NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
573045 |
2mao   |
19366 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mao
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 1946
_Distance_constraint_stats_list.Viol_count 102
_Distance_constraint_stats_list.Viol_total 194.024
_Distance_constraint_stats_list.Viol_max 0.445
_Distance_constraint_stats_list.Viol_rms 0.0078
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0003
_Distance_constraint_stats_list.Viol_average_violations_only 0.1057
_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 4 GLN 0.000 0.000 . 0 "[ . 1 . ]"
1 5 LEU 0.014 0.014 17 0 "[ . 1 . ]"
1 6 THR 1.283 0.097 16 0 "[ . 1 . ]"
1 7 ASP 0.174 0.025 14 0 "[ . 1 . ]"
1 8 GLN 0.024 0.024 12 0 "[ . 1 . ]"
1 9 VAL 2.391 0.112 13 0 "[ . 1 . ]"
1 10 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 11 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 12 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 13 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 14 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 15 GLN 4.609 0.445 11 0 "[ . 1 . ]"
1 16 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 17 GLY 0.000 0.000 . 0 "[ . 1 . ]"
1 18 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 19 GLN 0.532 0.224 17 0 "[ . 1 . ]"
1 20 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 21 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 22 PHE 0.000 0.000 . 0 "[ . 1 . ]"
1 23 ASN 0.532 0.224 17 0 "[ . 1 . ]"
1 24 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 25 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 26 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 27 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 28 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 29 TYR 0.000 0.000 . 0 "[ . 1 . ]"
1 30 GLN 0.000 0.000 . 0 "[ . 1 . ]"
1 31 HIS 0.000 0.000 . 0 "[ . 1 . ]"
1 32 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 33 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 34 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 35 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 36 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 37 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 38 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 39 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 40 TYR 0.000 0.000 . 0 "[ . 1 . ]"
1 41 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 42 PRO 0.000 0.000 . 0 "[ . 1 . ]"
1 43 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 44 GLY 0.000 0.000 . 0 "[ . 1 . ]"
1 45 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 46 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 47 PRO 0.000 0.000 . 0 "[ . 1 . ]"
1 48 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 49 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 50 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 51 GLN 1.856 0.190 18 0 "[ . 1 . ]"
1 52 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 53 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 54 PHE 0.000 0.000 . 0 "[ . 1 . ]"
1 55 ILE 1.856 0.190 18 0 "[ . 1 . ]"
1 56 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 57 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 58 TYR 0.000 0.000 . 0 "[ . 1 . ]"
1 59 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 60 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 61 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 62 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 63 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 64 PHE 0.000 0.000 . 0 "[ . 1 . ]"
1 65 ARG 4.596 0.445 11 0 "[ . 1 . ]"
1 66 GLY 0.000 0.000 . 0 "[ . 1 . ]"
1 67 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 68 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 69 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 70 PHE 0.000 0.000 . 0 "[ . 1 . ]"
1 71 TYR 0.000 0.000 . 0 "[ . 1 . ]"
1 72 THR 0.000 0.000 . 0 "[ . 1 . ]"
1 73 TRP 0.000 0.000 . 0 "[ . 1 . ]"
1 74 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 75 TYR 0.000 0.000 . 0 "[ . 1 . ]"
1 76 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 77 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 78 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 79 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 80 ASN 0.000 0.000 . 0 "[ . 1 . ]"
1 81 THR 0.119 0.119 10 0 "[ . 1 . ]"
1 82 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 83 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 84 ASN 0.119 0.119 10 0 "[ . 1 . ]"
1 85 TYR 0.251 0.251 4 0 "[ . 1 . ]"
1 86 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 87 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 88 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 89 GLN 0.912 0.251 4 0 "[ . 1 . ]"
1 90 GLY 0.000 0.000 . 0 "[ . 1 . ]"
1 91 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 92 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 93 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 94 GLU 0.044 0.044 6 0 "[ . 1 . ]"
1 95 LEU 0.149 0.069 8 0 "[ . 1 . ]"
1 96 VAL 0.104 0.069 8 0 "[ . 1 . ]"
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 4 GLN HA 1 5 LEU H 3.180 . 3.680 2.726 2.318 3.314 . 0 0 "[ . 1 . ]" 1
2 1 4 GLN HA 1 5 LEU HA 4.340 . 4.840 4.404 4.276 4.539 . 0 0 "[ . 1 . ]" 1
3 1 4 GLN HB2 1 5 LEU HG 5.080 . 5.580 4.740 3.146 5.386 . 0 0 "[ . 1 . ]" 1
4 1 4 GLN HB3 1 5 LEU HB2 5.860 . 6.360 5.517 4.198 6.070 . 0 0 "[ . 1 . ]" 1
5 1 5 LEU H 1 5 LEU MD2 5.140 . 5.640 3.284 1.786 3.991 0.014 17 0 "[ . 1 . ]" 1
6 1 5 LEU H 1 6 THR H 5.480 . 5.980 4.540 4.401 4.652 . 0 0 "[ . 1 . ]" 1
7 1 5 LEU HA 1 8 GLN HB3 5.800 . 6.300 5.938 5.848 6.024 . 0 0 "[ . 1 . ]" 1
8 1 5 LEU HA 1 9 VAL HB 4.700 . 5.200 4.782 4.706 4.844 . 0 0 "[ . 1 . ]" 1
9 1 5 LEU HA 1 9 VAL MG1 5.420 . 5.920 2.371 2.274 2.429 . 0 0 "[ . 1 . ]" 1
10 1 5 LEU HA 1 9 VAL MG2 5.210 . 5.710 4.269 4.168 4.341 . 0 0 "[ . 1 . ]" 1
11 1 5 LEU HB2 1 6 THR H 4.840 . 5.340 3.728 3.584 3.826 . 0 0 "[ . 1 . ]" 1
12 1 5 LEU HB2 1 9 VAL H 6.300 . 6.800 6.278 6.180 6.432 . 0 0 "[ . 1 . ]" 1
13 1 5 LEU HB2 1 9 VAL MG1 5.370 . 5.870 3.538 3.434 3.697 . 0 0 "[ . 1 . ]" 1
14 1 5 LEU HB3 1 10 LEU H 5.400 . 5.900 4.350 4.193 4.480 . 0 0 "[ . 1 . ]" 1
15 1 5 LEU HB3 1 6 THR H 4.460 . 4.960 2.673 2.550 2.752 . 0 0 "[ . 1 . ]" 1
16 1 5 LEU HB3 1 6 THR HA 5.500 . 6.000 4.633 4.489 4.722 . 0 0 "[ . 1 . ]" 1
17 1 5 LEU HB3 1 9 VAL MG1 6.210 . 6.710 2.097 1.975 2.266 . 0 0 "[ . 1 . ]" 1
18 1 5 LEU HB3 1 9 VAL MG2 4.860 . 5.360 3.490 3.345 3.797 . 0 0 "[ . 1 . ]" 1
19 1 5 LEU MD1 1 9 VAL MG1 4.850 . 5.350 2.979 2.022 3.176 . 0 0 "[ . 1 . ]" 1
20 1 5 LEU MD1 1 9 VAL MG2 4.280 . 4.780 2.959 2.426 3.095 . 0 0 "[ . 1 . ]" 1
21 1 5 LEU MD2 1 6 THR H 6.080 . 6.580 3.768 3.494 4.869 . 0 0 "[ . 1 . ]" 1
22 1 6 THR H 1 6 THR HB 4.000 . 4.500 2.825 2.763 3.307 . 0 0 "[ . 1 . ]" 1
23 1 6 THR H 1 7 ASP H 4.670 . 5.170 4.429 4.375 4.443 . 0 0 "[ . 1 . ]" 1
24 1 6 THR H 1 8 GLN H 5.500 . 6.000 4.034 3.962 4.074 . 0 0 "[ . 1 . ]" 1
25 1 6 THR H 1 8 GLN HB3 5.800 . 6.300 4.260 4.169 4.411 . 0 0 "[ . 1 . ]" 1
26 1 6 THR H 1 9 VAL H 4.320 . 4.820 3.067 3.018 3.099 . 0 0 "[ . 1 . ]" 1
27 1 6 THR H 1 9 VAL MG1 5.400 . 5.900 1.740 1.703 1.772 0.097 16 0 "[ . 1 . ]" 1
28 1 6 THR HA 1 7 ASP H 3.050 . 3.550 2.556 2.525 2.598 . 0 0 "[ . 1 . ]" 1
29 1 6 THR HA 1 8 GLN H 4.450 . 4.950 4.167 4.106 4.231 . 0 0 "[ . 1 . ]" 1
30 1 6 THR HA 1 9 VAL H 5.360 . 5.860 4.962 4.897 5.028 . 0 0 "[ . 1 . ]" 1
31 1 6 THR HB 1 7 ASP H 3.360 . 3.860 3.410 3.378 3.600 . 0 0 "[ . 1 . ]" 1
32 1 6 THR HB 1 8 GLN H 3.650 . 4.150 2.796 2.620 4.115 . 0 0 "[ . 1 . ]" 1
33 1 6 THR MG 1 10 LEU HB2 6.140 . 6.640 5.181 4.898 5.244 . 0 0 "[ . 1 . ]" 1
34 1 6 THR MG 1 10 LEU MD1 7.720 . 8.220 4.803 4.085 4.939 . 0 0 "[ . 1 . ]" 1
35 1 6 THR MG 1 10 LEU MD2 6.810 . 7.310 4.758 4.727 4.835 . 0 0 "[ . 1 . ]" 1
36 1 6 THR MG 1 7 ASP H 4.970 . 5.470 1.871 1.775 3.241 0.025 14 0 "[ . 1 . ]" 1
37 1 6 THR MG 1 7 ASP HB2 6.610 . 7.110 4.430 4.327 5.408 . 0 0 "[ . 1 . ]" 1
38 1 6 THR MG 1 8 GLN H 5.680 . 6.180 2.440 1.776 2.600 0.024 12 0 "[ . 1 . ]" 1
39 1 6 THR MG 1 9 VAL H 6.490 . 6.990 4.340 2.261 4.543 . 0 0 "[ . 1 . ]" 1
40 1 7 ASP H 1 7 ASP HB2 3.650 . 4.150 3.560 3.551 3.578 . 0 0 "[ . 1 . ]" 1
41 1 7 ASP H 1 7 ASP HB3 3.930 . 4.430 2.448 2.420 2.498 . 0 0 "[ . 1 . ]" 1
42 1 7 ASP H 1 8 GLN H 3.620 . 4.120 2.817 2.715 2.837 . 0 0 "[ . 1 . ]" 1
43 1 7 ASP H 1 8 GLN HB3 4.990 . 5.490 5.008 4.960 5.031 . 0 0 "[ . 1 . ]" 1
44 1 7 ASP H 1 9 VAL H 5.020 . 5.520 4.787 4.751 4.830 . 0 0 "[ . 1 . ]" 1
45 1 7 ASP HA 1 10 LEU H 4.110 . 4.610 3.267 3.180 3.404 . 0 0 "[ . 1 . ]" 1
46 1 7 ASP HA 1 10 LEU MD2 5.000 . 5.500 3.183 3.000 3.283 . 0 0 "[ . 1 . ]" 1
47 1 7 ASP HA 1 11 VAL H 4.470 . 4.970 3.669 3.540 3.792 . 0 0 "[ . 1 . ]" 1
48 1 7 ASP HA 1 11 VAL MG2 6.610 . 7.110 3.256 3.130 3.395 . 0 0 "[ . 1 . ]" 1
49 1 7 ASP HA 1 25 LEU MD1 3.900 . 4.400 2.372 2.269 2.533 . 0 0 "[ . 1 . ]" 1
50 1 7 ASP HA 1 25 LEU MD2 5.250 . 5.750 3.561 3.459 3.676 . 0 0 "[ . 1 . ]" 1
51 1 7 ASP HA 1 8 GLN HA 4.800 . 5.300 4.823 4.781 4.851 . 0 0 "[ . 1 . ]" 1
52 1 7 ASP HB2 1 11 VAL MG2 6.610 . 7.110 3.056 2.882 3.173 . 0 0 "[ . 1 . ]" 1
53 1 7 ASP HB2 1 25 LEU MD1 6.610 . 7.110 2.890 2.800 3.006 . 0 0 "[ . 1 . ]" 1
54 1 7 ASP HB2 1 70 PHE HA 5.500 . 6.000 5.374 5.206 5.463 . 0 0 "[ . 1 . ]" 1
55 1 7 ASP HB2 1 70 PHE QD 5.340 . 5.840 2.366 2.294 2.497 . 0 0 "[ . 1 . ]" 1
56 1 7 ASP HB2 1 71 TYR H 5.460 . 5.960 5.268 4.994 5.372 . 0 0 "[ . 1 . ]" 1
57 1 7 ASP HB2 1 71 TYR HA 5.950 . 6.450 6.011 5.826 6.079 . 0 0 "[ . 1 . ]" 1
58 1 7 ASP HB2 1 8 GLN H 4.420 . 4.920 4.145 4.113 4.184 . 0 0 "[ . 1 . ]" 1
59 1 7 ASP HB3 1 11 VAL MG2 6.490 . 6.990 4.334 4.184 4.441 . 0 0 "[ . 1 . ]" 1
60 1 7 ASP HB3 1 25 LEU MD1 5.510 . 6.010 2.754 2.576 2.965 . 0 0 "[ . 1 . ]" 1
61 1 7 ASP HB3 1 70 PHE HB2 4.930 . 5.430 4.945 4.822 4.986 . 0 0 "[ . 1 . ]" 1
62 1 7 ASP HB3 1 70 PHE HB3 5.050 . 5.550 3.837 3.634 3.912 . 0 0 "[ . 1 . ]" 1
63 1 7 ASP HB3 1 70 PHE QD 5.030 . 5.530 2.918 2.774 3.043 . 0 0 "[ . 1 . ]" 1
64 1 7 ASP HB3 1 8 GLN H 4.120 . 4.620 4.238 4.210 4.253 . 0 0 "[ . 1 . ]" 1
65 1 8 GLN H 1 10 LEU H 4.910 . 5.410 3.772 3.730 3.812 . 0 0 "[ . 1 . ]" 1
66 1 8 GLN H 1 11 VAL H 4.690 . 5.190 4.720 4.696 4.738 . 0 0 "[ . 1 . ]" 1
67 1 8 GLN H 1 11 VAL MG2 6.610 . 7.110 5.023 4.969 5.067 . 0 0 "[ . 1 . ]" 1
68 1 8 GLN H 1 25 LEU MD1 6.610 . 7.110 5.266 5.149 5.439 . 0 0 "[ . 1 . ]" 1
69 1 8 GLN H 1 8 GLN HB2 3.230 . 3.730 2.579 2.560 2.613 . 0 0 "[ . 1 . ]" 1
70 1 8 GLN H 1 8 GLN HB3 3.320 . 3.820 2.384 2.357 2.468 . 0 0 "[ . 1 . ]" 1
71 1 8 GLN H 1 8 GLN HE21 5.080 . 5.580 4.971 4.927 5.012 . 0 0 "[ . 1 . ]" 1
72 1 8 GLN H 1 8 GLN HG3 4.670 . 5.170 4.387 4.367 4.433 . 0 0 "[ . 1 . ]" 1
73 1 8 GLN H 1 9 VAL H 3.580 . 4.080 2.714 2.687 2.747 . 0 0 "[ . 1 . ]" 1
74 1 8 GLN H 1 9 VAL HB 5.800 . 6.300 5.417 5.379 5.488 . 0 0 "[ . 1 . ]" 1
75 1 8 GLN H 1 9 VAL MG1 6.490 . 6.990 3.658 3.603 3.744 . 0 0 "[ . 1 . ]" 1
76 1 8 GLN HA 1 8 GLN HE21 5.500 . 6.000 2.497 2.438 2.571 . 0 0 "[ . 1 . ]" 1
77 1 8 GLN HA 1 8 GLN HG2 4.140 . 4.640 3.803 3.768 3.823 . 0 0 "[ . 1 . ]" 1
78 1 8 GLN HA 1 8 GLN HG3 4.080 . 4.580 3.199 3.161 3.219 . 0 0 "[ . 1 . ]" 1
79 1 8 GLN HB2 1 9 VAL H 4.170 . 4.670 3.812 3.785 3.856 . 0 0 "[ . 1 . ]" 1
80 1 8 GLN HB2 1 9 VAL HA 5.630 . 6.130 5.643 5.630 5.655 . 0 0 "[ . 1 . ]" 1
81 1 8 GLN HB2 1 9 VAL MG1 6.610 . 7.110 4.738 4.677 4.812 . 0 0 "[ . 1 . ]" 1
82 1 8 GLN HB3 1 9 VAL H 3.670 . 4.170 2.382 2.352 2.434 . 0 0 "[ . 1 . ]" 1
83 1 8 GLN HE21 1 11 VAL HB 5.500 . 6.000 4.148 3.907 4.320 . 0 0 "[ . 1 . ]" 1
84 1 8 GLN HE21 1 11 VAL MG1 7.040 . 7.540 4.881 4.660 5.041 . 0 0 "[ . 1 . ]" 1
85 1 8 GLN HE21 1 12 GLU HA 5.500 . 6.000 5.447 5.244 5.533 . 0 0 "[ . 1 . ]" 1
86 1 8 GLN HE21 1 12 GLU HB2 5.500 . 6.000 4.526 4.302 4.602 . 0 0 "[ . 1 . ]" 1
87 1 8 GLN HE21 1 12 GLU HB3 5.500 . 6.000 5.449 5.234 5.513 . 0 0 "[ . 1 . ]" 1
88 1 8 GLN HE21 1 12 GLU HG2 5.500 . 6.000 4.014 3.837 4.172 . 0 0 "[ . 1 . ]" 1
89 1 8 GLN HE21 1 12 GLU HG3 4.810 . 5.310 2.596 2.379 2.691 . 0 0 "[ . 1 . ]" 1
90 1 8 GLN HE21 1 9 VAL H 4.330 . 4.830 4.399 4.381 4.437 . 0 0 "[ . 1 . ]" 1
91 1 8 GLN HE22 1 11 VAL MG1 6.610 . 7.110 4.994 4.659 5.248 . 0 0 "[ . 1 . ]" 1
92 1 8 GLN HE22 1 12 GLU HG2 5.500 . 6.000 4.613 4.331 4.817 . 0 0 "[ . 1 . ]" 1
93 1 8 GLN HG2 1 9 VAL HA 5.110 . 5.610 5.161 5.114 5.185 . 0 0 "[ . 1 . ]" 1
94 1 8 GLN HG2 1 9 VAL MG1 6.450 . 6.950 4.930 4.802 5.099 . 0 0 "[ . 1 . ]" 1
95 1 8 GLN HG3 1 9 VAL MG1 6.610 . 7.110 4.228 4.107 4.388 . 0 0 "[ . 1 . ]" 1
96 1 9 VAL H 1 10 LEU H 3.400 . 3.900 2.377 2.363 2.427 . 0 0 "[ . 1 . ]" 1
97 1 9 VAL H 1 11 VAL H 4.690 . 5.190 4.034 3.979 4.074 . 0 0 "[ . 1 . ]" 1
98 1 9 VAL H 1 12 GLU H 5.140 . 5.640 4.745 4.665 4.780 . 0 0 "[ . 1 . ]" 1
99 1 9 VAL H 1 9 VAL HB 3.060 . 3.560 2.832 2.800 2.878 . 0 0 "[ . 1 . ]" 1
100 1 9 VAL H 1 9 VAL MG1 4.020 . 4.520 1.727 1.688 1.763 0.112 13 0 "[ . 1 . ]" 1
101 1 9 VAL HA 1 12 GLU H 3.990 . 4.490 3.064 2.991 3.120 . 0 0 "[ . 1 . ]" 1
102 1 9 VAL HA 1 12 GLU HB2 4.110 . 4.610 2.421 2.322 2.489 . 0 0 "[ . 1 . ]" 1
103 1 9 VAL HA 1 12 GLU HB3 4.060 . 4.560 4.076 3.988 4.118 . 0 0 "[ . 1 . ]" 1
104 1 9 VAL HA 1 12 GLU HG2 4.650 . 5.150 4.681 4.640 4.712 . 0 0 "[ . 1 . ]" 1
105 1 9 VAL HA 1 12 GLU HG3 5.150 . 5.650 3.337 3.310 3.386 . 0 0 "[ . 1 . ]" 1
106 1 9 VAL HA 1 13 ARG H 4.450 . 4.950 4.020 3.905 4.234 . 0 0 "[ . 1 . ]" 1
107 1 9 VAL HB 1 10 LEU H 4.210 . 4.710 4.251 4.232 4.269 . 0 0 "[ . 1 . ]" 1
108 1 9 VAL MG1 1 10 LEU H 5.430 . 5.930 2.439 2.419 2.473 . 0 0 "[ . 1 . ]" 1
109 1 9 VAL MG1 1 12 GLU HG3 6.940 . 7.440 5.812 5.793 5.846 . 0 0 "[ . 1 . ]" 1
110 1 9 VAL MG1 1 13 ARG HB3 6.610 . 7.110 5.382 5.278 5.539 . 0 0 "[ . 1 . ]" 1
111 1 9 VAL MG2 1 10 LEU H 5.820 . 6.320 3.666 3.613 3.714 . 0 0 "[ . 1 . ]" 1
112 1 9 VAL MG2 1 10 LEU HA 5.030 . 5.530 3.611 3.579 3.668 . 0 0 "[ . 1 . ]" 1
113 1 9 VAL MG2 1 10 LEU HG 5.980 . 6.480 5.023 4.976 5.078 . 0 0 "[ . 1 . ]" 1
114 1 9 VAL MG2 1 12 GLU HG3 6.610 . 7.110 5.026 4.935 5.147 . 0 0 "[ . 1 . ]" 1
115 1 9 VAL MG2 1 13 ARG H 5.990 . 6.490 3.844 3.769 3.982 . 0 0 "[ . 1 . ]" 1
116 1 9 VAL MG2 1 13 ARG HB3 5.720 . 6.220 4.017 3.405 4.162 . 0 0 "[ . 1 . ]" 1
117 1 9 VAL MG2 1 13 ARG QD 5.650 . 6.150 3.809 2.829 4.178 . 0 0 "[ . 1 . ]" 1
118 1 10 LEU H 1 10 LEU HB2 3.360 . 3.860 2.113 2.090 2.132 . 0 0 "[ . 1 . ]" 1
119 1 10 LEU H 1 10 LEU HG 4.000 . 4.500 4.121 4.093 4.141 . 0 0 "[ . 1 . ]" 1
120 1 10 LEU H 1 10 LEU MD1 4.720 . 5.220 2.493 2.455 2.525 . 0 0 "[ . 1 . ]" 1
121 1 10 LEU H 1 10 LEU MD2 5.130 . 5.630 3.776 3.610 3.817 . 0 0 "[ . 1 . ]" 1
122 1 10 LEU H 1 11 VAL H 3.650 . 4.150 2.623 2.603 2.637 . 0 0 "[ . 1 . ]" 1
123 1 10 LEU H 1 11 VAL MG2 5.850 . 6.350 4.330 4.307 4.357 . 0 0 "[ . 1 . ]" 1
124 1 10 LEU H 1 25 LEU MD1 6.610 . 7.110 4.353 4.291 4.435 . 0 0 "[ . 1 . ]" 1
125 1 10 LEU HA 1 10 LEU MD1 4.010 . 4.510 2.204 2.143 2.248 . 0 0 "[ . 1 . ]" 1
126 1 10 LEU HA 1 13 ARG QD 4.690 . 5.190 3.778 2.751 4.312 . 0 0 "[ . 1 . ]" 1
127 1 10 LEU HA 1 21 ALA MB 4.760 . 5.260 2.957 2.906 3.107 . 0 0 "[ . 1 . ]" 1
128 1 10 LEU HB2 1 11 VAL H 4.470 . 4.970 3.174 3.094 3.225 . 0 0 "[ . 1 . ]" 1
129 1 10 LEU HB2 1 25 LEU HB2 5.450 . 5.950 3.927 3.827 4.117 . 0 0 "[ . 1 . ]" 1
130 1 10 LEU HB2 1 25 LEU MD1 4.490 . 4.990 2.511 2.441 2.600 . 0 0 "[ . 1 . ]" 1
131 1 10 LEU HB2 1 25 LEU MD2 5.740 . 6.240 3.408 3.336 3.477 . 0 0 "[ . 1 . ]" 1
132 1 10 LEU HB3 1 11 VAL H 4.340 . 4.840 3.563 3.531 3.589 . 0 0 "[ . 1 . ]" 1
133 1 10 LEU HB3 1 21 ALA MB 5.320 . 5.820 3.834 3.696 3.940 . 0 0 "[ . 1 . ]" 1
134 1 10 LEU HB3 1 25 LEU MD2 4.170 . 4.670 2.299 2.250 2.370 . 0 0 "[ . 1 . ]" 1
135 1 10 LEU HG 1 11 VAL H 5.250 . 5.750 5.255 5.230 5.277 . 0 0 "[ . 1 . ]" 1
136 1 10 LEU HG 1 11 VAL MG2 6.850 . 7.350 5.708 5.613 5.733 . 0 0 "[ . 1 . ]" 1
137 1 10 LEU HG 1 25 LEU MD1 5.520 . 6.020 3.860 3.775 3.941 . 0 0 "[ . 1 . ]" 1
138 1 10 LEU MD1 1 21 ALA MB 5.130 . 5.630 3.602 3.570 3.647 . 0 0 "[ . 1 . ]" 1
139 1 10 LEU MD1 1 25 LEU MD1 6.370 . 6.870 3.936 3.895 3.994 . 0 0 "[ . 1 . ]" 1
140 1 10 LEU MD2 1 11 VAL H 6.560 . 7.060 4.961 4.863 5.005 . 0 0 "[ . 1 . ]" 1
141 1 10 LEU MD2 1 21 ALA HA 6.100 . 6.600 4.636 4.461 4.870 . 0 0 "[ . 1 . ]" 1
142 1 10 LEU MD2 1 21 ALA MB 7.280 . 7.780 3.997 3.797 4.157 . 0 0 "[ . 1 . ]" 1
143 1 10 LEU MD2 1 24 LEU HB3 5.130 . 5.630 3.754 3.544 3.949 . 0 0 "[ . 1 . ]" 1
144 1 10 LEU MD2 1 25 LEU H 5.700 . 6.200 3.740 3.590 3.979 . 0 0 "[ . 1 . ]" 1
145 1 10 LEU MD2 1 25 LEU HB2 5.640 . 6.140 2.292 2.187 2.474 . 0 0 "[ . 1 . ]" 1
146 1 10 LEU MD2 1 25 LEU HG 5.000 . 5.500 4.206 4.165 4.254 . 0 0 "[ . 1 . ]" 1
147 1 10 LEU MD2 1 25 LEU MD1 4.530 . 5.030 2.122 2.050 2.169 . 0 0 "[ . 1 . ]" 1
148 1 10 LEU MD2 1 25 LEU MD2 5.750 . 6.250 3.474 3.423 3.517 . 0 0 "[ . 1 . ]" 1
149 1 11 VAL H 1 11 VAL HB 3.070 . 3.570 2.385 2.358 2.399 . 0 0 "[ . 1 . ]" 1
150 1 11 VAL H 1 11 VAL MG2 4.000 . 4.500 2.528 2.503 2.544 . 0 0 "[ . 1 . ]" 1
151 1 11 VAL H 1 12 GLU H 3.460 . 3.960 2.417 2.404 2.442 . 0 0 "[ . 1 . ]" 1
152 1 11 VAL H 1 12 GLU HB3 5.910 . 6.410 5.959 5.944 5.980 . 0 0 "[ . 1 . ]" 1
153 1 11 VAL H 1 13 ARG H 4.330 . 4.830 3.963 3.848 4.170 . 0 0 "[ . 1 . ]" 1
154 1 11 VAL H 1 25 LEU MD1 5.860 . 6.360 4.389 4.337 4.444 . 0 0 "[ . 1 . ]" 1
155 1 11 VAL H 1 25 LEU MD2 5.460 . 5.960 3.788 3.724 3.866 . 0 0 "[ . 1 . ]" 1
156 1 11 VAL HA 1 12 GLU HA 4.860 . 5.360 4.759 4.735 4.784 . 0 0 "[ . 1 . ]" 1
157 1 11 VAL HA 1 25 LEU MD1 5.860 . 6.360 4.924 4.890 4.952 . 0 0 "[ . 1 . ]" 1
158 1 11 VAL HB 1 12 GLU H 3.680 . 4.180 3.062 3.028 3.097 . 0 0 "[ . 1 . ]" 1
159 1 11 VAL HB 1 15 GLN HE21 5.500 . 6.000 5.805 5.596 5.881 . 0 0 "[ . 1 . ]" 1
160 1 11 VAL HB 1 64 PHE QD 5.290 . 5.790 4.277 3.955 4.645 . 0 0 "[ . 1 . ]" 1
161 1 11 VAL HB 1 64 PHE QE 5.460 . 5.960 4.072 3.715 4.679 . 0 0 "[ . 1 . ]" 1
162 1 11 VAL MG1 1 12 GLU H 4.880 . 5.380 3.612 3.575 3.638 . 0 0 "[ . 1 . ]" 1
163 1 11 VAL MG1 1 12 GLU HA 4.980 . 5.480 3.566 3.500 3.601 . 0 0 "[ . 1 . ]" 1
164 1 11 VAL MG1 1 12 GLU HG2 6.610 . 7.110 4.443 4.387 4.506 . 0 0 "[ . 1 . ]" 1
165 1 11 VAL MG1 1 12 GLU HG3 5.140 . 5.640 4.049 3.979 4.098 . 0 0 "[ . 1 . ]" 1
166 1 11 VAL MG1 1 14 VAL HB 6.560 . 7.060 5.490 5.467 5.522 . 0 0 "[ . 1 . ]" 1
167 1 11 VAL MG1 1 14 VAL MG1 7.930 . 8.430 4.735 4.708 4.783 . 0 0 "[ . 1 . ]" 1
168 1 11 VAL MG1 1 15 GLN HE22 5.940 . 6.440 2.938 2.898 2.972 . 0 0 "[ . 1 . ]" 1
169 1 11 VAL MG1 1 15 GLN HE21 5.450 . 5.950 2.928 2.793 2.976 . 0 0 "[ . 1 . ]" 1
170 1 11 VAL MG1 1 15 GLN HG2 4.940 . 5.440 4.150 4.125 4.200 . 0 0 "[ . 1 . ]" 1
171 1 11 VAL MG1 1 15 GLN HG3 6.320 . 6.820 3.108 3.070 3.181 . 0 0 "[ . 1 . ]" 1
172 1 11 VAL MG1 1 61 LEU HB2 6.520 . 7.020 4.791 4.716 4.903 . 0 0 "[ . 1 . ]" 1
173 1 11 VAL MG1 1 61 LEU HG 5.580 . 6.080 2.496 2.414 2.601 . 0 0 "[ . 1 . ]" 1
174 1 11 VAL MG1 1 61 LEU MD2 4.270 . 4.770 2.438 2.387 2.536 . 0 0 "[ . 1 . ]" 1
175 1 11 VAL MG1 1 62 ASP HA 6.610 . 7.110 5.485 5.371 5.555 . 0 0 "[ . 1 . ]" 1
176 1 11 VAL MG1 1 64 PHE H 6.330 . 6.830 4.952 4.609 5.223 . 0 0 "[ . 1 . ]" 1
177 1 11 VAL MG1 1 64 PHE HB2 6.610 . 7.110 4.197 3.883 4.801 . 0 0 "[ . 1 . ]" 1
178 1 11 VAL MG1 1 64 PHE HB3 6.200 . 6.700 3.226 2.858 3.590 . 0 0 "[ . 1 . ]" 1
179 1 11 VAL MG1 1 64 PHE HZ 6.400 . 6.900 4.857 4.574 5.333 . 0 0 "[ . 1 . ]" 1
180 1 11 VAL MG1 1 64 PHE QD 4.250 . 4.750 2.135 2.086 2.206 . 0 0 "[ . 1 . ]" 1
181 1 11 VAL MG1 1 64 PHE QE 5.060 . 5.560 3.021 2.839 3.232 . 0 0 "[ . 1 . ]" 1
182 1 11 VAL MG1 1 70 PHE QE 6.750 . 7.250 4.015 3.896 4.223 . 0 0 "[ . 1 . ]" 1
183 1 11 VAL MG2 1 12 GLU H 5.330 . 5.830 4.148 4.139 4.164 . 0 0 "[ . 1 . ]" 1
184 1 11 VAL MG2 1 12 GLU HG3 6.580 . 7.080 5.332 5.272 5.392 . 0 0 "[ . 1 . ]" 1
185 1 11 VAL MG2 1 13 ARG H 6.610 . 7.110 5.399 5.306 5.516 . 0 0 "[ . 1 . ]" 1
186 1 11 VAL MG2 1 14 VAL H 6.500 . 7.000 5.130 5.102 5.189 . 0 0 "[ . 1 . ]" 1
187 1 11 VAL MG2 1 14 VAL MG1 7.930 . 8.430 4.329 4.274 4.356 . 0 0 "[ . 1 . ]" 1
188 1 11 VAL MG2 1 14 VAL MG2 7.930 . 8.430 3.284 3.247 3.330 . 0 0 "[ . 1 . ]" 1
189 1 11 VAL MG2 1 25 LEU HB2 6.180 . 6.680 4.669 4.617 4.770 . 0 0 "[ . 1 . ]" 1
190 1 11 VAL MG2 1 25 LEU MD1 5.540 . 6.040 3.174 3.131 3.234 . 0 0 "[ . 1 . ]" 1
191 1 11 VAL MG2 1 61 LEU HB3 6.610 . 7.110 5.533 5.517 5.589 . 0 0 "[ . 1 . ]" 1
192 1 11 VAL MG2 1 61 LEU MD1 5.540 . 6.040 2.350 2.297 2.444 . 0 0 "[ . 1 . ]" 1
193 1 11 VAL MG2 1 61 LEU MD2 5.670 . 6.170 2.424 2.374 2.464 . 0 0 "[ . 1 . ]" 1
194 1 11 VAL MG2 1 64 PHE HB3 6.610 . 7.110 4.979 4.630 5.247 . 0 0 "[ . 1 . ]" 1
195 1 11 VAL MG2 1 64 PHE QD 5.310 . 5.810 3.885 3.660 3.982 . 0 0 "[ . 1 . ]" 1
196 1 11 VAL MG2 1 64 PHE QE 5.160 . 5.660 3.726 3.454 3.833 . 0 0 "[ . 1 . ]" 1
197 1 11 VAL MG2 1 70 PHE HA 6.330 . 6.830 4.475 4.095 4.612 . 0 0 "[ . 1 . ]" 1
198 1 11 VAL MG2 1 70 PHE HB2 6.610 . 7.110 2.998 2.412 3.207 . 0 0 "[ . 1 . ]" 1
199 1 11 VAL MG2 1 70 PHE HB3 6.460 . 6.960 3.930 3.460 4.100 . 0 0 "[ . 1 . ]" 1
200 1 11 VAL MG2 1 70 PHE QD 4.810 . 5.310 2.731 2.566 2.826 . 0 0 "[ . 1 . ]" 1
201 1 11 VAL MG2 1 70 PHE QE 6.000 . 6.500 3.031 2.913 3.194 . 0 0 "[ . 1 . ]" 1
202 1 12 GLU H 1 12 GLU HB2 3.600 . 4.100 2.329 2.294 2.374 . 0 0 "[ . 1 . ]" 1
203 1 12 GLU H 1 12 GLU HB3 3.600 . 4.100 3.571 3.551 3.590 . 0 0 "[ . 1 . ]" 1
204 1 12 GLU H 1 12 GLU HG2 3.720 . 4.220 3.659 3.610 3.718 . 0 0 "[ . 1 . ]" 1
205 1 12 GLU H 1 12 GLU HG3 4.250 . 4.750 2.482 2.433 2.564 . 0 0 "[ . 1 . ]" 1
206 1 12 GLU H 1 14 VAL H 4.590 . 5.090 4.257 4.205 4.306 . 0 0 "[ . 1 . ]" 1
207 1 12 GLU HA 1 12 GLU HG2 4.040 . 4.540 2.410 2.374 2.433 . 0 0 "[ . 1 . ]" 1
208 1 12 GLU HA 1 12 GLU HG3 3.930 . 4.430 2.942 2.893 2.960 . 0 0 "[ . 1 . ]" 1
209 1 12 GLU HA 1 15 GLN H 3.960 . 4.460 3.555 3.469 3.727 . 0 0 "[ . 1 . ]" 1
210 1 12 GLU HA 1 15 GLN HB2 3.700 . 4.200 2.761 2.627 2.962 . 0 0 "[ . 1 . ]" 1
211 1 12 GLU HB2 1 15 GLN H 5.500 . 6.000 5.563 5.512 5.636 . 0 0 "[ . 1 . ]" 1
