NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
621521 |
6amr   |
19452 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6amr
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 1413
_Distance_constraint_stats_list.Viol_count 685
_Distance_constraint_stats_list.Viol_total 79.728
_Distance_constraint_stats_list.Viol_max 0.030
_Distance_constraint_stats_list.Viol_rms 0.0011
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0058
_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 18 GLY 0.036 0.015 12 0 "[ . 1 . 2]"
1 19 PRO 0.083 0.015 12 0 "[ . 1 . 2]"
1 20 GLY 0.073 0.022 20 0 "[ . 1 . 2]"
1 21 SER 0.026 0.022 20 0 "[ . 1 . 2]"
1 22 MET 0.010 0.007 1 0 "[ . 1 . 2]"
1 23 ILE 0.140 0.009 6 0 "[ . 1 . 2]"
1 24 GLU 0.031 0.008 7 0 "[ . 1 . 2]"
1 25 GLN 0.020 0.009 8 0 "[ . 1 . 2]"
1 26 ILE 0.071 0.009 9 0 "[ . 1 . 2]"
1 27 GLY 0.045 0.009 4 0 "[ . 1 . 2]"
1 28 ASP 0.008 0.005 19 0 "[ . 1 . 2]"
1 29 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 GLU 0.285 0.018 9 0 "[ . 1 . 2]"
1 31 PHE 0.013 0.006 1 0 "[ . 1 . 2]"
1 32 ASP 0.019 0.015 19 0 "[ . 1 . 2]"
1 33 ASN 0.301 0.026 13 0 "[ . 1 . 2]"
1 34 LYS 0.058 0.008 3 0 "[ . 1 . 2]"
1 35 VAL 0.023 0.006 16 0 "[ . 1 . 2]"
1 36 THR 0.003 0.003 16 0 "[ . 1 . 2]"
1 37 SER 0.030 0.015 19 0 "[ . 1 . 2]"
1 38 CYS 0.129 0.018 15 0 "[ . 1 . 2]"
1 39 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 ASP 0.008 0.005 19 0 "[ . 1 . 2]"
1 41 ASN 0.090 0.024 11 0 "[ . 1 . 2]"
1 42 ILE 0.155 0.013 9 0 "[ . 1 . 2]"
1 43 LEU 0.398 0.018 12 0 "[ . 1 . 2]"
1 44 ILE 0.047 0.008 5 0 "[ . 1 . 2]"
1 45 LEU 0.032 0.007 15 0 "[ . 1 . 2]"
1 46 VAL 0.035 0.007 1 0 "[ . 1 . 2]"
1 47 ASP 0.028 0.021 15 0 "[ . 1 . 2]"
1 61 PRO 0.030 0.011 7 0 "[ . 1 . 2]"
1 62 GLN 0.474 0.020 1 0 "[ . 1 . 2]"
1 63 LEU 0.126 0.014 2 0 "[ . 1 . 2]"
1 64 GLU 0.024 0.008 11 0 "[ . 1 . 2]"
1 65 LYS 0.092 0.021 11 0 "[ . 1 . 2]"
1 66 LEU 0.090 0.011 11 0 "[ . 1 . 2]"
1 67 ALA 0.057 0.010 10 0 "[ . 1 . 2]"
1 68 GLN 0.053 0.010 20 0 "[ . 1 . 2]"
1 69 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 TYR 0.164 0.015 15 0 "[ . 1 . 2]"
1 71 THR 0.009 0.006 7 0 "[ . 1 . 2]"
1 72 GLU 0.006 0.006 7 0 "[ . 1 . 2]"
1 73 ASN 0.261 0.013 9 0 "[ . 1 . 2]"
1 74 VAL 0.228 0.018 2 0 "[ . 1 . 2]"
1 75 LYS 0.082 0.029 11 0 "[ . 1 . 2]"
1 76 ILE 0.143 0.029 11 0 "[ . 1 . 2]"
1 77 TYR 0.134 0.008 5 0 "[ . 1 . 2]"
1 82 GLU 0.025 0.017 1 0 "[ . 1 . 2]"
1 83 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 ASN 0.051 0.017 1 0 "[ . 1 . 2]"
1 85 GLN 0.170 0.030 16 0 "[ . 1 . 2]"
1 86 ASP 0.136 0.030 16 0 "[ . 1 . 2]"
1 87 VAL 0.016 0.004 13 0 "[ . 1 . 2]"
1 88 ALA 0.063 0.009 17 0 "[ . 1 . 2]"
1 89 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 TYR 0.097 0.009 6 0 "[ . 1 . 2]"
1 92 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 VAL 0.085 0.011 13 0 "[ . 1 . 2]"
1 98 THR 0.041 0.007 18 0 "[ . 1 . 2]"
1 99 ILE 0.062 0.021 15 0 "[ . 1 . 2]"
1 100 LEU 0.061 0.009 14 0 "[ . 1 . 2]"
1 101 MET 0.187 0.009 14 0 "[ . 1 . 2]"
1 102 PHE 0.170 0.018 15 0 "[ . 1 . 2]"
1 103 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 ASN 0.026 0.010 4 0 "[ . 1 . 2]"
1 105 GLY 0.000 0.000 11 0 "[ . 1 . 2]"
1 106 LYS 0.002 0.002 15 0 "[ . 1 . 2]"
1 107 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 LEU 0.277 0.018 8 0 "[ . 1 . 2]"
1 109 SER 0.036 0.008 5 0 "[ . 1 . 2]"
1 110 GLN 0.018 0.009 14 0 "[ . 1 . 2]"
1 111 VAL 0.340 0.020 1 0 "[ . 1 . 2]"
1 112 ILE 0.047 0.011 13 0 "[ . 1 . 2]"
1 113 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 114 ALA 0.013 0.007 5 0 "[ . 1 . 2]"
1 115 ASP 0.079 0.016 15 0 "[ . 1 . 2]"
1 116 ILE 0.126 0.011 3 0 "[ . 1 . 2]"
1 117 SER 0.002 0.002 14 0 "[ . 1 . 2]"
1 118 LYS 0.069 0.012 8 0 "[ . 1 . 2]"
1 119 ILE 0.035 0.008 1 0 "[ . 1 . 2]"
1 120 ILE 0.088 0.008 4 0 "[ . 1 . 2]"
1 121 SER 0.020 0.008 8 0 "[ . 1 . 2]"
1 122 GLU 0.171 0.011 9 0 "[ . 1 . 2]"
1 123 ILE 0.253 0.019 19 0 "[ . 1 . 2]"
1 124 ASN 0.040 0.008 4 0 "[ . 1 . 2]"
1 125 ASN 0.059 0.008 3 0 "[ . 1 . 2]"
1 126 ASN 0.111 0.018 12 0 "[ . 1 . 2]"
1 127 ILE 0.230 0.018 2 0 "[ . 1 . 2]"
1 128 ASN 0.215 0.019 19 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 19 PRO HG2 1 20 GLY HA2 5.500 . 6.050 5.381 4.548 6.059 0.009 1 0 "[ . 1 . 2]" 1
2 1 19 PRO HG2 1 20 GLY HA3 5.500 . 6.050 5.367 4.559 6.065 0.015 5 0 "[ . 1 . 2]" 1
3 1 27 GLY HA2 1 30 GLU H 4.800 . 5.280 4.929 4.603 5.186 . 0 0 "[ . 1 . 2]" 1
4 1 26 ILE HB 1 27 GLY HA2 4.830 . 5.310 4.592 4.396 4.824 . 0 0 "[ . 1 . 2]" 1
5 1 26 ILE HG13 1 27 GLY HA2 4.940 . 5.430 4.208 3.838 4.574 . 0 0 "[ . 1 . 2]" 1
6 1 26 ILE MG 1 27 GLY HA2 5.500 . 6.050 5.541 5.459 5.631 . 0 0 "[ . 1 . 2]" 1
7 1 23 ILE H 1 23 ILE MD 4.280 . 4.710 3.671 3.130 4.291 . 0 0 "[ . 1 . 2]" 1
8 1 23 ILE MD 1 64 GLU H 4.440 . 4.880 4.217 3.441 4.825 . 0 0 "[ . 1 . 2]" 1
9 1 23 ILE HA 1 23 ILE MD 3.960 . 4.360 3.065 2.186 3.881 . 0 0 "[ . 1 . 2]" 1
10 1 23 ILE MD 1 64 GLU HA 3.510 . 3.860 3.205 2.228 3.867 0.007 1 0 "[ . 1 . 2]" 1
11 1 23 ILE MD 1 64 GLU HG2 3.970 . 4.370 2.280 1.815 3.929 . 0 0 "[ . 1 . 2]" 1
12 1 23 ILE MD 1 64 GLU HG3 3.970 . 4.370 2.991 2.397 3.870 . 0 0 "[ . 1 . 2]" 1
13 1 23 ILE MD 1 76 ILE MG 2.780 . 3.060 2.579 2.047 3.059 . 0 0 "[ . 1 . 2]" 1
14 1 23 ILE HA 1 23 ILE MG 3.430 . 3.770 2.336 2.255 2.413 . 0 0 "[ . 1 . 2]" 1
15 1 23 ILE MG 1 77 TYR HA 3.970 . 4.370 3.947 3.363 4.374 0.004 11 0 "[ . 1 . 2]" 1
16 1 23 ILE MG 1 76 ILE H 4.560 . 5.020 4.789 4.215 5.020 0.000 14 0 "[ . 1 . 2]" 1
17 1 23 ILE H 1 23 ILE MG 4.370 . 4.810 3.877 3.811 3.917 . 0 0 "[ . 1 . 2]" 1
18 1 23 ILE HB 1 23 ILE MD 3.280 . 3.610 2.856 2.446 3.254 . 0 0 "[ . 1 . 2]" 1
19 1 116 ILE HA 1 116 ILE MD 2.890 . 3.180 2.123 2.073 2.180 . 0 0 "[ . 1 . 2]" 1
20 1 24 GLU HG2 1 26 ILE MG 4.750 . 5.220 3.431 2.078 4.855 . 0 0 "[ . 1 . 2]" 1
21 1 24 GLU HG3 1 26 ILE MG 4.750 . 5.220 3.280 1.944 4.595 . 0 0 "[ . 1 . 2]" 1
22 1 24 GLU HA 1 24 GLU HG2 3.850 . 4.230 3.620 3.104 3.844 . 0 0 "[ . 1 . 2]" 1
23 1 24 GLU HA 1 24 GLU HG3 3.850 . 4.230 2.941 2.389 3.193 . 0 0 "[ . 1 . 2]" 1
24 1 24 GLU HG3 1 77 TYR HE1 5.300 . 5.830 4.023 3.296 5.314 . 0 0 "[ . 1 . 2]" 1
25 1 24 GLU HG2 1 77 TYR HE1 5.300 . 5.830 3.218 2.077 5.185 . 0 0 "[ . 1 . 2]" 1
26 1 24 GLU H 1 24 GLU HG3 5.150 . 5.670 4.528 4.338 4.763 . 0 0 "[ . 1 . 2]" 1
27 1 24 GLU H 1 24 GLU HG2 5.150 . 5.670 4.730 4.371 4.974 . 0 0 "[ . 1 . 2]" 1
28 1 24 GLU HB2 1 25 GLN H 4.480 . 4.930 4.093 3.927 4.424 . 0 0 "[ . 1 . 2]" 1
29 1 23 ILE HA 1 24 GLU HB3 5.300 . 5.830 4.707 4.407 5.266 . 0 0 "[ . 1 . 2]" 1
30 1 23 ILE HA 1 24 GLU HB2 5.500 . 6.050 4.600 4.106 4.927 . 0 0 "[ . 1 . 2]" 1
31 1 25 GLN HA 1 26 ILE MG 4.560 . 5.020 3.605 3.426 3.912 . 0 0 "[ . 1 . 2]" 1
32 1 25 GLN H 1 25 GLN HG3 4.170 . 4.590 2.980 1.815 4.572 . 0 0 "[ . 1 . 2]" 1
33 1 26 ILE H 1 26 ILE MD 4.340 . 4.770 3.917 3.751 4.027 . 0 0 "[ . 1 . 2]" 1
34 1 26 ILE MD 1 34 LYS H 4.610 . 5.070 4.561 4.081 5.072 0.002 15 0 "[ . 1 . 2]" 1
35 1 26 ILE MD 1 31 PHE HD1 3.460 . 3.810 2.100 1.803 2.417 . 0 0 "[ . 1 . 2]" 1
36 1 26 ILE MD 1 46 VAL HA 5.040 . 5.540 4.911 4.393 5.542 0.002 5 0 "[ . 1 . 2]" 1
37 1 26 ILE MD 1 31 PHE HA 3.590 . 3.950 1.863 1.794 1.989 0.006 1 0 "[ . 1 . 2]" 1
38 1 26 ILE MD 1 77 TYR HB2 4.320 . 4.750 3.067 2.622 3.509 . 0 0 "[ . 1 . 2]" 1
39 1 26 ILE MD 1 77 TYR HB3 4.320 . 4.750 2.363 2.058 2.649 . 0 0 "[ . 1 . 2]" 1
40 1 26 ILE HB 1 26 ILE MD 3.460 . 3.810 2.442 2.406 2.470 . 0 0 "[ . 1 . 2]" 1
41 1 26 ILE MD 1 26 ILE MG 2.930 . 3.220 1.951 1.904 1.990 . 0 0 "[ . 1 . 2]" 1
42 1 24 GLU H 1 26 ILE MG 4.910 . 5.400 5.053 4.795 5.408 0.008 7 0 "[ . 1 . 2]" 1
43 1 26 ILE MG 1 34 LYS H 5.500 . 6.050 5.606 5.346 5.852 . 0 0 "[ . 1 . 2]" 1
44 1 26 ILE MG 1 77 TYR HD1 3.910 . 4.300 2.309 1.798 3.093 0.002 3 0 "[ . 1 . 2]" 1
45 1 26 ILE MG 1 77 TYR HE1 4.390 . 4.830 3.185 2.578 4.033 . 0 0 "[ . 1 . 2]" 1
46 1 26 ILE MG 1 27 GLY HA3 5.500 . 6.050 5.553 5.419 5.722 . 0 0 "[ . 1 . 2]" 1
47 1 24 GLU HB3 1 26 ILE MG 3.780 . 4.160 3.521 2.938 3.917 . 0 0 "[ . 1 . 2]" 1
48 1 26 ILE MG 1 30 GLU HG2 5.460 . 6.010 4.265 3.587 5.420 . 0 0 "[ . 1 . 2]" 1
49 1 26 ILE HG12 1 77 TYR HB2 4.620 . 5.080 4.017 3.506 4.423 . 0 0 "[ . 1 . 2]" 1
50 1 26 ILE HG12 1 77 TYR HB3 4.620 . 5.080 2.455 2.144 2.794 . 0 0 "[ . 1 . 2]" 1
51 1 26 ILE HB 1 27 GLY HA3 5.070 . 5.580 4.500 4.273 4.782 . 0 0 "[ . 1 . 2]" 1
52 1 30 GLU H 1 30 GLU HG2 3.810 . 4.190 2.280 2.079 2.483 . 0 0 "[ . 1 . 2]" 1
53 1 27 GLY HA3 1 30 GLU HG3 4.110 . 4.520 4.223 3.190 4.529 0.009 4 0 "[ . 1 . 2]" 1
54 1 27 GLY HA3 1 30 GLU HG2 4.110 . 4.520 3.300 2.477 3.744 . 0 0 "[ . 1 . 2]" 1
55 1 26 ILE HB 1 30 GLU HG2 4.550 . 5.010 3.002 2.205 4.320 . 0 0 "[ . 1 . 2]" 1
56 1 26 ILE HB 1 30 GLU HG3 4.550 . 5.010 2.776 1.990 3.871 . 0 0 "[ . 1 . 2]" 1
57 1 30 GLU HG3 1 34 LYS HD2 5.140 . 5.650 3.302 2.645 4.096 . 0 0 "[ . 1 . 2]" 1
58 1 30 GLU HG2 1 34 LYS HD2 5.140 . 5.650 4.199 3.337 4.645 . 0 0 "[ . 1 . 2]" 1
59 1 30 GLU HG2 1 34 LYS HD3 5.500 . 6.050 4.295 3.372 4.966 . 0 0 "[ . 1 . 2]" 1
60 1 30 GLU HG3 1 34 LYS HD3 5.500 . 6.050 3.476 2.867 4.305 . 0 0 "[ . 1 . 2]" 1
61 1 26 ILE MG 1 30 GLU HG3 5.460 . 6.010 3.607 2.805 4.540 . 0 0 "[ . 1 . 2]" 1
62 1 26 ILE MD 1 30 GLU HG2 5.500 . 6.050 4.189 3.499 5.374 . 0 0 "[ . 1 . 2]" 1
63 1 26 ILE MD 1 30 GLU HG3 5.500 . 6.050 4.079 2.928 5.367 . 0 0 "[ . 1 . 2]" 1
64 1 30 GLU HB3 1 34 LYS HD2 4.380 . 4.820 3.940 3.536 4.337 . 0 0 "[ . 1 . 2]" 1
65 1 30 GLU HB2 1 34 LYS HD2 4.380 . 4.820 2.327 2.038 2.706 . 0 0 "[ . 1 . 2]" 1
66 1 30 GLU HB2 1 34 LYS HB3 4.970 . 5.470 3.725 3.211 4.093 . 0 0 "[ . 1 . 2]" 1
67 1 30 GLU HB3 1 34 LYS HB3 4.970 . 5.470 5.211 4.860 5.447 . 0 0 "[ . 1 . 2]" 1
68 1 31 PHE HA 1 31 PHE HD1 4.250 . 4.680 2.652 2.439 2.997 . 0 0 "[ . 1 . 2]" 1
69 1 31 PHE HA 1 34 LYS H 4.530 . 4.980 4.121 4.004 4.191 . 0 0 "[ . 1 . 2]" 1
70 1 26 ILE HG12 1 31 PHE HA 4.820 . 5.300 4.637 4.300 4.950 . 0 0 "[ . 1 . 2]" 1
71 1 26 ILE MG 1 31 PHE HA 4.920 . 5.410 4.269 3.939 4.543 . 0 0 "[ . 1 . 2]" 1
72 1 33 ASN HA 1 33 ASN HD21 4.300 . 4.730 3.293 1.831 4.460 . 0 0 "[ . 1 . 2]" 1
73 1 33 ASN HB3 1 34 LYS H 3.710 . 4.080 2.665 2.327 3.267 . 0 0 "[ . 1 . 2]" 1
74 1 32 ASP H 1 33 ASN HB3 5.500 . 6.050 5.041 4.713 5.767 . 0 0 "[ . 1 . 2]" 1
75 1 33 ASN HB2 1 34 LYS H 3.800 . 4.180 3.748 3.092 3.967 . 0 0 "[ . 1 . 2]" 1
76 1 30 GLU HA 1 33 ASN HB3 4.250 . 4.680 2.137 1.801 2.834 . 0 0 "[ . 1 . 2]" 1
77 1 33 ASN HB3 1 34 LYS HB3 4.510 . 4.960 3.698 3.491 3.847 . 0 0 "[ . 1 . 2]" 1
78 1 33 ASN HB3 1 34 LYS HD2 4.270 . 4.700 4.220 3.846 4.707 0.007 13 0 "[ . 1 . 2]" 1
79 1 33 ASN HB2 1 34 LYS HD2 5.450 . 6.000 5.758 4.897 6.008 0.008 3 0 "[ . 1 . 2]" 1
80 1 33 ASN HB2 1 34 LYS HB3 5.410 . 5.950 5.313 4.579 5.499 . 0 0 "[ . 1 . 2]" 1
81 1 34 LYS HA 1 34 LYS HG2 4.220 . 4.640 3.683 3.645 3.722 . 0 0 "[ . 1 . 2]" 1
82 1 34 LYS HA 1 34 LYS HG3 4.220 . 4.640 3.882 3.831 3.941 . 0 0 "[ . 1 . 2]" 1
83 1 34 LYS HG3 1 35 VAL HA 4.620 . 5.080 3.813 3.572 4.116 . 0 0 "[ . 1 . 2]" 1
84 1 34 LYS HG2 1 35 VAL HA 4.620 . 5.080 4.525 4.316 4.673 . 0 0 "[ . 1 . 2]" 1
85 1 34 LYS H 1 34 LYS HD3 4.730 . 5.200 4.382 4.242 4.542 . 0 0 "[ . 1 . 2]" 1
86 1 34 LYS H 1 34 LYS HD2 4.480 . 4.930 3.807 3.588 4.027 . 0 0 "[ . 1 . 2]" 1
87 1 34 LYS HA 1 34 LYS HD2 4.870 . 5.360 4.706 4.633 4.794 . 0 0 "[ . 1 . 2]" 1
88 1 34 LYS H 1 35 VAL HA 4.670 . 5.140 4.773 4.718 4.851 . 0 0 "[ . 1 . 2]" 1
89 1 34 LYS H 1 35 VAL HB 4.320 . 4.750 4.304 4.201 4.440 . 0 0 "[ . 1 . 2]" 1
90 1 35 VAL HB 1 36 THR MG 4.650 . 5.120 3.094 2.940 3.933 . 0 0 "[ . 1 . 2]" 1
91 1 34 LYS H 1 35 VAL MG1 5.380 . 5.920 5.463 5.395 5.553 . 0 0 "[ . 1 . 2]" 1
92 1 34 LYS H 1 35 VAL MG2 5.380 . 5.920 3.638 3.589 3.712 . 0 0 "[ . 1 . 2]" 1
93 1 35 VAL HA 1 35 VAL MG2 3.580 . 3.940 2.341 2.317 2.372 . 0 0 "[ . 1 . 2]" 1
94 1 35 VAL HA 1 35 VAL MG1 3.580 . 3.940 2.468 2.423 2.505 . 0 0 "[ . 1 . 2]" 1
95 1 35 VAL MG2 1 44 ILE MD 3.400 . 3.740 2.832 2.429 3.210 . 0 0 "[ . 1 . 2]" 1
96 1 35 VAL MG1 1 44 ILE MD 3.400 . 3.740 2.916 2.265 3.358 . 0 0 "[ . 1 . 2]" 1
97 1 35 VAL MG2 1 36 THR MG 4.720 . 5.190 4.374 4.218 5.026 . 0 0 "[ . 1 . 2]" 1
98 1 35 VAL MG1 1 36 THR MG 4.720 . 5.190 2.824 2.457 4.041 . 0 0 "[ . 1 . 2]" 1
99 1 42 ILE HA 1 73 ASN HD21 5.110 . 5.620 3.117 2.284 4.317 . 0 0 "[ . 1 . 2]" 1
100 1 42 ILE HA 1 42 ILE HG12 4.230 . 4.650 2.859 2.440 3.045 . 0 0 "[ . 1 . 2]" 1
101 1 42 ILE HA 1 42 ILE HG13 4.230 . 4.650 2.487 2.376 2.754 . 0 0 "[ . 1 . 2]" 1
102 1 42 ILE H 1 42 ILE HB 4.070 . 4.480 2.545 2.263 2.689 . 0 0 "[ . 1 . 2]" 1
103 1 42 ILE HG13 1 73 ASN HB2 5.500 . 6.050 5.173 4.593 6.059 0.009 20 0 "[ . 1 . 2]" 1
104 1 42 ILE HG12 1 73 ASN HB2 5.500 . 6.050 5.836 4.524 6.063 0.013 9 0 "[ . 1 . 2]" 1
105 1 118 LYS HA 1 119 ILE MG 4.980 . 5.480 4.875 4.815 4.914 . 0 0 "[ . 1 . 2]" 1
106 1 119 ILE MG 1 120 ILE H 3.830 . 4.210 3.876 3.673 3.964 . 0 0 "[ . 1 . 2]" 1
107 1 42 ILE MD 1 73 ASN HD21 5.090 . 5.600 4.239 3.585 4.887 . 0 0 "[ . 1 . 2]" 1
108 1 42 ILE MD 1 73 ASN HA 3.690 . 4.060 3.115 2.638 3.497 . 0 0 "[ . 1 . 2]" 1
109 1 42 ILE HA 1 42 ILE MD 3.520 . 3.870 3.798 3.752 3.826 . 0 0 "[ . 1 . 2]" 1
110 1 42 ILE MD 1 73 ASN HB3 5.500 . 6.050 5.221 4.881 5.874 . 0 0 "[ . 1 . 2]" 1
111 1 43 LEU MD1 1 108 LEU HG 4.150 . 4.570 2.927 2.419 4.577 0.007 6 0 "[ . 1 . 2]" 1
112 1 43 LEU MD2 1 108 LEU HG 4.150 . 4.570 4.232 2.692 4.584 0.014 10 0 "[ . 1 . 2]" 1
113 1 44 ILE HB 1 102 PHE HB2 4.370 . 4.810 2.682 2.241 3.112 . 0 0 "[ . 1 . 2]" 1
114 1 44 ILE HB 1 102 PHE HB3 4.820 . 5.300 3.856 3.246 4.439 . 0 0 "[ . 1 . 2]" 1
115 1 44 ILE HA 1 44 ILE MG 3.490 . 3.840 2.479 2.421 2.539 . 0 0 "[ . 1 . 2]" 1
116 1 44 ILE MG 1 77 TYR HE2 3.470 . 3.820 2.547 2.066 3.383 . 0 0 "[ . 1 . 2]" 1
117 1 44 ILE MG 1 77 TYR HD2 3.450 . 3.790 1.899 1.792 2.163 0.008 5 0 "[ . 1 . 2]" 1
118 1 44 ILE MD 1 44 ILE MG 3.020 . 3.320 1.920 1.886 1.951 . 0 0 "[ . 1 . 2]" 1
119 1 44 ILE MG 1 46 VAL HB 4.840 . 5.320 4.469 3.985 4.844 . 0 0 "[ . 1 . 2]" 1
120 1 44 ILE MG 1 102 PHE HB2 4.310 . 4.740 3.281 2.818 3.821 . 0 0 "[ . 1 . 2]" 1
121 1 44 ILE MD 1 102 PHE HB2 4.270 . 4.700 3.881 3.538 4.295 . 0 0 "[ . 1 . 2]" 1
122 1 35 VAL HA 1 44 ILE MD 3.570 . 3.930 2.074 1.865 2.471 . 0 0 "[ . 1 . 2]" 1
123 1 44 ILE HA 1 44 ILE MD 4.330 . 4.760 3.787 3.738 3.828 . 0 0 "[ . 1 . 2]" 1
124 1 44 ILE MD 1 77 TYR HE2 4.200 . 4.620 2.436 1.800 3.299 0.000 18 0 "[ . 1 . 2]" 1
125 1 44 ILE MD 1 77 TYR HD2 4.910 . 5.400 3.461 2.666 4.314 . 0 0 "[ . 1 . 2]" 1
126 1 45 LEU HB2 1 76 ILE MG 4.490 . 4.940 3.031 2.355 3.770 . 0 0 "[ . 1 . 2]" 1
127 1 45 LEU HB3 1 76 ILE MG 4.490 . 4.940 3.654 2.903 4.177 . 0 0 "[ . 1 . 2]" 1
128 1 45 LEU HA 1 99 ILE MG 4.290 . 4.720 3.104 2.743 3.392 . 0 0 "[ . 1 . 2]" 1
129 1 45 LEU HG 1 101 MET ME 4.470 . 4.920 3.879 2.853 4.925 0.005 12 0 "[ . 1 . 2]" 1
130 1 45 LEU HG 1 101 MET HG2 4.520 . 4.970 2.860 1.796 4.686 0.004 10 0 "[ . 1 . 2]" 1
131 1 45 LEU H 1 45 LEU HG 4.940 . 5.430 3.387 2.449 4.163 . 0 0 "[ . 1 . 2]" 1
132 1 46 VAL HA 1 47 ASP HA 4.610 . 5.070 4.402 4.377 4.452 . 0 0 "[ . 1 . 2]" 1
133 1 46 VAL HA 1 77 TYR HB3 4.860 . 5.350 4.207 3.893 4.579 . 0 0 "[ . 1 . 2]" 1
134 1 31 PHE HD1 1 46 VAL MG1 3.490 . 3.840 3.420 2.439 3.837 . 0 0 "[ . 1 . 2]" 1
135 1 46 VAL MG2 1 102 PHE HD1 3.720 . 4.090 2.625 2.054 3.516 . 0 0 "[ . 1 . 2]" 1
136 1 45 LEU HA 1 46 VAL MG2 4.810 . 5.290 3.772 3.654 3.876 . 0 0 "[ . 1 . 2]" 1
137 1 46 VAL MG1 1 77 TYR HB2 4.760 . 5.240 2.419 1.793 4.005 0.007 1 0 "[ . 1 . 2]" 1
138 1 46 VAL MG1 1 77 TYR HB3 4.760 . 5.240 3.342 2.770 4.382 . 0 0 "[ . 1 . 2]" 1
139 1 26 ILE MD 1 46 VAL MG1 4.330 . 4.760 3.053 2.354 3.537 . 0 0 "[ . 1 . 2]" 1
140 1 35 VAL MG1 1 46 VAL MG2 4.010 . 4.410 2.767 2.017 3.391 . 0 0 "[ . 1 . 2]" 1
141 1 35 VAL MG1 1 46 VAL MG1 4.430 . 4.870 2.871 1.971 4.224 . 0 0 "[ . 1 . 2]" 1
142 1 35 VAL MG2 1 46 VAL MG2 4.010 . 4.410 3.246 1.865 4.258 . 0 0 "[ . 1 . 2]" 1
143 1 35 VAL MG2 1 46 VAL MG1 4.430 . 4.870 2.647 1.938 3.673 . 0 0 "[ . 1 . 2]" 1
144 1 47 ASP HA 1 99 ILE HG13 4.500 . 4.950 2.879 2.013 4.162 . 0 0 "[ . 1 . 2]" 1
145 1 47 ASP HA 1 99 ILE MD 4.700 . 5.170 3.928 3.449 4.741 . 0 0 "[ . 1 . 2]" 1
