NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
565666 |
2mc1   |
19423 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mc1
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 2292
_Distance_constraint_stats_list.Viol_count 4307
_Distance_constraint_stats_list.Viol_total 4783.185
_Distance_constraint_stats_list.Viol_max 0.296
_Distance_constraint_stats_list.Viol_rms 0.0217
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0052
_Distance_constraint_stats_list.Viol_average_violations_only 0.0555
_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 3 MET 1.312 0.189 2 0 "[ . 1 . 2]"
1 4 GLN 1.476 0.189 2 0 "[ . 1 . 2]"
1 5 ASP 3.350 0.231 7 0 "[ . 1 . 2]"
1 6 LEU 4.705 0.231 7 0 "[ . 1 . 2]"
1 7 SER 2.873 0.162 19 0 "[ . 1 . 2]"
1 8 VAL 1.651 0.074 14 0 "[ . 1 . 2]"
1 9 HIS 4.980 0.123 11 0 "[ . 1 . 2]"
1 10 LEU 6.587 0.201 14 0 "[ . 1 . 2]"
1 11 TRP 4.671 0.139 10 0 "[ . 1 . 2]"
1 12 TYR 5.087 0.132 19 0 "[ . 1 . 2]"
1 13 ALA 2.574 0.079 15 0 "[ . 1 . 2]"
1 14 GLY 1.207 0.107 2 0 "[ . 1 . 2]"
1 15 PRO 1.030 0.107 2 0 "[ . 1 . 2]"
1 16 MET 2.040 0.106 11 0 "[ . 1 . 2]"
1 17 GLU 2.149 0.094 10 0 "[ . 1 . 2]"
1 18 ARG 0.294 0.050 13 0 "[ . 1 . 2]"
1 19 ALA 3.333 0.097 6 0 "[ . 1 . 2]"
1 20 GLY 3.283 0.120 2 0 "[ . 1 . 2]"
1 21 ALA 4.323 0.139 11 0 "[ . 1 . 2]"
1 22 GLU 9.087 0.207 10 0 "[ . 1 . 2]"
1 23 SER 4.756 0.144 2 0 "[ . 1 . 2]"
1 24 ILE 5.923 0.143 14 0 "[ . 1 . 2]"
1 25 LEU 2.671 0.126 1 0 "[ . 1 . 2]"
1 26 ALA 1.818 0.210 18 0 "[ . 1 . 2]"
1 27 ASN 0.347 0.210 18 0 "[ . 1 . 2]"
1 28 ARG 3.257 0.149 14 0 "[ . 1 . 2]"
1 29 SER 3.278 0.149 14 0 "[ . 1 . 2]"
1 30 ASP 0.479 0.130 3 0 "[ . 1 . 2]"
1 31 GLY 2.170 0.146 3 0 "[ . 1 . 2]"
1 32 THR 1.693 0.125 17 0 "[ . 1 . 2]"
1 33 PHE 0.785 0.065 13 0 "[ . 1 . 2]"
1 34 LEU 3.541 0.114 5 0 "[ . 1 . 2]"
1 35 VAL 4.056 0.123 4 0 "[ . 1 . 2]"
1 36 ARG 2.813 0.257 18 0 "[ . 1 . 2]"
1 37 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 LYS 4.344 0.186 15 0 "[ . 1 . 2]"
1 51 TYR 5.174 0.160 15 0 "[ . 1 . 2]"
1 52 ASN 1.278 0.114 16 0 "[ . 1 . 2]"
1 53 VAL 2.677 0.164 4 0 "[ . 1 . 2]"
1 54 GLU 7.213 0.212 6 0 "[ . 1 . 2]"
1 55 VAL 3.773 0.137 16 0 "[ . 1 . 2]"
1 56 LYS 8.977 0.166 13 0 "[ . 1 . 2]"
1 57 HIS 6.376 0.207 10 0 "[ . 1 . 2]"
1 58 ILE 8.303 0.254 8 0 "[ . 1 . 2]"
1 59 LYS 0.030 0.020 16 0 "[ . 1 . 2]"
1 60 ILE 2.666 0.137 8 0 "[ . 1 . 2]"
1 61 MET 2.334 0.148 4 0 "[ . 1 . 2]"
1 62 THR 3.811 0.241 16 0 "[ . 1 . 2]"
1 63 ALA 8.092 0.241 16 0 "[ . 1 . 2]"
1 64 GLU 3.965 0.173 2 0 "[ . 1 . 2]"
1 65 GLY 0.999 0.099 8 0 "[ . 1 . 2]"
1 66 LEU 4.672 0.144 1 0 "[ . 1 . 2]"
1 67 TYR 3.892 0.115 3 0 "[ . 1 . 2]"
1 68 ARG 8.849 0.194 18 0 "[ . 1 . 2]"
1 69 ILE 9.756 0.202 17 0 "[ . 1 . 2]"
1 70 THR 4.346 0.288 18 0 "[ . 1 . 2]"
1 71 GLU 5.823 0.288 18 0 "[ . 1 . 2]"
1 72 LYS 9.180 0.277 19 0 "[ . 1 . 2]"
1 73 LYS 7.816 0.173 5 0 "[ . 1 . 2]"
1 74 ALA 5.350 0.194 18 0 "[ . 1 . 2]"
1 75 PHE 7.491 0.182 11 0 "[ . 1 . 2]"
1 76 ARG 5.050 0.296 13 0 "[ . 1 . 2]"
1 77 GLY 3.373 0.296 13 0 "[ . 1 . 2]"
1 78 LEU 7.375 0.168 1 0 "[ . 1 . 2]"
1 79 THR 2.165 0.139 10 0 "[ . 1 . 2]"
1 80 GLU 9.164 0.225 2 0 "[ . 1 . 2]"
1 81 LEU 11.537 0.231 16 0 "[ . 1 . 2]"
1 82 VAL 10.894 0.231 16 0 "[ . 1 . 2]"
1 83 GLU 11.901 0.212 14 0 "[ . 1 . 2]"
1 84 PHE 7.157 0.177 2 0 "[ . 1 . 2]"
1 85 TYR 4.435 0.132 11 0 "[ . 1 . 2]"
1 86 GLN 4.240 0.147 2 0 "[ . 1 . 2]"
1 87 GLN 1.289 0.151 19 0 "[ . 1 . 2]"
1 88 ASN 1.754 0.095 7 0 "[ . 1 . 2]"
1 89 SER 4.888 0.182 17 0 "[ . 1 . 2]"
1 90 LEU 8.870 0.218 15 0 "[ . 1 . 2]"
1 91 LYS 9.318 0.182 17 0 "[ . 1 . 2]"
1 92 ASP 7.961 0.218 15 0 "[ . 1 . 2]"
1 93 CYS 5.289 0.291 9 0 "[ . 1 . 2]"
1 94 PHE 7.031 0.291 9 0 "[ . 1 . 2]"
1 95 LYS 9.800 0.254 8 0 "[ . 1 . 2]"
1 96 SER 1.929 0.105 9 0 "[ . 1 . 2]"
1 97 LEU 16.533 0.263 16 0 "[ . 1 . 2]"
1 98 ASP 6.342 0.127 12 0 "[ . 1 . 2]"
1 99 THR 10.491 0.263 16 0 "[ . 1 . 2]"
1 100 THR 3.593 0.147 2 0 "[ . 1 . 2]"
1 101 LEU 2.779 0.101 18 0 "[ . 1 . 2]"
1 102 GLN 3.688 0.115 4 0 "[ . 1 . 2]"
1 103 PHE 1.636 0.105 6 0 "[ . 1 . 2]"
1 104 PRO 4.119 0.123 7 0 "[ . 1 . 2]"
1 105 PHE 5.011 0.152 5 0 "[ . 1 . 2]"
1 106 LYS 8.587 0.222 2 0 "[ . 1 . 2]"
1 107 GLU 9.777 0.201 14 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 MET HA 1 3 MET QG 2.650 . 3.500 2.270 1.954 3.171 . 0 0 "[ . 1 . 2]" 1
2 1 3 MET HA 1 4 GLN H 2.570 . 3.340 3.133 2.186 3.529 0.189 2 0 "[ . 1 . 2]" 1
3 1 4 GLN H 1 4 GLN QB 2.670 . 3.540 2.486 2.133 3.239 . 0 0 "[ . 1 . 2]" 1
4 1 4 GLN H 1 4 GLN QG 3.150 . 4.500 3.774 2.418 4.266 . 0 0 "[ . 1 . 2]" 1
5 1 4 GLN HA 1 4 GLN QG 2.570 . 3.340 2.284 2.019 3.351 0.011 14 0 "[ . 1 . 2]" 1
6 1 4 GLN HA 1 6 LEU QD 3.390 . 4.980 3.733 2.790 4.770 . 0 0 "[ . 1 . 2]" 1
7 1 4 GLN QB 1 5 ASP H 3.120 . 4.440 3.703 2.362 3.998 . 0 0 "[ . 1 . 2]" 1
8 1 4 GLN QB 1 6 LEU H 3.525 . 5.250 4.213 3.289 4.951 . 0 0 "[ . 1 . 2]" 1
9 1 4 GLN QB 1 6 LEU QD 2.885 . 3.970 3.595 2.562 4.073 0.103 10 0 "[ . 1 . 2]" 1
10 1 4 GLN HB2 1 5 ASP H 3.460 . 5.120 4.327 3.097 4.639 . 0 0 "[ . 1 . 2]" 1
11 1 4 GLN HB3 1 5 ASP H 3.460 . 5.120 4.050 2.433 4.408 . 0 0 "[ . 1 . 2]" 1
12 1 4 GLN QG 1 5 ASP H 3.385 . 4.970 4.322 3.326 4.721 . 0 0 "[ . 1 . 2]" 1
13 1 4 GLN QG 1 6 LEU QD 3.040 . 4.280 2.854 2.207 3.948 . 0 0 "[ . 1 . 2]" 1
14 1 5 ASP H 1 5 ASP QB 2.715 . 3.630 2.775 2.233 3.060 . 0 0 "[ . 1 . 2]" 1
15 1 5 ASP HA 1 6 LEU H 2.180 . 2.560 2.354 2.150 2.628 0.068 10 0 "[ . 1 . 2]" 1
16 1 5 ASP HA 1 6 LEU QD 3.235 . 4.670 4.431 3.986 4.703 0.033 18 0 "[ . 1 . 2]" 1
17 1 5 ASP HA 1 6 LEU HG 3.435 . 5.070 4.056 3.584 4.471 . 0 0 "[ . 1 . 2]" 1
18 1 5 ASP HA 1 7 SER H 2.630 . 3.460 3.127 2.907 3.446 . 0 0 "[ . 1 . 2]" 1
19 1 5 ASP HA 1 8 VAL H 3.500 . 5.200 4.812 4.550 5.096 . 0 0 "[ . 1 . 2]" 1
20 1 5 ASP HA 1 8 VAL MG2 3.650 . 5.500 5.148 4.827 5.400 . 0 0 "[ . 1 . 2]" 1
21 1 5 ASP QB 1 6 LEU H 2.735 . 3.670 3.790 3.463 3.901 0.231 7 0 "[ . 1 . 2]" 1
22 1 5 ASP QB 1 7 SER H 2.815 . 3.830 3.417 2.941 3.889 0.059 19 0 "[ . 1 . 2]" 1
23 1 5 ASP QB 1 8 VAL H 2.865 . 3.930 3.631 3.374 3.821 . 0 0 "[ . 1 . 2]" 1
24 1 5 ASP QB 1 8 VAL MG1 2.860 . 3.920 2.590 2.235 3.111 . 0 0 "[ . 1 . 2]" 1
25 1 5 ASP QB 1 8 VAL MG2 3.150 . 4.500 3.786 3.404 4.139 . 0 0 "[ . 1 . 2]" 1
26 1 5 ASP HB2 1 7 SER H 3.080 . 4.360 4.043 3.658 4.388 0.028 10 0 "[ . 1 . 2]" 1
27 1 5 ASP HB2 1 8 VAL H 3.230 . 4.660 3.876 3.538 4.703 0.043 20 0 "[ . 1 . 2]" 1
28 1 5 ASP HB2 1 8 VAL MG1 3.220 . 4.640 2.663 2.256 3.442 . 0 0 "[ . 1 . 2]" 1
29 1 5 ASP HB3 1 7 SER H 3.080 . 4.360 3.737 3.008 4.353 . 0 0 "[ . 1 . 2]" 1
30 1 5 ASP HB3 1 8 VAL H 3.230 . 4.660 4.514 3.996 4.734 0.074 14 0 "[ . 1 . 2]" 1
31 1 5 ASP HB3 1 8 VAL MG1 3.220 . 4.640 3.677 3.294 3.993 . 0 0 "[ . 1 . 2]" 1
32 1 6 LEU H 1 6 LEU HB2 2.380 . 2.960 2.620 2.533 2.755 . 0 0 "[ . 1 . 2]" 1
33 1 6 LEU H 1 6 LEU MD1 2.700 . 3.600 3.337 2.881 3.599 . 0 0 "[ . 1 . 2]" 1
34 1 6 LEU H 1 6 LEU QD 2.375 . 2.950 2.883 2.509 2.999 0.049 4 0 "[ . 1 . 2]" 1
35 1 6 LEU H 1 6 LEU MD2 2.700 . 3.600 3.221 2.560 3.522 . 0 0 "[ . 1 . 2]" 1
36 1 6 LEU H 1 6 LEU HG 2.285 . 2.770 1.932 1.840 2.065 . 0 0 "[ . 1 . 2]" 1
37 1 6 LEU H 1 7 SER H 2.435 . 3.070 2.628 2.300 2.849 . 0 0 "[ . 1 . 2]" 1
38 1 6 LEU H 1 7 SER HA 3.565 . 5.330 5.139 4.825 5.387 0.057 11 0 "[ . 1 . 2]" 1
39 1 6 LEU H 1 8 VAL H 3.140 . 4.480 4.420 4.275 4.503 0.023 20 0 "[ . 1 . 2]" 1
40 1 6 LEU H 1 8 VAL MG2 3.310 . 4.820 4.552 4.338 4.758 . 0 0 "[ . 1 . 2]" 1
41 1 6 LEU H 1 9 HIS HD2 3.510 . 5.220 4.751 4.454 4.989 . 0 0 "[ . 1 . 2]" 1
42 1 6 LEU H 1 12 TYR QD 3.500 . 5.200 5.036 4.669 5.253 0.053 6 0 "[ . 1 . 2]" 1
43 1 6 LEU H 1 12 TYR QE 3.315 . 4.830 4.512 4.251 4.774 . 0 0 "[ . 1 . 2]" 1
44 1 6 LEU HA 1 6 LEU QD 2.335 . 2.870 2.181 1.940 2.415 . 0 0 "[ . 1 . 2]" 1
45 1 6 LEU HA 1 8 VAL H 2.830 . 3.860 3.321 3.226 3.465 . 0 0 "[ . 1 . 2]" 1
46 1 6 LEU HA 1 8 VAL MG1 3.290 . 4.780 4.216 4.017 4.480 . 0 0 "[ . 1 . 2]" 1
47 1 6 LEU HA 1 8 VAL MG2 2.860 . 3.920 2.712 2.467 3.073 . 0 0 "[ . 1 . 2]" 1
48 1 6 LEU HA 1 9 HIS H 2.900 . 4.000 3.703 3.556 3.851 . 0 0 "[ . 1 . 2]" 1
49 1 6 LEU HA 1 9 HIS HD2 2.270 . 2.740 2.337 1.977 2.673 . 0 0 "[ . 1 . 2]" 1
50 1 6 LEU HB2 1 7 SER H 2.685 . 3.570 3.133 2.885 3.291 . 0 0 "[ . 1 . 2]" 1
51 1 6 LEU HB2 1 8 VAL H 3.485 . 5.170 4.891 4.795 5.075 . 0 0 "[ . 1 . 2]" 1
52 1 6 LEU HB2 1 9 HIS HD2 2.660 . 3.520 3.549 3.511 3.604 0.084 7 0 "[ . 1 . 2]" 1
53 1 6 LEU HB2 1 12 TYR HB2 3.465 . 5.130 4.272 3.746 4.605 . 0 0 "[ . 1 . 2]" 1
54 1 6 LEU HB3 1 7 SER H 3.305 . 4.810 4.121 3.978 4.248 . 0 0 "[ . 1 . 2]" 1
55 1 6 LEU HB3 1 8 VAL H 3.620 . 5.440 4.896 4.710 5.127 . 0 0 "[ . 1 . 2]" 1
56 1 6 LEU HB3 1 9 HIS H 3.305 . 4.810 4.347 4.098 4.592 . 0 0 "[ . 1 . 2]" 1
57 1 6 LEU HB3 1 11 TRP HE3 3.650 . 5.500 5.120 4.784 5.436 . 0 0 "[ . 1 . 2]" 1
58 1 6 LEU HB3 1 11 TRP HZ3 3.015 . 4.230 3.252 2.823 3.642 . 0 0 "[ . 1 . 2]" 1
59 1 6 LEU HB3 1 12 TYR QD 2.710 . 3.620 3.002 2.795 3.364 . 0 0 "[ . 1 . 2]" 1
60 1 6 LEU HB3 1 79 THR H 3.650 . 5.500 5.142 4.465 5.537 0.037 6 0 "[ . 1 . 2]" 1
61 1 6 LEU QD 1 7 SER H 3.420 . 5.040 4.203 4.107 4.273 . 0 0 "[ . 1 . 2]" 1
62 1 6 LEU QD 1 8 VAL H 3.620 . 5.440 4.815 4.588 4.994 . 0 0 "[ . 1 . 2]" 1
63 1 6 LEU QD 1 9 HIS HD2 2.510 . 3.220 2.492 2.052 2.857 . 0 0 "[ . 1 . 2]" 1
64 1 6 LEU QD 1 11 TRP HE3 3.620 . 5.440 5.083 4.677 5.417 . 0 0 "[ . 1 . 2]" 1
65 1 6 LEU QD 1 11 TRP HZ3 3.225 . 4.650 3.304 2.806 3.690 . 0 0 "[ . 1 . 2]" 1
66 1 6 LEU QD 1 12 TYR QD 2.830 . 3.860 3.460 3.225 3.624 . 0 0 "[ . 1 . 2]" 1
67 1 6 LEU QD 1 12 TYR QE 2.395 . 2.990 2.263 2.108 2.406 . 0 0 "[ . 1 . 2]" 1
68 1 6 LEU QD 1 35 VAL QG 3.000 . 4.200 3.531 3.273 3.754 . 0 0 "[ . 1 . 2]" 1
69 1 6 LEU QD 1 78 LEU H 2.970 . 4.140 2.890 2.429 3.182 . 0 0 "[ . 1 . 2]" 1
70 1 6 LEU QD 1 78 LEU HB3 3.295 . 4.790 2.922 2.304 3.432 . 0 0 "[ . 1 . 2]" 1
71 1 6 LEU QD 1 78 LEU QD 2.505 . 3.210 2.448 2.305 2.524 . 0 0 "[ . 1 . 2]" 1
72 1 6 LEU QD 1 79 THR H 2.855 . 3.910 3.032 2.112 3.590 . 0 0 "[ . 1 . 2]" 1
73 1 6 LEU MD1 1 12 TYR QD 3.425 . 5.050 3.626 3.289 3.856 . 0 0 "[ . 1 . 2]" 1
74 1 6 LEU MD1 1 78 LEU H 3.325 . 4.850 3.503 2.908 4.156 . 0 0 "[ . 1 . 2]" 1
75 1 6 LEU MD1 1 78 LEU HB2 3.115 . 4.430 2.421 1.944 3.207 . 0 0 "[ . 1 . 2]" 1
76 1 6 LEU MD2 1 12 TYR QD 3.425 . 5.050 4.428 4.033 4.689 . 0 0 "[ . 1 . 2]" 1
77 1 6 LEU MD2 1 78 LEU H 3.325 . 4.850 3.151 2.520 3.675 . 0 0 "[ . 1 . 2]" 1
78 1 6 LEU MD2 1 78 LEU HB2 3.115 . 4.430 2.385 1.833 2.982 . 0 0 "[ . 1 . 2]" 1
79 1 6 LEU HG 1 9 HIS HD2 3.275 . 4.750 4.390 4.004 4.648 . 0 0 "[ . 1 . 2]" 1
80 1 6 LEU HG 1 12 TYR QE 3.195 . 4.590 4.489 4.271 4.632 0.042 10 0 "[ . 1 . 2]" 1
81 1 6 LEU HG 1 78 LEU QD 3.330 . 4.860 4.863 4.650 4.939 0.079 6 0 "[ . 1 . 2]" 1
82 1 7 SER H 1 7 SER QB 2.200 . 2.600 2.438 2.053 2.762 0.162 19 0 "[ . 1 . 2]" 1
83 1 7 SER H 1 8 VAL H 2.330 . 2.860 2.789 2.715 2.840 . 0 0 "[ . 1 . 2]" 1
84 1 7 SER H 1 8 VAL HA 3.550 . 5.300 5.331 5.275 5.355 0.055 14 0 "[ . 1 . 2]" 1
85 1 7 SER H 1 8 VAL MG1 2.915 . 4.030 3.969 3.766 4.073 0.043 18 0 "[ . 1 . 2]" 1
86 1 7 SER H 1 8 VAL MG2 3.115 . 4.430 4.085 3.883 4.281 . 0 0 "[ . 1 . 2]" 1
87 1 7 SER H 1 9 HIS H 3.100 . 4.400 4.312 4.198 4.453 0.053 20 0 "[ . 1 . 2]" 1
88 1 7 SER H 1 9 HIS HD2 3.440 . 5.080 4.861 4.645 5.100 0.020 14 0 "[ . 1 . 2]" 1
89 1 7 SER H 1 12 TYR QD 2.930 . 4.060 3.493 3.094 3.874 . 0 0 "[ . 1 . 2]" 1
90 1 7 SER H 1 12 TYR QE 3.125 . 4.450 3.918 3.655 4.261 . 0 0 "[ . 1 . 2]" 1
91 1 7 SER HA 1 7 SER QB 2.300 . 2.800 2.295 2.158 2.538 . 0 0 "[ . 1 . 2]" 1
92 1 7 SER HA 1 8 VAL H 2.675 . 3.550 3.429 3.395 3.457 . 0 0 "[ . 1 . 2]" 1
93 1 7 SER HA 1 9 HIS H 2.745 . 3.690 3.586 3.450 3.694 0.004 9 0 "[ . 1 . 2]" 1
94 1 7 SER HA 1 9 HIS HB2 3.280 . 4.760 4.786 4.517 4.837 0.077 11 0 "[ . 1 . 2]" 1
95 1 7 SER HA 1 12 TYR H 3.350 . 4.900 4.744 4.568 4.894 . 0 0 "[ . 1 . 2]" 1
96 1 7 SER HA 1 12 TYR QD 2.410 . 3.020 1.963 1.846 2.200 . 0 0 "[ . 1 . 2]" 1
97 1 7 SER QB 1 8 VAL H 2.960 . 4.120 3.278 2.967 3.638 . 0 0 "[ . 1 . 2]" 1
98 1 7 SER QB 1 8 VAL MG1 3.100 . 4.400 3.636 3.074 4.193 . 0 0 "[ . 1 . 2]" 1
99 1 7 SER QB 1 8 VAL MG2 3.555 . 5.310 4.711 4.367 5.084 . 0 0 "[ . 1 . 2]" 1
100 1 7 SER QB 1 9 HIS H 3.280 . 4.760 4.664 4.453 4.780 0.020 13 0 "[ . 1 . 2]" 1
101 1 7 SER QB 1 12 TYR QD 2.705 . 3.610 2.960 2.687 3.389 . 0 0 "[ . 1 . 2]" 1
102 1 7 SER QB 1 12 TYR QE 2.985 . 4.170 3.903 3.552 4.290 0.120 5 0 "[ . 1 . 2]" 1
103 1 8 VAL H 1 8 VAL HB 2.780 . 3.760 3.601 3.588 3.622 . 0 0 "[ . 1 . 2]" 1
104 1 8 VAL H 1 8 VAL MG1 2.125 . 2.450 2.103 1.958 2.256 . 0 0 "[ . 1 . 2]" 1
105 1 8 VAL H 1 8 VAL MG2 2.100 . 2.400 2.102 1.923 2.355 . 0 0 "[ . 1 . 2]" 1
106 1 8 VAL H 1 9 HIS H 2.235 . 2.670 2.576 2.511 2.656 . 0 0 "[ . 1 . 2]" 1
107 1 8 VAL H 1 9 HIS HA 3.515 . 5.230 5.173 5.087 5.231 0.001 2 0 "[ . 1 . 2]" 1
108 1 8 VAL H 1 9 HIS HB2 3.460 . 5.120 4.988 4.773 5.116 . 0 0 "[ . 1 . 2]" 1
109 1 8 VAL H 1 12 TYR HB2 3.560 . 5.320 4.827 4.642 4.998 . 0 0 "[ . 1 . 2]" 1
110 1 8 VAL H 1 12 TYR HB3 3.550 . 5.300 4.619 4.251 4.971 . 0 0 "[ . 1 . 2]" 1
111 1 8 VAL HA 1 8 VAL HB 2.210 . 2.620 2.446 2.405 2.491 . 0 0 "[ . 1 . 2]" 1
112 1 8 VAL HA 1 8 VAL MG1 2.260 . 2.720 2.404 2.263 2.502 . 0 0 "[ . 1 . 2]" 1
113 1 8 VAL HA 1 8 VAL MG2 2.550 . 3.300 3.195 3.189 3.207 . 0 0 "[ . 1 . 2]" 1
114 1 8 VAL HB 1 9 HIS H 3.045 . 4.290 4.124 4.000 4.284 . 0 0 "[ . 1 . 2]" 1
115 1 8 VAL MG1 1 9 HIS H 2.910 . 4.020 3.981 3.908 4.046 0.026 7 0 "[ . 1 . 2]" 1
116 1 8 VAL MG1 1 9 HIS HD2 3.650 . 5.500 5.481 5.190 5.549 0.049 20 0 "[ . 1 . 2]" 1
117 1 8 VAL MG2 1 9 HIS H 2.355 . 2.910 2.335 2.074 2.625 . 0 0 "[ . 1 . 2]" 1
118 1 8 VAL MG2 1 9 HIS HA 3.055 . 4.310 3.408 3.271 3.551 . 0 0 "[ . 1 . 2]" 1
119 1 8 VAL MG2 1 9 HIS HB3 3.245 . 4.690 4.426 4.352 4.561 . 0 0 "[ . 1 . 2]" 1
120 1 8 VAL MG2 1 9 HIS HD2 2.895 . 3.990 3.366 3.114 3.657 . 0 0 "[ . 1 . 2]" 1
121 1 8 VAL MG2 1 9 HIS HE1 3.145 . 4.490 2.895 2.567 3.441 . 0 0 "[ . 1 . 2]" 1
122 1 9 HIS H 1 9 HIS HB2 2.325 . 2.850 2.600 2.443 2.648 . 0 0 "[ . 1 . 2]" 1
123 1 9 HIS H 1 9 HIS HB3 2.735 . 3.670 3.640 3.614 3.677 0.007 7 0 "[ . 1 . 2]" 1
124 1 9 HIS H 1 9 HIS HD2 2.620 . 3.440 3.237 3.088 3.502 0.062 10 0 "[ . 1 . 2]" 1
125 1 9 HIS H 1 10 LEU H 3.650 . 5.500 4.489 4.447 4.569 . 0 0 "[ . 1 . 2]" 1
126 1 9 HIS H 1 10 LEU HA 3.640 . 5.480 5.481 5.402 5.506 0.026 20 0 "[ . 1 . 2]" 1
127 1 9 HIS H 1 11 TRP H 3.650 . 5.500 5.218 4.990 5.362 . 0 0 "[ . 1 . 2]" 1
128 1 9 HIS H 1 12 TYR H 3.390 . 4.980 4.309 4.152 4.581 . 0 0 "[ . 1 . 2]" 1
129 1 9 HIS H 1 12 TYR HB2 2.875 . 3.950 3.051 2.843 3.371 . 0 0 "[ . 1 . 2]" 1
130 1 9 HIS H 1 12 TYR HB3 2.935 . 4.070 3.527 3.185 3.875 . 0 0 "[ . 1 . 2]" 1
131 1 9 HIS HA 1 11 TRP H 3.315 . 4.830 3.853 3.625 4.106 . 0 0 "[ . 1 . 2]" 1
132 1 9 HIS HA 1 11 TRP HZ2 3.650 . 5.500 5.039 4.843 5.510 0.010 14 0 "[ . 1 . 2]" 1
133 1 9 HIS HA 1 12 TYR H 3.650 . 5.500 4.496 4.372 4.896 . 0 0 "[ . 1 . 2]" 1
134 1 9 HIS HB2 1 9 HIS HD2 2.680 . 3.560 2.753 2.725 2.770 . 0 0 "[ . 1 . 2]" 1
135 1 9 HIS HB2 1 11 TRP H 2.635 . 3.470 3.436 3.232 3.502 0.032 20 0 "[ . 1 . 2]" 1
136 1 9 HIS HB2 1 11 TRP HA 3.650 . 5.500 5.593 5.552 5.623 0.123 11 0 "[ . 1 . 2]" 1
137 1 9 HIS HB2 1 12 TYR H 2.665 . 3.530 3.026 2.933 3.089 . 0 0 "[ . 1 . 2]" 1
138 1 9 HIS HB3 1 11 TRP H 2.445 . 3.090 2.902 2.369 3.079 . 0 0 "[ . 1 . 2]" 1
139 1 9 HIS HB3 1 11 TRP HZ2 3.310 . 4.820 3.145 2.969 3.857 . 0 0 "[ . 1 . 2]" 1
140 1 9 HIS HB3 1 12 TYR H 3.035 . 4.270 3.827 3.423 3.979 . 0 0 "[ . 1 . 2]" 1
141 1 9 HIS HB3 1 12 TYR HB2 3.650 . 5.500 3.767 3.597 3.963 . 0 0 "[ . 1 . 2]" 1
142 1 9 HIS HD2 1 11 TRP HZ2 3.255 . 4.710 4.191 3.203 4.682 . 0 0 "[ . 1 . 2]" 1
143 1 9 HIS HD2 1 11 TRP HZ3 3.130 . 4.460 3.471 3.018 3.920 . 0 0 "[ . 1 . 2]" 1
144 1 9 HIS HD2 1 12 TYR H 3.650 . 5.500 5.535 5.513 5.569 0.069 7 0 "[ . 1 . 2]" 1
145 1 9 HIS HD2 1 12 TYR HB2 3.215 . 4.630 3.603 3.385 3.914 . 0 0 "[ . 1 . 2]" 1
146 1 10 LEU H 1 10 LEU MD1 3.165 . 4.530 3.934 3.818 4.230 . 0 0 "[ . 1 . 2]" 1
147 1 10 LEU H 1 10 LEU MD2 3.165 . 4.530 4.249 4.198 4.301 . 0 0 "[ . 1 . 2]" 1
148 1 10 LEU H 1 10 LEU HG 3.295 . 4.790 4.480 4.334 4.521 . 0 0 "[ . 1 . 2]" 1
149 1 10 LEU H 1 11 TRP H 3.160 . 4.520 2.868 2.264 2.932 . 0 0 "[ . 1 . 2]" 1
150 1 10 LEU H 1 12 TYR H 2.935 . 4.070 4.137 3.908 4.181 0.111 16 0 "[ . 1 . 2]" 1
151 1 10 LEU HA 1 10 LEU MD1 2.880 . 3.960 2.007 1.933 2.164 . 0 0 "[ . 1 . 2]" 1
152 1 10 LEU HA 1 10 LEU QD 2.170 . 2.540 2.000 1.927 2.152 . 0 0 "[ . 1 . 2]" 1
153 1 10 LEU HA 1 10 LEU MD2 2.880 . 3.960 3.801 3.762 3.857 . 0 0 "[ . 1 . 2]" 1
154 1 10 LEU HA 1 10 LEU HG 2.700 . 3.600 3.057 2.973 3.129 . 0 0 "[ . 1 . 2]" 1
155 1 10 LEU HA 1 11 TRP H 2.655 . 3.510 3.530 3.489 3.551 0.041 20 0 "[ . 1 . 2]" 1
156 1 10 LEU HA 1 12 TYR H 2.815 . 3.830 3.682 3.553 3.772 . 0 0 "[ . 1 . 2]" 1
157 1 10 LEU HA 1 104 PRO QB 3.445 . 5.090 4.261 4.064 4.508 . 0 0 "[ . 1 . 2]" 1
158 1 10 LEU HA 1 106 LYS HB2 2.985 . 4.170 3.557 3.267 3.823 . 0 0 "[ . 1 . 2]" 1
159 1 10 LEU HA 1 106 LYS QD 2.885 . 3.970 3.635 3.442 3.838 . 0 0 "[ . 1 . 2]" 1
160 1 10 LEU HA 1 106 LYS HG3 3.090 . 4.380 3.703 3.437 3.872 . 0 0 "[ . 1 . 2]" 1
161 1 10 LEU HB2 1 10 LEU MD1 2.485 . 3.170 2.336 2.301 2.373 . 0 0 "[ . 1 . 2]" 1
162 1 10 LEU HB2 1 10 LEU MD2 2.485 . 3.170 2.398 2.331 2.443 . 0 0 "[ . 1 . 2]" 1
163 1 10 LEU HB2 1 11 TRP H 3.110 . 4.420 4.078 3.998 4.215 . 0 0 "[ . 1 . 2]" 1
164 1 10 LEU HB2 1 12 TYR H 3.650 . 5.500 5.464 5.350 5.526 0.026 14 0 "[ . 1 . 2]" 1
165 1 10 LEU HB2 1 104 PRO QB 3.465 . 5.130 4.373 4.198 4.584 . 0 0 "[ . 1 . 2]" 1
166 1 10 LEU HB3 1 10 LEU MD1 2.835 . 3.870 3.209 3.204 3.214 . 0 0 "[ . 1 . 2]" 1
167 1 10 LEU HB3 1 10 LEU QD 2.405 . 3.010 2.258 2.228 2.319 . 0 0 "[ . 1 . 2]" 1
168 1 10 LEU HB3 1 10 LEU MD2 2.835 . 3.870 2.308 2.272 2.379 . 0 0 "[ . 1 . 2]" 1
169 1 10 LEU HB3 1 11 TRP H 2.665 . 3.530 2.934 2.814 3.119 . 0 0 "[ . 1 . 2]" 1
170 1 10 LEU HB3 1 11 TRP HA 3.195 . 4.590 4.423 4.356 4.555 . 0 0 "[ . 1 . 2]" 1
171 1 10 LEU HB3 1 12 TYR H 3.600 . 5.400 4.899 4.773 5.025 . 0 0 "[ . 1 . 2]" 1
172 1 10 LEU HB3 1 104 PRO QB 2.960 . 4.120 3.093 2.889 3.358 . 0 0 "[ . 1 . 2]" 1
173 1 10 LEU HB3 1 104 PRO HG2 3.400 . 5.000 3.724 3.320 4.155 . 0 0 "[ . 1 . 2]" 1
174 1 10 LEU HB3 1 104 PRO HG3 3.410 . 5.020 2.603 2.179 2.985 . 0 0 "[ . 1 . 2]" 1
175 1 10 LEU QD 1 11 TRP HD1 3.230 . 4.660 4.560 4.151 4.780 0.120 7 0 "[ . 1 . 2]" 1
176 1 10 LEU QD 1 12 TYR H 3.505 . 5.210 4.659 4.552 4.771 . 0 0 "[ . 1 . 2]" 1
177 1 10 LEU QD 1 104 PRO QB 2.500 . 3.200 2.909 2.832 3.012 . 0 0 "[ . 1 . 2]" 1
178 1 10 LEU QD 1 104 PRO HD2 3.235 . 4.670 3.468 3.250 3.694 . 0 0 "[ . 1 . 2]" 1
179 1 10 LEU QD 1 104 PRO HG2 2.895 . 3.990 2.059 1.928 2.226 . 0 0 "[ . 1 . 2]" 1
180 1 10 LEU QD 1 106 LYS H 2.815 . 3.830 3.797 3.640 3.862 0.032 5 0 "[ . 1 . 2]" 1
181 1 10 LEU QD 1 106 LYS HB2 2.535 . 3.270 2.242 1.999 2.391 . 0 0 "[ . 1 . 2]" 1
182 1 10 LEU QD 1 106 LYS HB3 2.420 . 3.040 1.835 1.784 2.017 0.016 17 0 "[ . 1 . 2]" 1
183 1 10 LEU QD 1 106 LYS QD 2.750 . 3.700 2.413 2.297 2.706 . 0 0 "[ . 1 . 2]" 1
184 1 10 LEU QD 1 106 LYS QE 2.770 . 3.740 3.716 3.388 3.827 0.087 13 0 "[ . 1 . 2]" 1
185 1 10 LEU QD 1 107 GLU H 2.570 . 3.340 3.202 3.002 3.296 . 0 0 "[ . 1 . 2]" 1
186 1 10 LEU QD 1 107 GLU HA 2.300 . 2.800 2.808 2.450 2.919 0.119 20 0 "[ . 1 . 2]" 1
187 1 10 LEU QD 1 107 GLU QB 2.710 . 3.620 3.032 2.686 3.364 . 0 0 "[ . 1 . 2]" 1
188 1 10 LEU QD 1 107 GLU QG 2.930 . 4.060 1.857 1.782 2.084 0.018 11 0 "[ . 1 . 2]" 1
189 1 10 LEU MD1 1 104 PRO QB 2.875 . 3.950 3.588 3.517 3.717 . 0 0 "[ . 1 . 2]" 1
190 1 10 LEU MD1 1 104 PRO HG2 3.325 . 4.850 3.785 3.633 4.024 . 0 0 "[ . 1 . 2]" 1
191 1 10 LEU MD1 1 104 PRO HG3 3.185 . 4.570 4.193 4.102 4.330 . 0 0 "[ . 1 . 2]" 1
192 1 10 LEU MD1 1 106 LYS H 3.220 . 4.640 4.044 3.906 4.137 . 0 0 "[ . 1 . 2]" 1
193 1 10 LEU MD1 1 107 GLU H 2.820 . 3.840 3.815 3.642 3.874 0.034 1 0 "[ . 1 . 2]" 1
194 1 10 LEU MD1 1 107 GLU HA 2.580 . 3.360 3.477 3.408 3.561 0.201 14 0 "[ . 1 . 2]" 1
195 1 10 LEU MD2 1 104 PRO QB 2.875 . 3.950 3.077 2.971 3.214 . 0 0 "[ . 1 . 2]" 1
196 1 10 LEU MD2 1 104 PRO HG2 3.325 . 4.850 2.069 1.935 2.241 . 0 0 "[ . 1 . 2]" 1
197 1 10 LEU MD2 1 104 PRO HG3 3.185 . 4.570 1.977 1.910 2.214 . 0 0 "[ . 1 . 2]" 1
198 1 10 LEU MD2 1 106 LYS H 3.220 . 4.640 4.606 4.320 4.670 0.030 18 0 "[ . 1 . 2]" 1
199 1 10 LEU MD2 1 107 GLU H 2.820 . 3.840 3.442 3.141 3.599 . 0 0 "[ . 1 . 2]" 1
200 1 10 LEU MD2 1 107 GLU HA 2.580 . 3.360 2.970 2.511 3.141 . 0 0 "[ . 1 . 2]" 1
201 1 10 LEU HG 1 11 TRP HA 3.355 . 4.910 3.828 3.577 4.075 . 0 0 "[ . 1 . 2]" 1
202 1 10 LEU HG 1 106 LYS H 3.075 . 4.350 3.564 3.268 3.734 . 0 0 "[ . 1 . 2]" 1
203 1 10 LEU HG 1 106 LYS HB2 2.655 . 3.510 2.174 2.005 2.322 . 0 0 "[ . 1 . 2]" 1
204 1 10 LEU HG 1 107 GLU H 2.945 . 4.090 3.537 3.264 3.792 . 0 0 "[ . 1 . 2]" 1
205 1 11 TRP H 1 11 TRP HB2 2.765 . 3.730 3.572 3.527 3.616 . 0 0 "[ . 1 . 2]" 1
206 1 11 TRP H 1 11 TRP HB3 2.545 . 3.290 3.147 3.075 3.221 . 0 0 "[ . 1 . 2]" 1
207 1 11 TRP H 1 11 TRP HD1 2.490 . 3.180 2.911 2.684 3.133 . 0 0 "[ . 1 . 2]" 1
208 1 11 TRP H 1 11 TRP HZ2 3.650 . 5.500 5.399 5.281 5.535 0.035 10 0 "[ . 1 . 2]" 1
209 1 11 TRP H 1 12 TYR H 2.255 . 2.710 2.538 2.428 2.621 . 0 0 "[ . 1 . 2]" 1
210 1 11 TRP H 1 12 TYR HA 3.400 . 5.000 4.970 4.859 5.027 0.027 20 0 "[ . 1 . 2]" 1
211 1 11 TRP H 1 12 TYR HB2 3.080 . 4.360 4.254 4.189 4.331 . 0 0 "[ . 1 . 2]" 1
212 1 11 TRP H 1 12 TYR QD 3.650 . 5.500 5.525 5.396 5.632 0.132 19 0 "[ . 1 . 2]" 1
213 1 11 TRP H 1 82 VAL QG 3.620 . 5.440 4.650 4.533 4.834 . 0 0 "[ . 1 . 2]" 1
214 1 11 TRP H 1 104 PRO QB 2.740 . 3.680 3.132 2.984 3.368 . 0 0 "[ . 1 . 2]" 1
215 1 11 TRP H 1 104 PRO HG3 3.395 . 4.990 4.342 4.086 4.687 . 0 0 "[ . 1 . 2]" 1
216 1 11 TRP H 1 105 PHE QE 3.650 . 5.500 5.240 4.961 5.491 . 0 0 "[ . 1 . 2]" 1
217 1 11 TRP H 1 106 LYS HG3 3.610 . 5.420 5.275 5.033 5.383 . 0 0 "[ . 1 . 2]" 1
218 1 11 TRP HA 1 11 TRP HD1 3.015 . 4.230 4.190 4.009 4.259 0.029 14 0 "[ . 1 . 2]" 1
219 1 11 TRP HA 1 12 TYR H 2.605 . 3.410 3.262 3.215 3.300 . 0 0 "[ . 1 . 2]" 1
220 1 11 TRP HA 1 34 LEU HA 3.070 . 4.340 3.169 3.089 3.341 . 0 0 "[ . 1 . 2]" 1
221 1 11 TRP HA 1 35 VAL QG 3.405 . 5.010 4.698 4.518 4.822 . 0 0 "[ . 1 . 2]" 1
222 1 11 TRP HA 1 104 PRO QB 2.880 . 3.960 2.223 2.002 2.440 . 0 0 "[ . 1 . 2]" 1
223 1 11 TRP HA 1 105 PHE HB3 3.500 . 5.200 4.977 4.794 5.116 . 0 0 "[ . 1 . 2]" 1
224 1 11 TRP HA 1 105 PHE QD 2.540 . 3.280 2.659 2.491 2.831 . 0 0 "[ . 1 . 2]" 1
225 1 11 TRP HA 1 106 LYS HG3 3.155 . 4.510 4.056 3.694 4.302 . 0 0 "[ . 1 . 2]" 1
226 1 11 TRP HA 1 107 GLU H 3.650 . 5.500 5.271 5.141 5.418 . 0 0 "[ . 1 . 2]" 1
227 1 11 TRP HB2 1 11 TRP HE3 2.860 . 3.920 2.737 2.623 2.792 . 0 0 "[ . 1 . 2]" 1
228 1 11 TRP HB2 1 11 TRP HZ3 3.475 . 5.150 5.127 5.034 5.168 0.018 19 0 "[ . 1 . 2]" 1
229 1 11 TRP HB2 1 12 TYR H 3.140 . 4.480 4.147 4.062 4.189 . 0 0 "[ . 1 . 2]" 1
230 1 11 TRP HB2 1 34 LEU HA 3.060 . 4.320 2.316 2.157 2.712 . 0 0 "[ . 1 . 2]" 1
231 1 11 TRP HB2 1 35 VAL H 3.335 . 4.870 3.508 3.195 3.945 . 0 0 "[ . 1 . 2]" 1
232 1 11 TRP HB2 1 35 VAL QG 2.915 . 4.030 2.793 2.631 2.972 . 0 0 "[ . 1 . 2]" 1
233 1 11 TRP HB2 1 104 PRO QB 3.025 . 4.250 3.494 3.340 3.633 . 0 0 "[ . 1 . 2]" 1
234 1 11 TRP HB3 1 11 TRP HD1 2.340 . 2.880 2.588 2.563 2.641 . 0 0 "[ . 1 . 2]" 1
235 1 11 TRP HB3 1 34 LEU HA 3.185 . 4.570 3.345 3.059 3.846 . 0 0 "[ . 1 . 2]" 1
236 1 11 TRP HB3 1 104 PRO HA 2.815 . 3.830 2.614 2.395 2.893 . 0 0 "[ . 1 . 2]" 1
237 1 11 TRP HB3 1 104 PRO QB 2.645 . 3.490 1.977 1.894 2.084 . 0 0 "[ . 1 . 2]" 1
238 1 11 TRP HB3 1 105 PHE H 3.235 . 4.670 4.010 3.774 4.292 . 0 0 "[ . 1 . 2]" 1
239 1 11 TRP HB3 1 105 PHE QD 3.385 . 4.970 4.355 4.032 4.690 . 0 0 "[ . 1 . 2]" 1
240 1 11 TRP HB3 1 106 LYS H 3.650 . 5.500 5.082 4.866 5.317 . 0 0 "[ . 1 . 2]" 1
241 1 11 TRP HD1 1 82 VAL QG 3.320 . 4.840 3.371 3.198 3.795 . 0 0 "[ . 1 . 2]" 1
242 1 11 TRP HD1 1 104 PRO QB 2.465 . 3.130 2.847 2.495 3.097 . 0 0 "[ . 1 . 2]" 1
243 1 11 TRP HD1 1 104 PRO HD3 3.115 . 4.430 3.981 3.457 4.304 . 0 0 "[ . 1 . 2]" 1
244 1 11 TRP HD1 1 104 PRO HG2 3.600 . 5.400 5.136 4.746 5.276 . 0 0 "[ . 1 . 2]" 1
245 1 11 TRP HD1 1 104 PRO HG3 2.795 . 3.790 3.567 3.212 3.740 . 0 0 "[ . 1 . 2]" 1
246 1 11 TRP HE3 1 12 TYR H 3.140 . 4.480 3.701 3.444 3.990 . 0 0 "[ . 1 . 2]" 1
247 1 11 TRP HE3 1 12 TYR HA 2.670 . 3.540 3.021 2.795 3.410 . 0 0 "[ . 1 . 2]" 1
