NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
426274 |
2h3k   |
6759 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2h3k
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 1635
_Distance_constraint_stats_list.Viol_count 1620
_Distance_constraint_stats_list.Viol_total 942.735
_Distance_constraint_stats_list.Viol_max 0.173
_Distance_constraint_stats_list.Viol_rms 0.0090
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0014
_Distance_constraint_stats_list.Viol_average_violations_only 0.0291
_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 2 ASP 0.017 0.017 9 0 "[ . 1 . 2]"
1 3 GLU 1.068 0.058 10 0 "[ . 1 . 2]"
1 4 SER 0.908 0.089 10 0 "[ . 1 . 2]"
1 5 LEU 0.352 0.089 10 0 "[ . 1 . 2]"
1 6 LYS 0.697 0.062 15 0 "[ . 1 . 2]"
1 7 ASP 0.397 0.062 15 0 "[ . 1 . 2]"
1 8 ALA 0.045 0.026 13 0 "[ . 1 . 2]"
1 9 ILE 0.046 0.018 19 0 "[ . 1 . 2]"
1 10 LYS 0.064 0.030 11 0 "[ . 1 . 2]"
1 11 ASP 0.055 0.016 11 0 "[ . 1 . 2]"
1 12 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 ALA 0.057 0.023 3 0 "[ . 1 . 2]"
1 14 LEU 0.350 0.092 15 0 "[ . 1 . 2]"
1 15 GLU 0.023 0.008 11 0 "[ . 1 . 2]"
1 16 ASN 0.015 0.015 16 0 "[ . 1 . 2]"
1 17 LYS 0.047 0.014 10 0 "[ . 1 . 2]"
1 18 GLU 0.090 0.031 3 0 "[ . 1 . 2]"
1 19 HIS 0.123 0.038 3 0 "[ . 1 . 2]"
1 20 ASP 0.030 0.023 16 0 "[ . 1 . 2]"
1 21 ILE 0.387 0.046 10 0 "[ . 1 . 2]"
1 22 GLY 0.153 0.046 10 0 "[ . 1 . 2]"
1 23 PRO 0.075 0.025 2 0 "[ . 1 . 2]"
1 24 ARG 0.285 0.041 2 0 "[ . 1 . 2]"
1 25 GLU 0.059 0.026 14 0 "[ . 1 . 2]"
1 26 GLN 0.242 0.066 16 0 "[ . 1 . 2]"
1 27 VAL 1.959 0.100 4 0 "[ . 1 . 2]"
1 28 ASN 0.192 0.045 17 0 "[ . 1 . 2]"
1 29 PHE 0.997 0.056 6 0 "[ . 1 . 2]"
1 30 GLN 1.271 0.063 1 0 "[ . 1 . 2]"
1 31 LEU 0.169 0.026 20 0 "[ . 1 . 2]"
1 32 LEU 0.697 0.063 1 0 "[ . 1 . 2]"
1 33 ASP 0.034 0.021 11 0 "[ . 1 . 2]"
1 34 LYS 0.092 0.025 16 0 "[ . 1 . 2]"
1 35 ASN 0.070 0.022 6 0 "[ . 1 . 2]"
1 36 ASN 0.144 0.022 6 0 "[ . 1 . 2]"
1 37 GLU 0.083 0.029 16 0 "[ . 1 . 2]"
1 38 THR 0.026 0.006 13 0 "[ . 1 . 2]"
1 39 GLN 0.042 0.011 5 0 "[ . 1 . 2]"
1 45 SER 0.300 0.168 7 0 "[ . 1 . 2]"
1 46 ILE 0.645 0.168 7 0 "[ . 1 . 2]"
1 47 LYS 0.340 0.046 6 0 "[ . 1 . 2]"
1 48 ASP 1.356 0.118 18 0 "[ . 1 . 2]"
1 49 PRO 0.760 0.118 18 0 "[ . 1 . 2]"
1 50 ALA 0.461 0.041 5 0 "[ . 1 . 2]"
1 51 ASP 1.057 0.100 4 0 "[ . 1 . 2]"
1 52 VAL 0.553 0.060 3 0 "[ . 1 . 2]"
1 53 TYR 0.271 0.067 16 0 "[ . 1 . 2]"
1 54 TYR 0.979 0.098 16 0 "[ . 1 . 2]"
1 55 THR 0.047 0.020 13 0 "[ . 1 . 2]"
1 56 LYS 0.109 0.049 1 0 "[ . 1 . 2]"
1 57 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 LYS 0.574 0.068 5 0 "[ . 1 . 2]"
1 59 ALA 0.557 0.052 10 0 "[ . 1 . 2]"
1 60 GLU 0.562 0.067 16 0 "[ . 1 . 2]"
1 61 VAL 0.005 0.004 13 0 "[ . 1 . 2]"
1 62 GLU 0.084 0.032 7 0 "[ . 1 . 2]"
1 63 LEU 0.031 0.015 6 0 "[ . 1 . 2]"
1 64 ASP 0.353 0.046 6 0 "[ . 1 . 2]"
1 65 ILE 0.827 0.078 13 0 "[ . 1 . 2]"
1 66 ASN 0.083 0.025 10 0 "[ . 1 . 2]"
1 67 THR 0.840 0.051 13 0 "[ . 1 . 2]"
1 68 ALA 0.608 0.069 13 0 "[ . 1 . 2]"
1 69 SER 0.009 0.009 19 0 "[ . 1 . 2]"
1 70 THR 0.261 0.051 13 0 "[ . 1 . 2]"
1 71 TRP 0.188 0.027 4 0 "[ . 1 . 2]"
1 72 LYS 0.023 0.010 7 0 "[ . 1 . 2]"
1 73 LYS 0.024 0.013 4 0 "[ . 1 . 2]"
1 74 PHE 2.546 0.099 17 0 "[ . 1 . 2]"
1 75 GLU 0.140 0.041 18 0 "[ . 1 . 2]"
1 76 VAL 0.584 0.083 7 0 "[ . 1 . 2]"
1 77 TYR 0.072 0.038 12 0 "[ . 1 . 2]"
1 78 GLU 0.252 0.049 2 0 "[ . 1 . 2]"
1 79 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 GLN 0.022 0.022 11 0 "[ . 1 . 2]"
1 82 LYS 0.311 0.048 19 0 "[ . 1 . 2]"
1 83 LEU 0.245 0.056 6 0 "[ . 1 . 2]"
1 84 PRO 0.008 0.008 15 0 "[ . 1 . 2]"
1 85 VAL 1.220 0.090 5 0 "[ . 1 . 2]"
1 86 ARG 1.294 0.096 14 0 "[ . 1 . 2]"
1 87 LEU 0.097 0.042 12 0 "[ . 1 . 2]"
1 88 VAL 0.995 0.157 13 0 "[ . 1 . 2]"
1 89 SER 0.477 0.072 7 0 "[ . 1 . 2]"
1 90 TYR 6.116 0.167 4 0 "[ . 1 . 2]"
1 91 SER 1.251 0.095 10 0 "[ . 1 . 2]"
1 92 PRO 3.028 0.167 4 0 "[ . 1 . 2]"
1 93 VAL 0.805 0.079 17 0 "[ . 1 . 2]"
1 94 PRO 0.010 0.010 19 0 "[ . 1 . 2]"
1 95 GLU 0.969 0.095 10 0 "[ . 1 . 2]"
1 96 ASP 2.968 0.096 19 0 "[ . 1 . 2]"
1 97 HIS 0.329 0.040 1 0 "[ . 1 . 2]"
1 98 ALA 1.760 0.094 4 0 "[ . 1 . 2]"
1 99 TYR 0.186 0.046 12 0 "[ . 1 . 2]"
1 100 ILE 0.932 0.078 13 0 "[ . 1 . 2]"
1 101 ARG 0.230 0.047 3 0 "[ . 1 . 2]"
1 102 PHE 0.655 0.056 6 0 "[ . 1 . 2]"
1 103 PRO 0.122 0.033 2 0 "[ . 1 . 2]"
1 104 VAL 4.680 0.142 15 0 "[ . 1 . 2]"
1 105 SER 2.334 0.142 15 0 "[ . 1 . 2]"
1 106 ASP 1.227 0.068 5 0 "[ . 1 . 2]"
1 107 GLY 1.067 0.065 11 0 "[ . 1 . 2]"
1 108 THR 3.360 0.076 4 0 "[ . 1 . 2]"
1 109 GLN 0.937 0.076 4 0 "[ . 1 . 2]"
1 110 GLU 0.803 0.109 1 0 "[ . 1 . 2]"
1 111 LEU 2.849 0.173 4 0 "[ . 1 . 2]"
1 112 LYS 0.392 0.049 2 0 "[ . 1 . 2]"
1 113 ILE 0.548 0.044 15 0 "[ . 1 . 2]"
1 114 VAL 1.983 0.099 17 0 "[ . 1 . 2]"
1 115 SER 0.279 0.060 7 0 "[ . 1 . 2]"
1 116 SER 0.088 0.038 17 0 "[ . 1 . 2]"
1 117 THR 0.108 0.027 4 0 "[ . 1 . 2]"
1 118 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 119 ILE 0.055 0.016 1 0 "[ . 1 . 2]"
1 121 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 122 GLY 0.021 0.011 10 0 "[ . 1 . 2]"
1 123 GLU 0.010 0.010 10 0 "[ . 1 . 2]"
1 124 GLU 0.077 0.038 17 0 "[ . 1 . 2]"
1 125 THR 0.120 0.046 7 0 "[ . 1 . 2]"
1 126 ASN 0.109 0.046 7 0 "[ . 1 . 2]"
1 127 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 128 ASP 0.024 0.024 4 0 "[ . 1 . 2]"
1 129 TYR 0.236 0.032 13 0 "[ . 1 . 2]"
1 130 THR 0.144 0.023 9 0 "[ . 1 . 2]"
1 131 LYS 0.024 0.024 10 0 "[ . 1 . 2]"
1 132 LEU 0.271 0.031 2 0 "[ . 1 . 2]"
1 133 VAL 0.365 0.044 15 0 "[ . 1 . 2]"
1 134 PHE 1.820 0.069 14 0 "[ . 1 . 2]"
1 135 ALA 2.496 0.118 1 0 "[ . 1 . 2]"
1 136 LYS 1.817 0.118 1 0 "[ . 1 . 2]"
1 137 PRO 0.699 0.044 7 0 "[ . 1 . 2]"
1 138 ILE 5.985 0.096 15 0 "[ . 1 . 2]"
1 139 TYR 0.466 0.031 5 0 "[ . 1 . 2]"
1 140 ASN 0.246 0.039 14 0 "[ . 1 . 2]"
1 141 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 142 PRO 0.156 0.039 14 0 "[ . 1 . 2]"
1 143 SER 0.913 0.081 15 0 "[ . 1 . 2]"
1 144 LEU 0.980 0.081 15 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 13 ALA H 1 15 GLU H 4.800 . 4.800 4.033 3.634 4.426 . 0 0 "[ . 1 . 2]" 1
2 1 34 LYS HA 1 34 LYS QD 3.940 . 3.940 3.666 3.242 3.965 0.025 16 0 "[ . 1 . 2]" 1
3 1 90 TYR H 1 90 TYR QD 4.940 . 4.940 3.831 3.719 3.899 . 0 0 "[ . 1 . 2]" 1
4 1 54 TYR QB 1 59 ALA HA 4.360 . 4.360 4.068 3.893 4.304 . 0 0 "[ . 1 . 2]" 1
5 1 86 ARG QD 1 102 PHE H 5.500 . 5.500 4.884 4.276 5.524 0.024 7 0 "[ . 1 . 2]" 1
6 1 111 LEU H 1 134 PHE QD 5.500 . 5.500 5.081 4.824 5.376 . 0 0 "[ . 1 . 2]" 1
7 1 59 ALA H 1 138 ILE MG 5.500 . 5.500 4.720 4.359 5.145 . 0 0 "[ . 1 . 2]" 1
8 1 78 GLU H 1 108 THR MG 5.500 . 5.500 5.404 5.032 5.526 0.026 9 0 "[ . 1 . 2]" 1
9 1 111 LEU QB 1 134 PHE QE 4.810 . 4.810 4.556 4.336 4.818 0.008 9 0 "[ . 1 . 2]" 1
10 1 77 TYR QB 1 112 LYS H 5.500 . 5.500 4.327 3.899 4.755 . 0 0 "[ . 1 . 2]" 1
11 1 47 LYS H 1 47 LYS QE 4.680 . 4.680 4.522 4.289 4.689 0.009 7 0 "[ . 1 . 2]" 1
12 1 16 ASN H 1 90 TYR H 4.790 . 4.790 3.353 2.348 4.488 . 0 0 "[ . 1 . 2]" 1
13 1 83 LEU QD 1 103 PRO QG 3.630 . 3.630 2.243 1.847 2.664 . 0 0 "[ . 1 . 2]" 1
14 1 58 LYS QE 1 105 SER HA 3.440 . 3.440 2.111 1.843 2.498 . 0 0 "[ . 1 . 2]" 1
15 1 88 VAL QG 1 101 ARG H 5.130 . 5.130 3.668 3.004 4.088 . 0 0 "[ . 1 . 2]" 1
16 1 109 GLN QG 1 137 PRO HA 4.250 . 4.250 2.623 2.142 3.107 . 0 0 "[ . 1 . 2]" 1
17 1 27 VAL QG 1 50 ALA H 5.500 . 5.500 4.156 3.551 4.557 . 0 0 "[ . 1 . 2]" 1
18 1 14 LEU QD 1 87 LEU QD 2.680 . 2.680 2.244 1.792 2.687 0.008 15 0 "[ . 1 . 2]" 1
19 1 134 PHE QE 1 138 ILE H 5.500 . 5.500 5.546 5.530 5.569 0.069 14 0 "[ . 1 . 2]" 1
20 1 46 ILE H 1 46 ILE MD 5.340 . 5.340 2.091 1.863 2.867 . 0 0 "[ . 1 . 2]" 1
21 1 61 VAL QG 1 62 GLU H 3.850 . 3.850 2.192 1.922 2.559 . 0 0 "[ . 1 . 2]" 1
22 1 83 LEU HA 1 103 PRO QG 5.040 . 5.040 4.550 4.105 5.005 . 0 0 "[ . 1 . 2]" 1
23 1 34 LYS QG 1 35 ASN QD 5.500 . 5.500 4.092 2.330 5.044 . 0 0 "[ . 1 . 2]" 1
24 1 76 VAL HA 1 113 ILE MD 4.860 . 4.860 4.692 4.491 4.884 0.024 1 0 "[ . 1 . 2]" 1
25 1 101 ARG HA 1 101 ARG QG 3.750 . 3.750 3.110 1.987 3.339 . 0 0 "[ . 1 . 2]" 1
26 1 18 GLU H 1 18 GLU QG 4.250 . 4.250 3.589 1.907 4.194 . 0 0 "[ . 1 . 2]" 1
27 1 123 GLU H 1 123 GLU QB 3.080 . 3.080 2.358 1.992 3.090 0.010 10 0 "[ . 1 . 2]" 1
28 1 132 LEU QD 1 133 VAL H 4.610 . 4.610 3.775 3.463 3.966 . 0 0 "[ . 1 . 2]" 1
29 1 15 GLU QG 1 16 ASN QB 4.790 . 4.790 3.122 2.098 4.692 . 0 0 "[ . 1 . 2]" 1
30 1 32 LEU QD 1 38 THR HA 3.020 . 3.020 2.542 1.913 3.026 0.006 13 0 "[ . 1 . 2]" 1
31 1 14 LEU HA 1 89 SER HA 4.010 . 4.010 2.610 2.246 3.032 . 0 0 "[ . 1 . 2]" 1
32 1 63 LEU H 1 101 ARG HA 5.190 . 5.190 3.606 3.105 4.009 . 0 0 "[ . 1 . 2]" 1
33 1 70 THR MG 1 119 ILE QG 3.880 . 3.880 2.249 1.801 2.617 . 0 0 "[ . 1 . 2]" 1
