NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
397748 |
1t1h   |
6265 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1t1h
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 1063
_Distance_constraint_stats_list.Viol_count 2254
_Distance_constraint_stats_list.Viol_total 3356.719
_Distance_constraint_stats_list.Viol_max 0.397
_Distance_constraint_stats_list.Viol_rms 0.0298
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0079
_Distance_constraint_stats_list.Viol_average_violations_only 0.0745
_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 SER 0.853 0.161 18 0 "[ . 1 . 2]"
1 3 PRO 0.905 0.161 18 0 "[ . 1 . 2]"
1 5 PHE 0.475 0.095 8 0 "[ . 1 . 2]"
1 7 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 TYR 6.582 0.359 3 0 "[ . 1 . 2]"
1 9 PHE 2.605 0.241 2 0 "[ . 1 . 2]"
1 10 ARG 4.777 0.250 20 0 "[ . 1 . 2]"
1 11 CYS 3.851 0.250 10 0 "[ . 1 . 2]"
1 12 PRO 3.812 0.262 9 0 "[ . 1 . 2]"
1 13 ILE 3.871 0.184 3 0 "[ . 1 . 2]"
1 14 SER 0.479 0.124 10 0 "[ . 1 . 2]"
1 15 LEU 7.142 0.242 20 0 "[ . 1 . 2]"
1 16 GLU 5.210 0.250 10 0 "[ . 1 . 2]"
1 17 LEU 5.671 0.210 12 0 "[ . 1 . 2]"
1 18 MET 5.462 0.250 20 0 "[ . 1 . 2]"
1 19 LYS 2.698 0.222 10 0 "[ . 1 . 2]"
1 20 ASP 3.053 0.260 12 0 "[ . 1 . 2]"
1 21 PRO 3.721 0.144 17 0 "[ . 1 . 2]"
1 22 VAL 1.334 0.103 11 0 "[ . 1 . 2]"
1 23 ILE 14.996 0.241 8 0 "[ . 1 . 2]"
1 24 VAL 5.012 0.219 6 0 "[ . 1 . 2]"
1 25 SER 2.923 0.290 8 0 "[ . 1 . 2]"
1 26 THR 3.399 0.151 13 0 "[ . 1 . 2]"
1 27 GLY 2.879 0.152 13 0 "[ . 1 . 2]"
1 28 GLN 10.222 0.257 6 0 "[ . 1 . 2]"
1 29 THR 8.544 0.258 1 0 "[ . 1 . 2]"
1 30 TYR 4.280 0.262 9 0 "[ . 1 . 2]"
1 31 GLU 0.689 0.156 7 0 "[ . 1 . 2]"
1 32 ARG 4.519 0.301 5 0 "[ . 1 . 2]"
1 33 SER 3.969 0.217 15 0 "[ . 1 . 2]"
1 34 SER 3.491 0.154 16 0 "[ . 1 . 2]"
1 35 ILE 11.608 0.301 5 0 "[ . 1 . 2]"
1 36 GLN 10.211 0.257 6 0 "[ . 1 . 2]"
1 37 LYS 8.137 0.217 15 0 "[ . 1 . 2]"
1 38 TRP 10.002 0.185 9 0 "[ . 1 . 2]"
1 39 LEU 9.012 0.246 1 0 "[ . 1 . 2]"
1 40 ASP 4.711 0.175 8 0 "[ . 1 . 2]"
1 41 ALA 2.404 0.119 3 0 "[ . 1 . 2]"
1 42 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 HIS 3.863 0.175 8 0 "[ . 1 . 2]"
1 44 LYS 2.014 0.177 15 0 "[ . 1 . 2]"
1 45 THR 2.745 0.183 20 0 "[ . 1 . 2]"
1 46 CYS 7.916 0.297 20 0 "[ . 1 . 2]"
1 47 PRO 1.688 0.184 3 0 "[ . 1 . 2]"
1 48 LYS 5.755 0.295 15 0 "[ . 1 . 2]"
1 49 SER 1.653 0.301 6 0 "[ . 1 . 2]"
1 50 GLN 5.786 0.301 6 0 "[ . 1 . 2]"
1 51 GLU 3.239 0.313 2 0 "[ . 1 . 2]"
1 52 THR 2.436 0.183 20 0 "[ . 1 . 2]"
1 53 LEU 10.949 0.313 2 0 "[ . 1 . 2]"
1 54 LEU 1.344 0.160 8 0 "[ . 1 . 2]"
1 55 HIS 0.289 0.059 12 0 "[ . 1 . 2]"
1 56 ALA 1.605 0.194 16 0 "[ . 1 . 2]"
1 57 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 LEU 6.114 0.290 8 0 "[ . 1 . 2]"
1 59 THR 4.643 0.219 6 0 "[ . 1 . 2]"
1 60 PRO 0.842 0.143 14 0 "[ . 1 . 2]"
1 61 ASN 5.404 0.241 8 0 "[ . 1 . 2]"
1 62 TYR 0.691 0.080 6 0 "[ . 1 . 2]"
1 63 VAL 6.644 0.359 3 0 "[ . 1 . 2]"
1 64 LEU 2.064 0.108 12 0 "[ . 1 . 2]"
1 65 LYS 12.268 0.397 1 0 "[ . 1 . 2]"
1 66 SER 0.652 0.098 2 0 "[ . 1 . 2]"
1 67 LEU 1.121 0.108 11 0 "[ . 1 . 2]"
1 68 ILE 6.213 0.241 2 0 "[ . 1 . 2]"
1 69 ALA 6.144 0.277 2 0 "[ . 1 . 2]"
1 70 LEU 5.053 0.182 19 0 "[ . 1 . 2]"
1 71 TRP 4.485 0.162 12 0 "[ . 1 . 2]"
1 72 CYS 7.439 0.279 15 0 "[ . 1 . 2]"
1 73 GLU 1.691 0.291 19 0 "[ . 1 . 2]"
1 74 SER 1.844 0.291 19 0 "[ . 1 . 2]"
1 75 ASN 0.209 0.065 19 0 "[ . 1 . 2]"
1 76 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 ILE 14.833 0.279 15 0 "[ . 1 . 2]"
1 78 GLU 4.258 0.220 18 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 SER HA 1 3 PRO QD 2.630 . 3.460 2.246 1.745 3.576 0.116 18 0 "[ . 1 . 2]" 1
2 1 2 SER HA 1 3 PRO QG 3.500 . 5.200 4.088 3.579 5.229 0.029 18 0 "[ . 1 . 2]" 1
3 1 2 SER QB 1 3 PRO QB 3.630 . 5.460 4.898 4.056 5.388 . 0 0 "[ . 1 . 2]" 1
4 1 2 SER QB 1 3 PRO QD 2.680 . 3.560 2.730 1.639 3.607 0.161 18 0 "[ . 1 . 2]" 1
5 1 3 PRO HA 1 71 TRP HZ2 3.650 . 5.500 4.545 3.197 5.535 0.035 18 0 "[ . 1 . 2]" 1
6 1 3 PRO QB 1 71 TRP HZ2 3.650 . 5.500 3.359 1.848 5.517 0.017 19 0 "[ . 1 . 2]" 1
7 1 5 PHE HA 1 5 PHE QD 3.370 . 4.940 2.898 2.234 3.732 . 0 0 "[ . 1 . 2]" 1
8 1 5 PHE QD 1 10 ARG QB 3.650 . 5.500 2.561 1.774 4.186 0.026 16 0 "[ . 1 . 2]" 1
9 1 5 PHE QD 1 15 LEU QD 3.650 . 5.500 4.537 2.524 5.418 . 0 0 "[ . 1 . 2]" 1
10 1 5 PHE QD 1 17 LEU QD 3.650 . 5.500 4.334 2.869 5.527 0.027 11 0 "[ . 1 . 2]" 1
11 1 5 PHE QE 1 10 ARG HA 3.650 . 5.500 4.816 3.238 5.595 0.095 8 0 "[ . 1 . 2]" 1
12 1 5 PHE QE 1 10 ARG QB 3.650 . 5.500 2.890 1.816 4.353 . 0 0 "[ . 1 . 2]" 1
13 1 5 PHE QE 1 10 ARG QG 3.650 . 5.500 3.460 1.993 4.796 . 0 0 "[ . 1 . 2]" 1
14 1 5 PHE QE 1 15 LEU QD 3.650 . 5.500 3.945 2.213 5.489 . 0 0 "[ . 1 . 2]" 1
15 1 5 PHE QE 1 17 LEU QD 3.650 . 5.500 4.087 2.053 5.549 0.049 3 0 "[ . 1 . 2]" 1
16 1 7 GLU HA 1 7 GLU QG 2.890 . 3.970 2.670 2.320 3.492 . 0 0 "[ . 1 . 2]" 1
17 1 8 TYR HA 1 8 TYR QD 3.150 . 4.500 3.418 2.534 3.781 . 0 0 "[ . 1 . 2]" 1
18 1 8 TYR HA 1 63 VAL QG 3.380 . 4.960 4.935 4.117 5.319 0.359 3 0 "[ . 1 . 2]" 1
19 1 8 TYR QB 1 9 PHE QD 3.600 . 5.400 4.236 1.879 5.035 . 0 0 "[ . 1 . 2]" 1
20 1 8 TYR QB 1 64 LEU QD 3.650 . 5.500 2.691 1.700 4.265 0.100 3 0 "[ . 1 . 2]" 1
21 1 8 TYR QB 1 67 LEU QD 3.440 . 5.080 3.488 1.989 5.188 0.108 11 0 "[ . 1 . 2]" 1
22 1 8 TYR QD 1 63 VAL QG 3.270 . 4.740 4.799 4.372 4.927 0.187 7 0 "[ . 1 . 2]" 1
23 1 8 TYR QD 1 64 LEU QD 3.200 . 4.600 3.412 2.386 4.243 . 0 0 "[ . 1 . 2]" 1
24 1 8 TYR QD 1 67 LEU HA 3.650 . 5.500 5.142 4.645 5.598 0.098 18 0 "[ . 1 . 2]" 1
25 1 8 TYR QD 1 67 LEU QD 3.350 . 4.900 2.610 1.778 3.713 0.022 6 0 "[ . 1 . 2]" 1
26 1 8 TYR QD 1 70 LEU QD 3.370 . 4.940 5.030 4.951 5.113 0.173 19 0 "[ . 1 . 2]" 1
27 1 8 TYR QE 1 67 LEU HA 3.650 . 5.500 5.009 4.424 5.512 0.012 5 0 "[ . 1 . 2]" 1
28 1 8 TYR QE 1 67 LEU QB 3.650 . 5.500 3.207 2.478 3.963 . 0 0 "[ . 1 . 2]" 1
29 1 8 TYR QE 1 67 LEU QD 3.650 . 5.500 2.529 2.031 3.403 . 0 0 "[ . 1 . 2]" 1
30 1 8 TYR QE 1 70 LEU QD 3.100 . 4.400 4.389 4.083 4.578 0.178 11 0 "[ . 1 . 2]" 1
31 1 9 PHE H 1 10 ARG HA 3.650 . 5.500 4.901 4.510 5.369 . 0 0 "[ . 1 . 2]" 1
32 1 9 PHE H 1 17 LEU QD 3.650 . 5.500 4.644 4.056 5.010 . 0 0 "[ . 1 . 2]" 1
33 1 9 PHE H 1 18 MET ME 3.650 . 5.500 4.087 3.100 4.946 . 0 0 "[ . 1 . 2]" 1
34 1 9 PHE H 1 64 LEU QD 3.650 . 5.500 3.650 3.246 4.074 . 0 0 "[ . 1 . 2]" 1
35 1 9 PHE H 1 68 ILE MG 3.650 . 5.500 4.206 3.615 4.708 . 0 0 "[ . 1 . 2]" 1
36 1 9 PHE HA 1 9 PHE QD 2.960 . 4.130 2.227 1.769 3.705 0.021 13 0 "[ . 1 . 2]" 1
37 1 9 PHE HA 1 9 PHE QE 3.650 . 5.500 4.385 4.068 5.627 0.127 16 0 "[ . 1 . 2]" 1
38 1 9 PHE HA 1 17 LEU QD 3.380 . 4.960 3.198 2.146 4.675 . 0 0 "[ . 1 . 2]" 1
39 1 9 PHE HA 1 18 MET ME 3.230 . 4.670 3.623 2.746 4.227 . 0 0 "[ . 1 . 2]" 1
40 1 9 PHE HA 1 64 LEU QD 3.560 . 5.330 3.407 1.943 4.211 . 0 0 "[ . 1 . 2]" 1
41 1 9 PHE HA 1 64 LEU HG 3.650 . 5.500 4.340 2.440 5.608 0.108 12 0 "[ . 1 . 2]" 1
42 1 9 PHE HA 1 68 ILE MG 3.650 . 5.500 2.114 1.740 2.856 0.060 1 0 "[ . 1 . 2]" 1
43 1 9 PHE QB 1 10 ARG H 3.650 . 5.500 2.393 1.873 4.041 . 0 0 "[ . 1 . 2]" 1
44 1 9 PHE QB 1 17 LEU HA 3.650 . 5.500 5.237 4.401 5.621 0.121 3 0 "[ . 1 . 2]" 1
45 1 9 PHE QB 1 17 LEU QD 3.410 . 5.020 2.454 1.808 3.541 . 0 0 "[ . 1 . 2]" 1
46 1 9 PHE QB 1 68 ILE MG 3.650 . 5.500 3.527 1.690 4.239 0.110 16 0 "[ . 1 . 2]" 1
47 1 9 PHE QD 1 17 LEU QD 3.650 . 5.500 2.932 1.907 3.794 . 0 0 "[ . 1 . 2]" 1
48 1 9 PHE QD 1 18 MET ME 3.500 . 5.200 5.081 4.582 5.305 0.105 13 0 "[ . 1 . 2]" 1
49 1 9 PHE QD 1 64 LEU QD 3.250 . 4.700 4.304 3.587 4.735 0.035 13 0 "[ . 1 . 2]" 1
50 1 9 PHE QD 1 67 LEU QD 3.420 . 5.040 4.348 2.662 4.784 . 0 0 "[ . 1 . 2]" 1
51 1 9 PHE QD 1 68 ILE MD 4.000 . 5.400 5.406 5.080 5.641 0.241 2 0 "[ . 1 . 2]" 1
52 1 9 PHE QD 1 68 ILE MG 3.650 . 5.500 2.799 2.270 3.514 . 0 0 "[ . 1 . 2]" 1
53 1 9 PHE QE 1 67 LEU QB 3.650 . 5.500 2.671 1.791 4.277 0.009 10 0 "[ . 1 . 2]" 1
54 1 9 PHE QE 1 67 LEU QD 3.350 . 4.900 3.426 2.359 4.129 . 0 0 "[ . 1 . 2]" 1
55 1 9 PHE QE 1 68 ILE HA 3.650 . 5.500 3.524 2.501 4.905 . 0 0 "[ . 1 . 2]" 1
56 1 9 PHE QE 1 70 LEU QD 3.360 . 4.920 2.639 2.274 4.043 . 0 0 "[ . 1 . 2]" 1
57 1 9 PHE QE 1 70 LEU HG 3.650 . 5.500 3.875 2.349 5.546 0.046 16 0 "[ . 1 . 2]" 1
58 1 9 PHE QE 1 71 TRP HA 3.650 . 5.500 4.958 4.332 5.461 . 0 0 "[ . 1 . 2]" 1
59 1 9 PHE QE 1 71 TRP QB 3.550 . 5.300 2.919 2.011 3.597 . 0 0 "[ . 1 . 2]" 1
60 1 9 PHE QE 1 71 TRP HD1 3.610 . 5.420 3.365 2.987 3.929 . 0 0 "[ . 1 . 2]" 1
61 1 9 PHE HZ 1 67 LEU QB 3.650 . 5.500 3.963 3.240 5.401 . 0 0 "[ . 1 . 2]" 1
62 1 9 PHE HZ 1 67 LEU QD 3.540 . 5.280 3.770 2.228 5.023 . 0 0 "[ . 1 . 2]" 1
63 1 9 PHE HZ 1 70 LEU QD 3.590 . 5.380 2.880 2.201 4.294 . 0 0 "[ . 1 . 2]" 1
64 1 9 PHE HZ 1 71 TRP QB 3.650 . 5.500 4.193 3.437 5.123 . 0 0 "[ . 1 . 2]" 1
65 1 10 ARG H 1 10 ARG QD 3.650 . 5.500 4.347 2.968 5.164 . 0 0 "[ . 1 . 2]" 1
66 1 10 ARG H 1 10 ARG QG 3.630 . 5.460 3.569 1.996 4.285 . 0 0 "[ . 1 . 2]" 1
67 1 10 ARG H 1 11 CYS HA 3.650 . 5.500 5.347 4.952 5.575 0.075 4 0 "[ . 1 . 2]" 1
68 1 10 ARG H 1 68 ILE MG 3.650 . 5.500 4.667 4.366 5.114 . 0 0 "[ . 1 . 2]" 1
69 1 10 ARG HA 1 10 ARG QD 3.650 . 5.500 3.576 1.788 4.491 0.012 4 0 "[ . 1 . 2]" 1
70 1 10 ARG HA 1 11 CYS QB 3.560 . 5.320 4.159 3.965 4.705 . 0 0 "[ . 1 . 2]" 1
71 1 10 ARG HA 1 15 LEU HA 3.540 . 5.290 4.607 4.004 5.245 . 0 0 "[ . 1 . 2]" 1
72 1 10 ARG HA 1 17 LEU HA 3.000 . 4.200 2.789 1.814 3.686 . 0 0 "[ . 1 . 2]" 1
73 1 10 ARG HA 1 17 LEU QB 3.530 . 5.260 3.638 2.487 4.323 . 0 0 "[ . 1 . 2]" 1
74 1 10 ARG HA 1 17 LEU QD 3.650 . 5.500 2.192 1.694 3.128 0.106 6 0 "[ . 1 . 2]" 1
75 1 10 ARG HA 1 18 MET ME 3.360 . 4.920 3.904 3.083 4.768 . 0 0 "[ . 1 . 2]" 1
76 1 10 ARG HA 1 18 MET QG 3.610 . 5.420 5.009 3.385 5.670 0.250 20 0 "[ . 1 . 2]" 1
77 1 10 ARG QB 1 11 CYS H 3.650 . 5.500 3.520 2.677 3.941 . 0 0 "[ . 1 . 2]" 1
78 1 10 ARG QB 1 15 LEU HA 3.430 . 5.060 4.396 2.294 5.243 0.183 16 0 "[ . 1 . 2]" 1
79 1 10 ARG QB 1 17 LEU QB 3.650 . 5.500 4.705 2.727 5.610 0.110 15 0 "[ . 1 . 2]" 1
80 1 10 ARG QD 1 11 CYS H 3.650 . 5.500 3.815 2.831 5.011 . 0 0 "[ . 1 . 2]" 1
81 1 10 ARG QD 1 15 LEU H 3.650 . 5.500 4.400 3.483 5.529 0.029 4 0 "[ . 1 . 2]" 1
82 1 10 ARG QD 1 15 LEU HA 3.400 . 5.000 3.113 2.429 3.574 . 0 0 "[ . 1 . 2]" 1
83 1 10 ARG QD 1 15 LEU QB 3.460 . 5.120 3.840 3.266 4.677 . 0 0 "[ . 1 . 2]" 1
84 1 10 ARG QD 1 15 LEU QD 3.650 . 5.500 2.541 1.839 3.642 . 0 0 "[ . 1 . 2]" 1
85 1 10 ARG QD 1 16 GLU H 3.650 . 5.500 5.334 4.455 5.747 0.247 13 0 "[ . 1 . 2]" 1
86 1 10 ARG QD 1 17 LEU QB 3.650 . 5.500 5.169 2.871 5.635 0.135 6 0 "[ . 1 . 2]" 1
87 1 10 ARG QG 1 11 CYS H 3.650 . 5.500 3.308 2.324 4.384 . 0 0 "[ . 1 . 2]" 1
88 1 10 ARG QG 1 15 LEU H 3.650 . 5.500 4.896 3.839 5.703 0.203 4 0 "[ . 1 . 2]" 1
89 1 10 ARG QG 1 15 LEU HA 3.170 . 4.540 3.342 2.410 4.334 . 0 0 "[ . 1 . 2]" 1
90 1 10 ARG QG 1 15 LEU QB 3.650 . 5.500 4.411 3.620 5.192 . 0 0 "[ . 1 . 2]" 1
91 1 10 ARG QG 1 15 LEU QD 2.840 . 3.880 2.453 1.803 3.690 . 0 0 "[ . 1 . 2]" 1
92 1 11 CYS H 1 15 LEU HA 3.650 . 5.500 3.704 2.927 4.552 . 0 0 "[ . 1 . 2]" 1
93 1 11 CYS H 1 15 LEU QD 3.650 . 5.500 4.016 3.018 4.940 . 0 0 "[ . 1 . 2]" 1
94 1 11 CYS H 1 16 GLU H 3.650 . 5.500 4.163 3.000 4.724 . 0 0 "[ . 1 . 2]" 1
95 1 11 CYS H 1 16 GLU QG 3.650 . 5.500 4.400 3.727 5.174 . 0 0 "[ . 1 . 2]" 1
96 1 11 CYS H 1 17 LEU H 3.650 . 5.500 2.968 2.113 4.895 . 0 0 "[ . 1 . 2]" 1
