NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
386875 |
1ly7   |
4342 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1ly7
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 2069
_Distance_constraint_stats_list.Viol_count 1447
_Distance_constraint_stats_list.Viol_total 2008.676
_Distance_constraint_stats_list.Viol_max 0.932
_Distance_constraint_stats_list.Viol_rms 0.0397
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0043
_Distance_constraint_stats_list.Viol_average_violations_only 0.0925
_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 MET 0.944 0.225 11 0 "[ . 1 .]"
1 2 ASP 5.880 0.536 15 1 "[ . 1 +]"
1 3 GLU 3.835 0.536 15 1 "[ . 1 +]"
1 4 THR 0.812 0.147 2 0 "[ . 1 .]"
1 5 THR 0.328 0.130 13 0 "[ . 1 .]"
1 6 TYR 6.882 0.917 3 7 "[ *+ .* -** * .]"
1 7 GLU 0.359 0.205 3 0 "[ . 1 .]"
1 8 ARG 9.168 0.811 7 7 "[ * .*+ *** -.]"
1 9 LEU 6.673 0.719 2 5 "[ + .-** 1 *.]"
1 10 ALA 0.536 0.059 15 0 "[ . 1 .]"
1 11 GLU 7.643 0.745 4 4 "[ +.-** 1 .]"
1 12 GLU 0.052 0.021 1 0 "[ . 1 .]"
1 13 THR 0.069 0.018 15 0 "[ . 1 .]"
1 14 LEU 1.999 0.745 4 1 "[ +. 1 .]"
1 15 ASP 0.228 0.041 6 0 "[ . 1 .]"
1 16 SER 3.945 0.530 9 5 "[ - *.* +1* .]"
1 17 LEU 1.324 0.279 6 0 "[ . 1 .]"
1 18 ALA 0.881 0.174 6 0 "[ . 1 .]"
1 19 GLU 0.517 0.054 6 0 "[ . 1 .]"
1 20 PHE 0.290 0.043 5 0 "[ . 1 .]"
1 21 PHE 0.528 0.184 5 0 "[ . 1 .]"
1 22 GLU 0.061 0.017 4 0 "[ . 1 .]"
1 23 ASP 0.022 0.014 14 0 "[ . 1 .]"
1 24 LEU 0.284 0.146 2 0 "[ . 1 .]"
1 25 ALA 0.008 0.004 8 0 "[ . 1 .]"
1 26 ASP 2.107 0.317 1 0 "[ . 1 .]"
1 27 LYS 0.857 0.252 8 0 "[ . 1 .]"
1 28 PRO 0.726 0.252 8 0 "[ . 1 .]"
1 29 TYR 0.253 0.103 8 0 "[ . 1 .]"
1 30 THR 0.265 0.016 8 0 "[ . 1 .]"
1 31 PHE 1.452 0.185 8 0 "[ . 1 .]"
1 32 GLU 0.575 0.107 1 0 "[ . 1 .]"
1 33 ASP 0.758 0.187 6 0 "[ . 1 .]"
1 34 TYR 0.480 0.208 8 0 "[ . 1 .]"
1 35 ASP 2.014 0.209 8 0 "[ . 1 .]"
1 36 VAL 0.604 0.174 6 0 "[ . 1 .]"
1 37 SER 0.102 0.019 5 0 "[ . 1 .]"
1 38 PHE 0.235 0.022 5 0 "[ . 1 .]"
1 39 GLY 0.260 0.174 6 0 "[ . 1 .]"
1 40 SER 0.209 0.052 15 0 "[ . 1 .]"
1 41 GLY 0.146 0.041 8 0 "[ . 1 .]"
1 42 VAL 0.885 0.408 14 0 "[ . 1 .]"
1 43 LEU 0.531 0.106 6 0 "[ . 1 .]"
1 44 THR 2.233 0.524 8 1 "[ . + 1 .]"
1 45 VAL 0.072 0.053 8 0 "[ . 1 .]"
1 46 LYS 1.082 0.209 8 0 "[ . 1 .]"
1 47 LEU 4.602 0.686 8 1 "[ . + 1 .]"
1 48 GLY 0.314 0.314 8 0 "[ . 1 .]"
1 49 GLY 0.212 0.106 2 0 "[ . 1 .]"
1 50 ASP 0.301 0.037 5 0 "[ . 1 .]"
1 51 LEU 3.140 0.503 8 1 "[ . + 1 .]"
1 52 GLY 2.405 0.503 8 1 "[ . + 1 .]"
1 53 THR 0.360 0.052 8 0 "[ . 1 .]"
1 54 TYR 13.231 0.812 7 12 "[**- **+**1** **]"
1 55 VAL 9.023 0.635 12 6 "[ . - 1*+***]"
1 56 ILE 1.126 0.224 3 0 "[ . 1 .]"
1 57 ASN 9.092 0.834 15 7 "[* . * 1**-*+]"
1 58 LYS 0.598 0.056 10 0 "[ . 1 .]"
1 59 GLN 8.013 0.834 15 5 "[- . * 1 ** +]"
1 60 THR 3.002 0.723 15 2 "[ . 1 -+]"
1 61 PRO 3.561 0.736 12 4 "[* . 1 + -*]"
1 62 ASN 3.234 0.455 14 0 "[ . 1 .]"
1 63 LYS 7.775 0.917 3 7 "[ *+ .* -** * .]"
1 64 GLN 2.051 0.736 12 1 "[ . 1 + .]"
1 65 ILE 0.540 0.056 10 0 "[ . 1 .]"
1 66 TRP 3.272 0.932 3 2 "[ + . 1 -.]"
1 67 LEU 14.053 0.812 7 12 "[**- **+**1** **]"
1 68 SER 1.029 0.398 8 0 "[ . 1 .]"
1 69 SER 0.000 0.000 . 0 "[ . 1 .]"
1 70 PRO 0.001 0.001 3 0 "[ . 1 .]"
1 71 SER 0.079 0.020 13 0 "[ . 1 .]"
1 72 SER 0.780 0.128 11 0 "[ . 1 .]"
1 73 GLY 0.045 0.020 13 0 "[ . 1 .]"
1 74 PRO 0.081 0.031 1 0 "[ . 1 .]"
1 75 LYS 10.249 0.812 7 12 "[**- **+**1** **]"
1 76 ARG 5.324 0.932 3 4 "[ + . 1* *-]"
1 77 TYR 4.150 0.526 8 1 "[ . + 1 .]"
1 78 ASP 0.065 0.035 13 0 "[ . 1 .]"
1 79 TRP 0.171 0.035 13 0 "[ . 1 .]"
1 80 THR 0.230 0.035 1 0 "[ . 1 .]"
1 81 GLY 0.123 0.017 10 0 "[ . 1 .]"
1 82 LYS 0.222 0.059 4 0 "[ . 1 .]"
1 83 ASN 2.174 0.291 12 0 "[ . 1 .]"
1 84 TRP 0.469 0.028 8 0 "[ . 1 .]"
1 85 VAL 1.294 0.793 3 1 "[ + . 1 .]"
1 86 TYR 1.360 0.302 4 0 "[ . 1 .]"
1 87 SER 0.699 0.227 9 0 "[ . 1 .]"
1 88 HIS 0.767 0.302 4 0 "[ . 1 .]"
1 89 ASP 4.628 0.528 15 5 "[ * .* * 1- +]"
1 90 GLY 1.852 0.793 3 1 "[ + . 1 .]"
1 91 VAL 1.161 0.228 13 0 "[ . 1 .]"
1 92 SER 0.244 0.119 7 0 "[ . 1 .]"
1 93 LEU 2.157 0.303 9 0 "[ . 1 .]"
1 94 HIS 3.078 0.480 6 0 "[ . 1 .]"
1 95 GLU 0.035 0.017 4 0 "[ . 1 .]"
1 96 LEU 1.969 0.217 4 0 "[ . 1 .]"
1 97 LEU 1.925 0.236 3 0 "[ . 1 .]"
1 98 ALA 0.395 0.037 15 0 "[ . 1 .]"
1 99 ALA 0.435 0.037 15 0 "[ . 1 .]"
1 100 GLU 2.882 0.217 4 0 "[ . 1 .]"
1 101 LEU 2.293 0.201 3 0 "[ . 1 .]"
1 102 THR 1.878 0.447 13 0 "[ . 1 .]"
1 103 LYS 2.647 0.404 7 0 "[ . 1 .]"
1 104 ALA 0.825 0.362 5 0 "[ . 1 .]"
1 105 LEU 0.966 0.362 5 0 "[ . 1 .]"
1 106 LYS 1.671 0.217 12 0 "[ . 1 .]"
1 107 THR 0.606 0.060 8 0 "[ . 1 .]"
1 108 LYS 2.312 0.447 13 0 "[ . 1 .]"
1 109 LEU 2.627 0.533 15 1 "[ . 1 +]"
1 110 ASP 1.877 0.599 15 1 "[ . 1 +]"
1 111 LEU 1.075 0.236 3 0 "[ . 1 .]"
1 112 SER 0.983 0.523 6 1 "[ .+ 1 .]"
1 113 SER 0.174 0.063 13 0 "[ . 1 .]"
1 114 LEU 0.751 0.188 14 0 "[ . 1 .]"
1 115 ALA 0.231 0.067 13 0 "[ . 1 .]"
1 116 TYR 0.026 0.013 13 0 "[ . 1 .]"
1 117 SER 2.189 0.523 6 1 "[ .+ 1 .]"
1 118 GLY 1.375 0.256 10 0 "[ . 1 .]"
1 119 LYS 3.818 0.419 4 0 "[ . 1 .]"
1 120 ASP 2.670 0.259 9 0 "[ . 1 .]"
1 121 ALA 0.014 0.007 7 0 "[ . 1 .]"
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 MET HA 1 1 MET QB 2.200 . 2.800 2.478 2.333 2.540 . 0 0 "[ . 1 .]" 1
2 1 1 MET HA 1 1 MET QG 2.600 . 3.300 2.223 1.999 2.869 . 0 0 "[ . 1 .]" 1
3 1 1 MET QB 1 2 ASP H 3.000 . 4.100 2.708 1.860 3.910 0.040 7 0 "[ . 1 .]" 1
4 1 1 MET QB 1 2 ASP HA 2.800 . 3.800 3.816 3.618 4.025 0.225 11 0 "[ . 1 .]" 1
5 1 1 MET QB 1 2 ASP HA 2.900 . 4.000 3.584 3.398 3.713 . 0 0 "[ . 1 .]" 1
6 1 1 MET QG 1 2 ASP H 3.000 . 4.100 2.755 2.062 3.872 . 0 0 "[ . 1 .]" 1
7 1 2 ASP H 1 2 ASP HB2 3.300 . 4.700 3.629 2.609 4.049 . 0 0 "[ . 1 .]" 1
8 1 2 ASP H 1 2 ASP HB3 3.000 . 4.100 3.411 2.858 4.064 . 0 0 "[ . 1 .]" 1
9 1 2 ASP HA 1 2 ASP HB2 2.000 . 2.500 2.613 2.418 2.962 0.462 2 0 "[ . 1 .]" 1
10 1 2 ASP HA 1 2 ASP HB2 2.000 . 2.500 2.387 2.217 2.666 0.166 2 0 "[ . 1 .]" 1
11 1 2 ASP HA 1 2 ASP HB3 2.100 . 2.700 2.440 2.284 2.947 0.247 14 0 "[ . 1 .]" 1
12 1 2 ASP HB3 1 3 GLU HA 2.600 . 5.500 5.367 3.867 6.036 0.536 15 1 "[ . 1 +]" 1
13 1 3 GLU H 1 3 GLU QB 3.000 . 4.100 2.750 2.070 3.281 . 0 0 "[ . 1 .]" 1
14 1 3 GLU HA 1 3 GLU QB 2.100 . 2.700 2.441 2.157 2.538 . 0 0 "[ . 1 .]" 1
15 1 3 GLU HA 1 3 GLU QB 1.900 . 2.400 2.157 2.014 2.223 . 0 0 "[ . 1 .]" 1
16 1 3 GLU HA 1 3 GLU QG 2.400 . 3.100 2.277 2.014 3.016 . 0 0 "[ . 1 .]" 1
17 1 3 GLU HA 1 6 TYR H 3.100 . 4.300 3.535 3.094 4.365 0.065 13 0 "[ . 1 .]" 1
18 1 3 GLU HA 1 6 TYR HB2 2.700 . 3.600 3.097 2.556 3.619 0.019 9 0 "[ . 1 .]" 1
19 1 3 GLU HA 1 6 TYR HB3 2.500 . 3.300 2.925 1.750 3.400 0.100 4 0 "[ . 1 .]" 1
20 1 3 GLU HA 1 6 TYR QD 2.700 . 5.500 4.120 2.759 4.624 . 0 0 "[ . 1 .]" 1
21 1 3 GLU HA 1 63 LYS QE 2.500 . 5.500 4.343 3.573 5.310 . 0 0 "[ . 1 .]" 1
22 1 3 GLU QB 1 4 THR H 2.600 . 3.400 3.072 1.791 3.450 0.050 9 0 "[ . 1 .]" 1
23 1 3 GLU QB 1 4 THR HA 2.500 . 5.500 3.995 3.643 4.237 . 0 0 "[ . 1 .]" 1
24 1 3 GLU QB 1 4 THR MG 2.400 . 5.500 4.457 3.757 5.037 . 0 0 "[ . 1 .]" 1
25 1 3 GLU QB 1 6 TYR H 3.200 . 4.500 3.938 3.346 4.449 . 0 0 "[ . 1 .]" 1
26 1 3 GLU HG2 1 60 THR MG 2.200 . 2.800 2.526 1.899 2.787 . 0 0 "[ . 1 .]" 1
27 1 4 THR H 1 4 THR HA 2.600 . 3.400 2.824 2.261 2.946 . 0 0 "[ . 1 .]" 1
28 1 4 THR H 1 4 THR HB 2.500 . 3.300 2.702 2.495 3.421 0.121 2 0 "[ . 1 .]" 1
29 1 4 THR H 1 4 THR MG 2.800 . 3.800 3.783 3.649 3.947 0.147 2 0 "[ . 1 .]" 1
30 1 4 THR HA 1 4 THR MG 2.000 . 2.500 2.394 2.177 2.521 0.021 9 0 "[ . 1 .]" 1
31 1 4 THR HA 1 7 GLU H 3.000 . 4.100 3.987 3.769 4.154 0.054 13 0 "[ . 1 .]" 1
32 1 4 THR HA 1 7 GLU QB 2.700 . 5.500 4.307 3.666 5.199 . 0 0 "[ . 1 .]" 1
33 1 4 THR HA 1 7 GLU HG2 2.600 . 5.500 4.885 4.387 5.382 . 0 0 "[ . 1 .]" 1
34 1 4 THR HB 1 4 THR MG 2.000 . 2.500 2.092 2.069 2.116 . 0 0 "[ . 1 .]" 1
35 1 4 THR HB 1 5 THR H 2.100 . 2.700 2.330 1.795 2.745 0.045 13 0 "[ . 1 .]" 1
36 1 4 THR HB 1 5 THR MG 2.300 . 5.500 5.029 4.568 5.285 . 0 0 "[ . 1 .]" 1
37 1 4 THR MG 1 5 THR HA 2.900 . 4.000 3.680 3.197 3.987 . 0 0 "[ . 1 .]" 1
38 1 4 THR MG 1 8 ARG H 3.400 . 4.800 4.010 3.699 4.374 . 0 0 "[ . 1 .]" 1
39 1 5 THR H 1 5 THR HB 2.500 . 3.300 2.850 2.632 3.430 0.130 13 0 "[ . 1 .]" 1
40 1 5 THR H 1 5 THR MG 3.100 . 4.300 3.737 3.616 4.104 . 0 0 "[ . 1 .]" 1
41 1 5 THR HA 1 5 THR MG 2.000 . 2.500 2.223 2.066 2.532 0.032 13 0 "[ . 1 .]" 1
42 1 5 THR HA 1 8 ARG H 3.100 . 4.300 3.159 3.091 3.226 . 0 0 "[ . 1 .]" 1
43 1 5 THR HA 1 9 LEU QD 2.900 . 5.500 2.917 2.734 3.203 . 0 0 "[ . 1 .]" 1
44 1 5 THR HA 1 8 ARG QB 2.500 . 3.300 3.035 2.604 3.309 0.009 15 0 "[ . 1 .]" 1
45 1 5 THR HB 1 5 THR MG 1.800 . 2.200 2.085 2.069 2.105 . 0 0 "[ . 1 .]" 1
46 1 5 THR HB 1 6 TYR H 2.800 . 3.800 3.276 2.955 3.688 . 0 0 "[ . 1 .]" 1
47 1 5 THR MG 1 6 TYR H 3.200 . 4.500 4.173 3.689 4.419 . 0 0 "[ . 1 .]" 1
48 1 5 THR MG 1 8 ARG QB 2.300 . 3.000 2.919 2.691 3.015 0.015 2 0 "[ . 1 .]" 1
49 1 5 THR MG 1 9 LEU HA 2.800 . 5.500 4.486 4.194 4.907 . 0 0 "[ . 1 .]" 1
50 1 5 THR MG 1 9 LEU QD . . 2.500 1.922 1.759 2.189 0.041 7 0 "[ . 1 .]" 1
51 1 6 TYR H 1 6 TYR HA 2.600 . 3.400 2.831 2.803 2.892 . 0 0 "[ . 1 .]" 1
52 1 6 TYR H 1 6 TYR HB2 2.700 . 3.600 2.663 2.548 2.808 . 0 0 "[ . 1 .]" 1
53 1 6 TYR H 1 6 TYR HB3 2.700 . 3.600 2.411 2.287 2.509 . 0 0 "[ . 1 .]" 1
54 1 6 TYR H 1 6 TYR QD 3.100 . 4.300 4.181 4.127 4.203 . 0 0 "[ . 1 .]" 1
55 1 6 TYR HA 1 6 TYR HB2 2.400 . 3.100 2.413 2.353 2.464 . 0 0 "[ . 1 .]" 1
56 1 6 TYR HA 1 6 TYR HB3 2.500 . 3.300 3.023 3.010 3.030 . 0 0 "[ . 1 .]" 1
57 1 6 TYR HA 1 6 TYR QD 2.400 . 3.100 2.450 2.165 2.856 . 0 0 "[ . 1 .]" 1
58 1 6 TYR HA 1 7 GLU H 3.200 . 4.500 3.507 3.476 3.555 . 0 0 "[ . 1 .]" 1
59 1 6 TYR HA 1 7 GLU HA 2.400 . 5.500 4.752 4.673 4.814 . 0 0 "[ . 1 .]" 1
60 1 6 TYR HA 1 8 ARG QB 2.500 . 5.500 5.174 4.939 5.513 0.013 8 0 "[ . 1 .]" 1
61 1 6 TYR HA 1 9 LEU H 3.200 . 4.500 3.308 3.038 3.724 . 0 0 "[ . 1 .]" 1
62 1 6 TYR HA 1 9 LEU HB2 2.600 . 3.400 2.631 2.073 3.193 . 0 0 "[ . 1 .]" 1
63 1 6 TYR HA 1 9 LEU HB2 2.600 . 3.400 2.520 2.069 2.917 . 0 0 "[ . 1 .]" 1
64 1 6 TYR HA 1 9 LEU QD 2.600 . 3.400 3.042 2.891 3.342 . 0 0 "[ . 1 .]" 1
65 1 6 TYR HA 1 10 ALA MB 2.800 . 3.800 3.774 3.652 3.833 0.033 8 0 "[ . 1 .]" 1
66 1 6 TYR HA 1 10 ALA MB 2.800 . 3.800 3.695 3.470 3.811 0.011 8 0 "[ . 1 .]" 1
67 1 6 TYR HB2 1 6 TYR QD 2.400 . 3.100 2.631 2.475 2.740 . 0 0 "[ . 1 .]" 1
68 1 6 TYR HB2 1 6 TYR QE 3.300 . 4.700 3.720 3.551 3.805 . 0 0 "[ . 1 .]" 1
69 1 6 TYR HB3 1 6 TYR QD 2.500 . 3.300 2.284 2.275 2.335 . 0 0 "[ . 1 .]" 1
70 1 6 TYR HB3 1 6 TYR QE 3.200 . 4.500 3.049 2.540 4.086 . 0 0 "[ . 1 .]" 1
71 1 6 TYR QD 1 7 GLU H 3.000 . 4.100 3.915 3.264 4.106 0.006 7 0 "[ . 1 .]" 1
72 1 6 TYR QD 1 7 GLU HA 2.600 . 5.500 4.095 3.343 4.465 . 0 0 "[ . 1 .]" 1
73 1 6 TYR QD 1 10 ALA MB 2.900 . 4.000 2.978 2.646 3.383 . 0 0 "[ . 1 .]" 1
74 1 6 TYR QD 1 63 LYS HA 2.900 . 4.000 3.387 3.040 3.788 . 0 0 "[ . 1 .]" 1
75 1 6 TYR QD 1 63 LYS HB2 2.800 . 3.800 4.087 3.224 4.717 0.917 3 7 "[ *+ .* -** * .]" 1
76 1 6 TYR QD 1 63 LYS QD 2.700 . 3.600 1.986 1.787 2.179 0.013 7 0 "[ . 1 .]" 1
77 1 6 TYR QD 1 84 TRP HH2 2.800 . 3.800 2.369 1.928 2.590 . 0 0 "[ . 1 .]" 1
78 1 6 TYR QD 1 84 TRP HZ2 3.200 . 4.500 4.211 3.627 4.508 0.008 6 0 "[ . 1 .]" 1
79 1 6 TYR QD 1 84 TRP HZ3 3.000 . 4.100 4.044 3.779 4.125 0.025 10 0 "[ . 1 .]" 1
80 1 6 TYR QE 1 7 GLU HA 2.900 . 5.500 5.022 4.196 5.337 . 0 0 "[ . 1 .]" 1
81 1 6 TYR QE 1 7 GLU HA 2.900 . 5.500 4.115 3.816 4.194 . 0 0 "[ . 1 .]" 1
82 1 6 TYR QE 1 7 GLU HB2 3.000 . 5.500 3.281 2.779 3.814 . 0 0 "[ . 1 .]" 1
83 1 6 TYR QE 1 10 ALA MB 2.600 . 3.400 2.610 2.385 3.311 . 0 0 "[ . 1 .]" 1
84 1 6 TYR QE 1 64 GLN HG3 2.800 . 5.500 4.370 4.293 4.414 . 0 0 "[ . 1 .]" 1
85 1 6 TYR QE 1 58 LYS QB 3.000 . 4.100 3.192 2.541 4.114 0.014 9 0 "[ . 1 .]" 1
86 1 6 TYR QE 1 60 THR HA 2.300 . 3.000 2.695 1.726 3.012 0.012 6 0 "[ . 1 .]" 1
87 1 6 TYR QE 1 60 THR MG 2.600 . 5.500 3.270 2.368 3.732 . 0 0 "[ . 1 .]" 1
88 1 6 TYR QE 1 63 LYS HA 3.000 . 4.100 2.639 2.047 3.069 . 0 0 "[ . 1 .]" 1
89 1 6 TYR QE 1 63 LYS QB 3.000 . 4.100 3.506 2.739 4.122 0.022 5 0 "[ . 1 .]" 1
90 1 6 TYR QE 1 65 ILE MD 2.900 . 5.500 4.295 3.419 4.806 . 0 0 "[ . 1 .]" 1
91 1 6 TYR QE 1 84 TRP HH2 2.800 . 3.800 2.664 1.802 3.358 . 0 0 "[ . 1 .]" 1
92 1 6 TYR QE 1 84 TRP HZ3 3.000 . 4.100 3.439 2.672 4.112 0.012 5 0 "[ . 1 .]" 1
93 1 7 GLU H 1 7 GLU HA 2.700 . 3.600 2.842 2.797 2.894 . 0 0 "[ . 1 .]" 1
94 1 7 GLU H 1 7 GLU QB 2.800 . 3.800 2.505 2.260 2.642 . 0 0 "[ . 1 .]" 1
95 1 7 GLU H 1 7 GLU HG2 2.500 . 3.300 2.866 2.009 3.353 0.053 3 0 "[ . 1 .]" 1
96 1 7 GLU H 1 7 GLU HG3 2.500 . 3.300 2.486 1.775 3.260 . 0 0 "[ . 1 .]" 1
97 1 7 GLU H 1 8 ARG H 2.700 . 3.600 2.545 2.372 2.687 . 0 0 "[ . 1 .]" 1
98 1 7 GLU HA 1 7 GLU QB 2.300 . 3.000 2.341 2.276 2.446 . 0 0 "[ . 1 .]" 1
99 1 7 GLU HA 1 7 GLU HG2 2.200 . 2.800 2.570 2.226 3.005 0.205 3 0 "[ . 1 .]" 1
100 1 7 GLU HA 1 7 GLU HG3 2.300 . 5.500 3.457 2.864 3.861 . 0 0 "[ . 1 .]" 1
101 1 7 GLU HA 1 8 ARG H 3.300 . 4.700 3.413 3.344 3.479 . 0 0 "[ . 1 .]" 1
102 1 7 GLU HA 1 10 ALA MB 2.300 . 5.500 3.980 3.508 4.399 . 0 0 "[ . 1 .]" 1
103 1 7 GLU QB 1 8 ARG H 2.800 . 3.800 3.054 2.814 3.242 . 0 0 "[ . 1 .]" 1
104 1 7 GLU HG2 1 8 ARG H 3.300 . 5.500 4.796 4.286 5.244 . 0 0 "[ . 1 .]" 1
105 1 7 GLU HG3 1 8 ARG H 2.900 . 5.500 4.544 4.155 5.116 . 0 0 "[ . 1 .]" 1
106 1 8 ARG H 1 8 ARG HA 2.500 . 3.300 2.932 2.929 2.934 . 0 0 "[ . 1 .]" 1
107 1 8 ARG H 1 8 ARG QB 2.300 . 3.000 2.447 2.341 2.626 . 0 0 "[ . 1 .]" 1
108 1 8 ARG H 1 8 ARG HG2 3.100 . 5.500 3.548 2.269 4.704 . 0 0 "[ . 1 .]" 1
109 1 8 ARG H 1 8 ARG HG3 3.300 . 4.700 3.939 3.095 4.468 . 0 0 "[ . 1 .]" 1
110 1 8 ARG H 1 9 LEU H 2.800 . 3.800 2.192 2.094 2.371 . 0 0 "[ . 1 .]" 1
111 1 8 ARG HA 1 8 ARG QB 1.900 . 2.400 2.356 2.291 2.415 0.015 11 0 "[ . 1 .]" 1
112 1 8 ARG HA 1 8 ARG HD2 2.800 . 3.800 3.090 2.317 3.800 0.000 15 0 "[ . 1 .]" 1
113 1 8 ARG HA 1 8 ARG HD3 2.700 . 3.600 3.174 2.303 3.834 0.234 4 0 "[ . 1 .]" 1
114 1 8 ARG HA 1 8 ARG HG2 2.300 . 3.000 3.249 2.672 3.811 0.811 7 7 "[ * .*+ *-* *.]" 1
115 1 8 ARG HA 1 8 ARG HG3 2.200 . 5.500 3.285 2.373 3.909 . 0 0 "[ . 1 .]" 1
116 1 8 ARG HA 1 9 LEU H 3.300 . 4.700 3.481 3.312 3.566 . 0 0 "[ . 1 .]" 1
117 1 8 ARG HA 1 11 GLU H 3.000 . 4.100 3.829 3.498 4.024 . 0 0 "[ . 1 .]" 1
118 1 8 ARG HA 1 11 GLU HB3 2.200 . 5.500 3.044 2.776 3.442 . 0 0 "[ . 1 .]" 1
119 1 8 ARG HA 1 11 GLU QG 2.300 . 5.500 4.017 3.656 4.397 . 0 0 "[ . 1 .]" 1
120 1 8 ARG QB 1 8 ARG HD2 2.500 . 3.300 2.574 1.920 3.322 0.022 6 0 "[ . 1 .]" 1
121 1 8 ARG QB 1 8 ARG HD3 2.400 . 3.100 2.580 1.966 3.357 0.257 4 0 "[ . 1 .]" 1
122 1 8 ARG QB 1 9 LEU H 2.500 . 3.300 2.729 2.225 3.294 . 0 0 "[ . 1 .]" 1
123 1 8 ARG QB 1 9 LEU QD 2.600 . 3.400 3.006 2.572 3.294 . 0 0 "[ . 1 .]" 1
124 1 8 ARG HD2 1 8 ARG HG2 2.300 . 3.000 2.887 2.351 3.012 0.012 3 0 "[ . 1 .]" 1
125 1 8 ARG HD2 1 8 ARG HG3 2.300 . 3.000 2.515 2.231 3.004 0.004 4 0 "[ . 1 .]" 1
126 1 8 ARG HD3 1 8 ARG HG2 2.300 . 3.000 2.498 2.221 2.936 . 0 0 "[ . 1 .]" 1
127 1 8 ARG HD3 1 8 ARG HG3 2.400 . 3.100 2.887 2.349 3.013 . 0 0 "[ . 1 .]" 1
128 1 8 ARG HG2 1 9 LEU H 3.100 . 4.300 4.473 4.224 5.019 0.719 2 3 "[ + .* 1 -.]" 1
129 1 8 ARG HG3 1 9 LEU H 2.400 . 5.500 4.455 3.723 5.177 . 0 0 "[ . 1 .]" 1
130 1 9 LEU H 1 9 LEU HA 2.500 . 3.300 2.849 2.769 2.914 . 0 0 "[ . 1 .]" 1
131 1 9 LEU H 1 9 LEU HB2 2.500 . 3.300 2.318 2.083 2.672 . 0 0 "[ . 1 .]" 1
132 1 9 LEU H 1 9 LEU HB3 2.900 . 4.000 3.450 3.241 3.630 . 0 0 "[ . 1 .]" 1
133 1 9 LEU H 1 9 LEU QD 3.300 . 4.700 2.773 2.258 3.187 . 0 0 "[ . 1 .]" 1
134 1 9 LEU H 1 10 ALA H 2.800 . 3.800 2.761 2.511 2.972 . 0 0 "[ . 1 .]" 1
135 1 9 LEU HA 1 9 LEU HB2 2.400 . 3.100 2.954 2.864 3.013 . 0 0 "[ . 1 .]" 1
136 1 9 LEU HA 1 9 LEU HB3 2.400 . 3.100 2.626 2.403 2.833 . 0 0 "[ . 1 .]" 1
137 1 9 LEU HA 1 9 LEU QD 2.000 . 2.500 2.065 1.831 2.301 . 0 0 "[ . 1 .]" 1
138 1 9 LEU HA 1 9 LEU HG 2.800 . 3.800 2.904 2.597 3.283 . 0 0 "[ . 1 .]" 1
139 1 9 LEU HA 1 11 GLU HB2 2.900 . 5.500 5.727 5.355 6.151 0.651 8 3 "[ .-*+ 1 .]" 1
140 1 9 LEU HA 1 12 GLU HB2 2.700 . 3.600 3.412 3.072 3.615 0.015 6 0 "[ . 1 .]" 1
141 1 9 LEU HA 1 12 GLU HB3 2.900 . 5.500 4.537 3.674 4.951 . 0 0 "[ . 1 .]" 1
142 1 9 LEU HA 1 116 TYR QD 3.000 . 4.100 4.016 3.684 4.113 0.013 13 0 "[ . 1 .]" 1
143 1 9 LEU HA 1 116 TYR QE 2.600 . 3.400 2.785 2.350 3.156 . 0 0 "[ . 1 .]" 1
144 1 9 LEU HB2 1 9 LEU QD 2.400 . 3.000 2.106 1.945 2.314 . 0 0 "[ . 1 .]" 1
145 1 9 LEU HB2 1 10 ALA H 2.700 . 3.600 2.465 2.097 2.803 . 0 0 "[ . 1 .]" 1
146 1 9 LEU HB2 1 13 THR HB 2.300 . 5.500 4.981 4.339 5.515 0.015 13 0 "[ . 1 .]" 1
147 1 9 LEU HB2 1 84 TRP HZ2 2.800 . 3.800 3.231 2.465 3.811 0.011 2 0 "[ . 1 .]" 1
148 1 9 LEU HB3 1 9 LEU QD 2.500 . 3.100 2.277 2.028 2.506 . 0 0 "[ . 1 .]" 1
149 1 9 LEU HB3 1 9 LEU HG 2.400 . 3.100 2.624 2.283 3.020 . 0 0 "[ . 1 .]" 1
150 1 9 LEU HB3 1 10 ALA H 3.200 . 4.500 2.882 2.232 3.494 . 0 0 "[ . 1 .]" 1
151 1 9 LEU HB3 1 84 TRP HH2 2.900 . 4.000 3.540 3.002 3.944 . 0 0 "[ . 1 .]" 1
152 1 9 LEU HB3 1 84 TRP HZ2 2.700 . 3.600 2.276 1.794 3.189 0.006 3 0 "[ . 1 .]" 1
153 1 9 LEU MD1 1 9 LEU MD2 1.900 . 2.400 2.009 1.872 2.068 . 0 0 "[ . 1 .]" 1
154 1 9 LEU QD 1 9 LEU HG 2.200 . 2.800 1.873 1.853 1.888 . 0 0 "[ . 1 .]" 1
155 1 9 LEU QD 1 63 LYS QD 2.500 . 5.500 3.176 2.720 3.520 . 0 0 "[ . 1 .]" 1
156 1 9 LEU QD 1 79 TRP HE1 3.400 . 4.800 3.599 3.266 3.946 . 0 0 "[ . 1 .]" 1
157 1 9 LEU QD 1 79 TRP HH2 2.900 . 3.600 2.851 2.267 3.058 . 0 0 "[ . 1 .]" 1
158 1 9 LEU QD 1 79 TRP HZ2 2.600 . 3.400 2.820 2.445 3.170 . 0 0 "[ . 1 .]" 1
159 1 9 LEU QD 1 84 TRP HZ2 2.900 . 5.500 3.518 3.023 4.118 . 0 0 "[ . 1 .]" 1
160 1 9 LEU QD 1 116 TYR QD 3.100 . 4.300 3.812 3.417 4.134 . 0 0 "[ . 1 .]" 1
161 1 9 LEU QD 1 116 TYR QE 2.300 . 3.000 2.834 2.420 2.980 . 0 0 "[ . 1 .]" 1
162 1 10 ALA H 1 10 ALA HA 2.700 . 3.600 2.804 2.780 2.837 . 0 0 "[ . 1 .]" 1
163 1 10 ALA H 1 10 ALA MB 2.300 . 3.000 2.042 2.020 2.089 . 0 0 "[ . 1 .]" 1
164 1 10 ALA H 1 11 GLU H 2.700 . 3.600 2.676 2.574 2.735 . 0 0 "[ . 1 .]" 1
165 1 10 ALA HA 1 10 ALA MB 2.000 . 2.500 2.085 2.079 2.097 . 0 0 "[ . 1 .]" 1
166 1 10 ALA HA 1 11 GLU H 3.400 . 4.800 3.410 3.292 3.511 . 0 0 "[ . 1 .]" 1
167 1 10 ALA HA 1 13 THR H 3.000 . 4.100 3.646 3.383 3.845 . 0 0 "[ . 1 .]" 1
168 1 10 ALA HA 1 13 THR HB 2.200 . 2.800 2.734 2.551 2.818 0.018 15 0 "[ . 1 .]" 1
169 1 10 ALA HA 1 13 THR MG 2.800 . 5.500 3.897 3.731 4.027 . 0 0 "[ . 1 .]" 1
170 1 10 ALA HA 1 84 TRP HZ2 2.200 . 2.800 2.460 2.052 2.665 . 0 0 "[ . 1 .]" 1
171 1 10 ALA HA 1 65 ILE MD 2.300 . 3.000 2.742 2.500 3.043 0.043 10 0 "[ . 1 .]" 1
172 1 10 ALA HA 1 84 TRP HE1 3.000 . 4.100 3.403 3.156 3.550 . 0 0 "[ . 1 .]" 1
173 1 10 ALA HA 1 84 TRP HZ2 2.700 . 3.600 2.691 2.071 3.048 . 0 0 "[ . 1 .]" 1
174 1 10 ALA MB 1 11 GLU H 2.600 . 3.400 3.072 2.821 3.291 . 0 0 "[ . 1 .]" 1
175 1 10 ALA MB 1 11 GLU HA 3.000 . 4.100 3.857 3.741 3.970 . 0 0 "[ . 1 .]" 1
176 1 10 ALA MB 1 11 GLU HA 2.400 . 5.500 3.336 2.939 3.560 . 0 0 "[ . 1 .]" 1
177 1 10 ALA MB 1 13 THR HB 2.900 . 4.000 3.347 2.288 3.506 . 0 0 "[ . 1 .]" 1
178 1 10 ALA MB 1 13 THR MG 2.400 . 5.500 2.821 1.852 3.002 . 0 0 "[ . 1 .]" 1
179 1 10 ALA MB 1 65 ILE HA 2.600 . 5.500 3.854 3.604 4.304 . 0 0 "[ . 1 .]" 1
180 1 10 ALA MB 1 58 LYS HA 2.600 . 5.500 3.289 2.929 3.752 . 0 0 "[ . 1 .]" 1
181 1 10 ALA MB 1 65 ILE MD 2.100 . 2.700 2.392 1.758 2.518 . 0 0 "[ . 1 .]" 1
182 1 10 ALA MB 1 41 GLY HA2 2.800 . 3.800 3.714 3.370 3.841 0.041 8 0 "[ . 1 .]" 1
183 1 10 ALA MB 1 58 LYS HA 2.800 . 5.500 3.917 3.446 4.637 . 0 0 "[ . 1 .]" 1
184 1 10 ALA MB 1 58 LYS QB 2.800 . 3.800 2.372 1.870 3.815 0.015 10 0 "[ . 1 .]" 1
185 1 10 ALA MB 1 58 LYS QG 2.500 . 3.300 3.029 2.136 3.322 0.022 5 0 "[ . 1 .]" 1
186 1 10 ALA MB 1 63 LYS QB 2.700 . 5.500 5.007 4.303 5.559 0.059 15 0 "[ . 1 .]" 1
187 1 10 ALA MB 1 65 ILE MD 2.300 . 3.000 2.754 2.466 2.873 . 0 0 "[ . 1 .]" 1
188 1 10 ALA MB 1 65 ILE HG13 2.400 . 3.100 2.059 1.703 2.480 . 0 0 "[ . 1 .]" 1
189 1 10 ALA MB 1 84 TRP HH2 2.800 . 3.800 3.003 2.548 3.510 . 0 0 "[ . 1 .]" 1
190 1 10 ALA MB 1 84 TRP HZ2 2.600 . 3.400 3.212 2.856 3.428 0.028 8 0 "[ . 1 .]" 1
191 1 11 GLU H 1 11 GLU HA 2.600 . 3.400 2.880 2.813 2.925 . 0 0 "[ . 1 .]" 1
192 1 11 GLU H 1 11 GLU HB2 2.900 . 4.000 2.341 2.166 2.563 . 0 0 "[ . 1 .]" 1
193 1 11 GLU H 1 11 GLU HB3 2.300 . 3.000 2.846 2.586 3.013 0.013 10 0 "[ . 1 .]" 1
194 1 11 GLU H 1 11 GLU QG 3.000 . 4.100 3.957 3.733 4.080 . 0 0 "[ . 1 .]" 1
195 1 11 GLU H 1 12 GLU H 2.600 . 3.400 2.537 2.156 2.800 . 0 0 "[ . 1 .]" 1
196 1 11 GLU HA 1 11 GLU HB2 2.200 . 5.500 2.648 2.505 2.739 . 0 0 "[ . 1 .]" 1
197 1 11 GLU HA 1 11 GLU QG 2.200 . 2.800 2.288 2.043 2.823 0.023 14 0 "[ . 1 .]" 1
198 1 11 GLU HA 1 12 GLU H 2.800 . 3.800 3.546 3.469 3.571 . 0 0 "[ . 1 .]" 1
199 1 11 GLU HA 1 65 ILE MD 3.000 . 5.500 5.042 4.770 5.282 . 0 0 "[ . 1 .]" 1
200 1 11 GLU HA 1 14 LEU HB3 2.800 . 5.500 5.470 5.222 6.245 0.745 4 1 "[ +. 1 .]" 1
201 1 11 GLU HA 1 15 ASP H 3.800 . 5.500 4.356 4.190 4.764 . 0 0 "[ . 1 .]" 1
202 1 11 GLU HB3 1 11 GLU QG 1.800 . 2.200 2.382 2.130 2.523 0.323 1 0 "[ . 1 .]" 1
203 1 12 GLU H 1 12 GLU HA 2.600 . 3.400 2.830 2.766 2.924 . 0 0 "[ . 1 .]" 1
204 1 12 GLU H 1 12 GLU HB2 2.400 . 3.100 2.137 2.061 2.331 . 0 0 "[ . 1 .]" 1
205 1 12 GLU H 1 12 GLU HB3 2.900 . 4.000 3.341 2.900 3.469 . 0 0 "[ . 1 .]" 1
206 1 12 GLU H 1 12 GLU QG 2.600 . 5.500 3.298 2.910 4.098 . 0 0 "[ . 1 .]" 1
207 1 12 GLU HA 1 12 GLU HB2 2.200 . 5.500 2.895 2.685 2.957 . 0 0 "[ . 1 .]" 1
208 1 12 GLU HA 1 12 GLU QG 2.300 . 3.000 2.200 2.013 2.540 . 0 0 "[ . 1 .]" 1