248 1 11 TRP HE3 1 12 TYR HB2 3.085 . 4.370 3.565 3.230 3.881 . 0 0 "[ . 1 . 2]" 1
249 1 11 TRP HE3 1 12 TYR QD 2.790 . 3.780 2.673 2.536 2.962 . 0 0 "[ . 1 . 2]" 1
250 1 11 TRP HE3 1 35 VAL H 3.155 . 4.510 3.496 3.294 3.657 . 0 0 "[ . 1 . 2]" 1
251 1 11 TRP HE3 1 35 VAL HB 2.395 . 2.990 2.687 2.528 2.852 . 0 0 "[ . 1 . 2]" 1
252 1 11 TRP HE3 1 35 VAL MG1 2.910 . 4.020 3.991 3.851 4.067 0.047 17 0 "[ . 1 . 2]" 1
253 1 11 TRP HE3 1 35 VAL QG 2.435 . 3.070 2.067 1.945 2.206 . 0 0 "[ . 1 . 2]" 1
254 1 11 TRP HE3 1 35 VAL MG2 2.910 . 4.020 2.074 1.949 2.217 . 0 0 "[ . 1 . 2]" 1
255 1 11 TRP HE3 1 78 LEU QD 3.295 . 4.790 4.436 4.185 4.742 . 0 0 "[ . 1 . 2]" 1
256 1 11 TRP HE3 1 82 VAL MG1 3.465 . 5.130 3.800 3.452 4.099 . 0 0 "[ . 1 . 2]" 1
257 1 11 TRP HE3 1 82 VAL QG 2.845 . 3.890 3.211 3.003 3.383 . 0 0 "[ . 1 . 2]" 1
258 1 11 TRP HE3 1 82 VAL MG2 3.465 . 5.130 3.467 3.227 3.676 . 0 0 "[ . 1 . 2]" 1
259 1 11 TRP HZ2 1 79 THR H 3.215 . 4.630 4.048 3.902 4.314 . 0 0 "[ . 1 . 2]" 1
260 1 11 TRP HZ2 1 79 THR HA 2.340 . 2.880 2.021 1.891 2.325 . 0 0 "[ . 1 . 2]" 1
261 1 11 TRP HZ2 1 79 THR HB 3.060 . 4.320 4.320 4.175 4.459 0.139 10 0 "[ . 1 . 2]" 1
262 1 11 TRP HZ2 1 79 THR MG 2.305 . 2.810 2.193 1.991 2.441 . 0 0 "[ . 1 . 2]" 1
263 1 11 TRP HZ2 1 82 VAL QG 2.715 . 3.630 3.162 2.994 3.294 . 0 0 "[ . 1 . 2]" 1
264 1 11 TRP HZ2 1 83 GLU H 3.650 . 5.500 4.184 3.934 4.778 . 0 0 "[ . 1 . 2]" 1
265 1 11 TRP HZ2 1 83 GLU HG3 3.415 . 5.030 3.523 3.219 4.425 . 0 0 "[ . 1 . 2]" 1
266 1 11 TRP HZ3 1 12 TYR HB2 3.280 . 4.760 3.880 3.432 4.327 . 0 0 "[ . 1 . 2]" 1
267 1 11 TRP HZ3 1 35 VAL HB 2.870 . 3.940 3.141 2.837 3.488 . 0 0 "[ . 1 . 2]" 1
268 1 11 TRP HZ3 1 35 VAL MG1 2.695 . 3.590 3.526 3.277 3.640 0.050 9 0 "[ . 1 . 2]" 1
269 1 11 TRP HZ3 1 35 VAL QG 2.420 . 3.040 2.774 2.570 3.010 . 0 0 "[ . 1 . 2]" 1
270 1 11 TRP HZ3 1 35 VAL MG2 2.695 . 3.590 2.908 2.649 3.222 . 0 0 "[ . 1 . 2]" 1
271 1 11 TRP HZ3 1 78 LEU HB3 2.615 . 3.430 2.615 2.351 2.810 . 0 0 "[ . 1 . 2]" 1
272 1 11 TRP HZ3 1 78 LEU QD 2.770 . 3.740 3.279 3.006 3.548 . 0 0 "[ . 1 . 2]" 1
273 1 11 TRP HZ3 1 78 LEU HG 3.650 . 5.500 3.209 2.800 3.462 . 0 0 "[ . 1 . 2]" 1
274 1 11 TRP HZ3 1 79 THR H 3.465 . 5.130 4.831 4.654 5.051 . 0 0 "[ . 1 . 2]" 1
275 1 11 TRP HZ3 1 82 VAL QG 2.910 . 4.020 3.048 2.767 3.353 . 0 0 "[ . 1 . 2]" 1
276 1 12 TYR H 1 12 TYR HB2 2.340 . 2.880 2.415 2.321 2.516 . 0 0 "[ . 1 . 2]" 1
277 1 12 TYR H 1 12 TYR HB3 2.385 . 2.970 2.912 2.809 2.968 . 0 0 "[ . 1 . 2]" 1
278 1 12 TYR H 1 13 ALA H 3.095 . 4.390 4.375 4.265 4.460 0.070 12 0 "[ . 1 . 2]" 1
279 1 12 TYR H 1 13 ALA HA 3.610 . 5.420 5.179 4.998 5.300 . 0 0 "[ . 1 . 2]" 1
280 1 12 TYR H 1 13 ALA MB 3.605 . 5.410 5.327 5.252 5.409 . 0 0 "[ . 1 . 2]" 1
281 1 12 TYR H 1 14 GLY H 3.650 . 5.500 5.356 5.163 5.505 0.005 18 0 "[ . 1 . 2]" 1
282 1 12 TYR H 1 35 VAL H 3.605 . 5.410 4.584 4.461 4.716 . 0 0 "[ . 1 . 2]" 1
283 1 12 TYR H 1 35 VAL QG 3.525 . 5.250 4.791 4.590 4.984 . 0 0 "[ . 1 . 2]" 1
284 1 12 TYR H 1 104 PRO QB 3.340 . 4.880 4.528 4.289 4.763 . 0 0 "[ . 1 . 2]" 1
285 1 12 TYR H 1 106 LYS HB2 3.650 . 5.500 5.021 4.705 5.232 . 0 0 "[ . 1 . 2]" 1
286 1 12 TYR H 1 106 LYS QD 3.550 . 5.300 5.253 5.034 5.371 0.071 1 0 "[ . 1 . 2]" 1
287 1 12 TYR H 1 106 LYS HG3 3.245 . 4.690 4.214 3.933 4.345 . 0 0 "[ . 1 . 2]" 1
288 1 12 TYR HA 1 12 TYR QD 2.430 . 3.060 2.568 2.355 2.788 . 0 0 "[ . 1 . 2]" 1
289 1 12 TYR HA 1 12 TYR QE 3.295 . 4.790 4.242 4.178 4.306 . 0 0 "[ . 1 . 2]" 1
290 1 12 TYR HA 1 13 ALA H 2.270 . 2.740 2.134 2.105 2.167 . 0 0 "[ . 1 . 2]" 1
291 1 12 TYR HA 1 13 ALA MB 3.245 . 4.690 3.989 3.927 4.043 . 0 0 "[ . 1 . 2]" 1
292 1 12 TYR HA 1 35 VAL HB 3.105 . 4.410 2.694 2.230 2.929 . 0 0 "[ . 1 . 2]" 1
293 1 12 TYR HA 1 35 VAL QG 3.345 . 4.890 3.417 3.218 3.601 . 0 0 "[ . 1 . 2]" 1
294 1 12 TYR HA 1 105 PHE QE 3.180 . 4.560 4.086 3.885 4.162 . 0 0 "[ . 1 . 2]" 1
295 1 12 TYR HB2 1 14 GLY H 3.460 . 5.120 4.668 4.559 4.871 . 0 0 "[ . 1 . 2]" 1
296 1 12 TYR HB2 1 35 VAL QG 3.540 . 5.280 4.554 4.263 4.905 . 0 0 "[ . 1 . 2]" 1
297 1 12 TYR HB3 1 14 GLY H 3.335 . 4.870 3.638 3.390 3.901 . 0 0 "[ . 1 . 2]" 1
298 1 12 TYR QD 1 13 ALA H 2.935 . 4.070 3.846 3.458 4.000 . 0 0 "[ . 1 . 2]" 1
299 1 12 TYR QD 1 14 GLY H 2.560 . 3.320 2.557 1.849 2.932 . 0 0 "[ . 1 . 2]" 1
300 1 12 TYR QD 1 14 GLY HA3 3.095 . 4.390 3.074 2.793 3.248 . 0 0 "[ . 1 . 2]" 1
301 1 12 TYR QD 1 35 VAL HB 3.175 . 4.550 2.312 2.076 2.645 . 0 0 "[ . 1 . 2]" 1
302 1 12 TYR QD 1 35 VAL MG1 2.840 . 3.880 3.358 2.943 3.692 . 0 0 "[ . 1 . 2]" 1
303 1 12 TYR QD 1 35 VAL QG 2.550 . 3.300 3.001 2.680 3.353 0.053 7 0 "[ . 1 . 2]" 1
304 1 12 TYR QD 1 35 VAL MG2 2.840 . 3.880 3.390 3.084 3.846 . 0 0 "[ . 1 . 2]" 1
305 1 12 TYR QD 1 78 LEU QD 3.540 . 5.280 4.377 4.123 4.748 . 0 0 "[ . 1 . 2]" 1
306 1 12 TYR QE 1 13 ALA H 3.490 . 5.180 4.900 4.538 5.099 . 0 0 "[ . 1 . 2]" 1
307 1 12 TYR QE 1 14 GLY H 2.765 . 3.730 3.464 3.081 3.691 . 0 0 "[ . 1 . 2]" 1
308 1 12 TYR QE 1 14 GLY HA2 2.565 . 3.330 2.216 1.937 2.526 . 0 0 "[ . 1 . 2]" 1
309 1 12 TYR QE 1 14 GLY HA3 2.720 . 3.640 3.326 2.405 3.668 0.028 2 0 "[ . 1 . 2]" 1
310 1 12 TYR QE 1 15 PRO HD2 3.650 . 5.500 5.400 4.571 5.599 0.099 12 0 "[ . 1 . 2]" 1
311 1 12 TYR QE 1 35 VAL QG 2.510 . 3.220 2.374 1.940 3.092 . 0 0 "[ . 1 . 2]" 1
312 1 12 TYR QE 1 37 GLN H 3.220 . 4.640 3.823 2.620 4.445 . 0 0 "[ . 1 . 2]" 1
313 1 12 TYR QE 1 78 LEU MD1 3.295 . 4.790 4.107 3.712 4.838 0.048 7 0 "[ . 1 . 2]" 1
314 1 12 TYR QE 1 78 LEU QD 2.885 . 3.970 3.639 3.350 4.049 0.079 7 0 "[ . 1 . 2]" 1
315 1 12 TYR QE 1 78 LEU MD2 3.295 . 4.790 4.079 3.727 4.447 . 0 0 "[ . 1 . 2]" 1
316 1 13 ALA H 1 13 ALA MB 2.270 . 2.740 2.286 2.193 2.334 . 0 0 "[ . 1 . 2]" 1
317 1 13 ALA H 1 14 GLY H 2.430 . 3.060 2.318 2.199 2.420 . 0 0 "[ . 1 . 2]" 1
318 1 13 ALA H 1 14 GLY HA3 3.415 . 5.030 4.958 4.788 5.057 0.027 15 0 "[ . 1 . 2]" 1
319 1 13 ALA H 1 34 LEU HB3 3.625 . 5.450 5.263 5.096 5.411 . 0 0 "[ . 1 . 2]" 1
320 1 13 ALA H 1 34 LEU MD1 3.630 . 5.460 3.055 2.881 3.249 . 0 0 "[ . 1 . 2]" 1
321 1 13 ALA H 1 34 LEU QD 2.925 . 4.050 3.028 2.861 3.217 . 0 0 "[ . 1 . 2]" 1
322 1 13 ALA H 1 34 LEU MD2 3.630 . 5.460 4.997 4.822 5.229 . 0 0 "[ . 1 . 2]" 1
323 1 13 ALA H 1 35 VAL H 2.740 . 3.680 2.681 2.407 2.860 . 0 0 "[ . 1 . 2]" 1
324 1 13 ALA H 1 35 VAL HB 3.280 . 4.760 3.775 3.460 4.043 . 0 0 "[ . 1 . 2]" 1
325 1 13 ALA H 1 35 VAL QG 3.320 . 4.840 4.066 3.897 4.227 . 0 0 "[ . 1 . 2]" 1
326 1 13 ALA H 1 36 ARG HA 3.135 . 4.470 3.132 2.973 3.332 . 0 0 "[ . 1 . 2]" 1
327 1 13 ALA H 1 105 PHE QD 3.350 . 4.900 4.933 4.860 4.979 0.079 15 0 "[ . 1 . 2]" 1
328 1 13 ALA H 1 105 PHE QE 2.995 . 4.190 3.498 3.357 3.575 . 0 0 "[ . 1 . 2]" 1
329 1 13 ALA HA 1 14 GLY H 2.640 . 3.480 3.286 3.229 3.386 . 0 0 "[ . 1 . 2]" 1
330 1 13 ALA HA 1 105 PHE QE 2.620 . 3.440 2.885 2.692 3.120 . 0 0 "[ . 1 . 2]" 1
331 1 13 ALA HA 1 106 LYS QD 3.105 . 4.410 4.266 3.983 4.477 0.067 17 0 "[ . 1 . 2]" 1
332 1 13 ALA MB 1 14 GLY H 2.510 . 3.220 3.208 3.036 3.272 0.052 6 0 "[ . 1 . 2]" 1
333 1 13 ALA MB 1 16 MET HB2 2.730 . 3.660 2.062 1.895 2.292 . 0 0 "[ . 1 . 2]" 1
334 1 13 ALA MB 1 16 MET QB 2.490 . 3.180 1.763 1.729 1.887 0.071 12 0 "[ . 1 . 2]" 1
335 1 13 ALA MB 1 16 MET HB3 2.730 . 3.660 1.928 1.826 2.059 . 0 0 "[ . 1 . 2]" 1
336 1 13 ALA MB 1 17 GLU H 3.650 . 5.500 4.893 4.629 5.361 . 0 0 "[ . 1 . 2]" 1
337 1 13 ALA MB 1 24 ILE MD 3.015 . 4.230 3.655 3.471 3.825 . 0 0 "[ . 1 . 2]" 1
338 1 13 ALA MB 1 34 LEU MD1 2.620 . 3.440 2.079 1.912 2.338 . 0 0 "[ . 1 . 2]" 1
339 1 13 ALA MB 1 34 LEU QD 2.295 . 2.790 2.037 1.878 2.277 . 0 0 "[ . 1 . 2]" 1
340 1 13 ALA MB 1 34 LEU MD2 2.620 . 3.440 2.941 2.750 3.162 . 0 0 "[ . 1 . 2]" 1
341 1 13 ALA MB 1 36 ARG HA 2.665 . 3.530 3.079 2.740 3.484 . 0 0 "[ . 1 . 2]" 1
342 1 13 ALA MB 1 105 PHE QE 2.535 . 3.270 2.693 2.500 2.810 . 0 0 "[ . 1 . 2]" 1
343 1 14 GLY H 1 14 GLY HA2 2.335 . 2.870 2.310 2.293 2.351 . 0 0 "[ . 1 . 2]" 1
344 1 14 GLY H 1 14 GLY HA3 2.340 . 2.880 2.731 2.617 2.810 . 0 0 "[ . 1 . 2]" 1
345 1 14 GLY H 1 15 PRO HD2 3.015 . 4.230 4.141 3.736 4.337 0.107 2 0 "[ . 1 . 2]" 1
346 1 14 GLY H 1 34 LEU QD 3.620 . 5.440 4.654 4.517 4.864 . 0 0 "[ . 1 . 2]" 1
347 1 14 GLY H 1 35 VAL HB 3.650 . 5.500 4.793 4.499 5.101 . 0 0 "[ . 1 . 2]" 1
348 1 14 GLY H 1 36 ARG HB2 3.650 . 5.500 4.530 4.163 5.034 . 0 0 "[ . 1 . 2]" 1
349 1 14 GLY H 1 36 ARG QB 3.325 . 4.850 3.890 3.044 4.229 . 0 0 "[ . 1 . 2]" 1
350 1 14 GLY H 1 36 ARG HB3 3.650 . 5.500 4.307 3.121 4.868 . 0 0 "[ . 1 . 2]" 1
351 1 14 GLY H 1 37 GLN H 3.125 . 4.450 3.808 3.511 4.298 . 0 0 "[ . 1 . 2]" 1
352 1 14 GLY HA2 1 15 PRO QB 3.645 . 5.490 5.342 5.205 5.557 0.067 6 0 "[ . 1 . 2]" 1
353 1 14 GLY HA2 1 15 PRO HD3 2.720 . 3.640 3.583 3.440 3.722 0.082 19 0 "[ . 1 . 2]" 1
354 1 14 GLY HA3 1 15 PRO QB 3.455 . 5.110 4.582 4.498 4.721 . 0 0 "[ . 1 . 2]" 1
355 1 14 GLY HA3 1 15 PRO HD3 2.775 . 3.750 2.243 1.976 2.372 . 0 0 "[ . 1 . 2]" 1
356 1 14 GLY HA3 1 15 PRO HG3 3.190 . 4.580 4.351 4.181 4.395 . 0 0 "[ . 1 . 2]" 1
357 1 15 PRO HA 1 16 MET H 2.635 . 3.470 3.225 2.589 3.491 0.021 6 0 "[ . 1 . 2]" 1
358 1 15 PRO QB 1 16 MET H 3.205 . 4.610 3.695 2.929 4.036 . 0 0 "[ . 1 . 2]" 1
359 1 15 PRO HG2 1 16 MET H 3.315 . 4.830 3.641 3.014 4.837 0.007 18 0 "[ . 1 . 2]" 1
360 1 16 MET HA 1 16 MET HG2 2.780 . 3.760 3.545 3.387 3.632 . 0 0 "[ . 1 . 2]" 1
361 1 16 MET HA 1 16 MET HG3 2.780 . 3.760 2.703 2.155 3.276 . 0 0 "[ . 1 . 2]" 1
362 1 16 MET HA 1 17 GLU H 2.230 . 2.660 2.307 2.172 2.388 . 0 0 "[ . 1 . 2]" 1
363 1 16 MET HA 1 17 GLU HG2 3.160 . 4.520 3.747 3.219 4.295 . 0 0 "[ . 1 . 2]" 1
364 1 16 MET HA 1 17 GLU HG3 3.265 . 4.730 4.492 4.118 4.767 0.037 18 0 "[ . 1 . 2]" 1
365 1 16 MET HA 1 21 ALA H 3.650 . 5.500 5.434 5.037 5.606 0.106 11 0 "[ . 1 . 2]" 1
366 1 16 MET QB 1 17 GLU H 2.910 . 4.020 3.383 3.135 3.920 . 0 0 "[ . 1 . 2]" 1
367 1 16 MET QB 1 21 ALA MB 2.905 . 4.010 3.668 3.388 4.016 0.006 20 0 "[ . 1 . 2]" 1
368 1 16 MET QB 1 36 ARG HA 3.020 . 4.240 3.917 3.346 4.329 0.089 19 0 "[ . 1 . 2]" 1
369 1 16 MET QG 1 17 GLU H 2.630 . 3.460 2.130 1.776 3.102 0.024 1 0 "[ . 1 . 2]" 1
370 1 16 MET QG 1 20 GLY H 3.110 . 4.420 4.210 3.609 4.458 0.038 19 0 "[ . 1 . 2]" 1
371 1 16 MET QG 1 20 GLY HA2 3.545 . 5.290 4.402 3.755 4.872 . 0 0 "[ . 1 . 2]" 1
372 1 16 MET QG 1 20 GLY HA3 2.960 . 4.120 3.060 2.279 3.575 . 0 0 "[ . 1 . 2]" 1
373 1 16 MET QG 1 21 ALA MB 2.955 . 4.110 2.744 2.296 3.618 . 0 0 "[ . 1 . 2]" 1
374 1 16 MET HG2 1 20 GLY HA3 3.330 . 4.860 3.923 3.211 4.396 . 0 0 "[ . 1 . 2]" 1
375 1 16 MET HG2 1 21 ALA H 2.780 . 3.760 3.411 2.737 3.821 0.061 20 0 "[ . 1 . 2]" 1
376 1 16 MET HG3 1 20 GLY HA3 3.330 . 4.860 3.204 2.332 3.785 . 0 0 "[ . 1 . 2]" 1
377 1 16 MET HG3 1 21 ALA H 2.780 . 3.760 3.123 2.454 3.807 0.047 11 0 "[ . 1 . 2]" 1
378 1 17 GLU H 1 17 GLU HB2 2.745 . 3.690 3.650 3.567 3.710 0.020 14 0 "[ . 1 . 2]" 1
379 1 17 GLU H 1 17 GLU HG2 2.430 . 3.060 2.176 1.737 2.709 0.063 12 0 "[ . 1 . 2]" 1
380 1 17 GLU H 1 17 GLU HG3 2.455 . 3.110 2.348 1.953 3.005 . 0 0 "[ . 1 . 2]" 1
381 1 17 GLU H 1 18 ARG H 3.410 . 5.020 4.513 4.385 4.646 . 0 0 "[ . 1 . 2]" 1
382 1 17 GLU H 1 20 GLY H 3.155 . 4.510 3.781 3.475 3.995 . 0 0 "[ . 1 . 2]" 1
383 1 17 GLU H 1 20 GLY HA3 3.315 . 4.830 3.079 2.829 3.724 . 0 0 "[ . 1 . 2]" 1
384 1 17 GLU H 1 21 ALA H 3.165 . 4.530 3.653 3.440 4.527 . 0 0 "[ . 1 . 2]" 1
385 1 17 GLU HA 1 17 GLU HG2 2.970 . 4.140 3.758 3.503 4.011 . 0 0 "[ . 1 . 2]" 1
386 1 17 GLU HA 1 17 GLU HG3 2.790 . 3.780 3.660 3.509 3.845 0.065 20 0 "[ . 1 . 2]" 1
387 1 17 GLU HA 1 18 ARG H 2.655 . 3.510 2.426 2.264 2.698 . 0 0 "[ . 1 . 2]" 1
388 1 17 GLU HA 1 18 ARG HB3 3.525 . 5.250 4.987 4.586 5.278 0.028 19 0 "[ . 1 . 2]" 1
389 1 17 GLU HA 1 19 ALA H 3.460 . 5.120 4.915 4.512 5.181 0.061 3 0 "[ . 1 . 2]" 1
390 1 17 GLU HA 1 20 GLY H 3.340 . 4.880 4.589 4.365 4.792 . 0 0 "[ . 1 . 2]" 1
391 1 17 GLU HA 1 21 ALA H 3.500 . 5.200 4.654 4.494 4.821 . 0 0 "[ . 1 . 2]" 1
392 1 17 GLU HB2 1 18 ARG H 3.350 . 4.900 2.416 1.884 2.775 . 0 0 "[ . 1 . 2]" 1
393 1 17 GLU HB2 1 19 ALA H 2.655 . 3.510 3.333 2.874 3.604 0.094 10 0 "[ . 1 . 2]" 1
394 1 17 GLU HB2 1 19 ALA MB 3.135 . 4.470 3.793 3.200 4.273 . 0 0 "[ . 1 . 2]" 1
395 1 17 GLU HB2 1 20 GLY H 2.755 . 3.710 3.320 2.939 3.618 . 0 0 "[ . 1 . 2]" 1
396 1 17 GLU HB3 1 18 ARG H 2.985 . 4.170 3.633 3.385 3.857 . 0 0 "[ . 1 . 2]" 1
397 1 17 GLU HG2 1 19 ALA MB 3.250 . 4.700 4.620 4.272 4.792 0.092 18 0 "[ . 1 . 2]" 1
398 1 17 GLU HG2 1 20 GLY H 3.155 . 4.510 3.471 3.287 3.795 . 0 0 "[ . 1 . 2]" 1
399 1 17 GLU HG2 1 20 GLY HA2 3.650 . 5.500 4.579 4.222 5.252 . 0 0 "[ . 1 . 2]" 1
400 1 17 GLU HG2 1 20 GLY HA3 3.575 . 5.350 3.172 2.732 3.864 . 0 0 "[ . 1 . 2]" 1
401 1 17 GLU HG3 1 18 ARG H 3.235 . 4.670 4.044 3.667 4.351 . 0 0 "[ . 1 . 2]" 1
402 1 17 GLU HG3 1 19 ALA H 2.920 . 4.040 3.961 3.380 4.106 0.066 17 0 "[ . 1 . 2]" 1
403 1 17 GLU HG3 1 19 ALA MB 2.950 . 4.100 3.574 2.871 4.067 . 0 0 "[ . 1 . 2]" 1
404 1 17 GLU HG3 1 20 GLY H 2.635 . 3.470 1.913 1.733 2.416 0.067 6 0 "[ . 1 . 2]" 1
405 1 18 ARG H 1 19 ALA H 3.180 . 4.560 3.016 2.784 3.192 . 0 0 "[ . 1 . 2]" 1
406 1 18 ARG H 1 19 ALA MB 3.385 . 4.970 4.477 4.323 4.605 . 0 0 "[ . 1 . 2]" 1
407 1 18 ARG H 1 20 GLY H 3.650 . 5.500 3.988 3.692 4.248 . 0 0 "[ . 1 . 2]" 1
408 1 18 ARG H 1 21 ALA MB 3.630 . 5.460 4.334 3.932 4.560 . 0 0 "[ . 1 . 2]" 1
409 1 18 ARG HA 1 18 ARG QD 3.540 . 5.280 3.826 3.388 4.185 . 0 0 "[ . 1 . 2]" 1
410 1 18 ARG HA 1 18 ARG HG2 2.850 . 3.900 2.430 2.149 2.763 . 0 0 "[ . 1 . 2]" 1
411 1 18 ARG HA 1 18 ARG QG 2.610 . 3.420 2.357 2.125 2.678 . 0 0 "[ . 1 . 2]" 1
412 1 18 ARG HA 1 18 ARG HG3 2.850 . 3.900 3.247 2.806 3.599 . 0 0 "[ . 1 . 2]" 1
413 1 18 ARG HA 1 20 GLY H 3.175 . 4.550 4.313 3.966 4.500 . 0 0 "[ . 1 . 2]" 1
414 1 18 ARG HA 1 21 ALA H 2.785 . 3.770 3.365 3.015 3.546 . 0 0 "[ . 1 . 2]" 1
415 1 18 ARG HA 1 21 ALA MB 2.560 . 3.320 2.340 1.766 2.570 0.034 20 0 "[ . 1 . 2]" 1
416 1 18 ARG HA 1 22 GLU H 3.405 . 5.010 4.101 3.461 4.565 . 0 0 "[ . 1 . 2]" 1
417 1 18 ARG HA 1 22 GLU HG2 3.650 . 5.500 4.246 3.771 4.753 . 0 0 "[ . 1 . 2]" 1
418 1 18 ARG HA 1 57 HIS HE1 3.105 . 4.410 3.209 2.617 3.700 . 0 0 "[ . 1 . 2]" 1
419 1 18 ARG HB2 1 19 ALA H 2.885 . 3.970 3.571 3.272 3.803 . 0 0 "[ . 1 . 2]" 1
420 1 18 ARG HB2 1 57 HIS HE1 3.650 . 5.500 4.997 3.705 5.531 0.031 19 0 "[ . 1 . 2]" 1
421 1 18 ARG HB3 1 19 ALA H 2.460 . 3.120 2.113 1.847 2.434 . 0 0 "[ . 1 . 2]" 1
422 1 18 ARG HB3 1 20 GLY H 3.320 . 4.840 4.573 4.384 4.749 . 0 0 "[ . 1 . 2]" 1
423 1 18 ARG QD 1 19 ALA H 2.960 . 4.120 2.790 1.801 4.048 . 0 0 "[ . 1 . 2]" 1
424 1 18 ARG QD 1 19 ALA HA 3.255 . 4.710 3.244 2.113 4.760 0.050 13 0 "[ . 1 . 2]" 1
425 1 18 ARG QG 1 19 ALA H 2.790 . 3.780 3.524 3.135 3.824 0.044 11 0 "[ . 1 . 2]" 1
426 1 18 ARG QG 1 57 HIS HD2 2.855 . 3.910 3.180 2.786 3.780 . 0 0 "[ . 1 . 2]" 1
427 1 18 ARG QG 1 57 HIS HE1 3.015 . 4.230 2.819 2.395 3.156 . 0 0 "[ . 1 . 2]" 1
428 1 18 ARG HG2 1 57 HIS HD2 3.145 . 4.490 3.647 3.172 4.195 . 0 0 "[ . 1 . 2]" 1
429 1 18 ARG HG3 1 57 HIS HD2 3.145 . 4.490 3.577 2.917 4.295 . 0 0 "[ . 1 . 2]" 1
430 1 19 ALA H 1 19 ALA MB 2.100 . 2.400 2.108 1.997 2.232 . 0 0 "[ . 1 . 2]" 1
431 1 19 ALA H 1 20 GLY H 2.410 . 3.020 2.767 2.671 2.844 . 0 0 "[ . 1 . 2]" 1
432 1 19 ALA H 1 20 GLY HA2 3.585 . 5.370 5.388 5.316 5.439 0.069 13 0 "[ . 1 . 2]" 1
433 1 19 ALA H 1 20 GLY HA3 3.430 . 5.060 5.061 4.966 5.104 0.044 9 0 "[ . 1 . 2]" 1
434 1 19 ALA H 1 21 ALA H 3.160 . 4.520 4.251 4.043 4.435 . 0 0 "[ . 1 . 2]" 1
435 1 19 ALA H 1 22 GLU H 3.560 . 5.320 4.732 4.422 5.024 . 0 0 "[ . 1 . 2]" 1
436 1 19 ALA H 1 22 GLU HG3 3.235 . 4.670 3.889 3.386 4.217 . 0 0 "[ . 1 . 2]" 1
437 1 19 ALA H 1 57 HIS HE1 3.650 . 5.500 5.529 5.307 5.597 0.097 6 0 "[ . 1 . 2]" 1
438 1 19 ALA HA 1 22 GLU H 2.820 . 3.840 3.549 3.284 3.850 0.010 12 0 "[ . 1 . 2]" 1
439 1 19 ALA HA 1 22 GLU QB 2.815 . 3.830 3.186 2.496 3.743 . 0 0 "[ . 1 . 2]" 1
440 1 19 ALA HA 1 22 GLU HG2 3.225 . 4.650 3.800 3.480 4.252 . 0 0 "[ . 1 . 2]" 1
441 1 19 ALA HA 1 22 GLU HG3 2.430 . 3.060 2.115 1.822 2.501 . 0 0 "[ . 1 . 2]" 1
442 1 19 ALA HA 1 23 SER H 3.650 . 5.500 4.448 3.673 5.046 . 0 0 "[ . 1 . 2]" 1
443 1 19 ALA HA 1 57 HIS HE1 3.570 . 5.340 5.111 4.591 5.420 0.080 20 0 "[ . 1 . 2]" 1
444 1 19 ALA MB 1 20 GLY H 2.440 . 3.080 2.571 2.410 2.787 . 0 0 "[ . 1 . 2]" 1
445 1 19 ALA MB 1 20 GLY HA2 3.020 . 4.240 3.776 3.653 3.937 . 0 0 "[ . 1 . 2]" 1
446 1 19 ALA MB 1 20 GLY HA3 3.170 . 4.540 4.152 4.048 4.244 . 0 0 "[ . 1 . 2]" 1
447 1 19 ALA MB 1 22 GLU QB 3.350 . 4.900 4.267 3.844 4.824 . 0 0 "[ . 1 . 2]" 1
448 1 20 GLY H 1 20 GLY HA3 2.265 . 2.730 2.313 2.297 2.333 . 0 0 "[ . 1 . 2]" 1
449 1 20 GLY H 1 21 ALA H 2.330 . 2.860 2.596 2.290 2.690 . 0 0 "[ . 1 . 2]" 1
450 1 20 GLY H 1 21 ALA HA 3.510 . 5.220 5.218 4.961 5.297 0.077 4 0 "[ . 1 . 2]" 1
451 1 20 GLY H 1 22 GLU H 3.005 . 4.210 3.979 3.818 4.163 . 0 0 "[ . 1 . 2]" 1
452 1 20 GLY H 1 22 GLU HG2 3.650 . 5.500 5.569 5.517 5.618 0.118 14 0 "[ . 1 . 2]" 1
453 1 20 GLY H 1 22 GLU HG3 3.290 . 4.780 4.309 4.110 4.498 . 0 0 "[ . 1 . 2]" 1
454 1 20 GLY H 1 23 SER H 3.480 . 5.160 4.665 4.299 4.938 . 0 0 "[ . 1 . 2]" 1
455 1 20 GLY HA2 1 21 ALA H 2.680 . 3.560 3.554 3.527 3.571 0.011 11 0 "[ . 1 . 2]" 1
456 1 20 GLY HA2 1 22 GLU HG3 3.645 . 5.490 5.252 4.827 5.610 0.120 2 0 "[ . 1 . 2]" 1
457 1 20 GLY HA2 1 23 SER H 3.325 . 4.850 3.272 3.066 3.461 . 0 0 "[ . 1 . 2]" 1
458 1 20 GLY HA2 1 23 SER QB 2.875 . 3.950 2.635 2.153 2.947 . 0 0 "[ . 1 . 2]" 1
459 1 20 GLY HA2 1 24 ILE H 3.650 . 5.500 4.729 4.359 5.192 . 0 0 "[ . 1 . 2]" 1
460 1 20 GLY HA3 1 21 ALA H 2.540 . 3.280 2.718 2.656 2.834 . 0 0 "[ . 1 . 2]" 1
461 1 20 GLY HA3 1 21 ALA HA 3.275 . 4.750 4.357 4.328 4.380 . 0 0 "[ . 1 . 2]" 1
462 1 20 GLY HA3 1 21 ALA MB 3.565 . 5.330 4.409 4.345 4.493 . 0 0 "[ . 1 . 2]" 1
463 1 20 GLY HA3 1 23 SER QB 3.400 . 5.000 4.121 3.601 4.424 . 0 0 "[ . 1 . 2]" 1
464 1 21 ALA H 1 21 ALA MB 2.185 . 2.570 2.180 2.068 2.224 . 0 0 "[ . 1 . 2]" 1
465 1 21 ALA H 1 22 GLU H 2.385 . 2.970 2.761 2.664 2.856 . 0 0 "[ . 1 . 2]" 1
466 1 21 ALA H 1 22 GLU HG3 3.025 . 4.250 4.142 3.895 4.307 0.057 1 0 "[ . 1 . 2]" 1
467 1 21 ALA H 1 23 SER H 3.050 . 4.300 4.116 3.983 4.318 0.018 15 0 "[ . 1 . 2]" 1
468 1 21 ALA H 1 24 ILE MD 3.130 . 4.460 3.950 3.662 4.262 . 0 0 "[ . 1 . 2]" 1
469 1 21 ALA H 1 34 LEU MD1 3.350 . 4.900 4.442 4.046 4.661 . 0 0 "[ . 1 . 2]" 1
470 1 21 ALA H 1 34 LEU MD2 3.350 . 4.900 4.403 4.115 4.639 . 0 0 "[ . 1 . 2]" 1
471 1 21 ALA H 1 55 VAL QG 3.620 . 5.440 5.373 5.200 5.498 0.058 1 0 "[ . 1 . 2]" 1
472 1 21 ALA H 1 57 HIS HE1 3.040 . 4.280 4.323 4.155 4.419 0.139 11 0 "[ . 1 . 2]" 1
473 1 21 ALA HA 1 22 GLU H 2.655 . 3.510 3.537 3.509 3.567 0.057 20 0 "[ . 1 . 2]" 1
474 1 21 ALA HA 1 23 SER H 3.650 . 5.500 4.283 4.090 4.418 . 0 0 "[ . 1 . 2]" 1
475 1 21 ALA HA 1 24 ILE HB 3.145 . 4.490 3.962 3.721 4.263 . 0 0 "[ . 1 . 2]" 1
476 1 21 ALA HA 1 24 ILE MD 2.535 . 3.270 2.195 1.992 2.436 . 0 0 "[ . 1 . 2]" 1
477 1 21 ALA HA 1 34 LEU MD1 2.885 . 3.970 3.150 2.701 3.392 . 0 0 "[ . 1 . 2]" 1
478 1 21 ALA HA 1 34 LEU QD 2.455 . 3.110 2.259 1.982 2.453 . 0 0 "[ . 1 . 2]" 1
479 1 21 ALA HA 1 34 LEU MD2 2.885 . 3.970 2.321 2.020 2.549 . 0 0 "[ . 1 . 2]" 1
480 1 21 ALA MB 1 22 GLU H 2.375 . 2.950 2.567 2.421 2.829 . 0 0 "[ . 1 . 2]" 1
481 1 21 ALA MB 1 22 GLU HA 3.145 . 4.490 3.819 3.771 3.871 . 0 0 "[ . 1 . 2]" 1
482 1 21 ALA MB 1 22 GLU QB 3.555 . 5.310 4.471 4.392 4.580 . 0 0 "[ . 1 . 2]" 1
483 1 21 ALA MB 1 22 GLU HG2 3.045 . 4.290 3.251 3.128 3.438 . 0 0 "[ . 1 . 2]" 1
484 1 21 ALA MB 1 22 GLU HG3 3.150 . 4.500 3.708 3.532 3.928 . 0 0 "[ . 1 . 2]" 1
485 1 21 ALA MB 1 24 ILE MD 2.885 . 3.970 3.568 3.425 3.698 . 0 0 "[ . 1 . 2]" 1
486 1 21 ALA MB 1 34 LEU MD1 2.495 . 3.190 2.025 1.919 2.107 . 0 0 "[ . 1 . 2]" 1
487 1 21 ALA MB 1 34 LEU QD 2.270 . 2.740 1.773 1.688 1.880 0.112 20 0 "[ . 1 . 2]" 1
488 1 21 ALA MB 1 34 LEU MD2 2.495 . 3.190 1.965 1.858 2.122 . 0 0 "[ . 1 . 2]" 1
489 1 21 ALA MB 1 55 VAL MG1 3.100 . 4.400 3.308 3.154 3.455 . 0 0 "[ . 1 . 2]" 1
490 1 21 ALA MB 1 55 VAL QG 2.695 . 3.590 3.215 3.088 3.353 . 0 0 "[ . 1 . 2]" 1
491 1 21 ALA MB 1 55 VAL MG2 3.100 . 4.400 4.386 4.199 4.532 0.132 7 0 "[ . 1 . 2]" 1
492 1 21 ALA MB 1 57 HIS HE1 2.445 . 3.090 2.178 2.015 2.346 . 0 0 "[ . 1 . 2]" 1
493 1 22 GLU H 1 22 GLU QB 2.430 . 3.060 2.728 2.661 2.798 . 0 0 "[ . 1 . 2]" 1
494 1 22 GLU H 1 22 GLU HG2 2.385 . 2.970 2.279 2.121 2.464 . 0 0 "[ . 1 . 2]" 1
495 1 22 GLU H 1 22 GLU HG3 2.480 . 3.160 2.095 1.890 2.271 . 0 0 "[ . 1 . 2]" 1
496 1 22 GLU H 1 23 SER H 2.325 . 2.850 2.601 2.545 2.676 . 0 0 "[ . 1 . 2]" 1
497 1 22 GLU H 1 23 SER HA 3.470 . 5.140 5.195 5.153 5.244 0.104 12 0 "[ . 1 . 2]" 1
498 1 22 GLU H 1 23 SER QB 3.175 . 4.550 4.489 4.247 4.594 0.044 15 0 "[ . 1 . 2]" 1
499 1 22 GLU H 1 24 ILE MD 3.215 . 4.630 4.345 4.192 4.592 . 0 0 "[ . 1 . 2]" 1
500 1 22 GLU H 1 25 LEU H 3.480 . 5.160 4.805 4.659 4.982 . 0 0 "[ . 1 . 2]" 1
501 1 22 GLU H 1 25 LEU QD 3.620 . 5.440 4.099 3.761 4.456 . 0 0 "[ . 1 . 2]" 1
502 1 22 GLU H 1 26 ALA MB 3.650 . 5.500 5.415 5.011 5.577 0.077 6 0 "[ . 1 . 2]" 1
503 1 22 GLU H 1 34 LEU QD 3.620 . 5.440 4.265 4.077 4.399 . 0 0 "[ . 1 . 2]" 1
504 1 22 GLU H 1 55 VAL MG1 3.420 . 5.040 4.066 3.789 4.259 . 0 0 "[ . 1 . 2]" 1
505 1 22 GLU H 1 55 VAL QG 3.080 . 4.360 3.697 3.531 3.809 . 0 0 "[ . 1 . 2]" 1
506 1 22 GLU H 1 55 VAL MG2 3.420 . 5.040 4.252 4.106 4.336 . 0 0 "[ . 1 . 2]" 1
507 1 22 GLU H 1 57 HIS HE1 2.850 . 3.900 3.022 2.811 3.279 . 0 0 "[ . 1 . 2]" 1
508 1 22 GLU HA 1 22 GLU QB 2.305 . 2.810 2.261 2.239 2.283 . 0 0 "[ . 1 . 2]" 1
509 1 22 GLU HA 1 22 GLU HG2 2.755 . 3.710 2.643 2.569 2.707 . 0 0 "[ . 1 . 2]" 1
510 1 22 GLU HA 1 22 GLU HG3 2.875 . 3.950 3.627 3.528 3.707 . 0 0 "[ . 1 . 2]" 1
511 1 22 GLU HA 1 25 LEU H 2.710 . 3.620 3.476 3.151 3.665 0.045 9 0 "[ . 1 . 2]" 1
512 1 22 GLU HA 1 25 LEU HB2 2.900 . 4.000 2.139 1.960 2.276 . 0 0 "[ . 1 . 2]" 1
513 1 22 GLU HA 1 25 LEU HB3 3.325 . 4.850 3.696 3.552 3.929 . 0 0 "[ . 1 . 2]" 1
514 1 22 GLU HA 1 25 LEU QD 3.075 . 4.350 3.031 2.693 3.348 . 0 0 "[ . 1 . 2]" 1
515 1 22 GLU HA 1 26 ALA H 2.495 . 3.190 2.952 2.490 3.216 0.026 15 0 "[ . 1 . 2]" 1
516 1 22 GLU HA 1 26 ALA MB 3.075 . 4.350 3.660 3.202 3.974 . 0 0 "[ . 1 . 2]" 1
517 1 22 GLU HA 1 55 VAL H 3.650 . 5.500 5.500 5.286 5.596 0.096 4 0 "[ . 1 . 2]" 1
518 1 22 GLU HA 1 55 VAL HB 2.850 . 3.900 3.488 3.304 3.788 . 0 0 "[ . 1 . 2]" 1
519 1 22 GLU HA 1 55 VAL MG1 2.710 . 3.620 2.799 2.449 3.116 . 0 0 "[ . 1 . 2]" 1
520 1 22 GLU HA 1 55 VAL QG 2.310 . 2.820 1.859 1.761 1.998 0.039 6 0 "[ . 1 . 2]" 1
521 1 22 GLU HA 1 55 VAL MG2 2.710 . 3.620 1.890 1.779 2.039 0.021 6 0 "[ . 1 . 2]" 1
522 1 22 GLU HA 1 57 HIS HE1 3.440 . 5.080 3.649 3.398 4.218 . 0 0 "[ . 1 . 2]" 1
523 1 22 GLU QB 1 23 SER H 2.440 . 3.080 2.666 2.479 2.797 . 0 0 "[ . 1 . 2]" 1
524 1 22 GLU QB 1 23 SER QB 3.045 . 4.290 4.136 4.069 4.434 0.144 2 0 "[ . 1 . 2]" 1
525 1 22 GLU QB 1 25 LEU H 3.465 . 5.130 4.970 4.755 5.131 0.001 1 0 "[ . 1 . 2]" 1
526 1 22 GLU QB 1 26 ALA H 3.395 . 4.990 3.767 3.320 4.010 . 0 0 "[ . 1 . 2]" 1
527 1 22 GLU QB 1 26 ALA MB 2.870 . 3.940 3.052 2.458 3.407 . 0 0 "[ . 1 . 2]" 1
528 1 22 GLU QB 1 55 VAL H 3.135 . 4.470 4.483 4.364 4.554 0.084 2 0 "[ . 1 . 2]" 1
529 1 22 GLU QB 1 55 VAL MG1 3.120 . 4.440 3.710 3.562 3.859 . 0 0 "[ . 1 . 2]" 1
530 1 22 GLU QB 1 55 VAL QG 2.580 . 3.360 2.364 2.069 2.690 . 0 0 "[ . 1 . 2]" 1
531 1 22 GLU QB 1 55 VAL MG2 3.120 . 4.440 2.395 2.080 2.753 . 0 0 "[ . 1 . 2]" 1
532 1 22 GLU HG2 1 23 SER H 3.155 . 4.510 4.363 4.225 4.453 . 0 0 "[ . 1 . 2]" 1
533 1 22 GLU HG2 1 55 VAL HB 3.250 . 4.700 3.079 2.696 3.466 . 0 0 "[ . 1 . 2]" 1
534 1 22 GLU HG2 1 55 VAL MG1 3.030 . 4.260 2.787 2.523 2.981 . 0 0 "[ . 1 . 2]" 1
535 1 22 GLU HG2 1 55 VAL MG2 3.030 . 4.260 3.299 2.941 3.485 . 0 0 "[ . 1 . 2]" 1
536 1 22 GLU HG2 1 57 HIS HE1 2.430 . 3.060 2.028 1.838 2.390 . 0 0 "[ . 1 . 2]" 1
537 1 22 GLU HG3 1 55 VAL MG1 3.195 . 4.590 4.311 4.056 4.508 . 0 0 "[ . 1 . 2]" 1
538 1 22 GLU HG3 1 55 VAL QG 2.875 . 3.950 3.883 3.678 4.001 0.051 8 0 "[ . 1 . 2]" 1
539 1 22 GLU HG3 1 55 VAL MG2 3.195 . 4.590 4.416 4.155 4.622 0.032 8 0 "[ . 1 . 2]" 1
540 1 22 GLU HG3 1 57 HIS HD2 3.510 . 5.220 5.374 5.310 5.427 0.207 10 0 "[ . 1 . 2]" 1
541 1 22 GLU HG3 1 57 HIS HE1 2.885 . 3.970 3.304 3.040 3.517 . 0 0 "[ . 1 . 2]" 1
542 1 23 SER H 1 23 SER HA 2.360 . 2.920 2.758 2.722 2.800 . 0 0 "[ . 1 . 2]" 1
