NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
400267 |
1ul7   |
10025 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1ul7
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 1570
_Distance_constraint_stats_list.Viol_count 223
_Distance_constraint_stats_list.Viol_total 38.435
_Distance_constraint_stats_list.Viol_max 0.134
_Distance_constraint_stats_list.Viol_rms 0.0017
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0086
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 THR 0.125 0.125 20 0 "[ . 1 . 2]"
1 11 TRP 0.305 0.125 20 0 "[ . 1 . 2]"
1 13 MET 0.017 0.012 13 0 "[ . 1 . 2]"
1 14 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 THR 0.030 0.012 13 0 "[ . 1 . 2]"
1 16 THR 0.009 0.003 20 0 "[ . 1 . 2]"
1 17 SER 0.019 0.014 15 0 "[ . 1 . 2]"
1 18 SER 0.014 0.014 15 0 "[ . 1 . 2]"
1 19 MET 0.156 0.134 19 0 "[ . 1 . 2]"
1 20 ASP 0.002 0.002 4 0 "[ . 1 . 2]"
1 21 PRO 0.008 0.004 15 0 "[ . 1 . 2]"
1 22 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 MET 0.058 0.010 15 0 "[ . 1 . 2]"
1 25 MET 0.071 0.047 17 0 "[ . 1 . 2]"
1 26 ARG 0.083 0.019 18 0 "[ . 1 . 2]"
1 27 GLU 0.077 0.019 18 0 "[ . 1 . 2]"
1 28 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 ARG 0.004 0.003 5 0 "[ . 1 . 2]"
1 30 LYS 0.045 0.033 7 0 "[ . 1 . 2]"
1 31 VAL 0.003 0.001 11 0 "[ . 1 . 2]"
1 32 LEU 0.003 0.003 18 0 "[ . 1 . 2]"
1 33 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 ALA 0.001 0.001 11 0 "[ . 1 . 2]"
1 35 ASN 0.001 0.001 11 0 "[ . 1 . 2]"
1 36 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 CYS 0.001 0.001 14 0 "[ . 1 . 2]"
1 38 ASP 0.002 0.001 17 0 "[ . 1 . 2]"
1 39 TYR 0.004 0.003 5 0 "[ . 1 . 2]"
1 40 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 GLN 0.054 0.033 8 0 "[ . 1 . 2]"
1 42 ARG 0.041 0.033 8 0 "[ . 1 . 2]"
1 43 GLU 0.018 0.009 20 0 "[ . 1 . 2]"
1 44 ARG 0.113 0.101 16 0 "[ . 1 . 2]"
1 45 PHE 0.007 0.002 15 0 "[ . 1 . 2]"
1 46 LEU 0.065 0.017 20 0 "[ . 1 . 2]"
1 47 LEU 0.002 0.002 8 0 "[ . 1 . 2]"
1 48 PHE 0.003 0.002 8 0 "[ . 1 . 2]"
1 49 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 VAL 0.005 0.002 13 0 "[ . 1 . 2]"
1 51 HIS 0.004 0.003 10 0 "[ . 1 . 2]"
1 52 GLY 0.002 0.002 7 0 "[ . 1 . 2]"
1 53 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 HIS 0.059 0.050 18 0 "[ . 1 . 2]"
1 56 ALA 0.077 0.077 18 0 "[ . 1 . 2]"
1 57 GLU 0.001 0.001 16 0 "[ . 1 . 2]"
1 58 ASN 0.137 0.077 18 0 "[ . 1 . 2]"
1 59 LEU 0.031 0.028 18 0 "[ . 1 . 2]"
1 60 VAL 0.028 0.011 17 0 "[ . 1 . 2]"
1 61 GLN 0.008 0.004 17 0 "[ . 1 . 2]"
1 62 TRP 0.121 0.061 14 0 "[ . 1 . 2]"
1 63 GLU 0.022 0.020 7 0 "[ . 1 . 2]"
1 64 MET 0.005 0.003 18 0 "[ . 1 . 2]"
1 65 GLU 0.033 0.017 20 0 "[ . 1 . 2]"
1 66 VAL 0.009 0.003 4 0 "[ . 1 . 2]"
1 67 CYS 0.027 0.013 18 0 "[ . 1 . 2]"
1 68 LYS 0.048 0.016 14 0 "[ . 1 . 2]"
1 69 LEU 0.111 0.019 11 0 "[ . 1 . 2]"
1 70 PRO 0.048 0.016 14 0 "[ . 1 . 2]"
1 71 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 LEU 0.088 0.060 10 0 "[ . 1 . 2]"
1 73 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 LEU 0.081 0.025 11 0 "[ . 1 . 2]"
1 75 ASN 0.020 0.004 10 0 "[ . 1 . 2]"
1 76 GLY 0.006 0.002 13 0 "[ . 1 . 2]"
1 77 VAL 0.013 0.004 12 0 "[ . 1 . 2]"
1 78 ARG 0.003 0.002 17 0 "[ . 1 . 2]"
1 79 PHE 0.037 0.010 15 0 "[ . 1 . 2]"
1 80 LYS 0.030 0.020 7 0 "[ . 1 . 2]"
1 81 ARG 0.004 0.003 16 0 "[ . 1 . 2]"
1 82 ILE 0.190 0.061 14 0 "[ . 1 . 2]"
1 83 SER 0.065 0.023 17 0 "[ . 1 . 2]"
1 84 GLY 0.042 0.023 17 0 "[ . 1 . 2]"
1 85 THR 0.051 0.019 17 0 "[ . 1 . 2]"
1 86 SER 0.045 0.028 15 0 "[ . 1 . 2]"
1 87 ILE 0.056 0.032 15 0 "[ . 1 . 2]"
1 88 ALA 0.035 0.012 17 0 "[ . 1 . 2]"
1 89 PHE 0.033 0.028 15 0 "[ . 1 . 2]"
1 90 LYS 0.087 0.032 15 0 "[ . 1 . 2]"
1 91 ASN 0.038 0.016 15 0 "[ . 1 . 2]"
1 92 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 LYS 0.010 0.005 15 0 "[ . 1 . 2]"
1 96 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 ALA 0.002 0.002 7 0 "[ . 1 . 2]"
1 98 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 GLU 0.004 0.002 18 0 "[ . 1 . 2]"
1 100 LEU 0.001 0.001 17 0 "[ . 1 . 2]"
1 101 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 LEU 0.007 0.003 12 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 SER QB 1 4 GLY H . . 4.110 3.232 2.157 3.875 . 0 0 "[ . 1 . 2]" 1
2 1 8 ARG H 1 8 ARG QB . . 3.830 2.497 2.212 3.232 . 0 0 "[ . 1 . 2]" 1
3 1 8 ARG H 1 8 ARG QG . . 4.550 3.144 1.934 4.035 . 0 0 "[ . 1 . 2]" 1
4 1 8 ARG H 1 9 PHE H . . 4.690 3.975 2.173 4.615 . 0 0 "[ . 1 . 2]" 1
5 1 8 ARG HA 1 8 ARG QD . . 4.630 3.549 2.196 4.260 . 0 0 "[ . 1 . 2]" 1
6 1 8 ARG QB 1 9 PHE H . . 4.430 2.982 2.017 3.904 . 0 0 "[ . 1 . 2]" 1
7 1 9 PHE H 1 9 PHE QB . . 3.670 2.495 2.198 3.133 . 0 0 "[ . 1 . 2]" 1
8 1 9 PHE QB 1 10 THR H . . 4.160 3.443 2.391 4.029 . 0 0 "[ . 1 . 2]" 1
9 1 9 PHE HB2 1 10 THR H . . 4.870 3.971 2.475 4.600 . 0 0 "[ . 1 . 2]" 1
10 1 9 PHE HB3 1 10 THR H . . 4.870 3.970 3.113 4.655 . 0 0 "[ . 1 . 2]" 1
11 1 10 THR H 1 10 THR MG . . 4.690 3.088 1.959 3.965 . 0 0 "[ . 1 . 2]" 1
12 1 10 THR HA 1 10 THR MG . . 3.710 2.429 2.062 3.206 . 0 0 "[ . 1 . 2]" 1
13 1 10 THR HB 1 11 TRP H . . 4.200 3.203 1.935 4.325 0.125 20 0 "[ . 1 . 2]" 1
14 1 10 THR MG 1 11 TRP H . . 4.800 3.334 1.858 4.387 . 0 0 "[ . 1 . 2]" 1
15 1 11 TRP H 1 11 TRP HD1 . . 4.630 3.799 1.942 4.717 0.087 12 0 "[ . 1 . 2]" 1
16 1 11 TRP HH2 1 46 LEU QD . . 4.680 4.585 4.204 4.683 0.003 7 0 "[ . 1 . 2]" 1
17 1 11 TRP HZ2 1 46 LEU QD . . 5.440 5.206 4.293 5.442 0.002 20 0 "[ . 1 . 2]" 1
18 1 13 MET HA 1 13 MET ME . . 5.100 4.042 2.140 5.093 . 0 0 "[ . 1 . 2]" 1
19 1 13 MET HA 1 15 THR H . . 4.670 4.321 3.367 4.682 0.012 13 0 "[ . 1 . 2]" 1
20 1 13 MET ME 1 15 THR HA . . 5.500 3.938 3.522 4.252 . 0 0 "[ . 1 . 2]" 1
21 1 13 MET ME 1 15 THR HB . . 3.850 1.987 1.786 2.442 . 0 0 "[ . 1 . 2]" 1
22 1 13 MET ME 1 15 THR MG . . 3.760 2.973 1.998 3.457 . 0 0 "[ . 1 . 2]" 1
23 1 13 MET ME 1 16 THR MG . . 4.200 3.750 2.696 4.139 . 0 0 "[ . 1 . 2]" 1
24 1 13 MET ME 1 69 LEU MD1 . . 4.810 4.542 3.965 4.807 . 0 0 "[ . 1 . 2]" 1
25 1 13 MET ME 1 69 LEU QD . . 4.100 3.887 3.232 4.100 0.000 5 0 "[ . 1 . 2]" 1
26 1 13 MET ME 1 69 LEU MD2 . . 4.810 4.247 3.425 4.623 . 0 0 "[ . 1 . 2]" 1
27 1 13 MET ME 1 76 GLY QA . . 4.530 2.930 2.188 3.784 . 0 0 "[ . 1 . 2]" 1
28 1 13 MET ME 1 77 VAL H . . 4.260 2.029 1.753 2.860 . 0 0 "[ . 1 . 2]" 1
29 1 13 MET ME 1 77 VAL HB . . 3.500 2.491 1.865 3.267 . 0 0 "[ . 1 . 2]" 1
30 1 13 MET ME 1 77 VAL MG2 . . 3.540 3.266 2.500 3.543 0.003 20 0 "[ . 1 . 2]" 1
31 1 13 MET ME 1 97 ALA HA . . 5.500 5.223 4.478 5.498 . 0 0 "[ . 1 . 2]" 1
32 1 13 MET ME 1 97 ALA MB . . 4.920 4.591 3.947 4.922 0.002 7 0 "[ . 1 . 2]" 1
33 1 13 MET ME 1 100 LEU MD1 . . 4.480 4.306 3.815 4.479 . 0 0 "[ . 1 . 2]" 1
34 1 14 LYS H 1 14 LYS QG . . 4.240 2.939 1.892 4.045 . 0 0 "[ . 1 . 2]" 1
35 1 14 LYS H 1 15 THR H . . 4.250 2.513 1.834 3.452 . 0 0 "[ . 1 . 2]" 1
36 1 14 LYS QB 1 14 LYS QE . . 4.530 3.045 2.013 3.784 . 0 0 "[ . 1 . 2]" 1
37 1 15 THR H 1 15 THR MG . . 4.380 3.809 3.736 3.970 . 0 0 "[ . 1 . 2]" 1
38 1 15 THR HA 1 15 THR MG . . 3.560 2.344 2.224 2.526 . 0 0 "[ . 1 . 2]" 1
39 1 15 THR HA 1 16 THR H . . 3.460 2.238 2.141 2.793 . 0 0 "[ . 1 . 2]" 1
40 1 15 THR HA 1 16 THR MG . . 4.490 4.093 3.580 4.399 . 0 0 "[ . 1 . 2]" 1
41 1 15 THR HB 1 16 THR H . . 4.380 4.180 3.838 4.383 0.003 20 0 "[ . 1 . 2]" 1
42 1 15 THR HB 1 77 VAL HB . . 4.380 4.055 3.300 4.384 0.004 12 0 "[ . 1 . 2]" 1
43 1 15 THR HB 1 77 VAL MG1 . . 5.500 5.281 4.725 5.478 . 0 0 "[ . 1 . 2]" 1
44 1 15 THR HB 1 77 VAL MG2 . . 4.920 4.333 3.584 4.921 0.001 13 0 "[ . 1 . 2]" 1
45 1 15 THR HB 1 100 LEU MD1 . . 4.810 4.253 3.311 4.811 0.001 17 0 "[ . 1 . 2]" 1
46 1 15 THR MG 1 16 THR H . . 4.120 2.663 1.909 4.076 . 0 0 "[ . 1 . 2]" 1
47 1 15 THR MG 1 24 MET ME . . 4.760 4.164 3.418 4.680 . 0 0 "[ . 1 . 2]" 1
48 1 15 THR MG 1 77 VAL HB . . 4.120 3.928 3.632 4.116 . 0 0 "[ . 1 . 2]" 1
49 1 15 THR MG 1 77 VAL MG1 . . 5.050 4.768 4.520 5.016 . 0 0 "[ . 1 . 2]" 1
50 1 15 THR MG 1 77 VAL MG2 . . 3.850 3.312 2.772 3.768 . 0 0 "[ . 1 . 2]" 1
51 1 15 THR MG 1 79 PHE QE . . 4.800 4.337 3.383 4.754 . 0 0 "[ . 1 . 2]" 1
52 1 15 THR MG 1 97 ALA HA . . 4.490 3.518 2.386 4.418 . 0 0 "[ . 1 . 2]" 1
53 1 15 THR MG 1 100 LEU HB2 . . 4.250 3.588 2.635 4.231 . 0 0 "[ . 1 . 2]" 1
54 1 15 THR MG 1 100 LEU MD1 . . 3.450 2.713 1.773 3.427 . 0 0 "[ . 1 . 2]" 1
55 1 15 THR MG 1 102 LEU HB2 . . 5.050 3.527 2.936 4.002 . 0 0 "[ . 1 . 2]" 1
56 1 15 THR MG 1 102 LEU QB . . 4.200 3.429 2.869 3.856 . 0 0 "[ . 1 . 2]" 1
57 1 15 THR MG 1 102 LEU HB3 . . 5.050 4.682 4.029 5.050 0.000 15 0 "[ . 1 . 2]" 1
58 1 15 THR MG 1 102 LEU MD1 . . 3.840 2.818 2.082 3.544 . 0 0 "[ . 1 . 2]" 1
59 1 16 THR H 1 16 THR MG . . 4.000 3.103 1.902 3.645 . 0 0 "[ . 1 . 2]" 1
60 1 16 THR HA 1 16 THR MG . . 3.590 2.217 2.005 2.481 . 0 0 "[ . 1 . 2]" 1
61 1 16 THR HA 1 76 GLY QA . . 4.390 2.794 2.199 3.363 . 0 0 "[ . 1 . 2]" 1
62 1 16 THR HB 1 17 SER H . . 3.810 2.761 1.915 3.364 . 0 0 "[ . 1 . 2]" 1
63 1 16 THR HB 1 69 LEU QD . . 4.600 3.789 2.948 4.547 . 0 0 "[ . 1 . 2]" 1
64 1 16 THR HB 1 74 LEU QB . . 3.900 3.027 2.041 3.853 . 0 0 "[ . 1 . 2]" 1
65 1 16 THR HB 1 74 LEU MD1 . . 4.550 3.187 2.182 4.551 0.001 14 0 "[ . 1 . 2]" 1
66 1 16 THR HB 1 74 LEU QD . . 3.580 2.709 1.990 3.240 . 0 0 "[ . 1 . 2]" 1
67 1 16 THR HB 1 74 LEU MD2 . . 4.550 3.468 2.260 4.402 . 0 0 "[ . 1 . 2]" 1
68 1 16 THR MG 1 69 LEU MD1 . . 4.200 2.388 1.754 3.439 . 0 0 "[ . 1 . 2]" 1
69 1 16 THR MG 1 69 LEU QD . . 3.190 2.282 1.745 2.807 . 0 0 "[ . 1 . 2]" 1
70 1 16 THR MG 1 69 LEU MD2 . . 4.200 3.561 2.207 4.201 0.001 15 0 "[ . 1 . 2]" 1
71 1 16 THR MG 1 69 LEU HG . . 5.100 4.346 3.283 4.997 . 0 0 "[ . 1 . 2]" 1
72 1 16 THR MG 1 74 LEU QB . . 4.280 3.296 2.441 4.094 . 0 0 "[ . 1 . 2]" 1
73 1 16 THR MG 1 74 LEU QD . . 3.480 2.879 1.834 3.480 . 0 0 "[ . 1 . 2]" 1
74 1 16 THR MG 1 76 GLY HA2 . . 4.380 3.808 2.387 4.379 . 0 0 "[ . 1 . 2]" 1
75 1 16 THR MG 1 76 GLY HA3 . . 4.380 3.670 2.824 4.374 . 0 0 "[ . 1 . 2]" 1
76 1 17 SER H 1 24 MET ME . . 4.380 3.985 3.335 4.382 0.002 13 0 "[ . 1 . 2]" 1
77 1 17 SER H 1 75 ASN H . . 4.310 3.834 3.207 4.269 . 0 0 "[ . 1 . 2]" 1
78 1 17 SER H 1 77 VAL MG2 . . 5.500 5.174 4.589 5.500 . 3 0 "[ . 1 . 2]" 1
79 1 17 SER HA 1 18 SER H . . 3.520 2.361 2.138 3.534 0.014 15 0 "[ . 1 . 2]" 1
80 1 17 SER QB 1 19 MET H . . 4.750 3.542 2.713 4.557 . 0 0 "[ . 1 . 2]" 1
81 1 17 SER QB 1 24 MET ME . . 3.330 2.744 2.239 3.332 0.002 13 0 "[ . 1 . 2]" 1
82 1 17 SER QB 1 75 ASN H . . 5.210 4.499 3.606 5.154 . 0 0 "[ . 1 . 2]" 1
83 1 17 SER QB 1 102 LEU QB . . 3.340 2.229 1.831 2.641 . 0 0 "[ . 1 . 2]" 1
84 1 17 SER QB 1 102 LEU MD1 . . 3.890 2.572 1.962 3.637 . 0 0 "[ . 1 . 2]" 1
85 1 17 SER QB 1 102 LEU MD2 . . 4.300 3.026 2.024 4.092 . 0 0 "[ . 1 . 2]" 1
86 1 17 SER HB2 1 24 MET ME . . 3.850 3.326 2.611 3.850 0.000 13 0 "[ . 1 . 2]" 1
87 1 17 SER HB2 1 102 LEU HB2 . . 5.040 3.470 2.838 5.038 . 0 0 "[ . 1 . 2]" 1
88 1 17 SER HB2 1 102 LEU HB3 . . 5.040 2.512 2.002 3.916 . 0 0 "[ . 1 . 2]" 1
89 1 17 SER HB2 1 102 LEU MD1 . . 4.580 2.943 1.975 4.200 . 0 0 "[ . 1 . 2]" 1
90 1 17 SER HB2 1 102 LEU MD2 . . 4.930 3.318 2.051 4.484 . 0 0 "[ . 1 . 2]" 1
91 1 17 SER HB3 1 24 MET ME . . 3.850 3.029 2.357 3.752 . 0 0 "[ . 1 . 2]" 1
92 1 17 SER HB3 1 102 LEU HB2 . . 5.040 4.171 2.636 5.034 . 0 0 "[ . 1 . 2]" 1
93 1 17 SER HB3 1 102 LEU HB3 . . 5.040 3.236 2.049 4.054 . 0 0 "[ . 1 . 2]" 1
94 1 17 SER HB3 1 102 LEU MD1 . . 4.580 3.280 2.087 4.321 . 0 0 "[ . 1 . 2]" 1
95 1 17 SER HB3 1 102 LEU MD2 . . 4.930 3.693 2.843 4.725 . 0 0 "[ . 1 . 2]" 1
96 1 18 SER H 1 19 MET H . . 3.950 2.967 2.053 3.934 . 0 0 "[ . 1 . 2]" 1
97 1 18 SER HA 1 74 LEU QD . . 3.650 2.611 1.912 3.620 . 0 0 "[ . 1 . 2]" 1
98 1 18 SER QB 1 74 LEU QD . . 3.460 2.617 1.781 3.378 . 0 0 "[ . 1 . 2]" 1
99 1 19 MET H 1 19 MET QB . . 3.680 2.814 2.210 3.380 . 0 0 "[ . 1 . 2]" 1
100 1 19 MET H 1 19 MET HG2 . . 4.490 3.146 1.902 4.314 . 0 0 "[ . 1 . 2]" 1
101 1 19 MET H 1 19 MET QG . . 3.950 2.794 1.890 3.918 . 0 0 "[ . 1 . 2]" 1
102 1 19 MET H 1 19 MET HG3 . . 4.490 3.535 2.583 4.495 0.005 18 0 "[ . 1 . 2]" 1
103 1 19 MET HA 1 19 MET ME . . 5.210 4.763 3.960 5.218 0.008 20 0 "[ . 1 . 2]" 1
104 1 19 MET HA 1 19 MET HG2 . . 4.060 3.307 2.315 3.871 . 0 0 "[ . 1 . 2]" 1
105 1 19 MET HA 1 19 MET QG . . 3.540 2.975 2.269 3.386 . 0 0 "[ . 1 . 2]" 1
106 1 19 MET HA 1 19 MET HG3 . . 4.060 3.535 2.574 4.194 0.134 19 0 "[ . 1 . 2]" 1
107 1 19 MET HA 1 20 ASP H . . 3.190 2.398 2.157 2.617 . 0 0 "[ . 1 . 2]" 1
108 1 19 MET HA 1 20 ASP QB . . 4.650 4.518 4.231 4.652 0.002 4 0 "[ . 1 . 2]" 1
109 1 19 MET QB 1 20 ASP H . . 4.120 2.549 2.011 3.475 . 0 0 "[ . 1 . 2]" 1
110 1 19 MET ME 1 19 MET QG . . 3.480 2.209 1.981 2.620 . 0 0 "[ . 1 . 2]" 1
111 1 19 MET ME 1 20 ASP H . . 4.800 4.596 4.148 4.791 . 0 0 "[ . 1 . 2]" 1
112 1 19 MET ME 1 23 ASP H . . 5.380 4.373 3.568 5.320 . 0 0 "[ . 1 . 2]" 1
113 1 19 MET ME 1 23 ASP QB . . 3.470 2.230 1.709 3.024 . 0 0 "[ . 1 . 2]" 1
114 1 19 MET ME 1 24 MET H . . 4.550 3.514 2.461 4.507 . 0 0 "[ . 1 . 2]" 1
115 1 19 MET ME 1 24 MET HA . . 4.000 3.219 2.298 3.988 . 0 0 "[ . 1 . 2]" 1
116 1 19 MET ME 1 24 MET QG . . 3.740 2.813 1.937 3.741 0.001 13 0 "[ . 1 . 2]" 1
117 1 19 MET ME 1 27 GLU H . . 5.500 4.697 3.902 5.285 . 0 0 "[ . 1 . 2]" 1
118 1 19 MET ME 1 102 LEU HA . . 4.180 3.855 3.155 4.177 . 0 0 "[ . 1 . 2]" 1
119 1 19 MET ME 1 102 LEU MD2 . . 3.310 2.362 1.790 3.096 . 0 0 "[ . 1 . 2]" 1
120 1 19 MET QG 1 20 ASP H . . 4.550 3.508 2.047 4.319 . 0 0 "[ . 1 . 2]" 1
121 1 19 MET QG 1 102 LEU MD2 . . 4.690 3.896 2.617 4.636 . 0 0 "[ . 1 . 2]" 1
122 1 20 ASP H 1 20 ASP QB . . 3.380 2.329 2.148 2.778 . 0 0 "[ . 1 . 2]" 1
123 1 20 ASP HA 1 21 PRO QD . . 3.110 2.063 1.988 2.159 . 0 0 "[ . 1 . 2]" 1
124 1 20 ASP HA 1 21 PRO QG . . 4.490 3.972 3.890 4.076 . 0 0 "[ . 1 . 2]" 1
125 1 20 ASP QB 1 21 PRO HD2 . . 4.490 2.296 1.968 3.311 . 0 0 "[ . 1 . 2]" 1
126 1 20 ASP QB 1 21 PRO QD . . 3.900 2.267 1.952 3.192 . 0 0 "[ . 1 . 2]" 1
127 1 20 ASP QB 1 21 PRO HD3 . . 4.490 3.576 3.223 4.185 . 0 0 "[ . 1 . 2]" 1
128 1 20 ASP QB 1 22 SER H . . 4.800 2.565 2.253 3.505 . 0 0 "[ . 1 . 2]" 1
129 1 20 ASP QB 1 23 ASP H . . 4.180 3.147 2.875 3.673 . 0 0 "[ . 1 . 2]" 1
130 1 21 PRO HA 1 24 MET H . . 4.060 3.202 2.928 3.515 . 0 0 "[ . 1 . 2]" 1
131 1 21 PRO HA 1 24 MET HA . . 5.210 5.059 4.842 5.210 . 0 0 "[ . 1 . 2]" 1
132 1 21 PRO HA 1 24 MET QB . . 3.430 2.480 2.000 3.020 . 0 0 "[ . 1 . 2]" 1
133 1 21 PRO HA 1 24 MET ME . . 4.630 4.218 3.861 4.527 . 0 0 "[ . 1 . 2]" 1
134 1 21 PRO HA 1 24 MET QG . . 3.810 2.948 2.162 3.752 . 0 0 "[ . 1 . 2]" 1
135 1 21 PRO HA 1 25 MET H . . 4.800 4.383 3.869 4.785 . 0 0 "[ . 1 . 2]" 1
136 1 21 PRO HA 1 66 VAL HB . . 5.280 4.532 3.973 5.217 . 0 0 "[ . 1 . 2]" 1
137 1 21 PRO HA 1 66 VAL MG1 . . 3.590 2.433 2.004 2.814 . 0 0 "[ . 1 . 2]" 1
138 1 21 PRO QB 1 22 SER H . . 4.000 3.263 2.916 3.519 . 0 0 "[ . 1 . 2]" 1
139 1 21 PRO QB 1 24 MET QB . . 5.030 3.754 3.558 3.886 . 0 0 "[ . 1 . 2]" 1
140 1 21 PRO QB 1 24 MET ME . . 4.800 4.719 4.424 4.804 0.004 15 0 "[ . 1 . 2]" 1
141 1 21 PRO QB 1 45 PHE QD . . 5.030 3.897 2.909 4.673 . 0 0 "[ . 1 . 2]" 1
142 1 21 PRO QB 1 45 PHE QE . . 3.860 3.318 2.611 3.688 . 0 0 "[ . 1 . 2]" 1
143 1 21 PRO QB 1 45 PHE HZ . . 4.810 4.331 3.666 4.810 0.000 20 0 "[ . 1 . 2]" 1
144 1 21 PRO QB 1 66 VAL MG1 . . 3.320 2.082 1.812 2.513 . 0 0 "[ . 1 . 2]" 1
145 1 21 PRO QB 1 75 ASN QB . . 5.240 3.240 2.417 4.282 . 0 0 "[ . 1 . 2]" 1
146 1 21 PRO QD 1 22 SER H . . 4.120 2.639 2.601 2.718 . 0 0 "[ . 1 . 2]" 1
147 1 21 PRO QD 1 75 ASN QD . . 3.500 2.138 1.778 2.699 . 0 0 "[ . 1 . 2]" 1
148 1 21 PRO HD2 1 22 SER H . . 4.800 2.687 2.646 2.773 . 0 0 "[ . 1 . 2]" 1
149 1 21 PRO HD2 1 75 ASN HD21 . . 5.040 4.292 3.700 4.908 . 0 0 "[ . 1 . 2]" 1
150 1 21 PRO HD2 1 75 ASN HD22 . . 5.040 3.955 3.406 5.039 . 0 0 "[ . 1 . 2]" 1
151 1 21 PRO HD3 1 22 SER H . . 4.800 3.858 3.835 3.909 . 0 0 "[ . 1 . 2]" 1