97 1 11 CYS H 1 17 LEU HA 3.650 . 5.500 2.331 1.753 3.603 0.047 13 0 "[ . 1 . 2]" 1
98 1 11 CYS H 1 18 MET ME 3.650 . 5.500 3.356 2.666 4.033 . 0 0 "[ . 1 . 2]" 1
99 1 11 CYS H 1 18 MET QG 3.650 . 5.500 4.150 3.086 5.186 . 0 0 "[ . 1 . 2]" 1
100 1 11 CYS HA 1 12 PRO QD 2.870 . 3.940 1.832 1.684 1.977 0.116 10 0 "[ . 1 . 2]" 1
101 1 11 CYS HA 1 12 PRO QG 3.650 . 5.500 3.732 3.577 3.899 . 0 0 "[ . 1 . 2]" 1
102 1 11 CYS HA 1 13 ILE H 3.650 . 5.500 3.693 3.530 3.823 . 0 0 "[ . 1 . 2]" 1
103 1 11 CYS HA 1 14 SER H 3.650 . 5.500 5.422 4.937 5.624 0.124 10 0 "[ . 1 . 2]" 1
104 1 11 CYS HA 1 15 LEU H 3.650 . 5.500 5.346 4.606 5.580 0.080 17 0 "[ . 1 . 2]" 1
105 1 11 CYS HA 1 16 GLU H 3.650 . 5.500 5.518 5.107 5.750 0.250 10 0 "[ . 1 . 2]" 1
106 1 11 CYS HA 1 16 GLU QG 3.650 . 5.500 5.308 4.830 5.723 0.223 11 0 "[ . 1 . 2]" 1
107 1 11 CYS HA 1 18 MET H 3.650 . 5.500 4.936 3.825 5.632 0.132 2 0 "[ . 1 . 2]" 1
108 1 11 CYS HA 1 18 MET ME 2.750 . 3.700 2.693 2.082 3.153 . 0 0 "[ . 1 . 2]" 1
109 1 11 CYS HA 1 18 MET QG 3.550 . 5.300 4.436 3.406 5.246 . 0 0 "[ . 1 . 2]" 1
110 1 11 CYS HA 1 30 TYR HA 3.440 . 5.080 4.300 3.914 4.840 . 0 0 "[ . 1 . 2]" 1
111 1 11 CYS QB 1 13 ILE H 3.650 . 5.500 3.243 2.299 3.507 . 0 0 "[ . 1 . 2]" 1
112 1 11 CYS QB 1 14 SER H 3.650 . 5.500 3.572 3.135 3.910 . 0 0 "[ . 1 . 2]" 1
113 1 11 CYS QB 1 15 LEU H 3.610 . 5.420 3.701 2.214 4.476 . 0 0 "[ . 1 . 2]" 1
114 1 11 CYS QB 1 16 GLU H 3.400 . 5.000 2.881 2.313 4.012 . 0 0 "[ . 1 . 2]" 1
115 1 11 CYS QB 1 16 GLU QG 3.580 . 5.370 2.682 2.052 3.422 . 0 0 "[ . 1 . 2]" 1
116 1 11 CYS QB 1 18 MET QG 3.450 . 5.100 2.996 1.633 4.155 0.167 2 0 "[ . 1 . 2]" 1
117 1 12 PRO HA 1 13 ILE QG 4.000 . 5.000 4.743 4.463 5.004 0.004 5 0 "[ . 1 . 2]" 1
118 1 12 PRO QB 1 13 ILE QG 3.340 . 4.880 3.922 2.882 4.704 . 0 0 "[ . 1 . 2]" 1
119 1 12 PRO QB 1 30 TYR QE 3.440 . 5.090 4.109 2.081 4.581 . 0 0 "[ . 1 . 2]" 1
120 1 12 PRO QB 1 48 LYS QD 3.570 . 5.340 5.222 4.305 5.451 0.111 17 0 "[ . 1 . 2]" 1
121 1 12 PRO QB 1 48 LYS QG 3.550 . 5.300 4.461 3.775 5.331 0.031 14 0 "[ . 1 . 2]" 1
122 1 12 PRO QD 1 30 TYR HA 3.020 . 4.240 4.285 3.677 4.502 0.262 9 0 "[ . 1 . 2]" 1
123 1 12 PRO QD 1 30 TYR QD 3.650 . 5.500 2.468 1.841 2.788 . 0 0 "[ . 1 . 2]" 1
124 1 12 PRO QD 1 30 TYR QE 3.650 . 5.500 2.297 1.774 2.849 0.026 16 0 "[ . 1 . 2]" 1
125 1 12 PRO QG 1 13 ILE QG 3.430 . 5.060 3.700 2.588 4.783 . 0 0 "[ . 1 . 2]" 1
126 1 12 PRO QG 1 30 TYR QE 3.600 . 5.400 2.537 1.842 3.168 . 0 0 "[ . 1 . 2]" 1
127 1 12 PRO QG 1 48 LYS QD 3.360 . 4.920 4.218 3.157 4.883 . 0 0 "[ . 1 . 2]" 1
128 1 13 ILE H 1 13 ILE MD 3.480 . 5.160 3.570 2.806 3.971 . 0 0 "[ . 1 . 2]" 1
129 1 13 ILE H 1 13 ILE QG 3.600 . 5.410 2.257 1.777 2.637 0.013 1 0 "[ . 1 . 2]" 1
130 1 13 ILE H 1 13 ILE MG 3.310 . 4.820 3.799 3.735 3.826 . 0 0 "[ . 1 . 2]" 1
131 1 13 ILE H 1 14 SER HA 3.510 . 5.220 4.949 4.780 5.084 . 0 0 "[ . 1 . 2]" 1
132 1 13 ILE HA 1 13 ILE MD 3.170 . 4.550 3.349 2.163 3.896 . 0 0 "[ . 1 . 2]" 1
133 1 13 ILE HA 1 13 ILE QG 2.940 . 4.080 2.582 2.308 3.128 . 0 0 "[ . 1 . 2]" 1
134 1 13 ILE HA 1 47 PRO QB 3.650 . 5.500 4.322 3.548 5.331 . 0 0 "[ . 1 . 2]" 1
135 1 13 ILE HB 1 14 SER H 3.330 . 4.860 2.343 2.091 2.752 . 0 0 "[ . 1 . 2]" 1
136 1 13 ILE HB 1 14 SER HA 3.650 . 5.500 4.667 4.366 4.807 . 0 0 "[ . 1 . 2]" 1
137 1 13 ILE HB 1 15 LEU H 3.650 . 5.500 4.235 3.843 4.563 . 0 0 "[ . 1 . 2]" 1
138 1 13 ILE HB 1 34 SER HA 4.000 . 5.000 5.010 4.784 5.125 0.125 5 0 "[ . 1 . 2]" 1
139 1 13 ILE HB 1 34 SER QB 3.100 . 4.410 2.676 2.420 2.908 . 0 0 "[ . 1 . 2]" 1
140 1 13 ILE MD 1 14 SER H 3.650 . 5.500 4.469 4.138 4.712 . 0 0 "[ . 1 . 2]" 1
141 1 13 ILE MD 1 30 TYR H 3.650 . 5.500 5.500 5.221 5.598 0.098 13 0 "[ . 1 . 2]" 1
142 1 13 ILE MD 1 30 TYR QD 3.650 . 5.500 3.021 2.248 3.573 . 0 0 "[ . 1 . 2]" 1
143 1 13 ILE MD 1 30 TYR QE 3.310 . 4.820 3.947 2.889 4.827 0.007 19 0 "[ . 1 . 2]" 1
144 1 13 ILE MD 1 34 SER H 4.000 . 5.400 4.749 4.043 5.504 0.104 13 0 "[ . 1 . 2]" 1
145 1 13 ILE MD 1 34 SER HA 3.500 . 5.200 4.147 3.677 4.911 . 0 0 "[ . 1 . 2]" 1
146 1 13 ILE MD 1 34 SER QB 3.070 . 4.340 2.311 1.918 3.000 . 0 0 "[ . 1 . 2]" 1
147 1 13 ILE MD 1 35 ILE HA 3.020 . 4.250 3.279 2.407 3.883 . 0 0 "[ . 1 . 2]" 1
148 1 13 ILE MD 1 35 ILE HB 3.270 . 4.740 3.321 2.380 3.969 . 0 0 "[ . 1 . 2]" 1
149 1 13 ILE MD 1 35 ILE MG 3.170 . 4.540 4.145 3.435 4.592 0.052 13 0 "[ . 1 . 2]" 1
150 1 13 ILE MD 1 47 PRO HA 3.650 . 5.500 5.530 5.034 5.684 0.184 3 0 "[ . 1 . 2]" 1
151 1 13 ILE MD 1 47 PRO QB 3.290 . 4.780 3.419 2.821 3.671 . 0 0 "[ . 1 . 2]" 1
152 1 13 ILE MD 1 47 PRO QD 3.130 . 4.460 3.755 3.225 4.251 . 0 0 "[ . 1 . 2]" 1
153 1 13 ILE MD 1 47 PRO QG 3.060 . 4.330 2.494 2.144 3.089 . 0 0 "[ . 1 . 2]" 1
154 1 13 ILE QG 1 14 SER H 3.650 . 5.500 3.855 3.469 4.052 . 0 0 "[ . 1 . 2]" 1
155 1 13 ILE QG 1 30 TYR QD 3.650 . 5.500 3.781 2.678 4.279 . 0 0 "[ . 1 . 2]" 1
156 1 13 ILE QG 1 30 TYR QE 3.500 . 5.200 4.402 3.607 5.135 . 0 0 "[ . 1 . 2]" 1
157 1 13 ILE QG 1 34 SER QB 3.550 . 5.300 3.115 1.801 3.782 . 0 0 "[ . 1 . 2]" 1
158 1 13 ILE MG 1 14 SER H 3.230 . 4.660 3.280 3.010 3.620 . 0 0 "[ . 1 . 2]" 1
159 1 13 ILE MG 1 34 SER H 3.610 . 5.420 5.116 4.656 5.438 0.018 11 0 "[ . 1 . 2]" 1
160 1 13 ILE MG 1 35 ILE H 3.650 . 5.500 4.924 4.335 5.527 0.027 11 0 "[ . 1 . 2]" 1
161 1 14 SER H 1 15 LEU QB 3.650 . 5.500 4.575 4.405 4.847 . 0 0 "[ . 1 . 2]" 1
162 1 14 SER H 1 16 GLU H 3.650 . 5.500 3.039 2.773 3.888 . 0 0 "[ . 1 . 2]" 1
163 1 14 SER HA 1 16 GLU H 3.650 . 5.500 4.676 4.447 5.573 0.073 9 0 "[ . 1 . 2]" 1
164 1 14 SER QB 1 15 LEU QB 3.400 . 5.000 4.360 4.197 4.587 . 0 0 "[ . 1 . 2]" 1
165 1 14 SER QB 1 16 GLU H 3.650 . 5.500 3.381 2.786 4.554 . 0 0 "[ . 1 . 2]" 1
166 1 14 SER QB 1 16 GLU QB 3.650 . 5.500 2.938 2.246 4.100 . 0 0 "[ . 1 . 2]" 1
167 1 14 SER QB 1 16 GLU QG 3.650 . 5.500 3.884 2.283 5.285 . 0 0 "[ . 1 . 2]" 1
168 1 15 LEU H 1 15 LEU QD 3.020 . 4.240 3.905 3.123 4.148 . 0 0 "[ . 1 . 2]" 1
169 1 15 LEU H 1 15 LEU HG 3.320 . 4.840 4.311 3.895 4.964 0.124 4 0 "[ . 1 . 2]" 1
170 1 15 LEU HA 1 15 LEU QD 2.670 . 3.540 2.233 1.820 2.733 . 0 0 "[ . 1 . 2]" 1
171 1 15 LEU HA 1 77 ILE QG 3.550 . 5.300 4.737 4.092 5.191 . 0 0 "[ . 1 . 2]" 1
172 1 15 LEU QB 1 16 GLU H 3.150 . 4.500 3.850 3.751 3.968 . 0 0 "[ . 1 . 2]" 1
173 1 15 LEU QB 1 77 ILE MD 3.200 . 4.600 3.899 3.475 4.434 . 0 0 "[ . 1 . 2]" 1
174 1 15 LEU QB 1 77 ILE QG 2.980 . 4.170 4.240 4.158 4.391 0.221 11 0 "[ . 1 . 2]" 1
175 1 15 LEU QD 1 16 GLU H 3.440 . 5.080 3.965 3.405 4.248 . 0 0 "[ . 1 . 2]" 1
176 1 15 LEU QD 1 17 LEU H 3.480 . 5.170 3.609 3.068 4.797 . 0 0 "[ . 1 . 2]" 1
177 1 15 LEU QD 1 71 TRP HE3 3.650 . 5.500 5.515 5.217 5.662 0.162 12 0 "[ . 1 . 2]" 1
178 1 15 LEU QD 1 71 TRP HH2 3.650 . 5.500 4.624 3.977 5.305 . 0 0 "[ . 1 . 2]" 1
179 1 15 LEU QD 1 77 ILE QG 2.650 . 3.500 2.766 2.432 3.350 . 0 0 "[ . 1 . 2]" 1
180 1 15 LEU QD 1 77 ILE MG 2.880 . 3.960 4.092 3.962 4.202 0.242 20 0 "[ . 1 . 2]" 1
181 1 16 GLU H 1 16 GLU QG 3.210 . 4.620 2.628 1.979 3.069 . 0 0 "[ . 1 . 2]" 1
182 1 16 GLU H 1 17 LEU HA 3.650 . 5.500 4.488 4.180 5.080 . 0 0 "[ . 1 . 2]" 1
183 1 16 GLU H 1 77 ILE QG 3.650 . 5.500 4.863 4.373 5.161 . 0 0 "[ . 1 . 2]" 1
184 1 16 GLU HA 1 16 GLU QG 2.910 . 4.020 3.460 3.328 3.490 . 0 0 "[ . 1 . 2]" 1
185 1 16 GLU QB 1 17 LEU H 3.640 . 5.480 3.575 2.589 3.775 . 0 0 "[ . 1 . 2]" 1
186 1 16 GLU QB 1 77 ILE MG 3.650 . 5.500 4.834 3.147 5.615 0.115 1 0 "[ . 1 . 2]" 1
187 1 16 GLU QB 1 78 GLU HA 2.710 . 3.610 3.249 2.611 3.799 0.189 20 0 "[ . 1 . 2]" 1
188 1 16 GLU QB 1 78 GLU QB 2.960 . 4.120 3.632 2.222 4.216 0.096 18 0 "[ . 1 . 2]" 1
189 1 16 GLU QB 1 78 GLU QG 2.280 . 2.760 2.466 1.741 2.858 0.098 2 0 "[ . 1 . 2]" 1
190 1 16 GLU QG 1 17 LEU H 3.650 . 5.500 2.847 2.231 4.330 . 0 0 "[ . 1 . 2]" 1
191 1 16 GLU QG 1 18 MET H 3.650 . 5.500 3.132 1.793 4.711 0.007 2 0 "[ . 1 . 2]" 1
192 1 16 GLU QG 1 18 MET QB 3.590 . 5.380 4.111 3.202 5.496 0.116 12 0 "[ . 1 . 2]" 1
193 1 16 GLU QG 1 18 MET QG 3.320 . 4.840 4.407 2.805 5.024 0.184 7 0 "[ . 1 . 2]" 1
194 1 17 LEU H 1 17 LEU QD 3.650 . 5.500 3.725 3.238 4.188 . 0 0 "[ . 1 . 2]" 1
195 1 17 LEU HA 1 17 LEU QD 3.080 . 4.360 2.344 1.779 3.037 0.021 12 0 "[ . 1 . 2]" 1
196 1 17 LEU QB 1 17 LEU QD 2.770 . 3.740 1.960 1.857 2.059 . 0 0 "[ . 1 . 2]" 1
197 1 17 LEU QB 1 18 MET ME 3.650 . 5.500 5.224 4.379 5.617 0.117 9 0 "[ . 1 . 2]" 1
198 1 17 LEU QB 1 77 ILE MD 2.500 . 3.200 2.640 1.771 3.347 0.147 3 0 "[ . 1 . 2]" 1
199 1 17 LEU QB 1 77 ILE QG 2.720 . 3.640 2.197 1.663 3.172 0.137 8 0 "[ . 1 . 2]" 1
200 1 17 LEU QB 1 77 ILE MG 3.320 . 4.840 1.834 1.650 2.281 0.150 14 0 "[ . 1 . 2]" 1
201 1 17 LEU QD 1 18 MET H 3.380 . 4.960 3.413 2.404 4.402 . 0 0 "[ . 1 . 2]" 1
202 1 17 LEU QD 1 18 MET ME 3.530 . 5.260 3.704 2.476 4.472 . 0 0 "[ . 1 . 2]" 1
203 1 17 LEU QD 1 68 ILE HA 3.560 . 5.330 2.542 1.819 3.389 . 0 0 "[ . 1 . 2]" 1
204 1 17 LEU QD 1 68 ILE QG 3.400 . 5.000 3.816 3.420 4.550 . 0 0 "[ . 1 . 2]" 1
205 1 17 LEU QD 1 68 ILE MG 2.910 . 4.020 2.589 1.782 3.679 0.018 20 0 "[ . 1 . 2]" 1
206 1 17 LEU QD 1 77 ILE QG 3.530 . 5.260 3.145 2.287 3.855 . 0 0 "[ . 1 . 2]" 1
207 1 17 LEU QD 1 77 ILE MG 3.060 . 4.330 2.334 1.717 3.191 0.073 18 0 "[ . 1 . 2]" 1
208 1 17 LEU HG 1 68 ILE MG 3.330 . 4.860 3.952 2.640 4.951 0.091 6 0 "[ . 1 . 2]" 1
209 1 17 LEU HG 1 77 ILE QG 3.280 . 4.760 4.369 2.797 4.970 0.210 12 0 "[ . 1 . 2]" 1
210 1 17 LEU HG 1 77 ILE MG 3.150 . 4.500 3.308 2.011 4.296 . 0 0 "[ . 1 . 2]" 1
211 1 18 MET H 1 18 MET ME 3.580 . 5.360 3.603 2.574 4.739 . 0 0 "[ . 1 . 2]" 1
212 1 18 MET H 1 18 MET QG 3.530 . 5.260 2.274 1.701 4.238 0.099 9 0 "[ . 1 . 2]" 1
213 1 18 MET H 1 68 ILE HB 3.650 . 5.500 4.604 3.151 5.458 . 0 0 "[ . 1 . 2]" 1
214 1 18 MET H 1 68 ILE MD 3.400 . 5.000 4.212 3.418 5.082 0.082 8 0 "[ . 1 . 2]" 1
215 1 18 MET H 1 68 ILE MG 3.620 . 5.450 4.211 3.182 5.434 . 0 0 "[ . 1 . 2]" 1
216 1 18 MET HA 1 18 MET QG 3.050 . 4.300 3.079 2.270 3.486 . 0 0 "[ . 1 . 2]" 1
217 1 18 MET HA 1 19 LYS QG 3.650 . 5.500 3.809 3.187 4.544 . 0 0 "[ . 1 . 2]" 1
218 1 18 MET HA 1 20 ASP H 3.340 . 4.880 4.046 3.673 4.858 . 0 0 "[ . 1 . 2]" 1
219 1 18 MET HA 1 21 PRO QB 3.540 . 5.290 5.105 4.785 5.393 0.103 8 0 "[ . 1 . 2]" 1
220 1 18 MET HA 1 31 GLU HA 3.290 . 4.780 4.034 3.345 4.709 . 0 0 "[ . 1 . 2]" 1
221 1 18 MET QB 1 18 MET ME 2.820 . 3.840 3.152 1.933 3.677 . 0 0 "[ . 1 . 2]" 1
222 1 18 MET QB 1 19 LYS H 3.650 . 5.500 2.761 2.027 3.642 . 0 0 "[ . 1 . 2]" 1
223 1 18 MET QB 1 20 ASP H 3.500 . 5.210 3.463 2.943 4.474 . 0 0 "[ . 1 . 2]" 1
224 1 18 MET QB 1 21 PRO HA 3.520 . 5.240 3.239 2.744 4.639 . 0 0 "[ . 1 . 2]" 1
225 1 18 MET QB 1 21 PRO QD 3.580 . 5.370 3.875 3.320 5.392 0.022 8 0 "[ . 1 . 2]" 1
226 1 18 MET QB 1 21 PRO QG 3.650 . 5.500 3.879 3.188 5.022 . 0 0 "[ . 1 . 2]" 1
227 1 18 MET QB 1 31 GLU H 3.650 . 5.500 3.044 2.058 4.787 . 0 0 "[ . 1 . 2]" 1
228 1 18 MET QB 1 31 GLU HA 3.650 . 5.500 2.784 1.901 4.132 . 0 0 "[ . 1 . 2]" 1
229 1 18 MET QB 1 68 ILE MD 3.230 . 4.670 2.365 1.772 3.478 0.018 17 0 "[ . 1 . 2]" 1
230 1 18 MET QB 1 68 ILE QG 3.650 . 5.500 4.288 3.552 5.202 . 0 0 "[ . 1 . 2]" 1
231 1 18 MET QB 1 68 ILE MG 3.480 . 5.170 3.406 2.008 4.132 . 0 0 "[ . 1 . 2]" 1
232 1 18 MET ME 1 18 MET QG 2.920 . 4.040 2.261 2.166 2.430 . 0 0 "[ . 1 . 2]" 1
233 1 18 MET ME 1 21 PRO QG 3.090 . 4.380 4.186 3.270 4.438 0.058 18 0 "[ . 1 . 2]" 1
234 1 18 MET ME 1 29 THR HA 3.650 . 5.500 5.380 5.085 5.596 0.096 16 0 "[ . 1 . 2]" 1