212 1 12 GLU HB2 1 16 LYS QE 4.750 . 5.250 4.110 3.639 4.310 . 0 0 "[ . 1 . ]" 1
213 1 12 GLU HB3 1 13 ARG H 3.600 . 4.100 3.659 3.615 3.688 . 0 0 "[ . 1 . ]" 1
214 1 12 GLU HB3 1 16 LYS QE 5.130 . 5.630 2.654 2.351 2.964 . 0 0 "[ . 1 . ]" 1
215 1 12 GLU HG2 1 13 ARG H 5.210 . 5.710 5.093 5.059 5.151 . 0 0 "[ . 1 . ]" 1
216 1 12 GLU HG2 1 16 LYS QE 5.040 . 5.540 4.240 3.922 4.595 . 0 0 "[ . 1 . ]" 1
217 1 12 GLU HG3 1 13 ARG H 5.190 . 5.690 4.529 4.486 4.629 . 0 0 "[ . 1 . ]" 1
218 1 13 ARG H 1 13 ARG HB2 3.730 . 4.230 2.648 2.453 3.677 . 0 0 "[ . 1 . ]" 1
219 1 13 ARG H 1 13 ARG HB3 3.890 . 4.390 2.451 2.390 2.635 . 0 0 "[ . 1 . ]" 1
220 1 13 ARG H 1 13 ARG QD 5.120 . 5.620 4.434 3.717 4.622 . 0 0 "[ . 1 . ]" 1
221 1 13 ARG H 1 14 VAL H 3.450 . 3.950 2.662 2.534 2.737 . 0 0 "[ . 1 . ]" 1
222 1 13 ARG H 1 14 VAL MG1 6.000 . 6.500 4.117 4.057 4.204 . 0 0 "[ . 1 . ]" 1
223 1 13 ARG H 1 21 ALA MB 5.870 . 6.370 4.326 4.264 4.438 . 0 0 "[ . 1 . ]" 1
224 1 13 ARG HA 1 13 ARG QG 3.780 . 4.280 2.464 2.298 3.327 . 0 0 "[ . 1 . ]" 1
225 1 13 ARG HA 1 14 VAL HA 5.000 . 5.500 4.726 4.707 4.742 . 0 0 "[ . 1 . ]" 1
226 1 13 ARG HA 1 16 LYS H 4.230 . 4.730 3.172 2.773 3.294 . 0 0 "[ . 1 . ]" 1
227 1 13 ARG HA 1 16 LYS HB3 4.020 . 4.520 3.973 3.535 4.219 . 0 0 "[ . 1 . ]" 1
228 1 13 ARG HA 1 16 LYS HD3 5.260 . 5.760 4.456 3.970 5.206 . 0 0 "[ . 1 . ]" 1
229 1 13 ARG HA 1 18 ASP H 5.120 . 5.620 4.515 4.134 4.628 . 0 0 "[ . 1 . ]" 1
230 1 13 ARG HA 1 18 ASP HB2 5.140 . 5.640 3.936 3.825 4.117 . 0 0 "[ . 1 . ]" 1
231 1 13 ARG HA 1 21 ALA MB 6.270 . 6.770 4.633 4.514 5.120 . 0 0 "[ . 1 . ]" 1
232 1 13 ARG HB2 1 14 VAL H 5.390 . 5.890 4.066 3.965 4.216 . 0 0 "[ . 1 . ]" 1
233 1 13 ARG HB2 1 18 ASP HB2 4.790 . 5.290 4.509 2.636 4.806 . 0 0 "[ . 1 . ]" 1
234 1 13 ARG HB2 1 18 ASP HB3 5.500 . 6.000 5.418 3.928 5.670 . 0 0 "[ . 1 . ]" 1
235 1 13 ARG HB2 1 21 ALA MB 5.080 . 5.580 3.755 3.656 3.933 . 0 0 "[ . 1 . ]" 1
236 1 13 ARG HB3 1 21 ALA MB 5.990 . 6.490 2.734 2.473 4.370 . 0 0 "[ . 1 . ]" 1
237 1 13 ARG QD 1 14 VAL MG1 7.410 . 7.910 4.414 3.955 5.103 . 0 0 "[ . 1 . ]" 1
238 1 13 ARG QD 1 18 ASP HB2 5.690 . 6.190 3.693 3.106 3.966 . 0 0 "[ . 1 . ]" 1
239 1 13 ARG QD 1 18 ASP HB3 6.170 . 6.670 3.561 3.097 4.248 . 0 0 "[ . 1 . ]" 1
240 1 13 ARG QD 1 21 ALA MB 5.650 . 6.150 2.124 1.899 2.998 . 0 0 "[ . 1 . ]" 1
241 1 13 ARG QG 1 14 VAL H 4.120 . 4.620 3.591 2.574 3.756 . 0 0 "[ . 1 . ]" 1
242 1 13 ARG QG 1 14 VAL MG1 5.720 . 6.220 3.527 2.661 3.733 . 0 0 "[ . 1 . ]" 1
243 1 13 ARG QG 1 18 ASP H 4.400 . 4.900 3.712 3.566 4.121 . 0 0 "[ . 1 . ]" 1
244 1 13 ARG QG 1 18 ASP HB2 4.830 . 5.330 2.045 1.934 2.469 . 0 0 "[ . 1 . ]" 1
245 1 13 ARG QG 1 18 ASP HB3 4.730 . 5.230 2.659 2.526 3.474 . 0 0 "[ . 1 . ]" 1
246 1 13 ARG QG 1 20 LYS QE 6.680 . 7.180 4.068 3.780 4.828 . 0 0 "[ . 1 . ]" 1
247 1 13 ARG QG 1 21 ALA MB 4.740 . 5.240 2.265 2.017 2.409 . 0 0 "[ . 1 . ]" 1
248 1 14 VAL H 1 14 VAL HB 3.630 . 4.130 3.630 3.618 3.652 . 0 0 "[ . 1 . ]" 1
249 1 14 VAL H 1 14 VAL MG1 3.990 . 4.490 2.168 2.131 2.247 . 0 0 "[ . 1 . ]" 1
250 1 14 VAL H 1 15 GLN H 3.440 . 3.940 2.549 2.493 2.566 . 0 0 "[ . 1 . ]" 1
251 1 14 VAL H 1 15 GLN HA 5.500 . 6.000 5.213 5.179 5.224 . 0 0 "[ . 1 . ]" 1
252 1 14 VAL H 1 15 GLN HG2 5.860 . 6.360 5.923 5.890 5.962 . 0 0 "[ . 1 . ]" 1
253 1 14 VAL H 1 16 LYS H 4.730 . 5.230 3.898 3.837 3.952 . 0 0 "[ . 1 . ]" 1
254 1 14 VAL H 1 18 ASP HB2 5.350 . 5.850 4.738 4.339 5.009 . 0 0 "[ . 1 . ]" 1
255 1 14 VAL H 1 18 ASP HB3 5.670 . 6.170 5.794 5.746 5.838 . 0 0 "[ . 1 . ]" 1
256 1 14 VAL H 1 21 ALA MB 5.340 . 5.840 3.395 3.302 3.580 . 0 0 "[ . 1 . ]" 1
257 1 14 VAL H 1 25 LEU MD2 6.610 . 7.110 5.043 4.941 5.220 . 0 0 "[ . 1 . ]" 1
258 1 14 VAL H 1 61 LEU MD2 5.850 . 6.350 4.679 4.653 4.712 . 0 0 "[ . 1 . ]" 1
259 1 14 VAL HA 1 15 GLN HA 5.040 . 5.540 4.728 4.694 4.750 . 0 0 "[ . 1 . ]" 1
260 1 14 VAL HA 1 16 LYS H 4.370 . 4.870 3.809 3.700 4.006 . 0 0 "[ . 1 . ]" 1
261 1 14 VAL HA 1 17 GLY H 4.900 . 5.400 3.423 3.195 3.548 . 0 0 "[ . 1 . ]" 1
262 1 14 VAL HA 1 18 ASP H 3.230 . 3.730 2.949 2.812 3.017 . 0 0 "[ . 1 . ]" 1
263 1 14 VAL HA 1 18 ASP HB2 4.290 . 4.790 3.496 3.353 3.693 . 0 0 "[ . 1 . ]" 1
264 1 14 VAL HA 1 18 ASP HB3 4.590 . 5.090 4.373 4.270 4.565 . 0 0 "[ . 1 . ]" 1
265 1 14 VAL HA 1 21 ALA MB 5.070 . 5.570 3.421 3.313 3.592 . 0 0 "[ . 1 . ]" 1
266 1 14 VAL HA 1 22 PHE HB3 5.500 . 6.000 5.613 5.583 5.630 . 0 0 "[ . 1 . ]" 1
267 1 14 VAL HB 1 15 GLN H 4.000 . 4.500 4.044 4.017 4.063 . 0 0 "[ . 1 . ]" 1
268 1 14 VAL HB 1 21 ALA MB 6.490 . 6.990 4.379 4.333 4.434 . 0 0 "[ . 1 . ]" 1
269 1 14 VAL HB 1 22 PHE QD 6.170 . 6.670 4.039 3.977 4.089 . 0 0 "[ . 1 . ]" 1
270 1 14 VAL HB 1 25 LEU MD2 6.170 . 6.670 5.150 5.040 5.186 . 0 0 "[ . 1 . ]" 1
271 1 14 VAL HB 1 61 LEU MD2 4.420 . 4.920 3.372 3.308 3.443 . 0 0 "[ . 1 . ]" 1
272 1 14 VAL MG1 1 15 GLN H 5.910 . 6.410 4.028 4.015 4.050 . 0 0 "[ . 1 . ]" 1
273 1 14 VAL MG1 1 18 ASP H 6.610 . 7.110 4.610 4.431 4.695 . 0 0 "[ . 1 . ]" 1
274 1 14 VAL MG1 1 18 ASP HB2 6.610 . 7.110 4.280 3.839 4.583 . 0 0 "[ . 1 . ]" 1
275 1 14 VAL MG1 1 18 ASP HB3 6.460 . 6.960 4.461 4.313 4.571 . 0 0 "[ . 1 . ]" 1
276 1 14 VAL MG1 1 19 GLN HA 5.720 . 6.220 2.902 2.776 3.030 . 0 0 "[ . 1 . ]" 1
277 1 14 VAL MG1 1 20 LYS QE 8.090 . 8.590 5.839 5.745 6.042 . 0 0 "[ . 1 . ]" 1
278 1 14 VAL MG1 1 21 ALA H 5.550 . 6.050 3.018 2.986 3.102 . 0 0 "[ . 1 . ]" 1
279 1 14 VAL MG1 1 21 ALA MB 5.050 . 5.550 2.012 1.997 2.027 . 0 0 "[ . 1 . ]" 1
280 1 14 VAL MG1 1 22 PHE H 4.430 . 4.930 2.235 2.199 2.287 . 0 0 "[ . 1 . ]" 1
281 1 14 VAL MG1 1 22 PHE HA 4.260 . 4.760 2.333 2.286 2.403 . 0 0 "[ . 1 . ]" 1
282 1 14 VAL MG1 1 22 PHE HB2 4.420 . 4.920 1.988 1.970 2.013 . 0 0 "[ . 1 . ]" 1
283 1 14 VAL MG1 1 22 PHE HB3 4.310 . 4.810 3.215 3.197 3.245 . 0 0 "[ . 1 . ]" 1
284 1 14 VAL MG1 1 22 PHE QD 4.120 . 4.620 2.675 2.653 2.700 . 0 0 "[ . 1 . ]" 1
285 1 14 VAL MG1 1 22 PHE QE 6.340 . 6.840 4.734 4.713 4.760 . 0 0 "[ . 1 . ]" 1
286 1 14 VAL MG1 1 23 ASN H 6.500 . 7.000 4.190 4.157 4.252 . 0 0 "[ . 1 . ]" 1
287 1 14 VAL MG1 1 25 LEU HB2 6.510 . 7.010 3.939 3.851 3.999 . 0 0 "[ . 1 . ]" 1
288 1 14 VAL MG1 1 25 LEU MD2 5.960 . 6.460 3.213 3.139 3.248 . 0 0 "[ . 1 . ]" 1
289 1 14 VAL MG1 1 58 TYR QD 6.230 . 6.730 4.108 4.051 4.171 . 0 0 "[ . 1 . ]" 1
290 1 14 VAL MG1 1 58 TYR QE 5.660 . 6.160 3.283 3.230 3.329 . 0 0 "[ . 1 . ]" 1
291 1 14 VAL MG1 1 61 LEU HG 6.790 . 7.290 5.542 5.492 5.599 . 0 0 "[ . 1 . ]" 1
292 1 14 VAL MG1 1 61 LEU MD1 7.540 . 8.040 5.276 5.253 5.308 . 0 0 "[ . 1 . ]" 1
293 1 14 VAL MG1 1 61 LEU MD2 6.030 . 6.530 3.361 3.328 3.390 . 0 0 "[ . 1 . ]" 1
294 1 14 VAL MG2 1 15 GLN H 5.130 . 5.630 2.478 2.445 2.528 . 0 0 "[ . 1 . ]" 1
295 1 14 VAL MG2 1 15 GLN HA 5.860 . 6.360 3.587 3.542 3.647 . 0 0 "[ . 1 . ]" 1
296 1 14 VAL MG2 1 15 GLN HG2 6.610 . 7.110 3.562 3.507 3.615 . 0 0 "[ . 1 . ]" 1
297 1 14 VAL MG2 1 15 GLN HG3 6.610 . 7.110 2.403 2.341 2.487 . 0 0 "[ . 1 . ]" 1
298 1 14 VAL MG2 1 17 GLY H 6.520 . 7.020 4.964 4.849 5.050 . 0 0 "[ . 1 . ]" 1
299 1 14 VAL MG2 1 18 ASP H 6.520 . 7.020 5.436 5.321 5.478 . 0 0 "[ . 1 . ]" 1
300 1 14 VAL MG2 1 19 GLN HA 6.000 . 6.500 4.886 4.780 5.015 . 0 0 "[ . 1 . ]" 1
301 1 14 VAL MG2 1 21 ALA MB 6.750 . 7.250 3.966 3.928 4.005 . 0 0 "[ . 1 . ]" 1
302 1 14 VAL MG2 1 22 PHE HB2 5.670 . 6.170 3.365 3.327 3.400 . 0 0 "[ . 1 . ]" 1
303 1 14 VAL MG2 1 22 PHE HB3 5.870 . 6.370 4.879 4.841 4.909 . 0 0 "[ . 1 . ]" 1
304 1 14 VAL MG2 1 22 PHE QD 4.460 . 4.960 2.938 2.905 2.993 . 0 0 "[ . 1 . ]" 1
305 1 14 VAL MG2 1 22 PHE QE 6.040 . 6.540 4.414 4.345 4.469 . 0 0 "[ . 1 . ]" 1
306 1 14 VAL MG2 1 25 LEU MD2 7.370 . 7.870 3.268 3.158 3.316 . 0 0 "[ . 1 . ]" 1
307 1 14 VAL MG2 1 58 TYR HA 6.610 . 7.110 4.859 4.785 4.945 . 0 0 "[ . 1 . ]" 1
308 1 14 VAL MG2 1 58 TYR QD 4.950 . 5.450 3.759 3.744 3.774 . 0 0 "[ . 1 . ]" 1
309 1 14 VAL MG2 1 58 TYR QE 4.580 . 5.080 3.393 3.320 3.417 . 0 0 "[ . 1 . ]" 1
310 1 14 VAL MG2 1 61 LEU HB2 5.840 . 6.340 4.651 4.623 4.675 . 0 0 "[ . 1 . ]" 1
311 1 14 VAL MG2 1 61 LEU MD2 5.000 . 5.500 1.853 1.839 1.871 . 0 0 "[ . 1 . ]" 1
312 1 15 GLN H 1 15 GLN HB2 3.940 . 4.440 2.337 2.319 2.382 . 0 0 "[ . 1 . ]" 1
313 1 15 GLN H 1 15 GLN HB3 3.660 . 4.160 3.578 3.567 3.603 . 0 0 "[ . 1 . ]" 1
314 1 15 GLN H 1 15 GLN HE22 5.500 . 6.000 5.944 5.912 5.978 . 0 0 "[ . 1 . ]" 1
315 1 15 GLN H 1 15 GLN HG2 3.690 . 4.190 3.730 3.706 3.750 . 0 0 "[ . 1 . ]" 1
316 1 15 GLN H 1 15 GLN HG3 4.140 . 4.640 2.513 2.483 2.546 . 0 0 "[ . 1 . ]" 1
317 1 15 GLN H 1 16 LYS H 3.560 . 4.060 2.443 2.421 2.468 . 0 0 "[ . 1 . ]" 1
318 1 15 GLN H 1 17 GLY H 4.730 . 5.230 3.988 3.888 4.082 . 0 0 "[ . 1 . ]" 1
319 1 15 GLN H 1 18 ASP H 5.170 . 5.670 4.977 4.901 5.068 . 0 0 "[ . 1 . ]" 1
320 1 15 GLN H 1 21 ALA MB 6.610 . 7.110 5.401 5.313 5.563 . 0 0 "[ . 1 . ]" 1
321 1 15 GLN HA 1 15 GLN HE22 5.500 . 6.000 5.968 5.937 6.013 0.013 11 0 "[ . 1 . ]" 1
322 1 15 GLN HA 1 15 GLN HG2 3.860 . 4.360 2.477 2.440 2.517 . 0 0 "[ . 1 . ]" 1
323 1 15 GLN HA 1 15 GLN HG3 3.790 . 4.290 2.905 2.871 2.959 . 0 0 "[ . 1 . ]" 1
324 1 15 GLN HA 1 17 GLY H 4.330 . 4.830 3.588 3.376 3.981 . 0 0 "[ . 1 . ]" 1
325 1 15 GLN HA 1 62 ASP HA 5.020 . 5.520 4.324 4.010 4.640 . 0 0 "[ . 1 . ]" 1
326 1 15 GLN HB2 1 15 GLN HE22 5.000 . 5.500 4.711 4.695 4.739 . 0 0 "[ . 1 . ]" 1
327 1 15 GLN HB2 1 16 LYS H 4.110 . 4.610 3.203 2.992 3.298 . 0 0 "[ . 1 . ]" 1
328 1 15 GLN HB2 1 16 LYS HA 5.450 . 5.950 4.726 4.625 4.791 . 0 0 "[ . 1 . ]" 1
329 1 15 GLN HB2 1 16 LYS QE 4.690 . 5.190 4.105 3.716 4.270 . 0 0 "[ . 1 . ]" 1
330 1 15 GLN HE22 1 61 LEU HG 5.500 . 6.000 4.107 4.032 4.269 . 0 0 "[ . 1 . ]" 1
331 1 15 GLN HE22 1 62 ASP HA 4.330 . 4.830 4.582 4.405 4.806 . 0 0 "[ . 1 . ]" 1
332 1 15 GLN HE22 1 63 SER H 5.500 . 6.000 5.571 5.363 5.771 . 0 0 "[ . 1 . ]" 1
333 1 15 GLN HE22 1 64 PHE H 4.440 . 4.940 3.812 3.581 4.116 . 0 0 "[ . 1 . ]" 1
334 1 15 GLN HE22 1 64 PHE HB3 4.870 . 5.370 2.787 2.483 3.195 . 0 0 "[ . 1 . ]" 1
335 1 15 GLN HE22 1 64 PHE QD 4.250 . 4.750 3.063 2.754 3.645 . 0 0 "[ . 1 . ]" 1
336 1 15 GLN HE21 1 62 ASP HA 4.850 . 5.350 3.313 3.214 3.534 . 0 0 "[ . 1 . ]" 1
337 1 15 GLN HE21 1 64 PHE H 4.970 . 5.470 3.402 3.192 3.663 . 0 0 "[ . 1 . ]" 1
338 1 15 GLN HE21 1 64 PHE HB2 5.360 . 5.860 4.274 3.989 4.671 . 0 0 "[ . 1 . ]" 1
339 1 15 GLN HE21 1 64 PHE HB3 5.220 . 5.720 2.783 2.519 3.044 . 0 0 "[ . 1 . ]" 1
340 1 15 GLN HE21 1 64 PHE QD 4.960 . 5.460 3.769 3.555 3.873 . 0 0 "[ . 1 . ]" 1
341 1 15 GLN HE21 1 65 ARG H 5.500 . 6.000 6.254 5.984 6.445 0.445 11 0 "[ . 1 . ]" 1
342 1 15 GLN HG2 1 16 LYS H 5.350 . 5.850 5.251 5.210 5.303 . 0 0 "[ . 1 . ]" 1
343 1 15 GLN HG2 1 61 LEU HB3 5.500 . 6.000 4.903 4.765 4.988 . 0 0 "[ . 1 . ]" 1
344 1 15 GLN HG2 1 61 LEU MD2 5.310 . 5.810 4.478 4.440 4.501 . 0 0 "[ . 1 . ]" 1
345 1 15 GLN HG2 1 62 ASP HA 5.500 . 6.000 2.711 2.461 2.857 . 0 0 "[ . 1 . ]" 1
346 1 15 GLN HE22 1 15 GLN HG3 4.080 . 4.580 3.725 3.699 3.742 . 0 0 "[ . 1 . ]" 1
347 1 15 GLN HG3 1 61 LEU HB3 5.340 . 5.840 5.007 4.872 5.113 . 0 0 "[ . 1 . ]" 1
348 1 15 GLN HG3 1 61 LEU MD2 6.510 . 7.010 3.746 3.679 3.819 . 0 0 "[ . 1 . ]" 1
349 1 15 GLN HG3 1 62 ASP HA 4.630 . 5.130 4.250 4.049 4.365 . 0 0 "[ . 1 . ]" 1
350 1 15 GLN HG3 1 62 ASP QB 6.330 . 6.830 5.674 5.588 5.729 . 0 0 "[ . 1 . ]" 1
351 1 16 LYS H 1 16 LYS HB2 3.530 . 4.030 2.285 2.070 2.516 . 0 0 "[ . 1 . ]" 1
352 1 16 LYS H 1 16 LYS HB3 3.540 . 4.040 3.481 3.145 3.634 . 0 0 "[ . 1 . ]" 1
353 1 16 LYS H 1 16 LYS HD2 4.840 . 5.340 4.342 3.861 4.977 . 0 0 "[ . 1 . ]" 1
354 1 16 LYS H 1 16 LYS HD3 4.880 . 5.380 4.244 3.322 4.965 . 0 0 "[ . 1 . ]" 1
355 1 16 LYS H 1 16 LYS HG2 4.410 . 4.910 3.815 2.380 4.459 . 0 0 "[ . 1 . ]" 1
356 1 16 LYS H 1 16 LYS HG3 4.160 . 4.660 3.339 2.595 4.364 . 0 0 "[ . 1 . ]" 1
357 1 16 LYS H 1 17 GLY H 3.340 . 3.840 2.487 2.402 2.540 . 0 0 "[ . 1 . ]" 1
358 1 16 LYS H 1 18 ASP H 4.280 . 4.780 3.536 3.432 3.751 . 0 0 "[ . 1 . ]" 1
359 1 16 LYS HA 1 16 LYS HD2 4.430 . 4.930 3.908 2.788 4.543 . 0 0 "[ . 1 . ]" 1
360 1 16 LYS HA 1 16 LYS HD3 4.380 . 4.880 3.408 2.108 4.551 . 0 0 "[ . 1 . ]" 1
361 1 16 LYS HA 1 16 LYS HG2 3.500 . 4.000 2.874 2.292 3.515 . 0 0 "[ . 1 . ]" 1
362 1 16 LYS HA 1 16 LYS HG3 3.720 . 4.220 2.779 2.274 3.764 . 0 0 "[ . 1 . ]" 1
363 1 16 LYS HA 1 17 GLY HA3 5.070 . 5.570 4.464 4.413 4.536 . 0 0 "[ . 1 . ]" 1
364 1 16 LYS HA 1 18 ASP H 5.500 . 6.000 4.786 4.654 5.109 . 0 0 "[ . 1 . ]" 1
365 1 16 LYS HB2 1 16 LYS HD3 4.190 . 4.690 3.170 2.907 3.795 . 0 0 "[ . 1 . ]" 1
366 1 16 LYS HB2 1 17 GLY H 4.740 . 5.240 3.671 3.416 3.852 . 0 0 "[ . 1 . ]" 1
367 1 16 LYS HB3 1 17 GLY H 4.470 . 4.970 4.128 3.705 4.323 . 0 0 "[ . 1 . ]" 1
368 1 16 LYS HG2 1 17 GLY H 5.680 . 6.180 5.330 4.593 5.759 . 0 0 "[ . 1 . ]" 1
369 1 16 LYS HD2 1 16 LYS HG3 3.000 . 3.500 2.501 2.378 3.040 . 0 0 "[ . 1 . ]" 1
370 1 16 LYS HG3 1 17 GLY H 5.500 . 6.000 4.970 4.655 5.576 . 0 0 "[ . 1 . ]" 1
371 1 17 GLY H 1 18 ASP H 3.250 . 3.750 2.328 2.220 2.393 . 0 0 "[ . 1 . ]" 1
372 1 17 GLY H 1 18 ASP HB2 5.000 . 5.500 4.382 4.286 4.447 . 0 0 "[ . 1 . ]" 1
373 1 17 GLY H 1 18 ASP HB3 5.700 . 6.200 5.795 5.725 5.852 . 0 0 "[ . 1 . ]" 1
374 1 18 ASP H 1 18 ASP HB2 3.310 . 3.810 2.235 2.189 2.353 . 0 0 "[ . 1 . ]" 1
375 1 18 ASP H 1 18 ASP HB3 3.460 . 3.960 3.522 3.477 3.582 . 0 0 "[ . 1 . ]" 1
376 1 18 ASP H 1 19 GLN H 4.060 . 4.560 3.982 3.929 4.019 . 0 0 "[ . 1 . ]" 1
377 1 18 ASP H 1 21 ALA H 5.280 . 5.780 5.333 5.276 5.384 . 0 0 "[ . 1 . ]" 1
378 1 18 ASP H 1 21 ALA MB 6.450 . 6.950 4.731 4.606 4.831 . 0 0 "[ . 1 . ]" 1
379 1 18 ASP HA 1 19 GLN H 3.080 . 3.580 2.324 2.306 2.360 . 0 0 "[ . 1 . ]" 1
380 1 18 ASP HA 1 20 LYS H 4.090 . 4.590 3.205 3.153 3.247 . 0 0 "[ . 1 . ]" 1
381 1 18 ASP HA 1 21 ALA H 5.090 . 5.590 4.387 4.187 4.478 . 0 0 "[ . 1 . ]" 1
382 1 18 ASP HB2 1 19 GLN H 4.850 . 5.350 4.612 4.581 4.646 . 0 0 "[ . 1 . ]" 1
383 1 18 ASP HB2 1 20 LYS HG3 5.500 . 6.000 4.896 4.573 5.302 . 0 0 "[ . 1 . ]" 1
384 1 18 ASP HB2 1 20 LYS QD 6.010 . 6.510 5.407 4.697 5.511 . 0 0 "[ . 1 . ]" 1
385 1 18 ASP HB2 1 20 LYS QE 4.160 . 4.660 3.763 3.728 3.870 . 0 0 "[ . 1 . ]" 1
386 1 18 ASP HB2 1 21 ALA H 4.850 . 5.350 4.158 3.823 4.356 . 0 0 "[ . 1 . ]" 1
387 1 18 ASP HB2 1 21 ALA MB 4.940 . 5.440 3.411 2.979 3.696 . 0 0 "[ . 1 . ]" 1
388 1 18 ASP HB3 1 20 LYS HG2 5.500 . 6.000 2.385 2.250 2.451 . 0 0 "[ . 1 . ]" 1
389 1 18 ASP HB3 1 20 LYS HG3 5.500 . 6.000 3.217 2.924 3.588 . 0 0 "[ . 1 . ]" 1
390 1 18 ASP HB3 1 21 ALA H 5.130 . 5.630 3.090 2.920 3.244 . 0 0 "[ . 1 . ]" 1
391 1 18 ASP HB3 1 21 ALA MB 5.580 . 6.080 3.035 2.807 3.194 . 0 0 "[ . 1 . ]" 1
392 1 19 GLN H 1 19 GLN HB2 3.660 . 4.160 2.406 2.287 2.447 . 0 0 "[ . 1 . ]" 1
393 1 19 GLN H 1 19 GLN HB3 3.410 . 3.910 2.470 2.423 2.560 . 0 0 "[ . 1 . ]" 1
394 1 19 GLN H 1 19 GLN HG2 4.320 . 4.820 4.380 4.335 4.402 . 0 0 "[ . 1 . ]" 1
395 1 19 GLN H 1 19 GLN HG3 4.580 . 5.080 4.524 4.472 4.551 . 0 0 "[ . 1 . ]" 1
396 1 19 GLN H 1 21 ALA H 5.130 . 5.630 4.322 4.224 4.389 . 0 0 "[ . 1 . ]" 1
397 1 19 GLN HA 1 19 GLN HG2 3.750 . 4.250 2.400 2.383 2.417 . 0 0 "[ . 1 . ]" 1
398 1 19 GLN HA 1 19 GLN HG3 4.120 . 4.620 3.605 3.587 3.644 . 0 0 "[ . 1 . ]" 1
399 1 19 GLN HA 1 21 ALA MB 5.340 . 5.840 4.411 4.328 4.472 . 0 0 "[ . 1 . ]" 1
400 1 19 GLN HA 1 22 PHE H 3.730 . 4.230 3.104 3.068 3.136 . 0 0 "[ . 1 . ]" 1
401 1 19 GLN HA 1 22 PHE HB2 4.490 . 4.990 3.238 3.173 3.326 . 0 0 "[ . 1 . ]" 1
402 1 19 GLN HA 1 22 PHE HB3 4.320 . 4.820 3.302 3.153 3.387 . 0 0 "[ . 1 . ]" 1
403 1 19 GLN HA 1 58 TYR QE 4.400 . 4.900 3.143 3.005 3.260 . 0 0 "[ . 1 . ]" 1
404 1 19 GLN HB2 1 20 LYS H 4.500 . 5.000 4.137 3.995 4.194 . 0 0 "[ . 1 . ]" 1
405 1 19 GLN HB3 1 20 LYS H 4.370 . 4.870 3.155 3.025 3.218 . 0 0 "[ . 1 . ]" 1
406 1 19 GLN HB3 1 58 TYR QE 6.080 . 6.580 5.177 5.070 5.360 . 0 0 "[ . 1 . ]" 1
407 1 19 GLN HE21 1 23 ASN H 5.050 . 5.550 4.830 4.538 5.774 0.224 17 0 "[ . 1 . ]" 1
408 1 19 GLN HG2 1 58 TYR QD 6.170 . 6.670 4.301 4.111 4.544 . 0 0 "[ . 1 . ]" 1
409 1 19 GLN HG2 1 58 TYR QE 5.100 . 5.600 3.200 2.994 3.373 . 0 0 "[ . 1 . ]" 1
410 1 19 GLN QG 1 20 LYS H 5.240 . 5.740 4.573 4.533 4.667 . 0 0 "[ . 1 . ]" 1
411 1 20 LYS H 1 20 LYS HB2 3.500 . 4.000 3.549 3.536 3.557 . 0 0 "[ . 1 . ]" 1
412 1 20 LYS H 1 20 LYS HB3 3.530 . 4.030 2.444 2.336 2.497 . 0 0 "[ . 1 . ]" 1
413 1 20 LYS H 1 20 LYS HG2 4.240 . 4.740 2.022 1.913 2.261 . 0 0 "[ . 1 . ]" 1
414 1 20 LYS H 1 20 LYS HG3 4.320 . 4.820 3.361 3.262 3.645 . 0 0 "[ . 1 . ]" 1
415 1 20 LYS H 1 20 LYS QD 4.990 . 5.490 3.567 3.483 3.964 . 0 0 "[ . 1 . ]" 1
416 1 20 LYS H 1 21 ALA H 3.150 . 3.650 2.701 2.684 2.717 . 0 0 "[ . 1 . ]" 1
417 1 20 LYS H 1 22 PHE H 4.390 . 4.890 4.113 4.079 4.158 . 0 0 "[ . 1 . ]" 1
418 1 20 LYS HA 1 20 LYS HG3 3.800 . 4.300 3.785 3.765 3.816 . 0 0 "[ . 1 . ]" 1
419 1 20 LYS HA 1 23 ASN HD21 4.700 . 5.200 4.344 4.318 4.384 . 0 0 "[ . 1 . ]" 1
420 1 20 LYS HA 1 23 ASN HD22 5.650 . 6.150 5.748 5.732 5.765 . 0 0 "[ . 1 . ]" 1
421 1 20 LYS HB2 1 20 LYS QE 4.750 . 5.250 3.960 3.296 4.253 . 0 0 "[ . 1 . ]" 1
422 1 20 LYS HB2 1 21 ALA H 4.670 . 5.170 4.070 4.036 4.122 . 0 0 "[ . 1 . ]" 1
423 1 20 LYS HB3 1 20 LYS QE 4.670 . 5.170 3.864 2.019 4.003 . 0 0 "[ . 1 . ]" 1
424 1 20 LYS HB3 1 21 ALA H 4.220 . 4.720 4.135 4.038 4.177 . 0 0 "[ . 1 . ]" 1
425 1 20 LYS HB3 1 21 ALA HA 5.700 . 6.200 5.735 5.709 5.758 . 0 0 "[ . 1 . ]" 1
426 1 20 LYS HG2 1 21 ALA H 5.500 . 6.000 2.651 2.304 2.731 . 0 0 "[ . 1 . ]" 1
427 1 20 LYS HG3 1 21 ALA H 3.070 . 3.570 2.783 2.688 3.009 . 0 0 "[ . 1 . ]" 1
428 1 20 LYS QD 1 24 LEU MD1 7.410 . 7.910 4.579 4.470 4.720 . 0 0 "[ . 1 . ]" 1
429 1 21 ALA H 1 22 PHE H 3.310 . 3.810 2.431 2.404 2.451 . 0 0 "[ . 1 . ]" 1
430 1 21 ALA H 1 22 PHE HB2 5.120 . 5.620 4.720 4.675 4.760 . 0 0 "[ . 1 . ]" 1
431 1 21 ALA H 1 24 LEU MD1 5.800 . 6.300 4.778 4.712 4.838 . 0 0 "[ . 1 . ]" 1
432 1 21 ALA HA 1 24 LEU H 4.090 . 4.590 3.243 3.186 3.293 . 0 0 "[ . 1 . ]" 1
433 1 21 ALA HA 1 24 LEU HG 4.020 . 4.520 3.623 3.541 3.711 . 0 0 "[ . 1 . ]" 1
434 1 21 ALA HA 1 24 LEU MD1 4.070 . 4.570 2.646 2.550 2.732 . 0 0 "[ . 1 . ]" 1
435 1 21 ALA MB 1 22 PHE H 4.540 . 5.040 3.031 2.968 3.048 . 0 0 "[ . 1 . ]" 1
436 1 21 ALA MB 1 22 PHE HB2 6.610 . 7.110 4.356 4.289 4.390 . 0 0 "[ . 1 . ]" 1
437 1 21 ALA MB 1 23 ASN H 6.610 . 7.110 4.697 4.642 4.721 . 0 0 "[ . 1 . ]" 1
438 1 21 ALA MB 1 25 LEU HB3 5.900 . 6.400 4.987 4.954 5.021 . 0 0 "[ . 1 . ]" 1
439 1 21 ALA MB 1 25 LEU MD2 7.820 . 8.320 4.520 4.469 4.562 . 0 0 "[ . 1 . ]" 1
440 1 22 PHE H 1 22 PHE HB2 3.350 . 3.850 2.614 2.589 2.636 . 0 0 "[ . 1 . ]" 1
441 1 22 PHE H 1 22 PHE HB3 3.360 . 3.860 2.503 2.468 2.522 . 0 0 "[ . 1 . ]" 1
442 1 22 PHE H 1 58 TYR QE 5.650 . 6.150 4.693 4.640 4.740 . 0 0 "[ . 1 . ]" 1
443 1 22 PHE HA 1 22 PHE QD 3.400 . 3.900 2.405 2.358 2.463 . 0 0 "[ . 1 . ]" 1
444 1 22 PHE HA 1 22 PHE QE 4.890 . 5.390 4.423 4.406 4.441 . 0 0 "[ . 1 . ]" 1
445 1 22 PHE HA 1 25 LEU HB2 4.280 . 4.780 3.067 3.024 3.107 . 0 0 "[ . 1 . ]" 1
446 1 22 PHE HA 1 25 LEU HB3 4.850 . 5.350 2.183 2.146 2.209 . 0 0 "[ . 1 . ]" 1
447 1 22 PHE HA 1 25 LEU MD2 4.470 . 4.970 3.016 2.974 3.064 . 0 0 "[ . 1 . ]" 1
448 1 22 PHE HA 1 26 VAL MG1 6.610 . 7.110 3.709 3.645 3.770 . 0 0 "[ . 1 . ]" 1
449 1 22 PHE HA 1 58 TYR QE 5.630 . 6.130 5.069 5.050 5.090 . 0 0 "[ . 1 . ]" 1
450 1 22 PHE HB2 1 23 ASN H 4.010 . 4.510 3.942 3.915 3.970 . 0 0 "[ . 1 . ]" 1
451 1 22 PHE HB2 1 25 LEU MD2 6.230 . 6.730 4.379 4.327 4.428 . 0 0 "[ . 1 . ]" 1
452 1 22 PHE HB2 1 58 TYR QD 4.660 . 5.160 3.200 3.127 3.253 . 0 0 "[ . 1 . ]" 1
453 1 22 PHE HB2 1 58 TYR QE 4.420 . 4.920 2.685 2.662 2.707 . 0 0 "[ . 1 . ]" 1
454 1 22 PHE HB3 1 23 ASN H 3.700 . 4.200 2.730 2.693 2.774 . 0 0 "[ . 1 . ]" 1
455 1 22 PHE HB3 1 58 TYR QD 4.440 . 4.940 3.917 3.844 3.967 . 0 0 "[ . 1 . ]" 1
456 1 22 PHE HB3 1 58 TYR QE 4.480 . 4.980 3.625 3.579 3.669 . 0 0 "[ . 1 . ]" 1
457 1 22 PHE HB3 1 61 LEU MD2 6.610 . 7.110 5.222 5.135 5.300 . 0 0 "[ . 1 . ]" 1
458 1 22 PHE HZ 1 26 VAL MG1 5.200 . 5.700 2.662 2.634 2.723 . 0 0 "[ . 1 . ]" 1
459 1 22 PHE HZ 1 54 PHE HA 4.190 . 4.690 2.816 2.733 2.892 . 0 0 "[ . 1 . ]" 1
460 1 22 PHE HZ 1 54 PHE HB2 4.650 . 5.150 4.676 4.608 4.713 . 0 0 "[ . 1 . ]" 1
461 1 22 PHE HZ 1 54 PHE HB3 5.170 . 5.670 3.133 3.048 3.172 . 0 0 "[ . 1 . ]" 1
462 1 22 PHE HZ 1 54 PHE QD 4.660 . 5.160 3.474 3.333 3.604 . 0 0 "[ . 1 . ]" 1
463 1 22 PHE HZ 1 54 PHE QE 6.180 . 6.680 5.435 5.323 5.542 . 0 0 "[ . 1 . ]" 1
464 1 22 PHE HZ 1 55 ILE HA 5.350 . 5.850 5.020 4.963 5.067 . 0 0 "[ . 1 . ]" 1
465 1 22 PHE HZ 1 57 ALA MB 4.120 . 4.620 2.494 2.435 2.561 . 0 0 "[ . 1 . ]" 1
466 1 22 PHE HZ 1 58 TYR H 4.210 . 4.710 3.099 3.032 3.172 . 0 0 "[ . 1 . ]" 1
467 1 22 PHE HZ 1 58 TYR HA 4.650 . 5.150 3.843 3.725 3.887 . 0 0 "[ . 1 . ]" 1
468 1 22 PHE HZ 1 58 TYR HB3 4.550 . 5.050 4.472 4.435 4.511 . 0 0 "[ . 1 . ]" 1
469 1 22 PHE HZ 1 58 TYR QD 4.950 . 5.450 4.138 4.037 4.221 . 0 0 "[ . 1 . ]" 1
470 1 22 PHE HZ 1 61 LEU HB2 5.500 . 6.000 5.142 5.036 5.208 . 0 0 "[ . 1 . ]" 1
471 1 22 PHE HZ 1 61 LEU QD 6.730 . 7.230 4.133 4.018 4.224 . 0 0 "[ . 1 . ]" 1
472 1 22 PHE QD 1 23 ASN H 5.280 . 5.780 3.984 3.917 4.030 . 0 0 "[ . 1 . ]" 1
473 1 22 PHE QD 1 23 ASN HA 5.080 . 5.580 4.042 3.901 4.130 . 0 0 "[ . 1 . ]" 1
474 1 22 PHE QD 1 25 LEU MD1 6.740 . 7.240 5.025 5.007 5.059 . 0 0 "[ . 1 . ]" 1
475 1 22 PHE QD 1 25 LEU MD2 4.450 . 4.950 2.368 2.341 2.400 . 0 0 "[ . 1 . ]" 1
476 1 22 PHE QD 1 26 VAL MG1 4.690 . 5.190 3.116 3.073 3.168 . 0 0 "[ . 1 . ]" 1
477 1 22 PHE QD 1 58 TYR HA 5.280 . 5.780 4.472 4.323 4.664 . 0 0 "[ . 1 . ]" 1
478 1 22 PHE QD 1 58 TYR QD 4.750 . 5.250 3.057 3.007 3.076 . 0 0 "[ . 1 . ]" 1
479 1 22 PHE QD 1 58 TYR QE 5.590 . 6.090 3.925 3.907 3.959 . 0 0 "[ . 1 . ]" 1
480 1 22 PHE QD 1 61 LEU MD2 6.160 . 6.660 2.689 2.608 2.779 . 0 0 "[ . 1 . ]" 1
481 1 22 PHE QD 1 61 LEU QD 5.190 . 5.690 2.672 2.592 2.759 . 0 0 "[ . 1 . ]" 1
482 1 22 PHE QD 1 70 PHE HZ 5.120 . 5.620 4.625 4.581 4.639 . 0 0 "[ . 1 . ]" 1
483 1 22 PHE QE 1 25 LEU HB2 6.600 . 7.100 5.811 5.748 5.865 . 0 0 "[ . 1 . ]" 1