543 1 23 SER H 1 23 SER QB 2.100 . 2.400 2.281 2.084 2.446 0.046 2 0 "[ . 1 . 2]" 1
544 1 23 SER H 1 24 ILE H 2.315 . 2.830 2.913 2.820 2.973 0.143 14 0 "[ . 1 . 2]" 1
545 1 23 SER H 1 24 ILE MD 2.750 . 3.700 3.745 3.698 3.826 0.126 2 0 "[ . 1 . 2]" 1
546 1 23 SER H 1 24 ILE HG13 3.295 . 4.790 4.771 4.589 4.838 0.048 19 0 "[ . 1 . 2]" 1
547 1 23 SER H 1 25 LEU H 3.240 . 4.680 4.266 4.026 4.505 . 0 0 "[ . 1 . 2]" 1
548 1 23 SER H 1 26 ALA MB 3.285 . 4.770 4.356 4.207 4.560 . 0 0 "[ . 1 . 2]" 1
549 1 23 SER HA 1 24 ILE H 2.665 . 3.530 3.544 3.504 3.572 0.042 8 0 "[ . 1 . 2]" 1
550 1 23 SER HA 1 26 ALA MB 2.745 . 3.690 3.050 2.712 3.643 . 0 0 "[ . 1 . 2]" 1
551 1 23 SER QB 1 24 ILE H 2.500 . 3.200 2.941 2.327 3.251 0.051 17 0 "[ . 1 . 2]" 1
552 1 23 SER QB 1 24 ILE HG13 2.835 . 3.870 3.410 2.647 3.871 0.001 8 0 "[ . 1 . 2]" 1
553 1 24 ILE H 1 24 ILE HB 2.315 . 2.830 2.720 2.647 2.794 . 0 0 "[ . 1 . 2]" 1
554 1 24 ILE H 1 24 ILE MD 2.350 . 2.900 2.109 1.999 2.404 . 0 0 "[ . 1 . 2]" 1
555 1 24 ILE H 1 24 ILE HG12 2.935 . 4.070 3.632 3.494 3.871 . 0 0 "[ . 1 . 2]" 1
556 1 24 ILE H 1 24 ILE HG13 2.355 . 2.910 2.252 2.003 2.554 . 0 0 "[ . 1 . 2]" 1
557 1 24 ILE H 1 24 ILE MG 2.860 . 3.920 3.765 3.731 3.819 . 0 0 "[ . 1 . 2]" 1
558 1 24 ILE H 1 25 LEU H 2.180 . 2.560 2.552 2.301 2.680 0.120 9 0 "[ . 1 . 2]" 1
559 1 24 ILE H 1 34 LEU QD 3.090 . 4.380 4.335 4.026 4.427 0.047 8 0 "[ . 1 . 2]" 1
560 1 24 ILE HA 1 24 ILE HG12 2.645 . 3.490 3.400 3.346 3.453 . 0 0 "[ . 1 . 2]" 1
561 1 24 ILE HA 1 24 ILE HG13 2.540 . 3.280 2.600 2.549 2.643 . 0 0 "[ . 1 . 2]" 1
562 1 24 ILE HA 1 24 ILE MG 2.300 . 2.800 2.209 2.103 2.288 . 0 0 "[ . 1 . 2]" 1
563 1 24 ILE HA 1 26 ALA H 3.335 . 4.870 4.705 4.483 4.903 0.033 16 0 "[ . 1 . 2]" 1
564 1 24 ILE HB 1 24 ILE MD 2.455 . 3.110 2.044 1.911 2.124 . 0 0 "[ . 1 . 2]" 1
565 1 24 ILE HB 1 25 LEU QD 3.085 . 4.370 3.611 3.411 3.766 . 0 0 "[ . 1 . 2]" 1
566 1 24 ILE HB 1 34 LEU QD 2.820 . 3.840 3.180 3.054 3.312 . 0 0 "[ . 1 . 2]" 1
567 1 24 ILE MD 1 25 LEU H 2.945 . 4.090 3.098 2.961 3.283 . 0 0 "[ . 1 . 2]" 1
568 1 24 ILE MD 1 32 THR MG 3.650 . 5.500 5.579 5.546 5.625 0.125 17 0 "[ . 1 . 2]" 1
569 1 24 ILE MD 1 34 LEU QD 2.385 . 2.970 2.655 2.525 2.845 . 0 0 "[ . 1 . 2]" 1
570 1 24 ILE MD 1 105 PHE HB3 3.650 . 5.500 4.439 4.177 4.630 . 0 0 "[ . 1 . 2]" 1
571 1 24 ILE MD 1 105 PHE QD 2.785 . 3.770 2.120 1.935 2.386 . 0 0 "[ . 1 . 2]" 1
572 1 24 ILE MD 1 105 PHE QE 2.565 . 3.330 2.512 2.266 3.025 . 0 0 "[ . 1 . 2]" 1
573 1 24 ILE HG12 1 24 ILE MG 2.405 . 3.010 2.018 1.889 2.135 . 0 0 "[ . 1 . 2]" 1
574 1 24 ILE HG12 1 34 LEU QD 3.430 . 5.060 4.657 4.509 4.793 . 0 0 "[ . 1 . 2]" 1
575 1 24 ILE HG13 1 105 PHE QD 3.325 . 4.850 4.009 3.878 4.214 . 0 0 "[ . 1 . 2]" 1
576 1 24 ILE HG13 1 105 PHE QE 3.500 . 5.200 4.866 4.640 5.176 . 0 0 "[ . 1 . 2]" 1
577 1 24 ILE MG 1 25 LEU H 2.760 . 3.720 3.600 3.427 3.692 . 0 0 "[ . 1 . 2]" 1
578 1 24 ILE MG 1 25 LEU HA 2.945 . 4.090 3.897 3.721 4.027 . 0 0 "[ . 1 . 2]" 1
579 1 24 ILE MG 1 28 ARG H 3.175 . 4.550 4.050 3.656 4.431 . 0 0 "[ . 1 . 2]" 1
580 1 24 ILE MG 1 28 ARG HB2 2.780 . 3.760 3.373 3.000 3.589 . 0 0 "[ . 1 . 2]" 1
581 1 24 ILE MG 1 28 ARG QD 3.085 . 4.370 2.360 2.000 2.822 . 0 0 "[ . 1 . 2]" 1
582 1 24 ILE MG 1 32 THR MG 3.010 . 4.220 3.784 3.485 3.974 . 0 0 "[ . 1 . 2]" 1
583 1 24 ILE MG 1 105 PHE HA 3.080 . 4.360 3.358 3.074 3.605 . 0 0 "[ . 1 . 2]" 1
584 1 24 ILE MG 1 105 PHE HB2 2.730 . 3.660 2.486 2.113 2.800 . 0 0 "[ . 1 . 2]" 1
585 1 24 ILE MG 1 105 PHE HB3 3.310 . 4.820 4.014 3.728 4.299 . 0 0 "[ . 1 . 2]" 1
586 1 24 ILE MG 1 105 PHE QD 2.470 . 3.140 2.093 2.001 2.177 . 0 0 "[ . 1 . 2]" 1
587 1 24 ILE MG 1 105 PHE QE 2.855 . 3.910 3.709 3.457 3.892 . 0 0 "[ . 1 . 2]" 1
588 1 24 ILE MG 1 106 LYS H 3.605 . 5.410 4.742 4.453 4.991 . 0 0 "[ . 1 . 2]" 1
589 1 25 LEU H 1 25 LEU HB2 2.310 . 2.820 2.419 2.374 2.497 . 0 0 "[ . 1 . 2]" 1
590 1 25 LEU H 1 25 LEU HB3 2.700 . 3.600 3.577 3.562 3.594 . 0 0 "[ . 1 . 2]" 1
591 1 25 LEU H 1 25 LEU MD1 2.895 . 3.990 3.562 3.389 3.675 . 0 0 "[ . 1 . 2]" 1
592 1 25 LEU H 1 25 LEU QD 2.425 . 3.050 3.063 2.975 3.113 0.063 15 0 "[ . 1 . 2]" 1
593 1 25 LEU H 1 25 LEU MD2 2.895 . 3.990 3.349 3.188 3.549 . 0 0 "[ . 1 . 2]" 1
594 1 25 LEU H 1 25 LEU HG 2.465 . 3.130 2.216 2.105 2.268 . 0 0 "[ . 1 . 2]" 1
595 1 25 LEU H 1 26 ALA H 2.460 . 3.120 2.871 2.746 2.930 . 0 0 "[ . 1 . 2]" 1
596 1 25 LEU H 1 26 ALA HA 3.650 . 5.500 5.436 5.342 5.478 . 0 0 "[ . 1 . 2]" 1
597 1 25 LEU H 1 28 ARG H 3.185 . 4.570 4.494 4.391 4.628 0.058 18 0 "[ . 1 . 2]" 1
598 1 25 LEU H 1 28 ARG HB2 3.220 . 4.640 4.503 4.313 4.680 0.040 9 0 "[ . 1 . 2]" 1
599 1 25 LEU H 1 28 ARG QD 3.570 . 5.340 5.164 4.615 5.466 0.126 1 0 "[ . 1 . 2]" 1
600 1 25 LEU H 1 34 LEU QD 2.870 . 3.940 3.401 3.223 3.517 . 0 0 "[ . 1 . 2]" 1
601 1 25 LEU H 1 55 VAL MG1 3.600 . 5.400 4.822 4.391 5.193 . 0 0 "[ . 1 . 2]" 1
602 1 25 LEU H 1 55 VAL QG 2.995 . 4.190 3.806 3.616 3.960 . 0 0 "[ . 1 . 2]" 1
603 1 25 LEU H 1 55 VAL MG2 3.600 . 5.400 3.991 3.788 4.114 . 0 0 "[ . 1 . 2]" 1
604 1 25 LEU H 1 105 PHE QD 3.575 . 5.350 4.487 4.224 4.938 . 0 0 "[ . 1 . 2]" 1
605 1 25 LEU HA 1 25 LEU QD 2.295 . 2.790 1.962 1.864 2.033 . 0 0 "[ . 1 . 2]" 1
606 1 25 LEU HA 1 26 ALA HA 3.460 . 5.120 4.845 4.805 4.939 . 0 0 "[ . 1 . 2]" 1
607 1 25 LEU HA 1 28 ARG H 2.680 . 3.560 3.143 3.004 3.432 . 0 0 "[ . 1 . 2]" 1
608 1 25 LEU HA 1 28 ARG HB2 2.995 . 4.190 2.457 2.124 2.864 . 0 0 "[ . 1 . 2]" 1
609 1 25 LEU HA 1 55 VAL QG 3.500 . 5.200 3.945 3.854 4.123 . 0 0 "[ . 1 . 2]" 1
610 1 25 LEU HB2 1 26 ALA H 2.640 . 3.480 2.474 2.310 2.611 . 0 0 "[ . 1 . 2]" 1
611 1 25 LEU HB2 1 26 ALA HA 3.515 . 5.230 4.412 4.276 4.482 . 0 0 "[ . 1 . 2]" 1
612 1 25 LEU HB2 1 55 VAL MG1 2.900 . 4.000 2.997 2.451 3.471 . 0 0 "[ . 1 . 2]" 1
613 1 25 LEU HB2 1 55 VAL QG 2.485 . 3.170 1.922 1.810 2.066 . 0 0 "[ . 1 . 2]" 1
614 1 25 LEU HB2 1 55 VAL MG2 2.900 . 4.000 1.950 1.825 2.083 . 0 0 "[ . 1 . 2]" 1
615 1 25 LEU HB3 1 26 ALA H 2.895 . 3.990 3.393 3.176 3.585 . 0 0 "[ . 1 . 2]" 1
616 1 25 LEU HB3 1 50 LYS H 3.135 . 4.470 3.822 3.360 4.130 . 0 0 "[ . 1 . 2]" 1
617 1 25 LEU HB3 1 50 LYS HB3 3.185 . 4.570 3.888 3.498 4.315 . 0 0 "[ . 1 . 2]" 1
618 1 25 LEU HB3 1 55 VAL QG 2.585 . 3.370 2.114 1.889 2.245 . 0 0 "[ . 1 . 2]" 1
619 1 25 LEU QD 1 28 ARG H 3.245 . 4.690 4.431 4.306 4.708 0.018 15 0 "[ . 1 . 2]" 1
620 1 25 LEU QD 1 28 ARG HB2 2.950 . 4.100 3.362 3.102 3.841 . 0 0 "[ . 1 . 2]" 1
621 1 25 LEU QD 1 28 ARG HB3 3.095 . 4.390 3.520 3.093 3.956 . 0 0 "[ . 1 . 2]" 1
622 1 25 LEU QD 1 32 THR H 3.335 . 4.870 4.128 3.988 4.241 . 0 0 "[ . 1 . 2]" 1
623 1 25 LEU QD 1 32 THR HB 2.695 . 3.590 2.106 1.956 2.291 . 0 0 "[ . 1 . 2]" 1
624 1 25 LEU QD 1 32 THR MG 2.250 . 2.700 1.941 1.818 2.061 . 0 0 "[ . 1 . 2]" 1
625 1 25 LEU QD 1 33 PHE HA 2.585 . 3.370 2.201 1.908 2.456 . 0 0 "[ . 1 . 2]" 1
626 1 25 LEU QD 1 33 PHE HB2 3.465 . 5.130 3.913 3.705 4.143 . 0 0 "[ . 1 . 2]" 1
627 1 25 LEU QD 1 33 PHE HB3 3.315 . 4.830 4.027 3.840 4.259 . 0 0 "[ . 1 . 2]" 1
628 1 25 LEU QD 1 34 LEU H 2.860 . 3.920 3.020 2.900 3.190 . 0 0 "[ . 1 . 2]" 1
629 1 25 LEU QD 1 34 LEU HB3 3.270 . 4.740 3.003 2.852 3.169 . 0 0 "[ . 1 . 2]" 1
630 1 25 LEU QD 1 34 LEU QD 2.315 . 2.830 1.904 1.803 2.105 . 0 0 "[ . 1 . 2]" 1
631 1 25 LEU QD 1 50 LYS H 2.490 . 3.180 2.709 2.407 2.955 . 0 0 "[ . 1 . 2]" 1
632 1 25 LEU QD 1 50 LYS HB2 2.690 . 3.580 2.417 2.157 2.664 . 0 0 "[ . 1 . 2]" 1
633 1 25 LEU QD 1 50 LYS HB3 3.365 . 4.930 3.235 2.906 3.536 . 0 0 "[ . 1 . 2]" 1
634 1 25 LEU QD 1 55 VAL HA 3.040 . 4.280 3.801 3.649 3.952 . 0 0 "[ . 1 . 2]" 1
635 1 25 LEU QD 1 55 VAL QG 2.300 . 2.800 1.766 1.732 1.834 0.068 20 0 "[ . 1 . 2]" 1
636 1 25 LEU QD 1 57 HIS HE1 3.220 . 4.640 3.162 2.935 3.499 . 0 0 "[ . 1 . 2]" 1
637 1 25 LEU QD 1 105 PHE H 3.430 . 5.060 3.434 3.193 3.712 . 0 0 "[ . 1 . 2]" 1
638 1 25 LEU QD 1 105 PHE HA 2.815 . 3.830 2.840 2.497 3.090 . 0 0 "[ . 1 . 2]" 1
639 1 25 LEU QD 1 105 PHE HB2 2.775 . 3.750 2.478 2.258 2.748 . 0 0 "[ . 1 . 2]" 1
640 1 25 LEU QD 1 105 PHE HB3 2.690 . 3.580 2.239 2.084 2.462 . 0 0 "[ . 1 . 2]" 1
641 1 25 LEU QD 1 105 PHE QD 2.890 . 3.980 3.786 3.629 3.993 0.013 6 0 "[ . 1 . 2]" 1
642 1 25 LEU MD1 1 26 ALA H 3.245 . 4.690 4.447 4.289 4.580 . 0 0 "[ . 1 . 2]" 1
643 1 25 LEU MD1 1 33 PHE HA 2.865 . 3.930 2.793 2.395 3.073 . 0 0 "[ . 1 . 2]" 1
644 1 25 LEU MD1 1 33 PHE HB3 3.650 . 5.500 4.874 4.498 5.096 . 0 0 "[ . 1 . 2]" 1
645 1 25 LEU MD1 1 50 LYS HB2 2.990 . 4.180 3.515 3.244 3.826 . 0 0 "[ . 1 . 2]" 1
646 1 25 LEU MD2 1 26 ALA H 3.245 . 4.690 4.586 4.498 4.689 . 0 0 "[ . 1 . 2]" 1
647 1 25 LEU MD2 1 33 PHE HA 2.865 . 3.930 2.329 1.946 2.673 . 0 0 "[ . 1 . 2]" 1
648 1 25 LEU MD2 1 33 PHE HB3 3.650 . 5.500 4.304 4.048 4.583 . 0 0 "[ . 1 . 2]" 1
649 1 25 LEU MD2 1 50 LYS HB2 2.990 . 4.180 2.464 2.186 2.729 . 0 0 "[ . 1 . 2]" 1
650 1 25 LEU HG 1 34 LEU QD 2.630 . 3.460 1.948 1.784 2.067 0.016 3 0 "[ . 1 . 2]" 1
651 1 25 LEU HG 1 55 VAL QG 2.990 . 4.180 3.513 3.423 3.627 . 0 0 "[ . 1 . 2]" 1
652 1 26 ALA H 1 26 ALA MB 2.100 . 2.400 2.200 2.086 2.251 . 0 0 "[ . 1 . 2]" 1
653 1 26 ALA H 1 27 ASN H 3.075 . 4.350 2.752 2.685 2.923 . 0 0 "[ . 1 . 2]" 1
654 1 26 ALA H 1 28 ARG H 3.010 . 4.220 4.054 3.887 4.210 . 0 0 "[ . 1 . 2]" 1
655 1 26 ALA H 1 55 VAL HB 3.650 . 5.500 5.483 4.913 5.637 0.137 16 0 "[ . 1 . 2]" 1
656 1 26 ALA H 1 55 VAL QG 2.620 . 3.440 2.867 2.356 3.081 . 0 0 "[ . 1 . 2]" 1
657 1 26 ALA HA 1 28 ARG H 3.160 . 4.520 4.355 4.024 4.596 0.076 15 0 "[ . 1 . 2]" 1
658 1 26 ALA HA 1 50 LYS HD2 3.065 . 4.330 3.373 2.556 3.682 . 0 0 "[ . 1 . 2]" 1
659 1 26 ALA HA 1 50 LYS HD3 2.405 . 3.010 2.458 1.973 3.052 0.042 18 0 "[ . 1 . 2]" 1
660 1 26 ALA HA 1 50 LYS HE2 3.300 . 4.800 3.406 2.460 4.215 . 0 0 "[ . 1 . 2]" 1
661 1 26 ALA HA 1 50 LYS HE3 3.300 . 4.800 2.656 2.162 3.640 . 0 0 "[ . 1 . 2]" 1
662 1 26 ALA HA 1 50 LYS HG2 3.650 . 5.500 4.521 3.883 5.193 . 0 0 "[ . 1 . 2]" 1
663 1 26 ALA HA 1 55 VAL QG 2.920 . 4.040 3.206 2.752 3.667 . 0 0 "[ . 1 . 2]" 1
664 1 26 ALA MB 1 27 ASN H 2.870 . 3.940 2.577 2.318 2.711 . 0 0 "[ . 1 . 2]" 1
665 1 26 ALA MB 1 27 ASN HA 3.045 . 4.290 3.853 3.785 3.932 . 0 0 "[ . 1 . 2]" 1
666 1 26 ALA MB 1 27 ASN HB2 3.270 . 4.740 4.088 3.718 4.733 . 0 0 "[ . 1 . 2]" 1
667 1 26 ALA MB 1 27 ASN QB 2.875 . 3.950 3.750 3.585 4.160 0.210 18 0 "[ . 1 . 2]" 1
668 1 26 ALA MB 1 27 ASN HB3 3.270 . 4.740 4.494 4.091 4.761 0.021 4 0 "[ . 1 . 2]" 1
669 1 26 ALA MB 1 28 ARG H 3.340 . 4.880 4.444 4.235 4.599 . 0 0 "[ . 1 . 2]" 1
670 1 26 ALA MB 1 50 LYS QE 3.065 . 4.330 3.559 2.920 4.045 . 0 0 "[ . 1 . 2]" 1
671 1 26 ALA MB 1 54 GLU HA 3.625 . 5.450 4.383 3.667 4.737 . 0 0 "[ . 1 . 2]" 1
672 1 26 ALA MB 1 54 GLU QG 3.650 . 5.500 5.403 4.805 5.547 0.047 8 0 "[ . 1 . 2]" 1
673 1 26 ALA MB 1 55 VAL QG 2.630 . 3.460 2.967 2.443 3.389 . 0 0 "[ . 1 . 2]" 1
674 1 27 ASN H 1 28 ARG H 2.730 . 3.660 2.491 2.371 2.588 . 0 0 "[ . 1 . 2]" 1
675 1 27 ASN HB2 1 28 ARG H 2.985 . 4.170 3.980 3.060 4.183 0.013 20 0 "[ . 1 . 2]" 1
676 1 27 ASN HB3 1 28 ARG H 2.985 . 4.170 2.987 2.696 4.239 0.069 18 0 "[ . 1 . 2]" 1
677 1 28 ARG H 1 28 ARG HB2 2.435 . 3.070 2.130 2.064 2.192 . 0 0 "[ . 1 . 2]" 1
678 1 28 ARG H 1 28 ARG HB3 2.665 . 3.530 3.164 3.019 3.310 . 0 0 "[ . 1 . 2]" 1
679 1 28 ARG H 1 28 ARG HD2 2.970 . 4.140 3.477 2.982 4.205 0.065 13 0 "[ . 1 . 2]" 1
680 1 28 ARG H 1 28 ARG QD 2.705 . 3.610 3.184 2.745 3.535 . 0 0 "[ . 1 . 2]" 1
681 1 28 ARG H 1 28 ARG HD3 2.970 . 4.140 3.896 2.788 4.220 0.080 1 0 "[ . 1 . 2]" 1
682 1 28 ARG H 1 29 SER H 3.280 . 4.760 4.389 3.194 4.609 . 0 0 "[ . 1 . 2]" 1
683 1 28 ARG H 1 29 SER HA 3.650 . 5.500 5.510 5.071 5.649 0.149 14 0 "[ . 1 . 2]" 1
684 1 28 ARG H 1 32 THR HB 3.630 . 5.460 4.923 4.652 5.100 . 0 0 "[ . 1 . 2]" 1
685 1 28 ARG H 1 50 LYS HD3 3.515 . 5.230 4.510 3.822 4.972 . 0 0 "[ . 1 . 2]" 1
686 1 28 ARG HA 1 28 ARG HD2 2.895 . 3.990 2.393 2.044 2.864 . 0 0 "[ . 1 . 2]" 1
687 1 28 ARG HA 1 28 ARG QD 2.545 . 3.290 2.346 2.031 2.759 . 0 0 "[ . 1 . 2]" 1
688 1 28 ARG HA 1 28 ARG HD3 2.895 . 3.990 3.592 2.794 3.940 . 0 0 "[ . 1 . 2]" 1
689 1 28 ARG HA 1 28 ARG QG 2.760 . 3.720 2.185 2.002 2.321 . 0 0 "[ . 1 . 2]" 1
690 1 28 ARG HA 1 29 SER QB 3.260 . 4.720 4.266 4.141 4.729 0.009 13 0 "[ . 1 . 2]" 1
691 1 28 ARG HB2 1 29 SER H 2.870 . 3.940 3.703 2.979 3.986 0.046 18 0 "[ . 1 . 2]" 1
692 1 28 ARG HB2 1 32 THR HB 2.950 . 4.100 3.586 3.323 3.941 . 0 0 "[ . 1 . 2]" 1
693 1 28 ARG HB2 1 32 THR MG 2.740 . 3.680 2.530 2.216 2.723 . 0 0 "[ . 1 . 2]" 1
694 1 28 ARG HB2 1 105 PHE HA 3.555 . 5.310 4.130 3.862 4.455 . 0 0 "[ . 1 . 2]" 1
695 1 28 ARG HB3 1 29 SER H 2.705 . 3.610 2.385 1.740 2.892 0.060 5 0 "[ . 1 . 2]" 1
696 1 28 ARG HB3 1 32 THR HB 3.015 . 4.230 2.576 2.345 3.091 . 0 0 "[ . 1 . 2]" 1
697 1 28 ARG HB3 1 32 THR MG 2.685 . 3.570 2.321 2.188 2.553 . 0 0 "[ . 1 . 2]" 1
698 1 28 ARG QD 1 29 SER H 3.140 . 4.480 4.112 3.828 4.543 0.063 5 0 "[ . 1 . 2]" 1
699 1 28 ARG QD 1 32 THR MG 3.045 . 4.290 3.103 2.661 3.706 . 0 0 "[ . 1 . 2]" 1
700 1 28 ARG HD2 1 29 SER H 3.450 . 5.100 4.412 4.009 5.020 . 0 0 "[ . 1 . 2]" 1
701 1 28 ARG HD2 1 32 THR MG 3.420 . 5.040 4.137 3.818 4.523 . 0 0 "[ . 1 . 2]" 1
702 1 28 ARG HD3 1 29 SER H 3.450 . 5.100 4.954 4.658 5.197 0.097 5 0 "[ . 1 . 2]" 1
703 1 28 ARG HD3 1 32 THR MG 3.420 . 5.040 3.212 2.716 3.936 . 0 0 "[ . 1 . 2]" 1
704 1 28 ARG QG 1 29 SER H 3.135 . 4.470 2.436 2.008 3.556 . 0 0 "[ . 1 . 2]" 1
705 1 28 ARG QG 1 32 THR HB 3.095 . 4.390 3.782 3.474 4.285 . 0 0 "[ . 1 . 2]" 1
706 1 28 ARG QG 1 32 THR MG 2.630 . 3.460 1.989 1.792 2.338 0.008 2 0 "[ . 1 . 2]" 1
707 1 28 ARG HG2 1 29 SER H 3.525 . 5.250 3.440 2.748 4.028 . 0 0 "[ . 1 . 2]" 1
708 1 28 ARG HG3 1 29 SER H 3.525 . 5.250 2.526 2.022 3.957 . 0 0 "[ . 1 . 2]" 1
709 1 29 SER H 1 29 SER HB2 2.820 . 3.840 2.445 2.151 3.433 . 0 0 "[ . 1 . 2]" 1
710 1 29 SER H 1 29 SER QB 2.540 . 3.280 2.336 2.125 3.012 . 0 0 "[ . 1 . 2]" 1
711 1 29 SER H 1 29 SER HB3 2.820 . 3.840 3.114 2.807 3.964 0.124 15 0 "[ . 1 . 2]" 1
712 1 29 SER H 1 32 THR HB 3.395 . 4.990 4.229 3.144 4.781 . 0 0 "[ . 1 . 2]" 1
713 1 29 SER H 1 32 THR MG 3.250 . 4.700 3.870 3.497 4.260 . 0 0 "[ . 1 . 2]" 1
714 1 29 SER HA 1 30 ASP H 2.335 . 2.870 2.338 2.254 2.435 . 0 0 "[ . 1 . 2]" 1
715 1 29 SER HA 1 30 ASP QB 3.205 . 4.610 4.294 4.136 4.635 0.025 1 0 "[ . 1 . 2]" 1
716 1 29 SER QB 1 30 ASP H 2.590 . 3.380 2.958 2.418 3.237 . 0 0 "[ . 1 . 2]" 1
717 1 29 SER QB 1 30 ASP QB 3.145 . 4.490 4.390 3.991 4.620 0.130 3 0 "[ . 1 . 2]" 1
718 1 29 SER QB 1 31 GLY H 3.570 . 5.340 5.317 5.073 5.417 0.077 18 0 "[ . 1 . 2]" 1
719 1 29 SER QB 1 32 THR H 3.330 . 4.860 4.094 3.929 4.298 . 0 0 "[ . 1 . 2]" 1
720 1 29 SER QB 1 103 PHE QE 2.740 . 3.680 2.632 2.439 3.141 . 0 0 "[ . 1 . 2]" 1
721 1 29 SER HB2 1 103 PHE QD 3.650 . 5.500 5.141 4.438 5.528 0.028 19 0 "[ . 1 . 2]" 1
722 1 29 SER HB2 1 103 PHE QE 3.030 . 4.260 3.669 2.516 4.156 . 0 0 "[ . 1 . 2]" 1
723 1 29 SER HB3 1 103 PHE QD 3.650 . 5.500 4.803 4.382 5.561 0.061 13 0 "[ . 1 . 2]" 1
724 1 29 SER HB3 1 103 PHE QE 3.030 . 4.260 2.820 2.461 3.907 . 0 0 "[ . 1 . 2]" 1
725 1 30 ASP H 1 30 ASP QB 2.365 . 2.930 2.196 2.019 2.715 . 0 0 "[ . 1 . 2]" 1
726 1 30 ASP H 1 50 LYS HB3 3.650 . 5.500 5.184 4.852 5.490 . 0 0 "[ . 1 . 2]" 1
727 1 30 ASP H 1 50 LYS HG2 3.315 . 4.830 3.760 3.443 3.901 . 0 0 "[ . 1 . 2]" 1
728 1 30 ASP HA 1 31 GLY H 2.240 . 2.680 2.142 2.104 2.182 . 0 0 "[ . 1 . 2]" 1
729 1 30 ASP HA 1 31 GLY HA2 3.160 . 4.520 4.430 4.394 4.470 . 0 0 "[ . 1 . 2]" 1
730 1 30 ASP HA 1 32 THR H 2.845 . 3.890 3.407 3.217 3.507 . 0 0 "[ . 1 . 2]" 1
731 1 30 ASP HA 1 50 LYS H 3.650 . 5.500 5.102 4.860 5.248 . 0 0 "[ . 1 . 2]" 1
732 1 30 ASP HA 1 50 LYS HB2 3.320 . 4.840 4.152 3.953 4.315 . 0 0 "[ . 1 . 2]" 1
733 1 30 ASP HA 1 50 LYS HB3 2.990 . 4.180 2.997 2.723 3.225 . 0 0 "[ . 1 . 2]" 1
734 1 30 ASP HA 1 50 LYS HD3 3.565 . 5.330 4.462 3.947 4.865 . 0 0 "[ . 1 . 2]" 1
735 1 30 ASP HA 1 50 LYS QE 3.220 . 4.640 3.522 3.119 3.933 . 0 0 "[ . 1 . 2]" 1
736 1 30 ASP HA 1 50 LYS HG2 2.955 . 4.110 2.282 1.916 2.793 . 0 0 "[ . 1 . 2]" 1
737 1 30 ASP HA 1 50 LYS HG3 2.785 . 3.770 1.903 1.783 2.089 0.017 16 0 "[ . 1 . 2]" 1
738 1 30 ASP QB 1 31 GLY H 2.885 . 3.970 3.411 3.067 3.584 . 0 0 "[ . 1 . 2]" 1
739 1 31 GLY H 1 32 THR H 2.440 . 3.080 2.465 2.281 2.692 . 0 0 "[ . 1 . 2]" 1
740 1 31 GLY H 1 32 THR HA 3.565 . 5.330 4.944 4.781 5.080 . 0 0 "[ . 1 . 2]" 1
741 1 31 GLY H 1 32 THR HB 3.415 . 5.030 4.412 4.198 4.602 . 0 0 "[ . 1 . 2]" 1
742 1 31 GLY H 1 50 LYS HB2 2.850 . 3.900 3.934 3.748 4.046 0.146 3 0 "[ . 1 . 2]" 1
743 1 31 GLY H 1 50 LYS HB3 2.840 . 3.880 2.279 2.068 2.366 . 0 0 "[ . 1 . 2]" 1
744 1 31 GLY H 1 50 LYS HG2 3.060 . 4.320 3.397 2.894 3.949 . 0 0 "[ . 1 . 2]" 1
745 1 31 GLY H 1 50 LYS HG3 2.960 . 4.120 2.815 2.455 3.245 . 0 0 "[ . 1 . 2]" 1
746 1 31 GLY H 1 51 TYR HA 3.355 . 4.910 3.496 3.344 3.770 . 0 0 "[ . 1 . 2]" 1
747 1 31 GLY H 1 99 THR MG 3.630 . 5.460 4.568 3.966 4.937 . 0 0 "[ . 1 . 2]" 1
748 1 31 GLY H 1 102 GLN HB2 3.550 . 5.300 5.037 4.730 5.213 . 0 0 "[ . 1 . 2]" 1
749 1 31 GLY H 1 102 GLN HG3 3.420 . 5.040 4.913 4.763 5.062 0.022 19 0 "[ . 1 . 2]" 1
750 1 31 GLY HA2 1 50 LYS H 3.385 . 4.970 4.444 4.195 4.620 . 0 0 "[ . 1 . 2]" 1
751 1 31 GLY HA2 1 99 THR MG 3.150 . 4.500 2.825 2.376 3.268 . 0 0 "[ . 1 . 2]" 1
752 1 31 GLY HA2 1 102 GLN H 3.135 . 4.470 4.162 3.643 4.500 0.030 9 0 "[ . 1 . 2]" 1
753 1 31 GLY HA2 1 102 GLN HB2 2.870 . 3.940 3.554 3.257 3.913 . 0 0 "[ . 1 . 2]" 1
754 1 31 GLY HA2 1 102 GLN HB3 3.310 . 4.820 4.828 4.697 4.893 0.073 16 0 "[ . 1 . 2]" 1
755 1 31 GLY HA3 1 102 GLN H 3.185 . 4.570 4.137 3.447 4.608 0.038 5 0 "[ . 1 . 2]" 1
756 1 31 GLY HA3 1 102 GLN HB2 2.985 . 4.170 2.618 2.099 3.051 . 0 0 "[ . 1 . 2]" 1
757 1 31 GLY HA3 1 102 GLN HB3 3.080 . 4.360 3.453 3.263 3.578 . 0 0 "[ . 1 . 2]" 1
758 1 31 GLY HA3 1 102 GLN HG3 3.175 . 4.550 2.123 1.914 2.300 . 0 0 "[ . 1 . 2]" 1
759 1 31 GLY HA3 1 103 PHE QE 3.080 . 4.360 3.553 3.180 3.912 . 0 0 "[ . 1 . 2]" 1
760 1 32 THR H 1 32 THR HB 2.400 . 3.000 2.720 2.650 2.767 . 0 0 "[ . 1 . 2]" 1
761 1 32 THR H 1 50 LYS H 3.120 . 4.440 3.851 3.617 4.092 . 0 0 "[ . 1 . 2]" 1
762 1 32 THR H 1 50 LYS HB2 3.035 . 4.270 3.780 3.566 3.972 . 0 0 "[ . 1 . 2]" 1
763 1 32 THR H 1 50 LYS HB3 2.505 . 3.210 2.299 2.174 2.438 . 0 0 "[ . 1 . 2]" 1
764 1 32 THR H 1 103 PHE H 3.295 . 4.790 4.677 4.428 4.816 0.026 6 0 "[ . 1 . 2]" 1
765 1 32 THR H 1 103 PHE QE 3.040 . 4.280 2.635 2.429 2.913 . 0 0 "[ . 1 . 2]" 1
766 1 32 THR HA 1 32 THR MG 2.545 . 3.290 2.315 2.253 2.347 . 0 0 "[ . 1 . 2]" 1
767 1 32 THR HA 1 33 PHE H 2.280 . 2.760 2.249 2.208 2.333 . 0 0 "[ . 1 . 2]" 1
768 1 32 THR HA 1 33 PHE QD 2.930 . 4.060 3.246 3.057 3.458 . 0 0 "[ . 1 . 2]" 1
769 1 32 THR HA 1 102 GLN H 3.415 . 5.030 4.818 4.660 5.054 0.024 12 0 "[ . 1 . 2]" 1
770 1 32 THR HA 1 103 PHE H 2.480 . 3.160 2.692 2.569 2.800 . 0 0 "[ . 1 . 2]" 1
771 1 32 THR HA 1 103 PHE HA 3.395 . 4.990 4.789 4.682 4.895 . 0 0 "[ . 1 . 2]" 1
772 1 32 THR HA 1 103 PHE QB 3.000 . 4.200 3.790 3.604 4.039 . 0 0 "[ . 1 . 2]" 1
773 1 32 THR HA 1 103 PHE QD 2.650 . 3.500 2.061 1.988 2.175 . 0 0 "[ . 1 . 2]" 1
774 1 32 THR HA 1 103 PHE QE 3.100 . 4.400 3.352 3.176 3.569 . 0 0 "[ . 1 . 2]" 1
775 1 32 THR HB 1 33 PHE H 2.960 . 4.120 3.935 3.774 4.068 . 0 0 "[ . 1 . 2]" 1
776 1 32 THR HB 1 50 LYS H 3.190 . 4.580 3.560 3.352 3.829 . 0 0 "[ . 1 . 2]" 1
777 1 32 THR HB 1 50 LYS HB2 3.180 . 4.560 2.534 2.188 2.755 . 0 0 "[ . 1 . 2]" 1
778 1 32 THR HB 1 50 LYS HB3 3.265 . 4.730 2.530 2.371 2.869 . 0 0 "[ . 1 . 2]" 1
779 1 32 THR MG 1 33 PHE H 2.370 . 2.940 2.248 2.022 2.423 . 0 0 "[ . 1 . 2]" 1
780 1 32 THR MG 1 33 PHE HA 3.265 . 4.730 3.729 3.558 3.881 . 0 0 "[ . 1 . 2]" 1
781 1 32 THR MG 1 33 PHE QD 3.200 . 4.600 4.182 3.985 4.323 . 0 0 "[ . 1 . 2]" 1
782 1 32 THR MG 1 34 LEU QD 3.185 . 4.570 3.902 3.775 4.097 . 0 0 "[ . 1 . 2]" 1
783 1 32 THR MG 1 103 PHE H 3.155 . 4.510 4.191 4.012 4.341 . 0 0 "[ . 1 . 2]" 1
784 1 32 THR MG 1 103 PHE QB 2.980 . 4.160 3.363 3.039 3.538 . 0 0 "[ . 1 . 2]" 1
785 1 32 THR MG 1 103 PHE QD 3.070 . 4.340 2.456 2.310 2.595 . 0 0 "[ . 1 . 2]" 1
786 1 32 THR MG 1 103 PHE QE 3.540 . 5.280 3.949 3.736 4.165 . 0 0 "[ . 1 . 2]" 1
787 1 32 THR MG 1 105 PHE H 2.665 . 3.530 3.191 3.034 3.425 . 0 0 "[ . 1 . 2]" 1
788 1 32 THR MG 1 105 PHE HA 2.400 . 3.000 2.079 1.919 2.287 . 0 0 "[ . 1 . 2]" 1
789 1 32 THR MG 1 105 PHE HB2 2.775 . 3.750 3.243 3.133 3.446 . 0 0 "[ . 1 . 2]" 1
790 1 32 THR MG 1 105 PHE HB3 2.580 . 3.360 3.128 2.954 3.310 . 0 0 "[ . 1 . 2]" 1
791 1 32 THR MG 1 107 GLU H 3.255 . 4.710 4.460 4.266 4.699 . 0 0 "[ . 1 . 2]" 1
792 1 33 PHE H 1 33 PHE HB2 2.995 . 4.190 3.910 3.863 3.962 . 0 0 "[ . 1 . 2]" 1
793 1 33 PHE H 1 33 PHE HB3 2.755 . 3.710 3.117 3.042 3.217 . 0 0 "[ . 1 . 2]" 1
794 1 33 PHE H 1 33 PHE QD 2.455 . 3.110 2.412 2.143 2.562 . 0 0 "[ . 1 . 2]" 1
795 1 33 PHE H 1 102 GLN H 3.650 . 5.500 5.259 5.044 5.432 . 0 0 "[ . 1 . 2]" 1
796 1 33 PHE H 1 103 PHE H 2.815 . 3.830 3.428 3.227 3.626 . 0 0 "[ . 1 . 2]" 1
797 1 33 PHE H 1 103 PHE HA 3.595 . 5.390 4.869 4.713 5.044 . 0 0 "[ . 1 . 2]" 1
798 1 33 PHE H 1 103 PHE QD 3.200 . 4.600 3.867 3.709 3.994 . 0 0 "[ . 1 . 2]" 1
799 1 33 PHE H 1 104 PRO HA 2.775 . 3.750 3.087 2.947 3.297 . 0 0 "[ . 1 . 2]" 1
800 1 33 PHE H 1 104 PRO QB 3.445 . 5.090 4.871 4.751 5.055 . 0 0 "[ . 1 . 2]" 1
801 1 33 PHE H 1 105 PHE H 2.935 . 4.070 3.526 3.249 3.995 . 0 0 "[ . 1 . 2]" 1
802 1 33 PHE H 1 105 PHE HA 3.255 . 4.710 4.276 4.041 4.571 . 0 0 "[ . 1 . 2]" 1
803 1 33 PHE H 1 105 PHE HB3 3.190 . 4.580 4.341 4.066 4.598 0.018 4 0 "[ . 1 . 2]" 1
804 1 33 PHE HA 1 33 PHE QD 3.215 . 4.630 3.692 3.681 3.697 . 0 0 "[ . 1 . 2]" 1
805 1 33 PHE HA 1 34 LEU H 2.300 . 2.800 2.438 2.317 2.506 . 0 0 "[ . 1 . 2]" 1
806 1 33 PHE HA 1 34 LEU HB3 3.225 . 4.650 4.262 4.210 4.316 . 0 0 "[ . 1 . 2]" 1
807 1 33 PHE HA 1 34 LEU QD 3.150 . 4.500 3.974 3.807 4.109 . 0 0 "[ . 1 . 2]" 1
808 1 33 PHE HA 1 34 LEU HG 3.065 . 4.330 3.844 3.685 3.983 . 0 0 "[ . 1 . 2]" 1
809 1 33 PHE HA 1 50 LYS H 2.765 . 3.730 3.015 2.823 3.212 . 0 0 "[ . 1 . 2]" 1
810 1 33 PHE HA 1 104 PRO HA 3.650 . 5.500 5.046 4.949 5.233 . 0 0 "[ . 1 . 2]" 1
811 1 33 PHE HB2 1 34 LEU H 2.450 . 3.100 2.336 2.163 2.544 . 0 0 "[ . 1 . 2]" 1
812 1 33 PHE HB2 1 50 LYS H 3.530 . 5.260 4.590 4.291 4.876 . 0 0 "[ . 1 . 2]" 1
813 1 33 PHE HB2 1 101 LEU MD1 3.090 . 4.380 2.904 2.710 3.119 . 0 0 "[ . 1 . 2]" 1
814 1 33 PHE HB3 1 34 LEU H 2.855 . 3.910 3.771 3.651 3.879 . 0 0 "[ . 1 . 2]" 1
815 1 33 PHE HB3 1 50 LYS H 3.185 . 4.570 3.797 3.573 3.957 . 0 0 "[ . 1 . 2]" 1
816 1 33 PHE HB3 1 90 LEU QD 3.620 . 5.440 4.129 3.977 4.283 . 0 0 "[ . 1 . 2]" 1
817 1 33 PHE HB3 1 99 THR MG 3.650 . 5.500 5.138 4.964 5.313 . 0 0 "[ . 1 . 2]" 1
818 1 33 PHE HB3 1 101 LEU MD1 3.020 . 4.240 2.849 2.570 3.146 . 0 0 "[ . 1 . 2]" 1
819 1 33 PHE HB3 1 102 GLN H 3.215 . 4.630 4.274 3.984 4.652 0.022 3 0 "[ . 1 . 2]" 1
820 1 33 PHE QD 1 34 LEU H 3.150 . 4.500 2.829 2.617 3.270 . 0 0 "[ . 1 . 2]" 1
821 1 33 PHE QD 1 101 LEU MD1 3.230 . 4.660 2.466 2.324 2.598 . 0 0 "[ . 1 . 2]" 1
822 1 33 PHE QD 1 102 GLN H 2.705 . 3.610 3.206 2.954 3.596 . 0 0 "[ . 1 . 2]" 1
823 1 33 PHE QD 1 102 GLN HB2 3.170 . 4.540 3.749 3.512 4.114 . 0 0 "[ . 1 . 2]" 1
824 1 33 PHE QD 1 103 PHE H 2.440 . 3.080 2.322 2.192 2.603 . 0 0 "[ . 1 . 2]" 1
825 1 33 PHE QD 1 103 PHE QB 3.650 . 5.500 4.729 4.653 4.815 . 0 0 "[ . 1 . 2]" 1
826 1 33 PHE QD 1 104 PRO HA 3.050 . 4.300 3.667 3.458 3.773 . 0 0 "[ . 1 . 2]" 1
827 1 33 PHE QD 1 104 PRO HD2 3.650 . 5.500 5.537 5.511 5.565 0.065 13 0 "[ . 1 . 2]" 1
828 1 33 PHE QD 1 104 PRO HD3 3.650 . 5.500 4.859 4.812 4.918 . 0 0 "[ . 1 . 2]" 1
829 1 34 LEU H 1 34 LEU HB2 2.930 . 4.060 4.067 4.017 4.091 0.031 15 0 "[ . 1 . 2]" 1
830 1 34 LEU H 1 34 LEU HB3 2.740 . 3.680 3.438 3.371 3.492 . 0 0 "[ . 1 . 2]" 1
831 1 34 LEU H 1 34 LEU MD1 3.045 . 4.290 3.786 3.656 3.885 . 0 0 "[ . 1 . 2]" 1
832 1 34 LEU H 1 34 LEU QD 2.770 . 3.740 3.419 3.328 3.472 . 0 0 "[ . 1 . 2]" 1
833 1 34 LEU H 1 34 LEU MD2 3.045 . 4.290 3.900 3.735 4.026 . 0 0 "[ . 1 . 2]" 1
834 1 34 LEU H 1 34 LEU HG 2.425 . 3.050 2.585 2.425 2.677 . 0 0 "[ . 1 . 2]" 1
835 1 34 LEU H 1 35 VAL QG 3.070 . 4.340 3.783 3.561 4.074 . 0 0 "[ . 1 . 2]" 1
836 1 34 LEU H 1 55 VAL QG 3.610 . 5.420 5.030 4.914 5.150 . 0 0 "[ . 1 . 2]" 1
837 1 34 LEU H 1 105 PHE QD 3.580 . 5.360 5.094 4.920 5.258 . 0 0 "[ . 1 . 2]" 1
