NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
562651 |
3zeh   |
18878 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_3zeh
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 1946
_Distance_constraint_stats_list.Viol_count 3395
_Distance_constraint_stats_list.Viol_total 2777.181
_Distance_constraint_stats_list.Viol_max 0.377
_Distance_constraint_stats_list.Viol_rms 0.0164
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0036
_Distance_constraint_stats_list.Viol_average_violations_only 0.0409
_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 6 MET 1.308 0.096 16 0 "[ . 1 . 2]"
1 7 ALA 1.260 0.098 10 0 "[ . 1 . 2]"
1 8 ARG 4.761 0.300 15 0 "[ . 1 . 2]"
1 9 ASP 4.577 0.377 16 0 "[ . 1 . 2]"
1 10 PHE 5.939 0.377 16 0 "[ . 1 . 2]"
1 11 LYS 1.264 0.183 9 0 "[ . 1 . 2]"
1 12 PRO 0.360 0.070 3 0 "[ . 1 . 2]"
1 13 GLY 0.028 0.012 4 0 "[ . 1 . 2]"
1 14 ASP 1.266 0.114 17 0 "[ . 1 . 2]"
1 15 LEU 3.204 0.114 17 0 "[ . 1 . 2]"
1 16 ILE 5.003 0.091 10 0 "[ . 1 . 2]"
1 17 PHE 2.264 0.091 10 0 "[ . 1 . 2]"
1 18 ALA 0.321 0.034 2 0 "[ . 1 . 2]"
1 19 LYS 9.066 0.208 4 0 "[ . 1 . 2]"
1 20 MET 3.279 0.099 18 0 "[ . 1 . 2]"
1 21 LYS 1.354 0.127 16 0 "[ . 1 . 2]"
1 22 GLY 0.249 0.127 16 0 "[ . 1 . 2]"
1 23 TYR 1.527 0.099 18 0 "[ . 1 . 2]"
1 24 PRO 0.256 0.037 13 0 "[ . 1 . 2]"
1 25 HIS 3.526 0.170 7 0 "[ . 1 . 2]"
1 26 TRP 1.770 0.075 8 0 "[ . 1 . 2]"
1 27 PRO 1.146 0.052 15 0 "[ . 1 . 2]"
1 28 ALA 2.556 0.167 5 0 "[ . 1 . 2]"
1 29 ARG 0.328 0.132 9 0 "[ . 1 . 2]"
1 30 VAL 0.912 0.125 9 0 "[ . 1 . 2]"
1 31 ASP 0.906 0.125 9 0 "[ . 1 . 2]"
1 32 GLU 2.068 0.201 13 0 "[ . 1 . 2]"
1 33 VAL 3.798 0.163 19 0 "[ . 1 . 2]"
1 34 PRO 4.339 0.163 19 0 "[ . 1 . 2]"
1 35 ASP 0.740 0.108 4 0 "[ . 1 . 2]"
1 36 GLY 0.735 0.108 4 0 "[ . 1 . 2]"
1 37 ALA 2.931 0.125 19 0 "[ . 1 . 2]"
1 38 VAL 2.217 0.137 17 0 "[ . 1 . 2]"
1 39 LYS 4.104 0.262 20 0 "[ . 1 . 2]"
1 40 PRO 0.729 0.061 17 0 "[ . 1 . 2]"
1 41 PRO 1.204 0.061 17 0 "[ . 1 . 2]"
1 42 THR 2.810 0.126 18 0 "[ . 1 . 2]"
1 43 ASN 2.221 0.126 18 0 "[ . 1 . 2]"
1 44 LYS 3.384 0.189 17 0 "[ . 1 . 2]"
1 45 LEU 3.716 0.189 17 0 "[ . 1 . 2]"
1 46 PRO 1.508 0.059 9 0 "[ . 1 . 2]"
1 47 ILE 3.188 0.167 5 0 "[ . 1 . 2]"
1 48 PHE 2.938 0.121 1 0 "[ . 1 . 2]"
1 49 PHE 4.083 0.115 20 0 "[ . 1 . 2]"
1 50 PHE 1.409 0.132 9 0 "[ . 1 . 2]"
1 51 GLY 0.283 0.046 1 0 "[ . 1 . 2]"
1 52 THR 0.550 0.075 8 0 "[ . 1 . 2]"
1 53 HIS 1.093 0.065 9 0 "[ . 1 . 2]"
1 54 GLU 1.694 0.140 2 0 "[ . 1 . 2]"
1 55 THR 5.151 0.140 2 0 "[ . 1 . 2]"
1 56 ALA 5.595 0.122 16 0 "[ . 1 . 2]"
1 57 PHE 3.291 0.107 7 0 "[ . 1 . 2]"
1 58 LEU 5.595 0.208 4 0 "[ . 1 . 2]"
1 59 GLY 0.346 0.039 10 0 "[ . 1 . 2]"
1 60 PRO 1.731 0.080 19 0 "[ . 1 . 2]"
1 61 LYS 5.057 0.173 15 0 "[ . 1 . 2]"
1 62 ASP 2.357 0.168 19 0 "[ . 1 . 2]"
1 63 ILE 8.123 0.173 15 0 "[ . 1 . 2]"
1 64 PHE 3.240 0.094 13 0 "[ . 1 . 2]"
1 65 PRO 4.583 0.159 4 0 "[ . 1 . 2]"
1 66 TYR 1.874 0.113 16 0 "[ . 1 . 2]"
1 67 SER 3.110 0.111 8 0 "[ . 1 . 2]"
1 68 GLU 4.094 0.300 14 0 "[ . 1 . 2]"
1 69 ASN 7.231 0.210 13 0 "[ . 1 . 2]"
1 70 LYS 4.789 0.122 3 0 "[ . 1 . 2]"
1 71 GLU 5.474 0.192 1 0 "[ . 1 . 2]"
1 72 LYS 9.217 0.257 19 0 "[ . 1 . 2]"
1 73 TYR 6.361 0.120 3 0 "[ . 1 . 2]"
1 74 GLY 1.687 0.138 4 0 "[ . 1 . 2]"
1 75 LYS 2.163 0.138 4 0 "[ . 1 . 2]"
1 76 PRO 4.242 0.241 8 0 "[ . 1 . 2]"
1 77 ASN 6.463 0.241 8 0 "[ . 1 . 2]"
1 78 LYS 0.991 0.109 2 0 "[ . 1 . 2]"
1 79 ARG 4.731 0.232 3 0 "[ . 1 . 2]"
1 80 LYS 1.216 0.120 15 0 "[ . 1 . 2]"
1 81 GLY 0.017 0.017 13 0 "[ . 1 . 2]"
1 82 PHE 2.459 0.100 3 0 "[ . 1 . 2]"
1 83 ASN 1.824 0.144 17 0 "[ . 1 . 2]"
1 84 GLU 0.840 0.052 14 0 "[ . 1 . 2]"
1 85 GLY 0.864 0.053 4 0 "[ . 1 . 2]"
1 86 LEU 1.444 0.109 20 0 "[ . 1 . 2]"
1 87 TRP 2.831 0.074 10 0 "[ . 1 . 2]"
1 88 GLU 3.265 0.106 1 0 "[ . 1 . 2]"
1 89 ILE 2.387 0.108 9 0 "[ . 1 . 2]"
1 90 ASP 1.358 0.094 19 0 "[ . 1 . 2]"
1 91 ASN 4.240 0.117 6 0 "[ . 1 . 2]"
1 92 ASN 4.217 0.117 6 0 "[ . 1 . 2]"
1 93 PRO 1.818 0.108 9 0 "[ . 1 . 2]"
1 94 LYS 0.540 0.056 8 0 "[ . 1 . 2]"
1 95 VAL 2.952 0.240 8 0 "[ . 1 . 2]"
1 96 LYS 1.252 0.240 8 0 "[ . 1 . 2]"
1 97 PHE 1.028 0.108 19 0 "[ . 1 . 2]"
1 98 SER 0.413 0.108 19 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 6 MET HA 1 6 MET HG2 4.120 . 4.120 2.920 2.498 3.764 . 0 0 "[ . 1 . 2]" 1
2 1 6 MET HA 1 6 MET QG 3.530 . 3.530 2.658 2.435 3.073 . 0 0 "[ . 1 . 2]" 1
3 1 6 MET HA 1 6 MET HG3 4.120 . 4.120 3.318 2.471 3.779 . 0 0 "[ . 1 . 2]" 1
4 1 6 MET HA 1 7 ALA H 2.660 . 2.660 2.609 2.429 2.756 0.096 16 0 "[ . 1 . 2]" 1
5 1 6 MET QB 1 7 ALA H 3.050 . 3.050 2.142 1.798 2.957 . 0 0 "[ . 1 . 2]" 1
6 1 6 MET QB 1 8 ARG H 3.300 . 3.300 2.925 2.165 3.342 0.042 20 0 "[ . 1 . 2]" 1
7 1 6 MET HB2 1 7 ALA H 3.700 . 3.700 3.357 2.808 3.749 0.049 12 0 "[ . 1 . 2]" 1
8 1 6 MET HB2 1 8 ARG H 3.910 . 3.910 3.478 2.540 3.960 0.050 12 0 "[ . 1 . 2]" 1
9 1 6 MET HB2 1 8 ARG QG 3.980 . 3.980 2.870 1.953 4.049 0.069 12 0 "[ . 1 . 2]" 1
10 1 6 MET HB3 1 7 ALA H 3.700 . 3.700 2.171 1.813 3.096 . 0 0 "[ . 1 . 2]" 1
11 1 6 MET HB3 1 8 ARG H 3.910 . 3.910 3.300 2.176 3.950 0.040 15 0 "[ . 1 . 2]" 1
12 1 6 MET HB3 1 8 ARG QG 3.980 . 3.980 3.269 2.569 4.044 0.064 19 0 "[ . 1 . 2]" 1
13 1 6 MET QG 1 7 ALA H 4.200 . 4.200 3.653 1.716 4.221 0.021 2 0 "[ . 1 . 2]" 1
14 1 6 MET HG2 1 7 ALA H 4.840 . 4.840 4.154 3.311 4.845 0.005 2 0 "[ . 1 . 2]" 1
15 1 6 MET HG3 1 7 ALA H 4.840 . 4.840 4.225 1.722 4.844 0.004 11 0 "[ . 1 . 2]" 1
16 1 7 ALA H 1 7 ALA MB 2.720 . 2.720 2.337 2.224 2.497 . 0 0 "[ . 1 . 2]" 1
17 1 7 ALA H 1 8 ARG H 3.400 . 3.400 3.037 2.213 3.498 0.098 10 0 "[ . 1 . 2]" 1
18 1 7 ALA MB 1 8 ARG H 3.590 . 3.590 3.279 2.485 3.649 0.059 15 0 "[ . 1 . 2]" 1
19 1 8 ARG H 1 8 ARG QB 2.810 . 2.810 2.822 2.612 3.110 0.300 15 0 "[ . 1 . 2]" 1
20 1 8 ARG H 1 8 ARG QG 2.750 . 2.750 2.246 1.805 2.757 0.007 15 0 "[ . 1 . 2]" 1
21 1 8 ARG HA 1 8 ARG QD 4.300 . 4.300 4.251 3.698 4.411 0.111 14 0 "[ . 1 . 2]" 1
22 1 8 ARG HA 1 8 ARG QG 3.560 . 3.560 3.344 3.282 3.478 . 0 0 "[ . 1 . 2]" 1
23 1 8 ARG HA 1 9 ASP H 3.150 . 3.150 2.664 2.234 3.373 0.223 7 0 "[ . 1 . 2]" 1
24 1 8 ARG HA 1 9 ASP HA 4.560 . 4.560 4.434 4.275 4.609 0.049 15 0 "[ . 1 . 2]" 1
25 1 8 ARG HA 1 9 ASP QB 5.040 . 5.040 4.374 3.721 5.147 0.107 3 0 "[ . 1 . 2]" 1
26 1 8 ARG QB 1 8 ARG QD 3.020 . 3.020 2.198 2.045 2.530 . 0 0 "[ . 1 . 2]" 1
27 1 8 ARG QB 1 9 ASP H 3.180 . 3.180 2.433 1.788 3.415 0.235 3 0 "[ . 1 . 2]" 1
28 1 8 ARG QD 1 9 ASP H 4.430 . 4.430 3.752 2.745 4.461 0.031 2 0 "[ . 1 . 2]" 1
29 1 8 ARG QG 1 9 ASP H 3.600 . 3.600 3.019 1.732 3.639 0.039 17 0 "[ . 1 . 2]" 1
30 1 8 ARG QG 1 9 ASP HB2 5.500 . 5.500 5.113 3.991 5.698 0.198 17 0 "[ . 1 . 2]" 1
31 1 8 ARG QG 1 9 ASP HB3 5.500 . 5.500 4.719 2.687 5.590 0.090 2 0 "[ . 1 . 2]" 1
32 1 9 ASP H 1 9 ASP HB2 3.710 . 3.710 3.406 2.411 3.878 0.168 16 0 "[ . 1 . 2]" 1
33 1 9 ASP H 1 9 ASP QB 3.120 . 3.120 2.616 2.049 3.080 . 0 0 "[ . 1 . 2]" 1
34 1 9 ASP H 1 9 ASP HB3 3.710 . 3.710 2.768 2.217 3.309 . 0 0 "[ . 1 . 2]" 1
35 1 9 ASP H 1 10 PHE HA 5.040 . 5.040 4.923 4.226 5.230 0.190 16 0 "[ . 1 . 2]" 1
36 1 9 ASP HA 1 10 PHE H 2.690 . 2.690 2.506 2.025 3.067 0.377 16 0 "[ . 1 . 2]" 1
37 1 9 ASP QB 1 10 PHE H 3.360 . 3.360 2.593 1.963 3.426 0.066 17 0 "[ . 1 . 2]" 1
38 1 9 ASP QB 1 10 PHE QD 4.620 . 4.620 4.443 2.520 4.733 0.113 15 0 "[ . 1 . 2]" 1
39 1 9 ASP HB2 1 10 PHE H 4.210 . 4.210 2.913 1.972 4.024 . 0 0 "[ . 1 . 2]" 1
40 1 9 ASP HB2 1 10 PHE QD 5.500 . 5.500 4.859 2.542 5.510 0.010 9 0 "[ . 1 . 2]" 1
41 1 9 ASP HB3 1 10 PHE H 4.210 . 4.210 3.568 2.398 4.185 . 0 0 "[ . 1 . 2]" 1
42 1 9 ASP HB3 1 10 PHE QD 5.500 . 5.500 5.294 4.140 5.578 0.078 14 0 "[ . 1 . 2]" 1
43 1 10 PHE H 1 10 PHE HB2 3.100 . 3.100 2.588 2.430 2.724 . 0 0 "[ . 1 . 2]" 1
44 1 10 PHE H 1 10 PHE HB3 3.820 . 3.820 3.727 3.625 3.826 0.006 9 0 "[ . 1 . 2]" 1
45 1 10 PHE H 1 10 PHE QD 3.260 . 3.260 2.863 2.479 3.222 . 0 0 "[ . 1 . 2]" 1
46 1 10 PHE H 1 11 LYS H 4.470 . 4.470 4.243 3.976 4.474 0.004 4 0 "[ . 1 . 2]" 1
47 1 10 PHE H 1 45 LEU MD1 4.760 . 4.760 3.780 3.345 4.176 . 0 0 "[ . 1 . 2]" 1
48 1 10 PHE H 1 45 LEU QD 3.890 . 3.890 3.639 3.259 3.947 0.057 19 0 "[ . 1 . 2]" 1
49 1 10 PHE H 1 45 LEU MD2 4.760 . 4.760 4.772 4.218 4.874 0.114 2 0 "[ . 1 . 2]" 1
50 1 10 PHE HA 1 10 PHE QD 3.600 . 3.600 2.876 2.497 3.069 . 0 0 "[ . 1 . 2]" 1
51 1 10 PHE HA 1 10 PHE QE 4.710 . 4.710 4.624 4.355 4.746 0.036 17 0 "[ . 1 . 2]" 1
52 1 10 PHE HA 1 11 LYS H 2.820 . 2.820 2.130 2.039 2.237 . 0 0 "[ . 1 . 2]" 1
53 1 10 PHE HB2 1 11 LYS H 4.400 . 4.400 4.107 3.761 4.357 . 0 0 "[ . 1 . 2]" 1
54 1 10 PHE HB2 1 30 VAL MG1 4.340 . 4.340 3.857 3.278 4.282 . 0 0 "[ . 1 . 2]" 1
55 1 10 PHE HB2 1 30 VAL MG2 4.320 . 4.320 3.501 3.112 3.952 . 0 0 "[ . 1 . 2]" 1
56 1 10 PHE HB2 1 45 LEU MD1 3.820 . 3.820 2.093 1.938 2.225 . 0 0 "[ . 1 . 2]" 1
57 1 10 PHE HB2 1 45 LEU QD 3.200 . 3.200 2.082 1.930 2.210 . 0 0 "[ . 1 . 2]" 1
58 1 10 PHE HB2 1 45 LEU MD2 3.820 . 3.820 3.737 3.306 3.855 0.035 9 0 "[ . 1 . 2]" 1
59 1 10 PHE HB2 1 63 ILE MD 4.240 . 4.240 2.998 2.568 3.497 . 0 0 "[ . 1 . 2]" 1
60 1 10 PHE HB3 1 11 LYS H 3.700 . 3.700 3.183 2.571 3.709 0.009 20 0 "[ . 1 . 2]" 1
61 1 10 PHE HB3 1 16 ILE MG 4.370 . 4.370 3.630 3.184 4.252 . 0 0 "[ . 1 . 2]" 1
62 1 10 PHE HB3 1 30 VAL MG1 3.830 . 3.830 3.130 2.533 3.517 . 0 0 "[ . 1 . 2]" 1
63 1 10 PHE HB3 1 30 VAL MG2 3.160 . 3.160 2.117 1.932 2.573 . 0 0 "[ . 1 . 2]" 1
64 1 10 PHE HB3 1 45 LEU MD1 4.550 . 4.550 2.683 2.356 3.113 . 0 0 "[ . 1 . 2]" 1
65 1 10 PHE HB3 1 45 LEU QD 3.800 . 3.800 2.659 2.333 3.065 . 0 0 "[ . 1 . 2]" 1
66 1 10 PHE HB3 1 45 LEU MD2 4.550 . 4.550 4.404 3.749 4.593 0.043 16 0 "[ . 1 . 2]" 1
67 1 10 PHE HB3 1 63 ILE MD 4.150 . 4.150 3.001 2.658 3.377 . 0 0 "[ . 1 . 2]" 1
68 1 10 PHE HB3 1 63 ILE MG 5.500 . 5.500 5.428 5.125 5.575 0.075 9 0 "[ . 1 . 2]" 1
69 1 10 PHE QD 1 11 LYS H 4.330 . 4.330 4.046 2.973 4.347 0.017 10 0 "[ . 1 . 2]" 1
70 1 10 PHE QD 1 16 ILE MG 3.810 . 3.810 2.167 1.870 3.111 . 0 0 "[ . 1 . 2]" 1
71 1 10 PHE QD 1 30 VAL MG1 4.950 . 4.950 4.550 3.944 4.897 . 0 0 "[ . 1 . 2]" 1
72 1 10 PHE QD 1 30 VAL MG2 3.840 . 3.840 2.857 2.359 3.442 . 0 0 "[ . 1 . 2]" 1
73 1 10 PHE QD 1 45 LEU QD 3.750 . 3.750 3.115 2.808 3.479 . 0 0 "[ . 1 . 2]" 1
74 1 10 PHE QD 1 60 PRO HA 4.720 . 4.720 3.175 2.211 4.053 . 0 0 "[ . 1 . 2]" 1
75 1 10 PHE QD 1 60 PRO HG3 5.500 . 5.500 4.691 4.224 5.253 . 0 0 "[ . 1 . 2]" 1
76 1 10 PHE QD 1 63 ILE MD 4.120 . 4.120 2.667 2.413 2.793 . 0 0 "[ . 1 . 2]" 1
77 1 10 PHE QD 1 63 ILE MG 4.890 . 4.890 4.864 4.741 4.933 0.043 4 0 "[ . 1 . 2]" 1
78 1 10 PHE QE 1 16 ILE MG 3.700 . 3.700 2.136 1.968 2.343 . 0 0 "[ . 1 . 2]" 1
79 1 10 PHE QE 1 60 PRO HA 4.700 . 4.700 3.426 2.937 3.967 . 0 0 "[ . 1 . 2]" 1
80 1 10 PHE QE 1 63 ILE MD 4.540 . 4.540 3.275 3.032 3.473 . 0 0 "[ . 1 . 2]" 1
81 1 10 PHE QE 1 63 ILE MG 4.810 . 4.810 4.798 4.641 4.908 0.098 4 0 "[ . 1 . 2]" 1
82 1 10 PHE QE 1 64 PHE HA 4.870 . 4.870 3.372 2.858 3.914 . 0 0 "[ . 1 . 2]" 1
83 1 10 PHE QE 1 65 PRO HA 4.290 . 4.290 3.193 2.560 3.662 . 0 0 "[ . 1 . 2]" 1
84 1 10 PHE QE 1 65 PRO HD2 5.030 . 5.030 4.202 3.624 4.735 . 0 0 "[ . 1 . 2]" 1
85 1 10 PHE QE 1 65 PRO HD3 4.630 . 4.630 2.759 2.046 3.431 . 0 0 "[ . 1 . 2]" 1
86 1 10 PHE QE 1 65 PRO QG 5.010 . 5.010 3.988 3.012 4.532 . 0 0 "[ . 1 . 2]" 1
87 1 10 PHE HZ 1 16 ILE MG 4.330 . 4.330 3.959 2.652 4.301 . 0 0 "[ . 1 . 2]" 1
88 1 10 PHE HZ 1 63 ILE MG 5.490 . 5.490 5.517 5.287 5.603 0.113 3 0 "[ . 1 . 2]" 1
89 1 10 PHE HZ 1 64 PHE HA 4.220 . 4.220 2.789 2.018 3.412 . 0 0 "[ . 1 . 2]" 1
90 1 10 PHE HZ 1 65 PRO HD2 4.550 . 4.550 3.890 3.300 4.570 0.020 18 0 "[ . 1 . 2]" 1
91 1 10 PHE HZ 1 65 PRO HD3 4.110 . 4.110 2.466 1.862 3.083 . 0 0 "[ . 1 . 2]" 1
92 1 10 PHE HZ 1 65 PRO QG 4.710 . 4.710 4.194 2.979 4.737 0.027 8 0 "[ . 1 . 2]" 1
93 1 11 LYS H 1 11 LYS QB 3.240 . 3.240 2.670 2.391 3.247 0.007 3 0 "[ . 1 . 2]" 1
94 1 11 LYS H 1 11 LYS HG2 4.320 . 4.320 3.490 1.914 4.309 . 0 0 "[ . 1 . 2]" 1
95 1 11 LYS H 1 11 LYS QG 3.460 . 3.460 2.634 1.904 3.607 0.147 2 0 "[ . 1 . 2]" 1
96 1 11 LYS H 1 11 LYS HG3 4.320 . 4.320 2.992 2.045 4.339 0.019 10 0 "[ . 1 . 2]" 1
97 1 11 LYS H 1 12 PRO HD2 5.100 . 5.100 5.062 4.682 5.136 0.036 1 0 "[ . 1 . 2]" 1
98 1 11 LYS H 1 12 PRO HD3 5.100 . 5.100 4.768 4.654 5.027 . 0 0 "[ . 1 . 2]" 1
99 1 11 LYS H 1 14 ASP H 5.070 . 5.070 3.939 3.499 4.474 . 0 0 "[ . 1 . 2]" 1
100 1 11 LYS H 1 14 ASP QB 4.030 . 4.030 2.640 1.692 3.809 . 0 0 "[ . 1 . 2]" 1
101 1 11 LYS H 1 30 VAL MG1 4.190 . 4.190 3.934 3.573 4.219 0.029 14 0 "[ . 1 . 2]" 1
102 1 11 LYS H 1 30 VAL MG2 4.050 . 4.050 3.668 3.127 4.003 . 0 0 "[ . 1 . 2]" 1
103 1 11 LYS HA 1 11 LYS QD 4.100 . 4.100 3.776 2.180 4.283 0.183 9 0 "[ . 1 . 2]" 1
104 1 11 LYS HA 1 11 LYS QG 3.740 . 3.740 2.805 2.340 3.339 . 0 0 "[ . 1 . 2]" 1
105 1 11 LYS HA 1 12 PRO HD2 3.370 . 3.370 2.714 2.330 3.089 . 0 0 "[ . 1 . 2]" 1
106 1 11 LYS HA 1 12 PRO HD3 3.370 . 3.370 2.161 2.061 2.643 . 0 0 "[ . 1 . 2]" 1
107 1 11 LYS QB 1 12 PRO HD2 3.540 . 3.540 2.406 2.114 2.727 . 0 0 "[ . 1 . 2]" 1
108 1 11 LYS QB 1 12 PRO HD3 3.540 . 3.540 3.311 2.895 3.550 0.010 9 0 "[ . 1 . 2]" 1
109 1 11 LYS QD 1 11 LYS QG 2.360 . 2.360 2.047 1.975 2.095 . 0 0 "[ . 1 . 2]" 1
110 1 11 LYS QE 1 11 LYS QG 3.250 . 3.250 2.481 2.114 2.955 . 0 0 "[ . 1 . 2]" 1
111 1 11 LYS QG 1 12 PRO QD 3.980 . 3.980 3.670 3.013 4.050 0.070 3 0 "[ . 1 . 2]" 1
112 1 12 PRO HA 1 13 GLY H 3.250 . 3.250 2.153 2.111 2.220 . 0 0 "[ . 1 . 2]" 1
113 1 12 PRO HA 1 14 ASP H 3.820 . 3.820 3.536 3.389 3.824 0.004 11 0 "[ . 1 . 2]" 1
114 1 12 PRO HA 1 30 VAL HB 3.760 . 3.760 2.866 2.457 3.249 . 0 0 "[ . 1 . 2]" 1
115 1 12 PRO HA 1 30 VAL MG1 3.230 . 3.230 2.254 2.014 2.557 . 0 0 "[ . 1 . 2]" 1
116 1 12 PRO HA 1 31 ASP HA 4.580 . 4.580 4.104 3.419 4.591 0.011 2 0 "[ . 1 . 2]" 1
117 1 12 PRO HA 1 32 GLU H 5.500 . 5.500 5.126 4.816 5.537 0.037 6 0 "[ . 1 . 2]" 1
118 1 12 PRO QB 1 13 GLY H 3.830 . 3.830 3.399 3.001 3.533 . 0 0 "[ . 1 . 2]" 1
119 1 12 PRO QB 1 31 ASP HA 4.670 . 4.670 4.231 3.430 4.683 0.013 6 0 "[ . 1 . 2]" 1
120 1 12 PRO QB 1 32 GLU HA 3.420 . 3.420 2.158 1.866 2.677 . 0 0 "[ . 1 . 2]" 1
121 1 12 PRO HB2 1 13 GLY H 4.450 . 4.450 3.954 3.351 4.082 . 0 0 "[ . 1 . 2]" 1
122 1 12 PRO HB3 1 13 GLY H 4.450 . 4.450 3.717 3.211 3.909 . 0 0 "[ . 1 . 2]" 1
123 1 13 GLY H 1 14 ASP H 3.380 . 3.380 2.485 2.300 2.737 . 0 0 "[ . 1 . 2]" 1
124 1 13 GLY H 1 30 VAL H 4.470 . 4.470 3.820 3.586 4.044 . 0 0 "[ . 1 . 2]" 1
125 1 13 GLY H 1 30 VAL HB 4.030 . 4.030 2.754 2.440 2.959 . 0 0 "[ . 1 . 2]" 1
126 1 13 GLY H 1 30 VAL MG1 3.970 . 3.970 3.434 3.156 3.664 . 0 0 "[ . 1 . 2]" 1
127 1 13 GLY H 1 30 VAL MG2 4.460 . 4.460 4.309 4.056 4.472 0.012 4 0 "[ . 1 . 2]" 1
128 1 13 GLY H 1 31 ASP HA 4.550 . 4.550 3.583 3.220 3.859 . 0 0 "[ . 1 . 2]" 1
129 1 14 ASP H 1 14 ASP HB2 3.810 . 3.810 2.540 2.147 3.814 0.004 8 0 "[ . 1 . 2]" 1
130 1 14 ASP H 1 14 ASP QB 3.010 . 3.010 2.355 2.110 2.934 . 0 0 "[ . 1 . 2]" 1
131 1 14 ASP H 1 14 ASP HB3 3.810 . 3.810 3.092 2.418 3.692 . 0 0 "[ . 1 . 2]" 1
132 1 14 ASP H 1 15 LEU H 4.650 . 4.650 4.558 4.466 4.601 . 0 0 "[ . 1 . 2]" 1
133 1 14 ASP H 1 16 ILE MG 5.120 . 5.120 5.026 4.851 5.148 0.028 16 0 "[ . 1 . 2]" 1
134 1 14 ASP H 1 30 VAL HB 3.500 . 3.500 2.652 2.426 3.009 . 0 0 "[ . 1 . 2]" 1
135 1 14 ASP H 1 30 VAL MG1 4.600 . 4.600 3.958 3.719 4.356 . 0 0 "[ . 1 . 2]" 1
136 1 14 ASP H 1 30 VAL MG2 4.250 . 4.250 3.664 3.436 4.017 . 0 0 "[ . 1 . 2]" 1
137 1 14 ASP HA 1 15 LEU H 2.880 . 2.880 2.239 2.062 2.430 . 0 0 "[ . 1 . 2]" 1
138 1 14 ASP HA 1 15 LEU HG 4.170 . 4.170 3.561 3.343 3.945 . 0 0 "[ . 1 . 2]" 1
139 1 14 ASP HA 1 16 ILE MG 4.810 . 4.810 4.677 4.222 4.865 0.055 19 0 "[ . 1 . 2]" 1
140 1 14 ASP QB 1 15 LEU H 3.550 . 3.550 3.014 2.321 3.350 . 0 0 "[ . 1 . 2]" 1
141 1 14 ASP QB 1 15 LEU HB2 5.150 . 5.150 5.037 4.390 5.264 0.114 17 0 "[ . 1 . 2]" 1
142 1 14 ASP QB 1 16 ILE MG 3.460 . 3.460 2.869 2.282 3.543 0.083 8 0 "[ . 1 . 2]" 1
143 1 14 ASP QB 1 30 VAL H 5.040 . 5.040 3.902 3.256 5.017 . 0 0 "[ . 1 . 2]" 1
144 1 15 LEU H 1 15 LEU HB2 3.390 . 3.390 2.399 2.201 2.503 . 0 0 "[ . 1 . 2]" 1
145 1 15 LEU H 1 15 LEU HB3 3.870 . 3.870 3.614 3.537 3.667 . 0 0 "[ . 1 . 2]" 1
146 1 15 LEU H 1 15 LEU MD1 3.860 . 3.860 3.849 3.736 3.909 0.049 3 0 "[ . 1 . 2]" 1
147 1 15 LEU H 1 15 LEU MD2 3.760 . 3.760 3.433 3.267 3.688 . 0 0 "[ . 1 . 2]" 1
148 1 15 LEU H 1 15 LEU HG 3.570 . 3.570 2.637 2.440 2.876 . 0 0 "[ . 1 . 2]" 1
149 1 15 LEU H 1 16 ILE H 4.760 . 4.760 4.419 4.320 4.514 . 0 0 "[ . 1 . 2]" 1
150 1 15 LEU H 1 16 ILE MG 4.940 . 4.940 3.730 3.445 3.967 . 0 0 "[ . 1 . 2]" 1
151 1 15 LEU H 1 89 ILE MD 5.080 . 5.080 5.067 4.820 5.147 0.067 19 0 "[ . 1 . 2]" 1
152 1 15 LEU HA 1 15 LEU MD2 3.160 . 3.160 1.998 1.942 2.031 . 0 0 "[ . 1 . 2]" 1
153 1 15 LEU HA 1 16 ILE H 3.290 . 3.290 2.144 2.084 2.212 . 0 0 "[ . 1 . 2]" 1
154 1 15 LEU HA 1 16 ILE MD 5.500 . 5.500 4.895 4.640 5.090 . 0 0 "[ . 1 . 2]" 1
155 1 15 LEU HA 1 16 ILE HG13 4.110 . 4.110 3.873 3.409 4.176 0.066 14 0 "[ . 1 . 2]" 1
156 1 15 LEU HA 1 16 ILE MG 4.660 . 4.660 3.709 3.620 3.834 . 0 0 "[ . 1 . 2]" 1
157 1 15 LEU HA 1 29 ARG HA 3.890 . 3.890 2.612 2.360 2.883 . 0 0 "[ . 1 . 2]" 1
158 1 15 LEU HA 1 89 ILE MD 4.110 . 4.110 3.115 2.588 3.409 . 0 0 "[ . 1 . 2]" 1
159 1 15 LEU HB2 1 66 TYR HA 5.500 . 5.500 5.466 5.237 5.538 0.038 18 0 "[ . 1 . 2]" 1
160 1 15 LEU HB2 1 66 TYR HB2 4.370 . 4.370 3.782 3.278 4.136 . 0 0 "[ . 1 . 2]" 1
161 1 15 LEU HB2 1 66 TYR HB3 4.550 . 4.550 2.569 2.376 2.696 . 0 0 "[ . 1 . 2]" 1
162 1 15 LEU HB2 1 66 TYR QD 4.610 . 4.610 3.444 2.369 4.023 . 0 0 "[ . 1 . 2]" 1
163 1 15 LEU HB2 1 67 SER H 4.800 . 4.800 4.205 3.421 4.814 0.014 17 0 "[ . 1 . 2]" 1
164 1 15 LEU HB2 1 89 ILE MD 3.770 . 3.770 3.626 3.489 3.779 0.009 1 0 "[ . 1 . 2]" 1
165 1 15 LEU HB3 1 15 LEU MD1 3.170 . 3.170 2.328 2.310 2.350 . 0 0 "[ . 1 . 2]" 1
166 1 15 LEU HB3 1 16 ILE H 4.360 . 4.360 3.300 3.167 3.453 . 0 0 "[ . 1 . 2]" 1
167 1 15 LEU HB3 1 66 TYR HB3 4.670 . 4.670 2.500 2.162 2.871 . 0 0 "[ . 1 . 2]" 1
168 1 15 LEU HB3 1 66 TYR QD 4.650 . 4.650 3.395 2.594 3.996 . 0 0 "[ . 1 . 2]" 1
169 1 15 LEU HB3 1 89 ILE MD 3.410 . 3.410 2.030 1.891 2.218 . 0 0 "[ . 1 . 2]" 1
170 1 15 LEU MD1 1 66 TYR QD 3.680 . 3.680 3.100 2.507 3.590 . 0 0 "[ . 1 . 2]" 1
171 1 15 LEU MD1 1 66 TYR QE 4.470 . 4.470 3.786 2.806 4.487 0.017 12 0 "[ . 1 . 2]" 1
172 1 15 LEU MD1 1 89 ILE MD 3.390 . 3.390 3.027 2.524 3.395 0.005 3 0 "[ . 1 . 2]" 1
173 1 15 LEU MD1 1 89 ILE QG 3.820 . 3.820 2.313 2.038 2.555 . 0 0 "[ . 1 . 2]" 1
174 1 15 LEU MD1 1 93 PRO HA 4.980 . 4.980 4.419 3.759 4.997 0.017 3 0 "[ . 1 . 2]" 1
175 1 15 LEU MD2 1 16 ILE H 3.710 . 3.710 3.597 3.503 3.725 0.015 3 0 "[ . 1 . 2]" 1
176 1 15 LEU MD2 1 16 ILE HA 5.500 . 5.500 5.548 5.531 5.569 0.069 2 0 "[ . 1 . 2]" 1
177 1 15 LEU MD2 1 29 ARG H 5.220 . 5.220 4.926 4.511 5.220 0.000 1 0 "[ . 1 . 2]" 1
178 1 15 LEU MD2 1 29 ARG HA 3.690 . 3.690 3.077 2.666 3.376 . 0 0 "[ . 1 . 2]" 1
179 1 15 LEU MD2 1 30 VAL H 5.000 . 5.000 4.151 3.727 4.400 . 0 0 "[ . 1 . 2]" 1
180 1 15 LEU MD2 1 50 PHE HZ 3.950 . 3.950 3.011 2.413 3.698 . 0 0 "[ . 1 . 2]" 1
181 1 15 LEU MD2 1 89 ILE MD 3.200 . 3.200 2.520 2.328 2.736 . 0 0 "[ . 1 . 2]" 1
182 1 15 LEU MD2 1 89 ILE QG 3.770 . 3.770 1.987 1.894 2.110 . 0 0 "[ . 1 . 2]" 1
183 1 15 LEU MD2 1 93 PRO HA 3.960 . 3.960 3.396 2.586 3.776 . 0 0 "[ . 1 . 2]" 1
184 1 16 ILE H 1 16 ILE MD 3.800 . 3.800 3.496 3.000 3.851 0.051 5 0 "[ . 1 . 2]" 1
185 1 16 ILE H 1 16 ILE HG12 3.920 . 3.920 3.225 2.510 3.926 0.006 15 0 "[ . 1 . 2]" 1
186 1 16 ILE H 1 16 ILE HG13 3.550 . 3.550 2.288 2.161 2.397 . 0 0 "[ . 1 . 2]" 1
187 1 16 ILE H 1 16 ILE MG 3.830 . 3.830 3.160 3.075 3.276 . 0 0 "[ . 1 . 2]" 1
188 1 16 ILE H 1 17 PHE H 4.810 . 4.810 4.271 4.233 4.313 . 0 0 "[ . 1 . 2]" 1
189 1 16 ILE H 1 28 ALA H 4.150 . 4.150 3.330 3.167 3.448 . 0 0 "[ . 1 . 2]" 1
190 1 16 ILE H 1 29 ARG HA 3.810 . 3.810 2.858 2.639 3.220 . 0 0 "[ . 1 . 2]" 1
191 1 16 ILE H 1 30 VAL H 4.480 . 4.480 4.142 3.863 4.291 . 0 0 "[ . 1 . 2]" 1
192 1 16 ILE H 1 65 PRO HA 5.500 . 5.500 4.936 4.545 5.447 . 0 0 "[ . 1 . 2]" 1
193 1 16 ILE H 1 89 ILE MD 3.950 . 3.950 2.949 2.451 3.406 . 0 0 "[ . 1 . 2]" 1
194 1 16 ILE HA 1 16 ILE MD 4.360 . 4.360 3.917 3.706 4.129 . 0 0 "[ . 1 . 2]" 1
195 1 16 ILE HA 1 16 ILE MG 3.260 . 3.260 2.312 2.276 2.381 . 0 0 "[ . 1 . 2]" 1
196 1 16 ILE HA 1 17 PHE H 3.400 . 3.400 2.481 2.414 2.532 . 0 0 "[ . 1 . 2]" 1
197 1 16 ILE HA 1 64 PHE H 4.980 . 4.980 4.490 4.225 4.754 . 0 0 "[ . 1 . 2]" 1
198 1 16 ILE HA 1 65 PRO HA 3.840 . 3.840 2.346 1.937 2.779 . 0 0 "[ . 1 . 2]" 1
199 1 16 ILE HA 1 65 PRO HB3 5.190 . 5.190 4.612 4.115 5.076 . 0 0 "[ . 1 . 2]" 1
200 1 16 ILE HA 1 66 TYR H 3.450 . 3.450 1.975 1.818 2.117 . 0 0 "[ . 1 . 2]" 1
201 1 16 ILE HA 1 66 TYR HA 4.470 . 4.470 3.615 3.340 3.887 . 0 0 "[ . 1 . 2]" 1
