NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
598616 |
2n2y   |
25627 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2n2y
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 1236
_Distance_constraint_stats_list.Viol_count 923
_Distance_constraint_stats_list.Viol_total 124.832
_Distance_constraint_stats_list.Viol_max 0.069
_Distance_constraint_stats_list.Viol_rms 0.0019
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0003
_Distance_constraint_stats_list.Viol_average_violations_only 0.0068
_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 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 THR 0.003 0.003 15 0 "[ . 1 . 2]"
1 8 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 ASP 0.001 0.001 11 0 "[ . 1 . 2]"
1 10 VAL 0.001 0.001 11 0 "[ . 1 . 2]"
1 11 LYS 0.153 0.019 18 0 "[ . 1 . 2]"
1 12 PRO 0.463 0.019 18 0 "[ . 1 . 2]"
1 13 LYS 0.068 0.016 11 0 "[ . 1 . 2]"
1 14 SER 0.043 0.006 7 0 "[ . 1 . 2]"
1 15 ILE 0.185 0.038 8 0 "[ . 1 . 2]"
1 16 SER 0.003 0.003 16 0 "[ . 1 . 2]"
1 17 ARG 0.055 0.010 14 0 "[ . 1 . 2]"
1 18 ALA 0.037 0.010 14 0 "[ . 1 . 2]"
1 19 LYS 0.023 0.013 18 0 "[ . 1 . 2]"
1 20 LYS 0.460 0.064 12 0 "[ . 1 . 2]"
1 21 TRP 0.701 0.064 12 0 "[ . 1 . 2]"
1 22 SER 0.002 0.002 6 0 "[ . 1 . 2]"
1 23 GLU 0.042 0.017 5 0 "[ . 1 . 2]"
1 24 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 ILE 0.259 0.021 6 0 "[ . 1 . 2]"
1 26 GLU 0.288 0.020 11 0 "[ . 1 . 2]"
1 27 ASN 0.432 0.026 11 0 "[ . 1 . 2]"
1 28 LEU 0.284 0.022 11 0 "[ . 1 . 2]"
1 29 TYR 0.002 0.002 19 0 "[ . 1 . 2]"
1 30 ARG 0.038 0.006 13 0 "[ . 1 . 2]"
1 31 PHE 0.110 0.016 16 0 "[ . 1 . 2]"
1 32 GLN 0.066 0.006 19 0 "[ . 1 . 2]"
1 33 GLN 0.001 0.001 9 0 "[ . 1 . 2]"
1 34 ALA 0.128 0.020 19 0 "[ . 1 . 2]"
1 35 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 TYR 0.488 0.023 11 0 "[ . 1 . 2]"
1 37 ARG 0.109 0.014 6 0 "[ . 1 . 2]"
1 38 ASP 0.067 0.010 19 0 "[ . 1 . 2]"
1 39 GLU 0.023 0.009 2 0 "[ . 1 . 2]"
1 40 ILE 0.088 0.034 17 0 "[ . 1 . 2]"
1 41 GLU 0.327 0.023 11 0 "[ . 1 . 2]"
1 42 TYR 0.121 0.016 13 0 "[ . 1 . 2]"
1 43 LYS 0.109 0.016 13 0 "[ . 1 . 2]"
1 44 GLN 0.001 0.001 12 0 "[ . 1 . 2]"
1 45 VAL 0.028 0.016 12 0 "[ . 1 . 2]"
1 46 LYS 0.027 0.016 12 0 "[ . 1 . 2]"
1 47 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 VAL 0.044 0.005 8 0 "[ . 1 . 2]"
1 49 ALA 0.075 0.009 16 0 "[ . 1 . 2]"
1 50 MET 0.030 0.009 16 0 "[ . 1 . 2]"
1 51 VAL 0.155 0.018 6 0 "[ . 1 . 2]"
1 52 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 ARG 0.002 0.002 17 0 "[ . 1 . 2]"
1 54 TRP 0.394 0.022 9 0 "[ . 1 . 2]"
1 55 PRO 0.148 0.013 16 0 "[ . 1 . 2]"
1 56 GLU 0.006 0.004 9 0 "[ . 1 . 2]"
1 57 THR 0.028 0.022 9 0 "[ . 1 . 2]"
1 58 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 TYR 0.179 0.017 20 0 "[ . 1 . 2]"
1 60 VAL 0.120 0.012 5 0 "[ . 1 . 2]"
1 61 LYS 0.111 0.014 20 0 "[ . 1 . 2]"
1 62 LYS 0.014 0.005 10 0 "[ . 1 . 2]"
1 63 LEU 0.584 0.053 19 0 "[ . 1 . 2]"
1 64 GLN 0.193 0.012 1 0 "[ . 1 . 2]"
1 65 ARG 0.216 0.012 1 0 "[ . 1 . 2]"
1 66 ARG 0.048 0.018 13 0 "[ . 1 . 2]"
1 67 ASP 0.117 0.013 16 0 "[ . 1 . 2]"
1 68 ASN 0.236 0.012 18 0 "[ . 1 . 2]"
1 69 THR 0.030 0.005 15 0 "[ . 1 . 2]"
1 70 PHE 0.040 0.005 15 0 "[ . 1 . 2]"
1 71 PHE 0.051 0.020 19 0 "[ . 1 . 2]"
1 72 TYR 0.009 0.004 15 0 "[ . 1 . 2]"
1 73 TYR 0.517 0.053 19 0 "[ . 1 . 2]"
1 74 ASN 0.005 0.002 2 0 "[ . 1 . 2]"
1 75 LYS 0.212 0.021 6 0 "[ . 1 . 2]"
1 76 GLU 0.160 0.069 20 0 "[ . 1 . 2]"
1 77 ARG 0.629 0.069 20 0 "[ . 1 . 2]"
1 78 GLU 0.045 0.025 9 0 "[ . 1 . 2]"
1 79 CYS 0.219 0.038 11 0 "[ . 1 . 2]"
1 80 GLU 0.013 0.004 9 0 "[ . 1 . 2]"
1 81 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 GLU 0.022 0.018 11 0 "[ . 1 . 2]"
1 84 VAL 0.169 0.026 16 0 "[ . 1 . 2]"
1 85 HIS 0.218 0.021 6 0 "[ . 1 . 2]"
1 86 LYS 0.060 0.011 5 0 "[ . 1 . 2]"
1 87 VAL 0.031 0.006 14 0 "[ . 1 . 2]"
1 88 LYS 0.143 0.019 15 0 "[ . 1 . 2]"
1 89 VAL 0.167 0.022 11 0 "[ . 1 . 2]"
1 90 TYR 0.404 0.013 17 0 "[ . 1 . 2]"
1 91 VAL 0.029 0.006 8 0 "[ . 1 . 2]"
1 92 TYR 0.038 0.011 8 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 MET HA 1 5 MET QG 2.720 . 3.640 2.690 2.163 3.309 . 0 0 "[ . 1 . 2]" 1
2 1 5 MET HB2 1 6 ALA H 3.580 . 5.360 3.885 2.570 4.501 . 0 0 "[ . 1 . 2]" 1
3 1 5 MET HB3 1 6 ALA H 3.580 . 5.360 3.511 2.624 4.274 . 0 0 "[ . 1 . 2]" 1
4 1 7 THR HA 1 7 THR MG 2.460 . 3.110 2.337 2.126 3.113 0.003 15 0 "[ . 1 . 2]" 1
5 1 8 SER HB2 1 9 ASP H 3.650 . 5.500 3.784 2.001 4.675 . 0 0 "[ . 1 . 2]" 1
6 1 8 SER HB3 1 9 ASP H 3.650 . 5.500 3.843 1.957 4.655 . 0 0 "[ . 1 . 2]" 1
7 1 9 ASP HA 1 10 VAL H 2.500 . 3.190 2.404 2.159 3.103 . 0 0 "[ . 1 . 2]" 1
8 1 9 ASP HA 1 10 VAL MG2 3.160 . 4.520 3.819 3.287 4.521 0.001 11 0 "[ . 1 . 2]" 1
9 1 9 ASP HB2 1 10 VAL H 3.650 . 5.500 3.980 2.085 4.669 . 0 0 "[ . 1 . 2]" 1
10 1 9 ASP HB3 1 10 VAL H 3.650 . 5.500 3.898 2.411 4.596 . 0 0 "[ . 1 . 2]" 1
11 1 10 VAL H 1 10 VAL HB 2.840 . 3.880 2.512 2.408 2.604 . 0 0 "[ . 1 . 2]" 1
12 1 10 VAL H 1 10 VAL MG2 3.650 . 5.500 2.572 2.212 2.841 . 0 0 "[ . 1 . 2]" 1
13 1 10 VAL H 1 11 LYS H 3.650 . 5.500 4.393 4.299 4.558 . 0 0 "[ . 1 . 2]" 1
14 1 10 VAL HA 1 10 VAL MG1 2.970 . 4.140 2.300 2.264 2.355 . 0 0 "[ . 1 . 2]" 1
15 1 10 VAL HA 1 11 LYS H 2.640 . 3.480 2.147 2.132 2.162 . 0 0 "[ . 1 . 2]" 1
16 1 10 VAL HB 1 11 LYS H 3.650 . 5.500 4.277 4.201 4.400 . 0 0 "[ . 1 . 2]" 1
17 1 10 VAL MG1 1 11 LYS H 3.650 . 5.500 2.661 2.384 3.041 . 0 0 "[ . 1 . 2]" 1
18 1 11 LYS H 1 11 LYS HB2 2.950 . 4.100 2.955 2.246 3.733 . 0 0 "[ . 1 . 2]" 1
19 1 11 LYS H 1 11 LYS QB 2.670 . 3.530 2.596 2.222 3.056 . 0 0 "[ . 1 . 2]" 1
20 1 11 LYS H 1 11 LYS HB3 2.950 . 4.100 3.353 2.656 3.745 . 0 0 "[ . 1 . 2]" 1
21 1 11 LYS H 1 11 LYS QG 2.850 . 3.910 2.339 1.787 3.468 0.003 4 0 "[ . 1 . 2]" 1
22 1 11 LYS HB2 1 12 PRO HD2 2.750 . 3.700 3.069 2.217 3.719 0.019 18 0 "[ . 1 . 2]" 1
23 1 11 LYS HB3 1 12 PRO HD2 2.750 . 3.700 2.680 2.167 3.698 . 0 0 "[ . 1 . 2]" 1
24 1 11 LYS QE 1 11 LYS QG 2.290 . 2.780 2.231 2.129 2.336 . 0 0 "[ . 1 . 2]" 1
25 1 11 LYS QG 1 12 PRO HD2 3.100 . 4.410 3.643 2.659 4.269 . 0 0 "[ . 1 . 2]" 1
26 1 12 PRO HA 1 14 SER H 3.650 . 5.500 4.175 3.757 4.543 . 0 0 "[ . 1 . 2]" 1
27 1 12 PRO HA 1 92 TYR HA 2.730 . 3.660 2.759 2.314 3.289 . 0 0 "[ . 1 . 2]" 1
28 1 12 PRO HB2 1 13 LYS H 3.040 . 4.280 3.083 2.774 3.459 . 0 0 "[ . 1 . 2]" 1
29 1 12 PRO HB2 1 13 LYS HA 3.530 . 5.260 4.583 4.468 4.749 . 0 0 "[ . 1 . 2]" 1
30 1 12 PRO HB2 1 14 SER H 3.230 . 4.660 3.314 3.095 3.515 . 0 0 "[ . 1 . 2]" 1
31 1 12 PRO HB2 1 15 ILE MD 3.160 . 4.520 3.362 2.902 3.688 . 0 0 "[ . 1 . 2]" 1
32 1 12 PRO HB2 1 90 TYR QB 3.410 . 5.020 3.610 3.344 3.969 . 0 0 "[ . 1 . 2]" 1
33 1 12 PRO HB2 1 90 TYR QD 2.770 . 3.730 3.502 2.232 3.742 0.012 11 0 "[ . 1 . 2]" 1
34 1 12 PRO HB2 1 91 VAL H 3.250 . 4.710 4.153 3.784 4.681 . 0 0 "[ . 1 . 2]" 1
35 1 12 PRO HB2 1 92 TYR HA 3.650 . 5.500 4.758 4.294 5.423 . 0 0 "[ . 1 . 2]" 1
36 1 12 PRO HB3 1 13 LYS H 3.010 . 4.220 3.473 2.859 3.823 . 0 0 "[ . 1 . 2]" 1
37 1 12 PRO HB3 1 14 SER H 3.330 . 4.860 4.260 3.324 4.648 . 0 0 "[ . 1 . 2]" 1
38 1 12 PRO HB3 1 15 ILE MD 3.460 . 5.120 4.486 3.554 4.870 . 0 0 "[ . 1 . 2]" 1
39 1 12 PRO HB3 1 90 TYR HB2 3.220 . 4.640 3.141 2.927 4.520 . 0 0 "[ . 1 . 2]" 1
40 1 12 PRO HB3 1 90 TYR HB3 3.220 . 4.640 4.549 2.892 4.653 0.013 8 0 "[ . 1 . 2]" 1
41 1 12 PRO HB3 1 90 TYR QD 2.750 . 3.700 2.166 2.045 2.675 . 0 0 "[ . 1 . 2]" 1
42 1 12 PRO HB3 1 91 VAL H 3.350 . 4.900 4.144 3.387 4.462 . 0 0 "[ . 1 . 2]" 1
43 1 12 PRO HB3 1 92 TYR HA 3.160 . 4.520 4.265 3.513 4.531 0.011 8 0 "[ . 1 . 2]" 1
44 1 12 PRO HG2 1 14 SER H 3.650 . 5.500 5.316 4.941 5.506 0.006 7 0 "[ . 1 . 2]" 1
45 1 12 PRO HG2 1 90 TYR QD 3.330 . 4.870 4.502 3.295 4.883 0.013 17 0 "[ . 1 . 2]" 1
46 1 12 PRO HG3 1 90 TYR QD 2.790 . 3.780 3.421 2.247 3.792 0.012 8 0 "[ . 1 . 2]" 1
47 1 13 LYS H 1 13 LYS HB2 2.810 . 3.830 2.560 2.216 2.958 . 0 0 "[ . 1 . 2]" 1
48 1 13 LYS H 1 13 LYS HB3 2.810 . 3.830 2.973 2.334 3.701 . 0 0 "[ . 1 . 2]" 1
49 1 13 LYS H 1 13 LYS HG2 3.300 . 4.800 4.060 2.325 4.745 . 0 0 "[ . 1 . 2]" 1
50 1 13 LYS H 1 13 LYS QG 2.960 . 4.120 3.629 2.304 4.084 . 0 0 "[ . 1 . 2]" 1
51 1 13 LYS H 1 13 LYS HG3 3.300 . 4.800 4.225 2.567 4.681 . 0 0 "[ . 1 . 2]" 1
52 1 13 LYS H 1 14 SER H 3.650 . 5.500 2.244 2.049 2.488 . 0 0 "[ . 1 . 2]" 1
53 1 13 LYS H 1 15 ILE MD 3.650 . 5.500 5.308 4.919 5.490 . 0 0 "[ . 1 . 2]" 1
54 1 13 LYS H 1 90 TYR QD 3.650 . 5.500 4.712 3.460 5.470 . 0 0 "[ . 1 . 2]" 1
55 1 13 LYS H 1 91 VAL H 3.650 . 5.500 4.234 3.925 4.485 . 0 0 "[ . 1 . 2]" 1
56 1 13 LYS H 1 92 TYR HA 2.670 . 3.540 2.428 1.956 3.096 . 0 0 "[ . 1 . 2]" 1
57 1 13 LYS H 1 92 TYR QD 3.650 . 5.500 5.428 5.196 5.503 0.003 15 0 "[ . 1 . 2]" 1
58 1 13 LYS HA 1 13 LYS QD 2.810 . 3.820 3.065 2.158 3.836 0.016 11 0 "[ . 1 . 2]" 1
59 1 13 LYS HA 1 13 LYS HG2 2.880 . 3.960 3.078 2.247 3.653 . 0 0 "[ . 1 . 2]" 1
60 1 13 LYS HA 1 13 LYS QG 2.620 . 3.450 2.391 2.161 3.025 . 0 0 "[ . 1 . 2]" 1
61 1 13 LYS HA 1 13 LYS HG3 2.880 . 3.960 2.801 2.209 3.810 . 0 0 "[ . 1 . 2]" 1
62 1 13 LYS QB 1 14 SER H 2.830 . 3.850 2.655 2.388 2.995 . 0 0 "[ . 1 . 2]" 1
63 1 13 LYS HB2 1 14 SER H 3.100 . 4.400 3.445 2.648 4.070 . 0 0 "[ . 1 . 2]" 1
64 1 13 LYS HB3 1 14 SER H 3.100 . 4.400 3.025 2.414 3.974 . 0 0 "[ . 1 . 2]" 1
65 1 13 LYS QE 1 13 LYS QG 2.560 . 3.330 2.266 2.113 2.842 . 0 0 "[ . 1 . 2]" 1
66 1 13 LYS QG 1 14 SER H 3.570 . 5.340 3.967 3.208 4.720 . 0 0 "[ . 1 . 2]" 1
67 1 14 SER H 1 15 ILE H 3.650 . 5.500 4.375 4.363 4.385 . 0 0 "[ . 1 . 2]" 1
68 1 14 SER H 1 15 ILE MD 3.650 . 5.500 4.115 3.936 4.337 . 0 0 "[ . 1 . 2]" 1
69 1 14 SER H 1 15 ILE QG 3.570 . 5.340 4.216 4.034 4.668 . 0 0 "[ . 1 . 2]" 1
70 1 14 SER H 1 91 VAL H 3.650 . 5.500 3.240 2.983 3.536 . 0 0 "[ . 1 . 2]" 1
71 1 14 SER H 1 91 VAL HB 3.400 . 5.000 4.570 4.115 4.882 . 0 0 "[ . 1 . 2]" 1
72 1 14 SER HA 1 14 SER QB 2.210 . 2.620 2.365 2.154 2.484 . 0 0 "[ . 1 . 2]" 1
73 1 14 SER HA 1 15 ILE H 2.360 . 2.920 2.465 2.377 2.573 . 0 0 "[ . 1 . 2]" 1
74 1 14 SER HA 1 15 ILE MD 3.040 . 4.280 2.722 2.461 4.174 . 0 0 "[ . 1 . 2]" 1
75 1 14 SER QB 1 15 ILE H 2.100 . 2.400 2.271 2.081 2.405 0.005 20 0 "[ . 1 . 2]" 1
76 1 14 SER QB 1 91 VAL HB 3.060 . 4.320 4.295 4.200 4.324 0.004 9 0 "[ . 1 . 2]" 1
77 1 14 SER QB 1 91 VAL QG 3.220 . 4.640 2.159 2.098 2.413 . 0 0 "[ . 1 . 2]" 1
78 1 14 SER HB2 1 15 ILE HA 3.650 . 5.500 4.636 4.014 4.972 . 0 0 "[ . 1 . 2]" 1
79 1 14 SER HB3 1 15 ILE HA 3.650 . 5.500 4.466 4.135 5.331 . 0 0 "[ . 1 . 2]" 1
80 1 15 ILE H 1 15 ILE HB 2.670 . 3.540 2.728 2.624 2.786 . 0 0 "[ . 1 . 2]" 1
81 1 15 ILE H 1 15 ILE MD 3.650 . 5.500 2.469 2.089 3.709 . 0 0 "[ . 1 . 2]" 1
82 1 15 ILE H 1 15 ILE QG 3.000 . 4.210 3.333 2.706 3.471 . 0 0 "[ . 1 . 2]" 1
83 1 15 ILE H 1 15 ILE MG 3.430 . 5.060 3.885 3.851 3.903 . 0 0 "[ . 1 . 2]" 1
84 1 15 ILE H 1 16 SER H 3.650 . 5.500 4.318 4.220 4.363 . 0 0 "[ . 1 . 2]" 1
85 1 15 ILE HA 1 15 ILE MD 2.930 . 4.060 3.367 2.142 3.553 . 0 0 "[ . 1 . 2]" 1
86 1 15 ILE HA 1 15 ILE HG12 2.810 . 3.830 3.403 2.994 3.572 . 0 0 "[ . 1 . 2]" 1
87 1 15 ILE HA 1 15 ILE HG13 2.810 . 3.830 2.407 2.305 3.733 . 0 0 "[ . 1 . 2]" 1
88 1 15 ILE HA 1 15 ILE MG 2.540 . 3.280 2.287 2.234 2.339 . 0 0 "[ . 1 . 2]" 1
89 1 15 ILE HA 1 16 SER H 2.440 . 3.070 2.157 2.143 2.171 . 0 0 "[ . 1 . 2]" 1
90 1 15 ILE HA 1 90 TYR HA 2.770 . 3.730 2.292 2.161 2.507 . 0 0 "[ . 1 . 2]" 1
91 1 15 ILE HA 1 91 VAL H 3.060 . 4.320 3.022 2.749 3.287 . 0 0 "[ . 1 . 2]" 1
92 1 15 ILE HB 1 15 ILE MD 2.460 . 3.120 2.215 2.133 3.158 0.038 8 0 "[ . 1 . 2]" 1
93 1 15 ILE MD 1 15 ILE MG 2.810 . 3.830 2.992 1.858 3.183 . 0 0 "[ . 1 . 2]" 1
94 1 15 ILE MD 1 16 SER H 3.650 . 5.500 4.943 3.535 5.093 . 0 0 "[ . 1 . 2]" 1
95 1 15 ILE QG 1 15 ILE MG 2.310 . 2.830 2.005 1.900 2.293 . 0 0 "[ . 1 . 2]" 1
96 1 15 ILE QG 1 16 SER H 3.570 . 5.340 4.135 4.018 4.626 . 0 0 "[ . 1 . 2]" 1
97 1 15 ILE QG 1 90 TYR QD 3.140 . 4.480 4.389 2.570 4.492 0.012 13 0 "[ . 1 . 2]" 1
98 1 15 ILE QG 1 91 VAL H 3.110 . 4.420 3.427 3.089 4.426 0.006 8 0 "[ . 1 . 2]" 1
99 1 15 ILE HG12 1 15 ILE MG 2.710 . 3.610 2.100 1.936 3.201 . 0 0 "[ . 1 . 2]" 1
100 1 15 ILE HG13 1 15 ILE MG 2.710 . 3.610 2.743 2.349 2.865 . 0 0 "[ . 1 . 2]" 1
101 1 15 ILE MG 1 16 SER H 2.920 . 4.040 2.449 2.230 2.643 . 0 0 "[ . 1 . 2]" 1
102 1 15 ILE MG 1 88 LYS HA 3.020 . 4.240 3.962 3.654 4.219 . 0 0 "[ . 1 . 2]" 1
103 1 15 ILE MG 1 88 LYS HB2 2.960 . 4.130 2.556 2.106 3.714 . 0 0 "[ . 1 . 2]" 1
104 1 15 ILE MG 1 88 LYS QB 2.630 . 3.460 2.242 2.072 2.658 . 0 0 "[ . 1 . 2]" 1
105 1 15 ILE MG 1 88 LYS HB3 2.960 . 4.130 3.085 2.115 4.033 . 0 0 "[ . 1 . 2]" 1
106 1 15 ILE MG 1 88 LYS QD 2.650 . 3.500 2.471 2.199 3.014 . 0 0 "[ . 1 . 2]" 1
107 1 15 ILE MG 1 88 LYS QE 3.190 . 4.580 3.623 2.231 4.422 . 0 0 "[ . 1 . 2]" 1
108 1 15 ILE MG 1 88 LYS HG2 3.080 . 4.370 4.080 3.194 4.374 0.004 11 0 "[ . 1 . 2]" 1
109 1 15 ILE MG 1 88 LYS HG3 3.080 . 4.370 3.548 2.345 4.372 0.002 1 0 "[ . 1 . 2]" 1
110 1 15 ILE MG 1 89 VAL H 3.210 . 4.620 3.183 2.825 3.823 . 0 0 "[ . 1 . 2]" 1
111 1 15 ILE MG 1 90 TYR QD 3.420 . 5.040 4.944 3.738 5.050 0.010 8 0 "[ . 1 . 2]" 1
112 1 15 ILE MG 1 91 VAL H 3.650 . 5.500 4.452 4.184 4.740 . 0 0 "[ . 1 . 2]" 1
113 1 16 SER H 1 89 VAL H 3.650 . 5.500 3.384 3.081 3.862 . 0 0 "[ . 1 . 2]" 1