838 1 34 LEU HA 1 34 LEU MD1 2.965 . 4.130 3.501 3.461 3.541 . 0 0 "[ . 1 . 2]" 1
839 1 34 LEU HA 1 34 LEU MD2 2.965 . 4.130 4.067 4.023 4.099 . 0 0 "[ . 1 . 2]" 1
840 1 34 LEU HA 1 35 VAL H 2.270 . 2.740 2.410 2.321 2.462 . 0 0 "[ . 1 . 2]" 1
841 1 34 LEU HA 1 35 VAL HB 3.500 . 5.200 4.768 4.701 4.839 . 0 0 "[ . 1 . 2]" 1
842 1 34 LEU HA 1 35 VAL QG 2.795 . 3.790 3.030 2.963 3.171 . 0 0 "[ . 1 . 2]" 1
843 1 34 LEU HA 1 105 PHE QD 2.870 . 3.940 3.164 3.017 3.302 . 0 0 "[ . 1 . 2]" 1
844 1 34 LEU HA 1 105 PHE QE 3.265 . 4.730 4.410 4.139 4.618 . 0 0 "[ . 1 . 2]" 1
845 1 34 LEU HA 1 106 LYS H 3.650 . 5.500 5.245 5.100 5.485 . 0 0 "[ . 1 . 2]" 1
846 1 34 LEU HB2 1 34 LEU MD1 2.985 . 4.170 2.048 2.013 2.190 . 0 0 "[ . 1 . 2]" 1
847 1 34 LEU HB2 1 34 LEU MD2 2.985 . 4.170 2.662 2.548 2.735 . 0 0 "[ . 1 . 2]" 1
848 1 34 LEU HB2 1 35 VAL H 2.455 . 3.110 2.320 2.256 2.400 . 0 0 "[ . 1 . 2]" 1
849 1 34 LEU HB3 1 34 LEU HG 2.225 . 2.650 2.668 2.636 2.699 0.049 3 0 "[ . 1 . 2]" 1
850 1 34 LEU HB3 1 35 VAL H 2.740 . 3.680 3.732 3.689 3.772 0.092 19 0 "[ . 1 . 2]" 1
851 1 34 LEU HB3 1 105 PHE QD 2.560 . 3.320 2.070 1.943 2.234 . 0 0 "[ . 1 . 2]" 1
852 1 34 LEU QD 1 35 VAL H 2.610 . 3.420 2.408 2.257 2.636 . 0 0 "[ . 1 . 2]" 1
853 1 34 LEU QD 1 35 VAL HA 2.900 . 4.000 2.781 2.662 2.982 . 0 0 "[ . 1 . 2]" 1
854 1 34 LEU QD 1 35 VAL QG 3.035 . 4.270 3.502 3.416 3.634 . 0 0 "[ . 1 . 2]" 1
855 1 34 LEU QD 1 36 ARG H 2.725 . 3.650 3.528 3.320 3.686 0.036 20 0 "[ . 1 . 2]" 1
856 1 34 LEU QD 1 36 ARG HA 3.160 . 4.520 4.005 3.735 4.260 . 0 0 "[ . 1 . 2]" 1
857 1 34 LEU QD 1 36 ARG QB 3.085 . 4.370 2.943 2.622 3.287 . 0 0 "[ . 1 . 2]" 1
858 1 34 LEU QD 1 50 LYS H 3.620 . 5.440 5.470 5.313 5.554 0.114 5 0 "[ . 1 . 2]" 1
859 1 34 LEU QD 1 57 HIS HE1 2.920 . 4.040 3.947 3.698 4.083 0.043 4 0 "[ . 1 . 2]" 1
860 1 34 LEU QD 1 105 PHE H 3.140 . 4.480 3.639 3.483 3.778 . 0 0 "[ . 1 . 2]" 1
861 1 34 LEU QD 1 105 PHE HA 3.200 . 4.600 3.990 3.850 4.133 . 0 0 "[ . 1 . 2]" 1
862 1 34 LEU QD 1 105 PHE HB2 3.200 . 4.600 2.447 2.354 2.564 . 0 0 "[ . 1 . 2]" 1
863 1 34 LEU QD 1 105 PHE HB3 3.175 . 4.550 1.901 1.813 2.176 . 0 0 "[ . 1 . 2]" 1
864 1 34 LEU QD 1 105 PHE QD 2.780 . 3.760 2.702 2.602 2.794 . 0 0 "[ . 1 . 2]" 1
865 1 34 LEU QD 1 105 PHE QE 2.990 . 4.180 3.357 3.206 3.494 . 0 0 "[ . 1 . 2]" 1
866 1 34 LEU MD1 1 35 VAL H 3.210 . 4.620 2.419 2.264 2.653 . 0 0 "[ . 1 . 2]" 1
867 1 34 LEU MD1 1 105 PHE QE 3.650 . 5.500 3.951 3.732 4.143 . 0 0 "[ . 1 . 2]" 1
868 1 34 LEU MD2 1 35 VAL H 3.210 . 4.620 4.411 4.302 4.546 . 0 0 "[ . 1 . 2]" 1
869 1 34 LEU MD2 1 105 PHE QE 3.650 . 5.500 3.634 3.471 3.763 . 0 0 "[ . 1 . 2]" 1
870 1 34 LEU HG 1 35 VAL H 3.250 . 4.700 4.081 3.976 4.189 . 0 0 "[ . 1 . 2]" 1
871 1 34 LEU HG 1 57 HIS HE1 3.650 . 5.500 5.286 4.993 5.440 . 0 0 "[ . 1 . 2]" 1
872 1 34 LEU HG 1 105 PHE QD 3.620 . 5.440 4.499 4.362 4.639 . 0 0 "[ . 1 . 2]" 1
873 1 35 VAL H 1 35 VAL HB 2.865 . 3.930 2.941 2.761 3.025 . 0 0 "[ . 1 . 2]" 1
874 1 35 VAL H 1 35 VAL QG 2.480 . 3.160 2.598 2.499 2.666 . 0 0 "[ . 1 . 2]" 1
875 1 35 VAL H 1 105 PHE HB3 3.650 . 5.500 5.553 5.522 5.585 0.085 19 0 "[ . 1 . 2]" 1
876 1 35 VAL H 1 105 PHE QD 2.990 . 4.180 4.123 3.947 4.217 0.037 8 0 "[ . 1 . 2]" 1
877 1 35 VAL H 1 105 PHE QE 3.075 . 4.350 4.034 3.839 4.130 . 0 0 "[ . 1 . 2]" 1
878 1 35 VAL HA 1 35 VAL MG1 2.515 . 3.230 2.187 2.080 2.311 . 0 0 "[ . 1 . 2]" 1
879 1 35 VAL HA 1 35 VAL QG 2.305 . 2.810 2.051 1.983 2.098 . 0 0 "[ . 1 . 2]" 1
880 1 35 VAL HA 1 35 VAL MG2 2.515 . 3.230 2.487 2.402 2.549 . 0 0 "[ . 1 . 2]" 1
881 1 35 VAL HA 1 36 ARG H 2.315 . 2.830 2.257 2.161 2.309 . 0 0 "[ . 1 . 2]" 1
882 1 35 VAL HA 1 36 ARG QG 3.025 . 4.250 3.700 2.924 4.277 0.027 11 0 "[ . 1 . 2]" 1
883 1 35 VAL HB 1 36 ARG H 3.295 . 4.790 3.770 3.681 3.906 . 0 0 "[ . 1 . 2]" 1
884 1 35 VAL HB 1 78 LEU QD 3.305 . 4.810 4.061 3.875 4.412 . 0 0 "[ . 1 . 2]" 1
885 1 35 VAL QG 1 36 ARG H 2.415 . 3.030 2.158 1.908 2.400 . 0 0 "[ . 1 . 2]" 1
886 1 35 VAL QG 1 36 ARG HA 3.620 . 5.440 3.839 3.597 3.978 . 0 0 "[ . 1 . 2]" 1
887 1 35 VAL QG 1 60 ILE MD 2.540 . 3.280 2.596 2.359 3.159 . 0 0 "[ . 1 . 2]" 1
888 1 35 VAL QG 1 78 LEU QD 2.155 . 2.510 2.191 2.056 2.327 . 0 0 "[ . 1 . 2]" 1
889 1 35 VAL QG 1 78 LEU HG 2.550 . 3.300 2.699 2.353 2.893 . 0 0 "[ . 1 . 2]" 1
890 1 35 VAL QG 1 82 VAL HA 3.620 . 5.440 5.029 4.774 5.246 . 0 0 "[ . 1 . 2]" 1
891 1 35 VAL QG 1 82 VAL HB 3.370 . 4.940 4.775 4.624 5.063 0.123 4 0 "[ . 1 . 2]" 1
892 1 35 VAL QG 1 82 VAL QG 2.375 . 2.950 2.492 2.348 2.719 . 0 0 "[ . 1 . 2]" 1
893 1 35 VAL QG 1 101 LEU MD1 3.255 . 4.710 4.129 3.961 4.365 . 0 0 "[ . 1 . 2]" 1
894 1 35 VAL QG 1 104 PRO QB 3.620 . 5.440 5.497 5.421 5.563 0.123 7 0 "[ . 1 . 2]" 1
895 1 35 VAL MG1 1 36 ARG H 3.140 . 4.480 2.167 1.911 2.415 . 0 0 "[ . 1 . 2]" 1
896 1 35 VAL MG2 1 36 ARG H 3.140 . 4.480 4.098 3.989 4.179 . 0 0 "[ . 1 . 2]" 1
897 1 36 ARG H 1 36 ARG QB 2.645 . 3.490 3.026 2.692 3.262 . 0 0 "[ . 1 . 2]" 1
898 1 36 ARG H 1 36 ARG HD2 3.495 . 5.190 4.416 2.992 4.991 . 0 0 "[ . 1 . 2]" 1
899 1 36 ARG H 1 36 ARG QD 3.130 . 4.460 3.750 1.974 4.374 . 0 0 "[ . 1 . 2]" 1
900 1 36 ARG H 1 36 ARG HD3 3.495 . 5.190 4.153 2.002 4.967 . 0 0 "[ . 1 . 2]" 1
901 1 36 ARG H 1 36 ARG HG2 2.630 . 3.460 3.170 2.108 3.717 0.257 18 0 "[ . 1 . 2]" 1
902 1 36 ARG H 1 36 ARG QG 2.365 . 2.930 2.192 1.785 2.429 0.015 13 0 "[ . 1 . 2]" 1
903 1 36 ARG H 1 36 ARG HG3 2.630 . 3.460 2.378 1.794 3.675 0.215 3 0 "[ . 1 . 2]" 1
904 1 36 ARG H 1 37 GLN H 3.275 . 4.750 4.463 4.332 4.535 . 0 0 "[ . 1 . 2]" 1
905 1 36 ARG H 1 78 LEU QD 3.620 . 5.440 5.488 5.288 5.608 0.168 1 0 "[ . 1 . 2]" 1
906 1 36 ARG HA 1 37 GLN H 2.575 . 3.350 2.333 2.157 2.378 . 0 0 "[ . 1 . 2]" 1
907 1 50 LYS H 1 50 LYS HB2 2.365 . 2.930 2.699 2.621 2.797 . 0 0 "[ . 1 . 2]" 1
908 1 50 LYS H 1 50 LYS HB3 2.475 . 3.150 2.404 2.294 2.484 . 0 0 "[ . 1 . 2]" 1
909 1 50 LYS H 1 50 LYS HG3 3.250 . 4.700 4.334 4.233 4.406 . 0 0 "[ . 1 . 2]" 1
910 1 50 LYS H 1 51 TYR H 3.210 . 4.620 4.489 4.423 4.552 . 0 0 "[ . 1 . 2]" 1
911 1 50 LYS H 1 51 TYR HB2 3.645 . 5.490 5.093 4.997 5.177 . 0 0 "[ . 1 . 2]" 1
912 1 50 LYS H 1 55 VAL HA 3.250 . 4.700 4.459 4.377 4.540 . 0 0 "[ . 1 . 2]" 1
913 1 50 LYS H 1 55 VAL QG 2.990 . 4.180 3.609 3.361 3.846 . 0 0 "[ . 1 . 2]" 1
914 1 50 LYS HA 1 50 LYS HD2 2.885 . 3.970 2.240 2.026 2.492 . 0 0 "[ . 1 . 2]" 1
915 1 50 LYS HA 1 50 LYS HD3 2.855 . 3.910 3.151 2.678 3.695 . 0 0 "[ . 1 . 2]" 1
916 1 50 LYS HA 1 51 TYR H 2.210 . 2.620 2.163 2.147 2.184 . 0 0 "[ . 1 . 2]" 1
917 1 50 LYS HA 1 55 VAL HA 2.630 . 3.460 2.213 2.042 2.392 . 0 0 "[ . 1 . 2]" 1
918 1 50 LYS HA 1 55 VAL QG 2.695 . 3.590 2.381 1.888 2.755 . 0 0 "[ . 1 . 2]" 1
919 1 50 LYS HA 1 56 LYS H 2.890 . 3.980 3.634 3.471 3.784 . 0 0 "[ . 1 . 2]" 1
920 1 50 LYS HB2 1 51 TYR H 3.155 . 4.510 4.306 4.233 4.404 . 0 0 "[ . 1 . 2]" 1
921 1 50 LYS HB3 1 50 LYS QE 3.335 . 4.870 4.466 4.363 4.557 . 0 0 "[ . 1 . 2]" 1
922 1 50 LYS HB3 1 51 TYR H 3.095 . 4.390 4.323 4.199 4.391 0.001 9 0 "[ . 1 . 2]" 1
923 1 50 LYS HB3 1 55 VAL QG 3.620 . 5.440 4.239 3.886 4.630 . 0 0 "[ . 1 . 2]" 1
924 1 50 LYS HD2 1 51 TYR H 2.510 . 3.220 2.850 2.585 3.073 . 0 0 "[ . 1 . 2]" 1
925 1 50 LYS HD2 1 54 GLU H 2.920 . 4.040 3.412 2.667 4.099 0.059 16 0 "[ . 1 . 2]" 1
926 1 50 LYS HD2 1 54 GLU HA 3.285 . 4.770 3.891 3.446 4.353 . 0 0 "[ . 1 . 2]" 1
927 1 50 LYS HD2 1 55 VAL QG 2.685 . 3.570 2.362 1.874 2.852 . 0 0 "[ . 1 . 2]" 1
928 1 50 LYS HD3 1 51 TYR H 3.370 . 4.940 4.339 3.951 4.657 . 0 0 "[ . 1 . 2]" 1
929 1 50 LYS HD3 1 55 VAL QG 2.845 . 3.890 2.759 2.437 3.251 . 0 0 "[ . 1 . 2]" 1
930 1 50 LYS QE 1 51 TYR H 3.075 . 4.350 4.023 3.235 4.373 0.023 12 0 "[ . 1 . 2]" 1
931 1 50 LYS QE 1 53 VAL MG2 3.075 . 4.350 4.160 4.020 4.306 . 0 0 "[ . 1 . 2]" 1
932 1 50 LYS QE 1 54 GLU QB 3.380 . 4.960 4.627 4.066 4.895 . 0 0 "[ . 1 . 2]" 1
933 1 50 LYS QE 1 55 VAL QG 2.850 . 3.900 3.412 2.977 3.692 . 0 0 "[ . 1 . 2]" 1
934 1 50 LYS HE2 1 50 LYS HG3 2.790 . 3.780 2.926 2.422 3.562 . 0 0 "[ . 1 . 2]" 1
935 1 50 LYS HE2 1 53 VAL H 3.120 . 4.440 3.423 2.950 4.093 . 0 0 "[ . 1 . 2]" 1
936 1 50 LYS HE2 1 53 VAL HA 2.765 . 3.730 2.240 1.978 2.695 . 0 0 "[ . 1 . 2]" 1
937 1 50 LYS HE2 1 53 VAL MG2 3.445 . 5.090 4.674 4.349 4.921 . 0 0 "[ . 1 . 2]" 1
938 1 50 LYS HE2 1 54 GLU H 2.680 . 3.560 3.291 2.292 3.652 0.092 17 0 "[ . 1 . 2]" 1
939 1 50 LYS HE3 1 50 LYS HG3 2.790 . 3.780 3.352 2.706 3.736 . 0 0 "[ . 1 . 2]" 1
940 1 50 LYS HE3 1 53 VAL H 3.120 . 4.440 3.879 3.200 4.438 . 0 0 "[ . 1 . 2]" 1
941 1 50 LYS HE3 1 53 VAL HA 2.765 . 3.730 2.386 2.081 2.799 . 0 0 "[ . 1 . 2]" 1
942 1 50 LYS HE3 1 53 VAL MG2 3.445 . 5.090 4.728 4.345 5.083 . 0 0 "[ . 1 . 2]" 1
943 1 50 LYS HE3 1 54 GLU H 2.680 . 3.560 3.583 3.367 3.746 0.186 15 0 "[ . 1 . 2]" 1
944 1 50 LYS HG3 1 51 TYR HA 3.140 . 4.480 3.542 3.432 3.744 . 0 0 "[ . 1 . 2]" 1
945 1 50 LYS HG3 1 52 ASN H 3.230 . 4.660 4.251 3.976 4.479 . 0 0 "[ . 1 . 2]" 1
946 1 50 LYS HG3 1 54 GLU H 3.030 . 4.260 3.948 3.587 4.316 0.056 4 0 "[ . 1 . 2]" 1
947 1 51 TYR H 1 51 TYR HB2 2.625 . 3.450 2.935 2.893 3.028 . 0 0 "[ . 1 . 2]" 1
948 1 51 TYR H 1 51 TYR HB3 2.610 . 3.420 3.108 2.989 3.274 . 0 0 "[ . 1 . 2]" 1
949 1 51 TYR H 1 51 TYR QD 3.195 . 4.590 4.398 4.366 4.421 . 0 0 "[ . 1 . 2]" 1
950 1 51 TYR H 1 52 ASN H 3.000 . 4.200 4.172 4.075 4.258 0.058 4 0 "[ . 1 . 2]" 1
951 1 51 TYR H 1 53 VAL H 3.420 . 5.040 4.871 4.720 5.008 . 0 0 "[ . 1 . 2]" 1
952 1 51 TYR H 1 53 VAL HA 3.585 . 5.370 5.378 5.275 5.473 0.103 4 0 "[ . 1 . 2]" 1
953 1 51 TYR H 1 54 GLU H 2.630 . 3.460 3.077 2.948 3.224 . 0 0 "[ . 1 . 2]" 1
954 1 51 TYR H 1 54 GLU QB 3.195 . 4.590 3.816 3.711 3.935 . 0 0 "[ . 1 . 2]" 1
955 1 51 TYR H 1 55 VAL H 3.390 . 4.980 4.278 4.102 4.390 . 0 0 "[ . 1 . 2]" 1
956 1 51 TYR H 1 55 VAL HA 2.860 . 3.920 2.615 2.316 2.843 . 0 0 "[ . 1 . 2]" 1
957 1 51 TYR H 1 55 VAL MG1 3.360 . 4.920 4.383 4.181 4.598 . 0 0 "[ . 1 . 2]" 1
958 1 51 TYR H 1 55 VAL QG 2.985 . 4.170 3.453 3.099 3.714 . 0 0 "[ . 1 . 2]" 1
959 1 51 TYR H 1 55 VAL MG2 3.360 . 4.920 3.624 3.193 3.980 . 0 0 "[ . 1 . 2]" 1
960 1 51 TYR H 1 56 LYS H 3.060 . 4.320 3.905 3.634 4.078 . 0 0 "[ . 1 . 2]" 1
961 1 51 TYR HA 1 51 TYR QD 2.410 . 3.020 2.668 2.231 3.014 . 0 0 "[ . 1 . 2]" 1
962 1 51 TYR HA 1 52 ASN H 2.260 . 2.720 2.156 2.135 2.185 . 0 0 "[ . 1 . 2]" 1
963 1 51 TYR HA 1 52 ASN HA 3.100 . 4.400 4.397 4.375 4.423 0.023 15 0 "[ . 1 . 2]" 1
964 1 51 TYR HB2 1 97 LEU MD1 3.340 . 4.880 3.880 3.720 4.035 . 0 0 "[ . 1 . 2]" 1
965 1 51 TYR HB2 1 97 LEU QD 3.015 . 4.230 2.759 2.410 3.043 . 0 0 "[ . 1 . 2]" 1
966 1 51 TYR HB2 1 97 LEU MD2 3.340 . 4.880 2.826 2.437 3.165 . 0 0 "[ . 1 . 2]" 1
967 1 51 TYR HB2 1 98 ASP H 3.650 . 5.500 5.495 5.212 5.565 0.065 8 0 "[ . 1 . 2]" 1
968 1 51 TYR HB2 1 99 THR MG 3.150 . 4.500 4.043 3.918 4.275 . 0 0 "[ . 1 . 2]" 1
969 1 51 TYR HB3 1 52 ASN H 3.015 . 4.230 3.983 3.840 4.118 . 0 0 "[ . 1 . 2]" 1
970 1 51 TYR HB3 1 97 LEU QD 2.995 . 4.190 3.540 3.266 3.828 . 0 0 "[ . 1 . 2]" 1
971 1 51 TYR HB3 1 99 THR MG 3.650 . 5.500 5.163 5.029 5.419 . 0 0 "[ . 1 . 2]" 1
972 1 51 TYR QD 1 52 ASN H 2.665 . 3.530 2.405 1.981 3.337 . 0 0 "[ . 1 . 2]" 1
973 1 51 TYR QD 1 52 ASN HA 3.255 . 4.710 3.741 3.524 4.412 . 0 0 "[ . 1 . 2]" 1
974 1 51 TYR QD 1 52 ASN QB 2.615 . 3.430 2.549 1.946 3.101 . 0 0 "[ . 1 . 2]" 1
975 1 51 TYR QD 1 56 LYS HD3 3.650 . 5.500 5.580 5.518 5.649 0.149 16 0 "[ . 1 . 2]" 1
976 1 51 TYR QD 1 56 LYS QE 2.865 . 3.930 3.469 3.148 3.862 . 0 0 "[ . 1 . 2]" 1
977 1 51 TYR QD 1 97 LEU MD1 2.895 . 3.990 2.032 1.930 2.152 . 0 0 "[ . 1 . 2]" 1
978 1 51 TYR QD 1 97 LEU QD 2.625 . 3.450 1.845 1.734 1.995 0.066 18 0 "[ . 1 . 2]" 1
979 1 51 TYR QD 1 97 LEU MD2 2.895 . 3.990 2.127 1.947 2.390 . 0 0 "[ . 1 . 2]" 1
980 1 51 TYR QD 1 99 THR H 3.460 . 5.120 4.870 4.741 4.999 . 0 0 "[ . 1 . 2]" 1
981 1 51 TYR QD 1 99 THR MG 2.450 . 3.100 2.381 2.120 2.632 . 0 0 "[ . 1 . 2]" 1
982 1 51 TYR QE 1 52 ASN H 3.180 . 4.560 4.098 3.831 4.473 . 0 0 "[ . 1 . 2]" 1
983 1 51 TYR QE 1 52 ASN QB 3.260 . 4.720 4.006 2.791 4.722 0.002 20 0 "[ . 1 . 2]" 1
984 1 51 TYR QE 1 97 LEU HA 2.850 . 3.900 3.207 3.007 3.513 . 0 0 "[ . 1 . 2]" 1
985 1 51 TYR QE 1 97 LEU QD 2.650 . 3.500 1.929 1.858 2.006 . 0 0 "[ . 1 . 2]" 1
986 1 51 TYR QE 1 97 LEU HG 3.310 . 4.820 4.919 4.857 4.980 0.160 15 0 "[ . 1 . 2]" 1
987 1 51 TYR QE 1 98 ASP H 2.530 . 3.260 1.944 1.794 2.213 0.006 14 0 "[ . 1 . 2]" 1
988 1 51 TYR QE 1 98 ASP QB 2.770 . 3.740 3.303 3.140 3.456 . 0 0 "[ . 1 . 2]" 1
989 1 51 TYR QE 1 99 THR H 3.040 . 4.280 3.167 3.032 3.350 . 0 0 "[ . 1 . 2]" 1
990 1 51 TYR QE 1 99 THR HB 2.330 . 2.860 2.537 2.354 2.808 . 0 0 "[ . 1 . 2]" 1
991 1 51 TYR QE 1 99 THR MG 2.540 . 3.280 2.174 1.947 2.389 . 0 0 "[ . 1 . 2]" 1
992 1 52 ASN H 1 52 ASN HA 2.220 . 2.640 2.306 2.293 2.319 . 0 0 "[ . 1 . 2]" 1
993 1 52 ASN H 1 52 ASN HB2 2.955 . 4.110 3.193 2.870 3.410 . 0 0 "[ . 1 . 2]" 1
994 1 52 ASN H 1 52 ASN QB 2.590 . 3.380 3.049 2.774 3.251 . 0 0 "[ . 1 . 2]" 1
995 1 52 ASN H 1 52 ASN HB3 2.955 . 4.110 3.874 3.463 4.106 . 0 0 "[ . 1 . 2]" 1
996 1 52 ASN H 1 53 VAL H 2.715 . 3.630 3.110 2.767 3.271 . 0 0 "[ . 1 . 2]" 1
997 1 52 ASN H 1 53 VAL HA 3.535 . 5.270 5.200 4.894 5.326 0.056 16 0 "[ . 1 . 2]" 1
998 1 52 ASN H 1 53 VAL MG1 3.420 . 5.040 4.736 4.400 4.882 . 0 0 "[ . 1 . 2]" 1
999 1 52 ASN H 1 54 GLU H 3.050 . 4.300 3.887 3.776 3.959 . 0 0 "[ . 1 . 2]" 1
1000 1 52 ASN HA 1 53 VAL H 2.565 . 3.330 2.461 2.386 2.580 . 0 0 "[ . 1 . 2]" 1
1001 1 52 ASN HA 1 53 VAL HA 3.310 . 4.820 4.614 4.551 4.696 . 0 0 "[ . 1 . 2]" 1
1002 1 52 ASN HA 1 53 VAL MG1 2.665 . 3.530 3.211 3.038 3.394 . 0 0 "[ . 1 . 2]" 1
1003 1 52 ASN HA 1 53 VAL MG2 2.940 . 4.080 3.742 3.591 3.996 . 0 0 "[ . 1 . 2]" 1
1004 1 52 ASN HA 1 54 GLU H 3.135 . 4.470 3.980 3.867 4.072 . 0 0 "[ . 1 . 2]" 1
1005 1 52 ASN QB 1 53 VAL H 2.965 . 4.130 3.958 3.892 4.057 . 0 0 "[ . 1 . 2]" 1
1006 1 52 ASN QB 1 53 VAL MG1 3.115 . 4.430 4.206 3.941 4.486 0.056 8 0 "[ . 1 . 2]" 1
1007 1 52 ASN QB 1 53 VAL MG2 2.875 . 3.950 3.433 3.107 3.958 0.008 18 0 "[ . 1 . 2]" 1
1008 1 52 ASN QB 1 54 GLU H 2.960 . 4.120 3.621 3.469 3.783 . 0 0 "[ . 1 . 2]" 1
1009 1 52 ASN HB2 1 53 VAL H 3.290 . 4.780 4.578 4.474 4.665 . 0 0 "[ . 1 . 2]" 1
1010 1 52 ASN HB2 1 54 GLU H 3.245 . 4.690 4.301 3.761 4.804 0.114 16 0 "[ . 1 . 2]" 1
1011 1 52 ASN HB3 1 53 VAL H 3.290 . 4.780 4.331 4.243 4.467 . 0 0 "[ . 1 . 2]" 1
1012 1 52 ASN HB3 1 54 GLU H 3.245 . 4.690 4.065 3.570 4.589 . 0 0 "[ . 1 . 2]" 1
1013 1 53 VAL H 1 54 GLU H 2.375 . 2.950 2.837 2.741 2.885 . 0 0 "[ . 1 . 2]" 1
1014 1 53 VAL HA 1 53 VAL MG1 2.485 . 3.170 2.451 2.367 2.561 . 0 0 "[ . 1 . 2]" 1
1015 1 53 VAL HA 1 53 VAL MG2 2.520 . 3.240 3.196 3.177 3.205 . 0 0 "[ . 1 . 2]" 1
1016 1 53 VAL HA 1 54 GLU H 2.375 . 2.950 3.036 2.957 3.114 0.164 4 0 "[ . 1 . 2]" 1
1017 1 53 VAL HB 1 54 GLU H 3.225 . 4.650 4.502 4.448 4.568 . 0 0 "[ . 1 . 2]" 1
1018 1 53 VAL MG1 1 54 GLU H 3.180 . 4.560 4.145 4.058 4.235 . 0 0 "[ . 1 . 2]" 1
1019 1 53 VAL MG2 1 54 GLU H 2.810 . 3.820 3.353 3.182 3.480 . 0 0 "[ . 1 . 2]" 1
1020 1 53 VAL MG2 1 54 GLU HA 2.995 . 4.190 3.852 3.737 3.963 . 0 0 "[ . 1 . 2]" 1
1021 1 53 VAL MG2 1 54 GLU QB 3.260 . 4.720 3.397 3.131 3.672 . 0 0 "[ . 1 . 2]" 1
1022 1 53 VAL MG2 1 54 GLU QG 2.975 . 4.150 2.789 2.305 3.112 . 0 0 "[ . 1 . 2]" 1
1023 1 54 GLU H 1 54 GLU QB 2.345 . 2.890 2.532 2.461 2.572 . 0 0 "[ . 1 . 2]" 1
1024 1 54 GLU H 1 54 GLU QG 2.690 . 3.580 3.659 3.328 3.792 0.212 6 0 "[ . 1 . 2]" 1
1025 1 54 GLU H 1 55 VAL H 3.150 . 4.500 4.423 4.381 4.452 . 0 0 "[ . 1 . 2]" 1
1026 1 54 GLU HA 1 54 GLU QG 2.495 . 3.190 2.230 2.118 2.348 . 0 0 "[ . 1 . 2]" 1
1027 1 54 GLU HA 1 55 VAL H 2.250 . 2.700 2.489 2.380 2.635 . 0 0 "[ . 1 . 2]" 1
1028 1 54 GLU HA 1 55 VAL QG 2.750 . 3.700 3.287 3.137 3.442 . 0 0 "[ . 1 . 2]" 1
1029 1 54 GLU QB 1 55 VAL H 2.825 . 3.850 2.413 2.091 2.649 . 0 0 "[ . 1 . 2]" 1
1030 1 54 GLU QB 1 55 VAL QG 3.040 . 4.280 4.086 4.027 4.154 . 0 0 "[ . 1 . 2]" 1
1031 1 54 GLU QG 1 55 VAL H 3.035 . 4.270 3.615 3.452 3.714 . 0 0 "[ . 1 . 2]" 1
1032 1 54 GLU QG 1 55 VAL QG 3.620 . 5.440 4.729 4.599 4.880 . 0 0 "[ . 1 . 2]" 1
1033 1 55 VAL H 1 55 VAL HB 2.390 . 2.980 2.647 2.559 2.763 . 0 0 "[ . 1 . 2]" 1
1034 1 55 VAL H 1 55 VAL MG1 2.870 . 3.940 3.846 3.790 3.882 . 0 0 "[ . 1 . 2]" 1
1035 1 55 VAL H 1 55 VAL QG 2.400 . 3.000 2.684 2.454 2.929 . 0 0 "[ . 1 . 2]" 1
1036 1 55 VAL H 1 55 VAL MG2 2.870 . 3.940 2.745 2.482 3.047 . 0 0 "[ . 1 . 2]" 1
1037 1 55 VAL H 1 56 LYS H 3.185 . 4.570 4.467 4.418 4.511 . 0 0 "[ . 1 . 2]" 1
1038 1 55 VAL HA 1 55 VAL MG1 2.560 . 3.320 2.324 2.158 2.476 . 0 0 "[ . 1 . 2]" 1
1039 1 55 VAL HA 1 55 VAL QG 2.345 . 2.890 2.069 2.013 2.126 . 0 0 "[ . 1 . 2]" 1
1040 1 55 VAL HA 1 55 VAL MG2 2.560 . 3.320 2.334 2.221 2.434 . 0 0 "[ . 1 . 2]" 1
1041 1 55 VAL HA 1 56 LYS H 2.165 . 2.530 2.190 2.137 2.245 . 0 0 "[ . 1 . 2]" 1
1042 1 55 VAL HA 1 56 LYS HB2 3.080 . 4.360 4.186 4.052 4.364 0.004 11 0 "[ . 1 . 2]" 1
1043 1 55 VAL HA 1 56 LYS HB3 3.650 . 5.500 4.988 4.863 5.130 . 0 0 "[ . 1 . 2]" 1
1044 1 55 VAL HB 1 56 LYS H 3.110 . 4.420 4.013 3.900 4.103 . 0 0 "[ . 1 . 2]" 1
1045 1 55 VAL HB 1 57 HIS HD2 2.975 . 4.150 3.948 3.432 4.243 0.093 16 0 "[ . 1 . 2]" 1
1046 1 55 VAL HB 1 57 HIS HE1 3.650 . 5.500 3.894 3.403 4.428 . 0 0 "[ . 1 . 2]" 1
1047 1 55 VAL QG 1 56 LYS H 2.365 . 2.930 2.316 2.079 2.591 . 0 0 "[ . 1 . 2]" 1
1048 1 55 VAL QG 1 56 LYS HA 3.170 . 4.540 3.660 3.459 3.948 . 0 0 "[ . 1 . 2]" 1
1049 1 55 VAL QG 1 56 LYS HB2 3.155 . 4.510 4.374 4.205 4.546 0.036 11 0 "[ . 1 . 2]" 1
1050 1 55 VAL QG 1 56 LYS HB3 3.215 . 4.630 4.392 4.247 4.598 . 0 0 "[ . 1 . 2]" 1
1051 1 55 VAL QG 1 57 HIS HD2 3.115 . 4.430 3.320 2.872 3.772 . 0 0 "[ . 1 . 2]" 1
1052 1 55 VAL QG 1 57 HIS HE1 2.370 . 2.940 2.377 2.113 2.771 . 0 0 "[ . 1 . 2]" 1
1053 1 56 LYS H 1 56 LYS HB2 2.385 . 2.970 2.652 2.512 2.794 . 0 0 "[ . 1 . 2]" 1
1054 1 56 LYS H 1 56 LYS HB3 2.535 . 3.270 2.924 2.792 3.060 . 0 0 "[ . 1 . 2]" 1
1055 1 56 LYS H 1 57 HIS H 3.505 . 5.210 4.290 4.184 4.507 . 0 0 "[ . 1 . 2]" 1
1056 1 56 LYS H 1 97 LEU QD 3.195 . 4.590 3.751 3.591 3.935 . 0 0 "[ . 1 . 2]" 1
1057 1 56 LYS HA 1 56 LYS HD2 3.250 . 4.700 4.479 4.416 4.574 . 0 0 "[ . 1 . 2]" 1
1058 1 56 LYS HA 1 56 LYS HD3 3.245 . 4.690 4.434 4.370 4.546 . 0 0 "[ . 1 . 2]" 1
1059 1 56 LYS HA 1 56 LYS QE 3.025 . 4.250 3.472 2.854 4.129 . 0 0 "[ . 1 . 2]" 1
1060 1 56 LYS HA 1 56 LYS HG3 2.275 . 2.750 2.084 2.013 2.166 . 0 0 "[ . 1 . 2]" 1
1061 1 56 LYS HA 1 57 HIS H 2.535 . 3.270 2.166 2.137 2.220 . 0 0 "[ . 1 . 2]" 1
1062 1 56 LYS HA 1 57 HIS HD2 2.990 . 4.180 3.654 3.171 4.049 . 0 0 "[ . 1 . 2]" 1
1063 1 56 LYS HB2 1 56 LYS QE 3.165 . 4.530 1.999 1.861 2.271 . 0 0 "[ . 1 . 2]" 1
1064 1 56 LYS HB2 1 57 HIS H 3.245 . 4.690 4.528 4.345 4.590 . 0 0 "[ . 1 . 2]" 1
1065 1 56 LYS HB2 1 97 LEU MD1 3.650 . 5.500 4.659 4.472 4.842 . 0 0 "[ . 1 . 2]" 1
1066 1 56 LYS HB2 1 97 LEU QD 3.165 . 4.530 2.373 2.144 2.603 . 0 0 "[ . 1 . 2]" 1
1067 1 56 LYS HB2 1 97 LEU MD2 3.650 . 5.500 2.380 2.148 2.614 . 0 0 "[ . 1 . 2]" 1
1068 1 56 LYS HB3 1 56 LYS QE 3.290 . 4.780 3.326 3.216 3.590 . 0 0 "[ . 1 . 2]" 1
1069 1 56 LYS HB3 1 57 HIS H 3.180 . 4.560 4.065 3.712 4.252 . 0 0 "[ . 1 . 2]" 1
1070 1 56 LYS HB3 1 57 HIS HA 3.605 . 5.410 4.527 4.341 4.677 . 0 0 "[ . 1 . 2]" 1
1071 1 56 LYS HB3 1 97 LEU QD 2.895 . 3.990 1.885 1.788 2.039 0.012 15 0 "[ . 1 . 2]" 1
1072 1 56 LYS HD2 1 56 LYS QE 2.290 . 2.780 2.210 2.166 2.284 . 0 0 "[ . 1 . 2]" 1
1073 1 56 LYS HD2 1 96 SER QB 3.650 . 5.500 4.353 3.535 4.630 . 0 0 "[ . 1 . 2]" 1
1074 1 56 LYS HD2 1 97 LEU H 2.930 . 4.060 2.941 2.619 3.506 . 0 0 "[ . 1 . 2]" 1
1075 1 56 LYS HD2 1 97 LEU MD1 3.070 . 4.340 3.810 3.574 3.965 . 0 0 "[ . 1 . 2]" 1
1076 1 56 LYS HD2 1 97 LEU QD 2.615 . 3.430 1.746 1.728 1.768 0.072 3 0 "[ . 1 . 2]" 1
1077 1 56 LYS HD2 1 97 LEU MD2 3.070 . 4.340 1.748 1.731 1.770 0.069 3 0 "[ . 1 . 2]" 1
1078 1 56 LYS HD2 1 97 LEU HG 2.885 . 3.970 3.937 3.764 4.043 0.073 1 0 "[ . 1 . 2]" 1
1079 1 56 LYS HD3 1 56 LYS QE 2.360 . 2.920 2.409 2.226 2.539 . 0 0 "[ . 1 . 2]" 1
1080 1 56 LYS HD3 1 95 LYS H 3.385 . 4.970 5.038 4.792 5.136 0.166 13 0 "[ . 1 . 2]" 1
1081 1 56 LYS HD3 1 97 LEU H 3.135 . 4.470 3.084 2.707 3.607 . 0 0 "[ . 1 . 2]" 1
1082 1 56 LYS HD3 1 97 LEU QD 3.165 . 4.530 3.132 3.056 3.171 . 0 0 "[ . 1 . 2]" 1
1083 1 56 LYS QE 1 56 LYS HG3 2.585 . 3.370 2.669 2.268 3.183 . 0 0 "[ . 1 . 2]" 1
1084 1 56 LYS QE 1 97 LEU H 3.265 . 4.730 4.203 3.606 4.748 0.018 18 0 "[ . 1 . 2]" 1
1085 1 56 LYS QE 1 97 LEU MD1 3.275 . 4.750 4.164 3.848 4.643 . 0 0 "[ . 1 . 2]" 1
1086 1 56 LYS QE 1 97 LEU QD 2.935 . 4.070 2.426 2.143 2.705 . 0 0 "[ . 1 . 2]" 1
1087 1 56 LYS QE 1 97 LEU MD2 3.275 . 4.750 2.443 2.152 2.740 . 0 0 "[ . 1 . 2]" 1
1088 1 56 LYS HG2 1 58 ILE MD 2.960 . 4.120 4.232 4.183 4.278 0.158 1 0 "[ . 1 . 2]" 1
1089 1 56 LYS HG2 1 94 PHE QD 2.655 . 3.510 2.943 2.706 3.373 . 0 0 "[ . 1 . 2]" 1
1090 1 56 LYS HG2 1 95 LYS H 3.610 . 5.420 5.457 5.190 5.560 0.140 11 0 "[ . 1 . 2]" 1
1091 1 56 LYS HG3 1 57 HIS H 3.315 . 4.830 3.294 2.901 3.554 . 0 0 "[ . 1 . 2]" 1
1092 1 56 LYS HG3 1 58 ILE MD 3.580 . 5.360 4.944 4.749 5.138 . 0 0 "[ . 1 . 2]" 1
1093 1 56 LYS HG3 1 97 LEU QD 3.620 . 5.440 3.563 3.400 3.688 . 0 0 "[ . 1 . 2]" 1
1094 1 57 HIS H 1 57 HIS HD2 2.625 . 3.450 2.614 2.502 2.831 . 0 0 "[ . 1 . 2]" 1
1095 1 57 HIS H 1 58 ILE H 3.195 . 4.590 4.181 4.059 4.272 . 0 0 "[ . 1 . 2]" 1
1096 1 57 HIS HA 1 57 HIS HD2 3.190 . 4.580 4.353 4.126 4.522 . 0 0 "[ . 1 . 2]" 1
1097 1 57 HIS HA 1 58 ILE H 2.355 . 2.910 2.187 2.155 2.212 . 0 0 "[ . 1 . 2]" 1
1098 1 57 HIS HA 1 58 ILE HB 3.180 . 4.560 4.385 4.242 4.484 . 0 0 "[ . 1 . 2]" 1
1099 1 57 HIS HA 1 58 ILE HG12 3.335 . 4.870 4.865 4.632 5.003 0.133 20 0 "[ . 1 . 2]" 1
1100 1 57 HIS HB2 1 57 HIS HD2 2.510 . 3.220 2.915 2.813 2.961 . 0 0 "[ . 1 . 2]" 1
1101 1 57 HIS HB3 1 58 ILE H 2.935 . 4.070 3.747 3.662 3.800 . 0 0 "[ . 1 . 2]" 1
1102 1 58 ILE H 1 58 ILE HB 2.560 . 3.320 2.344 2.272 2.419 . 0 0 "[ . 1 . 2]" 1
1103 1 58 ILE H 1 58 ILE MD 3.195 . 4.590 4.101 3.902 4.267 . 0 0 "[ . 1 . 2]" 1
1104 1 58 ILE H 1 58 ILE HG12 2.715 . 3.630 3.512 3.328 3.664 0.034 20 0 "[ . 1 . 2]" 1
1105 1 58 ILE H 1 58 ILE MG 2.835 . 3.870 3.519 3.372 3.615 . 0 0 "[ . 1 . 2]" 1
1106 1 58 ILE H 1 59 LYS H 3.150 . 4.500 4.470 4.413 4.520 0.020 16 0 "[ . 1 . 2]" 1
1107 1 58 ILE HA 1 58 ILE MD 2.995 . 4.190 1.931 1.763 2.018 0.037 18 0 "[ . 1 . 2]" 1
1108 1 58 ILE HA 1 58 ILE HG13 2.815 . 3.830 3.561 3.519 3.603 . 0 0 "[ . 1 . 2]" 1
1109 1 58 ILE HA 1 58 ILE MG 2.560 . 3.320 2.698 2.622 2.813 . 0 0 "[ . 1 . 2]" 1
1110 1 58 ILE HA 1 59 LYS H 2.490 . 3.180 2.201 2.156 2.252 . 0 0 "[ . 1 . 2]" 1
1111 1 58 ILE HA 1 95 LYS QE 3.650 . 5.500 5.607 5.167 5.754 0.254 8 0 "[ . 1 . 2]" 1
1112 1 58 ILE HB 1 58 ILE MD 2.860 . 3.920 3.188 3.177 3.199 . 0 0 "[ . 1 . 2]" 1
1113 1 58 ILE MD 1 58 ILE MG 2.275 . 2.750 1.888 1.787 2.080 0.013 13 0 "[ . 1 . 2]" 1
1114 1 58 ILE MD 1 59 LYS H 3.335 . 4.870 2.546 2.198 2.859 . 0 0 "[ . 1 . 2]" 1
1115 1 58 ILE MD 1 94 PHE HA 3.255 . 4.710 4.050 3.583 4.466 . 0 0 "[ . 1 . 2]" 1
1116 1 58 ILE MD 1 94 PHE QD 3.005 . 4.210 4.155 3.917 4.259 0.049 6 0 "[ . 1 . 2]" 1
1117 1 58 ILE MD 1 94 PHE QE 3.195 . 4.590 4.402 4.168 4.626 0.036 11 0 "[ . 1 . 2]" 1
1118 1 58 ILE HG12 1 95 LYS QD 3.565 . 5.330 5.444 5.265 5.571 0.241 14 0 "[ . 1 . 2]" 1
1119 1 58 ILE HG13 1 94 PHE QD 2.675 . 3.550 2.826 2.311 3.362 . 0 0 "[ . 1 . 2]" 1
1120 1 58 ILE HG13 1 95 LYS QE 3.275 . 4.750 3.766 2.352 4.423 . 0 0 "[ . 1 . 2]" 1
1121 1 58 ILE MG 1 59 LYS H 2.550 . 3.300 2.511 2.159 2.688 . 0 0 "[ . 1 . 2]" 1
1122 1 58 ILE MG 1 69 ILE HA 3.150 . 4.500 2.709 2.512 3.000 . 0 0 "[ . 1 . 2]" 1
1123 1 58 ILE MG 1 69 ILE HB 2.650 . 3.500 1.986 1.848 2.134 . 0 0 "[ . 1 . 2]" 1
1124 1 58 ILE MG 1 94 PHE HA 3.090 . 4.380 3.419 2.990 3.725 . 0 0 "[ . 1 . 2]" 1
1125 1 58 ILE MG 1 94 PHE QD 3.125 . 4.450 3.775 3.268 4.069 . 0 0 "[ . 1 . 2]" 1
1126 1 58 ILE MG 1 94 PHE QE 2.940 . 4.080 3.450 2.999 3.711 . 0 0 "[ . 1 . 2]" 1
1127 1 58 ILE MG 1 95 LYS QE 2.975 . 4.150 3.475 2.926 4.048 . 0 0 "[ . 1 . 2]" 1
1128 1 60 ILE HA 1 60 ILE MD 2.905 . 4.010 3.762 3.685 3.803 . 0 0 "[ . 1 . 2]" 1
1129 1 60 ILE HA 1 60 ILE MG 2.490 . 3.180 2.464 2.362 2.580 . 0 0 "[ . 1 . 2]" 1
1130 1 60 ILE HA 1 61 MET HB2 3.085 . 4.370 4.148 4.042 4.357 . 0 0 "[ . 1 . 2]" 1
1131 1 60 ILE HA 1 61 MET HB3 3.650 . 5.500 5.101 4.943 5.261 . 0 0 "[ . 1 . 2]" 1
