NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
416700 |
2dkm   |
10262 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2dkm
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 1578
_Distance_constraint_stats_list.Viol_count 607
_Distance_constraint_stats_list.Viol_total 173.124
_Distance_constraint_stats_list.Viol_max 0.122
_Distance_constraint_stats_list.Viol_rms 0.0035
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0003
_Distance_constraint_stats_list.Viol_average_violations_only 0.0143
_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 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 PRO 0.135 0.107 15 0 "[ . 1 . 2]"
1 9 LEU 0.787 0.107 15 0 "[ . 1 . 2]"
1 10 PRO 0.426 0.101 18 0 "[ . 1 . 2]"
1 11 PRO 0.209 0.069 19 0 "[ . 1 . 2]"
1 12 PRO 0.893 0.092 3 0 "[ . 1 . 2]"
1 13 ARG 1.702 0.108 19 0 "[ . 1 . 2]"
1 14 ALA 0.799 0.108 19 0 "[ . 1 . 2]"
1 15 LEU 0.310 0.034 11 0 "[ . 1 . 2]"
1 16 THR 0.277 0.034 11 0 "[ . 1 . 2]"
1 17 LEU 0.143 0.025 5 0 "[ . 1 . 2]"
1 18 ALA 0.038 0.011 15 0 "[ . 1 . 2]"
1 19 ALA 0.065 0.017 10 0 "[ . 1 . 2]"
1 20 VAL 0.180 0.030 18 0 "[ . 1 . 2]"
1 21 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 PRO 0.049 0.015 14 0 "[ . 1 . 2]"
1 23 ARG 0.159 0.057 3 0 "[ . 1 . 2]"
1 24 THR 0.011 0.007 5 0 "[ . 1 . 2]"
1 25 VAL 0.076 0.017 17 0 "[ . 1 . 2]"
1 26 HIS 0.093 0.030 18 0 "[ . 1 . 2]"
1 27 LEU 0.037 0.008 19 0 "[ . 1 . 2]"
1 28 THR 0.037 0.012 11 0 "[ . 1 . 2]"
1 29 TRP 0.185 0.031 19 0 "[ . 1 . 2]"
1 30 GLN 0.089 0.026 19 0 "[ . 1 . 2]"
1 31 PRO 0.009 0.009 5 0 "[ . 1 . 2]"
1 32 SER 0.026 0.010 5 0 "[ . 1 . 2]"
1 33 ALA 0.010 0.010 19 0 "[ . 1 . 2]"
1 34 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 ALA 0.027 0.010 18 0 "[ . 1 . 2]"
1 36 THR 1.467 0.116 12 0 "[ . 1 . 2]"
1 37 HIS 0.091 0.020 18 0 "[ . 1 . 2]"
1 38 TYR 0.021 0.010 5 0 "[ . 1 . 2]"
1 39 LEU 0.196 0.055 4 0 "[ . 1 . 2]"
1 40 VAL 0.100 0.055 4 0 "[ . 1 . 2]"
1 41 ARG 0.120 0.042 18 0 "[ . 1 . 2]"
1 42 CYS 0.078 0.018 9 0 "[ . 1 . 2]"
1 43 SER 0.040 0.015 11 0 "[ . 1 . 2]"
1 44 PRO 0.015 0.008 19 0 "[ . 1 . 2]"
1 45 ALA 0.013 0.004 7 0 "[ . 1 . 2]"
1 46 SER 0.004 0.004 18 0 "[ . 1 . 2]"
1 47 PRO 0.086 0.021 17 0 "[ . 1 . 2]"
1 48 LYS 0.172 0.052 18 0 "[ . 1 . 2]"
1 49 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 GLU 0.005 0.005 9 0 "[ . 1 . 2]"
1 51 GLU 0.020 0.020 18 0 "[ . 1 . 2]"
1 52 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 ARG 0.107 0.023 14 0 "[ . 1 . 2]"
1 55 GLU 0.632 0.084 20 0 "[ . 1 . 2]"
1 56 VAL 0.449 0.122 20 0 "[ . 1 . 2]"
1 57 GLN 0.291 0.122 20 0 "[ . 1 . 2]"
1 58 VAL 0.059 0.028 18 0 "[ . 1 . 2]"
1 59 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 ARG 0.271 0.045 7 0 "[ . 1 . 2]"
1 61 PRO 0.018 0.006 20 0 "[ . 1 . 2]"
1 62 GLU 0.328 0.045 7 0 "[ . 1 . 2]"
1 63 VAL 0.016 0.005 10 0 "[ . 1 . 2]"
1 64 LEU 0.004 0.002 19 0 "[ . 1 . 2]"
1 65 LEU 0.001 0.001 5 0 "[ . 1 . 2]"
1 66 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 LEU 0.027 0.009 8 0 "[ . 1 . 2]"
1 69 GLU 0.049 0.020 2 0 "[ . 1 . 2]"
1 70 PRO 0.012 0.006 8 0 "[ . 1 . 2]"
1 71 GLY 0.025 0.007 7 0 "[ . 1 . 2]"
1 72 ARG 0.037 0.020 2 0 "[ . 1 . 2]"
1 73 ASP 0.013 0.004 2 0 "[ . 1 . 2]"
1 74 TYR 0.072 0.017 18 0 "[ . 1 . 2]"
1 75 GLU 0.045 0.015 11 0 "[ . 1 . 2]"
1 76 VAL 0.041 0.015 19 0 "[ . 1 . 2]"
1 77 SER 0.114 0.021 11 0 "[ . 1 . 2]"
1 78 VAL 0.057 0.021 11 0 "[ . 1 . 2]"
1 79 GLN 0.098 0.015 17 0 "[ . 1 . 2]"
1 80 SER 0.056 0.034 17 0 "[ . 1 . 2]"
1 81 LEU 0.193 0.045 17 0 "[ . 1 . 2]"
1 82 ARG 0.151 0.045 17 0 "[ . 1 . 2]"
1 84 PRO 0.003 0.003 9 0 "[ . 1 . 2]"
1 85 GLU 0.291 0.089 17 0 "[ . 1 . 2]"
1 86 GLY 0.035 0.007 19 0 "[ . 1 . 2]"
1 87 SER 0.359 0.076 8 0 "[ . 1 . 2]"
1 88 GLU 0.292 0.074 11 0 "[ . 1 . 2]"
1 89 ALA 0.132 0.029 11 0 "[ . 1 . 2]"
1 90 ARG 0.189 0.018 20 0 "[ . 1 . 2]"
1 91 GLY 0.019 0.011 20 0 "[ . 1 . 2]"
1 92 ILE 0.041 0.015 19 0 "[ . 1 . 2]"
1 93 ARG 0.010 0.003 3 0 "[ . 1 . 2]"
1 94 ALA 0.004 0.003 3 0 "[ . 1 . 2]"
1 95 ARG 0.205 0.051 19 0 "[ . 1 . 2]"
1 96 THR 0.114 0.051 19 0 "[ . 1 . 2]"
1 97 PRO 0.023 0.006 11 0 "[ . 1 . 2]"
1 98 THR 0.005 0.003 5 0 "[ . 1 . 2]"
1 99 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 7 GLY QA 1 8 PRO QD . . 2.750 1.984 1.842 2.213 . 0 0 "[ . 1 . 2]" 1
2 1 7 GLY QA 1 8 PRO QG . . 4.200 3.734 3.642 4.005 . 0 0 "[ . 1 . 2]" 1
3 1 8 PRO HA 1 9 LEU H . . 2.930 2.281 2.153 2.629 . 0 0 "[ . 1 . 2]" 1
4 1 8 PRO HB2 1 9 LEU H . . 4.390 3.415 2.093 4.194 . 0 0 "[ . 1 . 2]" 1
5 1 8 PRO HB3 1 9 LEU H . . 4.390 3.962 3.217 4.497 0.107 15 0 "[ . 1 . 2]" 1
6 1 9 LEU H 1 9 LEU HB2 . . 3.500 2.881 2.550 3.581 0.081 18 0 "[ . 1 . 2]" 1
7 1 9 LEU H 1 9 LEU HB3 . . 3.500 2.870 2.648 3.183 . 0 0 "[ . 1 . 2]" 1
8 1 9 LEU H 1 9 LEU MD1 . . 4.780 4.122 3.845 4.301 . 0 0 "[ . 1 . 2]" 1
9 1 9 LEU H 1 9 LEU MD2 . . 4.780 4.402 1.846 4.783 0.003 7 0 "[ . 1 . 2]" 1
10 1 9 LEU H 1 10 PRO QD . . 4.590 3.563 3.321 4.354 . 0 0 "[ . 1 . 2]" 1
11 1 9 LEU HA 1 9 LEU MD1 . . 4.620 2.138 1.949 4.090 . 0 0 "[ . 1 . 2]" 1
12 1 9 LEU HA 1 9 LEU QD . . 3.280 2.093 1.943 3.340 0.060 18 0 "[ . 1 . 2]" 1
13 1 9 LEU HA 1 9 LEU MD2 . . 4.620 3.809 3.541 3.876 . 0 0 "[ . 1 . 2]" 1
14 1 9 LEU HA 1 10 PRO HD2 . . 3.300 1.973 1.912 2.424 . 0 0 "[ . 1 . 2]" 1
15 1 9 LEU HA 1 10 PRO QD . . 2.880 1.912 1.851 2.104 . 0 0 "[ . 1 . 2]" 1
16 1 9 LEU HA 1 10 PRO HD3 . . 3.300 2.630 2.310 2.747 . 0 0 "[ . 1 . 2]" 1
17 1 9 LEU HA 1 10 PRO HG3 . . 4.780 4.472 4.359 4.535 . 0 0 "[ . 1 . 2]" 1
18 1 9 LEU QB 1 10 PRO QD . . 4.160 3.672 1.914 3.802 . 0 0 "[ . 1 . 2]" 1
19 1 9 LEU QB 1 87 SER QB . . 3.690 2.720 1.977 3.719 0.029 18 0 "[ . 1 . 2]" 1
20 1 9 LEU QD 1 10 PRO QD . . 3.300 2.784 2.344 3.401 0.101 18 0 "[ . 1 . 2]" 1
21 1 9 LEU QD 1 10 PRO HG2 . . 4.410 4.317 3.965 4.426 0.016 19 0 "[ . 1 . 2]" 1
22 1 9 LEU QD 1 34 GLY QA . . 4.000 3.462 2.495 3.983 . 0 0 "[ . 1 . 2]" 1
23 1 9 LEU QD 1 35 ALA H . . 4.460 2.849 1.906 4.319 . 0 0 "[ . 1 . 2]" 1
24 1 9 LEU QD 1 35 ALA HA . . 3.580 3.023 2.613 3.479 . 0 0 "[ . 1 . 2]" 1
25 1 9 LEU QD 1 35 ALA MB . . 3.350 2.275 1.787 2.930 . 0 0 "[ . 1 . 2]" 1
26 1 9 LEU QD 1 36 THR H . . 5.360 4.576 4.109 5.002 . 0 0 "[ . 1 . 2]" 1
27 1 9 LEU QD 1 80 SER QB . . 3.400 2.399 1.684 3.133 . 0 0 "[ . 1 . 2]" 1
28 1 9 LEU QD 1 80 SER HG . . 5.170 4.068 3.129 4.743 . 0 0 "[ . 1 . 2]" 1
29 1 9 LEU QD 1 81 LEU HA . . 4.000 3.141 2.383 3.614 . 0 0 "[ . 1 . 2]" 1
30 1 9 LEU QD 1 82 ARG H . . 3.590 2.903 2.271 3.454 . 0 0 "[ . 1 . 2]" 1
31 1 9 LEU QD 1 82 ARG QB . . 3.150 2.004 1.702 2.431 . 0 0 "[ . 1 . 2]" 1
32 1 9 LEU QD 1 82 ARG QD . . 4.040 2.852 1.918 3.820 . 0 0 "[ . 1 . 2]" 1
33 1 9 LEU QD 1 82 ARG QG . . 3.810 3.046 2.174 3.783 . 0 0 "[ . 1 . 2]" 1
34 1 9 LEU QD 1 85 GLU QB . . 4.990 4.841 4.180 5.010 0.020 19 0 "[ . 1 . 2]" 1
35 1 9 LEU QD 1 85 GLU QG . . 4.010 3.701 3.105 4.010 0.000 20 0 "[ . 1 . 2]" 1
36 1 9 LEU QD 1 86 GLY HA2 . . 4.150 2.728 2.292 3.011 . 0 0 "[ . 1 . 2]" 1
37 1 9 LEU QD 1 87 SER H . . 3.880 2.648 2.336 3.145 . 0 0 "[ . 1 . 2]" 1
38 1 9 LEU QD 1 87 SER QB . . 3.710 2.201 1.946 2.855 . 0 0 "[ . 1 . 2]" 1
39 1 9 LEU MD1 1 35 ALA HA . . 4.290 3.156 2.685 3.706 . 0 0 "[ . 1 . 2]" 1
40 1 9 LEU MD1 1 35 ALA MB . . 3.960 2.378 1.794 3.122 . 0 0 "[ . 1 . 2]" 1
41 1 9 LEU MD1 1 82 ARG HB2 . . 4.450 2.462 1.875 3.919 . 0 0 "[ . 1 . 2]" 1
42 1 9 LEU MD1 1 82 ARG HB3 . . 4.450 3.128 2.312 4.080 . 0 0 "[ . 1 . 2]" 1
43 1 9 LEU MD1 1 86 GLY HA2 . . 5.370 4.942 3.282 5.371 0.001 13 0 "[ . 1 . 2]" 1
44 1 9 LEU MD1 1 87 SER H . . 5.420 5.040 3.275 5.421 0.001 1 0 "[ . 1 . 2]" 1
45 1 9 LEU MD1 1 87 SER HB2 . . 6.100 4.784 3.537 5.519 . 0 0 "[ . 1 . 2]" 1
46 1 9 LEU MD1 1 87 SER HB3 . . 6.100 4.293 2.263 5.592 . 0 0 "[ . 1 . 2]" 1
47 1 9 LEU MD2 1 35 ALA HA . . 4.290 4.007 3.418 4.300 0.010 18 0 "[ . 1 . 2]" 1
48 1 9 LEU MD2 1 35 ALA MB . . 3.960 3.129 2.677 3.612 . 0 0 "[ . 1 . 2]" 1
49 1 9 LEU MD2 1 82 ARG HB2 . . 4.450 2.699 2.039 4.369 . 0 0 "[ . 1 . 2]" 1
50 1 9 LEU MD2 1 82 ARG HB3 . . 4.450 2.853 1.946 3.373 . 0 0 "[ . 1 . 2]" 1
51 1 9 LEU MD2 1 86 GLY HA2 . . 5.370 2.744 2.300 3.027 . 0 0 "[ . 1 . 2]" 1
52 1 9 LEU MD2 1 87 SER H . . 5.420 2.676 2.340 3.324 . 0 0 "[ . 1 . 2]" 1
53 1 9 LEU MD2 1 87 SER HB2 . . 6.100 3.237 2.032 4.351 . 0 0 "[ . 1 . 2]" 1
54 1 9 LEU MD2 1 87 SER HB3 . . 6.100 2.562 1.968 3.620 . 0 0 "[ . 1 . 2]" 1
55 1 9 LEU HG 1 10 PRO QD . . 3.960 3.770 3.155 4.040 0.080 18 0 "[ . 1 . 2]" 1
56 1 9 LEU HG 1 80 SER HB2 . . 4.460 2.674 2.057 3.443 . 0 0 "[ . 1 . 2]" 1
57 1 9 LEU HG 1 80 SER QB . . 3.870 2.555 2.023 3.315 . 0 0 "[ . 1 . 2]" 1
58 1 9 LEU HG 1 80 SER HB3 . . 4.460 3.305 2.768 4.323 . 0 0 "[ . 1 . 2]" 1
59 1 9 LEU HG 1 87 SER H . . 4.630 4.428 3.830 4.635 0.005 3 0 "[ . 1 . 2]" 1
60 1 9 LEU HG 1 87 SER HB2 . . 4.400 3.404 2.157 4.359 . 0 0 "[ . 1 . 2]" 1
61 1 9 LEU HG 1 87 SER QB . . 3.760 2.494 1.946 3.039 . 0 0 "[ . 1 . 2]" 1
62 1 9 LEU HG 1 87 SER HB3 . . 4.400 2.901 1.988 4.376 . 0 0 "[ . 1 . 2]" 1
63 1 10 PRO QB 1 11 PRO QD . . 3.610 3.220 2.859 3.306 . 0 0 "[ . 1 . 2]" 1
64 1 10 PRO QD 1 33 ALA MB . . 5.230 3.521 2.548 4.398 . 0 0 "[ . 1 . 2]" 1
65 1 10 PRO HG2 1 32 SER QB . . 5.230 3.815 2.947 4.523 . 0 0 "[ . 1 . 2]" 1
66 1 10 PRO HG2 1 33 ALA MB . . 4.210 3.544 2.506 4.159 . 0 0 "[ . 1 . 2]" 1
67 1 10 PRO HG3 1 32 SER HA . . 5.440 4.670 4.006 5.057 . 0 0 "[ . 1 . 2]" 1
68 1 10 PRO HG3 1 33 ALA MB . . 3.990 3.417 2.693 4.000 0.010 19 0 "[ . 1 . 2]" 1
69 1 11 PRO HA 1 12 PRO HD2 . . 3.470 2.561 2.446 2.576 . 0 0 "[ . 1 . 2]" 1
70 1 11 PRO HA 1 12 PRO HD3 . . 3.360 2.382 2.324 2.390 . 0 0 "[ . 1 . 2]" 1
71 1 11 PRO HA 1 12 PRO QG . . 4.290 4.111 4.034 4.121 . 0 0 "[ . 1 . 2]" 1
72 1 11 PRO HA 1 87 SER HB2 . . 4.190 3.628 2.674 4.202 0.012 5 0 "[ . 1 . 2]" 1
73 1 11 PRO HA 1 87 SER HB3 . . 4.190 3.746 3.220 4.192 0.002 13 0 "[ . 1 . 2]" 1
74 1 11 PRO QB 1 12 PRO HD2 . . 3.390 1.965 1.937 2.187 . 0 0 "[ . 1 . 2]" 1
75 1 11 PRO QB 1 12 PRO HD3 . . 3.730 3.194 3.172 3.363 . 0 0 "[ . 1 . 2]" 1
76 1 11 PRO QB 1 87 SER QB . . 4.300 2.677 2.020 3.387 . 0 0 "[ . 1 . 2]" 1
77 1 11 PRO QB 1 87 SER HG . . 4.370 2.319 1.948 3.186 . 0 0 "[ . 1 . 2]" 1
78 1 11 PRO QB 1 88 GLU H . . 3.850 3.150 2.498 3.637 . 0 0 "[ . 1 . 2]" 1
79 1 11 PRO QB 1 90 ARG QD . . 4.520 3.843 3.686 4.036 . 0 0 "[ . 1 . 2]" 1
80 1 11 PRO QB 1 90 ARG HG3 . . 3.550 2.052 1.973 2.323 . 0 0 "[ . 1 . 2]" 1
81 1 11 PRO HB2 1 12 PRO HD2 . . 3.930 2.020 1.987 2.277 . 0 0 "[ . 1 . 2]" 1
82 1 11 PRO HB2 1 12 PRO HD3 . . 4.300 3.466 3.438 3.682 . 0 0 "[ . 1 . 2]" 1
83 1 11 PRO HB2 1 90 ARG HG3 . . 4.160 2.067 1.990 2.339 . 0 0 "[ . 1 . 2]" 1
84 1 11 PRO HB3 1 12 PRO HD2 . . 3.930 2.698 2.683 2.823 . 0 0 "[ . 1 . 2]" 1
85 1 11 PRO HB3 1 12 PRO HD3 . . 4.300 3.740 3.722 3.887 . 0 0 "[ . 1 . 2]" 1
86 1 11 PRO HB3 1 90 ARG HG3 . . 4.160 3.508 3.182 3.960 . 0 0 "[ . 1 . 2]" 1
87 1 11 PRO QG 1 12 PRO HD2 . . 4.190 3.896 3.871 4.084 . 0 0 "[ . 1 . 2]" 1
88 1 11 PRO QG 1 87 SER QB . . 4.560 3.759 2.954 4.629 0.069 19 0 "[ . 1 . 2]" 1
89 1 11 PRO QG 1 90 ARG QD . . 3.800 3.738 3.496 3.818 0.018 20 0 "[ . 1 . 2]" 1
90 1 11 PRO QG 1 90 ARG HG3 . . 3.010 2.954 2.624 3.023 0.013 5 0 "[ . 1 . 2]" 1
91 1 12 PRO HA 1 13 ARG H . . 2.960 2.161 2.151 2.203 . 0 0 "[ . 1 . 2]" 1
92 1 12 PRO HA 1 29 TRP HD1 . . 4.570 3.888 3.551 4.155 . 0 0 "[ . 1 . 2]" 1
93 1 12 PRO HB2 1 13 ARG H . . 4.140 3.642 3.303 3.964 . 0 0 "[ . 1 . 2]" 1
94 1 12 PRO HB2 1 13 ARG HA . . 4.920 4.461 4.325 4.667 . 0 0 "[ . 1 . 2]" 1
95 1 12 PRO HB2 1 15 LEU MD1 . . 4.400 2.140 1.773 3.071 . 0 0 "[ . 1 . 2]" 1
96 1 12 PRO HB2 1 15 LEU QD . . 3.750 2.030 1.769 2.738 . 0 0 "[ . 1 . 2]" 1
97 1 12 PRO HB2 1 15 LEU MD2 . . 4.400 3.296 2.232 3.827 . 0 0 "[ . 1 . 2]" 1
98 1 12 PRO HB2 1 29 TRP HB2 . . 4.710 2.413 2.094 2.625 . 0 0 "[ . 1 . 2]" 1
99 1 12 PRO HB2 1 29 TRP HB3 . . 4.360 3.118 2.708 3.440 . 0 0 "[ . 1 . 2]" 1
100 1 12 PRO HB2 1 29 TRP HD1 . . 4.370 3.806 3.477 4.175 . 0 0 "[ . 1 . 2]" 1
101 1 12 PRO HB2 1 30 GLN H . . 4.530 3.942 3.775 4.126 . 0 0 "[ . 1 . 2]" 1
102 1 12 PRO HB2 1 78 VAL HB . . 4.730 3.828 3.332 4.197 . 0 0 "[ . 1 . 2]" 1
103 1 12 PRO HB2 1 78 VAL MG1 . . 4.150 3.838 3.532 4.138 . 0 0 "[ . 1 . 2]" 1
104 1 12 PRO HB3 1 13 ARG H . . 4.380 4.078 3.849 4.310 . 0 0 "[ . 1 . 2]" 1
105 1 12 PRO HB3 1 15 LEU QD . . 4.480 3.332 2.924 3.812 . 0 0 "[ . 1 . 2]" 1
106 1 12 PRO HB3 1 29 TRP HB3 . . 5.280 3.775 3.264 4.228 . 0 0 "[ . 1 . 2]" 1
107 1 12 PRO HB3 1 29 TRP HD1 . . 4.000 2.500 2.155 2.882 . 0 0 "[ . 1 . 2]" 1
108 1 12 PRO HD2 1 79 GLN HA . . 4.400 3.752 3.180 4.100 . 0 0 "[ . 1 . 2]" 1
109 1 12 PRO HD2 1 80 SER H . . 4.580 3.749 3.307 4.068 . 0 0 "[ . 1 . 2]" 1
110 1 12 PRO HD2 1 80 SER HG . . 5.040 3.677 3.060 4.673 . 0 0 "[ . 1 . 2]" 1
111 1 12 PRO HD2 1 87 SER HG . . 4.530 3.646 3.090 4.254 . 0 0 "[ . 1 . 2]" 1
112 1 12 PRO HD2 1 90 ARG H . . 4.610 4.315 3.940 4.590 . 0 0 "[ . 1 . 2]" 1
113 1 12 PRO HD2 1 90 ARG HG3 . . 4.140 3.182 2.998 3.471 . 0 0 "[ . 1 . 2]" 1
114 1 12 PRO HD3 1 13 ARG H . . 5.500 5.534 5.416 5.592 0.092 3 0 "[ . 1 . 2]" 1
115 1 12 PRO HD3 1 80 SER H . . 3.950 3.319 2.989 3.644 . 0 0 "[ . 1 . 2]" 1
116 1 12 PRO HD3 1 80 SER HG . . 4.090 2.472 2.027 3.097 . 0 0 "[ . 1 . 2]" 1
117 1 12 PRO HD3 1 87 SER QB . . 5.000 4.602 4.084 4.988 . 0 0 "[ . 1 . 2]" 1
118 1 12 PRO HD3 1 87 SER HG . . 4.370 4.081 3.299 4.399 0.029 19 0 "[ . 1 . 2]" 1
119 1 12 PRO HD3 1 90 ARG HG3 . . 5.050 4.865 4.674 5.059 0.009 8 0 "[ . 1 . 2]" 1
120 1 12 PRO QG 1 15 LEU MD1 . . 4.590 2.527 1.963 2.899 . 0 0 "[ . 1 . 2]" 1
121 1 12 PRO QG 1 15 LEU QD . . 3.930 2.445 1.945 2.771 . 0 0 "[ . 1 . 2]" 1
122 1 12 PRO QG 1 15 LEU MD2 . . 4.590 3.318 2.867 3.728 . 0 0 "[ . 1 . 2]" 1
123 1 12 PRO QG 1 29 TRP HE1 . . 4.860 4.425 3.919 4.866 0.006 3 0 "[ . 1 . 2]" 1
124 1 12 PRO QG 1 30 GLN H . . 5.500 5.435 5.284 5.526 0.026 19 0 "[ . 1 . 2]" 1
125 1 12 PRO QG 1 78 VAL HB . . 3.490 2.148 1.940 2.451 . 0 0 "[ . 1 . 2]" 1
126 1 12 PRO QG 1 78 VAL MG1 . . 3.210 2.058 1.888 2.304 . 0 0 "[ . 1 . 2]" 1
127 1 12 PRO QG 1 78 VAL MG2 . . 3.930 3.384 3.166 3.633 . 0 0 "[ . 1 . 2]" 1
128 1 12 PRO QG 1 79 GLN H . . 4.960 4.450 3.983 4.788 . 0 0 "[ . 1 . 2]" 1
129 1 12 PRO QG 1 79 GLN HA . . 4.470 4.049 3.543 4.413 . 0 0 "[ . 1 . 2]" 1
130 1 12 PRO QG 1 80 SER H . . 4.610 4.378 3.926 4.610 0.000 5 0 "[ . 1 . 2]" 1
131 1 12 PRO QG 1 80 SER HG . . 4.890 4.236 3.634 4.885 . 0 0 "[ . 1 . 2]" 1
132 1 13 ARG H 1 13 ARG QB . . 3.260 2.748 2.262 3.155 . 0 0 "[ . 1 . 2]" 1
133 1 13 ARG H 1 13 ARG QD . . 4.670 4.040 2.442 4.692 0.022 7 0 "[ . 1 . 2]" 1
134 1 13 ARG H 1 13 ARG QG . . 4.310 2.695 1.859 3.887 . 0 0 "[ . 1 . 2]" 1
135 1 13 ARG H 1 14 ALA H . . 4.790 2.052 1.830 2.379 . 0 0 "[ . 1 . 2]" 1
136 1 13 ARG H 1 14 ALA HA . . 5.500 4.747 4.578 5.016 . 0 0 "[ . 1 . 2]" 1
137 1 13 ARG H 1 29 TRP HB2 . . 4.410 4.118 3.790 4.331 . 0 0 "[ . 1 . 2]" 1
138 1 13 ARG H 1 29 TRP HD1 . . 5.450 5.428 5.296 5.481 0.031 19 0 "[ . 1 . 2]" 1
139 1 13 ARG H 1 30 GLN H . . 4.080 3.685 3.271 3.888 . 0 0 "[ . 1 . 2]" 1
140 1 13 ARG H 1 30 GLN HB2 . . 4.660 3.177 2.972 3.418 . 0 0 "[ . 1 . 2]" 1
141 1 13 ARG H 1 30 GLN HB3 . . 4.660 4.605 4.415 4.670 0.010 11 0 "[ . 1 . 2]" 1
142 1 13 ARG HA 1 13 ARG QD . . 4.350 3.937 2.207 4.395 0.045 15 0 "[ . 1 . 2]" 1
143 1 13 ARG HA 1 13 ARG QG . . 3.820 3.105 2.577 3.431 . 0 0 "[ . 1 . 2]" 1
144 1 13 ARG HA 1 14 ALA H . . 3.530 3.526 3.462 3.563 0.033 10 0 "[ . 1 . 2]" 1
145 1 13 ARG HA 1 14 ALA HA . . 4.750 4.707 4.683 4.726 . 0 0 "[ . 1 . 2]" 1
146 1 13 ARG HA 1 14 ALA MB . . 5.120 5.007 4.984 5.020 . 0 0 "[ . 1 . 2]" 1
147 1 13 ARG QB 1 13 ARG QD . . 3.300 2.161 2.048 2.689 . 0 0 "[ . 1 . 2]" 1
148 1 13 ARG QB 1 14 ALA H . . 4.100 3.072 2.732 3.272 . 0 0 "[ . 1 . 2]" 1
149 1 13 ARG QB 1 14 ALA MB . . 4.090 4.085 3.896 4.198 0.108 19 0 "[ . 1 . 2]" 1
150 1 13 ARG HB2 1 13 ARG QD . . 3.780 2.539 2.099 3.391 . 0 0 "[ . 1 . 2]" 1
151 1 13 ARG HB3 1 13 ARG QD . . 3.780 2.537 2.124 3.443 . 0 0 "[ . 1 . 2]" 1
152 1 13 ARG QD 1 14 ALA MB . . 5.310 4.617 3.627 5.264 . 0 0 "[ . 1 . 2]" 1