202 1 16 ILE HA 1 66 TYR HB2 4.730 . 4.730 3.013 2.464 3.446 . 0 0 "[ . 1 . 2]" 1
203 1 16 ILE HA 1 66 TYR HB3 4.320 . 4.320 3.606 3.091 4.025 . 0 0 "[ . 1 . 2]" 1
204 1 16 ILE HA 1 67 SER H 5.080 . 5.080 4.617 4.355 4.832 . 0 0 "[ . 1 . 2]" 1
205 1 16 ILE HA 1 89 ILE MD 5.250 . 5.250 4.405 4.018 4.769 . 0 0 "[ . 1 . 2]" 1
206 1 16 ILE HB 1 16 ILE MD 3.370 . 3.370 2.296 2.227 2.383 . 0 0 "[ . 1 . 2]" 1
207 1 16 ILE HB 1 17 PHE H 3.360 . 3.360 1.906 1.777 2.085 . 0 0 "[ . 1 . 2]" 1
208 1 16 ILE HB 1 17 PHE HA 4.640 . 4.640 4.178 4.011 4.384 . 0 0 "[ . 1 . 2]" 1
209 1 16 ILE HB 1 17 PHE QB 4.780 . 4.780 4.121 3.973 4.301 . 0 0 "[ . 1 . 2]" 1
210 1 16 ILE HB 1 63 ILE HB 4.600 . 4.600 2.502 2.200 2.830 . 0 0 "[ . 1 . 2]" 1
211 1 16 ILE HB 1 63 ILE MG 4.160 . 4.160 3.610 3.425 3.744 . 0 0 "[ . 1 . 2]" 1
212 1 16 ILE HB 1 64 PHE H 3.730 . 3.730 2.854 2.646 3.157 . 0 0 "[ . 1 . 2]" 1
213 1 16 ILE HB 1 64 PHE HA 5.080 . 5.080 4.621 4.420 4.829 . 0 0 "[ . 1 . 2]" 1
214 1 16 ILE HB 1 66 TYR H 4.720 . 4.720 4.369 4.169 4.550 . 0 0 "[ . 1 . 2]" 1
215 1 16 ILE MD 1 17 PHE H 4.080 . 4.080 3.187 2.884 3.478 . 0 0 "[ . 1 . 2]" 1
216 1 16 ILE MD 1 17 PHE QB 4.630 . 4.630 4.409 4.050 4.721 0.091 10 0 "[ . 1 . 2]" 1
217 1 16 ILE MD 1 18 ALA H 4.490 . 4.490 3.558 3.007 4.214 . 0 0 "[ . 1 . 2]" 1
218 1 16 ILE MD 1 18 ALA HA 4.540 . 4.540 3.020 2.769 3.315 . 0 0 "[ . 1 . 2]" 1
219 1 16 ILE MD 1 18 ALA MB 3.060 . 3.060 2.360 1.957 2.876 . 0 0 "[ . 1 . 2]" 1
220 1 16 ILE MD 1 28 ALA H 4.490 . 4.490 3.544 2.731 4.396 . 0 0 "[ . 1 . 2]" 1
221 1 16 ILE MD 1 28 ALA HA 5.500 . 5.500 4.546 4.080 5.025 . 0 0 "[ . 1 . 2]" 1
222 1 16 ILE MD 1 28 ALA MB 3.520 . 3.520 2.346 1.960 2.763 . 0 0 "[ . 1 . 2]" 1
223 1 16 ILE MD 1 29 ARG H 5.150 . 5.150 4.059 3.840 4.364 . 0 0 "[ . 1 . 2]" 1
224 1 16 ILE MD 1 30 VAL H 4.320 . 4.320 3.893 3.432 4.346 0.026 9 0 "[ . 1 . 2]" 1
225 1 16 ILE MD 1 30 VAL HA 4.290 . 4.290 3.756 3.275 4.299 0.009 4 0 "[ . 1 . 2]" 1
226 1 16 ILE MD 1 30 VAL MG2 3.350 . 3.350 2.706 2.014 3.371 0.021 19 0 "[ . 1 . 2]" 1
227 1 16 ILE MD 1 47 ILE MD 2.840 . 2.840 1.974 1.853 2.159 . 0 0 "[ . 1 . 2]" 1
228 1 16 ILE MD 1 47 ILE MG 3.020 . 3.020 2.083 1.926 2.364 . 0 0 "[ . 1 . 2]" 1
229 1 16 ILE MD 1 48 PHE H 5.070 . 5.070 4.481 4.298 4.949 . 0 0 "[ . 1 . 2]" 1
230 1 16 ILE MD 1 63 ILE H 5.210 . 5.210 5.223 5.086 5.285 0.075 9 0 "[ . 1 . 2]" 1
231 1 16 ILE MD 1 63 ILE HA 4.280 . 4.280 3.594 3.371 3.913 . 0 0 "[ . 1 . 2]" 1
232 1 16 ILE MD 1 63 ILE HB 3.440 . 3.440 2.310 2.151 2.421 . 0 0 "[ . 1 . 2]" 1
233 1 16 ILE MD 1 63 ILE MD 3.260 . 3.260 2.785 2.069 3.317 0.057 13 0 "[ . 1 . 2]" 1
234 1 16 ILE MD 1 63 ILE MG 2.920 . 2.920 2.021 1.922 2.117 . 0 0 "[ . 1 . 2]" 1
235 1 16 ILE MD 1 64 PHE H 4.140 . 4.140 3.663 3.410 3.926 . 0 0 "[ . 1 . 2]" 1
236 1 16 ILE HG12 1 16 ILE MG 2.910 . 2.910 2.175 2.084 2.245 . 0 0 "[ . 1 . 2]" 1
237 1 16 ILE HG12 1 17 PHE H 4.590 . 4.590 4.433 4.344 4.574 . 0 0 "[ . 1 . 2]" 1
238 1 16 ILE HG12 1 29 ARG HA 4.580 . 4.580 3.662 2.617 4.606 0.026 16 0 "[ . 1 . 2]" 1
239 1 16 ILE HG13 1 16 ILE MG 3.160 . 3.160 2.863 2.539 3.171 0.011 12 0 "[ . 1 . 2]" 1
240 1 16 ILE HG13 1 17 PHE H 4.200 . 4.200 3.863 3.442 4.249 0.049 1 0 "[ . 1 . 2]" 1
241 1 16 ILE HG13 1 29 ARG HA 4.120 . 4.120 3.183 2.626 3.790 . 0 0 "[ . 1 . 2]" 1
242 1 16 ILE HG13 1 64 PHE H 5.500 . 5.500 5.415 5.138 5.586 0.086 2 0 "[ . 1 . 2]" 1
243 1 16 ILE MG 1 17 PHE H 3.720 . 3.720 3.322 3.224 3.468 . 0 0 "[ . 1 . 2]" 1
244 1 16 ILE MG 1 30 VAL H 4.230 . 4.230 3.840 3.607 4.067 . 0 0 "[ . 1 . 2]" 1
245 1 16 ILE MG 1 30 VAL HB 4.500 . 4.500 4.439 4.251 4.531 0.031 13 0 "[ . 1 . 2]" 1
246 1 16 ILE MG 1 30 VAL MG2 3.390 . 3.390 2.399 2.249 2.675 . 0 0 "[ . 1 . 2]" 1
247 1 16 ILE MG 1 63 ILE HB 4.510 . 4.510 2.945 2.635 3.172 . 0 0 "[ . 1 . 2]" 1
248 1 16 ILE MG 1 63 ILE MD 3.500 . 3.500 2.577 2.046 2.980 . 0 0 "[ . 1 . 2]" 1
249 1 16 ILE MG 1 64 PHE H 4.440 . 4.440 3.863 3.649 4.038 . 0 0 "[ . 1 . 2]" 1
250 1 16 ILE MG 1 65 PRO HA 3.460 . 3.460 2.060 1.909 2.225 . 0 0 "[ . 1 . 2]" 1
251 1 16 ILE MG 1 65 PRO HB3 4.590 . 4.590 3.368 2.840 3.727 . 0 0 "[ . 1 . 2]" 1
252 1 16 ILE MG 1 66 TYR H 3.810 . 3.810 3.192 2.976 3.370 . 0 0 "[ . 1 . 2]" 1
253 1 16 ILE MG 1 67 SER H 5.250 . 5.250 5.133 4.822 5.277 0.027 7 0 "[ . 1 . 2]" 1
254 1 17 PHE H 1 17 PHE QD 4.390 . 4.390 3.228 3.023 3.371 . 0 0 "[ . 1 . 2]" 1
255 1 17 PHE H 1 18 ALA H 4.720 . 4.720 4.184 4.072 4.277 . 0 0 "[ . 1 . 2]" 1
256 1 17 PHE H 1 63 ILE HA 4.770 . 4.770 4.219 3.946 4.559 . 0 0 "[ . 1 . 2]" 1
257 1 17 PHE H 1 63 ILE HB 4.720 . 4.720 3.713 3.473 4.026 . 0 0 "[ . 1 . 2]" 1
258 1 17 PHE H 1 63 ILE MG 4.350 . 4.350 4.401 4.359 4.440 0.090 18 0 "[ . 1 . 2]" 1
259 1 17 PHE H 1 64 PHE H 3.830 . 3.830 2.516 2.347 2.818 . 0 0 "[ . 1 . 2]" 1
260 1 17 PHE H 1 64 PHE HB2 4.380 . 4.380 3.762 3.493 4.223 . 0 0 "[ . 1 . 2]" 1
261 1 17 PHE H 1 64 PHE HB3 5.180 . 5.180 4.850 4.533 5.194 0.014 17 0 "[ . 1 . 2]" 1
262 1 17 PHE H 1 65 PRO HA 4.870 . 4.870 3.889 3.608 4.201 . 0 0 "[ . 1 . 2]" 1
263 1 17 PHE H 1 66 TYR H 4.610 . 4.610 4.086 3.921 4.290 . 0 0 "[ . 1 . 2]" 1
264 1 17 PHE H 1 66 TYR HA 5.430 . 5.430 4.428 4.119 4.848 . 0 0 "[ . 1 . 2]" 1
265 1 17 PHE HA 1 17 PHE QD 3.990 . 3.990 2.780 2.615 3.096 . 0 0 "[ . 1 . 2]" 1
266 1 17 PHE HA 1 18 ALA H 3.140 . 3.140 2.074 2.044 2.124 . 0 0 "[ . 1 . 2]" 1
267 1 17 PHE HA 1 18 ALA MB 4.360 . 4.360 3.745 3.654 3.810 . 0 0 "[ . 1 . 2]" 1
268 1 17 PHE HA 1 26 TRP H 5.360 . 5.360 4.139 3.904 4.405 . 0 0 "[ . 1 . 2]" 1
269 1 17 PHE HA 1 27 PRO HA 4.050 . 4.050 2.622 2.425 2.774 . 0 0 "[ . 1 . 2]" 1
270 1 17 PHE HA 1 28 ALA H 4.020 . 4.020 2.766 2.563 2.972 . 0 0 "[ . 1 . 2]" 1
271 1 17 PHE HA 1 28 ALA MB 4.160 . 4.160 3.556 3.327 3.745 . 0 0 "[ . 1 . 2]" 1
272 1 17 PHE QB 1 18 ALA H 3.950 . 3.950 3.056 2.941 3.239 . 0 0 "[ . 1 . 2]" 1
273 1 17 PHE QB 1 25 HIS HA 4.630 . 4.630 3.584 3.351 3.910 . 0 0 "[ . 1 . 2]" 1
274 1 17 PHE QB 1 25 HIS HB2 4.550 . 4.550 3.539 3.291 3.794 . 0 0 "[ . 1 . 2]" 1
275 1 17 PHE QB 1 25 HIS HB3 4.250 . 4.250 1.983 1.865 2.260 . 0 0 "[ . 1 . 2]" 1
276 1 17 PHE QB 1 25 HIS HD2 4.630 . 4.630 3.101 2.597 3.547 . 0 0 "[ . 1 . 2]" 1
277 1 17 PHE QB 1 26 TRP H 4.600 . 4.600 3.646 3.372 3.892 . 0 0 "[ . 1 . 2]" 1
278 1 17 PHE QB 1 27 PRO HA 4.940 . 4.940 4.199 4.003 4.454 . 0 0 "[ . 1 . 2]" 1
279 1 17 PHE QB 1 63 ILE MG 5.070 . 5.070 4.937 4.722 5.080 0.010 19 0 "[ . 1 . 2]" 1
280 1 17 PHE QB 1 64 PHE H 4.290 . 4.290 3.101 2.796 3.348 . 0 0 "[ . 1 . 2]" 1
281 1 17 PHE QB 1 64 PHE HA 5.020 . 5.020 4.877 4.573 5.067 0.047 7 0 "[ . 1 . 2]" 1
282 1 17 PHE QB 1 64 PHE HB3 4.600 . 4.600 4.079 3.529 4.417 . 0 0 "[ . 1 . 2]" 1
283 1 17 PHE QB 1 64 PHE QD 4.390 . 4.390 3.619 3.276 4.246 . 0 0 "[ . 1 . 2]" 1
284 1 17 PHE QB 1 73 TYR QD 4.590 . 4.590 3.457 2.740 4.010 . 0 0 "[ . 1 . 2]" 1
285 1 17 PHE QD 1 18 ALA H 4.590 . 4.590 3.757 3.562 4.076 . 0 0 "[ . 1 . 2]" 1
286 1 17 PHE QD 1 25 HIS HB2 5.270 . 5.270 4.007 3.361 4.693 . 0 0 "[ . 1 . 2]" 1
287 1 17 PHE QD 1 26 TRP H 4.660 . 4.660 3.850 3.506 4.364 . 0 0 "[ . 1 . 2]" 1
288 1 17 PHE QD 1 27 PRO HA 4.410 . 4.410 2.976 2.432 3.438 . 0 0 "[ . 1 . 2]" 1
289 1 17 PHE QD 1 27 PRO HD2 5.110 . 5.110 4.377 4.132 4.720 . 0 0 "[ . 1 . 2]" 1
290 1 17 PHE QD 1 27 PRO HD3 5.000 . 5.000 3.173 2.896 3.433 . 0 0 "[ . 1 . 2]" 1
291 1 17 PHE QD 1 66 TYR HA 3.650 . 3.650 2.400 1.965 3.120 . 0 0 "[ . 1 . 2]" 1
292 1 17 PHE QD 1 66 TYR QD 4.510 . 4.510 3.833 3.509 4.424 . 0 0 "[ . 1 . 2]" 1
293 1 17 PHE QD 1 69 ASN H 4.690 . 4.690 4.261 4.019 4.697 0.007 14 0 "[ . 1 . 2]" 1
294 1 17 PHE QD 1 69 ASN QB 3.930 . 3.930 2.391 2.064 3.646 . 0 0 "[ . 1 . 2]" 1
295 1 17 PHE QD 1 69 ASN QD 5.050 . 5.050 3.810 3.335 4.850 . 0 0 "[ . 1 . 2]" 1
296 1 17 PHE QD 1 73 TYR HB2 4.590 . 4.590 3.260 2.962 3.547 . 0 0 "[ . 1 . 2]" 1
297 1 17 PHE QD 1 73 TYR HB3 4.530 . 4.530 3.614 3.349 3.900 . 0 0 "[ . 1 . 2]" 1
298 1 17 PHE QD 1 73 TYR QD 4.510 . 4.510 3.331 2.387 4.353 . 0 0 "[ . 1 . 2]" 1
299 1 17 PHE QE 1 27 PRO HD2 4.940 . 4.940 4.497 4.075 4.892 . 0 0 "[ . 1 . 2]" 1
300 1 17 PHE QE 1 27 PRO HD3 4.790 . 4.790 2.844 2.331 3.607 . 0 0 "[ . 1 . 2]" 1
301 1 17 PHE QE 1 66 TYR HA 3.900 . 3.900 2.120 1.961 2.277 . 0 0 "[ . 1 . 2]" 1
302 1 17 PHE QE 1 66 TYR QD 4.350 . 4.350 2.731 1.968 3.121 . 0 0 "[ . 1 . 2]" 1
303 1 17 PHE QE 1 66 TYR QE 4.470 . 4.470 3.679 3.195 4.277 . 0 0 "[ . 1 . 2]" 1
304 1 17 PHE QE 1 69 ASN QB 4.280 . 4.280 2.819 2.154 4.089 . 0 0 "[ . 1 . 2]" 1
305 1 17 PHE QE 1 70 LYS H 4.310 . 4.310 3.501 3.198 4.241 . 0 0 "[ . 1 . 2]" 1
306 1 17 PHE QE 1 70 LYS HA 3.640 . 3.640 2.660 2.173 3.564 . 0 0 "[ . 1 . 2]" 1
307 1 17 PHE QE 1 70 LYS QB 4.830 . 4.830 3.559 2.893 4.413 . 0 0 "[ . 1 . 2]" 1
308 1 17 PHE QE 1 74 GLY H 5.040 . 5.040 3.987 3.706 4.437 . 0 0 "[ . 1 . 2]" 1
309 1 17 PHE QE 1 74 GLY HA2 4.280 . 4.280 2.872 2.332 3.638 . 0 0 "[ . 1 . 2]" 1
310 1 17 PHE QE 1 74 GLY HA3 4.710 . 4.710 3.900 3.312 4.294 . 0 0 "[ . 1 . 2]" 1
311 1 17 PHE QE 1 86 LEU QD 3.860 . 3.860 3.098 2.539 3.502 . 0 0 "[ . 1 . 2]" 1
312 1 17 PHE HZ 1 66 TYR QD 4.350 . 4.350 2.833 2.260 3.440 . 0 0 "[ . 1 . 2]" 1
313 1 17 PHE HZ 1 66 TYR QE 4.040 . 4.040 3.158 2.753 3.955 . 0 0 "[ . 1 . 2]" 1
314 1 17 PHE HZ 1 70 LYS HA 4.060 . 4.060 2.555 2.072 3.716 . 0 0 "[ . 1 . 2]" 1
315 1 17 PHE HZ 1 70 LYS QB 5.500 . 5.500 3.971 3.308 5.427 . 0 0 "[ . 1 . 2]" 1
316 1 17 PHE HZ 1 74 GLY HA2 4.070 . 4.070 2.552 2.261 2.874 . 0 0 "[ . 1 . 2]" 1
317 1 17 PHE HZ 1 74 GLY HA3 3.990 . 3.990 2.821 2.310 3.451 . 0 0 "[ . 1 . 2]" 1
318 1 17 PHE HZ 1 86 LEU QD 4.100 . 4.100 3.573 2.614 4.102 0.002 19 0 "[ . 1 . 2]" 1
319 1 18 ALA H 1 18 ALA MB 3.250 . 3.250 2.257 2.197 2.347 . 0 0 "[ . 1 . 2]" 1
320 1 18 ALA H 1 19 LYS H 4.950 . 4.950 4.315 4.138 4.451 . 0 0 "[ . 1 . 2]" 1
321 1 18 ALA H 1 25 HIS HA 4.860 . 4.860 4.130 3.944 4.236 . 0 0 "[ . 1 . 2]" 1
322 1 18 ALA H 1 25 HIS HB3 4.850 . 4.850 4.388 4.157 4.575 . 0 0 "[ . 1 . 2]" 1
323 1 18 ALA H 1 26 TRP H 3.720 . 3.720 2.751 2.642 2.849 . 0 0 "[ . 1 . 2]" 1
324 1 18 ALA H 1 26 TRP HB2 5.240 . 5.240 4.586 4.376 4.847 . 0 0 "[ . 1 . 2]" 1
325 1 18 ALA H 1 26 TRP HB3 4.400 . 4.400 3.388 3.221 3.655 . 0 0 "[ . 1 . 2]" 1
326 1 18 ALA H 1 27 PRO HA 4.770 . 4.770 3.922 3.733 4.086 . 0 0 "[ . 1 . 2]" 1
327 1 18 ALA H 1 28 ALA H 4.140 . 4.140 3.694 3.593 3.849 . 0 0 "[ . 1 . 2]" 1
328 1 18 ALA H 1 28 ALA MB 3.700 . 3.700 3.010 2.808 3.219 . 0 0 "[ . 1 . 2]" 1
329 1 18 ALA H 1 47 ILE MG 4.400 . 4.400 4.295 4.205 4.408 0.008 15 0 "[ . 1 . 2]" 1
330 1 18 ALA H 1 49 PHE QD 4.730 . 4.730 4.616 4.318 4.764 0.034 2 0 "[ . 1 . 2]" 1
331 1 18 ALA H 1 64 PHE H 5.500 . 5.500 5.061 4.932 5.204 . 0 0 "[ . 1 . 2]" 1
332 1 18 ALA HA 1 19 LYS H 3.200 . 3.200 2.130 2.040 2.209 . 0 0 "[ . 1 . 2]" 1
333 1 18 ALA HA 1 19 LYS HB3 4.900 . 4.900 4.363 4.195 4.514 . 0 0 "[ . 1 . 2]" 1
334 1 18 ALA HA 1 58 LEU MD1 4.140 . 4.140 2.774 2.509 3.167 . 0 0 "[ . 1 . 2]" 1
335 1 18 ALA HA 1 63 ILE HA 3.800 . 3.800 2.783 2.410 3.179 . 0 0 "[ . 1 . 2]" 1
336 1 18 ALA HA 1 63 ILE HB 4.750 . 4.750 3.858 3.578 4.246 . 0 0 "[ . 1 . 2]" 1
337 1 18 ALA HA 1 63 ILE MD 5.500 . 5.500 5.030 4.859 5.246 . 0 0 "[ . 1 . 2]" 1
338 1 18 ALA HA 1 63 ILE MG 3.550 . 3.550 2.051 1.910 2.235 . 0 0 "[ . 1 . 2]" 1
339 1 18 ALA HA 1 64 PHE H 4.990 . 4.990 4.022 3.680 4.464 . 0 0 "[ . 1 . 2]" 1
340 1 18 ALA HA 1 64 PHE QD 5.500 . 5.500 5.023 4.455 5.513 0.013 11 0 "[ . 1 . 2]" 1
341 1 18 ALA MB 1 19 LYS H 3.420 . 3.420 3.047 2.712 3.241 . 0 0 "[ . 1 . 2]" 1
342 1 18 ALA MB 1 19 LYS HA 4.210 . 4.210 4.136 4.042 4.219 0.009 2 0 "[ . 1 . 2]" 1
343 1 18 ALA MB 1 20 MET H 5.230 . 5.230 4.733 4.534 4.938 . 0 0 "[ . 1 . 2]" 1
344 1 18 ALA MB 1 20 MET HG3 3.880 . 3.880 3.665 3.501 3.903 0.023 18 0 "[ . 1 . 2]" 1
345 1 18 ALA MB 1 25 HIS HA 5.130 . 5.130 4.713 4.558 4.815 . 0 0 "[ . 1 . 2]" 1
346 1 18 ALA MB 1 26 TRP H 4.160 . 4.160 3.491 3.292 3.772 . 0 0 "[ . 1 . 2]" 1
347 1 18 ALA MB 1 26 TRP HB2 4.900 . 4.900 4.275 3.901 4.847 . 0 0 "[ . 1 . 2]" 1
348 1 18 ALA MB 1 26 TRP HB3 4.990 . 4.990 2.963 2.575 3.601 . 0 0 "[ . 1 . 2]" 1
349 1 18 ALA MB 1 27 PRO HA 5.260 . 5.260 5.003 4.746 5.265 0.005 6 0 "[ . 1 . 2]" 1
350 1 18 ALA MB 1 28 ALA H 4.330 . 4.330 4.092 3.906 4.229 . 0 0 "[ . 1 . 2]" 1
351 1 18 ALA MB 1 28 ALA MB 2.910 . 2.910 2.064 1.954 2.182 . 0 0 "[ . 1 . 2]" 1
352 1 18 ALA MB 1 47 ILE HB 4.750 . 4.750 3.751 3.616 3.892 . 0 0 "[ . 1 . 2]" 1
353 1 18 ALA MB 1 47 ILE MD 3.380 . 3.380 3.312 3.016 3.412 0.032 4 0 "[ . 1 . 2]" 1
354 1 18 ALA MB 1 47 ILE MG 2.940 . 2.940 1.815 1.738 1.873 . 0 0 "[ . 1 . 2]" 1
355 1 18 ALA MB 1 49 PHE QD 4.500 . 4.500 3.210 2.850 3.678 . 0 0 "[ . 1 . 2]" 1
356 1 18 ALA MB 1 49 PHE QE 3.330 . 3.330 2.070 1.951 2.364 . 0 0 "[ . 1 . 2]" 1
357 1 18 ALA MB 1 49 PHE HZ 3.530 . 3.530 2.961 2.339 3.466 . 0 0 "[ . 1 . 2]" 1
358 1 18 ALA MB 1 58 LEU MD1 3.210 . 3.210 1.836 1.769 1.940 . 0 0 "[ . 1 . 2]" 1
359 1 18 ALA MB 1 63 ILE MG 3.270 . 3.270 2.614 2.073 3.055 . 0 0 "[ . 1 . 2]" 1
360 1 19 LYS H 1 19 LYS HB2 3.810 . 3.810 2.805 2.701 2.928 . 0 0 "[ . 1 . 2]" 1
361 1 19 LYS H 1 19 LYS HB3 3.630 . 3.630 2.409 2.247 2.541 . 0 0 "[ . 1 . 2]" 1
362 1 19 LYS H 1 19 LYS HD2 4.660 . 4.660 4.201 3.923 4.679 0.019 9 0 "[ . 1 . 2]" 1
363 1 19 LYS H 1 19 LYS HD3 5.490 . 5.490 5.327 4.484 5.581 0.091 18 0 "[ . 1 . 2]" 1
364 1 19 LYS H 1 19 LYS QG 4.520 . 4.520 4.084 4.016 4.164 . 0 0 "[ . 1 . 2]" 1
365 1 19 LYS H 1 20 MET H 4.650 . 4.650 4.251 4.109 4.345 . 0 0 "[ . 1 . 2]" 1
366 1 19 LYS H 1 58 LEU MD1 3.810 . 3.810 2.286 1.938 2.576 . 0 0 "[ . 1 . 2]" 1
367 1 19 LYS H 1 62 ASP HA 5.360 . 5.360 4.723 4.420 5.245 . 0 0 "[ . 1 . 2]" 1
368 1 19 LYS H 1 62 ASP HB2 4.860 . 4.860 4.671 4.420 4.883 0.023 2 0 "[ . 1 . 2]" 1
369 1 19 LYS H 1 62 ASP HB3 4.030 . 4.030 3.548 3.078 4.058 0.028 4 0 "[ . 1 . 2]" 1
370 1 19 LYS H 1 63 ILE H 5.500 . 5.500 5.180 4.912 5.513 0.013 4 0 "[ . 1 . 2]" 1
371 1 19 LYS H 1 63 ILE HA 4.120 . 4.120 3.353 3.022 3.632 . 0 0 "[ . 1 . 2]" 1
372 1 19 LYS H 1 63 ILE MG 4.310 . 4.310 3.219 2.931 3.391 . 0 0 "[ . 1 . 2]" 1
373 1 19 LYS H 1 64 PHE QE 5.470 . 5.470 5.393 4.837 5.513 0.043 6 0 "[ . 1 . 2]" 1
374 1 19 LYS HA 1 19 LYS HD2 4.090 . 4.090 3.385 3.137 4.111 0.021 19 0 "[ . 1 . 2]" 1
375 1 19 LYS HA 1 19 LYS HD3 4.010 . 4.010 3.886 3.034 4.182 0.172 15 0 "[ . 1 . 2]" 1
376 1 19 LYS HA 1 20 MET H 3.160 . 3.160 2.106 2.028 2.171 . 0 0 "[ . 1 . 2]" 1
377 1 19 LYS HA 1 25 HIS HA 4.050 . 4.050 2.553 2.298 2.804 . 0 0 "[ . 1 . 2]" 1
378 1 19 LYS HA 1 26 TRP H 4.590 . 4.590 3.381 3.239 3.629 . 0 0 "[ . 1 . 2]" 1
379 1 19 LYS HB2 1 20 MET H 4.680 . 4.680 4.336 4.185 4.464 . 0 0 "[ . 1 . 2]" 1
380 1 19 LYS HB2 1 25 HIS H 5.500 . 5.500 4.645 4.000 5.483 . 0 0 "[ . 1 . 2]" 1
381 1 19 LYS HB2 1 25 HIS HD2 4.330 . 4.330 2.422 2.210 2.745 . 0 0 "[ . 1 . 2]" 1
382 1 19 LYS HB2 1 64 PHE QE 4.410 . 4.410 3.968 3.092 4.430 0.020 6 0 "[ . 1 . 2]" 1
383 1 19 LYS HB3 1 25 HIS HD2 4.730 . 4.730 3.744 3.353 4.041 . 0 0 "[ . 1 . 2]" 1
384 1 19 LYS HB3 1 58 LEU MD1 3.920 . 3.920 3.786 3.576 3.950 0.030 15 0 "[ . 1 . 2]" 1
385 1 19 LYS HB3 1 62 ASP HA 4.300 . 4.300 3.756 3.363 4.273 . 0 0 "[ . 1 . 2]" 1
386 1 19 LYS HB3 1 62 ASP HB3 4.580 . 4.580 3.484 3.177 4.132 . 0 0 "[ . 1 . 2]" 1
387 1 19 LYS HB3 1 63 ILE MG 5.390 . 5.390 4.797 4.537 5.053 . 0 0 "[ . 1 . 2]" 1
388 1 19 LYS HB3 1 64 PHE QE 4.570 . 4.570 3.992 3.326 4.468 . 0 0 "[ . 1 . 2]" 1
389 1 19 LYS HD2 1 20 MET H 4.420 . 4.420 3.296 2.911 4.435 0.015 9 0 "[ . 1 . 2]" 1
390 1 19 LYS HD2 1 58 LEU MD2 4.190 . 4.190 4.341 4.220 4.398 0.208 4 0 "[ . 1 . 2]" 1
391 1 19 LYS HD3 1 20 MET H 3.880 . 3.880 3.705 2.836 3.926 0.046 2 0 "[ . 1 . 2]" 1
392 1 19 LYS HD3 1 25 HIS HA 5.500 . 5.500 5.584 5.388 5.670 0.170 7 0 "[ . 1 . 2]" 1
393 1 19 LYS QE 1 19 LYS QG 3.220 . 3.220 2.287 2.218 2.349 . 0 0 "[ . 1 . 2]" 1
394 1 19 LYS QE 1 25 HIS HE1 4.400 . 4.400 4.441 4.406 4.471 0.071 19 0 "[ . 1 . 2]" 1
395 1 19 LYS QG 1 20 MET H 4.490 . 4.490 3.282 2.848 3.579 . 0 0 "[ . 1 . 2]" 1
396 1 19 LYS QG 1 25 HIS HD2 4.900 . 4.900 3.698 3.412 4.024 . 0 0 "[ . 1 . 2]" 1
397 1 19 LYS QG 1 25 HIS HE1 4.240 . 4.240 3.145 2.841 3.542 . 0 0 "[ . 1 . 2]" 1
398 1 19 LYS HG2 1 25 HIS HE1 4.870 . 4.870 4.245 3.902 4.801 . 0 0 "[ . 1 . 2]" 1
399 1 19 LYS HG3 1 25 HIS HE1 4.870 . 4.870 3.261 2.919 3.852 . 0 0 "[ . 1 . 2]" 1
400 1 20 MET H 1 20 MET HB2 3.580 . 3.580 2.627 2.475 2.787 . 0 0 "[ . 1 . 2]" 1
401 1 20 MET H 1 20 MET HB3 3.850 . 3.850 3.758 3.645 3.846 . 0 0 "[ . 1 . 2]" 1
402 1 20 MET H 1 20 MET HG2 3.850 . 3.850 3.851 3.620 3.896 0.046 7 0 "[ . 1 . 2]" 1
403 1 20 MET H 1 20 MET HG3 3.950 . 3.950 3.029 2.733 3.199 . 0 0 "[ . 1 . 2]" 1
404 1 20 MET H 1 23 TYR H 4.850 . 4.850 3.885 3.631 4.163 . 0 0 "[ . 1 . 2]" 1
405 1 20 MET H 1 23 TYR HB2 4.230 . 4.230 2.626 2.155 3.214 . 0 0 "[ . 1 . 2]" 1
406 1 20 MET H 1 23 TYR HB3 5.130 . 5.130 3.570 2.890 4.265 . 0 0 "[ . 1 . 2]" 1
407 1 20 MET H 1 25 HIS HA 4.470 . 4.470 4.343 4.029 4.518 0.048 14 0 "[ . 1 . 2]" 1
408 1 20 MET H 1 26 TRP H 4.950 . 4.950 4.717 4.502 4.957 0.007 17 0 "[ . 1 . 2]" 1
409 1 20 MET H 1 58 LEU MD2 5.500 . 5.500 4.622 4.287 4.823 . 0 0 "[ . 1 . 2]" 1
410 1 20 MET HA 1 20 MET ME 4.470 . 4.470 4.427 3.937 4.480 0.010 14 0 "[ . 1 . 2]" 1
411 1 20 MET HA 1 20 MET HG2 3.690 . 3.690 2.458 2.371 2.617 . 0 0 "[ . 1 . 2]" 1
412 1 20 MET HA 1 20 MET HG3 3.850 . 3.850 3.231 3.110 3.428 . 0 0 "[ . 1 . 2]" 1
413 1 20 MET HA 1 21 LYS H 2.730 . 2.730 2.341 2.293 2.384 . 0 0 "[ . 1 . 2]" 1
414 1 20 MET HA 1 21 LYS HA 4.550 . 4.550 4.296 4.249 4.356 . 0 0 "[ . 1 . 2]" 1
415 1 20 MET HA 1 58 LEU MD2 3.610 . 3.610 2.770 2.171 3.026 . 0 0 "[ . 1 . 2]" 1
416 1 20 MET HB2 1 20 MET ME 3.010 . 3.010 2.157 2.053 2.835 . 0 0 "[ . 1 . 2]" 1
417 1 20 MET HB2 1 23 TYR H 4.070 . 4.070 3.690 3.104 3.826 . 0 0 "[ . 1 . 2]" 1
418 1 20 MET HB2 1 23 TYR HB2 4.370 . 4.370 2.045 1.884 2.246 . 0 0 "[ . 1 . 2]" 1
419 1 20 MET HB2 1 23 TYR HB3 4.550 . 4.550 3.458 3.194 3.718 . 0 0 "[ . 1 . 2]" 1
420 1 20 MET HB2 1 23 TYR QD 4.240 . 4.240 2.661 2.276 2.881 . 0 0 "[ . 1 . 2]" 1
421 1 20 MET HB2 1 23 TYR QE 5.400 . 5.400 4.408 4.112 5.031 . 0 0 "[ . 1 . 2]" 1
422 1 20 MET HB2 1 49 PHE HZ 5.110 . 5.110 4.219 3.859 4.582 . 0 0 "[ . 1 . 2]" 1
423 1 20 MET HB3 1 20 MET ME 3.060 . 3.060 2.706 2.022 2.806 . 0 0 "[ . 1 . 2]" 1
424 1 20 MET HB3 1 21 LYS H 3.420 . 3.420 2.450 2.392 2.551 . 0 0 "[ . 1 . 2]" 1
425 1 20 MET HB3 1 23 TYR HB2 4.450 . 4.450 3.565 3.318 3.767 . 0 0 "[ . 1 . 2]" 1
426 1 20 MET HB3 1 23 TYR HB3 5.370 . 5.370 5.129 4.821 5.373 0.003 16 0 "[ . 1 . 2]" 1
427 1 20 MET HB3 1 23 TYR QD 4.170 . 4.170 3.172 2.649 3.734 . 0 0 "[ . 1 . 2]" 1
428 1 20 MET HB3 1 49 PHE HZ 5.150 . 5.150 4.779 4.579 4.945 . 0 0 "[ . 1 . 2]" 1
429 1 20 MET ME 1 20 MET HG2 3.400 . 3.400 3.362 2.538 3.412 0.012 11 0 "[ . 1 . 2]" 1
430 1 20 MET ME 1 21 LYS H 4.810 . 4.810 4.759 3.910 4.854 0.044 16 0 "[ . 1 . 2]" 1
431 1 20 MET ME 1 23 TYR H 4.760 . 4.760 4.771 4.605 4.815 0.055 17 0 "[ . 1 . 2]" 1
432 1 20 MET ME 1 23 TYR QD 3.760 . 3.760 2.624 2.069 2.950 . 0 0 "[ . 1 . 2]" 1
433 1 20 MET ME 1 23 TYR QE 3.750 . 3.750 3.011 2.691 3.459 . 0 0 "[ . 1 . 2]" 1
434 1 20 MET ME 1 49 PHE QE 3.570 . 3.570 3.008 2.641 3.615 0.045 17 0 "[ . 1 . 2]" 1
435 1 20 MET ME 1 49 PHE HZ 3.740 . 3.740 2.846 2.314 3.741 0.001 17 0 "[ . 1 . 2]" 1
436 1 20 MET HG2 1 21 LYS H 4.120 . 4.120 4.022 3.831 4.138 0.018 18 0 "[ . 1 . 2]" 1
437 1 20 MET HG2 1 23 TYR QD 5.210 . 5.210 5.194 4.609 5.309 0.099 18 0 "[ . 1 . 2]" 1
438 1 20 MET HG2 1 49 PHE QE 4.440 . 4.440 4.162 3.720 4.456 0.016 4 0 "[ . 1 . 2]" 1
439 1 20 MET HG2 1 49 PHE HZ 4.070 . 4.070 3.095 2.777 3.297 . 0 0 "[ . 1 . 2]" 1
440 1 20 MET HG2 1 58 LEU MD1 4.150 . 4.150 2.467 2.065 2.730 . 0 0 "[ . 1 . 2]" 1
441 1 20 MET HG2 1 58 LEU MD2 3.290 . 3.290 2.180 1.880 2.680 . 0 0 "[ . 1 . 2]" 1
442 1 20 MET HG3 1 21 LYS H 5.170 . 5.170 4.894 4.774 4.974 . 0 0 "[ . 1 . 2]" 1
443 1 20 MET HG3 1 23 TYR QD 5.120 . 5.120 4.641 4.191 4.881 . 0 0 "[ . 1 . 2]" 1
444 1 20 MET HG3 1 49 PHE QD 5.270 . 5.270 5.144 4.635 5.341 0.071 17 0 "[ . 1 . 2]" 1
445 1 20 MET HG3 1 49 PHE HZ 4.010 . 4.010 2.133 1.942 2.543 . 0 0 "[ . 1 . 2]" 1
446 1 20 MET HG3 1 58 LEU MD1 3.580 . 3.580 2.669 2.457 2.933 . 0 0 "[ . 1 . 2]" 1
447 1 20 MET HG3 1 58 LEU MD2 4.370 . 4.370 3.538 3.392 3.832 . 0 0 "[ . 1 . 2]" 1
448 1 21 LYS H 1 21 LYS HB2 2.880 . 2.880 2.582 2.464 2.650 . 0 0 "[ . 1 . 2]" 1
449 1 21 LYS H 1 21 LYS HB3 2.880 . 2.880 2.483 2.389 2.569 . 0 0 "[ . 1 . 2]" 1
450 1 21 LYS H 1 21 LYS HG2 4.640 . 4.640 4.466 4.394 4.655 0.015 16 0 "[ . 1 . 2]" 1
451 1 21 LYS H 1 21 LYS HG3 4.640 . 4.640 4.503 4.439 4.544 . 0 0 "[ . 1 . 2]" 1
452 1 21 LYS H 1 22 GLY H 4.630 . 4.630 4.454 4.403 4.548 . 0 0 "[ . 1 . 2]" 1
453 1 21 LYS H 1 58 LEU MD1 5.500 . 5.500 5.386 4.910 5.522 0.022 11 0 "[ . 1 . 2]" 1
