NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
494359 |
2l6e   |
17307 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2l6e
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 1443
_Distance_constraint_stats_list.Viol_count 1913
_Distance_constraint_stats_list.Viol_total 2977.207
_Distance_constraint_stats_list.Viol_max 1.566
_Distance_constraint_stats_list.Viol_rms 0.0383
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0052
_Distance_constraint_stats_list.Viol_average_violations_only 0.0778
_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 21 MET 0.496 0.200 16 0 "[ . 1 . 2]"
1 22 THR 2.098 0.227 3 0 "[ . 1 . 2]"
1 23 SER 1.083 0.145 19 0 "[ . 1 . 2]"
1 24 ILE 0.897 0.335 18 0 "[ . 1 . 2]"
1 25 LEU 1.044 0.102 5 0 "[ . 1 . 2]"
1 26 ASP 0.050 0.047 13 0 "[ . 1 . 2]"
1 27 ILE 1.335 0.102 5 0 "[ . 1 . 2]"
1 28 ARG 0.488 0.247 7 0 "[ . 1 . 2]"
1 29 GLN 0.811 0.247 7 0 "[ . 1 . 2]"
1 30 GLY 1.144 0.075 10 0 "[ . 1 . 2]"
1 31 PRO 1.857 0.116 9 0 "[ . 1 . 2]"
1 32 LYS 0.711 0.096 12 0 "[ . 1 . 2]"
1 33 GLU 1.719 0.110 14 0 "[ . 1 . 2]"
1 34 PRO 0.823 0.104 20 0 "[ . 1 . 2]"
1 35 PHE 0.968 0.065 11 0 "[ . 1 . 2]"
1 36 ARG 0.257 0.054 9 0 "[ . 1 . 2]"
1 37 ASP 0.885 0.104 20 0 "[ . 1 . 2]"
1 38 TYR 2.810 0.161 19 0 "[ . 1 . 2]"
1 39 VAL 6.509 0.208 11 0 "[ . 1 . 2]"
1 40 ASP 0.078 0.067 5 0 "[ . 1 . 2]"
1 41 ARG 1.163 0.160 15 0 "[ . 1 . 2]"
1 42 PHE 4.369 0.211 16 0 "[ . 1 . 2]"
1 43 TYR 6.373 0.156 2 0 "[ . 1 . 2]"
1 44 LYS 2.119 0.160 15 0 "[ . 1 . 2]"
1 45 THR 0.643 0.125 20 0 "[ . 1 . 2]"
1 46 LEU 3.125 0.211 16 0 "[ . 1 . 2]"
1 47 ARG 9.421 0.461 19 0 "[ . 1 . 2]"
1 48 ALA 0.063 0.063 19 0 "[ . 1 . 2]"
1 49 GLU 0.173 0.061 2 0 "[ . 1 . 2]"
1 50 GLN 0.486 0.119 20 0 "[ . 1 . 2]"
1 51 ALA 4.605 0.351 15 0 "[ . 1 . 2]"
1 52 SER 0.699 0.143 14 0 "[ . 1 . 2]"
1 53 GLN 0.724 0.371 13 0 "[ . 1 . 2]"
1 54 GLU 1.059 0.143 14 0 "[ . 1 . 2]"
1 55 VAL 6.189 0.781 4 2 "[ +. 1 - 2]"
1 56 LYS 3.628 0.259 2 0 "[ . 1 . 2]"
1 57 ASN 3.051 0.927 1 2 "[+ . - . 2]"
1 58 ALA 1.556 0.366 4 0 "[ . 1 . 2]"
1 59 ALA 5.423 0.781 4 5 "[ +. -1 . ** *]"
1 60 THR 5.645 0.436 7 0 "[ . 1 . 2]"
1 61 GLU 8.263 0.243 7 0 "[ . 1 . 2]"
1 62 THR 3.657 0.303 7 0 "[ . 1 . 2]"
1 63 LEU 15.149 0.782 20 6 "[ . * -* . ** +]"
1 64 LEU 4.356 0.248 15 0 "[ . 1 . 2]"
1 65 VAL 0.740 0.089 17 0 "[ . 1 . 2]"
1 66 GLN 4.653 0.277 7 0 "[ . 1 . 2]"
1 67 ASN 2.633 0.572 17 1 "[ . 1 . + 2]"
1 68 ALA 1.533 0.109 1 0 "[ . 1 . 2]"
1 69 ASN 1.032 0.116 9 0 "[ . 1 . 2]"
1 70 PRO 1.493 0.132 9 0 "[ . 1 . 2]"
1 71 ASP 2.259 0.165 12 0 "[ . 1 . 2]"
1 72 CYS 0.642 0.070 19 0 "[ . 1 . 2]"
1 73 LYS 0.880 0.089 17 0 "[ . 1 . 2]"
1 74 THR 0.858 0.101 8 0 "[ . 1 . 2]"
1 75 ILE 1.033 0.065 17 0 "[ . 1 . 2]"
1 76 LEU 1.590 0.110 14 0 "[ . 1 . 2]"
1 77 LYS 0.377 0.101 8 0 "[ . 1 . 2]"
1 78 ALA 0.354 0.058 5 0 "[ . 1 . 2]"
1 79 LEU 4.783 0.210 5 0 "[ . 1 . 2]"
1 80 GLY 0.613 0.065 9 0 "[ . 1 . 2]"
1 81 PRO 0.821 0.065 9 0 "[ . 1 . 2]"
1 82 ALA 0.898 0.139 16 0 "[ . 1 . 2]"
1 83 ALA 0.917 0.139 16 0 "[ . 1 . 2]"
1 84 THR 3.221 0.196 15 0 "[ . 1 . 2]"
1 85 LEU 3.284 0.196 6 0 "[ . 1 . 2]"
1 86 GLU 2.389 0.196 6 0 "[ . 1 . 2]"
1 87 GLU 4.146 0.210 5 0 "[ . 1 . 2]"
1 88 MET 6.866 0.240 3 0 "[ . 1 . 2]"
1 89 MET 1.912 0.155 18 0 "[ . 1 . 2]"
1 90 THR 1.940 0.185 6 0 "[ . 1 . 2]"
1 91 ALA 3.441 0.240 3 0 "[ . 1 . 2]"
1 92 CYS 0.168 0.043 14 0 "[ . 1 . 2]"
1 93 GLN 2.551 0.185 6 0 "[ . 1 . 2]"
1 94 GLY 0.220 0.115 1 0 "[ . 1 . 2]"
1 95 VAL 1.035 0.210 14 0 "[ . 1 . 2]"
1 96 GLY 0.011 0.010 20 0 "[ . 1 . 2]"
1 97 GLY 0.839 0.210 14 0 "[ . 1 . 2]"
1 98 PRO 0.284 0.091 6 0 "[ . 1 . 2]"
2 1 ILE 28.611 1.566 11 9 "[ **-* * 1+* * *2]"
2 2 THR 4.968 0.243 7 0 "[ . 1 . 2]"
2 3 PHE 14.142 0.927 1 3 "[+ . - . *2]"
2 5 ASP 13.195 1.566 11 6 "[ **-* 1+ * 2]"
2 6 LEU 13.559 0.312 13 0 "[ . 1 . 2]"
2 7 LEU 5.470 0.838 19 1 "[ . 1 . +2]"
2 9 TYR 1.200 0.107 8 0 "[ . 1 . 2]"
2 10 TYR 1.990 0.090 14 0 "[ . 1 . 2]"
2 11 GLY 0.310 0.133 10 0 "[ . 1 . 2]"
2 12 LYS 2.019 0.242 17 0 "[ . 1 . 2]"
2 13 LYS 1.628 0.242 17 0 "[ . 1 . 2]"
2 14 LYS 0.010 0.010 6 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 21 MET HA 1 21 MET QG 2.770 . 3.740 2.687 2.396 3.353 . 0 0 "[ . 1 . 2]" 1
2 1 21 MET HA 1 22 THR H 2.565 . 3.330 2.613 2.088 3.530 0.200 16 0 "[ . 1 . 2]" 1
3 1 21 MET QB 1 22 THR H 3.110 . 4.420 3.209 1.796 4.018 0.004 6 0 "[ . 1 . 2]" 1
4 1 22 THR H 1 22 THR HB 2.770 . 3.740 3.127 2.660 3.967 0.227 3 0 "[ . 1 . 2]" 1
5 1 22 THR H 1 22 THR MG 2.845 . 3.890 3.316 1.924 3.983 0.093 2 0 "[ . 1 . 2]" 1
6 1 22 THR H 1 23 SER H 3.030 . 4.260 3.655 1.989 4.393 0.133 12 0 "[ . 1 . 2]" 1
7 1 22 THR HA 1 22 THR MG 2.635 . 3.470 2.475 2.164 3.228 . 0 0 "[ . 1 . 2]" 1
8 1 22 THR HA 1 23 SER H 2.600 . 3.400 2.464 2.087 3.407 0.007 3 0 "[ . 1 . 2]" 1
9 1 22 THR HA 1 45 THR MG 2.955 . 4.110 3.320 2.187 4.209 0.099 10 0 "[ . 1 . 2]" 1
10 1 22 THR HB 1 23 SER H 3.195 . 4.590 4.118 2.052 4.616 0.026 10 0 "[ . 1 . 2]" 1
11 1 22 THR MG 1 23 SER H 2.955 . 4.110 3.583 2.014 4.255 0.145 19 0 "[ . 1 . 2]" 1
12 1 23 SER H 1 23 SER HB2 2.855 . 3.910 3.272 2.622 4.029 0.119 2 0 "[ . 1 . 2]" 1
13 1 23 SER H 1 23 SER QB 2.600 . 3.400 2.909 2.391 3.400 0.000 16 0 "[ . 1 . 2]" 1
14 1 23 SER H 1 23 SER HB3 2.855 . 3.910 3.528 2.533 4.012 0.102 3 0 "[ . 1 . 2]" 1
15 1 23 SER H 1 45 THR MG 3.325 . 4.850 3.369 2.225 4.609 . 0 0 "[ . 1 . 2]" 1
16 1 23 SER QB 1 25 LEU H 3.310 . 4.820 3.546 2.882 4.849 0.029 17 0 "[ . 1 . 2]" 1
17 1 23 SER QB 1 26 ASP H 3.195 . 4.590 3.355 2.714 4.144 . 0 0 "[ . 1 . 2]" 1
18 1 24 ILE H 1 24 ILE HB 2.945 . 4.090 2.605 2.181 3.192 . 0 0 "[ . 1 . 2]" 1
19 1 24 ILE H 1 24 ILE MD 3.290 . 4.780 3.923 3.459 4.368 . 0 0 "[ . 1 . 2]" 1
20 1 24 ILE H 1 24 ILE MG 2.695 . 3.590 2.648 2.055 3.925 0.335 18 0 "[ . 1 . 2]" 1
21 1 24 ILE H 1 25 LEU H 3.020 . 4.240 2.778 2.494 3.616 . 0 0 "[ . 1 . 2]" 1
22 1 24 ILE HA 1 24 ILE MD 2.635 . 3.470 1.936 1.794 2.469 0.006 13 0 "[ . 1 . 2]" 1
23 1 24 ILE HA 1 24 ILE MG 2.710 . 3.620 3.172 2.719 3.226 . 0 0 "[ . 1 . 2]" 1
24 1 24 ILE HA 1 27 ILE H 2.815 . 3.830 3.413 3.080 3.776 . 0 0 "[ . 1 . 2]" 1
25 1 24 ILE HA 1 27 ILE HB 3.055 . 4.310 3.341 2.473 3.953 . 0 0 "[ . 1 . 2]" 1
26 1 24 ILE HA 1 27 ILE MD 3.325 . 4.850 3.810 3.407 4.630 . 0 0 "[ . 1 . 2]" 1
27 1 24 ILE HA 1 27 ILE HG12 3.045 . 4.290 2.354 1.977 3.185 . 0 0 "[ . 1 . 2]" 1
28 1 24 ILE HA 1 27 ILE HG13 3.045 . 4.290 2.837 2.394 3.886 . 0 0 "[ . 1 . 2]" 1
29 1 24 ILE HA 1 45 THR MG 2.655 . 3.510 2.581 2.187 3.130 . 0 0 "[ . 1 . 2]" 1
30 1 24 ILE HB 1 24 ILE MD 2.765 . 3.730 2.528 2.380 3.240 . 0 0 "[ . 1 . 2]" 1
31 1 24 ILE HB 1 45 THR MG 2.890 . 3.980 3.103 2.621 3.989 0.009 18 0 "[ . 1 . 2]" 1
32 1 24 ILE MD 1 24 ILE MG 2.830 . 3.860 3.063 1.972 3.255 . 0 0 "[ . 1 . 2]" 1
33 1 24 ILE MD 1 27 ILE H 3.320 . 4.840 3.962 3.414 4.548 . 0 0 "[ . 1 . 2]" 1
34 1 24 ILE MD 1 27 ILE HB 3.355 . 4.910 2.598 2.132 3.476 . 0 0 "[ . 1 . 2]" 1
35 1 24 ILE MD 1 27 ILE QG 2.785 . 3.770 2.114 1.771 2.938 0.029 4 0 "[ . 1 . 2]" 1
36 1 24 ILE MD 1 27 ILE MG 2.855 . 3.910 2.986 2.574 3.929 0.019 5 0 "[ . 1 . 2]" 1
37 1 24 ILE MD 1 42 PHE HA 2.860 . 3.920 2.668 2.194 3.558 . 0 0 "[ . 1 . 2]" 1
38 1 24 ILE MD 1 42 PHE QD 3.290 . 4.780 2.904 2.379 3.419 . 0 0 "[ . 1 . 2]" 1
39 1 24 ILE MD 1 42 PHE QE 3.020 . 4.240 3.097 2.371 3.473 . 0 0 "[ . 1 . 2]" 1
40 1 24 ILE MD 1 42 PHE HZ 3.405 . 5.010 3.803 3.220 4.289 . 0 0 "[ . 1 . 2]" 1
41 1 24 ILE MD 1 45 THR H 3.200 . 4.600 4.094 3.697 4.623 0.023 12 0 "[ . 1 . 2]" 1
42 1 24 ILE MD 1 45 THR HB 2.790 . 3.780 2.348 1.832 2.904 . 0 0 "[ . 1 . 2]" 1
43 1 24 ILE MD 1 45 THR MG 2.600 . 3.400 2.620 2.231 3.306 . 0 0 "[ . 1 . 2]" 1
44 1 24 ILE MD 1 46 LEU H 3.005 . 4.210 2.949 2.436 3.524 . 0 0 "[ . 1 . 2]" 1
45 1 24 ILE MD 1 46 LEU HA 3.065 . 4.330 3.110 2.436 4.120 . 0 0 "[ . 1 . 2]" 1
46 1 24 ILE MD 1 46 LEU QB 2.995 . 4.190 2.890 1.960 4.128 . 0 0 "[ . 1 . 2]" 1
47 1 24 ILE MD 1 46 LEU QD 2.935 . 4.070 2.643 2.268 3.160 . 0 0 "[ . 1 . 2]" 1
48 1 24 ILE QG 1 24 ILE MG 2.495 . 3.190 2.132 2.081 2.335 . 0 0 "[ . 1 . 2]" 1
49 1 24 ILE QG 1 45 THR MG 3.065 . 4.330 3.783 1.815 4.349 0.019 4 0 "[ . 1 . 2]" 1
50 1 24 ILE QG 1 46 LEU QB 3.305 . 4.810 3.630 2.326 4.863 0.053 6 0 "[ . 1 . 2]" 1
51 1 24 ILE MG 1 25 LEU H 2.610 . 3.420 2.560 2.091 2.993 . 0 0 "[ . 1 . 2]" 1
52 1 24 ILE MG 1 25 LEU HG 2.685 . 3.570 2.823 2.123 3.600 0.030 17 0 "[ . 1 . 2]" 1
53 1 24 ILE MG 1 26 ASP H 3.200 . 4.600 4.398 4.067 4.592 . 0 0 "[ . 1 . 2]" 1
54 1 24 ILE MG 1 45 THR MG 3.245 . 4.690 4.202 3.873 4.759 0.069 19 0 "[ . 1 . 2]" 1
55 1 25 LEU H 1 25 LEU HB2 2.455 . 3.110 2.479 2.406 2.573 . 0 0 "[ . 1 . 2]" 1
56 1 25 LEU H 1 25 LEU HB3 2.720 . 3.640 3.590 3.574 3.620 . 0 0 "[ . 1 . 2]" 1
57 1 25 LEU H 1 25 LEU MD1 2.985 . 4.170 3.449 1.782 3.754 0.018 10 0 "[ . 1 . 2]" 1
58 1 25 LEU H 1 25 LEU QD 2.615 . 3.430 2.924 1.779 3.220 0.021 10 0 "[ . 1 . 2]" 1
59 1 25 LEU H 1 25 LEU MD2 2.985 . 4.170 3.344 3.045 3.950 . 0 0 "[ . 1 . 2]" 1
60 1 25 LEU H 1 25 LEU HG 2.730 . 3.660 2.396 2.096 3.478 . 0 0 "[ . 1 . 2]" 1
61 1 25 LEU H 1 26 ASP H 2.530 . 3.260 2.548 2.261 2.721 . 0 0 "[ . 1 . 2]" 1
62 1 25 LEU HA 1 25 LEU QD 2.800 . 3.800 2.102 1.893 2.941 . 0 0 "[ . 1 . 2]" 1
63 1 25 LEU HA 1 25 LEU HG 2.935 . 4.070 3.069 2.479 3.217 . 0 0 "[ . 1 . 2]" 1
64 1 25 LEU HA 1 67 ASN QD 3.225 . 4.650 2.905 2.275 3.505 . 0 0 "[ . 1 . 2]" 1
65 1 25 LEU HB2 1 26 ASP H 2.855 . 3.910 3.068 2.841 3.426 . 0 0 "[ . 1 . 2]" 1
66 1 25 LEU HB2 1 27 ILE H 3.350 . 4.900 4.935 4.791 5.002 0.102 5 0 "[ . 1 . 2]" 1
67 1 25 LEU HB3 1 25 LEU QD 2.470 . 3.140 2.125 2.109 2.199 . 0 0 "[ . 1 . 2]" 1
68 1 25 LEU HB3 1 26 ASP H 3.005 . 4.210 3.994 3.856 4.178 . 0 0 "[ . 1 . 2]" 1
69 1 25 LEU QD 1 26 ASP H 3.085 . 4.370 4.191 3.720 4.325 . 0 0 "[ . 1 . 2]" 1
70 1 26 ASP H 1 26 ASP HB2 2.780 . 3.760 2.595 2.296 3.246 . 0 0 "[ . 1 . 2]" 1
71 1 26 ASP H 1 26 ASP QB 2.480 . 3.160 2.378 2.270 2.977 . 0 0 "[ . 1 . 2]" 1
72 1 26 ASP H 1 26 ASP HB3 2.780 . 3.760 3.056 2.475 3.623 . 0 0 "[ . 1 . 2]" 1
73 1 26 ASP H 1 27 ILE H 2.460 . 3.120 2.327 2.182 2.452 . 0 0 "[ . 1 . 2]" 1
74 1 26 ASP HA 1 28 ARG H 3.570 . 5.340 4.701 4.296 5.343 0.003 17 0 "[ . 1 . 2]" 1
75 1 26 ASP QB 1 27 ILE H 2.850 . 3.900 3.216 2.892 3.511 . 0 0 "[ . 1 . 2]" 1
76 1 26 ASP HB2 1 27 ILE H 3.120 . 4.440 3.815 3.095 4.302 . 0 0 "[ . 1 . 2]" 1
77 1 26 ASP HB3 1 27 ILE H 3.120 . 4.440 3.702 2.960 4.487 0.047 13 0 "[ . 1 . 2]" 1
78 1 27 ILE H 1 27 ILE HB 2.495 . 3.190 2.567 2.518 2.661 . 0 0 "[ . 1 . 2]" 1
79 1 27 ILE H 1 27 ILE MD 2.760 . 3.720 3.285 3.055 3.419 . 0 0 "[ . 1 . 2]" 1
80 1 27 ILE H 1 27 ILE HG12 2.895 . 3.990 2.282 2.046 2.451 . 0 0 "[ . 1 . 2]" 1
81 1 27 ILE H 1 27 ILE QG 2.545 . 3.290 2.263 2.034 2.426 . 0 0 "[ . 1 . 2]" 1
82 1 27 ILE H 1 27 ILE HG13 2.895 . 3.990 3.738 3.582 3.881 . 0 0 "[ . 1 . 2]" 1
83 1 27 ILE H 1 27 ILE MG 2.805 . 3.810 3.799 3.775 3.819 0.009 5 0 "[ . 1 . 2]" 1
84 1 27 ILE H 1 28 ARG H 3.095 . 4.390 4.070 3.830 4.373 . 0 0 "[ . 1 . 2]" 1
85 1 27 ILE H 1 45 THR MG 3.440 . 5.080 4.827 4.412 5.097 0.017 4 0 "[ . 1 . 2]" 1
86 1 27 ILE H 1 67 ASN QD 3.570 . 5.340 3.960 2.903 4.635 . 0 0 "[ . 1 . 2]" 1
87 1 27 ILE HA 1 27 ILE MD 2.600 . 3.400 2.042 1.975 2.143 . 0 0 "[ . 1 . 2]" 1
88 1 27 ILE HA 1 27 ILE MG 2.545 . 3.290 2.371 2.319 2.426 . 0 0 "[ . 1 . 2]" 1
89 1 27 ILE HA 1 28 ARG H 2.355 . 2.910 2.222 2.112 2.317 . 0 0 "[ . 1 . 2]" 1
90 1 27 ILE HB 1 27 ILE MD 2.970 . 4.140 3.238 3.230 3.242 . 0 0 "[ . 1 . 2]" 1
91 1 27 ILE HB 1 28 ARG H 3.170 . 4.540 4.424 4.357 4.468 . 0 0 "[ . 1 . 2]" 1
92 1 27 ILE HB 1 45 THR MG 3.525 . 5.250 4.550 4.186 5.123 . 0 0 "[ . 1 . 2]" 1
93 1 27 ILE MD 1 27 ILE MG 2.370 . 2.940 1.994 1.950 2.028 . 0 0 "[ . 1 . 2]" 1
94 1 27 ILE MD 1 28 ARG H 2.905 . 4.010 3.911 3.655 4.026 0.016 5 0 "[ . 1 . 2]" 1
95 1 27 ILE MD 1 42 PHE HA 3.020 . 4.240 3.805 3.262 4.123 . 0 0 "[ . 1 . 2]" 1
96 1 27 ILE MD 1 45 THR HB 3.475 . 5.150 3.729 3.131 4.382 . 0 0 "[ . 1 . 2]" 1
97 1 27 ILE MD 1 45 THR MG 2.760 . 3.720 2.867 2.144 3.282 . 0 0 "[ . 1 . 2]" 1
98 1 27 ILE QG 1 45 THR H 3.570 . 5.340 4.660 3.983 5.212 . 0 0 "[ . 1 . 2]" 1
99 1 27 ILE QG 1 45 THR HB 3.360 . 4.920 2.773 2.422 3.148 . 0 0 "[ . 1 . 2]" 1
100 1 27 ILE QG 1 45 THR MG 2.680 . 3.560 2.523 2.229 2.945 . 0 0 "[ . 1 . 2]" 1
101 1 27 ILE HG12 1 45 THR MG 3.085 . 4.370 3.005 2.589 3.325 . 0 0 "[ . 1 . 2]" 1
102 1 27 ILE HG13 1 45 THR MG 3.085 . 4.370 2.748 2.306 3.376 . 0 0 "[ . 1 . 2]" 1
103 1 27 ILE MG 1 28 ARG H 2.750 . 3.700 3.433 3.037 3.699 . 0 0 "[ . 1 . 2]" 1
104 1 27 ILE MG 1 38 TYR QD 2.750 . 3.700 3.028 2.544 3.366 . 0 0 "[ . 1 . 2]" 1
105 1 27 ILE MG 1 38 TYR QE . . 3.530 2.330 1.792 2.936 0.008 16 0 "[ . 1 . 2]" 1
106 1 27 ILE MG 1 38 TYR HH 3.495 . 5.190 4.455 3.493 5.198 0.008 2 0 "[ . 1 . 2]" 1
107 1 27 ILE MG 1 41 ARG H 3.380 . 4.960 4.652 4.011 4.989 0.029 6 0 "[ . 1 . 2]" 1
108 1 27 ILE MG 1 41 ARG QB 3.120 . 4.440 3.312 2.205 4.006 . 0 0 "[ . 1 . 2]" 1
109 1 27 ILE MG 1 41 ARG HE 3.345 . 4.890 3.501 1.902 4.851 . 0 0 "[ . 1 . 2]" 1
110 1 27 ILE MG 1 42 PHE H 2.920 . 4.040 3.175 2.619 3.498 . 0 0 "[ . 1 . 2]" 1
111 1 27 ILE MG 1 42 PHE HA 2.515 . 3.230 1.959 1.753 2.318 0.047 14 0 "[ . 1 . 2]" 1
112 1 27 ILE MG 1 42 PHE QB 3.065 . 4.330 2.445 1.988 2.742 . 0 0 "[ . 1 . 2]" 1
113 1 27 ILE MG 1 42 PHE QD 2.780 . 3.760 2.358 1.802 2.690 . 0 0 "[ . 1 . 2]" 1
114 1 27 ILE MG 1 45 THR H 3.650 . 5.500 4.959 4.684 5.473 . 0 0 "[ . 1 . 2]" 1
115 1 27 ILE MG 1 67 ASN QD 3.570 . 5.340 4.085 3.605 4.700 . 0 0 "[ . 1 . 2]" 1
116 1 28 ARG H 1 28 ARG HB2 2.890 . 3.980 2.860 2.386 3.874 . 0 0 "[ . 1 . 2]" 1
117 1 28 ARG H 1 28 ARG QB 2.560 . 3.320 2.595 2.327 3.212 . 0 0 "[ . 1 . 2]" 1
118 1 28 ARG H 1 28 ARG HB3 2.890 . 3.980 3.376 2.442 3.825 . 0 0 "[ . 1 . 2]" 1
119 1 28 ARG H 1 28 ARG HD2 3.650 . 5.500 4.738 2.125 5.417 . 0 0 "[ . 1 . 2]" 1
120 1 28 ARG H 1 28 ARG HD3 3.650 . 5.500 4.906 3.063 5.483 . 0 0 "[ . 1 . 2]" 1
121 1 28 ARG H 1 28 ARG HG2 3.575 . 5.350 3.851 2.246 4.475 . 0 0 "[ . 1 . 2]" 1
122 1 28 ARG H 1 28 ARG QG 3.215 . 4.630 3.108 2.210 4.043 . 0 0 "[ . 1 . 2]" 1
123 1 28 ARG H 1 28 ARG HG3 3.575 . 5.350 3.485 2.568 4.680 . 0 0 "[ . 1 . 2]" 1
124 1 28 ARG H 1 29 GLN H 3.210 . 4.620 4.450 4.362 4.548 . 0 0 "[ . 1 . 2]" 1
125 1 28 ARG H 1 38 TYR QE 3.360 . 4.920 4.089 3.481 4.656 . 0 0 "[ . 1 . 2]" 1
126 1 28 ARG HA 1 29 GLN H 2.445 . 3.090 2.275 2.159 2.357 . 0 0 "[ . 1 . 2]" 1
127 1 28 ARG HA 1 67 ASN HB3 2.755 . 3.710 1.940 1.730 2.275 0.070 20 0 "[ . 1 . 2]" 1
128 1 28 ARG QB 1 28 ARG QD 2.560 . 3.320 2.172 2.091 2.346 . 0 0 "[ . 1 . 2]" 1
129 1 28 ARG QB 1 29 GLN H 2.930 . 4.060 2.916 2.508 3.660 . 0 0 "[ . 1 . 2]" 1
130 1 28 ARG QB 1 67 ASN HB3 3.150 . 4.500 3.148 2.273 4.115 . 0 0 "[ . 1 . 2]" 1
131 1 28 ARG QD 1 29 GLN H 3.420 . 5.040 4.675 3.012 5.287 0.247 7 0 "[ . 1 . 2]" 1
132 1 28 ARG QG 1 67 ASN HB3 3.005 . 4.210 2.837 1.813 4.257 0.047 17 0 "[ . 1 . 2]" 1
133 1 28 ARG HG2 1 29 GLN H 3.650 . 5.500 3.906 2.186 4.893 . 0 0 "[ . 1 . 2]" 1
134 1 28 ARG HG2 1 67 ASN HB3 3.345 . 4.890 3.336 1.822 4.881 . 0 0 "[ . 1 . 2]" 1
135 1 28 ARG HG3 1 29 GLN H 3.650 . 5.500 4.210 2.651 5.089 . 0 0 "[ . 1 . 2]" 1
136 1 28 ARG HG3 1 67 ASN HB3 3.345 . 4.890 3.626 2.363 4.894 0.004 17 0 "[ . 1 . 2]" 1
137 1 29 GLN H 1 29 GLN QB 2.625 . 3.450 2.266 2.218 2.316 . 0 0 "[ . 1 . 2]" 1
138 1 29 GLN H 1 29 GLN HG2 3.615 . 5.430 4.448 4.338 4.528 . 0 0 "[ . 1 . 2]" 1
