NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
392830 |
1q60   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1q60
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 1700
_Distance_constraint_stats_list.Viol_count 1571
_Distance_constraint_stats_list.Viol_total 2683.143
_Distance_constraint_stats_list.Viol_max 0.980
_Distance_constraint_stats_list.Viol_rms 0.0352
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0039
_Distance_constraint_stats_list.Viol_average_violations_only 0.0854
_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 5 SER 5.194 0.768 7 4 "[- * + 1 * . 2]"
1 6 SER 0.015 0.006 4 0 "[ . 1 . 2]"
1 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 LEU 0.054 0.021 11 0 "[ . 1 . 2]"
1 9 LYS 0.726 0.198 4 0 "[ . 1 . 2]"
1 10 GLN 2.580 0.328 20 0 "[ . 1 . 2]"
1 11 LYS 0.022 0.010 11 0 "[ . 1 . 2]"
1 12 VAL 0.017 0.010 10 0 "[ . 1 . 2]"
1 13 GLU 4.642 0.441 4 0 "[ . 1 . 2]"
1 14 ASN 1.189 0.318 4 0 "[ . 1 . 2]"
1 15 LEU 0.640 0.071 20 0 "[ . 1 . 2]"
1 16 PHE 1.277 0.814 4 1 "[ +. 1 . 2]"
1 17 ASN 0.317 0.032 20 0 "[ . 1 . 2]"
1 18 GLU 0.207 0.156 13 0 "[ . 1 . 2]"
1 19 LYS 4.855 0.814 4 1 "[ +. 1 . 2]"
1 20 CYS 1.112 0.135 8 0 "[ . 1 . 2]"
1 21 GLY 2.125 0.190 20 0 "[ . 1 . 2]"
1 22 GLU 0.653 0.114 6 0 "[ . 1 . 2]"
1 23 ALA 0.933 0.132 18 0 "[ . 1 . 2]"
1 24 LEU 1.332 0.132 18 0 "[ . 1 . 2]"
1 25 GLY 0.226 0.030 14 0 "[ . 1 . 2]"
1 26 LEU 0.166 0.039 17 0 "[ . 1 . 2]"
1 27 LYS 3.458 0.531 3 1 "[ + . 1 . 2]"
1 28 GLN 3.274 0.531 3 1 "[ + . 1 . 2]"
1 29 ALA 0.426 0.062 7 0 "[ . 1 . 2]"
1 30 VAL 7.883 0.232 4 0 "[ . 1 . 2]"
1 31 LYS 15.815 0.577 10 8 "[ *** + * **- 2]"
1 32 VAL 0.668 0.167 11 0 "[ . 1 . 2]"
1 33 PRO 2.381 0.167 11 0 "[ . 1 . 2]"
1 34 PHE 2.266 0.141 9 0 "[ . 1 . 2]"
1 35 ALA 8.534 0.857 18 8 "[ *** *- 1* . + *]"
1 36 LEU 1.865 0.294 10 0 "[ . 1 . 2]"
1 37 PHE 0.504 0.057 16 0 "[ . 1 . 2]"
1 38 GLU 15.164 0.857 18 8 "[ *** *- 1* . + *]"
1 39 SER 2.836 0.361 13 0 "[ . 1 . 2]"
1 40 PHE 0.094 0.018 20 0 "[ . 1 . 2]"
1 41 PRO 0.054 0.033 13 0 "[ . 1 . 2]"
1 42 GLU 0.181 0.032 2 0 "[ . 1 . 2]"
1 43 ASP 0.650 0.092 19 0 "[ . 1 . 2]"
1 44 PHE 0.811 0.070 11 0 "[ . 1 . 2]"
1 45 TYR 2.347 0.847 18 1 "[ . 1 . + 2]"
1 46 VAL 1.244 0.341 5 0 "[ . 1 . 2]"
1 47 GLU 0.583 0.098 18 0 "[ . 1 . 2]"
1 48 GLY 0.815 0.098 18 0 "[ . 1 . 2]"
1 49 LEU 5.122 0.267 16 0 "[ . 1 . 2]"
1 50 PRO 5.622 0.484 3 0 "[ . 1 . 2]"
1 51 GLU 0.298 0.086 12 0 "[ . 1 . 2]"
1 52 GLY 0.185 0.064 12 0 "[ . 1 . 2]"
1 53 VAL 4.862 0.714 14 1 "[ . 1 +. 2]"
1 54 PRO 3.973 0.326 20 0 "[ . 1 . 2]"
1 55 PHE 1.070 0.341 5 0 "[ . 1 . 2]"
1 56 ARG 0.650 0.211 11 0 "[ . 1 . 2]"
1 57 ARG 7.345 0.633 19 3 "[ - 1 . * +2]"
1 58 PRO 7.450 0.603 2 1 "[ + . 1 . 2]"
1 59 SER 4.498 0.479 17 0 "[ . 1 . 2]"
1 60 THR 1.539 0.614 17 2 "[ - 1 . + 2]"
1 61 PHE 2.115 0.603 2 1 "[ + . 1 . 2]"
1 62 GLY 1.381 0.152 20 0 "[ . 1 . 2]"
1 63 ILE 7.684 0.768 7 4 "[- * + 1 * . 2]"
1 64 PRO 0.613 0.178 20 0 "[ . 1 . 2]"
1 65 ARG 3.644 0.714 14 1 "[ . 1 +. 2]"
1 66 LEU 0.999 0.130 14 0 "[ . 1 . 2]"
1 67 GLU 0.231 0.041 20 0 "[ . 1 . 2]"
1 68 LYS 7.658 0.429 9 0 "[ . 1 . 2]"
1 69 ILE 1.638 0.484 3 0 "[ . 1 . 2]"
1 70 LEU 2.080 0.717 14 1 "[ . 1 +. 2]"
1 71 ARG 1.844 0.717 14 1 "[ . 1 +. 2]"
1 72 ASN 0.470 0.141 14 0 "[ . 1 . 2]"
1 73 LYS 5.282 0.472 7 0 "[ . 1 . 2]"
1 74 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 LYS 2.512 0.715 1 3 "[+ . 1 .*- 2]"
1 76 ILE 2.597 0.715 1 3 "[+ . 1 .*- 2]"
1 77 LYS 0.190 0.034 18 0 "[ . 1 . 2]"
1 78 PHE 0.173 0.038 18 0 "[ . 1 . 2]"
1 79 ILE 2.589 0.181 14 0 "[ . 1 . 2]"
1 80 ILE 2.113 0.072 8 0 "[ . 1 . 2]"
1 81 LYS 6.164 0.847 18 1 "[ . 1 . + 2]"
1 82 LYS 0.352 0.140 5 0 "[ . 1 . 2]"
1 83 PRO 3.377 0.408 14 0 "[ . 1 . 2]"
1 84 GLU 6.276 0.931 12 1 "[ . 1 + . 2]"
1 85 MET 0.037 0.029 10 0 "[ . 1 . 2]"
1 86 PHE 0.148 0.028 11 0 "[ . 1 . 2]"
1 87 GLU 1.630 0.931 12 1 "[ . 1 + . 2]"
1 88 THR 0.903 0.850 8 1 "[ . + 1 . 2]"
1 89 ALA 1.035 0.980 8 1 "[ . + 1 . 2]"
1 90 ILE 0.406 0.384 18 0 "[ . 1 . 2]"
1 91 LYS 3.930 0.458 14 0 "[ . 1 . 2]"
1 92 GLU 3.537 0.980 8 1 "[ . + 1 . 2]"
1 93 SER 0.414 0.312 9 0 "[ . 1 . 2]"
1 94 SER 0.014 0.008 20 0 "[ . 1 . 2]"
1 95 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 5 SER H 1 63 ILE MD . . 4.110 3.546 2.800 4.082 . 0 0 "[ . 1 . 2]" 1
2 1 5 SER HA 1 8 LEU QD . . 4.650 4.245 3.329 4.587 . 0 0 "[ . 1 . 2]" 1
3 1 5 SER HA 1 63 ILE MD . . 3.900 3.571 3.133 3.922 0.022 4 0 "[ . 1 . 2]" 1
4 1 5 SER HA 1 63 ILE QG . . 4.730 2.618 1.960 4.164 . 0 0 "[ . 1 . 2]" 1
5 1 5 SER HA 1 63 ILE MG . . 4.740 3.703 2.638 4.514 . 0 0 "[ . 1 . 2]" 1
6 1 5 SER HB2 1 63 ILE MD . . 4.110 3.815 1.932 4.878 0.768 7 4 "[- * + 1 * . 2]" 1
7 1 5 SER HB2 1 63 ILE QG . . 4.310 2.530 1.791 3.350 . 0 0 "[ . 1 . 2]" 1
8 1 5 SER HB2 1 63 ILE MG . . 4.550 3.902 1.973 5.029 0.479 10 0 "[ . 1 . 2]" 1
9 1 5 SER HB2 1 66 LEU QD . . 4.450 3.196 1.927 4.580 0.130 14 0 "[ . 1 . 2]" 1
10 1 5 SER HB3 1 63 ILE QG . . 4.680 2.539 1.938 3.579 . 0 0 "[ . 1 . 2]" 1
11 1 5 SER HB3 1 63 ILE MG . . 5.020 4.055 2.632 4.996 . 0 0 "[ . 1 . 2]" 1
12 1 5 SER HB3 1 66 LEU QD . . 4.860 3.241 1.859 4.798 . 0 0 "[ . 1 . 2]" 1
13 1 6 SER HA 1 9 LYS HB2 . . 4.260 2.974 2.161 3.722 . 0 0 "[ . 1 . 2]" 1
14 1 6 SER HA 1 9 LYS HB3 . . 4.490 4.092 3.405 4.496 0.006 4 0 "[ . 1 . 2]" 1
15 1 6 SER HA 1 9 LYS QD . . 4.650 3.635 2.521 4.655 0.005 8 0 "[ . 1 . 2]" 1
16 1 7 GLY HA2 1 10 GLN H . . 4.670 3.799 3.420 4.117 . 0 0 "[ . 1 . 2]" 1
17 1 7 GLY HA2 1 10 GLN HB3 . . 4.680 3.782 3.088 4.561 . 0 0 "[ . 1 . 2]" 1
18 1 8 LEU H 1 8 LEU HB2 . . 3.770 2.479 2.245 2.637 . 0 0 "[ . 1 . 2]" 1
19 1 8 LEU H 1 8 LEU HB3 . . 4.040 3.534 3.496 3.546 . 0 0 "[ . 1 . 2]" 1
20 1 8 LEU H 1 8 LEU QD . . 4.480 2.493 1.803 3.207 . 0 0 "[ . 1 . 2]" 1
21 1 8 LEU H 1 8 LEU HG . . 3.980 2.912 2.028 3.773 . 0 0 "[ . 1 . 2]" 1
22 1 8 LEU H 1 9 LYS H . . 3.710 2.947 2.736 3.186 . 0 0 "[ . 1 . 2]" 1
23 1 8 LEU H 1 11 LYS QD . . 3.640 3.346 2.898 3.548 . 0 0 "[ . 1 . 2]" 1
24 1 8 LEU HA 1 8 LEU QD . . 3.110 1.979 1.914 2.119 . 0 0 "[ . 1 . 2]" 1
25 1 8 LEU HA 1 11 LYS H . . 3.790 3.336 3.064 3.555 . 0 0 "[ . 1 . 2]" 1
26 1 8 LEU HA 1 11 LYS HB2 . . 3.180 2.181 1.998 2.383 . 0 0 "[ . 1 . 2]" 1
27 1 8 LEU HA 1 11 LYS HB3 . . 4.210 3.782 3.553 4.005 . 0 0 "[ . 1 . 2]" 1
28 1 8 LEU HA 1 11 LYS QD . . 3.690 2.007 1.961 2.221 . 0 0 "[ . 1 . 2]" 1
29 1 8 LEU HA 1 12 VAL H . . 4.790 3.348 3.014 3.832 . 0 0 "[ . 1 . 2]" 1
30 1 8 LEU HA 1 66 LEU QD . . 5.220 4.057 3.846 4.298 . 0 0 "[ . 1 . 2]" 1
31 1 8 LEU HA 1 70 LEU MD1 . . 4.610 2.671 2.121 3.087 . 0 0 "[ . 1 . 2]" 1
32 1 8 LEU HB2 1 9 LYS H . . 3.970 2.540 2.350 2.732 . 0 0 "[ . 1 . 2]" 1
33 1 8 LEU HB2 1 66 LEU QD . . 3.570 2.463 2.258 2.796 . 0 0 "[ . 1 . 2]" 1
34 1 8 LEU HB3 1 9 LYS H . . 3.820 3.510 3.028 3.830 0.010 9 0 "[ . 1 . 2]" 1
35 1 8 LEU HB3 1 66 LEU HB2 . . 4.400 3.359 2.979 3.707 . 0 0 "[ . 1 . 2]" 1
36 1 8 LEU HB3 1 66 LEU HB3 . . 3.900 2.005 1.954 2.115 . 0 0 "[ . 1 . 2]" 1
37 1 8 LEU HB3 1 66 LEU QD . . 3.660 2.584 2.307 2.958 . 0 0 "[ . 1 . 2]" 1
38 1 8 LEU QD 1 9 LYS H . . 4.720 3.743 3.267 4.118 . 0 0 "[ . 1 . 2]" 1
39 1 8 LEU QD 1 11 LYS QD . . 3.920 2.359 2.097 2.744 . 0 0 "[ . 1 . 2]" 1
40 1 8 LEU QD 1 11 LYS QE . . 4.080 3.187 2.378 3.919 . 0 0 "[ . 1 . 2]" 1
41 1 8 LEU QD 1 66 LEU HB2 . . 3.530 2.687 1.992 3.465 . 0 0 "[ . 1 . 2]" 1
42 1 8 LEU QD 1 66 LEU HB3 . . 3.720 2.736 2.400 3.127 . 0 0 "[ . 1 . 2]" 1
43 1 8 LEU QD 1 66 LEU QD . . 3.520 2.748 2.275 3.046 . 0 0 "[ . 1 . 2]" 1
44 1 8 LEU QD 1 67 GLU H . . 3.930 3.043 2.565 3.473 . 0 0 "[ . 1 . 2]" 1
45 1 8 LEU QD 1 67 GLU HA . . 3.460 2.848 2.540 3.058 . 0 0 "[ . 1 . 2]" 1
46 1 8 LEU QD 1 67 GLU HG2 . . 3.750 1.870 1.710 2.008 . 0 0 "[ . 1 . 2]" 1
47 1 8 LEU QD 1 67 GLU HG3 . . 3.400 2.341 2.032 2.727 . 0 0 "[ . 1 . 2]" 1
48 1 8 LEU HG 1 66 LEU HB3 . . 4.680 3.763 2.446 4.701 0.021 11 0 "[ . 1 . 2]" 1
49 1 9 LYS H 1 9 LYS HB2 . . 3.510 2.082 2.017 2.313 . 0 0 "[ . 1 . 2]" 1
50 1 9 LYS H 1 9 LYS HB3 . . 3.380 3.302 2.938 3.526 0.146 3 0 "[ . 1 . 2]" 1
51 1 9 LYS H 1 9 LYS HG2 . . 4.200 4.101 3.500 4.205 0.005 4 0 "[ . 1 . 2]" 1
52 1 9 LYS H 1 9 LYS HG3 . . 4.350 3.269 2.461 4.121 . 0 0 "[ . 1 . 2]" 1
53 1 9 LYS H 1 10 GLN H . . 3.560 3.075 2.936 3.174 . 0 0 "[ . 1 . 2]" 1
54 1 9 LYS H 1 66 LEU QD . . 4.190 2.774 2.666 2.926 . 0 0 "[ . 1 . 2]" 1
55 1 9 LYS HA 1 9 LYS HG2 . . 3.730 2.347 2.047 2.600 . 0 0 "[ . 1 . 2]" 1
56 1 9 LYS HA 1 9 LYS HG3 . . 3.670 2.537 2.260 3.079 . 0 0 "[ . 1 . 2]" 1
57 1 9 LYS HA 1 12 VAL H . . 4.220 3.953 3.399 4.230 0.010 10 0 "[ . 1 . 2]" 1
58 1 9 LYS HA 1 12 VAL HB . . 3.440 3.028 2.600 3.261 . 0 0 "[ . 1 . 2]" 1
59 1 9 LYS HA 1 12 VAL QG . . 4.510 3.383 2.805 3.659 . 0 0 "[ . 1 . 2]" 1
60 1 9 LYS HA 1 58 PRO HB2 . . 4.080 2.676 2.051 3.340 . 0 0 "[ . 1 . 2]" 1
61 1 9 LYS HA 1 58 PRO HB3 . . 4.750 3.900 3.155 4.564 . 0 0 "[ . 1 . 2]" 1
62 1 9 LYS HA 1 66 LEU QD . . 3.310 2.394 2.125 2.569 . 0 0 "[ . 1 . 2]" 1
63 1 9 LYS HB2 1 10 GLN H . . 4.000 3.008 2.572 3.650 . 0 0 "[ . 1 . 2]" 1
64 1 9 LYS HB2 1 66 LEU QD . . 4.500 3.408 2.901 3.727 . 0 0 "[ . 1 . 2]" 1
65 1 9 LYS HB3 1 10 GLN H . . 3.690 2.725 2.302 3.093 . 0 0 "[ . 1 . 2]" 1
66 1 9 LYS HB3 1 66 LEU QD . . 4.720 4.152 3.895 4.341 . 0 0 "[ . 1 . 2]" 1
67 1 9 LYS QD 1 10 GLN H . . 4.630 4.561 4.113 4.679 0.049 10 0 "[ . 1 . 2]" 1
68 1 9 LYS QD 1 59 SER HA . . 3.380 2.382 1.988 3.087 . 0 0 "[ . 1 . 2]" 1
69 1 9 LYS QD 1 59 SER HB2 . . 4.710 3.275 2.339 4.700 . 0 0 "[ . 1 . 2]" 1
70 1 9 LYS QD 1 59 SER HB3 . . 4.530 3.391 2.018 4.620 0.090 19 0 "[ . 1 . 2]" 1
71 1 9 LYS QE 1 9 LYS HG2 . . 3.390 2.808 2.133 3.118 . 0 0 "[ . 1 . 2]" 1
72 1 9 LYS QE 1 9 LYS HG3 . . 3.690 2.269 1.959 3.279 . 0 0 "[ . 1 . 2]" 1
73 1 9 LYS HG2 1 10 GLN H . . 4.960 4.786 4.382 4.954 . 0 0 "[ . 1 . 2]" 1
74 1 9 LYS HG2 1 58 PRO HB2 . . 4.570 2.790 2.092 3.345 . 0 0 "[ . 1 . 2]" 1
75 1 9 LYS HG2 1 59 SER HA . . 4.140 2.562 2.041 3.102 . 0 0 "[ . 1 . 2]" 1
76 1 9 LYS HG2 1 59 SER HB2 . . 5.110 4.178 3.022 5.308 0.198 4 0 "[ . 1 . 2]" 1
77 1 9 LYS HG2 1 66 LEU QD . . 4.070 3.126 2.487 3.416 . 0 0 "[ . 1 . 2]" 1
78 1 9 LYS HG3 1 59 SER HA . . 4.240 3.116 2.160 3.851 . 0 0 "[ . 1 . 2]" 1
79 1 9 LYS HG3 1 66 LEU QD . . 3.800 2.383 1.870 3.237 . 0 0 "[ . 1 . 2]" 1
80 1 10 GLN H 1 10 GLN HB2 . . 3.250 2.179 2.021 2.968 . 0 0 "[ . 1 . 2]" 1
81 1 10 GLN H 1 10 GLN HB3 . . 3.260 2.933 2.147 3.168 . 0 0 "[ . 1 . 2]" 1
82 1 10 GLN H 1 10 GLN QG . . 3.660 3.586 3.432 3.776 0.116 9 0 "[ . 1 . 2]" 1
83 1 10 GLN HA 1 10 GLN HB2 . . 2.910 2.703 2.321 2.828 . 0 0 "[ . 1 . 2]" 1
84 1 10 GLN HA 1 10 GLN QG . . 3.290 2.161 1.964 2.703 . 0 0 "[ . 1 . 2]" 1
85 1 10 GLN HA 1 13 GLU H . . 3.730 3.422 3.092 3.687 . 0 0 "[ . 1 . 2]" 1
86 1 10 GLN HA 1 13 GLU HB2 . . 3.210 2.115 1.975 2.310 . 0 0 "[ . 1 . 2]" 1
87 1 10 GLN HA 1 13 GLU HB3 . . 3.610 3.468 3.167 3.616 0.006 10 0 "[ . 1 . 2]" 1
88 1 10 GLN HA 1 13 GLU HG2 . . 4.170 4.161 3.520 4.498 0.328 20 0 "[ . 1 . 2]" 1
89 1 10 GLN HA 1 13 GLU HG3 . . 4.420 3.231 2.938 3.906 . 0 0 "[ . 1 . 2]" 1
90 1 10 GLN HE21 1 14 ASN HD21 . . 3.690 2.728 1.901 3.886 0.196 13 0 "[ . 1 . 2]" 1
91 1 10 GLN QG 1 11 LYS H . . 5.200 4.109 2.561 4.454 . 0 0 "[ . 1 . 2]" 1
92 1 10 GLN QG 1 14 ASN H . . 4.850 4.372 3.235 4.796 . 0 0 "[ . 1 . 2]" 1
93 1 10 GLN QG 1 14 ASN HD21 . . 4.710 3.346 2.042 4.128 . 0 0 "[ . 1 . 2]" 1
94 1 10 GLN QG 1 14 ASN HD22 . . 5.210 3.873 2.944 5.041 . 0 0 "[ . 1 . 2]" 1
95 1 11 LYS H 1 11 LYS HB2 . . 3.400 2.389 2.278 2.606 . 0 0 "[ . 1 . 2]" 1
96 1 11 LYS H 1 11 LYS HB3 . . 4.060 3.529 3.507 3.553 . 0 0 "[ . 1 . 2]" 1
97 1 11 LYS H 1 11 LYS QD . . 4.430 2.918 2.481 3.196 . 0 0 "[ . 1 . 2]" 1
98 1 11 LYS H 1 11 LYS HG2 . . 4.020 3.792 3.528 4.017 . 0 0 "[ . 1 . 2]" 1
99 1 11 LYS H 1 11 LYS HG3 . . 3.470 2.426 2.013 2.966 . 0 0 "[ . 1 . 2]" 1
100 1 11 LYS H 1 12 VAL H . . 3.400 2.983 2.707 3.149 . 0 0 "[ . 1 . 2]" 1
101 1 11 LYS H 1 12 VAL QG . . 4.920 4.269 3.996 4.487 . 0 0 "[ . 1 . 2]" 1
102 1 11 LYS H 1 70 LEU MD2 . . 5.130 4.997 4.374 5.140 0.010 11 0 "[ . 1 . 2]" 1
103 1 11 LYS HA 1 11 LYS QD . . 4.650 3.935 3.610 4.060 . 0 0 "[ . 1 . 2]" 1
104 1 11 LYS HA 1 11 LYS HG2 . . 3.390 2.905 2.758 3.187 . 0 0 "[ . 1 . 2]" 1
105 1 11 LYS HA 1 11 LYS HG3 . . 3.620 2.401 2.153 2.594 . 0 0 "[ . 1 . 2]" 1
106 1 11 LYS HA 1 14 ASN H . . 4.030 3.630 3.403 3.870 . 0 0 "[ . 1 . 2]" 1
107 1 11 LYS HA 1 14 ASN QB . . 3.390 3.061 2.705 3.318 . 0 0 "[ . 1 . 2]" 1
108 1 11 LYS HA 1 14 ASN HD21 . . 4.350 3.839 2.762 4.353 0.003 5 0 "[ . 1 . 2]" 1
109 1 11 LYS HB2 1 11 LYS QD . . 3.190 2.011 1.955 2.118 . 0 0 "[ . 1 . 2]" 1
110 1 11 LYS HB2 1 12 VAL H . . 3.890 2.407 2.246 2.751 . 0 0 "[ . 1 . 2]" 1
111 1 11 LYS HB2 1 12 VAL QG . . 4.290 3.207 3.066 3.304 . 0 0 "[ . 1 . 2]" 1
112 1 11 LYS HB2 1 70 LEU MD1 . . 3.940 2.551 1.975 3.136 . 0 0 "[ . 1 . 2]" 1
113 1 11 LYS HB2 1 70 LEU MD2 . . 3.980 3.075 2.233 3.363 . 0 0 "[ . 1 . 2]" 1
114 1 11 LYS HB3 1 11 LYS QE . . 4.430 3.648 2.928 4.429 . 0 0 "[ . 1 . 2]" 1
115 1 11 LYS HB3 1 12 VAL H . . 4.480 3.247 2.908 3.658 . 0 0 "[ . 1 . 2]" 1
116 1 11 LYS HB3 1 12 VAL QG . . 4.750 3.727 3.467 3.974 . 0 0 "[ . 1 . 2]" 1
117 1 11 LYS HB3 1 70 LEU MD1 . . 3.980 2.921 2.281 3.746 . 0 0 "[ . 1 . 2]" 1
118 1 11 LYS HB3 1 70 LEU MD2 . . 3.850 2.111 1.926 2.516 . 0 0 "[ . 1 . 2]" 1
119 1 11 LYS QD 1 12 VAL QG . . 4.520 4.269 4.198 4.320 . 0 0 "[ . 1 . 2]" 1
120 1 11 LYS QD 1 70 LEU MD2 . . 5.150 3.754 2.996 4.386 . 0 0 "[ . 1 . 2]" 1
121 1 11 LYS QE 1 70 LEU MD2 . . 5.500 4.093 2.908 5.335 . 0 0 "[ . 1 . 2]" 1
122 1 12 VAL H 1 12 VAL HB . . 3.260 2.472 2.339 2.645 . 0 0 "[ . 1 . 2]" 1
123 1 12 VAL H 1 12 VAL QG . . 3.160 2.076 1.927 2.314 . 0 0 "[ . 1 . 2]" 1
124 1 12 VAL H 1 13 GLU H . . 3.380 2.763 2.529 2.951 . 0 0 "[ . 1 . 2]" 1
125 1 12 VAL H 1 70 LEU MD1 . . 4.850 3.247 2.369 4.101 . 0 0 "[ . 1 . 2]" 1
126 1 12 VAL H 1 70 LEU MD2 . . 4.770 3.727 3.394 4.030 . 0 0 "[ . 1 . 2]" 1
127 1 12 VAL HA 1 12 VAL QG . . 2.980 2.110 2.058 2.164 . 0 0 "[ . 1 . 2]" 1
128 1 12 VAL HA 1 15 LEU H . . 3.750 3.325 3.120 3.545 . 0 0 "[ . 1 . 2]" 1
129 1 12 VAL HA 1 15 LEU HB2 . . 3.490 3.143 2.988 3.230 . 0 0 "[ . 1 . 2]" 1
130 1 12 VAL HA 1 15 LEU HB3 . . 3.230 2.011 1.982 2.104 . 0 0 "[ . 1 . 2]" 1
131 1 12 VAL HA 1 15 LEU MD1 . . 4.920 4.479 4.310 4.623 . 0 0 "[ . 1 . 2]" 1
132 1 12 VAL HA 1 15 LEU MD2 . . 4.250 2.327 1.984 2.611 . 0 0 "[ . 1 . 2]" 1
133 1 12 VAL HA 1 15 LEU HG . . 4.490 3.955 3.745 4.162 . 0 0 "[ . 1 . 2]" 1
134 1 12 VAL HA 1 16 PHE H . . 4.500 4.004 3.834 4.207 . 0 0 "[ . 1 . 2]" 1
135 1 12 VAL HA 1 69 ILE MG . . 4.520 3.791 3.319 4.238 . 0 0 "[ . 1 . 2]" 1
136 1 12 VAL HA 1 70 LEU MD2 . . 3.710 3.443 2.942 3.685 . 0 0 "[ . 1 . 2]" 1
137 1 12 VAL HB 1 13 GLU H . . 3.640 2.765 2.491 3.089 . 0 0 "[ . 1 . 2]" 1
138 1 12 VAL HB 1 66 LEU QD . . 3.680 2.764 2.334 3.014 . 0 0 "[ . 1 . 2]" 1
139 1 12 VAL QG 1 13 GLU H . . 4.210 3.319 3.123 3.521 . 0 0 "[ . 1 . 2]" 1
140 1 12 VAL QG 1 13 GLU HA . . 4.300 3.545 3.310 3.822 . 0 0 "[ . 1 . 2]" 1
141 1 12 VAL QG 1 15 LEU HB3 . . 4.080 3.181 2.860 3.357 . 0 0 "[ . 1 . 2]" 1
142 1 12 VAL QG 1 15 LEU MD2 . . 4.310 2.212 1.926 2.458 . 0 0 "[ . 1 . 2]" 1
143 1 12 VAL QG 1 15 LEU HG . . 4.770 3.717 3.363 3.925 . 0 0 "[ . 1 . 2]" 1
144 1 12 VAL QG 1 16 PHE H . . 4.920 3.657 3.312 3.948 . 0 0 "[ . 1 . 2]" 1
145 1 12 VAL QG 1 16 PHE QD . . 3.730 3.150 2.949 3.327 . 0 0 "[ . 1 . 2]" 1
146 1 12 VAL QG 1 16 PHE QE . . 3.830 2.200 1.948 2.377 . 0 0 "[ . 1 . 2]" 1
147 1 12 VAL QG 1 58 PRO HA . . 4.510 3.220 2.684 3.649 . 0 0 "[ . 1 . 2]" 1
148 1 12 VAL QG 1 58 PRO HB2 . . 3.940 3.113 2.894 3.360 . 0 0 "[ . 1 . 2]" 1
149 1 12 VAL QG 1 58 PRO HB3 . . 3.540 1.934 1.784 2.178 . 0 0 "[ . 1 . 2]" 1
150 1 12 VAL QG 1 58 PRO HG2 . . 4.150 3.974 3.566 4.100 . 0 0 "[ . 1 . 2]" 1
151 1 12 VAL QG 1 58 PRO HG3 . . 3.620 2.884 2.200 3.200 . 0 0 "[ . 1 . 2]" 1
152 1 12 VAL QG 1 66 LEU HA . . 3.440 3.073 2.760 3.274 . 0 0 "[ . 1 . 2]" 1
153 1 12 VAL QG 1 66 LEU HB3 . . 3.940 2.848 2.581 3.212 . 0 0 "[ . 1 . 2]" 1
154 1 12 VAL QG 1 66 LEU QD . . 3.400 2.004 1.724 2.299 . 0 0 "[ . 1 . 2]" 1
155 1 12 VAL QG 1 69 ILE H . . 4.660 4.219 4.020 4.434 . 0 0 "[ . 1 . 2]" 1
156 1 12 VAL QG 1 69 ILE MD . . 3.600 2.681 2.384 3.049 . 0 0 "[ . 1 . 2]" 1
157 1 12 VAL QG 1 69 ILE MG . . 3.090 2.102 1.759 2.454 . 0 0 "[ . 1 . 2]" 1
158 1 12 VAL QG 1 70 LEU H . . 4.340 3.196 2.995 3.353 . 0 0 "[ . 1 . 2]" 1
159 1 12 VAL QG 1 70 LEU HB2 . . 4.260 3.786 3.432 4.029 . 0 0 "[ . 1 . 2]" 1
160 1 12 VAL QG 1 70 LEU MD2 . . 3.070 2.886 2.260 3.042 . 0 0 "[ . 1 . 2]" 1
161 1 12 VAL QG 1 70 LEU HG . . 3.240 2.133 1.951 2.582 . 0 0 "[ . 1 . 2]" 1
162 1 13 GLU H 1 13 GLU HB2 . . 3.230 2.152 2.023 2.305 . 0 0 "[ . 1 . 2]" 1
163 1 13 GLU H 1 13 GLU HG2 . . 3.730 3.221 2.748 4.018 0.288 4 0 "[ . 1 . 2]" 1
164 1 13 GLU H 1 13 GLU HG3 . . 4.400 3.509 2.609 4.258 . 0 0 "[ . 1 . 2]" 1
165 1 13 GLU H 1 58 PRO HG2 . . 4.860 4.291 3.802 4.570 . 0 0 "[ . 1 . 2]" 1
166 1 13 GLU H 1 58 PRO HG3 . . 5.080 4.054 3.529 4.450 . 0 0 "[ . 1 . 2]" 1
167 1 13 GLU HA 1 13 GLU HG2 . . 3.610 2.356 1.980 2.735 . 0 0 "[ . 1 . 2]" 1
168 1 13 GLU HA 1 13 GLU HG3 . . 3.750 3.330 2.356 3.595 . 0 0 "[ . 1 . 2]" 1
169 1 13 GLU HA 1 16 PHE H . . 4.250 4.012 3.739 4.136 . 0 0 "[ . 1 . 2]" 1
170 1 13 GLU HA 1 16 PHE QD . . 4.350 2.894 2.594 3.244 . 0 0 "[ . 1 . 2]" 1
