NMR Restraints Grid
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NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
404197 |
1wyj   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1wyj
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 1269
_Distance_constraint_stats_list.Viol_count 2582
_Distance_constraint_stats_list.Viol_total 3553.852
_Distance_constraint_stats_list.Viol_max 0.791
_Distance_constraint_stats_list.Viol_rms 0.0404
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0070
_Distance_constraint_stats_list.Viol_average_violations_only 0.0688
_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 10 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 ALA 0.146 0.023 6 0 "[ . 1 . 2]"
1 12 THR 4.120 0.371 10 0 "[ . 1 . 2]"
1 13 ILE 6.429 0.508 17 1 "[ . 1 . + 2]"
1 14 THR 4.132 0.516 17 1 "[ . 1 . + 2]"
1 15 TYR 2.744 0.141 5 0 "[ . 1 . 2]"
1 16 SER 0.207 0.043 17 0 "[ . 1 . 2]"
1 17 VAL 1.832 0.089 12 0 "[ . 1 . 2]"
1 18 LEU 2.577 0.085 6 0 "[ . 1 . 2]"
1 19 GLU 8.043 0.601 15 9 "[ -*** *1 * *+ *2]"
1 20 GLU 1.818 0.124 19 0 "[ . 1 . 2]"
1 21 THR 2.639 0.140 13 0 "[ . 1 . 2]"
1 22 ASP 3.626 0.436 1 0 "[ . 1 . 2]"
1 23 ARG 6.277 0.750 17 2 "[- . 1 . + 2]"
1 24 GLY 0.523 0.099 7 0 "[ . 1 . 2]"
1 25 SER 4.809 0.233 15 0 "[ . 1 . 2]"
1 26 LEU 13.865 0.460 7 0 "[ . 1 . 2]"
1 27 VAL 4.894 0.179 19 0 "[ . 1 . 2]"
1 28 GLY 1.673 0.179 19 0 "[ . 1 . 2]"
1 29 ASN 1.252 0.142 10 0 "[ . 1 . 2]"
1 30 LEU 3.318 0.139 20 0 "[ . 1 . 2]"
1 31 ALA 1.956 0.378 4 0 "[ . 1 . 2]"
1 32 LYS 0.556 0.432 6 0 "[ . 1 . 2]"
1 33 ASP 0.292 0.041 17 0 "[ . 1 . 2]"
1 34 LEU 3.051 0.212 12 0 "[ . 1 . 2]"
1 35 GLY 0.014 0.008 6 0 "[ . 1 . 2]"
1 36 LEU 0.131 0.019 17 0 "[ . 1 . 2]"
1 37 SER 0.058 0.019 20 0 "[ . 1 . 2]"
1 38 LEU 0.810 0.324 19 0 "[ . 1 . 2]"
1 39 ARG 0.354 0.042 4 0 "[ . 1 . 2]"
1 40 GLU 3.538 0.305 1 0 "[ . 1 . 2]"
1 41 LEU 1.583 0.138 19 0 "[ . 1 . 2]"
1 42 ILE 0.673 0.087 20 0 "[ . 1 . 2]"
1 43 THR 0.949 0.059 14 0 "[ . 1 . 2]"
1 44 ARG 0.291 0.118 15 0 "[ . 1 . 2]"
1 45 GLY 0.031 0.012 3 0 "[ . 1 . 2]"
1 46 ALA 0.672 0.051 6 0 "[ . 1 . 2]"
1 47 GLN 0.769 0.051 16 0 "[ . 1 . 2]"
1 48 ILE 4.806 0.202 18 0 "[ . 1 . 2]"
1 49 LEU 1.213 0.113 17 0 "[ . 1 . 2]"
1 50 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 LYS 0.206 0.027 11 0 "[ . 1 . 2]"
1 53 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 LYS 0.882 0.124 13 0 "[ . 1 . 2]"
1 55 GLN 0.300 0.087 2 0 "[ . 1 . 2]"
1 56 LEU 0.310 0.045 12 0 "[ . 1 . 2]"
1 57 LEU 6.882 0.188 3 0 "[ . 1 . 2]"
1 58 GLN 0.233 0.074 10 0 "[ . 1 . 2]"
1 59 LEU 9.001 0.378 9 0 "[ . 1 . 2]"
1 60 GLU 0.074 0.021 7 0 "[ . 1 . 2]"
1 61 GLN 0.269 0.078 7 0 "[ . 1 . 2]"
1 62 LYS 0.149 0.103 4 0 "[ . 1 . 2]"
1 63 SER 1.382 0.324 19 0 "[ . 1 . 2]"
1 64 GLY 5.804 0.378 9 0 "[ . 1 . 2]"
1 65 ASN 4.019 0.460 7 0 "[ . 1 . 2]"
1 66 LEU 4.645 0.112 1 0 "[ . 1 . 2]"
1 67 LEU 1.732 0.074 10 0 "[ . 1 . 2]"
1 68 LEU 5.390 0.188 3 0 "[ . 1 . 2]"
1 69 LYS 3.680 0.255 11 0 "[ . 1 . 2]"
1 70 GLU 3.448 0.750 17 2 "[- . 1 . + 2]"
1 71 LYS 12.444 0.791 3 9 "[* + . ** - . ****]"
1 72 LEU 2.206 0.151 18 0 "[ . 1 . 2]"
1 73 ASP 0.114 0.114 1 0 "[ . 1 . 2]"
1 74 ARG 0.500 0.096 17 0 "[ . 1 . 2]"
1 75 GLU 0.117 0.048 14 0 "[ . 1 . 2]"
1 76 GLU 0.168 0.114 1 0 "[ . 1 . 2]"
1 77 LEU 0.003 0.003 1 0 "[ . 1 . 2]"
1 78 CYS 2.717 0.237 13 0 "[ . 1 . 2]"
1 79 GLY 0.088 0.023 4 0 "[ . 1 . 2]"
1 81 THR 1.303 0.233 15 0 "[ . 1 . 2]"
1 82 ASN 0.796 0.230 16 0 "[ . 1 . 2]"
1 83 PRO 0.063 0.016 16 0 "[ . 1 . 2]"
1 84 CYS 0.065 0.016 18 0 "[ . 1 . 2]"
1 85 ILE 1.513 0.093 17 0 "[ . 1 . 2]"
1 86 LEU 0.947 0.085 16 0 "[ . 1 . 2]"
1 87 HIS 4.654 0.385 19 0 "[ . 1 . 2]"
1 88 PHE 5.066 0.385 19 0 "[ . 1 . 2]"
1 89 GLN 1.414 0.119 18 0 "[ . 1 . 2]"
1 90 VAL 4.505 0.105 6 0 "[ . 1 . 2]"
1 91 LEU 0.915 0.071 12 0 "[ . 1 . 2]"
1 92 LEU 2.691 0.544 13 1 "[ . 1 + . 2]"
1 93 LYS 1.660 0.057 4 0 "[ . 1 . 2]"
1 94 SER 3.663 0.394 12 0 "[ . 1 . 2]"
1 95 PRO 2.877 0.394 12 0 "[ . 1 . 2]"
1 96 VAL 5.154 0.140 4 0 "[ . 1 . 2]"
1 97 GLN 6.869 0.682 11 2 "[ . 1+ - . 2]"
1 98 PHE 4.215 0.237 12 0 "[ . 1 . 2]"
1 99 ILE 11.928 0.682 11 1 "[ . 1+ . 2]"
1 100 GLN 3.130 0.384 13 0 "[ . 1 . 2]"
1 101 GLY 4.112 0.508 17 1 "[ . 1 . + 2]"
1 102 GLU 1.678 0.516 17 1 "[ . 1 . + 2]"
1 103 ILE 3.693 0.093 17 0 "[ . 1 . 2]"
1 104 GLN 2.673 0.452 12 0 "[ . 1 . 2]"
1 105 LEU 5.603 0.475 3 0 "[ . 1 . 2]"
1 106 GLN 5.712 0.475 3 0 "[ . 1 . 2]"
1 107 ASP 0.022 0.012 8 0 "[ . 1 . 2]"
1 108 VAL 4.287 0.460 12 0 "[ . 1 . 2]"
1 109 ASN 0.004 0.004 14 0 "[ . 1 . 2]"
1 110 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 ALA 2.779 0.423 16 0 "[ . 1 . 2]"
1 113 PRO 2.779 0.423 16 0 "[ . 1 . 2]"
1 114 GLU 8.550 0.727 1 4 "[+ -*. *1 . 2]"
1 115 PHE 0.555 0.284 11 0 "[ . 1 . 2]"
1 116 MET 0.515 0.200 3 0 "[ . 1 . 2]"
1 117 GLU 0.241 0.067 12 0 "[ . 1 . 2]"
1 118 ASP 0.350 0.124 18 0 "[ . 1 . 2]"
1 119 GLU 4.202 0.694 18 5 "[** .* 1- . + 2]"
1 121 GLY 1.032 0.212 3 0 "[ . 1 . 2]"
1 122 PRO 1.032 0.212 3 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 10 SER QB 1 11 ALA H . . 4.080 2.561 2.228 3.414 . 0 0 "[ . 1 . 2]" 1
2 1 11 ALA H 1 11 ALA MB . . 3.520 2.279 2.109 2.887 . 0 0 "[ . 1 . 2]" 1
3 1 11 ALA HA 1 12 THR H . . 2.870 2.225 2.206 2.511 . 0 0 "[ . 1 . 2]" 1
4 1 11 ALA MB 1 12 THR H . . 3.130 3.098 2.382 3.153 0.023 6 0 "[ . 1 . 2]" 1
5 1 11 ALA MB 1 13 ILE H . . 4.600 3.416 2.691 3.593 . 0 0 "[ . 1 . 2]" 1
6 1 12 THR H 1 12 THR HB . . 2.950 2.860 2.780 2.940 . 0 0 "[ . 1 . 2]" 1
7 1 12 THR H 1 12 THR MG . . 4.350 2.027 1.903 2.099 . 0 0 "[ . 1 . 2]" 1
8 1 12 THR H 1 99 ILE MG . . 4.040 4.086 4.045 4.124 0.084 17 0 "[ . 1 . 2]" 1
9 1 12 THR HA 1 12 THR MG . . 3.210 3.230 3.229 3.231 0.021 6 0 "[ . 1 . 2]" 1
10 1 12 THR HA 1 13 ILE H . . 3.570 3.554 3.537 3.562 . 0 0 "[ . 1 . 2]" 1
11 1 12 THR HB 1 13 ILE H . . 4.590 4.113 4.087 4.142 . 0 0 "[ . 1 . 2]" 1
12 1 12 THR HB 1 99 ILE MG . . 3.410 3.439 3.383 3.484 0.074 13 0 "[ . 1 . 2]" 1
13 1 12 THR MG 1 13 ILE H . . 3.240 1.928 1.910 2.014 . 0 0 "[ . 1 . 2]" 1
14 1 12 THR MG 1 13 ILE HB . . 3.470 3.225 3.123 3.310 . 0 0 "[ . 1 . 2]" 1
15 1 12 THR MG 1 100 GLN H . . 4.040 1.896 1.867 1.916 . 0 0 "[ . 1 . 2]" 1
16 1 12 THR MG 1 100 GLN HA . . 3.800 3.844 3.728 3.908 0.108 11 0 "[ . 1 . 2]" 1
17 1 12 THR MG 1 100 GLN HB2 . . 3.800 3.386 2.969 4.171 0.371 10 0 "[ . 1 . 2]" 1
18 1 12 THR MG 1 100 GLN QG . . 3.800 3.332 1.915 3.748 . 0 0 "[ . 1 . 2]" 1
19 1 12 THR MG 1 101 GLY HA2 . . 3.690 2.316 2.061 2.597 . 0 0 "[ . 1 . 2]" 1
20 1 13 ILE H 1 13 ILE HB . . 3.620 2.808 2.739 2.926 . 0 0 "[ . 1 . 2]" 1
21 1 13 ILE H 1 13 ILE MD . . 4.110 4.043 3.966 4.113 0.003 19 0 "[ . 1 . 2]" 1
22 1 13 ILE H 1 13 ILE HG12 . . 3.790 3.765 3.641 3.815 0.025 19 0 "[ . 1 . 2]" 1
23 1 13 ILE H 1 13 ILE HG13 . . 4.020 2.676 2.590 2.763 . 0 0 "[ . 1 . 2]" 1
24 1 13 ILE H 1 13 ILE MG . . 4.610 3.917 3.891 3.960 . 0 0 "[ . 1 . 2]" 1
25 1 13 ILE H 1 101 GLY HA2 . . 4.530 2.032 1.927 2.334 . 0 0 "[ . 1 . 2]" 1
26 1 13 ILE HA 1 13 ILE MD . . 3.880 3.870 3.829 3.914 0.034 20 0 "[ . 1 . 2]" 1
27 1 13 ILE HA 1 13 ILE HG12 . . 3.840 2.663 2.593 2.749 . 0 0 "[ . 1 . 2]" 1
28 1 13 ILE HA 1 13 ILE HG13 . . 4.220 3.198 3.147 3.285 . 0 0 "[ . 1 . 2]" 1
29 1 13 ILE HA 1 13 ILE MG . . 3.190 2.204 2.139 2.282 . 0 0 "[ . 1 . 2]" 1
30 1 13 ILE HA 1 14 THR H . . 2.790 2.323 2.276 2.351 . 0 0 "[ . 1 . 2]" 1
31 1 13 ILE HA 1 14 THR MG . . 4.170 3.777 3.703 3.911 . 0 0 "[ . 1 . 2]" 1
32 1 13 ILE HB 1 13 ILE MD . . 3.180 2.293 2.249 2.353 . 0 0 "[ . 1 . 2]" 1
33 1 13 ILE HB 1 14 THR H . . 3.730 3.799 3.732 3.862 0.132 17 0 "[ . 1 . 2]" 1
34 1 13 ILE HB 1 15 TYR QE . . 4.310 3.809 3.479 4.149 . 0 0 "[ . 1 . 2]" 1
35 1 13 ILE MD 1 13 ILE MG . . 2.710 1.938 1.890 2.037 . 0 0 "[ . 1 . 2]" 1
36 1 13 ILE MD 1 15 TYR QE . . 3.560 3.428 3.268 3.579 0.019 13 0 "[ . 1 . 2]" 1
37 1 13 ILE MD 1 33 ASP HB2 . . 3.880 3.892 3.863 3.921 0.041 17 0 "[ . 1 . 2]" 1
38 1 13 ILE MD 1 33 ASP HB3 . . 3.740 3.049 2.786 3.503 . 0 0 "[ . 1 . 2]" 1
39 1 13 ILE MD 1 34 LEU HG . . 3.890 3.145 2.801 3.565 . 0 0 "[ . 1 . 2]" 1
40 1 13 ILE MD 1 88 PHE QE . . 3.820 3.782 3.539 3.842 0.022 6 0 "[ . 1 . 2]" 1
41 1 13 ILE MD 1 88 PHE HZ . . 3.570 3.462 3.057 3.592 0.022 10 0 "[ . 1 . 2]" 1
42 1 13 ILE HG12 1 13 ILE MG . . 2.920 2.444 2.368 2.519 . 0 0 "[ . 1 . 2]" 1
43 1 13 ILE HG13 1 13 ILE MG . . 3.590 3.227 3.223 3.232 . 0 0 "[ . 1 . 2]" 1
44 1 13 ILE HG13 1 34 LEU MD2 . . 3.510 3.434 3.302 3.519 0.009 14 0 "[ . 1 . 2]" 1
45 1 13 ILE HG13 1 101 GLY HA2 . . 4.070 3.314 3.081 3.649 . 0 0 "[ . 1 . 2]" 1
46 1 13 ILE MG 1 14 THR H . . 3.520 2.010 1.907 2.370 . 0 0 "[ . 1 . 2]" 1
47 1 13 ILE MG 1 15 TYR H . . 4.750 4.285 4.162 4.376 . 0 0 "[ . 1 . 2]" 1
48 1 13 ILE MG 1 15 TYR QD . . 3.630 2.357 2.144 2.557 . 0 0 "[ . 1 . 2]" 1
49 1 13 ILE MG 1 15 TYR QE . . 3.580 2.027 1.882 2.313 . 0 0 "[ . 1 . 2]" 1
50 1 13 ILE MG 1 33 ASP HB3 . . 3.830 2.908 2.635 3.243 . 0 0 "[ . 1 . 2]" 1
51 1 13 ILE MG 1 34 LEU MD2 . . 2.860 2.876 2.851 2.922 0.062 15 0 "[ . 1 . 2]" 1
52 1 13 ILE MG 1 88 PHE HZ . . 3.540 3.432 3.214 3.541 0.001 20 0 "[ . 1 . 2]" 1
53 1 13 ILE MG 1 101 GLY HA2 . . 4.030 4.235 4.081 4.538 0.508 17 1 "[ . 1 . + 2]" 1
54 1 14 THR H 1 14 THR HB . . 3.720 3.699 3.643 3.717 . 0 0 "[ . 1 . 2]" 1
55 1 14 THR H 1 14 THR MG . . 3.530 3.255 3.209 3.341 . 0 0 "[ . 1 . 2]" 1
56 1 14 THR HA 1 14 THR MG . . 3.090 2.203 2.182 2.255 . 0 0 "[ . 1 . 2]" 1
57 1 14 THR HA 1 15 TYR H . . 3.010 2.150 2.149 2.157 . 0 0 "[ . 1 . 2]" 1
58 1 14 THR HA 1 102 GLU H . . 3.630 3.001 2.781 3.226 . 0 0 "[ . 1 . 2]" 1
59 1 14 THR HA 1 102 GLU HB3 . . 3.970 3.727 2.961 4.486 0.516 17 1 "[ . 1 . + 2]" 1
60 1 14 THR HB 1 15 TYR H . . 3.690 3.700 3.546 3.762 0.072 20 0 "[ . 1 . 2]" 1
61 1 14 THR MG 1 15 TYR H . . 4.020 3.963 3.840 4.017 . 0 0 "[ . 1 . 2]" 1
62 1 14 THR MG 1 102 GLU H . . 4.040 3.739 3.026 4.043 0.003 3 0 "[ . 1 . 2]" 1
63 1 14 THR MG 1 102 GLU HB2 . . 3.250 2.052 1.955 2.227 . 0 0 "[ . 1 . 2]" 1
64 1 14 THR MG 1 102 GLU HB3 . . 4.000 3.214 2.164 3.588 . 0 0 "[ . 1 . 2]" 1
65 1 14 THR MG 1 102 GLU QG . . 3.330 3.355 3.305 3.378 0.048 10 0 "[ . 1 . 2]" 1
66 1 14 THR MG 1 104 GLN HE22 . . 4.030 3.872 3.265 4.482 0.452 12 0 "[ . 1 . 2]" 1
67 1 14 THR MG 1 104 GLN HG3 . . 3.630 3.097 2.780 3.432 . 0 0 "[ . 1 . 2]" 1
68 1 15 TYR H 1 15 TYR HB2 . . 4.000 2.040 1.996 2.108 . 0 0 "[ . 1 . 2]" 1
69 1 15 TYR H 1 15 TYR QD . . 3.760 2.799 2.630 2.956 . 0 0 "[ . 1 . 2]" 1
70 1 15 TYR H 1 103 ILE HA . . 3.680 2.281 2.005 2.489 . 0 0 "[ . 1 . 2]" 1
71 1 15 TYR H 1 103 ILE HG12 . . 4.870 3.555 3.141 3.677 . 0 0 "[ . 1 . 2]" 1
72 1 15 TYR H 1 104 GLN H . . 4.710 2.834 2.669 3.061 . 0 0 "[ . 1 . 2]" 1
73 1 15 TYR HA 1 15 TYR QD . . 3.220 2.841 2.545 3.075 . 0 0 "[ . 1 . 2]" 1
74 1 15 TYR HA 1 16 SER H . . 3.250 2.463 2.382 2.530 . 0 0 "[ . 1 . 2]" 1
75 1 15 TYR HB2 1 16 SER H . . 4.100 3.997 3.888 4.131 0.031 12 0 "[ . 1 . 2]" 1
76 1 15 TYR HB2 1 27 VAL MG1 . . 3.640 3.383 3.178 3.620 . 0 0 "[ . 1 . 2]" 1
77 1 15 TYR HB2 1 103 ILE HA . . 3.970 2.023 1.976 2.210 . 0 0 "[ . 1 . 2]" 1
78 1 15 TYR HB2 1 103 ILE MD . . 3.690 3.558 3.176 3.697 0.007 11 0 "[ . 1 . 2]" 1
79 1 15 TYR HB2 1 103 ILE HG13 . . 4.110 3.469 3.241 3.669 . 0 0 "[ . 1 . 2]" 1
80 1 15 TYR HB2 1 103 ILE MG . . 4.060 3.247 2.803 3.425 . 0 0 "[ . 1 . 2]" 1
81 1 15 TYR HB3 1 16 SER H . . 3.970 2.648 2.494 2.843 . 0 0 "[ . 1 . 2]" 1
82 1 15 TYR HB3 1 17 VAL MG1 . . 4.180 3.542 3.164 3.948 . 0 0 "[ . 1 . 2]" 1
83 1 15 TYR HB3 1 27 VAL MG1 . . 3.450 2.496 2.223 2.763 . 0 0 "[ . 1 . 2]" 1
84 1 15 TYR HB3 1 103 ILE MG . . 4.240 3.197 2.967 3.386 . 0 0 "[ . 1 . 2]" 1
85 1 15 TYR QD 1 16 SER H . . 4.190 3.705 3.445 3.994 . 0 0 "[ . 1 . 2]" 1
86 1 15 TYR QD 1 27 VAL MG1 . . 3.410 1.786 1.763 1.823 . 0 0 "[ . 1 . 2]" 1
87 1 15 TYR QD 1 30 LEU MD1 . . 4.240 4.242 4.104 4.297 0.057 10 0 "[ . 1 . 2]" 1
88 1 15 TYR QD 1 66 LEU HB2 . . 4.040 3.905 3.559 4.058 0.018 4 0 "[ . 1 . 2]" 1
89 1 15 TYR QD 1 66 LEU MD1 . . 3.600 3.512 3.114 3.656 0.056 12 0 "[ . 1 . 2]" 1
90 1 15 TYR QD 1 66 LEU MD2 . . 4.260 4.295 4.264 4.317 0.057 8 0 "[ . 1 . 2]" 1
91 1 15 TYR QD 1 103 ILE MD . . 3.910 3.724 3.438 3.930 0.020 7 0 "[ . 1 . 2]" 1
92 1 15 TYR QD 1 103 ILE HG12 . . 4.150 3.557 3.383 3.710 . 0 0 "[ . 1 . 2]" 1
93 1 15 TYR QD 1 103 ILE MG . . 4.280 4.183 3.996 4.303 0.023 20 0 "[ . 1 . 2]" 1
94 1 15 TYR QE 1 27 VAL HB . . 4.320 3.416 2.928 3.721 . 0 0 "[ . 1 . 2]" 1
95 1 15 TYR QE 1 27 VAL MG1 . . 3.940 3.188 2.992 3.463 . 0 0 "[ . 1 . 2]" 1
96 1 15 TYR QE 1 28 GLY HA2 . . 3.710 3.634 3.517 3.851 0.141 5 0 "[ . 1 . 2]" 1
97 1 15 TYR QE 1 28 GLY HA3 . . 3.850 2.400 2.251 2.628 . 0 0 "[ . 1 . 2]" 1
98 1 15 TYR QE 1 30 LEU MD1 . . 3.660 2.495 2.209 2.714 . 0 0 "[ . 1 . 2]" 1
99 1 15 TYR QE 1 66 LEU MD1 . . 3.920 2.190 1.869 2.647 . 0 0 "[ . 1 . 2]" 1
100 1 15 TYR QE 1 66 LEU MD2 . . 3.850 3.863 3.660 3.937 0.087 18 0 "[ . 1 . 2]" 1
101 1 16 SER H 1 16 SER QB . . 3.310 3.056 2.799 3.152 . 0 0 "[ . 1 . 2]" 1
102 1 16 SER H 1 17 VAL H . . 4.930 4.131 4.009 4.273 . 0 0 "[ . 1 . 2]" 1
103 1 16 SER HA 1 17 VAL H . . 2.910 2.223 2.215 2.236 . 0 0 "[ . 1 . 2]" 1
104 1 16 SER HA 1 17 VAL MG1 . . 4.130 3.779 3.628 3.989 . 0 0 "[ . 1 . 2]" 1