139 1 29 GLN H 1 38 TYR QD 3.180 . 4.560 3.940 3.338 4.332 . 0 0 "[ . 1 . 2]" 1
140 1 29 GLN H 1 38 TYR QE 2.990 . 4.180 3.276 2.979 3.654 . 0 0 "[ . 1 . 2]" 1
141 1 29 GLN H 1 67 ASN HB3 2.865 . 3.930 3.224 2.815 3.792 . 0 0 "[ . 1 . 2]" 1
142 1 29 GLN H 1 68 ALA HA 2.880 . 3.960 3.162 2.831 3.475 . 0 0 "[ . 1 . 2]" 1
143 1 29 GLN H 1 69 ASN H 3.260 . 4.720 4.609 4.285 4.774 0.054 14 0 "[ . 1 . 2]" 1
144 1 29 GLN HA 1 30 GLY H 2.675 . 3.550 2.169 2.123 2.213 . 0 0 "[ . 1 . 2]" 1
145 1 29 GLN HA 1 38 TYR QD 3.120 . 4.440 2.832 2.347 3.165 . 0 0 "[ . 1 . 2]" 1
146 1 29 GLN QB 1 68 ALA H 3.570 . 5.340 4.482 4.209 4.830 . 0 0 "[ . 1 . 2]" 1
147 1 29 GLN QB 1 69 ASN H 2.635 . 3.470 2.545 2.210 2.825 . 0 0 "[ . 1 . 2]" 1
148 1 29 GLN HB2 1 68 ALA HA 2.875 . 3.950 2.664 2.310 3.177 . 0 0 "[ . 1 . 2]" 1
149 1 29 GLN HB3 1 68 ALA HA 2.875 . 3.950 2.202 1.768 2.596 0.032 18 0 "[ . 1 . 2]" 1
150 1 29 GLN QE 1 35 PHE H 3.080 . 4.360 3.341 2.847 3.986 . 0 0 "[ . 1 . 2]" 1
151 1 29 GLN QE 1 35 PHE HA 2.785 . 3.770 3.001 2.073 3.604 . 0 0 "[ . 1 . 2]" 1
152 1 29 GLN QE 1 35 PHE QB 3.015 . 4.230 2.851 2.199 3.360 . 0 0 "[ . 1 . 2]" 1
153 1 29 GLN QE 1 35 PHE QD 2.930 . 4.060 3.050 1.938 3.687 . 0 0 "[ . 1 . 2]" 1
154 1 29 GLN QE 1 69 ASN H 3.340 . 4.880 3.971 3.405 4.562 . 0 0 "[ . 1 . 2]" 1
155 1 29 GLN QE 1 69 ASN QD 2.950 . 4.100 3.184 2.134 4.184 0.084 11 0 "[ . 1 . 2]" 1
156 1 29 GLN HE21 1 35 PHE H 3.380 . 4.960 3.767 3.129 4.312 . 0 0 "[ . 1 . 2]" 1
157 1 29 GLN HE21 1 35 PHE HA 3.065 . 4.330 3.341 2.170 4.052 . 0 0 "[ . 1 . 2]" 1
158 1 29 GLN HE21 1 35 PHE QD 3.260 . 4.720 4.066 2.343 4.785 0.065 11 0 "[ . 1 . 2]" 1
159 1 29 GLN HE22 1 35 PHE H 3.380 . 4.960 3.768 3.068 4.690 . 0 0 "[ . 1 . 2]" 1
160 1 29 GLN HE22 1 35 PHE HA 3.065 . 4.330 3.495 2.495 4.141 . 0 0 "[ . 1 . 2]" 1
161 1 29 GLN HE22 1 35 PHE QD 3.260 . 4.720 3.164 1.958 3.842 . 0 0 "[ . 1 . 2]" 1
162 1 29 GLN HG2 1 30 GLY H 2.915 . 4.030 2.921 2.478 3.453 . 0 0 "[ . 1 . 2]" 1
163 1 29 GLN HG2 1 31 PRO HA 3.650 . 5.500 4.884 4.357 5.524 0.024 12 0 "[ . 1 . 2]" 1
164 1 29 GLN HG2 1 33 GLU H 3.260 . 4.720 3.781 3.512 4.126 . 0 0 "[ . 1 . 2]" 1
165 1 29 GLN HG2 1 68 ALA HA 3.465 . 5.130 4.451 3.925 4.906 . 0 0 "[ . 1 . 2]" 1
166 1 29 GLN HG2 1 69 ASN QD 3.210 . 4.620 2.452 1.864 3.951 . 0 0 "[ . 1 . 2]" 1
167 1 29 GLN HG3 1 30 GLY H 3.090 . 4.380 3.361 2.904 3.865 . 0 0 "[ . 1 . 2]" 1
168 1 29 GLN HG3 1 33 GLU QG 2.780 . 3.760 3.126 2.577 3.767 0.007 17 0 "[ . 1 . 2]" 1
169 1 30 GLY H 1 31 PRO HD2 3.275 . 4.750 4.724 4.583 4.798 0.048 7 0 "[ . 1 . 2]" 1
170 1 30 GLY H 1 33 GLU H 2.900 . 4.000 4.016 3.861 4.075 0.075 10 0 "[ . 1 . 2]" 1
171 1 30 GLY H 1 33 GLU HB2 2.725 . 3.650 2.755 2.050 3.157 . 0 0 "[ . 1 . 2]" 1
172 1 30 GLY H 1 33 GLU HB3 2.725 . 3.650 2.199 1.961 3.066 . 0 0 "[ . 1 . 2]" 1
173 1 30 GLY H 1 33 GLU QG 3.075 . 4.350 3.115 2.338 3.569 . 0 0 "[ . 1 . 2]" 1
174 1 30 GLY H 1 38 TYR QB 3.290 . 4.780 4.295 3.665 4.800 0.020 11 0 "[ . 1 . 2]" 1
175 1 30 GLY H 1 38 TYR QD 3.290 . 4.780 4.640 4.260 4.854 0.074 10 0 "[ . 1 . 2]" 1
176 1 30 GLY H 1 69 ASN QD 3.250 . 4.700 4.062 3.670 4.642 . 0 0 "[ . 1 . 2]" 1
177 1 30 GLY QA 1 31 PRO HG2 3.225 . 4.650 4.043 3.942 4.159 . 0 0 "[ . 1 . 2]" 1
178 1 30 GLY QA 1 31 PRO HG3 3.190 . 4.580 4.302 4.269 4.343 . 0 0 "[ . 1 . 2]" 1
179 1 30 GLY QA 1 33 GLU H 2.895 . 3.990 3.289 3.068 3.581 . 0 0 "[ . 1 . 2]" 1
180 1 31 PRO HA 1 33 GLU H 3.545 . 5.290 3.997 3.606 4.242 . 0 0 "[ . 1 . 2]" 1
181 1 31 PRO HA 1 69 ASN HA 3.650 . 5.500 5.231 4.327 5.616 0.116 9 0 "[ . 1 . 2]" 1
182 1 31 PRO HA 1 69 ASN HB2 3.100 . 4.400 3.983 2.291 4.488 0.088 17 0 "[ . 1 . 2]" 1
183 1 31 PRO HA 1 69 ASN HB3 3.100 . 4.400 3.754 2.297 4.452 0.052 11 0 "[ . 1 . 2]" 1
184 1 31 PRO HA 1 69 ASN QD 2.875 . 3.950 2.680 1.904 3.087 . 0 0 "[ . 1 . 2]" 1
185 1 31 PRO QB 1 32 LYS H 2.950 . 4.100 3.159 2.841 3.505 . 0 0 "[ . 1 . 2]" 1
186 1 31 PRO QB 1 32 LYS QG 3.105 . 4.410 3.312 2.610 4.440 0.030 5 0 "[ . 1 . 2]" 1
187 1 31 PRO HD2 1 32 LYS H 2.985 . 4.170 2.979 2.557 3.226 . 0 0 "[ . 1 . 2]" 1
188 1 31 PRO HD2 1 33 GLU H 3.055 . 4.310 4.353 4.300 4.420 0.110 14 0 "[ . 1 . 2]" 1
189 1 31 PRO HD3 1 32 LYS H 3.135 . 4.470 4.029 3.761 4.172 . 0 0 "[ . 1 . 2]" 1
190 1 31 PRO HD3 1 69 ASN QD 3.560 . 5.320 4.275 2.776 5.328 0.008 1 0 "[ . 1 . 2]" 1
191 1 31 PRO HG2 1 32 LYS H 2.695 . 3.590 2.598 2.375 2.971 . 0 0 "[ . 1 . 2]" 1
192 1 31 PRO HG2 1 32 LYS QG 2.690 . 3.580 3.007 2.590 3.470 . 0 0 "[ . 1 . 2]" 1
193 1 31 PRO HG2 1 33 GLU H 3.465 . 5.130 4.754 4.533 4.993 . 0 0 "[ . 1 . 2]" 1
194 1 31 PRO HG3 1 32 LYS H 3.270 . 4.740 4.085 3.937 4.332 . 0 0 "[ . 1 . 2]" 1
195 1 32 LYS H 1 32 LYS QB 2.615 . 3.430 2.705 2.450 3.040 . 0 0 "[ . 1 . 2]" 1
196 1 32 LYS H 1 32 LYS QG 2.775 . 3.750 2.535 1.926 3.055 . 0 0 "[ . 1 . 2]" 1
197 1 32 LYS H 1 33 GLU H 2.465 . 3.130 2.294 2.092 2.472 . 0 0 "[ . 1 . 2]" 1
198 1 32 LYS HA 1 32 LYS QG 2.520 . 3.240 2.833 2.374 3.336 0.096 12 0 "[ . 1 . 2]" 1
199 1 32 LYS HA 1 33 GLU H 2.685 . 3.570 3.074 2.869 3.186 . 0 0 "[ . 1 . 2]" 1
200 1 32 LYS QB 1 33 GLU H 2.965 . 4.130 3.757 3.491 4.014 . 0 0 "[ . 1 . 2]" 1
201 1 32 LYS QE 1 32 LYS QG 2.560 . 3.320 2.320 2.121 2.808 . 0 0 "[ . 1 . 2]" 1
202 1 32 LYS QG 1 33 GLU H 3.205 . 4.610 4.028 3.279 4.590 . 0 0 "[ . 1 . 2]" 1
203 1 33 GLU H 1 33 GLU HB2 2.575 . 3.350 2.697 2.160 3.030 . 0 0 "[ . 1 . 2]" 1
204 1 33 GLU H 1 33 GLU HB3 2.575 . 3.350 2.513 2.354 3.371 0.021 17 0 "[ . 1 . 2]" 1
205 1 33 GLU H 1 33 GLU HG2 3.300 . 4.800 4.430 4.300 4.638 . 0 0 "[ . 1 . 2]" 1
206 1 33 GLU H 1 33 GLU HG3 3.300 . 4.800 4.509 4.130 4.624 . 0 0 "[ . 1 . 2]" 1
207 1 33 GLU H 1 34 PRO QD 3.295 . 4.790 4.225 4.115 4.310 . 0 0 "[ . 1 . 2]" 1
208 1 33 GLU H 1 69 ASN QD 3.375 . 4.950 3.759 3.004 4.634 . 0 0 "[ . 1 . 2]" 1
209 1 33 GLU HA 1 33 GLU QG 2.745 . 3.690 2.506 2.138 2.845 . 0 0 "[ . 1 . 2]" 1
210 1 33 GLU HA 1 34 PRO HD2 2.760 . 3.720 2.118 1.820 2.678 . 0 0 "[ . 1 . 2]" 1
211 1 33 GLU HA 1 34 PRO QD 2.475 . 3.150 1.844 1.782 1.932 0.018 4 0 "[ . 1 . 2]" 1
212 1 33 GLU HA 1 34 PRO HD3 2.760 . 3.720 2.287 1.828 2.563 . 0 0 "[ . 1 . 2]" 1
213 1 33 GLU QG 1 34 PRO QD 2.915 . 4.030 2.400 1.853 2.993 . 0 0 "[ . 1 . 2]" 1
214 1 33 GLU QG 1 37 ASP H 3.570 . 5.340 4.361 3.843 5.100 . 0 0 "[ . 1 . 2]" 1
215 1 33 GLU QG 1 37 ASP QB 3.025 . 4.250 2.765 2.281 3.245 . 0 0 "[ . 1 . 2]" 1
216 1 33 GLU QG 1 38 TYR H 3.010 . 4.220 3.438 2.881 4.248 0.028 17 0 "[ . 1 . 2]" 1
217 1 33 GLU QG 1 38 TYR QB 3.490 . 5.180 2.939 2.530 3.639 . 0 0 "[ . 1 . 2]" 1
218 1 33 GLU HG2 1 37 ASP HB2 3.650 . 5.500 4.082 2.632 5.507 0.007 19 0 "[ . 1 . 2]" 1
219 1 33 GLU HG2 1 37 ASP HB3 3.650 . 5.500 4.033 2.698 5.166 . 0 0 "[ . 1 . 2]" 1
220 1 33 GLU HG2 1 38 TYR H 3.360 . 4.920 3.753 2.964 4.700 . 0 0 "[ . 1 . 2]" 1
221 1 33 GLU HG3 1 37 ASP HB2 3.650 . 5.500 3.553 2.562 5.036 . 0 0 "[ . 1 . 2]" 1
222 1 33 GLU HG3 1 37 ASP HB3 3.650 . 5.500 3.505 2.690 4.321 . 0 0 "[ . 1 . 2]" 1
223 1 33 GLU HG3 1 38 TYR H 3.360 . 4.920 4.359 3.391 4.962 0.042 19 0 "[ . 1 . 2]" 1
224 1 34 PRO HA 1 35 PHE H 2.480 . 3.160 2.165 2.113 2.270 . 0 0 "[ . 1 . 2]" 1
225 1 34 PRO HB2 1 37 ASP H 2.695 . 3.590 2.578 1.962 2.926 . 0 0 "[ . 1 . 2]" 1
226 1 34 PRO HB3 1 35 PHE H 3.055 . 4.310 3.666 3.301 3.873 . 0 0 "[ . 1 . 2]" 1
227 1 34 PRO HB3 1 36 ARG H 3.090 . 4.380 3.898 3.213 4.222 . 0 0 "[ . 1 . 2]" 1
228 1 34 PRO HB3 1 37 ASP H 3.145 . 4.490 4.263 3.390 4.568 0.078 7 0 "[ . 1 . 2]" 1
229 1 34 PRO QD 1 37 ASP QB 3.015 . 4.230 2.890 1.950 3.630 . 0 0 "[ . 1 . 2]" 1
230 1 34 PRO QG 1 35 PHE H 3.320 . 4.840 4.651 4.469 4.789 . 0 0 "[ . 1 . 2]" 1
231 1 34 PRO QG 1 37 ASP H 2.925 . 4.050 3.108 2.526 3.804 . 0 0 "[ . 1 . 2]" 1
232 1 34 PRO HG2 1 37 ASP H 3.320 . 4.840 3.170 2.550 3.959 . 0 0 "[ . 1 . 2]" 1
233 1 34 PRO HG3 1 37 ASP H 3.320 . 4.840 4.552 4.110 4.944 0.104 20 0 "[ . 1 . 2]" 1
234 1 35 PHE H 1 35 PHE HB2 2.760 . 3.720 2.422 2.337 2.531 . 0 0 "[ . 1 . 2]" 1
235 1 35 PHE H 1 35 PHE HB3 2.760 . 3.720 2.585 2.481 2.692 . 0 0 "[ . 1 . 2]" 1
236 1 35 PHE H 1 35 PHE QD 3.230 . 4.660 4.150 4.098 4.179 . 0 0 "[ . 1 . 2]" 1
237 1 35 PHE H 1 36 ARG H 2.780 . 3.760 2.667 2.531 2.780 . 0 0 "[ . 1 . 2]" 1
238 1 35 PHE H 1 37 ASP H 3.280 . 4.760 4.419 4.214 4.657 . 0 0 "[ . 1 . 2]" 1
239 1 35 PHE HA 1 35 PHE QD 2.880 . 3.960 2.737 2.612 2.909 . 0 0 "[ . 1 . 2]" 1
240 1 35 PHE HA 1 37 ASP H 3.250 . 4.700 4.358 3.975 4.540 . 0 0 "[ . 1 . 2]" 1
241 1 35 PHE HA 1 38 TYR H 2.800 . 3.800 3.237 3.082 3.378 . 0 0 "[ . 1 . 2]" 1
242 1 35 PHE HA 1 38 TYR HB2 3.110 . 4.420 3.135 2.850 3.470 . 0 0 "[ . 1 . 2]" 1
243 1 35 PHE HA 1 38 TYR QB 2.785 . 3.770 2.104 1.836 2.383 . 0 0 "[ . 1 . 2]" 1
244 1 35 PHE HA 1 38 TYR HB3 3.110 . 4.420 2.140 1.856 2.427 . 0 0 "[ . 1 . 2]" 1
245 1 35 PHE HA 1 38 TYR QD 3.650 . 5.500 3.166 2.737 3.677 . 0 0 "[ . 1 . 2]" 1
246 1 35 PHE HA 1 39 VAL H 3.110 . 4.420 3.835 3.591 4.044 . 0 0 "[ . 1 . 2]" 1
247 1 35 PHE QB 1 92 CYS H 3.570 . 5.340 4.040 3.554 4.423 . 0 0 "[ . 1 . 2]" 1
248 1 35 PHE QB 1 92 CYS QB 2.715 . 3.630 2.105 1.757 2.398 0.043 14 0 "[ . 1 . 2]" 1
249 1 35 PHE HB2 1 36 ARG H 3.020 . 4.240 3.999 3.898 4.093 . 0 0 "[ . 1 . 2]" 1
250 1 35 PHE HB3 1 36 ARG H 3.020 . 4.240 2.917 2.813 3.001 . 0 0 "[ . 1 . 2]" 1
251 1 35 PHE QD 1 36 ARG H 3.110 . 4.420 4.031 3.817 4.313 . 0 0 "[ . 1 . 2]" 1
252 1 35 PHE QD 1 39 VAL QG 2.990 . 4.180 3.171 2.879 3.461 . 0 0 "[ . 1 . 2]" 1
253 1 35 PHE QD 1 64 LEU QD 3.305 . 4.810 4.251 3.914 4.585 . 0 0 "[ . 1 . 2]" 1
254 1 35 PHE QD 1 76 LEU MD1 3.185 . 4.570 3.635 2.835 4.109 . 0 0 "[ . 1 . 2]" 1
255 1 35 PHE QD 1 89 MET HA 2.825 . 3.850 2.021 1.771 2.648 0.029 19 0 "[ . 1 . 2]" 1
256 1 35 PHE QD 1 89 MET ME 3.160 . 4.520 3.511 2.929 3.936 . 0 0 "[ . 1 . 2]" 1
257 1 35 PHE QD 1 92 CYS HB2 3.355 . 4.910 3.949 3.112 4.848 . 0 0 "[ . 1 . 2]" 1
258 1 35 PHE QD 1 92 CYS HB3 3.355 . 4.910 3.795 3.419 4.238 . 0 0 "[ . 1 . 2]" 1
259 1 35 PHE QE 1 39 VAL QG 2.805 . 3.810 2.501 2.315 2.830 . 0 0 "[ . 1 . 2]" 1
260 1 35 PHE QE 1 64 LEU HA 3.650 . 5.500 5.054 4.515 5.526 0.026 18 0 "[ . 1 . 2]" 1
261 1 35 PHE QE 1 64 LEU QD 2.970 . 4.140 2.840 2.297 3.199 . 0 0 "[ . 1 . 2]" 1
262 1 35 PHE QE 1 68 ALA MB 2.815 . 3.830 3.086 2.303 3.658 . 0 0 "[ . 1 . 2]" 1
263 1 35 PHE QE 1 76 LEU MD1 2.905 . 4.010 2.666 2.272 2.992 . 0 0 "[ . 1 . 2]" 1
264 1 35 PHE QE 1 76 LEU MD2 2.980 . 4.160 3.204 2.601 3.800 . 0 0 "[ . 1 . 2]" 1
265 1 35 PHE QE 1 89 MET H 3.165 . 4.530 3.612 3.193 4.102 . 0 0 "[ . 1 . 2]" 1
266 1 35 PHE QE 1 89 MET ME 3.010 . 4.220 4.171 3.723 4.267 0.047 3 0 "[ . 1 . 2]" 1
267 1 35 PHE HZ 1 39 VAL QG 2.915 . 4.030 3.074 2.825 3.452 . 0 0 "[ . 1 . 2]" 1
268 1 35 PHE HZ 1 64 LEU QD 2.975 . 4.150 2.118 1.751 2.653 0.049 3 0 "[ . 1 . 2]" 1
269 1 35 PHE HZ 1 64 LEU HG 3.525 . 5.250 2.983 2.123 3.824 . 0 0 "[ . 1 . 2]" 1
270 1 35 PHE HZ 1 76 LEU MD1 3.045 . 4.290 3.723 3.021 4.210 . 0 0 "[ . 1 . 2]" 1
271 1 35 PHE HZ 1 76 LEU MD2 3.160 . 4.520 3.451 2.735 4.140 . 0 0 "[ . 1 . 2]" 1
272 1 35 PHE HZ 1 85 LEU HG 3.650 . 5.500 5.394 4.905 5.565 0.065 11 0 "[ . 1 . 2]" 1
273 1 36 ARG H 1 36 ARG HB2 2.760 . 3.720 2.926 2.221 3.620 . 0 0 "[ . 1 . 2]" 1
274 1 36 ARG H 1 36 ARG QB 2.420 . 3.040 2.424 2.133 2.759 . 0 0 "[ . 1 . 2]" 1
275 1 36 ARG H 1 36 ARG HB3 2.760 . 3.720 2.856 2.343 3.605 . 0 0 "[ . 1 . 2]" 1
276 1 36 ARG H 1 36 ARG HD2 3.650 . 5.500 4.658 4.380 4.867 . 0 0 "[ . 1 . 2]" 1
277 1 36 ARG H 1 36 ARG QD 3.310 . 4.820 4.060 3.540 4.419 . 0 0 "[ . 1 . 2]" 1
278 1 36 ARG H 1 36 ARG HD3 3.650 . 5.500 4.545 3.685 5.157 . 0 0 "[ . 1 . 2]" 1
279 1 36 ARG H 1 36 ARG HG2 3.245 . 4.690 3.313 1.934 4.620 . 0 0 "[ . 1 . 2]" 1
280 1 36 ARG H 1 36 ARG QG 2.930 . 4.060 2.764 1.763 4.037 0.037 3 0 "[ . 1 . 2]" 1
281 1 36 ARG H 1 36 ARG HG3 3.245 . 4.690 3.289 1.772 4.537 0.028 3 0 "[ . 1 . 2]" 1
282 1 36 ARG H 1 37 ASP H 2.685 . 3.570 2.681 2.573 2.820 . 0 0 "[ . 1 . 2]" 1
283 1 36 ARG H 1 38 TYR H 3.225 . 4.650 3.868 3.757 3.989 . 0 0 "[ . 1 . 2]" 1
284 1 36 ARG H 1 89 MET ME 3.415 . 5.030 4.084 3.599 4.707 . 0 0 "[ . 1 . 2]" 1
285 1 36 ARG HA 1 39 VAL H 3.095 . 4.390 3.680 3.315 3.997 . 0 0 "[ . 1 . 2]" 1
286 1 36 ARG HA 1 39 VAL HB 2.995 . 4.190 3.033 2.578 3.522 . 0 0 "[ . 1 . 2]" 1
287 1 36 ARG HA 1 39 VAL QG 2.970 . 4.140 3.611 3.268 3.942 . 0 0 "[ . 1 . 2]" 1
288 1 36 ARG HA 1 40 ASP H 3.355 . 4.910 4.240 4.006 4.562 . 0 0 "[ . 1 . 2]" 1
289 1 36 ARG HA 1 89 MET ME 2.545 . 3.290 1.948 1.748 2.337 0.052 13 0 "[ . 1 . 2]" 1
290 1 36 ARG QB 1 37 ASP H 2.860 . 3.920 2.794 2.203 3.580 . 0 0 "[ . 1 . 2]" 1
291 1 36 ARG HB2 1 37 ASP H 3.255 . 4.710 3.414 2.222 4.071 . 0 0 "[ . 1 . 2]" 1
292 1 36 ARG HB3 1 37 ASP H 3.255 . 4.710 3.307 2.277 4.100 . 0 0 "[ . 1 . 2]" 1
293 1 36 ARG QD 1 89 MET ME 3.150 . 4.500 3.815 1.914 4.311 . 0 0 "[ . 1 . 2]" 1
294 1 36 ARG QG 1 37 ASP H 2.940 . 4.080 3.113 1.911 4.134 0.054 9 0 "[ . 1 . 2]" 1
295 1 37 ASP H 1 37 ASP QB 2.555 . 3.310 2.304 2.197 2.461 . 0 0 "[ . 1 . 2]" 1
296 1 37 ASP H 1 38 TYR H 2.475 . 3.150 2.449 2.247 2.603 . 0 0 "[ . 1 . 2]" 1
297 1 37 ASP H 1 39 VAL H 3.255 . 4.710 4.254 3.986 4.546 . 0 0 "[ . 1 . 2]" 1
298 1 37 ASP HA 1 40 ASP QB 2.815 . 3.830 2.441 2.038 3.135 . 0 0 "[ . 1 . 2]" 1
299 1 37 ASP QB 1 38 TYR H 2.655 . 3.510 2.748 2.506 2.856 . 0 0 "[ . 1 . 2]" 1
300 1 38 TYR H 1 38 TYR HB2 2.750 . 3.700 2.702 2.556 2.801 . 0 0 "[ . 1 . 2]" 1
301 1 38 TYR H 1 38 TYR QB 2.500 . 3.200 2.188 2.105 2.223 . 0 0 "[ . 1 . 2]" 1
302 1 38 TYR H 1 38 TYR HB3 2.750 . 3.700 2.319 2.176 2.431 . 0 0 "[ . 1 . 2]" 1
303 1 38 TYR H 1 38 TYR QD 3.325 . 4.850 4.138 4.007 4.188 . 0 0 "[ . 1 . 2]" 1
304 1 38 TYR H 1 39 VAL H 2.630 . 3.460 2.731 2.606 2.863 . 0 0 "[ . 1 . 2]" 1
305 1 38 TYR H 1 39 VAL QG 3.115 . 4.430 4.511 4.436 4.591 0.161 19 0 "[ . 1 . 2]" 1
306 1 38 TYR HA 1 38 TYR QD 2.855 . 3.910 2.552 2.240 2.900 . 0 0 "[ . 1 . 2]" 1
307 1 38 TYR HA 1 41 ARG H 3.145 . 4.490 3.859 3.547 4.280 . 0 0 "[ . 1 . 2]" 1
308 1 38 TYR HA 1 41 ARG HE 3.095 . 4.390 3.375 2.472 4.404 0.014 8 0 "[ . 1 . 2]" 1
309 1 38 TYR HA 1 41 ARG QG 2.910 . 4.020 3.223 2.463 4.087 0.067 14 0 "[ . 1 . 2]" 1
310 1 38 TYR HA 1 42 PHE H 3.335 . 4.870 4.166 3.950 4.430 . 0 0 "[ . 1 . 2]" 1
311 1 38 TYR QB 1 39 VAL H 2.730 . 3.660 2.446 2.330 2.596 . 0 0 "[ . 1 . 2]" 1
312 1 38 TYR HB2 1 39 VAL H 3.155 . 4.510 3.868 3.778 3.971 . 0 0 "[ . 1 . 2]" 1
313 1 38 TYR HB3 1 39 VAL H 3.155 . 4.510 2.474 2.352 2.632 . 0 0 "[ . 1 . 2]" 1
314 1 38 TYR QD 1 39 VAL H 3.155 . 4.510 3.312 2.923 3.762 . 0 0 "[ . 1 . 2]" 1
315 1 38 TYR QD 1 39 VAL HA 3.530 . 5.260 3.961 3.560 4.359 . 0 0 "[ . 1 . 2]" 1
316 1 38 TYR QD 1 39 VAL QG 2.845 . 3.890 2.708 2.262 3.269 . 0 0 "[ . 1 . 2]" 1
317 1 38 TYR QD 1 64 LEU QD 3.510 . 5.220 3.368 3.008 3.988 . 0 0 "[ . 1 . 2]" 1
318 1 38 TYR QE 1 64 LEU HA 3.380 . 4.960 3.290 2.663 3.983 . 0 0 "[ . 1 . 2]" 1
319 1 38 TYR QE 1 64 LEU QD 2.865 . 3.930 2.099 1.734 3.098 0.066 12 0 "[ . 1 . 2]" 1
320 1 38 TYR QE 1 68 ALA HA 3.650 . 5.500 4.217 3.714 4.986 . 0 0 "[ . 1 . 2]" 1
321 1 38 TYR QE 1 68 ALA MB 2.885 . 3.970 3.318 2.444 3.975 0.005 12 0 "[ . 1 . 2]" 1
322 1 38 TYR HH 1 64 LEU HA 2.710 . 3.620 2.583 1.835 3.650 0.030 3 0 "[ . 1 . 2]" 1
323 1 38 TYR HH 1 64 LEU QD 3.015 . 4.230 3.012 2.111 3.908 . 0 0 "[ . 1 . 2]" 1
324 1 38 TYR HH 1 67 ASN H 3.100 . 4.400 3.627 3.220 3.977 . 0 0 "[ . 1 . 2]" 1
325 1 38 TYR HH 1 67 ASN HB2 3.240 . 4.680 2.247 1.725 2.619 0.075 12 0 "[ . 1 . 2]" 1
326 1 38 TYR HH 1 67 ASN HB3 3.595 . 5.390 3.512 2.181 4.217 . 0 0 "[ . 1 . 2]" 1