152 1 21 PRO HD3 1 75 ASN HD21 . . 5.040 2.712 1.965 3.313 . 0 0 "[ . 1 . 2]" 1
153 1 21 PRO HD3 1 75 ASN HD22 . . 5.040 2.365 1.901 3.814 . 0 0 "[ . 1 . 2]" 1
154 1 21 PRO QG 1 22 SER H . . 4.460 2.457 2.000 2.860 . 0 0 "[ . 1 . 2]" 1
155 1 21 PRO QG 1 45 PHE QE . . 4.990 4.002 2.998 4.527 . 0 0 "[ . 1 . 2]" 1
156 1 21 PRO QG 1 45 PHE HZ . . 4.800 4.190 3.309 4.660 . 0 0 "[ . 1 . 2]" 1
157 1 21 PRO QG 1 75 ASN QD . . 4.170 2.861 1.935 3.739 . 0 0 "[ . 1 . 2]" 1
158 1 22 SER H 1 22 SER HB2 . . 3.740 2.525 2.219 3.590 . 0 0 "[ . 1 . 2]" 1
159 1 22 SER H 1 22 SER HB3 . . 3.740 3.068 2.448 3.589 . 0 0 "[ . 1 . 2]" 1
160 1 22 SER H 1 23 ASP H . . 3.750 2.680 2.451 2.868 . 0 0 "[ . 1 . 2]" 1
161 1 22 SER HA 1 25 MET H . . 4.630 4.073 3.792 4.401 . 0 0 "[ . 1 . 2]" 1
162 1 22 SER HA 1 25 MET HB2 . . 4.380 3.667 3.193 4.015 . 0 0 "[ . 1 . 2]" 1
163 1 22 SER HA 1 25 MET HB3 . . 5.500 5.260 4.794 5.494 . 0 0 "[ . 1 . 2]" 1
164 1 22 SER HA 1 45 PHE QE . . 4.120 2.826 2.033 3.974 . 0 0 "[ . 1 . 2]" 1
165 1 22 SER QB 1 23 ASP H . . 3.950 2.851 2.234 3.560 . 0 0 "[ . 1 . 2]" 1
166 1 22 SER QB 1 23 ASP QB . . 5.180 4.286 3.682 4.965 . 0 0 "[ . 1 . 2]" 1
167 1 22 SER QB 1 45 PHE QE . . 5.340 4.441 3.597 5.292 . 0 0 "[ . 1 . 2]" 1
168 1 22 SER HB2 1 23 ASP H . . 4.490 3.431 2.284 4.139 . 0 0 "[ . 1 . 2]" 1
169 1 22 SER HB3 1 23 ASP H . . 4.490 3.338 2.398 4.119 . 0 0 "[ . 1 . 2]" 1
170 1 23 ASP H 1 23 ASP HB2 . . 3.850 2.369 2.198 2.618 . 0 0 "[ . 1 . 2]" 1
171 1 23 ASP H 1 23 ASP HB3 . . 3.850 3.307 2.531 3.653 . 0 0 "[ . 1 . 2]" 1
172 1 23 ASP H 1 24 MET H . . 3.480 2.422 2.237 2.704 . 0 0 "[ . 1 . 2]" 1
173 1 23 ASP H 1 25 MET H . . 4.930 4.347 4.003 4.669 . 0 0 "[ . 1 . 2]" 1
174 1 23 ASP HA 1 26 ARG H . . 4.050 3.493 3.021 3.776 . 0 0 "[ . 1 . 2]" 1
175 1 23 ASP HA 1 26 ARG HB2 . . 4.550 3.244 2.686 3.963 . 0 0 "[ . 1 . 2]" 1
176 1 23 ASP HA 1 26 ARG QB . . 3.880 2.970 2.658 3.278 . 0 0 "[ . 1 . 2]" 1
177 1 23 ASP HA 1 26 ARG HB3 . . 4.550 3.730 2.887 4.430 . 0 0 "[ . 1 . 2]" 1
178 1 23 ASP HA 1 26 ARG QD . . 4.380 3.663 2.255 4.293 . 0 0 "[ . 1 . 2]" 1
179 1 23 ASP HB2 1 24 MET H . . 4.380 3.110 2.568 3.951 . 0 0 "[ . 1 . 2]" 1
180 1 23 ASP HB3 1 24 MET H . . 4.380 3.329 2.309 3.932 . 0 0 "[ . 1 . 2]" 1
181 1 24 MET H 1 24 MET HB2 . . 4.110 2.290 2.179 2.538 . 0 0 "[ . 1 . 2]" 1
182 1 24 MET H 1 24 MET QB . . 3.520 2.262 2.158 2.490 . 0 0 "[ . 1 . 2]" 1
183 1 24 MET H 1 24 MET HB3 . . 4.110 3.542 3.482 3.598 . 0 0 "[ . 1 . 2]" 1
184 1 24 MET H 1 24 MET ME . . 5.170 4.980 4.761 5.097 . 0 0 "[ . 1 . 2]" 1
185 1 24 MET H 1 24 MET QG . . 3.420 2.630 2.130 3.019 . 0 0 "[ . 1 . 2]" 1
186 1 24 MET H 1 25 MET H . . 3.750 2.901 2.622 3.137 . 0 0 "[ . 1 . 2]" 1
187 1 24 MET H 1 66 VAL MG1 . . 4.690 4.371 3.924 4.693 0.003 4 0 "[ . 1 . 2]" 1
188 1 24 MET HA 1 24 MET QG . . 3.520 2.389 2.285 2.635 . 0 0 "[ . 1 . 2]" 1
189 1 24 MET HA 1 27 GLU H . . 4.200 3.449 2.960 3.635 . 0 0 "[ . 1 . 2]" 1
190 1 24 MET HA 1 27 GLU QB . . 4.200 2.822 2.280 3.694 . 0 0 "[ . 1 . 2]" 1
191 1 24 MET HA 1 102 LEU MD2 . . 3.620 2.977 2.568 3.494 . 0 0 "[ . 1 . 2]" 1
192 1 24 MET QB 1 24 MET ME . . 3.130 2.572 2.250 3.105 . 0 0 "[ . 1 . 2]" 1
193 1 24 MET QB 1 25 MET H . . 3.460 2.466 2.151 2.890 . 0 0 "[ . 1 . 2]" 1
194 1 24 MET QB 1 25 MET HA . . 4.590 3.774 3.674 3.926 . 0 0 "[ . 1 . 2]" 1
195 1 24 MET QB 1 66 VAL MG1 . . 3.760 2.433 1.934 2.828 . 0 0 "[ . 1 . 2]" 1
196 1 24 MET QB 1 66 VAL MG2 . . 3.170 2.169 1.846 2.827 . 0 0 "[ . 1 . 2]" 1
197 1 24 MET HB2 1 24 MET ME . . 3.850 3.453 3.197 3.802 . 0 0 "[ . 1 . 2]" 1
198 1 24 MET HB2 1 25 MET H . . 4.000 2.586 2.195 3.057 . 0 0 "[ . 1 . 2]" 1
199 1 24 MET HB3 1 24 MET ME . . 3.850 2.660 2.296 3.292 . 0 0 "[ . 1 . 2]" 1
200 1 24 MET HB3 1 25 MET H . . 4.000 3.136 2.727 3.558 . 0 0 "[ . 1 . 2]" 1
201 1 24 MET ME 1 24 MET QG . . 3.520 2.190 2.036 2.317 . 0 0 "[ . 1 . 2]" 1
202 1 24 MET ME 1 66 VAL MG1 . . 3.520 2.388 1.988 2.850 . 0 0 "[ . 1 . 2]" 1
203 1 24 MET ME 1 75 ASN H . . 5.400 5.029 4.435 5.397 . 0 0 "[ . 1 . 2]" 1
204 1 24 MET ME 1 75 ASN HB2 . . 4.200 3.462 2.619 4.167 . 0 0 "[ . 1 . 2]" 1
205 1 24 MET ME 1 75 ASN QB . . 3.510 3.056 2.594 3.511 0.001 7 0 "[ . 1 . 2]" 1
206 1 24 MET ME 1 75 ASN HB3 . . 4.200 3.580 2.627 4.202 0.002 17 0 "[ . 1 . 2]" 1
207 1 24 MET ME 1 76 GLY H . . 4.630 4.158 3.136 4.632 0.002 13 0 "[ . 1 . 2]" 1
208 1 24 MET ME 1 76 GLY QA . . 4.140 2.968 2.295 3.673 . 0 0 "[ . 1 . 2]" 1
209 1 24 MET ME 1 77 VAL MG1 . . 4.380 3.680 3.434 3.896 . 0 0 "[ . 1 . 2]" 1
210 1 24 MET ME 1 77 VAL MG2 . . 2.900 1.764 1.668 1.942 . 0 0 "[ . 1 . 2]" 1
211 1 24 MET ME 1 79 PHE QE . . 5.500 5.495 5.396 5.510 0.010 15 0 "[ . 1 . 2]" 1
212 1 24 MET QG 1 77 VAL MG2 . . 4.920 4.001 3.271 4.422 . 0 0 "[ . 1 . 2]" 1
213 1 24 MET QG 1 102 LEU MD1 . . 4.380 3.418 2.152 4.324 . 0 0 "[ . 1 . 2]" 1
214 1 24 MET QG 1 102 LEU MD2 . . 3.440 2.828 1.920 3.441 0.001 19 0 "[ . 1 . 2]" 1
215 1 25 MET H 1 25 MET HB2 . . 3.420 2.345 2.205 2.596 . 0 0 "[ . 1 . 2]" 1
216 1 25 MET H 1 25 MET HB3 . . 3.830 3.565 3.507 3.615 . 0 0 "[ . 1 . 2]" 1
217 1 25 MET H 1 25 MET ME . . 5.500 4.799 3.883 5.100 . 0 0 "[ . 1 . 2]" 1
218 1 25 MET H 1 25 MET HG2 . . 3.950 2.716 2.088 3.624 . 0 0 "[ . 1 . 2]" 1
219 1 25 MET H 1 25 MET QG . . 3.300 2.527 2.074 2.864 . 0 0 "[ . 1 . 2]" 1
220 1 25 MET H 1 25 MET HG3 . . 3.950 3.535 2.671 3.914 . 0 0 "[ . 1 . 2]" 1
221 1 25 MET H 1 26 ARG H . . 3.750 2.835 2.401 3.054 . 0 0 "[ . 1 . 2]" 1
222 1 25 MET H 1 27 GLU H . . 5.250 4.553 3.966 4.911 . 0 0 "[ . 1 . 2]" 1
223 1 25 MET H 1 66 VAL MG1 . . 4.860 4.250 3.734 4.777 . 0 0 "[ . 1 . 2]" 1
224 1 25 MET HA 1 25 MET ME . . 3.950 3.355 1.955 3.881 . 0 0 "[ . 1 . 2]" 1
225 1 25 MET HA 1 25 MET HG2 . . 4.140 2.640 2.197 2.952 . 0 0 "[ . 1 . 2]" 1
226 1 25 MET HA 1 25 MET HG3 . . 4.140 3.567 3.197 3.738 . 0 0 "[ . 1 . 2]" 1
227 1 25 MET HA 1 28 ILE H . . 4.180 3.908 3.487 4.178 . 0 0 "[ . 1 . 2]" 1
228 1 25 MET HA 1 28 ILE HB . . 3.400 2.853 2.483 3.357 . 0 0 "[ . 1 . 2]" 1
229 1 25 MET HA 1 28 ILE MD . . 3.490 2.444 2.018 3.027 . 0 0 "[ . 1 . 2]" 1
230 1 25 MET HA 1 28 ILE MG . . 4.490 4.023 3.751 4.474 . 0 0 "[ . 1 . 2]" 1
231 1 25 MET HA 1 66 VAL MG2 . . 4.490 3.424 3.205 3.695 . 0 0 "[ . 1 . 2]" 1
232 1 25 MET HB2 1 25 MET ME . . 3.900 3.740 3.457 3.947 0.047 17 0 "[ . 1 . 2]" 1
233 1 25 MET HB2 1 26 ARG H . . 3.830 2.801 2.449 3.073 . 0 0 "[ . 1 . 2]" 1
234 1 25 MET HB3 1 26 ARG H . . 3.570 3.467 3.312 3.566 . 0 0 "[ . 1 . 2]" 1
235 1 25 MET ME 1 25 MET HG2 . . 3.710 2.940 2.111 3.375 . 0 0 "[ . 1 . 2]" 1
236 1 25 MET ME 1 25 MET QG . . 3.200 2.217 2.079 2.365 . 0 0 "[ . 1 . 2]" 1
237 1 25 MET ME 1 25 MET HG3 . . 3.710 2.621 2.105 3.340 . 0 0 "[ . 1 . 2]" 1
238 1 25 MET ME 1 29 ARG QD . . 4.690 3.860 3.115 4.564 . 0 0 "[ . 1 . 2]" 1
239 1 25 MET ME 1 41 GLN QE . . 3.830 3.233 1.998 3.837 0.007 14 0 "[ . 1 . 2]" 1
240 1 25 MET ME 1 41 GLN QG . . 4.470 4.070 3.408 4.473 0.003 17 0 "[ . 1 . 2]" 1
241 1 25 MET ME 1 45 PHE HA . . 3.320 2.336 2.119 2.791 . 0 0 "[ . 1 . 2]" 1
242 1 25 MET ME 1 45 PHE QB . . 4.010 3.757 3.049 4.012 0.002 12 0 "[ . 1 . 2]" 1
243 1 25 MET ME 1 45 PHE QD . . 4.060 3.281 2.434 4.050 . 0 0 "[ . 1 . 2]" 1
244 1 25 MET ME 1 46 LEU H . . 4.060 3.416 2.773 4.050 . 0 0 "[ . 1 . 2]" 1
245 1 25 MET ME 1 47 LEU H . . 4.770 4.492 4.068 4.672 . 0 0 "[ . 1 . 2]" 1
246 1 25 MET ME 1 47 LEU HA . . 5.370 4.608 4.325 5.112 . 0 0 "[ . 1 . 2]" 1
247 1 25 MET ME 1 47 LEU HB2 . . 4.630 4.285 3.656 4.599 . 0 0 "[ . 1 . 2]" 1
248 1 25 MET ME 1 47 LEU HB3 . . 4.920 4.671 4.382 4.903 . 0 0 "[ . 1 . 2]" 1
249 1 25 MET ME 1 47 LEU MD1 . . 3.580 2.185 1.946 2.539 . 0 0 "[ . 1 . 2]" 1
250 1 25 MET ME 1 47 LEU QD . . 3.040 2.013 1.780 2.241 . 0 0 "[ . 1 . 2]" 1
251 1 25 MET ME 1 47 LEU MD2 . . 3.580 2.543 1.875 3.578 . 0 0 "[ . 1 . 2]" 1
252 1 25 MET ME 1 47 LEU HG . . 3.190 2.292 1.985 2.702 . 0 0 "[ . 1 . 2]" 1
253 1 25 MET ME 1 66 VAL H . . 5.500 4.803 3.651 5.392 . 0 0 "[ . 1 . 2]" 1
254 1 25 MET ME 1 66 VAL MG2 . . 4.340 3.948 2.801 4.342 0.002 20 0 "[ . 1 . 2]" 1
255 1 25 MET QG 1 45 PHE HA . . 4.390 3.511 2.794 4.319 . 0 0 "[ . 1 . 2]" 1
256 1 25 MET QG 1 45 PHE QD . . 3.420 2.214 1.853 2.831 . 0 0 "[ . 1 . 2]" 1
257 1 25 MET QG 1 45 PHE QE . . 3.430 2.756 2.016 3.406 . 0 0 "[ . 1 . 2]" 1
258 1 25 MET QG 1 45 PHE HZ . . 5.340 4.758 3.835 5.342 0.002 15 0 "[ . 1 . 2]" 1
259 1 25 MET QG 1 66 VAL HB . . 3.990 3.657 3.137 3.985 . 0 0 "[ . 1 . 2]" 1
260 1 25 MET QG 1 66 VAL MG1 . . 4.530 4.063 3.357 4.529 . 0 0 "[ . 1 . 2]" 1
261 1 25 MET QG 1 66 VAL MG2 . . 3.780 2.704 2.270 3.102 . 0 0 "[ . 1 . 2]" 1
262 1 25 MET HG2 1 45 PHE QD . . 3.950 2.551 1.999 3.186 . 0 0 "[ . 1 . 2]" 1
263 1 25 MET HG2 1 45 PHE QE . . 4.000 3.577 2.953 4.000 0.000 12 0 "[ . 1 . 2]" 1
264 1 25 MET HG2 1 66 VAL MG2 . . 4.490 2.772 2.289 3.311 . 0 0 "[ . 1 . 2]" 1
265 1 25 MET HG3 1 45 PHE QD . . 3.950 2.511 2.014 3.170 . 0 0 "[ . 1 . 2]" 1
266 1 25 MET HG3 1 45 PHE QE . . 4.000 2.932 2.052 3.833 . 0 0 "[ . 1 . 2]" 1
267 1 25 MET HG3 1 66 VAL MG2 . . 4.490 3.948 2.635 4.493 0.003 14 0 "[ . 1 . 2]" 1
268 1 26 ARG H 1 26 ARG HB2 . . 3.740 2.365 2.185 2.758 . 0 0 "[ . 1 . 2]" 1
269 1 26 ARG H 1 26 ARG QB . . 3.090 2.232 2.164 2.386 . 0 0 "[ . 1 . 2]" 1
270 1 26 ARG H 1 26 ARG HB3 . . 3.740 2.913 2.343 3.584 . 0 0 "[ . 1 . 2]" 1
271 1 26 ARG H 1 26 ARG QD . . 4.490 4.171 2.132 4.492 0.002 14 0 "[ . 1 . 2]" 1
272 1 26 ARG H 1 26 ARG HG2 . . 4.640 4.361 3.280 4.647 0.007 17 0 "[ . 1 . 2]" 1
273 1 26 ARG H 1 26 ARG HG3 . . 4.640 3.981 2.366 4.505 . 0 0 "[ . 1 . 2]" 1
274 1 26 ARG H 1 27 GLU H . . 3.640 2.726 2.303 2.973 . 0 0 "[ . 1 . 2]" 1
275 1 26 ARG HA 1 26 ARG QD . . 4.120 3.851 2.829 4.052 . 0 0 "[ . 1 . 2]" 1
276 1 26 ARG HA 1 26 ARG HG2 . . 4.200 3.015 2.318 3.587 . 0 0 "[ . 1 . 2]" 1
277 1 26 ARG HA 1 26 ARG QG . . 3.420 2.299 2.167 2.536 . 0 0 "[ . 1 . 2]" 1
278 1 26 ARG HA 1 26 ARG HG3 . . 4.200 2.490 2.204 3.304 . 0 0 "[ . 1 . 2]" 1
279 1 26 ARG HA 1 27 GLU HA . . 4.800 4.792 4.721 4.819 0.019 18 0 "[ . 1 . 2]" 1
280 1 26 ARG HA 1 29 ARG H . . 4.490 3.934 3.602 4.449 . 0 0 "[ . 1 . 2]" 1
281 1 26 ARG HA 1 29 ARG QB . . 4.490 3.281 2.857 3.558 . 0 0 "[ . 1 . 2]" 1
282 1 26 ARG HA 1 29 ARG QD . . 4.530 3.870 2.896 4.531 0.001 8 0 "[ . 1 . 2]" 1
283 1 26 ARG QB 1 27 GLU H . . 3.310 2.323 2.032 2.733 . 0 0 "[ . 1 . 2]" 1
284 1 26 ARG HB2 1 26 ARG QD . . 3.620 2.306 2.084 2.614 . 0 0 "[ . 1 . 2]" 1
285 1 26 ARG HB2 1 27 GLU H . . 4.000 3.334 2.480 3.797 . 0 0 "[ . 1 . 2]" 1
286 1 26 ARG HB3 1 26 ARG QD . . 3.620 2.583 2.251 3.284 . 0 0 "[ . 1 . 2]" 1
287 1 26 ARG HB3 1 27 GLU H . . 4.000 2.534 2.048 3.752 . 0 0 "[ . 1 . 2]" 1
288 1 26 ARG QD 1 27 GLU H . . 5.100 4.567 4.091 5.047 . 0 0 "[ . 1 . 2]" 1
289 1 26 ARG QG 1 27 GLU H . . 4.860 3.786 2.991 4.417 . 0 0 "[ . 1 . 2]" 1
290 1 27 GLU H 1 27 GLU QB . . 3.430 2.234 2.160 2.272 . 0 0 "[ . 1 . 2]" 1
291 1 27 GLU H 1 27 GLU HG2 . . 4.770 4.371 2.760 4.628 . 0 0 "[ . 1 . 2]" 1
292 1 27 GLU H 1 27 GLU QG . . 4.120 3.874 2.697 4.058 . 0 0 "[ . 1 . 2]" 1
293 1 27 GLU H 1 27 GLU HG3 . . 4.770 4.393 3.783 4.600 . 0 0 "[ . 1 . 2]" 1
294 1 27 GLU H 1 28 ILE H . . 3.590 2.827 2.711 2.931 . 0 0 "[ . 1 . 2]" 1
295 1 27 GLU HA 1 27 GLU HG2 . . 4.200 3.647 2.490 3.894 . 0 0 "[ . 1 . 2]" 1
296 1 27 GLU HA 1 27 GLU QG . . 3.650 2.807 2.434 3.282 . 0 0 "[ . 1 . 2]" 1
297 1 27 GLU HA 1 27 GLU HG3 . . 4.200 3.003 2.483 3.650 . 0 0 "[ . 1 . 2]" 1
298 1 27 GLU HA 1 29 ARG QB . . 5.500 5.107 4.746 5.292 . 0 0 "[ . 1 . 2]" 1
299 1 27 GLU HA 1 30 LYS HB2 . . 4.120 3.193 2.531 4.115 . 0 0 "[ . 1 . 2]" 1
300 1 27 GLU HA 1 30 LYS QB . . 3.400 2.385 2.190 2.806 . 0 0 "[ . 1 . 2]" 1
301 1 27 GLU HA 1 30 LYS HB3 . . 4.120 2.527 2.223 2.882 . 0 0 "[ . 1 . 2]" 1
302 1 27 GLU HA 1 30 LYS QD . . 4.120 3.116 2.195 3.879 . 0 0 "[ . 1 . 2]" 1
303 1 27 GLU HA 1 30 LYS QE . . 4.800 4.115 2.901 4.790 . 0 0 "[ . 1 . 2]" 1
304 1 27 GLU HA 1 30 LYS QG . . 4.380 4.021 1.924 4.374 . 0 0 "[ . 1 . 2]" 1
305 1 27 GLU HA 1 31 VAL QG . . 4.760 3.880 3.047 4.276 . 0 0 "[ . 1 . 2]" 1
306 1 27 GLU QB 1 28 ILE H . . 3.610 2.408 2.114 3.325 . 0 0 "[ . 1 . 2]" 1
307 1 27 GLU QB 1 102 LEU MD2 . . 3.770 2.616 2.109 3.526 . 0 0 "[ . 1 . 2]" 1
308 1 27 GLU QG 1 28 ILE H . . 4.580 3.343 2.026 4.309 . 0 0 "[ . 1 . 2]" 1
309 1 27 GLU QG 1 31 VAL QG . . 3.860 2.541 1.979 3.858 . 0 0 "[ . 1 . 2]" 1
310 1 27 GLU QG 1 100 LEU HA . . 4.820 3.696 3.012 4.388 . 0 0 "[ . 1 . 2]" 1
311 1 27 GLU QG 1 100 LEU MD2 . . 4.290 2.764 2.154 3.689 . 0 0 "[ . 1 . 2]" 1
312 1 27 GLU QG 1 101 LYS H . . 4.630 3.494 3.075 4.314 . 0 0 "[ . 1 . 2]" 1
313 1 27 GLU QG 1 102 LEU MD1 . . 3.820 3.665 3.233 3.820 . 0 0 "[ . 1 . 2]" 1
314 1 27 GLU QG 1 102 LEU MD2 . . 3.390 2.272 1.780 3.133 . 0 0 "[ . 1 . 2]" 1
315 1 27 GLU HG2 1 101 LYS H . . 5.400 3.989 3.338 5.352 . 0 0 "[ . 1 . 2]" 1
316 1 27 GLU HG2 1 102 LEU MD2 . . 4.000 2.429 1.916 3.622 . 0 0 "[ . 1 . 2]" 1
317 1 27 GLU HG3 1 101 LYS H . . 5.400 3.943 3.326 4.551 . 0 0 "[ . 1 . 2]" 1
318 1 27 GLU HG3 1 102 LEU MD2 . . 4.000 3.329 1.955 4.003 0.003 12 0 "[ . 1 . 2]" 1
319 1 28 ILE H 1 28 ILE HB . . 3.080 2.539 2.424 2.633 . 0 0 "[ . 1 . 2]" 1
320 1 28 ILE H 1 28 ILE HG12 . . 4.490 3.519 3.128 3.886 . 0 0 "[ . 1 . 2]" 1
321 1 28 ILE H 1 28 ILE QG . . 3.640 2.175 1.940 2.963 . 0 0 "[ . 1 . 2]" 1
322 1 28 ILE H 1 28 ILE HG13 . . 4.490 2.199 1.957 3.073 . 0 0 "[ . 1 . 2]" 1
323 1 28 ILE H 1 28 ILE MG . . 4.280 3.769 3.744 3.783 . 0 0 "[ . 1 . 2]" 1
324 1 28 ILE H 1 29 ARG H . . 3.830 3.014 2.715 3.267 . 0 0 "[ . 1 . 2]" 1
325 1 28 ILE H 1 100 LEU MD2 . . 4.250 3.937 3.560 4.183 . 0 0 "[ . 1 . 2]" 1
326 1 28 ILE H 1 102 LEU MD2 . . 5.250 4.281 3.251 5.072 . 0 0 "[ . 1 . 2]" 1
327 1 28 ILE HA 1 28 ILE HG12 . . 4.120 2.618 2.401 3.465 . 0 0 "[ . 1 . 2]" 1
328 1 28 ILE HA 1 28 ILE QG . . 3.600 2.345 2.185 2.417 . 0 0 "[ . 1 . 2]" 1
329 1 28 ILE HA 1 28 ILE HG13 . . 4.120 2.750 2.209 3.110 . 0 0 "[ . 1 . 2]" 1
330 1 28 ILE HA 1 28 ILE MG . . 3.540 2.455 2.368 2.489 . 0 0 "[ . 1 . 2]" 1
331 1 28 ILE HA 1 31 VAL H . . 4.380 3.916 3.559 4.355 . 0 0 "[ . 1 . 2]" 1
332 1 28 ILE HA 1 31 VAL HB . . 4.000 3.352 3.041 3.800 . 0 0 "[ . 1 . 2]" 1
333 1 28 ILE HA 1 31 VAL QG . . 3.930 3.438 2.944 3.767 . 0 0 "[ . 1 . 2]" 1
334 1 28 ILE HA 1 32 LEU MD1 . . 4.630 4.062 3.596 4.461 . 0 0 "[ . 1 . 2]" 1
335 1 28 ILE HA 1 64 MET ME . . 4.380 3.838 3.378 4.207 . 0 0 "[ . 1 . 2]" 1
336 1 28 ILE HA 1 100 LEU MD1 . . 4.820 4.382 3.829 4.817 . 0 0 "[ . 1 . 2]" 1
337 1 28 ILE HA 1 100 LEU MD2 . . 3.200 2.541 2.109 2.910 . 0 0 "[ . 1 . 2]" 1
338 1 28 ILE HB 1 28 ILE MD . . 3.250 2.294 2.185 2.527 . 0 0 "[ . 1 . 2]" 1
339 1 28 ILE HB 1 29 ARG H . . 3.310 2.460 2.189 2.965 . 0 0 "[ . 1 . 2]" 1
340 1 28 ILE HB 1 32 LEU MD1 . . 4.380 4.068 3.641 4.291 . 0 0 "[ . 1 . 2]" 1
341 1 28 ILE MD 1 64 MET ME . . 3.690 2.944 2.184 3.690 . 0 0 "[ . 1 . 2]" 1
342 1 28 ILE MD 1 66 VAL MG2 . . 3.090 2.152 1.925 2.431 . 0 0 "[ . 1 . 2]" 1
343 1 28 ILE MD 1 100 LEU MD1 . . 5.500 4.222 3.491 4.714 . 0 0 "[ . 1 . 2]" 1
344 1 28 ILE QG 1 100 LEU MD1 . . 4.020 3.387 2.928 3.890 . 0 0 "[ . 1 . 2]" 1
345 1 28 ILE QG 1 100 LEU MD2 . . 3.750 2.578 2.135 3.189 . 0 0 "[ . 1 . 2]" 1
346 1 28 ILE MG 1 29 ARG H . . 4.110 3.047 2.568 3.513 . 0 0 "[ . 1 . 2]" 1
347 1 28 ILE MG 1 29 ARG HA . . 4.280 3.187 2.993 3.470 . 0 0 "[ . 1 . 2]" 1
348 1 28 ILE MG 1 29 ARG QG . . 4.450 3.131 2.809 3.607 . 0 0 "[ . 1 . 2]" 1
349 1 28 ILE MG 1 32 LEU MD1 . . 2.800 1.956 1.828 2.127 . 0 0 "[ . 1 . 2]" 1
350 1 28 ILE MG 1 32 LEU MD2 . . 3.950 3.561 3.146 3.859 . 0 0 "[ . 1 . 2]" 1
351 1 28 ILE MG 1 32 LEU HG . . 3.950 3.002 2.492 3.415 . 0 0 "[ . 1 . 2]" 1
352 1 28 ILE MG 1 47 LEU HB2 . . 4.630 3.678 2.949 4.395 . 0 0 "[ . 1 . 2]" 1
353 1 28 ILE MG 1 64 MET ME . . 2.860 2.387 1.955 2.839 . 0 0 "[ . 1 . 2]" 1
354 1 28 ILE MG 1 96 ILE MG . . 4.490 3.815 3.276 4.215 . 0 0 "[ . 1 . 2]" 1