34 1 50 ALA MB 1 134 PHE QE 4.850 . 4.850 2.159 1.813 2.460 . 0 0 "[ . 1 . 2]" 1
35 1 64 ASP H 1 65 ILE H 5.500 . 5.500 4.408 4.066 4.609 . 0 0 "[ . 1 . 2]" 1
36 1 53 TYR QD 1 62 GLU H 5.380 . 5.380 3.931 3.257 4.729 . 0 0 "[ . 1 . 2]" 1
37 1 54 TYR HA 1 55 THR H 3.210 . 3.210 2.238 2.204 2.370 . 0 0 "[ . 1 . 2]" 1
38 1 99 TYR H 1 100 ILE H 5.500 . 5.500 4.385 4.154 4.586 . 0 0 "[ . 1 . 2]" 1
39 1 132 LEU HG 1 133 VAL HA 4.800 . 4.800 4.699 4.443 4.813 0.013 14 0 "[ . 1 . 2]" 1
40 1 4 SER QB 1 7 ASP H 4.620 . 4.620 2.491 2.035 3.368 . 0 0 "[ . 1 . 2]" 1
41 1 53 TYR H 1 61 VAL HA 4.910 . 4.910 3.370 3.162 3.541 . 0 0 "[ . 1 . 2]" 1
42 1 11 ASP QB 1 14 LEU QD 3.680 . 3.680 2.426 2.011 3.001 . 0 0 "[ . 1 . 2]" 1
43 1 15 GLU H 1 16 ASN H 5.020 . 5.020 3.488 2.136 4.532 . 0 0 "[ . 1 . 2]" 1
44 1 143 SER H 1 144 LEU H 3.070 . 3.070 2.167 1.914 2.680 . 0 0 "[ . 1 . 2]" 1
45 1 95 GLU HA 1 97 HIS HD2 3.750 . 3.750 3.453 2.896 3.663 . 0 0 "[ . 1 . 2]" 1
46 1 25 GLU QG 1 54 TYR QE 5.190 . 5.190 2.545 2.060 3.596 . 0 0 "[ . 1 . 2]" 1
47 1 82 LYS QE 1 114 VAL QG 3.460 . 3.460 2.037 1.807 2.306 . 0 0 "[ . 1 . 2]" 1
48 1 86 ARG QG 1 88 VAL QG 3.910 . 3.910 3.136 2.645 3.833 . 0 0 "[ . 1 . 2]" 1
49 1 119 ILE H 1 122 GLY H 5.500 . 5.500 5.072 4.658 5.511 0.011 10 0 "[ . 1 . 2]" 1
50 1 65 ILE MD 1 74 PHE QE 4.660 . 4.660 4.019 2.873 4.688 0.028 13 0 "[ . 1 . 2]" 1
51 1 60 GLU QB 1 61 VAL H 4.180 . 4.180 3.732 2.962 3.891 . 0 0 "[ . 1 . 2]" 1
52 1 29 PHE QD 1 30 GLN HA 4.830 . 4.830 4.004 3.911 4.102 . 0 0 "[ . 1 . 2]" 1
53 1 26 GLN H 1 26 GLN QG 4.730 . 4.730 2.385 1.907 3.157 . 0 0 "[ . 1 . 2]" 1
54 1 86 ARG QG 1 87 LEU HA 5.150 . 5.150 4.147 3.905 4.488 . 0 0 "[ . 1 . 2]" 1
55 1 116 SER HA 1 124 GLU QG 4.670 . 4.670 4.530 4.080 4.708 0.038 17 0 "[ . 1 . 2]" 1
56 1 59 ALA MB 1 140 ASN QB 3.480 . 3.480 2.708 2.052 3.434 . 0 0 "[ . 1 . 2]" 1
57 1 29 PHE QD 1 30 GLN H 4.240 . 4.240 4.226 4.113 4.273 0.033 1 0 "[ . 1 . 2]" 1
58 1 74 PHE QD 1 76 VAL QG 3.900 . 3.900 3.585 2.800 3.983 0.083 7 0 "[ . 1 . 2]" 1
59 1 27 VAL HB 1 134 PHE QD 4.310 . 4.310 4.275 4.144 4.347 0.037 8 0 "[ . 1 . 2]" 1
60 1 74 PHE QD 1 100 ILE MG 4.830 . 4.830 3.377 3.072 3.803 . 0 0 "[ . 1 . 2]" 1
61 1 85 VAL HB 1 100 ILE MD 4.790 . 4.790 4.070 3.637 4.457 . 0 0 "[ . 1 . 2]" 1
62 1 140 ASN HA 1 142 PRO QD 4.510 . 4.510 4.462 4.143 4.549 0.039 14 0 "[ . 1 . 2]" 1
63 1 112 LYS H 1 112 LYS QB 3.430 . 3.430 2.098 1.997 2.264 . 0 0 "[ . 1 . 2]" 1
64 1 54 TYR HA 1 60 GLU H 4.890 . 4.890 3.427 2.788 3.968 . 0 0 "[ . 1 . 2]" 1
65 1 88 VAL QG 1 99 TYR H 4.730 . 4.730 4.029 3.717 4.776 0.046 12 0 "[ . 1 . 2]" 1
66 1 136 LYS QD 1 138 ILE MD 5.370 . 5.370 4.509 2.214 5.284 . 0 0 "[ . 1 . 2]" 1
67 1 113 ILE MD 1 130 THR HB 3.880 . 3.880 3.546 3.011 3.889 0.009 15 0 "[ . 1 . 2]" 1
68 1 27 VAL H 1 52 VAL QG 4.910 . 4.910 3.679 3.069 4.060 . 0 0 "[ . 1 . 2]" 1
69 1 87 LEU HA 1 88 VAL QG 3.950 . 3.950 3.305 3.064 3.992 0.042 12 0 "[ . 1 . 2]" 1
70 1 112 LYS QG 1 129 TYR HA 4.600 . 4.600 4.074 3.517 4.562 . 0 0 "[ . 1 . 2]" 1
71 1 134 PHE QE 1 135 ALA H 5.500 . 5.500 5.265 5.025 5.404 . 0 0 "[ . 1 . 2]" 1
72 1 95 GLU QB 1 95 GLU QG 2.470 . 2.470 2.055 2.009 2.105 . 0 0 "[ . 1 . 2]" 1
73 1 97 HIS H 1 98 ALA MB 5.500 . 5.500 4.494 4.218 5.212 . 0 0 "[ . 1 . 2]" 1
74 1 85 VAL QG 1 102 PHE H 5.500 . 5.500 4.346 3.856 4.749 . 0 0 "[ . 1 . 2]" 1
75 1 38 THR H 1 38 THR HB 3.460 . 3.460 2.479 2.087 3.007 . 0 0 "[ . 1 . 2]" 1
76 1 70 THR H 1 71 TRP HE1 5.500 . 5.500 5.422 5.207 5.518 0.018 16 0 "[ . 1 . 2]" 1
77 1 65 ILE MG 1 68 ALA MB 4.830 . 4.830 2.561 2.181 2.935 . 0 0 "[ . 1 . 2]" 1
78 1 35 ASN H 1 129 TYR QE 5.500 . 5.500 4.662 4.303 4.997 . 0 0 "[ . 1 . 2]" 1
79 1 65 ILE H 1 99 TYR HA 4.970 . 4.970 3.540 3.054 4.311 . 0 0 "[ . 1 . 2]" 1
80 1 29 PHE HA 1 135 ALA HA 4.700 . 4.700 4.574 4.442 4.698 . 0 0 "[ . 1 . 2]" 1
81 1 87 LEU HA 1 101 ARG H 4.790 . 4.790 4.055 3.626 4.399 . 0 0 "[ . 1 . 2]" 1
82 1 76 VAL QG 1 102 PHE QD 4.410 . 4.410 3.299 2.894 3.713 . 0 0 "[ . 1 . 2]" 1
83 1 24 ARG H 1 25 GLU H 5.500 . 5.500 4.335 4.191 4.401 . 0 0 "[ . 1 . 2]" 1
84 1 9 ILE MD 1 90 TYR QE 4.280 . 4.280 2.633 2.209 3.133 . 0 0 "[ . 1 . 2]" 1
85 1 53 TYR QB 1 60 GLU QG 5.130 . 5.130 3.775 3.540 4.043 . 0 0 "[ . 1 . 2]" 1
86 1 57 LYS QB 1 58 LYS H 2.920 . 2.920 2.031 1.889 2.153 . 0 0 "[ . 1 . 2]" 1
87 1 76 VAL QG 1 85 VAL QG 3.500 . 3.500 3.014 1.908 3.514 0.014 18 0 "[ . 1 . 2]" 1
88 1 100 ILE H 1 100 ILE MG 4.250 . 4.250 2.734 2.461 2.946 . 0 0 "[ . 1 . 2]" 1
89 1 93 VAL H 1 96 ASP H 5.500 . 5.500 4.364 4.323 4.419 . 0 0 "[ . 1 . 2]" 1
90 1 137 PRO QB 1 139 TYR QE 3.460 . 3.460 2.328 2.125 2.650 . 0 0 "[ . 1 . 2]" 1
91 1 85 VAL QG 1 100 ILE HB 3.360 . 3.360 2.051 1.839 2.240 . 0 0 "[ . 1 . 2]" 1
92 1 74 PHE QD 1 115 SER QB 4.270 . 4.270 2.794 2.098 4.003 . 0 0 "[ . 1 . 2]" 1
93 1 29 PHE QD 1 50 ALA HA 4.720 . 4.720 3.800 3.292 4.224 . 0 0 "[ . 1 . 2]" 1
94 1 30 GLN HA 1 30 GLN QG 3.180 . 3.180 2.195 1.924 2.514 . 0 0 "[ . 1 . 2]" 1
95 1 116 SER QB 1 124 GLU QG 4.390 . 4.390 3.611 2.699 4.392 0.002 5 0 "[ . 1 . 2]" 1
96 1 65 ILE MD 1 100 ILE MD 3.410 . 3.410 3.257 2.807 3.488 0.078 13 0 "[ . 1 . 2]" 1
97 1 132 LEU QD 1 134 PHE QE 4.600 . 4.600 3.098 2.899 3.368 . 0 0 "[ . 1 . 2]" 1
98 1 106 ASP H 1 140 ASN H 5.500 . 5.500 5.191 4.475 5.501 0.001 2 0 "[ . 1 . 2]" 1
99 1 86 ARG H 1 102 PHE H 5.500 . 5.500 5.402 4.798 5.544 0.044 19 0 "[ . 1 . 2]" 1
100 1 72 LYS QB 1 72 LYS QE 4.100 . 4.100 3.098 1.907 3.709 . 0 0 "[ . 1 . 2]" 1
101 1 13 ALA H 1 14 LEU QD 5.500 . 5.500 4.182 3.554 4.577 . 0 0 "[ . 1 . 2]" 1
102 1 53 TYR QD 1 54 TYR H 5.500 . 5.500 4.688 3.971 4.836 . 0 0 "[ . 1 . 2]" 1
103 1 50 ALA HA 1 51 ASP H 3.040 . 3.040 2.291 2.205 2.479 . 0 0 "[ . 1 . 2]" 1
104 1 25 GLU QG 1 26 GLN H 4.090 . 4.090 3.668 2.901 3.987 . 0 0 "[ . 1 . 2]" 1
105 1 26 GLN HA 1 26 GLN QG 3.550 . 3.550 2.871 2.242 3.304 . 0 0 "[ . 1 . 2]" 1
106 1 90 TYR QD 1 92 PRO HA 4.200 . 4.200 4.004 3.927 4.110 . 0 0 "[ . 1 . 2]" 1
107 1 54 TYR HA 1 54 TYR QE 4.740 . 4.740 4.188 4.148 4.255 . 0 0 "[ . 1 . 2]" 1
108 1 22 GLY QA 1 23 PRO QG 4.800 . 4.800 3.701 3.677 3.728 . 0 0 "[ . 1 . 2]" 1
109 1 56 LYS H 1 56 LYS QB 3.420 . 3.420 2.199 1.968 2.477 . 0 0 "[ . 1 . 2]" 1
110 1 52 VAL HA 1 53 TYR H 3.530 . 3.530 2.229 2.202 2.286 . 0 0 "[ . 1 . 2]" 1
111 1 17 LYS HA 1 18 GLU H 3.170 . 3.170 2.516 2.249 2.911 . 0 0 "[ . 1 . 2]" 1
112 1 24 ARG HA 1 52 VAL H 5.440 . 5.440 4.551 3.714 5.237 . 0 0 "[ . 1 . 2]" 1
113 1 134 PHE H 1 134 PHE QD 4.100 . 4.100 3.166 2.975 3.249 . 0 0 "[ . 1 . 2]" 1
114 1 108 THR HB 1 138 ILE MG 4.670 . 4.670 4.695 4.664 4.721 0.051 18 0 "[ . 1 . 2]" 1
115 1 134 PHE QB 1 135 ALA H 4.080 . 4.080 2.601 2.490 2.774 . 0 0 "[ . 1 . 2]" 1
116 1 27 VAL QG 1 134 PHE H 5.500 . 5.500 5.225 4.921 5.487 . 0 0 "[ . 1 . 2]" 1
117 1 53 TYR QB 1 54 TYR H 4.910 . 4.910 3.857 3.789 3.897 . 0 0 "[ . 1 . 2]" 1
118 1 72 LYS H 1 117 THR HA 4.820 . 4.820 3.385 3.049 3.829 . 0 0 "[ . 1 . 2]" 1
119 1 116 SER HA 1 125 THR MG 5.050 . 5.050 4.684 4.263 5.061 0.011 17 0 "[ . 1 . 2]" 1
120 1 62 GLU QG 1 101 ARG HA 4.990 . 4.990 3.984 3.509 4.989 . 0 0 "[ . 1 . 2]" 1
121 1 88 VAL H 1 89 SER H 3.380 . 3.380 2.322 1.993 3.110 . 0 0 "[ . 1 . 2]" 1
122 1 132 LEU H 1 133 VAL H 4.370 . 4.370 4.232 4.073 4.389 0.019 15 0 "[ . 1 . 2]" 1
123 1 91 SER QB 1 95 GLU QB 3.140 . 3.140 1.768 1.705 1.846 0.095 10 0 "[ . 1 . 2]" 1
124 1 117 THR MG 1 119 ILE MD 4.430 . 4.430 4.310 3.978 4.446 0.016 1 0 "[ . 1 . 2]" 1
125 1 14 LEU QD 1 15 GLU H 5.500 . 5.500 4.148 3.795 4.538 . 0 0 "[ . 1 . 2]" 1
126 1 101 ARG H 1 102 PHE QD 5.500 . 5.500 3.853 3.613 4.198 . 0 0 "[ . 1 . 2]" 1
127 1 74 PHE HA 1 75 GLU H 3.390 . 3.390 2.229 2.210 2.275 . 0 0 "[ . 1 . 2]" 1
128 1 53 TYR H 1 60 GLU H 4.380 . 4.380 2.418 1.946 3.415 . 0 0 "[ . 1 . 2]" 1
129 1 106 ASP H 1 139 TYR QD 5.500 . 5.500 4.420 3.913 4.770 . 0 0 "[ . 1 . 2]" 1
130 1 88 VAL QG 1 101 ARG HA 4.790 . 4.790 4.639 4.060 4.837 0.047 3 0 "[ . 1 . 2]" 1
131 1 88 VAL H 1 99 TYR H 5.500 . 5.500 4.471 3.923 5.239 . 0 0 "[ . 1 . 2]" 1
132 1 102 PHE HA 1 103 PRO QG 4.810 . 4.810 4.027 3.940 4.095 . 0 0 "[ . 1 . 2]" 1
133 1 4 SER H 1 72 LYS QE 5.500 . 5.500 5.185 4.604 5.508 0.008 13 0 "[ . 1 . 2]" 1
134 1 68 ALA HA 1 71 TRP H 4.700 . 4.700 3.327 3.120 3.673 . 0 0 "[ . 1 . 2]" 1
135 1 17 LYS QE 1 19 HIS HA 3.890 . 3.890 3.322 2.438 3.901 0.011 10 0 "[ . 1 . 2]" 1
136 1 28 ASN H 1 135 ALA H 3.640 . 3.640 3.587 3.339 3.685 0.045 17 0 "[ . 1 . 2]" 1
137 1 66 ASN HA 1 98 ALA H 4.940 . 4.940 4.043 3.359 4.572 . 0 0 "[ . 1 . 2]" 1
138 1 74 PHE QD 1 100 ILE MD 3.680 . 3.680 3.487 2.521 3.683 0.003 10 0 "[ . 1 . 2]" 1
139 1 70 THR HB 1 118 GLN H 5.140 . 5.140 3.185 2.276 4.118 . 0 0 "[ . 1 . 2]" 1
140 1 130 THR HA 1 132 LEU H 5.450 . 5.450 5.289 4.920 5.449 . 0 0 "[ . 1 . 2]" 1
