NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
408200 |
1yr1   |
6395 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1yr1
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 2746
_Distance_constraint_stats_list.Viol_count 3374
_Distance_constraint_stats_list.Viol_total 3442.568
_Distance_constraint_stats_list.Viol_max 0.189
_Distance_constraint_stats_list.Viol_rms 0.0118
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0020
_Distance_constraint_stats_list.Viol_average_violations_only 0.0408
_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 1 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 2 SER 0.059 0.031 22 0 "[ . 1 . 2 .]"
1 3 GLU 0.147 0.031 22 0 "[ . 1 . 2 .]"
1 4 TRP 1.199 0.066 8 0 "[ . 1 . 2 .]"
1 5 ARG 0.165 0.016 16 0 "[ . 1 . 2 .]"
1 6 ARG 0.059 0.010 21 0 "[ . 1 . 2 .]"
1 7 ILE 2.801 0.121 12 0 "[ . 1 . 2 .]"
1 8 ALA 6.647 0.143 7 0 "[ . 1 . 2 .]"
1 9 TYR 3.534 0.084 17 0 "[ . 1 . 2 .]"
1 10 VAL 1.764 0.037 23 0 "[ . 1 . 2 .]"
1 11 TYR 0.134 0.024 9 0 "[ . 1 . 2 .]"
1 12 ASP 1.221 0.037 16 0 "[ . 1 . 2 .]"
1 13 ARG 1.998 0.089 24 0 "[ . 1 . 2 .]"
1 14 GLN 1.793 0.089 24 0 "[ . 1 . 2 .]"
1 15 THR 0.743 0.027 15 0 "[ . 1 . 2 .]"
1 16 PHE 3.228 0.086 13 0 "[ . 1 . 2 .]"
1 17 PHE 6.732 0.134 20 0 "[ . 1 . 2 .]"
1 18 PRO 1.053 0.039 24 0 "[ . 1 . 2 .]"
1 19 LEU 17.074 0.147 24 0 "[ . 1 . 2 .]"
1 20 LEU 1.629 0.045 21 0 "[ . 1 . 2 .]"
1 21 GLU 1.673 0.064 23 0 "[ . 1 . 2 .]"
1 22 ASN 2.517 0.064 24 0 "[ . 1 . 2 .]"
1 23 GLY 2.052 0.064 24 0 "[ . 1 . 2 .]"
1 24 ARG 1.943 0.066 17 0 "[ . 1 . 2 .]"
1 25 LEU 3.085 0.101 4 0 "[ . 1 . 2 .]"
1 26 LEU 0.950 0.047 25 0 "[ . 1 . 2 .]"
1 27 LYS 2.804 0.067 14 0 "[ . 1 . 2 .]"
1 28 GLN 3.372 0.072 22 0 "[ . 1 . 2 .]"
1 29 GLU 1.602 0.072 22 0 "[ . 1 . 2 .]"
1 30 GLY 5.370 0.134 20 0 "[ . 1 . 2 .]"
1 31 THR 5.591 0.106 12 0 "[ . 1 . 2 .]"
1 32 LYS 3.101 0.181 12 0 "[ . 1 . 2 .]"
1 33 THR 2.545 0.106 12 0 "[ . 1 . 2 .]"
1 34 ALA 0.488 0.055 6 0 "[ . 1 . 2 .]"
1 35 PRO 2.872 0.079 16 0 "[ . 1 . 2 .]"
1 36 SER 3.444 0.145 9 0 "[ . 1 . 2 .]"
1 37 ASP 4.715 0.154 12 0 "[ . 1 . 2 .]"
1 38 ALA 11.284 0.154 12 0 "[ . 1 . 2 .]"
1 39 PRO 4.140 0.121 25 0 "[ . 1 . 2 .]"
1 40 VAL 1.057 0.048 16 0 "[ . 1 . 2 .]"
1 41 LEU 6.214 0.091 22 0 "[ . 1 . 2 .]"
1 42 VAL 1.083 0.060 23 0 "[ . 1 . 2 .]"
1 43 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 44 TRP 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 45 LYS 0.028 0.017 15 0 "[ . 1 . 2 .]"
1 46 ASP 1.678 0.050 7 0 "[ . 1 . 2 .]"
1 47 GLY 2.253 0.065 5 0 "[ . 1 . 2 .]"
1 48 ASP 2.480 0.046 13 0 "[ . 1 . 2 .]"
1 49 ALA 2.250 0.050 7 0 "[ . 1 . 2 .]"
1 50 ILE 3.980 0.147 24 0 "[ . 1 . 2 .]"
1 51 ALA 1.386 0.065 5 0 "[ . 1 . 2 .]"
1 52 GLU 2.764 0.110 25 0 "[ . 1 . 2 .]"
1 53 MET 3.177 0.113 6 0 "[ . 1 . 2 .]"
1 54 THR 4.863 0.121 12 0 "[ . 1 . 2 .]"
1 55 GLY 0.003 0.003 9 0 "[ . 1 . 2 .]"
1 56 GLN 2.631 0.110 25 0 "[ . 1 . 2 .]"
1 57 LEU 4.561 0.113 6 0 "[ . 1 . 2 .]"
1 58 ALA 1.040 0.056 22 0 "[ . 1 . 2 .]"
1 59 GLU 4.624 0.070 18 0 "[ . 1 . 2 .]"
1 60 LEU 4.378 0.093 15 0 "[ . 1 . 2 .]"
1 61 PRO 2.025 0.051 15 0 "[ . 1 . 2 .]"
1 62 ALA 1.036 0.088 16 0 "[ . 1 . 2 .]"
1 63 ALA 3.121 0.088 13 0 "[ . 1 . 2 .]"
1 64 VAL 3.654 0.073 5 0 "[ . 1 . 2 .]"
1 65 LEU 2.946 0.068 22 0 "[ . 1 . 2 .]"
1 66 GLY 2.129 0.064 2 0 "[ . 1 . 2 .]"
1 67 ALA 3.982 0.088 13 0 "[ . 1 . 2 .]"
1 68 MET 0.274 0.041 13 0 "[ . 1 . 2 .]"
1 69 SER 0.489 0.046 13 0 "[ . 1 . 2 .]"
1 70 GLU 0.395 0.028 4 0 "[ . 1 . 2 .]"
1 71 ILE 2.168 0.060 23 0 "[ . 1 . 2 .]"
1 72 HIS 0.749 0.039 16 0 "[ . 1 . 2 .]"
1 73 TYR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 74 LYS 0.312 0.024 24 0 "[ . 1 . 2 .]"
1 75 PRO 1.512 0.073 14 0 "[ . 1 . 2 .]"
1 76 THR 3.223 0.073 14 0 "[ . 1 . 2 .]"
1 77 ARG 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 78 GLU 0.284 0.029 16 0 "[ . 1 . 2 .]"
1 79 TYR 1.311 0.052 24 0 "[ . 1 . 2 .]"
1 80 GLU 0.132 0.028 18 0 "[ . 1 . 2 .]"
1 81 ASP 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 82 ARG 1.062 0.052 24 0 "[ . 1 . 2 .]"
1 83 VAL 2.177 0.082 7 0 "[ . 1 . 2 .]"
1 84 ILE 2.246 0.134 23 0 "[ . 1 . 2 .]"
1 85 VAL 1.926 0.062 5 0 "[ . 1 . 2 .]"
1 86 TYR 0.892 0.046 13 0 "[ . 1 . 2 .]"
1 87 MET 2.519 0.094 20 0 "[ . 1 . 2 .]"
1 88 ASN 0.122 0.019 19 0 "[ . 1 . 2 .]"
1 89 ASP 6.259 0.189 23 0 "[ . 1 . 2 .]"
1 90 GLY 0.292 0.024 8 0 "[ . 1 . 2 .]"
1 91 TYR 0.174 0.021 20 0 "[ . 1 . 2 .]"
1 92 GLU 0.129 0.020 1 0 "[ . 1 . 2 .]"
1 93 VAL 0.803 0.090 22 0 "[ . 1 . 2 .]"
1 94 SER 1.527 0.134 23 0 "[ . 1 . 2 .]"
1 95 ALA 0.896 0.063 14 0 "[ . 1 . 2 .]"
1 96 THR 4.254 0.160 3 0 "[ . 1 . 2 .]"
1 97 ILE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 98 ARG 1.071 0.060 9 0 "[ . 1 . 2 .]"
1 99 GLN 0.164 0.034 20 0 "[ . 1 . 2 .]"
1 100 PHE 0.165 0.028 7 0 "[ . 1 . 2 .]"
1 101 ALA 4.267 0.093 15 0 "[ . 1 . 2 .]"
1 102 ASP 3.376 0.102 8 0 "[ . 1 . 2 .]"
1 103 LYS 4.498 0.160 3 0 "[ . 1 . 2 .]"
1 104 LEU 1.627 0.080 23 0 "[ . 1 . 2 .]"
1 105 SER 2.494 0.095 15 0 "[ . 1 . 2 .]"
1 106 HIS 2.150 0.122 7 0 "[ . 1 . 2 .]"
1 107 TYR 0.127 0.090 22 0 "[ . 1 . 2 .]"
1 108 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 109 ALA 2.246 0.120 11 0 "[ . 1 . 2 .]"
1 110 ILE 2.422 0.103 23 0 "[ . 1 . 2 .]"
1 111 ALA 1.241 0.061 17 0 "[ . 1 . 2 .]"
1 112 ALA 2.239 0.120 11 0 "[ . 1 . 2 .]"
1 113 ALA 1.894 0.103 23 0 "[ . 1 . 2 .]"
1 114 LEU 1.593 0.061 17 0 "[ . 1 . 2 .]"
1 115 ASP 0.921 0.066 20 0 "[ . 1 . 2 .]"
1 116 ARG 1.005 0.082 25 0 "[ . 1 . 2 .]"
1 117 ASN 0.643 0.082 25 0 "[ . 1 . 2 .]"
1 118 VAL 0.218 0.136 21 0 "[ . 1 . 2 .]"
1 119 LYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 GLY QA 1 2 SER HA 4.090 . 6.380 4.010 3.934 4.176 . 0 0 "[ . 1 . 2 .]" 1
2 1 2 SER HA 1 2 SER HB2 2.425 . 3.050 2.805 2.317 3.029 . 0 0 "[ . 1 . 2 .]" 1
3 1 2 SER HA 1 2 SER HB3 2.425 . 3.050 2.598 2.293 3.028 . 0 0 "[ . 1 . 2 .]" 1
4 1 2 SER HA 1 3 GLU H 2.675 . 3.550 2.682 2.138 3.581 0.031 22 0 "[ . 1 . 2 .]" 1
5 1 2 SER HA 1 3 GLU HA 3.635 . 5.470 4.506 4.330 5.330 . 0 0 "[ . 1 . 2 .]" 1
6 1 2 SER QB 1 3 GLU QB 4.525 . 7.250 4.276 3.133 5.353 . 0 0 "[ . 1 . 2 .]" 1
7 1 2 SER QB 1 3 GLU QG 4.275 . 6.750 4.575 3.217 5.251 . 0 0 "[ . 1 . 2 .]" 1
8 1 3 GLU HA 1 3 GLU HB2 2.395 . 2.990 2.919 2.713 3.006 0.016 23 0 "[ . 1 . 2 .]" 1
9 1 3 GLU HA 1 3 GLU HB3 2.395 . 2.990 2.737 2.580 2.956 . 0 0 "[ . 1 . 2 .]" 1
10 1 3 GLU HA 1 3 GLU HG2 2.595 . 3.390 2.502 2.047 3.362 . 0 0 "[ . 1 . 2 .]" 1
11 1 3 GLU HA 1 3 GLU QG 2.390 . 2.980 2.194 2.031 2.356 . 0 0 "[ . 1 . 2 .]" 1
12 1 3 GLU HA 1 3 GLU HG3 2.595 . 3.390 2.723 2.093 3.394 0.004 18 0 "[ . 1 . 2 .]" 1
13 1 3 GLU HA 1 4 TRP H 2.270 . 2.740 2.619 2.502 2.729 . 0 0 "[ . 1 . 2 .]" 1
14 1 3 GLU HA 1 4 TRP HA 3.200 . 4.600 4.351 4.309 4.488 . 0 0 "[ . 1 . 2 .]" 1
15 1 3 GLU HA 1 4 TRP HD1 3.450 . 5.100 4.565 3.594 5.032 . 0 0 "[ . 1 . 2 .]" 1
16 1 3 GLU HA 1 4 TRP HE1 3.650 . 5.500 5.136 4.247 5.508 0.008 5 0 "[ . 1 . 2 .]" 1
17 1 3 GLU QB 1 4 TRP H 2.565 . 3.330 2.134 1.982 2.452 . 0 0 "[ . 1 . 2 .]" 1
18 1 3 GLU QB 1 4 TRP HA 3.565 . 5.330 4.213 3.966 4.380 . 0 0 "[ . 1 . 2 .]" 1
19 1 3 GLU HB2 1 4 TRP H 2.735 . 3.670 3.589 3.424 3.679 0.009 18 0 "[ . 1 . 2 .]" 1
20 1 3 GLU HB3 1 4 TRP H 2.735 . 3.670 2.151 1.993 2.489 . 0 0 "[ . 1 . 2 .]" 1
21 1 3 GLU QG 1 4 TRP H 3.155 . 4.510 2.975 1.987 3.422 . 0 0 "[ . 1 . 2 .]" 1
22 1 3 GLU QG 1 4 TRP HD1 3.685 . 5.570 4.260 3.176 4.738 . 0 0 "[ . 1 . 2 .]" 1
23 1 3 GLU QG 1 4 TRP HE1 4.090 . 6.380 5.183 4.277 5.638 . 0 0 "[ . 1 . 2 .]" 1
24 1 3 GLU HG2 1 4 TRP H 3.310 . 4.820 3.095 1.997 3.823 . 0 0 "[ . 1 . 2 .]" 1
25 1 3 GLU HG3 1 4 TRP H 3.310 . 4.820 4.079 3.304 4.560 . 0 0 "[ . 1 . 2 .]" 1
26 1 4 TRP H 1 4 TRP HA 2.335 . 2.870 2.889 2.837 2.936 0.066 8 0 "[ . 1 . 2 .]" 1
27 1 4 TRP H 1 4 TRP HD1 2.440 . 3.080 2.942 2.563 3.102 0.022 16 0 "[ . 1 . 2 .]" 1
28 1 4 TRP H 1 4 TRP HE1 3.465 . 5.130 4.654 4.342 5.074 . 0 0 "[ . 1 . 2 .]" 1
29 1 4 TRP H 1 5 ARG H 3.230 . 4.660 4.580 4.435 4.628 . 0 0 "[ . 1 . 2 .]" 1
30 1 4 TRP H 1 20 LEU HB3 3.650 . 5.500 4.737 4.561 4.907 . 0 0 "[ . 1 . 2 .]" 1
31 1 4 TRP H 1 20 LEU MD1 3.140 . 4.480 3.204 3.044 3.377 . 0 0 "[ . 1 . 2 .]" 1
32 1 4 TRP H 1 20 LEU MD2 3.715 . 5.630 4.490 4.272 4.584 . 0 0 "[ . 1 . 2 .]" 1
33 1 4 TRP HA 1 4 TRP HD1 3.230 . 4.660 4.550 4.415 4.627 . 0 0 "[ . 1 . 2 .]" 1
34 1 4 TRP HA 1 4 TRP HE3 2.490 . 3.180 2.606 2.357 2.955 . 0 0 "[ . 1 . 2 .]" 1
35 1 4 TRP HA 1 5 ARG H 2.270 . 2.740 2.292 2.262 2.343 . 0 0 "[ . 1 . 2 .]" 1
36 1 4 TRP HA 1 5 ARG HA 3.215 . 4.630 4.360 4.348 4.373 . 0 0 "[ . 1 . 2 .]" 1
37 1 4 TRP HA 1 5 ARG QB 3.715 . 5.630 4.042 3.939 4.454 . 0 0 "[ . 1 . 2 .]" 1
38 1 4 TRP HA 1 20 LEU MD1 3.620 . 5.440 4.367 4.339 4.398 . 0 0 "[ . 1 . 2 .]" 1
39 1 4 TRP HA 1 21 GLU H 3.245 . 4.690 4.705 4.672 4.720 0.030 15 0 "[ . 1 . 2 .]" 1
40 1 4 TRP HA 1 21 GLU HB3 3.650 . 5.500 5.474 5.408 5.510 0.010 4 0 "[ . 1 . 2 .]" 1
41 1 4 TRP HA 1 21 GLU HG2 3.140 . 4.480 3.262 3.226 3.302 . 0 0 "[ . 1 . 2 .]" 1
42 1 4 TRP HA 1 21 GLU QG 3.025 . 4.250 3.118 3.078 3.163 . 0 0 "[ . 1 . 2 .]" 1
43 1 4 TRP HA 1 21 GLU HG3 3.140 . 4.480 3.965 3.890 4.052 . 0 0 "[ . 1 . 2 .]" 1
44 1 4 TRP HA 1 22 ASN H 3.590 . 5.380 5.287 5.202 5.383 0.003 11 0 "[ . 1 . 2 .]" 1
45 1 4 TRP QB 1 4 TRP HD1 2.590 . 3.380 2.525 2.494 2.573 . 0 0 "[ . 1 . 2 .]" 1
46 1 4 TRP QB 1 7 ILE MD 4.605 . 7.410 5.029 4.905 5.167 . 0 0 "[ . 1 . 2 .]" 1
47 1 4 TRP QB 1 20 LEU HB3 2.885 . 3.970 1.937 1.862 2.016 . 0 0 "[ . 1 . 2 .]" 1
48 1 4 TRP QB 1 20 LEU MD1 2.875 . 3.950 1.859 1.850 1.883 . 0 0 "[ . 1 . 2 .]" 1
49 1 4 TRP QB 1 20 LEU MD2 3.229 . 4.544 2.893 2.794 2.964 . 0 0 "[ . 1 . 2 .]" 1
50 1 4 TRP QB 1 21 GLU H 3.360 . 4.920 2.835 2.710 2.929 . 0 0 "[ . 1 . 2 .]" 1
51 1 4 TRP QB 1 21 GLU QG 2.870 . 3.940 2.122 1.986 2.234 . 0 0 "[ . 1 . 2 .]" 1
52 1 4 TRP QB 1 22 ASN H 2.950 . 4.100 3.029 2.935 3.168 . 0 0 "[ . 1 . 2 .]" 1
53 1 4 TRP HB2 1 4 TRP HD1 2.815 . 3.830 2.570 2.541 2.619 . 0 0 "[ . 1 . 2 .]" 1
54 1 4 TRP HB2 1 5 ARG H 2.765 . 3.730 3.694 3.558 3.736 0.006 9 0 "[ . 1 . 2 .]" 1
55 1 4 TRP HB2 1 20 LEU HB3 2.985 . 4.170 2.131 1.999 2.275 . 0 0 "[ . 1 . 2 .]" 1
56 1 4 TRP HB2 1 20 LEU MD1 3.015 . 4.230 1.874 1.863 1.897 . 0 0 "[ . 1 . 2 .]" 1
57 1 4 TRP HB2 1 20 LEU MD2 3.310 . 4.820 2.990 2.868 3.077 . 0 0 "[ . 1 . 2 .]" 1
58 1 4 TRP HB2 1 21 GLU HG2 3.340 . 4.880 3.819 3.697 3.952 . 0 0 "[ . 1 . 2 .]" 1
59 1 4 TRP HB2 1 21 GLU HG3 3.340 . 4.880 4.373 4.218 4.599 . 0 0 "[ . 1 . 2 .]" 1
60 1 4 TRP HB2 1 22 ASN H 3.224 . 4.534 4.254 4.091 4.441 . 0 0 "[ . 1 . 2 .]" 1
61 1 4 TRP HB3 1 4 TRP HD1 2.815 . 3.830 3.699 3.626 3.779 . 0 0 "[ . 1 . 2 .]" 1
62 1 4 TRP HB3 1 5 ARG H 2.765 . 3.730 2.734 2.604 2.829 . 0 0 "[ . 1 . 2 .]" 1
63 1 4 TRP HB3 1 20 LEU HB3 2.985 . 4.170 2.230 2.193 2.265 . 0 0 "[ . 1 . 2 .]" 1
64 1 4 TRP HB3 1 20 LEU MD1 3.015 . 4.230 3.111 3.018 3.197 . 0 0 "[ . 1 . 2 .]" 1
65 1 4 TRP HB3 1 20 LEU MD2 3.310 . 4.820 3.859 3.837 3.885 . 0 0 "[ . 1 . 2 .]" 1
66 1 4 TRP HB3 1 21 GLU HG2 3.340 . 4.880 2.257 2.095 2.409 . 0 0 "[ . 1 . 2 .]" 1
67 1 4 TRP HB3 1 21 GLU HG3 3.340 . 4.880 2.653 2.521 2.862 . 0 0 "[ . 1 . 2 .]" 1
68 1 4 TRP HB3 1 22 ASN H 3.224 . 4.534 3.100 3.002 3.244 . 0 0 "[ . 1 . 2 .]" 1
69 1 4 TRP HD1 1 20 LEU MD1 2.875 . 3.950 2.074 1.938 2.208 . 0 0 "[ . 1 . 2 .]" 1
70 1 4 TRP HD1 1 20 LEU MD2 3.590 . 5.380 4.440 4.399 4.488 . 0 0 "[ . 1 . 2 .]" 1
71 1 4 TRP HD1 1 21 GLU QG 4.090 . 6.380 5.275 5.054 5.425 . 0 0 "[ . 1 . 2 .]" 1
72 1 4 TRP HE1 1 20 LEU MD1 3.495 . 5.190 4.020 3.945 4.077 . 0 0 "[ . 1 . 2 .]" 1
73 1 4 TRP HE1 1 22 ASN HB3 3.650 . 5.500 5.198 4.728 5.509 0.009 11 0 "[ . 1 . 2 .]" 1
74 1 4 TRP HE1 1 22 ASN HD21 3.280 . 4.760 3.748 2.983 4.588 . 0 0 "[ . 1 . 2 .]" 1
75 1 4 TRP HE1 1 22 ASN HD22 3.280 . 4.760 3.019 2.387 3.735 . 0 0 "[ . 1 . 2 .]" 1
76 1 4 TRP HE1 1 24 ARG QB 4.090 . 6.380 4.501 4.112 4.865 . 0 0 "[ . 1 . 2 .]" 1
77 1 4 TRP HE3 1 5 ARG H 3.200 . 4.600 3.684 3.509 3.911 . 0 0 "[ . 1 . 2 .]" 1
78 1 4 TRP HE3 1 21 GLU HB3 3.650 . 5.500 5.046 4.801 5.176 . 0 0 "[ . 1 . 2 .]" 1
79 1 4 TRP HE3 1 21 GLU HG2 2.520 . 3.240 3.171 2.905 3.248 0.008 7 0 "[ . 1 . 2 .]" 1
80 1 4 TRP HE3 1 21 GLU QG 2.425 . 3.050 2.461 2.117 2.667 . 0 0 "[ . 1 . 2 .]" 1
81 1 4 TRP HE3 1 21 GLU HG3 2.520 . 3.240 2.570 2.175 2.836 . 0 0 "[ . 1 . 2 .]" 1
82 1 4 TRP HE3 1 22 ASN H 3.650 . 5.500 4.191 3.672 4.513 . 0 0 "[ . 1 . 2 .]" 1
83 1 4 TRP HZ3 1 21 GLU HG2 3.650 . 5.500 5.350 5.108 5.430 . 0 0 "[ . 1 . 2 .]" 1
84 1 4 TRP HZ3 1 21 GLU QG 3.545 . 5.290 4.080 3.675 4.237 . 0 0 "[ . 1 . 2 .]" 1
85 1 4 TRP HZ3 1 21 GLU HG3 3.650 . 5.500 4.235 3.768 4.432 . 0 0 "[ . 1 . 2 .]" 1
86 1 5 ARG H 1 5 ARG QB 2.850 . 3.900 2.412 2.279 2.918 . 0 0 "[ . 1 . 2 .]" 1
87 1 5 ARG H 1 5 ARG QG 3.995 . 6.190 3.694 1.980 4.107 . 0 0 "[ . 1 . 2 .]" 1
88 1 5 ARG H 1 6 ARG H 3.230 . 4.660 4.476 4.436 4.558 . 0 0 "[ . 1 . 2 .]" 1
89 1 5 ARG H 1 7 ILE MG 3.995 . 6.190 4.440 4.356 4.618 . 0 0 "[ . 1 . 2 .]" 1
90 1 5 ARG H 1 20 LEU MD1 4.165 . 6.530 4.838 4.738 4.878 . 0 0 "[ . 1 . 2 .]" 1
91 1 5 ARG H 1 21 GLU H 2.985 . 4.170 3.324 3.143 3.403 . 0 0 "[ . 1 . 2 .]" 1
92 1 5 ARG H 1 21 GLU HB3 3.185 . 4.570 3.713 3.558 3.803 . 0 0 "[ . 1 . 2 .]" 1
93 1 5 ARG H 1 21 GLU HG2 2.890 . 3.980 2.011 1.985 2.113 . 0 0 "[ . 1 . 2 .]" 1
94 1 5 ARG H 1 21 GLU QG 2.805 . 3.810 2.000 1.975 2.101 . 0 0 "[ . 1 . 2 .]" 1
95 1 5 ARG H 1 21 GLU HG3 2.890 . 3.980 3.563 3.521 3.684 . 0 0 "[ . 1 . 2 .]" 1
96 1 5 ARG HA 1 5 ARG QD 3.315 . 4.830 3.464 1.954 4.336 . 0 0 "[ . 1 . 2 .]" 1
97 1 5 ARG HA 1 5 ARG QG 2.680 . 3.560 2.508 2.087 3.331 . 0 0 "[ . 1 . 2 .]" 1
98 1 5 ARG HA 1 6 ARG H 2.595 . 3.390 2.165 2.148 2.251 . 0 0 "[ . 1 . 2 .]" 1
99 1 5 ARG HA 1 7 ILE MG 3.980 . 6.160 4.710 4.641 4.790 . 0 0 "[ . 1 . 2 .]" 1
100 1 5 ARG HA 1 20 LEU MD1 4.165 . 6.530 5.139 5.095 5.188 . 0 0 "[ . 1 . 2 .]" 1
101 1 5 ARG HA 1 20 LEU MD2 3.375 . 4.950 3.912 3.880 3.957 . 0 0 "[ . 1 . 2 .]" 1
102 1 5 ARG HA 1 21 GLU H 3.370 . 4.940 4.788 4.707 4.870 . 0 0 "[ . 1 . 2 .]" 1
103 1 5 ARG QB 1 7 ILE MD 4.600 . 7.400 4.887 4.683 5.227 . 0 0 "[ . 1 . 2 .]" 1
104 1 5 ARG QB 1 7 ILE MG 3.640 . 5.480 3.146 2.957 3.455 . 0 0 "[ . 1 . 2 .]" 1
105 1 5 ARG QB 1 21 GLU HB2 4.090 . 6.380 5.059 4.720 5.754 . 0 0 "[ . 1 . 2 .]" 1
106 1 5 ARG QB 1 21 GLU HB3 4.090 . 6.380 3.687 3.376 4.437 . 0 0 "[ . 1 . 2 .]" 1
107 1 5 ARG QB 1 21 GLU HG2 4.090 . 6.380 3.582 3.277 4.280 . 0 0 "[ . 1 . 2 .]" 1
108 1 5 ARG QB 1 21 GLU HG3 4.090 . 6.380 5.035 4.729 5.712 . 0 0 "[ . 1 . 2 .]" 1
109 1 5 ARG QD 1 6 ARG H 3.855 . 5.910 3.459 2.090 5.278 . 0 0 "[ . 1 . 2 .]" 1
110 1 5 ARG QD 1 7 ILE MD 4.600 . 7.400 4.970 4.251 5.368 . 0 0 "[ . 1 . 2 .]" 1
111 1 5 ARG QD 1 7 ILE MG 3.640 . 5.480 2.758 2.054 3.669 . 0 0 "[ . 1 . 2 .]" 1
112 1 5 ARG QG 1 6 ARG HA 4.090 . 6.380 4.847 4.045 5.643 . 0 0 "[ . 1 . 2 .]" 1
113 1 5 ARG QG 1 7 ILE MG 4.045 . 6.290 3.573 2.115 4.505 . 0 0 "[ . 1 . 2 .]" 1
114 1 5 ARG O 1 21 GLU H 1.950 . 2.200 2.146 1.915 2.216 0.016 16 0 "[ . 1 . 2 .]" 1
115 1 5 ARG O 1 21 GLU N 2.950 2.700 3.200 2.881 2.691 2.966 0.009 4 0 "[ . 1 . 2 .]" 1
116 1 6 ARG H 1 6 ARG HD2 3.650 . 5.500 4.308 3.807 4.668 . 0 0 "[ . 1 . 2 .]" 1
117 1 6 ARG H 1 6 ARG HD3 3.650 . 5.500 4.633 4.360 5.040 . 0 0 "[ . 1 . 2 .]" 1
118 1 6 ARG H 1 6 ARG QG 3.300 . 4.800 2.112 1.959 2.524 . 0 0 "[ . 1 . 2 .]" 1
119 1 6 ARG H 1 7 ILE H 3.155 . 4.510 4.507 4.453 4.520 0.010 21 0 "[ . 1 . 2 .]" 1
120 1 6 ARG H 1 20 LEU HA 3.200 . 4.600 4.208 4.151 4.353 . 0 0 "[ . 1 . 2 .]" 1
121 1 6 ARG H 1 20 LEU MD2 3.235 . 4.670 3.407 3.281 3.679 . 0 0 "[ . 1 . 2 .]" 1
122 1 6 ARG HA 1 6 ARG HD2 3.605 . 5.410 4.488 4.082 4.772 . 0 0 "[ . 1 . 2 .]" 1
123 1 6 ARG HA 1 6 ARG QD 3.460 . 5.120 4.089 3.753 4.213 . 0 0 "[ . 1 . 2 .]" 1
124 1 6 ARG HA 1 6 ARG HD3 3.605 . 5.410 4.731 4.168 4.944 . 0 0 "[ . 1 . 2 .]" 1
125 1 6 ARG HA 1 7 ILE MD 2.845 . 3.890 3.117 3.092 3.150 . 0 0 "[ . 1 . 2 .]" 1
126 1 6 ARG HA 1 8 ALA H 2.690 . 3.580 3.512 3.497 3.537 . 0 0 "[ . 1 . 2 .]" 1
127 1 6 ARG HA 1 19 LEU H 3.385 . 4.970 4.754 4.659 4.867 . 0 0 "[ . 1 . 2 .]" 1
128 1 6 ARG HA 1 20 LEU HA 2.335 . 2.870 1.985 1.961 2.051 . 0 0 "[ . 1 . 2 .]" 1
129 1 6 ARG HA 1 20 LEU HB2 3.650 . 5.500 4.975 4.946 5.051 . 0 0 "[ . 1 . 2 .]" 1
130 1 6 ARG HA 1 20 LEU MD1 4.165 . 6.530 4.971 4.905 5.066 . 0 0 "[ . 1 . 2 .]" 1
131 1 6 ARG HA 1 20 LEU MD2 2.675 . 3.550 2.651 2.538 2.782 . 0 0 "[ . 1 . 2 .]" 1
132 1 6 ARG HA 1 21 GLU H 2.875 . 3.950 3.530 3.449 3.637 . 0 0 "[ . 1 . 2 .]" 1
133 1 6 ARG HA 1 54 THR MG 4.165 . 6.530 4.724 4.691 4.763 . 0 0 "[ . 1 . 2 .]" 1
134 1 6 ARG QB 1 6 ARG QD 2.640 . 3.480 2.163 2.009 2.407 . 0 0 "[ . 1 . 2 .]" 1
135 1 6 ARG QB 1 7 ILE HA 3.795 . 5.790 4.122 4.099 4.142 . 0 0 "[ . 1 . 2 .]" 1
136 1 6 ARG QB 1 7 ILE MD 4.170 . 6.540 4.262 4.220 4.324 . 0 0 "[ . 1 . 2 .]" 1
137 1 6 ARG QB 1 8 ALA H 3.255 . 4.710 3.326 3.260 3.380 . 0 0 "[ . 1 . 2 .]" 1
138 1 6 ARG QB 1 19 LEU H 4.090 . 6.380 3.749 3.642 3.923 . 0 0 "[ . 1 . 2 .]" 1
139 1 6 ARG QB 1 20 LEU HA 3.765 . 5.730 3.858 3.761 3.989 . 0 0 "[ . 1 . 2 .]" 1
140 1 6 ARG QB 1 20 LEU MD2 3.505 . 5.210 3.302 3.187 3.475 . 0 0 "[ . 1 . 2 .]" 1
141 1 6 ARG QB 1 38 ALA MB 3.515 . 5.230 3.789 3.629 3.958 . 0 0 "[ . 1 . 2 .]" 1
142 1 6 ARG HB2 1 6 ARG HD2 2.845 . 3.890 2.490 2.182 2.852 . 0 0 "[ . 1 . 2 .]" 1
143 1 6 ARG HB2 1 6 ARG HD3 2.845 . 3.890 3.576 3.117 3.894 0.004 21 0 "[ . 1 . 2 .]" 1
144 1 6 ARG HB2 1 20 LEU MD2 3.745 . 5.690 4.077 3.859 4.179 . 0 0 "[ . 1 . 2 .]" 1
145 1 6 ARG HB2 1 38 ALA MB 3.605 . 5.410 4.401 4.210 4.541 . 0 0 "[ . 1 . 2 .]" 1
146 1 6 ARG HB3 1 6 ARG HD2 2.845 . 3.890 2.574 2.087 2.985 . 0 0 "[ . 1 . 2 .]" 1
147 1 6 ARG HB3 1 6 ARG HD3 2.845 . 3.890 3.379 2.327 3.825 . 0 0 "[ . 1 . 2 .]" 1
148 1 6 ARG HB3 1 20 LEU MD2 3.745 . 5.690 3.497 3.312 3.737 . 0 0 "[ . 1 . 2 .]" 1
149 1 6 ARG HB3 1 38 ALA MB 3.605 . 5.410 4.149 3.816 4.407 . 0 0 "[ . 1 . 2 .]" 1
150 1 6 ARG QD 1 9 TYR QE 4.440 . 7.080 3.892 3.622 4.100 . 0 0 "[ . 1 . 2 .]" 1
151 1 6 ARG QD 1 18 PRO HA 3.345 . 4.890 3.948 3.416 4.394 . 0 0 "[ . 1 . 2 .]" 1
152 1 6 ARG QD 1 18 PRO QB 3.185 . 4.570 2.231 1.930 2.612 . 0 0 "[ . 1 . 2 .]" 1
153 1 6 ARG HD2 1 9 TYR QD 4.720 . 7.640 5.688 5.226 6.275 . 0 0 "[ . 1 . 2 .]" 1
154 1 6 ARG HD2 1 9 TYR QE 4.575 . 7.350 4.112 3.766 4.641 . 0 0 "[ . 1 . 2 .]" 1
155 1 6 ARG HD2 1 18 PRO HA 3.540 . 5.280 4.494 3.555 5.270 . 0 0 "[ . 1 . 2 .]" 1
156 1 6 ARG HD2 1 18 PRO HB2 3.890 . 5.980 3.759 2.519 4.726 . 0 0 "[ . 1 . 2 .]" 1
157 1 6 ARG HD2 1 18 PRO HB3 3.890 . 5.980 2.997 2.434 3.811 . 0 0 "[ . 1 . 2 .]" 1
158 1 6 ARG HD2 1 20 LEU MD2 3.650 . 5.500 4.038 3.510 4.296 . 0 0 "[ . 1 . 2 .]" 1
159 1 6 ARG HD3 1 9 TYR QD 4.720 . 7.640 6.343 5.362 6.903 . 0 0 "[ . 1 . 2 .]" 1
160 1 6 ARG HD3 1 9 TYR QE 4.575 . 7.350 4.983 4.067 5.458 . 0 0 "[ . 1 . 2 .]" 1
161 1 6 ARG HD3 1 18 PRO HA 3.540 . 5.280 4.589 3.583 5.272 . 0 0 "[ . 1 . 2 .]" 1
162 1 6 ARG HD3 1 18 PRO HB2 3.890 . 5.980 2.884 2.160 3.715 . 0 0 "[ . 1 . 2 .]" 1
163 1 6 ARG HD3 1 18 PRO HB3 3.890 . 5.980 2.748 2.023 3.523 . 0 0 "[ . 1 . 2 .]" 1
164 1 6 ARG HD3 1 20 LEU MD2 3.650 . 5.500 3.271 2.640 3.586 . 0 0 "[ . 1 . 2 .]" 1
165 1 6 ARG QG 1 20 LEU HA 3.205 . 4.610 3.263 3.051 3.417 . 0 0 "[ . 1 . 2 .]" 1
166 1 6 ARG QG 1 20 LEU HB2 4.090 . 6.380 5.215 4.957 5.386 . 0 0 "[ . 1 . 2 .]" 1
167 1 6 ARG QG 1 20 LEU MD1 4.600 . 7.400 3.996 3.869 4.062 . 0 0 "[ . 1 . 2 .]" 1
168 1 7 ILE H 1 8 ALA H 2.365 . 2.930 1.962 1.949 1.982 . 0 0 "[ . 1 . 2 .]" 1
169 1 7 ILE H 1 19 LEU O 1.950 . 2.200 2.192 2.167 2.211 0.011 4 0 "[ . 1 . 2 .]" 1
170 1 7 ILE H 1 20 LEU HA 2.735 . 3.670 3.083 3.030 3.159 . 0 0 "[ . 1 . 2 .]" 1
171 1 7 ILE HA 1 7 ILE MG 2.615 . 3.430 2.443 2.402 2.513 . 0 0 "[ . 1 . 2 .]" 1
172 1 7 ILE HA 1 8 ALA H 2.625 . 3.450 3.293 3.266 3.313 . 0 0 "[ . 1 . 2 .]" 1
173 1 7 ILE HA 1 8 ALA MB 3.670 . 5.540 4.433 4.413 4.457 . 0 0 "[ . 1 . 2 .]" 1
174 1 7 ILE HA 1 38 ALA MB 3.030 . 4.260 3.139 3.001 3.247 . 0 0 "[ . 1 . 2 .]" 1
175 1 7 ILE HA 1 39 PRO QD 3.655 . 5.510 3.805 3.744 3.909 . 0 0 "[ . 1 . 2 .]" 1
176 1 7 ILE HA 1 54 THR MG 4.165 . 6.530 5.058 5.022 5.098 . 0 0 "[ . 1 . 2 .]" 1
177 1 7 ILE HA 1 57 LEU MD2 4.150 . 6.500 4.539 4.462 4.618 . 0 0 "[ . 1 . 2 .]" 1
178 1 7 ILE HA 1 65 LEU MD1 3.280 . 4.760 3.034 2.893 3.146 . 0 0 "[ . 1 . 2 .]" 1
179 1 7 ILE HA 1 65 LEU QD 2.905 . 4.124 2.884 2.790 2.946 . 0 0 "[ . 1 . 2 .]" 1
180 1 7 ILE HA 1 65 LEU MD2 3.280 . 4.760 3.615 3.500 3.743 . 0 0 "[ . 1 . 2 .]" 1
181 1 7 ILE HB 1 8 ALA MB 3.900 . 6.114 4.270 4.246 4.297 . 0 0 "[ . 1 . 2 .]" 1
182 1 7 ILE HB 1 54 THR MG 3.805 . 5.810 4.606 4.555 4.628 . 0 0 "[ . 1 . 2 .]" 1
183 1 7 ILE MD 1 8 ALA H 2.860 . 3.920 2.389 2.324 2.438 . 0 0 "[ . 1 . 2 .]" 1
184 1 7 ILE MD 1 8 ALA MB 3.765 . 5.730 2.480 2.426 2.589 . 0 0 "[ . 1 . 2 .]" 1
185 1 7 ILE MD 1 19 LEU H 3.945 . 6.090 4.684 4.654 4.720 . 0 0 "[ . 1 . 2 .]" 1
186 1 7 ILE MD 1 19 LEU HB2 3.870 . 5.940 4.249 4.171 4.337 . 0 0 "[ . 1 . 2 .]" 1
187 1 7 ILE MD 1 19 LEU QB 3.580 . 5.360 2.907 2.874 2.944 . 0 0 "[ . 1 . 2 .]" 1
188 1 7 ILE MD 1 19 LEU HB3 3.870 . 5.940 2.960 2.929 2.995 . 0 0 "[ . 1 . 2 .]" 1
189 1 7 ILE MD 1 19 LEU QD 5.170 . 8.540 3.386 3.310 3.493 . 0 0 "[ . 1 . 2 .]" 1
190 1 7 ILE MD 1 20 LEU HA 4.085 . 6.370 3.043 2.958 3.141 . 0 0 "[ . 1 . 2 .]" 1
191 1 7 ILE MD 1 21 GLU H 2.830 . 3.860 2.850 2.762 2.941 . 0 0 "[ . 1 . 2 .]" 1
192 1 7 ILE MD 1 21 GLU HA 2.615 . 3.430 1.862 1.848 1.870 . 0 0 "[ . 1 . 2 .]" 1
193 1 7 ILE MD 1 21 GLU HB2 3.360 . 4.920 3.915 3.855 3.939 . 0 0 "[ . 1 . 2 .]" 1
194 1 7 ILE MD 1 21 GLU HB3 3.030 . 4.260 3.183 3.104 3.213 . 0 0 "[ . 1 . 2 .]" 1
195 1 7 ILE MD 1 21 GLU HG2 3.995 . 6.190 4.232 4.193 4.301 . 0 0 "[ . 1 . 2 .]" 1
196 1 7 ILE MD 1 21 GLU QG 3.870 . 5.940 3.938 3.903 3.989 . 0 0 "[ . 1 . 2 .]" 1
197 1 7 ILE MD 1 21 GLU HG3 3.995 . 6.190 4.690 4.652 4.748 . 0 0 "[ . 1 . 2 .]" 1
198 1 7 ILE MD 1 22 ASN H 3.730 . 5.660 4.175 4.143 4.211 . 0 0 "[ . 1 . 2 .]" 1
199 1 7 ILE MD 1 23 GLY H 3.265 . 4.730 3.539 3.506 3.569 . 0 0 "[ . 1 . 2 .]" 1
200 1 7 ILE MD 1 54 THR HA 2.845 . 3.890 3.120 3.104 3.137 . 0 0 "[ . 1 . 2 .]" 1
201 1 7 ILE MD 1 54 THR HB 2.860 . 3.920 2.595 2.530 2.705 . 0 0 "[ . 1 . 2 .]" 1
202 1 7 ILE MD 1 54 THR MG 3.300 . 4.800 1.692 1.679 1.706 0.121 12 0 "[ . 1 . 2 .]" 1
203 1 7 ILE MD 1 57 LEU HB2 2.985 . 4.170 3.394 3.310 3.449 . 0 0 "[ . 1 . 2 .]" 1
204 1 7 ILE MD 1 58 ALA H 3.450 . 5.100 4.119 4.012 4.150 . 0 0 "[ . 1 . 2 .]" 1
205 1 7 ILE MD 1 58 ALA MB 3.965 . 6.130 3.254 3.149 3.383 . 0 0 "[ . 1 . 2 .]" 1
206 1 7 ILE QG 1 8 ALA MB 3.875 . 5.950 2.540 2.477 2.609 . 0 0 "[ . 1 . 2 .]" 1
207 1 7 ILE QG 1 21 GLU HA 3.125 . 4.450 2.716 2.623 2.857 . 0 0 "[ . 1 . 2 .]" 1
208 1 7 ILE QG 1 23 GLY H 4.090 . 6.380 5.364 5.305 5.427 . 0 0 "[ . 1 . 2 .]" 1
209 1 7 ILE QG 1 54 THR MG 3.455 . 5.110 2.512 2.424 2.538 . 0 0 "[ . 1 . 2 .]" 1
210 1 7 ILE QG 1 57 LEU MD1 4.245 . 6.690 3.944 3.880 4.012 . 0 0 "[ . 1 . 2 .]" 1
211 1 7 ILE QG 1 57 LEU MD2 3.610 . 5.420 2.566 2.441 2.666 . 0 0 "[ . 1 . 2 .]" 1
212 1 7 ILE QG 1 65 LEU MD1 4.445 . 7.090 3.915 3.683 4.202 . 0 0 "[ . 1 . 2 .]" 1
213 1 7 ILE QG 1 65 LEU QD 4.225 . 6.650 2.997 2.813 3.104 . 0 0 "[ . 1 . 2 .]" 1
214 1 7 ILE QG 1 65 LEU MD2 4.445 . 7.090 3.115 2.887 3.206 . 0 0 "[ . 1 . 2 .]" 1
215 1 7 ILE MG 1 20 LEU HA 3.855 . 5.910 4.088 3.995 4.301 . 0 0 "[ . 1 . 2 .]" 1
216 1 7 ILE MG 1 21 GLU HA 2.925 . 4.050 2.873 2.713 3.021 . 0 0 "[ . 1 . 2 .]" 1
217 1 7 ILE MG 1 21 GLU HB2 3.450 . 5.100 3.684 3.579 3.784 . 0 0 "[ . 1 . 2 .]" 1
218 1 7 ILE MG 1 21 GLU HB3 2.940 . 4.080 2.418 2.256 2.558 . 0 0 "[ . 1 . 2 .]" 1
219 1 7 ILE MG 1 21 GLU HG2 4.165 . 6.530 3.917 3.791 4.044 . 0 0 "[ . 1 . 2 .]" 1
220 1 7 ILE MG 1 21 GLU QG 3.910 . 6.134 3.757 3.647 3.867 . 0 0 "[ . 1 . 2 .]" 1
221 1 7 ILE MG 1 21 GLU HG3 4.165 . 6.530 4.835 4.725 4.954 . 0 0 "[ . 1 . 2 .]" 1
222 1 7 ILE MG 1 38 ALA MB 4.660 . 7.520 4.759 4.612 4.836 . 0 0 "[ . 1 . 2 .]" 1
223 1 7 ILE MG 1 57 LEU HB2 3.745 . 5.690 4.510 4.417 4.557 . 0 0 "[ . 1 . 2 .]" 1
224 1 7 ILE MG 1 57 LEU HB3 3.250 . 4.700 3.872 3.761 3.916 . 0 0 "[ . 1 . 2 .]" 1
225 1 7 ILE MG 1 58 ALA H 3.670 . 5.540 4.315 4.192 4.406 . 0 0 "[ . 1 . 2 .]" 1
226 1 7 ILE MG 1 58 ALA HA 2.705 . 3.610 2.478 2.246 2.650 . 0 0 "[ . 1 . 2 .]" 1
227 1 7 ILE MG 1 58 ALA MB 3.905 . 6.124 3.063 2.902 3.188 . 0 0 "[ . 1 . 2 .]" 1
228 1 7 ILE MG 1 62 ALA MB 4.680 . 7.560 4.301 4.003 4.639 . 0 0 "[ . 1 . 2 .]" 1
229 1 7 ILE MG 1 65 LEU QD 4.935 . 8.070 3.021 2.924 3.099 . 0 0 "[ . 1 . 2 .]" 1
230 1 7 ILE N 1 19 LEU O 2.950 2.700 3.200 3.067 3.042 3.084 . 0 0 "[ . 1 . 2 .]" 1
231 1 8 ALA H 1 8 ALA MB 2.675 . 3.550 2.816 2.800 2.826 . 0 0 "[ . 1 . 2 .]" 1
232 1 8 ALA H 1 9 TYR H 3.155 . 4.510 4.367 4.361 4.374 . 0 0 "[ . 1 . 2 .]" 1
233 1 8 ALA H 1 9 TYR QD 4.720 . 7.640 4.068 3.872 4.543 . 0 0 "[ . 1 . 2 .]" 1
234 1 8 ALA H 1 18 PRO HA 3.465 . 5.130 5.144 5.115 5.168 0.038 23 0 "[ . 1 . 2 .]" 1
235 1 8 ALA H 1 19 LEU H 2.780 . 3.760 3.505 3.480 3.539 . 0 0 "[ . 1 . 2 .]" 1
236 1 8 ALA H 1 19 LEU HB2 3.230 . 4.660 3.802 3.732 3.866 . 0 0 "[ . 1 . 2 .]" 1
237 1 8 ALA H 1 19 LEU QB 3.120 . 4.440 3.124 3.096 3.153 . 0 0 "[ . 1 . 2 .]" 1
238 1 8 ALA H 1 19 LEU HB3 3.230 . 4.660 3.322 3.269 3.369 . 0 0 "[ . 1 . 2 .]" 1
239 1 8 ALA H 1 19 LEU QD 4.870 . 7.940 4.334 4.299 4.383 . 0 0 "[ . 1 . 2 .]" 1
240 1 8 ALA H 1 19 LEU O 1.950 . 2.200 2.328 2.317 2.343 0.143 7 0 "[ . 1 . 2 .]" 1
241 1 8 ALA H 1 20 LEU HA 3.400 . 5.000 4.429 4.396 4.480 . 0 0 "[ . 1 . 2 .]" 1
242 1 8 ALA H 1 57 LEU MD2 3.635 . 5.470 4.276 4.210 4.338 . 0 0 "[ . 1 . 2 .]" 1
243 1 8 ALA HA 1 9 TYR H 2.365 . 2.930 2.549 2.541 2.556 . 0 0 "[ . 1 . 2 .]" 1
244 1 8 ALA HA 1 9 TYR QD 4.175 . 6.550 3.087 2.909 3.249 . 0 0 "[ . 1 . 2 .]" 1
245 1 8 ALA HA 1 9 TYR QE 4.715 . 7.630 4.793 4.553 4.936 . 0 0 "[ . 1 . 2 .]" 1
246 1 8 ALA HA 1 19 LEU QD 4.575 . 7.350 4.531 4.477 4.584 . 0 0 "[ . 1 . 2 .]" 1
247 1 8 ALA HA 1 38 ALA MB 2.615 . 3.430 2.564 2.360 2.734 . 0 0 "[ . 1 . 2 .]" 1
248 1 8 ALA HA 1 39 PRO QD 2.820 . 3.840 2.104 1.963 2.264 . 0 0 "[ . 1 . 2 .]" 1
249 1 8 ALA HA 1 39 PRO HG2 3.230 . 4.660 2.174 2.129 2.264 . 0 0 "[ . 1 . 2 .]" 1
250 1 8 ALA HA 1 39 PRO QG 3.224 . 4.534 2.159 2.115 2.245 . 0 0 "[ . 1 . 2 .]" 1
251 1 8 ALA HA 1 39 PRO HG3 3.230 . 4.660 3.687 3.620 3.781 . 0 0 "[ . 1 . 2 .]" 1
252 1 8 ALA HA 1 54 THR MG 3.805 . 5.810 4.113 4.048 4.169 . 0 0 "[ . 1 . 2 .]" 1
253 1 8 ALA HA 1 57 LEU MD2 3.635 . 5.470 3.123 3.088 3.149 . 0 0 "[ . 1 . 2 .]" 1
254 1 8 ALA HA 1 65 LEU QD 4.950 . 8.100 4.064 3.746 4.385 . 0 0 "[ . 1 . 2 .]" 1
255 1 8 ALA MB 1 9 TYR H 2.615 . 3.430 2.315 2.287 2.347 . 0 0 "[ . 1 . 2 .]" 1
256 1 8 ALA MB 1 9 TYR HA 4.085 . 6.370 3.864 3.842 3.880 . 0 0 "[ . 1 . 2 .]" 1
257 1 8 ALA MB 1 10 VAL MG2 4.525 . 7.250 4.048 4.009 4.101 . 0 0 "[ . 1 . 2 .]" 1
258 1 8 ALA MB 1 19 LEU HB2 3.030 . 4.260 2.669 2.620 2.735 . 0 0 "[ . 1 . 2 .]" 1
259 1 8 ALA MB 1 19 LEU QB 2.930 . 4.060 2.163 2.083 2.212 . 0 0 "[ . 1 . 2 .]" 1
260 1 8 ALA MB 1 19 LEU HB3 3.030 . 4.260 2.287 2.180 2.365 . 0 0 "[ . 1 . 2 .]" 1
261 1 8 ALA MB 1 19 LEU MD1 4.680 . 7.560 2.209 2.147 2.313 . 0 0 "[ . 1 . 2 .]" 1
262 1 8 ALA MB 1 19 LEU QD 4.040 . 6.280 2.194 2.133 2.295 . 0 0 "[ . 1 . 2 .]" 1
263 1 8 ALA MB 1 19 LEU MD2 4.680 . 7.560 3.747 3.634 3.838 . 0 0 "[ . 1 . 2 .]" 1
264 1 8 ALA MB 1 39 PRO HD2 3.915 . 6.144 3.380 3.276 3.495 . 0 0 "[ . 1 . 2 .]" 1
265 1 8 ALA MB 1 39 PRO QD 3.505 . 5.210 3.283 3.184 3.393 . 0 0 "[ . 1 . 2 .]" 1
266 1 8 ALA MB 1 39 PRO HD3 3.915 . 6.144 4.453 4.337 4.590 . 0 0 "[ . 1 . 2 .]" 1
267 1 8 ALA MB 1 39 PRO HG2 3.360 . 4.920 2.095 1.967 2.255 . 0 0 "[ . 1 . 2 .]" 1
268 1 8 ALA MB 1 39 PRO QG 3.280 . 4.760 2.078 1.954 2.233 . 0 0 "[ . 1 . 2 .]" 1
269 1 8 ALA MB 1 39 PRO HG3 3.360 . 4.920 3.441 3.349 3.584 . 0 0 "[ . 1 . 2 .]" 1
270 1 8 ALA MB 1 40 VAL HA 3.545 . 5.290 4.129 4.095 4.162 . 0 0 "[ . 1 . 2 .]" 1
271 1 8 ALA MB 1 41 LEU MD1 3.765 . 5.730 3.100 3.048 3.136 . 0 0 "[ . 1 . 2 .]" 1
272 1 8 ALA MB 1 41 LEU MD2 4.195 . 6.590 3.450 3.401 3.496 . 0 0 "[ . 1 . 2 .]" 1
273 1 8 ALA MB 1 50 ILE MG 4.680 . 7.560 4.325 4.256 4.374 . 0 0 "[ . 1 . 2 .]" 1
274 1 8 ALA MB 1 53 MET ME 3.965 . 6.130 3.342 3.245 3.442 . 0 0 "[ . 1 . 2 .]" 1
275 1 8 ALA MB 1 54 THR HB 4.135 . 6.470 4.206 4.138 4.264 . 0 0 "[ . 1 . 2 .]" 1
276 1 8 ALA MB 1 54 THR MG 3.920 . 6.040 1.799 1.727 1.848 0.073 12 0 "[ . 1 . 2 .]" 1
277 1 8 ALA MB 1 57 LEU MD1 4.320 . 6.840 3.749 3.690 3.882 . 0 0 "[ . 1 . 2 .]" 1
278 1 8 ALA MB 1 57 LEU MD2 3.515 . 5.230 1.833 1.781 1.879 0.019 9 0 "[ . 1 . 2 .]" 1
279 1 8 ALA MB 1 57 LEU HG 3.790 . 5.780 4.182 3.982 4.240 . 0 0 "[ . 1 . 2 .]" 1
280 1 8 ALA MB 1 65 LEU QB 4.600 . 7.400 4.560 4.458 4.650 . 0 0 "[ . 1 . 2 .]" 1
281 1 8 ALA N 1 19 LEU O 2.950 2.700 3.200 3.223 3.210 3.238 0.038 4 0 "[ . 1 . 2 .]" 1
282 1 8 ALA O 1 19 LEU H 1.950 . 2.200 1.740 1.720 1.766 . 0 0 "[ . 1 . 2 .]" 1
283 1 8 ALA O 1 19 LEU N 2.950 2.700 3.200 2.612 2.596 2.638 0.104 19 0 "[ . 1 . 2 .]" 1
284 1 9 TYR H 1 10 VAL H 3.090 . 4.380 4.407 4.404 4.410 0.030 21 0 "[ . 1 . 2 .]" 1
285 1 9 TYR H 1 10 VAL HA 3.280 . 4.760 4.725 4.706 4.741 . 0 0 "[ . 1 . 2 .]" 1
286 1 9 TYR H 1 10 VAL MG2 3.715 . 5.630 4.199 4.176 4.235 . 0 0 "[ . 1 . 2 .]" 1
287 1 9 TYR H 1 19 LEU H 3.215 . 4.630 4.393 4.315 4.434 . 0 0 "[ . 1 . 2 .]" 1
288 1 9 TYR H 1 19 LEU QB 3.610 . 5.420 3.271 3.232 3.320 . 0 0 "[ . 1 . 2 .]" 1
289 1 9 TYR H 1 19 LEU QD 4.375 . 6.950 3.401 3.357 3.491 . 0 0 "[ . 1 . 2 .]" 1
290 1 9 TYR H 1 39 PRO O 1.950 . 2.200 2.227 2.219 2.239 0.039 12 0 "[ . 1 . 2 .]" 1
291 1 9 TYR H 1 40 VAL HA 2.505 . 3.210 2.459 2.431 2.487 . 0 0 "[ . 1 . 2 .]" 1
292 1 9 TYR H 1 40 VAL MG2 3.325 . 4.850 3.922 3.915 3.939 . 0 0 "[ . 1 . 2 .]" 1
293 1 9 TYR H 1 41 LEU H 2.830 . 3.860 3.756 3.700 3.807 . 0 0 "[ . 1 . 2 .]" 1