355 1 28 ILE MG 1 100 LEU MD2 . . 4.060 3.515 2.892 4.009 . 0 0 "[ . 1 . 2]" 1
356 1 29 ARG H 1 29 ARG QB . . 3.730 2.328 2.205 2.473 . 0 0 "[ . 1 . 2]" 1
357 1 29 ARG H 1 29 ARG HG2 . . 4.000 3.739 3.313 4.000 0.000 4 0 "[ . 1 . 2]" 1
358 1 29 ARG H 1 29 ARG QG . . 3.430 2.483 2.126 2.744 . 0 0 "[ . 1 . 2]" 1
359 1 29 ARG H 1 29 ARG HG3 . . 4.000 2.522 2.152 2.795 . 0 0 "[ . 1 . 2]" 1
360 1 29 ARG H 1 30 LYS H . . 3.690 2.655 2.272 2.931 . 0 0 "[ . 1 . 2]" 1
361 1 29 ARG HA 1 29 ARG HG2 . . 3.700 2.546 2.337 2.659 . 0 0 "[ . 1 . 2]" 1
362 1 29 ARG HA 1 29 ARG HG3 . . 3.700 2.869 2.695 3.185 . 0 0 "[ . 1 . 2]" 1
363 1 29 ARG HA 1 30 LYS HA . . 5.100 4.845 4.724 4.940 . 0 0 "[ . 1 . 2]" 1
364 1 29 ARG HA 1 32 LEU H . . 4.340 3.614 3.129 4.119 . 0 0 "[ . 1 . 2]" 1
365 1 29 ARG HA 1 32 LEU HB2 . . 4.280 2.661 2.371 3.049 . 0 0 "[ . 1 . 2]" 1
366 1 29 ARG HA 1 32 LEU HB3 . . 4.630 4.231 3.888 4.579 . 0 0 "[ . 1 . 2]" 1
367 1 29 ARG HA 1 32 LEU MD1 . . 3.520 2.292 1.890 2.984 . 0 0 "[ . 1 . 2]" 1
368 1 29 ARG HA 1 32 LEU MD2 . . 5.100 4.706 4.193 5.087 . 0 0 "[ . 1 . 2]" 1
369 1 29 ARG QB 1 29 ARG QD . . 3.360 2.262 2.099 2.578 . 0 0 "[ . 1 . 2]" 1
370 1 29 ARG QB 1 30 LYS H . . 3.480 2.560 2.215 2.851 . 0 0 "[ . 1 . 2]" 1
371 1 29 ARG QB 1 39 TYR QE . . 3.950 3.324 2.366 3.762 . 0 0 "[ . 1 . 2]" 1
372 1 29 ARG QD 1 39 TYR QD . . 4.530 3.468 2.735 4.214 . 0 0 "[ . 1 . 2]" 1
373 1 29 ARG QD 1 39 TYR QE . . 3.950 3.140 2.265 3.953 0.003 5 0 "[ . 1 . 2]" 1
374 1 29 ARG QD 1 47 LEU QD . . 3.770 2.644 2.129 3.274 . 0 0 "[ . 1 . 2]" 1
375 1 29 ARG HD2 1 39 TYR QE . . 4.640 3.532 2.288 4.549 . 0 0 "[ . 1 . 2]" 1
376 1 29 ARG HD3 1 39 TYR QE . . 4.640 3.865 2.487 4.636 . 0 0 "[ . 1 . 2]" 1
377 1 29 ARG QG 1 32 LEU MD1 . . 4.040 3.175 2.585 3.683 . 0 0 "[ . 1 . 2]" 1
378 1 29 ARG QG 1 39 TYR QE . . 4.120 3.266 2.589 3.675 . 0 0 "[ . 1 . 2]" 1
379 1 29 ARG QG 1 47 LEU QD . . 3.080 2.229 1.927 2.657 . 0 0 "[ . 1 . 2]" 1
380 1 29 ARG HG2 1 47 LEU MD1 . . 4.740 2.793 2.336 3.556 . 0 0 "[ . 1 . 2]" 1
381 1 29 ARG HG2 1 47 LEU MD2 . . 4.740 3.602 2.478 4.469 . 0 0 "[ . 1 . 2]" 1
382 1 29 ARG HG3 1 47 LEU MD1 . . 4.740 2.435 2.014 3.020 . 0 0 "[ . 1 . 2]" 1
383 1 29 ARG HG3 1 47 LEU MD2 . . 4.740 3.864 3.185 4.735 . 0 0 "[ . 1 . 2]" 1
384 1 30 LYS H 1 30 LYS HB2 . . 3.590 2.595 2.205 3.510 . 0 0 "[ . 1 . 2]" 1
385 1 30 LYS H 1 30 LYS QB . . 3.040 2.218 2.140 2.275 . 0 0 "[ . 1 . 2]" 1
386 1 30 LYS H 1 30 LYS HB3 . . 3.590 2.550 2.196 2.897 . 0 0 "[ . 1 . 2]" 1
387 1 30 LYS H 1 30 LYS HG2 . . 4.690 4.311 2.845 4.527 . 0 0 "[ . 1 . 2]" 1
388 1 30 LYS H 1 30 LYS QG . . 4.080 3.818 2.780 3.987 . 0 0 "[ . 1 . 2]" 1
389 1 30 LYS H 1 30 LYS HG3 . . 4.690 4.309 2.910 4.582 . 0 0 "[ . 1 . 2]" 1
390 1 30 LYS H 1 31 VAL H . . 3.590 2.847 2.626 3.078 . 0 0 "[ . 1 . 2]" 1
391 1 30 LYS H 1 31 VAL QG . . 4.730 4.341 3.880 4.634 . 0 0 "[ . 1 . 2]" 1
392 1 30 LYS HA 1 30 LYS QD . . 4.280 4.069 3.431 4.290 0.010 5 0 "[ . 1 . 2]" 1
393 1 30 LYS HA 1 30 LYS HG2 . . 4.200 3.108 2.516 4.233 0.033 7 0 "[ . 1 . 2]" 1
394 1 30 LYS HA 1 30 LYS QG . . 3.480 2.573 2.316 3.425 . 0 0 "[ . 1 . 2]" 1
395 1 30 LYS HA 1 30 LYS HG3 . . 4.200 2.793 2.535 3.618 . 0 0 "[ . 1 . 2]" 1
396 1 30 LYS QB 1 30 LYS QD . . 3.320 2.182 2.057 2.398 . 0 0 "[ . 1 . 2]" 1
397 1 30 LYS QB 1 30 LYS QE . . 4.040 2.715 1.979 3.678 . 0 0 "[ . 1 . 2]" 1
398 1 30 LYS QB 1 31 VAL H . . 3.790 2.530 1.995 3.583 . 0 0 "[ . 1 . 2]" 1
399 1 30 LYS QB 1 31 VAL QG . . 4.170 3.232 2.880 4.051 . 0 0 "[ . 1 . 2]" 1
400 1 30 LYS HB2 1 30 LYS QD . . 3.810 2.591 2.278 2.955 . 0 0 "[ . 1 . 2]" 1
401 1 30 LYS HB2 1 30 LYS QE . . 4.630 3.236 1.999 4.237 . 0 0 "[ . 1 . 2]" 1
402 1 30 LYS HB3 1 30 LYS QD . . 3.810 2.423 2.149 3.439 . 0 0 "[ . 1 . 2]" 1
403 1 30 LYS HB3 1 30 LYS QE . . 4.630 3.226 2.169 4.037 . 0 0 "[ . 1 . 2]" 1
404 1 30 LYS QD 1 31 VAL H . . 4.690 4.299 3.421 4.690 0.000 1 0 "[ . 1 . 2]" 1
405 1 30 LYS QD 1 31 VAL QG . . 4.520 3.812 2.143 4.424 . 0 0 "[ . 1 . 2]" 1
406 1 30 LYS QE 1 31 VAL QG . . 5.340 4.067 2.173 5.341 0.001 11 0 "[ . 1 . 2]" 1
407 1 30 LYS QG 1 31 VAL HA . . 4.800 3.610 3.076 4.366 . 0 0 "[ . 1 . 2]" 1
408 1 31 VAL H 1 31 VAL HB . . 3.170 2.473 2.338 2.624 . 0 0 "[ . 1 . 2]" 1
409 1 31 VAL H 1 31 VAL QG . . 3.220 2.288 2.027 2.667 . 0 0 "[ . 1 . 2]" 1
410 1 31 VAL H 1 32 LEU H . . 3.590 2.766 2.324 3.090 . 0 0 "[ . 1 . 2]" 1
411 1 31 VAL H 1 100 LEU MD2 . . 4.690 4.420 4.036 4.665 . 0 0 "[ . 1 . 2]" 1
412 1 31 VAL HA 1 31 VAL MG1 . . 3.370 2.429 2.310 2.535 . 0 0 "[ . 1 . 2]" 1
413 1 31 VAL HA 1 31 VAL QG . . 2.880 2.098 2.034 2.156 . 0 0 "[ . 1 . 2]" 1
414 1 31 VAL HA 1 31 VAL MG2 . . 3.370 2.304 2.148 2.436 . 0 0 "[ . 1 . 2]" 1
415 1 31 VAL HA 1 34 ALA H . . 4.000 3.599 3.221 3.858 . 0 0 "[ . 1 . 2]" 1
416 1 31 VAL HA 1 34 ALA MB . . 3.290 2.759 2.519 3.092 . 0 0 "[ . 1 . 2]" 1
417 1 31 VAL HA 1 35 ASN QD . . 4.520 3.955 3.574 4.503 . 0 0 "[ . 1 . 2]" 1
418 1 31 VAL HB 1 32 LEU H . . 3.830 2.373 2.081 2.684 . 0 0 "[ . 1 . 2]" 1
419 1 31 VAL HB 1 100 LEU MD2 . . 3.450 3.008 2.750 3.315 . 0 0 "[ . 1 . 2]" 1
420 1 31 VAL QG 1 34 ALA MB . . 3.670 3.266 2.921 3.582 . 0 0 "[ . 1 . 2]" 1
421 1 31 VAL QG 1 35 ASN H . . 4.520 3.962 3.736 4.233 . 0 0 "[ . 1 . 2]" 1
422 1 31 VAL QG 1 35 ASN HB2 . . 4.900 4.059 3.697 4.403 . 0 0 "[ . 1 . 2]" 1
423 1 31 VAL QG 1 35 ASN HB3 . . 5.440 5.049 4.639 5.428 . 0 0 "[ . 1 . 2]" 1
424 1 31 VAL QG 1 35 ASN QD . . 3.240 2.115 1.748 2.612 . 0 0 "[ . 1 . 2]" 1
425 1 31 VAL QG 1 96 ILE HA . . 3.420 3.051 2.266 3.417 . 0 0 "[ . 1 . 2]" 1
426 1 31 VAL QG 1 96 ILE MD . . 3.150 2.747 2.137 3.132 . 0 0 "[ . 1 . 2]" 1
427 1 31 VAL QG 1 96 ILE MG . . 3.680 2.979 2.199 3.310 . 0 0 "[ . 1 . 2]" 1
428 1 31 VAL QG 1 99 GLU H . . 4.670 4.368 3.829 4.671 0.001 7 0 "[ . 1 . 2]" 1
429 1 31 VAL QG 1 99 GLU HA . . 4.250 3.944 3.679 4.233 . 0 0 "[ . 1 . 2]" 1
430 1 31 VAL QG 1 99 GLU QB . . 3.320 1.983 1.772 2.147 . 0 0 "[ . 1 . 2]" 1
431 1 31 VAL QG 1 99 GLU QG . . 3.930 3.106 2.428 3.559 . 0 0 "[ . 1 . 2]" 1
432 1 31 VAL QG 1 100 LEU H . . 4.200 3.154 2.793 3.587 . 0 0 "[ . 1 . 2]" 1
433 1 31 VAL QG 1 100 LEU HA . . 3.230 2.348 1.989 2.792 . 0 0 "[ . 1 . 2]" 1
434 1 31 VAL QG 1 100 LEU HB2 . . 5.050 4.332 3.940 4.585 . 0 0 "[ . 1 . 2]" 1
435 1 31 VAL QG 1 100 LEU MD2 . . 2.950 2.255 1.794 2.541 . 0 0 "[ . 1 . 2]" 1
436 1 31 VAL QG 1 100 LEU HG . . 4.010 3.227 2.760 3.607 . 0 0 "[ . 1 . 2]" 1
437 1 31 VAL QG 1 101 LYS H . . 4.560 3.000 2.067 3.621 . 0 0 "[ . 1 . 2]" 1
438 1 31 VAL MG1 1 32 LEU H . . 4.140 3.082 2.751 3.490 . 0 0 "[ . 1 . 2]" 1
439 1 31 VAL MG1 1 34 ALA MB . . 4.640 3.412 2.969 3.810 . 0 0 "[ . 1 . 2]" 1
440 1 31 VAL MG1 1 100 LEU H . . 4.800 3.381 2.906 4.001 . 0 0 "[ . 1 . 2]" 1
441 1 31 VAL MG1 1 100 LEU HA . . 4.210 3.447 2.563 4.100 . 0 0 "[ . 1 . 2]" 1
442 1 31 VAL MG1 1 100 LEU MD2 . . 3.470 3.110 2.780 3.446 . 0 0 "[ . 1 . 2]" 1
443 1 31 VAL MG1 1 100 LEU HG . . 4.620 3.501 3.013 3.913 . 0 0 "[ . 1 . 2]" 1
444 1 31 VAL MG2 1 32 LEU H . . 4.140 3.802 3.646 4.002 . 0 0 "[ . 1 . 2]" 1
445 1 31 VAL MG2 1 34 ALA MB . . 4.640 4.213 3.772 4.568 . 0 0 "[ . 1 . 2]" 1
446 1 31 VAL MG2 1 100 LEU H . . 4.800 3.826 3.194 4.280 . 0 0 "[ . 1 . 2]" 1
447 1 31 VAL MG2 1 100 LEU HA . . 4.210 2.398 2.006 2.845 . 0 0 "[ . 1 . 2]" 1
448 1 31 VAL MG2 1 100 LEU MD2 . . 3.470 2.328 1.815 2.751 . 0 0 "[ . 1 . 2]" 1
449 1 31 VAL MG2 1 100 LEU HG . . 4.620 3.806 3.204 4.225 . 0 0 "[ . 1 . 2]" 1
450 1 32 LEU H 1 32 LEU HB2 . . 3.950 2.475 2.298 2.696 . 0 0 "[ . 1 . 2]" 1
451 1 32 LEU H 1 32 LEU HB3 . . 3.910 3.586 3.548 3.614 . 0 0 "[ . 1 . 2]" 1
452 1 32 LEU H 1 32 LEU MD1 . . 4.110 3.386 3.140 3.567 . 0 0 "[ . 1 . 2]" 1
453 1 32 LEU H 1 32 LEU MD2 . . 4.610 3.614 3.289 3.864 . 0 0 "[ . 1 . 2]" 1
454 1 32 LEU H 1 32 LEU HG . . 3.200 2.310 1.959 2.633 . 0 0 "[ . 1 . 2]" 1
455 1 32 LEU H 1 33 GLY H . . 3.750 3.038 2.734 3.350 . 0 0 "[ . 1 . 2]" 1
456 1 32 LEU HA 1 32 LEU MD1 . . 4.380 3.887 3.842 3.935 . 0 0 "[ . 1 . 2]" 1
457 1 32 LEU HA 1 32 LEU MD2 . . 3.130 2.171 1.979 2.372 . 0 0 "[ . 1 . 2]" 1
458 1 32 LEU HA 1 34 ALA H . . 4.930 4.208 3.870 4.736 . 0 0 "[ . 1 . 2]" 1
459 1 32 LEU HA 1 35 ASN H . . 4.550 3.402 3.183 3.746 . 0 0 "[ . 1 . 2]" 1
460 1 32 LEU HA 1 35 ASN HB2 . . 4.120 3.063 2.681 3.454 . 0 0 "[ . 1 . 2]" 1
461 1 32 LEU HA 1 35 ASN HB3 . . 5.210 4.746 4.309 5.157 . 0 0 "[ . 1 . 2]" 1
462 1 32 LEU HA 1 37 CYS H . . 5.190 4.176 3.815 4.624 . 0 0 "[ . 1 . 2]" 1
463 1 32 LEU HA 1 37 CYS HB2 . . 4.800 2.689 2.316 3.276 . 0 0 "[ . 1 . 2]" 1
464 1 32 LEU HA 1 37 CYS QB . . 3.950 2.646 2.288 3.216 . 0 0 "[ . 1 . 2]" 1
465 1 32 LEU HA 1 37 CYS HB3 . . 4.800 3.966 3.557 4.680 . 0 0 "[ . 1 . 2]" 1
466 1 32 LEU HA 1 37 CYS HG . . 4.630 4.142 3.598 4.631 0.001 14 0 "[ . 1 . 2]" 1
467 1 32 LEU HA 1 96 ILE MD . . 3.850 3.355 2.791 3.756 . 0 0 "[ . 1 . 2]" 1
468 1 32 LEU HA 1 96 ILE MG . . 5.100 4.753 4.230 5.067 . 0 0 "[ . 1 . 2]" 1
469 1 32 LEU HB2 1 33 GLY H . . 3.720 2.300 2.026 2.853 . 0 0 "[ . 1 . 2]" 1
470 1 32 LEU HB2 1 37 CYS QB . . 4.390 3.797 3.398 4.378 . 0 0 "[ . 1 . 2]" 1
471 1 32 LEU HB2 1 39 TYR QD . . 3.900 3.087 2.123 3.769 . 0 0 "[ . 1 . 2]" 1
472 1 32 LEU HB3 1 32 LEU MD1 . . 3.620 2.544 2.394 2.628 . 0 0 "[ . 1 . 2]" 1
473 1 32 LEU HB3 1 32 LEU MD2 . . 3.470 2.280 2.167 2.354 . 0 0 "[ . 1 . 2]" 1
474 1 32 LEU HB3 1 33 GLY H . . 4.250 3.176 2.763 3.555 . 0 0 "[ . 1 . 2]" 1
475 1 32 LEU HB3 1 37 CYS HB2 . . 4.120 2.441 2.006 3.075 . 0 0 "[ . 1 . 2]" 1
476 1 32 LEU HB3 1 37 CYS QB . . 3.590 2.323 1.933 2.909 . 0 0 "[ . 1 . 2]" 1
477 1 32 LEU HB3 1 37 CYS HB3 . . 4.120 2.990 2.304 4.032 . 0 0 "[ . 1 . 2]" 1
478 1 32 LEU HB3 1 39 TYR QD . . 3.770 2.789 2.312 3.123 . 0 0 "[ . 1 . 2]" 1
479 1 32 LEU HB3 1 39 TYR QE . . 4.810 4.214 3.081 4.777 . 0 0 "[ . 1 . 2]" 1
480 1 32 LEU MD1 1 39 TYR HB2 . . 4.030 3.038 2.446 3.356 . 0 0 "[ . 1 . 2]" 1
481 1 32 LEU MD1 1 39 TYR QB . . 3.500 2.045 1.880 2.304 . 0 0 "[ . 1 . 2]" 1
482 1 32 LEU MD1 1 39 TYR HB3 . . 4.030 2.082 1.914 2.371 . 0 0 "[ . 1 . 2]" 1
483 1 32 LEU MD1 1 39 TYR QD . . 3.470 2.987 1.994 3.445 . 0 0 "[ . 1 . 2]" 1
484 1 32 LEU MD1 1 39 TYR QE . . 4.900 4.337 3.470 4.854 . 0 0 "[ . 1 . 2]" 1
485 1 32 LEU MD1 1 64 MET ME . . 4.380 3.831 3.343 4.358 . 0 0 "[ . 1 . 2]" 1
486 1 32 LEU MD1 1 96 ILE MG . . 5.030 4.260 3.829 4.856 . 0 0 "[ . 1 . 2]" 1
487 1 32 LEU MD2 1 35 ASN HB2 . . 5.340 3.987 3.622 4.300 . 0 0 "[ . 1 . 2]" 1
488 1 32 LEU MD2 1 35 ASN HB3 . . 5.500 5.164 4.833 5.492 . 0 0 "[ . 1 . 2]" 1
489 1 32 LEU MD2 1 37 CYS HB2 . . 3.810 2.678 2.008 3.151 . 0 0 "[ . 1 . 2]" 1
490 1 32 LEU MD2 1 37 CYS QB . . 3.330 2.324 1.829 2.760 . 0 0 "[ . 1 . 2]" 1
491 1 32 LEU MD2 1 37 CYS HB3 . . 3.810 2.580 2.106 3.054 . 0 0 "[ . 1 . 2]" 1
492 1 32 LEU MD2 1 39 TYR QB . . 4.390 3.475 2.845 3.888 . 0 0 "[ . 1 . 2]" 1
493 1 32 LEU MD2 1 39 TYR QD . . 4.490 4.078 3.373 4.414 . 0 0 "[ . 1 . 2]" 1
494 1 32 LEU MD2 1 62 TRP HE1 . . 4.520 3.724 3.117 4.258 . 0 0 "[ . 1 . 2]" 1
495 1 32 LEU MD2 1 62 TRP HH2 . . 4.280 3.829 3.400 4.217 . 0 0 "[ . 1 . 2]" 1
496 1 32 LEU MD2 1 62 TRP HZ2 . . 3.360 2.770 2.165 3.286 . 0 0 "[ . 1 . 2]" 1
497 1 32 LEU MD2 1 64 MET ME . . 4.000 3.799 3.207 4.003 0.003 18 0 "[ . 1 . 2]" 1
498 1 32 LEU MD2 1 96 ILE MG . . 3.990 3.046 2.456 3.495 . 0 0 "[ . 1 . 2]" 1
499 1 32 LEU HG 1 96 ILE MG . . 4.380 3.779 3.344 4.309 . 0 0 "[ . 1 . 2]" 1
500 1 33 GLY H 1 34 ALA H . . 3.690 2.891 2.493 3.207 . 0 0 "[ . 1 . 2]" 1
501 1 33 GLY H 1 39 TYR QE . . 4.630 3.310 2.118 4.170 . 0 0 "[ . 1 . 2]" 1
502 1 33 GLY QA 1 37 CYS H . . 4.760 3.254 2.985 3.622 . 0 0 "[ . 1 . 2]" 1
503 1 33 GLY QA 1 39 TYR QE . . 4.340 2.740 2.324 3.933 . 0 0 "[ . 1 . 2]" 1
504 1 33 GLY HA2 1 39 TYR QE . . 5.050 3.002 2.415 4.349 . 0 0 "[ . 1 . 2]" 1
505 1 33 GLY HA3 1 39 TYR QE . . 5.050 3.221 2.647 4.487 . 0 0 "[ . 1 . 2]" 1
506 1 34 ALA H 1 34 ALA MB . . 3.040 2.122 2.025 2.238 . 0 0 "[ . 1 . 2]" 1
507 1 34 ALA H 1 35 ASN H . . 3.370 2.637 2.448 2.954 . 0 0 "[ . 1 . 2]" 1
508 1 34 ALA MB 1 35 ASN H . . 3.790 2.673 2.399 2.867 . 0 0 "[ . 1 . 2]" 1
509 1 34 ALA MB 1 35 ASN HB2 . . 4.800 4.423 4.153 4.797 . 0 0 "[ . 1 . 2]" 1
510 1 34 ALA MB 1 35 ASN QD . . 3.790 3.259 2.756 3.791 0.001 11 0 "[ . 1 . 2]" 1
511 1 35 ASN H 1 35 ASN HB2 . . 3.410 2.442 2.239 2.754 . 0 0 "[ . 1 . 2]" 1
512 1 35 ASN H 1 35 ASN HB3 . . 3.910 3.613 3.526 3.690 . 0 0 "[ . 1 . 2]" 1
513 1 35 ASN H 1 35 ASN HD21 . . 4.340 2.785 2.250 4.163 . 0 0 "[ . 1 . 2]" 1
514 1 35 ASN H 1 35 ASN HD22 . . 4.340 3.862 3.333 4.259 . 0 0 "[ . 1 . 2]" 1
515 1 35 ASN H 1 36 ASN H . . 3.390 3.011 2.510 3.252 . 0 0 "[ . 1 . 2]" 1
516 1 35 ASN H 1 37 CYS H . . 4.690 3.558 3.309 3.835 . 0 0 "[ . 1 . 2]" 1
517 1 35 ASN HB2 1 36 ASN H . . 5.030 4.144 3.607 4.322 . 0 0 "[ . 1 . 2]" 1
518 1 35 ASN HB2 1 37 CYS H . . 5.340 3.655 3.297 4.099 . 0 0 "[ . 1 . 2]" 1
519 1 35 ASN HB2 1 92 ILE MD . . 4.630 4.276 3.832 4.618 . 0 0 "[ . 1 . 2]" 1
520 1 35 ASN HB2 1 96 ILE MD . . 3.950 3.587 3.114 3.911 . 0 0 "[ . 1 . 2]" 1
521 1 35 ASN HB3 1 36 ASN H . . 5.090 4.430 4.238 4.555 . 0 0 "[ . 1 . 2]" 1
522 1 35 ASN HB3 1 37 CYS H . . 5.500 4.492 4.020 5.106 . 0 0 "[ . 1 . 2]" 1
523 1 35 ASN HB3 1 37 CYS HG . . 4.280 2.482 2.010 3.054 . 0 0 "[ . 1 . 2]" 1
524 1 35 ASN HB3 1 92 ILE MD . . 4.060 3.675 3.232 4.012 . 0 0 "[ . 1 . 2]" 1
525 1 35 ASN HB3 1 96 ILE MD . . 4.280 4.101 3.575 4.279 . 0 0 "[ . 1 . 2]" 1
526 1 35 ASN QD 1 96 ILE HA . . 4.680 4.134 3.302 4.571 . 0 0 "[ . 1 . 2]" 1
527 1 35 ASN QD 1 96 ILE MD . . 4.020 3.070 2.517 3.629 . 0 0 "[ . 1 . 2]" 1
528 1 35 ASN QD 1 99 GLU QG . . 4.140 2.489 1.887 4.069 . 0 0 "[ . 1 . 2]" 1
529 1 35 ASN HD21 1 96 ILE MD . . 4.870 3.298 2.640 4.042 . 0 0 "[ . 1 . 2]" 1
530 1 35 ASN HD22 1 96 ILE MD . . 4.870 3.699 3.095 4.326 . 0 0 "[ . 1 . 2]" 1
531 1 36 ASN H 1 36 ASN HB2 . . 4.120 3.239 2.807 3.701 . 0 0 "[ . 1 . 2]" 1
532 1 36 ASN H 1 36 ASN HB3 . . 4.120 3.869 3.373 4.035 . 0 0 "[ . 1 . 2]" 1
533 1 36 ASN QB 1 51 HIS HD2 . . 4.740 3.720 3.447 4.520 . 0 0 "[ . 1 . 2]" 1
534 1 37 CYS H 1 37 CYS HB2 . . 4.000 2.355 2.207 2.471 . 0 0 "[ . 1 . 2]" 1
535 1 37 CYS H 1 37 CYS QB . . 3.290 2.325 2.185 2.434 . 0 0 "[ . 1 . 2]" 1
536 1 37 CYS H 1 37 CYS HB3 . . 4.000 3.592 3.494 3.673 . 0 0 "[ . 1 . 2]" 1
537 1 37 CYS H 1 37 CYS HG . . 3.660 3.270 2.815 3.620 . 0 0 "[ . 1 . 2]" 1
538 1 37 CYS H 1 51 HIS HD2 . . 4.690 4.221 3.598 4.668 . 0 0 "[ . 1 . 2]" 1
539 1 37 CYS HA 1 38 ASP H . . 3.160 2.297 2.196 2.540 . 0 0 "[ . 1 . 2]" 1
540 1 37 CYS HA 1 51 HIS HB2 . . 4.630 3.927 3.520 4.444 . 0 0 "[ . 1 . 2]" 1
541 1 37 CYS HA 1 51 HIS HD2 . . 4.200 2.706 2.031 3.384 . 0 0 "[ . 1 . 2]" 1
542 1 37 CYS QB 1 38 ASP H . . 3.900 2.708 2.118 3.054 . 0 0 "[ . 1 . 2]" 1
543 1 37 CYS QB 1 39 TYR QD . . 4.690 3.855 3.505 4.415 . 0 0 "[ . 1 . 2]" 1
544 1 37 CYS QB 1 51 HIS HD2 . . 5.220 3.915 3.579 4.285 . 0 0 "[ . 1 . 2]" 1
545 1 37 CYS HG 1 51 HIS HD2 . . 4.200 2.644 2.048 3.111 . 0 0 "[ . 1 . 2]" 1
546 1 37 CYS HG 1 62 TRP HH2 . . 4.800 4.212 3.470 4.697 . 0 0 "[ . 1 . 2]" 1
547 1 37 CYS HG 1 96 ILE MD . . 4.630 3.956 3.454 4.373 . 0 0 "[ . 1 . 2]" 1
548 1 38 ASP H 1 38 ASP HB2 . . 4.050 2.409 2.253 2.948 . 0 0 "[ . 1 . 2]" 1
549 1 38 ASP H 1 38 ASP QB . . 3.390 2.343 2.228 2.550 . 0 0 "[ . 1 . 2]" 1
550 1 38 ASP H 1 38 ASP HB3 . . 4.050 3.436 2.792 3.689 . 0 0 "[ . 1 . 2]" 1
551 1 38 ASP H 1 50 VAL HA . . 4.690 4.612 4.452 4.684 . 0 0 "[ . 1 . 2]" 1
552 1 38 ASP H 1 50 VAL HB . . 4.490 2.994 2.466 3.494 . 0 0 "[ . 1 . 2]" 1
553 1 38 ASP H 1 50 VAL MG1 . . 4.280 3.665 3.059 4.103 . 0 0 "[ . 1 . 2]" 1
554 1 38 ASP H 1 50 VAL MG2 . . 5.000 4.412 3.976 4.758 . 0 0 "[ . 1 . 2]" 1
555 1 38 ASP H 1 51 HIS HA . . 5.010 4.083 3.771 4.474 . 0 0 "[ . 1 . 2]" 1
556 1 38 ASP H 1 51 HIS HD2 . . 5.380 4.676 3.906 5.282 . 0 0 "[ . 1 . 2]" 1
557 1 38 ASP HA 1 50 VAL MG1 . . 5.500 5.383 5.039 5.485 . 0 0 "[ . 1 . 2]" 1
558 1 38 ASP QB 1 39 TYR H . . 3.700 3.413 3.003 3.701 0.001 8 0 "[ . 1 . 2]" 1