454 1 21 LYS H 1 58 LEU MD2 4.370 . 4.370 4.177 3.430 4.405 0.035 4 0 "[ . 1 . 2]" 1
455 1 21 LYS HA 1 21 LYS QD 4.040 . 4.040 3.878 2.170 4.164 0.124 11 0 "[ . 1 . 2]" 1
456 1 21 LYS HA 1 21 LYS HG2 3.860 . 3.860 3.197 2.809 3.823 . 0 0 "[ . 1 . 2]" 1
457 1 21 LYS HA 1 21 LYS HG3 3.860 . 3.860 2.695 2.529 3.124 . 0 0 "[ . 1 . 2]" 1
458 1 21 LYS HA 1 22 GLY H 3.080 . 3.080 2.162 2.048 2.227 . 0 0 "[ . 1 . 2]" 1
459 1 21 LYS HA 1 22 GLY HA2 4.520 . 4.520 4.395 4.358 4.430 . 0 0 "[ . 1 . 2]" 1
460 1 21 LYS HA 1 23 TYR H 4.020 . 4.020 3.446 3.232 3.636 . 0 0 "[ . 1 . 2]" 1
461 1 21 LYS QB 1 22 GLY H 3.900 . 3.900 3.866 3.689 3.909 0.009 12 0 "[ . 1 . 2]" 1
462 1 21 LYS HB2 1 22 GLY H 4.450 . 4.450 4.361 4.139 4.437 . 0 0 "[ . 1 . 2]" 1
463 1 21 LYS HB3 1 22 GLY H 4.450 . 4.450 4.320 4.124 4.402 . 0 0 "[ . 1 . 2]" 1
464 1 21 LYS QD 1 21 LYS QG 2.410 . 2.410 2.071 1.985 2.098 . 0 0 "[ . 1 . 2]" 1
465 1 21 LYS HG2 1 22 GLY H 4.340 . 4.340 3.557 3.172 4.467 0.127 16 0 "[ . 1 . 2]" 1
466 1 21 LYS HG3 1 22 GLY H 4.340 . 4.340 3.536 2.929 3.998 . 0 0 "[ . 1 . 2]" 1
467 1 22 GLY H 1 23 TYR H 3.630 . 3.630 2.406 2.289 2.913 . 0 0 "[ . 1 . 2]" 1
468 1 22 GLY HA2 1 23 TYR QD 5.320 . 5.320 4.804 4.408 5.268 . 0 0 "[ . 1 . 2]" 1
469 1 22 GLY HA3 1 23 TYR H 3.350 . 3.350 3.193 2.981 3.295 . 0 0 "[ . 1 . 2]" 1
470 1 22 GLY HA3 1 23 TYR QD 4.860 . 4.860 3.607 3.153 4.254 . 0 0 "[ . 1 . 2]" 1
471 1 22 GLY HA3 1 23 TYR QE 4.910 . 4.910 4.550 4.265 4.943 0.033 14 0 "[ . 1 . 2]" 1
472 1 23 TYR H 1 23 TYR HB2 3.260 . 3.260 2.495 2.284 2.677 . 0 0 "[ . 1 . 2]" 1
473 1 23 TYR H 1 23 TYR HB3 3.930 . 3.930 3.662 3.553 3.777 . 0 0 "[ . 1 . 2]" 1
474 1 23 TYR H 1 23 TYR QD 3.550 . 3.550 2.916 2.503 3.573 0.023 12 0 "[ . 1 . 2]" 1
475 1 23 TYR HA 1 23 TYR QD 4.120 . 4.120 3.001 2.456 3.156 . 0 0 "[ . 1 . 2]" 1
476 1 23 TYR HA 1 24 PRO HD2 3.420 . 3.420 2.462 2.222 2.951 . 0 0 "[ . 1 . 2]" 1
477 1 23 TYR HA 1 24 PRO HD3 3.510 . 3.510 2.202 1.915 2.411 . 0 0 "[ . 1 . 2]" 1
478 1 23 TYR HA 1 24 PRO HG2 4.600 . 4.600 4.487 4.378 4.585 . 0 0 "[ . 1 . 2]" 1
479 1 23 TYR HA 1 24 PRO HG3 4.600 . 4.600 4.331 3.986 4.532 . 0 0 "[ . 1 . 2]" 1
480 1 23 TYR HB2 1 24 PRO HD2 4.560 . 4.560 3.992 3.728 4.571 0.011 14 0 "[ . 1 . 2]" 1
481 1 23 TYR HB2 1 24 PRO HD3 4.860 . 4.860 4.742 4.400 4.874 0.014 19 0 "[ . 1 . 2]" 1
482 1 23 TYR HB3 1 24 PRO HD2 4.000 . 4.000 2.472 2.189 3.187 . 0 0 "[ . 1 . 2]" 1
483 1 23 TYR HB3 1 24 PRO HD3 4.000 . 4.000 3.652 3.232 3.902 . 0 0 "[ . 1 . 2]" 1
484 1 23 TYR QD 1 24 PRO HD2 4.420 . 4.420 2.858 2.375 3.454 . 0 0 "[ . 1 . 2]" 1
485 1 23 TYR QD 1 24 PRO HD3 4.090 . 4.090 3.954 3.345 4.120 0.030 13 0 "[ . 1 . 2]" 1
486 1 23 TYR QE 1 24 PRO HD2 5.390 . 5.390 5.002 4.469 5.427 0.037 13 0 "[ . 1 . 2]" 1
487 1 24 PRO HA 1 25 HIS H 3.150 . 3.150 2.461 2.397 2.520 . 0 0 "[ . 1 . 2]" 1
488 1 24 PRO QB 1 25 HIS H 3.150 . 3.150 2.539 2.456 2.662 . 0 0 "[ . 1 . 2]" 1
489 1 24 PRO HB2 1 25 HIS H 3.660 . 3.660 2.629 2.517 2.930 . 0 0 "[ . 1 . 2]" 1
490 1 24 PRO HB3 1 25 HIS H 3.660 . 3.660 3.459 3.029 3.639 . 0 0 "[ . 1 . 2]" 1
491 1 24 PRO QG 1 25 HIS H 5.030 . 5.030 4.170 3.998 4.492 . 0 0 "[ . 1 . 2]" 1
492 1 25 HIS H 1 25 HIS HB2 3.590 . 3.590 2.401 2.304 2.504 . 0 0 "[ . 1 . 2]" 1
493 1 25 HIS H 1 26 TRP H 4.930 . 4.930 4.390 4.334 4.471 . 0 0 "[ . 1 . 2]" 1
494 1 25 HIS H 1 73 TYR QE 5.150 . 5.150 4.970 4.375 5.196 0.046 8 0 "[ . 1 . 2]" 1
495 1 25 HIS HA 1 25 HIS HD2 4.750 . 4.750 3.416 3.265 3.820 . 0 0 "[ . 1 . 2]" 1
496 1 25 HIS HA 1 26 TRP H 3.140 . 3.140 2.189 2.048 2.312 . 0 0 "[ . 1 . 2]" 1
497 1 25 HIS HB2 1 26 TRP H 4.580 . 4.580 4.381 4.291 4.439 . 0 0 "[ . 1 . 2]" 1
498 1 25 HIS HB2 1 73 TYR QD 5.200 . 5.200 3.043 2.748 3.364 . 0 0 "[ . 1 . 2]" 1
499 1 25 HIS HB2 1 73 TYR QE 4.730 . 4.730 4.024 3.743 4.442 . 0 0 "[ . 1 . 2]" 1
500 1 25 HIS HB3 1 26 TRP H 4.400 . 4.400 3.614 3.406 3.704 . 0 0 "[ . 1 . 2]" 1
501 1 25 HIS HB3 1 73 TYR HB3 4.850 . 4.850 3.425 2.922 4.379 . 0 0 "[ . 1 . 2]" 1
502 1 25 HIS HB3 1 73 TYR QD 4.750 . 4.750 3.656 3.453 4.014 . 0 0 "[ . 1 . 2]" 1
503 1 25 HIS HD2 1 64 PHE QD 3.840 . 3.840 2.274 2.108 2.549 . 0 0 "[ . 1 . 2]" 1
504 1 25 HIS HD2 1 64 PHE QE 5.010 . 5.010 3.372 2.676 4.371 . 0 0 "[ . 1 . 2]" 1
505 1 25 HIS HD2 1 73 TYR QE 4.680 . 4.680 4.528 3.856 4.731 0.051 4 0 "[ . 1 . 2]" 1
506 1 25 HIS HE1 1 73 TYR QD 5.500 . 5.500 5.357 4.997 5.542 0.042 6 0 "[ . 1 . 2]" 1
507 1 25 HIS HE1 1 73 TYR QE 4.330 . 4.330 3.985 3.560 4.333 0.003 16 0 "[ . 1 . 2]" 1
508 1 26 TRP H 1 26 TRP HB2 4.130 . 4.130 2.560 2.418 2.788 . 0 0 "[ . 1 . 2]" 1
509 1 26 TRP H 1 26 TRP HB3 3.760 . 3.760 2.544 2.463 2.629 . 0 0 "[ . 1 . 2]" 1
510 1 26 TRP H 1 26 TRP HE3 5.270 . 5.270 4.694 4.477 4.940 . 0 0 "[ . 1 . 2]" 1
511 1 26 TRP H 1 27 PRO HD3 4.890 . 4.890 4.897 4.736 4.942 0.052 15 0 "[ . 1 . 2]" 1
512 1 26 TRP H 1 28 ALA MB 5.480 . 5.480 4.736 4.572 4.872 . 0 0 "[ . 1 . 2]" 1
513 1 26 TRP H 1 49 PHE QD 5.370 . 5.370 4.820 4.553 5.055 . 0 0 "[ . 1 . 2]" 1
514 1 26 TRP HA 1 27 PRO HD2 3.540 . 3.540 2.268 2.144 2.677 . 0 0 "[ . 1 . 2]" 1
515 1 26 TRP HA 1 27 PRO HD3 3.670 . 3.670 2.385 2.103 2.496 . 0 0 "[ . 1 . 2]" 1
516 1 26 TRP HA 1 82 PHE QE 3.610 . 3.610 2.228 2.048 2.515 . 0 0 "[ . 1 . 2]" 1
517 1 26 TRP HA 1 82 PHE HZ 4.370 . 4.370 3.716 3.263 4.349 . 0 0 "[ . 1 . 2]" 1
518 1 26 TRP HB2 1 49 PHE QD 4.640 . 4.640 3.789 3.445 4.209 . 0 0 "[ . 1 . 2]" 1
519 1 26 TRP HB2 1 49 PHE QE 5.070 . 5.070 3.364 2.963 3.679 . 0 0 "[ . 1 . 2]" 1
520 1 26 TRP HB2 1 82 PHE QE 5.240 . 5.240 3.748 3.262 4.309 . 0 0 "[ . 1 . 2]" 1
521 1 26 TRP HB3 1 49 PHE QD 4.250 . 4.250 2.417 2.207 2.660 . 0 0 "[ . 1 . 2]" 1
522 1 26 TRP HB3 1 49 PHE QE 4.700 . 4.700 2.251 2.005 2.588 . 0 0 "[ . 1 . 2]" 1
523 1 26 TRP HD1 1 27 PRO HD2 4.600 . 4.600 2.805 2.629 3.004 . 0 0 "[ . 1 . 2]" 1
524 1 26 TRP HD1 1 27 PRO HD3 5.060 . 5.060 4.247 4.070 4.419 . 0 0 "[ . 1 . 2]" 1
525 1 26 TRP HD1 1 27 PRO QG 5.140 . 5.140 3.321 2.975 4.191 . 0 0 "[ . 1 . 2]" 1
526 1 26 TRP HD1 1 28 ALA MB 4.300 . 4.300 3.270 2.803 3.524 . 0 0 "[ . 1 . 2]" 1
527 1 26 TRP HD1 1 49 PHE HA 3.870 . 3.870 3.455 3.082 3.775 . 0 0 "[ . 1 . 2]" 1
528 1 26 TRP HD1 1 49 PHE QB 4.340 . 4.340 3.196 2.916 3.577 . 0 0 "[ . 1 . 2]" 1
529 1 26 TRP HD1 1 49 PHE QD 3.820 . 3.820 2.393 2.199 2.603 . 0 0 "[ . 1 . 2]" 1
530 1 26 TRP HE1 1 27 PRO HD2 4.720 . 4.720 3.784 3.590 3.844 . 0 0 "[ . 1 . 2]" 1
531 1 26 TRP HE1 1 27 PRO HD3 5.500 . 5.500 5.507 5.321 5.542 0.042 20 0 "[ . 1 . 2]" 1
532 1 26 TRP HE1 1 27 PRO QG 5.310 . 5.310 3.827 3.495 4.785 . 0 0 "[ . 1 . 2]" 1
533 1 26 TRP HE1 1 28 ALA MB 5.500 . 5.500 5.205 4.738 5.515 0.015 6 0 "[ . 1 . 2]" 1
534 1 26 TRP HE1 1 49 PHE QB 3.920 . 3.920 2.993 2.599 3.362 . 0 0 "[ . 1 . 2]" 1
535 1 26 TRP HE1 1 49 PHE QD 4.660 . 4.660 3.947 3.629 4.260 . 0 0 "[ . 1 . 2]" 1
536 1 26 TRP HE1 1 50 PHE H 4.760 . 4.760 3.483 2.922 4.013 . 0 0 "[ . 1 . 2]" 1
537 1 26 TRP HE1 1 51 GLY HA3 4.590 . 4.590 3.867 3.602 4.202 . 0 0 "[ . 1 . 2]" 1
538 1 26 TRP HE1 1 52 THR H 3.720 . 3.720 3.552 3.307 3.728 0.008 2 0 "[ . 1 . 2]" 1
539 1 26 TRP HE1 1 52 THR MG 3.650 . 3.650 3.472 2.764 3.725 0.075 8 0 "[ . 1 . 2]" 1
540 1 26 TRP HE1 1 53 HIS H 5.450 . 5.450 4.987 4.613 5.327 . 0 0 "[ . 1 . 2]" 1
541 1 26 TRP HE1 1 82 PHE HA 4.400 . 4.400 3.337 3.036 3.737 . 0 0 "[ . 1 . 2]" 1
542 1 26 TRP HE1 1 85 GLY H 5.460 . 5.460 4.655 4.382 5.038 . 0 0 "[ . 1 . 2]" 1
543 1 26 TRP HE1 1 85 GLY HA3 4.270 . 4.270 3.506 3.138 3.991 . 0 0 "[ . 1 . 2]" 1
544 1 26 TRP HH2 1 52 THR MG 4.290 . 4.290 3.136 2.498 3.694 . 0 0 "[ . 1 . 2]" 1
545 1 26 TRP HH2 1 79 ARG QB 3.730 . 3.730 2.386 2.008 2.656 . 0 0 "[ . 1 . 2]" 1
546 1 26 TRP HH2 1 79 ARG HD2 5.070 . 5.070 3.526 1.957 4.219 . 0 0 "[ . 1 . 2]" 1
547 1 26 TRP HH2 1 79 ARG QD 4.240 . 4.240 3.413 1.949 4.027 . 0 0 "[ . 1 . 2]" 1
548 1 26 TRP HH2 1 79 ARG HD3 5.070 . 5.070 4.733 3.677 5.094 0.024 17 0 "[ . 1 . 2]" 1
549 1 26 TRP HH2 1 81 GLY H 5.500 . 5.500 5.112 4.926 5.300 . 0 0 "[ . 1 . 2]" 1
550 1 26 TRP HH2 1 82 PHE H 4.360 . 4.360 3.437 3.113 3.640 . 0 0 "[ . 1 . 2]" 1
551 1 26 TRP HH2 1 82 PHE HB2 4.890 . 4.890 3.380 3.107 3.647 . 0 0 "[ . 1 . 2]" 1
552 1 26 TRP HH2 1 82 PHE QB 4.280 . 4.280 3.318 3.061 3.554 . 0 0 "[ . 1 . 2]" 1
553 1 26 TRP HH2 1 82 PHE HB3 4.890 . 4.890 4.839 4.613 4.921 0.031 5 0 "[ . 1 . 2]" 1
554 1 26 TRP HZ2 1 52 THR MG 3.020 . 3.020 2.057 1.870 2.316 . 0 0 "[ . 1 . 2]" 1
555 1 26 TRP HZ2 1 79 ARG QB 5.040 . 5.040 4.227 4.020 4.568 . 0 0 "[ . 1 . 2]" 1
556 1 26 TRP HZ2 1 81 GLY H 5.410 . 5.410 4.722 4.296 5.056 . 0 0 "[ . 1 . 2]" 1
557 1 26 TRP HZ2 1 81 GLY HA2 4.370 . 4.370 3.797 3.606 4.026 . 0 0 "[ . 1 . 2]" 1
558 1 26 TRP HZ2 1 81 GLY HA3 4.180 . 4.180 2.398 2.027 2.875 . 0 0 "[ . 1 . 2]" 1
559 1 26 TRP HZ2 1 82 PHE H 4.210 . 4.210 3.268 2.939 3.614 . 0 0 "[ . 1 . 2]" 1
560 1 26 TRP HZ2 1 82 PHE HA 3.750 . 3.750 3.245 2.848 3.586 . 0 0 "[ . 1 . 2]" 1
561 1 26 TRP HZ2 1 82 PHE QB 5.340 . 5.340 3.703 3.507 3.906 . 0 0 "[ . 1 . 2]" 1
562 1 26 TRP HZ3 1 79 ARG QB 4.360 . 4.360 2.451 2.275 2.679 . 0 0 "[ . 1 . 2]" 1
563 1 26 TRP HZ3 1 79 ARG HD2 4.860 . 4.860 2.932 2.195 4.275 . 0 0 "[ . 1 . 2]" 1
564 1 26 TRP HZ3 1 79 ARG QD 4.080 . 4.080 2.812 2.183 3.554 . 0 0 "[ . 1 . 2]" 1
565 1 26 TRP HZ3 1 79 ARG HD3 4.860 . 4.860 4.173 3.618 4.872 0.012 17 0 "[ . 1 . 2]" 1
566 1 27 PRO HA 1 28 ALA H 3.190 . 3.190 2.194 2.159 2.230 . 0 0 "[ . 1 . 2]" 1
567 1 27 PRO HA 1 28 ALA HA 5.050 . 5.050 4.387 4.353 4.412 . 0 0 "[ . 1 . 2]" 1
568 1 27 PRO HA 1 28 ALA MB 4.100 . 4.100 3.938 3.914 3.974 . 0 0 "[ . 1 . 2]" 1
569 1 27 PRO HA 1 89 ILE MD 3.940 . 3.940 3.118 2.903 3.471 . 0 0 "[ . 1 . 2]" 1
570 1 27 PRO HA 1 89 ILE MG 5.000 . 5.000 4.142 3.715 4.829 . 0 0 "[ . 1 . 2]" 1
571 1 27 PRO QB 1 28 ALA H 3.920 . 3.920 3.505 3.454 3.533 . 0 0 "[ . 1 . 2]" 1
572 1 27 PRO QB 1 50 PHE QD 4.120 . 4.120 2.892 2.449 3.254 . 0 0 "[ . 1 . 2]" 1
573 1 27 PRO QB 1 86 LEU HA 4.510 . 4.510 3.270 2.896 3.666 . 0 0 "[ . 1 . 2]" 1
574 1 27 PRO QB 1 89 ILE HB 4.740 . 4.740 2.852 2.608 3.125 . 0 0 "[ . 1 . 2]" 1
575 1 27 PRO QB 1 89 ILE MD 3.550 . 3.550 2.461 2.247 2.705 . 0 0 "[ . 1 . 2]" 1
576 1 27 PRO QB 1 89 ILE MG 3.630 . 3.630 2.243 1.909 2.907 . 0 0 "[ . 1 . 2]" 1
577 1 27 PRO HD2 1 82 PHE QE 4.340 . 4.340 3.507 3.267 3.862 . 0 0 "[ . 1 . 2]" 1
578 1 27 PRO HD2 1 82 PHE HZ 4.870 . 4.870 4.349 3.935 4.856 . 0 0 "[ . 1 . 2]" 1
579 1 27 PRO HD2 1 86 LEU QD 4.660 . 4.660 4.152 3.849 4.663 0.003 7 0 "[ . 1 . 2]" 1
580 1 27 PRO HD3 1 82 PHE QE 4.290 . 4.290 3.094 2.759 3.352 . 0 0 "[ . 1 . 2]" 1
581 1 27 PRO HD3 1 86 LEU QD 4.510 . 4.510 3.321 2.850 4.078 . 0 0 "[ . 1 . 2]" 1
582 1 27 PRO QG 1 50 PHE QB 4.210 . 4.210 3.201 2.835 3.875 . 0 0 "[ . 1 . 2]" 1
583 1 27 PRO QG 1 85 GLY H 4.760 . 4.760 4.369 4.015 4.681 . 0 0 "[ . 1 . 2]" 1
584 1 27 PRO QG 1 85 GLY HA2 4.520 . 4.520 4.267 3.933 4.553 0.033 7 0 "[ . 1 . 2]" 1
585 1 27 PRO QG 1 86 LEU H 4.070 . 4.070 3.223 2.956 3.594 . 0 0 "[ . 1 . 2]" 1
586 1 27 PRO QG 1 86 LEU HA 4.180 . 4.180 2.892 2.314 3.527 . 0 0 "[ . 1 . 2]" 1
587 1 27 PRO QG 1 86 LEU QD 4.060 . 4.060 2.164 1.924 2.611 . 0 0 "[ . 1 . 2]" 1
588 1 27 PRO HG2 1 86 LEU HA 4.800 . 4.800 3.715 2.691 4.567 . 0 0 "[ . 1 . 2]" 1
589 1 27 PRO HG3 1 86 LEU HA 4.800 . 4.800 3.075 2.375 3.932 . 0 0 "[ . 1 . 2]" 1
590 1 28 ALA H 1 28 ALA MB 3.410 . 3.410 2.545 2.473 2.591 . 0 0 "[ . 1 . 2]" 1
591 1 28 ALA H 1 29 ARG H 4.880 . 4.880 4.279 4.247 4.320 . 0 0 "[ . 1 . 2]" 1
592 1 28 ALA H 1 47 ILE MG 4.520 . 4.520 4.644 4.602 4.687 0.167 5 0 "[ . 1 . 2]" 1
593 1 28 ALA H 1 50 PHE QD 4.540 . 4.540 3.619 3.228 3.981 . 0 0 "[ . 1 . 2]" 1
594 1 28 ALA H 1 89 ILE MD 3.810 . 3.810 2.930 2.623 3.381 . 0 0 "[ . 1 . 2]" 1
595 1 28 ALA H 1 89 ILE MG 5.500 . 5.500 4.973 4.526 5.518 0.018 6 0 "[ . 1 . 2]" 1
596 1 28 ALA HA 1 29 ARG H 3.410 . 3.410 2.391 2.318 2.487 . 0 0 "[ . 1 . 2]" 1
597 1 28 ALA HA 1 49 PHE HA 3.620 . 3.620 2.633 2.320 2.806 . 0 0 "[ . 1 . 2]" 1
598 1 28 ALA HA 1 50 PHE H 3.560 . 3.560 2.619 2.388 2.785 . 0 0 "[ . 1 . 2]" 1
599 1 28 ALA HA 1 50 PHE QD 4.000 . 4.000 2.326 2.010 2.816 . 0 0 "[ . 1 . 2]" 1
600 1 28 ALA MB 1 29 ARG H 3.100 . 3.100 2.317 2.226 2.379 . 0 0 "[ . 1 . 2]" 1
601 1 28 ALA MB 1 47 ILE HA 4.080 . 4.080 3.931 3.771 4.089 0.009 2 0 "[ . 1 . 2]" 1
602 1 28 ALA MB 1 47 ILE MG 2.680 . 2.680 1.915 1.862 1.968 . 0 0 "[ . 1 . 2]" 1
603 1 28 ALA MB 1 48 PHE H 3.870 . 3.870 3.354 3.137 3.696 . 0 0 "[ . 1 . 2]" 1
604 1 28 ALA MB 1 49 PHE H 4.530 . 4.530 3.958 3.714 4.314 . 0 0 "[ . 1 . 2]" 1
605 1 28 ALA MB 1 49 PHE HA 3.350 . 3.350 2.333 2.111 2.671 . 0 0 "[ . 1 . 2]" 1
606 1 28 ALA MB 1 49 PHE QD 4.080 . 4.080 2.517 2.169 2.783 . 0 0 "[ . 1 . 2]" 1
607 1 28 ALA MB 1 49 PHE QE 4.470 . 4.470 3.325 3.088 3.618 . 0 0 "[ . 1 . 2]" 1
608 1 28 ALA MB 1 50 PHE H 3.760 . 3.760 3.402 3.177 3.609 . 0 0 "[ . 1 . 2]" 1
609 1 29 ARG H 1 29 ARG HB2 4.040 . 4.040 3.053 2.820 3.837 . 0 0 "[ . 1 . 2]" 1
610 1 29 ARG H 1 29 ARG HB3 4.040 . 4.040 2.589 2.263 2.788 . 0 0 "[ . 1 . 2]" 1
611 1 29 ARG H 1 29 ARG HG2 5.060 . 5.060 4.231 2.672 4.554 . 0 0 "[ . 1 . 2]" 1
612 1 29 ARG H 1 29 ARG QG 4.340 . 4.340 3.891 2.562 4.147 . 0 0 "[ . 1 . 2]" 1
613 1 29 ARG H 1 29 ARG HG3 5.060 . 5.060 4.566 3.292 4.774 . 0 0 "[ . 1 . 2]" 1
614 1 29 ARG H 1 30 VAL H 4.610 . 4.610 4.424 4.369 4.489 . 0 0 "[ . 1 . 2]" 1
615 1 29 ARG H 1 47 ILE HA 4.850 . 4.850 4.424 4.270 4.667 . 0 0 "[ . 1 . 2]" 1
616 1 29 ARG H 1 47 ILE MG 3.820 . 3.820 3.412 3.191 3.574 . 0 0 "[ . 1 . 2]" 1
617 1 29 ARG H 1 48 PHE HB2 5.030 . 5.030 4.735 4.527 4.934 . 0 0 "[ . 1 . 2]" 1
618 1 29 ARG H 1 48 PHE HB3 4.180 . 4.180 3.182 2.969 3.441 . 0 0 "[ . 1 . 2]" 1
619 1 29 ARG H 1 48 PHE QD 4.710 . 4.710 3.572 3.253 3.994 . 0 0 "[ . 1 . 2]" 1
620 1 29 ARG H 1 49 PHE HA 4.850 . 4.850 3.788 3.470 4.018 . 0 0 "[ . 1 . 2]" 1
621 1 29 ARG H 1 50 PHE H 5.210 . 5.210 4.468 4.194 4.686 . 0 0 "[ . 1 . 2]" 1
622 1 29 ARG H 1 50 PHE QD 4.800 . 4.800 3.937 3.680 4.405 . 0 0 "[ . 1 . 2]" 1
623 1 29 ARG H 1 50 PHE QE 4.640 . 4.640 3.357 2.957 3.732 . 0 0 "[ . 1 . 2]" 1
624 1 29 ARG H 1 50 PHE HZ 4.770 . 4.770 4.578 4.175 4.786 0.016 20 0 "[ . 1 . 2]" 1
625 1 29 ARG HA 1 30 VAL H 3.360 . 3.360 2.257 2.212 2.347 . 0 0 "[ . 1 . 2]" 1
626 1 29 ARG HA 1 30 VAL MG2 4.090 . 4.090 3.743 3.531 3.908 . 0 0 "[ . 1 . 2]" 1
627 1 29 ARG QB 1 30 VAL H 3.970 . 3.970 3.546 2.763 3.748 . 0 0 "[ . 1 . 2]" 1
628 1 29 ARG QB 1 50 PHE QD 4.450 . 4.450 3.993 3.734 4.170 . 0 0 "[ . 1 . 2]" 1
629 1 29 ARG QB 1 50 PHE QE 4.880 . 4.880 2.223 1.956 2.622 . 0 0 "[ . 1 . 2]" 1
630 1 29 ARG QB 1 50 PHE HZ 4.460 . 4.460 2.145 1.922 2.303 . 0 0 "[ . 1 . 2]" 1
631 1 29 ARG HB2 1 30 VAL H 4.670 . 4.670 4.032 2.814 4.277 . 0 0 "[ . 1 . 2]" 1
632 1 29 ARG HB2 1 50 PHE QD 5.170 . 5.170 4.346 3.985 5.302 0.132 9 0 "[ . 1 . 2]" 1
633 1 29 ARG HB2 1 50 PHE HZ 5.180 . 5.180 2.269 1.954 3.313 . 0 0 "[ . 1 . 2]" 1
634 1 29 ARG HB3 1 30 VAL H 4.670 . 4.670 4.013 3.819 4.288 . 0 0 "[ . 1 . 2]" 1
635 1 29 ARG HB3 1 50 PHE QD 5.170 . 5.170 4.889 3.819 5.192 0.022 6 0 "[ . 1 . 2]" 1
636 1 29 ARG HB3 1 50 PHE HZ 5.180 . 5.180 3.302 2.291 3.790 . 0 0 "[ . 1 . 2]" 1
637 1 29 ARG QG 1 30 VAL H 4.050 . 4.050 2.581 2.319 3.250 . 0 0 "[ . 1 . 2]" 1
638 1 30 VAL H 1 30 VAL HB 3.500 . 3.500 2.578 2.535 2.628 . 0 0 "[ . 1 . 2]" 1
639 1 30 VAL H 1 30 VAL MG1 3.830 . 3.830 3.795 3.777 3.821 . 0 0 "[ . 1 . 2]" 1
640 1 30 VAL H 1 30 VAL MG2 3.300 . 3.300 2.165 2.051 2.272 . 0 0 "[ . 1 . 2]" 1
641 1 30 VAL H 1 47 ILE MD 4.690 . 4.690 4.257 3.893 4.627 . 0 0 "[ . 1 . 2]" 1
642 1 30 VAL HA 1 30 VAL MG1 3.280 . 3.280 2.392 2.343 2.420 . 0 0 "[ . 1 . 2]" 1
643 1 30 VAL HA 1 30 VAL MG2 3.340 . 3.340 2.480 2.459 2.534 . 0 0 "[ . 1 . 2]" 1
644 1 30 VAL HA 1 31 ASP H 3.150 . 3.150 2.145 2.005 2.189 . 0 0 "[ . 1 . 2]" 1
645 1 30 VAL HA 1 31 ASP HA 4.840 . 4.840 4.313 4.235 4.372 . 0 0 "[ . 1 . 2]" 1
646 1 30 VAL HA 1 31 ASP HB2 4.520 . 4.520 4.223 4.108 4.367 . 0 0 "[ . 1 . 2]" 1
647 1 30 VAL HA 1 31 ASP HB3 5.310 . 5.310 4.949 4.692 5.435 0.125 9 0 "[ . 1 . 2]" 1
648 1 30 VAL HA 1 45 LEU HB3 5.190 . 5.190 4.381 4.092 4.802 . 0 0 "[ . 1 . 2]" 1
649 1 30 VAL HA 1 47 ILE HA 4.000 . 4.000 2.700 2.465 3.163 . 0 0 "[ . 1 . 2]" 1
650 1 30 VAL HA 1 47 ILE MD 3.400 . 3.400 2.363 2.122 2.651 . 0 0 "[ . 1 . 2]" 1
651 1 30 VAL HA 1 47 ILE MG 4.530 . 4.530 3.827 3.598 4.022 . 0 0 "[ . 1 . 2]" 1
652 1 30 VAL HA 1 48 PHE H 4.340 . 4.340 3.651 3.454 4.248 . 0 0 "[ . 1 . 2]" 1
653 1 30 VAL HB 1 47 ILE MD 5.190 . 5.190 4.498 4.263 4.826 . 0 0 "[ . 1 . 2]" 1
654 1 30 VAL MG1 1 31 ASP H 3.380 . 3.380 2.847 2.706 2.977 . 0 0 "[ . 1 . 2]" 1
655 1 30 VAL MG1 1 31 ASP HA 4.730 . 4.730 4.183 4.038 4.323 . 0 0 "[ . 1 . 2]" 1
656 1 30 VAL MG1 1 32 GLU H 5.360 . 5.360 5.327 5.167 5.420 0.060 3 0 "[ . 1 . 2]" 1
657 1 30 VAL MG1 1 45 LEU HA 5.130 . 5.130 4.219 3.865 4.742 . 0 0 "[ . 1 . 2]" 1
658 1 30 VAL MG1 1 45 LEU HB3 3.960 . 3.960 2.287 2.014 2.736 . 0 0 "[ . 1 . 2]" 1
659 1 30 VAL MG1 1 46 PRO HD2 4.170 . 4.170 2.969 2.499 3.417 . 0 0 "[ . 1 . 2]" 1
660 1 30 VAL MG1 1 47 ILE MD 3.740 . 3.740 2.821 2.626 3.027 . 0 0 "[ . 1 . 2]" 1
661 1 30 VAL MG1 1 63 ILE MD 5.320 . 5.320 3.740 3.089 4.034 . 0 0 "[ . 1 . 2]" 1
662 1 30 VAL MG2 1 31 ASP H 4.160 . 4.160 4.167 4.122 4.195 0.035 17 0 "[ . 1 . 2]" 1
663 1 30 VAL MG2 1 47 ILE MD 3.010 . 3.010 2.467 2.144 2.825 . 0 0 "[ . 1 . 2]" 1
664 1 30 VAL MG2 1 63 ILE MD 3.640 . 3.640 2.565 1.981 2.990 . 0 0 "[ . 1 . 2]" 1
665 1 31 ASP H 1 31 ASP HB2 3.410 . 3.410 2.510 2.250 2.697 . 0 0 "[ . 1 . 2]" 1
666 1 31 ASP H 1 31 ASP HB3 3.650 . 3.650 2.842 2.578 3.491 . 0 0 "[ . 1 . 2]" 1
667 1 31 ASP H 1 32 GLU H 4.570 . 4.570 4.492 4.395 4.571 0.001 11 0 "[ . 1 . 2]" 1
668 1 31 ASP H 1 46 PRO QB 4.150 . 4.150 3.295 3.033 3.776 . 0 0 "[ . 1 . 2]" 1
669 1 31 ASP H 1 46 PRO HG2 4.250 . 4.250 2.853 2.503 3.094 . 0 0 "[ . 1 . 2]" 1
670 1 31 ASP H 1 46 PRO HG3 4.760 . 4.760 4.552 4.236 4.815 0.055 9 0 "[ . 1 . 2]" 1
671 1 31 ASP H 1 47 ILE HA 3.970 . 3.970 3.004 2.652 3.359 . 0 0 "[ . 1 . 2]" 1
672 1 31 ASP H 1 47 ILE MD 3.930 . 3.930 3.457 2.982 3.834 . 0 0 "[ . 1 . 2]" 1
673 1 31 ASP H 1 47 ILE MG 5.240 . 5.240 4.797 4.472 5.091 . 0 0 "[ . 1 . 2]" 1
674 1 31 ASP H 1 48 PHE H 4.470 . 4.470 3.551 3.305 3.809 . 0 0 "[ . 1 . 2]" 1
675 1 31 ASP HA 1 32 GLU H 2.880 . 2.880 2.620 2.430 2.745 . 0 0 "[ . 1 . 2]" 1
676 1 31 ASP HA 1 32 GLU QB 4.780 . 4.780 4.464 4.157 4.789 0.009 6 0 "[ . 1 . 2]" 1
677 1 31 ASP HA 1 46 PRO QB 5.280 . 5.280 4.782 4.599 5.109 . 0 0 "[ . 1 . 2]" 1
678 1 31 ASP HB2 1 32 GLU H 4.160 . 4.160 3.776 3.488 3.947 . 0 0 "[ . 1 . 2]" 1
679 1 31 ASP HB2 1 46 PRO QB 3.980 . 3.980 3.346 1.970 3.995 0.015 17 0 "[ . 1 . 2]" 1
680 1 31 ASP HB2 1 48 PHE H 4.340 . 4.340 3.155 2.639 3.915 . 0 0 "[ . 1 . 2]" 1
681 1 31 ASP HB2 1 48 PHE HB2 4.580 . 4.580 2.609 2.137 4.600 0.020 9 0 "[ . 1 . 2]" 1
682 1 31 ASP HB3 1 32 GLU H 3.010 . 3.010 2.853 2.176 3.099 0.089 16 0 "[ . 1 . 2]" 1
683 1 31 ASP HB3 1 46 PRO QB 3.970 . 3.970 2.337 1.921 2.930 . 0 0 "[ . 1 . 2]" 1
684 1 31 ASP HB3 1 46 PRO HG3 4.680 . 4.680 4.023 3.289 4.504 . 0 0 "[ . 1 . 2]" 1
685 1 32 GLU H 1 32 GLU HB2 3.790 . 3.790 3.192 2.314 3.832 0.042 19 0 "[ . 1 . 2]" 1
686 1 32 GLU H 1 32 GLU QB 3.050 . 3.050 2.749 2.284 3.063 0.013 8 0 "[ . 1 . 2]" 1
687 1 32 GLU H 1 32 GLU HB3 3.790 . 3.790 3.361 3.004 3.672 . 0 0 "[ . 1 . 2]" 1
688 1 32 GLU H 1 32 GLU QG 3.120 . 3.120 2.903 1.825 3.321 0.201 13 0 "[ . 1 . 2]" 1
689 1 32 GLU H 1 33 VAL H 4.660 . 4.660 4.418 4.232 4.504 . 0 0 "[ . 1 . 2]" 1
690 1 32 GLU HA 1 32 GLU QG 3.770 . 3.770 3.066 2.313 3.601 . 0 0 "[ . 1 . 2]" 1
691 1 32 GLU HA 1 33 VAL H 2.600 . 2.600 2.208 1.980 2.514 . 0 0 "[ . 1 . 2]" 1
692 1 32 GLU HA 1 33 VAL HB 5.020 . 5.020 4.639 4.350 5.044 0.024 1 0 "[ . 1 . 2]" 1
693 1 32 GLU HA 1 33 VAL QG 3.710 . 3.710 3.447 3.168 3.731 0.021 9 0 "[ . 1 . 2]" 1
694 1 32 GLU HA 1 46 PRO HG3 4.230 . 4.230 4.146 3.571 4.271 0.041 13 0 "[ . 1 . 2]" 1
695 1 32 GLU QB 1 33 VAL H 3.340 . 3.340 2.692 2.185 3.201 . 0 0 "[ . 1 . 2]" 1
696 1 32 GLU QB 1 33 VAL HA 4.940 . 4.940 4.423 4.059 4.769 . 0 0 "[ . 1 . 2]" 1
697 1 32 GLU QG 1 33 VAL H 4.380 . 4.380 3.972 3.274 4.396 0.016 10 0 "[ . 1 . 2]" 1
698 1 33 VAL H 1 33 VAL HB 2.990 . 2.990 2.670 2.481 3.008 0.018 14 0 "[ . 1 . 2]" 1
699 1 33 VAL H 1 33 VAL QG 2.780 . 2.780 2.115 1.945 2.494 . 0 0 "[ . 1 . 2]" 1
700 1 33 VAL H 1 34 PRO HD2 4.910 . 4.910 4.895 4.821 4.947 0.037 17 0 "[ . 1 . 2]" 1
701 1 33 VAL H 1 34 PRO HD3 5.050 . 5.050 4.574 4.303 4.852 . 0 0 "[ . 1 . 2]" 1
702 1 33 VAL H 1 46 PRO HG3 4.330 . 4.330 4.074 2.924 4.389 0.059 6 0 "[ . 1 . 2]" 1
703 1 33 VAL HA 1 33 VAL MG1 3.350 . 3.350 2.697 2.369 3.259 . 0 0 "[ . 1 . 2]" 1
704 1 33 VAL HA 1 33 VAL QG 2.740 . 2.740 2.206 2.109 2.388 . 0 0 "[ . 1 . 2]" 1
705 1 33 VAL HA 1 33 VAL MG2 3.350 . 3.350 2.388 2.328 2.456 . 0 0 "[ . 1 . 2]" 1