235 1 18 MET ME 1 29 THR HB 3.040 . 4.280 3.863 3.418 4.222 . 0 0 "[ . 1 . 2]" 1
236 1 18 MET ME 1 29 THR MG 4.000 . 5.500 3.923 3.389 4.286 . 0 0 "[ . 1 . 2]" 1
237 1 18 MET ME 1 30 TYR H 3.650 . 5.500 4.986 4.664 5.365 . 0 0 "[ . 1 . 2]" 1
238 1 18 MET ME 1 30 TYR HA 3.620 . 5.440 2.978 2.604 3.527 . 0 0 "[ . 1 . 2]" 1
239 1 18 MET ME 1 31 GLU H 3.650 . 5.500 4.222 3.883 4.508 . 0 0 "[ . 1 . 2]" 1
240 1 18 MET ME 1 68 ILE MD 2.830 . 3.870 3.273 2.853 3.730 . 0 0 "[ . 1 . 2]" 1
241 1 18 MET ME 1 68 ILE QG 3.540 . 5.290 4.745 4.306 5.134 . 0 0 "[ . 1 . 2]" 1
242 1 18 MET QG 1 19 LYS H 3.650 . 5.500 4.046 3.204 4.331 . 0 0 "[ . 1 . 2]" 1
243 1 18 MET QG 1 19 LYS QE 3.440 . 5.080 4.923 4.390 5.282 0.202 15 0 "[ . 1 . 2]" 1
244 1 18 MET QG 1 68 ILE MD 3.650 . 5.500 2.396 1.734 3.912 0.066 8 0 "[ . 1 . 2]" 1
245 1 19 LYS H 1 19 LYS QD 3.650 . 5.500 3.389 1.798 4.665 0.002 17 0 "[ . 1 . 2]" 1
246 1 19 LYS H 1 19 LYS QG 3.560 . 5.320 2.815 2.049 3.458 . 0 0 "[ . 1 . 2]" 1
247 1 19 LYS H 1 20 ASP HA 3.650 . 5.500 4.600 4.119 4.868 . 0 0 "[ . 1 . 2]" 1
248 1 19 LYS H 1 20 ASP QB 3.650 . 5.500 4.388 4.100 5.195 . 0 0 "[ . 1 . 2]" 1
249 1 19 LYS H 1 31 GLU HA 3.650 . 5.500 4.445 3.865 5.148 . 0 0 "[ . 1 . 2]" 1
250 1 19 LYS H 1 31 GLU QB 3.650 . 5.500 3.742 2.357 4.595 . 0 0 "[ . 1 . 2]" 1
251 1 19 LYS H 1 68 ILE MD 3.650 . 5.500 3.437 2.462 3.729 . 0 0 "[ . 1 . 2]" 1
252 1 19 LYS HA 1 19 LYS QD 3.170 . 4.540 3.235 1.827 4.300 . 0 0 "[ . 1 . 2]" 1
253 1 19 LYS HA 1 21 PRO QD 3.650 . 5.500 4.642 4.355 5.045 . 0 0 "[ . 1 . 2]" 1
254 1 19 LYS HA 1 68 ILE MD 4.000 . 5.400 2.945 2.754 3.191 . 0 0 "[ . 1 . 2]" 1
255 1 19 LYS HA 1 68 ILE MG 3.270 . 4.750 4.815 4.648 4.972 0.222 10 0 "[ . 1 . 2]" 1
256 1 19 LYS QB 1 19 LYS QE 3.410 . 5.020 3.116 1.758 3.833 0.042 8 0 "[ . 1 . 2]" 1
257 1 19 LYS QB 1 20 ASP H 3.080 . 4.370 2.418 1.752 2.774 0.038 1 0 "[ . 1 . 2]" 1
258 1 19 LYS QD 1 19 LYS QE 2.290 . 2.780 2.039 1.980 2.093 . 0 0 "[ . 1 . 2]" 1
259 1 19 LYS QD 1 20 ASP H 4.000 . 5.000 4.256 2.531 5.039 0.039 20 0 "[ . 1 . 2]" 1
260 1 19 LYS QD 1 78 GLU QG 3.340 . 4.880 4.363 3.510 4.965 0.085 17 0 "[ . 1 . 2]" 1
261 1 19 LYS QE 1 19 LYS QG 2.810 . 3.810 2.334 2.077 2.625 . 0 0 "[ . 1 . 2]" 1
262 1 19 LYS QE 1 68 ILE MD 3.460 . 5.130 4.607 3.753 5.235 0.105 11 0 "[ . 1 . 2]" 1
263 1 19 LYS QG 1 20 ASP H 3.510 . 5.220 3.946 3.200 4.459 . 0 0 "[ . 1 . 2]" 1
264 1 19 LYS QG 1 68 ILE MD 3.650 . 5.500 4.631 4.139 4.952 . 0 0 "[ . 1 . 2]" 1
265 1 19 LYS QG 1 78 GLU QG 3.550 . 5.300 4.668 3.357 5.386 0.086 5 0 "[ . 1 . 2]" 1
266 1 20 ASP H 1 31 GLU QB 3.650 . 5.500 4.744 2.225 5.615 0.115 17 0 "[ . 1 . 2]" 1
267 1 20 ASP H 1 65 LYS HA 3.650 . 5.500 5.619 5.488 5.760 0.260 12 0 "[ . 1 . 2]" 1
268 1 20 ASP H 1 65 LYS QE 3.620 . 5.450 5.137 4.389 5.650 0.200 1 0 "[ . 1 . 2]" 1
269 1 20 ASP H 1 68 ILE MD 3.650 . 5.500 3.641 3.279 4.129 . 0 0 "[ . 1 . 2]" 1
270 1 20 ASP HA 1 21 PRO QD 2.880 . 3.960 1.884 1.768 1.956 0.032 4 0 "[ . 1 . 2]" 1
271 1 20 ASP HA 1 65 LYS QD 3.530 . 5.260 4.066 2.830 4.877 . 0 0 "[ . 1 . 2]" 1
272 1 20 ASP HA 1 65 LYS QE 3.620 . 5.450 3.085 2.062 4.443 . 0 0 "[ . 1 . 2]" 1
273 1 20 ASP HA 1 65 LYS QG 3.380 . 4.960 2.999 1.942 4.678 . 0 0 "[ . 1 . 2]" 1
274 1 20 ASP QB 1 21 PRO QD 3.650 . 5.500 3.598 3.150 3.770 . 0 0 "[ . 1 . 2]" 1
275 1 21 PRO HA 1 22 VAL QG 3.650 . 5.500 3.298 3.168 3.688 . 0 0 "[ . 1 . 2]" 1
276 1 21 PRO HA 1 29 THR MG 3.120 . 4.450 3.888 3.354 4.321 . 0 0 "[ . 1 . 2]" 1
277 1 21 PRO HA 1 31 GLU HA 3.070 . 4.340 2.623 1.694 3.401 0.106 8 0 "[ . 1 . 2]" 1
278 1 21 PRO QB 1 29 THR MG 3.020 . 4.250 1.753 1.667 1.961 0.123 13 0 "[ . 1 . 2]" 1
279 1 21 PRO QB 1 31 GLU HA 3.460 . 5.130 3.793 3.089 4.619 . 0 0 "[ . 1 . 2]" 1
280 1 21 PRO QB 1 64 LEU HG 3.300 . 4.800 3.929 2.869 4.643 . 0 0 "[ . 1 . 2]" 1
281 1 21 PRO QB 1 68 ILE MD 3.650 . 5.500 2.672 2.254 3.265 . 0 0 "[ . 1 . 2]" 1
282 1 21 PRO QD 1 65 LYS HA 3.450 . 5.100 2.502 2.302 2.742 . 0 0 "[ . 1 . 2]" 1
283 1 21 PRO QD 1 65 LYS QB 3.520 . 5.240 2.192 1.778 2.593 0.022 11 0 "[ . 1 . 2]" 1
284 1 21 PRO QD 1 65 LYS QD 3.290 . 4.790 3.879 2.688 4.667 . 0 0 "[ . 1 . 2]" 1
285 1 21 PRO QD 1 68 ILE MD 3.650 . 5.500 1.849 1.710 2.053 0.090 4 0 "[ . 1 . 2]" 1
286 1 21 PRO QG 1 29 THR HB 3.310 . 4.820 4.794 3.638 4.964 0.144 17 0 "[ . 1 . 2]" 1
287 1 21 PRO QG 1 29 THR MG 3.160 . 4.520 2.760 1.967 3.030 . 0 0 "[ . 1 . 2]" 1
288 1 21 PRO QG 1 64 LEU QB 3.650 . 5.500 1.921 1.720 3.789 0.080 17 0 "[ . 1 . 2]" 1
289 1 21 PRO QG 1 64 LEU HG 3.320 . 4.840 3.141 1.798 3.839 0.002 12 0 "[ . 1 . 2]" 1
290 1 21 PRO QG 1 68 ILE MD 3.630 . 5.460 1.980 1.827 2.172 . 0 0 "[ . 1 . 2]" 1
291 1 22 VAL HA 1 22 VAL QG 2.850 . 3.900 2.242 2.180 2.301 . 0 0 "[ . 1 . 2]" 1
292 1 22 VAL HA 1 23 ILE HA 3.650 . 5.500 4.352 4.324 4.379 . 0 0 "[ . 1 . 2]" 1
293 1 22 VAL HA 1 23 ILE HB 3.650 . 5.500 4.188 4.001 4.341 . 0 0 "[ . 1 . 2]" 1
294 1 22 VAL HA 1 29 THR MG 3.560 . 5.330 3.783 3.424 4.280 . 0 0 "[ . 1 . 2]" 1
295 1 22 VAL HA 1 60 PRO HA 2.780 . 3.760 2.626 1.784 3.699 0.016 15 0 "[ . 1 . 2]" 1
296 1 22 VAL HA 1 61 ASN HA 3.650 . 5.500 5.397 4.904 5.603 0.103 11 0 "[ . 1 . 2]" 1
297 1 22 VAL HA 1 61 ASN QB 3.650 . 5.500 3.866 3.077 4.421 . 0 0 "[ . 1 . 2]" 1
298 1 22 VAL HB 1 23 ILE H 3.100 . 4.410 3.209 2.790 4.179 . 0 0 "[ . 1 . 2]" 1
299 1 22 VAL HB 1 58 LEU HA 3.520 . 5.240 4.132 3.439 5.320 0.080 7 0 "[ . 1 . 2]" 1
300 1 22 VAL HB 1 58 LEU QB 2.970 . 4.140 3.435 1.912 4.202 0.062 5 0 "[ . 1 . 2]" 1
301 1 22 VAL HB 1 59 THR H 3.450 . 5.100 3.720 3.136 5.087 . 0 0 "[ . 1 . 2]" 1
302 1 22 VAL HB 1 60 PRO HA 3.650 . 5.500 4.111 3.418 5.045 . 0 0 "[ . 1 . 2]" 1
303 1 22 VAL HB 1 61 ASN H 3.650 . 5.500 5.019 4.591 5.423 . 0 0 "[ . 1 . 2]" 1
304 1 22 VAL QG 1 23 ILE H 3.230 . 4.660 3.341 2.531 3.521 . 0 0 "[ . 1 . 2]" 1
305 1 22 VAL QG 1 30 TYR H 3.200 . 4.600 3.363 2.896 4.008 . 0 0 "[ . 1 . 2]" 1
306 1 22 VAL QG 1 30 TYR HA 3.650 . 5.500 5.042 4.683 5.518 0.018 8 0 "[ . 1 . 2]" 1
307 1 22 VAL QG 1 30 TYR QB 3.550 . 5.300 4.026 3.538 4.510 . 0 0 "[ . 1 . 2]" 1
308 1 22 VAL QG 1 31 GLU H 3.650 . 5.500 4.902 4.552 5.272 . 0 0 "[ . 1 . 2]" 1
309 1 22 VAL QG 1 31 GLU HA 3.650 . 5.500 3.735 3.179 4.314 . 0 0 "[ . 1 . 2]" 1
310 1 22 VAL QG 1 32 ARG H 3.190 . 4.580 3.123 2.623 3.487 . 0 0 "[ . 1 . 2]" 1
311 1 22 VAL QG 1 32 ARG HA 2.730 . 3.650 2.323 1.898 2.907 . 0 0 "[ . 1 . 2]" 1
312 1 22 VAL QG 1 32 ARG QB 3.010 . 4.220 2.531 1.791 3.526 0.009 15 0 "[ . 1 . 2]" 1
313 1 22 VAL QG 1 32 ARG QD 3.500 . 5.200 2.911 1.975 4.328 . 0 0 "[ . 1 . 2]" 1
314 1 22 VAL QG 1 32 ARG QG 3.130 . 4.460 2.354 1.793 3.556 0.007 12 0 "[ . 1 . 2]" 1
315 1 22 VAL QG 1 33 SER H 3.650 . 5.500 4.733 4.465 5.100 . 0 0 "[ . 1 . 2]" 1
316 1 22 VAL QG 1 34 SER H 3.580 . 5.360 5.110 4.772 5.363 0.003 18 0 "[ . 1 . 2]" 1
317 1 22 VAL QG 1 35 ILE H 3.340 . 4.880 4.403 4.188 4.571 . 0 0 "[ . 1 . 2]" 1
318 1 22 VAL QG 1 35 ILE QG 2.600 . 3.410 3.320 3.110 3.479 0.069 16 0 "[ . 1 . 2]" 1
319 1 22 VAL QG 1 35 ILE MG 2.480 . 3.150 2.035 1.846 2.196 . 0 0 "[ . 1 . 2]" 1
320 1 22 VAL QG 1 36 GLN QG 3.360 . 4.920 2.753 2.320 3.342 . 0 0 "[ . 1 . 2]" 1
321 1 22 VAL QG 1 58 LEU HA 3.420 . 5.040 4.071 2.446 4.582 . 0 0 "[ . 1 . 2]" 1
322 1 22 VAL QG 1 58 LEU QB 2.910 . 4.020 3.167 1.790 3.914 0.010 7 0 "[ . 1 . 2]" 1
323 1 22 VAL QG 1 60 PRO HA 2.770 . 3.740 2.879 2.378 3.458 . 0 0 "[ . 1 . 2]" 1
324 1 23 ILE H 1 23 ILE MD 3.390 . 4.980 4.335 4.181 4.487 . 0 0 "[ . 1 . 2]" 1
325 1 23 ILE H 1 23 ILE MG 2.900 . 4.000 2.858 2.249 3.453 . 0 0 "[ . 1 . 2]" 1
326 1 23 ILE H 1 29 THR HA 3.650 . 5.500 4.452 4.214 4.844 . 0 0 "[ . 1 . 2]" 1
327 1 23 ILE H 1 29 THR MG 3.650 . 5.500 3.467 3.100 4.038 . 0 0 "[ . 1 . 2]" 1
328 1 23 ILE H 1 59 THR HB 3.560 . 5.330 3.950 3.706 4.136 . 0 0 "[ . 1 . 2]" 1
329 1 23 ILE H 1 59 THR MG 3.440 . 5.080 4.115 3.815 4.489 . 0 0 "[ . 1 . 2]" 1
330 1 23 ILE H 1 60 PRO HA 3.400 . 5.000 3.258 2.557 4.055 . 0 0 "[ . 1 . 2]" 1
331 1 23 ILE H 1 61 ASN HA 3.440 . 5.080 4.708 4.262 5.116 0.036 2 0 "[ . 1 . 2]" 1
332 1 23 ILE H 1 61 ASN QB 3.580 . 5.370 3.099 2.574 3.419 . 0 0 "[ . 1 . 2]" 1
333 1 23 ILE HA 1 23 ILE MD 3.290 . 4.790 3.718 3.652 3.774 . 0 0 "[ . 1 . 2]" 1
334 1 23 ILE HA 1 24 VAL HA 3.650 . 5.500 4.432 4.393 4.471 . 0 0 "[ . 1 . 2]" 1
335 1 23 ILE HA 1 24 VAL QG 3.650 . 5.500 3.314 3.109 3.766 . 0 0 "[ . 1 . 2]" 1
336 1 23 ILE HA 1 28 GLN H 3.650 . 5.500 4.676 4.465 4.960 . 0 0 "[ . 1 . 2]" 1
337 1 23 ILE HA 1 29 THR HB 3.650 . 5.500 4.816 4.456 5.363 . 0 0 "[ . 1 . 2]" 1
338 1 23 ILE HA 1 29 THR MG 3.530 . 5.260 2.861 2.607 3.233 . 0 0 "[ . 1 . 2]" 1
339 1 23 ILE HA 1 30 TYR H 3.360 . 4.920 3.958 3.763 4.182 . 0 0 "[ . 1 . 2]" 1
340 1 23 ILE HB 1 23 ILE MD 2.900 . 4.000 2.417 2.309 2.557 . 0 0 "[ . 1 . 2]" 1
341 1 23 ILE HB 1 24 VAL H 3.460 . 5.120 4.224 4.082 4.323 . 0 0 "[ . 1 . 2]" 1
342 1 23 ILE HB 1 29 THR HA 3.420 . 5.040 4.406 3.776 4.987 . 0 0 "[ . 1 . 2]" 1
343 1 23 ILE HB 1 59 THR H 3.650 . 5.500 4.610 4.088 5.246 . 0 0 "[ . 1 . 2]" 1
344 1 23 ILE HB 1 59 THR HB 3.180 . 4.560 3.865 3.182 4.592 0.032 13 0 "[ . 1 . 2]" 1
345 1 23 ILE HB 1 61 ASN H 3.650 . 5.500 3.719 3.205 4.246 . 0 0 "[ . 1 . 2]" 1
346 1 23 ILE HB 1 61 ASN HA 3.430 . 5.060 3.804 3.321 4.179 . 0 0 "[ . 1 . 2]" 1
347 1 23 ILE HB 1 61 ASN QB 3.360 . 4.920 1.889 1.624 2.251 0.176 2 0 "[ . 1 . 2]" 1
348 1 23 ILE MD 1 23 ILE MG 2.540 . 3.270 1.873 1.807 1.929 0.003 15 0 "[ . 1 . 2]" 1
349 1 23 ILE MD 1 24 VAL H 3.560 . 5.330 4.210 3.908 4.514 . 0 0 "[ . 1 . 2]" 1
350 1 23 ILE MD 1 27 GLY H 3.590 . 5.380 5.129 4.550 5.501 0.121 5 0 "[ . 1 . 2]" 1
351 1 23 ILE MD 1 27 GLY QA 3.470 . 5.140 3.417 2.946 3.890 . 0 0 "[ . 1 . 2]" 1
352 1 23 ILE MD 1 28 GLN H 3.650 . 5.500 4.867 4.504 5.225 . 0 0 "[ . 1 . 2]" 1
353 1 23 ILE MD 1 28 GLN HA 4.000 . 5.400 5.464 5.387 5.532 0.132 7 0 "[ . 1 . 2]" 1
354 1 23 ILE MD 1 29 THR H 3.650 . 5.500 5.312 5.039 5.515 0.015 13 0 "[ . 1 . 2]" 1
355 1 23 ILE MD 1 29 THR HA 3.650 . 5.500 4.609 4.290 4.897 . 0 0 "[ . 1 . 2]" 1
356 1 23 ILE MD 1 29 THR HB 3.650 . 5.500 4.647 4.370 4.870 . 0 0 "[ . 1 . 2]" 1
357 1 23 ILE MD 1 29 THR MG 3.110 . 4.420 3.291 2.748 3.818 . 0 0 "[ . 1 . 2]" 1
358 1 23 ILE MD 1 59 THR HB 4.000 . 5.400 4.411 4.152 4.670 . 0 0 "[ . 1 . 2]" 1
359 1 23 ILE MD 1 59 THR MG 2.830 . 3.850 3.940 3.876 4.007 0.157 11 0 "[ . 1 . 2]" 1
360 1 23 ILE MD 1 61 ASN H 3.630 . 5.460 4.912 4.226 5.507 0.047 3 0 "[ . 1 . 2]" 1
361 1 23 ILE MD 1 61 ASN HA 2.730 . 3.660 3.796 3.599 3.901 0.241 8 0 "[ . 1 . 2]" 1
362 1 23 ILE MD 1 61 ASN QB 3.270 . 4.740 2.448 1.778 3.308 0.022 18 0 "[ . 1 . 2]" 1
363 1 23 ILE MD 1 62 TYR H 4.000 . 5.400 5.151 4.727 5.433 0.033 15 0 "[ . 1 . 2]" 1
364 1 23 ILE QG 1 24 VAL H 4.000 . 5.000 2.747 2.165 3.403 . 0 0 "[ . 1 . 2]" 1
365 1 23 ILE QG 1 27 GLY QA 3.650 . 5.500 3.544 2.897 4.545 . 0 0 "[ . 1 . 2]" 1
366 1 23 ILE QG 1 29 THR H 3.650 . 5.500 4.155 3.907 4.387 . 0 0 "[ . 1 . 2]" 1
367 1 23 ILE QG 1 29 THR HA 3.400 . 5.000 3.068 2.765 3.491 . 0 0 "[ . 1 . 2]" 1
368 1 23 ILE QG 1 30 TYR H 3.650 . 5.500 4.976 4.589 5.429 . 0 0 "[ . 1 . 2]" 1
369 1 23 ILE QG 1 59 THR HB 3.530 . 5.260 4.719 4.287 5.123 . 0 0 "[ . 1 . 2]" 1
370 1 23 ILE QG 1 61 ASN QB 3.420 . 5.040 2.830 2.014 3.647 . 0 0 "[ . 1 . 2]" 1
371 1 23 ILE MG 1 24 VAL H 3.270 . 4.740 2.889 2.407 3.441 . 0 0 "[ . 1 . 2]" 1
372 1 23 ILE MG 1 24 VAL HA 3.230 . 4.660 3.151 2.894 3.446 . 0 0 "[ . 1 . 2]" 1