105 1 16 SER HA 1 104 GLN H . . 3.440 3.386 3.179 3.483 0.043 17 0 "[ . 1 . 2]" 1
106 1 16 SER HA 1 104 GLN QB . . 3.460 3.002 2.459 3.231 . 0 0 "[ . 1 . 2]" 1
107 1 16 SER QB 1 17 VAL H . . 3.590 3.500 3.326 3.621 0.031 17 0 "[ . 1 . 2]" 1
108 1 16 SER QB 1 104 GLN QB . . 3.890 3.560 3.260 3.834 . 0 0 "[ . 1 . 2]" 1
109 1 16 SER QB 1 106 GLN QG . . 3.660 2.574 2.056 3.370 . 0 0 "[ . 1 . 2]" 1
110 1 17 VAL H 1 17 VAL HB . . 3.310 3.295 3.206 3.348 0.038 10 0 "[ . 1 . 2]" 1
111 1 17 VAL H 1 17 VAL MG1 . . 3.250 2.230 1.922 2.690 . 0 0 "[ . 1 . 2]" 1
112 1 17 VAL H 1 104 GLN H . . 4.750 4.377 4.218 4.609 . 0 0 "[ . 1 . 2]" 1
113 1 17 VAL H 1 105 LEU HA . . 4.530 2.945 2.655 3.396 . 0 0 "[ . 1 . 2]" 1
114 1 17 VAL H 1 106 GLN H . . 4.320 3.057 2.475 3.831 . 0 0 "[ . 1 . 2]" 1
115 1 17 VAL H 1 106 GLN QG . . 3.950 3.659 3.072 3.946 . 0 0 "[ . 1 . 2]" 1
116 1 17 VAL HA 1 17 VAL MG1 . . 3.170 3.205 3.193 3.221 0.051 15 0 "[ . 1 . 2]" 1
117 1 17 VAL HA 1 17 VAL MG2 . . 3.100 2.404 2.139 2.518 . 0 0 "[ . 1 . 2]" 1
118 1 17 VAL HA 1 18 LEU H . . 3.100 2.262 2.193 2.495 . 0 0 "[ . 1 . 2]" 1
119 1 17 VAL HA 1 18 LEU MD1 . . 3.810 3.815 3.756 3.863 0.053 6 0 "[ . 1 . 2]" 1
120 1 17 VAL HA 1 18 LEU HG . . 3.970 3.577 3.320 3.790 . 0 0 "[ . 1 . 2]" 1
121 1 17 VAL HB 1 18 LEU H . . 4.430 4.150 3.950 4.236 . 0 0 "[ . 1 . 2]" 1
122 1 17 VAL HB 1 21 THR MG . . 3.970 3.868 3.776 4.020 0.050 10 0 "[ . 1 . 2]" 1
123 1 17 VAL MG1 1 27 VAL MG1 . . 3.010 2.398 1.884 2.851 . 0 0 "[ . 1 . 2]" 1
124 1 17 VAL MG1 1 27 VAL MG2 . . 3.360 3.130 2.864 3.377 0.017 1 0 "[ . 1 . 2]" 1
125 1 17 VAL MG1 1 105 LEU HA . . 4.130 3.141 2.556 3.817 . 0 0 "[ . 1 . 2]" 1
126 1 17 VAL MG2 1 18 LEU H . . 3.150 2.311 1.916 2.606 . 0 0 "[ . 1 . 2]" 1
127 1 17 VAL MG2 1 18 LEU HB2 . . 3.860 3.778 3.508 3.930 0.070 12 0 "[ . 1 . 2]" 1
128 1 17 VAL MG2 1 21 THR HB . . 3.580 3.437 2.979 3.669 0.089 12 0 "[ . 1 . 2]" 1
129 1 17 VAL MG2 1 21 THR MG . . 3.180 1.690 1.620 1.810 . 0 0 "[ . 1 . 2]" 1
130 1 17 VAL MG2 1 27 VAL MG1 . . 3.570 3.257 2.881 3.555 . 0 0 "[ . 1 . 2]" 1
131 1 17 VAL MG2 1 27 VAL MG2 . . 3.610 2.663 2.343 2.937 . 0 0 "[ . 1 . 2]" 1
132 1 18 LEU H 1 18 LEU HB2 . . 3.530 2.680 2.493 2.737 . 0 0 "[ . 1 . 2]" 1
133 1 18 LEU H 1 18 LEU HB3 . . 3.500 3.529 3.515 3.585 0.085 6 0 "[ . 1 . 2]" 1
134 1 18 LEU H 1 18 LEU MD1 . . 3.730 2.454 2.395 2.548 . 0 0 "[ . 1 . 2]" 1
135 1 18 LEU H 1 18 LEU MD2 . . 3.960 3.667 3.601 3.918 . 0 0 "[ . 1 . 2]" 1
136 1 18 LEU H 1 18 LEU HG . . 3.320 2.032 1.930 2.445 . 0 0 "[ . 1 . 2]" 1
137 1 18 LEU H 1 19 GLU H . . 4.520 4.462 4.382 4.514 . 0 0 "[ . 1 . 2]" 1
138 1 18 LEU H 1 21 THR MG . . 4.250 3.484 2.960 3.787 . 0 0 "[ . 1 . 2]" 1
139 1 18 LEU HA 1 18 LEU MD1 . . 3.880 3.896 3.837 3.932 0.052 6 0 "[ . 1 . 2]" 1
140 1 18 LEU HA 1 18 LEU MD2 . . 2.930 2.943 2.866 3.006 0.076 6 0 "[ . 1 . 2]" 1
141 1 18 LEU HA 1 18 LEU HG . . 3.720 2.760 2.622 2.856 . 0 0 "[ . 1 . 2]" 1
142 1 18 LEU HA 1 19 GLU H . . 3.420 2.840 2.726 2.953 . 0 0 "[ . 1 . 2]" 1
143 1 18 LEU HA 1 20 GLU H . . 4.790 4.469 4.245 4.631 . 0 0 "[ . 1 . 2]" 1
144 1 18 LEU HA 1 105 LEU MD1 . . 3.720 2.518 2.080 3.491 . 0 0 "[ . 1 . 2]" 1
145 1 18 LEU HA 1 106 GLN H . . 4.190 2.542 2.016 3.107 . 0 0 "[ . 1 . 2]" 1
146 1 18 LEU HA 1 106 GLN HB2 . . 3.820 2.026 1.992 2.171 . 0 0 "[ . 1 . 2]" 1
147 1 18 LEU HA 1 106 GLN HB3 . . 3.710 3.435 3.058 3.723 0.013 8 0 "[ . 1 . 2]" 1
148 1 18 LEU HB2 1 18 LEU MD1 . . 3.050 1.967 1.955 2.023 . 0 0 "[ . 1 . 2]" 1
149 1 18 LEU HB2 1 19 GLU H . . 3.890 2.701 2.453 2.941 . 0 0 "[ . 1 . 2]" 1
150 1 18 LEU HB2 1 20 GLU H . . 4.460 2.703 2.514 2.787 . 0 0 "[ . 1 . 2]" 1
151 1 18 LEU HB2 1 21 THR MG . . 4.000 3.782 3.174 4.017 0.017 13 0 "[ . 1 . 2]" 1
152 1 18 LEU HB3 1 18 LEU MD1 . . 3.100 2.902 2.879 2.919 . 0 0 "[ . 1 . 2]" 1
153 1 18 LEU HB3 1 19 GLU H . . 4.280 2.101 1.985 2.279 . 0 0 "[ . 1 . 2]" 1
154 1 18 LEU HB3 1 20 GLU H . . 3.900 3.036 2.779 3.157 . 0 0 "[ . 1 . 2]" 1
155 1 18 LEU MD1 1 19 GLU H . . 4.500 4.254 4.060 4.448 . 0 0 "[ . 1 . 2]" 1
156 1 18 LEU MD1 1 20 GLU H . . 3.950 3.985 3.907 4.020 0.070 19 0 "[ . 1 . 2]" 1
157 1 18 LEU MD1 1 20 GLU QG . . 3.630 2.952 2.526 3.540 . 0 0 "[ . 1 . 2]" 1
158 1 18 LEU MD1 1 106 GLN QG . . 3.790 3.592 3.301 3.797 0.007 20 0 "[ . 1 . 2]" 1
159 1 18 LEU MD2 1 19 GLU H . . 4.050 3.811 3.596 3.975 . 0 0 "[ . 1 . 2]" 1
160 1 18 LEU MD2 1 106 GLN HB2 . . 3.430 2.688 2.387 2.995 . 0 0 "[ . 1 . 2]" 1
161 1 18 LEU MD2 1 106 GLN HB3 . . 3.360 2.550 2.073 3.045 . 0 0 "[ . 1 . 2]" 1
162 1 18 LEU MD2 1 106 GLN QG . . 3.480 2.768 2.338 3.370 . 0 0 "[ . 1 . 2]" 1
163 1 18 LEU HG 1 106 GLN H . . 4.420 4.156 3.808 4.434 0.014 20 0 "[ . 1 . 2]" 1
164 1 19 GLU H 1 19 GLU QB . . 3.160 2.795 2.633 3.033 . 0 0 "[ . 1 . 2]" 1
165 1 19 GLU H 1 19 GLU HG2 . . 3.950 2.897 1.943 3.493 . 0 0 "[ . 1 . 2]" 1
166 1 19 GLU H 1 19 GLU HG3 . . 3.900 2.230 1.937 3.495 . 0 0 "[ . 1 . 2]" 1
167 1 19 GLU H 1 20 GLU H . . 4.230 2.044 1.870 2.176 . 0 0 "[ . 1 . 2]" 1
168 1 19 GLU H 1 105 LEU MD1 . . 3.990 3.155 2.834 3.993 0.003 7 0 "[ . 1 . 2]" 1
169 1 19 GLU HA 1 19 GLU HG2 . . 3.620 3.788 2.740 4.221 0.601 15 9 "[ -*** *1 * *+ *2]" 1
170 1 19 GLU HA 1 105 LEU MD1 . . 3.400 2.852 1.898 3.408 0.008 15 0 "[ . 1 . 2]" 1
171 1 19 GLU QB 1 20 GLU H . . 3.600 3.600 3.227 3.724 0.124 19 0 "[ . 1 . 2]" 1
172 1 19 GLU QB 1 105 LEU MD1 . . 3.510 2.402 1.873 3.503 . 0 0 "[ . 1 . 2]" 1
173 1 19 GLU HG2 1 105 LEU MD1 . . 3.950 3.189 1.909 3.870 . 0 0 "[ . 1 . 2]" 1
174 1 19 GLU HG3 1 20 GLU H . . 4.100 2.804 2.046 4.111 0.011 20 0 "[ . 1 . 2]" 1
175 1 19 GLU HG3 1 105 LEU MD1 . . 3.940 3.722 2.418 3.971 0.031 10 0 "[ . 1 . 2]" 1
176 1 20 GLU H 1 20 GLU QB . . 3.450 2.718 2.485 3.034 . 0 0 "[ . 1 . 2]" 1
177 1 20 GLU H 1 20 GLU QG . . 3.400 2.065 1.879 2.322 . 0 0 "[ . 1 . 2]" 1
178 1 20 GLU H 1 21 THR H . . 3.860 3.239 2.604 3.698 . 0 0 "[ . 1 . 2]" 1
179 1 20 GLU HA 1 21 THR H . . 3.460 2.755 2.570 3.099 . 0 0 "[ . 1 . 2]" 1
180 1 20 GLU QB 1 21 THR H . . 4.610 4.093 4.068 4.125 . 0 0 "[ . 1 . 2]" 1
181 1 20 GLU QG 1 21 THR H . . 4.820 3.887 3.385 4.125 . 0 0 "[ . 1 . 2]" 1
182 1 21 THR H 1 21 THR HB . . 3.510 3.143 2.760 3.455 . 0 0 "[ . 1 . 2]" 1
183 1 21 THR H 1 21 THR MG . . 3.690 3.301 2.646 3.623 . 0 0 "[ . 1 . 2]" 1
184 1 21 THR H 1 68 LEU MD1 . . 4.680 4.478 4.039 4.757 0.077 5 0 "[ . 1 . 2]" 1
185 1 21 THR HA 1 21 THR MG . . 3.150 2.197 2.065 2.309 . 0 0 "[ . 1 . 2]" 1
186 1 21 THR HA 1 22 ASP H . . 3.050 2.239 2.155 2.688 . 0 0 "[ . 1 . 2]" 1
187 1 21 THR HA 1 68 LEU MD1 . . 3.700 3.635 3.323 3.840 0.140 13 0 "[ . 1 . 2]" 1
188 1 21 THR HB 1 22 ASP H . . 4.040 3.577 2.109 4.111 0.071 6 0 "[ . 1 . 2]" 1
189 1 21 THR HB 1 68 LEU MD1 . . 3.200 1.881 1.766 1.987 . 0 0 "[ . 1 . 2]" 1
190 1 21 THR HB 1 68 LEU MD2 . . 3.700 3.361 2.796 3.711 0.011 18 0 "[ . 1 . 2]" 1
191 1 21 THR HB 1 72 LEU H . . 4.610 4.216 3.860 4.608 . 0 0 "[ . 1 . 2]" 1
192 1 21 THR HB 1 72 LEU MD2 . . 4.010 1.910 1.837 2.095 . 0 0 "[ . 1 . 2]" 1
193 1 21 THR HB 1 72 LEU HG . . 4.240 4.207 3.880 4.284 0.044 7 0 "[ . 1 . 2]" 1
194 1 21 THR MG 1 22 ASP H . . 3.450 3.195 2.771 3.508 0.058 18 0 "[ . 1 . 2]" 1
195 1 21 THR MG 1 25 SER H . . 4.660 4.440 3.886 4.734 0.074 7 0 "[ . 1 . 2]" 1
196 1 21 THR MG 1 25 SER HB2 . . 3.380 2.767 2.122 3.216 . 0 0 "[ . 1 . 2]" 1
197 1 21 THR MG 1 25 SER HB3 . . 3.350 2.116 1.920 2.407 . 0 0 "[ . 1 . 2]" 1
198 1 21 THR MG 1 68 LEU MD1 . . 3.050 1.806 1.657 1.944 . 0 0 "[ . 1 . 2]" 1
199 1 21 THR MG 1 68 LEU MD2 . . 3.360 3.294 2.929 3.413 0.053 20 0 "[ . 1 . 2]" 1
200 1 22 ASP H 1 22 ASP HB2 . . 3.630 2.854 2.201 3.622 . 0 0 "[ . 1 . 2]" 1
201 1 22 ASP H 1 22 ASP HB3 . . 3.530 3.224 2.547 3.655 0.125 12 0 "[ . 1 . 2]" 1
202 1 22 ASP HA 1 23 ARG H . . 3.300 2.649 2.458 2.942 . 0 0 "[ . 1 . 2]" 1
203 1 22 ASP HB2 1 23 ARG H . . 3.540 3.375 2.108 3.976 0.436 1 0 "[ . 1 . 2]" 1
204 1 22 ASP HB3 1 23 ARG H . . 3.970 2.828 1.980 3.597 . 0 0 "[ . 1 . 2]" 1
205 1 23 ARG H 1 23 ARG QB . . 3.280 2.514 2.148 2.633 . 0 0 "[ . 1 . 2]" 1
206 1 23 ARG H 1 23 ARG QD . . 4.260 3.558 2.204 4.201 . 0 0 "[ . 1 . 2]" 1
207 1 23 ARG H 1 23 ARG HG2 . . 3.770 2.679 1.918 4.036 0.266 8 0 "[ . 1 . 2]" 1
208 1 23 ARG H 1 23 ARG HG3 . . 4.000 2.691 1.945 3.471 . 0 0 "[ . 1 . 2]" 1
209 1 23 ARG HA 1 23 ARG HG2 . . 4.010 3.309 2.480 4.048 0.038 17 0 "[ . 1 . 2]" 1
210 1 23 ARG HA 1 23 ARG HG3 . . 4.090 3.386 2.435 4.001 . 0 0 "[ . 1 . 2]" 1
211 1 23 ARG HA 1 24 GLY H . . 2.920 2.311 2.233 2.672 . 0 0 "[ . 1 . 2]" 1
212 1 23 ARG HA 1 25 SER H . . 4.180 3.898 3.303 4.208 0.028 8 0 "[ . 1 . 2]" 1
213 1 23 ARG HA 1 70 GLU H . . 4.340 4.184 3.582 4.380 0.040 8 0 "[ . 1 . 2]" 1
214 1 23 ARG QB 1 23 ARG QD . . 2.850 2.127 2.012 2.304 . 0 0 "[ . 1 . 2]" 1
215 1 23 ARG QB 1 24 GLY H . . 4.180 3.493 2.874 4.095 . 0 0 "[ . 1 . 2]" 1
216 1 23 ARG QB 1 70 GLU HA . . 3.930 2.365 1.766 3.713 . 0 0 "[ . 1 . 2]" 1
217 1 23 ARG QD 1 23 ARG HG2 . . 2.730 2.304 2.184 2.534 . 0 0 "[ . 1 . 2]" 1
218 1 23 ARG QD 1 70 GLU HA . . 3.640 3.329 2.452 3.681 0.041 11 0 "[ . 1 . 2]" 1
219 1 23 ARG QD 1 70 GLU HB2 . . 4.180 3.870 2.072 4.930 0.750 17 2 "[- . 1 . + 2]" 1
220 1 23 ARG HG2 1 70 GLU HA . . 3.840 3.130 1.982 3.911 0.071 7 0 "[ . 1 . 2]" 1
221 1 24 GLY H 1 25 SER H . . 3.930 2.210 1.887 2.739 . 0 0 "[ . 1 . 2]" 1
222 1 24 GLY H 1 68 LEU H . . 4.640 3.417 2.776 3.984 . 0 0 "[ . 1 . 2]" 1
223 1 24 GLY H 1 68 LEU HB2 . . 3.900 2.783 2.026 3.529 . 0 0 "[ . 1 . 2]" 1
224 1 24 GLY H 1 68 LEU MD1 . . 3.840 3.838 3.520 3.939 0.099 7 0 "[ . 1 . 2]" 1
225 1 24 GLY HA2 1 67 LEU HB3 . . 4.080 3.238 2.362 3.993 . 0 0 "[ . 1 . 2]" 1
226 1 24 GLY HA2 1 67 LEU MD1 . . 4.110 3.775 3.408 4.102 . 0 0 "[ . 1 . 2]" 1
227 1 25 SER H 1 25 SER HB2 . . 3.520 2.402 2.124 2.611 . 0 0 "[ . 1 . 2]" 1
228 1 25 SER H 1 25 SER HB3 . . 3.610 3.077 2.798 3.316 . 0 0 "[ . 1 . 2]" 1
229 1 25 SER H 1 67 LEU MD1 . . 4.280 3.976 3.533 4.303 0.023 19 0 "[ . 1 . 2]" 1
230 1 25 SER H 1 68 LEU H . . 4.620 2.644 2.328 3.014 . 0 0 "[ . 1 . 2]" 1
231 1 25 SER H 1 68 LEU HB2 . . 4.000 2.670 2.064 3.323 . 0 0 "[ . 1 . 2]" 1
232 1 25 SER H 1 68 LEU MD1 . . 4.680 2.754 2.275 3.167 . 0 0 "[ . 1 . 2]" 1
233 1 25 SER HA 1 26 LEU H . . 2.870 2.286 2.250 2.362 . 0 0 "[ . 1 . 2]" 1
234 1 25 SER HA 1 26 LEU HB3 . . 4.230 4.384 4.353 4.463 0.233 15 0 "[ . 1 . 2]" 1
235 1 25 SER HA 1 67 LEU MD1 . . 4.150 4.077 3.649 4.198 0.048 7 0 "[ . 1 . 2]" 1
236 1 25 SER HB2 1 68 LEU HB2 . . 3.910 3.623 3.232 3.922 0.012 3 0 "[ . 1 . 2]" 1
237 1 25 SER HB2 1 68 LEU MD1 . . 3.530 2.228 1.956 2.870 . 0 0 "[ . 1 . 2]" 1
238 1 25 SER HB3 1 26 LEU H . . 3.590 3.585 3.365 3.642 0.052 11 0 "[ . 1 . 2]" 1
239 1 25 SER HB3 1 68 LEU MD1 . . 3.740 1.962 1.781 3.001 . 0 0 "[ . 1 . 2]" 1
240 1 25 SER HB3 1 68 LEU HG . . 3.750 3.768 3.566 3.816 0.066 20 0 "[ . 1 . 2]" 1
241 1 26 LEU H 1 26 LEU HB2 . . 3.340 2.879 2.747 2.942 . 0 0 "[ . 1 . 2]" 1
242 1 26 LEU H 1 26 LEU HB3 . . 3.390 2.162 2.126 2.196 . 0 0 "[ . 1 . 2]" 1
243 1 26 LEU H 1 26 LEU MD2 . . 4.140 4.225 4.186 4.258 0.118 12 0 "[ . 1 . 2]" 1
244 1 26 LEU H 1 26 LEU HG . . 4.180 4.112 4.043 4.205 0.025 15 0 "[ . 1 . 2]" 1
245 1 26 LEU HA 1 26 LEU MD1 . . 2.960 2.057 1.991 2.129 . 0 0 "[ . 1 . 2]" 1
246 1 26 LEU HA 1 26 LEU MD2 . . 3.620 3.846 3.833 3.874 0.254 6 0 "[ . 1 . 2]" 1
247 1 26 LEU HA 1 26 LEU HG . . 3.850 3.551 3.476 3.575 . 0 0 "[ . 1 . 2]" 1
248 1 26 LEU HA 1 27 VAL H . . 3.090 2.179 2.176 2.184 . 0 0 "[ . 1 . 2]" 1
249 1 26 LEU HA 1 27 VAL MG2 . . 3.880 3.746 3.466 3.889 0.009 15 0 "[ . 1 . 2]" 1
250 1 26 LEU HA 1 28 GLY H . . 4.310 3.740 3.568 3.950 . 0 0 "[ . 1 . 2]" 1
251 1 26 LEU HA 1 67 LEU HA . . 3.600 3.141 2.921 3.298 . 0 0 "[ . 1 . 2]" 1
252 1 26 LEU HA 1 67 LEU MD1 . . 3.110 2.237 1.963 2.469 . 0 0 "[ . 1 . 2]" 1
253 1 26 LEU HA 1 68 LEU H . . 4.600 4.606 4.538 4.646 0.046 12 0 "[ . 1 . 2]" 1
254 1 26 LEU HB2 1 26 LEU MD1 . . 2.920 2.585 2.440 2.606 . 0 0 "[ . 1 . 2]" 1
255 1 26 LEU HB3 1 26 LEU MD2 . . 3.090 2.481 2.457 2.501 . 0 0 "[ . 1 . 2]" 1
256 1 26 LEU MD1 1 27 VAL H . . 3.290 2.201 2.113 2.638 . 0 0 "[ . 1 . 2]" 1
257 1 26 LEU MD1 1 27 VAL HA . . 4.030 3.882 3.787 4.072 0.042 15 0 "[ . 1 . 2]" 1
258 1 26 LEU MD1 1 28 GLY H . . 3.260 1.844 1.739 1.918 . 0 0 "[ . 1 . 2]" 1
259 1 26 LEU MD1 1 65 ASN HA . . 3.530 3.255 2.461 3.562 0.032 4 0 "[ . 1 . 2]" 1
260 1 26 LEU MD1 1 65 ASN HB2 . . 3.300 3.396 3.076 3.760 0.460 7 0 "[ . 1 . 2]" 1
261 1 26 LEU MD1 1 65 ASN HD21 . . 4.150 2.983 1.957 3.766 . 0 0 "[ . 1 . 2]" 1
262 1 26 LEU MD1 1 65 ASN HD22 . . 3.770 3.448 2.716 4.065 0.295 9 0 "[ . 1 . 2]" 1
263 1 26 LEU MD1 1 66 LEU H . . 3.540 2.650 2.326 2.945 . 0 0 "[ . 1 . 2]" 1
264 1 26 LEU HG 1 27 VAL H . . 4.080 4.122 4.087 4.159 0.079 13 0 "[ . 1 . 2]" 1
265 1 26 LEU HG 1 28 GLY H . . 3.800 3.751 3.504 3.864 0.064 15 0 "[ . 1 . 2]" 1
266 1 27 VAL H 1 27 VAL HB . . 3.440 2.330 2.235 2.464 . 0 0 "[ . 1 . 2]" 1
267 1 27 VAL H 1 27 VAL MG1 . . 3.760 3.696 3.653 3.731 . 0 0 "[ . 1 . 2]" 1
268 1 27 VAL H 1 27 VAL MG2 . . 3.160 2.358 1.946 2.564 . 0 0 "[ . 1 . 2]" 1
269 1 27 VAL H 1 28 GLY H . . 3.550 2.393 2.268 2.563 . 0 0 "[ . 1 . 2]" 1
270 1 27 VAL H 1 67 LEU HA . . 4.270 3.350 2.958 3.702 . 0 0 "[ . 1 . 2]" 1
271 1 27 VAL H 1 68 LEU H . . 4.670 4.624 4.359 4.718 0.048 13 0 "[ . 1 . 2]" 1