706 1 33 VAL HA 1 34 PRO HD2 3.080 . 3.080 2.196 2.129 2.298 . 0 0 "[ . 1 . 2]" 1
707 1 33 VAL HA 1 34 PRO HD3 3.000 . 3.000 2.185 1.987 2.358 . 0 0 "[ . 1 . 2]" 1
708 1 33 VAL HA 1 34 PRO QG 3.980 . 3.980 3.858 3.790 3.945 . 0 0 "[ . 1 . 2]" 1
709 1 33 VAL HA 1 37 ALA MB 5.070 . 5.070 4.381 3.772 4.956 . 0 0 "[ . 1 . 2]" 1
710 1 33 VAL HA 1 46 PRO QB 4.800 . 4.800 4.419 3.564 4.820 0.020 14 0 "[ . 1 . 2]" 1
711 1 33 VAL HA 1 46 PRO HG3 4.430 . 4.430 3.739 3.073 4.384 . 0 0 "[ . 1 . 2]" 1
712 1 33 VAL HB 1 34 PRO HD2 4.250 . 4.250 4.174 3.883 4.315 0.065 1 0 "[ . 1 . 2]" 1
713 1 33 VAL QG 1 34 PRO HA 4.490 . 4.490 4.023 3.884 4.114 . 0 0 "[ . 1 . 2]" 1
714 1 33 VAL QG 1 34 PRO HD2 3.030 . 3.030 2.251 2.058 2.414 . 0 0 "[ . 1 . 2]" 1
715 1 33 VAL QG 1 34 PRO HD3 3.350 . 3.350 3.352 3.301 3.399 0.049 17 0 "[ . 1 . 2]" 1
716 1 33 VAL QG 1 34 PRO QG 3.880 . 3.880 3.512 3.207 3.812 . 0 0 "[ . 1 . 2]" 1
717 1 33 VAL QG 1 35 ASP H 4.750 . 4.750 4.699 4.279 4.802 0.052 4 0 "[ . 1 . 2]" 1
718 1 33 VAL QG 1 37 ALA H 4.340 . 4.340 4.074 3.741 4.407 0.067 14 0 "[ . 1 . 2]" 1
719 1 33 VAL QG 1 37 ALA MB 3.090 . 3.090 2.461 2.132 3.013 . 0 0 "[ . 1 . 2]" 1
720 1 33 VAL QG 1 46 PRO QB 4.800 . 4.800 3.795 3.084 4.481 . 0 0 "[ . 1 . 2]" 1
721 1 33 VAL QG 1 46 PRO HD3 4.290 . 4.290 3.514 2.803 4.349 0.059 9 0 "[ . 1 . 2]" 1
722 1 33 VAL QG 1 46 PRO HG2 4.740 . 4.740 3.916 3.324 4.789 0.049 9 0 "[ . 1 . 2]" 1
723 1 33 VAL QG 1 46 PRO HG3 4.000 . 4.000 2.791 2.123 3.719 . 0 0 "[ . 1 . 2]" 1
724 1 33 VAL MG1 1 34 PRO HA 5.490 . 5.490 4.320 4.051 4.667 . 0 0 "[ . 1 . 2]" 1
725 1 33 VAL MG1 1 46 PRO HD3 5.360 . 5.360 4.805 3.016 5.395 0.035 3 0 "[ . 1 . 2]" 1
726 1 33 VAL MG2 1 34 PRO HA 5.490 . 5.490 5.167 4.206 5.653 0.163 19 0 "[ . 1 . 2]" 1
727 1 33 VAL MG2 1 46 PRO HD3 5.360 . 5.360 3.850 2.826 5.363 0.003 2 0 "[ . 1 . 2]" 1
728 1 34 PRO HA 1 35 ASP H 2.400 . 2.400 2.245 2.157 2.388 . 0 0 "[ . 1 . 2]" 1
729 1 34 PRO HA 1 35 ASP QB 4.450 . 4.450 4.290 4.150 4.472 0.022 18 0 "[ . 1 . 2]" 1
730 1 34 PRO HA 1 37 ALA MB 5.190 . 5.190 4.730 4.575 4.836 . 0 0 "[ . 1 . 2]" 1
731 1 34 PRO HB2 1 35 ASP H 3.380 . 3.380 3.146 2.714 3.400 0.020 14 0 "[ . 1 . 2]" 1
732 1 34 PRO HB2 1 37 ALA H 4.190 . 4.190 3.992 3.851 4.176 . 0 0 "[ . 1 . 2]" 1
733 1 34 PRO HB3 1 35 ASP H 3.940 . 3.940 3.752 3.600 3.876 . 0 0 "[ . 1 . 2]" 1
734 1 34 PRO HB3 1 37 ALA H 5.500 . 5.500 5.572 5.537 5.625 0.125 19 0 "[ . 1 . 2]" 1
735 1 34 PRO HB3 1 37 ALA MB 4.800 . 4.800 4.633 4.385 4.835 0.035 9 0 "[ . 1 . 2]" 1
736 1 34 PRO HD2 1 37 ALA H 5.400 . 5.400 4.927 4.153 5.426 0.026 10 0 "[ . 1 . 2]" 1
737 1 34 PRO HD2 1 37 ALA MB 3.310 . 3.310 2.824 2.101 3.278 . 0 0 "[ . 1 . 2]" 1
738 1 34 PRO HD3 1 37 ALA MB 4.520 . 4.520 4.160 3.539 4.533 0.013 10 0 "[ . 1 . 2]" 1
739 1 34 PRO QG 1 35 ASP H 4.760 . 4.760 4.521 4.163 4.707 . 0 0 "[ . 1 . 2]" 1
740 1 34 PRO QG 1 37 ALA H 4.090 . 4.090 3.762 3.225 4.095 0.005 14 0 "[ . 1 . 2]" 1
741 1 34 PRO QG 1 37 ALA MB 3.200 . 3.200 2.240 1.961 2.438 . 0 0 "[ . 1 . 2]" 1
742 1 35 ASP H 1 35 ASP QB 2.550 . 2.550 2.381 2.284 2.561 0.011 8 0 "[ . 1 . 2]" 1
743 1 35 ASP HA 1 35 ASP QB 2.770 . 2.770 2.324 2.194 2.376 . 0 0 "[ . 1 . 2]" 1
744 1 35 ASP HA 1 36 GLY H 2.750 . 2.750 2.205 2.039 2.320 . 0 0 "[ . 1 . 2]" 1
745 1 35 ASP HA 1 36 GLY HA2 4.580 . 4.580 4.450 4.375 4.541 . 0 0 "[ . 1 . 2]" 1
746 1 35 ASP HA 1 36 GLY QA 3.990 . 3.990 3.940 3.884 3.997 0.007 8 0 "[ . 1 . 2]" 1
747 1 35 ASP HA 1 36 GLY HA3 4.580 . 4.580 4.395 4.344 4.436 . 0 0 "[ . 1 . 2]" 1
748 1 35 ASP HA 1 37 ALA H 4.110 . 4.110 3.112 2.841 3.432 . 0 0 "[ . 1 . 2]" 1
749 1 35 ASP QB 1 36 GLY H 3.410 . 3.410 3.227 2.630 3.518 0.108 4 0 "[ . 1 . 2]" 1
750 1 35 ASP QB 1 36 GLY HA2 4.870 . 4.870 4.685 4.271 4.912 0.042 14 0 "[ . 1 . 2]" 1
751 1 35 ASP QB 1 36 GLY HA3 4.870 . 4.870 4.402 4.076 4.556 . 0 0 "[ . 1 . 2]" 1
752 1 35 ASP QB 1 37 ALA H 5.080 . 5.080 4.613 4.434 4.733 . 0 0 "[ . 1 . 2]" 1
753 1 36 GLY H 1 37 ALA H 3.410 . 3.410 2.628 2.373 2.778 . 0 0 "[ . 1 . 2]" 1
754 1 36 GLY H 1 37 ALA MB 4.340 . 4.340 4.290 4.052 4.444 0.104 16 0 "[ . 1 . 2]" 1
755 1 36 GLY QA 1 37 ALA H 3.040 . 3.040 2.862 2.697 2.941 . 0 0 "[ . 1 . 2]" 1
756 1 36 GLY QA 1 38 VAL H 5.340 . 5.340 4.233 3.241 5.349 0.009 14 0 "[ . 1 . 2]" 1
757 1 37 ALA H 1 37 ALA MB 2.610 . 2.610 2.253 2.170 2.312 . 0 0 "[ . 1 . 2]" 1
758 1 37 ALA H 1 38 VAL H 4.490 . 4.490 3.948 2.925 4.517 0.027 14 0 "[ . 1 . 2]" 1
759 1 37 ALA HA 1 38 VAL H 2.580 . 2.580 2.213 2.079 2.619 0.039 2 0 "[ . 1 . 2]" 1
760 1 37 ALA HA 1 38 VAL MG1 4.080 . 4.080 3.959 3.596 4.185 0.105 2 0 "[ . 1 . 2]" 1
761 1 37 ALA HA 1 38 VAL MG2 4.290 . 4.290 3.697 3.404 3.960 . 0 0 "[ . 1 . 2]" 1
762 1 37 ALA MB 1 38 VAL H 3.520 . 3.520 3.433 2.872 3.587 0.067 17 0 "[ . 1 . 2]" 1
763 1 37 ALA MB 1 39 LYS H 3.770 . 3.770 3.163 2.624 3.793 0.023 2 0 "[ . 1 . 2]" 1
764 1 38 VAL H 1 38 VAL HB 3.710 . 3.710 3.650 3.553 3.847 0.137 17 0 "[ . 1 . 2]" 1
765 1 38 VAL H 1 38 VAL MG1 3.060 . 3.060 2.361 1.980 2.554 . 0 0 "[ . 1 . 2]" 1
766 1 38 VAL H 1 38 VAL MG2 2.810 . 2.810 1.999 1.896 2.921 0.111 17 0 "[ . 1 . 2]" 1
767 1 38 VAL H 1 39 LYS H 3.540 . 3.540 2.641 2.308 3.620 0.080 17 0 "[ . 1 . 2]" 1
768 1 38 VAL HA 1 38 VAL MG1 2.940 . 2.940 2.324 2.209 2.353 . 0 0 "[ . 1 . 2]" 1
769 1 38 VAL HA 1 39 LYS HA 5.010 . 5.010 4.578 4.332 4.776 . 0 0 "[ . 1 . 2]" 1
770 1 38 VAL HB 1 39 LYS H 4.180 . 4.180 4.180 3.758 4.266 0.086 2 0 "[ . 1 . 2]" 1
771 1 38 VAL HB 1 39 LYS HA 5.060 . 5.060 4.646 4.236 4.769 . 0 0 "[ . 1 . 2]" 1
772 1 38 VAL MG2 1 39 LYS H 3.100 . 3.100 2.972 2.480 3.177 0.077 16 0 "[ . 1 . 2]" 1
773 1 38 VAL MG2 1 39 LYS HA 4.190 . 4.190 3.645 3.394 3.944 . 0 0 "[ . 1 . 2]" 1
774 1 39 LYS H 1 39 LYS HB2 3.620 . 3.620 2.930 2.384 3.714 0.094 8 0 "[ . 1 . 2]" 1
775 1 39 LYS H 1 39 LYS QB 3.110 . 3.110 2.615 2.352 3.065 . 0 0 "[ . 1 . 2]" 1
776 1 39 LYS H 1 39 LYS HB3 3.620 . 3.620 3.394 2.472 3.657 0.037 12 0 "[ . 1 . 2]" 1
777 1 39 LYS H 1 39 LYS QD 2.940 . 2.940 2.792 1.668 3.202 0.262 20 0 "[ . 1 . 2]" 1
778 1 39 LYS H 1 39 LYS HG2 3.880 . 3.880 2.883 1.743 3.994 0.114 2 0 "[ . 1 . 2]" 1
779 1 39 LYS H 1 39 LYS HG3 3.880 . 3.880 3.411 2.079 3.964 0.084 10 0 "[ . 1 . 2]" 1
780 1 39 LYS H 1 40 PRO QD 4.680 . 4.680 4.262 4.077 4.413 . 0 0 "[ . 1 . 2]" 1
781 1 39 LYS HA 1 39 LYS QD 4.050 . 4.050 2.942 1.927 4.155 0.105 20 0 "[ . 1 . 2]" 1
782 1 39 LYS HA 1 39 LYS QE 4.480 . 4.480 3.835 2.242 4.472 . 0 0 "[ . 1 . 2]" 1
783 1 39 LYS HA 1 39 LYS QG 3.660 . 3.660 3.163 2.464 3.543 . 0 0 "[ . 1 . 2]" 1
784 1 39 LYS HA 1 40 PRO HD2 3.020 . 3.020 2.276 2.089 2.784 . 0 0 "[ . 1 . 2]" 1
785 1 39 LYS HA 1 40 PRO HD3 3.020 . 3.020 2.265 1.869 2.499 . 0 0 "[ . 1 . 2]" 1
786 1 39 LYS HA 1 40 PRO QG 4.360 . 4.360 3.869 3.692 3.993 . 0 0 "[ . 1 . 2]" 1
787 1 39 LYS QB 1 40 PRO QD 3.070 . 3.070 2.753 2.308 3.106 0.036 5 0 "[ . 1 . 2]" 1
788 1 39 LYS QE 1 39 LYS HG2 3.640 . 3.640 2.833 2.230 3.519 . 0 0 "[ . 1 . 2]" 1
789 1 39 LYS QE 1 39 LYS HG3 3.640 . 3.640 2.834 2.341 3.536 . 0 0 "[ . 1 . 2]" 1
790 1 40 PRO HA 1 41 PRO HA 4.900 . 4.900 4.441 4.397 4.519 . 0 0 "[ . 1 . 2]" 1
791 1 40 PRO HA 1 41 PRO HD2 3.240 . 3.240 2.403 2.259 2.712 . 0 0 "[ . 1 . 2]" 1
792 1 40 PRO HA 1 41 PRO QD 2.810 . 2.810 2.098 1.845 2.292 . 0 0 "[ . 1 . 2]" 1
793 1 40 PRO HA 1 41 PRO HD3 3.240 . 3.240 2.382 1.877 2.814 . 0 0 "[ . 1 . 2]" 1
794 1 40 PRO HA 1 41 PRO HG2 4.640 . 4.640 4.501 4.410 4.608 . 0 0 "[ . 1 . 2]" 1
795 1 40 PRO HA 1 41 PRO HG3 4.680 . 4.680 4.492 4.000 4.741 0.061 17 0 "[ . 1 . 2]" 1
796 1 40 PRO QB 1 41 PRO QD 3.050 . 3.050 2.465 2.038 3.076 0.026 6 0 "[ . 1 . 2]" 1
797 1 40 PRO HB2 1 41 PRO HD2 4.150 . 4.150 2.796 2.100 3.656 . 0 0 "[ . 1 . 2]" 1
798 1 40 PRO HB2 1 41 PRO HD3 4.150 . 4.150 4.018 3.641 4.187 0.037 16 0 "[ . 1 . 2]" 1
799 1 40 PRO HB3 1 41 PRO HD2 4.150 . 4.150 3.031 2.211 3.924 . 0 0 "[ . 1 . 2]" 1
800 1 40 PRO HB3 1 41 PRO HD3 4.150 . 4.150 4.060 3.669 4.183 0.033 17 0 "[ . 1 . 2]" 1
801 1 41 PRO HA 1 42 THR H 2.630 . 2.630 2.211 2.047 2.388 . 0 0 "[ . 1 . 2]" 1
802 1 41 PRO HA 1 42 THR HA 4.430 . 4.430 4.343 4.299 4.383 . 0 0 "[ . 1 . 2]" 1
803 1 41 PRO HA 1 42 THR HB 4.890 . 4.890 4.773 4.558 4.923 0.033 3 0 "[ . 1 . 2]" 1
804 1 41 PRO HA 1 42 THR MG 5.500 . 5.500 5.290 5.227 5.375 . 0 0 "[ . 1 . 2]" 1
805 1 41 PRO HB2 1 42 THR H 3.590 . 3.590 3.086 2.494 3.554 . 0 0 "[ . 1 . 2]" 1
806 1 41 PRO HB3 1 42 THR H 3.990 . 3.990 3.656 3.004 3.939 . 0 0 "[ . 1 . 2]" 1
807 1 41 PRO QD 1 42 THR H 4.960 . 4.960 4.870 4.750 4.967 0.007 11 0 "[ . 1 . 2]" 1
808 1 41 PRO HG2 1 42 THR H 4.950 . 4.950 4.743 4.287 5.005 0.055 8 0 "[ . 1 . 2]" 1
809 1 42 THR H 1 42 THR HB 3.080 . 3.080 2.595 2.533 2.710 . 0 0 "[ . 1 . 2]" 1
810 1 42 THR H 1 42 THR MG 4.030 . 4.030 3.679 3.587 3.819 . 0 0 "[ . 1 . 2]" 1
811 1 42 THR H 1 43 ASN H 3.940 . 3.940 2.707 2.256 3.111 . 0 0 "[ . 1 . 2]" 1
812 1 42 THR H 1 43 ASN QB 5.420 . 5.420 5.310 4.867 5.477 0.057 3 0 "[ . 1 . 2]" 1
813 1 42 THR H 1 44 LYS H 4.700 . 4.700 3.137 2.548 3.704 . 0 0 "[ . 1 . 2]" 1
814 1 42 THR HA 1 42 THR MG 2.900 . 2.900 2.274 2.233 2.317 . 0 0 "[ . 1 . 2]" 1
815 1 42 THR HA 1 43 ASN H 3.390 . 3.390 3.171 3.107 3.269 . 0 0 "[ . 1 . 2]" 1
816 1 42 THR HA 1 43 ASN QB 4.630 . 4.630 4.335 3.934 4.593 . 0 0 "[ . 1 . 2]" 1
817 1 42 THR HA 1 44 LYS H 4.580 . 4.580 4.240 4.005 4.571 . 0 0 "[ . 1 . 2]" 1
818 1 42 THR HB 1 43 ASN H 3.860 . 3.860 3.716 3.643 3.804 . 0 0 "[ . 1 . 2]" 1
819 1 42 THR HB 1 43 ASN HA 5.270 . 5.270 5.291 5.273 5.318 0.048 18 0 "[ . 1 . 2]" 1
820 1 42 THR HB 1 43 ASN QB 5.380 . 5.380 4.863 4.466 5.208 . 0 0 "[ . 1 . 2]" 1
821 1 42 THR HB 1 44 LYS H 5.030 . 5.030 2.844 2.605 3.083 . 0 0 "[ . 1 . 2]" 1
822 1 42 THR MG 1 43 ASN H 4.310 . 4.310 4.256 4.155 4.315 0.005 20 0 "[ . 1 . 2]" 1
823 1 42 THR MG 1 43 ASN QB 4.250 . 4.250 4.151 3.771 4.376 0.126 18 0 "[ . 1 . 2]" 1
824 1 42 THR MG 1 43 ASN QD 3.920 . 3.920 3.856 3.242 4.021 0.101 5 0 "[ . 1 . 2]" 1
825 1 42 THR MG 1 44 LYS H 4.050 . 4.050 4.036 3.815 4.099 0.049 10 0 "[ . 1 . 2]" 1
826 1 43 ASN H 1 43 ASN QB 3.530 . 3.530 3.279 3.020 3.474 . 0 0 "[ . 1 . 2]" 1
827 1 43 ASN H 1 44 LYS H 3.380 . 3.380 2.351 2.159 2.555 . 0 0 "[ . 1 . 2]" 1
828 1 43 ASN HA 1 43 ASN QD 4.600 . 4.600 3.886 3.477 4.367 . 0 0 "[ . 1 . 2]" 1
829 1 43 ASN HA 1 44 LYS H 3.260 . 3.260 2.954 2.857 3.072 . 0 0 "[ . 1 . 2]" 1
830 1 43 ASN QB 1 43 ASN QD 3.060 . 3.060 2.142 2.074 2.198 . 0 0 "[ . 1 . 2]" 1
831 1 43 ASN QB 1 43 ASN HD22 3.530 . 3.530 3.267 3.208 3.307 . 0 0 "[ . 1 . 2]" 1
832 1 43 ASN QB 1 44 LYS H 3.760 . 3.760 3.691 3.498 3.855 0.095 18 0 "[ . 1 . 2]" 1
833 1 44 LYS H 1 44 LYS HB2 3.290 . 3.290 2.629 2.365 2.868 . 0 0 "[ . 1 . 2]" 1
834 1 44 LYS H 1 44 LYS HB3 4.040 . 4.040 3.733 3.584 3.859 . 0 0 "[ . 1 . 2]" 1
835 1 44 LYS H 1 44 LYS HG2 4.090 . 4.090 3.746 2.598 4.139 0.049 17 0 "[ . 1 . 2]" 1
836 1 44 LYS H 1 44 LYS HG3 3.370 . 3.370 3.110 2.677 3.511 0.141 1 0 "[ . 1 . 2]" 1
837 1 44 LYS H 1 45 LEU H 4.430 . 4.430 4.338 4.230 4.441 0.011 5 0 "[ . 1 . 2]" 1
838 1 44 LYS HA 1 44 LYS QD 4.280 . 4.280 3.838 2.389 4.278 . 0 0 "[ . 1 . 2]" 1
839 1 44 LYS HA 1 44 LYS HG3 4.140 . 4.140 3.258 2.878 3.870 . 0 0 "[ . 1 . 2]" 1
840 1 44 LYS HA 1 45 LEU H 3.100 . 3.100 2.379 2.130 2.600 . 0 0 "[ . 1 . 2]" 1
841 1 44 LYS HA 1 59 GLY QA 3.570 . 3.570 2.448 1.814 3.474 . 0 0 "[ . 1 . 2]" 1
842 1 44 LYS HB2 1 44 LYS QE 4.650 . 4.650 3.894 3.292 4.309 . 0 0 "[ . 1 . 2]" 1
843 1 44 LYS HB2 1 45 LEU H 3.530 . 3.530 3.473 3.186 3.617 0.087 1 0 "[ . 1 . 2]" 1
844 1 44 LYS HB2 1 57 PHE HA 4.970 . 4.970 4.295 3.735 4.994 0.024 17 0 "[ . 1 . 2]" 1
845 1 44 LYS HB2 1 57 PHE HB2 4.480 . 4.480 3.852 3.417 4.490 0.010 16 0 "[ . 1 . 2]" 1
846 1 44 LYS HB2 1 57 PHE HB3 4.260 . 4.260 2.414 1.962 3.101 . 0 0 "[ . 1 . 2]" 1
847 1 44 LYS HB3 1 44 LYS QE 4.440 . 4.440 3.384 2.038 4.039 . 0 0 "[ . 1 . 2]" 1
848 1 44 LYS HB3 1 45 LEU H 3.140 . 3.140 2.355 1.983 2.697 . 0 0 "[ . 1 . 2]" 1
849 1 44 LYS HB3 1 57 PHE HA 4.360 . 4.360 3.773 3.493 4.213 . 0 0 "[ . 1 . 2]" 1
850 1 44 LYS HB3 1 57 PHE HB2 5.030 . 5.030 4.153 3.411 4.721 . 0 0 "[ . 1 . 2]" 1
851 1 44 LYS HB3 1 57 PHE HB3 4.160 . 4.160 2.815 2.134 3.357 . 0 0 "[ . 1 . 2]" 1
852 1 44 LYS HB3 1 59 GLY QA 4.560 . 4.560 3.346 2.718 3.979 . 0 0 "[ . 1 . 2]" 1
853 1 44 LYS QD 1 57 PHE HA 4.540 . 4.540 4.360 3.764 4.647 0.107 7 0 "[ . 1 . 2]" 1
854 1 44 LYS QD 1 57 PHE HB2 4.360 . 4.360 3.307 2.736 3.975 . 0 0 "[ . 1 . 2]" 1
855 1 44 LYS QD 1 57 PHE HB3 4.140 . 4.140 3.009 2.286 3.797 . 0 0 "[ . 1 . 2]" 1
856 1 44 LYS HD2 1 57 PHE HB2 5.220 . 5.220 4.043 2.941 5.070 . 0 0 "[ . 1 . 2]" 1
857 1 44 LYS HD2 1 57 PHE HB3 4.730 . 4.730 3.762 2.686 4.717 . 0 0 "[ . 1 . 2]" 1
858 1 44 LYS HD3 1 57 PHE HB2 5.220 . 5.220 3.825 2.971 5.284 0.064 9 0 "[ . 1 . 2]" 1
859 1 44 LYS HD3 1 57 PHE HB3 4.730 . 4.730 3.400 2.476 4.701 . 0 0 "[ . 1 . 2]" 1
860 1 44 LYS QE 1 44 LYS HG2 3.420 . 3.420 2.345 2.242 2.585 . 0 0 "[ . 1 . 2]" 1
861 1 44 LYS QE 1 44 LYS HG3 3.410 . 3.410 2.856 2.384 3.430 0.020 4 0 "[ . 1 . 2]" 1
862 1 44 LYS QE 1 45 LEU H 5.410 . 5.410 5.050 3.503 5.599 0.189 17 0 "[ . 1 . 2]" 1
863 1 44 LYS QE 1 58 LEU HA 4.590 . 4.590 3.072 1.756 3.932 . 0 0 "[ . 1 . 2]" 1
864 1 44 LYS QE 1 59 GLY H 4.310 . 4.310 3.219 2.060 4.258 . 0 0 "[ . 1 . 2]" 1
865 1 44 LYS HG2 1 45 LEU H 4.470 . 4.470 4.087 3.526 4.560 0.090 15 0 "[ . 1 . 2]" 1
866 1 44 LYS HG2 1 59 GLY H 4.750 . 4.750 3.896 2.503 4.783 0.033 15 0 "[ . 1 . 2]" 1
867 1 45 LEU H 1 45 LEU HB2 3.710 . 3.710 2.461 2.374 2.564 . 0 0 "[ . 1 . 2]" 1
868 1 45 LEU H 1 45 LEU HB3 4.060 . 4.060 3.637 3.563 3.718 . 0 0 "[ . 1 . 2]" 1
869 1 45 LEU H 1 45 LEU MD1 4.550 . 4.550 3.757 3.550 3.987 . 0 0 "[ . 1 . 2]" 1
870 1 45 LEU H 1 45 LEU QD 3.600 . 3.600 3.355 3.217 3.558 . 0 0 "[ . 1 . 2]" 1
871 1 45 LEU H 1 45 LEU MD2 4.550 . 4.550 3.778 3.636 4.000 . 0 0 "[ . 1 . 2]" 1
872 1 45 LEU H 1 45 LEU HG 4.050 . 4.050 2.767 2.523 3.123 . 0 0 "[ . 1 . 2]" 1
873 1 45 LEU H 1 47 ILE MD 4.400 . 4.400 4.084 3.731 4.411 0.011 19 0 "[ . 1 . 2]" 1
874 1 45 LEU H 1 57 PHE HA 4.650 . 4.650 4.177 3.794 4.473 . 0 0 "[ . 1 . 2]" 1
875 1 45 LEU H 1 57 PHE HB3 4.760 . 4.760 4.292 3.814 4.693 . 0 0 "[ . 1 . 2]" 1
876 1 45 LEU H 1 58 LEU H 3.620 . 3.620 3.099 2.780 3.337 . 0 0 "[ . 1 . 2]" 1
877 1 45 LEU H 1 59 GLY H 5.360 . 5.360 4.584 3.956 4.984 . 0 0 "[ . 1 . 2]" 1
878 1 45 LEU H 1 59 GLY QA 4.230 . 4.230 2.862 2.052 3.329 . 0 0 "[ . 1 . 2]" 1
879 1 45 LEU H 1 60 PRO HD3 4.720 . 4.720 4.270 3.500 4.687 . 0 0 "[ . 1 . 2]" 1
880 1 45 LEU H 1 63 ILE MD 5.100 . 5.100 4.539 4.172 4.822 . 0 0 "[ . 1 . 2]" 1
881 1 45 LEU HA 1 45 LEU MD1 3.960 . 3.960 3.901 3.874 3.929 . 0 0 "[ . 1 . 2]" 1
882 1 45 LEU HA 1 45 LEU QD 3.050 . 3.050 2.176 2.070 2.286 . 0 0 "[ . 1 . 2]" 1
883 1 45 LEU HA 1 45 LEU MD2 3.960 . 3.960 2.187 2.078 2.301 . 0 0 "[ . 1 . 2]" 1
884 1 45 LEU HA 1 45 LEU HG 3.880 . 3.880 3.098 3.006 3.201 . 0 0 "[ . 1 . 2]" 1
885 1 45 LEU HA 1 46 PRO QB 4.860 . 4.860 4.630 4.570 4.706 . 0 0 "[ . 1 . 2]" 1
886 1 45 LEU HA 1 46 PRO HD2 3.410 . 3.410 2.388 2.218 2.527 . 0 0 "[ . 1 . 2]" 1
887 1 45 LEU HA 1 46 PRO HD3 3.320 . 3.320 2.330 2.251 2.440 . 0 0 "[ . 1 . 2]" 1
888 1 45 LEU HA 1 46 PRO HG2 4.550 . 4.550 4.510 4.381 4.582 0.032 17 0 "[ . 1 . 2]" 1
889 1 45 LEU HB2 1 45 LEU MD1 3.630 . 3.630 2.272 2.245 2.306 . 0 0 "[ . 1 . 2]" 1
890 1 45 LEU HB2 1 45 LEU QD 3.010 . 3.010 2.227 2.203 2.256 . 0 0 "[ . 1 . 2]" 1
891 1 45 LEU HB2 1 45 LEU MD2 3.630 . 3.630 3.199 3.186 3.206 . 0 0 "[ . 1 . 2]" 1
892 1 45 LEU HB2 1 46 PRO HD2 3.990 . 3.990 3.876 3.700 4.009 0.019 6 0 "[ . 1 . 2]" 1
893 1 45 LEU HB2 1 46 PRO HD3 5.200 . 5.200 4.805 4.622 4.944 . 0 0 "[ . 1 . 2]" 1
894 1 45 LEU HB2 1 47 ILE MD 3.440 . 3.440 2.493 2.287 2.677 . 0 0 "[ . 1 . 2]" 1
895 1 45 LEU HB2 1 58 LEU H 5.000 . 5.000 3.803 3.538 4.064 . 0 0 "[ . 1 . 2]" 1
896 1 45 LEU HB2 1 60 PRO HD3 5.500 . 5.500 4.747 4.214 5.047 . 0 0 "[ . 1 . 2]" 1
897 1 45 LEU HB2 1 63 ILE MD 4.970 . 4.970 3.094 2.874 3.291 . 0 0 "[ . 1 . 2]" 1
898 1 45 LEU HB3 1 45 LEU MD1 3.310 . 3.310 2.410 2.380 2.468 . 0 0 "[ . 1 . 2]" 1
899 1 45 LEU HB3 1 45 LEU QD 2.880 . 2.880 2.106 2.093 2.114 . 0 0 "[ . 1 . 2]" 1
900 1 45 LEU HB3 1 45 LEU MD2 3.310 . 3.310 2.324 2.296 2.349 . 0 0 "[ . 1 . 2]" 1
901 1 45 LEU HB3 1 46 PRO HD2 4.310 . 4.310 2.389 2.173 2.567 . 0 0 "[ . 1 . 2]" 1
902 1 45 LEU HB3 1 46 PRO HD3 4.140 . 4.140 3.725 3.498 3.934 . 0 0 "[ . 1 . 2]" 1
903 1 45 LEU HB3 1 47 ILE MD 3.420 . 3.420 3.103 2.835 3.317 . 0 0 "[ . 1 . 2]" 1
904 1 45 LEU HB3 1 47 ILE HG12 5.020 . 5.020 4.432 4.170 4.743 . 0 0 "[ . 1 . 2]" 1
905 1 45 LEU HB3 1 63 ILE MD 4.340 . 4.340 4.000 3.651 4.203 . 0 0 "[ . 1 . 2]" 1
906 1 45 LEU QD 1 46 PRO HD2 3.570 . 3.570 2.833 2.679 2.961 . 0 0 "[ . 1 . 2]" 1
907 1 45 LEU QD 1 46 PRO HD3 3.480 . 3.480 3.493 3.393 3.529 0.049 4 0 "[ . 1 . 2]" 1
908 1 45 LEU QD 1 46 PRO HG3 4.870 . 4.870 4.800 4.651 4.905 0.035 9 0 "[ . 1 . 2]" 1
909 1 45 LEU QD 1 60 PRO HA 3.750 . 3.750 2.875 2.104 3.265 . 0 0 "[ . 1 . 2]" 1
910 1 45 LEU QD 1 60 PRO QB 3.640 . 3.640 2.716 2.087 3.168 . 0 0 "[ . 1 . 2]" 1
911 1 45 LEU QD 1 60 PRO HD2 4.820 . 4.820 4.351 3.654 4.773 . 0 0 "[ . 1 . 2]" 1
912 1 45 LEU QD 1 60 PRO HD3 3.770 . 3.770 3.091 2.351 3.507 . 0 0 "[ . 1 . 2]" 1
913 1 45 LEU QD 1 60 PRO HG3 4.090 . 4.090 3.815 3.235 4.098 0.008 16 0 "[ . 1 . 2]" 1
914 1 45 LEU QD 1 63 ILE MD 2.890 . 2.890 1.964 1.858 2.115 . 0 0 "[ . 1 . 2]" 1
915 1 45 LEU HG 1 63 ILE MD 3.960 . 3.960 3.921 3.826 3.993 0.033 19 0 "[ . 1 . 2]" 1
916 1 46 PRO HA 1 47 ILE H 3.040 . 3.040 2.158 2.106 2.216 . 0 0 "[ . 1 . 2]" 1
917 1 46 PRO HA 1 55 THR MG 4.840 . 4.840 3.768 3.264 4.422 . 0 0 "[ . 1 . 2]" 1
918 1 46 PRO HA 1 56 ALA H 5.220 . 5.220 4.731 4.473 5.087 . 0 0 "[ . 1 . 2]" 1
919 1 46 PRO HA 1 57 PHE HA 3.760 . 3.760 3.024 2.545 3.282 . 0 0 "[ . 1 . 2]" 1
920 1 46 PRO HA 1 57 PHE QD 3.700 . 3.700 2.598 2.104 3.225 . 0 0 "[ . 1 . 2]" 1
921 1 46 PRO HA 1 57 PHE QE 4.400 . 4.400 3.086 2.783 3.465 . 0 0 "[ . 1 . 2]" 1
922 1 46 PRO QB 1 47 ILE H 4.530 . 4.530 3.398 3.249 3.461 . 0 0 "[ . 1 . 2]" 1
923 1 46 PRO QB 1 55 THR MG 5.040 . 5.040 3.453 2.869 3.988 . 0 0 "[ . 1 . 2]" 1
924 1 46 PRO QB 1 57 PHE QD 4.590 . 4.590 3.555 2.781 4.071 . 0 0 "[ . 1 . 2]" 1
925 1 46 PRO QB 1 57 PHE QE 4.390 . 4.390 2.471 2.126 2.912 . 0 0 "[ . 1 . 2]" 1
926 1 47 ILE H 1 47 ILE HB 3.260 . 3.260 2.627 2.568 2.694 . 0 0 "[ . 1 . 2]" 1
927 1 47 ILE H 1 47 ILE MD 3.950 . 3.950 3.574 3.493 3.727 . 0 0 "[ . 1 . 2]" 1
928 1 47 ILE H 1 47 ILE HG13 4.350 . 4.350 4.119 4.003 4.234 . 0 0 "[ . 1 . 2]" 1
929 1 47 ILE H 1 47 ILE MG 3.970 . 3.970 3.848 3.822 3.876 . 0 0 "[ . 1 . 2]" 1
930 1 47 ILE H 1 48 PHE H 5.270 . 5.270 4.199 3.987 4.274 . 0 0 "[ . 1 . 2]" 1
931 1 47 ILE H 1 55 THR MG 4.010 . 4.010 3.034 2.610 3.376 . 0 0 "[ . 1 . 2]" 1
932 1 47 ILE H 1 56 ALA H 3.600 . 3.600 2.952 2.805 3.137 . 0 0 "[ . 1 . 2]" 1
933 1 47 ILE H 1 56 ALA MB 4.580 . 4.580 3.859 3.629 4.066 . 0 0 "[ . 1 . 2]" 1
934 1 47 ILE H 1 57 PHE HA 3.880 . 3.880 3.086 2.933 3.209 . 0 0 "[ . 1 . 2]" 1
935 1 47 ILE H 1 57 PHE QD 4.510 . 4.510 4.129 3.718 4.515 0.005 7 0 "[ . 1 . 2]" 1
936 1 47 ILE H 1 58 LEU H 4.980 . 4.980 4.141 3.960 4.364 . 0 0 "[ . 1 . 2]" 1
937 1 47 ILE HA 1 47 ILE MD 3.210 . 3.210 2.127 2.071 2.180 . 0 0 "[ . 1 . 2]" 1
938 1 47 ILE HA 1 47 ILE MG 3.400 . 3.400 2.406 2.364 2.458 . 0 0 "[ . 1 . 2]" 1
939 1 47 ILE HA 1 48 PHE H 3.190 . 3.190 2.086 2.047 2.144 . 0 0 "[ . 1 . 2]" 1
940 1 47 ILE HB 1 48 PHE H 4.270 . 4.270 4.152 4.072 4.290 0.020 9 0 "[ . 1 . 2]" 1
941 1 47 ILE HB 1 49 PHE QD 5.370 . 5.370 4.948 4.234 5.359 . 0 0 "[ . 1 . 2]" 1
942 1 47 ILE HB 1 49 PHE QE 4.930 . 4.930 4.143 2.998 4.818 . 0 0 "[ . 1 . 2]" 1
943 1 47 ILE HB 1 56 ALA H 3.730 . 3.730 2.988 2.793 3.130 . 0 0 "[ . 1 . 2]" 1
944 1 47 ILE HB 1 56 ALA MB 3.840 . 3.840 2.407 2.221 2.621 . 0 0 "[ . 1 . 2]" 1
945 1 47 ILE MD 1 47 ILE MG 2.910 . 2.910 2.082 2.039 2.121 . 0 0 "[ . 1 . 2]" 1
946 1 47 ILE MD 1 48 PHE H 3.860 . 3.860 3.797 3.667 3.884 0.024 11 0 "[ . 1 . 2]" 1
947 1 47 ILE MD 1 56 ALA H 5.380 . 5.380 5.382 5.238 5.443 0.063 15 0 "[ . 1 . 2]" 1
948 1 47 ILE MD 1 58 LEU H 4.240 . 4.240 3.421 3.076 3.721 . 0 0 "[ . 1 . 2]" 1
949 1 47 ILE MD 1 58 LEU HB2 4.090 . 4.090 3.134 2.868 3.477 . 0 0 "[ . 1 . 2]" 1
950 1 47 ILE MD 1 63 ILE MD 3.140 . 3.140 2.381 2.049 2.750 . 0 0 "[ . 1 . 2]" 1
951 1 47 ILE HG12 1 57 PHE H 5.180 . 5.180 4.857 4.529 5.141 . 0 0 "[ . 1 . 2]" 1
952 1 47 ILE HG12 1 57 PHE HA 4.180 . 4.180 2.894 2.538 3.190 . 0 0 "[ . 1 . 2]" 1
953 1 47 ILE HG12 1 58 LEU H 4.100 . 4.100 2.245 1.980 2.449 . 0 0 "[ . 1 . 2]" 1
954 1 47 ILE HG13 1 57 PHE HA 4.600 . 4.600 4.153 3.790 4.543 . 0 0 "[ . 1 . 2]" 1
955 1 47 ILE HG13 1 58 LEU H 3.680 . 3.680 2.963 2.670 3.278 . 0 0 "[ . 1 . 2]" 1