294 1 9 TYR H 1 41 LEU MD1 3.545 . 5.290 4.306 4.267 4.322 . 0 0 "[ . 1 . 2 .]" 1
295 1 9 TYR H 1 57 LEU MD2 3.685 . 5.570 4.275 4.230 4.317 . 0 0 "[ . 1 . 2 .]" 1
296 1 9 TYR HA 1 10 VAL H 2.315 . 2.830 2.521 2.511 2.532 . 0 0 "[ . 1 . 2 .]" 1
297 1 9 TYR HA 1 10 VAL MG2 3.360 . 4.920 3.281 3.260 3.309 . 0 0 "[ . 1 . 2 .]" 1
298 1 9 TYR HA 1 17 PHE H 3.400 . 5.000 4.808 4.772 4.847 . 0 0 "[ . 1 . 2 .]" 1
299 1 9 TYR HA 1 18 PRO HA 2.490 . 3.180 2.932 2.876 2.965 . 0 0 "[ . 1 . 2 .]" 1
300 1 9 TYR HA 1 19 LEU H 2.780 . 3.760 2.342 2.245 2.386 . 0 0 "[ . 1 . 2 .]" 1
301 1 9 TYR HA 1 19 LEU QB 4.075 . 6.350 2.281 2.185 2.372 . 0 0 "[ . 1 . 2 .]" 1
302 1 9 TYR HA 1 19 LEU MD1 3.980 . 6.160 3.665 3.611 3.729 . 0 0 "[ . 1 . 2 .]" 1
303 1 9 TYR HA 1 19 LEU QD 3.780 . 5.760 3.570 3.522 3.625 . 0 0 "[ . 1 . 2 .]" 1
304 1 9 TYR HA 1 19 LEU MD2 3.980 . 6.160 4.924 4.868 4.969 . 0 0 "[ . 1 . 2 .]" 1
305 1 9 TYR QB 1 10 VAL H 3.160 . 4.520 2.198 2.184 2.222 . 0 0 "[ . 1 . 2 .]" 1
306 1 9 TYR QB 1 10 VAL HB 4.090 . 6.380 4.867 4.839 4.883 . 0 0 "[ . 1 . 2 .]" 1
307 1 9 TYR QB 1 10 VAL MG2 4.415 . 7.030 4.137 4.113 4.172 . 0 0 "[ . 1 . 2 .]" 1
308 1 9 TYR QB 1 16 PHE HA 3.935 . 6.070 3.566 3.521 3.634 . 0 0 "[ . 1 . 2 .]" 1
309 1 9 TYR QB 1 16 PHE QD 5.150 . 8.500 3.374 3.287 3.647 . 0 0 "[ . 1 . 2 .]" 1
310 1 9 TYR QB 1 18 PRO HA 3.715 . 5.630 3.980 3.920 4.043 . 0 0 "[ . 1 . 2 .]" 1
311 1 9 TYR QB 1 19 LEU H 4.090 . 6.380 4.256 4.187 4.313 . 0 0 "[ . 1 . 2 .]" 1
312 1 9 TYR QB 1 35 PRO QG 4.405 . 7.010 2.888 2.725 3.125 . 0 0 "[ . 1 . 2 .]" 1
313 1 9 TYR QB 1 40 VAL HA 3.390 . 4.980 2.112 2.009 2.216 . 0 0 "[ . 1 . 2 .]" 1
314 1 9 TYR QB 1 40 VAL MG1 4.355 . 6.910 2.777 2.732 2.831 . 0 0 "[ . 1 . 2 .]" 1
315 1 9 TYR QB 1 40 VAL MG2 3.515 . 5.230 1.952 1.885 2.047 . 0 0 "[ . 1 . 2 .]" 1
316 1 9 TYR QB 1 41 LEU H 3.920 . 6.040 3.519 3.473 3.580 . 0 0 "[ . 1 . 2 .]" 1
317 1 9 TYR QD 1 10 VAL H 4.210 . 6.620 3.248 3.124 3.399 . 0 0 "[ . 1 . 2 .]" 1
318 1 9 TYR QD 1 16 PHE HA 4.565 . 7.330 3.843 3.726 4.248 . 0 0 "[ . 1 . 2 .]" 1
319 1 9 TYR QD 1 16 PHE HB2 4.720 . 7.640 2.746 2.509 3.292 . 0 0 "[ . 1 . 2 .]" 1
320 1 9 TYR QD 1 17 PHE H 4.470 . 7.140 3.718 3.539 3.920 . 0 0 "[ . 1 . 2 .]" 1
321 1 9 TYR QD 1 18 PRO HA 3.665 . 5.530 2.955 2.533 3.085 . 0 0 "[ . 1 . 2 .]" 1
322 1 9 TYR QD 1 19 LEU H 4.535 . 7.270 3.765 3.667 3.879 . 0 0 "[ . 1 . 2 .]" 1
323 1 9 TYR QD 1 31 THR MG 4.320 . 6.840 3.299 2.953 3.590 . 0 0 "[ . 1 . 2 .]" 1
324 1 9 TYR QD 1 35 PRO HB2 4.720 . 7.640 3.937 3.386 4.314 . 0 0 "[ . 1 . 2 .]" 1
325 1 9 TYR QD 1 35 PRO HB3 4.720 . 7.640 4.433 4.161 4.653 . 0 0 "[ . 1 . 2 .]" 1
326 1 9 TYR QD 1 35 PRO HG2 4.455 . 7.110 3.028 2.615 3.276 . 0 0 "[ . 1 . 2 .]" 1
327 1 9 TYR QD 1 35 PRO QG 4.365 . 6.930 2.671 2.433 2.794 . 0 0 "[ . 1 . 2 .]" 1
328 1 9 TYR QD 1 35 PRO HG3 4.455 . 7.110 3.052 2.860 3.836 . 0 0 "[ . 1 . 2 .]" 1
329 1 9 TYR QD 1 37 ASP H 4.720 . 7.640 6.359 6.060 6.541 . 0 0 "[ . 1 . 2 .]" 1
330 1 9 TYR QD 1 38 ALA H 4.720 . 7.640 4.515 4.150 4.690 . 0 0 "[ . 1 . 2 .]" 1
331 1 9 TYR QD 1 38 ALA MB 4.010 . 6.220 2.137 1.969 2.351 . 0 0 "[ . 1 . 2 .]" 1
332 1 9 TYR QD 1 40 VAL HA 4.440 . 7.080 4.089 3.856 4.226 . 0 0 "[ . 1 . 2 .]" 1
333 1 9 TYR QD 1 40 VAL MG1 4.755 . 7.710 4.529 4.457 4.575 . 0 0 "[ . 1 . 2 .]" 1
334 1 9 TYR QD 1 40 VAL MG2 4.040 . 6.280 3.446 3.201 3.565 . 0 0 "[ . 1 . 2 .]" 1
335 1 9 TYR QE 1 16 PHE HB2 4.715 . 7.630 3.811 3.605 4.294 . 0 0 "[ . 1 . 2 .]" 1
336 1 9 TYR QE 1 18 PRO HA 3.815 . 5.830 3.088 2.829 3.285 . 0 0 "[ . 1 . 2 .]" 1
337 1 9 TYR QE 1 18 PRO HB2 4.670 . 7.540 4.529 4.257 4.893 . 0 0 "[ . 1 . 2 .]" 1
338 1 9 TYR QE 1 18 PRO QB 4.470 . 7.140 3.105 2.697 3.501 . 0 0 "[ . 1 . 2 .]" 1
339 1 9 TYR QE 1 18 PRO HB3 4.670 . 7.540 3.166 2.727 3.612 . 0 0 "[ . 1 . 2 .]" 1
340 1 9 TYR QE 1 19 LEU H 4.715 . 7.630 4.383 4.239 4.498 . 0 0 "[ . 1 . 2 .]" 1
341 1 9 TYR QE 1 31 THR MG 4.205 . 6.610 2.540 2.273 3.088 . 0 0 "[ . 1 . 2 .]" 1
342 1 9 TYR QE 1 35 PRO HA 4.715 . 7.630 5.335 5.054 5.500 . 0 0 "[ . 1 . 2 .]" 1
343 1 9 TYR QE 1 35 PRO HB2 3.990 . 6.180 3.203 2.604 3.458 . 0 0 "[ . 1 . 2 .]" 1
344 1 9 TYR QE 1 35 PRO HB3 3.990 . 6.180 3.536 3.264 3.687 . 0 0 "[ . 1 . 2 .]" 1
345 1 9 TYR QE 1 35 PRO HG2 4.265 . 6.730 3.581 3.006 3.977 . 0 0 "[ . 1 . 2 .]" 1
346 1 9 TYR QE 1 35 PRO HG3 4.265 . 6.730 3.099 2.900 3.368 . 0 0 "[ . 1 . 2 .]" 1
347 1 9 TYR QE 1 36 SER H 4.715 . 7.630 6.721 6.247 6.905 . 0 0 "[ . 1 . 2 .]" 1
348 1 9 TYR QE 1 37 ASP H 4.715 . 7.630 5.415 4.795 5.648 . 0 0 "[ . 1 . 2 .]" 1
349 1 9 TYR QE 1 38 ALA H 4.175 . 6.550 4.062 3.322 4.344 . 0 0 "[ . 1 . 2 .]" 1
350 1 9 TYR QE 1 38 ALA MB 3.790 . 5.780 2.073 1.867 2.375 . 0 0 "[ . 1 . 2 .]" 1
351 1 9 TYR QE 1 40 VAL MG2 4.380 . 6.960 4.833 4.648 4.970 . 0 0 "[ . 1 . 2 .]" 1
352 1 9 TYR N 1 39 PRO O 2.950 2.700 3.200 2.677 2.664 2.697 0.036 12 0 "[ . 1 . 2 .]" 1
353 1 9 TYR O 1 41 LEU H 1.950 . 2.200 2.060 2.031 2.095 . 0 0 "[ . 1 . 2 .]" 1
354 1 9 TYR O 1 41 LEU N 2.950 2.700 3.200 2.635 2.616 2.652 0.084 17 0 "[ . 1 . 2 .]" 1
355 1 10 VAL H 1 10 VAL HB 2.425 . 3.050 2.864 2.829 2.889 . 0 0 "[ . 1 . 2 .]" 1
356 1 10 VAL H 1 10 VAL MG2 2.770 . 3.740 2.833 2.814 2.854 . 0 0 "[ . 1 . 2 .]" 1
357 1 10 VAL H 1 11 TYR H 3.155 . 4.510 4.165 4.137 4.195 . 0 0 "[ . 1 . 2 .]" 1
358 1 10 VAL H 1 16 PHE HA 3.355 . 4.910 3.526 3.434 3.615 . 0 0 "[ . 1 . 2 .]" 1
359 1 10 VAL H 1 17 PHE H 2.595 . 3.390 2.565 2.525 2.592 . 0 0 "[ . 1 . 2 .]" 1
360 1 10 VAL H 1 17 PHE HB2 2.815 . 3.830 3.109 3.043 3.194 . 0 0 "[ . 1 . 2 .]" 1
361 1 10 VAL H 1 17 PHE QD 4.710 . 7.620 4.672 4.606 4.794 . 0 0 "[ . 1 . 2 .]" 1
362 1 10 VAL H 1 17 PHE O 1.950 . 2.200 2.016 1.921 2.211 0.011 1 0 "[ . 1 . 2 .]" 1
363 1 10 VAL H 1 18 PRO HA 3.075 . 4.350 4.362 4.332 4.383 0.033 11 0 "[ . 1 . 2 .]" 1
364 1 10 VAL H 1 19 LEU H 3.170 . 4.540 4.545 4.459 4.577 0.037 23 0 "[ . 1 . 2 .]" 1
365 1 10 VAL H 1 19 LEU QD 4.950 . 8.100 4.282 4.238 4.325 . 0 0 "[ . 1 . 2 .]" 1
366 1 10 VAL H 1 25 LEU MD1 4.165 . 6.530 4.999 4.885 5.124 . 0 0 "[ . 1 . 2 .]" 1
367 1 10 VAL H 1 25 LEU MD2 3.775 . 5.750 3.931 3.823 4.046 . 0 0 "[ . 1 . 2 .]" 1
368 1 10 VAL H 1 25 LEU HG 3.650 . 5.500 4.964 4.849 5.066 . 0 0 "[ . 1 . 2 .]" 1
369 1 10 VAL HA 1 10 VAL MG1 2.630 . 3.460 2.267 2.180 2.388 . 0 0 "[ . 1 . 2 .]" 1
370 1 10 VAL HA 1 10 VAL MG2 2.675 . 3.550 2.367 2.335 2.398 . 0 0 "[ . 1 . 2 .]" 1
371 1 10 VAL HA 1 11 TYR H 2.350 . 2.900 2.127 2.119 2.132 . 0 0 "[ . 1 . 2 .]" 1
372 1 10 VAL HA 1 17 PHE H 3.224 . 4.534 4.450 4.437 4.468 . 0 0 "[ . 1 . 2 .]" 1
373 1 10 VAL HA 1 25 LEU MD1 3.840 . 5.880 4.557 4.446 4.645 . 0 0 "[ . 1 . 2 .]" 1
374 1 10 VAL HA 1 25 LEU MD2 4.165 . 6.530 4.838 4.780 4.924 . 0 0 "[ . 1 . 2 .]" 1
375 1 10 VAL HA 1 41 LEU H 2.550 . 3.300 2.152 2.119 2.183 . 0 0 "[ . 1 . 2 .]" 1
376 1 10 VAL HA 1 41 LEU QB 3.175 . 4.550 1.970 1.955 1.981 . 0 0 "[ . 1 . 2 .]" 1
377 1 10 VAL HA 1 41 LEU MD1 3.375 . 4.950 3.698 3.660 3.739 . 0 0 "[ . 1 . 2 .]" 1
378 1 10 VAL HA 1 50 ILE MD 3.945 . 6.090 4.889 4.875 4.903 . 0 0 "[ . 1 . 2 .]" 1
379 1 10 VAL HA 1 50 ILE MG 3.915 . 6.144 4.802 4.734 4.860 . 0 0 "[ . 1 . 2 .]" 1
380 1 10 VAL HB 1 11 TYR H 3.045 . 4.290 4.211 4.176 4.231 . 0 0 "[ . 1 . 2 .]" 1
381 1 10 VAL HB 1 17 PHE H 2.830 . 3.860 3.145 3.058 3.251 . 0 0 "[ . 1 . 2 .]" 1
382 1 10 VAL HB 1 17 PHE HB2 3.650 . 5.500 1.956 1.943 1.967 . 0 0 "[ . 1 . 2 .]" 1
383 1 10 VAL HB 1 17 PHE HB3 3.015 . 4.230 3.638 3.610 3.662 . 0 0 "[ . 1 . 2 .]" 1
384 1 10 VAL HB 1 17 PHE QD 4.185 . 6.570 2.776 2.497 3.224 . 0 0 "[ . 1 . 2 .]" 1
385 1 10 VAL HB 1 19 LEU QD 4.900 . 8.114 4.142 4.123 4.161 . 0 0 "[ . 1 . 2 .]" 1
386 1 10 VAL HB 1 25 LEU MD1 2.800 . 3.800 2.676 2.540 2.818 . 0 0 "[ . 1 . 2 .]" 1
387 1 10 VAL HB 1 25 LEU MD2 2.755 . 3.710 2.367 2.296 2.464 . 0 0 "[ . 1 . 2 .]" 1
388 1 10 VAL HB 1 41 LEU MD1 4.070 . 6.340 4.932 4.858 4.987 . 0 0 "[ . 1 . 2 .]" 1
389 1 10 VAL HB 1 50 ILE MD 3.650 . 5.500 4.426 4.390 4.466 . 0 0 "[ . 1 . 2 .]" 1
390 1 10 VAL MG1 1 11 TYR H 2.740 . 3.680 2.772 2.667 2.910 . 0 0 "[ . 1 . 2 .]" 1
391 1 10 VAL MG1 1 11 TYR HA 3.560 . 5.320 4.235 4.116 4.314 . 0 0 "[ . 1 . 2 .]" 1
392 1 10 VAL MG1 1 11 TYR QD 5.235 . 8.670 5.388 5.319 5.434 . 0 0 "[ . 1 . 2 .]" 1
393 1 10 VAL MG1 1 12 ASP H 3.715 . 5.630 4.347 4.221 4.482 . 0 0 "[ . 1 . 2 .]" 1
394 1 10 VAL MG1 1 12 ASP HA 4.040 . 6.280 4.839 4.649 4.979 . 0 0 "[ . 1 . 2 .]" 1
395 1 10 VAL MG1 1 12 ASP HB2 2.910 . 4.134 2.946 2.842 3.141 . 0 0 "[ . 1 . 2 .]" 1
396 1 10 VAL MG1 1 12 ASP HB3 3.235 . 4.670 3.548 3.238 3.746 . 0 0 "[ . 1 . 2 .]" 1
397 1 10 VAL MG1 1 17 PHE H 3.495 . 5.190 4.195 4.152 4.233 . 0 0 "[ . 1 . 2 .]" 1
398 1 10 VAL MG1 1 17 PHE HB2 3.015 . 4.230 3.569 3.521 3.599 . 0 0 "[ . 1 . 2 .]" 1
399 1 10 VAL MG1 1 17 PHE QD 4.045 . 6.290 3.103 2.761 3.522 . 0 0 "[ . 1 . 2 .]" 1
400 1 10 VAL MG1 1 17 PHE QE 4.930 . 8.060 4.211 3.955 4.623 . 0 0 "[ . 1 . 2 .]" 1
401 1 10 VAL MG1 1 19 LEU QD 5.465 . 9.130 3.491 3.395 3.576 . 0 0 "[ . 1 . 2 .]" 1
402 1 10 VAL MG1 1 19 LEU HG 4.135 . 6.470 4.416 4.342 4.492 . 0 0 "[ . 1 . 2 .]" 1
403 1 10 VAL MG1 1 25 LEU QB 4.600 . 7.400 4.514 4.458 4.581 . 0 0 "[ . 1 . 2 .]" 1
404 1 10 VAL MG1 1 25 LEU MD1 3.795 . 5.790 1.971 1.913 2.067 . 0 0 "[ . 1 . 2 .]" 1
405 1 10 VAL MG1 1 25 LEU MD2 4.010 . 6.220 3.122 3.002 3.219 . 0 0 "[ . 1 . 2 .]" 1
406 1 10 VAL MG1 1 25 LEU HG 3.435 . 5.070 3.597 3.495 3.719 . 0 0 "[ . 1 . 2 .]" 1
407 1 10 VAL MG1 1 27 LYS QE 4.219 . 6.524 4.117 3.692 4.553 . 0 0 "[ . 1 . 2 .]" 1
408 1 10 VAL MG1 1 41 LEU QB 3.595 . 5.390 2.502 2.398 2.622 . 0 0 "[ . 1 . 2 .]" 1
409 1 10 VAL MG1 1 41 LEU MD1 4.219 . 6.524 3.329 3.166 3.451 . 0 0 "[ . 1 . 2 .]" 1
410 1 10 VAL MG1 1 41 LEU HG 4.025 . 6.250 4.596 4.535 4.720 . 0 0 "[ . 1 . 2 .]" 1
411 1 10 VAL MG1 1 42 VAL HA 3.790 . 5.780 4.621 4.527 4.691 . 0 0 "[ . 1 . 2 .]" 1
412 1 10 VAL MG1 1 44 TRP QB 3.815 . 5.830 2.620 2.573 2.683 . 0 0 "[ . 1 . 2 .]" 1
413 1 10 VAL MG1 1 44 TRP HD1 3.650 . 5.500 3.448 3.344 3.559 . 0 0 "[ . 1 . 2 .]" 1
414 1 10 VAL MG1 1 44 TRP HE3 4.165 . 6.530 5.374 5.323 5.403 . 0 0 "[ . 1 . 2 .]" 1
415 1 10 VAL MG1 1 50 ILE MD 3.545 . 5.290 2.224 2.072 2.396 . 0 0 "[ . 1 . 2 .]" 1
416 1 10 VAL MG1 1 50 ILE MG 4.290 . 6.780 3.306 3.144 3.454 . 0 0 "[ . 1 . 2 .]" 1
417 1 10 VAL MG2 1 11 TYR H 3.515 . 5.230 4.152 4.110 4.182 . 0 0 "[ . 1 . 2 .]" 1
418 1 10 VAL MG2 1 17 PHE H 3.760 . 5.720 4.206 4.122 4.324 . 0 0 "[ . 1 . 2 .]" 1
419 1 10 VAL MG2 1 17 PHE HB2 3.095 . 4.390 2.899 2.793 3.083 . 0 0 "[ . 1 . 2 .]" 1
420 1 10 VAL MG2 1 17 PHE HB3 3.790 . 5.780 3.942 3.847 4.094 . 0 0 "[ . 1 . 2 .]" 1
421 1 10 VAL MG2 1 17 PHE QD 4.915 . 8.144 3.909 3.741 4.176 . 0 0 "[ . 1 . 2 .]" 1
422 1 10 VAL MG2 1 19 LEU HA 3.530 . 5.260 3.832 3.788 3.863 . 0 0 "[ . 1 . 2 .]" 1
423 1 10 VAL MG2 1 19 LEU QB 4.200 . 6.600 2.924 2.892 2.967 . 0 0 "[ . 1 . 2 .]" 1
424 1 10 VAL MG2 1 19 LEU MD1 3.560 . 5.320 1.799 1.783 1.809 0.017 5 0 "[ . 1 . 2 .]" 1
425 1 10 VAL MG2 1 19 LEU QD 3.370 . 4.940 1.789 1.772 1.800 0.028 5 0 "[ . 1 . 2 .]" 1
426 1 10 VAL MG2 1 19 LEU MD2 3.560 . 5.320 3.156 3.095 3.211 . 0 0 "[ . 1 . 2 .]" 1
427 1 10 VAL MG2 1 19 LEU HG 3.465 . 5.130 1.916 1.898 1.936 . 0 0 "[ . 1 . 2 .]" 1
428 1 10 VAL MG2 1 25 LEU HA 3.590 . 5.380 3.597 3.536 3.663 . 0 0 "[ . 1 . 2 .]" 1
429 1 10 VAL MG2 1 25 LEU QB 3.780 . 5.760 3.463 3.440 3.492 . 0 0 "[ . 1 . 2 .]" 1
430 1 10 VAL MG2 1 25 LEU MD1 3.595 . 5.390 1.944 1.885 2.045 . 0 0 "[ . 1 . 2 .]" 1
431 1 10 VAL MG2 1 25 LEU MD2 3.655 . 5.510 2.353 2.255 2.458 . 0 0 "[ . 1 . 2 .]" 1
432 1 10 VAL MG2 1 25 LEU HG 2.875 . 3.950 1.826 1.820 1.840 . 0 0 "[ . 1 . 2 .]" 1
433 1 10 VAL MG2 1 41 LEU H 3.250 . 4.700 3.687 3.668 3.698 . 0 0 "[ . 1 . 2 .]" 1
434 1 10 VAL MG2 1 41 LEU QB 3.580 . 5.360 2.460 2.341 2.545 . 0 0 "[ . 1 . 2 .]" 1
435 1 10 VAL MG2 1 41 LEU MD1 3.455 . 5.110 2.398 2.293 2.493 . 0 0 "[ . 1 . 2 .]" 1
436 1 10 VAL MG2 1 41 LEU HG 3.205 . 4.610 3.311 3.251 3.363 . 0 0 "[ . 1 . 2 .]" 1
437 1 10 VAL MG2 1 44 TRP HD1 4.165 . 6.530 5.229 5.151 5.317 . 0 0 "[ . 1 . 2 .]" 1
438 1 10 VAL MG2 1 50 ILE MD 3.470 . 5.140 2.744 2.700 2.805 . 0 0 "[ . 1 . 2 .]" 1
439 1 10 VAL MG2 1 50 ILE MG 3.920 . 6.040 2.185 2.102 2.279 . 0 0 "[ . 1 . 2 .]" 1
440 1 10 VAL N 1 17 PHE O 2.950 2.700 3.200 2.746 2.692 2.894 0.008 25 0 "[ . 1 . 2 .]" 1
441 1 10 VAL O 1 17 PHE H 1.950 . 2.200 1.789 1.746 1.826 . 0 0 "[ . 1 . 2 .]" 1
442 1 10 VAL O 1 17 PHE N 2.950 2.700 3.200 2.752 2.715 2.790 . 0 0 "[ . 1 . 2 .]" 1
443 1 11 TYR H 1 11 TYR HB2 2.505 . 3.210 2.251 2.235 2.270 . 0 0 "[ . 1 . 2 .]" 1
444 1 11 TYR H 1 11 TYR HB3 2.470 . 3.140 2.939 2.920 2.962 . 0 0 "[ . 1 . 2 .]" 1
445 1 11 TYR H 1 12 ASP H 3.525 . 5.250 4.373 4.329 4.403 . 0 0 "[ . 1 . 2 .]" 1
446 1 11 TYR H 1 40 VAL HA 3.230 . 4.660 4.644 4.597 4.684 0.024 9 0 "[ . 1 . 2 .]" 1
447 1 11 TYR H 1 40 VAL MG1 3.235 . 4.670 2.462 2.427 2.535 . 0 0 "[ . 1 . 2 .]" 1
448 1 11 TYR H 1 41 LEU H 3.030 . 4.260 2.667 2.610 2.712 . 0 0 "[ . 1 . 2 .]" 1
449 1 11 TYR H 1 41 LEU QB 3.425 . 5.050 3.219 3.200 3.251 . 0 0 "[ . 1 . 2 .]" 1
450 1 11 TYR H 1 41 LEU O 1.950 . 2.200 1.900 1.851 1.929 . 0 0 "[ . 1 . 2 .]" 1
451 1 11 TYR H 1 42 VAL QG 4.090 . 6.380 3.784 3.702 3.873 . 0 0 "[ . 1 . 2 .]" 1
452 1 11 TYR HA 1 12 ASP H 2.225 . 2.650 2.140 2.130 2.156 . 0 0 "[ . 1 . 2 .]" 1
453 1 11 TYR HA 1 15 THR H 3.295 . 4.790 4.331 4.219 4.431 . 0 0 "[ . 1 . 2 .]" 1
454 1 11 TYR HA 1 16 PHE HA 2.395 . 2.990 2.646 2.588 2.706 . 0 0 "[ . 1 . 2 .]" 1
455 1 11 TYR HA 1 16 PHE QD 4.155 . 6.510 3.621 3.440 3.729 . 0 0 "[ . 1 . 2 .]" 1
456 1 11 TYR HA 1 40 VAL MG1 3.760 . 5.720 3.068 3.008 3.120 . 0 0 "[ . 1 . 2 .]" 1
457 1 11 TYR HA 1 42 VAL MG2 3.980 . 6.160 4.686 4.583 4.777 . 0 0 "[ . 1 . 2 .]" 1
458 1 11 TYR HB2 1 16 PHE HA 3.650 . 5.500 4.780 4.701 4.857 . 0 0 "[ . 1 . 2 .]" 1
459 1 11 TYR HB2 1 16 PHE QD 4.525 . 7.250 3.798 3.702 3.920 . 0 0 "[ . 1 . 2 .]" 1
460 1 11 TYR HB2 1 42 VAL HA 2.720 . 3.640 2.651 2.564 2.721 . 0 0 "[ . 1 . 2 .]" 1
461 1 11 TYR HB2 1 42 VAL MG1 3.590 . 5.380 3.890 3.819 3.938 . 0 0 "[ . 1 . 2 .]" 1
462 1 11 TYR HB2 1 42 VAL MG2 3.295 . 4.790 2.386 2.189 2.578 . 0 0 "[ . 1 . 2 .]" 1
463 1 11 TYR HB3 1 16 PHE QD 4.710 . 7.620 5.193 5.041 5.307 . 0 0 "[ . 1 . 2 .]" 1
464 1 11 TYR HB3 1 16 PHE QE 4.710 . 7.620 5.415 5.317 5.529 . 0 0 "[ . 1 . 2 .]" 1
465 1 11 TYR HB3 1 42 VAL HA 2.690 . 3.580 2.118 2.000 2.208 . 0 0 "[ . 1 . 2 .]" 1
466 1 11 TYR HB3 1 42 VAL MG1 3.670 . 5.540 3.024 2.915 3.114 . 0 0 "[ . 1 . 2 .]" 1
467 1 11 TYR HB3 1 42 VAL MG2 3.095 . 4.390 2.805 2.625 2.990 . 0 0 "[ . 1 . 2 .]" 1
468 1 11 TYR QD 1 12 ASP H 3.885 . 5.970 2.512 2.327 2.748 . 0 0 "[ . 1 . 2 .]" 1
469 1 11 TYR QD 1 12 ASP HA 4.705 . 7.610 3.461 3.315 3.786 . 0 0 "[ . 1 . 2 .]" 1
470 1 11 TYR QD 1 14 GLN H 4.720 . 7.640 3.837 3.572 4.170 . 0 0 "[ . 1 . 2 .]" 1
471 1 11 TYR QD 1 14 GLN HA 4.610 . 7.420 3.861 3.578 4.053 . 0 0 "[ . 1 . 2 .]" 1
472 1 11 TYR QD 1 15 THR H 4.720 . 7.640 3.407 3.075 3.597 . 0 0 "[ . 1 . 2 .]" 1
473 1 11 TYR QD 1 15 THR MG 5.235 . 8.670 5.921 5.652 6.096 . 0 0 "[ . 1 . 2 .]" 1
474 1 11 TYR QD 1 16 PHE H 4.720 . 7.640 5.466 5.066 5.661 . 0 0 "[ . 1 . 2 .]" 1
475 1 11 TYR QD 1 16 PHE HA 3.865 . 5.930 4.397 4.015 4.591 . 0 0 "[ . 1 . 2 .]" 1
476 1 11 TYR QD 1 17 PHE H 4.720 . 7.640 5.675 5.397 5.820 . 0 0 "[ . 1 . 2 .]" 1
477 1 11 TYR QD 1 34 ALA MB 4.705 . 7.610 5.112 4.875 5.324 . 0 0 "[ . 1 . 2 .]" 1
478 1 11 TYR QD 1 40 VAL MG1 4.135 . 6.470 2.181 1.986 2.584 . 0 0 "[ . 1 . 2 .]" 1
479 1 11 TYR QD 1 40 VAL MG2 4.630 . 7.460 3.948 3.784 4.336 . 0 0 "[ . 1 . 2 .]" 1
480 1 11 TYR QD 1 42 VAL HA 3.945 . 6.090 3.904 3.664 3.992 . 0 0 "[ . 1 . 2 .]" 1
481 1 11 TYR QD 1 42 VAL MG1 4.010 . 6.220 3.788 3.401 3.903 . 0 0 "[ . 1 . 2 .]" 1
482 1 11 TYR QD 1 42 VAL MG2 4.070 . 6.340 2.097 1.878 2.228 . 0 0 "[ . 1 . 2 .]" 1
483 1 11 TYR QE 1 12 ASP H 4.715 . 7.630 4.444 4.302 4.604 . 0 0 "[ . 1 . 2 .]" 1
484 1 11 TYR QE 1 14 GLN H 4.575 . 7.350 3.782 3.455 4.318 . 0 0 "[ . 1 . 2 .]" 1
485 1 11 TYR QE 1 14 GLN HA 3.385 . 4.970 2.409 1.997 2.855 . 0 0 "[ . 1 . 2 .]" 1
486 1 11 TYR QE 1 14 GLN HG2 4.715 . 7.630 4.004 3.636 4.362 . 0 0 "[ . 1 . 2 .]" 1
487 1 11 TYR QE 1 14 GLN HG3 4.715 . 7.630 4.292 3.886 4.874 . 0 0 "[ . 1 . 2 .]" 1
488 1 11 TYR QE 1 15 THR HA 4.715 . 7.630 4.591 4.204 4.855 . 0 0 "[ . 1 . 2 .]" 1
489 1 11 TYR QE 1 16 PHE HA 4.715 . 7.630 5.475 5.251 5.592 . 0 0 "[ . 1 . 2 .]" 1
490 1 11 TYR QE 1 34 ALA MB 4.229 . 6.544 4.121 3.943 4.478 . 0 0 "[ . 1 . 2 .]" 1
491 1 11 TYR QE 1 40 VAL MG1 4.300 . 6.800 3.780 3.651 3.953 . 0 0 "[ . 1 . 2 .]" 1
492 1 11 TYR QE 1 40 VAL MG2 4.595 . 7.390 4.624 4.458 4.920 . 0 0 "[ . 1 . 2 .]" 1
493 1 11 TYR QE 1 42 VAL MG1 4.175 . 6.550 4.818 4.502 4.899 . 0 0 "[ . 1 . 2 .]" 1
494 1 11 TYR QE 1 42 VAL MG2 4.595 . 7.390 3.721 3.516 3.836 . 0 0 "[ . 1 . 2 .]" 1
495 1 11 TYR N 1 41 LEU O 2.950 2.700 3.200 2.787 2.730 2.829 . 0 0 "[ . 1 . 2 .]" 1
496 1 12 ASP H 1 12 ASP HB2 2.595 . 3.390 3.398 3.344 3.427 0.037 16 0 "[ . 1 . 2 .]" 1
497 1 12 ASP H 1 12 ASP HB3 2.520 . 3.240 3.102 2.962 3.226 . 0 0 "[ . 1 . 2 .]" 1
498 1 12 ASP H 1 13 ARG H 3.000 . 4.200 4.205 4.181 4.230 0.030 12 0 "[ . 1 . 2 .]" 1
499 1 12 ASP H 1 14 GLN H 3.200 . 4.600 4.277 4.237 4.339 . 0 0 "[ . 1 . 2 .]" 1
500 1 12 ASP H 1 15 THR H 2.505 . 3.210 2.882 2.826 2.948 . 0 0 "[ . 1 . 2 .]" 1
501 1 12 ASP H 1 15 THR HB 3.200 . 4.600 4.431 4.163 4.589 . 0 0 "[ . 1 . 2 .]" 1
502 1 12 ASP H 1 15 THR MG 4.165 . 6.530 4.917 4.717 5.021 . 0 0 "[ . 1 . 2 .]" 1
503 1 12 ASP H 1 15 THR O 1.950 . 2.200 2.051 1.880 2.169 . 0 0 "[ . 1 . 2 .]" 1
504 1 12 ASP H 1 16 PHE HA 2.625 . 3.450 3.462 3.446 3.478 0.028 11 0 "[ . 1 . 2 .]" 1
505 1 12 ASP H 1 16 PHE QD 4.710 . 7.620 5.224 5.122 5.295 . 0 0 "[ . 1 . 2 .]" 1
506 1 12 ASP H 1 16 PHE QE 4.710 . 7.620 6.132 6.038 6.230 . 0 0 "[ . 1 . 2 .]" 1
507 1 12 ASP H 1 17 PHE H 3.155 . 4.510 3.981 3.903 4.086 . 0 0 "[ . 1 . 2 .]" 1
508 1 12 ASP H 1 17 PHE QD 4.710 . 7.620 4.681 4.571 4.784 . 0 0 "[ . 1 . 2 .]" 1
509 1 12 ASP HA 1 12 ASP HB2 2.315 . 2.830 2.503 2.456 2.570 . 0 0 "[ . 1 . 2 .]" 1
510 1 12 ASP HA 1 13 ARG HA 3.295 . 4.790 4.393 4.374 4.405 . 0 0 "[ . 1 . 2 .]" 1
511 1 12 ASP HA 1 14 GLN H 2.875 . 3.950 3.663 3.569 3.802 . 0 0 "[ . 1 . 2 .]" 1
512 1 12 ASP HA 1 17 PHE QE 4.710 . 7.620 4.932 4.779 5.148 . 0 0 "[ . 1 . 2 .]" 1
513 1 12 ASP HA 1 17 PHE HZ 3.650 . 5.500 5.403 5.237 5.530 0.030 16 0 "[ . 1 . 2 .]" 1
514 1 12 ASP HB2 1 17 PHE QD 4.710 . 7.620 4.245 4.158 4.393 . 0 0 "[ . 1 . 2 .]" 1
515 1 12 ASP HB2 1 17 PHE QE 4.340 . 6.880 3.625 3.461 3.898 . 0 0 "[ . 1 . 2 .]" 1
516 1 12 ASP HB3 1 13 ARG H 3.355 . 4.910 3.927 3.747 4.118 . 0 0 "[ . 1 . 2 .]" 1
517 1 12 ASP HB3 1 17 PHE QD 4.015 . 6.230 3.321 3.133 3.461 . 0 0 "[ . 1 . 2 .]" 1
518 1 12 ASP HB3 1 17 PHE QE 3.780 . 5.760 2.204 1.973 2.576 . 0 0 "[ . 1 . 2 .]" 1
519 1 12 ASP HB3 1 17 PHE HZ 3.465 . 5.130 3.315 3.071 3.548 . 0 0 "[ . 1 . 2 .]" 1
520 1 12 ASP N 1 15 THR O 2.950 2.700 3.200 3.014 2.856 3.124 . 0 0 "[ . 1 . 2 .]" 1
521 1 12 ASP O 1 15 THR H 1.950 . 2.200 2.212 2.203 2.218 0.018 1 0 "[ . 1 . 2 .]" 1
522 1 12 ASP O 1 15 THR N 2.950 2.700 3.200 3.030 2.999 3.058 . 0 0 "[ . 1 . 2 .]" 1
523 1 13 ARG H 1 14 GLN H 2.720 . 3.640 2.707 2.674 2.750 . 0 0 "[ . 1 . 2 .]" 1
524 1 13 ARG HA 1 13 ARG QD 2.970 . 4.140 3.081 2.006 3.706 . 0 0 "[ . 1 . 2 .]" 1
525 1 13 ARG HA 1 14 GLN H 2.240 . 2.680 2.752 2.724 2.769 0.089 24 0 "[ . 1 . 2 .]" 1
526 1 13 ARG QB 1 13 ARG QD 2.760 . 3.720 2.124 1.942 2.341 . 0 0 "[ . 1 . 2 .]" 1
527 1 14 GLN H 1 15 THR H 2.580 . 3.360 2.770 2.750 2.787 . 0 0 "[ . 1 . 2 .]" 1
528 1 14 GLN HA 1 14 GLN QE 4.085 . 6.370 4.344 4.236 4.461 . 0 0 "[ . 1 . 2 .]" 1
529 1 14 GLN HA 1 14 GLN HG2 2.214 . 2.514 2.459 2.454 2.465 . 0 0 "[ . 1 . 2 .]" 1
530 1 14 GLN HA 1 14 GLN HG3 2.214 . 2.514 2.456 2.452 2.462 . 0 0 "[ . 1 . 2 .]" 1
531 1 14 GLN HA 1 15 THR H 2.395 . 2.990 2.949 2.916 2.977 . 0 0 "[ . 1 . 2 .]" 1
532 1 14 GLN QB 1 14 GLN HE21 3.950 . 6.100 2.905 1.989 3.888 . 0 0 "[ . 1 . 2 .]" 1
533 1 14 GLN QB 1 14 GLN HE22 3.950 . 6.100 3.683 3.291 4.137 . 0 0 "[ . 1 . 2 .]" 1
534 1 14 GLN QB 1 15 THR HA 3.935 . 6.070 4.415 4.378 4.451 . 0 0 "[ . 1 . 2 .]" 1
535 1 14 GLN QB 1 15 THR MG 4.600 . 7.400 5.184 5.116 5.230 . 0 0 "[ . 1 . 2 .]" 1
536 1 15 THR HA 1 15 THR MG 2.615 . 3.430 2.485 2.454 2.508 . 0 0 "[ . 1 . 2 .]" 1
537 1 15 THR HA 1 16 PHE H 2.440 . 3.080 2.221 2.204 2.242 . 0 0 "[ . 1 . 2 .]" 1
538 1 15 THR HA 1 16 PHE QD 4.510 . 7.220 3.301 3.216 3.518 . 0 0 "[ . 1 . 2 .]" 1
539 1 15 THR HA 1 31 THR H 3.000 . 4.200 4.197 4.140 4.211 0.011 24 0 "[ . 1 . 2 .]" 1
540 1 15 THR HA 1 32 LYS HA 2.610 . 3.420 2.660 2.550 2.896 . 0 0 "[ . 1 . 2 .]" 1
541 1 15 THR HB 1 16 PHE H 3.170 . 4.540 3.964 3.877 4.013 . 0 0 "[ . 1 . 2 .]" 1
542 1 15 THR HB 1 17 PHE QD 3.980 . 6.160 3.739 3.543 3.993 . 0 0 "[ . 1 . 2 .]" 1
543 1 15 THR HB 1 17 PHE QE 3.500 . 5.200 2.300 1.980 2.682 . 0 0 "[ . 1 . 2 .]" 1
544 1 15 THR HB 1 17 PHE HZ 2.765 . 3.730 3.740 3.684 3.757 0.027 15 0 "[ . 1 . 2 .]" 1
545 1 15 THR HB 1 31 THR H 3.650 . 5.500 4.631 4.551 4.667 . 0 0 "[ . 1 . 2 .]" 1
546 1 15 THR MG 1 16 PHE H 2.940 . 4.080 2.121 2.079 2.157 . 0 0 "[ . 1 . 2 .]" 1
547 1 15 THR MG 1 16 PHE HA 3.375 . 4.950 3.854 3.842 3.866 . 0 0 "[ . 1 . 2 .]" 1
548 1 15 THR MG 1 16 PHE HB3 4.165 . 6.530 4.923 4.890 4.949 . 0 0 "[ . 1 . 2 .]" 1
549 1 15 THR MG 1 16 PHE QD 5.225 . 8.650 3.657 3.589 3.712 . 0 0 "[ . 1 . 2 .]" 1
550 1 15 THR MG 1 17 PHE H 3.775 . 5.750 4.130 4.083 4.172 . 0 0 "[ . 1 . 2 .]" 1
551 1 15 THR MG 1 17 PHE HA 3.390 . 4.980 3.795 3.721 3.875 . 0 0 "[ . 1 . 2 .]" 1
552 1 15 THR MG 1 17 PHE QD 3.940 . 6.080 2.770 2.559 3.041 . 0 0 "[ . 1 . 2 .]" 1
553 1 15 THR MG 1 17 PHE QE 3.830 . 5.860 2.511 2.167 2.817 . 0 0 "[ . 1 . 2 .]" 1
554 1 15 THR MG 1 18 PRO QD 4.355 . 6.910 4.235 4.098 4.355 . 0 0 "[ . 1 . 2 .]" 1
555 1 15 THR MG 1 30 GLY H 3.375 . 4.950 3.582 3.514 3.679 . 0 0 "[ . 1 . 2 .]" 1
556 1 15 THR MG 1 30 GLY HA2 2.660 . 3.520 2.961 2.884 3.009 . 0 0 "[ . 1 . 2 .]" 1
557 1 15 THR MG 1 30 GLY HA3 2.860 . 3.920 1.933 1.895 2.002 . 0 0 "[ . 1 . 2 .]" 1
558 1 15 THR MG 1 31 THR H 2.615 . 3.430 1.941 1.932 1.951 . 0 0 "[ . 1 . 2 .]" 1
559 1 15 THR MG 1 31 THR HA 3.065 . 4.330 2.840 2.784 2.946 . 0 0 "[ . 1 . 2 .]" 1
560 1 15 THR MG 1 31 THR HB 3.730 . 5.660 4.290 4.248 4.346 . 0 0 "[ . 1 . 2 .]" 1
561 1 15 THR MG 1 31 THR MG 4.180 . 6.560 3.291 3.193 3.340 . 0 0 "[ . 1 . 2 .]" 1
562 1 15 THR MG 1 32 LYS HA 2.985 . 4.170 3.247 3.219 3.288 . 0 0 "[ . 1 . 2 .]" 1
563 1 15 THR MG 1 32 LYS QG 4.385 . 6.970 4.173 3.948 4.907 . 0 0 "[ . 1 . 2 .]" 1
564 1 15 THR MG 1 33 THR MG 4.680 . 7.560 5.121 5.109 5.131 . 0 0 "[ . 1 . 2 .]" 1
565 1 16 PHE H 1 16 PHE QE 4.710 . 7.620 3.978 3.948 4.017 . 0 0 "[ . 1 . 2 .]" 1
566 1 16 PHE H 1 31 THR H 2.520 . 3.240 2.657 2.535 2.727 . 0 0 "[ . 1 . 2 .]" 1
567 1 16 PHE H 1 31 THR MG 3.405 . 5.010 2.841 2.654 2.974 . 0 0 "[ . 1 . 2 .]" 1
568 1 16 PHE H 1 31 THR O 1.950 . 2.200 1.786 1.716 1.848 . 0 0 "[ . 1 . 2 .]" 1
569 1 16 PHE H 1 32 LYS HA 3.090 . 4.380 3.684 3.623 3.764 . 0 0 "[ . 1 . 2 .]" 1
570 1 16 PHE HA 1 17 PHE H 2.270 . 2.740 2.129 2.119 2.139 . 0 0 "[ . 1 . 2 .]" 1
571 1 16 PHE HA 1 31 THR MG 3.650 . 5.500 4.348 4.136 4.437 . 0 0 "[ . 1 . 2 .]" 1
572 1 16 PHE HA 1 40 VAL MG1 3.360 . 4.920 3.557 3.522 3.597 . 0 0 "[ . 1 . 2 .]" 1
573 1 16 PHE HA 1 40 VAL MG2 3.530 . 5.260 4.188 4.144 4.223 . 0 0 "[ . 1 . 2 .]" 1
574 1 16 PHE HB2 1 17 PHE H 2.985 . 4.170 4.236 4.217 4.256 0.086 13 0 "[ . 1 . 2 .]" 1
575 1 16 PHE HB2 1 31 THR H 2.750 . 3.700 3.270 3.088 3.346 . 0 0 "[ . 1 . 2 .]" 1
576 1 16 PHE HB2 1 31 THR MG 2.845 . 3.890 2.123 1.875 2.243 . 0 0 "[ . 1 . 2 .]" 1
577 1 16 PHE HB2 1 35 PRO QG 3.515 . 5.230 3.382 2.740 3.773 . 0 0 "[ . 1 . 2 .]" 1
578 1 16 PHE HB2 1 40 VAL MG2 3.545 . 5.290 3.812 3.749 3.894 . 0 0 "[ . 1 . 2 .]" 1
579 1 16 PHE HB3 1 17 PHE H 2.705 . 3.610 3.656 3.641 3.680 0.070 25 0 "[ . 1 . 2 .]" 1
580 1 16 PHE HB3 1 31 THR MG 3.095 . 4.390 3.591 3.300 3.676 . 0 0 "[ . 1 . 2 .]" 1
581 1 16 PHE QD 1 17 PHE H 4.710 . 7.620 4.761 4.729 4.791 . 0 0 "[ . 1 . 2 .]" 1
582 1 16 PHE QD 1 31 THR H 4.710 . 7.620 3.729 3.542 3.813 . 0 0 "[ . 1 . 2 .]" 1
583 1 16 PHE QD 1 31 THR MG 4.125 . 6.450 2.324 1.977 2.470 . 0 0 "[ . 1 . 2 .]" 1
584 1 16 PHE QD 1 32 LYS H 4.710 . 7.620 4.584 4.150 4.670 . 0 0 "[ . 1 . 2 .]" 1
585 1 16 PHE QD 1 32 LYS HA 3.625 . 5.450 3.524 3.306 3.580 . 0 0 "[ . 1 . 2 .]" 1
586 1 16 PHE QD 1 32 LYS QD 5.150 . 8.500 5.231 5.089 5.546 . 0 0 "[ . 1 . 2 .]" 1
587 1 16 PHE QD 1 33 THR H 4.200 . 6.600 2.488 2.107 2.619 . 0 0 "[ . 1 . 2 .]" 1
588 1 16 PHE QD 1 33 THR HA 4.585 . 7.370 4.094 3.981 4.222 . 0 0 "[ . 1 . 2 .]" 1
589 1 16 PHE QD 1 33 THR MG 5.225 . 8.650 4.115 3.990 4.154 . 0 0 "[ . 1 . 2 .]" 1
590 1 16 PHE QD 1 34 ALA H 4.600 . 7.400 4.443 4.340 4.570 . 0 0 "[ . 1 . 2 .]" 1
591 1 16 PHE QD 1 34 ALA HA 3.640 . 5.480 3.323 3.195 3.399 . 0 0 "[ . 1 . 2 .]" 1
592 1 16 PHE QD 1 34 ALA MB 3.770 . 5.740 3.980 3.709 4.178 . 0 0 "[ . 1 . 2 .]" 1
593 1 16 PHE QD 1 35 PRO HD2 4.355 . 6.910 3.352 3.191 3.792 . 0 0 "[ . 1 . 2 .]" 1
594 1 16 PHE QD 1 35 PRO QD 4.280 . 6.760 2.960 2.753 3.223 . 0 0 "[ . 1 . 2 .]" 1
595 1 16 PHE QD 1 35 PRO HD3 4.355 . 6.910 3.307 2.948 3.566 . 0 0 "[ . 1 . 2 .]" 1
596 1 16 PHE QD 1 35 PRO QG 5.150 . 8.500 4.141 3.704 4.562 . 0 0 "[ . 1 . 2 .]" 1
597 1 16 PHE QE 1 31 THR MG 4.805 . 7.810 4.199 3.950 4.317 . 0 0 "[ . 1 . 2 .]" 1
598 1 16 PHE QE 1 32 LYS HA 4.015 . 6.230 3.695 3.267 3.838 . 0 0 "[ . 1 . 2 .]" 1
599 1 16 PHE QE 1 33 THR H 4.650 . 7.500 3.143 2.683 3.415 . 0 0 "[ . 1 . 2 .]" 1
600 1 16 PHE QE 1 33 THR HA 4.340 . 6.880 2.655 2.392 2.740 . 0 0 "[ . 1 . 2 .]" 1
601 1 16 PHE QE 1 34 ALA H 4.310 . 6.820 3.020 2.916 3.214 . 0 0 "[ . 1 . 2 .]" 1
602 1 16 PHE QE 1 34 ALA HA 3.825 . 5.850 3.117 2.981 3.384 . 0 0 "[ . 1 . 2 .]" 1
603 1 16 PHE QE 1 34 ALA MB 4.140 . 6.480 2.882 2.567 3.056 . 0 0 "[ . 1 . 2 .]" 1
604 1 16 PHE QE 1 35 PRO QD 5.150 . 8.500 3.734 3.467 4.114 . 0 0 "[ . 1 . 2 .]" 1
605 1 16 PHE QE 1 40 VAL MG2 3.800 . 5.800 2.797 2.649 3.169 . 0 0 "[ . 1 . 2 .]" 1
606 1 16 PHE QE 1 42 VAL MG2 4.700 . 7.600 4.370 4.268 4.521 . 0 0 "[ . 1 . 2 .]" 1
607 1 16 PHE HZ 1 34 ALA HA 3.435 . 5.070 3.381 3.099 3.819 . 0 0 "[ . 1 . 2 .]" 1
608 1 16 PHE HZ 1 34 ALA MB 3.140 . 4.480 2.532 2.319 2.910 . 0 0 "[ . 1 . 2 .]" 1
609 1 16 PHE N 1 31 THR O 2.950 2.700 3.200 2.707 2.661 2.780 0.039 12 0 "[ . 1 . 2 .]" 1
610 1 17 PHE H 1 17 PHE QE 4.710 . 7.620 4.512 4.430 4.563 . 0 0 "[ . 1 . 2 .]" 1
611 1 17 PHE H 1 18 PRO HD2 3.650 . 5.500 5.050 4.769 5.403 . 0 0 "[ . 1 . 2 .]" 1
612 1 17 PHE H 1 18 PRO HD3 3.650 . 5.500 4.719 4.418 4.926 . 0 0 "[ . 1 . 2 .]" 1
613 1 17 PHE H 1 25 LEU MD1 4.165 . 6.530 5.268 5.247 5.289 . 0 0 "[ . 1 . 2 .]" 1
614 1 17 PHE H 1 25 LEU MD2 3.560 . 5.320 3.939 3.880 3.981 . 0 0 "[ . 1 . 2 .]" 1
615 1 17 PHE H 1 27 LYS HA 3.510 . 5.220 5.195 5.072 5.250 0.030 6 0 "[ . 1 . 2 .]" 1
616 1 17 PHE H 1 30 GLY HA3 3.125 . 4.450 4.548 4.519 4.584 0.134 20 0 "[ . 1 . 2 .]" 1
617 1 17 PHE H 1 31 THR H 3.310 . 4.820 4.665 4.537 4.728 . 0 0 "[ . 1 . 2 .]" 1
618 1 17 PHE H 1 31 THR MG 4.229 . 6.544 5.012 4.771 5.168 . 0 0 "[ . 1 . 2 .]" 1
619 1 17 PHE H 1 40 VAL MG1 3.825 . 5.850 4.497 4.449 4.554 . 0 0 "[ . 1 . 2 .]" 1
620 1 17 PHE HA 1 18 PRO HD2 2.505 . 3.210 2.332 1.996 2.772 . 0 0 "[ . 1 . 2 .]" 1
621 1 17 PHE HA 1 18 PRO QD 2.410 . 3.020 1.943 1.895 2.041 . 0 0 "[ . 1 . 2 .]" 1
622 1 17 PHE HA 1 18 PRO HD3 2.505 . 3.210 2.286 1.929 2.589 . 0 0 "[ . 1 . 2 .]" 1
623 1 17 PHE HA 1 25 LEU MD2 3.560 . 5.320 3.770 3.746 3.793 . 0 0 "[ . 1 . 2 .]" 1
624 1 17 PHE HA 1 29 GLU H 3.385 . 4.970 4.818 4.736 4.944 . 0 0 "[ . 1 . 2 .]" 1
625 1 17 PHE HA 1 30 GLY H 2.920 . 4.040 3.859 3.782 3.909 . 0 0 "[ . 1 . 2 .]" 1
626 1 17 PHE HA 1 30 GLY HA2 2.765 . 3.730 2.102 1.996 2.182 . 0 0 "[ . 1 . 2 .]" 1
627 1 17 PHE HA 1 30 GLY HA3 2.675 . 3.550 2.815 2.698 2.942 . 0 0 "[ . 1 . 2 .]" 1
628 1 17 PHE HA 1 31 THR H 2.780 . 3.760 3.776 3.726 3.809 0.049 14 0 "[ . 1 . 2 .]" 1
629 1 17 PHE HA 1 31 THR MG 3.960 . 6.120 4.476 4.275 4.725 . 0 0 "[ . 1 . 2 .]" 1
630 1 17 PHE HB2 1 25 LEU MD1 3.250 . 4.700 3.454 3.394 3.522 . 0 0 "[ . 1 . 2 .]" 1
631 1 17 PHE HB2 1 25 LEU MD2 3.515 . 5.230 1.849 1.827 1.868 . 0 0 "[ . 1 . 2 .]" 1
632 1 17 PHE HB2 1 25 LEU HG 3.480 . 5.160 3.773 3.687 3.839 . 0 0 "[ . 1 . 2 .]" 1
633 1 17 PHE HB2 1 26 LEU H 3.650 . 5.500 4.412 4.138 4.653 . 0 0 "[ . 1 . 2 .]" 1
634 1 17 PHE HB3 1 25 LEU QB 4.090 . 6.380 4.703 4.632 4.751 . 0 0 "[ . 1 . 2 .]" 1
635 1 17 PHE HB3 1 25 LEU MD1 3.515 . 5.230 4.136 4.068 4.208 . 0 0 "[ . 1 . 2 .]" 1
636 1 17 PHE HB3 1 25 LEU MD2 3.235 . 4.670 1.933 1.904 1.950 . 0 0 "[ . 1 . 2 .]" 1
637 1 17 PHE HB3 1 25 LEU HG 3.045 . 4.290 4.293 4.221 4.324 0.034 9 0 "[ . 1 . 2 .]" 1
638 1 17 PHE HB3 1 26 LEU H 3.310 . 4.820 3.329 3.100 3.550 . 0 0 "[ . 1 . 2 .]" 1
639 1 17 PHE HB3 1 30 GLY H 3.650 . 5.500 4.999 4.911 5.109 . 0 0 "[ . 1 . 2 .]" 1
640 1 17 PHE QD 1 25 LEU QB 5.150 . 8.500 4.725 4.514 4.916 . 0 0 "[ . 1 . 2 .]" 1
641 1 17 PHE QD 1 25 LEU MD1 4.325 . 6.850 2.862 2.752 3.022 . 0 0 "[ . 1 . 2 .]" 1
642 1 17 PHE QD 1 25 LEU MD2 4.125 . 6.450 1.996 1.931 2.098 . 0 0 "[ . 1 . 2 .]" 1
643 1 17 PHE QD 1 25 LEU HG 4.680 . 7.560 4.512 4.431 4.598 . 0 0 "[ . 1 . 2 .]" 1
644 1 17 PHE QD 1 27 LYS HA 3.580 . 5.360 2.771 2.668 2.925 . 0 0 "[ . 1 . 2 .]" 1
645 1 17 PHE QD 1 27 LYS QB 5.219 . 8.524 3.754 3.532 3.997 . 0 0 "[ . 1 . 2 .]" 1
646 1 17 PHE QD 1 27 LYS QD 4.775 . 7.750 3.889 3.355 4.720 . 0 0 "[ . 1 . 2 .]" 1
647 1 17 PHE QD 1 27 LYS QE 4.730 . 7.660 2.942 2.246 3.511 . 0 0 "[ . 1 . 2 .]" 1
648 1 17 PHE QD 1 27 LYS HG2 4.710 . 7.620 2.763 2.197 3.339 . 0 0 "[ . 1 . 2 .]" 1