272 1 27 VAL HA 1 27 VAL MG1 . . 3.050 2.426 2.331 2.503 . 0 0 "[ . 1 . 2]" 1
273 1 27 VAL HA 1 27 VAL MG2 . . 3.060 2.347 2.242 2.455 . 0 0 "[ . 1 . 2]" 1
274 1 27 VAL HB 1 28 GLY H . . 3.610 2.730 2.502 2.879 . 0 0 "[ . 1 . 2]" 1
275 1 27 VAL HB 1 57 LEU MD2 . . 3.920 3.214 2.868 3.463 . 0 0 "[ . 1 . 2]" 1
276 1 27 VAL HB 1 66 LEU HB2 . . 3.630 2.848 2.208 3.502 . 0 0 "[ . 1 . 2]" 1
277 1 27 VAL HB 1 66 LEU HB3 . . 3.590 1.963 1.936 1.985 . 0 0 "[ . 1 . 2]" 1
278 1 27 VAL HB 1 66 LEU MD2 . . 3.430 3.184 2.976 3.390 . 0 0 "[ . 1 . 2]" 1
279 1 27 VAL HB 1 103 ILE MD . . 3.870 3.892 3.811 3.961 0.091 19 0 "[ . 1 . 2]" 1
280 1 27 VAL MG1 1 28 GLY H . . 3.930 3.553 3.333 3.817 . 0 0 "[ . 1 . 2]" 1
281 1 27 VAL MG1 1 57 LEU MD2 . . 2.970 2.993 2.829 3.039 0.069 13 0 "[ . 1 . 2]" 1
282 1 27 VAL MG1 1 66 LEU HB2 . . 3.520 3.580 3.552 3.614 0.094 19 0 "[ . 1 . 2]" 1
283 1 27 VAL MG1 1 66 LEU MD1 . . 3.910 3.389 3.148 3.564 . 0 0 "[ . 1 . 2]" 1
284 1 27 VAL MG1 1 103 ILE MD . . 3.070 1.925 1.847 2.069 . 0 0 "[ . 1 . 2]" 1
285 1 27 VAL MG1 1 103 ILE HG12 . . 3.990 3.033 2.862 3.339 . 0 0 "[ . 1 . 2]" 1
286 1 27 VAL MG1 1 103 ILE MG . . 3.910 2.449 2.282 2.646 . 0 0 "[ . 1 . 2]" 1
287 1 27 VAL MG2 1 28 GLY H . . 3.890 3.938 3.726 4.069 0.179 19 0 "[ . 1 . 2]" 1
288 1 27 VAL MG2 1 57 LEU MD2 . . 2.880 1.935 1.789 2.141 . 0 0 "[ . 1 . 2]" 1
289 1 27 VAL MG2 1 66 LEU HB3 . . 3.460 3.034 2.444 3.482 0.022 19 0 "[ . 1 . 2]" 1
290 1 27 VAL MG2 1 67 LEU HA . . 3.660 3.424 3.046 3.646 . 0 0 "[ . 1 . 2]" 1
291 1 27 VAL MG2 1 68 LEU H . . 3.690 3.412 3.102 3.574 . 0 0 "[ . 1 . 2]" 1
292 1 27 VAL MG2 1 68 LEU HA . . 4.100 3.642 3.431 3.799 . 0 0 "[ . 1 . 2]" 1
293 1 27 VAL MG2 1 68 LEU MD1 . . 2.940 2.282 1.948 2.793 . 0 0 "[ . 1 . 2]" 1
294 1 27 VAL MG2 1 68 LEU MD2 . . 2.870 1.916 1.647 2.155 . 0 0 "[ . 1 . 2]" 1
295 1 27 VAL MG2 1 68 LEU HG . . 3.630 1.937 1.785 2.380 . 0 0 "[ . 1 . 2]" 1
296 1 27 VAL MG2 1 103 ILE MG . . 4.020 3.771 3.381 4.082 0.062 3 0 "[ . 1 . 2]" 1
297 1 28 GLY H 1 66 LEU H . . 4.100 2.608 2.324 2.810 . 0 0 "[ . 1 . 2]" 1
298 1 28 GLY H 1 66 LEU HB2 . . 3.980 2.794 2.266 3.439 . 0 0 "[ . 1 . 2]" 1
299 1 28 GLY H 1 66 LEU HB3 . . 3.930 3.388 3.115 3.711 . 0 0 "[ . 1 . 2]" 1
300 1 29 ASN HA 1 30 LEU H . . 3.330 2.329 2.280 2.369 . 0 0 "[ . 1 . 2]" 1
301 1 29 ASN HA 1 30 LEU HB2 . . 4.170 4.203 4.151 4.266 0.096 3 0 "[ . 1 . 2]" 1
302 1 29 ASN HA 1 31 ALA H . . 4.550 4.244 3.807 4.576 0.026 15 0 "[ . 1 . 2]" 1
303 1 29 ASN HA 1 65 ASN HA . . 3.410 2.291 2.009 2.532 . 0 0 "[ . 1 . 2]" 1
304 1 29 ASN HA 1 66 LEU H . . 3.770 3.395 3.181 3.767 . 0 0 "[ . 1 . 2]" 1
305 1 29 ASN HB2 1 32 LYS H . . 4.550 3.495 2.104 4.386 . 0 0 "[ . 1 . 2]" 1
306 1 29 ASN HB2 1 32 LYS QB . . 3.380 2.590 1.982 3.164 . 0 0 "[ . 1 . 2]" 1
307 1 29 ASN HB3 1 29 ASN HD21 . . 3.660 2.640 2.103 3.521 . 0 0 "[ . 1 . 2]" 1
308 1 29 ASN HB3 1 29 ASN HD22 . . 3.990 3.696 3.446 4.132 0.142 10 0 "[ . 1 . 2]" 1
309 1 29 ASN HB3 1 32 LYS QB . . 3.870 2.178 1.934 3.071 . 0 0 "[ . 1 . 2]" 1
310 1 30 LEU H 1 30 LEU HB2 . . 3.610 2.617 2.366 2.729 . 0 0 "[ . 1 . 2]" 1
311 1 30 LEU H 1 30 LEU HB3 . . 3.520 2.753 2.690 2.817 . 0 0 "[ . 1 . 2]" 1
312 1 30 LEU H 1 30 LEU MD1 . . 4.150 4.075 3.853 4.178 0.028 15 0 "[ . 1 . 2]" 1
313 1 30 LEU H 1 31 ALA H . . 3.520 2.159 1.925 2.381 . 0 0 "[ . 1 . 2]" 1
314 1 30 LEU H 1 65 ASN HA . . 4.070 3.229 2.787 3.912 . 0 0 "[ . 1 . 2]" 1
315 1 30 LEU H 1 66 LEU H . . 4.700 4.478 4.220 4.715 0.015 9 0 "[ . 1 . 2]" 1
316 1 30 LEU HA 1 30 LEU MD1 . . 3.000 2.116 1.889 2.763 . 0 0 "[ . 1 . 2]" 1
317 1 30 LEU HA 1 30 LEU MD2 . . 3.710 3.794 3.716 3.849 0.139 20 0 "[ . 1 . 2]" 1
318 1 30 LEU HA 1 30 LEU HG . . 3.630 2.794 2.396 3.138 . 0 0 "[ . 1 . 2]" 1
319 1 30 LEU HA 1 33 ASP HB2 . . 3.700 2.125 1.990 2.552 . 0 0 "[ . 1 . 2]" 1
320 1 30 LEU HA 1 33 ASP HB3 . . 4.350 3.515 3.328 3.961 . 0 0 "[ . 1 . 2]" 1
321 1 30 LEU HA 1 34 LEU H . . 4.580 4.077 3.728 4.542 . 0 0 "[ . 1 . 2]" 1
322 1 30 LEU HB2 1 30 LEU MD1 . . 3.110 2.327 2.054 2.538 . 0 0 "[ . 1 . 2]" 1
323 1 30 LEU HB2 1 30 LEU MD2 . . 3.140 2.435 2.128 2.849 . 0 0 "[ . 1 . 2]" 1
324 1 30 LEU HB2 1 59 LEU MD1 . . 3.570 2.878 2.247 3.477 . 0 0 "[ . 1 . 2]" 1
325 1 30 LEU HB2 1 66 LEU MD1 . . 3.370 2.096 1.953 2.527 . 0 0 "[ . 1 . 2]" 1
326 1 30 LEU HB2 1 66 LEU HG . . 3.700 3.717 3.616 3.761 0.061 10 0 "[ . 1 . 2]" 1
327 1 30 LEU HB3 1 30 LEU MD1 . . 3.600 3.193 3.087 3.223 . 0 0 "[ . 1 . 2]" 1
328 1 30 LEU HB3 1 30 LEU MD2 . . 3.200 2.261 1.958 2.546 . 0 0 "[ . 1 . 2]" 1
329 1 30 LEU HB3 1 31 ALA H . . 4.100 2.565 2.186 3.216 . 0 0 "[ . 1 . 2]" 1
330 1 30 LEU HB3 1 59 LEU MD1 . . 3.640 2.648 1.960 3.186 . 0 0 "[ . 1 . 2]" 1
331 1 30 LEU HB3 1 66 LEU MD1 . . 3.940 3.543 3.377 3.940 . 13 0 "[ . 1 . 2]" 1
332 1 30 LEU MD1 1 66 LEU MD1 . . 3.340 1.945 1.722 2.422 . 0 0 "[ . 1 . 2]" 1
333 1 30 LEU MD2 1 59 LEU MD1 . . 3.130 2.719 1.971 3.156 0.026 20 0 "[ . 1 . 2]" 1
334 1 30 LEU MD2 1 66 LEU MD1 . . 3.220 2.515 1.842 3.237 0.017 14 0 "[ . 1 . 2]" 1
335 1 31 ALA H 1 31 ALA MB . . 2.770 2.141 2.092 2.201 . 0 0 "[ . 1 . 2]" 1
336 1 31 ALA H 1 32 LYS H . . 3.460 2.566 2.297 2.802 . 0 0 "[ . 1 . 2]" 1
337 1 31 ALA H 1 32 LYS QB . . 4.600 4.288 4.059 4.488 . 0 0 "[ . 1 . 2]" 1
338 1 31 ALA H 1 41 LEU MD1 . . 3.830 3.348 2.982 3.732 . 0 0 "[ . 1 . 2]" 1
339 1 31 ALA H 1 64 GLY HA2 . . 4.240 3.819 3.140 4.458 0.218 4 0 "[ . 1 . 2]" 1
340 1 31 ALA H 1 64 GLY HA3 . . 4.770 3.616 2.631 4.088 . 0 0 "[ . 1 . 2]" 1
341 1 31 ALA HA 1 34 LEU H . . 4.470 3.945 3.545 4.324 . 0 0 "[ . 1 . 2]" 1
342 1 31 ALA HA 1 36 LEU H . . 3.700 3.513 3.338 3.704 0.004 1 0 "[ . 1 . 2]" 1
343 1 31 ALA HA 1 36 LEU HB2 . . 3.850 2.679 2.375 3.005 . 0 0 "[ . 1 . 2]" 1
344 1 31 ALA HA 1 36 LEU MD1 . . 3.940 3.532 3.183 3.937 . 0 0 "[ . 1 . 2]" 1
345 1 31 ALA HA 1 41 LEU MD1 . . 3.260 2.914 2.655 3.263 0.003 19 0 "[ . 1 . 2]" 1
346 1 31 ALA HA 1 41 LEU MD2 . . 3.570 2.693 2.421 2.975 . 0 0 "[ . 1 . 2]" 1
347 1 31 ALA MB 1 32 LYS H . . 2.960 2.686 2.292 2.981 0.021 14 0 "[ . 1 . 2]" 1
348 1 31 ALA MB 1 38 LEU H . . 4.920 3.753 3.455 3.948 . 0 0 "[ . 1 . 2]" 1
349 1 31 ALA MB 1 38 LEU HA . . 3.530 2.971 2.652 3.174 . 0 0 "[ . 1 . 2]" 1
350 1 31 ALA MB 1 38 LEU MD2 . . 3.510 2.495 2.051 2.718 . 0 0 "[ . 1 . 2]" 1
351 1 31 ALA MB 1 41 LEU H . . 3.930 3.946 3.894 3.997 0.067 19 0 "[ . 1 . 2]" 1
352 1 31 ALA MB 1 41 LEU HB2 . . 3.880 2.828 2.747 2.963 . 0 0 "[ . 1 . 2]" 1
353 1 31 ALA MB 1 41 LEU HB3 . . 3.460 3.447 3.321 3.552 0.092 19 0 "[ . 1 . 2]" 1
354 1 31 ALA MB 1 41 LEU MD1 . . 2.700 2.714 2.665 2.838 0.138 19 0 "[ . 1 . 2]" 1
355 1 31 ALA MB 1 41 LEU MD2 . . 3.130 3.025 2.580 3.148 0.018 1 0 "[ . 1 . 2]" 1
356 1 31 ALA MB 1 41 LEU HG . . 3.680 1.863 1.757 1.929 . 0 0 "[ . 1 . 2]" 1
357 1 31 ALA MB 1 64 GLY HA2 . . 3.300 3.171 2.783 3.678 0.378 4 0 "[ . 1 . 2]" 1
358 1 31 ALA MB 1 64 GLY HA3 . . 3.970 2.673 2.150 2.982 . 0 0 "[ . 1 . 2]" 1
359 1 32 LYS H 1 32 LYS QB . . 2.920 2.080 2.018 2.175 . 0 0 "[ . 1 . 2]" 1
360 1 32 LYS H 1 32 LYS HG2 . . 3.910 3.642 3.277 3.909 . 0 0 "[ . 1 . 2]" 1
361 1 32 LYS H 1 32 LYS HG3 . . 3.900 3.796 3.076 3.922 0.022 15 0 "[ . 1 . 2]" 1
362 1 32 LYS H 1 33 ASP HB2 . . 4.830 4.136 3.893 4.390 . 0 0 "[ . 1 . 2]" 1
363 1 32 LYS HA 1 32 LYS QB . . 2.670 2.531 2.495 2.547 . 0 0 "[ . 1 . 2]" 1
364 1 32 LYS HA 1 32 LYS QD . . 3.710 2.946 2.271 3.545 . 0 0 "[ . 1 . 2]" 1
365 1 32 LYS HA 1 32 LYS HG2 . . 3.130 2.122 1.921 3.562 0.432 6 0 "[ . 1 . 2]" 1
366 1 32 LYS HA 1 32 LYS HG3 . . 3.610 3.281 2.379 3.526 . 0 0 "[ . 1 . 2]" 1
367 1 32 LYS QB 1 33 ASP H . . 3.280 3.050 2.751 3.288 0.008 17 0 "[ . 1 . 2]" 1
368 1 32 LYS QD 1 32 LYS HG2 . . 2.570 2.274 2.180 2.443 . 0 0 "[ . 1 . 2]" 1
369 1 32 LYS QE 1 32 LYS HG3 . . 2.640 2.205 1.962 2.492 . 0 0 "[ . 1 . 2]" 1
370 1 33 ASP H 1 33 ASP HB2 . . 3.760 2.058 2.006 2.182 . 0 0 "[ . 1 . 2]" 1
371 1 33 ASP H 1 33 ASP HB3 . . 3.510 3.326 3.172 3.470 . 0 0 "[ . 1 . 2]" 1
372 1 33 ASP H 1 34 LEU H . . 3.680 2.905 2.577 3.269 . 0 0 "[ . 1 . 2]" 1
373 1 33 ASP H 1 35 GLY H . . 4.450 3.560 3.320 3.900 . 0 0 "[ . 1 . 2]" 1
374 1 33 ASP HB2 1 34 LEU H . . 4.050 2.655 2.374 2.945 . 0 0 "[ . 1 . 2]" 1
375 1 33 ASP HB3 1 34 LEU H . . 4.250 2.515 2.053 2.857 . 0 0 "[ . 1 . 2]" 1
376 1 34 LEU H 1 34 LEU HB2 . . 3.450 2.520 2.194 2.672 . 0 0 "[ . 1 . 2]" 1
377 1 34 LEU H 1 34 LEU HB3 . . 3.800 3.554 3.472 3.623 . 0 0 "[ . 1 . 2]" 1
378 1 34 LEU H 1 34 LEU MD1 . . 3.700 3.733 3.663 3.790 0.090 18 0 "[ . 1 . 2]" 1
379 1 34 LEU H 1 34 LEU MD2 . . 3.800 2.638 1.988 3.219 . 0 0 "[ . 1 . 2]" 1
380 1 34 LEU H 1 34 LEU HG . . 3.860 2.530 2.048 3.889 0.029 15 0 "[ . 1 . 2]" 1
381 1 34 LEU H 1 35 GLY H . . 3.630 2.607 2.501 2.778 . 0 0 "[ . 1 . 2]" 1
382 1 34 LEU HA 1 34 LEU MD1 . . 3.730 3.441 1.956 3.854 0.124 6 0 "[ . 1 . 2]" 1
383 1 34 LEU HA 1 34 LEU MD2 . . 2.730 2.105 1.956 2.643 . 0 0 "[ . 1 . 2]" 1
384 1 34 LEU HB2 1 34 LEU MD1 . . 3.310 2.650 2.419 3.220 . 0 0 "[ . 1 . 2]" 1
385 1 34 LEU HB2 1 35 GLY H . . 4.430 3.579 3.126 4.104 . 0 0 "[ . 1 . 2]" 1
386 1 34 LEU HB2 1 36 LEU H . . 4.290 2.930 2.676 3.224 . 0 0 "[ . 1 . 2]" 1
387 1 34 LEU HB3 1 34 LEU MD1 . . 2.930 2.212 2.128 2.361 . 0 0 "[ . 1 . 2]" 1
388 1 34 LEU HB3 1 34 LEU MD2 . . 3.010 2.636 2.419 3.222 0.212 12 0 "[ . 1 . 2]" 1
389 1 35 GLY H 1 36 LEU H . . 3.240 2.482 2.218 2.836 . 0 0 "[ . 1 . 2]" 1
390 1 35 GLY H 1 36 LEU HG . . 4.470 4.279 4.003 4.478 0.008 6 0 "[ . 1 . 2]" 1
391 1 36 LEU H 1 36 LEU HB2 . . 3.590 2.393 2.239 2.464 . 0 0 "[ . 1 . 2]" 1
392 1 36 LEU H 1 36 LEU HB3 . . 3.840 3.563 3.500 3.582 . 0 0 "[ . 1 . 2]" 1
393 1 36 LEU H 1 36 LEU MD1 . . 3.840 3.526 3.278 3.725 . 0 0 "[ . 1 . 2]" 1
394 1 36 LEU H 1 36 LEU MD2 . . 3.650 3.617 3.547 3.662 0.012 6 0 "[ . 1 . 2]" 1
395 1 36 LEU H 1 36 LEU HG . . 3.430 2.467 2.317 2.694 . 0 0 "[ . 1 . 2]" 1
396 1 36 LEU H 1 37 SER H . . 4.610 4.585 4.528 4.629 0.019 20 0 "[ . 1 . 2]" 1
397 1 36 LEU HA 1 36 LEU MD2 . . 2.830 2.214 1.998 2.413 . 0 0 "[ . 1 . 2]" 1
398 1 36 LEU HA 1 37 SER H . . 3.280 2.514 2.275 2.644 . 0 0 "[ . 1 . 2]" 1
399 1 36 LEU HB2 1 36 LEU MD1 . . 2.950 2.261 2.186 2.352 . 0 0 "[ . 1 . 2]" 1
400 1 36 LEU HB2 1 36 LEU MD2 . . 3.260 3.208 3.181 3.221 . 0 0 "[ . 1 . 2]" 1
401 1 36 LEU HB2 1 37 SER H . . 4.870 3.597 3.354 4.048 . 0 0 "[ . 1 . 2]" 1
402 1 36 LEU HB2 1 41 LEU MD2 . . 3.350 2.083 1.937 2.235 . 0 0 "[ . 1 . 2]" 1
403 1 36 LEU HB3 1 37 SER H . . 3.870 2.407 2.147 2.982 . 0 0 "[ . 1 . 2]" 1
404 1 36 LEU HB3 1 40 GLU HB2 . . 3.560 3.099 2.736 3.340 . 0 0 "[ . 1 . 2]" 1
405 1 36 LEU HB3 1 40 GLU HB3 . . 3.970 2.992 2.658 3.518 . 0 0 "[ . 1 . 2]" 1
406 1 36 LEU HB3 1 41 LEU MD2 . . 3.330 2.400 2.192 2.644 . 0 0 "[ . 1 . 2]" 1
407 1 36 LEU MD2 1 37 SER H . . 3.650 3.380 3.011 3.620 . 0 0 "[ . 1 . 2]" 1
408 1 36 LEU MD2 1 40 GLU HB3 . . 3.380 3.325 2.991 3.399 0.019 17 0 "[ . 1 . 2]" 1
409 1 37 SER H 1 37 SER HB2 . . 3.590 2.422 2.067 2.780 . 0 0 "[ . 1 . 2]" 1
410 1 37 SER H 1 37 SER HB3 . . 4.080 3.265 2.580 3.730 . 0 0 "[ . 1 . 2]" 1
411 1 37 SER H 1 40 GLU HB2 . . 3.800 2.315 1.978 2.777 . 0 0 "[ . 1 . 2]" 1
412 1 37 SER H 1 40 GLU HB3 . . 4.370 3.473 2.895 4.106 . 0 0 "[ . 1 . 2]" 1
413 1 37 SER HB2 1 38 LEU H . . 4.400 4.132 3.837 4.366 . 0 0 "[ . 1 . 2]" 1
414 1 37 SER HB3 1 38 LEU H . . 4.100 3.155 2.711 3.960 . 0 0 "[ . 1 . 2]" 1
415 1 37 SER HB3 1 39 ARG H . . 4.420 3.237 2.908 3.834 . 0 0 "[ . 1 . 2]" 1
416 1 37 SER HB3 1 40 GLU H . . 4.720 2.999 2.445 3.835 . 0 0 "[ . 1 . 2]" 1
417 1 38 LEU H 1 38 LEU HB2 . . 3.660 2.088 2.042 2.138 . 0 0 "[ . 1 . 2]" 1
418 1 38 LEU H 1 38 LEU HB3 . . 3.760 3.400 3.355 3.441 . 0 0 "[ . 1 . 2]" 1
419 1 38 LEU H 1 38 LEU HG . . 4.120 4.027 3.881 4.121 0.001 14 0 "[ . 1 . 2]" 1
420 1 38 LEU H 1 39 ARG H . . 4.160 3.061 2.966 3.169 . 0 0 "[ . 1 . 2]" 1
421 1 38 LEU HA 1 38 LEU MD1 . . 3.060 2.083 1.953 2.387 . 0 0 "[ . 1 . 2]" 1
422 1 38 LEU HA 1 38 LEU MD2 . . 3.170 2.501 2.146 2.800 . 0 0 "[ . 1 . 2]" 1
423 1 38 LEU HA 1 41 LEU H . . 4.080 3.321 3.215 3.452 . 0 0 "[ . 1 . 2]" 1
424 1 38 LEU HA 1 41 LEU HB2 . . 3.690 2.457 2.256 2.561 . 0 0 "[ . 1 . 2]" 1
425 1 38 LEU HA 1 41 LEU HB3 . . 3.860 3.837 3.646 3.882 0.022 15 0 "[ . 1 . 2]" 1
426 1 38 LEU HB2 1 38 LEU MD1 . . 3.260 3.212 3.190 3.220 . 0 0 "[ . 1 . 2]" 1
427 1 38 LEU HB2 1 38 LEU MD2 . . 2.650 2.336 2.203 2.477 . 0 0 "[ . 1 . 2]" 1
428 1 38 LEU HB2 1 39 ARG H . . 3.600 2.775 2.660 2.922 . 0 0 "[ . 1 . 2]" 1
429 1 38 LEU HB3 1 38 LEU MD2 . . 3.340 3.200 3.182 3.213 . 0 0 "[ . 1 . 2]" 1
430 1 38 LEU MD1 1 63 SER HA . . 3.650 3.306 2.591 3.974 0.324 19 0 "[ . 1 . 2]" 1
431 1 38 LEU MD1 1 64 GLY H . . 4.290 2.803 2.084 3.715 . 0 0 "[ . 1 . 2]" 1
432 1 38 LEU MD1 1 64 GLY HA2 . . 3.670 2.765 2.299 3.372 . 0 0 "[ . 1 . 2]" 1
433 1 38 LEU MD1 1 64 GLY HA3 . . 3.570 2.683 2.105 3.533 . 0 0 "[ . 1 . 2]" 1
434 1 38 LEU MD2 1 63 SER HA . . 4.160 3.423 2.430 3.663 . 0 0 "[ . 1 . 2]" 1
435 1 38 LEU MD2 1 64 GLY H . . 4.550 3.885 2.829 4.288 . 0 0 "[ . 1 . 2]" 1
436 1 38 LEU MD2 1 64 GLY HA2 . . 3.910 3.416 2.937 3.616 . 0 0 "[ . 1 . 2]" 1
437 1 38 LEU MD2 1 64 GLY HA3 . . 3.960 2.234 1.979 2.681 . 0 0 "[ . 1 . 2]" 1
438 1 39 ARG H 1 39 ARG HB2 . . 3.340 2.171 2.113 2.272 . 0 0 "[ . 1 . 2]" 1