956 1 47 ILE HG13 1 58 LEU HB2 4.410 . 4.410 2.120 1.888 2.456 . 0 0 "[ . 1 . 2]" 1
957 1 47 ILE MG 1 48 PHE H 3.430 . 3.430 2.819 2.661 3.125 . 0 0 "[ . 1 . 2]" 1
958 1 47 ILE MG 1 49 PHE H 4.420 . 4.420 3.882 3.710 4.125 . 0 0 "[ . 1 . 2]" 1
959 1 47 ILE MG 1 49 PHE HA 4.600 . 4.600 3.695 3.542 3.815 . 0 0 "[ . 1 . 2]" 1
960 1 47 ILE MG 1 49 PHE QD 4.100 . 4.100 3.648 3.285 3.805 . 0 0 "[ . 1 . 2]" 1
961 1 47 ILE MG 1 49 PHE QE 4.300 . 4.300 3.388 2.911 3.706 . 0 0 "[ . 1 . 2]" 1
962 1 47 ILE MG 1 49 PHE HZ 4.980 . 4.980 3.752 3.134 4.174 . 0 0 "[ . 1 . 2]" 1
963 1 47 ILE MG 1 56 ALA H 4.390 . 4.390 3.840 3.624 4.020 . 0 0 "[ . 1 . 2]" 1
964 1 47 ILE MG 1 56 ALA MB 3.880 . 3.880 3.220 2.917 3.470 . 0 0 "[ . 1 . 2]" 1
965 1 47 ILE MG 1 58 LEU H 5.000 . 5.000 4.680 4.379 4.893 . 0 0 "[ . 1 . 2]" 1
966 1 47 ILE MG 1 63 ILE MG 3.590 . 3.590 3.164 2.979 3.398 . 0 0 "[ . 1 . 2]" 1
967 1 48 PHE H 1 48 PHE HB2 3.850 . 3.850 2.953 2.762 3.082 . 0 0 "[ . 1 . 2]" 1
968 1 48 PHE H 1 48 PHE HB3 3.800 . 3.800 2.475 2.299 2.589 . 0 0 "[ . 1 . 2]" 1
969 1 48 PHE H 1 48 PHE QD 4.530 . 4.530 4.197 4.097 4.271 . 0 0 "[ . 1 . 2]" 1
970 1 48 PHE H 1 56 ALA MB 5.500 . 5.500 5.585 5.545 5.621 0.121 1 0 "[ . 1 . 2]" 1
971 1 48 PHE HA 1 49 PHE H 3.020 . 3.020 2.109 2.069 2.153 . 0 0 "[ . 1 . 2]" 1
972 1 48 PHE HA 1 49 PHE QD 5.040 . 5.040 4.215 3.494 4.704 . 0 0 "[ . 1 . 2]" 1
973 1 48 PHE HA 1 55 THR HA 3.690 . 3.690 2.341 2.148 2.477 . 0 0 "[ . 1 . 2]" 1
974 1 48 PHE HA 1 55 THR HB 5.030 . 5.030 4.781 4.447 4.953 . 0 0 "[ . 1 . 2]" 1
975 1 48 PHE HA 1 55 THR MG 3.530 . 3.530 2.515 2.369 2.644 . 0 0 "[ . 1 . 2]" 1
976 1 48 PHE HA 1 56 ALA H 3.900 . 3.900 3.573 3.395 3.736 . 0 0 "[ . 1 . 2]" 1
977 1 48 PHE HB2 1 49 PHE H 4.420 . 4.420 4.289 4.193 4.381 . 0 0 "[ . 1 . 2]" 1
978 1 48 PHE HB2 1 55 THR HA 4.720 . 4.720 4.420 4.132 4.608 . 0 0 "[ . 1 . 2]" 1
979 1 48 PHE QD 1 49 PHE H 4.330 . 4.330 3.743 3.375 3.904 . 0 0 "[ . 1 . 2]" 1
980 1 48 PHE QD 1 53 HIS HA 5.160 . 5.160 4.048 3.562 4.233 . 0 0 "[ . 1 . 2]" 1
981 1 48 PHE QD 1 55 THR MG 3.680 . 3.680 3.242 2.792 3.689 0.009 4 0 "[ . 1 . 2]" 1
982 1 48 PHE QE 1 50 PHE HA 4.190 . 4.190 3.143 2.887 3.417 . 0 0 "[ . 1 . 2]" 1
983 1 48 PHE QE 1 50 PHE QD 4.700 . 4.700 2.880 2.465 3.645 . 0 0 "[ . 1 . 2]" 1
984 1 48 PHE QE 1 51 GLY H 4.770 . 4.770 4.625 4.378 4.816 0.046 1 0 "[ . 1 . 2]" 1
985 1 48 PHE QE 1 53 HIS H 4.480 . 4.480 4.428 4.086 4.542 0.062 14 0 "[ . 1 . 2]" 1
986 1 48 PHE QE 1 53 HIS HA 4.020 . 4.020 2.853 1.994 3.162 . 0 0 "[ . 1 . 2]" 1
987 1 48 PHE QE 1 53 HIS HB2 5.010 . 5.010 4.421 3.849 4.752 . 0 0 "[ . 1 . 2]" 1
988 1 48 PHE QE 1 53 HIS QB 4.210 . 4.210 2.909 2.420 3.235 . 0 0 "[ . 1 . 2]" 1
989 1 48 PHE QE 1 53 HIS HB3 5.010 . 5.010 2.951 2.439 3.292 . 0 0 "[ . 1 . 2]" 1
990 1 48 PHE QE 1 53 HIS HD2 4.320 . 4.320 4.097 3.045 4.385 0.065 9 0 "[ . 1 . 2]" 1
991 1 48 PHE QE 1 95 VAL QG 3.260 . 3.260 2.430 1.994 2.965 . 0 0 "[ . 1 . 2]" 1
992 1 48 PHE HZ 1 53 HIS HA 4.410 . 4.410 2.652 2.258 2.945 . 0 0 "[ . 1 . 2]" 1
993 1 48 PHE HZ 1 53 HIS HB2 5.140 . 5.140 4.262 3.951 4.708 . 0 0 "[ . 1 . 2]" 1
994 1 48 PHE HZ 1 53 HIS QB 4.300 . 4.300 2.990 2.393 3.703 . 0 0 "[ . 1 . 2]" 1
995 1 48 PHE HZ 1 53 HIS HB3 5.140 . 5.140 3.064 2.411 3.874 . 0 0 "[ . 1 . 2]" 1
996 1 48 PHE HZ 1 53 HIS HD2 4.050 . 4.050 3.753 3.028 4.099 0.049 6 0 "[ . 1 . 2]" 1
997 1 48 PHE HZ 1 95 VAL QG 3.790 . 3.790 3.214 2.236 3.820 0.030 15 0 "[ . 1 . 2]" 1
998 1 49 PHE H 1 49 PHE QB 3.360 . 3.360 2.442 2.389 2.484 . 0 0 "[ . 1 . 2]" 1
999 1 49 PHE H 1 49 PHE QD 3.360 . 3.360 2.757 2.259 3.158 . 0 0 "[ . 1 . 2]" 1
1000 1 49 PHE H 1 53 HIS H 5.500 . 5.500 4.935 4.750 5.118 . 0 0 "[ . 1 . 2]" 1
1001 1 49 PHE H 1 53 HIS HA 5.500 . 5.500 4.447 4.201 4.794 . 0 0 "[ . 1 . 2]" 1
1002 1 49 PHE H 1 54 GLU H 3.990 . 3.990 3.810 3.586 3.957 . 0 0 "[ . 1 . 2]" 1
1003 1 49 PHE H 1 54 GLU HB3 4.610 . 4.610 4.650 4.624 4.725 0.115 20 0 "[ . 1 . 2]" 1
1004 1 49 PHE H 1 55 THR HA 3.890 . 3.890 2.784 2.621 2.881 . 0 0 "[ . 1 . 2]" 1
1005 1 49 PHE H 1 55 THR MG 3.990 . 3.990 4.061 4.027 4.087 0.097 17 0 "[ . 1 . 2]" 1
1006 1 49 PHE H 1 56 ALA H 4.160 . 4.160 4.233 4.202 4.271 0.111 6 0 "[ . 1 . 2]" 1
1007 1 49 PHE HA 1 50 PHE H 3.320 . 3.320 2.128 2.084 2.182 . 0 0 "[ . 1 . 2]" 1
1008 1 49 PHE QB 1 50 PHE H 4.080 . 4.080 3.015 2.879 3.175 . 0 0 "[ . 1 . 2]" 1
1009 1 49 PHE QB 1 52 THR H 4.400 . 4.400 3.572 3.413 3.754 . 0 0 "[ . 1 . 2]" 1
1010 1 49 PHE QB 1 52 THR MG 5.020 . 5.020 3.901 3.586 4.206 . 0 0 "[ . 1 . 2]" 1
1011 1 49 PHE QB 1 53 HIS H 4.460 . 4.460 3.530 3.389 3.711 . 0 0 "[ . 1 . 2]" 1
1012 1 49 PHE QB 1 54 GLU H 3.460 . 3.460 2.565 2.337 3.002 . 0 0 "[ . 1 . 2]" 1
1013 1 49 PHE QB 1 54 GLU HB2 4.320 . 4.320 2.195 2.009 2.951 . 0 0 "[ . 1 . 2]" 1
1014 1 49 PHE QD 1 50 PHE H 4.840 . 4.840 3.748 3.551 3.947 . 0 0 "[ . 1 . 2]" 1
1015 1 49 PHE QD 1 54 GLU HB2 4.760 . 4.760 2.390 1.981 3.411 . 0 0 "[ . 1 . 2]" 1
1016 1 49 PHE QD 1 55 THR HA 4.230 . 4.230 3.267 2.732 3.856 . 0 0 "[ . 1 . 2]" 1
1017 1 49 PHE QD 1 56 ALA H 4.750 . 4.750 4.001 3.425 4.505 . 0 0 "[ . 1 . 2]" 1
1018 1 49 PHE QD 1 56 ALA MB 4.340 . 4.340 3.402 2.945 3.732 . 0 0 "[ . 1 . 2]" 1
1019 1 49 PHE QE 1 56 ALA H 5.050 . 5.050 3.831 3.180 4.511 . 0 0 "[ . 1 . 2]" 1
1020 1 49 PHE QE 1 56 ALA MB 3.170 . 3.170 1.827 1.708 1.964 . 0 0 "[ . 1 . 2]" 1
1021 1 49 PHE QE 1 58 LEU MD1 4.910 . 4.910 3.492 3.123 3.760 . 0 0 "[ . 1 . 2]" 1
1022 1 49 PHE HZ 1 56 ALA MB 4.110 . 4.110 2.877 2.349 3.377 . 0 0 "[ . 1 . 2]" 1
1023 1 49 PHE HZ 1 58 LEU MD1 3.670 . 3.670 2.846 2.217 3.443 . 0 0 "[ . 1 . 2]" 1
1024 1 50 PHE H 1 50 PHE HB2 4.100 . 4.100 2.374 2.324 2.448 . 0 0 "[ . 1 . 2]" 1
1025 1 50 PHE H 1 50 PHE QB 3.580 . 3.580 2.342 2.295 2.410 . 0 0 "[ . 1 . 2]" 1
1026 1 50 PHE H 1 50 PHE HB3 4.100 . 4.100 3.584 3.552 3.615 . 0 0 "[ . 1 . 2]" 1
1027 1 50 PHE H 1 50 PHE QD 4.050 . 4.050 2.860 2.575 3.147 . 0 0 "[ . 1 . 2]" 1
1028 1 50 PHE H 1 50 PHE QE 5.130 . 5.130 4.701 4.523 4.840 . 0 0 "[ . 1 . 2]" 1
1029 1 50 PHE H 1 51 GLY H 4.760 . 4.760 4.563 4.530 4.614 . 0 0 "[ . 1 . 2]" 1
1030 1 50 PHE H 1 52 THR H 4.820 . 4.820 4.431 4.317 4.557 . 0 0 "[ . 1 . 2]" 1
1031 1 50 PHE HA 1 50 PHE QD 3.860 . 3.860 2.551 2.263 2.717 . 0 0 "[ . 1 . 2]" 1
1032 1 50 PHE HA 1 50 PHE QE 4.370 . 4.370 4.424 4.390 4.455 0.085 6 0 "[ . 1 . 2]" 1
1033 1 50 PHE HA 1 51 GLY H 3.500 . 3.500 2.324 2.269 2.387 . 0 0 "[ . 1 . 2]" 1
1034 1 50 PHE HA 1 51 GLY HA2 4.920 . 4.920 4.488 4.447 4.547 . 0 0 "[ . 1 . 2]" 1
1035 1 50 PHE HA 1 51 GLY HA3 4.790 . 4.790 4.539 4.497 4.592 . 0 0 "[ . 1 . 2]" 1
1036 1 50 PHE HA 1 53 HIS H 4.580 . 4.580 3.310 3.100 3.503 . 0 0 "[ . 1 . 2]" 1
1037 1 50 PHE HA 1 53 HIS HD2 4.210 . 4.210 3.519 2.649 4.091 . 0 0 "[ . 1 . 2]" 1
1038 1 50 PHE HA 1 85 GLY HA2 4.700 . 4.700 4.062 3.954 4.160 . 0 0 "[ . 1 . 2]" 1
1039 1 50 PHE HA 1 95 VAL QG 4.580 . 4.580 4.034 3.428 4.582 0.002 14 0 "[ . 1 . 2]" 1
1040 1 50 PHE QB 1 85 GLY HA3 4.460 . 4.460 2.517 2.265 2.857 . 0 0 "[ . 1 . 2]" 1
1041 1 50 PHE QB 1 88 GLU HB2 4.220 . 4.220 2.145 2.026 2.474 . 0 0 "[ . 1 . 2]" 1
1042 1 50 PHE QB 1 89 ILE HB 4.790 . 4.790 3.119 2.763 3.495 . 0 0 "[ . 1 . 2]" 1
1043 1 50 PHE QB 1 89 ILE MD 4.720 . 4.720 4.057 3.802 4.474 . 0 0 "[ . 1 . 2]" 1
1044 1 50 PHE HB2 1 51 GLY H 4.340 . 4.340 3.842 3.721 3.977 . 0 0 "[ . 1 . 2]" 1
1045 1 50 PHE HB2 1 85 GLY HA2 4.540 . 4.540 3.069 2.791 3.331 . 0 0 "[ . 1 . 2]" 1
1046 1 50 PHE HB3 1 51 GLY H 4.340 . 4.340 2.615 2.395 2.814 . 0 0 "[ . 1 . 2]" 1
1047 1 50 PHE HB3 1 85 GLY HA2 4.540 . 4.540 2.112 1.950 2.395 . 0 0 "[ . 1 . 2]" 1
1048 1 50 PHE QD 1 51 GLY H 4.320 . 4.320 3.413 3.161 3.611 . 0 0 "[ . 1 . 2]" 1
1049 1 50 PHE QD 1 88 GLU HB3 4.130 . 4.130 2.374 1.930 3.017 . 0 0 "[ . 1 . 2]" 1
1050 1 50 PHE QD 1 89 ILE HA 4.570 . 4.570 3.911 3.643 4.259 . 0 0 "[ . 1 . 2]" 1
1051 1 50 PHE QD 1 89 ILE HB 4.570 . 4.570 2.638 2.338 3.084 . 0 0 "[ . 1 . 2]" 1
1052 1 50 PHE QD 1 89 ILE MD 3.610 . 3.610 2.595 2.300 2.943 . 0 0 "[ . 1 . 2]" 1
1053 1 50 PHE QD 1 89 ILE MG 4.320 . 4.320 3.851 3.608 4.203 . 0 0 "[ . 1 . 2]" 1
1054 1 50 PHE QE 1 89 ILE HA 4.320 . 4.320 3.512 3.085 3.966 . 0 0 "[ . 1 . 2]" 1
1055 1 50 PHE QE 1 89 ILE MD 3.560 . 3.560 2.494 2.211 2.814 . 0 0 "[ . 1 . 2]" 1
1056 1 50 PHE QE 1 89 ILE QG 4.650 . 4.650 2.601 2.374 2.862 . 0 0 "[ . 1 . 2]" 1
1057 1 50 PHE QE 1 89 ILE MG 4.670 . 4.670 4.476 4.300 4.692 0.022 9 0 "[ . 1 . 2]" 1
1058 1 50 PHE QE 1 93 PRO HA 4.010 . 4.010 2.893 2.224 3.863 . 0 0 "[ . 1 . 2]" 1
1059 1 50 PHE HZ 1 89 ILE HA 4.830 . 4.830 3.774 3.314 4.346 . 0 0 "[ . 1 . 2]" 1
1060 1 50 PHE HZ 1 93 PRO HA 3.810 . 3.810 2.754 2.402 3.456 . 0 0 "[ . 1 . 2]" 1
1061 1 51 GLY H 1 52 THR H 4.270 . 4.270 3.091 2.989 3.223 . 0 0 "[ . 1 . 2]" 1
1062 1 51 GLY H 1 52 THR MG 5.450 . 5.450 5.157 5.026 5.312 . 0 0 "[ . 1 . 2]" 1
1063 1 51 GLY H 1 53 HIS H 4.730 . 4.730 3.568 3.474 3.685 . 0 0 "[ . 1 . 2]" 1
1064 1 51 GLY H 1 53 HIS HD2 4.040 . 4.040 2.779 2.583 3.029 . 0 0 "[ . 1 . 2]" 1
1065 1 51 GLY H 1 85 GLY H 5.480 . 5.480 4.679 4.497 4.937 . 0 0 "[ . 1 . 2]" 1
1066 1 51 GLY H 1 85 GLY HA2 4.490 . 4.490 2.858 2.763 2.940 . 0 0 "[ . 1 . 2]" 1
1067 1 51 GLY H 1 85 GLY HA3 4.740 . 4.740 3.760 3.491 3.965 . 0 0 "[ . 1 . 2]" 1
1068 1 51 GLY H 1 88 GLU HB2 4.630 . 4.630 3.269 3.038 3.525 . 0 0 "[ . 1 . 2]" 1
1069 1 51 GLY H 1 88 GLU HB3 4.450 . 4.450 4.052 3.767 4.366 . 0 0 "[ . 1 . 2]" 1
1070 1 51 GLY H 1 95 VAL QG 5.440 . 5.440 4.333 3.706 5.034 . 0 0 "[ . 1 . 2]" 1
1071 1 51 GLY HA2 1 52 THR HA 4.990 . 4.990 4.433 4.401 4.471 . 0 0 "[ . 1 . 2]" 1
1072 1 51 GLY HA2 1 52 THR MG 4.710 . 4.710 4.530 4.427 4.620 . 0 0 "[ . 1 . 2]" 1
1073 1 51 GLY HA2 1 84 GLU H 5.500 . 5.500 5.063 4.869 5.343 . 0 0 "[ . 1 . 2]" 1
1074 1 51 GLY HA2 1 84 GLU HB2 4.510 . 4.510 2.862 2.506 3.288 . 0 0 "[ . 1 . 2]" 1
1075 1 51 GLY HA2 1 84 GLU QB 3.960 . 3.960 2.606 2.417 2.892 . 0 0 "[ . 1 . 2]" 1
1076 1 51 GLY HA2 1 84 GLU HB3 4.510 . 4.510 3.078 2.627 3.521 . 0 0 "[ . 1 . 2]" 1
1077 1 51 GLY HA2 1 85 GLY H 4.330 . 4.330 3.673 3.559 3.838 . 0 0 "[ . 1 . 2]" 1
1078 1 51 GLY HA2 1 85 GLY HA2 4.750 . 4.750 3.237 2.955 3.502 . 0 0 "[ . 1 . 2]" 1
1079 1 51 GLY HA2 1 85 GLY HA3 5.380 . 5.380 3.994 3.784 4.159 . 0 0 "[ . 1 . 2]" 1
1080 1 51 GLY HA3 1 52 THR MG 4.620 . 4.620 3.649 3.519 3.772 . 0 0 "[ . 1 . 2]" 1
1081 1 51 GLY HA3 1 53 HIS H 4.880 . 4.880 4.646 4.579 4.716 . 0 0 "[ . 1 . 2]" 1
1082 1 51 GLY HA3 1 81 GLY HA3 5.010 . 5.010 3.687 3.238 4.189 . 0 0 "[ . 1 . 2]" 1
1083 1 51 GLY HA3 1 84 GLU HB2 4.480 . 4.480 2.699 2.593 2.882 . 0 0 "[ . 1 . 2]" 1
1084 1 51 GLY HA3 1 84 GLU QB 3.940 . 3.940 2.634 2.546 2.778 . 0 0 "[ . 1 . 2]" 1
1085 1 51 GLY HA3 1 84 GLU HB3 4.480 . 4.480 3.734 3.338 4.099 . 0 0 "[ . 1 . 2]" 1
1086 1 51 GLY HA3 1 84 GLU QG 4.750 . 4.750 4.706 4.552 4.786 0.036 10 0 "[ . 1 . 2]" 1
1087 1 51 GLY HA3 1 85 GLY H 4.110 . 4.110 2.536 2.424 2.658 . 0 0 "[ . 1 . 2]" 1
1088 1 51 GLY HA3 1 85 GLY HA2 4.530 . 4.530 2.902 2.446 3.238 . 0 0 "[ . 1 . 2]" 1
1089 1 51 GLY HA3 1 85 GLY HA3 4.070 . 4.070 2.830 2.458 3.031 . 0 0 "[ . 1 . 2]" 1
1090 1 52 THR H 1 52 THR MG 3.080 . 3.080 2.822 2.696 2.944 . 0 0 "[ . 1 . 2]" 1
1091 1 52 THR H 1 53 HIS H 3.190 . 3.190 1.872 1.838 1.908 . 0 0 "[ . 1 . 2]" 1
1092 1 52 THR H 1 53 HIS HA 4.360 . 4.360 4.039 3.991 4.102 . 0 0 "[ . 1 . 2]" 1
1093 1 52 THR H 1 53 HIS HD2 4.670 . 4.670 3.463 3.297 3.650 . 0 0 "[ . 1 . 2]" 1
1094 1 52 THR H 1 54 GLU H 4.100 . 4.100 3.685 3.564 3.765 . 0 0 "[ . 1 . 2]" 1
1095 1 52 THR H 1 81 GLY HA3 5.500 . 5.500 4.411 3.969 4.894 . 0 0 "[ . 1 . 2]" 1
1096 1 52 THR HA 1 52 THR MG 2.890 . 2.890 2.303 2.274 2.350 . 0 0 "[ . 1 . 2]" 1
1097 1 52 THR HA 1 53 HIS HD2 4.840 . 4.840 4.338 3.913 4.888 0.048 19 0 "[ . 1 . 2]" 1
1098 1 52 THR HB 1 54 GLU H 4.140 . 4.140 3.291 2.982 3.521 . 0 0 "[ . 1 . 2]" 1
1099 1 52 THR HB 1 54 GLU HB2 4.700 . 4.700 3.795 3.123 4.121 . 0 0 "[ . 1 . 2]" 1
1100 1 52 THR HB 1 54 GLU HB3 5.160 . 5.160 4.840 4.541 5.014 . 0 0 "[ . 1 . 2]" 1
1101 1 52 THR HB 1 54 GLU QG 3.220 . 3.220 2.128 1.946 2.603 . 0 0 "[ . 1 . 2]" 1
1102 1 52 THR MG 1 53 HIS H 4.340 . 4.340 4.034 3.920 4.111 . 0 0 "[ . 1 . 2]" 1
1103 1 52 THR MG 1 54 GLU H 4.920 . 4.920 4.335 4.117 4.449 . 0 0 "[ . 1 . 2]" 1
1104 1 52 THR MG 1 54 GLU QG 4.080 . 4.080 3.565 3.312 3.988 . 0 0 "[ . 1 . 2]" 1
1105 1 52 THR MG 1 81 GLY HA2 3.920 . 3.920 3.136 2.838 3.416 . 0 0 "[ . 1 . 2]" 1
1106 1 52 THR MG 1 81 GLY HA3 3.490 . 3.490 2.032 1.776 2.383 . 0 0 "[ . 1 . 2]" 1
1107 1 52 THR MG 1 82 PHE H 4.980 . 4.980 4.211 3.881 4.449 . 0 0 "[ . 1 . 2]" 1
1108 1 52 THR MG 1 82 PHE HA 4.910 . 4.910 4.628 4.216 4.926 0.016 17 0 "[ . 1 . 2]" 1
1109 1 53 HIS H 1 53 HIS HB2 4.150 . 4.150 3.553 3.461 3.639 . 0 0 "[ . 1 . 2]" 1
1110 1 53 HIS H 1 53 HIS HB3 4.150 . 4.150 4.129 4.094 4.154 0.004 17 0 "[ . 1 . 2]" 1
1111 1 53 HIS H 1 53 HIS HD2 3.790 . 3.790 2.677 2.497 2.906 . 0 0 "[ . 1 . 2]" 1
1112 1 53 HIS H 1 54 GLU H 3.360 . 3.360 2.497 2.451 2.536 . 0 0 "[ . 1 . 2]" 1
1113 1 53 HIS H 1 54 GLU HB2 4.760 . 4.760 4.566 4.478 4.674 . 0 0 "[ . 1 . 2]" 1
1114 1 53 HIS H 1 54 GLU QG 4.850 . 4.850 4.175 3.935 4.569 . 0 0 "[ . 1 . 2]" 1
1115 1 53 HIS HA 1 53 HIS HD2 3.960 . 3.960 3.015 2.404 3.291 . 0 0 "[ . 1 . 2]" 1
1116 1 53 HIS QB 1 54 GLU H 4.020 . 4.020 3.771 3.653 3.826 . 0 0 "[ . 1 . 2]" 1
1117 1 53 HIS HB2 1 54 GLU H 4.630 . 4.630 4.102 3.936 4.195 . 0 0 "[ . 1 . 2]" 1
1118 1 53 HIS HB3 1 54 GLU H 4.630 . 4.630 4.403 4.317 4.485 . 0 0 "[ . 1 . 2]" 1
1119 1 53 HIS HD2 1 95 VAL QG 4.980 . 4.980 4.210 3.028 4.909 . 0 0 "[ . 1 . 2]" 1
1120 1 53 HIS HE1 1 95 VAL MG1 5.500 . 5.500 3.901 2.859 5.228 . 0 0 "[ . 1 . 2]" 1
1121 1 53 HIS HE1 1 95 VAL QG 4.300 . 4.300 2.668 1.946 4.318 0.018 19 0 "[ . 1 . 2]" 1
1122 1 53 HIS HE1 1 95 VAL MG2 5.500 . 5.500 2.731 1.956 4.601 . 0 0 "[ . 1 . 2]" 1
1123 1 54 GLU H 1 54 GLU HB2 3.280 . 3.280 2.341 2.259 2.412 . 0 0 "[ . 1 . 2]" 1
1124 1 54 GLU H 1 54 GLU HB3 3.730 . 3.730 3.542 3.518 3.578 . 0 0 "[ . 1 . 2]" 1
1125 1 54 GLU H 1 54 GLU QG 3.240 . 3.240 2.414 2.224 2.789 . 0 0 "[ . 1 . 2]" 1
1126 1 54 GLU H 1 55 THR H 4.510 . 4.510 4.531 4.417 4.564 0.054 14 0 "[ . 1 . 2]" 1
1127 1 54 GLU HA 1 54 GLU QG 3.220 . 3.220 2.539 2.336 2.894 . 0 0 "[ . 1 . 2]" 1
1128 1 54 GLU HA 1 55 THR H 2.830 . 2.830 2.446 2.237 2.597 . 0 0 "[ . 1 . 2]" 1
1129 1 54 GLU HB2 1 55 THR H 3.620 . 3.620 3.569 3.330 3.651 0.031 8 0 "[ . 1 . 2]" 1
1130 1 54 GLU HB3 1 55 THR H 3.250 . 3.250 2.355 2.106 2.532 . 0 0 "[ . 1 . 2]" 1
1131 1 54 GLU HB3 1 55 THR HA 4.820 . 4.820 4.270 4.137 4.351 . 0 0 "[ . 1 . 2]" 1
1132 1 54 GLU QG 1 55 THR H 3.980 . 3.980 3.878 3.662 4.120 0.140 2 0 "[ . 1 . 2]" 1
1133 1 55 THR H 1 55 THR HB 3.720 . 3.720 2.924 2.886 2.972 . 0 0 "[ . 1 . 2]" 1
1134 1 55 THR H 1 55 THR MG 4.020 . 4.020 3.950 3.913 3.989 . 0 0 "[ . 1 . 2]" 1
1135 1 55 THR H 1 56 ALA H 4.360 . 4.360 4.222 4.142 4.297 . 0 0 "[ . 1 . 2]" 1
1136 1 55 THR HA 1 55 THR MG 3.280 . 3.280 2.220 2.143 2.285 . 0 0 "[ . 1 . 2]" 1
1137 1 55 THR HA 1 56 ALA H 2.860 . 2.860 2.119 2.045 2.206 . 0 0 "[ . 1 . 2]" 1
1138 1 55 THR HA 1 56 ALA HA 5.030 . 5.030 4.436 4.385 4.489 . 0 0 "[ . 1 . 2]" 1
1139 1 55 THR HA 1 56 ALA MB 4.050 . 4.050 3.805 3.741 3.871 . 0 0 "[ . 1 . 2]" 1
1140 1 55 THR HB 1 56 ALA H 3.560 . 3.560 3.661 3.632 3.682 0.122 16 0 "[ . 1 . 2]" 1
1141 1 55 THR MG 1 56 ALA H 3.330 . 3.330 2.300 2.199 2.381 . 0 0 "[ . 1 . 2]" 1
1142 1 55 THR MG 1 56 ALA HA 5.090 . 5.090 3.850 3.746 3.955 . 0 0 "[ . 1 . 2]" 1
1143 1 55 THR MG 1 57 PHE QD 5.150 . 5.150 4.541 4.437 4.659 . 0 0 "[ . 1 . 2]" 1
1144 1 55 THR MG 1 57 PHE QE 3.960 . 3.960 4.000 3.975 4.025 0.065 1 0 "[ . 1 . 2]" 1
1145 1 56 ALA H 1 56 ALA MB 3.270 . 3.270 2.541 2.439 2.632 . 0 0 "[ . 1 . 2]" 1
1146 1 56 ALA H 1 57 PHE H 4.550 . 4.550 4.381 4.321 4.415 . 0 0 "[ . 1 . 2]" 1
1147 1 56 ALA HA 1 57 PHE H 2.750 . 2.750 2.523 2.424 2.605 . 0 0 "[ . 1 . 2]" 1
1148 1 56 ALA HA 1 57 PHE HA 5.410 . 5.410 4.507 4.472 4.540 . 0 0 "[ . 1 . 2]" 1
1149 1 56 ALA HA 1 57 PHE HB2 4.940 . 4.940 4.560 4.442 4.765 . 0 0 "[ . 1 . 2]" 1
1150 1 56 ALA MB 1 57 PHE H 2.830 . 2.830 2.043 1.974 2.189 . 0 0 "[ . 1 . 2]" 1
1151 1 56 ALA MB 1 58 LEU H 5.430 . 5.430 4.291 4.108 4.491 . 0 0 "[ . 1 . 2]" 1
1152 1 56 ALA MB 1 58 LEU MD1 3.500 . 3.500 3.245 2.937 3.502 0.002 20 0 "[ . 1 . 2]" 1
1153 1 56 ALA MB 1 58 LEU HG 3.310 . 3.310 2.787 2.514 3.169 . 0 0 "[ . 1 . 2]" 1
1154 1 57 PHE H 1 57 PHE HB2 3.190 . 3.190 2.679 2.603 2.804 . 0 0 "[ . 1 . 2]" 1
1155 1 57 PHE H 1 57 PHE HB3 3.910 . 3.910 3.791 3.745 3.844 . 0 0 "[ . 1 . 2]" 1
1156 1 57 PHE H 1 57 PHE QD 3.750 . 3.750 3.263 3.118 3.523 . 0 0 "[ . 1 . 2]" 1
1157 1 57 PHE H 1 58 LEU MD1 4.940 . 4.940 4.826 4.578 4.964 0.024 12 0 "[ . 1 . 2]" 1
1158 1 57 PHE H 1 58 LEU MD2 4.210 . 4.210 3.954 3.783 4.212 0.002 20 0 "[ . 1 . 2]" 1
1159 1 57 PHE H 1 58 LEU HG 4.270 . 4.270 3.513 3.294 3.676 . 0 0 "[ . 1 . 2]" 1
1160 1 57 PHE HA 1 57 PHE QD 3.790 . 3.790 2.772 2.415 3.005 . 0 0 "[ . 1 . 2]" 1
1161 1 57 PHE HA 1 57 PHE QE 4.860 . 4.860 4.583 4.494 4.624 . 0 0 "[ . 1 . 2]" 1
1162 1 57 PHE HA 1 58 LEU H 2.970 . 2.970 2.066 1.968 2.129 . 0 0 "[ . 1 . 2]" 1
1163 1 57 PHE HA 1 58 LEU MD2 4.810 . 4.810 4.830 4.749 4.868 0.058 1 0 "[ . 1 . 2]" 1
1164 1 57 PHE HA 1 58 LEU HG 5.310 . 5.310 4.052 3.961 4.133 . 0 0 "[ . 1 . 2]" 1
1165 1 57 PHE HB2 1 58 LEU H 4.330 . 4.330 4.298 4.238 4.343 0.013 15 0 "[ . 1 . 2]" 1
1166 1 57 PHE HB2 1 58 LEU HA 4.910 . 4.910 4.799 4.705 4.895 . 0 0 "[ . 1 . 2]" 1
1167 1 57 PHE HB2 1 58 LEU MD2 4.880 . 4.880 4.946 4.885 4.986 0.106 16 0 "[ . 1 . 2]" 1
1168 1 57 PHE HB3 1 58 LEU H 3.910 . 3.910 3.550 3.461 3.615 . 0 0 "[ . 1 . 2]" 1
1169 1 57 PHE QD 1 58 LEU H 4.600 . 4.600 4.214 3.961 4.318 . 0 0 "[ . 1 . 2]" 1
1170 1 58 LEU H 1 58 LEU HB2 3.550 . 3.550 2.689 2.639 2.762 . 0 0 "[ . 1 . 2]" 1
1171 1 58 LEU H 1 58 LEU HB3 3.940 . 3.940 3.779 3.751 3.804 . 0 0 "[ . 1 . 2]" 1
1172 1 58 LEU H 1 58 LEU MD1 4.240 . 4.240 4.068 3.945 4.134 . 0 0 "[ . 1 . 2]" 1
1173 1 58 LEU H 1 58 LEU MD2 4.020 . 4.020 3.976 3.913 4.023 0.003 4 0 "[ . 1 . 2]" 1
1174 1 58 LEU H 1 58 LEU HG 3.790 . 3.790 3.184 3.037 3.259 . 0 0 "[ . 1 . 2]" 1
1175 1 58 LEU H 1 59 GLY H 4.460 . 4.460 4.397 4.271 4.436 . 0 0 "[ . 1 . 2]" 1
1176 1 58 LEU HA 1 58 LEU MD1 4.280 . 4.280 3.857 3.816 3.891 . 0 0 "[ . 1 . 2]" 1
1177 1 58 LEU HA 1 58 LEU MD2 2.970 . 2.970 2.100 2.025 2.192 . 0 0 "[ . 1 . 2]" 1
1178 1 58 LEU HA 1 58 LEU HG 3.920 . 3.920 3.062 2.979 3.124 . 0 0 "[ . 1 . 2]" 1
1179 1 58 LEU HA 1 59 GLY H 3.000 . 3.000 2.387 2.306 2.558 . 0 0 "[ . 1 . 2]" 1
1180 1 58 LEU HA 1 59 GLY QA 4.410 . 4.410 3.850 3.775 3.902 . 0 0 "[ . 1 . 2]" 1
1181 1 58 LEU HA 1 62 ASP HB2 4.760 . 4.760 3.731 3.222 4.163 . 0 0 "[ . 1 . 2]" 1
1182 1 58 LEU HB2 1 58 LEU MD1 3.090 . 3.090 2.228 2.179 2.277 . 0 0 "[ . 1 . 2]" 1
1183 1 58 LEU HB2 1 59 GLY H 3.960 . 3.960 3.686 3.334 3.969 0.009 4 0 "[ . 1 . 2]" 1
1184 1 58 LEU HB2 1 62 ASP HB2 4.450 . 4.450 3.504 3.261 3.734 . 0 0 "[ . 1 . 2]" 1
1185 1 58 LEU HB2 1 62 ASP HB3 4.550 . 4.550 4.150 3.739 4.559 0.009 6 0 "[ . 1 . 2]" 1
1186 1 58 LEU HB2 1 63 ILE H 5.390 . 5.390 5.346 5.118 5.417 0.027 16 0 "[ . 1 . 2]" 1
1187 1 58 LEU HB2 1 63 ILE MD 4.640 . 4.640 3.854 3.622 4.179 . 0 0 "[ . 1 . 2]" 1
1188 1 58 LEU HB2 1 63 ILE MG 4.740 . 4.740 2.460 2.349 2.587 . 0 0 "[ . 1 . 2]" 1
1189 1 58 LEU HB3 1 58 LEU MD1 2.920 . 2.920 2.384 2.349 2.418 . 0 0 "[ . 1 . 2]" 1
1190 1 58 LEU HB3 1 58 LEU MD2 3.160 . 3.160 2.359 2.314 2.399 . 0 0 "[ . 1 . 2]" 1
1191 1 58 LEU HB3 1 59 GLY H 3.490 . 3.490 2.544 2.116 2.961 . 0 0 "[ . 1 . 2]" 1
1192 1 58 LEU HB3 1 62 ASP HB2 4.110 . 4.110 2.012 1.845 2.237 . 0 0 "[ . 1 . 2]" 1
1193 1 58 LEU HB3 1 62 ASP HB3 4.210 . 4.210 2.622 2.125 3.176 . 0 0 "[ . 1 . 2]" 1
1194 1 58 LEU HB3 1 63 ILE MG 3.690 . 3.690 2.741 2.433 3.133 . 0 0 "[ . 1 . 2]" 1
1195 1 58 LEU MD1 1 59 GLY H 4.990 . 4.990 4.507 4.165 4.814 . 0 0 "[ . 1 . 2]" 1
1196 1 58 LEU MD1 1 62 ASP H 5.410 . 5.410 5.246 4.845 5.444 0.034 4 0 "[ . 1 . 2]" 1
1197 1 58 LEU MD1 1 62 ASP HB2 3.790 . 3.790 3.439 3.126 3.713 . 0 0 "[ . 1 . 2]" 1
1198 1 58 LEU MD1 1 62 ASP HB3 3.570 . 3.570 2.804 2.457 3.272 . 0 0 "[ . 1 . 2]" 1
1199 1 58 LEU MD1 1 63 ILE H 5.150 . 5.150 4.996 4.738 5.187 0.037 15 0 "[ . 1 . 2]" 1
1200 1 58 LEU MD1 1 63 ILE MG 3.080 . 3.080 2.559 2.321 2.781 . 0 0 "[ . 1 . 2]" 1
1201 1 58 LEU MD2 1 59 GLY H 3.640 . 3.640 3.458 3.337 3.619 . 0 0 "[ . 1 . 2]" 1
1202 1 58 LEU MD2 1 62 ASP HB2 3.790 . 3.790 3.227 2.918 3.496 . 0 0 "[ . 1 . 2]" 1
1203 1 58 LEU MD2 1 62 ASP HB3 3.660 . 3.660 2.609 2.114 2.999 . 0 0 "[ . 1 . 2]" 1
1204 1 58 LEU HG 1 59 GLY H 5.110 . 5.110 4.902 4.738 5.061 . 0 0 "[ . 1 . 2]" 1
1205 1 58 LEU HG 1 62 ASP HB3 5.240 . 5.240 4.910 4.617 5.267 0.027 12 0 "[ . 1 . 2]" 1