141 1 67 THR HA 1 67 THR MG 2.820 . 2.820 2.272 1.965 2.471 . 0 0 "[ . 1 . 2]" 1
142 1 29 PHE QB 1 134 PHE HA 3.860 . 3.860 3.112 2.793 3.310 . 0 0 "[ . 1 . 2]" 1
143 1 100 ILE HB 1 100 ILE MD 3.240 . 3.240 2.034 1.919 2.147 . 0 0 "[ . 1 . 2]" 1
144 1 107 GLY H 1 139 TYR QE 5.060 . 5.060 3.370 2.880 3.646 . 0 0 "[ . 1 . 2]" 1
145 1 98 ALA H 1 99 TYR QD 5.500 . 5.500 5.061 4.268 5.355 . 0 0 "[ . 1 . 2]" 1
146 1 65 ILE MD 1 100 ILE QG 3.300 . 3.300 2.076 1.865 2.218 . 0 0 "[ . 1 . 2]" 1
147 1 7 ASP H 1 8 ALA H 3.310 . 3.310 2.267 1.990 2.566 . 0 0 "[ . 1 . 2]" 1
148 1 113 ILE HA 1 113 ILE MD 3.710 . 3.710 3.490 3.289 3.752 0.042 9 0 "[ . 1 . 2]" 1
149 1 65 ILE MD 1 100 ILE MG 3.150 . 3.150 2.347 1.958 2.691 . 0 0 "[ . 1 . 2]" 1
150 1 33 ASP QB 1 35 ASN QD 5.500 . 5.500 4.269 2.790 5.307 . 0 0 "[ . 1 . 2]" 1
151 1 47 LYS HA 1 47 LYS QG 3.380 . 3.380 2.286 1.978 2.599 . 0 0 "[ . 1 . 2]" 1
152 1 111 LEU H 1 134 PHE QE 5.500 . 5.500 5.454 5.196 5.534 0.034 5 0 "[ . 1 . 2]" 1
153 1 110 GLU QB 1 112 LYS QE 4.430 . 4.430 3.765 3.395 4.375 . 0 0 "[ . 1 . 2]" 1
154 1 71 TRP QB 1 117 THR HB 4.900 . 4.900 4.865 4.683 4.927 0.027 4 0 "[ . 1 . 2]" 1
155 1 52 VAL HA 1 53 TYR QD 4.950 . 4.950 3.531 3.152 4.359 . 0 0 "[ . 1 . 2]" 1
156 1 32 LEU H 1 132 LEU HA 4.340 . 4.340 3.253 2.829 3.580 . 0 0 "[ . 1 . 2]" 1
157 1 51 ASP HA 1 52 VAL QG 4.710 . 4.710 3.285 2.750 3.634 . 0 0 "[ . 1 . 2]" 1
158 1 46 ILE HA 1 65 ILE QG 4.710 . 4.710 3.468 3.149 3.930 . 0 0 "[ . 1 . 2]" 1
159 1 111 LEU QB 1 112 LYS H 3.590 . 3.590 2.889 2.591 3.205 . 0 0 "[ . 1 . 2]" 1
160 1 24 ARG H 1 54 TYR QB 4.920 . 4.920 4.902 4.614 4.961 0.041 2 0 "[ . 1 . 2]" 1
161 1 32 LEU QD 1 39 GLN H 5.500 . 5.500 4.291 3.428 4.789 . 0 0 "[ . 1 . 2]" 1
162 1 45 SER QB 1 65 ILE MG 4.590 . 4.590 2.801 1.984 3.263 . 0 0 "[ . 1 . 2]" 1
163 1 35 ASN H 1 36 ASN HA 4.270 . 4.270 4.168 4.032 4.292 0.022 6 0 "[ . 1 . 2]" 1
164 1 3 GLU HA 1 3 GLU QB 2.680 . 2.680 2.402 2.199 2.549 . 0 0 "[ . 1 . 2]" 1
165 1 74 PHE QE 1 113 ILE MD 4.370 . 4.370 3.675 3.459 4.035 . 0 0 "[ . 1 . 2]" 1
166 1 18 GLU HA 1 20 ASP H 4.810 . 4.810 3.728 3.120 4.687 . 0 0 "[ . 1 . 2]" 1
167 1 83 LEU QD 1 102 PHE QD 3.370 . 3.370 3.207 2.982 3.377 0.007 4 0 "[ . 1 . 2]" 1
168 1 123 GLU HA 1 123 GLU QG 3.550 . 3.550 2.379 1.963 3.304 . 0 0 "[ . 1 . 2]" 1
169 1 20 ASP H 1 21 ILE H 4.310 . 4.310 3.094 2.277 4.333 0.023 16 0 "[ . 1 . 2]" 1
170 1 14 LEU QD 1 17 LYS QE 4.010 . 4.010 3.760 3.247 4.024 0.014 10 0 "[ . 1 . 2]" 1
171 1 137 PRO QG 1 139 TYR QE 3.980 . 3.980 2.889 2.515 3.336 . 0 0 "[ . 1 . 2]" 1
172 1 87 LEU QD 1 98 ALA MB 4.090 . 4.090 2.574 1.905 3.157 . 0 0 "[ . 1 . 2]" 1
173 1 121 ASP QB 1 122 GLY H 3.840 . 3.840 2.466 1.957 3.505 . 0 0 "[ . 1 . 2]" 1
174 1 125 THR HB 1 127 TYR QE 4.000 . 4.000 3.441 2.726 3.956 . 0 0 "[ . 1 . 2]" 1
175 1 93 VAL H 1 94 PRO QD 4.510 . 4.510 2.498 2.464 2.533 . 0 0 "[ . 1 . 2]" 1
176 1 95 GLU QB 1 97 HIS H 4.980 . 4.980 3.738 2.444 4.115 . 0 0 "[ . 1 . 2]" 1
177 1 73 LYS H 1 74 PHE HA 5.500 . 5.500 5.002 4.910 5.126 . 0 0 "[ . 1 . 2]" 1
178 1 50 ALA HA 1 63 LEU HA 4.710 . 4.710 2.855 2.361 3.342 . 0 0 "[ . 1 . 2]" 1
179 1 107 GLY H 1 139 TYR QD 5.390 . 5.390 3.248 2.920 3.452 . 0 0 "[ . 1 . 2]" 1
180 1 107 GLY QA 1 137 PRO QB 4.020 . 4.020 2.598 2.306 2.865 . 0 0 "[ . 1 . 2]" 1
181 1 28 ASN QD 1 29 PHE HA 5.380 . 5.380 4.161 3.289 4.917 . 0 0 "[ . 1 . 2]" 1
182 1 21 ILE MG 1 22 GLY QA 4.630 . 4.630 3.492 2.848 3.878 . 0 0 "[ . 1 . 2]" 1
183 1 29 PHE QE 1 50 ALA H 4.150 . 4.150 2.269 1.969 2.469 . 0 0 "[ . 1 . 2]" 1
184 1 59 ALA MB 1 139 TYR HA 5.300 . 5.300 4.160 3.681 4.631 . 0 0 "[ . 1 . 2]" 1
185 1 26 GLN HA 1 27 VAL HA 4.800 . 4.800 4.505 4.488 4.545 . 0 0 "[ . 1 . 2]" 1
186 1 90 TYR QE 1 92 PRO QB 3.760 . 3.760 3.898 3.877 3.927 0.167 4 0 "[ . 1 . 2]" 1
187 1 52 VAL HB 1 138 ILE MD 5.120 . 5.120 4.514 3.902 5.041 . 0 0 "[ . 1 . 2]" 1
188 1 50 ALA MB 1 61 VAL QG 3.100 . 3.100 2.098 1.798 2.294 0.002 18 0 "[ . 1 . 2]" 1
189 1 116 SER HA 1 126 ASN HA 3.740 . 3.740 2.256 1.944 2.588 . 0 0 "[ . 1 . 2]" 1
190 1 111 LEU H 1 132 LEU QD 4.810 . 4.810 3.280 2.666 3.646 . 0 0 "[ . 1 . 2]" 1
191 1 68 ALA HA 1 98 ALA H 5.500 . 5.500 4.571 4.251 5.073 . 0 0 "[ . 1 . 2]" 1
192 1 48 ASP H 1 48 ASP QB 3.400 . 3.400 2.098 2.012 2.323 . 0 0 "[ . 1 . 2]" 1
193 1 104 VAL HA 1 104 VAL HB 2.970 . 2.970 2.534 2.498 2.640 . 0 0 "[ . 1 . 2]" 1
194 1 17 LYS QE 1 18 GLU H 5.500 . 5.500 3.392 1.945 4.573 . 0 0 "[ . 1 . 2]" 1
195 1 78 GLU H 1 83 LEU H 4.390 . 4.390 4.024 3.753 4.338 . 0 0 "[ . 1 . 2]" 1
196 1 5 LEU H 1 6 LYS H 4.650 . 4.650 2.705 2.462 2.820 . 0 0 "[ . 1 . 2]" 1
197 1 138 ILE H 1 138 ILE HB 3.280 . 3.280 2.561 2.490 2.608 . 0 0 "[ . 1 . 2]" 1
198 1 113 ILE H 1 114 VAL QG 4.910 . 4.910 4.137 3.692 4.320 . 0 0 "[ . 1 . 2]" 1
199 1 113 ILE H 1 131 LYS HA 5.040 . 5.040 3.999 3.709 4.386 . 0 0 "[ . 1 . 2]" 1
200 1 71 TRP HE3 1 117 THR MG 4.450 . 4.450 2.854 2.041 4.048 . 0 0 "[ . 1 . 2]" 1
201 1 119 ILE HB 1 121 ASP QB 4.780 . 4.780 2.766 2.422 3.134 . 0 0 "[ . 1 . 2]" 1
202 1 113 ILE MD 1 132 LEU QB 3.270 . 3.270 1.805 1.769 1.879 0.031 2 0 "[ . 1 . 2]" 1
203 1 67 THR HB 1 70 THR MG 3.820 . 3.820 2.053 1.805 2.355 . 0 0 "[ . 1 . 2]" 1
204 1 74 PHE QD 1 114 VAL H 5.460 . 5.460 3.009 2.843 3.532 . 0 0 "[ . 1 . 2]" 1
205 1 68 ALA MB 1 90 TYR QE 3.380 . 3.380 2.044 1.851 2.515 . 0 0 "[ . 1 . 2]" 1
206 1 50 ALA MB 1 135 ALA H 5.500 . 5.500 4.970 4.634 5.398 . 0 0 "[ . 1 . 2]" 1
207 1 72 LYS H 1 117 THR MG 5.500 . 5.500 3.208 2.756 3.921 . 0 0 "[ . 1 . 2]" 1
208 1 109 GLN QG 1 134 PHE QB 3.460 . 3.460 2.088 1.890 2.425 . 0 0 "[ . 1 . 2]" 1
209 1 100 ILE H 1 101 ARG H 5.500 . 5.500 4.496 4.439 4.568 . 0 0 "[ . 1 . 2]" 1
210 1 111 LEU H 1 133 VAL QG 4.360 . 4.360 3.957 3.734 4.213 . 0 0 "[ . 1 . 2]" 1
211 1 74 PHE QE 1 76 VAL QG 3.700 . 3.700 2.322 1.871 3.622 . 0 0 "[ . 1 . 2]" 1
212 1 46 ILE QG 1 65 ILE HA 5.000 . 5.000 3.157 2.674 4.576 . 0 0 "[ . 1 . 2]" 1
213 1 11 ASP QB 1 14 LEU H 5.030 . 5.030 2.308 1.995 2.812 . 0 0 "[ . 1 . 2]" 1
214 1 71 TRP H 1 72 LYS H 5.500 . 5.500 4.619 4.479 4.689 . 0 0 "[ . 1 . 2]" 1
215 1 104 VAL HB 1 108 THR H 4.930 . 4.930 3.510 3.317 3.706 . 0 0 "[ . 1 . 2]" 1
216 1 111 LEU H 1 132 LEU H 4.160 . 4.160 3.492 3.196 3.783 . 0 0 "[ . 1 . 2]" 1
217 1 33 ASP H 1 35 ASN H 5.290 . 5.290 3.796 2.982 4.049 . 0 0 "[ . 1 . 2]" 1
218 1 108 THR HB 1 109 GLN HA 4.780 . 4.780 4.824 4.792 4.856 0.076 4 0 "[ . 1 . 2]" 1
219 1 99 TYR HA 1 99 TYR QD 3.880 . 3.880 2.545 1.945 2.955 . 0 0 "[ . 1 . 2]" 1
220 1 57 LYS H 1 57 LYS QE 5.500 . 5.500 4.857 4.151 5.499 . 0 0 "[ . 1 . 2]" 1
221 1 91 SER QB 1 97 HIS QB 4.640 . 4.640 1.873 1.791 2.071 0.009 11 0 "[ . 1 . 2]" 1
222 1 140 ASN QD 1 141 ASP QB 5.100 . 5.100 4.577 3.727 5.085 . 0 0 "[ . 1 . 2]" 1
223 1 14 LEU QB 1 90 TYR H 4.300 . 4.300 3.114 2.621 3.364 . 0 0 "[ . 1 . 2]" 1
224 1 50 ALA HA 1 63 LEU QD 3.680 . 3.680 2.944 1.926 3.681 0.001 9 0 "[ . 1 . 2]" 1
225 1 67 THR HA 1 96 ASP QB 3.910 . 3.910 3.918 3.777 3.957 0.047 12 0 "[ . 1 . 2]" 1
226 1 61 VAL QG 1 63 LEU H 4.990 . 4.990 4.489 4.081 4.963 . 0 0 "[ . 1 . 2]" 1
227 1 113 ILE HA 1 113 ILE QG 3.920 . 3.920 2.063 1.954 2.270 . 0 0 "[ . 1 . 2]" 1
228 1 59 ALA MB 1 104 VAL HB 4.840 . 4.840 4.080 3.924 4.280 . 0 0 "[ . 1 . 2]" 1
229 1 35 ASN HA 1 37 GLU H 4.990 . 4.990 4.646 4.368 4.997 0.007 2 0 "[ . 1 . 2]" 1
230 1 9 ILE HA 1 9 ILE MG 3.140 . 3.140 2.349 2.257 2.419 . 0 0 "[ . 1 . 2]" 1
231 1 46 ILE QG 1 65 ILE MG 5.150 . 5.150 4.169 3.726 5.054 . 0 0 "[ . 1 . 2]" 1
232 1 27 VAL QG 1 134 PHE QB 3.390 . 3.390 2.752 2.395 2.953 . 0 0 "[ . 1 . 2]" 1
233 1 96 ASP H 1 97 HIS H 3.990 . 3.990 3.355 2.792 3.540 . 0 0 "[ . 1 . 2]" 1
234 1 46 ILE H 1 46 ILE HB 3.740 . 3.740 2.520 2.195 3.664 . 0 0 "[ . 1 . 2]" 1
235 1 133 VAL HA 1 134 PHE HA 4.910 . 4.910 4.535 4.474 4.564 . 0 0 "[ . 1 . 2]" 1
236 1 59 ALA MB 1 138 ILE MD 4.860 . 4.860 4.536 4.225 4.772 . 0 0 "[ . 1 . 2]" 1
237 1 28 ASN QB 1 135 ALA MB 3.310 . 3.310 1.930 1.792 2.171 0.008 8 0 "[ . 1 . 2]" 1
238 1 6 LYS H 1 7 ASP QB 5.500 . 5.500 4.225 4.033 4.458 . 0 0 "[ . 1 . 2]" 1
239 1 93 VAL QG 1 96 ASP H 5.490 . 5.490 4.257 4.174 4.386 . 0 0 "[ . 1 . 2]" 1
240 1 58 LYS HA 1 58 LYS QE 3.970 . 3.970 2.872 1.933 4.020 0.050 5 0 "[ . 1 . 2]" 1
241 1 117 THR MG 1 127 TYR QD 4.720 . 4.720 2.897 2.442 3.699 . 0 0 "[ . 1 . 2]" 1
242 1 27 VAL QG 1 134 PHE QD 3.510 . 3.510 2.326 1.920 2.783 . 0 0 "[ . 1 . 2]" 1
243 1 104 VAL QG 1 108 THR MG 3.500 . 3.500 2.992 2.318 3.463 . 0 0 "[ . 1 . 2]" 1
244 1 49 PRO HA 1 50 ALA H 3.320 . 3.320 2.319 2.228 2.435 . 0 0 "[ . 1 . 2]" 1
245 1 61 VAL QG 1 134 PHE QE 3.280 . 3.280 2.240 1.943 2.469 . 0 0 "[ . 1 . 2]" 1
246 1 76 VAL QG 1 83 LEU QD 3.270 . 3.270 2.740 1.986 3.249 . 0 0 "[ . 1 . 2]" 1