559 1 38 ASP QB 1 50 VAL H . . 4.310 3.633 3.203 4.085 . 0 0 "[ . 1 . 2]" 1
560 1 38 ASP QB 1 50 VAL HB . . 3.410 2.065 1.966 2.235 . 0 0 "[ . 1 . 2]" 1
561 1 38 ASP QB 1 50 VAL MG1 . . 3.540 2.866 2.609 3.130 . 0 0 "[ . 1 . 2]" 1
562 1 38 ASP QB 1 50 VAL MG2 . . 3.770 3.247 2.594 3.469 . 0 0 "[ . 1 . 2]" 1
563 1 38 ASP HB2 1 50 VAL H . . 5.120 3.969 3.318 4.937 . 0 0 "[ . 1 . 2]" 1
564 1 38 ASP HB2 1 50 VAL HB . . 4.120 2.287 1.999 3.158 . 0 0 "[ . 1 . 2]" 1
565 1 38 ASP HB2 1 50 VAL MG1 . . 4.380 3.008 2.646 3.687 . 0 0 "[ . 1 . 2]" 1
566 1 38 ASP HB2 1 50 VAL MG2 . . 4.380 3.733 3.383 4.381 0.001 17 0 "[ . 1 . 2]" 1
567 1 38 ASP HB3 1 50 VAL H . . 5.120 4.491 3.688 5.108 . 0 0 "[ . 1 . 2]" 1
568 1 38 ASP HB3 1 50 VAL HB . . 4.120 2.958 1.997 3.589 . 0 0 "[ . 1 . 2]" 1
569 1 38 ASP HB3 1 50 VAL MG1 . . 4.380 3.945 3.278 4.371 . 0 0 "[ . 1 . 2]" 1
570 1 38 ASP HB3 1 50 VAL MG2 . . 4.380 3.755 2.631 4.271 . 0 0 "[ . 1 . 2]" 1
571 1 39 TYR H 1 39 TYR QD . . 3.850 2.513 1.996 3.074 . 0 0 "[ . 1 . 2]" 1
572 1 39 TYR HA 1 39 TYR QD . . 4.280 3.696 3.561 3.741 . 0 0 "[ . 1 . 2]" 1
573 1 39 TYR HA 1 40 GLU H . . 3.150 2.240 2.141 2.458 . 0 0 "[ . 1 . 2]" 1
574 1 39 TYR HA 1 48 PHE H . . 4.690 3.816 3.488 4.237 . 0 0 "[ . 1 . 2]" 1
575 1 39 TYR HA 1 50 VAL H . . 4.370 4.080 3.701 4.326 . 0 0 "[ . 1 . 2]" 1
576 1 39 TYR QB 1 40 GLU H . . 3.580 2.852 2.309 3.286 . 0 0 "[ . 1 . 2]" 1
577 1 39 TYR QB 1 47 LEU HB3 . . 4.260 2.812 2.541 3.042 . 0 0 "[ . 1 . 2]" 1
578 1 39 TYR QB 1 47 LEU QD . . 3.730 2.748 2.122 3.212 . 0 0 "[ . 1 . 2]" 1
579 1 39 TYR QD 1 40 GLU H . . 4.490 4.114 3.517 4.468 . 0 0 "[ . 1 . 2]" 1
580 1 39 TYR QD 1 40 GLU HA . . 4.380 3.924 3.389 4.379 . 0 0 "[ . 1 . 2]" 1
581 1 39 TYR QD 1 47 LEU MD1 . . 4.490 3.691 3.255 3.994 . 0 0 "[ . 1 . 2]" 1
582 1 39 TYR QD 1 47 LEU QD . . 3.330 2.934 2.338 3.304 . 0 0 "[ . 1 . 2]" 1
583 1 39 TYR QD 1 47 LEU MD2 . . 4.490 3.129 2.359 3.649 . 0 0 "[ . 1 . 2]" 1
584 1 39 TYR QE 1 47 LEU QD . . 4.600 4.271 3.894 4.594 . 0 0 "[ . 1 . 2]" 1
585 1 40 GLU H 1 40 GLU HB2 . . 4.120 2.810 2.444 3.201 . 0 0 "[ . 1 . 2]" 1
586 1 40 GLU H 1 40 GLU HB3 . . 4.120 3.409 2.773 3.877 . 0 0 "[ . 1 . 2]" 1
587 1 40 GLU H 1 47 LEU HB3 . . 4.660 3.175 2.660 3.833 . 0 0 "[ . 1 . 2]" 1
588 1 40 GLU H 1 48 PHE H . . 3.860 2.178 1.901 2.596 . 0 0 "[ . 1 . 2]" 1
589 1 40 GLU H 1 48 PHE HB2 . . 4.840 4.050 3.031 4.601 . 0 0 "[ . 1 . 2]" 1
590 1 40 GLU H 1 48 PHE HB3 . . 4.690 2.995 2.351 3.602 . 0 0 "[ . 1 . 2]" 1
591 1 40 GLU HA 1 41 GLN H . . 3.250 2.224 2.141 2.389 . 0 0 "[ . 1 . 2]" 1
592 1 40 GLU QB 1 42 ARG QG . . 4.420 3.315 3.040 3.819 . 0 0 "[ . 1 . 2]" 1
593 1 40 GLU QB 1 47 LEU QD . . 4.640 4.369 3.870 4.616 . 0 0 "[ . 1 . 2]" 1
594 1 40 GLU QB 1 48 PHE H . . 4.580 3.235 2.887 3.729 . 0 0 "[ . 1 . 2]" 1
595 1 40 GLU QB 1 48 PHE HB2 . . 4.240 3.211 2.533 3.715 . 0 0 "[ . 1 . 2]" 1
596 1 40 GLU QB 1 48 PHE QD . . 4.300 3.685 2.999 4.127 . 0 0 "[ . 1 . 2]" 1
597 1 40 GLU HB2 1 48 PHE HB3 . . 4.280 2.727 2.021 3.617 . 0 0 "[ . 1 . 2]" 1
598 1 40 GLU HB3 1 48 PHE HB3 . . 4.280 3.346 2.031 4.234 . 0 0 "[ . 1 . 2]" 1
599 1 41 GLN H 1 41 GLN HB2 . . 3.830 2.387 2.158 2.705 . 0 0 "[ . 1 . 2]" 1
600 1 41 GLN H 1 41 GLN QB . . 3.360 2.224 2.138 2.278 . 0 0 "[ . 1 . 2]" 1
601 1 41 GLN H 1 41 GLN HB3 . . 3.830 2.754 2.398 3.468 . 0 0 "[ . 1 . 2]" 1
602 1 41 GLN H 1 47 LEU QD . . 4.760 3.484 2.779 3.966 . 0 0 "[ . 1 . 2]" 1
603 1 41 GLN HA 1 41 GLN HG2 . . 4.060 2.955 2.190 3.782 . 0 0 "[ . 1 . 2]" 1
604 1 41 GLN HA 1 41 GLN QG . . 3.570 2.406 2.168 2.804 . 0 0 "[ . 1 . 2]" 1
605 1 41 GLN HA 1 41 GLN HG3 . . 4.060 3.087 2.299 3.638 . 0 0 "[ . 1 . 2]" 1
606 1 41 GLN HA 1 42 ARG H . . 3.330 2.183 2.139 2.230 . 0 0 "[ . 1 . 2]" 1
607 1 41 GLN HA 1 43 GLU H . . 4.690 4.462 3.978 4.659 . 0 0 "[ . 1 . 2]" 1
608 1 41 GLN HA 1 47 LEU HA . . 3.850 3.105 2.734 3.374 . 0 0 "[ . 1 . 2]" 1
609 1 41 GLN HA 1 47 LEU QD . . 3.280 1.971 1.770 2.276 . 0 0 "[ . 1 . 2]" 1
610 1 41 GLN QB 1 47 LEU QD . . 3.720 3.158 2.496 3.656 . 0 0 "[ . 1 . 2]" 1
611 1 41 GLN QE 1 44 ARG HA . . 3.630 3.145 2.447 3.641 0.011 8 0 "[ . 1 . 2]" 1
612 1 41 GLN QG 1 42 ARG H . . 4.150 3.573 3.095 4.183 0.033 8 0 "[ . 1 . 2]" 1
613 1 41 GLN QG 1 47 LEU QD . . 3.600 2.944 2.023 3.582 . 0 0 "[ . 1 . 2]" 1
614 1 42 ARG H 1 42 ARG HB2 . . 4.050 2.322 2.197 2.594 . 0 0 "[ . 1 . 2]" 1
615 1 42 ARG H 1 42 ARG QB . . 3.290 2.293 2.175 2.542 . 0 0 "[ . 1 . 2]" 1
616 1 42 ARG H 1 42 ARG HB3 . . 4.050 3.559 3.484 3.726 . 0 0 "[ . 1 . 2]" 1
617 1 42 ARG H 1 42 ARG HG2 . . 4.120 3.003 2.247 3.284 . 0 0 "[ . 1 . 2]" 1
618 1 42 ARG H 1 42 ARG QG . . 3.590 2.896 2.221 3.128 . 0 0 "[ . 1 . 2]" 1
619 1 42 ARG H 1 42 ARG HG3 . . 4.120 3.860 3.464 4.094 . 0 0 "[ . 1 . 2]" 1
620 1 42 ARG H 1 47 LEU HA . . 4.050 2.452 2.032 2.898 . 0 0 "[ . 1 . 2]" 1
621 1 42 ARG H 1 47 LEU QD . . 4.100 3.009 2.331 3.480 . 0 0 "[ . 1 . 2]" 1
622 1 42 ARG H 1 48 PHE H . . 4.870 3.941 3.463 4.360 . 0 0 "[ . 1 . 2]" 1
623 1 42 ARG HA 1 42 ARG HD2 . . 4.060 3.326 2.217 4.038 . 0 0 "[ . 1 . 2]" 1
624 1 42 ARG HA 1 42 ARG QD . . 3.540 2.471 2.086 3.181 . 0 0 "[ . 1 . 2]" 1
625 1 42 ARG HA 1 42 ARG HD3 . . 4.060 2.876 2.107 3.903 . 0 0 "[ . 1 . 2]" 1
626 1 42 ARG HA 1 42 ARG QG . . 3.580 2.562 2.354 2.887 . 0 0 "[ . 1 . 2]" 1
627 1 42 ARG QB 1 42 ARG QD . . 3.250 2.261 2.054 2.663 . 0 0 "[ . 1 . 2]" 1
628 1 42 ARG QB 1 43 GLU H . . 3.480 2.137 1.881 2.466 . 0 0 "[ . 1 . 2]" 1
629 1 42 ARG QB 1 43 GLU QG . . 4.220 2.462 2.103 3.748 . 0 0 "[ . 1 . 2]" 1
630 1 42 ARG QB 1 46 LEU QD . . 3.410 2.266 1.825 3.071 . 0 0 "[ . 1 . 2]" 1
631 1 42 ARG QB 1 47 LEU H . . 4.770 4.169 3.484 4.769 . 0 0 "[ . 1 . 2]" 1
632 1 42 ARG QB 1 47 LEU HA . . 4.600 3.122 2.395 3.788 . 0 0 "[ . 1 . 2]" 1
633 1 42 ARG QB 1 47 LEU QD . . 5.120 4.336 3.633 4.861 . 0 0 "[ . 1 . 2]" 1
634 1 42 ARG QB 1 48 PHE HB2 . . 5.340 3.955 3.591 4.729 . 0 0 "[ . 1 . 2]" 1
635 1 42 ARG HB2 1 43 GLU H . . 4.340 2.243 1.903 2.596 . 0 0 "[ . 1 . 2]" 1
636 1 42 ARG HB3 1 43 GLU H . . 4.340 2.795 2.459 3.365 . 0 0 "[ . 1 . 2]" 1
637 1 42 ARG QD 1 46 LEU QD . . 4.160 3.799 3.038 4.164 0.004 14 0 "[ . 1 . 2]" 1
638 1 42 ARG HE 1 42 ARG QG . . 3.640 2.304 2.157 3.078 . 0 0 "[ . 1 . 2]" 1
639 1 42 ARG QG 1 46 LEU QD . . 4.310 3.062 2.296 3.944 . 0 0 "[ . 1 . 2]" 1
640 1 42 ARG QG 1 47 LEU QD . . 5.280 4.447 3.689 5.050 . 0 0 "[ . 1 . 2]" 1
641 1 42 ARG QG 1 48 PHE HB2 . . 3.950 2.252 1.810 3.152 . 0 0 "[ . 1 . 2]" 1
642 1 42 ARG QG 1 48 PHE HB3 . . 4.660 3.484 2.801 4.292 . 0 0 "[ . 1 . 2]" 1
643 1 42 ARG HG2 1 48 PHE HB2 . . 4.630 2.703 2.010 3.848 . 0 0 "[ . 1 . 2]" 1
644 1 42 ARG HG3 1 48 PHE HB2 . . 4.630 2.445 2.047 3.348 . 0 0 "[ . 1 . 2]" 1
645 1 43 GLU H 1 43 GLU HB2 . . 3.850 2.689 2.477 2.870 . 0 0 "[ . 1 . 2]" 1
646 1 43 GLU H 1 43 GLU HB3 . . 3.950 3.745 3.625 3.813 . 0 0 "[ . 1 . 2]" 1
647 1 43 GLU H 1 43 GLU QG . . 3.890 2.547 2.097 3.562 . 0 0 "[ . 1 . 2]" 1
648 1 43 GLU H 1 46 LEU H . . 4.050 3.047 2.807 3.399 . 0 0 "[ . 1 . 2]" 1
649 1 43 GLU H 1 46 LEU HB2 . . 4.330 3.622 3.421 3.880 . 0 0 "[ . 1 . 2]" 1
650 1 43 GLU H 1 46 LEU QB . . 3.800 2.019 1.890 2.393 . 0 0 "[ . 1 . 2]" 1
651 1 43 GLU H 1 46 LEU HB3 . . 4.330 2.029 1.897 2.416 . 0 0 "[ . 1 . 2]" 1
652 1 43 GLU H 1 46 LEU QD . . 4.310 3.100 2.701 3.759 . 0 0 "[ . 1 . 2]" 1
653 1 43 GLU H 1 46 LEU HG . . 4.800 4.310 3.376 4.802 0.002 17 0 "[ . 1 . 2]" 1
654 1 43 GLU HA 1 43 GLU QG . . 3.550 2.815 2.413 3.140 . 0 0 "[ . 1 . 2]" 1
655 1 43 GLU HB2 1 44 ARG H . . 3.540 3.035 2.792 3.230 . 0 0 "[ . 1 . 2]" 1
656 1 43 GLU HB2 1 44 ARG HA . . 5.210 5.026 4.852 5.210 . 0 0 "[ . 1 . 2]" 1
657 1 43 GLU HB2 1 45 PHE H . . 4.490 3.040 2.705 3.638 . 0 0 "[ . 1 . 2]" 1
658 1 43 GLU HB2 1 46 LEU H . . 4.630 2.813 2.338 3.218 . 0 0 "[ . 1 . 2]" 1
659 1 43 GLU HB2 1 46 LEU HB2 . . 4.390 2.206 2.002 2.559 . 0 0 "[ . 1 . 2]" 1
660 1 43 GLU HB2 1 46 LEU QB . . 3.780 1.864 1.804 1.935 . 0 0 "[ . 1 . 2]" 1
661 1 43 GLU HB2 1 46 LEU HB3 . . 4.390 2.032 1.995 2.241 . 0 0 "[ . 1 . 2]" 1
662 1 43 GLU HB2 1 46 LEU QD . . 4.100 3.001 2.778 3.247 . 0 0 "[ . 1 . 2]" 1
663 1 43 GLU HB2 1 46 LEU HG . . 5.250 4.474 4.220 4.559 . 0 0 "[ . 1 . 2]" 1
664 1 43 GLU HB3 1 44 ARG H . . 4.180 2.112 1.930 2.294 . 0 0 "[ . 1 . 2]" 1
665 1 43 GLU HB3 1 45 PHE H . . 4.340 3.538 3.020 4.245 . 0 0 "[ . 1 . 2]" 1
666 1 43 GLU HB3 1 46 LEU H . . 4.250 4.172 3.787 4.259 0.009 20 0 "[ . 1 . 2]" 1
667 1 43 GLU HB3 1 46 LEU HB2 . . 4.180 3.798 3.614 4.155 . 0 0 "[ . 1 . 2]" 1
668 1 43 GLU HB3 1 46 LEU QB . . 3.430 3.302 3.226 3.367 . 0 0 "[ . 1 . 2]" 1
669 1 43 GLU HB3 1 46 LEU HB3 . . 4.180 3.649 3.493 3.774 . 0 0 "[ . 1 . 2]" 1
670 1 43 GLU HB3 1 46 LEU QD . . 4.610 3.920 3.764 4.064 . 0 0 "[ . 1 . 2]" 1
671 1 43 GLU QG 1 46 LEU QB . . 3.740 2.241 1.916 3.086 . 0 0 "[ . 1 . 2]" 1
672 1 43 GLU QG 1 46 LEU QD . . 3.280 2.056 1.751 2.603 . 0 0 "[ . 1 . 2]" 1
673 1 44 ARG H 1 44 ARG HB2 . . 3.690 2.533 2.172 3.596 . 0 0 "[ . 1 . 2]" 1
674 1 44 ARG H 1 44 ARG HB3 . . 3.690 2.827 2.357 3.601 . 0 0 "[ . 1 . 2]" 1
675 1 44 ARG H 1 45 PHE H . . 4.250 2.906 2.630 3.360 . 0 0 "[ . 1 . 2]" 1
676 1 44 ARG HA 1 44 ARG QD . . 4.280 3.405 2.026 4.381 0.101 16 0 "[ . 1 . 2]" 1
677 1 44 ARG HA 1 44 ARG HG2 . . 3.950 3.088 2.218 3.876 . 0 0 "[ . 1 . 2]" 1
678 1 44 ARG HA 1 44 ARG QG . . 3.410 2.605 2.195 3.334 . 0 0 "[ . 1 . 2]" 1
679 1 44 ARG HA 1 44 ARG HG3 . . 3.950 3.023 2.492 3.838 . 0 0 "[ . 1 . 2]" 1
680 1 44 ARG QB 1 45 PHE H . . 3.570 2.526 1.941 3.347 . 0 0 "[ . 1 . 2]" 1
681 1 44 ARG QB 1 45 PHE QD . . 4.530 2.827 1.988 3.761 . 0 0 "[ . 1 . 2]" 1
682 1 44 ARG HB2 1 44 ARG QD . . 3.450 2.726 2.245 3.288 . 0 0 "[ . 1 . 2]" 1
683 1 44 ARG HB2 1 45 PHE H . . 4.180 3.490 2.358 4.073 . 0 0 "[ . 1 . 2]" 1
684 1 44 ARG HB3 1 44 ARG QD . . 3.450 2.539 2.118 3.448 . 0 0 "[ . 1 . 2]" 1
685 1 44 ARG HB3 1 45 PHE H . . 4.180 2.748 1.951 4.011 . 0 0 "[ . 1 . 2]" 1
686 1 44 ARG QD 1 45 PHE QE . . 3.770 3.139 2.090 3.771 0.001 20 0 "[ . 1 . 2]" 1
687 1 44 ARG QD 1 45 PHE HZ . . 5.500 4.954 3.715 5.449 . 0 0 "[ . 1 . 2]" 1
688 1 44 ARG QG 1 45 PHE QD . . 5.340 2.889 1.936 4.281 . 0 0 "[ . 1 . 2]" 1
689 1 44 ARG QG 1 45 PHE QE . . 4.660 3.488 2.198 4.637 . 0 0 "[ . 1 . 2]" 1
690 1 45 PHE H 1 45 PHE QB . . 3.570 2.520 2.387 2.597 . 0 0 "[ . 1 . 2]" 1
691 1 45 PHE H 1 45 PHE QD . . 4.490 3.362 2.754 3.939 . 0 0 "[ . 1 . 2]" 1
692 1 45 PHE H 1 46 LEU H . . 3.560 2.542 2.105 2.773 . 0 0 "[ . 1 . 2]" 1
693 1 45 PHE HA 1 45 PHE QD . . 3.490 2.782 2.069 3.068 . 0 0 "[ . 1 . 2]" 1
694 1 45 PHE HA 1 47 LEU HG . . 5.500 4.826 4.475 5.312 . 0 0 "[ . 1 . 2]" 1
695 1 45 PHE HA 1 66 VAL H . . 5.220 4.600 4.312 4.805 . 0 0 "[ . 1 . 2]" 1
696 1 45 PHE QB 1 66 VAL H . . 3.590 2.560 2.289 2.794 . 0 0 "[ . 1 . 2]" 1
697 1 45 PHE QB 1 66 VAL HB . . 3.730 2.949 2.045 3.710 . 0 0 "[ . 1 . 2]" 1
698 1 45 PHE QB 1 66 VAL MG1 . . 4.920 4.271 3.608 4.913 . 0 0 "[ . 1 . 2]" 1
699 1 45 PHE QB 1 66 VAL MG2 . . 4.200 3.599 2.738 4.163 . 0 0 "[ . 1 . 2]" 1
700 1 45 PHE HB2 1 66 VAL H . . 4.430 3.861 3.021 4.369 . 0 0 "[ . 1 . 2]" 1
701 1 45 PHE HB3 1 66 VAL H . . 4.430 2.602 2.340 2.837 . 0 0 "[ . 1 . 2]" 1
702 1 45 PHE QD 1 66 VAL HB . . 3.900 3.074 2.359 3.457 . 0 0 "[ . 1 . 2]" 1
703 1 45 PHE QD 1 66 VAL MG1 . . 4.800 4.109 3.496 4.688 . 0 0 "[ . 1 . 2]" 1
704 1 45 PHE QD 1 66 VAL MG2 . . 4.380 3.402 2.683 3.938 . 0 0 "[ . 1 . 2]" 1
705 1 46 LEU H 1 46 LEU HB2 . . 3.830 2.957 2.531 3.147 . 0 0 "[ . 1 . 2]" 1
706 1 46 LEU H 1 46 LEU HB3 . . 3.830 2.807 2.656 2.926 . 0 0 "[ . 1 . 2]" 1
707 1 46 LEU H 1 46 LEU QD . . 4.350 3.900 3.786 3.998 . 0 0 "[ . 1 . 2]" 1
708 1 46 LEU H 1 46 LEU HG . . 4.800 4.596 4.472 4.687 . 0 0 "[ . 1 . 2]" 1
709 1 46 LEU HA 1 46 LEU MD1 . . 4.490 2.821 1.916 3.624 . 0 0 "[ . 1 . 2]" 1
710 1 46 LEU HA 1 46 LEU QD . . 3.400 2.565 1.910 3.011 . 0 0 "[ . 1 . 2]" 1
711 1 46 LEU HA 1 46 LEU MD2 . . 4.490 3.579 3.127 3.915 . 0 0 "[ . 1 . 2]" 1
712 1 46 LEU HA 1 46 LEU HG . . 3.950 2.660 2.292 3.384 . 0 0 "[ . 1 . 2]" 1
713 1 46 LEU HA 1 47 LEU H . . 3.090 2.216 2.143 2.361 . 0 0 "[ . 1 . 2]" 1
714 1 46 LEU HA 1 47 LEU HG . . 5.500 3.775 3.417 4.367 . 0 0 "[ . 1 . 2]" 1
715 1 46 LEU HA 1 65 GLU HA . . 3.640 2.535 2.062 2.964 . 0 0 "[ . 1 . 2]" 1
716 1 46 LEU HA 1 66 VAL H . . 5.500 4.200 3.643 4.782 . 0 0 "[ . 1 . 2]" 1
717 1 46 LEU QB 1 47 LEU H . . 4.370 3.561 3.273 3.739 . 0 0 "[ . 1 . 2]" 1
718 1 46 LEU QB 1 65 GLU HA . . 5.340 3.934 3.129 4.764 . 0 0 "[ . 1 . 2]" 1
719 1 46 LEU QB 1 65 GLU HB2 . . 4.000 2.893 2.321 3.198 . 0 0 "[ . 1 . 2]" 1
720 1 46 LEU HB2 1 47 LEU H . . 5.040 4.182 3.970 4.427 . 0 0 "[ . 1 . 2]" 1
721 1 46 LEU HB2 1 65 GLU HB2 . . 4.560 2.938 2.341 3.267 . 0 0 "[ . 1 . 2]" 1
722 1 46 LEU HB3 1 47 LEU H . . 5.040 3.863 3.485 4.113 . 0 0 "[ . 1 . 2]" 1
723 1 46 LEU HB3 1 65 GLU HB2 . . 4.560 4.365 3.833 4.577 0.017 20 0 "[ . 1 . 2]" 1
724 1 46 LEU QD 1 47 LEU H . . 3.590 2.626 1.868 3.566 . 0 0 "[ . 1 . 2]" 1
725 1 46 LEU QD 1 63 GLU QB . . 3.260 2.173 1.834 2.766 . 0 0 "[ . 1 . 2]" 1
726 1 46 LEU QD 1 63 GLU QG . . 4.190 3.026 1.992 3.645 . 0 0 "[ . 1 . 2]" 1
727 1 46 LEU QD 1 64 MET H . . 4.000 2.814 1.874 3.743 . 0 0 "[ . 1 . 2]" 1
728 1 46 LEU QD 1 65 GLU HA . . 4.170 3.283 1.973 4.174 0.004 17 0 "[ . 1 . 2]" 1
729 1 46 LEU QD 1 65 GLU HB2 . . 3.530 1.991 1.770 2.546 . 0 0 "[ . 1 . 2]" 1
730 1 46 LEU QD 1 65 GLU HB3 . . 4.600 2.855 2.270 3.469 . 0 0 "[ . 1 . 2]" 1
731 1 46 LEU QD 1 65 GLU QG . . 3.720 3.285 2.746 3.666 . 0 0 "[ . 1 . 2]" 1
732 1 46 LEU MD1 1 47 LEU H . . 4.490 3.406 1.869 4.383 . 0 0 "[ . 1 . 2]" 1
733 1 46 LEU MD1 1 64 MET H . . 4.630 3.510 1.877 4.632 0.002 4 0 "[ . 1 . 2]" 1
734 1 46 LEU MD2 1 47 LEU H . . 4.490 3.449 1.908 4.447 . 0 0 "[ . 1 . 2]" 1
735 1 46 LEU MD2 1 64 MET H . . 4.630 3.851 2.451 4.628 . 0 0 "[ . 1 . 2]" 1
736 1 46 LEU HG 1 47 LEU H . . 3.860 2.670 2.078 3.444 . 0 0 "[ . 1 . 2]" 1
737 1 46 LEU HG 1 63 GLU QB . . 4.360 2.890 2.054 3.459 . 0 0 "[ . 1 . 2]" 1
738 1 46 LEU HG 1 63 GLU QG . . 5.340 4.216 3.039 5.280 . 0 0 "[ . 1 . 2]" 1
739 1 46 LEU HG 1 65 GLU HA . . 5.500 4.261 2.960 5.254 . 0 0 "[ . 1 . 2]" 1
740 1 46 LEU HG 1 65 GLU HB2 . . 4.280 3.284 2.000 4.286 0.006 7 0 "[ . 1 . 2]" 1
741 1 47 LEU H 1 47 LEU HB2 . . 4.060 2.711 2.517 2.951 . 0 0 "[ . 1 . 2]" 1
742 1 47 LEU H 1 47 LEU QD . . 4.650 3.557 3.394 3.746 . 0 0 "[ . 1 . 2]" 1
743 1 47 LEU H 1 47 LEU HG . . 4.630 3.125 2.806 3.577 . 0 0 "[ . 1 . 2]" 1
744 1 47 LEU H 1 64 MET H . . 4.000 2.626 2.331 2.969 . 0 0 "[ . 1 . 2]" 1
745 1 47 LEU H 1 65 GLU HA . . 4.280 3.912 3.579 4.231 . 0 0 "[ . 1 . 2]" 1
746 1 47 LEU HA 1 47 LEU QD . . 3.340 2.273 2.052 2.525 . 0 0 "[ . 1 . 2]" 1
747 1 47 LEU HA 1 48 PHE H . . 3.130 2.338 2.177 2.448 . 0 0 "[ . 1 . 2]" 1
748 1 47 LEU HB2 1 47 LEU QD . . 2.850 2.133 1.960 2.252 . 0 0 "[ . 1 . 2]" 1
749 1 47 LEU HB2 1 48 PHE H . . 4.900 3.728 3.485 4.050 . 0 0 "[ . 1 . 2]" 1
750 1 47 LEU HB2 1 64 MET H . . 4.340 3.769 3.320 4.248 . 0 0 "[ . 1 . 2]" 1
751 1 47 LEU HB2 1 64 MET QB . . 4.290 3.242 2.659 3.818 . 0 0 "[ . 1 . 2]" 1
752 1 47 LEU HB3 1 47 LEU MD1 . . 3.470 2.534 2.321 2.673 . 0 0 "[ . 1 . 2]" 1
753 1 47 LEU HB3 1 47 LEU QD . . 3.020 2.076 1.987 2.133 . 0 0 "[ . 1 . 2]" 1
754 1 47 LEU HB3 1 47 LEU MD2 . . 3.470 2.212 2.052 2.340 . 0 0 "[ . 1 . 2]" 1
755 1 47 LEU HB3 1 48 PHE H . . 4.050 2.597 2.335 3.106 . 0 0 "[ . 1 . 2]" 1
756 1 47 LEU HB3 1 48 PHE HB2 . . 5.500 5.277 4.991 5.502 0.002 8 0 "[ . 1 . 2]" 1
757 1 47 LEU QD 1 48 PHE H . . 4.040 3.239 2.617 3.557 . 0 0 "[ . 1 . 2]" 1
758 1 47 LEU QD 1 48 PHE HB2 . . 5.440 5.257 4.729 5.433 . 0 0 "[ . 1 . 2]" 1
759 1 48 PHE H 1 48 PHE HB2 . . 3.810 2.745 2.425 2.980 . 0 0 "[ . 1 . 2]" 1
760 1 48 PHE H 1 48 PHE HB3 . . 3.610 2.704 2.597 2.813 . 0 0 "[ . 1 . 2]" 1
761 1 48 PHE H 1 49 CYS H . . 5.140 4.161 3.965 4.599 . 0 0 "[ . 1 . 2]" 1
762 1 48 PHE HA 1 48 PHE QD . . 4.280 2.666 2.093 3.090 . 0 0 "[ . 1 . 2]" 1