1132 1 60 ILE HA 1 68 ARG H 3.120 . 4.440 3.785 3.523 3.940 . 0 0 "[ . 1 . 2]" 1
1133 1 60 ILE HA 1 69 ILE MG 2.570 . 3.340 3.246 3.052 3.434 0.094 1 0 "[ . 1 . 2]" 1
1134 1 60 ILE HB 1 60 ILE MD 2.575 . 3.350 2.302 2.172 2.420 . 0 0 "[ . 1 . 2]" 1
1135 1 60 ILE HB 1 67 TYR QD 3.285 . 4.770 4.280 4.064 4.683 . 0 0 "[ . 1 . 2]" 1
1136 1 60 ILE HB 1 78 LEU QD 3.340 . 4.880 3.652 3.419 3.831 . 0 0 "[ . 1 . 2]" 1
1137 1 60 ILE MD 1 60 ILE MG 2.290 . 2.780 1.897 1.753 2.143 0.047 13 0 "[ . 1 . 2]" 1
1138 1 60 ILE MD 1 67 TYR QD 2.785 . 3.770 3.529 3.228 3.780 0.010 16 0 "[ . 1 . 2]" 1
1139 1 60 ILE MD 1 68 ARG H 3.200 . 4.600 4.508 4.218 4.675 0.075 12 0 "[ . 1 . 2]" 1
1140 1 60 ILE MD 1 69 ILE MD 3.220 . 4.640 3.456 2.767 4.041 . 0 0 "[ . 1 . 2]" 1
1141 1 60 ILE MD 1 69 ILE MG 2.805 . 3.810 2.834 2.463 3.075 . 0 0 "[ . 1 . 2]" 1
1142 1 60 ILE MD 1 78 LEU MD1 2.705 . 3.610 1.829 1.771 1.937 0.029 11 0 "[ . 1 . 2]" 1
1143 1 60 ILE MD 1 78 LEU QD 2.325 . 2.850 1.714 1.663 1.747 0.137 8 0 "[ . 1 . 2]" 1
1144 1 60 ILE MD 1 78 LEU MD2 2.705 . 3.610 2.085 1.939 2.219 . 0 0 "[ . 1 . 2]" 1
1145 1 60 ILE MD 1 81 LEU MD1 2.670 . 3.540 3.203 2.286 3.534 . 0 0 "[ . 1 . 2]" 1
1146 1 60 ILE MD 1 81 LEU MD2 3.465 . 5.130 5.033 4.338 5.156 0.026 14 0 "[ . 1 . 2]" 1
1147 1 60 ILE MD 1 81 LEU HG 3.040 . 4.280 4.101 3.394 4.321 0.041 12 0 "[ . 1 . 2]" 1
1148 1 60 ILE MD 1 82 VAL QG 3.280 . 4.760 3.826 3.469 4.143 . 0 0 "[ . 1 . 2]" 1
1149 1 60 ILE HG12 1 60 ILE MG 2.670 . 3.540 2.310 2.210 2.401 . 0 0 "[ . 1 . 2]" 1
1150 1 60 ILE HG12 1 69 ILE MD 2.860 . 3.920 2.831 2.321 3.398 . 0 0 "[ . 1 . 2]" 1
1151 1 60 ILE HG12 1 69 ILE MG 2.705 . 3.610 2.026 1.858 2.277 . 0 0 "[ . 1 . 2]" 1
1152 1 60 ILE HG12 1 78 LEU QD 3.620 . 5.440 3.459 3.197 3.686 . 0 0 "[ . 1 . 2]" 1
1153 1 60 ILE HG13 1 69 ILE HA 3.445 . 5.090 3.207 2.842 3.625 . 0 0 "[ . 1 . 2]" 1
1154 1 60 ILE HG13 1 69 ILE MG 3.235 . 4.670 2.423 1.964 2.867 . 0 0 "[ . 1 . 2]" 1
1155 1 60 ILE MG 1 61 MET HA 3.060 . 4.320 3.765 3.531 4.028 . 0 0 "[ . 1 . 2]" 1
1156 1 60 ILE MG 1 67 TYR HA 2.695 . 3.590 2.789 2.526 2.968 . 0 0 "[ . 1 . 2]" 1
1157 1 60 ILE MG 1 67 TYR HB2 3.030 . 4.260 3.653 3.489 3.912 . 0 0 "[ . 1 . 2]" 1
1158 1 60 ILE MG 1 67 TYR HB3 2.730 . 3.660 2.201 2.046 2.449 . 0 0 "[ . 1 . 2]" 1
1159 1 60 ILE MG 1 67 TYR QD 2.190 . 2.580 2.321 2.142 2.446 . 0 0 "[ . 1 . 2]" 1
1160 1 60 ILE MG 1 68 ARG H 2.400 . 3.000 1.878 1.742 2.098 0.058 18 0 "[ . 1 . 2]" 1
1161 1 60 ILE MG 1 69 ILE HA 3.220 . 4.640 3.589 3.336 3.753 . 0 0 "[ . 1 . 2]" 1
1162 1 60 ILE MG 1 78 LEU HA 3.650 . 5.500 4.573 4.250 4.793 . 0 0 "[ . 1 . 2]" 1
1163 1 60 ILE MG 1 78 LEU MD1 3.025 . 4.250 3.276 2.985 3.601 . 0 0 "[ . 1 . 2]" 1
1164 1 60 ILE MG 1 78 LEU QD 2.685 . 3.570 2.378 1.973 2.574 . 0 0 "[ . 1 . 2]" 1
1165 1 60 ILE MG 1 78 LEU MD2 3.025 . 4.250 2.445 2.001 2.660 . 0 0 "[ . 1 . 2]" 1
1166 1 61 MET HA 1 61 MET HG2 2.795 . 3.790 2.650 2.046 3.376 . 0 0 "[ . 1 . 2]" 1
1167 1 61 MET HA 1 61 MET QG 2.555 . 3.310 2.088 1.969 2.248 . 0 0 "[ . 1 . 2]" 1
1168 1 61 MET HA 1 61 MET HG3 2.795 . 3.790 2.397 1.997 3.066 . 0 0 "[ . 1 . 2]" 1
1169 1 61 MET HA 1 62 THR H 2.295 . 2.790 2.411 2.225 2.595 . 0 0 "[ . 1 . 2]" 1
1170 1 61 MET HA 1 62 THR MG 2.780 . 3.760 3.786 3.715 3.843 0.083 9 0 "[ . 1 . 2]" 1
1171 1 61 MET HA 1 68 ARG H 3.650 . 5.500 4.579 4.426 4.796 . 0 0 "[ . 1 . 2]" 1
1172 1 61 MET HB2 1 62 THR H 3.110 . 4.420 3.949 3.704 4.183 . 0 0 "[ . 1 . 2]" 1
1173 1 61 MET HB2 1 68 ARG H 3.175 . 4.550 4.514 4.359 4.640 0.090 15 0 "[ . 1 . 2]" 1
1174 1 61 MET HB2 1 68 ARG QD 3.155 . 4.510 2.746 2.419 3.283 . 0 0 "[ . 1 . 2]" 1
1175 1 61 MET HB2 1 68 ARG QG 3.570 . 5.340 3.192 2.877 3.476 . 0 0 "[ . 1 . 2]" 1
1176 1 61 MET HB3 1 62 THR H 2.875 . 3.950 2.961 2.409 3.578 . 0 0 "[ . 1 . 2]" 1
1177 1 61 MET HB3 1 67 TYR HA 3.520 . 5.240 5.232 4.876 5.355 0.115 3 0 "[ . 1 . 2]" 1
1178 1 61 MET HB3 1 68 ARG H 3.140 . 4.480 4.022 3.724 4.265 . 0 0 "[ . 1 . 2]" 1
1179 1 61 MET HB3 1 68 ARG QG 2.855 . 3.910 2.269 2.023 2.752 . 0 0 "[ . 1 . 2]" 1
1180 1 61 MET QG 1 62 THR HA 3.570 . 5.340 4.477 3.838 4.776 . 0 0 "[ . 1 . 2]" 1
1181 1 61 MET QG 1 62 THR MG 3.040 . 4.280 3.956 3.503 4.428 0.148 4 0 "[ . 1 . 2]" 1
1182 1 61 MET QG 1 63 ALA MB 3.390 . 4.980 4.530 3.449 5.011 0.031 19 0 "[ . 1 . 2]" 1
1183 1 61 MET HG2 1 62 THR H 3.065 . 4.330 2.248 1.864 2.831 . 0 0 "[ . 1 . 2]" 1
1184 1 61 MET HG3 1 62 THR H 3.065 . 4.330 3.188 2.195 3.807 . 0 0 "[ . 1 . 2]" 1
1185 1 62 THR H 1 62 THR HB 2.855 . 3.910 3.369 3.235 3.763 . 0 0 "[ . 1 . 2]" 1
1186 1 62 THR H 1 62 THR MG 2.590 . 3.380 2.573 2.345 3.215 . 0 0 "[ . 1 . 2]" 1
1187 1 62 THR H 1 63 ALA H 3.090 . 4.380 4.331 4.216 4.373 . 0 0 "[ . 1 . 2]" 1
1188 1 62 THR H 1 63 ALA HA 3.455 . 5.110 4.914 4.757 5.075 . 0 0 "[ . 1 . 2]" 1
1189 1 62 THR H 1 63 ALA MB 3.255 . 4.710 4.224 3.902 4.594 . 0 0 "[ . 1 . 2]" 1
1190 1 62 THR HA 1 62 THR MG 2.540 . 3.280 3.037 2.185 3.189 . 0 0 "[ . 1 . 2]" 1
1191 1 62 THR HA 1 63 ALA H 2.400 . 3.000 2.374 2.133 2.599 . 0 0 "[ . 1 . 2]" 1
1192 1 62 THR HA 1 63 ALA HA 3.115 . 4.430 4.542 4.418 4.671 0.241 16 0 "[ . 1 . 2]" 1
1193 1 62 THR HA 1 63 ALA MB 3.035 . 4.270 3.749 3.629 3.973 . 0 0 "[ . 1 . 2]" 1
1194 1 62 THR HA 1 66 LEU H 2.960 . 4.120 3.915 3.604 4.238 0.118 15 0 "[ . 1 . 2]" 1
1195 1 62 THR HB 1 63 ALA H 3.055 . 4.310 3.741 3.243 4.116 . 0 0 "[ . 1 . 2]" 1
1196 1 62 THR MG 1 63 ALA H 2.965 . 4.130 3.189 2.660 3.755 . 0 0 "[ . 1 . 2]" 1
1197 1 62 THR MG 1 65 GLY H 3.335 . 4.870 4.522 3.866 4.953 0.083 1 0 "[ . 1 . 2]" 1
1198 1 62 THR MG 1 66 LEU H 3.625 . 5.450 4.765 4.339 5.076 . 0 0 "[ . 1 . 2]" 1
1199 1 63 ALA H 1 63 ALA MB 2.375 . 2.950 2.785 2.550 2.944 . 0 0 "[ . 1 . 2]" 1
1200 1 63 ALA H 1 64 GLU H 3.365 . 4.930 2.975 2.554 4.224 . 0 0 "[ . 1 . 2]" 1
1201 1 63 ALA H 1 64 GLU QG 3.425 . 5.050 4.804 4.472 5.161 0.111 3 0 "[ . 1 . 2]" 1
1202 1 63 ALA H 1 65 GLY H 3.030 . 4.260 2.907 2.393 3.379 . 0 0 "[ . 1 . 2]" 1
1203 1 63 ALA H 1 66 LEU H 2.605 . 3.410 2.539 2.215 2.989 . 0 0 "[ . 1 . 2]" 1
1204 1 63 ALA H 1 66 LEU HG 3.540 . 5.280 4.996 4.597 5.328 0.048 1 0 "[ . 1 . 2]" 1
1205 1 63 ALA HA 1 64 GLU HA 3.260 . 4.720 4.613 4.390 4.685 . 0 0 "[ . 1 . 2]" 1
1206 1 63 ALA HA 1 64 GLU QG 3.140 . 4.480 4.444 3.661 4.581 0.101 13 0 "[ . 1 . 2]" 1
1207 1 63 ALA HA 1 65 GLY H 3.060 . 4.320 3.811 3.476 4.258 . 0 0 "[ . 1 . 2]" 1
1208 1 63 ALA HA 1 66 LEU H 3.580 . 5.360 4.871 4.073 5.365 0.005 4 0 "[ . 1 . 2]" 1
1209 1 63 ALA MB 1 64 GLU H 2.875 . 3.950 1.977 1.732 3.105 0.068 13 0 "[ . 1 . 2]" 1
1210 1 63 ALA MB 1 64 GLU HA 3.350 . 4.900 3.822 3.582 4.680 . 0 0 "[ . 1 . 2]" 1
1211 1 63 ALA MB 1 64 GLU HB2 2.900 . 4.000 4.084 3.912 4.173 0.173 2 0 "[ . 1 . 2]" 1
1212 1 63 ALA MB 1 64 GLU QG 2.455 . 3.110 2.379 2.119 2.858 . 0 0 "[ . 1 . 2]" 1
1213 1 63 ALA MB 1 65 GLY H 3.030 . 4.260 4.019 3.788 4.247 . 0 0 "[ . 1 . 2]" 1
1214 1 63 ALA MB 1 66 LEU H 2.970 . 4.140 4.069 3.484 4.280 0.140 11 0 "[ . 1 . 2]" 1
1215 1 63 ALA MB 1 66 LEU QD 2.905 . 4.010 3.795 2.348 4.154 0.144 1 0 "[ . 1 . 2]" 1
1216 1 64 GLU H 1 64 GLU QG 2.855 . 3.910 2.258 1.760 2.873 0.040 8 0 "[ . 1 . 2]" 1
1217 1 64 GLU H 1 65 GLY H 3.175 . 4.550 3.129 2.833 3.507 . 0 0 "[ . 1 . 2]" 1
1218 1 64 GLU HA 1 64 GLU HB3 2.310 . 2.820 2.321 2.301 2.389 . 0 0 "[ . 1 . 2]" 1
1219 1 64 GLU HA 1 64 GLU QG 2.480 . 3.160 2.745 2.406 3.226 0.066 19 0 "[ . 1 . 2]" 1
1220 1 64 GLU HA 1 65 GLY H 2.525 . 3.250 2.855 2.604 3.044 . 0 0 "[ . 1 . 2]" 1
1221 1 64 GLU HA 1 66 LEU H 3.290 . 4.780 4.314 4.175 4.516 . 0 0 "[ . 1 . 2]" 1
1222 1 64 GLU HB2 1 65 GLY H 3.000 . 4.200 4.157 3.973 4.299 0.099 8 0 "[ . 1 . 2]" 1
1223 1 64 GLU HB2 1 66 LEU H 3.030 . 4.260 3.725 3.182 4.313 0.053 8 0 "[ . 1 . 2]" 1
1224 1 64 GLU HB2 1 66 LEU QD 2.925 . 4.050 1.998 1.782 2.920 0.018 13 0 "[ . 1 . 2]" 1
1225 1 64 GLU HB2 1 66 LEU HG 3.170 . 4.540 2.958 2.290 3.537 . 0 0 "[ . 1 . 2]" 1
1226 1 64 GLU HB3 1 65 GLY H 3.305 . 4.810 4.588 4.474 4.625 . 0 0 "[ . 1 . 2]" 1
1227 1 64 GLU QG 1 65 GLY H 3.270 . 4.740 4.480 4.407 4.707 . 0 0 "[ . 1 . 2]" 1
1228 1 64 GLU QG 1 66 LEU QD 3.065 . 4.330 3.150 2.437 3.751 . 0 0 "[ . 1 . 2]" 1
1229 1 64 GLU QG 1 66 LEU HG 3.565 . 5.330 4.883 4.323 5.344 0.014 18 0 "[ . 1 . 2]" 1
1230 1 65 GLY H 1 65 GLY QA 2.125 . 2.450 2.233 2.212 2.283 . 0 0 "[ . 1 . 2]" 1
1231 1 65 GLY H 1 66 LEU H 2.315 . 2.830 2.477 2.314 2.619 . 0 0 "[ . 1 . 2]" 1
1232 1 65 GLY H 1 66 LEU HB2 3.280 . 4.760 4.750 4.496 4.833 0.073 12 0 "[ . 1 . 2]" 1
1233 1 65 GLY H 1 66 LEU QD 3.240 . 4.680 4.474 4.045 4.642 . 0 0 "[ . 1 . 2]" 1
1234 1 65 GLY HA2 1 66 LEU H 2.660 . 3.520 3.087 2.899 3.272 . 0 0 "[ . 1 . 2]" 1
1235 1 65 GLY HA3 1 66 LEU H 2.660 . 3.520 3.415 3.293 3.500 . 0 0 "[ . 1 . 2]" 1
1236 1 66 LEU H 1 66 LEU HB2 2.365 . 2.930 2.524 2.371 2.609 . 0 0 "[ . 1 . 2]" 1
1237 1 66 LEU H 1 66 LEU HB3 2.770 . 3.740 3.692 3.614 3.749 0.009 16 0 "[ . 1 . 2]" 1
1238 1 66 LEU H 1 66 LEU QD 2.670 . 3.540 3.198 2.916 3.402 . 0 0 "[ . 1 . 2]" 1
1239 1 66 LEU H 1 66 LEU HG 2.385 . 2.970 2.676 2.264 2.988 0.018 17 0 "[ . 1 . 2]" 1
1240 1 66 LEU H 1 67 TYR H 3.205 . 4.610 4.515 4.465 4.585 . 0 0 "[ . 1 . 2]" 1
1241 1 66 LEU H 1 76 ARG HA 3.650 . 5.500 5.434 5.135 5.578 0.078 7 0 "[ . 1 . 2]" 1
1242 1 66 LEU HA 1 66 LEU MD1 2.955 . 4.110 3.855 3.797 3.893 . 0 0 "[ . 1 . 2]" 1
1243 1 66 LEU HA 1 66 LEU QD 2.255 . 2.710 2.374 2.129 2.629 . 0 0 "[ . 1 . 2]" 1
1244 1 66 LEU HA 1 66 LEU MD2 2.955 . 4.110 2.398 2.139 2.681 . 0 0 "[ . 1 . 2]" 1
1245 1 66 LEU HA 1 66 LEU HG 2.840 . 3.880 2.712 2.495 2.998 . 0 0 "[ . 1 . 2]" 1
1246 1 66 LEU HA 1 67 TYR H 2.265 . 2.730 2.404 2.270 2.475 . 0 0 "[ . 1 . 2]" 1
1247 1 66 LEU HA 1 67 TYR QD 2.675 . 3.550 2.946 2.696 3.240 . 0 0 "[ . 1 . 2]" 1
1248 1 66 LEU HA 1 76 ARG HA 2.720 . 3.640 2.776 2.433 2.957 . 0 0 "[ . 1 . 2]" 1
1249 1 66 LEU HA 1 77 GLY H 3.535 . 5.270 4.899 4.585 5.131 . 0 0 "[ . 1 . 2]" 1
1250 1 66 LEU HB2 1 66 LEU MD1 2.485 . 3.170 2.102 1.984 2.339 . 0 0 "[ . 1 . 2]" 1
1251 1 66 LEU HB2 1 66 LEU QD 2.285 . 2.770 2.071 1.962 2.284 . 0 0 "[ . 1 . 2]" 1
1252 1 66 LEU HB2 1 66 LEU MD2 2.485 . 3.170 3.129 3.074 3.189 0.019 14 0 "[ . 1 . 2]" 1
1253 1 66 LEU HB2 1 67 TYR H 2.790 . 3.780 3.520 3.351 3.861 0.081 15 0 "[ . 1 . 2]" 1
1254 1 66 LEU HB2 1 74 ALA MB 3.105 . 4.410 2.772 2.246 3.581 . 0 0 "[ . 1 . 2]" 1
1255 1 66 LEU HB2 1 75 PHE H 3.335 . 4.870 4.083 3.793 4.638 . 0 0 "[ . 1 . 2]" 1
1256 1 66 LEU HB3 1 66 LEU MD1 2.520 . 3.240 2.643 2.343 2.763 . 0 0 "[ . 1 . 2]" 1
1257 1 66 LEU HB3 1 66 LEU MD2 2.520 . 3.240 2.110 1.963 2.229 . 0 0 "[ . 1 . 2]" 1
1258 1 66 LEU HB3 1 67 TYR H 2.510 . 3.220 2.341 2.168 2.741 . 0 0 "[ . 1 . 2]" 1
1259 1 66 LEU HB3 1 67 TYR HA 3.430 . 5.060 4.501 4.349 4.635 . 0 0 "[ . 1 . 2]" 1
1260 1 66 LEU HB3 1 74 ALA HA 3.190 . 4.580 3.240 2.878 3.544 . 0 0 "[ . 1 . 2]" 1
1261 1 66 LEU HB3 1 75 PHE H 2.840 . 3.880 2.651 2.506 2.975 . 0 0 "[ . 1 . 2]" 1
1262 1 66 LEU QD 1 67 TYR H 2.585 . 3.370 3.218 3.051 3.418 0.048 4 0 "[ . 1 . 2]" 1
1263 1 66 LEU QD 1 67 TYR HA 3.620 . 5.440 5.184 5.093 5.265 . 0 0 "[ . 1 . 2]" 1
1264 1 66 LEU QD 1 74 ALA HA 3.175 . 4.550 3.790 3.437 4.081 . 0 0 "[ . 1 . 2]" 1
1265 1 66 LEU QD 1 74 ALA MB 2.535 . 3.270 2.086 1.875 2.525 . 0 0 "[ . 1 . 2]" 1
1266 1 66 LEU QD 1 75 PHE H 2.660 . 3.520 3.386 3.166 3.550 0.030 6 0 "[ . 1 . 2]" 1
1267 1 66 LEU QD 1 75 PHE HA 2.980 . 4.160 3.137 2.728 3.456 . 0 0 "[ . 1 . 2]" 1
1268 1 66 LEU QD 1 76 ARG H 2.805 . 3.810 3.241 2.974 3.482 . 0 0 "[ . 1 . 2]" 1
1269 1 66 LEU QD 1 76 ARG HA 2.345 . 2.890 2.053 1.865 2.513 . 0 0 "[ . 1 . 2]" 1
1270 1 66 LEU QD 1 76 ARG QB 2.800 . 3.800 3.490 2.925 3.714 . 0 0 "[ . 1 . 2]" 1
1271 1 66 LEU QD 1 76 ARG QD 3.005 . 4.210 3.733 2.899 4.165 . 0 0 "[ . 1 . 2]" 1
1272 1 66 LEU QD 1 77 GLY H 3.325 . 4.850 4.470 4.162 4.720 . 0 0 "[ . 1 . 2]" 1
1273 1 66 LEU MD1 1 74 ALA MB 2.785 . 3.770 2.187 1.915 2.851 . 0 0 "[ . 1 . 2]" 1
1274 1 66 LEU MD2 1 74 ALA MB 2.785 . 3.770 2.908 2.389 3.721 . 0 0 "[ . 1 . 2]" 1
1275 1 66 LEU HG 1 67 TYR H 3.260 . 4.720 4.582 4.418 4.758 0.038 14 0 "[ . 1 . 2]" 1
1276 1 66 LEU HG 1 75 PHE H 3.650 . 5.500 5.536 5.501 5.573 0.073 20 0 "[ . 1 . 2]" 1
1277 1 66 LEU HG 1 76 ARG HA 3.250 . 4.700 3.999 3.562 4.402 . 0 0 "[ . 1 . 2]" 1
1278 1 67 TYR H 1 67 TYR HB2 2.535 . 3.270 2.641 2.555 2.734 . 0 0 "[ . 1 . 2]" 1
1279 1 67 TYR H 1 67 TYR HB3 2.860 . 3.920 3.783 3.723 3.838 . 0 0 "[ . 1 . 2]" 1
1280 1 67 TYR H 1 67 TYR QD 2.440 . 3.080 2.545 2.314 2.871 . 0 0 "[ . 1 . 2]" 1
1281 1 67 TYR H 1 67 TYR QE 3.410 . 5.020 4.659 4.473 4.913 . 0 0 "[ . 1 . 2]" 1
1282 1 67 TYR H 1 74 ALA MB 3.180 . 4.560 4.138 3.840 4.515 . 0 0 "[ . 1 . 2]" 1
1283 1 67 TYR H 1 75 PHE HB2 3.035 . 4.270 3.335 3.219 3.422 . 0 0 "[ . 1 . 2]" 1
1284 1 67 TYR H 1 75 PHE HB3 3.200 . 4.600 4.147 3.978 4.342 . 0 0 "[ . 1 . 2]" 1
1285 1 67 TYR H 1 76 ARG HA 3.095 . 4.390 3.913 3.628 4.121 . 0 0 "[ . 1 . 2]" 1
1286 1 67 TYR HA 1 67 TYR QD 2.615 . 3.430 3.016 2.875 3.129 . 0 0 "[ . 1 . 2]" 1
1287 1 67 TYR HA 1 67 TYR QE 3.325 . 4.850 4.651 4.590 4.753 . 0 0 "[ . 1 . 2]" 1
1288 1 67 TYR HA 1 68 ARG H 2.175 . 2.550 2.217 2.176 2.275 . 0 0 "[ . 1 . 2]" 1
1289 1 67 TYR HA 1 68 ARG QG 3.150 . 4.500 3.270 3.099 3.430 . 0 0 "[ . 1 . 2]" 1
1290 1 67 TYR HA 1 75 PHE H 3.220 . 4.640 4.021 3.852 4.182 . 0 0 "[ . 1 . 2]" 1
1291 1 67 TYR HB2 1 68 ARG H 3.090 . 4.380 4.092 3.970 4.238 . 0 0 "[ . 1 . 2]" 1
1292 1 67 TYR HB2 1 75 PHE H 2.995 . 4.190 3.501 3.355 3.833 . 0 0 "[ . 1 . 2]" 1
1293 1 67 TYR HB2 1 75 PHE HB3 3.180 . 4.560 3.733 3.517 3.945 . 0 0 "[ . 1 . 2]" 1
1294 1 67 TYR HB2 1 77 GLY H 3.145 . 4.490 3.897 3.589 4.056 . 0 0 "[ . 1 . 2]" 1
1295 1 67 TYR HB2 1 81 LEU HG 3.080 . 4.360 4.401 4.279 4.471 0.111 4 0 "[ . 1 . 2]" 1
1296 1 67 TYR HB3 1 68 ARG H 2.710 . 3.620 3.123 2.939 3.374 . 0 0 "[ . 1 . 2]" 1
1297 1 67 TYR HB3 1 75 PHE H 3.515 . 5.230 4.556 4.427 4.832 . 0 0 "[ . 1 . 2]" 1
1298 1 67 TYR HB3 1 78 LEU MD1 3.505 . 5.210 3.571 3.366 3.879 . 0 0 "[ . 1 . 2]" 1
1299 1 67 TYR HB3 1 78 LEU QD 2.950 . 4.100 2.309 2.138 2.545 . 0 0 "[ . 1 . 2]" 1
1300 1 67 TYR HB3 1 78 LEU MD2 3.505 . 5.210 2.339 2.161 2.586 . 0 0 "[ . 1 . 2]" 1
1301 1 67 TYR HB3 1 81 LEU HG 3.105 . 4.410 4.438 4.310 4.507 0.097 3 0 "[ . 1 . 2]" 1
1302 1 67 TYR QD 1 68 ARG H 3.130 . 4.460 4.199 4.063 4.305 . 0 0 "[ . 1 . 2]" 1
1303 1 67 TYR QD 1 75 PHE H 3.255 . 4.710 4.343 4.086 4.702 . 0 0 "[ . 1 . 2]" 1
1304 1 67 TYR QD 1 75 PHE HB2 3.390 . 4.980 4.185 3.982 4.390 . 0 0 "[ . 1 . 2]" 1
1305 1 67 TYR QD 1 75 PHE HB3 3.520 . 5.240 4.411 4.130 4.647 . 0 0 "[ . 1 . 2]" 1
1306 1 67 TYR QD 1 76 ARG H 3.475 . 5.150 4.668 4.391 4.933 . 0 0 "[ . 1 . 2]" 1
1307 1 67 TYR QD 1 76 ARG HA 2.995 . 4.190 3.616 3.258 3.963 . 0 0 "[ . 1 . 2]" 1
1308 1 67 TYR QD 1 77 GLY H 2.535 . 3.270 3.277 3.046 3.350 0.080 15 0 "[ . 1 . 2]" 1
1309 1 67 TYR QD 1 77 GLY QA 2.485 . 3.170 2.342 2.060 2.649 . 0 0 "[ . 1 . 2]" 1
1310 1 67 TYR QD 1 78 LEU H 3.040 . 4.280 3.693 3.506 3.886 . 0 0 "[ . 1 . 2]" 1
1311 1 67 TYR QD 1 78 LEU HA 3.225 . 4.650 4.500 4.388 4.664 0.014 11 0 "[ . 1 . 2]" 1
1312 1 67 TYR QD 1 78 LEU MD1 3.165 . 4.530 4.233 4.076 4.424 . 0 0 "[ . 1 . 2]" 1
1313 1 67 TYR QD 1 78 LEU QD 2.465 . 3.130 2.307 2.184 2.410 . 0 0 "[ . 1 . 2]" 1
1314 1 67 TYR QD 1 78 LEU MD2 3.165 . 4.530 2.317 2.193 2.420 . 0 0 "[ . 1 . 2]" 1
1315 1 67 TYR QD 1 78 LEU HG 3.485 . 5.170 4.835 4.681 4.958 . 0 0 "[ . 1 . 2]" 1
1316 1 67 TYR QE 1 76 ARG HA 3.330 . 4.860 4.458 4.032 4.846 . 0 0 "[ . 1 . 2]" 1
1317 1 67 TYR QE 1 77 GLY QA 2.405 . 3.010 2.642 2.506 2.849 . 0 0 "[ . 1 . 2]" 1
1318 1 67 TYR QE 1 78 LEU H 2.965 . 4.130 4.059 3.907 4.182 0.052 15 0 "[ . 1 . 2]" 1
1319 1 67 TYR QE 1 78 LEU HB2 3.650 . 5.500 5.170 4.954 5.438 . 0 0 "[ . 1 . 2]" 1
1320 1 67 TYR QE 1 78 LEU QD 2.475 . 3.150 3.107 2.861 3.188 0.038 5 0 "[ . 1 . 2]" 1
1321 1 67 TYR QE 1 78 LEU HG 3.650 . 5.500 5.441 5.158 5.540 0.040 11 0 "[ . 1 . 2]" 1
1322 1 68 ARG H 1 68 ARG HB3 2.790 . 3.780 3.681 3.602 3.778 . 0 0 "[ . 1 . 2]" 1
1323 1 68 ARG H 1 68 ARG QD 3.365 . 4.930 4.099 3.851 4.324 . 0 0 "[ . 1 . 2]" 1
1324 1 68 ARG H 1 68 ARG QG 2.495 . 3.190 2.133 2.055 2.278 . 0 0 "[ . 1 . 2]" 1
1325 1 68 ARG H 1 69 ILE HA 3.385 . 4.970 4.673 4.584 4.772 . 0 0 "[ . 1 . 2]" 1
1326 1 68 ARG H 1 69 ILE MD 3.330 . 4.860 4.479 4.336 4.654 . 0 0 "[ . 1 . 2]" 1
1327 1 68 ARG H 1 73 LYS QB 3.650 . 5.500 5.549 5.149 5.659 0.159 20 0 "[ . 1 . 2]" 1
1328 1 68 ARG H 1 74 ALA HA 3.385 . 4.970 4.361 4.129 4.593 . 0 0 "[ . 1 . 2]" 1
1329 1 68 ARG H 1 75 PHE QD 3.650 . 5.500 5.504 5.263 5.635 0.135 17 0 "[ . 1 . 2]" 1
1330 1 68 ARG HA 1 69 ILE H 2.555 . 3.310 2.133 2.103 2.156 . 0 0 "[ . 1 . 2]" 1
1331 1 68 ARG HA 1 69 ILE MG 3.210 . 4.620 4.395 4.115 4.552 . 0 0 "[ . 1 . 2]" 1
1332 1 68 ARG HA 1 70 THR H 2.890 . 3.980 3.571 3.363 3.712 . 0 0 "[ . 1 . 2]" 1
1333 1 68 ARG HA 1 70 THR MG 3.650 . 5.500 4.644 4.330 4.921 . 0 0 "[ . 1 . 2]" 1
1334 1 68 ARG HA 1 74 ALA H 3.470 . 5.140 4.340 4.036 4.466 . 0 0 "[ . 1 . 2]" 1
1335 1 68 ARG HA 1 74 ALA HA 3.090 . 4.380 3.527 3.445 3.595 . 0 0 "[ . 1 . 2]" 1
1336 1 68 ARG HA 1 75 PHE H 3.260 . 4.720 3.813 3.585 3.988 . 0 0 "[ . 1 . 2]" 1
1337 1 68 ARG HA 1 75 PHE QD 2.990 . 4.180 3.312 3.113 3.483 . 0 0 "[ . 1 . 2]" 1
1338 1 68 ARG HA 1 75 PHE QE 3.485 . 5.170 4.777 4.407 4.987 . 0 0 "[ . 1 . 2]" 1
1339 1 68 ARG HA 1 81 LEU HB2 3.650 . 5.500 4.740 4.557 4.969 . 0 0 "[ . 1 . 2]" 1
1340 1 68 ARG HA 1 81 LEU HG 2.770 . 3.740 3.522 3.437 3.579 . 0 0 "[ . 1 . 2]" 1
1341 1 68 ARG HB2 1 68 ARG HD2 2.745 . 3.690 2.781 2.430 3.477 . 0 0 "[ . 1 . 2]" 1
1342 1 68 ARG HB2 1 68 ARG HD3 2.745 . 3.690 2.362 2.045 2.813 . 0 0 "[ . 1 . 2]" 1
1343 1 68 ARG HB2 1 69 ILE H 2.940 . 4.080 3.246 3.086 3.475 . 0 0 "[ . 1 . 2]" 1
1344 1 68 ARG HB2 1 69 ILE HA 3.215 . 4.630 4.736 4.700 4.785 0.155 14 0 "[ . 1 . 2]" 1
1345 1 68 ARG HB2 1 70 THR H 2.690 . 3.580 2.495 2.203 2.808 . 0 0 "[ . 1 . 2]" 1
1346 1 68 ARG HB2 1 70 THR MG 2.925 . 4.050 3.376 2.958 3.786 . 0 0 "[ . 1 . 2]" 1
1347 1 68 ARG HB2 1 73 LYS H 2.790 . 3.780 2.990 2.850 3.255 . 0 0 "[ . 1 . 2]" 1
1348 1 68 ARG HB2 1 74 ALA H 3.070 . 4.340 4.394 4.319 4.451 0.111 12 0 "[ . 1 . 2]" 1
1349 1 68 ARG HB2 1 74 ALA HA 2.775 . 3.750 3.689 3.577 3.758 0.008 17 0 "[ . 1 . 2]" 1
1350 1 68 ARG HB3 1 68 ARG HD2 2.990 . 4.180 3.712 3.345 4.068 . 0 0 "[ . 1 . 2]" 1
1351 1 68 ARG HB3 1 68 ARG HD3 2.990 . 4.180 2.887 2.672 3.277 . 0 0 "[ . 1 . 2]" 1
1352 1 68 ARG HB3 1 69 ILE H 2.915 . 4.030 3.830 3.733 3.959 . 0 0 "[ . 1 . 2]" 1
1353 1 68 ARG HB3 1 70 THR H 2.945 . 4.090 3.942 3.665 4.165 0.075 19 0 "[ . 1 . 2]" 1
1354 1 68 ARG HB3 1 73 LYS H 3.315 . 4.830 3.686 3.566 3.809 . 0 0 "[ . 1 . 2]" 1
1355 1 68 ARG HB3 1 74 ALA H 3.235 . 4.670 3.066 2.967 3.186 . 0 0 "[ . 1 . 2]" 1
1356 1 68 ARG HB3 1 74 ALA HA 2.935 . 4.070 1.990 1.906 2.073 . 0 0 "[ . 1 . 2]" 1
1357 1 68 ARG HB3 1 74 ALA MB 2.890 . 3.980 3.338 3.249 3.453 . 0 0 "[ . 1 . 2]" 1
1358 1 68 ARG HB3 1 75 PHE H 3.115 . 4.430 3.543 3.414 3.626 . 0 0 "[ . 1 . 2]" 1
1359 1 68 ARG HB3 1 81 LEU HG 3.650 . 5.500 5.568 5.496 5.615 0.115 14 0 "[ . 1 . 2]" 1
1360 1 68 ARG QD 1 70 THR H 3.145 . 4.490 3.887 3.544 4.421 . 0 0 "[ . 1 . 2]" 1
1361 1 68 ARG QD 1 71 GLU H 3.300 . 4.800 4.156 3.713 4.906 0.106 7 0 "[ . 1 . 2]" 1
1362 1 68 ARG QD 1 71 GLU HA 2.515 . 3.230 2.380 1.899 3.110 . 0 0 "[ . 1 . 2]" 1
1363 1 68 ARG QD 1 73 LYS H 2.985 . 4.170 2.932 2.550 3.454 . 0 0 "[ . 1 . 2]" 1
1364 1 68 ARG QD 1 73 LYS QB 3.365 . 4.930 3.985 3.760 4.374 . 0 0 "[ . 1 . 2]" 1
1365 1 68 ARG QD 1 74 ALA H 3.515 . 5.230 4.849 4.627 5.424 0.194 18 0 "[ . 1 . 2]" 1
1366 1 68 ARG QD 1 74 ALA MB 2.780 . 3.760 3.598 2.919 3.893 0.133 18 0 "[ . 1 . 2]" 1
1367 1 68 ARG HD2 1 70 THR H 3.540 . 5.280 4.482 3.829 5.363 0.083 12 0 "[ . 1 . 2]" 1
1368 1 68 ARG HD3 1 70 THR H 3.540 . 5.280 4.424 3.720 5.345 0.065 8 0 "[ . 1 . 2]" 1
1369 1 68 ARG QG 1 69 ILE H 3.245 . 4.690 4.454 4.411 4.561 . 0 0 "[ . 1 . 2]" 1
1370 1 68 ARG QG 1 70 THR H 3.230 . 4.660 4.373 3.952 4.694 0.034 3 0 "[ . 1 . 2]" 1
1371 1 68 ARG QG 1 74 ALA H 3.570 . 5.340 4.621 4.319 4.953 . 0 0 "[ . 1 . 2]" 1
1372 1 68 ARG QG 1 74 ALA HA 3.000 . 4.200 2.408 2.086 2.736 . 0 0 "[ . 1 . 2]" 1
1373 1 68 ARG QG 1 75 PHE H 3.415 . 5.030 3.678 3.050 3.949 . 0 0 "[ . 1 . 2]" 1
1374 1 69 ILE H 1 69 ILE MD 3.015 . 4.230 1.747 1.709 1.792 0.091 2 0 "[ . 1 . 2]" 1
1375 1 69 ILE H 1 69 ILE HG12 2.855 . 3.910 1.925 1.835 1.998 . 0 0 "[ . 1 . 2]" 1
1376 1 69 ILE H 1 69 ILE MG 2.560 . 3.320 3.021 2.863 3.110 . 0 0 "[ . 1 . 2]" 1
1377 1 69 ILE H 1 70 THR H 2.470 . 3.140 2.402 2.261 2.705 . 0 0 "[ . 1 . 2]" 1
1378 1 69 ILE H 1 70 THR MG 2.855 . 3.910 3.826 3.494 3.996 0.086 20 0 "[ . 1 . 2]" 1
1379 1 69 ILE H 1 73 LYS H 3.650 . 5.500 5.324 5.146 5.520 0.020 7 0 "[ . 1 . 2]" 1
1380 1 69 ILE H 1 74 ALA HA 3.650 . 5.500 5.481 5.368 5.544 0.044 2 0 "[ . 1 . 2]" 1
1381 1 69 ILE H 1 85 TYR QE 3.650 . 5.500 4.644 4.211 5.400 . 0 0 "[ . 1 . 2]" 1
1382 1 69 ILE HA 1 69 ILE MD 2.925 . 4.050 3.099 3.000 3.226 . 0 0 "[ . 1 . 2]" 1
1383 1 69 ILE HA 1 69 ILE MG 2.425 . 3.050 2.117 2.019 2.215 . 0 0 "[ . 1 . 2]" 1
1384 1 69 ILE HB 1 69 ILE MD 2.590 . 3.380 3.183 3.167 3.197 . 0 0 "[ . 1 . 2]" 1
1385 1 69 ILE HB 1 70 THR H 3.110 . 4.420 3.667 3.379 4.113 . 0 0 "[ . 1 . 2]" 1
1386 1 69 ILE HB 1 70 THR HB 2.980 . 4.160 3.827 3.554 4.188 0.028 15 0 "[ . 1 . 2]" 1
1387 1 69 ILE HB 1 70 THR MG 3.255 . 4.710 4.416 3.952 4.704 . 0 0 "[ . 1 . 2]" 1
1388 1 69 ILE HB 1 85 TYR QE 3.650 . 5.500 4.786 4.355 5.321 . 0 0 "[ . 1 . 2]" 1
1389 1 69 ILE HB 1 90 LEU QD 3.620 . 5.440 4.950 4.824 5.134 . 0 0 "[ . 1 . 2]" 1
1390 1 69 ILE HB 1 93 CYS HA 3.650 . 5.500 5.531 5.354 5.659 0.159 11 0 "[ . 1 . 2]" 1
1391 1 69 ILE HB 1 94 PHE HA 3.300 . 4.800 3.960 3.264 4.227 . 0 0 "[ . 1 . 2]" 1
1392 1 69 ILE HB 1 94 PHE QE 3.480 . 5.160 3.326 3.083 3.603 . 0 0 "[ . 1 . 2]" 1
1393 1 69 ILE MD 1 69 ILE MG 2.335 . 2.870 1.763 1.687 1.881 0.113 14 0 "[ . 1 . 2]" 1
1394 1 69 ILE MD 1 70 THR H 2.935 . 4.070 3.585 3.356 3.970 . 0 0 "[ . 1 . 2]" 1
1395 1 69 ILE MD 1 70 THR MG 2.935 . 4.070 4.126 3.704 4.262 0.192 4 0 "[ . 1 . 2]" 1
1396 1 69 ILE MD 1 73 LYS QB 3.260 . 4.720 3.559 3.052 3.749 . 0 0 "[ . 1 . 2]" 1
1397 1 69 ILE MD 1 73 LYS QE 3.295 . 4.790 4.623 4.021 4.841 0.051 17 0 "[ . 1 . 2]" 1
1398 1 69 ILE MD 1 73 LYS QG 3.325 . 4.850 4.009 2.667 4.398 . 0 0 "[ . 1 . 2]" 1
1399 1 69 ILE MD 1 81 LEU HG 2.915 . 4.030 2.126 1.962 2.291 . 0 0 "[ . 1 . 2]" 1
1400 1 69 ILE MD 1 85 TYR QE 2.625 . 3.450 2.487 1.902 3.282 . 0 0 "[ . 1 . 2]" 1
1401 1 69 ILE MD 1 93 CYS H 3.650 . 5.500 5.361 5.130 5.602 0.102 11 0 "[ . 1 . 2]" 1
1402 1 69 ILE MD 1 93 CYS HB2 3.240 . 4.680 3.393 3.188 3.565 . 0 0 "[ . 1 . 2]" 1
1403 1 69 ILE MD 1 93 CYS HB3 3.175 . 4.550 3.316 2.856 3.482 . 0 0 "[ . 1 . 2]" 1
1404 1 69 ILE MD 1 94 PHE H 3.625 . 5.450 5.089 4.832 5.252 . 0 0 "[ . 1 . 2]" 1
1405 1 69 ILE MD 1 94 PHE QD 3.175 . 4.550 4.025 3.866 4.164 . 0 0 "[ . 1 . 2]" 1
1406 1 69 ILE MD 1 94 PHE QE 3.320 . 4.840 2.858 2.595 3.276 . 0 0 "[ . 1 . 2]" 1
1407 1 69 ILE MD 1 101 LEU MD2 3.650 . 5.500 5.100 4.876 5.283 . 0 0 "[ . 1 . 2]" 1
1408 1 69 ILE HG12 1 69 ILE MG 2.755 . 3.710 3.180 3.167 3.193 . 0 0 "[ . 1 . 2]" 1
1409 1 69 ILE HG12 1 70 THR H 2.745 . 3.690 2.537 2.176 3.204 . 0 0 "[ . 1 . 2]" 1
1410 1 69 ILE HG12 1 70 THR MG 2.950 . 4.100 3.045 2.405 3.267 . 0 0 "[ . 1 . 2]" 1
1411 1 69 ILE HG12 1 73 LYS H 3.650 . 5.500 5.436 5.203 5.568 0.068 13 0 "[ . 1 . 2]" 1
1412 1 69 ILE HG12 1 73 LYS QE 3.465 . 5.130 4.433 3.982 4.930 . 0 0 "[ . 1 . 2]" 1
1413 1 69 ILE HG12 1 93 CYS HA 3.650 . 5.500 4.185 4.017 4.446 . 0 0 "[ . 1 . 2]" 1
1414 1 69 ILE HG12 1 94 PHE H 3.650 . 5.500 4.731 4.431 5.058 . 0 0 "[ . 1 . 2]" 1
1415 1 69 ILE HG13 1 73 LYS QE 3.650 . 5.500 5.145 4.596 5.595 0.095 17 0 "[ . 1 . 2]" 1
1416 1 69 ILE HG13 1 90 LEU HB3 3.650 . 5.500 4.855 4.572 5.051 . 0 0 "[ . 1 . 2]" 1
1417 1 69 ILE HG13 1 90 LEU QD 3.225 . 4.650 3.843 3.710 4.089 . 0 0 "[ . 1 . 2]" 1
1418 1 69 ILE HG13 1 94 PHE HA 3.215 . 4.630 4.511 3.964 4.717 0.087 18 0 "[ . 1 . 2]" 1
1419 1 69 ILE MG 1 85 TYR QE 3.190 . 4.580 4.070 3.472 4.655 0.075 18 0 "[ . 1 . 2]" 1
1420 1 69 ILE MG 1 90 LEU QD 3.045 . 4.290 3.667 3.542 3.804 . 0 0 "[ . 1 . 2]" 1
1421 1 69 ILE MG 1 94 PHE HA 3.360 . 4.920 4.936 4.528 5.122 0.202 17 0 "[ . 1 . 2]" 1
1422 1 69 ILE MG 1 94 PHE QD 3.290 . 4.780 3.739 3.597 3.843 . 0 0 "[ . 1 . 2]" 1