209 1 12 GLU HA 1 15 ASP H 3.300 . 4.700 3.562 3.407 3.759 . 0 0 "[ . 1 .]" 1
210 1 12 GLU HA 1 15 ASP HB2 2.300 . 3.000 2.469 2.061 2.998 . 0 0 "[ . 1 .]" 1
211 1 12 GLU HA 1 15 ASP HB3 2.300 . 3.000 2.695 2.315 2.993 . 0 0 "[ . 1 .]" 1
212 1 12 GLU HB2 1 12 GLU QG 1.900 . 2.400 2.269 2.128 2.421 0.021 1 0 "[ . 1 .]" 1
213 1 12 GLU HB2 1 13 THR H 2.900 . 4.000 3.187 2.958 3.638 . 0 0 "[ . 1 .]" 1
214 1 12 GLU HB2 1 116 TYR QD 3.000 . 5.500 3.864 3.395 4.574 . 0 0 "[ . 1 .]" 1
215 1 12 GLU HB3 1 12 GLU QG 2.400 . 3.100 2.374 2.150 2.523 . 0 0 "[ . 1 .]" 1
216 1 12 GLU HB3 1 13 THR H 3.000 . 4.100 3.251 2.906 3.521 . 0 0 "[ . 1 .]" 1
217 1 12 GLU HB3 1 116 TYR QD 2.700 . 3.600 3.191 2.624 3.484 . 0 0 "[ . 1 .]" 1
218 1 12 GLU HB3 1 116 TYR QE 2.500 . 3.300 2.630 1.942 3.120 . 0 0 "[ . 1 .]" 1
219 1 13 THR H 1 13 THR HA 2.600 . 3.400 2.810 2.794 2.832 . 0 0 "[ . 1 .]" 1
220 1 13 THR H 1 13 THR HB 3.200 . 4.500 2.517 2.445 2.601 . 0 0 "[ . 1 .]" 1
221 1 13 THR H 1 13 THR HG1 2.400 . 3.100 2.586 2.025 3.100 0.000 13 0 "[ . 1 .]" 1
222 1 13 THR H 1 13 THR MG 3.000 . 4.100 3.749 3.744 3.754 . 0 0 "[ . 1 .]" 1
223 1 13 THR H 1 14 LEU H 2.600 . 3.400 2.946 2.753 3.124 . 0 0 "[ . 1 .]" 1
224 1 13 THR H 1 116 TYR QE 3.300 . 4.700 4.193 3.732 4.515 . 0 0 "[ . 1 .]" 1
225 1 13 THR HA 1 13 THR HB 2.200 . 5.500 3.026 3.024 3.028 . 0 0 "[ . 1 .]" 1
226 1 13 THR HA 1 13 THR MG 2.000 . 2.500 2.376 2.303 2.445 . 0 0 "[ . 1 .]" 1
227 1 13 THR HA 1 14 LEU H 2.900 . 4.000 3.567 3.554 3.573 . 0 0 "[ . 1 .]" 1
228 1 13 THR HA 1 115 ALA MB 2.200 . 5.500 2.696 1.888 3.757 . 0 0 "[ . 1 .]" 1
229 1 13 THR HB 1 13 THR MG 2.000 . 2.500 2.085 2.070 2.099 . 0 0 "[ . 1 .]" 1
230 1 13 THR HB 1 14 LEU H 2.700 . 3.600 2.090 1.877 2.315 . 0 0 "[ . 1 .]" 1
231 1 13 THR HB 1 65 ILE MD 2.700 . 3.600 3.148 2.749 3.538 . 0 0 "[ . 1 .]" 1
232 1 13 THR HB 1 84 TRP HE1 3.400 . 4.800 3.587 3.319 3.921 . 0 0 "[ . 1 .]" 1
233 1 13 THR HG1 1 84 TRP HE1 2.900 . 4.000 2.520 1.829 3.010 . 0 0 "[ . 1 .]" 1
234 1 13 THR MG 1 14 LEU H 3.300 . 4.700 2.997 2.711 3.195 . 0 0 "[ . 1 .]" 1
235 1 13 THR MG 1 14 LEU HA 2.700 . 3.600 3.448 3.286 3.555 . 0 0 "[ . 1 .]" 1
236 1 13 THR MG 1 14 LEU QD 2.400 . 3.100 2.874 1.855 3.060 . 0 0 "[ . 1 .]" 1
237 1 13 THR MG 1 17 LEU QD 2.000 . 2.500 2.084 1.814 2.278 . 0 0 "[ . 1 .]" 1
238 1 13 THR MG 1 43 LEU QD 2.500 . 5.500 3.742 3.417 4.005 . 0 0 "[ . 1 .]" 1
239 1 13 THR MG 1 65 ILE MD 2.100 . 2.700 2.544 2.319 2.715 0.015 3 0 "[ . 1 .]" 1
240 1 13 THR MG 1 84 TRP HD1 2.200 . 2.800 2.656 2.258 2.804 0.004 8 0 "[ . 1 .]" 1
241 1 13 THR MG 1 84 TRP HE1 2.600 . 3.400 2.590 2.264 2.867 . 0 0 "[ . 1 .]" 1
242 1 13 THR MG 1 93 LEU QD 2.400 . 3.100 2.822 2.457 3.094 . 0 0 "[ . 1 .]" 1
243 1 13 THR MG 1 94 HIS HE1 2.200 . 5.500 3.667 3.127 4.765 . 0 0 "[ . 1 .]" 1
244 1 13 THR MG 1 116 TYR QD 2.700 . 5.500 4.267 3.778 4.554 . 0 0 "[ . 1 .]" 1
245 1 14 LEU H 1 14 LEU HA 2.800 . 3.800 2.795 2.747 2.841 . 0 0 "[ . 1 .]" 1
246 1 14 LEU H 1 14 LEU HB2 2.700 . 3.600 2.559 2.441 2.736 . 0 0 "[ . 1 .]" 1
247 1 14 LEU H 1 14 LEU HB3 2.900 . 4.000 3.583 3.547 3.595 . 0 0 "[ . 1 .]" 1
248 1 14 LEU H 1 14 LEU QD 3.100 . 4.300 2.930 1.880 3.089 0.120 4 0 "[ . 1 .]" 1
249 1 14 LEU H 1 14 LEU HG 2.700 . 3.600 2.206 1.801 3.770 0.170 4 0 "[ . 1 .]" 1
250 1 14 LEU H 1 15 ASP H 2.900 . 4.000 2.671 2.528 2.807 . 0 0 "[ . 1 .]" 1
251 1 14 LEU HA 1 14 LEU HB2 2.400 . 3.100 3.018 3.001 3.021 . 0 0 "[ . 1 .]" 1
252 1 14 LEU HA 1 14 LEU HB3 2.500 . 3.300 2.451 2.384 2.515 . 0 0 "[ . 1 .]" 1
253 1 14 LEU HA 1 14 LEU QD 2.400 . 2.500 2.215 1.939 2.438 . 0 0 "[ . 1 .]" 1
254 1 14 LEU HA 1 14 LEU QD 1.900 . 2.400 1.996 1.846 2.183 . 0 0 "[ . 1 .]" 1
255 1 14 LEU HA 1 14 LEU HG 2.400 . 3.100 3.067 2.960 3.341 0.241 4 0 "[ . 1 .]" 1
256 1 14 LEU HA 1 15 ASP H 3.300 . 4.700 3.446 3.421 3.495 . 0 0 "[ . 1 .]" 1
257 1 14 LEU HA 1 17 LEU H 2.900 . 4.000 3.455 3.255 3.760 . 0 0 "[ . 1 .]" 1
258 1 14 LEU HA 1 17 LEU QB 2.400 . 3.100 2.136 1.694 2.399 0.106 6 0 "[ . 1 .]" 1
259 1 14 LEU HA 1 17 LEU QB 2.600 . 3.400 2.128 1.694 2.384 0.106 6 0 "[ . 1 .]" 1
260 1 14 LEU HA 1 17 LEU QD 2.000 . 5.500 2.603 1.564 3.124 . 0 0 "[ . 1 .]" 1
261 1 14 LEU HA 1 17 LEU QD 2.700 . 3.600 2.584 1.564 3.096 0.236 3 0 "[ . 1 .]" 1
262 1 14 LEU HA 1 17 LEU HG 2.600 . 5.500 4.695 2.842 5.271 . 0 0 "[ . 1 .]" 1
263 1 14 LEU HA 1 18 ALA MB 2.700 . 5.500 4.528 4.332 4.835 . 0 0 "[ . 1 .]" 1
264 1 14 LEU HB2 1 14 LEU QD 2.300 . 3.000 2.156 1.895 2.261 . 0 0 "[ . 1 .]" 1
265 1 14 LEU HB2 1 14 LEU QD 2.300 . 3.000 1.938 1.759 2.013 . 0 0 "[ . 1 .]" 1
266 1 14 LEU HB2 1 14 LEU HG 2.300 . 3.000 2.543 2.462 2.750 . 0 0 "[ . 1 .]" 1
267 1 14 LEU HB2 1 15 ASP H 3.000 . 4.100 3.045 2.853 3.143 . 0 0 "[ . 1 .]" 1
268 1 14 LEU HB2 1 38 PHE QD 2.700 . 5.500 4.404 3.618 4.890 . 0 0 "[ . 1 .]" 1
269 1 14 LEU HB2 1 38 PHE QE 2.900 . 4.000 2.673 1.979 3.137 . 0 0 "[ . 1 .]" 1
270 1 14 LEU HB3 1 14 LEU QD 2.400 . 3.100 2.107 2.036 2.596 . 0 0 "[ . 1 .]" 1
271 1 14 LEU HB3 1 14 LEU QD 2.300 . 3.000 1.987 1.551 2.306 0.049 13 0 "[ . 1 .]" 1
272 1 14 LEU HB3 1 15 ASP H 3.100 . 4.300 4.012 3.869 4.105 . 0 0 "[ . 1 .]" 1
273 1 14 LEU HB3 1 38 PHE QD 2.700 . 3.600 3.319 2.604 3.579 . 0 0 "[ . 1 .]" 1
274 1 14 LEU HB3 1 38 PHE QE 2.900 . 4.000 2.568 1.877 3.329 . 0 0 "[ . 1 .]" 1
275 1 14 LEU QD 1 21 PHE QD 2.600 . 5.500 4.608 4.461 4.734 . 0 0 "[ . 1 .]" 1
276 1 14 LEU QD 1 14 LEU HG 2.200 . 2.800 1.874 1.855 1.891 . 0 0 "[ . 1 .]" 1
277 1 14 LEU QD 1 43 LEU HB2 2.100 . 2.700 2.025 1.815 2.193 . 0 0 "[ . 1 .]" 1
278 1 14 LEU QD 1 64 GLN HB2 2.800 . 5.500 4.952 4.835 5.080 . 0 0 "[ . 1 .]" 1
279 1 14 LEU QD 1 38 PHE QD 2.400 . 5.500 3.824 3.306 4.290 . 0 0 "[ . 1 .]" 1
280 1 14 LEU QD 1 38 PHE QE 2.900 . 4.000 3.021 2.476 3.705 . 0 0 "[ . 1 .]" 1
281 1 14 LEU QD 1 41 GLY HA2 2.500 . 3.300 2.698 2.160 3.265 . 0 0 "[ . 1 .]" 1
282 1 14 LEU QD 1 41 GLY HA3 2.500 . 5.500 3.057 2.544 4.077 . 0 0 "[ . 1 .]" 1
283 1 14 LEU QD 1 43 LEU HB2 2.900 . 4.000 2.378 1.978 3.070 . 0 0 "[ . 1 .]" 1
284 1 14 LEU QD 1 43 LEU HB3 2.700 . 3.600 3.253 2.944 3.575 . 0 0 "[ . 1 .]" 1
285 1 14 LEU QD 1 56 ILE HB 2.600 . 3.400 3.024 2.774 3.207 . 0 0 "[ . 1 .]" 1
286 1 14 LEU QD 1 56 ILE HB 2.500 . 5.500 2.728 2.254 3.043 . 0 0 "[ . 1 .]" 1
287 1 14 LEU QD 1 56 ILE MD 2.200 . 5.500 3.822 3.660 3.995 . 0 0 "[ . 1 .]" 1
288 1 14 LEU QD 1 65 ILE MG 2.100 . 5.500 2.706 2.374 2.890 . 0 0 "[ . 1 .]" 1
289 1 14 LEU QD 1 56 ILE MG 1.900 . 2.400 1.980 1.858 2.105 . 0 0 "[ . 1 .]" 1
290 1 14 LEU QD 1 57 ASN HA 2.600 . 3.400 2.668 2.267 3.041 . 0 0 "[ . 1 .]" 1
291 1 14 LEU QD 1 58 LYS H 2.900 . 4.000 2.859 2.269 3.643 . 0 0 "[ . 1 .]" 1
292 1 14 LEU QD 1 65 ILE MD 2.400 . 3.000 2.675 1.777 2.884 . 0 0 "[ . 1 .]" 1
293 1 14 LEU QD 1 65 ILE MG 2.100 . 5.500 2.781 2.384 3.065 . 0 0 "[ . 1 .]" 1
294 1 14 LEU HG 1 65 ILE MG 2.900 . 4.000 3.923 3.687 4.016 0.016 4 0 "[ . 1 .]" 1
295 1 14 LEU HG 1 65 ILE MD 2.700 . 3.600 3.225 3.006 3.637 0.037 4 0 "[ . 1 .]" 1
296 1 15 ASP H 1 15 ASP HA 2.600 . 3.400 2.828 2.809 2.840 . 0 0 "[ . 1 .]" 1
297 1 15 ASP H 1 15 ASP HB2 2.500 . 3.300 2.221 2.078 2.517 . 0 0 "[ . 1 .]" 1
298 1 15 ASP H 1 15 ASP HB3 2.700 . 3.600 2.986 2.550 3.383 . 0 0 "[ . 1 .]" 1
299 1 15 ASP H 1 16 SER H 2.700 . 3.600 2.817 2.701 2.924 . 0 0 "[ . 1 .]" 1
300 1 15 ASP HA 1 15 ASP HB2 2.300 . 3.000 2.706 2.471 2.919 . 0 0 "[ . 1 .]" 1
301 1 15 ASP HA 1 15 ASP HB3 2.200 . 5.500 2.938 2.771 3.028 . 0 0 "[ . 1 .]" 1
302 1 15 ASP HA 1 18 ALA H 2.900 . 4.000 3.557 3.471 3.607 . 0 0 "[ . 1 .]" 1
303 1 15 ASP HA 1 18 ALA MB 2.200 . 2.800 2.766 2.656 2.841 0.041 6 0 "[ . 1 .]" 1
304 1 15 ASP HA 1 38 PHE QD 2.400 . 5.500 4.511 3.914 4.735 . 0 0 "[ . 1 .]" 1
305 1 15 ASP HA 1 38 PHE QE 2.700 . 3.600 3.487 3.013 3.622 0.022 5 0 "[ . 1 .]" 1
306 1 15 ASP HB2 1 16 SER H 2.700 . 3.600 3.216 2.623 3.630 0.030 14 0 "[ . 1 .]" 1
307 1 15 ASP HB2 1 18 ALA MB 2.900 . 5.500 5.109 4.894 5.292 . 0 0 "[ . 1 .]" 1
308 1 15 ASP HB3 1 16 SER H 3.000 . 4.100 2.293 1.965 2.620 . 0 0 "[ . 1 .]" 1
309 1 16 SER H 1 16 SER HA 2.500 . 3.300 2.808 2.779 2.829 . 0 0 "[ . 1 .]" 1
310 1 16 SER H 1 16 SER HB2 2.600 . 3.400 2.879 2.164 3.536 0.136 7 0 "[ . 1 .]" 1
311 1 16 SER H 1 16 SER HB3 2.500 . 3.300 2.952 2.341 3.470 0.170 12 0 "[ . 1 .]" 1
312 1 16 SER H 1 17 LEU H 2.700 . 3.600 2.627 2.516 2.744 . 0 0 "[ . 1 .]" 1
313 1 16 SER H 1 115 ALA MB 3.100 . 4.300 3.497 3.060 4.237 . 0 0 "[ . 1 .]" 1
314 1 16 SER HA 1 16 SER HB3 2.000 . 2.500 2.605 2.241 3.030 0.530 9 5 "[ - *.* +1* .]" 1
315 1 16 SER HA 1 17 LEU H 3.100 . 4.300 3.506 3.429 3.534 . 0 0 "[ . 1 .]" 1
316 1 16 SER HA 1 19 GLU H 3.000 . 4.100 3.438 3.270 3.518 . 0 0 "[ . 1 .]" 1
317 1 16 SER HA 1 19 GLU QB 2.400 . 3.100 2.837 2.528 3.020 . 0 0 "[ . 1 .]" 1
318 1 16 SER HA 1 19 GLU QG 2.800 . 3.800 3.582 3.293 3.735 . 0 0 "[ . 1 .]" 1
319 1 16 SER HB2 1 17 LEU H 2.900 . 4.000 3.450 2.751 4.161 0.161 6 0 "[ . 1 .]" 1
320 1 16 SER HB3 1 17 LEU H 2.900 . 5.500 3.543 2.650 4.261 . 0 0 "[ . 1 .]" 1
321 1 16 SER HB3 1 115 ALA MB 2.100 . 5.500 2.812 1.774 3.468 . 0 0 "[ . 1 .]" 1
322 1 17 LEU H 1 17 LEU HA 2.700 . 3.600 2.821 2.803 2.846 . 0 0 "[ . 1 .]" 1
323 1 17 LEU H 1 17 LEU QB 2.500 . 3.300 2.096 2.058 2.166 . 0 0 "[ . 1 .]" 1
324 1 17 LEU H 1 17 LEU QD 2.800 . 3.800 2.783 2.444 3.047 . 0 0 "[ . 1 .]" 1
325 1 17 LEU H 1 17 LEU HG 2.600 . 5.500 3.651 3.231 3.998 . 0 0 "[ . 1 .]" 1
326 1 17 LEU H 1 18 ALA H 2.600 . 3.400 2.596 2.483 2.657 . 0 0 "[ . 1 .]" 1
327 1 17 LEU HA 1 17 LEU QB 2.500 . 3.300 2.514 2.487 2.531 . 0 0 "[ . 1 .]" 1
328 1 17 LEU HA 1 17 LEU QD 2.000 . 5.500 2.826 1.849 2.953 . 0 0 "[ . 1 .]" 1
329 1 17 LEU HA 1 17 LEU QD 2.300 . 3.000 2.217 1.818 2.519 . 0 0 "[ . 1 .]" 1
330 1 17 LEU HA 1 17 LEU HG 2.500 . 3.300 2.243 2.101 3.579 0.279 6 0 "[ . 1 .]" 1
331 1 17 LEU HA 1 18 ALA H 2.900 . 4.000 3.510 3.484 3.526 . 0 0 "[ . 1 .]" 1
332 1 17 LEU HA 1 21 PHE H 3.000 . 4.100 3.886 3.753 3.958 . 0 0 "[ . 1 .]" 1
333 1 17 LEU HA 1 20 PHE QB 2.400 . 3.100 2.582 2.487 2.771 . 0 0 "[ . 1 .]" 1
334 1 17 LEU HA 1 20 PHE QD 2.800 . 3.800 3.692 3.413 3.813 0.013 6 0 "[ . 1 .]" 1
335 1 17 LEU HA 1 114 LEU QD 2.400 . 3.100 2.379 1.953 2.748 . 0 0 "[ . 1 .]" 1
336 1 17 LEU QB 1 17 LEU QD 2.100 . 2.700 1.798 1.731 2.059 . 0 0 "[ . 1 .]" 1
337 1 17 LEU QB 1 18 ALA H 2.900 . 4.000 2.764 2.659 2.861 . 0 0 "[ . 1 .]" 1
338 1 17 LEU QB 1 21 PHE QD 2.800 . 3.800 3.129 2.900 3.397 . 0 0 "[ . 1 .]" 1
339 1 17 LEU QB 1 21 PHE QD 3.000 . 5.500 3.119 2.894 3.380 . 0 0 "[ . 1 .]" 1
340 1 17 LEU QB 1 21 PHE QE 3.000 . 4.100 3.261 2.911 3.610 . 0 0 "[ . 1 .]" 1
341 1 17 LEU QB 1 43 LEU QD 2.500 . 3.300 1.958 1.620 2.266 0.080 2 0 "[ . 1 .]" 1
342 1 17 LEU QB 1 56 ILE MD 2.800 . 5.500 3.611 3.322 3.858 . 0 0 "[ . 1 .]" 1
343 1 17 LEU QB 1 56 ILE HG13 2.400 . 5.500 5.214 5.069 5.348 . 0 0 "[ . 1 .]" 1
344 1 17 LEU QB 1 94 HIS HD2 2.900 . 5.500 4.190 3.845 4.630 . 0 0 "[ . 1 .]" 1
345 1 17 LEU MD1 1 17 LEU MD2 1.800 . 2.200 2.042 1.933 2.098 . 0 0 "[ . 1 .]" 1
346 1 17 LEU QD 1 17 LEU HG 2.100 . 2.700 1.877 1.862 1.891 . 0 0 "[ . 1 .]" 1
347 1 17 LEU QD 1 18 ALA H 3.300 . 4.700 4.103 3.910 4.188 . 0 0 "[ . 1 .]" 1
348 1 17 LEU QD 1 20 PHE H 3.100 . 5.500 3.796 3.580 3.909 . 0 0 "[ . 1 .]" 1
349 1 17 LEU QD 1 20 PHE QD 2.900 . 4.000 3.813 3.053 3.929 . 0 0 "[ . 1 .]" 1
350 1 17 LEU QD 1 20 PHE QD 2.500 . 5.500 3.421 2.963 3.540 . 0 0 "[ . 1 .]" 1
351 1 17 LEU QD 1 21 PHE H 3.400 . 5.500 4.136 3.869 4.214 . 0 0 "[ . 1 .]" 1
352 1 17 LEU QD 1 21 PHE QD 2.600 . 3.400 3.218 3.026 3.384 . 0 0 "[ . 1 .]" 1
353 1 17 LEU QD 1 21 PHE QD 3.000 . 5.500 3.069 2.925 3.244 . 0 0 "[ . 1 .]" 1
354 1 17 LEU QD 1 21 PHE QE 2.100 . 2.700 1.813 1.521 2.320 . 0 0 "[ . 1 .]" 1
355 1 17 LEU QD 1 21 PHE HZ 3.000 . 4.100 3.188 3.016 3.373 . 0 0 "[ . 1 .]" 1
356 1 17 LEU QD 1 56 ILE HB 2.800 . 5.500 3.500 3.222 4.020 . 0 0 "[ . 1 .]" 1
357 1 17 LEU QD 1 43 LEU QD 2.200 . 2.800 2.367 2.127 2.726 . 0 0 "[ . 1 .]" 1
358 1 17 LEU QD 1 56 ILE MD 2.100 . 2.700 2.306 2.010 2.694 . 0 0 "[ . 1 .]" 1
359 1 17 LEU QD 1 56 ILE MD 1.900 . 5.500 2.080 1.914 2.250 . 0 0 "[ . 1 .]" 1
360 1 17 LEU QD 1 56 ILE HG12 3.200 . 4.500 3.722 3.287 4.281 . 0 0 "[ . 1 .]" 1
361 1 17 LEU QD 1 56 ILE HG12 2.800 . 5.500 2.974 2.759 3.263 . 0 0 "[ . 1 .]" 1
362 1 17 LEU QD 1 56 ILE MG 2.400 . 3.100 2.681 2.226 3.088 . 0 0 "[ . 1 .]" 1
363 1 17 LEU QD 1 93 LEU QD 2.300 . 3.000 1.881 1.625 2.075 . 0 0 "[ . 1 .]" 1
364 1 17 LEU QD 1 93 LEU HB3 2.600 . 5.500 4.131 3.453 4.967 . 0 0 "[ . 1 .]" 1
365 1 17 LEU QD 1 93 LEU QD 2.400 . 3.100 2.169 1.645 2.786 0.055 3 0 "[ . 1 .]" 1
366 1 17 LEU QD 1 93 LEU HG 2.400 . 5.500 3.629 2.929 5.007 . 0 0 "[ . 1 .]" 1
367 1 17 LEU QD 1 94 HIS HA 2.700 . 3.600 3.430 3.278 3.538 . 0 0 "[ . 1 .]" 1
368 1 17 LEU QD 1 94 HIS HD2 2.700 . 3.600 2.135 1.754 2.644 0.046 1 0 "[ . 1 .]" 1
369 1 17 LEU QD 1 114 LEU HB3 2.300 . 3.000 2.154 1.983 2.298 . 0 0 "[ . 1 .]" 1
370 1 17 LEU HG 1 114 LEU QD 2.300 . 3.000 1.963 1.743 3.173 0.173 6 0 "[ . 1 .]" 1
371 1 18 ALA H 1 18 ALA HA 2.600 . 3.400 2.828 2.817 2.847 . 0 0 "[ . 1 .]" 1
372 1 18 ALA H 1 18 ALA MB 2.300 . 3.000 2.040 2.029 2.070 . 0 0 "[ . 1 .]" 1
373 1 18 ALA H 1 19 GLU H 2.600 . 3.400 2.682 2.574 2.747 . 0 0 "[ . 1 .]" 1
374 1 18 ALA H 1 21 PHE H 2.800 . 5.500 4.985 4.927 5.044 . 0 0 "[ . 1 .]" 1
375 1 18 ALA H 1 43 LEU QD 2.800 . 3.800 2.599 2.429 2.825 . 0 0 "[ . 1 .]" 1
376 1 18 ALA HA 1 18 ALA MB 2.000 . 2.500 2.085 2.082 2.092 . 0 0 "[ . 1 .]" 1
377 1 18 ALA HA 1 19 GLU H 3.200 . 4.500 3.556 3.539 3.564 . 0 0 "[ . 1 .]" 1
378 1 18 ALA HA 1 21 PHE H 3.000 . 4.100 3.814 3.649 3.945 . 0 0 "[ . 1 .]" 1
379 1 18 ALA HA 1 21 PHE HB2 2.800 . 3.800 3.191 3.019 3.319 . 0 0 "[ . 1 .]" 1
380 1 18 ALA HA 1 21 PHE HB3 2.900 . 5.500 4.807 4.639 4.967 . 0 0 "[ . 1 .]" 1
381 1 18 ALA HA 1 21 PHE QD 2.700 . 3.600 3.404 3.170 3.610 0.010 2 0 "[ . 1 .]" 1
382 1 18 ALA HA 1 36 VAL MG1 2.300 . 3.000 2.904 2.760 3.174 0.174 6 0 "[ . 1 .]" 1
383 1 18 ALA HA 1 36 VAL MG2 2.500 . 5.500 4.462 4.292 4.580 . 0 0 "[ . 1 .]" 1
384 1 18 ALA HA 1 43 LEU QD 2.100 . 2.700 2.072 1.911 2.232 . 0 0 "[ . 1 .]" 1
385 1 18 ALA MB 1 19 GLU H 2.500 . 3.300 2.507 2.458 2.621 . 0 0 "[ . 1 .]" 1
386 1 18 ALA MB 1 19 GLU HA 2.700 . 3.600 3.634 3.622 3.654 0.054 6 0 "[ . 1 .]" 1
387 1 18 ALA MB 1 19 GLU QG 2.400 . 3.100 2.719 2.396 2.910 . 0 0 "[ . 1 .]" 1
388 1 18 ALA MB 1 21 PHE H 3.200 . 4.500 3.934 3.841 4.084 . 0 0 "[ . 1 .]" 1
389 1 18 ALA MB 1 21 PHE QD 2.600 . 5.500 3.454 3.277 3.560 . 0 0 "[ . 1 .]" 1
390 1 18 ALA MB 1 38 PHE H 3.400 . 4.800 4.041 3.734 4.308 . 0 0 "[ . 1 .]" 1
391 1 18 ALA MB 1 38 PHE HB2 2.600 . 3.400 2.225 1.889 2.599 . 0 0 "[ . 1 .]" 1
392 1 18 ALA MB 1 38 PHE HB3 2.700 . 3.600 2.768 2.394 3.103 . 0 0 "[ . 1 .]" 1
393 1 18 ALA MB 1 38 PHE QD 2.300 . 3.000 2.808 2.650 2.997 . 0 0 "[ . 1 .]" 1
394 1 18 ALA MB 1 38 PHE QE 2.900 . 4.000 3.541 3.350 3.668 . 0 0 "[ . 1 .]" 1
395 1 19 GLU H 1 19 GLU HA 2.600 . 3.400 2.797 2.753 2.809 . 0 0 "[ . 1 .]" 1
396 1 19 GLU H 1 19 GLU QB 2.300 . 3.000 2.361 2.130 2.541 . 0 0 "[ . 1 .]" 1
397 1 19 GLU H 1 19 GLU QG 2.900 . 4.000 2.386 1.976 3.378 . 0 0 "[ . 1 .]" 1
398 1 19 GLU H 1 20 PHE H 2.600 . 3.400 2.661 2.617 2.754 . 0 0 "[ . 1 .]" 1
399 1 19 GLU H 1 21 PHE H 3.100 . 4.300 3.876 3.820 3.931 . 0 0 "[ . 1 .]" 1
400 1 19 GLU H 1 43 LEU QD 3.200 . 4.500 4.142 4.087 4.310 . 0 0 "[ . 1 .]" 1
401 1 19 GLU HA 1 19 GLU QB 2.000 . 2.500 2.412 2.343 2.470 . 0 0 "[ . 1 .]" 1
402 1 19 GLU HA 1 19 GLU QG 2.100 . 2.700 2.383 2.238 2.607 . 0 0 "[ . 1 .]" 1
403 1 19 GLU HA 1 20 PHE H 2.500 . 5.500 3.501 3.475 3.524 . 0 0 "[ . 1 .]" 1
404 1 19 GLU HA 1 23 ASP H 3.100 . 4.300 4.118 4.010 4.278 . 0 0 "[ . 1 .]" 1
405 1 19 GLU QB 1 20 PHE H 2.500 . 3.300 2.757 2.656 2.849 . 0 0 "[ . 1 .]" 1
406 1 20 PHE H 1 20 PHE HA 2.400 . 3.100 2.829 2.816 2.844 . 0 0 "[ . 1 .]" 1
407 1 20 PHE H 1 20 PHE QB 2.200 . 2.800 2.227 2.204 2.247 . 0 0 "[ . 1 .]" 1
408 1 20 PHE H 1 20 PHE QD 2.800 . 5.500 4.163 4.134 4.185 . 0 0 "[ . 1 .]" 1
409 1 20 PHE H 1 21 PHE H 2.500 . 3.300 2.833 2.776 2.894 . 0 0 "[ . 1 .]" 1
410 1 20 PHE H 1 21 PHE H 2.300 . 3.000 2.523 2.442 2.602 . 0 0 "[ . 1 .]" 1
411 1 20 PHE H 1 114 LEU QD 3.000 . 4.100 3.904 3.644 4.064 . 0 0 "[ . 1 .]" 1
412 1 20 PHE HA 1 20 PHE QB 2.300 . 3.000 2.307 2.284 2.331 . 0 0 "[ . 1 .]" 1
413 1 20 PHE HA 1 20 PHE QB 1.900 . 2.400 2.132 2.100 2.161 . 0 0 "[ . 1 .]" 1
414 1 20 PHE HA 1 20 PHE QD 2.400 . 3.100 2.474 2.398 2.587 . 0 0 "[ . 1 .]" 1
415 1 20 PHE HA 1 20 PHE QE 3.200 . 4.500 4.059 3.746 4.216 . 0 0 "[ . 1 .]" 1
416 1 20 PHE HA 1 23 ASP H 2.800 . 3.800 3.485 3.386 3.636 . 0 0 "[ . 1 .]" 1
417 1 20 PHE HA 1 23 ASP HB2 2.700 . 3.600 3.341 3.150 3.608 0.008 4 0 "[ . 1 .]" 1
418 1 20 PHE HA 1 23 ASP HB3 2.600 . 3.400 3.069 2.835 3.306 . 0 0 "[ . 1 .]" 1
419 1 20 PHE QB 1 20 PHE QD 2.300 . 3.000 2.135 2.130 2.142 . 0 0 "[ . 1 .]" 1
420 1 20 PHE QB 1 20 PHE QE 2.900 . 4.000 3.933 3.930 3.937 . 0 0 "[ . 1 .]" 1
421 1 20 PHE QB 1 21 PHE H 2.500 . 3.300 2.238 2.133 2.328 . 0 0 "[ . 1 .]" 1
422 1 20 PHE QB 1 114 LEU QD 2.500 . 2.800 2.149 1.825 2.332 . 0 0 "[ . 1 .]" 1
423 1 20 PHE QD 1 21 PHE H 2.700 . 3.600 3.027 2.892 3.124 . 0 0 "[ . 1 .]" 1
424 1 20 PHE QD 1 21 PHE HA 2.700 . 3.600 3.460 3.304 3.571 . 0 0 "[ . 1 .]" 1
425 1 20 PHE QD 1 21 PHE QD 2.800 . 3.800 3.048 2.869 3.282 . 0 0 "[ . 1 .]" 1
426 1 20 PHE QD 1 21 PHE QE 3.000 . 4.100 3.668 3.502 3.825 . 0 0 "[ . 1 .]" 1
427 1 20 PHE QD 1 21 PHE HZ 3.200 . 4.500 4.406 4.219 4.543 0.043 5 0 "[ . 1 .]" 1
428 1 20 PHE QD 1 24 LEU H 3.300 . 4.700 4.019 3.746 4.347 . 0 0 "[ . 1 .]" 1
429 1 20 PHE QD 1 24 LEU MD1 2.700 . 3.600 3.167 3.029 3.355 . 0 0 "[ . 1 .]" 1
430 1 20 PHE QD 1 24 LEU MD2 2.700 . 3.600 3.489 3.396 3.601 0.001 3 0 "[ . 1 .]" 1
431 1 20 PHE QD 1 97 LEU HG 3.100 . 5.500 3.889 3.796 3.946 . 0 0 "[ . 1 .]" 1
432 1 20 PHE QD 1 111 LEU MD2 2.700 . 3.600 3.307 2.975 3.539 . 0 0 "[ . 1 .]" 1
433 1 20 PHE QD 1 114 LEU QD 2.500 . 5.500 2.933 2.703 3.161 . 0 0 "[ . 1 .]" 1
434 1 20 PHE QE 1 114 LEU QD 2.800 . 5.500 3.674 3.363 3.930 . 0 0 "[ . 1 .]" 1
435 1 20 PHE QE 1 24 LEU MD1 2.300 . 3.000 2.729 2.585 2.868 . 0 0 "[ . 1 .]" 1
436 1 20 PHE QE 1 24 LEU MD2 2.200 . 2.800 2.553 2.460 2.693 . 0 0 "[ . 1 .]" 1
437 1 20 PHE QE 1 24 LEU HG 3.200 . 4.500 3.894 3.816 3.983 . 0 0 "[ . 1 .]" 1
438 1 20 PHE QE 1 109 LEU QD 2.500 . 3.300 2.350 2.220 2.412 . 0 0 "[ . 1 .]" 1
439 1 20 PHE QE 1 111 LEU MD1 2.200 . 2.800 2.443 2.221 2.816 0.016 5 0 "[ . 1 .]" 1
440 1 20 PHE QE 1 111 LEU MD2 2.500 . 3.300 2.910 2.398 3.181 . 0 0 "[ . 1 .]" 1
441 1 20 PHE QE 1 111 LEU HG 2.900 . 4.000 3.267 3.005 3.480 . 0 0 "[ . 1 .]" 1
442 1 20 PHE HZ 1 24 LEU MD1 2.500 . 3.300 2.904 2.712 3.149 . 0 0 "[ . 1 .]" 1
443 1 20 PHE HZ 1 24 LEU MD2 2.900 . 4.000 2.934 2.689 3.152 . 0 0 "[ . 1 .]" 1
444 1 20 PHE HZ 1 109 LEU HB2 3.300 . 4.700 4.236 3.986 4.511 . 0 0 "[ . 1 .]" 1
445 1 20 PHE HZ 1 109 LEU QD 2.600 . 5.500 1.757 1.597 1.896 . 0 0 "[ . 1 .]" 1
446 1 20 PHE HZ 1 109 LEU HG 2.900 . 4.000 4.009 3.945 4.030 0.030 1 0 "[ . 1 .]" 1
447 1 20 PHE HZ 1 111 LEU MD1 2.300 . 3.000 2.279 2.010 2.620 . 0 0 "[ . 1 .]" 1
448 1 20 PHE HZ 1 111 LEU MD2 2.800 . 5.500 4.298 3.542 4.603 . 0 0 "[ . 1 .]" 1
449 1 21 PHE H 1 21 PHE HA 2.500 . 3.300 2.780 2.767 2.794 . 0 0 "[ . 1 .]" 1
450 1 21 PHE H 1 21 PHE HB2 2.500 . 3.300 2.320 2.290 2.361 . 0 0 "[ . 1 .]" 1
451 1 21 PHE H 1 21 PHE HB3 2.700 . 3.600 3.559 3.549 3.571 . 0 0 "[ . 1 .]" 1
452 1 21 PHE H 1 22 GLU H 2.600 . 3.400 2.745 2.668 2.807 . 0 0 "[ . 1 .]" 1
453 1 21 PHE HA 1 21 PHE HB2 2.500 . 3.300 3.005 3.000 3.014 . 0 0 "[ . 1 .]" 1
454 1 21 PHE HA 1 21 PHE HB3 2.500 . 3.300 2.600 2.574 2.622 . 0 0 "[ . 1 .]" 1
455 1 21 PHE HA 1 21 PHE QD 2.200 . 2.800 2.506 2.340 2.686 . 0 0 "[ . 1 .]" 1
456 1 21 PHE HA 1 22 GLU H 2.900 . 4.000 3.518 3.492 3.551 . 0 0 "[ . 1 .]" 1
457 1 21 PHE HA 1 24 LEU H 2.800 . 3.800 3.408 3.335 3.502 . 0 0 "[ . 1 .]" 1
458 1 21 PHE HA 1 24 LEU HB2 2.500 . 3.300 3.152 2.917 3.300 . 0 0 "[ . 1 .]" 1
459 1 21 PHE HA 1 24 LEU MD1 2.300 . 3.000 1.785 1.592 1.976 0.008 1 0 "[ . 1 .]" 1
460 1 21 PHE HA 1 24 LEU MD2 2.700 . 5.500 4.148 3.974 4.258 . 0 0 "[ . 1 .]" 1
461 1 21 PHE HA 1 24 LEU HG 2.400 . 3.100 2.894 2.651 3.125 0.025 8 0 "[ . 1 .]" 1
462 1 21 PHE HA 1 36 VAL MG2 2.600 . 5.500 3.618 3.484 3.748 . 0 0 "[ . 1 .]" 1
463 1 21 PHE HB2 1 21 PHE QD 2.600 . 3.400 2.280 2.264 2.306 . 0 0 "[ . 1 .]" 1
464 1 21 PHE HB2 1 22 GLU H 3.300 . 4.700 2.813 2.672 2.916 . 0 0 "[ . 1 .]" 1
465 1 21 PHE HB2 1 36 VAL MG1 2.700 . 3.600 2.291 2.023 2.531 . 0 0 "[ . 1 .]" 1
466 1 21 PHE HB2 1 36 VAL MG2 2.500 . 3.300 3.076 2.917 3.242 . 0 0 "[ . 1 .]" 1
467 1 21 PHE HB2 1 43 LEU QD 2.900 . 4.000 3.130 2.829 3.498 . 0 0 "[ . 1 .]" 1
468 1 21 PHE HB2 1 45 VAL QG 2.600 . 3.400 3.173 3.080 3.311 . 0 0 "[ . 1 .]" 1
469 1 21 PHE HB2 1 45 VAL QG 2.600 . 3.400 2.639 2.541 2.809 . 0 0 "[ . 1 .]" 1
470 1 21 PHE HB3 1 21 PHE QD 2.500 . 3.300 2.552 2.486 2.612 . 0 0 "[ . 1 .]" 1
471 1 21 PHE HB3 1 22 GLU H 3.500 . 5.000 3.524 3.344 3.674 . 0 0 "[ . 1 .]" 1
472 1 21 PHE HB3 1 24 LEU MD1 2.800 . 3.800 3.430 3.238 3.571 . 0 0 "[ . 1 .]" 1
473 1 21 PHE HB3 1 36 VAL MG1 2.600 . 3.400 2.283 1.941 2.623 . 0 0 "[ . 1 .]" 1
474 1 21 PHE HB3 1 36 VAL MG2 2.400 . 3.100 1.937 1.759 2.175 . 0 0 "[ . 1 .]" 1
475 1 21 PHE HB3 1 45 VAL QG 2.800 . 3.800 2.563 2.408 2.694 . 0 0 "[ . 1 .]" 1
476 1 21 PHE QD 1 22 GLU H 3.200 . 4.500 4.475 4.401 4.517 0.017 4 0 "[ . 1 .]" 1
477 1 21 PHE QD 1 24 LEU HB2 3.000 . 5.500 3.866 3.778 3.930 . 0 0 "[ . 1 .]" 1
478 1 21 PHE QD 1 24 LEU MD1 2.200 . 2.800 2.498 2.286 2.799 . 0 0 "[ . 1 .]" 1