763 1 48 PHE HA 1 49 CYS H . . 3.230 2.196 2.141 2.289 . 0 0 "[ . 1 . 2]" 1
764 1 48 PHE HA 1 62 TRP H . . 5.480 5.112 4.722 5.444 . 0 0 "[ . 1 . 2]" 1
765 1 48 PHE HA 1 63 GLU HA . . 3.710 2.582 2.145 2.958 . 0 0 "[ . 1 . 2]" 1
766 1 48 PHE HA 1 63 GLU HG2 . . 5.170 2.815 1.998 4.342 . 0 0 "[ . 1 . 2]" 1
767 1 48 PHE HA 1 63 GLU QG . . 4.430 2.654 1.935 4.104 . 0 0 "[ . 1 . 2]" 1
768 1 48 PHE HA 1 63 GLU HG3 . . 5.170 3.785 2.160 5.100 . 0 0 "[ . 1 . 2]" 1
769 1 48 PHE QD 1 49 CYS H . . 4.550 3.861 2.799 4.205 . 0 0 "[ . 1 . 2]" 1
770 1 48 PHE QD 1 50 VAL MG1 . . 5.430 4.787 4.469 5.366 . 0 0 "[ . 1 . 2]" 1
771 1 48 PHE QD 1 50 VAL MG2 . . 4.200 2.284 1.970 3.113 . 0 0 "[ . 1 . 2]" 1
772 1 48 PHE QD 1 61 GLN QB . . 5.340 4.287 3.768 4.903 . 0 0 "[ . 1 . 2]" 1
773 1 48 PHE QD 1 63 GLU HA . . 5.040 4.107 3.435 4.947 . 0 0 "[ . 1 . 2]" 1
774 1 48 PHE QD 1 63 GLU QB . . 5.340 4.053 2.230 4.529 . 0 0 "[ . 1 . 2]" 1
775 1 48 PHE QD 1 63 GLU HG2 . . 4.630 2.557 2.005 3.468 . 0 0 "[ . 1 . 2]" 1
776 1 48 PHE QD 1 63 GLU QG . . 4.010 2.319 1.907 3.374 . 0 0 "[ . 1 . 2]" 1
777 1 48 PHE QD 1 63 GLU HG3 . . 4.630 3.157 2.026 4.621 . 0 0 "[ . 1 . 2]" 1
778 1 48 PHE QD 1 82 ILE MD . . 4.490 4.162 2.989 4.490 0.000 5 0 "[ . 1 . 2]" 1
779 1 48 PHE QD 1 82 ILE QG . . 4.380 3.740 3.008 4.207 . 0 0 "[ . 1 . 2]" 1
780 1 48 PHE QD 1 82 ILE MG . . 5.500 4.726 4.149 5.464 . 0 0 "[ . 1 . 2]" 1
781 1 48 PHE QE 1 50 VAL MG1 . . 4.490 4.091 3.764 4.466 . 0 0 "[ . 1 . 2]" 1
782 1 48 PHE QE 1 50 VAL MG2 . . 3.660 2.197 1.872 2.675 . 0 0 "[ . 1 . 2]" 1
783 1 48 PHE QE 1 61 GLN QB . . 4.270 2.721 1.995 3.479 . 0 0 "[ . 1 . 2]" 1
784 1 48 PHE QE 1 61 GLN QG . . 4.870 3.075 2.187 4.037 . 0 0 "[ . 1 . 2]" 1
785 1 48 PHE QE 1 82 ILE HB . . 5.030 3.793 3.205 4.797 . 0 0 "[ . 1 . 2]" 1
786 1 48 PHE QE 1 82 ILE MD . . 4.000 3.220 2.590 3.773 . 0 0 "[ . 1 . 2]" 1
787 1 48 PHE QE 1 82 ILE QG . . 4.100 2.303 1.983 2.596 . 0 0 "[ . 1 . 2]" 1
788 1 48 PHE QE 1 82 ILE MG . . 3.830 2.830 2.152 3.728 . 0 0 "[ . 1 . 2]" 1
789 1 48 PHE HZ 1 50 VAL MG2 . . 4.490 3.767 2.943 4.333 . 0 0 "[ . 1 . 2]" 1
790 1 48 PHE HZ 1 61 GLN QB . . 4.200 2.404 2.029 2.845 . 0 0 "[ . 1 . 2]" 1
791 1 48 PHE HZ 1 61 GLN QG . . 4.630 3.551 2.342 4.412 . 0 0 "[ . 1 . 2]" 1
792 1 48 PHE HZ 1 82 ILE HB . . 5.500 3.913 3.257 4.633 . 0 0 "[ . 1 . 2]" 1
793 1 48 PHE HZ 1 82 ILE MG . . 4.270 3.044 2.020 3.765 . 0 0 "[ . 1 . 2]" 1
794 1 49 CYS H 1 49 CYS HB2 . . 4.180 2.594 2.332 2.941 . 0 0 "[ . 1 . 2]" 1
795 1 49 CYS H 1 49 CYS QB . . 3.520 2.540 2.303 2.855 . 0 0 "[ . 1 . 2]" 1
796 1 49 CYS H 1 49 CYS HB3 . . 4.180 3.645 3.573 3.867 . 0 0 "[ . 1 . 2]" 1
797 1 49 CYS H 1 49 CYS HG . . 3.860 2.539 2.082 3.221 . 0 0 "[ . 1 . 2]" 1
798 1 49 CYS H 1 50 VAL MG2 . . 5.230 4.313 3.692 4.543 . 0 0 "[ . 1 . 2]" 1
799 1 49 CYS H 1 62 TRP H . . 3.950 3.758 3.207 3.950 . 0 0 "[ . 1 . 2]" 1
800 1 49 CYS H 1 63 GLU HA . . 4.250 2.562 1.949 3.195 . 0 0 "[ . 1 . 2]" 1
801 1 49 CYS H 1 63 GLU QG . . 4.580 3.824 3.292 4.576 . 0 0 "[ . 1 . 2]" 1
802 1 49 CYS H 1 64 MET H . . 5.500 4.332 3.925 5.076 . 0 0 "[ . 1 . 2]" 1
803 1 49 CYS QB 1 50 VAL H . . 3.950 2.854 2.468 3.220 . 0 0 "[ . 1 . 2]" 1
804 1 49 CYS QB 1 62 TRP H . . 4.000 3.050 2.676 3.403 . 0 0 "[ . 1 . 2]" 1
805 1 49 CYS QB 1 62 TRP HA . . 5.340 4.844 4.591 5.142 . 0 0 "[ . 1 . 2]" 1
806 1 49 CYS QB 1 62 TRP HE1 . . 4.790 3.263 2.930 3.585 . 0 0 "[ . 1 . 2]" 1
807 1 49 CYS QB 1 62 TRP HZ2 . . 4.200 2.890 2.543 3.183 . 0 0 "[ . 1 . 2]" 1
808 1 49 CYS HB2 1 50 VAL H . . 4.630 3.877 3.511 4.143 . 0 0 "[ . 1 . 2]" 1
809 1 49 CYS HB2 1 62 TRP H . . 4.690 3.112 2.710 3.555 . 0 0 "[ . 1 . 2]" 1
810 1 49 CYS HB2 1 62 TRP HZ2 . . 4.800 3.748 3.491 4.010 . 0 0 "[ . 1 . 2]" 1
811 1 49 CYS HB3 1 50 VAL H . . 4.630 2.942 2.522 3.391 . 0 0 "[ . 1 . 2]" 1
812 1 49 CYS HB3 1 62 TRP H . . 4.690 4.447 4.134 4.688 . 0 0 "[ . 1 . 2]" 1
813 1 49 CYS HB3 1 62 TRP HZ2 . . 4.800 3.013 2.599 3.340 . 0 0 "[ . 1 . 2]" 1
814 1 49 CYS HG 1 63 GLU HA . . 4.380 3.193 2.394 4.185 . 0 0 "[ . 1 . 2]" 1
815 1 49 CYS HG 1 64 MET H . . 4.690 3.603 2.818 4.298 . 0 0 "[ . 1 . 2]" 1
816 1 50 VAL H 1 50 VAL HB . . 3.750 2.791 2.643 2.925 . 0 0 "[ . 1 . 2]" 1
817 1 50 VAL H 1 50 VAL MG1 . . 4.060 3.853 3.757 3.928 . 0 0 "[ . 1 . 2]" 1
818 1 50 VAL H 1 50 VAL MG2 . . 3.910 3.221 2.997 3.358 . 0 0 "[ . 1 . 2]" 1
819 1 50 VAL HA 1 50 VAL MG1 . . 3.530 2.438 2.323 2.526 . 0 0 "[ . 1 . 2]" 1
820 1 50 VAL HA 1 50 VAL MG2 . . 3.590 2.198 2.118 2.293 . 0 0 "[ . 1 . 2]" 1
821 1 50 VAL HA 1 51 HIS H . . 3.080 2.165 2.141 2.211 . 0 0 "[ . 1 . 2]" 1
822 1 50 VAL HA 1 61 GLN HA . . 3.590 2.682 2.380 3.050 . 0 0 "[ . 1 . 2]" 1
823 1 50 VAL HA 1 61 GLN QE . . 4.960 4.546 3.951 4.958 . 0 0 "[ . 1 . 2]" 1
824 1 50 VAL HA 1 61 GLN QG . . 4.490 3.102 2.687 3.528 . 0 0 "[ . 1 . 2]" 1
825 1 50 VAL HA 1 62 TRP H . . 4.630 3.721 3.236 4.034 . 0 0 "[ . 1 . 2]" 1
826 1 50 VAL HA 1 62 TRP HE3 . . 5.360 3.988 3.503 4.387 . 0 0 "[ . 1 . 2]" 1
827 1 50 VAL HA 1 62 TRP HZ3 . . 4.380 3.330 2.609 3.877 . 0 0 "[ . 1 . 2]" 1
828 1 50 VAL HB 1 51 HIS H . . 4.800 4.220 4.032 4.411 . 0 0 "[ . 1 . 2]" 1
829 1 50 VAL MG1 1 51 HIS H . . 3.620 2.389 2.052 2.891 . 0 0 "[ . 1 . 2]" 1
830 1 50 VAL MG1 1 51 HIS HA . . 4.800 3.313 3.227 3.462 . 0 0 "[ . 1 . 2]" 1
831 1 50 VAL MG1 1 59 LEU HA . . 5.500 5.230 4.922 5.501 0.001 2 0 "[ . 1 . 2]" 1
832 1 50 VAL MG1 1 59 LEU MD1 . . 3.440 2.514 1.926 3.128 . 0 0 "[ . 1 . 2]" 1
833 1 50 VAL MG1 1 59 LEU MD2 . . 3.440 2.304 1.884 3.437 . 0 0 "[ . 1 . 2]" 1
834 1 50 VAL MG1 1 59 LEU HG . . 4.380 3.243 2.768 3.766 . 0 0 "[ . 1 . 2]" 1
835 1 50 VAL MG1 1 60 VAL H . . 4.630 4.357 4.141 4.628 . 0 0 "[ . 1 . 2]" 1
836 1 50 VAL MG1 1 61 GLN HA . . 4.380 4.029 3.546 4.382 0.002 13 0 "[ . 1 . 2]" 1
837 1 50 VAL MG1 1 61 GLN QE . . 4.390 2.745 1.931 3.303 . 0 0 "[ . 1 . 2]" 1
838 1 50 VAL MG1 1 61 GLN QG . . 3.620 2.797 2.420 3.221 . 0 0 "[ . 1 . 2]" 1
839 1 50 VAL MG2 1 51 HIS H . . 4.060 3.851 3.726 4.010 . 0 0 "[ . 1 . 2]" 1
840 1 50 VAL MG2 1 60 VAL MG1 . . 5.500 5.358 5.075 5.497 . 0 0 "[ . 1 . 2]" 1
841 1 50 VAL MG2 1 61 GLN HA . . 4.120 2.991 2.699 3.298 . 0 0 "[ . 1 . 2]" 1
842 1 50 VAL MG2 1 61 GLN QB . . 4.390 3.051 2.473 3.680 . 0 0 "[ . 1 . 2]" 1
843 1 50 VAL MG2 1 61 GLN QE . . 4.020 2.551 1.929 3.517 . 0 0 "[ . 1 . 2]" 1
844 1 50 VAL MG2 1 61 GLN QG . . 3.400 2.179 1.890 2.760 . 0 0 "[ . 1 . 2]" 1
845 1 50 VAL MG2 1 62 TRP H . . 4.800 3.826 3.444 4.250 . 0 0 "[ . 1 . 2]" 1
846 1 51 HIS H 1 51 HIS HB2 . . 4.110 3.118 2.961 3.216 . 0 0 "[ . 1 . 2]" 1
847 1 51 HIS H 1 51 HIS HB3 . . 4.000 3.015 2.879 3.147 . 0 0 "[ . 1 . 2]" 1
848 1 51 HIS H 1 59 LEU MD1 . . 4.320 3.572 2.668 4.285 . 0 0 "[ . 1 . 2]" 1
849 1 51 HIS H 1 59 LEU QD . . 3.750 2.980 2.275 3.668 . 0 0 "[ . 1 . 2]" 1
850 1 51 HIS H 1 59 LEU MD2 . . 4.320 3.606 2.284 4.307 . 0 0 "[ . 1 . 2]" 1
851 1 51 HIS H 1 60 VAL H . . 4.000 3.592 3.327 4.000 . 0 0 "[ . 1 . 2]" 1
852 1 51 HIS H 1 60 VAL HB . . 4.430 3.812 3.214 4.137 . 0 0 "[ . 1 . 2]" 1
853 1 51 HIS H 1 60 VAL MG1 . . 4.490 4.043 3.277 4.402 . 0 0 "[ . 1 . 2]" 1
854 1 51 HIS H 1 60 VAL MG2 . . 5.490 5.125 4.611 5.444 . 0 0 "[ . 1 . 2]" 1
855 1 51 HIS H 1 61 GLN HA . . 4.630 3.730 3.259 4.351 . 0 0 "[ . 1 . 2]" 1
856 1 51 HIS H 1 62 TRP HZ3 . . 3.790 2.683 2.328 2.998 . 0 0 "[ . 1 . 2]" 1
857 1 51 HIS HA 1 51 HIS HD2 . . 4.490 2.682 2.271 3.501 . 0 0 "[ . 1 . 2]" 1
858 1 51 HIS HA 1 52 GLY H . . 3.040 2.292 2.200 2.379 . 0 0 "[ . 1 . 2]" 1
859 1 51 HIS HA 1 52 GLY QA . . 4.630 3.896 3.887 3.907 . 0 0 "[ . 1 . 2]" 1
860 1 51 HIS HA 1 53 ASP H . . 5.500 4.720 4.057 5.493 . 0 0 "[ . 1 . 2]" 1
861 1 51 HIS HB2 1 60 VAL MG1 . . 5.040 4.793 3.916 5.043 0.003 10 0 "[ . 1 . 2]" 1
862 1 51 HIS HB2 1 62 TRP HH2 . . 3.770 2.167 2.001 2.605 . 0 0 "[ . 1 . 2]" 1
863 1 51 HIS HB2 1 62 TRP HZ3 . . 4.060 2.841 2.019 3.316 . 0 0 "[ . 1 . 2]" 1
864 1 51 HIS HB2 1 92 ILE MD . . 4.860 3.179 2.554 3.567 . 0 0 "[ . 1 . 2]" 1
865 1 51 HIS HB2 1 92 ILE QG . . 4.380 2.924 2.427 3.393 . 0 0 "[ . 1 . 2]" 1
866 1 51 HIS HB2 1 92 ILE MG . . 4.800 4.447 4.125 4.783 . 0 0 "[ . 1 . 2]" 1
867 1 51 HIS HB3 1 60 VAL MG1 . . 4.380 3.987 3.253 4.314 . 0 0 "[ . 1 . 2]" 1
868 1 51 HIS HB3 1 62 TRP HH2 . . 4.060 3.078 2.464 3.592 . 0 0 "[ . 1 . 2]" 1
869 1 51 HIS HB3 1 62 TRP HZ3 . . 4.000 2.702 2.307 3.398 . 0 0 "[ . 1 . 2]" 1
870 1 51 HIS HB3 1 92 ILE MD . . 5.450 3.108 2.456 3.468 . 0 0 "[ . 1 . 2]" 1
871 1 51 HIS HB3 1 92 ILE QG . . 4.380 2.588 2.036 3.198 . 0 0 "[ . 1 . 2]" 1
872 1 51 HIS HB3 1 92 ILE MG . . 5.270 3.664 3.220 4.007 . 0 0 "[ . 1 . 2]" 1
873 1 51 HIS HD2 1 92 ILE MD . . 4.630 4.111 3.275 4.617 . 0 0 "[ . 1 . 2]" 1
874 1 51 HIS HE1 1 92 ILE MD . . 4.630 3.148 2.702 3.659 . 0 0 "[ . 1 . 2]" 1
875 1 52 GLY QA 1 53 ASP H . . 3.350 2.515 2.238 2.802 . 0 0 "[ . 1 . 2]" 1
876 1 52 GLY QA 1 54 GLY H . . 4.020 3.326 2.941 3.750 . 0 0 "[ . 1 . 2]" 1
877 1 52 GLY QA 1 59 LEU HA . . 3.900 2.701 2.017 3.424 . 0 0 "[ . 1 . 2]" 1
878 1 52 GLY QA 1 59 LEU MD1 . . 4.280 2.600 1.764 3.608 . 0 0 "[ . 1 . 2]" 1
879 1 52 GLY QA 1 59 LEU QD . . 3.440 2.214 1.762 3.301 . 0 0 "[ . 1 . 2]" 1
880 1 52 GLY QA 1 59 LEU MD2 . . 4.280 3.537 1.821 4.282 0.002 7 0 "[ . 1 . 2]" 1
881 1 52 GLY QA 1 60 VAL H . . 4.550 3.177 2.589 3.860 . 0 0 "[ . 1 . 2]" 1
882 1 53 ASP H 1 54 GLY H . . 3.390 3.056 2.717 3.383 . 0 0 "[ . 1 . 2]" 1
883 1 53 ASP H 1 59 LEU QD . . 5.440 4.449 3.735 5.431 . 0 0 "[ . 1 . 2]" 1
884 1 53 ASP QB 1 54 GLY H . . 4.250 3.607 2.457 4.056 . 0 0 "[ . 1 . 2]" 1
885 1 53 ASP QB 1 95 LYS QG . . 5.340 5.040 4.410 5.329 . 0 0 "[ . 1 . 2]" 1
886 1 55 HIS H 1 55 HIS HB2 . . 3.660 2.392 2.212 2.808 . 0 0 "[ . 1 . 2]" 1
887 1 55 HIS H 1 55 HIS HD2 . . 4.380 2.970 1.925 4.233 . 0 0 "[ . 1 . 2]" 1
888 1 55 HIS H 1 58 ASN QB . . 3.770 2.580 1.888 3.779 0.009 2 0 "[ . 1 . 2]" 1
889 1 55 HIS HB2 1 58 ASN HB2 . . 4.800 3.000 2.177 4.798 . 0 0 "[ . 1 . 2]" 1
890 1 55 HIS HB2 1 58 ASN HB3 . . 4.800 4.360 3.109 4.850 0.050 18 0 "[ . 1 . 2]" 1
891 1 55 HIS HB2 1 58 ASN HD21 . . 4.690 2.505 1.865 3.265 . 0 0 "[ . 1 . 2]" 1
892 1 55 HIS HB2 1 58 ASN QD . . 4.110 2.376 1.840 3.120 . 0 0 "[ . 1 . 2]" 1
893 1 55 HIS HB2 1 58 ASN HD22 . . 4.690 3.382 1.899 3.963 . 0 0 "[ . 1 . 2]" 1
894 1 55 HIS HB3 1 58 ASN HD21 . . 5.040 3.362 2.553 4.857 . 0 0 "[ . 1 . 2]" 1
895 1 55 HIS HB3 1 58 ASN QD . . 4.290 3.199 2.515 3.813 . 0 0 "[ . 1 . 2]" 1
896 1 55 HIS HB3 1 58 ASN HD22 . . 5.040 4.342 3.437 4.969 . 0 0 "[ . 1 . 2]" 1
897 1 56 ALA HA 1 59 LEU H . . 4.430 4.102 3.772 4.331 . 0 0 "[ . 1 . 2]" 1
898 1 56 ALA HA 1 59 LEU HB2 . . 5.040 3.145 2.835 3.425 . 0 0 "[ . 1 . 2]" 1
899 1 56 ALA HA 1 59 LEU QB . . 4.280 3.106 2.804 3.370 . 0 0 "[ . 1 . 2]" 1
900 1 56 ALA HA 1 59 LEU HB3 . . 5.040 4.825 4.410 5.026 . 0 0 "[ . 1 . 2]" 1
901 1 56 ALA HA 1 59 LEU MD1 . . 5.500 3.836 2.902 5.498 . 0 0 "[ . 1 . 2]" 1
902 1 56 ALA HA 1 59 LEU MD2 . . 5.500 4.457 2.793 5.496 . 0 0 "[ . 1 . 2]" 1
903 1 56 ALA MB 1 57 GLU H . . 3.850 2.486 2.297 3.271 . 0 0 "[ . 1 . 2]" 1
904 1 56 ALA MB 1 57 GLU HA . . 4.280 3.814 3.766 4.044 . 0 0 "[ . 1 . 2]" 1
905 1 56 ALA MB 1 58 ASN H . . 4.850 4.124 3.985 4.510 . 0 0 "[ . 1 . 2]" 1
906 1 56 ALA MB 1 58 ASN QD . . 5.200 5.127 4.898 5.277 0.077 18 0 "[ . 1 . 2]" 1
907 1 57 GLU H 1 57 GLU HG2 . . 4.800 3.144 1.926 4.625 . 0 0 "[ . 1 . 2]" 1
908 1 57 GLU H 1 57 GLU QG . . 4.200 2.690 1.893 4.048 . 0 0 "[ . 1 . 2]" 1
909 1 57 GLU H 1 57 GLU HG3 . . 4.800 3.412 2.048 4.482 . 0 0 "[ . 1 . 2]" 1
910 1 57 GLU H 1 58 ASN H . . 3.790 2.622 2.199 2.732 . 0 0 "[ . 1 . 2]" 1
911 1 57 GLU HA 1 57 GLU HG2 . . 4.060 3.346 2.595 3.934 . 0 0 "[ . 1 . 2]" 1
912 1 57 GLU HA 1 57 GLU QG . . 3.510 2.868 2.315 3.338 . 0 0 "[ . 1 . 2]" 1
913 1 57 GLU HA 1 57 GLU HG3 . . 4.060 3.292 2.395 3.876 . 0 0 "[ . 1 . 2]" 1
914 1 57 GLU HA 1 59 LEU H . . 4.630 3.788 3.621 4.380 . 0 0 "[ . 1 . 2]" 1
915 1 57 GLU QB 1 58 ASN H . . 4.250 3.350 3.001 3.814 . 0 0 "[ . 1 . 2]" 1
916 1 57 GLU QG 1 58 ASN H . . 4.310 3.698 2.549 4.311 0.001 16 0 "[ . 1 . 2]" 1
917 1 58 ASN H 1 58 ASN HB2 . . 4.120 2.647 2.431 3.794 . 0 0 "[ . 1 . 2]" 1
918 1 58 ASN H 1 58 ASN QB . . 3.420 2.533 2.398 3.173 . 0 0 "[ . 1 . 2]" 1
919 1 58 ASN H 1 58 ASN HB3 . . 4.120 3.650 2.738 3.783 . 0 0 "[ . 1 . 2]" 1
920 1 58 ASN H 1 58 ASN QD . . 4.580 2.388 1.934 3.150 . 0 0 "[ . 1 . 2]" 1
921 1 58 ASN H 1 59 LEU H . . 3.390 2.715 2.264 3.131 . 0 0 "[ . 1 . 2]" 1
922 1 58 ASN H 1 59 LEU QB . . 5.190 4.036 3.795 4.294 . 0 0 "[ . 1 . 2]" 1
923 1 58 ASN HA 1 88 ALA MB . . 5.110 4.767 4.226 5.111 0.001 2 0 "[ . 1 . 2]" 1
924 1 58 ASN QB 1 88 ALA MB . . 4.530 3.756 3.335 4.096 . 0 0 "[ . 1 . 2]" 1
925 1 59 LEU H 1 59 LEU HB2 . . 3.440 2.400 2.222 2.608 . 0 0 "[ . 1 . 2]" 1
926 1 59 LEU H 1 59 LEU HB3 . . 3.440 2.662 2.422 2.836 . 0 0 "[ . 1 . 2]" 1
927 1 59 LEU H 1 59 LEU MD1 . . 4.800 4.058 3.836 4.259 . 0 0 "[ . 1 . 2]" 1
928 1 59 LEU H 1 59 LEU QD . . 4.200 3.634 3.483 3.731 . 0 0 "[ . 1 . 2]" 1
929 1 59 LEU H 1 59 LEU MD2 . . 4.800 4.134 3.695 4.284 . 0 0 "[ . 1 . 2]" 1
930 1 59 LEU H 1 59 LEU HG . . 4.630 4.502 4.283 4.658 0.028 18 0 "[ . 1 . 2]" 1
931 1 59 LEU HA 1 59 LEU MD1 . . 4.120 2.731 1.969 3.714 . 0 0 "[ . 1 . 2]" 1
932 1 59 LEU HA 1 59 LEU QD . . 3.200 2.384 1.892 3.063 . 0 0 "[ . 1 . 2]" 1
933 1 59 LEU HA 1 59 LEU MD2 . . 4.120 3.261 1.911 3.954 . 0 0 "[ . 1 . 2]" 1
934 1 59 LEU HA 1 59 LEU HG . . 4.120 2.909 2.340 3.774 . 0 0 "[ . 1 . 2]" 1
935 1 59 LEU HA 1 60 VAL H . . 3.080 2.243 2.141 2.313 . 0 0 "[ . 1 . 2]" 1
936 1 59 LEU QB 1 59 LEU QD . . 2.800 1.886 1.793 2.016 . 0 0 "[ . 1 . 2]" 1
937 1 59 LEU QB 1 60 VAL H . . 4.370 3.500 3.344 3.776 . 0 0 "[ . 1 . 2]" 1
938 1 59 LEU HB2 1 60 VAL H . . 5.040 4.139 3.901 4.396 . 0 0 "[ . 1 . 2]" 1
939 1 59 LEU HB3 1 60 VAL H . . 5.040 3.782 3.548 4.142 . 0 0 "[ . 1 . 2]" 1
940 1 59 LEU QD 1 60 VAL H . . 3.400 2.523 1.859 3.220 . 0 0 "[ . 1 . 2]" 1
941 1 59 LEU QD 1 60 VAL MG2 . . 5.000 4.215 3.640 4.714 . 0 0 "[ . 1 . 2]" 1
942 1 59 LEU QD 1 61 GLN H . . 5.440 4.320 3.381 5.255 . 0 0 "[ . 1 . 2]" 1
943 1 59 LEU QD 1 61 GLN QE . . 4.090 2.373 1.782 3.216 . 0 0 "[ . 1 . 2]" 1
944 1 59 LEU QD 1 61 GLN QG . . 4.100 2.260 1.789 2.976 . 0 0 "[ . 1 . 2]" 1
945 1 59 LEU MD1 1 60 VAL H . . 4.090 3.067 1.888 4.090 0.000 19 0 "[ . 1 . 2]" 1
946 1 59 LEU MD2 1 60 VAL H . . 4.090 3.184 1.862 4.032 . 0 0 "[ . 1 . 2]" 1
947 1 59 LEU HG 1 60 VAL H . . 5.360 2.865 1.953 4.688 . 0 0 "[ . 1 . 2]" 1
948 1 60 VAL H 1 60 VAL HB . . 3.850 2.498 2.385 2.600 . 0 0 "[ . 1 . 2]" 1
949 1 60 VAL H 1 60 VAL MG1 . . 4.070 3.759 3.705 3.829 . 0 0 "[ . 1 . 2]" 1
950 1 60 VAL H 1 60 VAL MG2 . . 3.950 2.902 2.555 3.130 . 0 0 "[ . 1 . 2]" 1
951 1 60 VAL H 1 61 GLN QG . . 5.190 4.150 3.904 4.578 . 0 0 "[ . 1 . 2]" 1
952 1 60 VAL HA 1 60 VAL MG1 . . 3.620 2.460 2.376 2.500 . 0 0 "[ . 1 . 2]" 1
953 1 60 VAL HA 1 60 VAL MG2 . . 3.560 2.235 2.118 2.405 . 0 0 "[ . 1 . 2]" 1
954 1 60 VAL HA 1 61 GLN H . . 3.110 2.182 2.141 2.218 . 0 0 "[ . 1 . 2]" 1
955 1 60 VAL HA 1 88 ALA MB . . 5.500 4.272 3.652 4.753 . 0 0 "[ . 1 . 2]" 1
956 1 60 VAL HB 1 62 TRP HE3 . . 4.720 4.037 3.577 4.323 . 0 0 "[ . 1 . 2]" 1
957 1 60 VAL HB 1 62 TRP HZ3 . . 4.380 3.213 2.329 3.738 . 0 0 "[ . 1 . 2]" 1
958 1 60 VAL HB 1 88 ALA MB . . 4.810 4.340 3.828 4.785 . 0 0 "[ . 1 . 2]" 1
959 1 60 VAL HB 1 92 ILE MG . . 4.120 2.889 2.290 3.630 . 0 0 "[ . 1 . 2]" 1
960 1 60 VAL MG1 1 61 GLN H . . 3.640 2.299 2.017 2.631 . 0 0 "[ . 1 . 2]" 1
961 1 60 VAL MG1 1 61 GLN HA . . 4.800 3.368 3.202 3.527 . 0 0 "[ . 1 . 2]" 1
962 1 60 VAL MG1 1 62 TRP H . . 4.390 3.884 3.533 4.319 . 0 0 "[ . 1 . 2]" 1
963 1 60 VAL MG1 1 62 TRP QB . . 4.170 3.242 2.981 3.418 . 0 0 "[ . 1 . 2]" 1
964 1 60 VAL MG1 1 62 TRP HE3 . . 3.380 2.026 1.905 2.187 . 0 0 "[ . 1 . 2]" 1
965 1 60 VAL MG1 1 62 TRP HZ3 . . 4.630 2.544 2.232 2.946 . 0 0 "[ . 1 . 2]" 1
966 1 60 VAL MG1 1 81 ARG QG . . 5.340 4.098 3.450 4.808 . 0 0 "[ . 1 . 2]" 1
967 1 60 VAL MG1 1 89 PHE HA . . 3.290 2.143 1.928 2.519 . 0 0 "[ . 1 . 2]" 1