649 1 17 PHE QD 1 27 LYS QG 4.425 . 7.050 2.734 2.186 3.287 . 0 0 "[ . 1 . 2 .]" 1
650 1 17 PHE QD 1 27 LYS HG3 4.710 . 7.620 4.415 3.923 4.908 . 0 0 "[ . 1 . 2 .]" 1
651 1 17 PHE QD 1 28 GLN H 4.710 . 7.620 5.369 5.122 5.626 . 0 0 "[ . 1 . 2 .]" 1
652 1 17 PHE QD 1 30 GLY H 4.200 . 6.600 3.390 3.020 3.754 . 0 0 "[ . 1 . 2 .]" 1
653 1 17 PHE QD 1 30 GLY HA2 3.920 . 6.040 2.700 2.505 2.882 . 0 0 "[ . 1 . 2 .]" 1
654 1 17 PHE QD 1 30 GLY HA3 4.060 . 6.320 1.941 1.914 1.968 . 0 0 "[ . 1 . 2 .]" 1
655 1 17 PHE QD 1 31 THR H 4.275 . 6.750 3.845 3.523 4.096 . 0 0 "[ . 1 . 2 .]" 1
656 1 17 PHE QE 1 25 LEU MD1 5.225 . 8.650 4.422 4.320 4.526 . 0 0 "[ . 1 . 2 .]" 1
657 1 17 PHE QE 1 25 LEU MD2 4.915 . 8.144 4.016 3.980 4.061 . 0 0 "[ . 1 . 2 .]" 1
658 1 17 PHE QE 1 27 LYS HA 4.215 . 6.630 3.500 3.378 3.700 . 0 0 "[ . 1 . 2 .]" 1
659 1 17 PHE QE 1 27 LYS QB 4.810 . 7.820 3.267 2.969 3.527 . 0 0 "[ . 1 . 2 .]" 1
660 1 17 PHE QE 1 27 LYS QD 4.965 . 8.130 2.952 2.076 4.290 . 0 0 "[ . 1 . 2 .]" 1
661 1 17 PHE QE 1 27 LYS QE 4.760 . 7.720 2.777 1.930 3.800 . 0 0 "[ . 1 . 2 .]" 1
662 1 17 PHE QE 1 27 LYS HG2 4.710 . 7.620 3.491 3.065 4.063 . 0 0 "[ . 1 . 2 .]" 1
663 1 17 PHE QE 1 27 LYS QG 4.505 . 7.210 3.413 3.024 3.929 . 0 0 "[ . 1 . 2 .]" 1
664 1 17 PHE QE 1 27 LYS HG3 4.710 . 7.620 4.838 4.413 5.282 . 0 0 "[ . 1 . 2 .]" 1
665 1 17 PHE QE 1 30 GLY HA2 4.245 . 6.690 4.602 4.418 4.813 . 0 0 "[ . 1 . 2 .]" 1
666 1 17 PHE QE 1 30 GLY HA3 4.710 . 7.620 3.086 2.947 3.249 . 0 0 "[ . 1 . 2 .]" 1
667 1 17 PHE QE 1 31 THR H 4.710 . 7.620 5.069 4.747 5.267 . 0 0 "[ . 1 . 2 .]" 1
668 1 18 PRO HA 1 19 LEU H 2.335 . 2.870 2.112 2.104 2.122 . 0 0 "[ . 1 . 2 .]" 1
669 1 18 PRO HA 1 20 LEU MD2 4.165 . 6.530 4.883 4.791 4.953 . 0 0 "[ . 1 . 2 .]" 1
670 1 18 PRO QB 1 19 LEU H 2.885 . 3.970 3.370 3.324 3.414 . 0 0 "[ . 1 . 2 .]" 1
671 1 18 PRO QB 1 20 LEU MD2 3.800 . 5.800 3.208 3.050 3.330 . 0 0 "[ . 1 . 2 .]" 1
672 1 18 PRO QB 1 26 LEU H 4.090 . 6.380 4.120 3.724 4.430 . 0 0 "[ . 1 . 2 .]" 1
673 1 18 PRO QB 1 26 LEU QD 4.770 . 7.740 2.915 1.979 3.673 . 0 0 "[ . 1 . 2 .]" 1
674 1 18 PRO HB2 1 19 LEU H 3.015 . 4.230 3.797 3.646 4.012 . 0 0 "[ . 1 . 2 .]" 1
675 1 18 PRO HB3 1 19 LEU H 3.015 . 4.230 3.807 3.578 4.007 . 0 0 "[ . 1 . 2 .]" 1
676 1 18 PRO QD 1 25 LEU MD2 3.815 . 5.830 3.905 3.765 4.164 . 0 0 "[ . 1 . 2 .]" 1
677 1 18 PRO QD 1 26 LEU H 3.375 . 4.950 3.769 3.335 4.068 . 0 0 "[ . 1 . 2 .]" 1
678 1 18 PRO QD 1 26 LEU QD 5.065 . 8.330 3.883 3.196 4.450 . 0 0 "[ . 1 . 2 .]" 1
679 1 18 PRO QD 1 29 GLU H 4.090 . 6.380 3.411 3.275 3.648 . 0 0 "[ . 1 . 2 .]" 1
680 1 18 PRO QD 1 29 GLU QB 3.920 . 6.040 2.531 2.186 2.845 . 0 0 "[ . 1 . 2 .]" 1
681 1 18 PRO QD 1 29 GLU QG 4.530 . 7.260 4.134 3.784 4.526 . 0 0 "[ . 1 . 2 .]" 1
682 1 18 PRO QD 1 30 GLY H 3.050 . 4.300 3.354 3.219 3.512 . 0 0 "[ . 1 . 2 .]" 1
683 1 18 PRO QD 1 30 GLY HA2 3.750 . 5.700 1.919 1.880 1.976 . 0 0 "[ . 1 . 2 .]" 1
684 1 18 PRO QD 1 30 GLY HA3 3.500 . 5.200 3.298 3.173 3.413 . 0 0 "[ . 1 . 2 .]" 1
685 1 18 PRO QD 1 31 THR H 4.090 . 6.380 3.623 3.253 3.838 . 0 0 "[ . 1 . 2 .]" 1
686 1 18 PRO HD2 1 26 LEU H 3.650 . 5.500 3.860 3.391 4.187 . 0 0 "[ . 1 . 2 .]" 1
687 1 18 PRO HD2 1 30 GLY H 3.310 . 4.820 3.699 3.361 4.202 . 0 0 "[ . 1 . 2 .]" 1
688 1 18 PRO HD3 1 26 LEU H 3.650 . 5.500 5.290 4.906 5.539 0.039 24 0 "[ . 1 . 2 .]" 1
689 1 18 PRO HD3 1 30 GLY H 3.310 . 4.820 3.977 3.625 4.299 . 0 0 "[ . 1 . 2 .]" 1
690 1 18 PRO QG 1 26 LEU QD 4.630 . 7.460 3.064 2.399 4.186 . 0 0 "[ . 1 . 2 .]" 1
691 1 18 PRO QG 1 29 GLU QG 4.530 . 7.260 3.442 3.278 3.939 . 0 0 "[ . 1 . 2 .]" 1
692 1 18 PRO O 1 26 LEU H 1.950 . 2.200 2.153 1.980 2.223 0.023 2 0 "[ . 1 . 2 .]" 1
693 1 18 PRO O 1 26 LEU N 2.950 2.700 3.200 3.084 2.884 3.195 . 0 0 "[ . 1 . 2 .]" 1
694 1 19 LEU H 1 19 LEU MD1 3.730 . 5.660 4.236 4.166 4.301 . 0 0 "[ . 1 . 2 .]" 1
695 1 19 LEU H 1 19 LEU QD 3.525 . 5.250 3.788 3.733 3.828 . 0 0 "[ . 1 . 2 .]" 1
696 1 19 LEU H 1 19 LEU MD2 3.730 . 5.660 4.269 4.215 4.294 . 0 0 "[ . 1 . 2 .]" 1
697 1 19 LEU H 1 25 LEU HA 3.385 . 4.970 5.049 5.019 5.071 0.101 4 0 "[ . 1 . 2 .]" 1
698 1 19 LEU H 1 25 LEU MD2 4.165 . 6.530 4.818 4.795 4.873 . 0 0 "[ . 1 . 2 .]" 1
699 1 19 LEU H 1 26 LEU H 3.510 . 5.220 5.075 4.937 5.207 . 0 0 "[ . 1 . 2 .]" 1
700 1 19 LEU HA 1 19 LEU MD1 3.205 . 4.610 3.772 3.768 3.776 . 0 0 "[ . 1 . 2 .]" 1
701 1 19 LEU HA 1 19 LEU QD 2.775 . 3.750 2.119 2.012 2.196 . 0 0 "[ . 1 . 2 .]" 1
702 1 19 LEU HA 1 19 LEU MD2 3.205 . 4.610 2.130 2.020 2.210 . 0 0 "[ . 1 . 2 .]" 1
703 1 19 LEU HA 1 19 LEU HG 2.490 . 3.180 2.588 2.568 2.612 . 0 0 "[ . 1 . 2 .]" 1
704 1 19 LEU HA 1 20 LEU H 2.315 . 2.830 2.138 2.130 2.148 . 0 0 "[ . 1 . 2 .]" 1
705 1 19 LEU HA 1 20 LEU MD2 3.310 . 4.820 3.818 3.775 3.897 . 0 0 "[ . 1 . 2 .]" 1
706 1 19 LEU HA 1 24 ARG H 3.575 . 5.350 4.958 4.831 5.050 . 0 0 "[ . 1 . 2 .]" 1
707 1 19 LEU HA 1 25 LEU H 3.280 . 4.760 4.738 4.703 4.766 0.006 24 0 "[ . 1 . 2 .]" 1
708 1 19 LEU HA 1 25 LEU HA 2.380 . 2.960 2.616 2.553 2.660 . 0 0 "[ . 1 . 2 .]" 1
709 1 19 LEU HA 1 25 LEU QB 4.090 . 6.380 4.462 4.385 4.513 . 0 0 "[ . 1 . 2 .]" 1
710 1 19 LEU HA 1 25 LEU MD2 3.340 . 4.880 3.834 3.814 3.851 . 0 0 "[ . 1 . 2 .]" 1
711 1 19 LEU HA 1 25 LEU HG 2.985 . 4.170 3.834 3.747 3.905 . 0 0 "[ . 1 . 2 .]" 1
712 1 19 LEU HA 1 26 LEU H 2.720 . 3.640 3.543 3.434 3.648 0.008 22 0 "[ . 1 . 2 .]" 1
713 1 19 LEU HA 1 26 LEU QD 4.950 . 8.100 4.245 3.305 4.977 . 0 0 "[ . 1 . 2 .]" 1
714 1 19 LEU HA 1 54 THR MG 3.855 . 5.910 3.848 3.804 3.901 . 0 0 "[ . 1 . 2 .]" 1
715 1 19 LEU QB 1 20 LEU H 3.470 . 5.140 3.518 3.498 3.541 . 0 0 "[ . 1 . 2 .]" 1
716 1 19 LEU QB 1 25 LEU HA 4.090 . 6.380 4.338 4.272 4.394 . 0 0 "[ . 1 . 2 .]" 1
717 1 19 LEU QB 1 25 LEU MD2 4.340 . 6.880 4.364 4.313 4.436 . 0 0 "[ . 1 . 2 .]" 1
718 1 19 LEU QB 1 41 LEU MD1 4.295 . 6.790 3.695 3.673 3.727 . 0 0 "[ . 1 . 2 .]" 1
719 1 19 LEU QB 1 50 ILE MG 4.045 . 6.290 3.864 3.838 3.887 . 0 0 "[ . 1 . 2 .]" 1
720 1 19 LEU QB 1 54 THR MG 3.300 . 4.800 1.848 1.832 1.921 . 0 0 "[ . 1 . 2 .]" 1
721 1 19 LEU QD 1 20 LEU H 3.505 . 5.210 2.469 2.249 2.555 . 0 0 "[ . 1 . 2 .]" 1
722 1 19 LEU QD 1 20 LEU MD2 5.465 . 9.130 4.450 4.397 4.489 . 0 0 "[ . 1 . 2 .]" 1
723 1 19 LEU QD 1 23 GLY H 4.405 . 7.010 3.246 3.166 3.402 . 0 0 "[ . 1 . 2 .]" 1
724 1 19 LEU QD 1 23 GLY HA2 3.785 . 5.770 1.935 1.875 2.001 . 0 0 "[ . 1 . 2 .]" 1
725 1 19 LEU QD 1 23 GLY HA3 3.600 . 5.400 3.112 3.016 3.182 . 0 0 "[ . 1 . 2 .]" 1
726 1 19 LEU QD 1 24 ARG H 4.125 . 6.450 3.395 3.306 3.478 . 0 0 "[ . 1 . 2 .]" 1
727 1 19 LEU QD 1 24 ARG HA 4.280 . 6.760 3.898 3.813 3.996 . 0 0 "[ . 1 . 2 .]" 1
728 1 19 LEU QD 1 25 LEU H 4.125 . 6.450 3.136 3.014 3.269 . 0 0 "[ . 1 . 2 .]" 1
729 1 19 LEU QD 1 25 LEU HA 3.400 . 5.000 2.430 2.264 2.722 . 0 0 "[ . 1 . 2 .]" 1
730 1 19 LEU QD 1 25 LEU QB 3.875 . 5.950 2.754 2.461 2.973 . 0 0 "[ . 1 . 2 .]" 1
731 1 19 LEU QD 1 25 LEU MD1 3.935 . 6.070 3.145 2.995 3.280 . 0 0 "[ . 1 . 2 .]" 1
732 1 19 LEU QD 1 25 LEU MD2 4.950 . 8.100 3.503 3.418 3.619 . 0 0 "[ . 1 . 2 .]" 1
733 1 19 LEU QD 1 25 LEU HG 3.165 . 4.530 2.638 2.475 2.801 . 0 0 "[ . 1 . 2 .]" 1
734 1 19 LEU QD 1 26 LEU H 4.145 . 6.490 4.121 3.996 4.324 . 0 0 "[ . 1 . 2 .]" 1
735 1 19 LEU QD 1 41 LEU MD1 3.745 . 5.690 1.715 1.709 1.729 0.091 22 0 "[ . 1 . 2 .]" 1
736 1 19 LEU QD 1 41 LEU MD2 5.200 . 8.600 3.553 3.536 3.581 . 0 0 "[ . 1 . 2 .]" 1
737 1 19 LEU QD 1 50 ILE MD 5.465 . 9.130 3.432 3.342 3.491 . 0 0 "[ . 1 . 2 .]" 1
738 1 19 LEU QD 1 50 ILE QG 4.380 . 6.960 3.241 3.136 3.344 . 0 0 "[ . 1 . 2 .]" 1
739 1 19 LEU QD 1 51 ALA MB 5.465 . 9.130 4.002 3.934 4.052 . 0 0 "[ . 1 . 2 .]" 1
740 1 19 LEU QD 1 53 MET ME 5.465 . 9.130 4.284 4.214 4.387 . 0 0 "[ . 1 . 2 .]" 1
741 1 19 LEU QD 1 54 THR HA 4.390 . 6.980 3.859 3.799 3.927 . 0 0 "[ . 1 . 2 .]" 1
742 1 19 LEU QD 1 54 THR HB 4.175 . 6.550 3.130 3.019 3.248 . 0 0 "[ . 1 . 2 .]" 1
743 1 19 LEU QD 1 54 THR MG 3.595 . 5.390 1.773 1.720 1.813 0.080 10 0 "[ . 1 . 2 .]" 1
744 1 19 LEU QD 1 57 LEU MD2 5.385 . 8.970 4.099 3.945 4.170 . 0 0 "[ . 1 . 2 .]" 1
745 1 19 LEU MD1 1 25 LEU QB 4.355 . 6.910 4.175 4.105 4.261 . 0 0 "[ . 1 . 2 .]" 1
746 1 19 LEU MD1 1 25 LEU MD1 4.385 . 6.970 3.447 3.264 3.587 . 0 0 "[ . 1 . 2 .]" 1
747 1 19 LEU MD1 1 25 LEU HG 3.495 . 5.190 3.131 3.062 3.220 . 0 0 "[ . 1 . 2 .]" 1
748 1 19 LEU MD1 1 41 LEU MD1 4.180 . 6.560 1.718 1.713 1.732 0.087 22 0 "[ . 1 . 2 .]" 1
749 1 19 LEU MD1 1 50 ILE MG 3.575 . 5.350 1.662 1.653 1.669 0.147 24 0 "[ . 1 . 2 .]" 1
750 1 19 LEU MD1 1 54 THR MG 3.965 . 6.130 1.884 1.869 1.903 . 0 0 "[ . 1 . 2 .]" 1
751 1 19 LEU MD2 1 25 LEU QB 4.355 . 6.910 2.796 2.480 3.036 . 0 0 "[ . 1 . 2 .]" 1
752 1 19 LEU MD2 1 25 LEU MD1 4.385 . 6.970 3.632 3.409 3.796 . 0 0 "[ . 1 . 2 .]" 1
753 1 19 LEU MD2 1 25 LEU HG 3.495 . 5.190 2.843 2.606 3.078 . 0 0 "[ . 1 . 2 .]" 1
754 1 19 LEU MD2 1 41 LEU MD1 4.180 . 6.560 3.587 3.543 3.648 . 0 0 "[ . 1 . 2 .]" 1
755 1 19 LEU MD2 1 50 ILE MG 3.575 . 5.350 1.962 1.880 2.156 . 0 0 "[ . 1 . 2 .]" 1
756 1 19 LEU MD2 1 54 THR MG 3.965 . 6.130 2.170 2.010 2.327 . 0 0 "[ . 1 . 2 .]" 1
757 1 19 LEU HG 1 25 LEU HA 3.185 . 4.570 2.997 2.909 3.080 . 0 0 "[ . 1 . 2 .]" 1
758 1 19 LEU HG 1 25 LEU MD1 3.220 . 4.640 3.572 3.466 3.651 . 0 0 "[ . 1 . 2 .]" 1
759 1 19 LEU HG 1 25 LEU MD2 3.515 . 5.230 3.195 3.118 3.277 . 0 0 "[ . 1 . 2 .]" 1
760 1 19 LEU HG 1 50 ILE MD 4.165 . 6.530 4.722 4.682 4.761 . 0 0 "[ . 1 . 2 .]" 1
761 1 19 LEU HG 1 50 ILE MG 3.915 . 6.144 2.996 2.921 3.059 . 0 0 "[ . 1 . 2 .]" 1
762 1 20 LEU H 1 20 LEU MD2 3.080 . 4.360 2.936 2.889 2.985 . 0 0 "[ . 1 . 2 .]" 1
763 1 20 LEU H 1 23 GLY H 3.015 . 4.230 4.059 3.999 4.124 . 0 0 "[ . 1 . 2 .]" 1
764 1 20 LEU H 1 24 ARG H 2.705 . 3.610 3.266 3.134 3.375 . 0 0 "[ . 1 . 2 .]" 1
765 1 20 LEU H 1 24 ARG O 1.950 . 2.200 2.231 2.215 2.245 0.045 21 0 "[ . 1 . 2 .]" 1
766 1 20 LEU H 1 25 LEU HA 2.800 . 3.800 3.765 3.698 3.811 0.011 12 0 "[ . 1 . 2 .]" 1
767 1 20 LEU H 1 26 LEU H 3.465 . 5.130 4.716 4.514 4.863 . 0 0 "[ . 1 . 2 .]" 1
768 1 20 LEU HA 1 20 LEU MD1 3.280 . 4.760 3.821 3.808 3.831 . 0 0 "[ . 1 . 2 .]" 1
769 1 20 LEU HA 1 20 LEU MD2 2.615 . 3.430 2.105 2.003 2.179 . 0 0 "[ . 1 . 2 .]" 1
770 1 20 LEU HA 1 21 GLU H 2.365 . 2.930 2.424 2.406 2.449 . 0 0 "[ . 1 . 2 .]" 1
771 1 20 LEU HA 1 22 ASN H 3.030 . 4.260 4.228 4.196 4.259 . 0 0 "[ . 1 . 2 .]" 1
772 1 20 LEU HA 1 23 GLY H 3.295 . 4.790 4.711 4.676 4.743 . 0 0 "[ . 1 . 2 .]" 1
773 1 20 LEU HA 1 24 ARG H 3.355 . 4.910 4.849 4.726 4.933 0.023 19 0 "[ . 1 . 2 .]" 1
774 1 20 LEU HB2 1 20 LEU MD1 2.615 . 3.430 2.351 2.341 2.365 . 0 0 "[ . 1 . 2 .]" 1
775 1 20 LEU HB2 1 21 GLU H 2.720 . 3.640 3.396 3.331 3.443 . 0 0 "[ . 1 . 2 .]" 1
776 1 20 LEU HB2 1 22 ASN H 2.425 . 3.050 2.813 2.774 2.849 . 0 0 "[ . 1 . 2 .]" 1
777 1 20 LEU HB2 1 23 GLY H 2.765 . 3.730 3.523 3.462 3.563 . 0 0 "[ . 1 . 2 .]" 1
778 1 20 LEU HB2 1 24 ARG H 2.610 . 3.420 2.298 2.202 2.389 . 0 0 "[ . 1 . 2 .]" 1
779 1 20 LEU HB2 1 24 ARG HB2 3.030 . 4.260 2.542 1.994 3.198 . 0 0 "[ . 1 . 2 .]" 1
780 1 20 LEU HB2 1 24 ARG QB 2.935 . 4.070 1.985 1.956 2.110 . 0 0 "[ . 1 . 2 .]" 1
781 1 20 LEU HB2 1 24 ARG HB3 3.030 . 4.260 2.454 1.987 2.884 . 0 0 "[ . 1 . 2 .]" 1
782 1 20 LEU HB2 1 24 ARG QD 4.090 . 6.380 4.906 4.756 5.185 . 0 0 "[ . 1 . 2 .]" 1
783 1 20 LEU HB3 1 20 LEU MD1 2.705 . 3.610 2.326 2.313 2.347 . 0 0 "[ . 1 . 2 .]" 1
784 1 20 LEU HB3 1 21 GLU H 2.470 . 3.140 2.400 2.363 2.429 . 0 0 "[ . 1 . 2 .]" 1
785 1 20 LEU HB3 1 22 ASN H 2.425 . 3.050 3.005 2.973 3.048 . 0 0 "[ . 1 . 2 .]" 1
786 1 20 LEU HB3 1 23 GLY H 3.170 . 4.540 4.566 4.552 4.575 0.035 17 0 "[ . 1 . 2 .]" 1
787 1 20 LEU HB3 1 24 ARG QB 4.090 . 6.380 3.235 3.194 3.290 . 0 0 "[ . 1 . 2 .]" 1
788 1 20 LEU MD1 1 21 GLU QG 4.510 . 7.220 4.353 4.321 4.382 . 0 0 "[ . 1 . 2 .]" 1
789 1 20 LEU MD1 1 22 ASN H 3.515 . 5.230 4.150 4.109 4.181 . 0 0 "[ . 1 . 2 .]" 1
790 1 20 LEU MD1 1 24 ARG H 3.310 . 4.820 3.768 3.696 3.837 . 0 0 "[ . 1 . 2 .]" 1
791 1 20 LEU MD1 1 24 ARG HA 3.870 . 5.940 4.356 4.265 4.461 . 0 0 "[ . 1 . 2 .]" 1
792 1 20 LEU MD1 1 24 ARG HB2 2.875 . 3.950 2.470 2.092 2.902 . 0 0 "[ . 1 . 2 .]" 1
793 1 20 LEU MD1 1 24 ARG QB 2.765 . 3.730 1.888 1.815 1.979 . 0 0 "[ . 1 . 2 .]" 1
794 1 20 LEU MD1 1 24 ARG HB3 2.875 . 3.950 1.992 1.945 2.015 . 0 0 "[ . 1 . 2 .]" 1
795 1 20 LEU MD1 1 24 ARG QD 4.600 . 7.400 3.590 3.205 3.962 . 0 0 "[ . 1 . 2 .]" 1
796 1 20 LEU MD1 1 24 ARG HG2 3.125 . 4.450 3.046 2.347 3.606 . 0 0 "[ . 1 . 2 .]" 1
797 1 20 LEU MD1 1 24 ARG HG3 3.125 . 4.450 2.528 2.484 2.609 . 0 0 "[ . 1 . 2 .]" 1
798 1 20 LEU MD1 1 26 LEU QD 4.145 . 6.490 2.472 2.164 2.768 . 0 0 "[ . 1 . 2 .]" 1
799 1 20 LEU MD2 1 24 ARG H 4.214 . 6.514 4.895 4.798 4.981 . 0 0 "[ . 1 . 2 .]" 1
800 1 20 LEU MD2 1 24 ARG HB2 4.165 . 6.530 4.600 4.162 5.124 . 0 0 "[ . 1 . 2 .]" 1
801 1 20 LEU MD2 1 24 ARG QB 3.815 . 5.830 3.509 3.389 3.652 . 0 0 "[ . 1 . 2 .]" 1
802 1 20 LEU MD2 1 24 ARG HB3 4.165 . 6.530 3.656 3.587 3.739 . 0 0 "[ . 1 . 2 .]" 1
803 1 20 LEU MD2 1 24 ARG QG 4.605 . 7.410 4.396 3.934 4.742 . 0 0 "[ . 1 . 2 .]" 1
804 1 20 LEU MD2 1 26 LEU QD 5.185 . 8.570 2.553 2.086 2.831 . 0 0 "[ . 1 . 2 .]" 1
805 1 20 LEU MD2 1 26 LEU HG 3.235 . 4.670 3.643 3.395 3.792 . 0 0 "[ . 1 . 2 .]" 1
806 1 20 LEU MD2 1 29 GLU QG 4.600 . 7.400 5.271 5.198 5.362 . 0 0 "[ . 1 . 2 .]" 1
807 1 20 LEU HG 1 26 LEU H 3.650 . 5.500 4.746 4.507 4.997 . 0 0 "[ . 1 . 2 .]" 1
808 1 20 LEU N 1 24 ARG O 2.950 2.700 3.200 3.161 3.142 3.181 . 0 0 "[ . 1 . 2 .]" 1
809 1 20 LEU O 1 23 GLY H 1.950 . 2.200 1.853 1.815 1.898 . 0 0 "[ . 1 . 2 .]" 1
810 1 20 LEU O 1 23 GLY N 2.950 2.700 3.200 2.734 2.702 2.790 . 0 0 "[ . 1 . 2 .]" 1
811 1 21 GLU H 1 22 ASN H 2.410 . 3.020 2.739 2.720 2.761 . 0 0 "[ . 1 . 2 .]" 1
812 1 21 GLU H 1 23 GLY H 3.155 . 4.510 4.189 4.168 4.206 . 0 0 "[ . 1 . 2 .]" 1
813 1 21 GLU HA 1 21 GLU HG2 2.830 . 3.860 3.724 3.702 3.731 . 0 0 "[ . 1 . 2 .]" 1
814 1 21 GLU HA 1 21 GLU QG 2.675 . 3.550 3.312 3.307 3.319 . 0 0 "[ . 1 . 2 .]" 1
815 1 21 GLU HA 1 21 GLU HG3 2.830 . 3.860 3.711 3.697 3.752 . 0 0 "[ . 1 . 2 .]" 1
816 1 21 GLU HA 1 22 ASN H 2.675 . 3.550 3.485 3.481 3.495 . 0 0 "[ . 1 . 2 .]" 1
817 1 21 GLU HA 1 23 GLY H 2.905 . 4.124 3.583 3.570 3.601 . 0 0 "[ . 1 . 2 .]" 1
818 1 21 GLU HA 1 54 THR HB 3.230 . 4.660 3.625 3.518 3.793 . 0 0 "[ . 1 . 2 .]" 1
819 1 21 GLU HA 1 54 THR MG 3.050 . 4.300 3.457 3.444 3.476 . 0 0 "[ . 1 . 2 .]" 1
820 1 21 GLU HA 1 58 ALA HA 3.224 . 4.534 4.142 3.958 4.342 . 0 0 "[ . 1 . 2 .]" 1
821 1 21 GLU HA 1 58 ALA MB 2.875 . 3.950 2.433 2.219 2.697 . 0 0 "[ . 1 . 2 .]" 1
822 1 21 GLU HB2 1 22 ASN H 2.750 . 3.700 3.739 3.719 3.764 0.064 23 0 "[ . 1 . 2 .]" 1
823 1 21 GLU HB2 1 58 ALA HA 3.155 . 4.510 3.957 3.739 4.228 . 0 0 "[ . 1 . 2 .]" 1
824 1 21 GLU HB2 1 58 ALA MB 2.720 . 3.640 2.006 1.887 2.111 . 0 0 "[ . 1 . 2 .]" 1
825 1 21 GLU HB3 1 22 ASN H 2.970 . 4.140 4.141 4.113 4.151 0.011 17 0 "[ . 1 . 2 .]" 1
826 1 21 GLU HB3 1 58 ALA MB 2.815 . 3.830 2.625 2.435 2.782 . 0 0 "[ . 1 . 2 .]" 1
827 1 21 GLU QG 1 22 ASN H 3.205 . 4.610 2.207 2.176 2.270 . 0 0 "[ . 1 . 2 .]" 1
828 1 21 GLU QG 1 22 ASN HB3 2.850 . 3.900 3.071 3.048 3.116 . 0 0 "[ . 1 . 2 .]" 1
829 1 22 ASN H 1 22 ASN HD21 3.650 . 5.500 4.232 1.987 4.601 . 0 0 "[ . 1 . 2 .]" 1
830 1 22 ASN H 1 22 ASN HD22 3.650 . 5.500 4.259 3.165 4.462 . 0 0 "[ . 1 . 2 .]" 1
831 1 22 ASN H 1 23 GLY H 2.505 . 3.210 2.669 2.652 2.680 . 0 0 "[ . 1 . 2 .]" 1
832 1 22 ASN H 1 23 GLY HA2 3.385 . 4.970 4.885 4.864 4.897 . 0 0 "[ . 1 . 2 .]" 1
833 1 22 ASN H 1 23 GLY HA3 3.450 . 5.100 5.157 5.150 5.164 0.064 24 0 "[ . 1 . 2 .]" 1
834 1 22 ASN HA 1 22 ASN HB2 2.225 . 2.650 2.449 2.412 2.509 . 0 0 "[ . 1 . 2 .]" 1
835 1 22 ASN HA 1 22 ASN HB3 2.285 . 2.770 2.455 2.400 2.496 . 0 0 "[ . 1 . 2 .]" 1
836 1 22 ASN HA 1 23 GLY H 2.565 . 3.330 3.134 3.124 3.163 . 0 0 "[ . 1 . 2 .]" 1
837 1 22 ASN HA 1 24 ARG H 3.155 . 4.510 4.396 4.363 4.429 . 0 0 "[ . 1 . 2 .]" 1
838 1 22 ASN HB2 1 23 GLY H 3.230 . 4.660 4.455 4.384 4.490 . 0 0 "[ . 1 . 2 .]" 1
839 1 22 ASN HB3 1 23 GLY H 3.185 . 4.570 4.533 4.494 4.568 . 0 0 "[ . 1 . 2 .]" 1
840 1 22 ASN QD 1 24 ARG H 3.975 . 6.150 3.422 3.118 3.821 . 0 0 "[ . 1 . 2 .]" 1
841 1 22 ASN QD 1 24 ARG QD 4.525 . 7.250 4.066 3.674 4.657 . 0 0 "[ . 1 . 2 .]" 1
842 1 23 GLY H 1 24 ARG H 2.505 . 3.210 2.622 2.583 2.663 . 0 0 "[ . 1 . 2 .]" 1
843 1 23 GLY H 1 24 ARG QB 3.825 . 5.850 4.330 4.252 4.415 . 0 0 "[ . 1 . 2 .]" 1
844 1 23 GLY H 1 51 ALA MB 4.165 . 6.530 4.567 4.423 4.747 . 0 0 "[ . 1 . 2 .]" 1
845 1 23 GLY H 1 54 THR HB 2.690 . 3.580 2.767 2.714 2.809 . 0 0 "[ . 1 . 2 .]" 1
846 1 23 GLY H 1 54 THR MG 3.125 . 4.450 3.245 3.218 3.261 . 0 0 "[ . 1 . 2 .]" 1
847 1 23 GLY HA2 1 24 ARG H 2.720 . 3.640 3.257 3.209 3.282 . 0 0 "[ . 1 . 2 .]" 1
848 1 23 GLY HA2 1 50 ILE MG 3.635 . 5.470 3.400 3.345 3.448 . 0 0 "[ . 1 . 2 .]" 1
849 1 23 GLY HA2 1 51 ALA MB 3.495 . 5.190 3.665 3.531 3.779 . 0 0 "[ . 1 . 2 .]" 1
850 1 23 GLY HA2 1 54 THR HB 3.590 . 5.380 2.738 2.641 2.826 . 0 0 "[ . 1 . 2 .]" 1
851 1 23 GLY HA2 1 54 THR MG 2.740 . 3.680 2.958 2.921 2.978 . 0 0 "[ . 1 . 2 .]" 1
852 1 23 GLY HA3 1 24 ARG H 2.610 . 3.420 3.356 3.335 3.391 . 0 0 "[ . 1 . 2 .]" 1
853 1 23 GLY HA3 1 50 ILE MG 3.340 . 4.880 3.870 3.811 3.917 . 0 0 "[ . 1 . 2 .]" 1
854 1 23 GLY HA3 1 51 ALA HA 3.170 . 4.540 1.961 1.941 1.985 . 0 0 "[ . 1 . 2 .]" 1
855 1 23 GLY HA3 1 51 ALA MB 3.360 . 4.920 2.306 2.138 2.469 . 0 0 "[ . 1 . 2 .]" 1
856 1 24 ARG H 1 24 ARG HA 2.335 . 2.870 2.800 2.787 2.807 . 0 0 "[ . 1 . 2 .]" 1
857 1 24 ARG H 1 24 ARG QD 4.090 . 6.380 4.244 4.082 4.525 . 0 0 "[ . 1 . 2 .]" 1
858 1 24 ARG H 1 25 LEU H 3.000 . 4.200 4.214 4.202 4.226 0.026 20 0 "[ . 1 . 2 .]" 1
859 1 24 ARG HA 1 24 ARG QD 2.940 . 4.080 2.048 1.945 2.713 . 0 0 "[ . 1 . 2 .]" 1
860 1 24 ARG HA 1 24 ARG HG2 2.720 . 3.640 3.048 2.506 3.706 0.066 17 0 "[ . 1 . 2 .]" 1
861 1 24 ARG HA 1 24 ARG QG 2.535 . 3.270 2.733 2.461 3.056 . 0 0 "[ . 1 . 2 .]" 1
862 1 24 ARG HA 1 24 ARG HG3 2.720 . 3.640 3.433 3.220 3.612 . 0 0 "[ . 1 . 2 .]" 1
863 1 24 ARG HA 1 25 LEU H 2.214 . 2.514 2.179 2.160 2.199 . 0 0 "[ . 1 . 2 .]" 1
864 1 24 ARG HA 1 25 LEU HA 3.650 . 5.500 4.437 4.429 4.448 . 0 0 "[ . 1 . 2 .]" 1
865 1 24 ARG HA 1 25 LEU QB 3.810 . 5.820 4.094 4.061 4.120 . 0 0 "[ . 1 . 2 .]" 1
866 1 24 ARG HA 1 26 LEU QD 4.715 . 7.630 4.253 3.743 4.844 . 0 0 "[ . 1 . 2 .]" 1
867 1 24 ARG HA 1 51 ALA MB 4.165 . 6.530 5.242 5.084 5.321 . 0 0 "[ . 1 . 2 .]" 1
868 1 24 ARG QB 1 24 ARG QD 2.725 . 3.650 2.449 2.310 2.859 . 0 0 "[ . 1 . 2 .]" 1
869 1 24 ARG QB 1 26 LEU QD 4.355 . 6.910 3.090 2.285 3.767 . 0 0 "[ . 1 . 2 .]" 1
870 1 24 ARG HB2 1 26 LEU MD1 5.455 . 9.110 5.530 5.103 6.099 . 0 0 "[ . 1 . 2 .]" 1
871 1 24 ARG HB2 1 26 LEU MD2 5.455 . 9.110 4.479 3.770 4.981 . 0 0 "[ . 1 . 2 .]" 1
872 1 24 ARG HB3 1 26 LEU MD1 5.455 . 9.110 4.292 3.705 4.937 . 0 0 "[ . 1 . 2 .]" 1
873 1 24 ARG HB3 1 26 LEU MD2 5.455 . 9.110 3.350 2.318 4.272 . 0 0 "[ . 1 . 2 .]" 1
874 1 24 ARG QD 1 25 LEU H 3.685 . 5.570 2.960 2.718 3.271 . 0 0 "[ . 1 . 2 .]" 1
875 1 24 ARG QD 1 25 LEU MD2 4.600 . 7.400 5.351 5.205 5.438 . 0 0 "[ . 1 . 2 .]" 1
876 1 24 ARG QD 1 26 LEU QD 4.365 . 6.930 2.498 2.065 3.309 . 0 0 "[ . 1 . 2 .]" 1
877 1 24 ARG QG 1 26 LEU QD 3.880 . 5.960 2.843 1.796 3.571 0.004 24 0 "[ . 1 . 2 .]" 1
878 1 24 ARG HG2 1 26 LEU MD1 4.710 . 7.620 5.174 3.763 6.274 . 0 0 "[ . 1 . 2 .]" 1
879 1 24 ARG HG2 1 26 LEU MD2 4.710 . 7.620 3.937 2.828 4.754 . 0 0 "[ . 1 . 2 .]" 1
880 1 24 ARG HG3 1 26 LEU MD1 4.710 . 7.620 4.207 2.972 5.111 . 0 0 "[ . 1 . 2 .]" 1
881 1 24 ARG HG3 1 26 LEU MD2 4.710 . 7.620 3.028 1.829 3.896 . 0 0 "[ . 1 . 2 .]" 1
882 1 25 LEU H 1 25 LEU MD1 3.635 . 5.470 4.253 4.224 4.293 . 0 0 "[ . 1 . 2 .]" 1
883 1 25 LEU H 1 25 LEU MD2 3.670 . 5.540 4.198 4.188 4.207 . 0 0 "[ . 1 . 2 .]" 1
884 1 25 LEU H 1 26 LEU H 3.170 . 4.540 4.449 4.372 4.544 0.004 6 0 "[ . 1 . 2 .]" 1
885 1 25 LEU HA 1 25 LEU MD1 3.220 . 4.640 3.786 3.779 3.798 . 0 0 "[ . 1 . 2 .]" 1
886 1 25 LEU HA 1 25 LEU MD2 2.720 . 3.640 2.427 2.398 2.459 . 0 0 "[ . 1 . 2 .]" 1
887 1 25 LEU HA 1 25 LEU HG 2.270 . 2.740 2.502 2.478 2.527 . 0 0 "[ . 1 . 2 .]" 1
888 1 25 LEU HA 1 26 LEU H 2.350 . 2.900 2.145 2.130 2.160 . 0 0 "[ . 1 . 2 .]" 1
889 1 25 LEU HA 1 26 LEU QD 4.405 . 7.010 3.773 2.946 4.297 . 0 0 "[ . 1 . 2 .]" 1
890 1 25 LEU HA 1 27 LYS H 3.540 . 5.280 5.294 5.245 5.312 0.032 9 0 "[ . 1 . 2 .]" 1
891 1 25 LEU QB 1 27 LYS QE 4.525 . 7.250 3.852 3.327 4.684 . 0 0 "[ . 1 . 2 .]" 1
892 1 25 LEU QB 1 27 LYS QG 4.265 . 6.730 3.503 3.304 3.679 . 0 0 "[ . 1 . 2 .]" 1
893 1 25 LEU QB 1 50 ILE MD 4.355 . 6.910 3.591 3.537 3.652 . 0 0 "[ . 1 . 2 .]" 1
894 1 25 LEU MD1 1 27 LYS H 4.165 . 6.530 5.086 4.870 5.183 . 0 0 "[ . 1 . 2 .]" 1
895 1 25 LEU MD1 1 27 LYS HA 4.165 . 6.530 5.002 4.808 5.182 . 0 0 "[ . 1 . 2 .]" 1
896 1 25 LEU MD1 1 27 LYS QD 4.305 . 6.810 4.350 4.005 4.650 . 0 0 "[ . 1 . 2 .]" 1
897 1 25 LEU MD1 1 27 LYS QE 3.685 . 5.570 2.707 2.335 3.363 . 0 0 "[ . 1 . 2 .]" 1
898 1 25 LEU MD1 1 27 LYS QG 4.090 . 6.380 3.310 3.025 3.468 . 0 0 "[ . 1 . 2 .]" 1
899 1 25 LEU MD1 1 41 LEU MD1 4.680 . 7.560 4.073 3.954 4.191 . 0 0 "[ . 1 . 2 .]" 1
900 1 25 LEU MD1 1 50 ILE MD 3.855 . 5.910 1.932 1.859 2.059 . 0 0 "[ . 1 . 2 .]" 1
901 1 25 LEU MD1 1 50 ILE MG 4.120 . 6.440 2.413 2.193 2.623 . 0 0 "[ . 1 . 2 .]" 1
902 1 25 LEU MD2 1 26 LEU H 3.235 . 4.670 2.341 2.004 2.553 . 0 0 "[ . 1 . 2 .]" 1
903 1 25 LEU MD2 1 26 LEU QD 5.465 . 9.130 4.062 3.589 4.360 . 0 0 "[ . 1 . 2 .]" 1
904 1 25 LEU MD2 1 27 LYS H 3.280 . 4.760 3.134 2.986 3.218 . 0 0 "[ . 1 . 2 .]" 1
905 1 25 LEU MD2 1 27 LYS HA 3.140 . 4.480 3.162 3.083 3.225 . 0 0 "[ . 1 . 2 .]" 1
906 1 25 LEU MD2 1 27 LYS QB 3.980 . 6.160 3.999 3.943 4.062 . 0 0 "[ . 1 . 2 .]" 1
907 1 25 LEU MD2 1 27 LYS QD 3.810 . 5.820 4.144 3.983 4.264 . 0 0 "[ . 1 . 2 .]" 1
908 1 25 LEU MD2 1 27 LYS QE 3.410 . 5.020 3.169 2.751 3.647 . 0 0 "[ . 1 . 2 .]" 1
909 1 25 LEU MD2 1 27 LYS HG2 3.125 . 4.450 2.466 2.303 2.612 . 0 0 "[ . 1 . 2 .]" 1
910 1 25 LEU MD2 1 27 LYS QG 2.975 . 4.150 2.397 2.271 2.486 . 0 0 "[ . 1 . 2 .]" 1
911 1 25 LEU MD2 1 27 LYS HG3 3.125 . 4.450 3.305 2.981 3.461 . 0 0 "[ . 1 . 2 .]" 1
912 1 25 LEU MD2 1 28 GLN H 3.995 . 6.190 5.009 4.875 5.085 . 0 0 "[ . 1 . 2 .]" 1
913 1 25 LEU HG 1 50 ILE MD 3.495 . 5.190 3.791 3.695 3.860 . 0 0 "[ . 1 . 2 .]" 1
914 1 26 LEU H 1 26 LEU MD1 3.280 . 4.760 3.820 3.251 3.954 . 0 0 "[ . 1 . 2 .]" 1
915 1 26 LEU H 1 26 LEU QD 3.075 . 4.350 2.911 2.141 3.352 . 0 0 "[ . 1 . 2 .]" 1
916 1 26 LEU H 1 26 LEU MD2 3.280 . 4.760 3.129 2.150 3.934 . 0 0 "[ . 1 . 2 .]" 1
917 1 26 LEU H 1 27 LYS H 2.935 . 4.070 4.056 3.957 4.096 0.026 5 0 "[ . 1 . 2 .]" 1
918 1 26 LEU HA 1 26 LEU MD1 3.465 . 5.130 3.334 1.995 3.954 . 0 0 "[ . 1 . 2 .]" 1
919 1 26 LEU HA 1 26 LEU QD 2.935 . 4.070 2.133 1.938 2.500 . 0 0 "[ . 1 . 2 .]" 1
920 1 26 LEU HA 1 26 LEU MD2 3.465 . 5.130 2.336 1.973 2.677 . 0 0 "[ . 1 . 2 .]" 1
921 1 26 LEU HA 1 27 LYS QB 3.965 . 6.130 4.522 4.427 4.585 . 0 0 "[ . 1 . 2 .]" 1
922 1 26 LEU HB2 1 29 GLU QB 2.755 . 3.710 2.326 2.028 2.528 . 0 0 "[ . 1 . 2 .]" 1
923 1 26 LEU HB2 1 29 GLU QG 3.900 . 6.114 3.169 2.790 3.595 . 0 0 "[ . 1 . 2 .]" 1
924 1 26 LEU HB2 1 30 GLY H 3.555 . 5.310 5.257 5.030 5.357 0.047 25 0 "[ . 1 . 2 .]" 1
925 1 26 LEU HB3 1 28 GLN H 2.955 . 4.110 3.552 3.425 3.722 . 0 0 "[ . 1 . 2 .]" 1
926 1 26 LEU HB3 1 29 GLU HA 3.420 . 5.040 4.670 4.267 4.945 . 0 0 "[ . 1 . 2 .]" 1
927 1 26 LEU HB3 1 29 GLU HB2 3.310 . 4.820 2.492 1.991 2.897 . 0 0 "[ . 1 . 2 .]" 1
928 1 26 LEU HB3 1 29 GLU QB 3.085 . 4.370 2.467 1.980 2.853 . 0 0 "[ . 1 . 2 .]" 1
929 1 26 LEU HB3 1 29 GLU HB3 3.310 . 4.820 4.010 3.533 4.393 . 0 0 "[ . 1 . 2 .]" 1
930 1 26 LEU HB3 1 29 GLU QG 3.405 . 5.010 2.154 1.943 2.507 . 0 0 "[ . 1 . 2 .]" 1
931 1 26 LEU HB3 1 30 GLY H 3.590 . 5.380 5.141 4.678 5.399 0.019 2 0 "[ . 1 . 2 .]" 1
932 1 26 LEU QD 1 28 GLN H 4.590 . 7.380 4.109 3.748 4.387 . 0 0 "[ . 1 . 2 .]" 1
933 1 26 LEU QD 1 28 GLN QB 5.360 . 8.920 4.029 3.630 4.425 . 0 0 "[ . 1 . 2 .]" 1
934 1 26 LEU QD 1 28 GLN QE 4.615 . 7.430 4.161 3.700 4.497 . 0 0 "[ . 1 . 2 .]" 1
935 1 26 LEU QD 1 29 GLU QB 3.645 . 5.490 2.861 2.392 3.403 . 0 0 "[ . 1 . 2 .]" 1
936 1 26 LEU QD 1 29 GLU QG 3.660 . 5.520 2.201 1.930 2.644 . 0 0 "[ . 1 . 2 .]" 1
937 1 26 LEU MD1 1 28 GLN HE21 5.530 . 9.260 5.690 3.961 6.771 . 0 0 "[ . 1 . 2 .]" 1
938 1 26 LEU MD1 1 28 GLN HE22 5.530 . 9.260 6.307 4.628 7.475 . 0 0 "[ . 1 . 2 .]" 1
939 1 26 LEU MD1 1 29 GLU H 4.214 . 6.514 4.128 3.668 4.457 . 0 0 "[ . 1 . 2 .]" 1
940 1 26 LEU MD1 1 29 GLU HB2 4.635 . 7.470 3.055 2.490 3.759 . 0 0 "[ . 1 . 2 .]" 1
941 1 26 LEU MD1 1 29 GLU HB3 4.635 . 7.470 3.884 3.235 4.834 . 0 0 "[ . 1 . 2 .]" 1
942 1 26 LEU MD1 1 29 GLU QG 3.935 . 6.070 2.235 1.953 2.672 . 0 0 "[ . 1 . 2 .]" 1
943 1 26 LEU MD2 1 28 GLN HE21 5.530 . 9.260 5.214 4.085 6.926 . 0 0 "[ . 1 . 2 .]" 1
944 1 26 LEU MD2 1 28 GLN HE22 5.530 . 9.260 5.827 4.608 7.487 . 0 0 "[ . 1 . 2 .]" 1
945 1 26 LEU MD2 1 29 GLU H 4.214 . 6.514 4.701 4.143 5.099 . 0 0 "[ . 1 . 2 .]" 1
946 1 26 LEU MD2 1 29 GLU HB2 4.635 . 7.470 4.324 3.976 4.583 . 0 0 "[ . 1 . 2 .]" 1
947 1 26 LEU MD2 1 29 GLU HB3 4.635 . 7.470 5.400 4.938 5.779 . 0 0 "[ . 1 . 2 .]" 1
948 1 26 LEU MD2 1 29 GLU QG 3.935 . 6.070 3.477 2.720 4.203 . 0 0 "[ . 1 . 2 .]" 1
949 1 26 LEU HG 1 29 GLU QG 4.090 . 6.380 3.817 2.463 4.674 . 0 0 "[ . 1 . 2 .]" 1
950 1 27 LYS H 1 27 LYS HA 2.365 . 2.930 2.844 2.834 2.851 . 0 0 "[ . 1 . 2 .]" 1
951 1 27 LYS H 1 27 LYS QE 4.090 . 6.380 4.521 4.279 4.778 . 0 0 "[ . 1 . 2 .]" 1
952 1 27 LYS H 1 27 LYS HG2 2.440 . 3.080 2.868 2.649 3.083 0.003 15 0 "[ . 1 . 2 .]" 1
953 1 27 LYS H 1 27 LYS QG 2.230 . 2.660 2.188 1.972 2.413 . 0 0 "[ . 1 . 2 .]" 1
954 1 27 LYS H 1 27 LYS HG3 2.440 . 3.080 2.281 1.996 2.556 . 0 0 "[ . 1 . 2 .]" 1
955 1 27 LYS H 1 28 GLN H 2.470 . 3.140 2.513 2.478 2.541 . 0 0 "[ . 1 . 2 .]" 1
956 1 27 LYS H 1 28 GLN HA 3.435 . 5.070 5.127 5.116 5.137 0.067 14 0 "[ . 1 . 2 .]" 1
957 1 27 LYS H 1 28 GLN QB 3.795 . 5.790 4.410 4.375 4.446 . 0 0 "[ . 1 . 2 .]" 1
958 1 27 LYS H 1 28 GLN QG 4.075 . 6.350 4.616 4.505 4.744 . 0 0 "[ . 1 . 2 .]" 1
959 1 27 LYS H 1 29 GLU H 3.650 . 5.500 4.020 3.903 4.106 . 0 0 "[ . 1 . 2 .]" 1
960 1 27 LYS HA 1 27 LYS QD 3.515 . 5.230 3.808 3.559 4.205 . 0 0 "[ . 1 . 2 .]" 1
961 1 27 LYS HA 1 27 LYS QE 4.090 . 6.380 4.239 3.453 4.617 . 0 0 "[ . 1 . 2 .]" 1
962 1 27 LYS HA 1 27 LYS HG2 2.750 . 3.700 2.528 2.386 2.644 . 0 0 "[ . 1 . 2 .]" 1
963 1 27 LYS HA 1 27 LYS QG 2.590 . 3.380 2.469 2.347 2.561 . 0 0 "[ . 1 . 2 .]" 1
964 1 27 LYS HA 1 27 LYS HG3 2.750 . 3.700 3.477 3.288 3.615 . 0 0 "[ . 1 . 2 .]" 1
965 1 27 LYS HA 1 28 GLN H 2.625 . 3.450 3.471 3.453 3.479 0.029 8 0 "[ . 1 . 2 .]" 1
966 1 27 LYS HA 1 28 GLN HA 3.385 . 4.970 4.693 4.656 4.738 . 0 0 "[ . 1 . 2 .]" 1
967 1 27 LYS HA 1 29 GLU H 2.935 . 4.070 4.017 3.897 4.084 0.014 25 0 "[ . 1 . 2 .]" 1
968 1 27 LYS HA 1 30 GLY H 3.045 . 4.290 4.130 3.924 4.289 . 0 0 "[ . 1 . 2 .]" 1
969 1 27 LYS QB 1 27 LYS QE 4.340 . 6.880 3.357 2.210 3.606 . 0 0 "[ . 1 . 2 .]" 1
970 1 27 LYS QB 1 28 GLN H 3.160 . 4.520 2.877 2.817 2.995 . 0 0 "[ . 1 . 2 .]" 1
971 1 27 LYS QB 1 28 GLN HA 3.655 . 5.510 3.940 3.892 3.991 . 0 0 "[ . 1 . 2 .]" 1
972 1 27 LYS QB 1 28 GLN QE 4.525 . 7.250 3.911 3.397 4.371 . 0 0 "[ . 1 . 2 .]" 1
973 1 27 LYS QB 1 28 GLN HG2 4.090 . 6.380 4.977 4.815 5.079 . 0 0 "[ . 1 . 2 .]" 1
974 1 27 LYS QB 1 28 GLN QG 4.010 . 6.220 3.395 3.294 3.479 . 0 0 "[ . 1 . 2 .]" 1
975 1 27 LYS QB 1 28 GLN HG3 4.090 . 6.380 3.456 3.353 3.551 . 0 0 "[ . 1 . 2 .]" 1
976 1 27 LYS QG 1 28 GLN QE 4.520 . 7.240 4.843 4.341 5.388 . 0 0 "[ . 1 . 2 .]" 1
977 1 27 LYS HG2 1 28 GLN H 3.650 . 5.500 4.765 4.632 4.911 . 0 0 "[ . 1 . 2 .]" 1
978 1 27 LYS HG3 1 28 GLN H 3.650 . 5.500 4.261 4.069 4.604 . 0 0 "[ . 1 . 2 .]" 1
979 1 28 GLN H 1 28 GLN QB 2.675 . 3.550 2.247 2.231 2.263 . 0 0 "[ . 1 . 2 .]" 1
980 1 28 GLN H 1 28 GLN HG2 3.230 . 4.660 4.116 4.021 4.222 . 0 0 "[ . 1 . 2 .]" 1
981 1 28 GLN H 1 28 GLN QG 2.845 . 3.890 2.810 2.708 2.938 . 0 0 "[ . 1 . 2 .]" 1
982 1 28 GLN H 1 28 GLN HG3 3.230 . 4.660 2.860 2.751 2.998 . 0 0 "[ . 1 . 2 .]" 1
983 1 28 GLN H 1 29 GLU H 2.365 . 2.930 2.446 2.379 2.547 . 0 0 "[ . 1 . 2 .]" 1
984 1 28 GLN H 1 30 GLY H 3.075 . 4.350 4.307 4.226 4.357 0.007 16 0 "[ . 1 . 2 .]" 1
985 1 28 GLN HA 1 28 GLN HG2 2.315 . 2.830 2.739 2.650 2.834 0.004 6 0 "[ . 1 . 2 .]" 1
986 1 28 GLN HA 1 28 GLN QG 2.150 . 2.500 2.341 2.307 2.364 . 0 0 "[ . 1 . 2 .]" 1
987 1 28 GLN HA 1 28 GLN HG3 2.315 . 2.830 2.549 2.444 2.656 . 0 0 "[ . 1 . 2 .]" 1
988 1 28 GLN HA 1 29 GLU H 2.595 . 3.390 3.446 3.440 3.462 0.072 22 0 "[ . 1 . 2 .]" 1
989 1 28 GLN HA 1 29 GLU QG 4.090 . 6.380 4.950 4.814 5.136 . 0 0 "[ . 1 . 2 .]" 1
990 1 28 GLN HA 1 30 GLY H 3.125 . 4.450 3.628 3.580 3.689 . 0 0 "[ . 1 . 2 .]" 1
991 1 28 GLN QB 1 29 GLU H 3.005 . 4.210 3.013 2.908 3.050 . 0 0 "[ . 1 . 2 .]" 1
992 1 29 GLU H 1 29 GLU QG 2.850 . 3.900 2.427 2.233 2.664 . 0 0 "[ . 1 . 2 .]" 1
993 1 29 GLU H 1 30 GLY H 2.410 . 3.020 2.753 2.711 2.815 . 0 0 "[ . 1 . 2 .]" 1
994 1 29 GLU H 1 30 GLY HA2 3.265 . 4.730 4.682 4.647 4.732 0.002 22 0 "[ . 1 . 2 .]" 1
995 1 29 GLU HA 1 29 GLU QG 2.660 . 3.520 3.058 2.968 3.146 . 0 0 "[ . 1 . 2 .]" 1
996 1 29 GLU HA 1 30 GLY H 2.690 . 3.580 3.003 2.956 3.049 . 0 0 "[ . 1 . 2 .]" 1
997 1 29 GLU QB 1 30 GLY H 3.020 . 4.240 3.759 3.716 3.794 . 0 0 "[ . 1 . 2 .]" 1
998 1 29 GLU HB2 1 30 GLY H 3.155 . 4.510 4.030 3.997 4.072 . 0 0 "[ . 1 . 2 .]" 1
999 1 29 GLU HB3 1 30 GLY H 3.155 . 4.510 4.496 4.420 4.532 0.022 1 0 "[ . 1 . 2 .]" 1
1000 1 30 GLY H 1 30 GLY HA3 2.380 . 2.960 2.319 2.309 2.329 . 0 0 "[ . 1 . 2 .]" 1
1001 1 30 GLY H 1 31 THR HA 3.590 . 5.380 5.414 5.395 5.454 0.074 25 0 "[ . 1 . 2 .]" 1