114 1 16 SER H 1 89 VAL HB 3.020 . 4.250 3.646 3.292 4.162 . 0 0 "[ . 1 . 2]" 1
115 1 16 SER H 1 90 TYR HA 3.650 . 5.500 3.310 2.842 3.565 . 0 0 "[ . 1 . 2]" 1
116 1 16 SER HA 1 89 VAL H 3.650 . 5.500 4.741 4.448 5.190 . 0 0 "[ . 1 . 2]" 1
117 1 16 SER QB 1 89 VAL HB 2.890 . 3.970 3.153 2.622 3.875 . 0 0 "[ . 1 . 2]" 1
118 1 16 SER QB 1 89 VAL MG1 3.150 . 4.500 4.062 3.644 4.503 0.003 16 0 "[ . 1 . 2]" 1
119 1 17 ARG H 1 88 LYS HA 3.650 . 5.500 5.129 4.304 5.445 . 0 0 "[ . 1 . 2]" 1
120 1 17 ARG HA 1 17 ARG QD 2.790 . 3.770 2.943 2.269 3.776 0.006 19 0 "[ . 1 . 2]" 1
121 1 17 ARG HA 1 17 ARG QG 2.530 . 3.260 2.308 2.123 2.477 . 0 0 "[ . 1 . 2]" 1
122 1 17 ARG HA 1 18 ALA H 2.390 . 2.980 2.154 2.125 2.255 . 0 0 "[ . 1 . 2]" 1
123 1 17 ARG HA 1 18 ALA MB 2.920 . 4.040 3.976 3.919 4.023 . 0 0 "[ . 1 . 2]" 1
124 1 17 ARG HA 1 88 LYS HA 2.920 . 4.040 2.468 2.203 2.845 . 0 0 "[ . 1 . 2]" 1
125 1 17 ARG HA 1 89 VAL H 3.210 . 4.630 2.879 2.470 3.098 . 0 0 "[ . 1 . 2]" 1
126 1 17 ARG HA 1 89 VAL MG2 2.980 . 4.160 3.343 2.973 4.009 . 0 0 "[ . 1 . 2]" 1
127 1 17 ARG HB2 1 17 ARG QD 2.690 . 3.580 2.576 2.139 3.513 . 0 0 "[ . 1 . 2]" 1
128 1 17 ARG HB2 1 18 ALA H 3.060 . 4.330 4.251 3.770 4.339 0.009 13 0 "[ . 1 . 2]" 1
129 1 17 ARG HB3 1 17 ARG QD 2.660 . 3.520 2.946 2.205 3.527 0.007 13 0 "[ . 1 . 2]" 1
130 1 17 ARG HB3 1 18 ALA H 3.020 . 4.250 3.233 2.689 3.338 . 0 0 "[ . 1 . 2]" 1
131 1 17 ARG HB3 1 18 ALA MB 3.200 . 4.600 4.524 4.258 4.599 . 0 0 "[ . 1 . 2]" 1
132 1 17 ARG QD 1 18 ALA H 3.570 . 5.340 4.498 3.291 5.350 0.010 14 0 "[ . 1 . 2]" 1
133 1 17 ARG QG 1 18 ALA H 3.570 . 5.340 3.911 3.359 4.335 . 0 0 "[ . 1 . 2]" 1
134 1 17 ARG QG 1 88 LYS HA 2.720 . 3.640 3.174 2.448 3.638 . 0 0 "[ . 1 . 2]" 1
135 1 18 ALA H 1 18 ALA MB 2.440 . 3.070 2.172 2.060 2.218 . 0 0 "[ . 1 . 2]" 1
136 1 18 ALA H 1 84 VAL HA 3.650 . 5.500 5.097 4.759 5.414 . 0 0 "[ . 1 . 2]" 1
137 1 18 ALA H 1 87 VAL HB 3.650 . 5.500 4.706 4.181 5.074 . 0 0 "[ . 1 . 2]" 1
138 1 18 ALA H 1 87 VAL MG1 3.650 . 5.500 4.112 3.297 4.533 . 0 0 "[ . 1 . 2]" 1
139 1 18 ALA H 1 88 LYS HA 3.080 . 4.360 3.223 2.716 3.908 . 0 0 "[ . 1 . 2]" 1
140 1 18 ALA H 1 89 VAL MG2 3.520 . 5.250 2.470 2.222 3.051 . 0 0 "[ . 1 . 2]" 1
141 1 18 ALA HA 1 20 LYS H 3.650 . 5.500 4.175 3.749 4.413 . 0 0 "[ . 1 . 2]" 1
142 1 18 ALA HA 1 25 ILE MD 3.150 . 4.500 3.317 2.735 3.632 . 0 0 "[ . 1 . 2]" 1
143 1 18 ALA HA 1 89 VAL MG2 3.260 . 4.720 2.952 2.348 3.453 . 0 0 "[ . 1 . 2]" 1
144 1 18 ALA MB 1 19 LYS H 2.900 . 4.000 2.700 2.482 2.878 . 0 0 "[ . 1 . 2]" 1
145 1 18 ALA MB 1 19 LYS HA 3.130 . 4.460 4.195 4.074 4.255 . 0 0 "[ . 1 . 2]" 1
146 1 18 ALA MB 1 19 LYS QB 3.300 . 4.800 4.441 4.092 4.688 . 0 0 "[ . 1 . 2]" 1
147 1 18 ALA MB 1 20 LYS H 3.130 . 4.460 3.084 2.464 3.462 . 0 0 "[ . 1 . 2]" 1
148 1 18 ALA MB 1 21 TRP HA 3.370 . 4.940 4.400 4.242 4.754 . 0 0 "[ . 1 . 2]" 1
149 1 18 ALA MB 1 25 ILE HA 3.460 . 5.130 3.929 3.769 4.208 . 0 0 "[ . 1 . 2]" 1
150 1 18 ALA MB 1 25 ILE MD 2.820 . 3.840 1.968 1.851 2.082 . 0 0 "[ . 1 . 2]" 1
151 1 18 ALA MB 1 25 ILE QG 2.770 . 3.740 2.371 2.105 2.600 . 0 0 "[ . 1 . 2]" 1
152 1 18 ALA MB 1 25 ILE MG 2.480 . 3.160 2.166 1.906 2.523 . 0 0 "[ . 1 . 2]" 1
153 1 18 ALA MB 1 84 VAL HA 3.000 . 4.200 3.022 2.567 3.476 . 0 0 "[ . 1 . 2]" 1
154 1 18 ALA MB 1 84 VAL HB 3.140 . 4.480 4.372 4.210 4.482 0.002 7 0 "[ . 1 . 2]" 1
155 1 18 ALA MB 1 84 VAL MG1 2.290 . 2.780 1.985 1.866 2.137 . 0 0 "[ . 1 . 2]" 1
156 1 18 ALA MB 1 85 HIS H 3.650 . 5.500 5.056 4.736 5.370 . 0 0 "[ . 1 . 2]" 1
157 1 18 ALA MB 1 87 VAL H 3.650 . 5.500 4.663 4.087 5.109 . 0 0 "[ . 1 . 2]" 1
158 1 18 ALA MB 1 87 VAL HB 2.810 . 3.810 3.463 2.738 3.802 . 0 0 "[ . 1 . 2]" 1
159 1 18 ALA MB 1 87 VAL MG1 2.940 . 4.090 3.201 2.279 3.854 . 0 0 "[ . 1 . 2]" 1
160 1 18 ALA MB 1 89 VAL MG2 2.420 . 3.040 2.087 1.963 2.275 . 0 0 "[ . 1 . 2]" 1
161 1 19 LYS H 1 19 LYS QB 2.750 . 3.690 2.421 2.153 2.854 . 0 0 "[ . 1 . 2]" 1
162 1 19 LYS H 1 19 LYS HG2 3.330 . 4.870 3.427 2.221 4.706 . 0 0 "[ . 1 . 2]" 1
163 1 19 LYS H 1 19 LYS QG 3.040 . 4.280 2.967 2.203 4.054 . 0 0 "[ . 1 . 2]" 1
164 1 19 LYS H 1 19 LYS HG3 3.330 . 4.870 3.629 2.320 4.509 . 0 0 "[ . 1 . 2]" 1
165 1 19 LYS H 1 20 LYS H 3.650 . 5.500 2.235 2.129 2.337 . 0 0 "[ . 1 . 2]" 1
166 1 19 LYS H 1 84 VAL MG1 3.650 . 5.500 3.316 3.075 3.603 . 0 0 "[ . 1 . 2]" 1
167 1 19 LYS H 1 89 VAL MG2 3.650 . 5.500 4.703 4.098 5.150 . 0 0 "[ . 1 . 2]" 1
168 1 19 LYS HA 1 19 LYS QD 2.810 . 3.810 2.835 2.140 3.823 0.013 18 0 "[ . 1 . 2]" 1
169 1 19 LYS HA 1 19 LYS HG2 2.830 . 3.850 3.085 2.329 3.853 0.003 17 0 "[ . 1 . 2]" 1
170 1 19 LYS HA 1 19 LYS QG 2.560 . 3.330 2.531 2.235 3.005 . 0 0 "[ . 1 . 2]" 1
171 1 19 LYS HA 1 19 LYS HG3 2.830 . 3.850 3.081 2.261 3.790 . 0 0 "[ . 1 . 2]" 1
172 1 19 LYS HA 1 84 VAL MG1 3.000 . 4.200 3.056 2.651 3.701 . 0 0 "[ . 1 . 2]" 1
173 1 19 LYS QB 1 20 LYS H 3.070 . 4.340 2.682 2.403 3.627 . 0 0 "[ . 1 . 2]" 1
174 1 20 LYS H 1 84 VAL MG1 3.650 . 5.500 2.623 1.881 2.856 . 0 0 "[ . 1 . 2]" 1
175 1 20 LYS HA 1 20 LYS QD 3.250 . 4.700 3.438 2.138 4.422 . 0 0 "[ . 1 . 2]" 1
176 1 20 LYS HA 1 20 LYS QE 3.520 . 5.240 4.331 3.507 5.230 . 0 0 "[ . 1 . 2]" 1
177 1 20 LYS HA 1 20 LYS HG2 2.870 . 3.930 3.183 2.171 3.892 . 0 0 "[ . 1 . 2]" 1
178 1 20 LYS HA 1 20 LYS HG3 2.870 . 3.930 2.665 2.182 3.708 . 0 0 "[ . 1 . 2]" 1
179 1 20 LYS HA 1 21 TRP H 2.240 . 2.680 2.482 2.244 2.675 . 0 0 "[ . 1 . 2]" 1
180 1 20 LYS HA 1 21 TRP HA 3.220 . 4.640 4.337 4.287 4.392 . 0 0 "[ . 1 . 2]" 1
181 1 20 LYS HA 1 21 TRP QB 3.140 . 4.480 4.184 4.095 4.343 . 0 0 "[ . 1 . 2]" 1
182 1 20 LYS HA 1 84 VAL HA 3.650 . 5.500 5.496 5.260 5.526 0.026 16 0 "[ . 1 . 2]" 1
183 1 20 LYS HA 1 84 VAL MG1 2.600 . 3.400 2.367 2.124 2.601 . 0 0 "[ . 1 . 2]" 1
184 1 20 LYS HA 1 84 VAL MG2 2.920 . 4.040 2.595 2.409 2.841 . 0 0 "[ . 1 . 2]" 1
185 1 20 LYS QB 1 20 LYS QE 3.320 . 4.840 3.217 2.167 3.865 . 0 0 "[ . 1 . 2]" 1
186 1 20 LYS HB2 1 21 TRP H 3.030 . 4.260 3.645 2.320 4.088 . 0 0 "[ . 1 . 2]" 1
187 1 20 LYS HB3 1 21 TRP H 3.030 . 4.260 3.266 2.424 3.863 . 0 0 "[ . 1 . 2]" 1
188 1 20 LYS QE 1 20 LYS QG 2.540 . 3.280 2.222 2.098 2.477 . 0 0 "[ . 1 . 2]" 1
189 1 20 LYS QG 1 21 TRP H 2.140 . 2.480 1.932 1.779 2.193 0.021 10 0 "[ . 1 . 2]" 1
190 1 20 LYS QG 1 21 TRP QB 3.170 . 4.550 3.248 2.696 3.548 . 0 0 "[ . 1 . 2]" 1
191 1 20 LYS HG2 1 21 TRP H 2.390 . 2.980 2.444 1.808 3.044 0.064 12 0 "[ . 1 . 2]" 1
192 1 20 LYS HG3 1 21 TRP H 2.390 . 2.980 2.394 1.791 3.005 0.025 7 0 "[ . 1 . 2]" 1
193 1 21 TRP H 1 84 VAL MG1 3.590 . 5.380 3.734 3.246 4.029 . 0 0 "[ . 1 . 2]" 1
194 1 21 TRP H 1 84 VAL MG2 2.960 . 4.130 2.496 1.908 2.984 . 0 0 "[ . 1 . 2]" 1
195 1 21 TRP HA 1 21 TRP HD1 3.100 . 4.400 2.813 2.116 3.270 . 0 0 "[ . 1 . 2]" 1
196 1 21 TRP HA 1 22 SER H 2.670 . 3.540 2.156 2.126 2.187 . 0 0 "[ . 1 . 2]" 1
197 1 21 TRP HA 1 25 ILE HB 2.690 . 3.570 2.966 2.757 3.155 . 0 0 "[ . 1 . 2]" 1
198 1 21 TRP HA 1 25 ILE QG 2.940 . 4.080 2.956 2.555 3.818 . 0 0 "[ . 1 . 2]" 1
199 1 21 TRP HA 1 84 VAL MG1 3.200 . 4.600 3.732 3.257 3.983 . 0 0 "[ . 1 . 2]" 1
200 1 21 TRP HA 1 84 VAL MG2 2.710 . 3.620 2.202 2.109 2.383 . 0 0 "[ . 1 . 2]" 1
201 1 21 TRP QB 1 84 VAL MG2 2.650 . 3.500 2.312 2.117 2.636 . 0 0 "[ . 1 . 2]" 1
202 1 21 TRP HD1 1 25 ILE MG 3.040 . 4.280 3.866 3.387 4.245 . 0 0 "[ . 1 . 2]" 1
203 1 21 TRP HD1 1 26 GLU QG 3.570 . 5.340 4.810 3.691 5.349 0.009 18 0 "[ . 1 . 2]" 1
204 1 21 TRP HD1 1 79 CYS H 3.650 . 5.500 5.001 4.219 5.488 . 0 0 "[ . 1 . 2]" 1
205 1 21 TRP HD1 1 79 CYS HB2 3.040 . 4.280 3.317 2.295 4.159 . 0 0 "[ . 1 . 2]" 1
206 1 21 TRP HD1 1 79 CYS HB3 2.680 . 3.560 2.886 2.358 3.513 . 0 0 "[ . 1 . 2]" 1
207 1 21 TRP HD1 1 84 VAL MG2 2.810 . 3.810 3.325 2.907 3.602 . 0 0 "[ . 1 . 2]" 1
208 1 21 TRP HE1 1 26 GLU H 3.650 . 5.500 3.677 3.414 4.059 . 0 0 "[ . 1 . 2]" 1
209 1 21 TRP HE1 1 26 GLU HA 3.650 . 5.500 3.522 2.653 3.987 . 0 0 "[ . 1 . 2]" 1
210 1 21 TRP HE1 1 26 GLU QB 2.960 . 4.120 1.811 1.787 1.898 0.013 11 0 "[ . 1 . 2]" 1
211 1 21 TRP HE1 1 26 GLU QG 3.570 . 5.340 3.032 1.918 3.541 . 0 0 "[ . 1 . 2]" 1
212 1 21 TRP HE1 1 27 ASN H 3.650 . 5.500 5.486 5.328 5.526 0.026 11 0 "[ . 1 . 2]" 1
213 1 21 TRP HE1 1 77 ARG QB 3.570 . 5.340 4.054 3.455 4.899 . 0 0 "[ . 1 . 2]" 1
214 1 21 TRP HE1 1 77 ARG QG 2.980 . 4.170 3.003 2.247 4.192 0.022 5 0 "[ . 1 . 2]" 1
215 1 21 TRP HE1 1 79 CYS H 3.650 . 5.500 4.084 3.303 4.821 . 0 0 "[ . 1 . 2]" 1
216 1 21 TRP HE1 1 79 CYS HB2 3.020 . 4.240 3.240 2.019 4.245 0.005 6 0 "[ . 1 . 2]" 1
217 1 21 TRP HE1 1 79 CYS HB3 2.850 . 3.910 3.308 2.383 3.915 0.005 5 0 "[ . 1 . 2]" 1
218 1 21 TRP HZ2 1 26 GLU HG2 3.650 . 5.500 4.845 3.718 5.505 0.005 3 0 "[ . 1 . 2]" 1
219 1 21 TRP HZ2 1 26 GLU QG 3.250 . 4.700 3.885 2.596 4.706 0.006 1 0 "[ . 1 . 2]" 1
220 1 21 TRP HZ2 1 26 GLU HG3 3.650 . 5.500 4.447 2.626 5.520 0.020 11 0 "[ . 1 . 2]" 1
221 1 21 TRP HZ2 1 77 ARG H 3.650 . 5.500 5.090 4.426 5.518 0.018 6 0 "[ . 1 . 2]" 1
222 1 21 TRP HZ2 1 77 ARG HB2 3.250 . 4.700 3.060 2.341 4.177 . 0 0 "[ . 1 . 2]" 1
223 1 21 TRP HZ2 1 77 ARG QB 2.900 . 4.000 2.726 2.192 3.454 . 0 0 "[ . 1 . 2]" 1
224 1 21 TRP HZ2 1 77 ARG HB3 3.250 . 4.700 3.376 2.382 4.713 0.013 14 0 "[ . 1 . 2]" 1
225 1 21 TRP HZ2 1 77 ARG QG 3.190 . 4.580 2.546 2.139 4.350 . 0 0 "[ . 1 . 2]" 1
226 1 22 SER H 1 23 GLU H 3.650 . 5.500 4.341 4.319 4.359 . 0 0 "[ . 1 . 2]" 1
227 1 22 SER H 1 25 ILE H 3.650 . 5.500 3.108 2.939 3.642 . 0 0 "[ . 1 . 2]" 1
228 1 22 SER H 1 25 ILE HB 2.100 . 2.400 2.232 2.037 2.402 0.002 6 0 "[ . 1 . 2]" 1
229 1 22 SER H 1 25 ILE MD 3.650 . 5.500 4.081 3.700 4.682 . 0 0 "[ . 1 . 2]" 1
230 1 22 SER H 1 25 ILE HG12 3.000 . 4.210 2.485 1.963 3.296 . 0 0 "[ . 1 . 2]" 1
231 1 22 SER H 1 25 ILE HG13 3.000 . 4.210 3.114 2.642 3.935 . 0 0 "[ . 1 . 2]" 1
232 1 22 SER H 1 25 ILE MG 2.870 . 3.930 3.720 3.510 3.916 . 0 0 "[ . 1 . 2]" 1
233 1 22 SER H 1 26 GLU H 3.650 . 5.500 2.941 2.532 3.335 . 0 0 "[ . 1 . 2]" 1
234 1 22 SER H 1 84 VAL MG2 3.290 . 4.790 3.896 3.633 4.077 . 0 0 "[ . 1 . 2]" 1
235 1 23 GLU H 1 23 GLU HG2 3.650 . 5.500 3.248 1.947 4.532 . 0 0 "[ . 1 . 2]" 1
236 1 23 GLU H 1 23 GLU HG3 3.650 . 5.500 3.430 1.890 4.616 . 0 0 "[ . 1 . 2]" 1
237 1 23 GLU H 1 24 GLU H 3.650 . 5.500 2.838 2.774 2.874 . 0 0 "[ . 1 . 2]" 1
238 1 23 GLU H 1 25 ILE H 3.650 . 5.500 4.430 4.289 4.590 . 0 0 "[ . 1 . 2]" 1
239 1 23 GLU HA 1 23 GLU QG 2.770 . 3.730 2.766 2.156 3.372 . 0 0 "[ . 1 . 2]" 1
240 1 23 GLU HA 1 59 TYR QD 2.960 . 4.120 4.078 3.927 4.137 0.017 5 0 "[ . 1 . 2]" 1
241 1 23 GLU HA 1 59 TYR QE 2.650 . 3.500 2.311 2.134 2.696 . 0 0 "[ . 1 . 2]" 1
242 1 23 GLU QB 1 59 TYR QE 2.920 . 4.040 2.994 2.111 3.868 . 0 0 "[ . 1 . 2]" 1
243 1 23 GLU QG 1 59 TYR QE 3.250 . 4.700 3.419 2.213 4.705 0.005 2 0 "[ . 1 . 2]" 1
244 1 23 GLU HG2 1 59 TYR QE 3.650 . 5.500 4.029 2.268 5.320 . 0 0 "[ . 1 . 2]" 1
245 1 23 GLU HG3 1 59 TYR QE 3.650 . 5.500 4.058 2.274 5.418 . 0 0 "[ . 1 . 2]" 1
246 1 24 GLU H 1 24 GLU HB2 2.930 . 4.060 2.430 2.310 2.562 . 0 0 "[ . 1 . 2]" 1
247 1 24 GLU H 1 24 GLU QB 2.640 . 3.480 2.334 2.257 2.414 . 0 0 "[ . 1 . 2]" 1
248 1 24 GLU H 1 24 GLU HB3 2.930 . 4.060 3.317 2.512 3.587 . 0 0 "[ . 1 . 2]" 1
249 1 24 GLU H 1 25 ILE H 3.650 . 5.500 2.607 2.535 2.676 . 0 0 "[ . 1 . 2]" 1
250 1 24 GLU HA 1 24 GLU QG 2.720 . 3.640 2.620 2.272 2.921 . 0 0 "[ . 1 . 2]" 1
251 1 24 GLU HA 1 27 ASN H 3.280 . 4.760 4.080 3.912 4.232 . 0 0 "[ . 1 . 2]" 1
252 1 24 GLU HA 1 27 ASN HB2 3.090 . 4.380 4.156 3.901 4.356 . 0 0 "[ . 1 . 2]" 1
253 1 24 GLU HA 1 27 ASN HB3 3.260 . 4.720 3.170 3.085 3.269 . 0 0 "[ . 1 . 2]" 1
254 1 24 GLU QB 1 25 ILE H 2.740 . 3.680 2.495 2.342 2.593 . 0 0 "[ . 1 . 2]" 1
255 1 24 GLU QB 1 25 ILE MD 2.920 . 4.040 2.433 2.216 2.773 . 0 0 "[ . 1 . 2]" 1
256 1 24 GLU HB2 1 25 ILE H 3.090 . 4.380 2.876 2.383 3.836 . 0 0 "[ . 1 . 2]" 1
257 1 24 GLU HB2 1 25 ILE MD 3.310 . 4.820 2.952 2.311 4.245 . 0 0 "[ . 1 . 2]" 1
258 1 24 GLU HB3 1 25 ILE H 3.090 . 4.380 3.268 2.430 3.629 . 0 0 "[ . 1 . 2]" 1
259 1 24 GLU HB3 1 25 ILE MD 3.310 . 4.820 2.809 2.290 3.070 . 0 0 "[ . 1 . 2]" 1
260 1 24 GLU HG2 1 25 ILE H 3.650 . 5.500 4.467 3.739 5.038 . 0 0 "[ . 1 . 2]" 1
261 1 24 GLU HG3 1 25 ILE H 3.650 . 5.500 4.599 3.581 4.982 . 0 0 "[ . 1 . 2]" 1
262 1 25 ILE H 1 25 ILE HB 2.330 . 2.860 2.730 2.630 2.826 . 0 0 "[ . 1 . 2]" 1
263 1 25 ILE H 1 25 ILE MD 3.650 . 5.500 2.463 2.168 2.763 . 0 0 "[ . 1 . 2]" 1
264 1 25 ILE H 1 25 ILE HG12 2.850 . 3.890 1.897 1.827 2.003 . 0 0 "[ . 1 . 2]" 1
265 1 25 ILE H 1 25 ILE QG 2.550 . 3.300 1.888 1.819 1.992 . 0 0 "[ . 1 . 2]" 1
266 1 25 ILE H 1 25 ILE HG13 2.850 . 3.890 3.462 3.377 3.554 . 0 0 "[ . 1 . 2]" 1
267 1 25 ILE H 1 25 ILE MG 3.150 . 4.500 3.748 3.713 3.774 . 0 0 "[ . 1 . 2]" 1
268 1 25 ILE H 1 26 GLU H 3.650 . 5.500 2.774 2.749 2.798 . 0 0 "[ . 1 . 2]" 1
269 1 25 ILE HA 1 25 ILE MD 2.640 . 3.480 2.097 2.053 2.137 . 0 0 "[ . 1 . 2]" 1
270 1 25 ILE HA 1 25 ILE QG 2.690 . 3.580 3.156 3.085 3.212 . 0 0 "[ . 1 . 2]" 1
271 1 25 ILE HA 1 25 ILE MG 2.540 . 3.270 2.273 2.233 2.301 . 0 0 "[ . 1 . 2]" 1
272 1 25 ILE HA 1 28 LEU H 3.170 . 4.540 3.351 3.151 3.578 . 0 0 "[ . 1 . 2]" 1
273 1 25 ILE HA 1 28 LEU HB2 2.870 . 3.940 2.535 2.229 2.833 . 0 0 "[ . 1 . 2]" 1
274 1 25 ILE HA 1 28 LEU HB3 3.500 . 5.210 4.142 3.697 4.446 . 0 0 "[ . 1 . 2]" 1