968 1 60 VAL MG1 1 89 PHE QB . . 3.670 3.361 2.991 3.670 0.000 17 0 "[ . 1 . 2]" 1
969 1 60 VAL MG1 1 89 PHE QD . . 3.400 2.597 2.027 2.914 . 0 0 "[ . 1 . 2]" 1
970 1 60 VAL MG1 1 92 ILE MG . . 3.360 1.894 1.662 2.043 . 0 0 "[ . 1 . 2]" 1
971 1 60 VAL MG2 1 61 GLN H . . 3.950 3.823 3.685 3.948 . 0 0 "[ . 1 . 2]" 1
972 1 60 VAL MG2 1 62 TRP HE3 . . 4.810 4.728 4.460 4.821 0.011 17 0 "[ . 1 . 2]" 1
973 1 60 VAL MG2 1 85 THR H . . 5.500 4.404 3.726 5.505 0.005 17 0 "[ . 1 . 2]" 1
974 1 60 VAL MG2 1 88 ALA HA . . 4.800 3.596 3.080 4.044 . 0 0 "[ . 1 . 2]" 1
975 1 60 VAL MG2 1 88 ALA MB . . 3.110 2.000 1.620 2.386 . 0 0 "[ . 1 . 2]" 1
976 1 60 VAL MG2 1 89 PHE H . . 4.200 3.394 2.870 3.937 . 0 0 "[ . 1 . 2]" 1
977 1 60 VAL MG2 1 89 PHE HA . . 3.440 2.705 2.022 3.049 . 0 0 "[ . 1 . 2]" 1
978 1 60 VAL MG2 1 89 PHE QB . . 4.050 3.734 3.166 4.042 . 0 0 "[ . 1 . 2]" 1
979 1 60 VAL MG2 1 89 PHE QD . . 4.380 4.151 3.371 4.383 0.003 15 0 "[ . 1 . 2]" 1
980 1 60 VAL MG2 1 92 ILE MG . . 3.640 2.743 2.063 3.150 . 0 0 "[ . 1 . 2]" 1
981 1 61 GLN H 1 61 GLN QG . . 3.860 3.091 2.644 3.526 . 0 0 "[ . 1 . 2]" 1
982 1 61 GLN HA 1 61 GLN QG . . 3.640 2.424 2.249 2.622 . 0 0 "[ . 1 . 2]" 1
983 1 61 GLN HA 1 62 TRP H . . 3.160 2.155 2.138 2.235 . 0 0 "[ . 1 . 2]" 1
984 1 61 GLN HA 1 62 TRP HE3 . . 3.950 2.671 2.343 2.989 . 0 0 "[ . 1 . 2]" 1
985 1 61 GLN HA 1 62 TRP HZ3 . . 4.800 3.735 3.285 4.026 . 0 0 "[ . 1 . 2]" 1
986 1 61 GLN QB 1 62 TRP H . . 4.100 3.239 2.837 3.557 . 0 0 "[ . 1 . 2]" 1
987 1 61 GLN QB 1 82 ILE MD . . 5.340 4.420 2.773 5.086 . 0 0 "[ . 1 . 2]" 1
988 1 61 GLN QB 1 83 SER H . . 3.750 2.803 2.414 3.510 . 0 0 "[ . 1 . 2]" 1
989 1 61 GLN QB 1 83 SER QB . . 4.030 2.769 1.984 3.697 . 0 0 "[ . 1 . 2]" 1
990 1 61 GLN HB2 1 82 ILE HB . . 4.280 2.645 2.037 3.697 . 0 0 "[ . 1 . 2]" 1
991 1 61 GLN HB2 1 82 ILE MG . . 4.280 3.173 1.968 3.961 . 0 0 "[ . 1 . 2]" 1
992 1 61 GLN HB2 1 83 SER H . . 4.430 2.858 2.436 3.681 . 0 0 "[ . 1 . 2]" 1
993 1 61 GLN HB3 1 82 ILE HB . . 4.280 3.085 2.320 4.002 . 0 0 "[ . 1 . 2]" 1
994 1 61 GLN HB3 1 82 ILE MG . . 4.280 3.541 2.352 4.259 . 0 0 "[ . 1 . 2]" 1
995 1 61 GLN HB3 1 83 SER H . . 4.430 4.155 3.412 4.432 0.002 18 0 "[ . 1 . 2]" 1
996 1 61 GLN QG 1 62 TRP H . . 4.550 4.126 3.843 4.366 . 0 0 "[ . 1 . 2]" 1
997 1 61 GLN QG 1 82 ILE MG . . 5.500 4.507 3.273 5.365 . 0 0 "[ . 1 . 2]" 1
998 1 61 GLN QG 1 83 SER QB . . 4.390 3.546 2.471 4.394 0.004 17 0 "[ . 1 . 2]" 1
999 1 62 TRP H 1 62 TRP HE3 . . 3.860 2.377 1.968 2.802 . 0 0 "[ . 1 . 2]" 1
1000 1 62 TRP H 1 62 TRP HZ3 . . 4.550 4.154 3.818 4.554 0.004 17 0 "[ . 1 . 2]" 1
1001 1 62 TRP HA 1 63 GLU H . . 3.520 2.318 2.205 2.554 . 0 0 "[ . 1 . 2]" 1
1002 1 62 TRP HA 1 81 ARG HA . . 4.060 3.252 2.550 4.063 0.003 16 0 "[ . 1 . 2]" 1
1003 1 62 TRP HA 1 82 ILE H . . 3.640 2.794 2.041 3.287 . 0 0 "[ . 1 . 2]" 1
1004 1 62 TRP HA 1 82 ILE HB . . 4.200 3.459 2.490 3.936 . 0 0 "[ . 1 . 2]" 1
1005 1 62 TRP HA 1 82 ILE MD . . 4.490 3.487 1.760 4.248 . 0 0 "[ . 1 . 2]" 1
1006 1 62 TRP HA 1 82 ILE QG . . 3.590 2.467 2.013 3.651 0.061 14 0 "[ . 1 . 2]" 1
1007 1 62 TRP HA 1 82 ILE MG . . 5.500 4.672 4.105 5.013 . 0 0 "[ . 1 . 2]" 1
1008 1 62 TRP HA 1 83 SER H . . 4.800 4.439 3.773 4.805 0.005 15 0 "[ . 1 . 2]" 1
1009 1 62 TRP QB 1 63 GLU H . . 3.590 2.680 2.228 3.001 . 0 0 "[ . 1 . 2]" 1
1010 1 62 TRP QB 1 79 PHE QD . . 5.340 4.163 3.428 4.735 . 0 0 "[ . 1 . 2]" 1
1011 1 62 TRP QB 1 80 LYS QB . . 5.340 4.385 3.962 5.347 0.007 7 0 "[ . 1 . 2]" 1
1012 1 62 TRP QB 1 82 ILE QG . . 5.020 4.019 3.468 5.002 . 0 0 "[ . 1 . 2]" 1
1013 1 62 TRP HB2 1 82 ILE H . . 5.040 4.142 3.521 4.610 . 0 0 "[ . 1 . 2]" 1
1014 1 62 TRP HB2 1 89 PHE QE . . 4.010 2.468 2.192 3.183 . 0 0 "[ . 1 . 2]" 1
1015 1 62 TRP HB3 1 82 ILE H . . 5.040 3.703 3.260 4.067 . 0 0 "[ . 1 . 2]" 1
1016 1 62 TRP HB3 1 89 PHE QE . . 4.010 2.405 2.000 3.005 . 0 0 "[ . 1 . 2]" 1
1017 1 62 TRP HD1 1 63 GLU H . . 4.400 3.800 2.935 4.340 . 0 0 "[ . 1 . 2]" 1
1018 1 62 TRP HD1 1 64 MET QB . . 4.800 4.668 4.481 4.800 . 5 0 "[ . 1 . 2]" 1
1019 1 62 TRP HD1 1 64 MET ME . . 5.310 4.583 4.084 5.070 . 0 0 "[ . 1 . 2]" 1
1020 1 62 TRP HD1 1 64 MET HG2 . . 3.850 3.201 2.507 3.598 . 0 0 "[ . 1 . 2]" 1
1021 1 62 TRP HD1 1 64 MET QG . . 3.380 2.544 2.360 2.703 . 0 0 "[ . 1 . 2]" 1
1022 1 62 TRP HD1 1 64 MET HG3 . . 3.850 2.791 2.430 3.824 . 0 0 "[ . 1 . 2]" 1
1023 1 62 TRP HD1 1 79 PHE HA . . 4.380 3.336 2.774 3.842 . 0 0 "[ . 1 . 2]" 1
1024 1 62 TRP HD1 1 79 PHE QB . . 4.390 3.626 2.703 4.230 . 0 0 "[ . 1 . 2]" 1
1025 1 62 TRP HD1 1 80 LYS H . . 4.430 3.748 3.223 4.257 . 0 0 "[ . 1 . 2]" 1
1026 1 62 TRP HD1 1 96 ILE QG . . 5.500 5.041 4.673 5.480 . 0 0 "[ . 1 . 2]" 1
1027 1 62 TRP HE1 1 64 MET QB . . 4.990 4.635 4.298 4.959 . 0 0 "[ . 1 . 2]" 1
1028 1 62 TRP HE1 1 64 MET ME . . 4.200 3.596 2.988 4.049 . 0 0 "[ . 1 . 2]" 1
1029 1 62 TRP HE1 1 64 MET HG2 . . 3.750 3.509 2.971 3.745 . 0 0 "[ . 1 . 2]" 1
1030 1 62 TRP HE1 1 64 MET QG . . 3.260 2.869 2.501 3.156 . 0 0 "[ . 1 . 2]" 1
1031 1 62 TRP HE1 1 64 MET HG3 . . 3.750 3.060 2.576 3.490 . 0 0 "[ . 1 . 2]" 1
1032 1 62 TRP HE1 1 79 PHE QD . . 3.950 3.554 2.426 3.953 0.003 17 0 "[ . 1 . 2]" 1
1033 1 62 TRP HE1 1 79 PHE QE . . 4.280 3.215 2.238 4.136 . 0 0 "[ . 1 . 2]" 1
1034 1 62 TRP HE1 1 96 ILE QG . . 4.720 2.842 2.490 3.260 . 0 0 "[ . 1 . 2]" 1
1035 1 62 TRP HH2 1 92 ILE QG . . 4.000 2.179 1.811 2.587 . 0 0 "[ . 1 . 2]" 1
1036 1 62 TRP HH2 1 96 ILE MD . . 4.280 3.569 3.101 4.034 . 0 0 "[ . 1 . 2]" 1
1037 1 62 TRP HZ2 1 92 ILE QG . . 4.380 3.137 2.817 3.508 . 0 0 "[ . 1 . 2]" 1
1038 1 62 TRP HZ2 1 92 ILE MG . . 4.800 4.287 3.821 4.765 . 0 0 "[ . 1 . 2]" 1
1039 1 62 TRP HZ2 1 95 LYS QB . . 5.500 5.475 5.375 5.505 0.005 15 0 "[ . 1 . 2]" 1
1040 1 62 TRP HZ2 1 96 ILE MD . . 3.410 2.385 1.979 3.133 . 0 0 "[ . 1 . 2]" 1
1041 1 62 TRP HZ2 1 96 ILE QG . . 4.060 2.185 1.972 2.459 . 0 0 "[ . 1 . 2]" 1
1042 1 62 TRP HZ3 1 92 ILE QG . . 4.750 2.890 2.296 3.594 . 0 0 "[ . 1 . 2]" 1
1043 1 62 TRP HZ3 1 92 ILE MG . . 4.200 3.051 2.505 3.565 . 0 0 "[ . 1 . 2]" 1
1044 1 63 GLU H 1 63 GLU QB . . 3.570 2.514 2.242 3.142 . 0 0 "[ . 1 . 2]" 1
1045 1 63 GLU H 1 63 GLU QG . . 4.350 2.700 1.929 3.472 . 0 0 "[ . 1 . 2]" 1
1046 1 63 GLU H 1 80 LYS QB . . 4.550 2.922 2.112 4.325 . 0 0 "[ . 1 . 2]" 1
1047 1 63 GLU H 1 82 ILE MD . . 4.630 3.529 1.840 4.506 . 0 0 "[ . 1 . 2]" 1
1048 1 63 GLU H 1 82 ILE QG . . 4.050 3.285 2.715 3.880 . 0 0 "[ . 1 . 2]" 1
1049 1 63 GLU HA 1 63 GLU HG2 . . 4.240 2.705 2.431 3.522 . 0 0 "[ . 1 . 2]" 1
1050 1 63 GLU HA 1 63 GLU QG . . 3.670 2.485 2.278 3.264 . 0 0 "[ . 1 . 2]" 1
1051 1 63 GLU HA 1 63 GLU HG3 . . 4.240 3.091 2.324 3.911 . 0 0 "[ . 1 . 2]" 1
1052 1 63 GLU HA 1 64 MET H . . 3.140 2.442 2.290 2.554 . 0 0 "[ . 1 . 2]" 1
1053 1 63 GLU QB 1 64 MET H . . 3.820 2.358 2.159 2.740 . 0 0 "[ . 1 . 2]" 1
1054 1 63 GLU QB 1 82 ILE MD . . 5.340 3.573 2.067 4.792 . 0 0 "[ . 1 . 2]" 1
1055 1 63 GLU HB2 1 80 LYS QB . . 4.380 2.673 2.025 4.101 . 0 0 "[ . 1 . 2]" 1
1056 1 63 GLU HB3 1 80 LYS QB . . 4.380 4.030 3.493 4.400 0.020 7 0 "[ . 1 . 2]" 1
1057 1 63 GLU QG 1 82 ILE MD . . 3.810 2.687 1.958 3.767 . 0 0 "[ . 1 . 2]" 1
1058 1 63 GLU QG 1 82 ILE QG . . 3.820 2.771 2.355 3.811 . 0 0 "[ . 1 . 2]" 1
1059 1 63 GLU QG 1 82 ILE MG . . 5.340 4.514 3.969 5.313 . 0 0 "[ . 1 . 2]" 1
1060 1 63 GLU HG2 1 82 ILE MD . . 4.370 3.755 2.760 4.242 . 0 0 "[ . 1 . 2]" 1
1061 1 63 GLU HG3 1 82 ILE MD . . 4.370 2.831 1.971 4.351 . 0 0 "[ . 1 . 2]" 1
1062 1 64 MET H 1 64 MET HG2 . . 4.800 4.278 3.230 4.591 . 0 0 "[ . 1 . 2]" 1
1063 1 64 MET H 1 64 MET QG . . 4.140 3.265 2.901 3.516 . 0 0 "[ . 1 . 2]" 1
1064 1 64 MET H 1 64 MET HG3 . . 4.800 3.473 2.959 4.431 . 0 0 "[ . 1 . 2]" 1
1065 1 64 MET HA 1 64 MET QG . . 3.700 2.426 2.273 2.685 . 0 0 "[ . 1 . 2]" 1
1066 1 64 MET HA 1 65 GLU H . . 3.240 2.178 2.141 2.328 . 0 0 "[ . 1 . 2]" 1
1067 1 64 MET HA 1 79 PHE HA . . 3.850 3.314 2.549 3.773 . 0 0 "[ . 1 . 2]" 1
1068 1 64 MET HA 1 80 LYS H . . 4.800 4.029 3.262 4.568 . 0 0 "[ . 1 . 2]" 1
1069 1 64 MET QB 1 65 GLU H . . 4.030 3.287 2.575 3.779 . 0 0 "[ . 1 . 2]" 1
1070 1 64 MET QB 1 77 VAL MG1 . . 3.890 2.521 1.871 3.006 . 0 0 "[ . 1 . 2]" 1
1071 1 64 MET HB2 1 65 GLU H . . 4.710 4.297 3.764 4.582 . 0 0 "[ . 1 . 2]" 1
1072 1 64 MET HB2 1 77 VAL MG1 . . 4.460 3.954 3.290 4.420 . 0 0 "[ . 1 . 2]" 1
1073 1 64 MET HB3 1 65 GLU H . . 4.710 3.420 2.621 4.024 . 0 0 "[ . 1 . 2]" 1
1074 1 64 MET HB3 1 77 VAL MG1 . . 4.460 2.551 1.882 3.058 . 0 0 "[ . 1 . 2]" 1
1075 1 64 MET ME 1 64 MET HG2 . . 3.810 2.463 2.166 3.335 . 0 0 "[ . 1 . 2]" 1
1076 1 64 MET ME 1 64 MET QG . . 3.180 2.308 2.121 2.594 . 0 0 "[ . 1 . 2]" 1
1077 1 64 MET ME 1 64 MET HG3 . . 3.810 3.242 2.148 3.400 . 0 0 "[ . 1 . 2]" 1
1078 1 64 MET ME 1 77 VAL MG1 . . 2.910 1.918 1.704 2.271 . 0 0 "[ . 1 . 2]" 1
1079 1 64 MET ME 1 77 VAL MG2 . . 4.000 3.177 2.694 3.512 . 0 0 "[ . 1 . 2]" 1
1080 1 64 MET ME 1 79 PHE QD . . 4.490 4.004 3.673 4.487 . 0 0 "[ . 1 . 2]" 1
1081 1 64 MET ME 1 79 PHE QE . . 3.590 2.827 2.294 3.303 . 0 0 "[ . 1 . 2]" 1
1082 1 64 MET ME 1 79 PHE HZ . . 3.670 2.538 1.905 3.008 . 0 0 "[ . 1 . 2]" 1
1083 1 64 MET ME 1 96 ILE MG . . 3.100 2.052 1.690 2.412 . 0 0 "[ . 1 . 2]" 1
1084 1 64 MET ME 1 100 LEU MD2 . . 4.250 3.006 2.251 3.509 . 0 0 "[ . 1 . 2]" 1
1085 1 64 MET QG 1 65 GLU H . . 4.980 4.127 3.848 4.597 . 0 0 "[ . 1 . 2]" 1
1086 1 64 MET QG 1 77 VAL MG1 . . 4.390 2.880 2.444 3.663 . 0 0 "[ . 1 . 2]" 1
1087 1 64 MET QG 1 80 LYS H . . 4.720 4.242 3.437 4.720 . 0 0 "[ . 1 . 2]" 1
1088 1 65 GLU H 1 65 GLU HB3 . . 4.150 2.577 2.334 2.850 . 0 0 "[ . 1 . 2]" 1
1089 1 65 GLU H 1 77 VAL MG1 . . 4.630 3.248 2.611 4.155 . 0 0 "[ . 1 . 2]" 1
1090 1 65 GLU H 1 78 ARG H . . 4.000 2.768 2.109 3.531 . 0 0 "[ . 1 . 2]" 1
1091 1 65 GLU H 1 78 ARG QB . . 4.580 2.767 1.870 4.511 . 0 0 "[ . 1 . 2]" 1
1092 1 65 GLU H 1 78 ARG QG . . 4.820 3.536 2.164 4.634 . 0 0 "[ . 1 . 2]" 1
1093 1 65 GLU HA 1 65 GLU HG2 . . 3.900 3.297 2.371 3.898 . 0 0 "[ . 1 . 2]" 1
1094 1 65 GLU HA 1 65 GLU HG3 . . 3.900 2.928 2.613 3.694 . 0 0 "[ . 1 . 2]" 1
1095 1 65 GLU HA 1 66 VAL H . . 3.160 2.230 2.145 2.298 . 0 0 "[ . 1 . 2]" 1
1096 1 65 GLU HA 1 66 VAL MG2 . . 4.800 3.495 3.232 3.867 . 0 0 "[ . 1 . 2]" 1
1097 1 65 GLU HB2 1 66 VAL H . . 4.340 3.889 3.618 4.057 . 0 0 "[ . 1 . 2]" 1
1098 1 65 GLU HB3 1 67 CYS QB . . 5.340 4.719 4.283 5.302 . 0 0 "[ . 1 . 2]" 1
1099 1 65 GLU HB3 1 78 ARG QD . . 4.750 3.626 2.101 4.752 0.002 17 0 "[ . 1 . 2]" 1
1100 1 65 GLU HB3 1 78 ARG QG . . 3.960 3.090 2.154 3.960 . 0 0 "[ . 1 . 2]" 1
1101 1 65 GLU QG 1 66 VAL H . . 3.550 2.397 1.961 2.881 . 0 0 "[ . 1 . 2]" 1
1102 1 65 GLU QG 1 67 CYS QB . . 4.140 3.036 2.472 4.139 . 0 0 "[ . 1 . 2]" 1
1103 1 65 GLU HG2 1 66 VAL H . . 4.250 2.989 1.969 4.172 . 0 0 "[ . 1 . 2]" 1
1104 1 65 GLU HG3 1 66 VAL H . . 4.250 2.783 2.066 3.816 . 0 0 "[ . 1 . 2]" 1
1105 1 66 VAL H 1 66 VAL HB . . 3.680 2.585 2.386 2.708 . 0 0 "[ . 1 . 2]" 1
1106 1 66 VAL H 1 66 VAL MG1 . . 4.550 3.815 3.733 3.859 . 0 0 "[ . 1 . 2]" 1
1107 1 66 VAL H 1 66 VAL MG2 . . 3.710 2.518 2.136 2.792 . 0 0 "[ . 1 . 2]" 1
1108 1 66 VAL HA 1 66 VAL MG1 . . 3.520 2.315 2.138 2.439 . 0 0 "[ . 1 . 2]" 1
1109 1 66 VAL HA 1 66 VAL MG2 . . 3.380 2.388 2.173 2.522 . 0 0 "[ . 1 . 2]" 1
1110 1 66 VAL HA 1 67 CYS H . . 2.980 2.164 2.141 2.234 . 0 0 "[ . 1 . 2]" 1
1111 1 66 VAL HB 1 67 CYS H . . 4.690 4.250 3.909 4.495 . 0 0 "[ . 1 . 2]" 1
1112 1 66 VAL MG1 1 67 CYS H . . 3.740 2.772 1.912 3.314 . 0 0 "[ . 1 . 2]" 1
1113 1 66 VAL MG1 1 75 ASN HB2 . . 4.280 3.478 2.038 4.121 . 0 0 "[ . 1 . 2]" 1
1114 1 66 VAL MG1 1 75 ASN QB . . 3.650 2.528 1.933 3.192 . 0 0 "[ . 1 . 2]" 1
1115 1 66 VAL MG1 1 75 ASN HB3 . . 4.280 2.673 1.956 3.354 . 0 0 "[ . 1 . 2]" 1
1116 1 66 VAL MG1 1 76 GLY H . . 4.800 4.121 3.450 4.710 . 0 0 "[ . 1 . 2]" 1
1117 1 66 VAL MG2 1 67 CYS H . . 4.340 4.132 3.812 4.298 . 0 0 "[ . 1 . 2]" 1
1118 1 67 CYS H 1 76 GLY H . . 4.370 3.654 3.168 4.249 . 0 0 "[ . 1 . 2]" 1
1119 1 67 CYS H 1 77 VAL MG2 . . 5.500 4.962 4.500 5.495 . 0 0 "[ . 1 . 2]" 1
1120 1 67 CYS HA 1 68 LYS QB . . 4.380 4.250 4.019 4.393 0.013 18 0 "[ . 1 . 2]" 1
1121 1 67 CYS QB 1 68 LYS H . . 3.480 3.062 2.165 3.477 . 0 0 "[ . 1 . 2]" 1
1122 1 67 CYS QB 1 68 LYS QB . . 5.200 4.805 4.322 5.175 . 0 0 "[ . 1 . 2]" 1
1123 1 67 CYS QB 1 69 LEU QD . . 4.650 4.482 4.042 4.661 0.011 15 0 "[ . 1 . 2]" 1
1124 1 67 CYS HB2 1 68 LYS H . . 4.140 3.880 2.401 4.140 . 0 0 "[ . 1 . 2]" 1
1125 1 67 CYS HB3 1 68 LYS H . . 4.140 3.279 2.181 3.780 . 0 0 "[ . 1 . 2]" 1
1126 1 68 LYS H 1 68 LYS QB . . 3.090 2.430 2.162 2.824 . 0 0 "[ . 1 . 2]" 1
1127 1 68 LYS H 1 68 LYS QD . . 4.800 3.856 2.068 4.704 . 0 0 "[ . 1 . 2]" 1
1128 1 68 LYS H 1 68 LYS QG . . 4.620 2.892 1.890 4.051 . 0 0 "[ . 1 . 2]" 1
1129 1 68 LYS HA 1 69 LEU H . . 3.210 2.201 2.141 2.321 . 0 0 "[ . 1 . 2]" 1
1130 1 68 LYS HA 1 75 ASN HA . . 3.520 2.280 1.997 2.998 . 0 0 "[ . 1 . 2]" 1
1131 1 68 LYS QB 1 68 LYS QE . . 4.490 2.898 1.990 3.750 . 0 0 "[ . 1 . 2]" 1
1132 1 68 LYS QB 1 70 PRO QD . . 5.500 5.335 4.834 5.516 0.016 14 0 "[ . 1 . 2]" 1
1133 1 69 LEU H 1 69 LEU HB2 . . 3.790 2.619 2.228 3.476 . 0 0 "[ . 1 . 2]" 1
1134 1 69 LEU H 1 69 LEU QB . . 3.210 2.535 2.205 2.858 . 0 0 "[ . 1 . 2]" 1
1135 1 69 LEU H 1 69 LEU HB3 . . 3.790 3.574 3.039 3.687 . 0 0 "[ . 1 . 2]" 1
1136 1 69 LEU H 1 69 LEU MD1 . . 4.380 3.194 1.830 3.757 . 0 0 "[ . 1 . 2]" 1
1137 1 69 LEU H 1 69 LEU QD . . 3.820 2.749 1.826 3.219 . 0 0 "[ . 1 . 2]" 1
1138 1 69 LEU H 1 69 LEU MD2 . . 4.380 3.380 1.851 4.150 . 0 0 "[ . 1 . 2]" 1
1139 1 69 LEU H 1 69 LEU HG . . 4.190 2.386 1.897 3.926 . 0 0 "[ . 1 . 2]" 1
1140 1 69 LEU H 1 70 PRO QD . . 4.690 4.318 4.232 4.364 . 0 0 "[ . 1 . 2]" 1
1141 1 69 LEU H 1 72 LEU QD . . 5.440 5.180 4.364 5.450 0.010 17 0 "[ . 1 . 2]" 1
1142 1 69 LEU H 1 74 LEU H . . 5.270 3.720 2.745 5.272 0.002 7 0 "[ . 1 . 2]" 1
1143 1 69 LEU H 1 75 ASN HA . . 3.790 3.205 2.657 3.794 0.004 10 0 "[ . 1 . 2]" 1
1144 1 69 LEU HA 1 69 LEU MD1 . . 4.280 3.760 1.989 4.117 . 0 0 "[ . 1 . 2]" 1
1145 1 69 LEU HA 1 69 LEU QD . . 3.220 2.468 1.927 3.239 0.019 11 0 "[ . 1 . 2]" 1
1146 1 69 LEU HA 1 69 LEU MD2 . . 4.280 2.606 2.051 3.695 . 0 0 "[ . 1 . 2]" 1
1147 1 69 LEU HA 1 69 LEU HG . . 4.120 3.026 2.397 3.694 . 0 0 "[ . 1 . 2]" 1
1148 1 69 LEU HA 1 70 PRO QD . . 3.020 1.980 1.923 2.011 . 0 0 "[ . 1 . 2]" 1
1149 1 69 LEU QB 1 70 PRO QD . . 3.450 2.401 2.230 2.643 . 0 0 "[ . 1 . 2]" 1
1150 1 69 LEU QB 1 71 ARG H . . 4.830 3.047 2.430 3.370 . 0 0 "[ . 1 . 2]" 1
1151 1 69 LEU QB 1 72 LEU QD . . 4.260 2.946 2.462 3.355 . 0 0 "[ . 1 . 2]" 1
1152 1 69 LEU QB 1 74 LEU H . . 4.690 3.233 1.940 4.703 0.013 10 0 "[ . 1 . 2]" 1
1153 1 69 LEU HB2 1 70 PRO QD . . 4.060 3.669 2.646 3.894 . 0 0 "[ . 1 . 2]" 1
1154 1 69 LEU HB3 1 70 PRO QD . . 4.060 2.454 2.251 2.968 . 0 0 "[ . 1 . 2]" 1
1155 1 69 LEU QD 1 70 PRO QD . . 3.830 2.867 1.960 3.776 . 0 0 "[ . 1 . 2]" 1
1156 1 69 LEU QD 1 72 LEU QB . . 4.460 2.169 1.775 3.134 . 0 0 "[ . 1 . 2]" 1
1157 1 69 LEU QD 1 72 LEU QD . . 4.080 2.091 1.669 2.887 . 0 0 "[ . 1 . 2]" 1
1158 1 69 LEU QD 1 74 LEU QB . . 3.790 2.898 2.082 3.802 0.012 11 0 "[ . 1 . 2]" 1
1159 1 69 LEU QD 1 74 LEU QD . . 3.270 3.108 1.897 3.276 0.006 15 0 "[ . 1 . 2]" 1
1160 1 69 LEU QD 1 75 ASN HA . . 4.330 3.631 2.080 4.331 0.001 14 0 "[ . 1 . 2]" 1
1161 1 69 LEU QD 1 76 GLY H . . 4.080 2.916 1.873 3.877 . 0 0 "[ . 1 . 2]" 1
1162 1 69 LEU QD 1 76 GLY QA . . 3.330 2.497 1.986 3.320 . 0 0 "[ . 1 . 2]" 1
1163 1 69 LEU MD1 1 75 ASN HA . . 5.210 4.125 2.498 4.997 . 0 0 "[ . 1 . 2]" 1
1164 1 69 LEU MD1 1 76 GLY H . . 4.740 3.499 2.059 4.437 . 0 0 "[ . 1 . 2]" 1
1165 1 69 LEU MD2 1 75 ASN HA . . 5.210 4.657 2.083 5.213 0.003 13 0 "[ . 1 . 2]" 1
1166 1 69 LEU MD2 1 76 GLY H . . 4.740 3.558 1.877 4.602 . 0 0 "[ . 1 . 2]" 1
1167 1 69 LEU HG 1 70 PRO QD . . 5.170 4.224 2.979 4.614 . 0 0 "[ . 1 . 2]" 1