153 1 13 ARG QG 1 14 ALA H . . 4.800 2.538 1.809 3.458 . 0 0 "[ . 1 . 2]" 1
154 1 13 ARG QG 1 14 ALA MB . . 3.790 3.211 2.545 3.781 . 0 0 "[ . 1 . 2]" 1
155 1 14 ALA H 1 14 ALA MB . . 3.630 2.215 2.123 2.282 . 0 0 "[ . 1 . 2]" 1
156 1 14 ALA H 1 15 LEU H . . 3.570 3.510 3.153 3.596 0.026 20 0 "[ . 1 . 2]" 1
157 1 14 ALA HA 1 15 LEU H . . 3.180 2.625 2.565 2.829 . 0 0 "[ . 1 . 2]" 1
158 1 14 ALA MB 1 15 LEU H . . 4.170 3.716 3.673 3.721 . 0 0 "[ . 1 . 2]" 1
159 1 14 ALA MB 1 15 LEU HA . . 4.760 4.269 4.214 4.315 . 0 0 "[ . 1 . 2]" 1
160 1 14 ALA MB 1 29 TRP HA . . 4.540 3.377 2.447 3.927 . 0 0 "[ . 1 . 2]" 1
161 1 14 ALA MB 1 29 TRP HB2 . . 4.810 4.231 3.420 4.804 . 0 0 "[ . 1 . 2]" 1
162 1 14 ALA MB 1 30 GLN H . . 4.680 2.866 2.218 3.538 . 0 0 "[ . 1 . 2]" 1
163 1 14 ALA MB 1 30 GLN HA . . 5.140 3.918 3.510 4.439 . 0 0 "[ . 1 . 2]" 1
164 1 14 ALA MB 1 30 GLN HB2 . . 4.630 2.853 2.203 4.043 . 0 0 "[ . 1 . 2]" 1
165 1 14 ALA MB 1 30 GLN QB . . 3.850 2.780 2.181 3.783 . 0 0 "[ . 1 . 2]" 1
166 1 14 ALA MB 1 30 GLN HB3 . . 4.630 3.931 3.415 4.554 . 0 0 "[ . 1 . 2]" 1
167 1 14 ALA MB 1 30 GLN HE21 . . 4.970 3.431 1.911 4.480 . 0 0 "[ . 1 . 2]" 1
168 1 14 ALA MB 1 30 GLN QE . . 4.250 3.269 1.896 4.063 . 0 0 "[ . 1 . 2]" 1
169 1 14 ALA MB 1 30 GLN HE22 . . 4.970 4.316 2.762 4.966 . 0 0 "[ . 1 . 2]" 1
170 1 14 ALA MB 1 30 GLN HG2 . . 3.600 2.537 1.868 3.510 . 0 0 "[ . 1 . 2]" 1
171 1 14 ALA MB 1 30 GLN QG . . 3.110 1.908 1.730 2.140 . 0 0 "[ . 1 . 2]" 1
172 1 14 ALA MB 1 30 GLN HG3 . . 3.600 2.153 1.795 2.910 . 0 0 "[ . 1 . 2]" 1
173 1 15 LEU H 1 15 LEU HB2 . . 3.010 2.242 2.184 2.323 . 0 0 "[ . 1 . 2]" 1
174 1 15 LEU H 1 15 LEU HB3 . . 3.620 3.530 3.487 3.573 . 0 0 "[ . 1 . 2]" 1
175 1 15 LEU H 1 15 LEU MD1 . . 4.490 2.632 2.099 3.547 . 0 0 "[ . 1 . 2]" 1
176 1 15 LEU H 1 15 LEU QD . . 3.730 2.579 2.092 3.356 . 0 0 "[ . 1 . 2]" 1
177 1 15 LEU H 1 15 LEU MD2 . . 4.490 4.123 3.941 4.276 . 0 0 "[ . 1 . 2]" 1
178 1 15 LEU H 1 15 LEU HG . . 4.110 3.534 2.802 3.915 . 0 0 "[ . 1 . 2]" 1
179 1 15 LEU H 1 16 THR H . . 4.540 4.332 4.129 4.493 . 0 0 "[ . 1 . 2]" 1
180 1 15 LEU H 1 29 TRP HB2 . . 5.090 4.714 4.268 4.937 . 0 0 "[ . 1 . 2]" 1
181 1 15 LEU HA 1 15 LEU MD1 . . 4.160 3.213 2.715 3.863 . 0 0 "[ . 1 . 2]" 1
182 1 15 LEU HA 1 15 LEU QD . . 3.540 2.698 2.295 2.992 . 0 0 "[ . 1 . 2]" 1
183 1 15 LEU HA 1 15 LEU MD2 . . 4.160 3.291 2.314 3.758 . 0 0 "[ . 1 . 2]" 1
184 1 15 LEU HA 1 15 LEU HG . . 4.180 2.432 2.257 2.673 . 0 0 "[ . 1 . 2]" 1
185 1 15 LEU HA 1 16 THR H . . 2.960 2.167 2.137 2.240 . 0 0 "[ . 1 . 2]" 1
186 1 15 LEU HA 1 29 TRP HB2 . . 4.050 3.585 3.443 3.780 . 0 0 "[ . 1 . 2]" 1
187 1 15 LEU HA 1 29 TRP HB3 . . 3.920 2.623 2.487 2.839 . 0 0 "[ . 1 . 2]" 1
188 1 15 LEU HA 1 29 TRP HE3 . . 4.710 4.142 3.707 4.485 . 0 0 "[ . 1 . 2]" 1
189 1 15 LEU HB2 1 16 THR H . . 5.060 4.482 4.314 4.573 . 0 0 "[ . 1 . 2]" 1
190 1 15 LEU HB2 1 92 ILE HB . . 4.360 3.292 2.755 4.045 . 0 0 "[ . 1 . 2]" 1
191 1 15 LEU HB2 1 92 ILE MD . . 3.800 3.325 2.934 3.757 . 0 0 "[ . 1 . 2]" 1
192 1 15 LEU HB3 1 16 THR H . . 4.190 3.705 3.360 3.998 . 0 0 "[ . 1 . 2]" 1
193 1 15 LEU HB3 1 29 TRP HB2 . . 5.500 5.415 5.207 5.502 0.002 4 0 "[ . 1 . 2]" 1
194 1 15 LEU HB3 1 29 TRP HE3 . . 5.500 4.853 4.501 5.318 . 0 0 "[ . 1 . 2]" 1
195 1 15 LEU HB3 1 92 ILE HB . . 4.400 2.669 2.467 2.959 . 0 0 "[ . 1 . 2]" 1
196 1 15 LEU HB3 1 92 ILE MD . . 3.640 2.585 2.055 2.891 . 0 0 "[ . 1 . 2]" 1
197 1 15 LEU QD 1 16 THR H . . 4.300 4.148 3.759 4.334 0.034 11 0 "[ . 1 . 2]" 1
198 1 15 LEU QD 1 29 TRP HA . . 5.440 3.807 3.505 4.149 . 0 0 "[ . 1 . 2]" 1
199 1 15 LEU QD 1 29 TRP HB2 . . 4.050 2.829 2.498 3.227 . 0 0 "[ . 1 . 2]" 1
200 1 15 LEU QD 1 29 TRP HB3 . . 3.650 2.547 1.836 2.973 . 0 0 "[ . 1 . 2]" 1
201 1 15 LEU QD 1 29 TRP HD1 . . 4.700 4.588 4.224 4.708 0.008 20 0 "[ . 1 . 2]" 1
202 1 15 LEU QD 1 29 TRP HE3 . . 3.920 3.139 2.149 3.796 . 0 0 "[ . 1 . 2]" 1
203 1 15 LEU QD 1 77 SER HA . . 4.580 4.211 3.821 4.513 . 0 0 "[ . 1 . 2]" 1
204 1 15 LEU QD 1 78 VAL H . . 4.220 3.560 3.323 3.836 . 0 0 "[ . 1 . 2]" 1
205 1 15 LEU QD 1 78 VAL HB . . 3.740 3.044 2.704 3.288 . 0 0 "[ . 1 . 2]" 1
206 1 15 LEU QD 1 78 VAL MG1 . . 3.990 3.729 3.061 3.983 . 0 0 "[ . 1 . 2]" 1
207 1 15 LEU QD 1 78 VAL MG2 . . 3.340 2.521 1.948 3.000 . 0 0 "[ . 1 . 2]" 1
208 1 15 LEU QD 1 90 ARG HA . . 4.580 4.145 3.930 4.490 . 0 0 "[ . 1 . 2]" 1
209 1 15 LEU QD 1 90 ARG HB2 . . 4.050 3.056 2.440 3.312 . 0 0 "[ . 1 . 2]" 1
210 1 15 LEU QD 1 90 ARG HB3 . . 3.950 2.683 2.186 3.166 . 0 0 "[ . 1 . 2]" 1
211 1 15 LEU QD 1 91 GLY H . . 4.880 4.023 3.770 4.210 . 0 0 "[ . 1 . 2]" 1
212 1 15 LEU QD 1 91 GLY QA . . 4.180 2.808 2.417 3.413 . 0 0 "[ . 1 . 2]" 1
213 1 15 LEU QD 1 92 ILE H . . 4.310 3.227 2.813 3.823 . 0 0 "[ . 1 . 2]" 1
214 1 15 LEU QD 1 92 ILE HA . . 4.590 3.803 3.400 4.315 . 0 0 "[ . 1 . 2]" 1
215 1 15 LEU QD 1 92 ILE HB . . 3.440 2.381 1.986 3.246 . 0 0 "[ . 1 . 2]" 1
216 1 15 LEU QD 1 92 ILE MD . . 4.150 3.387 2.937 3.695 . 0 0 "[ . 1 . 2]" 1
217 1 15 LEU MD1 1 16 THR H . . 5.500 4.970 4.566 5.515 0.015 5 0 "[ . 1 . 2]" 1
218 1 15 LEU MD1 1 29 TRP HB2 . . 4.690 3.224 2.511 4.473 . 0 0 "[ . 1 . 2]" 1
219 1 15 LEU MD1 1 29 TRP HB3 . . 4.290 3.265 2.632 4.117 . 0 0 "[ . 1 . 2]" 1
220 1 15 LEU MD1 1 29 TRP HE3 . . 4.810 4.653 4.351 4.812 0.002 19 0 "[ . 1 . 2]" 1
221 1 15 LEU MD1 1 78 VAL HB . . 4.510 3.736 3.218 4.254 . 0 0 "[ . 1 . 2]" 1
222 1 15 LEU MD1 1 78 VAL MG1 . . 4.780 4.422 4.137 4.743 . 0 0 "[ . 1 . 2]" 1
223 1 15 LEU MD1 1 90 ARG HB2 . . 4.710 3.220 2.457 3.616 . 0 0 "[ . 1 . 2]" 1
224 1 15 LEU MD1 1 90 ARG HB3 . . 4.520 2.831 2.193 3.585 . 0 0 "[ . 1 . 2]" 1
225 1 15 LEU MD2 1 16 THR H . . 5.500 4.606 3.834 5.297 . 0 0 "[ . 1 . 2]" 1
226 1 15 LEU MD2 1 29 TRP HB2 . . 4.690 4.066 2.946 4.645 . 0 0 "[ . 1 . 2]" 1
227 1 15 LEU MD2 1 29 TRP HB3 . . 4.290 3.105 1.839 3.820 . 0 0 "[ . 1 . 2]" 1
228 1 15 LEU MD2 1 29 TRP HE3 . . 4.810 3.249 2.152 3.980 . 0 0 "[ . 1 . 2]" 1
229 1 15 LEU MD2 1 78 VAL HB . . 4.510 3.239 2.885 3.710 . 0 0 "[ . 1 . 2]" 1
230 1 15 LEU MD2 1 78 VAL MG1 . . 4.780 4.065 3.133 4.606 . 0 0 "[ . 1 . 2]" 1
231 1 15 LEU MD2 1 90 ARG HB2 . . 4.710 3.994 3.458 4.714 0.004 5 0 "[ . 1 . 2]" 1
232 1 15 LEU MD2 1 90 ARG HB3 . . 4.520 3.734 3.181 4.526 0.006 10 0 "[ . 1 . 2]" 1
233 1 15 LEU HG 1 16 THR H . . 5.450 4.401 4.011 4.867 . 0 0 "[ . 1 . 2]" 1
234 1 15 LEU HG 1 29 TRP HB2 . . 4.890 3.102 2.818 3.396 . 0 0 "[ . 1 . 2]" 1
235 1 15 LEU HG 1 29 TRP HB3 . . 4.410 2.225 1.995 2.753 . 0 0 "[ . 1 . 2]" 1
236 1 15 LEU HG 1 92 ILE MG . . 4.560 4.254 3.596 4.565 0.005 10 0 "[ . 1 . 2]" 1
237 1 16 THR H 1 16 THR HB . . 3.360 2.760 2.570 2.946 . 0 0 "[ . 1 . 2]" 1
238 1 16 THR H 1 16 THR MG . . 4.200 3.901 3.826 3.962 . 0 0 "[ . 1 . 2]" 1
239 1 16 THR H 1 27 LEU QD . . 4.160 3.362 2.515 4.079 . 0 0 "[ . 1 . 2]" 1
240 1 16 THR H 1 28 THR H . . 3.810 3.449 3.161 3.822 0.012 11 0 "[ . 1 . 2]" 1
241 1 16 THR H 1 29 TRP HA . . 4.310 3.422 2.906 4.083 . 0 0 "[ . 1 . 2]" 1
242 1 16 THR H 1 29 TRP HB2 . . 5.500 5.247 4.977 5.507 0.007 5 0 "[ . 1 . 2]" 1
243 1 16 THR H 1 29 TRP HB3 . . 4.410 4.169 4.020 4.403 . 0 0 "[ . 1 . 2]" 1
244 1 16 THR HA 1 16 THR MG . . 3.250 2.370 2.245 2.443 . 0 0 "[ . 1 . 2]" 1
245 1 16 THR HA 1 17 LEU H . . 2.650 2.227 2.180 2.325 . 0 0 "[ . 1 . 2]" 1
246 1 16 THR HA 1 17 LEU HB2 . . 4.470 4.240 4.195 4.291 . 0 0 "[ . 1 . 2]" 1
247 1 16 THR HA 1 92 ILE MD . . 3.980 3.062 2.175 3.534 . 0 0 "[ . 1 . 2]" 1
248 1 16 THR HB 1 17 LEU H . . 4.050 3.925 3.669 4.043 . 0 0 "[ . 1 . 2]" 1
249 1 16 THR HB 1 28 THR H . . 4.900 4.697 4.439 4.904 0.004 7 0 "[ . 1 . 2]" 1
250 1 16 THR MG 1 17 LEU H . . 3.420 2.072 1.851 2.341 . 0 0 "[ . 1 . 2]" 1
251 1 16 THR MG 1 17 LEU HA . . 4.510 3.935 3.835 4.050 . 0 0 "[ . 1 . 2]" 1
252 1 16 THR MG 1 17 LEU HB2 . . 4.800 3.987 3.662 4.257 . 0 0 "[ . 1 . 2]" 1
253 1 16 THR MG 1 17 LEU HG . . 5.500 5.456 5.333 5.525 0.025 5 0 "[ . 1 . 2]" 1
254 1 16 THR MG 1 18 ALA HA . . 4.170 3.983 3.703 4.180 0.010 5 0 "[ . 1 . 2]" 1
255 1 17 LEU H 1 17 LEU HB2 . . 3.310 2.320 2.197 2.497 . 0 0 "[ . 1 . 2]" 1
256 1 17 LEU H 1 17 LEU HB3 . . 3.560 2.787 2.670 2.869 . 0 0 "[ . 1 . 2]" 1
257 1 17 LEU H 1 17 LEU MD1 . . 4.760 3.998 3.778 4.259 . 0 0 "[ . 1 . 2]" 1
258 1 17 LEU H 1 17 LEU QD . . 4.170 3.613 3.398 3.744 . 0 0 "[ . 1 . 2]" 1
259 1 17 LEU H 1 17 LEU MD2 . . 4.760 4.188 3.571 4.375 . 0 0 "[ . 1 . 2]" 1
260 1 17 LEU H 1 17 LEU HG . . 4.620 4.465 4.247 4.618 . 0 0 "[ . 1 . 2]" 1
261 1 17 LEU H 1 92 ILE MD . . 3.880 3.480 2.469 3.874 . 0 0 "[ . 1 . 2]" 1
262 1 17 LEU HA 1 17 LEU MD1 . . 4.040 2.815 2.080 3.737 . 0 0 "[ . 1 . 2]" 1
263 1 17 LEU HA 1 17 LEU QD . . 3.510 2.458 1.946 2.868 . 0 0 "[ . 1 . 2]" 1
264 1 17 LEU HA 1 17 LEU MD2 . . 4.040 3.221 2.043 3.860 . 0 0 "[ . 1 . 2]" 1
265 1 17 LEU HA 1 17 LEU HG . . 3.900 2.746 2.279 3.726 . 0 0 "[ . 1 . 2]" 1
266 1 17 LEU HA 1 18 ALA H . . 2.960 2.158 2.140 2.177 . 0 0 "[ . 1 . 2]" 1
267 1 17 LEU HA 1 18 ALA HA . . 4.950 4.422 4.358 4.453 . 0 0 "[ . 1 . 2]" 1
268 1 17 LEU HA 1 18 ALA MB . . 4.400 3.975 3.918 4.025 . 0 0 "[ . 1 . 2]" 1
269 1 17 LEU HA 1 27 LEU HA . . 3.660 2.695 2.287 3.161 . 0 0 "[ . 1 . 2]" 1
270 1 17 LEU HA 1 27 LEU MD1 . . 4.960 2.565 1.993 4.115 . 0 0 "[ . 1 . 2]" 1
271 1 17 LEU HA 1 27 LEU QD . . 3.930 2.220 1.916 2.495 . 0 0 "[ . 1 . 2]" 1
272 1 17 LEU HA 1 27 LEU MD2 . . 4.960 4.174 1.934 4.962 0.002 9 0 "[ . 1 . 2]" 1
273 1 17 LEU HB2 1 18 ALA H . . 4.660 4.518 4.348 4.582 . 0 0 "[ . 1 . 2]" 1
274 1 17 LEU HB3 1 18 ALA H . . 4.250 4.164 3.831 4.261 0.011 15 0 "[ . 1 . 2]" 1
275 1 17 LEU HB3 1 20 VAL HB . . 4.830 4.438 4.038 4.830 . 0 0 "[ . 1 . 2]" 1
276 1 17 LEU HB3 1 95 ARG HE . . 5.470 5.378 5.016 5.475 0.005 11 0 "[ . 1 . 2]" 1
277 1 17 LEU QD 1 18 ALA H . . 4.250 3.173 2.137 3.870 . 0 0 "[ . 1 . 2]" 1
278 1 17 LEU QD 1 19 ALA H . . 4.280 2.689 1.819 3.617 . 0 0 "[ . 1 . 2]" 1
279 1 17 LEU QD 1 20 VAL HB . . 4.240 2.164 1.841 2.803 . 0 0 "[ . 1 . 2]" 1
280 1 17 LEU QD 1 25 VAL HB . . 5.440 4.995 4.474 5.435 . 0 0 "[ . 1 . 2]" 1
281 1 17 LEU QD 1 26 HIS H . . 4.830 3.248 2.697 4.010 . 0 0 "[ . 1 . 2]" 1
282 1 17 LEU QD 1 27 LEU HA . . 4.880 3.427 2.659 4.165 . 0 0 "[ . 1 . 2]" 1
283 1 17 LEU QD 1 92 ILE MD . . 4.170 3.586 3.068 4.168 . 0 0 "[ . 1 . 2]" 1
284 1 17 LEU QD 1 95 ARG H . . 4.570 3.064 2.631 3.431 . 0 0 "[ . 1 . 2]" 1
285 1 17 LEU QD 1 95 ARG HE . . 4.660 3.404 2.688 4.583 . 0 0 "[ . 1 . 2]" 1
286 1 17 LEU MD1 1 18 ALA H . . 5.250 3.897 2.147 5.094 . 0 0 "[ . 1 . 2]" 1
287 1 17 LEU MD1 1 19 ALA H . . 4.940 3.817 1.822 4.749 . 0 0 "[ . 1 . 2]" 1
288 1 17 LEU MD2 1 18 ALA H . . 5.250 3.925 2.501 4.868 . 0 0 "[ . 1 . 2]" 1
289 1 17 LEU MD2 1 19 ALA H . . 4.940 3.249 1.853 4.277 . 0 0 "[ . 1 . 2]" 1
290 1 17 LEU HG 1 20 VAL HA . . 5.020 4.187 3.598 4.966 . 0 0 "[ . 1 . 2]" 1
291 1 18 ALA H 1 18 ALA MB . . 3.100 2.149 2.025 2.246 . 0 0 "[ . 1 . 2]" 1
292 1 18 ALA H 1 19 ALA H . . 3.130 2.733 2.536 2.939 . 0 0 "[ . 1 . 2]" 1
293 1 18 ALA H 1 26 HIS HB3 . . 4.840 3.978 3.466 4.377 . 0 0 "[ . 1 . 2]" 1
294 1 18 ALA H 1 27 LEU HA . . 3.540 2.547 2.093 2.802 . 0 0 "[ . 1 . 2]" 1
295 1 18 ALA H 1 27 LEU QD . . 4.850 3.397 2.787 3.858 . 0 0 "[ . 1 . 2]" 1
296 1 18 ALA H 1 28 THR H . . 4.040 3.398 2.842 3.818 . 0 0 "[ . 1 . 2]" 1
297 1 18 ALA H 1 28 THR MG . . 4.160 3.506 3.041 3.987 . 0 0 "[ . 1 . 2]" 1
298 1 18 ALA HA 1 19 ALA HA . . 5.380 4.602 4.566 4.633 . 0 0 "[ . 1 . 2]" 1
299 1 18 ALA HA 1 27 LEU HA . . 5.500 5.214 4.641 5.502 0.002 12 0 "[ . 1 . 2]" 1
300 1 18 ALA MB 1 19 ALA H . . 3.320 2.507 2.323 2.779 . 0 0 "[ . 1 . 2]" 1
301 1 18 ALA MB 1 19 ALA HA . . 4.820 4.251 4.172 4.325 . 0 0 "[ . 1 . 2]" 1
302 1 18 ALA MB 1 19 ALA MB . . 3.700 3.130 3.056 3.204 . 0 0 "[ . 1 . 2]" 1
303 1 18 ALA MB 1 26 HIS H . . 4.890 4.608 4.114 4.876 . 0 0 "[ . 1 . 2]" 1
304 1 18 ALA MB 1 26 HIS HB2 . . 4.240 3.839 3.390 4.237 . 0 0 "[ . 1 . 2]" 1
305 1 18 ALA MB 1 26 HIS HB3 . . 3.670 2.504 2.027 3.076 . 0 0 "[ . 1 . 2]" 1
306 1 18 ALA MB 1 26 HIS HD2 . . 4.540 3.611 2.398 4.393 . 0 0 "[ . 1 . 2]" 1
307 1 18 ALA MB 1 26 HIS HE1 . . 4.550 3.702 2.763 4.422 . 0 0 "[ . 1 . 2]" 1
308 1 18 ALA MB 1 27 LEU HA . . 4.170 3.408 2.820 3.785 . 0 0 "[ . 1 . 2]" 1
309 1 18 ALA MB 1 28 THR H . . 4.090 3.783 3.084 4.092 0.002 8 0 "[ . 1 . 2]" 1
310 1 18 ALA MB 1 28 THR MG . . 3.090 1.990 1.752 2.276 . 0 0 "[ . 1 . 2]" 1
311 1 19 ALA H 1 19 ALA MB . . 3.410 2.744 2.624 2.820 . 0 0 "[ . 1 . 2]" 1
312 1 19 ALA H 1 20 VAL H . . 4.510 4.241 4.030 4.400 . 0 0 "[ . 1 . 2]" 1
313 1 19 ALA H 1 20 VAL MG1 . . 5.480 5.445 5.226 5.497 0.017 10 0 "[ . 1 . 2]" 1
314 1 19 ALA H 1 25 VAL MG1 . . 5.500 5.030 4.668 5.205 . 0 0 "[ . 1 . 2]" 1
315 1 19 ALA H 1 26 HIS H . . 3.970 3.660 3.288 3.921 . 0 0 "[ . 1 . 2]" 1
316 1 19 ALA H 1 26 HIS HB2 . . 4.370 4.152 3.898 4.370 . 0 0 "[ . 1 . 2]" 1
317 1 19 ALA H 1 26 HIS HB3 . . 3.430 2.513 2.342 2.776 . 0 0 "[ . 1 . 2]" 1
318 1 19 ALA H 1 27 LEU HA . . 4.650 4.446 4.187 4.618 . 0 0 "[ . 1 . 2]" 1
319 1 19 ALA H 1 28 THR MG . . 5.500 4.991 4.640 5.321 . 0 0 "[ . 1 . 2]" 1
320 1 19 ALA HA 1 20 VAL H . . 2.840 2.232 2.145 2.432 . 0 0 "[ . 1 . 2]" 1
321 1 19 ALA MB 1 20 VAL H . . 3.450 2.820 2.309 3.157 . 0 0 "[ . 1 . 2]" 1
322 1 19 ALA MB 1 20 VAL HA . . 4.630 4.167 4.009 4.290 . 0 0 "[ . 1 . 2]" 1
323 1 19 ALA MB 1 26 HIS H . . 4.100 3.965 3.650 4.105 0.005 19 0 "[ . 1 . 2]" 1
324 1 19 ALA MB 1 26 HIS HA . . 5.380 5.210 4.824 5.386 0.006 17 0 "[ . 1 . 2]" 1
325 1 19 ALA MB 1 26 HIS HB2 . . 3.470 3.286 2.849 3.468 . 0 0 "[ . 1 . 2]" 1
326 1 19 ALA MB 1 26 HIS HB3 . . 3.190 2.691 2.155 2.971 . 0 0 "[ . 1 . 2]" 1
327 1 20 VAL H 1 20 VAL HB . . 3.960 2.981 2.807 3.189 . 0 0 "[ . 1 . 2]" 1
328 1 20 VAL H 1 20 VAL MG1 . . 3.660 1.921 1.868 1.991 . 0 0 "[ . 1 . 2]" 1
329 1 20 VAL H 1 20 VAL MG2 . . 4.270 3.836 3.748 3.880 . 0 0 "[ . 1 . 2]" 1
330 1 20 VAL H 1 21 THR H . . 4.800 4.196 4.062 4.319 . 0 0 "[ . 1 . 2]" 1
331 1 20 VAL HA 1 20 VAL MG1 . . 3.640 3.192 3.185 3.201 . 0 0 "[ . 1 . 2]" 1
332 1 20 VAL HA 1 20 VAL MG2 . . 3.490 2.331 2.245 2.446 . 0 0 "[ . 1 . 2]" 1
333 1 20 VAL HA 1 21 THR H . . 2.810 2.159 2.143 2.191 . 0 0 "[ . 1 . 2]" 1
334 1 20 VAL HA 1 25 VAL MG2 . . 4.210 4.023 3.942 4.113 . 0 0 "[ . 1 . 2]" 1
335 1 20 VAL HA 1 26 HIS H . . 4.120 3.993 3.842 4.089 . 0 0 "[ . 1 . 2]" 1
336 1 20 VAL HB 1 21 THR H . . 4.470 4.405 4.354 4.446 . 0 0 "[ . 1 . 2]" 1
337 1 20 VAL HB 1 25 VAL MG2 . . 5.500 5.483 5.346 5.517 0.017 17 0 "[ . 1 . 2]" 1
338 1 20 VAL HB 1 96 THR HA . . 4.850 4.612 4.315 4.812 . 0 0 "[ . 1 . 2]" 1
339 1 20 VAL HB 1 97 PRO HD2 . . 5.110 5.073 4.945 5.116 0.006 11 0 "[ . 1 . 2]" 1
340 1 20 VAL HB 1 97 PRO HD3 . . 4.680 4.436 4.310 4.589 . 0 0 "[ . 1 . 2]" 1
341 1 20 VAL MG1 1 21 THR H . . 4.410 4.144 4.095 4.234 . 0 0 "[ . 1 . 2]" 1
342 1 20 VAL MG1 1 96 THR HA . . 4.500 4.243 3.909 4.442 . 0 0 "[ . 1 . 2]" 1
343 1 20 VAL MG1 1 97 PRO HB3 . . 5.340 4.631 4.217 4.868 . 0 0 "[ . 1 . 2]" 1
344 1 20 VAL MG1 1 97 PRO HD2 . . 3.940 3.690 3.509 3.940 . 0 0 "[ . 1 . 2]" 1
345 1 20 VAL MG1 1 97 PRO HD3 . . 3.770 3.008 2.563 3.218 . 0 0 "[ . 1 . 2]" 1
346 1 20 VAL MG1 1 97 PRO QG . . 4.430 3.058 2.836 3.441 . 0 0 "[ . 1 . 2]" 1
347 1 20 VAL MG2 1 21 THR H . . 3.460 3.085 2.913 3.261 . 0 0 "[ . 1 . 2]" 1
348 1 20 VAL MG2 1 26 HIS H . . 5.500 5.474 5.341 5.530 0.030 18 0 "[ . 1 . 2]" 1
349 1 20 VAL MG2 1 96 THR HA . . 3.290 2.085 1.894 2.184 . 0 0 "[ . 1 . 2]" 1
350 1 20 VAL MG2 1 97 PRO HB3 . . 4.810 4.288 4.094 4.437 . 0 0 "[ . 1 . 2]" 1
351 1 20 VAL MG2 1 97 PRO HD2 . . 3.420 2.060 1.970 2.134 . 0 0 "[ . 1 . 2]" 1
352 1 20 VAL MG2 1 97 PRO HD3 . . 3.370 1.876 1.775 1.963 . 0 0 "[ . 1 . 2]" 1
353 1 20 VAL MG2 1 97 PRO HG2 . . 4.130 3.645 3.525 3.855 . 0 0 "[ . 1 . 2]" 1
354 1 20 VAL MG2 1 97 PRO QG . . 3.630 2.953 2.831 3.177 . 0 0 "[ . 1 . 2]" 1
355 1 20 VAL MG2 1 97 PRO HG3 . . 4.130 3.121 2.968 3.382 . 0 0 "[ . 1 . 2]" 1
356 1 21 THR H 1 21 THR MG . . 4.030 3.914 3.876 3.925 . 0 0 "[ . 1 . 2]" 1
357 1 21 THR H 1 23 ARG H . . 4.810 4.610 4.451 4.746 . 0 0 "[ . 1 . 2]" 1