479 1 21 PHE QD 1 36 VAL MG2 2.500 . 5.500 3.609 3.456 3.840 . 0 0 "[ . 1 .]" 1
480 1 21 PHE QD 1 45 VAL QG 2.500 . 3.300 2.411 2.277 2.633 . 0 0 "[ . 1 .]" 1
481 1 21 PHE QD 1 47 LEU MD2 3.000 . 5.500 4.000 2.776 4.417 . 0 0 "[ . 1 .]" 1
482 1 21 PHE QE 1 24 LEU HB2 2.700 . 5.500 4.060 3.254 4.925 . 0 0 "[ . 1 .]" 1
483 1 21 PHE QE 1 24 LEU MD1 2.700 . 5.500 3.564 3.361 3.723 . 0 0 "[ . 1 .]" 1
484 1 21 PHE QE 1 24 LEU MD1 2.400 . 5.500 2.938 2.548 3.232 . 0 0 "[ . 1 .]" 1
485 1 21 PHE QE 1 24 LEU MD2 2.300 . 5.500 5.405 5.267 5.510 0.010 5 0 "[ . 1 .]" 1
486 1 21 PHE QE 1 36 VAL MG2 2.500 . 5.500 5.310 5.175 5.520 0.020 14 0 "[ . 1 .]" 1
487 1 21 PHE QE 1 45 VAL QG 2.600 . 3.400 2.862 2.729 2.999 . 0 0 "[ . 1 .]" 1
488 1 21 PHE QE 1 96 LEU MD2 2.700 . 5.500 4.036 3.606 4.395 . 0 0 "[ . 1 .]" 1
489 1 21 PHE QE 1 56 ILE MD 2.400 . 3.100 2.548 2.113 2.808 . 0 0 "[ . 1 .]" 1
490 1 21 PHE QE 1 111 LEU MD2 2.300 . 5.500 3.365 3.165 3.902 . 0 0 "[ . 1 .]" 1
491 1 21 PHE QE 1 97 LEU QD 2.600 . 5.500 2.633 1.971 3.608 . 0 0 "[ . 1 .]" 1
492 1 21 PHE QE 1 97 LEU HG 2.300 . 5.500 3.303 2.995 4.074 . 0 0 "[ . 1 .]" 1
493 1 21 PHE QE 1 97 LEU HG 2.200 . 5.500 2.546 2.145 2.911 . 0 0 "[ . 1 .]" 1
494 1 21 PHE QE 1 101 LEU QD 2.400 . 3.100 2.708 2.189 3.090 . 0 0 "[ . 1 .]" 1
495 1 21 PHE QE 1 111 LEU MD2 3.200 . 4.500 3.895 3.543 4.522 0.022 5 0 "[ . 1 .]" 1
496 1 21 PHE HZ 1 45 VAL QG 3.000 . 5.500 3.616 3.454 3.767 . 0 0 "[ . 1 .]" 1
497 1 21 PHE HZ 1 56 ILE MD 2.800 . 3.800 3.078 2.655 3.351 . 0 0 "[ . 1 .]" 1
498 1 21 PHE HZ 1 96 LEU QD 3.100 . 4.300 3.898 3.415 4.144 . 0 0 "[ . 1 .]" 1
499 1 21 PHE HZ 1 97 LEU QD 2.600 . 3.400 2.045 1.616 3.119 0.184 5 0 "[ . 1 .]" 1
500 1 21 PHE HZ 1 97 LEU HG 2.200 . 2.800 2.076 1.672 2.944 0.144 5 0 "[ . 1 .]" 1
501 1 22 GLU H 1 22 GLU HA 2.500 . 3.300 2.837 2.808 2.855 . 0 0 "[ . 1 .]" 1
502 1 22 GLU H 1 22 GLU QB 2.600 . 3.400 2.171 2.073 2.280 . 0 0 "[ . 1 .]" 1
503 1 22 GLU H 1 22 GLU HG2 2.600 . 5.500 3.768 3.478 4.154 . 0 0 "[ . 1 .]" 1
504 1 22 GLU H 1 22 GLU HG3 2.600 . 3.400 3.002 2.608 3.407 0.007 12 0 "[ . 1 .]" 1
505 1 22 GLU H 1 23 ASP H 2.500 . 3.300 2.551 2.473 2.641 . 0 0 "[ . 1 .]" 1
506 1 22 GLU H 1 36 VAL MG1 2.800 . 3.800 3.105 2.860 3.517 . 0 0 "[ . 1 .]" 1
507 1 22 GLU HA 1 22 GLU QB 2.200 . 2.800 2.487 2.441 2.530 . 0 0 "[ . 1 .]" 1
508 1 22 GLU HA 1 22 GLU QB 2.000 . 2.500 2.208 2.135 2.252 . 0 0 "[ . 1 .]" 1
509 1 22 GLU HA 1 22 GLU HG2 2.200 . 2.800 2.242 2.064 2.494 . 0 0 "[ . 1 .]" 1
510 1 22 GLU HA 1 22 GLU HG3 2.500 . 3.300 3.029 2.765 3.286 . 0 0 "[ . 1 .]" 1
511 1 22 GLU HA 1 23 ASP H 2.900 . 4.000 3.500 3.464 3.521 . 0 0 "[ . 1 .]" 1
512 1 22 GLU HA 1 24 LEU H 3.500 . 5.000 4.183 4.063 4.308 . 0 0 "[ . 1 .]" 1
513 1 22 GLU HA 1 25 ALA H 3.100 . 4.300 3.521 3.418 3.643 . 0 0 "[ . 1 .]" 1
514 1 22 GLU HA 1 25 ALA MB 2.400 . 3.100 2.876 2.583 3.057 . 0 0 "[ . 1 .]" 1
515 1 22 GLU HA 1 25 ALA MB 1.800 . 2.200 2.050 2.004 2.079 . 0 0 "[ . 1 .]" 1
516 1 22 GLU HA 1 34 TYR QE 2.700 . 5.500 4.033 3.784 4.719 . 0 0 "[ . 1 .]" 1
517 1 22 GLU HA 1 36 VAL HB 2.700 . 3.600 3.131 2.764 3.435 . 0 0 "[ . 1 .]" 1
518 1 22 GLU HA 1 36 VAL MG1 2.400 . 5.500 3.353 3.093 3.627 . 0 0 "[ . 1 .]" 1
519 1 22 GLU HA 1 36 VAL MG1 2.400 . 3.100 3.002 2.839 3.096 . 0 0 "[ . 1 .]" 1
520 1 22 GLU HA 1 36 VAL MG2 2.100 . 2.700 2.256 2.022 2.511 . 0 0 "[ . 1 .]" 1
521 1 22 GLU QB 1 23 ASP H 2.700 . 3.600 2.809 2.706 2.980 . 0 0 "[ . 1 .]" 1
522 1 22 GLU HG2 1 23 ASP H 2.700 . 5.500 5.035 4.930 5.153 . 0 0 "[ . 1 .]" 1
523 1 22 GLU HG2 1 36 VAL MG1 2.500 . 3.300 2.932 2.449 3.301 0.001 15 0 "[ . 1 .]" 1
524 1 22 GLU HG2 1 36 VAL MG2 2.600 . 3.400 3.124 2.811 3.383 . 0 0 "[ . 1 .]" 1
525 1 22 GLU HG3 1 36 VAL MG1 2.400 . 3.100 2.306 1.794 2.731 . 0 0 "[ . 1 .]" 1
526 1 22 GLU HG3 1 36 VAL MG2 2.900 . 4.000 3.594 3.045 3.927 . 0 0 "[ . 1 .]" 1
527 1 23 ASP H 1 23 ASP HA 2.300 . 3.000 2.848 2.833 2.875 . 0 0 "[ . 1 .]" 1
528 1 23 ASP H 1 23 ASP HB2 2.200 . 2.800 2.441 2.292 2.649 . 0 0 "[ . 1 .]" 1
529 1 23 ASP H 1 23 ASP HB3 2.200 . 2.800 2.659 2.429 2.814 0.014 14 0 "[ . 1 .]" 1
530 1 23 ASP H 1 24 LEU H 2.400 . 3.100 2.512 2.416 2.580 . 0 0 "[ . 1 .]" 1
531 1 23 ASP HA 1 24 LEU H 2.900 . 4.000 3.496 3.475 3.523 . 0 0 "[ . 1 .]" 1
532 1 23 ASP HA 1 25 ALA H 3.100 . 4.300 3.905 3.726 4.032 . 0 0 "[ . 1 .]" 1
533 1 23 ASP HA 1 25 ALA MB 2.700 . 5.500 4.184 4.011 4.396 . 0 0 "[ . 1 .]" 1
534 1 23 ASP HA 1 25 ALA MB 2.600 . 5.500 3.729 3.600 3.810 . 0 0 "[ . 1 .]" 1
535 1 23 ASP HA 1 26 ASP H 3.400 . 4.800 3.771 3.527 4.072 . 0 0 "[ . 1 .]" 1
536 1 23 ASP HB2 1 24 LEU H 3.000 . 4.100 3.879 3.763 4.030 . 0 0 "[ . 1 .]" 1
537 1 23 ASP HB3 1 24 LEU H 2.800 . 3.800 2.830 2.671 2.938 . 0 0 "[ . 1 .]" 1
538 1 24 LEU H 1 24 LEU HA 2.500 . 3.300 2.837 2.812 2.870 . 0 0 "[ . 1 .]" 1
539 1 24 LEU H 1 24 LEU HB2 2.400 . 3.100 2.621 2.510 2.718 . 0 0 "[ . 1 .]" 1
540 1 24 LEU H 1 24 LEU HB3 2.700 . 3.600 3.593 3.582 3.605 0.005 8 0 "[ . 1 .]" 1
541 1 24 LEU H 1 24 LEU MD1 2.900 . 4.000 3.343 3.162 3.449 . 0 0 "[ . 1 .]" 1
542 1 24 LEU H 1 24 LEU MD2 2.800 . 3.800 3.377 3.186 3.565 . 0 0 "[ . 1 .]" 1
543 1 24 LEU H 1 24 LEU HG 2.400 . 3.100 2.024 1.851 2.216 . 0 0 "[ . 1 .]" 1
544 1 24 LEU HA 1 24 LEU HB2 2.500 . 3.300 3.015 3.007 3.020 . 0 0 "[ . 1 .]" 1
545 1 24 LEU HA 1 24 LEU HB3 2.300 . 3.000 2.406 2.361 2.463 . 0 0 "[ . 1 .]" 1
546 1 24 LEU HA 1 24 LEU MD1 2.400 . 5.500 3.950 3.908 3.994 . 0 0 "[ . 1 .]" 1
547 1 24 LEU HA 1 24 LEU MD2 2.000 . 2.500 2.292 2.037 2.462 . 0 0 "[ . 1 .]" 1
548 1 24 LEU HA 1 24 LEU HG 2.400 . 3.100 3.062 2.974 3.125 0.025 2 0 "[ . 1 .]" 1
549 1 24 LEU HA 1 25 ALA H 3.000 . 4.100 3.452 3.383 3.491 . 0 0 "[ . 1 .]" 1
550 1 24 LEU HA 1 26 ASP H 3.500 . 5.000 3.733 3.421 4.038 . 0 0 "[ . 1 .]" 1
551 1 24 LEU HA 1 27 LYS H 2.900 . 4.000 3.472 3.025 3.996 . 0 0 "[ . 1 .]" 1
552 1 24 LEU HA 1 27 LYS HB3 2.500 . 5.500 3.760 3.435 3.934 . 0 0 "[ . 1 .]" 1
553 1 24 LEU HA 1 27 LYS QD 2.300 . 5.500 3.355 1.544 4.948 . 0 0 "[ . 1 .]" 1
554 1 24 LEU HA 1 29 TYR QE 3.200 . 4.500 2.884 2.545 3.261 . 0 0 "[ . 1 .]" 1
555 1 24 LEU HB2 1 24 LEU MD1 2.200 . 2.800 2.137 2.029 2.292 . 0 0 "[ . 1 .]" 1
556 1 24 LEU HB2 1 24 LEU MD2 2.400 . 5.500 3.166 3.141 3.185 . 0 0 "[ . 1 .]" 1
557 1 24 LEU HB2 1 29 TYR QE 2.800 . 3.800 3.497 3.262 3.811 0.011 2 0 "[ . 1 .]" 1
558 1 24 LEU HB2 1 36 VAL MG2 2.000 . 5.500 4.295 4.051 4.478 . 0 0 "[ . 1 .]" 1
559 1 24 LEU HB3 1 24 LEU MD1 2.300 . 3.000 2.535 2.442 2.641 . 0 0 "[ . 1 .]" 1
560 1 24 LEU HB3 1 24 LEU MD2 2.400 . 3.100 2.221 2.113 2.347 . 0 0 "[ . 1 .]" 1
561 1 24 LEU HB3 1 25 ALA H 3.200 . 4.500 4.048 3.857 4.256 . 0 0 "[ . 1 .]" 1
562 1 24 LEU HB3 1 29 TYR QD 3.300 . 4.700 4.142 3.962 4.450 . 0 0 "[ . 1 .]" 1
563 1 24 LEU HB3 1 29 TYR QE 3.000 . 5.500 1.830 1.625 2.178 . 0 0 "[ . 1 .]" 1
564 1 24 LEU HB3 1 30 THR MG 2.300 . 3.000 2.910 2.708 3.009 0.009 5 0 "[ . 1 .]" 1
565 1 24 LEU MD1 1 24 LEU MD2 1.700 . 2.200 1.983 1.881 2.088 . 0 0 "[ . 1 .]" 1
566 1 24 LEU MD1 1 24 LEU HG 2.100 . 2.700 2.100 2.081 2.126 . 0 0 "[ . 1 .]" 1
567 1 24 LEU MD1 1 29 TYR QE 2.400 . 5.500 3.604 3.368 3.841 . 0 0 "[ . 1 .]" 1
568 1 24 LEU MD1 1 30 THR MG 2.100 . 5.500 3.769 3.210 3.994 . 0 0 "[ . 1 .]" 1
569 1 24 LEU MD1 1 34 TYR QE 2.900 . 5.500 3.564 3.266 3.864 . 0 0 "[ . 1 .]" 1
570 1 24 LEU MD1 1 36 VAL MG2 2.500 . 5.500 3.943 3.769 4.035 . 0 0 "[ . 1 .]" 1
571 1 24 LEU MD1 1 105 LEU QD 2.200 . 5.500 4.977 4.444 5.266 . 0 0 "[ . 1 .]" 1
572 1 24 LEU MD1 1 109 LEU HB3 2.600 . 5.500 5.028 4.801 5.338 . 0 0 "[ . 1 .]" 1
573 1 24 LEU MD2 1 24 LEU HG 2.100 . 2.700 2.096 2.081 2.126 . 0 0 "[ . 1 .]" 1
574 1 24 LEU MD2 1 27 LYS QE 2.800 . 3.800 2.480 1.654 3.624 0.146 2 0 "[ . 1 .]" 1
575 1 24 LEU MD2 1 29 TYR QD 3.000 . 5.500 4.227 3.883 4.544 . 0 0 "[ . 1 .]" 1
576 1 24 LEU MD2 1 29 TYR QE 2.200 . 2.800 2.502 2.258 2.707 . 0 0 "[ . 1 .]" 1
577 1 24 LEU HG 1 25 ALA H 3.000 . 5.500 4.231 4.068 4.373 . 0 0 "[ . 1 .]" 1
578 1 24 LEU HG 1 29 TYR QE 2.600 . 5.500 3.353 2.886 3.556 . 0 0 "[ . 1 .]" 1
579 1 25 ALA H 1 25 ALA HA 2.500 . 3.300 2.805 2.786 2.835 . 0 0 "[ . 1 .]" 1
580 1 25 ALA H 1 25 ALA MB 2.000 . 2.500 2.107 2.025 2.234 . 0 0 "[ . 1 .]" 1
581 1 25 ALA H 1 26 ASP H 2.600 . 3.400 2.650 2.588 2.753 . 0 0 "[ . 1 .]" 1
582 1 25 ALA H 1 34 TYR QE 2.800 . 3.800 2.967 2.483 3.804 0.004 4 0 "[ . 1 .]" 1
583 1 25 ALA HA 1 25 ALA MB 1.800 . 2.200 2.099 2.081 2.127 . 0 0 "[ . 1 .]" 1
584 1 25 ALA HA 1 26 ASP H 2.800 . 3.800 3.459 3.363 3.539 . 0 0 "[ . 1 .]" 1
585 1 25 ALA HA 1 30 THR MG 2.400 . 3.100 2.555 2.057 3.080 . 0 0 "[ . 1 .]" 1
586 1 25 ALA HA 1 34 TYR QD 2.300 . 3.000 2.311 1.933 2.636 . 0 0 "[ . 1 .]" 1
587 1 25 ALA MB 1 26 ASP H 2.500 . 3.300 2.921 2.684 3.163 . 0 0 "[ . 1 .]" 1
588 1 25 ALA MB 1 26 ASP HA 2.100 . 5.500 3.872 3.760 3.945 . 0 0 "[ . 1 .]" 1
589 1 25 ALA MB 1 26 ASP HB3 2.600 . 5.500 5.172 3.775 5.487 . 0 0 "[ . 1 .]" 1
590 1 25 ALA MB 1 27 LYS QG 2.100 . 5.500 3.966 3.820 4.170 . 0 0 "[ . 1 .]" 1
591 1 25 ALA MB 1 30 THR MG 2.500 . 5.500 3.821 3.448 4.284 . 0 0 "[ . 1 .]" 1
592 1 25 ALA MB 1 34 TYR QD 2.100 . 2.700 2.473 1.830 2.704 0.004 8 0 "[ . 1 .]" 1
593 1 25 ALA MB 1 34 TYR QE 2.000 . 5.500 2.705 2.179 3.454 . 0 0 "[ . 1 .]" 1
594 1 25 ALA MB 1 36 VAL MG2 2.400 . 3.100 2.852 2.444 3.092 . 0 0 "[ . 1 .]" 1
595 1 25 ALA MB 1 45 VAL QG 1.900 . 5.500 5.141 4.811 5.241 . 0 0 "[ . 1 .]" 1
596 1 26 ASP H 1 26 ASP HA 2.400 . 3.100 2.875 2.834 2.915 . 0 0 "[ . 1 .]" 1
597 1 26 ASP H 1 26 ASP HB2 3.100 . 4.300 2.396 2.122 3.602 . 0 0 "[ . 1 .]" 1
598 1 26 ASP H 1 26 ASP HB3 2.500 . 3.300 3.097 2.388 3.617 0.317 1 0 "[ . 1 .]" 1
599 1 26 ASP H 1 27 LYS H 2.500 . 3.300 2.508 2.251 2.682 . 0 0 "[ . 1 .]" 1
600 1 26 ASP HA 1 26 ASP HB2 2.200 . 2.800 2.768 2.319 3.028 0.228 1 0 "[ . 1 .]" 1
601 1 26 ASP HA 1 26 ASP HB2 2.100 . 2.700 2.516 2.245 2.687 . 0 0 "[ . 1 .]" 1
602 1 26 ASP HA 1 27 LYS H 2.700 . 3.600 3.344 3.090 3.541 . 0 0 "[ . 1 .]" 1
603 1 26 ASP HB2 1 27 LYS H 3.300 . 4.700 3.750 3.082 4.448 . 0 0 "[ . 1 .]" 1
604 1 26 ASP HB3 1 27 LYS H 3.500 . 5.000 3.619 2.555 4.238 . 0 0 "[ . 1 .]" 1
605 1 27 LYS H 1 27 LYS HA 2.600 . 3.400 2.905 2.834 2.947 . 0 0 "[ . 1 .]" 1
606 1 27 LYS H 1 27 LYS HB2 2.500 . 3.300 2.501 2.106 2.765 . 0 0 "[ . 1 .]" 1
607 1 27 LYS H 1 27 LYS HB3 2.600 . 5.500 3.605 3.321 3.778 . 0 0 "[ . 1 .]" 1
608 1 27 LYS H 1 27 LYS QD 2.700 . 5.500 3.526 2.153 4.508 . 0 0 "[ . 1 .]" 1
609 1 27 LYS H 1 28 PRO HD2 3.200 . 5.500 5.053 4.985 5.268 . 0 0 "[ . 1 .]" 1
610 1 27 LYS H 1 28 PRO HD3 2.900 . 5.500 4.825 4.553 4.893 . 0 0 "[ . 1 .]" 1
611 1 27 LYS H 1 29 TYR QD 2.900 . 5.500 4.075 3.940 4.373 . 0 0 "[ . 1 .]" 1
612 1 27 LYS HA 1 27 LYS HB2 2.600 . 3.400 2.995 2.876 3.025 . 0 0 "[ . 1 .]" 1
613 1 27 LYS HA 1 27 LYS HB3 2.500 . 3.300 2.514 2.336 2.797 . 0 0 "[ . 1 .]" 1
614 1 27 LYS HA 1 27 LYS QD 2.700 . 3.600 3.312 2.639 3.687 0.087 3 0 "[ . 1 .]" 1
615 1 27 LYS HA 1 27 LYS QE 3.000 . 5.500 4.563 3.175 4.939 . 0 0 "[ . 1 .]" 1
616 1 27 LYS HA 1 28 PRO HD2 2.200 . 2.800 2.594 2.425 2.966 0.166 2 0 "[ . 1 .]" 1
617 1 27 LYS HA 1 28 PRO HD3 2.200 . 2.800 2.093 1.747 2.179 . 0 0 "[ . 1 .]" 1
618 1 27 LYS HA 1 28 PRO HG3 2.500 . 5.500 4.310 3.838 4.418 . 0 0 "[ . 1 .]" 1
619 1 27 LYS HA 1 29 TYR H 3.300 . 4.700 3.879 3.774 3.974 . 0 0 "[ . 1 .]" 1
620 1 27 LYS HB2 1 28 PRO HD2 2.900 . 4.000 3.908 3.621 4.252 0.252 8 0 "[ . 1 .]" 1
621 1 27 LYS HB2 1 28 PRO HD3 2.800 . 5.500 4.572 4.111 4.761 . 0 0 "[ . 1 .]" 1
622 1 27 LYS HB2 1 29 TYR H 2.900 . 4.000 3.350 2.800 3.961 . 0 0 "[ . 1 .]" 1
623 1 27 LYS HB2 1 30 THR H 3.100 . 4.300 4.088 3.735 4.316 0.016 8 0 "[ . 1 .]" 1
624 1 27 LYS HB3 1 28 PRO HD2 2.700 . 3.600 2.454 2.265 2.855 . 0 0 "[ . 1 .]" 1
625 1 27 LYS HB3 1 28 PRO HD3 2.800 . 3.800 3.516 2.847 3.714 . 0 0 "[ . 1 .]" 1
626 1 27 LYS HB3 1 28 PRO HG3 2.800 . 5.500 5.130 4.840 5.317 . 0 0 "[ . 1 .]" 1
627 1 27 LYS HB3 1 29 TYR H 2.700 . 3.600 2.561 2.255 2.939 . 0 0 "[ . 1 .]" 1
628 1 27 LYS QE 1 30 THR MG 2.800 . 5.500 4.697 4.274 5.149 . 0 0 "[ . 1 .]" 1
629 1 28 PRO HA 1 28 PRO HB2 2.100 . 2.700 2.675 2.666 2.681 . 0 0 "[ . 1 .]" 1
630 1 28 PRO HA 1 28 PRO HB3 2.000 . 2.500 2.312 2.278 2.325 . 0 0 "[ . 1 .]" 1
631 1 28 PRO HA 1 28 PRO HD2 2.700 . 5.500 4.060 3.919 4.089 . 0 0 "[ . 1 .]" 1
632 1 28 PRO HA 1 28 PRO HD3 2.800 . 5.500 3.811 3.747 3.997 . 0 0 "[ . 1 .]" 1
633 1 28 PRO HA 1 29 TYR H 2.900 . 4.000 3.334 3.140 3.438 . 0 0 "[ . 1 .]" 1
634 1 28 PRO HA 1 29 TYR QD 3.300 . 5.500 4.578 4.358 4.734 . 0 0 "[ . 1 .]" 1
635 1 28 PRO HA 1 30 THR H 3.100 . 4.300 3.456 3.300 3.883 . 0 0 "[ . 1 .]" 1
636 1 28 PRO HB2 1 28 PRO HD2 2.700 . 5.500 3.958 3.654 4.016 . 0 0 "[ . 1 .]" 1
637 1 28 PRO HB2 1 28 PRO HD3 2.800 . 5.500 3.993 3.960 4.108 . 0 0 "[ . 1 .]" 1
638 1 28 PRO HB2 1 28 PRO HD3 2.200 . 5.500 3.820 3.621 3.928 . 0 0 "[ . 1 .]" 1
639 1 28 PRO HB2 1 29 TYR H 2.700 . 5.500 3.942 3.760 4.219 . 0 0 "[ . 1 .]" 1
640 1 28 PRO HB3 1 28 PRO HD2 2.600 . 5.500 3.885 3.872 3.935 . 0 0 "[ . 1 .]" 1
641 1 28 PRO HB3 1 28 PRO HD2 2.500 . 5.500 3.460 3.437 3.479 . 0 0 "[ . 1 .]" 1
642 1 28 PRO HB3 1 28 PRO HD3 2.700 . 3.600 3.149 3.049 3.605 0.005 8 0 "[ . 1 .]" 1
643 1 28 PRO HB3 1 28 PRO HD3 2.500 . 3.300 2.829 2.661 2.989 . 0 0 "[ . 1 .]" 1
644 1 28 PRO HB3 1 29 TYR H 3.400 . 4.800 4.445 4.309 4.597 . 0 0 "[ . 1 .]" 1
645 1 28 PRO HD2 1 29 TYR H 3.300 . 4.700 2.585 2.005 3.080 . 0 0 "[ . 1 .]" 1
646 1 28 PRO HD2 1 29 TYR QD 3.100 . 4.300 3.888 3.168 4.264 . 0 0 "[ . 1 .]" 1
647 1 28 PRO HD2 1 30 THR MG 2.900 . 5.500 5.432 5.059 5.516 0.016 6 0 "[ . 1 .]" 1
648 1 28 PRO HD3 1 28 PRO HG3 3.000 . 4.100 2.283 2.270 2.289 . 0 0 "[ . 1 .]" 1
649 1 28 PRO HG2 1 29 TYR HA 2.500 . 5.500 3.688 3.564 3.870 . 0 0 "[ . 1 .]" 1
650 1 29 TYR H 1 29 TYR HA 2.500 . 3.300 2.856 2.814 2.935 . 0 0 "[ . 1 .]" 1
651 1 29 TYR H 1 29 TYR HB2 2.700 . 3.600 3.553 3.501 3.703 0.103 8 0 "[ . 1 .]" 1
652 1 29 TYR H 1 29 TYR HB3 2.800 . 3.800 2.286 2.197 2.574 . 0 0 "[ . 1 .]" 1
653 1 29 TYR H 1 29 TYR QD 2.200 . 2.800 2.097 1.841 2.232 . 0 0 "[ . 1 .]" 1
654 1 29 TYR H 1 29 TYR QE 3.100 . 5.500 4.569 4.281 4.750 . 0 0 "[ . 1 .]" 1
655 1 29 TYR H 1 30 THR H 2.300 . 3.000 2.499 2.094 2.633 . 0 0 "[ . 1 .]" 1
656 1 29 TYR HA 1 29 TYR HB2 2.200 . 2.800 2.291 2.275 2.320 . 0 0 "[ . 1 .]" 1
657 1 29 TYR HA 1 29 TYR HB3 2.100 . 2.700 2.662 2.619 2.694 . 0 0 "[ . 1 .]" 1
658 1 29 TYR HA 1 29 TYR HB3 2.100 . 2.700 2.174 2.127 2.387 . 0 0 "[ . 1 .]" 1
659 1 29 TYR HA 1 29 TYR QD 2.400 . 5.500 3.702 3.686 3.714 . 0 0 "[ . 1 .]" 1
660 1 29 TYR HA 1 30 THR H 2.600 . 3.400 3.364 3.317 3.405 0.005 3 0 "[ . 1 .]" 1
661 1 29 TYR HB2 1 29 TYR QD 2.400 . 3.100 2.292 2.284 2.302 . 0 0 "[ . 1 .]" 1
662 1 29 TYR HB2 1 107 THR MG 2.800 . 5.500 4.378 4.114 4.713 . 0 0 "[ . 1 .]" 1
663 1 29 TYR HB3 1 29 TYR QD 2.300 . 3.000 2.565 2.536 2.596 . 0 0 "[ . 1 .]" 1
664 1 29 TYR QD 1 30 THR HA 2.800 . 5.500 4.067 4.007 4.117 . 0 0 "[ . 1 .]" 1
665 1 29 TYR QD 1 30 THR MG 2.300 . 3.000 2.828 2.673 2.997 . 0 0 "[ . 1 .]" 1
666 1 29 TYR QD 1 101 LEU QD 2.500 . 5.500 2.408 2.187 2.725 . 0 0 "[ . 1 .]" 1
667 1 29 TYR QD 1 105 LEU HB3 2.800 . 3.800 2.904 2.451 3.291 . 0 0 "[ . 1 .]" 1
668 1 29 TYR QD 1 105 LEU QD 2.300 . 3.000 2.414 2.189 2.739 . 0 0 "[ . 1 .]" 1
669 1 29 TYR QD 1 107 THR MG 2.600 . 3.400 2.559 2.368 2.879 . 0 0 "[ . 1 .]" 1
670 1 29 TYR QD 1 109 LEU QD 3.100 . 5.500 4.369 4.191 4.526 . 0 0 "[ . 1 .]" 1
671 1 29 TYR QD 1 109 LEU HG 2.700 . 5.500 5.357 5.173 5.513 0.013 10 0 "[ . 1 .]" 1
672 1 29 TYR QE 1 30 THR MG 2.500 . 3.300 2.592 2.477 2.784 . 0 0 "[ . 1 .]" 1
673 1 29 TYR QE 1 105 LEU QD 2.500 . 3.300 2.284 2.085 2.524 . 0 0 "[ . 1 .]" 1
674 1 29 TYR QE 1 107 THR HB 3.000 . 4.100 3.979 3.721 4.105 0.005 3 0 "[ . 1 .]" 1
675 1 29 TYR QE 1 107 THR MG 2.500 . 3.300 2.094 1.794 2.305 . 0 0 "[ . 1 .]" 1
676 1 29 TYR QE 1 109 LEU QD 2.600 . 3.400 3.021 2.892 3.205 . 0 0 "[ . 1 .]" 1
677 1 29 TYR QE 1 109 LEU HG 2.700 . 3.600 3.509 3.329 3.608 0.008 1 0 "[ . 1 .]" 1
678 1 30 THR H 1 30 THR HA 2.900 . 4.000 2.845 2.818 2.864 . 0 0 "[ . 1 .]" 1
679 1 30 THR H 1 30 THR HB 2.700 . 3.600 3.593 3.576 3.606 0.006 10 0 "[ . 1 .]" 1
680 1 30 THR H 1 30 THR MG 2.300 . 3.000 2.340 2.147 2.547 . 0 0 "[ . 1 .]" 1
681 1 30 THR H 1 105 LEU QD 3.300 . 4.700 4.513 4.411 4.593 . 0 0 "[ . 1 .]" 1
682 1 30 THR HA 1 30 THR MG 1.900 . 2.400 2.345 2.238 2.409 0.009 11 0 "[ . 1 .]" 1
683 1 30 THR HA 1 31 PHE H 2.200 . 2.800 2.651 2.561 2.732 . 0 0 "[ . 1 .]" 1
684 1 30 THR HA 1 31 PHE QD 3.100 . 4.300 3.110 2.626 3.439 . 0 0 "[ . 1 .]" 1
685 1 30 THR HA 1 34 TYR H 3.300 . 5.500 5.167 4.934 5.359 . 0 0 "[ . 1 .]" 1
686 1 30 THR HA 1 34 TYR QE 2.700 . 5.500 4.152 3.692 4.361 . 0 0 "[ . 1 .]" 1
687 1 30 THR HA 1 105 LEU QD 2.300 . 3.000 2.845 2.643 2.998 . 0 0 "[ . 1 .]" 1
688 1 30 THR HB 1 30 THR MG 2.000 . 2.500 2.096 2.071 2.117 . 0 0 "[ . 1 .]" 1
689 1 30 THR HB 1 31 PHE H 2.600 . 3.400 1.977 1.885 2.101 . 0 0 "[ . 1 .]" 1
690 1 30 THR HB 1 34 TYR H 3.200 . 4.500 4.416 4.190 4.513 0.013 5 0 "[ . 1 .]" 1
691 1 30 THR HB 1 34 TYR HB2 2.600 . 3.400 2.184 2.023 2.409 . 0 0 "[ . 1 .]" 1
692 1 30 THR HB 1 34 TYR HB3 2.700 . 3.600 2.743 2.422 3.118 . 0 0 "[ . 1 .]" 1
693 1 30 THR HB 1 34 TYR QD 2.600 . 3.400 3.127 2.624 3.372 . 0 0 "[ . 1 .]" 1
694 1 30 THR MG 1 31 PHE H 2.800 . 3.800 3.549 3.428 3.626 . 0 0 "[ . 1 .]" 1
695 1 30 THR MG 1 34 TYR HB3 2.700 . 3.600 3.291 2.680 3.558 . 0 0 "[ . 1 .]" 1
696 1 30 THR MG 1 34 TYR QD 2.500 . 3.300 2.735 2.469 2.876 . 0 0 "[ . 1 .]" 1
697 1 30 THR MG 1 34 TYR QE 2.500 . 3.300 3.167 3.048 3.311 0.011 7 0 "[ . 1 .]" 1
698 1 30 THR MG 1 45 VAL QG 2.500 . 5.500 3.730 3.543 4.275 . 0 0 "[ . 1 .]" 1
699 1 31 PHE H 1 31 PHE HA 2.500 . 3.300 2.893 2.864 2.914 . 0 0 "[ . 1 .]" 1
700 1 31 PHE H 1 31 PHE HB2 2.900 . 4.000 2.368 2.257 2.536 . 0 0 "[ . 1 .]" 1
701 1 31 PHE H 1 31 PHE HB3 2.700 . 3.600 3.588 3.530 3.645 0.045 3 0 "[ . 1 .]" 1
702 1 31 PHE H 1 31 PHE QD 3.100 . 4.300 2.632 2.086 3.063 . 0 0 "[ . 1 .]" 1
703 1 31 PHE H 1 34 TYR HA 5.500 . 5.500 4.433 4.258 4.931 . 0 0 "[ . 1 .]" 1
704 1 31 PHE H 1 34 TYR HB3 3.500 . 5.000 3.740 3.306 4.237 . 0 0 "[ . 1 .]" 1
705 1 31 PHE H 1 34 TYR QD 3.400 . 4.800 3.333 2.528 4.037 . 0 0 "[ . 1 .]" 1
706 1 31 PHE H 1 105 LEU QD 3.300 . 4.700 4.129 3.899 4.434 . 0 0 "[ . 1 .]" 1
707 1 31 PHE HA 1 31 PHE HB2 2.300 . 3.000 3.017 2.990 3.027 0.027 3 0 "[ . 1 .]" 1
708 1 31 PHE HA 1 31 PHE HB3 2.400 . 3.100 2.540 2.439 2.641 . 0 0 "[ . 1 .]" 1
709 1 31 PHE HA 1 31 PHE QD 2.500 . 3.300 2.775 2.356 3.087 . 0 0 "[ . 1 .]" 1
710 1 31 PHE HB2 1 31 PHE QD 2.700 . 3.600 2.350 2.266 2.496 . 0 0 "[ . 1 .]" 1
711 1 31 PHE HB2 1 32 GLU H 2.600 . 3.400 3.142 2.063 3.499 0.099 15 0 "[ . 1 .]" 1
712 1 31 PHE HB2 1 33 ASP H 2.700 . 3.600 3.036 2.776 3.236 . 0 0 "[ . 1 .]" 1
713 1 31 PHE HB3 1 31 PHE QD 2.700 . 3.600 2.444 2.301 2.608 . 0 0 "[ . 1 .]" 1
714 1 31 PHE HB3 1 32 GLU H 3.100 . 4.300 1.930 1.793 2.134 0.107 1 0 "[ . 1 .]" 1
715 1 31 PHE HB3 1 33 ASP H 2.800 . 3.800 2.770 2.493 3.479 . 0 0 "[ . 1 .]" 1
716 1 31 PHE QD 1 49 GLY HA2 2.900 . 4.000 3.806 3.447 4.106 0.106 2 0 "[ . 1 .]" 1
717 1 31 PHE QD 1 49 GLY HA3 3.000 . 4.100 2.403 1.903 2.894 . 0 0 "[ . 1 .]" 1
718 1 31 PHE QE 1 51 LEU QD 2.400 . 3.100 1.819 1.515 2.185 0.185 8 0 "[ . 1 .]" 1
719 1 31 PHE QE 1 51 LEU HG 3.000 . 4.100 3.403 1.896 4.108 0.008 8 0 "[ . 1 .]" 1
720 1 31 PHE QE 1 101 LEU QD 2.400 . 5.500 3.298 2.540 3.833 . 0 0 "[ . 1 .]" 1
721 1 32 GLU H 1 32 GLU HA 2.400 . 3.100 2.870 2.846 2.924 . 0 0 "[ . 1 .]" 1
722 1 32 GLU H 1 32 GLU QB 2.300 . 3.000 2.231 2.078 2.754 . 0 0 "[ . 1 .]" 1
723 1 32 GLU H 1 32 GLU QG 2.800 . 3.800 3.246 2.596 3.809 0.009 13 0 "[ . 1 .]" 1
724 1 32 GLU HA 1 32 GLU QG 2.000 . 2.500 2.271 2.020 2.441 . 0 0 "[ . 1 .]" 1
725 1 32 GLU HA 1 33 ASP H 2.800 . 3.800 3.461 3.360 3.529 . 0 0 "[ . 1 .]" 1
726 1 32 GLU HA 1 34 TYR H 3.100 . 5.500 4.476 4.278 4.742 . 0 0 "[ . 1 .]" 1
727 1 32 GLU QB 1 32 GLU HG3 1.500 . 2.200 2.093 2.073 2.120 . 0 0 "[ . 1 .]" 1
728 1 32 GLU QB 1 33 ASP H 2.600 . 3.400 2.929 2.615 3.243 . 0 0 "[ . 1 .]" 1
729 1 32 GLU QG 1 33 ASP H 2.800 . 5.500 4.488 4.210 4.772 . 0 0 "[ . 1 .]" 1
730 1 33 ASP H 1 33 ASP HA 2.500 . 3.300 2.938 2.911 2.948 . 0 0 "[ . 1 .]" 1
731 1 33 ASP H 1 33 ASP HB2 2.700 . 3.600 2.673 2.439 2.885 . 0 0 "[ . 1 .]" 1
732 1 33 ASP H 1 33 ASP HB3 2.800 . 3.800 3.294 2.936 3.606 . 0 0 "[ . 1 .]" 1
733 1 33 ASP H 1 34 TYR H 2.400 . 3.100 3.074 2.938 3.116 0.016 5 0 "[ . 1 .]" 1
734 1 33 ASP HA 1 33 ASP HB2 2.200 . 2.800 2.808 2.617 2.987 0.187 6 0 "[ . 1 .]" 1
735 1 34 TYR H 1 34 TYR HA 2.500 . 3.300 2.900 2.877 2.917 . 0 0 "[ . 1 .]" 1
736 1 34 TYR H 1 34 TYR HB2 2.300 . 3.000 2.670 2.478 2.793 . 0 0 "[ . 1 .]" 1
737 1 34 TYR H 1 34 TYR HB3 2.300 . 3.000 2.529 2.406 2.770 . 0 0 "[ . 1 .]" 1
738 1 34 TYR H 1 34 TYR QD 2.700 . 5.500 4.223 4.185 4.259 . 0 0 "[ . 1 .]" 1
739 1 34 TYR H 1 48 GLY HA3 3.300 . 5.500 5.290 5.107 5.493 . 0 0 "[ . 1 .]" 1
740 1 34 TYR HA 1 34 TYR HB2 2.300 . 3.000 2.486 2.423 2.614 . 0 0 "[ . 1 .]" 1
741 1 34 TYR HA 1 34 TYR HB3 2.400 . 3.100 3.025 3.002 3.028 . 0 0 "[ . 1 .]" 1
742 1 34 TYR HA 1 34 TYR QD 2.400 . 3.100 2.722 2.457 2.969 . 0 0 "[ . 1 .]" 1
743 1 34 TYR HA 1 34 TYR QE 2.900 . 5.500 4.588 4.478 4.684 . 0 0 "[ . 1 .]" 1
744 1 34 TYR HA 1 35 ASP H 2.200 . 2.800 2.156 2.133 2.213 . 0 0 "[ . 1 .]" 1
745 1 34 TYR HA 1 47 LEU HA 2.500 . 3.300 2.988 2.786 3.177 . 0 0 "[ . 1 .]" 1
746 1 34 TYR HA 1 48 GLY H 2.900 . 4.000 3.171 2.895 3.371 . 0 0 "[ . 1 .]" 1
747 1 34 TYR HB2 1 34 TYR QD 2.400 . 3.100 2.489 2.387 2.592 . 0 0 "[ . 1 .]" 1