1002 1 30 GLY HA2 1 31 THR H 2.690 . 3.580 2.312 2.276 2.344 . 0 0 "[ . 1 . 2 .]" 1
1003 1 30 GLY HA2 1 31 THR MG 3.760 . 5.720 3.373 3.253 3.566 . 0 0 "[ . 1 . 2 .]" 1
1004 1 30 GLY HA3 1 31 THR H 2.240 . 2.680 2.738 2.704 2.766 0.086 23 0 "[ . 1 . 2 .]" 1
1005 1 30 GLY HA3 1 31 THR MG 3.575 . 5.350 4.327 4.252 4.415 . 0 0 "[ . 1 . 2 .]" 1
1006 1 31 THR H 1 31 THR HB 2.535 . 3.270 3.283 3.238 3.295 0.025 14 0 "[ . 1 . 2 .]" 1
1007 1 31 THR H 1 31 THR MG 2.615 . 3.430 2.096 1.979 2.197 . 0 0 "[ . 1 . 2 .]" 1
1008 1 31 THR H 1 32 LYS HA 3.385 . 4.970 4.872 4.861 4.890 . 0 0 "[ . 1 . 2 .]" 1
1009 1 31 THR HA 1 31 THR HB 2.214 . 2.514 2.368 2.355 2.405 . 0 0 "[ . 1 . 2 .]" 1
1010 1 31 THR HA 1 31 THR MG 2.800 . 3.800 3.204 3.198 3.208 . 0 0 "[ . 1 . 2 .]" 1
1011 1 31 THR HA 1 32 LYS H 2.365 . 2.930 2.335 2.321 2.374 . 0 0 "[ . 1 . 2 .]" 1
1012 1 31 THR HA 1 32 LYS HA 3.140 . 4.480 4.350 4.346 4.362 . 0 0 "[ . 1 . 2 .]" 1
1013 1 31 THR HA 1 32 LYS QD 4.090 . 6.380 4.011 2.851 4.300 . 0 0 "[ . 1 . 2 .]" 1
1014 1 31 THR HA 1 32 LYS QG 3.610 . 5.420 3.658 3.491 4.355 . 0 0 "[ . 1 . 2 .]" 1
1015 1 31 THR HA 1 33 THR H 2.860 . 3.920 4.006 3.973 4.026 0.106 12 0 "[ . 1 . 2 .]" 1
1016 1 31 THR HB 1 32 LYS H 2.860 . 3.920 3.744 3.674 3.775 . 0 0 "[ . 1 . 2 .]" 1
1017 1 31 THR HB 1 32 LYS QG 4.090 . 6.380 5.293 5.230 5.402 . 0 0 "[ . 1 . 2 .]" 1
1018 1 31 THR MG 1 32 LYS H 3.280 . 4.760 3.791 3.671 3.851 . 0 0 "[ . 1 . 2 .]" 1
1019 1 31 THR MG 1 32 LYS HA 3.670 . 5.540 4.369 4.252 4.429 . 0 0 "[ . 1 . 2 .]" 1
1020 1 31 THR MG 1 32 LYS QE 4.385 . 6.970 5.094 4.754 5.217 . 0 0 "[ . 1 . 2 .]" 1
1021 1 31 THR MG 1 32 LYS QG 4.600 . 7.400 5.215 5.067 5.269 . 0 0 "[ . 1 . 2 .]" 1
1022 1 31 THR MG 1 33 THR H 2.770 . 3.740 2.592 2.405 2.775 . 0 0 "[ . 1 . 2 .]" 1
1023 1 31 THR MG 1 33 THR MG 4.025 . 6.250 2.715 2.250 3.109 . 0 0 "[ . 1 . 2 .]" 1
1024 1 31 THR MG 1 34 ALA HA 3.575 . 5.350 4.207 3.998 4.300 . 0 0 "[ . 1 . 2 .]" 1
1025 1 31 THR MG 1 34 ALA MB 4.680 . 7.560 5.164 5.022 5.224 . 0 0 "[ . 1 . 2 .]" 1
1026 1 31 THR MG 1 35 PRO HA 4.165 . 6.530 4.523 4.189 4.778 . 0 0 "[ . 1 . 2 .]" 1
1027 1 31 THR MG 1 35 PRO QB 4.450 . 7.100 3.481 3.228 3.942 . 0 0 "[ . 1 . 2 .]" 1
1028 1 31 THR MG 1 35 PRO HD2 3.745 . 5.690 4.357 3.936 4.453 . 0 0 "[ . 1 . 2 .]" 1
1029 1 31 THR MG 1 35 PRO QD 3.665 . 5.530 2.895 2.639 2.990 . 0 0 "[ . 1 . 2 .]" 1
1030 1 31 THR MG 1 35 PRO HD3 3.745 . 5.690 2.939 2.681 3.047 . 0 0 "[ . 1 . 2 .]" 1
1031 1 31 THR MG 1 35 PRO QG 3.920 . 6.040 3.281 2.093 3.761 . 0 0 "[ . 1 . 2 .]" 1
1032 1 32 LYS H 1 32 LYS HB2 2.610 . 3.420 3.544 3.502 3.601 0.181 12 0 "[ . 1 . 2 .]" 1
1033 1 32 LYS H 1 32 LYS QB 2.515 . 3.230 2.963 2.866 3.018 . 0 0 "[ . 1 . 2 .]" 1
1034 1 32 LYS H 1 32 LYS HB3 2.610 . 3.420 3.180 3.009 3.293 . 0 0 "[ . 1 . 2 .]" 1
1035 1 32 LYS H 1 32 LYS QD 4.075 . 6.350 2.003 1.893 2.173 . 0 0 "[ . 1 . 2 .]" 1
1036 1 32 LYS H 1 32 LYS QG 3.360 . 4.920 2.026 1.985 2.226 . 0 0 "[ . 1 . 2 .]" 1
1037 1 32 LYS H 1 33 THR H 2.520 . 3.240 2.786 2.708 2.822 . 0 0 "[ . 1 . 2 .]" 1
1038 1 32 LYS H 1 33 THR HB 3.555 . 5.310 4.793 4.727 4.836 . 0 0 "[ . 1 . 2 .]" 1
1039 1 32 LYS H 1 33 THR MG 4.165 . 6.530 2.940 2.553 3.092 . 0 0 "[ . 1 . 2 .]" 1
1040 1 32 LYS HA 1 32 LYS QD 3.390 . 4.980 3.517 3.479 3.583 . 0 0 "[ . 1 . 2 .]" 1
1041 1 32 LYS HA 1 32 LYS QE 3.995 . 6.190 4.924 3.791 5.146 . 0 0 "[ . 1 . 2 .]" 1
1042 1 32 LYS HA 1 33 THR H 2.660 . 3.520 2.948 2.902 3.055 . 0 0 "[ . 1 . 2 .]" 1
1043 1 32 LYS HA 1 33 THR MG 3.805 . 5.810 4.386 4.120 4.512 . 0 0 "[ . 1 . 2 .]" 1
1044 1 32 LYS QB 1 32 LYS QD 2.750 . 3.700 2.427 2.186 2.857 . 0 0 "[ . 1 . 2 .]" 1
1045 1 32 LYS QB 1 32 LYS QE 3.865 . 5.930 3.651 1.948 3.908 . 0 0 "[ . 1 . 2 .]" 1
1046 1 32 LYS QB 1 33 THR H 3.065 . 4.330 3.969 3.957 3.985 . 0 0 "[ . 1 . 2 .]" 1
1047 1 32 LYS QB 1 33 THR HB 3.780 . 5.760 4.694 4.590 4.804 . 0 0 "[ . 1 . 2 .]" 1
1048 1 32 LYS QB 1 33 THR MG 3.955 . 6.110 4.241 3.950 4.367 . 0 0 "[ . 1 . 2 .]" 1
1049 1 32 LYS HB2 1 32 LYS QE 3.950 . 6.100 4.019 1.959 4.378 . 0 0 "[ . 1 . 2 .]" 1
1050 1 32 LYS HB2 1 33 THR H 3.230 . 4.660 4.308 4.277 4.378 . 0 0 "[ . 1 . 2 .]" 1
1051 1 32 LYS HB3 1 32 LYS QE 3.950 . 6.100 4.277 3.418 4.562 . 0 0 "[ . 1 . 2 .]" 1
1052 1 32 LYS HB3 1 33 THR H 3.230 . 4.660 4.647 4.584 4.664 0.004 10 0 "[ . 1 . 2 .]" 1
1053 1 32 LYS QD 1 33 THR H 4.090 . 6.380 3.118 2.741 4.405 . 0 0 "[ . 1 . 2 .]" 1
1054 1 32 LYS QD 1 33 THR MG 3.625 . 5.450 2.213 1.968 3.809 . 0 0 "[ . 1 . 2 .]" 1
1055 1 32 LYS QE 1 33 THR MG 4.200 . 6.600 2.788 2.618 3.174 . 0 0 "[ . 1 . 2 .]" 1
1056 1 32 LYS QG 1 33 THR H 4.075 . 6.350 4.285 3.633 4.400 . 0 0 "[ . 1 . 2 .]" 1
1057 1 32 LYS QG 1 33 THR HB 4.090 . 6.380 5.006 3.661 5.289 . 0 0 "[ . 1 . 2 .]" 1
1058 1 32 LYS QG 1 33 THR MG 4.090 . 6.380 3.829 2.453 4.081 . 0 0 "[ . 1 . 2 .]" 1
1059 1 33 THR H 1 33 THR HB 2.735 . 3.670 3.524 3.442 3.657 . 0 0 "[ . 1 . 2 .]" 1
1060 1 33 THR H 1 33 THR MG 2.755 . 3.710 2.321 2.220 2.356 . 0 0 "[ . 1 . 2 .]" 1
1061 1 33 THR H 1 34 ALA H 3.045 . 4.290 4.288 4.151 4.345 0.055 6 0 "[ . 1 . 2 .]" 1
1062 1 33 THR HA 1 33 THR HB 2.315 . 2.830 2.334 2.295 2.340 . 0 0 "[ . 1 . 2 .]" 1
1063 1 33 THR HA 1 33 THR MG 2.800 . 3.800 3.199 3.171 3.203 . 0 0 "[ . 1 . 2 .]" 1
1064 1 33 THR HA 1 34 ALA H 2.145 . 2.490 2.203 2.154 2.228 . 0 0 "[ . 1 . 2 .]" 1
1065 1 33 THR HA 1 34 ALA MB 3.435 . 5.070 3.980 3.923 4.019 . 0 0 "[ . 1 . 2 .]" 1
1066 1 33 THR HB 1 34 ALA H 2.845 . 3.890 3.887 3.832 3.933 0.043 25 0 "[ . 1 . 2 .]" 1
1067 1 33 THR HB 1 34 ALA MB 4.165 . 6.530 5.404 5.371 5.424 . 0 0 "[ . 1 . 2 .]" 1
1068 1 33 THR MG 1 34 ALA HA 4.025 . 6.250 4.799 4.687 5.040 . 0 0 "[ . 1 . 2 .]" 1
1069 1 33 THR MG 1 35 PRO HA 3.775 . 5.750 4.538 4.356 4.634 . 0 0 "[ . 1 . 2 .]" 1
1070 1 34 ALA H 1 34 ALA MB 2.615 . 3.430 2.165 2.044 2.233 . 0 0 "[ . 1 . 2 .]" 1
1071 1 34 ALA H 1 35 PRO QD 4.090 . 6.380 4.229 4.060 4.280 . 0 0 "[ . 1 . 2 .]" 1
1072 1 34 ALA HA 1 35 PRO HD2 2.160 . 2.520 2.275 2.170 2.557 0.037 23 0 "[ . 1 . 2 .]" 1
1073 1 34 ALA HA 1 35 PRO HD3 2.160 . 2.520 2.284 1.994 2.385 . 0 0 "[ . 1 . 2 .]" 1
1074 1 34 ALA HA 1 35 PRO HG2 3.245 . 4.690 4.399 4.351 4.455 . 0 0 "[ . 1 . 2 .]" 1
1075 1 34 ALA HA 1 35 PRO QG 3.125 . 4.450 3.918 3.836 3.938 . 0 0 "[ . 1 . 2 .]" 1
1076 1 34 ALA HA 1 35 PRO HG3 3.245 . 4.690 4.401 4.191 4.448 . 0 0 "[ . 1 . 2 .]" 1
1077 1 34 ALA HA 1 40 VAL MG2 3.480 . 5.160 3.243 2.940 3.365 . 0 0 "[ . 1 . 2 .]" 1
1078 1 34 ALA MB 1 35 PRO QB 4.340 . 6.880 4.981 4.885 5.011 . 0 0 "[ . 1 . 2 .]" 1
1079 1 34 ALA MB 1 35 PRO HD2 3.220 . 4.640 3.177 3.057 3.501 . 0 0 "[ . 1 . 2 .]" 1
1080 1 34 ALA MB 1 35 PRO QD 2.970 . 4.140 3.024 2.953 3.195 . 0 0 "[ . 1 . 2 .]" 1
1081 1 34 ALA MB 1 35 PRO HD3 3.220 . 4.640 3.837 3.643 3.903 . 0 0 "[ . 1 . 2 .]" 1
1082 1 34 ALA MB 1 40 VAL MG2 3.950 . 6.100 3.206 2.874 3.408 . 0 0 "[ . 1 . 2 .]" 1
1083 1 35 PRO HA 1 36 SER H 2.210 . 2.620 2.192 2.171 2.243 . 0 0 "[ . 1 . 2 .]" 1
1084 1 35 PRO HA 1 36 SER HA 3.370 . 4.940 4.463 4.444 4.496 . 0 0 "[ . 1 . 2 .]" 1
1085 1 35 PRO HA 1 37 ASP H 3.155 . 4.510 3.288 3.244 3.370 . 0 0 "[ . 1 . 2 .]" 1
1086 1 35 PRO HA 1 38 ALA H 3.540 . 5.280 4.380 4.250 4.434 . 0 0 "[ . 1 . 2 .]" 1
1087 1 35 PRO QB 1 37 ASP H 2.720 . 3.640 2.969 2.844 3.262 . 0 0 "[ . 1 . 2 .]" 1
1088 1 35 PRO QB 1 38 ALA H 3.020 . 4.240 2.539 2.479 2.582 . 0 0 "[ . 1 . 2 .]" 1
1089 1 35 PRO QB 1 38 ALA MB 4.185 . 6.570 3.148 2.838 3.342 . 0 0 "[ . 1 . 2 .]" 1
1090 1 35 PRO QB 1 40 VAL MG2 4.605 . 7.410 4.151 3.568 4.381 . 0 0 "[ . 1 . 2 .]" 1
1091 1 35 PRO HB2 1 37 ASP H 2.955 . 4.110 3.084 2.899 3.657 . 0 0 "[ . 1 . 2 .]" 1
1092 1 35 PRO HB3 1 37 ASP H 2.955 . 4.110 4.072 3.528 4.170 0.060 8 0 "[ . 1 . 2 .]" 1
1093 1 35 PRO QD 1 40 VAL MG2 3.130 . 4.460 2.141 2.057 2.228 . 0 0 "[ . 1 . 2 .]" 1
1094 1 35 PRO HD2 1 40 VAL MG2 3.220 . 4.640 2.171 2.083 2.260 . 0 0 "[ . 1 . 2 .]" 1
1095 1 35 PRO HD3 1 40 VAL MG2 3.220 . 4.640 3.266 3.141 3.379 . 0 0 "[ . 1 . 2 .]" 1
1096 1 35 PRO QG 1 38 ALA H 3.510 . 5.220 3.590 3.274 4.583 . 0 0 "[ . 1 . 2 .]" 1
1097 1 35 PRO QG 1 38 ALA MB 4.370 . 6.940 3.397 3.095 4.056 . 0 0 "[ . 1 . 2 .]" 1
1098 1 35 PRO QG 1 40 VAL MG2 3.520 . 5.240 2.692 2.440 3.322 . 0 0 "[ . 1 . 2 .]" 1
1099 1 35 PRO HG2 1 38 ALA H 3.650 . 5.500 3.713 3.351 4.900 . 0 0 "[ . 1 . 2 .]" 1
1100 1 35 PRO HG3 1 38 ALA H 3.650 . 5.500 4.839 4.596 5.512 0.012 19 0 "[ . 1 . 2 .]" 1
1101 1 35 PRO O 1 38 ALA H 1.950 . 2.200 2.268 2.251 2.279 0.079 16 0 "[ . 1 . 2 .]" 1
1102 1 35 PRO O 1 38 ALA N 2.950 2.700 3.200 3.139 3.098 3.154 . 0 0 "[ . 1 . 2 .]" 1
1103 1 36 SER H 1 36 SER HB2 2.595 . 3.390 2.581 2.357 2.806 . 0 0 "[ . 1 . 2 .]" 1
1104 1 36 SER H 1 36 SER HB3 2.580 . 3.360 2.517 2.310 2.750 . 0 0 "[ . 1 . 2 .]" 1
1105 1 36 SER H 1 37 ASP H 2.270 . 2.740 2.622 2.615 2.645 . 0 0 "[ . 1 . 2 .]" 1
1106 1 36 SER H 1 38 ALA H 3.000 . 4.200 4.338 4.326 4.345 0.145 9 0 "[ . 1 . 2 .]" 1
1107 1 36 SER HB2 1 37 ASP H 3.170 . 4.540 4.263 4.116 4.391 . 0 0 "[ . 1 . 2 .]" 1
1108 1 36 SER HB3 1 37 ASP H 2.920 . 4.040 3.320 3.239 3.367 . 0 0 "[ . 1 . 2 .]" 1
1109 1 37 ASP H 1 37 ASP HB2 2.765 . 3.730 2.210 2.206 2.212 . 0 0 "[ . 1 . 2 .]" 1
1110 1 37 ASP H 1 38 ALA H 2.395 . 2.990 2.423 2.407 2.433 . 0 0 "[ . 1 . 2 .]" 1
1111 1 37 ASP H 1 38 ALA MB 3.560 . 5.320 4.358 4.310 4.390 . 0 0 "[ . 1 . 2 .]" 1
1112 1 37 ASP HB2 1 38 ALA H 2.955 . 4.110 3.022 3.011 3.040 . 0 0 "[ . 1 . 2 .]" 1
1113 1 37 ASP HB2 1 38 ALA MB 4.025 . 6.250 3.720 3.672 3.777 . 0 0 "[ . 1 . 2 .]" 1
1114 1 37 ASP HB3 1 38 ALA H 2.660 . 3.520 3.667 3.659 3.674 0.154 12 0 "[ . 1 . 2 .]" 1
1115 1 37 ASP HB3 1 38 ALA MB 3.915 . 6.144 3.612 3.490 3.743 . 0 0 "[ . 1 . 2 .]" 1
1116 1 38 ALA H 1 38 ALA MB 2.615 . 3.430 2.606 2.532 2.665 . 0 0 "[ . 1 . 2 .]" 1
1117 1 38 ALA H 1 39 PRO HA 3.370 . 4.940 5.037 5.024 5.061 0.121 25 0 "[ . 1 . 2 .]" 1
1118 1 38 ALA H 1 39 PRO HD2 3.650 . 5.500 4.909 4.883 4.937 . 0 0 "[ . 1 . 2 .]" 1
1119 1 38 ALA H 1 39 PRO HD3 3.650 . 5.500 4.984 4.955 5.008 . 0 0 "[ . 1 . 2 .]" 1
1120 1 38 ALA HA 1 39 PRO QD 2.660 . 3.520 2.205 2.186 2.220 . 0 0 "[ . 1 . 2 .]" 1
1121 1 38 ALA HA 1 65 LEU QD 4.900 . 8.114 3.008 2.829 3.179 . 0 0 "[ . 1 . 2 .]" 1
1122 1 38 ALA MB 1 39 PRO HD2 2.845 . 3.890 1.977 1.952 2.018 . 0 0 "[ . 1 . 2 .]" 1
1123 1 38 ALA MB 1 39 PRO QD 2.680 . 3.560 1.953 1.922 1.996 . 0 0 "[ . 1 . 2 .]" 1
1124 1 38 ALA MB 1 39 PRO HD3 2.845 . 3.890 3.052 2.863 3.167 . 0 0 "[ . 1 . 2 .]" 1
1125 1 38 ALA MB 1 39 PRO HG2 3.620 . 5.440 3.747 3.633 3.860 . 0 0 "[ . 1 . 2 .]" 1
1126 1 38 ALA MB 1 39 PRO QG 3.410 . 5.020 3.541 3.461 3.611 . 0 0 "[ . 1 . 2 .]" 1
1127 1 38 ALA MB 1 39 PRO HG3 3.620 . 5.440 4.363 4.333 4.386 . 0 0 "[ . 1 . 2 .]" 1
1128 1 38 ALA MB 1 57 LEU MD2 4.385 . 6.970 4.283 4.196 4.386 . 0 0 "[ . 1 . 2 .]" 1
1129 1 38 ALA MB 1 65 LEU MD1 4.645 . 7.490 3.220 3.074 3.345 . 0 0 "[ . 1 . 2 .]" 1
1130 1 38 ALA MB 1 65 LEU QD 4.260 . 6.720 3.175 3.037 3.288 . 0 0 "[ . 1 . 2 .]" 1
1131 1 38 ALA MB 1 65 LEU MD2 4.645 . 7.490 4.830 4.659 4.982 . 0 0 "[ . 1 . 2 .]" 1
1132 1 39 PRO HA 1 40 VAL H 2.240 . 2.680 2.435 2.427 2.445 . 0 0 "[ . 1 . 2 .]" 1
1133 1 39 PRO HA 1 68 MET QB 4.075 . 6.350 4.193 4.072 4.360 . 0 0 "[ . 1 . 2 .]" 1
1134 1 39 PRO HA 1 68 MET QG 3.330 . 4.860 2.838 2.681 2.940 . 0 0 "[ . 1 . 2 .]" 1
1135 1 39 PRO HA 1 71 ILE H 3.590 . 5.380 5.066 4.991 5.142 . 0 0 "[ . 1 . 2 .]" 1
1136 1 39 PRO HA 1 71 ILE MD 3.605 . 5.410 3.837 3.806 3.863 . 0 0 "[ . 1 . 2 .]" 1
1137 1 39 PRO HB2 1 40 VAL H 2.625 . 3.450 2.440 2.409 2.460 . 0 0 "[ . 1 . 2 .]" 1
1138 1 39 PRO HB2 1 65 LEU QD 4.640 . 7.480 4.836 4.534 5.177 . 0 0 "[ . 1 . 2 .]" 1
1139 1 39 PRO HB2 1 71 ILE MD 3.280 . 4.760 1.810 1.803 1.817 . 0 0 "[ . 1 . 2 .]" 1
1140 1 39 PRO HB2 1 71 ILE QG 3.240 . 4.680 3.207 3.170 3.243 . 0 0 "[ . 1 . 2 .]" 1
1141 1 39 PRO HB3 1 68 MET QB 4.090 . 6.380 3.637 3.360 4.006 . 0 0 "[ . 1 . 2 .]" 1
1142 1 39 PRO HB3 1 71 ILE MD 2.615 . 3.430 2.665 2.636 2.689 . 0 0 "[ . 1 . 2 .]" 1
1143 1 39 PRO QD 1 57 LEU MD1 4.605 . 7.410 5.085 5.004 5.136 . 0 0 "[ . 1 . 2 .]" 1
1144 1 39 PRO QD 1 57 LEU MD2 3.440 . 5.080 2.911 2.816 3.126 . 0 0 "[ . 1 . 2 .]" 1
1145 1 39 PRO QD 1 65 LEU QB 4.375 . 6.950 3.043 2.803 3.281 . 0 0 "[ . 1 . 2 .]" 1
1146 1 39 PRO QD 1 65 LEU QD 3.460 . 5.120 1.938 1.782 2.143 0.018 25 0 "[ . 1 . 2 .]" 1
1147 1 39 PRO QD 1 71 ILE MD 4.435 . 7.070 4.344 4.327 4.355 . 0 0 "[ . 1 . 2 .]" 1
1148 1 39 PRO HD2 1 65 LEU MD1 3.840 . 5.880 2.623 2.365 2.948 . 0 0 "[ . 1 . 2 .]" 1
1149 1 39 PRO HD2 1 65 LEU MD2 3.840 . 5.880 4.551 4.225 4.748 . 0 0 "[ . 1 . 2 .]" 1
1150 1 39 PRO HD3 1 65 LEU MD1 3.840 . 5.880 2.004 1.837 2.232 . 0 0 "[ . 1 . 2 .]" 1
1151 1 39 PRO HD3 1 65 LEU MD2 3.840 . 5.880 4.383 4.253 4.639 . 0 0 "[ . 1 . 2 .]" 1
1152 1 39 PRO QG 1 53 MET ME 3.735 . 5.670 3.763 3.602 3.840 . 0 0 "[ . 1 . 2 .]" 1
1153 1 39 PRO QG 1 54 THR MG 4.605 . 7.410 4.411 4.345 4.513 . 0 0 "[ . 1 . 2 .]" 1
1154 1 39 PRO QG 1 57 LEU MD1 3.490 . 5.180 3.664 3.599 3.708 . 0 0 "[ . 1 . 2 .]" 1
1155 1 39 PRO QG 1 57 LEU MD2 3.955 . 6.110 1.795 1.748 1.970 0.052 14 0 "[ . 1 . 2 .]" 1
1156 1 39 PRO QG 1 65 LEU QB 3.690 . 5.580 2.397 2.214 2.614 . 0 0 "[ . 1 . 2 .]" 1
1157 1 39 PRO QG 1 65 LEU QD 4.800 . 7.800 2.661 2.343 3.056 . 0 0 "[ . 1 . 2 .]" 1
1158 1 39 PRO QG 1 71 ILE MD 2.800 . 3.800 2.850 2.826 2.865 . 0 0 "[ . 1 . 2 .]" 1
1159 1 39 PRO HG2 1 57 LEU MD1 3.560 . 5.320 4.410 4.389 4.425 . 0 0 "[ . 1 . 2 .]" 1
1160 1 39 PRO HG2 1 71 ILE MD 3.050 . 4.300 3.196 3.165 3.218 . 0 0 "[ . 1 . 2 .]" 1
1161 1 39 PRO HG3 1 57 LEU MD1 3.560 . 5.320 3.916 3.817 3.984 . 0 0 "[ . 1 . 2 .]" 1
1162 1 39 PRO HG3 1 71 ILE MD 3.050 . 4.300 3.201 3.163 3.234 . 0 0 "[ . 1 . 2 .]" 1
1163 1 40 VAL H 1 40 VAL HB 2.425 . 3.050 2.669 2.656 2.683 . 0 0 "[ . 1 . 2 .]" 1
1164 1 40 VAL H 1 41 LEU H 3.385 . 4.970 4.432 4.425 4.439 . 0 0 "[ . 1 . 2 .]" 1
1165 1 40 VAL H 1 68 MET QG 3.750 . 5.700 4.265 3.944 4.520 . 0 0 "[ . 1 . 2 .]" 1
1166 1 40 VAL H 1 70 GLU HA 2.425 . 3.050 2.155 2.091 2.208 . 0 0 "[ . 1 . 2 .]" 1
1167 1 40 VAL H 1 70 GLU QB 3.580 . 5.360 3.738 3.674 3.795 . 0 0 "[ . 1 . 2 .]" 1
1168 1 40 VAL H 1 71 ILE H 2.675 . 3.550 2.854 2.789 2.918 . 0 0 "[ . 1 . 2 .]" 1
1169 1 40 VAL H 1 71 ILE MD 3.390 . 4.980 2.664 2.635 2.738 . 0 0 "[ . 1 . 2 .]" 1
1170 1 40 VAL H 1 71 ILE QG 3.825 . 5.850 3.363 3.291 3.449 . 0 0 "[ . 1 . 2 .]" 1
1171 1 40 VAL HA 1 40 VAL MG1 2.615 . 3.430 2.510 2.490 2.530 . 0 0 "[ . 1 . 2 .]" 1
1172 1 40 VAL HA 1 40 VAL MG2 2.615 . 3.430 2.367 2.345 2.382 . 0 0 "[ . 1 . 2 .]" 1
1173 1 40 VAL HA 1 41 LEU H 2.350 . 2.900 2.318 2.303 2.336 . 0 0 "[ . 1 . 2 .]" 1
1174 1 40 VAL HA 1 41 LEU MD1 4.165 . 6.530 5.104 5.074 5.124 . 0 0 "[ . 1 . 2 .]" 1
1175 1 40 VAL HA 1 71 ILE MD 3.450 . 5.100 3.973 3.947 4.001 . 0 0 "[ . 1 . 2 .]" 1
1176 1 40 VAL HB 1 42 VAL MG2 3.065 . 4.330 3.536 3.495 3.589 . 0 0 "[ . 1 . 2 .]" 1
1177 1 40 VAL HB 1 70 GLU HA 2.565 . 3.330 2.248 2.225 2.272 . 0 0 "[ . 1 . 2 .]" 1
1178 1 40 VAL HB 1 71 ILE H 2.535 . 3.270 3.114 3.063 3.163 . 0 0 "[ . 1 . 2 .]" 1
1179 1 40 VAL MG1 1 41 LEU H 2.910 . 4.134 2.075 2.044 2.112 . 0 0 "[ . 1 . 2 .]" 1
1180 1 40 VAL MG1 1 70 GLU HA 3.170 . 4.540 3.822 3.810 3.834 . 0 0 "[ . 1 . 2 .]" 1
1181 1 40 VAL MG1 1 71 ILE H 3.375 . 4.950 3.589 3.546 3.631 . 0 0 "[ . 1 . 2 .]" 1
1182 1 40 VAL MG2 1 41 LEU H 3.140 . 4.480 3.708 3.693 3.723 . 0 0 "[ . 1 . 2 .]" 1
1183 1 40 VAL MG2 1 70 GLU HA 3.050 . 4.300 3.401 3.327 3.459 . 0 0 "[ . 1 . 2 .]" 1
1184 1 40 VAL O 1 71 ILE H 1.950 . 2.200 1.787 1.772 1.796 . 0 0 "[ . 1 . 2 .]" 1
1185 1 40 VAL O 1 71 ILE N 2.950 2.700 3.200 2.663 2.652 2.671 0.048 16 0 "[ . 1 . 2 .]" 1
1186 1 41 LEU H 1 41 LEU MD1 3.590 . 5.380 4.107 4.077 4.131 . 0 0 "[ . 1 . 2 .]" 1
1187 1 41 LEU H 1 41 LEU MD2 3.450 . 5.100 3.685 3.661 3.746 . 0 0 "[ . 1 . 2 .]" 1
1188 1 41 LEU H 1 41 LEU HG 2.750 . 3.700 3.011 2.975 3.066 . 0 0 "[ . 1 . 2 .]" 1
1189 1 41 LEU H 1 42 VAL QG 4.355 . 6.910 4.200 4.092 4.267 . 0 0 "[ . 1 . 2 .]" 1
1190 1 41 LEU HA 1 41 LEU MD1 3.280 . 4.760 3.801 3.793 3.809 . 0 0 "[ . 1 . 2 .]" 1
1191 1 41 LEU HA 1 41 LEU MD2 2.690 . 3.580 2.022 1.957 2.073 . 0 0 "[ . 1 . 2 .]" 1
1192 1 41 LEU HA 1 41 LEU HG 2.455 . 3.110 3.125 3.116 3.133 0.023 14 0 "[ . 1 . 2 .]" 1
1193 1 41 LEU HA 1 42 VAL MG2 3.635 . 5.470 3.833 3.765 3.918 . 0 0 "[ . 1 . 2 .]" 1
1194 1 41 LEU HA 1 44 TRP HD1 3.045 . 4.290 3.993 3.965 4.035 . 0 0 "[ . 1 . 2 .]" 1
1195 1 41 LEU HA 1 71 ILE H 2.645 . 3.490 3.446 3.412 3.476 . 0 0 "[ . 1 . 2 .]" 1
1196 1 41 LEU HA 1 71 ILE HB 2.535 . 3.270 2.507 2.474 2.560 . 0 0 "[ . 1 . 2 .]" 1
1197 1 41 LEU HA 1 71 ILE MD 3.065 . 4.330 3.407 3.380 3.441 . 0 0 "[ . 1 . 2 .]" 1
1198 1 41 LEU HA 1 71 ILE QG 4.090 . 6.380 4.546 4.522 4.567 . 0 0 "[ . 1 . 2 .]" 1
1199 1 41 LEU HA 1 71 ILE MG 3.250 . 4.700 3.675 3.586 3.790 . 0 0 "[ . 1 . 2 .]" 1
1200 1 41 LEU QB 1 42 VAL H 3.550 . 5.300 3.663 3.656 3.672 . 0 0 "[ . 1 . 2 .]" 1
1201 1 41 LEU QB 1 44 TRP HD1 3.500 . 5.200 2.833 2.818 2.867 . 0 0 "[ . 1 . 2 .]" 1
1202 1 41 LEU QB 1 50 ILE HA 3.920 . 6.040 4.507 4.417 4.543 . 0 0 "[ . 1 . 2 .]" 1
1203 1 41 LEU QB 1 50 ILE QG 3.950 . 6.100 3.185 3.155 3.212 . 0 0 "[ . 1 . 2 .]" 1
1204 1 41 LEU QB 1 50 ILE MG 3.800 . 5.800 3.678 3.601 3.752 . 0 0 "[ . 1 . 2 .]" 1
1205 1 41 LEU QB 1 71 ILE HB 3.810 . 5.820 4.381 4.357 4.434 . 0 0 "[ . 1 . 2 .]" 1
1206 1 41 LEU MD1 1 44 TRP QB 4.605 . 7.410 3.891 3.828 3.914 . 0 0 "[ . 1 . 2 .]" 1
1207 1 41 LEU MD1 1 44 TRP HE3 3.530 . 5.260 4.089 3.876 4.154 . 0 0 "[ . 1 . 2 .]" 1
1208 1 41 LEU MD1 1 44 TRP HZ2 3.480 . 5.160 4.072 3.968 4.094 . 0 0 "[ . 1 . 2 .]" 1
1209 1 41 LEU MD1 1 50 ILE HA 3.790 . 5.780 2.519 2.457 2.575 . 0 0 "[ . 1 . 2 .]" 1
1210 1 41 LEU MD1 1 50 ILE HB 3.545 . 5.290 4.085 4.030 4.136 . 0 0 "[ . 1 . 2 .]" 1
1211 1 41 LEU MD1 1 50 ILE MD 3.920 . 6.040 3.460 3.401 3.561 . 0 0 "[ . 1 . 2 .]" 1
1212 1 41 LEU MD1 1 50 ILE QG 3.920 . 6.040 2.344 2.284 2.419 . 0 0 "[ . 1 . 2 .]" 1
1213 1 41 LEU MD1 1 50 ILE MG 3.950 . 6.100 2.045 1.948 2.149 . 0 0 "[ . 1 . 2 .]" 1
1214 1 41 LEU MD1 1 53 MET QB 3.660 . 5.520 2.621 2.411 2.715 . 0 0 "[ . 1 . 2 .]" 1
1215 1 41 LEU MD1 1 53 MET ME 3.980 . 6.160 3.376 3.249 3.473 . 0 0 "[ . 1 . 2 .]" 1
1216 1 41 LEU MD1 1 54 THR HA 3.855 . 5.910 4.320 4.259 4.395 . 0 0 "[ . 1 . 2 .]" 1
1217 1 41 LEU MD1 1 54 THR HB 4.165 . 6.530 5.066 4.967 5.129 . 0 0 "[ . 1 . 2 .]" 1
1218 1 41 LEU MD1 1 54 THR MG 3.935 . 6.070 3.067 2.993 3.132 . 0 0 "[ . 1 . 2 .]" 1
1219 1 41 LEU MD1 1 71 ILE HB 4.165 . 6.530 4.948 4.909 5.000 . 0 0 "[ . 1 . 2 .]" 1
1220 1 41 LEU MD2 1 44 TRP HH2 3.590 . 5.380 3.646 3.454 3.743 . 0 0 "[ . 1 . 2 .]" 1
1221 1 41 LEU MD2 1 44 TRP HZ2 3.000 . 4.200 2.434 2.307 2.483 . 0 0 "[ . 1 . 2 .]" 1
1222 1 41 LEU MD2 1 50 ILE HA 3.620 . 5.440 4.249 4.159 4.332 . 0 0 "[ . 1 . 2 .]" 1
1223 1 41 LEU MD2 1 50 ILE MG 4.460 . 7.120 4.189 4.071 4.310 . 0 0 "[ . 1 . 2 .]" 1
1224 1 41 LEU MD2 1 53 MET HA 4.165 . 6.530 4.956 4.705 5.031 . 0 0 "[ . 1 . 2 .]" 1
1225 1 41 LEU MD2 1 53 MET QB 3.055 . 4.310 2.542 2.353 2.646 . 0 0 "[ . 1 . 2 .]" 1
1226 1 41 LEU MD2 1 53 MET ME 3.640 . 5.480 2.218 1.976 2.328 . 0 0 "[ . 1 . 2 .]" 1
1227 1 41 LEU MD2 1 54 THR MG 4.680 . 7.560 4.440 4.398 4.508 . 0 0 "[ . 1 . 2 .]" 1
1228 1 41 LEU MD2 1 57 LEU MD1 4.680 . 7.560 4.165 4.077 4.297 . 0 0 "[ . 1 . 2 .]" 1
1229 1 41 LEU MD2 1 57 LEU MD2 4.260 . 6.720 3.618 3.524 3.692 . 0 0 "[ . 1 . 2 .]" 1
1230 1 41 LEU MD2 1 71 ILE H 3.420 . 5.040 3.885 3.827 3.966 . 0 0 "[ . 1 . 2 .]" 1
1231 1 41 LEU MD2 1 71 ILE HA 4.040 . 6.280 4.850 4.813 4.888 . 0 0 "[ . 1 . 2 .]" 1
1232 1 41 LEU MD2 1 71 ILE HB 2.755 . 3.710 2.245 2.159 2.350 . 0 0 "[ . 1 . 2 .]" 1
1233 1 41 LEU MD2 1 71 ILE MD 3.610 . 5.420 1.984 1.907 2.046 . 0 0 "[ . 1 . 2 .]" 1
1234 1 41 LEU MD2 1 71 ILE MG 3.685 . 5.570 2.833 2.723 2.908 . 0 0 "[ . 1 . 2 .]" 1
1235 1 41 LEU MD2 1 83 VAL HB 3.775 . 5.750 4.498 4.378 4.581 . 0 0 "[ . 1 . 2 .]" 1
1236 1 41 LEU MD2 1 85 VAL MG1 4.680 . 7.560 4.755 4.691 4.845 . 0 0 "[ . 1 . 2 .]" 1
1237 1 41 LEU MD2 1 100 PHE QE 5.225 . 8.650 4.362 4.274 4.778 . 0 0 "[ . 1 . 2 .]" 1
1238 1 41 LEU HG 1 53 MET ME 3.560 . 5.320 4.050 3.880 4.179 . 0 0 "[ . 1 . 2 .]" 1
1239 1 41 LEU HG 1 71 ILE H 3.650 . 5.500 5.492 5.453 5.515 0.015 22 0 "[ . 1 . 2 .]" 1
1240 1 41 LEU HG 1 71 ILE HB 3.230 . 4.660 4.487 4.458 4.525 . 0 0 "[ . 1 . 2 .]" 1
1241 1 41 LEU HG 1 71 ILE MD 3.360 . 4.920 3.508 3.480 3.533 . 0 0 "[ . 1 . 2 .]" 1
1242 1 42 VAL H 1 71 ILE MG 3.480 . 5.160 3.969 3.899 4.086 . 0 0 "[ . 1 . 2 .]" 1
1243 1 42 VAL H 1 71 ILE O 1.950 . 2.200 1.739 1.711 1.760 . 0 0 "[ . 1 . 2 .]" 1
1244 1 42 VAL HA 1 42 VAL MG1 2.615 . 3.430 2.359 2.306 2.424 . 0 0 "[ . 1 . 2 .]" 1
1245 1 42 VAL HA 1 42 VAL MG2 2.615 . 3.430 2.375 2.296 2.453 . 0 0 "[ . 1 . 2 .]" 1
1246 1 42 VAL HA 1 44 TRP HD1 2.625 . 3.450 3.222 3.190 3.245 . 0 0 "[ . 1 . 2 .]" 1
1247 1 42 VAL HA 1 72 HIS HA 3.495 . 5.190 4.781 4.730 4.807 . 0 0 "[ . 1 . 2 .]" 1
1248 1 42 VAL HB 1 70 GLU QB 3.550 . 5.300 4.367 4.355 4.381 . 0 0 "[ . 1 . 2 .]" 1
1249 1 42 VAL HB 1 72 HIS HA 2.440 . 3.080 1.913 1.898 1.922 . 0 0 "[ . 1 . 2 .]" 1
1250 1 42 VAL HB 1 72 HIS HD2 2.800 . 3.800 2.922 2.514 3.163 . 0 0 "[ . 1 . 2 .]" 1
1251 1 42 VAL QG 1 43 GLY H 3.720 . 5.640 2.417 2.290 2.529 . 0 0 "[ . 1 . 2 .]" 1
1252 1 42 VAL MG1 1 43 GLY HA2 3.235 . 4.670 3.768 3.719 3.804 . 0 0 "[ . 1 . 2 .]" 1
1253 1 42 VAL MG1 1 43 GLY QA 3.085 . 4.370 3.039 2.952 3.105 . 0 0 "[ . 1 . 2 .]" 1
1254 1 42 VAL MG1 1 43 GLY HA3 3.235 . 4.670 3.208 3.097 3.306 . 0 0 "[ . 1 . 2 .]" 1
1255 1 42 VAL MG1 1 70 GLU QB 4.605 . 7.410 4.499 4.434 4.556 . 0 0 "[ . 1 . 2 .]" 1
1256 1 42 VAL MG1 1 70 GLU QG 4.600 . 7.400 4.651 4.255 5.088 . 0 0 "[ . 1 . 2 .]" 1
1257 1 42 VAL MG1 1 72 HIS HA 2.815 . 3.830 3.189 3.137 3.230 . 0 0 "[ . 1 . 2 .]" 1
1258 1 42 VAL MG1 1 72 HIS QB 4.465 . 7.130 3.982 3.777 4.084 . 0 0 "[ . 1 . 2 .]" 1
1259 1 42 VAL MG1 1 72 HIS HD2 3.310 . 4.820 3.610 3.352 3.958 . 0 0 "[ . 1 . 2 .]" 1
1260 1 42 VAL MG2 1 70 GLU HA 3.495 . 5.190 4.052 3.970 4.163 . 0 0 "[ . 1 . 2 .]" 1
1261 1 42 VAL MG2 1 70 GLU HB2 3.224 . 4.534 2.197 2.116 2.283 . 0 0 "[ . 1 . 2 .]" 1
1262 1 42 VAL MG2 1 70 GLU QB 2.975 . 4.150 2.174 2.097 2.255 . 0 0 "[ . 1 . 2 .]" 1
1263 1 42 VAL MG2 1 70 GLU HB3 3.224 . 4.534 3.467 3.433 3.507 . 0 0 "[ . 1 . 2 .]" 1
1264 1 42 VAL MG2 1 70 GLU QG 3.285 . 4.770 2.887 2.435 3.362 . 0 0 "[ . 1 . 2 .]" 1
1265 1 42 VAL MG2 1 72 HIS HA 2.895 . 3.990 3.291 3.241 3.331 . 0 0 "[ . 1 . 2 .]" 1
1266 1 42 VAL MG2 1 72 HIS HD2 2.660 . 3.520 2.287 1.979 2.543 . 0 0 "[ . 1 . 2 .]" 1
1267 1 42 VAL N 1 71 ILE O 2.950 2.700 3.200 2.657 2.640 2.675 0.060 23 0 "[ . 1 . 2 .]" 1
1268 1 43 GLY H 1 44 TRP H 2.780 . 3.760 3.345 3.267 3.419 . 0 0 "[ . 1 . 2 .]" 1
1269 1 43 GLY HA2 1 44 TRP H 2.675 . 3.550 2.316 2.296 2.353 . 0 0 "[ . 1 . 2 .]" 1
1270 1 43 GLY HA3 1 44 TRP H 2.675 . 3.550 3.517 3.505 3.536 . 0 0 "[ . 1 . 2 .]" 1
1271 1 44 TRP H 1 44 TRP HB2 2.905 . 4.124 2.866 2.842 2.880 . 0 0 "[ . 1 . 2 .]" 1
1272 1 44 TRP H 1 44 TRP QB 2.655 . 3.510 2.798 2.776 2.810 . 0 0 "[ . 1 . 2 .]" 1
1273 1 44 TRP H 1 44 TRP HB3 2.905 . 4.124 3.908 3.893 3.914 . 0 0 "[ . 1 . 2 .]" 1
1274 1 44 TRP HA 1 44 TRP HD1 3.075 . 4.350 3.910 3.846 3.940 . 0 0 "[ . 1 . 2 .]" 1
1275 1 44 TRP HA 1 50 ILE MD 3.575 . 5.350 4.298 4.245 4.321 . 0 0 "[ . 1 . 2 .]" 1
1276 1 44 TRP HA 1 73 TYR QD 4.160 . 6.520 3.625 2.392 4.303 . 0 0 "[ . 1 . 2 .]" 1
1277 1 44 TRP QB 1 50 ILE MD 3.365 . 4.930 2.210 2.196 2.226 . 0 0 "[ . 1 . 2 .]" 1
1278 1 44 TRP QB 1 50 ILE QG 2.845 . 3.890 2.223 2.061 2.269 . 0 0 "[ . 1 . 2 .]" 1
1279 1 44 TRP HB2 1 50 ILE HG12 3.345 . 4.890 3.325 3.126 3.393 . 0 0 "[ . 1 . 2 .]" 1
1280 1 44 TRP HB2 1 50 ILE HG13 3.345 . 4.890 3.784 3.536 3.867 . 0 0 "[ . 1 . 2 .]" 1
1281 1 44 TRP HB3 1 50 ILE HG12 3.345 . 4.890 2.766 2.633 2.852 . 0 0 "[ . 1 . 2 .]" 1
1282 1 44 TRP HB3 1 50 ILE HG13 3.345 . 4.890 2.422 2.204 2.481 . 0 0 "[ . 1 . 2 .]" 1
1283 1 44 TRP HD1 1 50 ILE MD 3.870 . 5.940 4.776 4.734 4.800 . 0 0 "[ . 1 . 2 .]" 1
1284 1 44 TRP HE1 1 71 ILE H 3.650 . 5.500 5.211 5.157 5.270 . 0 0 "[ . 1 . 2 .]" 1
1285 1 44 TRP HE1 1 71 ILE MG 3.295 . 4.790 3.618 3.484 3.794 . 0 0 "[ . 1 . 2 .]" 1
1286 1 44 TRP HE3 1 49 ALA MB 2.985 . 4.170 2.523 2.278 2.728 . 0 0 "[ . 1 . 2 .]" 1
1287 1 44 TRP HE3 1 50 ILE H 3.280 . 4.760 3.472 3.252 3.557 . 0 0 "[ . 1 . 2 .]" 1
1288 1 44 TRP HE3 1 50 ILE HA 3.280 . 4.760 3.380 3.077 3.451 . 0 0 "[ . 1 . 2 .]" 1
1289 1 44 TRP HE3 1 50 ILE MD 3.140 . 4.480 3.610 3.551 3.664 . 0 0 "[ . 1 . 2 .]" 1
1290 1 44 TRP HE3 1 50 ILE QG 3.220 . 4.640 2.194 2.122 2.262 . 0 0 "[ . 1 . 2 .]" 1
1291 1 44 TRP HE3 1 50 ILE MG 4.040 . 6.280 4.673 4.543 4.773 . 0 0 "[ . 1 . 2 .]" 1
1292 1 44 TRP HE3 1 97 ILE MD 3.575 . 5.350 3.998 3.909 4.082 . 0 0 "[ . 1 . 2 .]" 1
1293 1 44 TRP HH2 1 50 ILE HA 3.635 . 5.470 4.650 4.533 4.749 . 0 0 "[ . 1 . 2 .]" 1
1294 1 44 TRP HH2 1 83 VAL MG1 3.170 . 4.540 1.957 1.872 2.052 . 0 0 "[ . 1 . 2 .]" 1
1295 1 44 TRP HH2 1 97 ILE MD 2.705 . 3.610 1.998 1.932 2.042 . 0 0 "[ . 1 . 2 .]" 1
1296 1 44 TRP HH2 1 97 ILE MG 3.465 . 5.130 4.142 3.953 4.173 . 0 0 "[ . 1 . 2 .]" 1
1297 1 44 TRP HZ2 1 71 ILE MG 2.615 . 3.430 2.597 2.499 2.752 . 0 0 "[ . 1 . 2 .]" 1
1298 1 44 TRP HZ2 1 83 VAL MG1 2.615 . 3.430 2.153 1.982 2.395 . 0 0 "[ . 1 . 2 .]" 1
1299 1 44 TRP HZ2 1 83 VAL MG2 3.575 . 5.350 4.091 3.892 4.260 . 0 0 "[ . 1 . 2 .]" 1
1300 1 44 TRP HZ2 1 97 ILE MD 3.435 . 5.070 4.068 3.985 4.095 . 0 0 "[ . 1 . 2 .]" 1
1301 1 44 TRP HZ3 1 49 ALA MB 2.720 . 3.640 2.251 1.996 2.388 . 0 0 "[ . 1 . 2 .]" 1
1302 1 44 TRP HZ3 1 97 ILE MD 2.615 . 3.430 1.985 1.914 2.062 . 0 0 "[ . 1 . 2 .]" 1
1303 1 44 TRP HZ3 1 97 ILE MG 3.480 . 5.160 4.083 3.816 4.114 . 0 0 "[ . 1 . 2 .]" 1
1304 1 45 LYS H 1 46 ASP H 2.815 . 3.830 2.071 1.997 2.502 . 0 0 "[ . 1 . 2 .]" 1
1305 1 45 LYS HA 1 45 LYS QD 2.970 . 4.140 3.589 3.236 3.770 . 0 0 "[ . 1 . 2 .]" 1
1306 1 45 LYS HA 1 45 LYS HG2 2.610 . 3.420 2.588 2.071 3.437 0.017 15 0 "[ . 1 . 2 .]" 1
1307 1 45 LYS HA 1 45 LYS QG 2.515 . 3.230 2.145 2.039 2.397 . 0 0 "[ . 1 . 2 .]" 1
1308 1 45 LYS HA 1 45 LYS HG3 2.610 . 3.420 2.828 2.092 3.407 . 0 0 "[ . 1 . 2 .]" 1
1309 1 45 LYS QB 1 46 ASP H 2.820 . 3.840 2.960 2.879 3.525 . 0 0 "[ . 1 . 2 .]" 1
1310 1 45 LYS HB2 1 46 ASP H 3.030 . 4.260 3.364 2.955 3.866 . 0 0 "[ . 1 . 2 .]" 1
1311 1 45 LYS HB3 1 46 ASP H 3.030 . 4.260 3.465 2.996 4.145 . 0 0 "[ . 1 . 2 .]" 1
1312 1 45 LYS QG 1 46 ASP H 4.090 . 6.380 4.466 4.103 4.644 . 0 0 "[ . 1 . 2 .]" 1
1313 1 46 ASP H 1 50 ILE MD 4.055 . 6.310 3.995 3.394 4.077 . 0 0 "[ . 1 . 2 .]" 1
1314 1 46 ASP HA 1 47 GLY H 2.410 . 3.020 2.249 2.238 2.265 . 0 0 "[ . 1 . 2 .]" 1
1315 1 46 ASP HB2 1 49 ALA HA 3.480 . 5.160 5.206 5.202 5.210 0.050 7 0 "[ . 1 . 2 .]" 1
1316 1 46 ASP HB2 1 49 ALA MB 2.615 . 3.430 2.551 2.479 2.609 . 0 0 "[ . 1 . 2 .]" 1
1317 1 46 ASP HB3 1 47 GLY H 3.215 . 4.630 3.958 3.928 3.991 . 0 0 "[ . 1 . 2 .]" 1
1318 1 46 ASP HB3 1 49 ALA MB 2.675 . 3.550 2.717 2.593 2.834 . 0 0 "[ . 1 . 2 .]" 1
1319 1 46 ASP O 1 50 ILE H 1.950 . 2.200 2.219 2.164 2.233 0.033 18 0 "[ . 1 . 2 .]" 1
1320 1 46 ASP O 1 50 ILE N 2.950 2.700 3.200 3.100 3.049 3.118 . 0 0 "[ . 1 . 2 .]" 1
1321 1 47 GLY H 1 48 ASP H 2.675 . 3.550 2.694 2.683 2.712 . 0 0 "[ . 1 . 2 .]" 1
1322 1 47 GLY H 1 50 ILE MD 4.165 . 6.530 3.459 3.363 3.488 . 0 0 "[ . 1 . 2 .]" 1
1323 1 47 GLY HA2 1 48 ASP HA 3.280 . 4.760 4.796 4.792 4.799 0.039 1 0 "[ . 1 . 2 .]" 1
1324 1 47 GLY HA2 1 50 ILE H 3.224 . 4.534 2.830 2.819 2.852 . 0 0 "[ . 1 . 2 .]" 1
1325 1 47 GLY HA2 1 50 ILE HB 2.765 . 3.730 2.077 2.020 2.136 . 0 0 "[ . 1 . 2 .]" 1
1326 1 47 GLY HA2 1 50 ILE MD 2.955 . 4.110 1.859 1.845 1.874 . 0 0 "[ . 1 . 2 .]" 1
1327 1 47 GLY HA3 1 48 ASP H 2.690 . 3.580 3.076 3.070 3.080 . 0 0 "[ . 1 . 2 .]" 1
1328 1 47 GLY HA3 1 50 ILE H 3.170 . 4.540 4.155 4.144 4.176 . 0 0 "[ . 1 . 2 .]" 1
1329 1 47 GLY HA3 1 50 ILE HB 2.660 . 3.520 3.362 3.328 3.399 . 0 0 "[ . 1 . 2 .]" 1
1330 1 47 GLY HA3 1 50 ILE MD 2.675 . 3.550 2.946 2.933 2.968 . 0 0 "[ . 1 . 2 .]" 1
1331 1 47 GLY HA3 1 51 ALA H 3.140 . 4.480 4.534 4.521 4.545 0.065 5 0 "[ . 1 . 2 .]" 1
1332 1 48 ASP H 1 48 ASP HA 2.315 . 2.830 2.823 2.821 2.825 . 0 0 "[ . 1 . 2 .]" 1
1333 1 48 ASP H 1 48 ASP HB2 2.550 . 3.300 2.065 2.062 2.067 . 0 0 "[ . 1 . 2 .]" 1
1334 1 48 ASP H 1 48 ASP QB 2.365 . 2.930 2.046 2.043 2.048 . 0 0 "[ . 1 . 2 .]" 1
1335 1 48 ASP H 1 48 ASP HB3 2.550 . 3.300 3.337 3.327 3.346 0.046 13 0 "[ . 1 . 2 .]" 1
1336 1 48 ASP H 1 49 ALA H 2.675 . 3.550 2.503 2.497 2.506 . 0 0 "[ . 1 . 2 .]" 1
1337 1 48 ASP H 1 50 ILE H 3.435 . 5.070 3.739 3.727 3.749 . 0 0 "[ . 1 . 2 .]" 1
1338 1 48 ASP H 1 50 ILE MD 3.715 . 5.630 4.610 4.590 4.629 . 0 0 "[ . 1 . 2 .]" 1
1339 1 48 ASP H 1 51 ALA H 3.435 . 5.070 4.731 4.700 4.772 . 0 0 "[ . 1 . 2 .]" 1
1340 1 48 ASP HA 1 48 ASP HB2 2.380 . 2.960 2.910 2.904 2.915 . 0 0 "[ . 1 . 2 .]" 1
1341 1 48 ASP HA 1 48 ASP HB3 2.380 . 2.960 2.807 2.799 2.817 . 0 0 "[ . 1 . 2 .]" 1
1342 1 48 ASP HA 1 49 ALA HA 3.265 . 4.730 4.756 4.747 4.759 0.029 6 0 "[ . 1 . 2 .]" 1
1343 1 48 ASP HA 1 51 ALA H 3.015 . 4.230 3.614 3.568 3.717 . 0 0 "[ . 1 . 2 .]" 1
1344 1 48 ASP HA 1 52 GLU H 3.435 . 5.070 4.640 4.579 4.706 . 0 0 "[ . 1 . 2 .]" 1
1345 1 48 ASP QB 1 49 ALA HA 3.625 . 5.450 3.821 3.807 3.840 . 0 0 "[ . 1 . 2 .]" 1
1346 1 48 ASP QB 1 49 ALA MB 3.405 . 5.010 3.701 3.664 3.758 . 0 0 "[ . 1 . 2 .]" 1
1347 1 48 ASP HB2 1 49 ALA H 3.015 . 4.230 2.956 2.940 2.992 . 0 0 "[ . 1 . 2 .]" 1
1348 1 48 ASP HB2 1 49 ALA MB 3.635 . 5.470 4.302 4.246 4.373 . 0 0 "[ . 1 . 2 .]" 1
1349 1 48 ASP HB3 1 49 ALA H 3.015 . 4.230 3.037 3.009 3.061 . 0 0 "[ . 1 . 2 .]" 1
1350 1 48 ASP HB3 1 49 ALA MB 3.635 . 5.470 4.037 3.983 4.107 . 0 0 "[ . 1 . 2 .]" 1
1351 1 49 ALA H 1 49 ALA HA 2.365 . 2.930 2.850 2.844 2.863 . 0 0 "[ . 1 . 2 .]" 1