358 1 21 THR H 1 24 THR H . . 4.270 4.092 4.008 4.231 . 0 0 "[ . 1 . 2]" 1
359 1 21 THR H 1 96 THR MG . . 3.810 3.321 3.107 3.610 . 0 0 "[ . 1 . 2]" 1
360 1 21 THR HA 1 21 THR MG . . 3.280 2.182 2.123 2.340 . 0 0 "[ . 1 . 2]" 1
361 1 21 THR HA 1 22 PRO HD2 . . 3.770 2.159 2.138 2.170 . 0 0 "[ . 1 . 2]" 1
362 1 21 THR HA 1 22 PRO HD3 . . 3.430 2.255 2.254 2.256 . 0 0 "[ . 1 . 2]" 1
363 1 21 THR HA 1 22 PRO HG2 . . 4.550 4.320 4.304 4.328 . 0 0 "[ . 1 . 2]" 1
364 1 21 THR HA 1 23 ARG QG . . 4.970 4.565 4.141 4.829 . 0 0 "[ . 1 . 2]" 1
365 1 21 THR HA 1 97 PRO QG . . 4.500 4.088 3.593 4.312 . 0 0 "[ . 1 . 2]" 1
366 1 21 THR MG 1 22 PRO HD2 . . 3.960 1.805 1.792 1.831 . 0 0 "[ . 1 . 2]" 1
367 1 21 THR MG 1 22 PRO HD3 . . 4.060 3.110 3.076 3.179 . 0 0 "[ . 1 . 2]" 1
368 1 21 THR MG 1 23 ARG H . . 4.790 2.098 1.867 2.269 . 0 0 "[ . 1 . 2]" 1
369 1 21 THR MG 1 23 ARG QB . . 4.230 3.146 2.675 3.677 . 0 0 "[ . 1 . 2]" 1
370 1 21 THR MG 1 23 ARG QG . . 4.550 2.186 1.736 2.610 . 0 0 "[ . 1 . 2]" 1
371 1 21 THR MG 1 24 THR H . . 3.930 2.815 2.588 2.975 . 0 0 "[ . 1 . 2]" 1
372 1 22 PRO HA 1 70 PRO HB2 . . 4.930 4.702 4.348 4.936 0.006 8 0 "[ . 1 . 2]" 1
373 1 22 PRO HA 1 70 PRO QB . . 4.170 3.355 2.951 3.595 . 0 0 "[ . 1 . 2]" 1
374 1 22 PRO HA 1 70 PRO HB3 . . 4.930 3.436 2.999 3.694 . 0 0 "[ . 1 . 2]" 1
375 1 22 PRO HA 1 71 GLY H . . 4.580 4.168 3.850 4.514 . 0 0 "[ . 1 . 2]" 1
376 1 22 PRO HA 1 96 THR MG . . 3.830 3.196 2.884 3.494 . 0 0 "[ . 1 . 2]" 1
377 1 22 PRO HB2 1 23 ARG QG . . 4.070 3.619 3.326 4.085 0.015 14 0 "[ . 1 . 2]" 1
378 1 22 PRO HB2 1 70 PRO HA . . 4.580 3.570 3.091 4.018 . 0 0 "[ . 1 . 2]" 1
379 1 22 PRO HB2 1 70 PRO HB2 . . 4.310 3.868 3.533 4.282 . 0 0 "[ . 1 . 2]" 1
380 1 22 PRO HB2 1 70 PRO QB . . 3.520 2.192 1.986 2.574 . 0 0 "[ . 1 . 2]" 1
381 1 22 PRO HB2 1 70 PRO HB3 . . 4.310 2.205 1.996 2.595 . 0 0 "[ . 1 . 2]" 1
382 1 22 PRO HB2 1 70 PRO HG3 . . 4.020 3.772 3.440 4.013 . 0 0 "[ . 1 . 2]" 1
383 1 22 PRO HB2 1 98 THR HA . . 4.670 4.366 3.936 4.673 0.003 5 0 "[ . 1 . 2]" 1
384 1 22 PRO HB2 1 99 SER H . . 4.740 3.535 2.950 3.997 . 0 0 "[ . 1 . 2]" 1
385 1 22 PRO HB2 1 99 SER QB . . 4.760 3.385 2.583 3.919 . 0 0 "[ . 1 . 2]" 1
386 1 22 PRO HB3 1 23 ARG H . . 4.650 4.488 4.430 4.550 . 0 0 "[ . 1 . 2]" 1
387 1 22 PRO HB3 1 70 PRO QB . . 3.860 2.564 2.308 2.819 . 0 0 "[ . 1 . 2]" 1
388 1 22 PRO HB3 1 98 THR HA . . 4.410 3.635 3.237 3.984 . 0 0 "[ . 1 . 2]" 1
389 1 22 PRO HB3 1 99 SER QB . . 4.750 3.672 3.082 4.157 . 0 0 "[ . 1 . 2]" 1
390 1 22 PRO HD2 1 23 ARG H . . 4.380 2.993 2.874 3.153 . 0 0 "[ . 1 . 2]" 1
391 1 22 PRO HD2 1 23 ARG QG . . 3.720 3.062 2.880 3.218 . 0 0 "[ . 1 . 2]" 1
392 1 22 PRO HD3 1 23 ARG H . . 4.720 4.025 3.962 4.110 . 0 0 "[ . 1 . 2]" 1
393 1 22 PRO HD3 1 23 ARG QG . . 4.450 4.411 4.324 4.460 0.010 8 0 "[ . 1 . 2]" 1
394 1 22 PRO HD3 1 97 PRO QG . . 4.250 2.653 2.083 2.965 . 0 0 "[ . 1 . 2]" 1
395 1 22 PRO HG2 1 23 ARG QD . . 4.530 3.876 2.971 4.362 . 0 0 "[ . 1 . 2]" 1
396 1 22 PRO HG2 1 23 ARG QG . . 3.020 2.383 2.199 2.639 . 0 0 "[ . 1 . 2]" 1
397 1 22 PRO HG2 1 99 SER QB . . 4.470 3.433 2.605 4.295 . 0 0 "[ . 1 . 2]" 1
398 1 23 ARG H 1 23 ARG HB2 . . 4.140 3.135 2.817 3.641 . 0 0 "[ . 1 . 2]" 1
399 1 23 ARG H 1 23 ARG QB . . 3.530 2.916 2.742 3.160 . 0 0 "[ . 1 . 2]" 1
400 1 23 ARG H 1 23 ARG HB3 . . 4.140 3.677 3.416 3.829 . 0 0 "[ . 1 . 2]" 1
401 1 23 ARG H 1 23 ARG HG2 . . 4.110 2.918 2.036 3.771 . 0 0 "[ . 1 . 2]" 1
402 1 23 ARG H 1 23 ARG HG3 . . 4.110 2.604 2.287 3.688 . 0 0 "[ . 1 . 2]" 1
403 1 23 ARG H 1 24 THR H . . 2.970 1.853 1.791 1.980 . 0 0 "[ . 1 . 2]" 1
404 1 23 ARG H 1 24 THR HA . . 4.980 4.572 4.500 4.650 . 0 0 "[ . 1 . 2]" 1
405 1 23 ARG H 1 24 THR MG . . 4.220 3.885 3.656 4.129 . 0 0 "[ . 1 . 2]" 1
406 1 23 ARG HA 1 23 ARG QD . . 4.780 3.972 2.545 4.527 . 0 0 "[ . 1 . 2]" 1
407 1 23 ARG HA 1 23 ARG HG2 . . 4.040 3.150 2.772 3.630 . 0 0 "[ . 1 . 2]" 1
408 1 23 ARG HA 1 23 ARG QG . . 3.450 2.942 2.656 3.281 . 0 0 "[ . 1 . 2]" 1
409 1 23 ARG HA 1 23 ARG HG3 . . 4.040 3.570 3.139 3.955 . 0 0 "[ . 1 . 2]" 1
410 1 23 ARG HA 1 68 LEU H . . 3.960 3.184 2.791 3.485 . 0 0 "[ . 1 . 2]" 1
411 1 23 ARG HA 1 68 LEU HB2 . . 4.070 3.687 3.278 3.936 . 0 0 "[ . 1 . 2]" 1
412 1 23 ARG HA 1 68 LEU HB3 . . 5.450 5.122 4.426 5.437 . 0 0 "[ . 1 . 2]" 1
413 1 23 ARG HA 1 68 LEU QD . . 4.960 4.676 4.424 4.962 0.002 3 0 "[ . 1 . 2]" 1
414 1 23 ARG QB 1 23 ARG QD . . 3.080 2.218 2.079 2.650 . 0 0 "[ . 1 . 2]" 1
415 1 23 ARG QB 1 24 THR H . . 4.170 3.126 2.740 3.658 . 0 0 "[ . 1 . 2]" 1
416 1 23 ARG QB 1 67 GLY H . . 4.510 4.145 3.835 4.503 . 0 0 "[ . 1 . 2]" 1
417 1 23 ARG QB 1 68 LEU H . . 4.280 4.087 3.597 4.287 0.007 14 0 "[ . 1 . 2]" 1
418 1 23 ARG HB2 1 23 ARG HD2 . . 4.150 2.838 2.249 3.772 . 0 0 "[ . 1 . 2]" 1
419 1 23 ARG HB2 1 23 ARG HD3 . . 4.150 3.382 2.372 4.207 0.057 3 0 "[ . 1 . 2]" 1
420 1 23 ARG HB2 1 24 THR H . . 4.810 3.242 2.788 3.894 . 0 0 "[ . 1 . 2]" 1
421 1 23 ARG HB2 1 24 THR MG . . 4.160 2.423 2.187 2.657 . 0 0 "[ . 1 . 2]" 1
422 1 23 ARG HB3 1 23 ARG HD2 . . 4.150 2.817 2.222 3.750 . 0 0 "[ . 1 . 2]" 1
423 1 23 ARG HB3 1 23 ARG HD3 . . 4.150 3.126 2.540 3.718 . 0 0 "[ . 1 . 2]" 1
424 1 23 ARG HB3 1 24 THR H . . 4.810 4.210 4.031 4.440 . 0 0 "[ . 1 . 2]" 1
425 1 23 ARG HB3 1 24 THR MG . . 4.160 3.529 3.150 4.101 . 0 0 "[ . 1 . 2]" 1
426 1 23 ARG QG 1 24 THR H . . 5.050 3.360 2.540 3.745 . 0 0 "[ . 1 . 2]" 1
427 1 23 ARG QG 1 24 THR MG . . 4.690 3.592 2.512 4.273 . 0 0 "[ . 1 . 2]" 1
428 1 24 THR H 1 24 THR MG . . 3.810 2.864 2.684 3.057 . 0 0 "[ . 1 . 2]" 1
429 1 24 THR H 1 25 VAL H . . 4.580 4.384 4.335 4.423 . 0 0 "[ . 1 . 2]" 1
430 1 24 THR H 1 96 THR MG . . 5.060 4.498 4.149 4.789 . 0 0 "[ . 1 . 2]" 1
431 1 24 THR HA 1 24 THR MG . . 3.290 2.485 2.396 2.605 . 0 0 "[ . 1 . 2]" 1
432 1 24 THR HA 1 25 VAL H . . 2.970 2.332 2.237 2.387 . 0 0 "[ . 1 . 2]" 1
433 1 24 THR HA 1 25 VAL MG2 . . 4.500 3.654 3.400 3.799 . 0 0 "[ . 1 . 2]" 1
434 1 24 THR HA 1 64 LEU MD1 . . 4.550 3.919 3.597 4.171 . 0 0 "[ . 1 . 2]" 1
435 1 24 THR HA 1 65 LEU HB3 . . 5.500 5.150 4.689 5.500 . 0 0 "[ . 1 . 2]" 1
436 1 24 THR HA 1 66 ASP HA . . 3.530 2.824 2.502 3.071 . 0 0 "[ . 1 . 2]" 1
437 1 24 THR HA 1 68 LEU H . . 4.700 3.878 3.030 4.229 . 0 0 "[ . 1 . 2]" 1
438 1 24 THR HA 1 68 LEU HB3 . . 5.500 4.894 4.450 5.346 . 0 0 "[ . 1 . 2]" 1
439 1 24 THR HA 1 68 LEU QD . . 3.870 2.346 1.986 2.836 . 0 0 "[ . 1 . 2]" 1
440 1 24 THR HA 1 68 LEU HG . . 4.800 3.294 2.888 3.814 . 0 0 "[ . 1 . 2]" 1
441 1 24 THR HA 1 96 THR MG . . 5.390 5.226 4.993 5.392 0.002 9 0 "[ . 1 . 2]" 1
442 1 24 THR HB 1 25 VAL H . . 3.380 2.645 2.449 2.874 . 0 0 "[ . 1 . 2]" 1
443 1 24 THR HB 1 64 LEU MD1 . . 3.430 2.137 1.954 2.440 . 0 0 "[ . 1 . 2]" 1
444 1 24 THR HB 1 64 LEU MD2 . . 4.060 3.850 3.566 4.061 0.001 10 0 "[ . 1 . 2]" 1
445 1 24 THR HB 1 64 LEU HG . . 4.670 3.426 3.231 3.743 . 0 0 "[ . 1 . 2]" 1
446 1 24 THR HB 1 66 ASP HA . . 4.440 2.718 2.054 3.479 . 0 0 "[ . 1 . 2]" 1
447 1 24 THR MG 1 25 VAL H . . 4.040 3.932 3.765 4.047 0.007 5 0 "[ . 1 . 2]" 1
448 1 24 THR MG 1 64 LEU MD1 . . 3.470 3.355 3.122 3.460 . 0 0 "[ . 1 . 2]" 1
449 1 24 THR MG 1 66 ASP H . . 4.800 4.568 4.254 4.757 . 0 0 "[ . 1 . 2]" 1
450 1 24 THR MG 1 66 ASP HA . . 3.140 2.099 1.976 2.371 . 0 0 "[ . 1 . 2]" 1
451 1 24 THR MG 1 66 ASP HB2 . . 3.550 2.994 2.404 3.479 . 0 0 "[ . 1 . 2]" 1
452 1 24 THR MG 1 66 ASP HB3 . . 3.550 3.024 2.354 3.536 . 0 0 "[ . 1 . 2]" 1
453 1 24 THR MG 1 67 GLY H . . 3.900 2.486 1.910 2.965 . 0 0 "[ . 1 . 2]" 1
454 1 24 THR MG 1 68 LEU H . . 5.240 3.965 3.595 4.331 . 0 0 "[ . 1 . 2]" 1
455 1 25 VAL H 1 25 VAL HB . . 3.620 2.577 2.428 2.706 . 0 0 "[ . 1 . 2]" 1
456 1 25 VAL H 1 25 VAL MG1 . . 4.410 3.763 3.711 3.847 . 0 0 "[ . 1 . 2]" 1
457 1 25 VAL H 1 25 VAL MG2 . . 3.680 3.028 2.791 3.185 . 0 0 "[ . 1 . 2]" 1
458 1 25 VAL H 1 64 LEU MD1 . . 4.330 2.862 2.470 3.466 . 0 0 "[ . 1 . 2]" 1
459 1 25 VAL H 1 64 LEU HG . . 4.940 4.537 4.123 4.929 . 0 0 "[ . 1 . 2]" 1
460 1 25 VAL H 1 65 LEU H . . 3.790 3.046 2.717 3.310 . 0 0 "[ . 1 . 2]" 1
461 1 25 VAL H 1 65 LEU HB2 . . 3.930 2.917 2.616 3.248 . 0 0 "[ . 1 . 2]" 1
462 1 25 VAL H 1 65 LEU HB3 . . 5.250 4.300 3.775 4.592 . 0 0 "[ . 1 . 2]" 1
463 1 25 VAL H 1 66 ASP HA . . 4.330 3.919 3.569 4.193 . 0 0 "[ . 1 . 2]" 1
464 1 25 VAL H 1 68 LEU QD . . 3.910 2.386 1.825 2.988 . 0 0 "[ . 1 . 2]" 1
465 1 25 VAL H 1 68 LEU HG . . 4.770 4.149 2.741 4.565 . 0 0 "[ . 1 . 2]" 1
466 1 25 VAL HA 1 25 VAL MG1 . . 3.410 2.491 2.420 2.539 . 0 0 "[ . 1 . 2]" 1
467 1 25 VAL HA 1 25 VAL MG2 . . 3.390 2.322 2.269 2.420 . 0 0 "[ . 1 . 2]" 1
468 1 25 VAL HA 1 26 HIS H . . 2.940 2.148 2.141 2.164 . 0 0 "[ . 1 . 2]" 1
469 1 25 VAL HA 1 26 HIS HB3 . . 4.840 4.777 4.582 4.840 0.000 9 0 "[ . 1 . 2]" 1
470 1 25 VAL HB 1 26 HIS H . . 4.410 4.315 4.173 4.419 0.009 10 0 "[ . 1 . 2]" 1
471 1 25 VAL HB 1 65 LEU H . . 4.870 3.418 3.244 3.637 . 0 0 "[ . 1 . 2]" 1
472 1 25 VAL HB 1 65 LEU HB3 . . 4.560 4.111 3.678 4.462 . 0 0 "[ . 1 . 2]" 1
473 1 25 VAL HB 1 68 LEU MD1 . . 4.320 2.315 2.156 2.851 . 0 0 "[ . 1 . 2]" 1
474 1 25 VAL HB 1 68 LEU QD . . 3.500 2.296 2.142 2.707 . 0 0 "[ . 1 . 2]" 1
475 1 25 VAL HB 1 68 LEU MD2 . . 4.320 4.046 3.373 4.298 . 0 0 "[ . 1 . 2]" 1
476 1 25 VAL HB 1 68 LEU HG . . 5.500 4.691 2.777 5.092 . 0 0 "[ . 1 . 2]" 1
477 1 25 VAL HB 1 74 TYR QD . . 5.500 5.320 5.178 5.442 . 0 0 "[ . 1 . 2]" 1
478 1 25 VAL HB 1 96 THR MG . . 4.710 4.630 4.390 4.715 0.005 3 0 "[ . 1 . 2]" 1
479 1 25 VAL MG1 1 26 HIS H . . 3.640 2.606 2.345 2.912 . 0 0 "[ . 1 . 2]" 1
480 1 25 VAL MG1 1 26 HIS HA . . 4.690 3.534 3.413 3.621 . 0 0 "[ . 1 . 2]" 1
481 1 25 VAL MG1 1 27 LEU HA . . 4.880 4.409 4.288 4.618 . 0 0 "[ . 1 . 2]" 1
482 1 25 VAL MG1 1 27 LEU HB2 . . 3.730 3.200 3.043 3.402 . 0 0 "[ . 1 . 2]" 1
483 1 25 VAL MG1 1 65 LEU H . . 4.620 3.691 3.428 4.148 . 0 0 "[ . 1 . 2]" 1
484 1 25 VAL MG2 1 26 HIS H . . 4.300 3.870 3.757 4.001 . 0 0 "[ . 1 . 2]" 1
485 1 25 VAL MG2 1 65 LEU HG . . 5.330 5.210 4.952 5.331 0.001 5 0 "[ . 1 . 2]" 1
486 1 25 VAL MG2 1 68 LEU MD1 . . 4.280 1.820 1.706 2.087 . 0 0 "[ . 1 . 2]" 1
487 1 25 VAL MG2 1 68 LEU QD . . 3.000 1.814 1.702 2.070 . 0 0 "[ . 1 . 2]" 1
488 1 25 VAL MG2 1 68 LEU MD2 . . 4.280 3.542 3.131 3.731 . 0 0 "[ . 1 . 2]" 1
489 1 25 VAL MG2 1 96 THR MG . . 3.330 2.223 2.060 2.322 . 0 0 "[ . 1 . 2]" 1
490 1 26 HIS H 1 26 HIS HB2 . . 3.660 2.835 2.753 3.032 . 0 0 "[ . 1 . 2]" 1
491 1 26 HIS H 1 26 HIS HB3 . . 3.510 2.741 2.595 2.842 . 0 0 "[ . 1 . 2]" 1
492 1 26 HIS HA 1 26 HIS HD2 . . 3.530 2.457 2.201 2.843 . 0 0 "[ . 1 . 2]" 1
493 1 26 HIS HA 1 27 LEU H . . 2.980 2.154 2.140 2.230 . 0 0 "[ . 1 . 2]" 1
494 1 26 HIS HA 1 27 LEU HA . . 4.630 4.400 4.392 4.443 . 0 0 "[ . 1 . 2]" 1
495 1 26 HIS HA 1 63 VAL H . . 5.250 4.840 4.533 5.133 . 0 0 "[ . 1 . 2]" 1
496 1 26 HIS HA 1 63 VAL MG1 . . 4.590 4.145 3.816 4.482 . 0 0 "[ . 1 . 2]" 1
497 1 26 HIS HA 1 64 LEU HA . . 3.440 2.350 2.196 2.512 . 0 0 "[ . 1 . 2]" 1
498 1 26 HIS HA 1 64 LEU QB . . 4.840 3.336 3.090 3.564 . 0 0 "[ . 1 . 2]" 1
499 1 26 HIS HA 1 64 LEU MD1 . . 3.850 2.426 2.210 2.735 . 0 0 "[ . 1 . 2]" 1
500 1 26 HIS HA 1 64 LEU MD2 . . 4.800 4.692 4.510 4.802 0.002 19 0 "[ . 1 . 2]" 1
501 1 26 HIS HA 1 65 LEU H . . 4.020 3.652 3.478 3.930 . 0 0 "[ . 1 . 2]" 1
502 1 26 HIS HB2 1 27 LEU H . . 4.440 4.348 4.158 4.448 0.008 19 0 "[ . 1 . 2]" 1
503 1 26 HIS HB2 1 64 LEU MD1 . . 3.480 2.204 1.962 2.524 . 0 0 "[ . 1 . 2]" 1
504 1 26 HIS HB2 1 64 LEU MD2 . . 4.080 3.908 3.653 4.065 . 0 0 "[ . 1 . 2]" 1
505 1 26 HIS HB3 1 27 LEU H . . 4.980 4.088 3.806 4.275 . 0 0 "[ . 1 . 2]" 1
506 1 26 HIS HB3 1 64 LEU MD1 . . 4.260 3.637 3.438 3.925 . 0 0 "[ . 1 . 2]" 1
507 1 26 HIS HB3 1 64 LEU MD2 . . 5.500 5.296 5.065 5.449 . 0 0 "[ . 1 . 2]" 1
508 1 26 HIS HD2 1 27 LEU H . . 3.540 2.099 1.901 2.445 . 0 0 "[ . 1 . 2]" 1
509 1 26 HIS HD2 1 28 THR MG . . 4.130 3.262 2.400 3.947 . 0 0 "[ . 1 . 2]" 1
510 1 26 HIS HD2 1 62 GLU HB2 . . 3.910 3.534 3.208 3.903 . 0 0 "[ . 1 . 2]" 1
511 1 26 HIS HD2 1 62 GLU QG . . 5.020 4.803 4.292 5.017 . 0 0 "[ . 1 . 2]" 1
512 1 26 HIS HD2 1 63 VAL H . . 3.930 3.428 2.911 3.833 . 0 0 "[ . 1 . 2]" 1
513 1 26 HIS HD2 1 64 LEU HA . . 4.470 3.559 2.766 4.388 . 0 0 "[ . 1 . 2]" 1
514 1 26 HIS HD2 1 64 LEU QB . . 4.740 3.331 2.469 4.180 . 0 0 "[ . 1 . 2]" 1
515 1 26 HIS HD2 1 64 LEU MD1 . . 4.680 3.834 3.269 4.398 . 0 0 "[ . 1 . 2]" 1
516 1 26 HIS HE1 1 28 THR MG . . 4.390 3.875 2.927 4.391 0.001 12 0 "[ . 1 . 2]" 1
517 1 26 HIS HE1 1 62 GLU HB2 . . 5.060 4.332 3.948 4.982 . 0 0 "[ . 1 . 2]" 1
518 1 26 HIS HE1 1 62 GLU QG . . 5.500 4.780 3.792 5.296 . 0 0 "[ . 1 . 2]" 1
519 1 27 LEU H 1 27 LEU HB2 . . 3.920 2.855 2.636 3.168 . 0 0 "[ . 1 . 2]" 1
520 1 27 LEU H 1 27 LEU HB3 . . 3.940 2.860 2.701 2.985 . 0 0 "[ . 1 . 2]" 1
521 1 27 LEU H 1 27 LEU MD1 . . 4.710 4.202 4.045 4.357 . 0 0 "[ . 1 . 2]" 1
522 1 27 LEU H 1 27 LEU MD2 . . 4.710 4.401 4.008 4.662 . 0 0 "[ . 1 . 2]" 1
523 1 27 LEU H 1 27 LEU HG . . 5.410 4.701 4.548 4.931 . 0 0 "[ . 1 . 2]" 1
524 1 27 LEU H 1 28 THR MG . . 4.880 3.876 3.688 4.070 . 0 0 "[ . 1 . 2]" 1
525 1 27 LEU H 1 62 GLU HB2 . . 5.500 4.783 4.411 5.191 . 0 0 "[ . 1 . 2]" 1
526 1 27 LEU H 1 63 VAL MG1 . . 3.780 2.995 2.595 3.490 . 0 0 "[ . 1 . 2]" 1
527 1 27 LEU H 1 64 LEU HA . . 4.210 3.552 3.377 3.678 . 0 0 "[ . 1 . 2]" 1
528 1 27 LEU HA 1 27 LEU MD1 . . 4.130 2.279 1.995 2.887 . 0 0 "[ . 1 . 2]" 1
529 1 27 LEU HA 1 27 LEU QD . . 3.510 2.122 1.942 2.489 . 0 0 "[ . 1 . 2]" 1
530 1 27 LEU HA 1 27 LEU MD2 . . 4.130 3.418 1.974 3.898 . 0 0 "[ . 1 . 2]" 1
531 1 27 LEU HA 1 28 THR H . . 2.860 2.269 2.176 2.335 . 0 0 "[ . 1 . 2]" 1
532 1 27 LEU HA 1 28 THR MG . . 4.380 3.545 3.374 3.823 . 0 0 "[ . 1 . 2]" 1
533 1 27 LEU HB2 1 27 LEU MD1 . . 3.640 2.483 2.062 3.182 . 0 0 "[ . 1 . 2]" 1
534 1 27 LEU HB2 1 27 LEU QD . . 3.120 2.125 1.979 2.338 . 0 0 "[ . 1 . 2]" 1
535 1 27 LEU HB2 1 27 LEU MD2 . . 3.640 2.426 2.258 2.568 . 0 0 "[ . 1 . 2]" 1
536 1 27 LEU HB2 1 28 THR H . . 4.390 4.125 3.972 4.336 . 0 0 "[ . 1 . 2]" 1
537 1 27 LEU HB2 1 29 TRP HE3 . . 5.140 4.952 4.786 5.069 . 0 0 "[ . 1 . 2]" 1
538 1 27 LEU HB2 1 29 TRP HZ3 . . 4.320 4.121 3.874 4.325 0.005 7 0 "[ . 1 . 2]" 1
539 1 27 LEU HB2 1 63 VAL H . . 4.960 4.713 4.433 4.962 0.002 8 0 "[ . 1 . 2]" 1
540 1 27 LEU HB2 1 63 VAL MG1 . . 3.800 3.275 2.825 3.700 . 0 0 "[ . 1 . 2]" 1
541 1 27 LEU HB3 1 28 THR H . . 3.980 3.632 3.409 3.786 . 0 0 "[ . 1 . 2]" 1
542 1 27 LEU HB3 1 29 TRP HE3 . . 4.140 3.521 3.318 3.815 . 0 0 "[ . 1 . 2]" 1
543 1 27 LEU HB3 1 29 TRP HZ3 . . 3.940 2.518 2.182 2.760 . 0 0 "[ . 1 . 2]" 1
544 1 27 LEU HB3 1 63 VAL MG1 . . 3.590 2.390 1.939 2.711 . 0 0 "[ . 1 . 2]" 1
545 1 27 LEU HB3 1 78 VAL MG2 . . 5.140 4.450 3.905 4.904 . 0 0 "[ . 1 . 2]" 1
546 1 27 LEU QD 1 29 TRP HE3 . . 4.020 2.335 1.791 2.911 . 0 0 "[ . 1 . 2]" 1
547 1 27 LEU QD 1 29 TRP HZ3 . . 3.940 2.586 2.093 3.180 . 0 0 "[ . 1 . 2]" 1
548 1 27 LEU MD1 1 28 THR H . . 3.970 2.597 1.812 3.390 . 0 0 "[ . 1 . 2]" 1
549 1 27 LEU MD1 1 29 TRP HE3 . . 4.810 3.674 1.793 4.657 . 0 0 "[ . 1 . 2]" 1
550 1 27 LEU MD1 1 29 TRP HZ3 . . 5.230 4.272 2.835 4.916 . 0 0 "[ . 1 . 2]" 1
551 1 27 LEU MD2 1 28 THR H . . 3.970 3.650 2.462 3.946 . 0 0 "[ . 1 . 2]" 1
552 1 27 LEU MD2 1 29 TRP HE3 . . 4.810 3.004 2.158 4.650 . 0 0 "[ . 1 . 2]" 1
553 1 27 LEU MD2 1 29 TRP HZ3 . . 5.230 3.066 2.096 5.071 . 0 0 "[ . 1 . 2]" 1
554 1 27 LEU HG 1 28 THR H . . 4.370 2.727 2.024 4.377 0.007 19 0 "[ . 1 . 2]" 1
555 1 27 LEU HG 1 29 TRP HE3 . . 3.880 3.015 2.198 3.883 0.003 3 0 "[ . 1 . 2]" 1
556 1 27 LEU HG 1 29 TRP HZ3 . . 4.310 3.671 2.962 4.085 . 0 0 "[ . 1 . 2]" 1
557 1 27 LEU HG 1 63 VAL MG1 . . 4.740 4.312 3.743 4.649 . 0 0 "[ . 1 . 2]" 1
558 1 27 LEU HG 1 78 VAL MG2 . . 5.080 4.448 3.608 4.972 . 0 0 "[ . 1 . 2]" 1
559 1 28 THR H 1 28 THR MG . . 3.850 3.053 2.915 3.274 . 0 0 "[ . 1 . 2]" 1
560 1 28 THR H 1 29 TRP H . . 4.640 4.284 4.176 4.424 . 0 0 "[ . 1 . 2]" 1
561 1 28 THR H 1 29 TRP HE3 . . 4.500 3.882 3.620 4.166 . 0 0 "[ . 1 . 2]" 1
562 1 28 THR H 1 62 GLU HA . . 4.950 4.781 4.632 4.931 . 0 0 "[ . 1 . 2]" 1
