NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
432206 |
2jrt   |
15344 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2jrt
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 2291
_Distance_constraint_stats_list.Viol_count 1434
_Distance_constraint_stats_list.Viol_total 1109.720
_Distance_constraint_stats_list.Viol_max 0.321
_Distance_constraint_stats_list.Viol_rms 0.0091
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0012
_Distance_constraint_stats_list.Viol_average_violations_only 0.0387
_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 2 TYR 0.639 0.302 2 0 "[ . 1 . 2]"
1 3 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 LYS 0.514 0.180 18 0 "[ . 1 . 2]"
1 5 ARG 0.891 0.321 16 0 "[ . 1 . 2]"
1 6 VAL 0.548 0.321 16 0 "[ . 1 . 2]"
1 7 ASP 0.096 0.096 3 0 "[ . 1 . 2]"
1 8 GLY 0.111 0.096 3 0 "[ . 1 . 2]"
1 9 PRO 0.252 0.103 6 0 "[ . 1 . 2]"
1 10 ARG 0.431 0.124 19 0 "[ . 1 . 2]"
1 11 GLN 1.344 0.120 8 0 "[ . 1 . 2]"
1 12 VAL 0.915 0.065 18 0 "[ . 1 . 2]"
1 13 THR 0.407 0.089 16 0 "[ . 1 . 2]"
1 14 LEU 5.131 0.132 19 0 "[ . 1 . 2]"
1 15 PRO 0.732 0.097 16 0 "[ . 1 . 2]"
1 16 ASP 0.467 0.069 20 0 "[ . 1 . 2]"
1 17 GLY 0.407 0.089 16 0 "[ . 1 . 2]"
1 18 THR 0.773 0.069 20 0 "[ . 1 . 2]"
1 19 VAL 3.228 0.122 20 0 "[ . 1 . 2]"
1 20 LEU 3.293 0.117 1 0 "[ . 1 . 2]"
1 21 SER 1.590 0.092 11 0 "[ . 1 . 2]"
1 22 ARG 1.016 0.124 19 0 "[ . 1 . 2]"
1 23 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 ASP 0.396 0.103 12 0 "[ . 1 . 2]"
1 25 LEU 2.540 0.099 8 0 "[ . 1 . 2]"
1 26 PRO 2.247 0.106 7 0 "[ . 1 . 2]"
1 27 PRO 0.621 0.126 18 0 "[ . 1 . 2]"
1 28 LEU 0.086 0.036 9 0 "[ . 1 . 2]"
1 29 ASP 0.759 0.103 7 0 "[ . 1 . 2]"
1 30 THR 2.723 0.170 19 0 "[ . 1 . 2]"
1 31 ARG 1.235 0.170 19 0 "[ . 1 . 2]"
1 32 ARG 0.494 0.085 5 0 "[ . 1 . 2]"
1 33 TRP 1.208 0.060 16 0 "[ . 1 . 2]"
1 34 VAL 0.797 0.085 5 0 "[ . 1 . 2]"
1 35 ALA 0.050 0.028 12 0 "[ . 1 . 2]"
1 36 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 ARG 1.517 0.092 5 0 "[ . 1 . 2]"
1 38 LYS 1.836 0.106 7 0 "[ . 1 . 2]"
1 39 ALA 0.366 0.052 12 0 "[ . 1 . 2]"
1 40 ALA 0.762 0.132 19 0 "[ . 1 . 2]"
1 41 VAL 0.199 0.047 1 0 "[ . 1 . 2]"
1 42 VAL 1.433 0.121 19 0 "[ . 1 . 2]"
1 43 LYS 0.569 0.097 16 0 "[ . 1 . 2]"
1 44 ALA 1.267 0.082 5 0 "[ . 1 . 2]"
1 45 VAL 0.711 0.089 11 0 "[ . 1 . 2]"
1 46 ILE 2.455 0.116 10 0 "[ . 1 . 2]"
1 47 HIS 1.401 0.078 19 0 "[ . 1 . 2]"
1 48 GLY 0.535 0.054 8 0 "[ . 1 . 2]"
1 49 LEU 0.755 0.056 2 0 "[ . 1 . 2]"
1 50 ILE 2.346 0.099 8 0 "[ . 1 . 2]"
1 51 THR 2.526 0.110 2 0 "[ . 1 . 2]"
1 52 GLU 2.811 0.139 6 0 "[ . 1 . 2]"
1 53 ARG 1.943 0.162 2 0 "[ . 1 . 2]"
1 54 GLU 1.606 0.098 9 0 "[ . 1 . 2]"
1 55 ALA 1.581 0.081 16 0 "[ . 1 . 2]"
1 56 LEU 3.596 0.162 2 0 "[ . 1 . 2]"
1 57 ASP 0.502 0.064 18 0 "[ . 1 . 2]"
1 58 ARG 2.284 0.069 14 0 "[ . 1 . 2]"
1 59 TYR 0.911 0.051 8 0 "[ . 1 . 2]"
1 60 SER 0.551 0.065 9 0 "[ . 1 . 2]"
1 61 LEU 1.143 0.076 16 0 "[ . 1 . 2]"
1 62 SER 2.616 0.119 18 0 "[ . 1 . 2]"
1 63 GLU 4.442 0.188 12 0 "[ . 1 . 2]"
1 64 GLU 0.279 0.062 6 0 "[ . 1 . 2]"
1 65 GLU 0.547 0.076 16 0 "[ . 1 . 2]"
1 66 PHE 0.809 0.060 7 0 "[ . 1 . 2]"
1 67 ALA 0.663 0.182 19 0 "[ . 1 . 2]"
1 68 LEU 0.340 0.112 15 0 "[ . 1 . 2]"
1 69 TRP 1.236 0.082 15 0 "[ . 1 . 2]"
1 70 ARG 2.648 0.116 10 0 "[ . 1 . 2]"
1 71 SER 0.168 0.070 3 0 "[ . 1 . 2]"
1 72 ALA 0.275 0.078 3 0 "[ . 1 . 2]"
1 73 VAL 0.849 0.088 19 0 "[ . 1 . 2]"
1 74 ALA 0.087 0.047 13 0 "[ . 1 . 2]"
1 75 ALA 0.551 0.088 19 0 "[ . 1 . 2]"
1 76 HIS 0.175 0.078 3 0 "[ . 1 . 2]"
1 77 GLY 0.209 0.055 3 0 "[ . 1 . 2]"
1 78 GLU 0.296 0.073 2 0 "[ . 1 . 2]"
1 79 LYS 0.447 0.073 2 0 "[ . 1 . 2]"
1 80 ALA 0.240 0.082 5 0 "[ . 1 . 2]"
1 81 LEU 1.514 0.135 16 0 "[ . 1 . 2]"
1 82 LYS 0.916 0.135 16 0 "[ . 1 . 2]"
1 83 VAL 0.274 0.059 17 0 "[ . 1 . 2]"
1 84 THR 2.475 0.223 17 0 "[ . 1 . 2]"
1 85 MET 2.012 0.107 12 0 "[ . 1 . 2]"
1 86 ILE 4.213 0.223 17 0 "[ . 1 . 2]"
1 87 GLN 0.018 0.007 7 0 "[ . 1 . 2]"
1 88 LYS 0.381 0.060 19 0 "[ . 1 . 2]"
1 89 TYR 1.475 0.107 7 0 "[ . 1 . 2]"
1 90 ARG 0.016 0.016 3 0 "[ . 1 . 2]"
1 91 GLN 1.897 0.161 13 0 "[ . 1 . 2]"
1 92 LEU 2.493 0.186 19 0 "[ . 1 . 2]"
1 93 HIS 0.814 0.186 19 0 "[ . 1 . 2]"
1 94 HIS 0.146 0.072 14 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 83 VAL HB 1 86 ILE MD 4.740 . 5.240 3.896 3.554 4.232 . 0 0 "[ . 1 . 2]" 1
2 1 85 MET HB2 1 86 ILE MD 5.310 . 5.766 3.588 2.674 4.709 . 0 0 "[ . 1 . 2]" 1
3 1 83 VAL HA 1 86 ILE MD 3.570 . 4.070 1.929 1.741 2.289 0.059 17 0 "[ . 1 . 2]" 1
4 1 86 ILE HB 1 86 ILE MD 3.410 . 3.865 2.257 2.192 2.304 . 0 0 "[ . 1 . 2]" 1
5 1 85 MET H 1 86 ILE MD 5.230 . 5.686 3.138 2.368 4.198 . 0 0 "[ . 1 . 2]" 1
6 1 86 ILE MD 1 88 LYS H 5.500 . 5.956 5.569 5.184 6.015 0.060 19 0 "[ . 1 . 2]" 1
7 1 86 ILE MD 1 89 TYR HE2 5.280 . 5.580 4.477 3.466 5.604 0.024 8 0 "[ . 1 . 2]" 1
8 1 50 ILE H 1 50 ILE MD 4.100 . 4.556 4.025 3.957 4.083 . 0 0 "[ . 1 . 2]" 1
9 1 50 ILE MD 1 59 TYR HD2 5.350 . 5.806 4.411 4.135 4.737 . 0 0 "[ . 1 . 2]" 1
10 1 50 ILE HB 1 50 ILE MD 3.150 . 3.605 2.359 2.337 2.383 . 0 0 "[ . 1 . 2]" 1
11 1 50 ILE HA 1 50 ILE MD 4.150 . 4.606 4.172 4.159 4.184 . 0 0 "[ . 1 . 2]" 1
12 1 50 ILE MD 1 51 THR HA 4.980 . 5.436 4.972 4.666 5.074 . 0 0 "[ . 1 . 2]" 1
13 1 50 ILE MD 1 59 TYR HE2 4.510 . 4.965 3.291 3.029 3.726 . 0 0 "[ . 1 . 2]" 1
14 1 50 ILE MD 1 52 GLU HA 5.040 . 5.496 4.336 4.184 4.473 . 0 0 "[ . 1 . 2]" 1
15 1 45 VAL HB 1 50 ILE MD 5.080 . 5.536 4.717 4.581 4.892 . 0 0 "[ . 1 . 2]" 1
16 1 50 ILE MD 1 55 ALA MB 3.070 . 3.526 2.000 1.827 2.206 . 0 0 "[ . 1 . 2]" 1
17 1 41 VAL MG1 1 50 ILE MD 3.540 . 3.996 2.632 2.451 2.860 . 0 0 "[ . 1 . 2]" 1
18 1 50 ILE MD 1 55 ALA HA 3.400 . 3.855 2.863 2.619 3.023 . 0 0 "[ . 1 . 2]" 1
19 1 44 ALA MB 1 50 ILE MD 3.170 . 3.625 2.554 2.425 2.674 . 0 0 "[ . 1 . 2]" 1
20 1 45 VAL HB 1 46 ILE MD 5.050 . 5.505 4.654 4.470 4.939 . 0 0 "[ . 1 . 2]" 1
21 1 46 ILE MD 1 70 ARG QG 4.470 . 4.925 4.794 4.420 4.989 0.064 13 0 "[ . 1 . 2]" 1
22 1 42 VAL MG2 1 46 ILE MD 2.670 . 3.125 2.035 1.904 2.162 . 0 0 "[ . 1 . 2]" 1
23 1 42 VAL HB 1 46 ILE MD 4.330 . 4.786 4.581 4.463 4.704 . 0 0 "[ . 1 . 2]" 1
24 1 46 ILE HB 1 46 ILE MD 3.020 . 3.476 2.442 2.390 2.486 . 0 0 "[ . 1 . 2]" 1
25 1 46 ILE MD 1 47 HIS H 4.730 . 5.186 4.839 4.635 5.016 . 0 0 "[ . 1 . 2]" 1
26 1 46 ILE MD 1 70 ARG QD 4.470 . 4.925 4.794 4.130 5.042 0.116 10 0 "[ . 1 . 2]" 1
27 1 43 LYS HA 1 46 ILE MD 3.400 . 3.855 2.744 2.272 3.232 . 0 0 "[ . 1 . 2]" 1
28 1 46 ILE MD 1 46 ILE MG 2.770 . 3.226 1.942 1.896 2.003 . 0 0 "[ . 1 . 2]" 1
29 1 46 ILE MD 1 66 PHE HZ 4.960 . 5.416 4.715 4.420 5.304 . 0 0 "[ . 1 . 2]" 1
30 1 43 LYS QE 1 46 ILE MD 5.060 . 5.516 4.968 4.513 5.532 0.017 2 0 "[ . 1 . 2]" 1
31 1 46 ILE H 1 46 ILE MD 3.780 . 4.235 3.614 3.488 3.737 . 0 0 "[ . 1 . 2]" 1
32 1 46 ILE MG 1 91 GLN HE22 5.500 . 5.956 3.661 2.376 5.642 . 0 0 "[ . 1 . 2]" 1
33 1 46 ILE HG13 1 46 ILE MG 3.460 . 3.915 3.206 3.198 3.214 . 0 0 "[ . 1 . 2]" 1
34 1 46 ILE MG 1 91 GLN HE21 5.500 . 5.956 3.768 2.063 5.443 . 0 0 "[ . 1 . 2]" 1
35 1 46 ILE HA 1 46 ILE MG 3.110 . 3.566 2.494 2.424 2.736 . 0 0 "[ . 1 . 2]" 1
36 1 46 ILE HG12 1 46 ILE MG 3.260 . 3.716 2.396 2.355 2.426 . 0 0 "[ . 1 . 2]" 1
37 1 46 ILE MG 1 47 HIS HD2 4.800 . 5.255 4.846 3.680 5.298 0.043 2 0 "[ . 1 . 2]" 1
38 1 46 ILE H 1 46 ILE MG 3.700 . 4.155 3.743 3.595 3.769 . 0 0 "[ . 1 . 2]" 1
39 1 46 ILE MG 1 47 HIS HA 4.250 . 4.706 3.374 3.150 3.627 . 0 0 "[ . 1 . 2]" 1
40 1 42 VAL MG2 1 46 ILE MG 4.270 . 4.726 4.394 4.213 4.553 . 0 0 "[ . 1 . 2]" 1
41 1 46 ILE MG 1 91 GLN QG 5.500 . 5.956 3.135 2.147 4.580 . 0 0 "[ . 1 . 2]" 1
42 1 43 LYS HA 1 46 ILE MG 4.010 . 4.465 3.747 2.927 4.057 . 0 0 "[ . 1 . 2]" 1
43 1 46 ILE MG 1 74 ALA HA 5.500 . 6.000 5.475 4.749 6.034 0.034 13 0 "[ . 1 . 2]" 1
44 1 46 ILE MG 1 47 HIS HB3 5.040 . 5.496 5.128 4.518 5.381 . 0 0 "[ . 1 . 2]" 1
45 1 15 PRO HG3 1 46 ILE MG 5.500 . 5.956 5.535 4.830 5.996 0.040 18 0 "[ . 1 . 2]" 1
46 1 86 ILE HA 1 86 ILE MG 3.250 . 3.705 2.466 2.377 2.592 . 0 0 "[ . 1 . 2]" 1
47 1 86 ILE MG 1 90 ARG QD 4.270 . 4.726 3.117 1.895 4.064 . 0 0 "[ . 1 . 2]" 1
48 1 86 ILE MG 1 89 TYR HB3 4.920 . 5.376 4.669 4.094 5.305 . 0 0 "[ . 1 . 2]" 1
49 1 86 ILE MG 1 90 ARG HB2 5.040 . 5.496 4.035 3.038 4.535 . 0 0 "[ . 1 . 2]" 1
50 1 86 ILE MG 1 90 ARG HB3 5.040 . 5.496 4.540 2.370 5.152 . 0 0 "[ . 1 . 2]" 1
51 1 86 ILE HG12 1 86 ILE MG 2.960 . 3.415 2.161 2.137 2.210 . 0 0 "[ . 1 . 2]" 1
52 1 55 ALA MB 1 61 LEU MD1 4.500 . 4.956 3.048 2.561 3.508 . 0 0 "[ . 1 . 2]" 1
53 1 55 ALA MB 1 59 TYR HD2 4.360 . 4.815 2.725 2.340 3.169 . 0 0 "[ . 1 . 2]" 1
54 1 41 VAL HB 1 55 ALA MB 4.690 . 5.146 4.442 4.277 4.586 . 0 0 "[ . 1 . 2]" 1
55 1 54 GLU HB3 1 55 ALA MB 3.950 . 4.405 3.938 3.825 4.105 . 0 0 "[ . 1 . 2]" 1
56 1 55 ALA MB 1 56 LEU HG 3.750 . 4.206 3.138 2.994 3.268 . 0 0 "[ . 1 . 2]" 1
57 1 45 VAL HB 1 55 ALA MB 4.880 . 5.335 4.748 4.428 4.977 . 0 0 "[ . 1 . 2]" 1
58 1 64 GLU HA 1 67 ALA MB 3.100 . 3.556 2.532 2.177 3.134 . 0 0 "[ . 1 . 2]" 1
59 1 67 ALA MB 1 68 LEU HA 3.980 . 4.436 3.883 3.830 3.969 . 0 0 "[ . 1 . 2]" 1
60 1 55 ALA MB 1 59 TYR HE2 4.690 . 5.146 3.301 2.922 3.697 . 0 0 "[ . 1 . 2]" 1
61 1 55 ALA MB 1 66 PHE QD 4.960 . 5.416 3.318 3.063 3.617 . 0 0 "[ . 1 . 2]" 1
62 1 86 ILE MG 1 89 TYR HE2 5.500 . 5.800 5.265 4.684 5.812 0.012 8 0 "[ . 1 . 2]" 1
63 1 55 ALA MB 1 66 PHE QE 4.070 . 4.525 3.020 2.737 3.379 . 0 0 "[ . 1 . 2]" 1
64 1 54 GLU H 1 55 ALA MB 4.470 . 4.925 4.262 4.088 4.416 . 0 0 "[ . 1 . 2]" 1
65 1 41 VAL MG1 1 55 ALA MB 2.920 . 3.375 2.109 2.011 2.236 . 0 0 "[ . 1 . 2]" 1
66 1 55 ALA MB 1 58 ARG HE 5.230 . 5.686 5.357 4.767 5.720 0.035 16 0 "[ . 1 . 2]" 1
67 1 66 PHE HB2 1 67 ALA MB 5.500 . 5.956 5.379 5.284 5.428 . 0 0 "[ . 1 . 2]" 1
68 1 67 ALA MB 1 69 TRP H 4.480 . 4.936 4.548 4.468 4.603 . 0 0 "[ . 1 . 2]" 1
69 1 66 PHE QD 1 67 ALA MB 4.710 . 5.166 4.377 4.123 4.512 . 0 0 "[ . 1 . 2]" 1
70 1 63 GLU QG 1 67 ALA MB 4.120 . 4.576 3.669 2.589 4.758 0.182 19 0 "[ . 1 . 2]" 1
71 1 54 GLU HB2 1 55 ALA MB 5.300 . 5.755 5.297 5.212 5.420 . 0 0 "[ . 1 . 2]" 1
72 1 45 VAL HA 1 55 ALA MB 5.500 . 5.956 5.162 4.973 5.465 . 0 0 "[ . 1 . 2]" 1
73 1 50 ILE MG 1 55 ALA H 5.500 . 5.956 5.279 5.090 5.451 . 0 0 "[ . 1 . 2]" 1
74 1 50 ILE MG 1 55 ALA HA 5.500 . 5.956 5.147 4.766 5.413 . 0 0 "[ . 1 . 2]" 1
75 1 50 ILE MG 1 51 THR H 3.900 . 4.356 3.731 3.613 3.833 . 0 0 "[ . 1 . 2]" 1
76 1 50 ILE MG 1 58 ARG HE 5.200 . 5.655 4.878 3.835 5.662 0.006 2 0 "[ . 1 . 2]" 1
77 1 50 ILE MG 1 54 GLU HB2 5.200 . 5.655 4.827 4.396 5.282 . 0 0 "[ . 1 . 2]" 1
78 1 22 ARG HA 1 50 ILE MG 4.610 . 5.065 3.750 3.181 4.187 . 0 0 "[ . 1 . 2]" 1
79 1 49 LEU HA 1 50 ILE MG 4.750 . 5.206 4.208 4.123 4.295 . 0 0 "[ . 1 . 2]" 1
80 1 25 LEU MD1 1 50 ILE MG 2.800 . 3.256 1.919 1.756 2.075 0.044 5 0 "[ . 1 . 2]" 1
81 1 50 ILE HA 1 50 ILE MG 3.200 . 3.655 2.414 2.377 2.460 . 0 0 "[ . 1 . 2]" 1
82 1 44 ALA HA 1 50 ILE MG 4.910 . 5.365 4.704 4.492 4.917 . 0 0 "[ . 1 . 2]" 1
83 1 49 LEU HG 1 50 ILE MG 3.400 . 3.855 2.250 1.929 2.482 . 0 0 "[ . 1 . 2]" 1
84 1 22 ARG QD 1 50 ILE MG 4.280 . 4.735 3.627 3.188 4.720 . 0 0 "[ . 1 . 2]" 1
85 1 45 VAL HA 1 50 ILE MG 5.320 . 5.775 4.851 4.679 5.057 . 0 0 "[ . 1 . 2]" 1
86 1 50 ILE MG 1 54 GLU HG3 4.750 . 5.206 4.177 3.301 5.180 . 0 0 "[ . 1 . 2]" 1
87 1 50 ILE MG 1 54 GLU HG2 4.750 . 5.206 3.371 2.484 4.609 . 0 0 "[ . 1 . 2]" 1
88 1 36 SER HA 1 39 ALA MB 3.030 . 3.486 2.732 2.340 3.180 . 0 0 "[ . 1 . 2]" 1
89 1 39 ALA MB 1 73 VAL MG1 2.930 . 3.385 2.576 2.116 3.236 . 0 0 "[ . 1 . 2]" 1
90 1 35 ALA MB 1 36 SER H 4.260 . 4.715 2.527 2.356 2.633 . 0 0 "[ . 1 . 2]" 1
91 1 25 LEU MD2 1 40 ALA MB 2.970 . 3.425 3.083 2.483 3.419 . 0 0 "[ . 1 . 2]" 1
92 1 20 LEU HA 1 40 ALA MB 5.500 . 5.956 5.534 5.158 5.835 . 0 0 "[ . 1 . 2]" 1
93 1 40 ALA MB 1 41 VAL H 3.170 . 3.625 2.516 2.417 2.656 . 0 0 "[ . 1 . 2]" 1
94 1 26 PRO HD2 1 40 ALA MB 3.380 . 3.836 3.204 2.926 3.552 . 0 0 "[ . 1 . 2]" 1
95 1 40 ALA MB 1 42 VAL H 4.900 . 5.356 4.676 4.597 4.800 . 0 0 "[ . 1 . 2]" 1
96 1 34 VAL H 1 34 VAL MG2 3.010 . 3.466 2.016 1.869 2.248 . 0 0 "[ . 1 . 2]" 1
97 1 34 VAL MG2 1 37 ARG HG3 3.160 . 3.615 2.076 1.906 2.451 . 0 0 "[ . 1 . 2]" 1
98 1 34 VAL MG2 1 37 ARG HD2 3.610 . 4.065 2.467 2.106 2.814 . 0 0 "[ . 1 . 2]" 1
99 1 34 VAL MG2 1 36 SER H 4.830 . 5.286 2.566 2.355 2.773 . 0 0 "[ . 1 . 2]" 1
100 1 33 TRP HA 1 34 VAL MG2 3.840 . 4.295 3.712 3.575 3.823 . 0 0 "[ . 1 . 2]" 1
101 1 40 ALA MB 1 43 LYS H 5.240 . 5.695 4.867 4.795 4.956 . 0 0 "[ . 1 . 2]" 1
102 1 34 VAL MG2 1 37 ARG H 3.230 . 3.685 1.943 1.833 2.144 . 0 0 "[ . 1 . 2]" 1
103 1 22 ARG H 1 23 ALA MB 4.680 . 5.135 4.247 4.148 4.384 . 0 0 "[ . 1 . 2]" 1
104 1 38 LYS HA 1 40 ALA MB 4.990 . 5.445 4.856 4.724 5.073 . 0 0 "[ . 1 . 2]" 1
105 1 20 LEU MD1 1 40 ALA MB 3.390 . 3.845 2.583 2.304 2.941 . 0 0 "[ . 1 . 2]" 1
106 1 34 VAL MG2 1 36 SER QB 4.390 . 4.845 2.705 2.248 3.585 . 0 0 "[ . 1 . 2]" 1
107 1 34 VAL MG2 1 37 ARG HG2 3.480 . 3.935 3.484 3.316 3.824 . 0 0 "[ . 1 . 2]" 1
108 1 34 VAL MG2 1 35 ALA HA 5.300 . 5.755 4.516 4.391 4.630 . 0 0 "[ . 1 . 2]" 1
109 1 34 VAL MG2 1 37 ARG HD3 4.510 . 4.965 3.813 3.543 4.175 . 0 0 "[ . 1 . 2]" 1
110 1 73 VAL H 1 74 ALA MB 4.480 . 4.936 4.281 4.132 4.493 . 0 0 "[ . 1 . 2]" 1
111 1 74 ALA MB 1 75 ALA H 3.530 . 3.986 2.709 2.423 3.505 . 0 0 "[ . 1 . 2]" 1
112 1 71 SER H 1 72 ALA MB 4.310 . 4.766 4.207 4.096 4.337 . 0 0 "[ . 1 . 2]" 1
113 1 75 ALA MB 1 76 HIS H 3.350 . 3.806 3.294 1.977 3.611 . 0 0 "[ . 1 . 2]" 1
114 1 26 PRO HG3 1 30 THR MG 5.400 . 5.856 4.645 3.755 5.620 . 0 0 "[ . 1 . 2]" 1
115 1 30 THR MG 1 37 ARG HD2 4.740 . 5.195 2.508 1.964 3.698 . 0 0 "[ . 1 . 2]" 1
116 1 30 THR MG 1 37 ARG HD3 4.330 . 4.786 2.414 1.766 3.648 0.034 11 0 "[ . 1 . 2]" 1
117 1 30 THR MG 1 37 ARG HB2 5.500 . 5.956 3.582 3.146 4.566 . 0 0 "[ . 1 . 2]" 1
118 1 30 THR MG 1 37 ARG HB3 5.500 . 5.956 3.317 2.982 3.980 . 0 0 "[ . 1 . 2]" 1
119 1 30 THR MG 1 37 ARG HG2 5.140 . 5.595 4.366 3.910 5.425 . 0 0 "[ . 1 . 2]" 1
120 1 30 THR MG 1 33 TRP HE3 5.500 . 5.956 3.450 3.110 3.953 . 0 0 "[ . 1 . 2]" 1
121 1 30 THR MG 1 59 TYR HE1 5.500 . 5.956 5.316 2.962 6.006 0.051 8 0 "[ . 1 . 2]" 1
122 1 30 THR MG 1 69 TRP HH2 5.000 . 5.456 5.168 4.675 5.468 0.013 10 0 "[ . 1 . 2]" 1
123 1 12 VAL MG2 1 50 ILE H 5.500 . 5.956 4.890 4.792 5.042 . 0 0 "[ . 1 . 2]" 1
124 1 12 VAL MG2 1 47 HIS HD2 5.500 . 5.956 2.968 2.764 3.250 . 0 0 "[ . 1 . 2]" 1
125 1 12 VAL MG2 1 49 LEU HB2 3.280 . 3.780 2.023 1.931 2.111 . 0 0 "[ . 1 . 2]" 1
126 1 12 VAL MG2 1 47 HIS HB2 3.780 . 4.280 2.112 1.892 2.326 . 0 0 "[ . 1 . 2]" 1
127 1 12 VAL MG2 1 20 LEU HB3 3.230 . 3.685 2.047 1.827 2.231 . 0 0 "[ . 1 . 2]" 1
128 1 12 VAL MG2 1 49 LEU HA 3.760 . 4.060 3.852 3.707 3.969 . 0 0 "[ . 1 . 2]" 1
129 1 12 VAL MG2 1 47 HIS HB3 3.770 . 4.226 2.784 2.594 3.003 . 0 0 "[ . 1 . 2]" 1
130 1 11 GLN HA 1 12 VAL MG2 4.030 . 4.485 3.569 3.463 3.629 . 0 0 "[ . 1 . 2]" 1
131 1 12 VAL MG2 1 49 LEU HB3 3.670 . 4.170 3.147 3.045 3.275 . 0 0 "[ . 1 . 2]" 1
132 1 12 VAL HA 1 12 VAL MG2 3.510 . 3.966 3.210 3.204 3.217 . 0 0 "[ . 1 . 2]" 1
133 1 11 GLN H 1 12 VAL MG2 5.450 . 5.905 5.166 4.918 5.319 . 0 0 "[ . 1 . 2]" 1
134 1 12 VAL MG2 1 44 ALA H 5.110 . 5.565 5.012 4.875 5.184 . 0 0 "[ . 1 . 2]" 1
135 1 12 VAL MG2 1 49 LEU MD2 3.010 . 3.466 2.245 2.012 2.552 . 0 0 "[ . 1 . 2]" 1
136 1 12 VAL MG2 1 43 LYS HB3 4.460 . 4.916 4.581 4.383 4.764 . 0 0 "[ . 1 . 2]" 1
137 1 12 VAL MG2 1 20 LEU HB2 3.640 . 4.095 3.502 3.244 3.719 . 0 0 "[ . 1 . 2]" 1
138 1 44 ALA MB 1 49 LEU MD2 2.890 . 3.345 1.958 1.785 2.097 0.015 19 0 "[ . 1 . 2]" 1
139 1 44 ALA MB 1 49 LEU HB2 4.240 . 4.695 3.584 3.388 3.797 . 0 0 "[ . 1 . 2]" 1
140 1 20 LEU MD2 1 44 ALA MB 3.030 . 3.486 1.940 1.785 2.283 0.015 6 0 "[ . 1 . 2]" 1
141 1 44 ALA MB 1 47 HIS HB2 5.070 . 5.525 4.798 4.676 5.016 . 0 0 "[ . 1 . 2]" 1
142 1 12 VAL MG2 1 44 ALA HA 4.190 . 4.646 2.883 2.712 3.060 . 0 0 "[ . 1 . 2]" 1
143 1 41 VAL MG2 1 44 ALA MB 4.370 . 4.826 4.289 4.034 4.431 . 0 0 "[ . 1 . 2]" 1
144 1 44 ALA MB 1 50 ILE HA 5.170 . 5.626 4.848 4.626 5.056 . 0 0 "[ . 1 . 2]" 1
145 1 25 LEU MD2 1 44 ALA MB 2.930 . 3.385 2.043 1.766 2.318 0.034 11 0 "[ . 1 . 2]" 1
146 1 43 LYS H 1 44 ALA MB 4.270 . 4.726 4.263 4.223 4.296 . 0 0 "[ . 1 . 2]" 1
147 1 20 LEU HG 1 44 ALA MB 3.810 . 4.266 3.382 3.223 3.538 . 0 0 "[ . 1 . 2]" 1
148 1 44 ALA MB 1 50 ILE MG 2.980 . 3.435 2.692 2.432 2.892 . 0 0 "[ . 1 . 2]" 1
149 1 25 LEU HG 1 44 ALA MB 3.200 . 3.655 3.688 3.533 3.737 0.082 5 0 "[ . 1 . 2]" 1
150 1 40 ALA HA 1 44 ALA MB 4.680 . 5.135 4.526 4.376 4.701 . 0 0 "[ . 1 . 2]" 1
151 1 44 ALA MB 1 50 ILE QG 3.660 . 4.115 1.972 1.878 2.144 . 0 0 "[ . 1 . 2]" 1
152 1 83 VAL HA 1 83 VAL MG1 3.270 . 3.726 3.216 3.211 3.221 . 0 0 "[ . 1 . 2]" 1
153 1 82 LYS HA 1 83 VAL MG1 4.320 . 4.775 4.154 4.054 4.293 . 0 0 "[ . 1 . 2]" 1
154 1 83 VAL MG1 1 84 THR HA 4.690 . 5.146 3.381 3.246 3.660 . 0 0 "[ . 1 . 2]" 1
155 1 39 ALA HA 1 73 VAL MG1 3.200 . 3.655 2.582 1.976 3.428 . 0 0 "[ . 1 . 2]" 1
156 1 73 VAL H 1 73 VAL MG1 3.790 . 4.246 3.801 3.760 3.864 . 0 0 "[ . 1 . 2]" 1
157 1 43 LYS H 1 73 VAL MG1 4.780 . 5.235 4.287 3.788 4.720 . 0 0 "[ . 1 . 2]" 1
158 1 19 VAL H 1 19 VAL MG2 3.250 . 3.705 2.662 2.542 2.813 . 0 0 "[ . 1 . 2]" 1
159 1 11 GLN HE21 1 19 VAL MG2 4.680 . 5.135 4.842 3.897 5.256 0.120 8 0 "[ . 1 . 2]" 1
160 1 45 VAL MG1 1 51 THR HA 3.750 . 4.206 2.735 2.351 2.840 . 0 0 "[ . 1 . 2]" 1
161 1 45 VAL MG1 1 52 GLU HA 3.450 . 3.905 2.509 2.080 3.014 . 0 0 "[ . 1 . 2]" 1
162 1 45 VAL MG1 1 66 PHE QE 3.720 . 4.175 3.145 2.794 3.445 . 0 0 "[ . 1 . 2]" 1
163 1 45 VAL MG1 1 46 ILE HA 3.940 . 4.396 3.436 3.224 3.569 . 0 0 "[ . 1 . 2]" 1
164 1 45 VAL H 1 45 VAL MG1 3.840 . 4.295 3.773 3.744 3.785 . 0 0 "[ . 1 . 2]" 1
165 1 45 VAL MG1 1 52 GLU HG2 3.860 . 4.315 3.953 3.089 4.356 0.040 4 0 "[ . 1 . 2]" 1
166 1 18 THR MG 1 20 LEU H 5.500 . 5.956 4.919 4.447 5.975 0.019 14 0 "[ . 1 . 2]" 1
167 1 45 VAL MG1 1 52 GLU HG3 3.390 . 3.845 2.668 1.722 3.277 0.078 18 0 "[ . 1 . 2]" 1
168 1 45 VAL MG1 1 51 THR HB 4.390 . 4.845 4.839 4.475 4.934 0.089 11 0 "[ . 1 . 2]" 1
169 1 45 VAL MG1 1 66 PHE QD 4.920 . 5.376 4.663 4.355 4.915 . 0 0 "[ . 1 . 2]" 1
170 1 45 VAL MG1 1 66 PHE HZ 3.810 . 4.266 2.852 2.530 3.202 . 0 0 "[ . 1 . 2]" 1
171 1 12 VAL MG1 1 49 LEU HA 3.370 . 3.826 2.562 2.377 2.686 . 0 0 "[ . 1 . 2]" 1
172 1 11 GLN H 1 12 VAL MG1 4.970 . 5.425 3.958 3.710 4.182 . 0 0 "[ . 1 . 2]" 1
173 1 18 THR H 1 18 THR MG 3.820 . 4.275 3.734 3.308 4.014 . 0 0 "[ . 1 . 2]" 1
174 1 11 GLN HA 1 12 VAL MG1 4.390 . 4.845 3.747 3.633 3.874 . 0 0 "[ . 1 . 2]" 1
175 1 12 VAL MG1 1 48 GLY HA2 4.460 . 4.916 4.754 4.422 4.918 0.002 10 0 "[ . 1 . 2]" 1
176 1 18 THR MG 1 19 VAL H 3.190 . 3.690 1.898 1.775 2.640 0.025 20 0 "[ . 1 . 2]" 1
177 1 18 THR HA 1 18 THR MG 2.730 . 3.185 2.264 2.148 2.361 . 0 0 "[ . 1 . 2]" 1
178 1 12 VAL HA 1 12 VAL MG1 3.120 . 3.576 2.310 2.281 2.333 . 0 0 "[ . 1 . 2]" 1
179 1 12 VAL MG1 1 49 LEU H 3.570 . 4.025 2.873 2.545 3.259 . 0 0 "[ . 1 . 2]" 1
180 1 14 LEU H 1 18 THR MG 4.950 . 5.405 4.916 4.595 5.416 0.011 15 0 "[ . 1 . 2]" 1
181 1 13 THR MG 1 15 PRO HA 4.880 . 5.335 4.406 3.959 4.557 . 0 0 "[ . 1 . 2]" 1
182 1 16 ASP H 1 18 THR MG 5.500 . 6.000 5.984 5.625 6.069 0.069 20 0 "[ . 1 . 2]" 1
183 1 45 VAL MG1 1 52 GLU HB2 3.510 . 3.966 2.380 2.070 3.715 . 0 0 "[ . 1 . 2]" 1
184 1 11 GLN HB2 1 19 VAL MG1 3.870 . 4.326 2.350 1.991 2.786 . 0 0 "[ . 1 . 2]" 1
185 1 12 VAL H 1 19 VAL MG1 3.870 . 4.326 3.637 3.241 3.933 . 0 0 "[ . 1 . 2]" 1
186 1 13 THR MG 1 17 GLY HA2 3.290 . 3.746 3.305 2.383 3.517 . 0 0 "[ . 1 . 2]" 1
187 1 13 THR MG 1 14 LEU H 3.270 . 3.726 2.475 2.257 2.839 . 0 0 "[ . 1 . 2]" 1
188 1 19 VAL MG1 1 21 SER H 4.280 . 4.735 3.423 3.123 3.814 . 0 0 "[ . 1 . 2]" 1
189 1 11 GLN HA 1 19 VAL MG1 4.650 . 5.106 4.016 3.588 4.383 . 0 0 "[ . 1 . 2]" 1
190 1 19 VAL MG1 1 21 SER HA 4.890 . 5.345 4.004 3.816 4.236 . 0 0 "[ . 1 . 2]" 1
191 1 19 VAL MG1 1 21 SER HB2 4.150 . 4.606 4.621 4.338 4.698 0.092 11 0 "[ . 1 . 2]" 1
192 1 13 THR MG 1 18 THR H 4.760 . 5.215 4.030 3.083 4.556 . 0 0 "[ . 1 . 2]" 1
193 1 19 VAL MG1 1 21 SER HB3 4.150 . 4.606 3.388 2.880 4.667 0.061 12 0 "[ . 1 . 2]" 1
194 1 34 VAL H 1 34 VAL MG1 3.270 . 3.726 2.578 2.286 3.058 . 0 0 "[ . 1 . 2]" 1
195 1 34 VAL HA 1 34 VAL MG1 3.120 . 3.576 2.353 2.311 2.389 . 0 0 "[ . 1 . 2]" 1
196 1 33 TRP HA 1 34 VAL MG1 4.260 . 4.715 3.892 3.594 4.071 . 0 0 "[ . 1 . 2]" 1
197 1 34 VAL MG1 1 37 ARG HD2 5.110 . 5.565 3.940 3.475 4.217 . 0 0 "[ . 1 . 2]" 1
198 1 84 THR HA 1 84 THR MG 2.880 . 3.336 2.294 2.231 2.352 . 0 0 "[ . 1 . 2]" 1
199 1 51 THR MG 1 55 ALA H 5.170 . 5.626 3.798 3.703 3.866 . 0 0 "[ . 1 . 2]" 1
200 1 51 THR MG 1 53 ARG H 3.880 . 4.335 2.955 2.497 3.199 . 0 0 "[ . 1 . 2]" 1
201 1 51 THR H 1 51 THR MG 3.050 . 3.506 1.942 1.794 2.183 0.006 18 0 "[ . 1 . 2]" 1
202 1 51 THR MG 1 52 GLU H 3.780 . 4.235 3.641 3.315 3.839 . 0 0 "[ . 1 . 2]" 1
203 1 51 THR HA 1 51 THR MG 3.290 . 3.746 3.213 3.197 3.227 . 0 0 "[ . 1 . 2]" 1
204 1 39 ALA MB 1 73 VAL MG2 3.110 . 3.410 2.686 2.396 3.000 . 0 0 "[ . 1 . 2]" 1
205 1 39 ALA H 1 73 VAL MG2 4.480 . 4.780 3.607 3.120 4.215 . 0 0 "[ . 1 . 2]" 1
206 1 39 ALA HA 1 73 VAL MG2 2.970 . 3.270 2.227 1.848 2.477 . 0 0 "[ . 1 . 2]" 1
207 1 51 THR MG 1 53 ARG HB3 3.620 . 4.076 3.711 2.764 4.160 0.084 20 0 "[ . 1 . 2]" 1
208 1 51 THR MG 1 52 GLU HB2 4.960 . 5.416 5.340 4.411 5.526 0.110 2 0 "[ . 1 . 2]" 1
209 1 69 TRP HB2 1 73 VAL MG2 5.080 . 5.536 4.820 4.551 5.098 . 0 0 "[ . 1 . 2]" 1
210 1 69 TRP HB3 1 73 VAL MG2 4.840 . 5.295 3.558 3.264 3.909 . 0 0 "[ . 1 . 2]" 1
211 1 43 LYS H 1 73 VAL MG2 4.760 . 5.215 5.024 4.556 5.252 0.036 19 0 "[ . 1 . 2]" 1
212 1 43 LYS QE 1 73 VAL MG2 4.510 . 4.965 4.207 3.585 4.618 . 0 0 "[ . 1 . 2]" 1
213 1 73 VAL MG2 1 74 ALA H 4.250 . 4.706 3.783 3.653 3.905 . 0 0 "[ . 1 . 2]" 1
214 1 42 VAL H 1 73 VAL MG2 4.950 . 5.405 4.669 4.246 4.996 . 0 0 "[ . 1 . 2]" 1
215 1 70 ARG H 1 73 VAL MG2 5.360 . 5.815 4.944 4.781 5.140 . 0 0 "[ . 1 . 2]" 1
216 1 40 ALA H 1 73 VAL MG2 5.500 . 5.956 5.170 4.824 5.530 . 0 0 "[ . 1 . 2]" 1
217 1 41 VAL MG1 1 61 LEU MD1 4.080 . 4.536 2.924 2.499 3.315 . 0 0 "[ . 1 . 2]" 1
218 1 41 VAL MG1 1 69 TRP HZ3 3.770 . 4.226 2.360 2.156 2.614 . 0 0 "[ . 1 . 2]" 1
219 1 41 VAL MG1 1 59 TYR HD2 4.040 . 4.496 2.832 2.494 3.321 . 0 0 "[ . 1 . 2]" 1
220 1 41 VAL HA 1 41 VAL MG1 3.120 . 3.576 2.405 2.382 2.444 . 0 0 "[ . 1 . 2]" 1
221 1 41 VAL MG1 1 66 PHE HZ 3.930 . 4.385 4.114 3.601 4.397 0.011 9 0 "[ . 1 . 2]" 1
222 1 41 VAL MG1 1 42 VAL HA 3.850 . 4.306 3.236 3.104 3.319 . 0 0 "[ . 1 . 2]" 1
223 1 42 VAL MG1 1 70 ARG HB3 4.770 . 5.226 4.412 4.031 4.766 . 0 0 "[ . 1 . 2]" 1
224 1 42 VAL MG1 1 46 ILE MD 3.130 . 3.586 3.058 2.862 3.416 . 0 0 "[ . 1 . 2]" 1
225 1 61 LEU MD2 1 69 TRP HH2 3.270 . 3.726 3.117 2.480 3.543 . 0 0 "[ . 1 . 2]" 1
226 1 61 LEU MD2 1 66 PHE HA 5.500 . 5.956 5.236 4.855 5.686 . 0 0 "[ . 1 . 2]" 1
227 1 42 VAL HA 1 42 VAL MG1 3.300 . 3.756 3.221 3.210 3.229 . 0 0 "[ . 1 . 2]" 1
228 1 61 LEU MD2 1 65 GLU HG2 3.680 . 4.180 1.916 1.751 2.274 0.049 4 0 "[ . 1 . 2]" 1
229 1 61 LEU HB3 1 61 LEU MD2 3.350 . 3.806 2.350 2.320 2.399 . 0 0 "[ . 1 . 2]" 1
230 1 61 LEU HA 1 61 LEU MD2 3.000 . 3.455 2.084 2.015 2.154 . 0 0 "[ . 1 . 2]" 1
231 1 61 LEU MD2 1 66 PHE QD 5.320 . 5.775 5.194 4.786 5.701 . 0 0 "[ . 1 . 2]" 1
232 1 59 TYR HB3 1 61 LEU MD2 3.760 . 4.215 2.986 2.297 3.454 . 0 0 "[ . 1 . 2]" 1
233 1 61 LEU MD2 1 66 PHE H 5.060 . 5.516 4.919 4.575 5.139 . 0 0 "[ . 1 . 2]" 1
234 1 61 LEU MD2 1 65 GLU HB2 4.010 . 4.465 3.919 3.540 4.250 . 0 0 "[ . 1 . 2]" 1
235 1 61 LEU MD2 1 69 TRP HE1 4.780 . 5.235 4.096 3.720 4.535 . 0 0 "[ . 1 . 2]" 1
236 1 61 LEU HB2 1 61 LEU MD2 3.230 . 3.685 3.197 3.190 3.202 . 0 0 "[ . 1 . 2]" 1
237 1 59 TYR HB2 1 61 LEU MD2 4.240 . 4.695 3.441 2.843 3.794 . 0 0 "[ . 1 . 2]" 1
238 1 61 LEU MD2 1 65 GLU HG3 3.910 . 4.365 2.995 2.781 3.288 . 0 0 "[ . 1 . 2]" 1
239 1 59 TYR HD2 1 61 LEU MD2 5.290 . 5.746 4.873 4.271 5.427 . 0 0 "[ . 1 . 2]" 1
240 1 42 VAL MG1 1 46 ILE HG13 4.440 . 4.896 4.286 4.114 4.668 . 0 0 "[ . 1 . 2]" 1
241 1 55 ALA MB 1 56 LEU MD2 3.750 . 4.206 3.367 3.117 3.569 . 0 0 "[ . 1 . 2]" 1
242 1 56 LEU MD2 1 66 PHE QE 4.820 . 5.275 4.561 4.333 4.945 . 0 0 "[ . 1 . 2]" 1
243 1 56 LEU MD2 1 63 GLU HA 3.400 . 3.855 2.769 2.457 3.198 . 0 0 "[ . 1 . 2]" 1
244 1 56 LEU MD2 1 61 LEU HB2 3.430 . 3.930 2.119 1.843 2.495 . 0 0 "[ . 1 . 2]" 1
245 1 56 LEU HA 1 56 LEU MD2 3.230 . 3.685 2.120 2.045 2.221 . 0 0 "[ . 1 . 2]" 1
246 1 56 LEU MD2 1 66 PHE HB2 3.420 . 3.875 2.010 1.776 2.250 0.024 1 0 "[ . 1 . 2]" 1
247 1 56 LEU MD2 1 66 PHE HB3 3.450 . 3.905 2.586 2.156 2.843 . 0 0 "[ . 1 . 2]" 1
248 1 56 LEU MD2 1 61 LEU HB3 3.660 . 4.115 2.812 2.645 3.064 . 0 0 "[ . 1 . 2]" 1
249 1 56 LEU MD2 1 63 GLU HB2 5.500 . 5.956 4.449 3.994 5.365 . 0 0 "[ . 1 . 2]" 1
250 1 56 LEU MD2 1 65 GLU HG3 5.500 . 5.956 5.024 4.594 5.430 . 0 0 "[ . 1 . 2]" 1