171 1 13 GLU HA 1 58 PRO HG2 . . 3.280 3.207 2.913 3.301 0.021 19 0 "[ . 1 . 2]" 1
172 1 13 GLU HA 1 58 PRO HG3 . . 3.620 2.524 2.203 2.818 . 0 0 "[ . 1 . 2]" 1
173 1 13 GLU HB2 1 14 ASN H . . 3.920 2.700 2.372 3.037 . 0 0 "[ . 1 . 2]" 1
174 1 13 GLU HB3 1 14 ASN H . . 3.200 2.895 2.197 3.206 0.006 19 0 "[ . 1 . 2]" 1
175 1 13 GLU HG2 1 14 ASN H . . 4.800 4.821 4.651 5.118 0.318 4 0 "[ . 1 . 2]" 1
176 1 13 GLU HG2 1 58 PRO HB3 . . 4.630 4.126 3.139 5.071 0.441 4 0 "[ . 1 . 2]" 1
177 1 13 GLU HG2 1 58 PRO HG2 . . 4.020 2.080 1.989 2.619 . 0 0 "[ . 1 . 2]" 1
178 1 14 ASN H 1 14 ASN QB . . 3.040 2.102 2.003 2.264 . 0 0 "[ . 1 . 2]" 1
179 1 14 ASN H 1 15 LEU H . . 3.550 2.672 2.553 2.783 . 0 0 "[ . 1 . 2]" 1
180 1 14 ASN HA 1 14 ASN HD21 . . 3.860 3.569 3.181 3.831 . 0 0 "[ . 1 . 2]" 1
181 1 14 ASN HA 1 14 ASN HD22 . . 4.310 4.017 3.793 4.214 . 0 0 "[ . 1 . 2]" 1
182 1 14 ASN HA 1 17 ASN H . . 4.350 3.627 3.189 3.803 . 0 0 "[ . 1 . 2]" 1
183 1 14 ASN HA 1 17 ASN HB2 . . 3.490 2.386 2.078 2.633 . 0 0 "[ . 1 . 2]" 1
184 1 14 ASN HA 1 17 ASN HB3 . . 4.120 3.858 3.502 4.093 . 0 0 "[ . 1 . 2]" 1
185 1 14 ASN HA 1 17 ASN HD21 . . 5.400 4.702 3.327 5.364 . 0 0 "[ . 1 . 2]" 1
186 1 14 ASN HA 1 18 GLU H . . 4.680 3.647 3.426 3.894 . 0 0 "[ . 1 . 2]" 1
187 1 14 ASN QB 1 15 LEU H . . 3.420 2.670 2.530 2.847 . 0 0 "[ . 1 . 2]" 1
188 1 15 LEU H 1 15 LEU HB2 . . 3.290 2.806 2.773 2.853 . 0 0 "[ . 1 . 2]" 1
189 1 15 LEU H 1 15 LEU HB3 . . 3.170 2.135 2.112 2.170 . 0 0 "[ . 1 . 2]" 1
190 1 15 LEU H 1 15 LEU MD1 . . 4.700 4.230 4.153 4.276 . 0 0 "[ . 1 . 2]" 1
191 1 15 LEU H 1 15 LEU MD2 . . 4.290 4.082 3.984 4.163 . 0 0 "[ . 1 . 2]" 1
192 1 15 LEU H 1 15 LEU HG . . 4.110 4.131 4.088 4.181 0.071 20 0 "[ . 1 . 2]" 1
193 1 15 LEU H 1 16 PHE H . . 3.580 3.163 3.002 3.247 . 0 0 "[ . 1 . 2]" 1
194 1 15 LEU HA 1 15 LEU HB2 . . 3.020 2.252 2.235 2.264 . 0 0 "[ . 1 . 2]" 1
195 1 15 LEU HA 1 15 LEU MD1 . . 3.150 2.446 2.214 2.649 . 0 0 "[ . 1 . 2]" 1
196 1 15 LEU HA 1 15 LEU MD2 . . 4.240 4.004 3.932 4.052 . 0 0 "[ . 1 . 2]" 1
197 1 15 LEU HA 1 15 LEU HG . . 3.950 3.483 3.421 3.567 . 0 0 "[ . 1 . 2]" 1
198 1 15 LEU HA 1 18 GLU H . . 4.130 3.887 3.479 4.085 . 0 0 "[ . 1 . 2]" 1
199 1 15 LEU HA 1 18 GLU HB2 . . 3.660 2.878 2.541 3.074 . 0 0 "[ . 1 . 2]" 1
200 1 15 LEU HA 1 18 GLU HB3 . . 4.140 4.030 3.708 4.150 0.010 7 0 "[ . 1 . 2]" 1
201 1 15 LEU HA 1 18 GLU HG3 . . 4.630 4.385 3.723 4.629 . 0 0 "[ . 1 . 2]" 1
202 1 15 LEU HB2 1 15 LEU MD2 . . 3.450 2.425 2.313 2.530 . 0 0 "[ . 1 . 2]" 1
203 1 15 LEU HB2 1 16 PHE H . . 4.050 3.878 3.813 3.978 . 0 0 "[ . 1 . 2]" 1
204 1 15 LEU HB3 1 15 LEU MD2 . . 3.370 2.274 2.121 2.417 . 0 0 "[ . 1 . 2]" 1
205 1 15 LEU HB3 1 16 PHE H . . 3.490 2.595 2.502 2.721 . 0 0 "[ . 1 . 2]" 1
206 1 15 LEU HB3 1 16 PHE QD . . 4.520 4.476 4.202 4.552 0.032 13 0 "[ . 1 . 2]" 1
207 1 15 LEU MD1 1 16 PHE H . . 4.480 3.656 3.439 3.822 . 0 0 "[ . 1 . 2]" 1
208 1 15 LEU MD1 1 16 PHE HB2 . . 5.500 5.401 5.138 5.518 0.018 3 0 "[ . 1 . 2]" 1
209 1 15 LEU MD1 1 16 PHE QD . . 4.320 3.690 3.395 4.220 . 0 0 "[ . 1 . 2]" 1
210 1 15 LEU MD1 1 16 PHE QE . . 4.930 4.397 4.140 4.885 . 0 0 "[ . 1 . 2]" 1
211 1 15 LEU MD1 1 19 LYS H . . 4.700 3.467 3.195 3.744 . 0 0 "[ . 1 . 2]" 1
212 1 15 LEU MD1 1 19 LYS QE . . 3.480 2.487 1.887 2.994 . 0 0 "[ . 1 . 2]" 1
213 1 15 LEU MD1 1 19 LYS HG2 . . 3.500 2.062 1.866 2.371 . 0 0 "[ . 1 . 2]" 1
214 1 15 LEU MD1 1 19 LYS HG3 . . 3.830 2.139 1.871 3.541 . 0 0 "[ . 1 . 2]" 1
215 1 15 LEU MD1 1 73 LYS HA . . 3.560 2.797 2.315 3.238 . 0 0 "[ . 1 . 2]" 1
216 1 15 LEU MD1 1 73 LYS HB2 . . 3.920 2.217 2.016 2.511 . 0 0 "[ . 1 . 2]" 1
217 1 15 LEU MD1 1 73 LYS HB3 . . 3.590 3.427 3.094 3.607 0.017 20 0 "[ . 1 . 2]" 1
218 1 15 LEU MD1 1 73 LYS QD . . 4.210 3.580 3.118 4.125 . 0 0 "[ . 1 . 2]" 1
219 1 15 LEU MD1 1 73 LYS HG3 . . 4.660 4.168 3.466 4.645 . 0 0 "[ . 1 . 2]" 1
220 1 15 LEU MD2 1 16 PHE H . . 4.480 3.477 3.363 3.744 . 0 0 "[ . 1 . 2]" 1
221 1 15 LEU MD2 1 16 PHE QD . . 4.250 3.465 2.931 4.007 . 0 0 "[ . 1 . 2]" 1
222 1 15 LEU MD2 1 16 PHE QE . . 4.520 2.955 2.280 3.767 . 0 0 "[ . 1 . 2]" 1
223 1 15 LEU MD2 1 19 LYS QE . . 5.000 4.366 3.942 4.665 . 0 0 "[ . 1 . 2]" 1
224 1 15 LEU MD2 1 73 LYS HA . . 3.780 2.925 2.561 3.179 . 0 0 "[ . 1 . 2]" 1
225 1 15 LEU MD2 1 73 LYS HB2 . . 3.840 2.922 2.302 3.499 . 0 0 "[ . 1 . 2]" 1
226 1 15 LEU MD2 1 73 LYS HB3 . . 3.750 3.039 2.495 3.421 . 0 0 "[ . 1 . 2]" 1
227 1 15 LEU HG 1 16 PHE H . . 3.740 2.307 2.184 2.649 . 0 0 "[ . 1 . 2]" 1
228 1 15 LEU HG 1 16 PHE HA . . 4.490 2.933 2.876 3.077 . 0 0 "[ . 1 . 2]" 1
229 1 15 LEU HG 1 16 PHE QD . . 4.100 2.746 2.269 3.477 . 0 0 "[ . 1 . 2]" 1
230 1 16 PHE H 1 16 PHE HB2 . . 3.470 2.434 2.346 2.505 . 0 0 "[ . 1 . 2]" 1
231 1 16 PHE H 1 16 PHE HB3 . . 3.860 3.475 3.461 3.488 . 0 0 "[ . 1 . 2]" 1
232 1 16 PHE H 1 16 PHE QD . . 3.950 2.952 2.707 3.056 . 0 0 "[ . 1 . 2]" 1
233 1 16 PHE H 1 17 ASN H . . 3.540 3.041 2.807 3.134 . 0 0 "[ . 1 . 2]" 1
234 1 16 PHE HA 1 16 PHE QD . . 2.860 2.002 1.931 2.166 . 0 0 "[ . 1 . 2]" 1
235 1 16 PHE HA 1 16 PHE QE . . 4.380 4.371 4.341 4.392 0.012 15 0 "[ . 1 . 2]" 1
236 1 16 PHE HA 1 19 LYS H . . 4.370 3.651 3.442 4.073 . 0 0 "[ . 1 . 2]" 1
237 1 16 PHE HA 1 19 LYS HB2 . . 4.080 2.641 2.437 2.908 . 0 0 "[ . 1 . 2]" 1
238 1 16 PHE HA 1 19 LYS HB3 . . 4.810 4.235 3.999 4.536 . 0 0 "[ . 1 . 2]" 1
239 1 16 PHE HA 1 19 LYS HG3 . . 5.000 3.707 3.232 5.814 0.814 4 1 "[ +. 1 . 2]" 1
240 1 16 PHE HA 1 32 VAL MG2 . . 4.550 3.530 3.071 3.829 . 0 0 "[ . 1 . 2]" 1
241 1 16 PHE HA 1 78 PHE QE . . 3.980 3.049 2.608 3.280 . 0 0 "[ . 1 . 2]" 1
242 1 16 PHE HA 1 78 PHE HZ . . 4.040 2.225 1.996 2.748 . 0 0 "[ . 1 . 2]" 1
243 1 16 PHE HB2 1 17 ASN H . . 3.730 2.124 1.953 2.582 . 0 0 "[ . 1 . 2]" 1
244 1 16 PHE HB2 1 32 VAL MG2 . . 3.370 2.888 2.491 3.381 0.011 17 0 "[ . 1 . 2]" 1
245 1 16 PHE HB2 1 78 PHE HZ . . 4.370 4.224 3.885 4.374 0.004 5 0 "[ . 1 . 2]" 1
246 1 16 PHE HB3 1 17 ASN H . . 4.000 3.195 3.053 3.687 . 0 0 "[ . 1 . 2]" 1
247 1 16 PHE HB3 1 32 VAL MG2 . . 3.280 1.991 1.829 2.331 . 0 0 "[ . 1 . 2]" 1
248 1 16 PHE HB3 1 55 PHE HZ . . 4.640 3.717 3.406 4.226 . 0 0 "[ . 1 . 2]" 1
249 1 16 PHE HB3 1 78 PHE HZ . . 4.020 2.782 2.343 3.024 . 0 0 "[ . 1 . 2]" 1
250 1 16 PHE QD 1 32 VAL MG2 . . 4.270 3.830 3.625 4.235 . 0 0 "[ . 1 . 2]" 1
251 1 16 PHE QD 1 34 PHE QE . . 4.390 4.166 3.745 4.389 . 0 0 "[ . 1 . 2]" 1
252 1 16 PHE QD 1 34 PHE HZ . . 3.540 3.113 2.569 3.384 . 0 0 "[ . 1 . 2]" 1
253 1 16 PHE QD 1 55 PHE QD . . 4.810 4.257 3.672 4.814 0.004 20 0 "[ . 1 . 2]" 1
254 1 16 PHE QD 1 55 PHE QE . . 4.550 2.708 2.096 3.121 . 0 0 "[ . 1 . 2]" 1
255 1 16 PHE QD 1 55 PHE HZ . . 4.420 4.357 3.980 4.428 0.008 10 0 "[ . 1 . 2]" 1
256 1 16 PHE QD 1 57 ARG HA . . 4.980 4.642 4.082 4.956 . 0 0 "[ . 1 . 2]" 1
257 1 16 PHE QD 1 58 PRO HD2 . . 4.500 4.355 4.030 4.504 0.004 15 0 "[ . 1 . 2]" 1
258 1 16 PHE QD 1 58 PRO HD3 . . 4.050 3.059 2.731 3.268 . 0 0 "[ . 1 . 2]" 1
259 1 16 PHE QD 1 58 PRO HG2 . . 4.200 3.999 3.707 4.222 0.022 11 0 "[ . 1 . 2]" 1
260 1 16 PHE QD 1 58 PRO HG3 . . 4.130 2.430 2.100 2.927 . 0 0 "[ . 1 . 2]" 1
261 1 16 PHE QD 1 76 ILE MD . . 4.090 4.053 3.841 4.101 0.011 14 0 "[ . 1 . 2]" 1
262 1 16 PHE QD 1 76 ILE MG . . 4.170 3.714 3.564 3.904 . 0 0 "[ . 1 . 2]" 1
263 1 16 PHE QD 1 78 PHE QE . . 4.200 2.975 2.601 3.297 . 0 0 "[ . 1 . 2]" 1
264 1 16 PHE QD 1 78 PHE HZ . . 4.360 2.484 1.996 3.077 . 0 0 "[ . 1 . 2]" 1
265 1 16 PHE QE 1 34 PHE HZ . . 4.170 4.073 3.775 4.180 0.010 18 0 "[ . 1 . 2]" 1
266 1 16 PHE QE 1 49 LEU MD1 . . 5.140 4.304 3.871 4.709 . 0 0 "[ . 1 . 2]" 1
267 1 16 PHE QE 1 49 LEU MD2 . . 3.640 2.898 2.524 3.143 . 0 0 "[ . 1 . 2]" 1
268 1 16 PHE QE 1 55 PHE QE . . 4.670 3.336 3.082 3.578 . 0 0 "[ . 1 . 2]" 1
269 1 16 PHE QE 1 57 ARG HA . . 5.120 3.844 3.467 4.166 . 0 0 "[ . 1 . 2]" 1
270 1 16 PHE QE 1 58 PRO HB3 . . 4.320 2.414 1.996 2.972 . 0 0 "[ . 1 . 2]" 1
271 1 16 PHE QE 1 58 PRO HD2 . . 4.190 4.006 3.729 4.194 0.004 20 0 "[ . 1 . 2]" 1
272 1 16 PHE QE 1 58 PRO HD3 . . 4.020 2.574 2.136 2.890 . 0 0 "[ . 1 . 2]" 1
273 1 16 PHE QE 1 58 PRO HG2 . . 4.720 3.876 3.647 4.230 . 0 0 "[ . 1 . 2]" 1
274 1 16 PHE QE 1 58 PRO HG3 . . 4.070 2.398 2.100 2.894 . 0 0 "[ . 1 . 2]" 1
275 1 16 PHE QE 1 69 ILE MD . . 4.060 3.959 3.557 4.069 0.009 3 0 "[ . 1 . 2]" 1
276 1 16 PHE QE 1 69 ILE MG . . 3.380 2.793 2.368 3.233 . 0 0 "[ . 1 . 2]" 1
277 1 16 PHE QE 1 76 ILE MD . . 3.530 2.978 2.737 3.229 . 0 0 "[ . 1 . 2]" 1
278 1 16 PHE QE 1 76 ILE MG . . 4.270 3.750 3.551 3.967 . 0 0 "[ . 1 . 2]" 1
279 1 16 PHE HZ 1 49 LEU MD2 . . 3.790 3.745 3.541 3.807 0.017 20 0 "[ . 1 . 2]" 1
280 1 16 PHE HZ 1 69 ILE MD . . 3.410 2.971 2.491 3.208 . 0 0 "[ . 1 . 2]" 1
281 1 16 PHE HZ 1 69 ILE MG . . 3.490 2.794 2.365 3.073 . 0 0 "[ . 1 . 2]" 1
282 1 17 ASN H 1 17 ASN HB2 . . 3.610 2.381 2.071 2.680 . 0 0 "[ . 1 . 2]" 1
283 1 17 ASN H 1 17 ASN HB3 . . 3.840 3.534 3.369 3.577 . 0 0 "[ . 1 . 2]" 1
284 1 17 ASN H 1 18 GLU H . . 3.590 3.038 2.689 3.184 . 0 0 "[ . 1 . 2]" 1
285 1 17 ASN H 1 32 VAL MG2 . . 4.540 3.099 2.660 3.578 . 0 0 "[ . 1 . 2]" 1
286 1 17 ASN HB2 1 17 ASN HD21 . . 3.530 3.118 2.372 3.395 . 0 0 "[ . 1 . 2]" 1
287 1 17 ASN HB2 1 17 ASN HD22 . . 4.040 3.922 3.558 4.063 0.023 15 0 "[ . 1 . 2]" 1
288 1 17 ASN HB2 1 18 GLU H . . 3.890 2.363 2.054 2.934 . 0 0 "[ . 1 . 2]" 1
289 1 17 ASN HB2 1 29 ALA MB . . 3.460 2.987 2.469 3.451 . 0 0 "[ . 1 . 2]" 1
290 1 17 ASN HB2 1 30 VAL H . . 4.520 4.377 3.647 4.533 0.013 14 0 "[ . 1 . 2]" 1
291 1 17 ASN HB3 1 17 ASN HD21 . . 3.530 2.429 2.108 3.562 0.032 20 0 "[ . 1 . 2]" 1
292 1 17 ASN HB3 1 17 ASN HD22 . . 4.140 3.601 3.447 4.155 0.015 20 0 "[ . 1 . 2]" 1
293 1 17 ASN HB3 1 18 GLU H . . 4.310 3.062 2.639 3.573 . 0 0 "[ . 1 . 2]" 1
294 1 17 ASN HB3 1 18 GLU HA . . 4.620 3.932 3.689 4.344 . 0 0 "[ . 1 . 2]" 1
295 1 17 ASN HB3 1 29 ALA HA . . 4.920 3.753 3.050 4.187 . 0 0 "[ . 1 . 2]" 1
296 1 17 ASN HB3 1 29 ALA MB . . 3.210 2.073 1.860 2.242 . 0 0 "[ . 1 . 2]" 1
297 1 17 ASN HB3 1 30 VAL H . . 4.180 2.887 1.988 3.307 . 0 0 "[ . 1 . 2]" 1
298 1 17 ASN HB3 1 31 LYS HA . . 4.710 4.270 3.628 4.648 . 0 0 "[ . 1 . 2]" 1
299 1 17 ASN HD21 1 31 LYS HA . . 4.370 2.957 2.432 3.934 . 0 0 "[ . 1 . 2]" 1
300 1 17 ASN HD21 1 31 LYS HG2 . . 5.270 4.174 3.610 4.857 . 0 0 "[ . 1 . 2]" 1
301 1 17 ASN HD21 1 31 LYS HG3 . . 5.220 4.656 3.830 5.237 0.017 13 0 "[ . 1 . 2]" 1
302 1 17 ASN HD22 1 31 LYS HA . . 4.060 2.493 1.947 3.801 . 0 0 "[ . 1 . 2]" 1
303 1 17 ASN HD22 1 31 LYS QD . . 4.850 4.604 3.992 4.858 0.008 16 0 "[ . 1 . 2]" 1
304 1 17 ASN HD22 1 31 LYS HG2 . . 5.200 2.963 2.267 3.333 . 0 0 "[ . 1 . 2]" 1
305 1 17 ASN HD22 1 31 LYS HG3 . . 4.700 3.570 2.844 4.640 . 0 0 "[ . 1 . 2]" 1
306 1 18 GLU H 1 18 GLU HB2 . . 3.490 2.107 2.057 2.479 . 0 0 "[ . 1 . 2]" 1
307 1 18 GLU H 1 18 GLU HB3 . . 3.830 3.395 3.348 3.549 . 0 0 "[ . 1 . 2]" 1
308 1 18 GLU H 1 18 GLU HG2 . . 4.060 3.360 3.239 3.511 . 0 0 "[ . 1 . 2]" 1
309 1 18 GLU H 1 18 GLU HG3 . . 3.580 3.436 2.078 3.574 . 0 0 "[ . 1 . 2]" 1
310 1 18 GLU H 1 19 LYS H . . 3.490 3.005 2.816 3.153 . 0 0 "[ . 1 . 2]" 1
311 1 18 GLU H 1 29 ALA MB . . 4.040 3.075 2.683 3.509 . 0 0 "[ . 1 . 2]" 1
312 1 18 GLU HA 1 18 GLU HG2 . . 3.450 2.045 1.992 2.663 . 0 0 "[ . 1 . 2]" 1
313 1 18 GLU HA 1 18 GLU HG3 . . 3.830 3.319 2.713 3.401 . 0 0 "[ . 1 . 2]" 1
314 1 18 GLU HA 1 29 ALA H . . 4.570 4.503 4.364 4.577 0.007 18 0 "[ . 1 . 2]" 1
315 1 18 GLU HA 1 29 ALA HA . . 3.000 2.165 1.996 2.381 . 0 0 "[ . 1 . 2]" 1
316 1 18 GLU HA 1 29 ALA MB . . 3.250 2.505 2.100 2.987 . 0 0 "[ . 1 . 2]" 1
317 1 18 GLU HA 1 30 VAL H . . 4.020 3.661 3.392 3.882 . 0 0 "[ . 1 . 2]" 1
318 1 18 GLU HB2 1 18 GLU HG2 . . 2.880 2.839 2.786 3.036 0.156 13 0 "[ . 1 . 2]" 1
319 1 18 GLU HB2 1 19 LYS H . . 3.910 2.757 2.463 2.915 . 0 0 "[ . 1 . 2]" 1
320 1 18 GLU HB3 1 19 LYS H . . 3.960 2.758 2.479 3.454 . 0 0 "[ . 1 . 2]" 1
321 1 18 GLU HG2 1 29 ALA HA . . 4.550 3.328 2.917 4.394 . 0 0 "[ . 1 . 2]" 1
322 1 18 GLU HG2 1 29 ALA MB . . 3.600 2.505 2.206 3.095 . 0 0 "[ . 1 . 2]" 1
323 1 18 GLU HG3 1 29 ALA MB . . 3.770 3.531 2.694 3.776 0.006 3 0 "[ . 1 . 2]" 1
324 1 19 LYS H 1 19 LYS HB2 . . 3.590 2.474 2.327 2.543 . 0 0 "[ . 1 . 2]" 1
325 1 19 LYS H 1 19 LYS HB3 . . 4.010 3.541 3.529 3.551 . 0 0 "[ . 1 . 2]" 1
326 1 19 LYS H 1 19 LYS HD2 . . 3.750 3.831 1.926 4.014 0.264 3 0 "[ . 1 . 2]" 1
327 1 19 LYS H 1 19 LYS HD3 . . 4.000 3.537 2.086 4.011 0.011 12 0 "[ . 1 . 2]" 1
328 1 19 LYS H 1 19 LYS HG2 . . 3.460 2.130 1.939 3.749 0.289 4 0 "[ . 1 . 2]" 1
329 1 19 LYS H 1 19 LYS HG3 . . 4.040 3.471 3.316 3.605 . 0 0 "[ . 1 . 2]" 1
330 1 19 LYS H 1 20 CYS H . . 3.520 2.917 2.728 3.046 . 0 0 "[ . 1 . 2]" 1
331 1 19 LYS HA 1 19 LYS HD2 . . 3.150 2.085 1.988 2.517 . 0 0 "[ . 1 . 2]" 1
332 1 19 LYS HA 1 19 LYS HD3 . . 3.950 2.774 2.432 3.637 . 0 0 "[ . 1 . 2]" 1
333 1 19 LYS HA 1 19 LYS HG2 . . 4.200 2.971 2.854 3.573 . 0 0 "[ . 1 . 2]" 1
334 1 19 LYS HA 1 19 LYS HG3 . . 4.090 3.617 2.342 3.730 . 0 0 "[ . 1 . 2]" 1
335 1 19 LYS HA 1 22 GLU H . . 3.790 3.290 3.115 3.450 . 0 0 "[ . 1 . 2]" 1
336 1 19 LYS HA 1 22 GLU HB2 . . 3.890 2.290 2.015 3.885 . 0 0 "[ . 1 . 2]" 1
337 1 19 LYS HA 1 22 GLU HB3 . . 3.340 2.937 2.364 3.409 0.069 1 0 "[ . 1 . 2]" 1
338 1 19 LYS HA 1 23 ALA H . . 4.590 4.054 3.730 4.244 . 0 0 "[ . 1 . 2]" 1
339 1 19 LYS HB2 1 20 CYS H . . 4.230 2.674 2.494 3.077 . 0 0 "[ . 1 . 2]" 1
340 1 19 LYS HB2 1 76 ILE MG . . 4.270 4.012 3.672 4.261 . 0 0 "[ . 1 . 2]" 1
341 1 19 LYS HB2 1 78 PHE QD . . 4.500 3.570 3.042 3.858 . 0 0 "[ . 1 . 2]" 1
342 1 19 LYS HB2 1 78 PHE QE . . 4.560 2.711 2.340 3.007 . 0 0 "[ . 1 . 2]" 1
343 1 19 LYS HB3 1 20 CYS H . . 4.380 3.625 3.380 4.058 . 0 0 "[ . 1 . 2]" 1
344 1 19 LYS HB3 1 76 ILE MG . . 4.850 3.577 3.328 3.769 . 0 0 "[ . 1 . 2]" 1
345 1 19 LYS HB3 1 78 PHE QD . . 3.990 2.578 2.229 2.984 . 0 0 "[ . 1 . 2]" 1
346 1 19 LYS HB3 1 78 PHE QE . . 4.810 2.935 2.612 3.376 . 0 0 "[ . 1 . 2]" 1
347 1 19 LYS QE 1 19 LYS HG3 . . 3.680 2.128 1.972 2.454 . 0 0 "[ . 1 . 2]" 1
348 1 19 LYS QE 1 76 ILE H . . 5.110 4.266 3.787 4.816 . 0 0 "[ . 1 . 2]" 1
349 1 19 LYS QE 1 76 ILE HB . . 4.040 2.977 2.523 3.523 . 0 0 "[ . 1 . 2]" 1
350 1 19 LYS QE 1 76 ILE MD . . 4.290 3.958 3.614 4.156 . 0 0 "[ . 1 . 2]" 1
351 1 19 LYS QE 1 76 ILE MG . . 4.340 2.197 1.879 3.351 . 0 0 "[ . 1 . 2]" 1
352 1 19 LYS HG3 1 76 ILE HB . . 4.770 4.266 3.917 4.867 0.097 4 0 "[ . 1 . 2]" 1
353 1 19 LYS HG3 1 76 ILE MG . . 3.810 2.684 2.264 3.366 . 0 0 "[ . 1 . 2]" 1
354 1 19 LYS HG3 1 78 PHE QD . . 4.700 3.869 3.503 4.310 . 0 0 "[ . 1 . 2]" 1
355 1 20 CYS H 1 20 CYS HB2 . . 3.270 2.223 2.067 2.631 . 0 0 "[ . 1 . 2]" 1
356 1 20 CYS H 1 20 CYS HB3 . . 3.360 2.960 2.381 3.391 0.031 1 0 "[ . 1 . 2]" 1
357 1 20 CYS H 1 21 GLY H . . 3.650 3.146 2.825 3.244 . 0 0 "[ . 1 . 2]" 1
358 1 20 CYS H 1 32 VAL MG2 . . 4.540 3.405 3.054 3.901 . 0 0 "[ . 1 . 2]" 1
359 1 20 CYS HA 1 20 CYS HG . . 3.700 2.931 2.089 3.674 . 0 0 "[ . 1 . 2]" 1
360 1 20 CYS HA 1 23 ALA H . . 4.340 3.457 3.195 3.822 . 0 0 "[ . 1 . 2]" 1
361 1 20 CYS HA 1 23 ALA MB . . 3.560 2.773 2.350 3.198 . 0 0 "[ . 1 . 2]" 1
362 1 20 CYS HA 1 32 VAL MG2 . . 4.530 3.825 3.027 4.282 . 0 0 "[ . 1 . 2]" 1
363 1 20 CYS HA 1 78 PHE HB3 . . 4.300 3.880 3.497 4.212 . 0 0 "[ . 1 . 2]" 1
364 1 20 CYS HA 1 78 PHE QD . . 4.330 2.653 2.055 3.360 . 0 0 "[ . 1 . 2]" 1
365 1 20 CYS HA 1 80 ILE MD . . 4.100 3.971 3.530 4.141 0.041 18 0 "[ . 1 . 2]" 1
366 1 20 CYS HB2 1 21 GLY H . . 4.070 3.287 2.705 3.811 . 0 0 "[ . 1 . 2]" 1
367 1 20 CYS HB2 1 30 VAL QG . . 4.680 3.980 3.212 4.472 . 0 0 "[ . 1 . 2]" 1
368 1 20 CYS HB2 1 32 VAL MG2 . . 3.410 2.138 1.802 2.655 . 0 0 "[ . 1 . 2]" 1
369 1 20 CYS HB2 1 78 PHE QE . . 4.800 3.368 2.421 4.118 . 0 0 "[ . 1 . 2]" 1
370 1 20 CYS HB3 1 21 GLY H . . 3.660 2.214 2.007 2.582 . 0 0 "[ . 1 . 2]" 1
371 1 20 CYS HB3 1 30 VAL H . . 4.740 2.982 2.306 3.820 . 0 0 "[ . 1 . 2]" 1
372 1 20 CYS HB3 1 30 VAL HB . . 4.470 2.870 1.998 4.605 0.135 8 0 "[ . 1 . 2]" 1
373 1 20 CYS HB3 1 30 VAL QG . . 4.360 2.888 1.852 3.775 . 0 0 "[ . 1 . 2]" 1
374 1 20 CYS HB3 1 32 VAL MG2 . . 3.750 3.260 2.548 3.566 . 0 0 "[ . 1 . 2]" 1
375 1 20 CYS HG 1 30 VAL HB . . 4.490 3.786 2.800 4.602 0.112 17 0 "[ . 1 . 2]" 1
376 1 20 CYS HG 1 30 VAL QG . . 4.540 3.121 1.866 4.120 . 0 0 "[ . 1 . 2]" 1
377 1 20 CYS HG 1 80 ILE MD . . 4.270 3.961 3.173 4.289 0.019 20 0 "[ . 1 . 2]" 1
378 1 21 GLY H 1 22 GLU H . . 3.650 2.870 2.742 2.955 . 0 0 "[ . 1 . 2]" 1
379 1 21 GLY H 1 24 LEU QD . . 5.050 4.192 3.942 4.456 . 0 0 "[ . 1 . 2]" 1
380 1 21 GLY H 1 29 ALA HA . . 4.220 3.236 2.944 3.541 . 0 0 "[ . 1 . 2]" 1
381 1 21 GLY H 1 30 VAL HB . . 4.380 3.198 2.573 4.570 0.190 20 0 "[ . 1 . 2]" 1
382 1 21 GLY H 1 30 VAL QG . . 4.200 2.582 1.822 3.214 . 0 0 "[ . 1 . 2]" 1
383 1 21 GLY HA2 1 24 LEU H . . 4.580 3.506 3.388 3.681 . 0 0 "[ . 1 . 2]" 1
384 1 21 GLY HA2 1 24 LEU HB2 . . 4.250 3.151 2.663 3.420 . 0 0 "[ . 1 . 2]" 1
385 1 21 GLY HA2 1 24 LEU HB3 . . 5.220 4.843 4.270 5.130 . 0 0 "[ . 1 . 2]" 1
386 1 21 GLY HA2 1 24 LEU QD . . 3.930 2.782 2.472 3.003 . 0 0 "[ . 1 . 2]" 1
387 1 21 GLY HA2 1 26 LEU HB2 . . 4.620 3.156 2.811 3.633 . 0 0 "[ . 1 . 2]" 1
388 1 21 GLY HA2 1 26 LEU HB3 . . 5.270 4.734 4.354 5.250 . 0 0 "[ . 1 . 2]" 1
389 1 21 GLY HA2 1 26 LEU MD1 . . 4.350 2.891 2.515 3.384 . 0 0 "[ . 1 . 2]" 1