563 1 28 THR HA 1 28 THR MG . . 3.280 2.350 2.185 2.451 . 0 0 "[ . 1 . 2]" 1
564 1 28 THR HA 1 29 TRP H . . 2.930 2.185 2.153 2.259 . 0 0 "[ . 1 . 2]" 1
565 1 28 THR HA 1 29 TRP HE3 . . 4.280 3.582 3.209 3.894 . 0 0 "[ . 1 . 2]" 1
566 1 28 THR HA 1 29 TRP HZ3 . . 4.910 4.477 3.929 4.900 . 0 0 "[ . 1 . 2]" 1
567 1 28 THR HA 1 61 PRO HG2 . . 5.500 5.011 4.831 5.168 . 0 0 "[ . 1 . 2]" 1
568 1 28 THR HA 1 62 GLU H . . 4.930 4.772 4.672 4.870 . 0 0 "[ . 1 . 2]" 1
569 1 28 THR HA 1 62 GLU HA . . 3.260 2.377 2.244 2.504 . 0 0 "[ . 1 . 2]" 1
570 1 28 THR HA 1 62 GLU HB2 . . 3.810 3.679 3.455 3.812 0.002 5 0 "[ . 1 . 2]" 1
571 1 28 THR HA 1 63 VAL H . . 4.170 3.812 3.603 4.047 . 0 0 "[ . 1 . 2]" 1
572 1 28 THR HB 1 29 TRP H . . 3.330 3.075 2.776 3.255 . 0 0 "[ . 1 . 2]" 1
573 1 28 THR HB 1 62 GLU HB2 . . 4.590 4.382 4.016 4.593 0.003 7 0 "[ . 1 . 2]" 1
574 1 28 THR MG 1 29 TRP H . . 4.030 3.911 3.655 4.021 . 0 0 "[ . 1 . 2]" 1
575 1 28 THR MG 1 62 GLU HA . . 3.950 2.891 2.470 3.145 . 0 0 "[ . 1 . 2]" 1
576 1 28 THR MG 1 62 GLU HB2 . . 3.130 2.187 1.946 2.380 . 0 0 "[ . 1 . 2]" 1
577 1 28 THR MG 1 62 GLU HB3 . . 3.890 2.290 2.013 2.911 . 0 0 "[ . 1 . 2]" 1
578 1 28 THR MG 1 62 GLU QG . . 3.970 3.758 3.530 3.958 . 0 0 "[ . 1 . 2]" 1
579 1 28 THR MG 1 63 VAL H . . 4.310 3.879 3.494 4.272 . 0 0 "[ . 1 . 2]" 1
580 1 29 TRP H 1 29 TRP HD1 . . 4.510 4.079 3.962 4.165 . 0 0 "[ . 1 . 2]" 1
581 1 29 TRP H 1 29 TRP HE3 . . 4.440 3.441 3.189 3.771 . 0 0 "[ . 1 . 2]" 1
582 1 29 TRP H 1 30 GLN HA . . 5.090 4.975 4.812 5.093 0.003 10 0 "[ . 1 . 2]" 1
583 1 29 TRP H 1 61 PRO HG2 . . 4.180 4.112 3.957 4.186 0.006 20 0 "[ . 1 . 2]" 1
584 1 29 TRP H 1 61 PRO HG3 . . 5.220 5.037 4.871 5.165 . 0 0 "[ . 1 . 2]" 1
585 1 29 TRP H 1 62 GLU HA . . 4.440 3.669 3.531 3.817 . 0 0 "[ . 1 . 2]" 1
586 1 29 TRP HA 1 30 GLN H . . 3.250 2.581 2.516 2.654 . 0 0 "[ . 1 . 2]" 1
587 1 29 TRP HA 1 61 PRO QB . . 5.140 4.567 4.436 4.699 . 0 0 "[ . 1 . 2]" 1
588 1 29 TRP HB2 1 30 GLN H . . 3.300 2.075 1.935 2.195 . 0 0 "[ . 1 . 2]" 1
589 1 29 TRP HB3 1 29 TRP HE3 . . 3.940 2.517 2.456 2.577 . 0 0 "[ . 1 . 2]" 1
590 1 29 TRP HB3 1 30 GLN H . . 3.620 3.528 3.418 3.615 . 0 0 "[ . 1 . 2]" 1
591 1 29 TRP HD1 1 30 GLN H . . 4.210 3.289 3.061 3.515 . 0 0 "[ . 1 . 2]" 1
592 1 29 TRP HD1 1 31 PRO HA . . 4.120 3.599 3.386 4.105 . 0 0 "[ . 1 . 2]" 1
593 1 29 TRP HD1 1 61 PRO HA . . 4.720 3.945 3.777 4.282 . 0 0 "[ . 1 . 2]" 1
594 1 29 TRP HD1 1 61 PRO HG2 . . 5.450 5.311 4.959 5.451 0.001 18 0 "[ . 1 . 2]" 1
595 1 29 TRP HD1 1 61 PRO HG3 . . 5.020 4.825 4.428 4.981 . 0 0 "[ . 1 . 2]" 1
596 1 29 TRP HD1 1 78 VAL MG1 . . 4.900 3.923 3.517 4.339 . 0 0 "[ . 1 . 2]" 1
597 1 29 TRP HE1 1 38 TYR QD . . 3.880 3.319 2.768 3.819 . 0 0 "[ . 1 . 2]" 1
598 1 29 TRP HE1 1 38 TYR QE . . 4.620 3.763 3.124 4.443 . 0 0 "[ . 1 . 2]" 1
599 1 29 TRP HE1 1 58 VAL MG2 . . 5.290 4.702 4.376 4.967 . 0 0 "[ . 1 . 2]" 1
600 1 29 TRP HE1 1 61 PRO HA . . 3.670 2.105 1.939 2.380 . 0 0 "[ . 1 . 2]" 1
601 1 29 TRP HE1 1 61 PRO HG2 . . 5.270 5.211 4.934 5.274 0.004 14 0 "[ . 1 . 2]" 1
602 1 29 TRP HE1 1 61 PRO HG3 . . 4.930 4.864 4.572 4.931 0.001 15 0 "[ . 1 . 2]" 1
603 1 29 TRP HE1 1 78 VAL MG1 . . 4.530 3.007 2.639 3.412 . 0 0 "[ . 1 . 2]" 1
604 1 29 TRP HE3 1 62 GLU HA . . 4.800 4.501 4.361 4.751 . 0 0 "[ . 1 . 2]" 1
605 1 29 TRP HE3 1 63 VAL MG1 . . 4.270 4.127 3.884 4.271 0.001 3 0 "[ . 1 . 2]" 1
606 1 29 TRP HE3 1 78 VAL MG1 . . 5.480 4.203 3.859 4.702 . 0 0 "[ . 1 . 2]" 1
607 1 29 TRP HE3 1 78 VAL MG2 . . 4.360 2.960 2.730 3.318 . 0 0 "[ . 1 . 2]" 1
608 1 29 TRP HH2 1 40 VAL MG1 . . 4.790 3.660 3.411 3.894 . 0 0 "[ . 1 . 2]" 1
609 1 29 TRP HH2 1 40 VAL MG2 . . 3.360 2.054 1.828 2.413 . 0 0 "[ . 1 . 2]" 1
610 1 29 TRP HH2 1 58 VAL MG1 . . 4.500 4.192 3.686 4.468 . 0 0 "[ . 1 . 2]" 1
611 1 29 TRP HH2 1 58 VAL MG2 . . 3.380 2.912 2.568 3.349 . 0 0 "[ . 1 . 2]" 1
612 1 29 TRP HH2 1 62 GLU H . . 5.500 5.212 5.022 5.454 . 0 0 "[ . 1 . 2]" 1
613 1 29 TRP HH2 1 63 VAL HB . . 3.610 2.582 2.078 2.936 . 0 0 "[ . 1 . 2]" 1
614 1 29 TRP HH2 1 63 VAL MG1 . . 3.460 2.451 2.212 3.097 . 0 0 "[ . 1 . 2]" 1
615 1 29 TRP HH2 1 63 VAL MG2 . . 4.410 3.934 3.534 4.229 . 0 0 "[ . 1 . 2]" 1
616 1 29 TRP HZ2 1 38 TYR HB2 . . 3.830 2.764 2.311 3.347 . 0 0 "[ . 1 . 2]" 1
617 1 29 TRP HZ2 1 38 TYR QB . . 3.340 2.631 2.263 2.996 . 0 0 "[ . 1 . 2]" 1
618 1 29 TRP HZ2 1 38 TYR HB3 . . 3.830 3.395 2.644 3.830 . 0 0 "[ . 1 . 2]" 1
619 1 29 TRP HZ2 1 38 TYR QD . . 4.260 3.515 2.877 4.096 . 0 0 "[ . 1 . 2]" 1
620 1 29 TRP HZ2 1 40 VAL MG2 . . 3.800 3.157 2.910 3.342 . 0 0 "[ . 1 . 2]" 1
621 1 29 TRP HZ2 1 58 VAL H . . 5.500 5.424 5.247 5.505 0.005 14 0 "[ . 1 . 2]" 1
622 1 29 TRP HZ2 1 58 VAL MG1 . . 5.020 4.897 4.435 5.030 0.010 18 0 "[ . 1 . 2]" 1
623 1 29 TRP HZ2 1 58 VAL MG2 . . 3.350 2.748 2.481 3.029 . 0 0 "[ . 1 . 2]" 1
624 1 29 TRP HZ2 1 61 PRO HA . . 3.520 2.514 2.346 2.729 . 0 0 "[ . 1 . 2]" 1
625 1 29 TRP HZ2 1 62 GLU H . . 4.690 4.664 4.540 4.699 0.009 3 0 "[ . 1 . 2]" 1
626 1 29 TRP HZ2 1 63 VAL MG1 . . 5.380 4.528 4.292 5.061 . 0 0 "[ . 1 . 2]" 1
627 1 29 TRP HZ2 1 78 VAL MG1 . . 4.050 2.676 2.446 2.954 . 0 0 "[ . 1 . 2]" 1
628 1 29 TRP HZ3 1 40 VAL MG2 . . 4.620 3.494 3.040 3.997 . 0 0 "[ . 1 . 2]" 1
629 1 29 TRP HZ3 1 62 GLU HA . . 4.450 4.154 3.895 4.462 0.012 19 0 "[ . 1 . 2]" 1
630 1 29 TRP HZ3 1 63 VAL H . . 4.120 3.433 3.021 3.797 . 0 0 "[ . 1 . 2]" 1
631 1 29 TRP HZ3 1 63 VAL MG1 . . 3.080 2.113 1.972 2.342 . 0 0 "[ . 1 . 2]" 1
632 1 29 TRP HZ3 1 78 VAL MG2 . . 4.460 2.711 2.388 3.066 . 0 0 "[ . 1 . 2]" 1
633 1 30 GLN H 1 30 GLN HB2 . . 3.680 2.225 2.182 2.379 . 0 0 "[ . 1 . 2]" 1
634 1 30 GLN H 1 30 GLN QB . . 3.100 2.202 2.161 2.347 . 0 0 "[ . 1 . 2]" 1
635 1 30 GLN H 1 30 GLN HB3 . . 3.680 3.507 3.480 3.593 . 0 0 "[ . 1 . 2]" 1
636 1 30 GLN H 1 30 GLN HG2 . . 4.210 3.413 2.833 4.210 . 0 0 "[ . 1 . 2]" 1
637 1 30 GLN H 1 30 GLN QG . . 3.660 2.967 2.505 3.164 . 0 0 "[ . 1 . 2]" 1
638 1 30 GLN H 1 30 GLN HG3 . . 4.210 3.579 2.593 4.226 0.016 18 0 "[ . 1 . 2]" 1
639 1 30 GLN HA 1 30 GLN QG . . 3.740 2.404 2.138 2.818 . 0 0 "[ . 1 . 2]" 1
640 1 30 GLN HA 1 31 PRO HD2 . . 3.220 2.178 2.034 2.242 . 0 0 "[ . 1 . 2]" 1
641 1 30 GLN HA 1 31 PRO HD3 . . 3.220 2.256 2.251 2.283 . 0 0 "[ . 1 . 2]" 1
642 1 30 GLN HA 1 31 PRO QG . . 4.320 3.872 3.801 3.907 . 0 0 "[ . 1 . 2]" 1
643 1 30 GLN QB 1 31 PRO QD . . 3.230 2.670 2.423 3.041 . 0 0 "[ . 1 . 2]" 1
644 1 30 GLN QG 1 31 PRO QD . . 4.470 3.171 2.556 3.674 . 0 0 "[ . 1 . 2]" 1
645 1 31 PRO HA 1 32 SER H . . 3.000 2.252 2.158 2.507 . 0 0 "[ . 1 . 2]" 1
646 1 31 PRO HA 1 38 TYR QE . . 4.780 3.542 3.019 3.969 . 0 0 "[ . 1 . 2]" 1
647 1 31 PRO HA 1 61 PRO HG2 . . 5.500 5.051 4.217 5.500 . 12 0 "[ . 1 . 2]" 1
648 1 31 PRO HA 1 61 PRO HG3 . . 4.520 3.519 2.538 4.079 . 0 0 "[ . 1 . 2]" 1
649 1 31 PRO HB2 1 32 SER H . . 4.170 3.096 2.358 3.492 . 0 0 "[ . 1 . 2]" 1
650 1 31 PRO HB2 1 32 SER QB . . 5.120 4.898 4.529 5.129 0.009 5 0 "[ . 1 . 2]" 1
651 1 31 PRO HB3 1 32 SER H . . 3.990 3.731 3.330 3.973 . 0 0 "[ . 1 . 2]" 1
652 1 32 SER H 1 32 SER QB . . 3.260 2.343 2.184 2.902 . 0 0 "[ . 1 . 2]" 1
653 1 32 SER H 1 35 ALA MB . . 4.210 3.733 2.975 4.220 0.010 5 0 "[ . 1 . 2]" 1
654 1 32 SER H 1 38 TYR QD . . 5.010 4.595 3.920 5.014 0.004 9 0 "[ . 1 . 2]" 1
655 1 32 SER H 1 38 TYR QE . . 4.570 2.514 1.989 3.258 . 0 0 "[ . 1 . 2]" 1
656 1 32 SER HA 1 33 ALA H . . 3.430 2.380 2.149 2.652 . 0 0 "[ . 1 . 2]" 1
657 1 32 SER HA 1 33 ALA MB . . 4.270 3.948 3.877 4.001 . 0 0 "[ . 1 . 2]" 1
658 1 32 SER QB 1 35 ALA H . . 4.270 3.047 1.885 3.882 . 0 0 "[ . 1 . 2]" 1
659 1 32 SER QB 1 38 TYR QD . . 4.410 3.935 3.384 4.409 . 0 0 "[ . 1 . 2]" 1
660 1 32 SER QB 1 38 TYR QE . . 4.760 2.478 2.001 3.427 . 0 0 "[ . 1 . 2]" 1
661 1 32 SER HB2 1 35 ALA MB . . 3.720 2.994 1.967 3.587 . 0 0 "[ . 1 . 2]" 1
662 1 32 SER HB3 1 35 ALA MB . . 3.720 2.251 1.788 3.646 . 0 0 "[ . 1 . 2]" 1
663 1 33 ALA H 1 33 ALA MB . . 3.510 2.221 2.056 2.419 . 0 0 "[ . 1 . 2]" 1
664 1 33 ALA H 1 34 GLY H . . 4.900 3.892 2.651 4.487 . 0 0 "[ . 1 . 2]" 1
665 1 33 ALA HA 1 34 GLY H . . 3.250 2.356 2.146 3.086 . 0 0 "[ . 1 . 2]" 1
666 1 33 ALA HA 1 34 GLY QA . . 4.590 3.924 3.891 4.087 . 0 0 "[ . 1 . 2]" 1
667 1 33 ALA HA 1 35 ALA H . . 5.000 4.351 3.497 4.928 . 0 0 "[ . 1 . 2]" 1
668 1 33 ALA MB 1 34 GLY H . . 3.990 3.543 2.921 3.723 . 0 0 "[ . 1 . 2]" 1
669 1 34 GLY H 1 35 ALA H . . 3.610 2.649 1.819 3.067 . 0 0 "[ . 1 . 2]" 1
670 1 34 GLY QA 1 35 ALA MB . . 4.920 4.143 4.006 4.216 . 0 0 "[ . 1 . 2]" 1
671 1 35 ALA H 1 35 ALA MB . . 2.920 2.117 2.029 2.293 . 0 0 "[ . 1 . 2]" 1
672 1 35 ALA H 1 36 THR H . . 4.670 4.513 4.217 4.633 . 0 0 "[ . 1 . 2]" 1
673 1 35 ALA HA 1 36 THR H . . 3.260 2.182 2.141 2.448 . 0 0 "[ . 1 . 2]" 1
674 1 35 ALA HA 1 36 THR MG . . 4.250 3.511 3.312 3.970 . 0 0 "[ . 1 . 2]" 1
675 1 35 ALA HA 1 37 HIS H . . 4.340 3.688 3.367 4.159 . 0 0 "[ . 1 . 2]" 1
676 1 35 ALA HA 1 82 ARG QB . . 4.080 2.458 1.989 3.321 . 0 0 "[ . 1 . 2]" 1
677 1 35 ALA HA 1 82 ARG QG . . 4.830 2.889 1.954 4.827 . 0 0 "[ . 1 . 2]" 1
678 1 35 ALA MB 1 36 THR H . . 3.970 3.110 2.409 3.402 . 0 0 "[ . 1 . 2]" 1
679 1 35 ALA MB 1 36 THR HA . . 4.990 4.299 4.070 4.548 . 0 0 "[ . 1 . 2]" 1
680 1 35 ALA MB 1 37 HIS H . . 3.930 3.061 2.632 3.393 . 0 0 "[ . 1 . 2]" 1
681 1 35 ALA MB 1 38 TYR QD . . 4.440 3.334 2.590 4.107 . 0 0 "[ . 1 . 2]" 1
682 1 35 ALA MB 1 38 TYR QE . . 4.980 2.654 2.031 3.345 . 0 0 "[ . 1 . 2]" 1
683 1 35 ALA MB 1 80 SER HB2 . . 3.920 3.342 1.936 3.782 . 0 0 "[ . 1 . 2]" 1
684 1 35 ALA MB 1 80 SER QB . . 3.180 2.153 1.848 2.445 . 0 0 "[ . 1 . 2]" 1
685 1 35 ALA MB 1 80 SER HB3 . . 3.920 2.299 1.859 3.655 . 0 0 "[ . 1 . 2]" 1
686 1 35 ALA MB 1 80 SER HG . . 5.170 4.163 3.429 4.773 . 0 0 "[ . 1 . 2]" 1
687 1 35 ALA MB 1 81 LEU H . . 3.430 2.980 2.537 3.429 . 0 0 "[ . 1 . 2]" 1
688 1 35 ALA MB 1 82 ARG QB . . 5.080 3.094 2.340 3.848 . 0 0 "[ . 1 . 2]" 1
689 1 36 THR H 1 36 THR MG . . 3.570 1.870 1.798 2.283 . 0 0 "[ . 1 . 2]" 1
690 1 36 THR H 1 37 HIS H . . 2.950 2.315 1.952 2.723 . 0 0 "[ . 1 . 2]" 1
691 1 36 THR H 1 82 ARG HA . . 3.870 2.329 1.896 2.806 . 0 0 "[ . 1 . 2]" 1
692 1 36 THR H 1 82 ARG QB . . 4.930 3.826 2.909 4.545 . 0 0 "[ . 1 . 2]" 1
693 1 36 THR H 1 82 ARG QG . . 5.130 3.664 2.527 5.018 . 0 0 "[ . 1 . 2]" 1
694 1 36 THR HA 1 36 THR MG . . 3.090 3.161 3.127 3.206 0.116 12 0 "[ . 1 . 2]" 1
695 1 36 THR HB 1 37 HIS H . . 4.630 4.266 4.103 4.501 . 0 0 "[ . 1 . 2]" 1
696 1 36 THR MG 1 37 HIS H . . 4.280 2.350 1.943 2.874 . 0 0 "[ . 1 . 2]" 1
697 1 36 THR MG 1 37 HIS HB2 . . 5.500 4.632 4.063 4.931 . 0 0 "[ . 1 . 2]" 1
698 1 36 THR MG 1 37 HIS HB3 . . 5.500 3.669 2.626 4.271 . 0 0 "[ . 1 . 2]" 1
699 1 36 THR MG 1 82 ARG HA . . 3.930 2.519 1.769 3.230 . 0 0 "[ . 1 . 2]" 1
700 1 36 THR MG 1 82 ARG QB . . 5.340 4.080 2.847 4.799 . 0 0 "[ . 1 . 2]" 1
701 1 36 THR MG 1 82 ARG QG . . 3.950 3.525 2.761 3.987 0.037 2 0 "[ . 1 . 2]" 1
702 1 37 HIS H 1 38 TYR H . . 4.660 4.375 4.310 4.435 . 0 0 "[ . 1 . 2]" 1
703 1 37 HIS H 1 81 LEU H . . 4.080 3.834 3.466 4.086 0.006 12 0 "[ . 1 . 2]" 1
704 1 37 HIS H 1 81 LEU HB2 . . 4.330 3.709 2.918 4.190 . 0 0 "[ . 1 . 2]" 1
705 1 37 HIS H 1 82 ARG HA . . 4.300 3.824 3.173 4.301 0.001 6 0 "[ . 1 . 2]" 1
706 1 37 HIS HB2 1 38 TYR H . . 3.570 2.471 2.060 2.805 . 0 0 "[ . 1 . 2]" 1
707 1 37 HIS HB2 1 57 GLN HB2 . . 5.500 5.262 4.986 5.490 . 0 0 "[ . 1 . 2]" 1
708 1 37 HIS HB2 1 57 GLN HB3 . . 5.500 3.588 3.272 3.818 . 0 0 "[ . 1 . 2]" 1
709 1 37 HIS HB2 1 57 GLN HG2 . . 4.510 3.649 3.406 3.798 . 0 0 "[ . 1 . 2]" 1
710 1 37 HIS HB2 1 57 GLN HG3 . . 5.370 5.291 4.809 5.379 0.009 14 0 "[ . 1 . 2]" 1
711 1 37 HIS HB2 1 81 LEU HB2 . . 5.230 4.163 3.998 4.318 . 0 0 "[ . 1 . 2]" 1
712 1 37 HIS HB2 1 81 LEU HB3 . . 5.500 5.433 5.245 5.520 0.020 18 0 "[ . 1 . 2]" 1
713 1 37 HIS HB2 1 81 LEU QD . . 4.600 4.337 3.915 4.573 . 0 0 "[ . 1 . 2]" 1
714 1 37 HIS HB3 1 38 TYR H . . 3.970 3.738 3.450 3.974 0.004 18 0 "[ . 1 . 2]" 1
715 1 37 HIS HB3 1 57 GLN HG2 . . 5.500 5.170 4.815 5.363 . 0 0 "[ . 1 . 2]" 1
716 1 37 HIS HB3 1 81 LEU HB2 . . 5.310 4.923 4.663 5.097 . 0 0 "[ . 1 . 2]" 1
717 1 37 HIS HB3 1 81 LEU QD . . 5.440 5.298 4.997 5.448 0.008 5 0 "[ . 1 . 2]" 1
718 1 37 HIS HD2 1 38 TYR H . . 4.600 4.082 3.605 4.587 . 0 0 "[ . 1 . 2]" 1
719 1 37 HIS HD2 1 57 GLN HG2 . . 4.520 2.837 2.243 3.304 . 0 0 "[ . 1 . 2]" 1
720 1 37 HIS HD2 1 57 GLN HG3 . . 4.630 4.359 3.854 4.631 0.001 12 0 "[ . 1 . 2]" 1
721 1 37 HIS HD2 1 81 LEU HB2 . . 4.510 2.428 2.002 3.286 . 0 0 "[ . 1 . 2]" 1
722 1 37 HIS HD2 1 81 LEU QD . . 4.410 2.368 1.946 3.015 . 0 0 "[ . 1 . 2]" 1
723 1 37 HIS HE1 1 81 LEU HB2 . . 4.780 4.258 3.367 4.780 . 0 0 "[ . 1 . 2]" 1
724 1 37 HIS HE1 1 81 LEU HB3 . . 4.470 3.520 2.492 4.419 . 0 0 "[ . 1 . 2]" 1
725 1 37 HIS HE1 1 81 LEU QD . . 5.350 4.350 3.604 5.211 . 0 0 "[ . 1 . 2]" 1
726 1 38 TYR H 1 38 TYR QD . . 4.160 2.785 2.277 3.386 . 0 0 "[ . 1 . 2]" 1
727 1 38 TYR H 1 38 TYR QE . . 5.010 4.511 4.237 5.020 0.010 5 0 "[ . 1 . 2]" 1
728 1 38 TYR H 1 57 GLN HG2 . . 4.950 4.474 3.788 4.949 . 0 0 "[ . 1 . 2]" 1
729 1 38 TYR H 1 58 VAL MG2 . . 4.150 3.507 2.730 4.008 . 0 0 "[ . 1 . 2]" 1
730 1 38 TYR H 1 81 LEU HB2 . . 5.500 4.578 4.104 4.817 . 0 0 "[ . 1 . 2]" 1
731 1 38 TYR H 1 81 LEU QD . . 4.990 4.507 4.020 4.992 0.002 13 0 "[ . 1 . 2]" 1
732 1 38 TYR HA 1 39 LEU H . . 3.120 2.217 2.148 2.359 . 0 0 "[ . 1 . 2]" 1
733 1 38 TYR HA 1 81 LEU H . . 3.690 2.399 2.096 2.802 . 0 0 "[ . 1 . 2]" 1
734 1 38 TYR HA 1 81 LEU HB2 . . 4.620 3.349 2.834 3.728 . 0 0 "[ . 1 . 2]" 1
735 1 38 TYR HA 1 81 LEU QD . . 4.230 3.185 2.209 3.968 . 0 0 "[ . 1 . 2]" 1
736 1 38 TYR HA 1 81 LEU HG . . 5.230 3.962 3.070 5.018 . 0 0 "[ . 1 . 2]" 1
737 1 38 TYR QB 1 39 LEU H . . 3.630 2.928 2.548 3.197 . 0 0 "[ . 1 . 2]" 1
738 1 38 TYR QB 1 40 VAL MG2 . . 3.980 3.378 3.243 3.663 . 0 0 "[ . 1 . 2]" 1
739 1 38 TYR QB 1 58 VAL H . . 4.440 3.806 3.195 4.016 . 0 0 "[ . 1 . 2]" 1
740 1 38 TYR QB 1 58 VAL MG2 . . 3.100 2.617 2.184 3.058 . 0 0 "[ . 1 . 2]" 1
741 1 38 TYR QB 1 78 VAL MG1 . . 3.420 2.484 2.113 2.797 . 0 0 "[ . 1 . 2]" 1
742 1 38 TYR HB2 1 39 LEU H . . 4.390 3.794 3.452 4.204 . 0 0 "[ . 1 . 2]" 1
743 1 38 TYR HB2 1 40 VAL MG2 . . 4.560 3.611 3.398 4.061 . 0 0 "[ . 1 . 2]" 1
744 1 38 TYR HB2 1 78 VAL MG1 . . 4.110 3.342 2.788 3.850 . 0 0 "[ . 1 . 2]" 1
745 1 38 TYR HB3 1 39 LEU H . . 4.390 3.049 2.624 3.345 . 0 0 "[ . 1 . 2]" 1
746 1 38 TYR HB3 1 40 VAL MG2 . . 4.560 4.148 3.604 4.562 0.002 16 0 "[ . 1 . 2]" 1
747 1 38 TYR HB3 1 78 VAL MG1 . . 4.110 2.568 2.188 2.915 . 0 0 "[ . 1 . 2]" 1
748 1 38 TYR QD 1 58 VAL MG2 . . 3.690 2.872 2.318 3.689 . 0 0 "[ . 1 . 2]" 1
749 1 38 TYR QD 1 61 PRO HA . . 4.480 3.458 2.717 4.293 . 0 0 "[ . 1 . 2]" 1
750 1 38 TYR QD 1 78 VAL MG1 . . 4.240 3.474 1.888 4.228 . 0 0 "[ . 1 . 2]" 1
751 1 38 TYR QD 1 80 SER QB . . 4.440 3.290 2.525 4.407 . 0 0 "[ . 1 . 2]" 1
752 1 38 TYR QD 1 81 LEU H . . 4.640 3.523 2.801 4.460 . 0 0 "[ . 1 . 2]" 1
753 1 38 TYR QE 1 58 VAL MG2 . . 5.500 4.586 3.877 5.388 . 0 0 "[ . 1 . 2]" 1
754 1 39 LEU H 1 39 LEU HB2 . . 3.780 2.594 2.431 2.734 . 0 0 "[ . 1 . 2]" 1
755 1 39 LEU H 1 39 LEU QB . . 3.290 2.340 2.288 2.412 . 0 0 "[ . 1 . 2]" 1
756 1 39 LEU H 1 39 LEU HB3 . . 3.780 2.680 2.544 2.845 . 0 0 "[ . 1 . 2]" 1
757 1 39 LEU H 1 39 LEU MD1 . . 4.940 4.115 3.856 4.249 . 0 0 "[ . 1 . 2]" 1
758 1 39 LEU H 1 39 LEU QD . . 4.330 3.632 3.551 3.736 . 0 0 "[ . 1 . 2]" 1
759 1 39 LEU H 1 39 LEU MD2 . . 4.940 4.059 3.815 4.339 . 0 0 "[ . 1 . 2]" 1
760 1 39 LEU H 1 39 LEU HG . . 4.810 4.703 4.540 4.796 . 0 0 "[ . 1 . 2]" 1
761 1 39 LEU H 1 40 VAL H . . 5.050 4.431 4.330 4.576 . 0 0 "[ . 1 . 2]" 1
762 1 39 LEU H 1 78 VAL MG1 . . 4.370 3.773 3.327 4.102 . 0 0 "[ . 1 . 2]" 1
763 1 39 LEU H 1 79 GLN H . . 3.800 2.909 2.380 3.285 . 0 0 "[ . 1 . 2]" 1
764 1 39 LEU H 1 79 GLN HB3 . . 4.390 3.462 2.880 3.969 . 0 0 "[ . 1 . 2]" 1
765 1 39 LEU H 1 81 LEU MD1 . . 4.560 3.572 1.878 4.535 . 0 0 "[ . 1 . 2]" 1
766 1 39 LEU H 1 81 LEU QD . . 3.760 2.751 1.854 3.597 . 0 0 "[ . 1 . 2]" 1