327 1 38 TYR HH 1 68 ALA H 3.080 . 4.360 4.180 3.420 4.420 0.060 10 0 "[ . 1 . 2]" 1
328 1 38 TYR HH 1 68 ALA MB 3.245 . 4.690 4.071 3.362 4.701 0.011 12 0 "[ . 1 . 2]" 1
329 1 39 VAL H 1 39 VAL HB 2.600 . 3.400 2.283 2.225 2.442 . 0 0 "[ . 1 . 2]" 1
330 1 39 VAL H 1 39 VAL MG1 2.850 . 3.900 3.685 3.645 3.761 . 0 0 "[ . 1 . 2]" 1
331 1 39 VAL H 1 39 VAL QG 2.415 . 3.030 2.484 2.262 2.601 . 0 0 "[ . 1 . 2]" 1
332 1 39 VAL H 1 39 VAL MG2 2.850 . 3.900 2.527 2.280 2.661 . 0 0 "[ . 1 . 2]" 1
333 1 39 VAL H 1 40 ASP H 2.725 . 3.650 2.676 2.575 2.781 . 0 0 "[ . 1 . 2]" 1
334 1 39 VAL H 1 89 MET ME 3.165 . 4.530 4.154 3.687 4.441 . 0 0 "[ . 1 . 2]" 1
335 1 39 VAL HA 1 39 VAL MG1 2.700 . 3.600 2.629 2.482 2.685 . 0 0 "[ . 1 . 2]" 1
336 1 39 VAL HA 1 39 VAL QG 2.445 . 3.090 2.110 2.092 2.123 . 0 0 "[ . 1 . 2]" 1
337 1 39 VAL HA 1 39 VAL MG2 2.700 . 3.600 2.224 2.182 2.307 . 0 0 "[ . 1 . 2]" 1
338 1 39 VAL HA 1 42 PHE H 3.020 . 4.240 3.330 3.150 3.473 . 0 0 "[ . 1 . 2]" 1
339 1 39 VAL HA 1 42 PHE HB2 3.075 . 4.350 3.053 2.716 3.377 . 0 0 "[ . 1 . 2]" 1
340 1 39 VAL HA 1 42 PHE QB 2.780 . 3.760 2.110 1.876 2.315 . 0 0 "[ . 1 . 2]" 1
341 1 39 VAL HA 1 42 PHE HB3 3.075 . 4.350 2.154 1.912 2.385 . 0 0 "[ . 1 . 2]" 1
342 1 39 VAL HA 1 42 PHE QD 3.580 . 5.360 3.859 3.025 4.212 . 0 0 "[ . 1 . 2]" 1
343 1 39 VAL HA 1 43 TYR H 3.295 . 4.790 3.373 3.137 3.526 . 0 0 "[ . 1 . 2]" 1
344 1 39 VAL HA 1 85 LEU QD 3.215 . 4.630 4.423 4.163 4.649 0.019 3 0 "[ . 1 . 2]" 1
345 1 39 VAL HB 1 40 ASP H 2.725 . 3.650 2.903 2.781 2.992 . 0 0 "[ . 1 . 2]" 1
346 1 39 VAL HB 1 43 TYR H 3.650 . 5.500 5.495 5.210 5.595 0.095 10 0 "[ . 1 . 2]" 1
347 1 39 VAL QG 1 40 ASP H 2.735 . 3.670 3.035 2.880 3.332 . 0 0 "[ . 1 . 2]" 1
348 1 39 VAL QG 1 42 PHE H 3.530 . 5.260 4.268 4.136 4.426 . 0 0 "[ . 1 . 2]" 1
349 1 39 VAL QG 1 42 PHE QB 3.120 . 4.440 3.128 2.845 3.349 . 0 0 "[ . 1 . 2]" 1
350 1 39 VAL QG 1 43 TYR H 3.370 . 4.940 3.378 3.140 3.496 . 0 0 "[ . 1 . 2]" 1
351 1 39 VAL QG 1 85 LEU HB3 3.390 . 4.980 4.831 4.568 5.077 0.097 10 0 "[ . 1 . 2]" 1
352 1 39 VAL QG 1 85 LEU QD 3.065 . 4.330 1.836 1.691 2.110 0.109 9 0 "[ . 1 . 2]" 1
353 1 39 VAL QG 1 89 MET ME 2.325 . 2.850 2.569 2.004 2.855 0.005 5 0 "[ . 1 . 2]" 1
354 1 39 VAL MG1 1 40 ASP H 3.085 . 4.370 3.128 2.940 3.549 . 0 0 "[ . 1 . 2]" 1
355 1 39 VAL MG1 1 89 MET ME 2.540 . 3.280 2.752 2.053 3.194 . 0 0 "[ . 1 . 2]" 1
356 1 39 VAL MG1 2 6 LEU HG 2.780 . 3.760 3.356 2.735 3.752 . 0 0 "[ . 1 . 2]" 1
357 1 39 VAL MG1 2 10 TYR QD 4.230 . 6.660 4.252 3.807 4.648 . 0 0 "[ . 1 . 2]" 1
358 1 39 VAL MG1 2 10 TYR QE 3.955 . 6.110 2.416 1.812 2.871 . 0 0 "[ . 1 . 2]" 1
359 1 39 VAL MG2 1 40 ASP H 3.085 . 4.370 4.118 4.037 4.175 . 0 0 "[ . 1 . 2]" 1
360 1 39 VAL MG2 1 89 MET ME 2.540 . 3.280 3.137 2.655 3.331 0.051 12 0 "[ . 1 . 2]" 1
361 1 39 VAL MG2 2 1 ILE MG 3.670 . 5.540 5.321 4.802 5.709 0.169 12 0 "[ . 1 . 2]" 1
362 1 39 VAL MG2 2 6 LEU QD 3.670 . 5.540 2.896 2.623 4.393 . 0 0 "[ . 1 . 2]" 1
363 1 39 VAL MG2 2 6 LEU HG 3.110 . 4.420 4.560 4.513 4.628 0.208 11 0 "[ . 1 . 2]" 1
364 1 39 VAL MG2 2 10 TYR QE 4.230 . 6.660 4.752 4.374 5.223 . 0 0 "[ . 1 . 2]" 1
365 1 40 ASP H 1 40 ASP HB2 2.585 . 3.370 2.543 2.446 2.652 . 0 0 "[ . 1 . 2]" 1
366 1 40 ASP H 1 40 ASP QB 2.360 . 2.920 2.258 2.226 2.285 . 0 0 "[ . 1 . 2]" 1
367 1 40 ASP H 1 40 ASP HB3 2.585 . 3.370 2.535 2.392 2.641 . 0 0 "[ . 1 . 2]" 1
368 1 40 ASP H 1 41 ARG H 2.770 . 3.740 2.869 2.783 2.950 . 0 0 "[ . 1 . 2]" 1
369 1 40 ASP H 1 89 MET ME 3.190 . 4.580 4.288 3.877 4.647 0.067 5 0 "[ . 1 . 2]" 1
370 1 40 ASP HA 1 41 ARG HA 3.360 . 4.920 4.642 4.586 4.736 . 0 0 "[ . 1 . 2]" 1
371 1 40 ASP HA 1 43 TYR H 3.235 . 4.670 4.152 3.888 4.374 . 0 0 "[ . 1 . 2]" 1
372 1 40 ASP HA 2 10 TYR QE 3.715 . 5.630 3.748 3.365 4.259 . 0 0 "[ . 1 . 2]" 1
373 1 40 ASP QB 1 41 ARG H 2.635 . 3.470 2.450 2.370 2.624 . 0 0 "[ . 1 . 2]" 1
374 1 40 ASP HB2 1 41 ARG H 2.895 . 3.990 3.843 3.751 3.985 . 0 0 "[ . 1 . 2]" 1
375 1 40 ASP HB3 1 41 ARG H 2.895 . 3.990 2.478 2.396 2.661 . 0 0 "[ . 1 . 2]" 1
376 1 41 ARG H 1 41 ARG HB2 2.875 . 3.950 3.215 2.482 3.670 . 0 0 "[ . 1 . 2]" 1
377 1 41 ARG H 1 41 ARG QB 2.635 . 3.470 2.602 2.441 2.772 . 0 0 "[ . 1 . 2]" 1
378 1 41 ARG H 1 41 ARG HB3 2.875 . 3.950 3.090 2.555 3.637 . 0 0 "[ . 1 . 2]" 1
379 1 41 ARG H 1 41 ARG HE 3.650 . 5.500 4.362 3.271 5.493 . 0 0 "[ . 1 . 2]" 1
380 1 41 ARG H 1 41 ARG HG2 3.130 . 4.460 2.587 1.798 3.432 0.002 11 0 "[ . 1 . 2]" 1
381 1 41 ARG H 1 41 ARG QG 2.725 . 3.650 2.107 1.781 2.307 0.019 11 0 "[ . 1 . 2]" 1
382 1 41 ARG H 1 41 ARG HG3 3.130 . 4.460 2.831 2.023 3.503 . 0 0 "[ . 1 . 2]" 1
383 1 41 ARG H 1 42 PHE H 2.775 . 3.750 2.412 2.314 2.589 . 0 0 "[ . 1 . 2]" 1
384 1 41 ARG H 1 43 TYR H 3.580 . 5.360 4.247 4.120 4.388 . 0 0 "[ . 1 . 2]" 1
385 1 41 ARG HA 1 41 ARG QG 2.735 . 3.670 3.012 2.399 3.372 . 0 0 "[ . 1 . 2]" 1
386 1 41 ARG HA 1 44 LYS H 3.065 . 4.330 3.440 3.257 3.667 . 0 0 "[ . 1 . 2]" 1
387 1 41 ARG HA 1 44 LYS HA 3.650 . 5.500 5.476 5.207 5.660 0.160 15 0 "[ . 1 . 2]" 1
388 1 41 ARG HA 1 44 LYS QB 3.010 . 4.220 3.095 2.419 4.025 . 0 0 "[ . 1 . 2]" 1
389 1 41 ARG HA 1 44 LYS QG 3.095 . 4.390 2.931 1.797 4.261 0.003 3 0 "[ . 1 . 2]" 1
390 1 41 ARG QB 1 41 ARG HE 3.015 . 4.230 3.026 1.752 4.080 0.048 1 0 "[ . 1 . 2]" 1
391 1 41 ARG QB 1 42 PHE H 2.850 . 3.900 3.144 2.403 3.640 . 0 0 "[ . 1 . 2]" 1
392 1 41 ARG QB 1 43 TYR H 3.570 . 5.340 5.148 4.756 5.391 0.051 10 0 "[ . 1 . 2]" 1
393 1 41 ARG HB2 1 41 ARG HE 3.335 . 4.870 3.469 1.764 4.666 0.036 1 0 "[ . 1 . 2]" 1
394 1 41 ARG HB2 1 42 PHE H 3.125 . 4.450 3.388 2.438 4.051 . 0 0 "[ . 1 . 2]" 1
395 1 41 ARG HB3 1 41 ARG HE 3.335 . 4.870 3.643 2.014 4.763 . 0 0 "[ . 1 . 2]" 1
396 1 41 ARG HB3 1 42 PHE H 3.125 . 4.450 3.923 3.619 4.159 . 0 0 "[ . 1 . 2]" 1
397 1 42 PHE H 1 42 PHE QB 2.605 . 3.410 2.225 2.166 2.249 . 0 0 "[ . 1 . 2]" 1
398 1 42 PHE H 1 42 PHE QD 3.195 . 4.590 4.169 4.115 4.200 . 0 0 "[ . 1 . 2]" 1
399 1 42 PHE H 1 43 TYR H 2.850 . 3.900 2.766 2.625 2.834 . 0 0 "[ . 1 . 2]" 1
400 1 42 PHE H 1 43 TYR QB 3.275 . 4.750 4.379 4.222 4.509 . 0 0 "[ . 1 . 2]" 1
401 1 42 PHE HA 1 42 PHE QD 3.215 . 4.630 3.011 2.291 3.184 . 0 0 "[ . 1 . 2]" 1
402 1 42 PHE HA 1 45 THR H 3.310 . 4.820 3.810 3.551 4.002 . 0 0 "[ . 1 . 2]" 1
403 1 42 PHE HA 1 45 THR HB 3.085 . 4.370 3.191 2.853 3.463 . 0 0 "[ . 1 . 2]" 1
404 1 42 PHE QB 1 64 LEU QD 3.315 . 4.830 3.465 3.105 4.428 . 0 0 "[ . 1 . 2]" 1
405 1 42 PHE HB2 1 43 TYR H 3.145 . 4.490 3.670 3.488 3.783 . 0 0 "[ . 1 . 2]" 1
406 1 42 PHE HB3 1 43 TYR H 3.145 . 4.490 2.312 2.158 2.398 . 0 0 "[ . 1 . 2]" 1
407 1 42 PHE QD 1 43 TYR H 3.270 . 4.740 3.240 3.114 3.622 . 0 0 "[ . 1 . 2]" 1
408 1 42 PHE QD 1 46 LEU QD 3.215 . 4.630 2.987 2.144 3.657 . 0 0 "[ . 1 . 2]" 1
409 1 42 PHE QD 1 64 LEU HA 3.650 . 5.500 4.236 3.743 4.858 . 0 0 "[ . 1 . 2]" 1
410 1 42 PHE QD 1 64 LEU QD 3.465 . 5.130 3.151 2.685 4.104 . 0 0 "[ . 1 . 2]" 1
411 1 42 PHE QD 2 6 LEU QD 4.230 . 6.660 3.532 2.877 4.305 . 0 0 "[ . 1 . 2]" 1
412 1 42 PHE QD 2 6 LEU HG 3.715 . 5.630 3.621 3.053 4.400 . 0 0 "[ . 1 . 2]" 1
413 1 42 PHE QE 1 43 TYR H 3.650 . 5.500 5.463 5.328 5.582 0.082 2 0 "[ . 1 . 2]" 1
414 1 42 PHE QE 1 46 LEU QB 2.955 . 4.110 3.867 3.198 4.321 0.211 16 0 "[ . 1 . 2]" 1
415 1 42 PHE QE 1 46 LEU QD 3.005 . 4.210 2.042 1.653 2.868 0.147 16 0 "[ . 1 . 2]" 1
416 1 42 PHE QE 1 60 THR H 3.650 . 5.500 5.248 4.447 5.609 0.109 7 0 "[ . 1 . 2]" 1
417 1 42 PHE QE 1 60 THR HA 3.405 . 5.010 3.420 2.517 3.976 . 0 0 "[ . 1 . 2]" 1
418 1 42 PHE QE 1 60 THR HB 3.225 . 4.650 3.961 2.559 4.660 0.010 1 0 "[ . 1 . 2]" 1
419 1 42 PHE QE 1 60 THR MG 2.965 . 4.130 2.260 1.728 3.875 0.072 1 0 "[ . 1 . 2]" 1
420 1 42 PHE QE 1 63 LEU QB 3.195 . 4.590 3.114 2.026 4.364 . 0 0 "[ . 1 . 2]" 1
421 1 42 PHE QE 1 63 LEU MD1 3.235 . 4.670 3.212 2.417 4.515 . 0 0 "[ . 1 . 2]" 1
422 1 42 PHE QE 1 64 LEU H 3.010 . 4.220 4.164 3.794 4.380 0.160 9 0 "[ . 1 . 2]" 1
423 1 42 PHE QE 1 64 LEU HA 3.170 . 4.540 3.201 2.409 4.256 . 0 0 "[ . 1 . 2]" 1
424 1 42 PHE QE 1 64 LEU MD1 3.595 . 5.390 3.281 2.778 5.509 0.119 8 0 "[ . 1 . 2]" 1
425 1 42 PHE QE 1 64 LEU QD 3.260 . 4.720 3.111 2.737 4.014 . 0 0 "[ . 1 . 2]" 1
426 1 42 PHE QE 1 64 LEU MD2 3.595 . 5.390 4.394 3.466 5.405 0.015 15 0 "[ . 1 . 2]" 1
427 1 42 PHE HZ 1 60 THR H 3.545 . 5.290 5.035 4.589 5.340 0.050 20 0 "[ . 1 . 2]" 1
428 1 42 PHE HZ 1 60 THR HB 3.350 . 4.900 4.560 2.944 4.978 0.078 2 0 "[ . 1 . 2]" 1
429 1 43 TYR H 1 43 TYR HB2 2.720 . 3.640 2.867 2.697 3.058 . 0 0 "[ . 1 . 2]" 1
430 1 43 TYR H 1 43 TYR HB3 2.720 . 3.640 2.173 2.051 2.256 . 0 0 "[ . 1 . 2]" 1
431 1 43 TYR H 1 43 TYR QD 3.230 . 4.660 3.985 3.753 4.108 . 0 0 "[ . 1 . 2]" 1
432 1 43 TYR H 1 44 LYS H 2.965 . 4.130 2.801 2.730 2.880 . 0 0 "[ . 1 . 2]" 1
433 1 43 TYR H 1 44 LYS QG 3.570 . 5.340 4.455 4.037 5.027 . 0 0 "[ . 1 . 2]" 1
434 1 43 TYR H 1 45 THR H 3.650 . 5.500 4.272 4.056 4.520 . 0 0 "[ . 1 . 2]" 1
435 1 43 TYR HA 1 43 TYR QD 2.935 . 4.070 2.863 2.643 3.094 . 0 0 "[ . 1 . 2]" 1
436 1 43 TYR HA 1 46 LEU H 3.310 . 4.820 3.557 3.382 3.718 . 0 0 "[ . 1 . 2]" 1
437 1 43 TYR HA 1 46 LEU HB2 3.310 . 4.820 3.282 2.544 3.970 . 0 0 "[ . 1 . 2]" 1
438 1 43 TYR HA 1 46 LEU QB 2.975 . 4.150 2.635 2.456 2.870 . 0 0 "[ . 1 . 2]" 1
439 1 43 TYR HA 1 46 LEU HB3 3.310 . 4.820 3.245 2.546 4.525 . 0 0 "[ . 1 . 2]" 1
440 1 43 TYR HA 1 46 LEU HG 3.315 . 4.830 4.303 3.192 4.886 0.056 17 0 "[ . 1 . 2]" 1
441 1 43 TYR HA 1 47 ARG H 3.415 . 5.030 4.217 3.771 4.634 . 0 0 "[ . 1 . 2]" 1
442 1 43 TYR HA 2 3 PHE QE 3.885 . 5.630 3.007 2.651 3.327 . 0 0 "[ . 1 . 2]" 1
443 1 43 TYR HA 2 6 LEU QD 2.985 . 4.170 3.493 2.705 3.709 . 0 0 "[ . 1 . 2]" 1
444 1 43 TYR HA 2 6 LEU HG 2.400 . 3.000 3.052 2.850 3.143 0.143 13 0 "[ . 1 . 2]" 1
445 1 43 TYR QB 1 44 LYS H 2.795 . 3.790 2.773 2.589 2.924 . 0 0 "[ . 1 . 2]" 1
446 1 43 TYR HB2 2 6 LEU QD 3.190 . 4.580 1.960 1.773 2.183 0.027 11 0 "[ . 1 . 2]" 1
447 1 43 TYR HB2 2 6 LEU HG 2.475 . 3.150 2.106 2.022 2.229 . 0 0 "[ . 1 . 2]" 1
448 1 43 TYR HB2 2 10 TYR QD 3.715 . 5.630 4.275 3.765 4.681 . 0 0 "[ . 1 . 2]" 1
449 1 43 TYR HB2 2 10 TYR QE 3.960 . 5.630 3.306 2.947 3.713 . 0 0 "[ . 1 . 2]" 1
450 1 43 TYR HB3 2 6 LEU QD 3.140 . 4.480 2.911 2.668 3.462 . 0 0 "[ . 1 . 2]" 1
451 1 43 TYR HB3 2 6 LEU HG 2.750 . 3.700 3.795 3.738 3.856 0.156 2 0 "[ . 1 . 2]" 1
452 1 43 TYR HB3 2 10 TYR QD 3.715 . 5.630 4.656 4.148 5.055 . 0 0 "[ . 1 . 2]" 1
453 1 43 TYR HB3 2 10 TYR QE 4.025 . 5.630 3.334 2.931 3.887 . 0 0 "[ . 1 . 2]" 1
454 1 43 TYR QD 1 44 LYS H 3.055 . 4.310 3.110 2.842 3.352 . 0 0 "[ . 1 . 2]" 1
455 1 43 TYR QD 1 44 LYS HA 3.380 . 4.960 3.712 3.417 3.951 . 0 0 "[ . 1 . 2]" 1
456 1 43 TYR QD 1 44 LYS QG 3.570 . 5.340 3.231 2.088 4.918 . 0 0 "[ . 1 . 2]" 1
457 1 43 TYR QD 1 46 LEU HG 3.650 . 5.500 5.549 5.513 5.607 0.107 20 0 "[ . 1 . 2]" 1
458 1 43 TYR QD 2 3 PHE QE 4.790 . 7.780 2.073 1.782 2.283 0.018 8 0 "[ . 1 . 2]" 1
459 1 43 TYR QD 2 6 LEU QB 3.715 . 5.630 2.328 1.782 3.982 0.018 2 0 "[ . 1 . 2]" 1
460 1 43 TYR QD 2 6 LEU QD 4.230 . 6.660 2.693 1.794 3.081 0.006 20 0 "[ . 1 . 2]" 1
461 1 43 TYR QD 2 6 LEU HG 3.715 . 5.630 3.027 2.490 3.768 . 0 0 "[ . 1 . 2]" 1
462 1 43 TYR QE 2 3 PHE QE 4.795 . 7.790 3.197 2.884 3.922 . 0 0 "[ . 1 . 2]" 1
463 1 43 TYR QE 2 3 PHE HZ 3.715 . 5.630 3.622 2.819 3.986 . 0 0 "[ . 1 . 2]" 1
464 1 43 TYR QE 2 7 LEU HA 3.715 . 5.630 2.715 1.855 3.386 . 0 0 "[ . 1 . 2]" 1
465 1 43 TYR QE 2 7 LEU MD1 4.230 . 6.660 3.976 2.477 4.434 . 0 0 "[ . 1 . 2]" 1
466 1 43 TYR QE 2 7 LEU MD2 4.230 . 6.660 1.754 1.696 1.841 0.104 17 0 "[ . 1 . 2]" 1
467 1 43 TYR QE 2 7 LEU HG 3.715 . 5.630 3.099 2.466 4.291 . 0 0 "[ . 1 . 2]" 1
468 1 44 LYS H 1 44 LYS HB2 2.815 . 3.830 2.861 2.258 3.657 . 0 0 "[ . 1 . 2]" 1
469 1 44 LYS H 1 44 LYS HB3 2.815 . 3.830 3.245 2.409 3.631 . 0 0 "[ . 1 . 2]" 1
470 1 44 LYS H 1 44 LYS HG2 3.065 . 4.330 2.906 1.939 4.044 . 0 0 "[ . 1 . 2]" 1
471 1 44 LYS H 1 44 LYS QG 2.660 . 3.520 2.294 1.925 2.698 . 0 0 "[ . 1 . 2]" 1
472 1 44 LYS H 1 44 LYS HG3 3.065 . 4.330 3.000 2.137 3.932 . 0 0 "[ . 1 . 2]" 1
473 1 44 LYS H 1 45 THR H 2.720 . 3.640 2.656 2.528 2.753 . 0 0 "[ . 1 . 2]" 1
474 1 44 LYS HA 1 44 LYS QD 3.145 . 4.490 3.848 1.919 4.557 0.067 17 0 "[ . 1 . 2]" 1
475 1 44 LYS HA 1 44 LYS HG2 2.845 . 3.890 3.033 2.314 3.795 . 0 0 "[ . 1 . 2]" 1
476 1 44 LYS HA 1 44 LYS QG 2.605 . 3.410 2.803 2.253 3.369 . 0 0 "[ . 1 . 2]" 1
477 1 44 LYS HA 1 44 LYS HG3 2.845 . 3.890 3.381 2.421 3.882 . 0 0 "[ . 1 . 2]" 1
478 1 44 LYS HA 1 47 ARG H 3.280 . 4.760 3.515 3.215 3.786 . 0 0 "[ . 1 . 2]" 1
479 1 44 LYS HA 1 47 ARG QB 3.295 . 4.790 3.022 2.479 4.521 . 0 0 "[ . 1 . 2]" 1
480 1 44 LYS HA 1 47 ARG HD2 3.005 . 4.210 4.112 3.486 4.298 0.088 12 0 "[ . 1 . 2]" 1
481 1 44 LYS HA 1 47 ARG QD 2.600 . 3.400 3.070 2.341 3.528 0.128 10 0 "[ . 1 . 2]" 1
482 1 44 LYS HA 1 47 ARG HD3 3.005 . 4.210 3.223 2.366 4.218 0.008 3 0 "[ . 1 . 2]" 1
483 1 44 LYS QB 1 44 LYS QD 2.525 . 3.250 2.246 2.080 2.535 . 0 0 "[ . 1 . 2]" 1
484 1 44 LYS QB 1 45 THR H 2.690 . 3.580 2.930 2.359 3.705 0.125 20 0 "[ . 1 . 2]" 1
485 1 44 LYS HB2 1 45 THR H 3.005 . 4.210 3.116 2.397 4.103 . 0 0 "[ . 1 . 2]" 1
486 1 44 LYS HB3 1 45 THR H 3.005 . 4.210 3.746 3.339 4.219 0.009 20 0 "[ . 1 . 2]" 1
487 1 44 LYS QE 1 44 LYS QG 2.560 . 3.320 2.356 2.116 2.718 . 0 0 "[ . 1 . 2]" 1
488 1 44 LYS QG 1 45 THR H 3.055 . 4.310 3.524 2.088 4.395 0.085 10 0 "[ . 1 . 2]" 1
489 1 45 THR H 1 45 THR HB 2.575 . 3.350 2.573 2.434 2.627 . 0 0 "[ . 1 . 2]" 1
490 1 45 THR H 1 45 THR MG 2.875 . 3.950 3.773 3.750 3.807 . 0 0 "[ . 1 . 2]" 1
491 1 45 THR H 1 46 LEU H 2.725 . 3.650 2.557 2.389 2.750 . 0 0 "[ . 1 . 2]" 1
492 1 45 THR H 1 46 LEU QB 3.350 . 4.900 4.322 4.137 4.622 . 0 0 "[ . 1 . 2]" 1
493 1 45 THR H 1 47 ARG H 3.305 . 4.810 4.033 3.870 4.302 . 0 0 "[ . 1 . 2]" 1
494 1 45 THR HA 1 45 THR MG 2.620 . 3.440 2.370 2.328 2.474 . 0 0 "[ . 1 . 2]" 1
495 1 45 THR HA 1 48 ALA H 3.245 . 4.690 3.394 3.051 3.609 . 0 0 "[ . 1 . 2]" 1
496 1 45 THR HA 1 48 ALA MB 2.915 . 4.030 2.827 2.530 3.134 . 0 0 "[ . 1 . 2]" 1
497 1 45 THR HB 1 46 LEU H 2.810 . 3.820 2.653 2.293 3.017 . 0 0 "[ . 1 . 2]" 1
498 1 45 THR MG 1 46 LEU H 3.040 . 4.280 3.592 3.308 3.803 . 0 0 "[ . 1 . 2]" 1
499 1 45 THR MG 1 46 LEU HA 3.125 . 4.450 3.638 3.369 3.848 . 0 0 "[ . 1 . 2]" 1
500 1 45 THR MG 1 48 ALA MB 2.820 . 3.840 3.396 2.873 3.903 0.063 19 0 "[ . 1 . 2]" 1
501 1 45 THR MG 1 49 GLU HG2 3.650 . 5.500 2.796 2.183 3.411 . 0 0 "[ . 1 . 2]" 1
502 1 45 THR MG 1 49 GLU HG3 3.650 . 5.500 3.808 2.917 4.796 . 0 0 "[ . 1 . 2]" 1
503 1 46 LEU H 1 46 LEU HB2 2.790 . 3.780 2.418 2.296 2.523 . 0 0 "[ . 1 . 2]" 1
504 1 46 LEU H 1 46 LEU HB3 2.790 . 3.780 2.889 2.459 3.596 . 0 0 "[ . 1 . 2]" 1
505 1 46 LEU H 1 46 LEU QD 3.265 . 3.970 3.489 3.062 3.703 . 0 0 "[ . 1 . 2]" 1
506 1 46 LEU H 1 46 LEU HG 3.200 . 4.600 3.833 2.462 4.526 . 0 0 "[ . 1 . 2]" 1
507 1 46 LEU H 1 47 ARG H 2.800 . 3.800 2.653 2.529 2.789 . 0 0 "[ . 1 . 2]" 1
508 1 46 LEU H 2 3 PHE QE 3.715 . 5.630 4.607 4.305 5.044 . 0 0 "[ . 1 . 2]" 1
509 1 46 LEU HA 1 46 LEU QD . . 3.030 1.933 1.793 2.052 0.007 11 0 "[ . 1 . 2]" 1
510 1 46 LEU HA 1 48 ALA H 3.085 . 4.370 3.872 3.563 4.084 . 0 0 "[ . 1 . 2]" 1
511 1 46 LEU HA 1 49 GLU H 2.915 . 4.030 3.112 2.899 3.349 . 0 0 "[ . 1 . 2]" 1
512 1 46 LEU HA 1 49 GLU QB 3.025 . 4.250 2.687 2.063 2.981 . 0 0 "[ . 1 . 2]" 1
513 1 46 LEU HA 1 49 GLU HG2 3.145 . 4.490 2.267 1.828 2.750 . 0 0 "[ . 1 . 2]" 1