251 1 56 LEU HB2 1 56 LEU MD2 3.450 . 3.905 3.196 3.190 3.202 . 0 0 "[ . 1 . 2]" 1
252 1 56 LEU HB3 1 56 LEU MD2 3.380 . 3.836 2.344 2.298 2.387 . 0 0 "[ . 1 . 2]" 1
253 1 56 LEU MD2 1 61 LEU H 4.380 . 4.835 3.878 3.734 4.197 . 0 0 "[ . 1 . 2]" 1
254 1 56 LEU MD2 1 63 GLU QG 4.070 . 4.525 3.924 3.235 4.417 . 0 0 "[ . 1 . 2]" 1
255 1 56 LEU H 1 56 LEU MD2 3.920 . 4.376 3.150 3.016 3.250 . 0 0 "[ . 1 . 2]" 1
256 1 56 LEU MD2 1 62 SER HA 4.300 . 4.755 3.281 2.813 3.663 . 0 0 "[ . 1 . 2]" 1
257 1 56 LEU MD2 1 66 PHE HA 4.470 . 4.925 4.117 3.885 4.330 . 0 0 "[ . 1 . 2]" 1
258 1 14 LEU MD2 1 18 THR H 4.650 . 4.950 3.444 3.253 3.796 . 0 0 "[ . 1 . 2]" 1
259 1 14 LEU HA 1 14 LEU MD2 3.100 . 3.556 2.997 2.736 3.115 . 0 0 "[ . 1 . 2]" 1
260 1 14 LEU MD2 1 15 PRO HD2 4.320 . 4.775 4.634 4.338 4.846 0.070 13 0 "[ . 1 . 2]" 1
261 1 14 LEU HB3 1 14 LEU MD2 3.300 . 3.756 3.181 3.158 3.202 . 0 0 "[ . 1 . 2]" 1
262 1 12 VAL HB 1 14 LEU MD2 4.820 . 5.275 4.824 4.569 5.155 . 0 0 "[ . 1 . 2]" 1
263 1 14 LEU HB2 1 14 LEU MD2 3.390 . 3.845 2.262 2.173 2.365 . 0 0 "[ . 1 . 2]" 1
264 1 14 LEU MD2 1 47 HIS HE1 5.500 . 5.956 5.952 5.689 6.034 0.078 19 0 "[ . 1 . 2]" 1
265 1 14 LEU MD2 1 43 LYS QD 4.320 . 4.775 3.974 3.700 4.207 . 0 0 "[ . 1 . 2]" 1
266 1 14 LEU H 1 14 LEU MD2 4.140 . 4.595 2.167 1.969 2.287 . 0 0 "[ . 1 . 2]" 1
267 1 12 VAL HA 1 14 LEU MD2 5.500 . 5.956 5.499 5.225 5.802 . 0 0 "[ . 1 . 2]" 1
268 1 12 VAL H 1 14 LEU MD2 5.500 . 5.956 4.667 4.379 4.905 . 0 0 "[ . 1 . 2]" 1
269 1 14 LEU MD2 1 18 THR HB 3.660 . 3.960 1.986 1.776 2.340 0.024 10 0 "[ . 1 . 2]" 1
270 1 14 LEU MD2 1 20 LEU MD1 3.620 . 4.076 3.405 3.047 3.628 . 0 0 "[ . 1 . 2]" 1
271 1 14 LEU MD2 1 20 LEU HA 4.570 . 5.025 3.288 2.992 3.491 . 0 0 "[ . 1 . 2]" 1
272 1 14 LEU MD2 1 19 VAL MG1 3.880 . 4.080 4.073 3.913 4.162 0.082 19 0 "[ . 1 . 2]" 1
273 1 14 LEU MD2 1 20 LEU HB3 3.600 . 4.056 2.477 2.126 2.726 . 0 0 "[ . 1 . 2]" 1
274 1 25 LEU MD2 1 41 VAL MG2 3.060 . 3.516 2.745 2.367 2.928 . 0 0 "[ . 1 . 2]" 1
275 1 25 LEU MD2 1 41 VAL MG1 3.430 . 3.885 3.275 2.857 3.447 . 0 0 "[ . 1 . 2]" 1
276 1 41 VAL MG1 1 45 VAL MG2 3.650 . 4.106 3.006 2.794 3.165 . 0 0 "[ . 1 . 2]" 1
277 1 25 LEU HA 1 25 LEU MD2 2.910 . 3.365 1.994 1.918 2.108 . 0 0 "[ . 1 . 2]" 1
278 1 25 LEU HB3 1 25 LEU MD2 3.020 . 3.476 2.329 2.273 2.377 . 0 0 "[ . 1 . 2]" 1
279 1 25 LEU MD2 1 26 PRO HD2 3.190 . 3.645 2.366 2.184 2.578 . 0 0 "[ . 1 . 2]" 1
280 1 45 VAL MG2 1 50 ILE MD 2.540 . 2.996 2.332 2.215 2.467 . 0 0 "[ . 1 . 2]" 1
281 1 25 LEU H 1 25 LEU MD2 4.020 . 4.476 3.576 3.405 3.706 . 0 0 "[ . 1 . 2]" 1
282 1 45 VAL HA 1 45 VAL MG2 2.990 . 3.445 2.397 2.341 2.429 . 0 0 "[ . 1 . 2]" 1
283 1 25 LEU MD2 1 44 ALA H 4.500 . 4.956 4.064 3.811 4.388 . 0 0 "[ . 1 . 2]" 1
284 1 45 VAL MG2 1 55 ALA H 5.140 . 5.595 3.659 3.371 3.836 . 0 0 "[ . 1 . 2]" 1
285 1 45 VAL MG2 1 52 GLU HA 3.300 . 3.756 2.252 2.085 2.665 . 0 0 "[ . 1 . 2]" 1
286 1 25 LEU MD2 1 41 VAL HB 4.310 . 4.766 4.708 4.473 4.812 0.047 1 0 "[ . 1 . 2]" 1
287 1 25 LEU MD2 1 26 PRO HD3 3.150 . 3.605 3.300 3.004 3.545 . 0 0 "[ . 1 . 2]" 1
288 1 42 VAL MG2 1 43 LYS H 3.980 . 4.436 3.689 3.625 3.744 . 0 0 "[ . 1 . 2]" 1
289 1 45 VAL MG2 1 66 PHE QD 4.980 . 5.436 4.149 3.980 4.299 . 0 0 "[ . 1 . 2]" 1
290 1 45 VAL MG2 1 66 PHE QE 3.040 . 3.496 2.629 2.440 2.851 . 0 0 "[ . 1 . 2]" 1
291 1 42 VAL MG2 1 69 TRP HB3 3.460 . 3.915 3.480 3.209 3.750 . 0 0 "[ . 1 . 2]" 1
292 1 42 VAL MG2 1 69 TRP HB2 3.610 . 4.065 3.592 3.412 3.777 . 0 0 "[ . 1 . 2]" 1
293 1 42 VAL MG2 1 70 ARG H 2.980 . 3.435 3.255 3.104 3.461 0.026 18 0 "[ . 1 . 2]" 1
294 1 92 LEU MD2 1 93 HIS HA 3.360 . 3.816 3.327 2.479 4.001 0.186 19 0 "[ . 1 . 2]" 1
295 1 92 LEU MD2 1 93 HIS QB 4.190 . 4.490 3.845 2.130 4.627 0.137 9 0 "[ . 1 . 2]" 1
296 1 68 LEU HB2 1 68 LEU MD2 3.250 . 3.705 3.197 3.194 3.202 . 0 0 "[ . 1 . 2]" 1
297 1 68 LEU HA 1 68 LEU MD2 2.850 . 3.306 2.003 1.958 2.083 . 0 0 "[ . 1 . 2]" 1
298 1 68 LEU H 1 68 LEU MD2 3.840 . 4.295 3.327 3.156 3.463 . 0 0 "[ . 1 . 2]" 1
299 1 3 LEU HA 1 3 LEU MD2 3.550 . 4.005 2.763 1.849 3.911 . 0 0 "[ . 1 . 2]" 1
300 1 28 LEU MD2 1 58 ARG HB3 3.580 . 4.036 3.689 3.279 4.072 0.036 9 0 "[ . 1 . 2]" 1
301 1 28 LEU MD2 1 59 TYR HD1 4.460 . 4.916 2.798 2.496 3.317 . 0 0 "[ . 1 . 2]" 1
302 1 27 PRO HA 1 28 LEU MD2 4.650 . 5.106 4.073 3.764 4.346 . 0 0 "[ . 1 . 2]" 1
303 1 28 LEU MD2 1 59 TYR HA 5.060 . 5.516 3.187 2.420 3.736 . 0 0 "[ . 1 . 2]" 1
304 1 28 LEU HB3 1 28 LEU MD2 3.320 . 3.776 2.399 2.344 2.477 . 0 0 "[ . 1 . 2]" 1
305 1 28 LEU HA 1 28 LEU MD2 3.020 . 3.476 2.077 2.006 2.161 . 0 0 "[ . 1 . 2]" 1
306 1 28 LEU HB2 1 28 LEU MD2 3.320 . 3.776 3.200 3.193 3.207 . 0 0 "[ . 1 . 2]" 1
307 1 28 LEU MD2 1 58 ARG HA 3.660 . 3.860 3.577 3.306 3.790 . 0 0 "[ . 1 . 2]" 1
308 1 44 ALA HA 1 49 LEU MD1 4.770 . 5.226 4.614 4.474 4.724 . 0 0 "[ . 1 . 2]" 1
309 1 28 LEU MD2 1 30 THR H 5.500 . 5.956 5.064 4.802 5.296 . 0 0 "[ . 1 . 2]" 1
310 1 28 LEU MD2 1 33 TRP HZ2 5.500 . 5.956 4.936 4.419 5.461 . 0 0 "[ . 1 . 2]" 1
311 1 22 ARG HA 1 49 LEU MD1 3.880 . 4.335 3.476 2.995 3.761 . 0 0 "[ . 1 . 2]" 1
312 1 81 LEU HB3 1 81 LEU MD2 2.950 . 3.405 2.241 2.184 2.320 . 0 0 "[ . 1 . 2]" 1
313 1 49 LEU HB2 1 49 LEU MD1 3.310 . 3.766 2.307 2.282 2.349 . 0 0 "[ . 1 . 2]" 1
314 1 22 ARG HB2 1 49 LEU MD1 3.510 . 4.010 3.969 3.723 4.066 0.056 2 0 "[ . 1 . 2]" 1
315 1 49 LEU HA 1 49 LEU MD1 2.950 . 3.405 2.140 2.079 2.180 . 0 0 "[ . 1 . 2]" 1
316 1 28 LEU MD2 1 58 ARG H 4.910 . 5.210 4.939 4.614 5.222 0.012 11 0 "[ . 1 . 2]" 1
317 1 12 VAL H 1 49 LEU MD1 3.410 . 3.865 2.637 2.299 2.878 . 0 0 "[ . 1 . 2]" 1
318 1 11 GLN HA 1 49 LEU MD1 3.030 . 3.486 2.329 2.124 2.639 . 0 0 "[ . 1 . 2]" 1
319 1 41 VAL MG2 1 69 TRP HZ3 3.730 . 4.186 2.110 1.817 2.293 . 0 0 "[ . 1 . 2]" 1
320 1 33 TRP HZ3 1 41 VAL MG2 3.670 . 4.126 2.309 2.192 2.494 . 0 0 "[ . 1 . 2]" 1
321 1 25 LEU HB3 1 41 VAL MG2 3.880 . 4.335 3.950 3.610 4.189 . 0 0 "[ . 1 . 2]" 1
322 1 41 VAL MG2 1 59 TYR HD2 4.470 . 4.925 3.599 3.316 3.961 . 0 0 "[ . 1 . 2]" 1
323 1 37 ARG HB3 1 41 VAL MG2 4.500 . 4.956 3.888 3.640 4.045 . 0 0 "[ . 1 . 2]" 1
324 1 26 PRO HG3 1 41 VAL MG2 3.680 . 4.135 2.282 2.135 2.470 . 0 0 "[ . 1 . 2]" 1
325 1 41 VAL HA 1 41 VAL MG2 3.120 . 3.576 2.378 2.338 2.407 . 0 0 "[ . 1 . 2]" 1
326 1 26 PRO HD2 1 41 VAL MG2 3.880 . 4.335 2.518 2.338 2.734 . 0 0 "[ . 1 . 2]" 1
327 1 25 LEU HA 1 41 VAL MG2 4.700 . 5.155 4.122 3.732 4.480 . 0 0 "[ . 1 . 2]" 1
328 1 37 ARG HA 1 41 VAL MG2 4.970 . 5.425 4.137 3.995 4.291 . 0 0 "[ . 1 . 2]" 1
329 1 26 PRO HG2 1 41 VAL MG2 3.520 . 3.976 2.432 2.284 2.624 . 0 0 "[ . 1 . 2]" 1
330 1 40 ALA HA 1 41 VAL MG2 5.260 . 5.715 4.936 4.900 5.012 . 0 0 "[ . 1 . 2]" 1
331 1 26 PRO HD3 1 41 VAL MG2 3.480 . 3.935 3.239 3.063 3.431 . 0 0 "[ . 1 . 2]" 1
332 1 41 VAL MG2 1 61 LEU MD1 4.600 . 5.056 3.651 3.308 3.958 . 0 0 "[ . 1 . 2]" 1
333 1 20 LEU MD1 1 21 SER H 3.530 . 3.986 2.879 2.496 3.165 . 0 0 "[ . 1 . 2]" 1
334 1 20 LEU MD1 1 24 ASP QB 3.060 . 3.560 1.915 1.756 2.294 0.044 5 0 "[ . 1 . 2]" 1
335 1 20 LEU MD1 1 40 ALA HA 3.940 . 4.396 3.256 2.749 3.862 . 0 0 "[ . 1 . 2]" 1
336 1 20 LEU MD1 1 24 ASP HA 4.820 . 5.320 4.324 4.128 4.689 . 0 0 "[ . 1 . 2]" 1
337 1 20 LEU H 1 20 LEU MD1 4.450 . 4.905 4.353 4.305 4.390 . 0 0 "[ . 1 . 2]" 1
338 1 20 LEU MD1 1 44 ALA HA 4.000 . 4.456 4.473 4.411 4.511 0.056 12 0 "[ . 1 . 2]" 1
339 1 20 LEU HA 1 20 LEU MD1 3.100 . 3.556 2.172 2.087 2.260 . 0 0 "[ . 1 . 2]" 1
340 1 79 LYS QD 1 79 LYS HG3 2.590 . 3.046 2.342 2.169 2.424 . 0 0 "[ . 1 . 2]" 1
341 1 85 MET HA 1 88 LYS HG3 5.500 . 5.956 3.550 2.464 5.091 . 0 0 "[ . 1 . 2]" 1
342 1 85 MET HA 1 88 LYS HG2 5.500 . 5.956 3.905 2.162 5.974 0.019 17 0 "[ . 1 . 2]" 1
343 1 88 LYS HA 1 88 LYS HG2 4.080 . 4.380 2.956 2.391 3.873 . 0 0 "[ . 1 . 2]" 1
344 1 79 LYS HG3 1 80 ALA H 4.860 . 5.315 4.227 1.782 5.325 0.018 2 0 "[ . 1 . 2]" 1
345 1 59 TYR HD1 1 61 LEU MD1 5.500 . 5.956 4.862 4.594 5.105 . 0 0 "[ . 1 . 2]" 1
346 1 79 LYS HA 1 79 LYS HG3 3.910 . 4.365 3.476 2.899 3.840 . 0 0 "[ . 1 . 2]" 1
347 1 61 LEU MD1 1 66 PHE QD 3.810 . 4.266 3.080 2.604 3.493 . 0 0 "[ . 1 . 2]" 1
348 1 20 LEU MD2 1 49 LEU HB2 3.620 . 4.076 3.736 3.329 4.015 . 0 0 "[ . 1 . 2]" 1
349 1 61 LEU MD1 1 65 GLU HB3 4.990 . 5.445 3.948 3.481 4.282 . 0 0 "[ . 1 . 2]" 1
350 1 56 LEU HA 1 61 LEU MD1 4.030 . 4.530 3.031 2.778 3.279 . 0 0 "[ . 1 . 2]" 1
351 1 59 TYR HB3 1 61 LEU MD1 4.300 . 4.755 2.888 2.674 3.212 . 0 0 "[ . 1 . 2]" 1
352 1 59 TYR HB2 1 61 LEU MD1 3.880 . 4.335 2.404 2.286 2.528 . 0 0 "[ . 1 . 2]" 1
353 1 56 LEU MD2 1 61 LEU MD1 3.610 . 4.065 2.889 2.641 3.172 . 0 0 "[ . 1 . 2]" 1
354 1 61 LEU MD1 1 69 TRP HD1 5.500 . 5.956 5.653 5.328 5.964 0.008 15 0 "[ . 1 . 2]" 1
355 1 61 LEU MD1 1 66 PHE HB3 5.000 . 5.456 5.068 4.732 5.363 . 0 0 "[ . 1 . 2]" 1
356 1 14 LEU MD1 1 43 LYS QE 3.740 . 4.240 3.549 3.277 3.772 . 0 0 "[ . 1 . 2]" 1
357 1 14 LEU MD1 1 40 ALA HA 4.170 . 4.370 4.360 4.091 4.502 0.132 19 0 "[ . 1 . 2]" 1
358 1 14 LEU H 1 14 LEU MD1 3.710 . 4.166 3.521 3.376 3.691 . 0 0 "[ . 1 . 2]" 1
359 1 56 LEU HB3 1 61 LEU MD1 5.200 . 5.655 4.961 4.725 5.260 . 0 0 "[ . 1 . 2]" 1
360 1 61 LEU MD1 1 65 GLU HB2 5.500 . 5.956 5.091 4.607 5.447 . 0 0 "[ . 1 . 2]" 1
361 1 14 LEU HB3 1 14 LEU MD1 3.190 . 3.645 2.461 2.377 2.513 . 0 0 "[ . 1 . 2]" 1
362 1 28 LEU HA 1 28 LEU MD1 4.310 . 4.766 3.864 3.806 3.917 . 0 0 "[ . 1 . 2]" 1
363 1 14 LEU MD1 1 15 PRO HD3 4.170 . 4.626 3.062 2.747 3.447 . 0 0 "[ . 1 . 2]" 1
364 1 14 LEU MD1 1 43 LYS HB3 3.950 . 4.550 2.318 2.032 2.832 . 0 0 "[ . 1 . 2]" 1
365 1 14 LEU MD1 1 20 LEU MD2 2.800 . 3.256 2.445 2.016 2.850 . 0 0 "[ . 1 . 2]" 1
366 1 14 LEU HA 1 14 LEU MD1 3.850 . 4.306 1.981 1.922 2.066 . 0 0 "[ . 1 . 2]" 1
367 1 14 LEU MD1 1 15 PRO HD2 4.040 . 4.496 2.739 2.460 3.020 . 0 0 "[ . 1 . 2]" 1
368 1 38 LYS QG 1 69 TRP HE3 5.500 . 5.956 4.034 3.807 4.385 . 0 0 "[ . 1 . 2]" 1
369 1 65 GLU HA 1 68 LEU MD1 3.270 . 3.726 2.704 2.401 3.064 . 0 0 "[ . 1 . 2]" 1
370 1 20 LEU MD2 1 44 ALA HA 3.320 . 3.776 2.190 2.097 2.289 . 0 0 "[ . 1 . 2]" 1
371 1 68 LEU HB3 1 68 LEU MD1 3.230 . 3.685 2.370 2.328 2.396 . 0 0 "[ . 1 . 2]" 1
372 1 20 LEU H 1 20 LEU MD2 4.850 . 5.306 4.412 4.335 4.525 . 0 0 "[ . 1 . 2]" 1
373 1 20 LEU MD2 1 43 LYS H 5.130 . 5.585 4.147 4.000 4.319 . 0 0 "[ . 1 . 2]" 1
374 1 20 LEU MD2 1 47 HIS HB2 3.840 . 4.295 3.780 3.446 4.123 . 0 0 "[ . 1 . 2]" 1
375 1 20 LEU MD2 1 21 SER H 5.180 . 5.635 5.015 4.796 5.137 . 0 0 "[ . 1 . 2]" 1
376 1 20 LEU HA 1 20 LEU MD2 4.180 . 4.635 3.905 3.871 3.935 . 0 0 "[ . 1 . 2]" 1
377 1 20 LEU MD2 1 43 LYS HB3 3.530 . 3.986 3.007 2.652 3.229 . 0 0 "[ . 1 . 2]" 1
378 1 20 LEU HB3 1 20 LEU MD2 3.190 . 3.645 2.294 2.260 2.329 . 0 0 "[ . 1 . 2]" 1
379 1 20 LEU MD2 1 43 LYS HB2 3.750 . 4.206 2.649 2.410 2.808 . 0 0 "[ . 1 . 2]" 1
380 1 20 LEU MD2 1 49 LEU HB3 3.840 . 4.295 3.727 3.436 3.909 . 0 0 "[ . 1 . 2]" 1
381 1 68 LEU HA 1 68 LEU MD1 3.960 . 4.416 3.854 3.821 3.885 . 0 0 "[ . 1 . 2]" 1
382 1 48 GLY H 1 49 LEU MD2 5.500 . 5.956 5.927 5.695 6.010 0.054 8 0 "[ . 1 . 2]" 1
383 1 49 LEU MD2 1 50 ILE H 4.570 . 5.025 3.924 3.613 4.116 . 0 0 "[ . 1 . 2]" 1
384 1 56 LEU MD1 1 62 SER HA 4.730 . 5.186 3.910 3.088 4.430 . 0 0 "[ . 1 . 2]" 1
385 1 49 LEU HB3 1 49 LEU MD2 3.160 . 3.615 2.262 2.242 2.283 . 0 0 "[ . 1 . 2]" 1
386 1 20 LEU HG 1 49 LEU MD2 3.100 . 4.100 1.858 1.777 2.077 0.023 13 0 "[ . 1 . 2]" 1
387 1 12 VAL H 1 49 LEU MD2 3.810 . 4.266 3.458 3.211 3.703 . 0 0 "[ . 1 . 2]" 1
388 1 22 ARG HA 1 49 LEU MD2 3.490 . 3.945 2.406 2.132 2.653 . 0 0 "[ . 1 . 2]" 1
389 1 56 LEU MD1 1 66 PHE HB3 4.590 . 5.045 3.904 3.526 4.178 . 0 0 "[ . 1 . 2]" 1
390 1 24 ASP QB 1 49 LEU MD2 4.940 . 5.396 4.065 3.809 4.387 . 0 0 "[ . 1 . 2]" 1
391 1 56 LEU MD1 1 63 GLU QG 3.390 . 3.845 3.017 2.145 3.866 0.020 8 0 "[ . 1 . 2]" 1
392 1 11 GLN HA 1 49 LEU MD2 3.930 . 4.385 3.590 3.357 3.789 . 0 0 "[ . 1 . 2]" 1
393 1 53 ARG HA 1 56 LEU MD1 3.330 . 4.330 2.339 1.864 2.755 . 0 0 "[ . 1 . 2]" 1
394 1 22 ARG QD 1 49 LEU MD2 4.820 . 5.275 4.480 4.125 4.744 . 0 0 "[ . 1 . 2]" 1
395 1 55 ALA H 1 56 LEU MD1 4.660 . 5.115 5.165 5.116 5.197 0.081 16 0 "[ . 1 . 2]" 1
396 1 56 LEU MD1 1 62 SER HB3 5.500 . 5.956 5.548 4.793 5.983 0.028 2 0 "[ . 1 . 2]" 1
397 1 56 LEU MD1 1 66 PHE HB2 4.710 . 5.166 4.045 3.701 4.392 . 0 0 "[ . 1 . 2]" 1
398 1 22 ARG H 1 25 LEU MD1 5.500 . 5.956 5.014 4.455 5.497 . 0 0 "[ . 1 . 2]" 1
399 1 56 LEU HA 1 56 LEU MD1 4.020 . 4.476 3.899 3.872 3.938 . 0 0 "[ . 1 . 2]" 1
400 1 25 LEU HB3 1 25 LEU MD1 3.340 . 3.796 2.419 2.380 2.468 . 0 0 "[ . 1 . 2]" 1
401 1 25 LEU MD1 1 44 ALA MB 3.670 . 4.126 3.161 2.794 3.441 . 0 0 "[ . 1 . 2]" 1
402 1 56 LEU H 1 56 LEU MD1 3.400 . 3.855 3.499 3.395 3.554 . 0 0 "[ . 1 . 2]" 1
403 1 25 LEU MD1 1 55 ALA HA 4.950 . 5.405 4.977 4.256 5.422 0.017 17 0 "[ . 1 . 2]" 1
404 1 22 ARG QD 1 25 LEU MD1 5.330 . 5.786 4.619 3.852 5.407 . 0 0 "[ . 1 . 2]" 1
405 1 25 LEU HB2 1 25 LEU MD1 3.160 . 3.615 2.289 2.245 2.323 . 0 0 "[ . 1 . 2]" 1
406 1 25 LEU MD1 1 49 LEU MD2 3.390 . 3.845 3.012 2.761 3.427 . 0 0 "[ . 1 . 2]" 1
407 1 25 LEU MD1 1 59 TYR HE2 5.300 . 5.755 3.654 3.198 4.176 . 0 0 "[ . 1 . 2]" 1
408 1 53 ARG HA 1 53 ARG HG2 4.150 . 4.606 2.712 2.132 3.444 . 0 0 "[ . 1 . 2]" 1
409 1 53 ARG H 1 53 ARG HG2 4.250 . 4.706 2.975 1.967 4.250 . 0 0 "[ . 1 . 2]" 1
410 1 53 ARG HG2 1 54 GLU H 5.130 . 5.585 4.717 3.971 5.143 . 0 0 "[ . 1 . 2]" 1
411 1 68 LEU HG 1 69 TRP HD1 5.250 . 5.706 4.871 4.698 5.090 . 0 0 "[ . 1 . 2]" 1
412 1 65 GLU HA 1 68 LEU HG 4.230 . 4.686 3.389 3.065 3.899 . 0 0 "[ . 1 . 2]" 1
413 1 44 ALA HA 1 49 LEU HG 4.620 . 5.076 4.699 4.616 4.806 . 0 0 "[ . 1 . 2]" 1
414 1 30 THR HA 1 31 ARG QG 5.500 . 5.800 5.460 4.152 5.970 0.170 19 0 "[ . 1 . 2]" 1
415 1 31 ARG HA 1 31 ARG QG 3.500 . 3.955 2.740 2.320 3.118 . 0 0 "[ . 1 . 2]" 1
416 1 25 LEU MD1 1 49 LEU HG 4.040 . 4.496 3.742 3.361 4.149 . 0 0 "[ . 1 . 2]" 1
417 1 20 LEU HG 1 24 ASP QB 4.720 . 5.470 3.736 3.397 4.158 . 0 0 "[ . 1 . 2]" 1
418 1 24 ASP QB 1 25 LEU HG 5.500 . 5.956 4.232 4.004 4.326 . 0 0 "[ . 1 . 2]" 1
419 1 22 ARG HA 1 25 LEU HG 3.930 . 4.385 2.676 2.246 3.007 . 0 0 "[ . 1 . 2]" 1
420 1 25 LEU HG 1 49 LEU MD2 4.650 . 5.106 2.958 2.648 3.369 . 0 0 "[ . 1 . 2]" 1
421 1 89 TYR H 1 90 ARG QG 4.190 . 4.646 3.991 3.379 4.454 . 0 0 "[ . 1 . 2]" 1
422 1 26 PRO HA 1 27 PRO HG3 4.730 . 5.186 4.464 4.088 4.613 . 0 0 "[ . 1 . 2]" 1
423 1 26 PRO HA 1 27 PRO HG2 4.640 . 5.095 4.401 4.235 4.555 . 0 0 "[ . 1 . 2]" 1
424 1 27 PRO HG3 1 29 ASP H 5.450 . 5.905 4.860 4.532 5.631 . 0 0 "[ . 1 . 2]" 1
425 1 27 PRO HG2 1 30 THR HB 3.270 . 3.770 3.611 1.837 3.896 0.126 18 0 "[ . 1 . 2]" 1
426 1 27 PRO HG2 1 29 ASP H 5.210 . 5.410 3.944 3.417 5.253 . 0 0 "[ . 1 . 2]" 1
427 1 10 ARG QG 1 22 ARG QD 4.020 . 4.476 3.515 2.540 4.599 0.124 19 0 "[ . 1 . 2]" 1
428 1 42 VAL MG2 1 70 ARG QG 3.680 . 4.135 3.780 3.519 4.134 . 0 0 "[ . 1 . 2]" 1
429 1 86 ILE HG13 1 89 TYR HB2 5.300 . 5.755 4.633 3.927 5.233 . 0 0 "[ . 1 . 2]" 1
430 1 86 ILE HG12 1 89 TYR HB2 5.500 . 5.956 5.496 4.473 6.005 0.050 3 0 "[ . 1 . 2]" 1
431 1 55 ALA HA 1 58 ARG HG2 3.960 . 4.260 2.321 2.210 2.425 . 0 0 "[ . 1 . 2]" 1
432 1 15 PRO HG2 1 47 HIS HE1 5.110 . 5.565 4.095 2.856 5.386 . 0 0 "[ . 1 . 2]" 1
433 1 58 ARG HG3 1 59 TYR HD1 5.500 . 5.956 3.961 3.588 4.391 . 0 0 "[ . 1 . 2]" 1
434 1 26 PRO HG3 1 37 ARG HB3 3.760 . 4.215 2.544 2.154 2.978 . 0 0 "[ . 1 . 2]" 1
435 1 58 ARG HG2 1 59 TYR HD2 5.500 . 5.956 3.497 3.212 3.823 . 0 0 "[ . 1 . 2]" 1
436 1 14 LEU HG 1 20 LEU H 5.400 . 5.856 5.458 5.016 5.822 . 0 0 "[ . 1 . 2]" 1
437 1 14 LEU HG 1 15 PRO HD2 4.250 . 4.706 4.208 3.779 4.614 . 0 0 "[ . 1 . 2]" 1
438 1 26 PRO HG3 1 59 TYR HE2 5.500 . 5.956 5.443 5.240 5.717 . 0 0 "[ . 1 . 2]" 1
439 1 26 PRO HG3 1 59 TYR HE1 5.500 . 5.956 5.042 4.655 5.503 . 0 0 "[ . 1 . 2]" 1
440 1 26 PRO HG2 1 59 TYR HE1 5.210 . 5.666 3.324 2.954 3.780 . 0 0 "[ . 1 . 2]" 1
441 1 45 VAL HB 1 46 ILE HG13 5.060 . 5.516 3.247 3.050 3.640 . 0 0 "[ . 1 . 2]" 1
442 1 26 PRO HG2 1 41 VAL H 5.190 . 5.646 4.882 4.516 5.201 . 0 0 "[ . 1 . 2]" 1
443 1 26 PRO HG2 1 37 ARG HD3 5.170 . 5.626 4.892 4.308 5.554 . 0 0 "[ . 1 . 2]" 1
444 1 46 ILE HG13 1 66 PHE HZ 5.500 . 5.956 3.900 3.554 4.399 . 0 0 "[ . 1 . 2]" 1
445 1 46 ILE HG13 1 47 HIS H 4.680 . 5.135 4.468 4.330 4.835 . 0 0 "[ . 1 . 2]" 1
446 1 46 ILE HG12 1 66 PHE HZ 5.500 . 5.956 5.111 4.666 5.740 . 0 0 "[ . 1 . 2]" 1
447 1 43 LYS HA 1 46 ILE HG12 4.750 . 5.206 4.803 4.544 5.213 0.008 18 0 "[ . 1 . 2]" 1
448 1 46 ILE HG12 1 47 HIS H 5.220 . 5.675 5.108 5.011 5.171 . 0 0 "[ . 1 . 2]" 1
449 1 42 VAL MG2 1 46 ILE HG13 3.760 . 4.215 2.561 2.349 2.873 . 0 0 "[ . 1 . 2]" 1
450 1 45 VAL HB 1 46 ILE HG12 5.500 . 5.956 4.479 4.220 5.084 . 0 0 "[ . 1 . 2]" 1
451 1 46 ILE HG12 1 91 GLN QG 5.500 . 5.956 4.414 2.197 5.970 0.014 15 0 "[ . 1 . 2]" 1
452 1 42 VAL MG1 1 69 TRP HB3 4.480 . 4.936 3.320 3.126 3.561 . 0 0 "[ . 1 . 2]" 1
453 1 66 PHE QD 1 69 TRP HB3 5.150 . 5.606 4.780 4.485 5.290 . 0 0 "[ . 1 . 2]" 1
454 1 66 PHE QD 1 69 TRP HB2 5.230 . 5.686 3.858 3.611 4.197 . 0 0 "[ . 1 . 2]" 1
455 1 33 TRP HB3 1 38 LYS HE3 4.730 . 5.230 2.443 2.014 3.870 . 0 0 "[ . 1 . 2]" 1
456 1 33 TRP HB3 1 38 LYS QG 5.340 . 5.670 2.213 1.967 2.573 . 0 0 "[ . 1 . 2]" 1
457 1 26 PRO HB3 1 37 ARG HG3 4.330 . 4.786 4.205 3.707 4.634 . 0 0 "[ . 1 . 2]" 1
458 1 26 PRO HB3 1 37 ARG HG2 4.570 . 5.025 2.694 2.060 3.045 . 0 0 "[ . 1 . 2]" 1
459 1 37 ARG HG2 1 38 LYS H 5.290 . 5.746 4.980 4.893 5.079 . 0 0 "[ . 1 . 2]" 1
460 1 37 ARG H 1 37 ARG HG2 4.380 . 4.835 3.480 3.289 3.753 . 0 0 "[ . 1 . 2]" 1
461 1 34 VAL H 1 37 ARG HG3 5.120 . 5.576 3.741 3.486 4.004 . 0 0 "[ . 1 . 2]" 1
462 1 33 TRP HB2 1 34 VAL H 5.240 . 5.695 4.345 3.784 4.555 . 0 0 "[ . 1 . 2]" 1
463 1 37 ARG HA 1 37 ARG HG3 4.060 . 4.516 3.116 2.908 3.248 . 0 0 "[ . 1 . 2]" 1
464 1 33 TRP HB2 1 38 LYS QG 5.210 . 5.540 3.534 3.167 4.058 . 0 0 "[ . 1 . 2]" 1
465 1 79 LYS QD 1 79 LYS HG2 2.590 . 3.046 2.294 2.165 2.412 . 0 0 "[ . 1 . 2]" 1
466 1 64 GLU HB2 1 64 GLU HG3 2.890 . 3.345 2.396 2.257 2.495 . 0 0 "[ . 1 . 2]" 1
467 1 22 ARG HB3 1 23 ALA HA 5.500 . 5.956 4.657 4.425 4.864 . 0 0 "[ . 1 . 2]" 1
468 1 56 LEU MD1 1 63 GLU HB2 4.880 . 5.335 3.591 2.834 4.958 . 0 0 "[ . 1 . 2]" 1
469 1 38 LYS HD2 1 69 TRP HE3 5.500 . 5.956 5.985 5.942 6.038 0.082 15 0 "[ . 1 . 2]" 1
470 1 38 LYS HD2 1 69 TRP HA 5.500 . 5.956 4.753 4.079 5.148 . 0 0 "[ . 1 . 2]" 1
471 1 33 TRP HB3 1 38 LYS HD2 5.500 . 5.830 4.012 3.761 4.251 . 0 0 "[ . 1 . 2]" 1
472 1 82 LYS QD 1 83 VAL H 5.190 . 5.646 3.803 2.391 4.587 . 0 0 "[ . 1 . 2]" 1
473 1 33 TRP HB3 1 38 LYS HD3 5.150 . 5.480 4.200 3.981 4.555 . 0 0 "[ . 1 . 2]" 1
474 1 46 ILE MG 1 47 HIS HB2 4.780 . 5.235 4.819 4.083 5.069 . 0 0 "[ . 1 . 2]" 1
475 1 14 LEU MD1 1 47 HIS HB3 5.500 . 5.956 4.905 4.545 5.252 . 0 0 "[ . 1 . 2]" 1
476 1 14 LEU MD1 1 47 HIS HB2 5.430 . 5.885 4.432 4.190 4.795 . 0 0 "[ . 1 . 2]" 1
477 1 44 ALA HA 1 47 HIS HB2 4.820 . 5.275 3.329 3.198 3.602 . 0 0 "[ . 1 . 2]" 1
478 1 44 ALA HA 1 47 HIS HB3 5.340 . 5.795 5.004 4.862 5.316 . 0 0 "[ . 1 . 2]" 1
479 1 51 THR H 1 54 GLU HB3 4.000 . 4.300 2.491 2.050 2.816 . 0 0 "[ . 1 . 2]" 1
480 1 50 ILE MD 1 54 GLU HB3 3.690 . 4.146 2.967 2.681 3.230 . 0 0 "[ . 1 . 2]" 1
481 1 50 ILE MD 1 54 GLU HB2 4.230 . 4.686 4.436 4.149 4.720 0.035 10 0 "[ . 1 . 2]" 1
482 1 50 ILE HA 1 54 GLU HB2 5.500 . 5.956 4.944 4.544 5.307 . 0 0 "[ . 1 . 2]" 1
483 1 51 THR HB 1 54 GLU HB2 5.500 . 5.956 4.596 4.315 4.857 . 0 0 "[ . 1 . 2]" 1
484 1 50 ILE HA 1 54 GLU HB3 5.290 . 5.746 4.409 4.027 4.773 . 0 0 "[ . 1 . 2]" 1
485 1 78 GLU HB2 1 78 GLU HG3 2.770 . 3.226 2.428 2.286 2.585 . 0 0 "[ . 1 . 2]" 1
486 1 78 GLU H 1 78 GLU HB2 3.910 . 4.365 3.615 3.518 3.704 . 0 0 "[ . 1 . 2]" 1
487 1 70 ARG H 1 70 ARG HB2 3.670 . 4.126 3.611 3.589 3.631 . 0 0 "[ . 1 . 2]" 1
488 1 42 VAL MG2 1 70 ARG HB3 4.080 . 4.536 2.171 1.898 2.534 . 0 0 "[ . 1 . 2]" 1
489 1 66 PHE QE 1 70 ARG HB3 5.500 . 5.956 3.476 3.199 3.928 . 0 0 "[ . 1 . 2]" 1
490 1 66 PHE QE 1 70 ARG HB2 5.270 . 5.726 4.619 4.120 5.143 . 0 0 "[ . 1 . 2]" 1
491 1 42 VAL MG2 1 70 ARG HB2 4.000 . 4.456 2.928 2.663 3.294 . 0 0 "[ . 1 . 2]" 1
492 1 51 THR MG 1 53 ARG HB2 3.580 . 4.036 3.050 2.433 3.962 . 0 0 "[ . 1 . 2]" 1
493 1 94 HIS H 1 94 HIS HB2 4.180 . 4.635 3.133 2.399 3.934 . 0 0 "[ . 1 . 2]" 1
494 1 94 HIS H 1 94 HIS HB3 4.180 . 4.635 3.053 2.444 4.047 . 0 0 "[ . 1 . 2]" 1
495 1 53 ARG H 1 53 ARG HB3 3.600 . 4.056 3.390 2.829 3.595 . 0 0 "[ . 1 . 2]" 1
496 1 73 VAL MG1 1 76 HIS HB3 5.500 . 5.956 4.358 3.276 5.965 0.009 9 0 "[ . 1 . 2]" 1
497 1 75 ALA MB 1 76 HIS HB3 5.500 . 5.956 5.313 4.636 5.654 . 0 0 "[ . 1 . 2]" 1
498 1 73 VAL HA 1 76 HIS HB2 4.780 . 5.235 3.052 2.473 3.666 . 0 0 "[ . 1 . 2]" 1
499 1 75 ALA MB 1 76 HIS HB2 5.500 . 5.956 4.677 4.147 5.114 . 0 0 "[ . 1 . 2]" 1
500 1 73 VAL MG1 1 76 HIS HB2 5.500 . 5.956 4.585 4.031 5.315 . 0 0 "[ . 1 . 2]" 1
501 1 58 ARG HB2 1 59 TYR HE2 5.500 . 5.956 5.570 5.173 5.814 . 0 0 "[ . 1 . 2]" 1
502 1 58 ARG HB2 1 59 TYR HE1 5.500 . 5.956 5.265 4.613 5.981 0.026 20 0 "[ . 1 . 2]" 1
503 1 58 ARG HB2 1 59 TYR H 4.300 . 4.755 3.954 3.771 4.185 . 0 0 "[ . 1 . 2]" 1
504 1 28 LEU MD2 1 58 ARG HB2 3.840 . 4.140 2.225 1.785 2.575 0.015 15 0 "[ . 1 . 2]" 1
505 1 58 ARG HB3 1 59 TYR HD2 5.500 . 5.956 5.721 5.471 5.930 . 0 0 "[ . 1 . 2]" 1
506 1 58 ARG HB2 1 59 TYR HD2 5.500 . 5.956 5.426 5.062 5.719 . 0 0 "[ . 1 . 2]" 1
507 1 58 ARG HB2 1 59 TYR HD1 5.500 . 5.956 5.116 4.587 5.674 . 0 0 "[ . 1 . 2]" 1
508 1 58 ARG HB2 1 60 SER H 5.500 . 5.956 5.390 5.202 5.565 . 0 0 "[ . 1 . 2]" 1
509 1 58 ARG HB3 1 59 TYR HE2 5.500 . 5.956 5.957 5.740 6.001 0.046 13 0 "[ . 1 . 2]" 1
510 1 26 PRO HB2 1 27 PRO HD3 4.590 . 5.045 4.112 3.527 4.418 . 0 0 "[ . 1 . 2]" 1
511 1 26 PRO HB3 1 59 TYR HE1 5.250 . 5.706 5.393 4.848 5.724 0.019 11 0 "[ . 1 . 2]" 1
512 1 26 PRO HB3 1 33 TRP HH2 5.080 . 5.536 4.703 4.303 5.018 . 0 0 "[ . 1 . 2]" 1
513 1 26 PRO HB3 1 41 VAL MG2 5.100 . 5.556 4.222 4.082 4.394 . 0 0 "[ . 1 . 2]" 1
514 1 26 PRO HB3 1 27 PRO HD2 4.210 . 4.666 2.969 2.605 3.267 . 0 0 "[ . 1 . 2]" 1
515 1 26 PRO HB3 1 34 VAL MG2 5.500 . 5.956 5.352 4.960 5.798 . 0 0 "[ . 1 . 2]" 1
516 1 26 PRO HB3 1 37 ARG HD3 4.870 . 5.326 2.610 1.932 3.280 . 0 0 "[ . 1 . 2]" 1
517 1 25 LEU MD2 1 26 PRO HB2 5.500 . 5.956 5.734 5.529 5.946 . 0 0 "[ . 1 . 2]" 1
518 1 26 PRO HB2 1 27 PRO HD2 4.590 . 5.045 2.771 2.433 3.123 . 0 0 "[ . 1 . 2]" 1
519 1 26 PRO HB3 1 38 LYS H 5.500 . 5.956 6.013 5.978 6.062 0.106 7 0 "[ . 1 . 2]" 1
520 1 26 PRO HB3 1 30 THR MG 4.910 . 5.365 3.979 3.274 4.909 . 0 0 "[ . 1 . 2]" 1
521 1 26 PRO HB2 1 33 TRP HZ3 5.330 . 5.786 3.261 2.858 3.650 . 0 0 "[ . 1 . 2]" 1
522 1 26 PRO HB2 1 30 THR MG 5.390 . 5.845 3.301 2.163 4.382 . 0 0 "[ . 1 . 2]" 1
523 1 26 PRO HB3 1 33 TRP HZ3 5.070 . 5.525 3.610 3.196 3.936 . 0 0 "[ . 1 . 2]" 1
524 1 26 PRO HB2 1 30 THR H 5.500 . 5.956 5.052 4.748 5.455 . 0 0 "[ . 1 . 2]" 1
525 1 25 LEU MD2 1 26 PRO HB3 5.500 . 5.956 5.591 5.417 5.789 . 0 0 "[ . 1 . 2]" 1
526 1 34 VAL MG2 1 37 ARG HB2 4.340 . 4.795 2.666 2.431 2.949 . 0 0 "[ . 1 . 2]" 1
527 1 5 ARG HB2 1 6 VAL H 4.170 . 4.470 4.229 3.860 4.510 0.040 9 0 "[ . 1 . 2]" 1
528 1 4 LYS H 1 5 ARG HB2 5.500 . 5.800 4.932 3.768 5.860 0.060 19 0 "[ . 1 . 2]" 1
529 1 4 LYS H 1 5 ARG HB3 5.500 . 5.800 5.155 3.572 5.980 0.180 18 0 "[ . 1 . 2]" 1
530 1 11 GLN HB3 1 49 LEU MD1 5.170 . 5.626 4.223 4.004 4.510 . 0 0 "[ . 1 . 2]" 1
531 1 11 GLN HB2 1 49 LEU MD1 5.170 . 5.626 4.315 4.127 4.550 . 0 0 "[ . 1 . 2]" 1
532 1 11 GLN HB3 1 19 VAL MG1 3.870 . 4.326 3.428 2.976 3.920 . 0 0 "[ . 1 . 2]" 1
533 1 15 PRO HB3 1 16 ASP H 4.600 . 5.056 4.302 4.165 4.412 . 0 0 "[ . 1 . 2]" 1
534 1 85 MET H 1 85 MET HG2 4.860 . 5.315 3.901 2.518 4.706 . 0 0 "[ . 1 . 2]" 1
535 1 85 MET H 1 85 MET HG3 4.860 . 5.315 3.872 2.193 4.555 . 0 0 "[ . 1 . 2]" 1
536 1 41 VAL H 1 42 VAL HB 5.310 . 5.766 5.154 5.068 5.236 . 0 0 "[ . 1 . 2]" 1
537 1 42 VAL HB 1 70 ARG HB3 4.240 . 4.695 4.216 3.931 4.569 . 0 0 "[ . 1 . 2]" 1
538 1 39 ALA HA 1 42 VAL HB 4.150 . 4.650 4.196 4.049 4.299 . 0 0 "[ . 1 . 2]" 1
539 1 45 VAL HB 1 46 ILE HA 4.270 . 4.726 4.174 4.088 4.332 . 0 0 "[ . 1 . 2]" 1
540 1 9 PRO HB2 1 49 LEU HA 4.700 . 5.000 3.350 2.094 4.735 . 0 0 "[ . 1 . 2]" 1
541 1 9 PRO HB2 1 12 VAL MG1 3.950 . 4.405 2.839 2.371 3.451 . 0 0 "[ . 1 . 2]" 1
542 1 9 PRO HB2 1 49 LEU MD1 4.400 . 4.700 2.844 1.968 3.857 . 0 0 "[ . 1 . 2]" 1
543 1 9 PRO HB3 1 11 GLN H 4.460 . 4.916 3.705 3.141 4.806 . 0 0 "[ . 1 . 2]" 1
544 1 11 GLN HG2 1 19 VAL MG1 4.370 . 4.826 4.419 4.071 4.837 0.011 15 0 "[ . 1 . 2]" 1
545 1 46 ILE MD 1 73 VAL HB 4.670 . 5.126 4.330 3.859 4.771 . 0 0 "[ . 1 . 2]" 1
546 1 11 GLN HA 1 11 GLN HG3 4.080 . 4.536 3.745 3.688 3.858 . 0 0 "[ . 1 . 2]" 1
547 1 11 GLN HG3 1 12 VAL H 4.540 . 4.996 4.146 3.830 4.460 . 0 0 "[ . 1 . 2]" 1
548 1 11 GLN HG3 1 20 LEU H 5.490 . 5.945 5.732 5.464 5.970 0.024 19 0 "[ . 1 . 2]" 1
549 1 82 LYS HB2 1 86 ILE MD 5.500 . 6.000 5.447 5.001 5.728 . 0 0 "[ . 1 . 2]" 1