767 1 39 LEU H 1 81 LEU MD2 . . 4.560 3.633 1.855 4.562 0.002 4 0 "[ . 1 . 2]" 1
768 1 39 LEU H 1 81 LEU HG . . 4.570 3.543 2.488 4.570 . 17 0 "[ . 1 . 2]" 1
769 1 39 LEU HA 1 39 LEU MD1 . . 4.080 2.738 2.088 3.016 . 0 0 "[ . 1 . 2]" 1
770 1 39 LEU HA 1 39 LEU QD . . 3.160 2.042 1.891 2.424 . 0 0 "[ . 1 . 2]" 1
771 1 39 LEU HA 1 39 LEU MD2 . . 4.080 2.262 1.912 3.878 . 0 0 "[ . 1 . 2]" 1
772 1 39 LEU HA 1 39 LEU HG . . 4.070 3.621 2.588 3.796 . 0 0 "[ . 1 . 2]" 1
773 1 39 LEU HA 1 40 VAL H . . 2.970 2.168 2.139 2.381 . 0 0 "[ . 1 . 2]" 1
774 1 39 LEU HA 1 57 GLN HA . . 3.540 2.691 2.117 2.898 . 0 0 "[ . 1 . 2]" 1
775 1 39 LEU HA 1 57 GLN HG2 . . 4.620 3.190 2.732 3.530 . 0 0 "[ . 1 . 2]" 1
776 1 39 LEU HA 1 81 LEU QD . . 4.350 3.403 3.012 3.698 . 0 0 "[ . 1 . 2]" 1
777 1 39 LEU QB 1 79 GLN H . . 4.510 3.335 2.790 3.972 . 0 0 "[ . 1 . 2]" 1
778 1 39 LEU QB 1 79 GLN HB3 . . 3.650 2.419 2.077 2.782 . 0 0 "[ . 1 . 2]" 1
779 1 39 LEU QB 1 81 LEU QD . . 3.040 1.865 1.702 2.133 . 0 0 "[ . 1 . 2]" 1
780 1 39 LEU HB2 1 40 VAL H . . 4.690 4.343 3.942 4.480 . 0 0 "[ . 1 . 2]" 1
781 1 39 LEU HB2 1 79 GLN HB3 . . 4.360 3.700 2.982 4.170 . 0 0 "[ . 1 . 2]" 1
782 1 39 LEU HB3 1 40 VAL H . . 4.690 4.031 3.304 4.250 . 0 0 "[ . 1 . 2]" 1
783 1 39 LEU HB3 1 79 GLN HB3 . . 4.360 2.454 2.098 2.828 . 0 0 "[ . 1 . 2]" 1
784 1 39 LEU QD 1 41 ARG H . . 5.180 3.266 2.789 4.250 . 0 0 "[ . 1 . 2]" 1
785 1 39 LEU QD 1 41 ARG HA . . 4.380 3.369 2.993 4.213 . 0 0 "[ . 1 . 2]" 1
786 1 39 LEU QD 1 41 ARG QD . . 3.920 3.216 2.055 3.838 . 0 0 "[ . 1 . 2]" 1
787 1 39 LEU QD 1 41 ARG QG . . 3.800 2.420 1.791 3.488 . 0 0 "[ . 1 . 2]" 1
788 1 39 LEU QD 1 55 GLU HA . . 3.780 3.016 2.509 3.400 . 0 0 "[ . 1 . 2]" 1
789 1 39 LEU QD 1 55 GLU QB . . 3.090 2.534 1.938 3.085 . 0 0 "[ . 1 . 2]" 1
790 1 39 LEU QD 1 55 GLU QG . . 3.690 2.643 1.662 3.684 . 0 0 "[ . 1 . 2]" 1
791 1 39 LEU QD 1 56 VAL H . . 3.890 2.765 2.308 3.359 . 0 0 "[ . 1 . 2]" 1
792 1 39 LEU QD 1 57 GLN H . . 4.640 3.976 3.380 4.188 . 0 0 "[ . 1 . 2]" 1
793 1 39 LEU QD 1 57 GLN HA . . 3.770 2.996 2.216 3.392 . 0 0 "[ . 1 . 2]" 1
794 1 39 LEU QD 1 57 GLN QB . . 4.100 3.558 3.326 3.687 . 0 0 "[ . 1 . 2]" 1
795 1 39 LEU QD 1 57 GLN QE . . 4.330 2.805 1.985 4.073 . 0 0 "[ . 1 . 2]" 1
796 1 39 LEU QD 1 57 GLN HG2 . . 3.870 2.492 1.997 2.744 . 0 0 "[ . 1 . 2]" 1
797 1 39 LEU QD 1 57 GLN HG3 . . 3.490 1.893 1.784 1.955 . 0 0 "[ . 1 . 2]" 1
798 1 39 LEU QD 1 79 GLN HB3 . . 4.780 3.634 2.836 4.067 . 0 0 "[ . 1 . 2]" 1
799 1 39 LEU MD1 1 40 VAL H . . 3.570 2.444 2.026 3.275 . 0 0 "[ . 1 . 2]" 1
800 1 39 LEU MD1 1 55 GLU HA . . 4.330 3.174 2.537 4.309 . 0 0 "[ . 1 . 2]" 1
801 1 39 LEU MD1 1 55 GLU QB . . 3.700 2.733 1.963 3.713 0.013 4 0 "[ . 1 . 2]" 1
802 1 39 LEU MD1 1 57 GLN HA . . 4.940 4.212 2.219 4.858 . 0 0 "[ . 1 . 2]" 1
803 1 39 LEU MD1 1 57 GLN HG2 . . 5.020 4.641 1.999 5.028 0.008 18 0 "[ . 1 . 2]" 1
804 1 39 LEU MD2 1 40 VAL H . . 3.570 2.943 2.369 3.625 0.055 4 0 "[ . 1 . 2]" 1
805 1 39 LEU MD2 1 55 GLU HA . . 4.330 4.055 3.350 4.339 0.009 14 0 "[ . 1 . 2]" 1
806 1 39 LEU MD2 1 55 GLU QB . . 3.700 3.190 2.652 3.740 0.040 11 0 "[ . 1 . 2]" 1
807 1 39 LEU MD2 1 57 GLN HA . . 4.940 3.303 2.888 4.955 0.015 4 0 "[ . 1 . 2]" 1
808 1 39 LEU MD2 1 57 GLN HG2 . . 5.020 2.744 2.084 4.807 . 0 0 "[ . 1 . 2]" 1
809 1 39 LEU HG 1 40 VAL H . . 5.000 4.444 1.873 4.901 . 0 0 "[ . 1 . 2]" 1
810 1 39 LEU HG 1 57 GLN HG3 . . 4.680 4.559 4.042 4.697 0.017 18 0 "[ . 1 . 2]" 1
811 1 39 LEU HG 1 79 GLN HB3 . . 4.870 4.466 3.975 4.864 . 0 0 "[ . 1 . 2]" 1
812 1 39 LEU HG 1 81 LEU QD . . 4.150 3.209 2.586 4.148 . 0 0 "[ . 1 . 2]" 1
813 1 40 VAL H 1 40 VAL HB . . 3.360 2.511 2.428 2.772 . 0 0 "[ . 1 . 2]" 1
814 1 40 VAL H 1 40 VAL MG1 . . 4.220 3.760 3.710 3.827 . 0 0 "[ . 1 . 2]" 1
815 1 40 VAL H 1 40 VAL MG2 . . 3.480 2.930 2.647 3.249 . 0 0 "[ . 1 . 2]" 1
816 1 40 VAL H 1 41 ARG H . . 5.390 4.229 3.899 4.429 . 0 0 "[ . 1 . 2]" 1
817 1 40 VAL H 1 56 VAL HB . . 5.290 4.968 3.765 5.295 0.005 18 0 "[ . 1 . 2]" 1
818 1 40 VAL H 1 57 GLN HA . . 4.120 3.158 2.727 3.520 . 0 0 "[ . 1 . 2]" 1
819 1 40 VAL HA 1 40 VAL MG1 . . 3.270 2.461 2.421 2.495 . 0 0 "[ . 1 . 2]" 1
820 1 40 VAL HA 1 40 VAL MG2 . . 3.370 2.205 2.114 2.305 . 0 0 "[ . 1 . 2]" 1
821 1 40 VAL HA 1 41 ARG H . . 2.950 2.156 2.141 2.178 . 0 0 "[ . 1 . 2]" 1
822 1 40 VAL HA 1 78 VAL MG1 . . 4.700 3.929 3.561 4.217 . 0 0 "[ . 1 . 2]" 1
823 1 40 VAL HA 1 78 VAL MG2 . . 4.220 3.447 3.180 3.680 . 0 0 "[ . 1 . 2]" 1
824 1 40 VAL HA 1 79 GLN H . . 4.370 4.067 3.764 4.336 . 0 0 "[ . 1 . 2]" 1
825 1 40 VAL HB 1 56 VAL H . . 3.950 3.629 3.021 3.944 . 0 0 "[ . 1 . 2]" 1
826 1 40 VAL HB 1 56 VAL QG . . 3.650 2.153 1.767 3.591 . 0 0 "[ . 1 . 2]" 1
827 1 40 VAL HB 1 58 VAL H . . 5.500 4.714 4.228 5.351 . 0 0 "[ . 1 . 2]" 1
828 1 40 VAL HB 1 58 VAL MG1 . . 4.470 3.455 2.366 4.007 . 0 0 "[ . 1 . 2]" 1
829 1 40 VAL HB 1 58 VAL MG2 . . 4.320 3.614 3.097 4.283 . 0 0 "[ . 1 . 2]" 1
830 1 40 VAL HB 1 63 VAL MG2 . . 4.140 3.338 2.777 3.930 . 0 0 "[ . 1 . 2]" 1
831 1 40 VAL MG1 1 41 ARG H . . 3.500 2.800 2.279 3.070 . 0 0 "[ . 1 . 2]" 1
832 1 40 VAL MG1 1 41 ARG HA . . 4.680 3.746 3.454 3.934 . 0 0 "[ . 1 . 2]" 1
833 1 40 VAL MG1 1 42 CYS QB . . 4.730 3.437 3.115 4.173 . 0 0 "[ . 1 . 2]" 1
834 1 40 VAL MG1 1 56 VAL H . . 4.910 3.952 3.579 4.396 . 0 0 "[ . 1 . 2]" 1
835 1 40 VAL MG1 1 56 VAL HB . . 4.920 4.874 4.134 4.928 0.008 14 0 "[ . 1 . 2]" 1
836 1 40 VAL MG1 1 76 VAL HA . . 4.560 3.975 3.702 4.282 . 0 0 "[ . 1 . 2]" 1
837 1 40 VAL MG1 1 77 SER H . . 4.560 4.051 3.438 4.366 . 0 0 "[ . 1 . 2]" 1
838 1 40 VAL MG1 1 78 VAL MG1 . . 4.850 4.637 4.194 4.852 0.002 1 0 "[ . 1 . 2]" 1
839 1 40 VAL MG1 1 78 VAL MG2 . . 3.590 3.460 2.871 3.591 0.001 5 0 "[ . 1 . 2]" 1
840 1 40 VAL MG2 1 41 ARG H . . 4.110 3.976 3.744 4.112 0.002 20 0 "[ . 1 . 2]" 1
841 1 40 VAL MG2 1 57 GLN HA . . 4.530 4.186 3.550 4.536 0.006 4 0 "[ . 1 . 2]" 1
842 1 40 VAL MG2 1 58 VAL H . . 4.360 3.667 2.942 4.278 . 0 0 "[ . 1 . 2]" 1
843 1 40 VAL MG2 1 58 VAL HB . . 4.880 4.482 3.853 4.850 . 0 0 "[ . 1 . 2]" 1
844 1 40 VAL MG2 1 58 VAL MG2 . . 3.190 2.110 1.858 2.362 . 0 0 "[ . 1 . 2]" 1
845 1 40 VAL MG2 1 63 VAL HB . . 3.440 2.483 2.108 3.236 . 0 0 "[ . 1 . 2]" 1
846 1 40 VAL MG2 1 78 VAL MG1 . . 3.370 2.820 2.319 3.255 . 0 0 "[ . 1 . 2]" 1
847 1 40 VAL MG2 1 78 VAL MG2 . . 3.280 2.468 2.018 2.952 . 0 0 "[ . 1 . 2]" 1
848 1 40 VAL MG2 1 79 GLN H . . 4.850 4.159 3.663 4.665 . 0 0 "[ . 1 . 2]" 1
849 1 41 ARG H 1 41 ARG HB2 . . 3.850 2.401 2.212 2.710 . 0 0 "[ . 1 . 2]" 1
850 1 41 ARG H 1 41 ARG QB . . 3.360 2.324 2.189 2.507 . 0 0 "[ . 1 . 2]" 1
851 1 41 ARG H 1 41 ARG HB3 . . 3.850 3.321 2.840 3.718 . 0 0 "[ . 1 . 2]" 1
852 1 41 ARG H 1 41 ARG QG . . 4.780 3.424 2.803 4.092 . 0 0 "[ . 1 . 2]" 1
853 1 41 ARG H 1 76 VAL MG1 . . 4.070 3.647 3.274 4.053 . 0 0 "[ . 1 . 2]" 1
854 1 41 ARG H 1 77 SER H . . 3.670 3.176 2.801 3.482 . 0 0 "[ . 1 . 2]" 1
855 1 41 ARG H 1 77 SER QB . . 4.590 3.717 3.094 4.466 . 0 0 "[ . 1 . 2]" 1
856 1 41 ARG H 1 78 VAL MG2 . . 4.900 4.335 3.961 4.606 . 0 0 "[ . 1 . 2]" 1
857 1 41 ARG HA 1 41 ARG HG2 . . 4.060 2.675 2.225 3.113 . 0 0 "[ . 1 . 2]" 1
858 1 41 ARG HA 1 41 ARG QG . . 3.440 2.294 2.158 2.406 . 0 0 "[ . 1 . 2]" 1
859 1 41 ARG HA 1 41 ARG HG3 . . 4.060 2.587 2.201 3.017 . 0 0 "[ . 1 . 2]" 1
860 1 41 ARG HA 1 42 CYS H . . 2.900 2.148 2.140 2.169 . 0 0 "[ . 1 . 2]" 1
861 1 41 ARG HA 1 55 GLU QB . . 5.070 3.796 2.787 4.820 . 0 0 "[ . 1 . 2]" 1
862 1 41 ARG HA 1 55 GLU QG . . 4.680 4.150 3.220 4.722 0.042 18 0 "[ . 1 . 2]" 1
863 1 41 ARG HA 1 56 VAL H . . 4.190 3.505 3.173 3.746 . 0 0 "[ . 1 . 2]" 1
864 1 41 ARG QB 1 41 ARG QD . . 2.970 2.166 2.044 2.457 . 0 0 "[ . 1 . 2]" 1
865 1 41 ARG QB 1 42 CYS H . . 4.180 3.554 3.181 3.869 . 0 0 "[ . 1 . 2]" 1
866 1 41 ARG QB 1 77 SER H . . 4.090 3.055 2.678 3.516 . 0 0 "[ . 1 . 2]" 1
867 1 41 ARG QB 1 77 SER QB . . 4.000 2.738 2.104 3.691 . 0 0 "[ . 1 . 2]" 1
868 1 41 ARG HB2 1 77 SER H . . 4.800 3.582 2.795 4.799 . 0 0 "[ . 1 . 2]" 1
869 1 41 ARG HB3 1 77 SER H . . 4.800 3.682 2.765 4.494 . 0 0 "[ . 1 . 2]" 1
870 1 41 ARG QD 1 55 GLU QG . . 4.780 4.206 2.892 4.784 0.004 11 0 "[ . 1 . 2]" 1
871 1 41 ARG QD 1 77 SER H . . 5.340 5.056 4.464 5.353 0.013 11 0 "[ . 1 . 2]" 1
872 1 41 ARG QG 1 42 CYS H . . 4.330 3.693 3.183 4.137 . 0 0 "[ . 1 . 2]" 1
873 1 41 ARG QG 1 55 GLU HA . . 4.360 2.965 2.368 3.369 . 0 0 "[ . 1 . 2]" 1
874 1 41 ARG QG 1 55 GLU QB . . 4.140 2.795 1.947 3.799 . 0 0 "[ . 1 . 2]" 1
875 1 41 ARG QG 1 55 GLU QG . . 3.920 3.085 1.869 3.942 0.022 14 0 "[ . 1 . 2]" 1
876 1 41 ARG HG2 1 42 CYS H . . 4.920 3.978 3.294 4.533 . 0 0 "[ . 1 . 2]" 1
877 1 41 ARG HG2 1 55 GLU QB . . 4.740 3.437 1.965 4.739 . 0 0 "[ . 1 . 2]" 1
878 1 41 ARG HG3 1 42 CYS H . . 4.920 4.459 3.527 4.926 0.006 18 0 "[ . 1 . 2]" 1
879 1 41 ARG HG3 1 55 GLU QB . . 4.740 3.234 1.982 4.372 . 0 0 "[ . 1 . 2]" 1
880 1 42 CYS H 1 42 CYS HB2 . . 3.820 2.853 2.565 3.149 . 0 0 "[ . 1 . 2]" 1
881 1 42 CYS H 1 42 CYS QB . . 3.260 2.385 2.259 2.756 . 0 0 "[ . 1 . 2]" 1
882 1 42 CYS H 1 42 CYS HB3 . . 3.820 2.685 2.315 3.712 . 0 0 "[ . 1 . 2]" 1
883 1 42 CYS H 1 54 ARG H . . 3.820 3.440 2.746 3.831 0.011 18 0 "[ . 1 . 2]" 1
884 1 42 CYS H 1 54 ARG HB3 . . 3.710 3.001 1.981 3.473 . 0 0 "[ . 1 . 2]" 1
885 1 42 CYS H 1 55 GLU HA . . 4.360 3.470 2.641 4.186 . 0 0 "[ . 1 . 2]" 1
886 1 42 CYS H 1 56 VAL H . . 5.160 4.460 3.993 4.931 . 0 0 "[ . 1 . 2]" 1
887 1 42 CYS H 1 65 LEU MD1 . . 5.500 5.132 4.463 5.437 . 0 0 "[ . 1 . 2]" 1
888 1 42 CYS H 1 65 LEU MD2 . . 5.500 4.910 4.381 5.416 . 0 0 "[ . 1 . 2]" 1
889 1 42 CYS H 1 76 VAL MG2 . . 5.500 5.287 4.845 5.499 . 0 0 "[ . 1 . 2]" 1
890 1 42 CYS HA 1 43 SER H . . 2.920 2.152 2.139 2.195 . 0 0 "[ . 1 . 2]" 1
891 1 42 CYS HA 1 54 ARG HB3 . . 4.820 4.677 3.942 4.838 0.018 9 0 "[ . 1 . 2]" 1
892 1 42 CYS HA 1 65 LEU MD1 . . 4.810 3.783 3.350 4.251 . 0 0 "[ . 1 . 2]" 1
893 1 42 CYS HA 1 76 VAL MG2 . . 3.720 3.051 2.602 3.223 . 0 0 "[ . 1 . 2]" 1
894 1 42 CYS HA 1 77 SER H . . 4.240 4.129 3.884 4.251 0.011 18 0 "[ . 1 . 2]" 1
895 1 42 CYS QB 1 43 SER H . . 4.370 3.788 3.204 3.983 . 0 0 "[ . 1 . 2]" 1
896 1 42 CYS QB 1 54 ARG H . . 4.390 3.596 3.023 4.281 . 0 0 "[ . 1 . 2]" 1
897 1 42 CYS QB 1 54 ARG HB2 . . 4.210 3.573 2.583 3.820 . 0 0 "[ . 1 . 2]" 1
898 1 42 CYS QB 1 54 ARG HB3 . . 3.260 2.109 1.989 2.381 . 0 0 "[ . 1 . 2]" 1
899 1 42 CYS QB 1 54 ARG QG . . 3.850 3.163 2.792 3.460 . 0 0 "[ . 1 . 2]" 1
900 1 42 CYS QB 1 65 LEU MD1 . . 3.400 2.616 2.054 3.189 . 0 0 "[ . 1 . 2]" 1
901 1 42 CYS QB 1 65 LEU MD2 . . 3.510 2.706 2.196 3.499 . 0 0 "[ . 1 . 2]" 1
902 1 42 CYS QB 1 76 VAL MG1 . . 4.040 3.877 3.472 4.043 0.003 4 0 "[ . 1 . 2]" 1
903 1 42 CYS QB 1 76 VAL MG2 . . 4.020 3.581 3.160 4.025 0.005 10 0 "[ . 1 . 2]" 1
904 1 42 CYS HB2 1 54 ARG HB3 . . 3.890 3.461 2.000 3.891 0.001 20 0 "[ . 1 . 2]" 1
905 1 42 CYS HB2 1 54 ARG HG2 . . 5.490 4.356 3.345 5.077 . 0 0 "[ . 1 . 2]" 1
906 1 42 CYS HB2 1 54 ARG HG3 . . 5.490 4.998 3.314 5.494 0.004 8 0 "[ . 1 . 2]" 1
907 1 42 CYS HB2 1 65 LEU MD1 . . 4.190 2.834 2.276 3.809 . 0 0 "[ . 1 . 2]" 1
908 1 42 CYS HB2 1 65 LEU MD2 . . 4.040 2.854 2.225 3.997 . 0 0 "[ . 1 . 2]" 1
909 1 42 CYS HB3 1 54 ARG HB3 . . 3.890 2.374 1.997 3.889 . 0 0 "[ . 1 . 2]" 1
910 1 42 CYS HB3 1 54 ARG HG2 . . 5.490 3.747 2.912 5.489 . 0 0 "[ . 1 . 2]" 1
911 1 42 CYS HB3 1 54 ARG HG3 . . 5.490 4.313 3.351 5.489 . 0 0 "[ . 1 . 2]" 1
912 1 42 CYS HB3 1 65 LEU MD1 . . 4.190 3.678 2.067 4.138 . 0 0 "[ . 1 . 2]" 1
913 1 42 CYS HB3 1 65 LEU MD2 . . 4.040 3.618 2.530 3.999 . 0 0 "[ . 1 . 2]" 1
914 1 43 SER H 1 43 SER HB2 . . 4.070 3.182 2.674 3.983 . 0 0 "[ . 1 . 2]" 1
915 1 43 SER H 1 43 SER QB . . 3.520 2.750 2.545 3.034 . 0 0 "[ . 1 . 2]" 1
916 1 43 SER H 1 43 SER HB3 . . 4.070 3.284 2.679 3.900 . 0 0 "[ . 1 . 2]" 1
917 1 43 SER H 1 74 TYR HB3 . . 4.580 4.225 3.696 4.576 . 0 0 "[ . 1 . 2]" 1
918 1 43 SER H 1 74 TYR QD . . 4.650 4.404 4.004 4.652 0.002 3 0 "[ . 1 . 2]" 1
919 1 43 SER H 1 76 VAL MG2 . . 4.330 3.830 3.206 4.171 . 0 0 "[ . 1 . 2]" 1
920 1 43 SER HA 1 44 PRO HD2 . . 3.130 2.245 2.120 2.326 . 0 0 "[ . 1 . 2]" 1
921 1 43 SER HA 1 44 PRO HD3 . . 3.090 2.258 2.250 2.273 . 0 0 "[ . 1 . 2]" 1
922 1 43 SER HA 1 44 PRO HG2 . . 4.770 4.387 4.288 4.452 . 0 0 "[ . 1 . 2]" 1
923 1 43 SER HA 1 44 PRO QG . . 4.140 3.909 3.841 3.955 . 0 0 "[ . 1 . 2]" 1
924 1 43 SER HA 1 44 PRO HG3 . . 4.770 4.388 4.337 4.428 . 0 0 "[ . 1 . 2]" 1
925 1 43 SER HA 1 53 GLU HA . . 3.900 3.325 2.594 3.882 . 0 0 "[ . 1 . 2]" 1
926 1 43 SER HA 1 53 GLU QB . . 5.010 4.150 2.710 5.002 . 0 0 "[ . 1 . 2]" 1
927 1 43 SER HA 1 53 GLU QG . . 4.930 4.217 3.435 4.890 . 0 0 "[ . 1 . 2]" 1
928 1 43 SER HA 1 54 ARG H . . 4.280 3.766 3.395 4.009 . 0 0 "[ . 1 . 2]" 1
929 1 43 SER HA 1 74 TYR QD . . 5.080 4.627 4.234 4.982 . 0 0 "[ . 1 . 2]" 1
930 1 43 SER QB 1 53 GLU HA . . 4.310 3.505 2.335 4.276 . 0 0 "[ . 1 . 2]" 1
931 1 43 SER QB 1 53 GLU QG . . 3.810 2.864 2.007 3.639 . 0 0 "[ . 1 . 2]" 1
932 1 43 SER QB 1 54 ARG H . . 5.340 4.176 3.339 4.742 . 0 0 "[ . 1 . 2]" 1
933 1 43 SER QB 1 75 GLU HB2 . . 4.020 3.384 2.747 4.027 0.007 11 0 "[ . 1 . 2]" 1
934 1 43 SER QB 1 75 GLU HB3 . . 4.480 4.307 3.880 4.495 0.015 11 0 "[ . 1 . 2]" 1
935 1 43 SER HB2 1 53 GLU QB . . 4.330 3.467 2.086 4.311 . 0 0 "[ . 1 . 2]" 1
936 1 43 SER HB2 1 75 GLU H . . 5.500 5.098 4.231 5.503 0.003 7 0 "[ . 1 . 2]" 1
937 1 43 SER HB2 1 75 GLU HB2 . . 4.670 4.206 3.066 4.670 . 0 0 "[ . 1 . 2]" 1
938 1 43 SER HB3 1 53 GLU QB . . 4.330 3.879 2.335 4.275 . 0 0 "[ . 1 . 2]" 1
939 1 43 SER HB3 1 75 GLU H . . 5.500 4.808 3.926 5.496 . 0 0 "[ . 1 . 2]" 1
940 1 43 SER HB3 1 75 GLU HB2 . . 4.670 3.874 2.778 4.625 . 0 0 "[ . 1 . 2]" 1
941 1 44 PRO HA 1 45 ALA H . . 3.140 2.206 2.165 2.260 . 0 0 "[ . 1 . 2]" 1
942 1 44 PRO HA 1 45 ALA MB . . 4.460 3.986 3.922 4.018 . 0 0 "[ . 1 . 2]" 1
943 1 44 PRO HA 1 46 SER H . . 4.870 3.857 3.558 4.254 . 0 0 "[ . 1 . 2]" 1
944 1 44 PRO HA 1 74 TYR QD . . 4.580 2.741 2.364 3.128 . 0 0 "[ . 1 . 2]" 1
945 1 44 PRO HA 1 74 TYR QE . . 4.880 3.932 3.621 4.253 . 0 0 "[ . 1 . 2]" 1
946 1 44 PRO HA 1 75 GLU H . . 4.290 3.472 3.053 3.860 . 0 0 "[ . 1 . 2]" 1
947 1 44 PRO QB 1 45 ALA H . . 3.820 3.058 2.878 3.230 . 0 0 "[ . 1 . 2]" 1
948 1 44 PRO QB 1 74 TYR QD . . 4.610 3.735 3.172 4.103 . 0 0 "[ . 1 . 2]" 1
949 1 44 PRO QB 1 74 TYR QE . . 4.100 3.544 2.887 3.923 . 0 0 "[ . 1 . 2]" 1
950 1 44 PRO HB2 1 45 ALA H . . 4.530 3.224 3.008 3.433 . 0 0 "[ . 1 . 2]" 1
951 1 44 PRO HB2 1 46 SER H . . 4.430 2.681 2.254 3.122 . 0 0 "[ . 1 . 2]" 1
952 1 44 PRO HB3 1 45 ALA H . . 4.530 3.802 3.670 3.934 . 0 0 "[ . 1 . 2]" 1
953 1 44 PRO HB3 1 46 SER H . . 4.430 4.133 3.828 4.434 0.004 18 0 "[ . 1 . 2]" 1
954 1 44 PRO HD2 1 53 GLU QG . . 5.340 4.372 2.895 5.338 . 0 0 "[ . 1 . 2]" 1
955 1 44 PRO HD2 1 54 ARG H . . 5.500 5.306 4.898 5.508 0.008 19 0 "[ . 1 . 2]" 1
956 1 44 PRO HD3 1 74 TYR QD . . 4.510 4.281 3.825 4.511 0.001 8 0 "[ . 1 . 2]" 1
957 1 44 PRO HD3 1 74 TYR QE . . 4.900 4.593 3.921 4.888 . 0 0 "[ . 1 . 2]" 1
958 1 44 PRO QG 1 74 TYR QE . . 5.350 4.997 4.205 5.350 0.000 5 0 "[ . 1 . 2]" 1
959 1 45 ALA H 1 45 ALA MB . . 3.240 2.155 2.045 2.250 . 0 0 "[ . 1 . 2]" 1
960 1 45 ALA H 1 74 TYR QD . . 4.680 4.342 4.040 4.640 . 0 0 "[ . 1 . 2]" 1
961 1 45 ALA H 1 75 GLU H . . 4.400 3.834 3.275 4.259 . 0 0 "[ . 1 . 2]" 1
962 1 45 ALA HA 1 75 GLU HG2 . . 4.760 3.753 2.647 4.703 . 0 0 "[ . 1 . 2]" 1
963 1 45 ALA HA 1 75 GLU QG . . 4.050 2.567 2.041 3.059 . 0 0 "[ . 1 . 2]" 1
964 1 45 ALA HA 1 75 GLU HG3 . . 4.760 2.731 2.055 3.619 . 0 0 "[ . 1 . 2]" 1
965 1 45 ALA MB 1 46 SER H . . 3.950 2.917 2.567 3.393 . 0 0 "[ . 1 . 2]" 1
966 1 45 ALA MB 1 73 ASP H . . 4.810 3.974 3.613 4.515 . 0 0 "[ . 1 . 2]" 1
967 1 45 ALA MB 1 73 ASP HB2 . . 3.490 2.589 2.003 3.491 0.001 7 0 "[ . 1 . 2]" 1
968 1 45 ALA MB 1 73 ASP QB . . 3.050 2.106 1.736 2.485 . 0 0 "[ . 1 . 2]" 1
969 1 45 ALA MB 1 73 ASP HB3 . . 3.490 2.611 1.801 3.492 0.002 5 0 "[ . 1 . 2]" 1
970 1 45 ALA MB 1 74 TYR H . . 4.830 3.930 3.566 4.460 . 0 0 "[ . 1 . 2]" 1