146 1 61 PRO HB2 1 65 LYS H 4.830 . 5.310 4.946 4.572 5.313 0.003 1 0 "[ . 1 . 2]" 1
147 1 61 PRO HD2 1 65 LYS H 4.940 . 5.430 4.365 3.745 4.882 . 0 0 "[ . 1 . 2]" 1
148 1 62 GLN HA 1 65 LYS H 3.510 . 3.860 3.657 3.375 3.822 . 0 0 "[ . 1 . 2]" 1
149 1 62 GLN HA 1 65 LYS HB2 3.920 . 4.310 2.890 2.373 3.548 . 0 0 "[ . 1 . 2]" 1
150 1 62 GLN HA 1 65 LYS HB3 3.920 . 4.310 3.194 2.539 4.313 0.003 1 0 "[ . 1 . 2]" 1
151 1 62 GLN HA 1 65 LYS HG2 4.490 . 4.940 4.200 3.490 4.952 0.012 7 0 "[ . 1 . 2]" 1
152 1 62 GLN HA 1 65 LYS HG3 4.490 . 4.940 4.166 3.198 4.949 0.009 13 0 "[ . 1 . 2]" 1
153 1 62 GLN HG2 1 63 LEU H 5.030 . 5.530 4.811 4.632 5.046 . 0 0 "[ . 1 . 2]" 1
154 1 62 GLN HA 1 62 GLN HG3 3.770 . 4.150 2.656 2.584 2.736 . 0 0 "[ . 1 . 2]" 1
155 1 62 GLN HA 1 62 GLN HG2 3.800 . 4.180 3.720 3.611 3.760 . 0 0 "[ . 1 . 2]" 1
156 1 61 PRO HA 1 62 GLN HG3 4.260 . 4.690 4.327 3.928 4.615 . 0 0 "[ . 1 . 2]" 1
157 1 62 GLN HG2 1 111 VAL MG1 3.740 . 4.110 3.853 3.413 4.104 . 0 0 "[ . 1 . 2]" 1
158 1 62 GLN HG3 1 111 VAL MG1 4.770 . 5.250 5.114 4.835 5.265 0.015 15 0 "[ . 1 . 2]" 1
159 1 62 GLN HG3 1 116 ILE MG 5.030 . 5.530 4.519 4.190 5.055 . 0 0 "[ . 1 . 2]" 1
160 1 62 GLN HG3 1 119 ILE HG12 4.720 . 5.190 3.400 3.037 3.804 . 0 0 "[ . 1 . 2]" 1
161 1 62 GLN HG2 1 119 ILE HG12 4.340 . 4.770 2.262 1.940 2.536 . 0 0 "[ . 1 . 2]" 1
162 1 62 GLN HB2 1 111 VAL MG1 3.750 . 4.130 3.775 3.450 4.046 . 0 0 "[ . 1 . 2]" 1
163 1 62 GLN HB3 1 116 ILE HG13 5.500 . 6.050 5.150 4.779 5.508 . 0 0 "[ . 1 . 2]" 1
164 1 62 GLN HB3 1 116 ILE HG12 5.500 . 6.050 5.423 5.040 5.748 . 0 0 "[ . 1 . 2]" 1
165 1 62 GLN HB2 1 114 ALA HA 5.230 . 5.750 5.423 4.783 5.750 0.000 5 0 "[ . 1 . 2]" 1
166 1 63 LEU HA 1 67 ALA MB 4.330 . 4.760 4.062 3.645 4.385 . 0 0 "[ . 1 . 2]" 1
167 1 63 LEU HA 1 119 ILE MD 3.750 . 4.130 3.822 3.232 4.138 0.008 1 0 "[ . 1 . 2]" 1
168 1 63 LEU HB3 1 76 ILE MG 3.960 . 4.360 3.514 2.912 4.229 . 0 0 "[ . 1 . 2]" 1
169 1 63 LEU HB2 1 76 ILE MG 3.960 . 4.360 3.755 2.697 4.360 . 0 0 "[ . 1 . 2]" 1
170 1 23 ILE MD 1 63 LEU HB2 4.440 . 4.880 3.957 2.689 4.796 . 0 0 "[ . 1 . 2]" 1
171 1 23 ILE MD 1 63 LEU HB3 4.440 . 4.880 4.170 3.034 4.883 0.003 7 0 "[ . 1 . 2]" 1
172 1 64 GLU HA 1 64 GLU HG2 3.660 . 4.030 2.478 2.357 2.984 . 0 0 "[ . 1 . 2]" 1
173 1 64 GLU HA 1 64 GLU HG3 3.660 . 4.030 3.157 2.599 3.642 . 0 0 "[ . 1 . 2]" 1
174 1 64 GLU HA 1 67 ALA MB 3.250 . 3.580 2.202 1.824 2.930 . 0 0 "[ . 1 . 2]" 1
175 1 64 GLU HG3 1 67 ALA MB 4.930 . 5.420 4.712 3.567 5.355 . 0 0 "[ . 1 . 2]" 1
176 1 64 GLU HG2 1 67 ALA MB 4.930 . 5.420 3.886 3.410 4.575 . 0 0 "[ . 1 . 2]" 1
177 1 65 LYS HA 1 68 GLN HB2 3.870 . 4.260 3.984 3.614 4.263 0.003 3 0 "[ . 1 . 2]" 1
178 1 65 LYS HA 1 65 LYS HD3 4.550 . 5.010 2.653 1.829 3.849 . 0 0 "[ . 1 . 2]" 1
179 1 65 LYS H 1 65 LYS HD3 5.110 . 5.620 4.522 3.866 5.641 0.021 11 0 "[ . 1 . 2]" 1
180 1 65 LYS HA 1 65 LYS HD2 4.550 . 5.010 2.855 1.881 4.235 . 0 0 "[ . 1 . 2]" 1
181 1 63 LEU HA 1 66 LEU HG 5.500 . 6.050 4.753 4.361 5.141 . 0 0 "[ . 1 . 2]" 1
182 1 67 ALA HA 1 74 VAL MG2 3.310 . 3.640 2.160 1.935 2.457 . 0 0 "[ . 1 . 2]" 1
183 1 67 ALA HA 1 70 TYR H 4.070 . 4.480 3.246 2.876 3.627 . 0 0 "[ . 1 . 2]" 1
184 1 67 ALA MB 1 70 TYR H 4.840 . 5.320 4.589 4.284 4.907 . 0 0 "[ . 1 . 2]" 1
185 1 67 ALA MB 1 76 ILE H 4.550 . 5.010 4.621 4.098 5.015 0.005 10 0 "[ . 1 . 2]" 1
186 1 67 ALA MB 1 68 GLN HA 3.990 . 4.390 3.865 3.763 3.989 . 0 0 "[ . 1 . 2]" 1
187 1 67 ALA MB 1 74 VAL HB 4.010 . 4.410 4.365 4.076 4.420 0.010 10 0 "[ . 1 . 2]" 1
188 1 67 ALA MB 1 68 GLN HG3 4.480 . 4.930 3.641 3.398 3.921 . 0 0 "[ . 1 . 2]" 1
189 1 67 ALA MB 1 74 VAL MG2 3.130 . 3.440 2.621 2.371 2.785 . 0 0 "[ . 1 . 2]" 1
190 1 67 ALA MB 1 71 THR HA 4.270 . 4.700 3.449 3.002 3.709 . 0 0 "[ . 1 . 2]" 1
191 1 68 GLN HA 1 68 GLN HG2 3.380 . 3.720 2.584 2.505 2.683 . 0 0 "[ . 1 . 2]" 1
192 1 68 GLN HA 1 68 GLN HG3 3.430 . 3.770 2.941 2.703 3.177 . 0 0 "[ . 1 . 2]" 1
193 1 68 GLN HB2 1 68 GLN HG3 3.000 . 3.300 2.491 2.430 2.583 . 0 0 "[ . 1 . 2]" 1
194 1 68 GLN HB3 1 68 GLN HG2 2.800 . 3.080 2.409 2.338 2.469 . 0 0 "[ . 1 . 2]" 1
195 1 69 GLN HA 1 69 GLN HG2 3.800 . 4.180 3.062 2.577 3.336 . 0 0 "[ . 1 . 2]" 1
196 1 69 GLN HG3 1 70 TYR H 4.720 . 5.190 4.611 3.799 4.939 . 0 0 "[ . 1 . 2]" 1
197 1 69 GLN HG2 1 70 TYR H 4.720 . 5.190 4.229 3.889 5.001 . 0 0 "[ . 1 . 2]" 1
198 1 69 GLN HA 1 69 GLN HG3 3.800 . 4.180 3.717 3.148 3.864 . 0 0 "[ . 1 . 2]" 1
199 1 69 GLN HB3 1 70 TYR H 3.730 . 4.100 3.572 3.302 3.895 . 0 0 "[ . 1 . 2]" 1
200 1 70 TYR HB3 1 127 ILE MD 4.270 . 4.700 2.174 1.972 2.384 . 0 0 "[ . 1 . 2]" 1
201 1 70 TYR HB2 1 127 ILE MD 4.270 . 4.700 2.986 2.690 3.183 . 0 0 "[ . 1 . 2]" 1
202 1 70 TYR HA 1 70 TYR HD2 4.880 . 5.370 2.225 2.107 2.405 . 0 0 "[ . 1 . 2]" 1
203 1 71 THR HA 1 71 THR MG 3.180 . 3.500 3.223 3.218 3.231 . 0 0 "[ . 1 . 2]" 1
204 1 71 THR MG 1 72 GLU HA 4.280 . 4.710 3.285 3.124 3.465 . 0 0 "[ . 1 . 2]" 1
205 1 72 GLU H 1 72 GLU HB2 3.980 . 4.380 2.942 2.436 3.613 . 0 0 "[ . 1 . 2]" 1
206 1 72 GLU HB3 1 73 ASN H 4.360 . 4.800 4.159 4.067 4.291 . 0 0 "[ . 1 . 2]" 1
207 1 72 GLU HB3 1 73 ASN HB2 5.500 . 6.050 4.996 4.522 5.599 . 0 0 "[ . 1 . 2]" 1
208 1 72 GLU HB2 1 73 ASN HB2 5.500 . 6.050 4.087 3.514 4.869 . 0 0 "[ . 1 . 2]" 1
209 1 72 GLU HA 1 72 GLU HG3 3.850 . 4.230 3.442 3.018 3.842 . 0 0 "[ . 1 . 2]" 1
210 1 72 GLU HA 1 72 GLU HG2 3.850 . 4.230 3.100 2.501 3.857 . 0 0 "[ . 1 . 2]" 1
211 1 73 ASN HB3 1 74 VAL H 4.160 . 4.580 3.576 3.173 3.851 . 0 0 "[ . 1 . 2]" 1
212 1 73 ASN HB2 1 74 VAL H 4.250 . 4.680 4.178 3.928 4.361 . 0 0 "[ . 1 . 2]" 1
213 1 73 ASN HB3 1 74 VAL MG1 4.050 . 4.460 2.804 2.592 3.034 . 0 0 "[ . 1 . 2]" 1
214 1 73 ASN HB2 1 74 VAL MG1 4.140 . 4.550 4.276 4.164 4.437 . 0 0 "[ . 1 . 2]" 1
215 1 74 VAL HA 1 75 LYS H 3.300 . 3.630 2.200 2.127 2.293 . 0 0 "[ . 1 . 2]" 1
216 1 74 VAL HA 1 74 VAL MG1 3.190 . 3.510 2.391 2.335 2.435 . 0 0 "[ . 1 . 2]" 1
217 1 74 VAL MG2 1 75 LYS H 3.690 . 4.060 3.709 3.501 3.985 . 0 0 "[ . 1 . 2]" 1
218 1 45 LEU H 1 74 VAL MG2 5.500 . 6.050 5.556 5.321 5.802 . 0 0 "[ . 1 . 2]" 1
219 1 70 TYR HD1 1 74 VAL MG2 4.850 . 5.330 3.965 3.445 4.311 . 0 0 "[ . 1 . 2]" 1
220 1 74 VAL HA 1 74 VAL MG2 3.400 . 3.740 3.228 3.224 3.239 . 0 0 "[ . 1 . 2]" 1
221 1 70 TYR HA 1 74 VAL MG2 4.270 . 4.700 4.131 3.879 4.264 . 0 0 "[ . 1 . 2]" 1
222 1 74 VAL MG2 1 75 LYS HA 4.270 . 4.700 3.679 3.473 3.963 . 0 0 "[ . 1 . 2]" 1
223 1 70 TYR HB2 1 74 VAL MG2 3.950 . 4.350 2.562 2.095 2.817 . 0 0 "[ . 1 . 2]" 1
224 1 73 ASN HB2 1 74 VAL MG2 4.990 . 5.490 5.111 4.836 5.327 . 0 0 "[ . 1 . 2]" 1
225 1 73 ASN HB3 1 74 VAL MG2 5.060 . 5.570 4.142 3.661 4.435 . 0 0 "[ . 1 . 2]" 1
226 1 70 TYR HB3 1 74 VAL MG2 3.950 . 4.350 3.232 2.619 3.718 . 0 0 "[ . 1 . 2]" 1
227 1 74 VAL MG2 1 123 ILE MG 4.470 . 4.920 3.983 3.366 4.415 . 0 0 "[ . 1 . 2]" 1
228 1 73 ASN HA 1 74 VAL MG1 4.120 . 4.530 4.360 4.260 4.446 . 0 0 "[ . 1 . 2]" 1
229 1 70 TYR HB2 1 74 VAL MG1 3.410 . 3.750 2.859 2.416 3.387 . 0 0 "[ . 1 . 2]" 1
230 1 67 ALA HA 1 74 VAL MG1 4.700 . 5.170 4.109 3.748 4.484 . 0 0 "[ . 1 . 2]" 1
231 1 70 TYR HB3 1 74 VAL MG1 3.410 . 3.750 2.746 2.291 3.249 . 0 0 "[ . 1 . 2]" 1
232 1 67 ALA MB 1 74 VAL MG1 4.340 . 4.770 4.510 4.160 4.774 0.004 9 0 "[ . 1 . 2]" 1
233 1 74 VAL MG1 1 127 ILE HG13 4.770 . 5.250 4.499 4.380 4.671 . 0 0 "[ . 1 . 2]" 1
234 1 74 VAL MG1 1 127 ILE HG12 3.490 . 3.840 3.840 3.735 3.858 0.018 2 0 "[ . 1 . 2]" 1
235 1 74 VAL MG1 1 75 LYS H 4.320 . 4.750 3.865 3.744 4.066 . 0 0 "[ . 1 . 2]" 1
236 1 70 TYR HD1 1 74 VAL MG1 4.370 . 4.810 3.669 3.075 4.108 . 0 0 "[ . 1 . 2]" 1
237 1 75 LYS HA 1 76 ILE MG 5.500 . 6.050 5.486 5.411 5.582 . 0 0 "[ . 1 . 2]" 1
238 1 42 ILE MG 1 75 LYS HB3 4.510 . 4.960 4.248 2.665 4.953 . 0 0 "[ . 1 . 2]" 1
239 1 42 ILE MG 1 75 LYS HB2 4.510 . 4.960 3.217 2.092 3.931 . 0 0 "[ . 1 . 2]" 1
240 1 75 LYS HG2 1 76 ILE H 5.410 . 5.950 4.691 3.247 5.076 . 0 0 "[ . 1 . 2]" 1
241 1 75 LYS HG3 1 76 ILE H 5.410 . 5.950 4.907 3.018 5.610 . 0 0 "[ . 1 . 2]" 1
242 1 75 LYS HD3 1 76 ILE H 5.220 . 5.740 3.649 2.609 5.524 . 0 0 "[ . 1 . 2]" 1
243 1 23 ILE MD 1 76 ILE HB 3.970 . 4.370 2.712 1.795 3.834 0.005 12 0 "[ . 1 . 2]" 1
244 1 23 ILE MD 1 76 ILE HA 5.360 . 5.900 5.107 4.311 5.903 0.003 1 0 "[ . 1 . 2]" 1
245 1 45 LEU H 1 76 ILE MG 4.690 . 5.160 4.418 4.004 4.854 . 0 0 "[ . 1 . 2]" 1
246 1 76 ILE H 1 76 ILE MG 4.160 . 4.580 3.815 3.764 3.892 . 0 0 "[ . 1 . 2]" 1
247 1 76 ILE MG 1 77 TYR HA 5.010 . 5.510 3.504 3.286 3.889 . 0 0 "[ . 1 . 2]" 1
248 1 23 ILE HA 1 76 ILE MG 4.390 . 4.830 3.099 2.772 3.560 . 0 0 "[ . 1 . 2]" 1
249 1 75 LYS HA 1 76 ILE MD 5.040 . 5.540 3.584 2.490 5.158 . 0 0 "[ . 1 . 2]" 1
250 1 67 ALA HA 1 76 ILE MD 4.260 . 4.690 3.795 3.158 4.621 . 0 0 "[ . 1 . 2]" 1
251 1 23 ILE HA 1 76 ILE MD 3.840 . 4.220 3.942 3.592 4.223 0.003 9 0 "[ . 1 . 2]" 1
252 1 67 ALA MB 1 76 ILE MD 3.050 . 3.360 2.048 1.871 2.317 . 0 0 "[ . 1 . 2]" 1
253 1 24 GLU HB3 1 77 TYR HA 4.710 . 5.180 3.542 2.636 4.281 . 0 0 "[ . 1 . 2]" 1
254 1 26 ILE HG12 1 77 TYR HA 5.220 . 5.740 4.291 3.904 4.655 . 0 0 "[ . 1 . 2]" 1
255 1 46 VAL HA 1 77 TYR HB2 4.860 . 5.350 2.897 2.537 3.340 . 0 0 "[ . 1 . 2]" 1
256 1 26 ILE HG13 1 77 TYR HB3 5.230 . 5.750 3.974 3.624 4.328 . 0 0 "[ . 1 . 2]" 1
257 1 26 ILE MG 1 77 TYR HB3 4.660 . 5.130 2.923 2.216 3.522 . 0 0 "[ . 1 . 2]" 1
258 1 26 ILE MG 1 77 TYR HB2 4.660 . 5.130 4.187 3.432 4.713 . 0 0 "[ . 1 . 2]" 1
259 1 26 ILE HG13 1 77 TYR HB2 5.230 . 5.750 5.298 4.928 5.753 0.003 10 0 "[ . 1 . 2]" 1
260 1 85 GLN HB2 1 88 ALA MB 5.120 . 5.630 3.872 2.032 5.305 . 0 0 "[ . 1 . 2]" 1
261 1 85 GLN HB3 1 88 ALA MB 5.120 . 5.630 4.480 2.797 5.635 0.005 20 0 "[ . 1 . 2]" 1
262 1 85 GLN HA 1 85 GLN HG3 4.200 . 4.620 3.675 3.012 4.274 . 0 0 "[ . 1 . 2]" 1
263 1 85 GLN HA 1 85 GLN HG2 4.200 . 4.620 3.271 2.536 4.262 . 0 0 "[ . 1 . 2]" 1
264 1 85 GLN H 1 85 GLN HG3 4.480 . 4.930 3.447 2.324 4.684 . 0 0 "[ . 1 . 2]" 1
265 1 87 VAL HA 1 90 GLN H 3.760 . 4.140 3.372 3.092 3.749 . 0 0 "[ . 1 . 2]" 1
266 1 87 VAL HA 1 91 TYR HE1 5.150 . 5.670 4.533 3.443 5.448 . 0 0 "[ . 1 . 2]" 1
267 1 87 VAL H 1 87 VAL MG1 3.810 . 4.190 3.677 1.915 3.790 . 0 0 "[ . 1 . 2]" 1
268 1 87 VAL MG1 1 91 TYR HE1 4.300 . 4.730 2.241 1.834 4.563 . 0 0 "[ . 1 . 2]" 1
269 1 87 VAL MG2 1 91 TYR HE1 4.300 . 4.730 4.176 1.840 4.734 0.004 13 0 "[ . 1 . 2]" 1
270 1 88 ALA H 1 88 ALA MB 3.200 . 3.520 2.238 2.224 2.271 . 0 0 "[ . 1 . 2]" 1
271 1 88 ALA MB 1 91 TYR HD1 4.760 . 5.240 4.819 3.556 5.243 0.003 5 0 "[ . 1 . 2]" 1
272 1 87 VAL H 1 88 ALA MB 4.740 . 5.210 4.477 4.376 4.694 . 0 0 "[ . 1 . 2]" 1
273 1 88 ALA MB 1 90 GLN H 5.150 . 5.670 4.336 4.189 4.519 . 0 0 "[ . 1 . 2]" 1
274 1 88 ALA MB 1 93 VAL MG2 3.840 . 4.220 3.393 2.310 4.224 0.004 15 0 "[ . 1 . 2]" 1
275 1 88 ALA HA 1 93 VAL MG1 4.820 . 5.300 3.589 2.330 4.719 . 0 0 "[ . 1 . 2]" 1
276 1 88 ALA HA 1 93 VAL HB 3.810 . 4.190 3.574 2.662 4.196 0.006 14 0 "[ . 1 . 2]" 1
277 1 89 THR HA 1 92 GLY H 4.180 . 4.600 3.223 2.942 3.522 . 0 0 "[ . 1 . 2]" 1
278 1 89 THR HA 1 89 THR MG 3.000 . 3.300 2.361 2.315 2.418 . 0 0 "[ . 1 . 2]" 1
279 1 89 THR MG 1 90 GLN HA 3.980 . 4.380 3.816 3.523 4.025 . 0 0 "[ . 1 . 2]" 1
280 1 90 GLN HB3 1 91 TYR H 4.200 . 4.620 2.519 2.286 2.722 . 0 0 "[ . 1 . 2]" 1
281 1 87 VAL HA 1 90 GLN HB3 3.930 . 4.320 2.452 2.125 2.960 . 0 0 "[ . 1 . 2]" 1
282 1 87 VAL HA 1 90 GLN HB2 3.930 . 4.320 3.047 2.560 3.747 . 0 0 "[ . 1 . 2]" 1
283 1 90 GLN HA 1 90 GLN HG3 4.110 . 4.520 2.702 2.445 3.227 . 0 0 "[ . 1 . 2]" 1
284 1 90 GLN HA 1 90 GLN HG2 4.110 . 4.520 3.289 2.955 3.799 . 0 0 "[ . 1 . 2]" 1
285 1 90 GLN HG2 1 91 TYR HA 5.250 . 5.780 4.144 3.382 5.449 . 0 0 "[ . 1 . 2]" 1
286 1 90 GLN HG3 1 91 TYR HA 5.250 . 5.780 4.916 3.585 5.650 . 0 0 "[ . 1 . 2]" 1
287 1 91 TYR HA 1 91 TYR HD2 3.860 . 4.250 2.543 1.898 3.494 . 0 0 "[ . 1 . 2]" 1
288 1 93 VAL HA 1 98 THR MG 4.810 . 5.290 4.464 3.512 5.080 . 0 0 "[ . 1 . 2]" 1
289 1 93 VAL HA 1 112 ILE MG 4.760 . 5.240 3.588 2.910 4.037 . 0 0 "[ . 1 . 2]" 1
290 1 93 VAL HA 1 93 VAL MG1 3.540 . 3.890 2.779 2.371 3.229 . 0 0 "[ . 1 . 2]" 1
291 1 93 VAL HA 1 93 VAL MG2 3.540 . 3.890 2.376 2.280 2.447 . 0 0 "[ . 1 . 2]" 1
292 1 88 ALA MB 1 93 VAL HA 5.430 . 5.970 5.178 4.814 5.616 . 0 0 "[ . 1 . 2]" 1
293 1 88 ALA MB 1 93 VAL HB 3.840 . 4.220 3.061 2.128 4.228 0.008 1 0 "[ . 1 . 2]" 1
294 1 93 VAL HB 1 112 ILE MG 4.890 . 5.380 4.775 3.899 5.391 0.011 13 0 "[ . 1 . 2]" 1
295 1 88 ALA HA 1 93 VAL MG2 4.820 . 5.300 3.561 2.194 5.099 . 0 0 "[ . 1 . 2]" 1
296 1 98 THR HA 1 99 ILE HB 5.260 . 5.790 4.639 4.574 4.716 . 0 0 "[ . 1 . 2]" 1
297 1 98 THR HA 1 111 VAL HB 5.500 . 6.050 4.383 3.752 5.410 . 0 0 "[ . 1 . 2]" 1
298 1 98 THR HA 1 99 ILE MD 4.710 . 5.180 3.354 2.509 4.950 . 0 0 "[ . 1 . 2]" 1
299 1 93 VAL MG2 1 98 THR HB 4.670 . 5.140 3.703 3.179 4.482 . 0 0 "[ . 1 . 2]" 1
300 1 98 THR HA 1 98 THR MG 3.340 . 3.670 2.364 2.322 2.436 . 0 0 "[ . 1 . 2]" 1
301 1 93 VAL HB 1 98 THR MG 3.980 . 4.380 3.588 2.734 4.376 . 0 0 "[ . 1 . 2]" 1
302 1 98 THR MG 1 112 ILE MG 3.170 . 3.490 3.342 2.505 3.496 0.006 6 0 "[ . 1 . 2]" 1
303 1 93 VAL MG2 1 98 THR MG 3.530 . 3.880 2.197 1.825 3.019 . 0 0 "[ . 1 . 2]" 1
304 1 98 THR MG 1 99 ILE HA 4.850 . 5.330 3.864 3.578 4.103 . 0 0 "[ . 1 . 2]" 1
305 1 47 ASP HA 1 99 ILE HA 3.800 . 4.180 2.248 1.933 2.526 . 0 0 "[ . 1 . 2]" 1
306 1 99 ILE HA 1 111 VAL H 4.870 . 5.360 4.655 4.445 4.801 . 0 0 "[ . 1 . 2]" 1
307 1 99 ILE HB 1 111 VAL H 3.760 . 4.140 2.928 2.575 3.321 . 0 0 "[ . 1 . 2]" 1
308 1 47 ASP HA 1 99 ILE HB 5.200 . 5.720 4.712 4.310 5.082 . 0 0 "[ . 1 . 2]" 1
309 1 99 ILE HB 1 111 VAL MG2 3.330 . 3.660 2.660 2.284 3.061 . 0 0 "[ . 1 . 2]" 1
310 1 47 ASP HA 1 99 ILE HG12 4.500 . 4.950 3.658 2.639 4.760 . 0 0 "[ . 1 . 2]" 1
311 1 99 ILE HG12 1 99 ILE MG 3.450 . 3.790 2.274 2.218 2.388 . 0 0 "[ . 1 . 2]" 1
312 1 99 ILE HG13 1 99 ILE MG 3.450 . 3.790 2.760 2.525 3.224 . 0 0 "[ . 1 . 2]" 1
313 1 99 ILE MG 1 111 VAL H 3.880 . 4.270 3.694 3.228 4.055 . 0 0 "[ . 1 . 2]" 1
314 1 99 ILE HA 1 99 ILE MG 3.370 . 3.710 2.398 2.331 2.471 . 0 0 "[ . 1 . 2]" 1
315 1 47 ASP HA 1 99 ILE MG 3.880 . 4.270 3.058 2.530 3.709 . 0 0 "[ . 1 . 2]" 1
316 1 99 ILE MG 1 111 VAL HB 3.480 . 3.830 3.443 2.865 3.820 . 0 0 "[ . 1 . 2]" 1
317 1 99 ILE MD 1 111 VAL H 4.260 . 4.690 4.316 4.010 4.697 0.007 8 0 "[ . 1 . 2]" 1
318 1 99 ILE MD 1 100 LEU H 5.140 . 5.650 5.032 4.856 5.485 . 0 0 "[ . 1 . 2]" 1
319 1 99 ILE MD 1 115 ASP H 5.500 . 6.050 5.807 5.045 6.066 0.016 15 0 "[ . 1 . 2]" 1
320 1 99 ILE HA 1 99 ILE MD 4.090 . 4.500 3.395 3.066 3.958 . 0 0 "[ . 1 . 2]" 1
321 1 99 ILE MD 1 114 ALA HA 5.370 . 5.910 5.091 4.472 5.508 . 0 0 "[ . 1 . 2]" 1
322 1 99 ILE MD 1 111 VAL HB 3.350 . 3.690 2.372 2.053 2.944 . 0 0 "[ . 1 . 2]" 1
323 1 100 LEU HA 1 100 LEU HG 3.500 . 3.850 2.510 2.444 3.086 . 0 0 "[ . 1 . 2]" 1
324 1 100 LEU H 1 100 LEU HG 5.030 . 5.530 4.300 3.983 4.563 . 0 0 "[ . 1 . 2]" 1
325 1 45 LEU HA 1 101 MET HA 3.850 . 4.230 2.554 2.292 2.865 . 0 0 "[ . 1 . 2]" 1
326 1 101 MET HB2 1 102 PHE H 5.280 . 5.810 4.339 4.277 4.417 . 0 0 "[ . 1 . 2]" 1
327 1 101 MET HB2 1 109 SER H 4.970 . 5.470 1.934 1.794 2.099 0.006 20 0 "[ . 1 . 2]" 1
328 1 101 MET HB3 1 109 SER HB3 5.500 . 6.050 5.447 4.342 6.028 . 0 0 "[ . 1 . 2]" 1
329 1 101 MET HB2 1 108 LEU HB2 4.710 . 5.180 2.668 2.295 3.126 . 0 0 "[ . 1 . 2]" 1
330 1 101 MET HG3 1 111 VAL MG2 3.780 . 4.160 3.353 3.024 3.763 . 0 0 "[ . 1 . 2]" 1
331 1 43 LEU MD1 1 101 MET HG2 4.240 . 4.660 3.395 2.646 4.379 . 0 0 "[ . 1 . 2]" 1
332 1 43 LEU MD2 1 101 MET HG2 4.240 . 4.660 3.612 3.095 4.621 . 0 0 "[ . 1 . 2]" 1
333 1 101 MET HG3 1 109 SER HB3 4.970 . 5.470 4.590 3.373 5.165 . 0 0 "[ . 1 . 2]" 1
334 1 101 MET HG2 1 109 SER HB3 5.460 . 6.010 5.488 4.242 5.983 . 0 0 "[ . 1 . 2]" 1
335 1 45 LEU HA 1 101 MET HG3 4.770 . 5.250 4.162 3.481 4.752 . 0 0 "[ . 1 . 2]" 1
336 1 45 LEU HA 1 101 MET HG2 5.020 . 5.520 3.499 2.940 4.076 . 0 0 "[ . 1 . 2]" 1
337 1 102 PHE HA 1 107 LYS HA 4.230 . 4.650 2.381 1.945 2.823 . 0 0 "[ . 1 . 2]" 1
338 1 101 MET HB2 1 102 PHE HA 4.960 . 5.460 4.862 4.750 5.020 . 0 0 "[ . 1 . 2]" 1
339 1 38 CYS H 1 102 PHE HB3 5.030 . 5.530 5.513 5.260 5.548 0.018 15 0 "[ . 1 . 2]" 1
340 1 102 PHE HB2 1 103 LYS H 5.230 . 5.750 3.986 3.841 4.216 . 0 0 "[ . 1 . 2]" 1