390 1 21 GLY HA2 1 26 LEU HG . . 4.740 3.902 3.327 4.608 . 0 0 "[ . 1 . 2]" 1
391 1 21 GLY HA2 1 29 ALA HA . . 4.790 4.764 4.492 4.852 0.062 7 0 "[ . 1 . 2]" 1
392 1 21 GLY HA2 1 30 VAL H . . 5.030 4.621 3.981 5.089 0.059 7 0 "[ . 1 . 2]" 1
393 1 21 GLY HA2 1 30 VAL HB . . 3.870 3.253 2.564 4.043 0.173 8 0 "[ . 1 . 2]" 1
394 1 21 GLY HA2 1 30 VAL QG . . 3.290 2.015 1.827 2.299 . 0 0 "[ . 1 . 2]" 1
395 1 21 GLY HA3 1 24 LEU HB2 . . 4.740 4.652 4.204 4.790 0.050 18 0 "[ . 1 . 2]" 1
396 1 21 GLY HA3 1 24 LEU QD . . 4.430 4.215 3.929 4.376 . 0 0 "[ . 1 . 2]" 1
397 1 21 GLY HA3 1 26 LEU HB2 . . 4.600 2.897 2.420 3.457 . 0 0 "[ . 1 . 2]" 1
398 1 21 GLY HA3 1 26 LEU MD1 . . 4.820 3.506 3.086 3.876 . 0 0 "[ . 1 . 2]" 1
399 1 21 GLY HA3 1 29 ALA HA . . 3.970 3.295 2.962 3.408 . 0 0 "[ . 1 . 2]" 1
400 1 21 GLY HA3 1 30 VAL HB . . 4.100 3.725 3.257 4.215 0.115 20 0 "[ . 1 . 2]" 1
401 1 21 GLY HA3 1 30 VAL QG . . 3.480 2.102 1.952 2.351 . 0 0 "[ . 1 . 2]" 1
402 1 22 GLU H 1 22 GLU HB2 . . 3.460 2.120 2.020 3.310 . 0 0 "[ . 1 . 2]" 1
403 1 22 GLU H 1 22 GLU HB3 . . 3.310 3.100 2.044 3.361 0.051 7 0 "[ . 1 . 2]" 1
404 1 22 GLU H 1 22 GLU HG2 . . 4.210 3.846 3.305 4.215 0.005 7 0 "[ . 1 . 2]" 1
405 1 22 GLU H 1 22 GLU HG3 . . 4.140 3.929 3.335 4.221 0.081 6 0 "[ . 1 . 2]" 1
406 1 22 GLU H 1 23 ALA H . . 3.230 2.679 2.339 2.925 . 0 0 "[ . 1 . 2]" 1
407 1 22 GLU HA 1 22 GLU HB2 . . 3.040 2.797 2.259 2.959 . 0 0 "[ . 1 . 2]" 1
408 1 22 GLU HA 1 22 GLU HG2 . . 3.600 2.140 1.963 3.714 0.114 6 0 "[ . 1 . 2]" 1
409 1 22 GLU HA 1 22 GLU HG3 . . 3.690 3.217 2.599 3.517 . 0 0 "[ . 1 . 2]" 1
410 1 22 GLU HA 1 24 LEU H . . 4.680 4.471 4.147 4.700 0.020 11 0 "[ . 1 . 2]" 1
411 1 22 GLU HA 1 25 GLY H . . 4.100 3.127 3.016 3.270 . 0 0 "[ . 1 . 2]" 1
412 1 22 GLU HA 1 26 LEU H . . 3.680 2.500 2.060 2.929 . 0 0 "[ . 1 . 2]" 1
413 1 22 GLU HB3 1 23 ALA H . . 3.620 3.042 2.616 3.461 . 0 0 "[ . 1 . 2]" 1
414 1 23 ALA H 1 23 ALA MB . . 2.900 2.079 1.932 2.155 . 0 0 "[ . 1 . 2]" 1
415 1 23 ALA H 1 24 LEU H . . 3.260 2.804 2.638 2.938 . 0 0 "[ . 1 . 2]" 1
416 1 23 ALA H 1 24 LEU QD . . 4.610 3.673 3.395 4.064 . 0 0 "[ . 1 . 2]" 1
417 1 23 ALA H 1 25 GLY H . . 4.290 3.684 3.547 3.844 . 0 0 "[ . 1 . 2]" 1
418 1 23 ALA HA 1 25 GLY H . . 3.880 3.817 3.533 3.904 0.024 19 0 "[ . 1 . 2]" 1
419 1 23 ALA MB 1 24 LEU H . . 3.270 2.452 2.231 2.775 . 0 0 "[ . 1 . 2]" 1
420 1 23 ALA MB 1 24 LEU QD . . 2.490 2.320 1.986 2.622 0.132 18 0 "[ . 1 . 2]" 1
421 1 23 ALA MB 1 78 PHE H . . 3.980 3.762 3.517 4.002 0.022 11 0 "[ . 1 . 2]" 1
422 1 23 ALA MB 1 78 PHE HA . . 4.510 4.324 3.958 4.517 0.007 9 0 "[ . 1 . 2]" 1
423 1 23 ALA MB 1 78 PHE HB2 . . 3.130 2.158 1.984 2.371 . 0 0 "[ . 1 . 2]" 1
424 1 23 ALA MB 1 78 PHE HB3 . . 3.450 2.240 1.941 2.625 . 0 0 "[ . 1 . 2]" 1
425 1 23 ALA MB 1 78 PHE QD . . 4.320 3.137 2.473 3.706 . 0 0 "[ . 1 . 2]" 1
426 1 23 ALA MB 1 80 ILE MD . . 2.730 2.417 1.973 2.751 0.021 18 0 "[ . 1 . 2]" 1
427 1 23 ALA MB 1 80 ILE HG12 . . 4.520 3.032 1.960 3.699 . 0 0 "[ . 1 . 2]" 1
428 1 23 ALA MB 1 80 ILE HG13 . . 3.810 2.129 1.789 2.472 . 0 0 "[ . 1 . 2]" 1
429 1 23 ALA MB 1 80 ILE MG . . 4.320 4.015 3.586 4.292 . 0 0 "[ . 1 . 2]" 1
430 1 24 LEU H 1 24 LEU HB2 . . 3.400 2.344 2.241 2.427 . 0 0 "[ . 1 . 2]" 1
431 1 24 LEU H 1 24 LEU HB3 . . 3.830 3.528 3.493 3.550 . 0 0 "[ . 1 . 2]" 1
432 1 24 LEU H 1 24 LEU QD . . 3.700 2.061 1.816 2.326 . 0 0 "[ . 1 . 2]" 1
433 1 24 LEU H 1 24 LEU HG . . 3.890 3.394 2.735 3.895 0.005 3 0 "[ . 1 . 2]" 1
434 1 24 LEU H 1 25 GLY H . . 3.350 2.530 2.424 2.620 . 0 0 "[ . 1 . 2]" 1
435 1 24 LEU HA 1 24 LEU HB3 . . 2.930 2.513 2.461 2.579 . 0 0 "[ . 1 . 2]" 1
436 1 24 LEU HA 1 24 LEU QD . . 2.960 2.388 1.903 2.978 0.018 18 0 "[ . 1 . 2]" 1
437 1 24 LEU HA 1 24 LEU HG . . 4.110 3.202 2.401 3.744 . 0 0 "[ . 1 . 2]" 1
438 1 24 LEU HB2 1 24 LEU QD . . 3.240 2.165 1.968 2.375 . 0 0 "[ . 1 . 2]" 1
439 1 24 LEU HB2 1 25 GLY H . . 4.670 3.342 3.187 3.540 . 0 0 "[ . 1 . 2]" 1
440 1 24 LEU HB2 1 26 LEU H . . 4.630 3.949 3.230 4.613 . 0 0 "[ . 1 . 2]" 1
441 1 24 LEU HB2 1 26 LEU MD1 . . 3.910 2.594 2.142 2.797 . 0 0 "[ . 1 . 2]" 1
442 1 24 LEU HB2 1 26 LEU HG . . 4.140 2.658 2.490 2.856 . 0 0 "[ . 1 . 2]" 1
443 1 24 LEU HB3 1 25 GLY H . . 4.210 4.141 3.915 4.240 0.030 14 0 "[ . 1 . 2]" 1
444 1 24 LEU HB3 1 26 LEU MD1 . . 4.020 3.205 2.318 3.816 . 0 0 "[ . 1 . 2]" 1
445 1 24 LEU HB3 1 26 LEU HG . . 4.110 3.211 2.824 3.663 . 0 0 "[ . 1 . 2]" 1
446 1 24 LEU QD 1 83 PRO HA . . 3.600 3.052 2.619 3.499 . 0 0 "[ . 1 . 2]" 1
447 1 24 LEU QD 1 83 PRO HB2 . . 3.700 2.776 2.203 3.022 . 0 0 "[ . 1 . 2]" 1
448 1 24 LEU QD 1 83 PRO HB3 . . 3.470 2.558 2.135 2.887 . 0 0 "[ . 1 . 2]" 1
449 1 24 LEU QD 1 83 PRO HG2 . . 4.820 4.511 4.141 4.679 . 0 0 "[ . 1 . 2]" 1
450 1 24 LEU QD 1 83 PRO HG3 . . 4.750 4.257 3.843 4.538 . 0 0 "[ . 1 . 2]" 1
451 1 24 LEU QD 1 86 PHE QB . . 3.620 2.295 1.963 2.699 . 0 0 "[ . 1 . 2]" 1
452 1 24 LEU QD 1 86 PHE QD . . 3.770 2.233 1.971 2.859 . 0 0 "[ . 1 . 2]" 1
453 1 24 LEU QD 1 86 PHE QE . . 4.720 3.032 2.388 3.870 . 0 0 "[ . 1 . 2]" 1
454 1 24 LEU HG 1 86 PHE QB . . 4.390 3.722 2.696 4.418 0.028 11 0 "[ . 1 . 2]" 1
455 1 25 GLY H 1 26 LEU H . . 3.160 2.390 2.064 2.788 . 0 0 "[ . 1 . 2]" 1
456 1 25 GLY H 1 26 LEU HG . . 4.740 3.701 3.537 3.913 . 0 0 "[ . 1 . 2]" 1
457 1 26 LEU H 1 26 LEU HB2 . . 3.520 2.638 2.466 2.802 . 0 0 "[ . 1 . 2]" 1
458 1 26 LEU H 1 26 LEU HB3 . . 3.980 3.735 3.625 3.839 . 0 0 "[ . 1 . 2]" 1
459 1 26 LEU H 1 26 LEU MD1 . . 4.670 3.954 3.632 4.206 . 0 0 "[ . 1 . 2]" 1
460 1 26 LEU H 1 26 LEU MD2 . . 3.770 3.685 3.503 3.769 . 0 0 "[ . 1 . 2]" 1
461 1 26 LEU H 1 26 LEU HG . . 3.330 2.805 2.372 3.121 . 0 0 "[ . 1 . 2]" 1
462 1 26 LEU HA 1 26 LEU MD1 . . 4.710 3.903 3.859 3.992 . 0 0 "[ . 1 . 2]" 1
463 1 26 LEU HA 1 26 LEU MD2 . . 2.900 2.077 1.960 2.381 . 0 0 "[ . 1 . 2]" 1
464 1 26 LEU HA 1 27 LYS H . . 3.210 2.507 2.431 2.549 . 0 0 "[ . 1 . 2]" 1
465 1 26 LEU HA 1 28 GLN H . . 4.590 3.965 3.832 4.118 . 0 0 "[ . 1 . 2]" 1
466 1 26 LEU HB2 1 26 LEU MD1 . . 3.240 2.247 2.064 2.352 . 0 0 "[ . 1 . 2]" 1
467 1 26 LEU HB2 1 27 LYS H . . 4.500 3.507 3.255 3.729 . 0 0 "[ . 1 . 2]" 1
468 1 26 LEU HB2 1 28 GLN H . . 3.730 2.818 2.565 3.154 . 0 0 "[ . 1 . 2]" 1
469 1 26 LEU HB2 1 28 GLN QG . . 4.300 2.905 2.324 3.272 . 0 0 "[ . 1 . 2]" 1
470 1 26 LEU HB3 1 26 LEU MD2 . . 3.200 2.392 2.230 2.449 . 0 0 "[ . 1 . 2]" 1
471 1 26 LEU HB3 1 27 LYS H . . 3.730 2.431 2.337 2.565 . 0 0 "[ . 1 . 2]" 1
472 1 26 LEU HB3 1 27 LYS HA . . 5.190 4.723 4.656 4.823 . 0 0 "[ . 1 . 2]" 1
473 1 26 LEU HB3 1 28 GLN H . . 3.540 2.554 2.380 2.969 . 0 0 "[ . 1 . 2]" 1
474 1 26 LEU HB3 1 28 GLN HB3 . . 4.780 4.673 4.400 4.792 0.012 13 0 "[ . 1 . 2]" 1
475 1 26 LEU HB3 1 28 GLN QG . . 3.850 2.441 2.173 2.878 . 0 0 "[ . 1 . 2]" 1
476 1 26 LEU MD1 1 28 GLN H . . 3.920 3.924 3.902 3.959 0.039 17 0 "[ . 1 . 2]" 1
477 1 26 LEU MD1 1 28 GLN HE21 . . 4.520 3.013 2.050 4.081 . 0 0 "[ . 1 . 2]" 1
478 1 26 LEU MD1 1 28 GLN HE22 . . 4.770 3.872 2.597 4.772 0.002 11 0 "[ . 1 . 2]" 1
479 1 26 LEU MD1 1 28 GLN QG . . 3.510 2.704 2.477 2.872 . 0 0 "[ . 1 . 2]" 1
480 1 26 LEU MD2 1 27 LYS H . . 4.050 3.610 3.468 3.896 . 0 0 "[ . 1 . 2]" 1
481 1 26 LEU MD2 1 28 GLN H . . 4.770 4.494 4.303 4.768 . 0 0 "[ . 1 . 2]" 1
482 1 26 LEU HG 1 27 LYS H . . 5.120 4.948 4.903 4.996 . 0 0 "[ . 1 . 2]" 1
483 1 27 LYS H 1 27 LYS HB2 . . 4.190 2.396 2.205 3.643 . 0 0 "[ . 1 . 2]" 1
484 1 27 LYS H 1 27 LYS HB3 . . 3.540 3.405 2.712 3.636 0.096 1 0 "[ . 1 . 2]" 1
485 1 27 LYS H 1 27 LYS HG2 . . 4.420 3.872 1.984 4.427 0.007 5 0 "[ . 1 . 2]" 1
486 1 27 LYS H 1 27 LYS HG3 . . 4.480 3.734 3.092 4.482 0.002 3 0 "[ . 1 . 2]" 1
487 1 27 LYS H 1 28 GLN H . . 3.770 2.347 2.056 2.508 . 0 0 "[ . 1 . 2]" 1
488 1 27 LYS HA 1 27 LYS QD . . 4.520 3.443 2.143 4.302 . 0 0 "[ . 1 . 2]" 1
489 1 27 LYS HA 1 27 LYS HG2 . . 3.870 2.305 1.928 3.653 . 0 0 "[ . 1 . 2]" 1
490 1 27 LYS HA 1 27 LYS HG3 . . 3.670 3.104 2.130 3.812 0.142 19 0 "[ . 1 . 2]" 1
491 1 27 LYS HA 1 28 GLN H . . 3.430 3.196 3.035 3.416 . 0 0 "[ . 1 . 2]" 1
492 1 27 LYS HB2 1 27 LYS QE . . 4.580 3.681 2.757 4.312 . 0 0 "[ . 1 . 2]" 1
493 1 27 LYS HB2 1 28 GLN H . . 4.750 4.024 3.480 4.459 . 0 0 "[ . 1 . 2]" 1
494 1 27 LYS HB2 1 28 GLN HA . . 5.110 5.224 4.815 5.641 0.531 3 1 "[ + . 1 . 2]" 1
495 1 27 LYS HB3 1 28 GLN H . . 4.780 4.272 4.029 4.489 . 0 0 "[ . 1 . 2]" 1
496 1 27 LYS QD 1 27 LYS HG2 . . 2.700 2.362 2.179 2.562 . 0 0 "[ . 1 . 2]" 1
497 1 27 LYS QD 1 27 LYS HG3 . . 2.640 2.396 2.179 2.571 . 0 0 "[ . 1 . 2]" 1
498 1 28 GLN H 1 28 GLN HB2 . . 3.850 3.728 3.555 3.853 0.003 13 0 "[ . 1 . 2]" 1
499 1 28 GLN H 1 28 GLN HB3 . . 3.700 3.187 2.749 3.445 . 0 0 "[ . 1 . 2]" 1
500 1 28 GLN H 1 28 GLN QG . . 3.710 2.027 1.910 2.257 . 0 0 "[ . 1 . 2]" 1
501 1 28 GLN HA 1 28 GLN QG . . 3.690 3.350 3.250 3.442 . 0 0 "[ . 1 . 2]" 1
502 1 28 GLN HA 1 29 ALA H . . 2.800 2.694 2.566 2.752 . 0 0 "[ . 1 . 2]" 1
503 1 28 GLN HA 1 29 ALA MB . . 4.030 3.998 3.939 4.042 0.012 3 0 "[ . 1 . 2]" 1
504 1 28 GLN HB2 1 29 ALA H . . 3.820 2.120 2.021 2.312 . 0 0 "[ . 1 . 2]" 1
505 1 28 GLN HB2 1 30 VAL QG . . 4.710 4.484 4.203 4.658 . 0 0 "[ . 1 . 2]" 1
506 1 28 GLN HB3 1 29 ALA H . . 3.640 3.553 3.300 3.648 0.008 13 0 "[ . 1 . 2]" 1
507 1 28 GLN QG 1 29 ALA H . . 4.180 3.324 2.792 3.905 . 0 0 "[ . 1 . 2]" 1
508 1 28 GLN QG 1 29 ALA MB . . 5.050 4.541 4.124 5.086 0.036 18 0 "[ . 1 . 2]" 1
509 1 28 GLN QG 1 30 VAL QG . . 4.140 3.019 2.537 3.993 . 0 0 "[ . 1 . 2]" 1
510 1 29 ALA H 1 29 ALA MB . . 2.770 2.193 2.079 2.341 . 0 0 "[ . 1 . 2]" 1
511 1 29 ALA HA 1 30 VAL H . . 2.830 2.405 2.260 2.545 . 0 0 "[ . 1 . 2]" 1
512 1 29 ALA HA 1 30 VAL HB . . 4.710 4.560 4.426 4.727 0.017 8 0 "[ . 1 . 2]" 1
513 1 29 ALA HA 1 30 VAL QG . . 4.270 3.117 2.954 3.318 . 0 0 "[ . 1 . 2]" 1
514 1 29 ALA MB 1 30 VAL H . . 3.180 2.720 2.486 2.951 . 0 0 "[ . 1 . 2]" 1
515 1 29 ALA MB 1 30 VAL HA . . 4.860 3.888 3.760 4.046 . 0 0 "[ . 1 . 2]" 1
516 1 30 VAL H 1 30 VAL HB . . 3.600 3.049 2.726 3.686 0.086 20 0 "[ . 1 . 2]" 1
517 1 30 VAL H 1 30 VAL QG . . 3.620 2.668 2.060 2.952 . 0 0 "[ . 1 . 2]" 1
518 1 30 VAL HA 1 30 VAL QG . . 2.950 2.190 2.067 2.470 . 0 0 "[ . 1 . 2]" 1
519 1 30 VAL HA 1 31 LYS H . . 2.750 2.187 2.182 2.195 . 0 0 "[ . 1 . 2]" 1
520 1 30 VAL HA 1 31 LYS HB2 . . 5.000 4.185 4.173 4.198 . 0 0 "[ . 1 . 2]" 1
521 1 30 VAL HA 1 31 LYS HB3 . . 4.970 5.155 5.128 5.202 0.232 4 0 "[ . 1 . 2]" 1
522 1 30 VAL HB 1 31 LYS H . . 4.180 4.249 4.153 4.311 0.131 11 0 "[ . 1 . 2]" 1
523 1 30 VAL QG 1 31 LYS H . . 3.590 2.806 2.511 2.991 . 0 0 "[ . 1 . 2]" 1
524 1 30 VAL QG 1 31 LYS HA . . 4.650 4.278 4.065 4.462 . 0 0 "[ . 1 . 2]" 1
525 1 30 VAL QG 1 31 LYS HB2 . . 4.920 3.988 3.800 4.145 . 0 0 "[ . 1 . 2]" 1
526 1 30 VAL QG 1 31 LYS HB3 . . 5.330 4.094 3.926 4.247 . 0 0 "[ . 1 . 2]" 1
527 1 30 VAL QG 1 32 VAL HA . . 4.670 4.316 3.719 4.590 . 0 0 "[ . 1 . 2]" 1
528 1 30 VAL QG 1 33 PRO HD3 . . 4.290 3.694 3.101 4.080 . 0 0 "[ . 1 . 2]" 1
529 1 30 VAL QG 1 86 PHE QD . . 3.930 3.402 3.093 3.692 . 0 0 "[ . 1 . 2]" 1
530 1 30 VAL QG 1 86 PHE QE . . 4.110 3.844 3.577 4.036 . 0 0 "[ . 1 . 2]" 1
531 1 30 VAL QG 1 89 ALA MB . . 3.460 3.242 2.953 3.418 . 0 0 "[ . 1 . 2]" 1
532 1 30 VAL QG 1 90 ILE H . . 5.190 3.730 3.393 4.088 . 0 0 "[ . 1 . 2]" 1
533 1 30 VAL QG 1 90 ILE HA . . 3.090 2.461 1.863 3.009 . 0 0 "[ . 1 . 2]" 1
534 1 30 VAL QG 1 93 SER QB . . 3.790 2.965 2.083 3.439 . 0 0 "[ . 1 . 2]" 1
535 1 31 LYS H 1 31 LYS HB2 . . 3.360 2.038 2.024 2.045 . 0 0 "[ . 1 . 2]" 1
536 1 31 LYS H 1 31 LYS HB3 . . 3.280 3.102 3.071 3.121 . 0 0 "[ . 1 . 2]" 1
537 1 31 LYS H 1 31 LYS QD . . 4.750 4.586 4.475 4.750 . 0 0 "[ . 1 . 2]" 1
538 1 31 LYS H 1 31 LYS HG2 . . 3.700 4.068 3.768 4.205 0.505 16 5 "[ *** 1 .+- 2]" 1
539 1 31 LYS H 1 31 LYS HG3 . . 4.160 3.904 3.758 4.193 0.033 9 0 "[ . 1 . 2]" 1
540 1 31 LYS H 1 93 SER QB . . 4.150 3.522 2.539 4.135 . 0 0 "[ . 1 . 2]" 1
541 1 31 LYS HA 1 31 LYS QD . . 4.450 3.572 2.792 4.028 . 0 0 "[ . 1 . 2]" 1
542 1 31 LYS HA 1 31 LYS HE3 . . 4.880 4.710 3.813 5.457 0.577 10 3 "[ . + * - 2]" 1
543 1 31 LYS HA 1 31 LYS HG2 . . 3.730 2.153 2.071 2.208 . 0 0 "[ . 1 . 2]" 1
544 1 31 LYS HA 1 31 LYS HG3 . . 3.910 2.942 2.710 3.431 . 0 0 "[ . 1 . 2]" 1
545 1 31 LYS HA 1 32 VAL H . . 2.830 2.266 2.177 2.432 . 0 0 "[ . 1 . 2]" 1
546 1 31 LYS HA 1 32 VAL HB . . 4.600 4.450 4.323 4.567 . 0 0 "[ . 1 . 2]" 1
547 1 31 LYS HA 1 32 VAL MG2 . . 4.060 3.688 3.282 3.877 . 0 0 "[ . 1 . 2]" 1
548 1 31 LYS HB2 1 32 VAL H . . 4.750 4.415 4.148 4.624 . 0 0 "[ . 1 . 2]" 1
549 1 31 LYS HB3 1 32 VAL H . . 4.820 3.701 3.220 4.081 . 0 0 "[ . 1 . 2]" 1
550 1 31 LYS QD 1 32 VAL H . . 4.460 3.600 1.921 4.471 0.011 12 0 "[ . 1 . 2]" 1
551 1 31 LYS HE3 1 31 LYS HG2 . . 4.130 3.117 2.139 4.133 0.003 10 0 "[ . 1 . 2]" 1
552 1 31 LYS HE3 1 31 LYS HG3 . . 3.570 2.881 2.015 4.050 0.480 6 0 "[ . 1 . 2]" 1
553 1 31 LYS HG2 1 32 VAL H . . 5.330 2.802 2.153 3.535 . 0 0 "[ . 1 . 2]" 1
554 1 31 LYS HG3 1 32 VAL H . . 4.860 4.263 3.797 4.864 0.004 2 0 "[ . 1 . 2]" 1
555 1 32 VAL H 1 32 VAL HB . . 3.400 2.324 2.154 2.543 . 0 0 "[ . 1 . 2]" 1
556 1 32 VAL H 1 32 VAL MG1 . . 4.180 3.691 3.594 3.806 . 0 0 "[ . 1 . 2]" 1
557 1 32 VAL H 1 32 VAL MG2 . . 2.990 2.576 2.256 2.905 . 0 0 "[ . 1 . 2]" 1
558 1 32 VAL HA 1 32 VAL MG1 . . 3.320 2.486 2.401 2.570 . 0 0 "[ . 1 . 2]" 1
559 1 32 VAL HA 1 32 VAL MG2 . . 3.290 2.271 2.154 2.434 . 0 0 "[ . 1 . 2]" 1
560 1 32 VAL HA 1 33 PRO HD2 . . 3.090 2.229 2.199 2.309 . 0 0 "[ . 1 . 2]" 1
561 1 32 VAL HA 1 33 PRO HD3 . . 3.050 2.014 1.940 2.068 . 0 0 "[ . 1 . 2]" 1
562 1 32 VAL HA 1 33 PRO HG2 . . 4.460 4.350 4.345 4.378 . 0 0 "[ . 1 . 2]" 1
563 1 32 VAL HA 1 37 PHE QE . . 4.980 3.863 3.595 4.179 . 0 0 "[ . 1 . 2]" 1
564 1 32 VAL HA 1 86 PHE QE . . 4.280 3.931 3.133 4.283 0.003 10 0 "[ . 1 . 2]" 1
565 1 32 VAL HB 1 34 PHE QE . . 3.970 2.705 1.983 3.312 . 0 0 "[ . 1 . 2]" 1
566 1 32 VAL HB 1 34 PHE HZ . . 4.580 3.746 3.444 3.965 . 0 0 "[ . 1 . 2]" 1
567 1 32 VAL MG1 1 33 PRO HA . . 4.600 4.091 3.999 4.159 . 0 0 "[ . 1 . 2]" 1
568 1 32 VAL MG1 1 33 PRO HD2 . . 3.420 2.660 2.133 2.859 . 0 0 "[ . 1 . 2]" 1
569 1 32 VAL MG1 1 33 PRO HD3 . . 3.910 3.647 3.263 3.759 . 0 0 "[ . 1 . 2]" 1
570 1 32 VAL MG1 1 33 PRO HG2 . . 4.480 4.369 3.929 4.520 0.040 19 0 "[ . 1 . 2]" 1
571 1 32 VAL MG1 1 34 PHE H . . 3.910 2.847 2.284 3.303 . 0 0 "[ . 1 . 2]" 1
572 1 32 VAL MG1 1 34 PHE HA . . 3.400 3.019 2.809 3.218 . 0 0 "[ . 1 . 2]" 1
573 1 32 VAL MG1 1 34 PHE QD . . 4.990 2.946 1.940 3.469 . 0 0 "[ . 1 . 2]" 1
574 1 32 VAL MG1 1 34 PHE QE . . 4.830 2.906 1.927 3.344 . 0 0 "[ . 1 . 2]" 1
575 1 32 VAL MG1 1 34 PHE HZ . . 5.050 3.440 3.144 4.205 . 0 0 "[ . 1 . 2]" 1
576 1 32 VAL MG1 1 37 PHE QD . . 4.000 3.346 3.074 3.585 . 0 0 "[ . 1 . 2]" 1
577 1 32 VAL MG1 1 37 PHE QE . . 3.180 2.734 1.944 3.200 0.020 9 0 "[ . 1 . 2]" 1
578 1 32 VAL MG1 1 37 PHE HZ . . 4.970 3.774 2.850 4.173 . 0 0 "[ . 1 . 2]" 1
579 1 32 VAL MG1 1 55 PHE QE . . 3.720 2.856 2.242 3.382 . 0 0 "[ . 1 . 2]" 1
580 1 32 VAL MG1 1 55 PHE HZ . . 3.190 2.087 1.932 2.399 . 0 0 "[ . 1 . 2]" 1
581 1 32 VAL MG1 1 78 PHE QE . . 3.840 2.687 2.172 3.296 . 0 0 "[ . 1 . 2]" 1
582 1 32 VAL MG2 1 33 PRO HD2 . . 3.790 3.764 3.475 3.957 0.167 11 0 "[ . 1 . 2]" 1
583 1 32 VAL MG2 1 34 PHE QE . . 4.590 3.867 2.942 4.306 . 0 0 "[ . 1 . 2]" 1
584 1 32 VAL MG2 1 34 PHE HZ . . 4.290 4.223 3.842 4.309 0.019 18 0 "[ . 1 . 2]" 1
585 1 32 VAL MG2 1 37 PHE QE . . 5.210 4.358 3.804 4.760 . 0 0 "[ . 1 . 2]" 1
586 1 32 VAL MG2 1 55 PHE QE . . 4.960 3.874 3.561 4.408 . 0 0 "[ . 1 . 2]" 1
587 1 32 VAL MG2 1 55 PHE HZ . . 3.890 3.063 2.703 3.826 . 0 0 "[ . 1 . 2]" 1
588 1 32 VAL MG2 1 78 PHE QE . . 3.730 2.232 1.803 2.652 . 0 0 "[ . 1 . 2]" 1
589 1 32 VAL MG2 1 78 PHE HZ . . 3.750 2.998 2.270 3.540 . 0 0 "[ . 1 . 2]" 1
590 1 33 PRO HA 1 34 PHE H . . 2.840 2.503 2.380 2.628 . 0 0 "[ . 1 . 2]" 1
591 1 33 PRO HA 1 34 PHE QD . . 4.430 4.241 3.863 4.446 0.016 17 0 "[ . 1 . 2]" 1
592 1 33 PRO HB2 1 36 LEU H . . 4.550 2.546 2.232 2.727 . 0 0 "[ . 1 . 2]" 1
593 1 33 PRO HB2 1 36 LEU HB2 . . 4.180 2.092 1.981 2.412 . 0 0 "[ . 1 . 2]" 1
594 1 33 PRO HB2 1 36 LEU QD . . 4.040 2.193 1.789 2.828 . 0 0 "[ . 1 . 2]" 1
595 1 33 PRO HB2 1 36 LEU HG . . 4.080 3.051 2.330 4.132 0.052 14 0 "[ . 1 . 2]" 1
596 1 33 PRO HB2 1 37 PHE QE . . 4.740 4.311 3.814 4.679 . 0 0 "[ . 1 . 2]" 1
597 1 33 PRO HB2 1 89 ALA MB . . 4.280 4.040 3.670 4.290 0.010 19 0 "[ . 1 . 2]" 1
598 1 33 PRO HB3 1 34 PHE H . . 4.580 4.661 4.586 4.721 0.141 9 0 "[ . 1 . 2]" 1
599 1 33 PRO HB3 1 36 LEU H . . 4.590 4.024 3.757 4.259 . 0 0 "[ . 1 . 2]" 1
600 1 33 PRO HB3 1 36 LEU HB2 . . 4.500 3.803 3.650 4.119 . 0 0 "[ . 1 . 2]" 1
601 1 33 PRO HB3 1 89 ALA MB . . 3.680 2.896 2.408 3.340 . 0 0 "[ . 1 . 2]" 1
602 1 33 PRO HD2 1 36 LEU HB2 . . 4.660 4.471 4.185 4.681 0.021 1 0 "[ . 1 . 2]" 1
603 1 33 PRO HD2 1 36 LEU QD . . 5.170 4.270 3.947 4.612 . 0 0 "[ . 1 . 2]" 1
604 1 33 PRO HD2 1 37 PHE QD . . 4.690 3.853 3.633 4.106 . 0 0 "[ . 1 . 2]" 1
605 1 33 PRO HD2 1 37 PHE QE . . 3.360 2.078 1.985 2.428 . 0 0 "[ . 1 . 2]" 1
606 1 33 PRO HD2 1 86 PHE QE . . 4.700 2.854 2.170 3.315 . 0 0 "[ . 1 . 2]" 1
607 1 33 PRO HD2 1 86 PHE HZ . . 3.810 2.753 2.076 3.084 . 0 0 "[ . 1 . 2]" 1
608 1 33 PRO HD3 1 36 LEU QD . . 5.270 4.488 4.177 4.818 . 0 0 "[ . 1 . 2]" 1
609 1 33 PRO HD3 1 37 PHE QE . . 4.670 3.790 3.605 4.140 . 0 0 "[ . 1 . 2]" 1