247 1 113 ILE MD 1 113 ILE MG 3.080 . 3.080 2.722 2.419 2.977 . 0 0 "[ . 1 . 2]" 1
248 1 111 LEU QD 1 134 PHE QE 3.590 . 3.590 1.933 1.806 2.110 . 0 0 "[ . 1 . 2]" 1
249 1 30 GLN QE 1 135 ALA HA 5.180 . 5.180 2.207 1.938 2.789 . 0 0 "[ . 1 . 2]" 1
250 1 118 GLN HA 1 119 ILE QG 4.690 . 4.690 4.153 3.813 4.587 . 0 0 "[ . 1 . 2]" 1
251 1 90 TYR QE 1 97 HIS H 5.240 . 5.240 3.462 3.059 5.012 . 0 0 "[ . 1 . 2]" 1
252 1 32 LEU HA 1 39 GLN H 4.800 . 4.800 4.558 4.124 4.811 0.011 5 0 "[ . 1 . 2]" 1
253 1 64 ASP HA 1 100 ILE H 4.880 . 4.880 4.113 3.756 4.311 . 0 0 "[ . 1 . 2]" 1
254 1 73 LYS H 1 74 PHE H 5.500 . 5.500 4.469 4.425 4.513 . 0 0 "[ . 1 . 2]" 1
255 1 61 VAL HA 1 62 GLU H 3.340 . 3.340 2.288 2.226 2.420 . 0 0 "[ . 1 . 2]" 1
256 1 108 THR HA 1 109 GLN H 3.020 . 3.020 2.210 2.201 2.252 . 0 0 "[ . 1 . 2]" 1
257 1 82 LYS QE 1 114 VAL HB 4.860 . 4.860 2.908 2.573 3.461 . 0 0 "[ . 1 . 2]" 1
258 1 74 PHE HA 1 115 SER HA 3.560 . 3.560 3.043 2.660 3.396 . 0 0 "[ . 1 . 2]" 1
259 1 9 ILE H 1 10 LYS QB 5.500 . 5.500 4.446 4.148 4.790 . 0 0 "[ . 1 . 2]" 1
260 1 136 LYS H 1 138 ILE MD 5.270 . 5.270 3.547 3.355 3.756 . 0 0 "[ . 1 . 2]" 1
261 1 2 ASP QB 1 85 VAL H 5.500 . 5.500 4.765 3.772 5.517 0.017 9 0 "[ . 1 . 2]" 1
262 1 45 SER QB 1 46 ILE QG 4.300 . 4.300 3.165 2.277 4.226 . 0 0 "[ . 1 . 2]" 1
263 1 30 GLN HA 1 31 LEU H 3.630 . 3.630 2.220 2.214 2.224 . 0 0 "[ . 1 . 2]" 1
264 1 32 LEU HA 1 37 GLU H 5.470 . 5.470 3.647 3.231 4.028 . 0 0 "[ . 1 . 2]" 1
265 1 55 THR MG 1 56 LYS H 4.280 . 4.280 3.627 3.517 3.777 . 0 0 "[ . 1 . 2]" 1
266 1 45 SER HA 1 65 ILE HA 4.850 . 4.850 4.304 3.546 4.870 0.020 7 0 "[ . 1 . 2]" 1
267 1 34 LYS QB 1 129 TYR H 5.500 . 5.500 5.354 4.849 5.522 0.022 17 0 "[ . 1 . 2]" 1
268 1 99 TYR H 1 100 ILE MG 5.200 . 5.200 3.693 3.394 3.883 . 0 0 "[ . 1 . 2]" 1
269 1 64 ASP QB 1 65 ILE H 4.610 . 4.610 3.594 2.698 4.026 . 0 0 "[ . 1 . 2]" 1
270 1 25 GLU QB 1 54 TYR QE 5.070 . 5.070 3.071 2.640 3.495 . 0 0 "[ . 1 . 2]" 1
271 1 52 VAL QG 1 59 ALA MB 3.230 . 3.230 2.398 1.949 3.007 . 0 0 "[ . 1 . 2]" 1
272 1 6 LYS HA 1 6 LYS QG 3.760 . 3.760 2.727 1.963 3.371 . 0 0 "[ . 1 . 2]" 1
273 1 104 VAL QG 1 138 ILE HB 3.880 . 3.880 2.193 1.946 2.437 . 0 0 "[ . 1 . 2]" 1
274 1 108 THR HB 1 110 GLU H 5.120 . 5.120 4.932 4.348 5.136 0.016 13 0 "[ . 1 . 2]" 1
275 1 111 LEU H 1 133 VAL HA 4.500 . 4.500 3.509 3.176 3.752 . 0 0 "[ . 1 . 2]" 1
276 1 129 TYR QE 1 130 THR HA 4.810 . 4.810 4.724 4.488 4.825 0.015 4 0 "[ . 1 . 2]" 1
277 1 30 GLN H 1 132 LEU QD 5.120 . 5.120 3.779 3.342 4.053 . 0 0 "[ . 1 . 2]" 1
278 1 52 VAL H 1 52 VAL HB 3.780 . 3.780 2.563 2.321 3.226 . 0 0 "[ . 1 . 2]" 1
279 1 98 ALA MB 1 100 ILE MG 3.970 . 3.970 2.954 2.690 3.223 . 0 0 "[ . 1 . 2]" 1
280 1 87 LEU HG 1 100 ILE MG 3.460 . 3.460 2.205 1.914 3.356 . 0 0 "[ . 1 . 2]" 1
281 1 54 TYR QE 1 59 ALA MB 4.030 . 4.030 1.857 1.799 2.044 0.001 16 0 "[ . 1 . 2]" 1
282 1 3 GLU QB 1 8 ALA MB 4.360 . 4.360 3.248 2.367 4.322 . 0 0 "[ . 1 . 2]" 1
283 1 66 ASN QB 1 97 HIS HE1 4.650 . 4.650 2.488 1.985 3.446 . 0 0 "[ . 1 . 2]" 1
284 1 58 LYS QB 1 103 PRO HA 4.050 . 4.050 3.948 3.765 4.083 0.033 2 0 "[ . 1 . 2]" 1
285 1 45 SER QB 1 66 ASN QB 4.890 . 4.890 4.257 3.309 4.736 . 0 0 "[ . 1 . 2]" 1
286 1 4 SER H 1 7 ASP QB 4.230 . 4.230 2.915 2.236 3.638 . 0 0 "[ . 1 . 2]" 1
287 1 26 GLN HA 1 27 VAL H 3.080 . 3.080 2.229 2.209 2.294 . 0 0 "[ . 1 . 2]" 1
288 1 6 LYS HA 1 9 ILE MG 3.760 . 3.760 3.219 2.675 3.676 . 0 0 "[ . 1 . 2]" 1
289 1 71 TRP HA 1 71 TRP HE3 4.210 . 4.210 2.979 2.325 3.732 . 0 0 "[ . 1 . 2]" 1
290 1 82 LYS QE 1 114 VAL HA 5.180 . 5.180 5.161 4.871 5.209 0.029 9 0 "[ . 1 . 2]" 1
291 1 86 ARG H 1 102 PHE QB 5.240 . 5.240 4.082 3.580 4.408 . 0 0 "[ . 1 . 2]" 1
292 1 7 ASP HA 1 10 LYS H 5.380 . 5.380 4.125 3.577 5.173 . 0 0 "[ . 1 . 2]" 1
293 1 95 GLU H 1 95 GLU QB 3.510 . 3.510 2.140 2.066 2.213 . 0 0 "[ . 1 . 2]" 1
294 1 18 GLU QG 1 20 ASP H 5.120 . 5.120 3.081 2.142 4.169 . 0 0 "[ . 1 . 2]" 1
295 1 65 ILE MG 1 67 THR HB 5.040 . 5.040 4.585 4.222 4.931 . 0 0 "[ . 1 . 2]" 1
296 1 110 GLU H 1 111 LEU QD 5.500 . 5.500 2.631 2.353 2.915 . 0 0 "[ . 1 . 2]" 1
297 1 108 THR MG 1 109 GLN HA 4.280 . 4.280 3.804 3.630 3.968 . 0 0 "[ . 1 . 2]" 1
298 1 35 ASN H 1 37 GLU QB 5.500 . 5.500 4.083 3.807 4.586 . 0 0 "[ . 1 . 2]" 1
299 1 68 ALA H 1 90 TYR QE 5.420 . 5.420 4.441 3.963 5.020 . 0 0 "[ . 1 . 2]" 1
300 1 112 LYS QB 1 112 LYS QE 4.040 . 4.040 3.081 1.903 3.624 . 0 0 "[ . 1 . 2]" 1
301 1 108 THR MG 1 138 ILE HB 5.060 . 5.060 4.670 4.555 4.779 . 0 0 "[ . 1 . 2]" 1
302 1 7 ASP H 1 7 ASP QB 3.580 . 3.580 2.221 2.046 2.359 . 0 0 "[ . 1 . 2]" 1
303 1 113 ILE HA 1 114 VAL QG 4.510 . 4.510 3.169 3.001 3.414 . 0 0 "[ . 1 . 2]" 1
304 1 63 LEU H 1 64 ASP H 5.470 . 5.470 4.475 4.231 4.581 . 0 0 "[ . 1 . 2]" 1
305 1 140 ASN H 1 141 ASP H 5.320 . 5.320 4.660 4.539 4.699 . 0 0 "[ . 1 . 2]" 1
306 1 78 GLU QB 1 108 THR MG 3.840 . 3.840 2.874 2.653 3.161 . 0 0 "[ . 1 . 2]" 1
307 1 14 LEU HA 1 14 LEU QD 2.830 . 2.830 2.028 1.848 2.781 . 0 0 "[ . 1 . 2]" 1
308 1 53 TYR QB 1 60 GLU H 5.010 . 5.010 3.196 2.738 3.743 . 0 0 "[ . 1 . 2]" 1
309 1 47 LYS QG 1 48 ASP H 4.270 . 4.270 3.654 2.382 4.248 . 0 0 "[ . 1 . 2]" 1
310 1 65 ILE MG 1 71 TRP HD1 4.130 . 4.130 2.330 1.938 2.985 . 0 0 "[ . 1 . 2]" 1
311 1 66 ASN HA 1 97 HIS H 5.500 . 5.500 5.003 4.500 5.302 . 0 0 "[ . 1 . 2]" 1
312 1 70 THR HB 1 119 ILE QG 4.180 . 4.180 2.432 1.935 3.033 . 0 0 "[ . 1 . 2]" 1
313 1 141 ASP H 1 142 PRO QD 5.500 . 5.500 3.505 3.234 3.682 . 0 0 "[ . 1 . 2]" 1
314 1 110 GLU H 1 111 LEU HG 5.140 . 5.140 4.893 4.612 5.148 0.008 10 0 "[ . 1 . 2]" 1
315 1 30 GLN H 1 30 GLN QG 4.390 . 4.390 3.632 3.374 3.933 . 0 0 "[ . 1 . 2]" 1
316 1 18 GLU QG 1 21 ILE H 5.500 . 5.500 4.998 3.783 5.497 . 0 0 "[ . 1 . 2]" 1
317 1 50 ALA MB 1 63 LEU QB 4.810 . 4.810 4.279 2.949 4.818 0.008 18 0 "[ . 1 . 2]" 1
318 1 34 LYS QB 1 129 TYR QE 5.020 . 5.020 3.312 2.494 3.912 . 0 0 "[ . 1 . 2]" 1
319 1 10 LYS HA 1 10 LYS QE 4.240 . 4.240 4.020 3.566 4.245 0.005 12 0 "[ . 1 . 2]" 1
320 1 30 GLN H 1 134 PHE HA 4.320 . 4.320 3.437 3.201 3.632 . 0 0 "[ . 1 . 2]" 1
321 1 72 LYS QB 1 117 THR HA 5.310 . 5.310 3.233 2.828 3.768 . 0 0 "[ . 1 . 2]" 1
322 1 46 ILE HA 1 65 ILE MG 4.760 . 4.760 4.488 4.112 4.759 . 0 0 "[ . 1 . 2]" 1
323 1 76 VAL QG 1 77 TYR HA 4.320 . 4.320 3.479 3.166 3.774 . 0 0 "[ . 1 . 2]" 1
324 1 24 ARG HA 1 53 TYR HA 3.400 . 3.400 2.456 2.122 2.850 . 0 0 "[ . 1 . 2]" 1
325 1 74 PHE QD 1 85 VAL QG 5.500 . 5.500 2.410 1.838 3.106 . 0 0 "[ . 1 . 2]" 1
326 1 4 SER QB 1 6 LYS QG 4.950 . 4.950 3.718 1.868 4.985 0.035 4 0 "[ . 1 . 2]" 1
327 1 74 PHE H 1 114 VAL QG 5.500 . 5.500 5.355 5.132 5.571 0.071 5 0 "[ . 1 . 2]" 1
328 1 21 ILE HA 1 21 ILE QG 3.440 . 3.440 2.584 2.302 3.203 . 0 0 "[ . 1 . 2]" 1
329 1 74 PHE QE 1 113 ILE MG 4.780 . 4.780 2.165 1.852 2.810 . 0 0 "[ . 1 . 2]" 1
330 1 6 LYS H 1 7 ASP H 4.480 . 4.480 2.495 2.392 2.613 . 0 0 "[ . 1 . 2]" 1
331 1 29 PHE QE 1 49 PRO HA 4.740 . 4.740 1.974 1.932 2.181 . 0 0 "[ . 1 . 2]" 1
332 1 32 LEU QD 1 36 ASN H 5.500 . 5.500 3.986 3.186 4.374 . 0 0 "[ . 1 . 2]" 1
333 1 57 LYS H 1 58 LYS H 3.390 . 3.390 2.781 2.342 3.016 . 0 0 "[ . 1 . 2]" 1
334 1 33 ASP H 1 34 LYS H 5.080 . 5.080 4.262 3.566 4.349 . 0 0 "[ . 1 . 2]" 1
335 1 58 LYS QE 1 105 SER H 5.500 . 5.500 4.148 2.620 5.032 . 0 0 "[ . 1 . 2]" 1
336 1 17 LYS H 1 89 SER QB 5.270 . 5.270 2.770 1.946 3.668 . 0 0 "[ . 1 . 2]" 1
337 1 28 ASN H 1 28 ASN QB 3.530 . 3.530 2.155 1.979 2.294 . 0 0 "[ . 1 . 2]" 1
338 1 107 GLY QA 1 139 TYR QE 4.510 . 4.510 2.752 2.609 2.811 . 0 0 "[ . 1 . 2]" 1
339 1 51 ASP H 1 53 TYR QE 5.410 . 5.410 4.987 4.386 5.411 0.001 16 0 "[ . 1 . 2]" 1
340 1 138 ILE MD 1 139 TYR H 4.360 . 4.360 3.956 3.828 4.070 . 0 0 "[ . 1 . 2]" 1
341 1 70 THR HB 1 117 THR MG 4.620 . 4.620 4.254 3.950 4.630 0.010 3 0 "[ . 1 . 2]" 1
342 1 89 SER H 1 99 TYR H 4.910 . 4.910 3.419 3.179 3.870 . 0 0 "[ . 1 . 2]" 1
343 1 33 ASP QB 1 34 LYS H 4.050 . 4.050 2.070 1.887 4.005 . 0 0 "[ . 1 . 2]" 1
344 1 142 PRO QB 1 143 SER H 4.060 . 4.060 3.491 3.315 3.657 . 0 0 "[ . 1 . 2]" 1
345 1 33 ASP H 1 36 ASN H 5.440 . 5.440 4.378 3.881 4.770 . 0 0 "[ . 1 . 2]" 1
346 1 101 ARG H 1 101 ARG QB 3.910 . 3.910 3.139 2.489 3.326 . 0 0 "[ . 1 . 2]" 1
347 1 91 SER H 1 97 HIS H 4.260 . 4.260 3.223 2.989 3.671 . 0 0 "[ . 1 . 2]" 1
348 1 23 PRO QG 1 144 LEU QD 3.650 . 3.650 3.363 2.641 3.675 0.025 2 0 "[ . 1 . 2]" 1
349 1 74 PHE HZ 1 76 VAL QG 5.470 . 5.470 2.763 2.040 4.582 . 0 0 "[ . 1 . 2]" 1
350 1 71 TRP HA 1 118 GLN H 5.420 . 5.420 4.676 3.838 4.975 . 0 0 "[ . 1 . 2]" 1
351 1 29 PHE H 1 135 ALA H 5.500 . 5.500 4.842 4.617 4.984 . 0 0 "[ . 1 . 2]" 1
352 1 103 PRO HA 1 104 VAL QG 5.230 . 5.230 3.059 2.888 3.181 . 0 0 "[ . 1 . 2]" 1
353 1 58 LYS HA 1 58 LYS QG 3.150 . 3.150 2.454 2.032 2.746 . 0 0 "[ . 1 . 2]" 1