550 1 82 LYS HB3 1 86 ILE MD 5.330 . 5.830 4.726 4.585 4.898 . 0 0 "[ . 1 . 2]" 1
551 1 82 LYS HB3 1 84 THR H 3.610 . 4.065 3.202 2.787 3.662 . 0 0 "[ . 1 . 2]" 1
552 1 82 LYS HB3 1 84 THR HB 3.730 . 4.186 3.632 3.063 4.057 . 0 0 "[ . 1 . 2]" 1
553 1 88 LYS HB2 1 89 TYR HD1 5.500 . 5.956 4.517 3.678 5.812 . 0 0 "[ . 1 . 2]" 1
554 1 88 LYS HB3 1 89 TYR HD1 5.500 . 5.956 4.831 3.886 5.988 0.032 13 0 "[ . 1 . 2]" 1
555 1 40 ALA HA 1 43 LYS HB2 3.630 . 4.085 2.980 2.829 3.225 . 0 0 "[ . 1 . 2]" 1
556 1 81 LEU HA 1 85 MET HB2 4.540 . 4.996 3.000 2.364 4.640 . 0 0 "[ . 1 . 2]" 1
557 1 81 LEU HA 1 85 MET HB3 4.740 . 5.195 3.078 2.344 3.725 . 0 0 "[ . 1 . 2]" 1
558 1 82 LYS H 1 85 MET HB2 3.560 . 4.016 2.416 1.924 2.909 . 0 0 "[ . 1 . 2]" 1
559 1 20 LEU MD1 1 43 LYS HB3 4.920 . 5.376 5.116 4.590 5.398 0.023 9 0 "[ . 1 . 2]" 1
560 1 42 VAL MG1 1 43 LYS HB3 5.210 . 5.666 4.562 4.492 4.644 . 0 0 "[ . 1 . 2]" 1
561 1 18 THR HA 1 19 VAL HB 4.850 . 5.306 4.755 4.676 4.798 . 0 0 "[ . 1 . 2]" 1
562 1 87 GLN HA 1 87 GLN QG 3.350 . 3.806 2.645 2.386 3.353 . 0 0 "[ . 1 . 2]" 1
563 1 87 GLN QG 1 90 ARG H 5.110 . 5.565 4.806 4.285 5.173 . 0 0 "[ . 1 . 2]" 1
564 1 87 GLN H 1 87 GLN QG 4.030 . 4.485 3.793 2.070 4.063 . 0 0 "[ . 1 . 2]" 1
565 1 62 SER H 1 65 GLU HG3 4.980 . 5.436 4.557 4.041 5.152 . 0 0 "[ . 1 . 2]" 1
566 1 61 LEU MD1 1 65 GLU HG3 5.240 . 5.695 3.454 3.132 3.687 . 0 0 "[ . 1 . 2]" 1
567 1 65 GLU HG2 1 69 TRP HD1 5.390 . 5.845 5.246 4.900 5.499 . 0 0 "[ . 1 . 2]" 1
568 1 65 GLU H 1 65 GLU HG3 4.660 . 5.115 4.429 4.369 4.473 . 0 0 "[ . 1 . 2]" 1
569 1 65 GLU H 1 65 GLU HG2 4.810 . 5.266 4.578 4.545 4.610 . 0 0 "[ . 1 . 2]" 1
570 1 61 LEU HG 1 65 GLU HG2 5.320 . 5.620 4.717 4.331 5.235 . 0 0 "[ . 1 . 2]" 1
571 1 65 GLU HA 1 65 GLU HG2 3.790 . 4.246 3.816 3.748 3.893 . 0 0 "[ . 1 . 2]" 1
572 1 62 SER H 1 65 GLU HG2 4.580 . 5.036 3.471 3.142 4.122 . 0 0 "[ . 1 . 2]" 1
573 1 61 LEU HG 1 65 GLU HG3 5.500 . 5.700 5.697 5.457 5.776 0.076 16 0 "[ . 1 . 2]" 1
574 1 61 LEU HB2 1 65 GLU HG3 5.500 . 5.700 5.265 4.961 5.642 . 0 0 "[ . 1 . 2]" 1
575 1 61 LEU MD1 1 65 GLU HG2 5.450 . 5.750 3.401 2.684 3.952 . 0 0 "[ . 1 . 2]" 1
576 1 12 VAL HB 1 20 LEU HG 5.480 . 5.936 5.965 5.901 6.000 0.065 18 0 "[ . 1 . 2]" 1
577 1 12 VAL HB 1 47 HIS HB3 4.930 . 5.385 2.330 2.002 2.863 . 0 0 "[ . 1 . 2]" 1
578 1 12 VAL H 1 12 VAL HB 4.170 . 4.626 3.792 3.730 3.835 . 0 0 "[ . 1 . 2]" 1
579 1 78 GLU HA 1 78 GLU HG2 3.860 . 4.315 3.722 3.606 3.870 . 0 0 "[ . 1 . 2]" 1
580 1 78 GLU H 1 78 GLU HG3 4.710 . 5.166 3.201 2.751 3.839 . 0 0 "[ . 1 . 2]" 1
581 1 78 GLU HG3 1 79 LYS H 5.210 . 5.666 3.496 2.306 4.515 . 0 0 "[ . 1 . 2]" 1
582 1 78 GLU HA 1 78 GLU HG3 4.000 . 4.456 3.872 3.654 4.258 . 0 0 "[ . 1 . 2]" 1
583 1 78 GLU HG3 1 79 LYS HA 4.540 . 4.996 4.021 3.168 5.069 0.073 2 0 "[ . 1 . 2]" 1
584 1 78 GLU HB3 1 78 GLU HG2 2.710 . 3.165 2.567 2.320 3.006 . 0 0 "[ . 1 . 2]" 1
585 1 62 SER HB2 1 64 GLU HG2 3.700 . 4.155 2.408 1.910 2.904 . 0 0 "[ . 1 . 2]" 1
586 1 62 SER HB2 1 64 GLU HG3 3.610 . 4.065 3.101 2.460 4.128 0.062 6 0 "[ . 1 . 2]" 1
587 1 64 GLU HG3 1 68 LEU MD1 5.340 . 5.795 4.551 4.136 5.241 . 0 0 "[ . 1 . 2]" 1
588 1 64 GLU HG3 1 67 ALA MB 5.460 . 5.916 5.415 5.107 5.876 . 0 0 "[ . 1 . 2]" 1
589 1 52 GLU HG2 1 56 LEU MD2 5.100 . 5.556 3.457 3.093 4.210 . 0 0 "[ . 1 . 2]" 1
590 1 52 GLU HG2 1 56 LEU MD1 4.450 . 4.905 2.652 2.170 3.777 . 0 0 "[ . 1 . 2]" 1
591 1 52 GLU HG3 1 56 LEU MD1 4.430 . 4.885 4.038 3.616 4.930 0.045 18 0 "[ . 1 . 2]" 1
592 1 52 GLU H 1 52 GLU HG2 4.570 . 5.025 4.470 4.017 4.566 . 0 0 "[ . 1 . 2]" 1
593 1 52 GLU HG3 1 53 ARG H 5.170 . 5.626 4.865 4.629 4.968 . 0 0 "[ . 1 . 2]" 1
594 1 52 GLU HG2 1 53 ARG H 4.850 . 5.306 4.185 3.759 5.081 . 0 0 "[ . 1 . 2]" 1
595 1 52 GLU HG3 1 66 PHE QE 4.960 . 5.416 2.896 2.316 3.250 . 0 0 "[ . 1 . 2]" 1
596 1 52 GLU HG3 1 66 PHE QD 4.960 . 5.416 3.316 2.663 4.154 . 0 0 "[ . 1 . 2]" 1
597 1 52 GLU HG2 1 53 ARG HA 5.480 . 5.936 4.333 3.569 6.075 0.139 6 0 "[ . 1 . 2]" 1
598 1 42 VAL HA 1 52 GLU HG3 5.470 . 5.925 5.904 5.594 6.047 0.121 19 0 "[ . 1 . 2]" 1
599 1 52 GLU HG2 1 55 ALA MB 5.000 . 5.456 4.280 3.884 4.709 . 0 0 "[ . 1 . 2]" 1
600 1 52 GLU HG3 1 56 LEU MD2 4.970 . 5.425 4.218 3.767 5.429 0.003 18 0 "[ . 1 . 2]" 1
601 1 63 GLU HA 1 63 GLU QG 3.380 . 3.836 2.321 2.208 2.425 . 0 0 "[ . 1 . 2]" 1
602 1 63 GLU QG 1 64 GLU H 4.640 . 5.095 3.977 3.674 4.463 . 0 0 "[ . 1 . 2]" 1
603 1 62 SER HA 1 63 GLU QG 5.300 . 5.600 5.396 3.893 5.719 0.119 18 0 "[ . 1 . 2]" 1
604 1 54 GLU H 1 54 GLU HG2 4.700 . 5.155 4.496 4.360 4.616 . 0 0 "[ . 1 . 2]" 1
605 1 25 LEU MD1 1 54 GLU HG2 5.500 . 5.956 4.612 4.063 5.103 . 0 0 "[ . 1 . 2]" 1
606 1 51 THR H 1 54 GLU HG2 5.060 . 5.360 3.841 2.890 5.051 . 0 0 "[ . 1 . 2]" 1
607 1 51 THR H 1 54 GLU HG3 5.060 . 5.360 4.586 3.938 5.099 . 0 0 "[ . 1 . 2]" 1
608 1 25 LEU MD1 1 54 GLU HG3 5.500 . 5.956 5.077 3.851 6.030 0.074 5 0 "[ . 1 . 2]" 1
609 1 59 TYR HB3 1 61 LEU HG 4.280 . 4.735 2.613 2.309 2.953 . 0 0 "[ . 1 . 2]" 1
610 1 59 TYR H 1 59 TYR HB3 4.200 . 4.655 3.691 3.633 3.753 . 0 0 "[ . 1 . 2]" 1
611 1 59 TYR HB2 1 61 LEU HG 4.130 . 4.585 2.072 1.792 2.378 0.008 4 0 "[ . 1 . 2]" 1
612 1 55 ALA MB 1 59 TYR HB2 5.240 . 5.695 4.208 3.872 4.578 . 0 0 "[ . 1 . 2]" 1
613 1 59 TYR HB2 1 61 LEU HB3 5.500 . 5.956 4.782 4.582 5.000 . 0 0 "[ . 1 . 2]" 1
614 1 42 VAL MG1 1 46 ILE HB 5.080 . 5.536 4.759 4.320 4.988 . 0 0 "[ . 1 . 2]" 1
615 1 42 VAL MG2 1 46 ILE HB 5.300 . 5.755 4.055 3.639 4.282 . 0 0 "[ . 1 . 2]" 1
616 1 46 ILE HB 1 47 HIS HD2 4.960 . 5.416 4.594 4.193 5.184 . 0 0 "[ . 1 . 2]" 1
617 1 45 VAL HB 1 46 ILE HB 5.080 . 5.536 4.802 4.498 5.007 . 0 0 "[ . 1 . 2]" 1
618 1 45 VAL H 1 46 ILE HB 5.080 . 5.536 4.714 4.323 4.866 . 0 0 "[ . 1 . 2]" 1
619 1 55 ALA MB 1 59 TYR HB3 5.500 . 5.956 5.474 5.087 5.899 . 0 0 "[ . 1 . 2]" 1
620 1 81 LEU HG 1 89 TYR HB3 5.500 . 6.500 6.436 5.844 6.598 0.098 1 0 "[ . 1 . 2]" 1
621 1 89 TYR HB3 1 92 LEU MD1 5.500 . 5.700 4.586 3.242 5.785 0.085 1 0 "[ . 1 . 2]" 1
622 1 86 ILE HB 1 89 TYR HD2 5.500 . 5.956 4.903 4.430 5.422 . 0 0 "[ . 1 . 2]" 1
623 1 81 LEU MD2 1 89 TYR HB2 5.310 . 5.810 5.200 3.645 5.847 0.037 5 0 "[ . 1 . 2]" 1
624 1 81 LEU HG 1 89 TYR HB2 5.410 . 6.410 6.062 5.560 6.413 0.003 4 0 "[ . 1 . 2]" 1
625 1 86 ILE HB 1 89 TYR HB2 5.500 . 5.956 5.395 4.935 5.855 . 0 0 "[ . 1 . 2]" 1
626 1 2 TYR QB 1 4 LYS H 5.400 . 5.856 4.625 3.180 5.970 0.115 9 0 "[ . 1 . 2]" 1
627 1 61 LEU MD1 1 66 PHE HB2 4.910 . 5.365 3.580 3.212 3.901 . 0 0 "[ . 1 . 2]" 1
628 1 65 GLU HB3 1 66 PHE HB2 5.180 . 5.635 3.928 3.658 4.103 . 0 0 "[ . 1 . 2]" 1
629 1 65 GLU HB3 1 66 PHE HB3 5.500 . 5.956 4.761 4.599 4.925 . 0 0 "[ . 1 . 2]" 1
630 1 14 LEU HB2 1 15 PRO HD2 4.000 . 4.456 3.907 3.494 4.257 . 0 0 "[ . 1 . 2]" 1
631 1 14 LEU HB2 1 18 THR HA 4.030 . 4.485 4.263 4.073 4.442 . 0 0 "[ . 1 . 2]" 1
632 1 14 LEU HB3 1 15 PRO HD2 3.720 . 4.175 2.324 1.884 2.750 . 0 0 "[ . 1 . 2]" 1
633 1 13 THR HA 1 14 LEU HB2 4.400 . 4.856 4.552 4.459 4.608 . 0 0 "[ . 1 . 2]" 1
634 1 14 LEU HB3 1 18 THR MG 5.500 . 5.956 5.076 4.752 5.310 . 0 0 "[ . 1 . 2]" 1
635 1 14 LEU HB2 1 18 THR MG 5.330 . 5.786 4.090 3.836 4.332 . 0 0 "[ . 1 . 2]" 1
636 1 14 LEU HB2 1 19 VAL H 5.500 . 5.956 4.932 4.687 5.059 . 0 0 "[ . 1 . 2]" 1
637 1 55 ALA MB 1 56 LEU HB3 5.450 . 5.905 5.150 5.084 5.233 . 0 0 "[ . 1 . 2]" 1
638 1 56 LEU HB3 1 61 LEU HG 5.300 . 5.755 5.533 5.111 5.772 0.017 20 0 "[ . 1 . 2]" 1
639 1 53 ARG HA 1 56 LEU HB2 4.610 . 5.110 2.794 2.245 3.290 . 0 0 "[ . 1 . 2]" 1
640 1 53 ARG HA 1 56 LEU HB3 4.900 . 5.400 4.379 3.885 4.867 . 0 0 "[ . 1 . 2]" 1
641 1 55 ALA MB 1 56 LEU HB2 5.320 . 5.775 4.620 4.521 4.720 . 0 0 "[ . 1 . 2]" 1
642 1 25 LEU HB3 1 26 PRO HD2 4.800 . 5.255 2.558 2.108 2.862 . 0 0 "[ . 1 . 2]" 1
643 1 25 LEU HB3 1 26 PRO HD3 4.380 . 4.835 4.008 3.603 4.266 . 0 0 "[ . 1 . 2]" 1
644 1 22 ARG HA 1 25 LEU HB2 5.460 . 5.916 3.962 3.286 4.351 . 0 0 "[ . 1 . 2]" 1
645 1 25 LEU HB2 1 26 PRO HD3 4.920 . 5.376 5.039 4.801 5.170 . 0 0 "[ . 1 . 2]" 1
646 1 53 ARG HA 1 57 ASP HB2 5.440 . 5.896 4.822 4.467 5.283 . 0 0 "[ . 1 . 2]" 1
647 1 57 ASP HB2 1 59 TYR H 5.500 . 5.956 5.552 4.876 5.865 . 0 0 "[ . 1 . 2]" 1
648 1 57 ASP HB3 1 59 TYR H 5.500 . 5.956 4.944 4.707 5.494 . 0 0 "[ . 1 . 2]" 1
649 1 65 GLU HA 1 68 LEU HB2 4.210 . 4.666 3.265 3.046 3.408 . 0 0 "[ . 1 . 2]" 1
650 1 68 LEU H 1 68 LEU HB3 3.710 . 4.166 3.595 3.579 3.613 . 0 0 "[ . 1 . 2]" 1
651 1 68 LEU HB2 1 68 LEU MD1 3.300 . 3.756 2.329 2.296 2.363 . 0 0 "[ . 1 . 2]" 1
652 1 68 LEU HB2 1 69 TRP HA 5.430 . 5.885 4.239 4.128 4.314 . 0 0 "[ . 1 . 2]" 1
653 1 68 LEU HB3 1 69 TRP HA 5.200 . 5.655 4.402 4.235 4.514 . 0 0 "[ . 1 . 2]" 1
654 1 28 LEU H 1 28 LEU HB2 4.080 . 4.536 2.557 2.484 2.597 . 0 0 "[ . 1 . 2]" 1
655 1 38 LYS HE3 1 69 TRP HZ2 5.500 . 5.956 4.555 4.090 5.275 . 0 0 "[ . 1 . 2]" 1
656 1 38 LYS HE2 1 69 TRP HE1 5.160 . 5.615 3.031 2.590 4.735 . 0 0 "[ . 1 . 2]" 1
657 1 33 TRP HB3 1 38 LYS HE2 4.540 . 5.040 2.525 2.178 3.115 . 0 0 "[ . 1 . 2]" 1
658 1 33 TRP HB2 1 38 LYS HE3 4.650 . 5.150 2.729 2.083 4.090 . 0 0 "[ . 1 . 2]" 1
659 1 33 TRP HB2 1 38 LYS HE2 4.840 . 5.340 2.732 2.231 3.375 . 0 0 "[ . 1 . 2]" 1
660 1 33 TRP HA 1 38 LYS HE3 5.500 . 5.800 4.528 4.106 5.843 0.043 11 0 "[ . 1 . 2]" 1
661 1 33 TRP HA 1 38 LYS HE2 5.390 . 5.690 4.953 4.092 5.536 . 0 0 "[ . 1 . 2]" 1
662 1 35 ALA HA 1 38 LYS HE2 5.500 . 5.956 5.595 4.573 5.983 0.028 12 0 "[ . 1 . 2]" 1
663 1 50 ILE HB 1 54 GLU H 5.190 . 5.690 4.852 4.678 5.058 . 0 0 "[ . 1 . 2]" 1
664 1 7 ASP HB3 1 8 GLY H 4.630 . 5.085 4.001 2.746 4.437 . 0 0 "[ . 1 . 2]" 1
665 1 50 ILE HB 1 51 THR MG 4.260 . 4.715 3.692 3.574 3.865 . 0 0 "[ . 1 . 2]" 1
666 1 50 ILE HB 1 54 GLU HB2 4.130 . 4.430 3.734 3.317 4.193 . 0 0 "[ . 1 . 2]" 1
667 1 45 VAL HA 1 50 ILE HB 5.500 . 5.956 5.025 4.891 5.141 . 0 0 "[ . 1 . 2]" 1
668 1 50 ILE HB 1 51 THR HA 5.500 . 5.956 4.632 4.482 4.736 . 0 0 "[ . 1 . 2]" 1
669 1 50 ILE HB 1 55 ALA H 5.420 . 5.620 4.309 4.064 4.534 . 0 0 "[ . 1 . 2]" 1
670 1 39 ALA MB 1 43 LYS QE 3.640 . 4.140 2.186 1.847 2.539 . 0 0 "[ . 1 . 2]" 1
671 1 14 LEU MD2 1 24 ASP QB 4.980 . 5.436 5.088 4.545 5.538 0.103 12 0 "[ . 1 . 2]" 1
672 1 43 LYS H 1 43 LYS QE 4.800 . 5.255 4.523 4.335 4.658 . 0 0 "[ . 1 . 2]" 1
673 1 23 ALA HA 1 24 ASP QB 5.500 . 5.956 5.255 5.057 5.385 . 0 0 "[ . 1 . 2]" 1
674 1 43 LYS QE 1 73 VAL MG1 3.800 . 4.255 2.524 2.031 3.234 . 0 0 "[ . 1 . 2]" 1
675 1 43 LYS HA 1 43 LYS QE 4.870 . 5.326 4.641 4.543 4.956 . 0 0 "[ . 1 . 2]" 1
676 1 79 LYS QE 1 79 LYS HG3 3.440 . 3.895 2.619 2.299 3.397 . 0 0 "[ . 1 . 2]" 1
677 1 79 LYS QE 1 79 LYS HG2 3.440 . 3.895 2.810 2.284 3.505 . 0 0 "[ . 1 . 2]" 1
678 1 81 LEU HB2 1 81 LEU MD1 3.400 . 3.855 2.301 2.214 2.398 . 0 0 "[ . 1 . 2]" 1
679 1 81 LEU HB3 1 81 LEU HG 2.700 . 3.155 2.551 2.476 2.633 . 0 0 "[ . 1 . 2]" 1
680 1 49 LEU HB3 1 50 ILE QG 3.380 . 3.836 3.242 3.143 3.374 . 0 0 "[ . 1 . 2]" 1
681 1 49 LEU HB2 1 50 ILE H 4.490 . 4.945 3.692 3.615 3.817 . 0 0 "[ . 1 . 2]" 1
682 1 31 ARG HA 1 31 ARG HD2 4.390 . 4.845 2.574 1.774 3.791 0.026 9 0 "[ . 1 . 2]" 1
683 1 53 ARG HA 1 53 ARG HD3 3.980 . 4.436 2.781 1.781 4.463 0.027 7 0 "[ . 1 . 2]" 1
684 1 32 ARG QD 1 34 VAL MG1 4.170 . 4.626 3.958 2.358 4.667 0.041 7 0 "[ . 1 . 2]" 1
685 1 10 ARG H 1 22 ARG QD 4.530 . 4.985 4.553 2.948 5.019 0.033 14 0 "[ . 1 . 2]" 1
686 1 70 ARG HB2 1 70 ARG QD 3.410 . 3.865 2.925 2.422 3.233 . 0 0 "[ . 1 . 2]" 1
687 1 70 ARG HB3 1 70 ARG QD 3.550 . 4.005 2.351 2.202 2.558 . 0 0 "[ . 1 . 2]" 1
688 1 26 PRO HB3 1 37 ARG HD2 4.460 . 4.916 4.141 3.611 4.754 . 0 0 "[ . 1 . 2]" 1
689 1 37 ARG HB2 1 37 ARG HD2 3.900 . 4.356 2.603 2.467 2.787 . 0 0 "[ . 1 . 2]" 1
690 1 25 LEU MD1 1 58 ARG HD2 4.390 . 4.845 3.671 2.664 4.287 . 0 0 "[ . 1 . 2]" 1
691 1 37 ARG HA 1 37 ARG HD2 4.890 . 5.345 4.659 4.623 4.694 . 0 0 "[ . 1 . 2]" 1
692 1 58 ARG H 1 58 ARG HD3 5.280 . 5.735 4.551 4.148 4.919 . 0 0 "[ . 1 . 2]" 1
693 1 37 ARG HD2 1 38 LYS H 5.430 . 5.885 5.305 5.045 5.690 . 0 0 "[ . 1 . 2]" 1
694 1 25 LEU MD1 1 58 ARG HD3 4.390 . 4.845 3.493 2.937 4.107 . 0 0 "[ . 1 . 2]" 1
695 1 55 ALA HA 1 58 ARG HD2 4.460 . 4.916 3.413 2.607 3.982 . 0 0 "[ . 1 . 2]" 1
696 1 8 GLY HA3 1 9 PRO HD2 3.420 . 3.875 2.938 2.047 3.774 . 0 0 "[ . 1 . 2]" 1
697 1 13 THR MG 1 17 GLY HA3 4.400 . 4.856 4.698 3.740 4.945 0.089 16 0 "[ . 1 . 2]" 1
698 1 14 LEU MD2 1 20 LEU HB2 4.780 . 5.530 1.722 1.683 1.756 0.117 1 0 "[ . 1 . 2]" 1
699 1 14 LEU MD1 1 20 LEU HB2 3.930 . 4.680 2.876 2.359 3.306 . 0 0 "[ . 1 . 2]" 1
700 1 11 GLN HA 1 20 LEU HB3 5.430 . 5.885 5.061 4.640 5.301 . 0 0 "[ . 1 . 2]" 1
701 1 14 LEU MD1 1 20 LEU HB3 3.860 . 4.860 3.244 2.992 3.550 . 0 0 "[ . 1 . 2]" 1
702 1 14 LEU H 1 20 LEU HB3 4.930 . 5.680 5.027 4.628 5.318 . 0 0 "[ . 1 . 2]" 1
703 1 12 VAL HB 1 20 LEU HB3 5.260 . 5.715 4.528 4.292 4.740 . 0 0 "[ . 1 . 2]" 1
704 1 12 VAL H 1 20 LEU HB2 5.030 . 5.485 4.919 4.552 5.105 . 0 0 "[ . 1 . 2]" 1
705 1 20 LEU HB2 1 43 LYS HB2 5.080 . 5.536 5.024 4.682 5.311 . 0 0 "[ . 1 . 2]" 1
706 1 77 GLY HA2 1 78 GLU HA 5.260 . 5.715 4.598 4.421 4.912 . 0 0 "[ . 1 . 2]" 1
707 1 77 GLY HA3 1 78 GLU HA 5.260 . 5.715 4.607 4.400 4.721 . 0 0 "[ . 1 . 2]" 1
708 1 56 LEU HA 1 61 LEU HB3 4.260 . 4.760 3.579 3.466 3.797 . 0 0 "[ . 1 . 2]" 1
709 1 61 LEU HB3 1 65 GLU HB2 4.920 . 5.376 3.949 3.300 4.393 . 0 0 "[ . 1 . 2]" 1
710 1 12 VAL MG2 1 48 GLY HA2 5.500 . 5.956 5.908 5.597 5.998 0.043 20 0 "[ . 1 . 2]" 1
711 1 47 HIS HA 1 48 GLY HA2 5.330 . 5.786 5.032 4.978 5.094 . 0 0 "[ . 1 . 2]" 1
712 1 48 GLY HA3 1 50 ILE H 5.500 . 5.956 5.121 4.878 5.471 . 0 0 "[ . 1 . 2]" 1
713 1 47 HIS H 1 48 GLY HA2 5.500 . 5.956 4.722 4.570 4.915 . 0 0 "[ . 1 . 2]" 1
714 1 47 HIS H 1 48 GLY HA3 5.300 . 5.755 5.060 4.938 5.214 . 0 0 "[ . 1 . 2]" 1
715 1 12 VAL MG2 1 48 GLY HA3 5.500 . 5.956 5.595 5.293 5.807 . 0 0 "[ . 1 . 2]" 1
716 1 45 VAL HA 1 48 GLY HA2 5.160 . 5.615 3.991 3.712 4.232 . 0 0 "[ . 1 . 2]" 1
717 1 47 HIS HA 1 48 GLY HA3 5.430 . 5.885 4.418 4.372 4.467 . 0 0 "[ . 1 . 2]" 1
718 1 45 VAL HA 1 48 GLY HA3 5.500 . 5.956 5.535 5.294 5.782 . 0 0 "[ . 1 . 2]" 1
719 1 48 GLY HA2 1 49 LEU HB3 5.500 . 5.956 5.305 5.218 5.390 . 0 0 "[ . 1 . 2]" 1
720 1 9 PRO HD2 1 49 LEU MD1 4.970 . 5.425 3.635 1.797 5.428 0.003 12 0 "[ . 1 . 2]" 1
721 1 8 GLY HA2 1 9 PRO HD3 3.400 . 3.855 2.322 1.854 3.584 . 0 0 "[ . 1 . 2]" 1
722 1 8 GLY HA2 1 9 PRO HD2 3.420 . 3.875 3.186 2.378 3.878 0.003 11 0 "[ . 1 . 2]" 1
723 1 8 GLY H 1 9 PRO HD2 4.940 . 5.396 4.982 3.389 5.404 0.009 14 0 "[ . 1 . 2]" 1
724 1 8 GLY HA3 1 9 PRO HD3 3.400 . 3.855 2.854 2.075 3.715 . 0 0 "[ . 1 . 2]" 1
725 1 9 PRO HD3 1 49 LEU MD1 5.500 . 5.956 4.949 3.233 5.981 0.026 16 0 "[ . 1 . 2]" 1
726 1 26 PRO HD3 1 37 ARG HB3 4.260 . 4.715 4.286 3.904 4.740 0.025 7 0 "[ . 1 . 2]" 1
727 1 25 LEU H 1 26 PRO HD2 4.950 . 5.405 4.706 4.636 4.780 . 0 0 "[ . 1 . 2]" 1
728 1 26 PRO HD3 1 40 ALA MB 3.860 . 4.315 2.270 2.074 2.538 . 0 0 "[ . 1 . 2]" 1
729 1 25 LEU HB2 1 26 PRO HD2 4.660 . 5.115 3.977 3.663 4.173 . 0 0 "[ . 1 . 2]" 1
730 1 25 LEU HG 1 26 PRO HD2 5.100 . 5.556 4.322 4.157 4.550 . 0 0 "[ . 1 . 2]" 1
731 1 14 LEU H 1 15 PRO HD3 5.380 . 5.835 4.912 4.638 5.271 . 0 0 "[ . 1 . 2]" 1
732 1 14 LEU HB2 1 15 PRO HD3 5.220 . 5.675 4.591 4.256 4.891 . 0 0 "[ . 1 . 2]" 1
733 1 14 LEU HG 1 15 PRO HD3 5.140 . 5.595 5.130 4.659 5.590 . 0 0 "[ . 1 . 2]" 1
734 1 14 LEU HB3 1 15 PRO HD3 3.770 . 4.226 3.413 2.971 3.828 . 0 0 "[ . 1 . 2]" 1
735 1 14 LEU MD2 1 15 PRO HD3 4.640 . 5.095 4.782 4.390 5.125 0.030 12 0 "[ . 1 . 2]" 1
736 1 15 PRO HD2 1 43 LYS HB3 5.170 . 5.626 4.978 4.171 5.626 0.000 19 0 "[ . 1 . 2]" 1
737 1 15 PRO HD3 1 43 LYS HB3 4.770 . 5.226 5.016 4.215 5.323 0.097 16 0 "[ . 1 . 2]" 1
738 1 26 PRO HA 1 27 PRO HD3 3.390 . 3.845 2.395 1.960 2.576 . 0 0 "[ . 1 . 2]" 1
739 1 26 PRO HA 1 27 PRO HD2 3.390 . 3.845 2.264 2.047 2.872 . 0 0 "[ . 1 . 2]" 1
740 1 26 PRO HB3 1 27 PRO HD3 4.210 . 4.666 4.144 3.490 4.398 . 0 0 "[ . 1 . 2]" 1
741 1 61 LEU HA 1 65 GLU HB3 4.680 . 5.135 4.051 3.602 4.411 . 0 0 "[ . 1 . 2]" 1
742 1 60 SER HA 1 61 LEU HA 5.080 . 5.536 4.513 4.383 4.672 . 0 0 "[ . 1 . 2]" 1
743 1 61 LEU HA 1 61 LEU HG 3.690 . 4.146 3.117 2.984 3.281 . 0 0 "[ . 1 . 2]" 1
744 1 61 LEU HA 1 61 LEU MD1 4.540 . 4.996 3.886 3.858 3.904 . 0 0 "[ . 1 . 2]" 1
745 1 56 LEU HA 1 61 LEU HA 4.690 . 5.146 4.462 4.276 4.658 . 0 0 "[ . 1 . 2]" 1
746 1 56 LEU HB3 1 61 LEU HA 5.250 . 5.706 5.249 5.089 5.453 . 0 0 "[ . 1 . 2]" 1
747 1 61 LEU HA 1 65 GLU HB2 5.500 . 5.956 4.445 3.860 5.056 . 0 0 "[ . 1 . 2]" 1
748 1 80 ALA HA 1 81 LEU HB3 5.500 . 5.956 5.744 5.649 5.968 0.013 5 0 "[ . 1 . 2]" 1
749 1 80 ALA HA 1 81 LEU HB2 4.380 . 4.835 4.559 4.376 4.917 0.082 5 0 "[ . 1 . 2]" 1
750 1 29 ASP HA 1 30 THR MG 5.500 . 6.000 5.840 4.293 6.103 0.103 7 0 "[ . 1 . 2]" 1
751 1 15 PRO HA 1 16 ASP HA 5.040 . 5.496 4.752 4.589 4.825 . 0 0 "[ . 1 . 2]" 1
752 1 16 ASP HA 1 17 GLY HA3 5.360 . 5.815 4.519 4.371 4.580 . 0 0 "[ . 1 . 2]" 1
753 1 16 ASP HA 1 18 THR H 5.020 . 5.476 4.596 4.269 5.479 0.003 13 0 "[ . 1 . 2]" 1
754 1 25 LEU HA 1 25 LEU HG 4.210 . 4.666 2.916 2.823 3.017 . 0 0 "[ . 1 . 2]" 1
755 1 25 LEU HA 1 26 PRO HG3 4.550 . 5.005 4.435 4.343 4.598 . 0 0 "[ . 1 . 2]" 1
756 1 25 LEU HA 1 26 PRO HD3 3.470 . 3.925 2.432 2.363 2.571 . 0 0 "[ . 1 . 2]" 1
757 1 25 LEU HA 1 26 PRO HD2 3.250 . 3.705 2.114 1.936 2.384 . 0 0 "[ . 1 . 2]" 1
758 1 25 LEU HA 1 40 ALA MB 4.170 . 4.626 3.183 2.889 3.515 . 0 0 "[ . 1 . 2]" 1
759 1 74 ALA HA 1 75 ALA H 3.500 . 3.955 3.475 3.067 3.557 . 0 0 "[ . 1 . 2]" 1
760 1 73 VAL MG1 1 74 ALA HA 3.930 . 4.385 3.225 2.945 3.519 . 0 0 "[ . 1 . 2]" 1
761 1 20 LEU HA 1 24 ASP QB 3.460 . 3.960 2.846 2.624 3.140 . 0 0 "[ . 1 . 2]" 1
762 1 14 LEU HA 1 15 PRO HD3 3.220 . 3.675 2.175 1.922 2.568 . 0 0 "[ . 1 . 2]" 1
763 1 14 LEU HA 1 14 LEU HG 3.960 . 4.416 3.737 3.703 3.784 . 0 0 "[ . 1 . 2]" 1
764 1 14 LEU HA 1 15 PRO HD2 3.110 . 3.566 2.641 2.294 3.019 . 0 0 "[ . 1 . 2]" 1
765 1 14 LEU HA 1 18 THR H 5.230 . 5.686 4.894 4.463 5.215 . 0 0 "[ . 1 . 2]" 1
766 1 72 ALA HA 1 74 ALA H 5.500 . 5.956 5.172 4.619 5.670 . 0 0 "[ . 1 . 2]" 1
767 1 11 GLN HA 1 21 SER HB2 4.910 . 5.410 3.875 3.485 4.746 . 0 0 "[ . 1 . 2]" 1
768 1 11 GLN HA 1 22 ARG H 3.650 . 3.850 3.539 3.312 3.714 . 0 0 "[ . 1 . 2]" 1
769 1 11 GLN HA 1 21 SER HA 2.870 . 3.000 1.791 1.727 1.896 0.073 19 0 "[ . 1 . 2]" 1
770 1 11 GLN HA 1 21 SER HB3 4.910 . 5.410 3.571 3.342 3.945 . 0 0 "[ . 1 . 2]" 1
771 1 24 ASP HA 1 25 LEU HB2 5.500 . 5.956 5.434 5.351 5.560 . 0 0 "[ . 1 . 2]" 1
772 1 32 ARG HA 1 32 ARG HG2 3.920 . 4.376 3.150 2.333 3.788 . 0 0 "[ . 1 . 2]" 1
773 1 32 ARG HA 1 32 ARG HG3 3.920 . 4.376 3.184 2.479 3.847 . 0 0 "[ . 1 . 2]" 1
774 1 23 ALA MB 1 24 ASP HA 4.660 . 5.115 4.032 3.957 4.103 . 0 0 "[ . 1 . 2]" 1
775 1 32 ARG HA 1 33 TRP HD1 5.440 . 5.896 4.489 3.828 4.894 . 0 0 "[ . 1 . 2]" 1
776 1 32 ARG HA 1 32 ARG QD 4.370 . 4.826 3.856 1.905 4.486 . 0 0 "[ . 1 . 2]" 1
777 1 38 LYS HB3 1 39 ALA HA 4.860 . 5.315 4.312 4.189 4.409 . 0 0 "[ . 1 . 2]" 1
778 1 39 ALA HA 1 73 VAL HB 4.350 . 4.806 3.998 3.473 4.714 . 0 0 "[ . 1 . 2]" 1
779 1 39 ALA HA 1 42 VAL MG1 3.270 . 3.770 1.926 1.804 2.015 . 0 0 "[ . 1 . 2]" 1
780 1 44 ALA HA 1 49 LEU HB2 3.880 . 4.335 3.125 2.973 3.276 . 0 0 "[ . 1 . 2]" 1
781 1 43 LYS H 1 44 ALA HA 5.500 . 5.956 5.193 5.127 5.243 . 0 0 "[ . 1 . 2]" 1
782 1 44 ALA HA 1 46 ILE H 5.500 . 5.956 4.573 4.452 4.721 . 0 0 "[ . 1 . 2]" 1
783 1 44 ALA HA 1 49 LEU HB3 3.680 . 4.135 2.494 2.388 2.606 . 0 0 "[ . 1 . 2]" 1
784 1 67 ALA HA 1 70 ARG QD 3.970 . 4.320 2.454 1.828 3.324 . 0 0 "[ . 1 . 2]" 1
785 1 67 ALA HA 1 70 ARG QG 3.980 . 4.280 2.303 2.039 2.563 . 0 0 "[ . 1 . 2]" 1
786 1 44 ALA HA 1 49 LEU MD2 4.060 . 4.516 2.877 2.741 3.088 . 0 0 "[ . 1 . 2]" 1
787 1 20 LEU HG 1 44 ALA HA 4.330 . 4.786 3.841 3.718 3.981 . 0 0 "[ . 1 . 2]" 1
788 1 31 ARG HA 1 31 ARG HD3 4.390 . 4.845 2.937 1.799 3.848 0.001 4 0 "[ . 1 . 2]" 1
789 1 30 THR MG 1 31 ARG HA 4.910 . 5.365 3.581 3.235 4.138 . 0 0 "[ . 1 . 2]" 1
790 1 39 ALA MB 1 40 ALA HA 4.330 . 4.786 3.808 3.754 3.852 . 0 0 "[ . 1 . 2]" 1
791 1 40 ALA HA 1 43 LYS QE 5.020 . 5.476 4.848 4.327 5.248 . 0 0 "[ . 1 . 2]" 1
792 1 31 ARG HA 1 33 TRP HE1 4.530 . 4.985 3.043 2.412 3.717 . 0 0 "[ . 1 . 2]" 1
793 1 40 ALA HA 1 43 LYS H 4.230 . 4.686 3.861 3.738 4.011 . 0 0 "[ . 1 . 2]" 1
794 1 81 LEU HA 1 81 LEU MD2 4.180 . 4.635 3.703 3.596 3.793 . 0 0 "[ . 1 . 2]" 1
795 1 92 LEU HA 1 92 LEU MD1 4.440 . 4.896 3.644 2.529 4.135 . 0 0 "[ . 1 . 2]" 1
796 1 20 LEU MD2 1 40 ALA HA 4.660 . 5.115 3.091 2.708 3.488 . 0 0 "[ . 1 . 2]" 1
797 1 40 ALA HA 1 43 LYS HB3 4.470 . 4.925 4.594 4.440 4.858 . 0 0 "[ . 1 . 2]" 1
798 1 81 LEU HA 1 81 LEU HG 3.480 . 3.935 2.448 2.312 2.507 . 0 0 "[ . 1 . 2]" 1
799 1 81 LEU HA 1 81 LEU MD1 3.210 . 3.665 2.912 2.525 3.294 . 0 0 "[ . 1 . 2]" 1
800 1 54 GLU H 1 55 ALA HA 5.360 . 5.815 5.210 5.039 5.331 . 0 0 "[ . 1 . 2]" 1
801 1 55 ALA HA 1 59 TYR HD2 4.250 . 4.706 2.710 2.380 2.986 . 0 0 "[ . 1 . 2]" 1
802 1 55 ALA HA 1 58 ARG HG3 4.180 . 4.635 3.238 3.031 3.540 . 0 0 "[ . 1 . 2]" 1
803 1 54 GLU HB3 1 55 ALA HA 5.060 . 5.516 4.319 4.083 4.489 . 0 0 "[ . 1 . 2]" 1
804 1 55 ALA HA 1 56 LEU HG 5.440 . 5.896 5.344 5.228 5.458 . 0 0 "[ . 1 . 2]" 1
805 1 41 VAL MG1 1 55 ALA HA 4.100 . 4.556 3.510 3.348 3.819 . 0 0 "[ . 1 . 2]" 1
806 1 55 ALA HA 1 58 ARG HD3 4.460 . 4.916 3.345 2.119 4.776 . 0 0 "[ . 1 . 2]" 1
807 1 55 ALA HA 1 58 ARG H 4.430 . 4.885 3.768 3.600 3.948 . 0 0 "[ . 1 . 2]" 1
808 1 55 ALA HA 1 58 ARG HB3 4.190 . 4.646 4.657 4.542 4.712 0.066 17 0 "[ . 1 . 2]" 1
809 1 61 LEU HB3 1 62 SER HA 4.990 . 5.445 4.559 4.286 4.728 . 0 0 "[ . 1 . 2]" 1
810 1 85 MET HA 1 86 ILE MD 5.190 . 5.646 4.815 4.460 5.709 0.063 5 0 "[ . 1 . 2]" 1
811 1 84 THR MG 1 85 MET HA 4.920 . 5.376 3.988 3.637 4.342 . 0 0 "[ . 1 . 2]" 1
812 1 5 ARG HA 1 5 ARG QD 4.310 . 4.766 3.900 2.096 4.261 . 0 0 "[ . 1 . 2]" 1
813 1 5 ARG HA 1 6 VAL QG 5.120 . 5.576 3.615 3.337 3.874 . 0 0 "[ . 1 . 2]" 1
814 1 85 MET HA 1 86 ILE HG13 5.500 . 5.956 5.825 5.201 6.055 0.099 20 0 "[ . 1 . 2]" 1
815 1 62 SER HA 1 62 SER HB3 2.920 . 3.375 2.429 2.388 2.459 . 0 0 "[ . 1 . 2]" 1
816 1 61 LEU HB2 1 62 SER HA 5.460 . 5.916 4.722 4.302 4.914 . 0 0 "[ . 1 . 2]" 1
817 1 56 LEU HB2 1 62 SER HA 5.200 . 5.655 5.533 4.783 5.731 0.075 8 0 "[ . 1 . 2]" 1
818 1 62 SER HA 1 64 GLU HG2 5.500 . 5.956 4.725 4.311 5.439 . 0 0 "[ . 1 . 2]" 1
819 1 62 SER HA 1 63 GLU HB2 4.620 . 5.076 4.485 4.249 4.899 . 0 0 "[ . 1 . 2]" 1
820 1 62 SER HA 1 63 GLU HA 4.600 . 5.056 4.278 4.236 4.354 . 0 0 "[ . 1 . 2]" 1
821 1 21 SER HA 1 22 ARG HB2 4.810 . 5.266 4.872 4.691 5.159 . 0 0 "[ . 1 . 2]" 1
822 1 11 GLN HB3 1 21 SER HA 4.210 . 4.710 2.821 2.370 3.347 . 0 0 "[ . 1 . 2]" 1
823 1 21 SER HA 1 49 LEU MD2 4.300 . 4.755 3.188 2.887 3.548 . 0 0 "[ . 1 . 2]" 1
824 1 21 SER HA 1 49 LEU MD1 3.930 . 4.385 2.799 2.465 3.139 . 0 0 "[ . 1 . 2]" 1
825 1 11 GLN HB2 1 21 SER HA 4.210 . 4.710 3.177 2.840 3.590 . 0 0 "[ . 1 . 2]" 1
826 1 20 LEU HG 1 21 SER HA 5.500 . 5.956 4.198 4.039 4.434 . 0 0 "[ . 1 . 2]" 1
827 1 75 ALA MB 1 76 HIS HA 4.230 . 4.686 4.091 3.932 4.222 . 0 0 "[ . 1 . 2]" 1
828 1 35 ALA HA 1 38 LYS HD2 4.100 . 4.556 2.987 2.562 3.418 . 0 0 "[ . 1 . 2]" 1
829 1 35 ALA HA 1 38 LYS HB2 3.720 . 4.175 2.647 2.317 2.970 . 0 0 "[ . 1 . 2]" 1
830 1 82 LYS HA 1 85 MET HB2 4.200 . 4.400 4.377 4.129 4.476 0.076 15 0 "[ . 1 . 2]" 1
831 1 35 ALA HA 1 38 LYS HD3 5.080 . 5.536 4.523 4.084 5.002 . 0 0 "[ . 1 . 2]" 1
832 1 35 ALA HA 1 38 LYS HB3 4.230 . 4.686 4.249 3.917 4.576 . 0 0 "[ . 1 . 2]" 1
833 1 56 LEU HA 1 57 ASP HA 4.910 . 5.110 4.721 4.583 4.822 . 0 0 "[ . 1 . 2]" 1
834 1 35 ALA HA 1 38 LYS HE3 4.670 . 5.126 4.540 4.094 4.987 . 0 0 "[ . 1 . 2]" 1
835 1 56 LEU HB2 1 57 ASP HA 5.000 . 5.456 4.170 3.974 4.293 . 0 0 "[ . 1 . 2]" 1
836 1 72 ALA HA 1 76 HIS HA 5.500 . 5.956 4.993 2.650 6.033 0.078 3 0 "[ . 1 . 2]" 1
837 1 56 LEU HB3 1 57 ASP HA 5.090 . 5.545 4.498 4.243 4.677 . 0 0 "[ . 1 . 2]" 1
838 1 35 ALA HA 1 38 LYS QG 5.100 . 5.556 3.383 3.169 3.681 . 0 0 "[ . 1 . 2]" 1
839 1 57 ASP HA 1 59 TYR H 5.090 . 5.545 4.461 3.958 4.748 . 0 0 "[ . 1 . 2]" 1
840 1 35 ALA HA 1 37 ARG H 5.200 . 5.655 4.432 4.163 4.591 . 0 0 "[ . 1 . 2]" 1
841 1 87 GLN HA 1 90 ARG H 4.370 . 4.826 3.395 3.025 3.796 . 0 0 "[ . 1 . 2]" 1
842 1 79 LYS HA 1 79 LYS HG2 3.910 . 4.365 3.022 2.485 3.736 . 0 0 "[ . 1 . 2]" 1
843 1 33 TRP HA 1 37 ARG HB2 4.320 . 4.775 3.477 3.102 3.932 . 0 0 "[ . 1 . 2]" 1
844 1 33 TRP HA 1 37 ARG HG3 4.640 . 5.095 5.073 4.836 5.155 0.060 16 0 "[ . 1 . 2]" 1
845 1 82 LYS HA 1 82 LYS QD 4.800 . 5.255 3.547 1.932 4.261 . 0 0 "[ . 1 . 2]" 1
846 1 30 THR MG 1 33 TRP HA 4.520 . 4.976 2.717 2.184 3.973 . 0 0 "[ . 1 . 2]" 1
847 1 33 TRP HA 1 33 TRP HZ3 5.260 . 5.715 5.038 4.747 5.386 . 0 0 "[ . 1 . 2]" 1
848 1 86 ILE MG 1 87 GLN HA 4.090 . 4.545 3.430 3.227 3.644 . 0 0 "[ . 1 . 2]" 1