341 1 36 THR MG 1 105 GLY HA3 5.340 . 5.870 4.996 3.895 5.698 . 0 0 "[ . 1 . 2]" 1
342 1 36 THR MG 1 105 GLY HA2 5.340 . 5.870 3.765 2.784 4.495 . 0 0 "[ . 1 . 2]" 1
343 1 101 MET HB2 1 109 SER HA 4.940 . 5.430 4.333 4.229 4.482 . 0 0 "[ . 1 . 2]" 1
344 1 106 LYS HA 1 106 LYS HD3 4.780 . 5.260 4.248 2.375 4.736 . 0 0 "[ . 1 . 2]" 1
345 1 106 LYS HA 1 106 LYS HD2 4.780 . 5.260 4.012 2.110 4.918 . 0 0 "[ . 1 . 2]" 1
346 1 106 LYS H 1 106 LYS HD2 5.370 . 5.910 5.034 4.313 5.573 . 0 0 "[ . 1 . 2]" 1
347 1 106 LYS H 1 106 LYS HD3 5.370 . 5.910 4.893 3.197 5.401 . 0 0 "[ . 1 . 2]" 1
348 1 101 MET HB2 1 107 LYS HA 5.360 . 5.900 4.811 4.149 5.208 . 0 0 "[ . 1 . 2]" 1
349 1 101 MET HB3 1 108 LEU HB2 4.450 . 4.890 2.930 2.293 3.520 . 0 0 "[ . 1 . 2]" 1
350 1 108 LEU H 1 108 LEU HG 4.680 . 5.150 4.050 3.915 4.282 . 0 0 "[ . 1 . 2]" 1
351 1 109 SER HB2 1 122 GLU HG3 4.520 . 4.970 3.665 3.066 4.881 . 0 0 "[ . 1 . 2]" 1
352 1 101 MET ME 1 109 SER HB2 4.500 . 4.950 2.911 2.287 4.238 . 0 0 "[ . 1 . 2]" 1
353 1 101 MET HB2 1 109 SER HB2 3.910 . 4.300 3.254 2.723 4.308 0.008 5 0 "[ . 1 . 2]" 1
354 1 108 LEU HB2 1 109 SER HB2 4.490 . 4.940 3.792 3.382 4.262 . 0 0 "[ . 1 . 2]" 1
355 1 109 SER HB3 1 111 VAL MG2 4.400 . 4.840 4.502 3.763 4.843 0.003 15 0 "[ . 1 . 2]" 1
356 1 108 LEU HB2 1 109 SER HB3 4.980 . 5.480 4.905 3.839 5.482 0.002 8 0 "[ . 1 . 2]" 1
357 1 101 MET HB2 1 109 SER HB3 4.300 . 4.730 4.224 3.244 4.728 . 0 0 "[ . 1 . 2]" 1
358 1 101 MET ME 1 109 SER HB3 4.610 . 5.070 3.814 2.941 4.814 . 0 0 "[ . 1 . 2]" 1
359 1 109 SER HB3 1 122 GLU HB3 4.570 . 5.030 3.747 3.178 4.844 . 0 0 "[ . 1 . 2]" 1
360 1 100 LEU HG 1 110 GLN HB2 4.410 . 4.850 3.543 2.471 4.859 0.009 14 0 "[ . 1 . 2]" 1
361 1 100 LEU HG 1 110 GLN HB3 4.410 . 4.850 3.081 2.467 4.257 . 0 0 "[ . 1 . 2]" 1
362 1 100 LEU HG 1 110 GLN HA 4.510 . 4.960 3.885 3.386 4.961 0.001 14 0 "[ . 1 . 2]" 1
363 1 111 VAL HA 1 112 ILE HG12 5.040 . 5.540 5.168 4.905 5.301 . 0 0 "[ . 1 . 2]" 1
364 1 111 VAL HA 1 112 ILE HG13 5.040 . 5.540 3.949 3.687 4.100 . 0 0 "[ . 1 . 2]" 1
365 1 111 VAL H 1 111 VAL MG2 3.540 . 3.890 2.246 2.140 2.505 . 0 0 "[ . 1 . 2]" 1
366 1 111 VAL MG2 1 122 GLU H 5.500 . 6.050 5.713 5.446 6.060 0.010 19 0 "[ . 1 . 2]" 1
367 1 111 VAL MG2 1 119 ILE H 4.330 . 4.760 4.573 4.084 4.765 0.005 11 0 "[ . 1 . 2]" 1
368 1 111 VAL MG2 1 120 ILE H 5.500 . 6.050 5.876 5.606 6.053 0.003 19 0 "[ . 1 . 2]" 1
369 1 110 GLN HA 1 111 VAL MG2 4.380 . 4.820 3.574 3.333 3.802 . 0 0 "[ . 1 . 2]" 1
370 1 111 VAL HA 1 111 VAL MG1 3.450 . 3.790 2.399 2.362 2.434 . 0 0 "[ . 1 . 2]" 1
371 1 101 MET HG2 1 111 VAL MG2 4.820 . 5.300 4.003 3.584 4.709 . 0 0 "[ . 1 . 2]" 1
372 1 62 GLN HB3 1 111 VAL MG1 4.190 . 4.610 4.596 4.392 4.630 0.020 1 0 "[ . 1 . 2]" 1
373 1 111 VAL HA 1 112 ILE HB 5.110 . 5.620 4.753 4.661 4.962 . 0 0 "[ . 1 . 2]" 1
374 1 112 ILE HB 1 112 ILE MD 3.080 . 3.390 2.452 2.432 2.474 . 0 0 "[ . 1 . 2]" 1
375 1 112 ILE HB 1 113 GLY HA2 5.500 . 6.050 5.670 5.410 5.837 . 0 0 "[ . 1 . 2]" 1
376 1 113 GLY HA2 1 114 ALA MB 4.660 . 5.130 3.988 3.930 4.163 . 0 0 "[ . 1 . 2]" 1
377 1 112 ILE MG 1 113 GLY HA2 4.570 . 5.030 3.932 3.728 4.233 . 0 0 "[ . 1 . 2]" 1
378 1 112 ILE MG 1 113 GLY HA3 4.160 . 4.580 3.590 3.363 4.028 . 0 0 "[ . 1 . 2]" 1
379 1 112 ILE HB 1 113 GLY HA3 4.580 . 5.040 4.781 4.671 4.854 . 0 0 "[ . 1 . 2]" 1
380 1 114 ALA MB 1 115 ASP H 4.170 . 4.590 3.639 3.455 3.735 . 0 0 "[ . 1 . 2]" 1
381 1 113 GLY HA3 1 114 ALA MB 4.170 . 4.590 4.082 3.790 4.482 . 0 0 "[ . 1 . 2]" 1
382 1 115 ASP H 1 115 ASP HB3 3.950 . 4.350 3.718 3.601 3.869 . 0 0 "[ . 1 . 2]" 1
383 1 115 ASP H 1 115 ASP HB2 3.950 . 4.350 2.556 2.352 2.844 . 0 0 "[ . 1 . 2]" 1
384 1 115 ASP HB2 1 118 LYS HB2 4.650 . 5.120 3.154 2.532 4.329 . 0 0 "[ . 1 . 2]" 1
385 1 115 ASP HB2 1 118 LYS HB3 4.650 . 5.120 2.396 1.924 3.251 . 0 0 "[ . 1 . 2]" 1
386 1 115 ASP HB2 1 118 LYS HD2 5.500 . 6.050 4.254 2.157 6.022 . 0 0 "[ . 1 . 2]" 1
387 1 115 ASP HB2 1 118 LYS HD3 5.500 . 6.050 4.982 3.713 6.055 0.005 5 0 "[ . 1 . 2]" 1
388 1 115 ASP HB3 1 118 LYS HD2 5.500 . 6.050 4.841 3.270 6.051 0.001 10 0 "[ . 1 . 2]" 1
389 1 115 ASP HB3 1 118 LYS HD3 5.500 . 6.050 5.255 4.302 6.002 . 0 0 "[ . 1 . 2]" 1
390 1 115 ASP HB3 1 118 LYS HB2 4.650 . 5.120 2.495 1.881 4.191 . 0 0 "[ . 1 . 2]" 1
391 1 115 ASP HB3 1 118 LYS HB3 4.650 . 5.120 2.443 1.913 3.070 . 0 0 "[ . 1 . 2]" 1
392 1 115 ASP H 1 116 ILE HA 4.920 . 5.410 4.675 4.101 5.018 . 0 0 "[ . 1 . 2]" 1
393 1 116 ILE HA 1 116 ILE HG13 4.130 . 4.540 3.072 3.030 3.113 . 0 0 "[ . 1 . 2]" 1
394 1 115 ASP H 1 116 ILE HB 5.410 . 5.950 5.675 4.905 5.955 0.005 8 0 "[ . 1 . 2]" 1
395 1 116 ILE H 1 116 ILE HG12 5.500 . 6.050 4.687 4.666 4.705 . 0 0 "[ . 1 . 2]" 1
396 1 116 ILE MG 1 117 SER HA 3.750 . 4.130 3.340 3.235 3.452 . 0 0 "[ . 1 . 2]" 1
397 1 116 ILE HA 1 116 ILE MG 3.390 . 3.730 3.221 3.212 3.228 . 0 0 "[ . 1 . 2]" 1
398 1 116 ILE HG13 1 116 ILE MG 3.020 . 3.320 2.489 2.461 2.507 . 0 0 "[ . 1 . 2]" 1
399 1 116 ILE HG12 1 116 ILE MG 3.230 . 3.550 2.305 2.292 2.335 . 0 0 "[ . 1 . 2]" 1
400 1 62 GLN HB3 1 116 ILE MG 5.110 . 5.620 5.554 5.244 5.631 0.011 3 0 "[ . 1 . 2]" 1
401 1 62 GLN HG2 1 116 ILE MG 4.660 . 5.130 4.668 4.197 4.908 . 0 0 "[ . 1 . 2]" 1
402 1 62 GLN HA 1 116 ILE MD 4.160 . 4.580 2.543 2.192 2.942 . 0 0 "[ . 1 . 2]" 1
403 1 116 ILE MD 1 120 ILE H 4.290 . 4.720 3.688 3.580 3.798 . 0 0 "[ . 1 . 2]" 1
404 1 63 LEU H 1 116 ILE MD 5.500 . 6.050 5.256 5.045 5.448 . 0 0 "[ . 1 . 2]" 1
405 1 62 GLN HB2 1 116 ILE MD 4.450 . 4.890 3.983 3.736 4.249 . 0 0 "[ . 1 . 2]" 1
406 1 62 GLN HG2 1 116 ILE MD 4.740 . 5.210 3.214 3.000 3.488 . 0 0 "[ . 1 . 2]" 1
407 1 62 GLN HB3 1 116 ILE MD 3.440 . 3.780 2.597 2.291 2.967 . 0 0 "[ . 1 . 2]" 1
408 1 117 SER HA 1 119 ILE H 5.090 . 5.600 4.657 4.479 4.800 . 0 0 "[ . 1 . 2]" 1
409 1 117 SER HA 1 120 ILE HG13 3.520 . 3.870 2.468 2.302 2.732 . 0 0 "[ . 1 . 2]" 1
410 1 117 SER HA 1 120 ILE MG 3.610 . 3.970 3.795 3.584 3.972 0.002 14 0 "[ . 1 . 2]" 1
411 1 119 ILE H 1 119 ILE HB 3.650 . 4.020 3.644 3.631 3.661 . 0 0 "[ . 1 . 2]" 1
412 1 119 ILE HB 1 120 ILE H 3.950 . 4.350 3.883 3.829 3.960 . 0 0 "[ . 1 . 2]" 1
413 1 111 VAL MG2 1 119 ILE HB 3.800 . 4.180 3.038 2.526 3.434 . 0 0 "[ . 1 . 2]" 1
414 1 119 ILE H 1 119 ILE HG12 3.890 . 4.280 3.342 3.253 3.460 . 0 0 "[ . 1 . 2]" 1
415 1 119 ILE H 1 119 ILE HG13 4.320 . 4.750 2.368 2.181 2.674 . 0 0 "[ . 1 . 2]" 1
416 1 116 ILE MD 1 119 ILE HG12 3.630 . 3.990 2.554 2.010 2.974 . 0 0 "[ . 1 . 2]" 1
417 1 66 LEU H 1 119 ILE MD 3.810 . 4.190 4.048 3.776 4.196 0.006 17 0 "[ . 1 . 2]" 1
418 1 119 ILE HA 1 119 ILE MD 3.540 . 3.890 3.693 3.639 3.724 . 0 0 "[ . 1 . 2]" 1
419 1 119 ILE MD 1 120 ILE HA 3.910 . 4.300 2.505 2.424 2.634 . 0 0 "[ . 1 . 2]" 1
420 1 66 LEU HG 1 119 ILE MD 2.840 . 3.120 2.477 2.235 2.677 . 0 0 "[ . 1 . 2]" 1
421 1 120 ILE HA 1 125 ASN H 5.500 . 6.050 5.891 5.730 6.058 0.008 4 0 "[ . 1 . 2]" 1
422 1 120 ILE HA 1 120 ILE MG 3.130 . 3.440 2.316 2.281 2.345 . 0 0 "[ . 1 . 2]" 1
423 1 120 ILE H 1 120 ILE HB 3.810 . 4.190 3.673 3.651 3.683 . 0 0 "[ . 1 . 2]" 1
424 1 120 ILE HB 1 121 SER H 4.020 . 4.420 3.884 3.765 3.935 . 0 0 "[ . 1 . 2]" 1
425 1 62 GLN HA 1 116 ILE HB 4.160 . 4.580 4.569 4.339 4.589 0.009 6 0 "[ . 1 . 2]" 1
426 1 120 ILE HB 1 120 ILE MD 3.530 . 3.880 2.301 2.285 2.319 . 0 0 "[ . 1 . 2]" 1
427 1 120 ILE H 1 120 ILE HG12 4.110 . 4.520 3.366 3.320 3.394 . 0 0 "[ . 1 . 2]" 1
428 1 120 ILE HA 1 120 ILE HG13 3.940 . 4.330 3.643 3.621 3.653 . 0 0 "[ . 1 . 2]" 1
429 1 116 ILE HG13 1 120 ILE HG13 4.710 . 5.180 4.135 3.975 4.411 . 0 0 "[ . 1 . 2]" 1
430 1 116 ILE MD 1 120 ILE HG13 4.870 . 5.360 4.480 4.301 4.653 . 0 0 "[ . 1 . 2]" 1
431 1 119 ILE MD 1 120 ILE HG13 5.120 . 5.630 4.106 3.968 4.371 . 0 0 "[ . 1 . 2]" 1
432 1 120 ILE MG 1 121 SER H 4.190 . 4.610 4.040 3.992 4.098 . 0 0 "[ . 1 . 2]" 1
433 1 120 ILE MG 1 124 ASN HD21 3.850 . 4.230 4.202 3.902 4.238 0.008 4 0 "[ . 1 . 2]" 1
434 1 116 ILE HA 1 120 ILE MG 4.140 . 4.550 3.709 3.568 3.961 . 0 0 "[ . 1 . 2]" 1
435 1 120 ILE HG13 1 120 ILE MG 2.940 . 3.230 2.679 2.640 2.705 . 0 0 "[ . 1 . 2]" 1
436 1 120 ILE H 1 120 ILE MD 3.620 . 3.980 3.577 3.469 3.675 . 0 0 "[ . 1 . 2]" 1
437 1 117 SER HA 1 120 ILE MD 3.800 . 4.180 2.928 2.748 3.149 . 0 0 "[ . 1 . 2]" 1
438 1 120 ILE MD 1 121 SER HA 4.000 . 4.400 2.516 2.389 2.639 . 0 0 "[ . 1 . 2]" 1
439 1 120 ILE HA 1 120 ILE MD 3.920 . 4.310 3.726 3.704 3.753 . 0 0 "[ . 1 . 2]" 1
440 1 122 GLU HA 1 125 ASN HD21 4.670 . 5.140 3.525 1.958 4.193 . 0 0 "[ . 1 . 2]" 1
441 1 122 GLU HA 1 125 ASN HB3 3.800 . 4.180 2.827 2.370 4.186 0.006 5 0 "[ . 1 . 2]" 1
442 1 122 GLU HA 1 122 GLU HG2 3.720 . 4.090 3.694 3.606 3.761 . 0 0 "[ . 1 . 2]" 1
443 1 122 GLU HA 1 122 GLU HG3 4.170 . 4.590 3.861 3.790 4.000 . 0 0 "[ . 1 . 2]" 1
444 1 122 GLU H 1 122 GLU HG3 4.020 . 4.420 3.382 3.136 3.568 . 0 0 "[ . 1 . 2]" 1
445 1 111 VAL MG2 1 122 GLU HG3 4.070 . 4.480 3.818 3.370 4.304 . 0 0 "[ . 1 . 2]" 1
446 1 111 VAL MG2 1 122 GLU HG2 4.190 . 4.610 4.080 3.746 4.547 . 0 0 "[ . 1 . 2]" 1
447 1 122 GLU HG3 1 123 ILE HA 4.920 . 5.410 3.637 3.353 4.209 . 0 0 "[ . 1 . 2]" 1
448 1 120 ILE HA 1 122 GLU HG2 5.000 . 5.500 5.086 4.862 5.448 . 0 0 "[ . 1 . 2]" 1
449 1 122 GLU H 1 123 ILE HA 5.210 . 5.730 5.226 5.163 5.302 . 0 0 "[ . 1 . 2]" 1
450 1 123 ILE HA 1 123 ILE HG12 3.450 . 3.790 2.480 2.418 2.531 . 0 0 "[ . 1 . 2]" 1
451 1 123 ILE HA 1 123 ILE HG13 3.450 . 3.790 2.981 2.937 3.019 . 0 0 "[ . 1 . 2]" 1
452 1 120 ILE HA 1 123 ILE HB 3.720 . 4.090 3.069 2.789 3.280 . 0 0 "[ . 1 . 2]" 1
453 1 119 ILE MD 1 123 ILE HB 4.270 . 4.700 3.671 3.449 3.858 . 0 0 "[ . 1 . 2]" 1
454 1 123 ILE H 1 123 ILE HG13 4.380 . 4.820 2.284 2.143 2.379 . 0 0 "[ . 1 . 2]" 1
455 1 123 ILE H 1 123 ILE HG12 4.380 . 4.820 3.505 3.417 3.575 . 0 0 "[ . 1 . 2]" 1
456 1 74 VAL MG1 1 123 ILE MG 3.060 . 3.370 2.541 2.163 2.908 . 0 0 "[ . 1 . 2]" 1
457 1 123 ILE HA 1 123 ILE MG 3.450 . 3.790 2.470 2.441 2.500 . 0 0 "[ . 1 . 2]" 1
458 1 70 TYR HE1 1 123 ILE MG 4.370 . 4.810 3.815 3.130 4.511 . 0 0 "[ . 1 . 2]" 1
459 1 123 ILE MG 1 127 ILE HG12 4.410 . 4.850 2.360 2.202 2.483 . 0 0 "[ . 1 . 2]" 1
460 1 70 TYR HE1 1 123 ILE MD 4.840 . 5.320 4.926 4.307 5.329 0.009 2 0 "[ . 1 . 2]" 1
461 1 120 ILE HA 1 123 ILE MD 3.330 . 3.660 3.618 3.314 3.666 0.006 15 0 "[ . 1 . 2]" 1
462 1 66 LEU HB2 1 123 ILE MD 4.020 . 4.420 3.068 2.769 3.488 . 0 0 "[ . 1 . 2]" 1
463 1 119 ILE HB 1 123 ILE MD 4.170 . 4.590 2.555 2.241 2.858 . 0 0 "[ . 1 . 2]" 1
464 1 66 LEU HB3 1 123 ILE MD 4.020 . 4.420 3.600 3.225 3.832 . 0 0 "[ . 1 . 2]" 1
465 1 119 ILE MD 1 123 ILE MD 2.770 . 3.050 2.229 2.079 2.411 . 0 0 "[ . 1 . 2]" 1
466 1 123 ILE MD 1 123 ILE MG 2.960 . 3.260 1.954 1.916 2.001 . 0 0 "[ . 1 . 2]" 1
467 1 121 SER HA 1 124 ASN HB2 3.830 . 4.210 3.607 3.307 3.871 . 0 0 "[ . 1 . 2]" 1
468 1 124 ASN HA 1 127 ILE HG12 4.060 . 4.470 2.752 2.036 3.476 . 0 0 "[ . 1 . 2]" 1
469 1 124 ASN HA 1 127 ILE MG 5.500 . 6.050 4.594 4.022 5.112 . 0 0 "[ . 1 . 2]" 1
470 1 123 ILE MG 1 124 ASN HA 3.890 . 4.280 3.153 3.035 3.255 . 0 0 "[ . 1 . 2]" 1
471 1 122 GLU HA 1 125 ASN HB2 3.800 . 4.180 3.118 2.494 4.030 . 0 0 "[ . 1 . 2]" 1
472 1 126 ASN H 1 126 ASN HB2 3.960 . 4.360 2.620 2.338 3.760 . 0 0 "[ . 1 . 2]" 1
473 1 43 LEU MD1 1 126 ASN HB3 3.900 . 4.290 3.106 2.328 4.120 . 0 0 "[ . 1 . 2]" 1
474 1 43 LEU MD2 1 126 ASN HB3 3.900 . 4.290 3.199 1.989 4.308 0.018 12 0 "[ . 1 . 2]" 1
475 1 43 LEU MD1 1 126 ASN HB2 3.900 . 4.290 3.207 1.866 4.288 . 0 0 "[ . 1 . 2]" 1
476 1 43 LEU MD2 1 126 ASN HB2 3.900 . 4.290 2.789 1.982 4.223 . 0 0 "[ . 1 . 2]" 1
477 1 127 ILE HA 1 127 ILE HG13 3.910 . 4.300 3.689 3.665 3.713 . 0 0 "[ . 1 . 2]" 1
478 1 127 ILE HA 1 127 ILE HG12 4.190 . 4.610 3.800 3.762 3.829 . 0 0 "[ . 1 . 2]" 1
479 1 127 ILE H 1 127 ILE HB 3.690 . 4.060 3.830 3.688 3.923 . 0 0 "[ . 1 . 2]" 1
480 1 74 VAL MG1 1 127 ILE HB 3.950 . 4.350 3.859 3.438 4.358 0.008 6 0 "[ . 1 . 2]" 1
481 1 127 ILE HG12 1 128 ASN H 5.100 . 5.610 4.581 4.476 4.692 . 0 0 "[ . 1 . 2]" 1
482 1 124 ASN HA 1 127 ILE HG13 3.790 . 4.170 2.590 2.218 3.246 . 0 0 "[ . 1 . 2]" 1
483 1 123 ILE MG 1 127 ILE HG13 4.610 . 5.070 3.382 2.956 3.710 . 0 0 "[ . 1 . 2]" 1
484 1 126 ASN H 1 127 ILE MG 4.660 . 5.130 4.057 3.645 4.350 . 0 0 "[ . 1 . 2]" 1
485 1 127 ILE HA 1 127 ILE MG 3.080 . 3.390 2.349 2.314 2.424 . 0 0 "[ . 1 . 2]" 1
486 1 73 ASN HB3 1 127 ILE MG 4.090 . 4.500 2.955 2.613 3.363 . 0 0 "[ . 1 . 2]" 1
487 1 123 ILE MG 1 127 ILE MG 3.560 . 3.920 3.038 2.544 3.719 . 0 0 "[ . 1 . 2]" 1
488 1 124 ASN HA 1 127 ILE MD 3.530 . 3.880 3.276 2.533 3.882 0.002 14 0 "[ . 1 . 2]" 1
489 1 73 ASN HB2 1 127 ILE MD 4.110 . 4.520 3.964 3.542 4.227 . 0 0 "[ . 1 . 2]" 1
490 1 73 ASN HB3 1 127 ILE MD 3.980 . 4.380 2.740 2.347 3.035 . 0 0 "[ . 1 . 2]" 1
491 1 123 ILE MG 1 127 ILE MD 3.240 . 3.560 2.061 1.871 2.329 . 0 0 "[ . 1 . 2]" 1
492 1 70 TYR HE1 1 127 ILE MD 3.790 . 4.170 3.688 3.349 4.175 0.005 8 0 "[ . 1 . 2]" 1
493 1 70 TYR HD1 1 127 ILE MD 4.050 . 4.460 2.762 2.367 3.075 . 0 0 "[ . 1 . 2]" 1
494 1 74 VAL H 1 127 ILE MD 5.500 . 6.050 4.749 4.498 5.113 . 0 0 "[ . 1 . 2]" 1
495 1 101 MET ME 1 123 ILE HA 2.930 . 3.220 2.196 1.837 3.103 . 0 0 "[ . 1 . 2]" 1
496 1 101 MET ME 1 101 MET HG2 2.700 . 2.970 2.535 2.478 2.585 . 0 0 "[ . 1 . 2]" 1
497 1 101 MET ME 1 123 ILE H 3.450 . 3.790 3.581 3.315 3.794 0.004 19 0 "[ . 1 . 2]" 1
498 1 101 MET ME 1 122 GLU H 4.850 . 5.330 5.136 4.897 5.339 0.009 14 0 "[ . 1 . 2]" 1
499 1 101 MET ME 1 109 SER H 4.560 . 5.020 3.711 3.243 4.209 . 0 0 "[ . 1 . 2]" 1
500 1 112 ILE H 1 112 ILE MD 4.750 . 5.220 3.953 3.798 4.121 . 0 0 "[ . 1 . 2]" 1
501 1 98 THR HA 1 112 ILE MG 4.440 . 4.880 4.060 3.326 4.485 . 0 0 "[ . 1 . 2]" 1
502 1 18 GLY HA2 1 19 PRO HG2 5.500 . 6.050 4.757 4.128 5.870 . 0 0 "[ . 1 . 2]" 1
503 1 18 GLY HA3 1 19 PRO HG2 5.500 . 6.050 5.484 4.550 6.048 . 0 0 "[ . 1 . 2]" 1
504 1 40 ASP H 1 41 ASN HB2 5.450 . 6.000 5.504 5.095 5.727 . 0 0 "[ . 1 . 2]" 1
505 1 122 GLU HB2 1 123 ILE HA 4.640 . 5.100 4.507 4.310 4.753 . 0 0 "[ . 1 . 2]" 1
506 1 63 LEU HA 1 63 LEU MD1 4.480 . 4.930 2.801 1.923 4.134 . 0 0 "[ . 1 . 2]" 1
507 1 63 LEU HA 1 63 LEU MD2 4.480 . 4.930 3.240 2.073 4.063 . 0 0 "[ . 1 . 2]" 1
508 1 88 ALA MB 1 93 VAL MG1 3.840 . 4.220 2.672 1.946 3.596 . 0 0 "[ . 1 . 2]" 1
509 1 93 VAL MG1 1 98 THR MG 3.530 . 3.880 2.672 1.951 3.887 0.007 18 0 "[ . 1 . 2]" 1
510 1 93 VAL MG1 1 98 THR HB 4.670 . 5.140 3.427 2.160 4.668 . 0 0 "[ . 1 . 2]" 1
511 1 77 TYR H 1 77 TYR HD1 5.080 . 5.590 4.799 4.077 5.354 . 0 0 "[ . 1 . 2]" 1
512 1 77 TYR H 1 77 TYR HD2 5.280 . 5.810 3.651 2.959 4.443 . 0 0 "[ . 1 . 2]" 1
513 1 77 TYR HA 1 77 TYR HD1 3.830 . 4.210 2.553 1.844 3.248 . 0 0 "[ . 1 . 2]" 1
514 1 24 GLU HB3 1 77 TYR HD1 3.600 . 3.960 2.365 1.798 3.071 0.002 1 0 "[ . 1 . 2]" 1
515 1 24 GLU HB3 1 77 TYR HE1 3.860 . 4.250 2.555 2.009 3.525 . 0 0 "[ . 1 . 2]" 1
516 1 42 ILE MG 1 77 TYR HE2 5.500 . 6.050 4.836 4.138 5.910 . 0 0 "[ . 1 . 2]" 1
517 1 88 ALA HA 1 91 TYR HE1 5.500 . 6.050 5.503 3.923 6.059 0.009 17 0 "[ . 1 . 2]" 1
518 1 91 TYR H 1 91 TYR HD1 3.720 . 4.090 3.055 2.181 4.061 . 0 0 "[ . 1 . 2]" 1
519 1 70 TYR H 1 70 TYR HD2 3.450 . 3.790 3.792 3.764 3.805 0.015 15 0 "[ . 1 . 2]" 1
520 1 66 LEU HA 1 70 TYR HD1 4.420 . 4.860 3.792 3.489 4.370 . 0 0 "[ . 1 . 2]" 1
521 1 66 LEU HB2 1 70 TYR HD1 4.110 . 4.520 3.557 3.383 3.802 . 0 0 "[ . 1 . 2]" 1
522 1 66 LEU HB3 1 70 TYR HD1 4.110 . 4.520 1.963 1.794 2.225 0.006 3 0 "[ . 1 . 2]" 1
523 1 66 LEU HA 1 70 TYR HE1 4.500 . 4.950 3.912 3.169 4.621 . 0 0 "[ . 1 . 2]" 1
524 1 66 LEU MD1 1 70 TYR HE1 3.580 . 3.940 2.370 1.922 2.863 . 0 0 "[ . 1 . 2]" 1
525 1 66 LEU MD2 1 70 TYR HE1 3.580 . 3.940 2.033 1.820 2.653 . 0 0 "[ . 1 . 2]" 1
526 1 69 GLN HB3 1 70 TYR HE2 4.680 . 5.150 3.951 3.308 4.435 . 0 0 "[ . 1 . 2]" 1
527 1 66 LEU HG 1 70 TYR HE1 4.390 . 4.830 4.478 4.291 4.831 0.001 9 0 "[ . 1 . 2]" 1
528 1 69 GLN HB2 1 70 TYR HE2 4.680 . 5.150 4.225 3.558 4.600 . 0 0 "[ . 1 . 2]" 1
529 1 31 PHE HD1 1 35 VAL HB 4.660 . 5.130 4.616 3.849 5.133 0.003 7 0 "[ . 1 . 2]" 1
530 1 46 VAL MG2 1 102 PHE HE1 5.090 . 5.600 2.926 2.070 4.598 . 0 0 "[ . 1 . 2]" 1