484 1 22 PHE QE 1 25 LEU MD2 5.200 . 5.700 3.117 3.029 3.190 . 0 0 "[ . 1 . ]" 1
485 1 22 PHE QE 1 26 VAL MG1 4.560 . 5.060 2.538 2.509 2.570 . 0 0 "[ . 1 . ]" 1
486 1 22 PHE QE 1 54 PHE HA 5.320 . 5.820 3.863 3.808 3.922 . 0 0 "[ . 1 . ]" 1
487 1 22 PHE QE 1 54 PHE HB2 4.600 . 5.100 4.145 4.091 4.191 . 0 0 "[ . 1 . ]" 1
488 1 22 PHE QE 1 55 ILE HA 5.850 . 6.350 3.980 3.861 4.052 . 0 0 "[ . 1 . ]" 1
489 1 22 PHE QE 1 57 ALA MB 5.280 . 5.780 3.323 3.263 3.427 . 0 0 "[ . 1 . ]" 1
490 1 22 PHE QE 1 58 TYR H 5.100 . 5.600 3.787 3.732 3.830 . 0 0 "[ . 1 . ]" 1
491 1 22 PHE QE 1 58 TYR HA 4.560 . 5.060 3.631 3.524 3.760 . 0 0 "[ . 1 . ]" 1
492 1 22 PHE QE 1 58 TYR HB2 5.130 . 5.630 2.665 2.587 2.750 . 0 0 "[ . 1 . ]" 1
493 1 22 PHE QE 1 58 TYR HB3 4.610 . 5.110 3.994 3.911 4.084 . 0 0 "[ . 1 . ]" 1
494 1 22 PHE QE 1 58 TYR QD 5.250 . 5.750 3.452 3.418 3.484 . 0 0 "[ . 1 . ]" 1
495 1 22 PHE QE 1 58 TYR QE 6.400 . 6.900 5.103 5.068 5.135 . 0 0 "[ . 1 . ]" 1
496 1 22 PHE QE 1 61 LEU QD 5.300 . 5.800 2.429 2.361 2.484 . 0 0 "[ . 1 . ]" 1
497 1 22 PHE QE 1 70 PHE HZ 4.880 . 5.380 3.288 3.114 3.406 . 0 0 "[ . 1 . ]" 1
498 1 22 PHE QE 1 70 PHE QE 5.980 . 6.480 4.061 3.680 4.227 . 0 0 "[ . 1 . ]" 1
499 1 23 ASN H 1 23 ASN HB2 3.580 . 4.080 2.642 2.624 2.660 . 0 0 "[ . 1 . ]" 1
500 1 23 ASN H 1 23 ASN HB3 3.410 . 3.910 2.220 2.196 2.261 . 0 0 "[ . 1 . ]" 1
501 1 23 ASN H 1 24 LEU H 3.460 . 3.960 2.663 2.647 2.697 . 0 0 "[ . 1 . ]" 1
502 1 23 ASN H 1 24 LEU MD1 6.220 . 6.720 5.217 5.208 5.237 . 0 0 "[ . 1 . ]" 1
503 1 23 ASN H 1 26 VAL MG1 6.240 . 6.740 4.776 4.753 4.803 . 0 0 "[ . 1 . ]" 1
504 1 23 ASN HA 1 24 LEU HG 5.320 . 5.820 5.234 5.208 5.265 . 0 0 "[ . 1 . ]" 1
505 1 23 ASN HA 1 26 VAL H 3.900 . 4.400 3.614 3.587 3.628 . 0 0 "[ . 1 . ]" 1
506 1 23 ASN HA 1 26 VAL MG1 4.400 . 4.900 3.661 3.610 3.695 . 0 0 "[ . 1 . ]" 1
507 1 23 ASN HA 1 27 VAL MG1 6.200 . 6.700 4.616 4.093 4.960 . 0 0 "[ . 1 . ]" 1
508 1 23 ASN HB2 1 24 LEU H 3.880 . 4.380 3.966 3.947 3.983 . 0 0 "[ . 1 . ]" 1
509 1 23 ASN HB2 1 24 LEU HA 5.600 . 6.100 5.701 5.691 5.714 . 0 0 "[ . 1 . ]" 1
510 1 23 ASN HB2 1 24 LEU HG 4.930 . 5.430 4.915 4.879 4.942 . 0 0 "[ . 1 . ]" 1
511 1 23 ASN HB2 1 24 LEU MD2 6.410 . 6.910 5.345 5.314 5.378 . 0 0 "[ . 1 . ]" 1
512 1 23 ASN HB2 1 26 VAL MG1 6.850 . 7.350 5.494 5.472 5.518 . 0 0 "[ . 1 . ]" 1
513 1 23 ASN HB3 1 24 LEU H 4.080 . 4.580 2.591 2.568 2.620 . 0 0 "[ . 1 . ]" 1
514 1 23 ASN HB3 1 24 LEU HG 5.380 . 5.880 3.222 3.170 3.251 . 0 0 "[ . 1 . ]" 1
515 1 23 ASN HB3 1 24 LEU MD2 6.470 . 6.970 4.187 4.133 4.222 . 0 0 "[ . 1 . ]" 1
516 1 23 ASN HB3 1 26 VAL MG1 7.000 . 7.500 5.958 5.942 5.979 . 0 0 "[ . 1 . ]" 1
517 1 23 ASN HB3 1 27 VAL MG1 6.970 . 7.470 5.576 5.334 5.723 . 0 0 "[ . 1 . ]" 1
518 1 23 ASN HD21 1 24 LEU H 4.480 . 4.980 3.024 2.998 3.050 . 0 0 "[ . 1 . ]" 1
519 1 23 ASN HD21 1 24 LEU MD2 6.610 . 7.110 2.549 2.485 2.590 . 0 0 "[ . 1 . ]" 1
520 1 23 ASN HD21 1 27 VAL MG1 6.610 . 7.110 4.746 4.510 4.880 . 0 0 "[ . 1 . ]" 1
521 1 23 ASN HD22 1 24 LEU H 4.350 . 4.850 4.472 4.456 4.494 . 0 0 "[ . 1 . ]" 1
522 1 23 ASN HD22 1 27 VAL MG1 6.500 . 7.000 4.357 3.855 4.670 . 0 0 "[ . 1 . ]" 1
523 1 24 LEU H 1 24 LEU HB2 3.270 . 3.770 2.416 2.384 2.452 . 0 0 "[ . 1 . ]" 1
524 1 24 LEU H 1 24 LEU HB3 3.620 . 4.120 3.582 3.568 3.601 . 0 0 "[ . 1 . ]" 1
525 1 24 LEU H 1 24 LEU HG 3.370 . 3.870 2.259 2.228 2.285 . 0 0 "[ . 1 . ]" 1
526 1 24 LEU H 1 24 LEU MD1 4.710 . 5.210 3.494 3.476 3.510 . 0 0 "[ . 1 . ]" 1
527 1 24 LEU H 1 25 LEU H 3.450 . 3.950 2.530 2.515 2.551 . 0 0 "[ . 1 . ]" 1
528 1 24 LEU H 1 25 LEU HB3 5.490 . 5.990 4.680 4.654 4.711 . 0 0 "[ . 1 . ]" 1
529 1 24 LEU H 1 26 VAL MG1 6.610 . 7.110 5.390 5.351 5.424 . 0 0 "[ . 1 . ]" 1
530 1 24 LEU H 1 27 VAL H 5.240 . 5.740 5.121 5.083 5.167 . 0 0 "[ . 1 . ]" 1
531 1 24 LEU H 1 27 VAL MG1 6.610 . 7.110 4.641 4.432 4.935 . 0 0 "[ . 1 . ]" 1
532 1 24 LEU HA 1 24 LEU HG 3.980 . 4.480 3.019 3.002 3.039 . 0 0 "[ . 1 . ]" 1
533 1 24 LEU HA 1 27 VAL H 3.830 . 4.330 3.725 3.624 3.807 . 0 0 "[ . 1 . ]" 1
534 1 24 LEU HA 1 27 VAL MG1 4.410 . 4.910 2.670 2.263 3.285 . 0 0 "[ . 1 . ]" 1
535 1 24 LEU HB2 1 25 LEU H 4.690 . 5.190 3.149 3.119 3.181 . 0 0 "[ . 1 . ]" 1
536 1 24 LEU HB3 1 25 LEU H 4.030 . 4.530 4.073 4.050 4.102 . 0 0 "[ . 1 . ]" 1
537 1 24 LEU HB3 1 27 VAL H 5.700 . 6.200 5.662 5.555 5.727 . 0 0 "[ . 1 . ]" 1
538 1 24 LEU HB3 1 27 VAL MG1 6.100 . 6.600 4.389 3.822 5.259 . 0 0 "[ . 1 . ]" 1
539 1 24 LEU MD1 1 25 LEU H 5.810 . 6.310 4.873 4.864 4.883 . 0 0 "[ . 1 . ]" 1
540 1 25 LEU H 1 25 LEU HB2 3.380 . 3.880 2.689 2.660 2.713 . 0 0 "[ . 1 . ]" 1
541 1 25 LEU H 1 25 LEU HB3 3.700 . 4.200 2.370 2.346 2.394 . 0 0 "[ . 1 . ]" 1
542 1 25 LEU H 1 25 LEU MD2 5.260 . 5.760 4.220 4.197 4.243 . 0 0 "[ . 1 . ]" 1
543 1 25 LEU H 1 26 VAL H 3.330 . 3.830 2.525 2.498 2.544 . 0 0 "[ . 1 . ]" 1
544 1 25 LEU H 1 26 VAL MG1 5.520 . 6.020 4.005 3.968 4.043 . 0 0 "[ . 1 . ]" 1
545 1 25 LEU H 1 27 VAL H 4.810 . 5.310 3.950 3.908 4.035 . 0 0 "[ . 1 . ]" 1
546 1 25 LEU H 1 28 ARG H 5.420 . 5.920 5.173 5.130 5.238 . 0 0 "[ . 1 . ]" 1
547 1 25 LEU HA 1 25 LEU MD1 4.020 . 4.520 2.104 2.086 2.129 . 0 0 "[ . 1 . ]" 1
548 1 25 LEU HA 1 26 VAL MG1 6.610 . 7.110 4.958 4.922 4.989 . 0 0 "[ . 1 . ]" 1
549 1 25 LEU HA 1 28 ARG HD2 5.170 . 5.670 3.180 2.982 3.295 . 0 0 "[ . 1 . ]" 1
550 1 25 LEU HA 1 28 ARG HD3 5.010 . 5.510 2.918 2.728 3.016 . 0 0 "[ . 1 . ]" 1
551 1 25 LEU HA 1 29 TYR H 4.970 . 5.470 5.107 5.079 5.128 . 0 0 "[ . 1 . ]" 1
552 1 25 LEU HA 1 29 TYR QD 4.660 . 5.160 4.188 4.153 4.237 . 0 0 "[ . 1 . ]" 1
553 1 25 LEU HA 1 29 TYR QE 5.630 . 6.130 4.484 4.414 4.561 . 0 0 "[ . 1 . ]" 1
554 1 25 LEU HB2 1 26 VAL H 4.760 . 5.260 4.011 3.971 4.057 . 0 0 "[ . 1 . ]" 1
555 1 25 LEU HB2 1 26 VAL MG1 6.970 . 7.470 4.751 4.711 4.793 . 0 0 "[ . 1 . ]" 1
556 1 25 LEU HB3 1 26 VAL H 4.330 . 4.830 2.674 2.613 2.747 . 0 0 "[ . 1 . ]" 1
557 1 25 LEU HB3 1 26 VAL MG1 6.610 . 7.110 3.229 3.181 3.272 . 0 0 "[ . 1 . ]" 1
558 1 25 LEU HB3 1 70 PHE QE 5.660 . 6.160 5.078 5.035 5.120 . 0 0 "[ . 1 . ]" 1
559 1 25 LEU HG 1 26 VAL H 5.130 . 5.630 3.697 3.626 3.773 . 0 0 "[ . 1 . ]" 1
560 1 25 LEU HG 1 29 TYR QE 5.160 . 5.660 3.928 3.814 4.142 . 0 0 "[ . 1 . ]" 1
561 1 25 LEU MD1 1 26 VAL H 6.610 . 7.110 4.495 4.436 4.535 . 0 0 "[ . 1 . ]" 1
562 1 25 LEU MD1 1 26 VAL MG1 8.220 . 8.720 4.717 4.676 4.764 . 0 0 "[ . 1 . ]" 1
563 1 25 LEU MD1 1 28 ARG HD2 6.400 . 6.900 3.524 3.342 3.644 . 0 0 "[ . 1 . ]" 1
564 1 25 LEU MD1 1 28 ARG HD3 6.120 . 6.620 2.441 2.261 2.572 . 0 0 "[ . 1 . ]" 1
565 1 25 LEU MD1 1 29 TYR QD 4.870 . 5.370 3.096 2.953 3.301 . 0 0 "[ . 1 . ]" 1
566 1 25 LEU MD1 1 29 TYR QE 4.420 . 4.920 2.362 2.252 2.466 . 0 0 "[ . 1 . ]" 1
567 1 25 LEU MD1 1 70 PHE HZ 4.900 . 5.400 3.906 3.759 4.095 . 0 0 "[ . 1 . ]" 1
568 1 25 LEU MD1 1 70 PHE QD 6.080 . 6.580 3.188 2.974 3.295 . 0 0 "[ . 1 . ]" 1
569 1 25 LEU MD1 1 70 PHE QE 5.390 . 5.890 2.484 2.373 2.632 . 0 0 "[ . 1 . ]" 1
570 1 25 LEU MD2 1 26 VAL MG1 7.930 . 8.430 3.717 3.651 3.776 . 0 0 "[ . 1 . ]" 1
571 1 25 LEU MD2 1 28 ARG HD3 6.610 . 7.110 5.217 5.074 5.321 . 0 0 "[ . 1 . ]" 1
572 1 25 LEU MD2 1 28 ARG HG3 7.210 . 7.710 6.010 5.940 6.053 . 0 0 "[ . 1 . ]" 1
573 1 25 LEU MD2 1 61 LEU MD2 5.910 . 6.410 2.940 2.877 2.989 . 0 0 "[ . 1 . ]" 1
574 1 25 LEU MD2 1 70 PHE HZ 3.880 . 4.380 2.611 2.514 2.815 . 0 0 "[ . 1 . ]" 1
575 1 25 LEU MD2 1 70 PHE QE 4.410 . 4.910 2.775 2.729 2.844 . 0 0 "[ . 1 . ]" 1
576 1 26 VAL H 1 26 VAL HB 3.630 . 4.130 3.661 3.652 3.677 . 0 0 "[ . 1 . ]" 1
577 1 26 VAL H 1 26 VAL MG1 3.940 . 4.440 2.159 2.123 2.194 . 0 0 "[ . 1 . ]" 1
578 1 26 VAL H 1 27 VAL H 3.230 . 3.730 2.700 2.680 2.733 . 0 0 "[ . 1 . ]" 1
579 1 26 VAL H 1 27 VAL HA 5.500 . 6.000 5.241 5.224 5.261 . 0 0 "[ . 1 . ]" 1
580 1 26 VAL HA 1 27 VAL HA 5.500 . 6.000 4.727 4.706 4.760 . 0 0 "[ . 1 . ]" 1
581 1 26 VAL HA 1 27 VAL MG1 6.610 . 7.110 5.025 4.978 5.090 . 0 0 "[ . 1 . ]" 1
582 1 26 VAL HA 1 29 TYR HB2 5.070 . 5.570 2.790 2.737 2.853 . 0 0 "[ . 1 . ]" 1
583 1 26 VAL HA 1 29 TYR QD 5.290 . 5.790 3.324 3.222 3.487 . 0 0 "[ . 1 . ]" 1
584 1 26 VAL HA 1 30 GLN H 4.780 . 5.280 4.260 4.189 4.334 . 0 0 "[ . 1 . ]" 1
585 1 26 VAL HA 1 30 GLN HE21 5.500 . 6.000 5.498 5.372 5.565 . 0 0 "[ . 1 . ]" 1
586 1 26 VAL HA 1 54 PHE HZ 4.260 . 4.760 4.092 4.049 4.135 . 0 0 "[ . 1 . ]" 1
587 1 26 VAL HA 1 54 PHE QE 4.490 . 4.990 3.731 3.685 3.771 . 0 0 "[ . 1 . ]" 1
588 1 26 VAL HB 1 27 VAL H 4.200 . 4.700 4.135 4.116 4.159 . 0 0 "[ . 1 . ]" 1
589 1 26 VAL MG1 1 27 VAL H 5.760 . 6.260 4.097 4.069 4.126 . 0 0 "[ . 1 . ]" 1
590 1 26 VAL MG1 1 54 PHE HA 6.340 . 6.840 3.527 3.453 3.626 . 0 0 "[ . 1 . ]" 1
591 1 26 VAL MG1 1 54 PHE HB2 5.580 . 6.080 3.713 3.617 3.792 . 0 0 "[ . 1 . ]" 1
592 1 26 VAL MG1 1 54 PHE HB3 6.410 . 6.910 2.255 2.157 2.345 . 0 0 "[ . 1 . ]" 1
593 1 26 VAL MG1 1 54 PHE HZ 6.610 . 7.110 4.586 4.525 4.647 . 0 0 "[ . 1 . ]" 1
594 1 26 VAL MG1 1 54 PHE QD 4.700 . 5.200 2.875 2.776 2.940 . 0 0 "[ . 1 . ]" 1
595 1 26 VAL MG1 1 54 PHE QE 5.110 . 5.610 3.584 3.482 3.672 . 0 0 "[ . 1 . ]" 1
596 1 26 VAL MG1 1 57 ALA MB 8.650 . 9.150 3.937 3.888 4.007 . 0 0 "[ . 1 . ]" 1
597 1 26 VAL MG2 1 27 VAL H 4.600 . 5.100 2.549 2.512 2.586 . 0 0 "[ . 1 . ]" 1
598 1 26 VAL MG2 1 27 VAL HA 5.190 . 5.690 3.227 3.182 3.288 . 0 0 "[ . 1 . ]" 1
599 1 26 VAL MG2 1 27 VAL MG1 7.210 . 7.710 3.318 2.581 3.790 . 0 0 "[ . 1 . ]" 1
600 1 26 VAL MG2 1 28 ARG H 6.450 . 6.950 4.527 4.506 4.543 . 0 0 "[ . 1 . ]" 1
601 1 26 VAL MG2 1 29 TYR H 6.610 . 7.110 4.838 4.803 4.874 . 0 0 "[ . 1 . ]" 1
602 1 26 VAL MG2 1 30 GLN H 5.850 . 6.350 4.650 4.630 4.672 . 0 0 "[ . 1 . ]" 1
603 1 26 VAL MG2 1 30 GLN HA 6.000 . 6.500 5.058 5.026 5.080 . 0 0 "[ . 1 . ]" 1
604 1 26 VAL MG2 1 30 GLN HB2 5.430 . 5.930 3.462 3.426 3.496 . 0 0 "[ . 1 . ]" 1
605 1 26 VAL MG2 1 30 GLN HB3 5.760 . 6.260 4.824 4.763 4.877 . 0 0 "[ . 1 . ]" 1
606 1 26 VAL MG2 1 30 GLN HE21 6.390 . 6.890 2.743 2.658 2.805 . 0 0 "[ . 1 . ]" 1
607 1 26 VAL MG2 1 30 GLN HE22 6.610 . 7.110 3.468 3.407 3.505 . 0 0 "[ . 1 . ]" 1
608 1 26 VAL MG2 1 30 GLN HG2 6.760 . 7.260 5.734 5.705 5.761 . 0 0 "[ . 1 . ]" 1
609 1 26 VAL MG2 1 30 GLN HG3 6.220 . 6.720 4.723 4.662 4.769 . 0 0 "[ . 1 . ]" 1
610 1 26 VAL MG2 1 54 PHE HZ 5.520 . 6.020 4.631 4.599 4.661 . 0 0 "[ . 1 . ]" 1
611 1 26 VAL MG2 1 54 PHE QE 6.740 . 7.240 3.665 3.541 3.767 . 0 0 "[ . 1 . ]" 1
612 1 26 VAL MG2 1 57 ALA MB 8.510 . 9.010 5.935 5.896 5.991 . 0 0 "[ . 1 . ]" 1
613 1 27 VAL H 1 27 VAL HB 3.600 . 4.100 2.980 2.548 3.641 . 0 0 "[ . 1 . ]" 1
614 1 27 VAL H 1 27 VAL MG1 3.860 . 4.360 2.113 2.006 2.280 . 0 0 "[ . 1 . ]" 1
615 1 27 VAL HA 1 28 ARG HA 4.840 . 5.340 4.803 4.780 4.820 . 0 0 "[ . 1 . ]" 1
616 1 27 VAL HA 1 30 GLN H 4.110 . 4.610 2.914 2.832 3.010 . 0 0 "[ . 1 . ]" 1
617 1 27 VAL HA 1 30 GLN HB2 4.440 . 4.940 2.182 2.147 2.229 . 0 0 "[ . 1 . ]" 1
618 1 27 VAL HA 1 30 GLN HB3 4.660 . 5.160 2.532 2.483 2.592 . 0 0 "[ . 1 . ]" 1
619 1 27 VAL HA 1 30 GLN HE21 4.420 . 4.920 3.156 2.958 3.313 . 0 0 "[ . 1 . ]" 1
620 1 27 VAL HA 1 30 GLN HE22 4.990 . 5.490 3.669 3.457 3.821 . 0 0 "[ . 1 . ]" 1
621 1 27 VAL HA 1 30 GLN HG3 4.460 . 4.960 4.461 4.409 4.499 . 0 0 "[ . 1 . ]" 1
622 1 27 VAL HB 1 28 ARG H 4.200 . 4.700 4.088 3.954 4.179 . 0 0 "[ . 1 . ]" 1
623 1 27 VAL MG1 1 28 ARG H 5.010 . 5.510 3.103 2.454 4.108 . 0 0 "[ . 1 . ]" 1
624 1 27 VAL MG1 1 28 ARG HG2 6.610 . 7.110 4.125 3.080 5.644 . 0 0 "[ . 1 . ]" 1
625 1 27 VAL MG1 1 30 GLN H 6.610 . 7.110 4.787 4.757 4.849 . 0 0 "[ . 1 . ]" 1
626 1 27 VAL MG1 1 30 GLN HB2 6.610 . 7.110 4.494 3.681 5.002 . 0 0 "[ . 1 . ]" 1
627 1 27 VAL MG1 1 30 GLN HE22 6.550 . 7.050 4.353 2.526 5.521 . 0 0 "[ . 1 . ]" 1
628 1 27 VAL MG2 1 28 ARG H 5.010 . 5.510 3.322 2.407 3.914 . 0 0 "[ . 1 . ]" 1
629 1 27 VAL MG2 1 30 GLN HE22 6.090 . 6.590 4.364 3.774 5.222 . 0 0 "[ . 1 . ]" 1
630 1 28 ARG H 1 28 ARG HB2 3.170 . 3.670 2.627 2.603 2.650 . 0 0 "[ . 1 . ]" 1
631 1 28 ARG H 1 28 ARG HB3 3.500 . 4.000 3.589 3.578 3.601 . 0 0 "[ . 1 . ]" 1
632 1 28 ARG H 1 28 ARG HD2 5.450 . 5.950 4.297 4.214 4.369 . 0 0 "[ . 1 . ]" 1
633 1 28 ARG H 1 28 ARG HD3 4.420 . 4.920 3.987 3.880 4.042 . 0 0 "[ . 1 . ]" 1
634 1 28 ARG H 1 28 ARG HG2 4.240 . 4.740 3.055 2.989 3.135 . 0 0 "[ . 1 . ]" 1
635 1 28 ARG H 1 28 ARG HG3 4.920 . 5.420 1.916 1.843 1.963 . 0 0 "[ . 1 . ]" 1
636 1 28 ARG H 1 29 TYR H 3.240 . 3.740 2.485 2.456 2.506 . 0 0 "[ . 1 . ]" 1
637 1 28 ARG H 1 29 TYR QD 5.160 . 5.660 3.601 3.529 3.698 . 0 0 "[ . 1 . ]" 1
638 1 28 ARG H 1 30 GLN H 4.850 . 5.350 3.790 3.750 3.834 . 0 0 "[ . 1 . ]" 1
639 1 28 ARG HA 1 28 ARG HD2 5.050 . 5.550 4.975 4.953 5.010 . 0 0 "[ . 1 . ]" 1
640 1 28 ARG HA 1 29 TYR QD 5.860 . 6.360 4.771 4.673 4.887 . 0 0 "[ . 1 . ]" 1
641 1 28 ARG HA 1 30 GLN H 5.500 . 6.000 4.197 4.163 4.250 . 0 0 "[ . 1 . ]" 1
642 1 28 ARG HA 1 32 LYS H 5.700 . 6.200 5.798 5.756 5.834 . 0 0 "[ . 1 . ]" 1
643 1 28 ARG HB2 1 29 TYR H 4.150 . 4.650 2.754 2.693 2.789 . 0 0 "[ . 1 . ]" 1
644 1 28 ARG HB2 1 29 TYR QD 5.210 . 5.710 2.285 2.207 2.399 . 0 0 "[ . 1 . ]" 1
645 1 28 ARG HB3 1 29 TYR H 3.940 . 4.440 3.943 3.906 3.968 . 0 0 "[ . 1 . ]" 1
646 1 28 ARG HB3 1 29 TYR HA 4.740 . 5.240 4.750 4.704 4.799 . 0 0 "[ . 1 . ]" 1
647 1 28 ARG HB3 1 29 TYR QD 5.260 . 5.760 3.873 3.786 3.999 . 0 0 "[ . 1 . ]" 1
648 1 28 ARG HD2 1 29 TYR QD 6.170 . 6.670 5.342 5.231 5.423 . 0 0 "[ . 1 . ]" 1
649 1 28 ARG HD2 1 29 TYR QE 5.440 . 5.940 4.894 4.787 4.941 . 0 0 "[ . 1 . ]" 1
650 1 28 ARG HD3 1 29 TYR QD 6.140 . 6.640 3.868 3.701 3.940 . 0 0 "[ . 1 . ]" 1
651 1 28 ARG HD3 1 29 TYR QE 4.180 . 4.680 3.150 3.050 3.196 . 0 0 "[ . 1 . ]" 1
652 1 28 ARG HG2 1 29 TYR H 5.010 . 5.510 4.852 4.805 4.905 . 0 0 "[ . 1 . ]" 1
653 1 28 ARG HG2 1 29 TYR QD 6.170 . 6.670 5.170 5.086 5.257 . 0 0 "[ . 1 . ]" 1
654 1 28 ARG HG2 1 29 TYR QE 6.170 . 6.670 5.524 5.490 5.553 . 0 0 "[ . 1 . ]" 1
655 1 28 ARG HG3 1 29 TYR H 5.500 . 6.000 3.948 3.864 4.012 . 0 0 "[ . 1 . ]" 1
656 1 28 ARG HG3 1 29 TYR QD 5.150 . 5.650 4.077 3.985 4.172 . 0 0 "[ . 1 . ]" 1
657 1 28 ARG HG3 1 29 TYR QE 5.280 . 5.780 4.769 4.733 4.805 . 0 0 "[ . 1 . ]" 1
658 1 29 TYR H 1 29 TYR HB2 3.790 . 4.290 2.388 2.358 2.416 . 0 0 "[ . 1 . ]" 1
659 1 29 TYR H 1 29 TYR HB3 3.600 . 4.100 3.617 3.608 3.627 . 0 0 "[ . 1 . ]" 1
660 1 29 TYR H 1 29 TYR QD 3.830 . 4.330 2.406 2.324 2.512 . 0 0 "[ . 1 . ]" 1
661 1 29 TYR H 1 29 TYR QE 5.560 . 6.060 4.584 4.554 4.642 . 0 0 "[ . 1 . ]" 1
662 1 29 TYR H 1 30 GLN H 3.280 . 3.780 2.323 2.294 2.359 . 0 0 "[ . 1 . ]" 1
663 1 29 TYR H 1 30 GLN HA 4.850 . 5.350 4.739 4.717 4.760 . 0 0 "[ . 1 . ]" 1
664 1 29 TYR H 1 30 GLN HB2 5.470 . 5.970 4.234 4.193 4.270 . 0 0 "[ . 1 . ]" 1
665 1 29 TYR H 1 30 GLN HB3 5.420 . 5.920 4.684 4.625 4.768 . 0 0 "[ . 1 . ]" 1
666 1 29 TYR H 1 54 PHE HZ 4.720 . 5.220 4.380 4.244 4.525 . 0 0 "[ . 1 . ]" 1
667 1 29 TYR H 1 54 PHE QE 5.810 . 6.310 4.844 4.715 4.977 . 0 0 "[ . 1 . ]" 1
668 1 29 TYR H 1 74 LEU MD2 6.610 . 7.110 4.501 4.396 4.615 . 0 0 "[ . 1 . ]" 1
669 1 29 TYR HA 1 29 TYR QD 3.450 . 3.950 3.002 2.916 3.064 . 0 0 "[ . 1 . ]" 1
670 1 29 TYR HA 1 29 TYR QE 5.570 . 6.070 4.573 4.535 4.604 . 0 0 "[ . 1 . ]" 1
671 1 29 TYR HA 1 32 LYS H 4.390 . 4.890 2.815 2.747 2.884 . 0 0 "[ . 1 . ]" 1
672 1 29 TYR HA 1 32 LYS HB2 4.810 . 5.310 2.354 2.283 2.441 . 0 0 "[ . 1 . ]" 1
673 1 29 TYR HA 1 32 LYS HB3 5.240 . 5.740 4.020 3.900 4.187 . 0 0 "[ . 1 . ]" 1
674 1 29 TYR HA 1 32 LYS QD 5.740 . 6.240 2.664 2.365 4.085 . 0 0 "[ . 1 . ]" 1
675 1 29 TYR HA 1 32 LYS QE 5.160 . 5.660 3.866 2.217 4.619 . 0 0 "[ . 1 . ]" 1
676 1 29 TYR HA 1 32 LYS QG 5.340 . 5.840 2.893 2.594 3.300 . 0 0 "[ . 1 . ]" 1
677 1 29 TYR HA 1 33 VAL H 5.210 . 5.710 3.667 3.513 3.786 . 0 0 "[ . 1 . ]" 1
678 1 29 TYR HA 1 33 VAL MG1 6.860 . 7.360 4.589 3.593 5.778 . 0 0 "[ . 1 . ]" 1
679 1 29 TYR HA 1 54 PHE HZ 4.860 . 5.360 4.724 4.552 4.899 . 0 0 "[ . 1 . ]" 1
680 1 29 TYR HA 1 74 LEU MD2 6.430 . 6.930 4.367 4.282 4.430 . 0 0 "[ . 1 . ]" 1
681 1 29 TYR HB2 1 30 GLN H 5.430 . 5.930 3.496 3.475 3.518 . 0 0 "[ . 1 . ]" 1
682 1 29 TYR HB2 1 33 VAL MG1 6.000 . 6.500 4.272 3.487 5.210 . 0 0 "[ . 1 . ]" 1
683 1 29 TYR HB2 1 54 PHE HZ 3.720 . 4.220 3.261 3.052 3.455 . 0 0 "[ . 1 . ]" 1
684 1 29 TYR HB2 1 54 PHE QE 4.410 . 4.910 3.101 2.884 3.327 . 0 0 "[ . 1 . ]" 1
685 1 29 TYR HB2 1 74 LEU MD2 4.900 . 5.400 2.584 2.467 2.699 . 0 0 "[ . 1 . ]" 1
686 1 29 TYR HB3 1 30 GLN H 4.110 . 4.610 4.200 4.186 4.214 . 0 0 "[ . 1 . ]" 1
687 1 29 TYR HB3 1 33 VAL H 5.500 . 6.000 3.633 3.583 3.664 . 0 0 "[ . 1 . ]" 1
688 1 29 TYR HB3 1 33 VAL MG1 6.000 . 6.500 3.124 2.141 4.308 . 0 0 "[ . 1 . ]" 1
689 1 29 TYR HB3 1 54 PHE HZ 4.520 . 5.020 3.498 3.303 3.660 . 0 0 "[ . 1 . ]" 1
690 1 29 TYR HB3 1 54 PHE QE 5.760 . 6.260 3.304 3.046 3.542 . 0 0 "[ . 1 . ]" 1
691 1 29 TYR HB3 1 74 LEU MD2 5.060 . 5.560 2.462 2.342 2.540 . 0 0 "[ . 1 . ]" 1
692 1 29 TYR QD 1 30 GLN H 5.460 . 5.960 4.516 4.488 4.558 . 0 0 "[ . 1 . ]" 1
693 1 29 TYR QD 1 32 LYS HB2 6.170 . 6.670 3.157 2.850 3.438 . 0 0 "[ . 1 . ]" 1
694 1 29 TYR QD 1 32 LYS HB3 5.570 . 6.070 4.056 3.684 4.427 . 0 0 "[ . 1 . ]" 1
695 1 29 TYR QD 1 32 LYS QD 5.870 . 6.370 3.225 2.655 4.559 . 0 0 "[ . 1 . ]" 1
696 1 29 TYR QD 1 32 LYS QE 6.740 . 7.240 4.629 2.653 5.290 . 0 0 "[ . 1 . ]" 1
697 1 29 TYR QD 1 32 LYS QG 6.610 . 7.110 4.573 4.230 4.998 . 0 0 "[ . 1 . ]" 1
698 1 29 TYR QD 1 33 VAL H 5.940 . 6.440 4.629 4.549 4.704 . 0 0 "[ . 1 . ]" 1
699 1 29 TYR QD 1 33 VAL MG1 6.740 . 7.240 4.003 3.090 5.106 . 0 0 "[ . 1 . ]" 1
700 1 29 TYR QD 1 70 PHE QD 6.070 . 6.570 4.636 4.447 4.769 . 0 0 "[ . 1 . ]" 1
701 1 29 TYR QD 1 70 PHE QE 4.980 . 5.480 3.361 3.168 3.530 . 0 0 "[ . 1 . ]" 1
702 1 29 TYR QD 1 71 TYR HB3 6.170 . 6.670 4.544 4.385 4.706 . 0 0 "[ . 1 . ]" 1
703 1 29 TYR QD 1 74 LEU MD2 4.640 . 5.140 2.560 2.397 2.701 . 0 0 "[ . 1 . ]" 1
704 1 29 TYR QD 1 75 TYR QE 4.360 . 4.860 2.190 2.062 2.351 . 0 0 "[ . 1 . ]" 1
705 1 29 TYR QE 1 32 LYS QD 5.860 . 6.360 3.700 3.234 4.680 . 0 0 "[ . 1 . ]" 1
706 1 29 TYR QE 1 32 LYS QE 6.930 . 7.430 4.750 3.282 5.510 . 0 0 "[ . 1 . ]" 1
707 1 29 TYR QE 1 70 PHE QD 4.490 . 4.990 3.271 3.151 3.357 . 0 0 "[ . 1 . ]" 1
708 1 29 TYR QE 1 71 TYR H 5.520 . 6.020 4.343 4.183 4.505 . 0 0 "[ . 1 . ]" 1
709 1 29 TYR QE 1 71 TYR HA 4.100 . 4.600 2.595 2.363 2.857 . 0 0 "[ . 1 . ]" 1
710 1 29 TYR QE 1 71 TYR HB3 4.340 . 4.840 2.238 2.108 2.351 . 0 0 "[ . 1 . ]" 1
711 1 29 TYR QE 1 74 LEU HB2 6.170 . 6.670 5.219 5.007 5.417 . 0 0 "[ . 1 . ]" 1
712 1 29 TYR QE 1 74 LEU MD2 5.100 . 5.600 3.522 3.396 3.640 . 0 0 "[ . 1 . ]" 1
713 1 29 TYR QE 1 75 TYR QD 6.040 . 6.540 4.862 4.828 4.893 . 0 0 "[ . 1 . ]" 1
714 1 29 TYR QE 1 75 TYR QE 5.230 . 5.730 3.455 3.231 3.697 . 0 0 "[ . 1 . ]" 1
715 1 30 GLN H 1 30 GLN HB2 3.500 . 4.000 2.377 2.340 2.401 . 0 0 "[ . 1 . ]" 1
716 1 30 GLN H 1 30 GLN HB3 3.490 . 3.990 2.507 2.476 2.546 . 0 0 "[ . 1 . ]" 1
717 1 30 GLN H 1 54 PHE HZ 4.090 . 4.590 3.444 3.347 3.551 . 0 0 "[ . 1 . ]" 1
718 1 30 GLN H 1 54 PHE QE 4.800 . 5.300 4.165 4.071 4.263 . 0 0 "[ . 1 . ]" 1
719 1 30 GLN HA 1 30 GLN HE21 5.500 . 6.000 3.974 3.925 4.014 . 0 0 "[ . 1 . ]" 1
720 1 30 GLN HA 1 33 VAL H 4.480 . 4.980 3.860 3.789 3.950 . 0 0 "[ . 1 . ]" 1
721 1 30 GLN HA 1 33 VAL MG1 5.310 . 5.810 4.334 4.181 4.517 . 0 0 "[ . 1 . ]" 1
722 1 30 GLN HA 1 33 VAL MG2 5.800 . 6.300 3.067 2.485 3.791 . 0 0 "[ . 1 . ]" 1
723 1 30 GLN HA 1 50 VAL MG1 5.010 . 5.510 2.731 2.424 3.016 . 0 0 "[ . 1 . ]" 1
724 1 30 GLN HA 1 54 PHE HZ 3.260 . 3.760 2.062 2.019 2.104 . 0 0 "[ . 1 . ]" 1
725 1 30 GLN HA 1 54 PHE QE 3.320 . 3.820 2.499 2.428 2.573 . 0 0 "[ . 1 . ]" 1
726 1 30 GLN HB2 1 50 VAL MG1 6.260 . 6.760 4.063 3.889 4.251 . 0 0 "[ . 1 . ]" 1
727 1 30 GLN HB2 1 54 PHE QE 5.590 . 6.090 2.772 2.685 2.870 . 0 0 "[ . 1 . ]" 1
728 1 30 GLN HB3 1 31 HIS QB 5.800 . 6.300 4.238 3.996 4.671 . 0 0 "[ . 1 . ]" 1
729 1 30 GLN HB3 1 50 VAL MG1 6.300 . 6.800 4.692 4.509 4.865 . 0 0 "[ . 1 . ]" 1
730 1 30 GLN HB3 1 54 PHE HZ 4.670 . 5.170 4.624 4.564 4.676 . 0 0 "[ . 1 . ]" 1
731 1 30 GLN HB3 1 54 PHE QE 4.620 . 5.120 4.193 4.127 4.246 . 0 0 "[ . 1 . ]" 1
732 1 30 GLN HE21 1 50 VAL MG1 6.610 . 7.110 4.035 3.862 4.226 . 0 0 "[ . 1 . ]" 1
733 1 30 GLN HE21 1 54 PHE HZ 4.510 . 5.010 4.583 4.553 4.636 . 0 0 "[ . 1 . ]" 1
734 1 30 GLN HE21 1 54 PHE QD 4.520 . 5.020 3.663 3.523 3.840 . 0 0 "[ . 1 . ]" 1
735 1 30 GLN HE22 1 50 VAL MG1 6.610 . 7.110 5.126 4.883 5.342 . 0 0 "[ . 1 . ]" 1
736 1 30 GLN HE22 1 54 PHE QE 5.620 . 6.120 4.328 4.235 4.462 . 0 0 "[ . 1 . ]" 1
737 1 30 GLN HG2 1 31 HIS HA 5.370 . 5.870 4.206 4.125 4.284 . 0 0 "[ . 1 . ]" 1
738 1 30 GLN HG2 1 31 HIS QB 5.970 . 6.470 4.954 4.727 5.386 . 0 0 "[ . 1 . ]" 1
739 1 30 GLN HG2 1 50 VAL MG1 6.200 . 6.700 3.433 3.312 3.533 . 0 0 "[ . 1 . ]" 1
740 1 30 GLN HG2 1 54 PHE HZ 5.140 . 5.640 5.042 4.986 5.085 . 0 0 "[ . 1 . ]" 1
741 1 30 GLN HG2 1 54 PHE QE 4.990 . 5.490 3.902 3.852 3.999 . 0 0 "[ . 1 . ]" 1
742 1 30 GLN HG3 1 33 VAL MG1 7.330 . 7.830 6.003 5.778 6.176 . 0 0 "[ . 1 . ]" 1
743 1 30 GLN HG3 1 50 VAL MG1 5.900 . 6.400 2.475 2.356 2.609 . 0 0 "[ . 1 . ]" 1
744 1 30 GLN HG3 1 54 PHE QE 5.950 . 6.450 2.222 2.155 2.340 . 0 0 "[ . 1 . ]" 1
745 1 31 HIS H 1 32 LYS H 4.690 . 5.190 2.353 2.325 2.386 . 0 0 "[ . 1 . ]" 1
746 1 31 HIS HA 1 34 ALA MB 4.110 . 4.610 2.804 2.752 2.861 . 0 0 "[ . 1 . ]" 1
747 1 31 HIS HA 1 35 SER H 5.500 . 6.000 4.617 4.509 4.731 . 0 0 "[ . 1 . ]" 1
748 1 31 HIS HB3 1 32 LYS H 3.750 . 4.250 3.228 2.889 3.885 . 0 0 "[ . 1 . ]" 1
749 1 31 HIS QB 1 32 LYS H 5.020 . 5.520 2.832 2.786 2.864 . 0 0 "[ . 1 . ]" 1
750 1 31 HIS QB 1 32 LYS HA 6.170 . 6.670 4.119 3.919 4.234 . 0 0 "[ . 1 . ]" 1
751 1 31 HIS QB 1 32 LYS HB3 6.170 . 6.670 5.470 5.302 5.541 . 0 0 "[ . 1 . ]" 1
752 1 31 HIS QB 1 34 ALA MB 6.620 . 7.120 4.490 4.276 4.607 . 0 0 "[ . 1 . ]" 1
753 1 32 LYS H 1 32 LYS HB2 3.380 . 3.880 2.458 2.423 2.488 . 0 0 "[ . 1 . ]" 1
754 1 32 LYS H 1 32 LYS QE 5.590 . 6.090 4.423 3.555 4.986 . 0 0 "[ . 1 . ]" 1