849 1 79 LYS HA 1 79 LYS QD 4.410 . 4.865 3.425 1.786 4.522 0.014 19 0 "[ . 1 . 2]" 1
850 1 90 ARG HA 1 90 ARG QD 4.440 . 4.896 3.098 1.784 4.541 0.016 3 0 "[ . 1 . 2]" 1
851 1 88 LYS HA 1 89 TYR HD1 5.500 . 5.956 5.757 5.369 6.002 0.047 16 0 "[ . 1 . 2]" 1
852 1 90 ARG HA 1 90 ARG QG 3.370 . 3.826 2.759 2.283 3.347 . 0 0 "[ . 1 . 2]" 1
853 1 59 TYR HA 1 60 SER HB3 5.500 . 5.956 5.202 4.412 5.813 . 0 0 "[ . 1 . 2]" 1
854 1 28 LEU HA 1 59 TYR HA 4.870 . 5.326 3.861 3.359 4.394 . 0 0 "[ . 1 . 2]" 1
855 1 33 TRP HZ2 1 59 TYR HA 4.030 . 4.485 3.768 3.198 4.248 . 0 0 "[ . 1 . 2]" 1
856 1 59 TYR HA 1 59 TYR HD1 3.390 . 3.845 2.377 2.261 2.545 . 0 0 "[ . 1 . 2]" 1
857 1 87 GLN QG 1 88 LYS HA 4.340 . 4.795 3.626 3.188 4.180 . 0 0 "[ . 1 . 2]" 1
858 1 58 ARG HG3 1 59 TYR HA 5.500 . 5.956 3.753 3.516 4.065 . 0 0 "[ . 1 . 2]" 1
859 1 88 LYS HA 1 88 LYS HG3 4.080 . 4.380 3.341 2.488 3.838 . 0 0 "[ . 1 . 2]" 1
860 1 10 ARG HA 1 22 ARG QD 3.640 . 4.140 2.369 1.831 2.826 . 0 0 "[ . 1 . 2]" 1
861 1 68 LEU HA 1 68 LEU HG 3.490 . 3.945 3.112 3.022 3.194 . 0 0 "[ . 1 . 2]" 1
862 1 10 ARG HA 1 10 ARG QG 3.170 . 3.625 2.529 2.289 3.328 . 0 0 "[ . 1 . 2]" 1
863 1 49 LEU HA 1 49 LEU MD2 4.030 . 4.485 3.914 3.894 3.936 . 0 0 "[ . 1 . 2]" 1
864 1 49 LEU HA 1 49 LEU HG 3.790 . 4.246 3.059 2.986 3.135 . 0 0 "[ . 1 . 2]" 1
865 1 28 LEU HA 1 30 THR H 4.200 . 4.655 3.520 3.247 3.844 . 0 0 "[ . 1 . 2]" 1
866 1 10 ARG HA 1 11 GLN H 3.520 . 3.976 3.434 3.344 3.571 . 0 0 "[ . 1 . 2]" 1
867 1 28 LEU HA 1 59 TYR HD1 4.220 . 4.675 2.599 2.106 3.192 . 0 0 "[ . 1 . 2]" 1
868 1 56 LEU HA 1 59 TYR HD2 5.500 . 5.956 4.645 4.293 4.928 . 0 0 "[ . 1 . 2]" 1
869 1 56 LEU HA 1 56 LEU HG 3.940 . 4.396 3.157 3.090 3.241 . 0 0 "[ . 1 . 2]" 1
870 1 56 LEU HA 1 61 LEU HB2 3.500 . 4.250 1.867 1.766 2.091 0.034 7 0 "[ . 1 . 2]" 1
871 1 55 ALA MB 1 56 LEU HA 4.230 . 4.686 3.803 3.742 3.858 . 0 0 "[ . 1 . 2]" 1
872 1 56 LEU HA 1 61 LEU HG 3.670 . 4.420 3.491 3.025 3.798 . 0 0 "[ . 1 . 2]" 1
873 1 60 SER HA 1 61 LEU HG 4.960 . 5.416 4.702 4.387 5.079 . 0 0 "[ . 1 . 2]" 1
874 1 59 TYR HB2 1 60 SER HA 5.430 . 5.885 5.259 5.122 5.393 . 0 0 "[ . 1 . 2]" 1
875 1 60 SER HA 1 61 LEU MD2 5.340 . 5.795 5.036 4.699 5.491 . 0 0 "[ . 1 . 2]" 1
876 1 53 ARG HA 1 55 ALA H 5.090 . 5.545 4.408 4.071 4.645 . 0 0 "[ . 1 . 2]" 1
877 1 53 ARG HA 1 56 LEU MD2 4.830 . 5.830 4.590 4.034 4.983 . 0 0 "[ . 1 . 2]" 1
878 1 53 ARG HA 1 53 ARG HD2 3.980 . 4.436 3.335 1.932 4.421 . 0 0 "[ . 1 . 2]" 1
879 1 53 ARG HA 1 56 LEU HG 4.060 . 5.060 3.246 2.503 3.745 . 0 0 "[ . 1 . 2]" 1
880 1 89 TYR HA 1 92 LEU MD1 4.250 . 4.550 3.308 1.979 4.545 . 0 0 "[ . 1 . 2]" 1
881 1 88 LYS HB2 1 89 TYR HA 5.500 . 5.956 4.497 4.081 5.110 . 0 0 "[ . 1 . 2]" 1
882 1 88 LYS HB3 1 89 TYR HA 5.500 . 5.956 4.669 4.122 5.826 . 0 0 "[ . 1 . 2]" 1
883 1 53 ARG HA 1 53 ARG HG3 4.150 . 4.606 3.651 3.204 3.815 . 0 0 "[ . 1 . 2]" 1
884 1 53 ARG HA 1 56 LEU H 3.840 . 4.340 3.450 2.924 3.728 . 0 0 "[ . 1 . 2]" 1
885 1 65 GLU HA 1 65 GLU HG3 3.710 . 4.166 3.048 2.842 3.214 . 0 0 "[ . 1 . 2]" 1
886 1 65 GLU HA 1 67 ALA H 5.120 . 5.576 4.355 4.200 4.503 . 0 0 "[ . 1 . 2]" 1
887 1 37 ARG HA 1 40 ALA MB 3.150 . 3.605 2.744 2.506 2.880 . 0 0 "[ . 1 . 2]" 1
888 1 26 PRO HB3 1 37 ARG HA 4.160 . 4.615 3.417 3.319 3.513 . 0 0 "[ . 1 . 2]" 1
889 1 26 PRO HG3 1 37 ARG HA 4.520 . 4.976 3.208 2.921 3.383 . 0 0 "[ . 1 . 2]" 1
890 1 26 PRO HD3 1 37 ARG HA 5.110 . 5.565 3.732 3.321 4.121 . 0 0 "[ . 1 . 2]" 1
891 1 26 PRO HD2 1 37 ARG HA 5.420 . 5.876 5.149 4.741 5.481 . 0 0 "[ . 1 . 2]" 1
892 1 36 SER QB 1 37 ARG HA 5.500 . 5.956 3.944 3.761 4.158 . 0 0 "[ . 1 . 2]" 1
893 1 26 PRO HB2 1 37 ARG HA 4.340 . 4.795 4.826 4.758 4.887 0.092 5 0 "[ . 1 . 2]" 1
894 1 33 TRP HE3 1 37 ARG HA 4.950 . 5.405 4.618 4.416 4.921 . 0 0 "[ . 1 . 2]" 1
895 1 42 VAL MG2 1 69 TRP HA 4.720 . 5.175 4.861 4.678 5.047 . 0 0 "[ . 1 . 2]" 1
896 1 69 TRP HA 1 72 ALA MB 3.560 . 4.016 2.999 2.824 3.421 . 0 0 "[ . 1 . 2]" 1
897 1 57 ASP HB3 1 58 ARG HA 4.510 . 4.965 4.068 3.673 4.275 . 0 0 "[ . 1 . 2]" 1
898 1 38 LYS HB3 1 69 TRP HA 4.920 . 5.376 3.951 3.480 4.299 . 0 0 "[ . 1 . 2]" 1
899 1 69 TRP HA 1 73 VAL H 4.720 . 5.175 4.100 3.813 4.629 . 0 0 "[ . 1 . 2]" 1
900 1 57 ASP H 1 58 ARG HA 5.200 . 5.655 5.232 4.981 5.345 . 0 0 "[ . 1 . 2]" 1
901 1 57 ASP HB2 1 58 ARG HA 5.380 . 5.835 5.205 4.281 5.489 . 0 0 "[ . 1 . 2]" 1
902 1 58 ARG HA 1 58 ARG HD3 5.500 . 5.956 5.212 4.569 5.546 . 0 0 "[ . 1 . 2]" 1
903 1 58 ARG HA 1 58 ARG HD2 5.500 . 5.956 5.023 4.558 5.539 . 0 0 "[ . 1 . 2]" 1
904 1 58 ARG HA 1 58 ARG HG2 3.970 . 4.425 3.761 3.680 3.894 . 0 0 "[ . 1 . 2]" 1
905 1 38 LYS HD3 1 69 TRP HA 5.290 . 5.746 3.649 3.147 4.153 . 0 0 "[ . 1 . 2]" 1
906 1 50 ILE MD 1 54 GLU HA 4.790 . 5.246 5.013 4.802 5.279 0.034 5 0 "[ . 1 . 2]" 1
907 1 54 GLU HA 1 57 ASP HB3 4.110 . 4.565 3.274 2.244 4.582 0.016 14 0 "[ . 1 . 2]" 1
908 1 54 GLU HA 1 57 ASP HB2 3.650 . 4.106 3.390 2.784 4.116 0.010 13 0 "[ . 1 . 2]" 1
909 1 54 GLU HA 1 54 GLU HG3 3.840 . 4.295 2.933 2.540 3.251 . 0 0 "[ . 1 . 2]" 1
910 1 54 GLU HA 1 54 GLU HG2 3.840 . 4.295 3.535 2.839 3.969 . 0 0 "[ . 1 . 2]" 1
911 1 69 TRP HB3 1 70 ARG HA 4.750 . 5.206 4.197 4.044 4.306 . 0 0 "[ . 1 . 2]" 1
912 1 70 ARG HA 1 74 ALA MB 4.090 . 4.545 3.213 2.793 4.080 . 0 0 "[ . 1 . 2]" 1
913 1 46 ILE MD 1 70 ARG HA 4.280 . 4.780 3.588 3.259 3.865 . 0 0 "[ . 1 . 2]" 1
914 1 42 VAL MG2 1 70 ARG HA 2.890 . 3.890 1.882 1.752 2.269 0.048 18 0 "[ . 1 . 2]" 1
915 1 70 ARG HA 1 70 ARG QG 3.480 . 3.935 3.352 3.330 3.366 . 0 0 "[ . 1 . 2]" 1
916 1 70 ARG HA 1 73 VAL HB 3.870 . 4.326 3.047 2.819 3.250 . 0 0 "[ . 1 . 2]" 1
917 1 64 GLU HA 1 64 GLU HG2 3.850 . 4.306 3.699 3.615 3.758 . 0 0 "[ . 1 . 2]" 1
918 1 64 GLU HA 1 64 GLU HG3 3.760 . 4.260 3.863 3.739 4.251 . 0 0 "[ . 1 . 2]" 1
919 1 63 GLU H 1 64 GLU HA 5.370 . 5.826 5.312 5.213 5.427 . 0 0 "[ . 1 . 2]" 1
920 1 38 LYS HA 1 41 VAL HB 4.520 . 4.976 3.136 2.918 3.272 . 0 0 "[ . 1 . 2]" 1
921 1 38 LYS HA 1 41 VAL MG2 3.980 . 4.436 3.117 2.920 3.229 . 0 0 "[ . 1 . 2]" 1
922 1 33 TRP HB3 1 38 LYS HA 5.500 . 5.800 4.500 4.162 4.969 . 0 0 "[ . 1 . 2]" 1
923 1 64 GLU HA 1 68 LEU H 5.000 . 5.456 4.371 3.974 4.693 . 0 0 "[ . 1 . 2]" 1
924 1 38 LYS HA 1 38 LYS HD2 5.060 . 5.516 4.668 4.630 4.720 . 0 0 "[ . 1 . 2]" 1
925 1 38 LYS HA 1 42 VAL MG1 4.830 . 5.286 4.594 4.460 4.685 . 0 0 "[ . 1 . 2]" 1
926 1 38 LYS HA 1 38 LYS HD3 5.240 . 5.695 4.217 4.072 4.351 . 0 0 "[ . 1 . 2]" 1
927 1 12 VAL HA 1 13 THR HB 4.930 . 5.385 4.872 4.760 4.983 . 0 0 "[ . 1 . 2]" 1
928 1 22 ARG HA 1 49 LEU HG 4.650 . 5.106 3.640 3.347 4.130 . 0 0 "[ . 1 . 2]" 1
929 1 12 VAL HA 1 19 VAL MG1 5.420 . 5.876 4.716 4.419 5.070 . 0 0 "[ . 1 . 2]" 1
930 1 22 ARG HA 1 22 ARG HG3 4.030 . 4.485 3.002 2.798 3.367 . 0 0 "[ . 1 . 2]" 1
931 1 22 ARG HA 1 22 ARG QD 4.500 . 4.956 4.136 3.968 4.235 . 0 0 "[ . 1 . 2]" 1
932 1 22 ARG HA 1 25 LEU MD1 3.570 . 4.025 2.636 2.032 3.104 . 0 0 "[ . 1 . 2]" 1
933 1 22 ARG HA 1 22 ARG HG2 4.030 . 4.485 2.502 2.393 2.616 . 0 0 "[ . 1 . 2]" 1
934 1 22 ARG HA 1 23 ALA HA 5.250 . 5.706 4.615 4.556 4.680 . 0 0 "[ . 1 . 2]" 1
935 1 34 VAL HA 1 35 ALA MB 4.890 . 5.345 4.169 4.131 4.220 . 0 0 "[ . 1 . 2]" 1
936 1 34 VAL HA 1 34 VAL MG2 3.530 . 3.986 3.212 3.209 3.217 . 0 0 "[ . 1 . 2]" 1
937 1 43 LYS HA 1 46 ILE HG13 3.840 . 4.295 3.590 3.347 3.955 . 0 0 "[ . 1 . 2]" 1
938 1 11 GLN HA 1 22 ARG HA 5.500 . 5.700 5.445 5.195 5.704 0.004 4 0 "[ . 1 . 2]" 1
939 1 21 SER HA 1 22 ARG HA 5.500 . 5.700 4.315 4.284 4.347 . 0 0 "[ . 1 . 2]" 1
940 1 22 ARG HA 1 44 ALA MB 4.650 . 5.106 4.718 4.446 5.038 . 0 0 "[ . 1 . 2]" 1
941 1 11 GLN HA 1 12 VAL HA 4.770 . 5.226 4.408 4.365 4.448 . 0 0 "[ . 1 . 2]" 1
942 1 56 LEU MD1 1 63 GLU HA 3.830 . 4.286 2.921 2.155 3.408 . 0 0 "[ . 1 . 2]" 1
943 1 43 LYS HA 1 47 HIS HB2 5.500 . 5.956 5.140 4.947 5.433 . 0 0 "[ . 1 . 2]" 1
944 1 63 GLU HA 1 66 PHE HB3 3.910 . 4.365 3.131 2.714 3.700 . 0 0 "[ . 1 . 2]" 1
945 1 42 VAL MG1 1 43 LYS HA 4.170 . 4.626 3.283 3.237 3.346 . 0 0 "[ . 1 . 2]" 1
946 1 43 LYS HA 1 46 ILE HB 3.270 . 3.726 2.380 1.977 2.641 . 0 0 "[ . 1 . 2]" 1
947 1 63 GLU HA 1 66 PHE QD 5.000 . 5.456 4.772 4.355 5.286 . 0 0 "[ . 1 . 2]" 1
948 1 63 GLU HA 1 67 ALA MB 5.120 . 5.576 4.459 3.980 4.908 . 0 0 "[ . 1 . 2]" 1
949 1 52 GLU HG2 1 63 GLU HA 5.470 . 5.925 5.145 4.305 5.775 . 0 0 "[ . 1 . 2]" 1
950 1 63 GLU HA 1 67 ALA H 4.450 . 4.905 3.962 3.445 4.279 . 0 0 "[ . 1 . 2]" 1
951 1 43 LYS HA 1 43 LYS QG 3.540 . 3.996 2.404 2.360 2.473 . 0 0 "[ . 1 . 2]" 1
952 1 43 LYS HA 1 47 HIS HD2 3.960 . 4.416 3.899 3.571 4.362 . 0 0 "[ . 1 . 2]" 1
953 1 43 LYS HA 1 45 VAL H 5.200 . 5.655 4.410 4.228 4.608 . 0 0 "[ . 1 . 2]" 1
954 1 63 GLU HA 1 66 PHE HB2 4.350 . 4.806 3.878 3.354 4.359 . 0 0 "[ . 1 . 2]" 1
955 1 52 GLU HA 1 52 GLU HG3 3.500 . 3.955 2.488 2.284 2.719 . 0 0 "[ . 1 . 2]" 1
956 1 52 GLU HA 1 52 GLU HG2 3.260 . 3.716 2.962 2.748 3.104 . 0 0 "[ . 1 . 2]" 1
957 1 52 GLU HA 1 56 LEU HG 3.800 . 4.800 4.026 3.444 4.450 . 0 0 "[ . 1 . 2]" 1
958 1 52 GLU HA 1 66 PHE HZ 5.460 . 5.916 4.179 3.749 4.708 . 0 0 "[ . 1 . 2]" 1
959 1 52 GLU HA 1 55 ALA MB 3.410 . 3.865 2.936 2.750 3.216 . 0 0 "[ . 1 . 2]" 1
960 1 51 THR HA 1 54 GLU HB3 4.990 . 5.445 4.524 4.171 4.999 . 0 0 "[ . 1 . 2]" 1
961 1 51 THR HA 1 52 GLU HA 4.720 . 5.175 4.263 4.172 4.336 . 0 0 "[ . 1 . 2]" 1
962 1 51 THR HA 1 53 ARG H 4.870 . 5.326 4.352 4.125 4.642 . 0 0 "[ . 1 . 2]" 1
963 1 45 VAL MG2 1 51 THR HA 4.680 . 5.135 3.608 3.075 3.857 . 0 0 "[ . 1 . 2]" 1
964 1 71 SER HA 1 75 ALA MB 3.780 . 4.080 2.821 1.756 4.150 0.070 3 0 "[ . 1 . 2]" 1
965 1 65 GLU HB2 1 66 PHE HA 5.500 . 5.956 5.546 5.431 5.618 . 0 0 "[ . 1 . 2]" 1
966 1 66 PHE HA 1 66 PHE QE 5.060 . 5.516 4.573 4.525 4.621 . 0 0 "[ . 1 . 2]" 1
967 1 66 PHE HA 1 69 TRP HE3 5.320 . 5.775 4.218 3.981 4.498 . 0 0 "[ . 1 . 2]" 1
968 1 59 TYR HA 1 60 SER HB2 5.500 . 5.956 4.481 4.253 5.840 . 0 0 "[ . 1 . 2]" 1
969 1 61 LEU MD1 1 66 PHE HA 4.520 . 4.976 3.973 3.642 4.193 . 0 0 "[ . 1 . 2]" 1
970 1 66 PHE HA 1 69 TRP HB3 4.110 . 4.565 3.996 3.829 4.257 . 0 0 "[ . 1 . 2]" 1
971 1 42 VAL MG2 1 66 PHE HA 5.110 . 5.565 4.996 4.788 5.227 . 0 0 "[ . 1 . 2]" 1
972 1 36 SER HA 1 40 ALA H 5.220 . 5.675 4.300 4.010 4.564 . 0 0 "[ . 1 . 2]" 1
973 1 65 GLU HB3 1 66 PHE HA 5.050 . 5.505 4.194 3.943 4.345 . 0 0 "[ . 1 . 2]" 1
974 1 66 PHE HA 1 70 ARG QG 5.500 . 5.700 4.979 4.523 5.556 . 0 0 "[ . 1 . 2]" 1
975 1 66 PHE HA 1 67 ALA HA 5.320 . 5.775 4.833 4.790 4.866 . 0 0 "[ . 1 . 2]" 1
976 1 66 PHE HA 1 69 TRP HB2 3.760 . 4.215 2.469 2.341 2.779 . 0 0 "[ . 1 . 2]" 1
977 1 65 GLU HA 1 66 PHE HA 5.500 . 5.956 4.770 4.735 4.802 . 0 0 "[ . 1 . 2]" 1
978 1 65 GLU HG3 1 66 PHE HA 5.160 . 5.615 3.599 3.352 3.794 . 0 0 "[ . 1 . 2]" 1
979 1 66 PHE HA 1 69 TRP HD1 4.500 . 4.956 3.852 3.602 4.159 . 0 0 "[ . 1 . 2]" 1
980 1 65 GLU HG2 1 66 PHE HA 4.990 . 5.445 5.021 4.799 5.223 . 0 0 "[ . 1 . 2]" 1
981 1 66 PHE HA 1 69 TRP HA 5.500 . 5.956 4.982 4.786 5.175 . 0 0 "[ . 1 . 2]" 1
982 1 60 SER HB2 1 61 LEU H 4.750 . 5.206 4.422 4.057 4.639 . 0 0 "[ . 1 . 2]" 1
983 1 66 PHE HA 1 68 LEU HB2 5.500 . 5.956 4.940 4.827 5.090 . 0 0 "[ . 1 . 2]" 1
984 1 60 SER HB3 1 61 LEU H 4.750 . 5.206 4.390 4.181 4.579 . 0 0 "[ . 1 . 2]" 1
985 1 36 SER HA 1 38 LYS H 4.960 . 5.416 4.555 4.399 4.769 . 0 0 "[ . 1 . 2]" 1
986 1 19 VAL HA 1 19 VAL MG2 3.490 . 3.945 2.388 2.330 2.430 . 0 0 "[ . 1 . 2]" 1
987 1 19 VAL HA 1 19 VAL MG1 3.490 . 3.945 2.406 2.347 2.467 . 0 0 "[ . 1 . 2]" 1
988 1 13 THR HA 1 19 VAL HA 2.870 . 3.326 2.677 2.477 2.891 . 0 0 "[ . 1 . 2]" 1
989 1 36 SER QB 1 39 ALA H 5.290 . 5.746 4.978 4.749 5.190 . 0 0 "[ . 1 . 2]" 1
990 1 36 SER QB 1 39 ALA MB 4.730 . 5.186 4.191 3.762 4.613 . 0 0 "[ . 1 . 2]" 1
991 1 36 SER QB 1 37 ARG HG3 5.320 . 5.775 3.334 2.813 4.157 . 0 0 "[ . 1 . 2]" 1
992 1 13 THR HA 1 14 LEU MD2 3.940 . 4.396 3.016 2.892 3.178 . 0 0 "[ . 1 . 2]" 1
993 1 13 THR HA 1 13 THR MG 3.370 . 3.826 2.316 2.264 2.356 . 0 0 "[ . 1 . 2]" 1
994 1 6 VAL HA 1 6 VAL QG 3.040 . 3.496 2.170 2.122 2.341 . 0 0 "[ . 1 . 2]" 1
995 1 86 ILE HA 1 89 TYR HB3 4.510 . 4.956 4.392 3.876 4.869 . 0 0 "[ . 1 . 2]" 1
996 1 86 ILE HA 1 89 TYR HB2 4.450 . 4.905 2.787 2.323 3.251 . 0 0 "[ . 1 . 2]" 1
997 1 86 ILE HA 1 86 ILE HG12 3.670 . 4.126 3.402 2.909 3.572 . 0 0 "[ . 1 . 2]" 1
998 1 86 ILE HA 1 86 ILE HG13 3.940 . 4.396 2.316 2.126 2.553 . 0 0 "[ . 1 . 2]" 1
999 1 86 ILE HA 1 89 TYR HD2 4.960 . 5.416 2.021 1.773 2.437 0.027 15 0 "[ . 1 . 2]" 1
1000 1 86 ILE HA 1 89 TYR H 4.200 . 4.655 3.236 2.888 3.484 . 0 0 "[ . 1 . 2]" 1
1001 1 83 VAL HA 1 84 THR HA 4.760 . 5.215 4.740 4.535 4.862 . 0 0 "[ . 1 . 2]" 1
1002 1 84 THR HA 1 87 GLN H 4.160 . 4.615 3.925 3.500 4.469 . 0 0 "[ . 1 . 2]" 1
1003 1 83 VAL MG2 1 84 THR HA 4.320 . 4.775 3.705 3.479 4.077 . 0 0 "[ . 1 . 2]" 1
1004 1 27 PRO HA 1 29 ASP H 4.700 . 5.155 3.864 3.693 4.029 . 0 0 "[ . 1 . 2]" 1
1005 1 9 PRO HA 1 49 LEU MD1 5.120 . 5.576 4.501 4.121 4.926 . 0 0 "[ . 1 . 2]" 1
1006 1 9 PRO HA 1 10 ARG QG 4.900 . 5.356 4.108 3.530 5.459 0.103 6 0 "[ . 1 . 2]" 1
1007 1 27 PRO HA 1 28 LEU HG 4.060 . 4.516 3.728 3.576 3.929 . 0 0 "[ . 1 . 2]" 1
1008 1 71 SER HB2 1 75 ALA MB 5.500 . 5.956 4.769 3.851 5.508 . 0 0 "[ . 1 . 2]" 1
1009 1 71 SER HB3 1 75 ALA MB 5.500 . 5.956 4.075 2.963 5.341 . 0 0 "[ . 1 . 2]" 1
1010 1 83 VAL HA 1 86 ILE HG13 5.080 . 5.536 4.612 3.936 5.038 . 0 0 "[ . 1 . 2]" 1
1011 1 83 VAL HA 1 86 ILE HG12 4.760 . 5.215 4.454 4.130 4.830 . 0 0 "[ . 1 . 2]" 1
1012 1 83 VAL HA 1 86 ILE HB 4.740 . 4.956 3.877 2.664 4.950 . 0 0 "[ . 1 . 2]" 1
1013 1 18 THR HA 1 19 VAL H 2.820 . 3.020 2.450 2.389 2.483 . 0 0 "[ . 1 . 2]" 1
1014 1 18 THR HA 1 19 VAL HA 4.670 . 5.126 4.450 4.388 4.481 . 0 0 "[ . 1 . 2]" 1
1015 1 18 THR HA 1 19 VAL MG1 5.500 . 5.956 5.536 5.469 5.585 . 0 0 "[ . 1 . 2]" 1
1016 1 18 THR HA 1 19 VAL MG2 4.050 . 4.505 3.475 3.298 3.716 . 0 0 "[ . 1 . 2]" 1
1017 1 45 VAL HA 1 66 PHE HZ 5.160 . 5.615 4.939 4.637 5.137 . 0 0 "[ . 1 . 2]" 1
1018 1 39 ALA MB 1 73 VAL HA 5.320 . 5.775 4.753 4.141 5.292 . 0 0 "[ . 1 . 2]" 1
1019 1 73 VAL HA 1 74 ALA MB 5.500 . 5.956 5.028 4.980 5.071 . 0 0 "[ . 1 . 2]" 1
1020 1 73 VAL HA 1 73 VAL MG1 2.960 . 3.415 2.405 2.383 2.437 . 0 0 "[ . 1 . 2]" 1
1021 1 73 VAL HA 1 73 VAL MG2 2.990 . 3.445 2.376 2.347 2.411 . 0 0 "[ . 1 . 2]" 1
1022 1 73 VAL HA 1 76 HIS HB3 4.780 . 5.235 3.495 2.689 5.016 . 0 0 "[ . 1 . 2]" 1
1023 1 45 VAL HA 1 50 ILE QG 4.550 . 5.005 2.692 2.579 2.847 . 0 0 "[ . 1 . 2]" 1
1024 1 45 VAL HA 1 45 VAL MG1 3.300 . 3.756 2.393 2.349 2.461 . 0 0 "[ . 1 . 2]" 1
1025 1 45 VAL HA 1 50 ILE MD 4.090 . 4.545 4.146 3.991 4.308 . 0 0 "[ . 1 . 2]" 1
1026 1 44 ALA MB 1 45 VAL HA 4.760 . 5.215 3.831 3.787 3.875 . 0 0 "[ . 1 . 2]" 1
1027 1 45 VAL H 1 46 ILE HA 5.030 . 5.485 5.212 5.146 5.267 . 0 0 "[ . 1 . 2]" 1
1028 1 15 PRO HA 1 17 GLY H 4.510 . 4.965 3.577 3.209 4.056 . 0 0 "[ . 1 . 2]" 1
1029 1 46 ILE HA 1 48 GLY H 4.930 . 5.385 3.995 3.804 4.318 . 0 0 "[ . 1 . 2]" 1
1030 1 46 ILE HA 1 46 ILE HG13 3.630 . 4.085 2.899 2.606 3.020 . 0 0 "[ . 1 . 2]" 1
1031 1 46 ILE HA 1 46 ILE HG12 3.440 . 3.895 2.449 2.345 2.522 . 0 0 "[ . 1 . 2]" 1
1032 1 46 ILE HA 1 46 ILE MD 3.890 . 4.345 3.792 3.714 3.828 . 0 0 "[ . 1 . 2]" 1
1033 1 14 LEU HB3 1 15 PRO HA 5.190 . 5.646 4.786 4.679 4.859 . 0 0 "[ . 1 . 2]" 1
1034 1 62 SER HB3 1 63 GLU HB2 4.320 . 4.775 4.630 4.102 4.830 0.054 7 0 "[ . 1 . 2]" 1
1035 1 62 SER HB2 1 63 GLU HB2 5.370 . 5.826 5.642 4.975 5.840 0.014 5 0 "[ . 1 . 2]" 1
1036 1 62 SER HB3 1 64 GLU HG2 5.020 . 5.476 2.740 2.319 3.888 . 0 0 "[ . 1 . 2]" 1
1037 1 62 SER HB2 1 63 GLU HA 5.220 . 5.675 5.183 5.091 5.262 . 0 0 "[ . 1 . 2]" 1
1038 1 62 SER HB3 1 63 GLU HA 5.160 . 5.615 4.951 4.882 5.041 . 0 0 "[ . 1 . 2]" 1
1039 1 30 THR HA 1 30 THR MG 3.510 . 3.966 2.531 2.366 3.221 . 0 0 "[ . 1 . 2]" 1
1040 1 27 PRO HG2 1 30 THR HA 5.220 . 5.520 4.260 3.437 5.377 . 0 0 "[ . 1 . 2]" 1
1041 1 29 ASP HA 1 30 THR HA 5.130 . 5.585 4.704 4.608 4.799 . 0 0 "[ . 1 . 2]" 1
1042 1 30 THR HA 1 31 ARG HA 5.430 . 5.885 4.411 4.331 5.354 . 0 0 "[ . 1 . 2]" 1
1043 1 21 SER H 1 21 SER HB3 4.010 . 4.465 2.936 2.688 3.700 . 0 0 "[ . 1 . 2]" 1
1044 1 21 SER HB2 1 22 ARG H 4.080 . 4.536 2.524 2.261 3.546 . 0 0 "[ . 1 . 2]" 1
1045 1 21 SER H 1 21 SER HB2 4.010 . 4.465 3.520 2.628 3.697 . 0 0 "[ . 1 . 2]" 1
1046 1 21 SER HB3 1 49 LEU MD1 5.130 . 5.585 4.767 4.287 5.155 . 0 0 "[ . 1 . 2]" 1
1047 1 21 SER HB2 1 49 LEU MD1 5.130 . 5.585 4.480 3.952 5.114 . 0 0 "[ . 1 . 2]" 1
1048 1 41 VAL HA 1 43 LYS H 5.380 . 5.835 4.597 4.512 4.682 . 0 0 "[ . 1 . 2]" 1
1049 1 26 PRO HG3 1 41 VAL HA 5.280 . 5.735 4.921 4.632 5.200 . 0 0 "[ . 1 . 2]" 1
1050 1 41 VAL HA 1 59 TYR HE2 5.420 . 5.876 4.045 3.663 4.590 . 0 0 "[ . 1 . 2]" 1
1051 1 41 VAL HA 1 44 ALA MB 3.470 . 3.925 2.785 2.536 2.926 . 0 0 "[ . 1 . 2]" 1
1052 1 41 VAL HA 1 50 ILE MD 4.410 . 4.865 3.471 3.256 3.704 . 0 0 "[ . 1 . 2]" 1
1053 1 25 LEU MD2 1 41 VAL HA 3.520 . 3.976 2.446 2.274 2.592 . 0 0 "[ . 1 . 2]" 1
1054 1 41 VAL HB 1 42 VAL HA 5.220 . 5.675 4.181 4.125 4.246 . 0 0 "[ . 1 . 2]" 1
1055 1 42 VAL HA 1 45 VAL HB 3.950 . 4.405 3.211 2.920 3.478 . 0 0 "[ . 1 . 2]" 1
1056 1 42 VAL HA 1 46 ILE H 5.010 . 5.465 4.156 4.056 4.341 . 0 0 "[ . 1 . 2]" 1
1057 1 42 VAL HA 1 42 VAL MG2 2.880 . 3.336 2.328 2.299 2.356 . 0 0 "[ . 1 . 2]" 1
1058 1 42 VAL HA 1 44 ALA MB 5.430 . 5.885 4.538 4.449 4.624 . 0 0 "[ . 1 . 2]" 1
1059 1 42 VAL HA 1 46 ILE HB 5.500 . 5.956 5.533 4.883 5.759 . 0 0 "[ . 1 . 2]" 1
1060 1 42 VAL HA 1 46 ILE MD 4.730 . 5.186 4.376 4.235 4.563 . 0 0 "[ . 1 . 2]" 1
1061 1 41 VAL MG2 1 42 VAL HA 5.500 . 5.956 5.311 5.282 5.342 . 0 0 "[ . 1 . 2]" 1
1062 1 12 VAL HB 1 13 THR HB 4.790 . 5.246 4.840 4.636 5.021 . 0 0 "[ . 1 . 2]" 1
1063 1 83 VAL MG2 1 84 THR HB 5.220 . 5.675 5.522 5.235 5.702 0.027 13 0 "[ . 1 . 2]" 1
1064 1 84 THR HB 1 85 MET HB2 5.160 . 5.615 4.720 4.121 5.350 . 0 0 "[ . 1 . 2]" 1
1065 1 18 THR HB 1 19 VAL HA 4.310 . 4.766 4.459 4.174 4.763 . 0 0 "[ . 1 . 2]" 1
1066 1 18 THR HB 1 19 VAL MG2 4.900 . 5.356 5.019 4.685 5.259 . 0 0 "[ . 1 . 2]" 1
1067 1 14 LEU HG 1 18 THR HB 4.430 . 4.885 2.721 2.258 3.304 . 0 0 "[ . 1 . 2]" 1
1068 1 14 LEU HB3 1 18 THR HB 4.950 . 5.405 3.742 3.256 4.389 . 0 0 "[ . 1 . 2]" 1
1069 1 14 LEU MD1 1 18 THR HB 4.100 . 4.556 4.148 3.867 4.507 . 0 0 "[ . 1 . 2]" 1
1070 1 14 LEU HB2 1 18 THR HB 4.050 . 4.505 2.523 2.199 3.132 . 0 0 "[ . 1 . 2]" 1
1071 1 30 THR HB 1 33 TRP HH2 5.480 . 5.936 4.396 3.730 5.974 0.038 1 0 "[ . 1 . 2]" 1
1072 1 26 PRO HB2 1 30 THR HB 5.450 . 5.905 3.453 2.988 4.631 . 0 0 "[ . 1 . 2]" 1
1073 1 51 THR HB 1 54 GLU HB3 4.990 . 5.445 4.724 4.447 5.116 . 0 0 "[ . 1 . 2]" 1
1074 1 48 GLY H 1 49 LEU HB3 4.650 . 5.106 4.514 4.203 4.669 . 0 0 "[ . 1 . 2]" 1
1075 1 48 GLY H 1 49 LEU HB2 4.530 . 4.985 4.710 4.516 4.849 . 0 0 "[ . 1 . 2]" 1
1076 1 47 HIS HB2 1 48 GLY H 4.280 . 4.735 3.422 3.064 3.671 . 0 0 "[ . 1 . 2]" 1
1077 1 44 ALA MB 1 48 GLY H 4.920 . 5.376 5.095 4.783 5.307 . 0 0 "[ . 1 . 2]" 1
1078 1 48 GLY H 1 50 ILE H 4.220 . 4.675 4.006 3.808 4.265 . 0 0 "[ . 1 . 2]" 1
1079 1 48 GLY H 1 48 GLY HA2 2.940 . 3.395 2.344 2.315 2.423 . 0 0 "[ . 1 . 2]" 1
1080 1 45 VAL HA 1 48 GLY H 4.060 . 4.516 3.476 3.294 3.687 . 0 0 "[ . 1 . 2]" 1
1081 1 47 HIS H 1 48 GLY H 3.210 . 3.665 2.392 2.245 2.588 . 0 0 "[ . 1 . 2]" 1
1082 1 48 GLY H 1 49 LEU H 3.230 . 3.685 2.350 2.169 2.467 . 0 0 "[ . 1 . 2]" 1
1083 1 46 ILE H 1 48 GLY H 4.430 . 4.885 3.949 3.810 4.057 . 0 0 "[ . 1 . 2]" 1
1084 1 47 HIS HB3 1 48 GLY H 4.430 . 4.885 4.122 3.909 4.277 . 0 0 "[ . 1 . 2]" 1
1085 1 46 ILE MG 1 48 GLY H 5.050 . 5.505 4.730 4.460 4.923 . 0 0 "[ . 1 . 2]" 1
1086 1 12 VAL MG2 1 48 GLY H 4.490 . 4.945 4.629 4.254 4.812 . 0 0 "[ . 1 . 2]" 1
1087 1 12 VAL MG1 1 48 GLY H 4.420 . 4.876 4.177 3.810 4.404 . 0 0 "[ . 1 . 2]" 1
1088 1 45 VAL HA 1 50 ILE H 3.840 . 4.295 2.924 2.792 3.085 . 0 0 "[ . 1 . 2]" 1
1089 1 49 LEU HB3 1 50 ILE H 3.460 . 3.915 2.323 2.131 2.502 . 0 0 "[ . 1 . 2]" 1
1090 1 44 ALA MB 1 50 ILE H 4.000 . 4.456 3.021 2.813 3.226 . 0 0 "[ . 1 . 2]" 1
1091 1 50 ILE H 1 50 ILE MG 3.120 . 3.576 2.871 2.723 3.018 . 0 0 "[ . 1 . 2]" 1
1092 1 50 ILE H 1 50 ILE QG 3.570 . 4.025 2.355 2.283 2.425 . 0 0 "[ . 1 . 2]" 1
1093 1 45 VAL MG2 1 50 ILE H 4.100 . 4.556 3.972 3.769 4.080 . 0 0 "[ . 1 . 2]" 1
1094 1 49 LEU HG 1 50 ILE H 4.370 . 4.826 3.604 3.243 3.785 . 0 0 "[ . 1 . 2]" 1
1095 1 48 GLY HA2 1 50 ILE H 4.780 . 5.235 4.041 3.829 4.540 . 0 0 "[ . 1 . 2]" 1
1096 1 44 ALA HA 1 50 ILE H 4.510 . 4.965 4.026 3.878 4.174 . 0 0 "[ . 1 . 2]" 1
1097 1 14 LEU MD1 1 17 GLY H 5.380 . 5.835 5.260 5.089 5.390 . 0 0 "[ . 1 . 2]" 1
1098 1 14 LEU HB2 1 17 GLY H 4.020 . 4.476 3.058 2.773 3.311 . 0 0 "[ . 1 . 2]" 1
1099 1 16 ASP HB3 1 17 GLY H 4.330 . 4.786 3.961 2.734 4.491 . 0 0 "[ . 1 . 2]" 1
1100 1 17 GLY H 1 18 THR HA 5.450 . 5.905 4.995 4.701 5.233 . 0 0 "[ . 1 . 2]" 1
1101 1 17 GLY H 1 18 THR HB 5.500 . 5.956 4.834 4.429 5.302 . 0 0 "[ . 1 . 2]" 1
1102 1 17 GLY H 1 17 GLY HA2 2.850 . 3.306 2.367 2.309 2.488 . 0 0 "[ . 1 . 2]" 1
1103 1 16 ASP HB2 1 17 GLY H 4.330 . 4.786 3.552 3.017 4.240 . 0 0 "[ . 1 . 2]" 1
1104 1 17 GLY H 1 17 GLY HA3 2.950 . 3.405 2.922 2.871 2.956 . 0 0 "[ . 1 . 2]" 1
1105 1 16 ASP H 1 17 GLY H 2.950 . 3.405 2.425 2.231 2.525 . 0 0 "[ . 1 . 2]" 1
1106 1 13 THR MG 1 17 GLY H 3.700 . 4.155 3.728 3.002 3.939 . 0 0 "[ . 1 . 2]" 1
1107 1 16 ASP HA 1 17 GLY H 3.530 . 3.986 3.371 3.246 3.494 . 0 0 "[ . 1 . 2]" 1
1108 1 14 LEU H 1 17 GLY H 4.460 . 4.916 4.000 3.793 4.393 . 0 0 "[ . 1 . 2]" 1
1109 1 14 LEU HB3 1 17 GLY H 4.380 . 4.835 3.552 3.290 3.813 . 0 0 "[ . 1 . 2]" 1
1110 1 14 LEU MD2 1 17 GLY H 5.290 . 5.490 4.718 4.536 4.952 . 0 0 "[ . 1 . 2]" 1
1111 1 14 LEU HA 1 17 GLY H 4.980 . 5.436 4.564 4.411 4.690 . 0 0 "[ . 1 . 2]" 1
1112 1 8 GLY H 1 9 PRO HD3 4.960 . 5.416 4.503 4.030 5.031 . 0 0 "[ . 1 . 2]" 1
1113 1 76 HIS HB3 1 77 GLY H 4.720 . 5.175 3.883 2.680 4.460 . 0 0 "[ . 1 . 2]" 1
1114 1 76 HIS HB2 1 77 GLY H 4.720 . 5.175 4.289 3.886 4.619 . 0 0 "[ . 1 . 2]" 1
1115 1 75 ALA MB 1 77 GLY H 5.380 . 5.835 4.591 2.654 5.373 . 0 0 "[ . 1 . 2]" 1
1116 1 77 GLY H 1 78 GLU H 4.340 . 4.795 3.008 1.961 4.098 . 0 0 "[ . 1 . 2]" 1
1117 1 59 TYR H 1 61 LEU HG 4.420 . 4.876 3.918 3.544 4.208 . 0 0 "[ . 1 . 2]" 1
1118 1 51 THR H 1 51 THR HG1 4.640 . 5.095 4.620 4.460 4.725 . 0 0 "[ . 1 . 2]" 1
1119 1 50 ILE H 1 51 THR H 4.650 . 5.106 4.414 4.363 4.457 . 0 0 "[ . 1 . 2]" 1
1120 1 59 TYR H 1 59 TYR HB2 3.400 . 3.855 2.512 2.424 2.609 . 0 0 "[ . 1 . 2]" 1
1121 1 59 TYR H 1 61 LEU MD1 4.850 . 5.306 4.218 4.020 4.418 . 0 0 "[ . 1 . 2]" 1
1122 1 50 ILE MD 1 51 THR H 3.560 . 4.016 3.836 3.435 4.040 0.024 18 0 "[ . 1 . 2]" 1
1123 1 50 ILE HA 1 51 THR H 3.260 . 3.716 2.494 2.342 2.660 . 0 0 "[ . 1 . 2]" 1
1124 1 51 THR H 1 51 THR HB 3.680 . 4.135 2.984 2.813 3.142 . 0 0 "[ . 1 . 2]" 1
1125 1 58 ARG HB3 1 59 TYR H 4.010 . 4.465 4.107 3.994 4.241 . 0 0 "[ . 1 . 2]" 1
1126 1 50 ILE HB 1 51 THR H 3.160 . 3.615 2.311 2.023 2.475 . 0 0 "[ . 1 . 2]" 1
1127 1 56 LEU HA 1 59 TYR H 4.050 . 4.505 4.064 3.752 4.257 . 0 0 "[ . 1 . 2]" 1
1128 1 59 TYR H 1 60 SER HA 4.250 . 4.706 4.432 4.190 4.611 . 0 0 "[ . 1 . 2]" 1
1129 1 51 THR H 1 54 GLU HB2 3.560 . 4.016 3.021 2.694 3.371 . 0 0 "[ . 1 . 2]" 1
1130 1 51 THR H 1 54 GLU HA 5.500 . 5.956 5.180 4.800 5.465 . 0 0 "[ . 1 . 2]" 1
1131 1 58 ARG HG3 1 59 TYR H 4.280 . 4.735 2.651 2.302 2.984 . 0 0 "[ . 1 . 2]" 1
1132 1 59 TYR H 1 61 LEU MD2 5.090 . 5.545 5.226 4.724 5.536 . 0 0 "[ . 1 . 2]" 1
1133 1 45 VAL MG2 1 51 THR H 4.750 . 5.206 4.235 3.816 4.427 . 0 0 "[ . 1 . 2]" 1
1134 1 58 ARG HG2 1 59 TYR H 4.360 . 4.815 2.842 2.475 3.316 . 0 0 "[ . 1 . 2]" 1
1135 1 55 ALA HA 1 59 TYR H 4.460 . 4.916 3.954 3.631 4.471 . 0 0 "[ . 1 . 2]" 1
1136 1 59 TYR H 1 59 TYR HD2 3.740 . 4.195 3.333 3.056 3.584 . 0 0 "[ . 1 . 2]" 1
1137 1 50 ILE QG 1 51 THR H 4.680 . 5.135 3.289 3.026 3.536 . 0 0 "[ . 1 . 2]" 1
1138 1 11 GLN HE22 1 19 VAL MG1 3.740 . 4.195 3.465 2.633 4.064 . 0 0 "[ . 1 . 2]" 1
1139 1 11 GLN HE22 1 11 GLN HG2 3.820 . 4.275 3.788 3.505 4.056 . 0 0 "[ . 1 . 2]" 1
1140 1 11 GLN HE21 1 19 VAL MG1 3.710 . 4.166 3.638 2.499 4.223 0.058 4 0 "[ . 1 . 2]" 1
1141 1 11 GLN HE22 1 19 VAL MG2 4.440 . 4.896 4.422 3.729 4.922 0.026 6 0 "[ . 1 . 2]" 1
1142 1 14 LEU HG 1 16 ASP H 4.780 . 5.235 4.377 4.171 4.659 . 0 0 "[ . 1 . 2]" 1
1143 1 15 PRO HG2 1 16 ASP H 4.550 . 5.005 3.618 2.776 4.389 . 0 0 "[ . 1 . 2]" 1
1144 1 14 LEU H 1 16 ASP H 4.900 . 5.356 4.655 4.364 4.943 . 0 0 "[ . 1 . 2]" 1
1145 1 14 LEU HA 1 16 ASP H 4.490 . 4.945 3.713 3.445 4.020 . 0 0 "[ . 1 . 2]" 1
1146 1 16 ASP H 1 16 ASP HB3 3.670 . 4.126 3.268 2.284 3.646 . 0 0 "[ . 1 . 2]" 1
1147 1 14 LEU HB2 1 16 ASP H 3.650 . 4.106 2.986 2.738 3.214 . 0 0 "[ . 1 . 2]" 1
1148 1 14 LEU MD1 1 16 ASP H 4.540 . 4.996 4.087 3.895 4.497 . 0 0 "[ . 1 . 2]" 1
1149 1 14 LEU HB3 1 16 ASP H 3.520 . 3.976 2.131 1.951 2.487 . 0 0 "[ . 1 . 2]" 1
1150 1 16 ASP H 1 16 ASP HB2 3.670 . 4.126 2.663 2.508 3.625 . 0 0 "[ . 1 . 2]" 1