971 1 45 ALA MB 1 75 GLU H . . 4.610 3.963 3.401 4.496 . 0 0 "[ . 1 . 2]" 1
972 1 45 ALA MB 1 75 GLU HB2 . . 4.480 4.119 3.770 4.482 0.002 8 0 "[ . 1 . 2]" 1
973 1 45 ALA MB 1 75 GLU HB3 . . 5.020 4.863 4.551 5.024 0.004 7 0 "[ . 1 . 2]" 1
974 1 45 ALA MB 1 75 GLU HG2 . . 4.090 3.009 2.027 4.037 . 0 0 "[ . 1 . 2]" 1
975 1 45 ALA MB 1 75 GLU QG . . 3.540 2.243 1.940 2.497 . 0 0 "[ . 1 . 2]" 1
976 1 45 ALA MB 1 75 GLU HG3 . . 4.090 2.605 2.013 3.685 . 0 0 "[ . 1 . 2]" 1
977 1 45 ALA MB 1 93 ARG QD . . 4.550 3.653 3.131 4.401 . 0 0 "[ . 1 . 2]" 1
978 1 46 SER H 1 46 SER HB2 . . 4.140 2.873 2.250 3.749 . 0 0 "[ . 1 . 2]" 1
979 1 46 SER H 1 46 SER HB3 . . 4.140 2.882 2.340 3.747 . 0 0 "[ . 1 . 2]" 1
980 1 46 SER H 1 47 PRO QD . . 4.960 4.299 4.178 4.362 . 0 0 "[ . 1 . 2]" 1
981 1 46 SER H 1 48 LYS H . . 5.070 4.782 4.531 5.006 . 0 0 "[ . 1 . 2]" 1
982 1 47 PRO HA 1 48 LYS H . . 3.340 3.334 3.286 3.361 0.021 17 0 "[ . 1 . 2]" 1
983 1 47 PRO QB 1 48 LYS H . . 4.000 3.668 3.629 3.734 . 0 0 "[ . 1 . 2]" 1
984 1 47 PRO HB2 1 48 LYS H . . 4.650 3.900 3.850 3.982 . 0 0 "[ . 1 . 2]" 1
985 1 47 PRO HB3 1 48 LYS H . . 4.650 4.467 4.439 4.513 . 0 0 "[ . 1 . 2]" 1
986 1 47 PRO HG2 1 48 LYS H . . 3.820 3.225 3.135 3.381 . 0 0 "[ . 1 . 2]" 1
987 1 48 LYS H 1 48 LYS QB . . 3.490 2.359 2.145 2.782 . 0 0 "[ . 1 . 2]" 1
988 1 48 LYS H 1 48 LYS QG . . 3.880 2.786 1.872 3.932 0.052 18 0 "[ . 1 . 2]" 1
989 1 48 LYS HA 1 48 LYS QD . . 4.450 3.443 2.044 4.452 0.002 4 0 "[ . 1 . 2]" 1
990 1 48 LYS HA 1 48 LYS QG . . 3.910 2.684 2.190 3.342 . 0 0 "[ . 1 . 2]" 1
991 1 49 GLY QA 1 51 GLU H . . 4.510 3.835 3.106 4.466 . 0 0 "[ . 1 . 2]" 1
992 1 50 GLU H 1 50 GLU QB . . 3.600 2.533 2.225 3.014 . 0 0 "[ . 1 . 2]" 1
993 1 50 GLU H 1 50 GLU QG . . 4.180 3.238 1.882 4.185 0.005 9 0 "[ . 1 . 2]" 1
994 1 50 GLU H 1 51 GLU H . . 3.970 3.129 2.272 3.969 . 0 0 "[ . 1 . 2]" 1
995 1 50 GLU HA 1 50 GLU QG . . 3.610 2.744 2.215 3.440 . 0 0 "[ . 1 . 2]" 1
996 1 51 GLU H 1 51 GLU QB . . 3.640 2.458 2.213 2.855 . 0 0 "[ . 1 . 2]" 1
997 1 51 GLU H 1 51 GLU QG . . 3.670 2.643 1.897 3.690 0.020 18 0 "[ . 1 . 2]" 1
998 1 51 GLU HA 1 51 GLU QG . . 3.550 2.867 2.188 3.477 . 0 0 "[ . 1 . 2]" 1
999 1 51 GLU HA 1 52 GLU H . . 2.920 2.379 2.140 2.800 . 0 0 "[ . 1 . 2]" 1
1000 1 51 GLU QG 1 52 GLU H . . 5.040 4.071 2.665 4.826 . 0 0 "[ . 1 . 2]" 1
1001 1 52 GLU H 1 52 GLU HB2 . . 3.850 2.852 2.240 3.679 . 0 0 "[ . 1 . 2]" 1
1002 1 52 GLU H 1 52 GLU QB . . 3.150 2.511 2.216 2.917 . 0 0 "[ . 1 . 2]" 1
1003 1 52 GLU H 1 52 GLU HB3 . . 3.850 3.204 2.467 3.764 . 0 0 "[ . 1 . 2]" 1
1004 1 52 GLU H 1 52 GLU HG2 . . 5.090 3.508 1.933 4.763 . 0 0 "[ . 1 . 2]" 1
1005 1 52 GLU H 1 52 GLU QG . . 4.360 3.091 1.923 4.262 . 0 0 "[ . 1 . 2]" 1
1006 1 52 GLU H 1 52 GLU HG3 . . 5.090 3.856 2.357 4.988 . 0 0 "[ . 1 . 2]" 1
1007 1 52 GLU HA 1 52 GLU QG . . 3.610 2.658 2.267 3.420 . 0 0 "[ . 1 . 2]" 1
1008 1 52 GLU HA 1 53 GLU H . . 2.990 2.291 2.150 2.649 . 0 0 "[ . 1 . 2]" 1
1009 1 52 GLU QB 1 53 GLU H . . 4.000 3.166 2.068 3.991 . 0 0 "[ . 1 . 2]" 1
1010 1 52 GLU QG 1 53 GLU H . . 5.340 3.438 1.952 4.689 . 0 0 "[ . 1 . 2]" 1
1011 1 53 GLU H 1 53 GLU QB . . 3.180 2.539 2.173 3.029 . 0 0 "[ . 1 . 2]" 1
1012 1 53 GLU H 1 53 GLU QG . . 4.230 2.688 1.929 4.180 . 0 0 "[ . 1 . 2]" 1
1013 1 53 GLU HA 1 53 GLU QG . . 3.740 2.687 2.403 3.415 . 0 0 "[ . 1 . 2]" 1
1014 1 53 GLU HA 1 54 ARG H . . 2.910 2.234 2.147 2.318 . 0 0 "[ . 1 . 2]" 1
1015 1 53 GLU QB 1 54 ARG H . . 3.670 3.027 2.605 3.622 . 0 0 "[ . 1 . 2]" 1
1016 1 53 GLU QG 1 54 ARG H . . 4.510 3.836 1.921 4.510 . 0 0 "[ . 1 . 2]" 1
1017 1 54 ARG H 1 54 ARG HB2 . . 3.940 2.889 2.564 3.220 . 0 0 "[ . 1 . 2]" 1
1018 1 54 ARG H 1 54 ARG HB3 . . 3.550 2.519 2.233 2.974 . 0 0 "[ . 1 . 2]" 1
1019 1 54 ARG H 1 54 ARG QD . . 4.900 4.502 4.225 4.901 0.001 16 0 "[ . 1 . 2]" 1
1020 1 54 ARG H 1 54 ARG HG2 . . 4.950 4.579 4.087 4.925 . 0 0 "[ . 1 . 2]" 1
1021 1 54 ARG H 1 54 ARG QG . . 4.350 4.008 3.821 4.134 . 0 0 "[ . 1 . 2]" 1
1022 1 54 ARG H 1 54 ARG HG3 . . 4.950 4.456 4.215 4.713 . 0 0 "[ . 1 . 2]" 1
1023 1 54 ARG HB2 1 56 VAL QG . . 5.040 4.709 4.382 5.063 0.023 14 0 "[ . 1 . 2]" 1
1024 1 54 ARG QD 1 56 VAL QG . . 4.310 3.095 2.257 3.693 . 0 0 "[ . 1 . 2]" 1
1025 1 54 ARG QG 1 55 GLU H . . 3.970 2.621 1.930 3.481 . 0 0 "[ . 1 . 2]" 1
1026 1 54 ARG QG 1 56 VAL QG . . 3.990 2.355 1.926 2.748 . 0 0 "[ . 1 . 2]" 1
1027 1 55 GLU H 1 55 GLU QB . . 3.270 2.678 2.166 3.271 0.001 3 0 "[ . 1 . 2]" 1
1028 1 55 GLU H 1 55 GLU HG2 . . 4.620 3.867 2.183 4.631 0.011 19 0 "[ . 1 . 2]" 1
1029 1 55 GLU H 1 55 GLU QG . . 3.920 3.284 1.931 4.004 0.084 20 0 "[ . 1 . 2]" 1
1030 1 55 GLU H 1 55 GLU HG3 . . 4.620 3.775 2.153 4.656 0.036 20 0 "[ . 1 . 2]" 1
1031 1 55 GLU H 1 56 VAL H . . 4.720 4.239 3.982 4.478 . 0 0 "[ . 1 . 2]" 1
1032 1 55 GLU H 1 56 VAL QG . . 4.550 3.609 3.139 4.005 . 0 0 "[ . 1 . 2]" 1
1033 1 55 GLU HA 1 55 GLU HG2 . . 4.150 3.367 2.573 4.179 0.029 18 0 "[ . 1 . 2]" 1
1034 1 55 GLU HA 1 55 GLU HG3 . . 4.150 3.174 2.398 4.229 0.079 7 0 "[ . 1 . 2]" 1
1035 1 55 GLU HA 1 56 VAL H . . 2.910 2.155 2.138 2.212 . 0 0 "[ . 1 . 2]" 1
1036 1 55 GLU HA 1 56 VAL QG . . 4.340 3.319 3.179 3.473 . 0 0 "[ . 1 . 2]" 1
1037 1 55 GLU QB 1 56 VAL H . . 4.090 3.461 2.958 3.867 . 0 0 "[ . 1 . 2]" 1
1038 1 55 GLU QB 1 56 VAL HA . . 4.870 4.422 4.107 4.846 . 0 0 "[ . 1 . 2]" 1
1039 1 55 GLU QG 1 56 VAL H . . 4.590 3.748 2.516 4.638 0.048 18 0 "[ . 1 . 2]" 1
1040 1 56 VAL H 1 56 VAL HB . . 3.840 3.771 2.961 3.880 0.040 10 0 "[ . 1 . 2]" 1
1041 1 56 VAL H 1 56 VAL MG1 . . 3.880 3.158 2.801 3.911 0.031 20 0 "[ . 1 . 2]" 1
1042 1 56 VAL H 1 56 VAL QG . . 3.280 2.048 1.850 2.304 . 0 0 "[ . 1 . 2]" 1
1043 1 56 VAL H 1 56 VAL MG2 . . 3.880 2.077 1.877 2.340 . 0 0 "[ . 1 . 2]" 1
1044 1 56 VAL H 1 57 GLN H . . 4.770 4.446 4.390 4.511 . 0 0 "[ . 1 . 2]" 1
1045 1 56 VAL HA 1 56 VAL MG1 . . 3.500 2.245 2.053 2.424 . 0 0 "[ . 1 . 2]" 1
1046 1 56 VAL HA 1 56 VAL MG2 . . 3.500 3.163 2.665 3.202 . 0 0 "[ . 1 . 2]" 1
1047 1 56 VAL HA 1 57 GLN H . . 2.760 2.370 2.280 2.456 . 0 0 "[ . 1 . 2]" 1
1048 1 56 VAL HA 1 57 GLN HA . . 4.810 4.414 4.372 4.454 . 0 0 "[ . 1 . 2]" 1
1049 1 56 VAL HB 1 57 GLN H . . 3.190 2.508 2.271 3.070 . 0 0 "[ . 1 . 2]" 1
1050 1 56 VAL QG 1 57 GLN H . . 3.270 3.122 1.837 3.294 0.024 4 0 "[ . 1 . 2]" 1
1051 1 56 VAL QG 1 57 GLN HA . . 4.760 3.931 3.681 4.190 . 0 0 "[ . 1 . 2]" 1
1052 1 56 VAL MG1 1 57 GLN H . . 3.850 3.493 1.840 3.786 . 0 0 "[ . 1 . 2]" 1
1053 1 56 VAL MG2 1 57 GLN H . . 3.850 3.622 3.351 3.972 0.122 20 0 "[ . 1 . 2]" 1
1054 1 57 GLN H 1 57 GLN HB2 . . 4.090 2.438 2.299 2.536 . 0 0 "[ . 1 . 2]" 1
1055 1 57 GLN H 1 57 GLN QB . . 3.340 2.400 2.271 2.490 . 0 0 "[ . 1 . 2]" 1
1056 1 57 GLN H 1 57 GLN HB3 . . 4.090 3.599 3.525 3.632 . 0 0 "[ . 1 . 2]" 1
1057 1 57 GLN H 1 57 GLN HG2 . . 4.660 4.518 4.280 4.625 . 0 0 "[ . 1 . 2]" 1
1058 1 57 GLN H 1 57 GLN HG3 . . 4.750 3.534 3.319 3.929 . 0 0 "[ . 1 . 2]" 1
1059 1 57 GLN H 1 58 VAL H . . 4.600 4.361 4.169 4.499 . 0 0 "[ . 1 . 2]" 1
1060 1 57 GLN HA 1 57 GLN HG2 . . 3.970 2.660 2.348 3.462 . 0 0 "[ . 1 . 2]" 1
1061 1 57 GLN HA 1 57 GLN HG3 . . 4.010 2.547 2.205 2.823 . 0 0 "[ . 1 . 2]" 1
1062 1 57 GLN HA 1 58 VAL H . . 2.960 2.168 2.139 2.278 . 0 0 "[ . 1 . 2]" 1
1063 1 57 GLN HA 1 58 VAL MG1 . . 4.660 3.817 3.570 4.076 . 0 0 "[ . 1 . 2]" 1
1064 1 57 GLN HA 1 58 VAL MG2 . . 4.150 3.649 3.448 3.868 . 0 0 "[ . 1 . 2]" 1
1065 1 57 GLN QB 1 58 VAL H . . 3.780 3.218 2.740 3.496 . 0 0 "[ . 1 . 2]" 1
1066 1 57 GLN HG2 1 58 VAL H . . 4.400 3.980 3.632 4.428 0.028 18 0 "[ . 1 . 2]" 1
1067 1 57 GLN HG2 1 81 LEU QD . . 4.490 3.287 2.463 4.045 . 0 0 "[ . 1 . 2]" 1
1068 1 57 GLN HG3 1 58 VAL H . . 4.990 4.525 3.793 4.726 . 0 0 "[ . 1 . 2]" 1
1069 1 57 GLN HG3 1 81 LEU QD . . 4.710 3.981 3.202 4.707 . 0 0 "[ . 1 . 2]" 1
1070 1 58 VAL H 1 58 VAL MG1 . . 3.710 2.970 2.703 3.201 . 0 0 "[ . 1 . 2]" 1
1071 1 58 VAL H 1 58 VAL MG2 . . 3.140 2.123 1.944 2.342 . 0 0 "[ . 1 . 2]" 1
1072 1 58 VAL HA 1 58 VAL MG1 . . 3.190 2.309 2.157 2.433 . 0 0 "[ . 1 . 2]" 1
1073 1 58 VAL HA 1 59 GLY QA . . 4.720 3.894 3.890 3.907 . 0 0 "[ . 1 . 2]" 1
1074 1 58 VAL HA 1 60 ARG H . . 4.150 3.731 3.501 4.055 . 0 0 "[ . 1 . 2]" 1
1075 1 58 VAL HB 1 59 GLY H . . 4.310 3.096 2.667 3.454 . 0 0 "[ . 1 . 2]" 1
1076 1 58 VAL HB 1 60 ARG H . . 3.240 2.547 2.293 3.118 . 0 0 "[ . 1 . 2]" 1
1077 1 58 VAL HB 1 60 ARG QG . . 4.600 3.272 2.541 4.111 . 0 0 "[ . 1 . 2]" 1
1078 1 58 VAL HB 1 63 VAL MG2 . . 5.360 4.381 4.171 4.630 . 0 0 "[ . 1 . 2]" 1
1079 1 58 VAL MG1 1 60 ARG H . . 4.460 4.133 3.959 4.415 . 0 0 "[ . 1 . 2]" 1
1080 1 58 VAL MG1 1 63 VAL HA . . 3.730 3.202 2.617 3.668 . 0 0 "[ . 1 . 2]" 1
1081 1 58 VAL MG1 1 63 VAL HB . . 3.500 2.741 2.322 3.174 . 0 0 "[ . 1 . 2]" 1
1082 1 58 VAL MG2 1 60 ARG H . . 3.620 2.995 2.043 3.504 . 0 0 "[ . 1 . 2]" 1
1083 1 58 VAL MG2 1 61 PRO HA . . 4.550 3.732 3.473 3.933 . 0 0 "[ . 1 . 2]" 1
1084 1 58 VAL MG2 1 62 GLU H . . 4.140 3.951 3.673 4.144 0.004 4 0 "[ . 1 . 2]" 1
1085 1 58 VAL MG2 1 63 VAL HB . . 3.630 2.731 2.366 3.046 . 0 0 "[ . 1 . 2]" 1
1086 1 59 GLY H 1 60 ARG H . . 3.700 2.633 2.343 3.168 . 0 0 "[ . 1 . 2]" 1
1087 1 60 ARG H 1 60 ARG QB . . 3.680 2.984 2.741 3.367 . 0 0 "[ . 1 . 2]" 1
1088 1 60 ARG H 1 60 ARG HG2 . . 4.120 2.397 1.934 3.074 . 0 0 "[ . 1 . 2]" 1
1089 1 60 ARG H 1 60 ARG QG . . 3.360 2.224 1.917 2.609 . 0 0 "[ . 1 . 2]" 1
1090 1 60 ARG H 1 60 ARG HG3 . . 4.120 3.108 2.338 3.832 . 0 0 "[ . 1 . 2]" 1
1091 1 60 ARG H 1 61 PRO QD . . 4.430 4.349 4.240 4.377 . 0 0 "[ . 1 . 2]" 1
1092 1 60 ARG HA 1 61 PRO QB . . 5.500 4.566 4.549 4.575 . 0 0 "[ . 1 . 2]" 1
1093 1 60 ARG HA 1 61 PRO QD . . 3.100 2.084 2.034 2.108 . 0 0 "[ . 1 . 2]" 1
1094 1 60 ARG QB 1 60 ARG QD . . 3.040 2.234 2.019 2.641 . 0 0 "[ . 1 . 2]" 1
1095 1 60 ARG QB 1 61 PRO QD . . 3.210 2.040 1.952 2.277 . 0 0 "[ . 1 . 2]" 1
1096 1 60 ARG HB2 1 61 PRO QD . . 3.690 2.565 1.987 3.187 . 0 0 "[ . 1 . 2]" 1
1097 1 60 ARG HB3 1 61 PRO QD . . 3.690 2.569 1.977 3.223 . 0 0 "[ . 1 . 2]" 1
1098 1 60 ARG QD 1 62 GLU QG . . 4.500 3.251 1.872 4.511 0.011 7 0 "[ . 1 . 2]" 1
1099 1 60 ARG QG 1 62 GLU H . . 4.210 3.342 2.040 4.255 0.045 7 0 "[ . 1 . 2]" 1
1100 1 60 ARG QG 1 62 GLU QG . . 4.110 2.879 1.940 3.744 . 0 0 "[ . 1 . 2]" 1
1101 1 61 PRO HA 1 62 GLU H . . 3.420 3.290 3.280 3.311 . 0 0 "[ . 1 . 2]" 1
1102 1 61 PRO QD 1 62 GLU H . . 3.090 2.965 2.925 2.985 . 0 0 "[ . 1 . 2]" 1
1103 1 61 PRO QD 1 62 GLU QG . . 4.820 3.645 3.158 4.327 . 0 0 "[ . 1 . 2]" 1
1104 1 61 PRO HG3 1 62 GLU H . . 4.870 4.640 4.591 4.663 . 0 0 "[ . 1 . 2]" 1
1105 1 62 GLU H 1 62 GLU QG . . 3.380 2.199 2.006 2.525 . 0 0 "[ . 1 . 2]" 1
1106 1 62 GLU H 1 63 VAL H . . 4.520 4.339 4.206 4.472 . 0 0 "[ . 1 . 2]" 1
1107 1 62 GLU HA 1 62 GLU QG . . 3.900 3.357 3.279 3.469 . 0 0 "[ . 1 . 2]" 1
1108 1 62 GLU HA 1 63 VAL H . . 3.000 2.150 2.139 2.201 . 0 0 "[ . 1 . 2]" 1
1109 1 62 GLU HA 1 63 VAL MG1 . . 4.430 3.752 3.542 3.943 . 0 0 "[ . 1 . 2]" 1
1110 1 62 GLU HB2 1 63 VAL H . . 3.540 3.367 3.025 3.544 0.004 18 0 "[ . 1 . 2]" 1
1111 1 62 GLU HB3 1 63 VAL H . . 4.430 4.275 4.099 4.435 0.005 10 0 "[ . 1 . 2]" 1
1112 1 62 GLU QG 1 63 VAL H . . 4.340 4.127 3.689 4.343 0.003 7 0 "[ . 1 . 2]" 1
1113 1 62 GLU QG 1 63 VAL HA . . 4.560 4.047 3.627 4.534 . 0 0 "[ . 1 . 2]" 1
1114 1 63 VAL H 1 63 VAL MG1 . . 3.380 2.113 1.908 2.318 . 0 0 "[ . 1 . 2]" 1
1115 1 63 VAL H 1 63 VAL MG2 . . 4.550 3.890 3.819 3.932 . 0 0 "[ . 1 . 2]" 1
1116 1 63 VAL H 1 64 LEU H . . 4.620 4.447 4.355 4.490 . 0 0 "[ . 1 . 2]" 1
1117 1 63 VAL HA 1 63 VAL MG2 . . 3.170 2.280 2.122 2.377 . 0 0 "[ . 1 . 2]" 1
1118 1 63 VAL HA 1 64 LEU H . . 2.840 2.233 2.186 2.297 . 0 0 "[ . 1 . 2]" 1
1119 1 63 VAL HA 1 64 LEU HB2 . . 4.620 4.535 4.429 4.619 . 0 0 "[ . 1 . 2]" 1
1120 1 63 VAL HA 1 64 LEU QB . . 4.050 3.960 3.931 3.990 . 0 0 "[ . 1 . 2]" 1
1121 1 63 VAL HA 1 64 LEU HB3 . . 4.620 4.369 4.292 4.444 . 0 0 "[ . 1 . 2]" 1
1122 1 63 VAL HB 1 64 LEU H . . 4.250 4.035 3.895 4.153 . 0 0 "[ . 1 . 2]" 1
1123 1 63 VAL MG1 1 64 LEU H . . 3.940 3.720 3.481 3.935 . 0 0 "[ . 1 . 2]" 1
1124 1 63 VAL MG1 1 64 LEU HA . . 4.580 3.793 3.510 4.042 . 0 0 "[ . 1 . 2]" 1
1125 1 63 VAL MG1 1 65 LEU H . . 4.410 4.156 3.749 4.374 . 0 0 "[ . 1 . 2]" 1
1126 1 63 VAL MG1 1 65 LEU HG . . 3.940 3.330 2.974 3.532 . 0 0 "[ . 1 . 2]" 1
1127 1 63 VAL MG1 1 78 VAL MG2 . . 4.240 3.511 3.292 3.729 . 0 0 "[ . 1 . 2]" 1
1128 1 63 VAL MG2 1 64 LEU H . . 3.260 2.071 1.885 2.377 . 0 0 "[ . 1 . 2]" 1
1129 1 63 VAL MG2 1 64 LEU QB . . 4.430 3.998 3.869 4.135 . 0 0 "[ . 1 . 2]" 1
1130 1 63 VAL MG2 1 65 LEU H . . 4.240 3.827 3.516 4.177 . 0 0 "[ . 1 . 2]" 1
1131 1 63 VAL MG2 1 65 LEU HA . . 4.230 4.043 3.871 4.200 . 0 0 "[ . 1 . 2]" 1
1132 1 63 VAL MG2 1 65 LEU HG . . 3.470 2.933 2.635 3.300 . 0 0 "[ . 1 . 2]" 1
1133 1 64 LEU H 1 64 LEU HB2 . . 3.760 3.249 3.141 3.359 . 0 0 "[ . 1 . 2]" 1
1134 1 64 LEU H 1 64 LEU QB . . 3.130 2.494 2.418 2.553 . 0 0 "[ . 1 . 2]" 1
1135 1 64 LEU H 1 64 LEU HB3 . . 3.760 2.592 2.513 2.670 . 0 0 "[ . 1 . 2]" 1
1136 1 64 LEU H 1 64 LEU MD1 . . 5.260 4.351 4.307 4.456 . 0 0 "[ . 1 . 2]" 1
1137 1 64 LEU H 1 64 LEU MD2 . . 4.670 4.475 4.368 4.606 . 0 0 "[ . 1 . 2]" 1
1138 1 64 LEU H 1 64 LEU HG . . 4.720 4.346 4.261 4.462 . 0 0 "[ . 1 . 2]" 1
1139 1 64 LEU H 1 65 LEU H . . 4.700 4.103 3.998 4.211 . 0 0 "[ . 1 . 2]" 1
1140 1 64 LEU HA 1 64 LEU MD1 . . 3.520 2.104 1.977 2.371 . 0 0 "[ . 1 . 2]" 1
1141 1 64 LEU HA 1 64 LEU MD2 . . 4.110 3.918 3.828 3.983 . 0 0 "[ . 1 . 2]" 1
1142 1 64 LEU HA 1 64 LEU HG . . 4.030 3.268 3.194 3.401 . 0 0 "[ . 1 . 2]" 1
1143 1 64 LEU HA 1 65 LEU H . . 2.960 2.150 2.140 2.163 . 0 0 "[ . 1 . 2]" 1
1144 1 64 LEU HA 1 65 LEU HB2 . . 4.840 4.663 4.504 4.826 . 0 0 "[ . 1 . 2]" 1
1145 1 64 LEU QB 1 64 LEU MD2 . . 2.950 2.065 2.004 2.095 . 0 0 "[ . 1 . 2]" 1
1146 1 64 LEU HB2 1 64 LEU MD2 . . 3.370 2.404 2.215 2.541 . 0 0 "[ . 1 . 2]" 1
1147 1 64 LEU HB3 1 64 LEU MD2 . . 3.370 2.266 2.097 2.460 . 0 0 "[ . 1 . 2]" 1
1148 1 64 LEU MD1 1 65 LEU H . . 3.780 2.830 2.556 3.081 . 0 0 "[ . 1 . 2]" 1
1149 1 64 LEU MD1 1 66 ASP QB . . 4.420 4.179 3.663 4.404 . 0 0 "[ . 1 . 2]" 1
1150 1 64 LEU MD2 1 65 LEU H . . 5.070 4.882 4.720 4.986 . 0 0 "[ . 1 . 2]" 1
1151 1 64 LEU MD2 1 66 ASP QB . . 4.200 3.894 3.401 4.193 . 0 0 "[ . 1 . 2]" 1
1152 1 64 LEU HG 1 65 LEU H . . 3.950 3.672 3.440 3.831 . 0 0 "[ . 1 . 2]" 1
1153 1 64 LEU HG 1 66 ASP QB . . 5.340 3.563 3.214 3.950 . 0 0 "[ . 1 . 2]" 1
1154 1 65 LEU H 1 65 LEU HB2 . . 3.490 2.528 2.384 2.684 . 0 0 "[ . 1 . 2]" 1
1155 1 65 LEU H 1 65 LEU HB3 . . 4.140 3.641 3.598 3.664 . 0 0 "[ . 1 . 2]" 1
1156 1 65 LEU H 1 65 LEU MD1 . . 3.940 3.616 3.364 3.883 . 0 0 "[ . 1 . 2]" 1
1157 1 65 LEU H 1 65 LEU MD2 . . 4.240 3.572 3.410 3.854 . 0 0 "[ . 1 . 2]" 1
1158 1 65 LEU H 1 65 LEU HG . . 3.720 2.426 2.163 2.795 . 0 0 "[ . 1 . 2]" 1
1159 1 65 LEU H 1 66 ASP H . . 4.880 4.405 4.236 4.573 . 0 0 "[ . 1 . 2]" 1
1160 1 65 LEU HA 1 65 LEU MD1 . . 4.470 3.920 3.822 3.991 . 0 0 "[ . 1 . 2]" 1
1161 1 65 LEU HA 1 65 LEU MD2 . . 3.100 2.169 1.953 2.459 . 0 0 "[ . 1 . 2]" 1
1162 1 65 LEU HA 1 65 LEU HG . . 4.030 3.108 2.964 3.222 . 0 0 "[ . 1 . 2]" 1
1163 1 65 LEU HA 1 66 ASP H . . 2.950 2.158 2.138 2.257 . 0 0 "[ . 1 . 2]" 1
1164 1 65 LEU HA 1 68 LEU QD . . 4.830 4.119 3.839 4.485 . 0 0 "[ . 1 . 2]" 1
1165 1 65 LEU HB2 1 65 LEU MD1 . . 3.250 2.224 2.056 2.402 . 0 0 "[ . 1 . 2]" 1
1166 1 65 LEU HB2 1 65 LEU MD2 . . 3.530 3.176 3.154 3.192 . 0 0 "[ . 1 . 2]" 1
1167 1 65 LEU HB2 1 66 ASP H . . 4.660 4.212 3.690 4.456 . 0 0 "[ . 1 . 2]" 1
1168 1 65 LEU HB2 1 68 LEU QD . . 4.150 2.143 1.972 2.530 . 0 0 "[ . 1 . 2]" 1
1169 1 65 LEU HB3 1 65 LEU MD1 . . 3.490 2.439 2.264 2.570 . 0 0 "[ . 1 . 2]" 1
1170 1 65 LEU HB3 1 65 LEU MD2 . . 3.670 2.285 2.114 2.416 . 0 0 "[ . 1 . 2]" 1
1171 1 65 LEU HB3 1 66 ASP H . . 4.140 3.443 2.850 3.807 . 0 0 "[ . 1 . 2]" 1
1172 1 65 LEU HB3 1 68 LEU MD1 . . 4.360 2.968 2.560 4.011 . 0 0 "[ . 1 . 2]" 1
1173 1 65 LEU HB3 1 68 LEU QD . . 3.490 2.636 2.357 3.064 . 0 0 "[ . 1 . 2]" 1