610 1 33 PRO HD3 1 86 PHE QE . . 3.580 3.043 2.471 3.486 . 0 0 "[ . 1 . 2]" 1
611 1 33 PRO HD3 1 86 PHE HZ . . 5.220 3.994 3.400 4.556 . 0 0 "[ . 1 . 2]" 1
612 1 33 PRO HD3 1 89 ALA MB . . 4.320 3.677 2.760 4.118 . 0 0 "[ . 1 . 2]" 1
613 1 33 PRO HG2 1 36 LEU HB2 . . 4.540 2.725 2.385 2.971 . 0 0 "[ . 1 . 2]" 1
614 1 33 PRO HG2 1 36 LEU HB3 . . 4.790 3.794 3.443 4.090 . 0 0 "[ . 1 . 2]" 1
615 1 33 PRO HG2 1 36 LEU QD . . 3.700 2.370 1.958 2.814 . 0 0 "[ . 1 . 2]" 1
616 1 33 PRO HG2 1 37 PHE QD . . 4.540 3.849 3.476 4.341 . 0 0 "[ . 1 . 2]" 1
617 1 33 PRO HG2 1 37 PHE QE . . 3.770 2.831 2.188 3.285 . 0 0 "[ . 1 . 2]" 1
618 1 33 PRO HG2 1 86 PHE QD . . 5.040 3.888 3.518 4.111 . 0 0 "[ . 1 . 2]" 1
619 1 33 PRO HG2 1 86 PHE QE . . 4.970 2.866 2.489 3.175 . 0 0 "[ . 1 . 2]" 1
620 1 33 PRO HG2 1 86 PHE HZ . . 5.000 2.729 2.332 3.179 . 0 0 "[ . 1 . 2]" 1
621 1 33 PRO HG3 1 36 LEU QD . . 4.130 2.762 2.319 3.183 . 0 0 "[ . 1 . 2]" 1
622 1 33 PRO HG3 1 37 PHE QE . . 4.590 4.230 3.691 4.611 0.021 11 0 "[ . 1 . 2]" 1
623 1 33 PRO HG3 1 86 PHE QE . . 4.240 3.318 2.829 3.860 . 0 0 "[ . 1 . 2]" 1
624 1 33 PRO HG3 1 86 PHE HZ . . 5.010 3.906 3.442 4.530 . 0 0 "[ . 1 . 2]" 1
625 1 33 PRO HG3 1 89 ALA MB . . 4.080 2.670 2.174 2.997 . 0 0 "[ . 1 . 2]" 1
626 1 34 PHE H 1 34 PHE HB2 . . 3.880 2.348 2.295 2.442 . 0 0 "[ . 1 . 2]" 1
627 1 34 PHE H 1 34 PHE HB3 . . 3.560 3.486 3.459 3.513 . 0 0 "[ . 1 . 2]" 1
628 1 34 PHE H 1 34 PHE QD . . 3.510 2.281 2.033 2.458 . 0 0 "[ . 1 . 2]" 1
629 1 34 PHE H 1 35 ALA H . . 4.350 2.935 2.773 3.042 . 0 0 "[ . 1 . 2]" 1
630 1 34 PHE HA 1 34 PHE QD . . 3.440 2.767 1.969 2.987 . 0 0 "[ . 1 . 2]" 1
631 1 34 PHE HA 1 37 PHE H . . 4.020 3.255 3.032 3.466 . 0 0 "[ . 1 . 2]" 1
632 1 34 PHE HA 1 37 PHE QB . . 3.670 2.548 2.422 2.761 . 0 0 "[ . 1 . 2]" 1
633 1 34 PHE HA 1 37 PHE QD . . 3.220 2.503 2.013 2.909 . 0 0 "[ . 1 . 2]" 1
634 1 34 PHE HA 1 37 PHE QE . . 4.560 4.275 3.849 4.570 0.010 5 0 "[ . 1 . 2]" 1
635 1 34 PHE HA 1 55 PHE QE . . 4.710 3.982 3.495 4.582 . 0 0 "[ . 1 . 2]" 1
636 1 34 PHE HB2 1 35 ALA H . . 5.000 2.777 2.464 3.076 . 0 0 "[ . 1 . 2]" 1
637 1 34 PHE HB3 1 35 ALA H . . 4.760 3.629 3.264 3.964 . 0 0 "[ . 1 . 2]" 1
638 1 34 PHE QD 1 55 PHE QE . . 4.970 4.042 3.323 4.668 . 0 0 "[ . 1 . 2]" 1
639 1 34 PHE QD 1 56 ARG HA . . 4.350 4.290 3.967 4.419 0.069 11 0 "[ . 1 . 2]" 1
640 1 34 PHE QD 1 57 ARG HG2 . . 4.930 4.347 3.782 4.777 . 0 0 "[ . 1 . 2]" 1
641 1 34 PHE QD 1 57 ARG HG3 . . 4.920 3.994 3.414 5.050 0.130 11 0 "[ . 1 . 2]" 1
642 1 34 PHE QE 1 55 PHE HZ . . 4.340 4.143 3.182 4.350 0.010 3 0 "[ . 1 . 2]" 1
643 1 34 PHE QE 1 56 ARG HA . . 4.770 3.943 3.499 4.852 0.082 11 0 "[ . 1 . 2]" 1
644 1 34 PHE QE 1 57 ARG HA . . 4.090 2.992 1.947 3.471 . 0 0 "[ . 1 . 2]" 1
645 1 34 PHE QE 1 57 ARG HG3 . . 5.030 3.658 2.837 4.542 . 0 0 "[ . 1 . 2]" 1
646 1 34 PHE QE 1 58 PRO HD3 . . 4.690 3.633 2.913 4.008 . 0 0 "[ . 1 . 2]" 1
647 1 34 PHE HZ 1 55 PHE HZ . . 5.190 4.955 4.399 5.213 0.023 11 0 "[ . 1 . 2]" 1
648 1 34 PHE HZ 1 57 ARG HA . . 3.970 3.132 2.799 3.566 . 0 0 "[ . 1 . 2]" 1
649 1 34 PHE HZ 1 58 PRO HD2 . . 4.170 3.935 3.566 4.173 0.003 20 0 "[ . 1 . 2]" 1
650 1 34 PHE HZ 1 58 PRO HD3 . . 4.030 2.789 2.399 3.162 . 0 0 "[ . 1 . 2]" 1
651 1 34 PHE HZ 1 58 PRO HG3 . . 4.750 4.198 3.701 4.750 . 0 0 "[ . 1 . 2]" 1
652 1 35 ALA H 1 35 ALA MB . . 3.430 2.033 1.937 2.179 . 0 0 "[ . 1 . 2]" 1
653 1 35 ALA H 1 36 LEU H . . 4.280 2.749 2.412 3.019 . 0 0 "[ . 1 . 2]" 1
654 1 35 ALA HA 1 37 PHE H . . 5.020 4.252 3.798 4.579 . 0 0 "[ . 1 . 2]" 1
655 1 35 ALA HA 1 38 GLU H . . 4.080 3.124 2.854 3.330 . 0 0 "[ . 1 . 2]" 1
656 1 35 ALA HA 1 38 GLU HB2 . . 3.410 3.138 2.047 4.267 0.857 18 6 "[ -** * 1 . + *]" 1
657 1 35 ALA HA 1 38 GLU HB3 . . 4.200 3.241 2.189 4.083 . 0 0 "[ . 1 . 2]" 1
658 1 35 ALA HA 1 38 GLU HG2 . . 3.700 3.170 1.994 4.355 0.655 11 2 "[ . - 1+ . 2]" 1
659 1 35 ALA HA 1 38 GLU HG3 . . 4.560 3.367 2.369 4.571 0.011 15 0 "[ . 1 . 2]" 1
660 1 35 ALA MB 1 36 LEU H . . 3.450 2.576 2.325 3.137 . 0 0 "[ . 1 . 2]" 1
661 1 35 ALA MB 1 36 LEU HA . . 4.590 3.748 3.630 3.975 . 0 0 "[ . 1 . 2]" 1
662 1 35 ALA MB 1 36 LEU QD . . 4.520 3.449 2.686 3.989 . 0 0 "[ . 1 . 2]" 1
663 1 35 ALA MB 1 37 PHE H . . 5.180 4.451 4.113 4.706 . 0 0 "[ . 1 . 2]" 1
664 1 35 ALA MB 1 38 GLU H . . 4.980 4.266 4.095 4.621 . 0 0 "[ . 1 . 2]" 1
665 1 36 LEU H 1 36 LEU HB2 . . 3.500 2.188 2.096 2.346 . 0 0 "[ . 1 . 2]" 1
666 1 36 LEU H 1 36 LEU HB3 . . 3.820 3.459 3.376 3.520 . 0 0 "[ . 1 . 2]" 1
667 1 36 LEU H 1 36 LEU QD . . 4.210 2.825 1.903 3.531 . 0 0 "[ . 1 . 2]" 1
668 1 36 LEU H 1 36 LEU HG . . 3.440 3.078 2.357 3.734 0.294 10 0 "[ . 1 . 2]" 1
669 1 36 LEU H 1 37 PHE H . . 3.220 2.724 2.268 2.932 . 0 0 "[ . 1 . 2]" 1
670 1 36 LEU H 1 37 PHE QB . . 4.690 4.546 4.089 4.693 0.003 15 0 "[ . 1 . 2]" 1
671 1 36 LEU H 1 37 PHE QD . . 3.860 3.611 3.073 3.852 . 0 0 "[ . 1 . 2]" 1
672 1 36 LEU HA 1 36 LEU QD . . 3.030 2.273 1.911 2.802 . 0 0 "[ . 1 . 2]" 1
673 1 36 LEU HA 1 36 LEU HG . . 3.980 2.651 2.205 3.038 . 0 0 "[ . 1 . 2]" 1
674 1 36 LEU HA 1 38 GLU H . . 4.560 4.068 3.651 4.581 0.021 5 0 "[ . 1 . 2]" 1
675 1 36 LEU HA 1 39 SER H . . 4.110 3.587 3.300 3.795 . 0 0 "[ . 1 . 2]" 1
676 1 36 LEU HA 1 39 SER HB2 . . 4.160 3.175 2.900 3.424 . 0 0 "[ . 1 . 2]" 1
677 1 36 LEU HA 1 39 SER HB3 . . 4.950 4.596 4.204 4.964 0.014 13 0 "[ . 1 . 2]" 1
678 1 36 LEU HA 1 40 PHE H . . 4.200 3.368 2.972 3.739 . 0 0 "[ . 1 . 2]" 1
679 1 36 LEU HA 1 40 PHE QD . . 3.640 2.491 1.984 2.956 . 0 0 "[ . 1 . 2]" 1
680 1 36 LEU HA 1 40 PHE QE . . 4.570 3.782 3.250 4.222 . 0 0 "[ . 1 . 2]" 1
681 1 36 LEU HB2 1 37 PHE H . . 4.020 2.936 2.753 3.175 . 0 0 "[ . 1 . 2]" 1
682 1 36 LEU HB2 1 37 PHE QD . . 4.030 3.162 2.871 3.340 . 0 0 "[ . 1 . 2]" 1
683 1 36 LEU HB2 1 37 PHE QE . . 4.790 3.942 3.640 4.174 . 0 0 "[ . 1 . 2]" 1
684 1 36 LEU HB2 1 40 PHE QD . . 5.030 4.662 3.933 5.036 0.006 13 0 "[ . 1 . 2]" 1
685 1 36 LEU HB3 1 37 PHE H . . 3.850 3.476 3.153 3.855 0.005 5 0 "[ . 1 . 2]" 1
686 1 36 LEU HB3 1 37 PHE QD . . 4.810 4.019 3.658 4.251 . 0 0 "[ . 1 . 2]" 1
687 1 36 LEU HB3 1 40 PHE QD . . 4.640 3.448 2.830 3.816 . 0 0 "[ . 1 . 2]" 1
688 1 36 LEU HB3 1 44 PHE QD . . 4.200 2.609 1.991 3.206 . 0 0 "[ . 1 . 2]" 1
689 1 36 LEU HB3 1 44 PHE QE . . 4.270 3.172 2.760 3.582 . 0 0 "[ . 1 . 2]" 1
690 1 36 LEU HB3 1 86 PHE QE . . 5.160 3.201 2.529 3.645 . 0 0 "[ . 1 . 2]" 1
691 1 36 LEU QD 1 39 SER HB2 . . 4.900 4.155 3.675 4.735 . 0 0 "[ . 1 . 2]" 1
692 1 36 LEU QD 1 40 PHE QD . . 3.490 2.369 1.945 3.180 . 0 0 "[ . 1 . 2]" 1
693 1 36 LEU QD 1 40 PHE QE . . 3.610 2.827 2.439 3.343 . 0 0 "[ . 1 . 2]" 1
694 1 36 LEU QD 1 44 PHE QD . . 4.520 3.314 2.867 3.620 . 0 0 "[ . 1 . 2]" 1
695 1 36 LEU QD 1 44 PHE QE . . 4.120 2.487 1.927 2.966 . 0 0 "[ . 1 . 2]" 1
696 1 36 LEU QD 1 44 PHE HZ . . 4.480 3.136 2.198 3.894 . 0 0 "[ . 1 . 2]" 1
697 1 36 LEU QD 1 85 MET HA . . 5.150 4.204 3.801 4.599 . 0 0 "[ . 1 . 2]" 1
698 1 36 LEU QD 1 85 MET QB . . 3.790 2.351 1.967 2.900 . 0 0 "[ . 1 . 2]" 1
699 1 36 LEU QD 1 85 MET ME . . 3.100 2.276 2.013 2.721 . 0 0 "[ . 1 . 2]" 1
700 1 36 LEU QD 1 86 PHE HA . . 3.710 2.652 2.219 3.076 . 0 0 "[ . 1 . 2]" 1
701 1 36 LEU QD 1 86 PHE QD . . 3.670 2.535 2.367 2.750 . 0 0 "[ . 1 . 2]" 1
702 1 36 LEU QD 1 86 PHE QE . . 4.920 2.680 2.128 3.105 . 0 0 "[ . 1 . 2]" 1
703 1 37 PHE H 1 37 PHE QB . . 3.350 2.199 2.084 2.278 . 0 0 "[ . 1 . 2]" 1
704 1 37 PHE H 1 38 GLU H . . 3.290 2.488 2.320 2.681 . 0 0 "[ . 1 . 2]" 1
705 1 37 PHE HA 1 37 PHE QD . . 3.590 3.093 3.002 3.167 . 0 0 "[ . 1 . 2]" 1
706 1 37 PHE HA 1 40 PHE H . . 4.520 3.649 3.322 4.053 . 0 0 "[ . 1 . 2]" 1
707 1 37 PHE HA 1 44 PHE H . . 4.910 3.736 3.595 3.873 . 0 0 "[ . 1 . 2]" 1
708 1 37 PHE HA 1 44 PHE HB2 . . 3.270 2.165 2.000 2.315 . 0 0 "[ . 1 . 2]" 1
709 1 37 PHE HA 1 44 PHE HB3 . . 3.660 3.557 3.319 3.670 0.010 18 0 "[ . 1 . 2]" 1
710 1 37 PHE HA 1 44 PHE QD . . 4.540 3.208 2.949 3.588 . 0 0 "[ . 1 . 2]" 1
711 1 37 PHE QB 1 38 GLU H . . 3.770 2.869 2.542 3.153 . 0 0 "[ . 1 . 2]" 1
712 1 37 PHE QB 1 44 PHE HB2 . . 5.170 3.821 3.628 4.094 . 0 0 "[ . 1 . 2]" 1
713 1 37 PHE QB 1 55 PHE QD . . 3.980 3.452 2.876 3.870 . 0 0 "[ . 1 . 2]" 1
714 1 37 PHE QB 1 55 PHE QE . . 4.330 3.434 2.818 4.164 . 0 0 "[ . 1 . 2]" 1
715 1 37 PHE QD 1 38 GLU H . . 4.270 4.203 3.945 4.327 0.057 16 0 "[ . 1 . 2]" 1
716 1 37 PHE QD 1 44 PHE HA . . 5.120 4.299 3.913 4.900 . 0 0 "[ . 1 . 2]" 1
717 1 37 PHE QD 1 44 PHE HB2 . . 4.130 3.206 2.884 3.575 . 0 0 "[ . 1 . 2]" 1
718 1 37 PHE QD 1 44 PHE HB3 . . 4.170 3.156 2.779 3.593 . 0 0 "[ . 1 . 2]" 1
719 1 37 PHE QD 1 45 TYR H . . 4.640 3.635 3.038 4.286 . 0 0 "[ . 1 . 2]" 1
720 1 37 PHE QD 1 45 TYR HA . . 3.200 2.043 1.993 2.169 . 0 0 "[ . 1 . 2]" 1
721 1 37 PHE QD 1 45 TYR HB2 . . 4.950 4.456 4.252 4.656 . 0 0 "[ . 1 . 2]" 1
722 1 37 PHE QD 1 45 TYR HB3 . . 4.830 3.868 3.654 4.138 . 0 0 "[ . 1 . 2]" 1
723 1 37 PHE QD 1 46 VAL H . . 5.000 3.919 3.469 4.114 . 0 0 "[ . 1 . 2]" 1
724 1 37 PHE QD 1 46 VAL MG2 . . 4.080 3.852 3.340 4.081 0.001 8 0 "[ . 1 . 2]" 1
725 1 37 PHE QD 1 55 PHE QD . . 4.130 3.494 2.575 4.099 . 0 0 "[ . 1 . 2]" 1
726 1 37 PHE QD 1 55 PHE QE . . 4.530 3.215 2.742 3.574 . 0 0 "[ . 1 . 2]" 1
727 1 37 PHE QE 1 44 PHE HA . . 4.720 3.720 3.399 4.292 . 0 0 "[ . 1 . 2]" 1
728 1 37 PHE QE 1 44 PHE HB2 . . 4.890 3.963 3.726 4.322 . 0 0 "[ . 1 . 2]" 1
729 1 37 PHE QE 1 44 PHE HB3 . . 4.120 2.870 2.539 3.248 . 0 0 "[ . 1 . 2]" 1
730 1 37 PHE QE 1 45 TYR H . . 3.970 2.689 2.214 3.179 . 0 0 "[ . 1 . 2]" 1
731 1 37 PHE QE 1 45 TYR HA . . 4.190 2.831 2.157 3.263 . 0 0 "[ . 1 . 2]" 1
732 1 37 PHE QE 1 46 VAL MG2 . . 3.570 2.826 2.090 3.231 . 0 0 "[ . 1 . 2]" 1
733 1 37 PHE QE 1 80 ILE MD . . 4.910 3.883 3.321 4.255 . 0 0 "[ . 1 . 2]" 1
734 1 37 PHE HZ 1 44 PHE HA . . 5.340 4.920 4.577 5.271 . 0 0 "[ . 1 . 2]" 1
735 1 37 PHE HZ 1 44 PHE HB3 . . 4.810 3.389 3.114 3.638 . 0 0 "[ . 1 . 2]" 1
736 1 37 PHE HZ 1 78 PHE QD . . 3.660 2.910 2.397 3.621 . 0 0 "[ . 1 . 2]" 1
737 1 37 PHE HZ 1 78 PHE QE . . 4.330 3.797 3.287 4.340 0.010 11 0 "[ . 1 . 2]" 1
738 1 37 PHE HZ 1 80 ILE MD . . 3.560 3.227 2.664 3.572 0.012 14 0 "[ . 1 . 2]" 1
739 1 37 PHE HZ 1 80 ILE HG12 . . 4.830 4.275 3.708 4.845 0.015 6 0 "[ . 1 . 2]" 1
740 1 38 GLU H 1 38 GLU HB2 . . 3.390 2.924 2.223 3.539 0.149 3 0 "[ . 1 . 2]" 1
741 1 38 GLU H 1 38 GLU HB3 . . 3.760 2.902 2.144 3.642 . 0 0 "[ . 1 . 2]" 1
742 1 38 GLU H 1 38 GLU HG2 . . 3.490 2.848 2.498 3.499 0.009 16 0 "[ . 1 . 2]" 1
743 1 38 GLU H 1 38 GLU HG3 . . 4.010 3.581 2.972 4.174 0.164 16 0 "[ . 1 . 2]" 1
744 1 38 GLU H 1 39 SER H . . 3.220 2.471 2.225 2.702 . 0 0 "[ . 1 . 2]" 1
745 1 38 GLU H 1 39 SER HB2 . . 4.910 4.428 4.136 4.795 . 0 0 "[ . 1 . 2]" 1
746 1 38 GLU HA 1 38 GLU HG2 . . 3.900 3.125 2.116 3.815 . 0 0 "[ . 1 . 2]" 1
747 1 38 GLU HA 1 38 GLU HG3 . . 3.480 3.530 3.083 3.751 0.271 6 0 "[ . 1 . 2]" 1
748 1 38 GLU HB2 1 39 SER H . . 3.700 3.311 2.274 4.061 0.361 13 0 "[ . 1 . 2]" 1
749 1 38 GLU HB3 1 39 SER H . . 3.870 3.495 2.880 3.875 0.005 2 0 "[ . 1 . 2]" 1
750 1 39 SER H 1 39 SER HB2 . . 3.210 2.222 2.100 2.412 . 0 0 "[ . 1 . 2]" 1
751 1 39 SER H 1 39 SER HB3 . . 3.560 3.473 3.340 3.553 . 0 0 "[ . 1 . 2]" 1
752 1 39 SER HA 1 41 PRO HD2 . . 4.940 4.882 4.713 4.973 0.033 13 0 "[ . 1 . 2]" 1
753 1 39 SER HA 1 41 PRO HD3 . . 4.750 3.510 3.380 3.590 . 0 0 "[ . 1 . 2]" 1
754 1 39 SER HB2 1 40 PHE H . . 3.770 2.897 2.744 3.171 . 0 0 "[ . 1 . 2]" 1
755 1 39 SER HB2 1 40 PHE QD . . 3.800 3.549 3.237 3.801 0.001 4 0 "[ . 1 . 2]" 1
756 1 39 SER HB2 1 40 PHE QE . . 4.070 3.776 3.524 3.987 . 0 0 "[ . 1 . 2]" 1
757 1 39 SER HB3 1 40 PHE H . . 4.010 3.538 3.087 3.879 . 0 0 "[ . 1 . 2]" 1
758 1 39 SER HB3 1 40 PHE QD . . 4.150 3.640 3.283 3.930 . 0 0 "[ . 1 . 2]" 1
759 1 39 SER HB3 1 40 PHE QE . . 4.240 3.466 3.201 3.695 . 0 0 "[ . 1 . 2]" 1
760 1 40 PHE H 1 40 PHE HB2 . . 3.400 2.635 2.525 2.707 . 0 0 "[ . 1 . 2]" 1
761 1 40 PHE H 1 40 PHE HB3 . . 4.020 3.718 3.677 3.756 . 0 0 "[ . 1 . 2]" 1
762 1 40 PHE H 1 40 PHE QD . . 3.820 3.217 3.023 3.369 . 0 0 "[ . 1 . 2]" 1
763 1 40 PHE H 1 41 PRO HD2 . . 4.430 4.215 4.104 4.316 . 0 0 "[ . 1 . 2]" 1
764 1 40 PHE H 1 41 PRO HD3 . . 3.960 3.033 2.884 3.171 . 0 0 "[ . 1 . 2]" 1
765 1 40 PHE H 1 44 PHE QD . . 4.200 3.773 3.565 4.010 . 0 0 "[ . 1 . 2]" 1
766 1 40 PHE HA 1 40 PHE QD . . 3.420 2.527 2.431 2.656 . 0 0 "[ . 1 . 2]" 1
767 1 40 PHE HA 1 40 PHE QE . . 4.760 4.681 4.618 4.748 . 0 0 "[ . 1 . 2]" 1
768 1 40 PHE HA 1 41 PRO HD2 . . 3.030 2.331 2.302 2.372 . 0 0 "[ . 1 . 2]" 1
769 1 40 PHE HA 1 41 PRO HD3 . . 3.410 2.596 2.547 2.662 . 0 0 "[ . 1 . 2]" 1
770 1 40 PHE HA 1 41 PRO HG2 . . 4.670 4.561 4.531 4.604 . 0 0 "[ . 1 . 2]" 1
771 1 40 PHE HA 1 41 PRO HG3 . . 4.820 4.704 4.661 4.762 . 0 0 "[ . 1 . 2]" 1
772 1 40 PHE HA 1 42 GLU H . . 4.240 3.307 3.108 3.928 . 0 0 "[ . 1 . 2]" 1
773 1 40 PHE HB2 1 43 ASP HB2 . . 4.150 3.239 2.700 3.795 . 0 0 "[ . 1 . 2]" 1
774 1 40 PHE HB2 1 43 ASP HB3 . . 4.900 4.670 4.229 4.917 0.017 14 0 "[ . 1 . 2]" 1
775 1 40 PHE HB2 1 44 PHE QD . . 3.310 2.014 1.987 2.104 . 0 0 "[ . 1 . 2]" 1
776 1 40 PHE HB2 1 44 PHE QE . . 4.120 2.746 2.435 3.013 . 0 0 "[ . 1 . 2]" 1
777 1 40 PHE HB3 1 43 ASP HB2 . . 4.040 2.560 2.313 2.857 . 0 0 "[ . 1 . 2]" 1
778 1 40 PHE HB3 1 43 ASP HB3 . . 4.250 4.021 3.782 4.258 0.008 14 0 "[ . 1 . 2]" 1
779 1 40 PHE HB3 1 44 PHE QD . . 3.420 3.335 2.975 3.438 0.018 20 0 "[ . 1 . 2]" 1
780 1 40 PHE HB3 1 44 PHE QE . . 4.060 3.485 3.092 3.751 . 0 0 "[ . 1 . 2]" 1
781 1 40 PHE QD 1 41 PRO HD2 . . 4.800 4.495 4.413 4.607 . 0 0 "[ . 1 . 2]" 1
782 1 40 PHE QD 1 44 PHE QE . . 3.940 2.614 2.315 3.102 . 0 0 "[ . 1 . 2]" 1
783 1 40 PHE QD 1 85 MET ME . . 3.480 2.858 2.287 3.427 . 0 0 "[ . 1 . 2]" 1
784 1 40 PHE QE 1 85 MET ME . . 3.470 2.300 1.927 2.885 . 0 0 "[ . 1 . 2]" 1
785 1 40 PHE HZ 1 85 MET ME . . 3.540 3.124 2.648 3.534 . 0 0 "[ . 1 . 2]" 1
786 1 41 PRO HA 1 44 PHE H . . 3.540 3.268 2.950 3.540 . 0 0 "[ . 1 . 2]" 1
787 1 41 PRO HA 1 44 PHE HB2 . . 4.680 3.714 3.327 3.979 . 0 0 "[ . 1 . 2]" 1
788 1 41 PRO HA 1 45 TYR HB3 . . 4.900 3.967 3.496 4.324 . 0 0 "[ . 1 . 2]" 1
789 1 41 PRO HB3 1 42 GLU H . . 4.580 4.324 3.994 4.446 . 0 0 "[ . 1 . 2]" 1
790 1 41 PRO HD2 1 42 GLU H . . 4.160 2.304 2.255 2.387 . 0 0 "[ . 1 . 2]" 1
791 1 41 PRO HD3 1 42 GLU H . . 4.460 3.672 3.655 3.771 . 0 0 "[ . 1 . 2]" 1
792 1 41 PRO HG2 1 42 GLU H . . 3.350 3.072 2.462 3.353 0.003 8 0 "[ . 1 . 2]" 1
793 1 41 PRO HG3 1 42 GLU H . . 4.500 4.232 3.847 4.414 . 0 0 "[ . 1 . 2]" 1
794 1 42 GLU H 1 42 GLU HB2 . . 3.590 2.303 2.036 3.559 . 0 0 "[ . 1 . 2]" 1
795 1 42 GLU H 1 42 GLU HB3 . . 3.530 3.279 2.462 3.521 . 0 0 "[ . 1 . 2]" 1
796 1 42 GLU H 1 42 GLU QG . . 3.740 3.022 1.942 3.731 . 0 0 "[ . 1 . 2]" 1
797 1 42 GLU H 1 43 ASP H . . 3.300 2.944 2.383 3.331 0.031 10 0 "[ . 1 . 2]" 1
798 1 42 GLU H 1 44 PHE H . . 4.770 4.252 3.886 4.656 . 0 0 "[ . 1 . 2]" 1
799 1 42 GLU HA 1 42 GLU HB2 . . 3.040 2.908 2.480 3.037 . 0 0 "[ . 1 . 2]" 1
800 1 42 GLU HA 1 42 GLU QG . . 3.300 2.262 1.972 3.332 0.032 2 0 "[ . 1 . 2]" 1
801 1 42 GLU HA 1 45 TYR QD . . 4.230 3.975 3.615 4.237 0.007 17 0 "[ . 1 . 2]" 1
802 1 42 GLU HA 1 45 TYR QE . . 5.000 4.790 4.052 5.008 0.008 16 0 "[ . 1 . 2]" 1
803 1 42 GLU HB2 1 43 ASP H . . 5.060 3.918 2.779 4.562 . 0 0 "[ . 1 . 2]" 1
804 1 42 GLU HB3 1 43 ASP H . . 4.870 4.038 3.115 4.463 . 0 0 "[ . 1 . 2]" 1
805 1 42 GLU QG 1 43 ASP H . . 4.680 4.295 2.076 4.660 . 0 0 "[ . 1 . 2]" 1
806 1 43 ASP H 1 43 ASP HB2 . . 4.050 2.696 2.211 3.057 . 0 0 "[ . 1 . 2]" 1
807 1 43 ASP HA 1 45 TYR QD . . 5.180 4.112 3.617 4.487 . 0 0 "[ . 1 . 2]" 1
808 1 43 ASP HA 1 45 TYR QE . . 5.190 3.721 2.843 4.651 . 0 0 "[ . 1 . 2]" 1
809 1 43 ASP HA 1 81 LYS H . . 4.480 4.022 3.484 4.400 . 0 0 "[ . 1 . 2]" 1
810 1 43 ASP HA 1 81 LYS HB2 . . 3.390 2.602 1.979 2.859 . 0 0 "[ . 1 . 2]" 1
811 1 43 ASP HA 1 81 LYS HB3 . . 3.970 3.881 3.276 3.989 0.019 18 0 "[ . 1 . 2]" 1
812 1 43 ASP HA 1 81 LYS HD2 . . 3.610 2.374 1.961 3.423 . 0 0 "[ . 1 . 2]" 1
813 1 43 ASP HA 1 81 LYS HD3 . . 3.910 3.455 1.999 4.002 0.092 19 0 "[ . 1 . 2]" 1
814 1 43 ASP HA 1 81 LYS HG2 . . 4.520 4.339 3.551 4.541 0.021 20 0 "[ . 1 . 2]" 1
815 1 43 ASP HA 1 81 LYS HG3 . . 4.060 3.145 1.978 3.965 . 0 0 "[ . 1 . 2]" 1
816 1 43 ASP HB2 1 44 PHE H . . 3.360 2.488 2.128 2.875 . 0 0 "[ . 1 . 2]" 1
817 1 43 ASP HB2 1 44 PHE QD . . 4.040 3.256 2.800 3.715 . 0 0 "[ . 1 . 2]" 1
818 1 43 ASP HB2 1 44 PHE QE . . 4.350 3.719 3.361 4.138 . 0 0 "[ . 1 . 2]" 1
819 1 43 ASP HB2 1 82 LYS HG3 . . 4.400 4.169 3.618 4.418 0.018 3 0 "[ . 1 . 2]" 1
820 1 43 ASP HB3 1 44 PHE H . . 3.650 3.494 3.012 3.658 0.008 6 0 "[ . 1 . 2]" 1
821 1 43 ASP HB3 1 44 PHE QD . . 4.190 3.879 3.510 4.095 . 0 0 "[ . 1 . 2]" 1
822 1 43 ASP HB3 1 44 PHE QE . . 4.460 3.816 3.596 4.026 . 0 0 "[ . 1 . 2]" 1
823 1 43 ASP HB3 1 44 PHE HZ . . 5.390 4.306 4.028 4.584 . 0 0 "[ . 1 . 2]" 1
824 1 43 ASP HB3 1 81 LYS HB2 . . 4.310 2.587 2.405 2.760 . 0 0 "[ . 1 . 2]" 1
825 1 43 ASP HB3 1 81 LYS HB3 . . 4.230 4.211 4.070 4.298 0.068 10 0 "[ . 1 . 2]" 1
826 1 43 ASP HB3 1 82 LYS H . . 4.240 3.455 2.893 3.934 . 0 0 "[ . 1 . 2]" 1
827 1 43 ASP HB3 1 82 LYS HG3 . . 4.480 2.862 2.368 3.801 . 0 0 "[ . 1 . 2]" 1
828 1 44 PHE H 1 44 PHE HB2 . . 3.810 2.499 2.411 2.587 . 0 0 "[ . 1 . 2]" 1
829 1 44 PHE H 1 45 TYR QD . . 4.180 3.588 3.252 3.976 . 0 0 "[ . 1 . 2]" 1