1151 1 15 PRO HG3 1 16 ASP H 4.620 . 5.076 4.408 4.134 4.645 . 0 0 "[ . 1 . 2]" 1
1152 1 15 PRO HD3 1 16 ASP H 3.980 . 4.436 3.727 3.533 3.967 . 0 0 "[ . 1 . 2]" 1
1153 1 15 PRO HB2 1 16 ASP H 3.960 . 4.416 3.429 2.947 3.863 . 0 0 "[ . 1 . 2]" 1
1154 1 14 LEU MD2 1 16 ASP H 5.100 . 5.556 4.690 4.505 4.933 . 0 0 "[ . 1 . 2]" 1
1155 1 13 THR MG 1 16 ASP H 4.820 . 5.275 5.009 4.605 5.223 . 0 0 "[ . 1 . 2]" 1
1156 1 16 ASP H 1 17 GLY HA2 4.740 . 5.195 4.778 4.609 4.905 . 0 0 "[ . 1 . 2]" 1
1157 1 15 PRO HD2 1 16 ASP H 3.870 . 4.326 2.595 2.335 2.927 . 0 0 "[ . 1 . 2]" 1
1158 1 45 VAL HA 1 47 HIS H 5.000 . 5.456 4.314 4.031 4.607 . 0 0 "[ . 1 . 2]" 1
1159 1 47 HIS H 1 49 LEU H 4.290 . 4.746 3.616 3.411 3.785 . 0 0 "[ . 1 . 2]" 1
1160 1 46 ILE MG 1 47 HIS H 3.680 . 4.135 3.437 2.932 3.736 . 0 0 "[ . 1 . 2]" 1
1161 1 46 ILE HB 1 47 HIS H 3.320 . 3.776 2.883 2.602 3.096 . 0 0 "[ . 1 . 2]" 1
1162 1 47 HIS H 1 47 HIS HB3 3.750 . 4.206 3.646 3.612 3.688 . 0 0 "[ . 1 . 2]" 1
1163 1 46 ILE H 1 47 HIS H 3.400 . 3.855 2.707 2.588 2.836 . 0 0 "[ . 1 . 2]" 1
1164 1 47 HIS H 1 47 HIS HB2 3.230 . 3.685 2.433 2.388 2.497 . 0 0 "[ . 1 . 2]" 1
1165 1 12 VAL MG1 1 47 HIS H 4.780 . 5.235 4.690 4.407 5.062 . 0 0 "[ . 1 . 2]" 1
1166 1 45 VAL MG2 1 47 HIS H 5.500 . 5.956 5.351 5.177 5.506 . 0 0 "[ . 1 . 2]" 1
1167 1 43 LYS HA 1 47 HIS H 3.870 . 4.326 3.938 3.730 4.210 . 0 0 "[ . 1 . 2]" 1
1168 1 45 VAL HB 1 47 HIS H 5.390 . 5.845 5.016 4.881 5.256 . 0 0 "[ . 1 . 2]" 1
1169 1 70 ARG HB2 1 71 SER H 3.850 . 4.306 4.005 3.785 4.168 . 0 0 "[ . 1 . 2]" 1
1170 1 70 ARG QD 1 71 SER H 4.370 . 4.826 4.401 4.081 4.699 . 0 0 "[ . 1 . 2]" 1
1171 1 42 VAL MG2 1 71 SER H 4.550 . 5.005 4.727 4.610 4.974 . 0 0 "[ . 1 . 2]" 1
1172 1 70 ARG HB3 1 71 SER H 4.150 . 4.606 4.113 3.923 4.221 . 0 0 "[ . 1 . 2]" 1
1173 1 70 ARG QG 1 71 SER H 3.730 . 4.186 2.456 2.209 2.654 . 0 0 "[ . 1 . 2]" 1
1174 1 58 ARG HB3 1 60 SER H 5.500 . 5.956 5.577 5.464 5.714 . 0 0 "[ . 1 . 2]" 1
1175 1 70 ARG H 1 71 SER H 3.060 . 3.516 2.593 2.500 2.688 . 0 0 "[ . 1 . 2]" 1
1176 1 60 SER H 1 61 LEU MD2 4.850 . 5.306 4.949 4.544 5.254 . 0 0 "[ . 1 . 2]" 1
1177 1 57 ASP HA 1 60 SER H 3.920 . 4.376 3.733 3.165 4.104 . 0 0 "[ . 1 . 2]" 1
1178 1 68 LEU HB3 1 71 SER H 5.500 . 5.956 5.217 4.982 5.492 . 0 0 "[ . 1 . 2]" 1
1179 1 71 SER H 1 73 VAL HB 5.500 . 5.956 5.572 5.347 5.842 . 0 0 "[ . 1 . 2]" 1
1180 1 56 LEU HA 1 60 SER H 4.170 . 4.370 4.397 4.369 4.435 0.065 9 0 "[ . 1 . 2]" 1
1181 1 59 TYR HB2 1 60 SER H 3.990 . 4.445 3.607 3.498 3.713 . 0 0 "[ . 1 . 2]" 1
1182 1 58 ARG HA 1 60 SER H 4.200 . 4.655 3.973 3.855 4.060 . 0 0 "[ . 1 . 2]" 1
1183 1 60 SER H 1 60 SER HA 2.570 . 3.026 2.267 2.259 2.276 . 0 0 "[ . 1 . 2]" 1
1184 1 56 LEU HB3 1 60 SER H 5.500 . 5.956 5.677 5.405 5.832 . 0 0 "[ . 1 . 2]" 1
1185 1 59 TYR H 1 60 SER H 2.960 . 3.415 2.280 2.063 2.444 . 0 0 "[ . 1 . 2]" 1
1186 1 60 SER H 1 61 LEU H 3.100 . 3.556 2.839 2.583 3.100 . 0 0 "[ . 1 . 2]" 1
1187 1 60 SER H 1 61 LEU MD1 5.430 . 5.885 4.972 4.741 5.115 . 0 0 "[ . 1 . 2]" 1
1188 1 30 THR MG 1 34 VAL H 5.500 . 5.956 3.782 3.178 5.143 . 0 0 "[ . 1 . 2]" 1
1189 1 60 SER H 1 61 LEU HG 4.170 . 4.626 3.951 3.705 4.219 . 0 0 "[ . 1 . 2]" 1
1190 1 58 ARG H 1 60 SER H 4.200 . 4.655 3.896 3.673 4.068 . 0 0 "[ . 1 . 2]" 1
1191 1 11 GLN H 1 49 LEU MD1 3.790 . 4.246 3.213 3.067 3.466 . 0 0 "[ . 1 . 2]" 1
1192 1 60 SER H 1 61 LEU HA 5.370 . 5.826 5.263 5.165 5.352 . 0 0 "[ . 1 . 2]" 1
1193 1 68 LEU HA 1 71 SER H 3.350 . 3.806 3.436 3.133 3.648 . 0 0 "[ . 1 . 2]" 1
1194 1 68 LEU H 1 71 SER H 4.820 . 5.275 4.701 4.467 4.834 . 0 0 "[ . 1 . 2]" 1
1195 1 69 TRP HB2 1 71 SER H 4.960 . 5.416 4.733 4.557 4.820 . 0 0 "[ . 1 . 2]" 1
1196 1 69 TRP HA 1 71 SER H 4.640 . 5.095 4.291 4.106 4.462 . 0 0 "[ . 1 . 2]" 1
1197 1 71 SER H 1 73 VAL H 4.350 . 4.806 4.048 3.815 4.402 . 0 0 "[ . 1 . 2]" 1
1198 1 11 GLN H 1 22 ARG QD 4.820 . 5.275 5.180 4.652 5.340 0.064 8 0 "[ . 1 . 2]" 1
1199 1 9 PRO HB2 1 11 GLN H 3.560 . 4.016 3.083 2.294 4.068 0.052 7 0 "[ . 1 . 2]" 1
1200 1 11 GLN H 1 11 GLN HG3 3.960 . 4.416 3.239 2.871 3.566 . 0 0 "[ . 1 . 2]" 1
1201 1 10 ARG QG 1 11 GLN H 4.490 . 4.945 4.029 2.455 4.826 . 0 0 "[ . 1 . 2]" 1
1202 1 34 VAL H 1 37 ARG HD3 4.790 . 5.246 4.526 3.891 4.922 . 0 0 "[ . 1 . 2]" 1
1203 1 10 ARG H 1 11 GLN H 3.190 . 3.645 2.375 2.130 3.561 . 0 0 "[ . 1 . 2]" 1
1204 1 34 VAL H 1 37 ARG HG2 4.640 . 5.095 5.071 4.822 5.159 0.064 9 0 "[ . 1 . 2]" 1
1205 1 33 TRP HA 1 34 VAL H 3.080 . 3.536 2.155 2.091 2.270 . 0 0 "[ . 1 . 2]" 1
1206 1 11 GLN H 1 49 LEU MD2 5.500 . 5.956 5.378 5.183 5.674 . 0 0 "[ . 1 . 2]" 1
1207 1 33 TRP H 1 34 VAL H 5.070 . 5.525 4.370 4.137 4.608 . 0 0 "[ . 1 . 2]" 1
1208 1 34 VAL H 1 37 ARG HB2 3.950 . 4.405 2.760 2.602 3.026 . 0 0 "[ . 1 . 2]" 1
1209 1 9 PRO HA 1 11 GLN H 4.150 . 4.606 3.804 3.166 4.390 . 0 0 "[ . 1 . 2]" 1
1210 1 11 GLN H 1 12 VAL HA 5.120 . 5.576 4.715 4.593 4.856 . 0 0 "[ . 1 . 2]" 1
1211 1 11 GLN H 1 11 GLN HE21 5.500 . 5.956 5.167 4.946 5.418 . 0 0 "[ . 1 . 2]" 1
1212 1 11 GLN H 1 11 GLN HG2 4.290 . 4.746 2.640 2.427 2.829 . 0 0 "[ . 1 . 2]" 1
1213 1 33 TRP HB3 1 34 VAL H 4.470 . 4.925 3.483 2.500 3.992 . 0 0 "[ . 1 . 2]" 1
1214 1 33 TRP HE3 1 34 VAL H 4.320 . 4.775 3.665 2.897 4.157 . 0 0 "[ . 1 . 2]" 1
1215 1 57 ASP H 1 60 SER H 4.430 . 4.885 4.699 4.445 4.905 0.020 7 0 "[ . 1 . 2]" 1
1216 1 54 GLU HA 1 56 LEU H 4.900 . 5.356 4.578 4.357 4.786 . 0 0 "[ . 1 . 2]" 1
1217 1 34 VAL H 1 37 ARG HD2 4.020 . 4.476 3.025 2.496 3.518 . 0 0 "[ . 1 . 2]" 1
1218 1 56 LEU H 1 58 ARG H 4.620 . 5.076 4.443 4.167 4.577 . 0 0 "[ . 1 . 2]" 1
1219 1 56 LEU H 1 56 LEU HG 2.970 . 3.425 2.052 1.968 2.125 . 0 0 "[ . 1 . 2]" 1
1220 1 55 ALA MB 1 56 LEU H 3.180 . 3.635 2.435 2.351 2.564 . 0 0 "[ . 1 . 2]" 1
1221 1 56 LEU H 1 57 ASP HB2 4.890 . 5.345 4.880 4.613 5.074 . 0 0 "[ . 1 . 2]" 1
1222 1 56 LEU H 1 59 TYR H 4.750 . 5.206 4.956 4.869 5.021 . 0 0 "[ . 1 . 2]" 1
1223 1 56 LEU H 1 56 LEU HB2 3.470 . 3.925 2.587 2.541 2.667 . 0 0 "[ . 1 . 2]" 1
1224 1 56 LEU H 1 61 LEU MD1 4.950 . 5.405 4.399 3.980 4.882 . 0 0 "[ . 1 . 2]" 1
1225 1 56 LEU H 1 61 LEU H 4.990 . 5.445 5.219 4.953 5.373 . 0 0 "[ . 1 . 2]" 1
1226 1 50 ILE MD 1 56 LEU H 4.860 . 5.315 4.852 4.644 5.043 . 0 0 "[ . 1 . 2]" 1
1227 1 56 LEU H 1 61 LEU HB2 4.630 . 5.085 4.441 4.266 4.772 . 0 0 "[ . 1 . 2]" 1
1228 1 56 LEU H 1 58 ARG HG2 4.630 . 5.085 4.710 4.408 4.994 . 0 0 "[ . 1 . 2]" 1
1229 1 56 LEU H 1 56 LEU HB3 3.720 . 4.175 3.582 3.568 3.597 . 0 0 "[ . 1 . 2]" 1
1230 1 52 GLU HA 1 56 LEU H 4.410 . 4.865 4.252 3.842 4.648 . 0 0 "[ . 1 . 2]" 1
1231 1 54 GLU H 1 56 LEU H 4.070 . 4.525 4.102 3.910 4.271 . 0 0 "[ . 1 . 2]" 1
1232 1 22 ARG HA 1 24 ASP H 4.270 . 4.726 3.661 3.475 3.816 . 0 0 "[ . 1 . 2]" 1
1233 1 24 ASP H 1 25 LEU HB2 4.940 . 5.396 4.400 4.176 4.592 . 0 0 "[ . 1 . 2]" 1
1234 1 24 ASP H 1 25 LEU HG 5.340 . 5.795 3.969 3.727 4.161 . 0 0 "[ . 1 . 2]" 1
1235 1 21 SER H 1 24 ASP H 4.260 . 4.715 3.467 3.292 3.707 . 0 0 "[ . 1 . 2]" 1
1236 1 23 ALA MB 1 24 ASP H 3.520 . 3.976 3.149 2.987 3.279 . 0 0 "[ . 1 . 2]" 1
1237 1 20 LEU HA 1 24 ASP H 5.320 . 5.775 5.069 4.815 5.419 . 0 0 "[ . 1 . 2]" 1
1238 1 24 ASP H 1 24 ASP QB 3.030 . 3.486 2.318 2.232 2.377 . 0 0 "[ . 1 . 2]" 1
1239 1 20 LEU MD1 1 24 ASP H 4.170 . 4.626 3.844 3.546 4.103 . 0 0 "[ . 1 . 2]" 1
1240 1 24 ASP H 1 49 LEU MD2 4.950 . 5.405 4.337 4.068 4.728 . 0 0 "[ . 1 . 2]" 1
1241 1 28 LEU MD2 1 58 ARG HE 4.520 . 4.820 3.407 1.789 4.813 0.011 5 0 "[ . 1 . 2]" 1
1242 1 25 LEU MD2 1 58 ARG HE 5.240 . 5.695 5.104 4.076 5.765 0.069 14 0 "[ . 1 . 2]" 1
1243 1 28 LEU MD1 1 58 ARG HE 5.500 . 5.956 5.068 3.872 5.967 0.011 7 0 "[ . 1 . 2]" 1
1244 1 12 VAL H 1 21 SER HB3 5.500 . 5.956 4.938 4.598 5.382 . 0 0 "[ . 1 . 2]" 1
1245 1 12 VAL H 1 20 LEU HB3 4.270 . 4.726 3.400 2.981 3.613 . 0 0 "[ . 1 . 2]" 1
1246 1 12 VAL H 1 21 SER HB2 5.500 . 5.956 5.589 5.321 5.969 0.014 18 0 "[ . 1 . 2]" 1
1247 1 11 GLN HB2 1 12 VAL H 4.140 . 4.595 2.945 2.715 3.181 . 0 0 "[ . 1 . 2]" 1
1248 1 12 VAL H 1 12 VAL MG2 3.050 . 3.506 2.127 1.984 2.224 . 0 0 "[ . 1 . 2]" 1
1249 1 11 GLN HA 1 12 VAL H 2.910 . 3.365 2.194 2.134 2.273 . 0 0 "[ . 1 . 2]" 1
1250 1 11 GLN H 1 12 VAL H 4.530 . 4.985 4.266 4.176 4.353 . 0 0 "[ . 1 . 2]" 1
1251 1 11 GLN HB3 1 12 VAL H 4.140 . 4.595 4.019 3.865 4.107 . 0 0 "[ . 1 . 2]" 1
1252 1 12 VAL H 1 20 LEU HA 4.580 . 5.036 4.641 4.523 4.775 . 0 0 "[ . 1 . 2]" 1
1253 1 12 VAL H 1 20 LEU HG 4.880 . 5.335 4.131 3.992 4.318 . 0 0 "[ . 1 . 2]" 1
1254 1 12 VAL H 1 12 VAL MG1 3.350 . 3.806 2.997 2.790 3.105 . 0 0 "[ . 1 . 2]" 1
1255 1 12 VAL H 1 21 SER HA 3.560 . 3.760 3.240 3.107 3.455 . 0 0 "[ . 1 . 2]" 1
1256 1 28 LEU HG 1 29 ASP H 4.840 . 5.295 4.392 4.216 4.541 . 0 0 "[ . 1 . 2]" 1
1257 1 28 LEU MD2 1 29 ASP H 4.690 . 5.146 4.585 4.463 4.685 . 0 0 "[ . 1 . 2]" 1
1258 1 27 PRO HB2 1 29 ASP H 3.400 . 3.855 2.354 2.064 3.013 . 0 0 "[ . 1 . 2]" 1
1259 1 29 ASP H 1 29 ASP HB3 3.840 . 4.295 3.084 2.325 3.662 . 0 0 "[ . 1 . 2]" 1
1260 1 27 PRO HB3 1 29 ASP H 4.070 . 4.525 3.870 3.276 4.187 . 0 0 "[ . 1 . 2]" 1
1261 1 28 LEU MD1 1 29 ASP H 5.020 . 5.476 4.936 4.728 5.194 . 0 0 "[ . 1 . 2]" 1
1262 1 29 ASP H 1 29 ASP HB2 3.840 . 4.295 2.755 2.330 3.654 . 0 0 "[ . 1 . 2]" 1
1263 1 29 ASP H 1 30 THR H 3.180 . 3.635 2.536 2.346 2.881 . 0 0 "[ . 1 . 2]" 1
1264 1 28 LEU H 1 29 ASP H 3.510 . 3.966 2.512 2.322 2.683 . 0 0 "[ . 1 . 2]" 1
1265 1 29 ASP H 1 30 THR HA 5.150 . 5.606 4.938 4.611 5.163 . 0 0 "[ . 1 . 2]" 1
1266 1 29 ASP H 1 30 THR HB 5.420 . 5.876 4.739 4.416 5.054 . 0 0 "[ . 1 . 2]" 1
1267 1 61 LEU H 1 62 SER H 4.540 . 4.996 4.481 4.271 4.580 . 0 0 "[ . 1 . 2]" 1
1268 1 62 SER H 1 62 SER HB3 4.110 . 4.565 3.708 3.621 3.920 . 0 0 "[ . 1 . 2]" 1
1269 1 61 LEU MD1 1 62 SER H 4.380 . 4.835 4.511 3.863 4.833 . 0 0 "[ . 1 . 2]" 1
1270 1 61 LEU HB2 1 62 SER H 3.910 . 4.365 3.639 2.840 3.898 . 0 0 "[ . 1 . 2]" 1
1271 1 61 LEU HB3 1 62 SER H 3.550 . 4.005 2.537 1.783 2.919 0.017 5 0 "[ . 1 . 2]" 1
1272 1 62 SER H 1 65 GLU HB2 3.500 . 3.955 2.892 2.474 3.271 . 0 0 "[ . 1 . 2]" 1
1273 1 62 SER H 1 65 GLU HB3 3.540 . 3.996 2.515 2.054 2.979 . 0 0 "[ . 1 . 2]" 1
1274 1 61 LEU HA 1 62 SER H 2.730 . 3.185 2.352 2.211 2.789 . 0 0 "[ . 1 . 2]" 1
1275 1 62 SER H 1 62 SER HB2 3.470 . 3.925 2.615 2.506 2.898 . 0 0 "[ . 1 . 2]" 1
1276 1 61 LEU MD2 1 62 SER H 3.670 . 4.126 3.475 3.169 3.730 . 0 0 "[ . 1 . 2]" 1
1277 1 56 LEU HA 1 62 SER H 4.950 . 5.150 5.081 4.240 5.219 0.069 20 0 "[ . 1 . 2]" 1
1278 1 61 LEU HG 1 62 SER H 4.780 . 5.235 4.894 4.559 5.094 . 0 0 "[ . 1 . 2]" 1
1279 1 62 SER H 1 66 PHE H 4.140 . 4.595 4.200 3.583 4.543 . 0 0 "[ . 1 . 2]" 1
1280 1 16 ASP H 1 18 THR H 3.910 . 4.365 3.572 3.334 4.032 . 0 0 "[ . 1 . 2]" 1
1281 1 16 ASP HB3 1 18 THR H 4.960 . 5.416 3.853 2.346 5.431 0.016 13 0 "[ . 1 . 2]" 1
1282 1 17 GLY H 1 18 THR H 2.930 . 3.385 2.336 1.994 2.693 . 0 0 "[ . 1 . 2]" 1
1283 1 14 LEU HG 1 18 THR H 4.510 . 4.965 4.272 3.996 4.664 . 0 0 "[ . 1 . 2]" 1
1284 1 17 GLY HA3 1 18 THR H 3.560 . 4.016 3.307 3.179 3.547 . 0 0 "[ . 1 . 2]" 1
1285 1 18 THR H 1 18 THR HB 3.600 . 4.056 2.817 2.559 3.291 . 0 0 "[ . 1 . 2]" 1
1286 1 14 LEU H 1 18 THR H 3.970 . 4.425 3.437 2.641 3.828 . 0 0 "[ . 1 . 2]" 1
1287 1 14 LEU MD1 1 18 THR H 4.990 . 5.445 4.951 4.754 5.248 . 0 0 "[ . 1 . 2]" 1
1288 1 14 LEU HB2 1 18 THR H 3.570 . 4.025 2.178 1.902 2.496 . 0 0 "[ . 1 . 2]" 1
1289 1 16 ASP HB2 1 18 THR H 4.960 . 5.416 3.278 2.313 4.430 . 0 0 "[ . 1 . 2]" 1
1290 1 18 THR H 1 19 VAL MG2 5.040 . 5.496 5.090 4.610 5.358 . 0 0 "[ . 1 . 2]" 1
1291 1 14 LEU HB3 1 18 THR H 4.070 . 4.525 3.507 3.259 3.885 . 0 0 "[ . 1 . 2]" 1
1292 1 26 PRO HG3 1 41 VAL H 4.410 . 4.865 3.855 3.557 4.118 . 0 0 "[ . 1 . 2]" 1
1293 1 41 VAL H 1 41 VAL MG1 3.820 . 4.275 3.773 3.765 3.781 . 0 0 "[ . 1 . 2]" 1
1294 1 41 VAL H 1 41 VAL MG2 3.040 . 3.496 2.095 2.027 2.184 . 0 0 "[ . 1 . 2]" 1
1295 1 41 VAL H 1 41 VAL HB 3.210 . 3.665 2.536 2.494 2.566 . 0 0 "[ . 1 . 2]" 1
1296 1 25 LEU MD2 1 41 VAL H 3.890 . 4.345 4.091 3.707 4.297 . 0 0 "[ . 1 . 2]" 1
1297 1 41 VAL H 1 42 VAL MG1 4.410 . 4.865 3.941 3.840 4.007 . 0 0 "[ . 1 . 2]" 1
1298 1 41 VAL H 1 69 TRP HE3 5.040 . 5.496 4.614 4.344 4.881 . 0 0 "[ . 1 . 2]" 1
1299 1 39 ALA MB 1 41 VAL H 4.930 . 5.230 4.556 4.410 4.693 . 0 0 "[ . 1 . 2]" 1
1300 1 39 ALA HA 1 41 VAL H 4.730 . 5.230 4.418 4.306 4.553 . 0 0 "[ . 1 . 2]" 1
1301 1 38 LYS HB3 1 41 VAL H 5.500 . 5.956 5.360 5.220 5.458 . 0 0 "[ . 1 . 2]" 1
1302 1 39 ALA H 1 41 VAL H 4.970 . 5.425 4.277 4.177 4.385 . 0 0 "[ . 1 . 2]" 1
1303 1 38 LYS HA 1 41 VAL H 3.720 . 4.175 3.566 3.461 3.625 . 0 0 "[ . 1 . 2]" 1
1304 1 27 PRO HB3 1 30 THR H 5.500 . 5.956 5.061 3.980 5.403 . 0 0 "[ . 1 . 2]" 1
1305 1 53 ARG H 1 55 ALA H 4.480 . 4.936 4.235 4.073 4.376 . 0 0 "[ . 1 . 2]" 1
1306 1 29 ASP HB2 1 30 THR H 4.720 . 5.175 3.838 3.031 4.524 . 0 0 "[ . 1 . 2]" 1
1307 1 30 THR H 1 30 THR MG 3.830 . 4.286 3.517 1.976 3.792 . 0 0 "[ . 1 . 2]" 1
1308 1 28 LEU HB3 1 30 THR H 5.270 . 5.726 5.140 4.917 5.353 . 0 0 "[ . 1 . 2]" 1
1309 1 28 LEU HB2 1 30 THR H 5.270 . 5.726 4.996 4.812 5.209 . 0 0 "[ . 1 . 2]" 1
1310 1 30 THR H 1 30 THR HB 3.510 . 3.966 2.501 2.372 2.744 . 0 0 "[ . 1 . 2]" 1
1311 1 27 PRO HB2 1 30 THR H 4.420 . 4.920 3.460 2.558 3.861 . 0 0 "[ . 1 . 2]" 1
1312 1 27 PRO HG2 1 30 THR H 4.720 . 5.220 3.475 2.963 4.645 . 0 0 "[ . 1 . 2]" 1
1313 1 53 ARG H 1 54 GLU HA 5.500 . 5.956 5.199 5.099 5.360 . 0 0 "[ . 1 . 2]" 1
1314 1 29 ASP HB3 1 30 THR H 4.720 . 5.175 3.986 2.964 4.427 . 0 0 "[ . 1 . 2]" 1
1315 1 29 ASP HA 1 30 THR H 3.540 . 3.996 3.290 2.908 3.461 . 0 0 "[ . 1 . 2]" 1
1316 1 42 VAL MG2 1 70 ARG HE 5.250 . 5.706 4.665 3.716 5.769 0.064 1 0 "[ . 1 . 2]" 1
1317 1 70 ARG HB2 1 70 ARG HE 4.820 . 5.275 2.899 2.064 4.505 . 0 0 "[ . 1 . 2]" 1
1318 1 45 VAL MG1 1 53 ARG H 4.710 . 5.166 4.585 4.370 4.894 . 0 0 "[ . 1 . 2]" 1
1319 1 52 GLU H 1 53 ARG H 3.300 . 3.756 2.722 2.601 2.820 . 0 0 "[ . 1 . 2]" 1
1320 1 53 ARG H 1 54 GLU HB2 5.390 . 5.845 5.025 4.848 5.218 . 0 0 "[ . 1 . 2]" 1
1321 1 53 ARG H 1 53 ARG HG3 4.250 . 4.706 3.878 3.041 4.527 . 0 0 "[ . 1 . 2]" 1
1322 1 52 GLU HB3 1 53 ARG H 2.730 . 3.185 2.624 2.432 3.207 0.022 18 0 "[ . 1 . 2]" 1
1323 1 53 ARG H 1 53 ARG HB2 2.870 . 3.326 2.318 2.088 2.722 . 0 0 "[ . 1 . 2]" 1
1324 1 53 ARG H 1 54 GLU H 3.290 . 3.746 2.580 2.484 2.753 . 0 0 "[ . 1 . 2]" 1
1325 1 70 ARG HB3 1 70 ARG HE 4.710 . 5.166 3.479 2.674 4.555 . 0 0 "[ . 1 . 2]" 1
1326 1 28 LEU H 1 30 THR H 5.300 . 5.755 4.223 3.971 4.505 . 0 0 "[ . 1 . 2]" 1
1327 1 52 GLU HB2 1 53 ARG H 3.670 . 4.126 3.604 2.618 3.845 . 0 0 "[ . 1 . 2]" 1
1328 1 53 ARG H 1 53 ARG HD3 5.040 . 5.496 4.454 3.535 5.182 . 0 0 "[ . 1 . 2]" 1
1329 1 53 ARG H 1 56 LEU MD1 4.550 . 5.005 4.194 3.863 4.537 . 0 0 "[ . 1 . 2]" 1
1330 1 67 ALA HA 1 70 ARG HE 5.200 . 5.700 4.172 1.770 5.231 0.030 15 0 "[ . 1 . 2]" 1
1331 1 50 ILE MD 1 53 ARG H 5.500 . 5.956 5.994 5.946 6.049 0.093 6 0 "[ . 1 . 2]" 1
1332 1 53 ARG H 1 56 LEU MD2 5.500 . 5.956 5.922 5.744 6.011 0.055 16 0 "[ . 1 . 2]" 1
1333 1 51 THR HG1 1 53 ARG H 4.860 . 5.315 3.293 2.913 3.778 . 0 0 "[ . 1 . 2]" 1
1334 1 45 VAL MG2 1 53 ARG H 5.100 . 5.556 4.963 4.803 5.148 . 0 0 "[ . 1 . 2]" 1
1335 1 53 ARG H 1 53 ARG HD2 5.040 . 5.496 4.717 2.680 5.333 . 0 0 "[ . 1 . 2]" 1
1336 1 56 LEU MD1 1 57 ASP H 4.400 . 4.856 4.498 4.190 4.708 . 0 0 "[ . 1 . 2]" 1
1337 1 57 ASP H 1 58 ARG H 3.200 . 3.655 2.642 2.331 2.791 . 0 0 "[ . 1 . 2]" 1
1338 1 55 ALA MB 1 57 ASP H 4.590 . 5.045 4.403 4.279 4.635 . 0 0 "[ . 1 . 2]" 1
1339 1 54 GLU HA 1 57 ASP H 3.780 . 4.235 3.557 3.320 3.951 . 0 0 "[ . 1 . 2]" 1
1340 1 57 ASP H 1 57 ASP HB2 3.050 . 3.506 2.486 2.133 2.706 . 0 0 "[ . 1 . 2]" 1
1341 1 56 LEU MD2 1 57 ASP H 5.120 . 5.576 4.644 4.548 4.703 . 0 0 "[ . 1 . 2]" 1
1342 1 53 ARG HA 1 57 ASP H 4.390 . 4.845 4.041 3.611 4.409 . 0 0 "[ . 1 . 2]" 1
1343 1 56 LEU HB2 1 57 ASP H 3.540 . 3.996 2.707 2.305 2.961 . 0 0 "[ . 1 . 2]" 1
1344 1 56 LEU HG 1 57 ASP H 4.320 . 4.775 4.189 4.050 4.328 . 0 0 "[ . 1 . 2]" 1
1345 1 57 ASP H 1 57 ASP HB3 3.560 . 4.016 2.816 2.359 3.609 . 0 0 "[ . 1 . 2]" 1
1346 1 57 ASP H 1 59 TYR H 4.430 . 4.885 4.025 3.775 4.265 . 0 0 "[ . 1 . 2]" 1
1347 1 54 GLU H 1 57 ASP H 4.730 . 4.930 4.656 4.471 4.771 . 0 0 "[ . 1 . 2]" 1
1348 1 57 ASP H 1 61 LEU H 5.350 . 5.806 4.763 4.528 4.977 . 0 0 "[ . 1 . 2]" 1
1349 1 72 ALA H 1 73 VAL H 3.710 . 4.166 2.434 2.285 2.672 . 0 0 "[ . 1 . 2]" 1
1350 1 76 HIS H 1 76 HIS HB2 4.130 . 4.585 2.612 2.412 3.228 . 0 0 "[ . 1 . 2]" 1
1351 1 73 VAL H 1 73 VAL MG2 2.810 . 3.266 2.344 2.061 2.672 . 0 0 "[ . 1 . 2]" 1
1352 1 72 ALA MB 1 73 VAL H 3.130 . 3.586 2.649 2.124 3.057 . 0 0 "[ . 1 . 2]" 1
1353 1 76 HIS H 1 76 HIS HB3 4.130 . 4.585 2.645 2.345 3.722 . 0 0 "[ . 1 . 2]" 1
1354 1 73 VAL H 1 73 VAL HB 2.880 . 3.336 2.538 2.460 2.653 . 0 0 "[ . 1 . 2]" 1
1355 1 73 VAL H 1 75 ALA MB 4.870 . 5.326 4.819 4.300 5.208 . 0 0 "[ . 1 . 2]" 1
1356 1 46 ILE MD 1 73 VAL H 5.490 . 5.945 5.797 5.526 6.009 0.064 1 0 "[ . 1 . 2]" 1
1357 1 70 ARG HA 1 73 VAL H 3.890 . 4.345 3.400 2.953 3.649 . 0 0 "[ . 1 . 2]" 1
1358 1 37 ARG HB2 1 39 ALA H 5.140 . 5.595 5.141 4.999 5.282 . 0 0 "[ . 1 . 2]" 1
1359 1 73 VAL MG2 1 76 HIS H 5.500 . 5.956 5.505 5.019 5.814 . 0 0 "[ . 1 . 2]" 1
1360 1 73 VAL HA 1 76 HIS H 4.600 . 5.056 3.941 3.209 4.879 . 0 0 "[ . 1 . 2]" 1
1361 1 76 HIS H 1 77 GLY H 4.590 . 5.045 3.476 2.182 4.559 . 0 0 "[ . 1 . 2]" 1
1362 1 73 VAL H 1 76 HIS H 4.860 . 5.315 4.695 3.966 5.328 0.012 2 0 "[ . 1 . 2]" 1
1363 1 38 LYS HD2 1 39 ALA H 4.910 . 5.365 5.114 4.948 5.293 . 0 0 "[ . 1 . 2]" 1
1364 1 38 LYS HB2 1 39 ALA H 3.280 . 3.736 2.554 2.484 2.652 . 0 0 "[ . 1 . 2]" 1
1365 1 37 ARG HA 1 39 ALA H 4.930 . 5.385 4.354 4.219 4.488 . 0 0 "[ . 1 . 2]" 1
1366 1 39 ALA H 1 42 VAL MG1 3.910 . 4.365 4.013 3.908 4.076 . 0 0 "[ . 1 . 2]" 1
1367 1 38 LYS QG 1 39 ALA H 4.660 . 5.115 4.073 4.012 4.164 . 0 0 "[ . 1 . 2]" 1
1368 1 38 LYS HB3 1 39 ALA H 3.490 . 3.945 3.518 3.404 3.596 . 0 0 "[ . 1 . 2]" 1
1369 1 36 SER HA 1 39 ALA H 4.260 . 4.715 3.627 3.264 3.949 . 0 0 "[ . 1 . 2]" 1
1370 1 35 ALA HA 1 39 ALA H 3.970 . 4.425 3.936 3.700 4.227 . 0 0 "[ . 1 . 2]" 1
1371 1 39 ALA H 1 39 ALA MB 2.700 . 3.155 2.229 2.223 2.235 . 0 0 "[ . 1 . 2]" 1
1372 1 39 ALA H 1 40 ALA H 3.120 . 3.576 2.747 2.674 2.821 . 0 0 "[ . 1 . 2]" 1
1373 1 39 ALA H 1 42 VAL HB 5.500 . 5.956 5.964 5.885 6.008 0.052 12 0 "[ . 1 . 2]" 1
1374 1 38 LYS H 1 39 ALA H 3.160 . 3.615 2.657 2.618 2.720 . 0 0 "[ . 1 . 2]" 1
1375 1 37 ARG H 1 39 ALA H 4.620 . 5.076 3.998 3.883 4.136 . 0 0 "[ . 1 . 2]" 1
1376 1 38 LYS HD3 1 39 ALA H 5.500 . 5.956 5.563 5.380 5.680 . 0 0 "[ . 1 . 2]" 1
1377 1 84 THR H 1 84 THR HB 3.850 . 4.306 2.658 2.532 2.799 . 0 0 "[ . 1 . 2]" 1
1378 1 83 VAL HA 1 84 THR H 3.570 . 4.025 3.497 3.386 3.541 . 0 0 "[ . 1 . 2]" 1
1379 1 84 THR H 1 84 THR MG 3.900 . 4.356 3.740 3.685 3.873 . 0 0 "[ . 1 . 2]" 1
1380 1 39 ALA H 1 40 ALA MB 4.760 . 5.215 4.402 4.345 4.463 . 0 0 "[ . 1 . 2]" 1
1381 1 83 VAL MG1 1 84 THR H 3.970 . 4.425 2.229 2.002 2.714 . 0 0 "[ . 1 . 2]" 1
1382 1 83 VAL HB 1 84 THR H 4.420 . 4.876 4.022 3.926 4.194 . 0 0 "[ . 1 . 2]" 1
1383 1 84 THR H 1 85 MET HB2 4.750 . 5.206 4.456 3.964 4.786 . 0 0 "[ . 1 . 2]" 1
1384 1 82 LYS QD 1 84 THR H 4.930 . 5.385 3.770 2.981 4.882 . 0 0 "[ . 1 . 2]" 1
1385 1 82 LYS HG2 1 84 THR H 4.590 . 5.045 2.538 1.790 4.165 0.010 14 0 "[ . 1 . 2]" 1
1386 1 82 LYS HG3 1 84 THR H 4.590 . 5.045 3.508 1.965 4.450 . 0 0 "[ . 1 . 2]" 1
1387 1 84 THR H 1 85 MET H 3.620 . 4.076 2.512 2.386 2.760 . 0 0 "[ . 1 . 2]" 1
1388 1 70 ARG H 1 73 VAL HB 5.190 . 5.646 5.270 5.056 5.448 . 0 0 "[ . 1 . 2]" 1
1389 1 70 ARG H 1 70 ARG QG 3.220 . 3.675 2.118 1.856 2.508 . 0 0 "[ . 1 . 2]" 1
1390 1 70 ARG H 1 73 VAL H 4.790 . 5.246 4.776 4.625 4.928 . 0 0 "[ . 1 . 2]" 1
1391 1 64 GLU H 1 66 PHE H 4.730 . 5.186 4.495 4.318 4.739 . 0 0 "[ . 1 . 2]" 1
1392 1 69 TRP HB2 1 70 ARG H 3.620 . 4.076 2.412 2.326 2.504 . 0 0 "[ . 1 . 2]" 1
1393 1 69 TRP HB3 1 70 ARG H 3.440 . 3.895 3.387 3.259 3.509 . 0 0 "[ . 1 . 2]" 1
1394 1 70 ARG H 1 70 ARG HB3 3.270 . 3.726 2.594 2.387 2.779 . 0 0 "[ . 1 . 2]" 1
1395 1 66 PHE HA 1 70 ARG H 4.390 . 4.690 4.013 3.877 4.200 . 0 0 "[ . 1 . 2]" 1
1396 1 66 PHE H 1 68 LEU MD1 5.330 . 5.786 5.625 5.416 5.806 0.021 4 0 "[ . 1 . 2]" 1
1397 1 61 LEU HB3 1 66 PHE H 4.560 . 5.016 3.822 3.484 4.077 . 0 0 "[ . 1 . 2]" 1
1398 1 68 LEU HA 1 70 ARG H 4.670 . 5.126 4.629 4.518 4.790 . 0 0 "[ . 1 . 2]" 1
1399 1 65 GLU HB3 1 66 PHE H 3.800 . 4.255 2.252 2.110 2.396 . 0 0 "[ . 1 . 2]" 1
1400 1 66 PHE H 1 66 PHE HB3 3.290 . 3.746 2.644 2.593 2.694 . 0 0 "[ . 1 . 2]" 1
1401 1 56 LEU MD2 1 66 PHE H 3.860 . 4.315 3.217 2.888 3.490 . 0 0 "[ . 1 . 2]" 1
1402 1 66 PHE H 1 67 ALA MB 4.630 . 5.085 4.325 4.287 4.405 . 0 0 "[ . 1 . 2]" 1
1403 1 66 PHE H 1 66 PHE HB2 3.270 . 3.726 2.410 2.346 2.463 . 0 0 "[ . 1 . 2]" 1
1404 1 63 GLU HA 1 66 PHE H 4.020 . 4.476 3.511 3.191 3.873 . 0 0 "[ . 1 . 2]" 1
1405 1 66 PHE H 1 69 TRP HD1 5.420 . 5.876 5.309 5.080 5.555 . 0 0 "[ . 1 . 2]" 1
1406 1 65 GLU HB2 1 66 PHE H 3.820 . 4.275 3.667 3.492 3.785 . 0 0 "[ . 1 . 2]" 1
1407 1 61 LEU MD1 1 66 PHE H 4.640 . 5.095 4.388 4.182 4.572 . 0 0 "[ . 1 . 2]" 1
1408 1 46 ILE MD 1 70 ARG H 5.110 . 5.565 5.542 5.343 5.654 0.088 4 0 "[ . 1 . 2]" 1
1409 1 67 ALA HA 1 70 ARG H 4.040 . 4.340 3.699 3.593 3.859 . 0 0 "[ . 1 . 2]" 1
1410 1 66 PHE QE 1 70 ARG H 5.280 . 5.735 4.999 4.840 5.217 . 0 0 "[ . 1 . 2]" 1
1411 1 68 LEU H 1 70 ARG H 4.700 . 5.155 4.331 4.179 4.475 . 0 0 "[ . 1 . 2]" 1
1412 1 66 PHE H 1 68 LEU H 4.850 . 5.306 4.223 4.087 4.297 . 0 0 "[ . 1 . 2]" 1
1413 1 61 LEU HB2 1 66 PHE H 4.630 . 5.085 4.898 4.510 5.113 0.028 15 0 "[ . 1 . 2]" 1
1414 1 65 GLU HG2 1 66 PHE H 4.190 . 4.646 4.247 3.970 4.423 . 0 0 "[ . 1 . 2]" 1
1415 1 63 GLU QG 1 66 PHE H 5.500 . 5.956 5.047 4.617 5.527 . 0 0 "[ . 1 . 2]" 1
1416 1 65 GLU H 1 66 PHE H 2.670 . 3.125 2.675 2.498 2.850 . 0 0 "[ . 1 . 2]" 1
1417 1 51 THR MG 1 54 GLU H 4.060 . 4.516 1.750 1.702 1.806 0.098 9 0 "[ . 1 . 2]" 1
1418 1 52 GLU HA 1 54 GLU H 4.690 . 5.146 4.153 4.025 4.279 . 0 0 "[ . 1 . 2]" 1
1419 1 43 LYS H 1 43 LYS QG 3.890 . 4.345 2.418 2.340 2.519 . 0 0 "[ . 1 . 2]" 1
1420 1 51 THR HG1 1 54 GLU H 4.040 . 4.496 4.317 3.663 4.550 0.055 9 0 "[ . 1 . 2]" 1
1421 1 53 ARG HA 1 53 ARG HE 5.240 . 5.695 3.731 2.450 4.947 . 0 0 "[ . 1 . 2]" 1
1422 1 43 LYS H 1 43 LYS QD 3.710 . 4.166 3.867 3.716 3.975 . 0 0 "[ . 1 . 2]" 1
1423 1 42 VAL MG1 1 43 LYS H 3.390 . 3.845 2.151 2.101 2.188 . 0 0 "[ . 1 . 2]" 1
1424 1 43 LYS H 1 43 LYS HB2 3.230 . 3.685 2.429 2.382 2.504 . 0 0 "[ . 1 . 2]" 1
1425 1 54 GLU H 1 54 GLU HB2 3.170 . 3.625 2.651 2.537 2.778 . 0 0 "[ . 1 . 2]" 1
1426 1 41 VAL MG2 1 42 VAL H 3.930 . 4.385 3.772 3.712 3.811 . 0 0 "[ . 1 . 2]" 1
1427 1 53 ARG HB2 1 54 GLU H 3.320 . 3.776 3.139 2.606 3.781 0.006 5 0 "[ . 1 . 2]" 1
1428 1 51 THR H 1 54 GLU H 4.130 . 4.430 3.816 3.567 3.960 . 0 0 "[ . 1 . 2]" 1
1429 1 53 ARG HG3 1 54 GLU H 5.130 . 5.585 5.181 4.775 5.429 . 0 0 "[ . 1 . 2]" 1
1430 1 54 GLU H 1 54 GLU HB3 3.140 . 3.595 2.425 2.237 2.630 . 0 0 "[ . 1 . 2]" 1
1431 1 39 ALA HA 1 42 VAL H 4.180 . 4.680 3.605 3.485 3.706 . 0 0 "[ . 1 . 2]" 1
1432 1 34 VAL H 1 38 LYS H 4.600 . 5.056 4.208 3.749 4.548 . 0 0 "[ . 1 . 2]" 1
1433 1 53 ARG HE 1 53 ARG HG2 4.100 . 4.556 2.762 2.093 3.772 . 0 0 "[ . 1 . 2]" 1
1434 1 50 ILE MD 1 54 GLU H 4.240 . 4.695 4.552 4.415 4.680 . 0 0 "[ . 1 . 2]" 1
1435 1 38 LYS HB3 1 42 VAL H 4.740 . 5.195 4.892 4.766 4.991 . 0 0 "[ . 1 . 2]" 1
1436 1 38 LYS HA 1 42 VAL H 4.410 . 4.865 4.198 4.045 4.293 . 0 0 "[ . 1 . 2]" 1
1437 1 42 VAL H 1 66 PHE HZ 4.970 . 5.425 5.158 4.640 5.432 0.006 19 0 "[ . 1 . 2]" 1
1438 1 42 VAL H 1 44 ALA H 4.340 . 4.795 3.999 3.939 4.099 . 0 0 "[ . 1 . 2]" 1
1439 1 42 VAL H 1 43 LYS H 3.380 . 3.836 2.663 2.626 2.702 . 0 0 "[ . 1 . 2]" 1
1440 1 42 VAL H 1 42 VAL HB 3.050 . 3.506 2.572 2.540 2.608 . 0 0 "[ . 1 . 2]" 1
1441 1 51 THR HB 1 54 GLU H 4.720 . 5.175 4.506 4.437 4.634 . 0 0 "[ . 1 . 2]" 1
1442 1 41 VAL MG1 1 42 VAL H 3.930 . 4.385 3.309 3.205 3.397 . 0 0 "[ . 1 . 2]" 1
1443 1 53 ARG HE 1 53 ARG HG3 4.100 . 4.556 2.957 2.346 3.753 . 0 0 "[ . 1 . 2]" 1
1444 1 42 VAL H 1 42 VAL MG1 2.830 . 3.286 2.115 2.059 2.137 . 0 0 "[ . 1 . 2]" 1
1445 1 41 VAL H 1 42 VAL H 3.190 . 3.645 2.710 2.627 2.787 . 0 0 "[ . 1 . 2]" 1
1446 1 41 VAL HB 1 42 VAL H 3.370 . 3.826 2.459 2.374 2.542 . 0 0 "[ . 1 . 2]" 1
1447 1 53 ARG HB3 1 53 ARG HE 4.780 . 5.235 3.696 1.809 4.549 . 0 0 "[ . 1 . 2]" 1
1448 1 42 VAL H 1 44 ALA MB 4.990 . 5.445 4.687 4.621 4.760 . 0 0 "[ . 1 . 2]" 1
1449 1 43 LYS H 1 45 VAL H 4.650 . 5.106 4.324 4.192 4.524 . 0 0 "[ . 1 . 2]" 1
1450 1 33 TRP HB3 1 38 LYS H 4.900 . 5.200 4.241 3.908 4.842 . 0 0 "[ . 1 . 2]" 1
1451 1 41 VAL H 1 43 LYS H 4.500 . 4.956 4.144 4.050 4.233 . 0 0 "[ . 1 . 2]" 1
1452 1 39 ALA MB 1 43 LYS H 4.750 . 5.050 4.393 4.260 4.512 . 0 0 "[ . 1 . 2]" 1