514 1 46 LEU HA 1 49 GLU QG 2.850 . 3.900 2.104 1.768 2.553 0.032 14 0 "[ . 1 . 2]" 1
515 1 46 LEU HA 1 49 GLU HG3 3.145 . 4.490 2.527 2.169 3.026 . 0 0 "[ . 1 . 2]" 1
516 1 46 LEU QB 1 46 LEU QD 2.275 . 2.750 1.938 1.893 1.962 . 0 0 "[ . 1 . 2]" 1
517 1 46 LEU QB 1 47 ARG H 2.950 . 4.100 2.711 2.354 2.883 . 0 0 "[ . 1 . 2]" 1
518 1 46 LEU HB2 1 46 LEU QD 2.800 . 3.800 2.174 2.085 2.366 . 0 0 "[ . 1 . 2]" 1
519 1 46 LEU HB2 1 47 ARG H 3.330 . 4.860 3.537 2.416 4.015 . 0 0 "[ . 1 . 2]" 1
520 1 46 LEU HB3 1 46 LEU QD 2.800 . 3.800 2.218 2.031 2.367 . 0 0 "[ . 1 . 2]" 1
521 1 46 LEU HB3 1 47 ARG H 3.330 . 4.860 3.042 2.529 3.694 . 0 0 "[ . 1 . 2]" 1
522 1 46 LEU QD 1 49 GLU QB 2.845 . 3.890 2.617 2.129 3.423 . 0 0 "[ . 1 . 2]" 1
523 1 46 LEU QD 1 49 GLU HG2 3.650 . 5.500 3.079 2.850 3.372 . 0 0 "[ . 1 . 2]" 1
524 1 46 LEU QD 1 49 GLU QG 2.910 . 4.020 2.218 1.900 2.738 . 0 0 "[ . 1 . 2]" 1
525 1 46 LEU QD 1 49 GLU HG3 3.650 . 5.500 2.282 1.922 2.897 . 0 0 "[ . 1 . 2]" 1
526 1 46 LEU QD 1 56 LYS HA 3.365 . 4.210 3.333 2.707 3.989 . 0 0 "[ . 1 . 2]" 1
527 1 46 LEU QD 1 60 THR HB 3.615 . 5.430 3.135 1.768 3.839 0.032 15 0 "[ . 1 . 2]" 1
528 1 46 LEU QD 2 3 PHE QE 3.955 . 6.110 3.274 2.978 3.601 . 0 0 "[ . 1 . 2]" 1
529 1 46 LEU QD 2 6 LEU HG 3.155 . 4.510 3.736 2.997 4.365 . 0 0 "[ . 1 . 2]" 1
530 1 46 LEU HG 1 49 GLU HG2 3.590 . 5.380 5.048 4.688 5.380 . 0 0 "[ . 1 . 2]" 1
531 1 46 LEU HG 1 49 GLU QG 3.255 . 4.710 4.310 4.048 4.689 . 0 0 "[ . 1 . 2]" 1
532 1 46 LEU HG 1 49 GLU HG3 3.590 . 5.380 4.696 4.306 5.256 . 0 0 "[ . 1 . 2]" 1
533 1 47 ARG H 1 47 ARG HB2 2.865 . 3.930 2.527 2.249 3.510 . 0 0 "[ . 1 . 2]" 1
534 1 47 ARG H 1 47 ARG QB 2.570 . 3.340 2.382 2.155 2.954 . 0 0 "[ . 1 . 2]" 1
535 1 47 ARG H 1 47 ARG HB3 2.865 . 3.930 3.119 2.399 3.620 . 0 0 "[ . 1 . 2]" 1
536 1 47 ARG H 1 47 ARG QG 3.140 . 4.480 2.991 1.773 3.965 0.027 15 0 "[ . 1 . 2]" 1
537 1 47 ARG H 1 48 ALA H 2.800 . 3.800 2.602 2.485 2.741 . 0 0 "[ . 1 . 2]" 1
538 1 47 ARG H 1 49 GLU H 3.350 . 4.900 3.985 3.824 4.130 . 0 0 "[ . 1 . 2]" 1
539 1 47 ARG H 2 3 PHE QE 3.715 . 5.630 3.434 3.010 4.089 . 0 0 "[ . 1 . 2]" 1
540 1 47 ARG H 2 3 PHE HZ 2.640 . 3.480 3.534 3.347 3.593 0.113 17 0 "[ . 1 . 2]" 1
541 1 47 ARG HA 1 47 ARG QG 2.750 . 3.700 2.464 2.251 3.223 . 0 0 "[ . 1 . 2]" 1
542 1 47 ARG HA 1 48 ALA HA 3.555 . 5.310 4.655 4.554 4.772 . 0 0 "[ . 1 . 2]" 1
543 1 47 ARG HA 2 3 PHE QE 3.480 . 5.160 3.121 2.902 3.540 . 0 0 "[ . 1 . 2]" 1
544 1 47 ARG HA 2 3 PHE HZ 2.220 . 2.570 2.280 1.801 2.637 0.067 8 0 "[ . 1 . 2]" 1
545 1 47 ARG HA 2 7 LEU MD2 3.170 . 4.540 4.511 4.008 4.655 0.115 13 0 "[ . 1 . 2]" 1
546 1 47 ARG QB 1 48 ALA H 2.890 . 3.980 2.892 2.521 3.393 . 0 0 "[ . 1 . 2]" 1
547 1 47 ARG HB2 1 48 ALA H 3.240 . 4.680 3.449 2.559 4.092 . 0 0 "[ . 1 . 2]" 1
548 1 47 ARG HB2 2 3 PHE HZ 2.800 . 3.800 3.207 1.936 4.127 0.327 4 0 "[ . 1 . 2]" 1
549 1 47 ARG HB3 1 48 ALA H 3.240 . 4.680 3.500 2.715 4.332 . 0 0 "[ . 1 . 2]" 1
550 1 47 ARG HB3 2 3 PHE QE 4.740 . 7.680 4.411 3.099 4.861 . 0 0 "[ . 1 . 2]" 1
551 1 47 ARG HB3 2 3 PHE HZ 2.900 . 4.000 3.539 1.736 3.929 0.064 15 0 "[ . 1 . 2]" 1
552 1 47 ARG HD2 2 3 PHE QE 4.180 . 6.560 4.218 3.773 4.476 . 0 0 "[ . 1 . 2]" 1
553 1 47 ARG HD2 2 3 PHE HZ 2.610 . 3.420 3.436 3.003 3.572 0.152 20 0 "[ . 1 . 2]" 1
554 1 47 ARG HD2 2 7 LEU MD2 3.020 . 4.240 3.065 2.532 3.564 . 0 0 "[ . 1 . 2]" 1
555 1 47 ARG HD3 2 7 LEU MD2 3.090 . 4.380 4.226 3.349 4.841 0.461 19 0 "[ . 1 . 2]" 1
556 1 47 ARG QG 1 48 ALA H 3.250 . 4.700 3.975 2.747 4.366 . 0 0 "[ . 1 . 2]" 1
557 1 47 ARG QG 2 3 PHE QE 3.790 . 5.780 2.995 2.290 3.671 . 0 0 "[ . 1 . 2]" 1
558 1 47 ARG QG 2 3 PHE HZ 2.285 . 2.770 2.030 1.554 2.803 0.246 2 0 "[ . 1 . 2]" 1
559 1 47 ARG HG2 1 48 ALA H 3.650 . 5.500 4.577 3.704 5.199 . 0 0 "[ . 1 . 2]" 1
560 1 47 ARG HG3 1 48 ALA H 3.650 . 5.500 4.531 2.832 5.114 . 0 0 "[ . 1 . 2]" 1
561 1 48 ALA H 1 48 ALA MB 2.385 . 2.970 2.310 2.237 2.402 . 0 0 "[ . 1 . 2]" 1
562 1 48 ALA H 1 49 GLU H 2.635 . 3.470 2.293 1.998 2.567 . 0 0 "[ . 1 . 2]" 1
563 1 48 ALA MB 1 49 GLU H 2.780 . 3.760 3.003 2.731 3.417 . 0 0 "[ . 1 . 2]" 1
564 1 49 GLU H 1 49 GLU HB2 2.765 . 3.730 2.380 2.058 2.544 . 0 0 "[ . 1 . 2]" 1
565 1 49 GLU H 1 49 GLU QB 2.500 . 3.200 2.346 2.040 2.495 . 0 0 "[ . 1 . 2]" 1
566 1 49 GLU H 1 49 GLU HB3 2.765 . 3.730 3.566 3.330 3.604 . 0 0 "[ . 1 . 2]" 1
567 1 49 GLU H 1 49 GLU HG2 2.940 . 4.080 2.491 2.157 3.382 . 0 0 "[ . 1 . 2]" 1
568 1 49 GLU H 1 49 GLU QG 2.650 . 3.500 2.453 2.142 3.236 . 0 0 "[ . 1 . 2]" 1
569 1 49 GLU H 1 49 GLU HG3 2.940 . 4.080 3.760 3.573 4.128 0.048 15 0 "[ . 1 . 2]" 1
570 1 49 GLU QB 1 56 LYS QE 2.995 . 4.190 2.829 1.739 4.217 0.061 2 0 "[ . 1 . 2]" 1
571 1 50 GLN H 1 50 GLN QG 3.185 . 4.570 3.047 1.770 4.106 0.030 3 0 "[ . 1 . 2]" 1
572 1 50 GLN HA 1 50 GLN QG 2.695 . 3.590 2.708 2.307 3.343 . 0 0 "[ . 1 . 2]" 1
573 1 50 GLN HA 1 51 ALA H 2.450 . 3.100 2.394 2.138 3.146 0.046 18 0 "[ . 1 . 2]" 1
574 1 50 GLN QB 1 51 ALA H 2.975 . 4.150 3.854 3.536 4.035 . 0 0 "[ . 1 . 2]" 1
575 1 50 GLN HB2 1 51 ALA H 3.310 . 4.820 4.400 3.738 4.584 . 0 0 "[ . 1 . 2]" 1
576 1 50 GLN HB3 1 51 ALA H 3.310 . 4.820 4.293 3.805 4.611 . 0 0 "[ . 1 . 2]" 1
577 1 50 GLN QG 1 51 ALA H 3.240 . 4.680 4.266 3.380 4.799 0.119 20 0 "[ . 1 . 2]" 1
578 1 51 ALA H 1 51 ALA MB 2.660 . 3.520 2.672 2.277 2.905 . 0 0 "[ . 1 . 2]" 1
579 1 51 ALA H 1 52 SER H 3.305 . 4.810 4.368 4.224 4.602 . 0 0 "[ . 1 . 2]" 1
580 1 51 ALA H 1 56 LYS QE 2.795 . 3.790 2.924 2.239 3.884 0.094 6 0 "[ . 1 . 2]" 1
581 1 51 ALA HA 1 52 SER H 2.530 . 3.260 2.366 2.265 2.517 . 0 0 "[ . 1 . 2]" 1
582 1 51 ALA MB 1 52 SER H 2.600 . 3.400 2.519 2.253 2.735 . 0 0 "[ . 1 . 2]" 1
583 1 51 ALA MB 1 55 VAL HB 2.640 . 3.480 2.905 2.179 3.831 0.351 15 0 "[ . 1 . 2]" 1
584 1 51 ALA MB 1 55 VAL MG1 2.490 . 3.180 2.641 1.544 3.226 0.256 9 0 "[ . 1 . 2]" 1
585 1 51 ALA MB 1 56 LYS H 3.135 . 4.470 3.554 3.210 3.835 . 0 0 "[ . 1 . 2]" 1
586 1 51 ALA MB 1 56 LYS HA 2.705 . 3.610 3.649 3.290 3.869 0.259 2 0 "[ . 1 . 2]" 1
587 1 51 ALA MB 1 56 LYS HE2 2.895 . 3.990 2.776 1.699 3.380 0.101 2 0 "[ . 1 . 2]" 1
588 1 51 ALA MB 1 56 LYS HE3 2.895 . 3.990 3.240 1.689 4.153 0.163 13 0 "[ . 1 . 2]" 1
589 1 52 SER H 1 52 SER HB2 2.970 . 4.140 2.568 2.440 2.762 . 0 0 "[ . 1 . 2]" 1
590 1 52 SER H 1 52 SER QB 2.620 . 3.440 2.454 2.228 2.617 . 0 0 "[ . 1 . 2]" 1
591 1 52 SER H 1 52 SER HB3 2.970 . 4.140 3.327 2.351 3.604 . 0 0 "[ . 1 . 2]" 1
592 1 52 SER H 1 55 VAL H 3.405 . 5.010 4.488 4.130 4.925 . 0 0 "[ . 1 . 2]" 1
593 1 52 SER H 1 55 VAL HB 2.965 . 4.130 3.214 2.673 4.179 0.049 4 0 "[ . 1 . 2]" 1
594 1 52 SER H 1 55 VAL MG1 3.230 . 4.660 3.637 1.962 4.385 . 0 0 "[ . 1 . 2]" 1
595 1 52 SER H 1 55 VAL MG2 3.115 . 4.430 3.408 2.717 4.467 0.037 9 0 "[ . 1 . 2]" 1
596 1 52 SER HA 1 56 LYS H 3.580 . 5.360 5.146 4.999 5.402 0.042 15 0 "[ . 1 . 2]" 1
597 1 52 SER QB 1 54 GLU H 2.860 . 3.920 3.369 3.113 3.826 . 0 0 "[ . 1 . 2]" 1
598 1 52 SER QB 1 55 VAL MG2 3.245 . 4.690 2.362 1.798 4.804 0.114 4 0 "[ . 1 . 2]" 1
599 1 52 SER QB 1 56 LYS H 3.570 . 5.340 4.227 3.889 4.490 . 0 0 "[ . 1 . 2]" 1
600 1 52 SER HB2 1 53 GLN H 3.570 . 5.340 3.836 3.039 4.053 . 0 0 "[ . 1 . 2]" 1
601 1 52 SER HB2 1 54 GLU H 3.220 . 4.640 4.177 3.686 4.783 0.143 14 0 "[ . 1 . 2]" 1
602 1 52 SER HB3 1 53 GLN H 3.570 . 5.340 3.059 2.101 4.038 . 0 0 "[ . 1 . 2]" 1
603 1 52 SER HB3 1 54 GLU H 3.220 . 4.640 3.584 3.288 4.048 . 0 0 "[ . 1 . 2]" 1
604 1 53 GLN H 1 53 GLN HG2 3.650 . 5.500 4.100 3.109 4.534 . 0 0 "[ . 1 . 2]" 1
605 1 53 GLN H 1 53 GLN QG 3.305 . 4.810 3.370 2.117 3.977 . 0 0 "[ . 1 . 2]" 1
606 1 53 GLN H 1 53 GLN HG3 3.650 . 5.500 3.664 2.154 4.451 . 0 0 "[ . 1 . 2]" 1
607 1 53 GLN H 1 54 GLU H 3.235 . 4.670 2.865 2.615 3.050 . 0 0 "[ . 1 . 2]" 1
608 1 53 GLN HA 1 54 GLU HA 3.650 . 5.500 4.762 4.670 4.854 . 0 0 "[ . 1 . 2]" 1
609 1 53 GLN HA 1 56 LYS QB 3.110 . 4.420 2.763 2.089 4.214 . 0 0 "[ . 1 . 2]" 1
610 1 53 GLN HA 1 56 LYS QD 3.465 . 5.130 3.316 2.021 5.267 0.137 2 0 "[ . 1 . 2]" 1
611 1 53 GLN QB 1 54 GLU H 2.765 . 3.730 2.470 2.286 2.876 . 0 0 "[ . 1 . 2]" 1
612 1 53 GLN HB2 1 54 GLU H 3.070 . 4.340 3.309 2.396 3.893 . 0 0 "[ . 1 . 2]" 1
613 1 53 GLN HB3 1 54 GLU H 3.070 . 4.340 2.884 2.308 3.743 . 0 0 "[ . 1 . 2]" 1
614 1 53 GLN HG2 2 3 PHE QD 3.715 . 5.630 4.125 2.657 5.344 . 0 0 "[ . 1 . 2]" 1
615 1 53 GLN HG3 2 3 PHE QE 3.580 . 5.360 4.483 2.581 5.731 0.371 13 0 "[ . 1 . 2]" 1
616 1 54 GLU H 1 54 GLU HB2 2.890 . 3.980 2.802 2.381 3.632 . 0 0 "[ . 1 . 2]" 1
617 1 54 GLU H 1 54 GLU QB 2.615 . 3.430 2.475 2.222 2.686 . 0 0 "[ . 1 . 2]" 1
618 1 54 GLU H 1 54 GLU HB3 2.890 . 3.980 3.199 2.509 3.615 . 0 0 "[ . 1 . 2]" 1
619 1 54 GLU H 1 54 GLU HG2 3.190 . 4.580 3.243 1.979 4.584 0.004 5 0 "[ . 1 . 2]" 1
620 1 54 GLU H 1 54 GLU QG 2.895 . 3.990 2.661 1.961 4.043 0.053 5 0 "[ . 1 . 2]" 1
621 1 54 GLU H 1 54 GLU HG3 3.190 . 4.580 3.198 1.997 4.495 . 0 0 "[ . 1 . 2]" 1
622 1 54 GLU H 1 55 VAL H 2.770 . 3.740 2.676 2.455 2.841 . 0 0 "[ . 1 . 2]" 1
623 1 54 GLU HA 1 54 GLU HG2 2.970 . 4.140 3.290 2.427 3.788 . 0 0 "[ . 1 . 2]" 1
624 1 54 GLU HA 1 54 GLU QG 2.635 . 3.470 2.752 2.337 3.480 0.010 16 0 "[ . 1 . 2]" 1
625 1 54 GLU HA 1 54 GLU HG3 2.970 . 4.140 3.172 2.367 4.235 0.095 16 0 "[ . 1 . 2]" 1
626 1 54 GLU HA 1 56 LYS H 3.370 . 4.940 4.385 4.169 4.631 . 0 0 "[ . 1 . 2]" 1
627 1 54 GLU HA 1 57 ASN H 3.090 . 4.380 3.343 3.112 3.560 . 0 0 "[ . 1 . 2]" 1
628 1 54 GLU HA 1 57 ASN QB 3.160 . 3.830 3.051 2.508 3.840 0.010 17 0 "[ . 1 . 2]" 1
629 1 54 GLU HA 1 57 ASN QD 2.930 . 4.060 2.595 1.784 4.119 0.059 11 0 "[ . 1 . 2]" 1
630 1 54 GLU HA 1 58 ALA H 3.085 . 4.370 4.140 3.836 4.401 0.031 18 0 "[ . 1 . 2]" 1
631 1 54 GLU QB 1 55 VAL H 2.725 . 3.650 2.831 2.300 3.535 . 0 0 "[ . 1 . 2]" 1
632 1 54 GLU HB2 1 55 VAL H 3.095 . 4.390 3.130 2.339 4.025 . 0 0 "[ . 1 . 2]" 1
633 1 54 GLU HB3 1 55 VAL H 3.095 . 4.390 3.644 2.398 4.172 . 0 0 "[ . 1 . 2]" 1
634 1 54 GLU QG 1 55 VAL H 3.155 . 4.510 3.608 1.983 4.594 0.084 1 0 "[ . 1 . 2]" 1
635 1 54 GLU HG2 1 55 VAL H 3.535 . 5.270 4.187 2.161 5.327 0.057 1 0 "[ . 1 . 2]" 1
636 1 54 GLU HG3 1 55 VAL H 3.535 . 5.270 4.178 2.027 5.080 . 0 0 "[ . 1 . 2]" 1
637 1 55 VAL H 1 55 VAL HB 2.495 . 3.190 2.561 2.470 2.692 . 0 0 "[ . 1 . 2]" 1
638 1 55 VAL H 1 55 VAL MG1 2.835 . 3.870 3.535 1.902 3.787 . 0 0 "[ . 1 . 2]" 1
639 1 55 VAL H 1 55 VAL MG2 2.545 . 3.290 2.330 1.992 3.813 0.523 15 1 "[ . 1 + 2]" 1
640 1 55 VAL H 1 56 LYS H 2.695 . 3.590 2.581 2.373 2.740 . 0 0 "[ . 1 . 2]" 1
641 1 55 VAL H 1 56 LYS QB 3.240 . 4.680 4.519 4.292 4.810 0.130 1 0 "[ . 1 . 2]" 1
642 1 55 VAL H 1 57 ASN H 3.430 . 5.060 4.026 3.791 4.206 . 0 0 "[ . 1 . 2]" 1
643 1 55 VAL HA 1 55 VAL MG1 2.675 . 3.550 2.513 2.346 3.199 . 0 0 "[ . 1 . 2]" 1
644 1 55 VAL HA 1 55 VAL MG2 2.560 . 3.320 2.392 2.265 2.444 . 0 0 "[ . 1 . 2]" 1
645 1 55 VAL HA 1 58 ALA H 2.930 . 4.060 3.545 3.295 3.830 . 0 0 "[ . 1 . 2]" 1
646 1 55 VAL HA 1 58 ALA MB 2.725 . 3.650 2.871 2.393 3.215 . 0 0 "[ . 1 . 2]" 1
647 1 55 VAL HB 1 56 LYS H 2.830 . 3.860 2.768 2.342 3.944 0.084 4 0 "[ . 1 . 2]" 1
648 1 55 VAL MG1 1 58 ALA H 3.295 . 4.790 4.820 4.577 5.156 0.366 4 0 "[ . 1 . 2]" 1
649 1 55 VAL MG1 1 59 ALA H 3.170 . 4.540 4.215 3.635 5.321 0.781 4 1 "[ +. 1 . 2]" 1
650 1 55 VAL MG2 1 56 LYS H 3.145 . 4.490 3.746 3.334 3.908 . 0 0 "[ . 1 . 2]" 1
651 1 56 LYS H 1 56 LYS QB 2.575 . 3.350 2.379 2.194 2.558 . 0 0 "[ . 1 . 2]" 1
652 1 56 LYS H 1 56 LYS QD 3.130 . 4.460 4.134 3.471 4.586 0.126 12 0 "[ . 1 . 2]" 1
653 1 56 LYS H 1 56 LYS HG2 3.145 . 4.490 3.367 2.192 4.437 . 0 0 "[ . 1 . 2]" 1
654 1 56 LYS H 1 56 LYS QG 2.840 . 3.880 2.534 2.158 3.930 0.050 14 0 "[ . 1 . 2]" 1
655 1 56 LYS H 1 56 LYS HG3 3.145 . 4.490 2.847 2.235 4.399 . 0 0 "[ . 1 . 2]" 1
656 1 56 LYS H 1 57 ASN H 2.885 . 3.970 2.680 2.537 2.850 . 0 0 "[ . 1 . 2]" 1
657 1 56 LYS HA 1 56 LYS HD2 3.650 . 5.500 4.494 3.112 5.533 0.033 15 0 "[ . 1 . 2]" 1
658 1 56 LYS HA 1 56 LYS QD 3.275 . 4.750 3.838 1.772 4.508 0.028 2 0 "[ . 1 . 2]" 1
659 1 56 LYS HA 1 56 LYS HD3 3.650 . 5.500 4.261 1.782 4.864 0.018 2 0 "[ . 1 . 2]" 1
660 1 56 LYS HA 1 59 ALA MB 2.650 . 3.500 2.739 2.267 3.335 . 0 0 "[ . 1 . 2]" 1
661 1 56 LYS QB 1 57 ASN H 2.895 . 3.990 2.715 2.363 3.626 . 0 0 "[ . 1 . 2]" 1
662 1 56 LYS QD 1 57 ASN H 3.570 . 5.340 4.862 4.291 5.394 0.054 11 0 "[ . 1 . 2]" 1
663 1 57 ASN H 1 57 ASN QB 2.995 . 3.550 2.600 2.464 2.750 . 0 0 "[ . 1 . 2]" 1
664 1 57 ASN H 1 58 ALA H 2.725 . 3.650 2.703 2.494 2.866 . 0 0 "[ . 1 . 2]" 1
665 1 57 ASN QB 1 58 ALA H 2.950 . 3.460 2.542 2.240 3.595 0.135 1 0 "[ . 1 . 2]" 1
666 1 57 ASN QB 2 2 THR HA 2.750 . 3.700 3.694 3.518 3.839 0.139 7 0 "[ . 1 . 2]" 1
667 1 57 ASN QB 2 2 THR HB 2.935 . 4.000 2.091 1.737 2.857 0.063 7 0 "[ . 1 . 2]" 1
668 1 57 ASN QB 2 2 THR MG 3.120 . 4.440 3.172 2.534 3.494 . 0 0 "[ . 1 . 2]" 1
669 1 57 ASN HD22 2 3 PHE QD 3.715 . 5.630 4.457 2.518 6.557 0.927 1 2 "[+ . - . 2]" 1
670 1 58 ALA H 1 58 ALA MB 2.330 . 2.860 2.231 2.217 2.249 . 0 0 "[ . 1 . 2]" 1
671 1 58 ALA H 1 59 ALA H 2.625 . 3.450 2.689 2.515 2.780 . 0 0 "[ . 1 . 2]" 1
672 1 58 ALA H 1 59 ALA MB 3.105 . 4.410 4.360 4.201 4.452 0.042 9 0 "[ . 1 . 2]" 1
673 1 58 ALA MB 1 59 ALA H 2.705 . 3.610 2.551 2.444 2.765 . 0 0 "[ . 1 . 2]" 1
674 1 59 ALA H 1 59 ALA MB 2.415 . 3.030 2.237 2.228 2.254 . 0 0 "[ . 1 . 2]" 1
675 1 59 ALA H 1 60 THR HB 3.425 . 5.050 4.926 4.756 5.103 0.053 11 0 "[ . 1 . 2]" 1
676 1 59 ALA HA 1 60 THR HA 3.580 . 5.360 4.807 4.694 4.899 . 0 0 "[ . 1 . 2]" 1
677 1 59 ALA HA 1 63 LEU MD1 3.280 . 4.760 4.025 3.392 4.892 0.132 18 0 "[ . 1 . 2]" 1
678 1 59 ALA HA 1 63 LEU MD2 3.415 . 5.030 4.387 3.716 4.906 . 0 0 "[ . 1 . 2]" 1
679 1 59 ALA HA 1 63 LEU HG 3.185 . 4.570 3.535 3.128 4.019 . 0 0 "[ . 1 . 2]" 1
680 1 59 ALA MB 1 60 THR H 2.555 . 3.310 2.472 2.342 2.672 . 0 0 "[ . 1 . 2]" 1
681 1 59 ALA MB 1 60 THR HA 2.860 . 3.920 3.760 3.693 3.830 . 0 0 "[ . 1 . 2]" 1
682 1 59 ALA MB 1 60 THR HB 3.295 . 4.790 4.489 3.827 4.856 0.066 1 0 "[ . 1 . 2]" 1
683 1 59 ALA MB 1 63 LEU MD1 2.340 . 2.880 2.564 1.934 3.595 0.715 18 4 "[ . -1 . *+ *]" 1
684 1 59 ALA MB 1 63 LEU HG 2.640 . 3.480 3.100 2.820 3.329 . 0 0 "[ . 1 . 2]" 1
685 1 60 THR H 1 60 THR HB 2.535 . 3.270 2.580 2.411 2.727 . 0 0 "[ . 1 . 2]" 1
686 1 60 THR H 1 60 THR MG 2.935 . 4.070 3.353 2.050 3.767 . 0 0 "[ . 1 . 2]" 1
687 1 60 THR H 1 61 GLU H 2.555 . 3.310 2.757 2.608 2.893 . 0 0 "[ . 1 . 2]" 1
688 1 60 THR H 1 61 GLU QB 3.360 . 4.920 4.760 4.520 4.962 0.042 1 0 "[ . 1 . 2]" 1
689 1 60 THR H 1 61 GLU QG 3.570 . 5.340 4.272 3.803 4.617 . 0 0 "[ . 1 . 2]" 1
690 1 60 THR H 1 62 THR H 3.295 . 4.790 4.263 4.076 4.658 . 0 0 "[ . 1 . 2]" 1
691 1 60 THR H 1 63 LEU MD1 3.175 . 4.550 3.958 3.410 4.245 . 0 0 "[ . 1 . 2]" 1
692 1 60 THR HA 1 60 THR MG 2.560 . 3.320 2.581 2.303 3.212 . 0 0 "[ . 1 . 2]" 1
693 1 60 THR HA 1 61 GLU QB 3.570 . 5.340 5.398 5.263 5.509 0.169 4 0 "[ . 1 . 2]" 1
694 1 60 THR HA 1 63 LEU H 3.090 . 4.380 3.381 3.059 3.727 . 0 0 "[ . 1 . 2]" 1
695 1 60 THR HA 1 63 LEU QB 3.020 . 4.240 3.101 2.202 4.413 0.173 18 0 "[ . 1 . 2]" 1
696 1 60 THR HA 1 63 LEU MD1 2.675 . 3.550 2.746 1.364 3.464 0.436 7 0 "[ . 1 . 2]" 1
697 1 60 THR HA 1 64 LEU H 3.220 . 4.640 3.247 2.797 3.605 . 0 0 "[ . 1 . 2]" 1
698 1 60 THR HA 1 64 LEU QB 3.400 . 5.000 3.685 3.414 4.008 . 0 0 "[ . 1 . 2]" 1
699 1 60 THR HA 1 64 LEU QD 3.230 . 4.660 4.568 4.338 4.747 0.087 5 0 "[ . 1 . 2]" 1
700 1 60 THR HB 1 61 GLU H 2.980 . 4.160 2.894 2.278 4.097 . 0 0 "[ . 1 . 2]" 1