531 1 91 TYR HE1 1 102 PHE HZ 4.070 . 4.480 4.291 3.072 4.489 0.009 6 0 "[ . 1 . 2]" 1
532 1 18 GLY H 1 19 PRO HD2 4.810 . 5.290 3.378 1.946 4.713 . 0 0 "[ . 1 . 2]" 1
533 1 18 GLY H 1 19 PRO HD3 4.810 . 5.290 2.893 2.120 3.714 . 0 0 "[ . 1 . 2]" 1
534 1 18 GLY H 1 19 PRO HG2 5.050 . 5.560 5.065 3.841 5.575 0.015 12 0 "[ . 1 . 2]" 1
535 1 18 GLY H 1 19 PRO HG3 5.420 . 5.960 4.808 4.109 5.320 . 0 0 "[ . 1 . 2]" 1
536 1 20 GLY H 1 21 SER H 4.120 . 4.530 3.154 1.795 4.552 0.022 20 0 "[ . 1 . 2]" 1
537 1 19 PRO HA 1 20 GLY H 3.040 . 3.340 2.467 2.166 3.347 0.007 18 0 "[ . 1 . 2]" 1
538 1 19 PRO HG2 1 20 GLY H 4.900 . 5.390 4.503 3.150 5.056 . 0 0 "[ . 1 . 2]" 1
539 1 21 SER H 1 22 MET H 4.750 . 5.220 4.063 2.344 4.638 . 0 0 "[ . 1 . 2]" 1
540 1 22 MET H 1 23 ILE H 3.590 . 3.950 2.510 1.793 3.952 0.007 1 0 "[ . 1 . 2]" 1
541 1 23 ILE H 1 24 GLU H 4.480 . 4.930 4.129 3.675 4.480 . 0 0 "[ . 1 . 2]" 1
542 1 23 ILE H 1 24 GLU HB2 4.900 . 5.390 4.904 4.188 5.395 0.005 7 0 "[ . 1 . 2]" 1
543 1 23 ILE H 1 23 ILE HB 3.150 . 3.470 2.720 2.557 2.797 . 0 0 "[ . 1 . 2]" 1
544 1 23 ILE H 1 23 ILE HG12 3.800 . 4.180 3.105 2.136 4.082 . 0 0 "[ . 1 . 2]" 1
545 1 23 ILE H 1 23 ILE HG13 3.800 . 4.180 3.310 2.532 4.054 . 0 0 "[ . 1 . 2]" 1
546 1 24 GLU H 1 25 GLN H 4.660 . 5.130 4.453 4.162 4.610 . 0 0 "[ . 1 . 2]" 1
547 1 24 GLU H 1 77 TYR HA 4.220 . 4.640 2.796 2.322 3.190 . 0 0 "[ . 1 . 2]" 1
548 1 23 ILE HA 1 24 GLU H 2.970 . 3.270 2.204 2.113 2.337 . 0 0 "[ . 1 . 2]" 1
549 1 24 GLU H 1 24 GLU HB3 3.260 . 3.590 2.653 2.411 3.235 . 0 0 "[ . 1 . 2]" 1
550 1 24 GLU H 1 24 GLU HB2 3.580 . 3.940 2.953 2.531 3.225 . 0 0 "[ . 1 . 2]" 1
551 1 23 ILE HB 1 24 GLU H 4.270 . 4.700 4.282 4.063 4.446 . 0 0 "[ . 1 . 2]" 1
552 1 24 GLU H 1 76 ILE MG 4.830 . 5.310 3.888 2.889 4.405 . 0 0 "[ . 1 . 2]" 1
553 1 23 ILE MG 1 24 GLU H 3.420 . 3.760 3.122 2.655 3.685 . 0 0 "[ . 1 . 2]" 1
554 1 24 GLU HA 1 25 GLN H 2.980 . 3.280 2.263 2.139 2.358 . 0 0 "[ . 1 . 2]" 1
555 1 25 GLN H 1 25 GLN HG2 4.170 . 4.590 2.835 1.897 4.375 . 0 0 "[ . 1 . 2]" 1
556 1 24 GLU HG2 1 25 GLN H 3.910 . 4.300 3.763 2.760 4.306 0.006 11 0 "[ . 1 . 2]" 1
557 1 24 GLU HG3 1 25 GLN H 3.910 . 4.300 2.645 2.182 3.600 . 0 0 "[ . 1 . 2]" 1
558 1 24 GLU HB3 1 25 GLN H 3.980 . 4.380 3.905 3.380 4.335 . 0 0 "[ . 1 . 2]" 1
559 1 25 GLN H 1 26 ILE MG 4.860 . 5.350 4.204 3.566 4.659 . 0 0 "[ . 1 . 2]" 1
560 1 25 GLN HA 1 26 ILE H 3.160 . 3.480 2.210 2.126 2.289 . 0 0 "[ . 1 . 2]" 1
561 1 25 GLN HB2 1 26 ILE H 4.440 . 4.880 3.259 2.779 4.236 . 0 0 "[ . 1 . 2]" 1
562 1 25 GLN HB3 1 26 ILE H 4.440 . 4.880 3.968 2.850 4.247 . 0 0 "[ . 1 . 2]" 1
563 1 26 ILE H 1 26 ILE HG13 3.840 . 4.220 3.023 2.906 3.148 . 0 0 "[ . 1 . 2]" 1
564 1 26 ILE H 1 26 ILE HG12 3.800 . 4.180 2.280 2.065 2.425 . 0 0 "[ . 1 . 2]" 1
565 1 26 ILE H 1 26 ILE MG 3.700 . 4.070 2.972 2.837 3.104 . 0 0 "[ . 1 . 2]" 1
566 1 26 ILE H 1 27 GLY H 4.870 . 5.360 4.432 4.385 4.488 . 0 0 "[ . 1 . 2]" 1
567 1 27 GLY H 1 30 GLU H 4.490 . 4.940 3.954 3.621 4.335 . 0 0 "[ . 1 . 2]" 1
568 1 26 ILE HB 1 27 GLY H 3.430 . 3.770 2.253 1.923 2.693 . 0 0 "[ . 1 . 2]" 1
569 1 26 ILE HG13 1 27 GLY H 4.550 . 5.010 3.537 3.163 3.984 . 0 0 "[ . 1 . 2]" 1
570 1 26 ILE HG12 1 27 GLY H 4.850 . 5.330 4.568 4.311 4.873 . 0 0 "[ . 1 . 2]" 1
571 1 26 ILE MG 1 27 GLY H 3.770 . 4.150 3.591 3.480 3.778 . 0 0 "[ . 1 . 2]" 1
572 1 26 ILE MD 1 27 GLY H 4.340 . 4.770 4.098 3.679 4.566 . 0 0 "[ . 1 . 2]" 1
573 1 28 ASP H 1 29 SER H 3.770 . 4.150 2.648 2.530 2.861 . 0 0 "[ . 1 . 2]" 1
574 1 28 ASP H 1 30 GLU H 4.030 . 4.430 4.257 4.044 4.435 0.005 19 0 "[ . 1 . 2]" 1
575 1 27 GLY HA3 1 28 ASP H 3.500 . 3.850 2.637 2.364 2.916 . 0 0 "[ . 1 . 2]" 1
576 1 27 GLY HA2 1 28 ASP H 3.260 . 3.590 2.467 2.253 2.710 . 0 0 "[ . 1 . 2]" 1
577 1 30 GLU H 1 32 ASP H 5.220 . 5.740 5.134 4.819 5.433 . 0 0 "[ . 1 . 2]" 1
578 1 29 SER H 1 30 GLU H 3.510 . 3.860 2.592 2.415 2.766 . 0 0 "[ . 1 . 2]" 1
579 1 30 GLU H 1 31 PHE H 2.890 . 3.180 2.222 1.930 2.563 . 0 0 "[ . 1 . 2]" 1
580 1 27 GLY HA3 1 30 GLU H 3.770 . 4.150 3.803 3.390 4.152 0.002 13 0 "[ . 1 . 2]" 1
581 1 30 GLU H 1 31 PHE HA 4.670 . 5.140 4.601 4.300 4.932 . 0 0 "[ . 1 . 2]" 1
582 1 30 GLU H 1 33 ASN HB2 4.550 . 5.010 4.959 4.382 5.028 0.018 9 0 "[ . 1 . 2]" 1
583 1 30 GLU H 1 33 ASN HB3 5.200 . 5.720 4.937 4.607 5.732 0.012 18 0 "[ . 1 . 2]" 1
584 1 30 GLU H 1 30 GLU HG3 3.810 . 4.190 3.348 2.520 3.757 . 0 0 "[ . 1 . 2]" 1
585 1 26 ILE MD 1 30 GLU H 4.940 . 5.430 5.141 4.658 5.432 0.002 11 0 "[ . 1 . 2]" 1
586 1 29 SER H 1 31 PHE H 4.680 . 5.150 3.810 3.648 4.032 . 0 0 "[ . 1 . 2]" 1
587 1 27 GLY H 1 31 PHE H 5.160 . 5.680 4.566 3.860 5.384 . 0 0 "[ . 1 . 2]" 1
588 1 31 PHE H 1 31 PHE HD1 5.160 . 5.680 4.698 4.629 4.787 . 0 0 "[ . 1 . 2]" 1
589 1 31 PHE H 1 31 PHE HD2 5.500 . 6.050 4.748 4.633 4.835 . 0 0 "[ . 1 . 2]" 1
590 1 28 ASP HA 1 31 PHE H 4.060 . 4.470 3.496 2.978 3.916 . 0 0 "[ . 1 . 2]" 1
591 1 29 SER HA 1 31 PHE H 4.710 . 5.180 4.103 3.823 4.383 . 0 0 "[ . 1 . 2]" 1
592 1 31 PHE H 1 33 ASN HB2 4.800 . 5.280 4.756 4.084 5.022 . 0 0 "[ . 1 . 2]" 1
593 1 31 PHE H 1 33 ASN HB3 5.190 . 5.710 4.721 4.366 5.652 . 0 0 "[ . 1 . 2]" 1
594 1 31 PHE H 1 34 LYS HD3 5.270 . 5.800 5.416 5.093 5.728 . 0 0 "[ . 1 . 2]" 1
595 1 26 ILE MD 1 31 PHE H 4.190 . 4.610 3.944 3.702 4.194 . 0 0 "[ . 1 . 2]" 1
596 1 32 ASP H 1 33 ASN H 3.170 . 3.490 2.562 2.448 2.763 . 0 0 "[ . 1 . 2]" 1
597 1 32 ASP H 1 35 VAL H 4.520 . 4.970 4.718 4.628 4.833 . 0 0 "[ . 1 . 2]" 1
598 1 31 PHE H 1 32 ASP H 3.540 . 3.890 3.196 3.121 3.259 . 0 0 "[ . 1 . 2]" 1
599 1 31 PHE HD2 1 32 ASP H 3.800 . 4.180 2.645 2.487 2.883 . 0 0 "[ . 1 . 2]" 1
600 1 32 ASP H 1 33 ASN HA 5.170 . 5.690 5.137 5.048 5.319 . 0 0 "[ . 1 . 2]" 1
601 1 32 ASP H 1 33 ASN HB2 4.470 . 4.920 4.610 4.215 4.878 . 0 0 "[ . 1 . 2]" 1
602 1 32 ASP H 1 36 THR MG 4.820 . 5.300 4.723 4.372 4.986 . 0 0 "[ . 1 . 2]" 1
603 1 26 ILE MD 1 32 ASP H 5.030 . 5.530 4.983 4.855 5.093 . 0 0 "[ . 1 . 2]" 1
604 1 34 LYS H 1 34 LYS HB3 3.780 . 4.160 2.932 2.812 3.025 . 0 0 "[ . 1 . 2]" 1
605 1 33 ASN H 1 35 VAL H 4.300 . 4.730 3.961 3.897 4.043 . 0 0 "[ . 1 . 2]" 1
606 1 32 ASP HA 1 35 VAL H 4.360 . 4.800 3.419 3.158 3.757 . 0 0 "[ . 1 . 2]" 1
607 1 31 PHE HA 1 35 VAL H 4.690 . 5.160 4.209 3.996 4.346 . 0 0 "[ . 1 . 2]" 1
608 1 33 ASN HB3 1 35 VAL H 5.500 . 6.050 4.697 4.428 5.248 . 0 0 "[ . 1 . 2]" 1
609 1 34 LYS HB3 1 35 VAL H 4.670 . 5.140 4.201 4.095 4.289 . 0 0 "[ . 1 . 2]" 1
610 1 35 VAL H 1 44 ILE MD 5.050 . 5.560 4.336 4.087 4.784 . 0 0 "[ . 1 . 2]" 1
611 1 35 VAL H 1 35 VAL HB 3.520 . 3.870 2.472 2.406 2.526 . 0 0 "[ . 1 . 2]" 1
612 1 35 VAL H 1 35 VAL MG1 4.380 . 4.820 3.791 3.758 3.813 . 0 0 "[ . 1 . 2]" 1
613 1 35 VAL H 1 35 VAL MG2 4.380 . 4.820 2.463 2.375 2.534 . 0 0 "[ . 1 . 2]" 1
614 1 35 VAL H 1 36 THR H 3.240 . 3.560 2.563 2.492 2.732 . 0 0 "[ . 1 . 2]" 1
615 1 32 ASP HA 1 36 THR H 3.430 . 3.770 2.522 2.283 2.956 . 0 0 "[ . 1 . 2]" 1
616 1 36 THR H 1 36 THR HB 3.850 . 4.230 3.612 2.683 3.706 . 0 0 "[ . 1 . 2]" 1
617 1 36 THR H 1 36 THR MG 3.320 . 3.650 2.456 2.151 2.638 . 0 0 "[ . 1 . 2]" 1
618 1 35 VAL HB 1 36 THR H 3.120 . 3.430 2.529 2.408 2.635 . 0 0 "[ . 1 . 2]" 1
619 1 35 VAL MG1 1 36 THR H 3.870 . 4.260 3.167 2.957 3.377 . 0 0 "[ . 1 . 2]" 1
620 1 35 VAL MG2 1 36 THR H 3.870 . 4.260 3.912 3.879 3.965 . 0 0 "[ . 1 . 2]" 1
621 1 32 ASP H 1 36 THR H 5.220 . 5.740 5.069 4.858 5.338 . 0 0 "[ . 1 . 2]" 1
622 1 35 VAL H 1 37 SER H 4.160 . 4.580 3.676 3.498 3.877 . 0 0 "[ . 1 . 2]" 1
623 1 36 THR H 1 37 SER H 3.360 . 3.700 2.341 2.237 2.480 . 0 0 "[ . 1 . 2]" 1
624 1 32 ASP HA 1 37 SER H 4.560 . 5.020 4.394 4.071 4.945 . 0 0 "[ . 1 . 2]" 1
625 1 33 ASN HA 1 37 SER H 4.640 . 5.100 4.362 4.078 4.959 . 0 0 "[ . 1 . 2]" 1
626 1 37 SER H 1 37 SER HB2 3.700 . 4.070 2.613 2.478 3.575 . 0 0 "[ . 1 . 2]" 1
627 1 37 SER H 1 37 SER HB3 3.700 . 4.070 3.357 2.456 3.692 . 0 0 "[ . 1 . 2]" 1
628 1 36 THR MG 1 37 SER H 4.190 . 4.610 3.962 3.070 4.145 . 0 0 "[ . 1 . 2]" 1
629 1 35 VAL HB 1 37 SER H 4.550 . 5.010 4.701 4.563 4.955 . 0 0 "[ . 1 . 2]" 1
630 1 37 SER H 1 38 CYS H 3.120 . 3.430 2.648 2.292 2.817 . 0 0 "[ . 1 . 2]" 1
631 1 38 CYS H 1 39 ASN H 4.560 . 5.020 4.227 4.094 4.416 . 0 0 "[ . 1 . 2]" 1
632 1 38 CYS H 1 105 GLY H 5.020 . 5.520 4.090 3.746 4.463 . 0 0 "[ . 1 . 2]" 1
633 1 38 CYS H 1 40 ASP H 5.500 . 6.050 5.427 5.182 5.727 . 0 0 "[ . 1 . 2]" 1
634 1 37 SER HA 1 38 CYS H 3.390 . 3.730 3.167 3.118 3.312 . 0 0 "[ . 1 . 2]" 1
635 1 36 THR HA 1 38 CYS H 4.020 . 4.420 3.477 3.332 3.603 . 0 0 "[ . 1 . 2]" 1
636 1 38 CYS H 1 38 CYS HB2 3.260 . 3.590 2.644 2.513 3.593 0.003 6 0 "[ . 1 . 2]" 1
637 1 38 CYS H 1 38 CYS HB3 3.260 . 3.590 2.522 2.429 2.700 . 0 0 "[ . 1 . 2]" 1
638 1 38 CYS H 1 44 ILE MD 4.180 . 4.600 3.938 3.679 4.344 . 0 0 "[ . 1 . 2]" 1
639 1 35 VAL MG2 1 38 CYS H 5.500 . 6.050 5.720 5.517 6.047 . 0 0 "[ . 1 . 2]" 1
640 1 35 VAL MG1 1 38 CYS H 5.500 . 6.050 4.770 4.553 5.010 . 0 0 "[ . 1 . 2]" 1
641 1 35 VAL HB 1 38 CYS H 5.500 . 6.050 5.695 5.478 6.051 0.001 6 0 "[ . 1 . 2]" 1
642 1 39 ASN H 1 39 ASN HB2 3.650 . 4.020 3.092 2.354 3.720 . 0 0 "[ . 1 . 2]" 1
643 1 39 ASN H 1 39 ASN HB3 3.650 . 4.020 2.808 2.488 3.732 . 0 0 "[ . 1 . 2]" 1
644 1 39 ASN H 1 41 ASN H 5.230 . 5.750 4.403 4.180 4.701 . 0 0 "[ . 1 . 2]" 1
645 1 40 ASP H 1 41 ASN H 3.230 . 3.550 2.590 2.356 2.790 . 0 0 "[ . 1 . 2]" 1
646 1 40 ASP H 1 104 ASN H 5.330 . 5.860 5.097 4.405 5.860 0.000 14 0 "[ . 1 . 2]" 1
647 1 39 ASN H 1 40 ASP H 3.580 . 3.940 2.396 2.013 2.652 . 0 0 "[ . 1 . 2]" 1
648 1 39 ASN HA 1 40 ASP H 3.200 . 3.520 3.260 3.080 3.442 . 0 0 "[ . 1 . 2]" 1
649 1 40 ASP H 1 41 ASN HA 4.610 . 5.070 4.818 4.553 5.057 . 0 0 "[ . 1 . 2]" 1
650 1 40 ASP H 1 40 ASP HB2 3.880 . 4.270 2.525 2.357 2.707 . 0 0 "[ . 1 . 2]" 1
651 1 40 ASP H 1 40 ASP HB3 3.880 . 4.270 3.441 2.514 3.641 . 0 0 "[ . 1 . 2]" 1
652 1 40 ASP H 1 44 ILE MD 5.280 . 5.810 5.115 3.721 5.660 . 0 0 "[ . 1 . 2]" 1
653 1 41 ASN H 1 41 ASN HD22 4.810 . 5.290 4.533 3.710 5.314 0.024 11 0 "[ . 1 . 2]" 1
654 1 39 ASN HA 1 41 ASN H 4.560 . 5.020 3.414 3.087 3.857 . 0 0 "[ . 1 . 2]" 1
655 1 41 ASN H 1 41 ASN HB2 4.110 . 4.520 3.459 3.021 3.605 . 0 0 "[ . 1 . 2]" 1
656 1 41 ASN H 1 42 ILE H 3.640 . 4.000 2.628 2.474 2.821 . 0 0 "[ . 1 . 2]" 1
657 1 42 ILE H 1 43 LEU H 4.570 . 5.030 4.602 4.515 4.670 . 0 0 "[ . 1 . 2]" 1
658 1 40 ASP H 1 42 ILE H 3.820 . 4.200 3.961 3.495 4.205 0.005 19 0 "[ . 1 . 2]" 1
659 1 40 ASP HA 1 42 ILE H 4.440 . 4.880 4.238 3.906 4.528 . 0 0 "[ . 1 . 2]" 1
660 1 41 ASN HB2 1 42 ILE H 4.720 . 5.190 3.962 3.719 4.293 . 0 0 "[ . 1 . 2]" 1
661 1 41 ASN HB3 1 42 ILE H 5.130 . 5.640 4.287 3.765 4.404 . 0 0 "[ . 1 . 2]" 1
662 1 40 ASP HB2 1 42 ILE H 4.660 . 5.130 2.834 2.123 4.522 . 0 0 "[ . 1 . 2]" 1
663 1 40 ASP HB3 1 42 ILE H 4.660 . 5.130 3.222 2.393 3.824 . 0 0 "[ . 1 . 2]" 1
664 1 42 ILE H 1 42 ILE MD 4.300 . 4.730 4.392 3.870 4.515 . 0 0 "[ . 1 . 2]" 1
665 1 106 LYS H 1 107 LYS H 5.060 . 5.570 4.483 4.319 4.587 . 0 0 "[ . 1 . 2]" 1
666 1 43 LEU H 1 75 LYS H 4.850 . 5.330 4.463 4.132 4.651 . 0 0 "[ . 1 . 2]" 1
667 1 42 ILE HA 1 43 LEU H 3.050 . 3.360 2.359 2.200 2.518 . 0 0 "[ . 1 . 2]" 1
668 1 43 LEU H 1 43 LEU HB2 3.500 . 3.850 2.686 2.391 2.841 . 0 0 "[ . 1 . 2]" 1
669 1 42 ILE HB 1 43 LEU H 4.380 . 4.820 4.079 3.952 4.188 . 0 0 "[ . 1 . 2]" 1
670 1 43 LEU H 1 43 LEU HB3 3.500 . 3.850 2.582 2.416 3.627 . 0 0 "[ . 1 . 2]" 1
671 1 43 LEU H 1 74 VAL MG1 3.430 . 3.770 3.753 3.657 3.778 0.008 15 0 "[ . 1 . 2]" 1
672 1 103 LYS H 1 108 LEU H 5.010 . 5.510 4.509 4.071 4.799 . 0 0 "[ . 1 . 2]" 1
673 1 102 PHE HA 1 108 LEU H 3.830 . 4.210 3.239 2.982 3.572 . 0 0 "[ . 1 . 2]" 1
674 1 107 LYS HA 1 108 LEU H 3.240 . 3.560 2.167 2.116 2.240 . 0 0 "[ . 1 . 2]" 1
675 1 101 MET HB3 1 108 LEU H 3.920 . 4.310 3.936 3.375 4.315 0.005 9 0 "[ . 1 . 2]" 1
676 1 108 LEU H 1 108 LEU HB2 3.830 . 4.210 2.519 2.418 2.582 . 0 0 "[ . 1 . 2]" 1
677 1 108 LEU H 1 108 LEU HB3 3.760 . 4.140 3.665 3.614 3.715 . 0 0 "[ . 1 . 2]" 1
678 1 45 LEU H 1 77 TYR H 4.460 . 4.910 3.959 3.431 4.403 . 0 0 "[ . 1 . 2]" 1
679 1 45 LEU H 1 75 LYS H 4.170 . 4.590 3.396 3.028 3.638 . 0 0 "[ . 1 . 2]" 1
680 1 44 ILE HA 1 45 LEU H 3.110 . 3.420 2.142 2.101 2.192 . 0 0 "[ . 1 . 2]" 1
681 1 44 ILE HB 1 45 LEU H 4.370 . 4.810 4.312 4.092 4.459 . 0 0 "[ . 1 . 2]" 1
682 1 45 LEU H 1 45 LEU HB2 3.850 . 4.230 2.570 2.435 2.682 . 0 0 "[ . 1 . 2]" 1
683 1 45 LEU H 1 45 LEU HB3 3.850 . 4.230 3.705 3.628 3.784 . 0 0 "[ . 1 . 2]" 1
684 1 44 ILE MG 1 45 LEU H 3.410 . 3.750 2.855 2.452 3.210 . 0 0 "[ . 1 . 2]" 1
685 1 45 LEU HA 1 46 VAL H 3.090 . 3.400 2.185 2.168 2.209 . 0 0 "[ . 1 . 2]" 1
686 1 46 VAL H 1 102 PHE H 5.250 . 5.780 4.205 3.818 4.594 . 0 0 "[ . 1 . 2]" 1
687 1 46 VAL H 1 101 MET HA 4.350 . 4.790 3.595 3.365 3.942 . 0 0 "[ . 1 . 2]" 1
688 1 46 VAL H 1 99 ILE HA 5.050 . 5.560 4.645 4.191 5.016 . 0 0 "[ . 1 . 2]" 1
689 1 46 VAL H 1 46 VAL HB 3.670 . 4.040 3.264 2.515 3.839 . 0 0 "[ . 1 . 2]" 1
690 1 45 LEU HB2 1 46 VAL H 4.650 . 5.120 4.372 4.088 4.451 . 0 0 "[ . 1 . 2]" 1
691 1 45 LEU HB3 1 46 VAL H 4.650 . 5.120 3.729 3.090 3.858 . 0 0 "[ . 1 . 2]" 1
692 1 46 VAL H 1 46 VAL MG2 3.660 . 4.030 2.156 1.929 2.522 . 0 0 "[ . 1 . 2]" 1
693 1 46 VAL H 1 99 ILE MG 3.490 . 3.840 3.137 2.679 3.658 . 0 0 "[ . 1 . 2]" 1
694 1 46 VAL HA 1 47 ASP H 3.450 . 3.790 2.161 2.113 2.212 . 0 0 "[ . 1 . 2]" 1
695 1 47 ASP H 1 47 ASP HB2 3.910 . 4.300 3.360 2.310 3.846 . 0 0 "[ . 1 . 2]" 1
696 1 47 ASP H 1 47 ASP HB3 3.910 . 4.300 2.794 2.301 3.610 . 0 0 "[ . 1 . 2]" 1
697 1 46 VAL MG2 1 47 ASP H 5.130 . 5.640 4.100 3.900 4.222 . 0 0 "[ . 1 . 2]" 1
698 1 46 VAL MG1 1 47 ASP H 5.300 . 5.830 3.547 2.753 4.104 . 0 0 "[ . 1 . 2]" 1
699 1 47 ASP H 1 99 ILE MD 5.500 . 6.050 5.721 5.084 5.979 . 0 0 "[ . 1 . 2]" 1
700 1 47 ASP H 1 76 ILE MG 4.300 . 4.730 3.542 3.127 4.242 . 0 0 "[ . 1 . 2]" 1
701 1 62 GLN H 1 63 LEU H 3.360 . 3.700 2.813 2.504 3.035 . 0 0 "[ . 1 . 2]" 1
702 1 61 PRO HD2 1 62 GLN H 5.500 . 6.050 5.464 5.222 5.671 . 0 0 "[ . 1 . 2]" 1
703 1 62 GLN H 1 62 GLN HG3 3.520 . 3.870 2.617 2.142 2.888 . 0 0 "[ . 1 . 2]" 1
704 1 61 PRO HB2 1 62 GLN H 3.290 . 3.620 2.547 2.063 2.874 . 0 0 "[ . 1 . 2]" 1
705 1 61 PRO HG2 1 62 GLN H 4.080 . 4.490 4.308 3.854 4.501 0.011 7 0 "[ . 1 . 2]" 1
706 1 61 PRO HB3 1 62 GLN H 4.130 . 4.540 3.475 3.234 3.722 . 0 0 "[ . 1 . 2]" 1
707 1 62 GLN H 1 111 VAL MG1 5.350 . 5.890 5.381 4.743 5.880 . 0 0 "[ . 1 . 2]" 1
708 1 62 GLN H 1 116 ILE MD 5.500 . 6.050 4.362 3.925 4.807 . 0 0 "[ . 1 . 2]" 1
709 1 61 PRO HA 1 63 LEU H 5.060 . 5.570 4.592 3.969 4.865 . 0 0 "[ . 1 . 2]" 1
710 1 62 GLN HG3 1 63 LEU H 4.410 . 4.850 4.569 4.269 4.704 . 0 0 "[ . 1 . 2]" 1
711 1 62 GLN HB2 1 63 LEU H 3.700 . 4.070 2.387 2.184 2.747 . 0 0 "[ . 1 . 2]" 1
712 1 61 PRO HG2 1 63 LEU H 4.060 . 4.470 3.820 3.107 4.384 . 0 0 "[ . 1 . 2]" 1
713 1 63 LEU H 1 111 VAL MG1 5.150 . 5.670 5.115 4.556 5.668 . 0 0 "[ . 1 . 2]" 1
714 1 63 LEU H 1 119 ILE MD 5.500 . 6.050 4.405 4.018 4.624 . 0 0 "[ . 1 . 2]" 1
715 1 63 LEU H 1 67 ALA MB 5.500 . 6.050 5.729 5.611 5.842 . 0 0 "[ . 1 . 2]" 1
716 1 61 PRO HB3 1 63 LEU H 4.790 . 5.270 4.676 4.187 4.999 . 0 0 "[ . 1 . 2]" 1
717 1 64 GLU H 1 65 LYS H 3.780 . 4.160 2.526 2.421 2.718 . 0 0 "[ . 1 . 2]" 1
718 1 61 PRO HB2 1 64 GLU H 3.970 . 4.370 3.573 3.215 3.996 . 0 0 "[ . 1 . 2]" 1
719 1 64 GLU H 1 64 GLU HG2 4.430 . 4.870 3.591 3.304 4.460 . 0 0 "[ . 1 . 2]" 1
720 1 64 GLU H 1 64 GLU HG3 4.430 . 4.870 2.764 2.335 4.511 . 0 0 "[ . 1 . 2]" 1
721 1 61 PRO HG2 1 64 GLU H 3.550 . 3.900 2.500 2.138 2.956 . 0 0 "[ . 1 . 2]" 1
722 1 64 GLU H 1 67 ALA MB 5.140 . 5.650 4.262 4.053 4.587 . 0 0 "[ . 1 . 2]" 1
723 1 63 LEU MD1 1 64 GLU H 5.270 . 5.800 3.992 1.803 4.664 . 0 0 "[ . 1 . 2]" 1
724 1 63 LEU MD2 1 64 GLU H 5.270 . 5.800 4.003 2.027 4.580 . 0 0 "[ . 1 . 2]" 1
725 1 64 GLU H 1 66 LEU H 4.850 . 5.330 4.363 4.185 4.478 . 0 0 "[ . 1 . 2]" 1
726 1 64 GLU HG2 1 65 LYS H 5.500 . 6.050 4.933 3.831 5.115 . 0 0 "[ . 1 . 2]" 1
727 1 64 GLU HB2 1 65 LYS H 4.290 . 4.720 2.862 2.397 3.777 . 0 0 "[ . 1 . 2]" 1
728 1 64 GLU HB3 1 65 LYS H 4.290 . 4.720 3.542 2.499 3.825 . 0 0 "[ . 1 . 2]" 1
729 1 64 GLU HG3 1 65 LYS H 5.500 . 6.050 4.510 4.284 5.186 . 0 0 "[ . 1 . 2]" 1