1453 1 43 LYS H 1 43 LYS HB3 3.600 . 4.056 3.609 3.595 3.636 . 0 0 "[ . 1 . 2]" 1
1454 1 42 VAL HB 1 43 LYS H 3.890 . 4.345 3.979 3.950 4.001 . 0 0 "[ . 1 . 2]" 1
1455 1 39 ALA HA 1 43 LYS H 4.360 . 4.860 3.763 3.594 3.929 . 0 0 "[ . 1 . 2]" 1
1456 1 43 LYS H 1 46 ILE MD 4.890 . 5.345 4.259 3.896 4.604 . 0 0 "[ . 1 . 2]" 1
1457 1 54 GLU H 1 54 GLU HG3 4.700 . 5.155 4.415 4.252 4.519 . 0 0 "[ . 1 . 2]" 1
1458 1 51 THR HA 1 54 GLU H 5.030 . 5.485 4.517 4.397 4.643 . 0 0 "[ . 1 . 2]" 1
1459 1 52 GLU H 1 54 GLU H 4.510 . 4.965 4.039 3.929 4.172 . 0 0 "[ . 1 . 2]" 1
1460 1 54 GLU H 1 56 LEU MD1 4.920 . 5.376 5.162 4.850 5.386 0.010 16 0 "[ . 1 . 2]" 1
1461 1 53 ARG HE 1 56 LEU MD1 5.500 . 5.956 3.948 2.934 5.961 0.005 16 0 "[ . 1 . 2]" 1
1462 1 42 VAL H 1 45 VAL H 5.310 . 5.766 4.978 4.866 5.139 . 0 0 "[ . 1 . 2]" 1
1463 1 37 ARG HG3 1 38 LYS H 4.350 . 4.806 4.369 4.201 4.603 . 0 0 "[ . 1 . 2]" 1
1464 1 38 LYS H 1 40 ALA H 4.430 . 4.885 4.174 4.026 4.311 . 0 0 "[ . 1 . 2]" 1
1465 1 38 LYS H 1 38 LYS HD2 4.500 . 4.956 4.248 4.081 4.425 . 0 0 "[ . 1 . 2]" 1
1466 1 35 ALA HA 1 38 LYS H 4.090 . 4.545 3.569 3.322 3.753 . 0 0 "[ . 1 . 2]" 1
1467 1 38 LYS H 1 38 LYS HD3 4.940 . 5.396 4.888 4.815 4.968 . 0 0 "[ . 1 . 2]" 1
1468 1 34 VAL MG2 1 38 LYS H 4.240 . 4.695 3.704 3.605 3.794 . 0 0 "[ . 1 . 2]" 1
1469 1 38 LYS H 1 39 ALA MB 4.670 . 5.126 4.301 4.266 4.351 . 0 0 "[ . 1 . 2]" 1
1470 1 37 ARG H 1 38 LYS H 3.200 . 3.655 2.498 2.375 2.590 . 0 0 "[ . 1 . 2]" 1
1471 1 37 ARG HB2 1 38 LYS H 3.670 . 4.126 2.749 2.625 2.924 . 0 0 "[ . 1 . 2]" 1
1472 1 38 LYS H 1 38 LYS QG 3.900 . 4.356 2.363 2.239 2.488 . 0 0 "[ . 1 . 2]" 1
1473 1 38 LYS H 1 38 LYS HB3 3.610 . 4.065 3.606 3.594 3.618 . 0 0 "[ . 1 . 2]" 1
1474 1 38 LYS H 1 38 LYS HB2 3.500 . 3.955 2.459 2.400 2.501 . 0 0 "[ . 1 . 2]" 1
1475 1 36 SER QB 1 38 LYS H 5.250 . 5.706 4.765 4.538 5.141 . 0 0 "[ . 1 . 2]" 1
1476 1 26 PRO HG3 1 38 LYS H 5.500 . 5.956 5.084 4.865 5.259 . 0 0 "[ . 1 . 2]" 1
1477 1 38 LYS H 1 38 LYS HE2 5.500 . 5.956 5.354 4.680 5.603 . 0 0 "[ . 1 . 2]" 1
1478 1 38 LYS H 1 38 LYS HE3 5.500 . 5.956 4.966 4.674 5.828 . 0 0 "[ . 1 . 2]" 1
1479 1 37 ARG HD3 1 38 LYS H 5.500 . 5.956 5.784 5.470 5.932 . 0 0 "[ . 1 . 2]" 1
1480 1 41 VAL MG1 1 45 VAL H 4.400 . 4.856 4.302 4.120 4.451 . 0 0 "[ . 1 . 2]" 1
1481 1 44 ALA H 1 45 VAL H 3.220 . 3.675 2.715 2.643 2.774 . 0 0 "[ . 1 . 2]" 1
1482 1 45 VAL H 1 46 ILE MG 5.500 . 5.956 5.816 5.503 5.910 . 0 0 "[ . 1 . 2]" 1
1483 1 42 VAL HA 1 45 VAL H 3.830 . 4.286 3.418 3.212 3.570 . 0 0 "[ . 1 . 2]" 1
1484 1 45 VAL H 1 50 ILE MD 4.170 . 4.626 3.708 3.513 3.943 . 0 0 "[ . 1 . 2]" 1
1485 1 44 ALA MB 1 45 VAL H 3.210 . 3.665 2.434 2.321 2.562 . 0 0 "[ . 1 . 2]" 1
1486 1 45 VAL H 1 45 VAL HB 2.980 . 3.435 2.549 2.453 2.598 . 0 0 "[ . 1 . 2]" 1
1487 1 45 VAL H 1 45 VAL MG2 2.890 . 3.345 2.078 2.022 2.160 . 0 0 "[ . 1 . 2]" 1
1488 1 45 VAL H 1 66 PHE QE 4.880 . 5.335 4.471 4.209 4.631 . 0 0 "[ . 1 . 2]" 1
1489 1 45 VAL H 1 46 ILE H 3.140 . 3.595 2.595 2.517 2.662 . 0 0 "[ . 1 . 2]" 1
1490 1 45 VAL H 1 50 ILE H 4.990 . 5.445 4.335 4.180 4.487 . 0 0 "[ . 1 . 2]" 1
1491 1 45 VAL H 1 50 ILE QG 4.610 . 5.065 3.238 2.993 3.410 . 0 0 "[ . 1 . 2]" 1
1492 1 45 VAL H 1 46 ILE HG13 4.620 . 5.076 4.322 4.132 4.827 . 0 0 "[ . 1 . 2]" 1
1493 1 45 VAL H 1 49 LEU HB3 4.970 . 5.425 4.688 4.607 4.765 . 0 0 "[ . 1 . 2]" 1
1494 1 45 VAL H 1 47 HIS H 4.280 . 4.735 4.128 4.011 4.286 . 0 0 "[ . 1 . 2]" 1
1495 1 64 GLU H 1 67 ALA MB 4.660 . 5.115 4.472 4.315 4.670 . 0 0 "[ . 1 . 2]" 1
1496 1 64 GLU H 1 64 GLU HG2 3.340 . 3.796 2.079 1.777 2.546 0.023 16 0 "[ . 1 . 2]" 1
1497 1 62 SER HB3 1 64 GLU H 3.440 . 3.895 3.108 2.995 3.420 . 0 0 "[ . 1 . 2]" 1
1498 1 63 GLU HB2 1 64 GLU H 3.610 . 4.065 3.513 2.516 3.826 . 0 0 "[ . 1 . 2]" 1
1499 1 63 GLU HB3 1 64 GLU H 3.850 . 4.306 2.761 2.360 3.632 . 0 0 "[ . 1 . 2]" 1
1500 1 63 GLU H 1 64 GLU H 3.050 . 3.506 2.714 2.590 2.870 . 0 0 "[ . 1 . 2]" 1
1501 1 64 GLU H 1 65 GLU H 3.070 . 3.526 2.663 2.508 2.800 . 0 0 "[ . 1 . 2]" 1
1502 1 62 SER HB2 1 64 GLU H 3.130 . 3.586 3.339 3.124 3.528 . 0 0 "[ . 1 . 2]" 1
1503 1 64 GLU H 1 65 GLU HB2 5.000 . 5.456 4.982 4.819 5.096 . 0 0 "[ . 1 . 2]" 1
1504 1 62 SER HA 1 64 GLU H 4.330 . 4.786 4.395 4.262 4.629 . 0 0 "[ . 1 . 2]" 1
1505 1 64 GLU H 1 64 GLU HB3 3.050 . 3.506 2.632 2.526 2.825 . 0 0 "[ . 1 . 2]" 1
1506 1 56 LEU MD2 1 64 GLU H 5.130 . 5.585 5.072 4.782 5.334 . 0 0 "[ . 1 . 2]" 1
1507 1 64 GLU H 1 64 GLU HG3 3.340 . 3.796 3.290 3.060 3.654 . 0 0 "[ . 1 . 2]" 1
1508 1 64 GLU H 1 67 ALA H 4.980 . 5.436 4.721 4.556 4.944 . 0 0 "[ . 1 . 2]" 1
1509 1 62 SER H 1 64 GLU H 4.760 . 5.215 5.154 4.907 5.266 0.051 7 0 "[ . 1 . 2]" 1
1510 1 13 THR H 1 13 THR MG 3.960 . 4.416 3.831 3.781 3.898 . 0 0 "[ . 1 . 2]" 1
1511 1 61 LEU H 1 61 LEU HG 3.290 . 3.746 2.750 2.400 3.128 . 0 0 "[ . 1 . 2]" 1
1512 1 61 LEU H 1 61 LEU HB2 3.360 . 3.816 2.559 2.371 2.685 . 0 0 "[ . 1 . 2]" 1
1513 1 56 LEU HB2 1 61 LEU H 4.500 . 4.956 4.754 4.490 5.006 0.051 9 0 "[ . 1 . 2]" 1
1514 1 56 LEU HB3 1 61 LEU H 4.520 . 4.976 3.673 3.428 4.022 . 0 0 "[ . 1 . 2]" 1
1515 1 59 TYR HB2 1 61 LEU H 4.530 . 4.985 3.758 3.136 4.368 . 0 0 "[ . 1 . 2]" 1
1516 1 12 VAL HB 1 13 THR H 2.940 . 3.395 2.408 1.963 2.776 . 0 0 "[ . 1 . 2]" 1
1517 1 12 VAL HA 1 13 THR H 2.630 . 3.086 2.406 2.254 2.633 . 0 0 "[ . 1 . 2]" 1
1518 1 12 VAL MG2 1 13 THR H 3.570 . 4.025 3.502 3.063 3.773 . 0 0 "[ . 1 . 2]" 1
1519 1 13 THR H 1 13 THR HB 2.960 . 3.415 2.654 2.566 2.742 . 0 0 "[ . 1 . 2]" 1
1520 1 12 VAL MG1 1 13 THR H 3.300 . 3.756 3.586 3.481 3.695 . 0 0 "[ . 1 . 2]" 1
1521 1 38 LYS HB3 1 40 ALA H 5.500 . 5.956 5.571 5.426 5.717 . 0 0 "[ . 1 . 2]" 1
1522 1 13 THR H 1 14 LEU H 4.480 . 4.936 4.500 4.425 4.558 . 0 0 "[ . 1 . 2]" 1
1523 1 40 ALA H 1 41 VAL HB 5.300 . 5.755 5.004 4.916 5.065 . 0 0 "[ . 1 . 2]" 1
1524 1 40 ALA H 1 42 VAL H 4.930 . 5.385 4.379 4.287 4.498 . 0 0 "[ . 1 . 2]" 1
1525 1 40 ALA H 1 41 VAL MG2 4.490 . 4.945 4.137 4.048 4.203 . 0 0 "[ . 1 . 2]" 1
1526 1 13 THR H 1 14 LEU MD2 4.820 . 5.275 4.600 4.396 4.907 . 0 0 "[ . 1 . 2]" 1
1527 1 39 ALA MB 1 40 ALA H 3.060 . 3.516 2.512 2.384 2.619 . 0 0 "[ . 1 . 2]" 1
1528 1 38 LYS HA 1 40 ALA H 4.520 . 4.976 4.433 4.260 4.623 . 0 0 "[ . 1 . 2]" 1
1529 1 26 PRO HD3 1 40 ALA H 5.010 . 5.465 4.887 4.686 5.124 . 0 0 "[ . 1 . 2]" 1
1530 1 40 ALA H 1 40 ALA MB 2.720 . 3.175 2.234 2.223 2.242 . 0 0 "[ . 1 . 2]" 1
1531 1 40 ALA H 1 43 LYS H 4.840 . 5.295 4.790 4.747 4.852 . 0 0 "[ . 1 . 2]" 1
1532 1 60 SER HA 1 61 LEU H 2.970 . 3.425 2.611 2.334 2.936 . 0 0 "[ . 1 . 2]" 1
1533 1 37 ARG HA 1 40 ALA H 3.730 . 4.186 3.349 3.103 3.501 . 0 0 "[ . 1 . 2]" 1
1534 1 61 LEU H 1 61 LEU MD1 4.130 . 4.585 3.856 3.638 4.098 . 0 0 "[ . 1 . 2]" 1
1535 1 61 LEU H 1 61 LEU HB3 3.780 . 4.235 3.699 3.583 3.798 . 0 0 "[ . 1 . 2]" 1
1536 1 56 LEU HA 1 61 LEU H 3.350 . 3.650 2.616 2.323 2.772 . 0 0 "[ . 1 . 2]" 1
1537 1 61 LEU H 1 61 LEU MD2 3.720 . 4.175 3.671 3.398 3.918 . 0 0 "[ . 1 . 2]" 1
1538 1 12 VAL H 1 13 THR H 4.550 . 5.005 4.449 4.383 4.501 . 0 0 "[ . 1 . 2]" 1
1539 1 13 THR H 1 14 LEU MD1 5.500 . 5.956 5.182 4.767 5.882 . 0 0 "[ . 1 . 2]" 1
1540 1 59 TYR H 1 61 LEU H 4.260 . 4.715 3.843 3.272 4.327 . 0 0 "[ . 1 . 2]" 1
1541 1 40 ALA H 1 42 VAL MG1 4.020 . 4.476 4.239 4.149 4.359 . 0 0 "[ . 1 . 2]" 1
1542 1 40 ALA H 1 43 LYS QE 5.030 . 5.485 5.202 4.677 5.492 0.006 5 0 "[ . 1 . 2]" 1
1543 1 58 ARG H 1 61 LEU H 5.000 . 5.456 5.364 4.961 5.508 0.053 5 0 "[ . 1 . 2]" 1
1544 1 25 LEU H 1 26 PRO HD3 5.220 . 5.675 5.037 4.869 5.261 . 0 0 "[ . 1 . 2]" 1
1545 1 68 LEU H 1 69 TRP HA 5.410 . 5.865 5.199 5.085 5.285 . 0 0 "[ . 1 . 2]" 1
1546 1 24 ASP QB 1 25 LEU H 3.840 . 4.295 3.133 2.939 3.367 . 0 0 "[ . 1 . 2]" 1
1547 1 23 ALA HA 1 25 LEU H 4.130 . 4.585 3.678 3.459 3.903 . 0 0 "[ . 1 . 2]" 1
1548 1 20 LEU MD1 1 25 LEU H 3.740 . 4.195 3.737 3.444 4.140 . 0 0 "[ . 1 . 2]" 1
1549 1 25 LEU H 1 25 LEU MD1 4.040 . 4.496 3.575 3.471 3.674 . 0 0 "[ . 1 . 2]" 1
1550 1 25 LEU H 1 25 LEU HB2 2.870 . 3.326 2.369 2.321 2.430 . 0 0 "[ . 1 . 2]" 1
1551 1 25 LEU H 1 25 LEU HG 3.250 . 3.705 2.472 2.364 2.623 . 0 0 "[ . 1 . 2]" 1
1552 1 25 LEU H 1 25 LEU HB3 3.580 . 4.036 3.563 3.543 3.575 . 0 0 "[ . 1 . 2]" 1
1553 1 24 ASP H 1 25 LEU H 3.050 . 3.506 2.281 2.117 2.418 . 0 0 "[ . 1 . 2]" 1
1554 1 25 LEU H 1 49 LEU MD2 4.530 . 4.985 4.365 4.051 4.736 . 0 0 "[ . 1 . 2]" 1
1555 1 22 ARG HA 1 25 LEU H 4.040 . 4.496 3.595 3.148 4.015 . 0 0 "[ . 1 . 2]" 1
1556 1 23 ALA MB 1 25 LEU H 4.660 . 5.115 4.453 4.327 4.612 . 0 0 "[ . 1 . 2]" 1
1557 1 44 ALA H 1 49 LEU MD2 4.420 . 4.876 4.523 4.412 4.617 . 0 0 "[ . 1 . 2]" 1
1558 1 54 GLU HA 1 58 ARG H 4.120 . 4.576 3.876 3.643 4.322 . 0 0 "[ . 1 . 2]" 1
1559 1 68 LEU H 1 68 LEU HB2 3.200 . 3.655 2.474 2.413 2.538 . 0 0 "[ . 1 . 2]" 1
1560 1 67 ALA MB 1 68 LEU H 3.100 . 3.556 2.563 2.449 2.727 . 0 0 "[ . 1 . 2]" 1
1561 1 65 GLU HG3 1 68 LEU H 5.500 . 5.956 5.209 5.031 5.316 . 0 0 "[ . 1 . 2]" 1
1562 1 25 LEU H 1 50 ILE MG 5.500 . 5.800 5.818 5.647 5.899 0.099 8 0 "[ . 1 . 2]" 1
1563 1 68 LEU H 1 68 LEU MD1 3.390 . 3.845 3.652 3.594 3.758 . 0 0 "[ . 1 . 2]" 1
1564 1 43 LYS HB3 1 44 ALA H 3.700 . 4.155 3.752 3.582 3.884 . 0 0 "[ . 1 . 2]" 1
1565 1 20 LEU MD2 1 44 ALA H 3.680 . 4.135 2.741 2.618 2.873 . 0 0 "[ . 1 . 2]" 1
1566 1 21 SER H 1 25 LEU H 5.500 . 5.956 5.075 4.424 5.460 . 0 0 "[ . 1 . 2]" 1
1567 1 20 LEU MD1 1 44 ALA H 4.490 . 4.945 4.577 4.433 4.713 . 0 0 "[ . 1 . 2]" 1
1568 1 44 ALA H 1 45 VAL MG2 5.130 . 5.585 4.133 4.018 4.204 . 0 0 "[ . 1 . 2]" 1
1569 1 65 GLU HA 1 68 LEU H 3.960 . 4.416 3.593 3.435 3.817 . 0 0 "[ . 1 . 2]" 1
1570 1 68 LEU H 1 68 LEU HG 3.090 . 3.546 2.335 2.195 2.451 . 0 0 "[ . 1 . 2]" 1
1571 1 68 LEU H 1 70 ARG QD 5.500 . 5.956 5.376 4.808 6.067 0.112 15 0 "[ . 1 . 2]" 1
1572 1 68 LEU H 1 70 ARG QG 4.770 . 5.226 4.404 4.162 4.631 . 0 0 "[ . 1 . 2]" 1
1573 1 68 LEU H 1 69 TRP H 3.050 . 3.506 2.580 2.447 2.676 . 0 0 "[ . 1 . 2]" 1
1574 1 43 LYS H 1 44 ALA H 3.180 . 3.635 2.581 2.523 2.635 . 0 0 "[ . 1 . 2]" 1
1575 1 43 LYS HB2 1 44 ALA H 3.490 . 3.945 2.875 2.702 3.053 . 0 0 "[ . 1 . 2]" 1
1576 1 44 ALA H 1 44 ALA MB 2.750 . 3.205 2.239 2.230 2.247 . 0 0 "[ . 1 . 2]" 1
1577 1 65 GLU H 1 68 LEU H 4.910 . 5.365 4.768 4.625 4.893 . 0 0 "[ . 1 . 2]" 1
1578 1 58 ARG H 1 58 ARG HG3 3.780 . 4.235 3.301 3.138 3.500 . 0 0 "[ . 1 . 2]" 1
1579 1 41 VAL HA 1 44 ALA H 3.860 . 4.315 3.642 3.466 3.758 . 0 0 "[ . 1 . 2]" 1
1580 1 63 GLU QG 1 67 ALA H 4.870 . 5.326 4.426 3.594 5.350 0.025 10 0 "[ . 1 . 2]" 1
1581 1 66 PHE HA 1 68 LEU H 4.680 . 5.135 4.181 4.057 4.328 . 0 0 "[ . 1 . 2]" 1
1582 1 58 ARG H 1 58 ARG HB3 3.190 . 3.645 2.617 2.532 2.794 . 0 0 "[ . 1 . 2]" 1
1583 1 58 ARG H 1 59 TYR H 3.340 . 3.796 2.621 2.380 2.717 . 0 0 "[ . 1 . 2]" 1
1584 1 43 LYS QG 1 44 ALA H 4.380 . 4.835 4.238 4.156 4.313 . 0 0 "[ . 1 . 2]" 1
1585 1 56 LEU MD2 1 67 ALA H 4.740 . 5.195 4.636 4.207 4.778 . 0 0 "[ . 1 . 2]" 1
1586 1 58 ARG H 1 58 ARG HB2 3.770 . 4.226 3.623 3.600 3.683 . 0 0 "[ . 1 . 2]" 1
1587 1 40 ALA HA 1 44 ALA H 4.320 . 4.775 4.221 4.118 4.338 . 0 0 "[ . 1 . 2]" 1
1588 1 57 ASP HB2 1 58 ARG H 3.390 . 3.690 3.450 2.389 3.754 0.064 18 0 "[ . 1 . 2]" 1
1589 1 67 ALA H 1 68 LEU MD1 5.100 . 5.556 5.427 5.327 5.510 . 0 0 "[ . 1 . 2]" 1
1590 1 65 GLU HB3 1 67 ALA H 4.770 . 5.226 4.664 4.503 4.788 . 0 0 "[ . 1 . 2]" 1
1591 1 67 ALA H 1 70 ARG QG 4.420 . 4.876 4.479 4.056 4.890 0.015 10 0 "[ . 1 . 2]" 1
1592 1 58 ARG H 1 58 ARG HD2 5.280 . 5.735 4.197 3.739 4.828 . 0 0 "[ . 1 . 2]" 1
1593 1 67 ALA H 1 69 TRP H 4.210 . 4.666 4.115 4.018 4.256 . 0 0 "[ . 1 . 2]" 1
1594 1 67 ALA H 1 67 ALA MB 2.620 . 3.076 2.237 2.228 2.247 . 0 0 "[ . 1 . 2]" 1
1595 1 67 ALA H 1 68 LEU H 3.020 . 3.476 2.702 2.618 2.768 . 0 0 "[ . 1 . 2]" 1
1596 1 66 PHE HB3 1 68 LEU H 5.440 . 5.896 5.130 4.988 5.200 . 0 0 "[ . 1 . 2]" 1
1597 1 66 PHE HB3 1 67 ALA H 3.360 . 3.816 2.777 2.608 2.835 . 0 0 "[ . 1 . 2]" 1
1598 1 67 ALA H 1 68 LEU HG 4.790 . 5.246 4.508 4.350 4.674 . 0 0 "[ . 1 . 2]" 1
1599 1 65 GLU H 1 67 ALA H 3.900 . 4.356 3.829 3.699 3.962 . 0 0 "[ . 1 . 2]" 1
1600 1 66 PHE HB2 1 67 ALA H 3.930 . 4.385 3.898 3.761 3.936 . 0 0 "[ . 1 . 2]" 1
1601 1 64 GLU HA 1 67 ALA H 4.100 . 4.556 3.603 3.276 4.171 . 0 0 "[ . 1 . 2]" 1
1602 1 41 VAL MG1 1 44 ALA H 4.680 . 5.135 4.665 4.584 4.733 . 0 0 "[ . 1 . 2]" 1
1603 1 44 ALA H 1 45 VAL HB 5.500 . 5.956 4.960 4.853 5.060 . 0 0 "[ . 1 . 2]" 1
1604 1 42 VAL HA 1 44 ALA H 4.700 . 5.155 4.124 4.031 4.264 . 0 0 "[ . 1 . 2]" 1
1605 1 41 VAL H 1 44 ALA H 4.650 . 5.106 4.717 4.617 4.788 . 0 0 "[ . 1 . 2]" 1
1606 1 89 TYR H 1 89 TYR HB2 3.080 . 3.536 2.511 2.293 2.631 . 0 0 "[ . 1 . 2]" 1
1607 1 87 GLN QG 1 89 TYR H 5.370 . 5.826 5.019 4.415 5.429 . 0 0 "[ . 1 . 2]" 1
1608 1 86 ILE MG 1 89 TYR H 4.290 . 4.746 4.220 3.878 4.457 . 0 0 "[ . 1 . 2]" 1
1609 1 58 ARG H 1 58 ARG HG2 3.580 . 4.036 2.133 1.913 2.383 . 0 0 "[ . 1 . 2]" 1
1610 1 57 ASP HB3 1 58 ARG H 3.930 . 4.385 2.636 2.264 3.741 . 0 0 "[ . 1 . 2]" 1
1611 1 56 LEU HA 1 58 ARG H 4.590 . 5.045 4.872 4.413 5.082 0.037 3 0 "[ . 1 . 2]" 1
1612 1 67 ALA H 1 70 ARG QD 4.720 . 5.175 4.469 3.852 5.264 0.088 15 0 "[ . 1 . 2]" 1
1613 1 66 PHE H 1 67 ALA H 2.840 . 3.296 2.658 2.617 2.722 . 0 0 "[ . 1 . 2]" 1
1614 1 89 TYR H 1 89 TYR HB3 3.810 . 4.266 3.632 3.554 3.717 . 0 0 "[ . 1 . 2]" 1
1615 1 89 TYR H 1 89 TYR HE2 5.500 . 5.956 5.201 4.702 5.950 . 0 0 "[ . 1 . 2]" 1
1616 1 89 TYR H 1 89 TYR HE1 5.500 . 5.956 5.351 4.931 6.007 0.051 17 0 "[ . 1 . 2]" 1
1617 1 89 TYR HA 1 91 GLN H 4.650 . 5.106 4.254 3.960 4.853 . 0 0 "[ . 1 . 2]" 1
1618 1 10 ARG H 1 49 LEU MD1 4.890 . 5.345 4.116 3.355 4.458 . 0 0 "[ . 1 . 2]" 1
1619 1 20 LEU HG 1 21 SER H 4.170 . 4.626 3.826 3.587 3.971 . 0 0 "[ . 1 . 2]" 1
1620 1 21 SER H 1 24 ASP QB 3.870 . 4.326 2.199 1.784 2.633 0.016 9 0 "[ . 1 . 2]" 1
1621 1 12 VAL MG2 1 21 SER H 5.390 . 5.845 4.983 4.872 5.088 . 0 0 "[ . 1 . 2]" 1
1622 1 20 LEU HA 1 21 SER H 2.880 . 3.336 2.170 2.115 2.220 . 0 0 "[ . 1 . 2]" 1
1623 1 20 LEU HB3 1 21 SER H 4.600 . 5.056 4.455 4.387 4.498 . 0 0 "[ . 1 . 2]" 1
1624 1 21 SER H 1 49 LEU MD2 4.590 . 5.045 4.115 3.764 4.298 . 0 0 "[ . 1 . 2]" 1
1625 1 10 ARG H 1 10 ARG HB3 3.690 . 4.146 3.452 2.132 4.111 . 0 0 "[ . 1 . 2]" 1
1626 1 10 ARG H 1 10 ARG QG 3.790 . 4.246 2.679 2.111 3.767 . 0 0 "[ . 1 . 2]" 1
1627 1 10 ARG H 1 11 GLN HG2 5.500 . 5.956 4.146 3.826 5.789 . 0 0 "[ . 1 . 2]" 1
1628 1 21 SER H 1 24 ASP HA 4.650 . 5.106 4.732 4.542 4.975 . 0 0 "[ . 1 . 2]" 1
1629 1 9 PRO HA 1 10 ARG H 2.980 . 3.435 2.318 2.135 3.076 . 0 0 "[ . 1 . 2]" 1
1630 1 9 PRO HB3 1 10 ARG H 4.310 . 4.766 3.483 2.898 4.634 . 0 0 "[ . 1 . 2]" 1
1631 1 91 GLN H 1 91 GLN QG 3.670 . 4.000 2.911 1.741 4.102 0.102 2 0 "[ . 1 . 2]" 1
1632 1 20 LEU HB2 1 21 SER H 4.390 . 4.845 4.407 4.239 4.517 . 0 0 "[ . 1 . 2]" 1
1633 1 90 ARG H 1 91 GLN H 3.510 . 3.966 2.426 2.084 2.734 . 0 0 "[ . 1 . 2]" 1
1634 1 21 SER H 1 49 LEU MD1 4.810 . 5.266 4.874 4.648 5.133 . 0 0 "[ . 1 . 2]" 1
1635 1 12 VAL H 1 21 SER H 4.860 . 5.315 4.627 4.525 4.726 . 0 0 "[ . 1 . 2]" 1
1636 1 10 ARG H 1 10 ARG HB2 3.690 . 4.146 2.643 2.259 3.660 . 0 0 "[ . 1 . 2]" 1
1637 1 9 PRO HB2 1 10 ARG H 3.860 . 4.315 3.487 2.672 4.182 . 0 0 "[ . 1 . 2]" 1
1638 1 90 ARG HB2 1 91 GLN H 4.730 . 5.186 2.984 2.371 4.135 . 0 0 "[ . 1 . 2]" 1
1639 1 90 ARG HB3 1 91 GLN H 4.730 . 5.186 3.830 3.467 4.094 . 0 0 "[ . 1 . 2]" 1
1640 1 93 HIS HA 1 94 HIS H 3.060 . 3.516 2.433 2.073 3.555 0.039 12 0 "[ . 1 . 2]" 1
1641 1 91 GLN H 1 92 LEU MD2 5.500 . 5.800 5.626 3.812 5.961 0.161 13 0 "[ . 1 . 2]" 1
1642 1 86 ILE MG 1 91 GLN H 5.400 . 5.900 5.680 4.998 5.976 0.076 18 0 "[ . 1 . 2]" 1
1643 1 90 ARG QG 1 91 GLN H 4.430 . 4.885 3.990 2.381 4.376 . 0 0 "[ . 1 . 2]" 1
1644 1 92 LEU MD2 1 94 HIS H 4.610 . 5.065 4.044 2.653 5.137 0.072 14 0 "[ . 1 . 2]" 1
1645 1 93 HIS QB 1 94 HIS H 3.940 . 4.396 3.459 2.056 4.056 . 0 0 "[ . 1 . 2]" 1
1646 1 90 ARG HA 1 91 GLN H 3.550 . 4.005 3.486 3.413 3.540 . 0 0 "[ . 1 . 2]" 1
1647 1 22 ARG QD 1 23 ALA H 5.350 . 5.806 5.341 4.951 5.664 . 0 0 "[ . 1 . 2]" 1
1648 1 80 ALA MB 1 81 LEU H 3.260 . 3.716 3.299 2.504 3.712 . 0 0 "[ . 1 . 2]" 1
1649 1 81 LEU H 1 81 LEU HB2 2.820 . 3.276 2.433 2.242 2.719 . 0 0 "[ . 1 . 2]" 1
1650 1 75 ALA H 1 75 ALA MB 2.620 . 3.076 2.331 2.254 2.559 . 0 0 "[ . 1 . 2]" 1
1651 1 78 GLU H 1 78 GLU HG2 3.660 . 4.115 2.232 1.776 3.137 0.024 10 0 "[ . 1 . 2]" 1
1652 1 80 ALA HA 1 81 LEU H 2.700 . 3.155 2.235 2.124 2.740 . 0 0 "[ . 1 . 2]" 1
1653 1 73 VAL MG1 1 75 ALA H 4.680 . 5.135 4.892 4.325 5.130 . 0 0 "[ . 1 . 2]" 1
1654 1 75 ALA H 1 76 HIS HA 5.010 . 5.465 4.802 4.208 5.113 . 0 0 "[ . 1 . 2]" 1
1655 1 81 LEU H 1 81 LEU MD1 3.810 . 4.266 2.373 2.047 2.802 . 0 0 "[ . 1 . 2]" 1
1656 1 81 LEU H 1 81 LEU HB3 3.880 . 4.335 3.640 3.526 3.812 . 0 0 "[ . 1 . 2]" 1
1657 1 81 LEU H 1 85 MET HB2 5.500 . 5.956 5.490 5.016 6.044 0.088 17 0 "[ . 1 . 2]" 1
1658 1 81 LEU H 1 85 MET HB3 5.500 . 5.956 5.738 5.181 6.062 0.107 12 0 "[ . 1 . 2]" 1
1659 1 81 LEU H 1 82 LYS H 3.600 . 3.900 3.748 3.154 4.035 0.135 16 0 "[ . 1 . 2]" 1
1660 1 22 ARG HB2 1 23 ALA H 3.900 . 4.356 3.278 2.943 3.510 . 0 0 "[ . 1 . 2]" 1
1661 1 22 ARG HB3 1 23 ALA H 4.400 . 4.856 4.064 3.778 4.222 . 0 0 "[ . 1 . 2]" 1
1662 1 78 GLU H 1 79 LYS QD 5.500 . 5.956 4.930 4.240 5.795 . 0 0 "[ . 1 . 2]" 1
1663 1 78 GLU H 1 78 GLU HB3 3.780 . 4.235 2.717 2.499 2.900 . 0 0 "[ . 1 . 2]" 1
1664 1 76 HIS HA 1 78 GLU H 5.500 . 5.956 4.167 2.801 5.963 0.008 9 0 "[ . 1 . 2]" 1
1665 1 78 GLU H 1 80 ALA H 4.630 . 5.085 4.471 4.063 5.114 0.029 9 0 "[ . 1 . 2]" 1
1666 1 31 ARG HA 1 31 ARG HE 4.790 . 5.246 3.680 2.379 4.738 . 0 0 "[ . 1 . 2]" 1
1667 1 23 ALA H 1 24 ASP H 3.400 . 3.855 2.270 2.121 2.449 . 0 0 "[ . 1 . 2]" 1
1668 1 73 VAL HA 1 75 ALA H 4.310 . 4.766 4.555 3.639 4.854 0.088 19 0 "[ . 1 . 2]" 1
1669 1 73 VAL H 1 75 ALA H 3.980 . 4.436 3.816 3.338 4.318 . 0 0 "[ . 1 . 2]" 1
1670 1 74 ALA H 1 75 ALA H 2.700 . 3.155 2.577 2.438 2.759 . 0 0 "[ . 1 . 2]" 1
1671 1 75 ALA H 1 76 HIS H 3.470 . 3.925 2.502 1.933 2.866 . 0 0 "[ . 1 . 2]" 1
1672 1 21 SER HB3 1 23 ALA H 4.210 . 4.666 3.864 2.895 4.303 . 0 0 "[ . 1 . 2]" 1
1673 1 22 ARG H 1 23 ALA H 3.600 . 4.056 2.555 2.481 2.648 . 0 0 "[ . 1 . 2]" 1
1674 1 23 ALA H 1 23 ALA MB 2.920 . 3.375 2.308 2.260 2.354 . 0 0 "[ . 1 . 2]" 1
1675 1 23 ALA H 1 49 LEU MD2 5.120 . 5.576 4.584 4.386 4.904 . 0 0 "[ . 1 . 2]" 1
1676 1 23 ALA H 1 24 ASP QB 4.760 . 5.215 4.125 3.881 4.287 . 0 0 "[ . 1 . 2]" 1
1677 1 21 SER HB2 1 23 ALA H 4.210 . 4.666 2.685 2.466 3.033 . 0 0 "[ . 1 . 2]" 1
1678 1 21 SER HA 1 23 ALA H 4.550 . 5.005 3.998 3.818 4.230 . 0 0 "[ . 1 . 2]" 1
1679 1 23 ALA H 1 25 LEU H 4.690 . 5.146 3.939 3.714 4.088 . 0 0 "[ . 1 . 2]" 1
1680 1 82 LYS HA 1 83 VAL H 2.740 . 3.195 2.384 2.294 2.505 . 0 0 "[ . 1 . 2]" 1
1681 1 83 VAL H 1 83 VAL MG1 2.970 . 3.425 2.152 2.107 2.207 . 0 0 "[ . 1 . 2]" 1
1682 1 83 VAL H 1 83 VAL HB 2.980 . 3.435 2.497 2.431 2.524 . 0 0 "[ . 1 . 2]" 1
1683 1 83 VAL H 1 86 ILE MD 3.860 . 4.160 3.702 3.036 4.098 . 0 0 "[ . 1 . 2]" 1
1684 1 82 LYS HB3 1 83 VAL H 3.700 . 4.155 3.694 3.172 3.983 . 0 0 "[ . 1 . 2]" 1
1685 1 82 LYS QE 1 83 VAL H 4.210 . 4.666 3.925 2.867 4.518 . 0 0 "[ . 1 . 2]" 1
1686 1 83 VAL H 1 85 MET H 4.110 . 4.565 4.150 3.961 4.412 . 0 0 "[ . 1 . 2]" 1
1687 1 46 ILE H 1 46 ILE HG12 3.980 . 4.436 3.509 3.354 3.880 . 0 0 "[ . 1 . 2]" 1
1688 1 46 ILE H 1 46 ILE HG13 3.350 . 3.806 2.258 2.095 2.719 . 0 0 "[ . 1 . 2]" 1
1689 1 45 VAL HB 1 46 ILE H 3.490 . 3.945 2.582 2.469 2.811 . 0 0 "[ . 1 . 2]" 1
1690 1 46 ILE H 1 46 ILE HB 3.220 . 3.675 2.426 2.155 2.512 . 0 0 "[ . 1 . 2]" 1
1691 1 45 VAL MG2 1 46 ILE H 3.790 . 4.246 3.772 3.706 3.888 . 0 0 "[ . 1 . 2]" 1
1692 1 43 LYS HA 1 46 ILE H 3.980 . 4.436 3.328 3.168 3.471 . 0 0 "[ . 1 . 2]" 1
1693 1 45 VAL MG1 1 46 ILE H 3.980 . 4.436 3.467 3.303 3.611 . 0 0 "[ . 1 . 2]" 1
1694 1 44 ALA H 1 46 ILE H 4.270 . 4.726 4.067 3.864 4.237 . 0 0 "[ . 1 . 2]" 1
1695 1 83 VAL H 1 83 VAL MG2 4.120 . 4.576 3.769 3.749 3.780 . 0 0 "[ . 1 . 2]" 1
1696 1 90 ARG H 1 90 ARG HB3 4.160 . 4.615 3.522 2.554 3.742 . 0 0 "[ . 1 . 2]" 1
1697 1 86 ILE MG 1 88 LYS H 4.880 . 5.335 4.859 4.711 5.006 . 0 0 "[ . 1 . 2]" 1
1698 1 79 LYS H 1 79 LYS HG2 4.080 . 4.536 2.765 1.796 3.762 0.004 2 0 "[ . 1 . 2]" 1
1699 1 65 GLU H 1 66 PHE HA 5.230 . 5.686 5.264 5.114 5.393 . 0 0 "[ . 1 . 2]" 1
1700 1 78 GLU HB3 1 79 LYS H 4.300 . 4.755 4.296 3.999 4.585 . 0 0 "[ . 1 . 2]" 1
1701 1 14 LEU H 1 19 VAL H 4.800 . 5.255 4.817 4.667 5.025 . 0 0 "[ . 1 . 2]" 1
1702 1 78 GLU HA 1 79 LYS H 3.380 . 3.836 3.291 2.850 3.478 . 0 0 "[ . 1 . 2]" 1
1703 1 78 GLU HG2 1 79 LYS H 5.210 . 5.666 3.321 2.591 4.258 . 0 0 "[ . 1 . 2]" 1
1704 1 88 LYS H 1 88 LYS HG3 4.110 . 4.565 2.959 2.071 3.904 . 0 0 "[ . 1 . 2]" 1
1705 1 19 VAL H 1 20 LEU H 4.520 . 4.976 4.384 4.300 4.473 . 0 0 "[ . 1 . 2]" 1
1706 1 92 LEU MD2 1 93 HIS H 3.930 . 4.385 3.029 2.122 4.357 . 0 0 "[ . 1 . 2]" 1
1707 1 85 MET HG3 1 86 ILE H 5.500 . 5.956 4.956 4.176 5.706 . 0 0 "[ . 1 . 2]" 1
1708 1 85 MET HG2 1 86 ILE H 5.500 . 5.956 5.103 4.521 5.572 . 0 0 "[ . 1 . 2]" 1
1709 1 14 LEU MD2 1 19 VAL H 4.740 . 4.940 3.267 3.211 3.314 . 0 0 "[ . 1 . 2]" 1
1710 1 79 LYS H 1 79 LYS QD 4.210 . 4.666 3.641 3.034 4.021 . 0 0 "[ . 1 . 2]" 1
1711 1 87 GLN QG 1 88 LYS H 4.550 . 5.005 3.514 2.295 4.085 . 0 0 "[ . 1 . 2]" 1
1712 1 89 TYR HB3 1 90 ARG H 4.060 . 4.516 3.899 3.058 4.281 . 0 0 "[ . 1 . 2]" 1
1713 1 19 VAL H 1 19 VAL MG1 4.030 . 4.485 3.840 3.807 3.861 . 0 0 "[ . 1 . 2]" 1
1714 1 14 LEU MD1 1 19 VAL H 5.450 . 5.905 5.963 5.923 6.028 0.122 20 0 "[ . 1 . 2]" 1
1715 1 18 THR HB 1 19 VAL H 2.980 . 3.435 3.241 2.693 3.502 0.066 9 0 "[ . 1 . 2]" 1
1716 1 19 VAL H 1 19 VAL HB 2.900 . 3.355 2.608 2.554 2.656 . 0 0 "[ . 1 . 2]" 1
1717 1 14 LEU HG 1 19 VAL H 5.160 . 5.615 5.503 5.155 5.663 0.048 4 0 "[ . 1 . 2]" 1
1718 1 79 LYS H 1 81 LEU MD1 5.020 . 5.476 4.285 2.965 5.229 . 0 0 "[ . 1 . 2]" 1
1719 1 79 LYS H 1 79 LYS HG3 4.080 . 4.536 2.919 2.056 3.970 . 0 0 "[ . 1 . 2]" 1
1720 1 78 GLU HB2 1 79 LYS H 4.460 . 4.916 4.180 3.836 4.422 . 0 0 "[ . 1 . 2]" 1
1721 1 79 LYS H 1 80 ALA H 3.090 . 3.546 2.448 2.125 2.953 . 0 0 "[ . 1 . 2]" 1
1722 1 62 SER HA 1 65 GLU H 4.470 . 4.925 4.565 4.426 4.758 . 0 0 "[ . 1 . 2]" 1
1723 1 86 ILE H 1 86 ILE HB 2.910 . 3.365 2.500 2.374 2.605 . 0 0 "[ . 1 . 2]" 1
1724 1 62 SER HB3 1 65 GLU H 4.270 . 4.726 3.846 3.505 4.292 . 0 0 "[ . 1 . 2]" 1
1725 1 88 LYS H 1 88 LYS HG2 4.110 . 4.565 2.986 2.064 3.895 . 0 0 "[ . 1 . 2]" 1
1726 1 88 LYS H 1 90 ARG QG 5.410 . 5.865 5.091 4.164 5.777 . 0 0 "[ . 1 . 2]" 1
1727 1 86 ILE HA 1 88 LYS H 4.320 . 4.775 4.149 3.907 4.411 . 0 0 "[ . 1 . 2]" 1
1728 1 85 MET HA 1 88 LYS H 4.530 . 4.985 3.373 3.024 3.651 . 0 0 "[ . 1 . 2]" 1
1729 1 88 LYS H 1 89 TYR H 3.380 . 3.836 2.576 2.360 2.836 . 0 0 "[ . 1 . 2]" 1
1730 1 61 LEU MD2 1 65 GLU H 5.500 . 5.956 5.558 5.111 5.751 . 0 0 "[ . 1 . 2]" 1
1731 1 90 ARG H 1 90 ARG HB2 4.160 . 4.615 2.577 2.328 3.641 . 0 0 "[ . 1 . 2]" 1
1732 1 89 TYR HB2 1 90 ARG H 3.770 . 4.226 2.938 2.392 3.363 . 0 0 "[ . 1 . 2]" 1
1733 1 63 GLU HA 1 65 GLU H 4.270 . 4.726 4.095 3.677 4.320 . 0 0 "[ . 1 . 2]" 1
1734 1 89 TYR HA 1 90 ARG H 3.530 . 3.986 3.466 3.338 3.549 . 0 0 "[ . 1 . 2]" 1
1735 1 65 GLU H 1 65 GLU HB3 2.870 . 3.326 2.478 2.381 2.604 . 0 0 "[ . 1 . 2]" 1
1736 1 62 SER HB2 1 65 GLU H 3.270 . 3.726 2.755 2.484 3.224 . 0 0 "[ . 1 . 2]" 1
1737 1 65 GLU H 1 65 GLU HB2 3.120 . 3.576 2.538 2.406 2.654 . 0 0 "[ . 1 . 2]" 1
1738 1 64 GLU HG2 1 65 GLU H 4.360 . 4.815 2.655 2.086 2.935 . 0 0 "[ . 1 . 2]" 1
1739 1 65 GLU H 1 66 PHE HB2 5.210 . 5.666 4.963 4.765 5.165 . 0 0 "[ . 1 . 2]" 1
1740 1 62 SER H 1 65 GLU H 4.080 . 4.536 3.683 3.331 3.844 . 0 0 "[ . 1 . 2]" 1
1741 1 86 ILE H 1 86 ILE HG12 4.020 . 4.476 3.922 3.658 4.069 . 0 0 "[ . 1 . 2]" 1
1742 1 65 GLU H 1 66 PHE HB3 4.870 . 5.326 4.927 4.703 5.144 . 0 0 "[ . 1 . 2]" 1
1743 1 18 THR H 1 19 VAL H 4.690 . 4.890 4.552 4.392 4.618 . 0 0 "[ . 1 . 2]" 1
1744 1 86 ILE H 1 86 ILE HG13 3.190 . 3.645 2.980 2.137 3.313 . 0 0 "[ . 1 . 2]" 1
1745 1 56 LEU MD2 1 65 GLU H 4.790 . 5.246 4.536 4.236 4.899 . 0 0 "[ . 1 . 2]" 1
1746 1 65 GLU H 1 68 LEU MD1 4.650 . 5.106 4.855 4.627 5.053 . 0 0 "[ . 1 . 2]" 1
1747 1 61 LEU HB3 1 65 GLU H 4.730 . 5.186 4.854 4.561 5.050 . 0 0 "[ . 1 . 2]" 1
1748 1 65 GLU H 1 67 ALA MB 4.530 . 4.985 4.457 4.347 4.578 . 0 0 "[ . 1 . 2]" 1
1749 1 64 GLU HB3 1 65 GLU H 4.140 . 4.595 4.070 3.980 4.206 . 0 0 "[ . 1 . 2]" 1
1750 1 64 GLU HG3 1 65 GLU H 4.410 . 4.865 2.686 2.112 4.039 . 0 0 "[ . 1 . 2]" 1
1751 1 82 LYS H 1 82 LYS HG3 4.790 . 5.246 4.486 4.338 4.599 . 0 0 "[ . 1 . 2]" 1
1752 1 85 MET HA 1 86 ILE H 3.510 . 3.966 3.475 3.317 3.531 . 0 0 "[ . 1 . 2]" 1
1753 1 86 ILE H 1 86 ILE MD 3.520 . 3.976 1.984 1.727 2.824 0.073 18 0 "[ . 1 . 2]" 1
1754 1 86 ILE H 1 86 ILE MG 4.100 . 4.556 3.776 3.742 3.798 . 0 0 "[ . 1 . 2]" 1