1423 1 69 ILE MG 1 94 PHE QE 3.075 . 4.350 2.086 1.957 2.313 . 0 0 "[ . 1 . 2]" 1
1424 1 70 THR H 1 70 THR HB 2.820 . 3.840 3.084 2.870 3.376 . 0 0 "[ . 1 . 2]" 1
1425 1 70 THR H 1 70 THR MG 2.435 . 3.070 2.305 1.944 2.533 . 0 0 "[ . 1 . 2]" 1
1426 1 70 THR H 1 71 GLU H 3.325 . 4.850 4.311 4.189 4.439 . 0 0 "[ . 1 . 2]" 1
1427 1 70 THR H 1 71 GLU HA 3.460 . 5.120 4.982 4.775 5.204 0.084 19 0 "[ . 1 . 2]" 1
1428 1 70 THR H 1 73 LYS H 2.780 . 3.760 3.704 3.517 3.796 0.036 5 0 "[ . 1 . 2]" 1
1429 1 70 THR H 1 73 LYS QB 3.060 . 4.320 3.248 2.759 3.492 . 0 0 "[ . 1 . 2]" 1
1430 1 70 THR H 1 73 LYS QG 3.575 . 5.350 5.099 4.546 5.434 0.084 20 0 "[ . 1 . 2]" 1
1431 1 70 THR H 1 93 CYS HB3 3.405 . 5.010 3.622 3.069 4.422 . 0 0 "[ . 1 . 2]" 1
1432 1 70 THR HA 1 70 THR HB 2.380 . 2.960 2.538 2.391 2.622 . 0 0 "[ . 1 . 2]" 1
1433 1 70 THR HA 1 71 GLU QG 3.340 . 4.880 4.547 3.930 5.168 0.288 18 0 "[ . 1 . 2]" 1
1434 1 70 THR HB 1 71 GLU H 3.020 . 4.240 4.113 3.724 4.302 0.062 20 0 "[ . 1 . 2]" 1
1435 1 70 THR HB 1 72 LYS H 3.035 . 4.270 4.068 3.761 4.277 0.007 20 0 "[ . 1 . 2]" 1
1436 1 70 THR HB 1 73 LYS H 3.545 . 5.290 4.865 4.691 5.137 . 0 0 "[ . 1 . 2]" 1
1437 1 70 THR HB 1 93 CYS HB2 3.340 . 4.880 4.508 3.584 4.956 0.076 2 0 "[ . 1 . 2]" 1
1438 1 70 THR HB 1 93 CYS HB3 2.845 . 3.890 3.083 2.364 3.942 0.052 11 0 "[ . 1 . 2]" 1
1439 1 70 THR MG 1 71 GLU H 2.850 . 3.900 3.588 3.272 3.833 . 0 0 "[ . 1 . 2]" 1
1440 1 70 THR MG 1 71 GLU HA 3.095 . 4.390 4.401 4.182 4.526 0.136 16 0 "[ . 1 . 2]" 1
1441 1 70 THR MG 1 72 LYS H 2.555 . 3.310 1.947 1.736 2.413 0.064 6 0 "[ . 1 . 2]" 1
1442 1 70 THR MG 1 72 LYS HA 3.180 . 4.560 3.808 3.627 4.200 . 0 0 "[ . 1 . 2]" 1
1443 1 70 THR MG 1 72 LYS HB2 3.190 . 4.580 2.125 1.912 2.597 . 0 0 "[ . 1 . 2]" 1
1444 1 70 THR MG 1 73 LYS H 2.280 . 2.760 2.171 1.783 2.422 0.017 4 0 "[ . 1 . 2]" 1
1445 1 70 THR MG 1 93 CYS HA 2.805 . 3.810 2.076 1.877 2.380 . 0 0 "[ . 1 . 2]" 1
1446 1 70 THR MG 1 93 CYS HB2 3.025 . 4.250 3.747 3.452 4.280 0.030 1 0 "[ . 1 . 2]" 1
1447 1 70 THR MG 1 93 CYS HB3 2.850 . 3.900 2.699 2.073 3.098 . 0 0 "[ . 1 . 2]" 1
1448 1 71 GLU H 1 71 GLU QB 2.315 . 2.830 2.380 1.956 2.523 . 0 0 "[ . 1 . 2]" 1
1449 1 71 GLU H 1 71 GLU QG 2.550 . 3.300 2.781 2.364 3.407 0.107 18 0 "[ . 1 . 2]" 1
1450 1 71 GLU H 1 72 LYS H 2.700 . 3.600 2.731 2.541 2.860 . 0 0 "[ . 1 . 2]" 1
1451 1 71 GLU H 1 72 LYS HB2 3.520 . 5.240 5.223 4.949 5.328 0.088 20 0 "[ . 1 . 2]" 1
1452 1 71 GLU H 1 72 LYS HG2 3.270 . 4.740 4.509 3.188 4.853 0.113 16 0 "[ . 1 . 2]" 1
1453 1 71 GLU H 1 72 LYS HG3 3.175 . 4.550 3.730 3.193 4.594 0.044 8 0 "[ . 1 . 2]" 1
1454 1 71 GLU H 1 73 LYS H 3.170 . 4.540 4.452 4.359 4.571 0.031 5 0 "[ . 1 . 2]" 1
1455 1 71 GLU HA 1 71 GLU QB 2.255 . 2.710 2.198 2.159 2.211 . 0 0 "[ . 1 . 2]" 1
1456 1 71 GLU HA 1 71 GLU QG 2.650 . 3.500 3.386 3.270 3.436 . 0 0 "[ . 1 . 2]" 1
1457 1 71 GLU HA 1 73 LYS H 3.055 . 4.310 3.880 3.579 4.286 . 0 0 "[ . 1 . 2]" 1
1458 1 71 GLU QB 1 72 LYS H 2.780 . 3.760 3.705 3.524 3.778 0.018 15 0 "[ . 1 . 2]" 1
1459 1 71 GLU QB 1 72 LYS HA 3.195 . 4.590 4.478 4.353 4.789 0.199 18 0 "[ . 1 . 2]" 1
1460 1 71 GLU QB 1 72 LYS HG2 3.215 . 4.630 4.219 3.592 4.635 0.005 10 0 "[ . 1 . 2]" 1
1461 1 71 GLU QB 1 72 LYS HG3 3.585 . 5.370 4.383 3.853 5.428 0.058 8 0 "[ . 1 . 2]" 1
1462 1 71 GLU QG 1 72 LYS HA 3.000 . 4.200 3.398 3.091 3.807 . 0 0 "[ . 1 . 2]" 1
1463 1 71 GLU QG 1 72 LYS HB3 3.310 . 4.820 4.304 4.141 4.599 . 0 0 "[ . 1 . 2]" 1
1464 1 71 GLU QG 1 72 LYS QE 3.100 . 4.400 2.982 1.795 3.771 0.005 8 0 "[ . 1 . 2]" 1
1465 1 71 GLU QG 1 72 LYS HG2 2.800 . 3.800 2.252 1.845 2.921 . 0 0 "[ . 1 . 2]" 1
1466 1 71 GLU QG 1 72 LYS HG3 3.170 . 4.540 2.405 1.795 3.472 0.005 15 0 "[ . 1 . 2]" 1
1467 1 71 GLU QG 1 73 LYS H 3.420 . 5.040 4.619 4.488 4.707 . 0 0 "[ . 1 . 2]" 1
1468 1 71 GLU HG2 1 72 LYS HA 3.300 . 4.800 3.555 3.163 4.852 0.052 18 0 "[ . 1 . 2]" 1
1469 1 71 GLU HG2 1 72 LYS HG2 3.205 . 4.610 2.347 1.854 4.247 . 0 0 "[ . 1 . 2]" 1
1470 1 71 GLU HG3 1 72 LYS HA 3.300 . 4.800 4.824 3.126 4.998 0.198 16 0 "[ . 1 . 2]" 1
1471 1 71 GLU HG3 1 72 LYS HG2 3.205 . 4.610 3.482 2.900 3.848 . 0 0 "[ . 1 . 2]" 1
1472 1 72 LYS H 1 72 LYS HB2 2.325 . 2.850 2.708 2.643 2.843 . 0 0 "[ . 1 . 2]" 1
1473 1 72 LYS H 1 72 LYS HB3 2.815 . 3.830 3.631 3.545 3.684 . 0 0 "[ . 1 . 2]" 1
1474 1 72 LYS H 1 72 LYS HG2 2.585 . 3.370 2.831 1.769 3.414 0.044 7 0 "[ . 1 . 2]" 1
1475 1 72 LYS H 1 72 LYS HG3 2.665 . 3.530 2.154 1.796 3.112 0.004 18 0 "[ . 1 . 2]" 1
1476 1 72 LYS H 1 73 LYS H 2.315 . 2.830 2.471 2.345 2.686 . 0 0 "[ . 1 . 2]" 1
1477 1 72 LYS HA 1 72 LYS HB3 2.330 . 2.860 2.335 2.274 2.359 . 0 0 "[ . 1 . 2]" 1
1478 1 72 LYS HA 1 72 LYS QD 3.025 . 4.250 3.728 2.631 4.114 . 0 0 "[ . 1 . 2]" 1
1479 1 72 LYS HA 1 72 LYS QE 3.155 . 4.510 4.645 3.774 4.787 0.277 19 0 "[ . 1 . 2]" 1
1480 1 72 LYS HA 1 72 LYS HG2 2.365 . 2.930 2.660 2.497 3.026 0.096 11 0 "[ . 1 . 2]" 1
1481 1 72 LYS HA 1 72 LYS HG3 2.750 . 3.700 3.363 3.029 3.917 0.217 11 0 "[ . 1 . 2]" 1
1482 1 72 LYS HA 1 73 LYS H 2.605 . 3.410 3.383 3.291 3.479 0.069 4 0 "[ . 1 . 2]" 1
1483 1 72 LYS HB2 1 72 LYS HG3 2.365 . 2.930 2.417 2.243 2.589 . 0 0 "[ . 1 . 2]" 1
1484 1 72 LYS HB2 1 73 LYS H 2.720 . 3.640 3.462 3.051 3.645 0.005 17 0 "[ . 1 . 2]" 1
1485 1 72 LYS HB3 1 72 LYS QD 2.620 . 3.440 2.346 2.144 2.629 . 0 0 "[ . 1 . 2]" 1
1486 1 72 LYS HB3 1 72 LYS QE 3.000 . 4.200 3.916 3.574 4.149 . 0 0 "[ . 1 . 2]" 1
1487 1 72 LYS HB3 1 73 LYS H 3.125 . 4.450 4.403 4.187 4.512 0.062 11 0 "[ . 1 . 2]" 1
1488 1 72 LYS QE 1 72 LYS HG2 2.675 . 3.550 2.703 2.124 3.161 . 0 0 "[ . 1 . 2]" 1
1489 1 73 LYS H 1 73 LYS QB 2.230 . 2.660 2.485 2.253 2.563 . 0 0 "[ . 1 . 2]" 1
1490 1 73 LYS H 1 73 LYS QE 3.650 . 5.500 4.178 3.204 5.442 . 0 0 "[ . 1 . 2]" 1
1491 1 73 LYS H 1 73 LYS QG 3.025 . 4.250 4.228 4.074 4.279 0.029 6 0 "[ . 1 . 2]" 1
1492 1 73 LYS H 1 74 ALA H 3.200 . 4.600 4.408 4.341 4.458 . 0 0 "[ . 1 . 2]" 1
1493 1 73 LYS H 1 74 ALA HA 3.545 . 5.290 5.095 5.000 5.291 0.001 4 0 "[ . 1 . 2]" 1
1494 1 73 LYS HA 1 73 LYS QB 2.395 . 2.990 2.517 2.493 2.530 . 0 0 "[ . 1 . 2]" 1
1495 1 73 LYS HA 1 73 LYS HD2 2.955 . 4.110 3.388 2.570 3.909 . 0 0 "[ . 1 . 2]" 1
1496 1 73 LYS HA 1 73 LYS QD 2.585 . 3.370 2.284 1.897 3.386 0.016 17 0 "[ . 1 . 2]" 1
1497 1 73 LYS HA 1 73 LYS HD3 2.955 . 4.110 2.348 1.907 3.711 . 0 0 "[ . 1 . 2]" 1
1498 1 73 LYS HA 1 73 LYS QG 2.590 . 3.380 2.273 2.061 2.420 . 0 0 "[ . 1 . 2]" 1
1499 1 73 LYS HA 1 74 ALA H 2.175 . 2.550 2.639 2.586 2.679 0.129 7 0 "[ . 1 . 2]" 1
1500 1 73 LYS HA 1 74 ALA HA 3.210 . 4.620 4.684 4.669 4.699 0.079 7 0 "[ . 1 . 2]" 1
1501 1 73 LYS HA 1 74 ALA MB 2.845 . 3.890 3.688 3.632 3.803 . 0 0 "[ . 1 . 2]" 1
1502 1 73 LYS QB 1 73 LYS QD 2.670 . 3.540 2.513 2.222 2.765 . 0 0 "[ . 1 . 2]" 1
1503 1 73 LYS QB 1 73 LYS QE 2.770 . 3.740 2.195 1.891 3.087 . 0 0 "[ . 1 . 2]" 1
1504 1 73 LYS QB 1 74 ALA H 2.525 . 3.250 2.370 2.075 2.707 . 0 0 "[ . 1 . 2]" 1
1505 1 73 LYS QB 1 75 PHE QD 3.070 . 4.340 3.399 3.065 3.683 . 0 0 "[ . 1 . 2]" 1
1506 1 73 LYS QB 1 75 PHE QE 2.960 . 4.120 3.249 2.688 3.715 . 0 0 "[ . 1 . 2]" 1
1507 1 73 LYS QD 1 74 ALA H 2.845 . 3.890 3.700 3.492 3.882 . 0 0 "[ . 1 . 2]" 1
1508 1 73 LYS QD 1 75 PHE QE 3.130 . 4.460 3.735 2.583 4.113 . 0 0 "[ . 1 . 2]" 1
1509 1 73 LYS QD 1 84 PHE QE 3.495 . 5.190 5.212 4.962 5.332 0.142 7 0 "[ . 1 . 2]" 1
1510 1 73 LYS HD2 1 74 ALA H 3.185 . 4.570 4.272 3.878 4.630 0.060 4 0 "[ . 1 . 2]" 1
1511 1 73 LYS HD3 1 74 ALA H 3.185 . 4.570 4.078 3.731 4.312 . 0 0 "[ . 1 . 2]" 1
1512 1 73 LYS QE 1 73 LYS QG 2.415 . 3.030 2.268 2.028 2.871 . 0 0 "[ . 1 . 2]" 1
1513 1 73 LYS QE 1 74 ALA H 3.530 . 5.260 4.575 3.666 4.941 . 0 0 "[ . 1 . 2]" 1
1514 1 73 LYS QE 1 75 PHE QE 2.810 . 3.820 3.805 3.245 3.993 0.173 5 0 "[ . 1 . 2]" 1
1515 1 73 LYS QG 1 74 ALA H 2.810 . 3.820 1.890 1.727 2.240 0.073 17 0 "[ . 1 . 2]" 1
1516 1 73 LYS QG 1 74 ALA HA 3.410 . 5.020 4.411 4.146 4.741 . 0 0 "[ . 1 . 2]" 1
1517 1 73 LYS QG 1 75 PHE QE 3.005 . 4.210 1.926 1.794 2.173 0.006 17 0 "[ . 1 . 2]" 1
1518 1 74 ALA H 1 74 ALA MB 2.360 . 2.920 2.901 2.868 2.923 0.003 17 0 "[ . 1 . 2]" 1
1519 1 74 ALA H 1 75 PHE H 3.020 . 4.240 3.954 3.724 4.085 . 0 0 "[ . 1 . 2]" 1
1520 1 74 ALA HA 1 75 PHE H 2.235 . 2.670 2.165 2.145 2.195 . 0 0 "[ . 1 . 2]" 1
1521 1 74 ALA HA 1 75 PHE HB2 3.260 . 4.720 4.426 4.341 4.579 . 0 0 "[ . 1 . 2]" 1
1522 1 74 ALA HA 1 75 PHE QD 2.865 . 3.930 3.417 3.213 3.576 . 0 0 "[ . 1 . 2]" 1
1523 1 74 ALA MB 1 75 PHE H 2.535 . 3.270 3.202 3.053 3.351 0.081 17 0 "[ . 1 . 2]" 1
1524 1 75 PHE H 1 75 PHE HB2 2.530 . 3.260 2.565 2.459 2.704 . 0 0 "[ . 1 . 2]" 1
1525 1 75 PHE H 1 75 PHE HB3 2.855 . 3.910 3.721 3.660 3.793 . 0 0 "[ . 1 . 2]" 1
1526 1 75 PHE H 1 75 PHE QD 2.505 . 3.210 2.866 2.661 3.015 . 0 0 "[ . 1 . 2]" 1
1527 1 75 PHE H 1 75 PHE QE 3.580 . 5.360 5.126 4.981 5.259 . 0 0 "[ . 1 . 2]" 1
1528 1 75 PHE H 1 76 ARG HA 3.435 . 5.070 5.041 4.780 5.130 0.060 20 0 "[ . 1 . 2]" 1
1529 1 75 PHE HA 1 75 PHE QD 3.190 . 4.580 3.036 3.000 3.081 . 0 0 "[ . 1 . 2]" 1
1530 1 75 PHE HA 1 77 GLY H 2.990 . 4.180 4.049 3.886 4.181 0.001 20 0 "[ . 1 . 2]" 1
1531 1 75 PHE HA 1 80 GLU QB 3.190 . 4.580 4.179 3.858 4.528 . 0 0 "[ . 1 . 2]" 1
1532 1 75 PHE HB2 1 76 ARG H 2.905 . 4.010 3.927 3.816 3.985 . 0 0 "[ . 1 . 2]" 1
1533 1 75 PHE HB2 1 77 GLY H 2.715 . 3.630 3.567 3.310 3.688 0.058 17 0 "[ . 1 . 2]" 1
1534 1 75 PHE HB2 1 80 GLU H 3.650 . 5.500 5.508 5.390 5.634 0.134 7 0 "[ . 1 . 2]" 1
1535 1 75 PHE HB2 1 80 GLU QB 3.115 . 4.430 4.165 3.715 4.452 0.022 1 0 "[ . 1 . 2]" 1
1536 1 75 PHE HB2 1 81 LEU H 3.130 . 4.460 4.208 3.929 4.438 . 0 0 "[ . 1 . 2]" 1
1537 1 75 PHE HB2 1 81 LEU HB2 3.195 . 4.590 2.101 2.029 2.184 . 0 0 "[ . 1 . 2]" 1
1538 1 75 PHE HB2 1 81 LEU HG 3.015 . 4.230 3.579 3.377 3.783 . 0 0 "[ . 1 . 2]" 1
1539 1 75 PHE HB3 1 76 ARG H 2.555 . 3.310 2.637 2.517 2.739 . 0 0 "[ . 1 . 2]" 1
1540 1 75 PHE HB3 1 77 GLY H 2.390 . 2.980 2.398 2.261 2.515 . 0 0 "[ . 1 . 2]" 1
1541 1 75 PHE HB3 1 80 GLU H 3.195 . 4.590 4.338 4.188 4.537 . 0 0 "[ . 1 . 2]" 1
1542 1 75 PHE HB3 1 80 GLU QB 2.845 . 3.890 2.552 2.122 2.876 . 0 0 "[ . 1 . 2]" 1
1543 1 75 PHE HB3 1 80 GLU HG2 3.290 . 4.780 4.778 4.328 4.962 0.182 11 0 "[ . 1 . 2]" 1
1544 1 75 PHE HB3 1 80 GLU HG3 3.290 . 4.780 4.066 3.336 4.813 0.033 1 0 "[ . 1 . 2]" 1
1545 1 75 PHE HB3 1 81 LEU H 2.845 . 3.890 3.526 3.280 3.750 . 0 0 "[ . 1 . 2]" 1
1546 1 75 PHE HB3 1 81 LEU HB2 3.165 . 4.530 2.675 2.563 2.866 . 0 0 "[ . 1 . 2]" 1
1547 1 75 PHE HB3 1 81 LEU HG 3.580 . 5.360 4.812 4.631 5.066 . 0 0 "[ . 1 . 2]" 1
1548 1 75 PHE QD 1 80 GLU QB 2.840 . 3.880 2.226 1.905 2.554 . 0 0 "[ . 1 . 2]" 1
1549 1 75 PHE QD 1 80 GLU QG 3.290 . 4.780 4.154 3.832 4.426 . 0 0 "[ . 1 . 2]" 1
1550 1 75 PHE QD 1 81 LEU H 2.930 . 4.060 3.598 3.453 3.768 . 0 0 "[ . 1 . 2]" 1
1551 1 75 PHE QD 1 81 LEU HB2 2.495 . 3.190 3.072 2.988 3.190 . 0 0 "[ . 1 . 2]" 1
1552 1 75 PHE QD 1 81 LEU MD1 3.385 . 4.970 4.657 4.594 4.718 . 0 0 "[ . 1 . 2]" 1
1553 1 75 PHE QD 1 81 LEU MD2 3.055 . 4.310 2.816 2.634 3.020 . 0 0 "[ . 1 . 2]" 1
1554 1 75 PHE QD 1 81 LEU HG 2.905 . 4.010 3.709 3.549 3.952 . 0 0 "[ . 1 . 2]" 1
1555 1 75 PHE QD 1 82 VAL H 3.650 . 5.500 5.259 5.180 5.381 . 0 0 "[ . 1 . 2]" 1
1556 1 75 PHE QD 1 84 PHE H 3.650 . 5.500 5.260 5.078 5.371 . 0 0 "[ . 1 . 2]" 1
1557 1 75 PHE QE 1 81 LEU H 3.555 . 5.310 5.021 4.909 5.236 . 0 0 "[ . 1 . 2]" 1
1558 1 75 PHE QE 1 81 LEU HB2 3.475 . 5.150 4.325 4.179 4.493 . 0 0 "[ . 1 . 2]" 1
1559 1 75 PHE QE 1 81 LEU MD1 3.570 . 5.340 4.883 4.794 4.990 . 0 0 "[ . 1 . 2]" 1
1560 1 75 PHE QE 1 81 LEU HG 3.355 . 4.910 4.615 4.410 4.909 . 0 0 "[ . 1 . 2]" 1
1561 1 75 PHE QE 1 84 PHE H 3.200 . 4.600 4.682 4.622 4.739 0.139 17 0 "[ . 1 . 2]" 1
1562 1 75 PHE QE 1 84 PHE HB2 3.170 . 4.540 2.891 2.453 3.235 . 0 0 "[ . 1 . 2]" 1
1563 1 75 PHE QE 1 84 PHE HB3 2.730 . 3.660 2.644 2.472 2.860 . 0 0 "[ . 1 . 2]" 1
1564 1 76 ARG H 1 76 ARG QB 2.350 . 2.900 2.438 2.021 2.879 . 0 0 "[ . 1 . 2]" 1
1565 1 76 ARG H 1 76 ARG QG 2.450 . 3.100 2.350 1.792 3.185 0.085 8 0 "[ . 1 . 2]" 1
1566 1 76 ARG H 1 77 GLY H 2.460 . 3.120 2.508 2.337 2.604 . 0 0 "[ . 1 . 2]" 1
1567 1 76 ARG H 1 80 GLU H 3.650 . 5.500 5.469 5.340 5.611 0.111 2 0 "[ . 1 . 2]" 1
1568 1 76 ARG H 1 80 GLU HG2 3.415 . 5.030 4.949 4.594 5.100 0.070 19 0 "[ . 1 . 2]" 1
1569 1 76 ARG H 1 80 GLU QG 3.040 . 4.280 3.587 3.400 3.902 . 0 0 "[ . 1 . 2]" 1
1570 1 76 ARG H 1 80 GLU HG3 3.415 . 5.030 3.704 3.454 4.172 . 0 0 "[ . 1 . 2]" 1
1571 1 76 ARG H 1 81 LEU HB2 3.650 . 5.500 5.304 5.110 5.486 . 0 0 "[ . 1 . 2]" 1
1572 1 76 ARG HA 1 76 ARG QD 2.815 . 3.830 3.574 2.247 3.976 0.146 19 0 "[ . 1 . 2]" 1
1573 1 76 ARG HA 1 76 ARG QG 2.625 . 3.450 2.384 2.132 2.817 . 0 0 "[ . 1 . 2]" 1
1574 1 76 ARG HA 1 77 GLY H 2.630 . 3.460 3.448 3.345 3.489 0.029 20 0 "[ . 1 . 2]" 1
1575 1 76 ARG QB 1 76 ARG QD 2.470 . 3.140 2.295 1.928 2.771 . 0 0 "[ . 1 . 2]" 1
1576 1 76 ARG QB 1 77 GLY H 2.705 . 3.610 2.940 2.726 3.331 . 0 0 "[ . 1 . 2]" 1
1577 1 76 ARG QG 1 77 GLY H 3.025 . 4.250 4.123 3.561 4.546 0.296 13 0 "[ . 1 . 2]" 1
1578 1 76 ARG QG 1 80 GLU QG 3.490 . 5.180 4.304 3.337 5.405 0.225 2 0 "[ . 1 . 2]" 1
1579 1 77 GLY H 1 77 GLY QA 2.200 . 2.600 2.496 2.474 2.510 . 0 0 "[ . 1 . 2]" 1
1580 1 77 GLY H 1 78 LEU H 3.170 . 4.540 4.270 4.203 4.339 . 0 0 "[ . 1 . 2]" 1
1581 1 77 GLY H 1 78 LEU HA 3.350 . 4.900 4.933 4.840 4.977 0.077 17 0 "[ . 1 . 2]" 1
1582 1 77 GLY H 1 78 LEU QD 3.620 . 5.440 4.910 4.745 5.030 . 0 0 "[ . 1 . 2]" 1
1583 1 77 GLY H 1 79 THR H 3.580 . 5.360 5.258 5.108 5.402 0.042 2 0 "[ . 1 . 2]" 1
1584 1 77 GLY H 1 80 GLU H 2.895 . 3.990 3.629 3.468 3.905 . 0 0 "[ . 1 . 2]" 1
1585 1 77 GLY H 1 80 GLU QB 2.505 . 3.210 2.741 2.252 3.246 0.036 2 0 "[ . 1 . 2]" 1
1586 1 77 GLY H 1 80 GLU HG2 2.815 . 3.830 3.558 2.916 3.865 0.035 16 0 "[ . 1 . 2]" 1
1587 1 77 GLY H 1 80 GLU HG3 2.815 . 3.830 2.602 2.116 3.643 . 0 0 "[ . 1 . 2]" 1
1588 1 77 GLY H 1 81 LEU HB2 3.290 . 4.780 4.398 4.150 4.665 . 0 0 "[ . 1 . 2]" 1
1589 1 77 GLY QA 1 78 LEU H 2.175 . 2.550 2.180 2.117 2.223 . 0 0 "[ . 1 . 2]" 1
1590 1 77 GLY QA 1 78 LEU HA 2.945 . 4.090 4.049 4.020 4.083 . 0 0 "[ . 1 . 2]" 1
1591 1 77 GLY QA 1 78 LEU HB2 3.170 . 4.540 4.021 3.956 4.076 . 0 0 "[ . 1 . 2]" 1
1592 1 77 GLY QA 1 78 LEU HB3 3.650 . 5.500 5.079 4.983 5.152 . 0 0 "[ . 1 . 2]" 1
1593 1 77 GLY QA 1 78 LEU QD 2.920 . 4.040 3.459 3.310 3.696 . 0 0 "[ . 1 . 2]" 1
1594 1 77 GLY QA 1 79 THR H 2.695 . 3.590 3.516 3.452 3.603 0.013 4 0 "[ . 1 . 2]" 1
1595 1 77 GLY QA 1 80 GLU H 3.380 . 4.960 3.338 3.189 3.531 . 0 0 "[ . 1 . 2]" 1
1596 1 77 GLY QA 1 81 LEU HB2 3.650 . 5.500 5.223 5.054 5.460 . 0 0 "[ . 1 . 2]" 1
1597 1 78 LEU H 1 78 LEU HB2 2.210 . 2.620 2.157 2.085 2.213 . 0 0 "[ . 1 . 2]" 1
1598 1 78 LEU H 1 78 LEU HB3 2.695 . 3.590 3.463 3.387 3.511 . 0 0 "[ . 1 . 2]" 1
1599 1 78 LEU H 1 78 LEU MD1 3.075 . 4.350 3.893 3.753 4.036 . 0 0 "[ . 1 . 2]" 1
1600 1 78 LEU H 1 78 LEU QD 2.520 . 3.240 2.203 1.976 2.513 . 0 0 "[ . 1 . 2]" 1
1601 1 78 LEU H 1 78 LEU MD2 3.075 . 4.350 2.216 1.982 2.539 . 0 0 "[ . 1 . 2]" 1
1602 1 78 LEU H 1 78 LEU HG 3.160 . 4.520 4.052 3.933 4.170 . 0 0 "[ . 1 . 2]" 1
1603 1 78 LEU H 1 79 THR H 2.350 . 2.900 2.947 2.785 3.016 0.116 5 0 "[ . 1 . 2]" 1
1604 1 78 LEU H 1 80 GLU H 3.200 . 4.600 4.281 4.116 4.452 . 0 0 "[ . 1 . 2]" 1
1605 1 78 LEU H 1 81 LEU H 3.300 . 4.800 4.749 4.694 4.811 0.011 11 0 "[ . 1 . 2]" 1
1606 1 78 LEU HA 1 78 LEU MD1 2.765 . 3.730 2.035 1.929 2.127 . 0 0 "[ . 1 . 2]" 1
1607 1 78 LEU HA 1 78 LEU QD 2.510 . 3.220 1.870 1.811 1.936 . 0 0 "[ . 1 . 2]" 1
1608 1 78 LEU HA 1 78 LEU MD2 2.765 . 3.730 2.195 2.057 2.405 . 0 0 "[ . 1 . 2]" 1
1609 1 78 LEU HA 1 78 LEU HG 2.675 . 3.550 3.550 3.536 3.575 0.025 13 0 "[ . 1 . 2]" 1
1610 1 78 LEU HA 1 79 THR H 2.665 . 3.530 3.533 3.521 3.546 0.016 18 0 "[ . 1 . 2]" 1
1611 1 78 LEU HA 1 80 GLU H 3.070 . 4.340 4.284 4.072 4.387 0.047 14 0 "[ . 1 . 2]" 1
1612 1 78 LEU HA 1 81 LEU H 2.630 . 3.460 3.344 3.289 3.393 . 0 0 "[ . 1 . 2]" 1
1613 1 78 LEU HA 1 81 LEU HB3 2.800 . 3.800 2.324 2.229 2.434 . 0 0 "[ . 1 . 2]" 1
1614 1 78 LEU HA 1 81 LEU MD1 2.990 . 4.180 3.353 3.191 3.544 . 0 0 "[ . 1 . 2]" 1
1615 1 78 LEU HA 1 81 LEU HG 3.190 . 4.580 4.196 4.073 4.322 . 0 0 "[ . 1 . 2]" 1
1616 1 78 LEU HA 1 82 VAL H 2.945 . 4.090 3.558 3.460 3.765 . 0 0 "[ . 1 . 2]" 1
1617 1 78 LEU HB2 1 79 THR H 2.510 . 3.220 2.701 2.576 2.821 . 0 0 "[ . 1 . 2]" 1
1618 1 78 LEU HB2 1 79 THR HA 3.395 . 4.990 4.808 4.682 4.926 . 0 0 "[ . 1 . 2]" 1
1619 1 78 LEU HB2 1 81 LEU H 3.650 . 5.500 5.408 5.334 5.535 0.035 2 0 "[ . 1 . 2]" 1
1620 1 78 LEU HB3 1 78 LEU MD1 2.745 . 3.690 2.264 2.206 2.338 . 0 0 "[ . 1 . 2]" 1
1621 1 78 LEU HB3 1 78 LEU QD 2.445 . 3.090 2.220 2.168 2.283 . 0 0 "[ . 1 . 2]" 1
1622 1 78 LEU HB3 1 78 LEU MD2 2.745 . 3.690 3.194 3.182 3.203 . 0 0 "[ . 1 . 2]" 1
1623 1 78 LEU HB3 1 79 THR H 2.805 . 3.810 2.782 2.623 2.962 . 0 0 "[ . 1 . 2]" 1
1624 1 78 LEU HB3 1 82 VAL H 3.370 . 4.940 4.321 4.217 4.516 . 0 0 "[ . 1 . 2]" 1
1625 1 78 LEU HB3 1 82 VAL QG 3.200 . 4.600 2.739 2.419 3.083 . 0 0 "[ . 1 . 2]" 1
1626 1 78 LEU QD 1 79 THR H 3.100 . 4.400 3.778 3.725 3.812 . 0 0 "[ . 1 . 2]" 1
1627 1 78 LEU QD 1 81 LEU HB3 3.085 . 4.370 2.846 2.756 2.909 . 0 0 "[ . 1 . 2]" 1
1628 1 78 LEU QD 1 81 LEU MD1 2.915 . 4.030 2.500 2.250 2.663 . 0 0 "[ . 1 . 2]" 1
1629 1 78 LEU QD 1 81 LEU HG 3.160 . 4.520 3.516 3.351 3.672 . 0 0 "[ . 1 . 2]" 1
1630 1 78 LEU QD 1 82 VAL H 2.760 . 3.720 3.457 3.354 3.573 . 0 0 "[ . 1 . 2]" 1
1631 1 78 LEU QD 1 82 VAL QG 2.630 . 3.460 1.870 1.800 2.012 . 0 0 "[ . 1 . 2]" 1
1632 1 78 LEU MD1 1 79 THR H 3.525 . 5.250 4.270 4.164 4.386 . 0 0 "[ . 1 . 2]" 1
1633 1 78 LEU MD1 1 81 LEU HB3 3.650 . 5.500 2.926 2.806 3.000 . 0 0 "[ . 1 . 2]" 1
1634 1 78 LEU MD2 1 79 THR H 3.525 . 5.250 4.215 4.147 4.321 . 0 0 "[ . 1 . 2]" 1
1635 1 78 LEU MD2 1 81 LEU HB3 3.650 . 5.500 3.904 3.778 4.082 . 0 0 "[ . 1 . 2]" 1
1636 1 78 LEU HG 1 79 THR H 3.650 . 5.500 4.876 4.779 4.983 . 0 0 "[ . 1 . 2]" 1
1637 1 78 LEU HG 1 81 LEU HB3 3.650 . 5.500 5.546 5.463 5.602 0.102 16 0 "[ . 1 . 2]" 1
1638 1 78 LEU HG 1 82 VAL QG 3.340 . 4.880 3.864 3.712 3.969 . 0 0 "[ . 1 . 2]" 1
1639 1 79 THR H 1 79 THR HB 2.300 . 2.800 2.769 2.614 2.904 0.104 2 0 "[ . 1 . 2]" 1
1640 1 79 THR H 1 80 GLU QG 3.085 . 4.370 3.972 3.812 4.212 . 0 0 "[ . 1 . 2]" 1
1641 1 79 THR H 1 81 LEU H 2.985 . 4.170 3.973 3.918 4.105 . 0 0 "[ . 1 . 2]" 1
1642 1 79 THR H 1 82 VAL H 3.405 . 5.010 4.507 4.349 4.642 . 0 0 "[ . 1 . 2]" 1
1643 1 79 THR H 1 82 VAL QG 3.620 . 5.440 4.075 3.817 4.259 . 0 0 "[ . 1 . 2]" 1
1644 1 79 THR HA 1 79 THR MG 2.425 . 3.050 2.198 2.038 2.328 . 0 0 "[ . 1 . 2]" 1
1645 1 79 THR HA 1 80 GLU H 2.685 . 3.570 3.555 3.524 3.579 0.009 2 0 "[ . 1 . 2]" 1
1646 1 79 THR HA 1 81 LEU H 3.020 . 4.240 4.038 3.943 4.247 0.007 2 0 "[ . 1 . 2]" 1
1647 1 79 THR HA 1 82 VAL H 2.975 . 4.150 3.555 3.365 3.705 . 0 0 "[ . 1 . 2]" 1
1648 1 79 THR HA 1 82 VAL HB 2.950 . 4.100 2.569 2.164 2.782 . 0 0 "[ . 1 . 2]" 1
1649 1 79 THR HA 1 82 VAL MG1 3.210 . 4.620 3.874 3.459 4.098 . 0 0 "[ . 1 . 2]" 1
1650 1 79 THR HA 1 82 VAL MG2 3.210 . 4.620 3.477 3.010 3.662 . 0 0 "[ . 1 . 2]" 1
1651 1 79 THR HA 1 83 GLU H 2.890 . 3.980 3.143 3.007 3.271 . 0 0 "[ . 1 . 2]" 1
1652 1 79 THR HB 1 80 GLU H 2.415 . 3.030 2.719 2.541 2.977 . 0 0 "[ . 1 . 2]" 1
1653 1 79 THR HB 1 80 GLU QB 3.400 . 5.000 4.746 4.566 4.936 . 0 0 "[ . 1 . 2]" 1
1654 1 79 THR HB 1 80 GLU QG 3.360 . 4.920 2.962 2.731 3.339 . 0 0 "[ . 1 . 2]" 1
1655 1 79 THR HB 1 81 LEU H 3.455 . 5.110 4.745 4.598 4.887 . 0 0 "[ . 1 . 2]" 1
1656 1 79 THR MG 1 80 GLU HA 2.995 . 4.190 3.895 3.644 4.189 . 0 0 "[ . 1 . 2]" 1
1657 1 79 THR MG 1 80 GLU QB 3.535 . 5.270 5.022 4.828 5.211 . 0 0 "[ . 1 . 2]" 1
1658 1 79 THR MG 1 83 GLU HA 3.650 . 5.500 4.956 4.679 5.188 . 0 0 "[ . 1 . 2]" 1
1659 1 79 THR MG 1 83 GLU HB3 3.380 . 4.960 4.015 3.880 4.315 . 0 0 "[ . 1 . 2]" 1
1660 1 79 THR MG 1 83 GLU HG2 3.140 . 4.480 2.746 2.332 2.967 . 0 0 "[ . 1 . 2]" 1
1661 1 79 THR MG 1 83 GLU HG3 2.820 . 3.840 1.901 1.779 2.100 0.021 3 0 "[ . 1 . 2]" 1
1662 1 80 GLU H 1 80 GLU QB 2.265 . 2.730 2.756 2.607 2.883 0.153 2 0 "[ . 1 . 2]" 1
1663 1 80 GLU H 1 80 GLU HG2 2.695 . 3.590 1.919 1.760 2.101 0.040 10 0 "[ . 1 . 2]" 1
1664 1 80 GLU H 1 80 GLU QG 2.455 . 3.110 1.859 1.745 1.986 0.055 2 0 "[ . 1 . 2]" 1
1665 1 80 GLU H 1 80 GLU HG3 2.695 . 3.590 2.811 1.883 3.482 . 0 0 "[ . 1 . 2]" 1
1666 1 80 GLU H 1 81 LEU H 2.285 . 2.770 2.346 2.223 2.493 . 0 0 "[ . 1 . 2]" 1
1667 1 80 GLU H 1 81 LEU HB3 3.175 . 4.550 4.370 4.233 4.496 . 0 0 "[ . 1 . 2]" 1
1668 1 80 GLU H 1 81 LEU MD1 3.650 . 5.500 5.559 5.468 5.610 0.110 16 0 "[ . 1 . 2]" 1
1669 1 80 GLU H 1 82 VAL H 3.205 . 4.610 4.077 3.944 4.162 . 0 0 "[ . 1 . 2]" 1
1670 1 80 GLU HA 1 80 GLU QB 2.360 . 2.920 2.247 2.185 2.306 . 0 0 "[ . 1 . 2]" 1
1671 1 80 GLU HA 1 80 GLU HG2 2.855 . 3.910 3.013 2.647 3.468 . 0 0 "[ . 1 . 2]" 1
1672 1 80 GLU HA 1 80 GLU QG 2.500 . 3.200 2.900 2.600 3.252 0.052 10 0 "[ . 1 . 2]" 1
1673 1 80 GLU HA 1 80 GLU HG3 2.855 . 3.910 3.865 3.702 3.960 0.050 12 0 "[ . 1 . 2]" 1
1674 1 80 GLU HA 1 81 LEU H 2.680 . 3.560 3.418 3.388 3.484 . 0 0 "[ . 1 . 2]" 1
1675 1 80 GLU HA 1 82 VAL H 3.480 . 5.160 4.743 4.489 4.843 . 0 0 "[ . 1 . 2]" 1
1676 1 80 GLU HA 1 83 GLU H 2.970 . 4.140 4.110 3.582 4.198 0.058 12 0 "[ . 1 . 2]" 1
1677 1 80 GLU HA 1 83 GLU HB2 2.705 . 3.610 3.285 2.715 3.391 . 0 0 "[ . 1 . 2]" 1
1678 1 80 GLU HA 1 83 GLU HG2 3.380 . 4.960 4.828 4.671 5.049 0.089 2 0 "[ . 1 . 2]" 1
1679 1 80 GLU HA 1 83 GLU HG3 3.085 . 4.370 4.441 3.918 4.537 0.167 16 0 "[ . 1 . 2]" 1
1680 1 80 GLU HA 1 84 PHE H 3.110 . 4.420 3.926 3.762 4.057 . 0 0 "[ . 1 . 2]" 1
1681 1 80 GLU QB 1 81 LEU H 2.560 . 3.320 3.015 2.786 3.145 . 0 0 "[ . 1 . 2]" 1
1682 1 80 GLU QB 1 81 LEU HB2 3.170 . 4.540 4.108 3.980 4.242 . 0 0 "[ . 1 . 2]" 1
1683 1 80 GLU QG 1 81 LEU H 2.875 . 3.950 3.615 3.067 3.802 . 0 0 "[ . 1 . 2]" 1
1684 1 81 LEU H 1 81 LEU HB2 2.420 . 3.040 2.781 2.707 2.862 . 0 0 "[ . 1 . 2]" 1
1685 1 81 LEU H 1 81 LEU HB3 2.265 . 2.730 2.310 2.246 2.359 . 0 0 "[ . 1 . 2]" 1
1686 1 81 LEU H 1 81 LEU MD1 2.815 . 3.830 3.712 3.661 3.778 . 0 0 "[ . 1 . 2]" 1
1687 1 81 LEU H 1 81 LEU MD2 2.980 . 4.160 4.055 4.008 4.102 . 0 0 "[ . 1 . 2]" 1
1688 1 81 LEU H 1 81 LEU HG 3.325 . 4.850 4.645 4.600 4.674 . 0 0 "[ . 1 . 2]" 1
1689 1 81 LEU H 1 82 VAL H 2.310 . 2.820 2.316 2.259 2.379 . 0 0 "[ . 1 . 2]" 1
1690 1 81 LEU H 1 82 VAL HA 3.590 . 5.380 5.011 4.964 5.075 . 0 0 "[ . 1 . 2]" 1
1691 1 81 LEU H 1 82 VAL QG 2.665 . 3.530 3.719 3.692 3.761 0.231 16 0 "[ . 1 . 2]" 1
1692 1 81 LEU H 1 83 GLU H 2.865 . 3.930 3.954 3.904 3.985 0.055 19 0 "[ . 1 . 2]" 1
1693 1 81 LEU H 1 83 GLU HB2 3.455 . 5.110 5.181 5.114 5.225 0.115 3 0 "[ . 1 . 2]" 1
1694 1 81 LEU H 1 84 PHE H 3.270 . 4.740 4.373 4.324 4.432 . 0 0 "[ . 1 . 2]" 1
1695 1 81 LEU HA 1 81 LEU MD1 2.665 . 3.530 3.353 3.278 3.446 . 0 0 "[ . 1 . 2]" 1
1696 1 81 LEU HA 1 81 LEU HG 2.915 . 4.030 3.678 3.640 3.749 . 0 0 "[ . 1 . 2]" 1
1697 1 81 LEU HB2 1 81 LEU MD1 3.010 . 4.220 3.136 3.115 3.158 . 0 0 "[ . 1 . 2]" 1
1698 1 81 LEU HB2 1 82 VAL H 3.475 . 5.150 3.763 3.690 3.849 . 0 0 "[ . 1 . 2]" 1
1699 1 81 LEU HB3 1 81 LEU MD1 2.575 . 3.350 2.065 2.018 2.163 . 0 0 "[ . 1 . 2]" 1
1700 1 81 LEU HB3 1 82 VAL H 2.440 . 3.080 2.377 2.285 2.510 . 0 0 "[ . 1 . 2]" 1
1701 1 81 LEU HB3 1 82 VAL QG 3.150 . 4.500 2.936 2.788 3.120 . 0 0 "[ . 1 . 2]" 1
1702 1 81 LEU HB3 1 83 GLU H 3.485 . 5.170 5.054 4.958 5.120 . 0 0 "[ . 1 . 2]" 1
1703 1 81 LEU MD1 1 82 VAL H 2.465 . 3.130 2.443 2.325 2.564 . 0 0 "[ . 1 . 2]" 1
1704 1 81 LEU MD1 1 82 VAL HA 2.505 . 3.210 2.471 2.339 2.553 . 0 0 "[ . 1 . 2]" 1
1705 1 81 LEU MD1 1 82 VAL QG 2.450 . 3.100 2.046 1.967 2.121 . 0 0 "[ . 1 . 2]" 1
1706 1 81 LEU MD1 1 83 GLU H 3.170 . 4.540 4.551 4.474 4.590 0.050 6 0 "[ . 1 . 2]" 1
1707 1 81 LEU MD1 1 85 TYR H 3.120 . 4.440 4.203 3.969 4.392 . 0 0 "[ . 1 . 2]" 1
1708 1 81 LEU MD1 1 85 TYR HB2 2.690 . 3.580 3.499 3.211 3.606 0.026 12 0 "[ . 1 . 2]" 1
1709 1 81 LEU MD2 1 82 VAL H 2.985 . 4.170 3.888 3.816 3.985 . 0 0 "[ . 1 . 2]" 1
1710 1 81 LEU MD2 1 84 PHE H 3.220 . 4.640 4.469 4.318 4.595 . 0 0 "[ . 1 . 2]" 1
1711 1 81 LEU HG 1 82 VAL HA 3.650 . 5.500 5.340 5.236 5.417 . 0 0 "[ . 1 . 2]" 1
1712 1 82 VAL H 1 82 VAL HB 2.165 . 2.530 2.366 2.310 2.442 . 0 0 "[ . 1 . 2]" 1
1713 1 82 VAL H 1 82 VAL QG 2.135 . 2.470 2.038 1.945 2.212 . 0 0 "[ . 1 . 2]" 1