730 1 65 LYS H 1 65 LYS HD2 5.110 . 5.620 4.760 4.117 5.320 . 0 0 "[ . 1 . 2]" 1
731 1 65 LYS H 1 66 LEU H 3.470 . 3.820 2.857 2.738 2.973 . 0 0 "[ . 1 . 2]" 1
732 1 63 LEU HA 1 66 LEU H 4.140 . 4.550 3.829 3.620 4.041 . 0 0 "[ . 1 . 2]" 1
733 1 65 LYS HG2 1 66 LEU H 5.500 . 6.050 4.709 4.380 5.003 . 0 0 "[ . 1 . 2]" 1
734 1 65 LYS HG3 1 66 LEU H 5.500 . 6.050 4.462 3.383 5.006 . 0 0 "[ . 1 . 2]" 1
735 1 66 LEU H 1 67 ALA HA 5.290 . 5.820 5.096 4.995 5.165 . 0 0 "[ . 1 . 2]" 1
736 1 67 ALA H 1 68 GLN H 3.280 . 3.610 2.725 2.659 2.804 . 0 0 "[ . 1 . 2]" 1
737 1 66 LEU H 1 67 ALA H 3.270 . 3.600 2.489 2.386 2.561 . 0 0 "[ . 1 . 2]" 1
738 1 67 ALA H 1 69 GLN H 4.950 . 5.440 4.255 4.133 4.382 . 0 0 "[ . 1 . 2]" 1
739 1 67 ALA H 1 70 TYR H 5.400 . 5.940 4.705 4.543 4.914 . 0 0 "[ . 1 . 2]" 1
740 1 65 LYS H 1 67 ALA H 4.370 . 4.810 4.003 3.778 4.371 . 0 0 "[ . 1 . 2]" 1
741 1 67 ALA H 1 68 GLN HB2 4.640 . 5.100 4.872 4.710 5.075 . 0 0 "[ . 1 . 2]" 1
742 1 67 ALA H 1 67 ALA MB 2.770 . 3.050 2.252 2.231 2.268 . 0 0 "[ . 1 . 2]" 1
743 1 67 ALA H 1 74 VAL MG2 3.990 . 4.390 4.015 3.688 4.236 . 0 0 "[ . 1 . 2]" 1
744 1 68 GLN H 1 69 GLN H 3.100 . 3.410 2.735 2.598 2.837 . 0 0 "[ . 1 . 2]" 1
745 1 66 LEU H 1 68 GLN H 3.880 . 4.270 4.232 4.097 4.280 0.010 20 0 "[ . 1 . 2]" 1
746 1 66 LEU HA 1 68 GLN H 4.190 . 4.610 4.168 3.914 4.391 . 0 0 "[ . 1 . 2]" 1
747 1 64 GLU HA 1 68 GLN H 4.260 . 4.690 3.795 3.318 4.255 . 0 0 "[ . 1 . 2]" 1
748 1 68 GLN H 1 68 GLN HG3 3.310 . 3.640 2.257 2.036 2.448 . 0 0 "[ . 1 . 2]" 1
749 1 68 GLN H 1 68 GLN HG2 4.360 . 4.800 3.526 3.161 3.724 . 0 0 "[ . 1 . 2]" 1
750 1 68 GLN H 1 68 GLN HB2 2.820 . 3.100 2.478 2.386 2.642 . 0 0 "[ . 1 . 2]" 1
751 1 67 ALA MB 1 68 GLN H 3.250 . 3.580 2.682 2.435 2.845 . 0 0 "[ . 1 . 2]" 1
752 1 68 GLN H 1 74 VAL MG2 5.150 . 5.670 5.066 4.890 5.294 . 0 0 "[ . 1 . 2]" 1
753 1 68 GLN H 1 76 ILE MD 5.500 . 6.050 5.400 5.100 5.645 . 0 0 "[ . 1 . 2]" 1
754 1 69 GLN H 1 71 THR H 4.650 . 5.120 3.962 3.851 4.149 . 0 0 "[ . 1 . 2]" 1
755 1 66 LEU HA 1 69 GLN H 3.800 . 4.180 3.614 3.435 3.815 . 0 0 "[ . 1 . 2]" 1
756 1 68 GLN HB2 1 69 GLN H 3.480 . 3.830 2.831 2.606 2.945 . 0 0 "[ . 1 . 2]" 1
757 1 68 GLN HB3 1 69 GLN H 4.000 . 4.400 3.742 3.593 3.880 . 0 0 "[ . 1 . 2]" 1
758 1 69 GLN H 1 69 GLN HB2 3.700 . 4.070 2.536 2.412 2.663 . 0 0 "[ . 1 . 2]" 1
759 1 69 GLN H 1 69 GLN HB3 3.700 . 4.070 3.655 3.631 3.672 . 0 0 "[ . 1 . 2]" 1
760 1 67 ALA MB 1 69 GLN H 4.810 . 5.290 4.430 4.323 4.544 . 0 0 "[ . 1 . 2]" 1
761 1 68 GLN HG3 1 69 GLN H 5.180 . 5.700 4.454 4.236 4.616 . 0 0 "[ . 1 . 2]" 1
762 1 68 GLN H 1 70 TYR H 4.260 . 4.690 4.305 4.069 4.542 . 0 0 "[ . 1 . 2]" 1
763 1 66 LEU HA 1 70 TYR H 4.440 . 4.880 4.151 3.888 4.403 . 0 0 "[ . 1 . 2]" 1
764 1 70 TYR H 1 70 TYR HB2 3.880 . 4.270 2.561 2.490 2.730 . 0 0 "[ . 1 . 2]" 1
765 1 70 TYR H 1 70 TYR HB3 3.880 . 4.270 3.651 3.617 3.711 . 0 0 "[ . 1 . 2]" 1
766 1 69 GLN HB2 1 70 TYR H 3.730 . 4.100 2.431 2.192 2.722 . 0 0 "[ . 1 . 2]" 1
767 1 70 TYR H 1 71 THR MG 5.500 . 6.050 4.510 4.309 4.761 . 0 0 "[ . 1 . 2]" 1
768 1 70 TYR H 1 74 VAL MG1 5.420 . 5.960 4.927 4.532 5.424 . 0 0 "[ . 1 . 2]" 1
769 1 70 TYR H 1 127 ILE MD 5.500 . 6.050 4.839 4.598 5.021 . 0 0 "[ . 1 . 2]" 1
770 1 71 THR H 1 72 GLU H 3.280 . 3.610 2.828 2.719 2.935 . 0 0 "[ . 1 . 2]" 1
771 1 70 TYR H 1 71 THR H 3.170 . 3.490 2.825 2.631 3.014 . 0 0 "[ . 1 . 2]" 1
772 1 71 THR H 1 71 THR HB 3.030 . 3.330 2.550 2.438 2.647 . 0 0 "[ . 1 . 2]" 1
773 1 69 GLN HA 1 71 THR H 3.990 . 4.390 4.047 3.844 4.271 . 0 0 "[ . 1 . 2]" 1
774 1 71 THR H 1 71 THR MG 2.990 . 3.290 2.113 1.994 2.340 . 0 0 "[ . 1 . 2]" 1
775 1 67 ALA MB 1 71 THR H 4.600 . 5.060 4.544 4.063 5.063 0.003 4 0 "[ . 1 . 2]" 1
776 1 72 GLU H 1 73 ASN H 3.090 . 3.400 2.593 2.514 2.731 . 0 0 "[ . 1 . 2]" 1
777 1 72 GLU H 1 74 VAL H 4.100 . 4.510 3.957 3.826 4.133 . 0 0 "[ . 1 . 2]" 1
778 1 70 TYR HA 1 72 GLU H 4.050 . 4.460 3.545 3.285 3.949 . 0 0 "[ . 1 . 2]" 1
779 1 72 GLU H 1 72 GLU HB3 3.980 . 4.380 3.205 2.550 3.622 . 0 0 "[ . 1 . 2]" 1
780 1 71 THR MG 1 72 GLU H 3.470 . 3.820 2.264 1.996 2.409 . 0 0 "[ . 1 . 2]" 1
781 1 42 ILE MD 1 72 GLU H 5.500 . 6.050 5.581 5.123 5.896 . 0 0 "[ . 1 . 2]" 1
782 1 72 GLU H 1 74 VAL MG1 5.500 . 6.050 5.524 5.225 5.926 . 0 0 "[ . 1 . 2]" 1
783 1 72 GLU H 1 73 ASN HB3 5.470 . 6.020 5.180 5.084 5.384 . 0 0 "[ . 1 . 2]" 1
784 1 70 TYR HA 1 73 ASN H 3.530 . 3.880 3.749 3.519 3.889 0.009 20 0 "[ . 1 . 2]" 1
785 1 70 TYR HB2 1 73 ASN H 5.070 . 5.580 4.595 4.403 4.720 . 0 0 "[ . 1 . 2]" 1
786 1 73 ASN H 1 73 ASN HB2 3.860 . 4.250 2.737 2.565 2.960 . 0 0 "[ . 1 . 2]" 1
787 1 73 ASN H 1 73 ASN HB3 3.600 . 3.960 2.879 2.792 2.957 . 0 0 "[ . 1 . 2]" 1
788 1 72 GLU HB2 1 73 ASN H 4.360 . 4.800 3.549 3.127 4.187 . 0 0 "[ . 1 . 2]" 1
789 1 70 TYR HB3 1 73 ASN H 5.070 . 5.580 3.746 3.694 3.898 . 0 0 "[ . 1 . 2]" 1
790 1 73 ASN H 1 74 VAL MG1 3.710 . 4.080 3.735 3.495 4.071 . 0 0 "[ . 1 . 2]" 1
791 1 74 VAL H 1 75 LYS H 4.480 . 4.930 4.360 4.159 4.427 . 0 0 "[ . 1 . 2]" 1
792 1 73 ASN H 1 74 VAL H 2.870 . 3.160 2.050 1.847 2.206 . 0 0 "[ . 1 . 2]" 1
793 1 70 TYR HB2 1 74 VAL H 4.770 . 5.250 4.671 4.282 5.024 . 0 0 "[ . 1 . 2]" 1
794 1 70 TYR HB3 1 74 VAL H 4.770 . 5.250 4.342 3.740 4.741 . 0 0 "[ . 1 . 2]" 1
795 1 74 VAL H 1 74 VAL MG1 3.210 . 3.530 3.005 2.932 3.096 . 0 0 "[ . 1 . 2]" 1
796 1 44 ILE HA 1 75 LYS H 4.320 . 4.750 2.767 2.585 3.063 . 0 0 "[ . 1 . 2]" 1
797 1 74 VAL HB 1 75 LYS H 4.640 . 5.100 2.883 2.669 3.366 . 0 0 "[ . 1 . 2]" 1
798 1 44 ILE MG 1 75 LYS H 4.810 . 5.290 4.565 4.337 4.870 . 0 0 "[ . 1 . 2]" 1
799 1 76 ILE H 1 77 TYR H 4.750 . 5.220 4.475 4.305 4.551 . 0 0 "[ . 1 . 2]" 1
800 1 75 LYS HA 1 76 ILE H 3.070 . 3.380 2.178 2.112 2.386 . 0 0 "[ . 1 . 2]" 1
801 1 76 ILE H 1 76 ILE HB 3.240 . 3.560 2.542 2.437 2.726 . 0 0 "[ . 1 . 2]" 1
802 1 76 ILE H 1 76 ILE MD 3.540 . 3.890 2.768 2.070 3.895 0.005 13 0 "[ . 1 . 2]" 1
803 1 75 LYS HD2 1 76 ILE H 5.220 . 5.740 4.373 2.692 5.563 . 0 0 "[ . 1 . 2]" 1
804 1 46 VAL HA 1 77 TYR H 4.610 . 5.070 2.587 2.315 2.890 . 0 0 "[ . 1 . 2]" 1
805 1 46 VAL HB 1 77 TYR H 5.500 . 6.050 5.104 4.608 5.762 . 0 0 "[ . 1 . 2]" 1
806 1 76 ILE HB 1 77 TYR H 4.840 . 5.320 4.088 3.939 4.352 . 0 0 "[ . 1 . 2]" 1
807 1 44 ILE MG 1 77 TYR H 4.400 . 4.840 3.829 3.041 4.301 . 0 0 "[ . 1 . 2]" 1
808 1 76 ILE MG 1 77 TYR H 3.340 . 3.670 2.482 2.264 3.107 . 0 0 "[ . 1 . 2]" 1
809 1 23 ILE MG 1 77 TYR H 4.330 . 4.760 4.602 4.019 4.767 0.007 18 0 "[ . 1 . 2]" 1
810 1 82 GLU H 1 84 ASN H 4.450 . 4.890 3.882 2.964 4.442 . 0 0 "[ . 1 . 2]" 1
811 1 82 GLU H 1 83 ASP H 3.590 . 3.950 2.751 2.242 3.084 . 0 0 "[ . 1 . 2]" 1
812 1 82 GLU H 1 82 GLU HB2 3.930 . 4.320 2.768 2.368 3.664 . 0 0 "[ . 1 . 2]" 1
813 1 82 GLU H 1 82 GLU HB3 3.930 . 4.320 3.050 2.386 3.662 . 0 0 "[ . 1 . 2]" 1
814 1 82 GLU H 1 82 GLU HG2 4.500 . 4.950 3.468 1.914 4.569 . 0 0 "[ . 1 . 2]" 1
815 1 82 GLU H 1 82 GLU HG3 4.500 . 4.950 3.437 1.866 4.572 . 0 0 "[ . 1 . 2]" 1
816 1 82 GLU HG2 1 83 ASP H 5.400 . 5.940 3.963 2.009 5.528 . 0 0 "[ . 1 . 2]" 1
817 1 82 GLU HG3 1 83 ASP H 5.400 . 5.940 4.093 1.975 5.187 . 0 0 "[ . 1 . 2]" 1
818 1 83 ASP H 1 84 ASN H 3.350 . 3.690 2.352 1.809 2.835 . 0 0 "[ . 1 . 2]" 1
819 1 83 ASP HB2 1 84 ASN H 5.160 . 5.680 4.113 3.021 4.457 . 0 0 "[ . 1 . 2]" 1
820 1 83 ASP HB3 1 84 ASN H 5.160 . 5.680 3.677 3.031 4.494 . 0 0 "[ . 1 . 2]" 1
821 1 84 ASN H 1 85 GLN H 4.360 . 4.800 3.471 1.952 4.643 . 0 0 "[ . 1 . 2]" 1
822 1 84 ASN HA 1 85 GLN H 2.950 . 3.250 2.635 2.146 3.263 0.013 3 0 "[ . 1 . 2]" 1
823 1 85 GLN H 1 86 ASP HA 4.730 . 5.200 4.933 4.408 5.213 0.013 7 0 "[ . 1 . 2]" 1
824 1 85 GLN H 1 85 GLN HG2 4.480 . 4.930 3.338 2.343 4.091 . 0 0 "[ . 1 . 2]" 1
825 1 85 GLN H 1 85 GLN HB2 4.070 . 4.480 3.094 2.377 3.916 . 0 0 "[ . 1 . 2]" 1
826 1 85 GLN H 1 85 GLN HB3 4.070 . 4.480 3.563 2.904 3.829 . 0 0 "[ . 1 . 2]" 1
827 1 85 GLN H 1 88 ALA MB 5.500 . 6.050 4.390 2.827 5.977 . 0 0 "[ . 1 . 2]" 1
828 1 86 ASP H 1 87 VAL H 3.570 . 3.930 2.552 2.124 2.805 . 0 0 "[ . 1 . 2]" 1
829 1 86 ASP H 1 86 ASP HB2 3.500 . 3.850 2.523 2.351 2.803 . 0 0 "[ . 1 . 2]" 1
830 1 86 ASP H 1 86 ASP HB3 3.500 . 3.850 3.317 2.360 3.647 . 0 0 "[ . 1 . 2]" 1
831 1 85 GLN HB2 1 86 ASP H 4.480 . 4.930 3.824 2.539 4.531 . 0 0 "[ . 1 . 2]" 1
832 1 85 GLN HB3 1 86 ASP H 4.480 . 4.930 3.716 2.354 4.313 . 0 0 "[ . 1 . 2]" 1
833 1 85 GLN H 1 86 ASP H 3.960 . 4.360 4.229 3.840 4.390 0.030 16 0 "[ . 1 . 2]" 1
834 1 87 VAL H 1 88 ALA H 3.640 . 4.000 2.825 2.715 3.025 . 0 0 "[ . 1 . 2]" 1
835 1 85 GLN H 1 87 VAL H 5.500 . 6.050 5.174 4.654 6.052 0.002 18 0 "[ . 1 . 2]" 1
836 1 87 VAL H 1 87 VAL MG2 3.810 . 4.190 1.998 1.863 3.759 . 0 0 "[ . 1 . 2]" 1
837 1 89 THR H 1 90 GLN H 3.270 . 3.600 2.566 2.443 2.701 . 0 0 "[ . 1 . 2]" 1
838 1 90 GLN H 1 91 TYR H 3.330 . 3.660 2.693 2.566 2.859 . 0 0 "[ . 1 . 2]" 1
839 1 89 THR HB 1 90 GLN H 3.130 . 3.440 2.794 2.587 2.944 . 0 0 "[ . 1 . 2]" 1
840 1 90 GLN H 1 90 GLN HB2 2.980 . 3.280 2.540 2.410 2.661 . 0 0 "[ . 1 . 2]" 1
841 1 90 GLN H 1 90 GLN HB3 2.980 . 3.280 2.509 2.371 2.650 . 0 0 "[ . 1 . 2]" 1
842 1 89 THR MG 1 90 GLN H 3.730 . 4.100 3.750 3.566 3.845 . 0 0 "[ . 1 . 2]" 1
843 1 87 VAL H 1 87 VAL HB 3.160 . 3.480 2.627 2.524 2.679 . 0 0 "[ . 1 . 2]" 1
844 1 86 ASP HA 1 88 ALA H 5.110 . 5.620 4.086 3.482 4.810 . 0 0 "[ . 1 . 2]" 1
845 1 87 VAL HB 1 88 ALA H 4.090 . 4.500 2.666 2.390 3.940 . 0 0 "[ . 1 . 2]" 1
846 1 88 ALA H 1 89 THR H 3.830 . 4.210 2.721 2.532 2.897 . 0 0 "[ . 1 . 2]" 1
847 1 89 THR H 1 89 THR HB 3.140 . 3.450 2.600 2.537 2.678 . 0 0 "[ . 1 . 2]" 1
848 1 88 ALA MB 1 89 THR H 3.350 . 3.690 2.426 2.246 2.647 . 0 0 "[ . 1 . 2]" 1
849 1 89 THR H 1 89 THR MG 3.960 . 4.360 3.761 3.747 3.776 . 0 0 "[ . 1 . 2]" 1
850 1 88 ALA HA 1 91 TYR H 3.950 . 4.350 3.609 3.242 3.912 . 0 0 "[ . 1 . 2]" 1
851 1 91 TYR H 1 91 TYR HB2 3.530 . 3.880 2.386 2.244 2.453 . 0 0 "[ . 1 . 2]" 1
852 1 91 TYR H 1 91 TYR HB3 3.530 . 3.880 3.607 3.537 3.650 . 0 0 "[ . 1 . 2]" 1
853 1 90 GLN HB2 1 91 TYR H 4.200 . 4.620 3.834 3.728 3.973 . 0 0 "[ . 1 . 2]" 1
854 1 92 GLY H 1 93 VAL H 3.170 . 3.490 2.579 2.339 2.831 . 0 0 "[ . 1 . 2]" 1
855 1 90 GLN H 1 92 GLY H 4.180 . 4.600 3.635 3.464 3.779 . 0 0 "[ . 1 . 2]" 1
856 1 91 TYR HA 1 92 GLY H 3.540 . 3.890 3.360 3.202 3.421 . 0 0 "[ . 1 . 2]" 1
857 1 88 ALA HA 1 92 GLY H 4.800 . 5.280 4.503 4.134 4.904 . 0 0 "[ . 1 . 2]" 1
858 1 91 TYR HB2 1 92 GLY H 4.300 . 4.730 3.350 3.165 3.720 . 0 0 "[ . 1 . 2]" 1
859 1 91 TYR HB3 1 92 GLY H 4.300 . 4.730 4.065 3.870 4.313 . 0 0 "[ . 1 . 2]" 1
860 1 92 GLY H 1 93 VAL HB 5.020 . 5.520 4.814 4.500 5.104 . 0 0 "[ . 1 . 2]" 1
861 1 89 THR MG 1 92 GLY H 4.590 . 5.050 4.335 4.166 4.638 . 0 0 "[ . 1 . 2]" 1
862 1 88 ALA HA 1 93 VAL H 4.150 . 4.570 3.827 3.371 4.388 . 0 0 "[ . 1 . 2]" 1
863 1 93 VAL H 1 93 VAL HB 3.320 . 3.650 2.590 2.491 2.758 . 0 0 "[ . 1 . 2]" 1
864 1 88 ALA MB 1 93 VAL H 4.190 . 4.610 3.826 3.442 4.069 . 0 0 "[ . 1 . 2]" 1
865 1 93 VAL H 1 112 ILE MG 5.500 . 6.050 5.779 5.000 6.056 0.006 15 0 "[ . 1 . 2]" 1
866 1 91 TYR H 1 93 VAL H 4.620 . 5.080 4.059 3.586 4.552 . 0 0 "[ . 1 . 2]" 1
867 1 99 ILE H 1 100 LEU HA 5.090 . 5.600 4.851 4.576 5.047 . 0 0 "[ . 1 . 2]" 1
868 1 99 ILE H 1 111 VAL HB 4.300 . 4.730 2.770 2.301 3.610 . 0 0 "[ . 1 . 2]" 1
869 1 99 ILE H 1 111 VAL MG1 5.220 . 5.740 3.772 3.458 4.198 . 0 0 "[ . 1 . 2]" 1
870 1 99 ILE H 1 111 VAL MG2 5.500 . 6.050 4.156 3.700 4.827 . 0 0 "[ . 1 . 2]" 1
871 1 98 THR MG 1 99 ILE H 4.450 . 4.890 2.743 2.340 3.022 . 0 0 "[ . 1 . 2]" 1
872 1 46 VAL H 1 100 LEU H 3.660 . 4.030 3.255 2.866 3.656 . 0 0 "[ . 1 . 2]" 1
873 1 100 LEU H 1 101 MET H 5.020 . 5.520 4.478 4.371 4.597 . 0 0 "[ . 1 . 2]" 1
874 1 99 ILE HA 1 100 LEU H 3.100 . 3.410 2.198 2.150 2.293 . 0 0 "[ . 1 . 2]" 1
875 1 46 VAL HB 1 100 LEU H 4.820 . 5.300 4.125 2.747 4.889 . 0 0 "[ . 1 . 2]" 1
876 1 100 LEU H 1 100 LEU HB2 3.860 . 4.250 2.482 2.249 3.044 . 0 0 "[ . 1 . 2]" 1
877 1 99 ILE HB 1 100 LEU H 4.140 . 4.550 4.176 3.925 4.367 . 0 0 "[ . 1 . 2]" 1
878 1 100 LEU H 1 100 LEU HB3 3.860 . 4.250 3.353 2.721 3.701 . 0 0 "[ . 1 . 2]" 1
879 1 98 THR MG 1 100 LEU H 5.070 . 5.580 4.289 3.815 4.620 . 0 0 "[ . 1 . 2]" 1
880 1 46 VAL MG2 1 100 LEU H 4.850 . 5.330 3.327 2.295 4.877 . 0 0 "[ . 1 . 2]" 1
881 1 99 ILE MG 1 100 LEU H 3.370 . 3.710 2.722 2.283 3.130 . 0 0 "[ . 1 . 2]" 1
882 1 101 MET H 1 108 LEU H 4.810 . 5.290 4.196 3.847 4.413 . 0 0 "[ . 1 . 2]" 1
883 1 101 MET H 1 111 VAL H 5.490 . 6.040 4.707 4.289 5.029 . 0 0 "[ . 1 . 2]" 1
884 1 101 MET H 1 102 PHE H 5.210 . 5.730 4.308 4.205 4.372 . 0 0 "[ . 1 . 2]" 1
885 1 45 LEU HA 1 101 MET H 5.020 . 5.520 4.875 4.616 5.154 . 0 0 "[ . 1 . 2]" 1
886 1 100 LEU HA 1 101 MET H 3.170 . 3.490 2.197 2.134 2.305 . 0 0 "[ . 1 . 2]" 1
887 1 101 MET H 1 109 SER HB3 5.480 . 6.030 5.375 4.537 5.696 . 0 0 "[ . 1 . 2]" 1
888 1 101 MET H 1 109 SER HB2 5.500 . 6.050 4.909 4.392 5.896 . 0 0 "[ . 1 . 2]" 1
889 1 101 MET H 1 101 MET HG3 4.020 . 4.420 2.628 2.380 2.886 . 0 0 "[ . 1 . 2]" 1
890 1 101 MET H 1 101 MET ME 5.170 . 5.690 4.767 4.572 4.943 . 0 0 "[ . 1 . 2]" 1
891 1 101 MET H 1 101 MET HB2 3.690 . 4.060 2.537 2.425 2.619 . 0 0 "[ . 1 . 2]" 1
892 1 100 LEU HG 1 101 MET H 3.580 . 3.940 3.729 2.497 3.948 0.008 1 0 "[ . 1 . 2]" 1
893 1 45 LEU H 1 102 PHE H 5.480 . 6.030 4.934 4.749 5.042 . 0 0 "[ . 1 . 2]" 1
894 1 102 PHE H 1 103 LYS H 5.370 . 5.910 4.481 4.447 4.513 . 0 0 "[ . 1 . 2]" 1
895 1 102 PHE H 1 102 PHE HD1 4.090 . 4.500 3.018 2.687 3.281 . 0 0 "[ . 1 . 2]" 1
896 1 101 MET HA 1 102 PHE H 3.150 . 3.470 2.157 2.119 2.192 . 0 0 "[ . 1 . 2]" 1
897 1 45 LEU HA 1 102 PHE H 4.310 . 4.740 3.633 3.342 3.895 . 0 0 "[ . 1 . 2]" 1
898 1 102 PHE H 1 102 PHE HB3 3.960 . 4.360 3.702 3.666 3.745 . 0 0 "[ . 1 . 2]" 1
899 1 102 PHE H 1 102 PHE HB2 3.880 . 4.270 2.507 2.441 2.577 . 0 0 "[ . 1 . 2]" 1
900 1 101 MET HG2 1 102 PHE H 4.740 . 5.210 4.684 4.564 4.786 . 0 0 "[ . 1 . 2]" 1
901 1 44 ILE HB 1 102 PHE H 4.000 . 4.400 3.250 2.967 3.561 . 0 0 "[ . 1 . 2]" 1
902 1 101 MET HB3 1 102 PHE H 3.770 . 4.150 3.604 3.494 3.740 . 0 0 "[ . 1 . 2]" 1
903 1 44 ILE MG 1 102 PHE H 4.400 . 4.840 3.660 3.133 3.907 . 0 0 "[ . 1 . 2]" 1
904 1 102 PHE H 1 108 LEU HB2 5.500 . 6.050 5.458 5.183 5.829 . 0 0 "[ . 1 . 2]" 1
905 1 102 PHE HA 1 103 LYS H 3.550 . 3.900 2.242 2.151 2.294 . 0 0 "[ . 1 . 2]" 1
906 1 102 PHE HB3 1 103 LYS H 4.260 . 4.690 2.807 2.619 3.098 . 0 0 "[ . 1 . 2]" 1
907 1 103 LYS H 1 108 LEU HG 5.420 . 5.960 5.321 4.897 5.823 . 0 0 "[ . 1 . 2]" 1
908 1 103 LYS H 1 104 ASN H 5.280 . 5.810 3.959 3.771 4.125 . 0 0 "[ . 1 . 2]" 1
909 1 42 ILE H 1 104 ASN H 5.500 . 6.050 4.755 3.819 5.292 . 0 0 "[ . 1 . 2]" 1
910 1 104 ASN H 1 106 LYS H 5.500 . 6.050 4.195 3.990 4.323 . 0 0 "[ . 1 . 2]" 1
911 1 39 ASN HA 1 104 ASN H 5.370 . 5.910 4.663 3.524 5.886 . 0 0 "[ . 1 . 2]" 1
912 1 104 ASN H 1 105 GLY H 4.080 . 4.490 2.687 2.580 2.966 . 0 0 "[ . 1 . 2]" 1
913 1 105 GLY H 1 106 LYS H 3.900 . 4.290 2.629 2.482 2.889 . 0 0 "[ . 1 . 2]" 1
914 1 102 PHE HB3 1 105 GLY H 5.150 . 5.670 3.854 2.968 4.315 . 0 0 "[ . 1 . 2]" 1
915 1 36 THR MG 1 105 GLY H 5.500 . 6.050 5.189 4.404 6.050 0.000 11 0 "[ . 1 . 2]" 1
916 1 44 ILE MD 1 105 GLY H 5.500 . 6.050 5.314 4.754 5.864 . 0 0 "[ . 1 . 2]" 1
917 1 108 LEU H 1 109 SER H 3.160 . 3.480 2.345 2.167 2.506 . 0 0 "[ . 1 . 2]" 1
918 1 101 MET H 1 109 SER H 3.690 . 4.060 3.248 3.074 3.454 . 0 0 "[ . 1 . 2]" 1
919 1 102 PHE HA 1 109 SER H 5.290 . 5.820 5.114 4.862 5.499 . 0 0 "[ . 1 . 2]" 1
920 1 100 LEU HA 1 109 SER H 5.280 . 5.810 5.132 4.902 5.371 . 0 0 "[ . 1 . 2]" 1
921 1 109 SER H 1 109 SER HB2 3.510 . 3.860 3.049 2.885 3.480 . 0 0 "[ . 1 . 2]" 1
922 1 109 SER H 1 109 SER HB3 4.020 . 4.420 3.781 3.041 3.995 . 0 0 "[ . 1 . 2]" 1
923 1 101 MET HG3 1 109 SER H 4.790 . 5.270 4.065 3.694 4.431 . 0 0 "[ . 1 . 2]" 1
924 1 101 MET HB3 1 109 SER H 3.720 . 4.090 3.478 3.273 3.686 . 0 0 "[ . 1 . 2]" 1
925 1 108 LEU HB2 1 109 SER H 3.710 . 4.080 2.438 2.372 2.750 . 0 0 "[ . 1 . 2]" 1
926 1 108 LEU HB3 1 109 SER H 4.010 . 4.410 3.498 3.368 3.784 . 0 0 "[ . 1 . 2]" 1
927 1 110 GLN H 1 111 VAL H 4.420 . 4.860 4.137 3.939 4.316 . 0 0 "[ . 1 . 2]" 1