701 1 60 THR HB 1 63 LEU MD1 3.650 . 5.500 4.874 3.109 5.633 0.133 16 0 "[ . 1 . 2]" 1
702 1 60 THR HB 1 64 LEU H 3.645 . 5.490 5.321 4.928 5.517 0.027 7 0 "[ . 1 . 2]" 1
703 1 60 THR HB 2 3 PHE QD 3.715 . 5.630 5.176 4.011 5.592 . 0 0 "[ . 1 . 2]" 1
704 1 60 THR MG 1 61 GLU H 3.085 . 4.370 3.150 2.206 3.624 . 0 0 "[ . 1 . 2]" 1
705 1 60 THR MG 1 64 LEU H 3.475 . 5.150 3.906 3.408 4.817 . 0 0 "[ . 1 . 2]" 1
706 1 60 THR MG 1 64 LEU QB 3.065 . 4.330 2.828 2.201 3.849 . 0 0 "[ . 1 . 2]" 1
707 1 60 THR MG 1 64 LEU QD 2.715 . 3.630 2.974 2.433 3.767 0.137 15 0 "[ . 1 . 2]" 1
708 1 60 THR MG 2 3 PHE HA 2.780 . 3.760 2.853 2.180 3.497 . 0 0 "[ . 1 . 2]" 1
709 1 60 THR MG 2 3 PHE QE 4.140 . 6.480 5.551 4.836 5.939 . 0 0 "[ . 1 . 2]" 1
710 1 61 GLU H 1 61 GLU HB2 2.780 . 3.760 2.530 2.294 2.688 . 0 0 "[ . 1 . 2]" 1
711 1 61 GLU H 1 61 GLU QB 2.525 . 3.250 2.480 2.267 2.614 . 0 0 "[ . 1 . 2]" 1
712 1 61 GLU H 1 61 GLU HB3 2.780 . 3.760 3.582 3.541 3.629 . 0 0 "[ . 1 . 2]" 1
713 1 61 GLU H 1 61 GLU HG2 3.080 . 4.360 2.826 2.276 3.272 . 0 0 "[ . 1 . 2]" 1
714 1 61 GLU H 1 61 GLU QG 2.710 . 3.620 2.195 1.886 2.530 . 0 0 "[ . 1 . 2]" 1
715 1 61 GLU H 1 61 GLU HG3 3.080 . 4.360 2.563 1.907 3.626 . 0 0 "[ . 1 . 2]" 1
716 1 61 GLU H 1 62 THR H 2.830 . 3.860 2.761 2.664 2.906 . 0 0 "[ . 1 . 2]" 1
717 1 61 GLU HA 1 61 GLU HG2 2.835 . 3.870 2.559 2.396 2.676 . 0 0 "[ . 1 . 2]" 1
718 1 61 GLU HA 1 61 GLU QG 2.590 . 3.380 2.487 2.361 2.618 . 0 0 "[ . 1 . 2]" 1
719 1 61 GLU HA 1 61 GLU HG3 2.835 . 3.870 3.428 3.125 3.732 . 0 0 "[ . 1 . 2]" 1
720 1 61 GLU QB 1 62 THR H 2.695 . 3.590 2.648 2.276 2.919 . 0 0 "[ . 1 . 2]" 1
721 1 61 GLU QB 1 62 THR MG 3.090 . 4.380 3.844 2.841 4.580 0.200 18 0 "[ . 1 . 2]" 1
722 1 61 GLU QB 2 1 ILE QG 3.200 . 4.600 4.575 3.815 4.841 0.241 14 0 "[ . 1 . 2]" 1
723 1 61 GLU HB2 1 62 THR H 3.035 . 4.270 2.715 2.303 3.048 . 0 0 "[ . 1 . 2]" 1
724 1 61 GLU HB3 1 62 THR H 3.035 . 4.270 3.711 3.466 3.934 . 0 0 "[ . 1 . 2]" 1
725 1 61 GLU QG 1 62 THR H 3.250 . 4.700 4.060 3.714 4.396 . 0 0 "[ . 1 . 2]" 1
726 1 61 GLU HG2 1 62 THR H 3.650 . 5.500 4.768 4.473 5.080 . 0 0 "[ . 1 . 2]" 1
727 1 61 GLU HG2 2 2 THR HB 2.220 . 2.640 2.665 2.038 2.883 0.243 7 0 "[ . 1 . 2]" 1
728 1 61 GLU HG2 2 2 THR MG 2.780 . 3.760 2.377 1.715 3.713 0.085 9 0 "[ . 1 . 2]" 1
729 1 61 GLU HG3 1 62 THR H 3.650 . 5.500 4.465 3.882 5.275 . 0 0 "[ . 1 . 2]" 1
730 1 61 GLU HG3 2 2 THR HB 2.235 . 2.670 2.716 2.369 2.875 0.205 14 0 "[ . 1 . 2]" 1
731 1 61 GLU HG3 2 2 THR MG 2.780 . 3.760 3.101 2.416 3.775 0.015 11 0 "[ . 1 . 2]" 1
732 1 62 THR H 1 62 THR HB 2.840 . 3.880 3.162 2.639 3.660 . 0 0 "[ . 1 . 2]" 1
733 1 62 THR H 1 62 THR MG 2.675 . 3.550 3.167 1.936 3.697 0.147 7 0 "[ . 1 . 2]" 1
734 1 62 THR H 1 63 LEU H 2.585 . 3.370 2.440 2.255 2.656 . 0 0 "[ . 1 . 2]" 1
735 1 62 THR H 1 63 LEU HG 3.210 . 4.620 4.020 3.652 4.427 . 0 0 "[ . 1 . 2]" 1
736 1 62 THR H 1 64 LEU H 3.320 . 4.840 3.924 3.736 4.168 . 0 0 "[ . 1 . 2]" 1
737 1 62 THR HA 1 62 THR MG 2.445 . 3.090 2.271 2.150 3.205 0.115 16 0 "[ . 1 . 2]" 1
738 1 62 THR HB 1 63 LEU H 3.045 . 4.290 2.913 2.186 4.076 . 0 0 "[ . 1 . 2]" 1
739 1 62 THR HB 1 63 LEU MD2 3.005 . 4.210 4.023 3.382 4.513 0.303 7 0 "[ . 1 . 2]" 1
740 1 62 THR HB 1 63 LEU HG 3.595 . 5.390 3.792 3.087 5.062 . 0 0 "[ . 1 . 2]" 1
741 1 62 THR MG 1 63 LEU H 2.955 . 4.110 3.760 2.169 4.100 . 0 0 "[ . 1 . 2]" 1
742 1 62 THR MG 1 63 LEU HG 3.355 . 4.910 4.640 2.184 5.015 0.105 2 0 "[ . 1 . 2]" 1
743 1 63 LEU H 1 63 LEU HB2 2.875 . 3.950 2.815 2.436 3.601 . 0 0 "[ . 1 . 2]" 1
744 1 63 LEU H 1 63 LEU HB3 2.875 . 3.950 3.405 2.936 3.601 . 0 0 "[ . 1 . 2]" 1
745 1 63 LEU H 1 63 LEU MD1 2.820 . 3.840 3.271 2.329 3.656 . 0 0 "[ . 1 . 2]" 1
746 1 63 LEU H 1 63 LEU MD2 2.775 . 3.750 3.395 2.934 3.586 . 0 0 "[ . 1 . 2]" 1
747 1 63 LEU H 1 63 LEU HG 2.740 . 3.680 2.135 1.804 2.355 . 0 0 "[ . 1 . 2]" 1
748 1 63 LEU H 1 64 LEU H 2.735 . 3.670 2.652 2.500 2.865 . 0 0 "[ . 1 . 2]" 1
749 1 63 LEU HA 1 63 LEU MD2 2.555 . 3.310 2.640 1.918 4.092 0.782 20 6 "[ . * ** . -* +]" 1
750 1 63 LEU HA 1 66 GLN H 2.935 . 4.070 3.133 2.589 3.483 . 0 0 "[ . 1 . 2]" 1
751 1 63 LEU HA 1 66 GLN QB 2.710 . 3.620 2.024 1.646 2.431 0.154 10 0 "[ . 1 . 2]" 1
752 1 63 LEU HA 1 66 GLN QE 3.385 . 4.970 3.042 1.720 4.910 0.080 7 0 "[ . 1 . 2]" 1
753 1 63 LEU HA 1 66 GLN QG 3.010 . 4.220 3.838 2.485 4.271 0.051 6 0 "[ . 1 . 2]" 1
754 1 63 LEU HA 1 67 ASN H 3.130 . 4.460 3.532 3.077 3.959 . 0 0 "[ . 1 . 2]" 1
755 1 63 LEU QB 1 63 LEU MD1 2.510 . 3.220 2.133 2.078 2.266 . 0 0 "[ . 1 . 2]" 1
756 1 63 LEU QB 1 63 LEU MD2 2.470 . 3.140 2.237 2.093 2.345 . 0 0 "[ . 1 . 2]" 1
757 1 63 LEU QB 1 64 LEU H 2.850 . 3.900 2.977 2.557 3.744 . 0 0 "[ . 1 . 2]" 1
758 1 63 LEU HB2 1 63 LEU MD1 2.855 . 3.910 2.300 2.248 2.365 . 0 0 "[ . 1 . 2]" 1
759 1 63 LEU HB2 1 63 LEU MD2 2.895 . 3.990 2.963 2.382 3.204 . 0 0 "[ . 1 . 2]" 1
760 1 63 LEU HB2 1 64 LEU H 3.125 . 4.450 3.105 2.609 4.037 . 0 0 "[ . 1 . 2]" 1
761 1 63 LEU HB3 1 63 LEU MD1 2.855 . 3.910 2.621 2.325 3.159 . 0 0 "[ . 1 . 2]" 1
762 1 63 LEU HB3 1 63 LEU MD2 2.895 . 3.990 2.339 2.278 2.411 . 0 0 "[ . 1 . 2]" 1
763 1 63 LEU HB3 1 64 LEU H 3.125 . 4.450 3.925 3.574 4.453 0.003 10 0 "[ . 1 . 2]" 1
764 1 63 LEU MD2 1 66 GLN HE21 3.190 . 4.580 3.176 2.007 4.579 . 0 0 "[ . 1 . 2]" 1
765 1 63 LEU MD2 1 66 GLN QE 2.830 . 3.860 2.709 1.858 3.779 . 0 0 "[ . 1 . 2]" 1
766 1 63 LEU MD2 1 66 GLN HE22 3.190 . 4.580 3.013 2.193 4.252 . 0 0 "[ . 1 . 2]" 1
767 1 63 LEU MD2 1 66 GLN QG 3.570 . 5.340 4.494 3.378 5.617 0.277 7 0 "[ . 1 . 2]" 1
768 1 63 LEU MD2 1 67 ASN H 3.650 . 5.500 4.948 4.084 6.072 0.572 17 1 "[ . 1 . + 2]" 1
769 1 64 LEU H 1 64 LEU HB2 2.710 . 3.620 2.444 2.217 2.607 . 0 0 "[ . 1 . 2]" 1
770 1 64 LEU H 1 64 LEU HB3 2.710 . 3.620 2.572 2.461 2.719 . 0 0 "[ . 1 . 2]" 1
771 1 64 LEU H 1 64 LEU MD1 3.305 . 4.810 4.047 3.902 4.308 . 0 0 "[ . 1 . 2]" 1
772 1 64 LEU H 1 64 LEU QD 2.965 . 4.130 3.672 3.590 3.750 . 0 0 "[ . 1 . 2]" 1
773 1 64 LEU H 1 64 LEU MD2 3.305 . 4.810 4.222 3.842 4.268 . 0 0 "[ . 1 . 2]" 1
774 1 64 LEU H 1 64 LEU HG 3.310 . 4.820 4.502 4.463 4.559 . 0 0 "[ . 1 . 2]" 1
775 1 64 LEU H 1 65 VAL H 2.790 . 3.780 2.779 2.677 2.940 . 0 0 "[ . 1 . 2]" 1
776 1 64 LEU H 1 65 VAL HB 3.650 . 5.500 5.092 4.972 5.289 . 0 0 "[ . 1 . 2]" 1
777 1 64 LEU H 1 66 GLN H 3.000 . 4.200 3.946 3.757 4.087 . 0 0 "[ . 1 . 2]" 1
778 1 64 LEU HA 1 64 LEU MD1 3.250 . 4.700 2.192 1.958 3.466 . 0 0 "[ . 1 . 2]" 1
779 1 64 LEU HA 1 64 LEU QD 2.645 . 3.490 2.108 1.886 3.102 . 0 0 "[ . 1 . 2]" 1
780 1 64 LEU HA 1 64 LEU MD2 3.250 . 4.700 3.768 1.903 3.928 . 0 0 "[ . 1 . 2]" 1
781 1 64 LEU HA 1 64 LEU HG 3.010 . 4.220 3.092 2.541 3.692 . 0 0 "[ . 1 . 2]" 1
782 1 64 LEU QB 1 64 LEU QD 2.240 . 2.680 1.939 1.862 2.054 . 0 0 "[ . 1 . 2]" 1
783 1 64 LEU QB 1 65 VAL H 2.845 . 3.890 2.435 2.209 2.621 . 0 0 "[ . 1 . 2]" 1
784 1 64 LEU HB2 1 64 LEU MD1 2.895 . 3.990 2.374 2.142 3.173 . 0 0 "[ . 1 . 2]" 1
785 1 64 LEU HB2 1 64 LEU MD2 2.895 . 3.990 2.448 2.336 3.099 . 0 0 "[ . 1 . 2]" 1
786 1 64 LEU HB2 1 65 VAL H 3.235 . 4.670 3.768 3.604 3.928 . 0 0 "[ . 1 . 2]" 1
787 1 64 LEU HB3 1 64 LEU MD1 2.895 . 3.990 3.120 2.259 3.204 . 0 0 "[ . 1 . 2]" 1
788 1 64 LEU HB3 1 64 LEU MD2 2.895 . 3.990 2.337 2.161 3.187 . 0 0 "[ . 1 . 2]" 1
789 1 64 LEU HB3 1 65 VAL H 3.235 . 4.670 2.466 2.228 2.662 . 0 0 "[ . 1 . 2]" 1
790 1 64 LEU QD 1 65 VAL H 3.010 . 4.220 3.760 3.110 3.978 . 0 0 "[ . 1 . 2]" 1
791 1 64 LEU QD 1 65 VAL HA 3.385 . 4.970 4.143 2.793 4.463 . 0 0 "[ . 1 . 2]" 1
792 1 64 LEU QD 1 65 VAL QG 3.085 . 4.370 3.190 2.469 3.539 . 0 0 "[ . 1 . 2]" 1
793 1 64 LEU QD 1 68 ALA H 3.585 . 5.370 5.349 5.056 5.479 0.109 1 0 "[ . 1 . 2]" 1
794 1 64 LEU QD 1 85 LEU HA 3.145 . 4.490 4.182 3.592 4.570 0.080 17 0 "[ . 1 . 2]" 1
795 1 64 LEU QD 1 85 LEU HB2 3.375 . 4.950 4.492 3.985 4.968 0.018 8 0 "[ . 1 . 2]" 1
796 1 64 LEU QD 1 85 LEU QD 2.920 . 4.040 2.454 1.903 2.919 . 0 0 "[ . 1 . 2]" 1
797 1 64 LEU QD 2 1 ILE HA 3.090 . 4.380 3.214 1.994 4.628 0.248 15 0 "[ . 1 . 2]" 1
798 1 64 LEU QD 2 1 ILE HB 2.800 . 3.800 3.650 2.929 3.963 0.163 2 0 "[ . 1 . 2]" 1
799 1 64 LEU QD 2 1 ILE MG 3.480 . 5.160 2.892 1.761 3.902 0.039 14 0 "[ . 1 . 2]" 1
800 1 64 LEU MD1 1 65 VAL H 3.335 . 4.870 4.436 3.488 4.800 . 0 0 "[ . 1 . 2]" 1
801 1 64 LEU MD2 1 65 VAL H 3.335 . 4.870 4.114 3.150 4.441 . 0 0 "[ . 1 . 2]" 1
802 1 64 LEU HG 1 65 VAL QG 3.130 . 4.460 3.604 3.142 4.494 0.034 8 0 "[ . 1 . 2]" 1
803 1 65 VAL H 1 65 VAL HB 2.605 . 3.410 2.554 2.516 2.601 . 0 0 "[ . 1 . 2]" 1
804 1 65 VAL H 1 65 VAL MG1 2.875 . 3.950 3.775 3.761 3.790 . 0 0 "[ . 1 . 2]" 1
805 1 65 VAL H 1 65 VAL QG 2.490 . 3.180 2.078 1.946 2.145 . 0 0 "[ . 1 . 2]" 1
806 1 65 VAL H 1 65 VAL MG2 2.875 . 3.950 2.088 1.953 2.157 . 0 0 "[ . 1 . 2]" 1
807 1 65 VAL H 1 66 GLN H 2.605 . 3.410 2.414 2.357 2.457 . 0 0 "[ . 1 . 2]" 1
808 1 65 VAL HA 1 65 VAL MG1 2.605 . 3.410 2.366 2.338 2.388 . 0 0 "[ . 1 . 2]" 1
809 1 65 VAL HA 1 65 VAL MG2 2.605 . 3.410 2.433 2.405 2.473 . 0 0 "[ . 1 . 2]" 1
810 1 65 VAL HA 1 68 ALA H 2.950 . 4.100 3.787 3.478 4.112 0.012 8 0 "[ . 1 . 2]" 1
811 1 65 VAL HA 1 68 ALA MB 2.590 . 3.380 2.811 2.507 2.988 . 0 0 "[ . 1 . 2]" 1
812 1 65 VAL HA 1 76 LEU HB3 3.410 . 5.020 4.387 3.949 4.709 . 0 0 "[ . 1 . 2]" 1
813 1 65 VAL HA 1 76 LEU MD1 2.825 . 3.850 2.248 1.924 2.554 . 0 0 "[ . 1 . 2]" 1
814 1 65 VAL HB 1 66 GLN H 2.945 . 4.090 2.727 2.571 2.846 . 0 0 "[ . 1 . 2]" 1
815 1 65 VAL QG 1 66 GLN H 2.655 . 3.510 3.299 3.222 3.354 . 0 0 "[ . 1 . 2]" 1
816 1 65 VAL QG 1 66 GLN HA 2.960 . 4.120 3.561 3.412 3.784 . 0 0 "[ . 1 . 2]" 1
817 1 65 VAL QG 1 67 ASN H 3.620 . 5.440 4.738 4.660 4.848 . 0 0 "[ . 1 . 2]" 1
818 1 65 VAL QG 1 68 ALA H 3.175 . 4.550 4.340 4.194 4.457 . 0 0 "[ . 1 . 2]" 1
819 1 65 VAL QG 1 68 ALA MB 2.635 . 3.470 3.359 3.029 3.553 0.083 15 0 "[ . 1 . 2]" 1
820 1 65 VAL QG 1 73 LYS H 3.480 . 5.160 4.841 4.492 5.177 0.017 16 0 "[ . 1 . 2]" 1
821 1 65 VAL QG 1 73 LYS HA 2.755 . 3.710 2.720 2.334 3.144 . 0 0 "[ . 1 . 2]" 1
822 1 65 VAL QG 1 73 LYS QG 2.525 . 3.250 1.863 1.711 2.193 0.089 17 0 "[ . 1 . 2]" 1
823 1 65 VAL QG 1 76 LEU H 3.360 . 4.920 4.367 3.836 4.890 . 0 0 "[ . 1 . 2]" 1
824 1 65 VAL QG 1 76 LEU HB2 2.760 . 3.720 2.442 1.890 2.957 . 0 0 "[ . 1 . 2]" 1
825 1 65 VAL QG 1 76 LEU HB3 2.675 . 3.550 2.634 2.250 3.023 . 0 0 "[ . 1 . 2]" 1
826 1 65 VAL QG 1 76 LEU MD2 3.215 . 4.630 3.527 3.195 3.868 . 0 0 "[ . 1 . 2]" 1
827 1 65 VAL QG 1 77 LYS H 3.085 . 4.370 3.899 3.273 4.386 0.016 14 0 "[ . 1 . 2]" 1
828 1 65 VAL MG1 1 66 GLN H 2.970 . 4.140 3.653 3.521 3.797 . 0 0 "[ . 1 . 2]" 1
829 1 65 VAL MG1 1 76 LEU HB3 2.970 . 4.140 3.154 2.574 3.700 . 0 0 "[ . 1 . 2]" 1
830 1 65 VAL MG1 1 76 LEU MD1 2.735 . 3.670 2.259 1.912 2.656 . 0 0 "[ . 1 . 2]" 1
831 1 65 VAL MG2 1 66 GLN H 2.970 . 4.140 3.761 3.718 3.812 . 0 0 "[ . 1 . 2]" 1
832 1 65 VAL MG2 1 76 LEU HB3 2.970 . 4.140 2.846 2.347 3.300 . 0 0 "[ . 1 . 2]" 1
833 1 65 VAL MG2 1 76 LEU MD1 2.735 . 3.670 2.417 2.027 2.734 . 0 0 "[ . 1 . 2]" 1
834 1 66 GLN H 1 66 GLN HB2 2.715 . 3.630 2.513 2.257 2.722 . 0 0 "[ . 1 . 2]" 1
835 1 66 GLN H 1 66 GLN QB 2.420 . 3.040 2.208 2.080 2.428 . 0 0 "[ . 1 . 2]" 1
836 1 66 GLN H 1 66 GLN HB3 2.715 . 3.630 2.594 2.166 3.607 . 0 0 "[ . 1 . 2]" 1
837 1 66 GLN H 1 66 GLN HG2 3.130 . 4.460 4.212 3.456 4.467 0.007 19 0 "[ . 1 . 2]" 1
838 1 66 GLN H 1 66 GLN QG 2.770 . 3.740 3.658 2.249 3.930 0.190 14 0 "[ . 1 . 2]" 1
839 1 66 GLN H 1 66 GLN HG3 3.130 . 4.460 4.119 2.276 4.504 0.044 17 0 "[ . 1 . 2]" 1
840 1 66 GLN H 1 67 ASN H 2.800 . 3.800 2.704 2.553 2.846 . 0 0 "[ . 1 . 2]" 1
841 1 66 GLN H 1 68 ALA H 3.095 . 4.390 3.967 3.824 4.145 . 0 0 "[ . 1 . 2]" 1
842 1 66 GLN HA 1 66 GLN HG2 2.900 . 4.000 2.980 2.266 3.320 . 0 0 "[ . 1 . 2]" 1
843 1 66 GLN HA 1 66 GLN QG 2.595 . 3.390 2.492 2.242 2.710 . 0 0 "[ . 1 . 2]" 1
844 1 66 GLN HA 1 66 GLN HG3 2.900 . 4.000 2.765 2.460 3.554 . 0 0 "[ . 1 . 2]" 1
845 1 66 GLN HA 1 68 ALA H 3.040 . 4.280 3.863 3.660 4.069 . 0 0 "[ . 1 . 2]" 1
846 1 66 GLN HA 1 73 LYS HE2 3.355 . 4.910 2.985 1.928 4.748 . 0 0 "[ . 1 . 2]" 1
847 1 66 GLN HA 1 73 LYS QE 3.035 . 4.270 2.896 1.921 4.065 . 0 0 "[ . 1 . 2]" 1
848 1 66 GLN HA 1 73 LYS HE3 3.355 . 4.910 4.296 3.658 4.944 0.034 5 0 "[ . 1 . 2]" 1
849 1 66 GLN QB 1 67 ASN H 2.760 . 3.720 2.565 2.414 2.754 . 0 0 "[ . 1 . 2]" 1
850 1 66 GLN HB2 1 67 ASN H 3.040 . 4.280 3.706 2.530 4.056 . 0 0 "[ . 1 . 2]" 1
851 1 66 GLN HB3 1 67 ASN H 3.040 . 4.280 2.746 2.439 3.783 . 0 0 "[ . 1 . 2]" 1
852 1 66 GLN QG 1 67 ASN H 3.375 . 4.950 3.601 3.006 4.491 . 0 0 "[ . 1 . 2]" 1
853 1 66 GLN QG 1 68 ALA H 3.570 . 5.340 4.828 4.463 5.388 0.048 7 0 "[ . 1 . 2]" 1
854 1 67 ASN H 1 67 ASN HB2 2.605 . 3.410 2.434 2.288 2.535 . 0 0 "[ . 1 . 2]" 1
855 1 67 ASN H 1 68 ALA H 2.420 . 3.040 2.523 2.393 2.654 . 0 0 "[ . 1 . 2]" 1
856 1 67 ASN H 1 68 ALA MB 3.130 . 4.460 4.092 3.981 4.173 . 0 0 "[ . 1 . 2]" 1
857 1 67 ASN HA 1 68 ALA H 2.665 . 3.530 3.242 3.083 3.352 . 0 0 "[ . 1 . 2]" 1
858 1 67 ASN HB2 1 68 ALA H 3.035 . 4.270 3.597 3.340 3.865 . 0 0 "[ . 1 . 2]" 1
859 1 67 ASN HB3 1 68 ALA H 3.280 . 4.760 4.249 4.090 4.380 . 0 0 "[ . 1 . 2]" 1
860 1 68 ALA H 1 68 ALA MB 2.230 . 2.660 2.279 2.245 2.344 . 0 0 "[ . 1 . 2]" 1
861 1 68 ALA H 1 69 ASN H 3.205 . 4.610 4.581 4.522 4.627 0.017 10 0 "[ . 1 . 2]" 1
862 1 68 ALA H 1 73 LYS HB2 3.650 . 5.500 4.464 3.850 5.001 . 0 0 "[ . 1 . 2]" 1
863 1 68 ALA H 1 73 LYS HE2 3.650 . 5.500 4.225 3.314 5.554 0.054 5 0 "[ . 1 . 2]" 1
864 1 68 ALA H 1 73 LYS HE3 3.650 . 5.500 4.594 3.805 5.529 0.029 7 0 "[ . 1 . 2]" 1
865 1 68 ALA H 1 76 LEU MD1 3.610 . 5.420 4.409 4.173 4.635 . 0 0 "[ . 1 . 2]" 1
866 1 68 ALA HA 1 69 ASN H 2.460 . 3.120 2.345 2.196 2.507 . 0 0 "[ . 1 . 2]" 1
867 1 68 ALA MB 1 69 ASN H 2.485 . 3.170 2.550 2.183 2.850 . 0 0 "[ . 1 . 2]" 1
868 1 68 ALA MB 1 72 CYS H 3.315 . 4.830 4.454 4.220 4.634 . 0 0 "[ . 1 . 2]" 1
869 1 68 ALA MB 1 72 CYS HB2 3.085 . 4.370 3.053 2.041 4.286 . 0 0 "[ . 1 . 2]" 1
870 1 68 ALA MB 1 72 CYS QB 2.795 . 3.790 2.374 2.009 2.833 . 0 0 "[ . 1 . 2]" 1
871 1 68 ALA MB 1 72 CYS HB3 3.085 . 4.370 2.886 2.287 3.375 . 0 0 "[ . 1 . 2]" 1
872 1 68 ALA MB 1 73 LYS H 2.915 . 4.030 3.337 3.090 3.762 . 0 0 "[ . 1 . 2]" 1
873 1 68 ALA MB 1 73 LYS HA 3.040 . 4.280 3.152 2.793 3.458 . 0 0 "[ . 1 . 2]" 1
874 1 68 ALA MB 1 76 LEU MD1 2.515 . 3.230 2.331 2.102 2.527 . 0 0 "[ . 1 . 2]" 1
875 1 69 ASN H 1 69 ASN HB2 2.785 . 3.770 2.667 2.325 3.664 . 0 0 "[ . 1 . 2]" 1
876 1 69 ASN H 1 69 ASN HB3 2.785 . 3.770 3.406 2.548 3.637 . 0 0 "[ . 1 . 2]" 1
877 1 69 ASN H 1 69 ASN QD 3.095 . 4.390 2.600 2.148 4.351 . 0 0 "[ . 1 . 2]" 1
878 1 69 ASN H 1 70 PRO QD 3.235 . 4.670 4.406 4.323 4.433 . 0 0 "[ . 1 . 2]" 1
879 1 69 ASN H 1 72 CYS H 3.260 . 4.720 4.248 3.926 4.525 . 0 0 "[ . 1 . 2]" 1
880 1 69 ASN H 1 73 LYS H 3.555 . 5.310 4.319 4.083 4.740 . 0 0 "[ . 1 . 2]" 1
881 1 69 ASN HA 1 70 PRO HD2 2.740 . 3.680 2.279 2.057 2.422 . 0 0 "[ . 1 . 2]" 1
882 1 69 ASN HA 1 70 PRO QD 2.475 . 3.150 2.137 1.954 2.230 . 0 0 "[ . 1 . 2]" 1
883 1 69 ASN HA 1 70 PRO HD3 2.740 . 3.680 2.595 2.396 2.676 . 0 0 "[ . 1 . 2]" 1
884 1 69 ASN QB 1 69 ASN QD 2.510 . 3.220 2.156 2.076 2.670 . 0 0 "[ . 1 . 2]" 1
885 1 69 ASN QB 1 70 PRO QD 2.615 . 3.430 2.102 1.806 3.244 . 0 0 "[ . 1 . 2]" 1
886 1 69 ASN QB 1 71 ASP H 2.910 . 4.020 2.985 2.387 3.592 . 0 0 "[ . 1 . 2]" 1
887 1 70 PRO HA 1 73 LYS H 2.970 . 4.140 3.611 3.158 3.838 . 0 0 "[ . 1 . 2]" 1