1206 1 59 GLY H 1 60 PRO HD2 4.620 . 4.620 4.612 4.484 4.659 0.039 10 0 "[ . 1 . 2]" 1
1207 1 59 GLY H 1 60 PRO HD3 5.330 . 5.330 5.161 5.087 5.247 . 0 0 "[ . 1 . 2]" 1
1208 1 59 GLY H 1 61 LYS H 4.760 . 4.760 4.326 3.996 4.691 . 0 0 "[ . 1 . 2]" 1
1209 1 59 GLY H 1 62 ASP H 4.280 . 4.280 3.620 3.347 3.939 . 0 0 "[ . 1 . 2]" 1
1210 1 59 GLY H 1 62 ASP HB2 4.070 . 4.070 2.333 2.014 2.601 . 0 0 "[ . 1 . 2]" 1
1211 1 59 GLY H 1 62 ASP HB3 4.550 . 4.550 3.731 3.302 4.184 . 0 0 "[ . 1 . 2]" 1
1212 1 59 GLY QA 1 60 PRO HD3 3.320 . 3.320 2.466 2.377 2.566 . 0 0 "[ . 1 . 2]" 1
1213 1 59 GLY QA 1 61 LYS H 4.160 . 4.160 3.003 2.870 3.147 . 0 0 "[ . 1 . 2]" 1
1214 1 59 GLY HA2 1 60 PRO HD2 3.610 . 3.610 2.644 2.400 2.817 . 0 0 "[ . 1 . 2]" 1
1215 1 59 GLY HA3 1 60 PRO HD2 3.610 . 3.610 2.399 2.251 2.520 . 0 0 "[ . 1 . 2]" 1
1216 1 60 PRO HA 1 62 ASP H 4.280 . 4.280 3.763 3.615 4.052 . 0 0 "[ . 1 . 2]" 1
1217 1 60 PRO HA 1 63 ILE H 3.860 . 3.860 3.765 3.601 3.890 0.030 12 0 "[ . 1 . 2]" 1
1218 1 60 PRO HA 1 63 ILE HB 5.050 . 5.050 4.869 4.714 5.067 0.017 2 0 "[ . 1 . 2]" 1
1219 1 60 PRO HA 1 63 ILE MD 3.370 . 3.370 1.983 1.904 2.151 . 0 0 "[ . 1 . 2]" 1
1220 1 60 PRO HA 1 63 ILE HG12 3.730 . 3.730 2.277 2.193 2.390 . 0 0 "[ . 1 . 2]" 1
1221 1 60 PRO HA 1 63 ILE HG13 3.850 . 3.850 2.849 2.636 3.113 . 0 0 "[ . 1 . 2]" 1
1222 1 60 PRO HA 1 63 ILE MG 4.040 . 4.040 4.072 3.974 4.120 0.080 19 0 "[ . 1 . 2]" 1
1223 1 60 PRO QB 1 61 LYS H 3.670 . 3.670 3.470 3.294 3.572 . 0 0 "[ . 1 . 2]" 1
1224 1 60 PRO QB 1 63 ILE MD 3.950 . 3.950 3.246 3.093 3.472 . 0 0 "[ . 1 . 2]" 1
1225 1 60 PRO HB2 1 61 LYS H 4.400 . 4.400 3.656 3.437 3.784 . 0 0 "[ . 1 . 2]" 1
1226 1 60 PRO HB3 1 61 LYS H 4.400 . 4.400 4.322 4.223 4.383 . 0 0 "[ . 1 . 2]" 1
1227 1 60 PRO HD2 1 61 LYS H 4.010 . 4.010 2.922 2.838 2.996 . 0 0 "[ . 1 . 2]" 1
1228 1 60 PRO HD3 1 61 LYS H 3.920 . 3.920 3.950 3.934 3.971 0.051 5 0 "[ . 1 . 2]" 1
1229 1 60 PRO HG2 1 61 LYS H 3.730 . 3.730 2.950 2.709 3.125 . 0 0 "[ . 1 . 2]" 1
1230 1 60 PRO HG3 1 61 LYS H 4.560 . 4.560 4.315 4.154 4.438 . 0 0 "[ . 1 . 2]" 1
1231 1 61 LYS H 1 61 LYS QB 2.820 . 2.820 2.698 2.378 2.894 0.074 17 0 "[ . 1 . 2]" 1
1232 1 61 LYS H 1 61 LYS HG2 3.480 . 3.480 2.670 2.000 3.552 0.072 13 0 "[ . 1 . 2]" 1
1233 1 61 LYS H 1 61 LYS HG3 3.480 . 3.480 2.755 1.892 3.609 0.129 7 0 "[ . 1 . 2]" 1
1234 1 61 LYS H 1 62 ASP H 3.070 . 3.070 2.239 2.076 2.347 . 0 0 "[ . 1 . 2]" 1
1235 1 61 LYS H 1 62 ASP HA 5.060 . 5.060 4.868 4.666 4.956 . 0 0 "[ . 1 . 2]" 1
1236 1 61 LYS H 1 62 ASP HB2 4.560 . 4.560 4.277 4.149 4.433 . 0 0 "[ . 1 . 2]" 1
1237 1 61 LYS H 1 63 ILE H 4.140 . 4.140 3.850 3.699 4.020 . 0 0 "[ . 1 . 2]" 1
1238 1 61 LYS H 1 63 ILE MD 4.820 . 4.820 4.670 4.424 4.881 0.061 2 0 "[ . 1 . 2]" 1
1239 1 61 LYS HA 1 61 LYS QG 3.620 . 3.620 3.074 2.363 3.494 . 0 0 "[ . 1 . 2]" 1
1240 1 61 LYS HA 1 63 ILE H 3.920 . 3.920 3.674 3.225 3.879 . 0 0 "[ . 1 . 2]" 1
1241 1 61 LYS HA 1 63 ILE MD 5.500 . 5.500 5.572 5.390 5.673 0.173 15 0 "[ . 1 . 2]" 1
1242 1 61 LYS QB 1 62 ASP H 3.600 . 3.600 3.547 3.071 3.768 0.168 19 0 "[ . 1 . 2]" 1
1243 1 61 LYS QB 1 62 ASP HA 4.770 . 4.770 4.291 3.626 4.560 . 0 0 "[ . 1 . 2]" 1
1244 1 61 LYS QB 1 63 ILE H 4.860 . 4.860 4.737 4.364 4.889 0.029 14 0 "[ . 1 . 2]" 1
1245 1 61 LYS QE 1 61 LYS HG2 3.850 . 3.850 2.974 2.367 3.570 . 0 0 "[ . 1 . 2]" 1
1246 1 61 LYS QE 1 61 LYS QG 3.180 . 3.180 2.512 2.157 2.878 . 0 0 "[ . 1 . 2]" 1
1247 1 61 LYS QE 1 61 LYS HG3 3.850 . 3.850 2.922 2.357 3.633 . 0 0 "[ . 1 . 2]" 1
1248 1 61 LYS QG 1 62 ASP H 4.100 . 4.100 3.417 2.614 4.181 0.081 7 0 "[ . 1 . 2]" 1
1249 1 61 LYS QG 1 63 ILE H 5.340 . 5.340 4.916 4.328 5.399 0.059 9 0 "[ . 1 . 2]" 1
1250 1 62 ASP H 1 62 ASP HB2 3.280 . 3.280 2.471 2.322 2.595 . 0 0 "[ . 1 . 2]" 1
1251 1 62 ASP H 1 62 ASP HB3 3.790 . 3.790 3.686 3.591 3.770 . 0 0 "[ . 1 . 2]" 1
1252 1 62 ASP H 1 63 ILE H 2.940 . 2.940 2.108 1.929 2.228 . 0 0 "[ . 1 . 2]" 1
1253 1 62 ASP H 1 63 ILE MD 5.100 . 5.100 4.279 4.028 4.523 . 0 0 "[ . 1 . 2]" 1
1254 1 62 ASP H 1 63 ILE HG12 4.280 . 4.280 2.945 2.747 3.257 . 0 0 "[ . 1 . 2]" 1
1255 1 62 ASP H 1 63 ILE HG13 5.190 . 5.190 4.393 4.190 4.731 . 0 0 "[ . 1 . 2]" 1
1256 1 62 ASP H 1 63 ILE MG 4.230 . 4.230 3.665 3.427 3.821 . 0 0 "[ . 1 . 2]" 1
1257 1 62 ASP HA 1 64 PHE QE 4.040 . 4.040 3.958 3.531 4.088 0.048 17 0 "[ . 1 . 2]" 1
1258 1 62 ASP HB2 1 63 ILE H 3.980 . 3.980 3.412 3.009 3.781 . 0 0 "[ . 1 . 2]" 1
1259 1 62 ASP HB2 1 63 ILE MD 5.200 . 5.200 4.678 4.334 5.071 . 0 0 "[ . 1 . 2]" 1
1260 1 62 ASP HB2 1 63 ILE MG 4.260 . 4.260 3.015 2.582 3.398 . 0 0 "[ . 1 . 2]" 1
1261 1 62 ASP HB3 1 63 ILE H 4.210 . 4.210 4.112 3.692 4.280 0.070 20 0 "[ . 1 . 2]" 1
1262 1 62 ASP HB3 1 63 ILE MG 4.730 . 4.730 3.593 3.165 3.885 . 0 0 "[ . 1 . 2]" 1
1263 1 63 ILE H 1 63 ILE HB 3.830 . 3.830 3.711 3.669 3.746 . 0 0 "[ . 1 . 2]" 1
1264 1 63 ILE H 1 63 ILE MD 3.680 . 3.680 3.688 3.591 3.754 0.074 10 0 "[ . 1 . 2]" 1
1265 1 63 ILE H 1 63 ILE HG12 3.370 . 3.370 2.021 1.914 2.105 . 0 0 "[ . 1 . 2]" 1
1266 1 63 ILE H 1 63 ILE HG13 3.450 . 3.450 2.902 2.806 2.989 . 0 0 "[ . 1 . 2]" 1
1267 1 63 ILE H 1 63 ILE MG 3.460 . 3.460 2.913 2.694 3.037 . 0 0 "[ . 1 . 2]" 1
1268 1 63 ILE H 1 64 PHE H 4.560 . 4.560 4.346 4.282 4.414 . 0 0 "[ . 1 . 2]" 1
1269 1 63 ILE H 1 64 PHE QD 5.480 . 5.480 4.635 4.303 4.844 . 0 0 "[ . 1 . 2]" 1
1270 1 63 ILE H 1 64 PHE QE 5.000 . 5.000 4.831 4.602 5.031 0.031 9 0 "[ . 1 . 2]" 1
1271 1 63 ILE HA 1 63 ILE MD 4.240 . 4.240 4.159 4.131 4.185 . 0 0 "[ . 1 . 2]" 1
1272 1 63 ILE HA 1 63 ILE MG 3.470 . 3.470 2.296 2.273 2.345 . 0 0 "[ . 1 . 2]" 1
1273 1 63 ILE HA 1 64 PHE H 3.230 . 3.230 2.214 2.124 2.300 . 0 0 "[ . 1 . 2]" 1
1274 1 63 ILE HA 1 64 PHE QD 4.690 . 4.690 3.258 2.858 3.656 . 0 0 "[ . 1 . 2]" 1
1275 1 63 ILE HB 1 63 ILE MD 3.260 . 3.260 2.459 2.399 2.520 . 0 0 "[ . 1 . 2]" 1
1276 1 63 ILE HB 1 64 PHE H 4.000 . 4.000 2.606 2.382 2.713 . 0 0 "[ . 1 . 2]" 1
1277 1 63 ILE MD 1 63 ILE MG 2.870 . 2.870 1.863 1.791 1.898 . 0 0 "[ . 1 . 2]" 1
1278 1 63 ILE MD 1 64 PHE H 4.570 . 4.570 4.572 4.392 4.642 0.072 5 0 "[ . 1 . 2]" 1
1279 1 63 ILE HG12 1 63 ILE MG 3.170 . 3.170 2.424 2.367 2.465 . 0 0 "[ . 1 . 2]" 1
1280 1 63 ILE HG12 1 64 PHE H 4.940 . 4.940 4.763 4.647 4.853 . 0 0 "[ . 1 . 2]" 1
1281 1 63 ILE HG13 1 64 PHE H 4.070 . 4.070 3.958 3.784 4.079 0.009 18 0 "[ . 1 . 2]" 1
1282 1 63 ILE MG 1 64 PHE H 3.650 . 3.650 3.568 3.485 3.642 . 0 0 "[ . 1 . 2]" 1
1283 1 63 ILE MG 1 64 PHE HA 5.430 . 5.430 5.385 5.296 5.447 0.017 8 0 "[ . 1 . 2]" 1
1284 1 64 PHE H 1 64 PHE HB2 3.860 . 3.860 2.743 2.615 2.846 . 0 0 "[ . 1 . 2]" 1
1285 1 64 PHE H 1 64 PHE HB3 4.060 . 4.060 3.835 3.763 3.895 . 0 0 "[ . 1 . 2]" 1
1286 1 64 PHE H 1 64 PHE QD 3.550 . 3.550 3.045 2.766 3.303 . 0 0 "[ . 1 . 2]" 1
1287 1 64 PHE H 1 65 PRO HD2 4.870 . 4.870 4.831 4.736 4.880 0.010 9 0 "[ . 1 . 2]" 1
1288 1 64 PHE H 1 65 PRO HD3 5.050 . 5.050 4.764 4.487 4.938 . 0 0 "[ . 1 . 2]" 1
1289 1 64 PHE HA 1 64 PHE QD 4.000 . 4.000 3.013 2.792 3.183 . 0 0 "[ . 1 . 2]" 1
1290 1 64 PHE HA 1 65 PRO HB3 5.080 . 5.080 4.921 4.816 5.085 0.005 15 0 "[ . 1 . 2]" 1
1291 1 64 PHE HA 1 65 PRO HD2 3.430 . 3.430 2.378 2.208 2.552 . 0 0 "[ . 1 . 2]" 1
1292 1 64 PHE HA 1 65 PRO HD3 3.310 . 3.310 2.292 2.099 2.435 . 0 0 "[ . 1 . 2]" 1
1293 1 64 PHE HA 1 65 PRO QG 4.080 . 4.080 3.995 3.852 4.083 0.003 8 0 "[ . 1 . 2]" 1
1294 1 64 PHE HA 1 69 ASN QD 5.130 . 5.130 3.829 3.399 4.930 . 0 0 "[ . 1 . 2]" 1
1295 1 64 PHE HB2 1 65 PRO HD2 4.740 . 4.740 3.852 3.660 4.095 . 0 0 "[ . 1 . 2]" 1
1296 1 64 PHE HB2 1 65 PRO HD3 4.730 . 4.730 4.788 4.764 4.824 0.094 13 0 "[ . 1 . 2]" 1
1297 1 64 PHE HB2 1 73 TYR QE 5.000 . 5.000 3.771 2.539 5.008 0.008 15 0 "[ . 1 . 2]" 1
1298 1 64 PHE HB3 1 65 PRO HD2 4.190 . 4.190 2.394 2.156 2.685 . 0 0 "[ . 1 . 2]" 1
1299 1 64 PHE HB3 1 65 PRO HD3 4.390 . 4.390 3.731 3.563 3.917 . 0 0 "[ . 1 . 2]" 1
1300 1 64 PHE HB3 1 69 ASN HD21 4.620 . 4.620 3.032 2.595 4.290 . 0 0 "[ . 1 . 2]" 1
1301 1 64 PHE HB3 1 69 ASN QD 3.870 . 3.870 2.270 1.647 3.572 . 0 0 "[ . 1 . 2]" 1
1302 1 64 PHE HB3 1 69 ASN HD22 4.620 . 4.620 2.377 1.653 3.821 . 0 0 "[ . 1 . 2]" 1
1303 1 64 PHE HB3 1 73 TYR QE 5.400 . 5.400 3.998 2.661 5.458 0.058 17 0 "[ . 1 . 2]" 1
1304 1 64 PHE QD 1 65 PRO HD3 5.020 . 5.020 4.190 3.861 4.510 . 0 0 "[ . 1 . 2]" 1
1305 1 64 PHE QD 1 73 TYR QE 5.400 . 5.400 4.022 3.061 5.241 . 0 0 "[ . 1 . 2]" 1
1306 1 64 PHE QE 1 65 PRO HD2 5.500 . 5.500 5.395 5.189 5.523 0.023 18 0 "[ . 1 . 2]" 1
1307 1 65 PRO HA 1 66 TYR H 3.240 . 3.240 2.033 1.925 2.122 . 0 0 "[ . 1 . 2]" 1
1308 1 65 PRO HA 1 66 TYR HA 4.630 . 4.630 4.250 4.159 4.380 . 0 0 "[ . 1 . 2]" 1
1309 1 65 PRO HA 1 66 TYR HB2 5.030 . 5.030 4.533 4.329 4.746 . 0 0 "[ . 1 . 2]" 1
1310 1 65 PRO HA 1 66 TYR HB3 4.690 . 4.690 4.356 4.093 4.533 . 0 0 "[ . 1 . 2]" 1
1311 1 65 PRO HA 1 67 SER H 3.800 . 3.800 3.829 3.609 3.874 0.074 5 0 "[ . 1 . 2]" 1
1312 1 65 PRO HA 1 68 GLU H 5.500 . 5.500 4.785 4.523 5.261 . 0 0 "[ . 1 . 2]" 1
1313 1 65 PRO HA 1 69 ASN H 5.320 . 5.320 5.390 5.278 5.479 0.159 4 0 "[ . 1 . 2]" 1
1314 1 65 PRO HB2 1 66 TYR H 4.340 . 4.340 3.401 3.099 3.551 . 0 0 "[ . 1 . 2]" 1
1315 1 65 PRO HB2 1 68 GLU H 4.040 . 4.040 2.764 2.465 3.121 . 0 0 "[ . 1 . 2]" 1
1316 1 65 PRO HB3 1 66 TYR H 4.280 . 4.280 3.826 3.563 3.962 . 0 0 "[ . 1 . 2]" 1
1317 1 65 PRO HB3 1 67 SER H 4.420 . 4.420 4.284 3.920 4.453 0.033 8 0 "[ . 1 . 2]" 1
1318 1 65 PRO HB3 1 68 GLU H 4.680 . 4.680 4.508 4.220 4.717 0.037 15 0 "[ . 1 . 2]" 1
1319 1 65 PRO HD2 1 69 ASN HD21 4.340 . 4.340 2.989 2.347 3.609 . 0 0 "[ . 1 . 2]" 1
1320 1 65 PRO HD2 1 69 ASN QD 3.710 . 3.710 2.336 1.835 2.937 . 0 0 "[ . 1 . 2]" 1
1321 1 65 PRO HD2 1 69 ASN HD22 4.340 . 4.340 2.453 1.916 3.130 . 0 0 "[ . 1 . 2]" 1
1322 1 65 PRO HD3 1 69 ASN HD21 4.990 . 4.990 4.447 3.917 5.013 0.023 8 0 "[ . 1 . 2]" 1
1323 1 65 PRO HD3 1 69 ASN QD 4.330 . 4.330 3.783 3.354 4.255 . 0 0 "[ . 1 . 2]" 1
1324 1 65 PRO HD3 1 69 ASN HD22 4.990 . 4.990 4.129 3.584 4.831 . 0 0 "[ . 1 . 2]" 1
1325 1 65 PRO QG 1 67 SER H 4.550 . 4.550 4.492 3.889 4.629 0.079 8 0 "[ . 1 . 2]" 1
1326 1 65 PRO QG 1 68 GLU H 3.340 . 3.340 3.163 2.632 3.402 0.062 15 0 "[ . 1 . 2]" 1
1327 1 65 PRO QG 1 69 ASN H 4.120 . 4.120 4.062 3.754 4.159 0.039 19 0 "[ . 1 . 2]" 1
1328 1 65 PRO QG 1 69 ASN HD21 4.650 . 4.650 2.709 2.226 3.724 . 0 0 "[ . 1 . 2]" 1
1329 1 65 PRO QG 1 69 ASN QD 3.880 . 3.880 2.482 2.089 3.481 . 0 0 "[ . 1 . 2]" 1
1330 1 65 PRO QG 1 69 ASN HD22 4.650 . 4.650 2.940 2.487 4.181 . 0 0 "[ . 1 . 2]" 1
1331 1 66 TYR H 1 66 TYR HB2 3.420 . 3.420 2.656 2.558 2.879 . 0 0 "[ . 1 . 2]" 1
1332 1 66 TYR H 1 66 TYR HB3 3.570 . 3.570 2.363 2.111 2.511 . 0 0 "[ . 1 . 2]" 1
1333 1 66 TYR H 1 66 TYR QD 4.290 . 4.290 4.143 3.924 4.218 . 0 0 "[ . 1 . 2]" 1
1334 1 66 TYR H 1 67 SER H 3.550 . 3.550 2.659 2.492 2.773 . 0 0 "[ . 1 . 2]" 1
1335 1 66 TYR HA 1 66 TYR QD 3.430 . 3.430 2.887 2.627 3.066 . 0 0 "[ . 1 . 2]" 1
1336 1 66 TYR HA 1 66 TYR QE 5.140 . 5.140 4.792 4.645 5.001 . 0 0 "[ . 1 . 2]" 1
1337 1 66 TYR HA 1 68 GLU H 4.800 . 4.800 4.519 4.106 4.824 0.024 5 0 "[ . 1 . 2]" 1
1338 1 66 TYR HA 1 69 ASN H 4.380 . 4.380 3.511 3.153 3.724 . 0 0 "[ . 1 . 2]" 1
1339 1 66 TYR HA 1 69 ASN QB 4.720 . 4.720 3.266 2.208 4.771 0.051 18 0 "[ . 1 . 2]" 1
1340 1 66 TYR HA 1 89 ILE MD 5.460 . 5.460 4.433 3.945 4.737 . 0 0 "[ . 1 . 2]" 1
1341 1 66 TYR HB2 1 67 SER H 4.220 . 4.220 4.044 3.918 4.233 0.013 16 0 "[ . 1 . 2]" 1
1342 1 66 TYR HB2 1 89 ILE MD 3.980 . 3.980 2.640 2.387 3.078 . 0 0 "[ . 1 . 2]" 1
1343 1 66 TYR HB3 1 67 SER H 3.400 . 3.400 2.811 2.668 3.113 . 0 0 "[ . 1 . 2]" 1
1344 1 66 TYR HB3 1 89 ILE MD 4.070 . 4.070 3.281 2.897 3.579 . 0 0 "[ . 1 . 2]" 1
1345 1 66 TYR QD 1 67 SER H 3.560 . 3.560 3.494 3.110 3.671 0.111 8 0 "[ . 1 . 2]" 1
1346 1 66 TYR QD 1 67 SER HA 4.100 . 4.100 3.323 2.982 4.007 . 0 0 "[ . 1 . 2]" 1
1347 1 66 TYR QD 1 67 SER QB 4.660 . 4.660 4.135 3.321 4.703 0.043 15 0 "[ . 1 . 2]" 1
1348 1 66 TYR QD 1 70 LYS H 5.180 . 5.180 5.079 4.425 5.254 0.074 8 0 "[ . 1 . 2]" 1
1349 1 66 TYR QD 1 70 LYS QB 4.780 . 4.780 3.572 3.000 3.890 . 0 0 "[ . 1 . 2]" 1
1350 1 66 TYR QD 1 89 ILE MD 3.410 . 3.410 2.674 2.201 2.977 . 0 0 "[ . 1 . 2]" 1
1351 1 66 TYR QD 1 89 ILE MG 4.610 . 4.610 3.468 3.036 4.022 . 0 0 "[ . 1 . 2]" 1
1352 1 66 TYR QE 1 67 SER HA 4.930 . 4.930 4.396 3.879 4.649 . 0 0 "[ . 1 . 2]" 1
1353 1 66 TYR QE 1 70 LYS HA 4.140 . 4.140 4.068 3.661 4.191 0.051 16 0 "[ . 1 . 2]" 1
1354 1 66 TYR QE 1 70 LYS QB 5.050 . 5.050 3.384 2.471 3.875 . 0 0 "[ . 1 . 2]" 1
1355 1 66 TYR QE 1 70 LYS QD 3.990 . 3.990 3.323 2.171 4.103 0.113 16 0 "[ . 1 . 2]" 1
1356 1 66 TYR QE 1 70 LYS QG 4.890 . 4.890 3.789 2.990 4.912 0.022 19 0 "[ . 1 . 2]" 1
1357 1 66 TYR QE 1 74 GLY HA3 4.790 . 4.790 4.086 3.273 4.839 0.049 15 0 "[ . 1 . 2]" 1
1358 1 66 TYR QE 1 86 LEU QD 4.070 . 4.070 3.072 2.100 4.111 0.041 15 0 "[ . 1 . 2]" 1
1359 1 66 TYR QE 1 89 ILE MD 4.210 . 4.210 3.429 2.779 4.242 0.032 9 0 "[ . 1 . 2]" 1
1360 1 66 TYR QE 1 89 ILE MG 3.870 . 3.870 2.857 2.335 3.399 . 0 0 "[ . 1 . 2]" 1
1361 1 67 SER H 1 67 SER QB 2.870 . 2.870 2.499 2.158 2.810 . 0 0 "[ . 1 . 2]" 1
1362 1 67 SER H 1 68 GLU H 3.440 . 3.440 2.784 2.402 3.185 . 0 0 "[ . 1 . 2]" 1
1363 1 67 SER H 1 69 ASN H 4.380 . 4.380 3.907 3.689 4.142 . 0 0 "[ . 1 . 2]" 1
1364 1 67 SER HA 1 68 GLU HA 4.740 . 4.740 4.641 4.386 4.767 0.027 7 0 "[ . 1 . 2]" 1
1365 1 67 SER HA 1 69 ASN H 4.620 . 4.620 4.288 3.897 4.684 0.064 3 0 "[ . 1 . 2]" 1
1366 1 67 SER HA 1 70 LYS H 4.460 . 4.460 4.147 3.798 4.475 0.015 3 0 "[ . 1 . 2]" 1
1367 1 67 SER HA 1 70 LYS QB 3.830 . 3.830 3.392 2.906 3.858 0.028 10 0 "[ . 1 . 2]" 1
1368 1 67 SER HA 1 70 LYS QD 4.180 . 4.180 3.714 2.551 4.243 0.063 11 0 "[ . 1 . 2]" 1
1369 1 67 SER HA 1 70 LYS QG 5.370 . 5.370 4.795 3.426 5.461 0.091 7 0 "[ . 1 . 2]" 1
1370 1 67 SER QB 1 68 GLU H 3.180 . 3.180 2.618 2.319 3.074 . 0 0 "[ . 1 . 2]" 1
1371 1 67 SER QB 1 68 GLU QB 4.500 . 4.500 4.272 3.925 4.544 0.044 5 0 "[ . 1 . 2]" 1
1372 1 67 SER QB 1 69 ASN H 4.590 . 4.590 4.508 4.277 4.668 0.078 1 0 "[ . 1 . 2]" 1
1373 1 67 SER QB 1 70 LYS H 5.440 . 5.440 5.279 4.946 5.512 0.072 9 0 "[ . 1 . 2]" 1
1374 1 68 GLU H 1 68 GLU HB2 3.670 . 3.670 2.599 2.158 3.578 . 0 0 "[ . 1 . 2]" 1
1375 1 68 GLU H 1 68 GLU QB 2.960 . 2.960 2.499 2.137 3.006 0.046 15 0 "[ . 1 . 2]" 1
1376 1 68 GLU H 1 68 GLU HB3 3.670 . 3.670 3.566 2.966 3.675 0.005 6 0 "[ . 1 . 2]" 1
1377 1 68 GLU H 1 68 GLU QG 3.230 . 3.230 2.698 2.042 3.354 0.124 19 0 "[ . 1 . 2]" 1
1378 1 68 GLU H 1 69 ASN H 3.220 . 3.220 2.376 2.176 2.574 . 0 0 "[ . 1 . 2]" 1
1379 1 68 GLU H 1 69 ASN HA 5.130 . 5.130 5.001 4.845 5.156 0.026 2 0 "[ . 1 . 2]" 1
1380 1 68 GLU H 1 70 LYS H 4.140 . 4.140 4.098 3.908 4.198 0.058 13 0 "[ . 1 . 2]" 1
1381 1 68 GLU HA 1 68 GLU HG2 3.680 . 3.680 3.270 2.573 3.959 0.279 15 0 "[ . 1 . 2]" 1
1382 1 68 GLU HA 1 68 GLU QG 3.220 . 3.220 2.571 2.217 3.332 0.112 14 0 "[ . 1 . 2]" 1
1383 1 68 GLU HA 1 68 GLU HG3 3.680 . 3.680 2.875 2.248 3.980 0.300 14 0 "[ . 1 . 2]" 1
1384 1 68 GLU HA 1 70 LYS H 4.060 . 4.060 3.961 3.594 4.155 0.095 9 0 "[ . 1 . 2]" 1
1385 1 68 GLU QB 1 69 ASN H 3.660 . 3.660 3.048 2.034 3.768 0.108 14 0 "[ . 1 . 2]" 1
1386 1 68 GLU QB 1 69 ASN QD 3.710 . 3.710 2.610 2.073 3.866 0.156 15 0 "[ . 1 . 2]" 1
1387 1 68 GLU QB 1 70 LYS H 5.020 . 5.020 4.689 3.916 5.013 . 0 0 "[ . 1 . 2]" 1
1388 1 68 GLU HB2 1 69 ASN H 4.400 . 4.400 3.166 2.056 4.084 . 0 0 "[ . 1 . 2]" 1
1389 1 68 GLU HB3 1 69 ASN H 4.400 . 4.400 4.035 3.247 4.477 0.077 15 0 "[ . 1 . 2]" 1
1390 1 68 GLU QG 1 69 ASN H 4.410 . 4.410 4.230 3.156 4.576 0.166 19 0 "[ . 1 . 2]" 1
1391 1 68 GLU QG 1 69 ASN QD 4.270 . 4.270 4.049 2.221 4.384 0.114 4 0 "[ . 1 . 2]" 1
1392 1 69 ASN H 1 69 ASN QB 3.300 . 3.300 2.606 2.232 3.224 . 0 0 "[ . 1 . 2]" 1
1393 1 69 ASN H 1 69 ASN QD 4.240 . 4.240 2.637 2.263 2.931 . 0 0 "[ . 1 . 2]" 1
1394 1 69 ASN H 1 70 LYS H 2.890 . 2.890 2.362 2.179 2.712 . 0 0 "[ . 1 . 2]" 1
1395 1 69 ASN H 1 70 LYS HA 4.780 . 4.780 4.564 4.319 4.902 0.122 3 0 "[ . 1 . 2]" 1
1396 1 69 ASN H 1 70 LYS QB 4.260 . 4.260 4.047 3.765 4.287 0.027 15 0 "[ . 1 . 2]" 1
1397 1 69 ASN H 1 71 GLU H 5.120 . 5.120 4.630 4.393 4.844 . 0 0 "[ . 1 . 2]" 1
1398 1 69 ASN H 1 72 LYS HG3 4.950 . 4.950 5.001 4.473 5.160 0.210 13 0 "[ . 1 . 2]" 1
1399 1 69 ASN H 1 73 TYR QD 5.500 . 5.500 5.381 5.061 5.551 0.051 12 0 "[ . 1 . 2]" 1
1400 1 69 ASN HA 1 69 ASN QD 4.110 . 4.110 3.450 2.611 3.600 . 0 0 "[ . 1 . 2]" 1
1401 1 69 ASN HA 1 71 GLU H 4.080 . 4.080 3.655 2.952 4.096 0.016 17 0 "[ . 1 . 2]" 1
1402 1 69 ASN HA 1 72 LYS H 3.770 . 3.770 2.997 2.267 3.325 . 0 0 "[ . 1 . 2]" 1
1403 1 69 ASN HA 1 72 LYS HB2 4.130 . 4.130 2.840 2.004 3.298 . 0 0 "[ . 1 . 2]" 1
1404 1 69 ASN HA 1 72 LYS HB3 4.620 . 4.620 4.274 3.553 4.655 0.035 1 0 "[ . 1 . 2]" 1
1405 1 69 ASN HA 1 72 LYS HG3 4.030 . 4.030 2.279 2.070 2.640 . 0 0 "[ . 1 . 2]" 1
1406 1 69 ASN HA 1 73 TYR H 4.500 . 4.500 3.897 2.944 4.278 . 0 0 "[ . 1 . 2]" 1
1407 1 69 ASN HA 1 73 TYR QD 4.680 . 4.680 4.171 3.343 4.712 0.032 18 0 "[ . 1 . 2]" 1
1408 1 69 ASN QB 1 70 LYS H 3.910 . 3.910 3.630 3.356 3.946 0.036 1 0 "[ . 1 . 2]" 1
1409 1 69 ASN QB 1 72 LYS H 4.660 . 4.660 3.964 3.317 4.420 . 0 0 "[ . 1 . 2]" 1
1410 1 69 ASN QB 1 72 LYS HB3 5.470 . 5.470 4.059 3.387 4.774 . 0 0 "[ . 1 . 2]" 1
1411 1 69 ASN QB 1 72 LYS QD 5.180 . 5.180 3.186 1.997 5.159 . 0 0 "[ . 1 . 2]" 1
1412 1 69 ASN QB 1 72 LYS HG3 4.620 . 4.620 3.653 1.993 4.623 0.003 17 0 "[ . 1 . 2]" 1
1413 1 69 ASN QB 1 73 TYR H 4.360 . 4.360 3.191 2.707 3.445 . 0 0 "[ . 1 . 2]" 1
1414 1 69 ASN QB 1 73 TYR HA 5.340 . 5.340 5.279 4.958 5.392 0.052 10 0 "[ . 1 . 2]" 1
1415 1 69 ASN QB 1 73 TYR HB3 4.850 . 4.850 4.780 4.366 4.902 0.052 1 0 "[ . 1 . 2]" 1
1416 1 69 ASN QB 1 73 TYR QD 3.670 . 3.670 2.010 1.859 2.295 . 0 0 "[ . 1 . 2]" 1
1417 1 69 ASN QB 1 73 TYR QE 4.440 . 4.440 3.077 2.401 4.185 . 0 0 "[ . 1 . 2]" 1
1418 1 70 LYS H 1 70 LYS QB 2.770 . 2.770 2.338 2.113 2.721 . 0 0 "[ . 1 . 2]" 1
1419 1 70 LYS H 1 70 LYS QG 4.090 . 4.090 3.370 1.838 4.021 . 0 0 "[ . 1 . 2]" 1
1420 1 70 LYS H 1 71 GLU H 3.390 . 3.390 2.591 2.419 2.833 . 0 0 "[ . 1 . 2]" 1
1421 1 70 LYS H 1 71 GLU QB 4.930 . 4.930 4.787 4.374 5.028 0.098 14 0 "[ . 1 . 2]" 1
1422 1 70 LYS H 1 72 LYS H 3.960 . 3.960 3.817 3.668 3.980 0.020 1 0 "[ . 1 . 2]" 1
1423 1 70 LYS HA 1 70 LYS QG 3.590 . 3.590 2.821 2.445 3.351 . 0 0 "[ . 1 . 2]" 1
1424 1 70 LYS HA 1 73 TYR H 4.370 . 4.370 3.715 3.339 4.180 . 0 0 "[ . 1 . 2]" 1
1425 1 70 LYS HA 1 74 GLY H 4.030 . 4.030 3.013 2.553 3.401 . 0 0 "[ . 1 . 2]" 1
1426 1 70 LYS HA 1 74 GLY HA2 4.410 . 4.410 3.783 3.373 4.159 . 0 0 "[ . 1 . 2]" 1
1427 1 70 LYS HA 1 74 GLY HA3 3.970 . 3.970 2.680 2.104 3.250 . 0 0 "[ . 1 . 2]" 1
1428 1 70 LYS QB 1 70 LYS QE 4.280 . 4.280 3.177 2.034 3.677 . 0 0 "[ . 1 . 2]" 1
1429 1 70 LYS QB 1 71 GLU H 3.420 . 3.420 2.984 2.374 3.489 0.069 10 0 "[ . 1 . 2]" 1
1430 1 70 LYS QB 1 71 GLU HA 4.530 . 4.530 4.358 4.181 4.606 0.076 9 0 "[ . 1 . 2]" 1
1431 1 70 LYS QB 1 72 LYS H 4.930 . 4.930 4.655 4.323 4.970 0.040 15 0 "[ . 1 . 2]" 1
1432 1 70 LYS QB 1 74 GLY H 5.290 . 5.290 4.657 4.078 5.051 . 0 0 "[ . 1 . 2]" 1
1433 1 70 LYS QB 1 74 GLY HA2 5.200 . 5.200 5.076 4.501 5.296 0.096 1 0 "[ . 1 . 2]" 1
1434 1 70 LYS QB 1 74 GLY HA3 4.350 . 4.350 3.870 3.077 4.365 0.015 8 0 "[ . 1 . 2]" 1
1435 1 70 LYS HE2 1 70 LYS QG 3.560 . 3.560 2.892 2.430 3.425 . 0 0 "[ . 1 . 2]" 1
1436 1 70 LYS HE3 1 70 LYS QG 3.560 . 3.560 2.891 2.370 3.531 . 0 0 "[ . 1 . 2]" 1
1437 1 70 LYS QG 1 71 GLU H 3.680 . 3.680 3.137 2.115 3.793 0.113 3 0 "[ . 1 . 2]" 1
1438 1 70 LYS QG 1 71 GLU HA 4.240 . 4.240 3.562 3.135 4.072 . 0 0 "[ . 1 . 2]" 1
1439 1 70 LYS QG 1 74 GLY HA3 4.660 . 4.660 3.512 2.466 4.763 0.103 6 0 "[ . 1 . 2]" 1
1440 1 71 GLU H 1 71 GLU QB 2.730 . 2.730 2.581 2.167 2.835 0.105 4 0 "[ . 1 . 2]" 1
1441 1 71 GLU H 1 71 GLU HG2 3.900 . 3.900 3.173 1.975 3.717 . 0 0 "[ . 1 . 2]" 1
1442 1 71 GLU H 1 71 GLU HG3 3.900 . 3.900 2.924 1.869 3.908 0.008 7 0 "[ . 1 . 2]" 1
1443 1 71 GLU H 1 72 LYS H 3.030 . 3.030 2.368 2.280 2.479 . 0 0 "[ . 1 . 2]" 1
1444 1 71 GLU H 1 72 LYS HA 5.020 . 5.020 5.020 4.927 5.088 0.068 18 0 "[ . 1 . 2]" 1
1445 1 71 GLU H 1 72 LYS HB2 5.120 . 5.120 4.706 4.587 4.806 . 0 0 "[ . 1 . 2]" 1
1446 1 71 GLU H 1 72 LYS HG3 4.530 . 4.530 3.732 3.317 4.487 . 0 0 "[ . 1 . 2]" 1
1447 1 71 GLU H 1 73 TYR H 4.540 . 4.540 4.381 4.311 4.476 . 0 0 "[ . 1 . 2]" 1
1448 1 71 GLU HA 1 71 GLU HG2 3.900 . 3.900 3.672 2.686 4.092 0.192 1 0 "[ . 1 . 2]" 1
1449 1 71 GLU HA 1 71 GLU HG3 3.900 . 3.900 3.287 2.620 3.874 . 0 0 "[ . 1 . 2]" 1
1450 1 71 GLU HA 1 74 GLY H 4.510 . 4.510 4.230 3.794 4.522 0.012 20 0 "[ . 1 . 2]" 1
1451 1 71 GLU QB 1 72 LYS H 3.690 . 3.690 2.956 2.415 3.504 . 0 0 "[ . 1 . 2]" 1
1452 1 71 GLU QB 1 72 LYS HA 4.820 . 4.820 3.872 3.502 4.252 . 0 0 "[ . 1 . 2]" 1