439 1 39 ARG H 1 39 ARG HB3 . . 3.450 2.914 2.747 3.037 . 0 0 "[ . 1 . 2]" 1
440 1 39 ARG H 1 40 GLU H . . 3.830 3.047 2.921 3.148 . 0 0 "[ . 1 . 2]" 1
441 1 39 ARG HA 1 39 ARG QD . . 3.860 3.653 3.517 3.902 0.042 4 0 "[ . 1 . 2]" 1
442 1 39 ARG HA 1 39 ARG HG2 . . 3.250 3.150 2.360 3.260 0.010 5 0 "[ . 1 . 2]" 1
443 1 39 ARG HA 1 39 ARG HG3 . . 3.160 2.272 2.114 3.125 . 0 0 "[ . 1 . 2]" 1
444 1 39 ARG HA 1 42 ILE H . . 4.110 3.342 3.180 3.538 . 0 0 "[ . 1 . 2]" 1
445 1 39 ARG HA 1 42 ILE HB . . 3.590 2.279 2.136 2.538 . 0 0 "[ . 1 . 2]" 1
446 1 39 ARG HA 1 42 ILE MD . . 3.750 2.383 2.157 3.604 . 0 0 "[ . 1 . 2]" 1
447 1 39 ARG HB2 1 39 ARG QD . . 3.860 2.203 2.031 3.026 . 0 0 "[ . 1 . 2]" 1
448 1 39 ARG HB2 1 39 ARG HG2 . . 2.990 2.993 2.907 3.027 0.037 6 0 "[ . 1 . 2]" 1
449 1 39 ARG HB2 1 39 ARG HG3 . . 2.980 2.676 2.269 2.772 . 0 0 "[ . 1 . 2]" 1
450 1 39 ARG HB3 1 39 ARG QD . . 3.820 2.821 1.965 3.110 . 0 0 "[ . 1 . 2]" 1
451 1 39 ARG HB3 1 40 GLU H . . 3.740 2.376 2.218 2.550 . 0 0 "[ . 1 . 2]" 1
452 1 39 ARG HB3 1 40 GLU HA . . 4.140 3.856 3.739 3.984 . 0 0 "[ . 1 . 2]" 1
453 1 39 ARG HG2 1 40 GLU H . . 4.290 4.176 3.932 4.292 0.002 2 0 "[ . 1 . 2]" 1
454 1 39 ARG HG2 1 43 THR MG . . 3.820 2.444 2.137 2.870 . 0 0 "[ . 1 . 2]" 1
455 1 39 ARG HG3 1 43 THR MG . . 3.430 3.070 2.804 3.441 0.011 4 0 "[ . 1 . 2]" 1
456 1 40 GLU H 1 40 GLU HB2 . . 3.370 2.123 2.045 2.273 . 0 0 "[ . 1 . 2]" 1
457 1 40 GLU H 1 40 GLU HB3 . . 3.500 3.422 3.331 3.511 0.011 10 0 "[ . 1 . 2]" 1
458 1 40 GLU H 1 40 GLU HG2 . . 3.850 3.833 2.768 4.155 0.305 1 0 "[ . 1 . 2]" 1
459 1 40 GLU H 1 40 GLU HG3 . . 4.150 3.383 2.666 3.844 . 0 0 "[ . 1 . 2]" 1
460 1 40 GLU H 1 41 LEU H . . 3.620 2.820 2.728 2.978 . 0 0 "[ . 1 . 2]" 1
461 1 40 GLU HA 1 40 GLU HG2 . . 3.880 2.736 2.093 3.539 . 0 0 "[ . 1 . 2]" 1
462 1 40 GLU HA 1 40 GLU HG3 . . 3.660 2.643 2.175 3.595 . 0 0 "[ . 1 . 2]" 1
463 1 40 GLU HA 1 43 THR H . . 4.110 3.352 3.179 3.638 . 0 0 "[ . 1 . 2]" 1
464 1 40 GLU HB2 1 41 LEU H . . 3.870 2.826 2.555 2.999 . 0 0 "[ . 1 . 2]" 1
465 1 40 GLU HB2 1 41 LEU MD2 . . 4.040 3.353 3.118 3.604 . 0 0 "[ . 1 . 2]" 1
466 1 40 GLU HB3 1 41 LEU H . . 3.760 3.111 2.854 3.300 . 0 0 "[ . 1 . 2]" 1
467 1 40 GLU HB3 1 41 LEU MD2 . . 3.590 2.809 2.626 3.102 . 0 0 "[ . 1 . 2]" 1
468 1 41 LEU H 1 41 LEU HB2 . . 3.230 2.088 2.060 2.125 . 0 0 "[ . 1 . 2]" 1
469 1 41 LEU H 1 41 LEU HB3 . . 3.430 3.402 3.374 3.431 0.001 1 0 "[ . 1 . 2]" 1
470 1 41 LEU H 1 41 LEU MD2 . . 3.870 2.371 2.174 2.489 . 0 0 "[ . 1 . 2]" 1
471 1 41 LEU H 1 41 LEU HG . . 3.700 3.594 3.477 3.705 0.005 19 0 "[ . 1 . 2]" 1
472 1 41 LEU H 1 42 ILE H . . 3.780 2.604 2.485 2.771 . 0 0 "[ . 1 . 2]" 1
473 1 41 LEU HA 1 41 LEU MD1 . . 3.250 2.850 2.598 2.897 . 0 0 "[ . 1 . 2]" 1
474 1 41 LEU HA 1 41 LEU MD2 . . 2.880 1.927 1.893 2.045 . 0 0 "[ . 1 . 2]" 1
475 1 41 LEU HA 1 44 ARG H . . 4.510 3.750 3.598 3.929 . 0 0 "[ . 1 . 2]" 1
476 1 41 LEU HA 1 46 ALA H . . 4.480 3.856 3.232 4.245 . 0 0 "[ . 1 . 2]" 1
477 1 41 LEU HA 1 46 ALA MB . . 3.500 2.716 2.452 3.036 . 0 0 "[ . 1 . 2]" 1
478 1 41 LEU HB2 1 41 LEU MD2 . . 2.780 2.714 2.563 2.771 . 0 0 "[ . 1 . 2]" 1
479 1 41 LEU HB2 1 42 ILE H . . 3.750 3.250 2.832 3.357 . 0 0 "[ . 1 . 2]" 1
480 1 41 LEU HB3 1 41 LEU MD1 . . 3.080 1.990 1.958 2.103 . 0 0 "[ . 1 . 2]" 1
481 1 41 LEU HB3 1 41 LEU MD2 . . 3.120 3.141 3.117 3.196 0.076 19 0 "[ . 1 . 2]" 1
482 1 41 LEU HB3 1 42 ILE H . . 3.700 3.671 3.270 3.739 0.039 12 0 "[ . 1 . 2]" 1
483 1 41 LEU HB3 1 46 ALA MB . . 3.340 2.830 2.236 3.322 . 0 0 "[ . 1 . 2]" 1
484 1 41 LEU MD1 1 46 ALA H . . 4.290 3.651 3.219 4.059 . 0 0 "[ . 1 . 2]" 1
485 1 41 LEU MD1 1 46 ALA MB . . 2.770 1.744 1.654 1.860 . 0 0 "[ . 1 . 2]" 1
486 1 41 LEU MD2 1 46 ALA MB . . 3.190 2.899 2.547 3.149 . 0 0 "[ . 1 . 2]" 1
487 1 41 LEU HG 1 46 ALA MB . . 4.130 3.960 3.760 4.149 0.019 10 0 "[ . 1 . 2]" 1
488 1 42 ILE H 1 42 ILE HB . . 3.120 2.147 2.106 2.471 . 0 0 "[ . 1 . 2]" 1
489 1 42 ILE H 1 42 ILE MD . . 3.810 2.744 2.601 3.815 0.005 20 0 "[ . 1 . 2]" 1
490 1 42 ILE H 1 42 ILE HG13 . . 3.510 3.452 2.376 3.537 0.027 18 0 "[ . 1 . 2]" 1
491 1 42 ILE H 1 42 ILE MG . . 3.620 3.532 3.501 3.707 0.087 20 0 "[ . 1 . 2]" 1
492 1 42 ILE H 1 43 THR H . . 3.540 2.527 2.388 2.916 . 0 0 "[ . 1 . 2]" 1
493 1 42 ILE H 1 43 THR MG . . 4.470 4.043 3.587 4.430 . 0 0 "[ . 1 . 2]" 1
494 1 42 ILE H 1 44 ARG H . . 4.590 3.923 3.608 4.299 . 0 0 "[ . 1 . 2]" 1
495 1 42 ILE HA 1 42 ILE MD . . 3.290 3.297 3.260 3.333 0.043 18 0 "[ . 1 . 2]" 1
496 1 42 ILE HA 1 42 ILE HG12 . . 3.390 3.209 2.365 3.287 . 0 0 "[ . 1 . 2]" 1
497 1 42 ILE HA 1 42 ILE HG13 . . 3.620 2.130 2.040 3.528 . 0 0 "[ . 1 . 2]" 1
498 1 42 ILE HA 1 42 ILE MG . . 2.880 2.658 2.467 2.702 . 0 0 "[ . 1 . 2]" 1
499 1 42 ILE HA 1 44 ARG H . . 4.770 4.540 4.306 4.775 0.005 9 0 "[ . 1 . 2]" 1
500 1 42 ILE HA 1 45 GLY H . . 4.010 3.366 3.233 3.514 . 0 0 "[ . 1 . 2]" 1
501 1 42 ILE HB 1 42 ILE MD . . 3.180 2.039 1.948 2.777 . 0 0 "[ . 1 . 2]" 1
502 1 42 ILE HB 1 43 THR H . . 3.580 2.687 2.354 2.820 . 0 0 "[ . 1 . 2]" 1
503 1 42 ILE HB 1 43 THR MG . . 3.710 3.526 3.278 3.697 . 0 0 "[ . 1 . 2]" 1
504 1 42 ILE HG12 1 42 ILE MG . . 2.920 2.179 2.060 2.855 . 0 0 "[ . 1 . 2]" 1
505 1 42 ILE HG13 1 42 ILE MG . . 3.030 2.916 2.872 3.098 0.068 20 0 "[ . 1 . 2]" 1
506 1 42 ILE MG 1 43 THR H . . 3.840 2.688 2.447 3.221 . 0 0 "[ . 1 . 2]" 1
507 1 42 ILE MG 1 43 THR HA . . 3.410 3.013 2.875 3.411 0.001 20 0 "[ . 1 . 2]" 1
508 1 42 ILE MG 1 43 THR MG . . 3.750 2.649 2.400 3.496 . 0 0 "[ . 1 . 2]" 1
509 1 43 THR H 1 43 THR HB . . 3.430 3.475 3.453 3.489 0.059 14 0 "[ . 1 . 2]" 1
510 1 43 THR H 1 43 THR MG . . 3.170 2.145 1.870 2.361 . 0 0 "[ . 1 . 2]" 1
511 1 43 THR H 1 44 ARG H . . 3.740 2.843 2.711 2.914 . 0 0 "[ . 1 . 2]" 1
512 1 43 THR HA 1 43 THR MG . . 2.900 2.386 2.226 2.504 . 0 0 "[ . 1 . 2]" 1
513 1 43 THR HB 1 44 ARG H . . 3.820 3.565 3.330 3.819 . 0 0 "[ . 1 . 2]" 1
514 1 43 THR HB 1 44 ARG HG3 . . 4.160 4.085 3.860 4.181 0.021 18 0 "[ . 1 . 2]" 1
515 1 43 THR MG 1 44 ARG H . . 4.080 3.911 3.697 4.068 . 0 0 "[ . 1 . 2]" 1
516 1 44 ARG H 1 44 ARG HB2 . . 3.470 2.452 2.343 2.565 . 0 0 "[ . 1 . 2]" 1
517 1 44 ARG H 1 44 ARG HB3 . . 4.020 3.574 3.552 3.597 . 0 0 "[ . 1 . 2]" 1
518 1 44 ARG H 1 44 ARG HG2 . . 3.490 3.337 2.843 3.488 . 0 0 "[ . 1 . 2]" 1
519 1 44 ARG H 1 44 ARG HG3 . . 3.970 2.339 1.970 2.603 . 0 0 "[ . 1 . 2]" 1
520 1 44 ARG H 1 45 GLY H . . 3.750 2.607 2.507 2.671 . 0 0 "[ . 1 . 2]" 1
521 1 44 ARG H 1 92 LEU QD . . 4.740 4.418 4.015 4.624 . 0 0 "[ . 1 . 2]" 1
522 1 44 ARG HA 1 44 ARG HG2 . . 3.020 2.461 2.289 2.793 . 0 0 "[ . 1 . 2]" 1
523 1 44 ARG HA 1 44 ARG HG3 . . 3.790 3.156 2.785 3.440 . 0 0 "[ . 1 . 2]" 1
524 1 44 ARG HB2 1 45 GLY H . . 4.460 3.673 3.258 3.878 . 0 0 "[ . 1 . 2]" 1
525 1 44 ARG HB2 1 46 ALA H . . 4.860 4.477 3.805 4.867 0.007 2 0 "[ . 1 . 2]" 1
526 1 44 ARG HB2 1 92 LEU QD . . 3.840 2.528 2.050 2.781 . 0 0 "[ . 1 . 2]" 1
527 1 44 ARG HB3 1 44 ARG HE . . 4.130 3.381 2.103 4.034 . 0 0 "[ . 1 . 2]" 1
528 1 44 ARG HB3 1 92 LEU HB3 . . 3.900 2.782 2.159 3.503 . 0 0 "[ . 1 . 2]" 1
529 1 44 ARG HB3 1 92 LEU QD . . 3.500 2.246 2.039 2.550 . 0 0 "[ . 1 . 2]" 1
530 1 44 ARG HB3 1 93 LYS H . . 4.190 3.393 2.740 4.214 0.024 10 0 "[ . 1 . 2]" 1
531 1 44 ARG HD3 1 92 LEU QD . . 4.090 3.634 2.872 4.208 0.118 15 0 "[ . 1 . 2]" 1
532 1 44 ARG HE 1 44 ARG HG2 . . 4.020 3.315 2.107 4.053 0.033 6 0 "[ . 1 . 2]" 1
533 1 44 ARG HE 1 92 LEU QD . . 4.080 3.240 2.579 3.697 . 0 0 "[ . 1 . 2]" 1
534 1 45 GLY H 1 46 ALA H . . 3.630 3.466 3.188 3.642 0.012 3 0 "[ . 1 . 2]" 1
535 1 45 GLY H 1 46 ALA MB . . 4.710 4.574 4.352 4.721 0.011 12 0 "[ . 1 . 2]" 1
536 1 46 ALA H 1 46 ALA MB . . 2.720 2.143 1.964 2.328 . 0 0 "[ . 1 . 2]" 1
537 1 46 ALA H 1 47 GLN H . . 4.450 4.470 4.417 4.501 0.051 6 0 "[ . 1 . 2]" 1
538 1 46 ALA H 1 92 LEU QD . . 3.860 3.618 3.502 3.743 . 0 0 "[ . 1 . 2]" 1
539 1 46 ALA HA 1 47 GLN H . . 3.070 2.197 2.186 2.234 . 0 0 "[ . 1 . 2]" 1
540 1 46 ALA HA 1 92 LEU QD . . 3.080 1.996 1.947 2.104 . 0 0 "[ . 1 . 2]" 1
541 1 46 ALA MB 1 47 GLN H . . 3.410 3.270 3.113 3.393 . 0 0 "[ . 1 . 2]" 1
542 1 46 ALA MB 1 92 LEU QD . . 2.560 1.936 1.857 2.124 . 0 0 "[ . 1 . 2]" 1
543 1 46 ALA MB 1 92 LEU HG . . 3.890 3.868 3.786 3.923 0.033 5 0 "[ . 1 . 2]" 1
544 1 47 GLN H 1 47 GLN HB3 . . 3.930 3.316 3.080 3.481 . 0 0 "[ . 1 . 2]" 1
545 1 47 GLN H 1 47 GLN QG . . 3.710 2.021 1.926 2.394 . 0 0 "[ . 1 . 2]" 1
546 1 47 GLN H 1 90 VAL MG1 . . 3.710 3.222 2.921 3.578 . 0 0 "[ . 1 . 2]" 1
547 1 47 GLN H 1 91 LEU H . . 4.010 2.762 2.559 2.935 . 0 0 "[ . 1 . 2]" 1
548 1 47 GLN H 1 91 LEU HB2 . . 5.040 4.892 4.772 4.989 . 0 0 "[ . 1 . 2]" 1
549 1 47 GLN H 1 91 LEU HB3 . . 4.160 3.332 3.185 3.460 . 0 0 "[ . 1 . 2]" 1
550 1 47 GLN H 1 92 LEU QD . . 3.930 3.577 3.398 3.701 . 0 0 "[ . 1 . 2]" 1
551 1 47 GLN HA 1 47 GLN QG . . 3.520 3.330 3.304 3.376 . 0 0 "[ . 1 . 2]" 1
552 1 47 GLN HA 1 48 ILE H . . 3.150 2.482 2.400 2.597 . 0 0 "[ . 1 . 2]" 1
553 1 47 GLN HB2 1 47 GLN QG . . 2.550 2.302 2.180 2.447 . 0 0 "[ . 1 . 2]" 1
554 1 47 GLN HB2 1 48 ILE H . . 3.590 2.508 2.252 2.696 . 0 0 "[ . 1 . 2]" 1
555 1 47 GLN HB2 1 49 LEU MD2 . . 4.000 3.835 3.374 4.028 0.028 12 0 "[ . 1 . 2]" 1
556 1 47 GLN HB3 1 48 ILE H . . 3.850 3.760 3.594 3.882 0.032 16 0 "[ . 1 . 2]" 1
557 1 47 GLN QG 1 48 ILE H . . 3.970 3.752 3.368 3.968 . 0 0 "[ . 1 . 2]" 1
558 1 47 GLN QG 1 49 LEU MD1 . . 4.030 3.856 3.517 4.081 0.051 16 0 "[ . 1 . 2]" 1
559 1 47 GLN QG 1 49 LEU MD2 . . 3.690 2.832 1.995 3.115 . 0 0 "[ . 1 . 2]" 1
560 1 47 GLN QG 1 91 LEU HB2 . . 3.630 3.408 3.211 3.546 . 0 0 "[ . 1 . 2]" 1
561 1 47 GLN QG 1 91 LEU HB3 . . 3.670 1.929 1.784 2.052 . 0 0 "[ . 1 . 2]" 1
562 1 47 GLN QG 1 91 LEU QD . . 3.740 2.237 1.892 2.606 . 0 0 "[ . 1 . 2]" 1
563 1 48 ILE H 1 48 ILE HB . . 3.090 2.500 2.374 2.572 . 0 0 "[ . 1 . 2]" 1
564 1 48 ILE H 1 48 ILE MD . . 3.770 3.056 2.827 3.436 . 0 0 "[ . 1 . 2]" 1
565 1 48 ILE H 1 48 ILE HG12 . . 3.880 2.418 2.173 2.673 . 0 0 "[ . 1 . 2]" 1
566 1 48 ILE H 1 48 ILE HG13 . . 4.200 3.851 3.674 4.039 . 0 0 "[ . 1 . 2]" 1
567 1 48 ILE H 1 48 ILE MG . . 3.720 3.772 3.724 3.800 0.080 10 0 "[ . 1 . 2]" 1
568 1 48 ILE HA 1 48 ILE MD . . 3.150 1.946 1.890 2.047 . 0 0 "[ . 1 . 2]" 1
569 1 48 ILE HA 1 48 ILE MG . . 3.070 2.279 2.190 2.367 . 0 0 "[ . 1 . 2]" 1
570 1 48 ILE HA 1 49 LEU H . . 3.230 2.216 2.189 2.243 . 0 0 "[ . 1 . 2]" 1
571 1 48 ILE HA 1 88 PHE QD . . 3.810 3.788 3.627 3.848 0.038 8 0 "[ . 1 . 2]" 1
572 1 48 ILE HA 1 90 VAL HA . . 3.920 3.156 2.885 3.287 . 0 0 "[ . 1 . 2]" 1
573 1 48 ILE HA 1 91 LEU H . . 4.410 3.895 3.664 4.040 . 0 0 "[ . 1 . 2]" 1
574 1 48 ILE HB 1 48 ILE MD . . 3.470 3.201 3.183 3.214 . 0 0 "[ . 1 . 2]" 1
575 1 48 ILE HB 1 49 LEU H . . 4.140 4.155 4.129 4.189 0.049 16 0 "[ . 1 . 2]" 1
576 1 48 ILE MD 1 48 ILE MG . . 2.760 2.261 2.112 2.374 . 0 0 "[ . 1 . 2]" 1
577 1 48 ILE MD 1 49 LEU H . . 3.810 3.666 3.408 3.826 0.016 16 0 "[ . 1 . 2]" 1
578 1 48 ILE MD 1 57 LEU MD1 . . 3.730 3.744 3.711 3.779 0.049 20 0 "[ . 1 . 2]" 1
579 1 48 ILE MD 1 59 LEU H . . 4.380 4.024 3.817 4.238 . 0 0 "[ . 1 . 2]" 1
580 1 48 ILE MD 1 59 LEU HB3 . . 3.300 3.164 2.847 3.502 0.202 18 0 "[ . 1 . 2]" 1
581 1 48 ILE MD 1 66 LEU MD1 . . 3.040 2.444 2.144 2.941 . 0 0 "[ . 1 . 2]" 1
582 1 48 ILE MD 1 66 LEU MD2 . . 3.010 2.334 1.995 2.732 . 0 0 "[ . 1 . 2]" 1
583 1 48 ILE MD 1 88 PHE QD . . 3.450 3.177 2.738 3.467 0.017 1 0 "[ . 1 . 2]" 1
584 1 48 ILE MD 1 90 VAL HA . . 3.550 3.101 2.876 3.252 . 0 0 "[ . 1 . 2]" 1
585 1 48 ILE MD 1 90 VAL MG2 . . 2.750 2.423 2.126 2.654 . 0 0 "[ . 1 . 2]" 1
586 1 48 ILE MD 1 91 LEU H . . 4.120 4.156 4.126 4.191 0.071 12 0 "[ . 1 . 2]" 1
587 1 48 ILE HG12 1 59 LEU H . . 3.540 2.361 2.078 2.626 . 0 0 "[ . 1 . 2]" 1
588 1 48 ILE HG12 1 59 LEU HB3 . . 3.520 2.209 1.990 2.605 . 0 0 "[ . 1 . 2]" 1
589 1 48 ILE HG13 1 48 ILE MG . . 3.000 2.206 2.137 2.290 . 0 0 "[ . 1 . 2]" 1
590 1 48 ILE HG13 1 59 LEU H . . 3.460 3.402 3.121 3.485 0.025 12 0 "[ . 1 . 2]" 1
591 1 48 ILE HG13 1 66 LEU MD2 . . 2.960 1.995 1.829 2.351 . 0 0 "[ . 1 . 2]" 1
592 1 48 ILE MG 1 49 LEU H . . 3.180 2.476 2.202 2.689 . 0 0 "[ . 1 . 2]" 1
593 1 48 ILE MG 1 57 LEU H . . 4.070 3.826 3.560 4.060 . 0 0 "[ . 1 . 2]" 1
594 1 48 ILE MG 1 57 LEU HB2 . . 2.830 1.979 1.839 2.253 . 0 0 "[ . 1 . 2]" 1
595 1 48 ILE MG 1 57 LEU MD1 . . 3.190 1.969 1.823 2.267 . 0 0 "[ . 1 . 2]" 1
596 1 48 ILE MG 1 57 LEU MD2 . . 3.220 3.300 3.259 3.353 0.133 16 0 "[ . 1 . 2]" 1
597 1 48 ILE MG 1 66 LEU MD2 . . 3.270 1.970 1.811 2.187 . 0 0 "[ . 1 . 2]" 1
598 1 48 ILE MG 1 88 PHE HB2 . . 3.770 2.444 2.206 2.641 . 0 0 "[ . 1 . 2]" 1
599 1 48 ILE MG 1 88 PHE HB3 . . 3.830 3.621 3.166 3.807 . 0 0 "[ . 1 . 2]" 1
600 1 48 ILE MG 1 88 PHE QD . . 3.220 2.746 2.507 3.019 . 0 0 "[ . 1 . 2]" 1
601 1 48 ILE MG 1 89 GLN H . . 4.010 3.268 2.792 3.628 . 0 0 "[ . 1 . 2]" 1
602 1 49 LEU H 1 49 LEU HB2 . . 3.610 2.424 2.303 2.524 . 0 0 "[ . 1 . 2]" 1
603 1 49 LEU H 1 49 LEU HB3 . . 3.830 3.614 3.534 3.684 . 0 0 "[ . 1 . 2]" 1
604 1 49 LEU H 1 49 LEU MD1 . . 4.570 4.225 3.998 4.384 . 0 0 "[ . 1 . 2]" 1
605 1 49 LEU H 1 49 LEU HG . . 3.830 3.256 2.656 3.566 . 0 0 "[ . 1 . 2]" 1
606 1 49 LEU H 1 89 GLN H . . 4.080 2.417 2.200 2.948 . 0 0 "[ . 1 . 2]" 1