928 1 109 SER H 1 110 GLN H 4.420 . 4.860 4.365 4.310 4.386 . 0 0 "[ . 1 . 2]" 1
929 1 109 SER HA 1 110 GLN H 2.920 . 3.210 2.486 2.296 2.573 . 0 0 "[ . 1 . 2]" 1
930 1 109 SER HB2 1 110 GLN H 4.120 . 4.530 3.510 3.301 3.801 . 0 0 "[ . 1 . 2]" 1
931 1 109 SER HB3 1 110 GLN H 3.930 . 4.320 2.545 2.189 3.398 . 0 0 "[ . 1 . 2]" 1
932 1 110 GLN H 1 110 GLN HB2 3.980 . 4.380 3.697 2.599 4.039 . 0 0 "[ . 1 . 2]" 1
933 1 110 GLN H 1 110 GLN HB3 3.980 . 4.380 3.393 2.813 3.857 . 0 0 "[ . 1 . 2]" 1
934 1 110 GLN H 1 111 VAL MG2 4.700 . 5.170 4.462 4.135 4.766 . 0 0 "[ . 1 . 2]" 1
935 1 111 VAL H 1 111 VAL HB 3.550 . 3.900 2.550 2.495 2.676 . 0 0 "[ . 1 . 2]" 1
936 1 98 THR MG 1 111 VAL H 4.460 . 4.910 4.226 3.547 4.917 0.007 19 0 "[ . 1 . 2]" 1
937 1 111 VAL H 1 112 ILE H 4.430 . 4.870 4.309 4.181 4.452 . 0 0 "[ . 1 . 2]" 1
938 1 111 VAL HA 1 112 ILE H 2.950 . 3.250 2.178 2.135 2.239 . 0 0 "[ . 1 . 2]" 1
939 1 112 ILE H 1 112 ILE HB 3.230 . 3.550 2.635 2.521 2.808 . 0 0 "[ . 1 . 2]" 1
940 1 112 ILE H 1 112 ILE HG12 4.000 . 4.400 3.781 3.568 3.962 . 0 0 "[ . 1 . 2]" 1
941 1 112 ILE H 1 112 ILE HG13 4.000 . 4.400 2.647 2.405 2.857 . 0 0 "[ . 1 . 2]" 1
942 1 111 VAL MG1 1 112 ILE H 3.450 . 3.790 3.130 2.571 3.255 . 0 0 "[ . 1 . 2]" 1
943 1 112 ILE H 1 113 GLY H 4.830 . 5.310 4.223 4.058 4.419 . 0 0 "[ . 1 . 2]" 1
944 1 99 ILE H 1 113 GLY H 5.200 . 5.720 4.806 4.206 5.099 . 0 0 "[ . 1 . 2]" 1
945 1 113 GLY H 1 114 ALA H 4.490 . 4.940 4.437 4.061 4.556 . 0 0 "[ . 1 . 2]" 1
946 1 112 ILE HG13 1 113 GLY H 5.450 . 6.000 5.164 5.129 5.241 . 0 0 "[ . 1 . 2]" 1
947 1 111 VAL MG1 1 113 GLY H 4.360 . 4.800 3.778 3.375 4.318 . 0 0 "[ . 1 . 2]" 1
948 1 112 ILE HG12 1 113 GLY H 5.450 . 6.000 4.629 4.452 4.828 . 0 0 "[ . 1 . 2]" 1
949 1 114 ALA H 1 115 ASP H 4.400 . 4.840 3.280 2.674 3.768 . 0 0 "[ . 1 . 2]" 1
950 1 111 VAL MG1 1 114 ALA H 4.560 . 5.020 4.657 3.987 5.027 0.007 5 0 "[ . 1 . 2]" 1
951 1 111 VAL MG1 1 115 ASP H 4.000 . 4.400 3.132 2.438 3.571 . 0 0 "[ . 1 . 2]" 1
952 1 115 ASP H 1 116 ILE H 4.670 . 5.140 3.871 3.237 4.122 . 0 0 "[ . 1 . 2]" 1
953 1 115 ASP HA 1 116 ILE H 3.200 . 3.520 2.258 2.150 2.528 . 0 0 "[ . 1 . 2]" 1
954 1 116 ILE H 1 116 ILE HB 3.280 . 3.610 2.600 2.508 2.657 . 0 0 "[ . 1 . 2]" 1
955 1 116 ILE H 1 116 ILE HG13 4.500 . 4.950 4.471 4.439 4.493 . 0 0 "[ . 1 . 2]" 1
956 1 116 ILE H 1 116 ILE MG 3.360 . 3.700 1.971 1.888 2.050 . 0 0 "[ . 1 . 2]" 1
957 1 116 ILE H 1 116 ILE MD 4.180 . 4.600 4.167 4.107 4.214 . 0 0 "[ . 1 . 2]" 1
958 1 116 ILE H 1 117 SER H 3.400 . 3.740 2.742 2.624 2.954 . 0 0 "[ . 1 . 2]" 1
959 1 117 SER H 1 118 LYS H 3.210 . 3.530 2.601 2.520 2.689 . 0 0 "[ . 1 . 2]" 1
960 1 115 ASP HA 1 117 SER H 4.200 . 4.620 3.702 3.420 4.021 . 0 0 "[ . 1 . 2]" 1
961 1 117 SER H 1 117 SER HB2 3.380 . 3.720 2.742 2.451 3.541 . 0 0 "[ . 1 . 2]" 1
962 1 117 SER H 1 117 SER HB3 3.380 . 3.720 2.851 2.473 3.594 . 0 0 "[ . 1 . 2]" 1
963 1 116 ILE HB 1 117 SER H 4.140 . 4.550 3.977 3.920 4.031 . 0 0 "[ . 1 . 2]" 1
964 1 116 ILE HG13 1 117 SER H 4.140 . 4.550 3.745 3.486 3.927 . 0 0 "[ . 1 . 2]" 1
965 1 116 ILE MG 1 117 SER H 3.060 . 3.370 2.043 1.861 2.163 . 0 0 "[ . 1 . 2]" 1
966 1 116 ILE MD 1 117 SER H 4.720 . 5.190 4.531 4.388 4.612 . 0 0 "[ . 1 . 2]" 1
967 1 118 LYS H 1 119 ILE H 3.910 . 4.300 2.536 2.410 2.754 . 0 0 "[ . 1 . 2]" 1
968 1 118 LYS H 1 118 LYS HB2 3.680 . 4.050 2.610 2.242 3.644 . 0 0 "[ . 1 . 2]" 1
969 1 118 LYS H 1 118 LYS HB3 3.680 . 4.050 2.502 2.179 2.959 . 0 0 "[ . 1 . 2]" 1
970 1 118 LYS H 1 120 ILE MG 4.900 . 5.390 5.264 5.107 5.392 0.002 7 0 "[ . 1 . 2]" 1
971 1 116 ILE MD 1 118 LYS H 5.170 . 5.690 5.367 5.238 5.608 . 0 0 "[ . 1 . 2]" 1
972 1 119 ILE H 1 120 ILE H 3.740 . 4.110 2.732 2.621 2.818 . 0 0 "[ . 1 . 2]" 1
973 1 118 LYS H 1 120 ILE H 4.910 . 5.400 4.123 4.024 4.312 . 0 0 "[ . 1 . 2]" 1
974 1 117 SER HA 1 120 ILE H 3.990 . 4.390 3.875 3.725 4.064 . 0 0 "[ . 1 . 2]" 1
975 1 116 ILE HA 1 120 ILE H 4.030 . 4.430 3.899 3.845 3.963 . 0 0 "[ . 1 . 2]" 1
976 1 120 ILE H 1 120 ILE HG13 2.910 . 3.200 2.076 1.968 2.158 . 0 0 "[ . 1 . 2]" 1
977 1 116 ILE HG13 1 120 ILE H 4.480 . 4.930 4.233 4.153 4.480 . 0 0 "[ . 1 . 2]" 1
978 1 120 ILE H 1 120 ILE MG 3.170 . 3.490 2.314 2.241 2.392 . 0 0 "[ . 1 . 2]" 1
979 1 119 ILE MD 1 120 ILE H 3.680 . 4.050 2.610 2.447 2.874 . 0 0 "[ . 1 . 2]" 1
980 1 120 ILE H 1 123 ILE MD 4.700 . 5.170 4.615 4.495 4.788 . 0 0 "[ . 1 . 2]" 1
981 1 119 ILE H 1 120 ILE MG 4.520 . 4.970 4.398 4.283 4.555 . 0 0 "[ . 1 . 2]" 1
982 1 119 ILE H 1 119 ILE MG 3.930 . 4.320 2.045 1.925 2.200 . 0 0 "[ . 1 . 2]" 1
983 1 120 ILE H 1 121 SER H 3.230 . 3.550 2.600 2.528 2.693 . 0 0 "[ . 1 . 2]" 1
984 1 120 ILE HG13 1 121 SER H 3.020 . 3.320 2.429 2.335 2.514 . 0 0 "[ . 1 . 2]" 1
985 1 121 SER H 1 122 GLU HG2 4.830 . 5.310 3.997 3.828 4.220 . 0 0 "[ . 1 . 2]" 1
986 1 121 SER H 1 124 ASN HB2 5.450 . 6.000 5.270 5.119 5.425 . 0 0 "[ . 1 . 2]" 1
987 1 120 ILE MD 1 121 SER H 3.190 . 3.510 2.404 2.199 2.572 . 0 0 "[ . 1 . 2]" 1
988 1 119 ILE MD 1 121 SER H 4.730 . 5.200 4.481 4.368 4.628 . 0 0 "[ . 1 . 2]" 1
989 1 119 ILE HG13 1 121 SER H 4.640 . 5.100 4.461 4.335 4.622 . 0 0 "[ . 1 . 2]" 1
990 1 121 SER H 1 123 ILE MD 5.500 . 6.050 5.696 5.556 5.818 . 0 0 "[ . 1 . 2]" 1
991 1 122 GLU H 1 122 GLU HG2 3.660 . 4.030 2.007 1.793 2.233 0.007 20 0 "[ . 1 . 2]" 1
992 1 122 GLU H 1 122 GLU HB3 3.220 . 3.540 2.678 2.528 2.938 . 0 0 "[ . 1 . 2]" 1
993 1 119 ILE MD 1 122 GLU H 5.210 . 5.730 5.234 5.060 5.388 . 0 0 "[ . 1 . 2]" 1
994 1 120 ILE MD 1 122 GLU H 4.700 . 5.170 4.516 4.392 4.611 . 0 0 "[ . 1 . 2]" 1
995 1 122 GLU H 1 123 ILE H 3.540 . 3.890 2.611 2.513 2.720 . 0 0 "[ . 1 . 2]" 1
996 1 123 ILE H 1 124 ASN HB2 5.250 . 5.780 4.849 4.667 4.987 . 0 0 "[ . 1 . 2]" 1
997 1 122 GLU HG2 1 123 ILE H 4.390 . 4.830 2.486 2.268 2.767 . 0 0 "[ . 1 . 2]" 1
998 1 123 ILE H 1 123 ILE HB 2.920 . 3.210 2.502 2.458 2.563 . 0 0 "[ . 1 . 2]" 1
999 1 119 ILE MD 1 123 ILE H 4.140 . 4.550 4.456 4.279 4.555 0.005 20 0 "[ . 1 . 2]" 1
1000 1 123 ILE H 1 123 ILE MD 3.740 . 4.110 3.683 3.590 3.748 . 0 0 "[ . 1 . 2]" 1
1001 1 123 ILE H 1 123 ILE MG 3.890 . 4.280 3.791 3.778 3.810 . 0 0 "[ . 1 . 2]" 1
1002 1 122 GLU HG3 1 123 ILE H 3.780 . 4.160 2.590 2.141 2.938 . 0 0 "[ . 1 . 2]" 1
1003 1 123 ILE H 1 126 ASN H 5.500 . 6.050 4.980 4.458 5.306 . 0 0 "[ . 1 . 2]" 1
1004 1 123 ILE H 1 124 ASN H 3.260 . 3.590 2.783 2.634 2.865 . 0 0 "[ . 1 . 2]" 1
1005 1 124 ASN H 1 124 ASN HD22 4.600 . 5.060 4.182 3.675 4.334 . 0 0 "[ . 1 . 2]" 1
1006 1 121 SER HA 1 124 ASN H 4.580 . 5.040 4.383 4.054 4.581 . 0 0 "[ . 1 . 2]" 1
1007 1 123 ILE HB 1 124 ASN H 3.140 . 3.450 2.391 2.272 2.529 . 0 0 "[ . 1 . 2]" 1
1008 1 101 MET ME 1 124 ASN H 5.190 . 5.710 5.065 4.831 5.710 . 0 0 "[ . 1 . 2]" 1
1009 1 123 ILE MD 1 124 ASN H 4.300 . 4.730 4.466 4.355 4.594 . 0 0 "[ . 1 . 2]" 1
1010 1 123 ILE MG 1 124 ASN H 3.610 . 3.970 3.083 3.000 3.226 . 0 0 "[ . 1 . 2]" 1
1011 1 119 ILE MD 1 124 ASN H 4.960 . 5.460 5.120 4.972 5.278 . 0 0 "[ . 1 . 2]" 1
1012 1 123 ILE H 1 125 ASN H 4.370 . 4.810 3.825 3.625 4.076 . 0 0 "[ . 1 . 2]" 1
1013 1 124 ASN H 1 125 ASN H 3.300 . 3.630 2.643 2.587 2.676 . 0 0 "[ . 1 . 2]" 1
1014 1 125 ASN H 1 127 ILE H 4.740 . 5.210 4.020 3.824 4.299 . 0 0 "[ . 1 . 2]" 1
1015 1 122 GLU HA 1 125 ASN H 3.780 . 4.160 3.603 3.357 3.963 . 0 0 "[ . 1 . 2]" 1
1016 1 123 ILE HA 1 125 ASN H 4.860 . 5.350 4.016 3.857 4.179 . 0 0 "[ . 1 . 2]" 1
1017 1 124 ASN HB2 1 125 ASN H 3.450 . 3.790 3.086 2.893 3.161 . 0 0 "[ . 1 . 2]" 1
1018 1 125 ASN H 1 125 ASN HB2 3.630 . 3.990 2.584 2.259 2.910 . 0 0 "[ . 1 . 2]" 1
1019 1 125 ASN H 1 125 ASN HB3 3.630 . 3.990 2.610 2.333 3.580 . 0 0 "[ . 1 . 2]" 1
1020 1 101 MET ME 1 125 ASN H 5.490 . 6.040 5.052 4.610 5.894 . 0 0 "[ . 1 . 2]" 1
1021 1 123 ILE HB 1 125 ASN H 4.880 . 5.370 4.650 4.546 4.855 . 0 0 "[ . 1 . 2]" 1
1022 1 125 ASN H 1 126 ASN H 3.070 . 3.380 2.537 2.236 2.771 . 0 0 "[ . 1 . 2]" 1
1023 1 126 ASN H 1 127 ILE H 2.910 . 3.200 2.220 2.034 2.392 . 0 0 "[ . 1 . 2]" 1
1024 1 124 ASN H 1 126 ASN H 4.780 . 5.260 4.203 3.844 4.519 . 0 0 "[ . 1 . 2]" 1
1025 1 124 ASN HA 1 126 ASN H 4.420 . 4.860 3.894 3.359 4.294 . 0 0 "[ . 1 . 2]" 1
1026 1 122 GLU HA 1 126 ASN H 5.230 . 5.750 4.780 4.306 5.255 . 0 0 "[ . 1 . 2]" 1
1027 1 123 ILE HA 1 126 ASN H 4.160 . 4.580 3.539 3.023 3.976 . 0 0 "[ . 1 . 2]" 1
1028 1 125 ASN HB3 1 126 ASN H 3.980 . 4.380 3.073 2.722 4.048 . 0 0 "[ . 1 . 2]" 1
1029 1 125 ASN HB2 1 126 ASN H 3.980 . 4.380 3.961 2.707 4.260 . 0 0 "[ . 1 . 2]" 1
1030 1 126 ASN H 1 126 ASN HB3 3.960 . 4.360 3.524 2.717 3.791 . 0 0 "[ . 1 . 2]" 1
1031 1 101 MET ME 1 126 ASN H 4.930 . 5.420 4.338 3.707 5.025 . 0 0 "[ . 1 . 2]" 1
1032 1 126 ASN H 1 127 ILE HG13 4.440 . 4.880 4.711 4.434 4.877 . 0 0 "[ . 1 . 2]" 1
1033 1 126 ASN H 1 127 ILE HG12 4.670 . 5.140 3.727 3.368 4.029 . 0 0 "[ . 1 . 2]" 1
1034 1 126 ASN HB2 1 127 ILE H 4.210 . 4.630 3.428 2.601 4.208 . 0 0 "[ . 1 . 2]" 1
1035 1 126 ASN HB3 1 127 ILE H 4.210 . 4.630 3.937 2.711 4.344 . 0 0 "[ . 1 . 2]" 1
1036 1 127 ILE H 1 127 ILE HG13 3.490 . 3.840 2.959 2.778 3.185 . 0 0 "[ . 1 . 2]" 1
1037 1 127 ILE H 1 127 ILE HG12 3.320 . 3.650 2.403 2.113 2.685 . 0 0 "[ . 1 . 2]" 1
1038 1 127 ILE H 1 127 ILE MG 3.190 . 3.510 2.881 2.342 3.181 . 0 0 "[ . 1 . 2]" 1
1039 1 123 ILE MG 1 127 ILE H 5.080 . 5.590 4.050 3.609 4.465 . 0 0 "[ . 1 . 2]" 1
1040 1 128 ASN H 1 128 ASN HA 2.840 . 3.120 2.828 2.712 2.896 . 0 0 "[ . 1 . 2]" 1
1041 1 127 ILE HA 1 128 ASN H 2.880 . 3.170 2.462 2.425 2.503 . 0 0 "[ . 1 . 2]" 1
1042 1 128 ASN H 1 128 ASN HB2 3.690 . 4.060 3.613 3.555 3.664 . 0 0 "[ . 1 . 2]" 1
1043 1 128 ASN H 1 128 ASN HB3 3.690 . 4.060 2.615 2.285 3.066 . 0 0 "[ . 1 . 2]" 1
1044 1 127 ILE HB 1 128 ASN H 3.240 . 3.560 2.197 2.132 2.362 . 0 0 "[ . 1 . 2]" 1
1045 1 127 ILE HG13 1 128 ASN H 3.910 . 4.300 3.504 3.310 3.654 . 0 0 "[ . 1 . 2]" 1
1046 1 127 ILE MG 1 128 ASN H 3.720 . 4.090 3.585 3.506 3.750 . 0 0 "[ . 1 . 2]" 1
1047 1 123 ILE MG 1 128 ASN H 5.500 . 6.050 6.060 6.048 6.069 0.019 19 0 "[ . 1 . 2]" 1
1048 1 41 ASN H 1 41 ASN HD21 4.810 . 5.290 3.721 2.075 5.253 . 0 0 "[ . 1 . 2]" 1
1049 1 41 ASN HA 1 41 ASN HD21 4.350 . 4.790 3.153 1.847 4.372 . 0 0 "[ . 1 . 2]" 1
1050 1 41 ASN HA 1 41 ASN HD22 4.350 . 4.790 3.924 3.447 4.512 . 0 0 "[ . 1 . 2]" 1
1051 1 42 ILE HB 1 73 ASN HD21 5.500 . 6.050 4.928 4.249 6.059 0.009 2 0 "[ . 1 . 2]" 1
1052 1 73 ASN HD21 1 127 ILE HG12 5.370 . 5.910 5.859 4.821 5.921 0.011 8 0 "[ . 1 . 2]" 1
1053 1 73 ASN HD21 1 127 ILE MG 4.130 . 4.540 2.532 1.825 2.832 . 0 0 "[ . 1 . 2]" 1
1054 1 73 ASN HD21 1 74 VAL MG1 3.800 . 4.180 3.689 3.046 4.018 . 0 0 "[ . 1 . 2]" 1
1055 1 73 ASN HD22 1 127 ILE MG 4.710 . 5.180 2.536 2.270 2.813 . 0 0 "[ . 1 . 2]" 1
1056 1 73 ASN HD22 1 127 ILE HB 4.460 . 4.910 3.513 3.046 4.287 . 0 0 "[ . 1 . 2]" 1
1057 1 122 GLU HG3 1 126 ASN HD21 5.500 . 6.050 4.779 4.042 5.507 . 0 0 "[ . 1 . 2]" 1
1058 1 122 GLU HG3 1 126 ASN HD22 5.500 . 6.050 5.392 4.331 6.060 0.010 8 0 "[ . 1 . 2]" 1
1059 1 122 GLU HA 1 125 ASN HD22 4.670 . 5.140 4.887 3.259 5.148 0.008 3 0 "[ . 1 . 2]" 1
1060 1 125 ASN HB3 1 125 ASN HD22 4.010 . 4.410 3.556 3.464 4.039 . 0 0 "[ . 1 . 2]" 1
1061 1 125 ASN HB2 1 125 ASN HD22 4.010 . 4.410 3.822 3.466 4.053 . 0 0 "[ . 1 . 2]" 1
1062 1 124 ASN HB2 1 124 ASN HD22 3.510 . 3.860 3.485 3.473 3.503 . 0 0 "[ . 1 . 2]" 1
1063 1 120 ILE MG 1 124 ASN HD22 3.440 . 3.780 3.577 3.337 3.786 0.006 9 0 "[ . 1 . 2]" 1
1064 1 120 ILE MD 1 124 ASN HD21 3.530 . 3.880 3.406 2.994 3.789 . 0 0 "[ . 1 . 2]" 1
1065 1 121 SER HA 1 124 ASN HD21 4.300 . 4.730 4.081 3.800 4.417 . 0 0 "[ . 1 . 2]" 1
1066 1 33 ASN HA 1 33 ASN HD22 4.300 . 4.730 4.036 3.455 4.658 . 0 0 "[ . 1 . 2]" 1
1067 1 127 ILE MD 1 128 ASN HD22 4.380 . 4.820 4.001 2.731 4.736 . 0 0 "[ . 1 . 2]" 1
1068 1 127 ILE MG 1 128 ASN HD22 5.280 . 5.810 5.011 4.528 5.704 . 0 0 "[ . 1 . 2]" 1
1069 1 127 ILE MG 1 128 ASN HD21 4.370 . 4.810 4.368 3.992 4.710 . 0 0 "[ . 1 . 2]" 1
1070 1 127 ILE MD 1 128 ASN HD21 4.270 . 4.700 3.644 2.979 4.704 0.004 20 0 "[ . 1 . 2]" 1
1071 1 73 ASN HB3 1 128 ASN HD21 3.930 . 4.320 3.857 2.978 4.326 0.006 1 0 "[ . 1 . 2]" 1
1072 1 73 ASN HB3 1 128 ASN HD22 4.510 . 4.960 3.699 2.938 4.383 . 0 0 "[ . 1 . 2]" 1
1073 1 68 GLN HB2 1 68 GLN HE22 5.010 . 5.510 4.427 3.802 4.745 . 0 0 "[ . 1 . 2]" 1
1074 1 68 GLN HE22 1 68 GLN HG3 3.990 . 4.390 3.547 3.476 3.778 . 0 0 "[ . 1 . 2]" 1
1075 1 65 LYS HA 1 68 GLN HE22 5.400 . 5.940 3.704 2.538 4.980 . 0 0 "[ . 1 . 2]" 1
1076 1 65 LYS HA 1 68 GLN HE21 5.400 . 5.940 3.619 2.055 5.619 . 0 0 "[ . 1 . 2]" 1
1077 1 69 GLN HE22 1 69 GLN HG3 3.960 . 4.360 3.606 3.477 3.793 . 0 0 "[ . 1 . 2]" 1
1078 1 69 GLN HE22 1 69 GLN HG2 3.960 . 4.360 3.680 3.484 4.070 . 0 0 "[ . 1 . 2]" 1
1079 1 62 GLN HE21 1 116 ILE HB 5.500 . 6.050 4.332 3.111 5.752 . 0 0 "[ . 1 . 2]" 1
1080 1 62 GLN HE21 1 111 VAL MG1 5.010 . 5.510 4.468 2.288 5.228 . 0 0 "[ . 1 . 2]" 1
1081 1 62 GLN HE21 1 114 ALA HA 4.470 . 4.920 2.904 1.805 3.777 . 0 0 "[ . 1 . 2]" 1
1082 1 62 GLN HE22 1 114 ALA HA 4.030 . 4.430 2.521 1.910 3.096 . 0 0 "[ . 1 . 2]" 1
1083 1 62 GLN HE22 1 62 GLN HG3 3.860 . 4.250 3.634 3.491 4.081 . 0 0 "[ . 1 . 2]" 1
1084 1 62 GLN HE22 1 62 GLN HG2 4.050 . 4.460 3.679 3.482 3.790 . 0 0 "[ . 1 . 2]" 1
1085 1 62 GLN HE22 1 111 VAL MG1 4.130 . 4.540 4.269 3.118 4.558 0.018 13 0 "[ . 1 . 2]" 1
1086 1 33 ASN H 1 33 ASN HB3 3.020 . 3.320 2.752 2.567 3.346 0.026 13 0 "[ . 1 . 2]" 1
1087 1 33 ASN H 1 33 ASN HB2 3.020 . 3.320 2.321 2.006 2.482 . 0 0 "[ . 1 . 2]" 1
1088 1 33 ASN H 1 34 LYS HB3 5.480 . 6.030 5.465 5.367 5.566 . 0 0 "[ . 1 . 2]" 1
1089 1 33 ASN H 1 34 LYS HD2 5.490 . 6.040 5.819 5.499 6.047 0.007 7 0 "[ . 1 . 2]" 1
1090 1 33 ASN H 1 34 LYS HA 5.460 . 6.010 5.415 5.375 5.444 . 0 0 "[ . 1 . 2]" 1
1091 1 31 PHE H 1 33 ASN H 4.810 . 5.290 3.876 3.775 4.005 . 0 0 "[ . 1 . 2]" 1
1092 1 33 ASN H 1 36 THR H 5.240 . 5.760 4.701 4.578 4.830 . 0 0 "[ . 1 . 2]" 1
1093 1 33 ASN H 1 34 LYS H 3.380 . 3.720 2.855 2.783 2.905 . 0 0 "[ . 1 . 2]" 1
1094 1 18 GLY H 1 19 PRO QD 4.140 . 4.550 2.522 1.930 3.206 . 0 0 "[ . 1 . 2]" 1
1095 1 18 GLY QA 1 19 PRO HG2 4.660 . 5.130 4.332 4.014 4.612 . 0 0 "[ . 1 . 2]" 1
1096 1 18 GLY QA 1 19 PRO HG3 5.100 . 5.610 4.527 4.224 4.749 . 0 0 "[ . 1 . 2]" 1
1097 1 18 GLY QA 1 19 PRO QD 2.770 . 3.050 2.149 1.943 2.400 . 0 0 "[ . 1 . 2]" 1
1098 1 19 PRO QB 1 20 GLY H 4.020 . 4.420 3.120 1.978 4.026 . 0 0 "[ . 1 . 2]" 1
1099 1 23 ILE H 1 23 ILE QG 3.250 . 3.580 2.526 2.123 2.971 . 0 0 "[ . 1 . 2]" 1
1100 1 23 ILE MG 1 77 TYR QB 5.340 . 5.870 5.379 4.861 5.760 . 0 0 "[ . 1 . 2]" 1
1101 1 23 ILE QG 1 24 GLU H 4.870 . 5.360 4.600 4.182 4.935 . 0 0 "[ . 1 . 2]" 1
1102 1 23 ILE QG 1 64 GLU QG 4.610 . 5.070 3.130 2.171 4.489 . 0 0 "[ . 1 . 2]" 1
1103 1 23 ILE QG 1 76 ILE HB 3.770 . 4.150 2.884 1.791 3.927 0.009 6 0 "[ . 1 . 2]" 1
1104 1 23 ILE MD 1 63 LEU QB 3.850 . 4.230 3.553 2.657 4.237 0.007 11 0 "[ . 1 . 2]" 1
1105 1 23 ILE MD 1 64 GLU QG 3.420 . 3.760 2.141 1.794 3.030 0.006 6 0 "[ . 1 . 2]" 1
1106 1 24 GLU H 1 24 GLU QG 4.390 . 4.830 4.105 3.991 4.227 . 0 0 "[ . 1 . 2]" 1
1107 1 24 GLU QG 1 26 ILE MG 4.000 . 4.400 2.803 1.903 3.858 . 0 0 "[ . 1 . 2]" 1
1108 1 24 GLU QG 1 77 TYR HE1 4.590 . 5.050 3.076 2.060 4.675 . 0 0 "[ . 1 . 2]" 1
1109 1 25 GLN H 1 25 GLN QG 3.610 . 3.970 2.316 1.809 3.979 0.009 8 0 "[ . 1 . 2]" 1
1110 1 25 GLN QB 1 26 ILE H 3.830 . 4.210 3.045 2.716 3.760 . 0 0 "[ . 1 . 2]" 1
1111 1 25 GLN QG 1 26 ILE H 4.420 . 4.860 4.181 2.766 4.705 . 0 0 "[ . 1 . 2]" 1
1112 1 26 ILE H 1 77 TYR QB 5.030 . 5.530 4.012 3.484 4.306 . 0 0 "[ . 1 . 2]" 1
1113 1 26 ILE HB 1 30 GLU QB 3.900 . 4.290 4.040 3.539 4.299 0.009 9 0 "[ . 1 . 2]" 1
1114 1 26 ILE MG 1 30 GLU QG 4.620 . 5.080 3.398 2.710 4.080 . 0 0 "[ . 1 . 2]" 1
1115 1 26 ILE MG 1 77 TYR QB 4.020 . 4.420 2.868 2.193 3.428 . 0 0 "[ . 1 . 2]" 1
1116 1 26 ILE HG12 1 77 TYR QB 4.050 . 4.460 2.433 2.133 2.765 . 0 0 "[ . 1 . 2]" 1
1117 1 26 ILE HG13 1 77 TYR QB 4.450 . 4.890 3.865 3.548 4.209 . 0 0 "[ . 1 . 2]" 1
1118 1 26 ILE MD 1 30 GLU QB 4.540 . 4.990 4.447 3.885 4.921 . 0 0 "[ . 1 . 2]" 1
1119 1 26 ILE MD 1 30 GLU QG 4.820 . 5.300 3.486 2.882 4.215 . 0 0 "[ . 1 . 2]" 1