1168 1 69 LEU HG 1 75 ASN HA . . 5.210 3.973 3.354 5.131 . 0 0 "[ . 1 . 2]" 1
1169 1 69 LEU HG 1 76 GLY H . . 4.550 3.202 2.199 4.494 . 0 0 "[ . 1 . 2]" 1
1170 1 69 LEU HG 1 76 GLY QA . . 5.340 3.510 2.522 4.953 . 0 0 "[ . 1 . 2]" 1
1171 1 70 PRO HA 1 72 LEU H . . 5.480 5.060 3.947 5.490 0.010 16 0 "[ . 1 . 2]" 1
1172 1 70 PRO QD 1 71 ARG H . . 4.420 2.681 2.604 2.808 . 0 0 "[ . 1 . 2]" 1
1173 1 71 ARG H 1 71 ARG QB . . 3.750 2.307 2.162 2.569 . 0 0 "[ . 1 . 2]" 1
1174 1 71 ARG H 1 71 ARG QG . . 4.180 3.307 1.942 4.079 . 0 0 "[ . 1 . 2]" 1
1175 1 71 ARG H 1 72 LEU H . . 4.000 2.599 1.974 3.224 . 0 0 "[ . 1 . 2]" 1
1176 1 71 ARG HA 1 71 ARG QD . . 4.490 3.112 1.988 4.088 . 0 0 "[ . 1 . 2]" 1
1177 1 71 ARG HA 1 71 ARG QG . . 3.560 2.487 2.151 2.975 . 0 0 "[ . 1 . 2]" 1
1178 1 71 ARG QB 1 71 ARG QD . . 3.380 2.267 2.045 2.684 . 0 0 "[ . 1 . 2]" 1
1179 1 71 ARG QB 1 72 LEU H . . 3.330 2.346 1.896 3.028 . 0 0 "[ . 1 . 2]" 1
1180 1 71 ARG QB 1 72 LEU MD1 . . 5.190 3.028 1.951 4.343 . 0 0 "[ . 1 . 2]" 1
1181 1 71 ARG QB 1 72 LEU QD . . 4.390 2.739 1.948 3.949 . 0 0 "[ . 1 . 2]" 1
1182 1 71 ARG QB 1 72 LEU MD2 . . 5.190 4.152 2.219 4.769 . 0 0 "[ . 1 . 2]" 1
1183 1 72 LEU H 1 72 LEU QB . . 3.350 2.402 2.136 2.778 . 0 0 "[ . 1 . 2]" 1
1184 1 72 LEU H 1 72 LEU MD1 . . 4.380 2.801 1.879 3.873 . 0 0 "[ . 1 . 2]" 1
1185 1 72 LEU H 1 72 LEU MD2 . . 4.380 3.892 2.215 4.287 . 0 0 "[ . 1 . 2]" 1
1186 1 72 LEU H 1 72 LEU HG . . 4.460 3.151 1.968 4.241 . 0 0 "[ . 1 . 2]" 1
1187 1 72 LEU H 1 73 SER H . . 4.640 4.363 2.701 4.625 . 0 0 "[ . 1 . 2]" 1
1188 1 72 LEU HA 1 72 LEU MD1 . . 4.490 3.470 2.068 4.008 . 0 0 "[ . 1 . 2]" 1
1189 1 72 LEU HA 1 72 LEU QD . . 3.140 2.670 2.025 3.200 0.060 10 0 "[ . 1 . 2]" 1
1190 1 72 LEU HA 1 72 LEU MD2 . . 4.490 3.036 2.219 3.756 . 0 0 "[ . 1 . 2]" 1
1191 1 72 LEU QB 1 72 LEU MD1 . . 3.220 2.081 1.975 2.274 . 0 0 "[ . 1 . 2]" 1
1192 1 72 LEU QB 1 72 LEU QD . . 2.780 1.853 1.789 1.968 . 0 0 "[ . 1 . 2]" 1
1193 1 72 LEU QB 1 72 LEU MD2 . . 3.220 2.088 1.972 2.254 . 0 0 "[ . 1 . 2]" 1
1194 1 72 LEU QB 1 73 SER H . . 4.110 2.549 1.976 3.171 . 0 0 "[ . 1 . 2]" 1
1195 1 72 LEU QB 1 74 LEU H . . 3.690 2.812 2.348 3.149 . 0 0 "[ . 1 . 2]" 1
1196 1 72 LEU QD 1 73 SER H . . 4.830 3.568 2.606 4.296 . 0 0 "[ . 1 . 2]" 1
1197 1 72 LEU MD1 1 73 SER H . . 5.500 4.576 2.853 5.028 . 0 0 "[ . 1 . 2]" 1
1198 1 72 LEU MD2 1 73 SER H . . 5.500 3.874 2.618 4.909 . 0 0 "[ . 1 . 2]" 1
1199 1 73 SER H 1 74 LEU H . . 3.860 3.039 2.239 3.431 . 0 0 "[ . 1 . 2]" 1
1200 1 73 SER HB2 1 74 LEU H . . 5.410 4.422 3.998 4.658 . 0 0 "[ . 1 . 2]" 1
1201 1 73 SER HB3 1 74 LEU H . . 5.410 4.305 2.762 4.659 . 0 0 "[ . 1 . 2]" 1
1202 1 74 LEU H 1 74 LEU QB . . 3.430 2.765 2.386 3.271 . 0 0 "[ . 1 . 2]" 1
1203 1 74 LEU H 1 74 LEU MD1 . . 4.800 3.164 2.229 4.099 . 0 0 "[ . 1 . 2]" 1
1204 1 74 LEU H 1 74 LEU QD . . 4.000 2.964 1.791 3.803 . 0 0 "[ . 1 . 2]" 1
1205 1 74 LEU H 1 74 LEU MD2 . . 4.800 4.112 1.870 4.603 . 0 0 "[ . 1 . 2]" 1
1206 1 74 LEU H 1 74 LEU HG . . 4.020 3.273 2.015 4.045 0.025 11 0 "[ . 1 . 2]" 1
1207 1 74 LEU H 1 75 ASN H . . 4.870 4.420 4.361 4.568 . 0 0 "[ . 1 . 2]" 1
1208 1 74 LEU HA 1 74 LEU MD1 . . 4.630 3.701 3.291 4.026 . 0 0 "[ . 1 . 2]" 1
1209 1 74 LEU HA 1 74 LEU QD . . 3.390 2.778 2.316 3.394 0.004 7 0 "[ . 1 . 2]" 1
1210 1 74 LEU HA 1 74 LEU MD2 . . 4.630 3.029 2.334 4.013 . 0 0 "[ . 1 . 2]" 1
1211 1 74 LEU HA 1 75 ASN H . . 3.210 2.491 2.237 2.652 . 0 0 "[ . 1 . 2]" 1
1212 1 74 LEU QB 1 75 ASN H . . 3.440 2.264 1.896 2.803 . 0 0 "[ . 1 . 2]" 1
1213 1 74 LEU QB 1 75 ASN HA . . 5.340 4.213 4.050 4.386 . 0 0 "[ . 1 . 2]" 1
1214 1 74 LEU HB2 1 75 ASN H . . 4.110 3.219 1.908 3.983 . 0 0 "[ . 1 . 2]" 1
1215 1 74 LEU HB3 1 75 ASN H . . 4.110 2.450 2.025 3.436 . 0 0 "[ . 1 . 2]" 1
1216 1 74 LEU QD 1 75 ASN H . . 3.980 3.448 2.616 3.954 . 0 0 "[ . 1 . 2]" 1
1217 1 74 LEU HG 1 75 ASN H . . 4.870 4.522 4.139 4.847 . 0 0 "[ . 1 . 2]" 1
1218 1 75 ASN H 1 75 ASN QB . . 3.530 2.606 2.356 3.056 . 0 0 "[ . 1 . 2]" 1
1219 1 75 ASN H 1 76 GLY H . . 4.690 4.368 4.013 4.547 . 0 0 "[ . 1 . 2]" 1
1220 1 75 ASN HA 1 76 GLY H . . 3.320 2.189 2.144 2.445 . 0 0 "[ . 1 . 2]" 1
1221 1 75 ASN QB 1 76 GLY H . . 3.720 3.285 2.911 3.712 . 0 0 "[ . 1 . 2]" 1
1222 1 75 ASN HB2 1 76 GLY H . . 4.430 4.110 3.039 4.431 0.001 5 0 "[ . 1 . 2]" 1
1223 1 75 ASN HB3 1 76 GLY H . . 4.430 3.506 3.031 4.343 . 0 0 "[ . 1 . 2]" 1
1224 1 77 VAL H 1 77 VAL HB . . 3.950 2.613 2.409 2.800 . 0 0 "[ . 1 . 2]" 1
1225 1 77 VAL H 1 77 VAL MG2 . . 3.950 2.500 1.924 3.088 . 0 0 "[ . 1 . 2]" 1
1226 1 77 VAL HA 1 77 VAL MG1 . . 3.490 2.347 2.098 2.506 . 0 0 "[ . 1 . 2]" 1
1227 1 77 VAL HA 1 77 VAL MG2 . . 3.430 2.402 2.194 2.576 . 0 0 "[ . 1 . 2]" 1
1228 1 77 VAL HA 1 78 ARG H . . 3.200 2.199 2.140 2.345 . 0 0 "[ . 1 . 2]" 1
1229 1 77 VAL HB 1 79 PHE QE . . 4.490 2.063 1.999 2.283 . 0 0 "[ . 1 . 2]" 1
1230 1 77 VAL HB 1 100 LEU MD1 . . 4.750 3.612 3.118 4.062 . 0 0 "[ . 1 . 2]" 1
1231 1 77 VAL MG1 1 78 ARG H . . 3.850 2.368 1.882 3.036 . 0 0 "[ . 1 . 2]" 1
1232 1 77 VAL MG1 1 79 PHE QD . . 4.380 2.989 2.460 3.650 . 0 0 "[ . 1 . 2]" 1
1233 1 77 VAL MG1 1 79 PHE QE . . 4.000 2.274 1.910 3.199 . 0 0 "[ . 1 . 2]" 1
1234 1 77 VAL MG1 1 79 PHE HZ . . 4.800 3.051 2.474 3.997 . 0 0 "[ . 1 . 2]" 1
1235 1 77 VAL MG1 1 96 ILE MG . . 5.240 3.996 3.676 4.463 . 0 0 "[ . 1 . 2]" 1
1236 1 77 VAL MG1 1 100 LEU MD1 . . 3.560 3.134 2.670 3.494 . 0 0 "[ . 1 . 2]" 1
1237 1 77 VAL MG1 1 100 LEU MD2 . . 4.800 4.219 3.672 4.635 . 0 0 "[ . 1 . 2]" 1
1238 1 77 VAL MG1 1 102 LEU MD1 . . 4.770 4.449 3.758 4.770 0.000 3 0 "[ . 1 . 2]" 1
1239 1 77 VAL MG2 1 78 ARG H . . 4.630 3.984 3.672 4.255 . 0 0 "[ . 1 . 2]" 1
1240 1 77 VAL MG2 1 100 LEU MD1 . . 2.950 2.540 1.843 2.917 . 0 0 "[ . 1 . 2]" 1
1241 1 78 ARG H 1 78 ARG QB . . 3.670 2.469 2.221 2.964 . 0 0 "[ . 1 . 2]" 1
1242 1 78 ARG H 1 78 ARG QG . . 4.200 3.217 1.843 4.165 . 0 0 "[ . 1 . 2]" 1
1243 1 78 ARG HA 1 79 PHE H . . 3.460 2.191 2.139 2.293 . 0 0 "[ . 1 . 2]" 1
1244 1 78 ARG HA 1 79 PHE QD . . 4.630 3.123 2.634 3.652 . 0 0 "[ . 1 . 2]" 1
1245 1 78 ARG QB 1 79 PHE H . . 4.030 3.409 2.721 3.867 . 0 0 "[ . 1 . 2]" 1
1246 1 78 ARG HB2 1 79 PHE H . . 4.630 3.998 3.155 4.550 . 0 0 "[ . 1 . 2]" 1
1247 1 78 ARG HB3 1 79 PHE H . . 4.630 3.842 2.786 4.297 . 0 0 "[ . 1 . 2]" 1
1248 1 78 ARG QG 1 79 PHE H . . 4.550 3.470 2.067 4.535 . 0 0 "[ . 1 . 2]" 1
1249 1 79 PHE H 1 79 PHE QB . . 3.620 2.477 2.269 2.685 . 0 0 "[ . 1 . 2]" 1
1250 1 79 PHE H 1 79 PHE QD . . 3.710 2.515 1.964 2.997 . 0 0 "[ . 1 . 2]" 1
1251 1 79 PHE HA 1 79 PHE QD . . 4.380 3.085 2.992 3.146 . 0 0 "[ . 1 . 2]" 1
1252 1 79 PHE HA 1 80 LYS H . . 3.280 2.181 2.139 2.313 . 0 0 "[ . 1 . 2]" 1
1253 1 79 PHE QB 1 80 LYS H . . 4.450 3.448 2.609 3.691 . 0 0 "[ . 1 . 2]" 1
1254 1 79 PHE QB 1 89 PHE HZ . . 3.530 2.474 2.035 3.018 . 0 0 "[ . 1 . 2]" 1
1255 1 79 PHE QB 1 93 ALA MB . . 5.200 3.984 3.394 4.468 . 0 0 "[ . 1 . 2]" 1
1256 1 79 PHE HB2 1 89 PHE HZ . . 4.060 3.617 2.968 4.061 0.001 16 0 "[ . 1 . 2]" 1
1257 1 79 PHE HB3 1 89 PHE HZ . . 4.060 2.525 2.067 3.144 . 0 0 "[ . 1 . 2]" 1
1258 1 79 PHE QD 1 89 PHE HZ . . 4.440 3.857 3.142 4.395 . 0 0 "[ . 1 . 2]" 1
1259 1 79 PHE QD 1 93 ALA MB . . 4.000 3.322 2.721 3.766 . 0 0 "[ . 1 . 2]" 1
1260 1 79 PHE QD 1 96 ILE MG . . 4.800 4.512 4.171 4.799 . 0 0 "[ . 1 . 2]" 1
1261 1 79 PHE QE 1 93 ALA HA . . 4.060 3.618 3.018 4.035 . 0 0 "[ . 1 . 2]" 1
1262 1 79 PHE QE 1 93 ALA MB . . 4.380 3.940 3.426 4.266 . 0 0 "[ . 1 . 2]" 1
1263 1 79 PHE QE 1 96 ILE HB . . 3.950 2.423 2.078 2.916 . 0 0 "[ . 1 . 2]" 1
1264 1 79 PHE QE 1 96 ILE MG . . 3.710 2.659 2.251 3.049 . 0 0 "[ . 1 . 2]" 1
1265 1 79 PHE QE 1 97 ALA MB . . 4.380 3.861 3.014 4.352 . 0 0 "[ . 1 . 2]" 1
1266 1 79 PHE HZ 1 96 ILE HB . . 4.630 3.497 2.596 4.264 . 0 0 "[ . 1 . 2]" 1
1267 1 79 PHE HZ 1 96 ILE MG . . 3.710 2.655 2.033 3.319 . 0 0 "[ . 1 . 2]" 1
1268 1 79 PHE HZ 1 97 ALA H . . 4.800 3.990 3.117 4.528 . 0 0 "[ . 1 . 2]" 1
1269 1 79 PHE HZ 1 97 ALA HA . . 4.800 3.349 2.177 3.888 . 0 0 "[ . 1 . 2]" 1
1270 1 79 PHE HZ 1 97 ALA MB . . 4.380 3.765 2.930 4.379 . 0 0 "[ . 1 . 2]" 1
1271 1 79 PHE HZ 1 100 LEU MD1 . . 4.800 2.487 2.034 3.012 . 0 0 "[ . 1 . 2]" 1
1272 1 80 LYS QB 1 81 ARG H . . 4.690 3.728 3.494 3.922 . 0 0 "[ . 1 . 2]" 1
1273 1 80 LYS QB 1 82 ILE MD . . 4.380 3.162 2.636 3.580 . 0 0 "[ . 1 . 2]" 1
1274 1 80 LYS QG 1 81 ARG H . . 4.710 2.959 2.427 4.014 . 0 0 "[ . 1 . 2]" 1
1275 1 81 ARG H 1 81 ARG HB2 . . 3.590 2.586 2.207 2.957 . 0 0 "[ . 1 . 2]" 1
1276 1 81 ARG H 1 81 ARG QB . . 3.130 2.272 2.184 2.382 . 0 0 "[ . 1 . 2]" 1
1277 1 81 ARG H 1 81 ARG HB3 . . 3.590 2.614 2.318 3.494 . 0 0 "[ . 1 . 2]" 1
1278 1 81 ARG H 1 81 ARG QG . . 5.070 3.934 3.034 4.089 . 0 0 "[ . 1 . 2]" 1
1279 1 81 ARG H 1 89 PHE HZ . . 4.250 4.042 3.782 4.251 0.001 17 0 "[ . 1 . 2]" 1
1280 1 81 ARG HA 1 81 ARG HG2 . . 4.200 2.859 2.221 3.464 . 0 0 "[ . 1 . 2]" 1
1281 1 81 ARG HA 1 81 ARG QG . . 3.680 2.408 2.180 2.640 . 0 0 "[ . 1 . 2]" 1
1282 1 81 ARG HA 1 81 ARG HG3 . . 4.200 2.777 2.372 3.548 . 0 0 "[ . 1 . 2]" 1
1283 1 81 ARG HA 1 82 ILE H . . 3.380 2.190 2.140 2.334 . 0 0 "[ . 1 . 2]" 1
1284 1 81 ARG HA 1 82 ILE QG . . 4.800 3.880 3.220 4.793 . 0 0 "[ . 1 . 2]" 1
1285 1 81 ARG HA 1 83 SER H . . 4.490 4.325 4.011 4.491 0.001 18 0 "[ . 1 . 2]" 1
1286 1 81 ARG HA 1 89 PHE QD . . 4.920 3.895 3.563 4.275 . 0 0 "[ . 1 . 2]" 1
1287 1 81 ARG HA 1 89 PHE QE . . 5.080 3.349 2.731 3.795 . 0 0 "[ . 1 . 2]" 1
1288 1 81 ARG QB 1 89 PHE QB . . 4.720 3.904 3.173 4.535 . 0 0 "[ . 1 . 2]" 1
1289 1 81 ARG QB 1 89 PHE QE . . 4.600 3.063 2.573 4.174 . 0 0 "[ . 1 . 2]" 1
1290 1 81 ARG QB 1 89 PHE HZ . . 5.170 3.454 2.770 4.574 . 0 0 "[ . 1 . 2]" 1
1291 1 81 ARG HB2 1 89 PHE QD . . 5.140 3.517 2.891 5.138 . 0 0 "[ . 1 . 2]" 1
1292 1 81 ARG HB3 1 89 PHE QD . . 5.140 4.594 4.019 5.048 . 0 0 "[ . 1 . 2]" 1
1293 1 81 ARG QD 1 86 SER QB . . 5.180 4.356 3.630 5.180 . 0 0 "[ . 1 . 2]" 1
1294 1 81 ARG QD 1 89 PHE HA . . 5.340 4.799 3.930 5.278 . 0 0 "[ . 1 . 2]" 1
1295 1 81 ARG QD 1 89 PHE QB . . 4.290 2.551 1.784 3.125 . 0 0 "[ . 1 . 2]" 1
1296 1 81 ARG QD 1 89 PHE QD . . 4.380 2.925 2.060 4.165 . 0 0 "[ . 1 . 2]" 1
1297 1 81 ARG QG 1 82 ILE H . . 4.410 2.948 2.086 3.745 . 0 0 "[ . 1 . 2]" 1
1298 1 81 ARG QG 1 89 PHE QB . . 4.530 2.630 2.263 3.189 . 0 0 "[ . 1 . 2]" 1
1299 1 82 ILE H 1 82 ILE HB . . 3.950 2.566 2.292 2.869 . 0 0 "[ . 1 . 2]" 1
1300 1 82 ILE H 1 82 ILE MD . . 4.800 3.290 2.247 3.778 . 0 0 "[ . 1 . 2]" 1
1301 1 82 ILE H 1 82 ILE QG . . 4.000 2.634 2.057 3.613 . 0 0 "[ . 1 . 2]" 1
1302 1 82 ILE H 1 82 ILE MG . . 4.490 3.802 3.675 3.944 . 0 0 "[ . 1 . 2]" 1
1303 1 82 ILE H 1 83 SER H . . 3.330 2.474 2.091 2.805 . 0 0 "[ . 1 . 2]" 1
1304 1 82 ILE HA 1 82 ILE MD . . 3.330 2.242 1.918 3.332 0.002 14 0 "[ . 1 . 2]" 1
1305 1 82 ILE HA 1 82 ILE QG . . 3.810 2.834 2.153 3.094 . 0 0 "[ . 1 . 2]" 1
1306 1 82 ILE HA 1 82 ILE MG . . 3.410 2.346 2.173 2.561 . 0 0 "[ . 1 . 2]" 1
1307 1 82 ILE HB 1 83 SER H . . 3.720 2.214 1.989 2.478 . 0 0 "[ . 1 . 2]" 1
1308 1 82 ILE HB 1 83 SER QB . . 4.690 3.747 3.297 4.208 . 0 0 "[ . 1 . 2]" 1
1309 1 82 ILE MD 1 82 ILE MG . . 3.100 2.211 1.898 3.145 0.045 16 0 "[ . 1 . 2]" 1
1310 1 82 ILE QG 1 82 ILE MG . . 3.230 2.223 2.012 2.378 . 0 0 "[ . 1 . 2]" 1
1311 1 82 ILE QG 1 83 SER H . . 4.430 3.862 3.606 4.266 . 0 0 "[ . 1 . 2]" 1
1312 1 82 ILE MG 1 83 SER H . . 3.950 3.072 2.501 3.543 . 0 0 "[ . 1 . 2]" 1
1313 1 82 ILE MG 1 83 SER HB2 . . 4.490 3.530 2.429 4.446 . 0 0 "[ . 1 . 2]" 1
1314 1 82 ILE MG 1 83 SER QB . . 3.670 3.128 2.386 3.676 0.006 17 0 "[ . 1 . 2]" 1
1315 1 82 ILE MG 1 83 SER HB3 . . 4.490 3.986 2.852 4.511 0.021 17 0 "[ . 1 . 2]" 1
1316 1 83 SER HA 1 84 GLY H . . 3.110 2.532 2.340 2.629 . 0 0 "[ . 1 . 2]" 1
1317 1 83 SER QB 1 84 GLY H . . 3.360 2.477 1.987 3.185 . 0 0 "[ . 1 . 2]" 1
1318 1 83 SER QB 1 84 GLY QA . . 4.270 3.653 3.434 4.293 0.023 17 0 "[ . 1 . 2]" 1
1319 1 83 SER HB2 1 84 GLY H . . 4.000 3.292 2.051 3.878 . 0 0 "[ . 1 . 2]" 1
1320 1 83 SER HB3 1 84 GLY H . . 4.000 2.835 2.006 3.973 . 0 0 "[ . 1 . 2]" 1
1321 1 84 GLY H 1 85 THR H . . 4.550 4.140 2.049 4.500 . 0 0 "[ . 1 . 2]" 1
1322 1 84 GLY QA 1 85 THR H . . 3.040 2.232 2.119 2.903 . 0 0 "[ . 1 . 2]" 1
1323 1 84 GLY QA 1 85 THR MG . . 4.560 3.800 3.443 4.579 0.019 17 0 "[ . 1 . 2]" 1
1324 1 84 GLY HA2 1 85 THR H . . 3.500 2.349 2.154 3.369 . 0 0 "[ . 1 . 2]" 1
1325 1 84 GLY HA3 1 85 THR H . . 3.500 2.912 2.591 3.169 . 0 0 "[ . 1 . 2]" 1
1326 1 85 THR H 1 85 THR MG . . 3.050 2.225 1.880 2.550 . 0 0 "[ . 1 . 2]" 1
1327 1 85 THR H 1 88 ALA MB . . 4.000 3.111 2.279 4.012 0.012 17 0 "[ . 1 . 2]" 1
1328 1 85 THR HA 1 85 THR MG . . 3.300 3.190 3.170 3.206 . 0 0 "[ . 1 . 2]" 1
1329 1 85 THR HA 1 86 SER H . . 3.280 2.447 2.222 2.633 . 0 0 "[ . 1 . 2]" 1
1330 1 85 THR HA 1 87 ILE H . . 4.920 4.659 4.250 4.896 . 0 0 "[ . 1 . 2]" 1
1331 1 85 THR MG 1 86 SER H . . 4.180 3.141 2.658 3.821 . 0 0 "[ . 1 . 2]" 1
1332 1 85 THR MG 1 86 SER QB . . 4.470 4.309 3.609 4.485 0.015 17 0 "[ . 1 . 2]" 1
1333 1 85 THR MG 1 87 ILE H . . 3.790 2.446 1.951 3.394 . 0 0 "[ . 1 . 2]" 1
1334 1 85 THR MG 1 87 ILE MD . . 4.930 3.091 2.147 4.234 . 0 0 "[ . 1 . 2]" 1
1335 1 85 THR MG 1 88 ALA H . . 4.930 1.900 1.796 2.075 . 0 0 "[ . 1 . 2]" 1
1336 1 85 THR MG 1 88 ALA HA . . 5.050 3.993 3.654 4.341 . 0 0 "[ . 1 . 2]" 1
1337 1 86 SER H 1 86 SER HB2 . . 4.050 3.065 2.355 3.617 . 0 0 "[ . 1 . 2]" 1
1338 1 86 SER H 1 86 SER QB . . 3.470 2.556 2.260 2.938 . 0 0 "[ . 1 . 2]" 1
1339 1 86 SER H 1 86 SER HB3 . . 4.050 3.070 2.494 3.624 . 0 0 "[ . 1 . 2]" 1
1340 1 86 SER H 1 87 ILE H . . 3.860 2.821 2.337 3.293 . 0 0 "[ . 1 . 2]" 1
1341 1 86 SER QB 1 87 ILE H . . 3.660 2.761 2.126 3.184 . 0 0 "[ . 1 . 2]" 1
1342 1 86 SER QB 1 87 ILE HB . . 5.250 5.003 4.486 5.252 0.002 4 0 "[ . 1 . 2]" 1
1343 1 86 SER QB 1 89 PHE QB . . 4.080 3.980 3.810 4.108 0.028 15 0 "[ . 1 . 2]" 1
1344 1 86 SER QB 1 89 PHE QD . . 4.530 4.206 3.736 4.528 . 0 0 "[ . 1 . 2]" 1
1345 1 86 SER HB2 1 87 ILE H . . 4.430 2.975 2.156 4.057 . 0 0 "[ . 1 . 2]" 1
1346 1 86 SER HB3 1 87 ILE H . . 4.430 3.610 2.452 4.089 . 0 0 "[ . 1 . 2]" 1
1347 1 87 ILE H 1 87 ILE HB . . 3.260 2.529 2.349 2.696 . 0 0 "[ . 1 . 2]" 1
1348 1 87 ILE H 1 87 ILE MD . . 3.660 3.038 1.875 3.650 . 0 0 "[ . 1 . 2]" 1
1349 1 87 ILE H 1 87 ILE HG12 . . 4.250 3.507 1.986 3.888 . 0 0 "[ . 1 . 2]" 1
1350 1 87 ILE H 1 87 ILE QG . . 3.640 2.353 1.941 3.168 . 0 0 "[ . 1 . 2]" 1
1351 1 87 ILE H 1 87 ILE HG13 . . 4.250 2.478 1.976 3.549 . 0 0 "[ . 1 . 2]" 1
1352 1 87 ILE HA 1 87 ILE MD . . 4.050 3.552 1.998 3.856 . 0 0 "[ . 1 . 2]" 1
1353 1 87 ILE HA 1 87 ILE HG12 . . 3.740 2.834 2.461 3.539 . 0 0 "[ . 1 . 2]" 1
1354 1 87 ILE HA 1 87 ILE HG13 . . 3.740 2.714 2.212 3.698 . 0 0 "[ . 1 . 2]" 1
1355 1 87 ILE HA 1 87 ILE MG . . 3.450 2.456 2.370 2.536 . 0 0 "[ . 1 . 2]" 1
1356 1 87 ILE HA 1 90 LYS H . . 4.340 3.946 3.359 4.334 . 0 0 "[ . 1 . 2]" 1
1357 1 87 ILE HA 1 90 LYS HB2 . . 4.640 4.038 2.626 4.615 . 0 0 "[ . 1 . 2]" 1
1358 1 87 ILE HA 1 90 LYS QB . . 3.820 3.297 2.597 3.842 0.022 14 0 "[ . 1 . 2]" 1
1359 1 87 ILE HA 1 90 LYS HB3 . . 4.640 3.737 2.809 4.610 . 0 0 "[ . 1 . 2]" 1
1360 1 87 ILE HA 1 90 LYS QE . . 4.490 3.694 2.050 4.522 0.032 15 0 "[ . 1 . 2]" 1
1361 1 87 ILE HA 1 91 ASN H . . 4.630 4.254 3.935 4.592 . 0 0 "[ . 1 . 2]" 1
1362 1 87 ILE HB 1 88 ALA H . . 3.830 2.308 2.067 2.798 . 0 0 "[ . 1 . 2]" 1
1363 1 87 ILE HG12 1 87 ILE MG . . 3.590 2.336 2.038 3.193 . 0 0 "[ . 1 . 2]" 1
1364 1 87 ILE HG13 1 87 ILE MG . . 3.590 3.004 2.302 3.201 . 0 0 "[ . 1 . 2]" 1
1365 1 87 ILE MG 1 88 ALA H . . 3.330 2.900 2.406 3.316 . 0 0 "[ . 1 . 2]" 1
1366 1 87 ILE MG 1 88 ALA HA . . 4.060 3.120 2.822 3.474 . 0 0 "[ . 1 . 2]" 1
1367 1 87 ILE MG 1 88 ALA MB . . 4.280 3.594 3.259 3.907 . 0 0 "[ . 1 . 2]" 1
1368 1 87 ILE MG 1 90 LYS QE . . 5.210 4.609 3.561 5.207 . 0 0 "[ . 1 . 2]" 1
1369 1 87 ILE MG 1 91 ASN QB . . 4.910 3.754 2.955 4.553 . 0 0 "[ . 1 . 2]" 1