888 1 70 PRO HA 1 73 LYS HB3 2.775 . 3.750 2.397 1.790 2.741 0.010 20 0 "[ . 1 . 2]" 1
889 1 70 PRO HA 1 74 THR H 3.065 . 4.330 4.060 3.746 4.327 . 0 0 "[ . 1 . 2]" 1
890 1 70 PRO QB 1 71 ASP H 2.695 . 3.590 2.852 2.705 3.197 . 0 0 "[ . 1 . 2]" 1
891 1 70 PRO HB2 1 71 ASP H 3.065 . 4.330 2.918 2.755 3.304 . 0 0 "[ . 1 . 2]" 1
892 1 70 PRO HB3 1 71 ASP H 3.065 . 4.330 4.027 3.926 4.258 . 0 0 "[ . 1 . 2]" 1
893 1 70 PRO QD 1 71 ASP H 2.630 . 3.460 3.120 2.844 3.218 . 0 0 "[ . 1 . 2]" 1
894 1 70 PRO HD2 1 71 ASP H 2.935 . 4.070 3.228 2.916 3.344 . 0 0 "[ . 1 . 2]" 1
895 1 70 PRO HD3 1 71 ASP H 2.935 . 4.070 4.138 3.953 4.202 0.132 9 0 "[ . 1 . 2]" 1
896 1 70 PRO HG2 1 71 ASP H 3.095 . 4.390 2.489 2.267 2.819 . 0 0 "[ . 1 . 2]" 1
897 1 70 PRO HG2 1 71 ASP HA 3.505 . 5.210 4.712 4.446 4.834 . 0 0 "[ . 1 . 2]" 1
898 1 70 PRO HG3 1 71 ASP H 3.050 . 4.300 4.008 3.836 4.273 . 0 0 "[ . 1 . 2]" 1
899 1 71 ASP H 1 71 ASP HB2 2.600 . 3.400 2.683 2.321 3.565 0.165 12 0 "[ . 1 . 2]" 1
900 1 71 ASP H 1 71 ASP QB 2.295 . 2.790 2.331 2.200 2.702 . 0 0 "[ . 1 . 2]" 1
901 1 71 ASP H 1 71 ASP HB3 2.600 . 3.400 2.665 2.384 3.544 0.144 8 0 "[ . 1 . 2]" 1
902 1 71 ASP H 1 72 CYS H 2.355 . 2.910 2.773 2.691 2.840 . 0 0 "[ . 1 . 2]" 1
903 1 71 ASP H 1 72 CYS HA 3.595 . 5.390 5.359 5.297 5.408 0.018 7 0 "[ . 1 . 2]" 1
904 1 71 ASP H 1 73 LYS H 2.970 . 4.140 3.989 3.734 4.155 0.015 3 0 "[ . 1 . 2]" 1
905 1 71 ASP HA 1 74 THR H 2.985 . 4.170 3.700 3.433 4.121 . 0 0 "[ . 1 . 2]" 1
906 1 71 ASP QB 1 72 CYS H 2.665 . 3.530 2.430 2.181 3.316 . 0 0 "[ . 1 . 2]" 1
907 1 71 ASP HB2 1 72 CYS H 2.960 . 4.120 3.515 2.202 3.938 . 0 0 "[ . 1 . 2]" 1
908 1 71 ASP HB3 1 72 CYS H 2.960 . 4.120 2.711 2.256 3.884 . 0 0 "[ . 1 . 2]" 1
909 1 72 CYS H 1 72 CYS QB 2.465 . 3.130 2.418 2.225 2.619 . 0 0 "[ . 1 . 2]" 1
910 1 72 CYS H 1 73 LYS H 2.460 . 3.120 2.579 2.444 2.680 . 0 0 "[ . 1 . 2]" 1
911 1 72 CYS H 1 73 LYS HB2 3.455 . 5.110 4.851 4.585 5.098 . 0 0 "[ . 1 . 2]" 1
912 1 72 CYS H 1 73 LYS HB3 3.315 . 4.830 4.720 4.592 4.831 0.001 8 0 "[ . 1 . 2]" 1
913 1 72 CYS H 1 74 THR H 3.090 . 4.380 4.124 3.884 4.389 0.009 20 0 "[ . 1 . 2]" 1
914 1 72 CYS H 1 76 LEU MD1 3.650 . 5.500 5.521 5.453 5.570 0.070 19 0 "[ . 1 . 2]" 1
915 1 72 CYS HA 1 75 ILE H 2.755 . 3.710 3.311 3.068 3.506 . 0 0 "[ . 1 . 2]" 1
916 1 72 CYS HA 1 75 ILE HB 2.750 . 3.700 2.904 2.655 3.408 . 0 0 "[ . 1 . 2]" 1
917 1 72 CYS HA 1 75 ILE MD 2.665 . 3.530 2.405 2.152 2.678 . 0 0 "[ . 1 . 2]" 1
918 1 72 CYS HA 1 75 ILE HG12 3.535 . 5.270 4.557 4.317 4.800 . 0 0 "[ . 1 . 2]" 1
919 1 72 CYS HA 1 75 ILE QG 3.130 . 4.460 3.052 2.756 3.308 . 0 0 "[ . 1 . 2]" 1
920 1 72 CYS HA 1 75 ILE HG13 3.535 . 5.270 3.101 2.788 3.373 . 0 0 "[ . 1 . 2]" 1
921 1 72 CYS HA 1 75 ILE MG 3.345 . 4.890 4.235 4.037 4.656 . 0 0 "[ . 1 . 2]" 1
922 1 72 CYS HA 1 76 LEU MD1 3.330 . 4.860 4.726 4.505 4.923 0.063 4 0 "[ . 1 . 2]" 1
923 1 72 CYS HA 1 76 LEU HG 3.380 . 4.960 4.001 3.773 4.276 . 0 0 "[ . 1 . 2]" 1
924 1 72 CYS QB 1 74 THR H 3.570 . 5.340 4.700 4.533 4.936 . 0 0 "[ . 1 . 2]" 1
925 1 72 CYS QB 1 75 ILE MD 3.260 . 4.720 3.936 3.664 4.147 . 0 0 "[ . 1 . 2]" 1
926 1 72 CYS QB 1 76 LEU MD1 2.985 . 4.170 3.396 3.022 3.747 . 0 0 "[ . 1 . 2]" 1
927 1 72 CYS QB 1 76 LEU MD2 3.205 . 4.610 4.017 3.401 4.582 . 0 0 "[ . 1 . 2]" 1
928 1 72 CYS QB 1 76 LEU HG 3.425 . 5.050 3.706 3.254 4.169 . 0 0 "[ . 1 . 2]" 1
929 1 72 CYS HB2 1 73 LYS H 2.930 . 4.060 3.146 2.451 3.948 . 0 0 "[ . 1 . 2]" 1
930 1 72 CYS HB3 1 73 LYS H 2.930 . 4.060 3.249 2.514 3.799 . 0 0 "[ . 1 . 2]" 1
931 1 73 LYS H 1 73 LYS HB2 2.490 . 3.180 2.453 2.308 2.598 . 0 0 "[ . 1 . 2]" 1
932 1 73 LYS H 1 73 LYS HB3 2.535 . 3.270 2.513 2.370 2.613 . 0 0 "[ . 1 . 2]" 1
933 1 73 LYS H 1 73 LYS QE 3.205 . 4.610 3.966 3.806 4.166 . 0 0 "[ . 1 . 2]" 1
934 1 73 LYS H 1 73 LYS HG2 3.180 . 4.560 4.463 4.385 4.522 . 0 0 "[ . 1 . 2]" 1
935 1 73 LYS H 1 73 LYS HG3 3.180 . 4.560 4.407 4.328 4.457 . 0 0 "[ . 1 . 2]" 1
936 1 73 LYS H 1 74 THR H 2.485 . 3.170 2.733 2.641 2.884 . 0 0 "[ . 1 . 2]" 1
937 1 73 LYS H 1 75 ILE H 3.280 . 4.760 4.173 4.041 4.425 . 0 0 "[ . 1 . 2]" 1
938 1 73 LYS HA 1 73 LYS HG2 2.790 . 3.780 3.236 2.958 3.581 . 0 0 "[ . 1 . 2]" 1
939 1 73 LYS HA 1 73 LYS QG 2.525 . 3.250 2.464 2.378 2.529 . 0 0 "[ . 1 . 2]" 1
940 1 73 LYS HA 1 73 LYS HG3 2.790 . 3.780 2.561 2.453 2.660 . 0 0 "[ . 1 . 2]" 1
941 1 73 LYS HA 1 74 THR HA 3.585 . 5.370 4.804 4.735 4.848 . 0 0 "[ . 1 . 2]" 1
942 1 73 LYS HA 1 75 ILE H 3.355 . 4.910 4.337 4.154 4.538 . 0 0 "[ . 1 . 2]" 1
943 1 73 LYS HA 1 76 LEU H 2.745 . 3.690 3.375 3.173 3.601 . 0 0 "[ . 1 . 2]" 1
944 1 73 LYS HA 1 76 LEU HB2 2.585 . 3.370 2.682 2.478 2.923 . 0 0 "[ . 1 . 2]" 1
945 1 73 LYS HA 1 76 LEU HB3 3.115 . 4.430 4.196 3.937 4.441 0.011 18 0 "[ . 1 . 2]" 1
946 1 73 LYS HA 1 76 LEU MD1 2.630 . 3.460 2.122 1.783 2.497 0.017 4 0 "[ . 1 . 2]" 1
947 1 73 LYS HA 1 76 LEU HG 3.105 . 4.410 2.946 2.555 3.436 . 0 0 "[ . 1 . 2]" 1
948 1 73 LYS HA 1 77 LYS H 3.045 . 4.290 4.162 3.916 4.314 0.024 9 0 "[ . 1 . 2]" 1
949 1 73 LYS HB2 1 73 LYS QE 2.995 . 4.190 2.054 1.760 2.687 0.040 14 0 "[ . 1 . 2]" 1
950 1 73 LYS HB2 1 74 THR H 2.945 . 4.090 3.893 3.770 4.052 . 0 0 "[ . 1 . 2]" 1
951 1 73 LYS HB3 1 74 THR H 2.470 . 3.140 2.647 2.494 2.806 . 0 0 "[ . 1 . 2]" 1
952 1 73 LYS QG 1 74 THR H 2.855 . 3.910 3.688 3.506 3.928 0.018 14 0 "[ . 1 . 2]" 1
953 1 74 THR H 1 74 THR HB 2.255 . 2.710 2.545 2.481 2.618 . 0 0 "[ . 1 . 2]" 1
954 1 74 THR H 1 74 THR MG 2.870 . 3.940 3.755 3.746 3.765 . 0 0 "[ . 1 . 2]" 1
955 1 74 THR H 1 75 ILE H 2.500 . 3.200 2.637 2.468 2.806 . 0 0 "[ . 1 . 2]" 1
956 1 74 THR H 1 76 LEU H 3.390 . 4.980 4.077 3.949 4.215 . 0 0 "[ . 1 . 2]" 1
957 1 74 THR HA 1 74 THR MG 2.395 . 2.990 2.390 2.360 2.416 . 0 0 "[ . 1 . 2]" 1
958 1 74 THR HA 1 75 ILE HA 3.385 . 4.970 4.765 4.724 4.791 . 0 0 "[ . 1 . 2]" 1
959 1 74 THR HA 1 77 LYS H 2.860 . 3.920 3.634 3.486 3.856 . 0 0 "[ . 1 . 2]" 1
960 1 74 THR HA 1 77 LYS QB 2.690 . 3.580 3.133 2.832 3.681 0.101 8 0 "[ . 1 . 2]" 1
961 1 74 THR HB 1 75 ILE H 2.495 . 3.190 2.619 2.489 2.792 . 0 0 "[ . 1 . 2]" 1
962 1 74 THR HB 1 75 ILE HA 3.185 . 4.570 4.269 4.160 4.386 . 0 0 "[ . 1 . 2]" 1
963 1 74 THR MG 1 75 ILE H 2.690 . 3.580 3.529 3.424 3.640 0.060 3 0 "[ . 1 . 2]" 1
964 1 74 THR MG 1 75 ILE HA 2.945 . 4.090 3.566 3.481 3.672 . 0 0 "[ . 1 . 2]" 1
965 1 74 THR MG 1 75 ILE MD 3.360 . 4.920 4.930 4.771 4.985 0.065 17 0 "[ . 1 . 2]" 1
966 1 75 ILE H 1 75 ILE HB 2.360 . 2.920 2.549 2.498 2.604 . 0 0 "[ . 1 . 2]" 1
967 1 75 ILE H 1 75 ILE MD 2.740 . 3.680 3.542 3.469 3.590 . 0 0 "[ . 1 . 2]" 1
968 1 75 ILE H 1 75 ILE HG12 2.725 . 3.650 3.353 3.261 3.468 . 0 0 "[ . 1 . 2]" 1
969 1 75 ILE H 1 75 ILE QG 2.365 . 2.930 2.054 1.963 2.168 . 0 0 "[ . 1 . 2]" 1
970 1 75 ILE H 1 75 ILE HG13 2.725 . 3.650 2.073 1.979 2.190 . 0 0 "[ . 1 . 2]" 1
971 1 75 ILE H 1 75 ILE MG 2.870 . 3.940 3.766 3.753 3.774 . 0 0 "[ . 1 . 2]" 1
972 1 75 ILE H 1 76 LEU H 2.460 . 3.120 2.561 2.471 2.630 . 0 0 "[ . 1 . 2]" 1
973 1 75 ILE H 1 77 LYS H 3.405 . 5.010 4.098 4.014 4.175 . 0 0 "[ . 1 . 2]" 1
974 1 75 ILE HA 1 75 ILE MD 2.865 . 3.930 3.851 3.832 3.873 . 0 0 "[ . 1 . 2]" 1
975 1 75 ILE HA 1 75 ILE HG12 2.665 . 3.530 2.571 2.532 2.620 . 0 0 "[ . 1 . 2]" 1
976 1 75 ILE HA 1 75 ILE QG 2.445 . 3.090 2.441 2.403 2.484 . 0 0 "[ . 1 . 2]" 1
977 1 75 ILE HA 1 75 ILE HG13 2.665 . 3.530 3.042 2.988 3.108 . 0 0 "[ . 1 . 2]" 1
978 1 75 ILE HA 1 75 ILE MG 2.490 . 3.180 2.375 2.328 2.408 . 0 0 "[ . 1 . 2]" 1
979 1 75 ILE HA 1 78 ALA H 3.020 . 4.240 3.286 3.122 3.475 . 0 0 "[ . 1 . 2]" 1
980 1 75 ILE HA 1 78 ALA MB 2.700 . 3.600 2.518 2.253 2.943 . 0 0 "[ . 1 . 2]" 1
981 1 75 ILE HB 1 75 ILE MD 2.615 . 3.430 2.414 2.382 2.429 . 0 0 "[ . 1 . 2]" 1
982 1 75 ILE HB 1 76 LEU H 2.585 . 3.370 2.622 2.476 2.724 . 0 0 "[ . 1 . 2]" 1
983 1 75 ILE MD 1 75 ILE MG 2.380 . 2.960 1.945 1.911 1.997 . 0 0 "[ . 1 . 2]" 1
984 1 75 ILE MD 1 76 LEU H 3.565 . 5.330 4.544 4.389 4.641 . 0 0 "[ . 1 . 2]" 1
985 1 75 ILE MD 1 91 ALA MB 3.035 . 4.270 3.628 3.355 4.032 . 0 0 "[ . 1 . 2]" 1
986 1 75 ILE MD 1 92 CYS HA 2.755 . 3.710 3.033 2.223 3.584 . 0 0 "[ . 1 . 2]" 1
987 1 75 ILE MD 1 92 CYS QB 3.095 . 4.390 3.874 2.774 4.429 0.039 18 0 "[ . 1 . 2]" 1
988 1 75 ILE QG 1 75 ILE MG 2.470 . 3.140 2.318 2.289 2.334 . 0 0 "[ . 1 . 2]" 1
989 1 75 ILE QG 1 76 LEU H 3.380 . 4.960 3.930 3.826 4.004 . 0 0 "[ . 1 . 2]" 1
990 1 75 ILE HG12 1 75 ILE MG 2.725 . 3.650 2.378 2.344 2.397 . 0 0 "[ . 1 . 2]" 1
991 1 75 ILE HG13 1 75 ILE MG 2.725 . 3.650 3.204 3.199 3.206 . 0 0 "[ . 1 . 2]" 1
992 1 75 ILE MG 1 76 LEU H 2.730 . 3.660 3.525 3.457 3.593 . 0 0 "[ . 1 . 2]" 1
993 1 75 ILE MG 1 76 LEU HA 2.900 . 4.000 3.559 3.466 3.657 . 0 0 "[ . 1 . 2]" 1
994 1 75 ILE MG 1 76 LEU MD2 2.880 . 3.960 3.466 3.280 3.693 . 0 0 "[ . 1 . 2]" 1
995 1 75 ILE MG 1 76 LEU HG 3.080 . 4.360 4.331 4.113 4.405 0.045 13 0 "[ . 1 . 2]" 1
996 1 75 ILE MG 1 78 ALA H 3.335 . 4.870 4.378 4.174 4.618 . 0 0 "[ . 1 . 2]" 1
997 1 75 ILE MG 1 78 ALA MB 2.615 . 3.430 3.183 2.963 3.451 0.021 1 0 "[ . 1 . 2]" 1
998 1 75 ILE MG 1 91 ALA MB 2.325 . 2.850 1.974 1.770 2.174 0.030 12 0 "[ . 1 . 2]" 1
999 1 75 ILE MG 1 92 CYS H 3.440 . 5.080 4.167 3.464 4.575 . 0 0 "[ . 1 . 2]" 1
1000 1 75 ILE MG 1 92 CYS HA 3.045 . 4.290 3.697 2.856 4.317 0.027 12 0 "[ . 1 . 2]" 1
1001 1 76 LEU H 1 76 LEU HB2 2.610 . 3.420 2.555 2.497 2.624 . 0 0 "[ . 1 . 2]" 1
1002 1 76 LEU H 1 76 LEU HB3 2.810 . 3.820 3.587 3.581 3.600 . 0 0 "[ . 1 . 2]" 1
1003 1 76 LEU H 1 76 LEU MD1 2.810 . 3.820 3.571 3.506 3.646 . 0 0 "[ . 1 . 2]" 1
1004 1 76 LEU H 1 76 LEU MD2 2.860 . 3.920 3.148 2.961 3.272 . 0 0 "[ . 1 . 2]" 1
1005 1 76 LEU H 1 76 LEU HG 2.500 . 3.200 2.127 2.026 2.223 . 0 0 "[ . 1 . 2]" 1
1006 1 76 LEU HA 1 76 LEU MD1 2.995 . 4.190 3.873 3.846 3.894 . 0 0 "[ . 1 . 2]" 1
1007 1 76 LEU HA 1 76 LEU MD2 2.450 . 3.100 2.054 2.006 2.106 . 0 0 "[ . 1 . 2]" 1
1008 1 76 LEU HA 1 76 LEU HG 2.895 . 3.990 3.153 3.080 3.232 . 0 0 "[ . 1 . 2]" 1
1009 1 76 LEU HA 1 78 ALA H 3.120 . 4.440 4.162 3.960 4.344 . 0 0 "[ . 1 . 2]" 1
1010 1 76 LEU HA 1 79 LEU H 2.845 . 3.890 3.499 3.195 3.692 . 0 0 "[ . 1 . 2]" 1
1011 1 76 LEU HA 1 79 LEU HB2 3.010 . 4.220 3.029 2.482 3.273 . 0 0 "[ . 1 . 2]" 1
1012 1 76 LEU HA 1 79 LEU HB3 3.385 . 4.970 4.640 4.072 4.913 . 0 0 "[ . 1 . 2]" 1
1013 1 76 LEU HA 1 79 LEU QD 2.635 . 3.470 2.304 1.793 2.675 0.007 10 0 "[ . 1 . 2]" 1
1014 1 76 LEU HA 1 80 GLY H 3.475 . 5.150 4.466 3.837 5.074 . 0 0 "[ . 1 . 2]" 1
1015 1 76 LEU HA 1 88 MET ME 3.020 . 4.240 3.712 3.409 3.952 . 0 0 "[ . 1 . 2]" 1
1016 1 76 LEU HA 1 91 ALA MB 3.170 . 4.540 4.289 3.832 4.593 0.053 4 0 "[ . 1 . 2]" 1
1017 1 76 LEU HB2 1 76 LEU MD1 2.715 . 3.630 2.330 2.310 2.367 . 0 0 "[ . 1 . 2]" 1
1018 1 76 LEU HB2 1 76 LEU MD2 2.555 . 3.310 3.201 3.193 3.206 . 0 0 "[ . 1 . 2]" 1
1019 1 76 LEU HB3 1 76 LEU MD1 2.795 . 3.790 2.387 2.356 2.416 . 0 0 "[ . 1 . 2]" 1
1020 1 76 LEU HB3 1 76 LEU MD2 2.685 . 3.570 2.376 2.348 2.409 . 0 0 "[ . 1 . 2]" 1
1021 1 76 LEU HB3 1 77 LYS H 2.865 . 3.930 3.723 3.558 3.865 . 0 0 "[ . 1 . 2]" 1
1022 1 76 LEU MD1 1 77 LYS H 3.315 . 4.830 4.509 4.301 4.707 . 0 0 "[ . 1 . 2]" 1
1023 1 76 LEU MD2 1 77 LYS H 3.440 . 5.080 4.631 4.583 4.672 . 0 0 "[ . 1 . 2]" 1
1024 1 76 LEU MD2 1 79 LEU QD 2.530 . 3.260 2.788 1.903 3.283 0.023 19 0 "[ . 1 . 2]" 1
1025 1 76 LEU MD2 1 88 MET H 3.330 . 4.860 4.720 4.466 4.878 0.018 18 0 "[ . 1 . 2]" 1
1026 1 76 LEU MD2 1 88 MET HA 2.740 . 3.680 2.992 2.473 3.551 . 0 0 "[ . 1 . 2]" 1
1027 1 76 LEU MD2 1 88 MET QB 2.660 . 3.520 2.179 1.830 2.536 . 0 0 "[ . 1 . 2]" 1
1028 1 76 LEU MD2 1 88 MET ME 2.740 . 3.680 3.608 3.076 3.750 0.070 4 0 "[ . 1 . 2]" 1
1029 1 76 LEU MD2 1 88 MET HG2 2.955 . 4.110 3.432 1.912 4.125 0.015 20 0 "[ . 1 . 2]" 1
1030 1 76 LEU MD2 1 88 MET HG3 2.955 . 4.110 2.920 1.815 3.667 . 0 0 "[ . 1 . 2]" 1
1031 1 76 LEU MD2 1 89 MET H 3.555 . 5.310 5.032 4.666 5.420 0.110 14 0 "[ . 1 . 2]" 1
1032 1 76 LEU MD2 1 91 ALA MB 2.885 . 3.970 3.387 2.592 3.945 . 0 0 "[ . 1 . 2]" 1
1033 1 77 LYS H 1 77 LYS QB 2.320 . 2.840 2.381 2.295 2.505 . 0 0 "[ . 1 . 2]" 1
1034 1 77 LYS H 1 77 LYS HD2 3.650 . 5.500 4.469 3.482 5.018 . 0 0 "[ . 1 . 2]" 1
1035 1 77 LYS H 1 77 LYS HD3 3.650 . 5.500 4.390 3.606 5.080 . 0 0 "[ . 1 . 2]" 1
1036 1 77 LYS H 1 77 LYS HG2 2.995 . 4.190 3.030 2.252 3.782 . 0 0 "[ . 1 . 2]" 1
1037 1 77 LYS H 1 77 LYS QG 2.615 . 3.430 2.435 2.225 2.662 . 0 0 "[ . 1 . 2]" 1
1038 1 77 LYS H 1 77 LYS HG3 2.995 . 4.190 3.095 2.294 3.961 . 0 0 "[ . 1 . 2]" 1
1039 1 77 LYS H 1 78 ALA H 2.440 . 3.080 2.519 2.453 2.658 . 0 0 "[ . 1 . 2]" 1
1040 1 77 LYS H 1 79 LEU H 3.250 . 4.700 4.112 3.985 4.213 . 0 0 "[ . 1 . 2]" 1
1041 1 77 LYS HA 1 77 LYS HD2 3.650 . 5.500 3.908 1.939 4.843 . 0 0 "[ . 1 . 2]" 1
1042 1 77 LYS HA 1 77 LYS QD 3.270 . 4.740 3.348 1.878 4.519 . 0 0 "[ . 1 . 2]" 1
1043 1 77 LYS HA 1 77 LYS HD3 3.650 . 5.500 3.815 1.903 5.535 0.035 3 0 "[ . 1 . 2]" 1
1044 1 77 LYS HA 1 77 LYS HG2 2.905 . 4.010 2.868 2.356 3.894 . 0 0 "[ . 1 . 2]" 1
1045 1 77 LYS HA 1 77 LYS QG 2.595 . 3.390 2.699 2.286 3.352 . 0 0 "[ . 1 . 2]" 1
1046 1 77 LYS HA 1 77 LYS HG3 2.905 . 4.010 3.371 2.955 3.742 . 0 0 "[ . 1 . 2]" 1
1047 1 77 LYS HA 1 79 LEU H 3.195 . 4.590 4.129 3.912 4.415 . 0 0 "[ . 1 . 2]" 1
1048 1 77 LYS QB 1 78 ALA H 2.735 . 3.670 2.963 2.578 3.623 . 0 0 "[ . 1 . 2]" 1
1049 1 77 LYS HB2 1 78 ALA H 3.125 . 4.450 3.114 2.645 4.109 . 0 0 "[ . 1 . 2]" 1
1050 1 77 LYS HB3 1 78 ALA H 3.125 . 4.450 3.836 3.565 4.057 . 0 0 "[ . 1 . 2]" 1
1051 1 78 ALA H 1 78 ALA MB 2.210 . 2.620 2.248 2.240 2.261 . 0 0 "[ . 1 . 2]" 1
1052 1 78 ALA H 1 79 LEU H 2.430 . 3.060 2.559 2.434 2.671 . 0 0 "[ . 1 . 2]" 1
1053 1 78 ALA H 1 79 LEU QD 3.535 . 5.270 4.330 3.648 4.765 . 0 0 "[ . 1 . 2]" 1
1054 1 78 ALA HA 1 80 GLY H 3.230 . 4.660 4.615 4.264 4.718 0.058 5 0 "[ . 1 . 2]" 1
1055 1 78 ALA MB 1 79 LEU H 2.515 . 3.230 2.675 2.511 2.780 . 0 0 "[ . 1 . 2]" 1
1056 1 78 ALA MB 1 80 GLY H 3.325 . 4.850 4.724 4.529 4.853 0.003 5 0 "[ . 1 . 2]" 1
1057 1 79 LEU H 1 79 LEU HB2 2.405 . 3.010 2.287 2.141 2.417 . 0 0 "[ . 1 . 2]" 1
1058 1 79 LEU H 1 79 LEU HB3 2.725 . 3.650 3.533 3.446 3.581 . 0 0 "[ . 1 . 2]" 1
1059 1 79 LEU H 1 79 LEU MD1 2.985 . 4.170 3.509 3.121 3.820 . 0 0 "[ . 1 . 2]" 1
1060 1 79 LEU H 1 79 LEU QD 2.545 . 3.290 2.814 2.237 3.203 . 0 0 "[ . 1 . 2]" 1
1061 1 79 LEU H 1 79 LEU MD2 2.985 . 4.170 3.194 2.265 4.015 . 0 0 "[ . 1 . 2]" 1
1062 1 79 LEU H 1 79 LEU HG 3.085 . 4.370 3.292 2.357 4.240 . 0 0 "[ . 1 . 2]" 1
1063 1 79 LEU H 1 80 GLY H 2.545 . 3.290 2.661 2.484 2.777 . 0 0 "[ . 1 . 2]" 1
1064 1 79 LEU HA 1 79 LEU MD1 3.040 . 4.280 2.945 1.800 3.897 . 0 0 "[ . 1 . 2]" 1
1065 1 79 LEU HA 1 79 LEU QD 2.300 . 2.800 2.013 1.778 2.411 0.022 19 0 "[ . 1 . 2]" 1
1066 1 79 LEU HA 1 79 LEU MD2 3.040 . 4.280 2.471 2.071 3.027 . 0 0 "[ . 1 . 2]" 1
1067 1 79 LEU HA 1 83 ALA MB 3.050 . 4.300 3.693 3.429 4.128 . 0 0 "[ . 1 . 2]" 1
1068 1 79 LEU HB2 1 79 LEU MD1 2.645 . 3.490 2.652 2.148 3.196 . 0 0 "[ . 1 . 2]" 1
1069 1 79 LEU HB2 1 79 LEU QD 2.415 . 3.030 2.191 2.111 2.258 . 0 0 "[ . 1 . 2]" 1
1070 1 79 LEU HB2 1 79 LEU MD2 2.645 . 3.490 2.755 2.238 3.186 . 0 0 "[ . 1 . 2]" 1
1071 1 79 LEU HB2 1 80 GLY H 2.760 . 3.720 2.496 2.306 2.727 . 0 0 "[ . 1 . 2]" 1
1072 1 79 LEU HB3 1 79 LEU MD1 2.690 . 3.580 2.517 2.446 2.654 . 0 0 "[ . 1 . 2]" 1
1073 1 79 LEU HB3 1 79 LEU QD 2.415 . 3.030 2.236 2.074 2.440 . 0 0 "[ . 1 . 2]" 1