607 1 49 LEU H 1 89 GLN QB . . 4.530 3.889 3.454 4.205 . 0 0 "[ . 1 . 2]" 1
608 1 49 LEU H 1 90 VAL HA . . 4.400 3.863 3.650 4.048 . 0 0 "[ . 1 . 2]" 1
609 1 49 LEU H 1 91 LEU H . . 4.910 4.377 4.042 4.642 . 0 0 "[ . 1 . 2]" 1
610 1 49 LEU HA 1 49 LEU MD1 . . 3.700 3.537 2.418 3.813 0.113 17 0 "[ . 1 . 2]" 1
611 1 49 LEU HA 1 49 LEU MD2 . . 3.100 1.965 1.880 2.246 . 0 0 "[ . 1 . 2]" 1
612 1 49 LEU HA 1 49 LEU HG . . 4.100 3.257 3.021 3.773 . 0 0 "[ . 1 . 2]" 1
613 1 49 LEU HB2 1 49 LEU MD1 . . 3.310 2.600 2.429 3.148 . 0 0 "[ . 1 . 2]" 1
614 1 49 LEU HB2 1 89 GLN H . . 4.340 2.819 2.529 3.320 . 0 0 "[ . 1 . 2]" 1
615 1 49 LEU HB2 1 89 GLN QB . . 3.510 2.458 2.016 2.719 . 0 0 "[ . 1 . 2]" 1
616 1 49 LEU HB3 1 49 LEU MD1 . . 3.380 2.233 2.104 2.314 . 0 0 "[ . 1 . 2]" 1
617 1 49 LEU HB3 1 49 LEU MD2 . . 3.160 2.626 2.430 3.185 0.025 11 0 "[ . 1 . 2]" 1
618 1 49 LEU HB3 1 89 GLN QB . . 3.590 3.512 3.174 3.614 0.024 20 0 "[ . 1 . 2]" 1
619 1 49 LEU MD1 1 89 GLN QB . . 3.370 3.203 2.595 3.404 0.034 11 0 "[ . 1 . 2]" 1
620 1 49 LEU MD1 1 91 LEU HB2 . . 3.690 2.147 1.944 2.436 . 0 0 "[ . 1 . 2]" 1
621 1 49 LEU MD1 1 91 LEU HB3 . . 3.240 3.081 2.810 3.247 0.007 12 0 "[ . 1 . 2]" 1
622 1 49 LEU MD1 1 91 LEU QD . . 3.400 2.449 2.128 2.907 . 0 0 "[ . 1 . 2]" 1
623 1 49 LEU MD1 1 98 PHE QE . . 3.600 2.202 1.857 2.552 . 0 0 "[ . 1 . 2]" 1
624 1 49 LEU MD2 1 91 LEU HB3 . . 3.790 3.109 2.002 3.750 . 0 0 "[ . 1 . 2]" 1
625 1 50 SER H 1 50 SER HB2 . . 4.020 2.873 2.492 3.691 . 0 0 "[ . 1 . 2]" 1
626 1 50 SER H 1 50 SER HB3 . . 4.050 3.245 2.216 3.740 . 0 0 "[ . 1 . 2]" 1
627 1 51 LYS H 1 51 LYS QB . . 3.730 2.874 1.994 3.199 . 0 0 "[ . 1 . 2]" 1
628 1 51 LYS HA 1 51 LYS HG2 . . 3.890 2.693 1.959 3.462 . 0 0 "[ . 1 . 2]" 1
629 1 51 LYS HA 1 51 LYS HG3 . . 3.650 2.538 1.956 3.403 . 0 0 "[ . 1 . 2]" 1
630 1 51 LYS QB 1 51 LYS QE . . 3.800 2.746 1.964 3.521 . 0 0 "[ . 1 . 2]" 1
631 1 51 LYS QB 1 55 GLN HA . . 3.620 3.350 2.635 3.647 0.027 11 0 "[ . 1 . 2]" 1
632 1 51 LYS QB 1 56 LEU H . . 3.960 3.859 3.118 3.980 0.020 14 0 "[ . 1 . 2]" 1
633 1 51 LYS QB 1 56 LEU MD1 . . 3.830 2.378 1.787 2.857 . 0 0 "[ . 1 . 2]" 1
634 1 51 LYS QE 1 56 LEU MD1 . . 3.660 2.332 1.795 3.632 . 0 0 "[ . 1 . 2]" 1
635 1 51 LYS QE 1 56 LEU MD2 . . 3.740 3.271 2.152 3.749 0.009 7 0 "[ . 1 . 2]" 1
636 1 53 ASN HB3 1 54 LYS H . . 4.540 3.134 2.084 4.400 . 0 0 "[ . 1 . 2]" 1
637 1 54 LYS HA 1 54 LYS QD . . 4.160 3.553 2.887 3.962 . 0 0 "[ . 1 . 2]" 1
638 1 54 LYS HA 1 54 LYS HG2 . . 3.750 2.811 1.993 3.493 . 0 0 "[ . 1 . 2]" 1
639 1 54 LYS HA 1 54 LYS HG3 . . 3.860 2.375 1.998 3.510 . 0 0 "[ . 1 . 2]" 1
640 1 54 LYS HB2 1 54 LYS HG2 . . 2.930 2.918 2.685 3.054 0.124 13 0 "[ . 1 . 2]" 1
641 1 54 LYS HB3 1 54 LYS QD . . 3.500 2.746 2.011 3.305 . 0 0 "[ . 1 . 2]" 1
642 1 54 LYS QD 1 54 LYS QE . . 2.450 2.091 2.053 2.135 . 0 0 "[ . 1 . 2]" 1
643 1 54 LYS QD 1 54 LYS HG2 . . 2.620 2.372 2.178 2.572 . 0 0 "[ . 1 . 2]" 1
644 1 55 GLN HA 1 55 GLN HG2 . . 3.810 3.354 2.637 3.737 . 0 0 "[ . 1 . 2]" 1
645 1 55 GLN HA 1 55 GLN HG3 . . 3.750 2.777 1.994 3.777 0.027 3 0 "[ . 1 . 2]" 1
646 1 55 GLN HA 1 56 LEU H . . 3.090 2.288 2.202 2.588 . 0 0 "[ . 1 . 2]" 1
647 1 55 GLN HA 1 56 LEU MD1 . . 3.840 3.298 2.526 3.840 0.000 14 0 "[ . 1 . 2]" 1
648 1 55 GLN HA 1 57 LEU H . . 4.460 3.640 3.180 4.260 . 0 0 "[ . 1 . 2]" 1
649 1 55 GLN HG2 1 57 LEU H . . 3.900 3.076 2.053 3.933 0.033 18 0 "[ . 1 . 2]" 1
650 1 55 GLN HG3 1 57 LEU H . . 3.730 2.769 1.962 3.817 0.087 2 0 "[ . 1 . 2]" 1
651 1 56 LEU H 1 56 LEU HB2 . . 3.890 2.556 2.349 2.827 . 0 0 "[ . 1 . 2]" 1
652 1 56 LEU H 1 56 LEU HB3 . . 4.070 3.689 3.579 3.843 . 0 0 "[ . 1 . 2]" 1
653 1 56 LEU H 1 56 LEU MD1 . . 4.500 2.519 2.096 3.082 . 0 0 "[ . 1 . 2]" 1
654 1 56 LEU H 1 56 LEU MD2 . . 4.360 4.298 4.170 4.405 0.045 12 0 "[ . 1 . 2]" 1
655 1 56 LEU H 1 57 LEU H . . 3.620 2.270 1.914 2.594 . 0 0 "[ . 1 . 2]" 1
656 1 56 LEU HA 1 56 LEU MD1 . . 3.840 3.542 2.775 3.852 0.012 14 0 "[ . 1 . 2]" 1
657 1 56 LEU HA 1 56 LEU MD2 . . 3.780 3.265 2.776 3.769 . 0 0 "[ . 1 . 2]" 1
658 1 56 LEU HA 1 70 GLU H . . 4.360 3.632 3.144 4.015 . 0 0 "[ . 1 . 2]" 1
659 1 56 LEU HA 1 70 GLU QG . . 3.930 3.589 3.149 3.956 0.026 7 0 "[ . 1 . 2]" 1
660 1 56 LEU HB2 1 56 LEU MD1 . . 3.080 2.150 1.957 2.348 . 0 0 "[ . 1 . 2]" 1
661 1 56 LEU HB2 1 56 LEU MD2 . . 3.510 2.797 2.376 3.050 . 0 0 "[ . 1 . 2]" 1
662 1 56 LEU HB2 1 57 LEU H . . 4.040 3.746 2.600 4.060 0.020 16 0 "[ . 1 . 2]" 1
663 1 56 LEU HB2 1 57 LEU HG . . 3.910 3.709 3.190 3.948 0.038 18 0 "[ . 1 . 2]" 1
664 1 56 LEU HB3 1 56 LEU MD1 . . 3.350 3.045 2.845 3.209 . 0 0 "[ . 1 . 2]" 1
665 1 56 LEU HB3 1 56 LEU MD2 . . 3.290 2.132 1.980 2.302 . 0 0 "[ . 1 . 2]" 1
666 1 56 LEU MD2 1 70 GLU QG . . 3.670 3.229 2.451 3.660 . 0 0 "[ . 1 . 2]" 1
667 1 57 LEU H 1 57 LEU HB2 . . 3.730 2.594 2.313 2.826 . 0 0 "[ . 1 . 2]" 1
668 1 57 LEU H 1 57 LEU HB3 . . 4.080 3.647 3.517 3.851 . 0 0 "[ . 1 . 2]" 1
669 1 57 LEU H 1 57 LEU MD1 . . 4.830 4.358 3.955 4.603 . 0 0 "[ . 1 . 2]" 1
670 1 57 LEU H 1 57 LEU MD2 . . 4.160 4.175 4.070 4.262 0.102 18 0 "[ . 1 . 2]" 1
671 1 57 LEU H 1 57 LEU HG . . 3.940 3.679 3.370 3.959 0.019 14 0 "[ . 1 . 2]" 1
672 1 57 LEU H 1 69 LYS HB3 . . 4.730 4.447 4.007 4.682 . 0 0 "[ . 1 . 2]" 1
673 1 57 LEU HA 1 57 LEU MD1 . . 3.970 3.804 3.753 3.869 . 0 0 "[ . 1 . 2]" 1
674 1 57 LEU HA 1 57 LEU MD2 . . 3.040 2.039 1.929 2.131 . 0 0 "[ . 1 . 2]" 1
675 1 57 LEU HA 1 57 LEU HG . . 4.040 2.822 2.711 2.953 . 0 0 "[ . 1 . 2]" 1
676 1 57 LEU HA 1 58 GLN H . . 3.300 2.349 2.247 2.428 . 0 0 "[ . 1 . 2]" 1
677 1 57 LEU HA 1 69 LYS H . . 4.120 3.056 2.254 3.515 . 0 0 "[ . 1 . 2]" 1
678 1 57 LEU HA 1 69 LYS HB2 . . 4.200 3.746 3.330 4.093 . 0 0 "[ . 1 . 2]" 1
679 1 57 LEU HB2 1 57 LEU MD1 . . 3.150 2.328 2.216 2.472 . 0 0 "[ . 1 . 2]" 1
680 1 57 LEU HB2 1 57 LEU MD2 . . 3.270 3.214 3.206 3.221 . 0 0 "[ . 1 . 2]" 1
681 1 57 LEU HB2 1 58 GLN H . . 4.570 4.113 3.910 4.351 . 0 0 "[ . 1 . 2]" 1
682 1 57 LEU HB3 1 57 LEU MD1 . . 3.190 2.392 2.194 2.512 . 0 0 "[ . 1 . 2]" 1
683 1 57 LEU HB3 1 57 LEU MD2 . . 3.120 2.356 2.290 2.453 . 0 0 "[ . 1 . 2]" 1
684 1 57 LEU HB3 1 58 GLN H . . 4.210 2.854 2.623 3.221 . 0 0 "[ . 1 . 2]" 1
685 1 57 LEU HB3 1 66 LEU MD2 . . 3.220 2.340 1.973 2.555 . 0 0 "[ . 1 . 2]" 1
686 1 57 LEU MD1 1 66 LEU MD1 . . 3.590 3.625 3.473 3.702 0.112 1 0 "[ . 1 . 2]" 1
687 1 57 LEU MD1 1 66 LEU MD2 . . 3.300 1.846 1.792 1.959 . 0 0 "[ . 1 . 2]" 1
688 1 57 LEU MD1 1 88 PHE HB3 . . 3.850 2.615 2.123 2.940 . 0 0 "[ . 1 . 2]" 1
689 1 57 LEU MD1 1 88 PHE QD . . 3.680 3.373 3.160 3.533 . 0 0 "[ . 1 . 2]" 1
690 1 57 LEU MD1 1 103 ILE MD . . 3.020 1.835 1.714 1.898 . 0 0 "[ . 1 . 2]" 1
691 1 57 LEU MD2 1 58 GLN H . . 3.640 2.731 2.316 3.277 . 0 0 "[ . 1 . 2]" 1
692 1 57 LEU MD2 1 66 LEU MD2 . . 2.840 2.000 1.834 2.268 . 0 0 "[ . 1 . 2]" 1
693 1 57 LEU MD2 1 67 LEU H . . 4.560 3.776 3.367 4.057 . 0 0 "[ . 1 . 2]" 1
694 1 57 LEU MD2 1 68 LEU HA . . 3.380 2.088 1.862 2.322 . 0 0 "[ . 1 . 2]" 1
695 1 57 LEU MD2 1 68 LEU HB3 . . 4.020 3.597 3.173 4.002 . 0 0 "[ . 1 . 2]" 1
696 1 57 LEU MD2 1 68 LEU MD1 . . 3.680 3.787 3.737 3.868 0.188 3 0 "[ . 1 . 2]" 1
697 1 57 LEU MD2 1 68 LEU MD2 . . 2.760 1.813 1.648 2.174 . 0 0 "[ . 1 . 2]" 1
698 1 57 LEU MD2 1 68 LEU HG . . 3.680 2.776 2.467 3.654 . 0 0 "[ . 1 . 2]" 1
699 1 57 LEU MD2 1 69 LYS H . . 3.760 3.728 3.430 3.800 0.040 16 0 "[ . 1 . 2]" 1
700 1 57 LEU MD2 1 103 ILE MD . . 3.010 2.904 2.653 3.055 0.045 15 0 "[ . 1 . 2]" 1
701 1 58 GLN H 1 58 GLN QB . . 3.440 2.784 2.690 2.814 . 0 0 "[ . 1 . 2]" 1
702 1 58 GLN H 1 67 LEU HB2 . . 4.450 3.818 3.510 4.111 . 0 0 "[ . 1 . 2]" 1
703 1 58 GLN HA 1 59 LEU H . . 3.120 2.210 2.202 2.225 . 0 0 "[ . 1 . 2]" 1
704 1 58 GLN QB 1 59 LEU H . . 4.150 3.829 3.671 3.956 . 0 0 "[ . 1 . 2]" 1
705 1 58 GLN QB 1 67 LEU HB2 . . 3.950 3.034 2.793 3.242 . 0 0 "[ . 1 . 2]" 1
706 1 58 GLN QB 1 67 LEU MD2 . . 4.070 4.023 3.815 4.144 0.074 10 0 "[ . 1 . 2]" 1
707 1 58 GLN HG2 1 59 LEU H . . 4.520 3.453 2.809 4.092 . 0 0 "[ . 1 . 2]" 1
708 1 59 LEU H 1 59 LEU HB2 . . 3.510 2.894 2.672 3.077 . 0 0 "[ . 1 . 2]" 1
709 1 59 LEU H 1 59 LEU HB3 . . 3.820 2.195 2.102 2.321 . 0 0 "[ . 1 . 2]" 1
710 1 59 LEU H 1 59 LEU MD2 . . 4.090 3.966 3.723 4.127 0.037 5 0 "[ . 1 . 2]" 1
711 1 59 LEU H 1 59 LEU HG . . 4.490 4.170 3.975 4.327 . 0 0 "[ . 1 . 2]" 1
712 1 59 LEU HA 1 59 LEU MD1 . . 3.060 2.501 2.078 3.019 . 0 0 "[ . 1 . 2]" 1
713 1 59 LEU HB2 1 59 LEU MD1 . . 3.400 2.244 1.993 2.397 . 0 0 "[ . 1 . 2]" 1
714 1 59 LEU HB2 1 59 LEU MD2 . . 2.850 2.638 2.501 2.886 0.036 19 0 "[ . 1 . 2]" 1
715 1 59 LEU HB3 1 59 LEU MD1 . . 3.000 3.159 3.002 3.213 0.213 5 0 "[ . 1 . 2]" 1
716 1 59 LEU HB3 1 59 LEU MD2 . . 2.620 2.066 1.959 2.165 . 0 0 "[ . 1 . 2]" 1
717 1 59 LEU HB3 1 60 GLU H . . 4.710 4.497 4.210 4.620 . 0 0 "[ . 1 . 2]" 1
718 1 59 LEU MD1 1 60 GLU H . . 3.300 2.998 2.545 3.321 0.021 7 0 "[ . 1 . 2]" 1
719 1 59 LEU MD1 1 64 GLY H . . 4.630 3.578 2.999 4.223 . 0 0 "[ . 1 . 2]" 1
720 1 59 LEU MD1 1 64 GLY HA2 . . 3.860 2.342 1.965 2.760 . 0 0 "[ . 1 . 2]" 1
721 1 59 LEU MD1 1 64 GLY HA3 . . 3.500 3.735 3.431 3.878 0.378 9 0 "[ . 1 . 2]" 1
722 1 59 LEU MD2 1 61 GLN HA . . 3.730 3.232 2.769 3.606 . 0 0 "[ . 1 . 2]" 1
723 1 59 LEU MD2 1 61 GLN QB . . 3.860 3.651 3.284 3.902 0.042 14 0 "[ . 1 . 2]" 1
724 1 59 LEU MD2 1 61 GLN HG2 . . 3.860 3.337 1.998 3.864 0.004 4 0 "[ . 1 . 2]" 1
725 1 59 LEU MD2 1 61 GLN HG3 . . 3.750 2.585 1.960 3.428 . 0 0 "[ . 1 . 2]" 1
726 1 59 LEU HG 1 60 GLU H . . 4.190 3.379 2.360 3.923 . 0 0 "[ . 1 . 2]" 1
727 1 59 LEU HG 1 61 GLN HA . . 3.780 3.035 2.547 3.858 0.078 7 0 "[ . 1 . 2]" 1
728 1 60 GLU H 1 60 GLU QB . . 3.650 2.249 1.998 2.691 . 0 0 "[ . 1 . 2]" 1
729 1 60 GLU H 1 60 GLU QG . . 4.140 2.874 1.887 3.795 . 0 0 "[ . 1 . 2]" 1
730 1 60 GLU H 1 67 LEU MD2 . . 4.170 2.026 1.761 2.658 . 0 0 "[ . 1 . 2]" 1
731 1 60 GLU HA 1 60 GLU QG . . 3.780 2.606 1.961 3.331 . 0 0 "[ . 1 . 2]" 1
732 1 60 GLU HA 1 67 LEU MD2 . . 4.080 3.308 2.625 3.934 . 0 0 "[ . 1 . 2]" 1
733 1 60 GLU QB 1 62 LYS QG . . 3.940 2.548 2.068 3.773 . 0 0 "[ . 1 . 2]" 1
734 1 60 GLU QB 1 63 SER H . . 4.730 2.892 2.074 4.159 . 0 0 "[ . 1 . 2]" 1
735 1 60 GLU QB 1 67 LEU MD2 . . 2.800 1.951 1.774 2.371 . 0 0 "[ . 1 . 2]" 1
736 1 60 GLU QB 1 67 LEU HG . . 3.910 3.775 3.238 3.924 0.014 10 0 "[ . 1 . 2]" 1
737 1 60 GLU QG 1 62 LYS H . . 4.590 3.309 1.923 4.150 . 0 0 "[ . 1 . 2]" 1
738 1 60 GLU QG 1 62 LYS QG . . 3.750 2.881 2.046 3.697 . 0 0 "[ . 1 . 2]" 1
739 1 60 GLU QG 1 63 SER H . . 4.330 3.558 2.297 4.165 . 0 0 "[ . 1 . 2]" 1
740 1 60 GLU QG 1 67 LEU MD2 . . 3.130 2.180 1.717 2.714 . 0 0 "[ . 1 . 2]" 1
741 1 61 GLN HA 1 61 GLN HG2 . . 3.620 2.456 1.957 3.181 . 0 0 "[ . 1 . 2]" 1
742 1 61 GLN HA 1 61 GLN HG3 . . 3.510 2.670 2.071 3.264 . 0 0 "[ . 1 . 2]" 1
743 1 61 GLN QB 1 62 LYS H . . 4.380 3.227 2.477 3.822 . 0 0 "[ . 1 . 2]" 1
744 1 62 LYS H 1 62 LYS HB2 . . 4.070 3.371 2.419 3.705 . 0 0 "[ . 1 . 2]" 1
745 1 62 LYS H 1 62 LYS HB3 . . 3.900 2.826 2.298 3.674 . 0 0 "[ . 1 . 2]" 1
746 1 62 LYS H 1 62 LYS QG . . 3.920 2.313 1.932 3.566 . 0 0 "[ . 1 . 2]" 1
747 1 62 LYS H 1 63 SER H . . 4.390 2.279 1.994 2.562 . 0 0 "[ . 1 . 2]" 1
748 1 62 LYS HA 1 62 LYS QD . . 4.150 3.748 2.515 4.253 0.103 4 0 "[ . 1 . 2]" 1
749 1 62 LYS HA 1 62 LYS QG . . 3.840 3.139 2.217 3.410 . 0 0 "[ . 1 . 2]" 1
750 1 62 LYS HB2 1 62 LYS QD . . 3.570 2.278 1.965 3.268 . 0 0 "[ . 1 . 2]" 1
751 1 62 LYS HB3 1 63 SER H . . 4.710 4.102 3.101 4.491 . 0 0 "[ . 1 . 2]" 1
752 1 62 LYS QE 1 62 LYS QG . . 3.180 2.047 1.951 2.323 . 0 0 "[ . 1 . 2]" 1
753 1 63 SER H 1 63 SER HB2 . . 4.010 2.538 2.247 2.922 . 0 0 "[ . 1 . 2]" 1
754 1 63 SER H 1 63 SER HB3 . . 4.150 3.439 3.093 3.756 . 0 0 "[ . 1 . 2]" 1
755 1 63 SER H 1 64 GLY H . . 3.410 1.994 1.893 2.323 . 0 0 "[ . 1 . 2]" 1
756 1 63 SER H 1 64 GLY HA3 . . 4.780 4.466 4.163 4.753 . 0 0 "[ . 1 . 2]" 1
757 1 63 SER H 1 65 ASN H . . 4.490 3.842 3.252 4.294 . 0 0 "[ . 1 . 2]" 1
758 1 63 SER HB2 1 64 GLY H . . 4.530 3.213 2.675 4.016 . 0 0 "[ . 1 . 2]" 1
759 1 63 SER HB2 1 65 ASN H . . 4.850 4.166 3.579 4.827 . 0 0 "[ . 1 . 2]" 1
760 1 63 SER HB3 1 65 ASN H . . 4.580 3.959 3.172 4.826 0.246 3 0 "[ . 1 . 2]" 1
761 1 64 GLY H 1 65 ASN H . . 3.550 2.377 1.898 2.844 . 0 0 "[ . 1 . 2]" 1
762 1 65 ASN H 1 65 ASN HB2 . . 3.800 2.581 2.392 2.714 . 0 0 "[ . 1 . 2]" 1
763 1 65 ASN H 1 65 ASN HB3 . . 3.690 3.672 3.545 3.799 0.109 15 0 "[ . 1 . 2]" 1
764 1 65 ASN H 1 67 LEU MD2 . . 3.940 3.279 3.025 3.600 . 0 0 "[ . 1 . 2]" 1
765 1 65 ASN HA 1 66 LEU H . . 3.300 2.424 2.285 2.592 . 0 0 "[ . 1 . 2]" 1
766 1 65 ASN HB2 1 65 ASN HD22 . . 4.130 3.709 3.448 4.158 0.028 18 0 "[ . 1 . 2]" 1
767 1 65 ASN HB2 1 66 LEU H . . 4.720 4.024 3.629 4.397 . 0 0 "[ . 1 . 2]" 1
768 1 65 ASN HB2 1 67 LEU MD1 . . 3.770 3.310 2.914 3.775 0.005 3 0 "[ . 1 . 2]" 1
769 1 65 ASN HB2 1 67 LEU MD2 . . 3.620 2.532 2.063 2.852 . 0 0 "[ . 1 . 2]" 1
770 1 65 ASN HB3 1 65 ASN HD22 . . 4.150 3.695 3.524 3.942 . 0 0 "[ . 1 . 2]" 1
771 1 65 ASN HB3 1 66 LEU H . . 4.200 2.790 2.334 3.328 . 0 0 "[ . 1 . 2]" 1
772 1 65 ASN HB3 1 67 LEU MD1 . . 3.270 2.766 2.556 3.177 . 0 0 "[ . 1 . 2]" 1
773 1 65 ASN HB3 1 67 LEU MD2 . . 3.380 2.804 2.378 3.346 . 0 0 "[ . 1 . 2]" 1
774 1 66 LEU H 1 66 LEU HB2 . . 3.860 2.152 2.075 2.246 . 0 0 "[ . 1 . 2]" 1