1352 1 49 ALA H 1 49 ALA MB 2.705 . 3.610 2.167 2.103 2.219 . 0 0 "[ . 1 . 2 .]" 1
1353 1 49 ALA H 1 50 ILE H 3.140 . 4.480 2.440 2.408 2.455 . 0 0 "[ . 1 . 2 .]" 1
1354 1 49 ALA HA 1 51 ALA H 3.230 . 4.660 4.604 4.589 4.627 . 0 0 "[ . 1 . 2 .]" 1
1355 1 49 ALA HA 1 52 GLU H 2.720 . 3.640 3.412 3.402 3.423 . 0 0 "[ . 1 . 2 .]" 1
1356 1 49 ALA HA 1 52 GLU HA 3.525 . 5.250 5.268 5.261 5.274 0.024 21 0 "[ . 1 . 2 .]" 1
1357 1 49 ALA HA 1 52 GLU HB2 3.015 . 4.230 2.711 2.686 2.739 . 0 0 "[ . 1 . 2 .]" 1
1358 1 49 ALA HA 1 52 GLU QB 2.760 . 3.720 2.679 2.655 2.706 . 0 0 "[ . 1 . 2 .]" 1
1359 1 49 ALA HA 1 52 GLU HB3 3.015 . 4.230 4.184 4.161 4.204 . 0 0 "[ . 1 . 2 .]" 1
1360 1 49 ALA HA 1 52 GLU HG2 2.830 . 3.860 3.512 3.263 3.769 . 0 0 "[ . 1 . 2 .]" 1
1361 1 49 ALA HA 1 52 GLU QG 2.695 . 3.590 2.488 2.328 2.614 . 0 0 "[ . 1 . 2 .]" 1
1362 1 49 ALA HA 1 52 GLU HG3 2.830 . 3.860 2.552 2.351 2.738 . 0 0 "[ . 1 . 2 .]" 1
1363 1 49 ALA HA 1 97 ILE MD 3.095 . 4.390 3.272 3.218 3.319 . 0 0 "[ . 1 . 2 .]" 1
1364 1 49 ALA HA 1 97 ILE MG 3.280 . 4.760 3.692 3.678 3.711 . 0 0 "[ . 1 . 2 .]" 1
1365 1 49 ALA MB 1 50 ILE H 2.785 . 3.770 2.694 2.650 2.734 . 0 0 "[ . 1 . 2 .]" 1
1366 1 49 ALA MB 1 50 ILE HA 3.280 . 4.760 3.832 3.777 3.894 . 0 0 "[ . 1 . 2 .]" 1
1367 1 49 ALA MB 1 52 GLU QB 3.610 . 5.420 3.746 3.736 3.767 . 0 0 "[ . 1 . 2 .]" 1
1368 1 49 ALA MB 1 52 GLU QG 3.625 . 5.450 3.901 3.838 3.948 . 0 0 "[ . 1 . 2 .]" 1
1369 1 49 ALA MB 1 73 TYR QD 5.080 . 8.360 4.736 4.215 5.047 . 0 0 "[ . 1 . 2 .]" 1
1370 1 49 ALA MB 1 83 VAL MG1 4.680 . 7.560 4.823 4.673 4.907 . 0 0 "[ . 1 . 2 .]" 1
1371 1 49 ALA MB 1 97 ILE MD 3.390 . 4.980 2.467 2.387 2.600 . 0 0 "[ . 1 . 2 .]" 1
1372 1 49 ALA MB 1 97 ILE MG 4.320 . 6.840 3.863 3.822 3.896 . 0 0 "[ . 1 . 2 .]" 1
1373 1 50 ILE H 1 50 ILE HB 2.440 . 3.080 2.360 2.336 2.385 . 0 0 "[ . 1 . 2 .]" 1
1374 1 50 ILE H 1 50 ILE MD 2.910 . 4.134 3.385 3.363 3.406 . 0 0 "[ . 1 . 2 .]" 1
1375 1 50 ILE HA 1 50 ILE HG12 2.830 . 3.860 2.658 2.641 2.679 . 0 0 "[ . 1 . 2 .]" 1
1376 1 50 ILE HA 1 50 ILE QG 2.745 . 3.690 2.368 2.351 2.385 . 0 0 "[ . 1 . 2 .]" 1
1377 1 50 ILE HA 1 50 ILE HG13 2.830 . 3.860 2.659 2.605 2.709 . 0 0 "[ . 1 . 2 .]" 1
1378 1 50 ILE HA 1 50 ILE MG 2.690 . 3.580 2.498 2.469 2.529 . 0 0 "[ . 1 . 2 .]" 1
1379 1 50 ILE HA 1 52 GLU H 3.030 . 4.260 4.056 4.000 4.107 . 0 0 "[ . 1 . 2 .]" 1
1380 1 50 ILE HA 1 53 MET QB 3.455 . 5.110 2.857 2.753 2.894 . 0 0 "[ . 1 . 2 .]" 1
1381 1 50 ILE HA 1 53 MET ME 4.165 . 6.530 5.344 5.285 5.370 . 0 0 "[ . 1 . 2 .]" 1
1382 1 50 ILE HA 1 54 THR H 3.224 . 4.534 4.041 3.998 4.084 . 0 0 "[ . 1 . 2 .]" 1
1383 1 50 ILE HB 1 50 ILE MD 2.615 . 3.430 2.203 2.183 2.237 . 0 0 "[ . 1 . 2 .]" 1
1384 1 50 ILE HB 1 51 ALA H 2.550 . 3.300 2.439 2.411 2.462 . 0 0 "[ . 1 . 2 .]" 1
1385 1 50 ILE MG 1 51 ALA H 3.000 . 4.200 3.059 3.028 3.087 . 0 0 "[ . 1 . 2 .]" 1
1386 1 50 ILE MG 1 51 ALA HA 3.000 . 4.200 3.299 3.278 3.327 . 0 0 "[ . 1 . 2 .]" 1
1387 1 50 ILE MG 1 51 ALA MB 4.245 . 6.690 3.784 3.745 3.827 . 0 0 "[ . 1 . 2 .]" 1
1388 1 50 ILE MG 1 52 GLU H 3.945 . 6.090 4.627 4.597 4.669 . 0 0 "[ . 1 . 2 .]" 1
1389 1 50 ILE MG 1 54 THR H 3.390 . 4.980 3.687 3.652 3.735 . 0 0 "[ . 1 . 2 .]" 1
1390 1 50 ILE MG 1 54 THR HA 4.165 . 6.530 5.184 5.128 5.250 . 0 0 "[ . 1 . 2 .]" 1
1391 1 50 ILE MG 1 54 THR MG 4.290 . 6.780 3.391 3.332 3.434 . 0 0 "[ . 1 . 2 .]" 1
1392 1 50 ILE O 1 54 THR H 1.950 . 2.200 1.960 1.921 1.986 . 0 0 "[ . 1 . 2 .]" 1
1393 1 50 ILE O 1 54 THR N 2.950 2.700 3.200 2.935 2.894 2.963 . 0 0 "[ . 1 . 2 .]" 1
1394 1 51 ALA H 1 51 ALA MB 2.615 . 3.430 2.158 2.089 2.234 . 0 0 "[ . 1 . 2 .]" 1
1395 1 51 ALA H 1 52 GLU H 2.350 . 2.900 2.726 2.710 2.735 . 0 0 "[ . 1 . 2 .]" 1
1396 1 51 ALA H 1 52 GLU QB 3.780 . 5.760 4.693 4.671 4.705 . 0 0 "[ . 1 . 2 .]" 1
1397 1 51 ALA H 1 54 THR H 3.650 . 5.500 4.952 4.913 4.991 . 0 0 "[ . 1 . 2 .]" 1
1398 1 51 ALA HA 1 54 THR H 2.780 . 3.760 3.718 3.646 3.767 0.007 14 0 "[ . 1 . 2 .]" 1
1399 1 51 ALA HA 1 54 THR MG 3.685 . 5.570 4.352 4.266 4.426 . 0 0 "[ . 1 . 2 .]" 1
1400 1 51 ALA MB 1 52 GLU H 2.705 . 3.610 2.818 2.743 2.872 . 0 0 "[ . 1 . 2 .]" 1
1401 1 51 ALA MB 1 52 GLU HA 3.435 . 5.070 3.856 3.796 3.901 . 0 0 "[ . 1 . 2 .]" 1
1402 1 51 ALA MB 1 52 GLU QG 3.580 . 5.360 3.381 3.281 3.490 . 0 0 "[ . 1 . 2 .]" 1
1403 1 51 ALA MB 1 54 THR H 4.055 . 6.310 4.907 4.850 4.950 . 0 0 "[ . 1 . 2 .]" 1
1404 1 52 GLU H 1 52 GLU HB2 2.750 . 3.700 2.368 2.356 2.382 . 0 0 "[ . 1 . 2 .]" 1
1405 1 52 GLU H 1 52 GLU QB 2.490 . 3.180 2.336 2.325 2.349 . 0 0 "[ . 1 . 2 .]" 1
1406 1 52 GLU H 1 52 GLU HB3 2.750 . 3.700 3.566 3.564 3.573 . 0 0 "[ . 1 . 2 .]" 1
1407 1 52 GLU H 1 52 GLU HG2 2.690 . 3.580 2.523 2.409 2.671 . 0 0 "[ . 1 . 2 .]" 1
1408 1 52 GLU H 1 52 GLU QG 2.585 . 3.370 2.452 2.370 2.522 . 0 0 "[ . 1 . 2 .]" 1
1409 1 52 GLU H 1 52 GLU HG3 2.690 . 3.580 3.374 3.098 3.561 . 0 0 "[ . 1 . 2 .]" 1
1410 1 52 GLU H 1 53 MET QB 3.515 . 5.230 4.252 4.192 4.277 . 0 0 "[ . 1 . 2 .]" 1
1411 1 52 GLU H 1 54 THR H 3.230 . 4.660 4.198 4.174 4.225 . 0 0 "[ . 1 . 2 .]" 1
1412 1 52 GLU H 1 97 ILE MG 3.450 . 5.100 3.826 3.805 3.855 . 0 0 "[ . 1 . 2 .]" 1
1413 1 52 GLU HA 1 52 GLU HG2 2.815 . 3.830 2.614 2.436 2.771 . 0 0 "[ . 1 . 2 .]" 1
1414 1 52 GLU HA 1 52 GLU QG 2.605 . 3.410 2.565 2.403 2.702 . 0 0 "[ . 1 . 2 .]" 1
1415 1 52 GLU HA 1 52 GLU HG3 2.815 . 3.830 3.728 3.670 3.750 . 0 0 "[ . 1 . 2 .]" 1
1416 1 52 GLU HA 1 97 ILE MG 3.125 . 4.450 3.577 3.558 3.600 . 0 0 "[ . 1 . 2 .]" 1
1417 1 52 GLU QB 1 97 ILE MD 2.910 . 4.134 2.826 2.760 2.864 . 0 0 "[ . 1 . 2 .]" 1
1418 1 52 GLU QB 1 97 ILE QG 4.530 . 7.260 4.190 4.173 4.237 . 0 0 "[ . 1 . 2 .]" 1
1419 1 52 GLU HB2 1 97 ILE MD 3.250 . 4.700 2.933 2.861 2.977 . 0 0 "[ . 1 . 2 .]" 1
1420 1 52 GLU HB2 1 97 ILE MG 2.645 . 3.490 1.930 1.918 1.945 . 0 0 "[ . 1 . 2 .]" 1
1421 1 52 GLU HB3 1 97 ILE MD 3.250 . 4.700 3.693 3.628 3.739 . 0 0 "[ . 1 . 2 .]" 1
1422 1 52 GLU HB3 1 97 ILE MG 2.645 . 3.490 1.829 1.825 1.837 . 0 0 "[ . 1 . 2 .]" 1
1423 1 52 GLU QG 1 97 ILE MD 3.920 . 6.040 3.959 3.892 4.033 . 0 0 "[ . 1 . 2 .]" 1
1424 1 52 GLU O 1 56 GLN H 1.950 . 2.200 2.293 2.278 2.310 0.110 25 0 "[ . 1 . 2 .]" 1
1425 1 52 GLU O 1 56 GLN N 2.950 2.700 3.200 3.170 3.151 3.192 . 0 0 "[ . 1 . 2 .]" 1
1426 1 53 MET HA 1 53 MET ME 2.785 . 3.770 2.810 2.716 3.048 . 0 0 "[ . 1 . 2 .]" 1
1427 1 53 MET HA 1 57 LEU MD1 3.530 . 5.260 3.718 3.677 3.853 . 0 0 "[ . 1 . 2 .]" 1
1428 1 53 MET HA 1 83 VAL MG2 3.980 . 6.160 4.960 4.900 5.034 . 0 0 "[ . 1 . 2 .]" 1
1429 1 53 MET HA 1 97 ILE MD 3.310 . 4.820 3.738 3.512 3.822 . 0 0 "[ . 1 . 2 .]" 1
1430 1 53 MET HA 1 97 ILE MG 2.770 . 3.740 1.965 1.948 1.997 . 0 0 "[ . 1 . 2 .]" 1
1431 1 53 MET QB 1 53 MET ME 2.845 . 3.890 1.980 1.924 2.043 . 0 0 "[ . 1 . 2 .]" 1
1432 1 53 MET QB 1 54 THR MG 4.090 . 6.380 4.183 4.094 4.236 . 0 0 "[ . 1 . 2 .]" 1
1433 1 53 MET QB 1 57 LEU MD2 3.860 . 5.920 3.915 3.674 3.968 . 0 0 "[ . 1 . 2 .]" 1
1434 1 53 MET QB 1 83 VAL MG1 3.830 . 5.860 4.097 4.014 4.194 . 0 0 "[ . 1 . 2 .]" 1
1435 1 53 MET QB 1 83 VAL MG2 4.540 . 7.280 4.643 4.519 4.902 . 0 0 "[ . 1 . 2 .]" 1
1436 1 53 MET QB 1 97 ILE MD 3.130 . 4.460 2.607 2.574 2.713 . 0 0 "[ . 1 . 2 .]" 1
1437 1 53 MET QB 1 97 ILE MG 3.240 . 4.680 3.020 2.980 3.128 . 0 0 "[ . 1 . 2 .]" 1
1438 1 53 MET HB2 1 53 MET ME 3.140 . 4.480 3.365 3.322 3.387 . 0 0 "[ . 1 . 2 .]" 1
1439 1 53 MET HB2 1 54 THR H 2.625 . 3.450 3.013 2.991 3.039 . 0 0 "[ . 1 . 2 .]" 1
1440 1 53 MET HB2 1 97 ILE MD 3.480 . 5.160 2.641 2.605 2.755 . 0 0 "[ . 1 . 2 .]" 1
1441 1 53 MET HB2 1 97 ILE MG 3.465 . 5.130 3.128 3.082 3.251 . 0 0 "[ . 1 . 2 .]" 1
1442 1 53 MET HB3 1 53 MET ME 3.140 . 4.480 1.994 1.935 2.060 . 0 0 "[ . 1 . 2 .]" 1
1443 1 53 MET HB3 1 54 THR H 2.625 . 3.450 2.687 2.654 2.721 . 0 0 "[ . 1 . 2 .]" 1
1444 1 53 MET HB3 1 97 ILE MD 3.480 . 5.160 4.022 4.004 4.070 . 0 0 "[ . 1 . 2 .]" 1
1445 1 53 MET HB3 1 97 ILE MG 3.465 . 5.130 3.982 3.937 4.065 . 0 0 "[ . 1 . 2 .]" 1
1446 1 53 MET ME 1 56 GLN HG2 3.960 . 6.120 4.623 4.442 4.856 . 0 0 "[ . 1 . 2 .]" 1
1447 1 53 MET ME 1 56 GLN QG 3.775 . 5.750 4.075 3.994 4.202 . 0 0 "[ . 1 . 2 .]" 1
1448 1 53 MET ME 1 56 GLN HG3 3.960 . 6.120 4.559 4.252 4.792 . 0 0 "[ . 1 . 2 .]" 1
1449 1 53 MET ME 1 57 LEU HB2 3.605 . 5.410 3.913 3.750 3.963 . 0 0 "[ . 1 . 2 .]" 1
1450 1 53 MET ME 1 57 LEU MD1 3.130 . 4.460 1.719 1.687 1.767 0.113 6 0 "[ . 1 . 2 .]" 1
1451 1 53 MET ME 1 57 LEU MD2 3.470 . 5.140 2.246 2.156 2.329 . 0 0 "[ . 1 . 2 .]" 1
1452 1 53 MET ME 1 57 LEU HG 3.224 . 4.534 3.700 3.651 3.737 . 0 0 "[ . 1 . 2 .]" 1
1453 1 53 MET ME 1 71 ILE MD 3.205 . 4.610 2.260 2.151 2.334 . 0 0 "[ . 1 . 2 .]" 1
1454 1 53 MET ME 1 71 ILE QG 3.800 . 5.800 3.638 3.527 3.753 . 0 0 "[ . 1 . 2 .]" 1
1455 1 53 MET ME 1 100 PHE QB 3.860 . 5.920 3.532 3.408 3.894 . 0 0 "[ . 1 . 2 .]" 1
1456 1 53 MET ME 1 100 PHE QD 3.875 . 5.950 3.116 3.006 3.491 . 0 0 "[ . 1 . 2 .]" 1
1457 1 53 MET ME 1 100 PHE QE 3.815 . 5.830 2.704 2.558 3.002 . 0 0 "[ . 1 . 2 .]" 1
1458 1 53 MET ME 1 100 PHE HZ 2.940 . 4.080 3.010 2.916 3.054 . 0 0 "[ . 1 . 2 .]" 1
1459 1 53 MET QG 1 56 GLN HG2 4.090 . 6.380 4.498 4.255 5.036 . 0 0 "[ . 1 . 2 .]" 1
1460 1 53 MET QG 1 56 GLN HG3 4.090 . 6.380 4.191 3.891 5.036 . 0 0 "[ . 1 . 2 .]" 1
1461 1 53 MET QG 1 57 LEU MD1 4.525 . 7.250 3.928 3.869 4.422 . 0 0 "[ . 1 . 2 .]" 1
1462 1 53 MET QG 1 97 ILE MD 4.290 . 6.780 2.084 1.958 2.220 . 0 0 "[ . 1 . 2 .]" 1
1463 1 53 MET QG 1 97 ILE MG 3.440 . 5.080 2.391 2.313 2.475 . 0 0 "[ . 1 . 2 .]" 1
1464 1 53 MET O 1 57 LEU H 1.950 . 2.200 2.246 2.221 2.275 0.075 9 0 "[ . 1 . 2 .]" 1
1465 1 53 MET O 1 57 LEU N 2.950 2.700 3.200 3.155 3.125 3.199 . 0 0 "[ . 1 . 2 .]" 1
1466 1 54 THR H 1 54 THR HB 2.520 . 3.240 3.287 3.254 3.305 0.065 16 0 "[ . 1 . 2 .]" 1
1467 1 54 THR H 1 54 THR MG 3.050 . 4.300 3.318 3.287 3.370 . 0 0 "[ . 1 . 2 .]" 1
1468 1 54 THR H 1 55 GLY H 2.565 . 3.330 2.672 2.641 2.694 . 0 0 "[ . 1 . 2 .]" 1
1469 1 54 THR H 1 56 GLN H 3.230 . 4.660 4.314 4.267 4.373 . 0 0 "[ . 1 . 2 .]" 1
1470 1 54 THR H 1 57 LEU MD1 3.915 . 6.144 4.352 4.268 4.630 . 0 0 "[ . 1 . 2 .]" 1
1471 1 54 THR HA 1 54 THR HB 2.365 . 2.930 2.859 2.844 2.879 . 0 0 "[ . 1 . 2 .]" 1
1472 1 54 THR HA 1 54 THR MG 2.615 . 3.430 2.003 1.996 2.009 . 0 0 "[ . 1 . 2 .]" 1
1473 1 54 THR HA 1 56 GLN H 3.090 . 4.380 4.262 4.204 4.350 . 0 0 "[ . 1 . 2 .]" 1
1474 1 54 THR HA 1 57 LEU H 2.765 . 3.730 3.195 3.137 3.276 . 0 0 "[ . 1 . 2 .]" 1
1475 1 54 THR HA 1 57 LEU MD2 3.825 . 5.850 2.487 2.249 2.598 . 0 0 "[ . 1 . 2 .]" 1
1476 1 54 THR HB 1 55 GLY H 2.490 . 3.180 3.147 3.112 3.183 0.003 9 0 "[ . 1 . 2 .]" 1
1477 1 54 THR HB 1 57 LEU HB2 3.650 . 5.500 4.588 4.482 4.667 . 0 0 "[ . 1 . 2 .]" 1
1478 1 54 THR HB 1 58 ALA MB 3.980 . 6.160 4.461 4.310 4.595 . 0 0 "[ . 1 . 2 .]" 1
1479 1 54 THR MG 1 55 GLY H 3.605 . 5.410 4.265 4.256 4.273 . 0 0 "[ . 1 . 2 .]" 1
1480 1 54 THR MG 1 55 GLY QA 4.605 . 7.410 4.746 4.702 4.789 . 0 0 "[ . 1 . 2 .]" 1
1481 1 54 THR MG 1 57 LEU HB2 3.620 . 5.440 3.215 3.140 3.308 . 0 0 "[ . 1 . 2 .]" 1
1482 1 54 THR MG 1 57 LEU MD1 4.680 . 7.560 4.155 4.090 4.371 . 0 0 "[ . 1 . 2 .]" 1
1483 1 54 THR MG 1 57 LEU MD2 3.780 . 5.760 2.779 2.666 2.922 . 0 0 "[ . 1 . 2 .]" 1
1484 1 54 THR MG 1 71 ILE MD 4.680 . 7.560 5.235 5.227 5.246 . 0 0 "[ . 1 . 2 .]" 1
1485 1 54 THR O 1 58 ALA H 1.950 . 2.200 2.130 2.033 2.207 0.007 18 0 "[ . 1 . 2 .]" 1
1486 1 54 THR O 1 58 ALA N 2.950 2.700 3.200 2.908 2.821 2.990 . 0 0 "[ . 1 . 2 .]" 1
1487 1 55 GLY H 1 56 GLN H 2.595 . 3.390 2.699 2.670 2.726 . 0 0 "[ . 1 . 2 .]" 1
1488 1 55 GLY H 1 58 ALA MB 4.150 . 6.500 4.756 4.679 4.873 . 0 0 "[ . 1 . 2 .]" 1
1489 1 55 GLY QA 1 57 LEU H 3.515 . 5.230 3.975 3.910 4.019 . 0 0 "[ . 1 . 2 .]" 1
1490 1 55 GLY QA 1 58 ALA H 3.330 . 4.860 3.318 3.257 3.393 . 0 0 "[ . 1 . 2 .]" 1
1491 1 55 GLY QA 1 58 ALA MB 3.285 . 4.770 2.669 2.516 2.799 . 0 0 "[ . 1 . 2 .]" 1
1492 1 56 GLN H 1 56 GLN QE 4.085 . 6.370 4.004 2.664 4.742 . 0 0 "[ . 1 . 2 .]" 1
1493 1 56 GLN H 1 56 GLN HG2 2.985 . 4.170 2.005 1.983 2.031 . 0 0 "[ . 1 . 2 .]" 1
1494 1 56 GLN H 1 56 GLN QG 2.785 . 3.770 1.993 1.968 2.020 . 0 0 "[ . 1 . 2 .]" 1
1495 1 56 GLN H 1 56 GLN HG3 2.985 . 4.170 3.486 3.291 3.576 . 0 0 "[ . 1 . 2 .]" 1
1496 1 56 GLN H 1 57 LEU H 2.395 . 2.990 2.593 2.552 2.648 . 0 0 "[ . 1 . 2 .]" 1
1497 1 56 GLN H 1 57 LEU MD1 3.480 . 5.160 3.739 3.675 3.777 . 0 0 "[ . 1 . 2 .]" 1
1498 1 56 GLN H 1 58 ALA MB 4.085 . 6.370 4.782 4.715 4.832 . 0 0 "[ . 1 . 2 .]" 1
1499 1 56 GLN H 1 97 ILE MG 4.229 . 6.544 4.325 4.281 4.373 . 0 0 "[ . 1 . 2 .]" 1
1500 1 56 GLN HA 1 58 ALA MB 3.930 . 6.060 4.779 4.692 4.878 . 0 0 "[ . 1 . 2 .]" 1
1501 1 56 GLN HA 1 59 GLU H 2.875 . 3.950 3.534 3.494 3.592 . 0 0 "[ . 1 . 2 .]" 1
1502 1 56 GLN HA 1 59 GLU HB3 3.015 . 4.230 4.241 4.214 4.258 0.028 10 0 "[ . 1 . 2 .]" 1
1503 1 56 GLN HA 1 59 GLU HG2 2.505 . 3.210 2.068 2.044 2.110 . 0 0 "[ . 1 . 2 .]" 1
1504 1 56 GLN HA 1 59 GLU QG 2.375 . 2.950 2.042 2.019 2.083 . 0 0 "[ . 1 . 2 .]" 1
1505 1 56 GLN HA 1 59 GLU HG3 2.505 . 3.210 3.149 3.100 3.218 0.008 25 0 "[ . 1 . 2 .]" 1
1506 1 56 GLN HA 1 101 ALA H 3.125 . 4.450 4.292 4.216 4.391 . 0 0 "[ . 1 . 2 .]" 1
1507 1 56 GLN HA 1 101 ALA MB 2.985 . 4.170 3.275 3.210 3.324 . 0 0 "[ . 1 . 2 .]" 1
1508 1 56 GLN QB 1 57 LEU MD1 4.430 . 7.060 2.458 2.423 2.486 . 0 0 "[ . 1 . 2 .]" 1
1509 1 56 GLN QB 1 100 PHE H 3.965 . 6.130 3.549 3.419 3.666 . 0 0 "[ . 1 . 2 .]" 1
1510 1 56 GLN QB 1 101 ALA H 3.730 . 5.660 2.218 2.117 2.358 . 0 0 "[ . 1 . 2 .]" 1
1511 1 56 GLN QB 1 101 ALA MB 3.410 . 5.020 2.554 2.379 2.702 . 0 0 "[ . 1 . 2 .]" 1
1512 1 56 GLN QE 1 101 ALA MB 4.225 . 6.650 3.842 2.586 4.807 . 0 0 "[ . 1 . 2 .]" 1
1513 1 56 GLN QG 1 97 ILE HA 3.795 . 5.790 3.111 2.934 3.268 . 0 0 "[ . 1 . 2 .]" 1
1514 1 56 GLN QG 1 97 ILE MG 3.365 . 4.930 2.870 2.803 2.936 . 0 0 "[ . 1 . 2 .]" 1
1515 1 56 GLN QG 1 100 PHE H 3.890 . 5.980 2.773 2.604 3.052 . 0 0 "[ . 1 . 2 .]" 1
1516 1 56 GLN QG 1 101 ALA H 3.440 . 5.080 3.442 3.208 3.683 . 0 0 "[ . 1 . 2 .]" 1
1517 1 56 GLN HG2 1 97 ILE MG 3.495 . 5.190 3.210 3.065 3.458 . 0 0 "[ . 1 . 2 .]" 1
1518 1 56 GLN HG3 1 97 ILE MG 3.495 . 5.190 3.260 3.027 3.389 . 0 0 "[ . 1 . 2 .]" 1
1519 1 56 GLN O 1 60 LEU H 1.950 . 2.200 1.951 1.864 2.070 . 0 0 "[ . 1 . 2 .]" 1
1520 1 56 GLN O 1 60 LEU N 2.950 2.700 3.200 2.914 2.832 3.019 . 0 0 "[ . 1 . 2 .]" 1
1521 1 57 LEU H 1 57 LEU HA 2.315 . 2.830 2.835 2.823 2.850 0.020 25 0 "[ . 1 . 2 .]" 1
1522 1 57 LEU H 1 57 LEU MD1 2.770 . 3.740 2.189 2.020 2.253 . 0 0 "[ . 1 . 2 .]" 1
1523 1 57 LEU H 1 57 LEU MD2 3.280 . 4.760 3.686 3.506 3.740 . 0 0 "[ . 1 . 2 .]" 1
1524 1 57 LEU H 1 58 ALA H 3.125 . 4.450 2.574 2.519 2.614 . 0 0 "[ . 1 . 2 .]" 1
1525 1 57 LEU H 1 58 ALA MB 3.575 . 5.350 4.245 4.163 4.301 . 0 0 "[ . 1 . 2 .]" 1
1526 1 57 LEU H 1 60 LEU H 3.295 . 4.790 4.801 4.766 4.819 0.029 3 0 "[ . 1 . 2 .]" 1
1527 1 57 LEU H 1 65 LEU QD 4.610 . 7.420 4.383 4.284 4.553 . 0 0 "[ . 1 . 2 .]" 1
1528 1 57 LEU HA 1 57 LEU MD1 2.615 . 3.430 2.280 2.230 2.312 . 0 0 "[ . 1 . 2 .]" 1
1529 1 57 LEU HA 1 57 LEU MD2 3.310 . 4.820 3.829 3.820 3.851 . 0 0 "[ . 1 . 2 .]" 1
1530 1 57 LEU HA 1 58 ALA H 2.690 . 3.580 3.479 3.471 3.486 . 0 0 "[ . 1 . 2 .]" 1
1531 1 57 LEU HA 1 60 LEU H 2.625 . 3.450 3.391 3.316 3.450 . 0 0 "[ . 1 . 2 .]" 1
1532 1 57 LEU HA 1 60 LEU QB 3.765 . 5.730 3.466 3.070 3.753 . 0 0 "[ . 1 . 2 .]" 1
1533 1 57 LEU HA 1 60 LEU MD1 3.465 . 5.130 3.318 3.272 3.364 . 0 0 "[ . 1 . 2 .]" 1
1534 1 57 LEU HA 1 60 LEU QD 3.214 . 4.514 1.923 1.842 1.986 0.072 23 0 "[ . 1 . 2 .]" 1
1535 1 57 LEU HA 1 60 LEU MD2 3.465 . 5.130 1.936 1.852 2.003 . 0 0 "[ . 1 . 2 .]" 1
1536 1 57 LEU HA 1 60 LEU HG 3.650 . 5.500 3.072 2.036 4.595 . 0 0 "[ . 1 . 2 .]" 1
1537 1 57 LEU HA 1 65 LEU QD 4.190 . 6.580 2.417 2.234 2.694 . 0 0 "[ . 1 . 2 .]" 1
1538 1 57 LEU HB2 1 58 ALA H 2.815 . 3.830 3.041 2.997 3.083 . 0 0 "[ . 1 . 2 .]" 1
1539 1 57 LEU HB2 1 65 LEU QD 4.780 . 7.760 3.345 3.282 3.450 . 0 0 "[ . 1 . 2 .]" 1
1540 1 57 LEU HB3 1 57 LEU MD1 2.785 . 3.770 3.197 3.190 3.199 . 0 0 "[ . 1 . 2 .]" 1
1541 1 57 LEU HB3 1 58 ALA H 2.800 . 3.800 3.663 3.630 3.695 . 0 0 "[ . 1 . 2 .]" 1
1542 1 57 LEU HB3 1 58 ALA MB 3.915 . 6.144 4.633 4.601 4.666 . 0 0 "[ . 1 . 2 .]" 1
1543 1 57 LEU HB3 1 65 LEU QD 4.235 . 6.670 1.931 1.909 1.956 . 0 0 "[ . 1 . 2 .]" 1
1544 1 57 LEU MD1 1 59 GLU H 4.165 . 6.530 5.038 4.964 5.092 . 0 0 "[ . 1 . 2 .]" 1
1545 1 57 LEU MD1 1 60 LEU H 4.025 . 6.250 4.825 4.733 4.880 . 0 0 "[ . 1 . 2 .]" 1
1546 1 57 LEU MD1 1 60 LEU MD1 4.305 . 6.810 3.680 3.012 4.083 . 0 0 "[ . 1 . 2 .]" 1
1547 1 57 LEU MD1 1 60 LEU QD 3.945 . 6.090 2.379 1.903 2.850 . 0 0 "[ . 1 . 2 .]" 1
1548 1 57 LEU MD1 1 60 LEU MD2 4.305 . 6.810 2.481 1.909 3.113 . 0 0 "[ . 1 . 2 .]" 1
1549 1 57 LEU MD1 1 65 LEU HA 4.070 . 6.340 4.462 4.312 4.601 . 0 0 "[ . 1 . 2 .]" 1
1550 1 57 LEU MD1 1 65 LEU QB 4.060 . 6.320 3.243 2.984 3.450 . 0 0 "[ . 1 . 2 .]" 1
1551 1 57 LEU MD1 1 65 LEU QD 4.410 . 7.020 3.507 3.313 3.738 . 0 0 "[ . 1 . 2 .]" 1
1552 1 57 LEU MD1 1 71 ILE MD 4.180 . 6.560 3.471 3.386 3.546 . 0 0 "[ . 1 . 2 .]" 1
1553 1 57 LEU MD1 1 100 PHE QD 4.405 . 7.010 2.724 2.240 2.828 . 0 0 "[ . 1 . 2 .]" 1
1554 1 57 LEU MD1 1 100 PHE QE 3.845 . 5.890 2.555 2.135 2.655 . 0 0 "[ . 1 . 2 .]" 1
1555 1 57 LEU MD1 1 100 PHE HZ 3.015 . 4.230 3.140 3.094 3.183 . 0 0 "[ . 1 . 2 .]" 1
1556 1 57 LEU MD1 1 101 ALA MB 4.680 . 7.560 4.258 4.165 4.341 . 0 0 "[ . 1 . 2 .]" 1
1557 1 57 LEU MD2 1 58 ALA H 4.165 . 6.530 4.845 4.760 4.890 . 0 0 "[ . 1 . 2 .]" 1
1558 1 57 LEU MD2 1 60 LEU MD1 4.680 . 7.560 4.820 4.705 4.968 . 0 0 "[ . 1 . 2 .]" 1
1559 1 57 LEU MD2 1 60 LEU QD 4.235 . 6.670 3.787 3.683 3.939 . 0 0 "[ . 1 . 2 .]" 1
1560 1 57 LEU MD2 1 60 LEU MD2 4.680 . 7.560 3.960 3.847 4.145 . 0 0 "[ . 1 . 2 .]" 1
1561 1 57 LEU MD2 1 65 LEU QB 3.640 . 5.480 2.688 2.578 3.023 . 0 0 "[ . 1 . 2 .]" 1
1562 1 57 LEU MD2 1 65 LEU MD1 3.840 . 5.880 3.024 2.546 3.472 . 0 0 "[ . 1 . 2 .]" 1
1563 1 57 LEU MD2 1 65 LEU MD2 3.840 . 5.880 3.241 3.150 3.403 . 0 0 "[ . 1 . 2 .]" 1
1564 1 57 LEU MD2 1 71 ILE MD 3.640 . 5.480 2.753 2.648 2.868 . 0 0 "[ . 1 . 2 .]" 1
1565 1 57 LEU MD2 1 100 PHE QE 4.930 . 8.060 3.969 3.754 4.027 . 0 0 "[ . 1 . 2 .]" 1
1566 1 57 LEU HG 1 58 ALA H 3.650 . 5.500 5.289 5.272 5.326 . 0 0 "[ . 1 . 2 .]" 1
1567 1 57 LEU HG 1 60 LEU QD 4.560 . 7.320 2.595 2.421 2.870 . 0 0 "[ . 1 . 2 .]" 1
1568 1 58 ALA H 1 59 GLU H 2.550 . 3.300 2.530 2.499 2.565 . 0 0 "[ . 1 . 2 .]" 1
1569 1 58 ALA H 1 59 GLU HB3 3.385 . 4.970 5.011 5.002 5.026 0.056 22 0 "[ . 1 . 2 .]" 1
1570 1 58 ALA H 1 60 LEU H 3.465 . 5.130 4.174 4.136 4.224 . 0 0 "[ . 1 . 2 .]" 1
1571 1 58 ALA H 1 65 LEU QD 4.560 . 7.320 4.192 4.154 4.250 . 0 0 "[ . 1 . 2 .]" 1
1572 1 58 ALA HA 1 59 GLU H 2.675 . 3.550 3.445 3.435 3.458 . 0 0 "[ . 1 . 2 .]" 1
1573 1 58 ALA MB 1 59 GLU H 2.755 . 3.710 3.002 2.933 3.048 . 0 0 "[ . 1 . 2 .]" 1
1574 1 58 ALA MB 1 59 GLU HA 3.360 . 4.920 3.988 3.937 4.013 . 0 0 "[ . 1 . 2 .]" 1
1575 1 58 ALA MB 1 59 GLU QG 3.935 . 6.070 3.905 3.869 3.958 . 0 0 "[ . 1 . 2 .]" 1
1576 1 58 ALA MB 1 65 LEU QD 5.465 . 9.130 4.519 4.466 4.553 . 0 0 "[ . 1 . 2 .]" 1
1577 1 59 GLU H 1 59 GLU HB2 2.765 . 3.730 3.648 3.636 3.659 . 0 0 "[ . 1 . 2 .]" 1
1578 1 59 GLU H 1 59 GLU HB3 2.410 . 3.020 2.932 2.900 2.951 . 0 0 "[ . 1 . 2 .]" 1
1579 1 59 GLU H 1 59 GLU HG2 2.580 . 3.360 2.008 1.990 2.045 . 0 0 "[ . 1 . 2 .]" 1
1580 1 59 GLU H 1 59 GLU HG3 2.580 . 3.360 2.782 2.761 2.831 . 0 0 "[ . 1 . 2 .]" 1
1581 1 59 GLU H 1 60 LEU H 2.425 . 3.050 2.212 2.189 2.260 . 0 0 "[ . 1 . 2 .]" 1
1582 1 59 GLU H 1 60 LEU QB 3.670 . 5.540 4.155 3.899 4.332 . 0 0 "[ . 1 . 2 .]" 1
1583 1 59 GLU HA 1 59 GLU HB2 2.410 . 3.020 2.487 2.482 2.493 . 0 0 "[ . 1 . 2 .]" 1
1584 1 59 GLU HA 1 59 GLU HB3 2.365 . 2.930 2.394 2.392 2.399 . 0 0 "[ . 1 . 2 .]" 1
1585 1 59 GLU HA 1 59 GLU HG2 2.735 . 3.670 3.731 3.726 3.740 0.070 18 0 "[ . 1 . 2 .]" 1
1586 1 59 GLU HA 1 59 GLU HG3 2.735 . 3.670 3.715 3.709 3.722 0.052 5 0 "[ . 1 . 2 .]" 1
1587 1 59 GLU HB2 1 60 LEU H 2.705 . 3.610 3.635 3.629 3.644 0.034 13 0 "[ . 1 . 2 .]" 1
1588 1 59 GLU HB2 1 101 ALA MB 3.730 . 5.660 4.202 4.088 4.343 . 0 0 "[ . 1 . 2 .]" 1
1589 1 59 GLU QG 1 60 LEU H 3.750 . 5.700 1.957 1.951 1.961 . 0 0 "[ . 1 . 2 .]" 1
1590 1 59 GLU QG 1 60 LEU QD 5.235 . 8.670 3.628 3.474 3.818 . 0 0 "[ . 1 . 2 .]" 1
1591 1 59 GLU QG 1 101 ALA MB 2.860 . 3.920 2.370 2.260 2.486 . 0 0 "[ . 1 . 2 .]" 1
1592 1 59 GLU HG2 1 101 ALA MB 3.095 . 4.390 3.380 3.308 3.468 . 0 0 "[ . 1 . 2 .]" 1
1593 1 59 GLU HG3 1 101 ALA MB 3.095 . 4.390 2.420 2.300 2.547 . 0 0 "[ . 1 . 2 .]" 1
1594 1 60 LEU H 1 60 LEU MD1 3.360 . 4.920 3.984 3.909 4.099 . 0 0 "[ . 1 . 2 .]" 1
1595 1 60 LEU H 1 60 LEU QD 3.160 . 4.520 2.882 2.645 3.041 . 0 0 "[ . 1 . 2 .]" 1
1596 1 60 LEU H 1 60 LEU MD2 3.360 . 4.920 2.969 2.680 3.166 . 0 0 "[ . 1 . 2 .]" 1
1597 1 60 LEU H 1 61 PRO QD 4.090 . 6.380 4.422 4.416 4.429 . 0 0 "[ . 1 . 2 .]" 1
1598 1 60 LEU H 1 101 ALA MB 3.000 . 4.200 3.041 2.825 3.201 . 0 0 "[ . 1 . 2 .]" 1
1599 1 60 LEU HA 1 60 LEU MD1 3.420 . 5.040 3.662 3.418 4.014 . 0 0 "[ . 1 . 2 .]" 1
1600 1 60 LEU HA 1 60 LEU MD2 3.420 . 5.040 3.873 3.517 4.112 . 0 0 "[ . 1 . 2 .]" 1
1601 1 60 LEU HA 1 61 PRO HD2 2.285 . 2.770 2.811 2.797 2.819 0.049 16 0 "[ . 1 . 2 .]" 1
1602 1 60 LEU HA 1 61 PRO HD3 2.285 . 2.770 2.116 2.090 2.141 . 0 0 "[ . 1 . 2 .]" 1
1603 1 60 LEU QB 1 61 PRO QD 3.455 . 5.110 2.251 2.033 2.575 . 0 0 "[ . 1 . 2 .]" 1
1604 1 60 LEU QB 1 61 PRO QG 4.030 . 6.260 4.157 3.974 4.432 . 0 0 "[ . 1 . 2 .]" 1
1605 1 60 LEU QB 1 65 LEU QD 5.170 . 8.540 4.154 4.038 4.244 . 0 0 "[ . 1 . 2 .]" 1
1606 1 60 LEU QB 1 101 ALA HA 3.130 . 4.460 2.416 2.120 2.538 . 0 0 "[ . 1 . 2 .]" 1
1607 1 60 LEU QB 1 101 ALA MB 3.085 . 4.370 1.810 1.707 1.896 0.093 15 0 "[ . 1 . 2 .]" 1
1608 1 60 LEU HB2 1 61 PRO HD2 3.985 . 6.170 2.347 2.084 2.744 . 0 0 "[ . 1 . 2 .]" 1
1609 1 60 LEU HB2 1 61 PRO HD3 3.985 . 6.170 3.121 2.988 3.316 . 0 0 "[ . 1 . 2 .]" 1
1610 1 60 LEU HB3 1 61 PRO HD2 3.985 . 6.170 3.869 3.739 4.063 . 0 0 "[ . 1 . 2 .]" 1
1611 1 60 LEU HB3 1 61 PRO HD3 3.985 . 6.170 4.289 4.130 4.518 . 0 0 "[ . 1 . 2 .]" 1
1612 1 60 LEU QD 1 61 PRO QB 4.265 . 6.730 3.328 3.017 3.777 . 0 0 "[ . 1 . 2 .]" 1
1613 1 60 LEU QD 1 61 PRO QD 3.610 . 5.420 2.517 2.207 2.954 . 0 0 "[ . 1 . 2 .]" 1
1614 1 60 LEU QD 1 61 PRO QG 4.240 . 6.680 3.812 3.568 4.162 . 0 0 "[ . 1 . 2 .]" 1
1615 1 60 LEU QD 1 64 VAL HB 3.630 . 5.460 2.137 1.857 2.676 . 0 0 "[ . 1 . 2 .]" 1
1616 1 60 LEU QD 1 65 LEU QB 4.490 . 7.180 1.803 1.782 1.844 0.018 23 0 "[ . 1 . 2 .]" 1
1617 1 60 LEU QD 1 65 LEU QD 5.010 . 8.220 2.062 1.817 2.271 . 0 0 "[ . 1 . 2 .]" 1
1618 1 60 LEU QD 1 100 PHE QD 4.585 . 7.370 2.220 2.067 2.365 . 0 0 "[ . 1 . 2 .]" 1
1619 1 60 LEU QD 1 100 PHE QE 4.415 . 7.030 2.458 2.279 2.584 . 0 0 "[ . 1 . 2 .]" 1
1620 1 60 LEU QD 1 100 PHE HZ 4.455 . 7.110 4.310 4.187 4.441 . 0 0 "[ . 1 . 2 .]" 1
1621 1 60 LEU QD 1 101 ALA HA 3.660 . 5.520 1.984 1.841 2.221 . 0 0 "[ . 1 . 2 .]" 1
1622 1 60 LEU QD 1 101 ALA MB 4.595 . 7.390 2.596 2.401 2.799 . 0 0 "[ . 1 . 2 .]" 1
1623 1 60 LEU MD1 1 61 PRO HB2 5.190 . 8.580 3.758 3.097 4.731 . 0 0 "[ . 1 . 2 .]" 1
1624 1 60 LEU MD1 1 61 PRO HB3 5.190 . 8.580 4.986 4.296 6.006 . 0 0 "[ . 1 . 2 .]" 1
1625 1 60 LEU MD1 1 61 PRO HD2 4.650 . 7.500 2.650 2.241 3.241 . 0 0 "[ . 1 . 2 .]" 1
1626 1 60 LEU MD1 1 61 PRO HD3 4.650 . 7.500 3.904 3.504 4.482 . 0 0 "[ . 1 . 2 .]" 1
1627 1 60 LEU MD1 1 100 PHE QD 4.900 . 8.114 3.469 2.077 4.332 . 0 0 "[ . 1 . 2 .]" 1
1628 1 60 LEU MD1 1 100 PHE QE 4.855 . 7.910 3.222 2.409 3.738 . 0 0 "[ . 1 . 2 .]" 1
1629 1 60 LEU MD2 1 61 PRO HB2 5.190 . 8.580 5.117 4.124 5.808 . 0 0 "[ . 1 . 2 .]" 1
1630 1 60 LEU MD2 1 61 PRO HB3 5.190 . 8.580 6.200 5.156 6.919 . 0 0 "[ . 1 . 2 .]" 1
1631 1 60 LEU MD2 1 61 PRO HD2 4.650 . 7.500 4.011 3.654 4.305 . 0 0 "[ . 1 . 2 .]" 1
1632 1 60 LEU MD2 1 61 PRO HD3 4.650 . 7.500 4.850 4.403 5.174 . 0 0 "[ . 1 . 2 .]" 1
1633 1 60 LEU MD2 1 100 PHE QD 4.900 . 8.114 2.849 2.117 3.906 . 0 0 "[ . 1 . 2 .]" 1
1634 1 60 LEU MD2 1 100 PHE QE 4.855 . 7.910 2.874 2.300 3.593 . 0 0 "[ . 1 . 2 .]" 1
1635 1 60 LEU HG 1 61 PRO QD 4.090 . 6.380 3.310 2.045 4.175 . 0 0 "[ . 1 . 2 .]" 1
1636 1 60 LEU HG 1 62 ALA H 3.650 . 5.500 5.482 5.311 5.588 0.088 16 0 "[ . 1 . 2 .]" 1
1637 1 60 LEU HG 1 101 ALA MB 3.375 . 4.950 3.980 3.900 4.023 . 0 0 "[ . 1 . 2 .]" 1
1638 1 61 PRO HA 1 62 ALA H 2.300 . 2.800 2.146 2.140 2.154 . 0 0 "[ . 1 . 2 .]" 1
1639 1 61 PRO HA 1 62 ALA MB 3.405 . 5.010 3.985 3.938 4.011 . 0 0 "[ . 1 . 2 .]" 1
1640 1 61 PRO HA 1 63 ALA H 3.075 . 4.350 3.875 3.737 3.972 . 0 0 "[ . 1 . 2 .]" 1
1641 1 61 PRO HA 1 64 VAL H 3.215 . 4.630 4.390 4.348 4.425 . 0 0 "[ . 1 . 2 .]" 1
1642 1 61 PRO QB 1 63 ALA H 2.730 . 3.660 3.141 3.009 3.226 . 0 0 "[ . 1 . 2 .]" 1
1643 1 61 PRO QB 1 63 ALA MB 3.305 . 4.810 3.267 3.163 3.324 . 0 0 "[ . 1 . 2 .]" 1
1644 1 61 PRO QB 1 64 VAL H 2.870 . 3.940 2.232 2.163 2.273 . 0 0 "[ . 1 . 2 .]" 1
1645 1 61 PRO QB 1 64 VAL MG2 3.230 . 4.660 1.944 1.883 2.030 . 0 0 "[ . 1 . 2 .]" 1
1646 1 61 PRO QB 1 114 LEU MD2 3.985 . 6.170 1.837 1.809 1.936 . 0 0 "[ . 1 . 2 .]" 1
1647 1 61 PRO HB2 1 62 ALA H 2.905 . 4.124 3.993 3.932 4.023 . 0 0 "[ . 1 . 2 .]" 1
1648 1 61 PRO HB2 1 63 ALA H 2.935 . 4.070 3.503 3.323 3.631 . 0 0 "[ . 1 . 2 .]" 1
1649 1 61 PRO HB2 1 63 ALA MB 3.405 . 5.010 3.582 3.455 3.678 . 0 0 "[ . 1 . 2 .]" 1
1650 1 61 PRO HB2 1 64 VAL H 3.170 . 4.540 2.257 2.182 2.301 . 0 0 "[ . 1 . 2 .]" 1
1651 1 61 PRO HB2 1 64 VAL MG2 3.545 . 5.290 1.962 1.898 2.051 . 0 0 "[ . 1 . 2 .]" 1
1652 1 61 PRO HB3 1 62 ALA H 2.905 . 4.124 3.614 3.528 3.669 . 0 0 "[ . 1 . 2 .]" 1
1653 1 61 PRO HB3 1 63 ALA H 2.935 . 4.070 3.550 3.440 3.650 . 0 0 "[ . 1 . 2 .]" 1
1654 1 61 PRO HB3 1 63 ALA MB 3.405 . 5.010 3.771 3.667 3.842 . 0 0 "[ . 1 . 2 .]" 1
1655 1 61 PRO HB3 1 64 VAL H 3.170 . 4.540 3.536 3.492 3.587 . 0 0 "[ . 1 . 2 .]" 1
1656 1 61 PRO HB3 1 64 VAL MG2 3.545 . 5.290 3.177 3.106 3.256 . 0 0 "[ . 1 . 2 .]" 1
1657 1 61 PRO QD 1 64 VAL H 4.090 . 6.380 4.553 4.458 4.649 . 0 0 "[ . 1 . 2 .]" 1
1658 1 61 PRO QD 1 64 VAL MG2 3.385 . 4.970 2.620 2.439 2.750 . 0 0 "[ . 1 . 2 .]" 1
1659 1 61 PRO QD 1 65 LEU H 4.090 . 6.380 4.817 4.704 4.954 . 0 0 "[ . 1 . 2 .]" 1
1660 1 61 PRO QD 1 101 ALA MB 3.875 . 5.950 3.843 3.593 4.042 . 0 0 "[ . 1 . 2 .]" 1
1661 1 61 PRO HD2 1 64 VAL MG2 3.515 . 5.230 2.660 2.469 2.798 . 0 0 "[ . 1 . 2 .]" 1
1662 1 61 PRO HD2 1 101 ALA MB 4.165 . 6.530 4.272 4.028 4.509 . 0 0 "[ . 1 . 2 .]" 1
1663 1 61 PRO HD3 1 64 VAL MG2 3.515 . 5.230 3.944 3.792 4.046 . 0 0 "[ . 1 . 2 .]" 1
1664 1 61 PRO HD3 1 101 ALA MB 4.165 . 6.530 4.358 4.039 4.565 . 0 0 "[ . 1 . 2 .]" 1
1665 1 61 PRO QG 1 63 ALA H 3.935 . 6.070 5.101 4.968 5.185 . 0 0 "[ . 1 . 2 .]" 1
1666 1 61 PRO QG 1 64 VAL H 3.905 . 6.124 4.203 4.107 4.260 . 0 0 "[ . 1 . 2 .]" 1
1667 1 61 PRO QG 1 64 VAL MG1 3.815 . 5.830 4.037 4.013 4.074 . 0 0 "[ . 1 . 2 .]" 1
1668 1 61 PRO QG 1 64 VAL MG2 3.580 . 5.360 2.094 1.992 2.254 . 0 0 "[ . 1 . 2 .]" 1
1669 1 61 PRO QG 1 111 ALA HA 3.810 . 5.820 4.013 3.864 4.138 . 0 0 "[ . 1 . 2 .]" 1
1670 1 61 PRO QG 1 111 ALA MB 3.890 . 5.980 3.423 3.202 3.658 . 0 0 "[ . 1 . 2 .]" 1
1671 1 61 PRO O 1 64 VAL H 1.950 . 2.200 2.225 2.185 2.251 0.051 15 0 "[ . 1 . 2 .]" 1
1672 1 61 PRO O 1 64 VAL N 2.950 2.700 3.200 2.841 2.788 2.891 . 0 0 "[ . 1 . 2 .]" 1
1673 1 61 PRO O 1 65 LEU H 1.950 . 2.200 2.207 2.150 2.233 0.033 23 0 "[ . 1 . 2 .]" 1
1674 1 61 PRO O 1 65 LEU N 2.950 2.700 3.200 3.151 3.101 3.179 . 0 0 "[ . 1 . 2 .]" 1
1675 1 62 ALA H 1 62 ALA MB 2.615 . 3.430 2.175 2.071 2.233 . 0 0 "[ . 1 . 2 .]" 1
1676 1 62 ALA H 1 63 ALA H 2.970 . 4.140 2.821 2.769 2.874 . 0 0 "[ . 1 . 2 .]" 1
1677 1 62 ALA H 1 63 ALA MB 4.214 . 6.514 4.480 4.438 4.524 . 0 0 "[ . 1 . 2 .]" 1
1678 1 62 ALA H 1 64 VAL H 3.185 . 4.570 4.293 4.198 4.389 . 0 0 "[ . 1 . 2 .]" 1
1679 1 62 ALA H 1 65 LEU QD 4.950 . 8.100 3.772 3.648 3.887 . 0 0 "[ . 1 . 2 .]" 1
1680 1 62 ALA H 1 65 LEU HG 3.450 . 5.100 4.536 4.421 4.624 . 0 0 "[ . 1 . 2 .]" 1
1681 1 62 ALA HA 1 63 ALA H 2.720 . 3.640 3.530 3.502 3.544 . 0 0 "[ . 1 . 2 .]" 1
1682 1 62 ALA HA 1 65 LEU QD 3.585 . 5.370 2.005 1.923 2.101 . 0 0 "[ . 1 . 2 .]" 1
1683 1 62 ALA HA 1 65 LEU HG 2.214 . 2.514 2.115 2.002 2.163 . 0 0 "[ . 1 . 2 .]" 1
1684 1 62 ALA MB 1 63 ALA H 2.705 . 3.610 2.677 2.601 2.819 . 0 0 "[ . 1 . 2 .]" 1
1685 1 62 ALA MB 1 63 ALA HA 3.310 . 4.820 3.822 3.743 3.881 . 0 0 "[ . 1 . 2 .]" 1
1686 1 62 ALA MB 1 64 VAL H 3.870 . 5.940 4.550 4.470 4.662 . 0 0 "[ . 1 . 2 .]" 1
1687 1 62 ALA MB 1 65 LEU MD1 4.060 . 6.320 3.342 3.200 3.465 . 0 0 "[ . 1 . 2 .]" 1
1688 1 62 ALA MB 1 65 LEU QD 3.840 . 5.880 2.915 2.835 2.987 . 0 0 "[ . 1 . 2 .]" 1
1689 1 62 ALA MB 1 65 LEU MD2 4.060 . 6.320 3.218 3.016 3.338 . 0 0 "[ . 1 . 2 .]" 1
1690 1 62 ALA MB 1 65 LEU HG 3.065 . 4.330 3.618 3.537 3.655 . 0 0 "[ . 1 . 2 .]" 1
1691 1 62 ALA O 1 66 GLY H 1.950 . 2.200 2.050 1.964 2.204 0.004 4 0 "[ . 1 . 2 .]" 1
1692 1 62 ALA O 1 66 GLY N 2.950 2.700 3.200 2.721 2.688 2.781 0.012 1 0 "[ . 1 . 2 .]" 1
1693 1 63 ALA H 1 63 ALA HA 2.350 . 2.900 2.825 2.811 2.838 . 0 0 "[ . 1 . 2 .]" 1
1694 1 63 ALA H 1 63 ALA MB 2.615 . 3.430 2.185 2.153 2.201 . 0 0 "[ . 1 . 2 .]" 1
1695 1 63 ALA H 1 64 VAL H 2.505 . 3.210 2.610 2.577 2.655 . 0 0 "[ . 1 . 2 .]" 1
1696 1 63 ALA H 1 64 VAL HA 3.650 . 5.500 5.214 5.184 5.251 . 0 0 "[ . 1 . 2 .]" 1
1697 1 63 ALA H 1 65 LEU H 3.200 . 4.600 4.493 4.357 4.578 . 0 0 "[ . 1 . 2 .]" 1
1698 1 63 ALA H 1 65 LEU HG 3.555 . 5.310 4.447 4.358 4.548 . 0 0 "[ . 1 . 2 .]" 1
1699 1 63 ALA H 1 66 GLY H 3.230 . 4.660 4.504 4.457 4.575 . 0 0 "[ . 1 . 2 .]" 1
1700 1 63 ALA HA 1 64 VAL HA 3.265 . 4.730 4.793 4.780 4.803 0.073 5 0 "[ . 1 . 2 .]" 1
1701 1 63 ALA HA 1 65 LEU H 3.465 . 5.130 4.870 4.732 4.923 . 0 0 "[ . 1 . 2 .]" 1