755 1 32 LYS H 1 32 LYS QG 4.020 . 4.520 2.211 2.149 2.314 . 0 0 "[ . 1 . ]" 1
756 1 32 LYS H 1 33 VAL H 3.480 . 3.980 2.554 2.437 2.652 . 0 0 "[ . 1 . ]" 1
757 1 32 LYS H 1 33 VAL MG1 6.790 . 7.290 4.771 4.020 5.697 . 0 0 "[ . 1 . ]" 1
758 1 32 LYS HA 1 32 LYS QE 5.540 . 6.040 4.579 3.805 4.971 . 0 0 "[ . 1 . ]" 1
759 1 32 LYS HA 1 33 VAL HA 5.500 . 6.000 4.714 4.630 4.822 . 0 0 "[ . 1 . ]" 1
760 1 32 LYS HA 1 34 ALA H 4.450 . 4.950 4.415 4.376 4.445 . 0 0 "[ . 1 . ]" 1
761 1 32 LYS HA 1 35 SER HB3 3.320 . 3.820 3.262 3.113 3.362 . 0 0 "[ . 1 . ]" 1
762 1 32 LYS HA 1 75 TYR QE 5.950 . 6.450 5.159 5.011 5.291 . 0 0 "[ . 1 . ]" 1
763 1 32 LYS HB2 1 33 VAL H 4.380 . 4.880 2.727 2.652 2.875 . 0 0 "[ . 1 . ]" 1
764 1 32 LYS HB2 1 75 TYR QE 4.570 . 5.070 3.108 3.017 3.214 . 0 0 "[ . 1 . ]" 1
765 1 32 LYS HB3 1 32 LYS QE 4.400 . 4.900 3.702 2.006 4.150 . 0 0 "[ . 1 . ]" 1
766 1 32 LYS HB3 1 33 VAL H 4.410 . 4.910 3.784 3.708 3.867 . 0 0 "[ . 1 . ]" 1
767 1 32 LYS HB3 1 33 VAL MG1 7.150 . 7.650 4.804 3.787 6.037 . 0 0 "[ . 1 . ]" 1
768 1 32 LYS HB3 1 75 TYR QE 4.330 . 4.830 3.208 2.912 3.562 . 0 0 "[ . 1 . ]" 1
769 1 32 LYS QD 1 75 TYR QE 6.730 . 7.230 3.641 3.177 4.491 . 0 0 "[ . 1 . ]" 1
770 1 32 LYS QG 1 33 VAL H 6.130 . 6.630 4.088 4.057 4.164 . 0 0 "[ . 1 . ]" 1
771 1 32 LYS QG 1 75 TYR QE 6.390 . 6.890 4.693 4.463 4.963 . 0 0 "[ . 1 . ]" 1
772 1 33 VAL H 1 33 VAL HB 3.630 . 4.130 3.105 2.391 3.679 . 0 0 "[ . 1 . ]" 1
773 1 33 VAL H 1 33 VAL MG1 4.200 . 4.700 2.859 2.188 3.691 . 0 0 "[ . 1 . ]" 1
774 1 33 VAL H 1 34 ALA H 3.520 . 4.020 2.464 2.414 2.502 . 0 0 "[ . 1 . ]" 1
775 1 33 VAL H 1 34 ALA MB 6.350 . 6.850 4.149 4.101 4.183 . 0 0 "[ . 1 . ]" 1
776 1 33 VAL H 1 36 LEU H 5.500 . 6.000 5.037 4.919 5.128 . 0 0 "[ . 1 . ]" 1
777 1 33 VAL H 1 54 PHE HZ 5.150 . 5.650 4.150 4.095 4.190 . 0 0 "[ . 1 . ]" 1
778 1 33 VAL H 1 54 PHE QE 6.160 . 6.660 5.003 4.957 5.048 . 0 0 "[ . 1 . ]" 1
779 1 33 VAL H 1 75 TYR QE 5.250 . 5.750 4.191 3.487 4.706 . 0 0 "[ . 1 . ]" 1
780 1 33 VAL HA 1 34 ALA MB 6.610 . 7.110 5.012 4.989 5.032 . 0 0 "[ . 1 . ]" 1
781 1 33 VAL HA 1 35 SER HB3 4.920 . 5.420 4.796 4.651 4.929 . 0 0 "[ . 1 . ]" 1
782 1 33 VAL HA 1 36 LEU H 4.050 . 4.550 3.300 3.109 3.508 . 0 0 "[ . 1 . ]" 1
783 1 33 VAL HA 1 36 LEU HG 4.630 . 5.130 2.286 2.031 2.615 . 0 0 "[ . 1 . ]" 1
784 1 33 VAL HA 1 36 LEU MD2 5.430 . 5.930 2.505 2.272 2.734 . 0 0 "[ . 1 . ]" 1
785 1 33 VAL HA 1 37 VAL H 4.760 . 5.260 4.014 3.930 4.110 . 0 0 "[ . 1 . ]" 1
786 1 33 VAL HA 1 75 TYR QD 6.170 . 6.670 3.776 3.235 4.261 . 0 0 "[ . 1 . ]" 1
787 1 33 VAL HA 1 75 TYR QE 5.240 . 5.740 3.932 3.005 4.698 . 0 0 "[ . 1 . ]" 1
788 1 33 VAL HA 1 78 ALA MB 5.440 . 5.940 3.721 3.655 3.816 . 0 0 "[ . 1 . ]" 1
789 1 33 VAL HB 1 34 ALA H 4.060 . 4.560 3.448 2.577 4.144 . 0 0 "[ . 1 . ]" 1
790 1 33 VAL HB 1 34 ALA MB 6.240 . 6.740 4.640 3.921 5.216 . 0 0 "[ . 1 . ]" 1
791 1 33 VAL HB 1 35 SER H 5.300 . 5.800 5.139 4.825 5.395 . 0 0 "[ . 1 . ]" 1
792 1 33 VAL HB 1 53 ALA MB 6.210 . 6.710 4.566 4.200 5.062 . 0 0 "[ . 1 . ]" 1
793 1 33 VAL HB 1 54 PHE HZ 4.830 . 5.330 4.088 3.062 4.929 . 0 0 "[ . 1 . ]" 1
794 1 33 VAL HB 1 54 PHE QE 5.330 . 5.830 4.367 3.835 4.794 . 0 0 "[ . 1 . ]" 1
795 1 33 VAL HB 1 74 LEU MD2 6.610 . 7.110 5.042 4.902 5.217 . 0 0 "[ . 1 . ]" 1
796 1 33 VAL HB 1 78 ALA MB 6.100 . 6.600 3.159 2.221 4.291 . 0 0 "[ . 1 . ]" 1
797 1 33 VAL MG1 1 34 ALA H 5.610 . 6.110 3.795 3.545 3.996 . 0 0 "[ . 1 . ]" 1
798 1 33 VAL MG1 1 54 PHE HZ 4.430 . 4.930 3.516 3.314 3.755 . 0 0 "[ . 1 . ]" 1
799 1 33 VAL MG1 1 54 PHE QE 4.520 . 5.020 3.123 2.863 3.401 . 0 0 "[ . 1 . ]" 1
800 1 33 VAL MG1 1 74 LEU MD2 5.700 . 6.200 3.340 2.629 4.053 . 0 0 "[ . 1 . ]" 1
801 1 33 VAL MG1 1 75 TYR HA 6.570 . 7.070 3.241 2.835 3.775 . 0 0 "[ . 1 . ]" 1
802 1 33 VAL MG1 1 75 TYR QD 4.380 . 4.880 2.621 2.127 3.211 . 0 0 "[ . 1 . ]" 1
803 1 33 VAL MG1 1 75 TYR QE 4.950 . 5.450 3.362 2.920 3.880 . 0 0 "[ . 1 . ]" 1
804 1 33 VAL MG1 1 78 ALA HA 6.470 . 6.970 4.575 3.626 5.394 . 0 0 "[ . 1 . ]" 1
805 1 33 VAL MG1 1 78 ALA MB 5.370 . 5.870 2.467 1.820 3.046 . 0 0 "[ . 1 . ]" 1
806 1 33 VAL MG2 1 34 ALA H 5.870 . 6.370 3.110 2.483 3.876 . 0 0 "[ . 1 . ]" 1
807 1 33 VAL MG2 1 34 ALA HA 6.610 . 7.110 4.261 3.299 5.444 . 0 0 "[ . 1 . ]" 1
808 1 33 VAL MG2 1 34 ALA MB 7.120 . 7.620 3.995 3.198 4.966 . 0 0 "[ . 1 . ]" 1
809 1 33 VAL MG2 1 35 SER H 6.610 . 7.110 4.726 4.382 5.150 . 0 0 "[ . 1 . ]" 1
810 1 33 VAL MG2 1 36 LEU MD1 6.420 . 6.920 4.450 4.306 4.548 . 0 0 "[ . 1 . ]" 1
811 1 33 VAL MG2 1 37 VAL H 6.580 . 7.080 5.190 4.799 5.671 . 0 0 "[ . 1 . ]" 1
812 1 33 VAL MG2 1 50 VAL HA 5.400 . 5.900 3.911 3.278 4.664 . 0 0 "[ . 1 . ]" 1
813 1 33 VAL MG2 1 50 VAL MG1 4.670 . 5.170 2.662 2.093 3.309 . 0 0 "[ . 1 . ]" 1
814 1 33 VAL MG2 1 50 VAL MG2 5.390 . 5.890 2.917 2.071 3.894 . 0 0 "[ . 1 . ]" 1
815 1 33 VAL MG2 1 54 PHE H 6.790 . 7.290 5.563 5.303 5.834 . 0 0 "[ . 1 . ]" 1
816 1 33 VAL MG2 1 54 PHE HZ 5.140 . 5.640 2.418 2.248 2.671 . 0 0 "[ . 1 . ]" 1
817 1 33 VAL MG2 1 54 PHE QD 5.990 . 6.490 4.084 4.025 4.121 . 0 0 "[ . 1 . ]" 1
818 1 33 VAL MG2 1 54 PHE QE 6.230 . 6.730 2.506 2.104 2.824 . 0 0 "[ . 1 . ]" 1
819 1 33 VAL MG2 1 74 LEU MD1 6.350 . 6.850 4.017 3.640 4.378 . 0 0 "[ . 1 . ]" 1
820 1 33 VAL MG2 1 74 LEU MD2 6.320 . 6.820 3.370 2.587 4.042 . 0 0 "[ . 1 . ]" 1
821 1 33 VAL MG2 1 75 TYR HA 6.150 . 6.650 4.486 3.545 5.210 . 0 0 "[ . 1 . ]" 1
822 1 33 VAL MG2 1 78 ALA HA 6.120 . 6.620 5.099 4.885 5.256 . 0 0 "[ . 1 . ]" 1
823 1 33 VAL MG2 1 78 ALA MB 4.950 . 5.450 3.019 2.942 3.096 . 0 0 "[ . 1 . ]" 1
824 1 34 ALA H 1 35 SER H 3.730 . 4.230 2.603 2.510 2.700 . 0 0 "[ . 1 . ]" 1
825 1 34 ALA H 1 35 SER HB2 5.090 . 5.590 4.822 4.689 4.931 . 0 0 "[ . 1 . ]" 1
826 1 34 ALA H 1 35 SER HB3 5.100 . 5.600 4.903 4.791 5.025 . 0 0 "[ . 1 . ]" 1
827 1 34 ALA H 1 36 LEU H 5.500 . 6.000 4.411 4.211 4.590 . 0 0 "[ . 1 . ]" 1
828 1 34 ALA H 1 46 VAL MG2 6.610 . 7.110 5.118 4.586 5.406 . 0 0 "[ . 1 . ]" 1
829 1 34 ALA H 1 50 VAL MG1 6.610 . 7.110 3.802 3.611 3.974 . 0 0 "[ . 1 . ]" 1
830 1 34 ALA H 1 50 VAL MG2 5.040 . 5.540 3.272 2.932 3.567 . 0 0 "[ . 1 . ]" 1
831 1 34 ALA H 1 54 PHE QE 6.290 . 6.790 5.611 5.574 5.646 . 0 0 "[ . 1 . ]" 1
832 1 34 ALA H 1 78 ALA MB 6.510 . 7.010 5.476 5.318 5.610 . 0 0 "[ . 1 . ]" 1
833 1 34 ALA HA 1 36 LEU H 5.500 . 6.000 4.564 4.441 4.757 . 0 0 "[ . 1 . ]" 1
834 1 34 ALA HA 1 37 VAL H 4.750 . 5.250 3.511 3.419 3.643 . 0 0 "[ . 1 . ]" 1
835 1 34 ALA HA 1 37 VAL HB 3.970 . 4.470 4.048 3.954 4.117 . 0 0 "[ . 1 . ]" 1
836 1 34 ALA HA 1 37 VAL MG1 3.840 . 4.340 1.943 1.920 1.998 . 0 0 "[ . 1 . ]" 1
837 1 34 ALA HA 1 46 VAL MG2 4.470 . 4.970 2.788 2.419 3.062 . 0 0 "[ . 1 . ]" 1
838 1 34 ALA HA 1 50 VAL HA 5.500 . 6.000 5.171 5.002 5.268 . 0 0 "[ . 1 . ]" 1
839 1 34 ALA HA 1 50 VAL MG2 3.940 . 4.440 2.245 2.193 2.298 . 0 0 "[ . 1 . ]" 1
840 1 34 ALA HA 1 78 ALA MB 6.340 . 6.840 5.134 4.932 5.347 . 0 0 "[ . 1 . ]" 1
841 1 34 ALA MB 1 35 SER H 4.460 . 4.960 2.918 2.838 2.956 . 0 0 "[ . 1 . ]" 1
842 1 34 ALA MB 1 35 SER HA 5.760 . 6.260 3.955 3.908 3.994 . 0 0 "[ . 1 . ]" 1
843 1 34 ALA MB 1 35 SER HB2 5.820 . 6.320 4.178 4.103 4.227 . 0 0 "[ . 1 . ]" 1
844 1 34 ALA MB 1 35 SER HB3 6.200 . 6.700 4.902 4.840 4.933 . 0 0 "[ . 1 . ]" 1
845 1 34 ALA MB 1 36 LEU H 6.610 . 7.110 4.827 4.745 4.899 . 0 0 "[ . 1 . ]" 1
846 1 34 ALA MB 1 37 VAL MG2 7.930 . 8.430 5.482 5.383 5.537 . 0 0 "[ . 1 . ]" 1
847 1 34 ALA MB 1 46 VAL HB 6.610 . 7.110 5.419 4.901 5.632 . 0 0 "[ . 1 . ]" 1
848 1 34 ALA MB 1 46 VAL MG2 5.160 . 5.660 2.926 2.397 3.122 . 0 0 "[ . 1 . ]" 1
849 1 34 ALA MB 1 47 PRO HA 6.610 . 7.110 4.269 3.903 4.655 . 0 0 "[ . 1 . ]" 1
850 1 34 ALA MB 1 47 PRO HB3 6.610 . 7.110 5.190 4.730 5.566 . 0 0 "[ . 1 . ]" 1
851 1 34 ALA MB 1 50 VAL H 6.610 . 7.110 5.323 5.168 5.477 . 0 0 "[ . 1 . ]" 1
852 1 34 ALA MB 1 50 VAL MG1 5.860 . 6.360 2.993 2.804 3.193 . 0 0 "[ . 1 . ]" 1
853 1 34 ALA MB 1 50 VAL MG2 5.050 . 5.550 2.145 2.081 2.245 . 0 0 "[ . 1 . ]" 1
854 1 34 ALA MB 1 54 PHE QE 7.410 . 7.910 5.263 5.053 5.500 . 0 0 "[ . 1 . ]" 1
855 1 35 SER H 1 35 SER HB2 3.140 . 3.640 2.529 2.492 2.567 . 0 0 "[ . 1 . ]" 1
856 1 35 SER H 1 35 SER HB3 3.380 . 3.880 2.490 2.454 2.515 . 0 0 "[ . 1 . ]" 1
857 1 35 SER H 1 36 LEU H 3.570 . 4.070 2.554 2.431 2.665 . 0 0 "[ . 1 . ]" 1
858 1 35 SER H 1 37 VAL MG1 6.610 . 7.110 4.241 4.161 4.346 . 0 0 "[ . 1 . ]" 1
859 1 35 SER H 1 38 SER H 5.050 . 5.550 4.708 4.687 4.753 . 0 0 "[ . 1 . ]" 1
860 1 35 SER H 1 50 VAL MG2 6.610 . 7.110 4.790 4.622 4.937 . 0 0 "[ . 1 . ]" 1
861 1 35 SER HA 1 35 SER HB2 2.860 . 3.360 2.493 2.477 2.504 . 0 0 "[ . 1 . ]" 1
862 1 35 SER HA 1 38 SER H 5.410 . 5.910 3.825 3.668 3.905 . 0 0 "[ . 1 . ]" 1
863 1 35 SER HB2 1 36 LEU H 3.750 . 4.250 3.842 3.809 3.870 . 0 0 "[ . 1 . ]" 1
864 1 35 SER HB3 1 36 LEU H 3.520 . 4.020 2.529 2.453 2.615 . 0 0 "[ . 1 . ]" 1
865 1 35 SER HB3 1 36 LEU HB2 5.340 . 5.840 5.405 5.379 5.431 . 0 0 "[ . 1 . ]" 1
866 1 35 SER HB3 1 36 LEU HG 5.500 . 6.000 4.463 4.353 4.625 . 0 0 "[ . 1 . ]" 1
867 1 35 SER HB3 1 36 LEU MD2 6.610 . 7.110 4.388 4.300 4.512 . 0 0 "[ . 1 . ]" 1
868 1 36 LEU H 1 36 LEU HB2 3.700 . 4.200 3.646 3.616 3.661 . 0 0 "[ . 1 . ]" 1
869 1 36 LEU H 1 36 LEU HG 3.940 . 4.440 2.167 2.073 2.284 . 0 0 "[ . 1 . ]" 1
870 1 36 LEU H 1 36 LEU MD1 5.440 . 5.940 3.664 3.591 3.786 . 0 0 "[ . 1 . ]" 1
871 1 36 LEU H 1 36 LEU MD2 5.100 . 5.600 3.240 3.163 3.293 . 0 0 "[ . 1 . ]" 1
872 1 36 LEU H 1 37 VAL H 3.500 . 4.000 2.489 2.449 2.560 . 0 0 "[ . 1 . ]" 1
873 1 36 LEU H 1 37 VAL HB 4.810 . 5.310 4.604 4.554 4.671 . 0 0 "[ . 1 . ]" 1
874 1 36 LEU H 1 37 VAL MG1 6.570 . 7.070 4.174 4.080 4.241 . 0 0 "[ . 1 . ]" 1
875 1 36 LEU H 1 38 SER H 4.800 . 5.300 4.025 3.976 4.120 . 0 0 "[ . 1 . ]" 1
876 1 36 LEU HA 1 37 VAL HA 4.720 . 5.220 4.620 4.597 4.646 . 0 0 "[ . 1 . ]" 1
877 1 36 LEU HA 1 39 ARG QD 4.920 . 5.420 2.921 2.288 4.029 . 0 0 "[ . 1 . ]" 1
878 1 36 LEU HB2 1 37 VAL H 4.080 . 4.580 4.169 4.139 4.201 . 0 0 "[ . 1 . ]" 1
879 1 36 LEU HB2 1 37 VAL HA 5.500 . 6.000 4.727 4.690 4.768 . 0 0 "[ . 1 . ]" 1
880 1 36 LEU HB2 1 78 ALA MB 6.970 . 7.470 5.402 5.289 5.506 . 0 0 "[ . 1 . ]" 1
881 1 36 LEU HB2 1 79 VAL HB 4.950 . 5.450 4.966 4.795 5.089 . 0 0 "[ . 1 . ]" 1
882 1 36 LEU HB3 1 37 VAL H 4.190 . 4.690 4.158 4.065 4.205 . 0 0 "[ . 1 . ]" 1
883 1 36 LEU HG 1 37 VAL H 4.830 . 5.330 2.570 2.363 2.681 . 0 0 "[ . 1 . ]" 1
884 1 36 LEU HG 1 37 VAL HA 5.500 . 6.000 4.425 4.188 4.560 . 0 0 "[ . 1 . ]" 1
885 1 36 LEU HG 1 40 TYR QE 6.170 . 6.670 5.546 5.508 5.626 . 0 0 "[ . 1 . ]" 1
886 1 36 LEU MD1 1 37 VAL H 4.240 . 4.740 2.830 2.770 2.957 . 0 0 "[ . 1 . ]" 1
887 1 36 LEU MD1 1 37 VAL HA 4.240 . 4.740 2.591 2.524 2.650 . 0 0 "[ . 1 . ]" 1
888 1 36 LEU MD1 1 78 ALA MB 5.350 . 5.850 2.209 2.136 2.306 . 0 0 "[ . 1 . ]" 1
889 1 36 LEU MD2 1 37 VAL H 5.360 . 5.860 4.218 4.053 4.300 . 0 0 "[ . 1 . ]" 1
890 1 36 LEU MD2 1 37 VAL HA 6.550 . 7.050 5.273 5.152 5.348 . 0 0 "[ . 1 . ]" 1
891 1 36 LEU MD2 1 40 TYR QD 7.680 . 8.180 5.760 5.709 5.846 . 0 0 "[ . 1 . ]" 1
892 1 36 LEU MD2 1 75 TYR HA 4.730 . 5.230 2.744 2.471 2.979 . 0 0 "[ . 1 . ]" 1
893 1 36 LEU MD2 1 75 TYR HB2 4.790 . 5.290 3.701 3.510 3.953 . 0 0 "[ . 1 . ]" 1
894 1 36 LEU MD2 1 75 TYR HB3 5.370 . 5.870 2.369 2.206 2.552 . 0 0 "[ . 1 . ]" 1
895 1 36 LEU MD2 1 75 TYR QD 4.330 . 4.830 2.569 2.263 2.850 . 0 0 "[ . 1 . ]" 1
896 1 36 LEU MD2 1 76 ARG H 6.610 . 7.110 5.374 5.200 5.525 . 0 0 "[ . 1 . ]" 1
897 1 36 LEU MD2 1 78 ALA MB 5.620 . 6.120 3.280 2.984 3.448 . 0 0 "[ . 1 . ]" 1
898 1 36 LEU MD2 1 79 VAL H 5.940 . 6.440 4.896 4.756 4.996 . 0 0 "[ . 1 . ]" 1
899 1 36 LEU MD2 1 79 VAL HB 6.610 . 7.110 4.528 4.369 4.630 . 0 0 "[ . 1 . ]" 1
900 1 37 VAL H 1 37 VAL HB 3.660 . 4.160 2.496 2.436 2.551 . 0 0 "[ . 1 . ]" 1
901 1 37 VAL H 1 37 VAL MG1 4.310 . 4.810 2.308 2.220 2.350 . 0 0 "[ . 1 . ]" 1
902 1 37 VAL H 1 38 SER H 3.780 . 4.280 2.422 2.376 2.476 . 0 0 "[ . 1 . ]" 1
903 1 37 VAL H 1 40 TYR QD 5.580 . 6.080 4.619 4.517 4.686 . 0 0 "[ . 1 . ]" 1
904 1 37 VAL H 1 78 ALA MB 5.680 . 6.180 4.406 4.322 4.499 . 0 0 "[ . 1 . ]" 1
905 1 37 VAL HA 1 38 SER HA 4.870 . 5.370 4.798 4.773 4.865 . 0 0 "[ . 1 . ]" 1
906 1 37 VAL HA 1 38 SER HB2 5.800 . 6.300 5.763 5.491 5.815 . 0 0 "[ . 1 . ]" 1
907 1 37 VAL HA 1 40 TYR H 4.770 . 5.270 3.359 3.302 3.399 . 0 0 "[ . 1 . ]" 1
908 1 37 VAL HA 1 40 TYR HA 5.500 . 6.000 5.512 5.436 5.544 . 0 0 "[ . 1 . ]" 1
909 1 37 VAL HA 1 40 TYR QD 3.320 . 3.820 1.993 1.936 2.043 . 0 0 "[ . 1 . ]" 1
910 1 37 VAL HA 1 40 TYR QE 5.760 . 6.260 3.832 3.741 3.893 . 0 0 "[ . 1 . ]" 1
911 1 37 VAL HA 1 41 VAL MG2 6.400 . 6.900 4.106 4.051 4.207 . 0 0 "[ . 1 . ]" 1
912 1 37 VAL HA 1 78 ALA MB 5.630 . 6.130 4.423 4.281 4.601 . 0 0 "[ . 1 . ]" 1
913 1 37 VAL HB 1 38 SER H 4.490 . 4.990 4.134 4.118 4.156 . 0 0 "[ . 1 . ]" 1
914 1 37 VAL HB 1 46 VAL HA 6.200 . 6.700 6.205 5.922 6.339 . 0 0 "[ . 1 . ]" 1
915 1 37 VAL HB 1 78 ALA HA 5.500 . 6.000 4.818 4.704 4.999 . 0 0 "[ . 1 . ]" 1
916 1 37 VAL HB 1 82 ALA MB 5.090 . 5.590 4.260 4.232 4.279 . 0 0 "[ . 1 . ]" 1
917 1 37 VAL MG1 1 38 SER H 4.820 . 5.320 2.602 2.476 2.657 . 0 0 "[ . 1 . ]" 1
918 1 37 VAL MG1 1 38 SER HA 6.610 . 7.110 3.481 3.165 3.553 . 0 0 "[ . 1 . ]" 1
919 1 37 VAL MG1 1 38 SER HB2 4.950 . 5.450 3.786 3.509 4.263 . 0 0 "[ . 1 . ]" 1
920 1 37 VAL MG1 1 40 TYR QD 7.410 . 7.910 4.740 4.643 4.787 . 0 0 "[ . 1 . ]" 1
921 1 37 VAL MG1 1 41 VAL MG2 4.870 . 5.370 2.888 2.626 2.994 . 0 0 "[ . 1 . ]" 1
922 1 37 VAL MG1 1 46 VAL HA 4.950 . 5.450 3.166 2.903 3.354 . 0 0 "[ . 1 . ]" 1
923 1 37 VAL MG1 1 46 VAL HB 6.410 . 6.910 3.916 3.238 4.065 . 0 0 "[ . 1 . ]" 1
924 1 37 VAL MG1 1 49 VAL MG2 7.440 . 7.940 4.440 4.245 4.641 . 0 0 "[ . 1 . ]" 1
925 1 37 VAL MG1 1 78 ALA MB 6.160 . 6.660 3.358 3.145 3.712 . 0 0 "[ . 1 . ]" 1
926 1 37 VAL MG1 1 82 ALA MB 6.200 . 6.700 3.946 3.910 4.061 . 0 0 "[ . 1 . ]" 1
927 1 37 VAL MG2 1 39 ARG H 6.160 . 6.660 4.577 4.510 4.736 . 0 0 "[ . 1 . ]" 1
928 1 37 VAL MG2 1 40 TYR QD 6.090 . 6.590 3.124 2.960 3.249 . 0 0 "[ . 1 . ]" 1
929 1 37 VAL MG2 1 41 VAL MG2 4.570 . 5.070 2.260 2.090 2.337 . 0 0 "[ . 1 . ]" 1
930 1 37 VAL MG2 1 46 VAL HA 4.720 . 5.220 4.010 3.973 4.035 . 0 0 "[ . 1 . ]" 1
931 1 37 VAL MG2 1 46 VAL HB 6.450 . 6.950 5.115 4.621 5.237 . 0 0 "[ . 1 . ]" 1
932 1 37 VAL MG2 1 49 VAL HB 4.670 . 5.170 3.200 3.063 3.418 . 0 0 "[ . 1 . ]" 1
933 1 37 VAL MG2 1 49 VAL MG1 4.980 . 5.480 2.037 1.973 2.190 . 0 0 "[ . 1 . ]" 1
934 1 37 VAL MG2 1 49 VAL MG2 6.090 . 6.590 3.709 3.562 3.826 . 0 0 "[ . 1 . ]" 1
935 1 37 VAL MG2 1 50 VAL H 6.110 . 6.610 4.643 4.526 4.795 . 0 0 "[ . 1 . ]" 1
936 1 37 VAL MG2 1 82 ALA MB 5.190 . 5.690 1.952 1.928 1.992 . 0 0 "[ . 1 . ]" 1
937 1 38 SER H 1 38 SER HB2 3.930 . 4.430 2.478 2.241 2.544 . 0 0 "[ . 1 . ]" 1
938 1 38 SER H 1 38 SER HB3 3.420 . 3.920 2.678 2.487 3.545 . 0 0 "[ . 1 . ]" 1
939 1 38 SER H 1 39 ARG H 3.940 . 4.440 2.604 2.555 2.738 . 0 0 "[ . 1 . ]" 1
940 1 38 SER H 1 41 VAL MG2 6.590 . 7.090 4.562 4.496 4.620 . 0 0 "[ . 1 . ]" 1
941 1 38 SER HA 1 39 ARG HA 4.800 . 5.300 4.704 4.598 4.739 . 0 0 "[ . 1 . ]" 1
942 1 38 SER HA 1 40 TYR H 4.930 . 5.430 3.559 3.501 3.669 . 0 0 "[ . 1 . ]" 1
943 1 38 SER HA 1 41 VAL H 4.270 . 4.770 3.192 3.133 3.336 . 0 0 "[ . 1 . ]" 1
944 1 38 SER HA 1 41 VAL HB 5.390 . 5.890 5.262 5.178 5.427 . 0 0 "[ . 1 . ]" 1
945 1 38 SER HA 1 41 VAL MG2 5.600 . 6.100 2.952 2.881 3.089 . 0 0 "[ . 1 . ]" 1
946 1 38 SER HA 1 46 VAL HA 5.500 . 6.000 4.419 4.253 4.840 . 0 0 "[ . 1 . ]" 1
947 1 38 SER HA 1 46 VAL MG1 4.560 . 5.060 3.878 3.840 3.966 . 0 0 "[ . 1 . ]" 1
948 1 38 SER HA 1 46 VAL MG2 5.990 . 6.490 2.384 2.194 3.202 . 0 0 "[ . 1 . ]" 1
949 1 38 SER HB2 1 39 ARG H 5.500 . 6.000 4.100 3.226 4.308 . 0 0 "[ . 1 . ]" 1
950 1 38 SER HB2 1 41 VAL MG2 6.610 . 7.110 4.905 4.730 5.568 . 0 0 "[ . 1 . ]" 1
951 1 38 SER HB3 1 39 ARG H 5.500 . 6.000 3.448 3.282 4.061 . 0 0 "[ . 1 . ]" 1
952 1 38 SER HB3 1 41 VAL MG2 6.610 . 7.110 5.470 5.206 5.545 . 0 0 "[ . 1 . ]" 1
953 1 38 SER HB3 1 46 VAL MG1 5.640 . 6.140 4.743 4.393 4.817 . 0 0 "[ . 1 . ]" 1
954 1 39 ARG H 1 39 ARG HB2 4.010 . 4.510 2.709 2.396 3.713 . 0 0 "[ . 1 . ]" 1
955 1 39 ARG H 1 39 ARG HB3 4.060 . 4.560 3.486 2.689 3.645 . 0 0 "[ . 1 . ]" 1
956 1 39 ARG H 1 39 ARG HG2 4.210 . 4.710 3.224 2.006 3.699 . 0 0 "[ . 1 . ]" 1
957 1 39 ARG H 1 39 ARG HG3 3.610 . 4.110 2.413 2.132 3.496 . 0 0 "[ . 1 . ]" 1
958 1 39 ARG H 1 39 ARG QD 5.610 . 6.110 3.919 3.674 4.355 . 0 0 "[ . 1 . ]" 1
959 1 39 ARG H 1 40 TYR H 3.560 . 4.060 2.452 2.367 2.499 . 0 0 "[ . 1 . ]" 1
960 1 39 ARG H 1 40 TYR QD 4.840 . 5.340 3.569 3.411 3.773 . 0 0 "[ . 1 . ]" 1
961 1 39 ARG H 1 41 VAL MG2 6.610 . 7.110 4.741 4.669 4.895 . 0 0 "[ . 1 . ]" 1
962 1 39 ARG HA 1 39 ARG HB2 2.920 . 3.420 2.927 2.360 3.040 . 0 0 "[ . 1 . ]" 1
963 1 39 ARG HA 1 39 ARG HG2 4.130 . 4.630 2.773 2.495 3.768 . 0 0 "[ . 1 . ]" 1
964 1 39 ARG HA 1 39 ARG HG3 3.810 . 4.310 3.249 2.984 3.738 . 0 0 "[ . 1 . ]" 1
965 1 39 ARG HA 1 40 TYR HA 5.500 . 6.000 4.554 4.539 4.581 . 0 0 "[ . 1 . ]" 1
966 1 39 ARG HB2 1 40 TYR H 4.950 . 5.450 3.658 3.437 4.440 . 0 0 "[ . 1 . ]" 1
967 1 39 ARG HB2 1 40 TYR QD 5.600 . 6.100 3.610 3.093 5.138 . 0 0 "[ . 1 . ]" 1
968 1 39 ARG HB3 1 40 TYR H 4.610 . 5.110 4.359 4.262 4.435 . 0 0 "[ . 1 . ]" 1
969 1 39 ARG HB3 1 40 TYR QD 5.780 . 6.280 4.735 4.503 5.237 . 0 0 "[ . 1 . ]" 1
970 1 39 ARG HB3 1 40 TYR QE 6.170 . 6.670 4.770 4.457 5.580 . 0 0 "[ . 1 . ]" 1
971 1 39 ARG QD 1 40 TYR QE 6.120 . 6.620 4.107 2.912 4.903 . 0 0 "[ . 1 . ]" 1
972 1 40 TYR H 1 40 TYR HB3 3.880 . 4.380 3.748 3.692 3.769 . 0 0 "[ . 1 . ]" 1
973 1 40 TYR H 1 40 TYR QD 3.630 . 4.130 3.070 2.892 3.235 . 0 0 "[ . 1 . ]" 1
974 1 40 TYR H 1 40 TYR QE 5.630 . 6.130 4.978 4.880 5.059 . 0 0 "[ . 1 . ]" 1
975 1 40 TYR H 1 41 VAL H 3.260 . 3.760 1.931 1.894 2.026 . 0 0 "[ . 1 . ]" 1
976 1 40 TYR H 1 41 VAL MG1 5.970 . 6.470 4.437 4.272 4.548 . 0 0 "[ . 1 . ]" 1
977 1 40 TYR H 1 41 VAL MG2 5.440 . 5.940 3.404 3.354 3.603 . 0 0 "[ . 1 . ]" 1
978 1 40 TYR HA 1 40 TYR QD 3.610 . 4.110 2.706 2.560 2.846 . 0 0 "[ . 1 . ]" 1
979 1 40 TYR HA 1 40 TYR QE 5.590 . 6.090 4.575 4.528 4.625 . 0 0 "[ . 1 . ]" 1
980 1 40 TYR HA 1 41 VAL MG1 6.610 . 7.110 4.358 4.224 4.390 . 0 0 "[ . 1 . ]" 1
981 1 40 TYR HA 1 41 VAL MG2 6.610 . 7.110 4.777 4.714 4.999 . 0 0 "[ . 1 . ]" 1
982 1 40 TYR HA 1 82 ALA MB 6.210 . 6.710 4.278 4.175 4.680 . 0 0 "[ . 1 . ]" 1
983 1 40 TYR HA 1 86 LEU MD1 6.590 . 7.090 4.220 3.831 4.504 . 0 0 "[ . 1 . ]" 1
984 1 40 TYR HB2 1 41 VAL H 4.450 . 4.950 3.245 3.077 3.328 . 0 0 "[ . 1 . ]" 1
985 1 40 TYR HB2 1 41 VAL MG1 5.260 . 5.760 3.509 3.178 3.611 . 0 0 "[ . 1 . ]" 1
986 1 40 TYR HB2 1 41 VAL MG2 5.400 . 5.900 3.268 3.187 3.447 . 0 0 "[ . 1 . ]" 1
987 1 40 TYR HB2 1 82 ALA MB 5.660 . 6.160 2.316 2.217 2.682 . 0 0 "[ . 1 . ]" 1
988 1 40 TYR HB2 1 83 LYS HG3 5.500 . 6.000 4.871 4.634 5.066 . 0 0 "[ . 1 . ]" 1
989 1 40 TYR HB2 1 86 LEU MD1 6.320 . 6.820 5.013 4.740 5.122 . 0 0 "[ . 1 . ]" 1
990 1 40 TYR HB3 1 41 VAL H 4.250 . 4.750 4.106 3.977 4.182 . 0 0 "[ . 1 . ]" 1
991 1 40 TYR HB3 1 82 ALA MB 4.760 . 5.260 2.421 2.317 2.755 . 0 0 "[ . 1 . ]" 1
992 1 40 TYR HB3 1 86 LEU MD1 6.120 . 6.620 3.965 3.664 4.102 . 0 0 "[ . 1 . ]" 1
993 1 40 TYR QD 1 79 VAL MG1 7.160 . 7.660 5.060 4.966 5.110 . 0 0 "[ . 1 . ]" 1
994 1 40 TYR QD 1 79 VAL MG2 4.830 . 5.330 2.997 2.898 3.093 . 0 0 "[ . 1 . ]" 1
995 1 40 TYR QD 1 82 ALA MB 5.810 . 6.310 3.492 3.382 3.787 . 0 0 "[ . 1 . ]" 1
996 1 40 TYR QD 1 83 LYS HE2 6.170 . 6.670 3.217 3.146 3.312 . 0 0 "[ . 1 . ]" 1
997 1 40 TYR QD 1 83 LYS QD 5.920 . 6.420 4.759 4.742 4.776 . 0 0 "[ . 1 . ]" 1
998 1 40 TYR QD 1 86 LEU MD1 6.830 . 7.330 4.816 4.367 5.059 . 0 0 "[ . 1 . ]" 1
999 1 40 TYR QE 1 79 VAL HA 5.890 . 6.390 4.401 4.138 4.868 . 0 0 "[ . 1 . ]" 1
1000 1 40 TYR QE 1 79 VAL HB 4.930 . 5.430 3.352 3.137 3.683 . 0 0 "[ . 1 . ]" 1
1001 1 40 TYR QE 1 79 VAL MG1 5.730 . 6.230 4.325 4.282 4.360 . 0 0 "[ . 1 . ]" 1
1002 1 40 TYR QE 1 79 VAL MG2 3.910 . 4.410 2.706 2.668 2.766 . 0 0 "[ . 1 . ]" 1
1003 1 40 TYR QE 1 82 ALA MB 7.290 . 7.790 4.913 4.835 5.113 . 0 0 "[ . 1 . ]" 1
1004 1 40 TYR QE 1 83 LYS HE2 4.600 . 5.100 3.056 2.978 3.264 . 0 0 "[ . 1 . ]" 1
1005 1 41 VAL H 1 42 PRO QD 6.170 . 6.670 4.345 4.332 4.377 . 0 0 "[ . 1 . ]" 1
1006 1 41 VAL H 1 46 VAL HA 5.290 . 5.790 5.275 5.177 5.455 . 0 0 "[ . 1 . ]" 1
1007 1 41 VAL H 1 82 ALA MB 6.590 . 7.090 4.025 3.943 4.231 . 0 0 "[ . 1 . ]" 1
1008 1 41 VAL HA 1 42 PRO HG2 5.500 . 6.000 4.570 4.533 4.665 . 0 0 "[ . 1 . ]" 1
1009 1 41 VAL HA 1 42 PRO HG3 5.080 . 5.580 4.604 4.574 4.633 . 0 0 "[ . 1 . ]" 1
1010 1 41 VAL HA 1 42 PRO QD 3.770 . 4.270 2.151 2.127 2.184 . 0 0 "[ . 1 . ]" 1
1011 1 41 VAL HA 1 86 LEU MD1 6.610 . 7.110 3.023 2.586 3.590 . 0 0 "[ . 1 . ]" 1
1012 1 41 VAL HA 1 86 LEU MD2 6.500 . 7.000 3.409 2.914 3.692 . 0 0 "[ . 1 . ]" 1
1013 1 41 VAL HB 1 42 PRO QD 3.740 . 4.240 2.057 1.918 2.105 . 0 0 "[ . 1 . ]" 1
1014 1 41 VAL HB 1 45 ASP HB2 4.960 . 5.460 2.506 2.377 3.621 . 0 0 "[ . 1 . ]" 1
1015 1 41 VAL HB 1 45 ASP HB3 3.840 . 4.340 3.330 2.056 3.531 . 0 0 "[ . 1 . ]" 1
1016 1 41 VAL HB 1 49 VAL MG2 6.610 . 7.110 3.685 3.583 4.017 . 0 0 "[ . 1 . ]" 1
1017 1 41 VAL MG1 1 42 PRO HG2 6.270 . 6.770 4.806 4.726 5.115 . 0 0 "[ . 1 . ]" 1
1018 1 41 VAL MG1 1 42 PRO QD 5.880 . 6.380 2.806 2.738 3.055 . 0 0 "[ . 1 . ]" 1
1019 1 41 VAL MG1 1 45 ASP HA 6.610 . 7.110 5.551 5.518 5.577 . 0 0 "[ . 1 . ]" 1
1020 1 41 VAL MG1 1 45 ASP HB2 5.310 . 5.810 3.627 3.545 4.504 . 0 0 "[ . 1 . ]" 1
1021 1 41 VAL MG1 1 45 ASP HB3 5.870 . 6.370 3.639 3.468 3.705 . 0 0 "[ . 1 . ]" 1
1022 1 41 VAL MG1 1 49 VAL MG2 6.260 . 6.760 2.267 2.129 2.607 . 0 0 "[ . 1 . ]" 1
1023 1 41 VAL MG1 1 85 TYR HB3 6.610 . 7.110 3.080 2.749 3.435 . 0 0 "[ . 1 . ]" 1
1024 1 41 VAL MG1 1 85 TYR QD 4.880 . 5.380 2.609 2.428 3.160 . 0 0 "[ . 1 . ]" 1
1025 1 41 VAL MG1 1 85 TYR QE 7.410 . 7.910 3.778 3.602 4.304 . 0 0 "[ . 1 . ]" 1
1026 1 41 VAL MG1 1 86 LEU H 5.740 . 6.240 4.140 3.952 4.382 . 0 0 "[ . 1 . ]" 1