1174 1 65 LEU HB3 1 68 LEU MD2 . . 4.360 3.050 2.387 3.626 . 0 0 "[ . 1 . 2]" 1
1175 1 65 LEU MD1 1 68 LEU QD . . 4.380 2.590 2.200 2.810 . 0 0 "[ . 1 . 2]" 1
1176 1 65 LEU MD2 1 66 ASP H . . 3.990 3.746 3.423 3.967 . 0 0 "[ . 1 . 2]" 1
1177 1 66 ASP H 1 66 ASP QB . . 3.640 2.836 2.671 2.967 . 0 0 "[ . 1 . 2]" 1
1178 1 66 ASP HA 1 67 GLY H . . 3.400 2.265 2.168 2.523 . 0 0 "[ . 1 . 2]" 1
1179 1 66 ASP HA 1 67 GLY QA . . 4.420 3.995 3.940 4.120 . 0 0 "[ . 1 . 2]" 1
1180 1 66 ASP HA 1 68 LEU H . . 4.720 4.356 3.274 4.697 . 0 0 "[ . 1 . 2]" 1
1181 1 66 ASP QB 1 67 GLY H . . 3.200 2.794 2.186 3.101 . 0 0 "[ . 1 . 2]" 1
1182 1 67 GLY H 1 68 LEU H . . 3.530 2.752 2.317 3.056 . 0 0 "[ . 1 . 2]" 1
1183 1 68 LEU H 1 68 LEU HB2 . . 3.160 2.652 2.313 2.780 . 0 0 "[ . 1 . 2]" 1
1184 1 68 LEU H 1 68 LEU HB3 . . 4.000 3.777 3.556 3.847 . 0 0 "[ . 1 . 2]" 1
1185 1 68 LEU H 1 68 LEU MD1 . . 4.190 3.908 3.517 4.173 . 0 0 "[ . 1 . 2]" 1
1186 1 68 LEU H 1 68 LEU MD2 . . 4.190 3.931 1.937 4.190 . 0 0 "[ . 1 . 2]" 1
1187 1 68 LEU H 1 68 LEU HG . . 3.520 3.047 2.707 3.529 0.009 8 0 "[ . 1 . 2]" 1
1188 1 68 LEU HA 1 68 LEU MD1 . . 4.360 3.852 2.539 3.961 . 0 0 "[ . 1 . 2]" 1
1189 1 68 LEU HA 1 68 LEU QD . . 2.960 2.298 1.993 2.492 . 0 0 "[ . 1 . 2]" 1
1190 1 68 LEU HA 1 68 LEU MD2 . . 4.360 2.319 2.084 2.521 . 0 0 "[ . 1 . 2]" 1
1191 1 68 LEU HA 1 68 LEU HG . . 4.130 3.029 2.831 3.754 . 0 0 "[ . 1 . 2]" 1
1192 1 68 LEU HA 1 69 GLU H . . 3.440 2.511 2.364 2.637 . 0 0 "[ . 1 . 2]" 1
1193 1 68 LEU HA 1 69 GLU QG . . 4.710 3.874 3.417 4.698 . 0 0 "[ . 1 . 2]" 1
1194 1 68 LEU HB2 1 68 LEU QD . . 3.040 2.149 2.011 2.499 . 0 0 "[ . 1 . 2]" 1
1195 1 68 LEU HB2 1 69 GLU H . . 3.810 3.388 3.197 3.692 . 0 0 "[ . 1 . 2]" 1
1196 1 68 LEU HB2 1 74 TYR QE . . 4.700 4.283 4.066 4.537 . 0 0 "[ . 1 . 2]" 1
1197 1 68 LEU HB3 1 69 GLU H . . 3.510 2.206 1.942 2.527 . 0 0 "[ . 1 . 2]" 1
1198 1 68 LEU HB3 1 74 TYR QD . . 5.440 4.522 4.087 4.777 . 0 0 "[ . 1 . 2]" 1
1199 1 68 LEU HB3 1 74 TYR QE . . 4.720 2.837 2.623 3.029 . 0 0 "[ . 1 . 2]" 1
1200 1 68 LEU QD 1 69 GLU H . . 3.950 3.147 2.931 3.401 . 0 0 "[ . 1 . 2]" 1
1201 1 68 LEU QD 1 74 TYR QD . . 3.920 3.228 2.245 3.566 . 0 0 "[ . 1 . 2]" 1
1202 1 68 LEU QD 1 74 TYR QE . . 4.110 2.755 2.163 3.086 . 0 0 "[ . 1 . 2]" 1
1203 1 68 LEU QD 1 96 THR MG . . 3.510 3.296 2.994 3.506 . 0 0 "[ . 1 . 2]" 1
1204 1 68 LEU MD1 1 69 GLU H . . 4.780 4.296 3.109 4.648 . 0 0 "[ . 1 . 2]" 1
1205 1 68 LEU MD1 1 74 TYR QD . . 4.520 3.661 2.250 4.044 . 0 0 "[ . 1 . 2]" 1
1206 1 68 LEU MD1 1 74 TYR QE . . 4.850 3.454 2.173 4.022 . 0 0 "[ . 1 . 2]" 1
1207 1 68 LEU MD2 1 69 GLU H . . 4.780 3.280 3.006 4.067 . 0 0 "[ . 1 . 2]" 1
1208 1 68 LEU MD2 1 74 TYR QD . . 4.520 3.710 3.264 4.525 0.005 8 0 "[ . 1 . 2]" 1
1209 1 68 LEU MD2 1 74 TYR QE . . 4.850 2.994 2.593 3.985 . 0 0 "[ . 1 . 2]" 1
1210 1 69 GLU H 1 69 GLU HB2 . . 3.910 2.590 2.291 3.837 . 0 0 "[ . 1 . 2]" 1
1211 1 69 GLU H 1 69 GLU QB . . 3.390 2.455 2.263 2.820 . 0 0 "[ . 1 . 2]" 1
1212 1 69 GLU H 1 69 GLU HB3 . . 3.910 3.572 2.810 3.743 . 0 0 "[ . 1 . 2]" 1
1213 1 69 GLU H 1 69 GLU QG . . 4.310 2.949 2.359 3.666 . 0 0 "[ . 1 . 2]" 1
1214 1 69 GLU H 1 74 TYR QE . . 4.140 3.216 2.154 3.657 . 0 0 "[ . 1 . 2]" 1
1215 1 69 GLU HA 1 70 PRO HD2 . . 3.210 2.237 2.166 2.379 . 0 0 "[ . 1 . 2]" 1
1216 1 69 GLU HA 1 70 PRO HD3 . . 3.210 2.256 2.251 2.289 . 0 0 "[ . 1 . 2]" 1
1217 1 69 GLU QB 1 70 PRO QD . . 4.210 2.387 1.998 2.657 . 0 0 "[ . 1 . 2]" 1
1218 1 69 GLU QB 1 72 ARG QD . . 3.980 2.940 2.072 4.000 0.020 2 0 "[ . 1 . 2]" 1
1219 1 69 GLU QB 1 74 TYR QE . . 4.510 4.229 3.370 4.527 0.017 18 0 "[ . 1 . 2]" 1
1220 1 69 GLU QG 1 70 PRO QD . . 3.820 3.422 2.599 3.779 . 0 0 "[ . 1 . 2]" 1
1221 1 69 GLU QG 1 72 ARG QD . . 4.760 3.913 2.383 4.688 . 0 0 "[ . 1 . 2]" 1
1222 1 70 PRO HA 1 96 THR MG . . 4.380 4.202 3.859 4.384 0.004 12 0 "[ . 1 . 2]" 1
1223 1 70 PRO HA 1 97 PRO HD2 . . 5.440 5.012 4.609 5.291 . 0 0 "[ . 1 . 2]" 1
1224 1 70 PRO HA 1 98 THR HA . . 4.600 4.012 3.725 4.238 . 0 0 "[ . 1 . 2]" 1
1225 1 70 PRO QB 1 71 GLY H . . 3.770 3.026 2.666 3.414 . 0 0 "[ . 1 . 2]" 1
1226 1 70 PRO QB 1 98 THR HA . . 3.290 1.996 1.945 2.095 . 0 0 "[ . 1 . 2]" 1
1227 1 70 PRO QB 1 98 THR MG . . 3.800 2.560 2.088 2.929 . 0 0 "[ . 1 . 2]" 1
1228 1 70 PRO QB 1 99 SER H . . 4.720 2.701 2.097 2.977 . 0 0 "[ . 1 . 2]" 1
1229 1 70 PRO QB 1 99 SER QB . . 5.040 3.772 2.788 4.200 . 0 0 "[ . 1 . 2]" 1
1230 1 70 PRO HB2 1 71 GLY H . . 4.430 3.186 2.759 3.658 . 0 0 "[ . 1 . 2]" 1
1231 1 70 PRO HB2 1 98 THR HA . . 3.850 2.029 1.997 2.144 . 0 0 "[ . 1 . 2]" 1
1232 1 70 PRO HB2 1 98 THR MG . . 4.470 2.589 2.100 2.970 . 0 0 "[ . 1 . 2]" 1
1233 1 70 PRO HB3 1 71 GLY H . . 4.430 3.783 3.531 4.088 . 0 0 "[ . 1 . 2]" 1
1234 1 70 PRO HB3 1 98 THR HA . . 3.850 2.987 2.650 3.192 . 0 0 "[ . 1 . 2]" 1
1235 1 70 PRO HB3 1 98 THR MG . . 4.470 4.043 3.667 4.451 . 0 0 "[ . 1 . 2]" 1
1236 1 70 PRO HG2 1 98 THR HA . . 4.930 4.135 3.961 4.250 . 0 0 "[ . 1 . 2]" 1
1237 1 70 PRO HG3 1 99 SER QB . . 5.250 4.317 3.282 4.897 . 0 0 "[ . 1 . 2]" 1
1238 1 71 GLY H 1 72 ARG H . . 3.470 2.726 2.432 3.100 . 0 0 "[ . 1 . 2]" 1
1239 1 71 GLY H 1 96 THR H . . 4.960 4.234 3.943 4.511 . 0 0 "[ . 1 . 2]" 1
1240 1 71 GLY H 1 96 THR HA . . 4.700 4.667 4.514 4.707 0.007 7 0 "[ . 1 . 2]" 1
1241 1 71 GLY H 1 96 THR HG1 . . 3.600 2.835 1.996 3.594 . 0 0 "[ . 1 . 2]" 1
1242 1 71 GLY H 1 96 THR MG . . 4.570 4.421 4.222 4.566 . 0 0 "[ . 1 . 2]" 1
1243 1 71 GLY H 1 97 PRO HA . . 4.930 4.155 3.905 4.546 . 0 0 "[ . 1 . 2]" 1
1244 1 71 GLY H 1 98 THR HA . . 4.210 3.734 3.441 3.909 . 0 0 "[ . 1 . 2]" 1
1245 1 71 GLY H 1 98 THR MG . . 4.180 2.944 2.381 3.769 . 0 0 "[ . 1 . 2]" 1
1246 1 71 GLY QA 1 98 THR MG . . 3.090 2.135 1.904 2.489 . 0 0 "[ . 1 . 2]" 1
1247 1 71 GLY HA2 1 98 THR MG . . 3.680 2.830 2.540 3.231 . 0 0 "[ . 1 . 2]" 1
1248 1 71 GLY HA3 1 98 THR MG . . 3.680 2.211 1.954 2.588 . 0 0 "[ . 1 . 2]" 1
1249 1 72 ARG H 1 72 ARG QB . . 3.410 2.641 2.535 2.674 . 0 0 "[ . 1 . 2]" 1
1250 1 72 ARG H 1 72 ARG QG . . 4.700 4.217 4.150 4.285 . 0 0 "[ . 1 . 2]" 1
1251 1 72 ARG H 1 74 TYR QE . . 4.910 4.379 4.018 4.881 . 0 0 "[ . 1 . 2]" 1
1252 1 72 ARG H 1 96 THR H . . 3.730 3.357 2.971 3.715 . 0 0 "[ . 1 . 2]" 1
1253 1 72 ARG H 1 96 THR HG1 . . 3.420 2.405 1.898 3.002 . 0 0 "[ . 1 . 2]" 1
1254 1 72 ARG H 1 96 THR MG . . 4.310 4.078 3.734 4.259 . 0 0 "[ . 1 . 2]" 1
1255 1 72 ARG HA 1 72 ARG QD . . 4.000 3.150 2.149 4.012 0.012 6 0 "[ . 1 . 2]" 1
1256 1 72 ARG HA 1 72 ARG QG . . 3.690 2.388 2.165 2.592 . 0 0 "[ . 1 . 2]" 1
1257 1 72 ARG HA 1 73 ASP H . . 3.160 2.210 2.161 2.385 . 0 0 "[ . 1 . 2]" 1
1258 1 72 ARG QB 1 72 ARG QD . . 3.310 2.162 2.038 2.493 . 0 0 "[ . 1 . 2]" 1
1259 1 72 ARG QB 1 73 ASP H . . 3.880 3.530 3.135 3.652 . 0 0 "[ . 1 . 2]" 1
1260 1 72 ARG QB 1 74 TYR QE . . 3.490 2.359 2.123 2.597 . 0 0 "[ . 1 . 2]" 1
1261 1 72 ARG HB2 1 73 ASP H . . 4.490 4.245 4.003 4.374 . 0 0 "[ . 1 . 2]" 1
1262 1 72 ARG HB2 1 74 TYR QE . . 4.100 3.857 3.482 4.103 0.003 11 0 "[ . 1 . 2]" 1
1263 1 72 ARG HB3 1 73 ASP H . . 4.490 3.779 3.276 3.959 . 0 0 "[ . 1 . 2]" 1
1264 1 72 ARG HB3 1 74 TYR QE . . 4.100 2.381 2.136 2.628 . 0 0 "[ . 1 . 2]" 1
1265 1 72 ARG QD 1 74 TYR QE . . 5.050 4.157 2.988 5.025 . 0 0 "[ . 1 . 2]" 1
1266 1 72 ARG QG 1 73 ASP H . . 4.510 2.441 1.933 2.789 . 0 0 "[ . 1 . 2]" 1
1267 1 72 ARG QG 1 73 ASP HA . . 4.860 4.427 4.090 4.611 . 0 0 "[ . 1 . 2]" 1
1268 1 72 ARG QG 1 74 TYR QD . . 5.230 4.131 3.290 4.512 . 0 0 "[ . 1 . 2]" 1
1269 1 72 ARG QG 1 74 TYR QE . . 5.340 3.314 2.362 3.857 . 0 0 "[ . 1 . 2]" 1
1270 1 73 ASP H 1 73 ASP HB2 . . 4.030 2.697 2.260 3.653 . 0 0 "[ . 1 . 2]" 1
1271 1 73 ASP H 1 73 ASP QB . . 3.390 2.482 2.235 3.080 . 0 0 "[ . 1 . 2]" 1
1272 1 73 ASP H 1 73 ASP HB3 . . 4.030 3.290 2.362 3.706 . 0 0 "[ . 1 . 2]" 1
1273 1 73 ASP H 1 74 TYR H . . 4.710 4.505 4.250 4.560 . 0 0 "[ . 1 . 2]" 1
1274 1 73 ASP HA 1 74 TYR H . . 3.040 2.185 2.143 2.220 . 0 0 "[ . 1 . 2]" 1
1275 1 73 ASP HA 1 74 TYR HB2 . . 4.730 4.424 4.295 4.510 . 0 0 "[ . 1 . 2]" 1
1276 1 73 ASP HA 1 74 TYR QD . . 4.570 3.865 3.381 4.293 . 0 0 "[ . 1 . 2]" 1
1277 1 73 ASP HA 1 95 ARG HA . . 3.440 2.794 2.328 3.099 . 0 0 "[ . 1 . 2]" 1
1278 1 73 ASP HA 1 95 ARG QB . . 4.530 4.016 3.668 4.321 . 0 0 "[ . 1 . 2]" 1
1279 1 73 ASP HA 1 96 THR H . . 4.430 4.308 3.837 4.434 0.004 2 0 "[ . 1 . 2]" 1
1280 1 73 ASP QB 1 74 TYR H . . 4.090 3.206 2.922 3.788 . 0 0 "[ . 1 . 2]" 1
1281 1 73 ASP QB 1 93 ARG QD . . 4.520 3.367 2.085 4.450 . 0 0 "[ . 1 . 2]" 1
1282 1 73 ASP QB 1 93 ARG QG . . 5.340 4.279 3.210 5.254 . 0 0 "[ . 1 . 2]" 1
1283 1 73 ASP HB2 1 74 TYR H . . 4.760 3.997 3.028 4.388 . 0 0 "[ . 1 . 2]" 1
1284 1 73 ASP HB3 1 74 TYR H . . 4.760 3.496 3.011 4.275 . 0 0 "[ . 1 . 2]" 1
1285 1 74 TYR H 1 74 TYR HB2 . . 3.840 2.606 2.361 2.706 . 0 0 "[ . 1 . 2]" 1
1286 1 74 TYR H 1 74 TYR QD . . 4.030 3.217 2.953 3.489 . 0 0 "[ . 1 . 2]" 1
1287 1 74 TYR H 1 94 ALA H . . 3.910 3.535 2.630 3.904 . 0 0 "[ . 1 . 2]" 1
1288 1 74 TYR H 1 94 ALA MB . . 4.500 2.717 2.246 3.250 . 0 0 "[ . 1 . 2]" 1
1289 1 74 TYR H 1 95 ARG HA . . 4.080 3.832 3.390 4.094 0.014 11 0 "[ . 1 . 2]" 1
1290 1 74 TYR HB2 1 75 GLU H . . 4.340 3.978 3.690 4.323 . 0 0 "[ . 1 . 2]" 1
1291 1 74 TYR HB2 1 76 VAL MG2 . . 3.990 3.415 2.764 3.989 . 0 0 "[ . 1 . 2]" 1
1292 1 74 TYR HB2 1 94 ALA H . . 4.960 4.381 3.641 4.866 . 0 0 "[ . 1 . 2]" 1
1293 1 74 TYR HB2 1 94 ALA MB . . 3.870 2.281 1.796 2.752 . 0 0 "[ . 1 . 2]" 1
1294 1 74 TYR HB3 1 75 GLU H . . 3.950 2.834 2.424 3.503 . 0 0 "[ . 1 . 2]" 1
1295 1 74 TYR HB3 1 76 VAL MG2 . . 3.900 2.976 2.595 3.331 . 0 0 "[ . 1 . 2]" 1
1296 1 74 TYR HB3 1 94 ALA MB . . 4.120 3.431 2.968 3.980 . 0 0 "[ . 1 . 2]" 1
1297 1 74 TYR QD 1 75 GLU H . . 4.430 3.633 3.164 4.251 . 0 0 "[ . 1 . 2]" 1
1298 1 74 TYR QD 1 94 ALA MB . . 4.450 3.366 2.448 4.024 . 0 0 "[ . 1 . 2]" 1
1299 1 74 TYR QD 1 95 ARG HA . . 4.790 4.634 4.189 4.795 0.005 18 0 "[ . 1 . 2]" 1
1300 1 74 TYR QD 1 96 THR MG . . 3.660 3.516 2.845 3.661 0.001 10 0 "[ . 1 . 2]" 1
1301 1 74 TYR QE 1 96 THR HG1 . . 4.630 3.949 3.137 4.630 . 5 0 "[ . 1 . 2]" 1
1302 1 74 TYR QE 1 96 THR MG . . 4.140 3.789 2.996 4.145 0.005 2 0 "[ . 1 . 2]" 1
1303 1 75 GLU H 1 75 GLU HB2 . . 3.670 2.482 2.255 2.659 . 0 0 "[ . 1 . 2]" 1
1304 1 75 GLU H 1 75 GLU HB3 . . 4.160 3.649 3.507 3.788 . 0 0 "[ . 1 . 2]" 1
1305 1 75 GLU H 1 75 GLU QG . . 4.320 3.053 2.309 3.498 . 0 0 "[ . 1 . 2]" 1
1306 1 75 GLU H 1 76 VAL H . . 4.630 3.937 3.589 4.210 . 0 0 "[ . 1 . 2]" 1
1307 1 75 GLU H 1 76 VAL MG2 . . 4.580 3.944 3.567 4.397 . 0 0 "[ . 1 . 2]" 1
1308 1 75 GLU HB3 1 76 VAL H . . 4.230 3.967 3.586 4.205 . 0 0 "[ . 1 . 2]" 1
1309 1 75 GLU QG 1 76 VAL H . . 4.650 4.403 4.050 4.644 . 0 0 "[ . 1 . 2]" 1
1310 1 75 GLU HG2 1 76 VAL H . . 5.500 4.733 4.263 5.028 . 0 0 "[ . 1 . 2]" 1
1311 1 75 GLU HG3 1 76 VAL H . . 5.500 5.277 4.901 5.500 0.000 8 0 "[ . 1 . 2]" 1
1312 1 76 VAL H 1 76 VAL HB . . 3.440 2.596 2.481 2.781 . 0 0 "[ . 1 . 2]" 1
1313 1 76 VAL H 1 76 VAL MG1 . . 4.230 3.809 3.761 3.881 . 0 0 "[ . 1 . 2]" 1
1314 1 76 VAL H 1 76 VAL MG2 . . 3.370 2.356 2.020 2.875 . 0 0 "[ . 1 . 2]" 1
1315 1 76 VAL H 1 77 SER H . . 4.820 4.336 4.195 4.461 . 0 0 "[ . 1 . 2]" 1
1316 1 76 VAL HA 1 76 VAL MG1 . . 3.260 2.386 2.254 2.471 . 0 0 "[ . 1 . 2]" 1
1317 1 76 VAL HA 1 76 VAL MG2 . . 3.230 2.422 2.286 2.601 . 0 0 "[ . 1 . 2]" 1
1318 1 76 VAL HA 1 77 SER H . . 2.840 2.149 2.140 2.182 . 0 0 "[ . 1 . 2]" 1
1319 1 76 VAL HA 1 77 SER QB . . 4.960 4.473 4.117 4.675 . 0 0 "[ . 1 . 2]" 1
1320 1 76 VAL HA 1 78 VAL MG2 . . 5.050 4.996 4.812 5.053 0.003 7 0 "[ . 1 . 2]" 1
1321 1 76 VAL HB 1 77 SER H . . 4.760 4.292 4.142 4.419 . 0 0 "[ . 1 . 2]" 1
1322 1 76 VAL HB 1 77 SER HA . . 5.500 4.827 4.636 5.020 . 0 0 "[ . 1 . 2]" 1
1323 1 76 VAL HB 1 78 VAL MG2 . . 5.420 4.260 3.944 4.625 . 0 0 "[ . 1 . 2]" 1
1324 1 76 VAL HB 1 91 GLY QA . . 4.840 4.363 4.060 4.656 . 0 0 "[ . 1 . 2]" 1
1325 1 76 VAL HB 1 92 ILE H . . 4.170 3.614 3.247 3.976 . 0 0 "[ . 1 . 2]" 1
1326 1 76 VAL HB 1 92 ILE MG . . 3.180 3.116 2.823 3.195 0.015 19 0 "[ . 1 . 2]" 1
1327 1 76 VAL MG1 1 77 SER H . . 3.290 2.912 2.563 3.201 . 0 0 "[ . 1 . 2]" 1
1328 1 76 VAL MG1 1 77 SER HA . . 4.250 3.871 3.725 4.129 . 0 0 "[ . 1 . 2]" 1
1329 1 76 VAL MG1 1 78 VAL H . . 4.620 4.323 3.972 4.620 0.000 9 0 "[ . 1 . 2]" 1
1330 1 76 VAL MG1 1 78 VAL MG2 . . 3.180 2.659 2.412 2.918 . 0 0 "[ . 1 . 2]" 1
1331 1 76 VAL MG2 1 77 SER H . . 4.960 4.184 4.098 4.314 . 0 0 "[ . 1 . 2]" 1
1332 1 77 SER H 1 77 SER HB2 . . 4.010 3.034 2.666 3.707 . 0 0 "[ . 1 . 2]" 1
1333 1 77 SER H 1 77 SER QB . . 3.480 2.675 2.300 3.013 . 0 0 "[ . 1 . 2]" 1
1334 1 77 SER H 1 77 SER HB3 . . 4.010 3.219 2.376 3.768 . 0 0 "[ . 1 . 2]" 1
1335 1 77 SER H 1 78 VAL MG2 . . 4.830 4.360 4.180 4.595 . 0 0 "[ . 1 . 2]" 1
1336 1 77 SER HA 1 78 VAL H . . 2.940 2.167 2.138 2.234 . 0 0 "[ . 1 . 2]" 1
1337 1 77 SER HA 1 78 VAL HB . . 4.740 4.649 4.563 4.735 . 0 0 "[ . 1 . 2]" 1
1338 1 77 SER HA 1 78 VAL MG2 . . 4.300 3.535 3.291 3.753 . 0 0 "[ . 1 . 2]" 1
1339 1 77 SER HA 1 89 ALA MB . . 4.850 4.732 4.478 4.858 0.008 18 0 "[ . 1 . 2]" 1
1340 1 77 SER HA 1 90 ARG H . . 4.720 4.298 4.023 4.554 . 0 0 "[ . 1 . 2]" 1
1341 1 77 SER HA 1 92 ILE H . . 4.210 3.940 3.790 4.088 . 0 0 "[ . 1 . 2]" 1
1342 1 77 SER QB 1 78 VAL H . . 3.560 3.361 3.097 3.581 0.021 11 0 "[ . 1 . 2]" 1
1343 1 77 SER QB 1 89 ALA MB . . 3.350 2.954 2.595 3.359 0.009 11 0 "[ . 1 . 2]" 1
1344 1 77 SER QB 1 90 ARG H . . 4.430 3.964 3.542 4.421 . 0 0 "[ . 1 . 2]" 1
1345 1 77 SER HB2 1 78 VAL H . . 4.160 3.892 3.195 4.163 0.003 19 0 "[ . 1 . 2]" 1
1346 1 77 SER HB2 1 89 ALA MB . . 3.850 3.532 2.853 3.862 0.012 19 0 "[ . 1 . 2]" 1
1347 1 77 SER HB2 1 90 ARG H . . 5.280 4.754 3.614 5.265 . 0 0 "[ . 1 . 2]" 1
1348 1 77 SER HB3 1 78 VAL H . . 4.160 3.791 3.336 4.159 . 0 0 "[ . 1 . 2]" 1
1349 1 77 SER HB3 1 89 ALA MB . . 3.850 3.358 2.675 3.852 0.002 15 0 "[ . 1 . 2]" 1
1350 1 77 SER HB3 1 90 ARG H . . 5.280 4.519 3.669 5.258 . 0 0 "[ . 1 . 2]" 1
1351 1 78 VAL H 1 78 VAL HB . . 3.570 2.616 2.497 2.743 . 0 0 "[ . 1 . 2]" 1
1352 1 78 VAL H 1 78 VAL MG1 . . 4.430 3.837 3.786 3.896 . 0 0 "[ . 1 . 2]" 1
1353 1 78 VAL H 1 78 VAL MG2 . . 3.630 2.566 2.355 2.803 . 0 0 "[ . 1 . 2]" 1
1354 1 78 VAL H 1 89 ALA MB . . 5.060 4.879 4.349 5.062 0.002 2 0 "[ . 1 . 2]" 1
1355 1 78 VAL H 1 90 ARG H . . 3.500 3.191 2.580 3.505 0.005 20 0 "[ . 1 . 2]" 1
1356 1 78 VAL HB 1 79 GLN H . . 5.060 3.974 3.699 4.179 . 0 0 "[ . 1 . 2]" 1
1357 1 78 VAL HB 1 90 ARG H . . 4.810 4.307 3.957 4.550 . 0 0 "[ . 1 . 2]" 1
1358 1 78 VAL HB 1 90 ARG HB2 . . 4.670 3.818 3.501 4.189 . 0 0 "[ . 1 . 2]" 1
1359 1 78 VAL MG1 1 79 GLN H . . 3.540 2.234 1.905 2.630 . 0 0 "[ . 1 . 2]" 1
1360 1 78 VAL MG1 1 79 GLN HA . . 4.660 3.466 3.196 3.659 . 0 0 "[ . 1 . 2]" 1
1361 1 78 VAL MG2 1 79 GLN H . . 4.230 3.987 3.769 4.141 . 0 0 "[ . 1 . 2]" 1
1362 1 79 GLN H 1 79 GLN HB2 . . 3.970 3.402 3.167 3.604 . 0 0 "[ . 1 . 2]" 1
1363 1 79 GLN H 1 79 GLN HB3 . . 3.730 2.678 2.546 2.850 . 0 0 "[ . 1 . 2]" 1
1364 1 79 GLN H 1 79 GLN QG . . 4.450 3.958 3.831 4.087 . 0 0 "[ . 1 . 2]" 1
1365 1 79 GLN HA 1 80 SER H . . 3.140 2.148 2.138 2.191 . 0 0 "[ . 1 . 2]" 1
1366 1 79 GLN HA 1 87 SER H . . 4.710 4.352 3.999 4.721 0.011 17 0 "[ . 1 . 2]" 1
1367 1 79 GLN HA 1 87 SER HB2 . . 5.500 5.072 4.190 5.505 0.005 17 0 "[ . 1 . 2]" 1
1368 1 79 GLN HA 1 87 SER HB3 . . 5.500 4.528 2.854 5.438 . 0 0 "[ . 1 . 2]" 1
1369 1 79 GLN HA 1 89 ALA HA . . 3.980 3.824 3.510 3.985 0.005 3 0 "[ . 1 . 2]" 1
1370 1 79 GLN HA 1 90 ARG H . . 4.430 3.951 3.640 4.222 . 0 0 "[ . 1 . 2]" 1
1371 1 79 GLN HB2 1 81 LEU QD . . 4.950 4.288 3.759 4.731 . 0 0 "[ . 1 . 2]" 1
1372 1 79 GLN HB2 1 86 GLY HA3 . . 5.500 5.459 5.323 5.507 0.007 19 0 "[ . 1 . 2]" 1
1373 1 79 GLN HB3 1 80 SER H . . 4.440 4.359 4.166 4.449 0.009 3 0 "[ . 1 . 2]" 1
1374 1 79 GLN HB3 1 81 LEU MD1 . . 4.520 4.195 2.436 4.530 0.010 8 0 "[ . 1 . 2]" 1
1375 1 79 GLN HB3 1 81 LEU QD . . 3.890 3.320 2.426 3.890 . 0 0 "[ . 1 . 2]" 1
1376 1 79 GLN HB3 1 81 LEU MD2 . . 4.520 3.693 2.724 4.535 0.015 17 0 "[ . 1 . 2]" 1