1453 1 71 GLU QB 1 72 LYS HB2 5.490 . 5.490 5.012 4.510 5.537 0.047 1 0 "[ . 1 . 2]" 1
1454 1 71 GLU QB 1 73 TYR H 5.460 . 5.460 5.176 4.797 5.531 0.071 11 0 "[ . 1 . 2]" 1
1455 1 71 GLU QG 1 72 LYS H 4.220 . 4.220 3.883 2.630 4.339 0.119 6 0 "[ . 1 . 2]" 1
1456 1 71 GLU QG 1 72 LYS HG2 5.340 . 5.340 5.025 2.992 5.474 0.134 16 0 "[ . 1 . 2]" 1
1457 1 71 GLU HG2 1 72 LYS H 5.000 . 5.000 4.497 3.962 4.963 . 0 0 "[ . 1 . 2]" 1
1458 1 71 GLU HG3 1 72 LYS H 5.000 . 5.000 4.414 2.658 5.138 0.138 16 0 "[ . 1 . 2]" 1
1459 1 72 LYS H 1 72 LYS HB2 2.950 . 2.950 2.586 2.440 2.689 . 0 0 "[ . 1 . 2]" 1
1460 1 72 LYS H 1 72 LYS HB3 3.810 . 3.810 3.621 3.553 3.674 . 0 0 "[ . 1 . 2]" 1
1461 1 72 LYS H 1 72 LYS QE 4.850 . 4.850 4.415 3.806 4.880 0.030 16 0 "[ . 1 . 2]" 1
1462 1 72 LYS H 1 72 LYS HG2 3.830 . 3.830 3.144 2.442 3.418 . 0 0 "[ . 1 . 2]" 1
1463 1 72 LYS H 1 72 LYS HG3 2.880 . 2.880 2.197 1.866 2.906 0.026 1 0 "[ . 1 . 2]" 1
1464 1 72 LYS H 1 73 TYR H 3.060 . 3.060 2.606 2.445 2.774 . 0 0 "[ . 1 . 2]" 1
1465 1 72 LYS H 1 73 TYR HA 5.190 . 5.190 5.155 4.998 5.226 0.036 15 0 "[ . 1 . 2]" 1
1466 1 72 LYS H 1 73 TYR QD 5.370 . 5.370 4.852 4.642 5.049 . 0 0 "[ . 1 . 2]" 1
1467 1 72 LYS H 1 74 GLY H 3.890 . 3.890 3.481 3.249 3.667 . 0 0 "[ . 1 . 2]" 1
1468 1 72 LYS HA 1 72 LYS QD 4.810 . 4.810 4.028 3.703 4.339 . 0 0 "[ . 1 . 2]" 1
1469 1 72 LYS HA 1 72 LYS QE 4.610 . 4.610 4.216 2.440 4.783 0.173 13 0 "[ . 1 . 2]" 1
1470 1 72 LYS HA 1 72 LYS HG2 3.780 . 3.780 2.510 2.233 2.678 . 0 0 "[ . 1 . 2]" 1
1471 1 72 LYS HA 1 72 LYS HG3 3.960 . 3.960 3.241 2.948 3.779 . 0 0 "[ . 1 . 2]" 1
1472 1 72 LYS HB2 1 72 LYS QE 3.610 . 3.610 2.936 2.063 3.867 0.257 19 0 "[ . 1 . 2]" 1
1473 1 72 LYS HB2 1 73 TYR H 3.750 . 3.750 2.206 2.036 2.366 . 0 0 "[ . 1 . 2]" 1
1474 1 72 LYS HB2 1 73 TYR HB2 5.500 . 5.500 3.914 3.750 4.126 . 0 0 "[ . 1 . 2]" 1
1475 1 72 LYS HB2 1 73 TYR QD 5.060 . 5.060 2.945 2.527 3.226 . 0 0 "[ . 1 . 2]" 1
1476 1 72 LYS HB2 1 73 TYR QE 4.990 . 4.990 3.585 3.421 3.739 . 0 0 "[ . 1 . 2]" 1
1477 1 72 LYS HB2 1 74 GLY H 4.330 . 4.330 4.232 3.996 4.354 0.024 4 0 "[ . 1 . 2]" 1
1478 1 72 LYS HB3 1 72 LYS QD 3.430 . 3.430 2.551 2.174 3.069 . 0 0 "[ . 1 . 2]" 1
1479 1 72 LYS HB3 1 72 LYS QE 3.570 . 3.570 2.693 1.879 3.628 0.058 4 0 "[ . 1 . 2]" 1
1480 1 72 LYS HB3 1 73 TYR H 4.090 . 4.090 3.408 3.250 3.512 . 0 0 "[ . 1 . 2]" 1
1481 1 72 LYS HB3 1 73 TYR HB2 5.500 . 5.500 4.958 4.623 5.221 . 0 0 "[ . 1 . 2]" 1
1482 1 72 LYS HB3 1 73 TYR QD 4.940 . 4.940 3.630 3.094 3.964 . 0 0 "[ . 1 . 2]" 1
1483 1 72 LYS HB3 1 73 TYR QE 4.920 . 4.920 3.535 3.182 3.837 . 0 0 "[ . 1 . 2]" 1
1484 1 72 LYS HD2 1 73 TYR QE 4.790 . 4.790 4.034 3.120 4.894 0.104 7 0 "[ . 1 . 2]" 1
1485 1 72 LYS HD3 1 73 TYR QE 4.790 . 4.790 3.944 3.079 4.878 0.088 15 0 "[ . 1 . 2]" 1
1486 1 72 LYS QE 1 72 LYS HG2 3.480 . 3.480 2.851 2.199 3.515 0.035 15 0 "[ . 1 . 2]" 1
1487 1 72 LYS QE 1 72 LYS HG3 3.750 . 3.750 2.923 2.126 3.487 . 0 0 "[ . 1 . 2]" 1
1488 1 72 LYS QE 1 73 TYR QE 4.420 . 4.420 3.377 2.242 4.485 0.065 19 0 "[ . 1 . 2]" 1
1489 1 72 LYS HG2 1 73 TYR H 4.600 . 4.600 4.622 4.214 4.720 0.120 3 0 "[ . 1 . 2]" 1
1490 1 72 LYS HG2 1 73 TYR QD 5.480 . 5.480 5.487 5.258 5.588 0.108 5 0 "[ . 1 . 2]" 1
1491 1 72 LYS HG2 1 73 TYR QE 5.370 . 5.370 5.332 5.073 5.416 0.046 14 0 "[ . 1 . 2]" 1
1492 1 72 LYS HG3 1 73 TYR H 4.220 . 4.220 3.834 3.614 4.112 . 0 0 "[ . 1 . 2]" 1
1493 1 72 LYS HG3 1 73 TYR QD 4.860 . 4.860 4.819 4.385 4.957 0.097 10 0 "[ . 1 . 2]" 1
1494 1 72 LYS HG3 1 73 TYR QE 5.500 . 5.500 5.024 4.081 5.247 . 0 0 "[ . 1 . 2]" 1
1495 1 73 TYR H 1 73 TYR HB2 3.780 . 3.780 2.649 2.548 2.745 . 0 0 "[ . 1 . 2]" 1
1496 1 73 TYR H 1 73 TYR HB3 3.960 . 3.960 3.750 3.675 3.836 . 0 0 "[ . 1 . 2]" 1
1497 1 73 TYR H 1 73 TYR QD 3.760 . 3.760 3.125 2.890 3.268 . 0 0 "[ . 1 . 2]" 1
1498 1 73 TYR H 1 73 TYR QE 5.500 . 5.500 4.732 4.635 4.847 . 0 0 "[ . 1 . 2]" 1
1499 1 73 TYR H 1 74 GLY H 3.060 . 3.060 2.111 2.004 2.268 . 0 0 "[ . 1 . 2]" 1
1500 1 73 TYR H 1 74 GLY HA2 4.610 . 4.610 4.591 4.452 4.653 0.043 10 0 "[ . 1 . 2]" 1
1501 1 73 TYR H 1 74 GLY HA3 4.400 . 4.400 4.225 4.026 4.385 . 0 0 "[ . 1 . 2]" 1
1502 1 73 TYR HA 1 73 TYR QD 3.330 . 3.330 2.496 2.300 2.798 . 0 0 "[ . 1 . 2]" 1
1503 1 73 TYR HA 1 73 TYR QE 4.840 . 4.840 4.562 4.456 4.697 . 0 0 "[ . 1 . 2]" 1
1504 1 73 TYR HA 1 75 LYS H 3.890 . 3.890 3.545 3.237 3.744 . 0 0 "[ . 1 . 2]" 1
1505 1 73 TYR HB2 1 74 GLY H 4.840 . 4.840 3.522 3.282 3.729 . 0 0 "[ . 1 . 2]" 1
1506 1 73 TYR HB2 1 74 GLY HA3 5.310 . 5.310 4.939 4.654 5.194 . 0 0 "[ . 1 . 2]" 1
1507 1 73 TYR HB2 1 75 LYS H 5.500 . 5.500 4.988 4.818 5.161 . 0 0 "[ . 1 . 2]" 1
1508 1 73 TYR HB3 1 74 GLY H 4.760 . 4.760 4.315 4.203 4.420 . 0 0 "[ . 1 . 2]" 1
1509 1 73 TYR QD 1 74 GLY H 4.850 . 4.850 4.613 4.463 4.748 . 0 0 "[ . 1 . 2]" 1
1510 1 73 TYR QD 1 75 LYS H 5.500 . 5.500 5.555 5.503 5.593 0.093 13 0 "[ . 1 . 2]" 1
1511 1 74 GLY H 1 75 LYS H 3.530 . 3.530 3.262 2.683 3.540 0.010 1 0 "[ . 1 . 2]" 1
1512 1 74 GLY H 1 75 LYS QG 4.530 . 4.530 3.764 3.095 4.668 0.138 4 0 "[ . 1 . 2]" 1
1513 1 74 GLY HA2 1 75 LYS H 3.330 . 3.330 2.752 2.557 3.181 . 0 0 "[ . 1 . 2]" 1
1514 1 74 GLY HA2 1 86 LEU MD1 4.720 . 4.720 3.333 2.217 4.248 . 0 0 "[ . 1 . 2]" 1
1515 1 74 GLY HA2 1 86 LEU QD 3.530 . 3.530 2.393 2.026 2.964 . 0 0 "[ . 1 . 2]" 1
1516 1 74 GLY HA2 1 86 LEU MD2 4.720 . 4.720 2.874 2.039 4.057 . 0 0 "[ . 1 . 2]" 1
1517 1 74 GLY HA3 1 86 LEU QD 5.440 . 5.440 3.251 2.578 3.955 . 0 0 "[ . 1 . 2]" 1
1518 1 75 LYS H 1 75 LYS HB2 3.970 . 3.970 3.073 2.575 3.855 . 0 0 "[ . 1 . 2]" 1
1519 1 75 LYS H 1 75 LYS QB 3.220 . 3.220 2.792 2.530 3.256 0.036 9 0 "[ . 1 . 2]" 1
1520 1 75 LYS H 1 75 LYS HB3 3.970 . 3.970 3.616 2.756 3.830 . 0 0 "[ . 1 . 2]" 1
1521 1 75 LYS H 1 75 LYS QG 3.140 . 3.140 2.763 2.062 3.244 0.104 17 0 "[ . 1 . 2]" 1
1522 1 75 LYS H 1 76 PRO HA 5.500 . 5.500 5.107 4.666 5.420 . 0 0 "[ . 1 . 2]" 1
1523 1 75 LYS H 1 76 PRO HD2 5.090 . 5.090 4.974 4.814 5.092 0.002 18 0 "[ . 1 . 2]" 1
1524 1 75 LYS H 1 76 PRO HD3 5.170 . 5.170 4.695 4.404 5.010 . 0 0 "[ . 1 . 2]" 1
1525 1 75 LYS H 1 86 LEU MD1 4.230 . 4.230 3.717 3.354 4.210 . 0 0 "[ . 1 . 2]" 1
1526 1 75 LYS H 1 86 LEU QD 3.680 . 3.680 3.323 2.978 3.702 0.022 6 0 "[ . 1 . 2]" 1
1527 1 75 LYS H 1 86 LEU MD2 4.230 . 4.230 3.771 3.282 4.233 0.003 3 0 "[ . 1 . 2]" 1
1528 1 75 LYS HA 1 75 LYS QG 3.520 . 3.520 2.896 2.259 3.461 . 0 0 "[ . 1 . 2]" 1
1529 1 75 LYS HA 1 76 PRO HA 4.740 . 4.740 4.359 4.250 4.478 . 0 0 "[ . 1 . 2]" 1
1530 1 75 LYS HA 1 76 PRO HD2 3.190 . 3.190 2.538 2.184 2.863 . 0 0 "[ . 1 . 2]" 1
1531 1 75 LYS HA 1 76 PRO HD3 3.260 . 3.260 2.128 1.953 2.350 . 0 0 "[ . 1 . 2]" 1
1532 1 75 LYS HA 1 76 PRO HG2 4.650 . 4.650 4.530 4.337 4.676 0.026 2 0 "[ . 1 . 2]" 1
1533 1 75 LYS HA 1 76 PRO HG3 4.650 . 4.650 4.292 4.113 4.529 . 0 0 "[ . 1 . 2]" 1
1534 1 75 LYS QB 1 75 LYS QG 2.360 . 2.360 2.048 1.960 2.096 . 0 0 "[ . 1 . 2]" 1
1535 1 75 LYS QB 1 76 PRO HD2 3.680 . 3.680 2.456 2.082 2.999 . 0 0 "[ . 1 . 2]" 1
1536 1 75 LYS QB 1 76 PRO HD3 3.970 . 3.970 3.445 3.081 3.980 0.010 11 0 "[ . 1 . 2]" 1
1537 1 75 LYS HB2 1 76 PRO HD2 4.400 . 4.400 3.430 2.184 4.411 0.011 18 0 "[ . 1 . 2]" 1
1538 1 75 LYS HB3 1 76 PRO HD2 4.400 . 4.400 2.904 2.093 3.799 . 0 0 "[ . 1 . 2]" 1
1539 1 75 LYS QG 1 76 PRO HD2 4.120 . 4.120 3.943 3.276 4.183 0.063 16 0 "[ . 1 . 2]" 1
1540 1 75 LYS QG 1 76 PRO HD3 4.770 . 4.770 4.445 3.238 4.834 0.064 20 0 "[ . 1 . 2]" 1
1541 1 76 PRO HA 1 77 ASN H 2.850 . 2.850 2.074 1.973 2.371 . 0 0 "[ . 1 . 2]" 1
1542 1 76 PRO HA 1 77 ASN HA 5.130 . 5.130 4.356 4.275 4.490 . 0 0 "[ . 1 . 2]" 1
1543 1 76 PRO HA 1 82 PHE QD 4.290 . 4.290 2.936 2.178 3.643 . 0 0 "[ . 1 . 2]" 1
1544 1 76 PRO HA 1 82 PHE QE 4.170 . 4.170 3.359 2.446 4.194 0.024 15 0 "[ . 1 . 2]" 1
1545 1 76 PRO HA 1 83 ASN HD21 4.830 . 4.830 3.737 2.712 4.833 0.003 13 0 "[ . 1 . 2]" 1
1546 1 76 PRO HA 1 83 ASN HD22 4.730 . 4.730 3.746 3.235 4.215 . 0 0 "[ . 1 . 2]" 1
1547 1 76 PRO HA 1 86 LEU QD 3.540 . 3.540 2.403 2.136 2.836 . 0 0 "[ . 1 . 2]" 1
1548 1 76 PRO QB 1 77 ASN H 3.200 . 3.200 3.000 2.490 3.213 0.013 16 0 "[ . 1 . 2]" 1
1549 1 76 PRO QB 1 77 ASN HD21 5.340 . 5.340 5.273 4.650 5.581 0.241 8 0 "[ . 1 . 2]" 1
1550 1 76 PRO QB 1 83 ASN HD21 4.420 . 4.420 3.488 2.275 4.564 0.144 17 0 "[ . 1 . 2]" 1
1551 1 76 PRO QB 1 83 ASN HD22 4.020 . 4.020 3.160 2.693 3.816 . 0 0 "[ . 1 . 2]" 1
1552 1 76 PRO QB 1 86 LEU QD 3.710 . 3.710 3.191 2.229 3.754 0.044 1 0 "[ . 1 . 2]" 1
1553 1 76 PRO HB2 1 77 ASN H 3.650 . 3.650 3.491 2.567 3.717 0.067 18 0 "[ . 1 . 2]" 1
1554 1 76 PRO HB2 1 83 ASN HD22 4.650 . 4.650 3.895 2.810 4.658 0.008 7 0 "[ . 1 . 2]" 1
1555 1 76 PRO HB3 1 77 ASN H 3.650 . 3.650 3.333 2.738 3.727 0.077 6 0 "[ . 1 . 2]" 1
1556 1 76 PRO HB3 1 83 ASN HD22 4.650 . 4.650 3.507 2.797 4.337 . 0 0 "[ . 1 . 2]" 1
1557 1 76 PRO HD2 1 77 ASN H 5.500 . 5.500 5.498 5.424 5.541 0.041 7 0 "[ . 1 . 2]" 1
1558 1 76 PRO HD2 1 86 LEU QD 4.280 . 4.280 3.994 3.675 4.327 0.047 20 0 "[ . 1 . 2]" 1
1559 1 76 PRO HD3 1 77 ASN H 5.500 . 5.500 5.470 5.346 5.562 0.062 19 0 "[ . 1 . 2]" 1
1560 1 76 PRO HD3 1 86 LEU QD 4.400 . 4.400 2.811 2.367 3.325 . 0 0 "[ . 1 . 2]" 1
1561 1 77 ASN H 1 77 ASN QB 3.650 . 3.650 2.540 2.337 3.004 . 0 0 "[ . 1 . 2]" 1
1562 1 77 ASN H 1 77 ASN HD21 4.570 . 4.570 3.568 2.269 4.585 0.015 20 0 "[ . 1 . 2]" 1
1563 1 77 ASN H 1 78 LYS H 4.630 . 4.630 4.350 4.210 4.468 . 0 0 "[ . 1 . 2]" 1
1564 1 77 ASN H 1 78 LYS HA 5.150 . 5.150 4.869 4.214 5.180 0.030 19 0 "[ . 1 . 2]" 1
1565 1 77 ASN H 1 82 PHE QB 4.120 . 4.120 3.425 2.755 4.135 0.015 20 0 "[ . 1 . 2]" 1
1566 1 77 ASN H 1 82 PHE QD 3.910 . 3.910 2.720 2.172 3.263 . 0 0 "[ . 1 . 2]" 1
1567 1 77 ASN H 1 82 PHE QE 5.240 . 5.240 3.756 2.954 4.709 . 0 0 "[ . 1 . 2]" 1
1568 1 77 ASN H 1 83 ASN H 4.750 . 4.750 4.619 4.123 4.811 0.061 2 0 "[ . 1 . 2]" 1
1569 1 77 ASN H 1 83 ASN HD21 3.650 . 3.650 3.172 2.370 3.733 0.083 5 0 "[ . 1 . 2]" 1
1570 1 77 ASN H 1 83 ASN HD22 3.770 . 3.770 2.663 2.135 3.219 . 0 0 "[ . 1 . 2]" 1
1571 1 77 ASN H 1 86 LEU QD 4.490 . 4.490 3.734 3.213 4.424 . 0 0 "[ . 1 . 2]" 1
1572 1 77 ASN HA 1 77 ASN HD21 4.270 . 4.270 2.736 2.218 3.970 . 0 0 "[ . 1 . 2]" 1
1573 1 77 ASN HA 1 78 LYS H 3.280 . 3.280 2.652 2.453 2.892 . 0 0 "[ . 1 . 2]" 1
1574 1 77 ASN HA 1 78 LYS HA 4.590 . 4.590 4.338 4.221 4.453 . 0 0 "[ . 1 . 2]" 1
1575 1 77 ASN HA 1 78 LYS QD 4.380 . 4.380 3.640 2.292 4.423 0.043 14 0 "[ . 1 . 2]" 1
1576 1 77 ASN HA 1 79 ARG H 4.360 . 4.360 4.092 3.849 4.385 0.025 3 0 "[ . 1 . 2]" 1
1577 1 77 ASN QB 1 78 LYS H 3.310 . 3.310 2.225 1.669 2.717 . 0 0 "[ . 1 . 2]" 1
1578 1 77 ASN QB 1 78 LYS HB2 4.670 . 4.670 4.438 3.815 4.779 0.109 2 0 "[ . 1 . 2]" 1
1579 1 77 ASN QB 1 79 ARG H 3.290 . 3.290 2.171 1.892 2.852 . 0 0 "[ . 1 . 2]" 1
1580 1 77 ASN QB 1 82 PHE QD 4.800 . 4.800 3.019 2.490 4.806 0.006 3 0 "[ . 1 . 2]" 1
1581 1 77 ASN HB2 1 78 LYS H 3.860 . 3.860 3.383 1.674 3.730 . 0 0 "[ . 1 . 2]" 1
1582 1 77 ASN HB2 1 79 ARG H 3.960 . 3.960 3.314 2.319 4.023 0.063 9 0 "[ . 1 . 2]" 1
1583 1 77 ASN HB3 1 78 LYS H 3.860 . 3.860 2.339 1.783 3.262 . 0 0 "[ . 1 . 2]" 1
1584 1 77 ASN HB3 1 79 ARG H 3.960 . 3.960 2.319 1.898 4.192 0.232 3 0 "[ . 1 . 2]" 1
1585 1 77 ASN HD21 1 79 ARG H 4.820 . 4.820 4.904 4.705 5.007 0.187 14 0 "[ . 1 . 2]" 1
1586 1 78 LYS H 1 78 LYS HB2 3.490 . 3.490 2.485 2.324 2.638 . 0 0 "[ . 1 . 2]" 1
1587 1 78 LYS H 1 78 LYS HB3 3.800 . 3.800 3.672 3.569 3.774 . 0 0 "[ . 1 . 2]" 1
1588 1 78 LYS H 1 78 LYS QD 4.570 . 4.570 3.137 1.998 4.000 . 0 0 "[ . 1 . 2]" 1
1589 1 78 LYS H 1 78 LYS QG 3.550 . 3.550 3.096 2.635 3.609 0.059 4 0 "[ . 1 . 2]" 1
1590 1 78 LYS H 1 79 ARG H 3.400 . 3.400 2.225 2.000 2.574 . 0 0 "[ . 1 . 2]" 1
1591 1 78 LYS HA 1 78 LYS QD 4.020 . 4.020 2.409 1.781 3.323 . 0 0 "[ . 1 . 2]" 1
1592 1 78 LYS HA 1 78 LYS QG 3.240 . 3.240 2.744 2.322 3.002 . 0 0 "[ . 1 . 2]" 1
1593 1 78 LYS HA 1 79 ARG H 3.560 . 3.560 3.140 2.702 3.491 . 0 0 "[ . 1 . 2]" 1
1594 1 78 LYS HB2 1 79 ARG H 4.220 . 4.220 3.677 3.195 4.175 . 0 0 "[ . 1 . 2]" 1
1595 1 78 LYS QG 1 79 ARG H 4.750 . 4.750 4.608 4.269 4.798 0.048 9 0 "[ . 1 . 2]" 1
1596 1 79 ARG H 1 79 ARG QB 2.860 . 2.860 2.235 1.819 2.484 . 0 0 "[ . 1 . 2]" 1
1597 1 79 ARG H 1 79 ARG HD2 5.200 . 5.200 4.861 4.518 5.095 . 0 0 "[ . 1 . 2]" 1
1598 1 79 ARG H 1 79 ARG QD 4.320 . 4.320 4.047 3.684 4.330 0.010 9 0 "[ . 1 . 2]" 1
1599 1 79 ARG H 1 79 ARG HD3 5.200 . 5.200 4.415 3.815 5.350 0.150 14 0 "[ . 1 . 2]" 1
1600 1 79 ARG H 1 79 ARG HG2 3.300 . 3.300 2.891 2.435 3.481 0.181 8 0 "[ . 1 . 2]" 1
1601 1 79 ARG H 1 79 ARG HG3 3.960 . 3.960 3.905 3.665 4.048 0.088 9 0 "[ . 1 . 2]" 1
1602 1 79 ARG H 1 80 LYS H 4.710 . 4.710 4.428 4.323 4.567 . 0 0 "[ . 1 . 2]" 1
1603 1 79 ARG H 1 82 PHE HB2 4.450 . 4.450 3.974 3.695 4.211 . 0 0 "[ . 1 . 2]" 1
1604 1 79 ARG H 1 82 PHE HB3 4.450 . 4.450 3.616 3.230 4.171 . 0 0 "[ . 1 . 2]" 1
1605 1 79 ARG H 1 82 PHE QD 4.610 . 4.610 4.625 4.504 4.710 0.100 3 0 "[ . 1 . 2]" 1
1606 1 79 ARG HA 1 79 ARG HD2 3.670 . 3.670 2.997 2.099 3.428 . 0 0 "[ . 1 . 2]" 1
1607 1 79 ARG HA 1 79 ARG HD3 3.670 . 3.670 2.458 2.011 3.581 . 0 0 "[ . 1 . 2]" 1
1608 1 79 ARG HA 1 79 ARG HG2 4.010 . 4.010 2.791 2.212 3.157 . 0 0 "[ . 1 . 2]" 1
1609 1 79 ARG HA 1 80 LYS H 2.870 . 2.870 2.174 2.069 2.283 . 0 0 "[ . 1 . 2]" 1
1610 1 79 ARG QB 1 79 ARG HD2 3.800 . 3.800 2.422 2.248 2.858 . 0 0 "[ . 1 . 2]" 1
1611 1 79 ARG QB 1 79 ARG HD3 3.800 . 3.800 3.030 2.858 3.453 . 0 0 "[ . 1 . 2]" 1
1612 1 79 ARG QB 1 80 LYS H 3.640 . 3.640 3.355 3.131 3.679 0.039 8 0 "[ . 1 . 2]" 1
1613 1 79 ARG QB 1 80 LYS HA 4.770 . 4.770 4.468 4.342 4.634 . 0 0 "[ . 1 . 2]" 1
1614 1 79 ARG QB 1 82 PHE H 4.140 . 4.140 3.281 3.130 3.366 . 0 0 "[ . 1 . 2]" 1
1615 1 79 ARG QB 1 82 PHE HA 4.340 . 4.340 4.333 4.123 4.419 0.079 8 0 "[ . 1 . 2]" 1
1616 1 79 ARG QB 1 82 PHE HB2 4.390 . 4.390 2.160 2.023 2.371 . 0 0 "[ . 1 . 2]" 1
1617 1 79 ARG QB 1 82 PHE QB 3.790 . 3.790 2.100 1.952 2.330 . 0 0 "[ . 1 . 2]" 1
1618 1 79 ARG QB 1 82 PHE HB3 4.390 . 4.390 2.891 2.408 3.461 . 0 0 "[ . 1 . 2]" 1
1619 1 79 ARG QB 1 83 ASN H 5.080 . 5.080 4.670 4.350 5.049 . 0 0 "[ . 1 . 2]" 1
1620 1 79 ARG QD 1 80 LYS H 3.980 . 3.980 3.474 2.898 4.000 0.020 10 0 "[ . 1 . 2]" 1
1621 1 79 ARG HD2 1 80 LYS H 4.760 . 4.760 4.069 3.036 4.769 0.009 11 0 "[ . 1 . 2]" 1
1622 1 79 ARG HD3 1 80 LYS H 4.760 . 4.760 3.970 3.008 4.803 0.043 12 0 "[ . 1 . 2]" 1
1623 1 80 LYS H 1 80 LYS HB2 3.070 . 3.070 2.508 2.230 2.745 . 0 0 "[ . 1 . 2]" 1
1624 1 80 LYS H 1 80 LYS HB3 3.070 . 3.070 2.594 2.394 3.082 0.012 8 0 "[ . 1 . 2]" 1
1625 1 80 LYS H 1 80 LYS QD 4.530 . 4.530 4.355 3.511 4.580 0.050 18 0 "[ . 1 . 2]" 1
1626 1 80 LYS H 1 80 LYS HG2 4.750 . 4.750 4.507 4.328 4.687 . 0 0 "[ . 1 . 2]" 1
1627 1 80 LYS H 1 80 LYS QG 4.160 . 4.160 4.004 3.918 4.094 . 0 0 "[ . 1 . 2]" 1
1628 1 80 LYS H 1 80 LYS HG3 4.750 . 4.750 4.489 4.406 4.685 . 0 0 "[ . 1 . 2]" 1
1629 1 80 LYS HA 1 80 LYS QD 3.980 . 3.980 2.954 2.014 4.100 0.120 15 0 "[ . 1 . 2]" 1
1630 1 80 LYS HA 1 80 LYS HG2 3.700 . 3.700 3.227 2.338 3.773 0.073 5 0 "[ . 1 . 2]" 1
1631 1 80 LYS HA 1 80 LYS HG3 3.700 . 3.700 3.086 2.489 3.753 0.053 19 0 "[ . 1 . 2]" 1
1632 1 80 LYS HA 1 81 GLY H 2.790 . 2.790 2.209 2.100 2.308 . 0 0 "[ . 1 . 2]" 1
1633 1 80 LYS HA 1 81 GLY HA2 4.530 . 4.530 4.405 4.316 4.480 . 0 0 "[ . 1 . 2]" 1
1634 1 80 LYS HA 1 82 PHE H 3.930 . 3.930 3.264 2.964 3.529 . 0 0 "[ . 1 . 2]" 1
1635 1 80 LYS QB 1 81 GLY H 3.900 . 3.900 3.674 3.331 3.867 . 0 0 "[ . 1 . 2]" 1
1636 1 80 LYS HB2 1 81 GLY H 4.440 . 4.440 4.241 3.960 4.457 0.017 13 0 "[ . 1 . 2]" 1
1637 1 80 LYS HB3 1 81 GLY H 4.440 . 4.440 4.049 3.480 4.310 . 0 0 "[ . 1 . 2]" 1
1638 1 80 LYS QD 1 81 GLY H 4.770 . 4.770 3.143 1.730 4.574 . 0 0 "[ . 1 . 2]" 1
1639 1 80 LYS QE 1 80 LYS HG2 3.610 . 3.610 2.606 2.329 3.545 . 0 0 "[ . 1 . 2]" 1
1640 1 80 LYS QE 1 80 LYS QG 3.110 . 3.110 2.401 2.142 2.867 . 0 0 "[ . 1 . 2]" 1
1641 1 80 LYS QE 1 80 LYS HG3 3.610 . 3.610 2.978 2.477 3.528 . 0 0 "[ . 1 . 2]" 1
1642 1 80 LYS QG 1 81 GLY H 3.600 . 3.600 2.831 2.048 3.507 . 0 0 "[ . 1 . 2]" 1
1643 1 81 GLY H 1 82 PHE H 3.470 . 3.470 2.604 2.444 2.868 . 0 0 "[ . 1 . 2]" 1
1644 1 81 GLY H 1 82 PHE HA 5.470 . 5.470 4.991 4.877 5.265 . 0 0 "[ . 1 . 2]" 1
1645 1 81 GLY H 1 83 ASN H 4.610 . 4.610 3.205 2.916 3.771 . 0 0 "[ . 1 . 2]" 1
1646 1 81 GLY H 1 84 GLU H 4.590 . 4.590 3.212 2.921 3.467 . 0 0 "[ . 1 . 2]" 1
1647 1 81 GLY HA2 1 83 ASN H 4.880 . 4.880 4.389 4.149 4.645 . 0 0 "[ . 1 . 2]" 1
1648 1 81 GLY HA2 1 84 GLU H 4.370 . 4.370 3.558 3.407 3.673 . 0 0 "[ . 1 . 2]" 1
1649 1 81 GLY HA3 1 82 PHE HA 4.680 . 4.680 4.341 4.249 4.397 . 0 0 "[ . 1 . 2]" 1
1650 1 81 GLY HA3 1 83 ASN H 5.470 . 5.470 4.810 4.634 5.025 . 0 0 "[ . 1 . 2]" 1
1651 1 81 GLY HA3 1 84 GLU H 4.940 . 4.940 4.809 4.662 4.915 . 0 0 "[ . 1 . 2]" 1
1652 1 82 PHE H 1 82 PHE HB2 3.440 . 3.440 2.450 2.361 2.516 . 0 0 "[ . 1 . 2]" 1
1653 1 82 PHE H 1 82 PHE HB3 3.440 . 3.440 2.585 2.429 2.701 . 0 0 "[ . 1 . 2]" 1
1654 1 82 PHE H 1 82 PHE QD 4.140 . 4.140 4.168 4.153 4.185 0.045 14 0 "[ . 1 . 2]" 1
1655 1 82 PHE H 1 83 ASN H 3.530 . 3.530 2.418 2.339 2.577 . 0 0 "[ . 1 . 2]" 1
1656 1 82 PHE H 1 83 ASN QB 5.260 . 5.260 4.485 4.316 4.640 . 0 0 "[ . 1 . 2]" 1
1657 1 82 PHE H 1 84 GLU H 4.260 . 4.260 3.872 3.744 4.018 . 0 0 "[ . 1 . 2]" 1
1658 1 82 PHE HA 1 82 PHE QD 3.930 . 3.930 3.105 2.984 3.158 . 0 0 "[ . 1 . 2]" 1
1659 1 82 PHE HA 1 84 GLU H 4.590 . 4.590 4.568 4.390 4.631 0.041 17 0 "[ . 1 . 2]" 1
1660 1 82 PHE HA 1 85 GLY H 4.000 . 4.000 3.444 3.269 3.628 . 0 0 "[ . 1 . 2]" 1
1661 1 82 PHE QB 1 83 ASN H 3.260 . 3.260 2.449 2.136 2.688 . 0 0 "[ . 1 . 2]" 1
1662 1 82 PHE QB 1 83 ASN HD21 4.190 . 4.190 3.427 2.186 4.287 0.097 7 0 "[ . 1 . 2]" 1
1663 1 82 PHE HB2 1 83 ASN H 3.790 . 3.790 3.672 3.511 3.814 0.024 4 0 "[ . 1 . 2]" 1
1664 1 82 PHE HB3 1 83 ASN H 3.790 . 3.790 2.488 2.155 2.747 . 0 0 "[ . 1 . 2]" 1
1665 1 82 PHE QD 1 83 ASN H 4.010 . 4.010 3.613 3.216 3.841 . 0 0 "[ . 1 . 2]" 1
1666 1 82 PHE QD 1 86 LEU QD 4.240 . 4.240 2.770 2.362 3.330 . 0 0 "[ . 1 . 2]" 1
1667 1 82 PHE QE 1 86 LEU MD1 3.700 . 3.700 2.667 2.088 3.663 . 0 0 "[ . 1 . 2]" 1
1668 1 82 PHE QE 1 86 LEU QD 3.240 . 3.240 2.343 1.905 2.945 . 0 0 "[ . 1 . 2]" 1
1669 1 82 PHE QE 1 86 LEU MD2 3.700 . 3.700 2.692 2.197 3.103 . 0 0 "[ . 1 . 2]" 1
1670 1 82 PHE HZ 1 86 LEU QD 4.130 . 4.130 3.747 3.417 4.155 0.025 7 0 "[ . 1 . 2]" 1
1671 1 83 ASN H 1 83 ASN QB 3.140 . 3.140 2.488 2.324 2.657 . 0 0 "[ . 1 . 2]" 1
1672 1 83 ASN H 1 83 ASN HD21 4.050 . 4.050 2.818 1.894 3.838 . 0 0 "[ . 1 . 2]" 1
1673 1 83 ASN H 1 83 ASN HD22 4.810 . 4.810 3.751 3.466 4.194 . 0 0 "[ . 1 . 2]" 1
1674 1 83 ASN H 1 84 GLU H 3.480 . 3.480 2.467 2.308 2.714 . 0 0 "[ . 1 . 2]" 1
1675 1 83 ASN H 1 84 GLU HA 5.500 . 5.500 5.114 4.983 5.308 . 0 0 "[ . 1 . 2]" 1
1676 1 83 ASN H 1 85 GLY H 4.490 . 4.490 3.757 3.568 3.949 . 0 0 "[ . 1 . 2]" 1
1677 1 83 ASN H 1 86 LEU QD 5.320 . 5.320 4.664 4.213 5.266 . 0 0 "[ . 1 . 2]" 1
1678 1 83 ASN HA 1 85 GLY H 4.440 . 4.440 4.303 4.091 4.469 0.029 2 0 "[ . 1 . 2]" 1
1679 1 83 ASN HA 1 86 LEU H 3.950 . 3.950 3.423 3.064 3.706 . 0 0 "[ . 1 . 2]" 1
1680 1 83 ASN HA 1 86 LEU HB2 5.060 . 5.060 3.075 2.616 3.553 . 0 0 "[ . 1 . 2]" 1
1681 1 83 ASN HA 1 86 LEU QB 4.200 . 4.200 2.887 2.247 3.094 . 0 0 "[ . 1 . 2]" 1
1682 1 83 ASN HA 1 86 LEU HB3 5.060 . 5.060 4.035 2.440 4.723 . 0 0 "[ . 1 . 2]" 1
1683 1 83 ASN HA 1 86 LEU QD 3.560 . 3.560 2.569 2.020 3.301 . 0 0 "[ . 1 . 2]" 1
1684 1 83 ASN HA 1 87 TRP H 4.620 . 4.620 4.564 4.215 4.649 0.029 19 0 "[ . 1 . 2]" 1
1685 1 83 ASN QB 1 83 ASN HD22 3.790 . 3.790 3.386 3.219 3.487 . 0 0 "[ . 1 . 2]" 1
1686 1 83 ASN QB 1 84 GLU H 3.430 . 3.430 2.415 2.105 2.702 . 0 0 "[ . 1 . 2]" 1
1687 1 83 ASN QB 1 84 GLU HA 4.850 . 4.850 3.836 3.637 4.060 . 0 0 "[ . 1 . 2]" 1
1688 1 83 ASN QB 1 85 GLY H 4.980 . 4.980 4.538 4.403 4.657 . 0 0 "[ . 1 . 2]" 1
1689 1 83 ASN QB 1 86 LEU H 5.500 . 5.500 4.803 4.637 4.956 . 0 0 "[ . 1 . 2]" 1
1690 1 83 ASN QB 1 86 LEU QD 4.900 . 4.900 3.938 3.244 4.575 . 0 0 "[ . 1 . 2]" 1
1691 1 83 ASN HD21 1 84 GLU H 5.210 . 5.210 4.461 3.938 5.239 0.029 19 0 "[ . 1 . 2]" 1
1692 1 83 ASN HD21 1 86 LEU QD 5.420 . 5.420 4.259 3.079 5.473 0.053 13 0 "[ . 1 . 2]" 1
1693 1 84 GLU H 1 84 GLU HB2 3.640 . 3.640 2.462 2.328 2.663 . 0 0 "[ . 1 . 2]" 1
1694 1 84 GLU H 1 84 GLU QB 3.090 . 3.090 2.417 2.297 2.597 . 0 0 "[ . 1 . 2]" 1
1695 1 84 GLU H 1 84 GLU HB3 3.640 . 3.640 3.529 3.481 3.623 . 0 0 "[ . 1 . 2]" 1
1696 1 84 GLU H 1 84 GLU HG2 3.810 . 3.810 3.636 3.394 3.831 0.021 7 0 "[ . 1 . 2]" 1
1697 1 84 GLU H 1 84 GLU QG 3.290 . 3.290 2.715 1.950 3.221 . 0 0 "[ . 1 . 2]" 1
1698 1 84 GLU H 1 84 GLU HG3 3.810 . 3.810 2.859 1.962 3.591 . 0 0 "[ . 1 . 2]" 1
1699 1 84 GLU H 1 85 GLY H 3.410 . 3.410 2.580 2.431 2.694 . 0 0 "[ . 1 . 2]" 1