1702 1 63 ALA HA 1 66 GLY H 2.830 . 3.860 3.358 3.259 3.413 . 0 0 "[ . 1 . 2 .]" 1
1703 1 63 ALA HA 1 66 GLY HA2 3.650 . 5.500 4.942 4.894 5.008 . 0 0 "[ . 1 . 2 .]" 1
1704 1 63 ALA HA 1 66 GLY HA3 3.650 . 5.500 3.262 3.221 3.324 . 0 0 "[ . 1 . 2 .]" 1
1705 1 63 ALA HA 1 67 ALA H 3.435 . 5.070 4.377 4.308 4.450 . 0 0 "[ . 1 . 2 .]" 1
1706 1 63 ALA MB 1 64 VAL H 2.815 . 3.830 2.570 2.494 2.639 . 0 0 "[ . 1 . 2 .]" 1
1707 1 63 ALA MB 1 64 VAL HA 3.235 . 4.670 3.741 3.707 3.762 . 0 0 "[ . 1 . 2 .]" 1
1708 1 63 ALA MB 1 66 GLY H 4.040 . 6.280 4.385 4.288 4.437 . 0 0 "[ . 1 . 2 .]" 1
1709 1 63 ALA O 1 67 ALA H 1.950 . 2.200 2.262 2.235 2.288 0.088 13 0 "[ . 1 . 2 .]" 1
1710 1 63 ALA O 1 67 ALA N 2.950 2.700 3.200 2.890 2.833 2.937 . 0 0 "[ . 1 . 2 .]" 1
1711 1 64 VAL H 1 64 VAL HB 2.315 . 2.830 2.402 2.361 2.444 . 0 0 "[ . 1 . 2 .]" 1
1712 1 64 VAL H 1 64 VAL MG1 3.295 . 4.790 3.751 3.736 3.764 . 0 0 "[ . 1 . 2 .]" 1
1713 1 64 VAL H 1 64 VAL MG2 2.615 . 3.430 2.247 2.131 2.358 . 0 0 "[ . 1 . 2 .]" 1
1714 1 64 VAL H 1 65 LEU H 2.380 . 2.960 2.863 2.823 2.896 . 0 0 "[ . 1 . 2 .]" 1
1715 1 64 VAL H 1 65 LEU HG 2.970 . 4.140 4.094 3.936 4.161 0.021 16 0 "[ . 1 . 2 .]" 1
1716 1 64 VAL H 1 66 GLY H 2.955 . 4.110 3.659 3.619 3.696 . 0 0 "[ . 1 . 2 .]" 1
1717 1 64 VAL H 1 110 ILE MG 3.900 . 6.114 4.191 4.118 4.301 . 0 0 "[ . 1 . 2 .]" 1
1718 1 64 VAL H 1 111 ALA HA 3.030 . 4.260 4.170 4.046 4.264 0.004 3 0 "[ . 1 . 2 .]" 1
1719 1 64 VAL HA 1 64 VAL MG1 2.615 . 3.430 2.554 2.499 2.591 . 0 0 "[ . 1 . 2 .]" 1
1720 1 64 VAL HA 1 64 VAL MG2 2.615 . 3.430 2.345 2.313 2.374 . 0 0 "[ . 1 . 2 .]" 1
1721 1 64 VAL HA 1 65 LEU H 2.705 . 3.610 3.577 3.572 3.586 . 0 0 "[ . 1 . 2 .]" 1
1722 1 64 VAL HA 1 67 ALA H 2.720 . 3.640 3.524 3.481 3.581 . 0 0 "[ . 1 . 2 .]" 1
1723 1 64 VAL HA 1 67 ALA MB 2.895 . 3.990 2.995 2.815 3.198 . 0 0 "[ . 1 . 2 .]" 1
1724 1 64 VAL HA 1 110 ILE MD 4.070 . 6.340 4.516 4.427 4.659 . 0 0 "[ . 1 . 2 .]" 1
1725 1 64 VAL HA 1 110 ILE MG 3.205 . 4.610 1.856 1.816 1.915 . 0 0 "[ . 1 . 2 .]" 1
1726 1 64 VAL HA 1 111 ALA MB 3.745 . 5.690 4.742 4.702 4.783 . 0 0 "[ . 1 . 2 .]" 1
1727 1 64 VAL HA 1 113 ALA MB 3.185 . 4.570 3.677 3.556 3.736 . 0 0 "[ . 1 . 2 .]" 1
1728 1 64 VAL HB 1 66 GLY H 3.125 . 4.450 4.501 4.487 4.514 0.064 2 0 "[ . 1 . 2 .]" 1
1729 1 64 VAL MG1 1 65 LEU QB 3.965 . 6.130 3.717 3.625 3.812 . 0 0 "[ . 1 . 2 .]" 1
1730 1 64 VAL MG1 1 66 GLY H 3.670 . 5.540 4.530 4.491 4.572 . 0 0 "[ . 1 . 2 .]" 1
1731 1 64 VAL MG1 1 67 ALA H 3.775 . 5.750 4.470 4.360 4.548 . 0 0 "[ . 1 . 2 .]" 1
1732 1 64 VAL MG1 1 67 ALA MB 4.475 . 7.150 4.066 3.897 4.227 . 0 0 "[ . 1 . 2 .]" 1
1733 1 64 VAL MG1 1 68 MET ME 3.730 . 5.660 3.221 2.970 3.483 . 0 0 "[ . 1 . 2 .]" 1
1734 1 64 VAL MG1 1 87 MET ME 4.680 . 7.560 4.588 4.248 4.848 . 0 0 "[ . 1 . 2 .]" 1
1735 1 64 VAL MG1 1 100 PHE QE 4.855 . 7.910 3.863 3.611 4.220 . 0 0 "[ . 1 . 2 .]" 1
1736 1 64 VAL MG1 1 104 LEU H 3.930 . 6.060 4.310 4.118 4.496 . 0 0 "[ . 1 . 2 .]" 1
1737 1 64 VAL MG1 1 104 LEU QB 3.690 . 5.580 1.850 1.782 1.897 0.018 18 0 "[ . 1 . 2 .]" 1
1738 1 64 VAL MG1 1 104 LEU MD2 4.680 . 7.560 3.714 3.557 3.834 . 0 0 "[ . 1 . 2 .]" 1
1739 1 64 VAL MG1 1 105 SER HA 3.360 . 4.920 3.528 3.110 3.858 . 0 0 "[ . 1 . 2 .]" 1
1740 1 64 VAL MG1 1 110 ILE MG 4.180 . 6.560 1.901 1.842 1.928 . 0 0 "[ . 1 . 2 .]" 1
1741 1 64 VAL MG2 1 105 SER HA 3.450 . 5.100 3.472 2.980 3.918 . 0 0 "[ . 1 . 2 .]" 1
1742 1 64 VAL MG2 1 107 TYR H 4.165 . 6.530 5.063 4.842 5.202 . 0 0 "[ . 1 . 2 .]" 1
1743 1 64 VAL MG2 1 110 ILE HB 2.955 . 4.110 3.089 3.064 3.117 . 0 0 "[ . 1 . 2 .]" 1
1744 1 64 VAL MG2 1 110 ILE MG 3.485 . 5.170 2.664 2.375 2.837 . 0 0 "[ . 1 . 2 .]" 1
1745 1 64 VAL MG2 1 111 ALA HA 3.480 . 5.160 1.879 1.846 1.925 . 0 0 "[ . 1 . 2 .]" 1
1746 1 64 VAL MG2 1 111 ALA MB 3.905 . 6.124 2.452 2.335 2.559 . 0 0 "[ . 1 . 2 .]" 1
1747 1 64 VAL MG2 1 113 ALA H 4.085 . 6.370 4.526 4.460 4.575 . 0 0 "[ . 1 . 2 .]" 1
1748 1 64 VAL MG2 1 113 ALA MB 3.965 . 6.130 3.819 3.738 3.873 . 0 0 "[ . 1 . 2 .]" 1
1749 1 64 VAL MG2 1 114 LEU H 4.165 . 6.530 4.378 4.314 4.433 . 0 0 "[ . 1 . 2 .]" 1
1750 1 65 LEU H 1 65 LEU HA 2.285 . 2.770 2.815 2.802 2.838 0.068 22 0 "[ . 1 . 2 .]" 1
1751 1 65 LEU H 1 65 LEU QD 3.600 . 5.400 3.023 2.976 3.080 . 0 0 "[ . 1 . 2 .]" 1
1752 1 65 LEU H 1 66 GLY H 2.440 . 3.080 2.607 2.594 2.623 . 0 0 "[ . 1 . 2 .]" 1
1753 1 65 LEU H 1 66 GLY QA 3.890 . 5.980 4.478 4.443 4.502 . 0 0 "[ . 1 . 2 .]" 1
1754 1 65 LEU H 1 67 ALA H 3.015 . 4.230 4.149 4.095 4.198 . 0 0 "[ . 1 . 2 .]" 1
1755 1 65 LEU HA 1 66 GLY H 2.675 . 3.550 3.443 3.395 3.465 . 0 0 "[ . 1 . 2 .]" 1
1756 1 65 LEU HA 1 67 ALA H 2.815 . 3.830 3.880 3.847 3.896 0.066 5 0 "[ . 1 . 2 .]" 1
1757 1 65 LEU HA 1 68 MET ME 2.660 . 3.520 2.605 2.429 2.857 . 0 0 "[ . 1 . 2 .]" 1
1758 1 65 LEU HA 1 68 MET QG 3.330 . 4.860 3.493 3.140 4.076 . 0 0 "[ . 1 . 2 .]" 1
1759 1 65 LEU HA 1 71 ILE MD 4.165 . 6.530 5.090 4.981 5.225 . 0 0 "[ . 1 . 2 .]" 1
1760 1 65 LEU HA 1 100 PHE QE 4.120 . 6.440 3.544 3.348 3.703 . 0 0 "[ . 1 . 2 .]" 1
1761 1 65 LEU QB 1 104 LEU MD2 4.600 . 7.400 5.274 5.096 5.363 . 0 0 "[ . 1 . 2 .]" 1
1762 1 65 LEU QD 1 66 GLY H 4.360 . 6.920 2.601 2.373 3.035 . 0 0 "[ . 1 . 2 .]" 1
1763 1 66 GLY H 1 67 ALA H 2.440 . 3.080 2.452 2.335 2.502 . 0 0 "[ . 1 . 2 .]" 1
1764 1 66 GLY H 1 67 ALA HA 3.435 . 5.070 5.072 4.933 5.119 0.049 17 0 "[ . 1 . 2 .]" 1
1765 1 66 GLY H 1 67 ALA MB 3.480 . 5.160 4.097 3.907 4.192 . 0 0 "[ . 1 . 2 .]" 1
1766 1 66 GLY QA 1 68 MET H 3.245 . 4.690 4.097 4.043 4.162 . 0 0 "[ . 1 . 2 .]" 1
1767 1 66 GLY HA2 1 68 MET H 3.465 . 5.130 4.356 4.310 4.418 . 0 0 "[ . 1 . 2 .]" 1
1768 1 66 GLY HA3 1 68 MET H 3.465 . 5.130 4.988 4.893 5.083 . 0 0 "[ . 1 . 2 .]" 1
1769 1 67 ALA H 1 67 ALA HA 2.350 . 2.900 2.905 2.884 2.919 0.019 4 0 "[ . 1 . 2 .]" 1
1770 1 67 ALA H 1 67 ALA MB 2.630 . 3.460 2.186 2.096 2.317 . 0 0 "[ . 1 . 2 .]" 1
1771 1 67 ALA H 1 68 MET H 2.890 . 3.980 3.865 3.836 3.896 . 0 0 "[ . 1 . 2 .]" 1
1772 1 67 ALA H 1 68 MET ME 3.340 . 4.880 3.867 3.733 4.141 . 0 0 "[ . 1 . 2 .]" 1
1773 1 67 ALA H 1 68 MET HG2 3.650 . 5.500 3.484 3.208 4.218 . 0 0 "[ . 1 . 2 .]" 1
1774 1 67 ALA H 1 68 MET QG 3.255 . 4.710 3.410 3.161 4.059 . 0 0 "[ . 1 . 2 .]" 1
1775 1 67 ALA H 1 68 MET HG3 3.650 . 5.500 4.940 4.773 5.282 . 0 0 "[ . 1 . 2 .]" 1
1776 1 67 ALA H 1 110 ILE MG 3.760 . 5.720 3.415 3.221 3.635 . 0 0 "[ . 1 . 2 .]" 1
1777 1 67 ALA HA 1 88 ASN H 2.955 . 4.110 3.942 3.801 4.114 0.004 8 0 "[ . 1 . 2 .]" 1
1778 1 67 ALA HA 1 88 ASN HB2 3.200 . 4.600 4.003 2.887 4.529 . 0 0 "[ . 1 . 2 .]" 1
1779 1 67 ALA HA 1 88 ASN QB 2.985 . 4.170 2.857 2.441 3.062 . 0 0 "[ . 1 . 2 .]" 1
1780 1 67 ALA HA 1 88 ASN HB3 3.200 . 4.600 3.105 2.468 4.302 . 0 0 "[ . 1 . 2 .]" 1
1781 1 67 ALA HA 1 88 ASN HD21 3.125 . 4.450 2.658 1.994 3.784 . 0 0 "[ . 1 . 2 .]" 1
1782 1 67 ALA HA 1 88 ASN QD 2.775 . 3.750 2.497 1.946 3.375 . 0 0 "[ . 1 . 2 .]" 1
1783 1 67 ALA HA 1 88 ASN HD22 3.125 . 4.450 3.201 2.660 3.820 . 0 0 "[ . 1 . 2 .]" 1
1784 1 67 ALA MB 1 68 MET HA 3.545 . 5.290 4.303 4.255 4.349 . 0 0 "[ . 1 . 2 .]" 1
1785 1 67 ALA MB 1 68 MET ME 4.505 . 7.210 3.665 3.519 3.984 . 0 0 "[ . 1 . 2 .]" 1
1786 1 67 ALA MB 1 68 MET QG 4.224 . 6.534 4.006 3.809 4.572 . 0 0 "[ . 1 . 2 .]" 1
1787 1 67 ALA MB 1 87 MET QG 3.750 . 5.700 3.280 2.991 3.678 . 0 0 "[ . 1 . 2 .]" 1
1788 1 67 ALA MB 1 88 ASN H 3.235 . 4.670 3.397 3.234 3.584 . 0 0 "[ . 1 . 2 .]" 1
1789 1 67 ALA MB 1 88 ASN HB2 3.885 . 5.970 4.472 3.169 4.901 . 0 0 "[ . 1 . 2 .]" 1
1790 1 67 ALA MB 1 88 ASN QB 3.800 . 5.800 3.564 3.110 3.838 . 0 0 "[ . 1 . 2 .]" 1
1791 1 67 ALA MB 1 88 ASN HB3 3.885 . 5.970 3.921 3.470 4.649 . 0 0 "[ . 1 . 2 .]" 1
1792 1 67 ALA MB 1 88 ASN HD21 3.450 . 5.100 3.091 1.934 4.060 . 0 0 "[ . 1 . 2 .]" 1
1793 1 67 ALA MB 1 88 ASN QD 3.330 . 4.860 2.520 1.797 3.332 0.003 21 0 "[ . 1 . 2 .]" 1
1794 1 67 ALA MB 1 88 ASN HD22 3.450 . 5.100 2.828 2.067 4.277 . 0 0 "[ . 1 . 2 .]" 1
1795 1 67 ALA MB 1 110 ILE HB 3.670 . 5.540 4.334 4.093 4.560 . 0 0 "[ . 1 . 2 .]" 1
1796 1 67 ALA MB 1 110 ILE QG 3.815 . 5.830 3.349 3.020 3.731 . 0 0 "[ . 1 . 2 .]" 1
1797 1 67 ALA MB 1 110 ILE MG 3.670 . 5.540 1.888 1.738 2.043 0.062 2 0 "[ . 1 . 2 .]" 1
1798 1 68 MET H 1 68 MET ME 3.715 . 5.630 4.535 4.402 4.702 . 0 0 "[ . 1 . 2 .]" 1
1799 1 68 MET H 1 68 MET QG 3.175 . 4.550 2.713 2.637 2.732 . 0 0 "[ . 1 . 2 .]" 1
1800 1 68 MET H 1 69 SER H 3.650 . 5.500 4.158 3.964 4.359 . 0 0 "[ . 1 . 2 .]" 1
1801 1 68 MET H 1 88 ASN H 2.935 . 4.070 3.760 3.593 3.949 . 0 0 "[ . 1 . 2 .]" 1
1802 1 68 MET H 1 88 ASN QB 2.930 . 4.060 2.697 2.231 3.563 . 0 0 "[ . 1 . 2 .]" 1
1803 1 68 MET HA 1 68 MET ME 3.375 . 4.950 4.000 3.910 4.077 . 0 0 "[ . 1 . 2 .]" 1
1804 1 68 MET HA 1 68 MET QG 2.820 . 3.840 3.329 3.304 3.402 . 0 0 "[ . 1 . 2 .]" 1
1805 1 68 MET HA 1 70 GLU H 3.200 . 4.600 4.469 4.185 4.608 0.008 5 0 "[ . 1 . 2 .]" 1
1806 1 68 MET HA 1 85 VAL MG2 4.040 . 6.280 4.785 4.505 5.067 . 0 0 "[ . 1 . 2 .]" 1
1807 1 68 MET HA 1 87 MET H 3.155 . 4.510 4.503 4.430 4.551 0.041 13 0 "[ . 1 . 2 .]" 1
1808 1 68 MET HA 1 87 MET HA 2.425 . 3.050 2.430 2.295 2.591 . 0 0 "[ . 1 . 2 .]" 1
1809 1 68 MET HA 1 87 MET ME 3.730 . 5.660 4.047 3.660 4.485 . 0 0 "[ . 1 . 2 .]" 1
1810 1 68 MET QB 1 70 GLU H 3.345 . 4.890 3.409 3.054 3.782 . 0 0 "[ . 1 . 2 .]" 1
1811 1 68 MET QB 1 86 TYR H 3.145 . 4.490 3.135 2.939 3.345 . 0 0 "[ . 1 . 2 .]" 1
1812 1 68 MET QB 1 87 MET H 4.090 . 6.380 4.400 4.170 4.630 . 0 0 "[ . 1 . 2 .]" 1
1813 1 68 MET QB 1 88 ASN H 3.530 . 5.260 3.873 3.648 4.176 . 0 0 "[ . 1 . 2 .]" 1
1814 1 68 MET HB2 1 86 TYR H 3.230 . 4.660 3.249 3.031 3.478 . 0 0 "[ . 1 . 2 .]" 1
1815 1 68 MET HB3 1 86 TYR H 3.230 . 4.660 4.123 3.952 4.344 . 0 0 "[ . 1 . 2 .]" 1
1816 1 68 MET ME 1 68 MET HG2 2.910 . 4.134 2.646 2.371 3.377 . 0 0 "[ . 1 . 2 .]" 1
1817 1 68 MET ME 1 68 MET HG3 2.910 . 4.134 3.154 2.386 3.396 . 0 0 "[ . 1 . 2 .]" 1
1818 1 68 MET ME 1 85 VAL HB 3.155 . 4.510 2.583 2.269 2.872 . 0 0 "[ . 1 . 2 .]" 1
1819 1 68 MET ME 1 85 VAL MG1 4.060 . 6.320 2.810 2.683 2.962 . 0 0 "[ . 1 . 2 .]" 1
1820 1 68 MET ME 1 85 VAL MG2 3.500 . 5.200 2.237 2.037 2.444 . 0 0 "[ . 1 . 2 .]" 1
1821 1 68 MET ME 1 87 MET ME 3.625 . 5.450 2.758 2.407 3.130 . 0 0 "[ . 1 . 2 .]" 1
1822 1 68 MET ME 1 93 VAL QG 5.460 . 9.120 4.309 4.076 4.430 . 0 0 "[ . 1 . 2 .]" 1
1823 1 68 MET ME 1 95 ALA MB 4.680 . 7.560 5.056 4.869 5.260 . 0 0 "[ . 1 . 2 .]" 1
1824 1 68 MET ME 1 100 PHE QE 3.940 . 6.080 2.988 2.750 3.244 . 0 0 "[ . 1 . 2 .]" 1
1825 1 68 MET ME 1 100 PHE HZ 2.675 . 3.550 2.795 2.661 2.880 . 0 0 "[ . 1 . 2 .]" 1
1826 1 68 MET ME 1 104 LEU QB 3.985 . 6.170 3.609 3.323 3.968 . 0 0 "[ . 1 . 2 .]" 1
1827 1 68 MET ME 1 104 LEU MD1 3.595 . 5.390 2.688 2.414 3.005 . 0 0 "[ . 1 . 2 .]" 1
1828 1 68 MET ME 1 104 LEU MD2 4.195 . 6.590 3.217 3.011 3.559 . 0 0 "[ . 1 . 2 .]" 1
1829 1 68 MET ME 1 110 ILE MD 3.905 . 6.124 3.273 2.968 3.477 . 0 0 "[ . 1 . 2 .]" 1
1830 1 68 MET ME 1 110 ILE MG 3.670 . 5.540 3.183 2.970 3.407 . 0 0 "[ . 1 . 2 .]" 1
1831 1 68 MET QG 1 70 GLU HA 4.090 . 6.380 4.800 4.330 5.169 . 0 0 "[ . 1 . 2 .]" 1
1832 1 69 SER H 1 86 TYR HB2 3.045 . 4.290 3.408 2.954 3.722 . 0 0 "[ . 1 . 2 .]" 1
1833 1 69 SER H 1 86 TYR HB3 3.030 . 4.260 3.587 3.338 3.765 . 0 0 "[ . 1 . 2 .]" 1
1834 1 69 SER H 1 86 TYR QD 4.720 . 7.640 5.205 4.904 5.426 . 0 0 "[ . 1 . 2 .]" 1
1835 1 69 SER H 1 86 TYR O 1.950 . 2.200 1.796 1.724 1.883 . 0 0 "[ . 1 . 2 .]" 1
1836 1 69 SER H 1 88 ASN H 3.215 . 4.630 4.187 3.891 4.638 0.008 8 0 "[ . 1 . 2 .]" 1
1837 1 69 SER HA 1 88 ASN HA 3.400 . 5.000 4.403 4.102 4.761 . 0 0 "[ . 1 . 2 .]" 1
1838 1 69 SER QB 1 70 GLU QG 3.965 . 6.130 2.612 2.252 3.338 . 0 0 "[ . 1 . 2 .]" 1
1839 1 69 SER HB2 1 70 GLU QG 4.090 . 6.380 3.121 2.295 4.385 . 0 0 "[ . 1 . 2 .]" 1
1840 1 69 SER HB3 1 70 GLU QG 4.090 . 6.380 3.344 2.318 4.778 . 0 0 "[ . 1 . 2 .]" 1
1841 1 69 SER N 1 86 TYR O 2.950 2.700 3.200 2.681 2.654 2.701 0.046 13 0 "[ . 1 . 2 .]" 1
1842 1 70 GLU H 1 70 GLU QG 3.515 . 5.230 2.360 2.152 2.502 . 0 0 "[ . 1 . 2 .]" 1
1843 1 70 GLU H 1 71 ILE H 3.155 . 4.510 4.318 4.284 4.351 . 0 0 "[ . 1 . 2 .]" 1
1844 1 70 GLU H 1 86 TYR H 2.750 . 3.700 3.217 3.087 3.315 . 0 0 "[ . 1 . 2 .]" 1
1845 1 70 GLU H 1 86 TYR HB2 3.215 . 4.630 2.162 1.989 2.299 . 0 0 "[ . 1 . 2 .]" 1
1846 1 70 GLU H 1 86 TYR HB3 2.860 . 3.920 3.402 3.298 3.499 . 0 0 "[ . 1 . 2 .]" 1
1847 1 70 GLU H 1 86 TYR QD 4.720 . 7.640 4.124 3.584 4.300 . 0 0 "[ . 1 . 2 .]" 1
1848 1 70 GLU HA 1 71 ILE H 2.315 . 2.830 2.290 2.257 2.327 . 0 0 "[ . 1 . 2 .]" 1
1849 1 70 GLU HA 1 71 ILE MD 3.360 . 4.920 3.904 3.842 3.924 . 0 0 "[ . 1 . 2 .]" 1
1850 1 70 GLU QB 1 72 HIS HD2 3.265 . 4.730 3.283 3.155 3.479 . 0 0 "[ . 1 . 2 .]" 1
1851 1 70 GLU HB2 1 72 HIS HD2 3.650 . 5.500 3.335 3.196 3.551 . 0 0 "[ . 1 . 2 .]" 1
1852 1 70 GLU HB3 1 72 HIS HD2 3.650 . 5.500 4.910 4.837 4.977 . 0 0 "[ . 1 . 2 .]" 1
1853 1 70 GLU QG 1 72 HIS H 4.090 . 6.380 5.133 4.943 5.267 . 0 0 "[ . 1 . 2 .]" 1
1854 1 70 GLU QG 1 72 HIS HD2 3.095 . 4.390 2.786 2.461 3.059 . 0 0 "[ . 1 . 2 .]" 1
1855 1 70 GLU QG 1 86 TYR HB3 4.090 . 6.380 3.665 3.436 3.812 . 0 0 "[ . 1 . 2 .]" 1
1856 1 70 GLU O 1 86 TYR H 1.950 . 2.200 2.215 2.206 2.228 0.028 4 0 "[ . 1 . 2 .]" 1
1857 1 70 GLU O 1 86 TYR N 2.950 2.700 3.200 2.930 2.875 2.975 . 0 0 "[ . 1 . 2 .]" 1
1858 1 71 ILE H 1 71 ILE HB 2.505 . 3.210 2.566 2.546 2.593 . 0 0 "[ . 1 . 2 .]" 1
1859 1 71 ILE H 1 71 ILE MD 2.845 . 3.890 3.023 2.985 3.043 . 0 0 "[ . 1 . 2 .]" 1
1860 1 71 ILE H 1 71 ILE HG12 3.280 . 4.760 4.125 4.085 4.183 . 0 0 "[ . 1 . 2 .]" 1
1861 1 71 ILE H 1 71 ILE QG 3.085 . 4.370 2.703 2.651 2.781 . 0 0 "[ . 1 . 2 .]" 1
1862 1 71 ILE H 1 71 ILE HG13 3.280 . 4.760 2.740 2.686 2.823 . 0 0 "[ . 1 . 2 .]" 1
1863 1 71 ILE H 1 72 HIS HD2 3.125 . 4.450 4.007 3.756 4.228 . 0 0 "[ . 1 . 2 .]" 1
1864 1 71 ILE HA 1 71 ILE MD 3.250 . 4.700 3.858 3.841 3.870 . 0 0 "[ . 1 . 2 .]" 1
1865 1 71 ILE HA 1 71 ILE HG12 2.720 . 3.640 3.037 3.020 3.052 . 0 0 "[ . 1 . 2 .]" 1
1866 1 71 ILE HA 1 71 ILE QG 2.500 . 3.200 2.441 2.423 2.459 . 0 0 "[ . 1 . 2 .]" 1
1867 1 71 ILE HA 1 71 ILE HG13 2.720 . 3.640 2.573 2.542 2.599 . 0 0 "[ . 1 . 2 .]" 1
1868 1 71 ILE HA 1 71 ILE MG 2.615 . 3.430 2.348 2.286 2.424 . 0 0 "[ . 1 . 2 .]" 1
1869 1 71 ILE HA 1 72 HIS HD2 2.800 . 3.800 3.618 3.263 3.806 0.006 3 0 "[ . 1 . 2 .]" 1
1870 1 71 ILE HA 1 85 VAL H 3.215 . 4.630 4.627 4.591 4.645 0.015 20 0 "[ . 1 . 2 .]" 1
1871 1 71 ILE HA 1 85 VAL HA 2.395 . 2.990 2.008 1.982 2.045 . 0 0 "[ . 1 . 2 .]" 1
1872 1 71 ILE HA 1 85 VAL MG1 3.185 . 4.570 3.473 3.393 3.576 . 0 0 "[ . 1 . 2 .]" 1
1873 1 71 ILE HA 1 86 TYR H 3.155 . 4.510 3.100 3.011 3.183 . 0 0 "[ . 1 . 2 .]" 1
1874 1 71 ILE HB 1 72 HIS H 2.905 . 4.124 4.060 4.046 4.082 . 0 0 "[ . 1 . 2 .]" 1
1875 1 71 ILE HB 1 83 VAL MG2 4.165 . 6.530 5.124 4.903 5.291 . 0 0 "[ . 1 . 2 .]" 1
1876 1 71 ILE MD 1 83 VAL HB 3.885 . 5.970 4.743 4.650 4.842 . 0 0 "[ . 1 . 2 .]" 1
1877 1 71 ILE MD 1 83 VAL MG1 4.680 . 7.560 4.793 4.672 4.899 . 0 0 "[ . 1 . 2 .]" 1
1878 1 71 ILE MD 1 85 VAL HA 3.855 . 5.910 4.442 4.378 4.503 . 0 0 "[ . 1 . 2 .]" 1
1879 1 71 ILE MD 1 85 VAL HB 3.310 . 4.820 3.994 3.974 4.002 . 0 0 "[ . 1 . 2 .]" 1
1880 1 71 ILE MD 1 85 VAL MG1 3.810 . 5.820 3.278 3.210 3.344 . 0 0 "[ . 1 . 2 .]" 1
1881 1 71 ILE MD 1 100 PHE QE 4.235 . 6.670 3.140 3.055 3.453 . 0 0 "[ . 1 . 2 .]" 1
1882 1 71 ILE MD 1 100 PHE HZ 2.770 . 3.740 2.896 2.871 2.957 . 0 0 "[ . 1 . 2 .]" 1
1883 1 71 ILE QG 1 85 VAL MG1 3.095 . 4.390 2.050 1.936 2.184 . 0 0 "[ . 1 . 2 .]" 1
1884 1 71 ILE QG 1 100 PHE HZ 2.935 . 4.070 2.956 2.911 2.999 . 0 0 "[ . 1 . 2 .]" 1
1885 1 71 ILE HG12 1 85 VAL MG1 3.220 . 4.640 2.069 1.951 2.207 . 0 0 "[ . 1 . 2 .]" 1
1886 1 71 ILE HG12 1 100 PHE HZ 3.125 . 4.450 3.015 2.969 3.058 . 0 0 "[ . 1 . 2 .]" 1
1887 1 71 ILE HG13 1 85 VAL MG1 3.220 . 4.640 3.336 3.272 3.469 . 0 0 "[ . 1 . 2 .]" 1
1888 1 71 ILE HG13 1 100 PHE HZ 3.125 . 4.450 4.265 4.195 4.339 . 0 0 "[ . 1 . 2 .]" 1
1889 1 71 ILE MG 1 72 HIS H 2.830 . 3.860 2.368 2.166 2.542 . 0 0 "[ . 1 . 2 .]" 1
1890 1 71 ILE MG 1 72 HIS HA 3.360 . 4.920 3.852 3.747 3.928 . 0 0 "[ . 1 . 2 .]" 1
1891 1 71 ILE MG 1 73 TYR QB 4.435 . 7.070 4.345 4.135 4.586 . 0 0 "[ . 1 . 2 .]" 1
1892 1 71 ILE MG 1 83 VAL HB 2.615 . 3.430 2.076 2.026 2.130 . 0 0 "[ . 1 . 2 .]" 1
1893 1 71 ILE MG 1 84 ILE H 2.875 . 3.950 3.199 3.098 3.261 . 0 0 "[ . 1 . 2 .]" 1
1894 1 71 ILE MG 1 84 ILE HA 3.635 . 5.470 4.193 4.108 4.260 . 0 0 "[ . 1 . 2 .]" 1
1895 1 71 ILE MG 1 84 ILE MD 4.680 . 7.560 5.045 4.955 5.102 . 0 0 "[ . 1 . 2 .]" 1
1896 1 71 ILE MG 1 85 VAL HA 2.925 . 4.050 2.692 2.527 2.909 . 0 0 "[ . 1 . 2 .]" 1
1897 1 71 ILE MG 1 85 VAL HB 3.390 . 4.980 3.822 3.670 3.943 . 0 0 "[ . 1 . 2 .]" 1
1898 1 71 ILE MG 1 85 VAL MG1 3.470 . 5.140 2.112 1.947 2.296 . 0 0 "[ . 1 . 2 .]" 1
1899 1 71 ILE MG 1 100 PHE QE 4.030 . 6.260 2.530 2.372 2.846 . 0 0 "[ . 1 . 2 .]" 1
1900 1 71 ILE MG 1 100 PHE HZ 3.435 . 5.070 4.001 3.937 4.093 . 0 0 "[ . 1 . 2 .]" 1
1901 1 72 HIS H 1 72 HIS HD2 2.750 . 3.700 3.201 2.926 3.367 . 0 0 "[ . 1 . 2 .]" 1
1902 1 72 HIS H 1 73 TYR H 3.125 . 4.450 4.338 4.264 4.429 . 0 0 "[ . 1 . 2 .]" 1
1903 1 72 HIS H 1 74 LYS QG 4.090 . 6.380 4.866 4.452 5.799 . 0 0 "[ . 1 . 2 .]" 1
1904 1 72 HIS H 1 84 ILE H 3.230 . 4.660 3.328 3.228 3.430 . 0 0 "[ . 1 . 2 .]" 1
1905 1 72 HIS H 1 84 ILE HB 3.265 . 4.730 3.499 3.411 3.598 . 0 0 "[ . 1 . 2 .]" 1
1906 1 72 HIS H 1 84 ILE O 1.950 . 2.200 1.705 1.693 1.770 0.007 5 0 "[ . 1 . 2 .]" 1
1907 1 72 HIS HA 1 72 HIS HD2 2.365 . 2.930 2.822 2.540 2.941 0.011 13 0 "[ . 1 . 2 .]" 1
1908 1 72 HIS HA 1 73 TYR H 2.660 . 3.520 2.149 2.142 2.161 . 0 0 "[ . 1 . 2 .]" 1
1909 1 72 HIS HA 1 73 TYR QB 3.515 . 5.230 4.083 4.038 4.104 . 0 0 "[ . 1 . 2 .]" 1
1910 1 72 HIS HA 1 74 LYS QG 4.090 . 6.380 4.496 4.307 5.189 . 0 0 "[ . 1 . 2 .]" 1
1911 1 72 HIS QB 1 73 TYR QB 4.525 . 7.250 4.778 4.706 4.833 . 0 0 "[ . 1 . 2 .]" 1
1912 1 72 HIS QB 1 74 LYS QG 4.000 . 6.200 2.650 2.460 3.328 . 0 0 "[ . 1 . 2 .]" 1
1913 1 72 HIS QB 1 84 ILE H 3.440 . 5.080 3.537 3.420 3.705 . 0 0 "[ . 1 . 2 .]" 1
1914 1 72 HIS QB 1 84 ILE HB 2.820 . 3.840 2.493 2.288 2.674 . 0 0 "[ . 1 . 2 .]" 1
1915 1 72 HIS QB 1 84 ILE MG 3.825 . 5.850 3.650 3.516 3.747 . 0 0 "[ . 1 . 2 .]" 1
1916 1 72 HIS HB2 1 84 ILE HB 2.905 . 4.124 2.536 2.315 2.712 . 0 0 "[ . 1 . 2 .]" 1
1917 1 72 HIS HB2 1 84 ILE MG 4.165 . 6.530 3.768 3.616 3.854 . 0 0 "[ . 1 . 2 .]" 1
1918 1 72 HIS HB3 1 84 ILE HB 2.905 . 4.124 3.697 3.557 4.053 . 0 0 "[ . 1 . 2 .]" 1
1919 1 72 HIS HB3 1 84 ILE MG 4.165 . 6.530 4.893 4.792 5.112 . 0 0 "[ . 1 . 2 .]" 1
1920 1 72 HIS N 1 84 ILE O 2.950 2.700 3.200 2.675 2.661 2.742 0.039 16 0 "[ . 1 . 2 .]" 1
1921 1 72 HIS O 1 84 ILE H 1.950 . 2.200 1.840 1.740 1.966 . 0 0 "[ . 1 . 2 .]" 1
1922 1 72 HIS O 1 84 ILE N 2.950 2.700 3.200 2.804 2.705 2.926 . 0 0 "[ . 1 . 2 .]" 1
1923 1 73 TYR H 1 73 TYR HB2 2.830 . 3.860 2.480 2.249 2.629 . 0 0 "[ . 1 . 2 .]" 1
1924 1 73 TYR H 1 73 TYR QB 2.740 . 3.680 2.250 2.173 2.290 . 0 0 "[ . 1 . 2 .]" 1
1925 1 73 TYR H 1 73 TYR HB3 2.830 . 3.860 2.627 2.495 2.877 . 0 0 "[ . 1 . 2 .]" 1
1926 1 73 TYR H 1 74 LYS QE 4.090 . 6.380 5.197 5.043 5.502 . 0 0 "[ . 1 . 2 .]" 1
1927 1 73 TYR HA 1 74 LYS H 2.505 . 3.210 2.161 2.144 2.189 . 0 0 "[ . 1 . 2 .]" 1
1928 1 73 TYR HA 1 74 LYS QE 4.090 . 6.380 5.465 5.262 5.696 . 0 0 "[ . 1 . 2 .]" 1
1929 1 73 TYR HA 1 83 VAL HA 2.520 . 3.240 2.685 2.557 2.791 . 0 0 "[ . 1 . 2 .]" 1
1930 1 73 TYR HA 1 83 VAL MG1 2.615 . 3.430 2.525 2.398 2.633 . 0 0 "[ . 1 . 2 .]" 1
1931 1 73 TYR HA 1 84 ILE H 3.060 . 4.320 3.580 3.496 3.686 . 0 0 "[ . 1 . 2 .]" 1
1932 1 73 TYR QB 1 83 VAL MG1 3.645 . 5.490 3.496 3.267 3.787 . 0 0 "[ . 1 . 2 .]" 1
1933 1 73 TYR QD 1 74 LYS H 4.720 . 7.640 3.158 2.105 3.915 . 0 0 "[ . 1 . 2 .]" 1
1934 1 73 TYR QD 1 75 PRO QG 5.160 . 8.520 3.635 3.100 3.973 . 0 0 "[ . 1 . 2 .]" 1
1935 1 73 TYR QD 1 81 ASP HA 4.720 . 7.640 4.619 4.311 4.879 . 0 0 "[ . 1 . 2 .]" 1
1936 1 73 TYR QD 1 83 VAL HA 4.440 . 7.080 3.555 3.217 3.857 . 0 0 "[ . 1 . 2 .]" 1
1937 1 73 TYR QD 1 83 VAL MG1 3.900 . 6.114 2.238 1.868 3.136 . 0 0 "[ . 1 . 2 .]" 1
1938 1 73 TYR QD 1 83 VAL MG2 5.235 . 8.670 4.767 4.471 5.369 . 0 0 "[ . 1 . 2 .]" 1
1939 1 73 TYR QD 1 97 ILE MD 4.275 . 6.750 3.767 3.307 4.397 . 0 0 "[ . 1 . 2 .]" 1
1940 1 73 TYR QE 1 75 PRO HB2 4.715 . 7.630 4.433 4.109 4.761 . 0 0 "[ . 1 . 2 .]" 1
1941 1 73 TYR QE 1 75 PRO QB 4.585 . 7.370 3.040 2.349 3.905 . 0 0 "[ . 1 . 2 .]" 1
1942 1 73 TYR QE 1 75 PRO HB3 4.715 . 7.630 3.113 2.362 4.250 . 0 0 "[ . 1 . 2 .]" 1
1943 1 73 TYR QE 1 75 PRO HD2 4.715 . 7.630 4.296 3.804 4.863 . 0 0 "[ . 1 . 2 .]" 1
1944 1 73 TYR QE 1 75 PRO QD 4.455 . 7.110 3.098 2.870 3.446 . 0 0 "[ . 1 . 2 .]" 1
1945 1 73 TYR QE 1 75 PRO HD3 4.715 . 7.630 3.186 2.969 3.688 . 0 0 "[ . 1 . 2 .]" 1
1946 1 73 TYR QE 1 75 PRO HG2 4.470 . 7.140 4.177 2.432 4.969 . 0 0 "[ . 1 . 2 .]" 1
1947 1 73 TYR QE 1 75 PRO QG 4.290 . 6.780 2.718 2.124 3.626 . 0 0 "[ . 1 . 2 .]" 1
1948 1 73 TYR QE 1 75 PRO HG3 4.470 . 7.140 2.777 2.136 3.731 . 0 0 "[ . 1 . 2 .]" 1
1949 1 73 TYR QE 1 81 ASP H 4.715 . 7.630 5.122 4.740 5.634 . 0 0 "[ . 1 . 2 .]" 1
1950 1 73 TYR QE 1 81 ASP HA 3.615 . 5.430 2.551 2.209 2.892 . 0 0 "[ . 1 . 2 .]" 1
1951 1 73 TYR QE 1 82 ARG H 4.715 . 7.630 3.807 3.148 4.695 . 0 0 "[ . 1 . 2 .]" 1
1952 1 73 TYR QE 1 83 VAL MG1 4.205 . 6.610 3.162 2.746 3.425 . 0 0 "[ . 1 . 2 .]" 1
1953 1 73 TYR QE 1 83 VAL MG2 5.230 . 8.660 5.325 4.977 5.513 . 0 0 "[ . 1 . 2 .]" 1
1954 1 74 LYS H 1 75 PRO QD 3.655 . 5.510 3.185 2.916 3.334 . 0 0 "[ . 1 . 2 .]" 1
1955 1 74 LYS H 1 82 ARG QB 4.090 . 6.380 4.299 4.220 4.379 . 0 0 "[ . 1 . 2 .]" 1
1956 1 74 LYS H 1 82 ARG O 1.950 . 2.200 2.212 2.191 2.224 0.024 24 0 "[ . 1 . 2 .]" 1
1957 1 74 LYS H 1 83 VAL HA 2.625 . 3.450 2.329 2.203 2.426 . 0 0 "[ . 1 . 2 .]" 1
1958 1 74 LYS H 1 83 VAL MG1 3.235 . 4.670 3.464 3.212 3.688 . 0 0 "[ . 1 . 2 .]" 1
1959 1 74 LYS H 1 84 ILE H 2.890 . 3.980 3.217 3.077 3.385 . 0 0 "[ . 1 . 2 .]" 1
1960 1 74 LYS HA 1 75 PRO QD 2.550 . 3.300 2.099 2.039 2.298 . 0 0 "[ . 1 . 2 .]" 1
1961 1 74 LYS HA 1 75 PRO QG 3.530 . 5.260 3.975 3.899 4.180 . 0 0 "[ . 1 . 2 .]" 1
1962 1 74 LYS QB 1 74 LYS QD 2.760 . 3.720 2.102 1.961 2.126 . 0 0 "[ . 1 . 2 .]" 1
1963 1 74 LYS QB 1 74 LYS QE 3.595 . 5.390 3.232 2.600 3.456 . 0 0 "[ . 1 . 2 .]" 1
1964 1 74 LYS QB 1 82 ARG QG 3.525 . 5.250 3.189 2.972 3.410 . 0 0 "[ . 1 . 2 .]" 1
1965 1 74 LYS QB 1 83 VAL HA 3.840 . 5.880 3.889 3.727 4.085 . 0 0 "[ . 1 . 2 .]" 1
1966 1 74 LYS QB 1 84 ILE MD 3.295 . 4.790 3.034 2.878 3.212 . 0 0 "[ . 1 . 2 .]" 1
1967 1 74 LYS QB 1 84 ILE QG 2.990 . 4.180 2.014 1.921 2.162 . 0 0 "[ . 1 . 2 .]" 1
1968 1 74 LYS QB 1 84 ILE MG 4.295 . 6.790 4.475 4.339 4.630 . 0 0 "[ . 1 . 2 .]" 1
1969 1 74 LYS HB2 1 74 LYS QE 3.780 . 5.760 3.454 2.672 3.818 . 0 0 "[ . 1 . 2 .]" 1
1970 1 74 LYS HB2 1 82 ARG HG2 4.200 . 6.600 3.399 3.088 3.703 . 0 0 "[ . 1 . 2 .]" 1
1971 1 74 LYS HB2 1 82 ARG HG3 4.200 . 6.600 4.655 4.402 4.960 . 0 0 "[ . 1 . 2 .]" 1
1972 1 74 LYS HB2 1 84 ILE MD 3.530 . 5.260 3.116 2.941 3.332 . 0 0 "[ . 1 . 2 .]" 1
1973 1 74 LYS HB2 1 84 ILE HG12 3.610 . 5.420 2.068 1.970 2.225 . 0 0 "[ . 1 . 2 .]" 1
1974 1 74 LYS HB2 1 84 ILE HG13 3.610 . 5.420 2.975 2.791 3.196 . 0 0 "[ . 1 . 2 .]" 1
1975 1 74 LYS HB3 1 74 LYS QE 3.780 . 5.760 3.917 3.556 4.021 . 0 0 "[ . 1 . 2 .]" 1
1976 1 74 LYS HB3 1 82 ARG HG2 4.200 . 6.600 4.277 4.006 4.694 . 0 0 "[ . 1 . 2 .]" 1
1977 1 74 LYS HB3 1 82 ARG HG3 4.200 . 6.600 5.847 5.568 6.223 . 0 0 "[ . 1 . 2 .]" 1
1978 1 74 LYS HB3 1 84 ILE MD 3.530 . 5.260 4.189 4.085 4.297 . 0 0 "[ . 1 . 2 .]" 1
1979 1 74 LYS HB3 1 84 ILE HG12 3.610 . 5.420 3.629 3.501 3.756 . 0 0 "[ . 1 . 2 .]" 1
1980 1 74 LYS HB3 1 84 ILE HG13 3.610 . 5.420 3.931 3.750 4.130 . 0 0 "[ . 1 . 2 .]" 1
1981 1 74 LYS QD 1 84 ILE MD 3.720 . 5.640 3.470 3.277 3.845 . 0 0 "[ . 1 . 2 .]" 1
1982 1 74 LYS QD 1 84 ILE QG 3.600 . 5.400 2.090 1.887 2.643 . 0 0 "[ . 1 . 2 .]" 1
1983 1 74 LYS QD 1 84 ILE MG 3.840 . 5.880 3.729 3.492 4.125 . 0 0 "[ . 1 . 2 .]" 1
1984 1 74 LYS QE 1 84 ILE H 3.995 . 6.190 3.798 3.459 4.050 . 0 0 "[ . 1 . 2 .]" 1
1985 1 74 LYS QE 1 84 ILE HB 3.515 . 5.230 2.114 1.917 2.393 . 0 0 "[ . 1 . 2 .]" 1
1986 1 74 LYS QE 1 84 ILE HG12 3.655 . 5.510 2.895 2.302 3.212 . 0 0 "[ . 1 . 2 .]" 1
1987 1 74 LYS QE 1 84 ILE QG 3.545 . 5.290 2.169 1.808 2.497 . 0 0 "[ . 1 . 2 .]" 1
1988 1 74 LYS QE 1 84 ILE HG13 3.655 . 5.510 2.246 1.886 2.603 . 0 0 "[ . 1 . 2 .]" 1
1989 1 74 LYS QE 1 84 ILE MG 3.550 . 5.300 2.524 2.279 2.730 . 0 0 "[ . 1 . 2 .]" 1
1990 1 74 LYS QE 1 86 TYR QE 5.155 . 8.510 3.343 2.647 4.326 . 0 0 "[ . 1 . 2 .]" 1
1991 1 74 LYS QE 1 94 SER QB 4.525 . 7.250 5.502 5.139 5.770 . 0 0 "[ . 1 . 2 .]" 1
1992 1 74 LYS QG 1 83 VAL HA 4.090 . 6.380 4.352 3.906 5.264 . 0 0 "[ . 1 . 2 .]" 1
1993 1 74 LYS QG 1 84 ILE H 3.590 . 5.380 3.498 2.855 4.637 . 0 0 "[ . 1 . 2 .]" 1
1994 1 74 LYS QG 1 84 ILE MD 3.995 . 6.190 4.150 3.609 4.591 . 0 0 "[ . 1 . 2 .]" 1
1995 1 74 LYS QG 1 84 ILE MG 4.370 . 6.940 4.377 3.920 4.782 . 0 0 "[ . 1 . 2 .]" 1
1996 1 74 LYS N 1 82 ARG O 2.950 2.700 3.200 2.969 2.903 3.032 . 0 0 "[ . 1 . 2 .]" 1
1997 1 75 PRO HA 1 76 THR H 2.180 . 2.560 2.326 2.279 2.385 . 0 0 "[ . 1 . 2 .]" 1
1998 1 75 PRO HA 1 76 THR MG 3.050 . 4.300 3.282 3.140 3.430 . 0 0 "[ . 1 . 2 .]" 1
1999 1 75 PRO HA 1 80 GLU HA 2.875 . 3.950 3.669 3.406 3.912 . 0 0 "[ . 1 . 2 .]" 1
2000 1 75 PRO HA 1 81 ASP H 3.200 . 4.600 4.527 4.404 4.579 . 0 0 "[ . 1 . 2 .]" 1
2001 1 75 PRO HA 1 82 ARG H 2.395 . 2.990 2.257 2.142 2.377 . 0 0 "[ . 1 . 2 .]" 1
2002 1 75 PRO HA 1 82 ARG HB2 2.860 . 3.920 3.371 3.157 3.686 . 0 0 "[ . 1 . 2 .]" 1
2003 1 75 PRO HA 1 82 ARG QB 2.780 . 3.760 2.116 1.969 2.411 . 0 0 "[ . 1 . 2 .]" 1
2004 1 75 PRO HA 1 82 ARG HB3 2.860 . 3.920 2.138 1.987 2.444 . 0 0 "[ . 1 . 2 .]" 1
2005 1 75 PRO HA 1 82 ARG QD 4.090 . 6.380 4.572 4.345 4.975 . 0 0 "[ . 1 . 2 .]" 1
2006 1 75 PRO HA 1 82 ARG QG 3.905 . 6.124 3.981 3.859 4.218 . 0 0 "[ . 1 . 2 .]" 1
2007 1 75 PRO QB 1 76 THR H 2.945 . 4.090 2.686 2.570 2.822 . 0 0 "[ . 1 . 2 .]" 1
2008 1 75 PRO QB 1 76 THR HA 3.410 . 5.020 3.995 3.973 4.013 . 0 0 "[ . 1 . 2 .]" 1
2009 1 75 PRO QB 1 80 GLU HA 2.300 . 2.800 2.422 2.245 2.535 . 0 0 "[ . 1 . 2 .]" 1
2010 1 75 PRO QB 1 80 GLU QG 4.450 . 7.100 3.690 3.049 4.855 . 0 0 "[ . 1 . 2 .]" 1
2011 1 75 PRO QB 1 81 ASP HA 3.145 . 4.490 3.693 3.607 3.731 . 0 0 "[ . 1 . 2 .]" 1
2012 1 75 PRO QB 1 82 ARG H 3.050 . 4.300 3.112 2.886 3.276 . 0 0 "[ . 1 . 2 .]" 1
2013 1 75 PRO HB2 1 76 THR HA 3.620 . 5.440 4.104 4.076 4.174 . 0 0 "[ . 1 . 2 .]" 1
2014 1 75 PRO HB2 1 80 GLU HA 2.455 . 3.110 2.582 2.361 3.120 0.010 24 0 "[ . 1 . 2 .]" 1
2015 1 75 PRO HB3 1 76 THR HA 3.620 . 5.440 5.486 5.099 5.513 0.073 14 0 "[ . 1 . 2 .]" 1
2016 1 75 PRO HB3 1 80 GLU HA 2.455 . 3.110 2.996 2.353 3.110 . 0 0 "[ . 1 . 2 .]" 1
2017 1 75 PRO QD 1 76 THR MG 4.605 . 7.410 4.790 4.656 4.920 . 0 0 "[ . 1 . 2 .]" 1
2018 1 76 THR H 1 76 THR HB 2.830 . 3.860 3.896 3.869 3.931 0.071 9 0 "[ . 1 . 2 .]" 1
2019 1 76 THR H 1 76 THR MG 2.705 . 3.610 2.833 2.690 2.936 . 0 0 "[ . 1 . 2 .]" 1
2020 1 76 THR H 1 77 ARG H 3.170 . 4.540 4.413 4.390 4.434 . 0 0 "[ . 1 . 2 .]" 1
2021 1 76 THR H 1 78 GLU H 3.140 . 4.480 4.472 4.404 4.498 0.018 6 0 "[ . 1 . 2 .]" 1
2022 1 76 THR H 1 79 TYR H 2.645 . 3.490 3.089 2.992 3.143 . 0 0 "[ . 1 . 2 .]" 1
2023 1 76 THR H 1 79 TYR HA 3.230 . 4.660 4.461 4.355 4.498 . 0 0 "[ . 1 . 2 .]" 1
2024 1 76 THR H 1 79 TYR HB2 3.125 . 4.450 3.374 3.054 3.574 . 0 0 "[ . 1 . 2 .]" 1
2025 1 76 THR H 1 79 TYR QB 2.870 . 3.940 3.251 2.974 3.413 . 0 0 "[ . 1 . 2 .]" 1
2026 1 76 THR H 1 79 TYR HB3 3.125 . 4.450 4.264 4.053 4.453 0.003 14 0 "[ . 1 . 2 .]" 1
2027 1 76 THR H 1 79 TYR QD 4.720 . 7.640 4.984 4.651 5.252 . 0 0 "[ . 1 . 2 .]" 1
2028 1 76 THR H 1 80 GLU H 3.155 . 4.510 4.043 3.877 4.206 . 0 0 "[ . 1 . 2 .]" 1
2029 1 76 THR H 1 80 GLU HA 2.520 . 3.240 2.805 2.538 3.074 . 0 0 "[ . 1 . 2 .]" 1
2030 1 76 THR H 1 81 ASP H 3.245 . 4.690 4.493 4.416 4.601 . 0 0 "[ . 1 . 2 .]" 1
2031 1 76 THR H 1 82 ARG H 3.030 . 4.260 3.485 3.309 3.659 . 0 0 "[ . 1 . 2 .]" 1
2032 1 76 THR HA 1 76 THR MG 2.615 . 3.430 2.486 2.408 2.602 . 0 0 "[ . 1 . 2 .]" 1
2033 1 76 THR HA 1 77 ARG HA 3.185 . 4.570 4.295 4.291 4.302 . 0 0 "[ . 1 . 2 .]" 1
2034 1 76 THR HA 1 77 ARG QG 4.090 . 6.380 4.124 3.620 4.533 . 0 0 "[ . 1 . 2 .]" 1
2035 1 76 THR HB 1 77 ARG H 2.535 . 3.270 2.451 2.261 2.509 . 0 0 "[ . 1 . 2 .]" 1
2036 1 76 THR HB 1 77 ARG QB 4.090 . 6.380 4.514 4.074 4.740 . 0 0 "[ . 1 . 2 .]" 1
2037 1 76 THR HB 1 78 GLU H 2.565 . 3.330 2.974 2.895 3.158 . 0 0 "[ . 1 . 2 .]" 1
2038 1 76 THR HB 1 79 TYR H 2.935 . 4.070 3.586 3.459 4.086 0.016 16 0 "[ . 1 . 2 .]" 1
2039 1 76 THR MG 1 77 ARG H 3.170 . 4.540 3.851 3.791 3.884 . 0 0 "[ . 1 . 2 .]" 1
2040 1 76 THR MG 1 77 ARG QG 4.600 . 7.400 4.692 4.397 5.305 . 0 0 "[ . 1 . 2 .]" 1
2041 1 76 THR MG 1 78 GLU H 3.545 . 5.290 4.185 4.117 4.227 . 0 0 "[ . 1 . 2 .]" 1
2042 1 76 THR MG 1 78 GLU QG 4.600 . 7.400 4.956 3.519 5.471 . 0 0 "[ . 1 . 2 .]" 1
2043 1 76 THR MG 1 79 TYR H 3.360 . 4.920 3.806 3.750 4.102 . 0 0 "[ . 1 . 2 .]" 1
2044 1 76 THR MG 1 79 TYR HA 4.165 . 6.530 5.345 5.261 5.395 . 0 0 "[ . 1 . 2 .]" 1
2045 1 76 THR MG 1 79 TYR HB2 3.730 . 5.660 3.023 2.829 3.196 . 0 0 "[ . 1 . 2 .]" 1
2046 1 76 THR MG 1 79 TYR QB 3.420 . 5.040 2.968 2.780 3.138 . 0 0 "[ . 1 . 2 .]" 1
2047 1 76 THR MG 1 79 TYR HB3 3.730 . 5.660 4.339 4.084 4.579 . 0 0 "[ . 1 . 2 .]" 1
2048 1 76 THR MG 1 79 TYR QD 4.660 . 7.520 3.459 3.063 4.055 . 0 0 "[ . 1 . 2 .]" 1
2049 1 76 THR MG 1 79 TYR QE 5.230 . 8.660 5.147 4.757 5.737 . 0 0 "[ . 1 . 2 .]" 1
2050 1 76 THR MG 1 82 ARG QD 3.285 . 4.770 2.409 1.850 3.122 . 0 0 "[ . 1 . 2 .]" 1
2051 1 76 THR MG 1 82 ARG QG 3.815 . 5.830 3.040 2.659 3.347 . 0 0 "[ . 1 . 2 .]" 1