1377 1 79 GLN HB3 1 86 GLY HA3 . . 5.430 5.218 4.930 5.434 0.004 5 0 "[ . 1 . 2]" 1
1378 1 79 GLN QE 1 81 LEU QD . . 4.210 2.620 1.817 3.327 . 0 0 "[ . 1 . 2]" 1
1379 1 79 GLN QE 1 86 GLY HA2 . . 4.410 3.558 3.270 3.932 . 0 0 "[ . 1 . 2]" 1
1380 1 79 GLN QE 1 86 GLY HA3 . . 3.710 2.092 1.862 2.482 . 0 0 "[ . 1 . 2]" 1
1381 1 79 GLN QE 1 87 SER H . . 4.220 3.050 2.031 3.783 . 0 0 "[ . 1 . 2]" 1
1382 1 79 GLN HE21 1 86 GLY HA2 . . 5.200 3.675 3.367 4.143 . 0 0 "[ . 1 . 2]" 1
1383 1 79 GLN HE21 1 86 GLY HA3 . . 4.270 2.144 1.897 2.589 . 0 0 "[ . 1 . 2]" 1
1384 1 79 GLN HE21 1 87 SER H . . 4.990 3.109 2.042 3.924 . 0 0 "[ . 1 . 2]" 1
1385 1 79 GLN HE22 1 86 GLY HA2 . . 5.200 4.810 4.221 5.205 0.005 18 0 "[ . 1 . 2]" 1
1386 1 79 GLN HE22 1 86 GLY HA3 . . 4.270 3.117 2.512 3.588 . 0 0 "[ . 1 . 2]" 1
1387 1 79 GLN HE22 1 87 SER H . . 4.990 4.561 3.585 4.957 . 0 0 "[ . 1 . 2]" 1
1388 1 79 GLN QG 1 80 SER H . . 3.810 2.885 2.532 3.073 . 0 0 "[ . 1 . 2]" 1
1389 1 79 GLN QG 1 81 LEU QD . . 3.560 2.153 1.910 2.569 . 0 0 "[ . 1 . 2]" 1
1390 1 79 GLN QG 1 87 SER H . . 3.660 2.298 1.863 2.677 . 0 0 "[ . 1 . 2]" 1
1391 1 79 GLN HG2 1 80 SER H . . 4.460 3.513 2.749 4.057 . 0 0 "[ . 1 . 2]" 1
1392 1 79 GLN HG2 1 87 SER H . . 4.420 2.901 2.493 3.440 . 0 0 "[ . 1 . 2]" 1
1393 1 79 GLN HG3 1 80 SER H . . 4.460 3.108 2.773 3.479 . 0 0 "[ . 1 . 2]" 1
1394 1 79 GLN HG3 1 87 SER H . . 4.420 2.431 1.910 3.008 . 0 0 "[ . 1 . 2]" 1
1395 1 80 SER H 1 80 SER HB2 . . 4.070 2.625 2.285 3.638 . 0 0 "[ . 1 . 2]" 1
1396 1 80 SER H 1 80 SER QB . . 3.410 2.488 2.259 2.767 . 0 0 "[ . 1 . 2]" 1
1397 1 80 SER H 1 80 SER HB3 . . 4.070 3.511 2.612 3.631 . 0 0 "[ . 1 . 2]" 1
1398 1 80 SER H 1 81 LEU QD . . 5.140 4.410 3.766 5.110 . 0 0 "[ . 1 . 2]" 1
1399 1 80 SER H 1 87 SER HB2 . . 4.610 3.860 2.528 4.190 . 0 0 "[ . 1 . 2]" 1
1400 1 80 SER H 1 87 SER QB . . 3.960 2.888 1.891 3.475 . 0 0 "[ . 1 . 2]" 1
1401 1 80 SER H 1 87 SER HB3 . . 4.610 3.035 1.899 3.746 . 0 0 "[ . 1 . 2]" 1
1402 1 80 SER H 1 87 SER HG . . 3.660 2.509 1.898 3.669 0.009 8 0 "[ . 1 . 2]" 1
1403 1 80 SER QB 1 81 LEU H . . 3.810 3.392 2.925 3.733 . 0 0 "[ . 1 . 2]" 1
1404 1 80 SER QB 1 87 SER H . . 4.380 3.530 3.002 4.414 0.034 17 0 "[ . 1 . 2]" 1
1405 1 80 SER HB2 1 81 LEU H . . 4.630 4.226 3.356 4.504 . 0 0 "[ . 1 . 2]" 1
1406 1 80 SER HB3 1 81 LEU H . . 4.630 3.632 2.992 4.475 . 0 0 "[ . 1 . 2]" 1
1407 1 80 SER HG 1 87 SER HB2 . . 5.500 4.273 2.895 5.439 . 0 0 "[ . 1 . 2]" 1
1408 1 80 SER HG 1 87 SER HB3 . . 5.500 3.663 2.315 4.964 . 0 0 "[ . 1 . 2]" 1
1409 1 81 LEU H 1 81 LEU HB2 . . 3.670 2.410 2.280 2.689 . 0 0 "[ . 1 . 2]" 1
1410 1 81 LEU H 1 81 LEU QD . . 4.050 2.949 2.081 3.614 . 0 0 "[ . 1 . 2]" 1
1411 1 81 LEU H 1 81 LEU HG . . 4.320 3.403 2.808 4.340 0.020 10 0 "[ . 1 . 2]" 1
1412 1 81 LEU H 1 87 SER H . . 5.230 4.850 4.495 5.234 0.004 16 0 "[ . 1 . 2]" 1
1413 1 81 LEU HA 1 81 LEU MD1 . . 4.690 3.225 1.935 3.904 . 0 0 "[ . 1 . 2]" 1
1414 1 81 LEU HA 1 81 LEU QD . . 3.470 2.131 1.908 3.021 . 0 0 "[ . 1 . 2]" 1
1415 1 81 LEU HA 1 81 LEU MD2 . . 4.690 2.436 1.954 3.518 . 0 0 "[ . 1 . 2]" 1
1416 1 81 LEU HA 1 81 LEU HG . . 4.180 3.192 2.368 3.726 . 0 0 "[ . 1 . 2]" 1
1417 1 81 LEU HA 1 82 ARG H . . 2.960 2.171 2.139 2.306 . 0 0 "[ . 1 . 2]" 1
1418 1 81 LEU HA 1 86 GLY HA2 . . 3.950 2.460 1.994 2.874 . 0 0 "[ . 1 . 2]" 1
1419 1 81 LEU HA 1 86 GLY HA3 . . 4.190 3.218 2.493 3.956 . 0 0 "[ . 1 . 2]" 1
1420 1 81 LEU HA 1 87 SER H . . 4.340 3.649 3.195 4.094 . 0 0 "[ . 1 . 2]" 1
1421 1 81 LEU HB3 1 82 ARG H . . 3.610 3.259 2.660 3.614 0.004 6 0 "[ . 1 . 2]" 1
1422 1 81 LEU QD 1 82 ARG H . . 3.830 3.301 2.790 3.875 0.045 17 0 "[ . 1 . 2]" 1
1423 1 81 LEU QD 1 86 GLY H . . 4.040 3.503 2.944 3.952 . 0 0 "[ . 1 . 2]" 1
1424 1 81 LEU QD 1 86 GLY HA2 . . 3.390 2.681 2.063 3.396 0.006 17 0 "[ . 1 . 2]" 1
1425 1 81 LEU QD 1 86 GLY HA3 . . 3.460 2.139 1.893 2.963 . 0 0 "[ . 1 . 2]" 1
1426 1 81 LEU QD 1 87 SER H . . 4.110 3.358 2.838 3.879 . 0 0 "[ . 1 . 2]" 1
1427 1 81 LEU MD1 1 86 GLY HA3 . . 4.770 3.753 1.954 4.771 0.001 4 0 "[ . 1 . 2]" 1
1428 1 81 LEU MD2 1 86 GLY HA3 . . 4.770 2.626 1.895 3.841 . 0 0 "[ . 1 . 2]" 1
1429 1 81 LEU HG 1 86 GLY HA3 . . 4.880 4.209 1.995 4.882 0.002 13 0 "[ . 1 . 2]" 1
1430 1 82 ARG H 1 82 ARG HB2 . . 3.910 3.076 2.699 3.836 . 0 0 "[ . 1 . 2]" 1
1431 1 82 ARG H 1 82 ARG HB3 . . 3.910 2.762 2.405 3.007 . 0 0 "[ . 1 . 2]" 1
1432 1 82 ARG H 1 85 GLU H . . 4.710 4.593 4.211 4.719 0.009 4 0 "[ . 1 . 2]" 1
1433 1 82 ARG H 1 86 GLY HA2 . . 4.000 3.091 2.379 3.749 . 0 0 "[ . 1 . 2]" 1
1434 1 82 ARG H 1 87 SER H . . 5.500 4.997 4.431 5.503 0.003 16 0 "[ . 1 . 2]" 1
1435 1 82 ARG HA 1 82 ARG QG . . 3.710 2.569 2.230 3.332 . 0 0 "[ . 1 . 2]" 1
1436 1 84 PRO QD 1 85 GLU H . . 3.550 2.710 2.619 2.807 . 0 0 "[ . 1 . 2]" 1
1437 1 84 PRO QD 1 85 GLU QG . . 4.570 3.695 3.143 4.496 . 0 0 "[ . 1 . 2]" 1
1438 1 84 PRO HD2 1 85 GLU H . . 4.360 2.765 2.665 2.871 . 0 0 "[ . 1 . 2]" 1
1439 1 84 PRO HD3 1 85 GLU H . . 4.360 3.893 3.851 3.961 . 0 0 "[ . 1 . 2]" 1
1440 1 84 PRO QG 1 85 GLU H . . 3.040 2.378 1.890 3.043 0.003 9 0 "[ . 1 . 2]" 1
1441 1 85 GLU H 1 85 GLU QB . . 3.620 3.002 2.903 3.091 . 0 0 "[ . 1 . 2]" 1
1442 1 85 GLU H 1 85 GLU HG2 . . 4.430 2.404 2.026 2.943 . 0 0 "[ . 1 . 2]" 1
1443 1 85 GLU H 1 85 GLU QG . . 3.660 2.300 2.010 2.881 . 0 0 "[ . 1 . 2]" 1
1444 1 85 GLU H 1 85 GLU HG3 . . 4.430 3.145 2.519 4.098 . 0 0 "[ . 1 . 2]" 1
1445 1 85 GLU H 1 86 GLY H . . 4.730 4.449 4.408 4.481 . 0 0 "[ . 1 . 2]" 1
1446 1 85 GLU HA 1 85 GLU HG2 . . 4.110 3.739 3.570 3.968 . 0 0 "[ . 1 . 2]" 1
1447 1 85 GLU HA 1 85 GLU QG . . 3.580 3.344 3.326 3.409 . 0 0 "[ . 1 . 2]" 1
1448 1 85 GLU HA 1 85 GLU HG3 . . 4.110 3.806 3.575 4.199 0.089 17 0 "[ . 1 . 2]" 1
1449 1 85 GLU HA 1 86 GLY H . . 2.820 2.267 2.212 2.289 . 0 0 "[ . 1 . 2]" 1
1450 1 85 GLU HA 1 86 GLY HA3 . . 4.500 4.354 4.333 4.391 . 0 0 "[ . 1 . 2]" 1
1451 1 85 GLU QB 1 86 GLY H . . 3.640 2.754 2.681 2.937 . 0 0 "[ . 1 . 2]" 1
1452 1 85 GLU QG 1 86 GLY H . . 4.310 3.852 3.551 4.055 . 0 0 "[ . 1 . 2]" 1
1453 1 85 GLU QG 1 86 GLY HA3 . . 5.340 5.094 4.770 5.320 . 0 0 "[ . 1 . 2]" 1
1454 1 85 GLU HG2 1 86 GLY H . . 5.120 4.772 3.739 5.121 0.001 13 0 "[ . 1 . 2]" 1
1455 1 85 GLU HG3 1 86 GLY H . . 5.120 4.138 3.750 4.527 . 0 0 "[ . 1 . 2]" 1
1456 1 86 GLY H 1 87 SER H . . 5.500 4.445 4.299 4.540 . 0 0 "[ . 1 . 2]" 1
1457 1 86 GLY HA2 1 87 SER H . . 3.220 2.567 2.319 2.799 . 0 0 "[ . 1 . 2]" 1
1458 1 86 GLY HA3 1 87 SER H . . 3.440 2.570 2.351 2.842 . 0 0 "[ . 1 . 2]" 1
1459 1 87 SER H 1 87 SER HB2 . . 4.140 3.387 2.252 3.721 . 0 0 "[ . 1 . 2]" 1
1460 1 87 SER H 1 87 SER QB . . 3.440 2.461 2.135 2.778 . 0 0 "[ . 1 . 2]" 1
1461 1 87 SER H 1 87 SER HB3 . . 4.140 2.562 2.184 2.889 . 0 0 "[ . 1 . 2]" 1
1462 1 87 SER H 1 87 SER HG . . 4.340 3.439 2.270 4.416 0.076 8 0 "[ . 1 . 2]" 1
1463 1 87 SER HA 1 88 GLU H . . 3.320 2.564 2.498 2.642 . 0 0 "[ . 1 . 2]" 1
1464 1 87 SER QB 1 88 GLU H . . 3.130 2.470 1.995 3.114 . 0 0 "[ . 1 . 2]" 1
1465 1 87 SER QB 1 88 GLU HB2 . . 4.990 4.199 3.746 4.830 . 0 0 "[ . 1 . 2]" 1
1466 1 87 SER HB2 1 88 GLU H . . 3.790 2.630 2.006 3.705 . 0 0 "[ . 1 . 2]" 1
1467 1 87 SER HB3 1 88 GLU H . . 3.790 3.593 2.716 3.793 0.003 11 0 "[ . 1 . 2]" 1
1468 1 87 SER HG 1 88 GLU H . . 3.860 3.083 2.278 3.859 . 0 0 "[ . 1 . 2]" 1
1469 1 88 GLU H 1 88 GLU HB2 . . 3.700 2.236 2.142 2.362 . 0 0 "[ . 1 . 2]" 1
1470 1 88 GLU H 1 88 GLU HB3 . . 3.610 3.450 3.004 3.569 . 0 0 "[ . 1 . 2]" 1
1471 1 88 GLU H 1 88 GLU QG . . 3.650 3.078 2.551 3.724 0.074 11 0 "[ . 1 . 2]" 1
1472 1 88 GLU HA 1 88 GLU QG . . 3.580 2.383 2.152 2.826 . 0 0 "[ . 1 . 2]" 1
1473 1 88 GLU HA 1 89 ALA H . . 2.920 2.391 2.298 2.461 . 0 0 "[ . 1 . 2]" 1
1474 1 88 GLU HA 1 89 ALA MB . . 4.070 4.005 3.905 4.051 . 0 0 "[ . 1 . 2]" 1
1475 1 88 GLU HB2 1 89 ALA H . . 3.950 3.879 3.689 3.979 0.029 11 0 "[ . 1 . 2]" 1
1476 1 88 GLU HB3 1 90 ARG H . . 5.500 5.233 4.966 5.458 . 0 0 "[ . 1 . 2]" 1
1477 1 88 GLU HB3 1 90 ARG HA . . 5.500 5.435 5.165 5.515 0.015 19 0 "[ . 1 . 2]" 1
1478 1 88 GLU HB3 1 90 ARG QD . . 5.340 4.146 3.334 4.932 . 0 0 "[ . 1 . 2]" 1
1479 1 88 GLU QG 1 89 ALA H . . 4.070 3.320 1.876 4.066 . 0 0 "[ . 1 . 2]" 1
1480 1 89 ALA H 1 89 ALA MB . . 2.970 2.273 2.080 2.389 . 0 0 "[ . 1 . 2]" 1
1481 1 89 ALA H 1 90 ARG H . . 4.720 4.414 4.324 4.503 . 0 0 "[ . 1 . 2]" 1
1482 1 89 ALA MB 1 90 ARG H . . 3.390 3.268 3.115 3.392 0.002 14 0 "[ . 1 . 2]" 1
1483 1 89 ALA MB 1 90 ARG HA . . 4.320 4.100 4.003 4.192 . 0 0 "[ . 1 . 2]" 1
1484 1 89 ALA MB 1 90 ARG QD . . 5.200 4.904 4.427 5.208 0.008 19 0 "[ . 1 . 2]" 1
1485 1 90 ARG H 1 90 ARG HB2 . . 3.530 2.647 2.427 2.765 . 0 0 "[ . 1 . 2]" 1
1486 1 90 ARG H 1 90 ARG HB3 . . 3.980 3.775 3.640 3.845 . 0 0 "[ . 1 . 2]" 1
1487 1 90 ARG HA 1 90 ARG HD2 . . 3.970 2.755 1.996 3.888 . 0 0 "[ . 1 . 2]" 1
1488 1 90 ARG HA 1 90 ARG QD . . 3.280 2.130 1.985 2.391 . 0 0 "[ . 1 . 2]" 1
1489 1 90 ARG HA 1 90 ARG HD3 . . 3.970 2.964 2.031 3.690 . 0 0 "[ . 1 . 2]" 1
1490 1 90 ARG HA 1 90 ARG HG3 . . 4.240 3.770 3.696 3.824 . 0 0 "[ . 1 . 2]" 1
1491 1 90 ARG HA 1 91 GLY H . . 2.970 2.179 2.145 2.212 . 0 0 "[ . 1 . 2]" 1
1492 1 90 ARG HB2 1 91 GLY H . . 4.700 4.438 4.307 4.514 . 0 0 "[ . 1 . 2]" 1
1493 1 90 ARG HB3 1 90 ARG HD2 . . 4.170 2.678 2.466 2.917 . 0 0 "[ . 1 . 2]" 1
1494 1 90 ARG HB3 1 90 ARG QD . . 3.610 2.498 2.230 2.811 . 0 0 "[ . 1 . 2]" 1
1495 1 90 ARG HB3 1 90 ARG HD3 . . 4.170 3.189 2.373 3.683 . 0 0 "[ . 1 . 2]" 1
1496 1 90 ARG HB3 1 91 GLY H . . 3.910 3.785 3.562 3.913 0.003 2 0 "[ . 1 . 2]" 1
1497 1 90 ARG QD 1 91 GLY H . . 3.970 3.882 3.474 3.981 0.011 20 0 "[ . 1 . 2]" 1
1498 1 91 GLY H 1 92 ILE H . . 4.750 4.515 4.488 4.544 . 0 0 "[ . 1 . 2]" 1
1499 1 91 GLY QA 1 92 ILE H . . 2.760 2.240 2.181 2.254 . 0 0 "[ . 1 . 2]" 1
1500 1 91 GLY QA 1 92 ILE MG . . 4.550 3.518 3.324 3.713 . 0 0 "[ . 1 . 2]" 1
1501 1 91 GLY HA2 1 92 ILE H . . 3.210 2.364 2.247 2.395 . 0 0 "[ . 1 . 2]" 1
1502 1 91 GLY HA3 1 92 ILE H . . 3.210 2.785 2.747 2.948 . 0 0 "[ . 1 . 2]" 1
1503 1 92 ILE H 1 92 ILE HB . . 4.130 3.161 3.007 3.316 . 0 0 "[ . 1 . 2]" 1
1504 1 92 ILE H 1 92 ILE MG . . 3.300 1.948 1.877 2.139 . 0 0 "[ . 1 . 2]" 1
1505 1 92 ILE H 1 93 ARG H . . 4.660 4.455 4.374 4.504 . 0 0 "[ . 1 . 2]" 1
1506 1 92 ILE H 1 93 ARG HA . . 5.070 5.035 4.974 5.073 0.003 5 0 "[ . 1 . 2]" 1
1507 1 92 ILE HA 1 92 ILE MD . . 4.010 3.727 3.611 3.860 . 0 0 "[ . 1 . 2]" 1
1508 1 92 ILE HA 1 92 ILE HG12 . . 3.970 3.234 2.978 3.475 . 0 0 "[ . 1 . 2]" 1
1509 1 92 ILE HA 1 92 ILE QG . . 3.280 2.375 2.275 2.534 . 0 0 "[ . 1 . 2]" 1
1510 1 92 ILE HA 1 92 ILE HG13 . . 3.970 2.446 2.327 2.605 . 0 0 "[ . 1 . 2]" 1
1511 1 92 ILE HA 1 93 ARG H . . 2.900 2.277 2.154 2.407 . 0 0 "[ . 1 . 2]" 1
1512 1 92 ILE HB 1 93 ARG H . . 4.130 3.908 3.751 4.097 . 0 0 "[ . 1 . 2]" 1
1513 1 92 ILE MD 1 93 ARG H . . 4.310 3.782 3.438 4.283 . 0 0 "[ . 1 . 2]" 1
1514 1 92 ILE QG 1 93 ARG H . . 3.160 2.086 1.762 2.592 . 0 0 "[ . 1 . 2]" 1
1515 1 92 ILE HG12 1 93 ARG H . . 3.630 2.544 2.080 3.224 . 0 0 "[ . 1 . 2]" 1
1516 1 92 ILE HG13 1 93 ARG H . . 3.630 2.250 1.903 2.843 . 0 0 "[ . 1 . 2]" 1
1517 1 92 ILE MG 1 93 ARG H . . 4.140 3.749 3.421 4.111 . 0 0 "[ . 1 . 2]" 1
1518 1 92 ILE MG 1 93 ARG HA . . 5.000 4.484 4.175 4.765 . 0 0 "[ . 1 . 2]" 1
1519 1 93 ARG H 1 93 ARG HB2 . . 3.590 2.496 2.189 2.851 . 0 0 "[ . 1 . 2]" 1
1520 1 93 ARG H 1 93 ARG QB . . 2.980 2.234 2.160 2.297 . 0 0 "[ . 1 . 2]" 1
1521 1 93 ARG H 1 93 ARG HB3 . . 3.590 2.680 2.365 3.506 . 0 0 "[ . 1 . 2]" 1
1522 1 93 ARG H 1 93 ARG QG . . 4.130 3.873 2.818 4.064 . 0 0 "[ . 1 . 2]" 1
1523 1 93 ARG HA 1 93 ARG QD . . 3.930 2.484 2.020 3.654 . 0 0 "[ . 1 . 2]" 1
1524 1 93 ARG HA 1 93 ARG QG . . 3.740 2.637 2.132 2.933 . 0 0 "[ . 1 . 2]" 1
1525 1 93 ARG HA 1 94 ALA H . . 2.880 2.198 2.144 2.323 . 0 0 "[ . 1 . 2]" 1
1526 1 93 ARG HA 1 94 ALA MB . . 4.550 4.029 3.841 4.115 . 0 0 "[ . 1 . 2]" 1
1527 1 93 ARG QB 1 93 ARG QD . . 3.320 2.348 2.040 2.634 . 0 0 "[ . 1 . 2]" 1
1528 1 93 ARG QB 1 94 ALA H . . 4.050 3.877 3.119 4.045 . 0 0 "[ . 1 . 2]" 1
1529 1 93 ARG HB2 1 94 ALA H . . 4.670 4.499 4.306 4.608 . 0 0 "[ . 1 . 2]" 1
1530 1 93 ARG HB3 1 94 ALA H . . 4.670 4.267 3.201 4.522 . 0 0 "[ . 1 . 2]" 1
1531 1 93 ARG QD 1 94 ALA H . . 4.430 3.510 2.596 4.431 0.001 15 0 "[ . 1 . 2]" 1
1532 1 93 ARG QG 1 94 ALA H . . 4.100 3.595 3.147 4.103 0.003 3 0 "[ . 1 . 2]" 1
1533 1 94 ALA H 1 94 ALA MB . . 3.400 2.220 2.025 2.415 . 0 0 "[ . 1 . 2]" 1
1534 1 94 ALA H 1 95 ARG H . . 4.720 4.477 3.899 4.639 . 0 0 "[ . 1 . 2]" 1
1535 1 94 ALA MB 1 95 ARG H . . 3.560 2.908 2.361 3.560 . 0 0 "[ . 1 . 2]" 1
1536 1 94 ALA MB 1 95 ARG HA . . 4.920 3.956 3.653 4.305 . 0 0 "[ . 1 . 2]" 1
1537 1 95 ARG H 1 95 ARG HB2 . . 3.930 3.854 3.652 3.962 0.032 13 0 "[ . 1 . 2]" 1
1538 1 95 ARG H 1 95 ARG QB . . 3.240 2.920 2.436 3.157 . 0 0 "[ . 1 . 2]" 1
1539 1 95 ARG H 1 95 ARG HB3 . . 3.930 3.029 2.473 3.327 . 0 0 "[ . 1 . 2]" 1
1540 1 95 ARG H 1 95 ARG QD . . 4.870 3.463 1.900 4.467 . 0 0 "[ . 1 . 2]" 1
1541 1 95 ARG H 1 96 THR MG . . 4.560 3.886 3.300 4.451 . 0 0 "[ . 1 . 2]" 1
1542 1 95 ARG HA 1 95 ARG QD . . 4.410 4.016 3.598 4.414 0.004 16 0 "[ . 1 . 2]" 1
1543 1 95 ARG HA 1 95 ARG QG . . 3.480 3.254 2.711 3.417 . 0 0 "[ . 1 . 2]" 1
1544 1 95 ARG HA 1 96 THR H . . 2.990 2.329 2.209 2.606 . 0 0 "[ . 1 . 2]" 1
1545 1 95 ARG HA 1 96 THR HA . . 4.980 4.477 4.432 4.612 . 0 0 "[ . 1 . 2]" 1
1546 1 95 ARG HA 1 96 THR MG . . 4.820 3.657 3.346 3.999 . 0 0 "[ . 1 . 2]" 1
1547 1 95 ARG QB 1 95 ARG QD . . 3.330 2.234 1.989 2.723 . 0 0 "[ . 1 . 2]" 1
1548 1 95 ARG QB 1 96 THR H . . 3.970 2.760 2.051 3.536 . 0 0 "[ . 1 . 2]" 1
1549 1 95 ARG HB2 1 96 THR H . . 4.600 2.831 2.063 3.791 . 0 0 "[ . 1 . 2]" 1
1550 1 95 ARG HB3 1 96 THR H . . 4.600 4.009 3.573 4.230 . 0 0 "[ . 1 . 2]" 1
1551 1 95 ARG QD 1 96 THR H . . 5.340 4.452 2.420 4.986 . 0 0 "[ . 1 . 2]" 1
1552 1 95 ARG QG 1 96 THR H . . 3.660 3.206 2.205 3.711 0.051 19 0 "[ . 1 . 2]" 1
1553 1 96 THR H 1 96 THR HG1 . . 4.300 3.348 2.089 3.935 . 0 0 "[ . 1 . 2]" 1
1554 1 96 THR H 1 96 THR MG . . 3.560 3.190 3.030 3.402 . 0 0 "[ . 1 . 2]" 1
1555 1 96 THR HA 1 96 THR MG . . 3.310 2.256 2.098 2.348 . 0 0 "[ . 1 . 2]" 1
1556 1 96 THR HA 1 97 PRO HD2 . . 3.230 2.186 2.021 2.248 . 0 0 "[ . 1 . 2]" 1
1557 1 96 THR HA 1 97 PRO HD3 . . 3.300 2.259 2.253 2.292 . 0 0 "[ . 1 . 2]" 1
1558 1 96 THR HA 1 97 PRO QG . . 4.460 3.878 3.797 3.911 . 0 0 "[ . 1 . 2]" 1
1559 1 96 THR HG1 1 96 THR MG . . 3.330 2.518 2.153 3.025 . 0 0 "[ . 1 . 2]" 1
1560 1 96 THR MG 1 97 PRO HD2 . . 4.110 3.162 2.987 3.514 . 0 0 "[ . 1 . 2]" 1
1561 1 96 THR MG 1 97 PRO HD3 . . 4.470 3.932 3.765 4.219 . 0 0 "[ . 1 . 2]" 1
1562 1 97 PRO HA 1 98 THR H . . 2.940 2.640 2.577 2.720 . 0 0 "[ . 1 . 2]" 1
1563 1 97 PRO HA 1 98 THR HA . . 4.670 4.482 4.414 4.556 . 0 0 "[ . 1 . 2]" 1
1564 1 97 PRO HA 1 98 THR MG . . 4.300 3.538 3.325 3.819 . 0 0 "[ . 1 . 2]" 1
1565 1 97 PRO HB2 1 98 THR H . . 3.620 2.067 1.907 2.200 . 0 0 "[ . 1 . 2]" 1
1566 1 97 PRO HB2 1 99 SER H . . 5.120 4.742 4.098 5.063 . 0 0 "[ . 1 . 2]" 1
1567 1 97 PRO HB3 1 98 THR H . . 3.780 3.207 3.148 3.260 . 0 0 "[ . 1 . 2]" 1
1568 1 97 PRO HG2 1 98 THR H . . 4.770 3.950 3.788 4.078 . 0 0 "[ . 1 . 2]" 1
1569 1 97 PRO HG3 1 98 THR H . . 4.770 4.656 4.514 4.769 . 0 0 "[ . 1 . 2]" 1
1570 1 98 THR H 1 98 THR HB . . 4.010 3.795 3.685 3.889 . 0 0 "[ . 1 . 2]" 1
1571 1 98 THR H 1 98 THR MG . . 3.560 3.044 2.825 3.283 . 0 0 "[ . 1 . 2]" 1
1572 1 98 THR H 1 99 SER H . . 4.480 4.094 3.714 4.276 . 0 0 "[ . 1 . 2]" 1
1573 1 98 THR HA 1 98 THR MG . . 3.350 2.267 2.121 2.399 . 0 0 "[ . 1 . 2]" 1
1574 1 98 THR HB 1 99 SER H . . 4.120 3.623 3.377 4.003 . 0 0 "[ . 1 . 2]" 1
1575 1 98 THR MG 1 99 SER H . . 4.710 4.049 3.891 4.205 . 0 0 "[ . 1 . 2]" 1
1576 1 99 SER QB 1 100 GLY H . . 4.810 3.554 2.401 4.047 . 0 0 "[ . 1 . 2]" 1
1577 1 100 GLY QA 1 101 PRO QD . . 3.060 1.958 1.850 2.072 . 0 0 "[ . 1 . 2]" 1
1578 1 100 GLY QA 1 101 PRO QG . . 4.940 3.700 3.642 3.878 . 0 0 "[ . 1 . 2]" 1
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