275 1 25 ILE HA 1 28 LEU QD 2.580 . 3.360 2.746 2.308 3.372 0.012 7 0 "[ . 1 . 2]" 1
276 1 25 ILE HA 1 28 LEU HG 3.040 . 4.280 3.865 3.583 4.075 . 0 0 "[ . 1 . 2]" 1
277 1 25 ILE HB 1 25 ILE MD 2.820 . 3.840 3.195 3.186 3.213 . 0 0 "[ . 1 . 2]" 1
278 1 25 ILE HB 1 26 GLU H 2.890 . 3.970 2.121 2.044 2.190 . 0 0 "[ . 1 . 2]" 1
279 1 25 ILE HB 1 84 VAL MG2 3.250 . 4.710 3.682 3.190 3.938 . 0 0 "[ . 1 . 2]" 1
280 1 25 ILE MD 1 25 ILE MG 2.530 . 3.260 1.897 1.811 2.000 . 0 0 "[ . 1 . 2]" 1
281 1 25 ILE MD 1 28 LEU H 3.650 . 5.500 4.732 4.581 4.893 . 0 0 "[ . 1 . 2]" 1
282 1 25 ILE MD 1 28 LEU QD 3.050 . 4.300 2.942 2.403 3.895 . 0 0 "[ . 1 . 2]" 1
283 1 25 ILE QG 1 25 ILE MG 2.440 . 3.070 2.239 2.180 2.267 . 0 0 "[ . 1 . 2]" 1
284 1 25 ILE QG 1 26 GLU H 3.570 . 5.340 3.504 3.393 3.655 . 0 0 "[ . 1 . 2]" 1
285 1 25 ILE HG12 1 25 ILE MG 2.730 . 3.650 3.189 3.178 3.204 . 0 0 "[ . 1 . 2]" 1
286 1 25 ILE HG13 1 25 ILE MG 2.730 . 3.650 2.287 2.220 2.319 . 0 0 "[ . 1 . 2]" 1
287 1 25 ILE MG 1 26 GLU H 3.220 . 4.640 3.431 3.267 3.576 . 0 0 "[ . 1 . 2]" 1
288 1 25 ILE MG 1 28 LEU HB3 3.650 . 5.500 4.563 3.902 4.979 . 0 0 "[ . 1 . 2]" 1
289 1 25 ILE MG 1 28 LEU HG 3.650 . 5.500 5.188 4.503 5.505 0.005 6 0 "[ . 1 . 2]" 1
290 1 25 ILE MG 1 29 TYR H 3.650 . 5.500 3.873 3.605 4.182 . 0 0 "[ . 1 . 2]" 1
291 1 25 ILE MG 1 84 VAL HA 2.730 . 3.660 2.500 2.425 2.732 . 0 0 "[ . 1 . 2]" 1
292 1 25 ILE MG 1 84 VAL HB 3.650 . 5.500 4.667 4.400 4.902 . 0 0 "[ . 1 . 2]" 1
293 1 25 ILE MG 1 84 VAL MG1 2.680 . 3.560 2.964 2.344 3.315 . 0 0 "[ . 1 . 2]" 1
294 1 25 ILE MG 1 84 VAL MG2 2.770 . 3.730 2.601 2.254 2.992 . 0 0 "[ . 1 . 2]" 1
295 1 25 ILE MG 1 85 HIS H 3.650 . 5.500 5.509 5.470 5.521 0.021 6 0 "[ . 1 . 2]" 1
296 1 25 ILE MG 1 87 VAL H 3.650 . 5.500 4.629 4.335 4.957 . 0 0 "[ . 1 . 2]" 1
297 1 25 ILE MG 1 87 VAL HB 2.810 . 3.820 2.785 2.455 3.155 . 0 0 "[ . 1 . 2]" 1
298 1 25 ILE MG 1 87 VAL MG2 2.850 . 3.910 3.064 2.786 3.537 . 0 0 "[ . 1 . 2]" 1
299 1 25 ILE MG 1 88 LYS H 3.650 . 5.500 5.157 4.740 5.493 . 0 0 "[ . 1 . 2]" 1
300 1 26 GLU H 1 26 GLU QB 2.690 . 3.580 2.224 2.101 2.256 . 0 0 "[ . 1 . 2]" 1
301 1 26 GLU H 1 26 GLU QG 3.570 . 5.340 4.003 3.858 4.071 . 0 0 "[ . 1 . 2]" 1
302 1 26 GLU H 1 27 ASN H 3.650 . 5.500 2.999 2.955 3.064 . 0 0 "[ . 1 . 2]" 1
303 1 26 GLU H 1 27 ASN HB3 3.440 . 5.080 5.078 5.044 5.095 0.015 13 0 "[ . 1 . 2]" 1
304 1 26 GLU HA 1 79 CYS HB3 3.650 . 5.500 4.498 3.299 5.517 0.017 16 0 "[ . 1 . 2]" 1
305 1 26 GLU QB 1 27 ASN H 2.870 . 3.940 2.440 2.323 2.623 . 0 0 "[ . 1 . 2]" 1
306 1 26 GLU QG 1 30 ARG HE 2.090 . 2.380 2.362 2.111 2.386 0.006 13 0 "[ . 1 . 2]" 1
307 1 26 GLU QG 1 59 TYR QE 3.360 . 4.920 3.780 2.911 4.713 . 0 0 "[ . 1 . 2]" 1
308 1 26 GLU HG2 1 27 ASN H 3.650 . 5.500 3.975 3.607 4.839 . 0 0 "[ . 1 . 2]" 1
309 1 26 GLU HG2 1 59 TYR QD 3.650 . 5.500 4.350 3.842 5.080 . 0 0 "[ . 1 . 2]" 1
310 1 26 GLU HG3 1 27 ASN H 3.650 . 5.500 4.252 3.323 4.908 . 0 0 "[ . 1 . 2]" 1
311 1 26 GLU HG3 1 59 TYR QD 3.650 . 5.500 4.199 3.042 5.470 . 0 0 "[ . 1 . 2]" 1
312 1 27 ASN H 1 27 ASN HB2 2.650 . 3.500 2.596 2.472 2.704 . 0 0 "[ . 1 . 2]" 1
313 1 27 ASN H 1 27 ASN HB3 2.830 . 3.850 2.446 2.377 2.509 . 0 0 "[ . 1 . 2]" 1
314 1 27 ASN H 1 28 LEU H 3.650 . 5.500 2.819 2.724 2.901 . 0 0 "[ . 1 . 2]" 1
315 1 27 ASN H 1 59 TYR QE 3.650 . 5.500 4.845 3.925 5.303 . 0 0 "[ . 1 . 2]" 1
316 1 27 ASN HA 1 30 ARG H 3.650 . 5.500 3.498 3.366 3.600 . 0 0 "[ . 1 . 2]" 1
317 1 27 ASN HA 1 31 PHE H 3.650 . 5.500 3.973 3.806 4.226 . 0 0 "[ . 1 . 2]" 1
318 1 27 ASN HA 1 60 VAL H 3.650 . 5.500 4.750 4.325 5.096 . 0 0 "[ . 1 . 2]" 1
319 1 27 ASN HA 1 60 VAL MG2 3.050 . 4.300 3.368 3.138 3.627 . 0 0 "[ . 1 . 2]" 1
320 1 27 ASN HB2 1 28 LEU H 3.040 . 4.290 3.822 3.725 3.905 . 0 0 "[ . 1 . 2]" 1
321 1 27 ASN HB2 1 60 VAL MG2 3.170 . 4.540 3.990 3.673 4.320 . 0 0 "[ . 1 . 2]" 1
322 1 27 ASN HB3 1 27 ASN HD21 2.100 . 2.400 2.407 2.393 2.419 0.019 5 0 "[ . 1 . 2]" 1
323 1 27 ASN HB3 1 28 LEU H 2.170 . 2.540 2.394 2.277 2.500 . 0 0 "[ . 1 . 2]" 1
324 1 27 ASN HB3 1 29 TYR H 3.650 . 5.500 4.902 4.774 5.092 . 0 0 "[ . 1 . 2]" 1
325 1 27 ASN HD21 1 28 LEU QD 2.940 . 4.080 2.680 1.886 3.247 . 0 0 "[ . 1 . 2]" 1
326 1 27 ASN HD22 1 28 LEU H 3.650 . 5.500 4.358 4.219 4.484 . 0 0 "[ . 1 . 2]" 1
327 1 27 ASN HD22 1 28 LEU HA 3.060 . 4.330 3.601 3.441 3.791 . 0 0 "[ . 1 . 2]" 1
328 1 27 ASN HD22 1 28 LEU QD 3.230 . 4.670 3.462 2.849 4.013 . 0 0 "[ . 1 . 2]" 1
329 1 27 ASN HD22 1 30 ARG HB2 3.650 . 5.500 5.330 4.957 5.502 0.002 18 0 "[ . 1 . 2]" 1
330 1 27 ASN HD22 1 31 PHE H 3.650 . 5.500 4.420 4.230 4.520 . 0 0 "[ . 1 . 2]" 1
331 1 27 ASN HD22 1 31 PHE HA 3.650 . 5.500 5.499 5.482 5.516 0.016 16 0 "[ . 1 . 2]" 1
332 1 27 ASN HD22 1 31 PHE HB2 2.600 . 3.400 3.364 3.151 3.402 0.002 15 0 "[ . 1 . 2]" 1
333 1 27 ASN HD22 1 38 ASP HA 3.210 . 4.620 3.322 2.773 3.926 . 0 0 "[ . 1 . 2]" 1
334 1 28 LEU H 1 28 LEU HB2 2.100 . 2.400 2.312 2.114 2.375 . 0 0 "[ . 1 . 2]" 1
335 1 28 LEU H 1 28 LEU MD1 2.930 . 4.060 3.509 3.273 3.990 . 0 0 "[ . 1 . 2]" 1
336 1 28 LEU H 1 28 LEU MD2 2.930 . 4.060 3.311 1.869 3.812 . 0 0 "[ . 1 . 2]" 1
337 1 28 LEU H 1 28 LEU HG 2.920 . 4.040 2.640 2.229 4.030 . 0 0 "[ . 1 . 2]" 1
338 1 28 LEU H 1 29 TYR H 3.650 . 5.500 2.783 2.712 2.860 . 0 0 "[ . 1 . 2]" 1
339 1 28 LEU H 1 89 VAL MG1 3.650 . 5.500 5.506 5.490 5.522 0.022 11 0 "[ . 1 . 2]" 1
340 1 28 LEU HA 1 28 LEU MD1 3.000 . 4.200 3.450 2.123 3.795 . 0 0 "[ . 1 . 2]" 1
341 1 28 LEU HA 1 28 LEU QD 2.380 . 2.960 2.118 1.933 2.207 . 0 0 "[ . 1 . 2]" 1
342 1 28 LEU HA 1 28 LEU MD2 3.000 . 4.200 2.185 2.105 2.267 . 0 0 "[ . 1 . 2]" 1
343 1 28 LEU HA 1 28 LEU HG 2.920 . 4.040 2.866 2.566 3.565 . 0 0 "[ . 1 . 2]" 1
344 1 28 LEU HA 1 31 PHE H 3.270 . 4.740 3.533 3.404 3.713 . 0 0 "[ . 1 . 2]" 1
345 1 28 LEU HA 1 31 PHE HB2 2.700 . 3.600 2.620 2.349 2.904 . 0 0 "[ . 1 . 2]" 1
346 1 28 LEU HA 1 32 GLN HE21 3.330 . 4.870 3.823 3.678 3.937 . 0 0 "[ . 1 . 2]" 1
347 1 28 LEU HB2 1 28 LEU MD1 2.540 . 3.280 2.467 2.205 3.188 . 0 0 "[ . 1 . 2]" 1
348 1 28 LEU HB2 1 28 LEU MD2 2.540 . 3.280 3.022 2.332 3.201 . 0 0 "[ . 1 . 2]" 1
349 1 28 LEU HB2 1 29 TYR H 2.830 . 3.870 2.723 2.612 2.874 . 0 0 "[ . 1 . 2]" 1
350 1 28 LEU HB2 1 32 GLN HE22 3.300 . 4.800 3.969 3.683 4.490 . 0 0 "[ . 1 . 2]" 1
351 1 28 LEU HB2 1 87 VAL MG1 2.610 . 3.420 3.287 3.074 3.424 0.004 13 0 "[ . 1 . 2]" 1
352 1 28 LEU HB3 1 28 LEU MD1 2.770 . 3.740 2.390 2.241 2.500 . 0 0 "[ . 1 . 2]" 1
353 1 28 LEU HB3 1 28 LEU QD 2.400 . 3.000 2.077 2.030 2.214 . 0 0 "[ . 1 . 2]" 1
354 1 28 LEU HB3 1 28 LEU MD2 2.770 . 3.740 2.399 2.179 3.183 . 0 0 "[ . 1 . 2]" 1
355 1 28 LEU HB3 1 29 TYR H 3.650 . 5.500 3.441 2.995 3.586 . 0 0 "[ . 1 . 2]" 1
356 1 28 LEU HB3 1 31 PHE HB2 3.650 . 5.500 4.915 4.600 5.335 . 0 0 "[ . 1 . 2]" 1
357 1 28 LEU HB3 1 32 GLN HE21 2.170 . 2.540 2.200 1.995 2.544 0.004 2 0 "[ . 1 . 2]" 1
358 1 28 LEU HB3 1 32 GLN HE22 2.330 . 2.860 2.622 2.440 2.861 0.001 2 0 "[ . 1 . 2]" 1
359 1 28 LEU HB3 1 87 VAL MG1 2.880 . 3.960 3.423 2.533 3.863 . 0 0 "[ . 1 . 2]" 1
360 1 28 LEU QD 1 31 PHE HB2 3.060 . 4.320 3.581 3.210 3.833 . 0 0 "[ . 1 . 2]" 1
361 1 28 LEU QD 1 32 GLN H 3.620 . 5.440 4.179 3.596 4.390 . 0 0 "[ . 1 . 2]" 1
362 1 28 LEU QD 1 32 GLN HE21 2.170 . 2.540 2.258 1.796 2.513 0.004 9 0 "[ . 1 . 2]" 1
363 1 28 LEU QD 1 32 GLN HE22 2.830 . 3.860 3.138 3.058 3.303 . 0 0 "[ . 1 . 2]" 1
364 1 28 LEU QD 1 32 GLN HG2 3.320 . 4.840 4.068 3.430 4.348 . 0 0 "[ . 1 . 2]" 1
365 1 28 LEU QD 1 38 ASP HA 2.680 . 3.560 3.235 2.943 3.553 . 0 0 "[ . 1 . 2]" 1
366 1 28 LEU QD 1 38 ASP QB 2.420 . 3.040 3.035 2.986 3.050 0.010 19 0 "[ . 1 . 2]" 1
367 1 28 LEU QD 1 39 GLU H 3.620 . 5.440 4.629 4.189 5.028 . 0 0 "[ . 1 . 2]" 1
368 1 28 LEU QD 1 89 VAL HA 2.520 . 3.240 2.358 2.122 3.153 . 0 0 "[ . 1 . 2]" 1
369 1 28 LEU QD 1 89 VAL MG1 2.340 . 2.880 1.985 1.794 2.671 0.006 11 0 "[ . 1 . 2]" 1
370 1 28 LEU QD 1 89 VAL MG2 2.560 . 3.320 2.557 2.012 3.211 . 0 0 "[ . 1 . 2]" 1
371 1 28 LEU QD 1 90 TYR H 2.850 . 3.890 2.716 2.069 3.530 . 0 0 "[ . 1 . 2]" 1
372 1 28 LEU QD 1 90 TYR QD 2.840 . 3.880 2.390 2.082 3.131 . 0 0 "[ . 1 . 2]" 1
373 1 28 LEU QD 1 90 TYR QE 3.250 . 4.700 2.601 2.022 4.475 . 0 0 "[ . 1 . 2]" 1
374 1 28 LEU MD1 1 89 VAL HA 3.020 . 4.240 2.400 2.141 3.508 . 0 0 "[ . 1 . 2]" 1
375 1 28 LEU MD1 1 89 VAL MG1 3.000 . 4.210 2.096 1.806 3.268 . 0 0 "[ . 1 . 2]" 1
376 1 28 LEU MD1 1 90 TYR H 3.220 . 4.640 3.003 2.076 4.410 . 0 0 "[ . 1 . 2]" 1
377 1 28 LEU MD2 1 89 VAL HA 3.020 . 4.240 3.696 3.247 4.157 . 0 0 "[ . 1 . 2]" 1
378 1 28 LEU MD2 1 89 VAL MG1 3.000 . 4.210 3.066 2.461 3.489 . 0 0 "[ . 1 . 2]" 1
379 1 28 LEU MD2 1 90 TYR H 3.220 . 4.640 3.411 2.533 4.512 . 0 0 "[ . 1 . 2]" 1
380 1 29 TYR H 1 29 TYR HB2 2.600 . 3.410 2.671 2.586 2.771 . 0 0 "[ . 1 . 2]" 1
381 1 29 TYR H 1 29 TYR HB3 2.690 . 3.580 2.367 2.245 2.479 . 0 0 "[ . 1 . 2]" 1
382 1 29 TYR H 1 29 TYR QD 3.650 . 5.500 4.140 4.061 4.179 . 0 0 "[ . 1 . 2]" 1
383 1 29 TYR H 1 30 ARG H 3.650 . 5.500 2.761 2.668 2.835 . 0 0 "[ . 1 . 2]" 1
384 1 29 TYR H 1 87 VAL MG2 3.150 . 4.500 4.213 3.746 4.437 . 0 0 "[ . 1 . 2]" 1
385 1 29 TYR HA 1 29 TYR QD 3.060 . 4.320 2.597 2.427 3.046 . 0 0 "[ . 1 . 2]" 1
386 1 29 TYR HA 1 32 GLN HB2 3.080 . 4.360 2.581 2.370 2.744 . 0 0 "[ . 1 . 2]" 1
387 1 29 TYR HA 1 87 VAL MG1 3.400 . 5.000 3.118 2.854 3.411 . 0 0 "[ . 1 . 2]" 1
388 1 29 TYR HA 1 87 VAL MG2 3.000 . 4.210 3.224 2.644 3.839 . 0 0 "[ . 1 . 2]" 1
389 1 29 TYR HB2 1 30 ARG H 3.030 . 4.260 3.872 3.813 3.916 . 0 0 "[ . 1 . 2]" 1
390 1 29 TYR HB2 1 87 VAL MG1 2.910 . 4.020 2.522 2.162 2.993 . 0 0 "[ . 1 . 2]" 1
391 1 29 TYR HB2 1 87 VAL MG2 2.380 . 2.960 2.246 2.063 2.441 . 0 0 "[ . 1 . 2]" 1
392 1 29 TYR HB3 1 30 ARG H 2.990 . 4.180 2.475 2.427 2.527 . 0 0 "[ . 1 . 2]" 1
393 1 29 TYR HB3 1 87 VAL MG1 3.250 . 4.710 3.852 3.559 4.264 . 0 0 "[ . 1 . 2]" 1
394 1 29 TYR HB3 1 87 VAL MG2 2.880 . 3.960 3.698 3.515 3.918 . 0 0 "[ . 1 . 2]" 1
395 1 29 TYR QD 1 30 ARG H 3.650 . 5.500 3.088 2.528 3.300 . 0 0 "[ . 1 . 2]" 1
396 1 29 TYR QD 1 30 ARG HA 2.750 . 3.700 3.374 2.605 3.679 . 0 0 "[ . 1 . 2]" 1
397 1 29 TYR QD 1 30 ARG HB2 3.650 . 5.500 4.707 4.106 4.987 . 0 0 "[ . 1 . 2]" 1
398 1 29 TYR QD 1 30 ARG HG2 3.070 . 4.340 2.999 2.534 3.340 . 0 0 "[ . 1 . 2]" 1
399 1 29 TYR QD 1 30 ARG QG 2.790 . 3.780 2.590 2.171 2.899 . 0 0 "[ . 1 . 2]" 1
400 1 29 TYR QD 1 30 ARG HG3 3.070 . 4.340 2.837 2.362 3.181 . 0 0 "[ . 1 . 2]" 1
401 1 29 TYR QD 1 73 TYR QE 3.000 . 4.200 4.080 3.914 4.202 0.002 19 0 "[ . 1 . 2]" 1
402 1 29 TYR QD 1 87 VAL MG2 2.520 . 3.230 2.247 2.070 2.335 . 0 0 "[ . 1 . 2]" 1
403 1 29 TYR QE 1 87 VAL MG2 3.040 . 4.280 3.819 3.532 3.990 . 0 0 "[ . 1 . 2]" 1
404 1 30 ARG H 1 30 ARG HB2 2.250 . 2.700 2.454 2.390 2.519 . 0 0 "[ . 1 . 2]" 1
405 1 30 ARG H 1 30 ARG HB3 2.870 . 3.930 3.584 3.573 3.602 . 0 0 "[ . 1 . 2]" 1
406 1 30 ARG H 1 30 ARG HD3 3.420 . 5.040 4.802 4.717 4.882 . 0 0 "[ . 1 . 2]" 1
407 1 30 ARG H 1 30 ARG QG 3.120 . 4.440 2.168 2.012 2.313 . 0 0 "[ . 1 . 2]" 1
408 1 30 ARG H 1 31 PHE H 3.650 . 5.500 2.782 2.743 2.812 . 0 0 "[ . 1 . 2]" 1
409 1 30 ARG H 1 60 VAL MG2 3.650 . 5.500 5.339 5.040 5.499 . 0 0 "[ . 1 . 2]" 1
410 1 30 ARG HA 1 30 ARG HG2 2.770 . 3.730 2.383 2.318 2.458 . 0 0 "[ . 1 . 2]" 1
411 1 30 ARG HA 1 30 ARG QG 2.510 . 3.220 2.306 2.254 2.367 . 0 0 "[ . 1 . 2]" 1
412 1 30 ARG HA 1 30 ARG HG3 2.770 . 3.730 3.078 3.000 3.118 . 0 0 "[ . 1 . 2]" 1
413 1 30 ARG HA 1 33 GLN H 3.110 . 4.420 3.709 3.599 3.959 . 0 0 "[ . 1 . 2]" 1
414 1 30 ARG HA 1 33 GLN QB 2.720 . 3.640 2.949 2.603 3.624 . 0 0 "[ . 1 . 2]" 1
415 1 30 ARG HA 1 33 GLN HG2 3.250 . 4.700 3.672 2.373 4.195 . 0 0 "[ . 1 . 2]" 1
416 1 30 ARG HA 1 33 GLN QG 2.920 . 4.040 3.100 2.218 3.484 . 0 0 "[ . 1 . 2]" 1
417 1 30 ARG HA 1 33 GLN HG3 3.250 . 4.700 3.419 2.662 3.722 . 0 0 "[ . 1 . 2]" 1
418 1 30 ARG HA 1 73 TYR QE 2.670 . 3.530 2.672 2.343 2.975 . 0 0 "[ . 1 . 2]" 1
419 1 30 ARG HB2 1 30 ARG HD3 2.970 . 4.140 3.232 3.119 3.360 . 0 0 "[ . 1 . 2]" 1
420 1 30 ARG HB2 1 31 PHE H 3.390 . 4.980 2.462 2.375 2.580 . 0 0 "[ . 1 . 2]" 1
421 1 30 ARG HB2 1 31 PHE HB2 3.170 . 4.540 4.425 4.307 4.526 . 0 0 "[ . 1 . 2]" 1
422 1 30 ARG HB2 1 32 GLN H 3.650 . 5.500 5.025 4.908 5.124 . 0 0 "[ . 1 . 2]" 1
423 1 30 ARG HB2 1 60 VAL HB 3.270 . 4.740 4.074 3.518 4.389 . 0 0 "[ . 1 . 2]" 1
424 1 30 ARG HB2 1 73 TYR QD 3.650 . 5.500 4.952 4.705 5.188 . 0 0 "[ . 1 . 2]" 1
425 1 30 ARG HB2 1 73 TYR QE 3.270 . 4.740 4.541 4.367 4.737 . 0 0 "[ . 1 . 2]" 1
426 1 30 ARG HB3 1 30 ARG HD3 2.850 . 3.890 2.505 2.439 2.675 . 0 0 "[ . 1 . 2]" 1
427 1 30 ARG HB3 1 31 PHE H 3.060 . 4.320 3.476 3.378 3.559 . 0 0 "[ . 1 . 2]" 1
428 1 30 ARG HB3 1 60 VAL HB 3.350 . 4.900 3.684 3.314 4.058 . 0 0 "[ . 1 . 2]" 1
429 1 30 ARG HB3 1 60 VAL MG2 3.240 . 4.680 3.757 3.473 4.125 . 0 0 "[ . 1 . 2]" 1
430 1 30 ARG HD2 1 60 VAL H 3.480 . 5.170 3.289 2.940 3.614 . 0 0 "[ . 1 . 2]" 1
431 1 30 ARG HD2 1 60 VAL HB 2.770 . 3.740 2.659 2.366 3.027 . 0 0 "[ . 1 . 2]" 1
432 1 30 ARG HD2 1 60 VAL MG1 3.550 . 5.300 4.114 3.834 4.381 . 0 0 "[ . 1 . 2]" 1
433 1 30 ARG HD2 1 60 VAL MG2 3.400 . 5.000 2.878 2.635 3.044 . 0 0 "[ . 1 . 2]" 1
434 1 30 ARG HD2 1 73 TYR QD 3.650 . 5.500 4.309 4.125 4.474 . 0 0 "[ . 1 . 2]" 1