775 1 66 LEU H 1 66 LEU HB3 . . 3.780 3.250 3.041 3.396 . 0 0 "[ . 1 . 2]" 1
776 1 66 LEU H 1 66 LEU HG . . 4.480 3.886 3.631 4.161 . 0 0 "[ . 1 . 2]" 1
777 1 66 LEU H 1 67 LEU MD1 . . 4.060 3.913 3.670 4.053 . 0 0 "[ . 1 . 2]" 1
778 1 66 LEU HA 1 66 LEU MD1 . . 3.640 3.474 3.401 3.541 . 0 0 "[ . 1 . 2]" 1
779 1 66 LEU HA 1 66 LEU MD2 . . 3.360 2.981 2.898 3.102 . 0 0 "[ . 1 . 2]" 1
780 1 66 LEU HA 1 67 LEU H . . 3.360 2.187 2.176 2.206 . 0 0 "[ . 1 . 2]" 1
781 1 66 LEU HA 1 67 LEU MD1 . . 4.430 4.183 3.893 4.443 0.013 18 0 "[ . 1 . 2]" 1
782 1 66 LEU HA 1 67 LEU MD2 . . 3.410 2.978 2.818 3.192 . 0 0 "[ . 1 . 2]" 1
783 1 66 LEU HB2 1 66 LEU MD1 . . 3.450 2.081 1.923 2.180 . 0 0 "[ . 1 . 2]" 1
784 1 66 LEU HB2 1 66 LEU MD2 . . 3.430 3.037 2.957 3.120 . 0 0 "[ . 1 . 2]" 1
785 1 66 LEU HB2 1 67 LEU H . . 4.670 4.624 4.531 4.699 0.029 18 0 "[ . 1 . 2]" 1
786 1 66 LEU HB3 1 66 LEU MD1 . . 3.540 2.868 2.729 2.980 . 0 0 "[ . 1 . 2]" 1
787 1 66 LEU HB3 1 66 LEU MD2 . . 3.450 2.143 2.101 2.201 . 0 0 "[ . 1 . 2]" 1
788 1 66 LEU HB3 1 67 LEU H . . 4.470 3.863 3.583 4.146 . 0 0 "[ . 1 . 2]" 1
789 1 66 LEU MD2 1 67 LEU H . . 3.670 3.659 3.437 3.709 0.039 10 0 "[ . 1 . 2]" 1
790 1 66 LEU HG 1 67 LEU H . . 4.390 3.970 3.823 4.127 . 0 0 "[ . 1 . 2]" 1
791 1 67 LEU H 1 67 LEU HB2 . . 3.930 2.508 2.450 2.612 . 0 0 "[ . 1 . 2]" 1
792 1 67 LEU H 1 67 LEU HB3 . . 3.660 3.665 3.635 3.725 0.065 17 0 "[ . 1 . 2]" 1
793 1 67 LEU H 1 67 LEU MD1 . . 3.450 3.412 3.273 3.499 0.049 10 0 "[ . 1 . 2]" 1
794 1 67 LEU H 1 67 LEU MD2 . . 3.650 2.115 1.911 2.436 . 0 0 "[ . 1 . 2]" 1
795 1 67 LEU HA 1 67 LEU MD1 . . 3.080 2.036 1.898 2.209 . 0 0 "[ . 1 . 2]" 1
796 1 67 LEU HA 1 67 LEU MD2 . . 4.010 3.238 3.091 3.360 . 0 0 "[ . 1 . 2]" 1
797 1 67 LEU HA 1 67 LEU HG . . 3.930 3.670 3.559 3.773 . 0 0 "[ . 1 . 2]" 1
798 1 67 LEU HA 1 68 LEU H . . 3.180 2.280 2.201 2.387 . 0 0 "[ . 1 . 2]" 1
799 1 67 LEU HB2 1 67 LEU MD2 . . 2.940 2.220 2.125 2.285 . 0 0 "[ . 1 . 2]" 1
800 1 67 LEU HB2 1 68 LEU H . . 4.150 4.040 3.735 4.204 0.054 6 0 "[ . 1 . 2]" 1
801 1 67 LEU HB3 1 67 LEU MD2 . . 3.240 3.177 3.141 3.206 . 0 0 "[ . 1 . 2]" 1
802 1 67 LEU MD1 1 68 LEU H . . 3.550 3.467 3.261 3.578 0.028 17 0 "[ . 1 . 2]" 1
803 1 68 LEU H 1 68 LEU HB2 . . 3.400 2.423 2.289 2.516 . 0 0 "[ . 1 . 2]" 1
804 1 68 LEU H 1 68 LEU HB3 . . 4.130 3.571 3.531 3.615 . 0 0 "[ . 1 . 2]" 1
805 1 68 LEU H 1 68 LEU MD1 . . 3.790 3.222 3.015 3.779 . 0 0 "[ . 1 . 2]" 1
806 1 68 LEU H 1 68 LEU MD2 . . 3.990 3.835 3.165 4.022 0.032 19 0 "[ . 1 . 2]" 1
807 1 68 LEU H 1 68 LEU HG . . 3.700 2.491 2.175 2.697 . 0 0 "[ . 1 . 2]" 1
808 1 68 LEU HA 1 68 LEU MD2 . . 3.010 2.503 2.053 2.704 . 0 0 "[ . 1 . 2]" 1
809 1 68 LEU HA 1 68 LEU HG . . 3.960 2.805 2.661 3.233 . 0 0 "[ . 1 . 2]" 1
810 1 68 LEU HA 1 69 LYS H . . 3.410 2.374 2.209 2.717 . 0 0 "[ . 1 . 2]" 1
811 1 68 LEU HB2 1 68 LEU MD1 . . 3.630 2.079 1.945 2.436 . 0 0 "[ . 1 . 2]" 1
812 1 68 LEU HB2 1 69 LYS H . . 4.220 3.844 3.134 4.225 0.005 6 0 "[ . 1 . 2]" 1
813 1 68 LEU HB3 1 68 LEU MD2 . . 2.820 2.119 2.010 2.447 . 0 0 "[ . 1 . 2]" 1
814 1 68 LEU HB3 1 69 LYS H . . 3.750 2.755 2.080 3.250 . 0 0 "[ . 1 . 2]" 1
815 1 68 LEU HB3 1 70 GLU H . . 4.070 3.218 2.900 3.719 . 0 0 "[ . 1 . 2]" 1
816 1 68 LEU MD2 1 69 LYS H . . 4.240 3.437 3.032 3.676 . 0 0 "[ . 1 . 2]" 1
817 1 68 LEU MD2 1 70 GLU H . . 5.020 4.384 4.017 4.712 . 0 0 "[ . 1 . 2]" 1
818 1 69 LYS H 1 69 LYS HB2 . . 3.490 2.425 2.125 2.956 . 0 0 "[ . 1 . 2]" 1
819 1 69 LYS H 1 69 LYS HB3 . . 3.430 2.672 2.394 2.879 . 0 0 "[ . 1 . 2]" 1
820 1 69 LYS H 1 70 GLU H . . 3.430 2.498 2.044 2.998 . 0 0 "[ . 1 . 2]" 1
821 1 69 LYS HA 1 69 LYS HB2 . . 3.020 2.575 2.427 2.700 . 0 0 "[ . 1 . 2]" 1
822 1 69 LYS HA 1 69 LYS QD . . 3.420 3.036 2.011 3.441 0.021 14 0 "[ . 1 . 2]" 1
823 1 69 LYS HA 1 69 LYS HG2 . . 3.420 3.028 2.063 3.675 0.255 11 0 "[ . 1 . 2]" 1
824 1 69 LYS HA 1 69 LYS HG3 . . 3.660 2.852 2.310 3.430 . 0 0 "[ . 1 . 2]" 1
825 1 69 LYS HA 1 70 GLU QG . . 4.110 4.071 3.857 4.137 0.027 10 0 "[ . 1 . 2]" 1
826 1 69 LYS HB2 1 69 LYS QD . . 3.410 2.593 1.958 3.463 0.053 9 0 "[ . 1 . 2]" 1
827 1 69 LYS HB2 1 70 GLU H . . 3.900 3.724 3.453 3.878 . 0 0 "[ . 1 . 2]" 1
828 1 69 LYS HB2 1 70 GLU QG . . 4.150 3.892 3.710 4.000 . 0 0 "[ . 1 . 2]" 1
829 1 69 LYS HB3 1 69 LYS QD . . 3.440 2.807 2.055 3.409 . 0 0 "[ . 1 . 2]" 1
830 1 69 LYS HB3 1 69 LYS QE . . 3.790 3.696 2.417 3.851 0.061 8 0 "[ . 1 . 2]" 1
831 1 69 LYS HB3 1 70 GLU H . . 3.660 2.593 2.258 3.057 . 0 0 "[ . 1 . 2]" 1
832 1 69 LYS HB3 1 70 GLU QG . . 3.800 2.340 2.123 2.615 . 0 0 "[ . 1 . 2]" 1
833 1 69 LYS QD 1 69 LYS HG3 . . 2.730 2.392 2.180 2.546 . 0 0 "[ . 1 . 2]" 1
834 1 69 LYS QE 1 69 LYS HG2 . . 3.670 2.753 2.007 3.473 . 0 0 "[ . 1 . 2]" 1
835 1 69 LYS QE 1 69 LYS HG3 . . 3.610 2.518 2.081 3.349 . 0 0 "[ . 1 . 2]" 1
836 1 69 LYS HG2 1 70 GLU QG . . 4.000 3.393 1.989 4.130 0.130 8 0 "[ . 1 . 2]" 1
837 1 69 LYS HG3 1 70 GLU QG . . 4.050 3.490 2.812 4.198 0.148 8 0 "[ . 1 . 2]" 1
838 1 70 GLU H 1 70 GLU HB3 . . 3.800 3.726 3.661 3.828 0.028 8 0 "[ . 1 . 2]" 1
839 1 70 GLU H 1 70 GLU QG . . 3.880 2.407 2.153 2.620 . 0 0 "[ . 1 . 2]" 1
840 1 70 GLU HA 1 70 GLU QG . . 3.510 3.245 3.183 3.299 . 0 0 "[ . 1 . 2]" 1
841 1 70 GLU HA 1 71 LYS H . . 3.230 2.740 2.629 2.771 . 0 0 "[ . 1 . 2]" 1
842 1 70 GLU HB2 1 71 LYS H . . 3.630 1.999 1.945 2.212 . 0 0 "[ . 1 . 2]" 1
843 1 70 GLU HB3 1 71 LYS H . . 4.110 3.273 3.119 3.402 . 0 0 "[ . 1 . 2]" 1
844 1 70 GLU QG 1 71 LYS H . . 4.040 3.696 3.453 3.916 . 0 0 "[ . 1 . 2]" 1
845 1 70 GLU QG 1 72 LEU MD1 . . 4.080 3.899 3.548 4.089 0.009 11 0 "[ . 1 . 2]" 1
846 1 71 LYS H 1 71 LYS HB2 . . 3.320 2.483 2.239 2.725 . 0 0 "[ . 1 . 2]" 1
847 1 71 LYS H 1 71 LYS HB3 . . 3.270 2.462 2.287 2.733 . 0 0 "[ . 1 . 2]" 1
848 1 71 LYS HA 1 71 LYS HG2 . . 3.470 3.021 2.879 3.235 . 0 0 "[ . 1 . 2]" 1
849 1 71 LYS HA 1 71 LYS HG3 . . 3.380 2.574 2.323 2.761 . 0 0 "[ . 1 . 2]" 1
850 1 71 LYS HA 1 72 LEU H . . 2.960 2.185 2.176 2.227 . 0 0 "[ . 1 . 2]" 1
851 1 71 LYS HA 1 72 LEU MD1 . . 3.870 3.645 3.253 3.919 0.049 7 0 "[ . 1 . 2]" 1
852 1 71 LYS HA 1 72 LEU MD2 . . 3.550 3.051 2.592 3.428 . 0 0 "[ . 1 . 2]" 1
853 1 71 LYS HB2 1 71 LYS HE2 . . 3.630 3.764 2.023 4.420 0.790 11 7 "[ * . *+ . *-**]" 1
854 1 71 LYS HB2 1 71 LYS HG3 . . 3.020 2.470 2.392 2.598 . 0 0 "[ . 1 . 2]" 1
855 1 71 LYS HB3 1 71 LYS HE2 . . 4.200 3.578 2.300 4.774 0.574 11 2 "[- . 1+ . 2]" 1
856 1 71 LYS QD 1 71 LYS HE2 . . 2.660 2.359 2.184 2.547 . 0 0 "[ . 1 . 2]" 1
857 1 71 LYS HE2 1 71 LYS HG3 . . 3.480 3.270 2.179 4.271 0.791 3 3 "[ + . 1 - . * 2]" 1
858 1 71 LYS HG2 1 72 LEU H . . 3.880 3.190 2.793 3.565 . 0 0 "[ . 1 . 2]" 1
859 1 71 LYS HG3 1 72 LEU H . . 3.850 3.341 2.716 3.642 . 0 0 "[ . 1 . 2]" 1
860 1 72 LEU H 1 72 LEU HB2 . . 3.480 2.515 2.447 2.603 . 0 0 "[ . 1 . 2]" 1
861 1 72 LEU H 1 72 LEU HB3 . . 4.040 3.547 3.531 3.599 . 0 0 "[ . 1 . 2]" 1
862 1 72 LEU H 1 72 LEU MD1 . . 3.700 2.567 2.184 3.044 . 0 0 "[ . 1 . 2]" 1
863 1 72 LEU H 1 72 LEU MD2 . . 3.470 1.896 1.805 1.989 . 0 0 "[ . 1 . 2]" 1
864 1 72 LEU H 1 72 LEU HG . . 3.770 3.761 3.652 3.819 0.049 6 0 "[ . 1 . 2]" 1
865 1 72 LEU HA 1 72 LEU MD1 . . 2.550 2.008 1.929 2.115 . 0 0 "[ . 1 . 2]" 1
866 1 72 LEU HA 1 72 LEU HG . . 4.150 3.615 3.462 3.758 . 0 0 "[ . 1 . 2]" 1
867 1 72 LEU HA 1 73 ASP H . . 2.990 2.260 2.177 2.581 . 0 0 "[ . 1 . 2]" 1
868 1 72 LEU HA 1 77 LEU QD . . 3.240 3.080 2.667 3.196 . 0 0 "[ . 1 . 2]" 1
869 1 72 LEU HB2 1 77 LEU QD . . 3.750 3.026 2.574 3.315 . 0 0 "[ . 1 . 2]" 1
870 1 72 LEU HB3 1 72 LEU MD2 . . 3.040 3.128 3.068 3.191 0.151 18 0 "[ . 1 . 2]" 1
871 1 72 LEU HB3 1 77 LEU QD . . 3.530 1.882 1.748 2.201 . 0 0 "[ . 1 . 2]" 1
872 1 73 ASP H 1 73 ASP HB2 . . 3.570 2.206 2.024 2.429 . 0 0 "[ . 1 . 2]" 1
873 1 73 ASP H 1 73 ASP HB3 . . 3.590 3.361 2.884 3.554 . 0 0 "[ . 1 . 2]" 1
874 1 73 ASP H 1 77 LEU QD . . 4.680 2.620 1.937 3.655 . 0 0 "[ . 1 . 2]" 1
875 1 73 ASP HB2 1 74 ARG H . . 4.910 4.371 2.748 4.699 . 0 0 "[ . 1 . 2]" 1
876 1 73 ASP HB2 1 76 GLU H . . 4.800 3.763 3.454 4.110 . 0 0 "[ . 1 . 2]" 1
877 1 73 ASP HB2 1 76 GLU HB3 . . 3.640 2.502 2.016 3.311 . 0 0 "[ . 1 . 2]" 1
878 1 73 ASP HB3 1 76 GLU H . . 4.050 2.330 1.941 2.906 . 0 0 "[ . 1 . 2]" 1
879 1 73 ASP HB3 1 76 GLU HB2 . . 3.680 2.228 2.002 3.020 . 0 0 "[ . 1 . 2]" 1
880 1 73 ASP HB3 1 76 GLU HB3 . . 3.470 2.541 2.070 3.584 0.114 1 0 "[ . 1 . 2]" 1
881 1 74 ARG H 1 74 ARG QB . . 3.490 2.388 2.016 3.126 . 0 0 "[ . 1 . 2]" 1
882 1 74 ARG H 1 74 ARG QG . . 3.930 2.542 1.895 3.931 0.001 1 0 "[ . 1 . 2]" 1
883 1 74 ARG H 1 75 GLU H . . 4.010 2.866 2.190 3.283 . 0 0 "[ . 1 . 2]" 1
884 1 74 ARG HA 1 74 ARG QG . . 3.250 2.476 2.008 3.336 0.086 2 0 "[ . 1 . 2]" 1
885 1 74 ARG HA 1 77 LEU H . . 4.410 4.003 3.643 4.312 . 0 0 "[ . 1 . 2]" 1
886 1 74 ARG HA 1 77 LEU QD . . 4.080 3.268 2.446 3.966 . 0 0 "[ . 1 . 2]" 1
887 1 74 ARG QB 1 74 ARG HD2 . . 3.390 2.657 2.083 3.305 . 0 0 "[ . 1 . 2]" 1
888 1 74 ARG QB 1 74 ARG HD3 . . 3.240 2.547 1.956 3.336 0.096 17 0 "[ . 1 . 2]" 1
889 1 74 ARG QB 1 75 GLU H . . 3.860 2.457 1.908 3.767 . 0 0 "[ . 1 . 2]" 1
890 1 74 ARG HD3 1 74 ARG QG . . 2.760 2.383 2.185 2.573 . 0 0 "[ . 1 . 2]" 1
891 1 74 ARG QG 1 75 GLU H . . 4.310 3.706 1.794 4.302 . 0 0 "[ . 1 . 2]" 1
892 1 75 GLU H 1 75 GLU QB . . 2.900 2.275 2.089 2.514 . 0 0 "[ . 1 . 2]" 1
893 1 75 GLU H 1 75 GLU QG . . 3.890 3.120 1.933 3.938 0.048 14 0 "[ . 1 . 2]" 1
894 1 75 GLU H 1 76 GLU H . . 3.490 2.950 2.511 3.118 . 0 0 "[ . 1 . 2]" 1
895 1 75 GLU HA 1 75 GLU QG . . 3.070 2.419 2.198 2.815 . 0 0 "[ . 1 . 2]" 1
896 1 75 GLU QB 1 75 GLU QG . . 2.400 2.102 2.051 2.134 . 0 0 "[ . 1 . 2]" 1
897 1 75 GLU QB 1 76 GLU H . . 3.080 2.252 2.098 2.794 . 0 0 "[ . 1 . 2]" 1
898 1 75 GLU QG 1 76 GLU H . . 3.860 3.815 3.573 3.872 0.012 19 0 "[ . 1 . 2]" 1
899 1 76 GLU H 1 76 GLU HB2 . . 3.230 2.191 2.155 2.222 . 0 0 "[ . 1 . 2]" 1
900 1 76 GLU H 1 76 GLU HB3 . . 3.280 2.857 2.780 2.927 . 0 0 "[ . 1 . 2]" 1
901 1 76 GLU H 1 76 GLU QG . . 4.190 3.883 3.839 3.921 . 0 0 "[ . 1 . 2]" 1
902 1 76 GLU H 1 77 LEU H . . 3.630 3.146 2.945 3.291 . 0 0 "[ . 1 . 2]" 1
903 1 76 GLU HA 1 76 GLU HB2 . . 2.870 2.600 2.579 2.630 . 0 0 "[ . 1 . 2]" 1
904 1 76 GLU HA 1 76 GLU QG . . 3.280 2.212 2.121 2.615 . 0 0 "[ . 1 . 2]" 1
905 1 76 GLU HB2 1 77 LEU H . . 3.720 3.532 3.376 3.723 0.003 1 0 "[ . 1 . 2]" 1
906 1 76 GLU HB3 1 77 LEU H . . 3.690 2.224 1.983 2.545 . 0 0 "[ . 1 . 2]" 1
907 1 76 GLU HB3 1 77 LEU QD . . 3.800 3.392 3.249 3.470 . 0 0 "[ . 1 . 2]" 1
908 1 76 GLU QG 1 77 LEU QD . . 3.790 3.540 3.210 3.617 . 0 0 "[ . 1 . 2]" 1
909 1 77 LEU H 1 77 LEU HB2 . . 3.590 2.576 2.492 2.641 . 0 0 "[ . 1 . 2]" 1
910 1 77 LEU H 1 77 LEU HB3 . . 3.690 3.551 3.534 3.625 . 0 0 "[ . 1 . 2]" 1
911 1 77 LEU H 1 77 LEU QD . . 3.350 2.933 2.828 3.040 . 0 0 "[ . 1 . 2]" 1
912 1 77 LEU H 1 77 LEU HG . . 3.530 2.017 1.950 2.240 . 0 0 "[ . 1 . 2]" 1
913 1 77 LEU H 1 78 CYS H . . 3.690 3.010 2.698 3.194 . 0 0 "[ . 1 . 2]" 1
914 1 77 LEU HA 1 77 LEU QD . . 2.780 2.518 2.290 2.731 . 0 0 "[ . 1 . 2]" 1
915 1 77 LEU HA 1 77 LEU HG . . 3.590 2.961 2.917 3.085 . 0 0 "[ . 1 . 2]" 1
916 1 77 LEU HB2 1 77 LEU QD . . 3.040 2.019 1.938 2.145 . 0 0 "[ . 1 . 2]" 1
917 1 77 LEU HB2 1 78 CYS H . . 4.050 1.960 1.914 2.002 . 0 0 "[ . 1 . 2]" 1
918 1 77 LEU HB3 1 77 LEU QD . . 3.050 2.015 1.954 2.088 . 0 0 "[ . 1 . 2]" 1
919 1 77 LEU HB3 1 78 CYS H . . 4.000 3.162 3.000 3.303 . 0 0 "[ . 1 . 2]" 1
920 1 78 CYS H 1 78 CYS HB2 . . 3.760 3.867 3.691 3.997 0.237 13 0 "[ . 1 . 2]" 1
921 1 78 CYS H 1 78 CYS HB3 . . 3.920 3.696 3.493 3.864 . 0 0 "[ . 1 . 2]" 1
922 1 78 CYS H 1 79 GLY H . . 3.490 2.794 1.897 3.513 0.023 4 0 "[ . 1 . 2]" 1
923 1 78 CYS H 1 79 GLY HA2 . . 4.440 4.002 3.641 4.319 . 0 0 "[ . 1 . 2]" 1
924 1 78 CYS HB2 1 79 GLY H . . 4.530 3.298 2.146 4.089 . 0 0 "[ . 1 . 2]" 1
925 1 78 CYS HB2 1 81 THR HB . . 3.960 2.275 1.992 2.891 . 0 0 "[ . 1 . 2]" 1
926 1 78 CYS HB3 1 81 THR HB . . 3.690 3.317 2.721 3.923 0.233 15 0 "[ . 1 . 2]" 1
927 1 78 CYS SG 1 84 CYS SG . . 2.100 2.078 2.001 2.109 0.009 17 0 "[ . 1 . 2]" 1
928 1 81 THR H 1 81 THR HB . . 3.240 2.551 2.313 3.072 . 0 0 "[ . 1 . 2]" 1
929 1 81 THR H 1 81 THR MG . . 3.740 3.611 2.821 3.866 0.126 2 0 "[ . 1 . 2]" 1
930 1 81 THR HA 1 81 THR MG . . 3.070 2.559 2.304 3.153 0.083 3 0 "[ . 1 . 2]" 1
931 1 81 THR HA 1 82 ASN H . . 3.040 2.508 2.292 3.270 0.230 16 0 "[ . 1 . 2]" 1
932 1 81 THR HB 1 82 ASN H . . 4.000 3.897 3.672 4.057 0.057 16 0 "[ . 1 . 2]" 1
933 1 81 THR MG 1 82 ASN H . . 3.570 2.123 1.788 3.604 0.034 14 0 "[ . 1 . 2]" 1
934 1 82 ASN H 1 82 ASN HB2 . . 3.780 3.407 2.294 3.865 0.085 16 0 "[ . 1 . 2]" 1
935 1 82 ASN H 1 82 ASN HB3 . . 3.750 3.368 2.617 3.890 0.140 16 0 "[ . 1 . 2]" 1
936 1 83 PRO HB2 1 84 CYS H . . 4.690 3.138 2.165 3.925 . 0 0 "[ . 1 . 2]" 1
937 1 83 PRO HB2 1 85 ILE MD . . 3.180 2.672 2.048 3.028 . 0 0 "[ . 1 . 2]" 1
938 1 83 PRO HB2 1 85 ILE HG13 . . 3.800 2.310 1.982 2.698 . 0 0 "[ . 1 . 2]" 1
939 1 83 PRO HB3 1 84 CYS H . . 4.700 3.897 3.166 4.561 . 0 0 "[ . 1 . 2]" 1
940 1 83 PRO HB3 1 85 ILE MD . . 3.810 3.655 3.123 3.825 0.015 13 0 "[ . 1 . 2]" 1
941 1 83 PRO HG2 1 85 ILE MD . . 3.280 2.837 2.010 3.296 0.016 16 0 "[ . 1 . 2]" 1