1074 1 79 LEU HB3 1 79 LEU MD2 2.690 . 3.580 2.658 2.165 3.190 . 0 0 "[ . 1 . 2]" 1
1075 1 79 LEU HB3 1 80 GLY H 2.820 . 3.840 3.170 2.816 3.475 . 0 0 "[ . 1 . 2]" 1
1076 1 79 LEU HB3 1 83 ALA H 3.350 . 4.900 4.387 3.815 4.870 . 0 0 "[ . 1 . 2]" 1
1077 1 79 LEU HB3 1 83 ALA MB 2.550 . 3.300 2.179 1.841 2.492 . 0 0 "[ . 1 . 2]" 1
1078 1 79 LEU QD 1 80 GLY H 3.195 . 4.590 3.892 3.746 3.976 . 0 0 "[ . 1 . 2]" 1
1079 1 79 LEU QD 1 83 ALA MB 2.395 . 2.990 2.474 1.922 2.940 . 0 0 "[ . 1 . 2]" 1
1080 1 79 LEU QD 1 84 THR H 3.205 . 4.610 4.501 4.082 4.682 0.072 18 0 "[ . 1 . 2]" 1
1081 1 79 LEU QD 1 87 GLU QB 3.180 . 4.560 2.115 1.823 2.407 . 0 0 "[ . 1 . 2]" 1
1082 1 79 LEU QD 1 87 GLU QG 2.940 . 4.080 3.306 2.644 3.878 . 0 0 "[ . 1 . 2]" 1
1083 1 79 LEU QD 1 88 MET H 3.150 . 4.500 3.640 3.210 4.007 . 0 0 "[ . 1 . 2]" 1
1084 1 79 LEU QD 1 88 MET HA 2.560 . 3.320 2.424 2.053 2.798 . 0 0 "[ . 1 . 2]" 1
1085 1 79 LEU QD 1 88 MET QG 2.925 . 4.050 3.233 1.806 3.916 . 0 0 "[ . 1 . 2]" 1
1086 1 79 LEU QD 1 91 ALA H 3.125 . 4.450 3.726 3.451 3.917 . 0 0 "[ . 1 . 2]" 1
1087 1 79 LEU QD 1 91 ALA HA 3.230 . 4.660 3.853 3.651 4.091 . 0 0 "[ . 1 . 2]" 1
1088 1 79 LEU QD 1 91 ALA MB 2.280 . 2.760 1.820 1.749 1.975 0.051 12 0 "[ . 1 . 2]" 1
1089 1 79 LEU QD 1 92 CYS H 3.620 . 5.440 4.596 4.198 4.854 . 0 0 "[ . 1 . 2]" 1
1090 1 79 LEU MD1 1 80 GLY H 3.540 . 5.280 4.342 4.086 4.580 . 0 0 "[ . 1 . 2]" 1
1091 1 79 LEU MD1 1 87 GLU H 3.650 . 5.500 5.035 4.629 5.403 . 0 0 "[ . 1 . 2]" 1
1092 1 79 LEU MD1 1 88 MET H 3.600 . 5.400 3.967 3.268 4.607 . 0 0 "[ . 1 . 2]" 1
1093 1 79 LEU MD1 1 88 MET HA 3.020 . 4.240 3.145 2.106 4.343 0.103 16 0 "[ . 1 . 2]" 1
1094 1 79 LEU MD1 1 88 MET ME 2.440 . 3.080 2.591 1.768 3.191 0.111 2 0 "[ . 1 . 2]" 1
1095 1 79 LEU MD1 1 91 ALA H 3.440 . 5.080 4.302 3.602 5.009 . 0 0 "[ . 1 . 2]" 1
1096 1 79 LEU MD1 1 91 ALA MB 2.555 . 3.310 2.435 1.759 3.302 0.041 12 0 "[ . 1 . 2]" 1
1097 1 79 LEU MD2 1 80 GLY H 3.540 . 5.280 4.461 3.998 4.770 . 0 0 "[ . 1 . 2]" 1
1098 1 79 LEU MD2 1 87 GLU H 3.650 . 5.500 5.535 5.069 5.710 0.210 5 0 "[ . 1 . 2]" 1
1099 1 79 LEU MD2 1 88 MET H 3.600 . 5.400 4.507 3.839 4.910 . 0 0 "[ . 1 . 2]" 1
1100 1 79 LEU MD2 1 88 MET HA 3.020 . 4.240 3.480 2.067 4.299 0.059 17 0 "[ . 1 . 2]" 1
1101 1 79 LEU MD2 1 88 MET ME 2.440 . 3.080 3.093 2.853 3.181 0.101 13 0 "[ . 1 . 2]" 1
1102 1 79 LEU MD2 1 91 ALA H 3.440 . 5.080 4.387 3.867 4.947 . 0 0 "[ . 1 . 2]" 1
1103 1 79 LEU MD2 1 91 ALA MB 2.555 . 3.310 2.323 1.794 3.079 0.006 5 0 "[ . 1 . 2]" 1
1104 1 79 LEU HG 1 80 GLY H 3.635 . 5.470 4.645 4.326 5.072 . 0 0 "[ . 1 . 2]" 1
1105 1 80 GLY H 1 81 PRO HD2 3.410 . 5.020 4.889 4.734 5.030 0.010 9 0 "[ . 1 . 2]" 1
1106 1 80 GLY H 1 81 PRO QD 3.030 . 4.260 4.193 4.030 4.325 0.065 9 0 "[ . 1 . 2]" 1
1107 1 80 GLY H 1 81 PRO HD3 3.410 . 5.020 4.570 4.327 4.822 . 0 0 "[ . 1 . 2]" 1
1108 1 80 GLY H 1 83 ALA MB 3.650 . 5.500 4.129 3.744 4.418 . 0 0 "[ . 1 . 2]" 1
1109 1 80 GLY H 1 88 MET ME 3.305 . 4.810 3.584 3.157 4.065 . 0 0 "[ . 1 . 2]" 1
1110 1 80 GLY QA 1 81 PRO QD 2.230 . 2.660 2.057 2.026 2.090 . 0 0 "[ . 1 . 2]" 1
1111 1 80 GLY QA 1 81 PRO HG2 3.140 . 4.480 4.170 3.975 4.278 . 0 0 "[ . 1 . 2]" 1
1112 1 80 GLY QA 1 82 ALA H 2.790 . 3.780 3.003 2.892 3.124 . 0 0 "[ . 1 . 2]" 1
1113 1 80 GLY HA2 1 81 PRO HD2 2.610 . 3.420 2.760 2.551 3.134 . 0 0 "[ . 1 . 2]" 1
1114 1 80 GLY HA2 1 81 PRO HD3 2.610 . 3.420 2.376 2.211 2.616 . 0 0 "[ . 1 . 2]" 1
1115 1 80 GLY HA2 1 82 ALA H 3.180 . 4.560 4.062 3.901 4.208 . 0 0 "[ . 1 . 2]" 1
1116 1 80 GLY HA3 1 81 PRO HD2 2.610 . 3.420 2.530 2.300 2.728 . 0 0 "[ . 1 . 2]" 1
1117 1 80 GLY HA3 1 81 PRO HD3 2.610 . 3.420 3.232 2.842 3.438 0.018 7 0 "[ . 1 . 2]" 1
1118 1 80 GLY HA3 1 82 ALA H 3.180 . 4.560 3.094 2.964 3.246 . 0 0 "[ . 1 . 2]" 1
1119 1 81 PRO HA 1 83 ALA H 2.885 . 3.970 3.549 3.363 3.890 . 0 0 "[ . 1 . 2]" 1
1120 1 81 PRO HB2 1 82 ALA H 2.860 . 3.920 3.837 3.644 3.956 0.036 9 0 "[ . 1 . 2]" 1
1121 1 81 PRO HB2 1 82 ALA MB 3.190 . 4.580 4.559 4.322 4.637 0.057 1 0 "[ . 1 . 2]" 1
1122 1 81 PRO HB2 1 83 ALA H 3.555 . 5.310 5.062 4.835 5.346 0.036 18 0 "[ . 1 . 2]" 1
1123 1 81 PRO HB3 1 82 ALA H 3.205 . 4.610 4.422 4.321 4.460 . 0 0 "[ . 1 . 2]" 1
1124 1 81 PRO QD 1 82 ALA H 2.725 . 3.650 2.695 2.547 2.982 . 0 0 "[ . 1 . 2]" 1
1125 1 81 PRO HD2 1 82 ALA H 3.070 . 4.340 2.748 2.587 3.066 . 0 0 "[ . 1 . 2]" 1
1126 1 81 PRO HD3 1 82 ALA H 3.070 . 4.340 3.901 3.808 4.071 . 0 0 "[ . 1 . 2]" 1
1127 1 81 PRO HG2 1 82 ALA H 2.835 . 3.870 3.137 2.827 3.306 . 0 0 "[ . 1 . 2]" 1
1128 1 81 PRO HG2 1 83 ALA H 3.650 . 5.500 5.279 5.052 5.456 . 0 0 "[ . 1 . 2]" 1
1129 1 81 PRO HG3 1 82 ALA H 3.135 . 4.470 4.421 4.203 4.502 0.032 4 0 "[ . 1 . 2]" 1
1130 1 82 ALA H 1 82 ALA MB 2.310 . 2.820 2.299 2.238 2.364 . 0 0 "[ . 1 . 2]" 1
1131 1 82 ALA H 1 83 ALA H 2.395 . 2.990 2.459 2.227 2.739 . 0 0 "[ . 1 . 2]" 1
1132 1 82 ALA H 1 83 ALA MB 3.140 . 4.480 3.955 3.756 4.247 . 0 0 "[ . 1 . 2]" 1
1133 1 82 ALA MB 1 83 ALA H 2.615 . 3.430 3.288 2.951 3.569 0.139 16 0 "[ . 1 . 2]" 1
1134 1 83 ALA H 1 83 ALA MB 2.205 . 2.610 2.355 2.247 2.562 . 0 0 "[ . 1 . 2]" 1
1135 1 83 ALA H 1 84 THR H 3.205 . 4.610 4.513 4.426 4.596 . 0 0 "[ . 1 . 2]" 1
1136 1 83 ALA H 1 88 MET ME 3.210 . 4.620 3.619 3.275 4.030 . 0 0 "[ . 1 . 2]" 1
1137 1 83 ALA HA 1 84 THR H 2.270 . 2.740 2.488 2.296 2.641 . 0 0 "[ . 1 . 2]" 1
1138 1 83 ALA MB 1 84 THR H 2.290 . 2.780 2.300 2.047 2.644 . 0 0 "[ . 1 . 2]" 1
1139 1 83 ALA MB 1 87 GLU HB2 3.060 . 4.320 2.409 2.205 2.803 . 0 0 "[ . 1 . 2]" 1
1140 1 83 ALA MB 1 87 GLU QB 2.740 . 3.680 2.298 2.048 2.666 . 0 0 "[ . 1 . 2]" 1
1141 1 83 ALA MB 1 87 GLU HB3 3.060 . 4.320 2.931 2.432 3.336 . 0 0 "[ . 1 . 2]" 1
1142 1 83 ALA MB 1 87 GLU QG 2.960 . 4.120 2.658 1.776 3.802 0.024 9 0 "[ . 1 . 2]" 1
1143 1 83 ALA MB 1 88 MET H 3.225 . 4.650 4.344 3.844 4.598 . 0 0 "[ . 1 . 2]" 1
1144 1 83 ALA MB 1 88 MET ME 2.370 . 2.940 1.882 1.720 2.202 0.080 12 0 "[ . 1 . 2]" 1
1145 1 83 ALA MB 1 88 MET QG 3.070 . 4.340 4.043 3.729 4.413 0.073 12 0 "[ . 1 . 2]" 1
1146 1 84 THR H 1 84 THR MG 2.410 . 3.020 2.330 2.016 2.663 . 0 0 "[ . 1 . 2]" 1
1147 1 84 THR H 1 85 LEU H 3.255 . 4.710 4.489 4.397 4.564 . 0 0 "[ . 1 . 2]" 1
1148 1 84 THR H 1 87 GLU H 2.895 . 3.990 3.543 3.272 3.682 . 0 0 "[ . 1 . 2]" 1
1149 1 84 THR H 1 87 GLU HA 3.480 . 5.160 5.181 4.938 5.324 0.164 14 0 "[ . 1 . 2]" 1
1150 1 84 THR H 1 87 GLU QB 2.535 . 3.270 2.711 2.321 3.145 . 0 0 "[ . 1 . 2]" 1
1151 1 84 THR H 1 87 GLU QG 3.400 . 5.000 2.575 1.913 3.376 . 0 0 "[ . 1 . 2]" 1
1152 1 84 THR H 1 88 MET ME 2.655 . 3.510 3.506 2.990 3.634 0.124 17 0 "[ . 1 . 2]" 1
1153 1 84 THR HA 1 84 THR MG 2.500 . 3.200 2.798 2.302 3.217 0.017 16 0 "[ . 1 . 2]" 1
1154 1 84 THR HA 1 85 LEU H 2.540 . 3.280 2.527 2.379 2.670 . 0 0 "[ . 1 . 2]" 1
1155 1 84 THR HA 1 85 LEU HB2 3.405 . 5.010 4.702 4.593 4.819 . 0 0 "[ . 1 . 2]" 1
1156 1 84 THR HA 1 86 GLU H 3.275 . 4.750 4.543 4.199 4.817 0.067 5 0 "[ . 1 . 2]" 1
1157 1 84 THR MG 1 85 LEU H 2.825 . 3.850 3.379 2.690 3.807 . 0 0 "[ . 1 . 2]" 1
1158 1 84 THR MG 1 87 GLU H 3.100 . 4.400 3.446 2.217 4.596 0.196 15 0 "[ . 1 . 2]" 1
1159 1 84 THR MG 1 87 GLU QB 3.465 . 5.130 3.941 3.228 4.728 . 0 0 "[ . 1 . 2]" 1
1160 1 84 THR MG 1 87 GLU HG2 3.650 . 5.500 3.538 1.806 5.353 . 0 0 "[ . 1 . 2]" 1
1161 1 84 THR MG 1 87 GLU QG 3.295 . 4.790 3.016 1.784 4.318 0.016 5 0 "[ . 1 . 2]" 1
1162 1 84 THR MG 1 87 GLU HG3 3.650 . 5.500 3.682 2.091 5.515 0.015 11 0 "[ . 1 . 2]" 1
1163 1 85 LEU H 1 85 LEU HB2 2.735 . 3.670 2.456 2.356 2.530 . 0 0 "[ . 1 . 2]" 1
1164 1 85 LEU H 1 85 LEU HB3 2.715 . 3.630 2.553 2.480 2.675 . 0 0 "[ . 1 . 2]" 1
1165 1 85 LEU H 1 85 LEU QD 3.300 . 4.800 3.682 3.617 3.721 . 0 0 "[ . 1 . 2]" 1
1166 1 85 LEU H 1 85 LEU HG 3.160 . 4.520 4.482 4.441 4.517 . 0 0 "[ . 1 . 2]" 1
1167 1 85 LEU H 1 86 GLU H 2.745 . 3.690 2.787 2.603 2.931 . 0 0 "[ . 1 . 2]" 1
1168 1 85 LEU H 1 87 GLU H 3.260 . 4.720 4.270 4.103 4.394 . 0 0 "[ . 1 . 2]" 1
1169 1 85 LEU H 2 1 ILE MD 3.155 . 4.510 3.360 2.637 4.537 0.027 15 0 "[ . 1 . 2]" 1
1170 1 85 LEU H 2 1 ILE MG 3.155 . 4.510 3.133 2.303 4.339 . 0 0 "[ . 1 . 2]" 1
1171 1 85 LEU HA 1 85 LEU MD1 3.110 . 4.420 2.157 2.042 2.504 . 0 0 "[ . 1 . 2]" 1
1172 1 85 LEU HA 1 85 LEU QD 2.640 . 3.480 2.146 2.034 2.473 . 0 0 "[ . 1 . 2]" 1
1173 1 85 LEU HA 1 85 LEU MD2 3.110 . 4.420 3.892 3.832 3.939 . 0 0 "[ . 1 . 2]" 1
1174 1 85 LEU HA 1 85 LEU HG 2.945 . 4.090 3.011 2.592 3.149 . 0 0 "[ . 1 . 2]" 1
1175 1 85 LEU HA 1 88 MET QG 3.075 . 4.350 2.948 2.156 4.270 . 0 0 "[ . 1 . 2]" 1
1176 1 85 LEU HB2 1 86 GLU H 2.900 . 4.000 3.846 3.795 3.934 . 0 0 "[ . 1 . 2]" 1
1177 1 85 LEU HB3 1 85 LEU MD1 2.805 . 3.810 3.183 3.091 3.199 . 0 0 "[ . 1 . 2]" 1
1178 1 85 LEU HB3 1 85 LEU MD2 2.805 . 3.810 2.242 2.147 2.302 . 0 0 "[ . 1 . 2]" 1
1179 1 85 LEU HB3 1 86 GLU H 2.965 . 4.130 2.561 2.417 2.732 . 0 0 "[ . 1 . 2]" 1
1180 1 85 LEU QD 1 86 GLU H 3.275 . 4.750 3.833 3.611 3.987 . 0 0 "[ . 1 . 2]" 1
1181 1 85 LEU QD 1 86 GLU QB 3.145 . 4.490 4.426 4.160 4.686 0.196 6 0 "[ . 1 . 2]" 1
1182 1 85 LEU QD 1 89 MET ME 2.635 . 3.470 3.262 2.294 3.504 0.034 2 0 "[ . 1 . 2]" 1
1183 1 85 LEU QD 1 89 MET QG 3.215 . 4.630 2.920 2.499 3.425 . 0 0 "[ . 1 . 2]" 1
1184 1 85 LEU MD1 2 1 ILE MD 3.465 . 5.130 4.385 1.897 4.979 . 0 0 "[ . 1 . 2]" 1
1185 1 85 LEU MD1 2 1 ILE MG 3.670 . 5.540 2.950 2.412 3.614 . 0 0 "[ . 1 . 2]" 1
1186 1 85 LEU MD1 2 6 LEU HG 3.155 . 4.510 4.474 3.901 4.588 0.078 1 0 "[ . 1 . 2]" 1
1187 1 85 LEU MD2 2 1 ILE MD 3.610 . 5.420 5.233 3.250 5.542 0.122 18 0 "[ . 1 . 2]" 1
1188 1 85 LEU MD2 2 1 ILE MG 3.900 . 6.000 4.352 3.161 5.154 . 0 0 "[ . 1 . 2]" 1
1189 1 85 LEU MD2 2 6 LEU HA 3.155 . 4.510 2.202 1.782 2.636 0.018 13 0 "[ . 1 . 2]" 1
1190 1 85 LEU MD2 2 6 LEU HG 3.155 . 4.510 3.995 3.788 4.459 . 0 0 "[ . 1 . 2]" 1
1191 1 85 LEU MD2 2 9 TYR HB2 2.985 . 4.170 2.752 2.180 3.352 . 0 0 "[ . 1 . 2]" 1
1192 1 85 LEU MD2 2 9 TYR HB3 2.780 . 3.760 2.787 2.339 3.309 . 0 0 "[ . 1 . 2]" 1
1193 1 85 LEU MD2 2 9 TYR QD 4.220 . 6.640 2.794 2.431 3.224 . 0 0 "[ . 1 . 2]" 1
1194 1 85 LEU MD2 2 9 TYR QE 4.230 . 6.660 3.614 3.180 3.935 . 0 0 "[ . 1 . 2]" 1
1195 1 85 LEU MD2 2 10 TYR QD 4.230 . 6.660 4.074 3.667 4.642 . 0 0 "[ . 1 . 2]" 1
1196 1 85 LEU MD2 2 10 TYR QE 4.480 . 6.660 3.381 2.791 3.980 . 0 0 "[ . 1 . 2]" 1
1197 1 85 LEU HG 1 86 GLU H 3.160 . 4.520 3.814 3.584 4.094 . 0 0 "[ . 1 . 2]" 1
1198 1 85 LEU HG 1 86 GLU HA 3.355 . 4.910 3.689 3.406 4.190 . 0 0 "[ . 1 . 2]" 1
1199 1 85 LEU HG 1 89 MET ME 3.015 . 4.230 3.848 2.723 4.178 . 0 0 "[ . 1 . 2]" 1
1200 1 85 LEU HG 1 89 MET HG2 3.465 . 5.130 3.043 2.215 4.290 . 0 0 "[ . 1 . 2]" 1
1201 1 85 LEU HG 1 89 MET QG 3.065 . 4.330 2.455 2.133 3.047 . 0 0 "[ . 1 . 2]" 1
1202 1 85 LEU HG 1 89 MET HG3 3.465 . 5.130 2.834 2.401 3.695 . 0 0 "[ . 1 . 2]" 1
1203 1 86 GLU H 1 86 GLU HB2 2.715 . 3.630 2.591 2.287 3.623 . 0 0 "[ . 1 . 2]" 1
1204 1 86 GLU H 1 86 GLU QB 2.410 . 3.020 2.270 2.167 2.606 . 0 0 "[ . 1 . 2]" 1
1205 1 86 GLU H 1 86 GLU HB3 2.715 . 3.630 2.634 2.395 3.591 . 0 0 "[ . 1 . 2]" 1
1206 1 86 GLU H 1 86 GLU QG 2.825 . 3.850 3.575 1.982 4.002 0.152 16 0 "[ . 1 . 2]" 1
1207 1 86 GLU H 1 87 GLU H 2.665 . 3.530 2.713 2.592 2.822 . 0 0 "[ . 1 . 2]" 1
1208 1 86 GLU HA 1 86 GLU QG 2.760 . 3.720 2.636 2.284 3.350 . 0 0 "[ . 1 . 2]" 1
1209 1 86 GLU HA 1 89 MET H 2.805 . 3.810 3.359 3.012 3.609 . 0 0 "[ . 1 . 2]" 1
1210 1 86 GLU HA 1 89 MET ME 3.235 . 4.670 4.495 4.157 4.723 0.053 13 0 "[ . 1 . 2]" 1
1211 1 86 GLU HA 1 89 MET HG2 3.415 . 5.030 3.594 2.220 4.663 . 0 0 "[ . 1 . 2]" 1
1212 1 86 GLU HA 1 89 MET QG 3.090 . 4.380 2.657 2.108 3.265 . 0 0 "[ . 1 . 2]" 1
1213 1 86 GLU HA 1 89 MET HG3 3.415 . 5.030 2.844 2.414 3.335 . 0 0 "[ . 1 . 2]" 1
1214 1 86 GLU HA 1 90 THR H 3.560 . 5.320 4.097 3.753 4.567 . 0 0 "[ . 1 . 2]" 1
1215 1 86 GLU HA 2 9 TYR QE 3.715 . 5.630 3.640 2.359 4.784 . 0 0 "[ . 1 . 2]" 1
1216 1 86 GLU HB2 1 87 GLU H 2.970 . 4.140 3.895 3.023 4.071 . 0 0 "[ . 1 . 2]" 1
1217 1 86 GLU HB3 1 87 GLU H 2.970 . 4.140 3.056 2.511 4.160 0.020 11 0 "[ . 1 . 2]" 1
1218 1 86 GLU HG2 2 9 TYR QE 3.580 . 5.360 4.334 2.573 5.467 0.107 8 0 "[ . 1 . 2]" 1
1219 1 86 GLU HG3 2 9 TYR QE 3.635 . 5.470 3.669 1.938 5.488 0.018 15 0 "[ . 1 . 2]" 1
1220 1 87 GLU H 1 87 GLU QB 2.435 . 3.070 2.392 2.229 2.596 . 0 0 "[ . 1 . 2]" 1
1221 1 87 GLU H 1 87 GLU HG2 3.175 . 4.550 3.011 2.015 4.078 . 0 0 "[ . 1 . 2]" 1
1222 1 87 GLU H 1 87 GLU QG 2.885 . 3.970 2.501 2.005 3.557 . 0 0 "[ . 1 . 2]" 1
1223 1 87 GLU H 1 87 GLU HG3 3.175 . 4.550 3.288 2.254 3.954 . 0 0 "[ . 1 . 2]" 1
1224 1 87 GLU H 1 88 MET H 2.590 . 3.380 2.570 2.397 2.730 . 0 0 "[ . 1 . 2]" 1
1225 1 87 GLU H 1 88 MET HA 3.650 . 5.500 5.205 5.064 5.334 . 0 0 "[ . 1 . 2]" 1
1226 1 87 GLU H 1 88 MET ME 3.120 . 4.440 4.259 3.652 4.531 0.091 14 0 "[ . 1 . 2]" 1
1227 1 87 GLU H 1 89 MET H 3.255 . 4.710 4.033 3.861 4.238 . 0 0 "[ . 1 . 2]" 1
1228 1 87 GLU HA 1 87 GLU HG2 2.805 . 3.810 3.046 2.445 3.641 . 0 0 "[ . 1 . 2]" 1
1229 1 87 GLU HA 1 87 GLU QG 2.555 . 3.310 2.671 2.320 3.133 . 0 0 "[ . 1 . 2]" 1
1230 1 87 GLU HA 1 87 GLU HG3 2.805 . 3.810 3.225 2.349 3.820 0.010 5 0 "[ . 1 . 2]" 1
1231 1 87 GLU HA 1 90 THR H 3.130 . 4.460 3.632 3.233 3.943 . 0 0 "[ . 1 . 2]" 1
1232 1 87 GLU HA 1 90 THR HB 2.885 . 3.970 3.171 2.374 3.767 . 0 0 "[ . 1 . 2]" 1
1233 1 87 GLU QB 1 88 MET H 2.560 . 3.320 2.576 2.313 2.732 . 0 0 "[ . 1 . 2]" 1
1234 1 87 GLU HB2 1 88 MET H 2.870 . 3.940 2.644 2.351 2.845 . 0 0 "[ . 1 . 2]" 1
1235 1 87 GLU HB3 1 88 MET H 2.870 . 3.940 3.597 3.194 3.825 . 0 0 "[ . 1 . 2]" 1
1236 1 88 MET H 1 88 MET HB2 2.805 . 3.810 2.632 2.273 3.586 . 0 0 "[ . 1 . 2]" 1
1237 1 88 MET H 1 88 MET HB3 2.805 . 3.810 3.556 2.806 3.629 . 0 0 "[ . 1 . 2]" 1
1238 1 88 MET H 1 88 MET ME 2.775 . 3.750 3.134 2.215 3.605 . 0 0 "[ . 1 . 2]" 1
1239 1 88 MET H 1 88 MET QG 2.690 . 3.580 2.304 1.750 3.473 0.050 19 0 "[ . 1 . 2]" 1
1240 1 88 MET H 1 89 MET H 2.570 . 3.340 2.613 2.529 2.727 . 0 0 "[ . 1 . 2]" 1
1241 1 88 MET HA 1 88 MET ME 3.145 . 4.490 3.533 2.307 4.097 . 0 0 "[ . 1 . 2]" 1
1242 1 88 MET HA 1 91 ALA H 2.900 . 4.000 3.401 2.982 3.835 . 0 0 "[ . 1 . 2]" 1
1243 1 88 MET HA 1 91 ALA MB 2.715 . 3.630 2.397 1.863 3.081 . 0 0 "[ . 1 . 2]" 1
1244 1 88 MET HA 1 92 CYS H 3.500 . 5.200 4.104 3.339 4.837 . 0 0 "[ . 1 . 2]" 1
1245 1 88 MET QB 1 89 MET H 2.820 . 3.840 2.533 2.240 3.474 . 0 0 "[ . 1 . 2]" 1
1246 1 88 MET ME 1 88 MET QG 2.610 . 3.420 2.202 2.150 2.491 . 0 0 "[ . 1 . 2]" 1
1247 1 88 MET ME 1 91 ALA MB 3.075 . 4.350 4.453 3.990 4.590 0.240 3 0 "[ . 1 . 2]" 1
1248 1 88 MET QG 1 89 MET H 3.395 . 4.990 3.883 2.389 4.520 . 0 0 "[ . 1 . 2]" 1
1249 1 89 MET H 1 89 MET HB2 2.445 . 3.090 2.608 2.521 2.760 . 0 0 "[ . 1 . 2]" 1
1250 1 89 MET H 1 89 MET HB3 2.705 . 3.610 3.589 3.579 3.611 0.001 19 0 "[ . 1 . 2]" 1
1251 1 89 MET H 1 89 MET ME 3.345 . 4.890 4.602 4.255 4.759 . 0 0 "[ . 1 . 2]" 1
1252 1 89 MET H 1 89 MET HG2 2.745 . 3.690 2.664 1.872 3.409 . 0 0 "[ . 1 . 2]" 1
1253 1 89 MET H 1 89 MET QG 2.495 . 3.190 1.996 1.864 2.203 . 0 0 "[ . 1 . 2]" 1
1254 1 89 MET H 1 89 MET HG3 2.745 . 3.690 2.703 1.973 3.568 . 0 0 "[ . 1 . 2]" 1
1255 1 89 MET H 1 90 THR H 2.575 . 3.350 2.718 2.586 2.895 . 0 0 "[ . 1 . 2]" 1
1256 1 89 MET H 1 91 ALA H 3.165 . 4.530 3.927 3.796 4.149 . 0 0 "[ . 1 . 2]" 1
1257 1 89 MET HA 1 89 MET ME 3.030 . 4.260 3.627 2.817 4.297 0.037 10 0 "[ . 1 . 2]" 1
1258 1 89 MET HA 1 89 MET QG 2.735 . 3.670 2.724 2.430 3.148 . 0 0 "[ . 1 . 2]" 1