435 1 30 ARG HD3 1 60 VAL H 3.360 . 4.920 4.117 3.821 4.444 . 0 0 "[ . 1 . 2]" 1
436 1 30 ARG HD3 1 60 VAL HB 2.750 . 3.700 2.650 2.347 2.979 . 0 0 "[ . 1 . 2]" 1
437 1 30 ARG HD3 1 60 VAL MG1 3.040 . 4.280 3.806 3.438 4.127 . 0 0 "[ . 1 . 2]" 1
438 1 30 ARG HD3 1 60 VAL MG2 3.300 . 4.800 3.735 3.463 3.940 . 0 0 "[ . 1 . 2]" 1
439 1 30 ARG HD3 1 63 LEU QB 3.570 . 5.340 4.835 4.567 5.343 0.003 11 0 "[ . 1 . 2]" 1
440 1 30 ARG HD3 1 73 TYR QD 3.440 . 5.090 2.921 2.640 3.104 . 0 0 "[ . 1 . 2]" 1
441 1 30 ARG HD3 1 73 TYR QE 3.060 . 4.320 3.867 3.668 4.317 . 0 0 "[ . 1 . 2]" 1
442 1 30 ARG HE 1 30 ARG HG2 2.330 . 2.860 2.716 2.647 2.807 . 0 0 "[ . 1 . 2]" 1
443 1 30 ARG HE 1 30 ARG QG 2.090 . 2.380 2.255 2.233 2.326 . 0 0 "[ . 1 . 2]" 1
444 1 30 ARG HE 1 30 ARG HG3 2.330 . 2.860 2.411 2.357 2.518 . 0 0 "[ . 1 . 2]" 1
445 1 30 ARG HE 1 73 TYR HB3 3.060 . 4.330 3.961 3.577 4.331 0.001 16 0 "[ . 1 . 2]" 1
446 1 30 ARG HE 1 74 ASN H 3.650 . 5.500 5.098 4.816 5.478 . 0 0 "[ . 1 . 2]" 1
447 1 30 ARG QG 1 73 TYR QD 3.420 . 5.040 2.715 2.412 3.092 . 0 0 "[ . 1 . 2]" 1
448 1 31 PHE H 1 31 PHE HB2 2.630 . 3.460 2.193 2.085 2.258 . 0 0 "[ . 1 . 2]" 1
449 1 31 PHE H 1 32 GLN H 3.650 . 5.500 2.715 2.629 2.802 . 0 0 "[ . 1 . 2]" 1
450 1 31 PHE HA 1 34 ALA MB 2.680 . 3.560 2.498 2.315 2.735 . 0 0 "[ . 1 . 2]" 1
451 1 31 PHE HA 1 36 TYR HB2 3.140 . 4.480 3.195 2.788 3.654 . 0 0 "[ . 1 . 2]" 1
452 1 31 PHE HA 1 36 TYR HB3 3.570 . 5.340 4.856 4.388 5.258 . 0 0 "[ . 1 . 2]" 1
453 1 31 PHE HA 1 63 LEU QD 3.060 . 4.320 2.631 2.024 3.876 . 0 0 "[ . 1 . 2]" 1
454 1 31 PHE HB2 1 32 GLN H 2.790 . 3.780 2.627 2.550 2.711 . 0 0 "[ . 1 . 2]" 1
455 1 31 PHE HB2 1 32 GLN HB2 3.650 . 5.500 4.889 4.814 5.010 . 0 0 "[ . 1 . 2]" 1
456 1 31 PHE HB2 1 36 TYR HB2 3.060 . 4.330 4.317 4.191 4.342 0.012 19 0 "[ . 1 . 2]" 1
457 1 31 PHE HB2 1 38 ASP HA 2.980 . 4.160 3.693 3.458 4.061 . 0 0 "[ . 1 . 2]" 1
458 1 32 GLN H 1 32 GLN HB2 2.100 . 2.400 2.369 2.323 2.406 0.006 19 0 "[ . 1 . 2]" 1
459 1 32 GLN H 1 32 GLN HG2 2.980 . 4.160 3.694 3.613 3.825 . 0 0 "[ . 1 . 2]" 1
460 1 32 GLN H 1 32 GLN HG3 2.750 . 3.700 2.404 2.293 2.533 . 0 0 "[ . 1 . 2]" 1
461 1 32 GLN H 1 33 GLN H 3.650 . 5.500 2.794 2.737 2.906 . 0 0 "[ . 1 . 2]" 1
462 1 32 GLN H 1 33 GLN QG 3.570 . 5.340 4.631 4.539 4.740 . 0 0 "[ . 1 . 2]" 1
463 1 32 GLN H 1 34 ALA H 3.650 . 5.500 4.078 3.829 4.248 . 0 0 "[ . 1 . 2]" 1
464 1 32 GLN HA 1 32 GLN HG2 2.960 . 4.120 2.480 2.372 2.563 . 0 0 "[ . 1 . 2]" 1
465 1 32 GLN HA 1 32 GLN HG3 2.940 . 4.080 2.739 2.604 2.796 . 0 0 "[ . 1 . 2]" 1
466 1 32 GLN HA 1 34 ALA H 3.650 . 5.500 4.209 3.674 4.397 . 0 0 "[ . 1 . 2]" 1
467 1 32 GLN HA 1 35 GLY H 3.650 . 5.500 3.303 3.087 3.461 . 0 0 "[ . 1 . 2]" 1
468 1 32 GLN HB3 1 35 GLY H 3.650 . 5.500 4.925 4.673 5.027 . 0 0 "[ . 1 . 2]" 1
469 1 32 GLN HE21 1 32 GLN HG2 2.400 . 3.000 2.950 2.905 2.999 . 0 0 "[ . 1 . 2]" 1
470 1 32 GLN HE21 1 32 GLN HG3 2.100 . 2.400 2.395 2.366 2.405 0.005 20 0 "[ . 1 . 2]" 1
471 1 32 GLN HE22 1 32 GLN HG2 2.920 . 4.040 3.795 3.777 3.816 . 0 0 "[ . 1 . 2]" 1
472 1 32 GLN HE22 1 32 GLN HG3 2.810 . 3.830 3.564 3.551 3.573 . 0 0 "[ . 1 . 2]" 1
473 1 32 GLN HG2 1 37 ARG HA 3.160 . 4.520 3.529 3.138 4.192 . 0 0 "[ . 1 . 2]" 1
474 1 32 GLN HG3 1 37 ARG HA 2.960 . 4.120 3.710 3.262 4.090 . 0 0 "[ . 1 . 2]" 1
475 1 33 GLN H 1 33 GLN QB 2.620 . 3.440 2.281 2.170 2.334 . 0 0 "[ . 1 . 2]" 1
476 1 33 GLN H 1 33 GLN HE21 3.650 . 5.500 4.738 4.107 5.499 . 0 0 "[ . 1 . 2]" 1
477 1 33 GLN H 1 33 GLN HG2 2.970 . 4.140 2.714 2.362 3.707 . 0 0 "[ . 1 . 2]" 1
478 1 33 GLN H 1 33 GLN QG 2.610 . 3.420 2.474 2.333 2.812 . 0 0 "[ . 1 . 2]" 1
479 1 33 GLN H 1 33 GLN HG3 2.970 . 4.140 3.397 2.714 3.648 . 0 0 "[ . 1 . 2]" 1
480 1 33 GLN H 1 34 ALA H 3.650 . 5.500 2.634 2.487 2.704 . 0 0 "[ . 1 . 2]" 1
481 1 33 GLN H 1 34 ALA MB 3.190 . 4.580 4.274 4.166 4.353 . 0 0 "[ . 1 . 2]" 1
482 1 33 GLN H 1 35 GLY H 3.650 . 5.500 3.880 3.750 4.056 . 0 0 "[ . 1 . 2]" 1
483 1 33 GLN H 1 73 TYR QE 3.650 . 5.500 5.413 5.063 5.501 0.001 9 0 "[ . 1 . 2]" 1
484 1 33 GLN HA 1 33 GLN QG 2.750 . 3.700 2.810 2.497 3.428 . 0 0 "[ . 1 . 2]" 1
485 1 33 GLN QB 1 35 GLY H 3.570 . 5.340 4.517 4.320 4.963 . 0 0 "[ . 1 . 2]" 1
486 1 33 GLN QB 1 73 TYR QE 3.110 . 4.420 3.685 3.185 4.388 . 0 0 "[ . 1 . 2]" 1
487 1 33 GLN HE21 1 33 GLN QG 2.080 . 2.360 2.265 2.208 2.358 . 0 0 "[ . 1 . 2]" 1
488 1 33 GLN HE22 1 33 GLN QG 2.680 . 3.560 3.289 3.262 3.342 . 0 0 "[ . 1 . 2]" 1
489 1 33 GLN HG2 1 73 TYR QE 3.650 . 5.500 4.541 2.377 5.408 . 0 0 "[ . 1 . 2]" 1
490 1 33 GLN HG3 1 73 TYR QE 3.650 . 5.500 3.819 3.428 4.137 . 0 0 "[ . 1 . 2]" 1
491 1 34 ALA H 1 34 ALA MB 2.360 . 2.920 2.144 2.043 2.240 . 0 0 "[ . 1 . 2]" 1
492 1 34 ALA H 1 35 GLY H 3.650 . 5.500 2.460 2.233 2.564 . 0 0 "[ . 1 . 2]" 1
493 1 34 ALA H 1 35 GLY QA 3.570 . 5.340 4.436 4.250 4.517 . 0 0 "[ . 1 . 2]" 1
494 1 34 ALA H 1 36 TYR H 3.650 . 5.500 3.602 3.413 3.684 . 0 0 "[ . 1 . 2]" 1
495 1 34 ALA H 1 63 LEU QD 3.620 . 5.440 4.071 3.334 5.257 . 0 0 "[ . 1 . 2]" 1
496 1 34 ALA H 1 73 TYR QE 3.650 . 5.500 4.884 4.485 5.509 0.009 16 0 "[ . 1 . 2]" 1
497 1 34 ALA HA 1 65 ARG HD2 3.310 . 4.820 3.177 2.395 4.523 . 0 0 "[ . 1 . 2]" 1
498 1 34 ALA HA 1 65 ARG HD3 3.310 . 4.820 3.786 2.501 4.353 . 0 0 "[ . 1 . 2]" 1
499 1 34 ALA HA 1 65 ARG HG2 3.130 . 4.460 2.845 2.300 3.425 . 0 0 "[ . 1 . 2]" 1
500 1 34 ALA MB 1 35 GLY H 2.560 . 3.330 3.044 2.966 3.104 . 0 0 "[ . 1 . 2]" 1
501 1 34 ALA MB 1 36 TYR H 2.400 . 3.000 2.899 2.690 3.014 0.014 19 0 "[ . 1 . 2]" 1
502 1 34 ALA MB 1 36 TYR QD 2.540 . 3.280 2.564 2.059 3.283 0.003 12 0 "[ . 1 . 2]" 1
503 1 34 ALA MB 1 63 LEU QB 2.770 . 3.740 2.641 2.260 2.978 . 0 0 "[ . 1 . 2]" 1
504 1 34 ALA MB 1 63 LEU MD1 3.070 . 4.340 3.326 1.926 4.333 . 0 0 "[ . 1 . 2]" 1
505 1 34 ALA MB 1 63 LEU QD 2.330 . 2.860 2.182 1.790 2.583 0.010 2 0 "[ . 1 . 2]" 1
506 1 34 ALA MB 1 63 LEU MD2 3.070 . 4.340 2.772 2.096 4.346 0.006 13 0 "[ . 1 . 2]" 1
507 1 34 ALA MB 1 63 LEU HG 2.810 . 3.810 3.101 2.763 3.821 0.011 6 0 "[ . 1 . 2]" 1
508 1 34 ALA MB 1 65 ARG QD 3.050 . 4.300 3.957 3.463 4.306 0.006 1 0 "[ . 1 . 2]" 1
509 1 34 ALA MB 1 71 PHE HB2 3.430 . 5.060 4.930 4.098 5.063 0.003 8 0 "[ . 1 . 2]" 1
510 1 34 ALA MB 1 71 PHE HB3 3.430 . 5.060 4.292 3.885 5.080 0.020 19 0 "[ . 1 . 2]" 1
511 1 34 ALA MB 1 73 TYR QE 2.980 . 4.160 3.419 3.083 3.929 . 0 0 "[ . 1 . 2]" 1
512 1 35 GLY H 1 36 TYR H 3.650 . 5.500 2.191 2.086 2.320 . 0 0 "[ . 1 . 2]" 1
513 1 35 GLY QA 1 36 TYR QD 3.210 . 4.620 3.975 3.233 4.416 . 0 0 "[ . 1 . 2]" 1
514 1 36 TYR H 1 36 TYR QD 3.270 . 4.740 3.078 1.839 3.456 . 0 0 "[ . 1 . 2]" 1
515 1 36 TYR H 1 37 ARG H 3.650 . 5.500 4.510 4.468 4.554 . 0 0 "[ . 1 . 2]" 1
516 1 36 TYR H 1 41 GLU HB3 3.650 . 5.500 5.499 5.319 5.518 0.018 6 0 "[ . 1 . 2]" 1
517 1 36 TYR HA 1 36 TYR QD 2.650 . 3.500 2.296 2.023 3.148 . 0 0 "[ . 1 . 2]" 1
518 1 36 TYR HA 1 37 ARG H 2.570 . 3.340 2.223 2.167 2.260 . 0 0 "[ . 1 . 2]" 1
519 1 36 TYR HA 1 38 ASP H 3.650 . 5.500 4.087 4.025 4.199 . 0 0 "[ . 1 . 2]" 1
520 1 36 TYR HB2 1 41 GLU HB3 2.850 . 3.900 3.893 3.804 3.923 0.023 11 0 "[ . 1 . 2]" 1
521 1 36 TYR HB3 1 37 ARG H 2.330 . 2.860 2.844 2.766 2.874 0.014 6 0 "[ . 1 . 2]" 1
522 1 36 TYR HB3 1 38 ASP H 2.750 . 3.700 3.020 2.875 3.226 . 0 0 "[ . 1 . 2]" 1
523 1 36 TYR HB3 1 38 ASP HA 3.650 . 5.500 4.764 4.633 4.983 . 0 0 "[ . 1 . 2]" 1
524 1 36 TYR HB3 1 41 GLU H 3.310 . 4.820 4.221 4.073 4.471 . 0 0 "[ . 1 . 2]" 1
525 1 36 TYR HB3 1 41 GLU HB3 2.990 . 4.180 2.168 2.078 2.253 . 0 0 "[ . 1 . 2]" 1
526 1 36 TYR HB3 1 41 GLU QG 3.040 . 4.290 3.321 2.916 3.978 . 0 0 "[ . 1 . 2]" 1
527 1 36 TYR HB3 1 42 TYR H 3.340 . 4.880 3.151 2.813 3.451 . 0 0 "[ . 1 . 2]" 1
528 1 36 TYR HB3 1 42 TYR HB2 3.350 . 4.910 3.486 3.073 3.931 . 0 0 "[ . 1 . 2]" 1
529 1 36 TYR QD 1 41 GLU HB3 3.400 . 5.000 3.162 2.248 3.849 . 0 0 "[ . 1 . 2]" 1
530 1 36 TYR QD 1 41 GLU QG 3.190 . 4.590 2.378 2.096 3.545 . 0 0 "[ . 1 . 2]" 1
531 1 36 TYR QD 1 42 TYR HA 3.020 . 4.250 3.295 2.272 3.592 . 0 0 "[ . 1 . 2]" 1
532 1 36 TYR QD 1 42 TYR HB2 3.020 . 4.250 2.865 2.433 3.349 . 0 0 "[ . 1 . 2]" 1
533 1 37 ARG H 1 37 ARG QD 2.100 . 2.400 1.996 1.796 2.405 0.005 6 0 "[ . 1 . 2]" 1
534 1 37 ARG H 1 37 ARG HG2 2.920 . 4.040 1.871 1.796 1.972 0.004 19 0 "[ . 1 . 2]" 1
535 1 37 ARG H 1 37 ARG HG3 3.310 . 4.820 3.338 3.180 3.521 . 0 0 "[ . 1 . 2]" 1
536 1 37 ARG H 1 38 ASP H 3.650 . 5.500 2.381 2.302 2.451 . 0 0 "[ . 1 . 2]" 1
537 1 37 ARG H 1 41 GLU H 3.650 . 5.500 4.447 4.068 4.707 . 0 0 "[ . 1 . 2]" 1
538 1 37 ARG H 1 41 GLU HB2 3.310 . 4.820 3.005 2.513 3.232 . 0 0 "[ . 1 . 2]" 1
539 1 37 ARG H 1 41 GLU HB3 3.650 . 5.500 2.791 2.342 3.133 . 0 0 "[ . 1 . 2]" 1
540 1 37 ARG QB 1 38 ASP H 2.730 . 3.660 3.311 3.078 3.457 . 0 0 "[ . 1 . 2]" 1
541 1 37 ARG QB 1 90 TYR QE 3.060 . 4.320 3.421 2.827 4.306 . 0 0 "[ . 1 . 2]" 1
542 1 37 ARG HB2 1 38 ASP H 3.120 . 4.450 3.509 3.171 3.768 . 0 0 "[ . 1 . 2]" 1
543 1 37 ARG HB3 1 38 ASP H 3.120 . 4.450 4.089 4.020 4.165 . 0 0 "[ . 1 . 2]" 1
544 1 37 ARG QD 1 38 ASP H 3.500 . 5.210 3.661 3.504 3.844 . 0 0 "[ . 1 . 2]" 1
545 1 37 ARG HG2 1 38 ASP H 2.100 . 2.400 1.897 1.799 2.333 0.001 15 0 "[ . 1 . 2]" 1
546 1 37 ARG HG2 1 41 GLU H 3.650 . 5.500 3.371 2.973 3.802 . 0 0 "[ . 1 . 2]" 1
547 1 38 ASP H 1 41 GLU H 3.650 . 5.500 3.109 2.921 3.262 . 0 0 "[ . 1 . 2]" 1
548 1 38 ASP H 1 41 GLU HB2 3.180 . 4.560 3.202 2.819 3.530 . 0 0 "[ . 1 . 2]" 1
549 1 38 ASP H 1 41 GLU HB3 3.590 . 5.380 2.885 2.621 3.750 . 0 0 "[ . 1 . 2]" 1
550 1 38 ASP H 1 42 TYR H 3.650 . 5.500 3.968 3.474 4.210 . 0 0 "[ . 1 . 2]" 1
551 1 38 ASP QB 1 39 GLU H 2.480 . 3.160 2.667 2.071 3.169 0.009 2 0 "[ . 1 . 2]" 1
552 1 38 ASP HB2 1 39 GLU H 2.760 . 3.720 3.030 2.086 3.723 0.003 14 0 "[ . 1 . 2]" 1
553 1 38 ASP HB3 1 39 GLU H 2.760 . 3.720 3.425 2.926 3.720 . 0 0 "[ . 1 . 2]" 1
554 1 39 GLU H 1 39 GLU HB2 2.980 . 4.160 3.141 2.445 3.612 . 0 0 "[ . 1 . 2]" 1
555 1 39 GLU H 1 39 GLU QB 2.620 . 3.440 2.479 2.359 2.819 . 0 0 "[ . 1 . 2]" 1
556 1 39 GLU H 1 39 GLU HB3 2.980 . 4.160 2.977 2.392 3.602 . 0 0 "[ . 1 . 2]" 1
557 1 39 GLU H 1 39 GLU QG 2.100 . 2.400 2.145 1.803 2.409 0.009 19 0 "[ . 1 . 2]" 1
558 1 39 GLU H 1 40 ILE H 3.650 . 5.500 2.856 2.766 2.959 . 0 0 "[ . 1 . 2]" 1
559 1 39 GLU HA 1 39 GLU HG2 2.850 . 3.890 3.275 2.375 3.733 . 0 0 "[ . 1 . 2]" 1
560 1 39 GLU HA 1 39 GLU HG3 2.850 . 3.890 3.332 2.340 3.766 . 0 0 "[ . 1 . 2]" 1
561 1 39 GLU HA 1 42 TYR H 2.960 . 4.120 3.394 3.266 3.660 . 0 0 "[ . 1 . 2]" 1
562 1 39 GLU HA 1 42 TYR HB2 2.870 . 3.930 3.437 3.222 3.581 . 0 0 "[ . 1 . 2]" 1
563 1 39 GLU HA 1 43 LYS H 3.190 . 4.580 3.792 3.400 3.981 . 0 0 "[ . 1 . 2]" 1
564 1 39 GLU HA 1 51 VAL MG2 3.070 . 4.340 3.744 3.236 4.341 0.001 9 0 "[ . 1 . 2]" 1
565 1 39 GLU QB 1 40 ILE H 2.920 . 4.040 3.136 2.630 3.589 . 0 0 "[ . 1 . 2]" 1
566 1 39 GLU QB 1 40 ILE HA 3.480 . 5.170 4.126 3.751 4.444 . 0 0 "[ . 1 . 2]" 1
567 1 39 GLU QB 1 43 LYS H 3.570 . 5.340 4.290 4.110 4.412 . 0 0 "[ . 1 . 2]" 1
568 1 39 GLU QB 1 51 VAL MG2 3.020 . 4.250 3.075 2.493 3.923 . 0 0 "[ . 1 . 2]" 1
569 1 39 GLU HB2 1 51 VAL MG2 3.350 . 4.910 3.821 2.573 4.795 . 0 0 "[ . 1 . 2]" 1
570 1 39 GLU HB3 1 51 VAL MG2 3.350 . 4.910 3.497 2.759 4.421 . 0 0 "[ . 1 . 2]" 1
571 1 40 ILE H 1 40 ILE HB 2.580 . 3.370 2.542 2.379 3.404 0.034 17 0 "[ . 1 . 2]" 1
572 1 40 ILE H 1 40 ILE MD 3.000 . 4.210 3.181 2.387 3.458 . 0 0 "[ . 1 . 2]" 1
573 1 40 ILE H 1 40 ILE QG 2.080 . 2.370 2.026 1.763 2.185 0.027 17 0 "[ . 1 . 2]" 1
574 1 40 ILE H 1 40 ILE MG 2.830 . 3.860 3.679 2.805 3.748 . 0 0 "[ . 1 . 2]" 1
575 1 40 ILE H 1 41 GLU H 3.650 . 5.500 2.911 2.795 3.128 . 0 0 "[ . 1 . 2]" 1
576 1 40 ILE HA 1 40 ILE MD 2.900 . 4.000 3.305 2.047 4.027 0.027 17 0 "[ . 1 . 2]" 1
577 1 40 ILE HA 1 40 ILE HG12 2.840 . 3.880 2.792 2.525 3.518 . 0 0 "[ . 1 . 2]" 1
578 1 40 ILE HA 1 40 ILE QG 2.560 . 3.320 2.600 2.351 3.175 . 0 0 "[ . 1 . 2]" 1
579 1 40 ILE HA 1 40 ILE HG13 2.840 . 3.880 3.111 2.755 3.734 . 0 0 "[ . 1 . 2]" 1
580 1 40 ILE HA 1 40 ILE MG 2.530 . 3.260 2.333 2.128 2.410 . 0 0 "[ . 1 . 2]" 1
581 1 40 ILE HA 1 43 LYS H 3.190 . 4.590 3.851 3.666 4.220 . 0 0 "[ . 1 . 2]" 1
582 1 40 ILE HA 1 43 LYS QB 2.850 . 3.900 3.140 2.971 3.427 . 0 0 "[ . 1 . 2]" 1
583 1 40 ILE HA 1 43 LYS HD2 3.650 . 5.500 3.438 2.750 4.784 . 0 0 "[ . 1 . 2]" 1
584 1 40 ILE HA 1 43 LYS QD 3.230 . 4.660 3.134 2.399 4.269 . 0 0 "[ . 1 . 2]" 1
585 1 40 ILE HA 1 43 LYS HD3 3.650 . 5.500 4.434 2.416 5.320 . 0 0 "[ . 1 . 2]" 1
586 1 40 ILE HA 1 44 GLN H 3.650 . 5.500 4.397 4.298 4.525 . 0 0 "[ . 1 . 2]" 1
587 1 40 ILE HB 1 40 ILE MD 2.710 . 3.620 2.566 2.196 3.219 . 0 0 "[ . 1 . 2]" 1
588 1 40 ILE HB 1 41 GLU H 2.750 . 3.700 2.366 2.027 2.546 . 0 0 "[ . 1 . 2]" 1
589 1 40 ILE QG 1 40 ILE MG 2.400 . 3.000 2.254 2.183 2.288 . 0 0 "[ . 1 . 2]" 1
590 1 40 ILE HG12 1 40 ILE MG 2.700 . 3.600 2.579 2.297 3.198 . 0 0 "[ . 1 . 2]" 1
591 1 40 ILE HG13 1 40 ILE MG 2.700 . 3.600 2.911 2.223 3.192 . 0 0 "[ . 1 . 2]" 1
592 1 40 ILE MG 1 41 GLU H 3.020 . 4.240 3.204 2.854 3.907 . 0 0 "[ . 1 . 2]" 1
593 1 41 GLU H 1 41 GLU HB2 2.900 . 4.000 2.430 2.079 2.592 . 0 0 "[ . 1 . 2]" 1
594 1 41 GLU H 1 41 GLU QG 3.570 . 5.340 4.003 3.540 4.063 . 0 0 "[ . 1 . 2]" 1
595 1 41 GLU H 1 42 TYR H 3.650 . 5.500 2.643 2.610 2.734 . 0 0 "[ . 1 . 2]" 1