373 1 23 ILE MG 1 24 VAL HB 4.000 . 5.500 4.967 4.595 5.396 . 0 0 "[ . 1 . 2]" 1
374 1 23 ILE MG 1 24 VAL QG 4.000 . 5.500 3.793 3.561 4.228 . 0 0 "[ . 1 . 2]" 1
375 1 23 ILE MG 1 25 SER H 3.650 . 5.500 4.794 4.422 5.248 . 0 0 "[ . 1 . 2]" 1
376 1 23 ILE MG 1 27 GLY H 4.000 . 5.500 4.865 3.939 5.594 0.094 8 0 "[ . 1 . 2]" 1
377 1 23 ILE MG 1 27 GLY QA 4.000 . 5.500 4.143 3.141 5.048 . 0 0 "[ . 1 . 2]" 1
378 1 23 ILE MG 1 28 GLN H 3.650 . 5.500 4.703 3.884 5.447 . 0 0 "[ . 1 . 2]" 1
379 1 23 ILE MG 1 28 GLN QB 4.000 . 5.500 5.632 5.554 5.687 0.187 4 0 "[ . 1 . 2]" 1
380 1 23 ILE MG 1 29 THR HA 3.330 . 4.860 4.800 4.543 4.921 0.061 8 0 "[ . 1 . 2]" 1
381 1 23 ILE MG 1 29 THR MG 2.880 . 3.960 4.053 3.898 4.138 0.178 4 0 "[ . 1 . 2]" 1
382 1 23 ILE MG 1 59 THR H 3.080 . 4.360 3.078 2.778 3.376 . 0 0 "[ . 1 . 2]" 1
383 1 23 ILE MG 1 59 THR HA 3.470 . 5.140 4.143 3.771 4.512 . 0 0 "[ . 1 . 2]" 1
384 1 23 ILE MG 1 59 THR HB 2.650 . 3.500 1.806 1.726 1.988 0.074 1 0 "[ . 1 . 2]" 1
385 1 23 ILE MG 1 59 THR MG 3.000 . 3.800 2.498 2.068 2.868 . 0 0 "[ . 1 . 2]" 1
386 1 23 ILE MG 1 60 PRO HA 3.500 . 5.210 4.802 3.914 5.353 0.143 14 0 "[ . 1 . 2]" 1
387 1 23 ILE MG 1 61 ASN H 3.650 . 5.500 4.497 3.599 5.320 . 0 0 "[ . 1 . 2]" 1
388 1 23 ILE MG 1 61 ASN HA 3.270 . 4.750 4.239 3.308 4.927 0.177 15 0 "[ . 1 . 2]" 1
389 1 23 ILE MG 1 61 ASN QB 3.330 . 4.860 3.165 2.345 3.554 . 0 0 "[ . 1 . 2]" 1
390 1 24 VAL H 1 24 VAL QG 3.020 . 4.250 2.493 2.218 2.771 . 0 0 "[ . 1 . 2]" 1
391 1 24 VAL H 1 29 THR HA 3.370 . 4.940 3.954 3.720 4.345 . 0 0 "[ . 1 . 2]" 1
392 1 24 VAL HA 1 24 VAL QG 2.710 . 3.610 2.201 2.108 2.382 . 0 0 "[ . 1 . 2]" 1
393 1 24 VAL HA 1 58 LEU QD 3.210 . 4.620 4.133 3.639 4.658 0.038 6 0 "[ . 1 . 2]" 1
394 1 24 VAL HA 1 59 THR MG 3.470 . 5.140 5.232 4.865 5.359 0.219 6 0 "[ . 1 . 2]" 1
395 1 24 VAL HB 1 25 SER H 3.390 . 4.980 2.884 1.999 3.800 . 0 0 "[ . 1 . 2]" 1
396 1 24 VAL HB 1 53 LEU QD 3.460 . 5.120 2.929 2.288 3.783 . 0 0 "[ . 1 . 2]" 1
397 1 24 VAL HB 1 58 LEU QD 3.630 . 5.460 4.208 2.531 4.713 . 0 0 "[ . 1 . 2]" 1
398 1 24 VAL QG 1 25 SER H 3.280 . 4.760 2.054 1.695 2.954 0.105 3 0 "[ . 1 . 2]" 1
399 1 24 VAL QG 1 27 GLY H 3.320 . 4.840 4.312 3.500 4.923 0.083 9 0 "[ . 1 . 2]" 1
400 1 24 VAL QG 1 28 GLN H 3.100 . 4.410 3.803 2.764 4.411 0.001 4 0 "[ . 1 . 2]" 1
401 1 24 VAL QG 1 28 GLN QB 3.080 . 4.370 3.267 1.713 4.440 0.077 10 0 "[ . 1 . 2]" 1
402 1 24 VAL QG 1 28 GLN QG 3.110 . 4.420 2.668 1.745 3.781 0.055 19 0 "[ . 1 . 2]" 1
403 1 24 VAL QG 1 29 THR HA 3.650 . 5.500 4.234 3.743 4.669 . 0 0 "[ . 1 . 2]" 1
404 1 24 VAL QG 1 30 TYR QD 3.370 . 4.940 4.658 4.239 5.009 0.069 10 0 "[ . 1 . 2]" 1
405 1 24 VAL QG 1 30 TYR QE 4.000 . 5.500 5.403 5.118 5.613 0.113 3 0 "[ . 1 . 2]" 1
406 1 24 VAL QG 1 35 ILE MD 3.010 . 4.220 3.231 2.689 3.777 . 0 0 "[ . 1 . 2]" 1
407 1 24 VAL QG 1 53 LEU QD 3.150 . 4.500 2.071 1.725 2.567 0.075 8 0 "[ . 1 . 2]" 1
408 1 24 VAL QG 1 58 LEU QD 2.450 . 3.100 2.033 1.702 2.891 0.098 20 0 "[ . 1 . 2]" 1
409 1 24 VAL QG 1 58 LEU HG 3.460 . 5.120 3.069 1.771 4.405 0.029 16 0 "[ . 1 . 2]" 1
410 1 24 VAL QG 1 59 THR H 3.610 . 5.420 3.261 3.018 4.154 . 0 0 "[ . 1 . 2]" 1
411 1 24 VAL QG 1 59 THR MG 4.000 . 5.500 5.342 5.238 5.650 0.150 10 0 "[ . 1 . 2]" 1
412 1 25 SER H 1 53 LEU QB 3.650 . 5.500 3.731 3.331 4.282 . 0 0 "[ . 1 . 2]" 1
413 1 25 SER H 1 53 LEU QD 3.650 . 5.500 4.000 3.663 4.502 . 0 0 "[ . 1 . 2]" 1
414 1 25 SER H 1 58 LEU HA 4.000 . 5.000 5.074 4.769 5.290 0.290 8 0 "[ . 1 . 2]" 1
415 1 25 SER H 1 58 LEU QD 3.650 . 5.500 5.332 4.575 5.538 0.038 17 0 "[ . 1 . 2]" 1
416 1 26 THR H 1 27 GLY QA 3.650 . 5.500 4.231 3.846 4.510 . 0 0 "[ . 1 . 2]" 1
417 1 26 THR H 1 53 LEU QB 3.650 . 5.500 5.199 4.893 5.535 0.035 8 0 "[ . 1 . 2]" 1
418 1 26 THR H 1 53 LEU QD 4.000 . 5.500 4.675 4.403 4.920 . 0 0 "[ . 1 . 2]" 1
419 1 26 THR HB 1 27 GLY H 3.520 . 5.250 3.063 2.452 3.567 . 0 0 "[ . 1 . 2]" 1
420 1 26 THR HG1 1 27 GLY H 4.000 . 5.000 4.332 4.058 4.719 . 0 0 "[ . 1 . 2]" 1
421 1 26 THR HG1 1 28 GLN H 4.000 . 5.000 5.060 5.002 5.151 0.151 13 0 "[ . 1 . 2]" 1
422 1 26 THR HG1 1 46 CYS H 4.000 . 5.000 5.015 4.726 5.072 0.072 13 0 "[ . 1 . 2]" 1
423 1 26 THR MG 1 27 GLY QA 3.170 . 4.550 4.002 3.431 4.304 . 0 0 "[ . 1 . 2]" 1
424 1 26 THR MG 1 28 GLN H 3.220 . 4.640 4.157 3.586 4.719 0.079 9 0 "[ . 1 . 2]" 1
425 1 26 THR MG 1 28 GLN QB 3.520 . 5.240 3.745 3.138 4.215 . 0 0 "[ . 1 . 2]" 1
426 1 26 THR MG 1 46 CYS H 3.520 . 5.240 4.133 3.798 4.539 . 0 0 "[ . 1 . 2]" 1
427 1 26 THR MG 1 46 CYS HA 3.330 . 4.870 4.924 4.662 5.016 0.146 17 0 "[ . 1 . 2]" 1
428 1 26 THR MG 1 46 CYS QB 2.770 . 3.730 2.850 2.439 3.507 . 0 0 "[ . 1 . 2]" 1
429 1 26 THR MG 1 51 GLU H 3.420 . 5.040 4.111 3.592 4.478 . 0 0 "[ . 1 . 2]" 1
430 1 26 THR MG 1 51 GLU HA 3.470 . 5.140 4.718 4.373 5.277 0.137 5 0 "[ . 1 . 2]" 1
431 1 26 THR MG 1 51 GLU QB 2.850 . 3.910 2.242 1.821 3.522 . 0 0 "[ . 1 . 2]" 1
432 1 26 THR MG 1 51 GLU QG 3.190 . 4.580 3.110 1.880 4.124 . 0 0 "[ . 1 . 2]" 1
433 1 26 THR MG 1 53 LEU HA 4.000 . 5.500 4.089 3.609 4.641 . 0 0 "[ . 1 . 2]" 1
434 1 26 THR MG 1 53 LEU QD 2.660 . 3.520 2.831 2.463 3.175 . 0 0 "[ . 1 . 2]" 1
435 1 27 GLY H 1 28 GLN H 3.210 . 4.620 2.195 1.807 2.545 . 0 0 "[ . 1 . 2]" 1
436 1 27 GLY H 1 53 LEU QB 3.650 . 5.500 5.590 5.429 5.652 0.152 13 0 "[ . 1 . 2]" 1
437 1 28 GLN H 1 28 GLN QG 3.340 . 4.880 2.990 1.880 4.070 . 0 0 "[ . 1 . 2]" 1
438 1 28 GLN H 1 29 THR HA 3.650 . 5.500 5.282 5.140 5.442 . 0 0 "[ . 1 . 2]" 1
439 1 28 GLN H 1 48 LYS QE 3.650 . 5.500 5.213 4.299 5.563 0.063 7 0 "[ . 1 . 2]" 1
440 1 28 GLN HA 1 48 LYS QD 3.650 . 5.500 4.578 3.166 5.364 . 0 0 "[ . 1 . 2]" 1
441 1 28 GLN QB 1 30 TYR QD 3.650 . 5.500 3.611 2.638 4.651 . 0 0 "[ . 1 . 2]" 1
442 1 28 GLN QB 1 30 TYR QE 3.270 . 4.750 2.925 1.792 4.225 . 0 0 "[ . 1 . 2]" 1
443 1 28 GLN QB 1 48 LYS QD 3.190 . 4.580 4.355 2.850 4.732 0.152 12 0 "[ . 1 . 2]" 1
444 1 28 GLN QB 1 48 LYS QE 3.540 . 5.280 3.222 2.316 4.127 . 0 0 "[ . 1 . 2]" 1
445 1 28 GLN QE 1 36 GLN QG 4.000 . 5.000 5.179 5.043 5.257 0.257 6 0 "[ . 1 . 2]" 1
446 1 28 GLN QE 1 39 LEU QD 4.000 . 5.500 2.781 1.876 3.736 . 0 0 "[ . 1 . 2]" 1
447 1 28 GLN QE 1 39 LEU HG 4.000 . 5.000 4.102 3.364 5.041 0.041 11 0 "[ . 1 . 2]" 1
448 1 28 GLN QG 1 29 THR H 3.650 . 5.500 3.427 2.485 4.302 . 0 0 "[ . 1 . 2]" 1
449 1 29 THR H 1 29 THR HG1 4.000 . 5.000 2.777 2.305 3.105 . 0 0 "[ . 1 . 2]" 1
450 1 29 THR H 1 29 THR MG 3.470 . 5.140 3.963 3.914 3.989 . 0 0 "[ . 1 . 2]" 1
451 1 29 THR HB 1 63 VAL QG 3.170 . 4.540 4.688 4.552 4.798 0.258 1 0 "[ . 1 . 2]" 1
452 1 29 THR HG1 1 30 TYR H 4.000 . 5.000 4.774 4.607 5.067 0.067 1 0 "[ . 1 . 2]" 1
453 1 29 THR MG 1 30 TYR H 2.960 . 4.130 3.266 3.025 3.378 . 0 0 "[ . 1 . 2]" 1
454 1 29 THR MG 1 61 ASN H 3.650 . 5.500 3.800 3.150 4.680 . 0 0 "[ . 1 . 2]" 1
455 1 29 THR MG 1 61 ASN HA 3.580 . 5.370 4.530 4.234 5.305 . 0 0 "[ . 1 . 2]" 1
456 1 29 THR MG 1 61 ASN QB 3.190 . 4.590 2.225 1.843 3.233 . 0 0 "[ . 1 . 2]" 1
457 1 29 THR MG 1 68 ILE MD 3.550 . 5.300 4.353 4.031 4.647 . 0 0 "[ . 1 . 2]" 1
458 1 29 THR MG 1 68 ILE MG 3.400 . 5.000 4.910 4.545 5.113 0.113 4 0 "[ . 1 . 2]" 1
459 1 30 TYR H 1 31 GLU HA 3.650 . 5.500 5.037 4.746 5.182 . 0 0 "[ . 1 . 2]" 1
460 1 30 TYR HA 1 30 TYR QD 3.380 . 4.960 2.261 2.012 2.467 . 0 0 "[ . 1 . 2]" 1
461 1 30 TYR HA 1 31 GLU HA 3.260 . 4.720 4.330 4.271 4.412 . 0 0 "[ . 1 . 2]" 1
462 1 30 TYR HA 1 35 ILE MG 3.420 . 5.040 4.860 4.419 5.143 0.103 7 0 "[ . 1 . 2]" 1
463 1 30 TYR QB 1 31 GLU H 3.650 . 5.500 2.188 2.039 2.402 . 0 0 "[ . 1 . 2]" 1
464 1 30 TYR QB 1 35 ILE H 3.650 . 5.500 3.945 3.434 4.589 . 0 0 "[ . 1 . 2]" 1
465 1 30 TYR QB 1 35 ILE HB 3.340 . 4.880 2.449 1.717 2.940 0.083 5 0 "[ . 1 . 2]" 1
466 1 30 TYR QB 1 35 ILE MG 3.050 . 4.300 2.917 2.447 3.277 . 0 0 "[ . 1 . 2]" 1
467 1 30 TYR QD 1 35 ILE MG 3.650 . 5.500 4.142 3.717 4.580 . 0 0 "[ . 1 . 2]" 1
468 1 30 TYR QE 1 35 ILE MD 3.550 . 5.300 4.303 3.223 5.192 . 0 0 "[ . 1 . 2]" 1
469 1 30 TYR QE 1 46 CYS HA 3.650 . 5.500 4.035 2.990 4.959 . 0 0 "[ . 1 . 2]" 1
470 1 30 TYR QE 1 47 PRO QB 3.650 . 5.500 4.466 4.078 5.090 . 0 0 "[ . 1 . 2]" 1
471 1 30 TYR QE 1 47 PRO QD 3.650 . 5.500 2.215 1.876 2.762 . 0 0 "[ . 1 . 2]" 1
472 1 30 TYR QE 1 47 PRO QG 3.620 . 5.440 2.754 2.229 3.482 . 0 0 "[ . 1 . 2]" 1
473 1 30 TYR QE 1 48 LYS QB 3.580 . 5.370 5.000 3.954 5.456 0.086 14 0 "[ . 1 . 2]" 1
474 1 31 GLU H 1 31 GLU QG 3.650 . 5.500 3.917 2.561 4.064 . 0 0 "[ . 1 . 2]" 1
475 1 31 GLU H 1 34 SER QB 3.650 . 5.500 3.505 2.868 4.568 . 0 0 "[ . 1 . 2]" 1
476 1 31 GLU HA 1 33 SER H 3.650 . 5.500 4.197 3.899 4.483 . 0 0 "[ . 1 . 2]" 1
477 1 31 GLU HA 1 34 SER H 3.580 . 5.360 4.599 4.409 4.970 . 0 0 "[ . 1 . 2]" 1
478 1 31 GLU HA 1 35 ILE H 3.650 . 5.500 5.159 4.965 5.448 . 0 0 "[ . 1 . 2]" 1
479 1 31 GLU HA 1 35 ILE MG 3.650 . 5.500 4.071 3.730 4.285 . 0 0 "[ . 1 . 2]" 1
480 1 31 GLU QB 1 34 SER H 3.650 . 5.500 3.190 2.516 4.221 . 0 0 "[ . 1 . 2]" 1
481 1 31 GLU QB 1 35 ILE MG 3.650 . 5.500 4.308 4.086 4.618 . 0 0 "[ . 1 . 2]" 1
482 1 31 GLU QG 1 32 ARG H 3.310 . 4.820 2.830 1.848 3.619 . 0 0 "[ . 1 . 2]" 1
483 1 31 GLU QG 1 33 SER H 3.290 . 4.780 2.363 1.785 3.970 0.015 17 0 "[ . 1 . 2]" 1
484 1 31 GLU QG 1 34 SER H 3.170 . 4.550 2.993 2.132 4.555 0.005 12 0 "[ . 1 . 2]" 1
485 1 31 GLU QG 1 35 ILE H 3.650 . 5.500 4.653 3.758 5.656 0.156 7 0 "[ . 1 . 2]" 1
486 1 32 ARG H 1 32 ARG QD 3.380 . 4.960 4.114 2.798 4.839 . 0 0 "[ . 1 . 2]" 1
487 1 32 ARG H 1 32 ARG QG 3.480 . 5.160 3.420 1.935 4.014 . 0 0 "[ . 1 . 2]" 1
488 1 32 ARG H 1 33 SER HA 3.650 . 5.500 5.329 5.222 5.514 0.014 5 0 "[ . 1 . 2]" 1
489 1 32 ARG HA 1 32 ARG QD 3.600 . 5.410 4.045 3.434 4.356 . 0 0 "[ . 1 . 2]" 1
490 1 32 ARG HA 1 34 SER H 3.650 . 5.500 3.861 3.685 4.040 . 0 0 "[ . 1 . 2]" 1
491 1 32 ARG HA 1 35 ILE H 3.650 . 5.500 3.350 3.032 3.500 . 0 0 "[ . 1 . 2]" 1
492 1 32 ARG HA 1 35 ILE MD 3.650 . 5.500 5.649 5.504 5.801 0.301 5 0 "[ . 1 . 2]" 1
493 1 32 ARG HA 1 35 ILE MG 2.810 . 3.820 1.993 1.848 2.186 . 0 0 "[ . 1 . 2]" 1
494 1 32 ARG HA 1 36 GLN H 3.650 . 5.500 2.993 2.447 3.494 . 0 0 "[ . 1 . 2]" 1
495 1 32 ARG HA 1 58 LEU QD 3.300 . 4.800 3.760 3.254 4.145 . 0 0 "[ . 1 . 2]" 1
496 1 32 ARG QB 1 33 SER H 3.470 . 5.140 2.664 2.367 3.468 . 0 0 "[ . 1 . 2]" 1
497 1 32 ARG QB 1 35 ILE H 3.650 . 5.500 4.937 4.548 5.097 . 0 0 "[ . 1 . 2]" 1
498 1 32 ARG QB 1 36 GLN H 3.650 . 5.500 4.467 3.724 5.082 . 0 0 "[ . 1 . 2]" 1
499 1 32 ARG QD 1 33 SER H 3.650 . 5.500 4.391 1.787 5.312 0.013 2 0 "[ . 1 . 2]" 1
500 1 32 ARG QG 1 33 SER H 3.650 . 5.500 3.794 3.013 4.289 . 0 0 "[ . 1 . 2]" 1
501 1 32 ARG QG 1 33 SER HA 3.650 . 5.500 4.239 3.074 5.672 0.172 17 0 "[ . 1 . 2]" 1
502 1 32 ARG QG 1 34 SER H 3.650 . 5.500 5.029 4.606 5.493 . 0 0 "[ . 1 . 2]" 1
503 1 32 ARG QG 1 35 ILE H 3.650 . 5.500 5.036 4.706 5.273 . 0 0 "[ . 1 . 2]" 1
504 1 32 ARG QG 1 36 GLN H 3.650 . 5.500 4.003 3.516 4.520 . 0 0 "[ . 1 . 2]" 1
505 1 32 ARG QG 1 36 GLN HA 3.650 . 5.500 5.237 4.544 5.687 0.187 18 0 "[ . 1 . 2]" 1
506 1 32 ARG QG 1 36 GLN QB 3.570 . 5.340 3.056 2.223 4.261 . 0 0 "[ . 1 . 2]" 1
507 1 33 SER H 1 34 SER HA 3.650 . 5.500 5.155 5.038 5.239 . 0 0 "[ . 1 . 2]" 1
508 1 33 SER H 1 37 LYS QB 3.650 . 5.500 5.616 5.525 5.717 0.217 15 0 "[ . 1 . 2]" 1
509 1 33 SER HA 1 36 GLN H 3.260 . 4.720 4.330 3.932 4.639 . 0 0 "[ . 1 . 2]" 1
510 1 33 SER HA 1 36 GLN QB 3.170 . 4.540 3.845 3.393 4.122 . 0 0 "[ . 1 . 2]" 1
511 1 33 SER HA 1 36 GLN QG 3.630 . 5.460 5.368 4.819 5.613 0.153 12 0 "[ . 1 . 2]" 1