748 1 34 TYR HB2 1 35 ASP H 3.800 . 5.500 4.283 4.110 4.438 . 0 0 "[ . 1 .]" 1
749 1 34 TYR HB3 1 34 TYR QD 2.600 . 3.400 2.329 2.283 2.407 . 0 0 "[ . 1 .]" 1
750 1 34 TYR HB3 1 35 ASP H 3.300 . 4.700 4.182 3.959 4.345 . 0 0 "[ . 1 .]" 1
751 1 34 TYR QD 1 35 ASP H 3.200 . 4.500 3.575 3.106 3.834 . 0 0 "[ . 1 .]" 1
752 1 34 TYR QD 1 35 ASP HA 2.800 . 5.500 3.974 3.484 4.242 . 0 0 "[ . 1 .]" 1
753 1 34 TYR QD 1 36 VAL MG2 2.700 . 5.500 3.544 3.033 3.726 . 0 0 "[ . 1 .]" 1
754 1 34 TYR QD 1 45 VAL QG 2.900 . 4.000 3.788 3.533 3.962 . 0 0 "[ . 1 .]" 1
755 1 34 TYR QD 1 47 LEU HA 2.400 . 3.100 2.883 2.748 3.083 . 0 0 "[ . 1 .]" 1
756 1 34 TYR QD 1 47 LEU MD1 3.100 . 5.500 4.050 2.536 4.344 . 0 0 "[ . 1 .]" 1
757 1 34 TYR QD 1 47 LEU MD2 2.300 . 3.000 2.648 2.153 3.183 0.183 8 0 "[ . 1 .]" 1
758 1 34 TYR QE 1 36 VAL MG1 2.800 . 5.500 4.645 4.462 4.812 . 0 0 "[ . 1 .]" 1
759 1 34 TYR QE 1 36 VAL MG1 3.000 . 5.500 3.590 3.262 3.938 . 0 0 "[ . 1 .]" 1
760 1 34 TYR QE 1 36 VAL MG2 2.100 . 2.700 2.605 2.451 2.704 0.004 7 0 "[ . 1 .]" 1
761 1 34 TYR QE 1 45 VAL QG 2.900 . 3.000 2.682 2.276 2.931 . 0 0 "[ . 1 .]" 1
762 1 34 TYR QE 1 47 LEU HA 2.700 . 5.500 4.369 3.897 4.594 . 0 0 "[ . 1 .]" 1
763 1 34 TYR QE 1 47 LEU MD2 2.200 . 2.800 2.394 1.986 3.008 0.208 8 0 "[ . 1 .]" 1
764 1 34 TYR QE 1 101 LEU QD 2.700 . 5.500 3.800 3.360 4.347 . 0 0 "[ . 1 .]" 1
765 1 35 ASP H 1 35 ASP HA 2.700 . 3.600 2.923 2.893 2.941 . 0 0 "[ . 1 .]" 1
766 1 35 ASP H 1 35 ASP HB2 2.800 . 3.800 2.804 2.564 3.115 . 0 0 "[ . 1 .]" 1
767 1 35 ASP H 1 35 ASP HB3 2.900 . 4.000 3.330 2.906 3.699 . 0 0 "[ . 1 .]" 1
768 1 35 ASP H 1 36 VAL H 3.200 . 4.500 4.408 4.361 4.442 . 0 0 "[ . 1 .]" 1
769 1 35 ASP H 1 46 LYS H 2.700 . 3.600 3.464 3.213 3.620 0.020 15 0 "[ . 1 .]" 1
770 1 35 ASP H 1 46 LYS QB 2.900 . 4.000 2.729 2.511 2.957 . 0 0 "[ . 1 .]" 1
771 1 35 ASP H 1 46 LYS QD 3.100 . 4.300 3.902 3.461 4.303 0.003 14 0 "[ . 1 .]" 1
772 1 35 ASP HA 1 35 ASP HB2 2.200 . 2.800 2.791 2.545 2.971 0.171 4 0 "[ . 1 .]" 1
773 1 35 ASP HA 1 35 ASP HB3 2.300 . 3.000 2.878 2.691 3.017 0.017 12 0 "[ . 1 .]" 1
774 1 35 ASP HB2 1 36 VAL H 3.000 . 4.100 4.109 3.998 4.187 0.087 8 0 "[ . 1 .]" 1
775 1 35 ASP HB2 1 46 LYS QB 2.900 . 4.000 2.568 1.868 3.345 . 0 0 "[ . 1 .]" 1
776 1 35 ASP HB2 1 46 LYS QD 2.700 . 3.600 2.669 2.160 3.377 . 0 0 "[ . 1 .]" 1
777 1 35 ASP HB3 1 36 VAL H 3.100 . 4.300 3.126 2.700 3.635 . 0 0 "[ . 1 .]" 1
778 1 35 ASP HB3 1 46 LYS QB 2.800 . 3.800 2.563 1.903 3.097 . 0 0 "[ . 1 .]" 1
779 1 35 ASP HB3 1 46 LYS QD 2.600 . 3.400 3.310 2.919 3.609 0.209 8 0 "[ . 1 .]" 1
780 1 36 VAL H 1 36 VAL HA 2.500 . 3.300 2.944 2.938 2.946 . 0 0 "[ . 1 .]" 1
781 1 36 VAL H 1 36 VAL HB 2.300 . 3.000 2.820 2.766 2.903 . 0 0 "[ . 1 .]" 1
782 1 36 VAL H 1 36 VAL MG1 2.800 . 5.500 3.929 3.907 3.948 . 0 0 "[ . 1 .]" 1
783 1 36 VAL H 1 36 VAL MG2 2.800 . 3.800 2.757 2.638 2.891 . 0 0 "[ . 1 .]" 1
784 1 36 VAL HA 1 36 VAL HB 2.500 . 3.300 3.017 3.005 3.022 . 0 0 "[ . 1 .]" 1
785 1 36 VAL HA 1 36 VAL MG1 2.000 . 2.500 2.270 2.133 2.410 . 0 0 "[ . 1 .]" 1
786 1 36 VAL HA 1 36 VAL MG2 2.000 . 2.500 2.448 2.370 2.501 0.001 9 0 "[ . 1 .]" 1
787 1 36 VAL HA 1 37 SER H 1.900 . 2.400 2.212 2.149 2.302 . 0 0 "[ . 1 .]" 1
788 1 36 VAL HA 1 45 VAL HA 2.400 . 3.100 2.434 2.301 2.623 . 0 0 "[ . 1 .]" 1
789 1 36 VAL HA 1 45 VAL QG 2.500 . 3.300 2.819 2.604 2.915 . 0 0 "[ . 1 .]" 1
790 1 36 VAL HA 1 46 LYS H 3.100 . 4.300 3.277 3.082 3.450 . 0 0 "[ . 1 .]" 1
791 1 36 VAL HB 1 36 VAL MG1 2.100 . 2.700 2.107 2.085 2.128 . 0 0 "[ . 1 .]" 1
792 1 36 VAL HB 1 36 VAL MG2 2.000 . 2.500 2.103 2.084 2.129 . 0 0 "[ . 1 .]" 1
793 1 36 VAL HB 1 37 SER H 3.300 . 4.700 3.908 3.564 4.224 . 0 0 "[ . 1 .]" 1
794 1 36 VAL MG1 1 37 SER H 2.400 . 3.100 2.233 1.882 2.659 . 0 0 "[ . 1 .]" 1
795 1 36 VAL MG1 1 37 SER QB 2.800 . 5.500 3.827 3.594 3.977 . 0 0 "[ . 1 .]" 1
796 1 36 VAL MG1 1 38 PHE QD 2.800 . 5.500 3.935 3.630 4.176 . 0 0 "[ . 1 .]" 1
797 1 36 VAL MG1 1 45 VAL QG 2.100 . 2.700 2.351 2.046 2.602 . 0 0 "[ . 1 .]" 1
798 1 36 VAL MG2 1 37 SER H 3.000 . 4.100 4.050 3.987 4.111 0.011 2 0 "[ . 1 .]" 1
799 1 36 VAL MG2 1 45 VAL QG 2.200 . 2.800 2.442 2.156 2.631 . 0 0 "[ . 1 .]" 1
800 1 37 SER H 1 37 SER HA 2.700 . 3.600 2.931 2.915 2.947 . 0 0 "[ . 1 .]" 1
801 1 37 SER H 1 37 SER QB 2.500 . 3.300 2.711 2.394 2.992 . 0 0 "[ . 1 .]" 1
802 1 37 SER H 1 38 PHE H 3.400 . 4.800 4.270 4.085 4.453 . 0 0 "[ . 1 .]" 1
803 1 37 SER H 1 44 THR H 3.000 . 4.100 3.725 2.976 4.090 . 0 0 "[ . 1 .]" 1
804 1 37 SER H 1 44 THR HB 3.000 . 4.100 4.057 3.883 4.119 0.019 5 0 "[ . 1 .]" 1
805 1 37 SER H 1 45 VAL H 3.300 . 4.700 3.967 3.898 4.031 . 0 0 "[ . 1 .]" 1
806 1 37 SER H 1 45 VAL HA 3.000 . 4.100 3.212 2.816 3.559 . 0 0 "[ . 1 .]" 1
807 1 37 SER HA 1 38 PHE H 2.400 . 3.100 2.171 2.134 2.222 . 0 0 "[ . 1 .]" 1
808 1 37 SER QB 1 38 PHE H 2.700 . 3.600 3.358 2.874 3.613 0.013 12 0 "[ . 1 .]" 1
809 1 37 SER QB 1 44 THR H 3.000 . 4.100 3.003 2.412 3.466 . 0 0 "[ . 1 .]" 1
810 1 37 SER QB 1 44 THR HB 2.000 . 2.500 2.259 2.009 2.482 . 0 0 "[ . 1 .]" 1
811 1 37 SER QB 1 44 THR MG 2.400 . 5.500 3.648 3.356 3.953 . 0 0 "[ . 1 .]" 1
812 1 38 PHE H 1 38 PHE HA 2.900 . 4.000 2.915 2.872 2.947 . 0 0 "[ . 1 .]" 1
813 1 38 PHE H 1 38 PHE HB2 2.800 . 3.800 3.422 3.190 3.650 . 0 0 "[ . 1 .]" 1
814 1 38 PHE H 1 38 PHE HB3 2.600 . 3.400 2.759 2.590 2.892 . 0 0 "[ . 1 .]" 1
815 1 38 PHE H 1 38 PHE QD 3.300 . 4.700 4.295 4.150 4.383 . 0 0 "[ . 1 .]" 1
816 1 38 PHE H 1 44 THR H 3.700 . 5.400 5.014 4.744 5.233 . 0 0 "[ . 1 .]" 1
817 1 38 PHE HA 1 38 PHE HB2 2.500 . 3.300 2.384 2.333 2.434 . 0 0 "[ . 1 .]" 1
818 1 38 PHE HA 1 38 PHE HB3 2.500 . 3.300 3.016 3.000 3.027 . 0 0 "[ . 1 .]" 1
819 1 38 PHE HA 1 38 PHE QD 2.400 . 3.100 2.584 2.392 2.837 . 0 0 "[ . 1 .]" 1
820 1 38 PHE HA 1 39 GLY H 2.200 . 2.800 2.169 2.137 2.246 . 0 0 "[ . 1 .]" 1
821 1 38 PHE HA 1 42 VAL QG 2.900 . 4.000 3.437 2.988 3.866 . 0 0 "[ . 1 .]" 1
822 1 38 PHE HA 1 43 LEU HA 2.400 . 3.100 2.537 2.326 2.832 . 0 0 "[ . 1 .]" 1
823 1 38 PHE HA 1 43 LEU QD 2.500 . 3.300 3.202 3.073 3.265 . 0 0 "[ . 1 .]" 1
824 1 38 PHE HA 1 44 THR H 3.200 . 4.500 3.644 3.286 3.910 . 0 0 "[ . 1 .]" 1
825 1 38 PHE HB2 1 38 PHE QD 2.400 . 3.100 2.569 2.490 2.646 . 0 0 "[ . 1 .]" 1
826 1 38 PHE HB2 1 39 GLY H 3.100 . 4.300 4.119 3.968 4.264 . 0 0 "[ . 1 .]" 1
827 1 38 PHE HB2 1 43 LEU HG 2.200 . 2.800 2.604 1.974 2.821 0.021 10 0 "[ . 1 .]" 1
828 1 38 PHE HB3 1 38 PHE QD 2.400 . 3.100 2.277 2.263 2.306 . 0 0 "[ . 1 .]" 1
829 1 38 PHE HB3 1 39 GLY H 3.400 . 4.800 4.276 3.966 4.470 . 0 0 "[ . 1 .]" 1
830 1 38 PHE QD 1 39 GLY H 2.500 . 3.300 3.076 2.775 3.318 0.018 14 0 "[ . 1 .]" 1
831 1 38 PHE QD 1 42 VAL H 3.000 . 4.100 3.749 3.045 4.117 0.017 5 0 "[ . 1 .]" 1
832 1 38 PHE QD 1 43 LEU H 3.400 . 5.500 4.733 4.190 5.077 . 0 0 "[ . 1 .]" 1
833 1 38 PHE QD 1 43 LEU HA 2.800 . 3.800 3.115 2.630 3.549 . 0 0 "[ . 1 .]" 1
834 1 38 PHE QD 1 43 LEU HB2 2.600 . 3.400 3.249 2.807 3.410 0.010 3 0 "[ . 1 .]" 1
835 1 38 PHE QD 1 43 LEU HB2 2.900 . 5.500 2.375 1.684 3.251 . 0 0 "[ . 1 .]" 1
836 1 38 PHE QD 1 43 LEU HB3 2.900 . 5.500 4.569 4.075 4.942 . 0 0 "[ . 1 .]" 1
837 1 38 PHE QD 1 43 LEU QD 2.800 . 5.500 2.640 1.886 3.263 . 0 0 "[ . 1 .]" 1
838 1 39 GLY H 1 39 GLY HA2 2.700 . 3.600 2.920 2.602 2.957 . 0 0 "[ . 1 .]" 1
839 1 39 GLY H 1 39 GLY HA3 2.700 . 3.600 2.551 2.399 2.937 . 0 0 "[ . 1 .]" 1
840 1 39 GLY H 1 42 VAL H 2.800 . 3.800 3.183 2.721 3.646 . 0 0 "[ . 1 .]" 1
841 1 39 GLY H 1 43 LEU HA 3.200 . 4.500 3.956 3.590 4.300 . 0 0 "[ . 1 .]" 1
842 1 40 SER HA 1 40 SER QB 1.800 . 2.200 2.200 2.161 2.252 0.052 15 0 "[ . 1 .]" 1
843 1 40 SER HA 1 41 GLY H 3.100 . 4.300 2.670 2.154 3.550 . 0 0 "[ . 1 .]" 1
844 1 41 GLY H 1 41 GLY HA2 2.800 . 3.800 2.543 2.293 2.926 . 0 0 "[ . 1 .]" 1
845 1 41 GLY H 1 41 GLY HA3 2.600 . 3.400 2.838 2.631 2.956 . 0 0 "[ . 1 .]" 1
846 1 41 GLY H 1 42 VAL H 2.700 . 3.600 2.321 1.785 2.838 0.015 14 0 "[ . 1 .]" 1
847 1 41 GLY HA2 1 58 LYS HG2 2.700 . 3.600 2.500 1.907 3.385 . 0 0 "[ . 1 .]" 1
848 1 41 GLY HA2 1 42 VAL H 2.800 . 3.800 3.019 2.631 3.429 . 0 0 "[ . 1 .]" 1
849 1 41 GLY HA3 1 42 VAL H 2.800 . 3.800 3.422 3.072 3.567 . 0 0 "[ . 1 .]" 1
850 1 42 VAL H 1 42 VAL HA 2.700 . 3.600 2.894 2.871 2.929 . 0 0 "[ . 1 .]" 1
851 1 42 VAL H 1 42 VAL HB 2.200 . 5.500 3.413 3.274 3.764 . 0 0 "[ . 1 .]" 1
852 1 42 VAL H 1 42 VAL QG 2.300 . 3.000 2.421 2.092 2.672 . 0 0 "[ . 1 .]" 1
853 1 42 VAL HA 1 42 VAL HB 2.500 . 3.300 2.500 2.446 2.681 . 0 0 "[ . 1 .]" 1
854 1 42 VAL HA 1 42 VAL QG 2.100 . 2.700 2.207 2.069 2.303 . 0 0 "[ . 1 .]" 1
855 1 42 VAL HA 1 43 LEU H 2.300 . 3.000 2.277 2.207 2.413 . 0 0 "[ . 1 .]" 1
856 1 42 VAL HA 1 57 ASN HA 2.200 . 2.800 2.063 1.795 2.330 . 0 0 "[ . 1 .]" 1
857 1 42 VAL HA 1 57 ASN HB2 2.700 . 3.600 2.986 2.251 3.638 0.038 1 0 "[ . 1 .]" 1
858 1 42 VAL HA 1 57 ASN HB3 2.600 . 3.400 2.906 2.083 3.415 0.015 10 0 "[ . 1 .]" 1
859 1 42 VAL HA 1 58 LYS H 3.100 . 4.300 3.314 3.040 3.620 . 0 0 "[ . 1 .]" 1
860 1 42 VAL HB 1 42 VAL QG 1.900 . 2.400 1.876 1.859 1.894 . 0 0 "[ . 1 .]" 1
861 1 42 VAL HB 1 43 LEU H 2.600 . 3.400 2.946 2.329 3.193 . 0 0 "[ . 1 .]" 1
862 1 42 VAL QG 1 43 LEU H 2.800 . 3.600 2.124 1.782 3.108 0.018 8 0 "[ . 1 .]" 1
863 1 42 VAL QG 1 43 LEU HA 2.700 . 5.500 3.378 3.110 4.101 . 0 0 "[ . 1 .]" 1
864 1 42 VAL QG 1 57 ASN HA 2.500 . 5.500 3.056 2.663 3.233 . 0 0 "[ . 1 .]" 1
865 1 42 VAL QG 1 57 ASN HB2 2.300 . 5.500 2.728 1.846 3.332 . 0 0 "[ . 1 .]" 1
866 1 42 VAL QG 1 57 ASN HB3 2.400 . 5.500 2.018 1.763 2.479 . 0 0 "[ . 1 .]" 1
867 1 42 VAL QG 1 56 ILE MG 2.500 . 5.500 5.127 4.802 5.298 . 0 0 "[ . 1 .]" 1
868 1 42 VAL QG 1 57 ASN HA 2.500 . 3.300 3.097 2.687 3.269 . 0 0 "[ . 1 .]" 1
869 1 42 VAL QG 1 57 ASN HB2 2.300 . 3.000 2.755 1.848 3.408 0.408 14 0 "[ . 1 .]" 1
870 1 42 VAL QG 1 57 ASN HB3 2.700 . 3.600 2.052 1.765 2.621 0.035 1 0 "[ . 1 .]" 1
871 1 42 VAL QG 1 58 LYS H 3.200 . 5.500 4.142 3.239 4.409 . 0 0 "[ . 1 .]" 1
872 1 43 LEU H 1 43 LEU HA 3.000 . 4.100 2.921 2.872 2.948 . 0 0 "[ . 1 .]" 1
873 1 43 LEU H 1 43 LEU HB2 2.800 . 3.800 2.851 2.595 3.179 . 0 0 "[ . 1 .]" 1
874 1 43 LEU H 1 43 LEU QD 2.800 . 5.500 3.979 3.897 4.087 . 0 0 "[ . 1 .]" 1
875 1 43 LEU H 1 56 ILE H 2.800 . 3.800 3.438 2.859 3.819 0.019 12 0 "[ . 1 .]" 1
876 1 43 LEU H 1 56 ILE HB 3.500 . 5.000 4.055 3.723 4.388 . 0 0 "[ . 1 .]" 1
877 1 43 LEU H 1 58 LYS H 3.300 . 4.700 4.201 4.120 4.296 . 0 0 "[ . 1 .]" 1
878 1 43 LEU H 1 57 ASN HA 3.000 . 4.100 2.989 2.669 3.580 . 0 0 "[ . 1 .]" 1
879 1 43 LEU HA 1 43 LEU HB2 2.500 . 3.300 2.710 2.618 2.774 . 0 0 "[ . 1 .]" 1
880 1 43 LEU HA 1 43 LEU HB3 2.700 . 3.600 2.951 2.914 2.993 . 0 0 "[ . 1 .]" 1
881 1 43 LEU HA 1 43 LEU QD 2.100 . 2.700 2.462 2.227 2.664 . 0 0 "[ . 1 .]" 1
882 1 43 LEU HA 1 44 THR H 2.200 . 2.800 2.253 2.146 2.400 . 0 0 "[ . 1 .]" 1
883 1 43 LEU HB2 1 43 LEU QD 2.300 . 3.000 2.190 1.995 2.386 . 0 0 "[ . 1 .]" 1
884 1 43 LEU HB2 1 44 THR H 3.000 . 5.500 4.620 4.296 4.667 . 0 0 "[ . 1 .]" 1
885 1 43 LEU HB2 1 56 ILE HB 2.800 . 3.800 3.266 3.074 3.423 . 0 0 "[ . 1 .]" 1
886 1 43 LEU HB3 1 43 LEU QD 2.400 . 3.100 2.044 1.905 2.122 . 0 0 "[ . 1 .]" 1
887 1 43 LEU HB3 1 56 ILE H 3.300 . 4.700 3.226 2.885 3.649 . 0 0 "[ . 1 .]" 1
888 1 43 LEU HB3 1 56 ILE HB 2.800 . 3.800 2.314 2.083 2.491 . 0 0 "[ . 1 .]" 1
889 1 43 LEU HB3 1 56 ILE MD 2.800 . 3.800 3.030 2.586 3.324 . 0 0 "[ . 1 .]" 1
890 1 43 LEU HB3 1 56 ILE MG 2.800 . 3.800 3.744 3.535 3.833 0.033 9 0 "[ . 1 .]" 1
891 1 43 LEU QD 1 44 THR H 2.400 . 5.500 3.338 1.996 4.335 . 0 0 "[ . 1 .]" 1
892 1 43 LEU QD 1 45 VAL QG 2.000 . 2.500 2.153 2.008 2.342 . 0 0 "[ . 1 .]" 1
893 1 43 LEU QD 1 56 ILE HA 2.800 . 3.800 3.788 3.755 3.812 0.012 13 0 "[ . 1 .]" 1
894 1 44 THR H 1 44 THR HA 3.000 . 4.100 2.915 2.885 2.947 . 0 0 "[ . 1 .]" 1
895 1 44 THR H 1 44 THR HB 2.400 . 3.100 2.678 2.557 2.972 . 0 0 "[ . 1 .]" 1
896 1 44 THR H 1 44 THR MG 3.300 . 4.700 3.818 3.755 3.998 . 0 0 "[ . 1 .]" 1
897 1 44 THR HA 1 44 THR HB 2.400 . 3.100 3.015 2.987 3.026 . 0 0 "[ . 1 .]" 1
898 1 44 THR HA 1 44 THR MG 2.000 . 2.500 2.293 2.114 2.471 . 0 0 "[ . 1 .]" 1
899 1 44 THR HA 1 45 VAL H 2.100 . 2.700 2.160 2.129 2.226 . 0 0 "[ . 1 .]" 1
900 1 44 THR HA 1 45 VAL QG 2.900 . 4.000 3.580 3.346 3.725 . 0 0 "[ . 1 .]" 1
901 1 44 THR HA 1 55 VAL HA 2.100 . 2.700 2.364 2.167 2.587 . 0 0 "[ . 1 .]" 1
902 1 44 THR HA 1 55 VAL QG 2.200 . 2.800 2.644 2.143 2.823 0.023 5 0 "[ . 1 .]" 1
903 1 44 THR HA 1 56 ILE H 3.000 . 4.100 3.324 3.127 3.597 . 0 0 "[ . 1 .]" 1
904 1 44 THR HB 1 44 THR MG 2.000 . 2.500 2.095 2.071 2.117 . 0 0 "[ . 1 .]" 1
905 1 44 THR HB 1 55 VAL MG1 2.600 . 5.500 5.063 4.291 6.024 0.524 8 1 "[ . + 1 .]" 1
906 1 44 THR MG 1 45 VAL H 2.600 . 3.400 2.851 2.385 3.300 . 0 0 "[ . 1 .]" 1
907 1 44 THR MG 1 46 LYS H 3.400 . 4.800 3.797 3.197 3.948 . 0 0 "[ . 1 .]" 1
908 1 44 THR MG 1 46 LYS HA 2.800 . 3.800 3.742 2.931 3.816 0.016 15 0 "[ . 1 .]" 1
909 1 44 THR MG 1 53 THR MG 1.800 . 2.200 1.985 1.803 2.117 . 0 0 "[ . 1 .]" 1
910 1 44 THR MG 1 54 TYR H 3.100 . 4.300 4.248 4.186 4.287 . 0 0 "[ . 1 .]" 1
911 1 44 THR MG 1 53 THR MG 1.700 . 5.500 2.449 2.173 2.952 . 0 0 "[ . 1 .]" 1
912 1 44 THR MG 1 55 VAL HA 2.600 . 3.400 3.341 3.102 3.410 0.010 3 0 "[ . 1 .]" 1
913 1 45 VAL H 1 45 VAL HA 2.900 . 4.000 2.940 2.923 2.949 . 0 0 "[ . 1 .]" 1
914 1 45 VAL H 1 45 VAL HB 2.600 . 3.400 2.692 2.608 2.800 . 0 0 "[ . 1 .]" 1
915 1 45 VAL H 1 45 VAL QG 3.300 . 4.000 2.547 2.294 2.910 . 0 0 "[ . 1 .]" 1
916 1 45 VAL H 1 46 LYS H 3.600 . 5.200 4.211 4.044 4.330 . 0 0 "[ . 1 .]" 1
917 1 45 VAL H 1 53 THR MG 2.500 . 3.300 3.059 2.698 3.318 0.018 13 0 "[ . 1 .]" 1
918 1 45 VAL H 1 54 TYR QB 3.400 . 4.800 3.749 3.596 3.956 . 0 0 "[ . 1 .]" 1
919 1 45 VAL H 1 55 VAL HA 2.800 . 3.800 3.164 2.950 3.323 . 0 0 "[ . 1 .]" 1
920 1 45 VAL HA 1 45 VAL HB 2.700 . 3.600 3.019 3.012 3.022 . 0 0 "[ . 1 .]" 1
921 1 45 VAL HA 1 45 VAL QG 2.300 . 2.800 2.093 2.038 2.136 . 0 0 "[ . 1 .]" 1
922 1 45 VAL HA 1 46 LYS H 2.100 . 2.700 2.154 2.140 2.169 . 0 0 "[ . 1 .]" 1
923 1 45 VAL HB 1 45 VAL QG 2.200 . 2.700 1.882 1.865 1.897 . 0 0 "[ . 1 .]" 1
924 1 45 VAL HB 1 47 LEU MD1 2.500 . 5.500 2.789 2.350 3.341 . 0 0 "[ . 1 .]" 1
925 1 45 VAL HB 1 54 TYR H 2.900 . 4.000 2.957 2.660 3.308 . 0 0 "[ . 1 .]" 1
926 1 45 VAL HB 1 54 TYR QB 2.800 . 3.400 2.231 2.000 2.441 . 0 0 "[ . 1 .]" 1
927 1 45 VAL HB 1 54 TYR QD 2.900 . 4.000 3.841 3.541 4.000 0.000 2 0 "[ . 1 .]" 1
928 1 45 VAL HB 1 54 TYR QD 2.900 . 4.000 3.462 3.293 3.642 . 0 0 "[ . 1 .]" 1
929 1 45 VAL MG1 1 45 VAL MG2 1.800 . 2.200 2.050 1.916 2.094 . 0 0 "[ . 1 .]" 1
930 1 45 VAL QG 1 46 LYS H 2.700 . 3.600 2.895 2.643 3.073 . 0 0 "[ . 1 .]" 1
931 1 45 VAL QG 1 47 LEU HA 2.800 . 5.500 4.263 4.028 4.495 . 0 0 "[ . 1 .]" 1
932 1 45 VAL QG 1 47 LEU MD2 2.600 . 2.700 1.989 1.507 2.419 . 0 0 "[ . 1 .]" 1
933 1 45 VAL QG 1 47 LEU HG 2.700 . 3.600 3.327 2.968 3.653 0.053 8 0 "[ . 1 .]" 1
934 1 45 VAL QG 1 54 TYR QB 3.000 . 3.800 2.829 2.645 3.078 . 0 0 "[ . 1 .]" 1
935 1 46 LYS H 1 46 LYS HA 2.800 . 3.800 2.888 2.874 2.917 . 0 0 "[ . 1 .]" 1
936 1 46 LYS H 1 46 LYS QB 2.600 . 3.400 2.269 2.191 2.327 . 0 0 "[ . 1 .]" 1
937 1 46 LYS H 1 46 LYS QD 2.700 . 5.500 4.401 4.300 4.470 . 0 0 "[ . 1 .]" 1
938 1 46 LYS H 1 46 LYS HG2 3.400 . 4.800 4.425 4.329 4.565 . 0 0 "[ . 1 .]" 1
939 1 46 LYS H 1 46 LYS HG3 3.300 . 4.700 4.511 4.123 4.644 . 0 0 "[ . 1 .]" 1
940 1 46 LYS H 1 53 THR MG 3.300 . 4.700 3.864 3.594 4.282 . 0 0 "[ . 1 .]" 1
941 1 46 LYS HA 1 46 LYS QB 2.500 . 3.300 2.385 2.315 2.520 . 0 0 "[ . 1 .]" 1
942 1 46 LYS HA 1 46 LYS QD 2.300 . 5.500 4.082 4.007 4.229 . 0 0 "[ . 1 .]" 1
943 1 46 LYS HA 1 46 LYS HG2 2.700 . 3.600 2.813 2.527 3.166 . 0 0 "[ . 1 .]" 1
944 1 46 LYS HA 1 46 LYS HG3 2.700 . 3.600 2.766 2.464 3.049 . 0 0 "[ . 1 .]" 1
945 1 46 LYS HA 1 47 LEU H 2.300 . 3.000 2.174 2.133 2.223 . 0 0 "[ . 1 .]" 1
946 1 46 LYS HA 1 53 THR HA 2.300 . 3.000 2.943 2.787 3.030 0.030 7 0 "[ . 1 .]" 1
947 1 46 LYS HA 1 53 THR MG 2.200 . 2.800 2.130 1.675 2.621 . 0 0 "[ . 1 .]" 1
948 1 46 LYS HA 1 54 TYR H 2.800 . 5.500 4.153 3.966 4.359 . 0 0 "[ . 1 .]" 1
949 1 46 LYS QB 1 46 LYS HG3 2.300 . 3.000 2.032 1.970 2.123 . 0 0 "[ . 1 .]" 1
950 1 46 LYS HG2 1 48 GLY H 2.800 . 3.800 2.615 2.095 3.641 . 0 0 "[ . 1 .]" 1
951 1 46 LYS HG3 1 48 GLY H 3.000 . 5.500 4.255 3.686 5.293 . 0 0 "[ . 1 .]" 1
952 1 47 LEU H 1 47 LEU HA 2.600 . 3.400 2.942 2.893 2.949 . 0 0 "[ . 1 .]" 1
953 1 47 LEU H 1 47 LEU HB2 2.600 . 3.400 2.865 2.350 2.993 . 0 0 "[ . 1 .]" 1
954 1 47 LEU H 1 47 LEU HB3 2.900 . 4.000 3.792 3.579 3.862 . 0 0 "[ . 1 .]" 1
955 1 47 LEU H 1 47 LEU MD1 2.700 . 3.600 3.554 3.406 4.084 0.484 8 0 "[ . 1 .]" 1
956 1 47 LEU H 1 47 LEU MD2 2.600 . 5.500 3.624 1.919 4.004 . 0 0 "[ . 1 .]" 1
957 1 47 LEU H 1 47 LEU HG 2.600 . 3.400 2.477 2.247 3.490 0.090 8 0 "[ . 1 .]" 1
958 1 47 LEU H 1 48 GLY H 2.600 . 3.400 3.284 3.154 3.398 . 0 0 "[ . 1 .]" 1
959 1 47 LEU H 1 53 THR HA 2.700 . 3.600 2.803 2.121 3.097 . 0 0 "[ . 1 .]" 1
960 1 47 LEU HA 1 47 LEU HB2 2.600 . 3.400 2.987 2.967 3.009 . 0 0 "[ . 1 .]" 1
961 1 47 LEU HA 1 47 LEU HB3 2.700 . 3.600 2.331 2.285 2.505 . 0 0 "[ . 1 .]" 1
962 1 47 LEU HA 1 47 LEU MD2 2.000 . 2.500 2.492 2.185 2.524 0.024 2 0 "[ . 1 .]" 1
963 1 47 LEU HA 1 47 LEU HG 2.700 . 3.600 3.173 2.980 3.706 0.106 8 0 "[ . 1 .]" 1
964 1 47 LEU HA 1 48 GLY H 2.400 . 3.100 2.352 2.320 2.388 . 0 0 "[ . 1 .]" 1
965 1 47 LEU HB2 1 47 LEU MD2 2.400 . 3.100 3.101 2.684 3.143 0.043 5 0 "[ . 1 .]" 1
966 1 47 LEU HB2 1 47 LEU MD2 2.100 . 2.700 2.157 2.028 2.411 . 0 0 "[ . 1 .]" 1
967 1 47 LEU HB2 1 47 LEU HG 2.500 . 3.300 2.374 2.154 2.507 . 0 0 "[ . 1 .]" 1
968 1 47 LEU HB2 1 48 GLY H 2.800 . 5.500 4.342 4.314 4.373 . 0 0 "[ . 1 .]" 1
969 1 47 LEU HB2 1 52 GLY HA2 2.800 . 3.800 3.874 3.598 4.303 0.503 8 1 "[ . + 1 .]" 1
970 1 47 LEU HB2 1 52 GLY HA3 2.900 . 4.000 3.256 2.945 3.505 . 0 0 "[ . 1 .]" 1
971 1 47 LEU HB2 1 53 THR H 2.700 . 5.500 4.557 4.253 4.793 . 0 0 "[ . 1 .]" 1
972 1 47 LEU HB3 1 47 LEU MD1 2.200 . 2.800 2.013 1.869 2.122 . 0 0 "[ . 1 .]" 1
973 1 47 LEU HB3 1 48 GLY H 3.200 . 4.500 4.391 4.308 4.449 . 0 0 "[ . 1 .]" 1
974 1 47 LEU MD1 1 54 TYR HA 2.700 . 3.600 3.303 2.992 3.652 0.052 8 0 "[ . 1 .]" 1
975 1 47 LEU MD2 1 47 LEU HG 2.100 . 2.700 2.100 2.084 2.121 . 0 0 "[ . 1 .]" 1
976 1 47 LEU MD2 1 48 GLY H 3.200 . 5.500 4.662 3.919 4.778 . 0 0 "[ . 1 .]" 1
977 1 47 LEU MD2 1 54 TYR QD 2.500 . 3.300 2.418 2.088 2.749 . 0 0 "[ . 1 .]" 1
978 1 47 LEU MD2 1 54 TYR QE 2.600 . 3.400 3.428 3.226 4.086 0.686 8 1 "[ . + 1 .]" 1
979 1 47 LEU HG 1 48 GLY H 3.400 . 5.500 4.956 4.847 5.814 0.314 8 0 "[ . 1 .]" 1
980 1 47 LEU HG 1 51 LEU QD 2.200 . 5.500 3.983 2.375 4.534 . 0 0 "[ . 1 .]" 1
981 1 47 LEU HG 1 54 TYR QD 3.000 . 4.100 2.874 1.905 3.306 . 0 0 "[ . 1 .]" 1
982 1 47 LEU HG 1 54 TYR QE 3.000 . 5.500 4.735 2.873 5.205 . 0 0 "[ . 1 .]" 1
983 1 48 GLY H 1 48 GLY HA3 2.400 . 3.100 2.297 2.293 2.306 . 0 0 "[ . 1 .]" 1
984 1 48 GLY H 1 49 GLY H 3.400 . 4.800 4.267 4.000 4.466 . 0 0 "[ . 1 .]" 1
985 1 48 GLY HA2 1 49 GLY H 2.500 . 3.300 2.218 2.140 2.349 . 0 0 "[ . 1 .]" 1
986 1 48 GLY HA3 1 49 GLY H 2.400 . 5.500 3.430 3.296 3.530 . 0 0 "[ . 1 .]" 1
987 1 49 GLY H 1 49 GLY HA2 2.700 . 3.600 2.784 2.688 2.876 . 0 0 "[ . 1 .]" 1
988 1 49 GLY H 1 49 GLY HA3 2.300 . 3.000 2.825 2.726 2.899 . 0 0 "[ . 1 .]" 1
989 1 49 GLY H 1 50 ASP H 3.200 . 4.500 2.972 2.354 3.504 . 0 0 "[ . 1 .]" 1
990 1 49 GLY HA2 1 50 ASP H 2.900 . 4.000 3.400 2.565 3.570 . 0 0 "[ . 1 .]" 1
991 1 49 GLY HA3 1 50 ASP H 2.900 . 4.000 2.541 2.202 3.567 . 0 0 "[ . 1 .]" 1
992 1 50 ASP H 1 50 ASP HA 3.000 . 4.100 2.798 2.270 2.943 . 0 0 "[ . 1 .]" 1
993 1 50 ASP H 1 50 ASP QB 3.000 . 4.100 2.833 2.467 3.316 . 0 0 "[ . 1 .]" 1
994 1 50 ASP H 1 51 LEU H 2.700 . 3.600 2.137 1.781 2.736 0.019 2 0 "[ . 1 .]" 1
995 1 50 ASP HA 1 50 ASP QB 2.000 . 2.500 2.489 2.381 2.537 0.037 5 0 "[ . 1 .]" 1
996 1 50 ASP HA 1 51 LEU H 3.100 . 4.300 3.054 2.508 3.505 . 0 0 "[ . 1 .]" 1
997 1 50 ASP HA 1 52 GLY H 3.600 . 5.500 5.361 4.770 5.527 0.027 14 0 "[ . 1 .]" 1
998 1 50 ASP QB 1 51 LEU H 3.200 . 4.500 3.533 2.771 3.997 . 0 0 "[ . 1 .]" 1
999 1 51 LEU H 1 51 LEU HA 2.500 . 3.300 2.898 2.788 2.948 . 0 0 "[ . 1 .]" 1
1000 1 51 LEU H 1 51 LEU HB2 2.400 . 3.100 2.587 2.053 3.192 0.092 4 0 "[ . 1 .]" 1
1001 1 51 LEU H 1 51 LEU HB3 2.600 . 3.400 3.101 2.630 3.501 0.101 14 0 "[ . 1 .]" 1
1002 1 51 LEU H 1 51 LEU QD 2.400 . 5.500 3.653 3.073 3.957 . 0 0 "[ . 1 .]" 1
1003 1 51 LEU H 1 51 LEU HG 2.300 . 5.500 4.243 2.744 4.759 . 0 0 "[ . 1 .]" 1
1004 1 51 LEU H 1 52 GLY H 2.500 . 3.300 2.778 2.219 3.222 . 0 0 "[ . 1 .]" 1
1005 1 51 LEU HA 1 51 LEU HB2 2.400 . 3.100 2.727 2.460 2.990 . 0 0 "[ . 1 .]" 1
1006 1 51 LEU HA 1 51 LEU HB3 2.300 . 3.000 2.897 2.621 3.020 0.020 8 0 "[ . 1 .]" 1
1007 1 51 LEU HA 1 51 LEU QD 1.800 . 2.200 1.941 1.725 2.127 . 0 0 "[ . 1 .]" 1
1008 1 51 LEU HA 1 51 LEU QD 2.500 . 3.300 1.887 1.641 2.082 0.059 4 0 "[ . 1 .]" 1
1009 1 51 LEU HA 1 51 LEU HG 2.400 . 3.100 2.889 2.536 3.080 . 0 0 "[ . 1 .]" 1
1010 1 51 LEU HA 1 52 GLY H 2.800 . 3.800 3.556 3.541 3.574 . 0 0 "[ . 1 .]" 1
1011 1 51 LEU HB2 1 51 LEU QD 2.300 . 3.000 2.205 2.053 2.506 . 0 0 "[ . 1 .]" 1
1012 1 51 LEU HB2 1 52 GLY H 3.000 . 5.500 2.966 2.142 3.492 . 0 0 "[ . 1 .]" 1
1013 1 51 LEU HB3 1 51 LEU QD 2.100 . 2.700 2.182 1.947 2.321 . 0 0 "[ . 1 .]" 1
1014 1 51 LEU HB3 1 51 LEU HG 2.600 . 3.400 2.650 2.444 3.014 . 0 0 "[ . 1 .]" 1
1015 1 51 LEU HB3 1 52 GLY H 3.000 . 4.100 1.982 1.713 2.406 0.187 11 0 "[ . 1 .]" 1
1016 1 51 LEU QD 1 51 LEU HG 2.000 . 2.400 1.871 1.857 1.893 . 0 0 "[ . 1 .]" 1