830 1 44 PHE HA 1 44 PHE QD . . 3.580 2.521 2.325 2.780 . 0 0 "[ . 1 . 2]" 1
831 1 44 PHE HA 1 45 TYR H . . 2.900 2.209 2.193 2.251 . 0 0 "[ . 1 . 2]" 1
832 1 44 PHE HA 1 45 TYR HA . . 4.700 4.410 4.372 4.465 . 0 0 "[ . 1 . 2]" 1
833 1 44 PHE HA 1 45 TYR QD . . 4.430 3.485 2.848 3.995 . 0 0 "[ . 1 . 2]" 1
834 1 44 PHE HA 1 80 ILE HA . . 3.630 3.048 2.818 3.240 . 0 0 "[ . 1 . 2]" 1
835 1 44 PHE HA 1 80 ILE MD . . 5.140 4.355 3.161 5.143 0.003 2 0 "[ . 1 . 2]" 1
836 1 44 PHE HA 1 80 ILE MG . . 4.560 4.346 4.050 4.580 0.020 20 0 "[ . 1 . 2]" 1
837 1 44 PHE HA 1 81 LYS H . . 4.260 3.599 3.349 3.798 . 0 0 "[ . 1 . 2]" 1
838 1 44 PHE HB2 1 45 TYR H . . 5.200 4.240 4.043 4.409 . 0 0 "[ . 1 . 2]" 1
839 1 44 PHE HB3 1 45 TYR H . . 4.550 3.498 3.192 3.839 . 0 0 "[ . 1 . 2]" 1
840 1 44 PHE QD 1 45 TYR H . . 4.790 4.251 4.114 4.371 . 0 0 "[ . 1 . 2]" 1
841 1 44 PHE QD 1 80 ILE HA . . 3.400 2.225 2.039 2.579 . 0 0 "[ . 1 . 2]" 1
842 1 44 PHE QD 1 80 ILE MD . . 3.790 2.829 1.925 3.638 . 0 0 "[ . 1 . 2]" 1
843 1 44 PHE QD 1 80 ILE HG12 . . 4.100 3.624 3.157 4.146 0.046 18 0 "[ . 1 . 2]" 1
844 1 44 PHE QD 1 80 ILE HG13 . . 4.720 4.738 4.615 4.790 0.070 11 0 "[ . 1 . 2]" 1
845 1 44 PHE QD 1 80 ILE MG . . 3.200 2.343 2.076 2.684 . 0 0 "[ . 1 . 2]" 1
846 1 44 PHE QD 1 81 LYS H . . 4.480 3.130 2.921 3.494 . 0 0 "[ . 1 . 2]" 1
847 1 44 PHE QD 1 82 LYS H . . 4.760 3.521 3.271 3.811 . 0 0 "[ . 1 . 2]" 1
848 1 44 PHE QD 1 86 PHE QD . . 4.160 4.060 3.741 4.178 0.018 18 0 "[ . 1 . 2]" 1
849 1 44 PHE QD 1 86 PHE QE . . 3.950 2.849 2.545 3.339 . 0 0 "[ . 1 . 2]" 1
850 1 44 PHE QD 1 86 PHE HZ . . 4.790 4.205 3.714 4.734 . 0 0 "[ . 1 . 2]" 1
851 1 44 PHE QE 1 80 ILE HA . . 4.670 3.475 3.236 3.716 . 0 0 "[ . 1 . 2]" 1
852 1 44 PHE QE 1 80 ILE MG . . 3.170 1.927 1.828 2.072 . 0 0 "[ . 1 . 2]" 1
853 1 44 PHE QE 1 82 LYS H . . 3.820 2.211 1.945 2.719 . 0 0 "[ . 1 . 2]" 1
854 1 44 PHE QE 1 82 LYS HB2 . . 4.230 2.870 2.605 3.158 . 0 0 "[ . 1 . 2]" 1
855 1 44 PHE QE 1 82 LYS HB3 . . 4.770 3.852 3.479 4.412 . 0 0 "[ . 1 . 2]" 1
856 1 44 PHE QE 1 83 PRO HA . . 4.700 3.425 3.211 3.636 . 0 0 "[ . 1 . 2]" 1
857 1 44 PHE QE 1 85 MET QB . . 4.370 3.239 3.033 3.472 . 0 0 "[ . 1 . 2]" 1
858 1 44 PHE QE 1 85 MET ME . . 3.760 2.739 2.352 3.129 . 0 0 "[ . 1 . 2]" 1
859 1 44 PHE QE 1 86 PHE QB . . 4.480 4.294 3.830 4.486 0.006 16 0 "[ . 1 . 2]" 1
860 1 44 PHE QE 1 86 PHE QD . . 4.550 2.897 2.449 3.245 . 0 0 "[ . 1 . 2]" 1
861 1 44 PHE QE 1 86 PHE QE . . 4.280 3.276 2.839 3.822 . 0 0 "[ . 1 . 2]" 1
862 1 44 PHE HZ 1 80 ILE MG . . 4.580 3.952 3.773 4.096 . 0 0 "[ . 1 . 2]" 1
863 1 44 PHE HZ 1 82 LYS H . . 5.020 3.556 3.237 3.932 . 0 0 "[ . 1 . 2]" 1
864 1 44 PHE HZ 1 82 LYS HB2 . . 3.820 2.013 1.985 2.116 . 0 0 "[ . 1 . 2]" 1
865 1 44 PHE HZ 1 82 LYS HB3 . . 4.310 2.843 2.290 3.565 . 0 0 "[ . 1 . 2]" 1
866 1 44 PHE HZ 1 82 LYS HD3 . . 5.170 4.519 4.193 4.781 . 0 0 "[ . 1 . 2]" 1
867 1 44 PHE HZ 1 85 MET QB . . 3.930 2.192 2.033 2.490 . 0 0 "[ . 1 . 2]" 1
868 1 44 PHE HZ 1 85 MET HG2 . . 4.970 4.718 4.291 4.978 0.008 7 0 "[ . 1 . 2]" 1
869 1 44 PHE HZ 1 85 MET HG3 . . 4.410 3.691 3.031 4.334 . 0 0 "[ . 1 . 2]" 1
870 1 45 TYR H 1 45 TYR QD . . 3.890 3.076 2.625 3.487 . 0 0 "[ . 1 . 2]" 1
871 1 45 TYR H 1 78 PHE HA . . 5.160 4.866 4.601 5.132 . 0 0 "[ . 1 . 2]" 1
872 1 45 TYR H 1 79 ILE H . . 3.910 3.123 2.903 3.307 . 0 0 "[ . 1 . 2]" 1
873 1 45 TYR H 1 79 ILE HB . . 3.880 2.969 2.458 3.654 . 0 0 "[ . 1 . 2]" 1
874 1 45 TYR H 1 79 ILE MG . . 4.270 3.859 3.187 4.293 0.023 12 0 "[ . 1 . 2]" 1
875 1 45 TYR H 1 80 ILE HA . . 4.580 4.298 4.089 4.518 . 0 0 "[ . 1 . 2]" 1
876 1 45 TYR HA 1 45 TYR QD . . 4.090 3.754 3.704 3.778 . 0 0 "[ . 1 . 2]" 1
877 1 45 TYR HA 1 46 VAL H . . 3.140 2.358 2.316 2.442 . 0 0 "[ . 1 . 2]" 1
878 1 45 TYR HA 1 46 VAL MG2 . . 4.050 3.561 3.379 3.763 . 0 0 "[ . 1 . 2]" 1
879 1 45 TYR HB2 1 46 VAL H . . 3.410 2.829 2.606 2.946 . 0 0 "[ . 1 . 2]" 1
880 1 45 TYR HB3 1 46 VAL H . . 3.990 3.981 3.744 4.066 0.076 13 0 "[ . 1 . 2]" 1
881 1 45 TYR QD 1 46 VAL H . . 3.900 3.774 3.387 3.947 0.047 14 0 "[ . 1 . 2]" 1
882 1 45 TYR QD 1 47 GLU QG . . 3.800 2.087 1.962 2.408 . 0 0 "[ . 1 . 2]" 1
883 1 45 TYR QD 1 79 ILE HB . . 4.160 3.044 2.495 3.248 . 0 0 "[ . 1 . 2]" 1
884 1 45 TYR QD 1 79 ILE MD . . 4.430 4.168 3.436 4.498 0.068 12 0 "[ . 1 . 2]" 1
885 1 45 TYR QD 1 79 ILE MG . . 4.190 3.528 3.126 3.763 . 0 0 "[ . 1 . 2]" 1
886 1 45 TYR QE 1 47 GLU HB2 . . 5.020 4.494 4.195 5.029 0.009 15 0 "[ . 1 . 2]" 1
887 1 45 TYR QE 1 47 GLU QG . . 3.640 2.269 1.935 2.797 . 0 0 "[ . 1 . 2]" 1
888 1 45 TYR QE 1 79 ILE HB . . 3.750 2.849 2.363 3.343 . 0 0 "[ . 1 . 2]" 1
889 1 45 TYR QE 1 79 ILE MD . . 4.020 3.392 2.763 3.688 . 0 0 "[ . 1 . 2]" 1
890 1 45 TYR QE 1 79 ILE HG12 . . 4.160 2.831 1.994 3.663 . 0 0 "[ . 1 . 2]" 1
891 1 45 TYR QE 1 79 ILE HG13 . . 3.890 2.533 1.981 3.693 . 0 0 "[ . 1 . 2]" 1
892 1 45 TYR QE 1 79 ILE MG . . 3.560 2.317 1.992 2.614 . 0 0 "[ . 1 . 2]" 1
893 1 45 TYR QE 1 81 LYS HD2 . . 4.480 3.160 1.995 4.412 . 0 0 "[ . 1 . 2]" 1
894 1 45 TYR QE 1 81 LYS HD3 . . 4.750 4.096 3.146 4.557 . 0 0 "[ . 1 . 2]" 1
895 1 45 TYR QE 1 81 LYS HE2 . . 3.860 2.793 1.992 4.707 0.847 18 1 "[ . 1 . + 2]" 1
896 1 45 TYR QE 1 81 LYS HG2 . . 5.230 4.098 2.934 5.130 . 0 0 "[ . 1 . 2]" 1
897 1 45 TYR QE 1 81 LYS HG3 . . 4.870 3.172 2.020 4.038 . 0 0 "[ . 1 . 2]" 1
898 1 46 VAL H 1 46 VAL HB . . 3.390 2.382 2.275 2.482 . 0 0 "[ . 1 . 2]" 1
899 1 46 VAL H 1 46 VAL MG1 . . 4.520 3.715 3.628 3.779 . 0 0 "[ . 1 . 2]" 1
900 1 46 VAL H 1 46 VAL MG2 . . 3.700 2.747 2.548 2.903 . 0 0 "[ . 1 . 2]" 1
901 1 46 VAL H 1 49 LEU MD1 . . 4.970 3.877 3.511 4.307 . 0 0 "[ . 1 . 2]" 1
902 1 46 VAL HA 1 46 VAL MG1 . . 3.290 2.495 2.386 2.590 . 0 0 "[ . 1 . 2]" 1
903 1 46 VAL HA 1 46 VAL MG2 . . 3.340 2.259 2.149 2.387 . 0 0 "[ . 1 . 2]" 1
904 1 46 VAL HA 1 47 GLU H . . 2.850 2.261 2.196 2.331 . 0 0 "[ . 1 . 2]" 1
905 1 46 VAL HA 1 47 GLU QG . . 4.600 3.600 3.257 4.144 . 0 0 "[ . 1 . 2]" 1
906 1 46 VAL HA 1 78 PHE HA . . 3.220 2.281 2.131 2.580 . 0 0 "[ . 1 . 2]" 1
907 1 46 VAL HA 1 79 ILE H . . 3.790 2.919 2.722 3.278 . 0 0 "[ . 1 . 2]" 1
908 1 46 VAL HA 1 79 ILE MD . . 4.830 3.949 3.247 4.637 . 0 0 "[ . 1 . 2]" 1
909 1 46 VAL HB 1 49 LEU MD1 . . 2.980 2.478 2.142 2.896 . 0 0 "[ . 1 . 2]" 1
910 1 46 VAL HB 1 55 PHE HB2 . . 4.660 2.687 2.231 3.163 . 0 0 "[ . 1 . 2]" 1
911 1 46 VAL HB 1 55 PHE HB3 . . 4.190 3.855 3.440 4.408 0.218 5 0 "[ . 1 . 2]" 1
912 1 46 VAL HB 1 55 PHE QD . . 4.690 3.011 2.591 3.348 . 0 0 "[ . 1 . 2]" 1
913 1 46 VAL HB 1 55 PHE QE . . 4.950 3.829 3.338 4.230 . 0 0 "[ . 1 . 2]" 1
914 1 46 VAL MG1 1 47 GLU H . . 3.470 2.356 2.096 2.690 . 0 0 "[ . 1 . 2]" 1
915 1 46 VAL MG1 1 47 GLU HA . . 4.610 3.546 3.290 3.865 . 0 0 "[ . 1 . 2]" 1
916 1 46 VAL MG1 1 49 LEU H . . 4.590 3.405 3.107 4.152 . 0 0 "[ . 1 . 2]" 1
917 1 46 VAL MG1 1 49 LEU HB2 . . 4.490 4.180 3.842 4.496 0.006 9 0 "[ . 1 . 2]" 1
918 1 46 VAL MG1 1 49 LEU MD1 . . 3.150 2.416 2.039 2.957 . 0 0 "[ . 1 . 2]" 1
919 1 46 VAL MG1 1 49 LEU MD2 . . 3.530 3.138 2.666 3.519 . 0 0 "[ . 1 . 2]" 1
920 1 46 VAL MG1 1 49 LEU HG . . 3.440 2.423 2.128 2.735 . 0 0 "[ . 1 . 2]" 1
921 1 46 VAL MG1 1 55 PHE HB3 . . 5.150 5.015 4.605 5.491 0.341 5 0 "[ . 1 . 2]" 1
922 1 46 VAL MG1 1 55 PHE QD . . 4.320 3.181 2.657 3.694 . 0 0 "[ . 1 . 2]" 1
923 1 46 VAL MG1 1 76 ILE HA . . 4.750 3.585 3.207 3.879 . 0 0 "[ . 1 . 2]" 1
924 1 46 VAL MG1 1 76 ILE MD . . 4.170 3.459 3.285 3.653 . 0 0 "[ . 1 . 2]" 1
925 1 46 VAL MG1 1 76 ILE MG . . 3.100 1.951 1.781 2.231 . 0 0 "[ . 1 . 2]" 1
926 1 46 VAL MG1 1 77 LYS H . . 4.090 2.521 2.245 2.981 . 0 0 "[ . 1 . 2]" 1
927 1 46 VAL MG1 1 78 PHE HA . . 3.900 3.199 2.777 3.769 . 0 0 "[ . 1 . 2]" 1
928 1 46 VAL MG1 1 78 PHE QD . . 4.110 2.753 2.267 3.522 . 0 0 "[ . 1 . 2]" 1
929 1 46 VAL MG1 1 78 PHE QE . . 4.050 2.697 1.972 3.271 . 0 0 "[ . 1 . 2]" 1
930 1 46 VAL MG2 1 47 GLU H . . 4.530 3.882 3.673 4.037 . 0 0 "[ . 1 . 2]" 1
931 1 46 VAL MG2 1 49 LEU MD1 . . 4.090 3.741 3.464 4.087 . 0 0 "[ . 1 . 2]" 1
932 1 46 VAL MG2 1 55 PHE HB2 . . 4.560 3.911 3.457 4.210 . 0 0 "[ . 1 . 2]" 1
933 1 46 VAL MG2 1 55 PHE HB3 . . 4.660 4.396 3.838 4.672 0.012 12 0 "[ . 1 . 2]" 1
934 1 46 VAL MG2 1 55 PHE QD . . 3.870 2.969 2.739 3.138 . 0 0 "[ . 1 . 2]" 1
935 1 46 VAL MG2 1 55 PHE QE . . 4.340 2.406 2.053 2.752 . 0 0 "[ . 1 . 2]" 1
936 1 46 VAL MG2 1 55 PHE HZ . . 4.800 2.705 2.368 3.064 . 0 0 "[ . 1 . 2]" 1
937 1 46 VAL MG2 1 76 ILE MG . . 4.630 3.530 3.206 3.986 . 0 0 "[ . 1 . 2]" 1
938 1 46 VAL MG2 1 78 PHE HA . . 3.820 2.384 1.970 2.888 . 0 0 "[ . 1 . 2]" 1
939 1 46 VAL MG2 1 78 PHE QD . . 4.270 2.779 2.476 3.017 . 0 0 "[ . 1 . 2]" 1
940 1 46 VAL MG2 1 78 PHE QE . . 4.220 2.697 2.387 2.935 . 0 0 "[ . 1 . 2]" 1
941 1 46 VAL MG2 1 78 PHE HZ . . 4.500 2.972 2.633 3.478 . 0 0 "[ . 1 . 2]" 1
942 1 46 VAL MG2 1 79 ILE H . . 4.730 3.508 2.804 4.066 . 0 0 "[ . 1 . 2]" 1
943 1 47 GLU H 1 47 GLU HB2 . . 3.700 2.639 2.333 2.803 . 0 0 "[ . 1 . 2]" 1
944 1 47 GLU H 1 47 GLU HB3 . . 4.040 3.741 3.558 3.822 . 0 0 "[ . 1 . 2]" 1
945 1 47 GLU H 1 47 GLU QG . . 3.780 2.873 2.576 3.248 . 0 0 "[ . 1 . 2]" 1
946 1 47 GLU H 1 77 LYS H . . 4.310 2.639 2.362 2.882 . 0 0 "[ . 1 . 2]" 1
947 1 47 GLU H 1 77 LYS HB2 . . 5.380 4.514 4.239 4.820 . 0 0 "[ . 1 . 2]" 1
948 1 47 GLU H 1 77 LYS HB3 . . 4.840 3.490 3.228 3.964 . 0 0 "[ . 1 . 2]" 1
949 1 47 GLU H 1 78 PHE HA . . 3.940 3.468 3.227 3.838 . 0 0 "[ . 1 . 2]" 1
950 1 47 GLU H 1 79 ILE MD . . 4.750 3.655 3.072 4.169 . 0 0 "[ . 1 . 2]" 1
951 1 47 GLU HA 1 47 GLU QG . . 3.240 2.436 2.213 2.616 . 0 0 "[ . 1 . 2]" 1
952 1 47 GLU HA 1 48 GLY H . . 3.400 2.506 2.258 2.762 . 0 0 "[ . 1 . 2]" 1
953 1 47 GLU HB2 1 48 GLY H . . 3.990 3.605 3.198 4.088 0.098 18 0 "[ . 1 . 2]" 1
954 1 47 GLU HB2 1 77 LYS H . . 4.770 3.880 3.507 4.242 . 0 0 "[ . 1 . 2]" 1
955 1 47 GLU HB2 1 77 LYS HB2 . . 4.100 4.049 3.911 4.107 0.007 3 0 "[ . 1 . 2]" 1
956 1 47 GLU HB2 1 77 LYS HB3 . . 4.180 2.952 2.734 3.052 . 0 0 "[ . 1 . 2]" 1
957 1 47 GLU HB2 1 79 ILE MD . . 4.440 3.255 2.860 3.456 . 0 0 "[ . 1 . 2]" 1
958 1 47 GLU HB3 1 48 GLY H . . 3.760 2.510 1.938 3.155 . 0 0 "[ . 1 . 2]" 1
959 1 47 GLU HB3 1 48 GLY HA2 . . 4.780 4.201 3.967 4.431 . 0 0 "[ . 1 . 2]" 1
960 1 47 GLU HB3 1 48 GLY HA3 . . 4.920 4.475 4.044 4.765 . 0 0 "[ . 1 . 2]" 1
961 1 47 GLU HB3 1 77 LYS HB3 . . 4.640 4.532 3.977 4.674 0.034 18 0 "[ . 1 . 2]" 1
962 1 47 GLU HB3 1 79 ILE MD . . 4.730 4.543 4.060 4.748 0.018 19 0 "[ . 1 . 2]" 1
963 1 47 GLU QG 1 48 GLY H . . 4.350 4.211 3.930 4.384 0.034 18 0 "[ . 1 . 2]" 1
964 1 47 GLU QG 1 79 ILE MD . . 3.580 2.842 2.037 3.475 . 0 0 "[ . 1 . 2]" 1
965 1 47 GLU QG 1 79 ILE HG12 . . 3.990 2.637 2.186 3.535 . 0 0 "[ . 1 . 2]" 1
966 1 47 GLU QG 1 79 ILE HG13 . . 4.090 2.918 2.062 4.094 0.004 4 0 "[ . 1 . 2]" 1
967 1 48 GLY H 1 49 LEU H . . 3.610 2.740 2.357 2.979 . 0 0 "[ . 1 . 2]" 1
968 1 48 GLY HA2 1 75 LYS QB . . 3.930 3.552 3.099 3.938 0.008 16 0 "[ . 1 . 2]" 1
969 1 48 GLY HA2 1 76 ILE HA . . 3.830 3.852 3.836 3.882 0.052 18 0 "[ . 1 . 2]" 1
970 1 48 GLY HA3 1 75 LYS QB . . 3.820 3.359 2.975 3.664 . 0 0 "[ . 1 . 2]" 1
971 1 48 GLY HA3 1 76 ILE HA . . 3.480 2.121 2.087 2.192 . 0 0 "[ . 1 . 2]" 1
972 1 48 GLY HA3 1 76 ILE HG12 . . 4.970 3.902 3.740 4.181 . 0 0 "[ . 1 . 2]" 1
973 1 48 GLY HA3 1 77 LYS H . . 4.390 3.510 3.357 3.677 . 0 0 "[ . 1 . 2]" 1
974 1 49 LEU H 1 49 LEU HB2 . . 3.380 2.357 2.168 2.499 . 0 0 "[ . 1 . 2]" 1
975 1 49 LEU H 1 49 LEU HB3 . . 3.700 3.525 3.459 3.548 . 0 0 "[ . 1 . 2]" 1
976 1 49 LEU H 1 49 LEU MD1 . . 3.740 3.375 3.130 3.677 . 0 0 "[ . 1 . 2]" 1
977 1 49 LEU H 1 49 LEU MD2 . . 4.410 3.674 3.461 4.112 . 0 0 "[ . 1 . 2]" 1
978 1 49 LEU H 1 49 LEU HG . . 3.520 2.404 2.156 3.042 . 0 0 "[ . 1 . 2]" 1
979 1 49 LEU HA 1 49 LEU MD1 . . 4.310 3.846 3.813 3.889 . 0 0 "[ . 1 . 2]" 1
980 1 49 LEU HA 1 49 LEU MD2 . . 3.030 2.191 1.962 2.422 . 0 0 "[ . 1 . 2]" 1
981 1 49 LEU HA 1 49 LEU HG . . 3.770 2.709 2.566 2.869 . 0 0 "[ . 1 . 2]" 1
982 1 49 LEU HA 1 50 PRO HD2 . . 3.260 2.689 2.651 2.740 . 0 0 "[ . 1 . 2]" 1
983 1 49 LEU HA 1 50 PRO HD3 . . 2.940 1.981 1.963 2.007 . 0 0 "[ . 1 . 2]" 1
984 1 49 LEU HA 1 50 PRO HG2 . . 4.390 4.619 4.590 4.657 0.267 16 0 "[ . 1 . 2]" 1
985 1 49 LEU HA 1 50 PRO HG3 . . 4.560 4.247 4.232 4.270 . 0 0 "[ . 1 . 2]" 1
986 1 49 LEU HA 1 69 ILE HA . . 4.680 4.424 4.112 4.678 . 0 0 "[ . 1 . 2]" 1
987 1 49 LEU HA 1 76 ILE MD . . 3.360 3.053 2.817 3.303 . 0 0 "[ . 1 . 2]" 1
988 1 49 LEU HA 1 76 ILE HG12 . . 4.780 2.749 2.577 3.080 . 0 0 "[ . 1 . 2]" 1
989 1 49 LEU HB2 1 49 LEU MD1 . . 3.190 2.122 1.989 2.371 . 0 0 "[ . 1 . 2]" 1
990 1 49 LEU HB2 1 50 PRO HD2 . . 3.980 3.879 3.773 3.975 . 0 0 "[ . 1 . 2]" 1
991 1 49 LEU HB2 1 50 PRO HD3 . . 4.510 4.460 4.406 4.514 0.004 4 0 "[ . 1 . 2]" 1
992 1 49 LEU HB2 1 53 VAL MG1 . . 4.870 4.850 4.686 4.891 0.021 16 0 "[ . 1 . 2]" 1
993 1 49 LEU HB3 1 49 LEU MD1 . . 3.330 2.570 2.349 2.700 . 0 0 "[ . 1 . 2]" 1
994 1 49 LEU HB3 1 49 LEU MD2 . . 3.240 2.265 2.126 2.379 . 0 0 "[ . 1 . 2]" 1
995 1 49 LEU HB3 1 50 PRO HD2 . . 3.530 2.264 2.145 2.385 . 0 0 "[ . 1 . 2]" 1
996 1 49 LEU HB3 1 50 PRO HD3 . . 3.920 3.293 3.177 3.404 . 0 0 "[ . 1 . 2]" 1
997 1 49 LEU HB3 1 53 VAL HB . . 4.030 3.329 2.724 3.551 . 0 0 "[ . 1 . 2]" 1
998 1 49 LEU HB3 1 53 VAL MG1 . . 4.230 3.369 3.163 3.517 . 0 0 "[ . 1 . 2]" 1
999 1 49 LEU MD1 1 50 PRO HD2 . . 4.690 4.121 3.760 4.364 . 0 0 "[ . 1 . 2]" 1
1000 1 49 LEU MD1 1 54 PRO HA . . 4.210 3.110 2.633 3.696 . 0 0 "[ . 1 . 2]" 1
1001 1 49 LEU MD1 1 55 PHE H . . 3.860 2.844 2.359 3.192 . 0 0 "[ . 1 . 2]" 1
1002 1 49 LEU MD1 1 55 PHE HA . . 3.490 2.039 1.963 2.260 . 0 0 "[ . 1 . 2]" 1
1003 1 49 LEU MD1 1 55 PHE HB2 . . 3.860 1.879 1.782 2.120 . 0 0 "[ . 1 . 2]" 1
1004 1 49 LEU MD1 1 55 PHE HB3 . . 3.250 3.217 3.120 3.478 0.228 5 0 "[ . 1 . 2]" 1
1005 1 49 LEU MD1 1 55 PHE QD . . 3.330 2.505 1.963 3.093 . 0 0 "[ . 1 . 2]" 1
1006 1 49 LEU MD1 1 55 PHE QE . . 4.750 4.327 4.053 4.715 . 0 0 "[ . 1 . 2]" 1
1007 1 49 LEU MD1 1 56 ARG H . . 4.170 4.103 3.923 4.199 0.029 11 0 "[ . 1 . 2]" 1
1008 1 49 LEU MD2 1 50 PRO HD2 . . 3.480 2.310 2.055 2.699 . 0 0 "[ . 1 . 2]" 1
1009 1 49 LEU MD2 1 50 PRO HD3 . . 3.320 2.532 2.241 2.869 . 0 0 "[ . 1 . 2]" 1
1010 1 49 LEU MD2 1 53 VAL HB . . 4.500 3.769 3.179 4.154 . 0 0 "[ . 1 . 2]" 1
1011 1 49 LEU MD2 1 53 VAL MG1 . . 3.500 2.568 2.301 2.953 . 0 0 "[ . 1 . 2]" 1
1012 1 49 LEU MD2 1 55 PHE HA . . 4.530 3.010 2.650 3.355 . 0 0 "[ . 1 . 2]" 1
1013 1 49 LEU MD2 1 55 PHE QD . . 4.360 3.001 2.565 3.571 . 0 0 "[ . 1 . 2]" 1
1014 1 49 LEU MD2 1 69 ILE HA . . 4.360 3.523 3.108 3.830 . 0 0 "[ . 1 . 2]" 1
1015 1 49 LEU MD2 1 69 ILE HG12 . . 4.260 2.431 2.051 2.691 . 0 0 "[ . 1 . 2]" 1
1016 1 49 LEU MD2 1 69 ILE HG13 . . 4.350 3.389 2.954 3.802 . 0 0 "[ . 1 . 2]" 1
1017 1 49 LEU HG 1 50 PRO HD2 . . 4.520 4.348 4.125 4.526 0.006 2 0 "[ . 1 . 2]" 1
1018 1 49 LEU HG 1 50 PRO HD3 . . 4.790 4.330 4.079 4.501 . 0 0 "[ . 1 . 2]" 1
1019 1 50 PRO HA 1 51 GLU H . . 2.960 2.299 2.158 2.530 . 0 0 "[ . 1 . 2]" 1
1020 1 50 PRO HA 1 51 GLU QB . . 4.510 4.154 4.025 4.345 . 0 0 "[ . 1 . 2]" 1
1021 1 50 PRO HA 1 72 ASN HB2 . . 5.070 4.808 4.315 5.074 0.004 17 0 "[ . 1 . 2]" 1
1022 1 50 PRO HA 1 72 ASN HD21 . . 4.520 2.809 2.304 3.166 . 0 0 "[ . 1 . 2]" 1
1023 1 50 PRO HA 1 72 ASN HD22 . . 4.030 3.441 2.646 4.028 . 0 0 "[ . 1 . 2]" 1
1024 1 50 PRO HB2 1 51 GLU H . . 4.150 3.124 2.486 3.662 . 0 0 "[ . 1 . 2]" 1
1025 1 50 PRO HB2 1 53 VAL H . . 4.890 4.548 4.044 4.750 . 0 0 "[ . 1 . 2]" 1
1026 1 50 PRO HB2 1 53 VAL MG2 . . 3.280 2.416 2.191 2.528 . 0 0 "[ . 1 . 2]" 1
1027 1 50 PRO HB3 1 51 GLU H . . 4.000 3.637 3.292 3.976 . 0 0 "[ . 1 . 2]" 1
1028 1 50 PRO HB3 1 53 VAL MG2 . . 3.890 3.849 3.705 3.916 0.026 16 0 "[ . 1 . 2]" 1
1029 1 50 PRO HD2 1 53 VAL H . . 5.040 4.484 4.256 4.685 . 0 0 "[ . 1 . 2]" 1
1030 1 50 PRO HD2 1 53 VAL HB . . 3.610 2.249 2.140 2.327 . 0 0 "[ . 1 . 2]" 1
1031 1 50 PRO HD2 1 53 VAL MG1 . . 3.800 2.234 1.967 2.942 . 0 0 "[ . 1 . 2]" 1
1032 1 50 PRO HD2 1 53 VAL MG2 . . 3.750 3.560 3.203 3.747 . 0 0 "[ . 1 . 2]" 1
1033 1 50 PRO HD3 1 53 VAL HB . . 4.380 3.812 3.716 4.045 . 0 0 "[ . 1 . 2]" 1
1034 1 50 PRO HD3 1 69 ILE HA . . 3.730 2.757 2.385 2.948 . 0 0 "[ . 1 . 2]" 1
1035 1 50 PRO HD3 1 72 ASN HB2 . . 4.400 3.004 2.462 3.501 . 0 0 "[ . 1 . 2]" 1
1036 1 50 PRO HD3 1 72 ASN HD21 . . 5.010 3.291 2.577 4.086 . 0 0 "[ . 1 . 2]" 1
1037 1 50 PRO HD3 1 76 ILE MD . . 4.030 3.115 2.777 3.428 . 0 0 "[ . 1 . 2]" 1
1038 1 50 PRO HG2 1 53 VAL HB . . 4.460 2.235 2.030 3.012 . 0 0 "[ . 1 . 2]" 1
1039 1 50 PRO HG2 1 53 VAL MG2 . . 4.440 2.108 1.961 2.298 . 0 0 "[ . 1 . 2]" 1
1040 1 50 PRO HG2 1 69 ILE HA . . 3.680 3.366 3.356 3.379 . 0 0 "[ . 1 . 2]" 1
1041 1 50 PRO HG3 1 53 VAL MG2 . . 3.780 3.530 3.422 3.741 . 0 0 "[ . 1 . 2]" 1
1042 1 50 PRO HG3 1 69 ILE HA . . 3.360 2.390 1.994 2.662 . 0 0 "[ . 1 . 2]" 1
1043 1 50 PRO HG3 1 69 ILE HG12 . . 4.490 4.358 3.922 4.974 0.484 3 0 "[ . 1 . 2]" 1
1044 1 51 GLU H 1 51 GLU QB . . 3.460 2.128 1.999 2.686 . 0 0 "[ . 1 . 2]" 1
1045 1 51 GLU H 1 51 GLU QG . . 4.240 3.566 2.371 4.036 . 0 0 "[ . 1 . 2]" 1
1046 1 51 GLU HA 1 51 GLU QG . . 3.600 2.298 1.986 3.328 . 0 0 "[ . 1 . 2]" 1
1047 1 51 GLU HA 1 52 GLY H . . 3.040 2.372 2.210 3.104 0.064 12 0 "[ . 1 . 2]" 1
1048 1 51 GLU HA 1 53 VAL H . . 4.180 3.327 3.155 4.266 0.086 12 0 "[ . 1 . 2]" 1