354 1 60 GLU H 1 60 GLU QG 4.610 . 4.610 3.511 2.855 4.057 . 0 0 "[ . 1 . 2]" 1
355 1 107 GLY H 1 138 ILE HB 4.950 . 4.950 4.930 4.752 4.984 0.034 19 0 "[ . 1 . 2]" 1
356 1 86 ARG QD 1 88 VAL QG 5.020 . 5.020 4.001 1.900 5.024 0.004 8 0 "[ . 1 . 2]" 1
357 1 32 LEU HA 1 36 ASN HA 4.210 . 4.210 4.149 3.926 4.229 0.019 5 0 "[ . 1 . 2]" 1
358 1 59 ALA MB 1 60 GLU H 3.960 . 3.960 2.714 2.373 3.004 . 0 0 "[ . 1 . 2]" 1
359 1 9 ILE MG 1 98 ALA MB 3.100 . 3.100 2.283 1.891 2.624 . 0 0 "[ . 1 . 2]" 1
360 1 108 THR HB 1 111 LEU QD 4.330 . 4.330 3.619 3.441 3.836 . 0 0 "[ . 1 . 2]" 1
361 1 68 ALA MB 1 69 SER H 4.670 . 4.670 2.822 2.613 3.030 . 0 0 "[ . 1 . 2]" 1
362 1 117 THR H 1 127 TYR QE 5.500 . 5.500 3.376 2.573 4.202 . 0 0 "[ . 1 . 2]" 1
363 1 61 VAL QG 1 63 LEU QD 3.420 . 3.420 2.568 1.819 3.380 . 0 0 "[ . 1 . 2]" 1
364 1 47 LYS QB 1 47 LYS QE 2.550 . 2.550 2.019 1.855 2.296 . 0 0 "[ . 1 . 2]" 1
365 1 138 ILE MG 1 139 TYR H 3.710 . 3.710 3.578 3.253 3.740 0.030 10 0 "[ . 1 . 2]" 1
366 1 110 GLU HA 1 132 LEU H 5.470 . 5.470 5.007 4.563 5.369 . 0 0 "[ . 1 . 2]" 1
367 1 31 LEU HA 1 132 LEU H 5.410 . 5.410 5.298 5.076 5.433 0.023 5 0 "[ . 1 . 2]" 1
368 1 73 LYS H 1 117 THR HA 5.500 . 5.500 4.917 4.383 5.401 . 0 0 "[ . 1 . 2]" 1
369 1 114 VAL QG 1 115 SER HA 5.000 . 5.000 3.820 3.487 4.069 . 0 0 "[ . 1 . 2]" 1
370 1 100 ILE MD 1 102 PHE QD 3.660 . 3.660 2.561 2.170 3.023 . 0 0 "[ . 1 . 2]" 1
371 1 69 SER H 1 70 THR MG 5.500 . 5.500 3.565 3.429 3.703 . 0 0 "[ . 1 . 2]" 1
372 1 33 ASP HA 1 129 TYR QD 4.550 . 4.550 4.249 3.715 4.529 . 0 0 "[ . 1 . 2]" 1
373 1 63 LEU H 1 63 LEU QD 4.800 . 4.800 3.143 2.093 3.761 . 0 0 "[ . 1 . 2]" 1
374 1 86 ARG HA 1 86 ARG QG 3.890 . 3.890 3.246 2.456 3.391 . 0 0 "[ . 1 . 2]" 1
375 1 91 SER H 1 97 HIS QB 4.860 . 4.860 2.886 2.636 3.384 . 0 0 "[ . 1 . 2]" 1
376 1 38 THR MG 1 39 GLN HA 4.980 . 4.980 4.261 3.435 4.980 0.000 8 0 "[ . 1 . 2]" 1
377 1 26 GLN H 1 26 GLN QE 5.500 . 5.500 4.104 2.056 4.973 . 0 0 "[ . 1 . 2]" 1
378 1 29 PHE HA 1 135 ALA H 3.970 . 3.970 3.178 3.003 3.276 . 0 0 "[ . 1 . 2]" 1
379 1 112 LYS HA 1 112 LYS QG 3.720 . 3.720 2.080 1.969 2.429 . 0 0 "[ . 1 . 2]" 1
380 1 18 GLU HA 1 19 HIS HD2 3.700 . 3.700 3.506 2.295 3.708 0.008 8 0 "[ . 1 . 2]" 1
381 1 35 ASN QB 1 37 GLU H 4.240 . 4.240 3.325 2.898 3.776 . 0 0 "[ . 1 . 2]" 1
382 1 71 TRP H 1 71 TRP QB 3.570 . 3.570 2.179 2.057 2.288 . 0 0 "[ . 1 . 2]" 1
383 1 29 PHE QB 1 133 VAL H 5.500 . 5.500 4.786 4.460 5.048 . 0 0 "[ . 1 . 2]" 1
384 1 58 LYS HA 1 140 ASN QD 4.760 . 4.760 3.226 2.173 4.107 . 0 0 "[ . 1 . 2]" 1
385 1 85 VAL QG 1 102 PHE HA 4.470 . 4.470 4.083 3.502 4.473 0.003 6 0 "[ . 1 . 2]" 1
386 1 32 LEU QD 1 36 ASN QB 3.880 . 3.880 3.643 3.166 3.889 0.009 15 0 "[ . 1 . 2]" 1
387 1 72 LYS QE 1 73 LYS H 5.500 . 5.500 4.186 3.377 4.740 . 0 0 "[ . 1 . 2]" 1
388 1 106 ASP HA 1 139 TYR QD 4.440 . 4.440 4.280 4.008 4.454 0.014 4 0 "[ . 1 . 2]" 1
389 1 16 ASN H 1 91 SER HA 5.500 . 5.500 4.244 3.007 5.515 0.015 16 0 "[ . 1 . 2]" 1
390 1 8 ALA HA 1 10 LYS H 3.870 . 3.870 3.744 3.598 3.868 . 0 0 "[ . 1 . 2]" 1
391 1 21 ILE H 1 53 TYR QE 5.500 . 5.500 3.401 2.271 4.633 . 0 0 "[ . 1 . 2]" 1
392 1 6 LYS QB 1 71 TRP H 5.120 . 5.120 4.796 4.180 5.133 0.013 7 0 "[ . 1 . 2]" 1
393 1 110 GLU QG 1 133 VAL QG 3.580 . 3.580 2.438 1.804 3.448 . 0 0 "[ . 1 . 2]" 1
394 1 77 TYR HA 1 81 GLN H 4.920 . 4.920 4.095 3.790 4.457 . 0 0 "[ . 1 . 2]" 1
395 1 9 ILE MG 1 90 TYR QB 4.210 . 4.210 2.823 2.286 3.539 . 0 0 "[ . 1 . 2]" 1
396 1 75 GLU H 1 115 SER QB 5.500 . 5.500 3.713 3.212 4.681 . 0 0 "[ . 1 . 2]" 1
397 1 129 TYR HA 1 129 TYR QD 4.060 . 4.060 2.818 2.303 2.976 . 0 0 "[ . 1 . 2]" 1
398 1 97 HIS HA 1 98 ALA H 3.580 . 3.580 2.220 2.211 2.232 . 0 0 "[ . 1 . 2]" 1
399 1 21 ILE HA 1 22 GLY H 2.800 . 2.800 2.293 2.212 2.475 . 0 0 "[ . 1 . 2]" 1
400 1 29 PHE QB 1 135 ALA H 4.600 . 4.600 4.402 4.157 4.549 . 0 0 "[ . 1 . 2]" 1
401 1 30 GLN QE 1 134 PHE HA 5.500 . 5.500 3.949 3.496 4.464 . 0 0 "[ . 1 . 2]" 1
402 1 93 VAL QG 1 95 GLU H 4.930 . 4.930 4.313 4.227 4.390 . 0 0 "[ . 1 . 2]" 1
403 1 76 VAL QG 1 83 LEU H 5.500 . 5.500 3.369 2.730 4.210 . 0 0 "[ . 1 . 2]" 1
404 1 142 PRO QG 1 144 LEU H 5.500 . 5.500 4.770 4.025 5.264 . 0 0 "[ . 1 . 2]" 1
405 1 89 SER H 1 90 TYR H 5.500 . 5.500 4.365 4.303 4.466 . 0 0 "[ . 1 . 2]" 1
406 1 143 SER H 1 144 LEU HA 4.180 . 4.180 4.226 4.187 4.261 0.081 15 0 "[ . 1 . 2]" 1
407 1 58 LYS QE 1 58 LYS QG 3.160 . 3.160 2.181 1.902 2.888 . 0 0 "[ . 1 . 2]" 1
408 1 77 TYR HA 1 83 LEU HG 3.980 . 3.980 3.687 3.219 3.984 0.004 2 0 "[ . 1 . 2]" 1
409 1 60 GLU QG 1 103 PRO HA 3.960 . 3.960 2.954 2.194 3.489 . 0 0 "[ . 1 . 2]" 1
410 1 95 GLU QG 1 97 HIS HD2 4.500 . 4.500 4.302 3.271 4.540 0.040 1 0 "[ . 1 . 2]" 1
411 1 63 LEU QD 1 65 ILE MD 4.550 . 4.550 3.524 2.321 3.939 . 0 0 "[ . 1 . 2]" 1
412 1 27 VAL HA 1 27 VAL QG 3.130 . 3.130 2.066 2.013 2.136 . 0 0 "[ . 1 . 2]" 1
413 1 65 ILE HA 1 67 THR H 4.250 . 4.250 4.065 3.392 4.266 0.016 12 0 "[ . 1 . 2]" 1
414 1 137 PRO QB 1 139 TYR QD 4.540 . 4.540 2.477 2.165 2.992 . 0 0 "[ . 1 . 2]" 1
415 1 47 LYS H 1 64 ASP QB 5.010 . 5.010 3.410 2.809 4.600 . 0 0 "[ . 1 . 2]" 1
416 1 59 ALA MB 1 140 ASN H 4.930 . 4.930 3.263 2.824 3.702 . 0 0 "[ . 1 . 2]" 1
417 1 29 PHE H 1 30 GLN HA 5.260 . 5.260 4.781 4.662 4.868 . 0 0 "[ . 1 . 2]" 1
418 1 56 LYS H 1 56 LYS QE 5.500 . 5.500 4.368 2.976 5.343 . 0 0 "[ . 1 . 2]" 1
419 1 4 SER H 1 5 LEU HA 5.500 . 5.500 5.272 4.911 5.589 0.089 10 0 "[ . 1 . 2]" 1
420 1 56 LYS QE 1 57 LYS QG 3.380 . 3.380 2.853 2.224 3.372 . 0 0 "[ . 1 . 2]" 1
421 1 46 ILE H 1 47 LYS H 5.500 . 5.500 4.675 4.591 4.708 . 0 0 "[ . 1 . 2]" 1
422 1 108 THR HA 1 108 THR MG 3.070 . 3.070 2.354 2.246 2.436 . 0 0 "[ . 1 . 2]" 1
423 1 90 TYR HA 1 90 TYR QD 3.510 . 3.510 3.019 2.927 3.076 . 0 0 "[ . 1 . 2]" 1
424 1 82 LYS QD 1 114 VAL QG 3.200 . 3.200 3.087 2.790 3.248 0.048 19 0 "[ . 1 . 2]" 1
425 1 113 ILE MG 1 115 SER HA 4.980 . 4.980 4.836 4.725 5.024 0.044 15 0 "[ . 1 . 2]" 1
426 1 87 LEU QD 1 98 ALA HA 4.530 . 4.530 3.271 2.949 4.009 . 0 0 "[ . 1 . 2]" 1
427 1 135 ALA H 1 138 ILE MD 5.500 . 5.500 4.475 4.245 4.756 . 0 0 "[ . 1 . 2]" 1
428 1 113 ILE H 1 130 THR H 4.460 . 4.460 3.166 2.260 3.625 . 0 0 "[ . 1 . 2]" 1
429 1 53 TYR H 1 60 GLU QB 4.630 . 4.630 3.014 2.811 3.190 . 0 0 "[ . 1 . 2]" 1
430 1 86 ARG H 1 102 PHE QD 5.170 . 5.170 4.593 3.949 5.113 . 0 0 "[ . 1 . 2]" 1
431 1 55 THR HA 1 56 LYS H 3.290 . 3.290 2.771 2.507 2.851 . 0 0 "[ . 1 . 2]" 1
432 1 112 LYS H 1 112 LYS QE 4.450 . 4.450 2.939 2.156 3.476 . 0 0 "[ . 1 . 2]" 1
433 1 104 VAL QG 1 138 ILE MG 3.430 . 3.430 1.737 1.704 1.773 0.096 15 0 "[ . 1 . 2]" 1
434 1 111 LEU HG 1 134 PHE QE 4.550 . 4.550 4.147 3.870 4.315 . 0 0 "[ . 1 . 2]" 1
435 1 74 PHE H 1 75 GLU H 5.500 . 5.500 3.963 3.571 4.199 . 0 0 "[ . 1 . 2]" 1
436 1 66 ASN QB 1 67 THR MG 4.140 . 4.140 2.922 2.406 3.979 . 0 0 "[ . 1 . 2]" 1
437 1 18 GLU HA 1 19 HIS HA 5.420 . 5.420 4.649 4.553 5.164 . 0 0 "[ . 1 . 2]" 1
438 1 26 GLN HA 1 27 VAL QG 5.050 . 5.050 3.658 3.318 4.049 . 0 0 "[ . 1 . 2]" 1
439 1 124 GLU H 1 125 THR H 4.870 . 4.870 4.559 4.194 4.681 . 0 0 "[ . 1 . 2]" 1
440 1 85 VAL QG 1 100 ILE MG 3.160 . 3.160 2.868 2.459 3.163 0.003 11 0 "[ . 1 . 2]" 1
441 1 31 LEU QD 1 133 VAL H 5.500 . 5.500 4.820 4.374 5.171 . 0 0 "[ . 1 . 2]" 1
442 1 25 GLU H 1 53 TYR HA 4.380 . 4.380 3.980 3.553 4.384 0.004 20 0 "[ . 1 . 2]" 1
443 1 24 ARG H 1 25 GLU QG 4.060 . 4.060 3.831 3.521 4.086 0.026 14 0 "[ . 1 . 2]" 1
444 1 76 VAL HA 1 77 TYR H 3.430 . 3.430 2.280 2.209 2.340 . 0 0 "[ . 1 . 2]" 1
445 1 26 GLN HA 1 51 ASP HA 3.420 . 3.420 2.319 1.961 2.962 . 0 0 "[ . 1 . 2]" 1
446 1 82 LYS HA 1 83 LEU H 3.520 . 3.520 2.238 2.216 2.288 . 0 0 "[ . 1 . 2]" 1
447 1 17 LYS QE 1 20 ASP H 5.500 . 5.500 5.198 3.199 5.503 0.003 11 0 "[ . 1 . 2]" 1
448 1 122 GLY H 1 123 GLU H 4.660 . 4.660 2.818 2.179 3.945 . 0 0 "[ . 1 . 2]" 1
449 1 104 VAL HB 1 138 ILE MG 3.900 . 3.900 3.204 2.938 3.448 . 0 0 "[ . 1 . 2]" 1
450 1 61 VAL H 1 104 VAL H 5.410 . 5.410 4.690 4.292 5.181 . 0 0 "[ . 1 . 2]" 1
451 1 31 LEU HA 1 132 LEU QD 4.610 . 4.610 3.583 3.241 4.079 . 0 0 "[ . 1 . 2]" 1
452 1 111 LEU QB 1 132 LEU QD 5.010 . 5.010 3.884 3.485 4.187 . 0 0 "[ . 1 . 2]" 1
453 1 46 ILE MG 1 63 LEU HG 4.580 . 4.580 4.145 2.485 4.562 . 0 0 "[ . 1 . 2]" 1
454 1 77 TYR QD 1 112 LYS QB 4.660 . 4.660 2.013 1.833 2.410 . 0 0 "[ . 1 . 2]" 1
455 1 77 TYR HA 1 77 TYR QD 4.050 . 4.050 3.114 2.743 3.555 . 0 0 "[ . 1 . 2]" 1
456 1 113 ILE MG 1 115 SER QB 3.870 . 3.870 3.114 2.726 3.695 . 0 0 "[ . 1 . 2]" 1
457 1 17 LYS H 1 89 SER HA 4.240 . 4.240 3.774 2.997 4.229 . 0 0 "[ . 1 . 2]" 1
458 1 110 GLU QB 1 133 VAL QG 3.540 . 3.540 2.275 1.844 3.231 . 0 0 "[ . 1 . 2]" 1
459 1 32 LEU QD 1 37 GLU H 4.890 . 4.890 3.125 2.518 3.429 . 0 0 "[ . 1 . 2]" 1