1017 1 51 LEU QD 1 52 GLY H 3.200 . 4.500 3.530 3.221 3.821 . 0 0 "[ . 1 .]" 1
1018 1 51 LEU QD 1 54 TYR QD 2.700 . 3.600 3.347 2.945 3.549 . 0 0 "[ . 1 .]" 1
1019 1 51 LEU QD 1 54 TYR QE 2.100 . 2.700 2.187 1.539 2.673 . 0 0 "[ . 1 .]" 1
1020 1 51 LEU QD 1 104 ALA HA 2.200 . 5.500 4.266 3.752 4.745 . 0 0 "[ . 1 .]" 1
1021 1 51 LEU QD 1 104 ALA HA 2.400 . 5.500 4.464 3.846 5.138 . 0 0 "[ . 1 .]" 1
1022 1 51 LEU QD 1 104 ALA MB 1.900 . 5.500 2.497 2.062 3.167 . 0 0 "[ . 1 .]" 1
1023 1 51 LEU HG 1 52 GLY H 3.300 . 4.700 3.917 3.004 4.596 . 0 0 "[ . 1 .]" 1
1024 1 52 GLY H 1 52 GLY HA2 2.400 . 3.100 2.665 2.577 2.707 . 0 0 "[ . 1 .]" 1
1025 1 52 GLY H 1 52 GLY HA3 2.600 . 3.400 2.911 2.888 2.944 . 0 0 "[ . 1 .]" 1
1026 1 52 GLY HA2 1 70 PRO HB3 3.000 . 4.100 3.839 3.541 4.052 . 0 0 "[ . 1 .]" 1
1027 1 52 GLY HA2 1 70 PRO HG3 3.000 . 4.100 3.906 3.686 4.091 . 0 0 "[ . 1 .]" 1
1028 1 52 GLY HA3 1 53 THR H 2.400 . 3.100 2.151 2.136 2.191 . 0 0 "[ . 1 .]" 1
1029 1 52 GLY HA3 1 70 PRO HB3 2.900 . 4.000 2.402 2.010 2.879 . 0 0 "[ . 1 .]" 1
1030 1 52 GLY HA3 1 70 PRO HG3 3.000 . 4.100 2.270 2.004 2.446 . 0 0 "[ . 1 .]" 1
1031 1 53 THR H 1 53 THR HA 2.900 . 4.000 2.892 2.876 2.914 . 0 0 "[ . 1 .]" 1
1032 1 53 THR H 1 53 THR HB 2.300 . 5.500 3.085 2.785 3.581 . 0 0 "[ . 1 .]" 1
1033 1 53 THR H 1 53 THR MG 2.900 . 4.000 3.994 3.877 4.032 0.032 1 0 "[ . 1 .]" 1
1034 1 53 THR H 1 70 PRO HB3 3.100 . 4.300 3.390 3.067 3.896 . 0 0 "[ . 1 .]" 1
1035 1 53 THR HA 1 53 THR HB 2.500 . 3.300 2.995 2.826 3.026 . 0 0 "[ . 1 .]" 1
1036 1 53 THR HA 1 53 THR MG 2.100 . 2.700 2.315 2.023 2.566 . 0 0 "[ . 1 .]" 1
1037 1 53 THR HA 1 54 TYR H 2.200 . 2.800 2.150 2.140 2.192 . 0 0 "[ . 1 .]" 1
1038 1 53 THR HB 1 53 THR MG 1.800 . 2.200 2.089 2.070 2.116 . 0 0 "[ . 1 .]" 1
1039 1 53 THR MG 1 54 TYR H 2.700 . 3.600 2.956 2.653 3.211 . 0 0 "[ . 1 .]" 1
1040 1 54 TYR H 1 54 TYR HA 3.000 . 4.100 2.906 2.885 2.946 . 0 0 "[ . 1 .]" 1
1041 1 54 TYR H 1 54 TYR QB 2.700 . 3.600 2.242 2.173 2.365 . 0 0 "[ . 1 .]" 1
1042 1 54 TYR H 1 54 TYR QD 2.600 . 5.500 3.240 2.800 3.590 . 0 0 "[ . 1 .]" 1
1043 1 54 TYR HA 1 54 TYR QD 2.600 . 3.400 2.469 1.969 2.790 . 0 0 "[ . 1 .]" 1
1044 1 54 TYR HA 1 54 TYR QE 3.300 . 4.700 4.363 4.196 4.493 . 0 0 "[ . 1 .]" 1
1045 1 54 TYR HA 1 56 ILE HG13 3.000 . 4.100 3.685 3.537 3.860 . 0 0 "[ . 1 .]" 1
1046 1 54 TYR HA 1 56 ILE MD 2.900 . 5.500 4.678 4.431 4.968 . 0 0 "[ . 1 .]" 1
1047 1 54 TYR HA 1 67 LEU MD2 2.800 . 3.800 3.392 3.099 3.610 . 0 0 "[ . 1 .]" 1
1048 1 54 TYR HA 1 70 PRO HD2 2.900 . 5.500 4.738 4.224 5.023 . 0 0 "[ . 1 .]" 1
1049 1 54 TYR HA 1 70 PRO HD3 2.600 . 3.400 3.160 2.733 3.401 0.001 3 0 "[ . 1 .]" 1
1050 1 54 TYR QB 1 54 TYR QD 2.600 . 3.400 2.145 2.135 2.196 . 0 0 "[ . 1 .]" 1
1051 1 54 TYR QB 1 55 VAL H 3.100 . 4.300 3.574 3.170 3.720 . 0 0 "[ . 1 .]" 1
1052 1 54 TYR QB 1 56 ILE MD 2.900 . 4.000 2.682 2.398 2.971 . 0 0 "[ . 1 .]" 1
1053 1 54 TYR QB 1 67 LEU MD1 2.800 . 3.800 4.421 4.210 4.612 0.812 7 12 "[**- **+**1** **]" 1
1054 1 54 TYR QB 1 69 SER HA 3.100 . 5.500 4.607 4.356 4.747 . 0 0 "[ . 1 .]" 1
1055 1 54 TYR QD 1 56 ILE MD 3.000 . 4.100 3.534 3.367 3.742 . 0 0 "[ . 1 .]" 1
1056 1 54 TYR QD 1 97 LEU QD 3.000 . 4.100 2.526 2.129 2.720 . 0 0 "[ . 1 .]" 1
1057 1 54 TYR QD 1 67 LEU MD2 2.100 . 2.700 2.239 1.870 2.528 . 0 0 "[ . 1 .]" 1
1058 1 54 TYR QD 1 69 SER HA 2.900 . 4.000 2.741 2.164 3.122 . 0 0 "[ . 1 .]" 1
1059 1 54 TYR QD 1 69 SER QB 2.700 . 3.600 2.849 2.438 3.174 . 0 0 "[ . 1 .]" 1
1060 1 54 TYR QD 1 70 PRO HD3 3.100 . 4.300 3.399 2.826 3.717 . 0 0 "[ . 1 .]" 1
1061 1 54 TYR QD 1 97 LEU QD 3.000 . 4.100 2.724 2.238 3.389 . 0 0 "[ . 1 .]" 1
1062 1 54 TYR QE 1 67 LEU MD1 2.100 . 2.700 2.891 2.576 3.226 0.526 8 1 "[ . + 1 .]" 1
1063 1 54 TYR QE 1 67 LEU QD 2.400 . 3.100 2.207 1.727 2.865 . 0 0 "[ . 1 .]" 1
1064 1 54 TYR QE 1 69 SER HA 2.800 . 3.800 3.063 2.478 3.380 . 0 0 "[ . 1 .]" 1
1065 1 54 TYR QE 1 69 SER QB 2.700 . 3.400 1.981 1.804 2.223 . 0 0 "[ . 1 .]" 1
1066 1 54 TYR QE 1 70 PRO HD3 3.100 . 4.300 3.535 2.974 3.803 . 0 0 "[ . 1 .]" 1
1067 1 54 TYR QE 1 96 LEU QD 2.400 . 3.100 2.874 2.583 3.046 . 0 0 "[ . 1 .]" 1
1068 1 54 TYR QE 1 97 LEU QD 2.600 . 3.400 2.874 2.517 3.356 . 0 0 "[ . 1 .]" 1
1069 1 54 TYR QE 1 101 LEU QD 2.300 . 5.500 2.312 1.743 3.239 . 0 0 "[ . 1 .]" 1
1070 1 54 TYR QE 1 104 ALA MB 2.900 . 5.500 4.948 4.361 5.508 0.008 5 0 "[ . 1 .]" 1
1071 1 55 VAL H 1 55 VAL HA 2.500 . 3.300 2.932 2.909 2.951 . 0 0 "[ . 1 .]" 1
1072 1 55 VAL H 1 55 VAL HB 2.700 . 3.600 2.553 2.215 2.878 . 0 0 "[ . 1 .]" 1
1073 1 55 VAL H 1 55 VAL MG1 2.700 . 5.500 3.739 3.451 3.941 . 0 0 "[ . 1 .]" 1
1074 1 55 VAL H 1 68 SER H 2.500 . 3.300 3.023 2.556 3.313 0.013 1 0 "[ . 1 .]" 1
1075 1 55 VAL H 1 68 SER HB2 3.000 . 4.100 3.768 3.450 4.105 0.005 9 0 "[ . 1 .]" 1
1076 1 55 VAL H 1 68 SER HB3 3.000 . 4.100 2.525 2.035 3.246 . 0 0 "[ . 1 .]" 1
1077 1 55 VAL HA 1 55 VAL HB 2.600 . 3.400 2.993 2.932 3.020 . 0 0 "[ . 1 .]" 1
1078 1 55 VAL HA 1 55 VAL MG1 1.900 . 2.400 2.393 2.106 2.779 0.379 8 0 "[ . 1 .]" 1
1079 1 55 VAL HA 1 56 ILE H 2.100 . 2.700 2.176 2.146 2.203 . 0 0 "[ . 1 .]" 1
1080 1 55 VAL HB 1 55 VAL MG1 1.900 . 2.400 2.107 2.084 2.130 . 0 0 "[ . 1 .]" 1
1081 1 55 VAL HB 1 55 VAL MG2 1.800 . 2.200 2.107 2.087 2.128 . 0 0 "[ . 1 .]" 1
1082 1 55 VAL HB 1 56 ILE H 3.400 . 4.800 4.322 4.012 4.436 . 0 0 "[ . 1 .]" 1
1083 1 55 VAL HB 1 68 SER HB2 2.400 . 3.100 2.406 2.130 2.812 . 0 0 "[ . 1 .]" 1
1084 1 55 VAL HB 1 68 SER HB3 2.500 . 3.300 2.081 1.704 2.481 . 0 0 "[ . 1 .]" 1
1085 1 55 VAL QG 1 56 ILE HA 2.900 . 4.000 3.670 3.097 4.030 0.030 5 0 "[ . 1 .]" 1
1086 1 55 VAL QG 1 57 ASN HD21 3.000 . 4.100 4.061 2.519 4.735 0.635 12 6 "[ . * 1*+-**]" 1
1087 1 55 VAL QG 1 57 ASN HD22 3.300 . 4.700 4.159 3.373 4.629 . 0 0 "[ . 1 .]" 1
1088 1 55 VAL QG 1 68 SER HB2 2.400 . 3.100 2.853 1.880 3.091 . 0 0 "[ . 1 .]" 1
1089 1 55 VAL MG1 1 56 ILE H 2.500 . 3.300 2.885 2.435 3.243 . 0 0 "[ . 1 .]" 1
1090 1 55 VAL MG2 1 68 SER HB3 2.600 . 3.400 2.704 1.979 3.798 0.398 8 0 "[ . 1 .]" 1
1091 1 56 ILE H 1 56 ILE HA 3.000 . 4.100 2.937 2.926 2.947 . 0 0 "[ . 1 .]" 1
1092 1 56 ILE H 1 56 ILE HB 2.700 . 3.600 2.750 2.584 2.895 . 0 0 "[ . 1 .]" 1
1093 1 56 ILE H 1 56 ILE MD 2.900 . 4.000 3.266 2.855 3.800 . 0 0 "[ . 1 .]" 1
1094 1 56 ILE H 1 56 ILE HG12 3.000 . 5.500 4.217 4.007 4.476 . 0 0 "[ . 1 .]" 1
1095 1 56 ILE H 1 56 ILE HG13 2.900 . 4.000 2.815 2.569 3.119 . 0 0 "[ . 1 .]" 1
1096 1 56 ILE HA 1 56 ILE HB 2.900 . 4.000 3.018 3.012 3.022 . 0 0 "[ . 1 .]" 1
1097 1 56 ILE HA 1 56 ILE MD 2.600 . 5.500 3.875 3.845 3.898 . 0 0 "[ . 1 .]" 1
1098 1 56 ILE HA 1 56 ILE HG12 2.500 . 3.300 2.746 2.687 2.865 . 0 0 "[ . 1 .]" 1
1099 1 56 ILE HA 1 56 ILE HG13 2.600 . 3.400 2.637 2.567 2.710 . 0 0 "[ . 1 .]" 1
1100 1 56 ILE HA 1 56 ILE MG 2.200 . 2.800 2.328 2.239 2.392 . 0 0 "[ . 1 .]" 1
1101 1 56 ILE HA 1 57 ASN H 2.400 . 3.100 2.195 2.131 2.260 . 0 0 "[ . 1 .]" 1
1102 1 56 ILE HA 1 65 ILE MG 2.900 . 4.000 3.499 3.321 3.719 . 0 0 "[ . 1 .]" 1
1103 1 56 ILE HA 1 67 LEU HA 2.200 . 2.800 2.624 2.556 2.736 . 0 0 "[ . 1 .]" 1
1104 1 56 ILE HA 1 67 LEU MD2 2.800 . 3.800 3.130 2.937 3.468 . 0 0 "[ . 1 .]" 1
1105 1 56 ILE HA 1 68 SER H 2.900 . 4.000 3.748 3.493 3.853 . 0 0 "[ . 1 .]" 1
1106 1 56 ILE HB 1 56 ILE MD 2.200 . 2.800 2.112 2.031 2.251 . 0 0 "[ . 1 .]" 1
1107 1 56 ILE HB 1 56 ILE HG12 2.700 . 3.600 2.930 2.888 2.972 . 0 0 "[ . 1 .]" 1
1108 1 56 ILE HB 1 56 ILE HG13 2.400 . 3.100 2.758 2.685 2.816 . 0 0 "[ . 1 .]" 1
1109 1 56 ILE HB 1 56 ILE HG13 2.200 . 2.800 2.294 1.982 2.509 . 0 0 "[ . 1 .]" 1
1110 1 56 ILE HB 1 56 ILE MG 2.100 . 2.700 2.118 2.084 2.128 . 0 0 "[ . 1 .]" 1
1111 1 56 ILE MD 1 56 ILE HG12 2.000 . 2.500 2.086 2.071 2.116 . 0 0 "[ . 1 .]" 1
1112 1 56 ILE MD 1 56 ILE HG12 1.900 . 2.400 2.027 2.007 2.048 . 0 0 "[ . 1 .]" 1
1113 1 56 ILE MD 1 56 ILE HG13 2.000 . 2.500 2.088 2.073 2.119 . 0 0 "[ . 1 .]" 1
1114 1 56 ILE MD 1 67 LEU H 3.600 . 5.200 4.990 4.910 5.127 . 0 0 "[ . 1 .]" 1
1115 1 56 ILE MD 1 67 LEU HA 2.900 . 5.500 4.631 4.498 4.750 . 0 0 "[ . 1 .]" 1
1116 1 56 ILE MD 1 93 LEU QD 2.300 . 3.000 2.807 2.448 2.912 . 0 0 "[ . 1 .]" 1
1117 1 56 ILE MD 1 94 HIS HA 2.800 . 5.500 3.006 2.531 3.519 . 0 0 "[ . 1 .]" 1
1118 1 56 ILE MD 1 97 LEU QD 2.000 . 2.500 2.395 2.244 2.492 . 0 0 "[ . 1 .]" 1
1119 1 56 ILE HG12 1 56 ILE MG 2.200 . 2.800 2.116 1.966 2.205 . 0 0 "[ . 1 .]" 1
1120 1 56 ILE HG12 1 57 ASN H 3.400 . 4.800 4.699 4.482 5.024 0.224 3 0 "[ . 1 .]" 1
1121 1 56 ILE HG12 1 93 LEU QD 1.900 . 5.500 2.238 1.834 2.850 . 0 0 "[ . 1 .]" 1
1122 1 56 ILE HG12 1 97 LEU QD 2.900 . 4.000 3.162 2.879 3.904 . 0 0 "[ . 1 .]" 1
1123 1 56 ILE HG13 1 56 ILE MG 2.400 . 3.100 3.055 2.995 3.120 0.020 9 0 "[ . 1 .]" 1
1124 1 56 ILE HG13 1 67 LEU HA 2.500 . 3.300 3.271 3.142 3.317 0.017 15 0 "[ . 1 .]" 1
1125 1 56 ILE HG13 1 67 LEU HA 2.300 . 5.500 3.039 2.980 3.074 . 0 0 "[ . 1 .]" 1
1126 1 56 ILE HG13 1 67 LEU MD1 1.900 . 2.400 1.868 1.858 1.885 . 0 0 "[ . 1 .]" 1
1127 1 56 ILE HG13 1 69 SER QB 2.900 . 5.500 4.314 4.039 4.638 . 0 0 "[ . 1 .]" 1
1128 1 56 ILE MG 1 65 ILE MD 2.600 . 3.400 3.334 3.004 3.426 0.026 8 0 "[ . 1 .]" 1
1129 1 56 ILE MG 1 65 ILE HG12 2.600 . 5.500 3.956 3.709 4.187 . 0 0 "[ . 1 .]" 1
1130 1 56 ILE MG 1 65 ILE MG 1.900 . 2.400 2.103 2.000 2.301 . 0 0 "[ . 1 .]" 1
1131 1 56 ILE MG 1 67 LEU HA 2.700 . 3.600 3.588 3.393 3.638 0.038 6 0 "[ . 1 .]" 1
1132 1 56 ILE MG 1 67 LEU HB2 2.800 . 3.800 3.402 3.219 3.726 . 0 0 "[ . 1 .]" 1
1133 1 56 ILE MG 1 93 LEU QD 2.400 . 3.100 2.024 1.799 2.368 . 0 0 "[ . 1 .]" 1
1134 1 57 ASN H 1 66 TRP H 2.900 . 4.000 3.374 2.987 3.645 . 0 0 "[ . 1 .]" 1
1135 1 57 ASN H 1 67 LEU HA 3.100 . 4.300 4.077 3.976 4.154 . 0 0 "[ . 1 .]" 1
1136 1 57 ASN HA 1 57 ASN HB2 2.300 . 3.000 2.468 2.280 2.799 . 0 0 "[ . 1 .]" 1
1137 1 57 ASN HA 1 57 ASN HB3 2.400 . 3.100 2.474 2.234 2.680 . 0 0 "[ . 1 .]" 1
1138 1 57 ASN HA 1 58 LYS H 2.300 . 3.000 2.402 2.259 2.545 . 0 0 "[ . 1 .]" 1
1139 1 57 ASN HB2 1 57 ASN HD21 2.800 . 3.800 2.881 2.109 3.553 . 0 0 "[ . 1 .]" 1
1140 1 57 ASN HB2 1 57 ASN HD22 3.100 . 4.300 3.779 3.423 4.097 . 0 0 "[ . 1 .]" 1
1141 1 57 ASN HB2 1 58 LYS H 2.700 . 3.600 2.567 2.314 2.827 . 0 0 "[ . 1 .]" 1
1142 1 57 ASN HB3 1 57 ASN HD21 3.200 . 4.500 2.939 2.139 3.543 . 0 0 "[ . 1 .]" 1
1143 1 57 ASN HB3 1 57 ASN HD22 3.400 . 4.800 3.799 3.443 4.089 . 0 0 "[ . 1 .]" 1
1144 1 57 ASN HB3 1 58 LYS H 2.900 . 4.000 3.739 3.219 3.979 . 0 0 "[ . 1 .]" 1
1145 1 57 ASN HD22 1 59 GLN HB2 3.500 . 5.000 5.208 4.608 5.834 0.834 15 5 "[* . * 1 -* +]" 1
1146 1 58 LYS H 1 58 LYS HA 2.900 . 4.000 2.926 2.892 2.946 . 0 0 "[ . 1 .]" 1
1147 1 58 LYS H 1 58 LYS QB 2.800 . 3.800 2.666 2.113 3.014 . 0 0 "[ . 1 .]" 1
1148 1 58 LYS H 1 58 LYS QD 2.800 . 5.500 3.969 3.421 4.654 . 0 0 "[ . 1 .]" 1
1149 1 58 LYS H 1 58 LYS QE 2.800 . 5.500 4.357 3.675 4.977 . 0 0 "[ . 1 .]" 1
1150 1 58 LYS H 1 58 LYS QG 3.000 . 4.100 2.349 1.894 3.826 0.006 8 0 "[ . 1 .]" 1
1151 1 58 LYS HA 1 58 LYS QB 2.100 . 2.700 2.222 2.175 2.541 . 0 0 "[ . 1 .]" 1
1152 1 58 LYS HA 1 58 LYS QD 2.400 . 5.500 3.964 1.989 4.385 . 0 0 "[ . 1 .]" 1
1153 1 58 LYS HA 1 58 LYS QG 2.700 . 3.600 3.212 2.191 3.387 . 0 0 "[ . 1 .]" 1
1154 1 58 LYS HA 1 59 GLN H 2.500 . 3.300 2.614 2.138 3.331 0.031 6 0 "[ . 1 .]" 1
1155 1 58 LYS HA 1 59 GLN HB3 2.600 . 5.500 4.145 4.072 4.215 . 0 0 "[ . 1 .]" 1
1156 1 58 LYS HA 1 65 ILE HA 2.500 . 3.300 2.413 2.091 3.163 . 0 0 "[ . 1 .]" 1
1157 1 58 LYS HA 1 65 ILE MD 2.900 . 4.000 3.770 3.232 4.056 0.056 10 0 "[ . 1 .]" 1
1158 1 58 LYS HA 1 65 ILE HG13 2.900 . 4.000 3.404 2.761 4.007 0.007 10 0 "[ . 1 .]" 1
1159 1 58 LYS HA 1 65 ILE MG 2.800 . 3.800 3.440 3.115 3.818 0.018 9 0 "[ . 1 .]" 1
1160 1 58 LYS QB 1 58 LYS QG 2.200 . 2.800 2.043 1.989 2.086 . 0 0 "[ . 1 .]" 1
1161 1 58 LYS QD 1 59 GLN H 3.400 . 4.800 4.188 3.098 4.855 0.055 14 0 "[ . 1 .]" 1
1162 1 59 GLN H 1 59 GLN HB2 3.100 . 4.300 2.681 2.185 3.131 . 0 0 "[ . 1 .]" 1
1163 1 59 GLN H 1 59 GLN HB3 3.100 . 4.300 3.257 2.838 4.016 . 0 0 "[ . 1 .]" 1
1164 1 59 GLN H 1 65 ILE HA 3.300 . 4.700 3.686 2.906 4.699 . 0 0 "[ . 1 .]" 1
1165 1 59 GLN HA 1 59 GLN HB2 2.500 . 3.300 2.711 2.636 2.857 . 0 0 "[ . 1 .]" 1
1166 1 59 GLN HA 1 59 GLN HB3 2.400 . 3.100 2.951 2.833 2.990 . 0 0 "[ . 1 .]" 1
1167 1 59 GLN HA 1 59 GLN HG2 2.600 . 3.400 3.338 2.520 3.654 0.254 7 0 "[ . 1 .]" 1
1168 1 59 GLN HA 1 59 GLN HG3 3.000 . 4.100 2.589 2.109 3.465 . 0 0 "[ . 1 .]" 1
1169 1 59 GLN HA 1 60 THR H 2.700 . 3.600 3.037 2.186 3.276 . 0 0 "[ . 1 .]" 1
1170 1 59 GLN HA 1 61 PRO HD2 2.700 . 5.500 3.819 3.030 4.178 . 0 0 "[ . 1 .]" 1
1171 1 59 GLN HB2 1 59 GLN HG2 2.600 . 3.400 2.615 2.206 3.006 . 0 0 "[ . 1 .]" 1
1172 1 59 GLN HB2 1 59 GLN HG3 2.600 . 3.400 2.830 2.386 3.009 . 0 0 "[ . 1 .]" 1
1173 1 59 GLN HB3 1 59 GLN HG2 2.500 . 3.300 2.422 2.205 2.946 . 0 0 "[ . 1 .]" 1
1174 1 59 GLN HB3 1 59 GLN HG3 2.600 . 3.400 2.619 2.206 3.006 . 0 0 "[ . 1 .]" 1
1175 1 59 GLN HB3 1 61 PRO HD2 2.900 . 4.000 2.700 2.202 3.684 . 0 0 "[ . 1 .]" 1
1176 1 59 GLN HB3 1 61 PRO HD3 2.900 . 5.500 4.371 3.931 5.426 . 0 0 "[ . 1 .]" 1
1177 1 59 GLN HB3 1 63 LYS HA 2.600 . 5.500 4.542 3.744 5.227 . 0 0 "[ . 1 .]" 1
1178 1 59 GLN HB3 1 64 GLN H 3.500 . 5.000 2.992 2.302 5.005 0.005 8 0 "[ . 1 .]" 1
1179 1 59 GLN QE 1 59 GLN HG2 3.100 . 4.300 2.561 2.102 3.350 . 0 0 "[ . 1 .]" 1
1180 1 59 GLN QE 1 59 GLN HG3 3.000 . 4.100 2.776 2.103 3.338 . 0 0 "[ . 1 .]" 1
1181 1 59 GLN HG2 1 61 PRO HD3 2.600 . 3.400 2.990 2.476 3.758 0.358 14 0 "[ . 1 .]" 1
1182 1 59 GLN HG2 1 62 ASN H 3.300 . 4.700 4.331 3.230 5.155 0.455 14 0 "[ . 1 .]" 1
1183 1 59 GLN HG2 1 61 PRO HD2 2.700 . 3.600 2.576 1.667 4.263 0.663 1 1 "[+ . 1 .]" 1
1184 1 59 GLN HG2 1 64 GLN H 3.700 . 5.400 4.439 3.828 5.025 . 0 0 "[ . 1 .]" 1
1185 1 60 THR H 1 61 PRO HB2 3.200 . 4.500 4.141 3.949 5.223 0.723 15 1 "[ . 1 +]" 1
1186 1 60 THR H 1 61 PRO HD2 3.000 . 5.500 1.459 1.345 1.799 . 0 0 "[ . 1 .]" 1
1187 1 60 THR H 1 61 PRO HD3 3.300 . 4.700 2.779 2.525 2.914 . 0 0 "[ . 1 .]" 1
1188 1 60 THR HA 1 60 THR MG 2.200 . 2.800 2.480 2.175 2.690 . 0 0 "[ . 1 .]" 1
1189 1 60 THR HA 1 63 LYS H 3.100 . 4.300 4.075 3.101 4.323 0.023 10 0 "[ . 1 .]" 1
1190 1 60 THR HB 1 60 THR MG 2.200 . 2.800 2.093 2.070 2.114 . 0 0 "[ . 1 .]" 1
1191 1 60 THR HB 1 61 PRO HG2 2.400 . 5.500 3.670 3.535 3.751 . 0 0 "[ . 1 .]" 1
1192 1 60 THR HB 1 61 PRO HD2 2.500 . 3.300 2.978 2.778 3.947 0.647 14 1 "[ . 1 +.]" 1
1193 1 61 PRO HA 1 61 PRO HB2 2.300 . 3.000 2.975 2.602 3.009 0.009 5 0 "[ . 1 .]" 1
1194 1 61 PRO HA 1 61 PRO HB3 2.500 . 3.300 2.331 2.313 2.351 . 0 0 "[ . 1 .]" 1
1195 1 61 PRO HA 1 61 PRO HD3 2.400 . 5.500 3.279 3.070 3.749 . 0 0 "[ . 1 .]" 1
1196 1 61 PRO HA 1 62 ASN H 3.400 . 4.800 3.554 3.403 3.588 . 0 0 "[ . 1 .]" 1
1197 1 61 PRO HB3 1 62 ASN H 3.400 . 4.800 3.339 3.028 4.332 . 0 0 "[ . 1 .]" 1
1198 1 61 PRO HD2 1 61 PRO HG2 2.700 . 3.600 2.275 2.261 2.319 . 0 0 "[ . 1 .]" 1
1199 1 61 PRO HD2 1 61 PRO HG3 2.500 . 3.300 2.912 2.694 2.980 . 0 0 "[ . 1 .]" 1
1200 1 61 PRO HD2 1 62 ASN H 3.200 . 4.500 3.685 2.538 4.147 . 0 0 "[ . 1 .]" 1
1201 1 61 PRO HD2 1 64 GLN HE21 3.200 . 5.500 4.960 3.617 6.236 0.736 12 1 "[ . 1 + .]" 1
1202 1 61 PRO HD3 1 62 ASN H 3.300 . 5.500 4.642 3.800 4.874 . 0 0 "[ . 1 .]" 1
1203 1 61 PRO HG2 1 62 ASN H 3.000 . 4.100 3.745 2.653 4.106 0.006 5 0 "[ . 1 .]" 1
1204 1 62 ASN H 1 62 ASN HA 2.600 . 3.400 2.920 2.855 2.949 . 0 0 "[ . 1 .]" 1
1205 1 62 ASN H 1 62 ASN HB2 3.100 . 4.300 2.879 2.575 3.302 . 0 0 "[ . 1 .]" 1
1206 1 62 ASN H 1 62 ASN HB3 2.700 . 3.600 3.390 2.876 3.933 0.333 1 0 "[ . 1 .]" 1
1207 1 62 ASN H 1 63 LYS H 2.600 . 3.400 2.879 1.841 3.168 . 0 0 "[ . 1 .]" 1
1208 1 62 ASN H 1 63 LYS H 2.500 . 3.300 2.314 1.792 2.537 . 0 0 "[ . 1 .]" 1
1209 1 62 ASN HA 1 62 ASN HB3 2.500 . 3.300 2.812 2.348 3.017 . 0 0 "[ . 1 .]" 1
1210 1 62 ASN HB2 1 62 ASN HD21 3.000 . 4.100 2.665 2.128 3.552 . 0 0 "[ . 1 .]" 1
1211 1 62 ASN HB3 1 62 ASN HD21 3.400 . 4.800 2.931 2.113 3.552 . 0 0 "[ . 1 .]" 1
1212 1 63 LYS H 1 63 LYS HA 2.500 . 3.300 2.285 2.267 2.293 . 0 0 "[ . 1 .]" 1
1213 1 63 LYS H 1 63 LYS QB 3.200 . 4.500 3.154 2.802 3.409 . 0 0 "[ . 1 .]" 1
1214 1 63 LYS H 1 63 LYS QD 3.000 . 5.500 4.386 4.021 4.806 . 0 0 "[ . 1 .]" 1
1215 1 63 LYS H 1 63 LYS QG 2.800 . 3.800 2.860 2.254 3.731 . 0 0 "[ . 1 .]" 1
1216 1 63 LYS H 1 64 GLN H 3.000 . 4.100 3.379 3.036 4.171 0.071 8 0 "[ . 1 .]" 1
1217 1 63 LYS HA 1 63 LYS QB 2.400 . 3.100 2.303 2.230 2.380 . 0 0 "[ . 1 .]" 1
1218 1 63 LYS HA 1 63 LYS QD 2.600 . 3.400 3.429 3.397 3.465 0.065 15 0 "[ . 1 .]" 1
1219 1 63 LYS HA 1 63 LYS QG 2.500 . 3.300 2.538 2.337 2.747 . 0 0 "[ . 1 .]" 1
1220 1 63 LYS HA 1 64 GLN H 2.700 . 3.600 2.439 2.293 3.477 . 0 0 "[ . 1 .]" 1
1221 1 63 LYS HB2 1 63 LYS HD2 2.300 . 3.000 2.397 1.958 2.872 . 0 0 "[ . 1 .]" 1
1222 1 63 LYS HD2 1 63 LYS HG2 2.200 . 2.800 2.223 2.052 2.374 . 0 0 "[ . 1 .]" 1
1223 1 64 GLN H 1 64 GLN HB2 2.900 . 4.000 2.910 2.644 3.405 . 0 0 "[ . 1 .]" 1
1224 1 64 GLN H 1 64 GLN HB3 3.200 . 4.500 3.858 3.753 3.975 . 0 0 "[ . 1 .]" 1
1225 1 64 GLN H 1 64 GLN QG 3.200 . 4.500 2.953 2.247 3.654 . 0 0 "[ . 1 .]" 1
1226 1 64 GLN HA 1 64 GLN HB2 2.700 . 3.600 3.002 2.934 3.026 . 0 0 "[ . 1 .]" 1
1227 1 64 GLN HA 1 64 GLN HB3 2.900 . 4.000 2.445 2.256 2.660 . 0 0 "[ . 1 .]" 1
1228 1 64 GLN HA 1 64 GLN QG 2.400 . 3.100 2.544 2.292 3.072 . 0 0 "[ . 1 .]" 1
1229 1 64 GLN HA 1 65 ILE H 2.800 . 3.800 2.166 2.135 2.188 . 0 0 "[ . 1 .]" 1
1230 1 64 GLN HA 1 84 TRP HZ3 2.900 . 4.000 3.675 3.167 4.010 0.010 14 0 "[ . 1 .]" 1
1231 1 64 GLN HB2 1 66 TRP HD1 2.900 . 4.000 3.614 2.857 3.988 . 0 0 "[ . 1 .]" 1
1232 1 64 GLN HB2 1 66 TRP HE1 2.800 . 3.800 3.469 2.643 3.808 0.008 8 0 "[ . 1 .]" 1
1233 1 64 GLN HB3 1 64 GLN QG 2.600 . 3.400 2.306 2.133 2.498 . 0 0 "[ . 1 .]" 1
1234 1 64 GLN HB3 1 65 ILE H 2.800 . 3.800 3.671 3.166 3.842 0.042 8 0 "[ . 1 .]" 1
1235 1 64 GLN HB3 1 66 TRP HD1 2.900 . 4.000 3.288 2.464 4.020 0.020 7 0 "[ . 1 .]" 1
1236 1 64 GLN HB3 1 66 TRP HE1 3.100 . 4.300 3.382 2.533 4.267 . 0 0 "[ . 1 .]" 1
1237 1 64 GLN HE21 1 64 GLN QG 3.000 . 4.100 2.472 2.092 2.708 . 0 0 "[ . 1 .]" 1
1238 1 64 GLN HG2 1 66 TRP HE1 3.000 . 5.500 5.179 4.062 5.989 0.489 6 0 "[ . 1 .]" 1
1239 1 65 ILE H 1 65 ILE HB 2.900 . 4.000 2.396 2.331 2.479 . 0 0 "[ . 1 .]" 1
1240 1 65 ILE H 1 84 TRP HZ3 2.900 . 4.000 3.757 3.421 4.012 0.012 9 0 "[ . 1 .]" 1
1241 1 65 ILE HA 1 65 ILE HB 2.700 . 3.600 3.008 2.989 3.017 . 0 0 "[ . 1 .]" 1
1242 1 65 ILE HA 1 65 ILE MD 2.600 . 5.500 3.752 3.694 3.800 . 0 0 "[ . 1 .]" 1
1243 1 65 ILE HA 1 65 ILE HG12 2.600 . 3.400 2.377 2.256 2.468 . 0 0 "[ . 1 .]" 1
1244 1 65 ILE HA 1 65 ILE HG13 2.500 . 3.300 2.896 2.801 3.026 . 0 0 "[ . 1 .]" 1
1245 1 65 ILE HA 1 65 ILE MG 2.200 . 2.800 2.501 2.402 2.622 . 0 0 "[ . 1 .]" 1
1246 1 65 ILE HA 1 66 TRP H 2.400 . 3.100 2.145 2.133 2.157 . 0 0 "[ . 1 .]" 1
1247 1 65 ILE HB 1 65 ILE MD 2.100 . 2.700 2.452 2.367 2.536 . 0 0 "[ . 1 .]" 1
1248 1 65 ILE HB 1 65 ILE HG12 2.800 . 3.800 3.029 3.026 3.031 . 0 0 "[ . 1 .]" 1
1249 1 65 ILE HB 1 65 ILE HG13 2.700 . 3.600 2.448 2.407 2.480 . 0 0 "[ . 1 .]" 1
1250 1 65 ILE HB 1 65 ILE HG13 2.200 . 2.800 2.031 1.955 2.116 . 0 0 "[ . 1 .]" 1
1251 1 65 ILE HB 1 65 ILE MG 2.200 . 2.800 2.113 2.085 2.130 . 0 0 "[ . 1 .]" 1
1252 1 65 ILE HB 1 77 TYR HA 2.800 . 5.500 5.286 5.013 5.509 0.009 9 0 "[ . 1 .]" 1
1253 1 65 ILE HB 1 77 TYR HB2 2.700 . 3.600 2.539 2.112 2.766 . 0 0 "[ . 1 .]" 1
1254 1 65 ILE HB 1 77 TYR HB3 3.000 . 4.100 3.332 3.001 3.922 . 0 0 "[ . 1 .]" 1
1255 1 65 ILE HB 1 77 TYR QD 3.500 . 5.000 4.012 3.498 4.509 . 0 0 "[ . 1 .]" 1
1256 1 65 ILE HB 1 93 LEU QD 2.600 . 5.500 3.564 2.944 4.328 . 0 0 "[ . 1 .]" 1
1257 1 65 ILE MD 1 65 ILE HG12 2.300 . 3.000 2.109 2.082 2.119 . 0 0 "[ . 1 .]" 1
1258 1 65 ILE MD 1 65 ILE HG13 2.200 . 2.800 2.109 2.081 2.119 . 0 0 "[ . 1 .]" 1
1259 1 65 ILE MD 1 65 ILE MG 1.900 . 2.400 1.866 1.700 2.075 . 0 0 "[ . 1 .]" 1
1260 1 65 ILE MD 1 77 TYR HB2 2.900 . 4.000 3.522 3.191 3.957 . 0 0 "[ . 1 .]" 1
1261 1 65 ILE MD 1 77 TYR QD 2.900 . 4.000 3.741 3.596 3.848 . 0 0 "[ . 1 .]" 1
1262 1 65 ILE MD 1 84 TRP HD1 2.900 . 4.000 3.240 3.004 3.743 . 0 0 "[ . 1 .]" 1
1263 1 65 ILE MD 1 84 TRP HE1 3.300 . 4.700 3.466 3.165 3.739 . 0 0 "[ . 1 .]" 1
1264 1 65 ILE MD 1 84 TRP HZ2 2.800 . 3.800 3.357 3.023 3.611 . 0 0 "[ . 1 .]" 1
1265 1 65 ILE MD 1 93 LEU QD 2.500 . 3.300 2.891 2.425 3.138 . 0 0 "[ . 1 .]" 1
1266 1 65 ILE HG12 1 65 ILE MG 2.100 . 2.700 2.435 2.348 2.512 . 0 0 "[ . 1 .]" 1
1267 1 65 ILE HG12 1 66 TRP H 2.700 . 5.500 4.207 3.829 4.392 . 0 0 "[ . 1 .]" 1
1268 1 65 ILE HG13 1 65 ILE MG 2.100 . 5.500 2.807 2.066 2.902 . 0 0 "[ . 1 .]" 1
1269 1 65 ILE MG 1 67 LEU HB2 3.000 . 4.100 3.489 3.101 3.740 . 0 0 "[ . 1 .]" 1
1270 1 65 ILE MG 1 77 TYR HB2 2.800 . 3.800 3.098 2.851 3.453 . 0 0 "[ . 1 .]" 1
1271 1 65 ILE MG 1 77 TYR QD 2.700 . 3.600 3.153 2.440 3.620 0.020 9 0 "[ . 1 .]" 1
1272 1 65 ILE MG 1 93 LEU QD 2.100 . 2.700 2.213 1.797 2.675 . 0 0 "[ . 1 .]" 1
1273 1 66 TRP H 1 66 TRP QB 3.000 . 4.100 2.250 2.184 2.351 . 0 0 "[ . 1 .]" 1
1274 1 66 TRP HA 1 66 TRP HD1 2.600 . 3.400 2.724 2.240 3.282 . 0 0 "[ . 1 .]" 1
1275 1 66 TRP HA 1 67 LEU H 2.400 . 3.100 2.158 2.125 2.243 . 0 0 "[ . 1 .]" 1
1276 1 66 TRP HA 1 76 ARG HA 2.500 . 3.300 2.885 2.205 3.209 . 0 0 "[ . 1 .]" 1
1277 1 66 TRP HA 1 77 TYR H 3.200 . 4.500 3.378 2.915 4.077 . 0 0 "[ . 1 .]" 1
1278 1 66 TRP HA 1 77 TYR QD 2.900 . 4.000 3.920 3.469 4.063 0.063 2 0 "[ . 1 .]" 1
1279 1 66 TRP QB 1 66 TRP HE3 2.800 . 3.800 2.460 2.372 2.615 . 0 0 "[ . 1 .]" 1
1280 1 66 TRP HB3 1 67 LEU H 3.500 . 5.000 3.181 2.851 3.379 . 0 0 "[ . 1 .]" 1
1281 1 66 TRP HD1 1 76 ARG HA 2.700 . 3.600 3.104 2.382 3.622 0.022 10 0 "[ . 1 .]" 1