1027 1 41 VAL MG1 1 86 LEU HB3 5.640 . 6.140 4.772 4.696 4.880 . 0 0 "[ . 1 . ]" 1
1028 1 41 VAL MG1 1 86 LEU MD1 5.810 . 6.310 2.436 2.184 3.127 . 0 0 "[ . 1 . ]" 1
1029 1 41 VAL MG2 1 42 PRO HA 6.610 . 7.110 4.714 4.537 4.749 . 0 0 "[ . 1 . ]" 1
1030 1 41 VAL MG2 1 42 PRO QD 6.340 . 6.840 3.581 3.361 3.615 . 0 0 "[ . 1 . ]" 1
1031 1 41 VAL MG2 1 45 ASP HA 6.610 . 7.110 4.949 4.508 5.113 . 0 0 "[ . 1 . ]" 1
1032 1 41 VAL MG2 1 45 ASP HB2 4.980 . 5.480 3.640 3.496 4.279 . 0 0 "[ . 1 . ]" 1
1033 1 41 VAL MG2 1 45 ASP HB3 5.180 . 5.680 3.848 2.857 4.036 . 0 0 "[ . 1 . ]" 1
1034 1 41 VAL MG2 1 46 VAL H 5.750 . 6.250 3.585 3.227 3.645 . 0 0 "[ . 1 . ]" 1
1035 1 41 VAL MG2 1 46 VAL HA 4.590 . 5.090 2.160 2.085 2.294 . 0 0 "[ . 1 . ]" 1
1036 1 41 VAL MG2 1 46 VAL HB 6.610 . 7.110 2.636 2.405 2.696 . 0 0 "[ . 1 . ]" 1
1037 1 41 VAL MG2 1 46 VAL MG1 5.730 . 6.230 3.945 3.822 4.005 . 0 0 "[ . 1 . ]" 1
1038 1 41 VAL MG2 1 47 PRO HD2 6.610 . 7.110 5.064 4.855 5.170 . 0 0 "[ . 1 . ]" 1
1039 1 41 VAL MG2 1 49 VAL HB 5.490 . 5.990 2.700 2.639 2.881 . 0 0 "[ . 1 . ]" 1
1040 1 41 VAL MG2 1 49 VAL MG2 5.910 . 6.410 2.428 2.248 2.786 . 0 0 "[ . 1 . ]" 1
1041 1 41 VAL MG2 1 82 ALA HA 5.100 . 5.600 3.907 3.789 4.245 . 0 0 "[ . 1 . ]" 1
1042 1 41 VAL MG2 1 82 ALA MB 6.530 . 7.030 2.704 2.585 3.008 . 0 0 "[ . 1 . ]" 1
1043 1 41 VAL MG2 1 85 TYR QD 6.940 . 7.440 4.522 4.397 4.870 . 0 0 "[ . 1 . ]" 1
1044 1 41 VAL MG2 1 85 TYR QE 7.410 . 7.910 5.018 4.853 5.332 . 0 0 "[ . 1 . ]" 1
1045 1 41 VAL MG2 1 86 LEU MD1 7.850 . 8.350 4.568 4.417 4.959 . 0 0 "[ . 1 . ]" 1
1046 1 42 PRO HA 1 43 SER H 3.200 . 3.700 2.427 2.400 2.476 . 0 0 "[ . 1 . ]" 1
1047 1 42 PRO HA 1 43 SER HA 4.800 . 5.300 4.285 4.268 4.312 . 0 0 "[ . 1 . ]" 1
1048 1 42 PRO HA 1 44 GLY H 5.500 . 6.000 4.113 4.087 4.142 . 0 0 "[ . 1 . ]" 1
1049 1 42 PRO HB2 1 43 SER H 4.130 . 4.630 2.657 2.530 2.713 . 0 0 "[ . 1 . ]" 1
1050 1 42 PRO HB2 1 45 ASP H 5.140 . 5.640 3.852 3.797 3.960 . 0 0 "[ . 1 . ]" 1
1051 1 42 PRO HB3 1 43 SER H 4.220 . 4.720 3.575 3.518 3.609 . 0 0 "[ . 1 . ]" 1
1052 1 42 PRO HG2 1 44 GLY H 5.500 . 6.000 3.097 2.861 3.164 . 0 0 "[ . 1 . ]" 1
1053 1 42 PRO HG2 1 45 ASP H 5.480 . 5.980 2.718 2.703 2.737 . 0 0 "[ . 1 . ]" 1
1054 1 42 PRO HG3 1 44 GLY H 4.910 . 5.410 4.415 4.235 4.471 . 0 0 "[ . 1 . ]" 1
1055 1 42 PRO HG3 1 45 ASP H 4.480 . 4.980 4.509 4.497 4.526 . 0 0 "[ . 1 . ]" 1
1056 1 42 PRO QD 1 45 ASP H 4.690 . 5.190 3.936 3.719 3.999 . 0 0 "[ . 1 . ]" 1
1057 1 42 PRO QD 1 45 ASP HA 6.170 . 6.670 5.392 5.119 5.462 . 0 0 "[ . 1 . ]" 1
1058 1 42 PRO QD 1 45 ASP HB2 5.140 . 5.640 2.595 2.391 3.268 . 0 0 "[ . 1 . ]" 1
1059 1 42 PRO QD 1 45 ASP HB3 4.690 . 5.190 3.859 2.354 4.013 . 0 0 "[ . 1 . ]" 1
1060 1 42 PRO QD 1 46 VAL HA 6.170 . 6.670 5.474 5.377 5.614 . 0 0 "[ . 1 . ]" 1
1061 1 42 PRO QD 1 85 TYR QE 6.650 . 7.150 4.531 4.219 4.890 . 0 0 "[ . 1 . ]" 1
1062 1 43 SER H 1 44 GLY H 4.090 . 4.590 2.761 2.737 2.781 . 0 0 "[ . 1 . ]" 1
1063 1 43 SER H 1 45 ASP H 5.320 . 5.820 4.358 4.317 4.385 . 0 0 "[ . 1 . ]" 1
1064 1 43 SER H 1 46 VAL H 5.500 . 6.000 4.939 4.892 5.046 . 0 0 "[ . 1 . ]" 1
1065 1 43 SER H 1 46 VAL MG1 6.280 . 6.780 4.448 4.238 4.521 . 0 0 "[ . 1 . ]" 1
1066 1 43 SER HA 1 46 VAL H 4.310 . 4.810 3.237 3.167 3.422 . 0 0 "[ . 1 . ]" 1
1067 1 43 SER HA 1 46 VAL HB 4.330 . 4.830 2.803 2.639 3.347 . 0 0 "[ . 1 . ]" 1
1068 1 43 SER HA 1 46 VAL MG1 3.860 . 4.360 2.096 1.969 2.153 . 0 0 "[ . 1 . ]" 1
1069 1 44 GLY H 1 45 ASP H 3.760 . 4.260 2.374 2.355 2.415 . 0 0 "[ . 1 . ]" 1
1070 1 44 GLY H 1 45 ASP HA 5.500 . 6.000 5.083 5.068 5.121 . 0 0 "[ . 1 . ]" 1
1071 1 44 GLY H 1 46 VAL H 5.080 . 5.580 3.729 3.693 3.822 . 0 0 "[ . 1 . ]" 1
1072 1 44 GLY H 1 47 PRO HD3 5.500 . 6.000 5.326 5.277 5.412 . 0 0 "[ . 1 . ]" 1
1073 1 44 GLY HA2 1 46 VAL H 5.500 . 6.000 4.256 4.217 4.343 . 0 0 "[ . 1 . ]" 1
1074 1 44 GLY HA3 1 46 VAL H 4.580 . 5.080 4.660 4.640 4.728 . 0 0 "[ . 1 . ]" 1
1075 1 44 GLY HA3 1 47 PRO HD2 5.400 . 5.900 5.205 5.073 5.256 . 0 0 "[ . 1 . ]" 1
1076 1 44 GLY HA3 1 47 PRO HD3 5.500 . 6.000 5.582 5.550 5.610 . 0 0 "[ . 1 . ]" 1
1077 1 45 ASP H 1 45 ASP HB2 3.770 . 4.270 2.544 2.482 3.000 . 0 0 "[ . 1 . ]" 1
1078 1 45 ASP H 1 45 ASP HB3 3.640 . 4.140 3.647 2.598 3.724 . 0 0 "[ . 1 . ]" 1
1079 1 45 ASP H 1 46 VAL H 3.080 . 3.580 2.046 2.009 2.077 . 0 0 "[ . 1 . ]" 1
1080 1 45 ASP H 1 46 VAL HB 5.010 . 5.510 3.970 3.881 4.286 . 0 0 "[ . 1 . ]" 1
1081 1 45 ASP H 1 46 VAL MG1 6.220 . 6.720 3.725 3.279 3.852 . 0 0 "[ . 1 . ]" 1
1082 1 45 ASP H 1 47 PRO HD2 5.410 . 5.910 3.665 3.529 3.711 . 0 0 "[ . 1 . ]" 1
1083 1 45 ASP H 1 47 PRO HD3 5.460 . 5.960 4.283 4.230 4.324 . 0 0 "[ . 1 . ]" 1
1084 1 45 ASP HA 1 47 PRO HD3 4.980 . 5.480 4.483 4.451 4.550 . 0 0 "[ . 1 . ]" 1
1085 1 45 ASP HA 1 48 ASP H 4.380 . 4.880 3.618 3.456 3.741 . 0 0 "[ . 1 . ]" 1
1086 1 45 ASP HA 1 48 ASP HB3 5.500 . 6.000 3.536 3.336 3.740 . 0 0 "[ . 1 . ]" 1
1087 1 45 ASP HA 1 49 VAL H 5.500 . 6.000 4.689 4.388 4.756 . 0 0 "[ . 1 . ]" 1
1088 1 45 ASP HA 1 49 VAL MG2 6.610 . 7.110 4.255 4.066 4.318 . 0 0 "[ . 1 . ]" 1
1089 1 45 ASP HA 1 85 TYR QE 6.170 . 6.670 4.402 4.226 4.823 . 0 0 "[ . 1 . ]" 1
1090 1 45 ASP HB2 1 46 VAL H 4.780 . 5.280 3.571 3.487 4.328 . 0 0 "[ . 1 . ]" 1
1091 1 45 ASP HB2 1 46 VAL HA 5.500 . 6.000 4.527 4.396 5.648 . 0 0 "[ . 1 . ]" 1
1092 1 45 ASP HB2 1 49 VAL MG2 5.200 . 5.700 4.111 3.979 4.448 . 0 0 "[ . 1 . ]" 1
1093 1 45 ASP HB2 1 85 TYR QD 5.530 . 6.030 4.620 4.455 4.966 . 0 0 "[ . 1 . ]" 1
1094 1 45 ASP HB2 1 85 TYR QE 3.940 . 4.440 3.438 3.312 3.541 . 0 0 "[ . 1 . ]" 1
1095 1 45 ASP HB2 1 86 LEU MD2 6.850 . 7.350 4.470 4.247 4.914 . 0 0 "[ . 1 . ]" 1
1096 1 45 ASP HB3 1 46 VAL H 5.150 . 5.650 4.217 3.414 4.306 . 0 0 "[ . 1 . ]" 1
1097 1 45 ASP HB3 1 49 VAL MG2 6.260 . 6.760 3.189 3.056 3.976 . 0 0 "[ . 1 . ]" 1
1098 1 45 ASP HB3 1 85 TYR QE 4.560 . 5.060 2.466 2.249 4.254 . 0 0 "[ . 1 . ]" 1
1099 1 46 VAL H 1 46 VAL HB 3.290 . 3.790 2.449 2.390 2.673 . 0 0 "[ . 1 . ]" 1
1100 1 46 VAL H 1 46 VAL MG1 4.140 . 4.640 2.226 1.851 2.348 . 0 0 "[ . 1 . ]" 1
1101 1 46 VAL H 1 47 PRO HD2 3.820 . 4.320 2.519 2.484 2.547 . 0 0 "[ . 1 . ]" 1
1102 1 46 VAL H 1 47 PRO HD3 3.950 . 4.450 2.767 2.731 2.825 . 0 0 "[ . 1 . ]" 1
1103 1 46 VAL H 1 47 PRO HG2 5.500 . 6.000 4.818 4.791 4.838 . 0 0 "[ . 1 . ]" 1
1104 1 46 VAL H 1 48 ASP H 4.650 . 5.150 4.351 4.285 4.425 . 0 0 "[ . 1 . ]" 1
1105 1 46 VAL HA 1 48 ASP H 5.420 . 5.920 4.176 4.117 4.242 . 0 0 "[ . 1 . ]" 1
1106 1 46 VAL HA 1 49 VAL H 4.230 . 4.730 3.495 3.397 3.668 . 0 0 "[ . 1 . ]" 1
1107 1 46 VAL HA 1 49 VAL HB 3.830 . 4.330 2.880 2.613 3.153 . 0 0 "[ . 1 . ]" 1
1108 1 46 VAL HA 1 49 VAL MG2 5.750 . 6.250 3.571 3.454 4.019 . 0 0 "[ . 1 . ]" 1
1109 1 46 VAL HA 1 50 VAL H 5.360 . 5.860 4.278 4.081 4.377 . 0 0 "[ . 1 . ]" 1
1110 1 46 VAL HB 1 47 PRO HD2 4.490 . 4.990 4.498 4.449 4.605 . 0 0 "[ . 1 . ]" 1
1111 1 46 VAL HB 1 47 PRO HD3 4.070 . 4.570 4.044 3.990 4.217 . 0 0 "[ . 1 . ]" 1
1112 1 46 VAL MG2 1 47 PRO HA 5.250 . 5.750 3.787 3.312 3.909 . 0 0 "[ . 1 . ]" 1
1113 1 46 VAL MG2 1 47 PRO HD2 5.580 . 6.080 4.643 4.369 4.699 . 0 0 "[ . 1 . ]" 1
1114 1 46 VAL MG2 1 47 PRO HD3 5.910 . 6.410 4.063 3.636 4.173 . 0 0 "[ . 1 . ]" 1
1115 1 46 VAL MG2 1 48 ASP H 6.610 . 7.110 5.058 4.833 5.128 . 0 0 "[ . 1 . ]" 1
1116 1 46 VAL MG2 1 50 VAL MG2 4.400 . 4.900 2.639 2.259 2.834 . 0 0 "[ . 1 . ]" 1
1117 1 47 PRO HA 1 48 ASP HA 5.320 . 5.820 4.725 4.699 4.745 . 0 0 "[ . 1 . ]" 1
1118 1 47 PRO HA 1 49 VAL H 4.590 . 5.090 4.311 4.246 4.525 . 0 0 "[ . 1 . ]" 1
1119 1 47 PRO HA 1 50 VAL H 4.180 . 4.680 3.474 3.410 3.650 . 0 0 "[ . 1 . ]" 1
1120 1 47 PRO HA 1 50 VAL HB 3.790 . 4.290 2.797 2.724 2.916 . 0 0 "[ . 1 . ]" 1
1121 1 47 PRO HA 1 50 VAL MG1 5.560 . 6.060 4.104 4.028 4.211 . 0 0 "[ . 1 . ]" 1
1122 1 47 PRO HA 1 50 VAL MG2 4.980 . 5.480 3.256 3.151 3.489 . 0 0 "[ . 1 . ]" 1
1123 1 47 PRO HB2 1 48 ASP H 3.880 . 4.380 3.698 3.663 3.736 . 0 0 "[ . 1 . ]" 1
1124 1 47 PRO HB2 1 48 ASP HA 5.500 . 6.000 4.283 4.235 4.320 . 0 0 "[ . 1 . ]" 1
1125 1 47 PRO HB3 1 48 ASP H 4.220 . 4.720 4.265 4.247 4.287 . 0 0 "[ . 1 . ]" 1
1126 1 47 PRO HB3 1 48 ASP HA 5.600 . 6.100 5.672 5.647 5.697 . 0 0 "[ . 1 . ]" 1
1127 1 47 PRO HD2 1 48 ASP H 4.650 . 5.150 2.450 2.402 2.541 . 0 0 "[ . 1 . ]" 1
1128 1 47 PRO HD3 1 48 ASP H 4.150 . 4.650 3.734 3.692 3.782 . 0 0 "[ . 1 . ]" 1
1129 1 47 PRO HD3 1 49 VAL H 5.500 . 6.000 5.324 5.262 5.458 . 0 0 "[ . 1 . ]" 1
1130 1 47 PRO HG2 1 48 ASP H 5.390 . 5.890 2.452 2.398 2.492 . 0 0 "[ . 1 . ]" 1
1131 1 47 PRO HG3 1 48 ASP H 4.580 . 5.080 3.950 3.915 3.984 . 0 0 "[ . 1 . ]" 1
1132 1 47 PRO HG3 1 48 ASP HA 5.700 . 6.200 5.762 5.737 5.839 . 0 0 "[ . 1 . ]" 1
1133 1 48 ASP H 1 48 ASP HB2 3.670 . 4.170 2.568 2.542 2.598 . 0 0 "[ . 1 . ]" 1
1134 1 48 ASP H 1 48 ASP HB3 3.080 . 3.580 2.481 2.459 2.520 . 0 0 "[ . 1 . ]" 1
1135 1 48 ASP H 1 49 VAL H 3.370 . 3.870 2.377 2.349 2.402 . 0 0 "[ . 1 . ]" 1
1136 1 48 ASP H 1 49 VAL MG2 6.610 . 7.110 3.935 3.902 4.009 . 0 0 "[ . 1 . ]" 1
1137 1 48 ASP H 1 50 VAL H 4.620 . 5.120 3.865 3.800 3.935 . 0 0 "[ . 1 . ]" 1
1138 1 48 ASP HA 1 49 VAL MG2 6.610 . 7.110 4.899 4.869 4.933 . 0 0 "[ . 1 . ]" 1
1139 1 48 ASP HA 1 50 VAL H 5.210 . 5.710 4.219 4.141 4.341 . 0 0 "[ . 1 . ]" 1
1140 1 48 ASP HA 1 51 GLN HG2 5.000 . 5.500 5.080 5.024 5.126 . 0 0 "[ . 1 . ]" 1
1141 1 48 ASP HA 1 51 GLN QB 3.790 . 4.290 2.694 2.621 3.061 . 0 0 "[ . 1 . ]" 1
1142 1 48 ASP HA 1 52 GLU H 4.940 . 5.440 4.093 4.041 4.299 . 0 0 "[ . 1 . ]" 1
1143 1 48 ASP HB2 1 49 VAL H 4.330 . 4.830 4.004 3.980 4.034 . 0 0 "[ . 1 . ]" 1
1144 1 48 ASP HB2 1 49 VAL HA 5.700 . 6.200 5.716 5.693 5.726 . 0 0 "[ . 1 . ]" 1
1145 1 48 ASP HB2 1 49 VAL MG2 6.240 . 6.740 4.684 4.651 4.711 . 0 0 "[ . 1 . ]" 1
1146 1 48 ASP HB2 1 85 TYR QE 6.170 . 6.670 5.197 4.934 5.574 . 0 0 "[ . 1 . ]" 1
1147 1 48 ASP HB3 1 49 VAL H 3.740 . 4.240 2.869 2.799 2.953 . 0 0 "[ . 1 . ]" 1
1148 1 48 ASP HB3 1 49 VAL HA 5.340 . 5.840 4.369 4.350 4.397 . 0 0 "[ . 1 . ]" 1
1149 1 48 ASP HB3 1 49 VAL MG1 6.550 . 7.050 5.515 5.479 5.528 . 0 0 "[ . 1 . ]" 1
1150 1 48 ASP HB3 1 49 VAL MG2 6.360 . 6.860 3.141 3.096 3.171 . 0 0 "[ . 1 . ]" 1
1151 1 48 ASP HB3 1 50 VAL H 5.500 . 6.000 5.058 4.977 5.166 . 0 0 "[ . 1 . ]" 1
1152 1 48 ASP HB3 1 85 TYR QE 6.170 . 6.670 4.026 3.740 4.463 . 0 0 "[ . 1 . ]" 1
1153 1 49 VAL H 1 49 VAL HB 3.590 . 4.090 2.340 2.305 2.367 . 0 0 "[ . 1 . ]" 1
1154 1 49 VAL H 1 50 VAL H 3.210 . 3.710 2.468 2.438 2.494 . 0 0 "[ . 1 . ]" 1
1155 1 49 VAL H 1 50 VAL HB 5.280 . 5.780 4.544 4.503 4.577 . 0 0 "[ . 1 . ]" 1
1156 1 49 VAL H 1 50 VAL MG2 5.390 . 5.890 4.146 4.099 4.190 . 0 0 "[ . 1 . ]" 1
1157 1 49 VAL HA 1 51 GLN QB 5.520 . 6.020 4.887 4.768 4.958 . 0 0 "[ . 1 . ]" 1
1158 1 49 VAL HA 1 52 GLU H 4.040 . 4.540 3.130 3.039 3.205 . 0 0 "[ . 1 . ]" 1
1159 1 49 VAL HA 1 52 GLU HB2 4.170 . 4.670 3.530 3.472 3.631 . 0 0 "[ . 1 . ]" 1
1160 1 49 VAL HA 1 52 GLU HB3 4.050 . 4.550 2.610 2.567 2.648 . 0 0 "[ . 1 . ]" 1
1161 1 49 VAL HA 1 52 GLU HG3 5.500 . 6.000 5.547 5.523 5.589 . 0 0 "[ . 1 . ]" 1
1162 1 49 VAL HA 1 53 ALA H 4.700 . 5.200 3.888 3.790 3.965 . 0 0 "[ . 1 . ]" 1
1163 1 49 VAL HA 1 53 ALA MB 5.900 . 6.400 4.456 4.405 4.540 . 0 0 "[ . 1 . ]" 1
1164 1 49 VAL HA 1 81 THR MG 5.660 . 6.160 3.101 2.945 3.236 . 0 0 "[ . 1 . ]" 1
1165 1 49 VAL HA 1 85 TYR QD 5.580 . 6.080 4.536 4.299 4.918 . 0 0 "[ . 1 . ]" 1
1166 1 49 VAL HB 1 50 VAL H 3.780 . 4.280 3.014 2.950 3.105 . 0 0 "[ . 1 . ]" 1
1167 1 49 VAL HB 1 50 VAL HB 5.500 . 6.000 5.171 5.079 5.237 . 0 0 "[ . 1 . ]" 1
1168 1 49 VAL HB 1 85 TYR QD 6.090 . 6.590 5.465 5.398 5.606 . 0 0 "[ . 1 . ]" 1
1169 1 49 VAL MG1 1 50 VAL H 5.270 . 5.770 3.645 3.554 3.690 . 0 0 "[ . 1 . ]" 1
1170 1 49 VAL MG1 1 52 GLU H 6.610 . 7.110 4.648 4.570 4.721 . 0 0 "[ . 1 . ]" 1
1171 1 49 VAL MG1 1 52 GLU HB2 6.610 . 7.110 5.018 4.884 5.161 . 0 0 "[ . 1 . ]" 1
1172 1 49 VAL MG1 1 52 GLU HB3 6.610 . 7.110 3.704 3.581 3.822 . 0 0 "[ . 1 . ]" 1
1173 1 49 VAL MG1 1 53 ALA H 6.220 . 6.720 4.062 3.959 4.173 . 0 0 "[ . 1 . ]" 1
1174 1 49 VAL MG1 1 53 ALA HA 6.280 . 6.780 4.956 4.854 5.078 . 0 0 "[ . 1 . ]" 1
1175 1 49 VAL MG1 1 53 ALA MB 5.610 . 6.110 3.202 3.133 3.290 . 0 0 "[ . 1 . ]" 1
1176 1 49 VAL MG1 1 81 THR HA 6.610 . 7.110 4.384 4.245 4.476 . 0 0 "[ . 1 . ]" 1
1177 1 49 VAL MG1 1 81 THR HB 5.720 . 6.220 2.731 2.603 2.794 . 0 0 "[ . 1 . ]" 1
1178 1 49 VAL MG1 1 81 THR MG 5.190 . 5.690 2.091 2.051 2.140 . 0 0 "[ . 1 . ]" 1
1179 1 49 VAL MG1 1 82 ALA H 5.420 . 5.920 3.176 3.100 3.242 . 0 0 "[ . 1 . ]" 1
1180 1 49 VAL MG1 1 82 ALA HA 4.230 . 4.730 2.330 2.257 2.443 . 0 0 "[ . 1 . ]" 1
1181 1 49 VAL MG1 1 82 ALA MB 5.380 . 5.880 2.115 2.063 2.158 . 0 0 "[ . 1 . ]" 1
1182 1 49 VAL MG1 1 85 TYR H 6.610 . 7.110 4.661 4.482 4.792 . 0 0 "[ . 1 . ]" 1
1183 1 49 VAL MG1 1 85 TYR HB2 6.610 . 7.110 3.523 3.402 3.698 . 0 0 "[ . 1 . ]" 1
1184 1 49 VAL MG1 1 85 TYR HB3 6.290 . 6.790 3.882 3.742 3.967 . 0 0 "[ . 1 . ]" 1
1185 1 49 VAL MG1 1 85 TYR QD 6.850 . 7.350 4.279 4.157 4.391 . 0 0 "[ . 1 . ]" 1
1186 1 49 VAL MG1 1 85 TYR QE 7.410 . 7.910 5.340 5.236 5.511 . 0 0 "[ . 1 . ]" 1
1187 1 49 VAL MG2 1 50 VAL H 6.100 . 6.600 4.094 4.067 4.118 . 0 0 "[ . 1 . ]" 1
1188 1 49 VAL MG2 1 50 VAL MG2 7.930 . 8.430 4.875 4.810 4.946 . 0 0 "[ . 1 . ]" 1
1189 1 49 VAL MG2 1 52 GLU HB3 6.610 . 7.110 4.081 4.021 4.156 . 0 0 "[ . 1 . ]" 1
1190 1 49 VAL MG2 1 81 THR MG 7.930 . 8.430 3.146 3.025 3.223 . 0 0 "[ . 1 . ]" 1
1191 1 49 VAL MG2 1 82 ALA HA 5.680 . 6.180 2.879 2.765 2.986 . 0 0 "[ . 1 . ]" 1
1192 1 49 VAL MG2 1 85 TYR HB3 6.280 . 6.780 3.012 2.886 3.132 . 0 0 "[ . 1 . ]" 1
1193 1 49 VAL MG2 1 85 TYR QD 4.700 . 5.200 2.821 2.691 2.933 . 0 0 "[ . 1 . ]" 1
1194 1 49 VAL MG2 1 85 TYR QE 5.110 . 5.610 3.375 3.263 3.565 . 0 0 "[ . 1 . ]" 1
1195 1 50 VAL H 1 50 VAL HB 3.230 . 3.730 2.327 2.295 2.360 . 0 0 "[ . 1 . ]" 1
1196 1 50 VAL H 1 50 VAL MG2 4.140 . 4.640 2.380 2.335 2.420 . 0 0 "[ . 1 . ]" 1
1197 1 50 VAL H 1 51 GLN H 3.680 . 4.180 2.536 2.507 2.568 . 0 0 "[ . 1 . ]" 1
1198 1 50 VAL H 1 51 GLN QB 5.310 . 5.810 4.321 4.291 4.372 . 0 0 "[ . 1 . ]" 1
1199 1 50 VAL H 1 52 GLU H 5.000 . 5.500 4.108 4.060 4.151 . 0 0 "[ . 1 . ]" 1
1200 1 50 VAL HA 1 53 ALA H 4.230 . 4.730 3.377 3.311 3.457 . 0 0 "[ . 1 . ]" 1
1201 1 50 VAL HA 1 53 ALA MB 3.900 . 4.400 2.465 2.408 2.532 . 0 0 "[ . 1 . ]" 1
1202 1 50 VAL HA 1 54 PHE H 4.970 . 5.470 4.335 4.174 4.474 . 0 0 "[ . 1 . ]" 1
1203 1 50 VAL HB 1 51 GLN H 3.930 . 4.430 2.820 2.765 2.891 . 0 0 "[ . 1 . ]" 1
1204 1 50 VAL MG1 1 51 GLN H 5.220 . 5.720 3.436 3.390 3.491 . 0 0 "[ . 1 . ]" 1
1205 1 50 VAL MG1 1 51 GLN HA 5.340 . 5.840 3.401 3.344 3.450 . 0 0 "[ . 1 . ]" 1
1206 1 50 VAL MG1 1 51 GLN QB 6.790 . 7.290 4.057 3.996 4.115 . 0 0 "[ . 1 . ]" 1
1207 1 50 VAL MG1 1 54 PHE HB3 6.610 . 7.110 5.325 5.222 5.417 . 0 0 "[ . 1 . ]" 1
1208 1 50 VAL MG1 1 54 PHE HZ 4.920 . 5.420 2.960 2.711 3.178 . 0 0 "[ . 1 . ]" 1
1209 1 50 VAL MG1 1 54 PHE QD 3.870 . 4.370 2.934 2.903 2.964 . 0 0 "[ . 1 . ]" 1
1210 1 50 VAL MG1 1 54 PHE QE 3.860 . 4.360 2.250 2.171 2.331 . 0 0 "[ . 1 . ]" 1
1211 1 50 VAL MG2 1 51 GLN H 5.510 . 6.010 4.048 4.015 4.080 . 0 0 "[ . 1 . ]" 1
1212 1 50 VAL MG2 1 53 ALA H 6.570 . 7.070 5.068 5.015 5.123 . 0 0 "[ . 1 . ]" 1
1213 1 50 VAL MG2 1 53 ALA MB 5.700 . 6.200 3.869 3.792 3.944 . 0 0 "[ . 1 . ]" 1
1214 1 50 VAL MG2 1 54 PHE QE 7.400 . 7.900 4.449 4.387 4.527 . 0 0 "[ . 1 . ]" 1
1215 1 50 VAL MG2 1 82 ALA MB 7.850 . 8.350 5.447 5.324 5.500 . 0 0 "[ . 1 . ]" 1
1216 1 51 GLN H 1 51 GLN QB 3.420 . 3.920 2.244 2.233 2.254 . 0 0 "[ . 1 . ]" 1
1217 1 51 GLN H 1 52 GLU H 3.620 . 4.120 2.626 2.596 2.667 . 0 0 "[ . 1 . ]" 1
1218 1 51 GLN H 1 53 ALA H 4.790 . 5.290 3.858 3.820 3.899 . 0 0 "[ . 1 . ]" 1
1219 1 51 GLN HA 1 51 GLN HG2 3.960 . 4.460 3.156 3.079 3.710 . 0 0 "[ . 1 . ]" 1
1220 1 51 GLN HA 1 51 GLN HG3 3.740 . 4.240 2.475 2.436 2.833 . 0 0 "[ . 1 . ]" 1
1221 1 51 GLN HA 1 53 ALA H 4.920 . 5.420 4.148 4.100 4.225 . 0 0 "[ . 1 . ]" 1
1222 1 51 GLN HA 1 54 PHE H 4.020 . 4.520 3.291 3.225 3.329 . 0 0 "[ . 1 . ]" 1
1223 1 51 GLN HA 1 54 PHE HB2 5.090 . 5.590 2.897 2.819 2.960 . 0 0 "[ . 1 . ]" 1
1224 1 51 GLN HA 1 54 PHE HB3 4.550 . 5.050 4.584 4.507 4.658 . 0 0 "[ . 1 . ]" 1
1225 1 51 GLN HA 1 54 PHE QD 4.270 . 4.770 2.838 2.717 2.971 . 0 0 "[ . 1 . ]" 1
1226 1 51 GLN HA 1 55 ILE H 4.850 . 5.350 4.189 4.132 4.239 . 0 0 "[ . 1 . ]" 1
1227 1 51 GLN HA 1 55 ILE HG12 5.660 . 6.160 5.697 5.672 5.724 . 0 0 "[ . 1 . ]" 1
1228 1 51 GLN HA 1 55 ILE MD 5.960 . 6.460 4.454 4.401 4.516 . 0 0 "[ . 1 . ]" 1
1229 1 51 GLN HE22 1 55 ILE HG12 5.470 . 5.970 6.019 5.002 6.160 0.190 18 0 "[ . 1 . ]" 1
1230 1 51 GLN HE22 1 55 ILE MD 6.040 . 6.540 3.847 3.740 4.408 . 0 0 "[ . 1 . ]" 1
1231 1 51 GLN HE21 1 55 ILE MD 6.560 . 7.060 2.516 2.364 2.914 . 0 0 "[ . 1 . ]" 1
1232 1 51 GLN HG2 1 55 ILE HG12 5.140 . 5.640 4.244 4.134 5.216 . 0 0 "[ . 1 . ]" 1
1233 1 51 GLN HG2 1 55 ILE MD 5.300 . 5.800 2.286 2.204 3.121 . 0 0 "[ . 1 . ]" 1
1234 1 51 GLN HG3 1 54 PHE HB3 5.500 . 6.000 5.534 5.485 5.643 . 0 0 "[ . 1 . ]" 1
1235 1 51 GLN HG3 1 55 ILE HG13 5.500 . 6.000 3.454 2.642 3.585 . 0 0 "[ . 1 . ]" 1
1236 1 51 GLN HG3 1 55 ILE MD 4.840 . 5.340 3.190 2.323 3.288 . 0 0 "[ . 1 . ]" 1
1237 1 51 GLN QB 1 52 GLU H 4.180 . 4.680 2.609 2.589 2.631 . 0 0 "[ . 1 . ]" 1
1238 1 51 GLN QB 1 55 ILE HG12 6.510 . 7.010 5.945 5.807 5.969 . 0 0 "[ . 1 . ]" 1
1239 1 51 GLN QB 1 55 ILE MD 6.830 . 7.330 3.864 3.728 3.925 . 0 0 "[ . 1 . ]" 1
1240 1 51 GLN QG 1 52 GLU H 5.390 . 5.890 3.643 3.592 3.832 . 0 0 "[ . 1 . ]" 1
1241 1 52 GLU H 1 52 GLU HB3 3.420 . 3.920 2.536 2.497 2.565 . 0 0 "[ . 1 . ]" 1
1242 1 52 GLU H 1 52 GLU HG2 4.520 . 5.020 4.468 4.442 4.497 . 0 0 "[ . 1 . ]" 1
1243 1 52 GLU H 1 52 GLU HG3 4.650 . 5.150 4.430 4.409 4.448 . 0 0 "[ . 1 . ]" 1
1244 1 52 GLU H 1 53 ALA H 3.510 . 4.010 2.605 2.586 2.618 . 0 0 "[ . 1 . ]" 1
1245 1 52 GLU H 1 53 ALA HA 5.220 . 5.720 5.225 5.214 5.234 . 0 0 "[ . 1 . ]" 1
1246 1 52 GLU H 1 53 ALA MB 5.330 . 5.830 4.283 4.269 4.293 . 0 0 "[ . 1 . ]" 1
1247 1 52 GLU H 1 55 ILE MD 6.610 . 7.110 4.275 4.219 4.314 . 0 0 "[ . 1 . ]" 1
1248 1 52 GLU HA 1 52 GLU HG2 4.040 . 4.540 3.102 3.018 3.197 . 0 0 "[ . 1 . ]" 1
1249 1 52 GLU HA 1 52 GLU HG3 4.060 . 4.560 2.416 2.354 2.483 . 0 0 "[ . 1 . ]" 1
1250 1 52 GLU HA 1 53 ALA MB 6.500 . 7.000 5.014 5.004 5.022 . 0 0 "[ . 1 . ]" 1
1251 1 52 GLU HA 1 55 ILE H 4.000 . 4.500 3.175 3.132 3.217 . 0 0 "[ . 1 . ]" 1
1252 1 52 GLU HA 1 55 ILE HB 3.250 . 3.750 2.497 2.431 2.562 . 0 0 "[ . 1 . ]" 1
1253 1 52 GLU HA 1 55 ILE HG12 4.710 . 5.210 4.776 4.750 4.806 . 0 0 "[ . 1 . ]" 1
1254 1 52 GLU HA 1 55 ILE HG13 5.100 . 5.600 3.532 3.488 3.570 . 0 0 "[ . 1 . ]" 1
1255 1 52 GLU HA 1 55 ILE MD 4.430 . 4.930 2.512 2.459 2.582 . 0 0 "[ . 1 . ]" 1
1256 1 52 GLU HA 1 55 ILE MG 4.860 . 5.360 3.955 3.890 4.007 . 0 0 "[ . 1 . ]" 1
1257 1 52 GLU HA 1 56 LYS H 4.470 . 4.970 3.791 3.747 3.865 . 0 0 "[ . 1 . ]" 1
1258 1 52 GLU HB2 1 53 ALA H 4.300 . 4.800 4.083 4.055 4.111 . 0 0 "[ . 1 . ]" 1
1259 1 52 GLU HB3 1 53 ALA H 4.000 . 4.500 2.959 2.900 3.022 . 0 0 "[ . 1 . ]" 1
1260 1 52 GLU HB3 1 53 ALA HA 5.280 . 5.780 4.387 4.341 4.449 . 0 0 "[ . 1 . ]" 1
1261 1 52 GLU HB3 1 53 ALA MB 6.610 . 7.110 4.144 4.092 4.184 . 0 0 "[ . 1 . ]" 1
1262 1 52 GLU HB3 1 56 LYS QD 6.620 . 7.120 5.959 5.871 6.023 . 0 0 "[ . 1 . ]" 1
1263 1 52 GLU HB3 1 81 THR MG 5.000 . 5.500 2.283 2.178 2.434 . 0 0 "[ . 1 . ]" 1
1264 1 52 GLU HG2 1 53 ALA H 5.140 . 5.640 4.130 4.044 4.236 . 0 0 "[ . 1 . ]" 1
1265 1 52 GLU HG2 1 53 ALA HA 5.290 . 5.790 3.959 3.857 4.081 . 0 0 "[ . 1 . ]" 1
1266 1 52 GLU HG2 1 55 ILE MD 6.610 . 7.110 5.033 4.957 5.120 . 0 0 "[ . 1 . ]" 1
1267 1 52 GLU HG2 1 55 ILE MG 6.610 . 7.110 5.204 5.092 5.394 . 0 0 "[ . 1 . ]" 1
1268 1 52 GLU HG2 1 56 LYS H 5.500 . 6.000 4.226 4.087 4.423 . 0 0 "[ . 1 . ]" 1
1269 1 52 GLU HG2 1 56 LYS HB2 4.990 . 5.490 3.236 3.066 3.480 . 0 0 "[ . 1 . ]" 1
1270 1 52 GLU HG2 1 56 LYS QD 5.100 . 5.600 4.261 3.802 4.500 . 0 0 "[ . 1 . ]" 1
1271 1 52 GLU HG2 1 56 LYS QE 6.170 . 6.670 2.699 2.281 4.145 . 0 0 "[ . 1 . ]" 1
1272 1 52 GLU HG2 1 56 LYS QG 6.170 . 6.670 4.968 4.802 5.215 . 0 0 "[ . 1 . ]" 1
1273 1 52 GLU HG2 1 81 THR MG 6.610 . 7.110 2.377 2.242 2.563 . 0 0 "[ . 1 . ]" 1
1274 1 52 GLU HG3 1 53 ALA H 5.270 . 5.770 4.923 4.863 4.957 . 0 0 "[ . 1 . ]" 1
1275 1 52 GLU HG3 1 53 ALA HA 5.470 . 5.970 5.300 5.157 5.388 . 0 0 "[ . 1 . ]" 1
1276 1 52 GLU HG3 1 55 ILE H 5.500 . 6.000 5.092 5.001 5.180 . 0 0 "[ . 1 . ]" 1
1277 1 52 GLU HG3 1 55 ILE HB 5.260 . 5.760 3.666 3.551 3.782 . 0 0 "[ . 1 . ]" 1
1278 1 52 GLU HG3 1 55 ILE MD 6.610 . 7.110 3.870 3.776 3.946 . 0 0 "[ . 1 . ]" 1
1279 1 52 GLU HG3 1 55 ILE MG 6.510 . 7.010 4.296 4.200 4.402 . 0 0 "[ . 1 . ]" 1
1280 1 52 GLU HG3 1 56 LYS QE 6.170 . 6.670 3.895 3.473 5.453 . 0 0 "[ . 1 . ]" 1
1281 1 52 GLU HG3 1 56 LYS QG 6.330 . 6.830 5.691 5.642 5.725 . 0 0 "[ . 1 . ]" 1
1282 1 52 GLU HG3 1 81 THR MG 5.190 . 5.690 3.727 3.621 3.836 . 0 0 "[ . 1 . ]" 1
1283 1 53 ALA H 1 54 PHE H 3.540 . 4.040 2.599 2.566 2.635 . 0 0 "[ . 1 . ]" 1
1284 1 53 ALA H 1 54 PHE QD 6.170 . 6.670 5.157 5.125 5.198 . 0 0 "[ . 1 . ]" 1
1285 1 53 ALA H 1 56 LYS H 5.060 . 5.560 4.643 4.609 4.669 . 0 0 "[ . 1 . ]" 1
1286 1 53 ALA H 1 77 ILE MG 6.610 . 7.110 4.849 4.762 5.013 . 0 0 "[ . 1 . ]" 1
1287 1 53 ALA H 1 81 THR MG 4.680 . 5.180 3.322 2.877 3.690 . 0 0 "[ . 1 . ]" 1
1288 1 53 ALA HA 1 55 ILE H 5.170 . 5.670 4.433 4.409 4.484 . 0 0 "[ . 1 . ]" 1
1289 1 53 ALA HA 1 56 LYS H 4.180 . 4.680 3.512 3.474 3.533 . 0 0 "[ . 1 . ]" 1
1290 1 53 ALA HA 1 56 LYS HB2 3.990 . 4.490 3.807 3.705 3.945 . 0 0 "[ . 1 . ]" 1
1291 1 53 ALA HA 1 56 LYS QE 4.960 . 5.460 3.725 2.819 4.023 . 0 0 "[ . 1 . ]" 1
1292 1 53 ALA HA 1 77 ILE MG 4.670 . 5.170 2.416 2.314 2.630 . 0 0 "[ . 1 . ]" 1
1293 1 53 ALA HA 1 78 ALA HA 4.320 . 4.820 3.917 3.848 4.071 . 0 0 "[ . 1 . ]" 1
1294 1 53 ALA HA 1 81 THR HB 4.140 . 4.640 3.888 3.744 4.089 . 0 0 "[ . 1 . ]" 1
1295 1 53 ALA HA 1 81 THR MG 4.340 . 4.840 3.194 2.802 3.522 . 0 0 "[ . 1 . ]" 1