596 1 41 GLU HA 1 43 LYS H 3.650 . 5.500 4.582 4.490 4.704 . 0 0 "[ . 1 . 2]" 1
597 1 41 GLU HA 1 44 GLN QB 2.920 . 4.040 2.753 2.558 2.940 . 0 0 "[ . 1 . 2]" 1
598 1 41 GLU HB2 1 42 TYR H 3.120 . 4.440 3.763 3.159 3.884 . 0 0 "[ . 1 . 2]" 1
599 1 41 GLU HB3 1 42 TYR H 3.520 . 5.250 2.603 2.513 2.655 . 0 0 "[ . 1 . 2]" 1
600 1 41 GLU QG 1 45 VAL H 3.570 . 5.340 4.316 3.945 5.317 . 0 0 "[ . 1 . 2]" 1
601 1 41 GLU QG 1 45 VAL MG2 2.920 . 4.040 2.738 2.231 3.903 . 0 0 "[ . 1 . 2]" 1
602 1 42 TYR H 1 42 TYR HB3 2.960 . 4.130 2.423 2.325 2.548 . 0 0 "[ . 1 . 2]" 1
603 1 42 TYR H 1 42 TYR QD 3.650 . 5.500 4.181 4.155 4.227 . 0 0 "[ . 1 . 2]" 1
604 1 42 TYR H 1 43 LYS H 2.400 . 3.000 2.814 2.741 2.977 . 0 0 "[ . 1 . 2]" 1
605 1 42 TYR HA 1 42 TYR QD 2.710 . 3.610 2.335 2.034 2.544 . 0 0 "[ . 1 . 2]" 1
606 1 42 TYR HA 1 45 VAL H 3.090 . 4.380 3.567 3.475 3.789 . 0 0 "[ . 1 . 2]" 1
607 1 42 TYR HA 1 45 VAL HB 2.890 . 3.970 2.967 2.834 3.145 . 0 0 "[ . 1 . 2]" 1
608 1 42 TYR HA 1 45 VAL MG1 3.100 . 4.400 4.278 4.177 4.406 0.006 13 0 "[ . 1 . 2]" 1
609 1 42 TYR HA 1 45 VAL MG2 3.040 . 4.290 3.007 2.666 3.596 . 0 0 "[ . 1 . 2]" 1
610 1 42 TYR HA 1 46 LYS H 3.230 . 4.670 4.351 4.147 4.595 . 0 0 "[ . 1 . 2]" 1
611 1 42 TYR HB2 1 43 LYS H 3.420 . 5.040 3.881 3.724 3.941 . 0 0 "[ . 1 . 2]" 1
612 1 42 TYR HB3 1 43 LYS H 2.170 . 2.540 2.478 2.280 2.547 0.007 19 0 "[ . 1 . 2]" 1
613 1 42 TYR QD 1 43 LYS H 3.650 . 5.500 3.503 3.204 3.928 . 0 0 "[ . 1 . 2]" 1
614 1 42 TYR QD 1 43 LYS QG 3.330 . 4.860 3.088 2.573 3.925 . 0 0 "[ . 1 . 2]" 1
615 1 42 TYR QD 1 46 LYS H 3.650 . 5.500 4.382 3.635 4.813 . 0 0 "[ . 1 . 2]" 1
616 1 42 TYR QD 1 51 VAL MG2 2.940 . 4.080 2.306 2.142 2.774 . 0 0 "[ . 1 . 2]" 1
617 1 42 TYR QE 1 43 LYS H 3.650 . 5.500 5.315 5.098 5.516 0.016 13 0 "[ . 1 . 2]" 1
618 1 42 TYR QE 1 45 VAL MG1 3.230 . 4.670 4.425 3.928 4.670 0.000 11 0 "[ . 1 . 2]" 1
619 1 42 TYR QE 1 46 LYS H 3.650 . 5.500 4.802 4.211 5.164 . 0 0 "[ . 1 . 2]" 1
620 1 42 TYR QE 1 51 VAL HA 2.780 . 3.760 2.951 2.267 3.730 . 0 0 "[ . 1 . 2]" 1
621 1 42 TYR QE 1 51 VAL HB 3.300 . 4.800 4.551 4.263 4.803 0.003 20 0 "[ . 1 . 2]" 1
622 1 42 TYR QE 1 51 VAL MG2 2.560 . 3.320 2.367 2.104 3.123 . 0 0 "[ . 1 . 2]" 1
623 1 42 TYR QE 1 63 LEU HA 3.420 . 5.040 3.725 3.009 4.420 . 0 0 "[ . 1 . 2]" 1
624 1 42 TYR QE 1 64 GLN H 3.650 . 5.500 2.989 1.995 4.069 . 0 0 "[ . 1 . 2]" 1
625 1 43 LYS H 1 43 LYS HB2 2.900 . 4.000 2.363 2.320 2.409 . 0 0 "[ . 1 . 2]" 1
626 1 43 LYS H 1 43 LYS QB 2.580 . 3.360 2.330 2.291 2.373 . 0 0 "[ . 1 . 2]" 1
627 1 43 LYS H 1 43 LYS HB3 2.900 . 4.000 3.550 3.535 3.570 . 0 0 "[ . 1 . 2]" 1
628 1 43 LYS H 1 43 LYS QD 3.190 . 4.580 3.649 2.997 4.228 . 0 0 "[ . 1 . 2]" 1
629 1 43 LYS H 1 43 LYS HG2 2.940 . 4.090 3.564 3.475 3.863 . 0 0 "[ . 1 . 2]" 1
630 1 43 LYS H 1 43 LYS QG 2.640 . 3.480 2.274 2.189 2.441 . 0 0 "[ . 1 . 2]" 1
631 1 43 LYS H 1 43 LYS HG3 2.940 . 4.090 2.301 2.213 2.468 . 0 0 "[ . 1 . 2]" 1
632 1 43 LYS H 1 44 GLN H 3.650 . 5.500 2.717 2.675 2.754 . 0 0 "[ . 1 . 2]" 1
633 1 43 LYS HA 1 43 LYS QD 3.320 . 4.840 3.975 3.912 4.138 . 0 0 "[ . 1 . 2]" 1
634 1 43 LYS HA 1 43 LYS HG2 2.810 . 3.810 2.467 2.342 2.808 . 0 0 "[ . 1 . 2]" 1
635 1 43 LYS HA 1 43 LYS QG 2.520 . 3.240 2.305 2.246 2.355 . 0 0 "[ . 1 . 2]" 1
636 1 43 LYS HA 1 43 LYS HG3 2.810 . 3.810 2.826 2.447 2.925 . 0 0 "[ . 1 . 2]" 1
637 1 43 LYS HA 1 47 GLN H 3.650 . 5.500 4.116 3.992 4.264 . 0 0 "[ . 1 . 2]" 1
638 1 43 LYS HA 1 48 VAL H 3.650 . 5.500 2.843 2.583 2.984 . 0 0 "[ . 1 . 2]" 1
639 1 43 LYS HA 1 48 VAL MG2 2.690 . 3.580 2.136 2.046 2.217 . 0 0 "[ . 1 . 2]" 1
640 1 43 LYS QB 1 43 LYS QD 2.540 . 3.280 2.151 2.119 2.294 . 0 0 "[ . 1 . 2]" 1
641 1 43 LYS QB 1 43 LYS QE 2.900 . 4.000 3.314 2.153 3.659 . 0 0 "[ . 1 . 2]" 1
642 1 43 LYS QB 1 44 GLN H 2.390 . 2.980 2.586 2.525 2.621 . 0 0 "[ . 1 . 2]" 1
643 1 43 LYS QD 1 49 ALA HA 3.340 . 4.880 2.735 2.119 4.740 . 0 0 "[ . 1 . 2]" 1
644 1 43 LYS QE 1 49 ALA HA 3.210 . 4.620 3.020 2.261 4.621 0.001 20 0 "[ . 1 . 2]" 1
645 1 43 LYS QE 1 51 VAL MG2 3.570 . 5.340 3.136 2.296 5.168 . 0 0 "[ . 1 . 2]" 1
646 1 43 LYS QG 1 48 VAL MG2 2.750 . 3.700 2.335 2.087 2.552 . 0 0 "[ . 1 . 2]" 1
647 1 43 LYS QG 1 51 VAL MG2 2.890 . 3.980 3.015 2.614 3.494 . 0 0 "[ . 1 . 2]" 1
648 1 43 LYS HG2 1 48 VAL MG2 3.110 . 4.420 2.371 2.106 2.648 . 0 0 "[ . 1 . 2]" 1
649 1 43 LYS HG2 1 51 VAL MG2 3.260 . 4.720 3.434 3.038 4.198 . 0 0 "[ . 1 . 2]" 1
650 1 43 LYS HG3 1 48 VAL MG2 3.110 . 4.420 3.585 3.202 3.832 . 0 0 "[ . 1 . 2]" 1
651 1 43 LYS HG3 1 51 VAL MG2 3.260 . 4.720 3.351 2.851 3.980 . 0 0 "[ . 1 . 2]" 1
652 1 44 GLN H 1 44 GLN QG 3.150 . 4.500 3.358 2.222 3.961 . 0 0 "[ . 1 . 2]" 1
653 1 44 GLN H 1 45 VAL H 3.650 . 5.500 2.709 2.640 2.773 . 0 0 "[ . 1 . 2]" 1
654 1 44 GLN HA 1 44 GLN QG 2.770 . 3.740 2.373 2.285 2.768 . 0 0 "[ . 1 . 2]" 1
655 1 44 GLN HA 1 46 LYS H 3.650 . 5.500 4.530 4.466 4.590 . 0 0 "[ . 1 . 2]" 1
656 1 44 GLN QB 1 45 VAL H 3.050 . 4.300 2.525 2.430 2.586 . 0 0 "[ . 1 . 2]" 1
657 1 44 GLN QB 1 45 VAL HA 3.240 . 4.680 3.989 3.841 4.098 . 0 0 "[ . 1 . 2]" 1
658 1 44 GLN HE21 1 44 GLN QG 2.080 . 2.360 2.274 2.205 2.361 0.001 12 0 "[ . 1 . 2]" 1
659 1 44 GLN QG 1 45 VAL H 3.570 . 5.340 3.834 3.496 4.171 . 0 0 "[ . 1 . 2]" 1
660 1 45 VAL H 1 45 VAL HB 2.670 . 3.540 2.414 2.365 2.485 . 0 0 "[ . 1 . 2]" 1
661 1 45 VAL H 1 45 VAL MG1 2.900 . 4.000 3.729 3.713 3.753 . 0 0 "[ . 1 . 2]" 1
662 1 45 VAL H 1 45 VAL MG2 3.650 . 5.500 2.319 2.117 2.418 . 0 0 "[ . 1 . 2]" 1
663 1 45 VAL H 1 46 LYS H 2.330 . 2.860 2.730 2.652 2.806 . 0 0 "[ . 1 . 2]" 1
664 1 45 VAL HA 1 45 VAL MG1 2.540 . 3.280 2.370 2.348 2.406 . 0 0 "[ . 1 . 2]" 1
665 1 45 VAL HA 1 45 VAL MG2 2.620 . 3.440 2.264 2.193 2.334 . 0 0 "[ . 1 . 2]" 1
666 1 45 VAL HB 1 46 LYS H 3.260 . 4.720 2.553 2.492 2.680 . 0 0 "[ . 1 . 2]" 1
667 1 45 VAL HB 1 46 LYS QG 3.060 . 4.330 3.054 2.799 4.346 0.016 12 0 "[ . 1 . 2]" 1
668 1 45 VAL MG1 1 46 LYS H 3.030 . 4.260 3.259 3.173 3.496 . 0 0 "[ . 1 . 2]" 1
669 1 45 VAL MG1 1 46 LYS HA 2.990 . 4.180 3.491 3.400 3.690 . 0 0 "[ . 1 . 2]" 1
670 1 45 VAL MG1 1 46 LYS QD 2.800 . 3.800 2.885 2.116 3.803 0.003 16 0 "[ . 1 . 2]" 1
671 1 45 VAL MG1 1 46 LYS QE 2.810 . 3.810 3.156 2.606 3.791 . 0 0 "[ . 1 . 2]" 1
672 1 45 VAL MG2 1 46 LYS H 3.650 . 5.500 3.907 3.816 3.986 . 0 0 "[ . 1 . 2]" 1
673 1 46 LYS H 1 46 LYS HB2 2.790 . 3.780 2.439 2.283 2.540 . 0 0 "[ . 1 . 2]" 1
674 1 46 LYS H 1 46 LYS HB3 2.790 . 3.780 3.637 3.558 3.694 . 0 0 "[ . 1 . 2]" 1
675 1 46 LYS H 1 46 LYS QD 3.570 . 5.340 3.809 2.195 4.279 . 0 0 "[ . 1 . 2]" 1
676 1 46 LYS H 1 46 LYS HG2 3.650 . 5.500 2.664 2.345 3.969 . 0 0 "[ . 1 . 2]" 1
677 1 46 LYS H 1 46 LYS QG 3.270 . 4.740 2.602 2.319 3.592 . 0 0 "[ . 1 . 2]" 1
678 1 46 LYS H 1 46 LYS HG3 3.650 . 5.500 3.792 3.603 4.103 . 0 0 "[ . 1 . 2]" 1
679 1 46 LYS H 1 47 GLN H 3.650 . 5.500 2.338 2.226 2.405 . 0 0 "[ . 1 . 2]" 1
680 1 46 LYS H 1 47 GLN HA 3.650 . 5.500 4.503 4.400 4.568 . 0 0 "[ . 1 . 2]" 1
681 1 46 LYS H 1 48 VAL H 3.650 . 5.500 3.999 3.849 4.262 . 0 0 "[ . 1 . 2]" 1
682 1 46 LYS HA 1 46 LYS HD2 2.560 . 3.320 2.863 2.310 3.325 0.005 1 0 "[ . 1 . 2]" 1
683 1 46 LYS HA 1 46 LYS QD 2.330 . 2.860 2.181 2.110 2.269 . 0 0 "[ . 1 . 2]" 1
684 1 46 LYS HA 1 46 LYS HD3 2.560 . 3.320 2.325 2.189 3.322 0.002 12 0 "[ . 1 . 2]" 1
685 1 46 LYS HA 1 46 LYS QE 3.130 . 4.460 4.067 3.971 4.242 . 0 0 "[ . 1 . 2]" 1
686 1 46 LYS HA 1 46 LYS QG 2.770 . 3.730 2.745 2.447 2.946 . 0 0 "[ . 1 . 2]" 1
687 1 46 LYS QB 1 48 VAL H 3.570 . 5.340 3.413 3.233 3.821 . 0 0 "[ . 1 . 2]" 1
688 1 46 LYS QB 1 48 VAL MG1 2.510 . 3.220 2.147 1.985 2.238 . 0 0 "[ . 1 . 2]" 1
689 1 46 LYS QB 1 48 VAL MG2 2.660 . 3.520 2.209 2.068 2.798 . 0 0 "[ . 1 . 2]" 1
690 1 46 LYS HB2 1 47 GLN H 3.650 . 5.500 3.584 3.383 3.723 . 0 0 "[ . 1 . 2]" 1
691 1 46 LYS HB2 1 48 VAL MG2 2.940 . 4.090 2.273 2.140 2.858 . 0 0 "[ . 1 . 2]" 1
692 1 46 LYS HB3 1 47 GLN H 3.650 . 5.500 4.274 4.091 4.382 . 0 0 "[ . 1 . 2]" 1
693 1 46 LYS HB3 1 48 VAL MG2 2.940 . 4.090 3.052 2.516 3.987 . 0 0 "[ . 1 . 2]" 1
694 1 46 LYS QE 1 46 LYS QG 2.520 . 3.240 2.254 2.121 2.615 . 0 0 "[ . 1 . 2]" 1
695 1 47 GLN H 1 47 GLN HG2 3.650 . 5.500 3.273 2.487 5.016 . 0 0 "[ . 1 . 2]" 1
696 1 47 GLN H 1 47 GLN HG3 3.650 . 5.500 3.390 2.457 4.521 . 0 0 "[ . 1 . 2]" 1
697 1 47 GLN H 1 48 VAL H 3.650 . 5.500 2.988 2.863 3.203 . 0 0 "[ . 1 . 2]" 1
698 1 47 GLN H 1 48 VAL MG1 3.650 . 5.500 4.181 3.802 4.315 . 0 0 "[ . 1 . 2]" 1
699 1 47 GLN HA 1 47 GLN QG 2.730 . 3.660 2.525 2.263 2.850 . 0 0 "[ . 1 . 2]" 1
700 1 48 VAL H 1 48 VAL MG2 3.650 . 5.500 1.953 1.906 2.024 . 0 0 "[ . 1 . 2]" 1
701 1 48 VAL H 1 49 ALA H 3.650 . 5.500 4.324 3.512 4.403 . 0 0 "[ . 1 . 2]" 1
702 1 48 VAL HA 1 48 VAL HB 2.400 . 3.000 2.487 2.453 2.553 . 0 0 "[ . 1 . 2]" 1
703 1 48 VAL HA 1 48 VAL MG1 2.420 . 3.030 2.289 2.207 2.399 . 0 0 "[ . 1 . 2]" 1
704 1 48 VAL HA 1 48 VAL MG2 2.750 . 3.700 3.180 3.166 3.191 . 0 0 "[ . 1 . 2]" 1
705 1 48 VAL HA 1 49 ALA MB 3.000 . 4.200 3.797 3.714 4.001 . 0 0 "[ . 1 . 2]" 1
706 1 48 VAL HA 1 50 MET H 3.220 . 4.640 4.427 4.231 4.598 . 0 0 "[ . 1 . 2]" 1
707 1 48 VAL HB 1 49 ALA H 2.100 . 2.400 1.905 1.812 2.032 . 0 0 "[ . 1 . 2]" 1
708 1 48 VAL HB 1 49 ALA MB 3.000 . 4.210 4.123 3.645 4.214 0.004 11 0 "[ . 1 . 2]" 1
709 1 48 VAL HB 1 50 MET H 3.090 . 4.380 2.708 2.481 3.025 . 0 0 "[ . 1 . 2]" 1
710 1 48 VAL MG1 1 49 ALA H 3.650 . 5.500 3.517 3.413 3.605 . 0 0 "[ . 1 . 2]" 1
711 1 48 VAL MG2 1 49 ALA H 2.400 . 3.000 2.893 1.849 3.005 0.005 8 0 "[ . 1 . 2]" 1
712 1 48 VAL MG2 1 50 MET H 3.650 . 5.500 2.775 2.106 3.974 . 0 0 "[ . 1 . 2]" 1
713 1 49 ALA H 1 49 ALA MB 2.750 . 3.700 2.590 2.392 2.939 . 0 0 "[ . 1 . 2]" 1
714 1 49 ALA H 1 50 MET H 3.650 . 5.500 2.016 1.791 2.349 0.009 16 0 "[ . 1 . 2]" 1
715 1 49 ALA MB 1 50 MET H 2.750 . 3.700 3.236 2.624 3.631 . 0 0 "[ . 1 . 2]" 1
716 1 49 ALA MB 1 50 MET HA 3.150 . 4.500 4.242 3.864 4.397 . 0 0 "[ . 1 . 2]" 1
717 1 49 ALA MB 1 50 MET QB 2.790 . 3.770 3.660 3.225 3.776 0.006 18 0 "[ . 1 . 2]" 1
718 1 49 ALA MB 1 50 MET QG 2.750 . 3.700 3.542 3.096 3.705 0.005 13 0 "[ . 1 . 2]" 1
719 1 50 MET H 1 50 MET QG 3.570 . 5.340 2.913 1.870 3.987 . 0 0 "[ . 1 . 2]" 1
720 1 50 MET QB 1 51 VAL H 2.970 . 4.140 2.928 2.457 3.431 . 0 0 "[ . 1 . 2]" 1
721 1 50 MET HB2 1 51 VAL H 3.350 . 4.900 3.477 2.487 4.489 . 0 0 "[ . 1 . 2]" 1
722 1 50 MET HB3 1 51 VAL H 3.350 . 4.900 3.652 2.608 4.051 . 0 0 "[ . 1 . 2]" 1
723 1 51 VAL H 1 51 VAL HB 2.880 . 3.960 2.643 2.512 2.797 . 0 0 "[ . 1 . 2]" 1
724 1 51 VAL H 1 51 VAL MG2 2.170 . 2.540 2.545 2.540 2.558 0.018 6 0 "[ . 1 . 2]" 1
725 1 51 VAL H 1 52 ASP H 3.650 . 5.500 4.446 4.374 4.519 . 0 0 "[ . 1 . 2]" 1
726 1 51 VAL HA 1 51 VAL MG1 2.520 . 3.240 2.287 2.247 2.342 . 0 0 "[ . 1 . 2]" 1
727 1 51 VAL HA 1 51 VAL MG2 2.480 . 3.150 2.384 2.295 2.467 . 0 0 "[ . 1 . 2]" 1
728 1 51 VAL HA 1 52 ASP H 2.480 . 3.150 2.193 2.166 2.227 . 0 0 "[ . 1 . 2]" 1
729 1 51 VAL HB 1 52 ASP H 3.030 . 4.260 4.026 3.834 4.182 . 0 0 "[ . 1 . 2]" 1
730 1 51 VAL HB 1 60 VAL MG1 3.300 . 4.800 4.681 4.284 4.808 0.008 17 0 "[ . 1 . 2]" 1
731 1 51 VAL HB 1 60 VAL MG2 3.130 . 4.460 4.231 3.854 4.458 . 0 0 "[ . 1 . 2]" 1
732 1 51 VAL MG1 1 52 ASP H 3.650 . 5.500 2.311 1.981 2.490 . 0 0 "[ . 1 . 2]" 1
733 1 51 VAL MG1 1 53 ARG QG 2.960 . 4.120 2.798 2.260 3.701 . 0 0 "[ . 1 . 2]" 1
734 1 51 VAL MG1 1 60 VAL HA 2.910 . 4.020 3.281 2.958 3.846 . 0 0 "[ . 1 . 2]" 1
735 1 51 VAL MG1 1 60 VAL MG1 2.570 . 3.340 2.491 2.245 2.735 . 0 0 "[ . 1 . 2]" 1
736 1 51 VAL MG1 1 60 VAL MG2 2.670 . 3.540 2.623 2.339 3.419 . 0 0 "[ . 1 . 2]" 1
737 1 51 VAL MG1 1 63 LEU QD 2.690 . 3.580 2.772 2.229 3.578 . 0 0 "[ . 1 . 2]" 1
738 1 51 VAL MG2 1 52 ASP H 3.230 . 4.660 4.050 3.868 4.138 . 0 0 "[ . 1 . 2]" 1
739 1 52 ASP HA 1 53 ARG H 2.290 . 2.780 2.161 2.142 2.225 . 0 0 "[ . 1 . 2]" 1
740 1 53 ARG H 1 53 ARG QB 2.750 . 3.690 2.791 2.617 2.909 . 0 0 "[ . 1 . 2]" 1
741 1 53 ARG H 1 53 ARG QG 3.010 . 4.220 2.918 2.644 3.376 . 0 0 "[ . 1 . 2]" 1
742 1 53 ARG H 1 61 LYS H 3.650 . 5.500 4.500 4.382 4.631 . 0 0 "[ . 1 . 2]" 1
743 1 53 ARG HA 1 53 ARG HD2 3.590 . 5.380 4.660 3.777 4.974 . 0 0 "[ . 1 . 2]" 1
744 1 53 ARG HA 1 53 ARG QD 3.180 . 4.560 3.967 3.570 4.215 . 0 0 "[ . 1 . 2]" 1
745 1 53 ARG HA 1 53 ARG HD3 3.590 . 5.380 4.327 3.744 4.635 . 0 0 "[ . 1 . 2]" 1
746 1 53 ARG HA 1 53 ARG HG2 2.980 . 4.160 2.515 2.395 2.648 . 0 0 "[ . 1 . 2]" 1
747 1 53 ARG HA 1 53 ARG QG 2.720 . 3.640 2.420 2.279 2.542 . 0 0 "[ . 1 . 2]" 1
748 1 53 ARG HA 1 53 ARG HG3 2.980 . 4.160 3.230 2.614 3.535 . 0 0 "[ . 1 . 2]" 1
749 1 53 ARG HA 1 54 TRP H 2.170 . 2.540 2.426 2.305 2.502 . 0 0 "[ . 1 . 2]" 1
750 1 53 ARG HA 1 60 VAL H 3.650 . 5.500 4.913 4.696 5.057 . 0 0 "[ . 1 . 2]" 1
751 1 53 ARG HA 1 60 VAL HA 2.770 . 3.730 3.038 2.748 3.240 . 0 0 "[ . 1 . 2]" 1
752 1 53 ARG HA 1 61 LYS H 3.650 . 5.500 2.445 2.252 2.740 . 0 0 "[ . 1 . 2]" 1
753 1 53 ARG HA 1 62 LYS H 3.650 . 5.500 4.867 4.653 5.247 . 0 0 "[ . 1 . 2]" 1
754 1 53 ARG QB 1 53 ARG QD 2.430 . 3.060 2.175 2.105 2.261 . 0 0 "[ . 1 . 2]" 1
755 1 53 ARG QB 1 58 GLY H 3.570 . 5.340 4.128 4.044 4.239 . 0 0 "[ . 1 . 2]" 1
756 1 53 ARG QB 1 58 GLY QA 2.750 . 3.690 2.462 2.211 2.619 . 0 0 "[ . 1 . 2]" 1
757 1 53 ARG QB 1 59 TYR H 3.570 . 5.340 3.582 3.340 3.963 . 0 0 "[ . 1 . 2]" 1