1282 1 66 TRP HE1 1 76 ARG HB3 3.300 . 4.700 4.037 2.630 5.632 0.932 3 2 "[ + . 1 -.]" 1
1283 1 67 LEU H 1 67 LEU HA 3.000 . 4.100 2.945 2.934 2.950 . 0 0 "[ . 1 .]" 1
1284 1 67 LEU H 1 67 LEU HB2 3.100 . 4.300 3.092 3.015 3.292 . 0 0 "[ . 1 .]" 1
1285 1 67 LEU H 1 67 LEU HB3 2.900 . 4.000 2.601 2.517 2.681 . 0 0 "[ . 1 .]" 1
1286 1 67 LEU H 1 67 LEU MD2 3.300 . 4.700 4.174 4.155 4.192 . 0 0 "[ . 1 .]" 1
1287 1 67 LEU H 1 75 LYS H 3.100 . 4.300 2.170 1.883 2.580 0.017 1 0 "[ . 1 .]" 1
1288 1 67 LEU H 1 77 TYR HB2 3.200 . 5.500 5.133 4.856 5.521 0.021 4 0 "[ . 1 .]" 1
1289 1 67 LEU HA 1 67 LEU HB2 2.400 . 3.100 2.442 2.405 2.462 . 0 0 "[ . 1 .]" 1
1290 1 67 LEU HA 1 67 LEU HB3 2.600 . 3.400 3.021 3.017 3.024 . 0 0 "[ . 1 .]" 1
1291 1 67 LEU HA 1 67 LEU MD2 2.200 . 2.800 1.969 1.880 2.138 . 0 0 "[ . 1 .]" 1
1292 1 67 LEU HA 1 68 SER H 2.200 . 2.800 2.192 2.141 2.221 . 0 0 "[ . 1 .]" 1
1293 1 67 LEU HB2 1 67 LEU MD2 2.300 . 3.000 2.685 2.647 2.740 . 0 0 "[ . 1 .]" 1
1294 1 67 LEU HB2 1 67 LEU HG 2.400 . 3.100 2.263 2.245 2.286 . 0 0 "[ . 1 .]" 1
1295 1 67 LEU HB2 1 77 TYR QD 3.000 . 4.100 2.733 2.366 3.140 . 0 0 "[ . 1 .]" 1
1296 1 67 LEU HB2 1 77 TYR QE 2.700 . 3.600 2.460 2.072 2.953 . 0 0 "[ . 1 .]" 1
1297 1 67 LEU HB2 1 93 LEU QD 2.800 . 3.800 2.587 2.025 3.531 . 0 0 "[ . 1 .]" 1
1298 1 67 LEU HB3 1 67 LEU MD2 2.400 . 5.500 3.149 3.128 3.168 . 0 0 "[ . 1 .]" 1
1299 1 67 LEU HB3 1 67 LEU HG 2.600 . 3.400 2.662 2.612 2.701 . 0 0 "[ . 1 .]" 1
1300 1 67 LEU HB3 1 75 LYS H 3.300 . 4.700 3.446 2.943 3.868 . 0 0 "[ . 1 .]" 1
1301 1 67 LEU HB3 1 77 TYR QD 3.000 . 4.100 3.050 2.614 3.636 . 0 0 "[ . 1 .]" 1
1302 1 67 LEU HB3 1 77 TYR QE 2.700 . 3.600 2.085 1.789 2.392 0.011 9 0 "[ . 1 .]" 1
1303 1 67 LEU HB3 1 93 LEU QD 2.700 . 3.600 3.156 2.933 3.535 . 0 0 "[ . 1 .]" 1
1304 1 67 LEU MD1 1 68 SER HB2 2.700 . 5.500 4.357 3.981 4.641 . 0 0 "[ . 1 .]" 1
1305 1 67 LEU QD 1 68 SER HA 2.800 . 3.800 3.483 3.281 3.598 . 0 0 "[ . 1 .]" 1
1306 1 67 LEU QD 1 69 SER HA 2.700 . 3.600 3.175 2.974 3.447 . 0 0 "[ . 1 .]" 1
1307 1 67 LEU QD 1 93 LEU HA 2.800 . 5.500 4.319 3.932 4.642 . 0 0 "[ . 1 .]" 1
1308 1 67 LEU QD 1 96 LEU HA 2.400 . 5.500 5.554 5.477 5.634 0.134 11 0 "[ . 1 .]" 1
1309 1 67 LEU QD 1 97 LEU QD 2.200 . 2.800 2.022 1.601 2.316 . 0 0 "[ . 1 .]" 1
1310 1 67 LEU MD1 1 69 SER QB 2.500 . 3.300 2.052 1.891 2.358 . 0 0 "[ . 1 .]" 1
1311 1 67 LEU MD1 1 75 LYS HA 2.700 . 5.500 4.792 4.598 5.085 . 0 0 "[ . 1 .]" 1
1312 1 67 LEU MD1 1 75 LYS QB 2.700 . 3.300 2.478 2.244 2.608 . 0 0 "[ . 1 .]" 1
1313 1 67 LEU MD1 1 75 LYS QB 2.800 . 3.800 2.353 1.983 2.497 . 0 0 "[ . 1 .]" 1
1314 1 67 LEU MD1 1 75 LYS QE 2.900 . 4.000 2.885 2.450 3.508 . 0 0 "[ . 1 .]" 1
1315 1 67 LEU MD1 1 77 TYR QE 2.500 . 3.300 2.697 2.002 3.181 . 0 0 "[ . 1 .]" 1
1316 1 67 LEU MD1 1 93 LEU HA 2.700 . 3.600 3.407 3.212 3.552 . 0 0 "[ . 1 .]" 1
1317 1 67 LEU HG 1 93 LEU QD 2.800 . 3.800 2.301 1.877 3.359 . 0 0 "[ . 1 .]" 1
1318 1 68 SER H 1 68 SER HB2 2.600 . 3.400 2.447 2.161 2.770 . 0 0 "[ . 1 .]" 1
1319 1 68 SER H 1 68 SER HB3 2.800 . 3.800 2.799 2.577 3.297 . 0 0 "[ . 1 .]" 1
1320 1 68 SER HA 1 68 SER HB2 2.400 . 3.100 2.624 2.498 2.888 . 0 0 "[ . 1 .]" 1
1321 1 68 SER HA 1 68 SER HB3 2.300 . 5.500 2.989 2.816 3.029 . 0 0 "[ . 1 .]" 1
1322 1 68 SER HA 1 69 SER H 2.400 . 3.100 2.190 2.134 2.247 . 0 0 "[ . 1 .]" 1
1323 1 68 SER HA 1 74 PRO HA 2.000 . 2.500 1.886 1.514 2.205 . 0 0 "[ . 1 .]" 1
1324 1 68 SER HA 1 74 PRO HB3 2.800 . 3.800 3.681 3.179 3.831 0.031 1 0 "[ . 1 .]" 1
1325 1 68 SER HA 1 74 PRO QG 2.500 . 5.500 4.145 3.419 4.921 . 0 0 "[ . 1 .]" 1
1326 1 68 SER HA 1 75 LYS H 2.900 . 4.000 3.466 2.934 3.746 . 0 0 "[ . 1 .]" 1
1327 1 68 SER HB2 1 69 SER H 3.300 . 4.700 4.577 4.411 4.663 . 0 0 "[ . 1 .]" 1
1328 1 68 SER HB2 1 73 GLY HA2 2.500 . 5.500 5.282 5.078 5.499 . 0 0 "[ . 1 .]" 1
1329 1 68 SER HB2 1 74 PRO HA 2.800 . 3.800 3.502 3.235 3.773 . 0 0 "[ . 1 .]" 1
1330 1 68 SER HB2 1 74 PRO QG 2.500 . 5.500 4.599 3.569 5.510 0.010 4 0 "[ . 1 .]" 1
1331 1 68 SER HB3 1 69 SER H 3.300 . 4.700 4.276 4.064 4.396 . 0 0 "[ . 1 .]" 1
1332 1 68 SER HB3 1 74 PRO HA 3.100 . 5.500 4.513 3.825 4.756 . 0 0 "[ . 1 .]" 1
1333 1 69 SER H 1 69 SER QB 2.600 . 4.100 2.494 2.239 2.968 . 0 0 "[ . 1 .]" 1
1334 1 69 SER H 1 73 GLY H 3.300 . 4.700 3.387 3.031 3.728 . 0 0 "[ . 1 .]" 1
1335 1 69 SER H 1 74 PRO HA 3.000 . 4.100 3.414 3.051 3.724 . 0 0 "[ . 1 .]" 1
1336 1 69 SER HA 1 69 SER QB 2.600 . 3.400 2.255 2.172 2.337 . 0 0 "[ . 1 .]" 1
1337 1 69 SER HA 1 70 PRO HD2 2.300 . 3.000 2.843 2.680 2.956 . 0 0 "[ . 1 .]" 1
1338 1 69 SER HA 1 70 PRO HD3 2.400 . 3.100 1.837 1.794 1.887 . 0 0 "[ . 1 .]" 1
1339 1 69 SER HA 1 70 PRO HG2 3.000 . 5.500 4.446 4.406 4.497 . 0 0 "[ . 1 .]" 1
1340 1 69 SER HA 1 70 PRO HG3 3.000 . 4.100 3.942 3.824 4.044 . 0 0 "[ . 1 .]" 1
1341 1 69 SER QB 1 71 SER H 3.400 . 4.500 2.926 2.242 3.242 . 0 0 "[ . 1 .]" 1
1342 1 69 SER QB 1 72 SER H 2.600 . 3.400 3.170 2.817 3.352 . 0 0 "[ . 1 .]" 1
1343 1 69 SER QB 1 73 GLY H 2.800 . 3.800 3.102 2.371 3.685 . 0 0 "[ . 1 .]" 1
1344 1 69 SER QB 1 96 LEU QD 2.300 . 3.000 2.677 2.424 2.875 . 0 0 "[ . 1 .]" 1
1345 1 70 PRO HA 1 70 PRO HB3 2.200 . 2.800 2.272 2.264 2.280 . 0 0 "[ . 1 .]" 1
1346 1 70 PRO HA 1 70 PRO HD2 3.100 . 4.300 3.917 3.899 3.928 . 0 0 "[ . 1 .]" 1
1347 1 70 PRO HA 1 70 PRO HD3 2.900 . 4.000 3.851 3.782 3.926 . 0 0 "[ . 1 .]" 1
1348 1 70 PRO HA 1 70 PRO HG2 2.800 . 5.500 4.008 3.973 4.049 . 0 0 "[ . 1 .]" 1
1349 1 70 PRO HA 1 70 PRO HG3 2.700 . 3.600 3.165 3.083 3.278 . 0 0 "[ . 1 .]" 1
1350 1 70 PRO HA 1 71 SER H 3.000 . 4.100 3.295 3.010 3.374 . 0 0 "[ . 1 .]" 1
1351 1 70 PRO HA 1 73 GLY HA2 1.500 . 5.500 4.395 4.062 4.849 . 0 0 "[ . 1 .]" 1
1352 1 70 PRO QB 1 71 SER H 3.400 . 4.800 3.485 3.322 3.851 . 0 0 "[ . 1 .]" 1
1353 1 70 PRO HB2 1 70 PRO HG3 2.600 . 3.400 2.983 2.974 2.989 . 0 0 "[ . 1 .]" 1
1354 1 70 PRO HB3 1 70 PRO HG2 2.600 . 3.400 2.691 2.674 2.714 . 0 0 "[ . 1 .]" 1
1355 1 70 PRO HD2 1 70 PRO HG2 2.700 . 3.600 2.323 2.317 2.328 . 0 0 "[ . 1 .]" 1
1356 1 70 PRO HD2 1 70 PRO HG3 2.600 . 3.400 2.996 2.993 2.999 . 0 0 "[ . 1 .]" 1
1357 1 70 PRO HD2 1 71 SER H 2.800 . 3.800 2.971 2.837 3.518 . 0 0 "[ . 1 .]" 1
1358 1 70 PRO HD3 1 70 PRO HG2 2.700 . 3.600 2.676 2.671 2.682 . 0 0 "[ . 1 .]" 1
1359 1 70 PRO HD3 1 70 PRO HG3 2.600 . 3.400 2.320 2.316 2.323 . 0 0 "[ . 1 .]" 1
1360 1 70 PRO HD3 1 71 SER H 3.100 . 4.300 3.899 3.804 4.201 . 0 0 "[ . 1 .]" 1
1361 1 70 PRO QG 1 71 SER H 2.900 . 5.500 4.215 4.115 4.537 . 0 0 "[ . 1 .]" 1
1362 1 70 PRO HG3 1 71 SER H 3.300 . 5.500 4.809 4.739 5.052 . 0 0 "[ . 1 .]" 1
1363 1 71 SER H 1 71 SER HA 2.600 . 3.400 2.915 2.852 2.946 . 0 0 "[ . 1 .]" 1
1364 1 71 SER H 1 71 SER QB 2.900 . 3.600 2.488 2.251 2.747 . 0 0 "[ . 1 .]" 1
1365 1 71 SER H 1 72 SER H 2.400 . 3.100 2.672 2.346 3.040 . 0 0 "[ . 1 .]" 1
1366 1 71 SER H 1 73 GLY H 2.600 . 3.400 3.161 2.606 3.420 0.020 13 0 "[ . 1 .]" 1
1367 1 71 SER HA 1 71 SER QB 2.000 . 2.500 2.324 2.235 2.375 . 0 0 "[ . 1 .]" 1
1368 1 71 SER HA 1 72 SER H 3.100 . 4.300 3.563 3.538 3.573 . 0 0 "[ . 1 .]" 1
1369 1 71 SER QB 1 72 SER H 3.000 . 4.100 1.992 1.888 2.189 0.012 9 0 "[ . 1 .]" 1
1370 1 71 SER QB 1 73 GLY H 3.100 . 4.300 3.860 3.592 4.101 . 0 0 "[ . 1 .]" 1
1371 1 72 SER H 1 72 SER HB2 3.100 . 4.300 3.373 2.251 3.754 . 0 0 "[ . 1 .]" 1
1372 1 72 SER H 1 72 SER HB3 3.200 . 4.500 2.832 2.305 3.282 . 0 0 "[ . 1 .]" 1
1373 1 72 SER H 1 73 GLY H 2.600 . 3.400 2.234 1.990 2.640 . 0 0 "[ . 1 .]" 1
1374 1 72 SER HA 1 72 SER HB2 2.100 . 2.700 2.513 2.284 2.828 0.128 11 0 "[ . 1 .]" 1
1375 1 72 SER HA 1 72 SER HB3 2.100 . 2.700 2.568 2.328 2.822 0.122 11 0 "[ . 1 .]" 1
1376 1 72 SER HA 1 73 GLY H 3.400 . 4.800 3.434 3.201 3.530 . 0 0 "[ . 1 .]" 1
1377 1 72 SER HB3 1 73 GLY H 3.100 . 4.300 3.774 3.216 4.261 . 0 0 "[ . 1 .]" 1
1378 1 73 GLY H 1 73 GLY HA2 2.500 . 3.300 2.431 2.298 2.509 . 0 0 "[ . 1 .]" 1
1379 1 73 GLY H 1 73 GLY HA3 2.400 . 3.100 2.932 2.801 2.959 . 0 0 "[ . 1 .]" 1
1380 1 74 PRO HA 1 74 PRO HB2 2.500 . 3.300 2.861 2.719 2.972 . 0 0 "[ . 1 .]" 1
1381 1 74 PRO HA 1 74 PRO HB3 2.300 . 3.000 2.286 2.274 2.295 . 0 0 "[ . 1 .]" 1
1382 1 74 PRO HA 1 75 LYS H 2.200 . 2.800 2.215 2.144 2.310 . 0 0 "[ . 1 .]" 1
1383 1 74 PRO HB2 1 75 LYS H 3.000 . 4.100 3.476 3.100 3.694 . 0 0 "[ . 1 .]" 1
1384 1 74 PRO HB3 1 75 LYS H 3.200 . 4.500 3.491 2.987 4.045 . 0 0 "[ . 1 .]" 1
1385 1 74 PRO HD2 1 74 PRO QG 2.300 . 3.000 2.216 2.185 2.246 . 0 0 "[ . 1 .]" 1
1386 1 75 LYS H 1 75 LYS HA 2.900 . 4.000 2.940 2.927 2.949 . 0 0 "[ . 1 .]" 1
1387 1 75 LYS H 1 75 LYS QB 2.900 . 4.000 2.600 2.427 2.732 . 0 0 "[ . 1 .]" 1
1388 1 75 LYS H 1 75 LYS QD 3.000 . 5.500 4.451 3.857 4.736 . 0 0 "[ . 1 .]" 1
1389 1 75 LYS HA 1 75 LYS QB 2.500 . 2.800 2.397 2.321 2.532 . 0 0 "[ . 1 .]" 1
1390 1 75 LYS HA 1 75 LYS HD2 2.900 . 4.000 2.939 2.454 3.408 . 0 0 "[ . 1 .]" 1
1391 1 75 LYS HA 1 75 LYS HD3 2.600 . 3.400 3.277 2.664 3.418 0.018 12 0 "[ . 1 .]" 1
1392 1 75 LYS HA 1 75 LYS QG 2.500 . 3.300 2.551 2.257 2.778 . 0 0 "[ . 1 .]" 1
1393 1 75 LYS HA 1 76 ARG H 2.300 . 3.000 2.240 2.134 2.503 . 0 0 "[ . 1 .]" 1
1394 1 75 LYS HA 1 86 TYR QE 2.900 . 5.500 3.883 2.567 5.447 . 0 0 "[ . 1 .]" 1
1395 1 75 LYS QB 1 75 LYS HD2 2.900 . 3.100 2.222 1.945 3.387 0.287 9 0 "[ . 1 .]" 1
1396 1 75 LYS QB 1 75 LYS HD3 2.300 . 5.500 3.102 2.082 3.348 . 0 0 "[ . 1 .]" 1
1397 1 75 LYS QB 1 75 LYS QE 2.500 . 3.300 2.846 2.501 3.013 . 0 0 "[ . 1 .]" 1
1398 1 75 LYS QB 1 76 ARG H 2.800 . 3.800 3.026 2.593 3.491 . 0 0 "[ . 1 .]" 1
1399 1 75 LYS QB 1 77 TYR QD 3.200 . 4.500 3.122 2.280 3.818 . 0 0 "[ . 1 .]" 1
1400 1 75 LYS QB 1 77 TYR QE 2.700 . 3.600 2.596 2.185 3.351 . 0 0 "[ . 1 .]" 1
1401 1 75 LYS HD2 1 76 ARG HB2 2.300 . 5.500 4.887 3.794 5.507 0.007 7 0 "[ . 1 .]" 1
1402 1 75 LYS HD2 1 96 LEU QD 2.300 . 5.500 4.685 3.753 5.040 . 0 0 "[ . 1 .]" 1
1403 1 75 LYS HD3 1 75 LYS QE 2.300 . 3.000 2.133 1.728 2.326 . 0 0 "[ . 1 .]" 1
1404 1 75 LYS QE 1 75 LYS QG 2.700 . 3.600 2.072 1.936 2.274 . 0 0 "[ . 1 .]" 1
1405 1 75 LYS QE 1 96 LEU QD 2.300 . 3.000 2.558 1.767 2.830 . 0 0 "[ . 1 .]" 1
1406 1 76 ARG H 1 76 ARG HB2 3.000 . 4.100 2.639 2.352 3.476 . 0 0 "[ . 1 .]" 1
1407 1 76 ARG H 1 76 ARG HB3 3.100 . 4.300 3.522 2.783 3.947 . 0 0 "[ . 1 .]" 1
1408 1 76 ARG H 1 76 ARG HG2 3.100 . 4.300 3.917 1.882 4.712 0.412 14 0 "[ . 1 .]" 1
1409 1 76 ARG H 1 86 TYR QD 2.900 . 4.000 3.622 2.118 4.014 0.014 15 0 "[ . 1 .]" 1
1410 1 76 ARG H 1 86 TYR QE 2.900 . 4.000 2.704 1.786 4.029 0.029 4 0 "[ . 1 .]" 1
1411 1 76 ARG HA 1 76 ARG HB2 2.700 . 3.600 2.930 2.623 3.026 . 0 0 "[ . 1 .]" 1
1412 1 76 ARG HA 1 76 ARG HB3 2.800 . 3.800 2.536 2.258 2.997 . 0 0 "[ . 1 .]" 1
1413 1 76 ARG HA 1 76 ARG HG2 2.800 . 3.800 2.912 2.658 3.484 . 0 0 "[ . 1 .]" 1
1414 1 76 ARG HA 1 76 ARG HG3 2.900 . 4.000 2.855 2.285 3.839 . 0 0 "[ . 1 .]" 1
1415 1 76 ARG HB2 1 76 ARG HD2 2.500 . 3.300 2.610 2.158 3.185 . 0 0 "[ . 1 .]" 1
1416 1 76 ARG HB2 1 76 ARG HD3 2.700 . 3.600 2.861 1.993 3.755 0.155 3 0 "[ . 1 .]" 1
1417 1 76 ARG HB2 1 76 ARG HG3 2.900 . 4.000 2.569 2.357 2.952 . 0 0 "[ . 1 .]" 1
1418 1 76 ARG HB3 1 76 ARG HD2 2.600 . 3.400 3.194 2.282 3.955 0.555 11 2 "[ . 1+ -]" 1
1419 1 76 ARG HB3 1 76 ARG HD3 2.900 . 4.000 2.880 2.286 3.459 . 0 0 "[ . 1 .]" 1
1420 1 76 ARG HB3 1 76 ARG HG3 2.900 . 4.000 2.963 2.681 3.011 . 0 0 "[ . 1 .]" 1
1421 1 76 ARG HD2 1 76 ARG HG2 2.500 . 3.300 2.925 2.724 3.015 . 0 0 "[ . 1 .]" 1
1422 1 76 ARG HD2 1 76 ARG HG3 2.600 . 3.400 2.497 2.220 2.929 . 0 0 "[ . 1 .]" 1
1423 1 76 ARG HD3 1 76 ARG HG2 2.600 . 3.400 2.481 2.219 2.876 . 0 0 "[ . 1 .]" 1
1424 1 76 ARG HD3 1 76 ARG HG3 2.800 . 3.800 2.925 2.728 3.014 . 0 0 "[ . 1 .]" 1
1425 1 77 TYR H 1 77 TYR HA 2.600 . 3.400 2.861 2.690 2.948 . 0 0 "[ . 1 .]" 1
1426 1 77 TYR H 1 77 TYR HB2 2.700 . 3.600 2.380 2.217 2.685 . 0 0 "[ . 1 .]" 1
1427 1 77 TYR H 1 77 TYR HB3 3.000 . 4.100 3.598 3.514 3.785 . 0 0 "[ . 1 .]" 1
1428 1 77 TYR H 1 77 TYR QD 2.500 . 3.300 2.810 1.698 3.257 0.002 9 0 "[ . 1 .]" 1
1429 1 77 TYR H 1 77 TYR QE 3.100 . 5.500 4.904 3.911 5.512 0.012 4 0 "[ . 1 .]" 1
1430 1 77 TYR HA 1 77 TYR HB2 2.700 . 3.600 3.006 2.988 3.025 . 0 0 "[ . 1 .]" 1
1431 1 77 TYR HA 1 77 TYR HB3 2.600 . 3.400 2.598 2.548 2.645 . 0 0 "[ . 1 .]" 1
1432 1 77 TYR HA 1 77 TYR QD 2.500 . 3.300 2.646 2.196 3.132 . 0 0 "[ . 1 .]" 1
1433 1 77 TYR HA 1 86 TYR HA 2.500 . 3.300 3.104 2.789 3.409 0.109 9 0 "[ . 1 .]" 1
1434 1 77 TYR HB2 1 77 TYR QD 2.700 . 3.600 2.333 2.271 2.557 . 0 0 "[ . 1 .]" 1
1435 1 77 TYR HB3 1 77 TYR QD 2.700 . 3.600 2.509 2.293 2.677 . 0 0 "[ . 1 .]" 1
1436 1 77 TYR HB3 1 78 ASP H 3.400 . 4.800 3.197 2.872 3.596 . 0 0 "[ . 1 .]" 1
1437 1 77 TYR HB3 1 84 TRP HA 2.700 . 5.500 3.900 3.463 4.333 . 0 0 "[ . 1 .]" 1
1438 1 77 TYR QD 1 78 ASP H 3.400 . 4.800 3.547 3.241 4.123 . 0 0 "[ . 1 .]" 1
1439 1 77 TYR QD 1 84 TRP HB3 3.000 . 5.500 3.784 3.337 4.080 . 0 0 "[ . 1 .]" 1
1440 1 77 TYR QD 1 84 TRP HE3 3.200 . 4.500 4.110 4.014 4.161 . 0 0 "[ . 1 .]" 1
1441 1 77 TYR QD 1 85 VAL HA 2.500 . 3.300 2.370 2.013 2.771 . 0 0 "[ . 1 .]" 1
1442 1 77 TYR QD 1 93 LEU H 3.100 . 4.300 3.629 3.109 4.201 . 0 0 "[ . 1 .]" 1
1443 1 77 TYR QD 1 93 LEU QD 3.000 . 5.500 3.187 2.826 3.936 . 0 0 "[ . 1 .]" 1
1444 1 77 TYR QE 1 85 VAL H 3.200 . 5.500 5.404 4.982 5.526 0.026 14 0 "[ . 1 .]" 1
1445 1 77 TYR QE 1 85 VAL HA 2.800 . 3.800 2.892 2.479 3.121 . 0 0 "[ . 1 .]" 1
1446 1 77 TYR QE 1 86 TYR H 3.100 . 4.300 2.797 2.297 3.162 . 0 0 "[ . 1 .]" 1
1447 1 77 TYR QE 1 93 LEU H 3.500 . 5.000 3.298 2.757 3.786 . 0 0 "[ . 1 .]" 1
1448 1 77 TYR QE 1 93 LEU HA 2.700 . 3.600 3.028 2.786 3.189 . 0 0 "[ . 1 .]" 1
1449 1 77 TYR QE 1 93 LEU QD 2.500 . 3.300 2.999 2.638 3.262 . 0 0 "[ . 1 .]" 1
1450 1 78 ASP H 1 78 ASP HB2 2.900 . 4.000 2.484 2.270 2.926 . 0 0 "[ . 1 .]" 1
1451 1 78 ASP H 1 78 ASP HB3 2.800 . 3.800 3.441 2.799 3.829 0.029 8 0 "[ . 1 .]" 1
1452 1 78 ASP HA 1 78 ASP HB2 2.400 . 3.100 2.911 2.600 3.026 . 0 0 "[ . 1 .]" 1
1453 1 78 ASP HA 1 78 ASP HB3 2.500 . 3.300 2.706 2.324 3.006 . 0 0 "[ . 1 .]" 1
1454 1 78 ASP HA 1 79 TRP H 2.500 . 3.300 2.430 2.345 2.582 . 0 0 "[ . 1 .]" 1
1455 1 78 ASP HA 1 84 TRP HE3 2.800 . 3.800 3.354 2.904 3.738 . 0 0 "[ . 1 .]" 1
1456 1 78 ASP HB2 1 79 TRP H 2.900 . 4.000 3.808 3.182 4.035 0.035 13 0 "[ . 1 .]" 1
1457 1 79 TRP H 1 79 TRP HA 2.900 . 4.000 2.886 2.878 2.926 . 0 0 "[ . 1 .]" 1
1458 1 79 TRP H 1 79 TRP HB2 2.800 . 3.800 2.718 2.615 2.868 . 0 0 "[ . 1 .]" 1
1459 1 79 TRP H 1 79 TRP HB3 3.000 . 4.100 2.457 2.377 2.531 . 0 0 "[ . 1 .]" 1
1460 1 79 TRP H 1 84 TRP HZ3 3.400 . 4.800 3.986 3.500 4.368 . 0 0 "[ . 1 .]" 1
1461 1 79 TRP HA 1 79 TRP HB2 2.500 . 3.300 2.443 2.407 2.484 . 0 0 "[ . 1 .]" 1
1462 1 79 TRP HA 1 79 TRP HB3 2.800 . 3.800 3.027 3.025 3.028 . 0 0 "[ . 1 .]" 1
1463 1 79 TRP HA 1 79 TRP HE3 2.300 . 3.000 2.558 2.305 2.833 . 0 0 "[ . 1 .]" 1
1464 1 79 TRP HA 1 84 TRP HA 2.500 . 3.300 2.800 2.564 2.972 . 0 0 "[ . 1 .]" 1
1465 1 79 TRP HA 1 84 TRP HE3 3.100 . 4.300 3.452 3.042 3.862 . 0 0 "[ . 1 .]" 1
1466 1 79 TRP HB2 1 79 TRP HD1 2.900 . 4.000 3.692 3.625 3.756 . 0 0 "[ . 1 .]" 1
1467 1 79 TRP HB3 1 79 TRP HD1 2.600 . 3.400 2.439 2.337 2.543 . 0 0 "[ . 1 .]" 1
1468 1 79 TRP HE1 1 81 GLY HA2 3.300 . 4.700 4.684 4.402 4.717 0.017 10 0 "[ . 1 .]" 1
1469 1 79 TRP HE3 1 80 THR H 3.200 . 4.500 4.021 3.686 4.230 . 0 0 "[ . 1 .]" 1
1470 1 79 TRP HE3 1 84 TRP HA 3.000 . 4.100 3.791 3.516 4.023 . 0 0 "[ . 1 .]" 1
1471 1 79 TRP HH2 1 82 LYS HA 2.600 . 3.400 2.822 2.634 3.002 . 0 0 "[ . 1 .]" 1
1472 1 79 TRP HH2 1 116 TYR HB3 3.000 . 4.100 3.538 2.429 4.026 . 0 0 "[ . 1 .]" 1
1473 1 79 TRP HH2 1 116 TYR QD 2.700 . 3.600 3.211 2.592 3.604 0.004 8 0 "[ . 1 .]" 1
1474 1 79 TRP HZ2 1 82 LYS HA 2.600 . 3.400 2.418 2.253 2.544 . 0 0 "[ . 1 .]" 1
1475 1 79 TRP HZ3 1 83 ASN HA 2.600 . 3.400 3.282 3.136 3.416 0.016 4 0 "[ . 1 .]" 1
1476 1 79 TRP HZ3 1 84 TRP HD1 3.100 . 4.300 3.877 3.525 4.210 . 0 0 "[ . 1 .]" 1
1477 1 79 TRP HZ3 1 116 TYR QB 2.800 . 3.800 3.272 2.845 3.609 . 0 0 "[ . 1 .]" 1
1478 1 80 THR H 1 80 THR HA 2.700 . 3.600 2.943 2.933 2.946 . 0 0 "[ . 1 .]" 1
1479 1 80 THR H 1 80 THR HB 2.800 . 3.800 3.774 3.700 3.835 0.035 1 0 "[ . 1 .]" 1
1480 1 80 THR H 1 80 THR MG 2.500 . 3.300 2.660 2.421 2.872 . 0 0 "[ . 1 .]" 1
1481 1 80 THR H 1 83 ASN H 3.200 . 4.500 3.424 3.168 3.682 . 0 0 "[ . 1 .]" 1
1482 1 80 THR H 1 84 TRP HA 3.300 . 4.700 2.937 2.782 3.111 . 0 0 "[ . 1 .]" 1
1483 1 80 THR HA 1 80 THR HB 2.000 . 2.500 2.409 2.376 2.436 . 0 0 "[ . 1 .]" 1
1484 1 80 THR HA 1 80 THR MG 2.000 . 2.500 2.445 2.393 2.502 0.002 14 0 "[ . 1 .]" 1
1485 1 80 THR HB 1 80 THR MG 1.800 . 2.200 2.099 2.070 2.117 . 0 0 "[ . 1 .]" 1
1486 1 80 THR HB 1 80 THR MG 1.800 . 2.200 1.866 1.847 1.884 . 0 0 "[ . 1 .]" 1
1487 1 80 THR HB 1 85 VAL MG2 3.000 . 4.100 3.813 3.650 3.971 . 0 0 "[ . 1 .]" 1
1488 1 80 THR MG 1 83 ASN H 3.300 . 5.500 5.118 5.014 5.250 . 0 0 "[ . 1 .]" 1
1489 1 80 THR MG 1 84 TRP HA 2.800 . 3.800 3.805 3.744 3.821 0.021 10 0 "[ . 1 .]" 1
1490 1 80 THR MG 1 85 VAL H 3.000 . 4.100 2.495 2.331 2.711 . 0 0 "[ . 1 .]" 1
1491 1 80 THR MG 1 85 VAL HB 2.200 . 2.800 2.460 2.014 2.795 . 0 0 "[ . 1 .]" 1
1492 1 80 THR MG 1 85 VAL MG1 2.100 . 5.500 2.170 1.511 2.827 . 0 0 "[ . 1 .]" 1
1493 1 80 THR MG 1 85 VAL MG2 1.800 . 5.500 3.131 2.957 3.359 . 0 0 "[ . 1 .]" 1
1494 1 81 GLY H 1 82 LYS H 3.100 . 4.300 4.200 4.108 4.306 0.006 13 0 "[ . 1 .]" 1
1495 1 81 GLY H 1 83 ASN H 3.200 . 5.500 4.618 4.555 4.659 . 0 0 "[ . 1 .]" 1
1496 1 81 GLY HA3 1 82 LYS H 3.300 . 4.700 2.247 2.193 2.299 . 0 0 "[ . 1 .]" 1
1497 1 82 LYS H 1 82 LYS HA 3.000 . 4.100 2.932 2.918 2.944 . 0 0 "[ . 1 .]" 1
1498 1 82 LYS H 1 82 LYS QB 3.100 . 4.300 2.843 2.530 3.222 . 0 0 "[ . 1 .]" 1
1499 1 82 LYS H 1 82 LYS QD 3.300 . 4.700 3.365 2.386 4.608 . 0 0 "[ . 1 .]" 1
1500 1 82 LYS HA 1 82 LYS QB 2.000 . 2.500 2.338 2.164 2.533 0.033 12 0 "[ . 1 .]" 1
1501 1 82 LYS HA 1 83 ASN H 3.300 . 4.700 3.034 2.876 3.192 . 0 0 "[ . 1 .]" 1
1502 1 82 LYS QB 1 82 LYS HE2 2.900 . 4.000 3.542 2.892 3.968 . 0 0 "[ . 1 .]" 1
1503 1 82 LYS QB 1 82 LYS HG2 2.400 . 3.100 2.280 2.129 2.508 . 0 0 "[ . 1 .]" 1
1504 1 82 LYS QB 1 82 LYS HG3 2.400 . 3.100 2.326 2.132 2.526 . 0 0 "[ . 1 .]" 1
1505 1 82 LYS QB 1 83 ASN H 3.100 . 4.300 3.768 3.507 3.997 . 0 0 "[ . 1 .]" 1
1506 1 82 LYS QB 1 83 ASN HD22 3.300 . 4.700 3.798 2.962 4.700 . 0 0 "[ . 1 .]" 1
1507 1 82 LYS QD 1 83 ASN H 3.300 . 4.700 4.562 4.176 4.729 0.029 1 0 "[ . 1 .]" 1
1508 1 82 LYS QE 1 82 LYS HG2 2.600 . 3.400 2.629 1.970 3.142 . 0 0 "[ . 1 .]" 1
1509 1 82 LYS QG 1 83 ASN H 3.400 . 4.800 4.310 3.351 4.816 0.016 12 0 "[ . 1 .]" 1
1510 1 83 ASN H 1 83 ASN HA 2.900 . 4.000 2.895 2.871 2.927 . 0 0 "[ . 1 .]" 1
1511 1 83 ASN HA 1 83 ASN HB2 2.200 . 2.800 2.741 2.537 2.993 0.193 3 0 "[ . 1 .]" 1
1512 1 83 ASN HA 1 83 ASN HB3 2.300 . 3.000 2.313 2.236 2.732 . 0 0 "[ . 1 .]" 1
1513 1 83 ASN HA 1 84 TRP H 2.700 . 3.600 2.353 2.264 2.568 . 0 0 "[ . 1 .]" 1
1514 1 83 ASN HA 1 84 TRP HD1 2.800 . 3.800 3.446 3.250 3.768 . 0 0 "[ . 1 .]" 1
1515 1 83 ASN HB2 1 84 TRP H 3.200 . 4.500 2.836 2.135 3.797 . 0 0 "[ . 1 .]" 1
1516 1 83 ASN HB3 1 83 ASN HD21 2.600 . 3.400 2.560 2.114 3.541 0.141 12 0 "[ . 1 .]" 1
1517 1 83 ASN HB3 1 83 ASN HD22 2.800 . 3.800 3.634 3.433 4.091 0.291 12 0 "[ . 1 .]" 1
1518 1 83 ASN HB3 1 84 TRP H 2.800 . 3.800 3.318 2.354 3.801 0.001 9 0 "[ . 1 .]" 1
1519 1 84 TRP H 1 84 TRP HB2 2.800 . 3.800 2.651 2.570 2.715 . 0 0 "[ . 1 .]" 1
1520 1 84 TRP H 1 84 TRP HB3 3.100 . 4.300 3.658 3.617 3.730 . 0 0 "[ . 1 .]" 1
1521 1 84 TRP H 1 84 TRP HD1 3.100 . 4.300 2.273 2.037 2.720 . 0 0 "[ . 1 .]" 1
1522 1 84 TRP HA 1 84 TRP HB2 2.500 . 3.300 3.021 3.012 3.027 . 0 0 "[ . 1 .]" 1
1523 1 84 TRP HA 1 84 TRP HB3 2.600 . 3.400 2.392 2.355 2.434 . 0 0 "[ . 1 .]" 1
1524 1 84 TRP HA 1 84 TRP HE3 2.700 . 3.600 3.354 3.011 3.490 . 0 0 "[ . 1 .]" 1
1525 1 84 TRP HA 1 85 VAL H 2.400 . 3.100 2.154 2.139 2.212 . 0 0 "[ . 1 .]" 1
1526 1 84 TRP HA 1 85 VAL MG2 2.900 . 4.000 3.566 3.361 3.759 . 0 0 "[ . 1 .]" 1
1527 1 84 TRP HB2 1 84 TRP HD1 2.800 . 3.800 2.724 2.637 2.765 . 0 0 "[ . 1 .]" 1
1528 1 84 TRP HB2 1 84 TRP HE3 3.100 . 4.300 4.063 4.026 4.138 . 0 0 "[ . 1 .]" 1
1529 1 84 TRP HB2 1 93 LEU H 3.100 . 4.300 3.490 3.222 3.793 . 0 0 "[ . 1 .]" 1
1530 1 84 TRP HB2 1 93 LEU QD 2.700 . 3.600 3.175 2.275 3.541 . 0 0 "[ . 1 .]" 1
1531 1 84 TRP HB2 1 94 HIS H 3.400 . 4.800 4.703 4.337 4.820 0.020 9 0 "[ . 1 .]" 1
1532 1 84 TRP HB3 1 84 TRP HD1 3.200 . 4.500 3.846 3.793 3.865 . 0 0 "[ . 1 .]" 1
1533 1 84 TRP HB3 1 84 TRP HE3 2.900 . 4.000 2.509 2.471 2.616 . 0 0 "[ . 1 .]" 1
1534 1 84 TRP HD1 1 93 LEU QD 3.100 . 4.300 3.877 3.201 4.258 . 0 0 "[ . 1 .]" 1
1535 1 84 TRP HD1 1 94 HIS HE1 2.600 . 3.400 2.812 1.985 3.378 . 0 0 "[ . 1 .]" 1
1536 1 84 TRP HE1 1 116 TYR QD 3.500 . 5.000 3.982 3.432 4.462 . 0 0 "[ . 1 .]" 1
1537 1 85 VAL H 1 85 VAL HB 2.600 . 3.400 2.866 2.807 2.935 . 0 0 "[ . 1 .]" 1
1538 1 85 VAL H 1 85 VAL MG1 2.600 . 5.500 3.937 3.905 3.959 . 0 0 "[ . 1 .]" 1
1539 1 85 VAL H 1 85 VAL MG2 2.900 . 4.000 2.637 2.404 3.073 . 0 0 "[ . 1 .]" 1
1540 1 85 VAL HA 1 85 VAL HB 2.600 . 3.400 3.010 3.000 3.022 . 0 0 "[ . 1 .]" 1
1541 1 85 VAL HA 1 85 VAL MG1 2.300 . 3.000 2.265 2.096 2.442 . 0 0 "[ . 1 .]" 1
1542 1 85 VAL HA 1 85 VAL MG2 2.300 . 3.000 2.503 2.290 2.636 . 0 0 "[ . 1 .]" 1
1543 1 85 VAL HA 1 86 TYR H 2.500 . 3.300 2.331 2.176 2.406 . 0 0 "[ . 1 .]" 1
1544 1 85 VAL HA 1 92 SER HA 2.100 . 2.700 1.803 1.570 2.016 . 0 0 "[ . 1 .]" 1
1545 1 85 VAL HA 1 92 SER QB 2.700 . 3.300 3.076 2.787 3.257 . 0 0 "[ . 1 .]" 1
1546 1 85 VAL HA 1 93 LEU H 3.000 . 4.100 3.295 3.055 3.604 . 0 0 "[ . 1 .]" 1