1296 1 53 ALA MB 1 54 PHE H 4.420 . 4.920 2.764 2.657 2.880 . 0 0 "[ . 1 . ]" 1
1297 1 53 ALA MB 1 54 PHE HA 5.810 . 6.310 3.993 3.972 4.017 . 0 0 "[ . 1 . ]" 1
1298 1 53 ALA MB 1 54 PHE HB2 6.610 . 7.110 4.598 4.552 4.641 . 0 0 "[ . 1 . ]" 1
1299 1 53 ALA MB 1 54 PHE QD 7.180 . 7.680 3.811 3.705 3.913 . 0 0 "[ . 1 . ]" 1
1300 1 53 ALA MB 1 55 ILE H 6.200 . 6.700 4.605 4.579 4.656 . 0 0 "[ . 1 . ]" 1
1301 1 53 ALA MB 1 56 LYS H 6.610 . 7.110 4.683 4.657 4.702 . 0 0 "[ . 1 . ]" 1
1302 1 53 ALA MB 1 56 LYS QG 7.410 . 7.910 5.473 5.399 5.548 . 0 0 "[ . 1 . ]" 1
1303 1 53 ALA MB 1 57 ALA MB 7.930 . 8.430 3.854 3.734 3.928 . 0 0 "[ . 1 . ]" 1
1304 1 53 ALA MB 1 77 ILE HB 6.410 . 6.910 3.158 3.031 3.341 . 0 0 "[ . 1 . ]" 1
1305 1 53 ALA MB 1 77 ILE MG 6.060 . 6.560 2.663 2.545 2.825 . 0 0 "[ . 1 . ]" 1
1306 1 53 ALA MB 1 78 ALA HA 3.750 . 4.250 2.066 2.035 2.116 . 0 0 "[ . 1 . ]" 1
1307 1 53 ALA MB 1 81 THR HB 4.910 . 5.410 2.906 2.562 3.128 . 0 0 "[ . 1 . ]" 1
1308 1 54 PHE H 1 54 PHE HB2 3.640 . 4.140 2.381 2.358 2.413 . 0 0 "[ . 1 . ]" 1
1309 1 54 PHE H 1 54 PHE HB3 3.580 . 4.080 3.590 3.574 3.606 . 0 0 "[ . 1 . ]" 1
1310 1 54 PHE H 1 54 PHE QD 3.850 . 4.350 3.387 3.283 3.467 . 0 0 "[ . 1 . ]" 1
1311 1 54 PHE H 1 55 ILE H 3.460 . 3.960 2.491 2.385 2.637 . 0 0 "[ . 1 . ]" 1
1312 1 54 PHE H 1 55 ILE HB 4.850 . 5.350 4.645 4.536 4.788 . 0 0 "[ . 1 . ]" 1
1313 1 54 PHE H 1 55 ILE MD 6.610 . 7.110 5.035 4.937 5.164 . 0 0 "[ . 1 . ]" 1
1314 1 54 PHE H 1 56 LYS H 4.520 . 5.020 3.933 3.820 4.126 . 0 0 "[ . 1 . ]" 1
1315 1 54 PHE H 1 57 ALA MB 6.610 . 7.110 4.438 4.366 4.495 . 0 0 "[ . 1 . ]" 1
1316 1 54 PHE H 1 77 ILE MG 6.610 . 7.110 4.897 4.847 4.979 . 0 0 "[ . 1 . ]" 1
1317 1 54 PHE HA 1 54 PHE QD 3.270 . 3.770 1.968 1.951 1.985 . 0 0 "[ . 1 . ]" 1
1318 1 54 PHE HA 1 54 PHE QE 4.880 . 5.380 4.310 4.282 4.336 . 0 0 "[ . 1 . ]" 1
1319 1 54 PHE HA 1 56 LYS H 5.200 . 5.700 4.281 4.214 4.417 . 0 0 "[ . 1 . ]" 1
1320 1 54 PHE HA 1 57 ALA H 3.990 . 4.490 3.101 3.035 3.202 . 0 0 "[ . 1 . ]" 1
1321 1 54 PHE HA 1 57 ALA HA 5.490 . 5.990 5.025 4.966 5.081 . 0 0 "[ . 1 . ]" 1
1322 1 54 PHE HA 1 57 ALA MB 4.250 . 4.750 2.233 2.190 2.268 . 0 0 "[ . 1 . ]" 1
1323 1 54 PHE HA 1 58 TYR H 5.140 . 5.640 3.829 3.773 3.890 . 0 0 "[ . 1 . ]" 1
1324 1 54 PHE HA 1 74 LEU MD1 5.510 . 6.010 3.534 3.378 3.713 . 0 0 "[ . 1 . ]" 1
1325 1 54 PHE HB2 1 55 ILE H 4.410 . 4.910 2.912 2.818 2.992 . 0 0 "[ . 1 . ]" 1
1326 1 54 PHE HB2 1 57 ALA MB 6.610 . 7.110 4.867 4.829 4.904 . 0 0 "[ . 1 . ]" 1
1327 1 54 PHE HB3 1 55 ILE H 4.180 . 4.680 3.819 3.772 3.865 . 0 0 "[ . 1 . ]" 1
1328 1 54 PHE QD 1 55 ILE H 5.960 . 6.460 4.642 4.596 4.682 . 0 0 "[ . 1 . ]" 1
1329 1 54 PHE QD 1 57 ALA H 5.920 . 6.420 4.716 4.652 4.842 . 0 0 "[ . 1 . ]" 1
1330 1 54 PHE QD 1 57 ALA MB 4.840 . 5.340 3.038 2.939 3.161 . 0 0 "[ . 1 . ]" 1
1331 1 54 PHE QD 1 74 LEU MD1 6.050 . 6.550 2.515 2.433 2.616 . 0 0 "[ . 1 . ]" 1
1332 1 54 PHE QE 1 74 LEU MD1 6.110 . 6.610 2.765 2.480 3.017 . 0 0 "[ . 1 . ]" 1
1333 1 54 PHE QE 1 74 LEU MD2 4.430 . 4.930 2.129 2.054 2.237 . 0 0 "[ . 1 . ]" 1
1334 1 55 ILE H 1 55 ILE HB 3.230 . 3.730 2.395 2.378 2.416 . 0 0 "[ . 1 . ]" 1
1335 1 55 ILE H 1 55 ILE HG12 3.660 . 4.160 3.575 3.542 3.606 . 0 0 "[ . 1 . ]" 1
1336 1 55 ILE H 1 55 ILE HG13 4.100 . 4.600 2.261 2.225 2.294 . 0 0 "[ . 1 . ]" 1
1337 1 55 ILE H 1 55 ILE MD 5.270 . 5.770 3.511 3.476 3.538 . 0 0 "[ . 1 . ]" 1
1338 1 55 ILE H 1 56 LYS H 3.460 . 3.960 2.495 2.457 2.562 . 0 0 "[ . 1 . ]" 1
1339 1 55 ILE H 1 57 ALA H 4.700 . 5.200 3.845 3.820 3.889 . 0 0 "[ . 1 . ]" 1
1340 1 55 ILE H 1 57 ALA MB 5.860 . 6.360 4.668 4.634 4.715 . 0 0 "[ . 1 . ]" 1
1341 1 55 ILE HA 1 55 ILE HG12 3.800 . 4.300 2.551 2.531 2.567 . 0 0 "[ . 1 . ]" 1
1342 1 55 ILE HA 1 55 ILE HG13 3.730 . 4.230 2.926 2.895 2.955 . 0 0 "[ . 1 . ]" 1
1343 1 55 ILE HA 1 57 ALA MB 6.270 . 6.770 5.015 4.959 5.067 . 0 0 "[ . 1 . ]" 1
1344 1 55 ILE HA 1 58 TYR H 3.950 . 4.450 3.698 3.641 3.737 . 0 0 "[ . 1 . ]" 1
1345 1 55 ILE HA 1 58 TYR HB2 3.900 . 4.400 3.907 3.867 3.938 . 0 0 "[ . 1 . ]" 1
1346 1 55 ILE HA 1 58 TYR HB3 4.080 . 4.580 3.437 3.380 3.478 . 0 0 "[ . 1 . ]" 1
1347 1 55 ILE HA 1 58 TYR QD 6.170 . 6.670 4.868 4.760 4.989 . 0 0 "[ . 1 . ]" 1
1348 1 55 ILE HB 1 56 LYS H 3.650 . 4.150 2.700 2.655 2.734 . 0 0 "[ . 1 . ]" 1
1349 1 55 ILE HB 1 56 LYS HB3 5.470 . 5.970 4.855 4.819 4.926 . 0 0 "[ . 1 . ]" 1
1350 1 55 ILE HB 1 57 ALA H 4.960 . 5.460 4.964 4.906 4.994 . 0 0 "[ . 1 . ]" 1
1351 1 55 ILE HB 1 59 ARG HD2 5.500 . 6.000 5.230 5.063 5.538 . 0 0 "[ . 1 . ]" 1
1352 1 55 ILE HG12 1 56 LYS H 5.380 . 5.880 5.076 5.058 5.089 . 0 0 "[ . 1 . ]" 1
1353 1 55 ILE HG13 1 56 LYS H 5.410 . 5.910 4.320 4.288 4.357 . 0 0 "[ . 1 . ]" 1
1354 1 55 ILE MD 1 56 LYS H 5.970 . 6.470 4.595 4.559 4.629 . 0 0 "[ . 1 . ]" 1
1355 1 55 ILE MG 1 56 LYS H 4.650 . 5.150 3.480 3.394 3.517 . 0 0 "[ . 1 . ]" 1
1356 1 55 ILE MG 1 58 TYR HB3 6.610 . 7.110 4.387 4.333 4.426 . 0 0 "[ . 1 . ]" 1
1357 1 55 ILE MG 1 58 TYR QD 7.410 . 7.910 4.951 4.851 5.051 . 0 0 "[ . 1 . ]" 1
1358 1 55 ILE MG 1 59 ARG HD2 5.520 . 6.020 2.926 2.860 3.005 . 0 0 "[ . 1 . ]" 1
1359 1 55 ILE MG 1 59 ARG HD3 5.040 . 5.540 3.974 3.165 4.251 . 0 0 "[ . 1 . ]" 1
1360 1 55 ILE MG 1 59 ARG QG 7.410 . 7.910 3.550 3.503 3.614 . 0 0 "[ . 1 . ]" 1
1361 1 56 LYS H 1 56 LYS HB2 3.400 . 3.900 2.494 2.464 2.516 . 0 0 "[ . 1 . ]" 1
1362 1 56 LYS H 1 56 LYS HB3 3.730 . 4.230 2.405 2.375 2.476 . 0 0 "[ . 1 . ]" 1
1363 1 56 LYS H 1 56 LYS QD 5.110 . 5.610 4.584 4.559 4.612 . 0 0 "[ . 1 . ]" 1
1364 1 56 LYS H 1 56 LYS QE 5.470 . 5.970 4.065 3.907 4.252 . 0 0 "[ . 1 . ]" 1
1365 1 56 LYS H 1 56 LYS QG 4.660 . 5.160 3.939 3.927 3.947 . 0 0 "[ . 1 . ]" 1
1366 1 56 LYS H 1 77 ILE MG 6.020 . 6.520 4.113 4.014 4.285 . 0 0 "[ . 1 . ]" 1
1367 1 56 LYS HA 1 59 ARG H 4.280 . 4.780 3.627 3.437 3.746 . 0 0 "[ . 1 . ]" 1
1368 1 56 LYS HA 1 59 ARG HD2 4.080 . 4.580 3.008 2.450 4.156 . 0 0 "[ . 1 . ]" 1
1369 1 56 LYS HA 1 59 ARG HD3 5.240 . 5.740 3.840 2.572 4.378 . 0 0 "[ . 1 . ]" 1
1370 1 56 LYS HA 1 60 ALA MB 5.620 . 6.120 4.704 4.666 4.764 . 0 0 "[ . 1 . ]" 1
1371 1 56 LYS HA 1 77 ILE MG 5.930 . 6.430 4.602 4.468 4.814 . 0 0 "[ . 1 . ]" 1
1372 1 56 LYS HB2 1 57 ALA MB 6.610 . 7.110 5.412 5.382 5.449 . 0 0 "[ . 1 . ]" 1
1373 1 56 LYS HB2 1 77 ILE MG 5.040 . 5.540 3.987 3.833 4.264 . 0 0 "[ . 1 . ]" 1
1374 1 56 LYS HB3 1 77 ILE MD 6.610 . 7.110 4.711 4.594 4.927 . 0 0 "[ . 1 . ]" 1
1375 1 56 LYS HB3 1 77 ILE MG 5.200 . 5.700 2.622 2.478 2.855 . 0 0 "[ . 1 . ]" 1
1376 1 56 LYS QD 1 77 ILE MD 7.410 . 7.910 3.980 3.744 5.155 . 0 0 "[ . 1 . ]" 1
1377 1 56 LYS QD 1 77 ILE MG 6.750 . 7.250 2.606 2.255 4.061 . 0 0 "[ . 1 . ]" 1
1378 1 56 LYS QD 1 81 THR MG 6.250 . 6.750 3.743 3.593 3.883 . 0 0 "[ . 1 . ]" 1
1379 1 56 LYS QE 1 77 ILE MD 7.410 . 7.910 5.267 3.353 5.554 . 0 0 "[ . 1 . ]" 1
1380 1 56 LYS QE 1 77 ILE MG 6.590 . 7.090 3.642 1.982 3.985 . 0 0 "[ . 1 . ]" 1
1381 1 56 LYS QE 1 81 THR HA 5.700 . 6.200 4.058 2.705 4.680 . 0 0 "[ . 1 . ]" 1
1382 1 56 LYS QE 1 81 THR MG 5.880 . 6.380 2.931 2.364 3.342 . 0 0 "[ . 1 . ]" 1
1383 1 56 LYS QG 1 57 ALA H 5.370 . 5.870 3.877 3.837 3.943 . 0 0 "[ . 1 . ]" 1
1384 1 56 LYS QG 1 57 ALA MB 6.080 . 6.580 4.540 4.492 4.624 . 0 0 "[ . 1 . ]" 1
1385 1 56 LYS QG 1 60 ALA H 6.170 . 6.670 4.583 4.487 4.715 . 0 0 "[ . 1 . ]" 1
1386 1 56 LYS QG 1 60 ALA MB 5.190 . 5.690 3.495 3.428 3.615 . 0 0 "[ . 1 . ]" 1
1387 1 56 LYS QG 1 77 ILE MG 7.160 . 7.660 2.744 2.588 3.070 . 0 0 "[ . 1 . ]" 1
1388 1 57 ALA H 1 58 TYR HB3 5.500 . 6.000 4.927 4.880 4.957 . 0 0 "[ . 1 . ]" 1
1389 1 57 ALA H 1 59 ARG H 5.080 . 5.580 4.222 4.180 4.261 . 0 0 "[ . 1 . ]" 1
1390 1 57 ALA H 1 77 ILE MD 5.990 . 6.490 4.957 4.857 5.035 . 0 0 "[ . 1 . ]" 1
1391 1 57 ALA H 1 77 ILE MG 4.840 . 5.340 2.922 2.851 3.058 . 0 0 "[ . 1 . ]" 1
1392 1 57 ALA HA 1 60 ALA H 4.220 . 4.720 3.377 3.322 3.399 . 0 0 "[ . 1 . ]" 1
1393 1 57 ALA HA 1 60 ALA MB 4.410 . 4.910 2.644 2.551 2.679 . 0 0 "[ . 1 . ]" 1
1394 1 57 ALA HA 1 61 LEU H 5.150 . 5.650 4.317 4.287 4.344 . 0 0 "[ . 1 . ]" 1
1395 1 57 ALA HA 1 73 TRP HH2 3.390 . 3.890 2.837 2.705 2.961 . 0 0 "[ . 1 . ]" 1
1396 1 57 ALA HA 1 73 TRP HZ2 5.500 . 6.000 4.484 4.339 4.590 . 0 0 "[ . 1 . ]" 1
1397 1 57 ALA HA 1 73 TRP HZ3 4.690 . 5.190 3.935 3.780 4.169 . 0 0 "[ . 1 . ]" 1
1398 1 57 ALA HA 1 74 LEU MD1 6.610 . 7.110 4.099 3.942 4.234 . 0 0 "[ . 1 . ]" 1
1399 1 57 ALA HA 1 77 ILE HG12 5.500 . 6.000 4.623 4.528 4.754 . 0 0 "[ . 1 . ]" 1
1400 1 57 ALA HA 1 77 ILE MD 4.120 . 4.620 3.223 3.149 3.300 . 0 0 "[ . 1 . ]" 1
1401 1 57 ALA HA 1 77 ILE MG 4.970 . 5.470 2.687 2.551 2.792 . 0 0 "[ . 1 . ]" 1
1402 1 57 ALA MB 1 58 TYR H 4.640 . 5.140 2.586 2.526 2.638 . 0 0 "[ . 1 . ]" 1
1403 1 57 ALA MB 1 58 TYR HA 6.030 . 6.530 3.795 3.763 3.834 . 0 0 "[ . 1 . ]" 1
1404 1 57 ALA MB 1 58 TYR HB2 6.610 . 7.110 4.034 4.002 4.082 . 0 0 "[ . 1 . ]" 1
1405 1 57 ALA MB 1 60 ALA H 6.610 . 7.110 4.452 4.383 4.490 . 0 0 "[ . 1 . ]" 1
1406 1 57 ALA MB 1 73 TRP HH2 5.140 . 5.640 2.973 2.847 3.027 . 0 0 "[ . 1 . ]" 1
1407 1 57 ALA MB 1 73 TRP HZ2 5.960 . 6.460 4.960 4.861 5.000 . 0 0 "[ . 1 . ]" 1
1408 1 57 ALA MB 1 73 TRP HZ3 3.790 . 4.290 2.414 2.314 2.550 . 0 0 "[ . 1 . ]" 1
1409 1 57 ALA MB 1 74 LEU HA 5.810 . 6.310 3.834 3.724 3.948 . 0 0 "[ . 1 . ]" 1
1410 1 57 ALA MB 1 74 LEU MD1 4.890 . 5.390 2.187 2.074 2.300 . 0 0 "[ . 1 . ]" 1
1411 1 57 ALA MB 1 74 LEU MD2 7.850 . 8.350 3.995 3.872 4.106 . 0 0 "[ . 1 . ]" 1
1412 1 57 ALA MB 1 77 ILE HG12 6.610 . 7.110 3.830 3.760 3.902 . 0 0 "[ . 1 . ]" 1
1413 1 57 ALA MB 1 77 ILE HG13 6.610 . 7.110 2.499 2.440 2.575 . 0 0 "[ . 1 . ]" 1
1414 1 57 ALA MB 1 77 ILE MD 5.800 . 6.300 3.650 3.590 3.737 . 0 0 "[ . 1 . ]" 1
1415 1 57 ALA MB 1 77 ILE MG 5.080 . 5.580 2.237 2.066 2.341 . 0 0 "[ . 1 . ]" 1
1416 1 58 TYR H 1 58 TYR HB2 3.460 . 3.960 2.393 2.376 2.412 . 0 0 "[ . 1 . ]" 1
1417 1 58 TYR H 1 58 TYR HB3 3.400 . 3.900 2.519 2.493 2.538 . 0 0 "[ . 1 . ]" 1
1418 1 58 TYR H 1 58 TYR QD 4.600 . 5.100 4.142 4.136 4.155 . 0 0 "[ . 1 . ]" 1
1419 1 58 TYR H 1 59 ARG H 3.640 . 4.140 2.714 2.657 2.756 . 0 0 "[ . 1 . ]" 1
1420 1 58 TYR H 1 60 ALA H 4.560 . 5.060 4.034 3.915 4.101 . 0 0 "[ . 1 . ]" 1
1421 1 58 TYR H 1 61 LEU MD1 6.790 . 7.290 5.690 5.661 5.716 . 0 0 "[ . 1 . ]" 1
1422 1 58 TYR H 1 77 ILE MG 6.610 . 7.110 4.959 4.886 5.066 . 0 0 "[ . 1 . ]" 1
1423 1 58 TYR HA 1 58 TYR QD 3.690 . 4.190 2.519 2.399 2.750 . 0 0 "[ . 1 . ]" 1
1424 1 58 TYR HA 1 58 TYR QE 5.190 . 5.690 4.516 4.463 4.620 . 0 0 "[ . 1 . ]" 1
1425 1 58 TYR HA 1 59 ARG HA 4.800 . 5.300 4.803 4.790 4.811 . 0 0 "[ . 1 . ]" 1
1426 1 58 TYR HA 1 60 ALA H 5.500 . 6.000 4.108 3.882 4.274 . 0 0 "[ . 1 . ]" 1
1427 1 58 TYR HA 1 61 LEU H 4.560 . 5.060 3.210 3.091 3.321 . 0 0 "[ . 1 . ]" 1
1428 1 58 TYR HA 1 61 LEU HB2 3.780 . 4.280 2.519 2.440 2.603 . 0 0 "[ . 1 . ]" 1
1429 1 58 TYR HA 1 61 LEU HB3 4.060 . 4.560 2.628 2.497 2.705 . 0 0 "[ . 1 . ]" 1
1430 1 58 TYR HA 1 61 LEU MD1 5.000 . 5.500 4.207 4.181 4.266 . 0 0 "[ . 1 . ]" 1
1431 1 58 TYR HA 1 61 LEU MD2 6.510 . 7.010 2.949 2.902 3.001 . 0 0 "[ . 1 . ]" 1
1432 1 58 TYR HB2 1 59 ARG H 3.850 . 4.350 3.872 3.857 3.906 . 0 0 "[ . 1 . ]" 1
1433 1 58 TYR HB2 1 59 ARG QG 5.990 . 6.490 4.642 4.577 4.749 . 0 0 "[ . 1 . ]" 1
1434 1 58 TYR HB2 1 61 LEU HB2 5.330 . 5.830 4.909 4.782 5.002 . 0 0 "[ . 1 . ]" 1
1435 1 58 TYR HB3 1 59 ARG H 3.990 . 4.490 2.624 2.597 2.675 . 0 0 "[ . 1 . ]" 1
1436 1 58 TYR HB3 1 59 ARG HD3 5.900 . 6.400 5.855 5.254 6.039 . 0 0 "[ . 1 . ]" 1
1437 1 58 TYR HB3 1 59 ARG QG 6.170 . 6.670 3.005 2.935 3.122 . 0 0 "[ . 1 . ]" 1
1438 1 58 TYR HB3 1 61 LEU HB2 5.490 . 5.990 5.445 5.400 5.511 . 0 0 "[ . 1 . ]" 1
1439 1 58 TYR QD 1 59 ARG H 4.860 . 5.360 3.813 3.714 3.880 . 0 0 "[ . 1 . ]" 1
1440 1 58 TYR QD 1 59 ARG HA 5.250 . 5.750 3.807 3.569 3.962 . 0 0 "[ . 1 . ]" 1
1441 1 58 TYR QD 1 59 ARG HB2 6.170 . 6.670 5.329 5.220 5.405 . 0 0 "[ . 1 . ]" 1
1442 1 58 TYR QD 1 59 ARG HD2 6.170 . 6.670 5.408 5.064 5.525 . 0 0 "[ . 1 . ]" 1
1443 1 58 TYR QD 1 59 ARG QG 4.900 . 5.400 3.056 2.996 3.139 . 0 0 "[ . 1 . ]" 1
1444 1 58 TYR QD 1 61 LEU HB3 5.600 . 6.100 3.788 3.644 3.976 . 0 0 "[ . 1 . ]" 1
1445 1 58 TYR QD 1 61 LEU QD 5.490 . 5.990 2.865 2.744 2.967 . 0 0 "[ . 1 . ]" 1
1446 1 58 TYR QD 1 62 ASP H 6.170 . 6.670 5.613 5.556 5.644 . 0 0 "[ . 1 . ]" 1
1447 1 58 TYR QE 1 59 ARG H 6.510 . 7.010 5.865 5.846 5.884 . 0 0 "[ . 1 . ]" 1
1448 1 58 TYR QE 1 59 ARG QG 6.010 . 6.510 4.751 4.665 4.796 . 0 0 "[ . 1 . ]" 1
1449 1 59 ARG H 1 59 ARG HB2 3.150 . 3.650 2.363 2.340 2.414 . 0 0 "[ . 1 . ]" 1
1450 1 59 ARG H 1 59 ARG HB3 3.930 . 4.430 3.556 3.545 3.579 . 0 0 "[ . 1 . ]" 1
1451 1 59 ARG H 1 59 ARG HD2 5.010 . 5.510 3.772 3.534 4.424 . 0 0 "[ . 1 . ]" 1
1452 1 59 ARG H 1 59 ARG HD3 4.590 . 5.090 4.326 3.688 4.528 . 0 0 "[ . 1 . ]" 1
1453 1 59 ARG H 1 59 ARG QG 4.610 . 5.110 2.200 2.160 2.250 . 0 0 "[ . 1 . ]" 1
1454 1 59 ARG H 1 60 ALA H 3.610 . 4.110 2.540 2.516 2.567 . 0 0 "[ . 1 . ]" 1
1455 1 59 ARG H 1 60 ALA MB 5.370 . 5.870 4.251 4.235 4.273 . 0 0 "[ . 1 . ]" 1
1456 1 59 ARG H 1 61 LEU H 4.900 . 5.400 3.813 3.769 3.875 . 0 0 "[ . 1 . ]" 1
1457 1 59 ARG HA 1 59 ARG HD2 4.680 . 5.180 4.662 4.618 4.798 . 0 0 "[ . 1 . ]" 1
1458 1 59 ARG HA 1 59 ARG HD3 4.510 . 5.010 4.432 4.365 4.574 . 0 0 "[ . 1 . ]" 1
1459 1 59 ARG HA 1 61 LEU H 5.240 . 5.740 3.998 3.923 4.067 . 0 0 "[ . 1 . ]" 1
1460 1 59 ARG HB2 1 59 ARG HD2 3.400 . 3.900 2.700 2.427 3.601 . 0 0 "[ . 1 . ]" 1
1461 1 59 ARG HB2 1 59 ARG HD3 3.480 . 3.980 2.691 2.302 2.815 . 0 0 "[ . 1 . ]" 1
1462 1 59 ARG HB2 1 60 ALA H 3.670 . 4.170 2.975 2.873 3.184 . 0 0 "[ . 1 . ]" 1
1463 1 59 ARG HB2 1 60 ALA MB 6.120 . 6.620 3.914 3.877 3.953 . 0 0 "[ . 1 . ]" 1
1464 1 59 ARG HB3 1 60 ALA H 4.920 . 5.420 3.928 3.875 4.059 . 0 0 "[ . 1 . ]" 1
1465 1 59 ARG HB3 1 62 ASP QB 6.170 . 6.670 5.538 5.499 5.600 . 0 0 "[ . 1 . ]" 1
1466 1 59 ARG HD3 1 60 ALA H 5.500 . 6.000 5.614 5.266 5.712 . 0 0 "[ . 1 . ]" 1
1467 1 59 ARG QG 1 60 ALA H 6.070 . 6.570 4.190 4.141 4.270 . 0 0 "[ . 1 . ]" 1
1468 1 59 ARG QG 1 61 LEU H 6.170 . 6.670 5.287 5.225 5.347 . 0 0 "[ . 1 . ]" 1
1469 1 60 ALA H 1 61 LEU H 3.220 . 3.720 2.277 2.115 2.367 . 0 0 "[ . 1 . ]" 1
1470 1 60 ALA H 1 61 LEU HB2 4.930 . 5.430 4.152 4.025 4.247 . 0 0 "[ . 1 . ]" 1
1471 1 60 ALA H 1 61 LEU MD1 6.610 . 7.110 5.444 5.348 5.506 . 0 0 "[ . 1 . ]" 1
1472 1 60 ALA H 1 63 SER H 5.300 . 5.800 5.351 5.299 5.397 . 0 0 "[ . 1 . ]" 1
1473 1 60 ALA H 1 73 TRP HH2 4.530 . 5.030 3.843 3.676 3.915 . 0 0 "[ . 1 . ]" 1
1474 1 60 ALA H 1 73 TRP HZ2 4.860 . 5.360 4.727 4.596 4.819 . 0 0 "[ . 1 . ]" 1
1475 1 60 ALA H 1 77 ILE MD 6.610 . 7.110 5.171 5.114 5.248 . 0 0 "[ . 1 . ]" 1
1476 1 60 ALA HA 1 62 ASP H 4.790 . 5.290 3.908 3.817 4.030 . 0 0 "[ . 1 . ]" 1
1477 1 60 ALA HA 1 63 SER HB3 4.980 . 5.480 4.836 3.911 5.018 . 0 0 "[ . 1 . ]" 1
1478 1 60 ALA HA 1 77 ILE MD 6.730 . 7.230 5.655 5.640 5.690 . 0 0 "[ . 1 . ]" 1
1479 1 60 ALA MB 1 61 LEU H 4.160 . 4.660 3.165 3.140 3.188 . 0 0 "[ . 1 . ]" 1
1480 1 60 ALA MB 1 61 LEU HB2 5.850 . 6.350 4.336 4.269 4.374 . 0 0 "[ . 1 . ]" 1
1481 1 60 ALA MB 1 62 ASP H 6.610 . 7.110 4.627 4.569 4.698 . 0 0 "[ . 1 . ]" 1
1482 1 60 ALA MB 1 63 SER H 6.610 . 7.110 4.359 4.311 4.451 . 0 0 "[ . 1 . ]" 1
1483 1 60 ALA MB 1 63 SER HB3 6.460 . 6.960 5.117 4.111 5.367 . 0 0 "[ . 1 . ]" 1
1484 1 60 ALA MB 1 73 TRP HE1 5.390 . 5.890 4.250 4.124 4.359 . 0 0 "[ . 1 . ]" 1
1485 1 60 ALA MB 1 73 TRP HH2 3.570 . 4.070 2.666 2.579 2.778 . 0 0 "[ . 1 . ]" 1
1486 1 60 ALA MB 1 73 TRP HZ2 3.310 . 3.810 2.348 2.278 2.440 . 0 0 "[ . 1 . ]" 1
1487 1 60 ALA MB 1 73 TRP HZ3 6.610 . 7.110 4.695 4.616 4.812 . 0 0 "[ . 1 . ]" 1
1488 1 60 ALA MB 1 77 ILE MD 4.960 . 5.460 3.012 2.996 3.039 . 0 0 "[ . 1 . ]" 1
1489 1 60 ALA MB 1 77 ILE MG 7.930 . 8.430 3.939 3.843 4.023 . 0 0 "[ . 1 . ]" 1
1490 1 61 LEU H 1 61 LEU HB2 3.040 . 3.540 2.404 2.390 2.417 . 0 0 "[ . 1 . ]" 1
1491 1 61 LEU H 1 61 LEU HG 4.390 . 4.890 4.464 4.455 4.473 . 0 0 "[ . 1 . ]" 1
1492 1 61 LEU H 1 61 LEU MD1 5.100 . 5.600 3.959 3.942 3.974 . 0 0 "[ . 1 . ]" 1
1493 1 61 LEU H 1 62 ASP H 3.520 . 4.020 2.462 2.439 2.482 . 0 0 "[ . 1 . ]" 1
1494 1 61 LEU H 1 62 ASP QB 6.170 . 6.670 4.191 4.149 4.495 . 0 0 "[ . 1 . ]" 1
1495 1 61 LEU HA 1 61 LEU MD2 4.540 . 5.040 3.815 3.810 3.821 . 0 0 "[ . 1 . ]" 1
1496 1 61 LEU HA 1 62 ASP HA 5.150 . 5.650 4.822 4.787 4.851 . 0 0 "[ . 1 . ]" 1
1497 1 61 LEU HA 1 64 PHE HB2 4.170 . 4.670 2.502 2.406 2.684 . 0 0 "[ . 1 . ]" 1
1498 1 61 LEU HA 1 64 PHE QD 6.170 . 6.670 4.394 4.145 4.635 . 0 0 "[ . 1 . ]" 1
1499 1 61 LEU HA 1 73 TRP HH2 3.230 . 3.730 2.894 2.826 3.033 . 0 0 "[ . 1 . ]" 1
1500 1 61 LEU HA 1 73 TRP HZ2 3.520 . 4.020 3.201 3.102 3.283 . 0 0 "[ . 1 . ]" 1
1501 1 61 LEU HA 1 73 TRP HZ3 4.900 . 5.400 4.374 4.284 4.504 . 0 0 "[ . 1 . ]" 1
1502 1 61 LEU HB2 1 62 ASP H 4.060 . 4.560 3.969 3.948 3.991 . 0 0 "[ . 1 . ]" 1
1503 1 61 LEU HB2 1 63 SER H 5.500 . 6.000 5.263 5.215 5.356 . 0 0 "[ . 1 . ]" 1
1504 1 61 LEU HB2 1 73 TRP HH2 4.240 . 4.740 2.770 2.662 2.841 . 0 0 "[ . 1 . ]" 1
1505 1 61 LEU HB3 1 62 ASP H 3.640 . 4.140 2.928 2.861 2.958 . 0 0 "[ . 1 . ]" 1
1506 1 61 LEU HB3 1 62 ASP QB 5.630 . 6.130 4.260 4.157 4.787 . 0 0 "[ . 1 . ]" 1
1507 1 61 LEU HG 1 64 PHE HB2 4.860 . 5.360 4.163 3.880 4.686 . 0 0 "[ . 1 . ]" 1
1508 1 61 LEU HG 1 73 TRP HH2 4.980 . 5.480 5.053 5.022 5.089 . 0 0 "[ . 1 . ]" 1
1509 1 61 LEU HG 1 73 TRP HZ3 5.440 . 5.940 5.512 5.476 5.542 . 0 0 "[ . 1 . ]" 1
1510 1 61 LEU MD1 1 64 PHE HB2 6.030 . 6.530 2.437 2.254 2.916 . 0 0 "[ . 1 . ]" 1
1511 1 61 LEU MD1 1 70 PHE QE 6.010 . 6.510 1.970 1.936 2.003 . 0 0 "[ . 1 . ]" 1
1512 1 61 LEU MD1 1 73 TRP HZ3 4.350 . 4.850 2.477 2.445 2.501 . 0 0 "[ . 1 . ]" 1
1513 1 61 LEU MD2 1 62 ASP H 6.150 . 6.650 4.671 4.605 4.706 . 0 0 "[ . 1 . ]" 1
1514 1 61 LEU MD2 1 62 ASP HA 6.610 . 7.110 5.126 5.038 5.186 . 0 0 "[ . 1 . ]" 1
1515 1 61 LEU MD2 1 64 PHE H 6.790 . 7.290 5.637 5.518 5.728 . 0 0 "[ . 1 . ]" 1
1516 1 61 LEU MD2 1 64 PHE HB3 6.180 . 6.680 4.792 4.668 4.919 . 0 0 "[ . 1 . ]" 1
1517 1 61 LEU MD2 1 70 PHE QE 7.320 . 7.820 3.286 2.977 3.373 . 0 0 "[ . 1 . ]" 1
1518 1 61 LEU QD 1 64 PHE QD 5.800 . 6.300 3.093 2.523 3.364 . 0 0 "[ . 1 . ]" 1
1519 1 61 LEU QD 1 64 PHE QE 7.570 . 8.070 4.189 3.837 4.424 . 0 0 "[ . 1 . ]" 1
1520 1 61 LEU QD 1 70 PHE HZ 5.620 . 6.120 3.333 3.255 3.492 . 0 0 "[ . 1 . ]" 1
1521 1 61 LEU QD 1 70 PHE QD 6.450 . 6.950 2.938 2.521 3.053 . 0 0 "[ . 1 . ]" 1
1522 1 61 LEU QD 1 70 PHE QE 5.510 . 6.010 1.955 1.923 1.984 . 0 0 "[ . 1 . ]" 1
1523 1 61 LEU QD 1 73 TRP HE3 6.980 . 7.480 3.612 3.510 3.659 . 0 0 "[ . 1 . ]" 1
1524 1 61 LEU QD 1 73 TRP HH2 4.660 . 5.160 2.851 2.814 2.903 . 0 0 "[ . 1 . ]" 1
1525 1 61 LEU QD 1 73 TRP HZ2 5.660 . 6.160 3.861 3.736 3.939 . 0 0 "[ . 1 . ]" 1
1526 1 61 LEU QD 1 73 TRP HZ3 4.910 . 5.410 2.457 2.426 2.481 . 0 0 "[ . 1 . ]" 1
1527 1 62 ASP H 1 62 ASP QB 3.400 . 3.900 2.205 2.185 2.372 . 0 0 "[ . 1 . ]" 1
1528 1 62 ASP H 1 63 SER H 3.230 . 3.730 2.624 2.579 2.688 . 0 0 "[ . 1 . ]" 1
1529 1 62 ASP QB 1 63 SER H 4.290 . 4.790 3.204 3.145 3.317 . 0 0 "[ . 1 . ]" 1
1530 1 62 ASP QB 1 63 SER HA 5.630 . 6.130 4.500 4.305 4.539 . 0 0 "[ . 1 . ]" 1
1531 1 62 ASP QB 1 63 SER HB3 6.170 . 6.670 5.431 3.980 5.578 . 0 0 "[ . 1 . ]" 1
1532 1 63 SER H 1 63 SER HB2 3.700 . 4.200 2.612 2.509 3.763 . 0 0 "[ . 1 . ]" 1
1533 1 63 SER H 1 63 SER HB3 3.550 . 4.050 3.602 2.710 3.705 . 0 0 "[ . 1 . ]" 1
1534 1 63 SER H 1 64 PHE H 3.190 . 3.690 2.217 2.148 2.284 . 0 0 "[ . 1 . ]" 1
1535 1 63 SER HA 1 65 ARG QD 6.030 . 6.530 4.663 2.997 5.431 . 0 0 "[ . 1 . ]" 1
1536 1 63 SER HB2 1 64 PHE H 5.090 . 5.590 3.747 3.572 4.502 . 0 0 "[ . 1 . ]" 1
1537 1 63 SER HB3 1 64 PHE H 5.050 . 5.550 4.357 3.763 4.516 . 0 0 "[ . 1 . ]" 1
1538 1 63 SER HB3 1 65 ARG QD 6.170 . 6.670 5.343 4.342 5.620 . 0 0 "[ . 1 . ]" 1
1539 1 64 PHE H 1 64 PHE HB2 3.250 . 3.750 2.588 2.495 2.772 . 0 0 "[ . 1 . ]" 1
1540 1 64 PHE H 1 64 PHE HB3 3.510 . 4.010 2.411 2.371 2.450 . 0 0 "[ . 1 . ]" 1
1541 1 64 PHE H 1 64 PHE QD 4.850 . 5.350 4.185 4.158 4.218 . 0 0 "[ . 1 . ]" 1
1542 1 64 PHE H 1 65 ARG H 5.030 . 5.530 4.617 4.374 4.672 . 0 0 "[ . 1 . ]" 1
1543 1 64 PHE H 1 73 TRP HE1 5.500 . 6.000 5.541 5.347 5.587 . 0 0 "[ . 1 . ]" 1
1544 1 64 PHE HA 1 64 PHE QD 3.400 . 3.900 2.507 2.176 2.705 . 0 0 "[ . 1 . ]" 1
1545 1 64 PHE HA 1 64 PHE QE 5.050 . 5.550 4.552 4.460 4.623 . 0 0 "[ . 1 . ]" 1
1546 1 64 PHE HA 1 65 ARG H 3.230 . 3.730 2.246 2.099 2.342 . 0 0 "[ . 1 . ]" 1
1547 1 64 PHE HA 1 65 ARG HB2 5.500 . 6.000 4.471 3.970 5.549 . 0 0 "[ . 1 . ]" 1
1548 1 64 PHE HA 1 66 GLY H 5.220 . 5.720 3.807 3.433 3.965 . 0 0 "[ . 1 . ]" 1
1549 1 64 PHE HA 1 73 TRP HE1 4.200 . 4.700 3.851 3.687 4.016 . 0 0 "[ . 1 . ]" 1
1550 1 64 PHE HB2 1 73 TRP HE1 5.090 . 5.590 3.992 3.247 4.237 . 0 0 "[ . 1 . ]" 1
1551 1 64 PHE HB2 1 73 TRP HZ2 4.520 . 5.020 3.478 3.020 3.732 . 0 0 "[ . 1 . ]" 1
1552 1 64 PHE HB3 1 73 TRP HZ2 5.500 . 6.000 5.120 4.517 5.408 . 0 0 "[ . 1 . ]" 1
1553 1 64 PHE HZ 1 66 GLY H 4.550 . 5.050 3.627 3.372 4.160 . 0 0 "[ . 1 . ]" 1
1554 1 64 PHE HZ 1 66 GLY HA3 4.000 . 4.500 3.992 3.153 4.155 . 0 0 "[ . 1 . ]" 1
1555 1 64 PHE HZ 1 68 SER H 4.190 . 4.690 3.492 2.680 3.849 . 0 0 "[ . 1 . ]" 1
1556 1 64 PHE HZ 1 69 ALA HA 4.560 . 5.060 4.118 3.898 4.633 . 0 0 "[ . 1 . ]" 1
1557 1 64 PHE HZ 1 69 ALA MB 6.150 . 6.650 4.974 2.946 5.192 . 0 0 "[ . 1 . ]" 1
1558 1 64 PHE HZ 1 70 PHE H 4.740 . 5.240 3.874 3.109 4.784 . 0 0 "[ . 1 . ]" 1
1559 1 64 PHE HZ 1 70 PHE HA 3.470 . 3.970 3.183 2.849 3.453 . 0 0 "[ . 1 . ]" 1
1560 1 64 PHE HZ 1 73 TRP HB3 4.690 . 5.190 4.385 3.822 4.682 . 0 0 "[ . 1 . ]" 1
1561 1 64 PHE QD 1 65 ARG H 4.440 . 4.940 3.077 2.441 3.427 . 0 0 "[ . 1 . ]" 1
1562 1 64 PHE QD 1 65 ARG HA 6.170 . 6.670 4.391 4.078 4.826 . 0 0 "[ . 1 . ]" 1
1563 1 64 PHE QD 1 66 GLY H 4.530 . 5.030 3.138 2.788 3.313 . 0 0 "[ . 1 . ]" 1
1564 1 64 PHE QD 1 66 GLY HA2 6.010 . 6.510 4.383 4.049 5.481 . 0 0 "[ . 1 . ]" 1
1565 1 64 PHE QD 1 67 ASP H 5.720 . 6.220 4.733 3.404 5.118 . 0 0 "[ . 1 . ]" 1