512 1 33 SER QB 1 34 SER H 3.330 . 4.860 3.101 2.901 3.702 . 0 0 "[ . 1 . 2]" 1
513 1 34 SER H 1 35 ILE H 3.000 . 3.300 2.237 2.165 2.327 . 0 0 "[ . 1 . 2]" 1
514 1 34 SER H 1 35 ILE HB 4.000 . 5.000 4.948 4.830 5.056 0.056 6 0 "[ . 1 . 2]" 1
515 1 34 SER H 1 35 ILE MG 4.000 . 5.500 3.297 3.110 3.467 . 0 0 "[ . 1 . 2]" 1
516 1 34 SER H 1 36 GLN QB 3.380 . 4.960 5.027 4.932 5.079 0.119 5 0 "[ . 1 . 2]" 1
517 1 34 SER H 1 37 LYS QB 3.480 . 5.160 4.356 4.167 4.800 . 0 0 "[ . 1 . 2]" 1
518 1 34 SER H 1 37 LYS QD 3.650 . 5.500 5.051 3.988 5.540 0.040 6 0 "[ . 1 . 2]" 1
519 1 34 SER H 1 37 LYS QE 3.650 . 5.500 4.962 4.556 5.577 0.077 8 0 "[ . 1 . 2]" 1
520 1 34 SER HA 1 37 LYS H 3.460 . 5.120 4.264 3.907 4.628 . 0 0 "[ . 1 . 2]" 1
521 1 34 SER HA 1 37 LYS QB 3.090 . 4.380 3.084 2.536 3.996 . 0 0 "[ . 1 . 2]" 1
522 1 34 SER HA 1 37 LYS QD 3.480 . 5.160 2.700 1.949 3.356 . 0 0 "[ . 1 . 2]" 1
523 1 34 SER HA 1 37 LYS QE 3.650 . 5.500 2.754 2.223 3.669 . 0 0 "[ . 1 . 2]" 1
524 1 34 SER HA 1 38 TRP H 3.650 . 5.500 5.293 5.009 5.654 0.154 16 0 "[ . 1 . 2]" 1
525 1 34 SER QB 1 35 ILE H 3.570 . 5.340 2.682 2.346 3.445 . 0 0 "[ . 1 . 2]" 1
526 1 34 SER QB 1 35 ILE MG 3.650 . 5.500 3.650 3.287 4.517 . 0 0 "[ . 1 . 2]" 1
527 1 34 SER QB 1 36 GLN H 3.650 . 5.500 4.928 4.704 5.480 . 0 0 "[ . 1 . 2]" 1
528 1 35 ILE H 1 35 ILE MD 3.610 . 5.420 4.255 4.193 4.374 . 0 0 "[ . 1 . 2]" 1
529 1 35 ILE H 1 35 ILE QG 2.930 . 4.060 3.999 3.911 4.084 0.024 16 0 "[ . 1 . 2]" 1
530 1 35 ILE H 1 36 GLN H 3.000 . 3.300 2.525 2.256 2.722 . 0 0 "[ . 1 . 2]" 1
531 1 35 ILE H 1 36 GLN HA 3.650 . 5.500 5.141 4.888 5.289 . 0 0 "[ . 1 . 2]" 1
532 1 35 ILE H 1 36 GLN QB 3.550 . 5.300 4.441 3.976 4.666 . 0 0 "[ . 1 . 2]" 1
533 1 35 ILE H 1 37 LYS QD 3.650 . 5.500 4.862 3.684 5.319 . 0 0 "[ . 1 . 2]" 1
534 1 35 ILE H 1 58 LEU QD 3.650 . 5.500 5.417 5.056 5.671 0.171 8 0 "[ . 1 . 2]" 1
535 1 35 ILE HA 1 35 ILE MD 2.810 . 3.820 2.118 1.995 2.296 . 0 0 "[ . 1 . 2]" 1
536 1 35 ILE HA 1 36 GLN HA 3.440 . 5.080 4.686 4.622 4.780 . 0 0 "[ . 1 . 2]" 1
537 1 35 ILE HA 1 38 TRP H 3.090 . 4.380 3.733 3.609 3.965 . 0 0 "[ . 1 . 2]" 1
538 1 35 ILE HA 1 38 TRP QB 3.070 . 4.340 4.466 4.375 4.525 0.185 9 0 "[ . 1 . 2]" 1
539 1 35 ILE HA 1 39 LEU HG 3.500 . 5.200 3.950 3.796 4.174 . 0 0 "[ . 1 . 2]" 1
540 1 35 ILE HB 1 35 ILE MD 2.990 . 4.180 2.384 2.351 2.426 . 0 0 "[ . 1 . 2]" 1
541 1 35 ILE HB 1 36 GLN H 3.600 . 5.410 3.966 3.877 4.044 . 0 0 "[ . 1 . 2]" 1
542 1 35 ILE HB 1 39 LEU QD 3.440 . 5.080 4.321 4.226 4.471 . 0 0 "[ . 1 . 2]" 1
543 1 35 ILE MD 1 35 ILE MG 3.020 . 4.240 3.231 3.217 3.242 . 0 0 "[ . 1 . 2]" 1
544 1 35 ILE MD 1 36 GLN H 3.650 . 5.500 4.259 4.166 4.395 . 0 0 "[ . 1 . 2]" 1
545 1 35 ILE MD 1 37 LYS H 3.650 . 5.500 5.019 4.881 5.203 . 0 0 "[ . 1 . 2]" 1
546 1 35 ILE MD 1 38 TRP H 3.650 . 5.500 4.159 4.071 4.335 . 0 0 "[ . 1 . 2]" 1
547 1 35 ILE MD 1 38 TRP QB 3.160 . 4.520 4.490 4.383 4.560 0.040 18 0 "[ . 1 . 2]" 1
548 1 35 ILE MD 1 38 TRP HE1 3.440 . 5.080 3.653 3.531 3.797 . 0 0 "[ . 1 . 2]" 1
549 1 35 ILE MD 1 38 TRP HH2 3.120 . 4.440 2.674 2.574 2.768 . 0 0 "[ . 1 . 2]" 1
550 1 35 ILE MD 1 38 TRP HZ2 3.650 . 5.500 2.780 2.680 2.902 . 0 0 "[ . 1 . 2]" 1
551 1 35 ILE MD 1 39 LEU H 3.440 . 5.080 3.465 3.302 3.670 . 0 0 "[ . 1 . 2]" 1
552 1 35 ILE MD 1 39 LEU QB 3.460 . 5.130 3.624 3.500 3.761 . 0 0 "[ . 1 . 2]" 1
553 1 35 ILE MD 1 39 LEU QD 2.920 . 4.040 2.039 1.908 2.183 . 0 0 "[ . 1 . 2]" 1
554 1 35 ILE MD 1 39 LEU HG 3.300 . 4.800 1.995 1.878 2.172 . 0 0 "[ . 1 . 2]" 1
555 1 35 ILE MD 1 40 ASP H 3.650 . 5.500 5.574 5.502 5.636 0.136 15 0 "[ . 1 . 2]" 1
556 1 35 ILE MD 1 46 CYS HA 3.460 . 5.130 4.061 3.657 4.589 . 0 0 "[ . 1 . 2]" 1
557 1 35 ILE MD 1 47 PRO QD 3.080 . 4.360 3.253 2.565 3.901 . 0 0 "[ . 1 . 2]" 1
558 1 35 ILE MD 1 53 LEU QD 3.190 . 4.580 2.704 2.346 2.992 . 0 0 "[ . 1 . 2]" 1
559 1 35 ILE MD 1 58 LEU QD 3.420 . 5.040 4.173 3.731 4.516 . 0 0 "[ . 1 . 2]" 1
560 1 35 ILE QG 1 35 ILE MG 2.820 . 3.840 2.093 2.077 2.106 . 0 0 "[ . 1 . 2]" 1
561 1 35 ILE QG 1 36 GLN H 2.910 . 4.020 3.265 2.984 3.521 . 0 0 "[ . 1 . 2]" 1
562 1 35 ILE QG 1 37 LYS H 3.420 . 5.040 4.778 4.583 4.972 . 0 0 "[ . 1 . 2]" 1
563 1 35 ILE QG 1 38 TRP H 3.590 . 5.380 4.826 4.729 4.937 . 0 0 "[ . 1 . 2]" 1
564 1 35 ILE QG 1 38 TRP HE1 3.650 . 5.500 5.573 5.525 5.671 0.171 11 0 "[ . 1 . 2]" 1
565 1 35 ILE QG 1 39 LEU H 3.570 . 5.340 3.889 3.738 3.994 . 0 0 "[ . 1 . 2]" 1
566 1 35 ILE QG 1 39 LEU HG 3.630 . 5.460 2.298 2.073 2.591 . 0 0 "[ . 1 . 2]" 1
567 1 35 ILE QG 1 40 ASP H 3.650 . 5.500 5.471 5.231 5.559 0.059 10 0 "[ . 1 . 2]" 1
568 1 35 ILE QG 1 58 LEU QD 3.150 . 4.500 3.067 2.642 3.473 . 0 0 "[ . 1 . 2]" 1
569 1 35 ILE MG 1 36 GLN HA 3.470 . 5.140 3.479 3.256 3.728 . 0 0 "[ . 1 . 2]" 1
570 1 35 ILE MG 1 36 GLN QB 3.250 . 4.700 3.274 3.096 3.521 . 0 0 "[ . 1 . 2]" 1
571 1 35 ILE MG 1 58 LEU QD 2.710 . 3.620 2.854 2.487 3.162 . 0 0 "[ . 1 . 2]" 1
572 1 35 ILE MG 1 58 LEU HG 3.370 . 4.940 4.770 4.195 5.138 0.198 13 0 "[ . 1 . 2]" 1
573 1 36 GLN H 1 36 GLN QB 2.900 . 4.000 2.284 2.177 2.458 . 0 0 "[ . 1 . 2]" 1
574 1 36 GLN H 1 36 GLN QG 3.330 . 4.860 2.659 2.365 2.866 . 0 0 "[ . 1 . 2]" 1
575 1 36 GLN H 1 37 LYS QD 3.650 . 5.500 5.404 4.135 5.657 0.157 17 0 "[ . 1 . 2]" 1
576 1 36 GLN H 1 58 LEU QD 3.120 . 4.440 4.159 3.712 4.391 . 0 0 "[ . 1 . 2]" 1
577 1 36 GLN HA 1 38 TRP H 3.630 . 5.460 3.936 3.710 4.163 . 0 0 "[ . 1 . 2]" 1
578 1 36 GLN HA 1 39 LEU H 3.400 . 5.000 2.974 2.670 3.213 . 0 0 "[ . 1 . 2]" 1
579 1 36 GLN HA 1 39 LEU HA 3.630 . 5.460 4.692 4.436 4.992 . 0 0 "[ . 1 . 2]" 1
580 1 36 GLN HA 1 39 LEU QB 3.330 . 4.860 1.871 1.697 2.161 0.103 7 0 "[ . 1 . 2]" 1
581 1 36 GLN HA 1 39 LEU HG 3.650 . 5.500 3.431 2.979 3.821 . 0 0 "[ . 1 . 2]" 1
582 1 36 GLN HA 1 40 ASP H 3.400 . 5.000 3.073 2.709 3.528 . 0 0 "[ . 1 . 2]" 1
583 1 36 GLN HA 1 58 LEU QD 2.850 . 3.890 3.669 2.968 3.911 0.021 17 0 "[ . 1 . 2]" 1
584 1 36 GLN QB 1 36 GLN QE 3.650 . 5.500 2.545 1.683 2.733 0.117 6 0 "[ . 1 . 2]" 1
585 1 36 GLN QB 1 37 LYS H 3.130 . 4.460 2.958 2.719 3.100 . 0 0 "[ . 1 . 2]" 1
586 1 36 GLN QB 1 38 TRP H 3.650 . 5.500 4.822 4.682 4.922 . 0 0 "[ . 1 . 2]" 1
587 1 36 GLN QB 1 40 ASP H 3.650 . 5.000 3.916 3.698 4.308 . 0 0 "[ . 1 . 2]" 1
588 1 36 GLN QB 1 40 ASP HA 3.500 . 5.200 5.273 5.223 5.366 0.166 18 0 "[ . 1 . 2]" 1
589 1 36 GLN QB 1 40 ASP QB 3.180 . 4.560 3.404 2.892 3.934 . 0 0 "[ . 1 . 2]" 1
590 1 36 GLN QB 1 58 LEU QD 3.170 . 4.540 3.530 3.068 3.836 . 0 0 "[ . 1 . 2]" 1
591 1 36 GLN QE 1 40 ASP HA 3.650 . 5.500 5.006 4.043 5.586 0.086 13 0 "[ . 1 . 2]" 1
592 1 36 GLN QG 1 37 LYS H 3.460 . 5.120 4.323 4.020 4.516 . 0 0 "[ . 1 . 2]" 1
593 1 36 GLN QG 1 40 ASP H 3.650 . 5.500 4.850 4.193 5.476 . 0 0 "[ . 1 . 2]" 1
594 1 36 GLN QG 1 58 LEU QB 3.650 . 5.500 4.115 3.709 4.641 . 0 0 "[ . 1 . 2]" 1
595 1 36 GLN QG 1 58 LEU QD 3.470 . 5.140 1.994 1.796 2.328 0.004 14 0 "[ . 1 . 2]" 1
596 1 37 LYS H 1 37 LYS QB 2.570 . 3.340 2.054 1.975 2.335 . 0 0 "[ . 1 . 2]" 1
597 1 37 LYS H 1 37 LYS QD 2.870 . 3.940 3.774 2.438 4.051 0.111 13 0 "[ . 1 . 2]" 1
598 1 37 LYS H 1 37 LYS QE 3.650 . 5.500 4.383 4.149 4.990 . 0 0 "[ . 1 . 2]" 1
599 1 37 LYS H 1 37 LYS QG 3.210 . 4.620 3.689 2.359 3.938 . 0 0 "[ . 1 . 2]" 1
600 1 37 LYS H 1 38 TRP HA 3.650 . 5.500 5.309 5.151 5.383 . 0 0 "[ . 1 . 2]" 1
601 1 37 LYS H 1 38 TRP QB 3.650 . 5.500 4.844 4.538 4.979 . 0 0 "[ . 1 . 2]" 1
602 1 37 LYS H 1 40 ASP QB 3.650 . 5.500 4.881 4.485 5.126 . 0 0 "[ . 1 . 2]" 1
603 1 37 LYS HA 1 37 LYS QD 3.490 . 5.180 4.298 3.769 4.490 . 0 0 "[ . 1 . 2]" 1
604 1 37 LYS HA 1 37 LYS QE 3.650 . 5.500 4.491 4.182 5.366 . 0 0 "[ . 1 . 2]" 1
605 1 37 LYS HA 1 39 LEU H 3.650 . 5.500 4.874 4.671 4.999 . 0 0 "[ . 1 . 2]" 1
606 1 37 LYS HA 1 40 ASP H 3.070 . 4.340 4.285 3.732 4.488 0.148 14 0 "[ . 1 . 2]" 1
607 1 37 LYS HA 1 40 ASP QB 2.930 . 4.060 3.596 2.595 4.011 . 0 0 "[ . 1 . 2]" 1
608 1 37 LYS HA 1 41 ALA H 3.440 . 5.080 5.021 4.653 5.145 0.065 1 0 "[ . 1 . 2]" 1
609 1 37 LYS QB 1 37 LYS QD 2.670 . 3.540 2.129 2.007 2.266 . 0 0 "[ . 1 . 2]" 1
610 1 37 LYS QB 1 37 LYS QE 3.330 . 4.860 2.382 2.031 3.823 . 0 0 "[ . 1 . 2]" 1
611 1 37 LYS QB 1 38 TRP H 2.840 . 3.880 2.942 2.702 3.563 . 0 0 "[ . 1 . 2]" 1
612 1 37 LYS QB 1 38 TRP HA 3.560 . 5.320 4.660 4.469 4.804 . 0 0 "[ . 1 . 2]" 1
613 1 37 LYS QD 1 38 TRP H 3.420 . 5.040 3.353 1.950 3.779 . 0 0 "[ . 1 . 2]" 1
614 1 37 LYS QD 1 38 TRP QB 4.000 . 5.000 3.136 2.113 3.708 . 0 0 "[ . 1 . 2]" 1
615 1 37 LYS QD 1 39 LEU H 3.650 . 5.500 5.335 4.010 5.646 0.146 12 0 "[ . 1 . 2]" 1
616 1 37 LYS QE 1 37 LYS QG 2.710 . 3.610 2.386 2.195 2.716 . 0 0 "[ . 1 . 2]" 1
617 1 37 LYS QE 1 38 TRP H 3.650 . 5.500 4.786 3.486 5.111 . 0 0 "[ . 1 . 2]" 1
618 1 37 LYS QG 1 38 TRP H 3.480 . 5.170 2.821 1.898 3.578 . 0 0 "[ . 1 . 2]" 1
619 1 37 LYS QG 1 41 ALA H 3.550 . 5.300 5.326 5.139 5.404 0.104 10 0 "[ . 1 . 2]" 1
620 1 38 TRP H 1 38 TRP QB 2.910 . 4.020 2.459 2.413 2.480 . 0 0 "[ . 1 . 2]" 1
621 1 38 TRP H 1 39 LEU QD 3.370 . 4.940 4.637 4.518 4.764 . 0 0 "[ . 1 . 2]" 1
622 1 38 TRP H 1 40 ASP QB 3.650 . 5.500 4.907 4.207 5.194 . 0 0 "[ . 1 . 2]" 1
623 1 38 TRP H 1 41 ALA MB 3.560 . 5.320 4.663 4.254 5.158 . 0 0 "[ . 1 . 2]" 1
624 1 38 TRP HA 1 38 TRP HD1 3.170 . 4.540 3.855 3.797 3.911 . 0 0 "[ . 1 . 2]" 1
625 1 38 TRP HA 1 38 TRP HE3 4.000 . 5.000 4.911 4.869 4.994 . 0 0 "[ . 1 . 2]" 1
626 1 38 TRP HA 1 41 ALA H 3.440 . 5.090 3.069 2.923 3.203 . 0 0 "[ . 1 . 2]" 1
627 1 38 TRP HA 1 41 ALA MB 3.030 . 4.260 2.375 1.980 2.835 . 0 0 "[ . 1 . 2]" 1
628 1 38 TRP HA 1 42 GLY H 3.650 . 5.500 4.792 4.098 5.229 . 0 0 "[ . 1 . 2]" 1
629 1 38 TRP QB 1 38 TRP HE3 3.490 . 5.180 2.349 2.325 2.374 . 0 0 "[ . 1 . 2]" 1
630 1 38 TRP QB 1 39 LEU H 3.250 . 4.710 3.546 3.500 3.624 . 0 0 "[ . 1 . 2]" 1
631 1 38 TRP QB 1 39 LEU QD 3.650 . 5.500 4.643 4.448 4.829 . 0 0 "[ . 1 . 2]" 1
632 1 38 TRP QB 1 39 LEU HG 3.650 . 5.500 5.167 4.977 5.279 . 0 0 "[ . 1 . 2]" 1
633 1 38 TRP QB 1 40 ASP H 3.650 . 5.500 5.174 4.809 5.353 . 0 0 "[ . 1 . 2]" 1
634 1 38 TRP HD1 1 41 ALA MB 2.850 . 3.910 3.947 3.816 4.029 0.119 3 0 "[ . 1 . 2]" 1
635 1 38 TRP HD1 1 43 HIS QB 3.050 . 4.300 1.731 1.669 1.782 0.131 17 0 "[ . 1 . 2]" 1
636 1 38 TRP HE1 1 39 LEU QD 3.450 . 5.100 2.588 2.375 2.864 . 0 0 "[ . 1 . 2]" 1
637 1 38 TRP HE1 1 39 LEU HG 3.650 . 5.500 4.091 3.888 4.393 . 0 0 "[ . 1 . 2]" 1
638 1 38 TRP HE1 1 43 HIS HA 3.650 . 5.500 5.300 4.979 5.548 0.048 14 0 "[ . 1 . 2]" 1
639 1 38 TRP HE1 1 43 HIS QB 3.390 . 4.980 3.019 2.419 3.344 . 0 0 "[ . 1 . 2]" 1
640 1 38 TRP HE1 1 45 THR HB 3.650 . 5.500 5.028 4.172 5.529 0.029 6 0 "[ . 1 . 2]" 1
641 1 38 TRP HE1 1 53 LEU QD 3.500 . 5.200 3.776 3.085 4.443 . 0 0 "[ . 1 . 2]" 1
642 1 38 TRP HE3 1 39 LEU HG 3.650 . 5.500 5.400 5.248 5.521 0.021 2 0 "[ . 1 . 2]" 1
643 1 38 TRP HH2 1 39 LEU QD 4.000 . 5.500 4.927 4.704 5.154 . 0 0 "[ . 1 . 2]" 1
644 1 38 TRP HH2 1 39 LEU HG 3.650 . 5.500 5.581 5.522 5.652 0.152 7 0 "[ . 1 . 2]" 1
645 1 38 TRP HH2 1 47 PRO QD 3.650 . 5.500 1.986 1.749 2.318 0.051 18 0 "[ . 1 . 2]" 1
646 1 38 TRP HH2 1 53 LEU QD 3.650 . 5.500 4.652 3.924 5.221 . 0 0 "[ . 1 . 2]" 1
647 1 38 TRP HZ2 1 43 HIS QB 3.620 . 5.440 5.409 4.888 5.571 0.131 5 0 "[ . 1 . 2]" 1
648 1 38 TRP HZ2 1 45 THR HB 3.560 . 5.320 5.181 4.059 5.490 0.170 11 0 "[ . 1 . 2]" 1
649 1 38 TRP HZ2 1 47 PRO HA 3.650 . 5.500 4.440 3.531 5.538 0.038 17 0 "[ . 1 . 2]" 1