1049 1 51 GLU QB 1 52 GLY H . . 4.650 3.223 2.026 3.823 . 0 0 "[ . 1 . 2]" 1
1050 1 51 GLU QG 1 52 GLY H . . 4.380 2.768 1.939 3.790 . 0 0 "[ . 1 . 2]" 1
1051 1 51 GLU QG 1 52 GLY HA3 . . 5.120 4.319 3.612 5.047 . 0 0 "[ . 1 . 2]" 1
1052 1 52 GLY H 1 53 VAL H . . 3.760 2.693 2.212 3.065 . 0 0 "[ . 1 . 2]" 1
1053 1 52 GLY HA2 1 53 VAL MG2 . . 4.980 4.252 4.106 4.533 . 0 0 "[ . 1 . 2]" 1
1054 1 52 GLY HA3 1 53 VAL MG2 . . 4.450 3.517 3.267 4.487 0.037 12 0 "[ . 1 . 2]" 1
1055 1 53 VAL H 1 53 VAL HB . . 3.420 2.615 2.393 2.721 . 0 0 "[ . 1 . 2]" 1
1056 1 53 VAL H 1 53 VAL MG1 . . 4.230 3.833 3.705 3.886 . 0 0 "[ . 1 . 2]" 1
1057 1 53 VAL H 1 53 VAL MG2 . . 3.290 2.720 2.143 2.913 . 0 0 "[ . 1 . 2]" 1
1058 1 53 VAL HA 1 53 VAL MG1 . . 3.240 2.331 2.230 2.445 . 0 0 "[ . 1 . 2]" 1
1059 1 53 VAL HA 1 53 VAL MG2 . . 3.210 2.423 2.344 2.513 . 0 0 "[ . 1 . 2]" 1
1060 1 53 VAL HA 1 54 PRO HD2 . . 2.770 2.192 2.181 2.229 . 0 0 "[ . 1 . 2]" 1
1061 1 53 VAL HA 1 54 PRO HD3 . . 3.100 2.182 2.007 2.279 . 0 0 "[ . 1 . 2]" 1
1062 1 53 VAL HA 1 54 PRO HG2 . . 5.030 4.370 4.345 4.395 . 0 0 "[ . 1 . 2]" 1
1063 1 53 VAL HA 1 54 PRO HG3 . . 4.780 4.363 4.236 4.437 . 0 0 "[ . 1 . 2]" 1
1064 1 53 VAL MG1 1 54 PRO HD2 . . 4.070 2.982 2.434 3.288 . 0 0 "[ . 1 . 2]" 1
1065 1 53 VAL MG1 1 54 PRO HD3 . . 3.730 3.877 3.513 4.056 0.326 20 0 "[ . 1 . 2]" 1
1066 1 53 VAL MG1 1 61 PHE QE . . 3.870 3.326 2.592 3.816 . 0 0 "[ . 1 . 2]" 1
1067 1 53 VAL MG1 1 61 PHE HZ . . 4.210 3.421 2.799 3.859 . 0 0 "[ . 1 . 2]" 1
1068 1 53 VAL MG1 1 65 ARG HB3 . . 4.780 4.120 3.530 4.696 . 0 0 "[ . 1 . 2]" 1
1069 1 53 VAL MG1 1 65 ARG HD2 . . 4.520 3.603 2.853 4.388 . 0 0 "[ . 1 . 2]" 1
1070 1 53 VAL MG1 1 65 ARG HD3 . . 3.810 3.294 1.929 4.524 0.714 14 1 "[ . 1 +. 2]" 1
1071 1 53 VAL MG1 1 69 ILE HG12 . . 4.330 2.468 2.057 3.463 . 0 0 "[ . 1 . 2]" 1
1072 1 53 VAL MG1 1 69 ILE HG13 . . 3.710 2.009 1.770 3.043 . 0 0 "[ . 1 . 2]" 1
1073 1 53 VAL MG2 1 54 PRO HD2 . . 4.570 4.141 3.948 4.251 . 0 0 "[ . 1 . 2]" 1
1074 1 53 VAL MG2 1 54 PRO HD3 . . 4.530 4.076 4.001 4.163 . 0 0 "[ . 1 . 2]" 1
1075 1 53 VAL MG2 1 65 ARG HA . . 3.940 3.689 3.369 3.957 0.017 16 0 "[ . 1 . 2]" 1
1076 1 53 VAL MG2 1 65 ARG HB3 . . 4.870 4.333 3.549 4.845 . 0 0 "[ . 1 . 2]" 1
1077 1 53 VAL MG2 1 65 ARG HD2 . . 4.390 3.763 2.975 4.360 . 0 0 "[ . 1 . 2]" 1
1078 1 53 VAL MG2 1 65 ARG HD3 . . 4.030 2.824 2.100 3.630 . 0 0 "[ . 1 . 2]" 1
1079 1 53 VAL MG2 1 65 ARG HG2 . . 3.980 2.488 2.078 3.468 . 0 0 "[ . 1 . 2]" 1
1080 1 53 VAL MG2 1 65 ARG HG3 . . 3.960 3.536 2.151 3.978 0.018 9 0 "[ . 1 . 2]" 1
1081 1 53 VAL MG2 1 68 LYS HB2 . . 3.760 3.109 2.881 3.587 . 0 0 "[ . 1 . 2]" 1
1082 1 53 VAL MG2 1 68 LYS HB3 . . 5.090 3.192 2.882 3.532 . 0 0 "[ . 1 . 2]" 1
1083 1 53 VAL MG2 1 68 LYS HD2 . . 4.630 3.641 2.927 4.380 . 0 0 "[ . 1 . 2]" 1
1084 1 53 VAL MG2 1 68 LYS HD3 . . 4.510 3.690 3.029 4.638 0.128 20 0 "[ . 1 . 2]" 1
1085 1 53 VAL MG2 1 68 LYS QE . . 4.800 4.185 1.960 4.809 0.009 15 0 "[ . 1 . 2]" 1
1086 1 54 PRO HA 1 55 PHE H . . 3.020 2.530 2.149 2.720 . 0 0 "[ . 1 . 2]" 1
1087 1 54 PRO HB2 1 55 PHE H . . 3.840 2.551 2.074 3.797 . 0 0 "[ . 1 . 2]" 1
1088 1 54 PRO HB2 1 56 ARG HG2 . . 4.350 3.314 2.930 3.789 . 0 0 "[ . 1 . 2]" 1
1089 1 54 PRO HB2 1 56 ARG HG3 . . 4.410 3.585 3.110 3.863 . 0 0 "[ . 1 . 2]" 1
1090 1 54 PRO HB3 1 55 PHE H . . 4.130 3.356 3.137 4.076 . 0 0 "[ . 1 . 2]" 1
1091 1 54 PRO HD3 1 61 PHE QE . . 4.380 4.111 3.662 4.580 0.200 14 0 "[ . 1 . 2]" 1
1092 1 54 PRO HG2 1 56 ARG HG2 . . 4.320 3.770 3.227 4.326 0.006 16 0 "[ . 1 . 2]" 1
1093 1 54 PRO HG2 1 56 ARG HG3 . . 4.320 2.925 2.608 3.519 . 0 0 "[ . 1 . 2]" 1
1094 1 54 PRO HG2 1 61 PHE QE . . 5.150 3.205 2.615 4.281 . 0 0 "[ . 1 . 2]" 1
1095 1 54 PRO HG2 1 61 PHE HZ . . 5.500 3.792 2.675 4.767 . 0 0 "[ . 1 . 2]" 1
1096 1 55 PHE H 1 55 PHE HB2 . . 3.550 2.590 2.214 2.821 . 0 0 "[ . 1 . 2]" 1
1097 1 55 PHE H 1 55 PHE HB3 . . 3.410 2.317 2.233 2.600 . 0 0 "[ . 1 . 2]" 1
1098 1 55 PHE HA 1 55 PHE QD . . 3.240 2.271 2.082 2.607 . 0 0 "[ . 1 . 2]" 1
1099 1 55 PHE HA 1 55 PHE QE . . 5.190 4.527 4.414 4.660 . 0 0 "[ . 1 . 2]" 1
1100 1 55 PHE HA 1 56 ARG H . . 2.900 2.706 2.206 2.926 0.026 4 0 "[ . 1 . 2]" 1
1101 1 55 PHE HA 1 61 PHE HZ . . 4.730 3.745 3.201 4.526 . 0 0 "[ . 1 . 2]" 1
1102 1 55 PHE HB3 1 56 ARG H . . 4.710 4.287 4.141 4.576 . 0 0 "[ . 1 . 2]" 1
1103 1 55 PHE QE 1 78 PHE QE . . 4.030 3.300 2.744 3.714 . 0 0 "[ . 1 . 2]" 1
1104 1 55 PHE QE 1 78 PHE HZ . . 4.620 2.642 2.017 3.265 . 0 0 "[ . 1 . 2]" 1
1105 1 55 PHE HZ 1 78 PHE QE . . 4.150 2.670 1.989 3.451 . 0 0 "[ . 1 . 2]" 1
1106 1 55 PHE HZ 1 78 PHE HZ . . 4.060 2.980 2.508 3.704 . 0 0 "[ . 1 . 2]" 1
1107 1 56 ARG H 1 56 ARG HB2 . . 4.130 2.254 2.088 2.655 . 0 0 "[ . 1 . 2]" 1
1108 1 56 ARG H 1 56 ARG HG2 . . 4.440 3.268 2.928 3.732 . 0 0 "[ . 1 . 2]" 1
1109 1 56 ARG H 1 56 ARG HG3 . . 4.680 3.809 3.352 4.366 . 0 0 "[ . 1 . 2]" 1
1110 1 56 ARG H 1 61 PHE QE . . 5.020 3.192 2.296 3.479 . 0 0 "[ . 1 . 2]" 1
1111 1 56 ARG H 1 61 PHE HZ . . 3.930 2.089 1.946 2.523 . 0 0 "[ . 1 . 2]" 1
1112 1 56 ARG HA 1 56 ARG HD2 . . 4.410 3.213 2.442 3.898 . 0 0 "[ . 1 . 2]" 1
1113 1 56 ARG HA 1 56 ARG HD3 . . 3.960 3.082 2.481 3.769 . 0 0 "[ . 1 . 2]" 1
1114 1 56 ARG HA 1 56 ARG HG2 . . 3.990 2.282 2.219 2.351 . 0 0 "[ . 1 . 2]" 1
1115 1 56 ARG HA 1 56 ARG HG3 . . 4.220 3.564 3.529 3.591 . 0 0 "[ . 1 . 2]" 1
1116 1 56 ARG HA 1 57 ARG H . . 3.180 2.721 2.641 2.807 . 0 0 "[ . 1 . 2]" 1
1117 1 56 ARG HB2 1 57 ARG H . . 3.710 3.572 3.434 3.708 . 0 0 "[ . 1 . 2]" 1
1118 1 56 ARG HB2 1 61 PHE QE . . 4.620 2.792 2.323 3.257 . 0 0 "[ . 1 . 2]" 1
1119 1 56 ARG HB2 1 61 PHE HZ . . 5.090 2.307 1.997 2.821 . 0 0 "[ . 1 . 2]" 1
1120 1 56 ARG HB3 1 56 ARG HD2 . . 4.010 2.285 2.001 2.574 . 0 0 "[ . 1 . 2]" 1
1121 1 56 ARG HB3 1 56 ARG HD3 . . 4.140 3.194 2.562 3.652 . 0 0 "[ . 1 . 2]" 1
1122 1 56 ARG HB3 1 57 ARG H . . 3.350 2.065 1.917 2.233 . 0 0 "[ . 1 . 2]" 1
1123 1 56 ARG HB3 1 57 ARG QB . . 4.470 3.824 3.626 4.286 . 0 0 "[ . 1 . 2]" 1
1124 1 56 ARG HD2 1 57 ARG QB . . 4.870 4.275 3.640 5.081 0.211 11 0 "[ . 1 . 2]" 1
1125 1 56 ARG HD2 1 60 THR MG . . 4.770 3.888 3.257 4.712 . 0 0 "[ . 1 . 2]" 1
1126 1 56 ARG HG2 1 57 ARG H . . 4.180 4.090 3.938 4.180 . 0 0 "[ . 1 . 2]" 1
1127 1 56 ARG HG2 1 61 PHE HZ . . 4.930 4.563 4.141 4.890 . 0 0 "[ . 1 . 2]" 1
1128 1 56 ARG HG3 1 57 ARG H . . 4.640 4.451 4.212 4.642 0.002 20 0 "[ . 1 . 2]" 1
1129 1 56 ARG HG3 1 60 THR MG . . 4.540 4.494 4.353 4.561 0.021 11 0 "[ . 1 . 2]" 1
1130 1 56 ARG HG3 1 61 PHE QE . . 4.870 4.140 3.691 4.733 . 0 0 "[ . 1 . 2]" 1
1131 1 56 ARG HG3 1 61 PHE HZ . . 4.890 4.349 3.839 4.793 . 0 0 "[ . 1 . 2]" 1
1132 1 57 ARG H 1 57 ARG QB . . 3.410 2.409 2.193 2.572 . 0 0 "[ . 1 . 2]" 1
1133 1 57 ARG H 1 57 ARG HD2 . . 5.030 3.104 2.114 4.574 . 0 0 "[ . 1 . 2]" 1
1134 1 57 ARG H 1 57 ARG HD3 . . 5.240 4.048 2.918 4.776 . 0 0 "[ . 1 . 2]" 1
1135 1 57 ARG H 1 57 ARG HG2 . . 3.510 3.553 1.949 4.143 0.633 19 1 "[ . 1 . +2]" 1
1136 1 57 ARG H 1 57 ARG HG3 . . 4.160 2.519 1.949 3.566 . 0 0 "[ . 1 . 2]" 1
1137 1 57 ARG H 1 58 PRO HD3 . . 5.210 4.712 4.624 4.760 . 0 0 "[ . 1 . 2]" 1
1138 1 57 ARG HA 1 57 ARG HG2 . . 4.000 3.034 2.510 3.636 . 0 0 "[ . 1 . 2]" 1
1139 1 57 ARG HA 1 57 ARG HG3 . . 3.720 2.679 2.199 4.041 0.321 17 0 "[ . 1 . 2]" 1
1140 1 57 ARG HA 1 58 PRO HD2 . . 3.110 2.675 2.606 2.734 . 0 0 "[ . 1 . 2]" 1
1141 1 57 ARG HA 1 58 PRO HD3 . . 2.940 2.000 1.973 2.027 . 0 0 "[ . 1 . 2]" 1
1142 1 57 ARG HA 1 58 PRO HG2 . . 4.800 4.626 4.578 4.670 . 0 0 "[ . 1 . 2]" 1
1143 1 57 ARG HA 1 58 PRO HG3 . . 4.890 4.272 4.249 4.296 . 0 0 "[ . 1 . 2]" 1
1144 1 57 ARG QB 1 57 ARG HD2 . . 3.680 2.341 1.966 3.067 . 0 0 "[ . 1 . 2]" 1
1145 1 57 ARG QB 1 57 ARG HD3 . . 3.720 2.559 2.060 3.067 . 0 0 "[ . 1 . 2]" 1
1146 1 57 ARG QB 1 58 PRO HD2 . . 3.880 2.277 2.142 2.457 . 0 0 "[ . 1 . 2]" 1
1147 1 57 ARG QB 1 58 PRO HD3 . . 4.770 3.228 3.056 3.386 . 0 0 "[ . 1 . 2]" 1
1148 1 57 ARG QB 1 59 SER H . . 4.070 2.700 2.244 3.106 . 0 0 "[ . 1 . 2]" 1
1149 1 57 ARG HD2 1 60 THR MG . . 4.850 4.682 4.258 5.464 0.614 17 2 "[ - 1 . + 2]" 1
1150 1 57 ARG HG2 1 58 PRO HD2 . . 4.300 3.733 3.098 4.747 0.447 11 0 "[ . 1 . 2]" 1
1151 1 57 ARG HG3 1 58 PRO HD2 . . 4.830 4.277 3.742 4.790 . 0 0 "[ . 1 . 2]" 1
1152 1 57 ARG HG3 1 58 PRO HD3 . . 5.170 4.332 3.671 5.068 . 0 0 "[ . 1 . 2]" 1
1153 1 58 PRO HA 1 60 THR H . . 4.680 3.651 3.477 3.842 . 0 0 "[ . 1 . 2]" 1
1154 1 58 PRO HA 1 61 PHE H . . 4.250 3.398 3.100 3.723 . 0 0 "[ . 1 . 2]" 1
1155 1 58 PRO HA 1 61 PHE HB3 . . 4.840 4.819 4.445 5.443 0.603 2 1 "[ + . 1 . 2]" 1
1156 1 58 PRO HA 1 61 PHE QD . . 3.080 2.118 1.998 2.707 . 0 0 "[ . 1 . 2]" 1
1157 1 58 PRO HA 1 61 PHE QE . . 4.630 3.456 2.975 3.962 . 0 0 "[ . 1 . 2]" 1
1158 1 58 PRO HA 1 66 LEU QD . . 3.760 2.790 2.456 3.111 . 0 0 "[ . 1 . 2]" 1
1159 1 58 PRO HB2 1 59 SER H . . 4.510 3.376 3.007 3.865 . 0 0 "[ . 1 . 2]" 1
1160 1 58 PRO HB2 1 66 LEU QD . . 3.650 2.832 2.165 3.217 . 0 0 "[ . 1 . 2]" 1
1161 1 58 PRO HB3 1 59 SER H . . 4.050 4.260 4.054 4.529 0.479 17 0 "[ . 1 . 2]" 1
1162 1 58 PRO HB3 1 66 LEU QD . . 3.900 2.999 2.173 3.420 . 0 0 "[ . 1 . 2]" 1
1163 1 58 PRO HD2 1 59 SER H . . 3.820 2.344 2.253 2.508 . 0 0 "[ . 1 . 2]" 1
1164 1 58 PRO HD3 1 59 SER H . . 3.890 3.703 3.658 3.736 . 0 0 "[ . 1 . 2]" 1
1165 1 58 PRO HG3 1 59 SER H . . 5.040 4.166 3.899 4.573 . 0 0 "[ . 1 . 2]" 1
1166 1 59 SER H 1 59 SER HB2 . . 3.930 2.914 2.172 3.603 . 0 0 "[ . 1 . 2]" 1
1167 1 59 SER H 1 59 SER HB3 . . 3.930 2.817 2.309 3.616 . 0 0 "[ . 1 . 2]" 1
1168 1 59 SER H 1 60 THR H . . 4.180 3.484 2.692 3.757 . 0 0 "[ . 1 . 2]" 1
1169 1 59 SER HA 1 61 PHE H . . 4.580 4.482 4.171 4.583 0.003 15 0 "[ . 1 . 2]" 1
1170 1 59 SER HB2 1 60 THR H . . 4.810 4.465 3.274 4.722 . 0 0 "[ . 1 . 2]" 1
1171 1 60 THR H 1 60 THR MG . . 3.490 3.428 3.215 3.518 0.028 2 0 "[ . 1 . 2]" 1
1172 1 60 THR H 1 61 PHE H . . 3.550 1.994 1.891 2.511 . 0 0 "[ . 1 . 2]" 1
1173 1 60 THR H 1 61 PHE QD . . 5.240 4.353 4.061 4.710 . 0 0 "[ . 1 . 2]" 1
1174 1 60 THR HA 1 60 THR HB . . 2.980 2.894 2.785 3.003 0.023 3 0 "[ . 1 . 2]" 1
1175 1 60 THR HA 1 60 THR MG . . 3.030 2.921 2.702 3.081 0.051 17 0 "[ . 1 . 2]" 1
1176 1 60 THR HB 1 61 PHE H . . 4.780 3.228 2.895 3.540 . 0 0 "[ . 1 . 2]" 1
1177 1 60 THR MG 1 61 PHE H . . 4.400 2.455 2.111 3.166 . 0 0 "[ . 1 . 2]" 1
1178 1 61 PHE H 1 61 PHE HB2 . . 3.960 2.261 2.099 2.388 . 0 0 "[ . 1 . 2]" 1
1179 1 61 PHE H 1 61 PHE HB3 . . 3.500 3.450 3.403 3.474 . 0 0 "[ . 1 . 2]" 1
1180 1 61 PHE H 1 66 LEU QD . . 4.820 3.653 3.365 3.965 . 0 0 "[ . 1 . 2]" 1
1181 1 61 PHE HA 1 61 PHE QD . . 3.240 2.061 1.991 2.268 . 0 0 "[ . 1 . 2]" 1
1182 1 61 PHE HA 1 61 PHE QE . . 5.200 4.322 4.266 4.434 . 0 0 "[ . 1 . 2]" 1
1183 1 61 PHE HA 1 62 GLY H . . 3.220 2.535 2.288 2.751 . 0 0 "[ . 1 . 2]" 1
1184 1 61 PHE HA 1 62 GLY HA3 . . 4.520 4.502 4.431 4.560 0.040 11 0 "[ . 1 . 2]" 1
1185 1 61 PHE HA 1 65 ARG HB2 . . 4.760 4.379 4.017 4.618 . 0 0 "[ . 1 . 2]" 1
1186 1 61 PHE HB2 1 62 GLY H . . 4.390 3.720 3.390 4.261 . 0 0 "[ . 1 . 2]" 1
1187 1 61 PHE HB2 1 65 ARG HB3 . . 3.940 3.927 3.785 4.004 0.064 4 0 "[ . 1 . 2]" 1
1188 1 61 PHE HB2 1 66 LEU H . . 4.750 4.459 4.146 4.748 . 0 0 "[ . 1 . 2]" 1
1189 1 61 PHE HB2 1 66 LEU QD . . 3.930 2.468 2.208 2.693 . 0 0 "[ . 1 . 2]" 1
1190 1 61 PHE HB2 1 66 LEU HG . . 3.800 2.249 1.996 2.499 . 0 0 "[ . 1 . 2]" 1
1191 1 61 PHE HB3 1 65 ARG HB2 . . 4.630 3.386 2.954 3.916 . 0 0 "[ . 1 . 2]" 1
1192 1 61 PHE HB3 1 66 LEU QD . . 3.580 3.244 2.934 3.520 . 0 0 "[ . 1 . 2]" 1
1193 1 61 PHE HB3 1 66 LEU HG . . 3.800 2.513 2.107 2.799 . 0 0 "[ . 1 . 2]" 1
1194 1 61 PHE QD 1 65 ARG HB2 . . 4.520 4.342 3.619 4.528 0.008 20 0 "[ . 1 . 2]" 1
1195 1 61 PHE QD 1 65 ARG HB3 . . 4.820 3.423 2.728 3.651 . 0 0 "[ . 1 . 2]" 1
1196 1 61 PHE QD 1 65 ARG HD2 . . 3.970 2.362 1.991 2.989 . 0 0 "[ . 1 . 2]" 1
1197 1 61 PHE QD 1 65 ARG HD3 . . 3.990 3.557 3.166 3.999 0.009 18 0 "[ . 1 . 2]" 1
1198 1 61 PHE QD 1 66 LEU QD . . 3.580 2.651 2.240 3.117 . 0 0 "[ . 1 . 2]" 1
1199 1 61 PHE QD 1 66 LEU HG . . 4.710 3.708 3.517 3.906 . 0 0 "[ . 1 . 2]" 1
1200 1 61 PHE QD 1 69 ILE MD . . 3.630 2.641 2.088 2.943 . 0 0 "[ . 1 . 2]" 1
1201 1 61 PHE QE 1 65 ARG HD2 . . 5.000 3.563 3.007 4.527 . 0 0 "[ . 1 . 2]" 1
1202 1 61 PHE QE 1 69 ILE MD . . 4.740 2.612 2.187 3.012 . 0 0 "[ . 1 . 2]" 1
1203 1 61 PHE HZ 1 69 ILE MD . . 4.630 3.660 3.376 3.948 . 0 0 "[ . 1 . 2]" 1
1204 1 62 GLY HA2 1 63 ILE H . . 3.090 2.597 2.447 2.687 . 0 0 "[ . 1 . 2]" 1
1205 1 62 GLY HA2 1 63 ILE HA . . 4.260 4.300 4.287 4.308 0.048 8 0 "[ . 1 . 2]" 1
1206 1 62 GLY HA2 1 63 ILE HB . . 4.810 4.825 4.783 4.962 0.152 20 0 "[ . 1 . 2]" 1
1207 1 62 GLY HA2 1 63 ILE QG . . 4.880 3.908 3.678 4.168 . 0 0 "[ . 1 . 2]" 1
1208 1 62 GLY HA2 1 64 PRO QD . . 4.040 3.396 3.222 3.512 . 0 0 "[ . 1 . 2]" 1
1209 1 62 GLY HA3 1 63 ILE H . . 3.130 2.645 2.554 2.810 . 0 0 "[ . 1 . 2]" 1
1210 1 62 GLY HA3 1 63 ILE HB . . 4.830 4.739 4.612 4.886 0.056 4 0 "[ . 1 . 2]" 1
1211 1 62 GLY HA3 1 63 ILE QG . . 4.830 4.696 4.567 4.766 . 0 0 "[ . 1 . 2]" 1
1212 1 62 GLY HA3 1 64 PRO QD . . 4.040 2.296 2.178 2.367 . 0 0 "[ . 1 . 2]" 1
1213 1 63 ILE H 1 63 ILE HB . . 3.290 2.254 2.184 2.435 . 0 0 "[ . 1 . 2]" 1
1214 1 63 ILE H 1 63 ILE QG . . 3.510 2.460 2.046 2.601 . 0 0 "[ . 1 . 2]" 1
1215 1 63 ILE H 1 63 ILE MG . . 3.780 3.652 3.621 3.707 . 0 0 "[ . 1 . 2]" 1
1216 1 63 ILE H 1 64 PRO QD . . 3.470 1.938 1.858 2.045 . 0 0 "[ . 1 . 2]" 1
1217 1 63 ILE HA 1 63 ILE MD . . 4.370 3.700 1.839 3.845 . 0 0 "[ . 1 . 2]" 1
1218 1 63 ILE HA 1 63 ILE QG . . 3.430 2.355 2.280 3.095 . 0 0 "[ . 1 . 2]" 1
1219 1 63 ILE HA 1 63 ILE MG . . 3.020 2.542 2.419 2.607 . 0 0 "[ . 1 . 2]" 1
1220 1 63 ILE HA 1 66 LEU H . . 3.840 3.878 3.817 3.925 0.085 9 0 "[ . 1 . 2]" 1
1221 1 63 ILE HA 1 66 LEU HB2 . . 3.530 3.052 2.898 3.215 . 0 0 "[ . 1 . 2]" 1
1222 1 63 ILE HA 1 66 LEU QD . . 3.260 2.340 1.944 2.663 . 0 0 "[ . 1 . 2]" 1
1223 1 63 ILE HA 1 66 LEU HG . . 4.490 4.342 4.068 4.521 0.031 18 0 "[ . 1 . 2]" 1
1224 1 63 ILE HB 1 63 ILE MD . . 3.370 2.166 2.050 3.127 . 0 0 "[ . 1 . 2]" 1
1225 1 63 ILE HB 1 64 PRO QD . . 2.950 1.872 1.848 1.904 . 0 0 "[ . 1 . 2]" 1
1226 1 63 ILE MD 1 64 PRO QD . . 3.420 3.433 3.338 3.598 0.178 20 0 "[ . 1 . 2]" 1
1227 1 63 ILE QG 1 64 PRO QD . . 4.530 3.568 3.221 3.654 . 0 0 "[ . 1 . 2]" 1
1228 1 63 ILE QG 1 66 LEU QD . . 4.400 3.525 3.312 4.004 . 0 0 "[ . 1 . 2]" 1
1229 1 63 ILE MG 1 64 PRO HA . . 3.720 3.403 3.234 3.614 . 0 0 "[ . 1 . 2]" 1
1230 1 63 ILE MG 1 64 PRO QD . . 3.700 2.960 2.777 3.282 . 0 0 "[ . 1 . 2]" 1
1231 1 64 PRO HA 1 67 GLU H . . 4.220 3.320 3.182 3.420 . 0 0 "[ . 1 . 2]" 1
1232 1 64 PRO HA 1 67 GLU HB2 . . 4.210 2.875 2.773 3.000 . 0 0 "[ . 1 . 2]" 1
1233 1 64 PRO HA 1 67 GLU HB3 . . 4.650 4.519 4.380 4.654 0.004 4 0 "[ . 1 . 2]" 1
1234 1 64 PRO HA 1 67 GLU HG2 . . 5.150 5.030 4.753 5.176 0.026 20 0 "[ . 1 . 2]" 1
1235 1 64 PRO HA 1 67 GLU HG3 . . 4.290 3.902 3.620 4.189 . 0 0 "[ . 1 . 2]" 1
1236 1 64 PRO HA 1 68 LYS HG2 . . 4.990 4.771 4.597 4.984 . 0 0 "[ . 1 . 2]" 1
1237 1 64 PRO HB2 1 65 ARG H . . 3.280 2.938 2.769 3.112 . 0 0 "[ . 1 . 2]" 1
1238 1 64 PRO HB2 1 65 ARG HA . . 4.810 3.892 3.843 3.947 . 0 0 "[ . 1 . 2]" 1
1239 1 64 PRO HB3 1 65 ARG H . . 4.170 4.014 3.919 4.114 . 0 0 "[ . 1 . 2]" 1
1240 1 64 PRO QD 1 65 ARG H . . 3.710 2.347 2.271 2.440 . 0 0 "[ . 1 . 2]" 1
1241 1 64 PRO HG2 1 65 ARG H . . 4.390 2.493 2.370 2.643 . 0 0 "[ . 1 . 2]" 1
1242 1 65 ARG H 1 65 ARG HB2 . . 3.320 2.068 2.027 2.226 . 0 0 "[ . 1 . 2]" 1
1243 1 65 ARG H 1 65 ARG HB3 . . 3.770 3.227 2.776 3.416 . 0 0 "[ . 1 . 2]" 1
1244 1 65 ARG H 1 65 ARG HG2 . . 4.270 4.080 3.703 4.633 0.363 14 0 "[ . 1 . 2]" 1
1245 1 65 ARG H 1 66 LEU H . . 3.360 2.843 2.794 2.895 . 0 0 "[ . 1 . 2]" 1
1246 1 65 ARG H 1 67 GLU H . . 4.670 4.596 4.424 4.711 0.041 20 0 "[ . 1 . 2]" 1
1247 1 65 ARG H 1 68 LYS HG3 . . 3.790 3.776 3.602 3.916 0.126 20 0 "[ . 1 . 2]" 1
1248 1 65 ARG HA 1 65 ARG HD3 . . 4.640 4.283 3.581 4.577 . 0 0 "[ . 1 . 2]" 1
1249 1 65 ARG HA 1 65 ARG HG2 . . 4.110 2.305 1.981 3.437 . 0 0 "[ . 1 . 2]" 1
1250 1 65 ARG HA 1 65 ARG HG3 . . 3.430 2.736 2.139 3.157 . 0 0 "[ . 1 . 2]" 1
1251 1 65 ARG HA 1 68 LYS H . . 3.840 3.333 3.087 3.542 . 0 0 "[ . 1 . 2]" 1
1252 1 65 ARG HA 1 68 LYS HB2 . . 3.180 2.675 2.300 3.084 . 0 0 "[ . 1 . 2]" 1
1253 1 65 ARG HA 1 68 LYS HD2 . . 4.290 3.107 2.617 4.303 0.013 13 0 "[ . 1 . 2]" 1
1254 1 65 ARG HA 1 68 LYS HD3 . . 4.110 3.815 3.273 4.290 0.180 1 0 "[ . 1 . 2]" 1
1255 1 65 ARG HA 1 68 LYS HG2 . . 3.650 3.694 3.666 3.717 0.067 10 0 "[ . 1 . 2]" 1
1256 1 65 ARG HA 1 68 LYS HG3 . . 3.380 1.977 1.952 1.995 . 0 0 "[ . 1 . 2]" 1
1257 1 65 ARG HB2 1 65 ARG HD2 . . 4.120 3.052 2.555 3.567 . 0 0 "[ . 1 . 2]" 1
1258 1 65 ARG HB2 1 66 LEU H . . 4.130 3.327 2.971 3.728 . 0 0 "[ . 1 . 2]" 1
1259 1 65 ARG HB3 1 65 ARG HD2 . . 4.060 2.358 2.085 3.944 . 0 0 "[ . 1 . 2]" 1
1260 1 65 ARG HB3 1 65 ARG HD3 . . 4.050 3.369 2.798 3.736 . 0 0 "[ . 1 . 2]" 1
1261 1 65 ARG HB3 1 66 LEU H . . 4.240 3.044 2.602 3.279 . 0 0 "[ . 1 . 2]" 1
1262 1 65 ARG HB3 1 69 ILE MD . . 4.860 3.558 3.291 3.892 . 0 0 "[ . 1 . 2]" 1
1263 1 66 LEU H 1 66 LEU HB2 . . 3.450 2.166 2.124 2.220 . 0 0 "[ . 1 . 2]" 1
1264 1 66 LEU H 1 66 LEU HB3 . . 4.050 3.456 3.431 3.484 . 0 0 "[ . 1 . 2]" 1
1265 1 66 LEU H 1 66 LEU QD . . 3.420 3.222 3.146 3.271 . 0 0 "[ . 1 . 2]" 1