1547 1 85 VAL HB 1 85 VAL MG1 2.100 . 2.700 2.100 2.083 2.127 . 0 0 "[ . 1 .]" 1
1548 1 85 VAL HB 1 85 VAL MG2 2.100 . 2.700 2.102 2.083 2.126 . 0 0 "[ . 1 .]" 1
1549 1 85 VAL HB 1 86 TYR H 2.900 . 4.000 3.524 3.305 4.004 0.004 9 0 "[ . 1 .]" 1
1550 1 85 VAL HB 1 92 SER HA 2.900 . 5.500 4.271 3.944 4.473 . 0 0 "[ . 1 .]" 1
1551 1 85 VAL MG1 1 90 GLY HA2 2.400 . 5.500 3.665 2.605 6.293 0.793 3 1 "[ + . 1 .]" 1
1552 1 85 VAL MG1 1 91 VAL H 3.100 . 4.300 3.434 2.261 4.305 0.005 4 0 "[ . 1 .]" 1
1553 1 85 VAL MG1 1 91 VAL HA 2.800 . 3.800 3.197 2.519 3.646 . 0 0 "[ . 1 .]" 1
1554 1 85 VAL MG1 1 91 VAL HA 2.400 . 3.100 2.575 2.255 2.905 . 0 0 "[ . 1 .]" 1
1555 1 85 VAL MG1 1 92 SER H 3.300 . 4.700 2.882 1.917 3.400 . 0 0 "[ . 1 .]" 1
1556 1 85 VAL MG1 1 92 SER HA 2.400 . 3.100 2.391 1.914 2.798 . 0 0 "[ . 1 .]" 1
1557 1 85 VAL MG1 1 92 SER QB 2.700 . 3.600 2.781 2.286 3.200 . 0 0 "[ . 1 .]" 1
1558 1 85 VAL MG2 1 86 TYR H 2.500 . 5.500 3.966 3.897 4.031 . 0 0 "[ . 1 .]" 1
1559 1 85 VAL MG2 1 91 VAL HA 2.800 . 5.500 4.871 4.478 5.449 . 0 0 "[ . 1 .]" 1
1560 1 85 VAL MG2 1 92 SER HA 2.300 . 3.000 2.778 2.428 3.011 0.011 14 0 "[ . 1 .]" 1
1561 1 85 VAL MG2 1 92 SER QB 2.500 . 3.300 1.873 1.686 2.064 0.014 4 0 "[ . 1 .]" 1
1562 1 86 TYR H 1 86 TYR HB2 2.900 . 4.000 2.644 2.265 3.182 . 0 0 "[ . 1 .]" 1
1563 1 86 TYR H 1 86 TYR HB3 2.800 . 3.800 2.788 2.468 3.024 . 0 0 "[ . 1 .]" 1
1564 1 86 TYR H 1 86 TYR QD 3.300 . 4.700 4.206 4.016 4.380 . 0 0 "[ . 1 .]" 1
1565 1 86 TYR H 1 91 VAL H 3.400 . 4.800 3.995 3.315 4.817 0.017 4 0 "[ . 1 .]" 1
1566 1 86 TYR H 1 92 SER HA 3.000 . 4.100 3.138 2.712 3.610 . 0 0 "[ . 1 .]" 1
1567 1 86 TYR HA 1 86 TYR HB2 2.700 . 3.600 2.592 2.454 2.732 . 0 0 "[ . 1 .]" 1
1568 1 86 TYR HA 1 86 TYR HB3 2.600 . 3.400 2.998 2.949 3.029 . 0 0 "[ . 1 .]" 1
1569 1 86 TYR HA 1 86 TYR QD 2.200 . 2.800 2.283 1.821 2.831 0.031 9 0 "[ . 1 .]" 1
1570 1 86 TYR HA 1 87 SER H 2.400 . 3.100 2.529 2.141 3.327 0.227 9 0 "[ . 1 .]" 1
1571 1 86 TYR HB2 1 86 TYR QD 2.500 . 3.300 2.599 2.275 2.770 . 0 0 "[ . 1 .]" 1
1572 1 86 TYR HB2 1 87 SER H 3.500 . 5.000 3.932 3.152 4.565 . 0 0 "[ . 1 .]" 1
1573 1 86 TYR HB3 1 86 TYR QD 2.400 . 3.100 2.424 2.275 2.732 . 0 0 "[ . 1 .]" 1
1574 1 86 TYR QD 1 87 SER H 2.700 . 3.600 2.723 1.801 3.613 0.013 4 0 "[ . 1 .]" 1
1575 1 86 TYR QD 1 89 ASP H 3.000 . 4.100 3.159 2.475 4.182 0.082 7 0 "[ . 1 .]" 1
1576 1 86 TYR QE 1 88 HIS HB2 2.400 . 3.100 2.476 2.043 3.402 0.302 4 0 "[ . 1 .]" 1
1577 1 86 TYR QE 1 88 HIS HB3 2.700 . 3.600 3.194 2.341 3.710 0.110 7 0 "[ . 1 .]" 1
1578 1 87 SER H 1 87 SER HA 2.800 . 3.800 2.818 2.265 2.946 . 0 0 "[ . 1 .]" 1
1579 1 87 SER H 1 87 SER QB 2.700 . 3.600 2.603 2.086 3.201 . 0 0 "[ . 1 .]" 1
1580 1 87 SER HA 1 89 ASP H 3.400 . 4.800 4.294 3.880 4.738 . 0 0 "[ . 1 .]" 1
1581 1 87 SER HA 1 90 GLY H 3.200 . 4.500 4.435 4.008 4.580 0.080 9 0 "[ . 1 .]" 1
1582 1 88 HIS H 1 88 HIS HA 3.000 . 4.100 2.757 2.257 2.946 . 0 0 "[ . 1 .]" 1
1583 1 88 HIS H 1 88 HIS HB2 2.900 . 4.000 2.848 2.226 3.491 . 0 0 "[ . 1 .]" 1
1584 1 88 HIS H 1 88 HIS HB3 3.100 . 4.300 3.393 2.877 4.027 . 0 0 "[ . 1 .]" 1
1585 1 88 HIS H 1 89 ASP H 3.400 . 4.800 2.406 1.985 4.048 0.015 6 0 "[ . 1 .]" 1
1586 1 88 HIS HA 1 88 HIS HB2 2.300 . 3.000 2.731 2.448 2.882 . 0 0 "[ . 1 .]" 1
1587 1 88 HIS HA 1 88 HIS HB3 2.300 . 3.000 2.921 2.819 3.025 0.025 12 0 "[ . 1 .]" 1
1588 1 88 HIS HA 1 89 ASP H 2.900 . 4.000 3.468 3.117 3.570 . 0 0 "[ . 1 .]" 1
1589 1 88 HIS HB2 1 88 HIS HD2 3.000 . 4.100 3.190 2.695 3.972 . 0 0 "[ . 1 .]" 1
1590 1 88 HIS HB2 1 89 ASP H 3.000 . 4.100 3.472 2.719 4.193 0.093 7 0 "[ . 1 .]" 1
1591 1 88 HIS HB3 1 88 HIS HD2 2.900 . 4.000 3.322 2.708 3.972 . 0 0 "[ . 1 .]" 1
1592 1 88 HIS HB3 1 89 ASP H 3.000 . 4.100 2.857 1.884 3.819 0.016 13 0 "[ . 1 .]" 1
1593 1 89 ASP H 1 89 ASP HA 2.700 . 3.600 2.896 2.740 2.947 . 0 0 "[ . 1 .]" 1
1594 1 89 ASP H 1 89 ASP HB2 3.100 . 4.300 3.097 2.503 4.033 . 0 0 "[ . 1 .]" 1
1595 1 89 ASP H 1 89 ASP HB3 2.900 . 4.000 3.349 2.648 3.877 . 0 0 "[ . 1 .]" 1
1596 1 89 ASP H 1 90 GLY H 2.200 . 2.800 2.035 1.583 2.364 0.017 4 0 "[ . 1 .]" 1
1597 1 89 ASP H 1 90 GLY HA2 3.200 . 4.500 4.208 3.939 4.497 . 0 0 "[ . 1 .]" 1
1598 1 89 ASP H 1 91 VAL H 3.400 . 4.800 4.062 3.527 4.876 0.076 4 0 "[ . 1 .]" 1
1599 1 89 ASP HA 1 89 ASP HB2 2.000 . 2.500 2.724 2.436 3.028 0.528 15 5 "[ * .* * 1- +]" 1
1600 1 89 ASP HA 1 89 ASP HB3 2.200 . 5.500 2.684 2.245 3.027 . 0 0 "[ . 1 .]" 1
1601 1 89 ASP HA 1 90 GLY H 3.000 . 4.100 3.348 2.793 3.574 . 0 0 "[ . 1 .]" 1
1602 1 89 ASP HB3 1 90 GLY H 3.100 . 4.300 3.595 2.100 4.679 0.379 7 0 "[ . 1 .]" 1
1603 1 89 ASP HB3 1 91 VAL H 2.300 . 3.000 2.695 2.258 3.228 0.228 13 0 "[ . 1 .]" 1
1604 1 90 GLY H 1 90 GLY HA2 2.400 . 3.100 2.572 2.356 2.958 . 0 0 "[ . 1 .]" 1
1605 1 90 GLY H 1 90 GLY HA3 2.500 . 3.300 2.815 2.321 2.956 . 0 0 "[ . 1 .]" 1
1606 1 90 GLY H 1 91 VAL QG 3.300 . 4.700 3.763 3.011 4.601 . 0 0 "[ . 1 .]" 1
1607 1 90 GLY HA2 1 91 VAL H 2.900 . 4.000 3.108 2.334 3.486 . 0 0 "[ . 1 .]" 1
1608 1 91 VAL H 1 91 VAL HA 2.600 . 3.400 2.821 2.265 2.950 . 0 0 "[ . 1 .]" 1
1609 1 91 VAL H 1 91 VAL QG 2.900 . 3.000 2.319 1.605 2.896 0.195 4 0 "[ . 1 .]" 1
1610 1 91 VAL HA 1 91 VAL HB 2.400 . 3.100 2.827 2.273 3.020 . 0 0 "[ . 1 .]" 1
1611 1 91 VAL HA 1 91 VAL QG 2.000 . 2.500 2.136 1.871 2.445 . 0 0 "[ . 1 .]" 1
1612 1 91 VAL HB 1 91 VAL QG 2.000 . 2.400 1.877 1.867 1.890 . 0 0 "[ . 1 .]" 1
1613 1 91 VAL HB 1 92 SER H 2.600 . 5.500 3.765 1.726 4.278 . 0 0 "[ . 1 .]" 1
1614 1 91 VAL MG1 1 91 VAL MG2 2.300 . 3.000 2.035 1.928 2.091 . 0 0 "[ . 1 .]" 1
1615 1 91 VAL QG 1 92 SER H 2.500 . 3.300 2.193 1.781 2.507 0.119 7 0 "[ . 1 .]" 1
1616 1 91 VAL QG 1 95 GLU HA 2.900 . 5.500 4.404 4.043 4.824 . 0 0 "[ . 1 .]" 1
1617 1 91 VAL QG 1 96 LEU HB2 2.700 . 3.600 2.553 2.167 3.414 . 0 0 "[ . 1 .]" 1
1618 1 92 SER H 1 92 SER HA 3.000 . 4.100 2.845 2.655 2.926 . 0 0 "[ . 1 .]" 1
1619 1 92 SER H 1 92 SER QB 2.000 . 4.300 2.523 2.081 3.171 . 0 0 "[ . 1 .]" 1
1620 1 92 SER H 1 95 GLU HB3 2.900 . 4.000 2.917 2.143 3.937 . 0 0 "[ . 1 .]" 1
1621 1 92 SER H 1 95 GLU QG 3.400 . 4.800 4.051 3.014 4.817 0.017 4 0 "[ . 1 .]" 1
1622 1 92 SER HA 1 92 SER QB 2.300 . 3.000 2.188 2.150 2.316 . 0 0 "[ . 1 .]" 1
1623 1 92 SER HA 1 93 LEU H 2.600 . 3.400 2.475 2.207 2.702 . 0 0 "[ . 1 .]" 1
1624 1 92 SER QB 1 93 LEU H 3.000 . 4.100 2.701 1.987 3.478 . 0 0 "[ . 1 .]" 1
1625 1 92 SER QB 1 95 GLU H 3.000 . 4.100 3.188 2.358 3.807 . 0 0 "[ . 1 .]" 1
1626 1 93 LEU H 1 93 LEU HA 2.800 . 3.800 2.822 2.755 2.868 . 0 0 "[ . 1 .]" 1
1627 1 93 LEU H 1 93 LEU HB2 2.700 . 3.600 2.556 2.063 2.883 . 0 0 "[ . 1 .]" 1
1628 1 93 LEU H 1 93 LEU HB3 2.600 . 3.400 2.516 2.198 3.296 . 0 0 "[ . 1 .]" 1
1629 1 93 LEU H 1 93 LEU QD 3.400 . 4.800 3.714 3.593 3.750 . 0 0 "[ . 1 .]" 1
1630 1 93 LEU H 1 93 LEU HG 3.200 . 4.500 4.235 3.490 4.400 . 0 0 "[ . 1 .]" 1
1631 1 93 LEU H 1 94 HIS H 3.000 . 4.100 2.894 2.625 3.231 . 0 0 "[ . 1 .]" 1
1632 1 93 LEU HA 1 93 LEU HB2 2.400 . 3.100 2.467 2.311 2.876 . 0 0 "[ . 1 .]" 1
1633 1 93 LEU HA 1 93 LEU HB3 2.400 . 3.100 2.988 2.831 3.017 . 0 0 "[ . 1 .]" 1
1634 1 93 LEU HA 1 93 LEU QD 2.700 . 2.700 2.425 1.955 2.660 . 0 0 "[ . 1 .]" 1
1635 1 93 LEU HA 1 93 LEU HG 2.600 . 3.400 2.909 2.372 3.242 . 0 0 "[ . 1 .]" 1
1636 1 93 LEU HA 1 94 HIS H 3.100 . 4.300 3.536 3.465 3.573 . 0 0 "[ . 1 .]" 1
1637 1 93 LEU HA 1 96 LEU HB2 2.900 . 4.000 3.355 2.965 3.859 . 0 0 "[ . 1 .]" 1
1638 1 93 LEU HA 1 96 LEU HB3 2.700 . 3.600 2.877 2.498 3.185 . 0 0 "[ . 1 .]" 1
1639 1 93 LEU HA 1 96 LEU HG 2.900 . 5.500 4.467 3.728 5.038 . 0 0 "[ . 1 .]" 1
1640 1 93 LEU HB2 1 93 LEU QD 2.500 . 3.100 2.174 2.051 2.530 . 0 0 "[ . 1 .]" 1
1641 1 93 LEU HB2 1 93 LEU HG 2.700 . 3.600 2.768 2.250 3.015 . 0 0 "[ . 1 .]" 1
1642 1 93 LEU HB2 1 94 HIS H 2.900 . 4.000 3.571 2.495 4.012 0.012 12 0 "[ . 1 .]" 1
1643 1 93 LEU HB3 1 93 LEU QD 2.400 . 3.100 2.088 1.975 2.174 . 0 0 "[ . 1 .]" 1
1644 1 93 LEU HB3 1 94 HIS H 2.600 . 3.400 2.194 1.670 2.707 0.130 5 0 "[ . 1 .]" 1
1645 1 93 LEU MD1 1 93 LEU MD2 1.700 . 2.200 2.046 1.907 2.090 . 0 0 "[ . 1 .]" 1
1646 1 93 LEU QD 1 93 LEU HG 2.100 . 2.500 1.877 1.853 1.894 . 0 0 "[ . 1 .]" 1
1647 1 93 LEU QD 1 94 HIS H 3.100 . 4.300 3.125 2.481 3.704 . 0 0 "[ . 1 .]" 1
1648 1 93 LEU QD 1 94 HIS HA 2.900 . 5.500 3.444 2.565 3.976 . 0 0 "[ . 1 .]" 1
1649 1 93 LEU QD 1 94 HIS HD2 2.500 . 3.600 3.019 2.330 3.555 . 0 0 "[ . 1 .]" 1
1650 1 93 LEU QD 1 94 HIS HE1 2.800 . 5.500 4.607 4.216 5.001 . 0 0 "[ . 1 .]" 1
1651 1 93 LEU QD 1 96 LEU QD 2.500 . 3.300 3.221 2.995 3.283 . 0 0 "[ . 1 .]" 1
1652 1 93 LEU QD 1 96 LEU HG 2.500 . 5.500 3.524 2.978 4.253 . 0 0 "[ . 1 .]" 1
1653 1 93 LEU QD 1 97 LEU QD 2.100 . 2.700 2.213 1.781 2.666 . 0 0 "[ . 1 .]" 1
1654 1 93 LEU HG 1 94 HIS H 3.000 . 4.100 3.623 2.985 4.403 0.303 9 0 "[ . 1 .]" 1
1655 1 93 LEU HG 1 97 LEU QD 2.100 . 5.500 3.577 3.196 4.549 . 0 0 "[ . 1 .]" 1
1656 1 94 HIS H 1 94 HIS HA 2.500 . 3.300 2.757 2.683 2.818 . 0 0 "[ . 1 .]" 1
1657 1 94 HIS H 1 94 HIS QB 2.500 . 3.300 2.757 2.610 2.909 . 0 0 "[ . 1 .]" 1
1658 1 94 HIS H 1 95 GLU H 2.800 . 3.800 2.849 2.688 3.047 . 0 0 "[ . 1 .]" 1
1659 1 94 HIS HA 1 94 HIS QB 2.200 . 2.800 2.265 2.210 2.315 . 0 0 "[ . 1 .]" 1
1660 1 94 HIS HA 1 94 HIS HD2 2.900 . 4.000 2.991 2.694 3.382 . 0 0 "[ . 1 .]" 1
1661 1 94 HIS HA 1 95 GLU H 3.300 . 4.700 3.542 3.519 3.572 . 0 0 "[ . 1 .]" 1
1662 1 94 HIS HA 1 97 LEU H 3.400 . 4.800 3.814 3.662 3.966 . 0 0 "[ . 1 .]" 1
1663 1 94 HIS HA 1 97 LEU HB2 2.600 . 3.400 3.122 2.733 3.410 0.010 12 0 "[ . 1 .]" 1
1664 1 94 HIS HA 1 97 LEU HB3 3.100 . 4.300 4.284 4.112 4.331 0.031 3 0 "[ . 1 .]" 1
1665 1 94 HIS HA 1 97 LEU QD 2.400 . 5.500 4.037 2.298 4.688 . 0 0 "[ . 1 .]" 1
1666 1 94 HIS HA 1 98 ALA MB 2.800 . 5.500 4.133 3.910 4.324 . 0 0 "[ . 1 .]" 1
1667 1 94 HIS HA 1 111 LEU HB2 2.900 . 4.000 3.848 3.672 3.998 . 0 0 "[ . 1 .]" 1
1668 1 94 HIS HA 1 111 LEU HB3 2.900 . 4.000 3.322 3.079 3.720 . 0 0 "[ . 1 .]" 1
1669 1 94 HIS HA 1 111 LEU MD2 2.400 . 3.100 2.096 1.807 2.456 . 0 0 "[ . 1 .]" 1
1670 1 94 HIS HA 1 114 LEU QD 2.800 . 3.800 3.018 2.534 3.541 . 0 0 "[ . 1 .]" 1
1671 1 94 HIS QB 1 94 HIS HD2 2.700 . 3.600 2.975 2.785 3.100 . 0 0 "[ . 1 .]" 1
1672 1 94 HIS QB 1 95 GLU H 2.900 . 4.000 2.544 2.134 2.743 . 0 0 "[ . 1 .]" 1
1673 1 94 HIS QB 1 111 LEU HB3 2.900 . 4.000 2.217 1.893 2.590 . 0 0 "[ . 1 .]" 1
1674 1 94 HIS QB 1 111 LEU MD2 2.800 . 3.800 2.775 2.125 3.342 . 0 0 "[ . 1 .]" 1
1675 1 94 HIS QB 1 117 SER HA 2.700 . 3.600 3.561 3.272 3.618 0.018 12 0 "[ . 1 .]" 1
1676 1 94 HIS QB 1 117 SER HB2 2.900 . 4.000 3.188 2.522 4.122 0.122 6 0 "[ . 1 .]" 1
1677 1 94 HIS QB 1 117 SER HB3 3.000 . 4.100 3.344 2.704 4.004 . 0 0 "[ . 1 .]" 1
1678 1 94 HIS HD2 1 111 LEU HB2 2.500 . 5.500 3.824 2.775 4.534 . 0 0 "[ . 1 .]" 1
1679 1 94 HIS HD2 1 111 LEU HB3 2.900 . 5.500 4.576 4.011 5.031 . 0 0 "[ . 1 .]" 1
1680 1 94 HIS HD2 1 114 LEU HB2 2.700 . 5.500 3.802 3.187 4.661 . 0 0 "[ . 1 .]" 1
1681 1 94 HIS HD2 1 114 LEU QD 2.300 . 3.000 2.096 1.655 2.555 . 0 0 "[ . 1 .]" 1
1682 1 94 HIS HD2 1 117 SER HB3 3.000 . 5.500 4.808 3.413 5.980 0.480 6 0 "[ . 1 .]" 1
1683 1 94 HIS HE1 1 117 SER HA 2.700 . 3.600 2.957 2.537 3.621 0.021 15 0 "[ . 1 .]" 1
1684 1 95 GLU H 1 95 GLU HA 2.500 . 3.300 2.823 2.797 2.847 . 0 0 "[ . 1 .]" 1
1685 1 95 GLU H 1 95 GLU HB2 2.400 . 3.100 2.371 2.105 2.645 . 0 0 "[ . 1 .]" 1
1686 1 95 GLU H 1 95 GLU HB3 2.600 . 3.400 2.732 2.429 3.410 0.010 7 0 "[ . 1 .]" 1
1687 1 95 GLU H 1 95 GLU QG 3.000 . 4.100 3.939 3.672 4.040 . 0 0 "[ . 1 .]" 1
1688 1 95 GLU H 1 96 LEU H 2.700 . 3.600 2.627 2.504 2.712 . 0 0 "[ . 1 .]" 1
1689 1 95 GLU HA 1 95 GLU QG 2.200 . 2.800 2.395 2.139 2.805 0.005 2 0 "[ . 1 .]" 1
1690 1 95 GLU HA 1 96 LEU H 3.100 . 4.300 3.520 3.471 3.546 . 0 0 "[ . 1 .]" 1
1691 1 95 GLU HA 1 98 ALA H 3.000 . 4.100 3.603 3.490 3.711 . 0 0 "[ . 1 .]" 1
1692 1 95 GLU HA 1 98 ALA MB 2.200 . 2.800 2.468 2.243 2.697 . 0 0 "[ . 1 .]" 1
1693 1 95 GLU HB2 1 96 LEU H 2.700 . 5.500 3.713 2.897 4.064 . 0 0 "[ . 1 .]" 1
1694 1 95 GLU HB3 1 96 LEU H 2.800 . 3.800 2.699 2.446 3.073 . 0 0 "[ . 1 .]" 1
1695 1 95 GLU QG 1 96 LEU H 2.500 . 5.500 3.952 3.667 4.578 . 0 0 "[ . 1 .]" 1
1696 1 96 LEU H 1 96 LEU HA 2.500 . 3.300 2.805 2.758 2.842 . 0 0 "[ . 1 .]" 1
1697 1 96 LEU H 1 96 LEU HB2 2.500 . 3.300 2.455 2.317 2.745 . 0 0 "[ . 1 .]" 1
1698 1 96 LEU H 1 96 LEU HB3 2.300 . 3.000 2.562 2.269 2.744 . 0 0 "[ . 1 .]" 1
1699 1 96 LEU H 1 96 LEU QD 2.600 . 5.500 3.634 3.594 3.698 . 0 0 "[ . 1 .]" 1
1700 1 96 LEU H 1 96 LEU HG 2.900 . 5.500 4.498 4.314 4.595 . 0 0 "[ . 1 .]" 1
1701 1 96 LEU H 1 97 LEU H 2.600 . 3.400 2.862 2.761 3.094 . 0 0 "[ . 1 .]" 1
1702 1 96 LEU HA 1 96 LEU HB2 2.100 . 2.700 2.480 2.320 2.567 . 0 0 "[ . 1 .]" 1
1703 1 96 LEU HA 1 96 LEU HB3 2.400 . 3.100 3.013 2.991 3.021 . 0 0 "[ . 1 .]" 1
1704 1 96 LEU HA 1 96 LEU QD 2.000 . 2.500 2.235 1.760 2.583 0.083 5 0 "[ . 1 .]" 1
1705 1 96 LEU HA 1 96 LEU HG 2.300 . 5.500 3.083 2.519 3.684 . 0 0 "[ . 1 .]" 1
1706 1 96 LEU HA 1 97 LEU H 3.300 . 4.700 3.563 3.533 3.570 . 0 0 "[ . 1 .]" 1
1707 1 96 LEU HB2 1 96 LEU QD 2.300 . 2.700 2.241 1.997 2.495 . 0 0 "[ . 1 .]" 1
1708 1 96 LEU HB2 1 96 LEU HG 2.400 . 3.100 2.696 2.286 2.990 . 0 0 "[ . 1 .]" 1
1709 1 96 LEU HB2 1 97 LEU H 2.800 . 3.800 3.601 3.436 3.786 . 0 0 "[ . 1 .]" 1
1710 1 96 LEU HB3 1 96 LEU QD 2.300 . 3.000 2.013 1.907 2.179 . 0 0 "[ . 1 .]" 1
1711 1 96 LEU HB3 1 97 LEU H 2.800 . 3.800 2.186 2.064 2.371 . 0 0 "[ . 1 .]" 1
1712 1 96 LEU HB3 1 100 GLU H 3.200 . 4.500 4.510 4.367 4.701 0.201 3 0 "[ . 1 .]" 1
1713 1 96 LEU MD1 1 100 GLU HG2 2.400 . 3.100 2.533 1.683 3.112 0.017 12 0 "[ . 1 .]" 1
1714 1 96 LEU QD 1 96 LEU HG 1.900 . 2.400 1.874 1.859 1.885 . 0 0 "[ . 1 .]" 1
1715 1 96 LEU QD 1 96 LEU HG 1.900 . 2.400 1.671 1.659 1.680 . 0 0 "[ . 1 .]" 1
1716 1 96 LEU QD 1 97 LEU QD 2.000 . 2.800 2.352 1.947 2.843 0.043 5 0 "[ . 1 .]" 1
1717 1 96 LEU QD 1 100 GLU HA 2.800 . 5.500 4.619 3.798 5.259 . 0 0 "[ . 1 .]" 1
1718 1 96 LEU QD 1 100 GLU HA 2.700 . 5.500 4.054 3.640 4.723 . 0 0 "[ . 1 .]" 1
1719 1 96 LEU QD 1 100 GLU HB2 2.400 . 5.500 3.753 2.819 4.501 . 0 0 "[ . 1 .]" 1
1720 1 96 LEU HG 1 100 GLU HA 2.800 . 5.500 4.745 3.681 5.717 0.217 4 0 "[ . 1 .]" 1
1721 1 97 LEU H 1 97 LEU HA 2.600 . 3.400 2.770 2.715 2.798 . 0 0 "[ . 1 .]" 1
1722 1 97 LEU H 1 97 LEU HB2 2.300 . 3.000 2.110 2.030 2.364 . 0 0 "[ . 1 .]" 1
1723 1 97 LEU H 1 97 LEU HB3 2.600 . 3.400 3.386 3.272 3.533 0.133 9 0 "[ . 1 .]" 1
1724 1 97 LEU H 1 97 LEU QD 2.900 . 4.000 2.429 1.966 3.240 . 0 0 "[ . 1 .]" 1
1725 1 97 LEU H 1 98 ALA H 2.600 . 3.400 2.753 2.663 2.911 . 0 0 "[ . 1 .]" 1
1726 1 97 LEU H 1 111 LEU MD2 3.200 . 4.500 3.662 3.448 3.847 . 0 0 "[ . 1 .]" 1
1727 1 97 LEU HA 1 97 LEU HB2 2.400 . 3.100 2.909 2.845 3.011 . 0 0 "[ . 1 .]" 1
1728 1 97 LEU HA 1 97 LEU HB3 2.400 . 3.100 2.761 2.542 2.844 . 0 0 "[ . 1 .]" 1
1729 1 97 LEU HA 1 97 LEU QD 2.000 . 2.500 1.947 1.643 2.575 0.157 9 0 "[ . 1 .]" 1
1730 1 97 LEU HA 1 98 ALA H 2.900 . 4.000 3.516 3.491 3.531 . 0 0 "[ . 1 .]" 1
1731 1 97 LEU HA 1 100 GLU H 3.100 . 4.300 3.705 3.568 3.886 . 0 0 "[ . 1 .]" 1
1732 1 97 LEU HA 1 111 LEU MD2 3.000 . 4.100 4.115 4.037 4.141 0.041 5 0 "[ . 1 .]" 1
1733 1 97 LEU HB2 1 97 LEU QD 2.600 . 3.300 2.199 1.939 2.322 . 0 0 "[ . 1 .]" 1
1734 1 97 LEU HB2 1 97 LEU HG 2.900 . 4.000 2.490 2.425 2.686 . 0 0 "[ . 1 .]" 1
1735 1 97 LEU HB2 1 111 LEU MD2 2.400 . 3.100 2.293 1.882 2.605 . 0 0 "[ . 1 .]" 1
1736 1 97 LEU HB3 1 97 LEU QD 2.600 . 3.300 2.307 2.080 2.531 . 0 0 "[ . 1 .]" 1
1737 1 97 LEU HB3 1 97 LEU HG 2.700 . 3.600 2.441 2.260 2.960 . 0 0 "[ . 1 .]" 1
1738 1 97 LEU HB3 1 98 ALA H 2.900 . 4.000 3.173 2.939 3.562 . 0 0 "[ . 1 .]" 1
1739 1 97 LEU HB3 1 100 GLU H 3.400 . 5.500 5.331 5.140 5.468 . 0 0 "[ . 1 .]" 1
1740 1 97 LEU HB3 1 111 LEU MD2 2.600 . 3.400 1.888 1.797 2.219 0.003 4 0 "[ . 1 .]" 1
1741 1 97 LEU QD 1 111 LEU MD2 2.300 . 5.500 3.155 2.092 3.339 . 0 0 "[ . 1 .]" 1
1742 1 97 LEU HG 1 111 LEU MD2 2.400 . 3.100 3.075 2.991 3.126 0.026 10 0 "[ . 1 .]" 1
1743 1 98 ALA H 1 98 ALA HA 2.400 . 3.100 2.793 2.777 2.807 . 0 0 "[ . 1 .]" 1
1744 1 98 ALA H 1 98 ALA MB 2.100 . 2.700 2.088 2.022 2.211 . 0 0 "[ . 1 .]" 1
1745 1 98 ALA H 1 111 LEU MD2 3.300 . 4.700 2.845 2.340 3.141 . 0 0 "[ . 1 .]" 1
1746 1 98 ALA HA 1 98 ALA MB 1.900 . 2.400 2.096 2.081 2.120 . 0 0 "[ . 1 .]" 1
1747 1 98 ALA HA 1 99 ALA H 3.100 . 4.300 3.560 3.547 3.567 . 0 0 "[ . 1 .]" 1
1748 1 98 ALA HA 1 101 LEU QB 2.700 . 5.500 4.159 3.924 4.519 . 0 0 "[ . 1 .]" 1
1749 1 98 ALA HA 1 111 LEU MD1 2.100 . 2.700 1.903 1.747 2.003 . 0 0 "[ . 1 .]" 1
1750 1 98 ALA HA 1 111 LEU MD2 2.800 . 3.800 3.426 2.881 3.824 0.024 5 0 "[ . 1 .]" 1
1751 1 98 ALA MB 1 99 ALA H 1.900 . 2.400 1.832 1.748 1.937 . 0 0 "[ . 1 .]" 1
1752 1 98 ALA MB 1 102 THR HA 2.800 . 5.500 4.857 4.811 4.907 . 0 0 "[ . 1 .]" 1
1753 1 98 ALA MB 1 102 THR HB 2.600 . 3.400 3.423 3.407 3.437 0.037 15 0 "[ . 1 .]" 1
1754 1 98 ALA MB 1 101 LEU H 2.800 . 5.500 5.159 5.059 5.259 . 0 0 "[ . 1 .]" 1
1755 1 98 ALA MB 1 110 ASP H 3.300 . 4.700 3.173 2.626 4.066 . 0 0 "[ . 1 .]" 1
1756 1 98 ALA MB 1 110 ASP HA 2.100 . 5.500 2.914 2.550 3.500 . 0 0 "[ . 1 .]" 1
1757 1 98 ALA MB 1 111 LEU MD1 1.900 . 2.400 2.103 1.879 2.406 0.006 2 0 "[ . 1 .]" 1
1758 1 98 ALA MB 1 111 LEU MD2 2.500 . 3.300 3.104 2.739 3.321 0.021 5 0 "[ . 1 .]" 1
1759 1 99 ALA H 1 99 ALA HA 2.200 . 2.800 2.292 2.171 2.529 . 0 0 "[ . 1 .]" 1
1760 1 99 ALA H 1 100 GLU H 2.400 . 3.100 2.729 2.683 2.799 . 0 0 "[ . 1 .]" 1
1761 1 99 ALA HA 1 99 ALA MB 1.600 . 2.200 2.101 2.080 2.125 . 0 0 "[ . 1 .]" 1
1762 1 99 ALA HA 1 100 GLU H 2.700 . 3.600 3.450 3.416 3.479 . 0 0 "[ . 1 .]" 1
1763 1 99 ALA HA 1 102 THR HA 2.900 . 4.000 3.966 3.895 4.011 0.011 1 0 "[ . 1 .]" 1
1764 1 99 ALA HA 1 102 THR H 3.000 . 4.100 3.436 3.377 3.499 . 0 0 "[ . 1 .]" 1
1765 1 99 ALA HA 1 102 THR HB 2.000 . 2.500 1.914 1.864 1.957 . 0 0 "[ . 1 .]" 1
1766 1 99 ALA HA 1 102 THR MG 2.500 . 3.300 3.052 2.913 3.141 . 0 0 "[ . 1 .]" 1
1767 1 99 ALA HA 1 103 LYS H 2.800 . 3.800 3.736 3.642 3.815 0.015 11 0 "[ . 1 .]" 1
1768 1 99 ALA MB 1 100 GLU H 2.300 . 3.000 2.966 2.834 3.008 0.008 3 0 "[ . 1 .]" 1
1769 1 100 GLU H 1 100 GLU HA 2.600 . 3.400 2.814 2.801 2.830 . 0 0 "[ . 1 .]" 1
1770 1 100 GLU H 1 100 GLU HB2 2.800 . 3.800 2.118 2.079 2.166 . 0 0 "[ . 1 .]" 1
1771 1 100 GLU H 1 100 GLU HB3 2.700 . 3.600 3.409 3.294 3.476 . 0 0 "[ . 1 .]" 1
1772 1 100 GLU H 1 100 GLU QG 2.600 . 3.400 3.106 2.919 3.375 . 0 0 "[ . 1 .]" 1
1773 1 100 GLU H 1 101 LEU H 2.600 . 3.400 2.963 2.892 3.023 . 0 0 "[ . 1 .]" 1
1774 1 100 GLU HA 1 100 GLU HB2 2.200 . 2.800 2.925 2.866 2.967 0.167 12 0 "[ . 1 .]" 1
1775 1 100 GLU HA 1 100 GLU HB3 2.200 . 5.500 2.756 2.694 2.828 . 0 0 "[ . 1 .]" 1
1776 1 100 GLU HA 1 100 GLU QG 2.400 . 3.100 2.549 2.242 2.756 . 0 0 "[ . 1 .]" 1
1777 1 100 GLU HA 1 101 LEU H 3.400 . 4.800 3.571 3.562 3.576 . 0 0 "[ . 1 .]" 1
1778 1 100 GLU HA 1 103 LYS QB 2.500 . 5.500 3.906 3.362 4.792 . 0 0 "[ . 1 .]" 1
1779 1 100 GLU HB2 1 100 GLU QG 2.200 . 2.800 2.160 2.141 2.165 . 0 0 "[ . 1 .]" 1
1780 1 100 GLU HB3 1 100 GLU QG 2.600 . 3.400 2.339 2.264 2.470 . 0 0 "[ . 1 .]" 1
1781 1 101 LEU H 1 101 LEU QB 2.300 . 3.000 2.360 2.102 2.625 . 0 0 "[ . 1 .]" 1
1782 1 101 LEU H 1 101 LEU QD 3.000 . 4.100 2.660 1.890 3.400 0.010 12 0 "[ . 1 .]" 1
1783 1 101 LEU H 1 102 THR H 2.500 . 3.300 2.560 2.471 2.592 . 0 0 "[ . 1 .]" 1
1784 1 101 LEU HA 1 101 LEU QB 2.600 . 3.100 2.404 2.296 2.508 . 0 0 "[ . 1 .]" 1
1785 1 101 LEU HA 1 101 LEU QD 2.000 . 2.500 1.979 1.725 2.251 . 0 0 "[ . 1 .]" 1
1786 1 101 LEU HA 1 104 ALA MB 1.700 . 2.200 1.973 1.917 2.007 . 0 0 "[ . 1 .]" 1
1787 1 101 LEU HA 1 104 ALA MB 2.000 . 2.500 2.384 2.179 2.506 0.006 7 0 "[ . 1 .]" 1
1788 1 101 LEU QB 1 101 LEU QD 2.300 . 3.000 1.588 1.515 1.679 0.085 14 0 "[ . 1 .]" 1
1789 1 101 LEU QB 1 102 THR H 3.200 . 3.600 3.055 2.921 3.202 . 0 0 "[ . 1 .]" 1
1790 1 101 LEU QB 1 104 ALA H 3.400 . 5.500 4.623 4.478 4.741 . 0 0 "[ . 1 .]" 1
1791 1 101 LEU QB 1 105 LEU QD 2.500 . 3.300 3.106 2.953 3.218 . 0 0 "[ . 1 .]" 1
1792 1 101 LEU QB 1 109 LEU MD1 2.300 . 3.000 1.687 1.585 1.843 0.015 14 0 "[ . 1 .]" 1
1793 1 101 LEU QB 1 109 LEU HG 2.500 . 3.300 2.868 2.521 3.138 . 0 0 "[ . 1 .]" 1
1794 1 101 LEU QD 1 104 ALA H 3.300 . 4.700 4.412 4.173 4.595 . 0 0 "[ . 1 .]" 1
1795 1 102 THR H 1 102 THR HA 2.500 . 3.300 2.857 2.817 2.894 . 0 0 "[ . 1 .]" 1
1796 1 102 THR H 1 102 THR HB 2.400 . 3.100 2.389 2.306 2.461 . 0 0 "[ . 1 .]" 1
1797 1 102 THR H 1 102 THR HG1 2.400 . 3.100 2.736 2.330 3.098 . 0 0 "[ . 1 .]" 1
1798 1 102 THR H 1 102 THR MG 2.700 . 5.500 3.738 3.706 3.759 . 0 0 "[ . 1 .]" 1
1799 1 102 THR H 1 103 LYS H 2.500 . 3.300 2.493 2.327 2.715 . 0 0 "[ . 1 .]" 1
1800 1 102 THR H 1 109 LEU HB2 3.000 . 4.100 4.121 4.106 4.129 0.029 3 0 "[ . 1 .]" 1
1801 1 102 THR HA 1 102 THR HB 2.300 . 5.500 3.022 3.010 3.027 . 0 0 "[ . 1 .]" 1
1802 1 102 THR HA 1 102 THR MG 2.000 . 2.500 2.503 2.472 2.541 0.041 4 0 "[ . 1 .]" 1
1803 1 102 THR HA 1 103 LYS H 2.900 . 4.000 3.508 3.473 3.556 . 0 0 "[ . 1 .]" 1
1804 1 102 THR HA 1 105 LEU H 3.400 . 4.800 3.983 3.717 4.361 . 0 0 "[ . 1 .]" 1
1805 1 102 THR HA 1 105 LEU HB3 2.600 . 5.500 3.965 3.683 4.160 . 0 0 "[ . 1 .]" 1
1806 1 102 THR HA 1 106 LYS H 3.400 . 4.800 4.296 3.692 4.713 . 0 0 "[ . 1 .]" 1
1807 1 102 THR HA 1 107 THR H 2.400 . 3.100 2.582 2.203 3.058 . 0 0 "[ . 1 .]" 1
1808 1 102 THR HA 1 107 THR HA 2.900 . 5.500 4.680 4.486 4.840 . 0 0 "[ . 1 .]" 1
1809 1 102 THR HA 1 107 THR MG 2.800 . 3.800 2.498 2.161 2.854 . 0 0 "[ . 1 .]" 1
1810 1 102 THR HA 1 108 LYS HA 2.500 . 5.500 4.013 3.396 4.486 . 0 0 "[ . 1 .]" 1