758 1 53 ARG QB 1 60 VAL HA 3.150 . 4.500 3.740 3.378 4.178 . 0 0 "[ . 1 . 2]" 1
759 1 53 ARG HB2 1 54 TRP H 3.110 . 4.420 3.490 3.212 3.987 . 0 0 "[ . 1 . 2]" 1
760 1 53 ARG HB2 1 58 GLY HA2 3.520 . 5.250 3.224 2.877 3.768 . 0 0 "[ . 1 . 2]" 1
761 1 53 ARG HB2 1 58 GLY HA3 3.520 . 5.250 4.470 4.144 4.949 . 0 0 "[ . 1 . 2]" 1
762 1 53 ARG HB2 1 60 VAL HA 3.570 . 5.340 4.908 4.707 5.180 . 0 0 "[ . 1 . 2]" 1
763 1 53 ARG HB3 1 54 TRP H 3.110 . 4.420 2.480 2.337 2.703 . 0 0 "[ . 1 . 2]" 1
764 1 53 ARG HB3 1 58 GLY HA2 3.520 . 5.250 2.659 2.272 2.936 . 0 0 "[ . 1 . 2]" 1
765 1 53 ARG HB3 1 58 GLY HA3 3.520 . 5.250 3.840 3.394 4.059 . 0 0 "[ . 1 . 2]" 1
766 1 53 ARG HB3 1 60 VAL HA 3.570 . 5.340 3.890 3.459 4.454 . 0 0 "[ . 1 . 2]" 1
767 1 53 ARG QD 1 58 GLY QA 2.920 . 4.040 3.352 3.138 3.938 . 0 0 "[ . 1 . 2]" 1
768 1 53 ARG QD 1 60 VAL MG2 3.280 . 4.760 3.588 2.463 4.532 . 0 0 "[ . 1 . 2]" 1
769 1 53 ARG QG 1 54 TRP H 3.130 . 4.460 3.987 3.518 4.197 . 0 0 "[ . 1 . 2]" 1
770 1 53 ARG QG 1 60 VAL HA 2.640 . 3.480 2.287 2.210 2.383 . 0 0 "[ . 1 . 2]" 1
771 1 53 ARG QG 1 60 VAL MG2 3.210 . 4.620 3.263 2.734 3.545 . 0 0 "[ . 1 . 2]" 1
772 1 53 ARG QG 1 61 LYS H 3.000 . 4.210 3.163 2.906 3.542 . 0 0 "[ . 1 . 2]" 1
773 1 53 ARG HG2 1 54 TRP H 3.540 . 5.280 4.226 3.665 4.480 . 0 0 "[ . 1 . 2]" 1
774 1 53 ARG HG2 1 60 VAL HA 2.980 . 4.160 2.313 2.252 2.419 . 0 0 "[ . 1 . 2]" 1
775 1 53 ARG HG2 1 61 LYS H 3.320 . 4.840 3.290 2.944 3.833 . 0 0 "[ . 1 . 2]" 1
776 1 53 ARG HG3 1 54 TRP H 3.540 . 5.280 4.901 4.534 5.083 . 0 0 "[ . 1 . 2]" 1
777 1 53 ARG HG3 1 60 VAL HA 2.980 . 4.160 3.794 2.964 4.151 . 0 0 "[ . 1 . 2]" 1
778 1 53 ARG HG3 1 61 LYS H 3.320 . 4.840 4.377 3.527 4.842 0.002 17 0 "[ . 1 . 2]" 1
779 1 54 TRP H 1 54 TRP HB2 2.740 . 3.680 2.477 2.340 2.516 . 0 0 "[ . 1 . 2]" 1
780 1 54 TRP H 1 54 TRP HB3 2.920 . 4.040 3.660 3.582 3.682 . 0 0 "[ . 1 . 2]" 1
781 1 54 TRP H 1 54 TRP HD1 3.650 . 5.500 2.352 2.213 2.528 . 0 0 "[ . 1 . 2]" 1
782 1 54 TRP H 1 58 GLY H 3.650 . 5.500 3.556 3.388 4.025 . 0 0 "[ . 1 . 2]" 1
783 1 54 TRP H 1 60 VAL H 3.650 . 5.500 5.366 4.961 5.469 . 0 0 "[ . 1 . 2]" 1
784 1 54 TRP H 1 61 LYS HB2 3.650 . 5.500 3.972 3.744 4.416 . 0 0 "[ . 1 . 2]" 1
785 1 54 TRP HA 1 55 PRO HD2 2.570 . 3.340 2.268 2.203 2.323 . 0 0 "[ . 1 . 2]" 1
786 1 54 TRP HA 1 55 PRO QD 2.330 . 2.860 2.067 2.027 2.101 . 0 0 "[ . 1 . 2]" 1
787 1 54 TRP HA 1 55 PRO HD3 2.570 . 3.340 2.383 2.329 2.457 . 0 0 "[ . 1 . 2]" 1
788 1 54 TRP HA 1 55 PRO HG3 3.200 . 4.600 4.482 4.442 4.531 . 0 0 "[ . 1 . 2]" 1
789 1 54 TRP HA 1 57 THR H 3.650 . 5.500 5.207 5.096 5.522 0.022 9 0 "[ . 1 . 2]" 1
790 1 54 TRP HA 1 58 GLY H 3.650 . 5.500 4.753 4.568 4.923 . 0 0 "[ . 1 . 2]" 1
791 1 54 TRP HA 1 59 TYR H 3.650 . 5.500 5.456 5.197 5.514 0.014 5 0 "[ . 1 . 2]" 1
792 1 54 TRP HA 1 61 LYS QD 3.570 . 5.340 4.606 3.129 5.263 . 0 0 "[ . 1 . 2]" 1
793 1 54 TRP HB2 1 55 PRO QD 2.940 . 4.080 3.771 3.711 3.830 . 0 0 "[ . 1 . 2]" 1
794 1 54 TRP HB2 1 55 PRO HG2 3.650 . 5.500 5.507 5.502 5.513 0.013 16 0 "[ . 1 . 2]" 1
795 1 54 TRP HB2 1 59 TYR H 3.650 . 5.500 3.304 2.887 3.397 . 0 0 "[ . 1 . 2]" 1
796 1 54 TRP HB2 1 75 LYS HA 3.650 . 5.500 4.470 3.660 5.046 . 0 0 "[ . 1 . 2]" 1
797 1 54 TRP HB2 1 75 LYS HG2 3.270 . 4.740 4.560 4.192 4.745 0.005 16 0 "[ . 1 . 2]" 1
798 1 54 TRP HB3 1 55 PRO HD2 3.120 . 4.440 2.453 2.364 2.527 . 0 0 "[ . 1 . 2]" 1
799 1 54 TRP HB3 1 55 PRO QD 2.830 . 3.860 2.427 2.340 2.498 . 0 0 "[ . 1 . 2]" 1
800 1 54 TRP HB3 1 55 PRO HD3 3.120 . 4.440 3.859 3.753 3.936 . 0 0 "[ . 1 . 2]" 1
801 1 54 TRP HB3 1 55 PRO HG2 3.230 . 4.660 4.079 3.896 4.127 . 0 0 "[ . 1 . 2]" 1
802 1 54 TRP HB3 1 58 GLY H 3.650 . 5.500 4.131 3.919 4.369 . 0 0 "[ . 1 . 2]" 1
803 1 54 TRP HB3 1 59 TYR H 3.480 . 5.160 4.951 4.343 5.067 . 0 0 "[ . 1 . 2]" 1
804 1 54 TRP HB3 1 75 LYS HG2 3.360 . 4.920 4.661 3.555 4.922 0.002 17 0 "[ . 1 . 2]" 1
805 1 54 TRP HD1 1 59 TYR HB2 2.850 . 3.890 3.815 3.543 3.907 0.017 20 0 "[ . 1 . 2]" 1
806 1 54 TRP HD1 1 59 TYR HB3 3.400 . 5.000 4.823 4.309 5.006 0.006 19 0 "[ . 1 . 2]" 1
807 1 54 TRP HD1 1 61 LYS HA 2.730 . 3.660 2.813 2.296 3.080 . 0 0 "[ . 1 . 2]" 1
808 1 54 TRP HD1 1 61 LYS HB2 3.170 . 4.540 3.001 2.773 3.746 . 0 0 "[ . 1 . 2]" 1
809 1 54 TRP HD1 1 75 LYS HA 3.260 . 4.720 4.104 3.516 4.626 . 0 0 "[ . 1 . 2]" 1
810 1 54 TRP HE1 1 61 LYS HA 2.100 . 2.400 1.834 1.796 1.951 0.004 16 0 "[ . 1 . 2]" 1
811 1 54 TRP HE1 1 61 LYS QD 2.390 . 2.980 2.911 1.970 2.993 0.013 17 0 "[ . 1 . 2]" 1
812 1 54 TRP HE1 1 61 LYS QG 3.570 . 5.340 2.012 1.799 3.739 0.001 11 0 "[ . 1 . 2]" 1
813 1 54 TRP HH2 1 61 LYS QE 3.230 . 4.660 3.741 3.189 4.674 0.014 20 0 "[ . 1 . 2]" 1
814 1 54 TRP HZ2 1 61 LYS QD 3.030 . 4.260 2.708 2.132 3.771 . 0 0 "[ . 1 . 2]" 1
815 1 54 TRP HZ2 1 61 LYS QE 3.000 . 4.210 2.660 2.251 4.190 . 0 0 "[ . 1 . 2]" 1
816 1 54 TRP HZ2 1 61 LYS QG 3.170 . 4.540 2.610 2.307 4.263 . 0 0 "[ . 1 . 2]" 1
817 1 54 TRP HZ2 1 75 LYS HG2 3.650 . 5.500 5.305 4.948 5.511 0.011 16 0 "[ . 1 . 2]" 1
818 1 56 GLU H 1 57 THR H 3.650 . 5.500 2.962 2.882 3.359 . 0 0 "[ . 1 . 2]" 1
819 1 56 GLU H 1 58 GLY H 3.650 . 5.500 4.003 3.676 4.388 . 0 0 "[ . 1 . 2]" 1
820 1 56 GLU QB 1 57 THR H 2.900 . 4.000 2.327 2.223 2.430 . 0 0 "[ . 1 . 2]" 1
821 1 56 GLU QB 1 57 THR MG 2.830 . 3.850 2.734 2.317 3.236 . 0 0 "[ . 1 . 2]" 1
822 1 56 GLU QB 1 58 GLY H 3.570 . 5.340 3.927 3.773 4.214 . 0 0 "[ . 1 . 2]" 1
823 1 56 GLU QB 1 75 LYS QD 2.690 . 3.570 2.523 2.190 2.827 . 0 0 "[ . 1 . 2]" 1
824 1 56 GLU QB 1 75 LYS QE 2.990 . 4.180 3.678 2.731 4.176 . 0 0 "[ . 1 . 2]" 1
825 1 56 GLU QB 1 75 LYS HG2 3.570 . 5.340 5.056 4.257 5.342 0.002 17 0 "[ . 1 . 2]" 1
826 1 56 GLU QB 1 75 LYS HG3 3.570 . 5.340 4.893 4.373 5.344 0.004 9 0 "[ . 1 . 2]" 1
827 1 56 GLU QG 1 75 LYS QD 2.970 . 4.140 3.176 2.432 4.043 . 0 0 "[ . 1 . 2]" 1
828 1 57 THR H 1 57 THR MG 2.890 . 3.980 2.917 2.436 3.266 . 0 0 "[ . 1 . 2]" 1
829 1 57 THR H 1 58 GLY H 3.650 . 5.500 1.879 1.810 2.000 . 0 0 "[ . 1 . 2]" 1
830 1 57 THR HA 1 57 THR MG 2.580 . 3.370 2.314 2.218 2.459 . 0 0 "[ . 1 . 2]" 1
831 1 57 THR HB 1 58 GLY H 3.280 . 4.760 3.770 3.391 4.056 . 0 0 "[ . 1 . 2]" 1
832 1 57 THR HB 1 59 TYR H 3.030 . 4.260 3.753 3.263 4.071 . 0 0 "[ . 1 . 2]" 1
833 1 57 THR HB 1 59 TYR QD 2.810 . 3.810 3.076 2.379 3.534 . 0 0 "[ . 1 . 2]" 1
834 1 57 THR HB 1 59 TYR QE 2.880 . 3.960 2.610 2.404 2.776 . 0 0 "[ . 1 . 2]" 1
835 1 57 THR MG 1 58 GLY H 3.300 . 4.800 3.984 3.704 4.117 . 0 0 "[ . 1 . 2]" 1
836 1 57 THR MG 1 59 TYR H 3.400 . 5.000 4.460 4.147 4.825 . 0 0 "[ . 1 . 2]" 1
837 1 57 THR MG 1 59 TYR QE 2.880 . 3.960 2.479 2.252 2.822 . 0 0 "[ . 1 . 2]" 1
838 1 57 THR MG 1 75 LYS QE 3.570 . 5.340 4.950 2.962 5.343 0.003 11 0 "[ . 1 . 2]" 1
839 1 57 THR MG 1 76 GLU HA 3.030 . 4.260 3.951 2.646 4.263 0.003 3 0 "[ . 1 . 2]" 1
840 1 58 GLY H 1 59 TYR H 3.650 . 5.500 2.219 2.128 2.364 . 0 0 "[ . 1 . 2]" 1
841 1 59 TYR H 1 59 TYR HB2 2.930 . 4.060 2.391 2.241 2.501 . 0 0 "[ . 1 . 2]" 1
842 1 59 TYR H 1 59 TYR HB3 2.950 . 4.100 3.606 3.538 3.660 . 0 0 "[ . 1 . 2]" 1
843 1 59 TYR H 1 59 TYR QD 3.200 . 4.600 3.249 2.970 3.431 . 0 0 "[ . 1 . 2]" 1
844 1 59 TYR H 1 75 LYS HB2 3.330 . 4.860 4.106 3.818 4.323 . 0 0 "[ . 1 . 2]" 1
845 1 59 TYR H 1 75 LYS QB 3.040 . 4.280 3.795 3.680 3.937 . 0 0 "[ . 1 . 2]" 1
846 1 59 TYR H 1 75 LYS HB3 3.330 . 4.860 4.545 4.012 4.867 0.007 20 0 "[ . 1 . 2]" 1
847 1 59 TYR H 1 75 LYS QD 3.570 . 5.340 5.309 5.049 5.349 0.009 6 0 "[ . 1 . 2]" 1
848 1 59 TYR HA 1 59 TYR QD 2.730 . 3.660 2.118 1.980 2.324 . 0 0 "[ . 1 . 2]" 1
849 1 59 TYR HA 1 59 TYR QE 3.140 . 4.480 4.271 4.217 4.346 . 0 0 "[ . 1 . 2]" 1
850 1 59 TYR HA 1 60 VAL MG2 3.110 . 4.420 3.569 3.401 3.733 . 0 0 "[ . 1 . 2]" 1
851 1 59 TYR HB2 1 60 VAL H 3.650 . 5.500 3.752 3.626 3.858 . 0 0 "[ . 1 . 2]" 1
852 1 59 TYR HB2 1 75 LYS QB 3.070 . 4.340 3.121 2.721 3.482 . 0 0 "[ . 1 . 2]" 1
853 1 59 TYR HB3 1 60 VAL H 2.900 . 4.000 2.519 2.373 2.641 . 0 0 "[ . 1 . 2]" 1
854 1 59 TYR HB3 1 60 VAL MG2 3.320 . 4.840 4.237 3.982 4.519 . 0 0 "[ . 1 . 2]" 1
855 1 59 TYR QD 1 60 VAL H 3.650 . 5.500 3.468 3.037 3.744 . 0 0 "[ . 1 . 2]" 1
856 1 59 TYR QD 1 76 GLU HA 3.340 . 4.880 4.556 3.949 4.877 . 0 0 "[ . 1 . 2]" 1
857 1 59 TYR QD 1 77 ARG H 3.650 . 5.500 3.695 2.881 5.349 . 0 0 "[ . 1 . 2]" 1
858 1 59 TYR QE 1 76 GLU HA 3.260 . 4.720 4.689 4.362 4.724 0.004 11 0 "[ . 1 . 2]" 1
859 1 59 TYR QE 1 77 ARG H 3.650 . 5.500 3.700 2.815 4.788 . 0 0 "[ . 1 . 2]" 1
860 1 59 TYR QE 1 77 ARG QB 3.130 . 4.460 3.024 2.280 4.441 . 0 0 "[ . 1 . 2]" 1
861 1 60 VAL H 1 60 VAL HB 2.710 . 3.620 2.545 2.470 2.632 . 0 0 "[ . 1 . 2]" 1
862 1 60 VAL H 1 60 VAL MG1 3.000 . 4.200 3.742 3.725 3.749 . 0 0 "[ . 1 . 2]" 1
863 1 60 VAL H 1 60 VAL MG2 2.560 . 3.320 2.084 1.866 2.316 . 0 0 "[ . 1 . 2]" 1
864 1 60 VAL HA 1 60 VAL MG1 2.690 . 3.580 2.320 2.261 2.367 . 0 0 "[ . 1 . 2]" 1
865 1 60 VAL HA 1 60 VAL MG2 2.690 . 3.580 2.377 2.258 2.506 . 0 0 "[ . 1 . 2]" 1
866 1 60 VAL HA 1 61 LYS H 2.520 . 3.230 2.144 2.129 2.155 . 0 0 "[ . 1 . 2]" 1
867 1 60 VAL HA 1 62 LYS H 3.020 . 4.250 4.095 3.970 4.197 . 0 0 "[ . 1 . 2]" 1
868 1 60 VAL HB 1 61 LYS H 3.650 . 5.500 4.231 4.165 4.291 . 0 0 "[ . 1 . 2]" 1
869 1 60 VAL HB 1 62 LYS H 3.420 . 5.040 4.919 4.530 5.045 0.005 10 0 "[ . 1 . 2]" 1
870 1 60 VAL HB 1 63 LEU QB 3.570 . 5.340 4.205 3.893 4.522 . 0 0 "[ . 1 . 2]" 1
871 1 60 VAL MG1 1 61 LYS H 2.830 . 3.850 2.664 2.381 2.860 . 0 0 "[ . 1 . 2]" 1
872 1 60 VAL MG1 1 62 LYS H 2.520 . 3.230 2.540 2.258 2.679 . 0 0 "[ . 1 . 2]" 1
873 1 60 VAL MG1 1 63 LEU QB 2.790 . 3.770 2.368 2.161 2.601 . 0 0 "[ . 1 . 2]" 1
874 1 60 VAL MG1 1 63 LEU QD 2.530 . 3.260 2.067 1.845 2.696 . 0 0 "[ . 1 . 2]" 1
875 1 60 VAL MG1 1 63 LEU HG 2.930 . 4.060 3.754 2.397 4.072 0.012 5 0 "[ . 1 . 2]" 1
876 1 60 VAL MG1 1 73 TYR QE 2.960 . 4.130 3.897 3.585 4.136 0.006 14 0 "[ . 1 . 2]" 1
877 1 60 VAL MG2 1 61 LYS H 3.210 . 4.620 4.070 3.980 4.144 . 0 0 "[ . 1 . 2]" 1
878 1 60 VAL MG2 1 63 LEU QB 3.500 . 5.200 4.194 4.004 4.344 . 0 0 "[ . 1 . 2]" 1
879 1 60 VAL MG2 1 63 LEU QD 3.070 . 4.340 2.965 2.688 3.464 . 0 0 "[ . 1 . 2]" 1
880 1 61 LYS H 1 62 LYS H 3.650 . 5.500 2.569 2.514 2.635 . 0 0 "[ . 1 . 2]" 1
881 1 61 LYS HA 1 61 LYS QD 3.170 . 4.540 3.708 2.229 3.911 . 0 0 "[ . 1 . 2]" 1
882 1 61 LYS HA 1 61 LYS QE 3.360 . 4.920 4.681 4.126 4.838 . 0 0 "[ . 1 . 2]" 1
883 1 61 LYS HA 1 61 LYS HG2 2.920 . 4.040 3.373 3.192 3.899 . 0 0 "[ . 1 . 2]" 1
884 1 61 LYS HA 1 61 LYS HG3 2.920 . 4.040 2.553 2.433 3.429 . 0 0 "[ . 1 . 2]" 1
885 1 61 LYS HA 1 73 TYR H 3.010 . 4.220 4.073 3.894 4.212 . 0 0 "[ . 1 . 2]" 1
886 1 61 LYS HA 1 73 TYR HB2 3.330 . 4.870 3.833 3.497 4.049 . 0 0 "[ . 1 . 2]" 1
887 1 61 LYS HA 1 73 TYR HB3 3.650 . 5.500 4.927 4.334 5.309 . 0 0 "[ . 1 . 2]" 1
888 1 61 LYS HB3 1 62 LYS H 2.450 . 3.100 2.465 2.323 2.554 . 0 0 "[ . 1 . 2]" 1
889 1 61 LYS QE 1 61 LYS QG 2.400 . 3.000 2.293 2.116 2.753 . 0 0 "[ . 1 . 2]" 1
890 1 61 LYS QG 1 62 LYS QB 3.000 . 4.200 2.634 2.322 3.194 . 0 0 "[ . 1 . 2]" 1
891 1 62 LYS H 1 62 LYS QG 2.520 . 3.230 2.281 2.177 2.398 . 0 0 "[ . 1 . 2]" 1
892 1 62 LYS H 1 63 LEU HA 3.620 . 5.450 4.812 4.722 4.879 . 0 0 "[ . 1 . 2]" 1
893 1 62 LYS HA 1 63 LEU H 2.590 . 3.380 2.267 2.223 2.308 . 0 0 "[ . 1 . 2]" 1
894 1 62 LYS HA 1 72 TYR HA 2.580 . 3.360 2.424 2.298 2.727 . 0 0 "[ . 1 . 2]" 1
895 1 62 LYS HA 1 72 TYR QB 3.370 . 4.940 4.351 4.150 4.715 . 0 0 "[ . 1 . 2]" 1
896 1 62 LYS HA 1 73 TYR H 3.270 . 4.750 2.676 2.429 2.969 . 0 0 "[ . 1 . 2]" 1
897 1 62 LYS HA 1 73 TYR QD 2.930 . 4.060 2.812 2.306 3.160 . 0 0 "[ . 1 . 2]" 1
898 1 62 LYS HA 1 73 TYR QE 3.570 . 5.340 4.582 3.527 5.038 . 0 0 "[ . 1 . 2]" 1
899 1 62 LYS QB 1 62 LYS QD 2.420 . 3.040 2.131 2.124 2.139 . 0 0 "[ . 1 . 2]" 1
900 1 62 LYS QB 1 62 LYS QE 2.830 . 3.850 3.575 3.533 3.661 . 0 0 "[ . 1 . 2]" 1
901 1 62 LYS QB 1 63 LEU H 2.770 . 3.740 2.790 2.646 2.960 . 0 0 "[ . 1 . 2]" 1
902 1 62 LYS QB 1 72 TYR HA 2.750 . 3.700 2.958 2.567 3.278 . 0 0 "[ . 1 . 2]" 1
903 1 62 LYS HB2 1 63 LEU H 3.050 . 4.300 2.846 2.691 3.032 . 0 0 "[ . 1 . 2]" 1
904 1 62 LYS HB2 1 72 TYR HA 3.020 . 4.240 3.376 2.947 3.755 . 0 0 "[ . 1 . 2]" 1
905 1 62 LYS HB2 1 72 TYR QD 2.980 . 4.160 3.542 3.211 4.104 . 0 0 "[ . 1 . 2]" 1
906 1 62 LYS HB2 1 72 TYR QE 3.350 . 4.900 3.748 3.187 4.446 . 0 0 "[ . 1 . 2]" 1
907 1 62 LYS HB3 1 63 LEU H 3.050 . 4.300 4.021 3.906 4.136 . 0 0 "[ . 1 . 2]" 1
908 1 62 LYS HB3 1 72 TYR HA 3.020 . 4.240 3.280 2.778 3.794 . 0 0 "[ . 1 . 2]" 1
909 1 62 LYS HB3 1 72 TYR QD 2.980 . 4.160 2.531 2.322 2.983 . 0 0 "[ . 1 . 2]" 1
910 1 62 LYS HB3 1 72 TYR QE 3.350 . 4.900 3.126 2.464 3.700 . 0 0 "[ . 1 . 2]" 1
911 1 62 LYS QD 1 72 TYR QD 2.990 . 4.180 3.843 3.381 4.156 . 0 0 "[ . 1 . 2]" 1
912 1 62 LYS HD2 1 72 TYR QD 3.280 . 4.760 4.698 4.422 4.764 0.004 15 0 "[ . 1 . 2]" 1
913 1 62 LYS HD2 1 72 TYR QE 2.900 . 4.000 3.544 3.270 3.824 . 0 0 "[ . 1 . 2]" 1
914 1 62 LYS HD3 1 72 TYR QD 3.280 . 4.760 4.088 3.509 4.602 . 0 0 "[ . 1 . 2]" 1
915 1 62 LYS HD3 1 72 TYR QE 2.900 . 4.000 2.987 2.555 3.688 . 0 0 "[ . 1 . 2]" 1
916 1 62 LYS QE 1 62 LYS QG 2.550 . 3.300 2.180 2.121 2.314 . 0 0 "[ . 1 . 2]" 1
917 1 62 LYS QG 1 63 LEU H 3.570 . 5.340 3.776 3.643 3.869 . 0 0 "[ . 1 . 2]" 1
918 1 63 LEU H 1 63 LEU QB 2.660 . 3.520 2.713 2.668 2.760 . 0 0 "[ . 1 . 2]" 1