2052 1 76 THR O 1 79 TYR H 1.950 . 2.200 2.226 2.168 2.235 0.035 21 0 "[ . 1 . 2 .]" 1
2053 1 76 THR O 1 79 TYR N 2.950 2.700 3.200 2.919 2.862 3.125 . 0 0 "[ . 1 . 2 .]" 1
2054 1 77 ARG H 1 78 GLU H 2.985 . 4.170 2.733 2.659 2.775 . 0 0 "[ . 1 . 2 .]" 1
2055 1 77 ARG H 1 78 GLU QG 3.995 . 6.190 4.220 3.779 4.601 . 0 0 "[ . 1 . 2 .]" 1
2056 1 77 ARG HA 1 77 ARG QD 3.745 . 5.690 4.071 2.883 4.630 . 0 0 "[ . 1 . 2 .]" 1
2057 1 77 ARG HA 1 80 GLU QG 4.090 . 6.380 4.344 3.708 5.580 . 0 0 "[ . 1 . 2 .]" 1
2058 1 77 ARG QB 1 78 GLU HA 3.810 . 5.820 4.318 4.038 4.506 . 0 0 "[ . 1 . 2 .]" 1
2059 1 77 ARG QD 1 78 GLU QG 4.525 . 7.250 4.038 2.684 5.471 . 0 0 "[ . 1 . 2 .]" 1
2060 1 77 ARG QG 1 78 GLU HA 4.090 . 6.380 4.383 3.585 5.807 . 0 0 "[ . 1 . 2 .]" 1
2061 1 77 ARG QG 1 79 TYR H 3.995 . 6.190 4.548 4.131 5.579 . 0 0 "[ . 1 . 2 .]" 1
2062 1 78 GLU H 1 78 GLU QG 3.175 . 4.550 2.461 1.979 2.820 . 0 0 "[ . 1 . 2 .]" 1
2063 1 78 GLU H 1 79 TYR H 2.300 . 2.800 2.142 2.090 2.304 . 0 0 "[ . 1 . 2 .]" 1
2064 1 78 GLU H 1 79 TYR HA 3.325 . 4.850 4.850 4.823 4.879 0.029 16 0 "[ . 1 . 2 .]" 1
2065 1 78 GLU H 1 79 TYR QD 4.720 . 7.640 4.248 3.653 4.957 . 0 0 "[ . 1 . 2 .]" 1
2066 1 78 GLU HA 1 78 GLU HB2 2.425 . 3.050 2.920 2.486 3.023 . 0 0 "[ . 1 . 2 .]" 1
2067 1 78 GLU HA 1 78 GLU HB3 2.425 . 3.050 2.417 2.336 2.515 . 0 0 "[ . 1 . 2 .]" 1
2068 1 78 GLU HA 1 78 GLU QG 2.770 . 3.740 2.791 2.364 3.335 . 0 0 "[ . 1 . 2 .]" 1
2069 1 78 GLU HA 1 79 TYR QD 4.720 . 7.640 4.950 4.667 5.238 . 0 0 "[ . 1 . 2 .]" 1
2070 1 78 GLU HA 1 79 TYR QE 4.715 . 7.630 5.600 5.272 6.011 . 0 0 "[ . 1 . 2 .]" 1
2071 1 78 GLU QB 1 79 TYR H 3.065 . 4.330 3.217 3.002 3.940 . 0 0 "[ . 1 . 2 .]" 1
2072 1 78 GLU QB 1 79 TYR QD 4.035 . 6.270 3.125 2.387 4.173 . 0 0 "[ . 1 . 2 .]" 1
2073 1 78 GLU QB 1 79 TYR QE 4.195 . 6.590 3.351 2.753 4.313 . 0 0 "[ . 1 . 2 .]" 1
2074 1 78 GLU HB2 1 79 TYR QD 4.210 . 6.620 3.229 2.439 4.362 . 0 0 "[ . 1 . 2 .]" 1
2075 1 78 GLU HB2 1 79 TYR QE 4.330 . 6.860 3.563 2.960 4.469 . 0 0 "[ . 1 . 2 .]" 1
2076 1 78 GLU HB3 1 79 TYR QD 4.210 . 6.620 4.245 3.395 5.321 . 0 0 "[ . 1 . 2 .]" 1
2077 1 78 GLU HB3 1 79 TYR QE 4.330 . 6.860 4.143 3.264 5.679 . 0 0 "[ . 1 . 2 .]" 1
2078 1 78 GLU QG 1 79 TYR H 4.090 . 6.380 3.886 2.547 4.417 . 0 0 "[ . 1 . 2 .]" 1
2079 1 78 GLU QG 1 79 TYR QD 4.600 . 7.400 4.184 2.232 5.269 . 0 0 "[ . 1 . 2 .]" 1
2080 1 78 GLU QG 1 79 TYR QE 4.520 . 7.240 4.384 2.762 5.369 . 0 0 "[ . 1 . 2 .]" 1
2081 1 79 TYR H 1 79 TYR QE 4.715 . 7.630 5.199 4.877 5.503 . 0 0 "[ . 1 . 2 .]" 1
2082 1 79 TYR H 1 80 GLU H 2.985 . 4.170 3.458 3.110 3.657 . 0 0 "[ . 1 . 2 .]" 1
2083 1 79 TYR H 1 80 GLU HA 3.650 . 5.500 4.354 4.114 4.473 . 0 0 "[ . 1 . 2 .]" 1
2084 1 79 TYR H 1 82 ARG QB 3.735 . 5.670 4.277 4.087 4.493 . 0 0 "[ . 1 . 2 .]" 1
2085 1 79 TYR HA 1 80 GLU H 2.380 . 2.960 2.334 2.269 2.390 . 0 0 "[ . 1 . 2 .]" 1
2086 1 79 TYR HA 1 81 ASP H 2.625 . 3.450 3.227 3.182 3.258 . 0 0 "[ . 1 . 2 .]" 1
2087 1 79 TYR HA 1 82 ARG QB 4.060 . 6.320 4.126 4.076 4.186 . 0 0 "[ . 1 . 2 .]" 1
2088 1 79 TYR HA 1 96 THR MG 3.480 . 5.160 3.900 3.573 4.127 . 0 0 "[ . 1 . 2 .]" 1
2089 1 79 TYR QB 1 81 ASP H 3.580 . 5.360 3.341 3.180 3.460 . 0 0 "[ . 1 . 2 .]" 1
2090 1 79 TYR QB 1 82 ARG H 3.270 . 4.740 3.244 3.071 3.326 . 0 0 "[ . 1 . 2 .]" 1
2091 1 79 TYR QB 1 82 ARG QB 3.170 . 4.540 1.822 1.812 1.849 . 0 0 "[ . 1 . 2 .]" 1
2092 1 79 TYR HB2 1 82 ARG HB2 3.690 . 5.580 2.052 1.987 2.235 . 0 0 "[ . 1 . 2 .]" 1
2093 1 79 TYR HB2 1 82 ARG HB3 3.690 . 5.580 3.323 3.133 3.544 . 0 0 "[ . 1 . 2 .]" 1
2094 1 79 TYR HB3 1 82 ARG HB2 3.690 . 5.580 2.081 1.990 2.170 . 0 0 "[ . 1 . 2 .]" 1
2095 1 79 TYR HB3 1 82 ARG HB3 3.690 . 5.580 3.706 3.584 3.845 . 0 0 "[ . 1 . 2 .]" 1
2096 1 79 TYR QD 1 80 GLU H 4.720 . 7.640 4.602 4.108 4.909 . 0 0 "[ . 1 . 2 .]" 1
2097 1 79 TYR QD 1 81 ASP H 4.720 . 7.640 4.570 4.175 4.827 . 0 0 "[ . 1 . 2 .]" 1
2098 1 79 TYR QD 1 82 ARG QD 4.940 . 8.080 2.660 2.065 3.383 . 0 0 "[ . 1 . 2 .]" 1
2099 1 79 TYR QD 1 96 THR MG 3.790 . 5.780 2.619 1.893 3.430 . 0 0 "[ . 1 . 2 .]" 1
2100 1 79 TYR QE 1 82 ARG QD 5.155 . 8.510 4.156 3.820 4.619 . 0 0 "[ . 1 . 2 .]" 1
2101 1 79 TYR QE 1 96 THR MG 4.285 . 6.770 3.732 2.785 4.293 . 0 0 "[ . 1 . 2 .]" 1
2102 1 79 TYR O 1 82 ARG H 1.950 . 2.200 2.218 2.210 2.252 0.052 24 0 "[ . 1 . 2 .]" 1
2103 1 79 TYR O 1 82 ARG N 2.950 2.700 3.200 2.981 2.946 3.061 . 0 0 "[ . 1 . 2 .]" 1
2104 1 80 GLU H 1 80 GLU HB2 2.675 . 3.550 2.311 2.057 3.569 0.019 6 0 "[ . 1 . 2 .]" 1
2105 1 80 GLU H 1 80 GLU QB 2.570 . 3.340 2.243 2.033 2.679 . 0 0 "[ . 1 . 2 .]" 1
2106 1 80 GLU H 1 80 GLU HB3 2.675 . 3.550 3.378 2.769 3.578 0.028 18 0 "[ . 1 . 2 .]" 1
2107 1 80 GLU H 1 80 GLU QG 3.250 . 4.700 2.867 1.969 3.895 . 0 0 "[ . 1 . 2 .]" 1
2108 1 80 GLU H 1 81 ASP H 2.535 . 3.270 2.740 2.701 2.769 . 0 0 "[ . 1 . 2 .]" 1
2109 1 80 GLU H 1 82 ARG H 3.435 . 5.070 4.637 4.547 4.688 . 0 0 "[ . 1 . 2 .]" 1
2110 1 80 GLU HA 1 80 GLU QG 2.660 . 3.520 2.324 2.009 3.295 . 0 0 "[ . 1 . 2 .]" 1
2111 1 80 GLU HA 1 81 ASP H 2.660 . 3.520 3.452 3.435 3.460 . 0 0 "[ . 1 . 2 .]" 1
2112 1 80 GLU HA 1 82 ARG H 2.890 . 3.980 3.878 3.806 3.973 . 0 0 "[ . 1 . 2 .]" 1
2113 1 80 GLU QB 1 81 ASP H 3.050 . 4.300 3.084 2.994 3.611 . 0 0 "[ . 1 . 2 .]" 1
2114 1 80 GLU QB 1 82 ARG H 4.030 . 6.260 4.795 4.731 4.936 . 0 0 "[ . 1 . 2 .]" 1
2115 1 80 GLU QG 1 81 ASP H 4.090 . 6.380 4.386 2.402 4.854 . 0 0 "[ . 1 . 2 .]" 1
2116 1 81 ASP H 1 82 ARG H 2.425 . 3.050 2.810 2.723 2.870 . 0 0 "[ . 1 . 2 .]" 1
2117 1 81 ASP H 1 82 ARG QB 3.550 . 5.300 4.050 4.004 4.078 . 0 0 "[ . 1 . 2 .]" 1
2118 1 81 ASP H 1 96 THR MG 3.730 . 5.660 3.720 3.440 3.879 . 0 0 "[ . 1 . 2 .]" 1
2119 1 81 ASP HA 1 81 ASP HB2 2.425 . 3.050 2.880 2.487 3.026 . 0 0 "[ . 1 . 2 .]" 1
2120 1 81 ASP HA 1 81 ASP HB3 2.425 . 3.050 2.447 2.372 2.647 . 0 0 "[ . 1 . 2 .]" 1
2121 1 81 ASP HA 1 82 ARG H 2.675 . 3.550 2.841 2.812 2.887 . 0 0 "[ . 1 . 2 .]" 1
2122 1 81 ASP HA 1 83 VAL MG1 3.700 . 5.600 3.887 3.789 4.111 . 0 0 "[ . 1 . 2 .]" 1
2123 1 81 ASP HA 1 97 ILE MD 3.000 . 4.200 3.299 3.205 3.371 . 0 0 "[ . 1 . 2 .]" 1
2124 1 81 ASP HA 1 97 ILE MG 4.165 . 6.530 5.227 5.134 5.305 . 0 0 "[ . 1 . 2 .]" 1
2125 1 81 ASP QB 1 83 VAL MG1 4.465 . 7.130 4.004 3.856 4.159 . 0 0 "[ . 1 . 2 .]" 1
2126 1 81 ASP QB 1 83 VAL MG2 4.605 . 7.410 4.614 4.372 4.780 . 0 0 "[ . 1 . 2 .]" 1
2127 1 81 ASP QB 1 96 THR MG 4.224 . 6.534 3.478 3.065 4.076 . 0 0 "[ . 1 . 2 .]" 1
2128 1 81 ASP QB 1 97 ILE H 2.815 . 3.830 2.330 2.090 2.524 . 0 0 "[ . 1 . 2 .]" 1
2129 1 81 ASP QB 1 97 ILE HB 2.700 . 3.600 2.010 1.967 2.092 . 0 0 "[ . 1 . 2 .]" 1
2130 1 81 ASP QB 1 97 ILE MD 3.300 . 4.800 2.808 2.611 3.098 . 0 0 "[ . 1 . 2 .]" 1
2131 1 81 ASP QB 1 97 ILE MG 3.470 . 5.140 3.527 3.429 3.595 . 0 0 "[ . 1 . 2 .]" 1
2132 1 81 ASP QB 1 98 ARG H 3.515 . 5.230 3.259 2.991 3.588 . 0 0 "[ . 1 . 2 .]" 1
2133 1 81 ASP HB2 1 97 ILE H 3.000 . 4.200 2.855 2.112 3.541 . 0 0 "[ . 1 . 2 .]" 1
2134 1 81 ASP HB2 1 97 ILE HB 2.985 . 4.170 2.916 1.996 3.394 . 0 0 "[ . 1 . 2 .]" 1
2135 1 81 ASP HB2 1 97 ILE MG 3.790 . 5.780 4.458 3.639 4.839 . 0 0 "[ . 1 . 2 .]" 1
2136 1 81 ASP HB2 1 98 ARG H 3.650 . 5.500 3.529 3.291 3.695 . 0 0 "[ . 1 . 2 .]" 1
2137 1 81 ASP HB3 1 97 ILE H 3.000 . 4.200 2.893 2.127 4.170 . 0 0 "[ . 1 . 2 .]" 1
2138 1 81 ASP HB3 1 97 ILE HB 2.985 . 4.170 2.347 1.980 3.286 . 0 0 "[ . 1 . 2 .]" 1
2139 1 81 ASP HB3 1 97 ILE MG 3.790 . 5.780 3.854 3.540 4.485 . 0 0 "[ . 1 . 2 .]" 1
2140 1 81 ASP HB3 1 98 ARG H 3.650 . 5.500 3.961 3.179 4.862 . 0 0 "[ . 1 . 2 .]" 1
2141 1 81 ASP O 1 97 ILE H 1.950 . 2.200 1.964 1.807 2.109 . 0 0 "[ . 1 . 2 .]" 1
2142 1 81 ASP O 1 97 ILE N 2.950 2.700 3.200 2.880 2.749 2.991 . 0 0 "[ . 1 . 2 .]" 1
2143 1 82 ARG H 1 83 VAL H 3.155 . 4.510 4.408 4.344 4.464 . 0 0 "[ . 1 . 2 .]" 1
2144 1 82 ARG H 1 83 VAL HA 3.525 . 5.250 5.261 5.233 5.290 0.040 24 0 "[ . 1 . 2 .]" 1
2145 1 82 ARG H 1 83 VAL MG1 4.165 . 6.530 4.263 4.124 4.404 . 0 0 "[ . 1 . 2 .]" 1
2146 1 82 ARG HA 1 82 ARG QD 3.280 . 4.760 3.465 3.009 3.908 . 0 0 "[ . 1 . 2 .]" 1
2147 1 82 ARG HA 1 82 ARG HG2 2.765 . 3.730 3.590 3.505 3.695 . 0 0 "[ . 1 . 2 .]" 1
2148 1 82 ARG HA 1 82 ARG HG3 2.765 . 3.730 2.438 2.379 2.485 . 0 0 "[ . 1 . 2 .]" 1
2149 1 82 ARG HA 1 83 VAL H 2.455 . 3.110 2.143 2.135 2.152 . 0 0 "[ . 1 . 2 .]" 1
2150 1 82 ARG HA 1 83 VAL MG2 3.760 . 5.720 3.711 3.536 3.822 . 0 0 "[ . 1 . 2 .]" 1
2151 1 82 ARG HA 1 84 ILE MD 4.165 . 6.530 4.633 4.520 4.788 . 0 0 "[ . 1 . 2 .]" 1
2152 1 82 ARG HA 1 95 ALA H 3.510 . 5.220 4.637 4.536 4.722 . 0 0 "[ . 1 . 2 .]" 1
2153 1 82 ARG HA 1 96 THR HA 2.350 . 2.900 2.489 2.310 2.625 . 0 0 "[ . 1 . 2 .]" 1
2154 1 82 ARG HA 1 96 THR HB 3.325 . 4.850 4.319 4.138 4.474 . 0 0 "[ . 1 . 2 .]" 1
2155 1 82 ARG HA 1 96 THR MG 2.660 . 3.520 2.191 1.963 2.432 . 0 0 "[ . 1 . 2 .]" 1
2156 1 82 ARG QB 1 84 ILE MD 4.340 . 6.880 4.182 4.112 4.256 . 0 0 "[ . 1 . 2 .]" 1
2157 1 82 ARG QB 1 96 THR MG 4.170 . 6.540 3.051 2.779 3.275 . 0 0 "[ . 1 . 2 .]" 1
2158 1 82 ARG QD 1 83 VAL H 4.090 . 6.380 4.695 4.238 4.963 . 0 0 "[ . 1 . 2 .]" 1
2159 1 82 ARG QD 1 84 ILE MD 3.705 . 5.610 3.672 3.145 3.946 . 0 0 "[ . 1 . 2 .]" 1
2160 1 82 ARG QD 1 94 SER QB 3.955 . 6.110 3.950 3.300 4.287 . 0 0 "[ . 1 . 2 .]" 1
2161 1 82 ARG QD 1 96 THR HA 3.980 . 6.160 5.170 4.529 5.564 . 0 0 "[ . 1 . 2 .]" 1
2162 1 82 ARG QD 1 96 THR MG 3.565 . 5.330 3.286 2.616 3.860 . 0 0 "[ . 1 . 2 .]" 1
2163 1 82 ARG QG 1 83 VAL H 3.190 . 4.580 2.881 2.628 3.054 . 0 0 "[ . 1 . 2 .]" 1
2164 1 82 ARG QG 1 84 ILE MD 2.625 . 3.450 2.444 2.351 2.522 . 0 0 "[ . 1 . 2 .]" 1
2165 1 82 ARG QG 1 94 SER HA 4.090 . 6.380 4.618 4.483 4.743 . 0 0 "[ . 1 . 2 .]" 1
2166 1 82 ARG QG 1 94 SER QB 3.895 . 5.990 3.408 3.216 3.587 . 0 0 "[ . 1 . 2 .]" 1
2167 1 82 ARG QG 1 95 ALA H 3.935 . 6.070 3.562 3.398 3.718 . 0 0 "[ . 1 . 2 .]" 1
2168 1 82 ARG QG 1 96 THR HA 3.825 . 5.850 4.208 4.039 4.374 . 0 0 "[ . 1 . 2 .]" 1
2169 1 82 ARG QG 1 96 THR MG 3.600 . 5.400 3.384 3.057 3.558 . 0 0 "[ . 1 . 2 .]" 1
2170 1 82 ARG HG2 1 83 VAL H 3.510 . 5.220 4.163 3.993 4.415 . 0 0 "[ . 1 . 2 .]" 1
2171 1 82 ARG HG2 1 84 ILE MD 2.740 . 3.680 2.685 2.485 2.856 . 0 0 "[ . 1 . 2 .]" 1
2172 1 82 ARG HG2 1 94 SER QB 4.010 . 6.220 4.225 3.978 4.486 . 0 0 "[ . 1 . 2 .]" 1
2173 1 82 ARG HG2 1 96 THR MG 3.870 . 5.940 4.707 4.422 4.876 . 0 0 "[ . 1 . 2 .]" 1
2174 1 82 ARG HG3 1 83 VAL H 3.510 . 5.220 2.939 2.656 3.122 . 0 0 "[ . 1 . 2 .]" 1
2175 1 82 ARG HG3 1 84 ILE MD 2.740 . 3.680 2.832 2.585 2.969 . 0 0 "[ . 1 . 2 .]" 1
2176 1 82 ARG HG3 1 94 SER QB 4.010 . 6.220 3.597 3.396 3.773 . 0 0 "[ . 1 . 2 .]" 1
2177 1 82 ARG HG3 1 96 THR MG 3.870 . 5.940 3.469 3.117 3.665 . 0 0 "[ . 1 . 2 .]" 1
2178 1 83 VAL H 1 83 VAL HB 2.780 . 3.760 3.757 3.720 3.793 0.033 10 0 "[ . 1 . 2 .]" 1
2179 1 83 VAL H 1 83 VAL MG1 2.970 . 4.140 2.893 2.794 3.087 . 0 0 "[ . 1 . 2 .]" 1
2180 1 83 VAL H 1 83 VAL MG2 2.940 . 4.080 2.081 1.958 2.222 . 0 0 "[ . 1 . 2 .]" 1
2181 1 83 VAL H 1 84 ILE H 3.340 . 4.880 4.417 4.377 4.446 . 0 0 "[ . 1 . 2 .]" 1
2182 1 83 VAL H 1 95 ALA H 2.765 . 3.730 3.328 3.216 3.463 . 0 0 "[ . 1 . 2 .]" 1
2183 1 83 VAL H 1 95 ALA O 1.950 . 2.200 1.773 1.733 1.838 . 0 0 "[ . 1 . 2 .]" 1
2184 1 83 VAL H 1 96 THR H 3.125 . 4.450 4.483 4.451 4.532 0.082 7 0 "[ . 1 . 2 .]" 1
2185 1 83 VAL HA 1 83 VAL MG1 2.615 . 3.430 2.341 2.173 2.404 . 0 0 "[ . 1 . 2 .]" 1
2186 1 83 VAL HA 1 84 ILE MD 3.775 . 5.750 3.839 3.712 3.930 . 0 0 "[ . 1 . 2 .]" 1
2187 1 83 VAL HB 1 84 ILE H 3.060 . 4.320 3.099 2.996 3.141 . 0 0 "[ . 1 . 2 .]" 1
2188 1 83 VAL HB 1 85 VAL MG1 3.790 . 5.780 3.568 3.412 3.757 . 0 0 "[ . 1 . 2 .]" 1
2189 1 83 VAL HB 1 95 ALA MB 4.165 . 6.530 4.832 4.578 5.124 . 0 0 "[ . 1 . 2 .]" 1
2190 1 83 VAL MG1 1 84 ILE MD 4.680 . 7.560 5.065 4.986 5.111 . 0 0 "[ . 1 . 2 .]" 1
2191 1 83 VAL MG1 1 85 VAL MG1 4.680 . 7.560 4.598 4.479 4.705 . 0 0 "[ . 1 . 2 .]" 1
2192 1 83 VAL MG1 1 97 ILE HA 3.495 . 5.190 4.116 4.060 4.198 . 0 0 "[ . 1 . 2 .]" 1
2193 1 83 VAL MG1 1 97 ILE MD 3.455 . 5.110 2.671 2.546 2.796 . 0 0 "[ . 1 . 2 .]" 1
2194 1 83 VAL MG1 1 97 ILE QG 3.795 . 5.790 2.177 2.055 2.272 . 0 0 "[ . 1 . 2 .]" 1
2195 1 83 VAL MG1 1 97 ILE MG 4.680 . 7.560 4.177 4.119 4.230 . 0 0 "[ . 1 . 2 .]" 1
2196 1 83 VAL MG2 1 84 ILE HA 3.650 . 5.500 4.093 3.945 4.211 . 0 0 "[ . 1 . 2 .]" 1
2197 1 83 VAL MG2 1 84 ILE MD 4.680 . 7.560 4.278 4.184 4.380 . 0 0 "[ . 1 . 2 .]" 1
2198 1 83 VAL MG2 1 85 VAL MG1 3.655 . 5.510 2.911 2.826 3.012 . 0 0 "[ . 1 . 2 .]" 1
2199 1 83 VAL MG2 1 94 SER QB 4.600 . 7.400 5.218 5.089 5.309 . 0 0 "[ . 1 . 2 .]" 1
2200 1 83 VAL MG2 1 95 ALA HA 3.790 . 5.780 4.308 4.159 4.443 . 0 0 "[ . 1 . 2 .]" 1
2201 1 83 VAL MG2 1 95 ALA MB 3.300 . 4.800 2.596 2.478 2.784 . 0 0 "[ . 1 . 2 .]" 1
2202 1 83 VAL MG2 1 96 THR H 3.480 . 5.160 3.789 3.533 4.227 . 0 0 "[ . 1 . 2 .]" 1
2203 1 83 VAL MG2 1 96 THR HA 2.970 . 4.140 2.740 2.490 3.023 . 0 0 "[ . 1 . 2 .]" 1
2204 1 83 VAL MG2 1 96 THR HB 4.165 . 6.530 4.856 4.677 5.122 . 0 0 "[ . 1 . 2 .]" 1
2205 1 83 VAL MG2 1 97 ILE H 3.495 . 5.190 3.268 3.149 3.400 . 0 0 "[ . 1 . 2 .]" 1
2206 1 83 VAL MG2 1 97 ILE HA 3.140 . 4.480 3.468 3.358 3.581 . 0 0 "[ . 1 . 2 .]" 1
2207 1 83 VAL MG2 1 97 ILE MD 4.335 . 6.870 3.973 3.849 4.059 . 0 0 "[ . 1 . 2 .]" 1
2208 1 83 VAL MG2 1 97 ILE MG 4.680 . 7.560 4.442 4.362 4.518 . 0 0 "[ . 1 . 2 .]" 1
2209 1 83 VAL MG2 1 100 PHE HA 3.635 . 5.470 4.193 4.088 4.300 . 0 0 "[ . 1 . 2 .]" 1
2210 1 83 VAL MG2 1 100 PHE QB 4.525 . 7.250 3.547 3.422 3.651 . 0 0 "[ . 1 . 2 .]" 1
2211 1 83 VAL MG2 1 100 PHE QD 3.905 . 6.124 2.008 1.918 2.135 . 0 0 "[ . 1 . 2 .]" 1
2212 1 83 VAL MG2 1 100 PHE QE 3.925 . 6.050 2.427 2.216 2.605 . 0 0 "[ . 1 . 2 .]" 1
2213 1 83 VAL MG2 1 104 LEU MD2 4.680 . 7.560 4.209 3.852 4.408 . 0 0 "[ . 1 . 2 .]" 1
2214 1 83 VAL N 1 95 ALA O 2.950 2.700 3.200 2.667 2.637 2.684 0.063 14 0 "[ . 1 . 2 .]" 1
2215 1 83 VAL O 1 95 ALA H 1.950 . 2.200 1.864 1.803 1.951 . 0 0 "[ . 1 . 2 .]" 1
2216 1 83 VAL O 1 95 ALA N 2.950 2.700 3.200 2.716 2.690 2.814 0.010 9 0 "[ . 1 . 2 .]" 1
2217 1 84 ILE H 1 84 ILE MD 3.000 . 4.200 3.234 3.168 3.299 . 0 0 "[ . 1 . 2 .]" 1
2218 1 84 ILE H 1 84 ILE QG 3.214 . 4.514 2.390 2.356 2.441 . 0 0 "[ . 1 . 2 .]" 1
2219 1 84 ILE H 1 86 TYR QE 4.715 . 7.630 5.422 5.033 6.818 . 0 0 "[ . 1 . 2 .]" 1
2220 1 84 ILE HA 1 84 ILE MD 2.615 . 3.430 2.120 1.971 2.234 . 0 0 "[ . 1 . 2 .]" 1
2221 1 84 ILE HA 1 84 ILE HG12 2.860 . 3.920 3.263 3.210 3.288 . 0 0 "[ . 1 . 2 .]" 1
2222 1 84 ILE HA 1 84 ILE QG 2.600 . 3.400 3.079 3.037 3.096 . 0 0 "[ . 1 . 2 .]" 1
2223 1 84 ILE HA 1 84 ILE HG13 2.860 . 3.920 3.774 3.748 3.785 . 0 0 "[ . 1 . 2 .]" 1
2224 1 84 ILE HA 1 84 ILE MG 2.615 . 3.430 2.345 2.307 2.382 . 0 0 "[ . 1 . 2 .]" 1
2225 1 84 ILE HA 1 85 VAL H 2.395 . 2.990 2.162 2.153 2.173 . 0 0 "[ . 1 . 2 .]" 1
2226 1 84 ILE HA 1 85 VAL MG1 3.480 . 5.160 3.615 3.542 3.651 . 0 0 "[ . 1 . 2 .]" 1
2227 1 84 ILE HA 1 93 VAL H 3.510 . 5.220 4.922 4.815 5.058 . 0 0 "[ . 1 . 2 .]" 1
2228 1 84 ILE HA 1 94 SER HA 2.395 . 2.990 2.006 1.978 2.102 . 0 0 "[ . 1 . 2 .]" 1
2229 1 84 ILE HA 1 95 ALA H 2.750 . 3.700 3.110 3.013 3.202 . 0 0 "[ . 1 . 2 .]" 1
2230 1 84 ILE HB 1 85 VAL H 3.224 . 4.534 4.275 4.258 4.309 . 0 0 "[ . 1 . 2 .]" 1
2231 1 84 ILE HB 1 86 TYR QE 4.145 . 6.490 3.469 3.142 4.994 . 0 0 "[ . 1 . 2 .]" 1
2232 1 84 ILE MD 1 84 ILE MG 3.145 . 4.490 1.929 1.832 2.070 . 0 0 "[ . 1 . 2 .]" 1
2233 1 84 ILE MD 1 94 SER HA 2.720 . 3.640 2.115 1.967 2.245 . 0 0 "[ . 1 . 2 .]" 1
2234 1 84 ILE MD 1 94 SER QB 3.229 . 4.544 1.853 1.780 1.928 0.134 23 0 "[ . 1 . 2 .]" 1
2235 1 84 ILE MD 1 95 ALA H 2.740 . 3.680 2.796 2.665 2.966 . 0 0 "[ . 1 . 2 .]" 1
2236 1 84 ILE QG 1 86 TYR QE 5.155 . 8.510 4.966 4.711 5.911 . 0 0 "[ . 1 . 2 .]" 1
2237 1 84 ILE QG 1 94 SER HA 3.685 . 5.570 4.071 4.008 4.127 . 0 0 "[ . 1 . 2 .]" 1
2238 1 84 ILE QG 1 94 SER QB 3.990 . 6.180 3.736 3.654 3.835 . 0 0 "[ . 1 . 2 .]" 1
2239 1 84 ILE HG12 1 94 SER QB 4.090 . 6.380 4.353 4.234 4.459 . 0 0 "[ . 1 . 2 .]" 1
2240 1 84 ILE HG13 1 94 SER QB 4.090 . 6.380 4.068 3.993 4.186 . 0 0 "[ . 1 . 2 .]" 1
2241 1 84 ILE MG 1 85 VAL H 2.860 . 3.920 3.009 2.935 3.120 . 0 0 "[ . 1 . 2 .]" 1
2242 1 84 ILE MG 1 85 VAL HA 3.915 . 6.144 4.167 4.129 4.202 . 0 0 "[ . 1 . 2 .]" 1
2243 1 84 ILE MG 1 85 VAL MG1 4.680 . 7.560 4.417 4.391 4.468 . 0 0 "[ . 1 . 2 .]" 1
2244 1 84 ILE MG 1 85 VAL MG2 4.680 . 7.560 4.022 3.903 4.168 . 0 0 "[ . 1 . 2 .]" 1
2245 1 84 ILE MG 1 86 TYR QD 4.195 . 6.590 3.890 3.611 4.378 . 0 0 "[ . 1 . 2 .]" 1
2246 1 84 ILE MG 1 86 TYR QE 3.990 . 6.180 3.468 3.093 3.989 . 0 0 "[ . 1 . 2 .]" 1
2247 1 84 ILE MG 1 92 GLU HA 3.235 . 4.670 3.780 3.651 3.827 . 0 0 "[ . 1 . 2 .]" 1
2248 1 84 ILE MG 1 92 GLU QB 3.825 . 5.850 3.539 2.760 3.845 . 0 0 "[ . 1 . 2 .]" 1
2249 1 84 ILE MG 1 92 GLU HG2 3.480 . 5.160 2.310 1.914 3.651 . 0 0 "[ . 1 . 2 .]" 1
2250 1 84 ILE MG 1 92 GLU QG 3.345 . 4.890 2.213 1.893 3.394 . 0 0 "[ . 1 . 2 .]" 1
2251 1 84 ILE MG 1 92 GLU HG3 3.480 . 5.160 2.984 2.208 4.259 . 0 0 "[ . 1 . 2 .]" 1
2252 1 84 ILE MG 1 93 VAL H 3.450 . 5.100 3.231 3.056 3.522 . 0 0 "[ . 1 . 2 .]" 1
2253 1 84 ILE MG 1 94 SER H 3.685 . 5.570 4.105 4.005 4.270 . 0 0 "[ . 1 . 2 .]" 1
2254 1 84 ILE MG 1 94 SER HA 3.000 . 4.200 2.802 2.676 2.985 . 0 0 "[ . 1 . 2 .]" 1
2255 1 84 ILE MG 1 94 SER QB 3.705 . 5.610 2.818 2.735 2.890 . 0 0 "[ . 1 . 2 .]" 1
2256 1 84 ILE MG 1 95 ALA H 3.825 . 5.850 4.530 4.438 4.658 . 0 0 "[ . 1 . 2 .]" 1
2257 1 85 VAL H 1 85 VAL HB 2.705 . 3.610 3.662 3.654 3.672 0.062 5 0 "[ . 1 . 2 .]" 1
2258 1 85 VAL H 1 85 VAL MG1 2.755 . 3.710 2.203 2.075 2.313 . 0 0 "[ . 1 . 2 .]" 1
2259 1 85 VAL H 1 85 VAL MG2 3.030 . 4.260 2.447 2.334 2.522 . 0 0 "[ . 1 . 2 .]" 1
2260 1 85 VAL H 1 86 TYR QD 4.720 . 7.640 4.939 4.589 6.066 . 0 0 "[ . 1 . 2 .]" 1
2261 1 85 VAL H 1 93 VAL H 2.815 . 3.830 3.844 3.789 3.864 0.034 5 0 "[ . 1 . 2 .]" 1
2262 1 85 VAL H 1 93 VAL HB 3.185 . 4.570 3.710 3.636 3.784 . 0 0 "[ . 1 . 2 .]" 1
2263 1 85 VAL H 1 93 VAL QG 4.120 . 6.440 4.013 3.856 4.094 . 0 0 "[ . 1 . 2 .]" 1
2264 1 85 VAL H 1 93 VAL O 1.950 . 2.200 2.182 2.085 2.223 0.023 16 0 "[ . 1 . 2 .]" 1
2265 1 85 VAL H 1 94 SER HA 2.720 . 3.640 3.025 2.956 3.106 . 0 0 "[ . 1 . 2 .]" 1
2266 1 85 VAL H 1 95 ALA H 2.970 . 4.140 4.066 3.941 4.159 0.019 23 0 "[ . 1 . 2 .]" 1
2267 1 85 VAL HA 1 86 TYR H 2.315 . 2.830 2.303 2.270 2.355 . 0 0 "[ . 1 . 2 .]" 1
2268 1 85 VAL HA 1 86 TYR QD 4.720 . 7.640 3.147 2.895 4.568 . 0 0 "[ . 1 . 2 .]" 1
2269 1 85 VAL HB 1 86 TYR H 2.660 . 3.520 2.714 2.594 2.796 . 0 0 "[ . 1 . 2 .]" 1
2270 1 85 VAL HB 1 87 MET ME 3.840 . 5.880 4.048 3.808 4.357 . 0 0 "[ . 1 . 2 .]" 1
2271 1 85 VAL HB 1 93 VAL HB 3.620 . 5.440 4.714 4.541 4.817 . 0 0 "[ . 1 . 2 .]" 1
2272 1 85 VAL MG1 1 86 TYR H 3.590 . 5.380 3.991 3.948 4.037 . 0 0 "[ . 1 . 2 .]" 1
2273 1 85 VAL MG1 1 87 MET ME 4.680 . 7.560 4.234 3.977 4.496 . 0 0 "[ . 1 . 2 .]" 1
2274 1 85 VAL MG1 1 93 VAL H 4.165 . 6.530 4.882 4.665 5.032 . 0 0 "[ . 1 . 2 .]" 1
2275 1 85 VAL MG1 1 93 VAL HB 3.375 . 4.950 3.861 3.631 3.959 . 0 0 "[ . 1 . 2 .]" 1
2276 1 85 VAL MG1 1 93 VAL QG 4.805 . 7.810 3.870 3.779 3.988 . 0 0 "[ . 1 . 2 .]" 1
2277 1 85 VAL MG1 1 94 SER H 4.165 . 6.530 5.274 5.252 5.301 . 0 0 "[ . 1 . 2 .]" 1
2278 1 85 VAL MG1 1 95 ALA H 3.670 . 5.540 4.112 3.983 4.235 . 0 0 "[ . 1 . 2 .]" 1
2279 1 85 VAL MG1 1 95 ALA MB 3.500 . 5.200 2.789 2.634 3.135 . 0 0 "[ . 1 . 2 .]" 1
2280 1 85 VAL MG1 1 100 PHE QE 3.675 . 5.550 2.205 1.938 2.328 . 0 0 "[ . 1 . 2 .]" 1
2281 1 85 VAL MG1 1 100 PHE HZ 2.615 . 3.430 2.059 1.981 2.197 . 0 0 "[ . 1 . 2 .]" 1
2282 1 85 VAL MG1 1 104 LEU MD1 3.855 . 5.910 3.325 3.030 3.659 . 0 0 "[ . 1 . 2 .]" 1
2283 1 85 VAL MG1 1 104 LEU MD2 3.625 . 5.450 2.616 2.444 2.795 . 0 0 "[ . 1 . 2 .]" 1
2284 1 85 VAL MG2 1 86 TYR H 2.970 . 4.140 3.321 3.239 3.396 . 0 0 "[ . 1 . 2 .]" 1
2285 1 85 VAL MG2 1 86 TYR QD 4.955 . 8.110 4.752 4.487 5.184 . 0 0 "[ . 1 . 2 .]" 1
2286 1 85 VAL MG2 1 87 MET H 3.575 . 5.350 3.504 3.280 3.713 . 0 0 "[ . 1 . 2 .]" 1
2287 1 85 VAL MG2 1 87 MET HA 3.295 . 4.790 3.776 3.734 3.824 . 0 0 "[ . 1 . 2 .]" 1
2288 1 85 VAL MG2 1 87 MET ME 3.545 . 5.290 2.161 1.907 2.438 . 0 0 "[ . 1 . 2 .]" 1
2289 1 85 VAL MG2 1 93 VAL H 3.325 . 4.850 2.784 2.300 3.120 . 0 0 "[ . 1 . 2 .]" 1
2290 1 85 VAL MG2 1 93 VAL HB 2.925 . 4.050 1.883 1.834 1.913 . 0 0 "[ . 1 . 2 .]" 1
2291 1 85 VAL MG2 1 93 VAL QG 4.510 . 7.220 2.593 2.478 2.661 . 0 0 "[ . 1 . 2 .]" 1
2292 1 85 VAL MG2 1 100 PHE HZ 3.390 . 4.980 3.978 3.872 4.071 . 0 0 "[ . 1 . 2 .]" 1
2293 1 85 VAL MG2 1 104 LEU MD1 3.545 . 5.290 2.179 1.925 2.619 . 0 0 "[ . 1 . 2 .]" 1
2294 1 85 VAL MG2 1 104 LEU MD2 3.795 . 5.790 2.992 2.797 3.191 . 0 0 "[ . 1 . 2 .]" 1
2295 1 85 VAL N 1 93 VAL O 2.950 2.700 3.200 2.739 2.703 2.778 . 0 0 "[ . 1 . 2 .]" 1
2296 1 85 VAL O 1 93 VAL H 1.950 . 2.200 1.911 1.735 2.065 . 0 0 "[ . 1 . 2 .]" 1
2297 1 85 VAL O 1 93 VAL N 2.950 2.700 3.200 2.847 2.691 2.934 0.009 6 0 "[ . 1 . 2 .]" 1
2298 1 86 TYR HA 1 87 MET H 2.350 . 2.900 2.171 2.155 2.192 . 0 0 "[ . 1 . 2 .]" 1
2299 1 86 TYR HA 1 92 GLU HA 2.425 . 3.050 2.576 2.422 2.691 . 0 0 "[ . 1 . 2 .]" 1
2300 1 86 TYR HA 1 92 GLU QB 4.090 . 6.380 4.335 3.932 4.642 . 0 0 "[ . 1 . 2 .]" 1
2301 1 86 TYR HA 1 93 VAL H 3.060 . 4.320 3.289 3.059 3.451 . 0 0 "[ . 1 . 2 .]" 1
2302 1 86 TYR HB2 1 92 GLU HA 3.650 . 5.500 5.438 5.250 5.512 0.012 18 0 "[ . 1 . 2 .]" 1
2303 1 86 TYR HB3 1 92 GLU HA 3.650 . 5.500 4.758 4.560 4.843 . 0 0 "[ . 1 . 2 .]" 1
2304 1 86 TYR QD 1 87 MET H 4.720 . 7.640 4.596 3.670 4.713 . 0 0 "[ . 1 . 2 .]" 1
2305 1 86 TYR QD 1 92 GLU HA 4.020 . 6.240 4.164 2.483 4.423 . 0 0 "[ . 1 . 2 .]" 1
2306 1 86 TYR QD 1 92 GLU QB 5.160 . 8.520 4.381 2.837 4.945 . 0 0 "[ . 1 . 2 .]" 1
2307 1 86 TYR QD 1 93 VAL H 4.485 . 7.170 4.906 4.193 5.271 . 0 0 "[ . 1 . 2 .]" 1
2308 1 86 TYR QE 1 92 GLU HA 4.715 . 7.630 4.887 3.624 5.283 . 0 0 "[ . 1 . 2 .]" 1
2309 1 86 TYR QE 1 92 GLU QB 4.935 . 8.070 4.138 2.259 4.703 . 0 0 "[ . 1 . 2 .]" 1
2310 1 86 TYR QE 1 92 GLU QG 5.155 . 8.510 3.256 2.273 3.707 . 0 0 "[ . 1 . 2 .]" 1
2311 1 87 MET H 1 87 MET QB 2.780 . 3.760 2.085 2.041 2.166 . 0 0 "[ . 1 . 2 .]" 1
2312 1 87 MET H 1 87 MET ME 3.530 . 5.260 2.875 2.555 3.386 . 0 0 "[ . 1 . 2 .]" 1
2313 1 87 MET H 1 89 ASP H 3.510 . 5.220 5.160 5.024 5.230 0.010 12 0 "[ . 1 . 2 .]" 1
2314 1 87 MET H 1 90 GLY H 3.230 . 4.660 4.620 4.481 4.682 0.022 19 0 "[ . 1 . 2 .]" 1
2315 1 87 MET H 1 91 TYR H 3.030 . 4.260 3.717 3.464 4.281 0.021 20 0 "[ . 1 . 2 .]" 1
2316 1 87 MET H 1 91 TYR O 1.950 . 2.200 2.175 2.038 2.208 0.008 15 0 "[ . 1 . 2 .]" 1
2317 1 87 MET H 1 92 GLU HA 2.765 . 3.730 3.144 2.722 3.332 . 0 0 "[ . 1 . 2 .]" 1
2318 1 87 MET H 1 93 VAL QG 4.295 . 6.790 3.256 3.031 3.509 . 0 0 "[ . 1 . 2 .]" 1
2319 1 87 MET HA 1 87 MET ME 2.815 . 3.830 2.312 1.984 2.662 . 0 0 "[ . 1 . 2 .]" 1
2320 1 87 MET HA 1 88 ASN H 2.610 . 3.420 2.264 2.260 2.270 . 0 0 "[ . 1 . 2 .]" 1
2321 1 87 MET HA 1 89 ASP H 2.845 . 3.890 3.915 3.894 3.940 0.050 23 0 "[ . 1 . 2 .]" 1
2322 1 87 MET QB 1 87 MET ME 3.225 . 4.650 2.373 1.908 2.915 . 0 0 "[ . 1 . 2 .]" 1
2323 1 87 MET QB 1 89 ASP H 2.695 . 3.590 2.542 2.427 2.749 . 0 0 "[ . 1 . 2 .]" 1
2324 1 87 MET QB 1 90 GLY H 3.255 . 4.710 2.857 2.716 3.126 . 0 0 "[ . 1 . 2 .]" 1
2325 1 87 MET QB 1 91 TYR H 2.680 . 3.560 2.203 1.996 2.556 . 0 0 "[ . 1 . 2 .]" 1
2326 1 87 MET QB 1 91 TYR QB 4.015 . 6.230 2.181 1.863 2.545 . 0 0 "[ . 1 . 2 .]" 1
2327 1 87 MET HB2 1 87 MET ME 3.360 . 4.920 2.416 1.919 3.003 . 0 0 "[ . 1 . 2 .]" 1
2328 1 87 MET HB2 1 89 ASP H 2.970 . 4.140 4.177 4.158 4.195 0.055 25 0 "[ . 1 . 2 .]" 1
2329 1 87 MET HB2 1 91 TYR H 2.935 . 4.070 3.248 2.818 4.005 . 0 0 "[ . 1 . 2 .]" 1
2330 1 87 MET HB3 1 87 MET ME 3.360 . 4.920 3.579 3.312 3.946 . 0 0 "[ . 1 . 2 .]" 1
2331 1 87 MET HB3 1 89 ASP H 2.970 . 4.140 2.564 2.443 2.787 . 0 0 "[ . 1 . 2 .]" 1
2332 1 87 MET HB3 1 91 TYR H 2.935 . 4.070 2.244 2.034 2.586 . 0 0 "[ . 1 . 2 .]" 1
2333 1 87 MET ME 1 91 TYR QB 3.845 . 5.890 4.055 3.571 4.332 . 0 0 "[ . 1 . 2 .]" 1
2334 1 87 MET ME 1 93 VAL H 3.745 . 5.690 3.884 3.572 4.253 . 0 0 "[ . 1 . 2 .]" 1
2335 1 87 MET ME 1 93 VAL QG 4.685 . 7.570 1.969 1.742 2.292 0.058 1 0 "[ . 1 . 2 .]" 1
2336 1 87 MET ME 1 104 LEU HA 3.945 . 6.090 4.802 4.661 4.956 . 0 0 "[ . 1 . 2 .]" 1
2337 1 87 MET ME 1 104 LEU MD1 3.470 . 5.140 2.316 2.160 2.538 . 0 0 "[ . 1 . 2 .]" 1
2338 1 87 MET ME 1 104 LEU HG 3.495 . 5.190 4.080 3.924 4.241 . 0 0 "[ . 1 . 2 .]" 1
2339 1 87 MET ME 1 107 TYR QD 4.055 . 6.310 4.111 3.468 4.658 . 0 0 "[ . 1 . 2 .]" 1
2340 1 87 MET ME 1 107 TYR QE 4.005 . 6.210 4.105 3.373 4.730 . 0 0 "[ . 1 . 2 .]" 1
2341 1 87 MET ME 1 110 ILE MD 3.610 . 5.420 1.855 1.706 2.044 0.094 20 0 "[ . 1 . 2 .]" 1
2342 1 87 MET ME 1 110 ILE QG 3.365 . 4.930 2.838 2.108 3.213 . 0 0 "[ . 1 . 2 .]" 1
2343 1 87 MET QG 1 89 ASP H 2.945 . 4.090 2.674 2.005 3.138 . 0 0 "[ . 1 . 2 .]" 1
2344 1 87 MET QG 1 110 ILE QG 3.950 . 6.100 3.121 2.741 3.411 . 0 0 "[ . 1 . 2 .]" 1
2345 1 87 MET N 1 91 TYR O 2.950 2.700 3.200 2.876 2.786 2.928 . 0 0 "[ . 1 . 2 .]" 1
2346 1 88 ASN H 1 89 ASP H 2.580 . 3.360 2.613 2.579 2.693 . 0 0 "[ . 1 . 2 .]" 1
2347 1 88 ASN H 1 90 GLY H 3.000 . 4.200 4.180 4.126 4.219 0.019 19 0 "[ . 1 . 2 .]" 1
2348 1 88 ASN HA 1 89 ASP H 2.660 . 3.520 3.459 3.448 3.470 . 0 0 "[ . 1 . 2 .]" 1
2349 1 88 ASN HA 1 90 GLY H 2.955 . 4.110 3.684 3.534 3.749 . 0 0 "[ . 1 . 2 .]" 1
2350 1 88 ASN QB 1 90 GLY H 4.030 . 6.260 4.778 4.591 4.858 . 0 0 "[ . 1 . 2 .]" 1
2351 1 89 ASP H 1 89 ASP HB2 2.455 . 3.110 2.195 2.193 2.204 . 0 0 "[ . 1 . 2 .]" 1
2352 1 89 ASP H 1 89 ASP HB3 2.550 . 3.300 3.484 3.481 3.489 0.189 23 0 "[ . 1 . 2 .]" 1
2353 1 89 ASP H 1 90 GLY H 2.505 . 3.210 2.543 2.495 2.645 . 0 0 "[ . 1 . 2 .]" 1
2354 1 89 ASP H 1 90 GLY QA 3.765 . 5.730 4.488 4.455 4.515 . 0 0 "[ . 1 . 2 .]" 1
2355 1 89 ASP H 1 91 TYR H 2.735 . 3.670 3.626 3.526 3.682 0.012 19 0 "[ . 1 . 2 .]" 1
2356 1 89 ASP H 1 91 TYR QE 4.715 . 7.630 5.468 4.572 6.522 . 0 0 "[ . 1 . 2 .]" 1
2357 1 89 ASP HA 1 90 GLY H 2.690 . 3.580 3.393 3.233 3.417 . 0 0 "[ . 1 . 2 .]" 1
2358 1 89 ASP HB2 1 91 TYR H 3.650 . 5.500 3.533 3.155 3.654 . 0 0 "[ . 1 . 2 .]" 1
2359 1 89 ASP HB3 1 90 GLY H 2.985 . 4.170 3.970 3.931 4.194 0.024 8 0 "[ . 1 . 2 .]" 1
2360 1 90 GLY H 1 91 TYR H 2.550 . 3.300 2.173 2.091 2.666 . 0 0 "[ . 1 . 2 .]" 1
2361 1 90 GLY H 1 91 TYR QB 3.625 . 5.450 4.261 4.030 4.494 . 0 0 "[ . 1 . 2 .]" 1
2362 1 91 TYR H 1 91 TYR HB2 2.800 . 3.800 2.486 2.310 2.735 . 0 0 "[ . 1 . 2 .]" 1
2363 1 91 TYR H 1 91 TYR QB 2.565 . 3.330 2.446 2.282 2.673 . 0 0 "[ . 1 . 2 .]" 1
2364 1 91 TYR H 1 91 TYR HB3 2.800 . 3.800 3.657 3.560 3.761 . 0 0 "[ . 1 . 2 .]" 1
2365 1 91 TYR H 1 91 TYR QE 4.715 . 7.630 4.809 4.527 5.406 . 0 0 "[ . 1 . 2 .]" 1
2366 1 91 TYR HA 1 92 GLU H 2.285 . 2.770 2.462 2.308 2.555 . 0 0 "[ . 1 . 2 .]" 1
2367 1 91 TYR QB 1 92 GLU H 2.580 . 3.360 2.291 2.087 2.654 . 0 0 "[ . 1 . 2 .]" 1
2368 1 91 TYR HB2 1 92 GLU H 2.720 . 3.640 3.546 3.168 3.660 0.020 1 0 "[ . 1 . 2 .]" 1
2369 1 91 TYR HB3 1 92 GLU H 2.720 . 3.640 2.323 2.106 2.731 . 0 0 "[ . 1 . 2 .]" 1
2370 1 91 TYR QD 1 92 GLU H 4.720 . 7.640 3.630 3.113 4.154 . 0 0 "[ . 1 . 2 .]" 1
2371 1 92 GLU H 1 93 VAL H 3.060 . 4.320 4.246 4.070 4.330 0.010 5 0 "[ . 1 . 2 .]" 1
2372 1 92 GLU H 1 93 VAL QG 4.385 . 6.970 3.857 3.687 4.109 . 0 0 "[ . 1 . 2 .]" 1
2373 1 92 GLU HA 1 92 GLU HG2 2.660 . 3.520 2.816 2.379 3.367 . 0 0 "[ . 1 . 2 .]" 1
2374 1 92 GLU HA 1 92 GLU QG 2.550 . 3.300 2.331 2.109 2.503 . 0 0 "[ . 1 . 2 .]" 1
2375 1 92 GLU HA 1 92 GLU HG3 2.660 . 3.520 2.635 2.132 3.458 . 0 0 "[ . 1 . 2 .]" 1
2376 1 92 GLU HA 1 93 VAL H 2.315 . 2.830 2.143 2.138 2.149 . 0 0 "[ . 1 . 2 .]" 1
2377 1 92 GLU QG 1 93 VAL H 3.229 . 4.544 3.117 2.747 3.915 . 0 0 "[ . 1 . 2 .]" 1
2378 1 93 VAL H 1 94 SER H 3.224 . 4.534 4.477 4.454 4.504 . 0 0 "[ . 1 . 2 .]" 1
2379 1 93 VAL HA 1 94 SER H 2.160 . 2.520 2.347 2.322 2.362 . 0 0 "[ . 1 . 2 .]" 1
2380 1 93 VAL HB 1 94 SER H 3.060 . 4.320 3.535 3.444 3.617 . 0 0 "[ . 1 . 2 .]" 1
2381 1 93 VAL HB 1 104 LEU MD1 3.340 . 4.880 3.233 2.661 3.708 . 0 0 "[ . 1 . 2 .]" 1
2382 1 93 VAL HB 1 104 LEU MD2 4.165 . 6.530 4.637 4.302 4.810 . 0 0 "[ . 1 . 2 .]" 1
2383 1 93 VAL QG 1 94 SER H 3.395 . 4.990 1.913 1.889 1.944 . 0 0 "[ . 1 . 2 .]" 1
2384 1 93 VAL QG 1 94 SER HA 4.045 . 6.290 3.686 3.612 3.754 . 0 0 "[ . 1 . 2 .]" 1
2385 1 93 VAL QG 1 94 SER QB 5.260 . 8.720 4.034 3.971 4.081 . 0 0 "[ . 1 . 2 .]" 1
2386 1 93 VAL QG 1 95 ALA HA 4.555 . 7.310 4.679 4.638 4.700 . 0 0 "[ . 1 . 2 .]" 1
2387 1 93 VAL QG 1 95 ALA MB 4.420 . 7.040 3.419 3.283 3.564 . 0 0 "[ . 1 . 2 .]" 1
2388 1 93 VAL QG 1 104 LEU HA 4.200 . 6.600 4.046 3.528 4.362 . 0 0 "[ . 1 . 2 .]" 1
2389 1 93 VAL QG 1 104 LEU QB 5.385 . 8.970 4.856 4.391 5.179 . 0 0 "[ . 1 . 2 .]" 1
2390 1 93 VAL QG 1 104 LEU MD1 4.155 . 6.510 2.529 2.124 2.837 . 0 0 "[ . 1 . 2 .]" 1
2391 1 93 VAL QG 1 104 LEU MD2 4.665 . 7.530 3.695 3.448 3.864 . 0 0 "[ . 1 . 2 .]" 1
2392 1 93 VAL QG 1 107 TYR QD 4.945 . 8.090 2.775 2.351 3.380 . 0 0 "[ . 1 . 2 .]" 1
2393 1 93 VAL QG 1 107 TYR QE 4.725 . 7.650 2.182 1.710 2.806 0.090 22 0 "[ . 1 . 2 .]" 1
2394 1 93 VAL QG 1 110 ILE MD 4.960 . 8.120 2.726 1.967 3.083 . 0 0 "[ . 1 . 2 .]" 1
2395 1 94 SER H 1 95 ALA H 3.200 . 4.600 4.458 4.440 4.471 . 0 0 "[ . 1 . 2 .]" 1
2396 1 94 SER H 1 95 ALA MB 3.945 . 6.090 4.490 4.408 4.556 . 0 0 "[ . 1 . 2 .]" 1
2397 1 94 SER H 1 107 TYR QE 4.715 . 7.630 5.159 4.179 5.739 . 0 0 "[ . 1 . 2 .]" 1
2398 1 94 SER HA 1 95 ALA H 2.285 . 2.770 2.243 2.211 2.260 . 0 0 "[ . 1 . 2 .]" 1
2399 1 94 SER HA 1 95 ALA MB 3.420 . 5.040 3.872 3.845 3.906 . 0 0 "[ . 1 . 2 .]" 1
2400 1 94 SER QB 1 95 ALA H 3.035 . 4.270 2.781 2.714 2.890 . 0 0 "[ . 1 . 2 .]" 1
2401 1 94 SER QB 1 95 ALA HA 3.780 . 5.760 4.195 3.995 4.318 . 0 0 "[ . 1 . 2 .]" 1
2402 1 94 SER QB 1 95 ALA MB 4.600 . 7.400 4.519 4.421 4.580 . 0 0 "[ . 1 . 2 .]" 1