1266 1 66 LEU H 1 66 LEU HG . . 3.330 2.806 2.668 2.912 . 0 0 "[ . 1 . 2]" 1
1267 1 66 LEU H 1 67 GLU H . . 3.450 2.809 2.666 2.913 . 0 0 "[ . 1 . 2]" 1
1268 1 66 LEU H 1 68 LYS H . . 4.360 4.013 3.903 4.134 . 0 0 "[ . 1 . 2]" 1
1269 1 66 LEU H 1 69 ILE MD . . 4.520 4.215 4.001 4.520 . 12 0 "[ . 1 . 2]" 1
1270 1 66 LEU HA 1 66 LEU QD . . 3.080 2.220 2.036 2.356 . 0 0 "[ . 1 . 2]" 1
1271 1 66 LEU HA 1 66 LEU HG . . 3.310 2.566 2.514 2.665 . 0 0 "[ . 1 . 2]" 1
1272 1 66 LEU HA 1 69 ILE HB . . 3.770 3.303 3.060 3.564 . 0 0 "[ . 1 . 2]" 1
1273 1 66 LEU HA 1 69 ILE MD . . 3.370 2.226 1.970 2.569 . 0 0 "[ . 1 . 2]" 1
1274 1 66 LEU HA 1 70 LEU H . . 4.740 4.610 4.417 4.748 0.008 17 0 "[ . 1 . 2]" 1
1275 1 66 LEU HB2 1 67 GLU H . . 4.040 2.649 2.516 2.724 . 0 0 "[ . 1 . 2]" 1
1276 1 66 LEU HB3 1 67 GLU H . . 4.420 3.168 3.003 3.343 . 0 0 "[ . 1 . 2]" 1
1277 1 66 LEU QD 1 67 GLU H . . 4.410 4.017 3.936 4.080 . 0 0 "[ . 1 . 2]" 1
1278 1 66 LEU QD 1 69 ILE MD . . 3.280 2.993 2.714 3.250 . 0 0 "[ . 1 . 2]" 1
1279 1 67 GLU H 1 67 GLU HB2 . . 3.330 2.197 2.121 2.315 . 0 0 "[ . 1 . 2]" 1
1280 1 67 GLU H 1 67 GLU HB3 . . 3.720 3.474 3.426 3.524 . 0 0 "[ . 1 . 2]" 1
1281 1 67 GLU H 1 67 GLU HG2 . . 3.970 3.035 2.854 3.223 . 0 0 "[ . 1 . 2]" 1
1282 1 67 GLU H 1 67 GLU HG3 . . 3.500 3.216 2.565 3.497 . 0 0 "[ . 1 . 2]" 1
1283 1 67 GLU H 1 68 LYS H . . 3.570 2.751 2.574 2.902 . 0 0 "[ . 1 . 2]" 1
1284 1 67 GLU HA 1 67 GLU HB3 . . 3.050 2.701 2.641 2.780 . 0 0 "[ . 1 . 2]" 1
1285 1 67 GLU HA 1 67 GLU HG2 . . 3.070 2.154 2.058 2.272 . 0 0 "[ . 1 . 2]" 1
1286 1 67 GLU HA 1 67 GLU HG3 . . 3.840 3.438 3.162 3.553 . 0 0 "[ . 1 . 2]" 1
1287 1 67 GLU HA 1 70 LEU H . . 3.980 3.276 3.049 3.575 . 0 0 "[ . 1 . 2]" 1
1288 1 67 GLU HA 1 70 LEU HB2 . . 3.130 2.388 2.058 2.598 . 0 0 "[ . 1 . 2]" 1
1289 1 67 GLU HA 1 70 LEU HB3 . . 4.100 3.953 3.580 4.099 . 0 0 "[ . 1 . 2]" 1
1290 1 67 GLU HA 1 70 LEU MD1 . . 3.510 2.554 1.936 3.387 . 0 0 "[ . 1 . 2]" 1
1291 1 67 GLU HB2 1 68 LYS H . . 3.690 2.881 2.762 2.987 . 0 0 "[ . 1 . 2]" 1
1292 1 67 GLU HB3 1 70 LEU HB2 . . 4.580 4.317 4.043 4.594 0.014 18 0 "[ . 1 . 2]" 1
1293 1 68 LYS H 1 68 LYS HB2 . . 3.210 2.587 2.472 2.735 . 0 0 "[ . 1 . 2]" 1
1294 1 68 LYS H 1 68 LYS HB3 . . 3.760 3.538 3.525 3.547 . 0 0 "[ . 1 . 2]" 1
1295 1 68 LYS H 1 68 LYS HD2 . . 5.010 4.473 4.316 4.632 . 0 0 "[ . 1 . 2]" 1
1296 1 68 LYS H 1 68 LYS HD3 . . 4.490 4.560 4.438 4.757 0.267 4 0 "[ . 1 . 2]" 1
1297 1 68 LYS H 1 68 LYS HG2 . . 3.490 2.551 2.316 2.794 . 0 0 "[ . 1 . 2]" 1
1298 1 68 LYS H 1 68 LYS HG3 . . 4.080 2.225 2.066 2.326 . 0 0 "[ . 1 . 2]" 1
1299 1 68 LYS H 1 69 ILE H . . 3.510 2.921 2.768 3.093 . 0 0 "[ . 1 . 2]" 1
1300 1 68 LYS HA 1 68 LYS HD2 . . 4.400 4.478 3.723 4.829 0.429 9 0 "[ . 1 . 2]" 1
1301 1 68 LYS HA 1 68 LYS HG2 . . 2.970 2.354 2.283 2.461 . 0 0 "[ . 1 . 2]" 1
1302 1 68 LYS HA 1 68 LYS HG3 . . 3.490 3.447 3.371 3.529 0.039 10 0 "[ . 1 . 2]" 1
1303 1 68 LYS HA 1 71 ARG H . . 3.930 3.668 3.247 3.841 . 0 0 "[ . 1 . 2]" 1
1304 1 68 LYS HA 1 71 ARG QB . . 3.470 2.715 2.231 3.183 . 0 0 "[ . 1 . 2]" 1
1305 1 68 LYS HA 1 71 ARG HD2 . . 4.700 3.033 2.000 4.505 . 0 0 "[ . 1 . 2]" 1
1306 1 68 LYS HA 1 71 ARG HD3 . . 4.490 3.255 2.039 4.561 0.071 20 0 "[ . 1 . 2]" 1
1307 1 68 LYS HA 1 71 ARG HG3 . . 4.530 3.488 2.135 4.411 . 0 0 "[ . 1 . 2]" 1
1308 1 68 LYS HB2 1 68 LYS HD3 . . 4.030 3.289 2.747 3.943 . 0 0 "[ . 1 . 2]" 1
1309 1 68 LYS HB2 1 68 LYS QE . . 4.170 3.768 2.074 4.169 . 0 0 "[ . 1 . 2]" 1
1310 1 68 LYS HB2 1 69 ILE H . . 4.080 2.598 2.209 2.831 . 0 0 "[ . 1 . 2]" 1
1311 1 68 LYS HB3 1 68 LYS HD3 . . 3.840 2.470 2.020 3.609 . 0 0 "[ . 1 . 2]" 1
1312 1 68 LYS HB3 1 68 LYS QE . . 4.550 3.310 2.207 4.044 . 0 0 "[ . 1 . 2]" 1
1313 1 68 LYS HB3 1 69 ILE H . . 3.880 3.703 3.351 3.884 0.004 8 0 "[ . 1 . 2]" 1
1314 1 68 LYS QE 1 68 LYS HG2 . . 3.690 2.451 1.988 3.357 . 0 0 "[ . 1 . 2]" 1
1315 1 68 LYS QE 1 68 LYS HG3 . . 3.720 2.714 2.098 3.245 . 0 0 "[ . 1 . 2]" 1
1316 1 69 ILE H 1 69 ILE HB . . 3.130 2.264 2.132 2.498 . 0 0 "[ . 1 . 2]" 1
1317 1 69 ILE H 1 69 ILE MD . . 3.690 2.764 2.478 3.094 . 0 0 "[ . 1 . 2]" 1
1318 1 69 ILE H 1 69 ILE HG12 . . 4.050 3.918 3.567 4.091 0.041 4 0 "[ . 1 . 2]" 1
1319 1 69 ILE H 1 69 ILE MG . . 3.990 3.659 3.572 3.720 . 0 0 "[ . 1 . 2]" 1
1320 1 69 ILE H 1 70 LEU H . . 3.460 2.850 2.616 3.108 . 0 0 "[ . 1 . 2]" 1
1321 1 69 ILE HA 1 69 ILE MD . . 3.690 3.721 3.680 3.802 0.112 19 0 "[ . 1 . 2]" 1
1322 1 69 ILE HA 1 69 ILE HG12 . . 3.400 2.922 2.772 3.059 . 0 0 "[ . 1 . 2]" 1
1323 1 69 ILE HA 1 69 ILE HG13 . . 3.250 2.334 2.269 2.486 . 0 0 "[ . 1 . 2]" 1
1324 1 69 ILE HA 1 69 ILE MG . . 3.170 2.548 2.443 2.671 . 0 0 "[ . 1 . 2]" 1
1325 1 69 ILE HA 1 70 LEU HA . . 4.980 4.844 4.757 4.883 . 0 0 "[ . 1 . 2]" 1
1326 1 69 ILE HA 1 71 ARG H . . 4.930 4.610 4.249 4.920 . 0 0 "[ . 1 . 2]" 1
1327 1 69 ILE HA 1 72 ASN H . . 4.230 3.503 3.354 3.690 . 0 0 "[ . 1 . 2]" 1
1328 1 69 ILE HA 1 72 ASN HB2 . . 4.130 3.412 3.042 3.678 . 0 0 "[ . 1 . 2]" 1
1329 1 69 ILE HB 1 69 ILE MD . . 3.450 2.046 1.963 2.124 . 0 0 "[ . 1 . 2]" 1
1330 1 69 ILE HB 1 70 LEU H . . 3.560 2.515 2.358 2.768 . 0 0 "[ . 1 . 2]" 1
1331 1 69 ILE MD 1 69 ILE MG . . 3.070 2.594 2.417 2.737 . 0 0 "[ . 1 . 2]" 1
1332 1 69 ILE MG 1 70 LEU H . . 3.870 2.907 2.416 3.174 . 0 0 "[ . 1 . 2]" 1
1333 1 69 ILE MG 1 70 LEU HA . . 3.750 3.181 2.802 3.360 . 0 0 "[ . 1 . 2]" 1
1334 1 69 ILE MG 1 70 LEU HG . . 4.200 3.516 3.084 3.906 . 0 0 "[ . 1 . 2]" 1
1335 1 70 LEU H 1 70 LEU HB2 . . 3.250 2.218 2.080 2.347 . 0 0 "[ . 1 . 2]" 1
1336 1 70 LEU H 1 70 LEU HB3 . . 3.580 3.474 3.394 3.525 . 0 0 "[ . 1 . 2]" 1
1337 1 70 LEU H 1 70 LEU MD2 . . 4.480 3.966 3.314 4.193 . 0 0 "[ . 1 . 2]" 1
1338 1 70 LEU H 1 70 LEU HG . . 3.560 2.848 2.625 3.103 . 0 0 "[ . 1 . 2]" 1
1339 1 70 LEU H 1 71 ARG H . . 3.450 2.971 2.751 3.090 . 0 0 "[ . 1 . 2]" 1
1340 1 70 LEU HA 1 70 LEU MD1 . . 3.670 3.696 3.585 3.750 0.080 10 0 "[ . 1 . 2]" 1
1341 1 70 LEU HA 1 70 LEU MD2 . . 3.080 2.530 1.899 3.056 . 0 0 "[ . 1 . 2]" 1
1342 1 70 LEU HA 1 70 LEU HG . . 3.930 2.469 2.287 3.018 . 0 0 "[ . 1 . 2]" 1
1343 1 70 LEU HA 1 72 ASN H . . 4.390 3.905 3.577 4.109 . 0 0 "[ . 1 . 2]" 1
1344 1 70 LEU HA 1 73 LYS H . . 4.190 3.863 3.597 4.041 . 0 0 "[ . 1 . 2]" 1
1345 1 70 LEU HA 1 73 LYS HB2 . . 4.420 3.620 3.279 3.854 . 0 0 "[ . 1 . 2]" 1
1346 1 70 LEU HA 1 73 LYS HB3 . . 3.810 2.166 1.997 2.442 . 0 0 "[ . 1 . 2]" 1
1347 1 70 LEU HB2 1 70 LEU MD1 . . 3.340 2.189 2.056 2.444 . 0 0 "[ . 1 . 2]" 1
1348 1 70 LEU HB2 1 70 LEU MD2 . . 3.240 3.100 2.980 3.210 . 0 0 "[ . 1 . 2]" 1
1349 1 70 LEU HB2 1 71 ARG H . . 3.440 2.694 2.499 2.892 . 0 0 "[ . 1 . 2]" 1
1350 1 70 LEU HB3 1 70 LEU MD1 . . 3.530 2.692 2.277 2.942 . 0 0 "[ . 1 . 2]" 1
1351 1 70 LEU HB3 1 70 LEU MD2 . . 3.250 2.245 2.018 2.505 . 0 0 "[ . 1 . 2]" 1
1352 1 70 LEU HB3 1 71 ARG H . . 3.860 3.174 2.821 3.511 . 0 0 "[ . 1 . 2]" 1
1353 1 70 LEU HB3 1 71 ARG HG3 . . 4.830 4.725 3.917 5.547 0.717 14 1 "[ . 1 +. 2]" 1
1354 1 70 LEU MD2 1 73 LYS QD . . 4.310 2.811 1.962 3.533 . 0 0 "[ . 1 . 2]" 1
1355 1 70 LEU MD2 1 73 LYS HE2 . . 4.900 3.125 1.981 4.490 . 0 0 "[ . 1 . 2]" 1
1356 1 71 ARG H 1 71 ARG QB . . 3.070 2.360 2.142 2.657 . 0 0 "[ . 1 . 2]" 1
1357 1 71 ARG H 1 71 ARG HG2 . . 4.290 3.485 2.385 4.222 . 0 0 "[ . 1 . 2]" 1
1358 1 71 ARG H 1 71 ARG HG3 . . 3.540 2.515 2.030 3.064 . 0 0 "[ . 1 . 2]" 1
1359 1 71 ARG H 1 72 ASN H . . 3.480 2.945 2.743 3.008 . 0 0 "[ . 1 . 2]" 1
1360 1 71 ARG HA 1 71 ARG HD2 . . 4.600 4.450 3.795 4.679 0.079 18 0 "[ . 1 . 2]" 1
1361 1 71 ARG HA 1 71 ARG HD3 . . 4.650 4.328 3.973 4.550 . 0 0 "[ . 1 . 2]" 1
1362 1 71 ARG HA 1 71 ARG HG2 . . 3.430 2.539 2.141 2.859 . 0 0 "[ . 1 . 2]" 1
1363 1 71 ARG HA 1 71 ARG HG3 . . 3.520 2.757 2.184 3.482 . 0 0 "[ . 1 . 2]" 1
1364 1 71 ARG HA 1 73 LYS H . . 4.240 4.155 4.010 4.250 0.010 11 0 "[ . 1 . 2]" 1
1365 1 71 ARG QB 1 71 ARG HD2 . . 3.630 2.715 2.030 3.308 . 0 0 "[ . 1 . 2]" 1
1366 1 71 ARG QB 1 71 ARG HD3 . . 3.600 2.374 2.040 3.218 . 0 0 "[ . 1 . 2]" 1
1367 1 71 ARG QB 1 72 ASN H . . 3.680 2.767 2.591 3.062 . 0 0 "[ . 1 . 2]" 1
1368 1 71 ARG QB 1 72 ASN HB2 . . 4.570 4.096 3.926 4.372 . 0 0 "[ . 1 . 2]" 1
1369 1 71 ARG HG2 1 72 ASN H . . 5.210 5.081 4.714 5.224 0.014 4 0 "[ . 1 . 2]" 1
1370 1 71 ARG HG3 1 72 ASN H . . 4.950 4.699 4.310 5.091 0.141 14 0 "[ . 1 . 2]" 1
1371 1 72 ASN H 1 72 ASN HB2 . . 3.230 2.433 2.341 2.512 . 0 0 "[ . 1 . 2]" 1
1372 1 72 ASN H 1 72 ASN HB3 . . 3.630 3.622 3.567 3.680 0.050 9 0 "[ . 1 . 2]" 1
1373 1 72 ASN H 1 73 LYS H . . 3.240 3.142 2.862 3.237 . 0 0 "[ . 1 . 2]" 1
1374 1 72 ASN H 1 76 ILE MD . . 4.630 4.009 3.729 4.271 . 0 0 "[ . 1 . 2]" 1
1375 1 72 ASN HA 1 75 LYS H . . 4.790 3.160 2.942 3.344 . 0 0 "[ . 1 . 2]" 1
1376 1 72 ASN HA 1 75 LYS QB . . 4.500 3.346 2.933 4.404 . 0 0 "[ . 1 . 2]" 1
1377 1 72 ASN HA 1 75 LYS HG2 . . 4.640 3.613 3.070 4.724 0.084 1 0 "[ . 1 . 2]" 1
1378 1 72 ASN HB2 1 73 LYS H . . 4.910 4.433 4.353 4.486 . 0 0 "[ . 1 . 2]" 1
1379 1 72 ASN HB2 1 76 ILE MD . . 4.280 3.434 2.999 3.693 . 0 0 "[ . 1 . 2]" 1
1380 1 72 ASN HB2 1 76 ILE HG13 . . 4.330 3.501 3.010 3.892 . 0 0 "[ . 1 . 2]" 1
1381 1 72 ASN HB3 1 75 LYS QB . . 4.330 2.374 2.002 4.192 . 0 0 "[ . 1 . 2]" 1
1382 1 72 ASN HB3 1 76 ILE MD . . 4.210 3.743 3.495 4.036 . 0 0 "[ . 1 . 2]" 1
1383 1 72 ASN HB3 1 76 ILE HG13 . . 4.260 2.929 2.480 3.182 . 0 0 "[ . 1 . 2]" 1
1384 1 73 LYS H 1 73 LYS HB2 . . 3.590 3.601 3.541 3.654 0.064 9 0 "[ . 1 . 2]" 1
1385 1 73 LYS H 1 73 LYS HB3 . . 3.490 2.590 2.363 2.704 . 0 0 "[ . 1 . 2]" 1
1386 1 73 LYS H 1 73 LYS QD . . 4.700 4.032 3.230 4.243 . 0 0 "[ . 1 . 2]" 1
1387 1 73 LYS H 1 73 LYS HG2 . . 3.750 2.223 1.944 2.756 . 0 0 "[ . 1 . 2]" 1
1388 1 73 LYS H 1 73 LYS HG3 . . 4.100 3.113 2.378 3.642 . 0 0 "[ . 1 . 2]" 1
1389 1 73 LYS H 1 74 ALA H . . 3.940 2.363 2.227 2.568 . 0 0 "[ . 1 . 2]" 1
1390 1 73 LYS H 1 76 ILE MD . . 4.290 4.184 4.060 4.293 0.003 12 0 "[ . 1 . 2]" 1
1391 1 73 LYS HA 1 73 LYS HG3 . . 3.950 3.652 3.540 3.830 . 0 0 "[ . 1 . 2]" 1
1392 1 73 LYS HA 1 75 LYS H . . 4.690 4.455 3.975 4.702 0.012 11 0 "[ . 1 . 2]" 1
1393 1 73 LYS HA 1 76 ILE H . . 4.350 3.584 3.353 3.828 . 0 0 "[ . 1 . 2]" 1
1394 1 73 LYS HA 1 76 ILE HB . . 4.070 2.753 2.405 3.037 . 0 0 "[ . 1 . 2]" 1
1395 1 73 LYS HA 1 76 ILE MD . . 3.100 2.165 2.008 2.536 . 0 0 "[ . 1 . 2]" 1
1396 1 73 LYS HA 1 76 ILE HG13 . . 4.190 3.919 3.636 4.194 0.004 12 0 "[ . 1 . 2]" 1
1397 1 73 LYS HB2 1 73 LYS HE2 . . 5.160 4.211 3.189 4.942 . 0 0 "[ . 1 . 2]" 1
1398 1 73 LYS HB2 1 74 ALA H . . 5.110 4.193 3.812 4.559 . 0 0 "[ . 1 . 2]" 1
1399 1 73 LYS HB3 1 73 LYS HE2 . . 4.660 3.738 2.378 4.879 0.219 9 0 "[ . 1 . 2]" 1
1400 1 73 LYS HB3 1 74 ALA H . . 4.500 4.112 3.717 4.399 . 0 0 "[ . 1 . 2]" 1
1401 1 73 LYS HE2 1 73 LYS HG2 . . 3.320 2.984 1.974 3.712 0.392 7 0 "[ . 1 . 2]" 1
1402 1 73 LYS HE2 1 73 LYS HG3 . . 3.810 3.738 2.117 4.282 0.472 7 0 "[ . 1 . 2]" 1
1403 1 73 LYS HG2 1 74 ALA H . . 4.570 2.923 1.953 4.286 . 0 0 "[ . 1 . 2]" 1
1404 1 73 LYS HG3 1 74 ALA H . . 4.360 2.759 2.165 3.525 . 0 0 "[ . 1 . 2]" 1
1405 1 73 LYS HG3 1 74 ALA HA . . 5.000 3.499 3.073 3.860 . 0 0 "[ . 1 . 2]" 1
1406 1 74 ALA H 1 74 ALA MB . . 3.030 2.174 1.946 2.377 . 0 0 "[ . 1 . 2]" 1
1407 1 74 ALA H 1 75 LYS H . . 3.720 2.287 1.901 2.670 . 0 0 "[ . 1 . 2]" 1
1408 1 74 ALA MB 1 75 LYS H . . 3.450 2.718 2.504 3.079 . 0 0 "[ . 1 . 2]" 1
1409 1 75 LYS H 1 75 LYS QB . . 3.410 2.465 2.430 2.559 . 0 0 "[ . 1 . 2]" 1
1410 1 75 LYS H 1 75 LYS QD . . 4.350 3.658 3.041 3.947 . 0 0 "[ . 1 . 2]" 1
1411 1 75 LYS H 1 75 LYS HG2 . . 3.910 2.205 1.940 3.315 . 0 0 "[ . 1 . 2]" 1
1412 1 75 LYS H 1 75 LYS HG3 . . 4.040 3.127 2.002 3.519 . 0 0 "[ . 1 . 2]" 1
1413 1 75 LYS H 1 76 ILE H . . 3.360 2.582 2.132 2.818 . 0 0 "[ . 1 . 2]" 1
1414 1 75 LYS HA 1 75 LYS QD . . 4.150 2.611 1.999 4.170 0.020 9 0 "[ . 1 . 2]" 1
1415 1 75 LYS HA 1 75 LYS HG2 . . 3.310 2.835 2.424 3.583 0.273 9 0 "[ . 1 . 2]" 1
1416 1 75 LYS HA 1 75 LYS HG3 . . 3.830 3.692 3.149 3.939 0.109 9 0 "[ . 1 . 2]" 1
1417 1 75 LYS QB 1 76 ILE H . . 4.040 2.750 2.507 3.564 . 0 0 "[ . 1 . 2]" 1
1418 1 75 LYS QE 1 75 LYS HG3 . . 3.610 2.422 1.996 3.256 . 0 0 "[ . 1 . 2]" 1
1419 1 75 LYS HG2 1 76 ILE H . . 4.280 4.255 2.034 4.995 0.715 1 3 "[+ . 1 .*- 2]" 1
1420 1 76 ILE H 1 76 ILE HB . . 3.270 2.207 2.164 2.275 . 0 0 "[ . 1 . 2]" 1
1421 1 76 ILE H 1 76 ILE MD . . 4.160 3.386 3.287 3.483 . 0 0 "[ . 1 . 2]" 1
1422 1 76 ILE H 1 76 ILE HG12 . . 3.830 3.802 3.649 3.844 0.014 3 0 "[ . 1 . 2]" 1
1423 1 76 ILE H 1 76 ILE HG13 . . 3.550 2.498 2.322 2.573 . 0 0 "[ . 1 . 2]" 1
1424 1 76 ILE H 1 76 ILE MG . . 3.840 3.633 3.607 3.670 . 0 0 "[ . 1 . 2]" 1
1425 1 76 ILE HA 1 76 ILE MD . . 3.970 3.765 3.746 3.786 . 0 0 "[ . 1 . 2]" 1
1426 1 76 ILE HA 1 76 ILE HG12 . . 3.620 2.533 2.470 2.599 . 0 0 "[ . 1 . 2]" 1
1427 1 76 ILE HA 1 76 ILE HG13 . . 3.640 2.536 2.465 2.642 . 0 0 "[ . 1 . 2]" 1
1428 1 76 ILE HA 1 76 ILE MG . . 3.370 2.634 2.558 2.699 . 0 0 "[ . 1 . 2]" 1
1429 1 76 ILE HA 1 77 LYS H . . 2.790 2.297 2.252 2.346 . 0 0 "[ . 1 . 2]" 1
1430 1 76 ILE HB 1 76 ILE MD . . 3.330 2.233 2.108 2.316 . 0 0 "[ . 1 . 2]" 1
1431 1 76 ILE HG12 1 77 LYS H . . 4.720 3.787 3.658 3.940 . 0 0 "[ . 1 . 2]" 1
1432 1 76 ILE MG 1 77 LYS H . . 3.690 2.196 1.970 2.494 . 0 0 "[ . 1 . 2]" 1
1433 1 76 ILE MG 1 77 LYS HA . . 4.190 3.166 3.086 3.248 . 0 0 "[ . 1 . 2]" 1
1434 1 76 ILE MG 1 78 PHE QD . . 3.610 2.773 2.618 2.938 . 0 0 "[ . 1 . 2]" 1
1435 1 76 ILE MG 1 78 PHE QE . . 3.660 2.418 2.138 2.836 . 0 0 "[ . 1 . 2]" 1
1436 1 77 LYS H 1 77 LYS HB2 . . 4.000 3.075 3.011 3.180 . 0 0 "[ . 1 . 2]" 1
1437 1 77 LYS H 1 77 LYS HB3 . . 3.820 3.178 3.066 3.257 . 0 0 "[ . 1 . 2]" 1
1438 1 77 LYS HA 1 77 LYS QD . . 5.050 3.729 3.550 3.968 . 0 0 "[ . 1 . 2]" 1
1439 1 77 LYS HA 1 77 LYS HG2 . . 4.160 2.793 2.060 3.063 . 0 0 "[ . 1 . 2]" 1
1440 1 77 LYS HA 1 77 LYS HG3 . . 3.790 2.302 2.043 3.133 . 0 0 "[ . 1 . 2]" 1
1441 1 77 LYS HA 1 78 PHE H . . 3.040 2.270 2.197 2.366 . 0 0 "[ . 1 . 2]" 1
1442 1 77 LYS HA 1 78 PHE HB2 . . 4.860 4.185 4.107 4.257 . 0 0 "[ . 1 . 2]" 1
1443 1 77 LYS HA 1 78 PHE QD . . 4.730 3.134 2.861 3.468 . 0 0 "[ . 1 . 2]" 1
1444 1 77 LYS HB2 1 78 PHE H . . 4.790 4.346 4.199 4.485 . 0 0 "[ . 1 . 2]" 1
1445 1 77 LYS HB2 1 79 ILE MD . . 4.570 4.265 4.031 4.585 0.015 14 0 "[ . 1 . 2]" 1
1446 1 77 LYS HB3 1 78 PHE H . . 4.290 3.754 3.523 3.994 . 0 0 "[ . 1 . 2]" 1
1447 1 77 LYS HB3 1 79 ILE MD . . 3.520 2.837 2.590 3.182 . 0 0 "[ . 1 . 2]" 1
1448 1 77 LYS QD 1 79 ILE MD . . 3.980 3.448 1.943 3.922 . 0 0 "[ . 1 . 2]" 1
1449 1 77 LYS QE 1 79 ILE MD . . 3.820 3.373 2.324 3.781 . 0 0 "[ . 1 . 2]" 1
1450 1 77 LYS HG2 1 78 PHE H . . 4.390 2.762 2.149 3.373 . 0 0 "[ . 1 . 2]" 1
1451 1 77 LYS HG2 1 79 ILE MD . . 3.970 3.056 2.624 3.964 . 0 0 "[ . 1 . 2]" 1
1452 1 77 LYS HG3 1 78 PHE H . . 4.410 3.224 2.774 4.203 . 0 0 "[ . 1 . 2]" 1
1453 1 77 LYS HG3 1 79 ILE MD . . 4.400 4.299 4.047 4.413 0.013 13 0 "[ . 1 . 2]" 1
1454 1 78 PHE H 1 78 PHE HB2 . . 3.570 2.143 2.029 2.241 . 0 0 "[ . 1 . 2]" 1
1455 1 78 PHE H 1 78 PHE HB3 . . 3.980 3.426 3.343 3.495 . 0 0 "[ . 1 . 2]" 1
1456 1 78 PHE H 1 78 PHE QD . . 3.950 2.633 2.282 2.909 . 0 0 "[ . 1 . 2]" 1
1457 1 78 PHE HA 1 78 PHE QD . . 4.300 2.853 2.498 3.053 . 0 0 "[ . 1 . 2]" 1
1458 1 78 PHE HA 1 79 ILE H . . 2.930 2.212 2.193 2.252 . 0 0 "[ . 1 . 2]" 1
1459 1 78 PHE HA 1 79 ILE HB . . 4.990 4.583 4.276 4.800 . 0 0 "[ . 1 . 2]" 1
1460 1 78 PHE HA 1 79 ILE MD . . 4.240 3.356 2.815 4.151 . 0 0 "[ . 1 . 2]" 1
1461 1 78 PHE HB2 1 79 ILE H . . 4.740 4.440 4.319 4.560 . 0 0 "[ . 1 . 2]" 1
1462 1 78 PHE HB2 1 80 ILE MD . . 4.710 4.588 4.401 4.723 0.013 20 0 "[ . 1 . 2]" 1
1463 1 78 PHE HB2 1 80 ILE HG13 . . 4.790 4.709 4.485 4.828 0.038 18 0 "[ . 1 . 2]" 1
1464 1 78 PHE HB3 1 79 ILE H . . 4.410 3.464 3.226 3.700 . 0 0 "[ . 1 . 2]" 1
1465 1 78 PHE HB3 1 80 ILE MD . . 3.920 3.358 3.106 3.602 . 0 0 "[ . 1 . 2]" 1
1466 1 78 PHE HB3 1 80 ILE HG12 . . 4.770 3.411 3.084 3.737 . 0 0 "[ . 1 . 2]" 1
1467 1 78 PHE HB3 1 80 ILE HG13 . . 4.340 3.631 3.301 3.953 . 0 0 "[ . 1 . 2]" 1
1468 1 78 PHE QD 1 80 ILE MD . . 3.830 3.434 3.149 3.817 . 0 0 "[ . 1 . 2]" 1
1469 1 79 ILE H 1 79 ILE HB . . 3.540 2.517 2.253 2.689 . 0 0 "[ . 1 . 2]" 1
1470 1 79 ILE H 1 79 ILE MD . . 4.970 2.816 2.254 3.595 . 0 0 "[ . 1 . 2]" 1
1471 1 79 ILE H 1 79 ILE HG12 . . 4.220 2.977 2.230 4.230 0.010 5 0 "[ . 1 . 2]" 1
1472 1 79 ILE H 1 79 ILE HG13 . . 4.280 4.010 3.714 4.292 0.012 16 0 "[ . 1 . 2]" 1
1473 1 79 ILE H 1 79 ILE MG . . 4.000 3.754 3.592 3.869 . 0 0 "[ . 1 . 2]" 1
1474 1 79 ILE HA 1 79 ILE MD . . 3.100 2.107 1.906 2.379 . 0 0 "[ . 1 . 2]" 1
1475 1 79 ILE HA 1 79 ILE MG . . 3.160 2.324 2.155 2.584 . 0 0 "[ . 1 . 2]" 1
1476 1 79 ILE HA 1 80 ILE H . . 2.710 2.206 2.176 2.244 . 0 0 "[ . 1 . 2]" 1
1477 1 79 ILE HA 1 80 ILE HB . . 4.910 4.646 4.561 4.693 . 0 0 "[ . 1 . 2]" 1
1478 1 79 ILE HA 1 80 ILE HG12 . . 4.020 3.806 3.389 4.065 0.045 17 0 "[ . 1 . 2]" 1
1479 1 79 ILE MD 1 80 ILE H . . 4.250 3.867 3.555 4.251 0.001 5 0 "[ . 1 . 2]" 1
1480 1 79 ILE HG12 1 79 ILE MG . . 3.430 2.953 2.364 3.228 . 0 0 "[ . 1 . 2]" 1
1481 1 79 ILE HG13 1 79 ILE MG . . 3.330 2.252 2.087 2.412 . 0 0 "[ . 1 . 2]" 1
1482 1 79 ILE MG 1 80 ILE H . . 3.540 2.493 2.273 2.806 . 0 0 "[ . 1 . 2]" 1
1483 1 79 ILE MG 1 80 ILE HA . . 4.510 3.779 3.338 4.024 . 0 0 "[ . 1 . 2]" 1