1370 1 87 ILE MG 1 91 ASN HD21 . . 4.380 3.276 2.091 4.202 . 0 0 "[ . 1 . 2]" 1
1371 1 87 ILE MG 1 91 ASN QD . . 3.770 2.757 1.756 3.322 . 0 0 "[ . 1 . 2]" 1
1372 1 87 ILE MG 1 91 ASN HD22 . . 4.380 3.303 1.887 4.352 . 0 0 "[ . 1 . 2]" 1
1373 1 88 ALA H 1 88 ALA MB . . 3.190 2.172 2.026 2.310 . 0 0 "[ . 1 . 2]" 1
1374 1 88 ALA H 1 89 PHE H . . 3.540 2.742 2.338 2.975 . 0 0 "[ . 1 . 2]" 1
1375 1 88 ALA HA 1 91 ASN H . . 4.050 3.514 3.216 3.834 . 0 0 "[ . 1 . 2]" 1
1376 1 88 ALA HA 1 91 ASN HB2 . . 3.950 2.442 2.268 2.708 . 0 0 "[ . 1 . 2]" 1
1377 1 88 ALA HA 1 91 ASN QB . . 3.420 2.394 2.191 2.562 . 0 0 "[ . 1 . 2]" 1
1378 1 88 ALA HA 1 91 ASN HB3 . . 3.950 3.615 2.898 3.962 0.012 15 0 "[ . 1 . 2]" 1
1379 1 88 ALA HA 1 91 ASN QD . . 4.390 2.939 1.917 3.851 . 0 0 "[ . 1 . 2]" 1
1380 1 88 ALA MB 1 89 PHE H . . 3.610 2.552 2.272 3.012 . 0 0 "[ . 1 . 2]" 1
1381 1 88 ALA MB 1 89 PHE QB . . 4.200 3.881 3.724 4.053 . 0 0 "[ . 1 . 2]" 1
1382 1 88 ALA MB 1 91 ASN H . . 5.180 4.577 4.368 4.809 . 0 0 "[ . 1 . 2]" 1
1383 1 88 ALA MB 1 91 ASN QB . . 4.490 3.700 3.489 3.878 . 0 0 "[ . 1 . 2]" 1
1384 1 89 PHE H 1 89 PHE QB . . 3.100 2.239 2.195 2.267 . 0 0 "[ . 1 . 2]" 1
1385 1 89 PHE HA 1 89 PHE QD . . 3.560 2.300 2.107 2.561 . 0 0 "[ . 1 . 2]" 1
1386 1 89 PHE HA 1 92 ILE H . . 4.630 4.080 3.708 4.469 . 0 0 "[ . 1 . 2]" 1
1387 1 89 PHE HA 1 92 ILE MG . . 3.350 2.700 2.393 3.089 . 0 0 "[ . 1 . 2]" 1
1388 1 89 PHE QB 1 90 LYS H . . 3.500 2.365 1.914 2.783 . 0 0 "[ . 1 . 2]" 1
1389 1 89 PHE QD 1 90 LYS H . . 4.110 3.476 2.775 3.970 . 0 0 "[ . 1 . 2]" 1
1390 1 89 PHE QD 1 90 LYS HA . . 4.630 4.079 3.771 4.273 . 0 0 "[ . 1 . 2]" 1
1391 1 89 PHE QD 1 92 ILE MG . . 4.200 3.336 2.897 3.663 . 0 0 "[ . 1 . 2]" 1
1392 1 89 PHE QD 1 93 ALA MB . . 4.550 3.676 3.080 4.278 . 0 0 "[ . 1 . 2]" 1
1393 1 89 PHE QE 1 93 ALA MB . . 4.830 3.492 2.807 4.184 . 0 0 "[ . 1 . 2]" 1
1394 1 89 PHE HZ 1 93 ALA MB . . 5.480 3.983 3.276 4.715 . 0 0 "[ . 1 . 2]" 1
1395 1 90 LYS H 1 90 LYS HB2 . . 3.640 2.450 2.167 3.589 . 0 0 "[ . 1 . 2]" 1
1396 1 90 LYS H 1 90 LYS QB . . 3.110 2.223 2.115 2.509 . 0 0 "[ . 1 . 2]" 1
1397 1 90 LYS H 1 90 LYS HB3 . . 3.640 2.819 2.156 3.536 . 0 0 "[ . 1 . 2]" 1
1398 1 90 LYS H 1 90 LYS HG2 . . 4.550 4.159 2.129 4.535 . 0 0 "[ . 1 . 2]" 1
1399 1 90 LYS H 1 90 LYS HG3 . . 4.550 4.119 2.716 4.566 0.016 7 0 "[ . 1 . 2]" 1
1400 1 90 LYS H 1 91 ASN H . . 3.590 2.667 2.420 2.882 . 0 0 "[ . 1 . 2]" 1
1401 1 90 LYS HA 1 90 LYS QD . . 4.630 3.718 3.083 4.416 . 0 0 "[ . 1 . 2]" 1
1402 1 90 LYS HA 1 90 LYS HG2 . . 4.120 2.725 2.179 3.783 . 0 0 "[ . 1 . 2]" 1
1403 1 90 LYS HA 1 90 LYS QG . . 3.610 2.387 2.148 3.342 . 0 0 "[ . 1 . 2]" 1
1404 1 90 LYS HA 1 90 LYS HG3 . . 4.120 3.026 2.169 3.720 . 0 0 "[ . 1 . 2]" 1
1405 1 90 LYS HA 1 93 ALA H . . 4.700 3.428 2.926 3.990 . 0 0 "[ . 1 . 2]" 1
1406 1 90 LYS HA 1 93 ALA MB . . 3.770 2.101 1.875 2.381 . 0 0 "[ . 1 . 2]" 1
1407 1 90 LYS HA 1 94 SER H . . 4.630 3.959 3.508 4.423 . 0 0 "[ . 1 . 2]" 1
1408 1 90 LYS QB 1 90 LYS QE . . 4.390 2.211 1.889 3.600 . 0 0 "[ . 1 . 2]" 1
1409 1 90 LYS QB 1 91 ASN H . . 3.410 2.763 2.326 3.390 . 0 0 "[ . 1 . 2]" 1
1410 1 90 LYS QB 1 91 ASN HA . . 4.690 4.017 3.799 4.458 . 0 0 "[ . 1 . 2]" 1
1411 1 90 LYS HB2 1 91 ASN H . . 4.000 3.691 2.954 4.016 0.016 15 0 "[ . 1 . 2]" 1
1412 1 90 LYS HB3 1 91 ASN H . . 4.000 2.973 2.350 3.949 . 0 0 "[ . 1 . 2]" 1
1413 1 90 LYS QE 1 90 LYS HG2 . . 3.900 3.018 2.164 3.464 . 0 0 "[ . 1 . 2]" 1
1414 1 90 LYS QE 1 90 LYS HG3 . . 3.900 2.733 2.221 3.512 . 0 0 "[ . 1 . 2]" 1
1415 1 90 LYS QG 1 91 ASN H . . 5.340 4.006 1.989 4.708 . 0 0 "[ . 1 . 2]" 1
1416 1 91 ASN H 1 91 ASN HB2 . . 3.760 2.259 2.179 2.549 . 0 0 "[ . 1 . 2]" 1
1417 1 91 ASN H 1 91 ASN QB . . 3.090 2.220 2.128 2.498 . 0 0 "[ . 1 . 2]" 1
1418 1 91 ASN H 1 91 ASN HB3 . . 3.760 3.325 2.876 3.608 . 0 0 "[ . 1 . 2]" 1
1419 1 91 ASN H 1 92 ILE H . . 3.750 3.014 2.544 3.355 . 0 0 "[ . 1 . 2]" 1
1420 1 91 ASN HA 1 94 SER HB2 . . 4.800 4.027 3.047 4.786 . 0 0 "[ . 1 . 2]" 1
1421 1 91 ASN HA 1 94 SER QB . . 4.120 3.597 3.010 4.021 . 0 0 "[ . 1 . 2]" 1
1422 1 91 ASN HA 1 94 SER HB3 . . 4.800 4.247 3.265 4.756 . 0 0 "[ . 1 . 2]" 1
1423 1 91 ASN QB 1 92 ILE H . . 3.480 2.248 1.904 2.772 . 0 0 "[ . 1 . 2]" 1
1424 1 91 ASN HB2 1 92 ILE H . . 4.000 2.783 2.226 3.563 . 0 0 "[ . 1 . 2]" 1
1425 1 91 ASN HB2 1 92 ILE HB . . 5.500 4.818 4.002 5.500 . 0 0 "[ . 1 . 2]" 1
1426 1 91 ASN HB3 1 92 ILE H . . 4.000 2.621 1.916 3.498 . 0 0 "[ . 1 . 2]" 1
1427 1 91 ASN HB3 1 92 ILE HB . . 5.500 4.179 3.655 4.777 . 0 0 "[ . 1 . 2]" 1
1428 1 92 ILE H 1 92 ILE HB . . 3.480 2.658 2.520 2.991 . 0 0 "[ . 1 . 2]" 1
1429 1 92 ILE H 1 92 ILE MD . . 4.800 4.123 3.984 4.243 . 0 0 "[ . 1 . 2]" 1
1430 1 92 ILE H 1 92 ILE MG . . 3.250 2.020 1.895 2.252 . 0 0 "[ . 1 . 2]" 1
1431 1 92 ILE H 1 93 ALA H . . 3.280 2.562 2.204 2.922 . 0 0 "[ . 1 . 2]" 1
1432 1 92 ILE H 1 93 ALA MB . . 4.550 4.168 3.832 4.467 . 0 0 "[ . 1 . 2]" 1
1433 1 92 ILE HA 1 92 ILE MD . . 3.090 2.039 1.910 2.380 . 0 0 "[ . 1 . 2]" 1
1434 1 92 ILE HA 1 95 LYS H . . 4.200 3.374 3.073 3.650 . 0 0 "[ . 1 . 2]" 1
1435 1 92 ILE HA 1 95 LYS QB . . 3.560 3.096 2.555 3.474 . 0 0 "[ . 1 . 2]" 1
1436 1 92 ILE HB 1 92 ILE MD . . 3.170 2.411 2.212 2.536 . 0 0 "[ . 1 . 2]" 1
1437 1 92 ILE HB 1 93 ALA H . . 4.630 4.017 3.810 4.280 . 0 0 "[ . 1 . 2]" 1
1438 1 92 ILE MD 1 95 LYS QB . . 3.670 2.184 1.820 2.927 . 0 0 "[ . 1 . 2]" 1
1439 1 92 ILE MD 1 95 LYS QD . . 4.490 3.822 2.271 4.321 . 0 0 "[ . 1 . 2]" 1
1440 1 92 ILE MD 1 95 LYS QG . . 4.280 2.425 1.995 2.934 . 0 0 "[ . 1 . 2]" 1
1441 1 92 ILE MD 1 96 ILE H . . 4.690 3.916 3.079 4.294 . 0 0 "[ . 1 . 2]" 1
1442 1 92 ILE MD 1 96 ILE MD . . 3.640 2.802 2.232 3.245 . 0 0 "[ . 1 . 2]" 1
1443 1 92 ILE MD 1 96 ILE QG . . 4.490 3.168 2.521 3.601 . 0 0 "[ . 1 . 2]" 1
1444 1 92 ILE QG 1 92 ILE MG . . 3.160 2.095 2.043 2.117 . 0 0 "[ . 1 . 2]" 1
1445 1 92 ILE QG 1 96 ILE QG . . 4.360 2.767 2.199 3.364 . 0 0 "[ . 1 . 2]" 1
1446 1 92 ILE MG 1 93 ALA H . . 3.300 2.065 1.802 2.587 . 0 0 "[ . 1 . 2]" 1
1447 1 92 ILE MG 1 93 ALA HA . . 4.200 3.271 2.995 3.561 . 0 0 "[ . 1 . 2]" 1
1448 1 92 ILE MG 1 93 ALA MB . . 4.060 3.100 2.955 3.234 . 0 0 "[ . 1 . 2]" 1
1449 1 93 ALA H 1 93 ALA MB . . 3.220 2.155 2.033 2.256 . 0 0 "[ . 1 . 2]" 1
1450 1 93 ALA H 1 94 SER H . . 3.590 2.751 2.435 3.081 . 0 0 "[ . 1 . 2]" 1
1451 1 93 ALA HA 1 95 LYS H . . 4.800 3.998 3.543 4.692 . 0 0 "[ . 1 . 2]" 1
1452 1 93 ALA HA 1 96 ILE H . . 4.380 3.493 3.082 4.025 . 0 0 "[ . 1 . 2]" 1
1453 1 93 ALA HA 1 96 ILE HB . . 3.810 3.388 3.120 3.564 . 0 0 "[ . 1 . 2]" 1
1454 1 93 ALA HA 1 96 ILE MD . . 4.810 4.642 4.217 4.808 . 0 0 "[ . 1 . 2]" 1
1455 1 93 ALA HA 1 96 ILE QG . . 4.200 3.018 2.561 3.157 . 0 0 "[ . 1 . 2]" 1
1456 1 93 ALA HA 1 96 ILE MG . . 4.800 4.689 4.401 4.800 . 0 0 "[ . 1 . 2]" 1
1457 1 93 ALA HA 1 97 ALA H . . 4.550 3.998 3.587 4.476 . 0 0 "[ . 1 . 2]" 1
1458 1 93 ALA MB 1 94 SER H . . 3.660 2.640 2.362 2.856 . 0 0 "[ . 1 . 2]" 1
1459 1 94 SER H 1 94 SER HB2 . . 3.810 2.418 2.203 3.508 . 0 0 "[ . 1 . 2]" 1
1460 1 94 SER H 1 94 SER HB3 . . 3.810 2.825 2.204 3.552 . 0 0 "[ . 1 . 2]" 1
1461 1 94 SER H 1 95 LYS H . . 3.590 2.613 2.371 2.812 . 0 0 "[ . 1 . 2]" 1
1462 1 94 SER H 1 95 LYS QB . . 4.980 4.676 4.188 4.952 . 0 0 "[ . 1 . 2]" 1
1463 1 94 SER HA 1 97 ALA H . . 4.490 3.912 3.431 4.445 . 0 0 "[ . 1 . 2]" 1
1464 1 94 SER HA 1 97 ALA MB . . 3.770 2.863 2.566 3.190 . 0 0 "[ . 1 . 2]" 1
1465 1 94 SER HB2 1 95 LYS H . . 4.380 3.817 3.110 4.357 . 0 0 "[ . 1 . 2]" 1
1466 1 94 SER HB3 1 95 LYS H . . 4.380 3.104 2.384 3.968 . 0 0 "[ . 1 . 2]" 1
1467 1 95 LYS H 1 95 LYS QB . . 3.090 2.458 2.179 2.566 . 0 0 "[ . 1 . 2]" 1
1468 1 95 LYS H 1 95 LYS QD . . 4.670 3.748 2.121 4.244 . 0 0 "[ . 1 . 2]" 1
1469 1 95 LYS H 1 95 LYS QG . . 4.430 2.353 1.919 4.062 . 0 0 "[ . 1 . 2]" 1
1470 1 95 LYS H 1 96 ILE H . . 3.640 2.559 2.217 3.040 . 0 0 "[ . 1 . 2]" 1
1471 1 95 LYS HA 1 95 LYS QD . . 4.090 2.385 2.037 3.803 . 0 0 "[ . 1 . 2]" 1
1472 1 95 LYS HA 1 95 LYS QG . . 3.360 2.766 2.375 2.953 . 0 0 "[ . 1 . 2]" 1
1473 1 95 LYS HA 1 98 ASN H . . 4.550 4.064 3.775 4.369 . 0 0 "[ . 1 . 2]" 1
1474 1 95 LYS HA 1 98 ASN QB . . 3.650 3.215 2.839 3.413 . 0 0 "[ . 1 . 2]" 1
1475 1 95 LYS QB 1 95 LYS QD . . 3.480 2.271 2.018 2.583 . 0 0 "[ . 1 . 2]" 1
1476 1 95 LYS QB 1 96 ILE H . . 3.500 2.591 2.015 2.941 . 0 0 "[ . 1 . 2]" 1
1477 1 95 LYS QB 1 96 ILE MD . . 4.310 2.928 2.014 3.582 . 0 0 "[ . 1 . 2]" 1
1478 1 95 LYS QE 1 95 LYS QG . . 3.220 2.258 2.053 2.537 . 0 0 "[ . 1 . 2]" 1
1479 1 95 LYS HE2 1 95 LYS QG . . 3.740 2.731 2.138 3.387 . 0 0 "[ . 1 . 2]" 1
1480 1 95 LYS HE3 1 95 LYS QG . . 3.740 2.716 2.150 3.457 . 0 0 "[ . 1 . 2]" 1
1481 1 95 LYS QG 1 96 ILE H . . 4.550 3.996 3.675 4.536 . 0 0 "[ . 1 . 2]" 1
1482 1 96 ILE H 1 96 ILE HB . . 3.350 2.650 2.517 2.775 . 0 0 "[ . 1 . 2]" 1
1483 1 96 ILE H 1 96 ILE MD . . 4.200 3.002 2.233 3.556 . 0 0 "[ . 1 . 2]" 1
1484 1 96 ILE H 1 96 ILE QG . . 3.390 2.065 1.900 2.413 . 0 0 "[ . 1 . 2]" 1
1485 1 96 ILE H 1 96 ILE MG . . 4.110 3.779 3.749 3.810 . 0 0 "[ . 1 . 2]" 1
1486 1 96 ILE H 1 97 ALA H . . 3.750 2.725 2.462 3.082 . 0 0 "[ . 1 . 2]" 1
1487 1 96 ILE HA 1 96 ILE MD . . 3.520 2.107 1.941 2.342 . 0 0 "[ . 1 . 2]" 1
1488 1 96 ILE HA 1 96 ILE MG . . 3.400 2.285 2.153 2.446 . 0 0 "[ . 1 . 2]" 1
1489 1 96 ILE HA 1 97 ALA MB . . 5.100 5.020 4.994 5.041 . 0 0 "[ . 1 . 2]" 1
1490 1 96 ILE HA 1 99 GLU H . . 4.380 3.875 3.575 4.144 . 0 0 "[ . 1 . 2]" 1
1491 1 96 ILE HA 1 99 GLU HB2 . . 4.800 2.662 2.277 3.046 . 0 0 "[ . 1 . 2]" 1
1492 1 96 ILE HA 1 99 GLU QB . . 4.200 2.633 2.258 3.005 . 0 0 "[ . 1 . 2]" 1
1493 1 96 ILE HA 1 99 GLU HB3 . . 4.800 4.171 3.737 4.592 . 0 0 "[ . 1 . 2]" 1
1494 1 96 ILE HA 1 100 LEU MD1 . . 5.170 4.380 3.968 4.796 . 0 0 "[ . 1 . 2]" 1
1495 1 96 ILE HB 1 96 ILE MD . . 3.620 3.210 3.181 3.222 . 0 0 "[ . 1 . 2]" 1
1496 1 96 ILE HB 1 97 ALA H . . 3.640 2.172 2.004 2.413 . 0 0 "[ . 1 . 2]" 1
1497 1 96 ILE MD 1 97 ALA H . . 4.800 4.468 4.188 4.634 . 0 0 "[ . 1 . 2]" 1
1498 1 96 ILE MG 1 97 ALA H . . 4.120 3.291 2.983 3.584 . 0 0 "[ . 1 . 2]" 1
1499 1 96 ILE MG 1 97 ALA HA . . 4.380 3.580 3.257 3.782 . 0 0 "[ . 1 . 2]" 1
1500 1 96 ILE MG 1 100 LEU HB3 . . 4.920 4.711 4.456 4.907 . 0 0 "[ . 1 . 2]" 1
1501 1 96 ILE MG 1 100 LEU MD2 . . 4.060 2.911 2.500 3.388 . 0 0 "[ . 1 . 2]" 1
1502 1 96 ILE MG 1 100 LEU HG . . 4.000 2.232 1.966 2.486 . 0 0 "[ . 1 . 2]" 1
1503 1 97 ALA H 1 97 ALA MB . . 3.350 2.152 2.031 2.239 . 0 0 "[ . 1 . 2]" 1
1504 1 97 ALA H 1 98 ASN H . . 3.750 2.931 2.683 3.211 . 0 0 "[ . 1 . 2]" 1
1505 1 97 ALA H 1 100 LEU MD1 . . 4.960 3.989 3.478 4.473 . 0 0 "[ . 1 . 2]" 1
1506 1 97 ALA HA 1 100 LEU H . . 4.550 4.285 3.892 4.542 . 0 0 "[ . 1 . 2]" 1
1507 1 97 ALA HA 1 100 LEU HB2 . . 4.280 3.268 2.855 3.605 . 0 0 "[ . 1 . 2]" 1
1508 1 97 ALA HA 1 100 LEU MD1 . . 3.560 2.445 2.038 2.910 . 0 0 "[ . 1 . 2]" 1
1509 1 97 ALA HA 1 100 LEU HG . . 4.200 3.777 3.043 4.148 . 0 0 "[ . 1 . 2]" 1
1510 1 97 ALA MB 1 98 ASN H . . 3.720 2.614 2.250 3.006 . 0 0 "[ . 1 . 2]" 1
1511 1 97 ALA MB 1 100 LEU MD1 . . 4.630 3.758 3.367 4.099 . 0 0 "[ . 1 . 2]" 1
1512 1 98 ASN H 1 98 ASN HB2 . . 3.560 2.512 2.192 2.916 . 0 0 "[ . 1 . 2]" 1
1513 1 98 ASN H 1 98 ASN QB . . 3.060 2.253 2.170 2.346 . 0 0 "[ . 1 . 2]" 1
1514 1 98 ASN H 1 98 ASN HB3 . . 3.560 2.784 2.264 3.547 . 0 0 "[ . 1 . 2]" 1
1515 1 98 ASN H 1 99 GLU H . . 3.540 2.815 2.531 3.131 . 0 0 "[ . 1 . 2]" 1
1516 1 98 ASN HA 1 100 LEU H . . 4.870 4.420 3.885 4.774 . 0 0 "[ . 1 . 2]" 1
1517 1 98 ASN QB 1 99 GLU H . . 3.900 2.092 1.889 2.305 . 0 0 "[ . 1 . 2]" 1
1518 1 98 ASN HB2 1 99 GLU H . . 4.430 3.245 2.179 3.754 . 0 0 "[ . 1 . 2]" 1
1519 1 98 ASN HB3 1 99 GLU H . . 4.430 2.234 1.900 2.981 . 0 0 "[ . 1 . 2]" 1
1520 1 99 GLU H 1 99 GLU HB2 . . 3.860 2.423 2.259 2.598 . 0 0 "[ . 1 . 2]" 1
1521 1 99 GLU H 1 99 GLU QB . . 3.370 2.386 2.235 2.542 . 0 0 "[ . 1 . 2]" 1
1522 1 99 GLU H 1 99 GLU HB3 . . 3.860 3.594 3.536 3.622 . 0 0 "[ . 1 . 2]" 1
1523 1 99 GLU H 1 99 GLU HG2 . . 4.110 2.674 2.146 4.023 . 0 0 "[ . 1 . 2]" 1
1524 1 99 GLU H 1 99 GLU QG . . 3.500 2.454 2.131 3.268 . 0 0 "[ . 1 . 2]" 1
1525 1 99 GLU H 1 99 GLU HG3 . . 4.110 3.519 2.422 4.001 . 0 0 "[ . 1 . 2]" 1
1526 1 99 GLU H 1 100 LEU H . . 3.280 3.027 2.923 3.134 . 0 0 "[ . 1 . 2]" 1
1527 1 99 GLU HA 1 99 GLU HG2 . . 3.710 2.772 2.158 3.533 . 0 0 "[ . 1 . 2]" 1
1528 1 99 GLU HA 1 99 GLU QG . . 3.120 2.618 2.122 2.950 . 0 0 "[ . 1 . 2]" 1
1529 1 99 GLU HA 1 99 GLU HG3 . . 3.710 3.482 2.232 3.712 0.002 18 0 "[ . 1 . 2]" 1
1530 1 100 LEU H 1 100 LEU HB2 . . 3.320 2.391 2.226 2.626 . 0 0 "[ . 1 . 2]" 1
1531 1 100 LEU H 1 100 LEU HB3 . . 3.790 3.581 3.519 3.619 . 0 0 "[ . 1 . 2]" 1
1532 1 100 LEU H 1 100 LEU MD1 . . 4.280 3.714 3.417 3.921 . 0 0 "[ . 1 . 2]" 1
1533 1 100 LEU H 1 100 LEU MD2 . . 4.000 3.513 3.182 3.750 . 0 0 "[ . 1 . 2]" 1
1534 1 100 LEU H 1 100 LEU HG . . 3.460 2.523 2.089 2.789 . 0 0 "[ . 1 . 2]" 1
1535 1 100 LEU HA 1 100 LEU MD1 . . 4.280 3.818 3.741 3.897 . 0 0 "[ . 1 . 2]" 1
1536 1 100 LEU HA 1 100 LEU MD2 . . 3.400 2.068 1.928 2.390 . 0 0 "[ . 1 . 2]" 1
1537 1 100 LEU HA 1 100 LEU HG . . 4.070 2.913 2.739 3.110 . 0 0 "[ . 1 . 2]" 1
1538 1 100 LEU HA 1 101 LYS H . . 3.160 2.176 2.139 2.244 . 0 0 "[ . 1 . 2]" 1
1539 1 100 LEU HA 1 101 LYS HA . . 4.630 4.431 4.387 4.475 . 0 0 "[ . 1 . 2]" 1
1540 1 100 LEU HA 1 101 LYS QB . . 4.520 4.239 4.083 4.494 . 0 0 "[ . 1 . 2]" 1
1541 1 100 LEU HB2 1 100 LEU MD1 . . 3.500 2.310 2.172 2.454 . 0 0 "[ . 1 . 2]" 1
1542 1 100 LEU HB2 1 102 LEU HG . . 4.460 4.216 3.895 4.458 . 0 0 "[ . 1 . 2]" 1
1543 1 100 LEU HB3 1 100 LEU MD2 . . 3.670 2.315 2.123 2.443 . 0 0 "[ . 1 . 2]" 1
1544 1 100 LEU HB3 1 101 LYS H . . 4.800 3.770 3.382 3.982 . 0 0 "[ . 1 . 2]" 1
1545 1 100 LEU HB3 1 102 LEU H . . 4.880 3.353 2.709 4.117 . 0 0 "[ . 1 . 2]" 1
1546 1 100 LEU HB3 1 102 LEU MD1 . . 3.570 2.246 1.939 2.820 . 0 0 "[ . 1 . 2]" 1
1547 1 100 LEU HB3 1 102 LEU MD2 . . 4.190 3.960 3.642 4.188 . 0 0 "[ . 1 . 2]" 1
1548 1 100 LEU HB3 1 102 LEU HG . . 4.060 2.546 2.161 2.850 . 0 0 "[ . 1 . 2]" 1
1549 1 100 LEU MD2 1 101 LYS H . . 4.280 3.485 3.192 3.814 . 0 0 "[ . 1 . 2]" 1
1550 1 100 LEU MD2 1 102 LEU HG . . 4.500 2.961 2.444 3.697 . 0 0 "[ . 1 . 2]" 1
1551 1 101 LYS H 1 101 LYS HB2 . . 4.000 2.345 2.181 2.657 . 0 0 "[ . 1 . 2]" 1
1552 1 101 LYS H 1 101 LYS HB3 . . 4.000 3.302 2.421 3.668 . 0 0 "[ . 1 . 2]" 1
1553 1 101 LYS H 1 101 LYS QD . . 5.040 4.256 3.710 4.777 . 0 0 "[ . 1 . 2]" 1
1554 1 101 LYS H 1 101 LYS HG2 . . 4.770 3.755 2.256 4.685 . 0 0 "[ . 1 . 2]" 1
1555 1 101 LYS H 1 101 LYS QG . . 4.110 3.176 2.232 4.082 . 0 0 "[ . 1 . 2]" 1
1556 1 101 LYS H 1 101 LYS HG3 . . 4.770 3.686 2.637 4.569 . 0 0 "[ . 1 . 2]" 1
1557 1 101 LYS HA 1 101 LYS QD . . 4.060 3.123 2.004 4.058 . 0 0 "[ . 1 . 2]" 1
1558 1 101 LYS HA 1 101 LYS QG . . 3.700 2.460 2.152 2.880 . 0 0 "[ . 1 . 2]" 1
1559 1 101 LYS HA 1 102 LEU H . . 3.350 2.552 2.290 2.970 . 0 0 "[ . 1 . 2]" 1
1560 1 101 LYS QG 1 102 LEU H . . 5.340 4.421 3.695 4.841 . 0 0 "[ . 1 . 2]" 1
1561 1 102 LEU H 1 102 LEU QB . . 3.440 2.637 2.418 2.892 . 0 0 "[ . 1 . 2]" 1
1562 1 102 LEU H 1 102 LEU MD1 . . 4.380 3.573 3.312 3.905 . 0 0 "[ . 1 . 2]" 1
1563 1 102 LEU H 1 102 LEU MD2 . . 4.340 3.739 3.283 4.018 . 0 0 "[ . 1 . 2]" 1
1564 1 102 LEU H 1 102 LEU HG . . 3.860 2.522 1.973 3.014 . 0 0 "[ . 1 . 2]" 1
1565 1 102 LEU HA 1 102 LEU MD1 . . 4.380 3.973 3.919 4.035 . 0 0 "[ . 1 . 2]" 1
1566 1 102 LEU HA 1 102 LEU MD2 . . 3.200 2.392 2.189 2.646 . 0 0 "[ . 1 . 2]" 1
1567 1 102 LEU QB 1 102 LEU MD1 . . 3.070 2.065 1.961 2.100 . 0 0 "[ . 1 . 2]" 1
1568 1 102 LEU QB 1 102 LEU MD2 . . 3.220 2.163 2.039 2.270 . 0 0 "[ . 1 . 2]" 1
1569 1 102 LEU HB2 1 102 LEU MD1 . . 3.660 2.193 2.018 2.287 . 0 0 "[ . 1 . 2]" 1
1570 1 102 LEU HB3 1 102 LEU MD1 . . 3.660 2.543 2.437 2.664 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Tuesday, July 2, 2024 4:39:22 PM GMT (wattos1)