650 1 38 TRP HZ2 1 47 PRO QB 3.600 . 5.400 4.036 3.229 5.438 0.038 17 0 "[ . 1 . 2]" 1
651 1 39 LEU H 1 39 LEU QD 2.920 . 4.040 3.142 3.036 3.239 . 0 0 "[ . 1 . 2]" 1
652 1 39 LEU H 1 39 LEU HG 2.800 . 3.800 2.636 2.509 2.770 . 0 0 "[ . 1 . 2]" 1
653 1 39 LEU H 1 40 ASP HA 3.650 . 5.500 5.325 5.165 5.424 . 0 0 "[ . 1 . 2]" 1
654 1 39 LEU H 1 40 ASP QB 3.650 . 5.500 4.535 4.171 4.799 . 0 0 "[ . 1 . 2]" 1
655 1 39 LEU H 1 41 ALA MB 3.650 . 5.500 4.600 4.342 4.995 . 0 0 "[ . 1 . 2]" 1
656 1 39 LEU H 1 53 LEU QD 3.650 . 5.500 5.606 5.507 5.743 0.243 2 0 "[ . 1 . 2]" 1
657 1 39 LEU H 1 58 LEU QD 3.650 . 5.500 5.511 4.863 5.746 0.246 1 0 "[ . 1 . 2]" 1
658 1 39 LEU HA 1 39 LEU QD 2.640 . 3.480 1.818 1.771 1.902 0.029 2 0 "[ . 1 . 2]" 1
659 1 39 LEU HA 1 53 LEU QD 3.650 . 5.500 4.725 4.551 4.940 . 0 0 "[ . 1 . 2]" 1
660 1 39 LEU HA 1 56 ALA MB 3.320 . 4.840 4.858 4.501 5.034 0.194 16 0 "[ . 1 . 2]" 1
661 1 39 LEU QB 1 40 ASP H 3.170 . 4.550 2.578 2.441 2.770 . 0 0 "[ . 1 . 2]" 1
662 1 39 LEU QB 1 58 LEU QD 3.600 . 5.410 3.525 2.741 3.997 . 0 0 "[ . 1 . 2]" 1
663 1 39 LEU QD 1 40 ASP H 3.110 . 4.420 4.109 4.044 4.182 . 0 0 "[ . 1 . 2]" 1
664 1 39 LEU QD 1 40 ASP HA 4.000 . 5.500 4.997 4.868 5.232 . 0 0 "[ . 1 . 2]" 1
665 1 39 LEU QD 1 41 ALA H 3.640 . 5.480 5.015 4.884 5.179 . 0 0 "[ . 1 . 2]" 1
666 1 39 LEU QD 1 41 ALA MB 3.480 . 5.160 5.131 4.915 5.235 0.075 7 0 "[ . 1 . 2]" 1
667 1 39 LEU QD 1 42 GLY H 3.650 . 5.500 4.648 4.423 4.847 . 0 0 "[ . 1 . 2]" 1
668 1 39 LEU QD 1 43 HIS H 3.380 . 4.960 3.776 3.292 4.297 . 0 0 "[ . 1 . 2]" 1
669 1 39 LEU QD 1 53 LEU QD 3.000 . 3.800 1.863 1.753 2.135 0.047 13 0 "[ . 1 . 2]" 1
670 1 39 LEU QD 1 56 ALA HA 3.030 . 4.260 3.831 3.440 4.152 . 0 0 "[ . 1 . 2]" 1
671 1 39 LEU QD 1 56 ALA MB 2.710 . 3.620 2.547 1.876 3.260 . 0 0 "[ . 1 . 2]" 1
672 1 39 LEU HG 1 40 ASP H 4.000 . 5.000 4.583 4.430 4.752 . 0 0 "[ . 1 . 2]" 1
673 1 39 LEU HG 1 58 LEU QD 3.330 . 4.870 4.419 3.713 4.839 . 0 0 "[ . 1 . 2]" 1
674 1 40 ASP H 1 40 ASP QB 2.850 . 3.910 2.256 2.089 2.388 . 0 0 "[ . 1 . 2]" 1
675 1 40 ASP H 1 41 ALA MB 3.300 . 4.800 4.230 4.062 4.374 . 0 0 "[ . 1 . 2]" 1
676 1 40 ASP HA 1 42 GLY H 3.440 . 5.080 3.769 3.432 4.463 . 0 0 "[ . 1 . 2]" 1
677 1 40 ASP HA 1 43 HIS H 3.650 . 5.500 5.349 4.543 5.675 0.175 8 0 "[ . 1 . 2]" 1
678 1 40 ASP QB 1 41 ALA H 3.150 . 4.500 2.962 2.534 3.313 . 0 0 "[ . 1 . 2]" 1
679 1 40 ASP QB 1 42 GLY H 3.650 . 5.500 4.688 4.429 5.111 . 0 0 "[ . 1 . 2]" 1
680 1 41 ALA H 1 41 ALA MB 2.580 . 3.360 2.243 2.228 2.272 . 0 0 "[ . 1 . 2]" 1
681 1 41 ALA H 1 42 GLY QA 3.550 . 5.300 4.488 4.253 4.638 . 0 0 "[ . 1 . 2]" 1
682 1 41 ALA H 1 43 HIS HD2 4.000 . 5.000 4.542 3.816 5.043 0.043 7 0 "[ . 1 . 2]" 1
683 1 41 ALA MB 1 42 GLY H 3.030 . 4.260 2.886 2.412 3.165 . 0 0 "[ . 1 . 2]" 1
684 1 42 GLY H 1 43 HIS QB 3.650 . 5.500 4.194 3.662 4.428 . 0 0 "[ . 1 . 2]" 1
685 1 43 HIS H 1 43 HIS QB 2.840 . 3.880 2.564 2.376 2.822 . 0 0 "[ . 1 . 2]" 1
686 1 43 HIS HA 1 44 LYS QD 3.360 . 4.920 4.616 2.593 5.029 0.109 3 0 "[ . 1 . 2]" 1
687 1 43 HIS QB 1 45 THR H 3.250 . 4.700 3.438 2.838 3.925 . 0 0 "[ . 1 . 2]" 1
688 1 44 LYS HA 1 44 LYS QD 3.090 . 4.380 4.074 2.075 4.511 0.131 16 0 "[ . 1 . 2]" 1
689 1 44 LYS HA 1 44 LYS QE 3.640 . 5.480 5.008 3.507 5.657 0.177 15 0 "[ . 1 . 2]" 1
690 1 44 LYS HA 1 45 THR MG 3.650 . 5.500 4.523 4.278 5.635 0.135 3 0 "[ . 1 . 2]" 1
691 1 44 LYS HA 1 52 THR MG 3.650 . 5.500 5.127 4.489 5.532 0.032 7 0 "[ . 1 . 2]" 1
692 1 44 LYS HA 1 53 LEU QD 3.050 . 4.300 2.766 2.283 3.274 . 0 0 "[ . 1 . 2]" 1
693 1 44 LYS QB 1 44 LYS QE 3.620 . 5.450 3.065 1.866 3.641 . 0 0 "[ . 1 . 2]" 1
694 1 44 LYS QB 1 45 THR MG 3.560 . 5.330 4.338 3.265 5.299 . 0 0 "[ . 1 . 2]" 1
695 1 44 LYS QB 1 52 THR HA 3.650 . 5.500 4.524 3.647 4.822 . 0 0 "[ . 1 . 2]" 1
696 1 44 LYS QB 1 52 THR MG 3.090 . 4.380 3.606 2.396 4.249 . 0 0 "[ . 1 . 2]" 1
697 1 44 LYS QB 1 53 LEU QD 3.590 . 5.380 3.394 2.557 4.290 . 0 0 "[ . 1 . 2]" 1
698 1 44 LYS QD 1 44 LYS QE 2.310 . 2.820 2.069 2.000 2.092 . 0 0 "[ . 1 . 2]" 1
699 1 44 LYS QD 1 45 THR MG 3.650 . 5.500 5.065 3.950 5.578 0.078 3 0 "[ . 1 . 2]" 1
700 1 44 LYS QD 1 52 THR MG 3.120 . 4.450 3.835 3.057 4.470 0.020 1 0 "[ . 1 . 2]" 1
701 1 44 LYS QE 1 44 LYS QG 2.650 . 3.500 2.220 2.122 2.327 . 0 0 "[ . 1 . 2]" 1
702 1 44 LYS QE 1 52 THR MG 3.440 . 5.080 3.507 2.386 4.917 . 0 0 "[ . 1 . 2]" 1
703 1 44 LYS QG 1 45 THR MG 3.110 . 4.420 3.484 2.803 4.432 0.012 20 0 "[ . 1 . 2]" 1
704 1 44 LYS QG 1 52 THR MG 3.040 . 4.290 2.625 2.127 3.223 . 0 0 "[ . 1 . 2]" 1
705 1 44 LYS QG 1 54 LEU QD 3.340 . 4.880 4.686 4.028 4.925 0.045 16 0 "[ . 1 . 2]" 1
706 1 45 THR H 1 45 THR MG 2.980 . 4.160 3.357 3.194 3.956 . 0 0 "[ . 1 . 2]" 1
707 1 45 THR H 1 52 THR HA 3.600 . 5.400 4.606 4.454 4.723 . 0 0 "[ . 1 . 2]" 1
708 1 45 THR H 1 52 THR MG 3.650 . 5.500 5.228 4.976 5.534 0.034 11 0 "[ . 1 . 2]" 1
709 1 45 THR H 1 53 LEU QD 3.240 . 4.680 3.133 2.795 3.530 . 0 0 "[ . 1 . 2]" 1
710 1 45 THR H 1 53 LEU HG 3.570 . 5.340 3.147 2.838 3.519 . 0 0 "[ . 1 . 2]" 1
711 1 45 THR HA 1 46 CYS HA 3.620 . 5.440 4.399 4.356 4.435 . 0 0 "[ . 1 . 2]" 1
712 1 45 THR HA 1 52 THR HA 2.670 . 3.540 2.125 1.791 2.331 0.009 7 0 "[ . 1 . 2]" 1
713 1 45 THR HA 1 52 THR HB 4.000 . 5.000 5.058 4.725 5.183 0.183 20 0 "[ . 1 . 2]" 1
714 1 45 THR HA 1 52 THR MG 3.220 . 4.640 3.850 3.576 4.137 . 0 0 "[ . 1 . 2]" 1
715 1 45 THR HA 1 53 LEU QD 3.510 . 5.220 2.937 2.693 3.253 . 0 0 "[ . 1 . 2]" 1
716 1 45 THR HA 1 53 LEU HG 3.140 . 4.480 2.433 2.192 2.748 . 0 0 "[ . 1 . 2]" 1
717 1 45 THR HB 1 46 CYS H 3.270 . 4.740 3.002 2.626 3.762 . 0 0 "[ . 1 . 2]" 1
718 1 45 THR HB 1 46 CYS HA 3.650 . 5.500 4.696 4.506 5.014 . 0 0 "[ . 1 . 2]" 1
719 1 45 THR HB 1 50 GLN QB 3.650 . 5.500 3.371 2.493 4.560 . 0 0 "[ . 1 . 2]" 1
720 1 45 THR HB 1 50 GLN QG 3.650 . 5.500 3.173 1.913 4.412 . 0 0 "[ . 1 . 2]" 1
721 1 45 THR HB 1 53 LEU H 3.650 . 5.500 4.886 4.508 5.210 . 0 0 "[ . 1 . 2]" 1
722 1 45 THR HB 1 53 LEU QD 3.520 . 5.250 4.406 4.164 4.565 . 0 0 "[ . 1 . 2]" 1
723 1 45 THR MG 1 50 GLN HA 3.160 . 4.520 3.273 1.748 3.809 0.052 3 0 "[ . 1 . 2]" 1
724 1 45 THR MG 1 50 GLN QB 3.490 . 5.180 3.042 2.340 4.020 . 0 0 "[ . 1 . 2]" 1
725 1 45 THR MG 1 50 GLN QE 3.650 . 5.500 3.645 1.732 5.520 0.068 18 0 "[ . 1 . 2]" 1
726 1 45 THR MG 1 51 GLU H 3.630 . 5.460 4.383 3.206 4.915 . 0 0 "[ . 1 . 2]" 1
727 1 45 THR MG 1 51 GLU HA 3.500 . 5.200 4.679 3.738 5.230 0.030 7 0 "[ . 1 . 2]" 1
728 1 45 THR MG 1 52 THR HA 2.850 . 3.910 1.971 1.794 2.305 0.006 10 0 "[ . 1 . 2]" 1
729 1 45 THR MG 1 52 THR HB 3.440 . 5.080 4.053 3.896 4.293 . 0 0 "[ . 1 . 2]" 1
730 1 45 THR MG 1 52 THR MG 2.620 . 3.440 2.818 2.365 3.453 0.013 9 0 "[ . 1 . 2]" 1
731 1 45 THR MG 1 53 LEU QD 4.000 . 5.500 4.083 3.602 4.375 . 0 0 "[ . 1 . 2]" 1
732 1 45 THR MG 1 53 LEU HG 4.000 . 5.500 4.122 3.950 4.310 . 0 0 "[ . 1 . 2]" 1
733 1 46 CYS H 1 48 LYS QE 4.000 . 5.000 5.096 4.823 5.229 0.229 20 0 "[ . 1 . 2]" 1
734 1 46 CYS H 1 49 SER H 3.650 . 5.500 5.085 4.586 5.430 . 0 0 "[ . 1 . 2]" 1
735 1 46 CYS H 1 50 GLN QG 4.000 . 5.000 4.989 4.339 5.297 0.297 20 0 "[ . 1 . 2]" 1
736 1 46 CYS H 1 51 GLU QB 3.650 . 5.500 3.782 3.180 5.390 . 0 0 "[ . 1 . 2]" 1
737 1 46 CYS H 1 53 LEU HA 4.000 . 5.000 5.020 4.768 5.144 0.144 13 0 "[ . 1 . 2]" 1
738 1 46 CYS H 1 53 LEU QD 3.190 . 4.590 2.429 1.967 2.793 . 0 0 "[ . 1 . 2]" 1
739 1 46 CYS H 1 53 LEU HG 3.600 . 5.400 3.336 2.864 3.821 . 0 0 "[ . 1 . 2]" 1
740 1 46 CYS HA 1 47 PRO QD 2.910 . 4.020 2.024 1.804 2.183 . 0 0 "[ . 1 . 2]" 1
741 1 46 CYS HA 1 47 PRO QG 3.520 . 5.240 3.938 3.610 4.132 . 0 0 "[ . 1 . 2]" 1
742 1 46 CYS HA 1 48 LYS QE 3.510 . 5.220 4.400 3.596 5.230 0.010 4 0 "[ . 1 . 2]" 1
743 1 46 CYS HA 1 53 LEU QD 3.150 . 4.500 2.502 2.161 2.726 . 0 0 "[ . 1 . 2]" 1
744 1 46 CYS QB 1 47 PRO QD 3.650 . 5.500 2.586 2.033 3.559 . 0 0 "[ . 1 . 2]" 1
745 1 46 CYS QB 1 48 LYS QD 3.640 . 5.480 3.637 2.240 4.440 . 0 0 "[ . 1 . 2]" 1
746 1 46 CYS QB 1 48 LYS QE 3.300 . 4.800 2.313 1.726 2.877 0.074 7 0 "[ . 1 . 2]" 1
747 1 46 CYS QB 1 50 GLN H 4.000 . 5.000 3.619 2.776 4.558 . 0 0 "[ . 1 . 2]" 1
748 1 46 CYS QB 1 53 LEU H 3.650 . 5.500 5.299 4.875 5.584 0.084 18 0 "[ . 1 . 2]" 1
749 1 46 CYS QB 1 53 LEU HA 3.650 . 5.500 5.315 4.742 5.666 0.166 15 0 "[ . 1 . 2]" 1
750 1 46 CYS QB 1 53 LEU QD 2.710 . 3.620 2.434 1.744 3.138 0.056 5 0 "[ . 1 . 2]" 1
751 1 47 PRO HA 1 48 LYS HA 3.460 . 5.120 4.702 4.601 4.856 . 0 0 "[ . 1 . 2]" 1
752 1 47 PRO QD 1 53 LEU QD 3.650 . 5.500 3.556 2.947 3.910 . 0 0 "[ . 1 . 2]" 1
753 1 48 LYS H 1 48 LYS QB 2.870 . 3.930 2.531 2.266 2.951 . 0 0 "[ . 1 . 2]" 1
754 1 48 LYS H 1 48 LYS QD 3.600 . 5.400 3.577 1.772 4.337 0.028 7 0 "[ . 1 . 2]" 1
755 1 48 LYS H 1 48 LYS QE 3.650 . 5.500 3.281 2.480 3.767 . 0 0 "[ . 1 . 2]" 1
756 1 48 LYS H 1 48 LYS QG 3.180 . 4.560 2.380 1.722 3.609 0.078 15 0 "[ . 1 . 2]" 1
757 1 48 LYS H 1 49 SER HA 3.620 . 5.440 5.037 4.921 5.344 . 0 0 "[ . 1 . 2]" 1
758 1 48 LYS H 1 49 SER QB 3.650 . 5.500 5.151 4.554 5.488 . 0 0 "[ . 1 . 2]" 1
759 1 48 LYS H 1 50 GLN H 3.400 . 5.000 3.263 2.895 3.658 . 0 0 "[ . 1 . 2]" 1
760 1 48 LYS H 1 50 GLN HA 3.530 . 5.260 4.760 4.315 5.302 0.042 7 0 "[ . 1 . 2]" 1
761 1 48 LYS HA 1 48 LYS QD 3.380 . 4.960 3.908 2.937 4.197 . 0 0 "[ . 1 . 2]" 1
762 1 48 LYS HA 1 48 LYS QE 3.300 . 4.800 4.556 4.063 5.095 0.295 15 0 "[ . 1 . 2]" 1
763 1 48 LYS HA 1 50 GLN H 3.650 . 5.500 4.696 4.359 5.054 . 0 0 "[ . 1 . 2]" 1
764 1 48 LYS QB 1 48 LYS QE 2.630 . 3.460 2.265 1.748 3.656 0.196 7 0 "[ . 1 . 2]" 1
765 1 48 LYS QB 1 49 SER H 3.230 . 4.660 2.400 1.900 3.826 . 0 0 "[ . 1 . 2]" 1
766 1 48 LYS QB 1 49 SER HA 3.650 . 5.500 4.235 3.876 4.764 . 0 0 "[ . 1 . 2]" 1
767 1 48 LYS QB 1 50 GLN H 3.650 . 5.500 4.019 3.558 5.302 . 0 0 "[ . 1 . 2]" 1
768 1 48 LYS QD 1 49 SER H 3.650 . 5.500 4.374 3.458 5.049 . 0 0 "[ . 1 . 2]" 1
769 1 48 LYS QE 1 48 LYS QG 2.810 . 3.810 2.382 2.061 2.824 . 0 0 "[ . 1 . 2]" 1
770 1 48 LYS QE 1 49 SER H 3.650 . 5.500 3.575 2.943 4.066 . 0 0 "[ . 1 . 2]" 1
771 1 48 LYS QE 1 51 GLU H 3.570 . 5.340 4.657 3.933 5.350 0.010 18 0 "[ . 1 . 2]" 1
772 1 48 LYS QE 1 51 GLU QB 3.350 . 4.910 4.273 3.110 4.936 0.026 5 0 "[ . 1 . 2]" 1
773 1 49 SER H 1 50 GLN H 2.990 . 4.180 1.901 1.605 2.199 0.195 6 0 "[ . 1 . 2]" 1
774 1 49 SER H 1 50 GLN QG 4.000 . 5.000 4.761 3.442 5.301 0.301 6 0 "[ . 1 . 2]" 1
775 1 49 SER QB 1 50 GLN H 3.650 . 5.500 3.601 2.838 3.969 . 0 0 "[ . 1 . 2]" 1
776 1 49 SER QB 1 51 GLU H 3.650 . 5.500 3.704 2.744 5.092 . 0 0 "[ . 1 . 2]" 1
777 1 49 SER QB 1 51 GLU QG 3.220 . 4.640 2.588 1.772 4.547 0.028 6 0 "[ . 1 . 2]" 1
778 1 50 GLN H 1 50 GLN QG 3.230 . 4.660 3.157 2.494 3.937 . 0 0 "[ . 1 . 2]" 1
779 1 50 GLN H 1 51 GLU QB 3.650 . 5.500 4.765 4.262 5.119 . 0 0 "[ . 1 . 2]" 1
780 1 50 GLN H 1 53 LEU QD 4.000 . 5.500 5.506 4.867 5.702 0.202 20 0 "[ . 1 . 2]" 1
781 1 50 GLN HA 1 50 GLN QE 3.650 . 5.500 2.747 1.719 3.937 0.081 9 0 "[ . 1 . 2]" 1
782 1 50 GLN HA 1 50 GLN QG 2.850 . 3.910 2.402 1.965 2.887 . 0 0 "[ . 1 . 2]" 1
783 1 50 GLN QB 1 50 GLN QE 3.650 . 5.500 2.591 1.673 3.404 0.127 18 0 "[ . 1 . 2]" 1
784 1 50 GLN QB 1 51 GLU H 3.650 . 5.500 3.844 3.721 3.915 . 0 0 "[ . 1 . 2]" 1
785 1 50 GLN QE 1 51 GLU H 3.280 . 4.760 4.586 4.254 4.937 0.177 20 0 "[ . 1 . 2]" 1
786 1 51 GLU H 1 51 GLU QG 3.050 . 4.300 2.640 2.105 3.815 . 0 0 "[ . 1 . 2]" 1
787 1 51 GLU HA 1 51 GLU QG 2.890 . 3.980 2.585 2.153 3.443 . 0 0 "[ . 1 . 2]" 1