2403 1 95 ALA H 1 95 ALA MB 2.660 . 3.520 2.770 2.724 2.815 . 0 0 "[ . 1 . 2 .]" 1
2404 1 95 ALA H 1 96 THR H 3.370 . 4.940 4.335 4.260 4.361 . 0 0 "[ . 1 . 2 .]" 1
2405 1 95 ALA H 1 100 PHE QD 4.710 . 7.620 5.689 5.277 5.930 . 0 0 "[ . 1 . 2 .]" 1
2406 1 95 ALA H 1 104 LEU MD2 4.165 . 6.530 5.174 4.658 5.392 . 0 0 "[ . 1 . 2 .]" 1
2407 1 95 ALA HA 1 96 THR H 2.315 . 2.830 2.515 2.259 2.623 . 0 0 "[ . 1 . 2 .]" 1
2408 1 95 ALA HA 1 96 THR MG 3.620 . 5.440 4.032 3.816 4.226 . 0 0 "[ . 1 . 2 .]" 1
2409 1 95 ALA HA 1 103 LYS QD 2.600 . 3.400 2.333 1.871 2.838 . 0 0 "[ . 1 . 2 .]" 1
2410 1 95 ALA HA 1 103 LYS QE 3.980 . 6.160 3.280 2.024 4.538 . 0 0 "[ . 1 . 2 .]" 1
2411 1 95 ALA HA 1 104 LEU MD2 3.760 . 5.720 4.541 4.295 4.716 . 0 0 "[ . 1 . 2 .]" 1
2412 1 95 ALA MB 1 96 THR H 2.615 . 3.430 2.179 1.967 2.702 . 0 0 "[ . 1 . 2 .]" 1
2413 1 95 ALA MB 1 96 THR HA 3.590 . 5.380 4.029 3.943 4.228 . 0 0 "[ . 1 . 2 .]" 1
2414 1 95 ALA MB 1 97 ILE HA 4.165 . 6.530 5.079 5.017 5.134 . 0 0 "[ . 1 . 2 .]" 1
2415 1 95 ALA MB 1 100 PHE H 4.025 . 6.250 4.526 4.439 4.644 . 0 0 "[ . 1 . 2 .]" 1
2416 1 95 ALA MB 1 100 PHE HA 2.720 . 3.640 2.268 2.114 2.416 . 0 0 "[ . 1 . 2 .]" 1
2417 1 95 ALA MB 1 100 PHE QB 4.075 . 6.350 3.705 3.610 3.838 . 0 0 "[ . 1 . 2 .]" 1
2418 1 95 ALA MB 1 100 PHE QD 3.955 . 6.110 3.228 2.752 3.412 . 0 0 "[ . 1 . 2 .]" 1
2419 1 95 ALA MB 1 100 PHE QE 3.925 . 6.050 3.674 3.269 3.823 . 0 0 "[ . 1 . 2 .]" 1
2420 1 95 ALA MB 1 100 PHE HZ 4.070 . 6.340 4.727 4.567 4.874 . 0 0 "[ . 1 . 2 .]" 1
2421 1 95 ALA MB 1 103 LYS H 3.420 . 5.040 4.059 4.012 4.103 . 0 0 "[ . 1 . 2 .]" 1
2422 1 95 ALA MB 1 103 LYS HA 3.745 . 5.690 4.099 4.000 4.165 . 0 0 "[ . 1 . 2 .]" 1
2423 1 95 ALA MB 1 103 LYS HB2 2.830 . 3.860 2.211 2.110 2.281 . 0 0 "[ . 1 . 2 .]" 1
2424 1 95 ALA MB 1 103 LYS HB3 2.925 . 4.050 1.946 1.883 2.002 . 0 0 "[ . 1 . 2 .]" 1
2425 1 95 ALA MB 1 103 LYS QD 3.485 . 5.170 2.855 2.444 3.164 . 0 0 "[ . 1 . 2 .]" 1
2426 1 95 ALA MB 1 103 LYS HG2 3.375 . 4.950 3.260 3.149 3.549 . 0 0 "[ . 1 . 2 .]" 1
2427 1 95 ALA MB 1 103 LYS QG 3.145 . 4.490 1.954 1.913 2.245 . 0 0 "[ . 1 . 2 .]" 1
2428 1 95 ALA MB 1 103 LYS HG3 3.375 . 4.950 1.970 1.927 2.270 . 0 0 "[ . 1 . 2 .]" 1
2429 1 95 ALA MB 1 104 LEU MD1 3.935 . 6.070 3.372 2.961 3.618 . 0 0 "[ . 1 . 2 .]" 1
2430 1 95 ALA MB 1 104 LEU MD2 3.485 . 5.170 2.337 2.069 2.490 . 0 0 "[ . 1 . 2 .]" 1
2431 1 96 THR H 1 96 THR HB 2.845 . 3.890 3.613 3.519 3.687 . 0 0 "[ . 1 . 2 .]" 1
2432 1 96 THR H 1 96 THR MG 3.050 . 4.300 3.313 3.101 3.444 . 0 0 "[ . 1 . 2 .]" 1
2433 1 96 THR H 1 100 PHE HA 2.860 . 3.920 3.161 2.870 3.765 . 0 0 "[ . 1 . 2 .]" 1
2434 1 96 THR H 1 100 PHE QD 4.710 . 7.620 4.644 3.951 5.252 . 0 0 "[ . 1 . 2 .]" 1
2435 1 96 THR H 1 103 LYS HA 3.590 . 5.380 5.481 5.444 5.540 0.160 3 0 "[ . 1 . 2 .]" 1
2436 1 96 THR H 1 103 LYS HB2 3.045 . 4.290 3.698 3.451 4.098 . 0 0 "[ . 1 . 2 .]" 1
2437 1 96 THR H 1 103 LYS QD 3.530 . 5.260 3.487 2.422 4.105 . 0 0 "[ . 1 . 2 .]" 1
2438 1 96 THR H 1 104 LEU MD2 3.980 . 6.160 4.817 4.432 5.190 . 0 0 "[ . 1 . 2 .]" 1
2439 1 96 THR HA 1 96 THR MG 2.615 . 3.430 2.198 2.089 2.296 . 0 0 "[ . 1 . 2 .]" 1
2440 1 96 THR HA 1 97 ILE H 2.550 . 3.300 2.299 2.254 2.335 . 0 0 "[ . 1 . 2 .]" 1
2441 1 96 THR HA 1 98 ARG H 2.875 . 3.950 3.986 3.964 4.010 0.060 9 0 "[ . 1 . 2 .]" 1
2442 1 96 THR HB 1 97 ILE H 2.565 . 3.330 2.822 2.714 2.928 . 0 0 "[ . 1 . 2 .]" 1
2443 1 96 THR HB 1 97 ILE MG 4.165 . 6.530 5.458 5.426 5.477 . 0 0 "[ . 1 . 2 .]" 1
2444 1 96 THR HB 1 98 ARG H 2.660 . 3.520 2.316 2.266 2.368 . 0 0 "[ . 1 . 2 .]" 1
2445 1 96 THR HB 1 98 ARG QB 4.040 . 6.280 3.828 3.511 3.990 . 0 0 "[ . 1 . 2 .]" 1
2446 1 96 THR HB 1 98 ARG QG 3.900 . 6.114 2.148 1.978 2.740 . 0 0 "[ . 1 . 2 .]" 1
2447 1 96 THR MG 1 97 ILE H 3.015 . 4.230 3.403 3.318 3.483 . 0 0 "[ . 1 . 2 .]" 1
2448 1 96 THR MG 1 98 ARG H 3.310 . 4.820 3.896 3.850 3.948 . 0 0 "[ . 1 . 2 .]" 1
2449 1 96 THR MG 1 98 ARG QB 4.600 . 7.400 4.662 4.446 4.784 . 0 0 "[ . 1 . 2 .]" 1
2450 1 96 THR MG 1 98 ARG QD 4.355 . 6.910 2.868 2.154 4.717 . 0 0 "[ . 1 . 2 .]" 1
2451 1 96 THR MG 1 98 ARG QG 3.640 . 5.480 3.323 3.197 3.498 . 0 0 "[ . 1 . 2 .]" 1
2452 1 96 THR MG 1 103 LYS QG 4.030 . 6.260 4.224 4.029 4.441 . 0 0 "[ . 1 . 2 .]" 1
2453 1 97 ILE H 1 97 ILE QG 3.590 . 5.380 2.115 2.024 2.201 . 0 0 "[ . 1 . 2 .]" 1
2454 1 97 ILE H 1 97 ILE MG 3.295 . 4.790 3.779 3.770 3.788 . 0 0 "[ . 1 . 2 .]" 1
2455 1 97 ILE H 1 98 ARG H 2.705 . 3.610 2.627 2.537 2.709 . 0 0 "[ . 1 . 2 .]" 1
2456 1 97 ILE HA 1 97 ILE MD 3.155 . 4.510 3.743 3.681 3.763 . 0 0 "[ . 1 . 2 .]" 1
2457 1 97 ILE HA 1 97 ILE MG 2.615 . 3.430 2.370 2.340 2.395 . 0 0 "[ . 1 . 2 .]" 1
2458 1 97 ILE HA 1 100 PHE H 2.845 . 3.890 3.512 3.412 3.613 . 0 0 "[ . 1 . 2 .]" 1
2459 1 97 ILE HA 1 100 PHE HA 3.310 . 4.820 4.475 4.328 4.591 . 0 0 "[ . 1 . 2 .]" 1
2460 1 97 ILE HA 1 100 PHE QB 3.515 . 5.230 2.358 2.267 2.443 . 0 0 "[ . 1 . 2 .]" 1
2461 1 97 ILE HA 1 100 PHE QD 4.200 . 6.600 3.318 3.164 3.585 . 0 0 "[ . 1 . 2 .]" 1
2462 1 97 ILE HB 1 98 ARG H 2.595 . 3.390 3.039 2.945 3.119 . 0 0 "[ . 1 . 2 .]" 1
2463 1 97 ILE QG 1 98 ARG H 4.090 . 6.380 4.084 4.028 4.146 . 0 0 "[ . 1 . 2 .]" 1
2464 1 97 ILE MG 1 98 ARG H 3.265 . 4.730 3.784 3.715 3.833 . 0 0 "[ . 1 . 2 .]" 1
2465 1 97 ILE MG 1 98 ARG HA 3.360 . 4.920 3.640 3.598 3.690 . 0 0 "[ . 1 . 2 .]" 1
2466 1 97 ILE MG 1 98 ARG QB 4.275 . 6.750 4.602 4.440 4.914 . 0 0 "[ . 1 . 2 .]" 1
2467 1 97 ILE MG 1 98 ARG QD 4.600 . 7.400 5.097 3.177 5.482 . 0 0 "[ . 1 . 2 .]" 1
2468 1 97 ILE MG 1 100 PHE QB 4.540 . 7.280 3.763 3.633 3.872 . 0 0 "[ . 1 . 2 .]" 1
2469 1 98 ARG H 1 98 ARG QD 3.840 . 5.880 2.799 2.099 3.997 . 0 0 "[ . 1 . 2 .]" 1
2470 1 98 ARG H 1 98 ARG QG 3.125 . 4.450 2.042 1.951 2.298 . 0 0 "[ . 1 . 2 .]" 1
2471 1 98 ARG H 1 99 GLN QG 3.580 . 5.360 4.345 3.958 4.738 . 0 0 "[ . 1 . 2 .]" 1
2472 1 98 ARG HA 1 98 ARG QD 3.700 . 5.600 3.936 2.177 4.231 . 0 0 "[ . 1 . 2 .]" 1
2473 1 98 ARG HA 1 99 GLN QG 4.090 . 6.380 4.195 4.081 4.410 . 0 0 "[ . 1 . 2 .]" 1
2474 1 98 ARG HA 1 100 PHE H 3.075 . 4.350 4.341 4.279 4.378 0.028 7 0 "[ . 1 . 2 .]" 1
2475 1 98 ARG QB 1 99 GLN HG2 3.560 . 5.320 3.321 2.426 4.416 . 0 0 "[ . 1 . 2 .]" 1
2476 1 98 ARG QB 1 99 GLN HG3 3.560 . 5.320 3.274 2.679 4.249 . 0 0 "[ . 1 . 2 .]" 1
2477 1 98 ARG QD 1 99 GLN HG2 4.090 . 6.380 5.178 4.751 5.715 . 0 0 "[ . 1 . 2 .]" 1
2478 1 98 ARG QD 1 99 GLN QG 3.905 . 6.124 4.091 3.659 4.842 . 0 0 "[ . 1 . 2 .]" 1
2479 1 98 ARG QD 1 99 GLN HG3 4.090 . 6.380 4.351 3.776 5.569 . 0 0 "[ . 1 . 2 .]" 1
2480 1 98 ARG QG 1 99 GLN HG2 3.280 . 4.760 3.333 2.585 4.322 . 0 0 "[ . 1 . 2 .]" 1
2481 1 98 ARG QG 1 99 GLN QG 3.160 . 4.520 2.390 1.904 3.727 . 0 0 "[ . 1 . 2 .]" 1
2482 1 98 ARG QG 1 99 GLN HG3 3.280 . 4.760 2.495 1.951 4.079 . 0 0 "[ . 1 . 2 .]" 1
2483 1 99 GLN HA 1 99 GLN HG2 2.750 . 3.700 2.598 2.345 3.082 . 0 0 "[ . 1 . 2 .]" 1
2484 1 99 GLN HA 1 99 GLN QG 2.475 . 3.150 2.516 2.312 2.709 . 0 0 "[ . 1 . 2 .]" 1
2485 1 99 GLN HA 1 99 GLN HG3 2.750 . 3.700 3.510 2.779 3.734 0.034 20 0 "[ . 1 . 2 .]" 1
2486 1 99 GLN QB 1 100 PHE H 3.090 . 4.380 3.843 3.830 3.862 . 0 0 "[ . 1 . 2 .]" 1
2487 1 99 GLN QB 1 102 ASP H 3.625 . 5.450 3.613 3.495 3.747 . 0 0 "[ . 1 . 2 .]" 1
2488 1 99 GLN QB 1 102 ASP QB 2.620 . 3.440 2.150 1.934 2.398 . 0 0 "[ . 1 . 2 .]" 1
2489 1 99 GLN QB 1 103 LYS H 3.410 . 5.020 3.330 3.176 3.480 . 0 0 "[ . 1 . 2 .]" 1
2490 1 99 GLN QB 1 103 LYS HA 3.765 . 5.730 4.496 4.295 4.712 . 0 0 "[ . 1 . 2 .]" 1
2491 1 99 GLN QB 1 103 LYS QD 4.530 . 7.260 4.093 3.781 4.526 . 0 0 "[ . 1 . 2 .]" 1
2492 1 99 GLN QB 1 103 LYS QE 3.900 . 6.114 3.448 2.716 4.054 . 0 0 "[ . 1 . 2 .]" 1
2493 1 99 GLN HB2 1 99 GLN HE21 4.075 . 6.350 3.770 2.037 4.610 . 0 0 "[ . 1 . 2 .]" 1
2494 1 99 GLN HB2 1 99 GLN HE22 4.075 . 6.350 4.544 3.564 5.271 . 0 0 "[ . 1 . 2 .]" 1
2495 1 99 GLN HB2 1 100 PHE H 3.230 . 4.660 4.166 4.152 4.202 . 0 0 "[ . 1 . 2 .]" 1
2496 1 99 GLN HB2 1 102 ASP HB2 3.225 . 4.650 4.578 4.412 4.655 0.005 4 0 "[ . 1 . 2 .]" 1
2497 1 99 GLN HB2 1 102 ASP HB3 3.225 . 4.650 3.594 3.349 3.940 . 0 0 "[ . 1 . 2 .]" 1
2498 1 99 GLN HB2 1 103 LYS QE 4.090 . 6.380 3.636 2.913 4.182 . 0 0 "[ . 1 . 2 .]" 1
2499 1 99 GLN HB3 1 99 GLN HE21 4.075 . 6.350 3.719 2.364 4.537 . 0 0 "[ . 1 . 2 .]" 1
2500 1 99 GLN HB3 1 99 GLN HE22 4.075 . 6.350 4.159 3.441 4.868 . 0 0 "[ . 1 . 2 .]" 1
2501 1 99 GLN HB3 1 100 PHE H 3.230 . 4.660 4.510 4.422 4.582 . 0 0 "[ . 1 . 2 .]" 1
2502 1 99 GLN HB3 1 102 ASP HB2 3.225 . 4.650 2.954 2.749 3.187 . 0 0 "[ . 1 . 2 .]" 1
2503 1 99 GLN HB3 1 102 ASP HB3 3.225 . 4.650 2.241 1.994 2.536 . 0 0 "[ . 1 . 2 .]" 1
2504 1 99 GLN HB3 1 103 LYS QE 4.090 . 6.380 4.399 3.170 5.445 . 0 0 "[ . 1 . 2 .]" 1
2505 1 99 GLN QE 1 102 ASP QB 4.520 . 7.240 4.360 3.027 5.567 . 0 0 "[ . 1 . 2 .]" 1
2506 1 99 GLN QG 1 100 PHE H 4.090 . 6.380 4.445 4.345 4.571 . 0 0 "[ . 1 . 2 .]" 1
2507 1 99 GLN QG 1 102 ASP QB 4.430 . 7.060 3.903 3.572 4.317 . 0 0 "[ . 1 . 2 .]" 1
2508 1 100 PHE H 1 101 ALA H 2.750 . 3.700 2.827 2.745 2.894 . 0 0 "[ . 1 . 2 .]" 1
2509 1 100 PHE H 1 101 ALA MB 3.885 . 5.970 4.461 4.405 4.521 . 0 0 "[ . 1 . 2 .]" 1
2510 1 100 PHE HA 1 103 LYS H 2.750 . 3.700 3.501 3.421 3.589 . 0 0 "[ . 1 . 2 .]" 1
2511 1 100 PHE HA 1 103 LYS HB2 3.170 . 4.540 2.415 2.278 2.524 . 0 0 "[ . 1 . 2 .]" 1
2512 1 100 PHE HA 1 103 LYS HB3 3.140 . 4.480 3.916 3.705 4.067 . 0 0 "[ . 1 . 2 .]" 1
2513 1 100 PHE HA 1 104 LEU MD2 3.295 . 4.790 3.187 2.932 3.319 . 0 0 "[ . 1 . 2 .]" 1
2514 1 100 PHE QB 1 101 ALA MB 4.600 . 7.400 3.767 3.696 3.837 . 0 0 "[ . 1 . 2 .]" 1
2515 1 100 PHE QB 1 104 LEU MD2 4.200 . 6.600 3.911 3.758 4.012 . 0 0 "[ . 1 . 2 .]" 1
2516 1 100 PHE QD 1 101 ALA H 4.155 . 6.510 3.239 3.124 3.437 . 0 0 "[ . 1 . 2 .]" 1
2517 1 100 PHE QD 1 101 ALA HA 4.185 . 6.570 2.766 2.682 3.153 . 0 0 "[ . 1 . 2 .]" 1
2518 1 100 PHE QD 1 101 ALA MB 4.355 . 6.910 3.664 3.580 3.734 . 0 0 "[ . 1 . 2 .]" 1
2519 1 100 PHE QD 1 104 LEU MD2 4.340 . 6.880 2.662 2.517 2.971 . 0 0 "[ . 1 . 2 .]" 1
2520 1 100 PHE QE 1 104 LEU MD2 4.235 . 6.670 2.663 2.543 2.933 . 0 0 "[ . 1 . 2 .]" 1
2521 1 100 PHE HZ 1 104 LEU MD2 3.030 . 4.260 3.266 3.133 3.368 . 0 0 "[ . 1 . 2 .]" 1
2522 1 100 PHE O 1 104 LEU H 1.950 . 2.200 2.066 2.012 2.160 . 0 0 "[ . 1 . 2 .]" 1
2523 1 100 PHE O 1 104 LEU N 2.950 2.700 3.200 3.035 2.984 3.123 . 0 0 "[ . 1 . 2 .]" 1
2524 1 101 ALA H 1 101 ALA MB 2.705 . 3.610 2.227 2.201 2.241 . 0 0 "[ . 1 . 2 .]" 1
2525 1 101 ALA H 1 102 ASP H 2.565 . 3.330 2.708 2.615 2.760 . 0 0 "[ . 1 . 2 .]" 1
2526 1 101 ALA HA 1 102 ASP H 2.625 . 3.450 3.529 3.501 3.538 0.088 4 0 "[ . 1 . 2 .]" 1
2527 1 101 ALA HA 1 104 LEU H 2.720 . 3.640 3.696 3.672 3.720 0.080 23 0 "[ . 1 . 2 .]" 1
2528 1 101 ALA MB 1 102 ASP H 2.720 . 3.640 2.467 2.387 2.630 . 0 0 "[ . 1 . 2 .]" 1
2529 1 101 ALA MB 1 102 ASP HA 3.325 . 4.850 3.826 3.801 3.874 . 0 0 "[ . 1 . 2 .]" 1
2530 1 101 ALA MB 1 102 ASP HB2 3.930 . 6.060 3.898 3.810 4.006 . 0 0 "[ . 1 . 2 .]" 1
2531 1 101 ALA MB 1 102 ASP QB 3.685 . 5.570 3.751 3.687 3.836 . 0 0 "[ . 1 . 2 .]" 1
2532 1 101 ALA MB 1 102 ASP HB3 3.930 . 6.060 4.887 4.808 4.935 . 0 0 "[ . 1 . 2 .]" 1
2533 1 101 ALA MB 1 104 LEU H 4.025 . 6.250 4.825 4.791 4.865 . 0 0 "[ . 1 . 2 .]" 1
2534 1 101 ALA MB 1 105 SER H 4.165 . 6.530 4.528 4.499 4.631 . 0 0 "[ . 1 . 2 .]" 1
2535 1 101 ALA MB 1 105 SER QB 4.170 . 6.540 3.691 3.413 4.215 . 0 0 "[ . 1 . 2 .]" 1
2536 1 102 ASP H 1 103 LYS H 2.455 . 3.110 2.611 2.522 2.672 . 0 0 "[ . 1 . 2 .]" 1
2537 1 102 ASP H 1 103 LYS QG 4.090 . 6.380 4.602 4.491 4.659 . 0 0 "[ . 1 . 2 .]" 1
2538 1 102 ASP HA 1 105 SER H 3.015 . 4.230 3.296 3.140 3.387 . 0 0 "[ . 1 . 2 .]" 1
2539 1 102 ASP HA 1 105 SER HB2 2.815 . 3.830 2.696 1.940 3.794 . 0 0 "[ . 1 . 2 .]" 1
2540 1 102 ASP HA 1 105 SER HB3 2.815 . 3.830 2.394 1.982 3.452 . 0 0 "[ . 1 . 2 .]" 1
2541 1 102 ASP O 1 106 HIS H 1.950 . 2.200 2.255 2.216 2.302 0.102 8 0 "[ . 1 . 2 .]" 1
2542 1 102 ASP O 1 106 HIS N 2.950 2.700 3.200 3.107 3.061 3.184 . 0 0 "[ . 1 . 2 .]" 1
2543 1 103 LYS H 1 103 LYS HB2 2.395 . 2.990 2.284 2.252 2.309 . 0 0 "[ . 1 . 2 .]" 1
2544 1 103 LYS H 1 103 LYS QE 4.090 . 6.380 4.233 3.254 5.156 . 0 0 "[ . 1 . 2 .]" 1
2545 1 103 LYS H 1 104 LEU H 2.550 . 3.300 2.873 2.801 2.926 . 0 0 "[ . 1 . 2 .]" 1
2546 1 103 LYS H 1 104 LEU MD2 3.450 . 5.100 3.880 3.781 3.942 . 0 0 "[ . 1 . 2 .]" 1
2547 1 103 LYS H 1 105 SER H 3.075 . 4.350 3.761 3.697 3.822 . 0 0 "[ . 1 . 2 .]" 1
2548 1 103 LYS HA 1 103 LYS HB3 2.270 . 2.740 2.600 2.593 2.606 . 0 0 "[ . 1 . 2 .]" 1
2549 1 103 LYS HA 1 103 LYS QD 3.160 . 4.520 2.408 1.959 3.168 . 0 0 "[ . 1 . 2 .]" 1
2550 1 103 LYS HA 1 103 LYS QE 3.935 . 6.070 2.930 1.901 4.300 . 0 0 "[ . 1 . 2 .]" 1
2551 1 103 LYS HA 1 103 LYS HG2 2.735 . 3.670 2.683 2.391 2.895 . 0 0 "[ . 1 . 2 .]" 1
2552 1 103 LYS HA 1 103 LYS HG3 2.735 . 3.670 3.644 3.622 3.661 . 0 0 "[ . 1 . 2 .]" 1
2553 1 103 LYS HA 1 104 LEU MD2 3.620 . 5.440 4.196 4.119 4.274 . 0 0 "[ . 1 . 2 .]" 1
2554 1 103 LYS HB2 1 103 LYS QE 3.810 . 5.820 4.028 3.748 4.283 . 0 0 "[ . 1 . 2 .]" 1
2555 1 103 LYS HB2 1 104 LEU H 2.750 . 3.700 2.501 2.447 2.539 . 0 0 "[ . 1 . 2 .]" 1
2556 1 103 LYS HB2 1 104 LEU MD2 3.205 . 4.610 2.425 2.344 2.517 . 0 0 "[ . 1 . 2 .]" 1
2557 1 103 LYS HB2 1 105 SER H 3.230 . 4.660 4.584 4.530 4.649 . 0 0 "[ . 1 . 2 .]" 1
2558 1 103 LYS HB3 1 104 LEU H 2.690 . 3.580 3.131 3.099 3.194 . 0 0 "[ . 1 . 2 .]" 1
2559 1 103 LYS HB3 1 104 LEU MD1 3.375 . 4.950 3.606 3.392 3.808 . 0 0 "[ . 1 . 2 .]" 1
2560 1 103 LYS HB3 1 104 LEU MD2 3.125 . 4.450 2.483 2.372 2.593 . 0 0 "[ . 1 . 2 .]" 1
2561 1 103 LYS HB3 1 105 SER H 3.400 . 5.000 5.079 5.050 5.095 0.095 15 0 "[ . 1 . 2 .]" 1
2562 1 103 LYS QD 1 104 LEU H 4.090 . 6.380 4.799 4.690 4.986 . 0 0 "[ . 1 . 2 .]" 1
2563 1 103 LYS QD 1 104 LEU MD2 4.415 . 7.030 4.238 4.021 4.451 . 0 0 "[ . 1 . 2 .]" 1
2564 1 103 LYS QE 1 104 LEU MD2 4.600 . 7.400 5.196 4.718 5.452 . 0 0 "[ . 1 . 2 .]" 1
2565 1 103 LYS QG 1 104 LEU MD2 3.610 . 5.420 3.787 3.708 3.920 . 0 0 "[ . 1 . 2 .]" 1
2566 1 103 LYS HG2 1 104 LEU MD2 3.870 . 5.940 4.560 4.479 4.749 . 0 0 "[ . 1 . 2 .]" 1
2567 1 103 LYS HG3 1 104 LEU MD2 3.870 . 5.940 4.047 3.946 4.177 . 0 0 "[ . 1 . 2 .]" 1
2568 1 104 LEU H 1 104 LEU MD1 3.360 . 4.920 3.526 3.413 3.611 . 0 0 "[ . 1 . 2 .]" 1
2569 1 104 LEU H 1 104 LEU MD2 2.985 . 4.170 2.055 1.977 2.110 . 0 0 "[ . 1 . 2 .]" 1
2570 1 104 LEU H 1 105 SER H 2.580 . 3.360 2.417 2.382 2.481 . 0 0 "[ . 1 . 2 .]" 1
2571 1 104 LEU HA 1 104 LEU MD1 2.615 . 3.430 1.973 1.929 2.022 . 0 0 "[ . 1 . 2 .]" 1
2572 1 104 LEU HA 1 104 LEU MD2 2.755 . 3.710 2.905 2.832 2.980 . 0 0 "[ . 1 . 2 .]" 1
2573 1 104 LEU HA 1 104 LEU HG 2.735 . 3.670 3.675 3.659 3.684 0.014 25 0 "[ . 1 . 2 .]" 1
2574 1 104 LEU HA 1 107 TYR QD 4.380 . 6.960 3.291 2.761 3.717 . 0 0 "[ . 1 . 2 .]" 1
2575 1 104 LEU QB 1 105 SER H 2.920 . 4.040 3.008 2.937 3.113 . 0 0 "[ . 1 . 2 .]" 1
2576 1 104 LEU QB 1 110 ILE MD 3.535 . 5.270 2.874 2.676 3.101 . 0 0 "[ . 1 . 2 .]" 1
2577 1 104 LEU QB 1 110 ILE MG 3.535 . 5.270 3.160 2.875 3.412 . 0 0 "[ . 1 . 2 .]" 1
2578 1 104 LEU HB2 1 105 SER H 3.030 . 4.260 3.130 3.051 3.246 . 0 0 "[ . 1 . 2 .]" 1
2579 1 104 LEU HB3 1 105 SER H 3.030 . 4.260 3.899 3.826 4.000 . 0 0 "[ . 1 . 2 .]" 1
2580 1 104 LEU MD1 1 105 SER H 3.915 . 6.144 4.675 4.645 4.691 . 0 0 "[ . 1 . 2 .]" 1
2581 1 104 LEU MD1 1 107 TYR HB2 3.685 . 5.570 3.216 2.969 3.509 . 0 0 "[ . 1 . 2 .]" 1
2582 1 104 LEU MD1 1 107 TYR QB 3.540 . 5.280 3.082 2.839 3.362 . 0 0 "[ . 1 . 2 .]" 1
2583 1 104 LEU MD1 1 107 TYR HB3 3.685 . 5.570 3.957 3.601 4.303 . 0 0 "[ . 1 . 2 .]" 1
2584 1 104 LEU MD1 1 107 TYR QD 4.040 . 6.280 3.084 2.679 3.710 . 0 0 "[ . 1 . 2 .]" 1
2585 1 104 LEU MD1 1 107 TYR QE 4.875 . 7.950 4.271 3.732 4.755 . 0 0 "[ . 1 . 2 .]" 1
2586 1 104 LEU MD1 1 110 ILE MD 3.885 . 5.970 1.839 1.788 1.890 0.012 6 0 "[ . 1 . 2 .]" 1
2587 1 104 LEU MD1 1 110 ILE MG 3.885 . 5.970 3.373 3.274 3.503 . 0 0 "[ . 1 . 2 .]" 1
2588 1 104 LEU MD2 1 105 SER H 3.715 . 5.630 3.996 3.932 4.075 . 0 0 "[ . 1 . 2 .]" 1
2589 1 104 LEU MD2 1 110 ILE MD 4.680 . 7.560 4.063 3.985 4.156 . 0 0 "[ . 1 . 2 .]" 1
2590 1 104 LEU MD2 1 110 ILE MG 4.680 . 7.560 4.992 4.839 5.056 . 0 0 "[ . 1 . 2 .]" 1
2591 1 104 LEU HG 1 110 ILE MD 3.170 . 4.540 3.500 3.341 3.608 . 0 0 "[ . 1 . 2 .]" 1
2592 1 104 LEU HG 1 110 ILE MG 3.435 . 5.070 4.016 3.848 4.100 . 0 0 "[ . 1 . 2 .]" 1
2593 1 104 LEU O 1 107 TYR H 1.950 . 2.200 2.093 1.932 2.214 0.014 22 0 "[ . 1 . 2 .]" 1
2594 1 104 LEU O 1 107 TYR N 2.950 2.700 3.200 2.987 2.836 3.104 . 0 0 "[ . 1 . 2 .]" 1
2595 1 105 SER H 1 106 HIS H 2.550 . 3.300 2.614 2.552 2.788 . 0 0 "[ . 1 . 2 .]" 1
2596 1 105 SER H 1 107 TYR H 3.370 . 4.940 4.069 3.965 4.285 . 0 0 "[ . 1 . 2 .]" 1
2597 1 105 SER HA 1 106 HIS H 2.705 . 3.610 3.502 3.483 3.566 . 0 0 "[ . 1 . 2 .]" 1
2598 1 105 SER HA 1 107 TYR H 2.845 . 3.890 3.609 3.495 3.796 . 0 0 "[ . 1 . 2 .]" 1
2599 1 105 SER HB2 1 106 HIS H 2.890 . 3.980 3.756 2.814 4.050 0.070 25 0 "[ . 1 . 2 .]" 1
2600 1 105 SER HB3 1 106 HIS H 2.890 . 3.980 3.038 2.571 3.904 . 0 0 "[ . 1 . 2 .]" 1
2601 1 106 HIS H 1 106 HIS HB2 2.905 . 4.124 2.342 2.072 3.646 . 0 0 "[ . 1 . 2 .]" 1
2602 1 106 HIS H 1 106 HIS QB 2.695 . 3.590 2.211 2.051 2.592 . 0 0 "[ . 1 . 2 .]" 1
2603 1 106 HIS H 1 106 HIS HB3 2.905 . 4.124 3.187 2.510 3.589 . 0 0 "[ . 1 . 2 .]" 1
2604 1 106 HIS H 1 107 TYR H 2.735 . 3.670 2.710 2.659 2.810 . 0 0 "[ . 1 . 2 .]" 1
2605 1 106 HIS H 1 107 TYR QB 3.550 . 5.300 4.215 4.034 4.366 . 0 0 "[ . 1 . 2 .]" 1
2606 1 106 HIS HA 1 106 HIS HD2 2.890 . 3.980 3.176 2.047 4.102 0.122 7 0 "[ . 1 . 2 .]" 1
2607 1 106 HIS QB 1 107 TYR H 3.610 . 5.420 3.427 3.155 3.985 . 0 0 "[ . 1 . 2 .]" 1
2608 1 107 TYR H 1 108 PRO QD 3.425 . 5.050 4.021 3.892 4.129 . 0 0 "[ . 1 . 2 .]" 1
2609 1 107 TYR H 1 108 PRO QG 4.090 . 6.380 5.638 5.299 5.832 . 0 0 "[ . 1 . 2 .]" 1
2610 1 107 TYR H 1 110 ILE HB 3.480 . 5.160 4.560 4.304 4.892 . 0 0 "[ . 1 . 2 .]" 1
2611 1 107 TYR H 1 110 ILE MD 4.085 . 6.370 4.063 3.912 4.240 . 0 0 "[ . 1 . 2 .]" 1
2612 1 107 TYR H 1 111 ALA MB 3.530 . 5.260 4.220 4.143 4.286 . 0 0 "[ . 1 . 2 .]" 1
2613 1 107 TYR HA 1 108 PRO QD 2.585 . 3.370 1.944 1.918 2.025 . 0 0 "[ . 1 . 2 .]" 1
2614 1 107 TYR HA 1 108 PRO QG 3.625 . 5.450 3.845 3.815 3.921 . 0 0 "[ . 1 . 2 .]" 1
2615 1 107 TYR HA 1 110 ILE MD 3.635 . 5.470 4.364 4.252 4.436 . 0 0 "[ . 1 . 2 .]" 1
2616 1 107 TYR QB 1 108 PRO QD 4.525 . 7.250 3.734 3.676 3.783 . 0 0 "[ . 1 . 2 .]" 1
2617 1 107 TYR QB 1 109 ALA H 3.220 . 4.640 3.657 3.481 3.827 . 0 0 "[ . 1 . 2 .]" 1
2618 1 107 TYR QB 1 110 ILE H 2.995 . 4.190 2.460 2.269 2.698 . 0 0 "[ . 1 . 2 .]" 1
2619 1 107 TYR QB 1 110 ILE HB 3.595 . 5.390 2.298 2.080 2.502 . 0 0 "[ . 1 . 2 .]" 1
2620 1 107 TYR QB 1 110 ILE MG 4.000 . 6.200 3.641 3.470 3.865 . 0 0 "[ . 1 . 2 .]" 1
2621 1 107 TYR QB 1 111 ALA H 3.425 . 5.050 3.088 2.841 3.249 . 0 0 "[ . 1 . 2 .]" 1
2622 1 107 TYR HB2 1 110 ILE H 3.230 . 4.660 4.212 4.026 4.418 . 0 0 "[ . 1 . 2 .]" 1
2623 1 107 TYR HB2 1 110 ILE MD 3.515 . 5.230 2.288 2.118 2.445 . 0 0 "[ . 1 . 2 .]" 1
2624 1 107 TYR HB3 1 110 ILE H 3.230 . 4.660 2.477 2.281 2.722 . 0 0 "[ . 1 . 2 .]" 1
2625 1 107 TYR HB3 1 110 ILE MD 3.515 . 5.230 2.248 2.030 2.497 . 0 0 "[ . 1 . 2 .]" 1
2626 1 107 TYR QD 1 108 PRO HD2 4.285 . 6.770 3.018 2.503 3.724 . 0 0 "[ . 1 . 2 .]" 1
2627 1 107 TYR QD 1 108 PRO QD 4.210 . 6.620 2.949 2.479 3.617 . 0 0 "[ . 1 . 2 .]" 1
2628 1 107 TYR QD 1 108 PRO HD3 4.285 . 6.770 4.192 3.636 4.906 . 0 0 "[ . 1 . 2 .]" 1
2629 1 107 TYR QD 1 109 ALA H 4.330 . 6.860 2.231 1.998 2.669 . 0 0 "[ . 1 . 2 .]" 1
2630 1 107 TYR QD 1 109 ALA MB 4.165 . 6.530 2.286 2.004 2.573 . 0 0 "[ . 1 . 2 .]" 1
2631 1 107 TYR QD 1 110 ILE H 4.130 . 6.460 2.436 2.114 2.852 . 0 0 "[ . 1 . 2 .]" 1
2632 1 107 TYR QD 1 110 ILE HB 4.720 . 7.640 4.122 3.912 4.327 . 0 0 "[ . 1 . 2 .]" 1
2633 1 107 TYR QD 1 110 ILE MD 4.290 . 6.780 2.610 2.270 2.911 . 0 0 "[ . 1 . 2 .]" 1
2634 1 107 TYR QD 1 111 ALA H 4.720 . 7.640 4.540 4.342 4.746 . 0 0 "[ . 1 . 2 .]" 1
2635 1 107 TYR QE 1 109 ALA H 4.640 . 7.480 4.007 3.672 4.361 . 0 0 "[ . 1 . 2 .]" 1
2636 1 107 TYR QE 1 109 ALA HA 4.715 . 7.630 5.566 5.204 5.951 . 0 0 "[ . 1 . 2 .]" 1
2637 1 107 TYR QE 1 109 ALA MB 3.930 . 6.060 2.670 2.365 3.030 . 0 0 "[ . 1 . 2 .]" 1
2638 1 107 TYR QE 1 110 ILE H 4.715 . 7.630 4.358 4.163 4.697 . 0 0 "[ . 1 . 2 .]" 1
2639 1 107 TYR QE 1 110 ILE MD 4.670 . 7.540 3.470 3.152 3.709 . 0 0 "[ . 1 . 2 .]" 1
2640 1 108 PRO HA 1 111 ALA MB 2.955 . 4.110 2.729 2.346 3.231 . 0 0 "[ . 1 . 2 .]" 1
2641 1 108 PRO QB 1 109 ALA MB 4.340 . 6.880 4.053 3.763 4.331 . 0 0 "[ . 1 . 2 .]" 1
2642 1 108 PRO QD 1 109 ALA H 3.660 . 5.520 2.531 2.338 2.719 . 0 0 "[ . 1 . 2 .]" 1
2643 1 108 PRO QD 1 109 ALA MB 3.720 . 5.640 3.730 3.529 3.892 . 0 0 "[ . 1 . 2 .]" 1
2644 1 108 PRO QG 1 109 ALA H 3.235 . 4.670 3.171 2.474 3.808 . 0 0 "[ . 1 . 2 .]" 1
2645 1 108 PRO QG 1 109 ALA MB 4.200 . 6.600 4.107 3.358 4.774 . 0 0 "[ . 1 . 2 .]" 1
2646 1 108 PRO QG 1 110 ILE H 4.090 . 6.380 5.387 4.886 5.759 . 0 0 "[ . 1 . 2 .]" 1
2647 1 109 ALA H 1 109 ALA MB 2.615 . 3.430 2.189 2.080 2.271 . 0 0 "[ . 1 . 2 .]" 1
2648 1 109 ALA H 1 110 ILE H 2.505 . 3.210 2.593 2.455 2.734 . 0 0 "[ . 1 . 2 .]" 1
2649 1 109 ALA H 1 110 ILE MD 4.040 . 6.280 5.115 4.916 5.211 . 0 0 "[ . 1 . 2 .]" 1
2650 1 109 ALA H 1 111 ALA H 3.045 . 4.290 4.201 4.066 4.297 0.007 25 0 "[ . 1 . 2 .]" 1
2651 1 109 ALA HA 1 110 ILE H 2.690 . 3.580 3.550 3.534 3.569 . 0 0 "[ . 1 . 2 .]" 1
2652 1 109 ALA HA 1 112 ALA H 2.610 . 3.420 3.510 3.482 3.540 0.120 11 0 "[ . 1 . 2 .]" 1
2653 1 109 ALA MB 1 110 ILE H 2.830 . 3.860 2.517 2.318 2.667 . 0 0 "[ . 1 . 2 .]" 1
2654 1 110 ILE H 1 110 ILE HB 2.315 . 2.830 2.684 2.640 2.749 . 0 0 "[ . 1 . 2 .]" 1
2655 1 110 ILE H 1 110 ILE HG12 2.580 . 3.360 3.220 3.090 3.391 0.031 3 0 "[ . 1 . 2 .]" 1
2656 1 110 ILE H 1 110 ILE QG 2.450 . 3.100 1.938 1.920 1.967 . 0 0 "[ . 1 . 2 .]" 1
2657 1 110 ILE H 1 110 ILE HG13 2.580 . 3.360 1.954 1.933 1.981 . 0 0 "[ . 1 . 2 .]" 1
2658 1 110 ILE H 1 111 ALA H 2.335 . 2.870 2.674 2.570 2.779 . 0 0 "[ . 1 . 2 .]" 1
2659 1 110 ILE H 1 112 ALA H 3.215 . 4.630 3.686 3.581 3.794 . 0 0 "[ . 1 . 2 .]" 1
2660 1 110 ILE HA 1 110 ILE HG12 2.815 . 3.830 2.687 2.611 2.797 . 0 0 "[ . 1 . 2 .]" 1
2661 1 110 ILE HA 1 110 ILE QG 2.695 . 3.590 2.539 2.503 2.568 . 0 0 "[ . 1 . 2 .]" 1
2662 1 110 ILE HA 1 110 ILE HG13 2.815 . 3.830 3.138 2.964 3.255 . 0 0 "[ . 1 . 2 .]" 1
2663 1 110 ILE HA 1 112 ALA MB 3.590 . 5.380 4.319 4.273 4.351 . 0 0 "[ . 1 . 2 .]" 1
2664 1 110 ILE HA 1 113 ALA H 2.750 . 3.700 3.774 3.742 3.803 0.103 23 0 "[ . 1 . 2 .]" 1
2665 1 110 ILE HB 1 111 ALA H 2.425 . 3.050 2.217 2.150 2.292 . 0 0 "[ . 1 . 2 .]" 1
2666 1 110 ILE HB 1 111 ALA MB 3.605 . 5.410 3.704 3.622 3.829 . 0 0 "[ . 1 . 2 .]" 1
2667 1 110 ILE MD 1 111 ALA H 3.465 . 5.130 4.134 3.996 4.224 . 0 0 "[ . 1 . 2 .]" 1
2668 1 110 ILE QG 1 111 ALA H 3.360 . 4.920 3.684 3.572 3.786 . 0 0 "[ . 1 . 2 .]" 1
2669 1 110 ILE MG 1 111 ALA H 2.925 . 4.050 3.408 3.343 3.451 . 0 0 "[ . 1 . 2 .]" 1
2670 1 111 ALA H 1 111 ALA MB 2.615 . 3.430 2.172 2.080 2.221 . 0 0 "[ . 1 . 2 .]" 1
2671 1 111 ALA H 1 112 ALA H 2.425 . 3.050 2.681 2.650 2.720 . 0 0 "[ . 1 . 2 .]" 1
2672 1 111 ALA H 1 113 ALA H 3.340 . 4.880 4.273 4.238 4.308 . 0 0 "[ . 1 . 2 .]" 1
2673 1 111 ALA HA 1 113 ALA H 2.905 . 4.124 3.667 3.626 3.713 . 0 0 "[ . 1 . 2 .]" 1
2674 1 111 ALA HA 1 113 ALA MB 3.560 . 5.320 3.826 3.728 3.928 . 0 0 "[ . 1 . 2 .]" 1
2675 1 111 ALA HA 1 114 LEU H 2.735 . 3.670 3.663 3.642 3.683 0.013 5 0 "[ . 1 . 2 .]" 1
2676 1 111 ALA HA 1 114 LEU QB 3.440 . 5.080 4.411 4.364 4.442 . 0 0 "[ . 1 . 2 .]" 1
2677 1 111 ALA HA 1 114 LEU MD1 2.770 . 3.740 2.504 2.298 2.640 . 0 0 "[ . 1 . 2 .]" 1
2678 1 111 ALA HA 1 114 LEU MD2 3.760 . 5.720 4.057 3.985 4.104 . 0 0 "[ . 1 . 2 .]" 1
2679 1 111 ALA HA 1 114 LEU HG 2.380 . 2.960 3.007 2.991 3.021 0.061 17 0 "[ . 1 . 2 .]" 1
2680 1 111 ALA MB 1 112 ALA H 2.615 . 3.430 2.789 2.761 2.836 . 0 0 "[ . 1 . 2 .]" 1
2681 1 111 ALA MB 1 113 ALA H 3.825 . 5.850 4.331 4.311 4.353 . 0 0 "[ . 1 . 2 .]" 1
2682 1 111 ALA MB 1 114 LEU H 3.670 . 5.540 4.245 4.190 4.295 . 0 0 "[ . 1 . 2 .]" 1
2683 1 111 ALA MB 1 114 LEU QB 4.310 . 6.820 4.045 3.990 4.145 . 0 0 "[ . 1 . 2 .]" 1
2684 1 111 ALA MB 1 114 LEU MD1 4.245 . 6.690 2.355 2.157 2.511 . 0 0 "[ . 1 . 2 .]" 1
2685 1 111 ALA MB 1 115 ASP H 3.960 . 6.120 5.033 4.984 5.078 . 0 0 "[ . 1 . 2 .]" 1
2686 1 112 ALA H 1 112 ALA MB 2.615 . 3.430 2.051 2.029 2.126 . 0 0 "[ . 1 . 2 .]" 1
2687 1 112 ALA H 1 113 ALA H 2.490 . 3.180 2.747 2.728 2.761 . 0 0 "[ . 1 . 2 .]" 1
2688 1 112 ALA HA 1 114 LEU MD1 3.870 . 5.940 4.626 4.472 4.766 . 0 0 "[ . 1 . 2 .]" 1
2689 1 112 ALA HA 1 115 ASP HB2 3.540 . 5.280 2.759 2.328 4.371 . 0 0 "[ . 1 . 2 .]" 1
2690 1 112 ALA HA 1 115 ASP QB 3.240 . 4.680 2.606 2.307 3.087 . 0 0 "[ . 1 . 2 .]" 1
2691 1 112 ALA HA 1 115 ASP HB3 3.540 . 5.280 3.765 2.866 4.331 . 0 0 "[ . 1 . 2 .]" 1
2692 1 112 ALA MB 1 115 ASP H 3.235 . 4.670 4.004 3.991 4.020 . 0 0 "[ . 1 . 2 .]" 1
2693 1 113 ALA H 1 114 LEU H 2.455 . 3.110 2.717 2.710 2.724 . 0 0 "[ . 1 . 2 .]" 1
2694 1 113 ALA H 1 115 ASP H 3.045 . 4.290 4.109 4.080 4.148 . 0 0 "[ . 1 . 2 .]" 1
2695 1 113 ALA HA 1 116 ARG H 2.800 . 3.800 3.589 3.349 3.821 0.021 24 0 "[ . 1 . 2 .]" 1
2696 1 113 ALA MB 1 114 LEU HA 3.560 . 5.320 3.936 3.905 3.948 . 0 0 "[ . 1 . 2 .]" 1
2697 1 113 ALA MB 1 114 LEU MD1 4.680 . 7.560 4.285 4.216 4.366 . 0 0 "[ . 1 . 2 .]" 1
2698 1 113 ALA MB 1 114 LEU MD2 3.885 . 5.970 3.670 3.571 3.838 . 0 0 "[ . 1 . 2 .]" 1
2699 1 114 LEU H 1 114 LEU QB 2.725 . 3.650 2.600 2.578 2.618 . 0 0 "[ . 1 . 2 .]" 1
2700 1 114 LEU H 1 115 ASP H 2.550 . 3.300 2.380 2.352 2.426 . 0 0 "[ . 1 . 2 .]" 1
2701 1 114 LEU H 1 115 ASP QB 3.470 . 5.140 4.218 4.067 4.378 . 0 0 "[ . 1 . 2 .]" 1
2702 1 114 LEU HA 1 114 LEU MD1 3.220 . 4.640 3.984 3.978 3.992 . 0 0 "[ . 1 . 2 .]" 1
2703 1 114 LEU HA 1 114 LEU MD2 2.615 . 3.430 2.399 2.316 2.520 . 0 0 "[ . 1 . 2 .]" 1
2704 1 114 LEU HA 1 114 LEU HG 2.735 . 3.670 3.054 3.013 3.096 . 0 0 "[ . 1 . 2 .]" 1
2705 1 114 LEU HA 1 115 ASP H 2.645 . 3.490 3.504 3.501 3.512 0.022 21 0 "[ . 1 . 2 .]" 1
2706 1 114 LEU QB 1 115 ASP H 2.960 . 4.120 2.740 2.674 2.813 . 0 0 "[ . 1 . 2 .]" 1
2707 1 114 LEU MD1 1 115 ASP H 3.495 . 5.190 4.121 4.029 4.193 . 0 0 "[ . 1 . 2 .]" 1
2708 1 115 ASP H 1 115 ASP HA 2.350 . 2.900 2.884 2.791 2.942 0.042 21 0 "[ . 1 . 2 .]" 1
2709 1 115 ASP H 1 115 ASP HB2 2.690 . 3.580 2.325 2.083 3.597 0.017 25 0 "[ . 1 . 2 .]" 1
2710 1 115 ASP H 1 115 ASP QB 2.470 . 3.140 2.227 2.055 2.377 . 0 0 "[ . 1 . 2 .]" 1
2711 1 115 ASP H 1 115 ASP HB3 2.690 . 3.580 3.225 2.411 3.575 . 0 0 "[ . 1 . 2 .]" 1
2712 1 115 ASP H 1 116 ARG QB 3.670 . 5.540 4.242 3.859 4.953 . 0 0 "[ . 1 . 2 .]" 1
2713 1 115 ASP HA 1 116 ARG H 2.645 . 3.490 3.325 2.973 3.556 0.066 20 0 "[ . 1 . 2 .]" 1
2714 1 115 ASP HA 1 118 VAL QG 4.370 . 6.940 3.730 1.968 5.217 . 0 0 "[ . 1 . 2 .]" 1
2715 1 115 ASP QB 1 116 ARG H 2.895 . 3.990 3.175 2.253 3.726 . 0 0 "[ . 1 . 2 .]" 1
2716 1 115 ASP QB 1 116 ARG HA 3.860 . 5.920 4.133 3.854 5.290 . 0 0 "[ . 1 . 2 .]" 1
2717 1 115 ASP HB2 1 116 ARG H 3.090 . 4.380 3.642 2.311 4.334 . 0 0 "[ . 1 . 2 .]" 1
2718 1 115 ASP HB3 1 116 ARG H 3.090 . 4.380 3.618 2.784 4.276 . 0 0 "[ . 1 . 2 .]" 1
2719 1 116 ARG H 1 116 ARG HB2 2.765 . 3.730 2.437 2.081 3.236 . 0 0 "[ . 1 . 2 .]" 1
2720 1 116 ARG H 1 116 ARG QB 2.650 . 3.500 2.334 2.053 3.054 . 0 0 "[ . 1 . 2 .]" 1
2721 1 116 ARG H 1 116 ARG HB3 2.765 . 3.730 3.150 2.475 3.762 0.032 18 0 "[ . 1 . 2 .]" 1
2722 1 116 ARG H 1 116 ARG QD 4.090 . 6.380 4.242 3.320 5.174 . 0 0 "[ . 1 . 2 .]" 1
2723 1 116 ARG H 1 116 ARG QG 3.825 . 5.850 3.726 2.082 4.405 . 0 0 "[ . 1 . 2 .]" 1
2724 1 116 ARG H 1 117 ASN H 2.675 . 3.550 2.719 2.241 3.632 0.082 25 0 "[ . 1 . 2 .]" 1
2725 1 116 ARG HA 1 116 ARG QD 3.610 . 5.420 3.430 2.272 4.145 . 0 0 "[ . 1 . 2 .]" 1
2726 1 116 ARG HA 1 117 ASN H 2.660 . 3.520 3.414 2.951 3.561 0.041 3 0 "[ . 1 . 2 .]" 1
2727 1 116 ARG QB 1 118 VAL H 4.030 . 6.260 4.877 3.050 5.538 . 0 0 "[ . 1 . 2 .]" 1
2728 1 116 ARG HB2 1 117 ASN H 3.090 . 4.380 3.525 2.159 4.441 0.061 10 0 "[ . 1 . 2 .]" 1
2729 1 116 ARG HB3 1 117 ASN H 3.090 . 4.380 2.988 2.126 4.081 . 0 0 "[ . 1 . 2 .]" 1
2730 1 116 ARG QG 1 117 ASN H 4.090 . 6.380 4.164 3.173 4.645 . 0 0 "[ . 1 . 2 .]" 1
2731 1 117 ASN H 1 117 ASN HB2 2.905 . 4.124 2.619 2.137 3.692 . 0 0 "[ . 1 . 2 .]" 1
2732 1 117 ASN H 1 117 ASN QB 2.695 . 3.590 2.472 2.100 2.980 . 0 0 "[ . 1 . 2 .]" 1
2733 1 117 ASN H 1 117 ASN HB3 2.905 . 4.124 3.329 2.591 3.832 . 0 0 "[ . 1 . 2 .]" 1
2734 1 117 ASN H 1 118 VAL H 2.935 . 4.070 3.002 1.997 4.080 0.010 6 0 "[ . 1 . 2 .]" 1
2735 1 117 ASN QB 1 118 VAL H 3.135 . 4.470 3.181 2.092 4.035 . 0 0 "[ . 1 . 2 .]" 1
2736 1 117 ASN QB 1 118 VAL QG 5.245 . 8.690 3.697 2.189 4.968 . 0 0 "[ . 1 . 2 .]" 1
2737 1 117 ASN HB2 1 118 VAL H 3.245 . 4.690 3.770 2.202 4.669 . 0 0 "[ . 1 . 2 .]" 1
2738 1 117 ASN HB3 1 118 VAL H 3.245 . 4.690 3.553 2.124 4.508 . 0 0 "[ . 1 . 2 .]" 1
2739 1 118 VAL H 1 118 VAL HB 2.735 . 3.670 3.285 2.619 3.806 0.136 21 0 "[ . 1 . 2 .]" 1
2740 1 118 VAL H 1 118 VAL QG 3.040 . 4.280 2.311 1.895 2.828 . 0 0 "[ . 1 . 2 .]" 1
2741 1 118 VAL H 1 119 LYS QB 3.875 . 5.950 4.705 3.913 5.249 . 0 0 "[ . 1 . 2 .]" 1
2742 1 118 VAL HA 1 119 LYS H 2.365 . 2.930 2.344 2.140 2.915 . 0 0 "[ . 1 . 2 .]" 1
2743 1 118 VAL HB 1 119 LYS H 3.015 . 4.230 3.827 1.991 4.230 . 0 0 "[ . 1 . 2 .]" 1
2744 1 118 VAL QG 1 119 LYS H 4.340 . 6.880 2.951 1.916 3.756 . 0 0 "[ . 1 . 2 .]" 1
2745 1 119 LYS H 1 119 LYS QB 2.790 . 3.780 2.866 2.413 3.240 . 0 0 "[ . 1 . 2 .]" 1
2746 1 119 LYS H 1 119 LYS QG 4.090 . 6.380 3.624 2.099 4.336 . 0 0 "[ . 1 . 2 .]" 1
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