460 1 11 ASP HA 1 12 PRO QD 3.070 . 3.070 2.010 1.980 2.063 . 0 0 "[ . 1 . 2]" 1
461 1 75 GLU HA 1 76 VAL QG 4.780 . 4.780 3.772 3.217 4.356 . 0 0 "[ . 1 . 2]" 1
462 1 65 ILE MD 1 100 ILE HA 5.360 . 5.360 4.882 4.658 5.105 . 0 0 "[ . 1 . 2]" 1
463 1 76 VAL H 1 77 TYR H 5.440 . 5.440 4.615 4.259 4.696 . 0 0 "[ . 1 . 2]" 1
464 1 65 ILE MG 1 68 ALA HA 3.950 . 3.950 2.377 1.823 2.795 . 0 0 "[ . 1 . 2]" 1
465 1 112 LYS QG 1 129 TYR QD 3.470 . 3.470 2.271 2.024 2.802 . 0 0 "[ . 1 . 2]" 1
466 1 32 LEU QD 1 133 VAL QG 3.500 . 3.500 2.708 1.930 3.236 . 0 0 "[ . 1 . 2]" 1
467 1 4 SER QB 1 72 LYS QE 3.930 . 3.930 2.460 1.901 3.639 . 0 0 "[ . 1 . 2]" 1
468 1 32 LEU QB 1 33 ASP H 5.060 . 5.060 3.471 2.981 3.708 . 0 0 "[ . 1 . 2]" 1
469 1 68 ALA H 1 71 TRP HD1 4.940 . 4.940 3.944 3.561 4.406 . 0 0 "[ . 1 . 2]" 1
470 1 109 GLN QG 1 137 PRO QG 4.880 . 4.880 4.447 3.720 4.896 0.016 11 0 "[ . 1 . 2]" 1
471 1 77 TYR QD 1 78 GLU H 4.680 . 4.680 3.008 2.305 3.433 . 0 0 "[ . 1 . 2]" 1
472 1 112 LYS HA 1 113 ILE H 3.370 . 3.370 2.268 2.213 2.434 . 0 0 "[ . 1 . 2]" 1
473 1 68 ALA HA 1 71 TRP HD1 3.240 . 3.240 2.132 1.940 2.679 . 0 0 "[ . 1 . 2]" 1
474 1 5 LEU QD 1 71 TRP HE3 4.740 . 4.740 3.483 2.219 4.521 . 0 0 "[ . 1 . 2]" 1
475 1 30 GLN H 1 135 ALA H 4.690 . 4.690 4.684 4.526 4.730 0.040 20 0 "[ . 1 . 2]" 1
476 1 27 VAL QG 1 138 ILE H 5.470 . 5.470 4.922 4.714 5.165 . 0 0 "[ . 1 . 2]" 1
477 1 87 LEU QB 1 100 ILE HA 4.780 . 4.780 4.418 3.881 4.754 . 0 0 "[ . 1 . 2]" 1
478 1 5 LEU QB 1 65 ILE MG 5.000 . 5.000 4.934 4.652 5.018 0.018 4 0 "[ . 1 . 2]" 1
479 1 10 LYS H 1 10 LYS QG 4.160 . 4.160 2.982 2.166 4.074 . 0 0 "[ . 1 . 2]" 1
480 1 29 PHE QD 1 50 ALA H 3.770 . 3.770 1.971 1.906 2.099 . 0 0 "[ . 1 . 2]" 1
481 1 135 ALA H 1 136 LYS HA 5.020 . 5.020 5.106 5.063 5.138 0.118 1 0 "[ . 1 . 2]" 1
482 1 9 ILE MD 1 90 TYR QD 5.280 . 5.280 3.792 3.439 4.335 . 0 0 "[ . 1 . 2]" 1
483 1 3 GLU H 1 3 GLU QB 3.430 . 3.430 2.513 2.122 3.064 . 0 0 "[ . 1 . 2]" 1
484 1 123 GLU HA 1 124 GLU H 3.170 . 3.170 2.356 2.223 2.904 . 0 0 "[ . 1 . 2]" 1
485 1 139 TYR H 1 140 ASN H 5.070 . 5.070 4.485 4.360 4.594 . 0 0 "[ . 1 . 2]" 1
486 1 29 PHE HZ 1 48 ASP HA 5.000 . 5.000 4.970 4.785 5.022 0.022 16 0 "[ . 1 . 2]" 1
487 1 68 ALA MB 1 71 TRP HE1 5.500 . 5.500 5.306 5.130 5.506 0.006 5 0 "[ . 1 . 2]" 1
488 1 4 SER H 1 5 LEU H 5.470 . 5.470 4.516 4.274 4.651 . 0 0 "[ . 1 . 2]" 1
489 1 49 PRO QB 1 50 ALA H 3.860 . 3.860 2.966 2.664 3.231 . 0 0 "[ . 1 . 2]" 1
490 1 21 ILE HB 1 22 GLY H 4.410 . 4.410 4.280 3.900 4.456 0.046 10 0 "[ . 1 . 2]" 1
491 1 100 ILE MD 1 102 PHE H 5.500 . 5.500 4.239 3.916 5.374 . 0 0 "[ . 1 . 2]" 1
492 1 131 LYS QG 1 133 VAL HA 4.650 . 4.650 4.437 4.208 4.638 . 0 0 "[ . 1 . 2]" 1
493 1 50 ALA H 1 50 ALA MB 3.510 . 3.510 2.054 1.910 2.156 . 0 0 "[ . 1 . 2]" 1
494 1 26 GLN QB 1 27 VAL H 4.080 . 4.080 3.264 2.992 3.496 . 0 0 "[ . 1 . 2]" 1
495 1 59 ALA H 1 60 GLU HA 5.500 . 5.500 5.501 5.456 5.546 0.046 18 0 "[ . 1 . 2]" 1
496 1 3 GLU H 1 4 SER H 4.160 . 4.160 4.195 4.174 4.218 0.058 10 0 "[ . 1 . 2]" 1
497 1 85 VAL HA 1 103 PRO QD 4.710 . 4.710 4.254 3.853 4.558 . 0 0 "[ . 1 . 2]" 1
498 1 47 LYS QB 1 47 LYS QD 2.520 . 2.520 2.306 2.142 2.459 . 0 0 "[ . 1 . 2]" 1
499 1 89 SER H 1 99 TYR QD 4.950 . 4.950 3.808 3.492 4.327 . 0 0 "[ . 1 . 2]" 1
500 1 88 VAL QG 1 99 TYR QD 4.510 . 4.510 3.561 2.890 4.075 . 0 0 "[ . 1 . 2]" 1
501 1 118 GLN QG 1 119 ILE H 5.500 . 5.500 3.385 2.625 4.599 . 0 0 "[ . 1 . 2]" 1
502 1 46 ILE MG 1 65 ILE HA 4.310 . 4.310 4.240 4.014 4.343 0.033 12 0 "[ . 1 . 2]" 1
503 1 14 LEU QB 1 14 LEU QD 2.740 . 2.740 1.913 1.808 1.993 . 0 0 "[ . 1 . 2]" 1
504 1 71 TRP H 1 71 TRP HD1 4.400 . 4.400 2.615 2.129 3.057 . 0 0 "[ . 1 . 2]" 1
505 1 9 ILE MG 1 90 TYR QD 3.890 . 3.890 2.334 2.090 2.676 . 0 0 "[ . 1 . 2]" 1
506 1 28 ASN HA 1 49 PRO HA 3.580 . 3.580 3.059 2.651 3.396 . 0 0 "[ . 1 . 2]" 1
507 1 108 THR HB 1 138 ILE HB 3.950 . 3.950 3.489 3.402 3.551 . 0 0 "[ . 1 . 2]" 1
508 1 10 LYS HA 1 10 LYS QD 2.650 . 2.650 2.134 1.946 2.470 . 0 0 "[ . 1 . 2]" 1
509 1 129 TYR H 1 129 TYR QD 5.090 . 5.090 4.024 3.784 4.161 . 0 0 "[ . 1 . 2]" 1
510 1 89 SER H 1 100 ILE H 5.500 . 5.500 5.508 5.384 5.572 0.072 7 0 "[ . 1 . 2]" 1
511 1 28 ASN QD 1 29 PHE H 4.000 . 4.000 2.589 1.918 3.825 . 0 0 "[ . 1 . 2]" 1
512 1 59 ALA H 1 140 ASN QD 5.500 . 5.500 4.176 2.605 5.071 . 0 0 "[ . 1 . 2]" 1
513 1 53 TYR HA 1 60 GLU QB 4.300 . 4.300 4.307 4.236 4.367 0.067 16 0 "[ . 1 . 2]" 1
514 1 95 GLU H 1 95 GLU QG 4.080 . 4.080 3.014 2.522 3.570 . 0 0 "[ . 1 . 2]" 1
515 1 17 LYS QB 1 89 SER QB 4.640 . 4.640 2.298 1.890 3.539 . 0 0 "[ . 1 . 2]" 1
516 1 112 LYS QG 1 129 TYR QE 4.680 . 4.680 1.969 1.857 2.237 . 0 0 "[ . 1 . 2]" 1
517 1 29 PHE QE 1 48 ASP HA 5.020 . 5.020 5.045 4.992 5.076 0.056 6 0 "[ . 1 . 2]" 1
518 1 138 ILE MG 1 140 ASN H 5.500 . 5.500 4.684 4.421 5.044 . 0 0 "[ . 1 . 2]" 1
519 1 71 TRP H 1 117 THR MG 5.500 . 5.500 4.323 3.767 5.010 . 0 0 "[ . 1 . 2]" 1
520 1 45 SER HA 1 67 THR MG 5.160 . 5.160 2.868 1.967 3.767 . 0 0 "[ . 1 . 2]" 1
521 1 76 VAL QG 1 113 ILE QG 3.670 . 3.670 1.955 1.782 2.569 0.018 3 0 "[ . 1 . 2]" 1
522 1 30 GLN QB 1 32 LEU HG 4.320 . 4.320 2.931 2.759 3.140 . 0 0 "[ . 1 . 2]" 1
523 1 68 ALA HA 1 98 ALA MB 4.630 . 4.630 3.084 2.910 3.282 . 0 0 "[ . 1 . 2]" 1
524 1 78 GLU H 1 80 ASN H 5.500 . 5.500 4.262 3.928 4.869 . 0 0 "[ . 1 . 2]" 1
525 1 62 GLU HA 1 101 ARG QB 4.790 . 4.790 2.373 1.901 4.031 . 0 0 "[ . 1 . 2]" 1
526 1 79 ASN QB 1 80 ASN H 4.640 . 4.640 2.509 1.891 3.926 . 0 0 "[ . 1 . 2]" 1
527 1 109 GLN HA 1 134 PHE QE 5.000 . 5.000 4.485 4.172 4.963 . 0 0 "[ . 1 . 2]" 1
528 1 104 VAL HB 1 108 THR HB 3.540 . 3.540 2.109 1.941 2.439 . 0 0 "[ . 1 . 2]" 1
529 1 91 SER QB 1 95 GLU QG 4.260 . 4.260 3.333 2.716 3.679 . 0 0 "[ . 1 . 2]" 1
530 1 75 GLU QB 1 76 VAL H 4.440 . 4.440 3.776 3.069 4.019 . 0 0 "[ . 1 . 2]" 1
531 1 65 ILE MG 1 98 ALA H 5.500 . 5.500 2.758 2.370 3.255 . 0 0 "[ . 1 . 2]" 1
532 1 47 LYS H 1 47 LYS QB 3.770 . 3.770 2.628 2.387 2.860 . 0 0 "[ . 1 . 2]" 1
533 1 97 HIS QB 1 99 TYR QD 4.620 . 4.620 4.153 3.837 4.541 . 0 0 "[ . 1 . 2]" 1
534 1 101 ARG QD 1 102 PHE H 5.140 . 5.140 4.043 3.121 4.986 . 0 0 "[ . 1 . 2]" 1
535 1 15 GLU H 1 90 TYR QB 5.500 . 5.500 4.916 4.153 5.357 . 0 0 "[ . 1 . 2]" 1
536 1 67 THR HB 1 71 TRP H 5.500 . 5.500 4.710 4.050 5.287 . 0 0 "[ . 1 . 2]" 1
537 1 28 ASN H 1 28 ASN QD 5.500 . 5.500 4.579 4.254 4.747 . 0 0 "[ . 1 . 2]" 1
538 1 9 ILE H 1 10 LYS H 4.220 . 4.220 2.745 2.575 3.328 . 0 0 "[ . 1 . 2]" 1
539 1 15 GLU HA 1 90 TYR H 4.300 . 4.300 3.647 2.992 4.049 . 0 0 "[ . 1 . 2]" 1
540 1 73 LYS HA 1 115 SER HA 5.200 . 5.200 4.971 4.679 5.213 0.013 4 0 "[ . 1 . 2]" 1
541 1 121 ASP H 1 121 ASP QB 2.660 . 2.660 2.224 1.964 2.460 . 0 0 "[ . 1 . 2]" 1
542 1 28 ASN H 1 135 ALA MB 4.440 . 4.440 2.142 1.930 2.396 . 0 0 "[ . 1 . 2]" 1
543 1 30 GLN QB 1 30 GLN QE 3.950 . 3.950 2.543 1.947 3.366 . 0 0 "[ . 1 . 2]" 1
544 1 89 SER H 1 99 TYR QB 4.020 . 4.020 2.222 1.911 2.649 . 0 0 "[ . 1 . 2]" 1
545 1 129 TYR H 1 130 THR H 5.450 . 5.450 3.954 3.743 4.189 . 0 0 "[ . 1 . 2]" 1
546 1 45 SER QB 1 71 TRP HZ2 3.480 . 3.480 2.378 1.919 3.468 . 0 0 "[ . 1 . 2]" 1
547 1 29 PHE QB 1 132 LEU QD 3.560 . 3.560 2.010 1.793 2.190 0.007 14 0 "[ . 1 . 2]" 1
548 1 102 PHE QD 1 104 VAL HA 4.900 . 4.900 4.325 4.076 4.581 . 0 0 "[ . 1 . 2]" 1
549 1 144 LEU H 1 144 LEU QB 3.050 . 3.050 2.578 1.942 3.016 . 0 0 "[ . 1 . 2]" 1
550 1 34 LYS QD 1 129 TYR QE 4.550 . 4.550 4.004 2.988 4.561 0.011 7 0 "[ . 1 . 2]" 1
551 1 12 PRO QG 1 13 ALA MB 4.830 . 4.830 3.320 3.144 3.519 . 0 0 "[ . 1 . 2]" 1
552 1 95 GLU H 1 97 HIS H 5.500 . 5.500 5.259 4.438 5.517 0.017 15 0 "[ . 1 . 2]" 1
553 1 59 ALA H 1 104 VAL QG 5.500 . 5.500 3.345 3.066 3.840 . 0 0 "[ . 1 . 2]" 1
554 1 111 LEU HA 1 111 LEU QD 2.800 . 2.800 2.911 2.798 2.973 0.173 4 0 "[ . 1 . 2]" 1
555 1 9 ILE QG 1 9 ILE MG 3.280 . 3.280 2.092 1.932 2.260 . 0 0 "[ . 1 . 2]" 1
556 1 65 ILE MD 1 65 ILE MG 3.310 . 3.310 3.066 2.929 3.157 . 0 0 "[ . 1 . 2]" 1
557 1 3 GLU QG 1 4 SER QB 4.660 . 4.660 3.776 3.288 4.676 0.016 15 0 "[ . 1 . 2]" 1
558 1 27 VAL QG 1 28 ASN H 4.010 . 4.010 2.351 1.921 2.770 . 0 0 "[ . 1 . 2]" 1
559 1 119 ILE HA 1 119 ILE MG 3.040 . 3.040 2.279 2.223 2.377 . 0 0 "[ . 1 . 2]" 1
560 1 86 ARG H 1 86 ARG QG 4.560 . 4.560 2.235 1.888 4.127 . 0 0 "[ . 1 . 2]" 1
561 1 124 GLU H 1 124 GLU QB 3.480 . 3.480 2.148 1.957 2.324 . 0 0 "[ . 1 . 2]" 1
562 1 70 THR MG 1 119 ILE MG 3.500 . 3.500 3.036 2.467 3.394 . 0 0 "[ . 1 . 2]" 1
563 1 92 PRO HA 1 96 ASP HA 5.300 . 5.300 5.301 5.209 5.360 0.060 9 0 "[ . 1 . 2]" 1
564 1 85 VAL QG 1 102 PHE QD 3.500 . 3.500 2.348 1.903 2.868 . 0 0 "[ . 1 . 2]" 1
565 1 74 PHE HZ 1 113 ILE MG 5.410 . 5.410 3.751 2.789 4.650 . 0 0 "[ . 1 . 2]" 1
566 1 6 LYS QG 1 72 LYS HA 4.560 . 4.560 3.902 2.487 4.533 . 0 0 "[ . 1 . 2]" 1