1714 1 82 VAL H 1 82 VAL MG2 2.560 . 3.320 2.048 1.952 2.230 . 0 0 "[ . 1 . 2]" 1
1715 1 82 VAL H 1 83 GLU H 2.295 . 2.790 2.763 2.669 2.795 0.005 10 0 "[ . 1 . 2]" 1
1716 1 82 VAL H 1 83 GLU HA 3.650 . 5.500 5.346 5.277 5.381 . 0 0 "[ . 1 . 2]" 1
1717 1 82 VAL H 1 83 GLU HB2 3.380 . 4.960 4.974 4.780 5.010 0.050 13 0 "[ . 1 . 2]" 1
1718 1 82 VAL H 1 83 GLU HG2 3.370 . 4.940 4.160 4.031 4.939 . 0 0 "[ . 1 . 2]" 1
1719 1 82 VAL H 1 85 TYR HB2 3.540 . 5.280 5.207 5.054 5.346 0.066 2 0 "[ . 1 . 2]" 1
1720 1 82 VAL HA 1 82 VAL MG1 2.555 . 3.310 2.376 2.301 2.477 . 0 0 "[ . 1 . 2]" 1
1721 1 82 VAL HA 1 82 VAL QG 2.300 . 2.800 2.083 2.019 2.139 . 0 0 "[ . 1 . 2]" 1
1722 1 82 VAL HA 1 82 VAL MG2 2.555 . 3.310 2.306 2.208 2.412 . 0 0 "[ . 1 . 2]" 1
1723 1 82 VAL HA 1 84 PHE H 3.090 . 4.380 4.166 4.080 4.264 . 0 0 "[ . 1 . 2]" 1
1724 1 82 VAL HA 1 85 TYR H 2.775 . 3.750 3.631 3.510 3.728 . 0 0 "[ . 1 . 2]" 1
1725 1 82 VAL HA 1 85 TYR HB2 3.190 . 4.580 3.042 2.866 3.278 . 0 0 "[ . 1 . 2]" 1
1726 1 82 VAL HA 1 86 GLN H 3.320 . 4.840 4.856 4.759 4.936 0.096 7 0 "[ . 1 . 2]" 1
1727 1 82 VAL HA 1 86 GLN QG 3.215 . 4.630 4.628 4.365 4.702 0.072 3 0 "[ . 1 . 2]" 1
1728 1 82 VAL HA 1 101 LEU MD1 3.340 . 4.880 3.533 3.326 3.624 . 0 0 "[ . 1 . 2]" 1
1729 1 82 VAL HA 1 101 LEU HG 2.515 . 3.230 2.821 2.598 2.986 . 0 0 "[ . 1 . 2]" 1
1730 1 82 VAL HB 1 83 GLU H 2.780 . 3.760 2.150 2.067 2.315 . 0 0 "[ . 1 . 2]" 1
1731 1 82 VAL HB 1 83 GLU HA 3.650 . 5.500 4.213 4.147 4.358 . 0 0 "[ . 1 . 2]" 1
1732 1 82 VAL HB 1 85 TYR H 3.650 . 5.500 5.434 5.332 5.524 0.024 2 0 "[ . 1 . 2]" 1
1733 1 82 VAL HB 1 86 GLN QG 3.650 . 5.500 5.269 5.001 5.393 . 0 0 "[ . 1 . 2]" 1
1734 1 82 VAL QG 1 83 GLU H 2.480 . 3.160 2.849 2.751 3.047 . 0 0 "[ . 1 . 2]" 1
1735 1 82 VAL QG 1 83 GLU HA 2.850 . 3.900 3.154 3.015 3.344 . 0 0 "[ . 1 . 2]" 1
1736 1 82 VAL QG 1 83 GLU HG3 2.910 . 4.020 4.167 4.127 4.232 0.212 14 0 "[ . 1 . 2]" 1
1737 1 82 VAL QG 1 84 PHE H 2.980 . 4.160 4.264 4.218 4.337 0.177 2 0 "[ . 1 . 2]" 1
1738 1 82 VAL QG 1 85 TYR H 3.300 . 4.800 4.346 4.268 4.425 . 0 0 "[ . 1 . 2]" 1
1739 1 82 VAL QG 1 86 GLN QG 2.975 . 4.150 3.295 3.072 3.417 . 0 0 "[ . 1 . 2]" 1
1740 1 82 VAL QG 1 101 LEU QB 3.205 . 4.610 3.089 3.004 3.197 . 0 0 "[ . 1 . 2]" 1
1741 1 82 VAL QG 1 101 LEU MD2 3.165 . 4.530 3.486 3.387 3.750 . 0 0 "[ . 1 . 2]" 1
1742 1 82 VAL QG 1 101 LEU HG 2.630 . 3.460 2.215 2.047 2.628 . 0 0 "[ . 1 . 2]" 1
1743 1 82 VAL MG1 1 84 PHE H 3.585 . 5.370 4.591 4.535 4.738 . 0 0 "[ . 1 . 2]" 1
1744 1 82 VAL MG1 1 101 LEU HG 2.955 . 4.110 2.228 2.053 2.659 . 0 0 "[ . 1 . 2]" 1
1745 1 82 VAL MG2 1 84 PHE H 3.585 . 5.370 5.060 4.969 5.116 . 0 0 "[ . 1 . 2]" 1
1746 1 82 VAL MG2 1 101 LEU HG 2.955 . 4.110 3.955 3.713 4.106 . 0 0 "[ . 1 . 2]" 1
1747 1 83 GLU H 1 83 GLU HB2 2.305 . 2.810 2.570 2.421 2.616 . 0 0 "[ . 1 . 2]" 1
1748 1 83 GLU H 1 83 GLU HB3 2.700 . 3.600 3.549 3.535 3.583 . 0 0 "[ . 1 . 2]" 1
1749 1 83 GLU H 1 83 GLU HG2 2.435 . 3.070 1.825 1.710 2.575 0.090 19 0 "[ . 1 . 2]" 1
1750 1 83 GLU H 1 83 GLU HG3 2.660 . 3.520 3.092 2.864 3.224 . 0 0 "[ . 1 . 2]" 1
1751 1 83 GLU H 1 84 PHE H 2.265 . 2.730 2.638 2.576 2.687 . 0 0 "[ . 1 . 2]" 1
1752 1 83 GLU H 1 84 PHE HB2 3.450 . 5.100 5.131 5.066 5.166 0.066 11 0 "[ . 1 . 2]" 1
1753 1 83 GLU H 1 85 TYR H 2.965 . 4.130 4.207 4.159 4.262 0.132 11 0 "[ . 1 . 2]" 1
1754 1 83 GLU H 1 86 GLN H 3.435 . 5.070 5.017 4.952 5.074 0.004 3 0 "[ . 1 . 2]" 1
1755 1 83 GLU HA 1 83 GLU HG2 2.475 . 3.150 2.835 2.310 2.962 . 0 0 "[ . 1 . 2]" 1
1756 1 83 GLU HA 1 83 GLU HG3 2.895 . 3.990 3.777 3.575 3.811 . 0 0 "[ . 1 . 2]" 1
1757 1 83 GLU HA 1 84 PHE H 2.675 . 3.550 3.458 3.437 3.474 . 0 0 "[ . 1 . 2]" 1
1758 1 83 GLU HA 1 85 TYR H 3.135 . 4.470 4.292 4.140 4.401 . 0 0 "[ . 1 . 2]" 1
1759 1 83 GLU HA 1 86 GLN H 2.700 . 3.600 3.499 3.372 3.606 0.006 16 0 "[ . 1 . 2]" 1
1760 1 83 GLU HA 1 86 GLN HB3 3.260 . 4.720 4.623 4.261 4.735 0.015 3 0 "[ . 1 . 2]" 1
1761 1 83 GLU HA 1 86 GLN QG 2.475 . 3.150 2.405 2.073 2.705 . 0 0 "[ . 1 . 2]" 1
1762 1 83 GLU HB2 1 84 PHE H 2.445 . 3.090 3.018 2.914 3.099 0.009 3 0 "[ . 1 . 2]" 1
1763 1 83 GLU HB2 1 85 TYR H 3.495 . 5.190 5.191 5.120 5.241 0.051 2 0 "[ . 1 . 2]" 1
1764 1 83 GLU HB2 1 86 GLN H 3.650 . 5.500 5.505 5.426 5.547 0.047 15 0 "[ . 1 . 2]" 1
1765 1 83 GLU HB3 1 84 PHE H 3.060 . 4.320 4.075 3.936 4.156 . 0 0 "[ . 1 . 2]" 1
1766 1 83 GLU HB3 1 84 PHE HA 3.315 . 4.830 4.748 4.517 4.816 . 0 0 "[ . 1 . 2]" 1
1767 1 83 GLU HG3 1 84 PHE H 3.580 . 5.360 4.928 4.809 5.028 . 0 0 "[ . 1 . 2]" 1
1768 1 84 PHE H 1 84 PHE HA 2.350 . 2.900 2.895 2.874 2.908 0.008 18 0 "[ . 1 . 2]" 1
1769 1 84 PHE H 1 84 PHE HB2 2.270 . 2.740 2.777 2.739 2.821 0.081 7 0 "[ . 1 . 2]" 1
1770 1 84 PHE H 1 84 PHE HB3 2.290 . 2.780 2.332 2.269 2.433 . 0 0 "[ . 1 . 2]" 1
1771 1 84 PHE H 1 85 TYR HA 3.535 . 5.270 5.064 5.002 5.128 . 0 0 "[ . 1 . 2]" 1
1772 1 84 PHE H 1 85 TYR HB2 3.145 . 4.490 4.377 4.305 4.489 . 0 0 "[ . 1 . 2]" 1
1773 1 84 PHE H 1 86 GLN H 2.905 . 4.010 3.782 3.684 3.839 . 0 0 "[ . 1 . 2]" 1
1774 1 84 PHE H 1 101 LEU HG 3.650 . 5.500 5.521 5.305 5.601 0.101 18 0 "[ . 1 . 2]" 1
1775 1 84 PHE HA 1 86 GLN H 2.995 . 4.190 3.839 3.696 3.939 . 0 0 "[ . 1 . 2]" 1
1776 1 84 PHE HA 1 86 GLN HB2 3.515 . 5.230 4.409 4.251 4.677 . 0 0 "[ . 1 . 2]" 1
1777 1 84 PHE HA 1 87 GLN H 3.110 . 4.420 4.161 3.922 4.430 0.010 7 0 "[ . 1 . 2]" 1
1778 1 84 PHE HB2 1 85 TYR H 3.000 . 4.200 4.017 3.974 4.078 . 0 0 "[ . 1 . 2]" 1
1779 1 84 PHE HB2 1 86 GLN H 3.650 . 5.500 5.506 5.401 5.571 0.071 8 0 "[ . 1 . 2]" 1
1780 1 84 PHE HB3 1 85 TYR H 2.465 . 3.130 2.748 2.681 2.882 . 0 0 "[ . 1 . 2]" 1
1781 1 84 PHE QE 1 88 ASN HB2 3.295 . 4.790 3.732 3.163 4.251 . 0 0 "[ . 1 . 2]" 1
1782 1 84 PHE QE 1 88 ASN QB 2.960 . 4.120 3.320 2.879 3.770 . 0 0 "[ . 1 . 2]" 1
1783 1 84 PHE QE 1 88 ASN HB3 3.295 . 4.790 3.728 3.311 4.273 . 0 0 "[ . 1 . 2]" 1
1784 1 85 TYR H 1 85 TYR HB2 2.385 . 2.970 2.250 2.192 2.306 . 0 0 "[ . 1 . 2]" 1
1785 1 85 TYR H 1 85 TYR HB3 2.665 . 3.530 3.534 3.496 3.558 0.028 15 0 "[ . 1 . 2]" 1
1786 1 85 TYR H 1 86 GLN H 2.280 . 2.760 2.528 2.446 2.565 . 0 0 "[ . 1 . 2]" 1
1787 1 85 TYR H 1 86 GLN HA 3.415 . 5.030 5.023 4.943 5.099 0.069 11 0 "[ . 1 . 2]" 1
1788 1 85 TYR H 1 86 GLN HB2 3.250 . 4.700 4.705 4.590 4.744 0.044 8 0 "[ . 1 . 2]" 1
1789 1 85 TYR H 1 86 GLN QG 3.025 . 4.250 4.090 3.900 4.254 0.004 2 0 "[ . 1 . 2]" 1
1790 1 85 TYR H 1 87 GLN H 3.215 . 4.630 4.447 4.327 4.631 0.001 7 0 "[ . 1 . 2]" 1
1791 1 85 TYR H 1 90 LEU QD 3.620 . 5.440 5.237 4.807 5.399 . 0 0 "[ . 1 . 2]" 1
1792 1 85 TYR H 1 101 LEU QB 3.455 . 5.110 4.800 4.254 5.026 . 0 0 "[ . 1 . 2]" 1
1793 1 85 TYR H 1 101 LEU MD1 3.650 . 5.500 5.473 5.294 5.538 0.038 1 0 "[ . 1 . 2]" 1
1794 1 85 TYR H 1 101 LEU MD2 3.035 . 4.270 3.650 3.364 4.108 . 0 0 "[ . 1 . 2]" 1
1795 1 85 TYR H 1 101 LEU HG 3.225 . 4.650 4.318 3.893 4.494 . 0 0 "[ . 1 . 2]" 1
1796 1 85 TYR HA 1 87 GLN H 2.725 . 3.650 3.616 3.359 3.736 0.086 9 0 "[ . 1 . 2]" 1
1797 1 85 TYR HA 1 88 ASN H 2.350 . 2.900 2.565 2.399 2.781 . 0 0 "[ . 1 . 2]" 1
1798 1 85 TYR HA 1 88 ASN QB 2.860 . 3.920 2.038 1.879 2.449 . 0 0 "[ . 1 . 2]" 1
1799 1 85 TYR HA 1 89 SER H 3.650 . 5.500 5.184 4.946 5.549 0.049 15 0 "[ . 1 . 2]" 1
1800 1 85 TYR HA 1 101 LEU H 3.535 . 5.270 4.958 4.386 5.306 0.036 1 0 "[ . 1 . 2]" 1
1801 1 85 TYR HB2 1 90 LEU MD1 3.480 . 5.160 4.765 4.477 5.049 . 0 0 "[ . 1 . 2]" 1
1802 1 85 TYR HB2 1 90 LEU QD 3.000 . 4.200 3.505 2.953 3.739 . 0 0 "[ . 1 . 2]" 1
1803 1 85 TYR HB2 1 90 LEU MD2 3.480 . 5.160 3.612 2.990 3.888 . 0 0 "[ . 1 . 2]" 1
1804 1 85 TYR HB2 1 101 LEU H 3.280 . 4.760 4.314 4.091 4.576 . 0 0 "[ . 1 . 2]" 1
1805 1 85 TYR HB2 1 101 LEU MD1 3.235 . 4.670 4.013 3.919 4.176 . 0 0 "[ . 1 . 2]" 1
1806 1 85 TYR HB2 1 101 LEU MD2 3.215 . 4.630 2.011 1.843 2.380 . 0 0 "[ . 1 . 2]" 1
1807 1 85 TYR HB2 1 101 LEU HG 2.795 . 3.790 3.103 2.478 3.553 . 0 0 "[ . 1 . 2]" 1
1808 1 85 TYR HB3 1 86 GLN H 2.895 . 3.990 3.942 3.772 4.049 0.059 2 0 "[ . 1 . 2]" 1
1809 1 85 TYR HB3 1 87 GLN H 3.585 . 5.370 5.170 4.889 5.345 . 0 0 "[ . 1 . 2]" 1
1810 1 85 TYR HB3 1 88 ASN H 3.195 . 4.590 4.348 3.883 4.678 0.088 16 0 "[ . 1 . 2]" 1
1811 1 85 TYR HB3 1 90 LEU QD 3.000 . 4.200 3.026 2.585 3.232 . 0 0 "[ . 1 . 2]" 1
1812 1 85 TYR HB3 1 90 LEU HG 3.510 . 5.220 2.540 2.229 3.007 . 0 0 "[ . 1 . 2]" 1
1813 1 85 TYR HB3 1 101 LEU H 2.910 . 4.020 3.500 3.140 3.768 . 0 0 "[ . 1 . 2]" 1
1814 1 85 TYR HB3 1 101 LEU MD1 3.250 . 4.700 4.189 4.116 4.326 . 0 0 "[ . 1 . 2]" 1
1815 1 85 TYR HB3 1 101 LEU MD2 2.995 . 4.190 1.836 1.751 1.959 0.049 16 0 "[ . 1 . 2]" 1
1816 1 85 TYR HB3 1 101 LEU HG 2.955 . 4.110 3.917 3.178 4.151 0.041 12 0 "[ . 1 . 2]" 1
1817 1 85 TYR QE 1 90 LEU QD 2.795 . 3.790 3.378 3.059 3.813 0.023 2 0 "[ . 1 . 2]" 1
1818 1 85 TYR QE 1 93 CYS HB2 3.175 . 4.550 2.129 1.830 3.467 . 0 0 "[ . 1 . 2]" 1
1819 1 85 TYR QE 1 93 CYS HB3 3.495 . 5.190 3.228 2.589 3.717 . 0 0 "[ . 1 . 2]" 1
1820 1 85 TYR QE 1 94 PHE H 3.480 . 5.160 3.963 3.107 4.651 . 0 0 "[ . 1 . 2]" 1
1821 1 86 GLN H 1 86 GLN HB2 2.365 . 2.930 2.390 2.262 2.475 . 0 0 "[ . 1 . 2]" 1
1822 1 86 GLN H 1 86 GLN HB3 2.860 . 3.920 3.584 3.543 3.605 . 0 0 "[ . 1 . 2]" 1
1823 1 86 GLN H 1 86 GLN QG 2.265 . 2.730 2.332 2.113 2.649 . 0 0 "[ . 1 . 2]" 1
1824 1 86 GLN H 1 87 GLN H 2.315 . 2.830 2.703 2.569 2.815 . 0 0 "[ . 1 . 2]" 1
1825 1 86 GLN H 1 88 ASN H 2.955 . 4.110 3.728 3.549 3.924 . 0 0 "[ . 1 . 2]" 1
1826 1 86 GLN H 1 101 LEU H 3.110 . 4.420 4.205 3.837 4.402 . 0 0 "[ . 1 . 2]" 1
1827 1 86 GLN H 1 101 LEU QB 2.840 . 3.880 3.313 2.833 3.656 . 0 0 "[ . 1 . 2]" 1
1828 1 86 GLN H 1 101 LEU MD1 3.620 . 5.440 5.282 5.125 5.418 . 0 0 "[ . 1 . 2]" 1
1829 1 86 GLN H 1 101 LEU MD2 3.125 . 4.450 3.264 2.973 3.935 . 0 0 "[ . 1 . 2]" 1
1830 1 86 GLN H 1 101 LEU HG 3.010 . 4.220 4.022 3.858 4.219 . 0 0 "[ . 1 . 2]" 1
1831 1 86 GLN HA 1 86 GLN QG 2.530 . 3.260 2.304 2.120 2.348 . 0 0 "[ . 1 . 2]" 1
1832 1 86 GLN HA 1 100 THR HB 2.770 . 3.740 2.844 2.720 2.987 . 0 0 "[ . 1 . 2]" 1
1833 1 86 GLN HA 1 101 LEU H 2.430 . 3.060 2.366 2.148 2.542 . 0 0 "[ . 1 . 2]" 1
1834 1 86 GLN HA 1 101 LEU HA 3.325 . 4.850 4.369 3.975 4.567 . 0 0 "[ . 1 . 2]" 1
1835 1 86 GLN HA 1 101 LEU QB 2.800 . 3.800 1.992 1.901 2.098 . 0 0 "[ . 1 . 2]" 1
1836 1 86 GLN HA 1 101 LEU MD2 3.250 . 4.700 2.907 2.677 3.429 . 0 0 "[ . 1 . 2]" 1
1837 1 86 GLN HA 1 101 LEU HG 3.090 . 4.380 4.142 3.901 4.246 . 0 0 "[ . 1 . 2]" 1
1838 1 86 GLN HB2 1 87 GLN H 3.070 . 4.340 2.776 2.663 2.963 . 0 0 "[ . 1 . 2]" 1
1839 1 86 GLN HB2 1 101 LEU H 3.650 . 5.500 5.277 4.967 5.488 . 0 0 "[ . 1 . 2]" 1
1840 1 86 GLN HB2 1 101 LEU QB 3.525 . 5.250 3.998 3.746 4.104 . 0 0 "[ . 1 . 2]" 1
1841 1 86 GLN HB3 1 87 GLN H 3.245 . 4.690 3.602 3.468 3.771 . 0 0 "[ . 1 . 2]" 1
1842 1 86 GLN HB3 1 100 THR MG 3.650 . 5.500 5.561 5.508 5.647 0.147 2 0 "[ . 1 . 2]" 1
1843 1 86 GLN HB3 1 101 LEU H 3.490 . 5.180 4.891 4.698 5.054 . 0 0 "[ . 1 . 2]" 1
1844 1 86 GLN QG 1 87 GLN H 3.115 . 4.430 4.210 4.130 4.290 . 0 0 "[ . 1 . 2]" 1
1845 1 86 GLN QG 1 88 ASN H 3.650 . 5.500 5.409 5.254 5.553 0.053 2 0 "[ . 1 . 2]" 1
1846 1 86 GLN QG 1 100 THR HB 3.430 . 5.060 4.710 4.573 4.777 . 0 0 "[ . 1 . 2]" 1
1847 1 86 GLN QG 1 101 LEU H 2.820 . 3.840 3.786 3.673 3.875 0.035 1 0 "[ . 1 . 2]" 1
1848 1 86 GLN QG 1 101 LEU QB 3.035 . 4.270 1.950 1.848 2.001 . 0 0 "[ . 1 . 2]" 1
1849 1 86 GLN QG 1 101 LEU HG 2.955 . 4.110 3.166 2.858 3.528 . 0 0 "[ . 1 . 2]" 1
1850 1 86 GLN QG 1 102 GLN H 3.650 . 5.500 5.365 4.915 5.506 0.006 2 0 "[ . 1 . 2]" 1
1851 1 87 GLN H 1 87 GLN QB 2.250 . 2.700 2.569 2.447 2.851 0.151 19 0 "[ . 1 . 2]" 1
1852 1 87 GLN H 1 87 GLN QG 2.330 . 2.860 2.544 1.888 2.879 0.019 3 0 "[ . 1 . 2]" 1
1853 1 87 GLN H 1 88 ASN H 2.175 . 2.550 2.095 1.897 2.339 . 0 0 "[ . 1 . 2]" 1
1854 1 87 GLN H 1 88 ASN HA 3.325 . 4.850 4.804 4.684 4.877 0.027 11 0 "[ . 1 . 2]" 1
1855 1 87 GLN H 1 100 THR MG 3.145 . 4.490 4.379 4.052 4.533 0.043 11 0 "[ . 1 . 2]" 1
1856 1 87 GLN H 1 101 LEU H 3.505 . 5.210 5.089 4.581 5.276 0.066 15 0 "[ . 1 . 2]" 1
1857 1 87 GLN HA 1 87 GLN HG2 2.820 . 3.840 2.990 2.376 3.740 . 0 0 "[ . 1 . 2]" 1
1858 1 87 GLN HA 1 87 GLN QG 2.575 . 3.350 2.676 2.308 3.289 . 0 0 "[ . 1 . 2]" 1
1859 1 87 GLN HA 1 87 GLN HG3 2.820 . 3.840 3.300 2.606 3.781 . 0 0 "[ . 1 . 2]" 1
1860 1 87 GLN HA 1 88 ASN H 2.625 . 3.450 3.363 3.151 3.481 0.031 16 0 "[ . 1 . 2]" 1
1861 1 87 GLN HA 1 100 THR MG 2.840 . 3.880 3.458 2.975 3.824 . 0 0 "[ . 1 . 2]" 1
1862 1 87 GLN QB 1 87 GLN QG 2.055 . 2.310 2.065 2.034 2.111 . 0 0 "[ . 1 . 2]" 1
1863 1 87 GLN QB 1 88 ASN H 3.080 . 4.360 3.177 2.858 3.592 . 0 0 "[ . 1 . 2]" 1
1864 1 87 GLN QG 1 88 ASN H 3.080 . 4.360 4.067 2.211 4.365 0.005 20 0 "[ . 1 . 2]" 1
1865 1 88 ASN H 1 88 ASN QB 2.285 . 2.770 2.462 2.204 2.691 . 0 0 "[ . 1 . 2]" 1
1866 1 88 ASN H 1 89 SER H 3.080 . 4.360 4.238 4.055 4.421 0.061 2 0 "[ . 1 . 2]" 1
1867 1 88 ASN H 1 100 THR HB 3.130 . 4.460 4.324 3.901 4.523 0.063 3 0 "[ . 1 . 2]" 1
1868 1 88 ASN H 1 100 THR MG 2.780 . 3.760 3.363 2.883 3.681 . 0 0 "[ . 1 . 2]" 1
1869 1 88 ASN HA 1 89 SER H 2.155 . 2.510 2.154 2.128 2.182 . 0 0 "[ . 1 . 2]" 1
1870 1 88 ASN HA 1 89 SER HA 3.145 . 4.490 4.408 4.336 4.460 . 0 0 "[ . 1 . 2]" 1
1871 1 88 ASN HA 1 89 SER HB2 3.370 . 4.940 4.232 4.166 4.487 . 0 0 "[ . 1 . 2]" 1
1872 1 88 ASN HA 1 89 SER QB 2.995 . 4.190 4.008 3.963 4.126 . 0 0 "[ . 1 . 2]" 1
1873 1 88 ASN HA 1 89 SER HB3 3.370 . 4.940 4.968 4.816 5.035 0.095 7 0 "[ . 1 . 2]" 1
1874 1 88 ASN HA 1 100 THR MG 2.915 . 4.030 3.593 3.379 3.797 . 0 0 "[ . 1 . 2]" 1
1875 1 88 ASN QB 1 89 SER H 2.895 . 3.990 3.784 3.345 3.966 . 0 0 "[ . 1 . 2]" 1
1876 1 88 ASN QB 1 100 THR MG 3.455 . 5.110 4.362 4.147 4.583 . 0 0 "[ . 1 . 2]" 1
1877 1 88 ASN HB2 1 89 SER H 3.255 . 4.710 4.319 4.131 4.504 . 0 0 "[ . 1 . 2]" 1
1878 1 88 ASN HB3 1 89 SER H 3.255 . 4.710 4.230 3.489 4.550 . 0 0 "[ . 1 . 2]" 1
1879 1 89 SER H 1 89 SER HB2 2.395 . 2.990 2.125 2.085 2.416 . 0 0 "[ . 1 . 2]" 1
1880 1 89 SER H 1 89 SER QB 2.200 . 2.600 2.079 2.049 2.248 . 0 0 "[ . 1 . 2]" 1
1881 1 89 SER H 1 89 SER HB3 2.395 . 2.990 2.997 2.677 3.064 0.074 6 0 "[ . 1 . 2]" 1
1882 1 89 SER H 1 90 LEU H 3.305 . 4.810 4.599 4.571 4.633 . 0 0 "[ . 1 . 2]" 1
1883 1 89 SER H 1 91 LYS QD 3.650 . 5.500 5.613 5.118 5.682 0.182 17 0 "[ . 1 . 2]" 1
1884 1 89 SER H 1 91 LYS QE 3.160 . 4.520 4.204 3.718 4.346 . 0 0 "[ . 1 . 2]" 1
1885 1 89 SER H 1 91 LYS HG2 3.405 . 5.010 4.825 4.737 5.011 0.001 1 0 "[ . 1 . 2]" 1
1886 1 89 SER H 1 92 ASP H 3.650 . 5.500 5.262 5.125 5.393 . 0 0 "[ . 1 . 2]" 1
1887 1 89 SER H 1 100 THR MG 2.480 . 3.160 2.871 2.700 3.039 . 0 0 "[ . 1 . 2]" 1
1888 1 89 SER HA 1 90 LEU H 2.265 . 2.730 2.198 2.169 2.245 . 0 0 "[ . 1 . 2]" 1
1889 1 89 SER HA 1 90 LEU HB2 3.265 . 4.730 4.584 4.531 4.643 . 0 0 "[ . 1 . 2]" 1
1890 1 89 SER HA 1 90 LEU HG 3.650 . 5.500 4.143 3.932 4.340 . 0 0 "[ . 1 . 2]" 1
1891 1 89 SER HA 1 91 LYS H 2.950 . 4.100 3.975 3.925 4.000 . 0 0 "[ . 1 . 2]" 1
1892 1 89 SER HA 1 91 LYS QD 3.330 . 4.860 4.716 4.582 4.843 . 0 0 "[ . 1 . 2]" 1
1893 1 89 SER HA 1 92 ASP H 3.650 . 5.500 4.888 4.789 5.066 . 0 0 "[ . 1 . 2]" 1
1894 1 89 SER HA 1 99 THR H 2.980 . 4.160 4.008 3.881 4.105 . 0 0 "[ . 1 . 2]" 1
1895 1 89 SER HA 1 100 THR H 3.130 . 4.460 4.348 4.218 4.453 . 0 0 "[ . 1 . 2]" 1
1896 1 89 SER HA 1 100 THR HA 2.605 . 3.410 2.856 2.633 3.039 . 0 0 "[ . 1 . 2]" 1
1897 1 89 SER HA 1 100 THR MG 2.450 . 3.100 1.917 1.872 1.966 . 0 0 "[ . 1 . 2]" 1
1898 1 89 SER HA 1 101 LEU H 3.570 . 5.340 5.011 4.823 5.186 . 0 0 "[ . 1 . 2]" 1
1899 1 89 SER QB 1 90 LEU H 2.700 . 3.600 3.505 3.418 3.546 . 0 0 "[ . 1 . 2]" 1
1900 1 89 SER QB 1 91 LYS H 2.545 . 3.290 3.138 3.034 3.320 0.030 1 0 "[ . 1 . 2]" 1
1901 1 89 SER QB 1 91 LYS QD 3.140 . 4.480 2.958 2.644 3.044 . 0 0 "[ . 1 . 2]" 1
1902 1 89 SER QB 1 91 LYS QE 2.810 . 3.820 1.903 1.798 1.976 0.002 2 0 "[ . 1 . 2]" 1
1903 1 89 SER QB 1 91 LYS HG2 2.950 . 4.100 1.906 1.803 2.192 . 0 0 "[ . 1 . 2]" 1
1904 1 89 SER QB 1 92 ASP H 3.145 . 4.490 3.327 3.140 3.546 . 0 0 "[ . 1 . 2]" 1
1905 1 89 SER QB 1 92 ASP QB 3.205 . 4.610 3.884 3.537 4.426 . 0 0 "[ . 1 . 2]" 1
1906 1 89 SER QB 1 98 ASP HA 3.570 . 5.340 4.385 4.278 4.671 . 0 0 "[ . 1 . 2]" 1
1907 1 89 SER QB 1 99 THR H 3.295 . 4.790 4.293 4.169 4.476 . 0 0 "[ . 1 . 2]" 1
1908 1 89 SER QB 1 100 THR HA 3.570 . 5.340 4.962 4.770 5.134 . 0 0 "[ . 1 . 2]" 1
1909 1 89 SER QB 1 100 THR MG 2.710 . 3.620 3.151 3.017 3.245 . 0 0 "[ . 1 . 2]" 1
1910 1 89 SER HB2 1 90 LEU H 3.050 . 4.300 4.300 3.975 4.370 0.070 20 0 "[ . 1 . 2]" 1
1911 1 89 SER HB2 1 100 THR MG 2.975 . 4.150 3.269 3.117 3.380 . 0 0 "[ . 1 . 2]" 1
1912 1 89 SER HB3 1 90 LEU H 3.050 . 4.300 3.716 3.653 3.799 . 0 0 "[ . 1 . 2]" 1
1913 1 89 SER HB3 1 100 THR MG 2.975 . 4.150 4.130 4.023 4.197 0.047 19 0 "[ . 1 . 2]" 1
1914 1 90 LEU H 1 90 LEU HB2 2.420 . 3.040 2.402 2.362 2.456 . 0 0 "[ . 1 . 2]" 1
1915 1 90 LEU H 1 90 LEU QD 2.480 . 3.160 2.399 2.318 2.576 . 0 0 "[ . 1 . 2]" 1
1916 1 90 LEU H 1 90 LEU HG 2.750 . 3.700 2.629 2.439 2.763 . 0 0 "[ . 1 . 2]" 1
1917 1 90 LEU H 1 91 LYS HB3 3.375 . 4.950 5.003 4.544 5.064 0.114 11 0 "[ . 1 . 2]" 1
1918 1 90 LEU H 1 91 LYS QD 3.220 . 4.640 4.562 4.425 4.700 0.060 1 0 "[ . 1 . 2]" 1
1919 1 90 LEU H 1 91 LYS HG2 3.210 . 4.620 4.086 3.996 4.337 . 0 0 "[ . 1 . 2]" 1
1920 1 90 LEU H 1 92 ASP H 3.315 . 4.830 4.171 4.103 4.256 . 0 0 "[ . 1 . 2]" 1
1921 1 90 LEU H 1 94 PHE QD 3.650 . 5.500 5.442 5.362 5.531 0.031 12 0 "[ . 1 . 2]" 1
1922 1 90 LEU H 1 97 LEU QD 2.580 . 3.360 3.366 3.244 3.396 0.036 1 0 "[ . 1 . 2]" 1
1923 1 90 LEU H 1 97 LEU HG 3.560 . 5.320 5.054 4.781 5.218 . 0 0 "[ . 1 . 2]" 1
1924 1 90 LEU H 1 99 THR H 2.470 . 3.140 2.889 2.772 2.957 . 0 0 "[ . 1 . 2]" 1
1925 1 90 LEU H 1 99 THR HA 3.275 . 4.750 4.346 4.201 4.493 . 0 0 "[ . 1 . 2]" 1
1926 1 90 LEU H 1 100 THR H 3.475 . 5.150 4.553 4.476 4.798 . 0 0 "[ . 1 . 2]" 1
1927 1 90 LEU H 1 100 THR HA 2.730 . 3.660 2.883 2.796 3.188 . 0 0 "[ . 1 . 2]" 1
1928 1 90 LEU H 1 100 THR HB 3.650 . 5.500 5.168 5.067 5.454 . 0 0 "[ . 1 . 2]" 1
1929 1 90 LEU H 1 100 THR MG 2.735 . 3.670 3.382 3.294 3.551 . 0 0 "[ . 1 . 2]" 1
1930 1 90 LEU HA 1 90 LEU MD1 2.830 . 3.860 3.622 3.566 3.686 . 0 0 "[ . 1 . 2]" 1
1931 1 90 LEU HA 1 90 LEU QD 2.460 . 3.120 2.760 2.668 2.835 . 0 0 "[ . 1 . 2]" 1
1932 1 90 LEU HA 1 90 LEU MD2 2.830 . 3.860 2.863 2.738 2.952 . 0 0 "[ . 1 . 2]" 1
1933 1 90 LEU HA 1 90 LEU HG 2.810 . 3.820 2.280 2.208 2.346 . 0 0 "[ . 1 . 2]" 1
1934 1 90 LEU HA 1 91 LYS HG2 3.445 . 5.090 4.868 4.750 4.944 . 0 0 "[ . 1 . 2]" 1
1935 1 90 LEU HA 1 92 ASP H 3.105 . 4.410 3.326 3.273 3.405 . 0 0 "[ . 1 . 2]" 1
1936 1 90 LEU HA 1 93 CYS H 2.760 . 3.720 3.426 3.215 3.535 . 0 0 "[ . 1 . 2]" 1
1937 1 90 LEU HA 1 94 PHE H 3.240 . 4.680 3.695 3.366 3.862 . 0 0 "[ . 1 . 2]" 1
1938 1 90 LEU HA 1 94 PHE QD 3.070 . 4.340 3.406 3.244 3.590 . 0 0 "[ . 1 . 2]" 1
1939 1 90 LEU HB2 1 90 LEU MD1 2.595 . 3.390 2.004 1.873 2.102 . 0 0 "[ . 1 . 2]" 1
1940 1 90 LEU HB2 1 90 LEU QD 2.345 . 2.890 1.973 1.851 2.062 . 0 0 "[ . 1 . 2]" 1
1941 1 90 LEU HB2 1 90 LEU MD2 2.595 . 3.390 2.963 2.903 2.991 . 0 0 "[ . 1 . 2]" 1
1942 1 90 LEU HB2 1 91 LYS HA 3.245 . 4.690 4.356 4.296 4.433 . 0 0 "[ . 1 . 2]" 1
1943 1 90 LEU HB2 1 92 ASP H 3.495 . 5.190 4.770 4.711 4.821 . 0 0 "[ . 1 . 2]" 1
1944 1 90 LEU HB2 1 94 PHE QD 2.905 . 4.010 3.933 3.729 4.030 0.020 15 0 "[ . 1 . 2]" 1
1945 1 90 LEU HB2 1 97 LEU HB2 3.170 . 4.540 4.242 4.027 4.373 . 0 0 "[ . 1 . 2]" 1
1946 1 90 LEU HB2 1 97 LEU HB3 2.465 . 3.130 2.761 2.541 2.925 . 0 0 "[ . 1 . 2]" 1
1947 1 90 LEU HB2 1 97 LEU MD1 3.065 . 4.330 1.928 1.880 1.990 . 0 0 "[ . 1 . 2]" 1
1948 1 90 LEU HB2 1 97 LEU QD 2.780 . 3.760 1.925 1.877 1.986 . 0 0 "[ . 1 . 2]" 1
1949 1 90 LEU HB2 1 97 LEU MD2 3.065 . 4.330 4.160 3.996 4.260 . 0 0 "[ . 1 . 2]" 1
1950 1 90 LEU HB2 1 99 THR H 2.765 . 3.730 2.990 2.828 3.224 . 0 0 "[ . 1 . 2]" 1
1951 1 90 LEU HB2 1 99 THR MG 2.990 . 4.180 3.387 3.222 3.637 . 0 0 "[ . 1 . 2]" 1
1952 1 90 LEU HB2 1 100 THR MG 3.650 . 5.500 5.264 5.172 5.397 . 0 0 "[ . 1 . 2]" 1
1953 1 90 LEU HB3 1 90 LEU MD1 2.930 . 4.060 2.886 2.841 2.932 . 0 0 "[ . 1 . 2]" 1
1954 1 90 LEU HB3 1 90 LEU MD2 2.930 . 4.060 2.089 1.916 2.125 . 0 0 "[ . 1 . 2]" 1
1955 1 90 LEU HB3 1 91 LYS H 3.010 . 4.220 3.751 3.670 3.854 . 0 0 "[ . 1 . 2]" 1
1956 1 90 LEU HB3 1 94 PHE H 3.100 . 4.400 3.288 3.140 3.379 . 0 0 "[ . 1 . 2]" 1
1957 1 90 LEU HB3 1 94 PHE QD 2.565 . 3.330 2.386 2.129 2.568 . 0 0 "[ . 1 . 2]" 1
1958 1 90 LEU HB3 1 97 LEU QD 2.935 . 4.070 3.155 3.085 3.294 . 0 0 "[ . 1 . 2]" 1
1959 1 90 LEU HB3 1 99 THR MG 3.595 . 5.390 4.718 4.591 4.961 . 0 0 "[ . 1 . 2]" 1
1960 1 90 LEU QD 1 91 LYS H 2.995 . 4.190 3.909 3.797 4.021 . 0 0 "[ . 1 . 2]" 1
1961 1 90 LEU QD 1 93 CYS H 3.570 . 5.340 4.744 4.677 4.827 . 0 0 "[ . 1 . 2]" 1
1962 1 90 LEU QD 1 93 CYS HB2 3.115 . 4.430 4.176 3.731 4.454 0.024 20 0 "[ . 1 . 2]" 1
1963 1 90 LEU QD 1 93 CYS HB3 3.620 . 5.440 5.033 4.647 5.494 0.054 17 0 "[ . 1 . 2]" 1
1964 1 90 LEU QD 1 94 PHE H 2.975 . 4.150 4.085 3.957 4.177 0.027 7 0 "[ . 1 . 2]" 1
1965 1 90 LEU QD 1 94 PHE HA 3.620 . 5.440 5.083 4.906 5.214 . 0 0 "[ . 1 . 2]" 1
1966 1 90 LEU QD 1 94 PHE HB2 3.475 . 5.150 3.731 3.589 3.873 . 0 0 "[ . 1 . 2]" 1
1967 1 90 LEU QD 1 94 PHE HB3 3.620 . 5.440 4.435 4.225 4.623 . 0 0 "[ . 1 . 2]" 1
1968 1 90 LEU QD 1 94 PHE QD 2.580 . 3.360 2.679 2.478 2.887 . 0 0 "[ . 1 . 2]" 1
1969 1 90 LEU QD 1 94 PHE QE 3.215 . 4.630 2.235 2.126 2.365 . 0 0 "[ . 1 . 2]" 1
1970 1 90 LEU QD 1 97 LEU HB3 3.400 . 5.000 3.576 3.438 3.725 . 0 0 "[ . 1 . 2]" 1
1971 1 90 LEU QD 1 97 LEU QD 2.185 . 2.570 1.942 1.827 2.080 . 0 0 "[ . 1 . 2]" 1
1972 1 90 LEU QD 1 97 LEU HG 2.925 . 4.050 2.411 2.109 2.617 . 0 0 "[ . 1 . 2]" 1
1973 1 90 LEU QD 1 99 THR H 2.960 . 4.120 3.035 2.707 3.329 . 0 0 "[ . 1 . 2]" 1
1974 1 90 LEU QD 1 100 THR HA 2.910 . 4.020 2.240 1.991 2.534 . 0 0 "[ . 1 . 2]" 1
1975 1 90 LEU QD 1 101 LEU H 2.920 . 4.040 3.140 2.951 3.292 . 0 0 "[ . 1 . 2]" 1
1976 1 90 LEU QD 1 101 LEU HA 3.105 . 4.410 3.177 3.038 3.300 . 0 0 "[ . 1 . 2]" 1
1977 1 90 LEU QD 1 101 LEU MD1 2.790 . 3.780 2.276 2.086 2.776 . 0 0 "[ . 1 . 2]" 1
1978 1 90 LEU MD1 1 92 ASP H 3.650 . 5.500 5.662 5.599 5.718 0.218 15 0 "[ . 1 . 2]" 1
1979 1 90 LEU MD1 1 94 PHE H 3.650 . 5.500 5.582 5.451 5.656 0.156 5 0 "[ . 1 . 2]" 1
1980 1 90 LEU MD1 1 94 PHE QD 3.210 . 4.620 4.396 4.320 4.465 . 0 0 "[ . 1 . 2]" 1
1981 1 90 LEU MD1 1 99 THR H 3.650 . 5.500 3.055 2.717 3.362 . 0 0 "[ . 1 . 2]" 1
1982 1 90 LEU MD1 1 100 THR HA 3.420 . 5.040 2.248 1.994 2.549 . 0 0 "[ . 1 . 2]" 1
1983 1 90 LEU MD1 1 101 LEU MD2 2.920 . 4.040 2.018 1.858 2.270 . 0 0 "[ . 1 . 2]" 1
1984 1 90 LEU MD2 1 92 ASP H 3.650 . 5.500 5.554 5.483 5.619 0.119 11 0 "[ . 1 . 2]" 1
1985 1 90 LEU MD2 1 94 PHE H 3.650 . 5.500 4.200 4.063 4.318 . 0 0 "[ . 1 . 2]" 1
1986 1 90 LEU MD2 1 94 PHE QD 3.210 . 4.620 2.704 2.493 2.929 . 0 0 "[ . 1 . 2]" 1
1987 1 90 LEU MD2 1 99 THR H 3.650 . 5.500 5.273 5.086 5.367 . 0 0 "[ . 1 . 2]" 1
1988 1 90 LEU MD2 1 100 THR HA 3.420 . 5.040 4.302 4.049 4.471 . 0 0 "[ . 1 . 2]" 1
1989 1 90 LEU MD2 1 101 LEU MD2 2.920 . 4.040 2.010 1.826 2.234 . 0 0 "[ . 1 . 2]" 1
1990 1 90 LEU HG 1 100 THR HA 3.105 . 4.410 3.090 2.826 3.291 . 0 0 "[ . 1 . 2]" 1
1991 1 90 LEU HG 1 101 LEU H 3.650 . 5.500 4.042 3.889 4.252 . 0 0 "[ . 1 . 2]" 1
1992 1 91 LYS H 1 91 LYS HB3 2.615 . 3.430 2.528 2.335 2.574 . 0 0 "[ . 1 . 2]" 1
1993 1 91 LYS H 1 91 LYS QD 2.560 . 3.320 3.003 2.900 3.330 0.010 2 0 "[ . 1 . 2]" 1
1994 1 91 LYS H 1 91 LYS QE 3.150 . 4.500 4.175 4.093 4.408 . 0 0 "[ . 1 . 2]" 1
1995 1 91 LYS H 1 91 LYS HG2 2.485 . 3.170 2.210 2.126 2.511 . 0 0 "[ . 1 . 2]" 1
1996 1 91 LYS H 1 92 ASP H 2.485 . 3.170 2.744 2.690 2.798 . 0 0 "[ . 1 . 2]" 1
1997 1 91 LYS H 1 92 ASP QB 3.300 . 4.800 4.515 4.379 4.773 . 0 0 "[ . 1 . 2]" 1
1998 1 91 LYS H 1 93 CYS H 3.205 . 4.610 4.346 4.144 4.488 . 0 0 "[ . 1 . 2]" 1
1999 1 91 LYS H 1 94 PHE H 3.470 . 5.140 4.466 4.287 4.590 . 0 0 "[ . 1 . 2]" 1
2000 1 91 LYS H 1 94 PHE HB2 3.030 . 4.260 3.666 3.526 3.893 . 0 0 "[ . 1 . 2]" 1
2001 1 91 LYS H 1 97 LEU QD 3.620 . 5.440 3.439 3.338 3.490 . 0 0 "[ . 1 . 2]" 1
2002 1 91 LYS H 1 98 ASP H 3.570 . 5.340 5.221 5.002 5.321 . 0 0 "[ . 1 . 2]" 1
2003 1 91 LYS H 1 98 ASP HA 2.795 . 3.790 3.039 2.884 3.099 . 0 0 "[ . 1 . 2]" 1
2004 1 91 LYS H 1 99 THR H 2.660 . 3.520 2.964 2.829 3.038 . 0 0 "[ . 1 . 2]" 1