1566 1 64 PHE QD 1 68 SER H 6.170 . 6.670 5.183 4.985 5.583 . 0 0 "[ . 1 . ]" 1
1567 1 64 PHE QD 1 73 TRP HD1 4.030 . 4.530 3.228 3.134 3.321 . 0 0 "[ . 1 . ]" 1
1568 1 64 PHE QD 1 73 TRP HE1 4.700 . 5.200 3.051 2.780 3.464 . 0 0 "[ . 1 . ]" 1
1569 1 64 PHE QE 1 66 GLY H 4.570 . 5.070 3.110 2.951 3.355 . 0 0 "[ . 1 . ]" 1
1570 1 64 PHE QE 1 66 GLY HA2 5.580 . 6.080 3.145 2.641 4.710 . 0 0 "[ . 1 . ]" 1
1571 1 64 PHE QE 1 66 GLY HA3 4.470 . 4.970 3.479 2.542 3.955 . 0 0 "[ . 1 . ]" 1
1572 1 64 PHE QE 1 67 ASP H 5.510 . 6.010 4.113 2.460 4.480 . 0 0 "[ . 1 . ]" 1
1573 1 64 PHE QE 1 68 SER H 4.310 . 4.810 3.505 3.074 3.717 . 0 0 "[ . 1 . ]" 1
1574 1 64 PHE QE 1 69 ALA HA 5.650 . 6.150 4.975 4.818 5.240 . 0 0 "[ . 1 . ]" 1
1575 1 64 PHE QE 1 70 PHE H 5.620 . 6.120 4.542 3.758 4.720 . 0 0 "[ . 1 . ]" 1
1576 1 64 PHE QE 1 70 PHE HA 3.690 . 4.190 3.233 2.801 3.346 . 0 0 "[ . 1 . ]" 1
1577 1 64 PHE QE 1 73 TRP HD1 4.320 . 4.820 3.349 2.786 3.860 . 0 0 "[ . 1 . ]" 1
1578 1 70 PHE H 1 71 TYR H 4.410 . 4.910 2.690 2.591 2.736 . 0 0 "[ . 1 . ]" 1
1579 1 70 PHE H 1 71 TYR QE 6.080 . 6.580 4.984 4.657 5.098 . 0 0 "[ . 1 . ]" 1
1580 1 70 PHE HA 1 70 PHE QD 4.130 . 4.630 2.501 2.432 2.570 . 0 0 "[ . 1 . ]" 1
1581 1 70 PHE HA 1 70 PHE QE 5.170 . 5.670 4.559 4.500 4.648 . 0 0 "[ . 1 . ]" 1
1582 1 70 PHE HA 1 71 TYR HA 5.130 . 5.630 4.722 4.703 4.743 . 0 0 "[ . 1 . ]" 1
1583 1 70 PHE HA 1 72 THR H 5.270 . 5.770 4.446 4.368 4.704 . 0 0 "[ . 1 . ]" 1
1584 1 70 PHE HA 1 73 TRP HE3 4.030 . 4.530 3.879 3.620 4.044 . 0 0 "[ . 1 . ]" 1
1585 1 70 PHE HZ 1 73 TRP HE3 4.490 . 4.990 4.551 4.520 4.633 . 0 0 "[ . 1 . ]" 1
1586 1 70 PHE HZ 1 73 TRP HZ3 3.840 . 4.340 3.843 3.817 3.865 . 0 0 "[ . 1 . ]" 1
1587 1 70 PHE HZ 1 74 LEU MD1 4.920 . 5.420 2.976 2.708 3.108 . 0 0 "[ . 1 . ]" 1
1588 1 70 PHE QD 1 71 TYR H 5.040 . 5.540 3.853 3.818 3.905 . 0 0 "[ . 1 . ]" 1
1589 1 70 PHE QD 1 71 TYR HA 5.410 . 5.910 3.745 3.659 3.794 . 0 0 "[ . 1 . ]" 1
1590 1 70 PHE QD 1 73 TRP HE3 4.730 . 5.230 3.168 3.060 3.278 . 0 0 "[ . 1 . ]" 1
1591 1 70 PHE QD 1 73 TRP HZ3 4.860 . 5.360 4.229 3.974 4.338 . 0 0 "[ . 1 . ]" 1
1592 1 70 PHE QD 1 74 LEU MD2 7.410 . 7.910 3.866 3.739 3.999 . 0 0 "[ . 1 . ]" 1
1593 1 70 PHE QE 1 71 TYR H 6.340 . 6.840 5.734 5.706 5.761 . 0 0 "[ . 1 . ]" 1
1594 1 70 PHE QE 1 73 TRP HE3 4.370 . 4.870 3.004 2.877 3.141 . 0 0 "[ . 1 . ]" 1
1595 1 70 PHE QE 1 73 TRP HH2 4.950 . 5.450 4.373 4.261 4.423 . 0 0 "[ . 1 . ]" 1
1596 1 70 PHE QE 1 73 TRP HZ3 3.820 . 4.320 2.495 2.328 2.600 . 0 0 "[ . 1 . ]" 1
1597 1 70 PHE QE 1 74 LEU HA 5.700 . 6.200 4.840 4.574 4.958 . 0 0 "[ . 1 . ]" 1
1598 1 70 PHE QE 1 74 LEU HB3 6.170 . 6.670 4.428 4.285 4.527 . 0 0 "[ . 1 . ]" 1
1599 1 71 TYR H 1 71 TYR HB2 3.600 . 4.100 3.615 3.605 3.621 . 0 0 "[ . 1 . ]" 1
1600 1 71 TYR H 1 71 TYR HB3 3.880 . 4.380 2.586 2.533 2.645 . 0 0 "[ . 1 . ]" 1
1601 1 71 TYR H 1 71 TYR QD 3.610 . 4.110 2.382 2.279 2.445 . 0 0 "[ . 1 . ]" 1
1602 1 71 TYR H 1 71 TYR QE 5.470 . 5.970 4.160 4.030 4.218 . 0 0 "[ . 1 . ]" 1
1603 1 71 TYR H 1 72 THR H 3.890 . 4.390 2.663 2.635 2.730 . 0 0 "[ . 1 . ]" 1
1604 1 71 TYR H 1 72 THR HB 5.500 . 6.000 4.944 4.901 5.025 . 0 0 "[ . 1 . ]" 1
1605 1 71 TYR H 1 73 TRP H 5.490 . 5.990 3.996 3.898 4.135 . 0 0 "[ . 1 . ]" 1
1606 1 71 TYR HA 1 73 TRP H 5.500 . 6.000 4.295 4.218 4.387 . 0 0 "[ . 1 . ]" 1
1607 1 71 TYR HA 1 74 LEU H 4.270 . 4.770 3.314 3.258 3.379 . 0 0 "[ . 1 . ]" 1
1608 1 71 TYR HA 1 74 LEU HB2 3.700 . 4.200 3.705 3.649 3.723 . 0 0 "[ . 1 . ]" 1
1609 1 71 TYR HA 1 74 LEU HG 5.000 . 5.500 5.002 4.917 5.052 . 0 0 "[ . 1 . ]" 1
1610 1 71 TYR HA 1 75 TYR H 4.740 . 5.240 3.942 3.840 4.011 . 0 0 "[ . 1 . ]" 1
1611 1 71 TYR HA 1 75 TYR QD 5.530 . 6.030 4.417 4.130 4.601 . 0 0 "[ . 1 . ]" 1
1612 1 71 TYR HB2 1 72 THR H 5.360 . 5.860 3.900 3.753 3.948 . 0 0 "[ . 1 . ]" 1
1613 1 71 TYR HB3 1 72 THR H 5.460 . 5.960 4.060 4.026 4.104 . 0 0 "[ . 1 . ]" 1
1614 1 71 TYR HB3 1 74 LEU HB2 6.000 . 6.500 6.010 5.962 6.033 . 0 0 "[ . 1 . ]" 1
1615 1 71 TYR HB3 1 74 LEU MD2 6.610 . 7.110 5.089 4.983 5.167 . 0 0 "[ . 1 . ]" 1
1616 1 71 TYR HB3 1 75 TYR QE 4.880 . 5.380 4.355 4.151 4.475 . 0 0 "[ . 1 . ]" 1
1617 1 71 TYR QD 1 72 THR H 4.180 . 4.680 3.072 2.875 3.178 . 0 0 "[ . 1 . ]" 1
1618 1 71 TYR QD 1 72 THR HA 4.250 . 4.750 3.112 3.050 3.222 . 0 0 "[ . 1 . ]" 1
1619 1 71 TYR QD 1 75 TYR H 5.620 . 6.120 5.059 5.009 5.161 . 0 0 "[ . 1 . ]" 1
1620 1 71 TYR QD 1 75 TYR QD 4.430 . 4.930 3.181 2.731 3.538 . 0 0 "[ . 1 . ]" 1
1621 1 71 TYR QE 1 72 THR H 5.030 . 5.530 3.954 3.792 4.026 . 0 0 "[ . 1 . ]" 1
1622 1 71 TYR QE 1 72 THR HA 4.890 . 5.390 4.216 4.124 4.367 . 0 0 "[ . 1 . ]" 1
1623 1 71 TYR QE 1 72 THR HB 5.460 . 5.960 4.712 4.472 4.872 . 0 0 "[ . 1 . ]" 1
1624 1 71 TYR QE 1 72 THR MG 5.630 . 6.130 4.204 4.181 4.226 . 0 0 "[ . 1 . ]" 1
1625 1 72 THR H 1 72 THR HB 3.330 . 3.830 2.519 2.473 2.543 . 0 0 "[ . 1 . ]" 1
1626 1 72 THR H 1 73 TRP H 3.570 . 4.070 2.508 2.430 2.554 . 0 0 "[ . 1 . ]" 1
1627 1 72 THR H 1 74 LEU H 5.050 . 5.550 3.979 3.879 4.027 . 0 0 "[ . 1 . ]" 1
1628 1 72 THR H 1 75 TYR H 5.470 . 5.970 4.756 4.709 4.792 . 0 0 "[ . 1 . ]" 1
1629 1 72 THR HA 1 74 LEU H 5.500 . 6.000 4.215 4.105 4.301 . 0 0 "[ . 1 . ]" 1
1630 1 72 THR HA 1 75 TYR H 4.200 . 4.700 3.490 3.408 3.545 . 0 0 "[ . 1 . ]" 1
1631 1 72 THR HA 1 75 TYR HB2 3.840 . 4.340 2.938 2.892 2.991 . 0 0 "[ . 1 . ]" 1
1632 1 72 THR HA 1 75 TYR HB3 4.570 . 5.070 4.575 4.493 4.622 . 0 0 "[ . 1 . ]" 1
1633 1 72 THR HA 1 75 TYR QD 4.990 . 5.490 3.101 2.699 3.441 . 0 0 "[ . 1 . ]" 1
1634 1 72 THR HA 1 76 ARG H 5.290 . 5.790 4.497 4.396 4.593 . 0 0 "[ . 1 . ]" 1
1635 1 72 THR HB 1 73 TRP H 3.130 . 3.630 2.738 2.647 2.813 . 0 0 "[ . 1 . ]" 1
1636 1 72 THR HB 1 73 TRP HB3 4.980 . 5.480 4.817 4.759 4.899 . 0 0 "[ . 1 . ]" 1
1637 1 72 THR HB 1 74 LEU H 5.500 . 6.000 5.003 4.968 5.055 . 0 0 "[ . 1 . ]" 1
1638 1 72 THR MG 1 73 TRP H 5.450 . 5.950 3.693 3.616 3.768 . 0 0 "[ . 1 . ]" 1
1639 1 72 THR MG 1 73 TRP HA 6.230 . 6.730 3.699 3.574 3.809 . 0 0 "[ . 1 . ]" 1
1640 1 72 THR MG 1 73 TRP HB2 6.610 . 7.110 4.634 4.541 4.716 . 0 0 "[ . 1 . ]" 1
1641 1 72 THR MG 1 75 TYR HB3 6.610 . 7.110 5.328 5.193 5.459 . 0 0 "[ . 1 . ]" 1
1642 1 72 THR MG 1 76 ARG H 6.270 . 6.770 4.588 4.525 4.661 . 0 0 "[ . 1 . ]" 1
1643 1 72 THR MG 1 76 ARG HB3 6.610 . 7.110 4.993 4.168 5.618 . 0 0 "[ . 1 . ]" 1
1644 1 72 THR MG 1 76 ARG QD 7.410 . 7.910 3.832 3.203 4.476 . 0 0 "[ . 1 . ]" 1
1645 1 73 TRP H 1 73 TRP HB2 3.870 . 4.370 2.583 2.537 2.642 . 0 0 "[ . 1 . ]" 1
1646 1 73 TRP H 1 73 TRP HE3 4.810 . 5.310 4.472 4.424 4.527 . 0 0 "[ . 1 . ]" 1
1647 1 73 TRP H 1 74 LEU H 3.620 . 4.120 2.562 2.499 2.616 . 0 0 "[ . 1 . ]" 1
1648 1 73 TRP H 1 74 LEU HB3 5.410 . 5.910 4.745 4.663 4.807 . 0 0 "[ . 1 . ]" 1
1649 1 73 TRP H 1 75 TYR H 4.930 . 5.430 4.149 4.102 4.215 . 0 0 "[ . 1 . ]" 1
1650 1 73 TRP HA 1 73 TRP HD1 3.350 . 3.850 3.339 3.310 3.387 . 0 0 "[ . 1 . ]" 1
1651 1 73 TRP HA 1 74 LEU HA 5.010 . 5.510 4.719 4.687 4.754 . 0 0 "[ . 1 . ]" 1
1652 1 73 TRP HA 1 76 ARG HB3 5.500 . 6.000 4.674 4.372 5.018 . 0 0 "[ . 1 . ]" 1
1653 1 73 TRP HA 1 76 ARG QG 4.400 . 4.900 3.027 2.356 3.721 . 0 0 "[ . 1 . ]" 1
1654 1 73 TRP HB2 1 74 LEU H 4.540 . 5.040 4.105 4.065 4.158 . 0 0 "[ . 1 . ]" 1
1655 1 73 TRP HB3 1 73 TRP HZ3 5.500 . 6.000 5.103 5.079 5.118 . 0 0 "[ . 1 . ]" 1
1656 1 73 TRP HB3 1 74 LEU H 4.290 . 4.790 2.891 2.809 2.985 . 0 0 "[ . 1 . ]" 1
1657 1 73 TRP HD1 1 77 ILE MD 6.000 . 6.500 5.011 4.866 5.075 . 0 0 "[ . 1 . ]" 1
1658 1 73 TRP HE1 1 77 ILE MD 5.960 . 6.460 4.150 3.974 4.257 . 0 0 "[ . 1 . ]" 1
1659 1 73 TRP HE3 1 74 LEU H 3.570 . 4.070 3.129 3.007 3.191 . 0 0 "[ . 1 . ]" 1
1660 1 73 TRP HE3 1 74 LEU HA 4.230 . 4.730 2.789 2.728 2.837 . 0 0 "[ . 1 . ]" 1
1661 1 73 TRP HE3 1 74 LEU HB2 4.300 . 4.800 2.602 2.557 2.646 . 0 0 "[ . 1 . ]" 1
1662 1 73 TRP HE3 1 74 LEU HB3 4.000 . 4.500 4.054 4.035 4.081 . 0 0 "[ . 1 . ]" 1
1663 1 73 TRP HH2 1 74 LEU MD1 5.490 . 5.990 4.393 4.310 4.534 . 0 0 "[ . 1 . ]" 1
1664 1 73 TRP HH2 1 77 ILE HG12 4.980 . 5.480 5.076 5.020 5.119 . 0 0 "[ . 1 . ]" 1
1665 1 73 TRP HH2 1 77 ILE MD 4.490 . 4.990 3.804 3.782 3.838 . 0 0 "[ . 1 . ]" 1
1666 1 73 TRP HZ2 1 77 ILE MD 4.280 . 4.780 3.494 3.379 3.567 . 0 0 "[ . 1 . ]" 1
1667 1 73 TRP HZ3 1 74 LEU HA 4.600 . 5.100 3.566 3.485 3.631 . 0 0 "[ . 1 . ]" 1
1668 1 73 TRP HZ3 1 74 LEU MD1 4.530 . 5.030 2.639 2.536 2.756 . 0 0 "[ . 1 . ]" 1
1669 1 73 TRP HZ3 1 77 ILE MD 5.200 . 5.700 4.333 4.275 4.359 . 0 0 "[ . 1 . ]" 1
1670 1 74 LEU H 1 74 LEU HB2 3.460 . 3.960 2.625 2.559 2.682 . 0 0 "[ . 1 . ]" 1
1671 1 74 LEU H 1 74 LEU HB3 3.310 . 3.810 2.393 2.378 2.417 . 0 0 "[ . 1 . ]" 1
1672 1 74 LEU H 1 74 LEU HG 5.500 . 6.000 4.386 4.366 4.414 . 0 0 "[ . 1 . ]" 1
1673 1 74 LEU H 1 75 TYR H 3.630 . 4.130 2.450 2.386 2.531 . 0 0 "[ . 1 . ]" 1
1674 1 74 LEU H 1 76 ARG H 4.940 . 5.440 3.970 3.894 4.037 . 0 0 "[ . 1 . ]" 1
1675 1 74 LEU H 1 77 ILE MD 6.610 . 7.110 5.560 5.511 5.594 . 0 0 "[ . 1 . ]" 1
1676 1 74 LEU HA 1 74 LEU MD1 3.920 . 4.420 2.053 2.032 2.079 . 0 0 "[ . 1 . ]" 1
1677 1 74 LEU HA 1 77 ILE H 4.290 . 4.790 3.263 3.205 3.318 . 0 0 "[ . 1 . ]" 1
1678 1 74 LEU HA 1 77 ILE HB 3.760 . 4.260 3.419 3.346 3.473 . 0 0 "[ . 1 . ]" 1
1679 1 74 LEU HA 1 77 ILE HG12 5.500 . 6.000 2.268 2.229 2.303 . 0 0 "[ . 1 . ]" 1
1680 1 74 LEU HA 1 77 ILE MD 5.060 . 5.560 3.814 3.762 3.857 . 0 0 "[ . 1 . ]" 1
1681 1 74 LEU HA 1 77 ILE MG 6.430 . 6.930 4.475 4.420 4.535 . 0 0 "[ . 1 . ]" 1
1682 1 74 LEU HA 1 78 ALA H 5.040 . 5.540 4.783 4.654 4.838 . 0 0 "[ . 1 . ]" 1
1683 1 74 LEU HA 1 78 ALA MB 6.610 . 7.110 5.371 5.261 5.468 . 0 0 "[ . 1 . ]" 1
1684 1 74 LEU HB2 1 75 TYR H 3.920 . 4.420 4.011 3.998 4.025 . 0 0 "[ . 1 . ]" 1
1685 1 74 LEU HB3 1 75 TYR H 4.680 . 5.180 2.754 2.721 2.790 . 0 0 "[ . 1 . ]" 1
1686 1 74 LEU HG 1 75 TYR H 5.500 . 6.000 3.883 3.811 3.972 . 0 0 "[ . 1 . ]" 1
1687 1 74 LEU HG 1 75 TYR QD 5.780 . 6.280 3.447 3.314 3.585 . 0 0 "[ . 1 . ]" 1
1688 1 74 LEU MD1 1 75 TYR HA 6.230 . 6.730 4.770 4.689 4.856 . 0 0 "[ . 1 . ]" 1
1689 1 74 LEU MD1 1 76 ARG H 6.610 . 7.110 5.201 5.095 5.304 . 0 0 "[ . 1 . ]" 1
1690 1 74 LEU MD1 1 77 ILE H 4.830 . 5.330 3.960 3.885 4.035 . 0 0 "[ . 1 . ]" 1
1691 1 74 LEU MD1 1 77 ILE HB 4.830 . 5.330 2.679 2.601 2.737 . 0 0 "[ . 1 . ]" 1
1692 1 74 LEU MD1 1 77 ILE MD 6.940 . 7.440 4.043 3.999 4.112 . 0 0 "[ . 1 . ]" 1
1693 1 74 LEU MD1 1 78 ALA H 6.290 . 6.790 4.374 4.257 4.477 . 0 0 "[ . 1 . ]" 1
1694 1 74 LEU MD1 1 78 ALA MB 6.740 . 7.240 4.185 4.044 4.276 . 0 0 "[ . 1 . ]" 1
1695 1 74 LEU MD2 1 75 TYR H 6.610 . 7.110 4.442 4.365 4.528 . 0 0 "[ . 1 . ]" 1
1696 1 74 LEU MD2 1 75 TYR QE 5.240 . 5.740 3.744 3.471 3.904 . 0 0 "[ . 1 . ]" 1
1697 1 75 TYR H 1 75 TYR HB2 3.500 . 4.000 2.432 2.395 2.497 . 0 0 "[ . 1 . ]" 1
1698 1 75 TYR H 1 75 TYR HB3 4.030 . 4.530 3.589 3.583 3.594 . 0 0 "[ . 1 . ]" 1
1699 1 75 TYR H 1 75 TYR QD 3.950 . 4.450 3.042 2.747 3.315 . 0 0 "[ . 1 . ]" 1
1700 1 75 TYR H 1 75 TYR QE 5.260 . 5.760 4.608 4.475 4.744 . 0 0 "[ . 1 . ]" 1
1701 1 75 TYR H 1 76 ARG H 3.690 . 4.190 2.675 2.636 2.740 . 0 0 "[ . 1 . ]" 1
1702 1 75 TYR H 1 76 ARG QG 5.470 . 5.970 4.142 3.849 4.295 . 0 0 "[ . 1 . ]" 1
1703 1 75 TYR H 1 77 ILE H 5.380 . 5.880 4.133 4.061 4.191 . 0 0 "[ . 1 . ]" 1
1704 1 75 TYR HA 1 75 TYR QD 3.090 . 3.590 2.046 1.916 2.181 . 0 0 "[ . 1 . ]" 1
1705 1 75 TYR HA 1 77 ILE H 5.220 . 5.720 3.985 3.810 4.136 . 0 0 "[ . 1 . ]" 1
1706 1 75 TYR HA 1 78 ALA H 4.100 . 4.600 3.311 3.017 3.593 . 0 0 "[ . 1 . ]" 1
1707 1 75 TYR HA 1 78 ALA MB 4.380 . 4.880 2.917 2.603 3.204 . 0 0 "[ . 1 . ]" 1
1708 1 75 TYR HB2 1 76 ARG H 4.030 . 4.530 3.017 2.802 3.212 . 0 0 "[ . 1 . ]" 1
1709 1 75 TYR HB3 1 76 ARG H 4.110 . 4.610 3.924 3.744 4.051 . 0 0 "[ . 1 . ]" 1
1710 1 75 TYR HB3 1 77 ILE H 5.500 . 6.000 5.478 5.433 5.514 . 0 0 "[ . 1 . ]" 1
1711 1 75 TYR QD 1 76 ARG H 5.300 . 5.800 4.633 4.538 4.758 . 0 0 "[ . 1 . ]" 1
1712 1 75 TYR QD 1 78 ALA H 6.170 . 6.670 4.982 4.531 5.362 . 0 0 "[ . 1 . ]" 1
1713 1 75 TYR QD 1 78 ALA MB 6.580 . 7.080 3.895 3.236 4.486 . 0 0 "[ . 1 . ]" 1
1714 1 76 ARG H 1 76 ARG QD 5.510 . 6.010 3.868 3.657 4.352 . 0 0 "[ . 1 . ]" 1
1715 1 76 ARG H 1 76 ARG QG 3.570 . 4.070 2.212 1.897 2.400 . 0 0 "[ . 1 . ]" 1
1716 1 76 ARG H 1 77 ILE H 3.710 . 4.210 2.541 2.479 2.612 . 0 0 "[ . 1 . ]" 1
1717 1 76 ARG H 1 77 ILE HB 5.500 . 6.000 5.010 4.939 5.085 . 0 0 "[ . 1 . ]" 1
1718 1 76 ARG H 1 77 ILE MD 6.610 . 7.110 4.592 4.417 4.732 . 0 0 "[ . 1 . ]" 1
1719 1 76 ARG H 1 78 ALA H 5.500 . 6.000 4.148 3.998 4.270 . 0 0 "[ . 1 . ]" 1
1720 1 76 ARG HA 1 76 ARG QD 4.800 . 5.300 3.540 2.004 4.420 . 0 0 "[ . 1 . ]" 1
1721 1 76 ARG HA 1 77 ILE HA 5.390 . 5.890 4.748 4.729 4.767 . 0 0 "[ . 1 . ]" 1
1722 1 76 ARG HA 1 79 VAL H 4.140 . 4.640 3.431 3.296 3.550 . 0 0 "[ . 1 . ]" 1
1723 1 76 ARG HA 1 79 VAL MG1 5.200 . 5.700 2.072 1.961 2.175 . 0 0 "[ . 1 . ]" 1
1724 1 76 ARG HA 1 79 VAL MG2 5.720 . 6.220 4.741 4.630 4.836 . 0 0 "[ . 1 . ]" 1
1725 1 76 ARG HA 1 80 ASN H 4.750 . 5.250 3.952 3.748 4.115 . 0 0 "[ . 1 . ]" 1
1726 1 76 ARG HA 1 80 ASN HD21 5.500 . 6.000 5.039 3.388 5.375 . 0 0 "[ . 1 . ]" 1
1727 1 76 ARG HB2 1 80 ASN HD22 5.330 . 5.830 4.221 2.944 5.206 . 0 0 "[ . 1 . ]" 1
1728 1 76 ARG HB2 1 80 ASN HD21 5.460 . 5.960 4.572 3.053 5.357 . 0 0 "[ . 1 . ]" 1
1729 1 76 ARG HB3 1 77 ILE H 5.500 . 6.000 4.091 3.884 4.346 . 0 0 "[ . 1 . ]" 1
1730 1 76 ARG HB3 1 80 ASN HD22 5.460 . 5.960 4.030 3.299 4.933 . 0 0 "[ . 1 . ]" 1
1731 1 76 ARG HB3 1 80 ASN HD21 5.370 . 5.870 4.605 3.871 5.544 . 0 0 "[ . 1 . ]" 1
1732 1 76 ARG QD 1 80 ASN HD22 6.170 . 6.670 4.177 3.658 5.269 . 0 0 "[ . 1 . ]" 1
1733 1 76 ARG QD 1 80 ASN HD21 6.170 . 6.670 4.935 4.169 5.526 . 0 0 "[ . 1 . ]" 1
1734 1 76 ARG QG 1 77 ILE H 4.640 . 5.140 3.533 2.540 4.280 . 0 0 "[ . 1 . ]" 1
1735 1 76 ARG QG 1 77 ILE HG12 6.110 . 6.610 4.322 2.965 5.454 . 0 0 "[ . 1 . ]" 1
1736 1 76 ARG QG 1 77 ILE MD 6.610 . 7.110 3.900 2.497 5.039 . 0 0 "[ . 1 . ]" 1
1737 1 77 ILE H 1 77 ILE HB 3.320 . 3.820 2.645 2.618 2.677 . 0 0 "[ . 1 . ]" 1
1738 1 77 ILE H 1 77 ILE HG12 3.740 . 4.240 2.091 2.055 2.120 . 0 0 "[ . 1 . ]" 1
1739 1 77 ILE H 1 77 ILE HG13 4.240 . 4.740 3.615 3.590 3.631 . 0 0 "[ . 1 . ]" 1
1740 1 77 ILE H 1 77 ILE MD 5.200 . 5.700 3.041 2.927 3.142 . 0 0 "[ . 1 . ]" 1
1741 1 77 ILE H 1 78 ALA H 3.410 . 3.910 2.534 2.481 2.577 . 0 0 "[ . 1 . ]" 1
1742 1 77 ILE H 1 78 ALA MB 6.050 . 6.550 4.196 4.131 4.242 . 0 0 "[ . 1 . ]" 1
1743 1 77 ILE H 1 79 VAL H 5.320 . 5.820 4.289 4.210 4.381 . 0 0 "[ . 1 . ]" 1
1744 1 77 ILE HA 1 77 ILE HG12 3.830 . 4.330 3.323 3.271 3.382 . 0 0 "[ . 1 . ]" 1
1745 1 77 ILE HA 1 77 ILE HG13 3.820 . 4.320 3.846 3.826 3.873 . 0 0 "[ . 1 . ]" 1
1746 1 77 ILE HA 1 78 ALA HA 4.670 . 5.170 4.733 4.709 4.764 . 0 0 "[ . 1 . ]" 1
1747 1 77 ILE HA 1 79 VAL H 5.350 . 5.850 4.660 4.579 4.745 . 0 0 "[ . 1 . ]" 1
1748 1 77 ILE HA 1 80 ASN H 4.600 . 5.100 3.857 3.686 3.996 . 0 0 "[ . 1 . ]" 1
1749 1 77 ILE HA 1 80 ASN HB2 3.960 . 4.460 3.129 2.889 3.315 . 0 0 "[ . 1 . ]" 1
1750 1 77 ILE HA 1 80 ASN HD22 5.500 . 6.000 5.286 5.040 5.464 . 0 0 "[ . 1 . ]" 1
1751 1 77 ILE HA 1 81 THR H 5.500 . 6.000 4.375 4.270 4.534 . 0 0 "[ . 1 . ]" 1
1752 1 77 ILE HB 1 78 ALA H 3.630 . 4.130 2.761 2.674 2.856 . 0 0 "[ . 1 . ]" 1
1753 1 77 ILE HG12 1 78 ALA H 5.350 . 5.850 4.095 4.030 4.141 . 0 0 "[ . 1 . ]" 1
1754 1 77 ILE HG12 1 78 ALA MB 6.610 . 7.110 5.322 5.244 5.373 . 0 0 "[ . 1 . ]" 1
1755 1 77 ILE HG13 1 78 ALA H 5.450 . 5.950 4.981 4.888 5.045 . 0 0 "[ . 1 . ]" 1
1756 1 77 ILE MD 1 78 ALA H 6.570 . 7.070 4.638 4.575 4.697 . 0 0 "[ . 1 . ]" 1
1757 1 77 ILE MG 1 78 ALA H 4.980 . 5.480 3.757 3.692 3.860 . 0 0 "[ . 1 . ]" 1
1758 1 77 ILE MG 1 78 ALA HA 5.630 . 6.130 3.604 3.518 3.738 . 0 0 "[ . 1 . ]" 1
1759 1 77 ILE MG 1 80 ASN HB2 6.610 . 7.110 4.371 4.060 4.575 . 0 0 "[ . 1 . ]" 1
1760 1 77 ILE MG 1 81 THR H 6.550 . 7.050 4.397 4.266 4.493 . 0 0 "[ . 1 . ]" 1
1761 1 77 ILE MG 1 81 THR HB 6.550 . 7.050 4.197 4.100 4.362 . 0 0 "[ . 1 . ]" 1
1762 1 77 ILE MG 1 81 THR MG 7.430 . 7.930 4.206 4.055 4.327 . 0 0 "[ . 1 . ]" 1
1763 1 78 ALA H 1 79 VAL H 3.630 . 4.130 2.639 2.604 2.716 . 0 0 "[ . 1 . ]" 1
1764 1 78 ALA H 1 79 VAL HA 5.320 . 5.820 5.256 5.230 5.309 . 0 0 "[ . 1 . ]" 1
1765 1 78 ALA H 1 79 VAL HB 5.500 . 6.000 5.108 5.060 5.187 . 0 0 "[ . 1 . ]" 1
1766 1 78 ALA H 1 79 VAL MG1 6.610 . 7.110 3.819 3.773 3.914 . 0 0 "[ . 1 . ]" 1
1767 1 78 ALA H 1 80 ASN H 5.310 . 5.810 4.058 3.993 4.142 . 0 0 "[ . 1 . ]" 1
1768 1 78 ALA H 1 81 THR HB 5.300 . 5.800 5.333 5.310 5.361 . 0 0 "[ . 1 . ]" 1
1769 1 78 ALA HA 1 81 THR H 4.500 . 5.000 3.545 3.307 3.650 . 0 0 "[ . 1 . ]" 1
1770 1 78 ALA HA 1 81 THR HB 3.580 . 4.080 2.894 2.715 3.000 . 0 0 "[ . 1 . ]" 1
1771 1 78 ALA HA 1 81 THR MG 5.340 . 5.840 4.225 4.034 4.321 . 0 0 "[ . 1 . ]" 1
1772 1 78 ALA HA 1 82 ALA H 4.660 . 5.160 4.453 4.328 4.538 . 0 0 "[ . 1 . ]" 1
1773 1 78 ALA HA 1 82 ALA MB 6.610 . 7.110 4.809 4.692 4.959 . 0 0 "[ . 1 . ]" 1
1774 1 78 ALA MB 1 79 VAL H 4.520 . 5.020 2.678 2.607 2.752 . 0 0 "[ . 1 . ]" 1
1775 1 78 ALA MB 1 79 VAL HA 5.670 . 6.170 3.896 3.862 3.932 . 0 0 "[ . 1 . ]" 1
1776 1 78 ALA MB 1 79 VAL HB 6.300 . 6.800 3.954 3.879 4.106 . 0 0 "[ . 1 . ]" 1
1777 1 78 ALA MB 1 80 ASN H 6.610 . 7.110 4.541 4.489 4.600 . 0 0 "[ . 1 . ]" 1
1778 1 78 ALA MB 1 81 THR HB 6.450 . 6.950 4.346 4.094 4.464 . 0 0 "[ . 1 . ]" 1
1779 1 78 ALA MB 1 82 ALA MB 6.590 . 7.090 4.411 4.305 4.553 . 0 0 "[ . 1 . ]" 1
1780 1 79 VAL H 1 79 VAL HB 3.230 . 3.730 2.673 2.660 2.686 . 0 0 "[ . 1 . ]" 1
1781 1 79 VAL H 1 79 VAL MG1 4.020 . 4.520 1.921 1.882 1.975 . 0 0 "[ . 1 . ]" 1
1782 1 79 VAL H 1 80 ASN H 3.640 . 4.140 2.501 2.449 2.549 . 0 0 "[ . 1 . ]" 1
1783 1 79 VAL H 1 81 THR HB 5.500 . 6.000 5.254 5.198 5.299 . 0 0 "[ . 1 . ]" 1
1784 1 79 VAL HA 1 81 THR H 5.500 . 6.000 4.012 3.951 4.106 . 0 0 "[ . 1 . ]" 1
1785 1 79 VAL HA 1 82 ALA H 4.100 . 4.600 3.217 3.091 3.326 . 0 0 "[ . 1 . ]" 1
1786 1 79 VAL HA 1 82 ALA MB 4.230 . 4.730 2.672 2.534 2.798 . 0 0 "[ . 1 . ]" 1
1787 1 79 VAL HA 1 83 LYS H 5.280 . 5.780 4.333 4.209 4.488 . 0 0 "[ . 1 . ]" 1
1788 1 79 VAL HA 1 83 LYS QD 6.170 . 6.670 5.185 5.025 5.353 . 0 0 "[ . 1 . ]" 1
1789 1 79 VAL HB 1 80 ASN H 4.090 . 4.590 4.154 4.144 4.164 . 0 0 "[ . 1 . ]" 1
1790 1 79 VAL MG1 1 80 ASN H 5.730 . 6.230 2.395 2.363 2.455 . 0 0 "[ . 1 . ]" 1
1791 1 79 VAL MG1 1 80 ASN HA 6.610 . 7.110 3.533 3.483 3.608 . 0 0 "[ . 1 . ]" 1
1792 1 79 VAL MG1 1 80 ASN HD21 6.610 . 7.110 4.518 2.511 4.799 . 0 0 "[ . 1 . ]" 1
1793 1 79 VAL MG1 1 83 LYS HE2 6.610 . 7.110 4.770 4.291 5.377 . 0 0 "[ . 1 . ]" 1
1794 1 79 VAL MG1 1 83 LYS QD 7.370 . 7.870 4.110 3.985 4.251 . 0 0 "[ . 1 . ]" 1
1795 1 79 VAL MG2 1 80 ASN H 5.480 . 5.980 3.770 3.721 3.855 . 0 0 "[ . 1 . ]" 1
1796 1 79 VAL MG2 1 80 ASN HA 5.670 . 6.170 3.732 3.653 3.840 . 0 0 "[ . 1 . ]" 1
1797 1 79 VAL MG2 1 80 ASN HB2 6.610 . 7.110 5.390 5.226 5.532 . 0 0 "[ . 1 . ]" 1
1798 1 79 VAL MG2 1 81 THR H 6.610 . 7.110 4.971 4.909 5.024 . 0 0 "[ . 1 . ]" 1
1799 1 79 VAL MG2 1 83 LYS H 6.470 . 6.970 4.238 4.106 4.351 . 0 0 "[ . 1 . ]" 1
1800 1 79 VAL MG2 1 83 LYS HE2 5.090 . 5.590 2.747 2.202 3.465 . 0 0 "[ . 1 . ]" 1
1801 1 79 VAL MG2 1 83 LYS HE3 4.840 . 5.340 2.649 1.933 3.289 . 0 0 "[ . 1 . ]" 1
1802 1 79 VAL MG2 1 83 LYS HG2 6.360 . 6.860 4.291 4.215 4.397 . 0 0 "[ . 1 . ]" 1
1803 1 79 VAL MG2 1 83 LYS HG3 6.510 . 7.010 3.157 3.043 3.247 . 0 0 "[ . 1 . ]" 1
1804 1 79 VAL MG2 1 83 LYS QD 5.550 . 6.050 2.970 2.769 3.188 . 0 0 "[ . 1 . ]" 1
1805 1 80 ASN H 1 80 ASN HB2 3.440 . 3.940 2.366 2.295 2.388 . 0 0 "[ . 1 . ]" 1
1806 1 80 ASN H 1 80 ASN HD22 4.680 . 5.180 4.598 3.964 4.687 . 0 0 "[ . 1 . ]" 1
1807 1 80 ASN H 1 80 ASN HD21 4.730 . 5.230 4.194 2.552 4.358 . 0 0 "[ . 1 . ]" 1
1808 1 80 ASN H 1 81 THR H 3.760 . 4.260 2.487 2.471 2.511 . 0 0 "[ . 1 . ]" 1
1809 1 80 ASN H 1 83 LYS QD 6.170 . 6.670 5.131 4.872 5.326 . 0 0 "[ . 1 . ]" 1
1810 1 80 ASN HA 1 81 THR HA 4.870 . 5.370 4.710 4.689 4.738 . 0 0 "[ . 1 . ]" 1
1811 1 80 ASN HA 1 83 LYS HE2 5.500 . 6.000 5.307 4.974 5.622 . 0 0 "[ . 1 . ]" 1
1812 1 80 ASN HA 1 83 LYS HE3 5.500 . 6.000 5.043 4.376 5.515 . 0 0 "[ . 1 . ]" 1
1813 1 80 ASN HA 1 83 LYS QD 5.080 . 5.580 3.040 2.684 3.282 . 0 0 "[ . 1 . ]" 1
1814 1 80 ASN HB2 1 81 THR H 4.030 . 4.530 3.114 3.059 3.288 . 0 0 "[ . 1 . ]" 1
1815 1 80 ASN HB2 1 82 ALA H 5.500 . 6.000 5.225 5.174 5.348 . 0 0 "[ . 1 . ]" 1
1816 1 80 ASN HB3 1 81 THR HA 4.890 . 5.390 4.558 4.510 4.631 . 0 0 "[ . 1 . ]" 1
1817 1 80 ASN HB3 1 83 LYS HB2 5.500 . 6.000 4.839 4.514 5.050 . 0 0 "[ . 1 . ]" 1
1818 1 80 ASN HB3 1 83 LYS QD 6.090 . 6.590 5.138 4.737 5.431 . 0 0 "[ . 1 . ]" 1
1819 1 81 THR H 1 81 THR HB 3.480 . 3.980 2.451 2.414 2.510 . 0 0 "[ . 1 . ]" 1
1820 1 81 THR H 1 82 ALA MB 6.500 . 7.000 4.104 4.080 4.136 . 0 0 "[ . 1 . ]" 1
1821 1 81 THR HA 1 84 ASN H 4.190 . 4.690 3.290 3.127 3.406 . 0 0 "[ . 1 . ]" 1
1822 1 81 THR HA 1 84 ASN HD22 5.020 . 5.520 5.182 4.075 5.639 0.119 10 0 "[ . 1 . ]" 1
1823 1 81 THR HA 1 84 ASN HD21 5.500 . 6.000 4.104 3.524 5.235 . 0 0 "[ . 1 . ]" 1
1824 1 81 THR HA 1 84 ASN QB 4.120 . 4.620 2.651 1.969 3.754 . 0 0 "[ . 1 . ]" 1
1825 1 81 THR HB 1 82 ALA H 3.500 . 4.000 2.979 2.867 3.056 . 0 0 "[ . 1 . ]" 1
1826 1 81 THR HB 1 82 ALA HA 4.680 . 5.180 4.455 4.331 4.520 . 0 0 "[ . 1 . ]" 1
1827 1 81 THR HB 1 82 ALA MB 6.320 . 6.820 4.106 4.002 4.192 . 0 0 "[ . 1 . ]" 1
1828 1 81 THR MG 1 82 ALA H 5.140 . 5.640 3.760 3.718 3.853 . 0 0 "[ . 1 . ]" 1
1829 1 81 THR MG 1 82 ALA HA 5.840 . 6.340 3.686 3.624 3.789 . 0 0 "[ . 1 . ]" 1
1830 1 81 THR MG 1 84 ASN QB 7.370 . 7.870 3.733 3.170 4.857 . 0 0 "[ . 1 . ]" 1
1831 1 81 THR MG 1 85 TYR HB3 6.610 . 7.110 4.388 4.234 4.620 . 0 0 "[ . 1 . ]" 1
1832 1 81 THR MG 1 85 TYR QD 6.280 . 6.780 4.005 3.927 4.103 . 0 0 "[ . 1 . ]" 1
1833 1 81 THR MG 1 85 TYR QE 7.410 . 7.910 5.533 5.501 5.559 . 0 0 "[ . 1 . ]" 1
1834 1 82 ALA H 1 83 LYS H 3.430 . 3.930 2.532 2.500 2.579 . 0 0 "[ . 1 . ]" 1
1835 1 82 ALA H 1 84 ASN H 4.460 . 4.960 3.899 3.719 4.085 . 0 0 "[ . 1 . ]" 1