567 1 14 LEU QB 1 15 GLU H 4.910 . 4.910 3.286 2.565 3.824 . 0 0 "[ . 1 . 2]" 1
568 1 68 ALA H 1 96 ASP QB 5.500 . 5.500 4.219 3.949 4.380 . 0 0 "[ . 1 . 2]" 1
569 1 119 ILE H 1 119 ILE MD 5.500 . 5.500 2.048 1.913 2.396 . 0 0 "[ . 1 . 2]" 1
570 1 81 GLN HA 1 82 LYS H 3.020 . 3.020 2.254 2.210 2.472 . 0 0 "[ . 1 . 2]" 1
571 1 63 LEU HA 1 63 LEU QD 3.430 . 3.430 2.654 1.951 3.352 . 0 0 "[ . 1 . 2]" 1
572 1 132 LEU QD 1 133 VAL HA 4.030 . 4.030 3.750 3.311 3.983 . 0 0 "[ . 1 . 2]" 1
573 1 16 ASN H 1 17 LYS H 4.260 . 4.260 3.022 2.028 3.508 . 0 0 "[ . 1 . 2]" 1
574 1 74 PHE QD 1 85 VAL H 5.500 . 5.500 5.430 5.202 5.545 0.045 1 0 "[ . 1 . 2]" 1
575 1 32 LEU HA 1 38 THR HA 3.510 . 3.510 3.320 3.087 3.515 0.005 12 0 "[ . 1 . 2]" 1
576 1 125 THR HA 1 125 THR MG 2.960 . 2.960 2.188 1.999 2.336 . 0 0 "[ . 1 . 2]" 1
577 1 139 TYR HA 1 139 TYR QD 3.910 . 3.910 2.353 2.190 2.509 . 0 0 "[ . 1 . 2]" 1
578 1 76 VAL HA 1 112 LYS H 5.500 . 5.500 4.579 3.835 5.141 . 0 0 "[ . 1 . 2]" 1
579 1 58 LYS HA 1 59 ALA H 3.320 . 3.320 2.403 2.332 2.466 . 0 0 "[ . 1 . 2]" 1
580 1 34 LYS H 1 129 TYR QE 5.500 . 5.500 3.996 2.054 4.637 . 0 0 "[ . 1 . 2]" 1
581 1 55 THR HA 1 57 LYS H 4.560 . 4.560 4.368 4.106 4.559 . 0 0 "[ . 1 . 2]" 1
582 1 4 SER H 1 8 ALA MB 5.500 . 5.500 3.886 3.240 4.797 . 0 0 "[ . 1 . 2]" 1
583 1 125 THR MG 1 126 ASN H 4.560 . 4.560 3.408 2.875 3.704 . 0 0 "[ . 1 . 2]" 1
584 1 30 GLN QG 1 32 LEU QD 4.670 . 4.670 3.376 2.871 3.743 . 0 0 "[ . 1 . 2]" 1
585 1 104 VAL HA 1 104 VAL QG 3.230 . 3.230 2.163 2.026 2.263 . 0 0 "[ . 1 . 2]" 1
586 1 141 ASP HA 1 144 LEU H 5.010 . 5.010 3.811 3.396 4.441 . 0 0 "[ . 1 . 2]" 1
587 1 77 TYR QD 1 82 LYS QB 5.500 . 5.500 4.402 3.716 5.023 . 0 0 "[ . 1 . 2]" 1
588 1 70 THR H 1 71 TRP H 4.350 . 4.350 2.219 1.970 2.429 . 0 0 "[ . 1 . 2]" 1
589 1 76 VAL QG 1 77 TYR H 4.280 . 4.280 2.514 1.908 3.397 . 0 0 "[ . 1 . 2]" 1
590 1 118 GLN HA 1 119 ILE HB 4.790 . 4.790 4.627 4.492 4.776 . 0 0 "[ . 1 . 2]" 1
591 1 100 ILE HA 1 100 ILE MG 3.030 . 3.030 2.337 2.211 2.418 . 0 0 "[ . 1 . 2]" 1
592 1 51 ASP H 1 51 ASP QB 3.740 . 3.740 2.308 2.040 2.575 . 0 0 "[ . 1 . 2]" 1
593 1 29 PHE HA 1 136 LYS H 5.500 . 5.500 5.449 5.319 5.533 0.033 12 0 "[ . 1 . 2]" 1
594 1 90 TYR QE 1 93 VAL H 4.990 . 4.990 3.754 3.668 3.871 . 0 0 "[ . 1 . 2]" 1
595 1 76 VAL HB 1 77 TYR H 5.020 . 5.020 3.986 2.898 4.475 . 0 0 "[ . 1 . 2]" 1
596 1 16 ASN HA 1 91 SER HA 4.370 . 4.370 4.090 3.381 4.350 . 0 0 "[ . 1 . 2]" 1
597 1 29 PHE QE 1 46 ILE MD 5.130 . 5.130 4.672 4.229 5.121 . 0 0 "[ . 1 . 2]" 1
598 1 33 ASP H 1 37 GLU H 4.060 . 4.060 3.143 2.697 3.690 . 0 0 "[ . 1 . 2]" 1
599 1 139 TYR H 1 139 TYR QE 5.470 . 5.470 5.179 5.037 5.482 0.012 4 0 "[ . 1 . 2]" 1
600 1 33 ASP HA 1 130 THR HA 3.630 . 3.630 3.049 2.583 3.503 . 0 0 "[ . 1 . 2]" 1
601 1 141 ASP HA 1 144 LEU QD 5.130 . 5.130 4.474 3.899 4.989 . 0 0 "[ . 1 . 2]" 1
602 1 109 GLN QE 1 134 PHE QB 5.350 . 5.350 4.113 3.240 4.965 . 0 0 "[ . 1 . 2]" 1
603 1 6 LYS QG 1 7 ASP H 4.380 . 4.380 3.278 2.079 4.430 0.050 1 0 "[ . 1 . 2]" 1
604 1 76 VAL HB 1 113 ILE HA 4.760 . 4.760 4.256 2.049 4.794 0.034 18 0 "[ . 1 . 2]" 1
605 1 30 GLN H 1 132 LEU HG 4.500 . 4.500 3.487 3.260 4.066 . 0 0 "[ . 1 . 2]" 1
606 1 31 LEU HA 1 132 LEU HA 3.720 . 3.720 2.819 2.555 2.979 . 0 0 "[ . 1 . 2]" 1
607 1 91 SER QB 1 97 HIS H 4.100 . 4.100 2.511 1.838 2.941 . 0 0 "[ . 1 . 2]" 1
608 1 126 ASN H 1 126 ASN QB 3.670 . 3.670 2.292 2.093 3.070 . 0 0 "[ . 1 . 2]" 1
609 1 32 LEU QB 1 36 ASN HA 3.310 . 3.310 2.557 2.101 2.871 . 0 0 "[ . 1 . 2]" 1
610 1 89 SER HA 1 90 TYR H 3.200 . 3.200 2.361 2.302 2.462 . 0 0 "[ . 1 . 2]" 1
611 1 32 LEU QD 1 33 ASP H 5.500 . 5.500 3.533 3.176 3.785 . 0 0 "[ . 1 . 2]" 1
612 1 31 LEU QD 1 132 LEU HA 3.530 . 3.530 3.282 2.979 3.539 0.009 16 0 "[ . 1 . 2]" 1
613 1 116 SER QB 1 127 TYR QD 4.890 . 4.890 4.688 4.002 4.889 . 0 0 "[ . 1 . 2]" 1
614 1 108 THR H 1 138 ILE MG 5.500 . 5.500 5.290 5.156 5.352 . 0 0 "[ . 1 . 2]" 1
615 1 9 ILE MG 1 90 TYR QE 4.200 . 4.200 3.118 2.542 3.574 . 0 0 "[ . 1 . 2]" 1
616 1 29 PHE HA 1 134 PHE QB 4.490 . 4.490 4.342 4.191 4.444 . 0 0 "[ . 1 . 2]" 1
617 1 131 LYS QG 1 133 VAL H 5.500 . 5.500 3.779 3.396 4.358 . 0 0 "[ . 1 . 2]" 1
618 1 102 PHE H 1 103 PRO QD 5.500 . 5.500 4.346 4.293 4.379 . 0 0 "[ . 1 . 2]" 1
619 1 66 ASN HA 1 67 THR MG 5.230 . 5.230 4.577 4.192 5.103 . 0 0 "[ . 1 . 2]" 1
620 1 61 VAL H 1 101 ARG HA 5.210 . 5.210 4.979 4.330 5.214 0.004 13 0 "[ . 1 . 2]" 1
621 1 26 GLN QE 1 27 VAL QG 5.500 . 5.500 5.157 3.858 5.503 0.003 11 0 "[ . 1 . 2]" 1
622 1 90 TYR QE 1 91 SER H 4.580 . 4.580 4.601 4.551 4.638 0.058 7 0 "[ . 1 . 2]" 1
623 1 38 THR H 1 39 GLN HA 5.500 . 5.500 5.382 5.128 5.506 0.006 18 0 "[ . 1 . 2]" 1
624 1 9 ILE HA 1 9 ILE MD 4.700 . 4.700 4.014 3.748 4.127 . 0 0 "[ . 1 . 2]" 1
625 1 98 ALA H 1 99 TYR H 5.500 . 5.500 4.493 4.301 4.568 . 0 0 "[ . 1 . 2]" 1
626 1 105 SER H 1 106 ASP H 4.580 . 4.580 4.602 4.519 4.614 0.034 19 0 "[ . 1 . 2]" 1
627 1 108 THR MG 1 109 GLN H 3.950 . 3.950 2.851 2.633 3.315 . 0 0 "[ . 1 . 2]" 1
628 1 30 GLN H 1 134 PHE QD 5.500 . 5.500 4.945 4.738 5.259 . 0 0 "[ . 1 . 2]" 1
629 1 87 LEU H 1 87 LEU QB 3.370 . 3.370 2.199 2.012 2.437 . 0 0 "[ . 1 . 2]" 1
630 1 134 PHE HA 1 134 PHE QD 3.760 . 3.760 2.002 1.930 2.169 . 0 0 "[ . 1 . 2]" 1
631 1 32 LEU H 1 33 ASP H 5.500 . 5.500 4.174 3.944 4.433 . 0 0 "[ . 1 . 2]" 1
632 1 26 GLN H 1 27 VAL QG 5.230 . 5.230 3.556 3.329 3.923 . 0 0 "[ . 1 . 2]" 1
633 1 68 ALA MB 1 97 HIS HA 4.360 . 4.360 3.443 3.071 4.038 . 0 0 "[ . 1 . 2]" 1
634 1 19 HIS HD2 1 88 VAL QG 5.010 . 5.010 4.268 3.482 4.955 . 0 0 "[ . 1 . 2]" 1
635 1 29 PHE HA 1 29 PHE QD 4.080 . 4.080 3.688 3.674 3.699 . 0 0 "[ . 1 . 2]" 1
636 1 108 THR H 1 109 GLN H 4.700 . 4.700 4.524 4.361 4.595 . 0 0 "[ . 1 . 2]" 1
637 1 29 PHE HZ 1 31 LEU QD 4.550 . 4.550 4.412 3.948 4.566 0.016 8 0 "[ . 1 . 2]" 1
638 1 62 GLU H 1 63 LEU H 4.880 . 4.880 4.434 4.227 4.524 . 0 0 "[ . 1 . 2]" 1
639 1 72 LYS QB 1 73 LYS H 4.240 . 4.240 2.324 1.942 2.735 . 0 0 "[ . 1 . 2]" 1
640 1 144 LEU HA 1 144 LEU QD 2.490 . 2.490 2.178 1.875 2.491 0.001 12 0 "[ . 1 . 2]" 1
641 1 55 THR HA 1 56 LYS QB 4.780 . 4.780 4.339 4.218 4.469 . 0 0 "[ . 1 . 2]" 1
642 1 56 LYS HA 1 56 LYS QE 5.500 . 5.500 4.703 3.469 5.502 0.002 15 0 "[ . 1 . 2]" 1
643 1 9 ILE HA 1 87 LEU QD 3.020 . 3.020 2.652 2.122 3.026 0.006 7 0 "[ . 1 . 2]" 1
644 1 109 GLN QG 1 110 GLU H 5.500 . 5.500 4.338 4.082 4.571 . 0 0 "[ . 1 . 2]" 1
645 1 57 LYS HA 1 57 LYS QD 3.750 . 3.750 3.378 1.930 3.731 . 0 0 "[ . 1 . 2]" 1
646 1 76 VAL QG 1 78 GLU H 5.500 . 5.500 4.137 3.659 4.670 . 0 0 "[ . 1 . 2]" 1
647 1 54 TYR HA 1 55 THR MG 4.490 . 4.490 3.755 3.249 4.210 . 0 0 "[ . 1 . 2]" 1
648 1 109 GLN H 1 110 GLU HA 5.080 . 5.080 4.797 4.710 4.907 . 0 0 "[ . 1 . 2]" 1
649 1 113 ILE MD 1 132 LEU QD 3.520 . 3.520 1.900 1.797 2.166 0.003 15 0 "[ . 1 . 2]" 1
650 1 46 ILE QG 1 71 TRP HZ2 5.180 . 5.180 3.863 3.379 4.566 . 0 0 "[ . 1 . 2]" 1
651 1 88 VAL HA 1 88 VAL QG 2.930 . 2.930 2.303 2.052 2.470 . 0 0 "[ . 1 . 2]" 1
652 1 92 PRO QB 1 93 VAL H 3.300 . 3.300 2.622 2.599 2.643 . 0 0 "[ . 1 . 2]" 1
653 1 30 GLN QE 1 133 VAL QG 5.260 . 5.260 3.316 2.465 4.511 . 0 0 "[ . 1 . 2]" 1
654 1 132 LEU HA 1 132 LEU QD 3.550 . 3.550 3.042 2.980 3.113 . 0 0 "[ . 1 . 2]" 1
655 1 46 ILE HA 1 46 ILE MG 3.420 . 3.420 2.339 2.065 2.516 . 0 0 "[ . 1 . 2]" 1
656 1 68 ALA MB 1 97 HIS QB 5.150 . 5.150 4.676 4.366 5.156 0.006 6 0 "[ . 1 . 2]" 1
657 1 70 THR HA 1 70 THR MG 3.020 . 3.020 2.389 2.297 2.475 . 0 0 "[ . 1 . 2]" 1
658 1 27 VAL QG 1 136 LYS QD 4.750 . 4.750 3.478 1.980 4.598 . 0 0 "[ . 1 . 2]" 1
659 1 46 ILE QG 1 65 ILE MD 4.790 . 4.790 3.454 2.976 4.792 0.002 7 0 "[ . 1 . 2]" 1
660 1 106 ASP QB 1 107 GLY H 3.970 . 3.970 3.695 3.643 3.753 . 0 0 "[ . 1 . 2]" 1
661 1 57 LYS H 1 58 LYS HA 5.500 . 5.500 4.855 4.376 5.047 . 0 0 "[ . 1 . 2]" 1
662 1 65 ILE HA 1 65 ILE MG 3.360 . 3.360 2.512 2.439 2.570 . 0 0 "[ . 1 . 2]" 1
663 1 73 LYS QB 1 74 PHE H 5.500 . 5.500 2.630 2.159 3.198 . 0 0 "[ . 1 . 2]" 1
664 1 52 VAL H 1 52 VAL QG 4.180 . 4.180 2.325 1.935 2.845 . 0 0 "[ . 1 . 2]" 1
665 1 104 VAL QG 1 138 ILE QG 4.010 . 4.010 2.657 2.489 2.783 . 0 0 "[ . 1 . 2]" 1
666 1 47 LYS HA 1 47 LYS QE 4.880 . 4.880 3.766 2.027 4.687 . 0 0 "[ . 1 . 2]" 1
667 1 84 PRO QD 1 103 PRO QG 5.360 . 5.360 3.733 3.316 4.496 . 0 0 "[ . 1 . 2]" 1
668 1 82 LYS H 1 83 LEU H 5.500 . 5.500 4.419 4.203 4.577 . 0 0 "[ . 1 . 2]" 1
669 1 134 PHE H 1 134 PHE QB 3.750 . 3.750 2.121 2.064 2.174 . 0 0 "[ . 1 . 2]" 1
670 1 77 TYR H 1 112 LYS QB 4.650 . 4.650 3.072 2.653 3.447 . 0 0 "[ . 1 . 2]" 1
671 1 74 PHE QD 1 100 ILE QG 4.060 . 4.060 3.850 3.450 4.102 0.042 4 0 "[ . 1 . 2]" 1
672 1 28 ASN QD 1 30 GLN QE 3.490 . 3.490 2.738 2.215 3.490 0.000 8 0 "[ . 1 . 2]" 1