942 1 83 PRO HG3 1 85 ILE MD . . 3.890 3.518 3.096 3.889 . 0 0 "[ . 1 . 2]" 1
943 1 84 CYS H 1 84 CYS QB . . 3.820 2.697 2.126 3.114 . 0 0 "[ . 1 . 2]" 1
944 1 84 CYS HA 1 85 ILE H . . 3.080 2.443 2.270 2.657 . 0 0 "[ . 1 . 2]" 1
945 1 84 CYS QB 1 85 ILE H . . 4.310 4.027 3.949 4.087 . 0 0 "[ . 1 . 2]" 1
946 1 84 CYS QB 1 105 LEU H . . 4.720 4.513 3.803 4.736 0.016 18 0 "[ . 1 . 2]" 1
947 1 84 CYS QB 1 105 LEU HB2 . . 4.290 3.258 2.084 4.039 . 0 0 "[ . 1 . 2]" 1
948 1 84 CYS QB 1 105 LEU HB3 . . 4.040 3.548 3.011 4.046 0.006 1 0 "[ . 1 . 2]" 1
949 1 84 CYS QB 1 105 LEU MD2 . . 4.270 2.935 1.831 3.455 . 0 0 "[ . 1 . 2]" 1
950 1 85 ILE H 1 85 ILE HB . . 3.220 2.506 2.304 2.705 . 0 0 "[ . 1 . 2]" 1
951 1 85 ILE H 1 85 ILE MD . . 4.100 4.005 3.773 4.165 0.065 20 0 "[ . 1 . 2]" 1
952 1 85 ILE H 1 85 ILE HG12 . . 4.440 3.975 3.619 4.244 . 0 0 "[ . 1 . 2]" 1
953 1 85 ILE H 1 85 ILE HG13 . . 4.040 2.880 2.486 3.170 . 0 0 "[ . 1 . 2]" 1
954 1 85 ILE H 1 85 ILE MG . . 3.890 3.760 3.685 3.839 . 0 0 "[ . 1 . 2]" 1
955 1 85 ILE HA 1 85 ILE HG12 . . 3.590 2.479 2.374 2.561 . 0 0 "[ . 1 . 2]" 1
956 1 85 ILE HA 1 103 ILE MG . . 3.940 3.966 3.885 4.033 0.093 17 0 "[ . 1 . 2]" 1
957 1 85 ILE HB 1 85 ILE MD . . 3.090 2.359 2.261 2.484 . 0 0 "[ . 1 . 2]" 1
958 1 85 ILE MD 1 85 ILE MG . . 2.760 1.990 1.875 2.097 . 0 0 "[ . 1 . 2]" 1
959 1 85 ILE MD 1 102 GLU HB3 . . 3.420 3.265 2.710 3.443 0.023 20 0 "[ . 1 . 2]" 1
960 1 85 ILE MD 1 104 GLN QB . . 4.100 4.070 3.832 4.126 0.026 16 0 "[ . 1 . 2]" 1
961 1 85 ILE MD 1 104 GLN HG2 . . 3.500 2.579 2.370 2.986 . 0 0 "[ . 1 . 2]" 1
962 1 85 ILE MD 1 104 GLN HG3 . . 3.910 3.849 3.658 3.916 0.006 6 0 "[ . 1 . 2]" 1
963 1 85 ILE HG12 1 85 ILE MG . . 3.240 2.382 2.291 2.469 . 0 0 "[ . 1 . 2]" 1
964 1 85 ILE HG12 1 104 GLN QB . . 4.130 3.950 3.701 4.144 0.014 17 0 "[ . 1 . 2]" 1
965 1 85 ILE HG13 1 85 ILE MG . . 3.320 3.231 3.225 3.240 . 0 0 "[ . 1 . 2]" 1
966 1 85 ILE MG 1 86 LEU H . . 3.330 2.455 2.270 2.651 . 0 0 "[ . 1 . 2]" 1
967 1 85 ILE MG 1 102 GLU HA . . 3.730 3.105 2.989 3.329 . 0 0 "[ . 1 . 2]" 1
968 1 85 ILE MG 1 102 GLU HB2 . . 3.700 3.639 3.086 3.764 0.064 20 0 "[ . 1 . 2]" 1
969 1 85 ILE MG 1 102 GLU HB3 . . 3.020 2.208 1.797 2.536 . 0 0 "[ . 1 . 2]" 1
970 1 85 ILE MG 1 102 GLU QG . . 3.170 3.101 1.955 3.211 0.041 16 0 "[ . 1 . 2]" 1
971 1 85 ILE MG 1 103 ILE H . . 3.900 1.827 1.738 1.907 . 0 0 "[ . 1 . 2]" 1
972 1 86 LEU H 1 86 LEU HB2 . . 3.870 2.155 2.045 2.505 . 0 0 "[ . 1 . 2]" 1
973 1 86 LEU H 1 86 LEU HB3 . . 3.780 2.865 2.534 3.033 . 0 0 "[ . 1 . 2]" 1
974 1 86 LEU H 1 86 LEU MD1 . . 4.140 3.754 3.455 4.225 0.085 16 0 "[ . 1 . 2]" 1
975 1 86 LEU H 1 86 LEU MD2 . . 4.500 4.340 4.053 4.426 . 0 0 "[ . 1 . 2]" 1
976 1 86 LEU H 1 103 ILE H . . 4.080 3.120 2.892 3.503 . 0 0 "[ . 1 . 2]" 1
977 1 86 LEU H 1 103 ILE HB . . 4.710 2.212 2.085 2.383 . 0 0 "[ . 1 . 2]" 1
978 1 86 LEU H 1 103 ILE MG . . 4.610 2.805 2.662 2.986 . 0 0 "[ . 1 . 2]" 1
979 1 86 LEU HB2 1 86 LEU MD1 . . 3.100 2.097 1.956 2.551 . 0 0 "[ . 1 . 2]" 1
980 1 86 LEU HB2 1 87 HIS H . . 4.610 4.288 4.205 4.492 . 0 0 "[ . 1 . 2]" 1
981 1 86 LEU HB2 1 103 ILE HB . . 3.230 2.305 1.987 3.260 0.030 16 0 "[ . 1 . 2]" 1
982 1 86 LEU HB2 1 103 ILE MG . . 3.650 2.200 1.960 3.018 . 0 0 "[ . 1 . 2]" 1
983 1 86 LEU HB3 1 86 LEU MD1 . . 3.200 2.803 2.111 3.021 . 0 0 "[ . 1 . 2]" 1
984 1 86 LEU HB3 1 86 LEU MD2 . . 3.100 2.050 1.937 2.573 . 0 0 "[ . 1 . 2]" 1
985 1 86 LEU HB3 1 103 ILE H . . 4.660 4.060 3.822 4.591 . 0 0 "[ . 1 . 2]" 1
986 1 86 LEU HB3 1 103 ILE HB . . 3.390 2.011 1.945 2.124 . 0 0 "[ . 1 . 2]" 1
987 1 86 LEU HB3 1 103 ILE MD . . 3.630 2.228 1.975 2.395 . 0 0 "[ . 1 . 2]" 1
988 1 86 LEU HB3 1 103 ILE MG . . 3.210 2.922 2.311 3.142 . 0 0 "[ . 1 . 2]" 1
989 1 86 LEU MD1 1 87 HIS H . . 4.830 4.323 4.158 4.802 . 0 0 "[ . 1 . 2]" 1
990 1 86 LEU MD1 1 103 ILE HB . . 3.670 3.684 3.602 3.730 0.060 10 0 "[ . 1 . 2]" 1
991 1 86 LEU MD1 1 103 ILE MD . . 3.140 2.657 1.947 3.005 . 0 0 "[ . 1 . 2]" 1
992 1 86 LEU MD1 1 103 ILE MG . . 3.250 2.722 2.449 3.174 . 0 0 "[ . 1 . 2]" 1
993 1 86 LEU MD2 1 87 HIS H . . 3.990 2.664 2.014 3.474 . 0 0 "[ . 1 . 2]" 1
994 1 86 LEU MD2 1 103 ILE HB . . 3.610 3.627 3.606 3.691 0.081 2 0 "[ . 1 . 2]" 1
995 1 87 HIS H 1 87 HIS HB2 . . 3.840 3.213 2.792 3.600 . 0 0 "[ . 1 . 2]" 1
996 1 87 HIS H 1 87 HIS HB3 . . 3.640 3.513 3.072 3.757 0.117 18 0 "[ . 1 . 2]" 1
997 1 87 HIS H 1 87 HIS HD2 . . 4.230 3.320 2.376 4.018 . 0 0 "[ . 1 . 2]" 1
998 1 87 HIS H 1 88 PHE H . . 4.650 4.302 4.233 4.451 . 0 0 "[ . 1 . 2]" 1
999 1 87 HIS HA 1 88 PHE H . . 3.090 2.189 2.185 2.195 . 0 0 "[ . 1 . 2]" 1
1000 1 87 HIS HB2 1 88 PHE H . . 3.790 3.935 3.435 4.175 0.385 19 0 "[ . 1 . 2]" 1
1001 1 87 HIS HB3 1 87 HIS HD2 . . 3.920 3.533 2.740 3.952 0.032 14 0 "[ . 1 . 2]" 1
1002 1 87 HIS HB3 1 88 PHE H . . 4.150 3.928 3.620 4.170 0.020 1 0 "[ . 1 . 2]" 1
1003 1 88 PHE H 1 88 PHE HB3 . . 4.150 2.987 2.953 3.031 . 0 0 "[ . 1 . 2]" 1
1004 1 88 PHE H 1 88 PHE QD . . 3.970 2.802 1.983 2.997 . 0 0 "[ . 1 . 2]" 1
1005 1 88 PHE H 1 89 GLN H . . 4.680 4.415 4.401 4.448 . 0 0 "[ . 1 . 2]" 1
1006 1 88 PHE HA 1 88 PHE QD . . 3.900 3.689 3.659 3.732 . 0 0 "[ . 1 . 2]" 1
1007 1 88 PHE HA 1 89 GLN H . . 3.140 2.557 2.461 2.651 . 0 0 "[ . 1 . 2]" 1
1008 1 88 PHE HB2 1 89 GLN H . . 3.770 2.551 2.188 2.707 . 0 0 "[ . 1 . 2]" 1
1009 1 88 PHE HB3 1 89 GLN H . . 3.930 3.939 3.659 4.049 0.119 18 0 "[ . 1 . 2]" 1
1010 1 88 PHE QD 1 89 GLN H . . 3.690 2.449 2.280 3.083 . 0 0 "[ . 1 . 2]" 1
1011 1 88 PHE QD 1 90 VAL MG2 . . 3.160 3.119 2.380 3.219 0.059 3 0 "[ . 1 . 2]" 1
1012 1 88 PHE QD 1 103 ILE MD . . 3.550 2.761 2.542 3.000 . 0 0 "[ . 1 . 2]" 1
1013 1 88 PHE QD 1 103 ILE HG12 . . 3.670 3.663 3.623 3.692 0.022 6 0 "[ . 1 . 2]" 1
1014 1 88 PHE QD 1 103 ILE HG13 . . 4.070 2.046 1.992 2.302 . 0 0 "[ . 1 . 2]" 1
1015 1 88 PHE QE 1 90 VAL MG2 . . 2.950 2.050 1.848 2.279 . 0 0 "[ . 1 . 2]" 1
1016 1 88 PHE QE 1 102 GLU H . . 4.370 2.604 2.381 3.230 . 0 0 "[ . 1 . 2]" 1
1017 1 88 PHE QE 1 103 ILE MD . . 3.650 3.577 3.385 3.656 0.006 1 0 "[ . 1 . 2]" 1
1018 1 88 PHE QE 1 103 ILE HG12 . . 3.330 2.903 2.735 3.132 . 0 0 "[ . 1 . 2]" 1
1019 1 88 PHE QE 1 103 ILE HG13 . . 3.520 2.232 1.986 2.735 . 0 0 "[ . 1 . 2]" 1
1020 1 89 GLN H 1 89 GLN QB . . 3.660 2.769 2.635 2.858 . 0 0 "[ . 1 . 2]" 1
1021 1 89 GLN H 1 89 GLN QG . . 4.590 3.541 3.251 3.890 . 0 0 "[ . 1 . 2]" 1
1022 1 89 GLN H 1 90 VAL HA . . 4.520 4.549 4.489 4.625 0.105 6 0 "[ . 1 . 2]" 1
1023 1 89 GLN HA 1 89 GLN QG . . 3.500 2.211 2.049 2.342 . 0 0 "[ . 1 . 2]" 1
1024 1 89 GLN HA 1 90 VAL H . . 3.020 2.367 2.203 2.593 . 0 0 "[ . 1 . 2]" 1
1025 1 89 GLN HA 1 90 VAL MG2 . . 4.120 3.651 3.437 3.921 . 0 0 "[ . 1 . 2]" 1
1026 1 89 GLN HA 1 100 GLN HA . . 3.560 3.280 3.052 3.519 . 0 0 "[ . 1 . 2]" 1
1027 1 89 GLN HA 1 101 GLY H . . 3.630 2.841 2.547 3.640 0.010 16 0 "[ . 1 . 2]" 1
1028 1 89 GLN QB 1 90 VAL H . . 3.580 2.799 2.241 3.467 . 0 0 "[ . 1 . 2]" 1
1029 1 89 GLN QG 1 90 VAL H . . 4.750 3.743 3.452 4.084 . 0 0 "[ . 1 . 2]" 1
1030 1 89 GLN QG 1 100 GLN HA . . 3.970 2.237 1.969 3.251 . 0 0 "[ . 1 . 2]" 1
1031 1 90 VAL H 1 90 VAL HB . . 3.480 2.325 2.195 2.457 . 0 0 "[ . 1 . 2]" 1
1032 1 90 VAL H 1 90 VAL MG2 . . 3.270 2.696 2.256 3.088 . 0 0 "[ . 1 . 2]" 1
1033 1 90 VAL H 1 99 ILE HB . . 3.780 2.763 2.532 3.024 . 0 0 "[ . 1 . 2]" 1
1034 1 90 VAL H 1 99 ILE MD . . 4.530 3.648 3.462 3.839 . 0 0 "[ . 1 . 2]" 1
1035 1 90 VAL H 1 99 ILE MG . . 4.520 3.641 3.342 3.826 . 0 0 "[ . 1 . 2]" 1
1036 1 90 VAL HA 1 90 VAL MG1 . . 3.020 2.480 2.366 2.568 . 0 0 "[ . 1 . 2]" 1
1037 1 90 VAL HA 1 91 LEU H . . 3.170 2.188 2.181 2.202 . 0 0 "[ . 1 . 2]" 1
1038 1 90 VAL HB 1 99 ILE H . . 4.150 3.266 2.930 3.527 . 0 0 "[ . 1 . 2]" 1
1039 1 90 VAL HB 1 99 ILE HB . . 3.040 1.940 1.912 1.966 . 0 0 "[ . 1 . 2]" 1
1040 1 90 VAL HB 1 99 ILE MD . . 3.440 2.288 2.246 2.363 . 0 0 "[ . 1 . 2]" 1
1041 1 90 VAL HB 1 99 ILE HG12 . . 3.860 3.926 3.895 3.951 0.091 18 0 "[ . 1 . 2]" 1
1042 1 90 VAL HB 1 99 ILE MG . . 3.420 3.358 3.208 3.459 0.039 16 0 "[ . 1 . 2]" 1
1043 1 90 VAL MG1 1 91 LEU H . . 3.290 3.026 2.707 3.207 . 0 0 "[ . 1 . 2]" 1
1044 1 90 VAL MG1 1 92 LEU QD . . 2.650 2.359 2.083 2.507 . 0 0 "[ . 1 . 2]" 1
1045 1 90 VAL MG1 1 92 LEU HG . . 3.290 2.370 2.226 2.540 . 0 0 "[ . 1 . 2]" 1
1046 1 90 VAL MG1 1 99 ILE H . . 4.050 4.081 4.054 4.113 0.063 8 0 "[ . 1 . 2]" 1
1047 1 90 VAL MG1 1 99 ILE HB . . 3.380 3.392 3.295 3.468 0.088 1 0 "[ . 1 . 2]" 1
1048 1 90 VAL MG2 1 91 LEU H . . 4.110 4.032 3.853 4.177 0.067 6 0 "[ . 1 . 2]" 1
1049 1 90 VAL MG2 1 99 ILE HB . . 3.400 3.225 2.930 3.405 0.005 19 0 "[ . 1 . 2]" 1
1050 1 90 VAL MG2 1 99 ILE MD . . 3.660 3.700 3.680 3.719 0.059 14 0 "[ . 1 . 2]" 1
1051 1 91 LEU H 1 91 LEU HB2 . . 3.430 3.052 2.933 3.142 . 0 0 "[ . 1 . 2]" 1
1052 1 91 LEU H 1 91 LEU HB3 . . 3.610 2.178 2.114 2.247 . 0 0 "[ . 1 . 2]" 1
1053 1 91 LEU H 1 91 LEU HG . . 4.050 4.018 3.936 4.069 0.019 16 0 "[ . 1 . 2]" 1
1054 1 91 LEU HA 1 91 LEU QD . . 3.070 2.208 2.055 2.426 . 0 0 "[ . 1 . 2]" 1
1055 1 91 LEU HA 1 91 LEU HG . . 3.550 3.413 3.238 3.463 . 0 0 "[ . 1 . 2]" 1
1056 1 91 LEU HA 1 92 LEU H . . 3.240 2.228 2.217 2.239 . 0 0 "[ . 1 . 2]" 1
1057 1 91 LEU HA 1 98 PHE HA . . 3.620 2.898 2.749 3.141 . 0 0 "[ . 1 . 2]" 1
1058 1 91 LEU HA 1 99 ILE H . . 4.620 4.283 4.125 4.519 . 0 0 "[ . 1 . 2]" 1
1059 1 91 LEU HB2 1 91 LEU QD . . 3.230 2.174 2.130 2.198 . 0 0 "[ . 1 . 2]" 1
1060 1 91 LEU HB2 1 92 LEU H . . 4.040 3.944 3.856 4.010 . 0 0 "[ . 1 . 2]" 1
1061 1 91 LEU HB3 1 91 LEU QD . . 3.240 2.158 2.012 2.268 . 0 0 "[ . 1 . 2]" 1
1062 1 91 LEU QD 1 92 LEU H . . 3.300 2.023 1.911 2.367 . 0 0 "[ . 1 . 2]" 1
1063 1 91 LEU QD 1 93 LYS QE . . 3.250 3.047 2.946 3.085 . 0 0 "[ . 1 . 2]" 1
1064 1 91 LEU QD 1 96 VAL MG1 . . 3.080 3.063 2.977 3.081 0.001 5 0 "[ . 1 . 2]" 1
1065 1 91 LEU QD 1 96 VAL MG2 . . 3.600 3.555 3.532 3.608 0.008 5 0 "[ . 1 . 2]" 1
1066 1 91 LEU QD 1 97 GLN H . . 3.840 3.513 3.304 3.613 . 0 0 "[ . 1 . 2]" 1
1067 1 91 LEU QD 1 98 PHE QD . . 3.840 3.373 3.162 3.630 . 0 0 "[ . 1 . 2]" 1
1068 1 91 LEU QD 1 98 PHE QE . . 4.080 2.438 2.107 2.812 . 0 0 "[ . 1 . 2]" 1
1069 1 91 LEU QD 1 98 PHE HZ . . 3.560 2.191 1.936 2.482 . 0 0 "[ . 1 . 2]" 1
1070 1 91 LEU HG 1 92 LEU H . . 4.310 3.341 3.065 3.473 . 0 0 "[ . 1 . 2]" 1
1071 1 92 LEU H 1 92 LEU HB2 . . 4.000 2.611 2.539 2.674 . 0 0 "[ . 1 . 2]" 1
1072 1 92 LEU H 1 92 LEU QD . . 3.870 3.562 3.508 3.610 . 0 0 "[ . 1 . 2]" 1
1073 1 92 LEU H 1 92 LEU HG . . 3.870 3.210 3.005 3.369 . 0 0 "[ . 1 . 2]" 1
1074 1 92 LEU H 1 97 GLN H . . 4.110 2.743 2.604 2.824 . 0 0 "[ . 1 . 2]" 1
1075 1 92 LEU H 1 98 PHE HA . . 3.980 3.480 3.429 3.547 . 0 0 "[ . 1 . 2]" 1
1076 1 92 LEU HA 1 92 LEU QD . . 2.980 1.978 1.934 2.028 . 0 0 "[ . 1 . 2]" 1
1077 1 92 LEU HA 1 92 LEU HG . . 3.890 3.064 3.034 3.134 . 0 0 "[ . 1 . 2]" 1
1078 1 92 LEU HA 1 93 LYS H . . 3.420 2.311 2.284 2.350 . 0 0 "[ . 1 . 2]" 1
1079 1 92 LEU HB2 1 92 LEU QD . . 2.910 2.286 2.202 2.358 . 0 0 "[ . 1 . 2]" 1
1080 1 92 LEU HB2 1 93 LYS H . . 4.110 4.021 3.946 4.115 0.005 16 0 "[ . 1 . 2]" 1
1081 1 92 LEU HB3 1 93 LYS H . . 4.020 2.875 2.764 2.963 . 0 0 "[ . 1 . 2]" 1
1082 1 92 LEU HB3 1 97 GLN QB . . 3.890 3.306 2.869 3.823 . 0 0 "[ . 1 . 2]" 1
1083 1 92 LEU QD 1 93 LYS H . . 4.110 3.275 3.034 3.447 . 0 0 "[ . 1 . 2]" 1
1084 1 92 LEU QD 1 97 GLN QB . . 3.460 2.299 1.898 2.890 . 0 0 "[ . 1 . 2]" 1
1085 1 92 LEU QD 1 97 GLN HG2 . . 3.880 3.466 2.423 4.424 0.544 13 1 "[ . 1 + . 2]" 1
1086 1 93 LYS H 1 93 LYS HB2 . . 4.140 2.450 2.417 2.504 . 0 0 "[ . 1 . 2]" 1
1087 1 93 LYS H 1 93 LYS HB3 . . 3.640 3.631 3.615 3.660 0.020 7 0 "[ . 1 . 2]" 1
1088 1 93 LYS H 1 93 LYS QG . . 3.590 2.710 2.546 3.020 . 0 0 "[ . 1 . 2]" 1
1089 1 93 LYS HA 1 93 LYS QG . . 3.460 2.325 2.222 2.425 . 0 0 "[ . 1 . 2]" 1
1090 1 93 LYS HA 1 94 SER H . . 3.230 2.593 2.575 2.616 . 0 0 "[ . 1 . 2]" 1
1091 1 93 LYS HA 1 96 VAL HA . . 3.150 2.664 2.596 2.716 . 0 0 "[ . 1 . 2]" 1
1092 1 93 LYS HA 1 96 VAL MG1 . . 3.860 3.813 3.616 3.897 0.037 9 0 "[ . 1 . 2]" 1
1093 1 93 LYS HA 1 96 VAL MG2 . . 3.200 2.342 2.092 2.488 . 0 0 "[ . 1 . 2]" 1
1094 1 93 LYS HA 1 97 GLN H . . 4.150 4.167 4.097 4.207 0.057 4 0 "[ . 1 . 2]" 1
1095 1 93 LYS HB2 1 94 SER H . . 3.440 3.470 3.447 3.492 0.052 14 0 "[ . 1 . 2]" 1
1096 1 93 LYS HB3 1 94 SER H . . 3.660 2.262 2.213 2.309 . 0 0 "[ . 1 . 2]" 1
1097 1 93 LYS HB3 1 96 VAL MG2 . . 3.820 3.718 3.447 3.859 0.039 9 0 "[ . 1 . 2]" 1
1098 1 93 LYS QE 1 93 LYS QG . . 2.920 2.083 1.988 2.235 . 0 0 "[ . 1 . 2]" 1
1099 1 93 LYS QG 1 94 SER H . . 3.940 3.871 3.734 3.978 0.038 11 0 "[ . 1 . 2]" 1
1100 1 94 SER H 1 94 SER HB2 . . 3.510 3.507 3.216 3.584 0.074 1 0 "[ . 1 . 2]" 1
1101 1 94 SER H 1 94 SER HB3 . . 3.460 2.334 2.206 3.374 . 0 0 "[ . 1 . 2]" 1
1102 1 94 SER H 1 96 VAL H . . 4.310 3.740 3.665 3.780 . 0 0 "[ . 1 . 2]" 1
1103 1 94 SER H 1 96 VAL HA . . 3.720 3.828 3.806 3.860 0.140 4 0 "[ . 1 . 2]" 1
1104 1 94 SER H 1 96 VAL MG2 . . 3.270 2.332 2.083 2.459 . 0 0 "[ . 1 . 2]" 1
1105 1 94 SER HA 1 95 PRO HA . . 3.080 1.686 1.677 1.691 . 0 0 "[ . 1 . 2]" 1
1106 1 94 SER HA 1 96 VAL H . . 4.600 1.978 1.955 2.013 . 0 0 "[ . 1 . 2]" 1
1107 1 94 SER HA 1 96 VAL MG2 . . 4.260 2.700 2.641 2.759 . 0 0 "[ . 1 . 2]" 1