1484 1 79 ILE MG 1 80 ILE HB . . 4.880 4.857 4.727 4.932 0.052 11 0 "[ . 1 . 2]" 1
1485 1 79 ILE MG 1 81 LYS H . . 4.430 3.937 3.598 4.184 . 0 0 "[ . 1 . 2]" 1
1486 1 79 ILE MG 1 81 LYS HA . . 4.770 4.342 4.082 4.519 . 0 0 "[ . 1 . 2]" 1
1487 1 79 ILE MG 1 81 LYS HD2 . . 4.430 3.978 3.039 4.471 0.041 9 0 "[ . 1 . 2]" 1
1488 1 79 ILE MG 1 81 LYS HD3 . . 4.360 4.433 4.339 4.541 0.181 14 0 "[ . 1 . 2]" 1
1489 1 79 ILE MG 1 81 LYS HE2 . . 3.880 2.674 1.939 3.681 . 0 0 "[ . 1 . 2]" 1
1490 1 79 ILE MG 1 81 LYS HE3 . . 3.860 3.232 2.047 3.883 0.023 15 0 "[ . 1 . 2]" 1
1491 1 79 ILE MG 1 81 LYS HG2 . . 3.670 3.077 2.562 3.600 . 0 0 "[ . 1 . 2]" 1
1492 1 79 ILE MG 1 81 LYS HG3 . . 3.650 2.738 2.516 3.521 . 0 0 "[ . 1 . 2]" 1
1493 1 80 ILE H 1 80 ILE HB . . 3.410 2.772 2.579 2.904 . 0 0 "[ . 1 . 2]" 1
1494 1 80 ILE H 1 80 ILE MD . . 4.510 4.215 3.955 4.428 . 0 0 "[ . 1 . 2]" 1
1495 1 80 ILE H 1 80 ILE HG12 . . 4.360 3.109 2.633 3.459 . 0 0 "[ . 1 . 2]" 1
1496 1 80 ILE H 1 80 ILE HG13 . . 4.120 3.355 2.870 3.970 . 0 0 "[ . 1 . 2]" 1
1497 1 80 ILE H 1 80 ILE MG . . 3.880 3.900 3.822 3.952 0.072 8 0 "[ . 1 . 2]" 1
1498 1 80 ILE HA 1 80 ILE MD . . 3.910 3.057 2.332 3.650 . 0 0 "[ . 1 . 2]" 1
1499 1 80 ILE HA 1 80 ILE HG12 . . 3.770 2.665 2.489 2.907 . 0 0 "[ . 1 . 2]" 1
1500 1 80 ILE HA 1 80 ILE HG13 . . 3.880 3.644 3.496 3.825 . 0 0 "[ . 1 . 2]" 1
1501 1 80 ILE HA 1 80 ILE MG . . 3.260 2.349 2.292 2.386 . 0 0 "[ . 1 . 2]" 1
1502 1 80 ILE HA 1 81 LYS H . . 3.060 2.181 2.176 2.182 . 0 0 "[ . 1 . 2]" 1
1503 1 80 ILE HA 1 82 LYS H . . 4.360 3.407 3.210 3.695 . 0 0 "[ . 1 . 2]" 1
1504 1 80 ILE HB 1 80 ILE MD . . 3.530 2.849 2.551 3.180 . 0 0 "[ . 1 . 2]" 1
1505 1 80 ILE HB 1 83 PRO HA . . 4.830 4.549 4.276 4.762 . 0 0 "[ . 1 . 2]" 1
1506 1 80 ILE MD 1 86 PHE QE . . 3.440 2.724 2.445 3.160 . 0 0 "[ . 1 . 2]" 1
1507 1 80 ILE MD 1 86 PHE HZ . . 4.510 2.822 2.271 3.446 . 0 0 "[ . 1 . 2]" 1
1508 1 80 ILE HG12 1 80 ILE MG . . 3.550 2.917 2.645 3.221 . 0 0 "[ . 1 . 2]" 1
1509 1 80 ILE HG13 1 80 ILE MG . . 3.630 2.943 2.496 3.193 . 0 0 "[ . 1 . 2]" 1
1510 1 80 ILE MG 1 81 LYS H . . 3.970 3.042 2.792 3.125 . 0 0 "[ . 1 . 2]" 1
1511 1 80 ILE MG 1 81 LYS HA . . 4.680 4.154 4.048 4.222 . 0 0 "[ . 1 . 2]" 1
1512 1 80 ILE MG 1 82 LYS H . . 3.390 2.439 1.916 2.907 . 0 0 "[ . 1 . 2]" 1
1513 1 80 ILE MG 1 82 LYS HA . . 4.690 4.009 3.908 4.153 . 0 0 "[ . 1 . 2]" 1
1514 1 80 ILE MG 1 83 PRO HA . . 3.010 2.276 2.115 2.381 . 0 0 "[ . 1 . 2]" 1
1515 1 80 ILE MG 1 83 PRO HB2 . . 3.900 3.681 3.473 3.906 0.006 7 0 "[ . 1 . 2]" 1
1516 1 80 ILE MG 1 83 PRO HB3 . . 3.600 2.326 2.067 2.616 . 0 0 "[ . 1 . 2]" 1
1517 1 80 ILE MG 1 83 PRO HD2 . . 4.360 4.070 3.872 4.222 . 0 0 "[ . 1 . 2]" 1
1518 1 80 ILE MG 1 83 PRO HD3 . . 3.780 2.938 2.658 3.134 . 0 0 "[ . 1 . 2]" 1
1519 1 80 ILE MG 1 83 PRO HG2 . . 4.780 4.297 4.004 4.548 . 0 0 "[ . 1 . 2]" 1
1520 1 80 ILE MG 1 83 PRO HG3 . . 4.600 3.372 2.960 3.685 . 0 0 "[ . 1 . 2]" 1
1521 1 80 ILE MG 1 86 PHE QB . . 3.790 3.301 3.037 3.601 . 0 0 "[ . 1 . 2]" 1
1522 1 80 ILE MG 1 86 PHE QD . . 3.400 3.083 2.794 3.425 0.025 11 0 "[ . 1 . 2]" 1
1523 1 80 ILE MG 1 86 PHE QE . . 4.820 3.195 2.755 3.913 . 0 0 "[ . 1 . 2]" 1
1524 1 81 LYS H 1 81 LYS HB2 . . 3.710 2.508 2.312 2.601 . 0 0 "[ . 1 . 2]" 1
1525 1 81 LYS H 1 81 LYS HB3 . . 3.950 3.635 3.555 3.670 . 0 0 "[ . 1 . 2]" 1
1526 1 81 LYS H 1 81 LYS HG2 . . 3.950 3.438 2.497 3.966 0.016 2 0 "[ . 1 . 2]" 1
1527 1 81 LYS H 1 81 LYS HG3 . . 3.730 2.587 2.428 2.915 . 0 0 "[ . 1 . 2]" 1
1528 1 81 LYS H 1 82 LYS H . . 3.480 2.160 2.081 2.248 . 0 0 "[ . 1 . 2]" 1
1529 1 81 LYS HA 1 81 LYS HD2 . . 4.500 4.631 4.421 4.855 0.355 14 0 "[ . 1 . 2]" 1
1530 1 81 LYS HA 1 81 LYS HD3 . . 4.750 4.161 3.356 4.487 . 0 0 "[ . 1 . 2]" 1
1531 1 81 LYS HA 1 81 LYS HG2 . . 3.270 2.499 2.333 2.740 . 0 0 "[ . 1 . 2]" 1
1532 1 81 LYS HA 1 81 LYS HG3 . . 3.770 3.183 2.710 3.744 . 0 0 "[ . 1 . 2]" 1
1533 1 81 LYS HA 1 83 PRO HD3 . . 4.520 3.568 3.356 4.032 . 0 0 "[ . 1 . 2]" 1
1534 1 81 LYS HB2 1 82 LYS H . . 4.730 3.242 2.815 3.703 . 0 0 "[ . 1 . 2]" 1
1535 1 81 LYS HB2 1 82 LYS HG3 . . 4.730 3.247 2.921 4.180 . 0 0 "[ . 1 . 2]" 1
1536 1 81 LYS HB3 1 82 LYS H . . 4.490 4.173 3.769 4.488 . 0 0 "[ . 1 . 2]" 1
1537 1 81 LYS HB3 1 82 LYS HG3 . . 4.620 3.918 3.623 4.621 0.001 7 0 "[ . 1 . 2]" 1
1538 1 81 LYS HE2 1 81 LYS HG2 . . 4.260 2.445 2.021 3.143 . 0 0 "[ . 1 . 2]" 1
1539 1 81 LYS HE2 1 81 LYS HG3 . . 4.200 2.770 2.271 3.792 . 0 0 "[ . 1 . 2]" 1
1540 1 81 LYS HE3 1 81 LYS HG2 . . 3.940 3.446 2.236 3.782 . 0 0 "[ . 1 . 2]" 1
1541 1 81 LYS HG3 1 82 LYS H . . 4.620 4.458 4.314 4.649 0.029 14 0 "[ . 1 . 2]" 1
1542 1 82 LYS H 1 82 LYS HB2 . . 3.770 2.699 2.470 2.847 . 0 0 "[ . 1 . 2]" 1
1543 1 82 LYS H 1 82 LYS HB3 . . 4.160 3.779 3.636 3.872 . 0 0 "[ . 1 . 2]" 1
1544 1 82 LYS H 1 82 LYS HG2 . . 4.480 3.716 3.195 4.035 . 0 0 "[ . 1 . 2]" 1
1545 1 82 LYS H 1 82 LYS HG3 . . 4.160 3.423 2.931 3.932 . 0 0 "[ . 1 . 2]" 1
1546 1 82 LYS H 1 83 PRO HD2 . . 4.590 4.300 3.984 4.584 . 0 0 "[ . 1 . 2]" 1
1547 1 82 LYS H 1 83 PRO HD3 . . 4.240 3.162 2.741 3.573 . 0 0 "[ . 1 . 2]" 1
1548 1 82 LYS HA 1 82 LYS HD2 . . 4.720 4.623 4.330 4.860 0.140 5 0 "[ . 1 . 2]" 1
1549 1 82 LYS HA 1 82 LYS HD3 . . 5.000 3.784 3.207 4.030 . 0 0 "[ . 1 . 2]" 1
1550 1 82 LYS HA 1 82 LYS HG2 . . 3.580 2.265 2.126 2.537 . 0 0 "[ . 1 . 2]" 1
1551 1 82 LYS HA 1 82 LYS HG3 . . 3.990 3.353 3.169 3.590 . 0 0 "[ . 1 . 2]" 1
1552 1 82 LYS HA 1 83 PRO HD2 . . 2.930 2.251 2.186 2.304 . 0 0 "[ . 1 . 2]" 1
1553 1 82 LYS HA 1 83 PRO HD3 . . 3.190 2.455 2.266 2.567 . 0 0 "[ . 1 . 2]" 1
1554 1 82 LYS HA 1 83 PRO HG2 . . 4.620 4.473 4.386 4.533 . 0 0 "[ . 1 . 2]" 1
1555 1 82 LYS HA 1 83 PRO HG3 . . 4.870 4.579 4.425 4.674 . 0 0 "[ . 1 . 2]" 1
1556 1 82 LYS HA 1 84 GLU H . . 4.620 3.176 2.974 3.458 . 0 0 "[ . 1 . 2]" 1
1557 1 82 LYS HB2 1 82 LYS HD3 . . 4.160 3.169 2.885 3.372 . 0 0 "[ . 1 . 2]" 1
1558 1 82 LYS HB2 1 83 PRO HD2 . . 5.220 5.061 4.860 5.112 . 0 0 "[ . 1 . 2]" 1
1559 1 82 LYS HB2 1 85 MET QB . . 4.620 3.373 2.753 3.973 . 0 0 "[ . 1 . 2]" 1
1560 1 82 LYS HB2 1 85 MET HG3 . . 4.710 3.809 2.768 4.658 . 0 0 "[ . 1 . 2]" 1
1561 1 82 LYS HB3 1 82 LYS HD2 . . 3.930 3.040 2.763 3.390 . 0 0 "[ . 1 . 2]" 1
1562 1 82 LYS HB3 1 82 LYS HD3 . . 4.150 2.132 2.005 2.319 . 0 0 "[ . 1 . 2]" 1
1563 1 82 LYS HB3 1 82 LYS HE2 . . 4.880 4.078 3.396 4.423 . 0 0 "[ . 1 . 2]" 1
1564 1 82 LYS HB3 1 82 LYS HE3 . . 4.880 4.404 3.872 4.732 . 0 0 "[ . 1 . 2]" 1
1565 1 82 LYS HB3 1 85 MET H . . 4.220 3.298 2.872 3.676 . 0 0 "[ . 1 . 2]" 1
1566 1 82 LYS HB3 1 85 MET QB . . 4.280 3.017 2.351 3.428 . 0 0 "[ . 1 . 2]" 1
1567 1 82 LYS HB3 1 85 MET HG3 . . 4.490 2.714 2.019 3.260 . 0 0 "[ . 1 . 2]" 1
1568 1 82 LYS HD2 1 85 MET ME . . 4.560 4.130 3.674 4.439 . 0 0 "[ . 1 . 2]" 1
1569 1 82 LYS HD3 1 85 MET ME . . 4.520 4.242 3.736 4.549 0.029 10 0 "[ . 1 . 2]" 1
1570 1 82 LYS HE2 1 82 LYS HG2 . . 3.930 2.634 2.060 3.545 . 0 0 "[ . 1 . 2]" 1
1571 1 82 LYS HE2 1 82 LYS HG3 . . 4.020 3.444 2.677 4.040 0.020 13 0 "[ . 1 . 2]" 1
1572 1 82 LYS HE3 1 82 LYS HG2 . . 4.050 2.694 1.982 3.581 . 0 0 "[ . 1 . 2]" 1
1573 1 82 LYS HE3 1 82 LYS HG3 . . 4.110 3.011 2.416 3.547 . 0 0 "[ . 1 . 2]" 1
1574 1 82 LYS HG2 1 83 PRO HD2 . . 4.930 4.313 4.136 4.617 . 0 0 "[ . 1 . 2]" 1
1575 1 83 PRO HA 1 85 MET H . . 4.340 3.577 3.261 4.074 . 0 0 "[ . 1 . 2]" 1
1576 1 83 PRO HA 1 86 PHE H . . 4.140 3.037 2.776 3.388 . 0 0 "[ . 1 . 2]" 1
1577 1 83 PRO HA 1 86 PHE QB . . 3.570 2.307 1.973 2.638 . 0 0 "[ . 1 . 2]" 1
1578 1 83 PRO HA 1 86 PHE QD . . 3.910 3.395 3.160 3.718 . 0 0 "[ . 1 . 2]" 1
1579 1 83 PRO HB2 1 84 GLU H . . 4.470 3.673 3.367 3.933 . 0 0 "[ . 1 . 2]" 1
1580 1 83 PRO HB2 1 84 GLU HA . . 4.970 4.178 4.051 4.292 . 0 0 "[ . 1 . 2]" 1
1581 1 83 PRO HD2 1 84 GLU H . . 4.040 2.387 2.254 2.585 . 0 0 "[ . 1 . 2]" 1
1582 1 83 PRO HD3 1 84 GLU H . . 4.630 3.695 3.656 3.770 . 0 0 "[ . 1 . 2]" 1
1583 1 83 PRO HG3 1 84 GLU H . . 4.240 4.393 4.127 4.648 0.408 14 0 "[ . 1 . 2]" 1
1584 1 84 GLU H 1 84 GLU HB2 . . 3.810 3.554 3.530 3.583 . 0 0 "[ . 1 . 2]" 1
1585 1 84 GLU H 1 84 GLU HB3 . . 3.430 2.523 2.351 2.796 . 0 0 "[ . 1 . 2]" 1
1586 1 84 GLU H 1 84 GLU HG2 . . 4.180 2.274 1.954 2.987 . 0 0 "[ . 1 . 2]" 1
1587 1 84 GLU H 1 84 GLU HG3 . . 4.220 3.145 2.112 3.874 . 0 0 "[ . 1 . 2]" 1
1588 1 84 GLU H 1 85 MET H . . 3.510 2.584 2.344 2.718 . 0 0 "[ . 1 . 2]" 1
1589 1 84 GLU HA 1 84 GLU HB2 . . 2.950 2.469 2.359 2.570 . 0 0 "[ . 1 . 2]" 1
1590 1 84 GLU HA 1 84 GLU HB3 . . 2.990 2.472 2.380 2.598 . 0 0 "[ . 1 . 2]" 1
1591 1 84 GLU HA 1 84 GLU HG2 . . 3.710 3.768 3.561 4.191 0.481 15 0 "[ . 1 . 2]" 1
1592 1 84 GLU HA 1 84 GLU HG3 . . 4.260 3.770 3.556 4.154 . 0 0 "[ . 1 . 2]" 1
1593 1 84 GLU HA 1 86 PHE H . . 4.280 3.891 3.635 4.288 0.008 15 0 "[ . 1 . 2]" 1
1594 1 84 GLU HA 1 87 GLU H . . 4.270 3.568 3.310 3.816 . 0 0 "[ . 1 . 2]" 1
1595 1 84 GLU HA 1 87 GLU HB2 . . 4.530 3.334 2.769 5.461 0.931 12 1 "[ . 1 + . 2]" 1
1596 1 84 GLU HA 1 87 GLU QG . . 4.220 3.845 3.474 4.115 . 0 0 "[ . 1 . 2]" 1
1597 1 84 GLU HB2 1 85 MET H . . 4.600 4.155 3.938 4.396 . 0 0 "[ . 1 . 2]" 1
1598 1 84 GLU HB3 1 85 MET H . . 4.550 4.191 3.851 4.349 . 0 0 "[ . 1 . 2]" 1
1599 1 84 GLU HG2 1 85 MET H . . 4.680 2.913 1.953 3.973 . 0 0 "[ . 1 . 2]" 1
1600 1 84 GLU HG3 1 85 MET H . . 4.250 2.906 2.175 4.165 . 0 0 "[ . 1 . 2]" 1
1601 1 84 GLU HG3 1 85 MET HG3 . . 4.490 3.197 2.093 4.252 . 0 0 "[ . 1 . 2]" 1
1602 1 85 MET H 1 85 MET QB . . 3.300 2.226 2.113 2.350 . 0 0 "[ . 1 . 2]" 1
1603 1 85 MET H 1 85 MET HG2 . . 4.060 3.315 2.608 4.000 . 0 0 "[ . 1 . 2]" 1
1604 1 85 MET H 1 85 MET HG3 . . 3.820 3.132 2.483 3.598 . 0 0 "[ . 1 . 2]" 1
1605 1 85 MET H 1 86 PHE H . . 3.250 2.324 2.092 2.553 . 0 0 "[ . 1 . 2]" 1
1606 1 85 MET H 1 86 PHE QB . . 4.620 3.801 3.607 3.989 . 0 0 "[ . 1 . 2]" 1
1607 1 85 MET H 1 86 PHE QD . . 4.540 4.133 3.860 4.473 . 0 0 "[ . 1 . 2]" 1
1608 1 85 MET HA 1 85 MET ME . . 4.200 3.992 3.796 4.179 . 0 0 "[ . 1 . 2]" 1
1609 1 85 MET HA 1 85 MET HG2 . . 3.460 2.424 2.251 2.672 . 0 0 "[ . 1 . 2]" 1
1610 1 85 MET HA 1 85 MET HG3 . . 3.890 3.332 2.720 3.689 . 0 0 "[ . 1 . 2]" 1
1611 1 85 MET HA 1 87 GLU H . . 4.950 4.099 3.829 4.344 . 0 0 "[ . 1 . 2]" 1
1612 1 85 MET QB 1 85 MET ME . . 3.050 2.013 1.920 2.174 . 0 0 "[ . 1 . 2]" 1
1613 1 85 MET QB 1 86 PHE H . . 4.460 3.136 2.833 3.400 . 0 0 "[ . 1 . 2]" 1
1614 1 85 MET QB 1 86 PHE QD . . 4.810 3.384 2.960 3.686 . 0 0 "[ . 1 . 2]" 1
1615 1 85 MET ME 1 85 MET HG2 . . 3.580 3.027 2.265 3.387 . 0 0 "[ . 1 . 2]" 1
1616 1 85 MET ME 1 85 MET HG3 . . 3.800 2.739 2.332 3.384 . 0 0 "[ . 1 . 2]" 1
1617 1 86 PHE H 1 86 PHE QB . . 3.150 1.934 1.891 1.995 . 0 0 "[ . 1 . 2]" 1
1618 1 86 PHE H 1 86 PHE QD . . 3.880 3.032 2.574 3.457 . 0 0 "[ . 1 . 2]" 1
1619 1 86 PHE H 1 87 GLU H . . 3.330 2.366 2.191 2.631 . 0 0 "[ . 1 . 2]" 1
1620 1 86 PHE HA 1 86 PHE QD . . 3.680 2.893 2.736 3.023 . 0 0 "[ . 1 . 2]" 1
1621 1 86 PHE HA 1 87 GLU H . . 3.600 3.556 3.493 3.588 . 0 0 "[ . 1 . 2]" 1
1622 1 86 PHE HA 1 89 ALA H . . 4.100 3.192 3.022 3.395 . 0 0 "[ . 1 . 2]" 1
1623 1 86 PHE HA 1 89 ALA MB . . 3.620 2.891 2.447 3.200 . 0 0 "[ . 1 . 2]" 1
1624 1 86 PHE QB 1 87 GLU H . . 3.830 2.826 2.709 3.018 . 0 0 "[ . 1 . 2]" 1
1625 1 86 PHE QB 1 89 ALA MB . . 4.280 3.843 3.478 4.143 . 0 0 "[ . 1 . 2]" 1
1626 1 86 PHE QB 1 90 ILE MD . . 3.880 2.050 1.805 2.381 . 0 0 "[ . 1 . 2]" 1
1627 1 86 PHE QB 1 90 ILE HG12 . . 4.760 4.209 3.598 4.735 . 0 0 "[ . 1 . 2]" 1
1628 1 86 PHE QB 1 90 ILE HG13 . . 4.100 3.374 2.567 4.097 . 0 0 "[ . 1 . 2]" 1
1629 1 86 PHE QD 1 89 ALA MB . . 3.990 3.575 2.983 3.906 . 0 0 "[ . 1 . 2]" 1
1630 1 86 PHE QD 1 90 ILE MD . . 4.320 2.870 2.159 3.548 . 0 0 "[ . 1 . 2]" 1
1631 1 87 GLU H 1 87 GLU HB2 . . 3.290 2.132 2.034 3.530 0.240 12 0 "[ . 1 . 2]" 1
1632 1 87 GLU H 1 87 GLU HB3 . . 3.400 3.230 2.324 3.392 . 0 0 "[ . 1 . 2]" 1
1633 1 87 GLU H 1 87 GLU QG . . 4.200 3.236 2.381 3.570 . 0 0 "[ . 1 . 2]" 1
1634 1 87 GLU H 1 88 THR H . . 3.800 3.021 2.943 3.156 . 0 0 "[ . 1 . 2]" 1
1635 1 87 GLU HA 1 90 ILE H . . 4.260 3.283 2.949 3.623 . 0 0 "[ . 1 . 2]" 1
1636 1 87 GLU HA 1 90 ILE HB . . 3.560 2.377 2.116 2.650 . 0 0 "[ . 1 . 2]" 1
1637 1 87 GLU HA 1 90 ILE MD . . 3.350 2.064 1.890 2.651 . 0 0 "[ . 1 . 2]" 1
1638 1 87 GLU HA 1 90 ILE HG12 . . 4.580 4.509 4.231 4.964 0.384 18 0 "[ . 1 . 2]" 1
1639 1 87 GLU HA 1 90 ILE MG . . 4.350 3.772 3.493 3.997 . 0 0 "[ . 1 . 2]" 1
1640 1 87 GLU HA 1 91 LYS H . . 4.590 3.971 3.701 4.422 . 0 0 "[ . 1 . 2]" 1
1641 1 87 GLU HB2 1 88 THR H . . 3.780 3.202 2.920 3.759 . 0 0 "[ . 1 . 2]" 1
1642 1 87 GLU HB3 1 88 THR H . . 3.750 2.827 2.454 3.802 0.052 12 0 "[ . 1 . 2]" 1
1643 1 87 GLU QG 1 90 ILE MD . . 4.960 3.062 2.514 4.369 . 0 0 "[ . 1 . 2]" 1
1644 1 88 THR H 1 88 THR HB . . 3.450 2.329 2.234 2.542 . 0 0 "[ . 1 . 2]" 1
1645 1 88 THR H 1 88 THR MG . . 4.000 3.671 3.656 3.679 . 0 0 "[ . 1 . 2]" 1
1646 1 88 THR H 1 89 ALA H . . 3.400 2.867 2.732 3.028 . 0 0 "[ . 1 . 2]" 1
1647 1 88 THR HA 1 88 THR MG . . 3.180 2.495 2.383 2.549 . 0 0 "[ . 1 . 2]" 1
1648 1 88 THR HA 1 91 LYS H . . 4.020 3.557 3.389 3.771 . 0 0 "[ . 1 . 2]" 1
1649 1 88 THR HA 1 91 LYS QB . . 3.430 2.631 2.318 3.396 . 0 0 "[ . 1 . 2]" 1
1650 1 88 THR HA 1 91 LYS QD . . 4.400 3.441 2.282 4.141 . 0 0 "[ . 1 . 2]" 1
1651 1 88 THR HB 1 89 ALA H . . 3.560 2.748 2.544 3.061 . 0 0 "[ . 1 . 2]" 1
1652 1 88 THR MG 1 89 ALA H . . 4.190 3.484 3.202 3.759 . 0 0 "[ . 1 . 2]" 1
1653 1 88 THR MG 1 89 ALA HA . . 4.390 3.603 3.420 3.792 . 0 0 "[ . 1 . 2]" 1
1654 1 88 THR MG 1 92 GLU H . . 4.130 4.005 3.853 4.129 . 0 0 "[ . 1 . 2]" 1
1655 1 88 THR MG 1 92 GLU HG3 . . 4.180 3.305 2.339 5.030 0.850 8 1 "[ . + 1 . 2]" 1
1656 1 89 ALA H 1 89 ALA MB . . 2.990 2.068 1.946 2.174 . 0 0 "[ . 1 . 2]" 1
1657 1 89 ALA H 1 90 ILE H . . 3.300 2.643 2.462 2.873 . 0 0 "[ . 1 . 2]" 1
1658 1 89 ALA HA 1 92 GLU H . . 4.280 3.383 2.953 3.902 . 0 0 "[ . 1 . 2]" 1
1659 1 89 ALA HA 1 92 GLU HB2 . . 3.770 2.990 2.095 4.750 0.980 8 1 "[ . + 1 . 2]" 1
1660 1 89 ALA MB 1 90 ILE H . . 3.320 2.426 2.176 2.740 . 0 0 "[ . 1 . 2]" 1
1661 1 89 ALA MB 1 90 ILE HA . . 4.780 3.704 3.612 3.766 . 0 0 "[ . 1 . 2]" 1
1662 1 89 ALA MB 1 91 LYS H . . 4.350 4.299 4.073 4.364 0.014 15 0 "[ . 1 . 2]" 1
1663 1 90 ILE H 1 90 ILE HB . . 3.240 2.422 2.312 2.511 . 0 0 "[ . 1 . 2]" 1
1664 1 90 ILE H 1 90 ILE MD . . 3.550 2.794 2.214 3.379 . 0 0 "[ . 1 . 2]" 1
1665 1 90 ILE H 1 90 ILE HG12 . . 3.860 3.580 3.318 3.810 . 0 0 "[ . 1 . 2]" 1
1666 1 90 ILE H 1 90 ILE HG13 . . 3.380 2.172 1.944 2.561 . 0 0 "[ . 1 . 2]" 1
1667 1 90 ILE H 1 90 ILE MG . . 3.850 3.704 3.681 3.716 . 0 0 "[ . 1 . 2]" 1
1668 1 90 ILE H 1 91 LYS H . . 3.370 2.762 2.583 2.952 . 0 0 "[ . 1 . 2]" 1
1669 1 90 ILE HA 1 90 ILE MD . . 4.150 3.794 3.642 3.879 . 0 0 "[ . 1 . 2]" 1
1670 1 90 ILE HA 1 90 ILE HG12 . . 3.570 2.881 2.591 3.159 . 0 0 "[ . 1 . 2]" 1
1671 1 90 ILE HA 1 90 ILE HG13 . . 3.740 2.575 2.308 2.946 . 0 0 "[ . 1 . 2]" 1
1672 1 90 ILE HA 1 90 ILE MG . . 3.020 2.440 2.323 2.511 . 0 0 "[ . 1 . 2]" 1
1673 1 90 ILE HB 1 90 ILE MD . . 3.350 2.145 2.002 2.342 . 0 0 "[ . 1 . 2]" 1
1674 1 90 ILE HB 1 91 LYS H . . 3.610 2.908 2.681 3.274 . 0 0 "[ . 1 . 2]" 1
1675 1 90 ILE HG12 1 90 ILE MG . . 3.670 2.203 1.973 2.387 . 0 0 "[ . 1 . 2]" 1
1676 1 90 ILE MG 1 91 LYS H . . 3.900 3.606 3.408 3.899 . 0 0 "[ . 1 . 2]" 1
1677 1 90 ILE MG 1 91 LYS HA . . 4.000 3.599 3.385 3.867 . 0 0 "[ . 1 . 2]" 1
1678 1 91 LYS H 1 91 LYS QB . . 3.070 2.093 1.987 2.331 . 0 0 "[ . 1 . 2]" 1
1679 1 91 LYS H 1 91 LYS HG2 . . 3.870 3.864 2.647 4.328 0.458 14 0 "[ . 1 . 2]" 1
1680 1 91 LYS H 1 91 LYS HG3 . . 4.330 3.589 2.584 4.345 0.015 12 0 "[ . 1 . 2]" 1
1681 1 91 LYS H 1 92 GLU H . . 3.460 2.733 2.312 3.146 . 0 0 "[ . 1 . 2]" 1
1682 1 91 LYS HA 1 91 LYS QD . . 4.490 3.862 3.468 4.452 . 0 0 "[ . 1 . 2]" 1
1683 1 91 LYS HA 1 91 LYS HG2 . . 3.910 2.822 1.999 3.774 . 0 0 "[ . 1 . 2]" 1
1684 1 91 LYS HA 1 91 LYS HG3 . . 3.790 2.758 2.004 3.527 . 0 0 "[ . 1 . 2]" 1
1685 1 91 LYS HA 1 92 GLU H . . 3.600 3.628 3.599 3.640 0.040 16 0 "[ . 1 . 2]" 1
1686 1 91 LYS QB 1 92 GLU H . . 3.560 2.568 2.032 3.417 . 0 0 "[ . 1 . 2]" 1
1687 1 91 LYS QE 1 91 LYS HG3 . . 3.510 2.703 1.977 3.338 . 0 0 "[ . 1 . 2]" 1
1688 1 92 GLU H 1 92 GLU HB2 . . 3.430 2.375 2.094 3.549 0.119 8 0 "[ . 1 . 2]" 1
1689 1 92 GLU H 1 92 GLU HB3 . . 3.590 3.461 2.394 3.593 0.003 15 0 "[ . 1 . 2]" 1
1690 1 92 GLU H 1 92 GLU HG2 . . 4.240 3.032 2.535 3.791 . 0 0 "[ . 1 . 2]" 1
1691 1 92 GLU H 1 92 GLU HG3 . . 3.940 3.056 2.180 3.927 . 0 0 "[ . 1 . 2]" 1
1692 1 92 GLU H 1 93 SER H . . 3.880 3.088 2.606 3.720 . 0 0 "[ . 1 . 2]" 1
1693 1 92 GLU HA 1 92 GLU HG2 . . 3.510 2.369 1.998 4.136 0.626 8 1 "[ . + 1 . 2]" 1
1694 1 92 GLU HA 1 92 GLU HG3 . . 4.040 3.405 2.783 3.739 . 0 0 "[ . 1 . 2]" 1
1695 1 92 GLU HB2 1 93 SER H . . 4.370 3.266 2.104 4.682 0.312 9 0 "[ . 1 . 2]" 1
1696 1 92 GLU HB3 1 93 SER H . . 4.670 3.619 2.480 4.526 . 0 0 "[ . 1 . 2]" 1
1697 1 93 SER H 1 93 SER QB . . 3.440 2.415 2.008 2.989 . 0 0 "[ . 1 . 2]" 1
1698 1 93 SER QB 1 94 SER H . . 3.970 3.287 2.222 3.978 0.008 20 0 "[ . 1 . 2]" 1
1699 1 95 GLY HA2 1 96 PRO QD . . 3.420 2.106 1.855 2.996 . 0 0 "[ . 1 . 2]" 1
1700 1 95 GLY HA3 1 96 PRO QD . . 3.410 2.820 1.880 3.372 . 0 0 "[ . 1 . 2]" 1
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