1811 1 102 THR HA 1 109 LEU H 3.000 . 4.100 3.545 3.266 3.747 . 0 0 "[ . 1 .]" 1
1812 1 102 THR HA 1 109 LEU QD 2.800 . 5.500 4.430 4.233 4.747 . 0 0 "[ . 1 .]" 1
1813 1 102 THR HA 1 109 LEU HG 2.400 . 5.500 4.201 3.932 4.586 . 0 0 "[ . 1 .]" 1
1814 1 102 THR HB 1 102 THR MG 1.800 . 2.200 2.090 2.071 2.116 . 0 0 "[ . 1 .]" 1
1815 1 102 THR HB 1 103 LYS H 2.400 . 3.100 2.807 2.587 2.941 . 0 0 "[ . 1 .]" 1
1816 1 102 THR HB 1 109 LEU H 3.300 . 4.700 4.559 4.170 4.720 0.020 5 0 "[ . 1 .]" 1
1817 1 102 THR HG1 1 103 LYS H 3.300 . 4.700 4.495 4.266 4.702 0.002 7 0 "[ . 1 .]" 1
1818 1 102 THR HG1 1 109 LEU H 2.700 . 3.600 2.353 1.976 3.193 . 0 0 "[ . 1 .]" 1
1819 1 102 THR MG 1 103 LYS H 2.800 . 3.800 3.520 3.241 3.660 . 0 0 "[ . 1 .]" 1
1820 1 102 THR MG 1 103 LYS HA 2.500 . 5.500 3.622 3.506 3.735 . 0 0 "[ . 1 .]" 1
1821 1 102 THR MG 1 107 THR H 3.000 . 4.100 3.770 3.403 4.103 0.003 1 0 "[ . 1 .]" 1
1822 1 102 THR MG 1 107 THR MG 2.700 . 5.500 4.030 3.816 4.405 . 0 0 "[ . 1 .]" 1
1823 1 102 THR MG 1 108 LYS HA 1.900 . 2.400 2.262 1.966 2.847 0.447 13 0 "[ . 1 .]" 1
1824 1 103 LYS H 1 103 LYS QB 2.200 . 2.800 2.385 2.207 2.739 . 0 0 "[ . 1 .]" 1
1825 1 103 LYS H 1 103 LYS HD2 3.100 . 4.300 4.207 3.193 4.704 0.404 7 0 "[ . 1 .]" 1
1826 1 103 LYS H 1 103 LYS HD3 3.300 . 4.700 4.170 3.278 4.743 0.043 11 0 "[ . 1 .]" 1
1827 1 103 LYS H 1 103 LYS QG 3.300 . 4.700 3.152 2.018 4.093 . 0 0 "[ . 1 .]" 1
1828 1 103 LYS H 1 104 ALA H 2.400 . 3.100 2.221 2.141 2.324 . 0 0 "[ . 1 .]" 1
1829 1 103 LYS HA 1 103 LYS QB 2.000 . 5.500 2.382 2.168 2.539 . 0 0 "[ . 1 .]" 1
1830 1 103 LYS HA 1 103 LYS QG 2.600 . 3.400 2.626 2.017 3.401 0.001 11 0 "[ . 1 .]" 1
1831 1 103 LYS HA 1 104 ALA H 2.500 . 5.500 3.355 3.284 3.470 . 0 0 "[ . 1 .]" 1
1832 1 103 LYS HA 1 106 LYS H 3.200 . 4.500 3.695 3.371 4.243 . 0 0 "[ . 1 .]" 1
1833 1 103 LYS QB 1 104 ALA H 2.300 . 5.500 3.394 3.012 3.765 . 0 0 "[ . 1 .]" 1
1834 1 103 LYS HD2 1 103 LYS QE 2.200 . 2.800 1.987 1.837 2.124 . 0 0 "[ . 1 .]" 1
1835 1 104 ALA H 1 104 ALA HA 2.900 . 4.000 2.934 2.898 2.950 . 0 0 "[ . 1 .]" 1
1836 1 104 ALA H 1 104 ALA MB 2.100 . 2.700 2.303 2.105 2.427 . 0 0 "[ . 1 .]" 1
1837 1 104 ALA H 1 105 LEU H 2.500 . 3.300 2.118 1.973 2.519 . 0 0 "[ . 1 .]" 1
1838 1 104 ALA H 1 105 LEU HB3 3.100 . 5.500 5.543 5.453 5.862 0.362 5 0 "[ . 1 .]" 1
1839 1 104 ALA H 1 106 LYS H 3.400 . 4.800 3.375 3.138 3.741 . 0 0 "[ . 1 .]" 1
1840 1 104 ALA HA 1 104 ALA MB 1.600 . 2.200 2.110 2.086 2.127 . 0 0 "[ . 1 .]" 1
1841 1 104 ALA HA 1 105 LEU H 2.800 . 3.800 3.467 3.388 3.575 . 0 0 "[ . 1 .]" 1
1842 1 104 ALA HA 1 106 LYS H 3.200 . 4.500 4.031 3.682 4.275 . 0 0 "[ . 1 .]" 1
1843 1 104 ALA MB 1 105 LEU H 2.400 . 3.100 2.841 2.304 3.101 0.001 14 0 "[ . 1 .]" 1
1844 1 104 ALA MB 1 105 LEU HA 2.600 . 5.500 4.047 3.802 4.139 . 0 0 "[ . 1 .]" 1
1845 1 104 ALA MB 1 106 LYS H 3.400 . 4.800 4.347 4.025 4.508 . 0 0 "[ . 1 .]" 1
1846 1 105 LEU H 1 105 LEU HA 2.600 . 3.400 2.937 2.885 2.948 . 0 0 "[ . 1 .]" 1
1847 1 105 LEU H 1 105 LEU HB2 2.400 . 3.100 2.396 2.143 2.543 . 0 0 "[ . 1 .]" 1
1848 1 105 LEU H 1 105 LEU HB3 2.700 . 3.600 3.521 3.390 3.632 0.032 7 0 "[ . 1 .]" 1
1849 1 105 LEU H 1 105 LEU QD 2.700 . 3.600 3.168 2.652 3.494 . 0 0 "[ . 1 .]" 1
1850 1 105 LEU H 1 105 LEU HG 2.700 . 5.500 3.838 3.051 4.521 . 0 0 "[ . 1 .]" 1
1851 1 105 LEU H 1 106 LYS H 2.400 . 3.100 2.189 1.831 2.652 . 0 0 "[ . 1 .]" 1
1852 1 105 LEU H 1 106 LYS HA 3.200 . 4.500 4.246 4.028 4.569 0.069 5 0 "[ . 1 .]" 1
1853 1 105 LEU H 1 107 THR H 3.300 . 4.700 3.534 3.318 3.902 . 0 0 "[ . 1 .]" 1
1854 1 105 LEU HA 1 105 LEU HB2 2.400 . 3.100 2.957 2.882 3.005 . 0 0 "[ . 1 .]" 1
1855 1 105 LEU HA 1 105 LEU HB3 2.300 . 3.000 2.686 2.564 2.812 . 0 0 "[ . 1 .]" 1
1856 1 105 LEU HA 1 105 LEU QD 2.000 . 2.500 2.035 1.535 2.473 . 0 0 "[ . 1 .]" 1
1857 1 105 LEU HA 1 106 LYS H 3.000 . 4.100 3.154 2.958 3.287 . 0 0 "[ . 1 .]" 1
1858 1 105 LEU HA 1 106 LYS QG 2.700 . 3.600 3.408 3.127 3.582 . 0 0 "[ . 1 .]" 1
1859 1 105 LEU HA 1 107 THR HB 3.200 . 5.500 5.198 4.982 5.429 . 0 0 "[ . 1 .]" 1
1860 1 105 LEU HB2 1 105 LEU QD 2.200 . 2.800 2.309 2.046 2.603 . 0 0 "[ . 1 .]" 1
1861 1 105 LEU HB2 1 107 THR HB 3.100 . 4.300 4.145 3.651 4.321 0.021 3 0 "[ . 1 .]" 1
1862 1 105 LEU HB2 1 107 THR MG 2.700 . 3.600 2.604 2.251 3.093 . 0 0 "[ . 1 .]" 1
1863 1 105 LEU HB2 1 109 LEU HG 2.700 . 5.500 5.077 4.647 5.481 . 0 0 "[ . 1 .]" 1
1864 1 105 LEU HB3 1 105 LEU QD 2.200 . 2.800 2.135 1.927 2.309 . 0 0 "[ . 1 .]" 1
1865 1 105 LEU HB3 1 106 LYS H 3.400 . 4.800 4.094 3.861 4.250 . 0 0 "[ . 1 .]" 1
1866 1 105 LEU HB3 1 107 THR H 3.600 . 5.200 3.688 3.289 3.953 . 0 0 "[ . 1 .]" 1
1867 1 105 LEU HB3 1 107 THR HB 2.900 . 4.000 3.094 2.787 3.380 . 0 0 "[ . 1 .]" 1
1868 1 105 LEU HB3 1 107 THR MG 2.300 . 3.000 2.428 2.056 2.753 . 0 0 "[ . 1 .]" 1
1869 1 105 LEU QD 1 106 LYS H 3.300 . 4.700 4.194 3.954 4.326 . 0 0 "[ . 1 .]" 1
1870 1 105 LEU QD 1 107 THR H 3.900 . 5.500 4.661 4.458 4.864 . 0 0 "[ . 1 .]" 1
1871 1 105 LEU QD 1 107 THR MG 2.600 . 3.400 2.885 2.633 3.236 . 0 0 "[ . 1 .]" 1
1872 1 106 LYS H 1 106 LYS HA 2.100 . 2.700 2.282 2.271 2.338 . 0 0 "[ . 1 .]" 1
1873 1 106 LYS H 1 106 LYS HB2 3.000 . 4.100 3.755 3.642 3.905 . 0 0 "[ . 1 .]" 1
1874 1 106 LYS H 1 106 LYS HB3 2.800 . 5.500 3.773 3.126 4.002 . 0 0 "[ . 1 .]" 1
1875 1 106 LYS H 1 106 LYS QD 2.600 . 3.400 3.216 2.994 3.451 0.051 8 0 "[ . 1 .]" 1
1876 1 106 LYS H 1 106 LYS QG 3.000 . 4.100 2.407 2.211 2.688 . 0 0 "[ . 1 .]" 1
1877 1 106 LYS H 1 107 THR H 2.500 . 3.300 2.887 2.680 3.264 . 0 0 "[ . 1 .]" 1
1878 1 106 LYS HA 1 106 LYS HB2 2.200 . 5.500 2.950 2.694 3.021 . 0 0 "[ . 1 .]" 1
1879 1 106 LYS HA 1 106 LYS HB3 2.100 . 2.700 2.309 2.217 2.405 . 0 0 "[ . 1 .]" 1
1880 1 106 LYS HA 1 106 LYS QD 2.700 . 3.600 3.050 2.089 3.817 0.217 12 0 "[ . 1 .]" 1
1881 1 106 LYS HA 1 106 LYS QG 2.200 . 5.500 2.941 2.760 3.270 . 0 0 "[ . 1 .]" 1
1882 1 106 LYS HA 1 107 THR H 2.300 . 3.000 2.796 2.613 2.959 . 0 0 "[ . 1 .]" 1
1883 1 106 LYS HA 1 107 THR HB 3.000 . 5.500 5.178 5.018 5.357 . 0 0 "[ . 1 .]" 1
1884 1 106 LYS HB2 1 106 LYS QG 2.400 . 3.100 2.296 2.145 2.486 . 0 0 "[ . 1 .]" 1
1885 1 106 LYS HB2 1 107 THR H 4.100 . 5.500 4.197 4.035 4.313 . 0 0 "[ . 1 .]" 1
1886 1 106 LYS HB3 1 106 LYS QG 2.300 . 3.000 2.298 2.141 2.460 . 0 0 "[ . 1 .]" 1
1887 1 106 LYS HB3 1 107 THR H 3.400 . 4.800 4.556 4.501 4.615 . 0 0 "[ . 1 .]" 1
1888 1 106 LYS QD 1 107 THR H 3.600 . 5.200 4.628 4.058 5.059 . 0 0 "[ . 1 .]" 1
1889 1 106 LYS QG 1 107 THR H 3.200 . 4.500 4.500 4.420 4.560 0.060 8 0 "[ . 1 .]" 1
1890 1 107 THR H 1 107 THR HA 2.400 . 3.100 2.944 2.937 2.948 . 0 0 "[ . 1 .]" 1
1891 1 107 THR H 1 107 THR HB 2.800 . 3.800 3.001 2.864 3.146 . 0 0 "[ . 1 .]" 1
1892 1 107 THR H 1 107 THR MG 2.800 . 3.800 2.277 1.943 2.507 . 0 0 "[ . 1 .]" 1
1893 1 107 THR H 1 108 LYS H 3.200 . 4.500 4.433 4.351 4.485 . 0 0 "[ . 1 .]" 1
1894 1 107 THR HA 1 107 THR HB 2.100 . 2.700 2.511 2.441 2.557 . 0 0 "[ . 1 .]" 1
1895 1 107 THR HA 1 107 THR MG 2.000 . 5.500 3.215 3.203 3.222 . 0 0 "[ . 1 .]" 1
1896 1 107 THR HA 1 108 LYS H 2.200 . 2.800 2.394 2.170 2.684 . 0 0 "[ . 1 .]" 1
1897 1 107 THR HB 1 107 THR MG 1.900 . 2.400 2.078 2.070 2.101 . 0 0 "[ . 1 .]" 1
1898 1 107 THR HB 1 108 LYS H 3.400 . 4.800 3.906 3.606 4.208 . 0 0 "[ . 1 .]" 1
1899 1 107 THR HB 1 109 LEU HG 2.700 . 5.500 5.196 4.981 5.470 . 0 0 "[ . 1 .]" 1
1900 1 107 THR MG 1 108 LYS H 2.900 . 4.000 3.354 2.680 3.959 . 0 0 "[ . 1 .]" 1
1901 1 107 THR MG 1 109 LEU HA 2.700 . 5.500 3.760 3.430 4.039 . 0 0 "[ . 1 .]" 1
1902 1 107 THR MG 1 109 LEU MD2 2.100 . 2.700 2.716 2.685 2.739 0.039 9 0 "[ . 1 .]" 1
1903 1 107 THR MG 1 109 LEU HG 2.300 . 3.000 2.302 2.034 2.601 . 0 0 "[ . 1 .]" 1
1904 1 108 LYS H 1 108 LYS HA 2.500 . 3.300 2.910 2.827 2.947 . 0 0 "[ . 1 .]" 1
1905 1 108 LYS H 1 108 LYS HB2 2.300 . 3.000 2.607 2.127 3.390 0.390 9 0 "[ . 1 .]" 1
1906 1 108 LYS H 1 108 LYS HB3 2.400 . 3.100 2.994 2.739 3.128 0.028 7 0 "[ . 1 .]" 1
1907 1 108 LYS H 1 108 LYS QD 3.300 . 4.700 4.099 1.895 4.620 0.005 9 0 "[ . 1 .]" 1
1908 1 108 LYS H 1 108 LYS QG 3.200 . 4.500 3.696 1.852 4.268 0.048 6 0 "[ . 1 .]" 1
1909 1 108 LYS H 1 109 LEU H 2.900 . 4.000 3.946 3.640 4.025 0.025 12 0 "[ . 1 .]" 1
1910 1 108 LYS HA 1 108 LYS QB 2.200 . 2.800 2.452 2.144 2.536 . 0 0 "[ . 1 .]" 1
1911 1 108 LYS HA 1 108 LYS QD 2.500 . 3.300 2.867 2.071 3.436 0.136 9 0 "[ . 1 .]" 1
1912 1 108 LYS HA 1 109 LEU H 2.100 . 2.700 2.276 2.160 2.380 . 0 0 "[ . 1 .]" 1
1913 1 108 LYS HB2 1 108 LYS HE2 2.900 . 4.000 3.500 2.927 4.001 0.001 8 0 "[ . 1 .]" 1
1914 1 108 LYS HB2 1 108 LYS HD2 2.100 . 2.700 2.299 2.112 2.426 . 0 0 "[ . 1 .]" 1
1915 1 108 LYS HB2 1 109 LEU H 3.000 . 5.500 4.583 4.185 4.673 . 0 0 "[ . 1 .]" 1
1916 1 108 LYS HB3 1 109 LEU H 2.800 . 5.500 4.299 4.126 4.488 . 0 0 "[ . 1 .]" 1
1917 1 108 LYS QD 1 108 LYS QE 2.100 . 2.700 1.992 1.849 2.071 . 0 0 "[ . 1 .]" 1
1918 1 108 LYS QD 1 109 LEU H 3.100 . 4.300 3.933 3.199 4.279 . 0 0 "[ . 1 .]" 1
1919 1 109 LEU H 1 109 LEU HA 2.800 . 3.800 2.862 2.809 2.910 . 0 0 "[ . 1 .]" 1
1920 1 109 LEU H 1 109 LEU HB2 2.400 . 3.100 2.167 2.103 2.265 . 0 0 "[ . 1 .]" 1
1921 1 109 LEU H 1 109 LEU HB3 2.800 . 3.800 3.456 3.389 3.526 . 0 0 "[ . 1 .]" 1
1922 1 109 LEU H 1 109 LEU MD2 3.100 . 4.300 3.737 3.611 3.788 . 0 0 "[ . 1 .]" 1
1923 1 109 LEU H 1 110 ASP H 3.000 . 4.100 2.930 2.472 4.310 0.210 12 0 "[ . 1 .]" 1
1924 1 109 LEU HA 1 109 LEU HB2 2.500 . 3.300 2.962 2.930 3.001 . 0 0 "[ . 1 .]" 1
1925 1 109 LEU HA 1 109 LEU HB3 2.200 . 2.800 2.696 2.622 2.751 . 0 0 "[ . 1 .]" 1
1926 1 109 LEU HA 1 109 LEU MD2 1.900 . 2.400 1.827 1.717 1.911 . 0 0 "[ . 1 .]" 1
1927 1 109 LEU HA 1 109 LEU HG 2.400 . 3.100 3.022 2.969 3.100 0.000 12 0 "[ . 1 .]" 1
1928 1 109 LEU HA 1 110 ASP HB2 2.200 . 5.500 4.733 3.889 6.033 0.533 15 1 "[ . 1 +]" 1
1929 1 109 LEU HA 1 111 LEU MD1 2.600 . 5.500 4.235 3.866 4.543 . 0 0 "[ . 1 .]" 1
1930 1 109 LEU HB2 1 109 LEU QD 2.000 . 2.500 2.420 2.341 2.474 . 0 0 "[ . 1 .]" 1
1931 1 109 LEU HB2 1 109 LEU MD2 2.400 . 5.500 3.178 3.170 3.187 . 0 0 "[ . 1 .]" 1
1932 1 109 LEU HB2 1 109 LEU HG 2.000 . 2.500 2.348 2.324 2.388 . 0 0 "[ . 1 .]" 1
1933 1 109 LEU HB2 1 110 ASP H 2.900 . 4.000 2.654 2.407 3.242 . 0 0 "[ . 1 .]" 1
1934 1 109 LEU HB2 1 111 LEU MD1 2.700 . 3.600 3.299 2.925 3.594 . 0 0 "[ . 1 .]" 1
1935 1 109 LEU HB3 1 109 LEU QD 2.400 . 3.100 2.049 1.983 2.129 . 0 0 "[ . 1 .]" 1
1936 1 109 LEU HB3 1 109 LEU HG 2.300 . 3.000 3.001 2.991 3.009 0.009 1 0 "[ . 1 .]" 1
1937 1 109 LEU HB3 1 110 ASP H 2.800 . 3.800 2.652 1.723 3.213 0.077 1 0 "[ . 1 .]" 1
1938 1 109 LEU HB3 1 111 LEU MD1 2.600 . 3.400 2.210 1.915 2.426 . 0 0 "[ . 1 .]" 1
1939 1 109 LEU QD 1 110 ASP H 2.800 . 5.500 3.723 2.652 4.093 . 0 0 "[ . 1 .]" 1
1940 1 109 LEU MD1 1 110 ASP H 3.400 . 4.800 4.213 3.271 4.695 . 0 0 "[ . 1 .]" 1
1941 1 109 LEU MD1 1 111 LEU MD1 2.100 . 2.700 2.179 1.690 2.455 . 0 0 "[ . 1 .]" 1
1942 1 109 LEU HG 1 111 LEU MD1 2.300 . 5.500 4.306 4.011 4.490 . 0 0 "[ . 1 .]" 1
1943 1 110 ASP H 1 110 ASP HA 2.100 . 2.700 2.342 2.271 2.790 0.090 1 0 "[ . 1 .]" 1
1944 1 110 ASP H 1 110 ASP HB2 2.600 . 3.400 3.157 3.009 3.999 0.599 15 1 "[ . 1 +]" 1
1945 1 110 ASP H 1 110 ASP HB3 2.600 . 5.500 3.683 3.062 3.945 . 0 0 "[ . 1 .]" 1
1946 1 110 ASP HA 1 110 ASP HB2 2.200 . 2.800 2.629 2.440 2.775 . 0 0 "[ . 1 .]" 1
1947 1 110 ASP HA 1 110 ASP HB3 2.400 . 3.100 2.943 2.362 3.026 . 0 0 "[ . 1 .]" 1
1948 1 110 ASP HA 1 111 LEU H 2.300 . 3.000 2.259 2.209 2.299 . 0 0 "[ . 1 .]" 1
1949 1 110 ASP HA 1 111 LEU MD1 2.500 . 5.500 3.726 3.523 3.936 . 0 0 "[ . 1 .]" 1
1950 1 110 ASP HA 1 112 SER H 3.200 . 4.500 3.738 3.241 4.107 . 0 0 "[ . 1 .]" 1
1951 1 110 ASP HB2 1 111 LEU H 3.400 . 4.800 4.598 4.073 4.673 . 0 0 "[ . 1 .]" 1
1952 1 110 ASP HB3 1 111 LEU H 3.500 . 5.000 4.350 4.219 4.507 . 0 0 "[ . 1 .]" 1
1953 1 111 LEU H 1 111 LEU HA 3.000 . 4.100 2.897 2.885 2.922 . 0 0 "[ . 1 .]" 1
1954 1 111 LEU H 1 111 LEU HB2 3.400 . 4.800 2.201 2.147 2.254 . 0 0 "[ . 1 .]" 1
1955 1 111 LEU H 1 111 LEU HB3 3.000 . 4.100 3.484 3.432 3.535 . 0 0 "[ . 1 .]" 1
1956 1 111 LEU H 1 111 LEU MD1 2.900 . 4.000 2.288 1.966 2.643 . 0 0 "[ . 1 .]" 1
1957 1 111 LEU H 1 111 LEU MD2 3.300 . 4.700 4.128 4.019 4.243 . 0 0 "[ . 1 .]" 1
1958 1 111 LEU H 1 111 LEU HG 2.700 . 5.500 4.052 3.852 4.233 . 0 0 "[ . 1 .]" 1
1959 1 111 LEU H 1 112 SER H 2.600 . 3.400 3.228 2.795 3.414 0.014 4 0 "[ . 1 .]" 1
1960 1 111 LEU HA 1 111 LEU HB2 2.300 . 3.000 2.975 2.954 2.997 . 0 0 "[ . 1 .]" 1
1961 1 111 LEU HA 1 111 LEU HB3 2.500 . 3.300 2.665 2.609 2.712 . 0 0 "[ . 1 .]" 1
1962 1 111 LEU HA 1 111 LEU MD1 2.300 . 3.000 2.736 2.599 2.965 . 0 0 "[ . 1 .]" 1
1963 1 111 LEU HA 1 111 LEU MD2 2.800 . 3.800 3.717 3.640 3.777 . 0 0 "[ . 1 .]" 1
1964 1 111 LEU HA 1 111 LEU HG 2.300 . 3.000 2.367 2.276 2.464 . 0 0 "[ . 1 .]" 1
1965 1 111 LEU HA 1 112 SER H 2.800 . 3.800 2.760 2.582 3.036 . 0 0 "[ . 1 .]" 1
1966 1 111 LEU HA 1 114 LEU H 3.200 . 4.500 3.898 3.617 4.337 . 0 0 "[ . 1 .]" 1
1967 1 111 LEU HA 1 114 LEU QD 2.600 . 3.400 2.897 2.540 3.196 . 0 0 "[ . 1 .]" 1
1968 1 111 LEU HB2 1 111 LEU MD1 2.400 . 3.100 2.252 2.094 2.360 . 0 0 "[ . 1 .]" 1
1969 1 111 LEU HB2 1 111 LEU MD2 2.400 . 3.100 2.486 2.362 2.608 . 0 0 "[ . 1 .]" 1
1970 1 111 LEU HB2 1 111 LEU HG 2.700 . 3.600 3.014 3.002 3.022 . 0 0 "[ . 1 .]" 1
1971 1 111 LEU HB3 1 111 LEU MD1 2.500 . 3.300 3.174 3.149 3.188 . 0 0 "[ . 1 .]" 1
1972 1 111 LEU HB3 1 111 LEU MD2 2.500 . 3.300 2.173 2.049 2.298 . 0 0 "[ . 1 .]" 1
1973 1 111 LEU HB3 1 111 LEU HG 2.900 . 4.000 2.532 2.474 2.595 . 0 0 "[ . 1 .]" 1
1974 1 111 LEU HB3 1 112 SER H 3.300 . 4.700 4.314 4.234 4.345 . 0 0 "[ . 1 .]" 1
1975 1 111 LEU HB3 1 114 LEU QD 2.400 . 3.100 2.199 1.512 2.924 0.188 14 0 "[ . 1 .]" 1
1976 1 111 LEU MD1 1 111 LEU MD2 1.700 . 2.200 1.957 1.859 2.062 . 0 0 "[ . 1 .]" 1
1977 1 111 LEU MD2 1 111 LEU HG 2.000 . 2.500 2.097 2.082 2.126 . 0 0 "[ . 1 .]" 1
1978 1 111 LEU MD2 1 114 LEU QD 2.100 . 2.700 2.074 1.706 2.500 0.094 6 0 "[ . 1 .]" 1
1979 1 111 LEU HG 1 112 SER H 3.500 . 5.500 5.069 4.926 5.212 . 0 0 "[ . 1 .]" 1
1980 1 111 LEU HG 1 114 LEU QD 2.500 . 3.300 2.265 1.910 2.583 . 0 0 "[ . 1 .]" 1
1981 1 112 SER H 1 112 SER HA 2.500 . 3.300 2.916 2.870 2.948 . 0 0 "[ . 1 .]" 1
1982 1 112 SER H 1 112 SER QB 2.600 . 3.400 2.479 2.193 2.783 . 0 0 "[ . 1 .]" 1
1983 1 112 SER H 1 113 SER H 2.700 . 3.600 2.309 1.901 2.627 . 0 0 "[ . 1 .]" 1
1984 1 112 SER HA 1 113 SER H 2.700 . 3.600 2.657 2.495 2.917 . 0 0 "[ . 1 .]" 1
1985 1 112 SER HA 1 117 SER HB2 2.600 . 3.400 2.987 2.342 3.923 0.523 6 1 "[ .+ 1 .]" 1
1986 1 112 SER QB 1 113 SER H 2.800 . 3.800 3.454 2.986 3.820 0.020 5 0 "[ . 1 .]" 1
1987 1 113 SER H 1 114 LEU H 2.800 . 3.800 2.343 2.020 2.608 . 0 0 "[ . 1 .]" 1
1988 1 113 SER HA 1 113 SER HB2 2.000 . 2.500 2.473 2.423 2.563 0.063 13 0 "[ . 1 .]" 1
1989 1 113 SER HA 1 113 SER QB 1.900 . 2.400 2.191 2.174 2.193 . 0 0 "[ . 1 .]" 1
1990 1 113 SER HA 1 113 SER HB3 2.000 . 2.500 2.450 2.350 2.500 . 0 0 "[ . 1 .]" 1
1991 1 113 SER HA 1 114 LEU H 3.000 . 4.100 3.285 2.897 3.373 . 0 0 "[ . 1 .]" 1
1992 1 113 SER HB2 1 114 LEU H 3.100 . 4.300 4.250 4.137 4.360 0.060 13 0 "[ . 1 .]" 1
1993 1 114 LEU H 1 114 LEU HA 2.600 . 3.400 2.848 2.815 2.911 . 0 0 "[ . 1 .]" 1
1994 1 114 LEU H 1 114 LEU HB2 2.200 . 2.800 2.351 2.050 2.780 . 0 0 "[ . 1 .]" 1
1995 1 114 LEU H 1 114 LEU HB3 2.700 . 3.600 3.409 3.075 3.593 . 0 0 "[ . 1 .]" 1
1996 1 114 LEU H 1 114 LEU QD 2.800 . 3.800 2.777 2.360 3.211 . 0 0 "[ . 1 .]" 1
1997 1 114 LEU H 1 115 ALA H 3.200 . 5.500 4.397 2.428 4.605 . 0 0 "[ . 1 .]" 1
1998 1 114 LEU H 1 117 SER HB3 3.300 . 4.700 3.613 2.985 4.192 . 0 0 "[ . 1 .]" 1
1999 1 114 LEU HA 1 114 LEU HB2 2.600 . 3.400 2.928 2.768 3.012 . 0 0 "[ . 1 .]" 1
2000 1 114 LEU HA 1 114 LEU HB2 2.300 . 3.000 2.530 2.305 2.806 . 0 0 "[ . 1 .]" 1
2001 1 114 LEU HA 1 114 LEU HB3 2.300 . 3.000 2.625 2.328 2.917 . 0 0 "[ . 1 .]" 1
2002 1 114 LEU HA 1 114 LEU QD 1.900 . 2.400 2.196 2.003 2.392 . 0 0 "[ . 1 .]" 1
2003 1 114 LEU HA 1 115 ALA H 2.400 . 3.100 2.641 2.487 3.167 0.067 13 0 "[ . 1 .]" 1
2004 1 114 LEU HB2 1 114 LEU QD 2.400 . 3.100 2.141 2.063 2.311 . 0 0 "[ . 1 .]" 1
2005 1 114 LEU HB2 1 114 LEU QD 2.100 . 2.700 1.761 1.747 1.791 . 0 0 "[ . 1 .]" 1
2006 1 114 LEU HB2 1 115 ALA H 2.800 . 3.800 3.390 2.441 3.860 0.060 13 0 "[ . 1 .]" 1
2007 1 114 LEU HB3 1 114 LEU QD 2.200 . 2.800 2.208 2.072 2.370 . 0 0 "[ . 1 .]" 1
2008 1 114 LEU HB3 1 115 ALA H 2.800 . 3.800 2.368 2.013 3.850 0.050 13 0 "[ . 1 .]" 1
2009 1 114 LEU MD1 1 114 LEU MD2 1.900 . 2.400 2.030 1.913 2.085 . 0 0 "[ . 1 .]" 1
2010 1 114 LEU QD 1 115 ALA H 3.200 . 4.500 3.454 2.966 4.206 . 0 0 "[ . 1 .]" 1
2011 1 115 ALA H 1 115 ALA MB 2.400 . 3.100 2.257 2.118 2.960 . 0 0 "[ . 1 .]" 1
2012 1 115 ALA HA 1 115 ALA MB 1.800 . 2.200 2.105 2.082 2.128 . 0 0 "[ . 1 .]" 1
2013 1 115 ALA HA 1 116 TYR H 2.000 . 2.500 2.195 2.162 2.243 . 0 0 "[ . 1 .]" 1
2014 1 115 ALA HA 1 117 SER H 3.000 . 4.100 3.515 3.304 3.876 . 0 0 "[ . 1 .]" 1
2015 1 115 ALA MB 1 116 TYR H 2.600 . 3.400 2.930 2.747 3.068 . 0 0 "[ . 1 .]" 1
2016 1 115 ALA MB 1 116 TYR QD 2.300 . 3.000 2.786 2.403 3.002 0.002 14 0 "[ . 1 .]" 1
2017 1 115 ALA MB 1 116 TYR QE 2.500 . 5.500 3.789 3.195 4.208 . 0 0 "[ . 1 .]" 1
2018 1 116 TYR H 1 116 TYR HA 2.300 . 3.000 2.273 2.268 2.277 . 0 0 "[ . 1 .]" 1
2019 1 116 TYR H 1 116 TYR QB 3.100 . 4.300 3.284 3.223 3.367 . 0 0 "[ . 1 .]" 1
2020 1 116 TYR H 1 116 TYR QD 2.800 . 3.800 3.586 3.444 3.697 . 0 0 "[ . 1 .]" 1
2021 1 116 TYR H 1 117 SER H 2.700 . 3.600 2.722 2.665 2.810 . 0 0 "[ . 1 .]" 1
2022 1 116 TYR HA 1 116 TYR QB 2.300 . 3.000 2.400 2.326 2.449 . 0 0 "[ . 1 .]" 1
2023 1 116 TYR HA 1 116 TYR QD 2.100 . 2.700 2.441 2.239 2.662 . 0 0 "[ . 1 .]" 1
2024 1 116 TYR HA 1 116 TYR QE 2.600 . 5.500 4.445 4.335 4.616 . 0 0 "[ . 1 .]" 1
2025 1 116 TYR HA 1 117 SER H 2.700 . 3.600 2.903 2.711 3.009 . 0 0 "[ . 1 .]" 1
2026 1 116 TYR QB 1 116 TYR QD 2.400 . 3.100 2.145 2.136 2.158 . 0 0 "[ . 1 .]" 1
2027 1 117 SER H 1 117 SER HA 2.700 . 3.600 2.895 2.827 2.948 . 0 0 "[ . 1 .]" 1
2028 1 117 SER H 1 117 SER HB2 2.700 . 5.500 3.494 2.147 3.748 . 0 0 "[ . 1 .]" 1
2029 1 117 SER H 1 117 SER HB3 2.500 . 3.300 2.858 2.248 3.234 . 0 0 "[ . 1 .]" 1
2030 1 117 SER H 1 118 GLY H 2.700 . 3.600 2.785 2.240 3.623 0.023 6 0 "[ . 1 .]" 1
2031 1 117 SER HA 1 117 SER HB2 2.100 . 2.700 2.528 2.248 2.827 0.127 6 0 "[ . 1 .]" 1
2032 1 117 SER HA 1 117 SER HB3 2.100 . 2.700 2.469 2.291 2.917 0.217 12 0 "[ . 1 .]" 1
2033 1 117 SER HA 1 118 GLY H 3.300 . 4.700 3.242 2.385 3.570 . 0 0 "[ . 1 .]" 1
2034 1 117 SER HA 1 120 ASP H 3.200 . 5.500 5.316 4.422 5.522 0.022 12 0 "[ . 1 .]" 1
2035 1 118 GLY H 1 118 GLY HA2 2.400 . 3.100 2.583 2.293 2.953 . 0 0 "[ . 1 .]" 1
2036 1 118 GLY H 1 118 GLY HA3 2.700 . 3.600 2.710 2.301 2.936 . 0 0 "[ . 1 .]" 1
2037 1 118 GLY H 1 119 LYS H 2.400 . 3.100 2.479 1.697 3.120 0.020 15 0 "[ . 1 .]" 1
2038 1 118 GLY HA2 1 119 LYS H 2.900 . 4.000 3.163 2.691 3.564 . 0 0 "[ . 1 .]" 1
2039 1 118 GLY HA3 1 119 LYS H 2.500 . 3.300 3.281 2.584 3.556 0.256 10 0 "[ . 1 .]" 1
2040 1 119 LYS H 1 119 LYS HA 2.200 . 2.800 2.477 2.272 2.927 0.127 15 0 "[ . 1 .]" 1
2041 1 119 LYS H 1 119 LYS HB2 2.700 . 3.600 3.337 2.460 3.967 0.367 10 0 "[ . 1 .]" 1
2042 1 119 LYS H 1 119 LYS QG 2.600 . 3.400 2.595 1.778 3.534 0.134 4 0 "[ . 1 .]" 1
2043 1 119 LYS H 1 120 ASP H 3.000 . 4.100 2.761 2.337 3.275 . 0 0 "[ . 1 .]" 1
2044 1 119 LYS HA 1 119 LYS HB3 2.000 . 2.500 2.457 2.234 2.919 0.419 4 0 "[ . 1 .]" 1
2045 1 119 LYS HA 1 119 LYS QD 2.300 . 5.500 4.090 3.776 4.417 . 0 0 "[ . 1 .]" 1
2046 1 119 LYS HA 1 119 LYS QG 2.400 . 3.100 2.635 2.220 3.302 0.202 3 0 "[ . 1 .]" 1
2047 1 119 LYS HA 1 120 ASP H 2.500 . 3.300 2.909 2.482 3.339 0.039 3 0 "[ . 1 .]" 1
2048 1 119 LYS HB2 1 119 LYS QD 2.200 . 2.800 2.484 2.034 2.862 0.062 10 0 "[ . 1 .]" 1
2049 1 119 LYS HB2 1 119 LYS QE 2.900 . 4.000 3.200 2.471 4.016 0.016 8 0 "[ . 1 .]" 1
2050 1 119 LYS HB2 1 119 LYS QG 2.400 . 3.100 2.323 2.185 2.521 . 0 0 "[ . 1 .]" 1
2051 1 119 LYS HB2 1 120 ASP H 3.000 . 5.500 4.086 3.399 4.509 . 0 0 "[ . 1 .]" 1
2052 1 119 LYS HB3 1 119 LYS QE 2.900 . 4.000 3.097 1.986 3.964 . 0 0 "[ . 1 .]" 1
2053 1 119 LYS HB3 1 119 LYS QG 2.100 . 2.700 2.353 2.131 2.493 . 0 0 "[ . 1 .]" 1
2054 1 119 LYS HB3 1 120 ASP H 3.300 . 4.700 4.415 4.200 4.665 . 0 0 "[ . 1 .]" 1
2055 1 119 LYS QD 1 119 LYS HE3 2.200 . 2.800 2.106 2.087 2.132 . 0 0 "[ . 1 .]" 1
2056 1 119 LYS QD 1 119 LYS QG 1.900 . 2.400 2.033 2.023 2.086 . 0 0 "[ . 1 .]" 1
2057 1 119 LYS QE 1 119 LYS HG2 2.600 . 3.400 2.404 1.957 3.066 . 0 0 "[ . 1 .]" 1
2058 1 119 LYS QG 1 120 ASP H 3.100 . 5.500 4.219 2.661 4.530 . 0 0 "[ . 1 .]" 1
2059 1 120 ASP H 1 120 ASP HA 2.600 . 3.400 2.615 2.271 2.947 . 0 0 "[ . 1 .]" 1
2060 1 120 ASP H 1 120 ASP HB2 3.100 . 4.300 3.190 2.311 3.923 . 0 0 "[ . 1 .]" 1
2061 1 120 ASP H 1 120 ASP HB3 2.700 . 3.600 3.335 2.742 3.859 0.259 9 0 "[ . 1 .]" 1
2062 1 120 ASP H 1 121 ALA H 3.100 . 4.300 3.663 1.930 4.307 0.007 7 0 "[ . 1 .]" 1
2063 1 120 ASP HA 1 120 ASP HB2 2.300 . 3.000 2.641 2.415 2.945 . 0 0 "[ . 1 .]" 1
2064 1 120 ASP HA 1 120 ASP HB3 2.200 . 2.800 2.760 2.238 3.025 0.225 15 0 "[ . 1 .]" 1
2065 1 120 ASP HA 1 121 ALA H 2.700 . 3.600 2.571 2.140 3.505 . 0 0 "[ . 1 .]" 1
2066 1 120 ASP HA 1 121 ALA HA 2.800 . 5.500 4.543 4.336 5.282 . 0 0 "[ . 1 .]" 1
2067 1 121 ALA H 1 121 ALA HA 2.700 . 3.600 2.795 2.274 2.949 . 0 0 "[ . 1 .]" 1
2068 1 121 ALA H 1 121 ALA MB 2.600 . 3.400 2.524 2.151 2.871 . 0 0 "[ . 1 .]" 1
2069 1 121 ALA HA 1 121 ALA MB 1.800 . 2.200 2.105 2.085 2.127 . 0 0 "[ . 1 .]" 1
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