788 1 51 GLU HA 1 52 THR HB 3.570 . 5.340 4.587 4.362 4.766 . 0 0 "[ . 1 . 2]" 1
789 1 51 GLU HA 1 53 LEU QD 3.570 . 5.340 5.404 4.885 5.653 0.313 2 0 "[ . 1 . 2]" 1
790 1 51 GLU QB 1 52 THR H 3.650 . 5.500 3.313 3.035 3.836 . 0 0 "[ . 1 . 2]" 1
791 1 51 GLU QB 1 53 LEU QD 3.620 . 5.440 3.594 3.155 4.760 . 0 0 "[ . 1 . 2]" 1
792 1 51 GLU QG 1 52 THR H 3.650 . 5.500 4.433 3.035 4.719 . 0 0 "[ . 1 . 2]" 1
793 1 52 THR H 1 52 THR MG 3.650 . 5.500 3.916 3.723 4.062 . 0 0 "[ . 1 . 2]" 1
794 1 52 THR H 1 53 LEU HA 3.650 . 5.500 5.211 4.976 5.503 0.003 20 0 "[ . 1 . 2]" 1
795 1 52 THR HA 1 53 LEU QB 3.540 . 5.290 4.605 4.488 4.689 . 0 0 "[ . 1 . 2]" 1
796 1 52 THR HA 1 53 LEU HG 3.650 . 5.500 3.633 3.483 3.763 . 0 0 "[ . 1 . 2]" 1
797 1 52 THR HB 1 53 LEU H 3.460 . 5.120 4.212 4.035 4.381 . 0 0 "[ . 1 . 2]" 1
798 1 52 THR HB 1 54 LEU QB 3.400 . 5.000 4.855 4.074 5.160 0.160 8 0 "[ . 1 . 2]" 1
799 1 52 THR HB 1 54 LEU QD 3.400 . 5.000 3.559 2.314 5.061 0.061 9 0 "[ . 1 . 2]" 1
800 1 52 THR MG 1 53 LEU H 2.920 . 4.040 2.905 2.621 3.086 . 0 0 "[ . 1 . 2]" 1
801 1 52 THR MG 1 53 LEU QD 4.000 . 5.500 4.367 4.191 4.578 . 0 0 "[ . 1 . 2]" 1
802 1 52 THR MG 1 53 LEU HG 3.300 . 4.800 4.529 4.144 4.812 0.012 11 0 "[ . 1 . 2]" 1
803 1 52 THR MG 1 54 LEU HA 3.420 . 5.040 2.928 2.379 3.548 . 0 0 "[ . 1 . 2]" 1
804 1 52 THR MG 1 54 LEU QB 3.250 . 4.700 3.870 3.313 4.378 . 0 0 "[ . 1 . 2]" 1
805 1 52 THR MG 1 54 LEU QD 3.130 . 4.460 2.691 1.855 3.611 . 0 0 "[ . 1 . 2]" 1
806 1 53 LEU H 1 53 LEU QB 2.850 . 3.890 2.683 2.536 2.769 . 0 0 "[ . 1 . 2]" 1
807 1 53 LEU H 1 53 LEU QD 3.040 . 4.290 2.705 2.527 2.903 . 0 0 "[ . 1 . 2]" 1
808 1 53 LEU H 1 53 LEU HG 2.850 . 3.890 1.999 1.822 2.242 . 0 0 "[ . 1 . 2]" 1
809 1 53 LEU HA 1 53 LEU QD 2.730 . 3.660 2.271 2.112 2.414 . 0 0 "[ . 1 . 2]" 1
810 1 53 LEU QB 1 56 ALA HA 3.350 . 4.910 3.268 2.823 3.570 . 0 0 "[ . 1 . 2]" 1
811 1 53 LEU QB 1 56 ALA MB 2.620 . 3.440 3.221 2.313 3.514 0.074 5 0 "[ . 1 . 2]" 1
812 1 53 LEU QD 1 56 ALA HA 3.150 . 4.500 3.792 3.250 4.082 . 0 0 "[ . 1 . 2]" 1
813 1 53 LEU QD 1 56 ALA MB 3.160 . 4.520 3.339 2.327 4.034 . 0 0 "[ . 1 . 2]" 1
814 1 54 LEU HA 1 54 LEU QD 2.710 . 3.620 1.969 1.795 2.610 0.005 3 0 "[ . 1 . 2]" 1
815 1 54 LEU HA 1 55 HIS HD2 3.650 . 5.500 4.461 2.893 5.544 0.044 5 0 "[ . 1 . 2]" 1
816 1 54 LEU QB 1 54 LEU QD 2.670 . 3.540 1.984 1.921 2.064 . 0 0 "[ . 1 . 2]" 1
817 1 54 LEU QB 1 55 HIS QB 3.480 . 5.170 3.893 3.442 4.903 . 0 0 "[ . 1 . 2]" 1
818 1 54 LEU QB 1 55 HIS HD2 3.020 . 4.240 3.038 2.047 4.299 0.059 12 0 "[ . 1 . 2]" 1
819 1 54 LEU QD 1 55 HIS HD2 3.530 . 5.260 3.122 1.790 4.109 0.010 20 0 "[ . 1 . 2]" 1
820 1 54 LEU HG 1 55 HIS HD2 3.650 . 5.500 3.890 1.787 5.557 0.057 18 0 "[ . 1 . 2]" 1
821 1 55 HIS HA 1 55 HIS HD2 3.650 . 5.500 3.762 2.248 4.580 . 0 0 "[ . 1 . 2]" 1
822 1 56 ALA MB 1 57 GLY QA 3.620 . 5.450 3.955 3.896 4.071 . 0 0 "[ . 1 . 2]" 1
823 1 57 GLY QA 1 58 LEU QD 3.550 . 5.300 3.783 2.459 4.751 . 0 0 "[ . 1 . 2]" 1
824 1 58 LEU H 1 58 LEU QD 3.650 . 5.500 2.866 1.937 3.716 . 0 0 "[ . 1 . 2]" 1
825 1 58 LEU HA 1 58 LEU QD 2.710 . 3.620 2.376 1.913 2.962 . 0 0 "[ . 1 . 2]" 1
826 1 58 LEU QB 1 58 LEU QD 2.530 . 3.260 1.929 1.864 2.067 . 0 0 "[ . 1 . 2]" 1
827 1 58 LEU QB 1 59 THR H 3.450 . 5.100 3.334 2.685 3.851 . 0 0 "[ . 1 . 2]" 1
828 1 58 LEU QD 1 59 THR H 3.250 . 4.700 3.557 3.090 4.152 . 0 0 "[ . 1 . 2]" 1
829 1 59 THR H 1 59 THR MG 3.380 . 4.960 3.802 3.699 3.875 . 0 0 "[ . 1 . 2]" 1
830 1 59 THR HA 1 60 PRO QD 2.820 . 3.840 1.921 1.853 2.071 . 0 0 "[ . 1 . 2]" 1
831 1 59 THR HA 1 60 PRO QG 3.460 . 5.120 3.827 3.759 3.969 . 0 0 "[ . 1 . 2]" 1
832 1 59 THR HB 1 60 PRO QD 3.560 . 5.320 4.220 4.016 4.410 . 0 0 "[ . 1 . 2]" 1
833 1 59 THR MG 1 60 PRO QB 3.460 . 5.120 4.171 3.724 4.623 . 0 0 "[ . 1 . 2]" 1
834 1 59 THR MG 1 60 PRO QD 2.920 . 4.040 2.559 2.103 3.250 . 0 0 "[ . 1 . 2]" 1
835 1 59 THR MG 1 60 PRO QG 3.460 . 5.130 4.093 3.573 4.793 . 0 0 "[ . 1 . 2]" 1
836 1 59 THR MG 1 61 ASN HA 3.560 . 5.320 3.978 3.727 4.220 . 0 0 "[ . 1 . 2]" 1
837 1 60 PRO HA 1 61 ASN HA 3.550 . 5.300 4.406 4.364 4.441 . 0 0 "[ . 1 . 2]" 1
838 1 60 PRO QB 1 62 TYR QD 3.650 . 5.500 4.127 3.173 5.360 . 0 0 "[ . 1 . 2]" 1
839 1 60 PRO QB 1 62 TYR QE 3.560 . 5.330 3.216 2.194 4.778 . 0 0 "[ . 1 . 2]" 1
840 1 60 PRO QG 1 62 TYR QE 3.530 . 5.260 4.203 2.888 5.294 0.034 18 0 "[ . 1 . 2]" 1
841 1 61 ASN HA 1 62 TYR QD 3.650 . 5.500 3.881 3.378 4.299 . 0 0 "[ . 1 . 2]" 1
842 1 61 ASN HA 1 62 TYR QE 3.650 . 5.500 5.100 4.403 5.514 0.014 10 0 "[ . 1 . 2]" 1
843 1 61 ASN QB 1 62 TYR H 3.650 . 5.500 3.664 2.958 3.922 . 0 0 "[ . 1 . 2]" 1
844 1 61 ASN QB 1 64 LEU H 3.650 . 5.500 3.794 3.346 4.399 . 0 0 "[ . 1 . 2]" 1
845 1 62 TYR H 1 63 VAL HA 3.650 . 5.500 4.874 4.663 5.027 . 0 0 "[ . 1 . 2]" 1
846 1 62 TYR H 1 63 VAL QG 3.650 . 5.500 3.870 3.194 4.316 . 0 0 "[ . 1 . 2]" 1
847 1 62 TYR HA 1 62 TYR QD 2.910 . 4.020 2.763 2.429 3.017 . 0 0 "[ . 1 . 2]" 1
848 1 62 TYR HA 1 62 TYR QE 3.280 . 4.760 4.536 4.422 4.701 . 0 0 "[ . 1 . 2]" 1
849 1 62 TYR HA 1 63 VAL QG 3.640 . 5.480 4.676 4.372 4.859 . 0 0 "[ . 1 . 2]" 1
850 1 62 TYR HA 1 65 LYS H 3.540 . 5.280 3.490 2.765 3.982 . 0 0 "[ . 1 . 2]" 1
851 1 62 TYR HA 1 65 LYS QB 3.050 . 4.300 3.093 2.170 4.376 0.076 5 0 "[ . 1 . 2]" 1
852 1 62 TYR HA 1 65 LYS QD 3.500 . 5.200 4.077 2.178 5.239 0.039 15 0 "[ . 1 . 2]" 1
853 1 62 TYR HA 1 65 LYS QG 3.650 . 5.500 4.173 2.375 5.149 . 0 0 "[ . 1 . 2]" 1
854 1 62 TYR QB 1 65 LYS QB 3.650 . 5.500 4.339 3.301 5.543 0.043 11 0 "[ . 1 . 2]" 1
855 1 62 TYR QD 1 65 LYS QD 3.360 . 4.920 3.662 2.739 4.478 . 0 0 "[ . 1 . 2]" 1
856 1 62 TYR QE 1 65 LYS QD 3.450 . 5.100 4.687 3.434 5.180 0.080 6 0 "[ . 1 . 2]" 1
857 1 63 VAL H 1 63 VAL QG 3.650 . 5.500 2.214 1.796 2.527 0.004 7 0 "[ . 1 . 2]" 1
858 1 63 VAL HA 1 63 VAL QG 2.980 . 4.160 2.273 2.182 2.485 . 0 0 "[ . 1 . 2]" 1
859 1 63 VAL HA 1 66 SER H 3.650 . 5.500 4.622 4.162 5.061 . 0 0 "[ . 1 . 2]" 1
860 1 63 VAL HA 1 66 SER QB 3.650 . 5.500 4.443 3.645 5.199 . 0 0 "[ . 1 . 2]" 1
861 1 63 VAL QG 1 64 LEU H 3.530 . 5.260 2.237 1.828 2.507 . 0 0 "[ . 1 . 2]" 1
862 1 63 VAL QG 1 64 LEU HA 3.090 . 4.380 2.861 2.655 3.162 . 0 0 "[ . 1 . 2]" 1
863 1 63 VAL QG 1 64 LEU QB 3.120 . 4.450 2.432 2.108 2.640 . 0 0 "[ . 1 . 2]" 1
864 1 63 VAL QG 1 64 LEU QD 3.060 . 4.330 2.649 2.022 3.157 . 0 0 "[ . 1 . 2]" 1
865 1 63 VAL QG 1 67 LEU QD 2.870 . 3.940 2.880 2.135 3.798 . 0 0 "[ . 1 . 2]" 1
866 1 63 VAL QG 1 68 ILE MD 4.000 . 5.400 5.339 5.198 5.487 0.087 8 0 "[ . 1 . 2]" 1
867 1 64 LEU H 1 64 LEU QD 3.650 . 5.500 3.473 1.705 3.724 0.095 12 0 "[ . 1 . 2]" 1
868 1 64 LEU H 1 64 LEU HG 3.650 . 5.500 4.501 3.106 4.653 . 0 0 "[ . 1 . 2]" 1
869 1 64 LEU H 1 66 SER H 3.650 . 5.500 4.266 3.929 4.615 . 0 0 "[ . 1 . 2]" 1
870 1 64 LEU H 1 68 ILE MG 3.650 . 5.500 5.405 5.112 5.549 0.049 3 0 "[ . 1 . 2]" 1
871 1 64 LEU HA 1 64 LEU QD 2.750 . 3.700 1.922 1.721 3.378 0.079 2 0 "[ . 1 . 2]" 1
872 1 64 LEU HA 1 67 LEU H 3.480 . 5.160 3.381 2.802 3.730 . 0 0 "[ . 1 . 2]" 1
873 1 64 LEU HA 1 67 LEU QB 3.480 . 5.160 2.729 2.195 3.119 . 0 0 "[ . 1 . 2]" 1
874 1 64 LEU HA 1 67 LEU QD 3.300 . 4.800 2.767 1.924 3.323 . 0 0 "[ . 1 . 2]" 1
875 1 64 LEU HA 1 68 ILE H 3.650 . 5.500 3.830 3.616 4.042 . 0 0 "[ . 1 . 2]" 1
876 1 64 LEU HA 1 68 ILE MG 3.020 . 4.250 3.646 3.326 4.057 . 0 0 "[ . 1 . 2]" 1
877 1 64 LEU QB 1 64 LEU QD 2.710 . 3.620 1.940 1.872 1.960 . 0 0 "[ . 1 . 2]" 1
878 1 64 LEU QB 1 65 LYS H 3.530 . 5.260 2.820 2.439 3.895 . 0 0 "[ . 1 . 2]" 1
879 1 64 LEU QB 1 66 SER H 3.650 . 5.500 4.874 4.594 5.200 . 0 0 "[ . 1 . 2]" 1
880 1 64 LEU QB 1 67 LEU QB 3.650 . 5.500 4.403 2.495 4.872 . 0 0 "[ . 1 . 2]" 1
881 1 64 LEU QB 1 67 LEU QD 3.510 . 5.220 4.353 3.384 4.892 . 0 0 "[ . 1 . 2]" 1
882 1 64 LEU QB 1 68 ILE MG 3.650 . 5.500 3.377 2.467 3.716 . 0 0 "[ . 1 . 2]" 1
883 1 64 LEU QD 1 65 LYS HA 3.580 . 5.360 4.621 4.105 4.923 . 0 0 "[ . 1 . 2]" 1
884 1 64 LEU QD 1 67 LEU H 3.460 . 5.120 4.236 3.343 4.886 . 0 0 "[ . 1 . 2]" 1
885 1 64 LEU QD 1 67 LEU QB 3.320 . 4.840 2.824 1.816 3.826 . 0 0 "[ . 1 . 2]" 1
886 1 64 LEU QD 1 67 LEU QD 3.010 . 4.220 2.988 1.974 4.237 0.017 12 0 "[ . 1 . 2]" 1
887 1 64 LEU QD 1 67 LEU HG 3.340 . 4.880 4.218 3.332 4.970 0.090 12 0 "[ . 1 . 2]" 1
888 1 64 LEU QD 1 68 ILE HA 3.650 . 5.500 4.729 4.115 5.187 . 0 0 "[ . 1 . 2]" 1
889 1 64 LEU QD 1 68 ILE MD 2.960 . 4.120 2.872 2.121 3.494 . 0 0 "[ . 1 . 2]" 1
890 1 64 LEU QD 1 68 ILE QG 3.650 . 5.500 3.913 3.522 4.343 . 0 0 "[ . 1 . 2]" 1
891 1 64 LEU QD 1 68 ILE MG 2.690 . 3.570 2.412 2.029 2.797 . 0 0 "[ . 1 . 2]" 1
892 1 64 LEU HG 1 65 LYS HA 3.580 . 5.000 4.555 3.534 5.068 0.068 17 0 "[ . 1 . 2]" 1
893 1 64 LEU HG 1 68 ILE MD 2.960 . 4.120 2.584 1.793 3.294 0.007 14 0 "[ . 1 . 2]" 1
894 1 64 LEU HG 1 68 ILE MG 3.650 . 5.500 2.020 1.843 2.873 . 0 0 "[ . 1 . 2]" 1
895 1 65 LYS H 1 65 LYS QD 3.650 . 5.500 4.396 3.892 4.788 . 0 0 "[ . 1 . 2]" 1
896 1 65 LYS H 1 65 LYS QE 3.650 . 5.500 4.928 3.712 5.897 0.397 1 0 "[ . 1 . 2]" 1
897 1 65 LYS H 1 65 LYS QG 3.380 . 4.960 3.534 1.924 3.966 . 0 0 "[ . 1 . 2]" 1
898 1 65 LYS H 1 68 ILE MD 3.650 . 5.500 3.663 3.454 3.896 . 0 0 "[ . 1 . 2]" 1
899 1 65 LYS H 1 68 ILE QG 3.650 . 5.500 3.936 3.744 4.098 . 0 0 "[ . 1 . 2]" 1
900 1 65 LYS H 1 68 ILE MG 3.650 . 5.500 4.832 4.596 5.005 . 0 0 "[ . 1 . 2]" 1
901 1 65 LYS H 1 69 ALA MB 4.000 . 5.500 5.719 5.665 5.777 0.277 2 0 "[ . 1 . 2]" 1
902 1 65 LYS HA 1 65 LYS QD 3.420 . 5.040 3.849 2.693 4.577 . 0 0 "[ . 1 . 2]" 1
903 1 65 LYS HA 1 65 LYS QE 3.500 . 5.200 3.979 3.526 4.932 . 0 0 "[ . 1 . 2]" 1
904 1 65 LYS HA 1 68 ILE H 3.560 . 5.330 3.694 3.325 3.883 . 0 0 "[ . 1 . 2]" 1
905 1 65 LYS HA 1 68 ILE HB 3.330 . 4.860 4.786 4.457 4.927 0.067 15 0 "[ . 1 . 2]" 1
906 1 65 LYS HA 1 68 ILE MD 3.230 . 4.660 1.935 1.800 2.098 0.000 10 0 "[ . 1 . 2]" 1
907 1 65 LYS HA 1 68 ILE MG 3.520 . 5.240 3.971 3.711 4.284 . 0 0 "[ . 1 . 2]" 1
908 1 65 LYS HA 1 69 ALA H 3.650 . 5.500 3.746 3.276 4.036 . 0 0 "[ . 1 . 2]" 1
909 1 65 LYS HA 1 69 ALA HA 3.640 . 5.480 5.490 5.267 5.631 0.151 16 0 "[ . 1 . 2]" 1
910 1 65 LYS HA 1 69 ALA MB 3.650 . 5.500 3.778 3.585 4.109 . 0 0 "[ . 1 . 2]" 1
911 1 65 LYS QB 1 65 LYS QE 3.500 . 5.200 2.752 1.748 3.788 0.052 3 0 "[ . 1 . 2]" 1
912 1 65 LYS QB 1 66 SER H 3.520 . 5.240 2.678 2.307 3.649 . 0 0 "[ . 1 . 2]" 1
913 1 65 LYS QB 1 66 SER HA 3.630 . 5.460 4.110 3.827 4.685 . 0 0 "[ . 1 . 2]" 1
914 1 65 LYS QB 1 67 LEU H 3.650 . 5.500 4.585 4.354 4.973 . 0 0 "[ . 1 . 2]" 1
915 1 65 LYS QB 1 69 ALA H 3.650 . 5.500 5.117 4.352 5.487 . 0 0 "[ . 1 . 2]" 1
916 1 65 LYS QD 1 66 SER H 3.650 . 5.500 4.100 3.435 4.680 . 0 0 "[ . 1 . 2]" 1
917 1 65 LYS QD 1 66 SER HA 3.380 . 4.960 4.350 3.057 5.057 0.097 12 0 "[ . 1 . 2]" 1
918 1 65 LYS QE 1 65 LYS QG 3.020 . 4.240 2.274 2.036 2.707 . 0 0 "[ . 1 . 2]" 1
919 1 65 LYS QE 1 66 SER H 3.650 . 5.500 5.213 4.533 5.598 0.098 2 0 "[ . 1 . 2]" 1
920 1 65 LYS QG 1 66 SER H 3.550 . 5.300 3.566 2.229 4.421 . 0 0 "[ . 1 . 2]" 1
921 1 65 LYS QG 1 68 ILE MD 3.540 . 5.280 3.403 2.759 4.405 . 0 0 "[ . 1 . 2]" 1
922 1 66 SER H 1 67 LEU QD 3.650 . 5.500 4.053 3.411 4.633 . 0 0 "[ . 1 . 2]" 1
923 1 66 SER H 1 68 ILE QG 3.650 . 5.500 4.202 4.023 4.329 . 0 0 "[ . 1 . 2]" 1
924 1 66 SER HA 1 67 LEU HA 4.000 . 5.000 4.672 4.619 4.786 . 0 0 "[ . 1 . 2]" 1
925 1 66 SER QB 1 67 LEU H 3.400 . 5.000 2.895 2.541 3.091 . 0 0 "[ . 1 . 2]" 1
926 1 66 SER QB 1 69 ALA MB 3.650 . 5.500 4.582 4.061 5.177 . 0 0 "[ . 1 . 2]" 1