1259 1 89 MET HB2 1 89 MET ME 2.910 . 4.020 3.422 3.045 4.052 0.032 16 0 "[ . 1 . 2]" 1
1260 1 89 MET HB2 1 90 THR H 2.610 . 3.420 2.485 2.264 2.665 . 0 0 "[ . 1 . 2]" 1
1261 1 89 MET HB2 1 91 ALA H 3.515 . 5.230 4.782 4.574 5.032 . 0 0 "[ . 1 . 2]" 1
1262 1 89 MET HB3 1 89 MET ME 2.510 . 3.220 2.309 2.073 3.375 0.155 18 0 "[ . 1 . 2]" 1
1263 1 89 MET HB3 1 90 THR H 2.755 . 3.710 3.648 3.473 3.767 0.057 7 0 "[ . 1 . 2]" 1
1264 1 89 MET ME 1 89 MET HG2 2.725 . 3.650 2.810 2.202 3.393 . 0 0 "[ . 1 . 2]" 1
1265 1 89 MET ME 1 89 MET HG3 2.725 . 3.650 2.900 2.197 3.394 . 0 0 "[ . 1 . 2]" 1
1266 1 89 MET ME 2 9 TYR QE 3.955 . 6.110 2.887 2.109 3.658 . 0 0 "[ . 1 . 2]" 1
1267 1 90 THR H 1 90 THR HB 2.370 . 2.940 2.578 2.476 2.659 . 0 0 "[ . 1 . 2]" 1
1268 1 90 THR H 1 90 THR MG 2.820 . 3.840 3.763 3.742 3.777 . 0 0 "[ . 1 . 2]" 1
1269 1 90 THR H 1 91 ALA H 2.510 . 3.220 2.494 2.358 2.669 . 0 0 "[ . 1 . 2]" 1
1270 1 90 THR H 1 91 ALA MB 3.085 . 4.370 4.183 4.048 4.352 . 0 0 "[ . 1 . 2]" 1
1271 1 90 THR HA 1 90 THR MG 2.525 . 3.250 2.353 2.313 2.426 . 0 0 "[ . 1 . 2]" 1
1272 1 90 THR HA 1 92 CYS H 3.390 . 4.980 4.335 3.930 4.615 . 0 0 "[ . 1 . 2]" 1
1273 1 90 THR HA 1 93 GLN H 2.760 . 3.720 3.424 3.099 3.746 0.026 8 0 "[ . 1 . 2]" 1
1274 1 90 THR HA 1 93 GLN HA 3.525 . 5.250 4.999 4.128 5.327 0.077 4 0 "[ . 1 . 2]" 1
1275 1 90 THR HA 1 93 GLN HB2 2.915 . 4.030 3.338 2.049 4.215 0.185 6 0 "[ . 1 . 2]" 1
1276 1 90 THR HA 1 93 GLN QB 2.655 . 3.510 2.622 2.037 3.031 . 0 0 "[ . 1 . 2]" 1
1277 1 90 THR HA 1 93 GLN HB3 2.915 . 4.030 3.381 2.273 4.120 0.090 1 0 "[ . 1 . 2]" 1
1278 1 90 THR HA 1 93 GLN QG 3.460 . 5.120 2.842 1.675 4.539 0.125 6 0 "[ . 1 . 2]" 1
1279 1 90 THR HB 1 91 ALA H 2.550 . 3.300 2.848 2.684 2.974 . 0 0 "[ . 1 . 2]" 1
1280 1 90 THR MG 1 91 ALA H 2.830 . 3.860 3.769 3.528 3.881 0.021 11 0 "[ . 1 . 2]" 1
1281 1 90 THR MG 1 91 ALA HA 2.850 . 3.900 3.803 3.431 3.930 0.030 6 0 "[ . 1 . 2]" 1
1282 1 90 THR MG 1 93 GLN H 3.305 . 4.810 4.405 4.039 4.725 . 0 0 "[ . 1 . 2]" 1
1283 1 91 ALA H 1 91 ALA MB 2.210 . 2.620 2.234 2.209 2.262 . 0 0 "[ . 1 . 2]" 1
1284 1 91 ALA H 1 92 CYS H 2.485 . 3.170 2.676 2.492 2.801 . 0 0 "[ . 1 . 2]" 1
1285 1 91 ALA H 1 93 GLN H 3.025 . 4.250 3.938 3.829 4.155 . 0 0 "[ . 1 . 2]" 1
1286 1 91 ALA H 1 93 GLN QB 3.570 . 5.340 4.897 4.579 5.356 0.016 6 0 "[ . 1 . 2]" 1
1287 1 91 ALA HA 1 92 CYS HA 3.650 . 5.500 4.662 4.537 4.775 . 0 0 "[ . 1 . 2]" 1
1288 1 91 ALA MB 1 92 CYS H 2.515 . 3.230 2.531 2.354 2.887 . 0 0 "[ . 1 . 2]" 1
1289 1 91 ALA MB 1 93 GLN H 3.130 . 4.460 4.275 4.133 4.448 . 0 0 "[ . 1 . 2]" 1
1290 1 92 CYS H 1 92 CYS HB2 2.805 . 3.810 2.653 2.497 2.959 . 0 0 "[ . 1 . 2]" 1
1291 1 92 CYS H 1 92 CYS QB 2.465 . 3.130 2.348 2.234 2.526 . 0 0 "[ . 1 . 2]" 1
1292 1 92 CYS H 1 92 CYS HB3 2.805 . 3.810 2.751 2.418 3.712 . 0 0 "[ . 1 . 2]" 1
1293 1 92 CYS HA 1 93 GLN H 2.680 . 3.560 3.286 2.980 3.523 . 0 0 "[ . 1 . 2]" 1
1294 1 92 CYS QB 1 93 GLN H 2.915 . 4.030 3.290 2.610 3.743 . 0 0 "[ . 1 . 2]" 1
1295 1 92 CYS HB2 1 93 GLN H 3.330 . 4.860 4.130 2.889 4.549 . 0 0 "[ . 1 . 2]" 1
1296 1 92 CYS HB3 1 93 GLN H 3.330 . 4.860 3.589 2.649 4.466 . 0 0 "[ . 1 . 2]" 1
1297 1 93 GLN H 1 93 GLN HB2 2.700 . 3.600 3.029 2.320 3.740 0.140 7 0 "[ . 1 . 2]" 1
1298 1 93 GLN H 1 93 GLN QB 2.275 . 2.750 2.425 2.292 2.702 . 0 0 "[ . 1 . 2]" 1
1299 1 93 GLN H 1 93 GLN HB3 2.700 . 3.600 3.050 2.356 3.642 0.042 5 0 "[ . 1 . 2]" 1
1300 1 93 GLN H 1 93 GLN HG2 2.745 . 3.690 2.787 2.210 3.765 0.075 1 0 "[ . 1 . 2]" 1
1301 1 93 GLN H 1 93 GLN QG 2.515 . 3.230 2.409 2.187 2.618 . 0 0 "[ . 1 . 2]" 1
1302 1 93 GLN H 1 93 GLN HG3 2.745 . 3.690 3.290 2.355 3.762 0.072 19 0 "[ . 1 . 2]" 1
1303 1 93 GLN H 1 94 GLY H 2.880 . 3.960 2.657 1.962 4.065 0.105 19 0 "[ . 1 . 2]" 1
1304 1 93 GLN HA 1 93 GLN HG2 2.875 . 3.950 3.277 2.401 3.864 . 0 0 "[ . 1 . 2]" 1
1305 1 93 GLN HA 1 93 GLN QG 2.570 . 3.340 2.972 2.302 3.348 0.008 11 0 "[ . 1 . 2]" 1
1306 1 93 GLN HA 1 93 GLN HG3 2.875 . 3.950 3.491 2.912 3.823 . 0 0 "[ . 1 . 2]" 1
1307 1 93 GLN QE 1 93 GLN QG 2.505 . 3.210 2.335 2.115 2.697 . 0 0 "[ . 1 . 2]" 1
1308 1 94 GLY H 1 95 VAL H 2.790 . 3.780 2.972 2.193 3.895 0.115 1 0 "[ . 1 . 2]" 1
1309 1 95 VAL H 1 95 VAL HB 2.285 . 2.770 2.676 2.331 2.915 0.145 1 0 "[ . 1 . 2]" 1
1310 1 95 VAL H 1 95 VAL QG 2.235 . 2.670 2.107 1.770 2.665 0.030 7 0 "[ . 1 . 2]" 1
1311 1 95 VAL HA 1 95 VAL QG 2.545 . 3.290 2.215 2.076 2.314 . 0 0 "[ . 1 . 2]" 1
1312 1 95 VAL HA 1 96 GLY H 2.670 . 3.540 2.726 2.087 3.550 0.010 20 0 "[ . 1 . 2]" 1
1313 1 95 VAL HA 1 97 GLY H 3.130 . 4.460 4.078 3.059 4.550 0.090 15 0 "[ . 1 . 2]" 1
1314 1 95 VAL QG 1 96 GLY H 2.795 . 3.790 2.558 1.974 3.069 . 0 0 "[ . 1 . 2]" 1
1315 1 95 VAL QG 1 96 GLY QA 3.150 . 4.500 3.335 2.741 3.952 . 0 0 "[ . 1 . 2]" 1
1316 1 95 VAL QG 1 97 GLY H 3.160 . 4.520 2.359 1.590 3.753 0.210 14 0 "[ . 1 . 2]" 1
1317 1 95 VAL QG 1 97 GLY QA 3.220 . 4.640 3.446 2.602 4.538 . 0 0 "[ . 1 . 2]" 1
1318 1 96 GLY H 1 97 GLY H 2.870 . 3.940 2.621 1.812 3.314 . 0 0 "[ . 1 . 2]" 1
1319 1 97 GLY H 1 98 PRO HD2 3.195 . 4.590 4.007 2.418 4.681 0.091 6 0 "[ . 1 . 2]" 1
1320 1 97 GLY H 1 98 PRO QD 2.900 . 4.000 3.052 2.051 3.911 . 0 0 "[ . 1 . 2]" 1
1321 1 97 GLY H 1 98 PRO HD3 3.195 . 4.590 3.279 2.070 4.218 . 0 0 "[ . 1 . 2]" 1
1322 1 97 GLY QA 1 98 PRO QD 2.370 . 2.940 1.999 1.779 2.465 0.021 9 0 "[ . 1 . 2]" 1
1323 2 1 ILE H1 2 1 ILE HB 2.805 . 3.810 3.581 2.468 4.194 0.384 15 0 "[ . 1 . 2]" 1
1324 2 1 ILE H1 2 1 ILE MD 2.995 . 4.190 3.463 1.709 5.201 1.011 3 4 "[ + * 1* - 2]" 1
1325 2 1 ILE H1 2 1 ILE QG 2.655 . 3.510 3.367 1.843 4.254 0.744 5 6 "[ * + * 1*- . *2]" 1
1326 2 1 ILE H1 2 1 ILE MG 2.985 . 4.170 3.039 1.790 4.096 0.010 17 0 "[ . 1 . 2]" 1
1327 2 1 ILE H1 2 5 ASP H 3.650 . 5.500 5.419 4.100 7.066 1.566 11 6 "[ **-* 1+ * 2]" 1
1328 2 1 ILE H1 2 5 ASP QB 3.065 . 4.330 3.496 1.799 5.444 1.114 11 4 "[ *- * 1+ . 2]" 1
1329 2 1 ILE HA 2 1 ILE MD 3.040 . 4.280 3.374 2.042 4.190 . 0 0 "[ . 1 . 2]" 1
1330 2 1 ILE HA 2 1 ILE QG 2.965 . 4.130 3.089 2.391 3.504 . 0 0 "[ . 1 . 2]" 1
1331 2 1 ILE HA 2 1 ILE MG 2.670 . 3.540 2.574 2.293 3.208 . 0 0 "[ . 1 . 2]" 1
1332 2 1 ILE HB 2 1 ILE MD 2.700 . 3.600 2.956 2.227 3.252 . 0 0 "[ . 1 . 2]" 1
1333 2 1 ILE MD 2 1 ILE MG 2.365 . 2.930 1.925 1.838 2.243 . 0 0 "[ . 1 . 2]" 1
1334 2 1 ILE MD 2 5 ASP HA 3.545 . 5.290 4.991 4.315 5.464 0.174 14 0 "[ . 1 . 2]" 1
1335 2 1 ILE MD 2 5 ASP QB 2.935 . 4.070 2.873 2.116 3.521 . 0 0 "[ . 1 . 2]" 1
1336 2 1 ILE QG 2 2 THR H 3.225 . 4.650 2.868 1.662 4.685 0.138 20 0 "[ . 1 . 2]" 1
1337 2 1 ILE MG 2 5 ASP QB 3.155 . 4.000 3.252 1.764 4.075 0.075 10 0 "[ . 1 . 2]" 1
1338 2 2 THR H 2 2 THR MG 3.395 . 4.990 2.190 1.769 2.869 0.031 5 0 "[ . 1 . 2]" 1
1339 2 2 THR HB 2 3 PHE H 3.190 . 4.580 2.978 2.641 3.560 . 0 0 "[ . 1 . 2]" 1
1340 2 2 THR MG 2 5 ASP H 3.250 . 4.700 3.250 2.360 3.692 . 0 0 "[ . 1 . 2]" 1
1341 2 3 PHE H 2 3 PHE QD 3.035 . 4.270 4.149 4.085 4.207 . 0 0 "[ . 1 . 2]" 1
1342 2 3 PHE HA 2 3 PHE QD 2.455 . 3.110 2.109 1.835 2.278 . 0 0 "[ . 1 . 2]" 1
1343 2 3 PHE HA 2 6 LEU H 2.970 . 4.140 3.259 2.985 3.639 . 0 0 "[ . 1 . 2]" 1
1344 2 3 PHE HA 2 6 LEU QB 3.570 . 5.340 2.406 1.882 4.691 . 0 0 "[ . 1 . 2]" 1
1345 2 3 PHE HA 2 6 LEU QD 3.055 . 4.310 3.004 1.707 3.282 0.093 13 0 "[ . 1 . 2]" 1
1346 2 3 PHE HA 2 6 LEU HG 2.720 . 3.640 3.800 3.683 3.952 0.312 13 0 "[ . 1 . 2]" 1
1347 2 3 PHE HA 2 7 LEU HG 3.650 . 5.500 4.551 3.994 5.375 . 0 0 "[ . 1 . 2]" 1
1348 2 3 PHE QD 2 6 LEU QD 3.150 . 4.500 3.502 1.730 3.928 0.070 20 0 "[ . 1 . 2]" 1
1349 2 3 PHE QD 2 6 LEU HG 2.660 . 3.520 3.373 3.056 3.579 0.059 20 0 "[ . 1 . 2]" 1
1350 2 3 PHE QD 2 7 LEU MD1 2.680 . 3.560 3.202 2.723 4.398 0.838 19 1 "[ . 1 . +2]" 1
1351 2 3 PHE QD 2 7 LEU HG 2.795 . 3.790 3.620 3.136 3.874 0.084 3 0 "[ . 1 . 2]" 1
1352 2 3 PHE QE 2 7 LEU HA 3.545 . 5.290 5.071 4.461 5.382 0.092 14 0 "[ . 1 . 2]" 1
1353 2 3 PHE QE 2 7 LEU MD1 2.745 . 3.690 2.657 2.124 3.232 . 0 0 "[ . 1 . 2]" 1
1354 2 3 PHE QE 2 7 LEU MD2 2.705 . 3.610 3.016 2.514 3.342 . 0 0 "[ . 1 . 2]" 1
1355 2 3 PHE QE 2 7 LEU HG 2.870 . 3.940 3.453 3.107 3.667 . 0 0 "[ . 1 . 2]" 1
1356 2 3 PHE HZ 2 7 LEU MD1 2.735 . 3.670 3.572 3.130 3.746 0.076 14 0 "[ . 1 . 2]" 1
1357 2 3 PHE HZ 2 7 LEU MD2 2.775 . 3.750 2.677 2.448 2.980 . 0 0 "[ . 1 . 2]" 1
1358 2 3 PHE HZ 2 7 LEU HG 3.020 . 4.240 3.899 3.502 4.285 0.045 19 0 "[ . 1 . 2]" 1
1359 2 5 ASP H 2 5 ASP QB 2.910 . 3.520 2.288 2.108 2.635 . 0 0 "[ . 1 . 2]" 1
1360 2 5 ASP H 2 6 LEU H 2.820 . 3.840 2.673 2.525 2.974 . 0 0 "[ . 1 . 2]" 1
1361 2 5 ASP QB 2 6 LEU H 3.090 . 4.380 2.600 2.411 2.748 . 0 0 "[ . 1 . 2]" 1
1362 2 6 LEU H 2 6 LEU HB2 2.765 . 3.730 2.220 2.037 3.707 . 0 0 "[ . 1 . 2]" 1
1363 2 6 LEU H 2 6 LEU QB 2.525 . 3.250 2.109 2.018 2.778 . 0 0 "[ . 1 . 2]" 1
1364 2 6 LEU H 2 6 LEU HB3 2.765 . 3.730 3.247 2.852 3.385 . 0 0 "[ . 1 . 2]" 1
1365 2 6 LEU H 2 6 LEU QD 3.080 . 4.360 2.724 1.677 2.985 0.123 13 0 "[ . 1 . 2]" 1
1366 2 6 LEU H 2 6 LEU HG 3.150 . 4.500 4.300 3.790 4.466 . 0 0 "[ . 1 . 2]" 1
1367 2 6 LEU H 2 7 LEU H 2.700 . 3.600 2.736 2.627 2.869 . 0 0 "[ . 1 . 2]" 1
1368 2 6 LEU HA 2 6 LEU QD 2.915 . 4.030 1.903 1.735 3.144 0.065 10 0 "[ . 1 . 2]" 1
1369 2 6 LEU HA 2 6 LEU HG 2.875 . 3.950 3.668 3.579 4.241 0.291 13 0 "[ . 1 . 2]" 1
1370 2 6 LEU HA 2 9 TYR H 2.935 . 4.070 3.651 3.089 3.890 . 0 0 "[ . 1 . 2]" 1
1371 2 6 LEU HA 2 9 TYR HB2 3.005 . 4.210 3.518 2.806 3.997 . 0 0 "[ . 1 . 2]" 1
1372 2 6 LEU HA 2 9 TYR QB 2.735 . 3.670 2.660 1.819 2.961 . 0 0 "[ . 1 . 2]" 1
1373 2 6 LEU HA 2 9 TYR HB3 3.005 . 4.210 2.759 1.843 3.052 . 0 0 "[ . 1 . 2]" 1
1374 2 6 LEU HA 2 9 TYR QD 3.010 . 4.220 4.012 3.024 4.272 0.052 10 0 "[ . 1 . 2]" 1
1375 2 6 LEU HA 2 10 TYR QD 2.930 . 4.060 3.686 3.278 3.898 . 0 0 "[ . 1 . 2]" 1
1376 2 6 LEU HA 2 10 TYR QE 3.210 . 4.620 4.185 3.926 4.402 . 0 0 "[ . 1 . 2]" 1
1377 2 6 LEU QB 2 6 LEU QD 2.435 . 3.070 2.030 2.009 2.044 . 0 0 "[ . 1 . 2]" 1
1378 2 6 LEU QB 2 10 TYR QD 2.935 . 4.070 3.743 2.526 3.989 . 0 0 "[ . 1 . 2]" 1
1379 2 6 LEU QB 2 10 TYR QE 3.125 . 4.450 4.198 2.196 4.517 0.067 3 0 "[ . 1 . 2]" 1
1380 2 6 LEU QD 2 7 LEU H 3.265 . 4.730 3.674 1.778 3.897 0.022 13 0 "[ . 1 . 2]" 1
1381 2 6 LEU QD 2 7 LEU HA 3.090 . 4.380 4.222 2.842 4.480 0.100 11 0 "[ . 1 . 2]" 1
1382 2 6 LEU QD 2 9 TYR QD 3.135 . 4.470 3.371 2.966 4.414 . 0 0 "[ . 1 . 2]" 1
1383 2 6 LEU QD 2 10 TYR QD 2.935 . 4.070 2.504 2.174 2.985 . 0 0 "[ . 1 . 2]" 1
1384 2 6 LEU QD 2 10 TYR QE 2.655 . 3.510 2.076 1.813 3.487 . 0 0 "[ . 1 . 2]" 1
1385 2 6 LEU HG 2 7 LEU H 3.350 . 4.900 4.884 4.423 4.975 0.075 3 0 "[ . 1 . 2]" 1
1386 2 6 LEU HG 2 10 TYR QD 3.360 . 4.920 4.894 4.531 5.010 0.090 14 0 "[ . 1 . 2]" 1
1387 2 6 LEU HG 2 10 TYR QE 3.315 . 4.830 4.251 3.787 4.510 . 0 0 "[ . 1 . 2]" 1
1388 2 7 LEU H 2 7 LEU QB 2.580 . 3.360 2.322 2.223 2.394 . 0 0 "[ . 1 . 2]" 1
1389 2 7 LEU H 2 7 LEU MD1 2.870 . 3.940 3.661 3.500 4.055 0.115 19 0 "[ . 1 . 2]" 1
1390 2 7 LEU H 2 7 LEU MD2 3.035 . 4.270 3.506 1.995 3.768 . 0 0 "[ . 1 . 2]" 1
1391 2 7 LEU H 2 7 LEU HG 2.470 . 3.140 2.577 2.321 3.361 0.221 19 0 "[ . 1 . 2]" 1
1392 2 7 LEU HA 2 7 LEU MD1 2.850 . 3.900 3.778 2.635 3.860 . 0 0 "[ . 1 . 2]" 1
1393 2 7 LEU HA 2 7 LEU MD2 2.575 . 3.350 1.935 1.835 2.032 . 0 0 "[ . 1 . 2]" 1
1394 2 7 LEU HA 2 7 LEU HG 2.815 . 3.830 2.967 2.801 3.701 . 0 0 "[ . 1 . 2]" 1
1395 2 7 LEU HA 2 10 TYR H 3.090 . 4.380 3.743 3.461 3.991 . 0 0 "[ . 1 . 2]" 1
1396 2 7 LEU HA 2 11 GLY H 3.075 . 4.350 3.827 3.516 4.068 . 0 0 "[ . 1 . 2]" 1
1397 2 7 LEU QB 2 7 LEU MD1 2.415 . 3.030 2.101 2.089 2.132 . 0 0 "[ . 1 . 2]" 1
1398 2 7 LEU QB 2 7 LEU MD2 2.345 . 2.890 2.328 2.249 2.574 . 0 0 "[ . 1 . 2]" 1
1399 2 7 LEU HB2 2 7 LEU MD2 2.620 . 3.440 3.178 2.746 3.214 . 0 0 "[ . 1 . 2]" 1
1400 2 7 LEU HB3 2 7 LEU MD2 2.620 . 3.440 2.413 2.300 3.110 . 0 0 "[ . 1 . 2]" 1
1401 2 9 TYR H 2 9 TYR HB2 2.795 . 3.790 2.664 2.574 2.786 . 0 0 "[ . 1 . 2]" 1
1402 2 9 TYR H 2 9 TYR QB 2.530 . 3.260 2.246 2.180 2.296 . 0 0 "[ . 1 . 2]" 1
1403 2 9 TYR H 2 9 TYR HB3 2.795 . 3.790 2.425 2.282 2.494 . 0 0 "[ . 1 . 2]" 1
1404 2 9 TYR H 2 9 TYR QD 3.000 . 4.200 4.186 4.106 4.215 0.015 18 0 "[ . 1 . 2]" 1
1405 2 9 TYR H 2 10 TYR H 2.845 . 3.890 2.731 2.665 2.837 . 0 0 "[ . 1 . 2]" 1
1406 2 9 TYR HA 2 9 TYR QD 2.595 . 3.390 2.676 2.505 2.872 . 0 0 "[ . 1 . 2]" 1
1407 2 9 TYR HA 2 9 TYR QE 3.515 . 5.230 4.655 4.514 4.772 . 0 0 "[ . 1 . 2]" 1
1408 2 9 TYR QB 2 10 TYR QD 2.970 . 4.140 3.203 2.706 3.343 . 0 0 "[ . 1 . 2]" 1
1409 2 9 TYR HB2 2 10 TYR H 2.955 . 4.110 3.787 3.664 3.923 . 0 0 "[ . 1 . 2]" 1
1410 2 9 TYR HB2 2 10 TYR QD 3.400 . 5.000 4.936 4.458 5.059 0.059 13 0 "[ . 1 . 2]" 1
1411 2 9 TYR HB3 2 10 TYR H 2.955 . 4.110 2.365 2.215 2.554 . 0 0 "[ . 1 . 2]" 1
1412 2 9 TYR HB3 2 10 TYR QD 3.400 . 5.000 3.245 2.730 3.391 . 0 0 "[ . 1 . 2]" 1
1413 2 9 TYR QD 2 10 TYR H 2.920 . 4.040 3.116 2.980 3.227 . 0 0 "[ . 1 . 2]" 1
1414 2 9 TYR QD 2 10 TYR HA 2.820 . 3.840 3.577 3.346 3.780 . 0 0 "[ . 1 . 2]" 1
1415 2 9 TYR QD 2 10 TYR QD 2.770 . 3.740 2.839 2.406 3.131 . 0 0 "[ . 1 . 2]" 1
1416 2 9 TYR QD 2 10 TYR QE 2.860 . 3.920 3.086 2.804 3.367 . 0 0 "[ . 1 . 2]" 1
1417 2 9 TYR QE 2 10 TYR HA 3.635 . 5.470 4.515 4.326 4.713 . 0 0 "[ . 1 . 2]" 1
1418 2 9 TYR QE 2 10 TYR QD 3.020 . 4.240 4.216 3.849 4.328 0.088 16 0 "[ . 1 . 2]" 1
1419 2 9 TYR QE 2 10 TYR QE 2.890 . 3.980 3.567 3.093 3.772 . 0 0 "[ . 1 . 2]" 1
1420 2 10 TYR H 2 10 TYR HB2 2.835 . 3.870 2.309 2.240 2.361 . 0 0 "[ . 1 . 2]" 1
1421 2 10 TYR H 2 10 TYR HB3 2.835 . 3.870 3.566 3.533 3.587 . 0 0 "[ . 1 . 2]" 1
1422 2 10 TYR H 2 10 TYR QD 2.665 . 3.530 2.616 2.384 2.763 . 0 0 "[ . 1 . 2]" 1
1423 2 10 TYR H 2 10 TYR QE 3.280 . 4.760 4.635 4.508 4.765 0.005 8 0 "[ . 1 . 2]" 1
1424 2 10 TYR H 2 11 GLY H 2.715 . 3.630 2.586 2.513 2.697 . 0 0 "[ . 1 . 2]" 1
1425 2 10 TYR HA 2 10 TYR QD 2.465 . 3.130 2.790 2.621 3.061 . 0 0 "[ . 1 . 2]" 1
1426 2 10 TYR HA 2 10 TYR QE 3.295 . 4.790 4.488 4.433 4.576 . 0 0 "[ . 1 . 2]" 1
1427 2 10 TYR HB2 2 11 GLY H 3.095 . 4.390 2.774 2.430 2.946 . 0 0 "[ . 1 . 2]" 1
1428 2 10 TYR HB3 2 11 GLY H 3.095 . 4.390 3.508 3.299 3.703 . 0 0 "[ . 1 . 2]" 1
1429 2 10 TYR QD 2 11 GLY H 3.140 . 4.480 4.400 4.177 4.523 0.043 8 0 "[ . 1 . 2]" 1
1430 2 11 GLY H 2 12 LYS H 2.740 . 3.680 3.229 2.456 3.813 0.133 10 0 "[ . 1 . 2]" 1
1431 2 12 LYS H 2 12 LYS HB2 2.805 . 3.810 2.895 2.099 3.875 0.065 14 0 "[ . 1 . 2]" 1
1432 2 12 LYS H 2 12 LYS QB 2.440 . 3.080 2.635 2.060 3.209 0.129 14 0 "[ . 1 . 2]" 1
1433 2 12 LYS H 2 12 LYS HB3 2.805 . 3.810 3.494 2.712 3.977 0.167 9 0 "[ . 1 . 2]" 1
1434 2 12 LYS H 2 12 LYS QG 2.690 . 3.580 2.648 1.745 3.714 0.134 5 0 "[ . 1 . 2]" 1
1435 2 12 LYS H 2 13 LYS H 2.960 . 4.120 3.460 2.382 4.362 0.242 17 0 "[ . 1 . 2]" 1
1436 2 12 LYS HA 2 13 LYS H 2.585 . 3.370 2.601 2.055 3.516 0.146 8 0 "[ . 1 . 2]" 1
1437 2 12 LYS QE 2 12 LYS QG 2.500 . 3.200 2.403 2.126 2.802 . 0 0 "[ . 1 . 2]" 1
1438 2 13 LYS H 2 13 LYS HB2 2.860 . 3.920 3.293 2.301 3.958 0.038 2 0 "[ . 1 . 2]" 1
1439 2 13 LYS H 2 13 LYS QB 2.545 . 3.290 2.673 2.222 3.366 0.076 14 0 "[ . 1 . 2]" 1
1440 2 13 LYS H 2 13 LYS HB3 2.860 . 3.920 3.046 2.371 4.081 0.161 14 0 "[ . 1 . 2]" 1
1441 2 13 LYS H 2 13 LYS QG 2.835 . 3.870 2.886 1.784 4.009 0.139 9 0 "[ . 1 . 2]" 1
1442 2 13 LYS HA 2 14 LYS H 2.675 . 3.550 2.732 2.103 3.560 0.010 6 0 "[ . 1 . 2]" 1
1443 2 14 LYS H 2 14 LYS QB 2.595 . 3.390 2.766 2.300 3.199 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Thursday, May 23, 2024 7:30:45 PM GMT (wattos1)