1755 1 86 ILE MG 1 90 ARG H 4.360 . 4.815 3.851 3.371 4.237 . 0 0 "[ . 1 . 2]" 1
1756 1 84 THR HA 1 86 ILE H 3.840 . 4.295 4.162 3.704 4.385 0.090 8 0 "[ . 1 . 2]" 1
1757 1 85 MET H 1 86 ILE H 3.170 . 3.625 2.425 2.114 2.681 . 0 0 "[ . 1 . 2]" 1
1758 1 81 LEU MD1 1 82 LYS H 4.750 . 5.206 4.620 4.367 4.805 . 0 0 "[ . 1 . 2]" 1
1759 1 81 LEU HB3 1 82 LYS H 4.320 . 4.775 4.130 3.818 4.286 . 0 0 "[ . 1 . 2]" 1
1760 1 82 LYS H 1 82 LYS HB3 3.050 . 3.506 2.549 2.330 2.799 . 0 0 "[ . 1 . 2]" 1
1761 1 81 LEU HA 1 82 LYS H 2.810 . 3.266 2.331 2.165 2.481 . 0 0 "[ . 1 . 2]" 1
1762 1 80 ALA MB 1 82 LYS H 4.400 . 4.856 3.719 3.118 4.777 . 0 0 "[ . 1 . 2]" 1
1763 1 82 LYS H 1 82 LYS HG2 4.790 . 5.246 4.497 4.346 4.715 . 0 0 "[ . 1 . 2]" 1
1764 1 82 LYS H 1 82 LYS HB2 3.230 . 3.685 2.542 2.337 2.796 . 0 0 "[ . 1 . 2]" 1
1765 1 51 THR HB 1 52 GLU H 4.010 . 4.465 3.766 3.663 3.918 . 0 0 "[ . 1 . 2]" 1
1766 1 45 VAL MG1 1 52 GLU H 3.400 . 3.855 2.496 2.301 2.792 . 0 0 "[ . 1 . 2]" 1
1767 1 50 ILE MD 1 52 GLU H 4.990 . 5.445 5.471 5.378 5.544 0.099 7 0 "[ . 1 . 2]" 1
1768 1 51 THR HA 1 55 ALA H 5.310 . 5.766 5.347 5.165 5.424 . 0 0 "[ . 1 . 2]" 1
1769 1 51 THR HA 1 52 GLU H 2.930 . 3.385 2.327 2.217 2.447 . 0 0 "[ . 1 . 2]" 1
1770 1 52 GLU H 1 52 GLU HB3 3.660 . 4.115 2.772 2.542 3.515 . 0 0 "[ . 1 . 2]" 1
1771 1 52 GLU H 1 52 GLU HG3 3.970 . 4.425 4.142 2.727 4.430 0.004 20 0 "[ . 1 . 2]" 1
1772 1 52 GLU H 1 52 GLU HB2 3.210 . 3.665 2.287 2.167 2.452 . 0 0 "[ . 1 . 2]" 1
1773 1 51 THR H 1 52 GLU H 4.560 . 5.016 4.535 4.450 4.572 . 0 0 "[ . 1 . 2]" 1
1774 1 55 ALA H 1 56 LEU H 2.990 . 3.445 2.691 2.644 2.813 . 0 0 "[ . 1 . 2]" 1
1775 1 54 GLU HB3 1 55 ALA H 3.370 . 3.826 2.530 2.417 2.754 . 0 0 "[ . 1 . 2]" 1
1776 1 55 ALA H 1 55 ALA MB 2.770 . 3.226 2.236 2.226 2.244 . 0 0 "[ . 1 . 2]" 1
1777 1 52 GLU HA 1 55 ALA H 3.830 . 4.286 3.473 3.278 3.656 . 0 0 "[ . 1 . 2]" 1
1778 1 52 GLU H 1 55 ALA H 5.180 . 5.635 4.895 4.779 4.963 . 0 0 "[ . 1 . 2]" 1
1779 1 50 ILE MD 1 55 ALA H 3.410 . 3.865 2.873 2.650 3.060 . 0 0 "[ . 1 . 2]" 1
1780 1 54 GLU HB2 1 55 ALA H 4.090 . 4.545 3.861 3.752 4.011 . 0 0 "[ . 1 . 2]" 1
1781 1 5 ARG HB3 1 6 VAL H 4.170 . 4.470 4.147 3.618 4.471 0.001 1 0 "[ . 1 . 2]" 1
1782 1 54 GLU H 1 55 ALA H 3.170 . 3.625 2.587 2.374 2.744 . 0 0 "[ . 1 . 2]" 1
1783 1 5 ARG HG2 1 6 VAL H 4.130 . 4.430 3.330 2.229 4.524 0.094 16 0 "[ . 1 . 2]" 1
1784 1 6 VAL H 1 6 VAL QG 3.030 . 3.486 2.149 1.957 2.413 . 0 0 "[ . 1 . 2]" 1
1785 1 45 VAL MG2 1 52 GLU H 4.240 . 4.695 3.634 3.432 3.891 . 0 0 "[ . 1 . 2]" 1
1786 1 5 ARG HA 1 6 VAL H 2.590 . 3.046 2.206 2.066 2.470 . 0 0 "[ . 1 . 2]" 1
1787 1 52 GLU H 1 53 ARG HB2 4.830 . 5.286 4.771 4.474 5.293 0.008 20 0 "[ . 1 . 2]" 1
1788 1 55 ALA H 1 56 LEU MD2 5.500 . 5.956 5.135 4.895 5.296 . 0 0 "[ . 1 . 2]" 1
1789 1 41 VAL MG1 1 55 ALA H 4.840 . 5.295 4.792 4.692 4.961 . 0 0 "[ . 1 . 2]" 1
1790 1 50 ILE QG 1 55 ALA H 5.210 . 5.666 4.137 4.006 4.313 . 0 0 "[ . 1 . 2]" 1
1791 1 55 ALA H 1 58 ARG HG2 5.500 . 5.956 4.324 4.095 4.475 . 0 0 "[ . 1 . 2]" 1
1792 1 55 ALA H 1 56 LEU HB2 5.280 . 5.735 4.941 4.814 5.156 . 0 0 "[ . 1 . 2]" 1
1793 1 54 GLU HG3 1 55 ALA H 4.890 . 5.345 3.984 3.168 4.925 . 0 0 "[ . 1 . 2]" 1
1794 1 54 GLU HG2 1 55 ALA H 4.890 . 5.345 4.070 3.598 4.657 . 0 0 "[ . 1 . 2]" 1
1795 1 55 ALA H 1 57 ASP HB2 5.500 . 5.956 5.648 5.199 5.972 0.017 3 0 "[ . 1 . 2]" 1
1796 1 55 ALA H 1 58 ARG H 4.800 . 5.255 4.843 4.735 5.058 . 0 0 "[ . 1 . 2]" 1
1797 1 51 THR H 1 55 ALA H 4.840 . 4.940 4.501 3.992 4.686 . 0 0 "[ . 1 . 2]" 1
1798 1 63 GLU H 1 65 GLU H 4.370 . 4.826 4.084 3.920 4.303 . 0 0 "[ . 1 . 2]" 1
1799 1 5 ARG HG3 1 6 VAL H 4.130 . 4.430 3.276 1.993 4.751 0.321 16 0 "[ . 1 . 2]" 1
1800 1 62 SER HB2 1 63 GLU H 3.510 . 3.966 3.570 3.334 3.730 . 0 0 "[ . 1 . 2]" 1
1801 1 56 LEU MD2 1 63 GLU H 4.130 . 4.585 3.730 3.417 4.073 . 0 0 "[ . 1 . 2]" 1
1802 1 63 GLU H 1 63 GLU HB2 2.820 . 3.276 2.297 2.160 2.415 . 0 0 "[ . 1 . 2]" 1
1803 1 63 GLU H 1 63 GLU QG 3.410 . 3.710 3.619 2.310 3.898 0.188 12 0 "[ . 1 . 2]" 1
1804 1 62 SER HA 1 63 GLU H 2.790 . 3.246 2.393 2.307 2.505 . 0 0 "[ . 1 . 2]" 1
1805 1 56 LEU MD1 1 63 GLU H 4.160 . 4.615 3.678 2.874 4.421 . 0 0 "[ . 1 . 2]" 1
1806 1 62 SER HB3 1 63 GLU H 3.240 . 3.695 2.558 2.372 2.728 . 0 0 "[ . 1 . 2]" 1
1807 1 62 SER H 1 63 GLU H 4.550 . 5.005 4.512 4.351 4.568 . 0 0 "[ . 1 . 2]" 1
1808 1 6 VAL H 1 6 VAL HB 3.060 . 3.516 2.638 2.535 3.309 . 0 0 "[ . 1 . 2]" 1
1809 1 68 LEU HG 1 69 TRP H 4.470 . 4.925 4.287 4.149 4.388 . 0 0 "[ . 1 . 2]" 1
1810 1 38 LYS HD3 1 69 TRP H 5.500 . 5.956 5.183 4.717 5.572 . 0 0 "[ . 1 . 2]" 1
1811 1 68 LEU HB2 1 69 TRP H 3.530 . 3.986 2.540 2.455 2.672 . 0 0 "[ . 1 . 2]" 1
1812 1 69 TRP H 1 70 ARG QG 4.650 . 5.106 4.182 3.843 4.535 . 0 0 "[ . 1 . 2]" 1
1813 1 82 LYS HB3 1 85 MET H 4.320 . 4.775 2.956 2.426 3.367 . 0 0 "[ . 1 . 2]" 1
1814 1 65 GLU HA 1 69 TRP H 4.630 . 5.085 4.480 4.353 4.548 . 0 0 "[ . 1 . 2]" 1
1815 1 69 TRP H 1 72 ALA H 4.800 . 5.255 4.750 4.642 4.876 . 0 0 "[ . 1 . 2]" 1
1816 1 68 LEU MD1 1 69 TRP H 4.320 . 4.775 4.456 4.346 4.585 . 0 0 "[ . 1 . 2]" 1
1817 1 91 GLN QG 1 92 LEU H 4.480 . 4.936 3.846 2.877 4.659 . 0 0 "[ . 1 . 2]" 1
1818 1 69 TRP H 1 69 TRP HB2 3.500 . 3.955 2.513 2.420 2.582 . 0 0 "[ . 1 . 2]" 1
1819 1 66 PHE HA 1 69 TRP H 3.570 . 4.025 3.130 3.028 3.255 . 0 0 "[ . 1 . 2]" 1
1820 1 69 TRP H 1 69 TRP HB3 3.650 . 4.106 3.614 3.597 3.628 . 0 0 "[ . 1 . 2]" 1
1821 1 69 TRP H 1 69 TRP HE1 4.590 . 5.045 4.421 4.305 4.641 . 0 0 "[ . 1 . 2]" 1
1822 1 68 LEU HB3 1 69 TRP H 3.840 . 4.295 3.586 3.442 3.692 . 0 0 "[ . 1 . 2]" 1
1823 1 47 HIS HB2 1 49 LEU H 5.090 . 5.545 3.284 3.022 3.766 . 0 0 "[ . 1 . 2]" 1
1824 1 49 LEU H 1 50 ILE H 3.210 . 3.665 2.540 2.215 2.846 . 0 0 "[ . 1 . 2]" 1
1825 1 84 THR MG 1 85 MET H 4.270 . 4.726 3.993 3.430 4.318 . 0 0 "[ . 1 . 2]" 1
1826 1 27 PRO HA 1 28 LEU H 3.130 . 3.586 2.272 2.146 2.380 . 0 0 "[ . 1 . 2]" 1
1827 1 27 PRO HB2 1 28 LEU H 3.940 . 4.396 2.999 2.613 3.473 . 0 0 "[ . 1 . 2]" 1
1828 1 44 ALA MB 1 49 LEU H 4.550 . 5.005 3.998 3.701 4.224 . 0 0 "[ . 1 . 2]" 1
1829 1 28 LEU H 1 28 LEU MD2 4.300 . 4.755 3.130 2.896 3.333 . 0 0 "[ . 1 . 2]" 1
1830 1 28 LEU H 1 28 LEU HB3 4.080 . 4.536 3.602 3.577 3.633 . 0 0 "[ . 1 . 2]" 1
1831 1 28 LEU H 1 28 LEU HG 3.070 . 3.526 2.203 2.085 2.361 . 0 0 "[ . 1 . 2]" 1
1832 1 49 LEU H 1 49 LEU MD2 4.310 . 4.766 4.242 4.210 4.289 . 0 0 "[ . 1 . 2]" 1
1833 1 49 LEU H 1 49 LEU HB2 3.270 . 3.726 2.578 2.460 2.715 . 0 0 "[ . 1 . 2]" 1
1834 1 28 LEU H 1 28 LEU MD1 4.210 . 4.666 3.647 3.532 3.745 . 0 0 "[ . 1 . 2]" 1
1835 1 12 VAL MG2 1 49 LEU H 3.520 . 3.976 3.445 3.237 3.810 . 0 0 "[ . 1 . 2]" 1
1836 1 49 LEU H 1 49 LEU HB3 3.200 . 3.655 2.465 2.406 2.554 . 0 0 "[ . 1 . 2]" 1
1837 1 27 PRO HB3 1 28 LEU H 4.020 . 4.476 3.544 3.108 3.774 . 0 0 "[ . 1 . 2]" 1
1838 1 85 MET H 1 85 MET HB2 3.170 . 3.625 2.353 2.208 2.583 . 0 0 "[ . 1 . 2]" 1
1839 1 91 GLN HA 1 92 LEU H 3.540 . 3.996 3.171 2.496 3.512 . 0 0 "[ . 1 . 2]" 1
1840 1 69 TRP H 1 71 SER H 4.740 . 5.195 4.019 3.806 4.140 . 0 0 "[ . 1 . 2]" 1
1841 1 47 HIS HB3 1 49 LEU H 5.340 . 5.795 4.148 3.912 4.650 . 0 0 "[ . 1 . 2]" 1
1842 1 69 TRP H 1 70 ARG HA 5.500 . 5.956 5.433 5.397 5.479 . 0 0 "[ . 1 . 2]" 1
1843 1 67 ALA HA 1 69 TRP H 4.620 . 5.076 4.502 4.354 4.582 . 0 0 "[ . 1 . 2]" 1
1844 1 66 PHE H 1 69 TRP H 4.980 . 5.436 4.745 4.649 4.806 . 0 0 "[ . 1 . 2]" 1
1845 1 49 LEU H 1 49 LEU HG 4.640 . 5.095 4.443 4.409 4.494 . 0 0 "[ . 1 . 2]" 1
1846 1 45 VAL HA 1 49 LEU H 4.590 . 5.045 3.866 3.585 4.300 . 0 0 "[ . 1 . 2]" 1
1847 1 47 HIS HA 1 49 LEU H 4.900 . 5.356 4.738 4.553 5.001 . 0 0 "[ . 1 . 2]" 1
1848 1 85 MET H 1 86 ILE HG13 4.910 . 5.365 4.930 4.252 5.428 0.062 10 0 "[ . 1 . 2]" 1
1849 1 84 THR HA 1 85 MET H 3.550 . 4.005 3.408 3.095 3.547 . 0 0 "[ . 1 . 2]" 1
1850 1 44 ALA HA 1 49 LEU H 3.650 . 4.106 3.581 3.285 3.771 . 0 0 "[ . 1 . 2]" 1
1851 1 91 GLN HB2 1 92 LEU H 5.050 . 5.505 4.130 3.019 4.585 . 0 0 "[ . 1 . 2]" 1
1852 1 91 GLN HB3 1 92 LEU H 5.050 . 5.505 3.984 2.718 4.586 . 0 0 "[ . 1 . 2]" 1
1853 1 89 TYR HA 1 92 LEU H 4.570 . 4.956 3.571 3.134 4.287 . 0 0 "[ . 1 . 2]" 1
1854 1 91 GLN H 1 92 LEU H 3.580 . 4.036 2.425 2.061 3.322 . 0 0 "[ . 1 . 2]" 1
1855 1 92 LEU H 1 92 LEU MD1 4.590 . 5.045 4.179 3.742 4.427 . 0 0 "[ . 1 . 2]" 1
1856 1 89 TYR HB2 1 92 LEU H 5.500 . 5.956 5.550 5.217 6.062 0.107 7 0 "[ . 1 . 2]" 1
1857 1 89 TYR HB3 1 92 LEU H 5.500 . 5.956 5.312 4.888 5.949 . 0 0 "[ . 1 . 2]" 1
1858 1 84 THR HB 1 85 MET H 3.490 . 3.945 3.083 2.215 3.902 . 0 0 "[ . 1 . 2]" 1
1859 1 10 ARG HA 1 22 ARG H 4.470 . 4.770 3.648 3.355 4.120 . 0 0 "[ . 1 . 2]" 1
1860 1 21 SER HB3 1 22 ARG H 4.080 . 4.536 3.587 2.564 3.854 . 0 0 "[ . 1 . 2]" 1
1861 1 22 ARG H 1 49 LEU MD2 3.860 . 4.315 3.344 3.137 3.629 . 0 0 "[ . 1 . 2]" 1
1862 1 22 ARG H 1 22 ARG HB2 3.040 . 3.496 2.423 2.307 2.649 . 0 0 "[ . 1 . 2]" 1
1863 1 22 ARG H 1 49 LEU MD1 3.690 . 4.146 2.814 2.606 3.105 . 0 0 "[ . 1 . 2]" 1
1864 1 21 SER HA 1 22 ARG H 3.050 . 3.506 2.467 2.402 2.535 . 0 0 "[ . 1 . 2]" 1
1865 1 22 ARG H 1 22 ARG QD 4.250 . 4.706 3.824 3.579 4.062 . 0 0 "[ . 1 . 2]" 1
1866 1 22 ARG H 1 24 ASP H 4.750 . 5.206 3.966 3.808 4.091 . 0 0 "[ . 1 . 2]" 1
1867 1 21 SER H 1 22 ARG H 4.620 . 5.076 4.536 4.503 4.568 . 0 0 "[ . 1 . 2]" 1
1868 1 82 LYS QD 1 85 MET H 5.300 . 5.755 4.631 3.756 5.656 . 0 0 "[ . 1 . 2]" 1
1869 1 82 LYS HB2 1 85 MET H 4.880 . 5.335 4.551 4.130 4.907 . 0 0 "[ . 1 . 2]" 1
1870 1 84 THR MG 1 87 GLN H 4.580 . 5.036 4.752 4.224 5.042 0.007 7 0 "[ . 1 . 2]" 1
1871 1 36 SER QB 1 37 ARG H 4.250 . 4.706 2.702 2.359 3.313 . 0 0 "[ . 1 . 2]" 1
1872 1 37 ARG H 1 37 ARG HD2 4.900 . 5.356 4.240 4.043 4.509 . 0 0 "[ . 1 . 2]" 1
1873 1 35 ALA MB 1 37 ARG H 5.500 . 5.956 4.572 4.423 4.685 . 0 0 "[ . 1 . 2]" 1
1874 1 37 ARG H 1 39 ALA MB 5.500 . 5.956 4.691 4.513 4.897 . 0 0 "[ . 1 . 2]" 1
1875 1 34 VAL H 1 37 ARG H 4.510 . 4.965 3.844 3.687 4.186 . 0 0 "[ . 1 . 2]" 1
1876 1 37 ARG H 1 37 ARG HG3 3.440 . 3.895 2.423 2.182 2.652 . 0 0 "[ . 1 . 2]" 1
1877 1 36 SER H 1 37 ARG H 4.620 . 5.076 2.756 2.680 2.824 . 0 0 "[ . 1 . 2]" 1
1878 1 37 ARG H 1 37 ARG HB2 3.250 . 3.705 2.457 2.328 2.541 . 0 0 "[ . 1 . 2]" 1
1879 1 87 GLN H 1 87 GLN HB2 3.620 . 4.076 2.625 2.390 3.622 . 0 0 "[ . 1 . 2]" 1
1880 1 87 GLN H 1 87 GLN HB3 3.620 . 4.076 2.545 2.348 2.724 . 0 0 "[ . 1 . 2]" 1
1881 1 86 ILE HB 1 87 GLN H 3.670 . 4.126 2.786 2.571 3.133 . 0 0 "[ . 1 . 2]" 1
1882 1 37 ARG H 1 38 LYS HB2 5.150 . 5.606 4.611 4.450 4.744 . 0 0 "[ . 1 . 2]" 1
1883 1 86 ILE H 1 87 GLN H 3.690 . 4.146 2.659 2.436 2.849 . 0 0 "[ . 1 . 2]" 1
1884 1 86 ILE MG 1 87 GLN H 3.730 . 4.186 3.427 3.281 3.672 . 0 0 "[ . 1 . 2]" 1
1885 1 37 ARG H 1 37 ARG HD3 5.210 . 5.666 4.902 4.780 5.008 . 0 0 "[ . 1 . 2]" 1
1886 1 87 GLN H 1 90 ARG QG 4.720 . 5.175 4.572 3.731 5.159 . 0 0 "[ . 1 . 2]" 1
1887 1 85 MET HA 1 87 GLN H 5.130 . 5.585 4.154 3.696 4.528 . 0 0 "[ . 1 . 2]" 1
1888 1 77 GLY HA2 1 80 ALA H 5.500 . 5.956 4.235 3.682 5.528 . 0 0 "[ . 1 . 2]" 1
1889 1 77 GLY HA3 1 80 ALA H 5.500 . 5.956 4.448 3.384 5.051 . 0 0 "[ . 1 . 2]" 1
1890 1 80 ALA H 1 81 LEU MD1 4.170 . 4.626 3.328 1.816 4.194 . 0 0 "[ . 1 . 2]" 1
1891 1 80 ALA H 1 80 ALA MB 2.970 . 3.425 2.623 2.317 2.905 . 0 0 "[ . 1 . 2]" 1
1892 1 79 LYS HG2 1 80 ALA H 4.860 . 5.315 4.381 2.910 5.298 . 0 0 "[ . 1 . 2]" 1
1893 1 46 ILE MD 1 74 ALA H 4.680 . 5.135 4.213 3.788 4.680 . 0 0 "[ . 1 . 2]" 1
1894 1 70 ARG HA 1 74 ALA H 4.040 . 4.496 2.905 2.231 3.695 . 0 0 "[ . 1 . 2]" 1
1895 1 73 VAL H 1 74 ALA H 2.980 . 3.435 2.541 2.362 2.742 . 0 0 "[ . 1 . 2]" 1
1896 1 74 ALA H 1 74 ALA MB 2.630 . 3.086 2.263 2.238 2.292 . 0 0 "[ . 1 . 2]" 1
1897 1 73 VAL HB 1 74 ALA H 3.140 . 3.595 2.433 2.106 2.782 . 0 0 "[ . 1 . 2]" 1
1898 1 42 VAL MG2 1 74 ALA H 4.100 . 4.556 3.949 3.570 4.603 0.047 13 0 "[ . 1 . 2]" 1
1899 1 73 VAL MG1 1 74 ALA H 4.230 . 4.686 3.251 2.950 3.548 . 0 0 "[ . 1 . 2]" 1
1900 1 72 ALA H 1 74 ALA H 4.060 . 4.516 4.206 3.943 4.438 . 0 0 "[ . 1 . 2]" 1
1901 1 70 ARG QG 1 72 ALA H 4.750 . 5.206 4.542 4.353 4.692 . 0 0 "[ . 1 . 2]" 1
1902 1 72 ALA H 1 75 ALA MB 5.160 . 5.615 4.632 4.207 5.246 . 0 0 "[ . 1 . 2]" 1
1903 1 70 ARG H 1 72 ALA H 3.960 . 4.416 4.093 3.845 4.301 . 0 0 "[ . 1 . 2]" 1
1904 1 70 ARG HB3 1 72 ALA H 5.500 . 5.956 5.776 5.471 5.988 0.033 18 0 "[ . 1 . 2]" 1
1905 1 69 TRP HA 1 72 ALA H 4.020 . 4.476 3.591 3.477 3.719 . 0 0 "[ . 1 . 2]" 1
1906 1 72 ALA H 1 72 ALA MB 2.620 . 3.076 2.280 2.242 2.319 . 0 0 "[ . 1 . 2]" 1
1907 1 71 SER H 1 72 ALA H 2.990 . 3.445 2.468 2.353 2.595 . 0 0 "[ . 1 . 2]" 1
1908 1 72 ALA H 1 73 VAL HA 5.060 . 5.516 5.083 4.976 5.267 . 0 0 "[ . 1 . 2]" 1
1909 1 72 ALA H 1 73 VAL HB 4.340 . 4.795 4.721 4.631 4.831 0.036 13 0 "[ . 1 . 2]" 1
1910 1 70 ARG HA 1 72 ALA H 4.410 . 4.865 4.116 3.660 4.431 . 0 0 "[ . 1 . 2]" 1
1911 1 72 ALA H 1 73 VAL MG2 4.200 . 4.655 3.927 3.789 4.123 . 0 0 "[ . 1 . 2]" 1
1912 1 7 ASP H 1 7 ASP HB2 3.580 . 4.036 2.876 2.344 3.691 . 0 0 "[ . 1 . 2]" 1
1913 1 7 ASP H 1 7 ASP HB3 3.580 . 4.036 2.821 2.420 3.789 . 0 0 "[ . 1 . 2]" 1
1914 1 7 ASP H 1 8 GLY H 4.020 . 4.476 3.504 2.137 4.572 0.096 3 0 "[ . 1 . 2]" 1
1915 1 38 LYS HB3 1 69 TRP HE1 5.500 . 5.956 5.071 4.656 5.397 . 0 0 "[ . 1 . 2]" 1
1916 1 65 GLU HB2 1 69 TRP HE1 5.020 . 5.476 4.850 4.682 5.058 . 0 0 "[ . 1 . 2]" 1
1917 1 38 LYS HE3 1 69 TRP HE1 5.490 . 5.945 4.516 4.325 4.997 . 0 0 "[ . 1 . 2]" 1
1918 1 61 LEU MD1 1 69 TRP HE1 5.140 . 5.595 4.570 4.220 4.837 . 0 0 "[ . 1 . 2]" 1
1919 1 65 GLU HG2 1 69 TRP HE1 3.780 . 4.235 3.462 3.100 3.751 . 0 0 "[ . 1 . 2]" 1
1920 1 65 GLU HG3 1 69 TRP HE1 3.380 . 3.836 2.345 2.091 2.550 . 0 0 "[ . 1 . 2]" 1
1921 1 38 LYS HD3 1 69 TRP HE1 3.840 . 4.295 3.347 2.741 3.690 . 0 0 "[ . 1 . 2]" 1
1922 1 69 TRP HA 1 69 TRP HE1 4.990 . 5.445 4.881 4.809 4.938 . 0 0 "[ . 1 . 2]" 1
1923 1 38 LYS HD2 1 69 TRP HE1 5.230 . 5.686 4.839 4.258 5.146 . 0 0 "[ . 1 . 2]" 1
1924 1 68 LEU MD1 1 69 TRP HE1 4.550 . 5.005 4.620 4.346 5.017 0.011 19 0 "[ . 1 . 2]" 1
1925 1 65 GLU HA 1 69 TRP HE1 5.230 . 5.686 4.187 3.925 4.486 . 0 0 "[ . 1 . 2]" 1
1926 1 33 TRP HE1 1 61 LEU HG 5.500 . 5.956 4.751 3.716 5.593 . 0 0 "[ . 1 . 2]" 1
1927 1 33 TRP HE1 1 59 TYR HB3 3.890 . 4.345 3.701 3.198 4.219 . 0 0 "[ . 1 . 2]" 1
1928 1 30 THR MG 1 33 TRP HE1 3.970 . 4.425 3.986 3.311 4.425 . 0 0 "[ . 1 . 2]" 1
1929 1 33 TRP HE1 1 61 LEU MD2 4.120 . 4.576 2.836 2.075 3.216 . 0 0 "[ . 1 . 2]" 1
1930 1 33 TRP HE1 1 59 TYR HB2 5.500 . 5.956 5.235 4.560 5.785 . 0 0 "[ . 1 . 2]" 1
1931 1 33 TRP HB2 1 33 TRP HE1 5.000 . 5.456 4.780 4.764 4.804 . 0 0 "[ . 1 . 2]" 1
1932 1 33 TRP H 1 33 TRP HE1 5.370 . 5.826 4.964 4.720 5.378 . 0 0 "[ . 1 . 2]" 1
1933 1 33 TRP HB3 1 33 TRP HE1 5.220 . 5.675 5.222 5.199 5.247 . 0 0 "[ . 1 . 2]" 1
1934 1 33 TRP H 1 33 TRP HB2 4.040 . 4.496 2.448 2.284 3.532 . 0 0 "[ . 1 . 2]" 1
1935 1 32 ARG HA 1 33 TRP H 3.500 . 3.955 2.418 2.241 3.556 . 0 0 "[ . 1 . 2]" 1
1936 1 14 LEU H 1 14 LEU HG 4.110 . 4.565 4.109 3.855 4.212 . 0 0 "[ . 1 . 2]" 1
1937 1 14 LEU H 1 15 PRO HD2 4.890 . 5.345 5.061 4.746 5.273 . 0 0 "[ . 1 . 2]" 1
1938 1 12 VAL MG2 1 14 LEU H 4.910 . 5.365 4.751 4.410 4.949 . 0 0 "[ . 1 . 2]" 1
1939 1 14 LEU H 1 18 THR HB 4.290 . 4.746 3.959 3.588 4.376 . 0 0 "[ . 1 . 2]" 1
1940 1 14 LEU H 1 14 LEU HB2 3.240 . 3.695 2.411 2.360 2.452 . 0 0 "[ . 1 . 2]" 1
1941 1 14 LEU H 1 14 LEU HB3 3.670 . 4.126 3.623 3.578 3.654 . 0 0 "[ . 1 . 2]" 1
1942 1 13 THR HA 1 14 LEU H 2.850 . 3.306 2.195 2.135 2.262 . 0 0 "[ . 1 . 2]" 1
1943 1 13 THR HB 1 14 LEU H 4.520 . 4.976 3.951 3.792 4.203 . 0 0 "[ . 1 . 2]" 1
1944 1 14 LEU H 1 19 VAL MG2 4.280 . 4.735 4.418 4.090 4.684 . 0 0 "[ . 1 . 2]" 1
1945 1 14 LEU H 1 19 VAL HA 3.330 . 3.786 3.340 3.197 3.526 . 0 0 "[ . 1 . 2]" 1
1946 1 14 LEU H 1 20 LEU H 4.220 . 4.675 4.166 3.791 4.393 . 0 0 "[ . 1 . 2]" 1
1947 1 20 LEU H 1 21 SER H 4.630 . 5.085 4.067 3.934 4.223 . 0 0 "[ . 1 . 2]" 1
1948 1 18 THR HB 1 20 LEU H 5.500 . 5.956 5.249 4.804 5.802 . 0 0 "[ . 1 . 2]" 1
1949 1 12 VAL HB 1 20 LEU H 5.500 . 5.956 5.092 4.910 5.233 . 0 0 "[ . 1 . 2]" 1
1950 1 19 VAL MG2 1 20 LEU H 4.060 . 4.516 3.999 3.883 4.101 . 0 0 "[ . 1 . 2]" 1
1951 1 19 VAL HB 1 20 LEU H 4.390 . 4.845 4.149 4.039 4.229 . 0 0 "[ . 1 . 2]" 1
1952 1 20 LEU H 1 20 LEU HG 4.300 . 4.755 4.361 4.277 4.452 . 0 0 "[ . 1 . 2]" 1
1953 1 20 LEU H 1 20 LEU HB3 3.460 . 3.915 2.519 2.432 2.636 . 0 0 "[ . 1 . 2]" 1
1954 1 19 VAL HA 1 20 LEU H 2.890 . 3.345 2.155 2.128 2.204 . 0 0 "[ . 1 . 2]" 1
1955 1 19 VAL MG1 1 20 LEU H 3.240 . 3.695 2.617 2.426 2.759 . 0 0 "[ . 1 . 2]" 1
1956 1 12 VAL H 1 20 LEU H 3.400 . 3.855 3.076 2.855 3.351 . 0 0 "[ . 1 . 2]" 1
1957 1 20 LEU H 1 20 LEU HB2 3.490 . 3.945 3.101 2.961 3.207 . 0 0 "[ . 1 . 2]" 1
1958 1 11 GLN HA 1 20 LEU H 4.900 . 5.100 4.635 4.440 4.894 . 0 0 "[ . 1 . 2]" 1
1959 1 14 LEU MD2 1 20 LEU H 4.590 . 4.890 2.624 2.361 2.851 . 0 0 "[ . 1 . 2]" 1
1960 1 14 LEU MD1 1 20 LEU H 4.550 . 4.850 4.460 4.155 4.769 . 0 0 "[ . 1 . 2]" 1
1961 1 13 THR MG 1 20 LEU H 5.380 . 5.835 5.005 4.730 5.261 . 0 0 "[ . 1 . 2]" 1
1962 1 12 VAL HA 1 20 LEU H 4.950 . 5.405 4.783 4.661 4.993 . 0 0 "[ . 1 . 2]" 1
1963 1 13 THR H 1 20 LEU H 5.170 . 5.626 4.860 4.630 5.027 . 0 0 "[ . 1 . 2]" 1
1964 1 61 LEU MD1 1 69 TRP HZ2 4.290 . 4.746 3.230 2.966 3.610 . 0 0 "[ . 1 . 2]" 1
1965 1 61 LEU MD2 1 69 TRP HZ2 3.390 . 3.845 2.713 2.430 3.080 . 0 0 "[ . 1 . 2]" 1
1966 1 38 LYS HE2 1 69 TRP HZ2 4.330 . 4.786 2.993 2.556 4.596 . 0 0 "[ . 1 . 2]" 1
1967 1 65 GLU HG2 1 69 TRP HZ2 4.610 . 5.065 3.558 3.195 3.900 . 0 0 "[ . 1 . 2]" 1
1968 1 33 TRP HZ2 1 41 VAL MG2 4.230 . 4.686 4.227 3.940 4.458 . 0 0 "[ . 1 . 2]" 1
1969 1 30 THR MG 1 33 TRP HZ2 4.200 . 4.655 4.070 2.898 4.678 0.023 9 0 "[ . 1 . 2]" 1
1970 1 33 TRP HZ2 1 59 TYR HE1 4.520 . 4.976 4.178 3.482 4.713 . 0 0 "[ . 1 . 2]" 1
1971 1 33 TRP HZ2 1 59 TYR HB2 3.730 . 4.186 3.616 3.099 4.134 . 0 0 "[ . 1 . 2]" 1
1972 1 33 TRP HZ2 1 61 LEU MD2 4.710 . 5.166 3.526 2.953 4.043 . 0 0 "[ . 1 . 2]" 1
1973 1 33 TRP HZ2 1 59 TYR HB3 3.180 . 3.635 2.104 1.766 2.639 0.034 18 0 "[ . 1 . 2]" 1
1974 1 33 TRP HZ2 1 69 TRP HH2 4.220 . 4.675 3.507 3.222 3.950 . 0 0 "[ . 1 . 2]" 1
1975 1 33 TRP HZ2 1 61 LEU MD1 4.410 . 4.865 3.565 2.776 4.442 . 0 0 "[ . 1 . 2]" 1
1976 1 26 PRO HB2 1 33 TRP HZ2 5.470 . 5.925 5.163 4.797 5.508 . 0 0 "[ . 1 . 2]" 1
1977 1 86 ILE HA 1 89 TYR HE2 4.040 . 4.240 3.721 3.273 4.264 0.024 1 0 "[ . 1 . 2]" 1
1978 1 55 ALA HA 1 59 TYR HE2 3.590 . 4.045 3.176 2.874 3.455 . 0 0 "[ . 1 . 2]" 1
1979 1 28 LEU HA 1 59 TYR HE1 3.220 . 3.675 2.912 2.195 3.670 . 0 0 "[ . 1 . 2]" 1
1980 1 26 PRO HB2 1 59 TYR HE1 3.770 . 4.226 3.873 3.238 4.245 0.020 3 0 "[ . 1 . 2]" 1
1981 1 25 LEU HB3 1 59 TYR HE2 4.040 . 4.496 4.107 3.739 4.471 . 0 0 "[ . 1 . 2]" 1
1982 1 81 LEU MD1 1 89 TYR HE2 3.170 . 4.170 3.597 2.895 4.157 . 0 0 "[ . 1 . 2]" 1
1983 1 58 ARG HG2 1 59 TYR HE2 3.770 . 4.226 4.054 3.897 4.227 0.002 17 0 "[ . 1 . 2]" 1
1984 1 27 PRO HA 1 59 TYR HE1 4.200 . 4.655 4.207 4.033 4.523 . 0 0 "[ . 1 . 2]" 1
1985 1 81 LEU HB3 1 89 TYR HE2 3.920 . 4.420 3.741 2.974 4.454 0.034 19 0 "[ . 1 . 2]" 1
1986 1 28 LEU MD2 1 59 TYR HE1 3.370 . 3.670 2.368 2.159 2.562 . 0 0 "[ . 1 . 2]" 1
1987 1 25 LEU MD2 1 59 TYR HE2 3.430 . 3.885 3.194 2.789 3.697 . 0 0 "[ . 1 . 2]" 1
1988 1 41 VAL MG1 1 59 TYR HE2 3.520 . 3.976 2.387 2.059 2.740 . 0 0 "[ . 1 . 2]" 1
1989 1 41 VAL MG2 1 59 TYR HE2 3.460 . 3.915 2.636 2.339 2.837 . 0 0 "[ . 1 . 2]" 1
1990 1 85 MET HB3 1 89 TYR HE2 3.680 . 3.980 2.850 2.108 3.912 . 0 0 "[ . 1 . 2]" 1
1991 1 26 PRO HD2 1 59 TYR HE2 3.820 . 4.275 4.289 4.236 4.311 0.036 7 0 "[ . 1 . 2]" 1
1992 1 41 VAL HB 1 69 TRP HE3 3.850 . 4.306 2.656 2.381 2.827 . 0 0 "[ . 1 . 2]" 1
1993 1 38 LYS HA 1 69 TRP HE3 3.960 . 4.416 3.188 2.857 3.489 . 0 0 "[ . 1 . 2]" 1
1994 1 38 LYS HB3 1 69 TRP HE3 3.920 . 4.376 3.333 3.230 3.508 . 0 0 "[ . 1 . 2]" 1
1995 1 41 VAL MG2 1 69 TRP HE3 4.310 . 4.766 3.955 3.651 4.153 . 0 0 "[ . 1 . 2]" 1
1996 1 42 VAL H 1 69 TRP HE3 3.900 . 4.356 3.279 3.136 3.485 . 0 0 "[ . 1 . 2]" 1
1997 1 69 TRP HB2 1 69 TRP HE3 3.520 . 3.976 3.299 3.116 3.420 . 0 0 "[ . 1 . 2]" 1
1998 1 69 TRP HA 1 69 TRP HE3 5.000 . 5.456 4.867 4.755 5.005 . 0 0 "[ . 1 . 2]" 1
1999 1 69 TRP HB3 1 69 TRP HE3 3.690 . 4.146 2.627 2.545 2.752 . 0 0 "[ . 1 . 2]" 1
2000 1 41 VAL MG1 1 69 TRP HE3 3.910 . 4.365 3.284 3.118 3.430 . 0 0 "[ . 1 . 2]" 1
2001 1 61 LEU MD1 1 69 TRP HE3 4.780 . 5.235 4.108 3.684 4.514 . 0 0 "[ . 1 . 2]" 1
2002 1 33 TRP HE3 1 34 VAL MG2 4.750 . 5.206 4.455 4.158 4.675 . 0 0 "[ . 1 . 2]" 1
2003 1 33 TRP HE3 1 38 LYS H 4.150 . 4.606 3.225 3.060 3.469 . 0 0 "[ . 1 . 2]" 1
2004 1 33 TRP HE3 1 37 ARG HG3 4.640 . 5.095 4.866 4.542 5.093 . 0 0 "[ . 1 . 2]" 1
2005 1 33 TRP HE3 1 37 ARG HD3 5.000 . 5.456 4.457 3.883 4.935 . 0 0 "[ . 1 . 2]" 1
2006 1 33 TRP HE3 1 37 ARG HB2 3.900 . 4.356 2.517 2.202 2.857 . 0 0 "[ . 1 . 2]" 1
2007 1 33 TRP HE3 1 38 LYS HB3 5.090 . 5.545 4.944 4.743 5.120 . 0 0 "[ . 1 . 2]" 1
2008 1 33 TRP HE3 1 38 LYS HA 4.480 . 4.936 3.238 3.021 3.519 . 0 0 "[ . 1 . 2]" 1
2009 1 33 TRP HE3 1 38 LYS QG 4.410 . 4.865 2.695 2.505 2.866 . 0 0 "[ . 1 . 2]" 1
2010 1 33 TRP HA 1 33 TRP HE3 3.930 . 4.385 2.972 2.647 3.335 . 0 0 "[ . 1 . 2]" 1
2011 1 33 TRP HB3 1 33 TRP HE3 4.050 . 4.505 2.624 2.495 2.748 . 0 0 "[ . 1 . 2]" 1
2012 1 76 HIS HA 1 76 HIS HD2 4.730 . 5.186 3.572 2.199 4.761 . 0 0 "[ . 1 . 2]" 1
2013 1 61 LEU MD1 1 69 TRP HZ3 4.250 . 4.706 3.164 2.824 3.363 . 0 0 "[ . 1 . 2]" 1
2014 1 41 VAL H 1 69 TRP HZ3 4.410 . 4.865 4.078 3.790 4.287 . 0 0 "[ . 1 . 2]" 1
2015 1 61 LEU MD2 1 69 TRP HZ3 4.770 . 5.226 4.767 4.059 5.234 0.009 15 0 "[ . 1 . 2]" 1
2016 1 41 VAL HB 1 69 TRP HZ3 3.500 . 3.955 2.004 1.777 2.243 0.023 2 0 "[ . 1 . 2]" 1
2017 1 38 LYS HA 1 69 TRP HZ3 3.830 . 4.286 2.720 2.501 2.996 . 0 0 "[ . 1 . 2]" 1
2018 1 38 LYS HB3 1 69 TRP HZ3 4.660 . 5.115 4.387 4.088 4.697 . 0 0 "[ . 1 . 2]" 1
2019 1 33 TRP HE3 1 69 TRP HZ3 4.340 . 4.795 4.409 4.114 4.690 . 0 0 "[ . 1 . 2]" 1
2020 1 33 TRP HZ3 1 69 TRP HZ3 4.310 . 4.766 3.684 3.434 3.873 . 0 0 "[ . 1 . 2]" 1
2021 1 42 VAL H 1 69 TRP HZ3 4.860 . 5.315 4.188 3.861 4.440 . 0 0 "[ . 1 . 2]" 1
2022 1 33 TRP HZ2 1 69 TRP HZ3 4.840 . 5.295 5.166 4.753 5.326 0.030 11 0 "[ . 1 . 2]" 1
2023 1 33 TRP HZ3 1 38 LYS HA 4.530 . 4.985 3.505 3.185 3.865 . 0 0 "[ . 1 . 2]" 1
2024 1 33 TRP HZ3 1 37 ARG HB3 4.100 . 4.556 2.477 2.240 2.711 . 0 0 "[ . 1 . 2]" 1
2025 1 26 PRO HG3 1 33 TRP HZ3 3.920 . 4.376 2.083 1.915 2.392 . 0 0 "[ . 1 . 2]" 1
2026 1 26 PRO HG2 1 33 TRP HZ3 3.870 . 4.326 2.642 2.327 2.970 . 0 0 "[ . 1 . 2]" 1
2027 1 33 TRP HZ3 1 38 LYS H 4.680 . 5.135 4.377 4.076 4.676 . 0 0 "[ . 1 . 2]" 1
2028 1 33 TRP HZ3 1 69 TRP HE3 5.310 . 5.766 5.776 5.524 5.819 0.053 9 0 "[ . 1 . 2]" 1
2029 1 15 PRO HD2 1 47 HIS HD2 5.500 . 5.956 5.081 4.664 5.494 . 0 0 "[ . 1 . 2]" 1
2030 1 30 THR MG 1 33 TRP HH2 5.150 . 5.606 4.212 3.087 4.863 . 0 0 "[ . 1 . 2]" 1
2031 1 47 HIS HA 1 47 HIS HD2 4.960 . 5.416 4.641 4.565 4.771 . 0 0 "[ . 1 . 2]" 1
2032 1 47 HIS HB2 1 47 HIS HD2 3.730 . 4.186 2.693 2.679 2.739 . 0 0 "[ . 1 . 2]" 1
2033 1 14 LEU MD2 1 47 HIS HD2 3.960 . 4.160 3.996 3.706 4.204 0.044 4 0 "[ . 1 . 2]" 1
2034 1 43 LYS H 1 47 HIS HD2 5.500 . 5.956 5.651 5.250 5.990 0.035 20 0 "[ . 1 . 2]" 1
2035 1 46 ILE H 1 47 HIS HD2 5.500 . 5.956 5.483 5.206 5.952 . 0 0 "[ . 1 . 2]" 1
2036 1 44 ALA HA 1 47 HIS HD2 3.650 . 4.106 3.887 3.658 4.121 0.016 9 0 "[ . 1 . 2]" 1
2037 1 43 LYS QD 1 47 HIS HD2 4.330 . 4.786 4.097 3.746 4.441 . 0 0 "[ . 1 . 2]" 1
2038 1 14 LEU MD1 1 47 HIS HD2 4.680 . 4.880 2.313 2.161 2.623 . 0 0 "[ . 1 . 2]" 1
2039 1 20 LEU HB3 1 47 HIS HD2 3.850 . 4.306 4.210 3.806 4.357 0.052 9 0 "[ . 1 . 2]" 1
2040 1 43 LYS HB3 1 47 HIS HD2 3.600 . 4.056 2.460 2.027 2.827 . 0 0 "[ . 1 . 2]" 1
2041 1 47 HIS H 1 47 HIS HD2 3.790 . 4.246 3.763 3.538 4.067 . 0 0 "[ . 1 . 2]" 1
2042 1 43 LYS HB2 1 47 HIS HD2 4.150 . 4.606 3.919 3.397 4.187 . 0 0 "[ . 1 . 2]" 1
2043 1 26 PRO HG2 1 33 TRP HH2 4.140 . 4.595 2.451 2.275 2.833 . 0 0 "[ . 1 . 2]" 1
2044 1 33 TRP HH2 1 41 VAL MG2 3.660 . 4.115 2.508 2.261 2.893 . 0 0 "[ . 1 . 2]" 1
2045 1 12 VAL MG1 1 47 HIS HD2 4.690 . 5.146 4.869 4.618 5.162 0.017 16 0 "[ . 1 . 2]" 1
2046 1 33 TRP HH2 1 59 TYR HE2 4.150 . 4.606 4.103 3.579 4.567 . 0 0 "[ . 1 . 2]" 1
2047 1 33 TRP HH2 1 59 TYR HE1 4.440 . 4.896 3.208 2.742 3.723 . 0 0 "[ . 1 . 2]" 1
2048 1 26 PRO HG3 1 33 TRP HH2 4.080 . 4.536 3.453 3.215 3.701 . 0 0 "[ . 1 . 2]" 1
2049 1 33 TRP HH2 1 41 VAL HB 5.260 . 5.715 5.051 4.730 5.557 . 0 0 "[ . 1 . 2]" 1
2050 1 33 TRP HH2 1 59 TYR HB2 5.500 . 5.956 4.595 4.297 5.029 . 0 0 "[ . 1 . 2]" 1
2051 1 33 TRP HH2 1 59 TYR HB3 4.190 . 4.646 3.793 3.369 4.437 . 0 0 "[ . 1 . 2]" 1
2052 1 26 PRO HB2 1 33 TRP HH2 4.290 . 4.746 3.468 2.929 3.887 . 0 0 "[ . 1 . 2]" 1
2053 1 68 LEU HA 1 69 TRP HD1 4.850 . 5.306 4.752 4.648 4.892 . 0 0 "[ . 1 . 2]" 1
2054 1 67 ALA H 1 69 TRP HD1 5.500 . 5.956 5.567 5.387 5.868 . 0 0 "[ . 1 . 2]" 1