1120 1 26 ILE MD 1 77 TYR QB 3.570 . 3.930 2.285 2.014 2.575 . 0 0 "[ . 1 . 2]" 1
1121 1 27 GLY H 1 30 GLU QB 4.100 . 4.510 4.147 3.816 4.353 . 0 0 "[ . 1 . 2]" 1
1122 1 27 GLY H 1 30 GLU QG 3.870 . 4.260 2.135 1.796 2.372 0.004 13 0 "[ . 1 . 2]" 1
1123 1 27 GLY HA3 1 30 GLU QG 3.340 . 3.670 3.184 2.397 3.574 . 0 0 "[ . 1 . 2]" 1
1124 1 29 SER H 1 29 SER QB 3.380 . 3.720 2.439 2.248 2.727 . 0 0 "[ . 1 . 2]" 1
1125 1 29 SER QB 1 30 GLU H 3.720 . 4.090 2.929 2.420 3.738 . 0 0 "[ . 1 . 2]" 1
1126 1 29 SER QB 1 31 PHE H 5.180 . 5.700 4.610 4.308 5.049 . 0 0 "[ . 1 . 2]" 1
1127 1 30 GLU H 1 30 GLU QB 3.680 . 4.050 2.915 2.613 3.098 . 0 0 "[ . 1 . 2]" 1
1128 1 30 GLU H 1 30 GLU QG 2.980 . 3.280 2.238 2.047 2.450 . 0 0 "[ . 1 . 2]" 1
1129 1 30 GLU H 1 31 PHE QB 4.390 . 4.830 4.010 3.716 4.335 . 0 0 "[ . 1 . 2]" 1
1130 1 30 GLU HA 1 30 GLU QG 3.450 . 3.790 3.433 3.331 3.520 . 0 0 "[ . 1 . 2]" 1
1131 1 30 GLU QB 1 31 PHE H 4.240 . 4.660 3.805 3.688 3.932 . 0 0 "[ . 1 . 2]" 1
1132 1 30 GLU QB 1 34 LYS HB3 4.340 . 4.770 3.645 3.169 3.962 . 0 0 "[ . 1 . 2]" 1
1133 1 30 GLU QG 1 31 PHE H 3.980 . 4.380 2.961 2.583 3.275 . 0 0 "[ . 1 . 2]" 1
1134 1 30 GLU QG 1 33 ASN HB3 5.340 . 5.870 4.671 4.342 5.642 . 0 0 "[ . 1 . 2]" 1
1135 1 30 GLU QG 1 34 LYS HD2 4.310 . 4.740 3.163 2.616 3.836 . 0 0 "[ . 1 . 2]" 1
1136 1 30 GLU QG 1 34 LYS HD3 4.850 . 5.330 3.268 2.839 3.918 . 0 0 "[ . 1 . 2]" 1
1137 1 31 PHE H 1 31 PHE QB 2.930 . 3.220 2.260 2.240 2.272 . 0 0 "[ . 1 . 2]" 1
1138 1 31 PHE HA 1 35 VAL QG 4.190 . 4.610 2.930 2.674 3.161 . 0 0 "[ . 1 . 2]" 1
1139 1 31 PHE QB 1 32 ASP H 3.650 . 4.020 2.085 1.975 2.154 . 0 0 "[ . 1 . 2]" 1
1140 1 31 PHE HD1 1 35 VAL QG 3.590 . 3.950 2.954 2.409 3.556 . 0 0 "[ . 1 . 2]" 1
1141 1 31 PHE HE1 1 35 VAL QG 3.970 . 4.370 2.975 2.524 3.528 . 0 0 "[ . 1 . 2]" 1
1142 1 32 ASP H 1 32 ASP QB 2.900 . 3.190 2.416 2.111 2.555 . 0 0 "[ . 1 . 2]" 1
1143 1 32 ASP QB 1 35 VAL H 5.240 . 5.760 4.900 4.698 5.121 . 0 0 "[ . 1 . 2]" 1
1144 1 32 ASP QB 1 36 THR H 4.540 . 4.990 3.876 3.511 4.674 . 0 0 "[ . 1 . 2]" 1
1145 1 32 ASP QB 1 37 SER H 4.940 . 5.430 4.840 4.393 5.445 0.015 19 0 "[ . 1 . 2]" 1
1146 1 33 ASN HA 1 37 SER QB 3.770 . 4.150 3.553 2.945 4.156 0.006 16 0 "[ . 1 . 2]" 1
1147 1 34 LYS H 1 34 LYS QG 4.130 . 4.540 2.034 1.931 2.124 . 0 0 "[ . 1 . 2]" 1
1148 1 34 LYS H 1 35 VAL QG 3.890 . 4.280 3.588 3.543 3.653 . 0 0 "[ . 1 . 2]" 1
1149 1 34 LYS HB2 1 34 LYS QE 3.830 . 4.210 2.479 2.093 2.973 . 0 0 "[ . 1 . 2]" 1
1150 1 34 LYS HB3 1 34 LYS QE 3.880 . 4.270 2.864 2.239 3.565 . 0 0 "[ . 1 . 2]" 1
1151 1 34 LYS QE 1 34 LYS QG 3.280 . 3.610 2.402 2.348 2.459 . 0 0 "[ . 1 . 2]" 1
1152 1 34 LYS QG 1 35 VAL H 4.740 . 5.210 2.596 2.388 2.723 . 0 0 "[ . 1 . 2]" 1
1153 1 34 LYS QG 1 35 VAL HA 3.940 . 4.330 3.621 3.410 3.848 . 0 0 "[ . 1 . 2]" 1
1154 1 34 LYS QE 1 77 TYR HE1 4.570 . 5.030 3.035 1.818 4.556 . 0 0 "[ . 1 . 2]" 1
1155 1 34 LYS QE 1 77 TYR HE2 5.130 . 5.640 4.324 3.175 5.469 . 0 0 "[ . 1 . 2]" 1
1156 1 35 VAL H 1 35 VAL QG 3.420 . 3.760 2.433 2.352 2.498 . 0 0 "[ . 1 . 2]" 1
1157 1 35 VAL HA 1 44 ILE QG 4.300 . 4.730 4.164 3.964 4.584 . 0 0 "[ . 1 . 2]" 1
1158 1 35 VAL QG 1 36 THR H 3.320 . 3.650 3.037 2.874 3.188 . 0 0 "[ . 1 . 2]" 1
1159 1 35 VAL QG 1 36 THR HA 4.620 . 5.080 3.107 2.919 3.272 . 0 0 "[ . 1 . 2]" 1
1160 1 35 VAL QG 1 36 THR MG 3.530 . 3.880 2.787 2.441 3.883 0.003 16 0 "[ . 1 . 2]" 1
1161 1 35 VAL QG 1 37 SER H 5.010 . 5.510 4.458 4.160 4.710 . 0 0 "[ . 1 . 2]" 1
1162 1 35 VAL QG 1 38 CYS H 4.480 . 4.930 4.544 4.387 4.760 . 0 0 "[ . 1 . 2]" 1
1163 1 35 VAL QG 1 44 ILE HB 4.340 . 4.770 2.970 2.345 3.455 . 0 0 "[ . 1 . 2]" 1
1164 1 35 VAL QG 1 44 ILE MG 3.300 . 3.630 1.924 1.798 2.400 0.002 9 0 "[ . 1 . 2]" 1
1165 1 35 VAL QG 1 46 VAL MG1 3.760 . 4.140 2.431 1.794 3.387 0.006 16 0 "[ . 1 . 2]" 1
1166 1 35 VAL QG 1 46 VAL MG2 3.480 . 3.830 2.587 1.799 3.187 0.001 9 0 "[ . 1 . 2]" 1
1167 1 35 VAL QG 1 77 TYR HE2 4.290 . 4.720 3.570 2.583 4.566 . 0 0 "[ . 1 . 2]" 1
1168 1 35 VAL QG 1 102 PHE HB2 4.100 . 4.510 2.394 1.934 2.876 . 0 0 "[ . 1 . 2]" 1
1169 1 35 VAL QG 1 102 PHE HB3 4.280 . 4.710 2.964 2.653 3.510 . 0 0 "[ . 1 . 2]" 1
1170 1 35 VAL QG 1 102 PHE HD1 3.950 . 4.350 2.716 2.365 3.450 . 0 0 "[ . 1 . 2]" 1
1171 1 36 THR H 1 37 SER QB 4.740 . 5.210 4.394 4.064 4.683 . 0 0 "[ . 1 . 2]" 1
1172 1 36 THR MG 1 105 GLY QA 4.530 . 4.980 3.656 2.732 4.336 . 0 0 "[ . 1 . 2]" 1
1173 1 37 SER H 1 37 SER QB 3.060 . 3.370 2.454 2.282 2.751 . 0 0 "[ . 1 . 2]" 1
1174 1 37 SER QB 1 38 CYS H 3.760 . 4.140 3.620 3.384 3.951 . 0 0 "[ . 1 . 2]" 1
1175 1 38 CYS H 1 38 CYS QB 2.830 . 3.110 2.288 2.242 2.627 . 0 0 "[ . 1 . 2]" 1
1176 1 38 CYS QB 1 39 ASN H 4.380 . 4.820 3.974 3.806 4.033 . 0 0 "[ . 1 . 2]" 1
1177 1 38 CYS QB 1 44 ILE MD 4.460 . 4.910 2.048 1.799 2.271 0.001 4 0 "[ . 1 . 2]" 1
1178 1 38 CYS QB 1 104 ASN H 5.130 . 5.640 2.872 1.857 3.732 . 0 0 "[ . 1 . 2]" 1
1179 1 38 CYS QB 1 105 GLY H 5.080 . 5.590 3.551 2.278 4.956 . 0 0 "[ . 1 . 2]" 1
1180 1 39 ASN H 1 39 ASN QB 3.140 . 3.450 2.501 2.284 3.015 . 0 0 "[ . 1 . 2]" 1
1181 1 39 ASN QB 1 40 ASP H 4.340 . 4.770 3.584 3.020 3.939 . 0 0 "[ . 1 . 2]" 1
1182 1 40 ASP H 1 40 ASP QB 3.210 . 3.530 2.442 2.272 2.631 . 0 0 "[ . 1 . 2]" 1
1183 1 40 ASP QB 1 42 ILE H 4.000 . 4.400 2.504 2.096 3.133 . 0 0 "[ . 1 . 2]" 1
1184 1 41 ASN H 1 41 ASN QD 4.200 . 4.620 3.503 2.065 4.633 0.013 1 0 "[ . 1 . 2]" 1
1185 1 41 ASN HA 1 41 ASN QD 3.810 . 4.190 2.997 1.840 3.954 . 0 0 "[ . 1 . 2]" 1
1186 1 41 ASN QD 1 104 ASN QB 3.420 . 3.760 3.298 2.197 3.770 0.010 4 0 "[ . 1 . 2]" 1
1187 1 42 ILE QG 1 73 ASN HB2 4.770 . 5.250 4.735 4.405 5.014 . 0 0 "[ . 1 . 2]" 1
1188 1 42 ILE QG 1 73 ASN HD21 4.070 . 4.480 2.798 2.115 3.607 . 0 0 "[ . 1 . 2]" 1
1189 1 42 ILE QG 1 73 ASN HD22 5.030 . 5.530 3.858 3.159 4.435 . 0 0 "[ . 1 . 2]" 1
1190 1 43 LEU HA 1 43 LEU QD 4.050 . 4.460 2.068 1.894 2.126 . 0 0 "[ . 1 . 2]" 1
1191 1 43 LEU QB 1 108 LEU HB2 5.340 . 5.870 5.873 5.762 5.888 0.018 8 0 "[ . 1 . 2]" 1
1192 1 43 LEU QD 1 101 MET HG2 3.530 . 3.880 3.101 2.546 3.883 0.003 6 0 "[ . 1 . 2]" 1
1193 1 43 LEU QD 1 108 LEU HB2 3.420 . 3.760 3.024 2.753 3.570 . 0 0 "[ . 1 . 2]" 1
1194 1 43 LEU QD 1 108 LEU HB3 3.830 . 4.210 3.820 3.392 4.128 . 0 0 "[ . 1 . 2]" 1
1195 1 43 LEU QD 1 108 LEU HG 3.520 . 3.870 2.743 2.408 3.047 . 0 0 "[ . 1 . 2]" 1
1196 1 43 LEU QD 1 122 GLU HA 5.440 . 5.980 5.888 5.547 5.991 0.011 9 0 "[ . 1 . 2]" 1
1197 1 43 LEU QD 1 123 ILE HA 2.930 . 3.220 2.637 2.209 3.050 . 0 0 "[ . 1 . 2]" 1
1198 1 43 LEU QD 1 123 ILE QG 3.440 . 3.780 2.749 2.003 3.685 . 0 0 "[ . 1 . 2]" 1
1199 1 43 LEU QD 1 126 ASN H 4.290 . 4.720 3.926 3.401 4.440 . 0 0 "[ . 1 . 2]" 1
1200 1 43 LEU QD 1 126 ASN QB 2.880 . 3.170 2.276 1.790 3.185 0.015 12 0 "[ . 1 . 2]" 1
1201 1 43 LEU QD 1 126 ASN QD 3.320 . 3.650 3.059 1.791 3.652 0.009 12 0 "[ . 1 . 2]" 1
1202 1 44 ILE MG 1 75 LYS QB 3.430 . 3.770 3.399 2.874 3.777 0.007 8 0 "[ . 1 . 2]" 1
1203 1 44 ILE MG 1 77 TYR QB 4.460 . 4.910 3.202 2.677 3.688 . 0 0 "[ . 1 . 2]" 1
1204 1 44 ILE QG 1 45 LEU H 4.770 . 5.250 4.092 3.950 4.271 . 0 0 "[ . 1 . 2]" 1
1205 1 45 LEU H 1 45 LEU QB 3.370 . 3.710 2.525 2.401 2.629 . 0 0 "[ . 1 . 2]" 1
1206 1 45 LEU QB 1 46 VAL H 3.980 . 4.380 3.530 3.003 3.618 . 0 0 "[ . 1 . 2]" 1
1207 1 45 LEU QB 1 47 ASP H 5.230 . 5.750 4.950 4.566 5.204 . 0 0 "[ . 1 . 2]" 1
1208 1 45 LEU QB 1 47 ASP QB 4.980 . 5.480 4.627 4.001 5.487 0.007 15 0 "[ . 1 . 2]" 1
1209 1 45 LEU QB 1 76 ILE MG 3.840 . 4.220 2.887 2.259 3.451 . 0 0 "[ . 1 . 2]" 1
1210 1 45 LEU QB 1 76 ILE QG 4.370 . 4.810 1.931 1.797 2.810 0.003 2 0 "[ . 1 . 2]" 1
1211 1 45 LEU QB 1 77 TYR H 4.400 . 4.840 3.854 3.626 4.069 . 0 0 "[ . 1 . 2]" 1
1212 1 45 LEU QB 1 99 ILE MG 3.470 . 3.820 2.151 1.799 2.511 0.001 4 0 "[ . 1 . 2]" 1
1213 1 46 VAL H 1 100 LEU QB 4.740 . 5.210 3.763 3.432 3.973 . 0 0 "[ . 1 . 2]" 1
1214 1 46 VAL HA 1 47 ASP QB 4.650 . 5.120 4.249 3.879 4.491 . 0 0 "[ . 1 . 2]" 1
1215 1 46 VAL HB 1 100 LEU QB 4.710 . 5.180 3.932 2.270 4.870 . 0 0 "[ . 1 . 2]" 1
1216 1 46 VAL MG2 1 77 TYR QB 4.460 . 4.910 3.552 1.799 4.905 0.001 4 0 "[ . 1 . 2]" 1
1217 1 47 ASP HA 1 99 ILE QG 3.910 . 4.300 2.507 2.001 3.127 . 0 0 "[ . 1 . 2]" 1
1218 1 47 ASP QB 1 76 ILE MG 3.800 . 4.180 3.303 2.717 3.969 . 0 0 "[ . 1 . 2]" 1
1219 1 47 ASP QB 1 99 ILE QG 4.080 . 4.490 2.248 1.808 3.387 . 0 0 "[ . 1 . 2]" 1
1220 1 47 ASP QB 1 99 ILE MD 3.590 . 3.950 3.316 2.729 3.971 0.021 15 0 "[ . 1 . 2]" 1
1221 1 62 GLN HA 1 65 LYS QB 3.210 . 3.530 2.532 2.329 2.709 . 0 0 "[ . 1 . 2]" 1
1222 1 62 GLN HA 1 65 LYS QG 3.880 . 4.270 3.632 2.959 3.999 . 0 0 "[ . 1 . 2]" 1
1223 1 62 GLN HA 1 65 LYS QD 4.820 . 5.300 5.007 4.212 5.304 0.004 19 0 "[ . 1 . 2]" 1
1224 1 63 LEU H 1 63 LEU QB 3.600 . 3.960 2.471 2.300 2.720 . 0 0 "[ . 1 . 2]" 1
1225 1 63 LEU H 1 63 LEU QD 3.560 . 3.920 2.113 1.786 2.962 0.014 2 0 "[ . 1 . 2]" 1
1226 1 63 LEU HA 1 63 LEU QD 3.670 . 4.040 2.432 1.895 3.451 . 0 0 "[ . 1 . 2]" 1
1227 1 63 LEU HA 1 66 LEU QB 4.210 . 4.630 3.584 3.368 3.902 . 0 0 "[ . 1 . 2]" 1
1228 1 63 LEU QB 1 64 GLU H 4.330 . 4.760 2.642 2.360 3.463 . 0 0 "[ . 1 . 2]" 1
1229 1 63 LEU QB 1 76 ILE HB 4.990 . 5.490 4.580 3.962 5.421 . 0 0 "[ . 1 . 2]" 1
1230 1 63 LEU QB 1 76 ILE MG 3.430 . 3.770 3.148 2.618 3.775 0.005 11 0 "[ . 1 . 2]" 1
1231 1 63 LEU QB 1 76 ILE MD 3.680 . 4.050 2.782 1.794 3.708 0.006 13 0 "[ . 1 . 2]" 1
1232 1 63 LEU QD 1 64 GLU H 4.520 . 4.970 3.347 1.801 3.982 . 0 0 "[ . 1 . 2]" 1
1233 1 63 LEU QD 1 76 ILE QG 3.800 . 4.180 3.096 2.159 4.183 0.003 14 0 "[ . 1 . 2]" 1
1234 1 64 GLU H 1 64 GLU QB 3.550 . 3.900 2.371 2.087 2.467 . 0 0 "[ . 1 . 2]" 1
1235 1 64 GLU H 1 64 GLU QG 3.590 . 3.950 2.625 2.307 3.958 0.008 11 0 "[ . 1 . 2]" 1
1236 1 64 GLU HA 1 64 GLU QG 3.150 . 3.470 2.376 2.297 2.506 . 0 0 "[ . 1 . 2]" 1
1237 1 64 GLU QB 1 65 LYS H 3.540 . 3.890 2.663 2.347 2.791 . 0 0 "[ . 1 . 2]" 1
1238 1 64 GLU QB 1 68 GLN QE 4.040 . 4.440 2.897 1.802 4.432 . 0 0 "[ . 1 . 2]" 1
1239 1 64 GLU QG 1 65 LYS H 4.770 . 5.250 4.152 3.687 4.532 . 0 0 "[ . 1 . 2]" 1
1240 1 64 GLU QG 1 67 ALA MB 4.300 . 4.730 3.701 3.269 4.315 . 0 0 "[ . 1 . 2]" 1
1241 1 65 LYS H 1 65 LYS QB 3.150 . 3.470 2.217 2.110 2.335 . 0 0 "[ . 1 . 2]" 1
1242 1 65 LYS HA 1 65 LYS QD 3.760 . 4.140 2.206 1.813 3.033 . 0 0 "[ . 1 . 2]" 1
1243 1 65 LYS HA 1 68 GLN QE 4.630 . 5.090 3.226 1.972 4.663 . 0 0 "[ . 1 . 2]" 1
1244 1 65 LYS QB 1 65 LYS QD 3.280 . 3.610 2.339 2.268 2.430 . 0 0 "[ . 1 . 2]" 1
1245 1 65 LYS QB 1 66 LEU H 2.780 . 3.060 2.445 2.307 2.555 . 0 0 "[ . 1 . 2]" 1
1246 1 65 LYS QG 1 66 LEU H 4.770 . 5.250 4.032 3.276 4.428 . 0 0 "[ . 1 . 2]" 1
1247 1 65 LYS QD 1 66 LEU H 4.990 . 5.490 4.432 3.388 4.984 . 0 0 "[ . 1 . 2]" 1
1248 1 65 LYS QD 1 66 LEU HA 5.050 . 5.560 4.767 3.044 5.571 0.011 11 0 "[ . 1 . 2]" 1
1249 1 66 LEU H 1 66 LEU QB 3.400 . 3.740 2.402 2.364 2.478 . 0 0 "[ . 1 . 2]" 1
1250 1 66 LEU HA 1 66 LEU QD 3.460 . 3.810 1.901 1.855 1.997 . 0 0 "[ . 1 . 2]" 1
1251 1 66 LEU HA 1 69 GLN QB 3.980 . 4.380 3.539 3.225 3.846 . 0 0 "[ . 1 . 2]" 1
1252 1 66 LEU HA 1 69 GLN QG 4.440 . 4.880 3.564 2.939 4.123 . 0 0 "[ . 1 . 2]" 1
1253 1 66 LEU QB 1 67 ALA H 3.220 . 3.540 2.777 2.680 2.915 . 0 0 "[ . 1 . 2]" 1
1254 1 66 LEU QB 1 68 GLN H 4.840 . 5.320 4.742 4.611 4.852 . 0 0 "[ . 1 . 2]" 1
1255 1 66 LEU QB 1 70 TYR H 5.110 . 5.620 4.105 3.931 4.311 . 0 0 "[ . 1 . 2]" 1
1256 1 66 LEU QB 1 70 TYR HE1 4.590 . 5.050 2.860 2.467 3.275 . 0 0 "[ . 1 . 2]" 1
1257 1 66 LEU QB 1 119 ILE MD 3.870 . 4.260 3.428 3.147 3.574 . 0 0 "[ . 1 . 2]" 1
1258 1 66 LEU QB 1 123 ILE MG 4.790 . 5.270 3.099 2.879 3.295 . 0 0 "[ . 1 . 2]" 1
1259 1 66 LEU QB 1 127 ILE MD 4.000 . 4.400 4.019 3.518 4.405 0.005 14 0 "[ . 1 . 2]" 1
1260 1 66 LEU QD 1 69 GLN QB 4.140 . 4.550 3.857 3.478 4.189 . 0 0 "[ . 1 . 2]" 1
1261 1 66 LEU QD 1 70 TYR HE1 2.990 . 3.290 1.875 1.794 2.174 0.006 5 0 "[ . 1 . 2]" 1
1262 1 66 LEU QD 1 119 ILE HG12 4.340 . 4.770 4.290 4.228 4.352 . 0 0 "[ . 1 . 2]" 1
1263 1 66 LEU QD 1 119 ILE HG13 4.090 . 4.500 3.935 3.768 4.076 . 0 0 "[ . 1 . 2]" 1
1264 1 66 LEU QD 1 123 ILE H 4.640 . 5.100 4.211 3.993 4.391 . 0 0 "[ . 1 . 2]" 1
1265 1 66 LEU QD 1 124 ASN H 4.560 . 5.020 3.750 3.364 4.033 . 0 0 "[ . 1 . 2]" 1
1266 1 66 LEU QD 1 124 ASN HA 5.040 . 5.540 4.644 4.271 4.957 . 0 0 "[ . 1 . 2]" 1
1267 1 67 ALA HA 1 70 TYR QB 4.590 . 5.050 3.194 2.806 3.758 . 0 0 "[ . 1 . 2]" 1
1268 1 68 GLN H 1 69 GLN QB 5.030 . 5.530 4.894 4.785 5.014 . 0 0 "[ . 1 . 2]" 1
1269 1 68 GLN HA 1 68 GLN QE 5.340 . 5.870 4.746 4.578 4.898 . 0 0 "[ . 1 . 2]" 1
1270 1 68 GLN HB2 1 68 GLN QE 4.290 . 4.720 3.727 2.745 4.099 . 0 0 "[ . 1 . 2]" 1
1271 1 69 GLN H 1 69 GLN QB 3.030 . 3.330 2.492 2.379 2.601 . 0 0 "[ . 1 . 2]" 1
1272 1 69 GLN H 1 69 GLN QG 3.760 . 4.140 2.405 2.086 2.661 . 0 0 "[ . 1 . 2]" 1
1273 1 69 GLN HA 1 69 GLN QG 3.140 . 3.450 2.925 2.470 3.137 . 0 0 "[ . 1 . 2]" 1
1274 1 69 GLN QB 1 70 TYR H 3.070 . 3.380 2.393 2.169 2.665 . 0 0 "[ . 1 . 2]" 1
1275 1 69 GLN QB 1 70 TYR HE2 3.830 . 4.210 3.623 3.045 4.016 . 0 0 "[ . 1 . 2]" 1
1276 1 69 GLN QB 1 70 TYR HD2 3.930 . 4.320 3.436 3.174 3.670 . 0 0 "[ . 1 . 2]" 1
1277 1 69 GLN QB 1 71 THR H 4.590 . 5.050 4.468 4.340 4.669 . 0 0 "[ . 1 . 2]" 1
1278 1 69 GLN QE 1 69 GLN QG 2.880 . 3.170 2.141 2.117 2.219 . 0 0 "[ . 1 . 2]" 1
1279 1 70 TYR H 1 70 TYR QB 3.160 . 3.480 2.513 2.449 2.664 . 0 0 "[ . 1 . 2]" 1
1280 1 70 TYR QB 1 73 ASN H 4.390 . 4.830 3.587 3.530 3.651 . 0 0 "[ . 1 . 2]" 1
1281 1 70 TYR QB 1 73 ASN HB3 4.720 . 5.190 2.917 2.394 3.448 . 0 0 "[ . 1 . 2]" 1
1282 1 70 TYR QB 1 74 VAL MG1 2.980 . 3.280 2.478 2.171 2.863 . 0 0 "[ . 1 . 2]" 1
1283 1 70 TYR QB 1 127 ILE MG 4.410 . 4.850 3.940 3.589 4.423 . 0 0 "[ . 1 . 2]" 1
1284 1 71 THR H 1 72 GLU QB 5.340 . 5.870 4.963 4.834 5.144 . 0 0 "[ . 1 . 2]" 1
1285 1 71 THR H 1 72 GLU QG 5.340 . 5.870 4.127 3.763 4.642 . 0 0 "[ . 1 . 2]" 1
1286 1 71 THR HB 1 72 GLU QG 5.340 . 5.870 5.195 4.776 5.804 . 0 0 "[ . 1 . 2]" 1
1287 1 71 THR MG 1 72 GLU QB 3.450 . 3.790 3.477 3.008 3.796 0.006 7 0 "[ . 1 . 2]" 1
1288 1 71 THR MG 1 72 GLU QG 3.560 . 3.920 2.757 2.006 3.791 . 0 0 "[ . 1 . 2]" 1
1289 1 72 GLU H 1 72 GLU QB 3.420 . 3.760 2.501 2.400 2.624 . 0 0 "[ . 1 . 2]" 1
1290 1 72 GLU H 1 72 GLU QG 3.250 . 3.580 2.100 1.849 2.376 . 0 0 "[ . 1 . 2]" 1
1291 1 72 GLU QB 1 73 ASN H 3.830 . 4.210 3.336 3.031 3.774 . 0 0 "[ . 1 . 2]" 1
1292 1 72 GLU QB 1 73 ASN HB2 4.720 . 5.190 3.908 3.402 4.586 . 0 0 "[ . 1 . 2]" 1
1293 1 72 GLU QG 1 73 ASN H 5.260 . 5.790 3.567 2.293 4.345 . 0 0 "[ . 1 . 2]" 1
1294 1 74 VAL HA 1 75 LYS QB 4.740 . 5.210 4.133 3.849 4.464 . 0 0 "[ . 1 . 2]" 1
1295 1 75 LYS H 1 75 LYS QD 5.200 . 5.720 4.448 4.123 5.017 . 0 0 "[ . 1 . 2]" 1
1296 1 75 LYS HA 1 75 LYS QD 4.400 . 4.840 2.348 1.822 4.248 . 0 0 "[ . 1 . 2]" 1
1297 1 75 LYS QB 1 77 TYR HE2 4.000 . 4.400 2.983 1.792 4.347 0.008 7 0 "[ . 1 . 2]" 1
1298 1 75 LYS QG 1 76 ILE H 4.610 . 5.070 4.177 2.980 4.711 . 0 0 "[ . 1 . 2]" 1
1299 1 75 LYS QD 1 76 ILE H 4.480 . 4.930 3.396 2.563 4.939 0.009 12 0 "[ . 1 . 2]" 1
1300 1 75 LYS QD 1 76 ILE HA 5.340 . 5.870 5.486 4.571 5.899 0.029 11 0 "[ . 1 . 2]" 1
1301 1 76 ILE MG 1 77 TYR QB 5.340 . 5.870 4.299 4.119 4.537 . 0 0 "[ . 1 . 2]" 1
1302 1 76 ILE QG 1 77 TYR H 5.340 . 5.870 4.066 3.843 4.326 . 0 0 "[ . 1 . 2]" 1
1303 1 77 TYR H 1 77 TYR QB 3.600 . 3.960 2.609 2.351 2.693 . 0 0 "[ . 1 . 2]" 1
1304 1 77 TYR QB 1 77 TYR HD2 3.240 . 3.560 2.335 2.269 2.478 . 0 0 "[ . 1 . 2]" 1
1305 1 82 GLU H 1 82 GLU QG 3.800 . 4.180 2.871 1.858 4.016 . 0 0 "[ . 1 . 2]" 1
1306 1 82 GLU H 1 84 ASN QB 5.340 . 5.870 5.061 4.060 5.887 0.017 1 0 "[ . 1 . 2]" 1
1307 1 82 GLU QB 1 84 ASN H 4.880 . 5.370 4.231 3.291 4.966 . 0 0 "[ . 1 . 2]" 1
1308 1 82 GLU QG 1 83 ASP H 4.590 . 5.050 3.443 1.921 4.417 . 0 0 "[ . 1 . 2]" 1
1309 1 83 ASP QB 1 84 ASN H 4.310 . 4.740 3.348 2.951 3.987 . 0 0 "[ . 1 . 2]" 1
1310 1 84 ASN H 1 84 ASN QB 3.490 . 3.840 2.503 2.258 3.076 . 0 0 "[ . 1 . 2]" 1
1311 1 84 ASN HA 1 85 GLN QG 5.040 . 5.540 4.504 3.373 5.207 . 0 0 "[ . 1 . 2]" 1
1312 1 84 ASN QB 1 85 GLN H 4.360 . 4.800 3.670 2.614 4.050 . 0 0 "[ . 1 . 2]" 1
1313 1 85 GLN H 1 85 GLN QB 3.470 . 3.820 2.784 2.347 3.325 . 0 0 "[ . 1 . 2]" 1