919 1 63 LEU H 1 63 LEU MD1 3.650 . 5.500 4.098 3.879 4.709 . 0 0 "[ . 1 . 2]" 1
920 1 63 LEU H 1 63 LEU MD2 3.650 . 5.500 4.439 3.894 4.750 . 0 0 "[ . 1 . 2]" 1
921 1 63 LEU H 1 71 PHE H 3.650 . 5.500 3.222 2.936 3.479 . 0 0 "[ . 1 . 2]" 1
922 1 63 LEU H 1 71 PHE QB 3.200 . 4.600 3.580 3.179 3.943 . 0 0 "[ . 1 . 2]" 1
923 1 63 LEU H 1 72 TYR HA 3.650 . 5.500 3.518 3.194 3.980 . 0 0 "[ . 1 . 2]" 1
924 1 63 LEU H 1 73 TYR QD 2.400 . 3.000 2.982 2.854 3.009 0.009 6 0 "[ . 1 . 2]" 1
925 1 63 LEU H 1 73 TYR QE 2.870 . 3.940 3.367 2.074 3.804 . 0 0 "[ . 1 . 2]" 1
926 1 63 LEU HA 1 63 LEU MD1 3.040 . 4.280 2.280 2.048 3.705 . 0 0 "[ . 1 . 2]" 1
927 1 63 LEU HA 1 63 LEU QD 2.390 . 2.980 2.031 1.902 2.162 . 0 0 "[ . 1 . 2]" 1
928 1 63 LEU HA 1 63 LEU MD2 3.040 . 4.280 3.090 2.085 3.755 . 0 0 "[ . 1 . 2]" 1
929 1 63 LEU HA 1 64 GLN H 2.450 . 3.100 2.161 2.123 2.217 . 0 0 "[ . 1 . 2]" 1
930 1 63 LEU QB 1 64 GLN H 3.060 . 4.330 3.548 3.368 3.685 . 0 0 "[ . 1 . 2]" 1
931 1 63 LEU QB 1 71 PHE QB 3.070 . 4.340 3.557 3.189 4.037 . 0 0 "[ . 1 . 2]" 1
932 1 63 LEU QB 1 73 TYR QE 2.620 . 3.450 1.940 1.836 2.170 . 0 0 "[ . 1 . 2]" 1
933 1 63 LEU HB2 1 63 LEU MD1 2.830 . 3.850 2.583 2.272 3.196 . 0 0 "[ . 1 . 2]" 1
934 1 63 LEU HB2 1 63 LEU MD2 2.830 . 3.850 2.435 2.237 3.173 . 0 0 "[ . 1 . 2]" 1
935 1 63 LEU HB2 1 73 TYR QD 2.960 . 4.120 2.748 2.303 3.292 . 0 0 "[ . 1 . 2]" 1
936 1 63 LEU HB3 1 63 LEU MD1 2.830 . 3.850 2.820 2.261 3.187 . 0 0 "[ . 1 . 2]" 1
937 1 63 LEU HB3 1 63 LEU MD2 2.830 . 3.850 2.560 2.242 3.190 . 0 0 "[ . 1 . 2]" 1
938 1 63 LEU HB3 1 73 TYR QD 2.960 . 4.120 3.700 3.269 4.128 0.008 13 0 "[ . 1 . 2]" 1
939 1 63 LEU QD 1 64 GLN H 3.620 . 5.440 2.588 1.797 3.301 0.003 3 0 "[ . 1 . 2]" 1
940 1 63 LEU HG 1 73 TYR QE 2.980 . 4.160 4.180 4.155 4.213 0.053 19 0 "[ . 1 . 2]" 1
941 1 64 GLN H 1 64 GLN QB 2.650 . 3.500 2.298 2.278 2.353 . 0 0 "[ . 1 . 2]" 1
942 1 64 GLN H 1 64 GLN HG3 3.650 . 5.500 4.477 4.431 4.554 . 0 0 "[ . 1 . 2]" 1
943 1 64 GLN HA 1 64 GLN HG2 2.710 . 3.620 2.589 2.477 2.700 . 0 0 "[ . 1 . 2]" 1
944 1 64 GLN HA 1 64 GLN HG3 2.670 . 3.540 2.651 2.524 2.787 . 0 0 "[ . 1 . 2]" 1
945 1 64 GLN HA 1 65 ARG H 2.500 . 3.200 2.154 2.122 2.184 . 0 0 "[ . 1 . 2]" 1
946 1 64 GLN HA 1 70 PHE HA 2.460 . 3.120 2.327 2.274 2.456 . 0 0 "[ . 1 . 2]" 1
947 1 64 GLN HA 1 70 PHE QD 2.980 . 4.160 3.792 3.511 4.163 0.003 9 0 "[ . 1 . 2]" 1
948 1 64 GLN HA 1 71 PHE H 2.940 . 4.080 2.843 2.632 3.095 . 0 0 "[ . 1 . 2]" 1
949 1 64 GLN QB 1 70 PHE QD 3.010 . 4.220 3.445 3.121 3.987 . 0 0 "[ . 1 . 2]" 1
950 1 64 GLN QB 1 70 PHE QE 2.810 . 3.820 3.286 2.887 3.749 . 0 0 "[ . 1 . 2]" 1
951 1 64 GLN HE21 1 64 GLN HG3 2.170 . 2.540 2.320 2.296 2.402 . 0 0 "[ . 1 . 2]" 1
952 1 64 GLN HE21 1 65 ARG H 3.650 . 5.500 5.286 5.021 5.462 . 0 0 "[ . 1 . 2]" 1
953 1 64 GLN HE21 1 68 ASN H 3.650 . 5.500 4.685 4.464 4.743 . 0 0 "[ . 1 . 2]" 1
954 1 64 GLN HE21 1 68 ASN HA 2.170 . 2.540 2.518 2.308 2.544 0.004 4 0 "[ . 1 . 2]" 1
955 1 64 GLN HE21 1 68 ASN HB2 3.190 . 4.580 4.437 4.232 4.577 . 0 0 "[ . 1 . 2]" 1
956 1 64 GLN HE21 1 68 ASN HB3 2.980 . 4.160 3.144 3.018 3.213 . 0 0 "[ . 1 . 2]" 1
957 1 64 GLN HE22 1 68 ASN H 3.650 . 5.500 4.914 4.739 5.106 . 0 0 "[ . 1 . 2]" 1
958 1 64 GLN HE22 1 68 ASN HA 2.400 . 3.000 2.826 2.740 2.988 . 0 0 "[ . 1 . 2]" 1
959 1 64 GLN HG2 1 65 ARG H 2.100 . 2.400 2.406 2.402 2.412 0.012 1 0 "[ . 1 . 2]" 1
960 1 64 GLN HG2 1 68 ASN H 3.650 . 5.500 3.430 3.309 3.562 . 0 0 "[ . 1 . 2]" 1
961 1 64 GLN HG2 1 68 ASN HA 2.790 . 3.770 2.761 2.694 2.829 . 0 0 "[ . 1 . 2]" 1
962 1 64 GLN HG2 1 68 ASN HB3 3.360 . 4.920 4.922 4.914 4.928 0.008 11 0 "[ . 1 . 2]" 1
963 1 64 GLN HG2 1 70 PHE HA 3.030 . 4.260 3.957 3.620 4.100 . 0 0 "[ . 1 . 2]" 1
964 1 64 GLN HG3 1 65 ARG H 3.070 . 4.340 3.481 3.266 3.694 . 0 0 "[ . 1 . 2]" 1
965 1 64 GLN HG3 1 68 ASN H 3.650 . 5.500 4.837 4.719 4.953 . 0 0 "[ . 1 . 2]" 1
966 1 64 GLN HG3 1 68 ASN HA 2.850 . 3.900 3.439 3.363 3.592 . 0 0 "[ . 1 . 2]" 1
967 1 64 GLN HG3 1 68 ASN HB3 3.650 . 5.500 5.001 4.869 5.225 . 0 0 "[ . 1 . 2]" 1
968 1 64 GLN HG3 1 70 PHE H 3.650 . 5.500 4.020 3.701 4.356 . 0 0 "[ . 1 . 2]" 1
969 1 64 GLN HG3 1 70 PHE HA 3.130 . 4.460 3.142 2.900 3.450 . 0 0 "[ . 1 . 2]" 1
970 1 64 GLN HG3 1 70 PHE QB 3.230 . 4.660 4.536 4.359 4.663 0.003 20 0 "[ . 1 . 2]" 1
971 1 64 GLN HG3 1 70 PHE QD 3.030 . 4.260 3.625 2.862 3.832 . 0 0 "[ . 1 . 2]" 1
972 1 64 GLN HG3 1 71 PHE H 3.650 . 5.500 4.891 4.585 5.275 . 0 0 "[ . 1 . 2]" 1
973 1 65 ARG H 1 65 ARG HD2 3.650 . 5.500 4.625 4.366 4.901 . 0 0 "[ . 1 . 2]" 1
974 1 65 ARG H 1 65 ARG HD3 3.650 . 5.500 4.626 4.374 4.798 . 0 0 "[ . 1 . 2]" 1
975 1 65 ARG H 1 65 ARG HG2 3.210 . 4.630 2.616 2.166 3.201 . 0 0 "[ . 1 . 2]" 1
976 1 65 ARG H 1 65 ARG HG3 2.860 . 3.920 2.397 2.108 2.790 . 0 0 "[ . 1 . 2]" 1
977 1 65 ARG H 1 70 PHE HA 2.980 . 4.160 3.550 3.258 3.751 . 0 0 "[ . 1 . 2]" 1
978 1 65 ARG H 1 70 PHE QD 3.650 . 5.500 5.387 5.110 5.491 . 0 0 "[ . 1 . 2]" 1
979 1 65 ARG HA 1 65 ARG HG2 2.880 . 3.960 2.473 2.364 2.591 . 0 0 "[ . 1 . 2]" 1
980 1 65 ARG HA 1 66 ARG H 2.380 . 2.960 2.440 2.395 2.522 . 0 0 "[ . 1 . 2]" 1
981 1 65 ARG QB 1 65 ARG QD 2.520 . 3.240 2.259 2.095 2.420 . 0 0 "[ . 1 . 2]" 1
982 1 65 ARG QB 1 66 ARG H 2.940 . 4.090 2.281 2.147 2.398 . 0 0 "[ . 1 . 2]" 1
983 1 65 ARG QB 1 67 ASP H 3.570 . 5.340 2.268 2.210 2.366 . 0 0 "[ . 1 . 2]" 1
984 1 65 ARG QD 1 67 ASP H 3.570 . 5.340 4.711 4.237 4.998 . 0 0 "[ . 1 . 2]" 1
985 1 65 ARG QD 1 71 PHE QD 3.420 . 5.040 3.112 2.448 4.521 . 0 0 "[ . 1 . 2]" 1
986 1 65 ARG HG2 1 70 PHE HA 3.650 . 5.500 5.117 4.434 5.502 0.002 14 0 "[ . 1 . 2]" 1
987 1 65 ARG HG2 1 71 PHE H 3.650 . 5.500 4.219 3.685 4.583 . 0 0 "[ . 1 . 2]" 1
988 1 65 ARG HG2 1 71 PHE QB 3.500 . 5.200 2.689 2.219 3.228 . 0 0 "[ . 1 . 2]" 1
989 1 65 ARG HG2 1 71 PHE QD 3.650 . 5.500 4.390 3.936 4.737 . 0 0 "[ . 1 . 2]" 1
990 1 65 ARG HG3 1 68 ASN H 3.650 . 5.500 5.503 5.484 5.512 0.012 18 0 "[ . 1 . 2]" 1
991 1 65 ARG HG3 1 70 PHE HA 3.350 . 4.910 4.495 3.944 4.823 . 0 0 "[ . 1 . 2]" 1
992 1 65 ARG HG3 1 71 PHE H 3.650 . 5.500 4.052 3.538 4.292 . 0 0 "[ . 1 . 2]" 1
993 1 65 ARG HG3 1 71 PHE QB 3.330 . 4.860 2.606 2.301 3.345 . 0 0 "[ . 1 . 2]" 1
994 1 65 ARG HG3 1 71 PHE QD 3.440 . 5.080 4.078 3.651 4.483 . 0 0 "[ . 1 . 2]" 1
995 1 66 ARG H 1 67 ASP H 3.650 . 5.500 2.567 2.502 2.630 . 0 0 "[ . 1 . 2]" 1
996 1 66 ARG HA 1 66 ARG HD2 3.100 . 4.410 3.899 2.302 4.422 0.012 4 0 "[ . 1 . 2]" 1
997 1 66 ARG HA 1 66 ARG HD3 3.100 . 4.410 3.618 2.266 4.428 0.018 13 0 "[ . 1 . 2]" 1
998 1 67 ASP H 1 67 ASP HB2 2.100 . 2.400 2.396 2.367 2.408 0.008 16 0 "[ . 1 . 2]" 1
999 1 67 ASP H 1 68 ASN H 3.650 . 5.500 2.468 2.396 2.575 . 0 0 "[ . 1 . 2]" 1
1000 1 67 ASP HA 1 67 ASP HB2 2.400 . 3.000 3.004 2.995 3.013 0.013 16 0 "[ . 1 . 2]" 1
1001 1 68 ASN H 1 69 THR MG 3.650 . 5.500 4.364 4.090 4.658 . 0 0 "[ . 1 . 2]" 1
1002 1 68 ASN HB2 1 68 ASN HD21 2.100 . 2.400 2.345 2.316 2.364 . 0 0 "[ . 1 . 2]" 1
1003 1 68 ASN HB2 1 68 ASN HD22 2.770 . 3.740 3.548 3.531 3.559 . 0 0 "[ . 1 . 2]" 1
1004 1 68 ASN HB2 1 69 THR MG 3.230 . 4.670 3.703 3.583 3.819 . 0 0 "[ . 1 . 2]" 1
1005 1 68 ASN HB3 1 68 ASN HD21 2.400 . 3.000 3.004 2.990 3.008 0.008 5 0 "[ . 1 . 2]" 1
1006 1 68 ASN HB3 1 69 THR H 3.650 . 5.500 4.481 4.392 4.556 . 0 0 "[ . 1 . 2]" 1
1007 1 68 ASN HB3 1 69 THR MG 3.540 . 5.290 4.803 4.543 5.056 . 0 0 "[ . 1 . 2]" 1
1008 1 69 THR H 1 69 THR MG 2.640 . 3.480 2.768 2.387 3.005 . 0 0 "[ . 1 . 2]" 1
1009 1 69 THR HA 1 69 THR MG 2.250 . 2.700 2.292 2.241 2.338 . 0 0 "[ . 1 . 2]" 1
1010 1 69 THR HA 1 70 PHE H 2.440 . 3.080 2.163 2.149 2.184 . 0 0 "[ . 1 . 2]" 1
1011 1 69 THR HA 1 70 PHE QD 3.210 . 4.620 3.851 3.209 4.293 . 0 0 "[ . 1 . 2]" 1
1012 1 69 THR HB 1 70 PHE H 2.810 . 3.810 3.317 3.206 3.401 . 0 0 "[ . 1 . 2]" 1
1013 1 69 THR MG 1 70 PHE H 2.850 . 3.890 3.885 3.815 3.895 0.005 15 0 "[ . 1 . 2]" 1
1014 1 70 PHE H 1 70 PHE QB 2.620 . 3.450 2.294 2.208 2.343 . 0 0 "[ . 1 . 2]" 1
1015 1 70 PHE H 1 70 PHE QD 3.650 . 5.500 2.481 2.114 2.836 . 0 0 "[ . 1 . 2]" 1
1016 1 70 PHE HA 1 70 PHE QD 2.900 . 4.000 2.702 2.442 2.958 . 0 0 "[ . 1 . 2]" 1
1017 1 70 PHE HA 1 71 PHE H 2.440 . 3.080 2.153 2.141 2.188 . 0 0 "[ . 1 . 2]" 1
1018 1 70 PHE QD 1 71 PHE H 3.650 . 5.500 3.882 3.546 4.407 . 0 0 "[ . 1 . 2]" 1
1019 1 71 PHE H 1 71 PHE QB 2.640 . 3.480 2.502 2.362 2.582 . 0 0 "[ . 1 . 2]" 1
1020 1 71 PHE HA 1 71 PHE QD 2.970 . 4.140 2.807 2.055 3.005 . 0 0 "[ . 1 . 2]" 1
1021 1 71 PHE HA 1 72 TYR H 2.290 . 2.780 2.143 2.040 2.159 . 0 0 "[ . 1 . 2]" 1
1022 1 71 PHE QB 1 73 TYR QE 2.980 . 4.160 3.080 2.617 3.309 . 0 0 "[ . 1 . 2]" 1
1023 1 71 PHE HB2 1 73 TYR QE 3.350 . 4.900 4.666 3.089 4.905 0.005 6 0 "[ . 1 . 2]" 1
1024 1 71 PHE HB3 1 73 TYR QE 3.350 . 4.900 3.136 2.641 3.364 . 0 0 "[ . 1 . 2]" 1
1025 1 71 PHE QD 1 72 TYR H 3.650 . 5.500 3.693 3.426 3.877 . 0 0 "[ . 1 . 2]" 1
1026 1 71 PHE QD 1 73 TYR QE 2.730 . 3.660 2.948 2.770 3.663 0.003 19 0 "[ . 1 . 2]" 1
1027 1 72 TYR H 1 72 TYR HB2 2.770 . 3.740 2.383 2.329 2.457 . 0 0 "[ . 1 . 2]" 1
1028 1 72 TYR H 1 72 TYR HB3 2.770 . 3.740 3.598 3.583 3.613 . 0 0 "[ . 1 . 2]" 1
1029 1 72 TYR H 1 72 TYR QD 3.650 . 5.500 2.556 2.260 2.875 . 0 0 "[ . 1 . 2]" 1
1030 1 72 TYR HA 1 72 TYR QD 2.830 . 3.860 2.655 2.341 2.897 . 0 0 "[ . 1 . 2]" 1
1031 1 72 TYR HA 1 73 TYR H 2.460 . 3.120 2.182 2.158 2.225 . 0 0 "[ . 1 . 2]" 1
1032 1 72 TYR HA 1 73 TYR QD 3.020 . 4.250 3.819 3.419 4.169 . 0 0 "[ . 1 . 2]" 1
1033 1 72 TYR QB 1 73 TYR H 2.810 . 3.820 3.033 2.882 3.164 . 0 0 "[ . 1 . 2]" 1
1034 1 73 TYR H 1 73 TYR HB3 3.000 . 4.200 3.628 3.599 3.696 . 0 0 "[ . 1 . 2]" 1
1035 1 73 TYR H 1 73 TYR QD 3.650 . 5.500 3.014 2.572 3.397 . 0 0 "[ . 1 . 2]" 1
1036 1 73 TYR HA 1 73 TYR QD 2.690 . 3.580 2.708 2.463 2.906 . 0 0 "[ . 1 . 2]" 1
1037 1 73 TYR HA 1 74 ASN H 2.420 . 3.040 2.309 2.258 2.398 . 0 0 "[ . 1 . 2]" 1
1038 1 73 TYR HB2 1 74 ASN H 2.920 . 4.040 3.953 3.797 4.039 . 0 0 "[ . 1 . 2]" 1
1039 1 73 TYR HB3 1 74 ASN H 3.140 . 4.480 2.687 2.439 2.815 . 0 0 "[ . 1 . 2]" 1
1040 1 73 TYR QD 1 74 ASN H 3.650 . 5.500 3.232 2.997 3.758 . 0 0 "[ . 1 . 2]" 1
1041 1 73 TYR QD 1 74 ASN QB 3.520 . 5.250 4.976 4.686 5.252 0.002 19 0 "[ . 1 . 2]" 1
1042 1 74 ASN H 1 74 ASN QB 2.170 . 2.530 2.364 2.182 2.532 0.002 2 0 "[ . 1 . 2]" 1
1043 1 74 ASN QB 1 75 LYS H 3.040 . 4.290 3.532 3.085 3.916 . 0 0 "[ . 1 . 2]" 1
1044 1 74 ASN HB2 1 75 LYS H 3.360 . 4.920 3.793 3.162 4.401 . 0 0 "[ . 1 . 2]" 1
1045 1 74 ASN HB3 1 75 LYS H 3.360 . 4.920 4.364 4.168 4.479 . 0 0 "[ . 1 . 2]" 1
1046 1 74 ASN QD 1 77 ARG H 3.570 . 5.340 4.164 2.194 5.120 . 0 0 "[ . 1 . 2]" 1
1047 1 74 ASN QD 1 77 ARG HA 2.950 . 4.100 3.568 2.761 4.092 . 0 0 "[ . 1 . 2]" 1
1048 1 74 ASN QD 1 77 ARG QB 3.490 . 5.180 4.803 3.400 5.178 . 0 0 "[ . 1 . 2]" 1
1049 1 74 ASN QD 1 78 GLU H 3.570 . 5.340 3.870 3.192 5.103 . 0 0 "[ . 1 . 2]" 1
1050 1 75 LYS H 1 75 LYS HB2 2.920 . 4.040 3.587 3.548 3.612 . 0 0 "[ . 1 . 2]" 1
1051 1 75 LYS H 1 75 LYS QB 2.580 . 3.370 2.580 2.410 2.727 . 0 0 "[ . 1 . 2]" 1
1052 1 75 LYS H 1 75 LYS HB3 2.920 . 4.040 2.648 2.449 2.833 . 0 0 "[ . 1 . 2]" 1
1053 1 75 LYS H 1 75 LYS HD2 3.360 . 4.920 4.560 4.317 4.835 . 0 0 "[ . 1 . 2]" 1
1054 1 75 LYS H 1 75 LYS QD 3.050 . 4.300 3.989 3.751 4.173 . 0 0 "[ . 1 . 2]" 1
1055 1 75 LYS H 1 75 LYS HD3 3.360 . 4.920 4.431 4.010 4.822 . 0 0 "[ . 1 . 2]" 1
1056 1 75 LYS H 1 75 LYS HG2 3.650 . 5.500 2.295 1.800 3.030 . 10 0 "[ . 1 . 2]" 1
1057 1 75 LYS H 1 75 LYS HG3 3.650 . 5.500 2.546 2.103 3.332 . 0 0 "[ . 1 . 2]" 1
1058 1 75 LYS H 1 76 GLU H 3.650 . 5.500 2.583 2.380 2.900 . 0 0 "[ . 1 . 2]" 1
1059 1 75 LYS QB 1 75 LYS QD 2.440 . 3.080 2.114 2.096 2.137 . 0 0 "[ . 1 . 2]" 1
1060 1 75 LYS QB 1 75 LYS QE 2.850 . 3.910 3.557 2.595 3.760 . 0 0 "[ . 1 . 2]" 1
1061 1 75 LYS HB2 1 75 LYS HD2 2.940 . 4.080 2.387 2.296 2.539 . 0 0 "[ . 1 . 2]" 1
1062 1 75 LYS HB2 1 75 LYS HD3 2.940 . 4.080 2.694 2.344 3.599 . 0 0 "[ . 1 . 2]" 1
1063 1 75 LYS HB2 1 76 GLU H 3.530 . 5.260 3.921 3.557 4.141 . 0 0 "[ . 1 . 2]" 1
1064 1 75 LYS HB3 1 75 LYS HD2 2.940 . 4.080 3.398 2.601 3.726 . 0 0 "[ . 1 . 2]" 1
1065 1 75 LYS HB3 1 75 LYS HD3 2.940 . 4.080 2.924 2.580 3.514 . 0 0 "[ . 1 . 2]" 1
1066 1 75 LYS HB3 1 76 GLU H 3.530 . 5.260 4.137 3.937 4.288 . 0 0 "[ . 1 . 2]" 1
1067 1 75 LYS QD 1 76 GLU H 3.190 . 4.580 4.030 3.317 4.572 . 0 0 "[ . 1 . 2]" 1
1068 1 75 LYS QD 1 76 GLU HA 3.570 . 5.340 4.232 2.877 5.339 . 0 0 "[ . 1 . 2]" 1
1069 1 75 LYS QE 1 76 GLU QG 2.910 . 4.020 3.031 2.064 4.023 0.003 11 0 "[ . 1 . 2]" 1
1070 1 75 LYS HE2 1 76 GLU H 3.650 . 5.500 4.722 3.515 5.513 0.013 20 0 "[ . 1 . 2]" 1
1071 1 75 LYS HE3 1 76 GLU H 3.650 . 5.500 4.882 3.625 5.510 0.010 4 0 "[ . 1 . 2]" 1
1072 1 75 LYS HG3 1 76 GLU H 2.250 . 2.700 2.153 1.938 2.588 . 0 0 "[ . 1 . 2]" 1
1073 1 75 LYS HG3 1 76 GLU HA 3.240 . 4.680 3.652 3.277 3.950 . 0 0 "[ . 1 . 2]" 1
1074 1 75 LYS HG3 1 76 GLU QG 3.160 . 4.520 2.893 2.063 4.490 . 0 0 "[ . 1 . 2]" 1
1075 1 75 LYS HG3 1 77 ARG H 3.650 . 5.500 4.959 4.561 5.521 0.021 6 0 "[ . 1 . 2]" 1
1076 1 76 GLU H 1 76 GLU HB2 2.890 . 3.970 2.298 2.095 2.831 . 0 0 "[ . 1 . 2]" 1
1077 1 76 GLU H 1 76 GLU QB 2.490 . 3.180 2.264 2.068 2.737 . 0 0 "[ . 1 . 2]" 1