1700 1 84 GLU HA 1 84 GLU HG2 3.700 . 3.700 3.456 2.652 3.752 0.052 14 0 "[ . 1 . 2]" 1
1701 1 84 GLU HA 1 84 GLU QG 3.160 . 3.160 2.516 2.441 2.562 . 0 0 "[ . 1 . 2]" 1
1702 1 84 GLU HA 1 84 GLU HG3 3.700 . 3.700 2.644 2.494 2.871 . 0 0 "[ . 1 . 2]" 1
1703 1 84 GLU HA 1 87 TRP H 4.390 . 4.390 3.460 3.206 3.641 . 0 0 "[ . 1 . 2]" 1
1704 1 84 GLU HA 1 87 TRP HB2 4.480 . 4.480 3.689 3.279 4.028 . 0 0 "[ . 1 . 2]" 1
1705 1 84 GLU HA 1 87 TRP HB3 4.140 . 4.140 2.890 2.599 3.319 . 0 0 "[ . 1 . 2]" 1
1706 1 84 GLU QB 1 85 GLY HA2 5.100 . 5.100 3.888 3.798 3.989 . 0 0 "[ . 1 . 2]" 1
1707 1 84 GLU QB 1 85 GLY HA3 5.340 . 5.340 4.254 4.144 4.342 . 0 0 "[ . 1 . 2]" 1
1708 1 84 GLU HB2 1 85 GLY H 3.910 . 3.910 2.633 2.505 2.775 . 0 0 "[ . 1 . 2]" 1
1709 1 84 GLU HB3 1 85 GLY H 3.910 . 3.910 3.719 3.520 3.920 0.010 15 0 "[ . 1 . 2]" 1
1710 1 84 GLU QG 1 85 GLY H 4.860 . 4.860 4.291 3.935 4.477 . 0 0 "[ . 1 . 2]" 1
1711 1 85 GLY H 1 86 LEU QD 5.440 . 5.440 4.948 4.684 5.348 . 0 0 "[ . 1 . 2]" 1
1712 1 85 GLY H 1 87 TRP H 4.260 . 4.260 3.993 3.822 4.101 . 0 0 "[ . 1 . 2]" 1
1713 1 85 GLY HA2 1 88 GLU HB2 4.420 . 4.420 2.308 2.239 2.371 . 0 0 "[ . 1 . 2]" 1
1714 1 85 GLY HA2 1 88 GLU HB3 5.480 . 5.480 3.997 3.948 4.045 . 0 0 "[ . 1 . 2]" 1
1715 1 85 GLY HA3 1 88 GLU H 4.760 . 4.760 4.391 4.295 4.487 . 0 0 "[ . 1 . 2]" 1
1716 1 85 GLY HA3 1 88 GLU HB2 4.980 . 4.980 3.908 3.842 3.966 . 0 0 "[ . 1 . 2]" 1
1717 1 85 GLY HA3 1 88 GLU HB3 5.500 . 5.500 5.534 5.507 5.553 0.053 4 0 "[ . 1 . 2]" 1
1718 1 86 LEU H 1 86 LEU HB2 3.810 . 3.810 2.421 2.219 2.543 . 0 0 "[ . 1 . 2]" 1
1719 1 86 LEU H 1 86 LEU QB 3.180 . 3.180 2.337 2.043 2.496 . 0 0 "[ . 1 . 2]" 1
1720 1 86 LEU H 1 86 LEU HB3 3.810 . 3.810 3.255 2.379 3.646 . 0 0 "[ . 1 . 2]" 1
1721 1 86 LEU H 1 86 LEU MD1 3.870 . 3.870 3.737 3.634 3.906 0.036 8 0 "[ . 1 . 2]" 1
1722 1 86 LEU H 1 86 LEU MD2 3.870 . 3.870 3.588 3.282 3.979 0.109 20 0 "[ . 1 . 2]" 1
1723 1 86 LEU H 1 86 LEU HG 4.370 . 4.370 2.994 2.271 4.397 0.027 20 0 "[ . 1 . 2]" 1
1724 1 86 LEU H 1 87 TRP H 3.510 . 3.510 2.621 2.546 2.730 . 0 0 "[ . 1 . 2]" 1
1725 1 86 LEU H 1 88 GLU H 4.730 . 4.730 4.182 4.072 4.276 . 0 0 "[ . 1 . 2]" 1
1726 1 86 LEU H 1 89 ILE MG 4.560 . 4.560 4.179 4.070 4.294 . 0 0 "[ . 1 . 2]" 1
1727 1 86 LEU HA 1 86 LEU MD1 4.090 . 4.090 3.334 2.037 3.923 . 0 0 "[ . 1 . 2]" 1
1728 1 86 LEU HA 1 86 LEU QD 2.840 . 2.840 2.054 2.005 2.093 . 0 0 "[ . 1 . 2]" 1
1729 1 86 LEU HA 1 86 LEU MD2 4.090 . 4.090 2.589 2.012 3.844 . 0 0 "[ . 1 . 2]" 1
1730 1 86 LEU HA 1 89 ILE H 3.900 . 3.900 3.704 3.436 3.932 0.032 1 0 "[ . 1 . 2]" 1
1731 1 86 LEU HA 1 89 ILE HB 5.500 . 5.500 4.256 3.917 4.609 . 0 0 "[ . 1 . 2]" 1
1732 1 86 LEU HA 1 89 ILE MD 5.150 . 5.150 4.603 4.335 4.823 . 0 0 "[ . 1 . 2]" 1
1733 1 86 LEU HA 1 89 ILE MG 3.190 . 3.190 2.160 1.925 2.351 . 0 0 "[ . 1 . 2]" 1
1734 1 86 LEU QB 1 86 LEU QD 2.820 . 2.820 1.920 1.867 1.949 . 0 0 "[ . 1 . 2]" 1
1735 1 86 LEU QB 1 89 ILE MG 4.020 . 4.020 3.809 3.587 4.036 0.016 7 0 "[ . 1 . 2]" 1
1736 1 86 LEU HB2 1 87 TRP H 3.870 . 3.870 3.034 2.570 3.834 . 0 0 "[ . 1 . 2]" 1
1737 1 86 LEU HB3 1 87 TRP H 3.870 . 3.870 3.352 2.515 3.715 . 0 0 "[ . 1 . 2]" 1
1738 1 86 LEU MD1 1 87 TRP H 4.950 . 4.950 4.581 4.466 4.671 . 0 0 "[ . 1 . 2]" 1
1739 1 86 LEU MD2 1 87 TRP H 4.950 . 4.950 4.604 4.286 4.751 . 0 0 "[ . 1 . 2]" 1
1740 1 87 TRP H 1 87 TRP HB2 3.250 . 3.250 2.685 2.619 2.743 . 0 0 "[ . 1 . 2]" 1
1741 1 87 TRP H 1 87 TRP HB3 3.330 . 3.330 2.396 2.362 2.427 . 0 0 "[ . 1 . 2]" 1
1742 1 87 TRP H 1 87 TRP HD1 5.340 . 5.340 5.035 4.964 5.086 . 0 0 "[ . 1 . 2]" 1
1743 1 87 TRP H 1 87 TRP HE3 4.360 . 4.360 4.399 4.376 4.428 0.068 15 0 "[ . 1 . 2]" 1
1744 1 87 TRP H 1 88 GLU H 3.400 . 3.400 2.599 2.507 2.673 . 0 0 "[ . 1 . 2]" 1
1745 1 87 TRP H 1 89 ILE MG 4.480 . 4.480 4.239 4.149 4.428 . 0 0 "[ . 1 . 2]" 1
1746 1 87 TRP HA 1 87 TRP HD1 4.090 . 4.090 2.991 2.897 3.072 . 0 0 "[ . 1 . 2]" 1
1747 1 87 TRP HA 1 87 TRP HE1 5.270 . 5.270 5.035 4.954 5.105 . 0 0 "[ . 1 . 2]" 1
1748 1 87 TRP HA 1 87 TRP HE3 4.730 . 4.730 4.702 4.601 4.761 0.031 6 0 "[ . 1 . 2]" 1
1749 1 87 TRP HA 1 90 ASP H 4.540 . 4.540 3.708 3.600 3.862 . 0 0 "[ . 1 . 2]" 1
1750 1 87 TRP HA 1 90 ASP HB2 4.300 . 4.300 3.565 2.940 4.010 . 0 0 "[ . 1 . 2]" 1
1751 1 87 TRP HA 1 90 ASP HB3 4.700 . 4.700 3.775 2.796 4.738 0.038 10 0 "[ . 1 . 2]" 1
1752 1 87 TRP HA 1 91 ASN H 4.520 . 4.520 4.323 3.988 4.545 0.025 11 0 "[ . 1 . 2]" 1
1753 1 87 TRP HA 1 91 ASN HD21 3.960 . 3.960 3.253 2.636 3.973 0.013 6 0 "[ . 1 . 2]" 1
1754 1 87 TRP HA 1 91 ASN HD22 4.130 . 4.130 3.652 3.216 4.124 . 0 0 "[ . 1 . 2]" 1
1755 1 87 TRP HB2 1 87 TRP HE1 5.040 . 5.040 4.810 4.793 4.824 . 0 0 "[ . 1 . 2]" 1
1756 1 87 TRP HB2 1 88 GLU H 4.040 . 4.040 3.889 3.814 3.944 . 0 0 "[ . 1 . 2]" 1
1757 1 87 TRP HB3 1 88 GLU H 3.690 . 3.690 2.518 2.429 2.567 . 0 0 "[ . 1 . 2]" 1
1758 1 87 TRP HB3 1 89 ILE H 5.180 . 5.180 5.126 5.048 5.187 0.007 2 0 "[ . 1 . 2]" 1
1759 1 87 TRP HD1 1 88 GLU H 5.500 . 5.500 5.534 5.502 5.574 0.074 10 0 "[ . 1 . 2]" 1
1760 1 87 TRP HD1 1 91 ASN HD21 4.560 . 4.560 3.808 3.495 4.147 . 0 0 "[ . 1 . 2]" 1
1761 1 87 TRP HD1 1 91 ASN HD22 4.480 . 4.480 3.105 2.912 3.385 . 0 0 "[ . 1 . 2]" 1
1762 1 87 TRP HE1 1 91 ASN HB2 4.650 . 4.650 4.213 3.507 4.524 . 0 0 "[ . 1 . 2]" 1
1763 1 87 TRP HE1 1 91 ASN HB3 4.650 . 4.650 4.447 3.836 4.661 0.011 20 0 "[ . 1 . 2]" 1
1764 1 87 TRP HE1 1 91 ASN HD21 4.370 . 4.370 4.291 3.951 4.426 0.056 1 0 "[ . 1 . 2]" 1
1765 1 87 TRP HE1 1 91 ASN HD22 4.040 . 4.040 3.610 3.354 3.871 . 0 0 "[ . 1 . 2]" 1
1766 1 87 TRP HE3 1 88 GLU H 3.740 . 3.740 2.815 2.683 2.923 . 0 0 "[ . 1 . 2]" 1
1767 1 87 TRP HE3 1 88 GLU HA 3.620 . 3.620 3.182 2.872 3.483 . 0 0 "[ . 1 . 2]" 1
1768 1 87 TRP HE3 1 88 GLU HG2 4.100 . 4.100 2.853 2.543 3.231 . 0 0 "[ . 1 . 2]" 1
1769 1 87 TRP HE3 1 88 GLU HG3 3.960 . 3.960 2.366 2.203 2.660 . 0 0 "[ . 1 . 2]" 1
1770 1 87 TRP HH2 1 88 GLU HG2 5.220 . 5.220 4.709 4.484 4.889 . 0 0 "[ . 1 . 2]" 1
1771 1 87 TRP HH2 1 91 ASN HB2 5.500 . 5.500 4.964 4.800 5.176 . 0 0 "[ . 1 . 2]" 1
1772 1 87 TRP HH2 1 91 ASN HB3 5.230 . 5.230 5.209 4.805 5.249 0.019 14 0 "[ . 1 . 2]" 1
1773 1 87 TRP HZ3 1 88 GLU HA 4.300 . 4.300 3.925 3.613 4.228 . 0 0 "[ . 1 . 2]" 1
1774 1 87 TRP HZ3 1 88 GLU HG2 4.750 . 4.750 2.681 2.443 2.999 . 0 0 "[ . 1 . 2]" 1
1775 1 87 TRP HZ3 1 88 GLU HG3 4.640 . 4.640 3.355 3.043 3.544 . 0 0 "[ . 1 . 2]" 1
1776 1 87 TRP HZ3 1 91 ASN HB2 5.440 . 5.440 5.223 4.941 5.360 . 0 0 "[ . 1 . 2]" 1
1777 1 88 GLU H 1 88 GLU HB2 3.570 . 3.570 2.426 2.378 2.507 . 0 0 "[ . 1 . 2]" 1
1778 1 88 GLU H 1 88 GLU HB3 3.780 . 3.780 3.633 3.610 3.671 . 0 0 "[ . 1 . 2]" 1
1779 1 88 GLU H 1 88 GLU HG2 3.790 . 3.790 3.568 3.481 3.678 . 0 0 "[ . 1 . 2]" 1
1780 1 88 GLU H 1 88 GLU HG3 3.460 . 3.460 2.638 2.489 2.792 . 0 0 "[ . 1 . 2]" 1
1781 1 88 GLU H 1 89 ILE H 3.680 . 3.680 2.860 2.813 2.908 . 0 0 "[ . 1 . 2]" 1
1782 1 88 GLU H 1 89 ILE HB 5.240 . 5.240 5.248 5.156 5.276 0.036 10 0 "[ . 1 . 2]" 1
1783 1 88 GLU H 1 89 ILE MG 4.520 . 4.520 4.187 4.129 4.269 . 0 0 "[ . 1 . 2]" 1
1784 1 88 GLU H 1 90 ASP H 4.730 . 4.730 4.221 4.104 4.395 . 0 0 "[ . 1 . 2]" 1
1785 1 88 GLU HA 1 88 GLU HG2 3.820 . 3.820 2.319 2.268 2.367 . 0 0 "[ . 1 . 2]" 1
1786 1 88 GLU HA 1 88 GLU HG3 3.910 . 3.910 3.064 2.995 3.162 . 0 0 "[ . 1 . 2]" 1
1787 1 88 GLU HA 1 90 ASP H 4.490 . 4.490 4.133 3.858 4.398 . 0 0 "[ . 1 . 2]" 1
1788 1 88 GLU HA 1 91 ASN H 3.930 . 3.930 3.495 3.273 3.650 . 0 0 "[ . 1 . 2]" 1
1789 1 88 GLU HA 1 92 ASN H 3.430 . 3.430 2.843 2.782 2.948 . 0 0 "[ . 1 . 2]" 1
1790 1 88 GLU HA 1 92 ASN HB2 4.790 . 4.790 4.537 3.424 4.865 0.075 19 0 "[ . 1 . 2]" 1
1791 1 88 GLU HA 1 92 ASN HB3 4.240 . 4.240 3.597 3.233 3.884 . 0 0 "[ . 1 . 2]" 1
1792 1 88 GLU HB2 1 89 ILE H 3.690 . 3.690 2.809 2.590 3.060 . 0 0 "[ . 1 . 2]" 1
1793 1 88 GLU HB3 1 89 ILE H 3.950 . 3.950 3.487 3.267 3.643 . 0 0 "[ . 1 . 2]" 1
1794 1 88 GLU HB3 1 89 ILE HA 4.550 . 4.550 3.985 3.786 4.084 . 0 0 "[ . 1 . 2]" 1
1795 1 88 GLU HB3 1 91 ASN H 5.310 . 5.310 5.280 5.141 5.362 0.052 9 0 "[ . 1 . 2]" 1
1796 1 88 GLU HB3 1 92 ASN H 4.590 . 4.590 4.329 4.040 4.468 . 0 0 "[ . 1 . 2]" 1
1797 1 88 GLU HB3 1 92 ASN HB3 4.900 . 4.900 4.115 2.877 4.500 . 0 0 "[ . 1 . 2]" 1
1798 1 88 GLU HG2 1 89 ILE H 5.130 . 5.130 5.019 4.898 5.128 . 0 0 "[ . 1 . 2]" 1
1799 1 88 GLU HG2 1 92 ASN H 4.640 . 4.640 4.699 4.661 4.746 0.106 1 0 "[ . 1 . 2]" 1
1800 1 88 GLU HG2 1 92 ASN HB3 4.430 . 4.430 3.942 3.399 4.256 . 0 0 "[ . 1 . 2]" 1
1801 1 88 GLU HG2 1 95 VAL QG 4.900 . 4.900 3.428 2.550 4.915 0.015 7 0 "[ . 1 . 2]" 1
1802 1 88 GLU HG3 1 89 ILE H 4.920 . 4.920 4.682 4.527 4.854 . 0 0 "[ . 1 . 2]" 1
1803 1 89 ILE H 1 89 ILE HB 3.240 . 3.240 2.568 2.513 2.633 . 0 0 "[ . 1 . 2]" 1
1804 1 89 ILE H 1 89 ILE MD 4.480 . 4.480 4.441 4.393 4.486 0.006 19 0 "[ . 1 . 2]" 1
1805 1 89 ILE H 1 89 ILE HG12 4.770 . 4.770 4.543 4.516 4.578 . 0 0 "[ . 1 . 2]" 1
1806 1 89 ILE H 1 89 ILE QG 4.140 . 4.140 3.999 3.968 4.021 . 0 0 "[ . 1 . 2]" 1
1807 1 89 ILE H 1 89 ILE HG13 4.770 . 4.770 4.439 4.398 4.485 . 0 0 "[ . 1 . 2]" 1
1808 1 89 ILE H 1 89 ILE MG 2.950 . 2.950 2.126 2.075 2.169 . 0 0 "[ . 1 . 2]" 1
1809 1 89 ILE H 1 90 ASP H 3.510 . 3.510 2.588 2.481 2.679 . 0 0 "[ . 1 . 2]" 1
1810 1 89 ILE H 1 90 ASP HB2 4.560 . 4.560 4.574 4.460 4.619 0.059 19 0 "[ . 1 . 2]" 1
1811 1 89 ILE H 1 91 ASN H 4.090 . 4.090 4.050 3.945 4.137 0.047 9 0 "[ . 1 . 2]" 1
1812 1 89 ILE HA 1 89 ILE MD 3.830 . 3.830 3.749 3.702 3.789 . 0 0 "[ . 1 . 2]" 1
1813 1 89 ILE HA 1 89 ILE HG12 3.750 . 3.750 3.109 3.040 3.174 . 0 0 "[ . 1 . 2]" 1
1814 1 89 ILE HA 1 89 ILE QG 3.150 . 3.150 2.320 2.290 2.353 . 0 0 "[ . 1 . 2]" 1
1815 1 89 ILE HA 1 89 ILE HG13 3.750 . 3.750 2.395 2.358 2.430 . 0 0 "[ . 1 . 2]" 1
1816 1 89 ILE HA 1 89 ILE MG 3.570 . 3.570 3.224 3.216 3.236 . 0 0 "[ . 1 . 2]" 1
1817 1 89 ILE HA 1 93 PRO HA 3.770 . 3.770 2.517 2.093 3.231 . 0 0 "[ . 1 . 2]" 1
1818 1 89 ILE HA 1 93 PRO HD3 4.660 . 4.660 4.169 3.633 4.534 . 0 0 "[ . 1 . 2]" 1
1819 1 89 ILE HB 1 89 ILE MD 3.240 . 3.240 2.394 2.361 2.433 . 0 0 "[ . 1 . 2]" 1
1820 1 89 ILE HB 1 90 ASP H 4.260 . 4.260 4.141 4.065 4.190 . 0 0 "[ . 1 . 2]" 1
1821 1 89 ILE MD 1 89 ILE MG 2.950 . 2.950 1.985 1.949 2.050 . 0 0 "[ . 1 . 2]" 1
1822 1 89 ILE MD 1 93 PRO HA 5.000 . 5.000 5.022 4.752 5.108 0.108 9 0 "[ . 1 . 2]" 1
1823 1 89 ILE QG 1 89 ILE MG 3.040 . 3.040 2.309 2.271 2.331 . 0 0 "[ . 1 . 2]" 1
1824 1 89 ILE QG 1 90 ASP H 5.060 . 5.060 4.055 3.860 4.182 . 0 0 "[ . 1 . 2]" 1
1825 1 89 ILE HG12 1 89 ILE MG 3.550 . 3.550 2.368 2.325 2.394 . 0 0 "[ . 1 . 2]" 1
1826 1 89 ILE HG13 1 89 ILE MG 3.550 . 3.550 3.203 3.192 3.213 . 0 0 "[ . 1 . 2]" 1
1827 1 89 ILE MG 1 90 ASP H 3.190 . 3.190 2.526 2.354 2.650 . 0 0 "[ . 1 . 2]" 1
1828 1 89 ILE MG 1 90 ASP HA 4.570 . 4.570 3.416 3.290 3.536 . 0 0 "[ . 1 . 2]" 1
1829 1 89 ILE MG 1 90 ASP HB2 4.260 . 4.260 3.156 2.708 3.777 . 0 0 "[ . 1 . 2]" 1
1830 1 89 ILE MG 1 90 ASP HB3 5.280 . 5.280 4.249 3.863 4.746 . 0 0 "[ . 1 . 2]" 1
1831 1 89 ILE MG 1 91 ASN H 4.460 . 4.460 4.382 4.257 4.500 0.040 6 0 "[ . 1 . 2]" 1
1832 1 90 ASP H 1 90 ASP HB2 3.180 . 3.180 2.385 2.154 2.595 . 0 0 "[ . 1 . 2]" 1
1833 1 90 ASP H 1 90 ASP HB3 3.570 . 3.570 2.961 2.283 3.574 0.004 15 0 "[ . 1 . 2]" 1
1834 1 90 ASP H 1 91 ASN H 3.170 . 3.170 2.279 2.142 2.493 . 0 0 "[ . 1 . 2]" 1
1835 1 90 ASP H 1 91 ASN HB2 4.550 . 4.550 4.509 4.299 4.567 0.017 20 0 "[ . 1 . 2]" 1
1836 1 90 ASP H 1 91 ASN HD21 4.380 . 4.380 3.554 3.440 3.626 . 0 0 "[ . 1 . 2]" 1
1837 1 90 ASP H 1 91 ASN HD22 4.890 . 4.890 4.924 4.873 4.984 0.094 19 0 "[ . 1 . 2]" 1
1838 1 90 ASP H 1 92 ASN H 4.370 . 4.370 4.051 3.659 4.383 0.013 15 0 "[ . 1 . 2]" 1
1839 1 90 ASP HA 1 92 ASN H 5.500 . 5.500 5.226 4.806 5.440 . 0 0 "[ . 1 . 2]" 1
1840 1 90 ASP HB2 1 91 ASN H 4.370 . 4.370 3.613 2.894 3.905 . 0 0 "[ . 1 . 2]" 1
1841 1 90 ASP HB2 1 91 ASN HD21 4.200 . 4.200 3.525 2.789 4.167 . 0 0 "[ . 1 . 2]" 1
1842 1 90 ASP HB2 1 91 ASN HD22 4.750 . 4.750 4.213 3.314 4.764 0.014 3 0 "[ . 1 . 2]" 1
1843 1 90 ASP HB3 1 91 ASN H 4.100 . 4.100 3.263 2.425 4.102 0.002 10 0 "[ . 1 . 2]" 1
1844 1 90 ASP HB3 1 91 ASN HD21 4.380 . 4.380 2.854 2.045 3.932 . 0 0 "[ . 1 . 2]" 1
1845 1 90 ASP HB3 1 91 ASN HD22 4.210 . 4.210 3.306 2.886 3.925 . 0 0 "[ . 1 . 2]" 1
1846 1 91 ASN H 1 91 ASN HB2 3.530 . 3.530 2.570 2.453 2.641 . 0 0 "[ . 1 . 2]" 1
1847 1 91 ASN H 1 91 ASN HB3 3.770 . 3.770 3.760 3.698 3.803 0.033 15 0 "[ . 1 . 2]" 1
1848 1 91 ASN H 1 91 ASN HD21 3.720 . 3.720 2.449 2.052 2.857 . 0 0 "[ . 1 . 2]" 1
1849 1 91 ASN H 1 91 ASN HD22 4.370 . 4.370 4.012 3.653 4.320 . 0 0 "[ . 1 . 2]" 1
1850 1 91 ASN H 1 92 ASN H 3.140 . 3.140 2.284 2.163 2.400 . 0 0 "[ . 1 . 2]" 1
1851 1 91 ASN H 1 92 ASN HA 4.890 . 4.890 4.793 4.641 4.937 0.047 6 0 "[ . 1 . 2]" 1
1852 1 91 ASN H 1 92 ASN HB2 5.400 . 5.400 5.182 4.713 5.335 . 0 0 "[ . 1 . 2]" 1
1853 1 91 ASN H 1 93 PRO HD3 4.160 . 4.160 3.668 3.334 4.137 . 0 0 "[ . 1 . 2]" 1
1854 1 91 ASN HA 1 91 ASN HD21 4.810 . 4.810 3.174 2.555 3.691 . 0 0 "[ . 1 . 2]" 1
1855 1 91 ASN HA 1 91 ASN HD22 4.960 . 4.960 3.955 3.656 4.170 . 0 0 "[ . 1 . 2]" 1
1856 1 91 ASN HA 1 93 PRO HD3 4.810 . 4.810 3.942 3.652 4.103 . 0 0 "[ . 1 . 2]" 1
1857 1 91 ASN HB2 1 91 ASN HD22 3.870 . 3.870 3.587 3.450 3.742 . 0 0 "[ . 1 . 2]" 1
1858 1 91 ASN HB2 1 92 ASN H 4.060 . 4.060 2.546 2.404 2.861 . 0 0 "[ . 1 . 2]" 1
1859 1 91 ASN HB3 1 92 ASN H 4.210 . 4.210 3.418 3.219 3.759 . 0 0 "[ . 1 . 2]" 1
1860 1 91 ASN HD21 1 92 ASN H 4.610 . 4.610 4.080 4.032 4.118 . 0 0 "[ . 1 . 2]" 1
1861 1 91 ASN HD22 1 92 ASN H 5.500 . 5.500 5.592 5.558 5.617 0.117 6 0 "[ . 1 . 2]" 1
1862 1 92 ASN H 1 92 ASN HB2 3.770 . 3.770 3.098 2.932 3.209 . 0 0 "[ . 1 . 2]" 1
1863 1 92 ASN H 1 92 ASN HB3 3.420 . 3.420 2.842 2.717 2.997 . 0 0 "[ . 1 . 2]" 1
1864 1 92 ASN H 1 93 PRO HA 4.780 . 4.780 4.450 4.208 4.630 . 0 0 "[ . 1 . 2]" 1
1865 1 92 ASN H 1 93 PRO HD2 4.110 . 4.110 4.011 3.663 4.159 0.049 15 0 "[ . 1 . 2]" 1
1866 1 92 ASN H 1 93 PRO HD3 3.390 . 3.390 3.181 2.857 3.428 0.038 15 0 "[ . 1 . 2]" 1
1867 1 92 ASN HA 1 93 PRO HD2 3.340 . 3.340 2.229 1.999 2.520 . 0 0 "[ . 1 . 2]" 1
1868 1 92 ASN HA 1 93 PRO HD3 3.520 . 3.520 2.972 2.745 3.350 . 0 0 "[ . 1 . 2]" 1
1869 1 92 ASN HA 1 94 LYS H 4.040 . 4.040 3.214 2.955 3.621 . 0 0 "[ . 1 . 2]" 1
1870 1 92 ASN HB2 1 92 ASN HD22 4.040 . 4.040 3.792 3.740 4.032 . 0 0 "[ . 1 . 2]" 1
1871 1 92 ASN HB3 1 92 ASN QD 3.400 . 3.400 2.184 2.105 2.254 . 0 0 "[ . 1 . 2]" 1
1872 1 92 ASN HB3 1 92 ASN HD22 3.990 . 3.990 3.471 3.432 3.500 . 0 0 "[ . 1 . 2]" 1
1873 1 92 ASN HB3 1 94 LYS H 5.150 . 5.150 4.463 4.304 4.641 . 0 0 "[ . 1 . 2]" 1
1874 1 92 ASN HB3 1 95 VAL H 4.340 . 4.340 4.339 4.136 4.422 0.082 8 0 "[ . 1 . 2]" 1
1875 1 92 ASN HB3 1 95 VAL QG 4.190 . 4.190 3.329 2.915 3.758 . 0 0 "[ . 1 . 2]" 1
1876 1 92 ASN QD 1 95 VAL H 4.000 . 4.000 3.828 2.655 4.000 0.000 10 0 "[ . 1 . 2]" 1
1877 1 92 ASN QD 1 95 VAL HA 3.550 . 3.550 2.960 2.114 3.546 . 0 0 "[ . 1 . 2]" 1
1878 1 92 ASN QD 1 95 VAL HB 3.470 . 3.470 2.161 1.711 2.369 . 0 0 "[ . 1 . 2]" 1
1879 1 92 ASN QD 1 95 VAL QG 3.050 . 3.050 2.391 2.069 2.622 . 0 0 "[ . 1 . 2]" 1
1880 1 92 ASN HD21 1 95 VAL H 4.640 . 4.640 4.394 2.772 4.652 0.012 7 0 "[ . 1 . 2]" 1
1881 1 92 ASN HD21 1 95 VAL HB 3.970 . 3.970 2.301 1.738 2.645 . 0 0 "[ . 1 . 2]" 1
1882 1 92 ASN HD21 1 95 VAL MG1 4.330 . 4.330 3.632 2.794 4.105 . 0 0 "[ . 1 . 2]" 1
1883 1 92 ASN HD21 1 95 VAL MG2 4.330 . 4.330 2.744 2.212 3.432 . 0 0 "[ . 1 . 2]" 1
1884 1 92 ASN HD22 1 95 VAL H 4.640 . 4.640 4.228 3.396 4.397 . 0 0 "[ . 1 . 2]" 1
1885 1 92 ASN HD22 1 95 VAL HB 3.970 . 3.970 2.694 2.357 2.952 . 0 0 "[ . 1 . 2]" 1
1886 1 92 ASN HD22 1 95 VAL MG1 4.330 . 4.330 4.227 3.878 4.376 0.046 16 0 "[ . 1 . 2]" 1
1887 1 92 ASN HD22 1 95 VAL MG2 4.330 . 4.330 2.833 2.462 3.635 . 0 0 "[ . 1 . 2]" 1
1888 1 93 PRO HA 1 95 VAL HB 5.020 . 5.020 5.051 4.810 5.120 0.100 8 0 "[ . 1 . 2]" 1
1889 1 93 PRO HA 1 95 VAL QG 4.250 . 4.250 3.484 3.237 3.866 . 0 0 "[ . 1 . 2]" 1
1890 1 93 PRO HD2 1 94 LYS H 3.990 . 3.990 2.901 2.665 3.170 . 0 0 "[ . 1 . 2]" 1
1891 1 93 PRO HD3 1 94 LYS H 4.800 . 4.800 3.936 3.749 4.197 . 0 0 "[ . 1 . 2]" 1
1892 1 94 LYS H 1 94 LYS HB2 3.730 . 3.730 3.668 3.563 3.752 0.022 19 0 "[ . 1 . 2]" 1
1893 1 94 LYS H 1 94 LYS HB3 3.340 . 3.340 2.911 2.715 3.147 . 0 0 "[ . 1 . 2]" 1
1894 1 94 LYS H 1 94 LYS QD 4.170 . 4.170 3.930 3.632 4.209 0.039 19 0 "[ . 1 . 2]" 1
1895 1 94 LYS H 1 94 LYS QE 5.450 . 5.450 4.518 3.560 5.099 . 0 0 "[ . 1 . 2]" 1
1896 1 94 LYS H 1 94 LYS HG2 3.580 . 3.580 2.065 1.755 2.497 . 0 0 "[ . 1 . 2]" 1
1897 1 94 LYS H 1 94 LYS QG 3.130 . 3.130 2.021 1.729 2.417 . 0 0 "[ . 1 . 2]" 1
1898 1 94 LYS H 1 94 LYS HG3 3.580 . 3.580 3.004 2.293 3.523 . 0 0 "[ . 1 . 2]" 1
1899 1 94 LYS H 1 95 VAL H 3.040 . 3.040 2.508 2.376 2.581 . 0 0 "[ . 1 . 2]" 1
1900 1 94 LYS H 1 95 VAL HA 4.670 . 4.670 4.587 4.349 4.726 0.056 8 0 "[ . 1 . 2]" 1
1901 1 94 LYS H 1 95 VAL HB 4.660 . 4.660 4.207 4.000 4.381 . 0 0 "[ . 1 . 2]" 1
1902 1 94 LYS H 1 95 VAL MG1 5.500 . 5.500 4.062 3.925 4.289 . 0 0 "[ . 1 . 2]" 1
1903 1 94 LYS H 1 95 VAL QG 4.320 . 4.320 3.954 3.832 4.121 . 0 0 "[ . 1 . 2]" 1
1904 1 94 LYS H 1 95 VAL MG2 5.500 . 5.500 5.438 5.290 5.536 0.036 8 0 "[ . 1 . 2]" 1
1905 1 94 LYS HA 1 94 LYS QD 4.550 . 4.550 4.335 4.264 4.570 0.020 19 0 "[ . 1 . 2]" 1
1906 1 94 LYS HA 1 94 LYS HG2 3.900 . 3.900 3.753 3.595 3.913 0.013 15 0 "[ . 1 . 2]" 1
1907 1 94 LYS HA 1 94 LYS QG 3.420 . 3.420 3.348 3.298 3.401 . 0 0 "[ . 1 . 2]" 1
1908 1 94 LYS HA 1 94 LYS HG3 3.900 . 3.900 3.769 3.627 3.844 . 0 0 "[ . 1 . 2]" 1
1909 1 94 LYS HA 1 95 VAL H 3.530 . 3.530 3.105 2.991 3.257 . 0 0 "[ . 1 . 2]" 1
1910 1 94 LYS HA 1 95 VAL QG 4.810 . 4.810 4.532 4.221 4.660 . 0 0 "[ . 1 . 2]" 1
1911 1 94 LYS HB2 1 95 VAL H 4.720 . 4.720 4.431 4.319 4.488 . 0 0 "[ . 1 . 2]" 1
1912 1 94 LYS HB2 1 95 VAL HA 5.500 . 5.500 4.829 4.620 5.088 . 0 0 "[ . 1 . 2]" 1
1913 1 94 LYS HB3 1 95 VAL H 4.700 . 4.700 4.525 4.363 4.640 . 0 0 "[ . 1 . 2]" 1
1914 1 94 LYS QE 1 94 LYS HG2 3.730 . 3.730 2.866 2.356 3.574 . 0 0 "[ . 1 . 2]" 1
1915 1 94 LYS QE 1 94 LYS QG 3.150 . 3.150 2.418 2.102 2.942 . 0 0 "[ . 1 . 2]" 1
1916 1 94 LYS QE 1 94 LYS HG3 3.730 . 3.730 2.729 2.362 3.506 . 0 0 "[ . 1 . 2]" 1
1917 1 94 LYS QG 1 95 VAL HA 4.630 . 4.630 3.695 3.284 4.233 . 0 0 "[ . 1 . 2]" 1
1918 1 95 VAL H 1 95 VAL HB 2.880 . 2.880 2.557 2.390 2.657 . 0 0 "[ . 1 . 2]" 1
1919 1 95 VAL H 1 95 VAL MG1 3.890 . 3.890 2.157 2.024 2.240 . 0 0 "[ . 1 . 2]" 1
1920 1 95 VAL H 1 95 VAL QG 2.820 . 2.820 2.145 2.016 2.225 . 0 0 "[ . 1 . 2]" 1
1921 1 95 VAL H 1 95 VAL MG2 3.890 . 3.890 3.793 3.743 3.820 . 0 0 "[ . 1 . 2]" 1
1922 1 95 VAL HA 1 95 VAL MG1 3.550 . 3.550 3.230 3.209 3.264 . 0 0 "[ . 1 . 2]" 1
1923 1 95 VAL HA 1 95 VAL QG 2.880 . 2.880 2.296 2.255 2.354 . 0 0 "[ . 1 . 2]" 1
1924 1 95 VAL HA 1 95 VAL MG2 3.550 . 3.550 2.349 2.304 2.420 . 0 0 "[ . 1 . 2]" 1
1925 1 95 VAL HA 1 96 LYS H 3.040 . 3.040 2.185 1.839 2.548 . 0 0 "[ . 1 . 2]" 1
1926 1 95 VAL HA 1 96 LYS HA 4.510 . 4.510 4.352 4.147 4.547 0.037 6 0 "[ . 1 . 2]" 1
1927 1 95 VAL HA 1 96 LYS QB 4.410 . 4.410 4.280 3.848 4.504 0.094 12 0 "[ . 1 . 2]" 1
1928 1 95 VAL HA 1 96 LYS QG 5.210 . 5.210 4.214 3.682 5.450 0.240 8 0 "[ . 1 . 2]" 1
1929 1 95 VAL QG 1 96 LYS H 3.420 . 3.420 2.485 1.798 3.457 0.037 11 0 "[ . 1 . 2]" 1
1930 1 95 VAL QG 1 96 LYS HA 4.480 . 4.480 3.398 3.020 4.055 . 0 0 "[ . 1 . 2]" 1
1931 1 95 VAL QG 1 97 PHE H 4.800 . 4.800 4.291 2.717 4.840 0.040 10 0 "[ . 1 . 2]" 1
1932 1 96 LYS HA 1 96 LYS QG 3.670 . 3.670 2.943 2.370 3.532 . 0 0 "[ . 1 . 2]" 1
1933 1 96 LYS HA 1 97 PHE H 3.370 . 3.370 2.830 2.188 3.466 0.096 2 0 "[ . 1 . 2]" 1
1934 1 96 LYS QB 1 97 PHE H 3.910 . 3.910 2.305 1.679 3.934 0.024 12 0 "[ . 1 . 2]" 1
1935 1 96 LYS HB2 1 97 PHE H 4.580 . 4.580 2.836 1.813 4.430 . 0 0 "[ . 1 . 2]" 1
1936 1 96 LYS HB3 1 97 PHE H 4.580 . 4.580 3.071 1.687 4.403 . 0 0 "[ . 1 . 2]" 1
1937 1 96 LYS QG 1 97 PHE H 4.590 . 4.590 3.538 2.702 4.220 . 0 0 "[ . 1 . 2]" 1
1938 1 97 PHE H 1 97 PHE HB2 3.730 . 3.730 2.889 2.367 3.762 0.032 13 0 "[ . 1 . 2]" 1
1939 1 97 PHE H 1 97 PHE HB3 3.730 . 3.730 3.120 2.545 3.753 0.023 11 0 "[ . 1 . 2]" 1
1940 1 97 PHE HA 1 97 PHE QD 3.850 . 3.850 2.931 2.452 3.774 . 0 0 "[ . 1 . 2]" 1
1941 1 97 PHE HA 1 98 SER H 3.480 . 3.480 2.725 1.970 3.533 0.053 8 0 "[ . 1 . 2]" 1
1942 1 97 PHE QB 1 98 SER H 3.690 . 3.690 2.761 1.796 3.798 0.108 19 0 "[ . 1 . 2]" 1
1943 1 97 PHE HB2 1 98 SER H 4.440 . 4.440 3.342 1.807 4.424 . 0 0 "[ . 1 . 2]" 1
1944 1 97 PHE HB3 1 98 SER H 4.440 . 4.440 3.332 2.059 4.297 . 0 0 "[ . 1 . 2]" 1
1945 1 97 PHE QD 1 98 SER H 4.420 . 4.420 3.613 2.739 4.451 0.031 5 0 "[ . 1 . 2]" 1
1946 1 98 SER H 1 98 SER QB 3.530 . 3.530 2.807 2.398 3.460 . 0 0 "[ . 1 . 2]" 1
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