1314 1 85 GLN H 1 85 GLN QG 3.700 . 4.070 2.786 2.247 3.540 . 0 0 "[ . 1 . 2]" 1
1315 1 85 GLN HA 1 85 GLN QG 3.460 . 3.810 3.008 2.440 3.528 . 0 0 "[ . 1 . 2]" 1
1316 1 85 GLN QB 1 88 ALA MB 4.480 . 4.930 3.612 2.016 4.765 . 0 0 "[ . 1 . 2]" 1
1317 1 86 ASP H 1 86 ASP QB 2.960 . 3.260 2.385 2.224 2.561 . 0 0 "[ . 1 . 2]" 1
1318 1 86 ASP QB 1 87 VAL H 3.330 . 3.660 2.940 2.308 3.524 . 0 0 "[ . 1 . 2]" 1
1319 1 86 ASP QB 1 87 VAL HA 4.680 . 5.150 4.039 3.631 4.295 . 0 0 "[ . 1 . 2]" 1
1320 1 86 ASP QB 1 87 VAL QG 3.810 . 4.190 3.597 2.913 4.182 . 0 0 "[ . 1 . 2]" 1
1321 1 87 VAL H 1 87 VAL QG 3.160 . 3.480 1.900 1.859 2.027 . 0 0 "[ . 1 . 2]" 1
1322 1 87 VAL HA 1 87 VAL QG 3.120 . 3.430 2.164 2.143 2.383 . 0 0 "[ . 1 . 2]" 1
1323 1 87 VAL HA 1 90 GLN QG 4.470 . 4.920 4.157 3.342 4.757 . 0 0 "[ . 1 . 2]" 1
1324 1 87 VAL QG 1 88 ALA H 4.210 . 4.630 3.155 1.799 3.322 0.001 10 0 "[ . 1 . 2]" 1
1325 1 87 VAL QG 1 91 TYR HA 5.440 . 5.980 5.373 5.101 5.561 . 0 0 "[ . 1 . 2]" 1
1326 1 87 VAL QG 1 91 TYR HD1 3.760 . 4.140 2.394 2.043 3.130 . 0 0 "[ . 1 . 2]" 1
1327 1 87 VAL QG 1 91 TYR HE1 3.220 . 3.540 2.099 1.830 2.464 . 0 0 "[ . 1 . 2]" 1
1328 1 87 VAL QG 1 102 PHE HZ 4.250 . 4.680 3.719 2.850 4.428 . 0 0 "[ . 1 . 2]" 1
1329 1 88 ALA HA 1 93 VAL QG 3.400 . 3.740 2.616 2.186 3.577 . 0 0 "[ . 1 . 2]" 1
1330 1 88 ALA MB 1 93 VAL QG 3.320 . 3.650 2.367 1.942 3.051 . 0 0 "[ . 1 . 2]" 1
1331 1 90 GLN HA 1 90 GLN QG 3.530 . 3.880 2.582 2.373 3.060 . 0 0 "[ . 1 . 2]" 1
1332 1 90 GLN QB 1 91 TYR H 3.460 . 3.810 2.486 2.267 2.677 . 0 0 "[ . 1 . 2]" 1
1333 1 90 GLN QB 1 92 GLY H 5.010 . 5.510 4.324 4.187 4.460 . 0 0 "[ . 1 . 2]" 1
1334 1 91 TYR H 1 91 TYR QB 3.050 . 3.360 2.354 2.220 2.416 . 0 0 "[ . 1 . 2]" 1
1335 1 91 TYR H 1 93 VAL QG 4.500 . 4.950 4.152 3.572 4.772 . 0 0 "[ . 1 . 2]" 1
1336 1 91 TYR QB 1 92 GLY H 3.750 . 4.130 3.200 3.052 3.511 . 0 0 "[ . 1 . 2]" 1
1337 1 91 TYR QB 1 93 VAL QG 3.510 . 3.860 2.900 1.996 3.865 0.005 9 0 "[ . 1 . 2]" 1
1338 1 92 GLY H 1 92 GLY QA 2.480 . 2.730 2.214 2.188 2.242 . 0 0 "[ . 1 . 2]" 1
1339 1 92 GLY H 1 93 VAL QG 3.980 . 4.380 3.776 3.453 4.049 . 0 0 "[ . 1 . 2]" 1
1340 1 93 VAL H 1 93 VAL QG 3.190 . 3.510 2.087 1.972 2.260 . 0 0 "[ . 1 . 2]" 1
1341 1 93 VAL HA 1 93 VAL QG 3.060 . 3.370 2.210 2.138 2.350 . 0 0 "[ . 1 . 2]" 1
1342 1 93 VAL QG 1 98 THR HB 3.400 . 3.740 3.061 2.144 3.743 0.003 15 0 "[ . 1 . 2]" 1
1343 1 93 VAL QG 1 98 THR MG 3.040 . 3.340 2.072 1.797 2.921 0.003 5 0 "[ . 1 . 2]" 1
1344 1 98 THR HA 1 99 ILE QG 4.810 . 5.290 4.248 3.285 4.850 . 0 0 "[ . 1 . 2]" 1
1345 1 98 THR MG 1 110 GLN QB 4.730 . 5.200 3.291 2.276 4.308 . 0 0 "[ . 1 . 2]" 1
1346 1 98 THR MG 1 112 ILE QG 4.360 . 4.800 2.194 1.840 2.711 . 0 0 "[ . 1 . 2]" 1
1347 1 99 ILE QG 1 111 VAL H 5.140 . 5.650 4.875 4.544 5.237 . 0 0 "[ . 1 . 2]" 1
1348 1 99 ILE QG 1 111 VAL HB 3.900 . 4.290 3.384 2.876 3.721 . 0 0 "[ . 1 . 2]" 1
1349 1 100 LEU H 1 100 LEU QB 3.370 . 3.710 2.389 2.223 2.540 . 0 0 "[ . 1 . 2]" 1
1350 1 100 LEU QB 1 101 MET H 3.790 . 4.170 3.181 2.737 3.713 . 0 0 "[ . 1 . 2]" 1
1351 1 100 LEU HG 1 110 GLN QB 3.630 . 3.990 2.844 2.393 3.995 0.005 20 0 "[ . 1 . 2]" 1
1352 1 101 MET HA 1 108 LEU QD 4.020 . 4.420 4.264 3.733 4.424 0.004 16 0 "[ . 1 . 2]" 1
1353 1 101 MET HB2 1 108 LEU QD 3.260 . 3.590 3.481 3.023 3.598 0.008 1 0 "[ . 1 . 2]" 1
1354 1 101 MET HB3 1 108 LEU QD 3.830 . 4.210 3.094 2.358 3.489 . 0 0 "[ . 1 . 2]" 1
1355 1 101 MET ME 1 123 ILE QG 3.010 . 3.310 2.277 1.931 2.686 . 0 0 "[ . 1 . 2]" 1
1356 1 101 MET ME 1 126 ASN QD 4.550 . 5.010 2.434 1.795 3.268 0.005 18 0 "[ . 1 . 2]" 1
1357 1 102 PHE H 1 108 LEU QD 3.630 . 3.990 3.768 3.440 3.979 . 0 0 "[ . 1 . 2]" 1
1358 1 102 PHE HA 1 108 LEU QD 4.360 . 4.800 2.642 2.354 2.970 . 0 0 "[ . 1 . 2]" 1
1359 1 103 LYS H 1 108 LEU QD 4.400 . 4.840 2.606 2.339 3.011 . 0 0 "[ . 1 . 2]" 1
1360 1 106 LYS QB 1 106 LYS QD 3.330 . 3.660 2.203 2.112 2.377 . 0 0 "[ . 1 . 2]" 1
1361 1 106 LYS QB 1 107 LYS H 3.880 . 4.270 3.523 2.548 3.903 . 0 0 "[ . 1 . 2]" 1
1362 1 106 LYS QB 1 108 LEU QD 3.710 . 4.080 2.932 2.400 3.259 . 0 0 "[ . 1 . 2]" 1
1363 1 106 LYS QD 1 108 LEU QD 4.290 . 4.720 3.118 1.798 4.535 0.002 15 0 "[ . 1 . 2]" 1
1364 1 107 LYS H 1 107 LYS QB 3.490 . 3.840 2.651 2.265 2.888 . 0 0 "[ . 1 . 2]" 1
1365 1 107 LYS H 1 108 LEU QD 4.510 . 4.960 3.896 3.534 4.199 . 0 0 "[ . 1 . 2]" 1
1366 1 108 LEU H 1 108 LEU QD 3.350 . 3.690 1.950 1.791 2.300 0.009 15 0 "[ . 1 . 2]" 1
1367 1 108 LEU HA 1 108 LEU QD 3.210 . 3.530 2.016 1.928 2.098 . 0 0 "[ . 1 . 2]" 1
1368 1 108 LEU QD 1 109 SER H 3.350 . 3.690 3.467 3.301 3.665 . 0 0 "[ . 1 . 2]" 1
1369 1 109 SER HB2 1 126 ASN QD 5.060 . 5.570 3.943 2.604 5.044 . 0 0 "[ . 1 . 2]" 1
1370 1 110 GLN H 1 110 GLN QB 3.360 . 3.700 3.065 2.553 3.342 . 0 0 "[ . 1 . 2]" 1
1371 1 110 GLN QB 1 111 VAL H 3.840 . 4.220 3.276 2.905 3.778 . 0 0 "[ . 1 . 2]" 1
1372 1 111 VAL HA 1 112 ILE QG 4.380 . 4.820 3.831 3.587 3.959 . 0 0 "[ . 1 . 2]" 1
1373 1 111 VAL MG2 1 118 LYS QD 4.960 . 5.460 4.047 2.527 5.407 . 0 0 "[ . 1 . 2]" 1
1374 1 112 ILE H 1 112 ILE QG 3.390 . 3.730 2.598 2.369 2.795 . 0 0 "[ . 1 . 2]" 1
1375 1 112 ILE QG 1 113 GLY H 4.620 . 5.080 4.317 4.196 4.459 . 0 0 "[ . 1 . 2]" 1
1376 1 115 ASP H 1 115 ASP QB 3.360 . 3.700 2.513 2.323 2.776 . 0 0 "[ . 1 . 2]" 1
1377 1 115 ASP H 1 118 LYS QB 4.720 . 5.190 4.257 3.796 5.202 0.012 8 0 "[ . 1 . 2]" 1
1378 1 115 ASP QB 1 118 LYS QB 3.500 . 3.850 1.894 1.793 2.476 0.007 13 0 "[ . 1 . 2]" 1
1379 1 117 SER H 1 117 SER QB 2.930 . 3.220 2.408 2.244 2.709 . 0 0 "[ . 1 . 2]" 1
1380 1 117 SER HA 1 117 SER QB 2.460 . 2.710 2.327 2.180 2.411 . 0 0 "[ . 1 . 2]" 1
1381 1 117 SER QB 1 118 LYS H 3.710 . 4.080 2.911 2.550 3.499 . 0 0 "[ . 1 . 2]" 1
1382 1 118 LYS H 1 118 LYS QB 3.140 . 3.450 2.210 2.110 2.447 . 0 0 "[ . 1 . 2]" 1
1383 1 118 LYS HA 1 118 LYS QD 3.830 . 4.210 3.025 2.111 3.950 . 0 0 "[ . 1 . 2]" 1
1384 1 118 LYS QB 1 118 LYS QD 3.130 . 3.440 2.388 2.007 2.788 . 0 0 "[ . 1 . 2]" 1
1385 1 118 LYS QG 1 121 SER QB 4.460 . 4.910 4.196 3.451 4.918 0.008 8 0 "[ . 1 . 2]" 1
1386 1 118 LYS QG 1 122 GLU H 5.120 . 5.630 4.700 4.097 5.505 . 0 0 "[ . 1 . 2]" 1
1387 1 118 LYS QD 1 121 SER H 4.880 . 5.370 4.864 4.187 5.375 0.005 9 0 "[ . 1 . 2]" 1
1388 1 118 LYS QD 1 122 GLU HG2 4.130 . 4.540 3.492 2.796 4.362 . 0 0 "[ . 1 . 2]" 1
1389 1 118 LYS QD 1 122 GLU HG3 5.120 . 5.630 4.561 3.986 5.579 . 0 0 "[ . 1 . 2]" 1
1390 1 119 ILE MD 1 123 ILE QG 4.430 . 4.870 3.566 3.358 3.706 . 0 0 "[ . 1 . 2]" 1
1391 1 120 ILE MD 1 121 SER QB 3.840 . 4.220 2.711 2.383 3.420 . 0 0 "[ . 1 . 2]" 1
1392 1 121 SER H 1 121 SER QB 2.790 . 3.070 2.292 2.236 2.487 . 0 0 "[ . 1 . 2]" 1
1393 1 122 GLU HA 1 125 ASN QB 3.280 . 3.610 2.489 2.233 2.775 . 0 0 "[ . 1 . 2]" 1
1394 1 122 GLU HA 1 125 ASN QD 3.840 . 4.220 3.436 1.943 4.016 . 0 0 "[ . 1 . 2]" 1
1395 1 122 GLU HA 1 126 ASN QD 4.240 . 4.660 3.829 3.345 4.662 0.002 19 0 "[ . 1 . 2]" 1
1396 1 123 ILE H 1 123 ILE QG 3.680 . 4.050 2.256 2.122 2.347 . 0 0 "[ . 1 . 2]" 1
1397 1 123 ILE H 1 125 ASN QB 5.340 . 5.870 4.533 4.221 4.894 . 0 0 "[ . 1 . 2]" 1
1398 1 123 ILE H 1 126 ASN QD 5.340 . 5.870 4.689 4.035 5.625 . 0 0 "[ . 1 . 2]" 1
1399 1 123 ILE HA 1 123 ILE QG 3.020 . 3.320 2.364 2.317 2.400 . 0 0 "[ . 1 . 2]" 1
1400 1 123 ILE HA 1 126 ASN QD 4.860 . 5.350 3.242 1.798 4.281 0.002 12 0 "[ . 1 . 2]" 1
1401 1 125 ASN H 1 125 ASN QB 2.810 . 3.090 2.245 2.211 2.299 . 0 0 "[ . 1 . 2]" 1
1402 1 125 ASN H 1 125 ASN QD 4.550 . 5.010 4.270 3.573 4.547 . 0 0 "[ . 1 . 2]" 1
1403 1 125 ASN H 1 126 ASN QB 5.340 . 5.870 4.564 3.910 5.003 . 0 0 "[ . 1 . 2]" 1
1404 1 125 ASN H 1 126 ASN QD 5.340 . 5.870 4.248 3.675 5.612 . 0 0 "[ . 1 . 2]" 1
1405 1 125 ASN QB 1 126 ASN H 3.420 . 3.760 2.906 2.603 3.316 . 0 0 "[ . 1 . 2]" 1
1406 1 125 ASN QB 1 126 ASN QD 4.470 . 4.920 3.205 2.356 4.846 . 0 0 "[ . 1 . 2]" 1
1407 1 126 ASN H 1 126 ASN QB 3.100 . 3.410 2.478 2.249 2.790 . 0 0 "[ . 1 . 2]" 1
1408 1 126 ASN QB 1 126 ASN QD 2.900 . 3.190 2.164 2.105 2.218 . 0 0 "[ . 1 . 2]" 1
1409 1 126 ASN QB 1 127 ILE H 3.670 . 4.040 3.173 2.509 3.746 . 0 0 "[ . 1 . 2]" 1
1410 1 127 ILE MG 1 128 ASN QB 5.340 . 5.870 5.340 5.076 5.634 . 0 0 "[ . 1 . 2]" 1
1411 1 128 ASN H 1 128 ASN QB 2.900 . 3.190 2.550 2.259 2.896 . 0 0 "[ . 1 . 2]" 1
1412 1 128 ASN QB 1 128 ASN HD21 2.990 . 3.290 2.692 2.240 2.873 . 0 0 "[ . 1 . 2]" 1
1413 1 128 ASN QB 1 128 ASN HD22 3.520 . 3.870 3.450 3.300 3.507 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 64
_Distance_constraint_stats_list.Viol_count 274
_Distance_constraint_stats_list.Viol_total 49.399
_Distance_constraint_stats_list.Viol_max 0.038
_Distance_constraint_stats_list.Viol_rms 0.0048
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0019
_Distance_constraint_stats_list.Viol_average_violations_only 0.0090
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 22 MET 0.141 0.018 11 0 "[ . 1 . 2]"
1 24 GLU 0.003 0.003 7 0 "[ . 1 . 2]"
1 26 ILE 0.012 0.011 3 0 "[ . 1 . 2]"
1 30 GLU 0.173 0.018 2 0 "[ . 1 . 2]"
1 31 PHE 0.030 0.008 16 0 "[ . 1 . 2]"
1 32 ASP 0.250 0.021 7 0 "[ . 1 . 2]"
1 34 LYS 0.173 0.018 2 0 "[ . 1 . 2]"
1 35 VAL 0.030 0.008 16 0 "[ . 1 . 2]"
1 36 THR 0.250 0.021 7 0 "[ . 1 . 2]"
1 43 LEU 0.075 0.015 8 0 "[ . 1 . 2]"
1 44 ILE 0.017 0.009 6 0 "[ . 1 . 2]"
1 45 LEU 0.025 0.010 14 0 "[ . 1 . 2]"
1 46 VAL 0.042 0.010 3 0 "[ . 1 . 2]"
1 47 ASP 0.122 0.027 6 0 "[ . 1 . 2]"
1 48 PHE 0.039 0.012 1 0 "[ . 1 . 2]"
1 62 GLN 0.467 0.038 20 0 "[ . 1 . 2]"
1 63 LEU 0.011 0.006 8 0 "[ . 1 . 2]"
1 66 LEU 0.467 0.038 20 0 "[ . 1 . 2]"
1 67 ALA 0.011 0.006 8 0 "[ . 1 . 2]"
1 70 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 THR 0.164 0.017 5 0 "[ . 1 . 2]"
1 73 ASN 0.018 0.008 6 0 "[ . 1 . 2]"
1 74 VAL 0.164 0.017 5 0 "[ . 1 . 2]"
1 75 LYS 0.057 0.015 8 0 "[ . 1 . 2]"
1 76 ILE 0.141 0.018 11 0 "[ . 1 . 2]"
1 77 TYR 0.147 0.027 6 0 "[ . 1 . 2]"
1 78 LYS 0.016 0.011 3 0 "[ . 1 . 2]"
1 86 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 VAL 0.094 0.013 13 0 "[ . 1 . 2]"
1 88 ALA 0.052 0.016 15 0 "[ . 1 . 2]"
1 90 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 TYR 0.094 0.013 13 0 "[ . 1 . 2]"
1 93 VAL 0.052 0.016 15 0 "[ . 1 . 2]"
1 98 THR 0.039 0.012 1 0 "[ . 1 . 2]"
1 99 ILE 0.005 0.005 8 0 "[ . 1 . 2]"
1 100 LEU 0.042 0.010 3 0 "[ . 1 . 2]"
1 101 MET 0.170 0.018 4 0 "[ . 1 . 2]"
1 102 PHE 0.017 0.009 6 0 "[ . 1 . 2]"
1 103 LYS 0.078 0.012 4 0 "[ . 1 . 2]"
1 106 LYS 0.078 0.012 4 0 "[ . 1 . 2]"
1 108 LEU 0.012 0.006 14 0 "[ . 1 . 2]"
1 109 SER 0.158 0.018 4 0 "[ . 1 . 2]"
1 111 VAL 0.005 0.005 8 0 "[ . 1 . 2]"
1 115 ASP 0.066 0.019 8 0 "[ . 1 . 2]"
1 116 ILE 0.203 0.018 4 0 "[ . 1 . 2]"
1 118 LYS 0.233 0.025 12 0 "[ . 1 . 2]"
1 119 ILE 0.066 0.019 8 0 "[ . 1 . 2]"
1 120 ILE 0.203 0.018 4 0 "[ . 1 . 2]"
1 122 GLU 0.233 0.025 12 0 "[ . 1 . 2]"
1 123 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 26 ILE N 1 78 LYS O 3.500 . 3.500 3.071 2.787 3.424 . 0 0 "[ . 1 . 2]" 2
2 1 26 ILE H 1 78 LYS O 2.500 . 2.500 2.136 1.859 2.511 0.011 3 0 "[ . 1 . 2]" 2
3 1 24 GLU N 1 76 ILE O 3.500 . 3.500 2.855 2.686 3.068 . 0 0 "[ . 1 . 2]" 2
4 1 24 GLU H 1 76 ILE O 2.500 . 2.500 1.945 1.823 2.222 . 0 0 "[ . 1 . 2]" 2
5 1 22 MET O 1 76 ILE N 3.000 . 3.000 2.907 2.811 2.966 . 0 0 "[ . 1 . 2]" 2
6 1 22 MET O 1 76 ILE H 2.000 . 2.000 1.989 1.847 2.018 0.018 11 0 "[ . 1 . 2]" 2
7 1 24 GLU O 1 78 LYS N 3.500 . 3.500 2.889 2.745 3.160 . 0 0 "[ . 1 . 2]" 2
8 1 24 GLU O 1 78 LYS H 2.500 . 2.500 1.991 1.813 2.503 0.003 7 0 "[ . 1 . 2]" 2
9 1 30 GLU O 1 34 LYS N 3.000 . 3.000 2.890 2.804 2.949 . 0 0 "[ . 1 . 2]" 2
10 1 30 GLU O 1 34 LYS H 2.000 . 2.000 2.007 1.966 2.018 0.018 2 0 "[ . 1 . 2]" 2
11 1 43 LEU N 1 73 ASN O 3.500 . 3.500 3.157 2.832 3.456 . 0 0 "[ . 1 . 2]" 2
12 1 43 LEU H 1 73 ASN O 2.500 . 2.500 2.234 1.925 2.508 0.008 6 0 "[ . 1 . 2]" 2
13 1 48 PHE N 1 98 THR O 3.500 . 3.500 3.035 2.763 3.436 . 0 0 "[ . 1 . 2]" 2
14 1 48 PHE H 1 98 THR O 2.500 . 2.500 2.177 1.798 2.512 0.012 1 0 "[ . 1 . 2]" 2
15 1 88 ALA O 1 93 VAL N 3.000 . 3.000 2.909 2.763 2.996 . 0 0 "[ . 1 . 2]" 2
16 1 88 ALA O 1 93 VAL H 2.000 . 2.000 1.960 1.834 2.016 0.016 15 0 "[ . 1 . 2]" 2
17 1 71 THR O 1 74 VAL N 3.500 . 3.500 3.380 3.236 3.468 . 0 0 "[ . 1 . 2]" 2
18 1 71 THR O 1 74 VAL H 2.500 . 2.500 2.508 2.502 2.517 0.017 5 0 "[ . 1 . 2]" 2
19 1 44 ILE O 1 102 PHE H 2.000 . 2.000 1.875 1.802 1.940 . 0 0 "[ . 1 . 2]" 2
20 1 44 ILE O 1 102 PHE N 3.000 . 3.000 2.826 2.722 2.909 . 0 0 "[ . 1 . 2]" 2
21 1 44 ILE H 1 102 PHE O 2.000 . 2.000 1.903 1.801 2.009 0.009 6 0 "[ . 1 . 2]" 2
22 1 44 ILE N 1 102 PHE O 3.000 . 3.000 2.833 2.695 2.957 . 0 0 "[ . 1 . 2]" 2
23 1 101 MET O 1 108 LEU H 2.000 . 2.000 1.899 1.825 2.006 0.006 14 0 "[ . 1 . 2]" 2
24 1 101 MET O 1 108 LEU N 3.000 . 3.000 2.830 2.742 2.990 . 0 0 "[ . 1 . 2]" 2
25 1 101 MET H 1 109 SER O 2.000 . 2.000 1.917 1.849 2.002 0.002 14 0 "[ . 1 . 2]" 2
26 1 101 MET N 1 109 SER O 2.800 . 2.800 2.806 2.765 2.818 0.018 4 0 "[ . 1 . 2]" 2
27 1 43 LEU O 1 75 LYS H 2.000 . 2.000 1.964 1.867 2.015 0.015 8 0 "[ . 1 . 2]" 2
28 1 43 LEU O 1 75 LYS N 3.000 . 3.000 2.904 2.777 2.977 . 0 0 "[ . 1 . 2]" 2
29 1 45 LEU O 1 77 TYR H 2.000 . 2.000 1.917 1.799 2.010 0.010 14 0 "[ . 1 . 2]" 2
30 1 45 LEU O 1 77 TYR N 3.000 . 3.000 2.842 2.670 2.936 . 0 0 "[ . 1 . 2]" 2
31 1 47 ASP H 1 77 TYR O 2.000 . 2.000 1.987 1.864 2.027 0.027 6 0 "[ . 1 . 2]" 2
32 1 47 ASP N 1 77 TYR O 3.000 . 3.000 2.905 2.768 2.980 . 0 0 "[ . 1 . 2]" 2
33 1 46 VAL O 1 100 LEU H 2.000 . 2.000 1.926 1.834 2.009 0.009 6 0 "[ . 1 . 2]" 2
34 1 46 VAL O 1 100 LEU N 3.000 . 3.000 2.846 2.753 2.942 . 0 0 "[ . 1 . 2]" 2
35 1 99 ILE H 1 111 VAL O 2.000 . 2.000 1.903 1.807 2.005 0.005 8 0 "[ . 1 . 2]" 2
36 1 99 ILE N 1 111 VAL O 3.000 . 3.000 2.834 2.726 2.968 . 0 0 "[ . 1 . 2]" 2
37 1 46 VAL H 1 100 LEU O 2.000 . 2.000 1.949 1.839 2.010 0.010 3 0 "[ . 1 . 2]" 2
38 1 46 VAL N 1 100 LEU O 3.000 . 3.000 2.884 2.802 2.973 . 0 0 "[ . 1 . 2]" 2
39 1 103 LYS O 1 106 LYS H 2.000 . 2.000 1.990 1.905 2.012 0.012 4 0 "[ . 1 . 2]" 2
40 1 103 LYS O 1 106 LYS N 3.000 . 3.000 2.894 2.802 2.949 . 0 0 "[ . 1 . 2]" 2
41 1 103 LYS H 1 106 LYS O 2.000 . 2.000 1.940 1.854 2.009 0.009 5 0 "[ . 1 . 2]" 2
42 1 103 LYS N 1 106 LYS O 3.000 . 3.000 2.833 2.746 2.937 . 0 0 "[ . 1 . 2]" 2
43 1 31 PHE O 1 35 VAL H 2.000 . 2.000 1.972 1.880 2.008 0.008 16 0 "[ . 1 . 2]" 2
44 1 31 PHE O 1 35 VAL N 3.000 . 3.000 2.834 2.746 2.891 . 0 0 "[ . 1 . 2]" 2
45 1 32 ASP O 1 36 THR H 2.000 . 2.000 2.012 2.005 2.021 0.021 7 0 "[ . 1 . 2]" 2
46 1 32 ASP O 1 36 THR N 3.000 . 3.000 2.849 2.782 2.929 . 0 0 "[ . 1 . 2]" 2
47 1 62 GLN O 1 66 LEU H 2.000 . 2.000 2.022 2.012 2.038 0.038 20 0 "[ . 1 . 2]" 2
48 1 62 GLN O 1 66 LEU N 3.000 . 3.000 2.992 2.971 3.005 0.005 1 0 "[ . 1 . 2]" 2
49 1 63 LEU O 1 67 ALA H 2.000 . 2.000 1.943 1.838 2.006 0.006 8 0 "[ . 1 . 2]" 2
50 1 63 LEU O 1 67 ALA N 3.000 . 3.000 2.814 2.720 2.900 . 0 0 "[ . 1 . 2]" 2
51 1 66 LEU O 1 70 TYR H 2.000 . 2.000 1.867 1.772 1.944 . 0 0 "[ . 1 . 2]" 2
52 1 66 LEU O 1 70 TYR N 3.000 . 3.000 2.827 2.734 2.908 . 0 0 "[ . 1 . 2]" 2
53 1 86 ASP O 1 90 GLN H 2.000 . 2.000 1.890 1.814 1.998 . 0 0 "[ . 1 . 2]" 2
54 1 86 ASP O 1 90 GLN N 3.000 . 3.000 2.762 2.651 2.874 . 0 0 "[ . 1 . 2]" 2
55 1 87 VAL O 1 91 TYR H 2.000 . 2.000 1.998 1.911 2.013 0.013 13 0 "[ . 1 . 2]" 2
56 1 87 VAL O 1 91 TYR N 3.000 . 3.000 2.935 2.819 2.986 . 0 0 "[ . 1 . 2]" 2
57 1 115 ASP O 1 119 ILE H 2.000 . 2.000 1.973 1.794 2.019 0.019 8 0 "[ . 1 . 2]" 2
58 1 115 ASP O 1 119 ILE N 3.000 . 3.000 2.925 2.719 2.993 . 0 0 "[ . 1 . 2]" 2
59 1 116 ILE O 1 120 ILE H 2.000 . 2.000 2.010 2.002 2.018 0.018 4 0 "[ . 1 . 2]" 2
60 1 116 ILE O 1 120 ILE N 3.000 . 3.000 2.982 2.967 3.003 0.003 14 0 "[ . 1 . 2]" 2
61 1 118 LYS O 1 122 GLU H 2.000 . 2.000 2.005 1.925 2.025 0.025 12 0 "[ . 1 . 2]" 2
62 1 118 LYS O 1 122 GLU N 3.000 . 3.000 2.952 2.860 2.996 . 0 0 "[ . 1 . 2]" 2
63 1 119 ILE O 1 123 ILE H 2.000 . 2.000 1.885 1.825 1.986 . 0 0 "[ . 1 . 2]" 2
64 1 119 ILE O 1 123 ILE N 3.000 . 3.000 2.831 2.760 2.953 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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