2005 1 91 LYS H 1 100 THR MG 3.470 . 5.140 5.172 5.126 5.227 0.087 4 0 "[ . 1 . 2]" 1
2006 1 91 LYS HA 1 91 LYS QD 3.115 . 4.430 4.072 4.027 4.252 . 0 0 "[ . 1 . 2]" 1
2007 1 91 LYS HA 1 91 LYS HG2 2.815 . 3.830 3.578 3.567 3.589 . 0 0 "[ . 1 . 2]" 1
2008 1 91 LYS HA 1 94 PHE H 2.930 . 4.060 3.361 3.195 3.615 . 0 0 "[ . 1 . 2]" 1
2009 1 91 LYS HA 1 94 PHE HB2 3.295 . 4.790 2.649 2.479 2.967 . 0 0 "[ . 1 . 2]" 1
2010 1 91 LYS HA 1 94 PHE HB3 3.180 . 4.560 3.582 3.356 3.960 . 0 0 "[ . 1 . 2]" 1
2011 1 91 LYS HA 1 97 LEU HB3 2.785 . 3.770 3.381 3.294 3.518 . 0 0 "[ . 1 . 2]" 1
2012 1 91 LYS HA 1 98 ASP HA 2.915 . 4.030 4.087 3.822 4.157 0.127 12 0 "[ . 1 . 2]" 1
2013 1 91 LYS HB2 1 92 ASP H 3.030 . 4.260 4.089 4.065 4.124 . 0 0 "[ . 1 . 2]" 1
2014 1 91 LYS HB2 1 92 ASP HA 3.280 . 4.760 4.751 4.667 4.817 0.057 5 0 "[ . 1 . 2]" 1
2015 1 91 LYS HB2 1 98 ASP HA 2.805 . 3.810 3.793 3.484 3.861 0.051 6 0 "[ . 1 . 2]" 1
2016 1 91 LYS HB2 1 98 ASP QB 3.270 . 4.740 4.468 4.256 4.600 . 0 0 "[ . 1 . 2]" 1
2017 1 91 LYS HB2 1 99 THR H 3.650 . 5.500 5.578 5.383 5.622 0.122 4 0 "[ . 1 . 2]" 1
2018 1 91 LYS HB3 1 91 LYS QD 2.575 . 3.350 2.105 2.066 2.245 . 0 0 "[ . 1 . 2]" 1
2019 1 91 LYS HB3 1 91 LYS QE 3.255 . 4.710 3.931 3.914 4.011 . 0 0 "[ . 1 . 2]" 1
2020 1 91 LYS HB3 1 92 ASP H 3.070 . 4.340 4.186 3.959 4.236 . 0 0 "[ . 1 . 2]" 1
2021 1 91 LYS HB3 1 98 ASP H 3.270 . 4.740 4.435 4.324 4.547 . 0 0 "[ . 1 . 2]" 1
2022 1 91 LYS HB3 1 98 ASP HA 2.685 . 3.570 2.106 1.861 2.169 . 0 0 "[ . 1 . 2]" 1
2023 1 91 LYS HB3 1 99 THR H 2.870 . 3.940 3.887 3.653 3.939 . 0 0 "[ . 1 . 2]" 1
2024 1 91 LYS QD 1 91 LYS QE 2.225 . 2.650 2.047 1.960 2.061 . 0 0 "[ . 1 . 2]" 1
2025 1 91 LYS QD 1 92 ASP H 3.260 . 4.720 4.484 4.221 4.589 . 0 0 "[ . 1 . 2]" 1
2026 1 91 LYS QD 1 98 ASP HA 2.580 . 3.360 1.942 1.813 2.797 . 0 0 "[ . 1 . 2]" 1
2027 1 91 LYS QD 1 98 ASP HB2 3.200 . 4.600 3.330 3.169 4.267 . 0 0 "[ . 1 . 2]" 1
2028 1 91 LYS QD 1 98 ASP QB 2.905 . 4.010 3.138 3.015 3.837 . 0 0 "[ . 1 . 2]" 1
2029 1 91 LYS QD 1 98 ASP HB3 3.200 . 4.600 3.853 3.769 4.409 . 0 0 "[ . 1 . 2]" 1
2030 1 91 LYS QD 1 99 THR H 2.935 . 4.070 3.386 3.178 4.080 0.010 2 0 "[ . 1 . 2]" 1
2031 1 91 LYS QE 1 91 LYS HG2 2.340 . 2.880 2.446 2.367 2.756 . 0 0 "[ . 1 . 2]" 1
2032 1 91 LYS QE 1 91 LYS HG3 2.430 . 3.060 2.527 2.423 3.083 0.023 2 0 "[ . 1 . 2]" 1
2033 1 91 LYS QE 1 92 ASP H 3.180 . 4.560 4.510 4.411 4.580 0.020 2 0 "[ . 1 . 2]" 1
2034 1 91 LYS QE 1 99 THR H 3.545 . 5.290 5.072 4.960 5.382 0.092 2 0 "[ . 1 . 2]" 1
2035 1 91 LYS HG2 1 92 ASP H 2.655 . 3.510 2.502 2.153 2.613 . 0 0 "[ . 1 . 2]" 1
2036 1 91 LYS HG2 1 99 THR H 3.455 . 5.110 4.418 4.300 4.799 . 0 0 "[ . 1 . 2]" 1
2037 1 91 LYS HG3 1 92 ASP H 2.635 . 3.470 3.437 3.064 3.488 0.018 16 0 "[ . 1 . 2]" 1
2038 1 91 LYS HG3 1 92 ASP HA 2.945 . 4.090 3.893 3.311 4.039 . 0 0 "[ . 1 . 2]" 1
2039 1 92 ASP H 1 92 ASP HA 2.330 . 2.860 2.838 2.795 2.882 0.022 1 0 "[ . 1 . 2]" 1
2040 1 92 ASP H 1 92 ASP QB 2.190 . 2.580 2.204 2.110 2.380 . 0 0 "[ . 1 . 2]" 1
2041 1 92 ASP H 1 93 CYS H 2.325 . 2.850 2.549 2.383 2.645 . 0 0 "[ . 1 . 2]" 1
2042 1 92 ASP H 1 94 PHE H 3.085 . 4.370 3.881 3.716 4.070 . 0 0 "[ . 1 . 2]" 1
2043 1 92 ASP H 1 97 LEU QD 3.620 . 5.440 5.543 5.484 5.597 0.157 4 0 "[ . 1 . 2]" 1
2044 1 92 ASP H 1 98 ASP HA 3.650 . 5.500 5.504 5.298 5.561 0.061 9 0 "[ . 1 . 2]" 1
2045 1 92 ASP HA 1 92 ASP QB 2.250 . 2.700 2.282 2.177 2.427 . 0 0 "[ . 1 . 2]" 1
2046 1 92 ASP HA 1 94 PHE H 3.650 . 5.500 5.220 5.063 5.393 . 0 0 "[ . 1 . 2]" 1
2047 1 92 ASP QB 1 93 CYS H 2.965 . 4.130 2.807 2.518 3.479 . 0 0 "[ . 1 . 2]" 1
2048 1 92 ASP QB 1 93 CYS HA 3.235 . 4.670 4.615 4.240 4.777 0.107 9 0 "[ . 1 . 2]" 1
2049 1 93 CYS H 1 93 CYS HB2 2.385 . 2.970 2.457 2.295 3.020 0.050 17 0 "[ . 1 . 2]" 1
2050 1 93 CYS H 1 93 CYS HB3 2.775 . 3.750 3.554 3.415 3.736 . 0 0 "[ . 1 . 2]" 1
2051 1 93 CYS H 1 94 PHE H 2.190 . 2.580 2.015 1.901 2.103 . 0 0 "[ . 1 . 2]" 1
2052 1 93 CYS H 1 94 PHE HB2 3.035 . 4.270 3.845 3.731 3.920 . 0 0 "[ . 1 . 2]" 1
2053 1 93 CYS HB2 1 94 PHE H 2.380 . 2.960 2.507 2.172 2.727 . 0 0 "[ . 1 . 2]" 1
2054 1 93 CYS HB2 1 94 PHE HA 3.115 . 4.430 4.433 3.519 4.721 0.291 9 0 "[ . 1 . 2]" 1
2055 1 93 CYS HB2 1 94 PHE QD 2.840 . 3.880 2.599 1.953 3.064 . 0 0 "[ . 1 . 2]" 1
2056 1 93 CYS HB3 1 94 PHE H 2.700 . 3.600 3.143 2.747 3.692 0.092 15 0 "[ . 1 . 2]" 1
2057 1 93 CYS HB3 1 94 PHE HA 3.200 . 4.600 4.013 3.648 4.830 0.230 17 0 "[ . 1 . 2]" 1
2058 1 93 CYS HB3 1 94 PHE QD 3.310 . 4.820 3.263 2.774 4.031 . 0 0 "[ . 1 . 2]" 1
2059 1 94 PHE H 1 94 PHE HB2 2.660 . 3.520 2.262 2.177 2.326 . 0 0 "[ . 1 . 2]" 1
2060 1 94 PHE H 1 94 PHE HB3 2.960 . 4.120 3.528 3.485 3.557 . 0 0 "[ . 1 . 2]" 1
2061 1 94 PHE H 1 94 PHE QD 2.560 . 3.320 1.956 1.763 2.267 0.037 13 0 "[ . 1 . 2]" 1
2062 1 94 PHE H 1 95 LYS H 3.265 . 4.730 4.626 4.596 4.655 . 0 0 "[ . 1 . 2]" 1
2063 1 94 PHE H 1 97 LEU HB3 3.200 . 4.600 4.108 3.945 4.227 . 0 0 "[ . 1 . 2]" 1
2064 1 94 PHE H 1 97 LEU QD 3.620 . 5.440 5.093 5.014 5.171 . 0 0 "[ . 1 . 2]" 1
2065 1 94 PHE HA 1 94 PHE QD 2.455 . 3.110 3.001 2.926 3.047 . 0 0 "[ . 1 . 2]" 1
2066 1 94 PHE HA 1 95 LYS QB 3.295 . 4.790 4.780 4.739 4.837 0.047 16 0 "[ . 1 . 2]" 1
2067 1 94 PHE HA 1 95 LYS QD 3.055 . 4.310 2.591 2.228 3.032 . 0 0 "[ . 1 . 2]" 1
2068 1 94 PHE HA 1 95 LYS QG 3.460 . 5.120 3.469 3.407 3.650 . 0 0 "[ . 1 . 2]" 1
2069 1 94 PHE HA 1 97 LEU QD 3.620 . 5.440 5.164 5.101 5.320 . 0 0 "[ . 1 . 2]" 1
2070 1 94 PHE HB2 1 95 LYS H 2.975 . 4.150 3.950 3.816 4.032 . 0 0 "[ . 1 . 2]" 1
2071 1 94 PHE HB2 1 97 LEU H 3.175 . 4.550 3.897 3.488 4.128 . 0 0 "[ . 1 . 2]" 1
2072 1 94 PHE HB2 1 97 LEU HB3 2.800 . 3.800 1.865 1.772 1.936 0.028 15 0 "[ . 1 . 2]" 1
2073 1 94 PHE HB2 1 97 LEU MD1 3.650 . 5.500 3.747 3.654 3.855 . 0 0 "[ . 1 . 2]" 1
2074 1 94 PHE HB2 1 97 LEU QD 3.120 . 4.440 3.558 3.496 3.602 . 0 0 "[ . 1 . 2]" 1
2075 1 94 PHE HB2 1 97 LEU MD2 3.650 . 5.500 4.444 4.307 4.602 . 0 0 "[ . 1 . 2]" 1
2076 1 94 PHE HB3 1 95 LYS H 2.995 . 4.190 2.672 2.475 2.819 . 0 0 "[ . 1 . 2]" 1
2077 1 94 PHE HB3 1 97 LEU H 2.720 . 3.640 2.572 2.387 2.766 . 0 0 "[ . 1 . 2]" 1
2078 1 94 PHE HB3 1 97 LEU HB3 2.910 . 4.020 1.982 1.867 2.324 . 0 0 "[ . 1 . 2]" 1
2079 1 94 PHE HB3 1 97 LEU MD1 3.190 . 4.580 4.113 3.980 4.363 . 0 0 "[ . 1 . 2]" 1
2080 1 94 PHE HB3 1 97 LEU MD2 3.190 . 4.580 3.772 3.609 3.919 . 0 0 "[ . 1 . 2]" 1
2081 1 94 PHE QD 1 95 LYS H 2.975 . 4.150 3.741 3.367 4.104 . 0 0 "[ . 1 . 2]" 1
2082 1 94 PHE QD 1 97 LEU H 3.145 . 4.490 3.603 3.312 4.077 . 0 0 "[ . 1 . 2]" 1
2083 1 94 PHE QD 1 97 LEU MD1 3.180 . 4.560 4.162 3.992 4.265 . 0 0 "[ . 1 . 2]" 1
2084 1 94 PHE QD 1 97 LEU QD 2.665 . 3.530 2.663 2.424 2.952 . 0 0 "[ . 1 . 2]" 1
2085 1 94 PHE QD 1 97 LEU MD2 3.180 . 4.560 2.696 2.440 3.016 . 0 0 "[ . 1 . 2]" 1
2086 1 95 LYS H 1 95 LYS QB 2.390 . 2.980 2.821 2.760 2.944 . 0 0 "[ . 1 . 2]" 1
2087 1 95 LYS H 1 95 LYS QD 3.080 . 4.360 2.159 1.846 2.342 . 0 0 "[ . 1 . 2]" 1
2088 1 95 LYS H 1 95 LYS QE 3.170 . 4.540 3.526 2.741 3.773 . 0 0 "[ . 1 . 2]" 1
2089 1 95 LYS H 1 95 LYS QG 2.780 . 3.760 1.769 1.738 1.817 0.062 15 0 "[ . 1 . 2]" 1
2090 1 95 LYS H 1 96 SER QB 3.460 . 5.120 4.942 4.646 5.102 . 0 0 "[ . 1 . 2]" 1
2091 1 95 LYS HA 1 95 LYS QB 2.265 . 2.730 2.198 2.161 2.217 . 0 0 "[ . 1 . 2]" 1
2092 1 95 LYS HA 1 95 LYS QD 2.865 . 3.930 2.391 2.264 2.585 . 0 0 "[ . 1 . 2]" 1
2093 1 95 LYS HA 1 95 LYS QG 2.635 . 3.470 3.294 3.254 3.388 . 0 0 "[ . 1 . 2]" 1
2094 1 95 LYS HA 1 97 LEU H 3.530 . 5.260 4.775 4.291 5.104 . 0 0 "[ . 1 . 2]" 1
2095 1 95 LYS QB 1 95 LYS QE 3.120 . 4.440 3.626 3.447 3.888 . 0 0 "[ . 1 . 2]" 1
2096 1 95 LYS QB 1 95 LYS QG 2.375 . 2.950 2.012 2.004 2.022 . 0 0 "[ . 1 . 2]" 1
2097 1 95 LYS QB 1 96 SER H 2.890 . 3.980 2.161 2.093 2.250 . 0 0 "[ . 1 . 2]" 1
2098 1 95 LYS QB 1 96 SER HA 3.045 . 4.290 3.940 3.820 3.974 . 0 0 "[ . 1 . 2]" 1
2099 1 95 LYS QB 1 97 LEU H 3.205 . 4.610 4.199 4.079 4.502 . 0 0 "[ . 1 . 2]" 1
2100 1 95 LYS QD 1 95 LYS QE 2.260 . 2.720 2.069 2.018 2.092 . 0 0 "[ . 1 . 2]" 1
2101 1 95 LYS QD 1 95 LYS QG 2.100 . 2.400 2.096 2.078 2.114 . 0 0 "[ . 1 . 2]" 1
2102 1 95 LYS QD 1 96 SER H 3.430 . 5.060 4.264 4.035 4.338 . 0 0 "[ . 1 . 2]" 1
2103 1 95 LYS QE 1 95 LYS QG 2.475 . 3.150 2.088 1.942 2.407 . 0 0 "[ . 1 . 2]" 1
2104 1 95 LYS QG 1 96 SER H 3.025 . 4.250 3.131 2.693 3.249 . 0 0 "[ . 1 . 2]" 1
2105 1 95 LYS QG 1 96 SER HA 3.650 . 5.500 5.524 5.184 5.605 0.105 9 0 "[ . 1 . 2]" 1
2106 1 95 LYS QG 1 96 SER QB 3.510 . 5.220 4.705 4.356 5.156 . 0 0 "[ . 1 . 2]" 1
2107 1 95 LYS QG 1 97 LEU H 3.160 . 4.520 4.507 4.312 4.600 0.080 18 0 "[ . 1 . 2]" 1
2108 1 96 SER H 1 96 SER QB 2.765 . 3.730 2.447 2.193 2.677 . 0 0 "[ . 1 . 2]" 1
2109 1 96 SER H 1 97 LEU H 2.530 . 3.260 2.241 2.151 2.441 . 0 0 "[ . 1 . 2]" 1
2110 1 96 SER H 1 97 LEU HB3 3.350 . 4.900 4.876 4.779 4.945 0.045 15 0 "[ . 1 . 2]" 1
2111 1 96 SER HA 1 96 SER QB 2.260 . 2.720 2.199 2.158 2.369 . 0 0 "[ . 1 . 2]" 1
2112 1 96 SER HA 1 97 LEU H 2.675 . 3.550 3.451 3.278 3.520 . 0 0 "[ . 1 . 2]" 1
2113 1 96 SER HA 1 97 LEU HB2 3.650 . 5.500 5.529 5.430 5.566 0.066 8 0 "[ . 1 . 2]" 1
2114 1 96 SER QB 1 97 LEU H 3.180 . 4.560 3.351 2.850 3.608 . 0 0 "[ . 1 . 2]" 1
2115 1 97 LEU H 1 97 LEU HB3 2.405 . 3.010 2.941 2.778 3.038 0.028 5 0 "[ . 1 . 2]" 1
2116 1 97 LEU H 1 97 LEU MD1 3.105 . 4.410 4.097 4.032 4.134 . 0 0 "[ . 1 . 2]" 1
2117 1 97 LEU H 1 97 LEU QD 2.840 . 3.880 3.294 3.209 3.454 . 0 0 "[ . 1 . 2]" 1
2118 1 97 LEU H 1 97 LEU MD2 3.105 . 4.410 3.474 3.350 3.707 . 0 0 "[ . 1 . 2]" 1
2119 1 97 LEU H 1 97 LEU HG 3.230 . 4.660 4.543 4.495 4.592 . 0 0 "[ . 1 . 2]" 1
2120 1 97 LEU HA 1 97 LEU MD1 2.825 . 3.850 2.067 1.917 2.218 . 0 0 "[ . 1 . 2]" 1
2121 1 97 LEU HA 1 97 LEU QD 2.475 . 3.150 1.809 1.783 1.862 0.017 5 0 "[ . 1 . 2]" 1
2122 1 97 LEU HA 1 97 LEU MD2 2.825 . 3.850 2.010 1.908 2.169 . 0 0 "[ . 1 . 2]" 1
2123 1 97 LEU HA 1 97 LEU HG 2.800 . 3.800 3.602 3.584 3.635 . 0 0 "[ . 1 . 2]" 1
2124 1 97 LEU HA 1 98 ASP H 2.110 . 2.420 2.224 2.183 2.261 . 0 0 "[ . 1 . 2]" 1
2125 1 97 LEU HA 1 98 ASP QB 3.215 . 4.630 4.255 4.136 4.332 . 0 0 "[ . 1 . 2]" 1
2126 1 97 LEU HA 1 99 THR MG 3.195 . 4.590 4.101 4.001 4.356 . 0 0 "[ . 1 . 2]" 1
2127 1 97 LEU HB2 1 97 LEU MD1 2.805 . 3.810 3.179 3.170 3.189 . 0 0 "[ . 1 . 2]" 1
2128 1 97 LEU HB2 1 97 LEU MD2 2.805 . 3.810 2.221 2.132 2.304 . 0 0 "[ . 1 . 2]" 1
2129 1 97 LEU HB2 1 98 ASP H 3.225 . 4.650 4.614 4.524 4.648 . 0 0 "[ . 1 . 2]" 1
2130 1 97 LEU HB3 1 97 LEU MD1 2.845 . 3.890 2.458 2.396 2.551 . 0 0 "[ . 1 . 2]" 1
2131 1 97 LEU HB3 1 97 LEU MD2 2.845 . 3.890 3.158 3.134 3.175 . 0 0 "[ . 1 . 2]" 1
2132 1 97 LEU HB3 1 98 ASP H 3.225 . 4.650 4.203 4.034 4.233 . 0 0 "[ . 1 . 2]" 1
2133 1 97 LEU HB3 1 98 ASP HA 3.275 . 4.750 4.433 4.356 4.497 . 0 0 "[ . 1 . 2]" 1
2134 1 97 LEU HB3 1 99 THR H 3.650 . 5.500 4.202 4.110 4.288 . 0 0 "[ . 1 . 2]" 1
2135 1 97 LEU HB3 1 99 THR MG 3.650 . 5.500 4.609 4.519 4.714 . 0 0 "[ . 1 . 2]" 1
2136 1 97 LEU QD 1 98 ASP H 2.650 . 3.500 2.304 1.930 2.399 . 0 0 "[ . 1 . 2]" 1
2137 1 97 LEU QD 1 99 THR H 2.700 . 3.600 2.118 2.033 2.187 . 0 0 "[ . 1 . 2]" 1
2138 1 97 LEU QD 1 100 THR H 3.335 . 4.870 4.332 4.266 4.381 . 0 0 "[ . 1 . 2]" 1
2139 1 97 LEU QD 1 100 THR HA 3.535 . 5.270 4.476 4.385 4.532 . 0 0 "[ . 1 . 2]" 1
2140 1 97 LEU QD 1 100 THR MG 3.395 . 4.990 4.996 4.930 5.045 0.055 16 0 "[ . 1 . 2]" 1
2141 1 97 LEU QD 1 101 LEU MD2 3.395 . 4.990 4.471 4.072 4.679 . 0 0 "[ . 1 . 2]" 1
2142 1 97 LEU MD1 1 98 ASP H 3.210 . 4.620 2.331 1.940 2.436 . 0 0 "[ . 1 . 2]" 1
2143 1 97 LEU MD1 1 99 THR H 3.190 . 4.580 2.121 2.035 2.190 . 0 0 "[ . 1 . 2]" 1
2144 1 97 LEU MD1 1 99 THR MG 2.665 . 3.530 1.710 1.677 1.747 0.123 15 0 "[ . 1 . 2]" 1
2145 1 97 LEU MD2 1 98 ASP H 3.210 . 4.620 3.639 3.419 3.881 . 0 0 "[ . 1 . 2]" 1
2146 1 97 LEU MD2 1 99 THR H 3.190 . 4.580 4.809 4.750 4.843 0.263 16 0 "[ . 1 . 2]" 1
2147 1 97 LEU MD2 1 99 THR MG 2.665 . 3.530 3.235 3.146 3.351 . 0 0 "[ . 1 . 2]" 1
2148 1 97 LEU HG 1 98 ASP H 3.385 . 4.970 5.018 4.686 5.096 0.126 3 0 "[ . 1 . 2]" 1
2149 1 97 LEU HG 1 99 THR H 3.650 . 5.500 4.645 4.513 4.767 . 0 0 "[ . 1 . 2]" 1
2150 1 97 LEU HG 1 99 THR MG 2.880 . 3.960 3.731 3.625 3.884 . 0 0 "[ . 1 . 2]" 1
2151 1 98 ASP H 1 98 ASP HB2 2.540 . 3.280 2.862 2.647 2.958 . 0 0 "[ . 1 . 2]" 1
2152 1 98 ASP H 1 98 ASP HB3 2.540 . 3.280 2.831 2.781 3.066 . 0 0 "[ . 1 . 2]" 1
2153 1 98 ASP H 1 99 THR H 2.705 . 3.610 3.522 3.395 3.570 . 0 0 "[ . 1 . 2]" 1
2154 1 98 ASP H 1 99 THR HA 3.490 . 5.180 5.248 5.187 5.298 0.118 13 0 "[ . 1 . 2]" 1
2155 1 98 ASP H 1 99 THR MG 2.745 . 3.690 3.722 3.574 3.784 0.094 12 0 "[ . 1 . 2]" 1
2156 1 98 ASP HA 1 99 THR H 2.210 . 2.620 2.391 2.365 2.410 . 0 0 "[ . 1 . 2]" 1
2157 1 98 ASP HA 1 99 THR MG 3.295 . 4.790 4.491 4.286 4.580 . 0 0 "[ . 1 . 2]" 1
2158 1 98 ASP QB 1 99 THR H 2.955 . 4.110 4.025 3.993 4.041 . 0 0 "[ . 1 . 2]" 1
2159 1 98 ASP HB2 1 99 THR H 3.280 . 4.760 4.648 4.635 4.661 . 0 0 "[ . 1 . 2]" 1
2160 1 98 ASP HB3 1 99 THR H 3.280 . 4.760 4.410 4.348 4.430 . 0 0 "[ . 1 . 2]" 1
2161 1 99 THR H 1 99 THR HB 2.660 . 3.520 3.501 3.461 3.582 0.062 9 0 "[ . 1 . 2]" 1
2162 1 99 THR H 1 99 THR MG 2.305 . 2.810 2.704 2.574 2.820 0.010 11 0 "[ . 1 . 2]" 1
2163 1 99 THR H 1 100 THR MG 3.175 . 4.550 4.490 4.379 4.561 0.011 8 0 "[ . 1 . 2]" 1
2164 1 99 THR HA 1 99 THR MG 2.745 . 3.690 3.189 3.183 3.196 . 0 0 "[ . 1 . 2]" 1
2165 1 99 THR HB 1 100 THR H 2.715 . 3.630 3.446 3.393 3.514 . 0 0 "[ . 1 . 2]" 1
2166 1 99 THR MG 1 100 THR H 2.530 . 3.260 2.593 2.485 2.661 . 0 0 "[ . 1 . 2]" 1
2167 1 99 THR MG 1 100 THR HA 2.940 . 4.080 3.602 3.538 3.724 . 0 0 "[ . 1 . 2]" 1
2168 1 99 THR MG 1 101 LEU MD1 3.470 . 5.140 4.710 4.492 5.076 . 0 0 "[ . 1 . 2]" 1
2169 1 99 THR MG 1 102 GLN H 3.260 . 4.720 4.162 3.901 4.310 . 0 0 "[ . 1 . 2]" 1
2170 1 99 THR MG 1 102 GLN HG3 3.130 . 4.460 3.769 3.417 4.298 . 0 0 "[ . 1 . 2]" 1
2171 1 100 THR H 1 100 THR HB 2.925 . 4.050 3.789 3.743 3.846 . 0 0 "[ . 1 . 2]" 1
2172 1 100 THR H 1 100 THR MG 2.380 . 2.960 2.981 2.919 3.045 0.085 1 0 "[ . 1 . 2]" 1
2173 1 100 THR H 1 101 LEU H 3.135 . 4.470 4.466 4.451 4.475 0.005 19 0 "[ . 1 . 2]" 1
2174 1 100 THR H 1 102 GLN HG2 3.220 . 4.640 3.654 3.103 4.654 0.014 19 0 "[ . 1 . 2]" 1
2175 1 100 THR H 1 102 GLN HG3 3.305 . 4.810 4.001 3.618 4.803 . 0 0 "[ . 1 . 2]" 1
2176 1 100 THR HA 1 100 THR MG 2.380 . 2.960 2.331 2.272 2.391 . 0 0 "[ . 1 . 2]" 1
2177 1 100 THR HA 1 101 LEU H 2.335 . 2.870 2.459 2.426 2.536 . 0 0 "[ . 1 . 2]" 1
2178 1 100 THR HA 1 101 LEU MD1 3.505 . 5.210 4.655 4.415 5.226 0.016 16 0 "[ . 1 . 2]" 1
2179 1 100 THR HB 1 101 LEU H 2.255 . 2.710 2.249 2.163 2.315 . 0 0 "[ . 1 . 2]" 1
2180 1 100 THR HB 1 102 GLN H 3.650 . 5.500 4.814 4.570 5.079 . 0 0 "[ . 1 . 2]" 1
2181 1 100 THR MG 1 101 LEU H 2.805 . 3.810 3.514 3.411 3.665 . 0 0 "[ . 1 . 2]" 1
2182 1 101 LEU H 1 101 LEU MD1 2.915 . 4.030 3.566 3.397 3.946 . 0 0 "[ . 1 . 2]" 1
2183 1 101 LEU H 1 101 LEU MD2 2.430 . 3.060 1.786 1.756 1.825 0.044 2 0 "[ . 1 . 2]" 1
2184 1 101 LEU H 1 101 LEU HG 2.905 . 4.010 3.760 3.705 3.825 . 0 0 "[ . 1 . 2]" 1
2185 1 101 LEU H 1 102 GLN H 3.070 . 4.340 3.995 3.872 4.132 . 0 0 "[ . 1 . 2]" 1
2186 1 101 LEU HA 1 101 LEU MD1 2.505 . 3.210 1.938 1.854 2.053 . 0 0 "[ . 1 . 2]" 1
2187 1 101 LEU HA 1 101 LEU MD2 3.170 . 4.540 2.561 2.169 2.745 . 0 0 "[ . 1 . 2]" 1
2188 1 101 LEU HA 1 101 LEU HG 2.995 . 4.190 3.676 3.647 3.717 . 0 0 "[ . 1 . 2]" 1
2189 1 101 LEU HA 1 102 GLN H 2.190 . 2.580 2.301 2.236 2.345 . 0 0 "[ . 1 . 2]" 1
2190 1 101 LEU HA 1 102 GLN HB2 3.195 . 4.590 4.528 4.346 4.623 0.033 4 0 "[ . 1 . 2]" 1
2191 1 101 LEU HA 1 103 PHE H 3.200 . 4.600 4.269 4.150 4.377 . 0 0 "[ . 1 . 2]" 1
2192 1 101 LEU QB 1 101 LEU MD1 2.480 . 3.160 2.259 2.184 2.303 . 0 0 "[ . 1 . 2]" 1
2193 1 101 LEU QB 1 102 GLN H 2.890 . 3.980 3.839 3.793 3.869 . 0 0 "[ . 1 . 2]" 1
2194 1 101 LEU QB 1 102 GLN HA 3.280 . 4.760 4.678 4.631 4.760 0.000 6 0 "[ . 1 . 2]" 1
2195 1 101 LEU MD1 1 102 GLN H 2.780 . 3.760 3.802 3.752 3.834 0.074 1 0 "[ . 1 . 2]" 1
2196 1 101 LEU MD1 1 103 PHE H 3.425 . 5.050 4.766 4.574 5.008 . 0 0 "[ . 1 . 2]" 1
2197 1 102 GLN H 1 102 GLN HB2 2.410 . 3.020 2.399 2.189 2.579 . 0 0 "[ . 1 . 2]" 1
2198 1 102 GLN H 1 102 GLN HB3 2.715 . 3.630 3.557 3.499 3.579 . 0 0 "[ . 1 . 2]" 1
2199 1 102 GLN H 1 102 GLN HG2 2.640 . 3.480 2.567 2.053 3.341 . 0 0 "[ . 1 . 2]" 1
2200 1 102 GLN H 1 102 GLN HG3 2.625 . 3.450 3.060 2.748 3.565 0.115 4 0 "[ . 1 . 2]" 1
2201 1 102 GLN H 1 103 PHE H 2.365 . 2.930 2.994 2.960 3.035 0.105 6 0 "[ . 1 . 2]" 1
2202 1 102 GLN HA 1 102 GLN HG2 2.635 . 3.470 2.456 2.030 3.363 . 0 0 "[ . 1 . 2]" 1
2203 1 102 GLN HA 1 102 GLN HG3 2.705 . 3.610 3.540 3.270 3.674 0.064 1 0 "[ . 1 . 2]" 1
2204 1 102 GLN HB2 1 103 PHE H 2.480 . 3.160 2.216 2.007 2.462 . 0 0 "[ . 1 . 2]" 1
2205 1 102 GLN HB2 1 103 PHE QD 3.175 . 4.550 3.637 3.413 3.854 . 0 0 "[ . 1 . 2]" 1
2206 1 102 GLN HB2 1 103 PHE QE 2.970 . 4.140 3.540 3.402 3.690 . 0 0 "[ . 1 . 2]" 1
2207 1 102 GLN HB3 1 103 PHE H 2.465 . 3.130 3.051 2.736 3.193 0.063 4 0 "[ . 1 . 2]" 1
2208 1 102 GLN HB3 1 103 PHE QE 2.965 . 4.130 2.762 2.663 2.857 . 0 0 "[ . 1 . 2]" 1
2209 1 102 GLN HG3 1 103 PHE H 3.380 . 4.960 4.460 4.304 4.632 . 0 0 "[ . 1 . 2]" 1
2210 1 102 GLN HG3 1 103 PHE QE 3.650 . 5.500 4.441 4.059 4.686 . 0 0 "[ . 1 . 2]" 1
2211 1 103 PHE H 1 103 PHE QB 2.850 . 3.900 3.335 3.284 3.370 . 0 0 "[ . 1 . 2]" 1
2212 1 103 PHE H 1 104 PRO HA 3.375 . 4.950 4.888 4.839 4.935 . 0 0 "[ . 1 . 2]" 1
2213 1 103 PHE HA 1 103 PHE QD 2.810 . 3.820 3.506 3.387 3.554 . 0 0 "[ . 1 . 2]" 1
2214 1 103 PHE HA 1 103 PHE QE 3.650 . 5.500 5.390 5.304 5.420 . 0 0 "[ . 1 . 2]" 1
2215 1 103 PHE HA 1 104 PRO QB 3.210 . 4.620 4.579 4.544 4.610 . 0 0 "[ . 1 . 2]" 1
2216 1 103 PHE HA 1 104 PRO HD2 2.505 . 3.210 2.391 2.243 2.584 . 0 0 "[ . 1 . 2]" 1
2217 1 103 PHE HA 1 104 PRO HD3 2.615 . 3.430 2.167 2.086 2.225 . 0 0 "[ . 1 . 2]" 1
2218 1 103 PHE HA 1 104 PRO HG2 3.215 . 4.630 4.498 4.402 4.630 0.000 19 0 "[ . 1 . 2]" 1
2219 1 103 PHE HA 1 104 PRO HG3 3.255 . 4.710 4.374 4.322 4.427 . 0 0 "[ . 1 . 2]" 1
2220 1 103 PHE QB 1 104 PRO HD3 3.185 . 4.570 3.360 3.145 3.562 . 0 0 "[ . 1 . 2]" 1
2221 1 104 PRO HA 1 105 PHE H 2.240 . 2.680 2.234 2.187 2.306 . 0 0 "[ . 1 . 2]" 1
2222 1 104 PRO HA 1 105 PHE HA 3.145 . 4.490 4.368 4.348 4.388 . 0 0 "[ . 1 . 2]" 1
2223 1 104 PRO HA 1 105 PHE HB3 3.115 . 4.430 4.344 4.283 4.392 . 0 0 "[ . 1 . 2]" 1
2224 1 104 PRO HA 1 105 PHE QD 2.940 . 4.080 3.728 3.522 3.932 . 0 0 "[ . 1 . 2]" 1
2225 1 104 PRO HA 1 106 LYS H 2.985 . 4.170 3.904 3.805 4.007 . 0 0 "[ . 1 . 2]" 1
2226 1 104 PRO HA 1 107 GLU H 3.390 . 4.980 4.613 4.491 4.715 . 0 0 "[ . 1 . 2]" 1
2227 1 104 PRO QB 1 105 PHE H 2.585 . 3.370 3.054 2.849 3.252 . 0 0 "[ . 1 . 2]" 1
2228 1 104 PRO QB 1 105 PHE HA 3.650 . 5.500 4.670 4.540 4.779 . 0 0 "[ . 1 . 2]" 1
2229 1 104 PRO QB 1 105 PHE QD 3.070 . 4.340 3.432 3.308 3.591 . 0 0 "[ . 1 . 2]" 1
2230 1 104 PRO QB 1 105 PHE QE 3.440 . 5.080 4.446 4.207 4.701 . 0 0 "[ . 1 . 2]" 1
2231 1 104 PRO QB 1 106 LYS H 2.495 . 3.190 2.465 2.235 2.564 . 0 0 "[ . 1 . 2]" 1
2232 1 104 PRO QB 1 106 LYS HB2 2.890 . 3.980 2.617 2.475 2.897 . 0 0 "[ . 1 . 2]" 1
2233 1 104 PRO QB 1 107 GLU H 2.370 . 2.940 3.008 2.967 3.041 0.101 18 0 "[ . 1 . 2]" 1
2234 1 104 PRO HD2 1 107 GLU HB2 3.275 . 4.750 2.803 2.580 3.053 . 0 0 "[ . 1 . 2]" 1
2235 1 104 PRO HD2 1 107 GLU QB 2.935 . 4.070 2.745 2.523 2.992 . 0 0 "[ . 1 . 2]" 1
2236 1 104 PRO HD2 1 107 GLU HB3 3.275 . 4.750 3.921 3.567 4.299 . 0 0 "[ . 1 . 2]" 1
2237 1 104 PRO HD3 1 107 GLU H 3.600 . 5.400 5.433 5.306 5.500 0.100 4 0 "[ . 1 . 2]" 1
2238 1 104 PRO HG2 1 106 LYS H 3.030 . 4.260 4.098 3.754 4.246 . 0 0 "[ . 1 . 2]" 1
2239 1 104 PRO HG2 1 107 GLU H 3.080 . 4.360 2.883 2.586 2.999 . 0 0 "[ . 1 . 2]" 1
2240 1 104 PRO HG2 1 107 GLU QB 2.575 . 3.350 2.291 1.996 2.629 . 0 0 "[ . 1 . 2]" 1
2241 1 104 PRO HG3 1 106 LYS H 3.540 . 5.280 5.082 4.778 5.221 . 0 0 "[ . 1 . 2]" 1
2242 1 105 PHE H 1 105 PHE HB2 2.760 . 3.720 3.532 3.516 3.552 . 0 0 "[ . 1 . 2]" 1
2243 1 105 PHE H 1 105 PHE HB3 2.370 . 2.940 2.239 2.205 2.280 . 0 0 "[ . 1 . 2]" 1
2244 1 105 PHE H 1 105 PHE QD 2.360 . 2.920 2.066 1.995 2.123 . 0 0 "[ . 1 . 2]" 1
2245 1 105 PHE H 1 105 PHE QE 3.060 . 4.320 4.406 4.330 4.472 0.152 5 0 "[ . 1 . 2]" 1
2246 1 105 PHE H 1 106 LYS H 2.585 . 3.370 2.678 2.517 2.809 . 0 0 "[ . 1 . 2]" 1
2247 1 105 PHE H 1 106 LYS HB2 3.220 . 4.640 4.554 4.335 4.681 0.041 16 0 "[ . 1 . 2]" 1
2248 1 105 PHE H 1 107 GLU H 3.195 . 4.590 4.202 4.097 4.278 . 0 0 "[ . 1 . 2]" 1
2249 1 105 PHE HA 1 105 PHE QD 2.760 . 3.720 3.672 3.658 3.687 . 0 0 "[ . 1 . 2]" 1
2250 1 105 PHE HA 1 107 GLU H 2.955 . 4.110 3.797 3.721 3.965 . 0 0 "[ . 1 . 2]" 1
2251 1 105 PHE HB2 1 106 LYS H 3.030 . 4.260 4.133 4.016 4.287 0.027 10 0 "[ . 1 . 2]" 1
2252 1 105 PHE HB3 1 106 LYS H 2.930 . 4.060 3.801 3.715 3.949 . 0 0 "[ . 1 . 2]" 1
2253 1 105 PHE QD 1 106 LYS H 2.510 . 3.220 2.384 2.221 2.831 . 0 0 "[ . 1 . 2]" 1
2254 1 105 PHE QD 1 106 LYS HA 3.175 . 4.550 3.875 3.791 3.998 . 0 0 "[ . 1 . 2]" 1
2255 1 105 PHE QD 1 106 LYS HG2 3.210 . 4.620 3.610 3.363 3.665 . 0 0 "[ . 1 . 2]" 1
2256 1 105 PHE QD 1 106 LYS HG3 2.810 . 3.820 3.802 3.560 3.896 0.076 15 0 "[ . 1 . 2]" 1
2257 1 105 PHE QE 1 106 LYS H 2.910 . 4.020 3.524 3.334 4.011 . 0 0 "[ . 1 . 2]" 1
2258 1 105 PHE QE 1 106 LYS HA 3.105 . 4.410 3.952 3.833 4.223 . 0 0 "[ . 1 . 2]" 1
2259 1 105 PHE QE 1 106 LYS QD 2.785 . 3.770 3.756 3.447 3.836 0.066 11 0 "[ . 1 . 2]" 1
2260 1 105 PHE QE 1 106 LYS QE 2.960 . 4.120 3.948 3.626 4.219 0.099 6 0 "[ . 1 . 2]" 1
2261 1 105 PHE QE 1 106 LYS HG2 2.850 . 3.900 2.794 2.705 2.907 . 0 0 "[ . 1 . 2]" 1
2262 1 105 PHE QE 1 106 LYS HG3 2.760 . 3.720 2.402 2.328 2.510 . 0 0 "[ . 1 . 2]" 1
2263 1 106 LYS H 1 106 LYS HB2 2.220 . 2.640 2.148 2.056 2.323 . 0 0 "[ . 1 . 2]" 1
2264 1 106 LYS H 1 106 LYS HB3 2.775 . 3.750 3.464 3.400 3.579 . 0 0 "[ . 1 . 2]" 1
2265 1 106 LYS H 1 106 LYS QD 3.205 . 4.610 4.580 4.515 4.610 0.000 15 0 "[ . 1 . 2]" 1
2266 1 106 LYS H 1 106 LYS QE 3.315 . 4.830 4.501 4.383 4.588 . 0 0 "[ . 1 . 2]" 1
2267 1 106 LYS H 1 106 LYS HG2 2.450 . 3.100 3.069 2.928 3.115 0.015 1 0 "[ . 1 . 2]" 1
2268 1 106 LYS H 1 106 LYS HG3 2.490 . 3.180 3.307 3.159 3.402 0.222 2 0 "[ . 1 . 2]" 1
2269 1 106 LYS H 1 107 GLU H 2.295 . 2.790 2.597 2.384 2.681 . 0 0 "[ . 1 . 2]" 1
2270 1 106 LYS H 1 107 GLU HA 3.430 . 5.060 5.145 4.963 5.190 0.130 2 0 "[ . 1 . 2]" 1
2271 1 106 LYS H 1 107 GLU QB 3.175 . 4.550 4.263 3.981 4.368 . 0 0 "[ . 1 . 2]" 1
2272 1 106 LYS HA 1 106 LYS QD 3.090 . 4.380 3.528 3.440 3.688 . 0 0 "[ . 1 . 2]" 1
2273 1 106 LYS HA 1 106 LYS HE2 2.985 . 4.170 2.326 1.968 3.993 . 0 0 "[ . 1 . 2]" 1
2274 1 106 LYS HA 1 106 LYS QE 2.685 . 3.570 2.136 1.960 2.320 . 0 0 "[ . 1 . 2]" 1
2275 1 106 LYS HA 1 106 LYS HE3 2.985 . 4.170 3.598 2.239 4.028 . 0 0 "[ . 1 . 2]" 1
2276 1 106 LYS HA 1 106 LYS HG2 2.940 . 4.080 2.090 2.029 2.259 . 0 0 "[ . 1 . 2]" 1
2277 1 106 LYS HA 1 106 LYS HG3 2.795 . 3.790 3.425 3.384 3.546 . 0 0 "[ . 1 . 2]" 1
2278 1 106 LYS HA 1 107 GLU H 2.665 . 3.530 3.453 3.419 3.471 . 0 0 "[ . 1 . 2]" 1
2279 1 106 LYS HB2 1 107 GLU H 2.480 . 3.160 3.159 3.045 3.218 0.058 1 0 "[ . 1 . 2]" 1
2280 1 106 LYS HB3 1 106 LYS HE2 2.895 . 3.990 3.028 2.270 3.572 . 0 0 "[ . 1 . 2]" 1
2281 1 106 LYS HB3 1 106 LYS HE3 2.895 . 3.990 3.586 2.289 3.844 . 0 0 "[ . 1 . 2]" 1
2282 1 106 LYS HB3 1 107 GLU H 2.960 . 4.120 3.676 3.578 3.957 . 0 0 "[ . 1 . 2]" 1
2283 1 106 LYS QE 1 106 LYS HG3 2.670 . 3.540 3.378 3.283 3.468 . 0 0 "[ . 1 . 2]" 1
2284 1 106 LYS HE2 1 106 LYS HG2 2.805 . 3.810 2.461 2.218 3.677 . 0 0 "[ . 1 . 2]" 1
2285 1 106 LYS HE2 1 106 LYS HG3 2.980 . 4.160 3.634 3.499 4.246 0.086 6 0 "[ . 1 . 2]" 1
2286 1 106 LYS HE3 1 106 LYS HG2 2.805 . 3.810 3.348 2.351 3.564 . 0 0 "[ . 1 . 2]" 1
2287 1 106 LYS HE3 1 106 LYS HG3 2.980 . 4.160 4.117 3.615 4.229 0.069 19 0 "[ . 1 . 2]" 1
2288 1 107 GLU H 1 107 GLU HA 2.305 . 2.810 2.834 2.783 2.863 0.053 9 0 "[ . 1 . 2]" 1
2289 1 107 GLU H 1 107 GLU QB 2.200 . 2.600 2.053 2.023 2.075 . 0 0 "[ . 1 . 2]" 1
2290 1 107 GLU H 1 107 GLU HG2 2.970 . 4.140 4.210 4.090 4.281 0.141 12 0 "[ . 1 . 2]" 1
2291 1 107 GLU H 1 107 GLU QG 2.675 . 3.550 3.418 3.235 3.594 0.044 9 0 "[ . 1 . 2]" 1
2292 1 107 GLU H 1 107 GLU HG3 2.970 . 4.140 3.622 3.354 3.897 . 0 0 "[ . 1 . 2]" 1
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