2055 1 65 GLU HA 1 69 TRP HD1 4.480 . 4.936 4.179 4.025 4.362 . 0 0 "[ . 1 . 2]" 1
2056 1 65 GLU HG3 1 69 TRP HD1 3.800 . 4.255 3.578 3.250 3.863 . 0 0 "[ . 1 . 2]" 1
2057 1 69 TRP HA 1 69 TRP HD1 3.140 . 3.595 2.724 2.599 2.835 . 0 0 "[ . 1 . 2]" 1
2058 1 69 TRP H 1 69 TRP HD1 2.850 . 3.306 2.077 1.948 2.281 . 0 0 "[ . 1 . 2]" 1
2059 1 38 LYS HD2 1 69 TRP HD1 5.340 . 5.795 5.045 4.521 5.459 . 0 0 "[ . 1 . 2]" 1
2060 1 68 LEU MD1 1 69 TRP HD1 3.880 . 4.335 4.054 3.863 4.270 . 0 0 "[ . 1 . 2]" 1
2061 1 69 TRP HD1 1 72 ALA MB 5.040 . 5.496 4.830 4.594 5.385 . 0 0 "[ . 1 . 2]" 1
2062 1 68 LEU HB2 1 69 TRP HD1 3.630 . 4.085 2.515 2.346 2.732 . 0 0 "[ . 1 . 2]" 1
2063 1 68 LEU HB3 1 69 TRP HD1 3.970 . 4.425 3.563 3.324 3.809 . 0 0 "[ . 1 . 2]" 1
2064 1 68 LEU H 1 69 TRP HD1 4.240 . 4.695 3.969 3.792 4.122 . 0 0 "[ . 1 . 2]" 1
2065 1 38 LYS HD3 1 69 TRP HD1 4.240 . 4.695 3.485 3.031 3.809 . 0 0 "[ . 1 . 2]" 1
2066 1 38 LYS HB3 1 69 TRP HH2 5.440 . 5.896 5.194 4.811 5.591 . 0 0 "[ . 1 . 2]" 1
2067 1 38 LYS HA 1 69 TRP HH2 4.520 . 4.976 3.754 3.492 4.148 . 0 0 "[ . 1 . 2]" 1
2068 1 41 VAL MG2 1 69 TRP HH2 4.300 . 4.755 3.255 3.058 3.522 . 0 0 "[ . 1 . 2]" 1
2069 1 61 LEU MD1 1 69 TRP HH2 4.200 . 4.655 2.451 2.178 2.671 . 0 0 "[ . 1 . 2]" 1
2070 1 31 ARG QG 1 33 TRP HD1 5.500 . 5.956 4.698 3.820 5.953 . 0 0 "[ . 1 . 2]" 1
2071 1 30 THR MG 1 33 TRP HD1 4.260 . 4.715 4.155 3.616 4.737 0.022 12 0 "[ . 1 . 2]" 1
2072 1 33 TRP H 1 33 TRP HD1 3.980 . 4.436 2.853 2.420 3.670 . 0 0 "[ . 1 . 2]" 1
2073 1 31 ARG HA 1 33 TRP HD1 3.960 . 4.416 3.257 2.585 3.891 . 0 0 "[ . 1 . 2]" 1
2074 1 33 TRP HB2 1 33 TRP HD1 3.260 . 3.716 2.634 2.582 2.704 . 0 0 "[ . 1 . 2]" 1
2075 1 33 TRP HB3 1 33 TRP HD1 3.850 . 4.306 3.778 3.716 3.837 . 0 0 "[ . 1 . 2]" 1
2076 1 33 TRP HA 1 33 TRP HD1 4.380 . 4.835 4.144 3.953 4.313 . 0 0 "[ . 1 . 2]" 1
2077 1 45 VAL HB 1 66 PHE HZ 3.620 . 4.076 2.094 1.873 2.324 . 0 0 "[ . 1 . 2]" 1
2078 1 45 VAL MG2 1 66 PHE HZ 3.010 . 3.466 2.361 2.088 2.539 . 0 0 "[ . 1 . 2]" 1
2079 1 42 VAL HA 1 66 PHE HZ 3.440 . 3.895 2.398 1.903 2.664 . 0 0 "[ . 1 . 2]" 1
2080 1 52 GLU HG2 1 66 PHE HZ 4.780 . 5.235 5.169 4.407 5.295 0.060 7 0 "[ . 1 . 2]" 1
2081 1 46 ILE H 1 66 PHE HZ 4.590 . 5.045 4.205 3.899 4.475 . 0 0 "[ . 1 . 2]" 1
2082 1 45 VAL H 1 66 PHE HZ 4.390 . 4.845 3.931 3.568 4.233 . 0 0 "[ . 1 . 2]" 1
2083 1 66 PHE HZ 1 70 ARG QD 5.050 . 5.505 4.740 4.222 5.531 0.026 10 0 "[ . 1 . 2]" 1
2084 1 66 PHE QE 1 69 TRP HZ3 5.210 . 5.666 4.669 4.044 5.277 . 0 0 "[ . 1 . 2]" 1
2085 1 44 ALA H 1 66 PHE QE 5.500 . 5.956 5.707 5.405 5.951 . 0 0 "[ . 1 . 2]" 1
2086 1 41 VAL HB 1 66 PHE QE 4.150 . 4.606 3.954 3.425 4.283 . 0 0 "[ . 1 . 2]" 1
2087 1 52 GLU HA 1 66 PHE QE 4.370 . 4.826 4.123 3.806 4.478 . 0 0 "[ . 1 . 2]" 1
2088 1 66 PHE QE 1 70 ARG QG 4.540 . 4.996 4.488 4.070 4.792 . 0 0 "[ . 1 . 2]" 1
2089 1 50 ILE MD 1 66 PHE QE 4.090 . 4.545 4.292 4.009 4.549 0.004 19 0 "[ . 1 . 2]" 1
2090 1 42 VAL H 1 66 PHE QE 4.410 . 4.865 4.092 3.706 4.368 . 0 0 "[ . 1 . 2]" 1
2091 1 41 VAL MG1 1 66 PHE QE 3.160 . 3.615 2.145 1.792 2.455 0.008 15 0 "[ . 1 . 2]" 1
2092 1 66 PHE QE 1 70 ARG QD 3.610 . 4.065 2.792 2.230 3.503 . 0 0 "[ . 1 . 2]" 1
2093 1 42 VAL MG2 1 66 PHE QE 3.520 . 3.976 3.037 2.900 3.154 . 0 0 "[ . 1 . 2]" 1
2094 1 45 VAL HB 1 66 PHE QE 3.940 . 4.396 3.447 3.197 3.654 . 0 0 "[ . 1 . 2]" 1
2095 1 42 VAL HA 1 66 PHE QE 3.480 . 3.935 2.462 2.232 2.992 . 0 0 "[ . 1 . 2]" 1
2096 1 52 GLU HG2 1 66 PHE QE 3.890 . 4.345 4.174 3.028 4.387 0.041 1 0 "[ . 1 . 2]" 1
2097 1 46 ILE HG13 1 66 PHE QE 4.710 . 5.166 4.511 4.155 4.829 . 0 0 "[ . 1 . 2]" 1
2098 1 52 GLU HB2 1 66 PHE QE 5.120 . 5.576 4.394 3.591 5.553 . 0 0 "[ . 1 . 2]" 1
2099 1 46 ILE H 1 66 PHE QE 5.060 . 5.516 5.176 4.942 5.415 . 0 0 "[ . 1 . 2]" 1
2100 1 61 LEU MD1 1 66 PHE QE 4.700 . 5.155 4.487 3.972 4.907 . 0 0 "[ . 1 . 2]" 1
2101 1 56 LEU MD1 1 66 PHE QD 4.810 . 5.266 4.492 4.252 4.770 . 0 0 "[ . 1 . 2]" 1
2102 1 66 PHE QD 1 70 ARG H 4.640 . 4.940 4.477 4.314 4.726 . 0 0 "[ . 1 . 2]" 1
2103 1 66 PHE HA 1 66 PHE QD 3.170 . 3.625 2.826 2.714 2.925 . 0 0 "[ . 1 . 2]" 1
2104 1 66 PHE QD 1 70 ARG QG 4.040 . 4.340 3.991 3.486 4.372 0.032 10 0 "[ . 1 . 2]" 1
2105 1 66 PHE H 1 66 PHE QD 4.180 . 4.635 4.150 4.112 4.180 . 0 0 "[ . 1 . 2]" 1
2106 1 42 VAL HA 1 66 PHE QD 4.600 . 5.056 4.449 4.170 4.659 . 0 0 "[ . 1 . 2]" 1
2107 1 66 PHE QD 1 67 ALA H 4.080 . 4.536 3.897 3.745 4.035 . 0 0 "[ . 1 . 2]" 1
2108 1 56 LEU MD2 1 66 PHE QD 3.520 . 3.976 3.161 2.976 3.532 . 0 0 "[ . 1 . 2]" 1
2109 1 66 PHE QD 1 70 ARG QD 3.770 . 4.226 2.548 2.194 2.982 . 0 0 "[ . 1 . 2]" 1
2110 1 52 GLU HG2 1 66 PHE QD 3.690 . 4.146 3.835 2.867 4.051 . 0 0 "[ . 1 . 2]" 1
2111 1 42 VAL MG2 1 66 PHE QD 4.280 . 4.735 4.070 3.891 4.227 . 0 0 "[ . 1 . 2]" 1
2112 1 66 PHE QD 1 69 TRP HZ3 5.100 . 5.556 4.448 3.956 5.004 . 0 0 "[ . 1 . 2]" 1
2113 1 66 PHE QD 1 67 ALA HA 4.080 . 4.536 3.637 3.354 3.812 . 0 0 "[ . 1 . 2]" 1
2114 1 52 GLU HB2 1 66 PHE QD 5.500 . 5.956 5.286 4.698 5.957 0.002 16 0 "[ . 1 . 2]" 1
2115 1 65 GLU HB3 1 66 PHE QD 5.500 . 5.956 5.379 5.060 5.553 . 0 0 "[ . 1 . 2]" 1
2116 1 85 MET HB3 1 89 TYR HD2 4.240 . 4.695 4.206 3.743 4.737 0.041 13 0 "[ . 1 . 2]" 1
2117 1 86 ILE MG 1 89 TYR HD2 3.890 . 4.345 3.505 2.882 4.085 . 0 0 "[ . 1 . 2]" 1
2118 1 89 TYR H 1 89 TYR HD2 4.220 . 4.675 3.615 3.233 4.094 . 0 0 "[ . 1 . 2]" 1
2119 1 89 TYR H 1 89 TYR HD1 4.480 . 4.936 3.826 3.373 4.237 . 0 0 "[ . 1 . 2]" 1
2120 1 89 TYR HA 1 89 TYR HD1 2.950 . 3.405 2.131 1.860 2.340 . 0 0 "[ . 1 . 2]" 1
2121 1 2 TYR QB 1 2 TYR HD1 2.800 . 3.256 2.521 2.413 2.644 . 0 0 "[ . 1 . 2]" 1
2122 1 89 TYR HB2 1 89 TYR HD2 2.940 . 3.395 2.327 2.296 2.390 . 0 0 "[ . 1 . 2]" 1
2123 1 2 TYR HA 1 2 TYR HD1 3.270 . 3.726 2.849 2.450 4.027 0.302 2 0 "[ . 1 . 2]" 1
2124 1 86 ILE HG13 1 89 TYR HD2 3.910 . 4.365 3.113 2.447 3.804 . 0 0 "[ . 1 . 2]" 1
2125 1 58 ARG HG3 1 59 TYR HD2 5.170 . 5.626 3.008 2.707 3.290 . 0 0 "[ . 1 . 2]" 1
2126 1 59 TYR HD2 1 61 LEU MD1 4.860 . 5.315 2.840 2.546 3.332 . 0 0 "[ . 1 . 2]" 1
2127 1 33 TRP HH2 1 59 TYR HD2 4.980 . 5.436 4.149 3.689 4.558 . 0 0 "[ . 1 . 2]" 1
2128 1 33 TRP HH2 1 59 TYR HD1 5.330 . 5.786 3.264 2.841 3.814 . 0 0 "[ . 1 . 2]" 1
2129 1 47 HIS HA 1 47 HIS HE1 4.750 . 5.206 4.629 4.575 4.695 . 0 0 "[ . 1 . 2]" 1
2130 1 15 PRO HG3 1 47 HIS HE1 3.940 . 4.396 3.063 2.324 4.087 . 0 0 "[ . 1 . 2]" 1
2131 1 14 LEU HA 1 47 HIS HE1 4.350 . 4.806 3.760 3.375 4.367 . 0 0 "[ . 1 . 2]" 1
2132 1 46 ILE MG 1 47 HIS HE1 3.870 . 4.326 4.009 3.513 4.246 . 0 0 "[ . 1 . 2]" 1
2133 1 15 PRO HD3 1 47 HIS HE1 3.780 . 4.235 2.407 1.934 2.740 . 0 0 "[ . 1 . 2]" 1
2134 1 46 ILE MD 1 47 HIS HE1 5.500 . 5.956 5.879 5.430 6.007 0.052 12 0 "[ . 1 . 2]" 1
2135 1 43 LYS QD 1 47 HIS HE1 5.500 . 5.956 5.664 5.258 5.978 0.023 12 0 "[ . 1 . 2]" 1
2136 1 46 ILE HB 1 47 HIS HE1 5.500 . 5.956 5.440 5.115 5.970 0.014 11 0 "[ . 1 . 2]" 1
2137 1 12 VAL MG2 1 47 HIS HE1 5.500 . 5.956 5.804 5.564 5.983 0.027 15 0 "[ . 1 . 2]" 1
2138 1 7 ASP QB 1 8 GLY H 3.990 . 4.445 3.553 2.228 4.026 . 0 0 "[ . 1 . 2]" 1
2139 1 8 GLY QA 1 9 PRO QG 4.120 . 4.576 3.637 3.541 3.784 . 0 0 "[ . 1 . 2]" 1
2140 1 9 PRO QG 1 10 ARG H 4.970 . 5.425 4.603 4.310 4.914 . 0 0 "[ . 1 . 2]" 1
2141 1 10 ARG H 1 10 ARG QB 3.080 . 3.536 2.434 2.102 3.389 . 0 0 "[ . 1 . 2]" 1
2142 1 10 ARG HA 1 22 ARG QG 4.320 . 4.820 2.669 1.988 3.557 . 0 0 "[ . 1 . 2]" 1
2143 1 10 ARG QB 1 11 GLN H 3.390 . 3.845 3.038 2.358 3.672 . 0 0 "[ . 1 . 2]" 1
2144 1 10 ARG QB 1 22 ARG QD 4.180 . 4.635 3.925 2.938 4.699 0.064 12 0 "[ . 1 . 2]" 1
2145 1 11 GLN QB 1 11 GLN HG3 2.600 . 3.056 2.353 2.253 2.417 . 0 0 "[ . 1 . 2]" 1
2146 1 11 GLN QB 1 11 GLN HE22 4.490 . 4.945 3.843 3.187 4.071 . 0 0 "[ . 1 . 2]" 1
2147 1 11 GLN QB 1 12 VAL H 3.530 . 3.986 2.875 2.664 3.075 . 0 0 "[ . 1 . 2]" 1
2148 1 11 GLN QB 1 19 VAL MG1 3.220 . 3.675 2.311 1.963 2.730 . 0 0 "[ . 1 . 2]" 1
2149 1 11 GLN QB 1 20 LEU H 4.970 . 5.425 3.889 3.639 4.187 . 0 0 "[ . 1 . 2]" 1
2150 1 11 GLN QB 1 21 SER HA 3.620 . 4.076 2.632 2.260 3.077 . 0 0 "[ . 1 . 2]" 1
2151 1 11 GLN QB 1 21 SER QB 3.370 . 3.826 2.393 1.972 2.831 . 0 0 "[ . 1 . 2]" 1
2152 1 11 GLN QB 1 22 ARG H 4.600 . 5.056 4.051 3.640 4.563 . 0 0 "[ . 1 . 2]" 1
2153 1 11 GLN QB 1 49 LEU MD1 4.400 . 4.856 3.801 3.619 4.034 . 0 0 "[ . 1 . 2]" 1
2154 1 16 ASP H 1 16 ASP QB 3.110 . 3.566 2.480 2.181 2.917 . 0 0 "[ . 1 . 2]" 1
2155 1 16 ASP QB 1 18 THR H 4.250 . 4.706 2.813 2.287 4.031 . 0 0 "[ . 1 . 2]" 1
2156 1 19 VAL MG1 1 21 SER QB 3.610 . 4.065 3.268 2.840 4.127 0.061 18 0 "[ . 1 . 2]" 1
2157 1 20 LEU H 1 21 SER QB 5.340 . 5.795 5.155 4.931 5.691 . 0 0 "[ . 1 . 2]" 1
2158 1 20 LEU HA 1 21 SER QB 4.400 . 4.856 4.510 4.408 4.641 . 0 0 "[ . 1 . 2]" 1
2159 1 21 SER H 1 21 SER QB 3.430 . 3.885 2.707 2.576 2.919 . 0 0 "[ . 1 . 2]" 1
2160 1 21 SER HA 1 22 ARG QG 5.340 . 5.795 3.864 3.687 4.035 . 0 0 "[ . 1 . 2]" 1
2161 1 21 SER QB 1 22 ARG H 3.470 . 3.925 2.372 2.242 2.552 . 0 0 "[ . 1 . 2]" 1
2162 1 21 SER QB 1 22 ARG HB2 5.090 . 5.545 4.217 4.047 4.392 . 0 0 "[ . 1 . 2]" 1
2163 1 21 SER QB 1 23 ALA H 3.620 . 4.076 2.622 2.337 2.809 . 0 0 "[ . 1 . 2]" 1
2164 1 21 SER QB 1 24 ASP H 4.400 . 4.856 3.552 2.505 3.941 . 0 0 "[ . 1 . 2]" 1
2165 1 21 SER QB 1 24 ASP QB 3.970 . 4.425 3.842 2.176 4.423 . 0 0 "[ . 1 . 2]" 1
2166 1 21 SER QB 1 49 LEU MD1 4.370 . 4.826 4.073 3.711 4.416 . 0 0 "[ . 1 . 2]" 1
2167 1 22 ARG H 1 22 ARG QG 3.730 . 4.186 2.359 2.078 2.574 . 0 0 "[ . 1 . 2]" 1
2168 1 22 ARG HA 1 22 ARG QG 3.450 . 3.905 2.381 2.294 2.512 . 0 0 "[ . 1 . 2]" 1
2169 1 22 ARG QG 1 49 LEU MD1 3.010 . 3.510 1.918 1.807 1.998 . 0 0 "[ . 1 . 2]" 1
2170 1 22 ARG QG 1 49 LEU MD2 4.310 . 4.810 2.747 2.512 3.045 . 0 0 "[ . 1 . 2]" 1
2171 1 22 ARG QG 1 50 ILE MG 3.250 . 3.705 2.690 2.193 3.529 . 0 0 "[ . 1 . 2]" 1
2172 1 25 LEU HB3 1 58 ARG QD 5.340 . 5.795 4.473 3.628 4.971 . 0 0 "[ . 1 . 2]" 1
2173 1 25 LEU MD1 1 54 GLU QG 4.830 . 5.286 4.234 3.517 4.844 . 0 0 "[ . 1 . 2]" 1
2174 1 25 LEU MD1 1 58 ARG QD 3.560 . 4.016 3.083 2.559 3.422 . 0 0 "[ . 1 . 2]" 1
2175 1 25 LEU MD2 1 58 ARG QD 3.920 . 4.376 4.154 3.671 4.421 0.045 18 0 "[ . 1 . 2]" 1
2176 1 26 PRO HA 1 27 PRO QD 2.970 . 3.425 2.049 1.929 2.151 . 0 0 "[ . 1 . 2]" 1
2177 1 26 PRO HB2 1 27 PRO QD 4.040 . 4.496 2.728 2.411 3.062 . 0 0 "[ . 1 . 2]" 1
2178 1 26 PRO HB3 1 27 PRO QD 3.700 . 4.155 2.900 2.573 3.123 . 0 0 "[ . 1 . 2]" 1
2179 1 27 PRO HA 1 28 LEU QB 5.340 . 5.795 4.571 4.488 4.635 . 0 0 "[ . 1 . 2]" 1
2180 1 28 LEU H 1 28 LEU QB 3.450 . 3.905 2.506 2.441 2.540 . 0 0 "[ . 1 . 2]" 1
2181 1 28 LEU QB 1 28 LEU MD2 2.910 . 3.365 2.334 2.289 2.397 . 0 0 "[ . 1 . 2]" 1
2182 1 28 LEU QB 1 29 ASP H 3.610 . 4.065 3.069 2.742 3.403 . 0 0 "[ . 1 . 2]" 1
2183 1 28 LEU QB 1 29 ASP HA 4.580 . 5.036 4.004 3.869 4.094 . 0 0 "[ . 1 . 2]" 1
2184 1 28 LEU QB 1 30 THR H 4.580 . 5.036 4.511 4.332 4.702 . 0 0 "[ . 1 . 2]" 1
2185 1 28 LEU QB 1 59 TYR HA 5.340 . 5.795 4.144 3.510 4.748 . 0 0 "[ . 1 . 2]" 1
2186 1 28 LEU MD2 1 58 ARG QD 4.030 . 4.530 3.223 2.041 4.273 . 0 0 "[ . 1 . 2]" 1
2187 1 29 ASP H 1 29 ASP QB 3.200 . 3.655 2.417 2.192 2.720 . 0 0 "[ . 1 . 2]" 1
2188 1 29 ASP QB 1 30 THR H 4.150 . 4.606 3.377 2.903 3.886 . 0 0 "[ . 1 . 2]" 1
2189 1 30 THR HA 1 31 ARG QB 4.450 . 4.905 4.237 3.968 4.512 . 0 0 "[ . 1 . 2]" 1
2190 1 31 ARG HA 1 31 ARG QD 3.560 . 4.016 2.056 1.766 2.950 0.034 9 0 "[ . 1 . 2]" 1
2191 1 31 ARG QB 1 31 ARG QD 3.280 . 3.736 2.594 2.216 2.919 . 0 0 "[ . 1 . 2]" 1
2192 1 31 ARG QD 1 33 TRP HD1 5.250 . 5.706 3.970 2.405 5.712 0.007 15 0 "[ . 1 . 2]" 1
2193 1 31 ARG QD 1 33 TRP HE1 5.340 . 5.795 3.366 2.458 4.842 . 0 0 "[ . 1 . 2]" 1
2194 1 32 ARG QB 1 34 VAL MG1 3.940 . 4.396 3.975 2.968 4.480 0.085 5 0 "[ . 1 . 2]" 1
2195 1 32 ARG QG 1 33 TRP H 5.310 . 5.766 4.056 3.396 4.431 . 0 0 "[ . 1 . 2]" 1
2196 1 32 ARG QG 1 34 VAL MG1 4.440 . 4.896 3.652 2.190 4.980 0.084 8 0 "[ . 1 . 2]" 1
2197 1 50 ILE MG 1 54 GLU QG 3.970 . 4.425 3.227 2.421 4.309 . 0 0 "[ . 1 . 2]" 1
2198 1 50 ILE MD 1 54 GLU QG 3.960 . 4.416 2.933 2.382 3.842 . 0 0 "[ . 1 . 2]" 1
2199 1 50 ILE MD 1 58 ARG QD 3.920 . 4.376 3.055 2.588 3.871 . 0 0 "[ . 1 . 2]" 1
2200 1 51 THR H 1 54 GLU QG 4.330 . 4.786 3.617 2.838 4.503 . 0 0 "[ . 1 . 2]" 1
2201 1 53 ARG H 1 53 ARG QG 3.480 . 3.935 2.830 1.958 3.896 . 0 0 "[ . 1 . 2]" 1
2202 1 53 ARG HA 1 53 ARG QG 3.480 . 3.935 2.631 2.102 3.205 . 0 0 "[ . 1 . 2]" 1
2203 1 53 ARG HB2 1 53 ARG QD 3.640 . 4.095 3.317 2.795 3.527 . 0 0 "[ . 1 . 2]" 1
2204 1 53 ARG HB3 1 53 ARG QD 2.770 . 3.226 2.508 2.176 3.068 . 0 0 "[ . 1 . 2]" 1
2205 1 53 ARG QG 1 54 GLU H 4.440 . 4.896 4.361 3.835 4.660 . 0 0 "[ . 1 . 2]" 1
2206 1 53 ARG QG 1 56 LEU MD1 3.390 . 3.845 3.506 1.914 4.007 0.162 2 0 "[ . 1 . 2]" 1
2207 1 53 ARG QD 1 56 LEU MD1 5.290 . 5.746 3.004 1.872 4.301 . 0 0 "[ . 1 . 2]" 1
2208 1 54 GLU HA 1 54 GLU QG 3.290 . 3.746 2.793 2.418 3.094 . 0 0 "[ . 1 . 2]" 1
2209 1 54 GLU HB3 1 58 ARG QD 5.330 . 5.786 4.661 3.834 5.646 . 0 0 "[ . 1 . 2]" 1
2210 1 54 GLU QG 1 55 ALA H 4.060 . 4.516 3.426 3.051 3.822 . 0 0 "[ . 1 . 2]" 1
2211 1 54 GLU QG 1 55 ALA MB 4.900 . 5.356 4.107 3.621 4.645 . 0 0 "[ . 1 . 2]" 1
2212 1 54 GLU QG 1 58 ARG HB2 5.340 . 5.795 4.866 4.236 5.674 . 0 0 "[ . 1 . 2]" 1
2213 1 54 GLU QG 1 58 ARG HG2 4.700 . 5.000 3.284 2.813 3.807 . 0 0 "[ . 1 . 2]" 1
2214 1 55 ALA H 1 58 ARG QD 5.340 . 5.795 4.627 3.972 5.626 . 0 0 "[ . 1 . 2]" 1
2215 1 55 ALA MB 1 58 ARG QD 4.940 . 5.396 3.867 3.473 4.387 . 0 0 "[ . 1 . 2]" 1
2216 1 58 ARG H 1 58 ARG QD 4.610 . 5.065 3.869 3.514 4.314 . 0 0 "[ . 1 . 2]" 1
2217 1 58 ARG QD 1 59 TYR H 5.340 . 5.795 4.354 4.085 4.722 . 0 0 "[ . 1 . 2]" 1
2218 1 58 ARG QD 1 59 TYR HE2 3.290 . 3.746 2.743 2.476 3.217 . 0 0 "[ . 1 . 2]" 1
2219 1 59 TYR HA 1 60 SER QB 4.810 . 5.266 4.157 3.895 4.743 . 0 0 "[ . 1 . 2]" 1
2220 1 60 SER H 1 60 SER QB 3.480 . 3.935 3.168 2.902 3.406 . 0 0 "[ . 1 . 2]" 1
2221 1 60 SER QB 1 61 LEU H 4.150 . 4.606 3.914 3.770 4.039 . 0 0 "[ . 1 . 2]" 1
2222 1 60 SER QB 1 61 LEU HA 5.340 . 5.795 4.422 4.231 4.663 . 0 0 "[ . 1 . 2]" 1
2223 1 60 SER QB 1 61 LEU MD2 5.340 . 5.795 4.204 3.925 4.841 . 0 0 "[ . 1 . 2]" 1
2224 1 67 ALA MB 1 71 SER QB 4.720 . 5.175 4.533 3.855 4.874 . 0 0 "[ . 1 . 2]" 1
2225 1 68 LEU HA 1 71 SER QB 2.940 . 3.395 2.528 2.053 2.781 . 0 0 "[ . 1 . 2]" 1
2226 1 68 LEU HB2 1 71 SER QB 4.940 . 5.396 5.156 4.561 5.412 0.017 3 0 "[ . 1 . 2]" 1
2227 1 68 LEU HB3 1 71 SER QB 4.260 . 4.715 4.341 3.682 4.633 . 0 0 "[ . 1 . 2]" 1
2228 1 68 LEU MD2 1 71 SER QB 3.770 . 4.226 3.489 2.981 3.861 . 0 0 "[ . 1 . 2]" 1
2229 1 69 TRP H 1 71 SER QB 5.140 . 5.595 4.930 4.475 5.162 . 0 0 "[ . 1 . 2]" 1
2230 1 70 ARG H 1 71 SER QB 4.660 . 5.115 4.597 4.302 4.788 . 0 0 "[ . 1 . 2]" 1
2231 1 71 SER H 1 71 SER QB 2.820 . 3.276 2.390 2.253 2.485 . 0 0 "[ . 1 . 2]" 1
2232 1 71 SER QB 1 72 ALA H 3.250 . 3.705 2.804 2.552 3.051 . 0 0 "[ . 1 . 2]" 1
2233 1 71 SER QB 1 72 ALA MB 4.920 . 5.376 3.747 3.585 3.952 . 0 0 "[ . 1 . 2]" 1
2234 1 73 VAL HA 1 76 HIS QB 4.090 . 4.545 2.794 2.424 3.311 . 0 0 "[ . 1 . 2]" 1
2235 1 73 VAL MG1 1 76 HIS QB 4.730 . 5.186 3.923 3.149 4.748 . 0 0 "[ . 1 . 2]" 1
2236 1 75 ALA H 1 76 HIS QB 4.550 . 5.005 4.066 3.488 4.330 . 0 0 "[ . 1 . 2]" 1
2237 1 75 ALA MB 1 76 HIS QB 4.660 . 5.115 4.381 3.981 4.705 . 0 0 "[ . 1 . 2]" 1
2238 1 76 HIS H 1 76 HIS QB 3.310 . 3.766 2.325 2.229 3.043 . 0 0 "[ . 1 . 2]" 1
2239 1 76 HIS QB 1 76 HIS HD2 3.330 . 3.786 2.861 2.622 3.280 . 0 0 "[ . 1 . 2]" 1
2240 1 77 GLY QA 1 78 GLU H 2.840 . 3.296 2.518 2.165 2.916 . 0 0 "[ . 1 . 2]" 1
2241 1 77 GLY QA 1 78 GLU HA 4.450 . 4.905 4.096 3.999 4.265 . 0 0 "[ . 1 . 2]" 1
2242 1 77 GLY QA 1 78 GLU HB3 5.040 . 5.496 4.755 4.478 4.988 . 0 0 "[ . 1 . 2]" 1
2243 1 77 GLY QA 1 78 GLU HG2 4.520 . 4.976 4.349 3.680 5.025 0.050 12 0 "[ . 1 . 2]" 1
2244 1 77 GLY QA 1 79 LYS H 3.820 . 4.275 3.075 2.771 3.319 . 0 0 "[ . 1 . 2]" 1
2245 1 77 GLY QA 1 79 LYS QG 3.950 . 4.405 3.830 2.633 4.461 0.055 3 0 "[ . 1 . 2]" 1
2246 1 77 GLY QA 1 80 ALA H 4.830 . 5.286 3.837 3.128 4.540 . 0 0 "[ . 1 . 2]" 1
2247 1 78 GLU H 1 79 LYS QG 4.350 . 4.806 3.521 3.071 3.913 . 0 0 "[ . 1 . 2]" 1
2248 1 79 LYS H 1 79 LYS QB 3.680 . 4.135 2.549 2.399 2.921 . 0 0 "[ . 1 . 2]" 1
2249 1 79 LYS H 1 79 LYS QG 3.330 . 3.786 2.190 1.764 2.584 0.036 2 0 "[ . 1 . 2]" 1
2250 1 79 LYS HA 1 79 LYS QG 3.400 . 3.855 2.837 2.389 3.351 . 0 0 "[ . 1 . 2]" 1
2251 1 79 LYS QB 1 80 ALA H 3.590 . 4.045 2.869 1.769 3.947 0.031 8 0 "[ . 1 . 2]" 1
2252 1 79 LYS QB 1 80 ALA HA 4.810 . 5.266 4.336 4.080 4.663 . 0 0 "[ . 1 . 2]" 1
2253 1 79 LYS QB 1 81 LEU MD1 5.340 . 5.795 4.748 2.386 5.786 . 0 0 "[ . 1 . 2]" 1
2254 1 79 LYS QG 1 80 ALA H 4.000 . 4.456 3.746 1.767 4.224 0.033 2 0 "[ . 1 . 2]" 1
2255 1 82 LYS H 1 82 LYS QG 4.180 . 4.635 3.999 3.932 4.141 . 0 0 "[ . 1 . 2]" 1
2256 1 82 LYS HA 1 82 LYS QG 3.490 . 3.945 2.554 2.389 2.899 . 0 0 "[ . 1 . 2]" 1
2257 1 82 LYS QG 1 83 VAL H 3.910 . 4.365 2.134 1.816 2.538 . 0 0 "[ . 1 . 2]" 1
2258 1 82 LYS QG 1 83 VAL HA 5.280 . 5.735 4.278 4.145 4.632 . 0 0 "[ . 1 . 2]" 1
2259 1 82 LYS QG 1 83 VAL MG1 3.740 . 4.195 2.369 2.042 2.853 . 0 0 "[ . 1 . 2]" 1
2260 1 82 LYS QG 1 84 THR H 4.010 . 4.465 2.220 1.783 3.115 0.017 14 0 "[ . 1 . 2]" 1
2261 1 82 LYS QG 1 84 THR HB 4.390 . 4.845 3.609 2.886 4.698 . 0 0 "[ . 1 . 2]" 1
2262 1 82 LYS QG 1 85 MET H 5.190 . 5.646 3.699 3.186 4.542 . 0 0 "[ . 1 . 2]" 1
2263 1 84 THR HA 1 87 GLN QB 4.580 . 4.956 3.716 2.832 4.658 . 0 0 "[ . 1 . 2]" 1
2264 1 85 MET H 1 85 MET QG 4.160 . 4.615 3.364 2.170 4.121 . 0 0 "[ . 1 . 2]" 1
2265 1 85 MET HA 1 85 MET QG 3.650 . 4.106 2.562 2.279 2.918 . 0 0 "[ . 1 . 2]" 1
2266 1 85 MET HA 1 88 LYS QB 3.820 . 4.275 3.205 2.400 4.312 0.037 15 0 "[ . 1 . 2]" 1
2267 1 85 MET QG 1 86 ILE H 4.830 . 5.286 4.433 3.996 4.816 . 0 0 "[ . 1 . 2]" 1
2268 1 85 MET QG 1 89 TYR HE2 4.530 . 5.030 3.935 2.213 5.023 . 0 0 "[ . 1 . 2]" 1
2269 1 86 ILE MG 1 87 GLN QB 4.690 . 5.146 4.338 4.010 4.623 . 0 0 "[ . 1 . 2]" 1
2270 1 86 ILE MG 1 90 ARG QB 4.340 . 4.795 3.702 2.340 4.182 . 0 0 "[ . 1 . 2]" 1
2271 1 87 GLN H 1 87 GLN QB 3.000 . 3.455 2.271 2.195 2.585 . 0 0 "[ . 1 . 2]" 1
2272 1 87 GLN H 1 88 LYS QB 5.090 . 5.545 4.768 4.525 5.074 . 0 0 "[ . 1 . 2]" 1
2273 1 87 GLN QB 1 88 LYS H 4.020 . 4.476 2.702 2.368 3.581 . 0 0 "[ . 1 . 2]" 1
2274 1 88 LYS H 1 88 LYS QB 3.020 . 3.476 2.451 2.341 2.569 . 0 0 "[ . 1 . 2]" 1
2275 1 88 LYS HA 1 88 LYS QG 3.540 . 3.840 2.714 2.289 3.358 . 0 0 "[ . 1 . 2]" 1
2276 1 88 LYS QB 1 89 TYR H 3.710 . 4.166 2.942 2.309 3.778 . 0 0 "[ . 1 . 2]" 1
2277 1 88 LYS QG 1 89 TYR H 4.540 . 4.996 3.949 2.466 4.623 . 0 0 "[ . 1 . 2]" 1
2278 1 89 TYR H 1 92 LEU QB 5.160 . 5.615 4.605 4.188 5.560 . 0 0 "[ . 1 . 2]" 1
2279 1 89 TYR HA 1 92 LEU QB 3.980 . 4.436 2.502 1.876 3.296 . 0 0 "[ . 1 . 2]" 1
2280 1 90 ARG H 1 90 ARG QB 3.560 . 4.016 2.436 2.300 2.647 . 0 0 "[ . 1 . 2]" 1
2281 1 90 ARG QB 1 91 GLN H 3.950 . 4.405 2.868 2.336 3.637 . 0 0 "[ . 1 . 2]" 1
2282 1 91 GLN QB 1 92 LEU H 4.320 . 4.775 3.547 2.670 3.987 . 0 0 "[ . 1 . 2]" 1
2283 1 92 LEU H 1 92 LEU QB 3.320 . 3.776 2.224 2.043 2.420 . 0 0 "[ . 1 . 2]" 1
2284 1 92 LEU QB 1 92 LEU MD2 3.060 . 3.516 2.232 2.053 2.381 . 0 0 "[ . 1 . 2]" 1
2285 1 92 LEU QB 1 93 HIS H 3.080 . 3.830 3.260 2.081 3.957 0.127 3 0 "[ . 1 . 2]" 1
2286 1 94 HIS H 1 94 HIS QB 3.560 . 4.016 2.670 2.259 3.122 . 0 0 "[ . 1 . 2]" 1
2287 1 82 LYS HA 1 85 MET QB 4.000 . 4.300 4.207 3.880 4.338 0.038 20 0 "[ . 1 . 2]" 1
2288 1 84 THR HB 1 86 ILE MD 5.000 . 5.500 5.608 5.520 5.723 0.223 17 0 "[ . 1 . 2]" 1
2289 1 77 GLY QA 1 78 GLU QB 5.000 . 5.456 4.500 4.276 4.672 . 0 0 "[ . 1 . 2]" 1
2290 1 77 GLY QA 1 78 GLU QG 5.000 . 5.456 4.128 3.560 4.735 . 0 0 "[ . 1 . 2]" 1
2291 1 11 GLN HA 1 21 SER H 5.000 . 5.300 4.345 4.250 4.568 . 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 33
_Distance_constraint_stats_list.Viol_count 222
_Distance_constraint_stats_list.Viol_total 196.242
_Distance_constraint_stats_list.Viol_max 0.170
_Distance_constraint_stats_list.Viol_rms 0.0312
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0149
_Distance_constraint_stats_list.Viol_average_violations_only 0.0442
_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 10 ARG 0.022 0.015 9 0 "[ . 1 . 2]"
1 12 VAL 0.576 0.060 3 0 "[ . 1 . 2]"
1 14 LEU 0.106 0.045 18 0 "[ . 1 . 2]"
1 17 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 THR 0.106 0.045 18 0 "[ . 1 . 2]"
1 20 LEU 0.576 0.060 3 0 "[ . 1 . 2]"
1 21 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 ARG 0.022 0.015 9 0 "[ . 1 . 2]"
1 24 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 ARG 1.867 0.170 6 0 "[ . 1 . 2]"
1 33 TRP 1.867 0.170 6 0 "[ . 1 . 2]"
1 34 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 SER 0.070 0.025 14 0 "[ . 1 . 2]"
1 37 ARG 0.316 0.057 19 0 "[ . 1 . 2]"
1 38 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 ALA 0.154 0.025 14 0 "[ . 1 . 2]"
1 41 VAL 0.413 0.057 19 0 "[ . 1 . 2]"
1 42 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 ALA 0.662 0.061 7 0 "[ . 1 . 2]"
1 45 VAL 0.097 0.033 12 0 "[ . 1 . 2]"
1 46 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 ILE 0.578 0.061 7 0 "[ . 1 . 2]"
1 51 THR 1.492 0.149 15 0 "[ . 1 . 2]"
1 52 GLU 0.020 0.020 11 0 "[ . 1 . 2]"
1 53 ARG 0.236 0.092 7 0 "[ . 1 . 2]"
1 54 GLU 0.224 0.062 11 0 "[ . 1 . 2]"
1 55 ALA 1.492 0.149 15 0 "[ . 1 . 2]"
1 56 LEU 0.080 0.027 13 0 "[ . 1 . 2]"
1 57 ASP 0.236 0.092 7 0 "[ . 1 . 2]"
1 58 ARG 0.224 0.062 11 0 "[ . 1 . 2]"
1 61 LEU 0.060 0.027 13 0 "[ . 1 . 2]"
1 62 SER 0.216 0.062 16 0 "[ . 1 . 2]"
1 65 GLU 2.251 0.151 2 0 "[ . 1 . 2]"
1 66 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 ALA 0.093 0.028 19 0 "[ . 1 . 2]"
1 68 LEU 0.642 0.082 7 0 "[ . 1 . 2]"
1 69 TRP 2.106 0.151 2 0 "[ . 1 . 2]"
1 70 ARG 0.146 0.033 19 0 "[ . 1 . 2]"
1 71 SER 0.093 0.028 19 0 "[ . 1 . 2]"
1 72 ALA 0.642 0.082 7 0 "[ . 1 . 2]"
1 73 VAL 0.072 0.025 16 0 "[ . 1 . 2]"
1 74 ALA 0.146 0.033 19 0 "[ . 1 . 2]"
1 86 ILE 0.081 0.025 3 0 "[ . 1 . 2]"
1 87 GLN 0.781 0.150 12 0 "[ . 1 . 2]"
1 90 ARG 0.081 0.025 3 0 "[ . 1 . 2]"
1 91 GLN 0.781 0.150 12 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 12 VAL H 1 20 LEU O 1.900 . 2.355 1.784 1.756 1.825 0.044 12 0 "[ . 1 . 2]" 2
2 1 10 ARG O 1 22 ARG H 1.900 . 2.355 1.979 1.785 2.130 0.015 9 0 "[ . 1 . 2]" 2
3 1 35 ALA O 1 39 ALA H 1.900 . 2.355 1.893 1.805 2.043 . 0 0 "[ . 1 . 2]" 2
4 1 36 SER O 1 40 ALA H 1.900 . 2.355 2.218 1.964 2.381 0.025 14 0 "[ . 1 . 2]" 2
5 1 37 ARG O 1 41 VAL H 1.900 . 2.355 2.344 2.099 2.412 0.057 19 0 "[ . 1 . 2]" 2
6 1 38 LYS O 1 42 VAL H 1.900 . 2.355 2.040 1.963 2.109 . 0 0 "[ . 1 . 2]" 2
7 1 39 ALA O 1 43 LYS H 1.900 . 2.355 1.909 1.801 2.053 . 0 0 "[ . 1 . 2]" 2
8 1 40 ALA O 1 44 ALA H 1.900 . 2.355 2.264 2.109 2.377 0.022 4 0 "[ . 1 . 2]" 2
9 1 41 VAL O 1 45 VAL H 1.900 . 2.400 2.342 2.193 2.433 0.033 12 0 "[ . 1 . 2]" 2
10 1 42 VAL O 1 46 ILE H 1.900 . 2.355 2.007 1.917 2.154 . 0 0 "[ . 1 . 2]" 2
11 1 52 GLU O 1 56 LEU H 1.900 . 2.355 2.078 1.848 2.375 0.020 11 0 "[ . 1 . 2]" 2
12 1 53 ARG O 1 57 ASP H 1.900 . 2.355 2.163 1.708 2.421 0.092 7 0 "[ . 1 . 2]" 2
13 1 54 GLU O 1 58 ARG H 1.900 . 2.355 1.937 1.738 2.405 0.062 11 0 "[ . 1 . 2]" 2
14 1 66 PHE O 1 70 ARG H 1.900 . 2.355 1.991 1.831 2.147 . 0 0 "[ . 1 . 2]" 2
15 1 67 ALA O 1 71 SER H 1.900 . 2.355 2.275 1.962 2.383 0.028 19 0 "[ . 1 . 2]" 2
16 1 68 LEU O 1 72 ALA H 1.900 . 2.000 2.015 1.846 2.082 0.082 7 0 "[ . 1 . 2]" 2
17 1 69 TRP O 1 73 VAL H 1.900 . 2.355 1.973 1.775 2.381 0.025 16 0 "[ . 1 . 2]" 2
18 1 87 GLN O 1 91 GLN H 1.900 . 2.200 2.174 1.790 2.350 0.150 12 0 "[ . 1 . 2]" 2
19 1 14 LEU H 1 18 THR O 1.900 . 2.355 1.852 1.755 2.008 0.045 18 0 "[ . 1 . 2]" 2
20 1 14 LEU O 1 17 GLY H 1.900 . 2.355 2.060 1.894 2.234 . 0 0 "[ . 1 . 2]" 2
21 1 12 VAL O 1 20 LEU H 1.900 . 2.355 1.828 1.740 1.950 0.060 3 0 "[ . 1 . 2]" 2
22 1 21 SER O 1 24 ASP H 1.900 . 2.355 2.032 1.931 2.192 . 0 0 "[ . 1 . 2]" 2
23 1 31 ARG O 1 33 TRP H 1.900 . 2.000 2.080 1.823 2.170 0.170 6 0 "[ . 1 . 2]" 2
24 1 34 VAL O 1 38 LYS H 1.900 . 2.355 2.022 1.918 2.129 . 0 0 "[ . 1 . 2]" 2
25 1 43 LYS O 1 47 HIS H 1.900 . 2.355 2.052 1.905 2.263 . 0 0 "[ . 1 . 2]" 2
26 1 44 ALA O 1 50 ILE H 1.900 . 2.355 2.377 2.200 2.417 0.061 7 0 "[ . 1 . 2]" 2
27 1 51 THR O 1 55 ALA H 1.900 . 2.100 2.171 2.038 2.249 0.149 15 0 "[ . 1 . 2]" 2
28 1 56 LEU O 1 61 LEU H 1.900 . 2.355 1.904 1.773 2.163 0.027 13 0 "[ . 1 . 2]" 2
29 1 62 SER O 1 65 GLU H 1.900 . 2.355 2.296 2.082 2.418 0.062 16 0 "[ . 1 . 2]" 2
30 1 62 SER O 1 66 PHE H 1.900 . 2.355 2.137 1.904 2.297 . 0 0 "[ . 1 . 2]" 2
31 1 65 GLU O 1 69 TRP H 1.900 . 2.000 2.102 2.035 2.151 0.151 2 0 "[ . 1 . 2]" 2
32 1 70 ARG O 1 74 ALA H 1.900 . 2.355 2.266 1.981 2.389 0.033 19 0 "[ . 1 . 2]" 2
33 1 86 ILE O 1 90 ARG H 1.900 . 2.355 2.095 1.788 2.381 0.025 3 0 "[ . 1 . 2]" 2
stop_
save_
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