1836 1 82 ALA H 1 85 TYR H 4.500 . 5.000 4.571 4.525 4.693 . 0 0 "[ . 1 . ]" 1
1837 1 82 ALA HA 1 85 TYR H 4.130 . 4.630 3.252 3.138 3.373 . 0 0 "[ . 1 . ]" 1
1838 1 82 ALA HA 1 85 TYR HB3 3.730 . 4.230 2.570 2.531 2.627 . 0 0 "[ . 1 . ]" 1
1839 1 82 ALA HA 1 85 TYR QD 4.740 . 5.240 4.179 4.036 4.258 . 0 0 "[ . 1 . ]" 1
1840 1 82 ALA HA 1 86 LEU H 4.250 . 4.750 4.310 4.276 4.349 . 0 0 "[ . 1 . ]" 1
1841 1 82 ALA MB 1 83 LYS H 4.560 . 5.060 2.692 2.606 2.775 . 0 0 "[ . 1 . ]" 1
1842 1 82 ALA MB 1 83 LYS HB3 6.580 . 7.080 5.308 5.243 5.350 . 0 0 "[ . 1 . ]" 1
1843 1 82 ALA MB 1 83 LYS HG3 4.700 . 5.200 3.147 3.045 3.228 . 0 0 "[ . 1 . ]" 1
1844 1 82 ALA MB 1 84 ASN H 6.610 . 7.110 4.466 4.352 4.616 . 0 0 "[ . 1 . ]" 1
1845 1 82 ALA MB 1 85 TYR QD 6.560 . 7.060 4.861 4.749 4.934 . 0 0 "[ . 1 . ]" 1
1846 1 82 ALA MB 1 86 LEU MD1 7.660 . 8.160 3.994 3.746 4.213 . 0 0 "[ . 1 . ]" 1
1847 1 83 LYS H 1 83 LYS HB2 3.550 . 4.050 2.350 2.322 2.397 . 0 0 "[ . 1 . ]" 1
1848 1 83 LYS H 1 83 LYS HB3 4.190 . 4.690 3.580 3.572 3.588 . 0 0 "[ . 1 . ]" 1
1849 1 83 LYS H 1 83 LYS HG2 4.450 . 4.950 3.660 3.534 3.761 . 0 0 "[ . 1 . ]" 1
1850 1 83 LYS H 1 83 LYS HG3 4.360 . 4.860 2.402 2.234 2.540 . 0 0 "[ . 1 . ]" 1
1851 1 83 LYS H 1 83 LYS QD 5.340 . 5.840 3.716 3.663 3.775 . 0 0 "[ . 1 . ]" 1
1852 1 83 LYS H 1 84 ASN H 3.910 . 4.410 2.465 2.421 2.543 . 0 0 "[ . 1 . ]" 1
1853 1 83 LYS HB2 1 84 ASN H 4.100 . 4.600 2.959 2.872 3.071 . 0 0 "[ . 1 . ]" 1
1854 1 83 LYS HB2 1 84 ASN QB 6.140 . 6.640 4.188 4.068 4.275 . 0 0 "[ . 1 . ]" 1
1855 1 83 LYS HB3 1 84 ASN QB 6.170 . 6.670 4.927 4.803 5.039 . 0 0 "[ . 1 . ]" 1
1856 1 84 ASN HA 1 87 VAL H 5.080 . 5.580 3.442 3.231 3.659 . 0 0 "[ . 1 . ]" 1
1857 1 84 ASN HA 1 87 VAL MG1 5.100 . 5.600 3.072 1.890 3.948 . 0 0 "[ . 1 . ]" 1
1858 1 84 ASN HA 1 87 VAL MG2 5.380 . 5.880 2.961 2.000 4.498 . 0 0 "[ . 1 . ]" 1
1859 1 84 ASN HA 1 88 ALA H 5.060 . 5.560 4.247 4.016 4.472 . 0 0 "[ . 1 . ]" 1
1860 1 84 ASN HD22 1 85 TYR HA 5.500 . 6.000 4.869 3.660 5.917 . 0 0 "[ . 1 . ]" 1
1861 1 84 ASN QB 1 85 TYR H 4.430 . 4.930 3.115 2.823 3.811 . 0 0 "[ . 1 . ]" 1
1862 1 84 ASN QB 1 87 VAL MG1 7.410 . 7.910 4.552 3.125 5.374 . 0 0 "[ . 1 . ]" 1
1863 1 84 ASN QB 1 87 VAL MG2 7.390 . 7.890 4.460 3.737 5.642 . 0 0 "[ . 1 . ]" 1
1864 1 85 TYR H 1 85 TYR HB2 3.370 . 3.870 2.514 2.479 2.562 . 0 0 "[ . 1 . ]" 1
1865 1 85 TYR H 1 85 TYR QD 5.050 . 5.550 4.164 4.141 4.182 . 0 0 "[ . 1 . ]" 1
1866 1 85 TYR H 1 86 LEU HA 5.390 . 5.890 5.179 5.111 5.244 . 0 0 "[ . 1 . ]" 1
1867 1 85 TYR H 1 86 LEU HB2 5.500 . 6.000 4.693 4.574 4.801 . 0 0 "[ . 1 . ]" 1
1868 1 85 TYR HA 1 85 TYR QD 3.730 . 4.230 2.818 2.710 2.955 . 0 0 "[ . 1 . ]" 1
1869 1 85 TYR HA 1 88 ALA MB 5.130 . 5.630 2.796 2.490 3.008 . 0 0 "[ . 1 . ]" 1
1870 1 85 TYR HB2 1 86 LEU H 3.900 . 4.400 3.947 3.921 3.975 . 0 0 "[ . 1 . ]" 1
1871 1 85 TYR HB3 1 86 LEU HB3 5.650 . 6.150 5.688 5.641 5.740 . 0 0 "[ . 1 . ]" 1
1872 1 85 TYR QD 1 86 LEU H 4.150 . 4.650 3.683 3.554 3.739 . 0 0 "[ . 1 . ]" 1
1873 1 85 TYR QD 1 86 LEU HA 4.320 . 4.820 3.539 3.312 3.710 . 0 0 "[ . 1 . ]" 1
1874 1 85 TYR QD 1 86 LEU HG 6.120 . 6.620 3.033 2.743 3.565 . 0 0 "[ . 1 . ]" 1
1875 1 85 TYR QD 1 86 LEU MD1 7.410 . 7.910 4.356 4.080 4.830 . 0 0 "[ . 1 . ]" 1
1876 1 85 TYR QD 1 86 LEU MD2 6.500 . 7.000 2.503 2.330 2.641 . 0 0 "[ . 1 . ]" 1
1877 1 85 TYR QD 1 88 ALA MB 7.410 . 7.910 4.348 3.993 4.560 . 0 0 "[ . 1 . ]" 1
1878 1 85 TYR QD 1 89 GLN HE22 3.730 . 4.230 3.477 2.987 4.481 0.251 4 0 "[ . 1 . ]" 1
1879 1 85 TYR QE 1 86 LEU MD2 7.350 . 7.850 3.459 3.096 3.843 . 0 0 "[ . 1 . ]" 1
1880 1 85 TYR QE 1 88 ALA MB 7.410 . 7.910 5.266 4.718 5.542 . 0 0 "[ . 1 . ]" 1
1881 1 85 TYR QE 1 89 GLN QG 6.190 . 6.690 4.493 3.594 4.964 . 0 0 "[ . 1 . ]" 1
1882 1 86 LEU H 1 86 LEU HB2 3.390 . 3.890 2.383 2.350 2.408 . 0 0 "[ . 1 . ]" 1
1883 1 86 LEU H 1 86 LEU HB3 4.140 . 4.640 3.597 3.584 3.609 . 0 0 "[ . 1 . ]" 1
1884 1 86 LEU H 1 86 LEU HG 4.580 . 5.080 2.518 2.409 2.591 . 0 0 "[ . 1 . ]" 1
1885 1 86 LEU H 1 86 LEU MD2 5.120 . 5.620 3.531 3.472 3.606 . 0 0 "[ . 1 . ]" 1
1886 1 86 LEU H 1 88 ALA H 4.030 . 4.530 3.963 3.908 4.023 . 0 0 "[ . 1 . ]" 1
1887 1 86 LEU HA 1 86 LEU MD2 4.550 . 5.050 1.978 1.950 2.002 . 0 0 "[ . 1 . ]" 1
1888 1 86 LEU HA 1 87 VAL MG1 6.610 . 7.110 4.999 4.810 5.293 . 0 0 "[ . 1 . ]" 1
1889 1 86 LEU HB2 1 87 VAL H 4.500 . 5.000 3.107 2.960 3.268 . 0 0 "[ . 1 . ]" 1
1890 1 86 LEU HB2 1 87 VAL HA 5.800 . 6.300 4.637 4.535 4.749 . 0 0 "[ . 1 . ]" 1
1891 1 86 LEU HB2 1 87 VAL MG1 5.960 . 6.460 3.971 3.233 4.986 . 0 0 "[ . 1 . ]" 1
1892 1 86 LEU HB3 1 87 VAL H 5.030 . 5.530 3.956 3.848 4.066 . 0 0 "[ . 1 . ]" 1
1893 1 86 LEU HB3 1 88 ALA H 5.500 . 6.000 5.524 5.347 5.584 . 0 0 "[ . 1 . ]" 1
1894 1 86 LEU MD2 1 89 GLN HE21 6.610 . 7.110 4.055 3.017 5.785 . 0 0 "[ . 1 . ]" 1
1895 1 86 LEU MD2 1 89 GLN QG 7.240 . 7.740 4.501 2.866 5.385 . 0 0 "[ . 1 . ]" 1
1896 1 87 VAL H 1 87 VAL HB 3.880 . 4.380 3.218 2.438 3.690 . 0 0 "[ . 1 . ]" 1
1897 1 87 VAL H 1 88 ALA H 3.640 . 4.140 2.375 2.292 2.502 . 0 0 "[ . 1 . ]" 1
1898 1 87 VAL H 1 90 GLY H 5.500 . 6.000 4.490 4.336 4.736 . 0 0 "[ . 1 . ]" 1
1899 1 87 VAL HA 1 90 GLY QA 4.940 . 5.440 3.166 2.856 3.598 . 0 0 "[ . 1 . ]" 1
1900 1 87 VAL HA 1 91 ARG QD 5.490 . 5.990 4.395 3.352 4.943 . 0 0 "[ . 1 . ]" 1
1901 1 87 VAL HB 1 88 ALA H 4.030 . 4.530 4.069 3.977 4.127 . 0 0 "[ . 1 . ]" 1
1902 1 87 VAL HB 1 88 ALA HA 5.500 . 6.000 5.050 4.619 5.688 . 0 0 "[ . 1 . ]" 1
1903 1 87 VAL HB 1 91 ARG HG2 5.000 . 5.500 4.595 2.827 5.057 . 0 0 "[ . 1 . ]" 1
1904 1 87 VAL MG1 1 88 ALA H 5.540 . 6.040 3.450 2.320 4.156 . 0 0 "[ . 1 . ]" 1
1905 1 87 VAL MG1 1 90 GLY H 6.610 . 7.110 4.698 4.516 4.881 . 0 0 "[ . 1 . ]" 1
1906 1 87 VAL MG1 1 91 ARG QB 7.200 . 7.700 4.876 4.013 5.398 . 0 0 "[ . 1 . ]" 1
1907 1 87 VAL MG1 1 91 ARG QD 7.410 . 7.910 4.532 2.612 5.605 . 0 0 "[ . 1 . ]" 1
1908 1 87 VAL MG2 1 88 ALA H 5.340 . 5.840 3.169 2.531 4.165 . 0 0 "[ . 1 . ]" 1
1909 1 87 VAL MG2 1 88 ALA HA 6.380 . 6.880 3.745 3.429 4.222 . 0 0 "[ . 1 . ]" 1
1910 1 87 VAL MG2 1 90 GLY H 6.610 . 7.110 4.652 4.261 5.004 . 0 0 "[ . 1 . ]" 1
1911 1 87 VAL MG2 1 91 ARG QD 7.410 . 7.910 3.704 3.162 5.524 . 0 0 "[ . 1 . ]" 1
1912 1 88 ALA HA 1 91 ARG HA 6.300 . 6.800 6.389 6.269 6.485 . 0 0 "[ . 1 . ]" 1
1913 1 88 ALA MB 1 89 GLN H 5.720 . 6.220 2.984 2.766 3.145 . 0 0 "[ . 1 . ]" 1
1914 1 88 ALA MB 1 89 GLN HB3 6.240 . 6.740 5.032 3.858 5.284 . 0 0 "[ . 1 . ]" 1
1915 1 88 ALA MB 1 89 GLN HE22 6.970 . 7.470 4.500 2.359 5.575 . 0 0 "[ . 1 . ]" 1
1916 1 88 ALA MB 1 89 GLN HE21 6.610 . 7.110 3.842 3.281 4.117 . 0 0 "[ . 1 . ]" 1
1917 1 88 ALA MB 1 89 GLN QG 7.410 . 7.910 3.435 2.805 4.320 . 0 0 "[ . 1 . ]" 1
1918 1 88 ALA MB 1 90 GLY H 6.610 . 7.110 4.519 4.317 4.723 . 0 0 "[ . 1 . ]" 1
1919 1 89 GLN HA 1 89 GLN HE22 5.500 . 6.000 5.662 4.662 6.138 0.138 1 0 "[ . 1 . ]" 1
1920 1 89 GLN HA 1 90 GLY QA 4.920 . 5.420 4.409 4.328 4.466 . 0 0 "[ . 1 . ]" 1
1921 1 89 GLN HB2 1 90 GLY H 4.370 . 4.870 3.390 2.890 4.218 . 0 0 "[ . 1 . ]" 1
1922 1 89 GLN HB2 1 90 GLY QA 5.850 . 6.350 4.266 3.679 4.587 . 0 0 "[ . 1 . ]" 1
1923 1 89 GLN HB3 1 90 GLY QA 5.810 . 6.310 4.548 4.069 5.330 . 0 0 "[ . 1 . ]" 1
1924 1 90 GLY H 1 91 ARG H 3.490 . 3.990 2.409 2.160 2.653 . 0 0 "[ . 1 . ]" 1
1925 1 90 GLY QA 1 91 ARG HA 4.840 . 5.340 4.073 4.037 4.122 . 0 0 "[ . 1 . ]" 1
1926 1 90 GLY QA 1 91 ARG HG2 6.170 . 6.670 4.222 3.496 5.113 . 0 0 "[ . 1 . ]" 1
1927 1 91 ARG H 1 91 ARG HG2 3.750 . 4.250 3.273 2.169 3.815 . 0 0 "[ . 1 . ]" 1
1928 1 91 ARG H 1 92 ARG H 4.150 . 4.650 2.461 2.016 4.431 . 0 0 "[ . 1 . ]" 1
1929 1 91 ARG HA 1 91 ARG HG2 3.950 . 4.450 2.808 2.333 3.715 . 0 0 "[ . 1 . ]" 1
1930 1 91 ARG HA 1 94 GLU HB3 4.400 . 4.900 3.595 2.335 4.489 . 0 0 "[ . 1 . ]" 1
1931 1 91 ARG HA 1 94 GLU QG 5.170 . 5.670 4.053 2.222 4.801 . 0 0 "[ . 1 . ]" 1
1932 1 91 ARG QB 1 93 LEU H 6.050 . 6.550 4.906 3.137 5.633 . 0 0 "[ . 1 . ]" 1
1933 1 92 ARG H 1 92 ARG HB3 4.000 . 4.500 3.087 2.415 3.974 . 0 0 "[ . 1 . ]" 1
1934 1 92 ARG H 1 92 ARG HG2 5.320 . 5.820 4.142 3.180 4.604 . 0 0 "[ . 1 . ]" 1
1935 1 92 ARG H 1 92 ARG HG3 4.990 . 5.490 3.705 2.223 4.752 . 0 0 "[ . 1 . ]" 1
1936 1 92 ARG H 1 93 LEU QD 7.410 . 7.910 4.743 3.570 5.499 . 0 0 "[ . 1 . ]" 1
1937 1 92 ARG H 1 94 GLU H 4.510 . 5.010 3.952 2.992 4.596 . 0 0 "[ . 1 . ]" 1
1938 1 92 ARG HB3 1 92 ARG HG2 2.910 . 3.410 2.472 2.445 2.504 . 0 0 "[ . 1 . ]" 1
1939 1 92 ARG HB3 1 93 LEU QB 4.950 . 5.450 4.175 3.792 4.502 . 0 0 "[ . 1 . ]" 1
1940 1 92 ARG HG3 1 93 LEU H 5.080 . 5.580 4.865 3.056 5.222 . 0 0 "[ . 1 . ]" 1
1941 1 93 LEU QD 1 94 GLU H 7.410 . 7.910 4.164 3.025 4.426 . 0 0 "[ . 1 . ]" 1
1942 1 94 GLU H 1 94 GLU HG2 5.230 . 5.730 3.889 2.052 4.977 . 0 0 "[ . 1 . ]" 1
1943 1 94 GLU H 1 95 LEU H 4.260 . 4.760 3.061 1.756 4.610 0.044 6 0 "[ . 1 . ]" 1
1944 1 95 LEU H 1 96 VAL H 3.520 . 4.020 2.458 1.731 3.367 0.069 8 0 "[ . 1 . ]" 1
1945 1 95 LEU H 1 96 VAL QG 7.410 . 7.910 3.630 2.525 4.583 . 0 0 "[ . 1 . ]" 1
1946 1 96 VAL H 1 96 VAL HB 3.640 . 4.140 3.269 2.431 3.855 . 0 0 "[ . 1 . ]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 111
_Distance_constraint_stats_list.Viol_count 18
_Distance_constraint_stats_list.Viol_total 17.929
_Distance_constraint_stats_list.Viol_max 0.079
_Distance_constraint_stats_list.Viol_rms 0.0054
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0005
_Distance_constraint_stats_list.Viol_average_violations_only 0.0553
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 6 THR 0.000 0.000 . 0 "[ . 1 . ]"
1 7 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 8 GLN 0.000 0.000 . 0 "[ . 1 . ]"
1 9 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 10 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 11 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 12 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 13 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 14 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 15 GLN 0.000 0.000 . 0 "[ . 1 . ]"
1 16 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 19 GLN 0.000 0.000 . 0 "[ . 1 . ]"
1 20 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 21 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 22 PHE 0.000 0.000 . 0 "[ . 1 . ]"
1 23 ASN 0.000 0.000 . 0 "[ . 1 . ]"
1 24 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 25 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 26 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 27 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 28 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 29 TYR 0.996 0.079 14 0 "[ . 1 . ]"
1 30 GLN 0.000 0.000 . 0 "[ . 1 . ]"
1 31 HIS 0.000 0.000 . 0 "[ . 1 . ]"
1 32 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 33 VAL 0.996 0.079 14 0 "[ . 1 . ]"
1 34 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 35 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 36 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 37 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 38 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 39 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 45 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 46 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 47 PRO 0.000 0.000 . 0 "[ . 1 . ]"
1 48 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 49 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 50 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 51 GLN 0.000 0.000 . 0 "[ . 1 . ]"
1 52 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 53 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 54 PHE 0.000 0.000 . 0 "[ . 1 . ]"
1 55 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 56 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 57 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 58 TYR 0.000 0.000 . 0 "[ . 1 . ]"
1 59 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 60 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 61 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 62 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 70 PHE 0.000 0.000 . 0 "[ . 1 . ]"
1 71 TYR 0.000 0.000 . 0 "[ . 1 . ]"
1 72 THR 0.000 0.000 . 0 "[ . 1 . ]"
1 73 TRP 0.000 0.000 . 0 "[ . 1 . ]"
1 74 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 75 TYR 0.000 0.000 . 0 "[ . 1 . ]"
1 76 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 77 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 78 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 79 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 80 ASN 0.000 0.000 . 0 "[ . 1 . ]"
1 81 THR 0.000 0.000 . 0 "[ . 1 . ]"
1 82 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 83 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 84 ASN 0.000 0.000 . 0 "[ . 1 . ]"
1 85 TYR 0.000 0.000 . 0 "[ . 1 . ]"
1 86 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 87 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 88 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 89 GLN 0.000 0.000 . 0 "[ . 1 . ]"
1 90 GLY 0.000 0.000 . 0 "[ . 1 . ]"
1 91 ARG 0.000 0.000 . 0 "[ . 1 . ]"
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 6 THR O 1 10 LEU H 2.400 . 2.900 1.956 1.882 2.031 . 0 0 "[ . 1 . ]" 2
2 1 6 THR O 1 10 LEU N 3.400 2.400 3.900 2.933 2.862 3.006 . 0 0 "[ . 1 . ]" 2
3 1 7 ASP O 1 11 VAL H 2.400 . 2.900 2.333 2.219 2.407 . 0 0 "[ . 1 . ]" 2
4 1 7 ASP O 1 11 VAL N 3.400 2.400 3.900 3.183 3.085 3.255 . 0 0 "[ . 1 . ]" 2
5 1 8 GLN O 1 12 GLU H 2.500 . 3.000 2.606 2.514 2.656 . 0 0 "[ . 1 . ]" 2
6 1 8 GLN O 1 12 GLU N 3.500 2.400 4.000 3.475 3.364 3.510 . 0 0 "[ . 1 . ]" 2
7 1 9 VAL O 1 13 ARG H 2.400 . 2.900 2.060 1.964 2.288 . 0 0 "[ . 1 . ]" 2
8 1 9 VAL O 1 13 ARG N 3.400 2.400 3.900 2.964 2.830 3.207 . 0 0 "[ . 1 . ]" 2
9 1 10 LEU O 1 14 VAL H 2.400 2.400 2.900 2.494 2.414 2.557 . 0 0 "[ . 1 . ]" 2
10 1 11 VAL O 1 15 GLN H 2.500 . 3.000 2.586 2.551 2.644 . 0 0 "[ . 1 . ]" 2
11 1 11 VAL O 1 15 GLN N 3.500 2.400 4.000 3.424 3.389 3.469 . 0 0 "[ . 1 . ]" 2
12 1 12 GLU O 1 16 LYS H 2.400 . 2.900 2.493 2.333 2.555 . 0 0 "[ . 1 . ]" 2
13 1 12 GLU O 1 16 LYS N 3.400 2.400 3.900 3.153 3.061 3.232 . 0 0 "[ . 1 . ]" 2
14 1 19 GLN O 1 23 ASN H 2.400 . 2.900 2.396 2.318 2.434 . 0 0 "[ . 1 . ]" 2
15 1 19 GLN O 1 23 ASN N 3.400 2.400 3.900 3.325 3.248 3.366 . 0 0 "[ . 1 . ]" 2
16 1 20 LYS O 1 24 LEU H 2.500 . 3.000 2.559 2.543 2.570 . 0 0 "[ . 1 . ]" 2
17 1 20 LYS O 1 24 LEU N 3.500 2.400 4.000 3.500 3.483 3.513 . 0 0 "[ . 1 . ]" 2
18 1 21 ALA O 1 25 LEU H 2.400 . 2.900 2.389 2.341 2.429 . 0 0 "[ . 1 . ]" 2
19 1 21 ALA O 1 25 LEU N 3.400 2.400 3.900 3.029 2.979 3.079 . 0 0 "[ . 1 . ]" 2
20 1 22 PHE O 1 26 VAL H 2.400 . 2.900 1.853 1.801 1.917 . 0 0 "[ . 1 . ]" 2
21 1 22 PHE O 1 26 VAL N 3.400 2.400 3.900 2.827 2.792 2.875 . 0 0 "[ . 1 . ]" 2
22 1 23 ASN O 1 27 VAL H 2.550 . 3.050 2.648 2.598 2.684 . 0 0 "[ . 1 . ]" 2
23 1 23 ASN O 1 27 VAL N 3.550 2.400 4.050 3.532 3.477 3.585 . 0 0 "[ . 1 . ]" 2
24 1 24 LEU O 1 28 ARG H 3.200 . 3.700 3.334 3.317 3.359 . 0 0 "[ . 1 . ]" 2
25 1 24 LEU O 1 28 ARG N 4.200 2.400 4.700 4.172 4.149 4.198 . 0 0 "[ . 1 . ]" 2
26 1 25 LEU O 1 29 TYR H 2.650 . 3.150 2.806 2.781 2.834 . 0 0 "[ . 1 . ]" 2
27 1 25 LEU O 1 29 TYR N 3.650 2.400 4.150 3.677 3.658 3.701 . 0 0 "[ . 1 . ]" 2
28 1 26 VAL O 1 30 GLN H 2.400 . 2.900 2.040 1.990 2.091 . 0 0 "[ . 1 . ]" 2
29 1 26 VAL O 1 30 GLN N 3.400 2.400 3.900 2.608 2.591 2.627 . 0 0 "[ . 1 . ]" 2
30 1 27 VAL O 1 31 HIS H 3.300 . 3.800 3.432 3.416 3.444 . 0 0 "[ . 1 . ]" 2
31 1 27 VAL O 1 31 HIS N 4.300 2.400 4.800 4.299 4.280 4.312 . 0 0 "[ . 1 . ]" 2
32 1 28 ARG O 1 32 LYS H 3.500 . 4.000 3.642 3.591 3.680 . 0 0 "[ . 1 . ]" 2
33 1 28 ARG O 1 32 LYS N 4.500 2.400 5.000 4.535 4.495 4.584 . 0 0 "[ . 1 . ]" 2
34 1 29 TYR O 1 33 VAL H 2.400 . 2.900 1.745 1.721 1.764 0.079 14 0 "[ . 1 . ]" 2
35 1 29 TYR O 1 33 VAL N 3.400 2.400 3.900 2.740 2.714 2.765 . 0 0 "[ . 1 . ]" 2
36 1 30 GLN O 1 34 ALA H 2.700 . 3.200 2.799 2.756 2.841 . 0 0 "[ . 1 . ]" 2
37 1 30 GLN O 1 34 ALA N 3.700 2.400 4.200 3.655 3.584 3.726 . 0 0 "[ . 1 . ]" 2
38 1 31 HIS O 1 35 SER H 2.700 . 3.200 2.764 2.740 2.788 . 0 0 "[ . 1 . ]" 2
39 1 31 HIS O 1 35 SER N 3.700 2.400 4.200 3.472 3.427 3.503 . 0 0 "[ . 1 . ]" 2
40 1 32 LYS O 1 36 LEU H 2.500 . 3.000 2.582 2.523 2.625 . 0 0 "[ . 1 . ]" 2
41 1 32 LYS O 1 36 LEU N 3.500 2.400 4.000 3.522 3.488 3.553 . 0 0 "[ . 1 . ]" 2
42 1 33 VAL O 1 37 VAL H 2.400 . 2.900 2.057 1.983 2.221 . 0 0 "[ . 1 . ]" 2
43 1 33 VAL O 1 37 VAL N 3.400 2.400 3.900 2.953 2.910 3.062 . 0 0 "[ . 1 . ]" 2
44 1 34 ALA O 1 38 SER H 2.400 . 2.900 2.456 2.420 2.518 . 0 0 "[ . 1 . ]" 2
45 1 34 ALA O 1 38 SER N 3.400 2.400 3.900 3.228 3.162 3.272 . 0 0 "[ . 1 . ]" 2
46 1 35 SER O 1 39 ARG H 3.500 . 4.000 3.635 3.608 3.668 . 0 0 "[ . 1 . ]" 2
47 1 35 SER O 1 39 ARG N 4.500 2.400 5.000 4.241 4.190 4.336 . 0 0 "[ . 1 . ]" 2
48 1 45 ASP O 1 49 VAL H 2.400 . 2.900 2.446 2.232 2.490 . 0 0 "[ . 1 . ]" 2
49 1 45 ASP O 1 49 VAL N 3.400 2.400 3.900 3.338 3.192 3.378 . 0 0 "[ . 1 . ]" 2
50 1 46 VAL O 1 50 VAL H 2.400 . 2.900 2.372 2.064 2.464 . 0 0 "[ . 1 . ]" 2
51 1 46 VAL O 1 50 VAL N 3.400 2.400 3.900 3.258 2.975 3.352 . 0 0 "[ . 1 . ]" 2
52 1 47 PRO O 1 51 GLN H 2.400 . 2.900 2.454 2.428 2.492 . 0 0 "[ . 1 . ]" 2
53 1 47 PRO O 1 51 GLN N 3.400 2.400 3.900 3.331 3.296 3.384 . 0 0 "[ . 1 . ]" 2
54 1 48 ASP O 1 52 GLU H 2.400 . 2.900 2.033 1.981 2.253 . 0 0 "[ . 1 . ]" 2
55 1 48 ASP O 1 52 GLU N 3.400 2.400 3.900 2.990 2.938 3.206 . 0 0 "[ . 1 . ]" 2
56 1 49 VAL O 1 53 ALA H 2.400 . 2.900 2.131 2.017 2.217 . 0 0 "[ . 1 . ]" 2
57 1 49 VAL O 1 53 ALA N 3.400 2.400 3.900 2.959 2.879 3.035 . 0 0 "[ . 1 . ]" 2
58 1 50 VAL O 1 54 PHE H 2.400 . 2.900 2.308 2.132 2.437 . 0 0 "[ . 1 . ]" 2
59 1 50 VAL O 1 54 PHE N 3.400 2.400 3.900 3.149 3.051 3.228 . 0 0 "[ . 1 . ]" 2
60 1 51 GLN O 1 55 ILE H 2.400 . 2.900 2.019 1.963 2.072 . 0 0 "[ . 1 . ]" 2
61 1 51 GLN O 1 55 ILE N 3.400 2.400 3.900 2.951 2.906 2.999 . 0 0 "[ . 1 . ]" 2
62 1 52 GLU O 1 56 LYS H 2.400 . 2.900 1.974 1.928 2.063 . 0 0 "[ . 1 . ]" 2
63 1 52 GLU O 1 56 LYS N 3.400 2.400 3.900 2.898 2.851 2.980 . 0 0 "[ . 1 . ]" 2
64 1 53 ALA O 1 57 ALA H 2.400 . 2.900 2.064 1.934 2.183 . 0 0 "[ . 1 . ]" 2
65 1 53 ALA O 1 57 ALA N 3.400 2.400 3.900 2.868 2.744 2.965 . 0 0 "[ . 1 . ]" 2
66 1 54 PHE O 1 58 TYR H 2.400 . 2.900 2.189 2.100 2.281 . 0 0 "[ . 1 . ]" 2
67 1 54 PHE O 1 58 TYR N 3.400 2.400 3.900 3.151 3.069 3.241 . 0 0 "[ . 1 . ]" 2
68 1 55 ILE O 1 59 ARG H 2.600 . 3.100 2.677 2.650 2.693 . 0 0 "[ . 1 . ]" 2
69 1 55 ILE O 1 59 ARG N 3.600 2.400 4.100 3.618 3.571 3.640 . 0 0 "[ . 1 . ]" 2
70 1 56 LYS O 1 60 ALA H 2.400 . 2.900 2.483 2.428 2.584 . 0 0 "[ . 1 . ]" 2
71 1 56 LYS O 1 60 ALA N 3.400 2.400 3.900 3.265 3.203 3.314 . 0 0 "[ . 1 . ]" 2
72 1 57 ALA O 1 61 LEU H 2.400 . 2.900 2.070 2.033 2.112 . 0 0 "[ . 1 . ]" 2
73 1 57 ALA O 1 61 LEU N 3.400 2.400 3.900 2.659 2.629 2.685 . 0 0 "[ . 1 . ]" 2
74 1 58 TYR O 1 62 ASP H 2.800 . 3.300 2.869 2.831 2.900 . 0 0 "[ . 1 . ]" 2
75 1 58 TYR O 1 62 ASP N 3.800 2.400 4.300 3.694 3.650 3.737 . 0 0 "[ . 1 . ]" 2
76 1 70 PHE O 1 74 LEU H 2.400 . 2.900 2.049 1.992 2.100 . 0 0 "[ . 1 . ]" 2
77 1 70 PHE O 1 74 LEU N 3.400 2.400 3.900 2.876 2.834 2.930 . 0 0 "[ . 1 . ]" 2
78 1 71 TYR O 1 75 TYR H 2.400 . 2.900 2.044 1.956 2.108 . 0 0 "[ . 1 . ]" 2
79 1 71 TYR O 1 75 TYR N 3.400 2.400 3.900 2.986 2.921 3.044 . 0 0 "[ . 1 . ]" 2
80 1 72 THR O 1 76 ARG H 2.550 . 3.050 2.633 2.581 2.685 . 0 0 "[ . 1 . ]" 2
81 1 72 THR O 1 76 ARG N 3.550 2.400 4.050 3.485 3.392 3.584 . 0 0 "[ . 1 . ]" 2
82 1 73 TRP O 1 77 ILE H 3.000 . 3.500 3.085 3.006 3.174 . 0 0 "[ . 1 . ]" 2
83 1 73 TRP O 1 77 ILE N 4.000 2.400 4.500 3.844 3.764 3.945 . 0 0 "[ . 1 . ]" 2
84 1 74 LEU O 1 78 ALA H 2.500 . 3.000 2.522 2.345 2.616 . 0 0 "[ . 1 . ]" 2
85 1 74 LEU O 1 78 ALA N 3.500 2.400 4.000 3.403 3.241 3.514 . 0 0 "[ . 1 . ]" 2
86 1 75 TYR O 1 79 VAL H 2.400 . 2.900 2.436 2.367 2.501 . 0 0 "[ . 1 . ]" 2
87 1 75 TYR O 1 79 VAL N 3.400 2.400 3.900 3.389 3.321 3.454 . 0 0 "[ . 1 . ]" 2
88 1 76 ARG O 1 80 ASN H 2.400 . 2.900 2.414 2.325 2.473 . 0 0 "[ . 1 . ]" 2
89 1 76 ARG O 1 80 ASN N 3.400 2.400 3.900 3.327 3.237 3.409 . 0 0 "[ . 1 . ]" 2
90 1 77 ILE O 1 81 THR H 2.400 . 2.900 2.386 2.252 2.460 . 0 0 "[ . 1 . ]" 2
91 1 77 ILE O 1 81 THR N 3.400 2.400 3.900 3.165 2.974 3.259 . 0 0 "[ . 1 . ]" 2
92 1 78 ALA O 1 82 ALA H 2.400 . 2.900 2.422 2.359 2.463 . 0 0 "[ . 1 . ]" 2
93 1 78 ALA O 1 82 ALA N 3.400 2.400 3.900 3.247 3.191 3.303 . 0 0 "[ . 1 . ]" 2
94 1 79 VAL O 1 83 LYS H 2.400 . 2.900 2.416 2.292 2.473 . 0 0 "[ . 1 . ]" 2
95 1 79 VAL O 1 83 LYS N 3.400 2.400 3.900 3.323 3.206 3.383 . 0 0 "[ . 1 . ]" 2
96 1 80 ASN O 1 84 ASN H 2.400 . 2.900 2.449 2.416 2.469 . 0 0 "[ . 1 . ]" 2
97 1 80 ASN O 1 84 ASN N 3.400 2.400 3.900 3.288 3.200 3.344 . 0 0 "[ . 1 . ]" 2
98 1 81 THR O 1 85 TYR H 2.400 . 2.900 2.197 2.037 2.339 . 0 0 "[ . 1 . ]" 2
99 1 81 THR O 1 85 TYR N 3.400 2.400 3.900 2.907 2.832 3.043 . 0 0 "[ . 1 . ]" 2
100 1 82 ALA O 1 86 LEU H 2.400 . 2.900 2.424 2.309 2.478 . 0 0 "[ . 1 . ]" 2
101 1 82 ALA O 1 86 LEU N 3.400 2.400 3.900 3.326 3.190 3.407 . 0 0 "[ . 1 . ]" 2
102 1 83 LYS O 1 87 VAL H 2.600 . 3.100 2.701 2.636 2.743 . 0 0 "[ . 1 . ]" 2
103 1 83 LYS O 1 87 VAL N 3.600 2.400 4.100 3.557 3.430 3.617 . 0 0 "[ . 1 . ]" 2
104 1 84 ASN O 1 88 ALA H 2.400 . 2.900 2.442 2.197 2.551 . 0 0 "[ . 1 . ]" 2
105 1 84 ASN O 1 88 ALA N 3.400 2.400 3.900 3.232 2.987 3.353 . 0 0 "[ . 1 . ]" 2
106 1 85 TYR O 1 89 GLN H 2.900 . 3.400 2.895 2.498 3.062 . 0 0 "[ . 1 . ]" 2
107 1 85 TYR O 1 89 GLN N 3.900 2.400 4.400 3.605 3.340 3.754 . 0 0 "[ . 1 . ]" 2
108 1 86 LEU O 1 90 GLY H 2.400 . 2.900 2.292 2.133 2.439 . 0 0 "[ . 1 . ]" 2
109 1 86 LEU O 1 90 GLY N 3.400 2.400 3.900 2.989 2.883 3.197 . 0 0 "[ . 1 . ]" 2
110 1 87 VAL O 1 91 ARG H 2.400 . 2.900 2.397 2.171 2.570 . 0 0 "[ . 1 . ]" 2
111 1 87 VAL O 1 91 ARG N 3.400 2.400 3.900 3.148 3.064 3.262 . 0 0 "[ . 1 . ]" 2
stop_
save_
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