927 1 67 LEU H 1 67 LEU QD 3.400 . 5.000 2.792 2.182 3.278 . 0 0 "[ . 1 . 2]" 1
928 1 67 LEU H 1 67 LEU HG 3.160 . 4.520 3.328 2.244 4.312 . 0 0 "[ . 1 . 2]" 1
929 1 67 LEU H 1 68 ILE HA 3.650 . 5.500 5.064 4.932 5.261 . 0 0 "[ . 1 . 2]" 1
930 1 67 LEU H 1 68 ILE MD 3.650 . 5.500 4.683 4.482 4.973 . 0 0 "[ . 1 . 2]" 1
931 1 67 LEU H 1 68 ILE QG 3.650 . 5.500 3.391 3.219 3.771 . 0 0 "[ . 1 . 2]" 1
932 1 67 LEU HA 1 67 LEU QD 3.150 . 4.500 1.999 1.803 2.503 . 0 0 "[ . 1 . 2]" 1
933 1 67 LEU HA 1 69 ALA H 3.650 . 5.500 4.279 3.964 4.541 . 0 0 "[ . 1 . 2]" 1
934 1 67 LEU HA 1 70 LEU H 3.650 . 5.500 3.719 3.480 3.989 . 0 0 "[ . 1 . 2]" 1
935 1 67 LEU HA 1 70 LEU QB 3.210 . 4.620 3.754 2.471 4.567 . 0 0 "[ . 1 . 2]" 1
936 1 67 LEU HA 1 70 LEU QD 3.070 . 4.340 2.413 1.904 3.291 . 0 0 "[ . 1 . 2]" 1
937 1 67 LEU HA 1 70 LEU HG 3.590 . 5.380 3.453 2.335 5.480 0.100 8 0 "[ . 1 . 2]" 1
938 1 67 LEU QB 1 68 ILE H 3.560 . 5.330 2.465 2.236 2.819 . 0 0 "[ . 1 . 2]" 1
939 1 67 LEU QB 1 70 LEU QD 3.520 . 5.240 3.496 3.109 4.015 . 0 0 "[ . 1 . 2]" 1
940 1 67 LEU QD 1 70 LEU QD 2.650 . 3.500 2.609 1.720 3.573 0.080 16 0 "[ . 1 . 2]" 1
941 1 68 ILE H 1 68 ILE MD 3.380 . 4.960 3.418 3.297 3.531 . 0 0 "[ . 1 . 2]" 1
942 1 68 ILE H 1 68 ILE QG 3.250 . 4.700 1.887 1.793 2.060 0.007 7 0 "[ . 1 . 2]" 1
943 1 68 ILE H 1 68 ILE MG 3.250 . 4.700 2.274 2.114 2.485 . 0 0 "[ . 1 . 2]" 1
944 1 68 ILE HA 1 68 ILE MD 3.310 . 4.820 4.171 4.140 4.192 . 0 0 "[ . 1 . 2]" 1
945 1 68 ILE HA 1 68 ILE MG 2.900 . 4.000 2.314 2.276 2.394 . 0 0 "[ . 1 . 2]" 1
946 1 68 ILE HA 1 69 ALA HA 3.650 . 5.500 4.787 4.744 4.832 . 0 0 "[ . 1 . 2]" 1
947 1 68 ILE HA 1 70 LEU H 3.650 . 5.500 3.946 3.650 4.454 . 0 0 "[ . 1 . 2]" 1
948 1 68 ILE HA 1 71 TRP H 3.650 . 5.500 3.321 3.149 3.483 . 0 0 "[ . 1 . 2]" 1
949 1 68 ILE HA 1 71 TRP HA 3.650 . 5.500 5.503 5.317 5.646 0.146 16 0 "[ . 1 . 2]" 1
950 1 68 ILE HA 1 71 TRP QB 3.290 . 4.780 2.986 2.755 3.167 . 0 0 "[ . 1 . 2]" 1
951 1 68 ILE HA 1 72 CYS H 3.650 . 5.500 4.075 3.792 4.389 . 0 0 "[ . 1 . 2]" 1
952 1 68 ILE HB 1 68 ILE MD 2.890 . 3.970 2.528 2.460 2.588 . 0 0 "[ . 1 . 2]" 1
953 1 68 ILE MD 1 68 ILE MG 2.690 . 3.580 1.853 1.778 1.920 0.022 2 0 "[ . 1 . 2]" 1
954 1 68 ILE MD 1 69 ALA H 3.650 . 5.500 3.888 3.764 4.037 . 0 0 "[ . 1 . 2]" 1
955 1 68 ILE QG 1 68 ILE MG 2.750 . 3.690 2.417 2.365 2.463 . 0 0 "[ . 1 . 2]" 1
956 1 68 ILE QG 1 69 ALA H 3.550 . 5.300 2.206 2.057 2.361 . 0 0 "[ . 1 . 2]" 1
957 1 68 ILE MG 1 69 ALA H 3.280 . 4.760 3.982 3.873 4.067 . 0 0 "[ . 1 . 2]" 1
958 1 68 ILE MG 1 69 ALA HA 4.000 . 5.500 5.388 5.314 5.447 . 0 0 "[ . 1 . 2]" 1
959 1 68 ILE MG 1 70 LEU H 3.650 . 5.500 5.266 4.997 5.512 0.012 2 0 "[ . 1 . 2]" 1
960 1 68 ILE MG 1 71 TRP H 3.650 . 5.500 5.106 4.929 5.273 . 0 0 "[ . 1 . 2]" 1
961 1 68 ILE MG 1 72 CYS H 3.650 . 5.500 5.391 5.210 5.579 0.079 13 0 "[ . 1 . 2]" 1
962 1 69 ALA H 1 69 ALA MB 2.750 . 3.700 2.211 2.182 2.246 . 0 0 "[ . 1 . 2]" 1
963 1 69 ALA H 1 70 LEU QB 3.650 . 5.500 4.698 4.072 5.041 . 0 0 "[ . 1 . 2]" 1
964 1 69 ALA HA 1 72 CYS H 3.310 . 4.830 3.901 3.570 4.291 . 0 0 "[ . 1 . 2]" 1
965 1 69 ALA HA 1 72 CYS QB 3.020 . 4.240 4.041 3.156 4.376 0.136 17 0 "[ . 1 . 2]" 1
966 1 69 ALA MB 1 70 LEU H 2.930 . 4.060 2.867 2.458 3.130 . 0 0 "[ . 1 . 2]" 1
967 1 69 ALA MB 1 70 LEU HA 3.260 . 4.720 3.925 3.749 4.049 . 0 0 "[ . 1 . 2]" 1
968 1 69 ALA MB 1 71 TRP H 3.650 . 5.500 4.567 4.379 4.762 . 0 0 "[ . 1 . 2]" 1
969 1 69 ALA MB 1 72 CYS H 3.650 . 5.500 5.069 4.844 5.285 . 0 0 "[ . 1 . 2]" 1
970 1 69 ALA MB 1 72 CYS QB 4.000 . 5.500 5.174 4.352 5.457 . 0 0 "[ . 1 . 2]" 1
971 1 69 ALA MB 1 73 GLU H 3.650 . 5.500 5.095 4.678 5.540 0.040 4 0 "[ . 1 . 2]" 1
972 1 69 ALA MB 1 73 GLU QB 3.650 . 5.500 4.376 3.893 4.932 . 0 0 "[ . 1 . 2]" 1
973 1 70 LEU H 1 70 LEU QB 2.810 . 3.820 2.536 2.087 2.794 . 0 0 "[ . 1 . 2]" 1
974 1 70 LEU H 1 70 LEU QD 3.110 . 4.420 3.119 2.957 3.654 . 0 0 "[ . 1 . 2]" 1
975 1 70 LEU H 1 71 TRP QB 3.650 . 5.500 4.159 3.988 4.429 . 0 0 "[ . 1 . 2]" 1
976 1 70 LEU H 1 72 CYS H 3.490 . 5.180 4.224 3.973 4.412 . 0 0 "[ . 1 . 2]" 1
977 1 70 LEU H 1 73 GLU QB 3.650 . 5.500 4.687 4.311 5.234 . 0 0 "[ . 1 . 2]" 1
978 1 70 LEU HA 1 70 LEU QD 2.770 . 3.730 3.354 3.065 3.417 . 0 0 "[ . 1 . 2]" 1
979 1 70 LEU HA 1 73 GLU H 3.550 . 5.300 3.711 3.402 4.189 . 0 0 "[ . 1 . 2]" 1
980 1 70 LEU HA 1 73 GLU QB 2.890 . 3.970 2.652 2.210 3.349 . 0 0 "[ . 1 . 2]" 1
981 1 70 LEU HA 1 73 GLU QG 3.490 . 5.180 4.013 3.438 4.653 . 0 0 "[ . 1 . 2]" 1
982 1 70 LEU QB 1 70 LEU QD 2.560 . 3.330 1.899 1.869 1.915 . 0 0 "[ . 1 . 2]" 1
983 1 70 LEU QB 1 71 TRP H 3.310 . 4.830 3.438 2.427 3.679 . 0 0 "[ . 1 . 2]" 1
984 1 70 LEU QB 1 72 CYS H 3.650 . 5.500 5.366 4.719 5.545 0.045 9 0 "[ . 1 . 2]" 1
985 1 70 LEU QB 1 73 GLU H 3.650 . 5.500 5.049 4.767 5.522 0.022 19 0 "[ . 1 . 2]" 1
986 1 70 LEU QB 1 73 GLU QB 3.650 . 5.500 4.074 3.600 4.959 . 0 0 "[ . 1 . 2]" 1
987 1 70 LEU QD 1 71 TRP H 3.650 . 5.500 2.594 2.372 3.010 . 0 0 "[ . 1 . 2]" 1
988 1 70 LEU QD 1 71 TRP HA 3.650 . 5.500 2.449 2.327 2.560 . 0 0 "[ . 1 . 2]" 1
989 1 70 LEU QD 1 71 TRP HD1 3.650 . 5.500 3.100 2.847 3.348 . 0 0 "[ . 1 . 2]" 1
990 1 70 LEU QD 1 71 TRP HE3 3.650 . 5.500 5.563 5.510 5.621 0.121 1 0 "[ . 1 . 2]" 1
991 1 70 LEU QD 1 72 CYS H 3.650 . 5.500 4.449 4.291 4.605 . 0 0 "[ . 1 . 2]" 1
992 1 70 LEU QD 1 73 GLU H 3.650 . 5.500 4.749 4.564 5.046 . 0 0 "[ . 1 . 2]" 1
993 1 70 LEU QD 1 73 GLU QB 3.230 . 4.660 4.428 4.212 4.842 0.182 19 0 "[ . 1 . 2]" 1
994 1 70 LEU QD 1 73 GLU QG 3.630 . 5.460 5.432 5.155 5.575 0.115 14 0 "[ . 1 . 2]" 1
995 1 70 LEU QD 1 74 SER QB 3.480 . 5.160 4.017 3.258 4.797 . 0 0 "[ . 1 . 2]" 1
996 1 71 TRP H 1 72 CYS HA 3.650 . 5.500 5.141 5.021 5.217 . 0 0 "[ . 1 . 2]" 1
997 1 71 TRP H 1 72 CYS QB 3.650 . 5.500 4.688 4.145 4.928 . 0 0 "[ . 1 . 2]" 1
998 1 71 TRP H 1 74 SER QB 3.650 . 5.500 5.164 4.633 5.532 0.032 2 0 "[ . 1 . 2]" 1
999 1 71 TRP HA 1 71 TRP HD1 3.340 . 4.880 3.399 3.176 3.603 . 0 0 "[ . 1 . 2]" 1
1000 1 71 TRP HA 1 74 SER QB 3.040 . 4.280 2.891 2.518 3.217 . 0 0 "[ . 1 . 2]" 1
1001 1 71 TRP QB 1 71 TRP HZ3 3.570 . 5.340 4.873 4.792 4.955 . 0 0 "[ . 1 . 2]" 1
1002 1 71 TRP QB 1 72 CYS H 3.500 . 5.210 2.503 2.350 2.708 . 0 0 "[ . 1 . 2]" 1
1003 1 71 TRP QB 1 74 SER QB 3.480 . 5.160 4.589 4.243 4.885 . 0 0 "[ . 1 . 2]" 1
1004 1 71 TRP HD1 1 74 SER QB 3.650 . 5.500 5.122 4.287 5.587 0.087 10 0 "[ . 1 . 2]" 1
1005 1 71 TRP HE3 1 72 CYS HA 3.630 . 5.460 2.725 2.320 3.092 . 0 0 "[ . 1 . 2]" 1
1006 1 71 TRP HE3 1 77 ILE MD 3.150 . 4.500 3.464 2.859 4.200 . 0 0 "[ . 1 . 2]" 1
1007 1 71 TRP HE3 1 77 ILE QG 3.650 . 5.500 4.493 3.725 5.285 . 0 0 "[ . 1 . 2]" 1
1008 1 71 TRP HE3 1 77 ILE MG 3.380 . 4.960 2.779 2.048 4.552 . 0 0 "[ . 1 . 2]" 1
1009 1 71 TRP HZ2 1 77 ILE MD 3.650 . 5.500 5.000 4.475 5.532 0.032 10 0 "[ . 1 . 2]" 1
1010 1 71 TRP HZ3 1 72 CYS HA 3.180 . 4.560 4.111 3.523 4.478 . 0 0 "[ . 1 . 2]" 1
1011 1 71 TRP HZ3 1 72 CYS QB 3.650 . 5.500 5.289 4.760 5.578 0.078 12 0 "[ . 1 . 2]" 1
1012 1 71 TRP HZ3 1 74 SER QB 3.650 . 5.500 5.522 5.338 5.626 0.126 10 0 "[ . 1 . 2]" 1
1013 1 71 TRP HZ3 1 77 ILE HB 3.650 . 5.500 2.551 1.876 3.480 . 0 0 "[ . 1 . 2]" 1
1014 1 72 CYS H 1 73 GLU QB 3.650 . 5.500 4.296 4.174 4.615 . 0 0 "[ . 1 . 2]" 1
1015 1 72 CYS H 1 74 SER H 3.650 . 5.500 4.093 3.939 4.360 . 0 0 "[ . 1 . 2]" 1
1016 1 72 CYS H 1 74 SER QB 3.650 . 5.500 5.116 4.854 5.516 0.016 10 0 "[ . 1 . 2]" 1
1017 1 72 CYS HA 1 75 ASN QB 3.420 . 5.040 3.910 3.099 4.282 . 0 0 "[ . 1 . 2]" 1
1018 1 72 CYS HA 1 77 ILE HB 2.920 . 4.040 3.580 3.100 4.070 0.030 17 0 "[ . 1 . 2]" 1
1019 1 72 CYS HA 1 77 ILE MD 3.230 . 4.670 4.565 4.082 4.855 0.185 4 0 "[ . 1 . 2]" 1
1020 1 72 CYS HA 1 77 ILE QG 3.290 . 4.780 4.844 4.548 5.059 0.279 15 0 "[ . 1 . 2]" 1
1021 1 72 CYS HA 1 77 ILE MG 3.440 . 5.090 2.151 1.668 3.185 0.122 2 0 "[ . 1 . 2]" 1
1022 1 72 CYS QB 1 73 GLU H 3.490 . 5.180 3.401 2.849 3.744 . 0 0 "[ . 1 . 2]" 1
1023 1 72 CYS QB 1 73 GLU HA 3.650 . 5.500 4.407 3.934 4.628 . 0 0 "[ . 1 . 2]" 1
1024 1 72 CYS QB 1 77 ILE H 3.650 . 5.500 3.499 2.519 5.616 0.116 9 0 "[ . 1 . 2]" 1
1025 1 72 CYS QB 1 77 ILE HB 3.080 . 4.360 4.309 3.633 4.549 0.189 17 0 "[ . 1 . 2]" 1
1026 1 72 CYS QB 1 77 ILE QG 3.650 . 5.500 4.530 4.216 5.134 . 0 0 "[ . 1 . 2]" 1
1027 1 72 CYS QB 1 77 ILE MG 3.420 . 5.040 2.205 1.787 2.625 0.013 3 0 "[ . 1 . 2]" 1
1028 1 72 CYS QB 1 78 GLU H 3.650 . 5.500 5.059 2.875 5.720 0.220 18 0 "[ . 1 . 2]" 1
1029 1 73 GLU H 1 73 GLU QB 2.940 . 4.080 2.239 2.146 2.399 . 0 0 "[ . 1 . 2]" 1
1030 1 73 GLU H 1 73 GLU QG 3.480 . 5.170 3.898 2.235 4.061 . 0 0 "[ . 1 . 2]" 1
1031 1 73 GLU H 1 74 SER HA 3.650 . 5.500 5.095 4.938 5.295 . 0 0 "[ . 1 . 2]" 1
1032 1 73 GLU H 1 74 SER QB 3.650 . 5.500 4.312 4.047 4.724 . 0 0 "[ . 1 . 2]" 1
1033 1 73 GLU HA 1 74 SER QB 3.570 . 5.340 5.260 5.102 5.451 0.111 4 0 "[ . 1 . 2]" 1
1034 1 73 GLU QB 1 74 SER H 3.650 . 5.500 2.746 2.530 3.099 . 0 0 "[ . 1 . 2]" 1
1035 1 73 GLU QB 1 74 SER HA 3.620 . 5.450 4.170 3.722 4.310 . 0 0 "[ . 1 . 2]" 1
1036 1 73 GLU QG 1 74 SER H 3.650 . 5.500 3.766 3.326 4.187 . 0 0 "[ . 1 . 2]" 1
1037 1 73 GLU QG 1 74 SER HA 3.550 . 5.300 3.771 3.216 5.591 0.291 19 0 "[ . 1 . 2]" 1
1038 1 74 SER HA 1 75 ASN HA 3.540 . 5.290 4.543 4.454 4.616 . 0 0 "[ . 1 . 2]" 1
1039 1 74 SER QB 1 75 ASN HA 3.600 . 5.410 4.404 4.108 4.893 . 0 0 "[ . 1 . 2]" 1
1040 1 75 ASN H 1 77 ILE H 3.650 . 5.500 4.836 3.431 5.483 . 0 0 "[ . 1 . 2]" 1
1041 1 75 ASN HA 1 76 GLY QA 3.530 . 5.260 4.044 3.891 4.365 . 0 0 "[ . 1 . 2]" 1
1042 1 75 ASN QB 1 77 ILE MD 3.270 . 4.740 3.995 3.519 4.525 . 0 0 "[ . 1 . 2]" 1
1043 1 75 ASN QB 1 77 ILE QG 3.570 . 5.340 5.115 4.363 5.405 0.065 19 0 "[ . 1 . 2]" 1
1044 1 76 GLY QA 1 77 ILE HA 3.510 . 5.220 4.040 3.950 4.323 . 0 0 "[ . 1 . 2]" 1
1045 1 76 GLY QA 1 77 ILE HB 3.650 . 5.500 4.439 4.167 4.908 . 0 0 "[ . 1 . 2]" 1
1046 1 77 ILE H 1 77 ILE MD 3.650 . 5.500 4.345 3.490 4.839 . 0 0 "[ . 1 . 2]" 1
1047 1 77 ILE H 1 77 ILE QG 3.470 . 5.140 4.061 3.938 4.208 . 0 0 "[ . 1 . 2]" 1
1048 1 77 ILE H 1 77 ILE MG 3.520 . 5.250 2.225 1.769 3.641 0.021 6 0 "[ . 1 . 2]" 1
1049 1 77 ILE HA 1 77 ILE MD 2.890 . 3.980 3.052 2.055 3.788 . 0 0 "[ . 1 . 2]" 1
1050 1 77 ILE HA 1 77 ILE MG 2.980 . 4.160 3.196 3.175 3.214 . 0 0 "[ . 1 . 2]" 1
1051 1 77 ILE HB 1 77 ILE MD 2.830 . 3.870 2.296 2.155 2.399 . 0 0 "[ . 1 . 2]" 1
1052 1 77 ILE MD 1 77 ILE MG 2.410 . 3.020 2.499 1.856 3.188 0.168 5 0 "[ . 1 . 2]" 1
1053 1 77 ILE MD 1 78 GLU H 3.480 . 5.160 4.436 3.359 5.203 0.043 13 0 "[ . 1 . 2]" 1
1054 1 77 ILE MD 1 78 GLU QB 3.650 . 5.500 5.369 4.510 5.588 0.088 8 0 "[ . 1 . 2]" 1
1055 1 77 ILE QG 1 77 ILE MG 2.980 . 4.160 2.162 1.992 2.311 . 0 0 "[ . 1 . 2]" 1
1056 1 77 ILE QG 1 78 GLU H 3.650 . 5.500 3.171 1.635 4.228 0.165 14 0 "[ . 1 . 2]" 1
1057 1 77 ILE MG 1 78 GLU H 2.920 . 4.040 3.138 1.938 4.164 0.124 19 0 "[ . 1 . 2]" 1
1058 1 77 ILE MG 1 78 GLU HA 3.380 . 4.960 3.858 3.217 4.494 . 0 0 "[ . 1 . 2]" 1
1059 1 77 ILE MG 1 78 GLU QG 3.650 . 5.500 4.583 2.096 5.436 . 0 0 "[ . 1 . 2]" 1
1060 1 78 GLU H 1 78 GLU QB 2.880 . 3.960 2.801 2.287 3.287 . 0 0 "[ . 1 . 2]" 1
1061 1 78 GLU H 1 78 GLU QG 3.080 . 4.360 4.093 2.887 4.395 0.035 20 0 "[ . 1 . 2]" 1
1062 1 78 GLU HA 1 78 GLU QG 2.560 . 3.320 2.400 2.299 2.499 . 0 0 "[ . 1 . 2]" 1
1063 1 78 GLU QB 1 78 GLU QG 2.270 . 2.730 2.068 2.002 2.088 . 0 0 "[ . 1 . 2]" 1
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