1108 1 94 SER HB2 1 95 PRO HA . . 3.610 3.207 3.119 4.004 0.394 12 0 "[ . 1 . 2]" 1
1109 1 94 SER HB3 1 95 PRO HA . . 4.030 3.934 3.208 4.033 0.003 10 0 "[ . 1 . 2]" 1
1110 1 95 PRO HA 1 96 VAL H . . 3.290 2.150 2.149 2.151 . 0 0 "[ . 1 . 2]" 1
1111 1 95 PRO HB2 1 96 VAL H . . 3.640 3.764 3.745 3.775 0.135 10 0 "[ . 1 . 2]" 1
1112 1 95 PRO HB3 1 96 VAL H . . 4.090 4.052 4.037 4.059 . 0 0 "[ . 1 . 2]" 1
1113 1 96 VAL H 1 96 VAL HB . . 2.950 2.241 2.194 2.290 . 0 0 "[ . 1 . 2]" 1
1114 1 96 VAL H 1 96 VAL MG1 . . 3.650 3.657 3.636 3.676 0.026 10 0 "[ . 1 . 2]" 1
1115 1 96 VAL H 1 96 VAL MG2 . . 2.850 2.307 2.210 2.413 . 0 0 "[ . 1 . 2]" 1
1116 1 96 VAL HA 1 96 VAL MG1 . . 3.030 2.549 2.500 2.582 . 0 0 "[ . 1 . 2]" 1
1117 1 96 VAL HA 1 96 VAL MG2 . . 2.880 2.318 2.297 2.342 . 0 0 "[ . 1 . 2]" 1
1118 1 96 VAL HA 1 97 GLN H . . 3.100 2.222 2.195 2.257 . 0 0 "[ . 1 . 2]" 1
1119 1 96 VAL MG1 1 97 GLN H . . 3.200 2.578 2.172 2.772 . 0 0 "[ . 1 . 2]" 1
1120 1 96 VAL MG1 1 98 PHE QD . . 3.840 3.205 2.919 3.424 . 0 0 "[ . 1 . 2]" 1
1121 1 96 VAL MG1 1 98 PHE QE . . 3.200 2.286 1.897 2.506 . 0 0 "[ . 1 . 2]" 1
1122 1 96 VAL MG2 1 97 GLN H . . 4.220 3.841 3.767 3.936 . 0 0 "[ . 1 . 2]" 1
1123 1 97 GLN H 1 97 GLN QB . . 3.870 2.858 2.756 2.918 . 0 0 "[ . 1 . 2]" 1
1124 1 97 GLN HA 1 97 GLN HG2 . . 3.770 2.821 2.099 3.304 . 0 0 "[ . 1 . 2]" 1
1125 1 97 GLN HA 1 97 GLN HG3 . . 3.840 2.858 2.515 3.324 . 0 0 "[ . 1 . 2]" 1
1126 1 97 GLN HA 1 98 PHE H . . 2.960 2.407 2.322 2.498 . 0 0 "[ . 1 . 2]" 1
1127 1 97 GLN HA 1 98 PHE HB2 . . 4.410 4.277 4.182 4.341 . 0 0 "[ . 1 . 2]" 1
1128 1 97 GLN QB 1 98 PHE H . . 3.990 3.424 3.198 3.605 . 0 0 "[ . 1 . 2]" 1
1129 1 97 GLN HE21 1 99 ILE MD . . 3.910 2.864 2.210 3.547 . 0 0 "[ . 1 . 2]" 1
1130 1 97 GLN HE21 1 99 ILE HG13 . . 4.160 3.103 2.371 4.842 0.682 11 1 "[ . 1+ . 2]" 1
1131 1 97 GLN HE22 1 97 GLN HG2 . . 3.700 3.525 3.450 4.156 0.456 11 0 "[ . 1 . 2]" 1
1132 1 97 GLN HE22 1 97 GLN HG3 . . 3.820 3.827 3.521 3.924 0.104 7 0 "[ . 1 . 2]" 1
1133 1 97 GLN HE22 1 99 ILE MD . . 4.030 3.200 2.108 4.031 0.001 16 0 "[ . 1 . 2]" 1
1134 1 97 GLN HG2 1 98 PHE H . . 4.090 2.286 2.022 2.661 . 0 0 "[ . 1 . 2]" 1
1135 1 97 GLN HG3 1 98 PHE H . . 4.430 2.838 1.939 3.953 . 0 0 "[ . 1 . 2]" 1
1136 1 97 GLN HG3 1 99 ILE MD . . 4.060 4.030 3.581 4.392 0.332 9 0 "[ . 1 . 2]" 1
1137 1 98 PHE H 1 98 PHE HB2 . . 3.360 2.479 2.284 2.595 . 0 0 "[ . 1 . 2]" 1
1138 1 98 PHE H 1 98 PHE HB3 . . 3.760 3.651 3.523 3.722 . 0 0 "[ . 1 . 2]" 1
1139 1 98 PHE H 1 98 PHE QD . . 4.090 2.845 2.446 3.253 . 0 0 "[ . 1 . 2]" 1
1140 1 98 PHE HA 1 98 PHE QD . . 4.120 3.072 2.868 3.190 . 0 0 "[ . 1 . 2]" 1
1141 1 98 PHE HA 1 99 ILE H . . 2.900 2.382 2.318 2.414 . 0 0 "[ . 1 . 2]" 1
1142 1 98 PHE HA 1 99 ILE HB . . 4.150 4.361 4.327 4.387 0.237 12 0 "[ . 1 . 2]" 1
1143 1 98 PHE HA 1 99 ILE MD . . 4.080 2.671 2.602 2.734 . 0 0 "[ . 1 . 2]" 1
1144 1 98 PHE HB2 1 99 ILE H . . 4.060 3.968 3.882 4.052 . 0 0 "[ . 1 . 2]" 1
1145 1 98 PHE HB3 1 99 ILE H . . 4.030 2.766 2.671 2.944 . 0 0 "[ . 1 . 2]" 1
1146 1 99 ILE H 1 99 ILE HB . . 3.470 2.596 2.517 2.696 . 0 0 "[ . 1 . 2]" 1
1147 1 99 ILE H 1 99 ILE MD . . 3.690 2.626 2.459 2.741 . 0 0 "[ . 1 . 2]" 1
1148 1 99 ILE H 1 99 ILE HG13 . . 4.080 3.904 3.849 3.960 . 0 0 "[ . 1 . 2]" 1
1149 1 99 ILE H 1 99 ILE MG . . 4.220 3.762 3.715 3.817 . 0 0 "[ . 1 . 2]" 1
1150 1 99 ILE HA 1 99 ILE MD . . 3.350 3.146 3.039 3.243 . 0 0 "[ . 1 . 2]" 1
1151 1 99 ILE HA 1 99 ILE HG12 . . 3.640 3.514 3.456 3.566 . 0 0 "[ . 1 . 2]" 1
1152 1 99 ILE HA 1 99 ILE HG13 . . 3.750 2.274 2.232 2.328 . 0 0 "[ . 1 . 2]" 1
1153 1 99 ILE HA 1 99 ILE MG . . 2.970 2.500 2.454 2.548 . 0 0 "[ . 1 . 2]" 1
1154 1 99 ILE HA 1 100 GLN H . . 3.000 2.449 2.331 2.493 . 0 0 "[ . 1 . 2]" 1
1155 1 99 ILE HB 1 99 ILE MD . . 2.920 2.056 2.015 2.135 . 0 0 "[ . 1 . 2]" 1
1156 1 99 ILE HG12 1 99 ILE MG . . 3.120 2.220 2.191 2.252 . 0 0 "[ . 1 . 2]" 1
1157 1 99 ILE MG 1 100 GLN H . . 3.260 1.889 1.793 2.172 . 0 0 "[ . 1 . 2]" 1
1158 1 100 GLN H 1 100 GLN HB2 . . 3.390 3.046 2.749 3.774 0.384 13 0 "[ . 1 . 2]" 1
1159 1 100 GLN H 1 100 GLN HB3 . . 3.990 3.665 2.803 3.887 . 0 0 "[ . 1 . 2]" 1
1160 1 100 GLN H 1 100 GLN QG . . 3.280 2.370 2.102 2.579 . 0 0 "[ . 1 . 2]" 1
1161 1 100 GLN HA 1 100 GLN QG . . 3.310 2.729 2.469 3.327 0.017 9 0 "[ . 1 . 2]" 1
1162 1 100 GLN HA 1 101 GLY H . . 3.070 2.336 2.237 2.467 . 0 0 "[ . 1 . 2]" 1
1163 1 100 GLN HB2 1 101 GLY H . . 4.570 4.370 4.025 4.504 . 0 0 "[ . 1 . 2]" 1
1164 1 100 GLN HB3 1 101 GLY H . . 4.640 4.284 3.962 4.649 0.009 9 0 "[ . 1 . 2]" 1
1165 1 100 GLN QG 1 101 GLY H . . 4.650 4.520 4.228 4.606 . 0 0 "[ . 1 . 2]" 1
1166 1 101 GLY HA2 1 102 GLU H . . 3.440 2.599 2.282 2.763 . 0 0 "[ . 1 . 2]" 1
1167 1 101 GLY HA3 1 102 GLU H . . 3.500 2.650 2.487 3.049 . 0 0 "[ . 1 . 2]" 1
1168 1 102 GLU H 1 102 GLU HB2 . . 4.010 2.753 2.554 2.899 . 0 0 "[ . 1 . 2]" 1
1169 1 102 GLU H 1 102 GLU HB3 . . 4.080 3.794 3.506 3.878 . 0 0 "[ . 1 . 2]" 1
1170 1 102 GLU H 1 102 GLU QG . . 4.280 3.375 2.668 4.109 . 0 0 "[ . 1 . 2]" 1
1171 1 102 GLU HA 1 102 GLU QG . . 3.610 2.466 2.035 2.978 . 0 0 "[ . 1 . 2]" 1
1172 1 102 GLU HA 1 103 ILE H . . 3.260 2.457 2.351 2.622 . 0 0 "[ . 1 . 2]" 1
1173 1 102 GLU HB3 1 103 ILE H . . 3.810 2.579 2.197 2.935 . 0 0 "[ . 1 . 2]" 1
1174 1 102 GLU QG 1 103 ILE H . . 4.580 3.982 3.022 4.332 . 0 0 "[ . 1 . 2]" 1
1175 1 103 ILE H 1 103 ILE HB . . 3.590 2.595 2.514 2.798 . 0 0 "[ . 1 . 2]" 1
1176 1 103 ILE H 1 103 ILE HG12 . . 4.080 4.026 3.920 4.104 0.024 7 0 "[ . 1 . 2]" 1
1177 1 103 ILE H 1 103 ILE MG . . 4.270 3.766 3.715 3.846 . 0 0 "[ . 1 . 2]" 1
1178 1 103 ILE HA 1 103 ILE MD . . 3.830 3.685 3.599 3.733 . 0 0 "[ . 1 . 2]" 1
1179 1 103 ILE HA 1 103 ILE HG12 . . 3.870 2.318 2.280 2.371 . 0 0 "[ . 1 . 2]" 1
1180 1 103 ILE HA 1 103 ILE HG13 . . 3.870 3.073 2.981 3.234 . 0 0 "[ . 1 . 2]" 1
1181 1 103 ILE HA 1 103 ILE MG . . 3.220 2.502 2.444 2.537 . 0 0 "[ . 1 . 2]" 1
1182 1 103 ILE HA 1 104 GLN H . . 3.250 2.196 2.177 2.224 . 0 0 "[ . 1 . 2]" 1
1183 1 103 ILE HB 1 103 ILE MD . . 3.190 2.447 2.362 2.536 . 0 0 "[ . 1 . 2]" 1
1184 1 103 ILE HG12 1 103 ILE MG . . 3.060 2.567 2.541 2.624 . 0 0 "[ . 1 . 2]" 1
1185 1 103 ILE HG12 1 104 GLN H . . 4.370 4.410 4.340 4.453 0.083 13 0 "[ . 1 . 2]" 1
1186 1 103 ILE HG13 1 103 ILE MG . . 3.190 3.211 3.197 3.220 0.030 11 0 "[ . 1 . 2]" 1
1187 1 103 ILE MG 1 104 GLN H . . 3.540 3.061 2.768 3.237 . 0 0 "[ . 1 . 2]" 1
1188 1 104 GLN H 1 104 GLN QB . . 3.280 2.376 2.278 2.470 . 0 0 "[ . 1 . 2]" 1
1189 1 104 GLN H 1 104 GLN HG3 . . 3.910 2.935 2.096 3.201 . 0 0 "[ . 1 . 2]" 1
1190 1 104 GLN HA 1 104 GLN HG2 . . 3.760 2.323 2.172 2.607 . 0 0 "[ . 1 . 2]" 1
1191 1 104 GLN HA 1 104 GLN HG3 . . 3.750 3.499 2.973 3.638 . 0 0 "[ . 1 . 2]" 1
1192 1 104 GLN HA 1 105 LEU H . . 3.180 2.308 2.206 2.399 . 0 0 "[ . 1 . 2]" 1
1193 1 104 GLN QB 1 104 GLN HE22 . . 4.530 3.982 3.673 4.189 . 0 0 "[ . 1 . 2]" 1
1194 1 104 GLN QB 1 105 LEU H . . 3.970 2.921 2.648 3.383 . 0 0 "[ . 1 . 2]" 1
1195 1 104 GLN HE22 1 104 GLN HG2 . . 4.000 3.867 3.547 4.086 0.086 14 0 "[ . 1 . 2]" 1
1196 1 104 GLN HE22 1 104 GLN HG3 . . 3.940 3.509 3.446 3.723 . 0 0 "[ . 1 . 2]" 1
1197 1 105 LEU H 1 105 LEU HB2 . . 3.600 2.756 2.017 3.188 . 0 0 "[ . 1 . 2]" 1
1198 1 105 LEU H 1 105 LEU HB3 . . 3.580 2.572 2.083 3.488 . 0 0 "[ . 1 . 2]" 1
1199 1 105 LEU H 1 105 LEU MD2 . . 4.240 3.473 2.227 4.066 . 0 0 "[ . 1 . 2]" 1
1200 1 105 LEU H 1 105 LEU HG . . 3.960 3.930 3.795 4.016 0.056 20 0 "[ . 1 . 2]" 1
1201 1 105 LEU HA 1 105 LEU MD1 . . 3.280 2.496 2.144 2.692 . 0 0 "[ . 1 . 2]" 1
1202 1 105 LEU HA 1 105 LEU HG . . 3.720 3.490 3.325 3.685 . 0 0 "[ . 1 . 2]" 1
1203 1 105 LEU HA 1 106 GLN H . . 3.290 2.210 2.177 2.328 . 0 0 "[ . 1 . 2]" 1
1204 1 105 LEU HB2 1 105 LEU MD2 . . 3.360 2.551 2.426 2.651 . 0 0 "[ . 1 . 2]" 1
1205 1 105 LEU HB2 1 106 GLN H . . 4.590 4.121 3.706 4.589 . 0 0 "[ . 1 . 2]" 1
1206 1 105 LEU HB3 1 105 LEU HG . . 3.010 2.557 2.435 2.625 . 0 0 "[ . 1 . 2]" 1
1207 1 105 LEU HB3 1 106 GLN H . . 4.050 4.114 3.197 4.525 0.475 3 0 "[ . 1 . 2]" 1
1208 1 105 LEU MD1 1 106 GLN H . . 3.970 2.594 2.082 3.388 . 0 0 "[ . 1 . 2]" 1
1209 1 106 GLN H 1 106 GLN HB2 . . 3.450 2.116 2.020 2.280 . 0 0 "[ . 1 . 2]" 1
1210 1 106 GLN H 1 106 GLN HB3 . . 3.420 3.382 3.208 3.515 0.095 11 0 "[ . 1 . 2]" 1
1211 1 106 GLN H 1 106 GLN QG . . 3.350 2.985 2.473 3.359 0.009 17 0 "[ . 1 . 2]" 1
1212 1 106 GLN HA 1 106 GLN QG . . 3.370 2.297 2.035 2.529 . 0 0 "[ . 1 . 2]" 1
1213 1 106 GLN HA 1 107 ASP H . . 3.130 2.289 2.202 2.532 . 0 0 "[ . 1 . 2]" 1
1214 1 107 ASP H 1 107 ASP HB2 . . 3.570 2.770 2.059 3.562 . 0 0 "[ . 1 . 2]" 1
1215 1 107 ASP H 1 107 ASP HB3 . . 3.600 3.058 2.264 3.583 . 0 0 "[ . 1 . 2]" 1
1216 1 107 ASP HA 1 108 VAL H . . 3.180 2.399 2.260 2.713 . 0 0 "[ . 1 . 2]" 1
1217 1 107 ASP HB2 1 108 VAL H . . 4.440 3.997 2.696 4.452 0.012 8 0 "[ . 1 . 2]" 1
1218 1 107 ASP HB3 1 108 VAL H . . 4.450 3.730 2.629 4.423 . 0 0 "[ . 1 . 2]" 1
1219 1 108 VAL H 1 108 VAL HB . . 3.350 2.365 2.102 3.523 0.173 5 0 "[ . 1 . 2]" 1
1220 1 108 VAL H 1 108 VAL MG1 . . 3.560 3.126 1.916 3.609 0.049 13 0 "[ . 1 . 2]" 1
1221 1 108 VAL H 1 108 VAL MG2 . . 3.180 2.930 1.926 3.640 0.460 12 0 "[ . 1 . 2]" 1
1222 1 108 VAL HA 1 108 VAL MG1 . . 2.860 2.720 2.124 3.197 0.337 12 0 "[ . 1 . 2]" 1
1223 1 108 VAL HA 1 108 VAL MG2 . . 3.230 2.323 2.066 3.210 . 0 0 "[ . 1 . 2]" 1
1224 1 108 VAL HA 1 109 ASN H . . 3.320 2.252 2.182 2.441 . 0 0 "[ . 1 . 2]" 1
1225 1 108 VAL MG1 1 109 ASN H . . 4.350 3.350 2.221 4.286 . 0 0 "[ . 1 . 2]" 1
1226 1 109 ASN H 1 109 ASN HB2 . . 4.030 3.327 2.624 4.034 0.004 14 0 "[ . 1 . 2]" 1
1227 1 109 ASN H 1 109 ASN HB3 . . 3.970 3.411 2.685 3.856 . 0 0 "[ . 1 . 2]" 1
1228 1 110 ASP H 1 110 ASP QB . . 3.580 2.740 2.026 3.361 . 0 0 "[ . 1 . 2]" 1
1229 1 112 ALA H 1 112 ALA MB . . 3.610 2.562 2.017 2.912 . 0 0 "[ . 1 . 2]" 1
1230 1 112 ALA HA 1 113 PRO HD2 . . 2.810 2.489 2.239 2.677 . 0 0 "[ . 1 . 2]" 1
1231 1 112 ALA HA 1 113 PRO HD3 . . 2.780 1.960 1.920 2.002 . 0 0 "[ . 1 . 2]" 1
1232 1 112 ALA HA 1 113 PRO QG . . 3.880 3.867 3.815 3.923 0.043 9 0 "[ . 1 . 2]" 1
1233 1 112 ALA MB 1 113 PRO HD2 . . 3.670 2.636 2.180 3.250 . 0 0 "[ . 1 . 2]" 1
1234 1 112 ALA MB 1 113 PRO HD3 . . 3.270 3.307 3.009 3.693 0.423 16 0 "[ . 1 . 2]" 1
1235 1 113 PRO HA 1 114 GLU H . . 3.040 2.333 2.167 2.629 . 0 0 "[ . 1 . 2]" 1
1236 1 113 PRO HB2 1 114 GLU H . . 3.930 3.040 2.265 3.593 . 0 0 "[ . 1 . 2]" 1
1237 1 113 PRO HB3 1 114 GLU H . . 3.950 3.597 3.202 3.928 . 0 0 "[ . 1 . 2]" 1
1238 1 114 GLU H 1 114 GLU HB2 . . 3.660 2.994 2.025 3.915 0.255 8 0 "[ . 1 . 2]" 1
1239 1 114 GLU H 1 114 GLU HB3 . . 3.910 3.281 2.444 3.881 . 0 0 "[ . 1 . 2]" 1
1240 1 114 GLU H 1 114 GLU HG3 . . 4.320 4.275 3.667 5.047 0.727 1 4 "[+ -*. *1 . 2]" 1
1241 1 114 GLU HA 1 114 GLU HB3 . . 2.910 2.744 2.480 3.047 0.137 17 0 "[ . 1 . 2]" 1
1242 1 114 GLU HA 1 114 GLU HG2 . . 4.030 2.894 1.996 3.803 . 0 0 "[ . 1 . 2]" 1
1243 1 114 GLU HA 1 114 GLU HG3 . . 3.850 3.326 2.028 4.044 0.194 11 0 "[ . 1 . 2]" 1
1244 1 114 GLU HA 1 115 PHE H . . 3.000 2.365 2.204 2.623 . 0 0 "[ . 1 . 2]" 1
1245 1 114 GLU HB3 1 114 GLU HG2 . . 2.790 2.787 2.266 3.051 0.261 14 0 "[ . 1 . 2]" 1
1246 1 114 GLU HB3 1 114 GLU HG3 . . 2.910 2.770 2.565 2.930 0.020 10 0 "[ . 1 . 2]" 1
1247 1 114 GLU HB3 1 115 PHE H . . 4.410 3.556 2.501 4.694 0.284 11 0 "[ . 1 . 2]" 1
1248 1 115 PHE H 1 115 PHE HB2 . . 3.710 2.777 1.941 3.703 . 0 0 "[ . 1 . 2]" 1
1249 1 115 PHE H 1 115 PHE HB3 . . 3.670 3.069 2.197 3.602 . 0 0 "[ . 1 . 2]" 1
1250 1 115 PHE HA 1 115 PHE QD . . 3.840 2.875 2.312 3.750 . 0 0 "[ . 1 . 2]" 1
1251 1 115 PHE HA 1 116 MET H . . 3.410 2.544 2.193 3.610 0.200 3 0 "[ . 1 . 2]" 1
1252 1 116 MET H 1 116 MET HB2 . . 3.790 2.802 1.987 3.793 0.003 12 0 "[ . 1 . 2]" 1
1253 1 116 MET HA 1 117 GLU H . . 3.120 2.504 2.205 3.163 0.043 19 0 "[ . 1 . 2]" 1
1254 1 116 MET HB3 1 117 GLU H . . 3.890 3.619 2.774 3.957 0.067 12 0 "[ . 1 . 2]" 1
1255 1 117 GLU H 1 117 GLU HB2 . . 3.550 2.852 2.094 3.346 . 0 0 "[ . 1 . 2]" 1
1256 1 117 GLU H 1 117 GLU QG . . 4.380 4.098 3.643 4.369 . 0 0 "[ . 1 . 2]" 1
1257 1 117 GLU HA 1 117 GLU QG . . 3.030 2.146 1.982 2.445 . 0 0 "[ . 1 . 2]" 1
1258 1 117 GLU HA 1 118 ASP H . . 2.930 2.351 2.231 2.553 . 0 0 "[ . 1 . 2]" 1
1259 1 117 GLU HB3 1 118 ASP H . . 3.760 3.492 2.856 3.760 . 0 0 "[ . 1 . 2]" 1
1260 1 117 GLU QG 1 118 ASP H . . 3.110 2.473 2.082 3.019 . 0 0 "[ . 1 . 2]" 1
1261 1 118 ASP H 1 118 ASP HB2 . . 3.790 3.054 2.288 3.914 0.124 18 0 "[ . 1 . 2]" 1
1262 1 118 ASP H 1 118 ASP HB3 . . 3.910 3.405 2.656 3.778 . 0 0 "[ . 1 . 2]" 1
1263 1 118 ASP HA 1 119 GLU H . . 3.330 2.416 2.253 2.679 . 0 0 "[ . 1 . 2]" 1
1264 1 119 GLU H 1 119 GLU HB2 . . 4.060 3.052 2.261 4.043 . 0 0 "[ . 1 . 2]" 1
1265 1 119 GLU H 1 119 GLU HB3 . . 3.950 3.477 2.728 3.961 0.011 7 0 "[ . 1 . 2]" 1
1266 1 119 GLU H 1 119 GLU HG2 . . 4.390 4.193 1.981 5.084 0.694 18 5 "[** .* 1- . + 2]" 1
1267 1 119 GLU HA 1 119 GLU HG2 . . 3.680 2.619 2.002 3.879 0.199 13 0 "[ . 1 . 2]" 1
1268 1 121 GLY HA2 1 122 PRO QD . . 3.180 1.914 1.853 2.224 . 0 0 "[ . 1 . 2]" 1
1269 1 121 GLY HA3 1 122 PRO QD . . 3.020 2.887 2.297 3.232 0.212 3 0 "[ . 1 . 2]" 1
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