1078 1 76 GLU H 1 76 GLU HB3 2.890 . 3.970 3.448 3.052 3.631 . 0 0 "[ . 1 . 2]" 1
1079 1 76 GLU H 1 76 GLU QG 2.910 . 4.020 2.875 1.992 3.931 . 0 0 "[ . 1 . 2]" 1
1080 1 76 GLU HA 1 76 GLU QG 2.460 . 3.120 2.370 2.140 2.937 . 0 0 "[ . 1 . 2]" 1
1081 1 76 GLU HA 1 77 ARG H 2.470 . 3.140 2.567 2.245 3.209 0.069 20 0 "[ . 1 . 2]" 1
1082 1 76 GLU HA 1 77 ARG HB2 3.650 . 5.500 4.389 3.929 5.481 . 0 0 "[ . 1 . 2]" 1
1083 1 76 GLU HA 1 77 ARG QB 3.310 . 4.830 4.081 3.830 4.288 . 0 0 "[ . 1 . 2]" 1
1084 1 76 GLU HA 1 77 ARG HB3 3.650 . 5.500 5.052 4.209 5.476 . 0 0 "[ . 1 . 2]" 1
1085 1 76 GLU QB 1 77 ARG H 2.890 . 3.970 3.699 2.922 3.957 . 0 0 "[ . 1 . 2]" 1
1086 1 76 GLU HB2 1 77 ARG H 3.170 . 4.540 4.350 3.604 4.548 0.008 9 0 "[ . 1 . 2]" 1
1087 1 76 GLU HB3 1 77 ARG H 3.170 . 4.540 4.064 3.069 4.541 0.001 10 0 "[ . 1 . 2]" 1
1088 1 76 GLU QG 1 77 ARG H 3.390 . 4.980 4.157 2.444 4.719 . 0 0 "[ . 1 . 2]" 1
1089 1 77 ARG H 1 77 ARG HB2 2.670 . 3.540 2.474 2.114 3.494 . 0 0 "[ . 1 . 2]" 1
1090 1 77 ARG H 1 77 ARG HB3 2.670 . 3.540 3.264 2.173 3.560 0.020 19 0 "[ . 1 . 2]" 1
1091 1 77 ARG H 1 77 ARG HD2 3.650 . 5.500 5.240 3.920 5.541 0.041 6 0 "[ . 1 . 2]" 1
1092 1 77 ARG H 1 77 ARG HD3 3.650 . 5.500 4.921 4.525 5.523 0.023 11 0 "[ . 1 . 2]" 1
1093 1 77 ARG H 1 77 ARG QG 3.050 . 4.300 3.562 3.118 4.326 0.026 20 0 "[ . 1 . 2]" 1
1094 1 77 ARG HA 1 77 ARG HD2 2.970 . 4.140 3.480 2.273 3.759 . 0 0 "[ . 1 . 2]" 1
1095 1 77 ARG HA 1 77 ARG QD 2.710 . 3.620 2.567 2.074 3.184 . 0 0 "[ . 1 . 2]" 1
1096 1 77 ARG HA 1 77 ARG HD3 2.970 . 4.140 2.768 2.090 3.629 . 0 0 "[ . 1 . 2]" 1
1097 1 77 ARG HA 1 77 ARG HG2 2.920 . 4.040 2.626 2.051 4.051 0.011 7 0 "[ . 1 . 2]" 1
1098 1 77 ARG HA 1 77 ARG HG3 2.920 . 4.040 3.435 2.789 3.661 . 0 0 "[ . 1 . 2]" 1
1099 1 77 ARG HA 1 78 GLU H 2.580 . 3.370 2.175 2.113 2.290 . 0 0 "[ . 1 . 2]" 1
1100 1 77 ARG HA 1 78 GLU HA 3.290 . 4.780 4.414 4.351 4.465 . 0 0 "[ . 1 . 2]" 1
1101 1 77 ARG HA 1 79 CYS H 2.900 . 4.000 3.809 3.489 4.007 0.007 16 0 "[ . 1 . 2]" 1
1102 1 77 ARG QB 1 77 ARG QD 2.480 . 3.150 2.271 2.003 2.741 . 0 0 "[ . 1 . 2]" 1
1103 1 77 ARG QB 1 78 GLU H 3.130 . 4.460 3.498 3.075 3.864 . 0 0 "[ . 1 . 2]" 1
1104 1 77 ARG HB2 1 78 GLU H 3.460 . 5.120 4.330 3.864 4.621 . 0 0 "[ . 1 . 2]" 1
1105 1 77 ARG HB3 1 78 GLU H 3.460 . 5.120 3.752 3.157 4.578 . 0 0 "[ . 1 . 2]" 1
1106 1 77 ARG QD 1 78 GLU H 3.570 . 5.340 2.408 1.794 3.890 0.006 16 0 "[ . 1 . 2]" 1
1107 1 77 ARG QD 1 79 CYS H 2.390 . 2.980 2.261 1.791 3.018 0.038 11 0 "[ . 1 . 2]" 1
1108 1 77 ARG QD 1 79 CYS HB2 2.920 . 4.040 2.856 2.227 3.572 . 0 0 "[ . 1 . 2]" 1
1109 1 77 ARG HD2 1 79 CYS HB2 3.210 . 4.620 3.588 2.305 4.627 0.007 20 0 "[ . 1 . 2]" 1
1110 1 77 ARG HD3 1 79 CYS HB2 3.210 . 4.620 3.198 2.651 3.932 . 0 0 "[ . 1 . 2]" 1
1111 1 77 ARG QG 1 78 GLU H 3.400 . 5.000 3.486 2.119 3.941 . 0 0 "[ . 1 . 2]" 1
1112 1 77 ARG QG 1 79 CYS H 2.960 . 4.130 3.685 1.777 4.141 0.013 6 0 "[ . 1 . 2]" 1
1113 1 78 GLU H 1 79 CYS H 3.650 . 5.500 2.352 1.775 2.829 0.025 9 0 "[ . 1 . 2]" 1
1114 1 78 GLU H 1 79 CYS HB2 3.650 . 5.500 4.187 3.711 4.848 . 0 0 "[ . 1 . 2]" 1
1115 1 78 GLU HA 1 78 GLU HG2 2.700 . 3.600 2.697 2.305 3.599 . 0 0 "[ . 1 . 2]" 1
1116 1 78 GLU HA 1 78 GLU HG3 2.700 . 3.600 3.113 2.326 3.604 0.004 17 0 "[ . 1 . 2]" 1
1117 1 79 CYS H 1 79 CYS HB2 2.730 . 3.650 2.659 2.092 3.295 . 0 0 "[ . 1 . 2]" 1
1118 1 79 CYS H 1 79 CYS HB3 2.730 . 3.660 2.906 2.175 3.630 . 0 0 "[ . 1 . 2]" 1
1119 1 79 CYS HA 1 80 GLU H 2.370 . 2.940 2.208 2.140 2.308 . 0 0 "[ . 1 . 2]" 1
1120 1 79 CYS HA 1 80 GLU HA 3.340 . 4.880 4.424 4.396 4.447 . 0 0 "[ . 1 . 2]" 1
1121 1 79 CYS HA 1 80 GLU HB2 3.090 . 4.380 4.333 4.035 4.384 0.004 9 0 "[ . 1 . 2]" 1
1122 1 79 CYS HA 1 83 GLU HB2 3.190 . 4.580 3.420 3.086 3.906 . 0 0 "[ . 1 . 2]" 1
1123 1 79 CYS HA 1 83 GLU HB3 3.190 . 4.580 4.270 3.257 4.582 0.002 12 0 "[ . 1 . 2]" 1
1124 1 79 CYS HB2 1 80 GLU H 3.330 . 4.870 3.982 3.424 4.428 . 0 0 "[ . 1 . 2]" 1
1125 1 79 CYS HB3 1 80 GLU H 3.650 . 5.500 3.632 2.786 4.203 . 0 0 "[ . 1 . 2]" 1
1126 1 79 CYS HB3 1 80 GLU HA 3.650 . 5.500 4.742 4.221 5.252 . 0 0 "[ . 1 . 2]" 1
1127 1 80 GLU H 1 83 GLU H 3.650 . 5.500 3.038 2.855 3.539 . 0 0 "[ . 1 . 2]" 1
1128 1 80 GLU H 1 83 GLU QG 3.570 . 5.340 3.364 2.165 4.773 . 0 0 "[ . 1 . 2]" 1
1129 1 80 GLU HB2 1 81 ASP H 3.650 . 5.500 3.630 3.426 3.907 . 0 0 "[ . 1 . 2]" 1
1130 1 80 GLU HB3 1 81 ASP H 3.650 . 5.500 2.307 2.108 2.804 . 0 0 "[ . 1 . 2]" 1
1131 1 81 ASP HA 1 83 GLU H 3.290 . 4.780 4.022 3.766 4.163 . 0 0 "[ . 1 . 2]" 1
1132 1 81 ASP HA 1 84 VAL H 3.070 . 4.340 3.127 3.001 3.199 . 0 0 "[ . 1 . 2]" 1
1133 1 81 ASP HA 1 84 VAL MG1 3.160 . 4.520 3.861 3.622 4.232 . 0 0 "[ . 1 . 2]" 1
1134 1 81 ASP HA 1 84 VAL MG2 2.450 . 3.100 2.420 2.207 2.651 . 0 0 "[ . 1 . 2]" 1
1135 1 81 ASP QB 1 84 VAL MG2 3.100 . 4.410 4.054 3.709 4.313 . 0 0 "[ . 1 . 2]" 1
1136 1 82 LYS H 1 82 LYS QG 3.570 . 5.340 2.862 2.039 4.015 . 0 0 "[ . 1 . 2]" 1
1137 1 82 LYS H 1 83 GLU H 2.330 . 2.860 2.621 2.558 2.705 . 0 0 "[ . 1 . 2]" 1
1138 1 82 LYS H 1 84 VAL MG2 3.650 . 5.500 4.714 4.337 5.128 . 0 0 "[ . 1 . 2]" 1
1139 1 82 LYS H 1 85 HIS H 3.650 . 5.500 5.058 4.842 5.293 . 0 0 "[ . 1 . 2]" 1
1140 1 82 LYS HA 1 82 LYS QD 3.290 . 4.790 3.667 2.208 4.277 . 0 0 "[ . 1 . 2]" 1
1141 1 82 LYS HA 1 82 LYS QG 2.720 . 3.640 2.587 2.263 3.344 . 0 0 "[ . 1 . 2]" 1
1142 1 82 LYS QE 1 82 LYS QG 2.400 . 3.000 2.241 2.116 2.493 . 0 0 "[ . 1 . 2]" 1
1143 1 82 LYS QG 1 83 GLU H 3.570 . 5.340 3.591 1.815 4.571 . 0 0 "[ . 1 . 2]" 1
1144 1 83 GLU H 1 83 GLU QB 2.650 . 3.500 2.196 2.076 2.414 . 0 0 "[ . 1 . 2]" 1
1145 1 83 GLU H 1 83 GLU QG 2.900 . 4.000 3.249 2.245 4.018 0.018 11 0 "[ . 1 . 2]" 1
1146 1 83 GLU H 1 84 VAL H 3.650 . 5.500 2.359 2.312 2.398 . 0 0 "[ . 1 . 2]" 1
1147 1 83 GLU H 1 84 VAL HA 3.520 . 5.240 4.990 4.932 5.036 . 0 0 "[ . 1 . 2]" 1
1148 1 83 GLU H 1 84 VAL MG2 3.000 . 4.200 3.832 3.467 4.054 . 0 0 "[ . 1 . 2]" 1
1149 1 83 GLU HA 1 86 LYS H 3.650 . 5.500 3.259 3.101 3.497 . 0 0 "[ . 1 . 2]" 1
1150 1 83 GLU HA 1 86 LYS QE 3.090 . 4.380 3.826 3.112 4.370 . 0 0 "[ . 1 . 2]" 1
1151 1 83 GLU HA 1 86 LYS QG 2.810 . 3.830 2.767 1.990 3.351 . 0 0 "[ . 1 . 2]" 1
1152 1 83 GLU HA 1 87 VAL H 3.650 . 5.500 3.771 3.657 4.010 . 0 0 "[ . 1 . 2]" 1
1153 1 83 GLU HA 1 87 VAL MG2 3.110 . 4.420 3.184 2.987 3.440 . 0 0 "[ . 1 . 2]" 1
1154 1 83 GLU QB 1 84 VAL H 3.140 . 4.480 2.804 2.696 2.928 . 0 0 "[ . 1 . 2]" 1
1155 1 83 GLU QB 1 84 VAL MG2 3.080 . 4.360 3.431 3.285 3.616 . 0 0 "[ . 1 . 2]" 1
1156 1 84 VAL H 1 84 VAL HB 2.660 . 3.520 2.428 2.357 2.594 . 0 0 "[ . 1 . 2]" 1
1157 1 84 VAL H 1 84 VAL MG1 3.110 . 4.420 3.731 3.716 3.747 . 0 0 "[ . 1 . 2]" 1
1158 1 84 VAL H 1 84 VAL MG2 2.480 . 3.160 2.153 1.792 2.374 0.008 13 0 "[ . 1 . 2]" 1
1159 1 84 VAL H 1 85 HIS H 3.650 . 5.500 2.750 2.682 2.843 . 0 0 "[ . 1 . 2]" 1
1160 1 84 VAL HA 1 84 VAL MG1 2.500 . 3.190 2.418 2.333 2.559 . 0 0 "[ . 1 . 2]" 1
1161 1 84 VAL HA 1 84 VAL MG2 2.290 . 2.780 2.297 2.232 2.409 . 0 0 "[ . 1 . 2]" 1
1162 1 84 VAL HA 1 87 VAL H 3.170 . 4.540 3.562 3.376 3.689 . 0 0 "[ . 1 . 2]" 1
1163 1 84 VAL HA 1 87 VAL HB 2.900 . 4.000 2.572 2.275 2.841 . 0 0 "[ . 1 . 2]" 1
1164 1 84 VAL HA 1 87 VAL MG1 3.190 . 4.580 3.864 3.521 4.200 . 0 0 "[ . 1 . 2]" 1
1165 1 84 VAL HB 1 85 HIS H 3.120 . 4.450 2.491 2.404 2.669 . 0 0 "[ . 1 . 2]" 1
1166 1 84 VAL MG1 1 85 HIS H 3.650 . 5.500 3.267 3.100 3.521 . 0 0 "[ . 1 . 2]" 1
1167 1 84 VAL MG2 1 85 HIS H 3.340 . 4.880 3.846 3.645 3.933 . 0 0 "[ . 1 . 2]" 1
1168 1 85 HIS H 1 85 HIS HB2 2.840 . 3.880 2.434 2.254 2.623 . 0 0 "[ . 1 . 2]" 1
1169 1 85 HIS H 1 85 HIS HB3 2.840 . 3.880 3.176 2.471 3.622 . 0 0 "[ . 1 . 2]" 1
1170 1 85 HIS H 1 85 HIS HD2 3.650 . 5.500 4.715 3.045 5.172 . 0 0 "[ . 1 . 2]" 1
1171 1 85 HIS H 1 86 LYS H 3.650 . 5.500 2.658 2.509 2.797 . 0 0 "[ . 1 . 2]" 1
1172 1 85 HIS QB 1 86 LYS H 2.780 . 3.760 2.548 2.405 2.638 . 0 0 "[ . 1 . 2]" 1
1173 1 86 LYS H 1 86 LYS HB2 2.850 . 3.890 2.830 2.367 3.631 . 0 0 "[ . 1 . 2]" 1
1174 1 86 LYS H 1 86 LYS QB 2.580 . 3.360 2.423 2.335 2.629 . 0 0 "[ . 1 . 2]" 1
1175 1 86 LYS H 1 86 LYS HB3 2.850 . 3.890 3.228 2.503 3.597 . 0 0 "[ . 1 . 2]" 1
1176 1 86 LYS H 1 86 LYS QD 3.380 . 4.960 4.168 3.893 4.356 . 0 0 "[ . 1 . 2]" 1
1177 1 86 LYS H 1 86 LYS HG2 2.400 . 3.000 2.778 2.312 3.011 0.011 5 0 "[ . 1 . 2]" 1
1178 1 86 LYS H 1 86 LYS QG 2.150 . 2.500 2.338 1.994 2.502 0.002 16 0 "[ . 1 . 2]" 1
1179 1 86 LYS H 1 86 LYS HG3 2.400 . 3.000 2.648 2.049 3.007 0.007 6 0 "[ . 1 . 2]" 1
1180 1 86 LYS H 1 87 VAL H 3.650 . 5.500 2.465 2.374 2.521 . 0 0 "[ . 1 . 2]" 1
1181 1 86 LYS H 1 87 VAL MG2 3.000 . 4.210 4.068 3.953 4.190 . 0 0 "[ . 1 . 2]" 1
1182 1 86 LYS HA 1 86 LYS QD 3.020 . 4.240 3.303 2.688 4.006 . 0 0 "[ . 1 . 2]" 1
1183 1 86 LYS HA 1 86 LYS QG 2.620 . 3.450 2.667 2.248 3.338 . 0 0 "[ . 1 . 2]" 1
1184 1 86 LYS QE 1 86 LYS QG 2.490 . 3.180 2.261 2.185 2.503 . 0 0 "[ . 1 . 2]" 1
1185 1 87 VAL H 1 87 VAL MG1 3.400 . 5.000 3.732 3.679 3.765 . 0 0 "[ . 1 . 2]" 1
1186 1 87 VAL H 1 87 VAL MG2 2.170 . 2.540 2.510 2.387 2.546 0.006 14 0 "[ . 1 . 2]" 1
1187 1 87 VAL HA 1 87 VAL MG1 2.890 . 3.970 2.363 2.310 2.460 . 0 0 "[ . 1 . 2]" 1
1188 1 87 VAL HA 1 87 VAL MG2 2.440 . 3.080 2.312 2.248 2.374 . 0 0 "[ . 1 . 2]" 1
1189 1 87 VAL HA 1 88 LYS QB 3.280 . 4.760 4.350 4.085 4.628 . 0 0 "[ . 1 . 2]" 1
1190 1 87 VAL HA 1 88 LYS QG 3.220 . 4.640 3.684 3.154 4.399 . 0 0 "[ . 1 . 2]" 1
1191 1 87 VAL MG1 1 88 LYS H 2.880 . 3.960 2.299 2.109 2.516 . 0 0 "[ . 1 . 2]" 1
1192 1 87 VAL MG1 1 88 LYS QG 3.340 . 4.880 3.794 3.433 4.540 . 0 0 "[ . 1 . 2]" 1
1193 1 87 VAL MG1 1 89 VAL HA 3.640 . 5.480 4.151 3.822 4.315 . 0 0 "[ . 1 . 2]" 1
1194 1 87 VAL MG1 1 89 VAL MG2 3.210 . 4.620 2.884 2.442 3.271 . 0 0 "[ . 1 . 2]" 1
1195 1 87 VAL MG2 1 88 LYS H 3.260 . 4.720 3.842 3.734 3.934 . 0 0 "[ . 1 . 2]" 1
1196 1 88 LYS H 1 88 LYS HB2 2.960 . 4.130 3.315 2.348 3.765 . 0 0 "[ . 1 . 2]" 1
1197 1 88 LYS H 1 88 LYS QB 2.540 . 3.270 2.719 2.318 3.024 . 0 0 "[ . 1 . 2]" 1
1198 1 88 LYS H 1 88 LYS HB3 2.960 . 4.130 3.194 2.600 3.745 . 0 0 "[ . 1 . 2]" 1
1199 1 88 LYS H 1 88 LYS QD 3.230 . 4.670 4.030 3.674 4.621 . 0 0 "[ . 1 . 2]" 1
1200 1 88 LYS H 1 88 LYS QE 3.380 . 4.960 4.177 3.121 4.968 0.008 11 0 "[ . 1 . 2]" 1
1201 1 88 LYS H 1 88 LYS QG 2.750 . 3.700 2.187 1.854 3.143 . 0 0 "[ . 1 . 2]" 1
1202 1 88 LYS HA 1 88 LYS QD 3.230 . 4.670 4.145 3.629 4.383 . 0 0 "[ . 1 . 2]" 1
1203 1 88 LYS HA 1 88 LYS HG2 2.940 . 4.080 3.267 2.340 3.698 . 0 0 "[ . 1 . 2]" 1
1204 1 88 LYS HA 1 88 LYS QG 2.650 . 3.500 2.982 2.243 3.311 . 0 0 "[ . 1 . 2]" 1
1205 1 88 LYS HA 1 88 LYS HG3 2.940 . 4.080 3.515 2.618 3.745 . 0 0 "[ . 1 . 2]" 1
1206 1 88 LYS HA 1 89 VAL H 2.450 . 3.100 2.285 2.158 2.417 . 0 0 "[ . 1 . 2]" 1
1207 1 88 LYS HA 1 89 VAL HB 3.350 . 4.910 4.692 4.533 4.885 . 0 0 "[ . 1 . 2]" 1
1208 1 88 LYS QB 1 88 LYS QD 2.430 . 3.060 2.130 2.086 2.232 . 0 0 "[ . 1 . 2]" 1
1209 1 88 LYS QB 1 88 LYS QE 2.630 . 3.460 3.161 2.104 3.479 0.019 15 0 "[ . 1 . 2]" 1
1210 1 88 LYS HB2 1 89 VAL H 3.240 . 4.680 3.219 2.616 4.235 . 0 0 "[ . 1 . 2]" 1
1211 1 88 LYS HB3 1 89 VAL H 3.240 . 4.680 3.594 2.433 4.385 . 0 0 "[ . 1 . 2]" 1
1212 1 88 LYS QE 1 88 LYS QG 2.460 . 3.120 2.256 2.092 2.745 . 0 0 "[ . 1 . 2]" 1
1213 1 89 VAL H 1 89 VAL HB 2.580 . 3.370 2.676 2.551 2.857 . 0 0 "[ . 1 . 2]" 1
1214 1 89 VAL H 1 89 VAL MG2 3.220 . 4.640 2.538 2.138 2.834 . 0 0 "[ . 1 . 2]" 1
1215 1 89 VAL HA 1 89 VAL MG1 2.940 . 4.080 2.259 2.195 2.343 . 0 0 "[ . 1 . 2]" 1
1216 1 89 VAL HA 1 89 VAL MG2 2.870 . 3.930 2.389 2.284 2.512 . 0 0 "[ . 1 . 2]" 1
1217 1 89 VAL HB 1 90 TYR H 3.200 . 4.600 4.194 4.059 4.259 . 0 0 "[ . 1 . 2]" 1
1218 1 89 VAL MG1 1 90 TYR H 3.650 . 5.500 2.631 2.457 2.872 . 0 0 "[ . 1 . 2]" 1
1219 1 90 TYR H 1 90 TYR QB 2.650 . 3.500 2.331 2.175 2.392 . 0 0 "[ . 1 . 2]" 1
1220 1 90 TYR H 1 90 TYR QD 3.650 . 5.500 1.990 1.798 3.392 0.002 9 0 "[ . 1 . 2]" 1
1221 1 90 TYR QD 1 91 VAL H 3.650 . 5.500 3.686 2.226 3.962 . 0 0 "[ . 1 . 2]" 1
1222 1 91 VAL H 1 91 VAL HB 2.810 . 3.810 3.571 2.939 3.760 . 0 0 "[ . 1 . 2]" 1
1223 1 91 VAL H 1 91 VAL MG1 3.650 . 5.500 2.940 2.213 3.209 . 0 0 "[ . 1 . 2]" 1
1224 1 91 VAL H 1 91 VAL QG 3.080 . 4.370 2.052 1.969 2.228 . 0 0 "[ . 1 . 2]" 1
1225 1 91 VAL H 1 91 VAL MG2 3.650 . 5.500 2.414 1.993 3.931 . 0 0 "[ . 1 . 2]" 1
1226 1 91 VAL HA 1 91 VAL MG1 2.620 . 3.440 2.444 2.215 3.177 . 0 0 "[ . 1 . 2]" 1
1227 1 91 VAL HA 1 91 VAL MG2 2.620 . 3.440 2.988 2.249 3.180 . 0 0 "[ . 1 . 2]" 1
1228 1 91 VAL HA 1 92 TYR H 2.480 . 3.160 2.146 2.134 2.174 . 0 0 "[ . 1 . 2]" 1
1229 1 91 VAL HA 1 92 TYR QD 3.150 . 4.500 3.459 3.177 3.647 . 0 0 "[ . 1 . 2]" 1
1230 1 91 VAL HB 1 92 TYR H 3.400 . 5.000 3.506 3.092 4.391 . 0 0 "[ . 1 . 2]" 1
1231 1 91 VAL HB 1 92 TYR QD 3.500 . 5.200 5.054 4.462 5.203 0.003 16 0 "[ . 1 . 2]" 1
1232 1 91 VAL QG 1 92 TYR H 2.870 . 3.930 3.306 2.380 3.570 . 0 0 "[ . 1 . 2]" 1
1233 1 92 TYR H 1 92 TYR HB2 2.800 . 3.800 3.639 3.549 3.718 . 0 0 "[ . 1 . 2]" 1
1234 1 92 TYR H 1 92 TYR HB3 2.800 . 3.800 2.714 2.294 3.112 . 0 0 "[ . 1 . 2]" 1
1235 1 92 TYR H 1 92 TYR QD 2.920 . 4.040 2.123 1.846 2.514 . 0 0 "[ . 1 . 2]" 1
1236 1 92 TYR HA 1 92 TYR QD 3.050 . 4.300 3.691 3.662 3.703 . 0 0 "[ . 1 . 2]" 1
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