673 1 86 ARG HA 1 101 ARG H 5.500 . 5.500 4.994 4.393 5.201 . 0 0 "[ . 1 . 2]" 1
674 1 65 ILE HB 1 65 ILE MD 3.420 . 3.420 2.091 1.942 2.200 . 0 0 "[ . 1 . 2]" 1
675 1 144 LEU H 1 144 LEU QD 4.220 . 4.220 3.518 2.460 3.889 . 0 0 "[ . 1 . 2]" 1
676 1 112 LYS HA 1 129 TYR QE 4.500 . 4.500 4.400 3.857 4.532 0.032 13 0 "[ . 1 . 2]" 1
677 1 76 VAL H 1 76 VAL HB 3.490 . 3.490 2.543 2.003 3.551 0.061 19 0 "[ . 1 . 2]" 1
678 1 69 SER H 1 70 THR H 4.480 . 4.480 2.592 2.340 2.695 . 0 0 "[ . 1 . 2]" 1
679 1 77 TYR QB 1 78 GLU H 4.500 . 4.500 3.621 3.264 3.836 . 0 0 "[ . 1 . 2]" 1
680 1 137 PRO QB 1 138 ILE H 4.190 . 4.190 3.322 3.207 3.411 . 0 0 "[ . 1 . 2]" 1
681 1 4 SER HA 1 5 LEU QB 4.750 . 4.750 4.021 3.986 4.120 . 0 0 "[ . 1 . 2]" 1
682 1 118 GLN HA 1 119 ILE MD 5.490 . 5.490 3.046 2.653 3.642 . 0 0 "[ . 1 . 2]" 1
683 1 65 ILE MD 1 100 ILE HB 4.390 . 4.390 4.290 4.024 4.435 0.045 7 0 "[ . 1 . 2]" 1
684 1 128 ASP H 1 129 TYR H 4.040 . 4.040 2.966 2.561 3.934 . 0 0 "[ . 1 . 2]" 1
685 1 88 VAL QG 1 99 TYR QB 4.280 . 4.280 2.069 1.788 2.762 0.012 15 0 "[ . 1 . 2]" 1
686 1 92 PRO QB 1 93 VAL QG 4.790 . 4.790 3.880 3.753 3.962 . 0 0 "[ . 1 . 2]" 1
687 1 109 GLN H 1 138 ILE H 5.500 . 5.500 4.779 4.600 5.053 . 0 0 "[ . 1 . 2]" 1
688 1 77 TYR H 1 78 GLU H 4.870 . 4.870 4.273 4.108 4.411 . 0 0 "[ . 1 . 2]" 1
689 1 78 GLU H 1 79 ASN H 5.260 . 5.260 4.421 4.316 4.516 . 0 0 "[ . 1 . 2]" 1
690 1 67 THR HA 1 67 THR HB 2.740 . 2.740 2.536 2.388 2.769 0.029 4 0 "[ . 1 . 2]" 1
691 1 79 ASN HA 1 79 ASN QB 2.740 . 2.740 2.516 2.324 2.552 . 0 0 "[ . 1 . 2]" 1
692 1 67 THR HB 1 68 ALA H 4.480 . 4.480 4.426 4.322 4.510 0.030 3 0 "[ . 1 . 2]" 1
693 1 80 ASN H 1 81 GLN H 3.510 . 3.510 2.516 2.046 3.204 . 0 0 "[ . 1 . 2]" 1
694 1 130 THR HA 1 130 THR MG 3.340 . 3.340 2.404 2.159 2.566 . 0 0 "[ . 1 . 2]" 1
695 1 45 SER H 1 46 ILE H 3.910 . 3.910 3.120 2.532 4.078 0.168 7 0 "[ . 1 . 2]" 1
696 1 27 VAL QG 1 135 ALA HA 5.480 . 5.480 4.488 4.234 4.686 . 0 0 "[ . 1 . 2]" 1
697 1 62 GLU HA 1 101 ARG QG 4.300 . 4.300 3.718 1.914 4.301 0.001 7 0 "[ . 1 . 2]" 1
698 1 76 VAL QG 1 111 LEU QD 3.420 . 3.420 1.996 1.833 2.223 . 0 0 "[ . 1 . 2]" 1
699 1 20 ASP QB 1 21 ILE H 5.500 . 5.500 3.874 3.235 4.074 . 0 0 "[ . 1 . 2]" 1
700 1 85 VAL QG 1 100 ILE HA 4.010 . 4.010 3.693 3.498 3.949 . 0 0 "[ . 1 . 2]" 1
701 1 31 LEU QB 1 32 LEU H 4.950 . 4.950 3.512 3.423 3.583 . 0 0 "[ . 1 . 2]" 1
702 1 6 LYS H 1 7 ASP HA 5.210 . 5.210 5.198 5.130 5.272 0.062 15 0 "[ . 1 . 2]" 1
703 1 14 LEU HG 1 89 SER HA 5.120 . 5.120 4.708 2.842 5.149 0.029 7 0 "[ . 1 . 2]" 1
704 1 105 SER H 1 105 SER QB 3.760 . 3.760 2.389 2.027 2.917 . 0 0 "[ . 1 . 2]" 1
705 1 15 GLU H 1 89 SER HA 5.500 . 5.500 5.127 4.660 5.489 . 0 0 "[ . 1 . 2]" 1
706 1 74 PHE QD 1 75 GLU H 4.130 . 4.130 2.100 1.940 2.426 . 0 0 "[ . 1 . 2]" 1
707 1 37 GLU HA 1 38 THR H 3.160 . 3.160 2.236 2.211 2.306 . 0 0 "[ . 1 . 2]" 1
708 1 15 GLU HA 1 90 TYR QD 4.300 . 4.300 2.812 2.293 3.171 . 0 0 "[ . 1 . 2]" 1
709 1 117 THR H 1 127 TYR QD 5.500 . 5.500 3.410 2.419 4.174 . 0 0 "[ . 1 . 2]" 1
710 1 82 LYS H 1 82 LYS QB 3.400 . 3.400 2.093 1.981 2.274 . 0 0 "[ . 1 . 2]" 1
711 1 77 TYR QB 1 81 GLN H 4.690 . 4.690 4.031 3.396 4.554 . 0 0 "[ . 1 . 2]" 1
712 1 108 THR MG 1 138 ILE H 4.860 . 4.860 4.880 4.811 4.910 0.050 15 0 "[ . 1 . 2]" 1
713 1 88 VAL QG 1 101 ARG QD 4.240 . 4.240 2.727 1.921 3.507 . 0 0 "[ . 1 . 2]" 1
714 1 113 ILE QG 1 130 THR HB 4.900 . 4.900 4.249 4.075 4.452 . 0 0 "[ . 1 . 2]" 1
715 1 134 PHE QD 1 136 LYS H 4.370 . 4.370 4.261 3.983 4.386 0.016 5 0 "[ . 1 . 2]" 1
716 1 143 SER H 1 144 LEU QD 5.090 . 5.090 4.714 4.286 5.067 . 0 0 "[ . 1 . 2]" 1
717 1 95 GLU QB 1 97 HIS HD2 3.330 . 3.330 2.893 2.690 3.119 . 0 0 "[ . 1 . 2]" 1
718 1 90 TYR H 1 91 SER H 5.500 . 5.500 4.195 4.176 4.228 . 0 0 "[ . 1 . 2]" 1
719 1 115 SER QB 1 116 SER H 5.500 . 5.500 2.745 2.253 3.423 . 0 0 "[ . 1 . 2]" 1
720 1 98 ALA HA 1 99 TYR QE 5.110 . 5.110 4.908 4.641 5.126 0.016 13 0 "[ . 1 . 2]" 1
721 1 136 LYS QB 1 137 PRO QD 3.530 . 3.530 2.067 1.892 2.278 . 0 0 "[ . 1 . 2]" 1
722 1 30 GLN QB 1 133 VAL QG 4.270 . 4.270 2.487 1.791 2.987 0.009 10 0 "[ . 1 . 2]" 1
723 1 83 LEU HA 1 83 LEU QD 2.780 . 2.780 2.102 1.895 2.509 . 0 0 "[ . 1 . 2]" 1
724 1 34 LYS H 1 35 ASN H 4.750 . 4.750 2.902 2.715 3.178 . 0 0 "[ . 1 . 2]" 1
725 1 27 VAL HB 1 51 ASP H 4.930 . 4.930 4.962 4.794 5.030 0.100 4 0 "[ . 1 . 2]" 1
726 1 76 VAL QG 1 111 LEU HG 4.010 . 4.010 3.741 3.406 4.047 0.037 19 0 "[ . 1 . 2]" 1
727 1 45 SER QB 1 46 ILE MD 5.090 . 5.090 2.434 1.924 3.285 . 0 0 "[ . 1 . 2]" 1
728 1 59 ALA HA 1 60 GLU H 3.050 . 3.050 2.378 2.268 2.541 . 0 0 "[ . 1 . 2]" 1
729 1 14 LEU H 1 89 SER HA 5.500 . 5.500 5.359 5.101 5.516 0.016 3 0 "[ . 1 . 2]" 1
730 1 138 ILE HA 1 138 ILE MD 2.830 . 2.830 1.975 1.915 2.071 . 0 0 "[ . 1 . 2]" 1
731 1 33 ASP QB 1 35 ASN H 5.010 . 5.010 3.054 2.533 4.398 . 0 0 "[ . 1 . 2]" 1
732 1 52 VAL HA 1 62 GLU H 4.330 . 4.330 3.554 3.288 3.811 . 0 0 "[ . 1 . 2]" 1
733 1 58 LYS QE 1 59 ALA H 3.770 . 3.770 2.747 1.935 3.774 0.004 2 0 "[ . 1 . 2]" 1
734 1 79 ASN H 1 80 ASN H 4.900 . 4.900 3.618 2.733 4.182 . 0 0 "[ . 1 . 2]" 1
735 1 58 LYS QB 1 58 LYS QE 4.320 . 4.320 3.120 1.863 3.698 . 0 0 "[ . 1 . 2]" 1
736 1 51 ASP H 1 52 VAL H 5.160 . 5.160 4.482 4.075 4.685 . 0 0 "[ . 1 . 2]" 1
737 1 108 THR MG 1 110 GLU HA 4.960 . 4.960 4.482 4.216 4.637 . 0 0 "[ . 1 . 2]" 1
738 1 18 GLU QG 1 19 HIS H 5.110 . 5.110 3.862 3.086 4.302 . 0 0 "[ . 1 . 2]" 1
739 1 59 ALA MB 1 141 ASP H 5.500 . 5.500 4.192 3.858 4.776 . 0 0 "[ . 1 . 2]" 1
740 1 34 LYS QB 1 35 ASN QD 4.770 . 4.770 3.055 2.407 3.880 . 0 0 "[ . 1 . 2]" 1
741 1 26 GLN QG 1 52 VAL H 5.500 . 5.500 5.120 4.471 5.501 0.001 17 0 "[ . 1 . 2]" 1
742 1 17 LYS H 1 90 TYR H 4.360 . 4.360 3.811 2.993 4.198 . 0 0 "[ . 1 . 2]" 1
743 1 132 LEU QD 1 134 PHE H 4.750 . 4.750 3.264 2.915 3.716 . 0 0 "[ . 1 . 2]" 1
744 1 2 ASP HA 1 3 GLU HA 4.720 . 4.720 4.515 4.431 4.695 . 0 0 "[ . 1 . 2]" 1
745 1 138 ILE H 1 139 TYR QE 5.500 . 5.500 5.496 5.399 5.531 0.031 5 0 "[ . 1 . 2]" 1
746 1 78 GLU H 1 83 LEU HG 4.150 . 4.150 3.769 3.175 4.113 . 0 0 "[ . 1 . 2]" 1
747 1 54 TYR QE 1 104 VAL QG 3.580 . 3.580 3.614 3.573 3.678 0.098 16 0 "[ . 1 . 2]" 1
748 1 87 LEU QB 1 88 VAL H 5.500 . 5.500 3.627 3.163 3.901 . 0 0 "[ . 1 . 2]" 1
749 1 139 TYR HA 1 140 ASN H 3.210 . 3.210 2.221 2.205 2.264 . 0 0 "[ . 1 . 2]" 1
750 1 113 ILE HB 1 130 THR HB 3.380 . 3.380 2.070 1.939 2.311 . 0 0 "[ . 1 . 2]" 1
751 1 17 LYS QE 1 17 LYS QG 2.890 . 2.890 2.201 1.951 2.437 . 0 0 "[ . 1 . 2]" 1
752 1 111 LEU HG 1 132 LEU QB 5.050 . 5.050 3.037 2.725 3.300 . 0 0 "[ . 1 . 2]" 1
753 1 67 THR MG 1 71 TRP HE1 5.500 . 5.500 4.715 4.195 5.352 . 0 0 "[ . 1 . 2]" 1
754 1 29 PHE HA 1 135 ALA MB 5.010 . 5.010 3.845 3.625 3.966 . 0 0 "[ . 1 . 2]" 1
755 1 117 THR HB 1 119 ILE MD 4.090 . 4.090 3.734 3.280 3.997 . 0 0 "[ . 1 . 2]" 1
756 1 97 HIS QB 1 98 ALA H 4.940 . 4.940 3.551 3.334 3.631 . 0 0 "[ . 1 . 2]" 1
757 1 69 SER H 1 71 TRP H 5.500 . 5.500 4.195 4.023 4.357 . 0 0 "[ . 1 . 2]" 1
758 1 85 VAL QG 1 102 PHE QB 4.210 . 4.210 2.838 1.862 3.392 . 0 0 "[ . 1 . 2]" 1
759 1 95 GLU QB 1 97 HIS QB 4.760 . 4.760 2.918 2.458 3.085 . 0 0 "[ . 1 . 2]" 1
760 1 3 GLU HA 1 4 SER H 3.060 . 3.060 2.887 2.204 2.984 . 0 0 "[ . 1 . 2]" 1
761 1 119 ILE MG 1 121 ASP H 5.500 . 5.500 4.109 3.252 4.772 . 0 0 "[ . 1 . 2]" 1
762 1 51 ASP QB 1 52 VAL H 4.580 . 4.580 3.102 2.453 3.872 . 0 0 "[ . 1 . 2]" 1
763 1 28 ASN H 1 29 PHE QD 5.500 . 5.500 5.361 5.055 5.491 . 0 0 "[ . 1 . 2]" 1
764 1 68 ALA H 1 69 SER H 4.540 . 4.540 2.715 2.596 2.853 . 0 0 "[ . 1 . 2]" 1
765 1 34 LYS QB 1 129 TYR QD 3.920 . 3.920 2.431 1.947 2.981 . 0 0 "[ . 1 . 2]" 1
766 1 50 ALA MB 1 51 ASP H 3.780 . 3.780 3.074 2.432 3.708 . 0 0 "[ . 1 . 2]" 1
767 1 76 VAL QG 1 113 ILE MD 4.870 . 4.870 2.930 2.605 3.182 . 0 0 "[ . 1 . 2]" 1
768 1 58 LYS QD 1 140 ASN QD 4.610 . 4.610 3.931 2.834 4.585 . 0 0 "[ . 1 . 2]" 1
769 1 29 PHE QE 1 50 ALA MB 3.750 . 3.750 3.361 3.135 3.544 . 0 0 "[ . 1 . 2]" 1
770 1 62 GLU QG 1 101 ARG QG 4.950 . 4.950 3.411 2.148 4.976 0.026 11 0 "[ . 1 . 2]" 1
771 1 25 GLU H 1 52 VAL H 5.500 . 5.500 2.605 2.076 3.156 . 0 0 "[ . 1 . 2]" 1
772 1 34 LYS H 1 35 ASN QD 4.990 . 4.990 4.025 3.131 4.944 . 0 0 "[ . 1 . 2]" 1
773 1 110 GLU H 1 110 GLU QB 3.730 . 3.730 2.846 2.534 3.351 . 0 0 "[ . 1 . 2]" 1
774 1 109 GLN QB 1 137 PRO HA 3.730 . 3.730 2.192 1.929 2.755 . 0 0 "[ . 1 . 2]" 1
775 1 24 ARG H 1 54 TYR QD 5.500 . 5.500 4.823 4.505 5.139 . 0 0 "[ . 1 . 2]" 1
776 1 53 TYR HA 1 55 THR MG 5.160 . 5.160 4.367 4.201 4.639 . 0 0 "[ . 1 . 2]" 1
777 1 90 TYR HA 1 99 TYR QD 4.060 . 4.060 2.895 2.467 3.808 . 0 0 "[ . 1 . 2]" 1
778 1 5 LEU QD 1 71 TRP HA 4.940 . 4.940 4.390 3.827 4.816 . 0 0 "[ . 1 . 2]" 1
779 1 66 ASN QB 1 67 THR H 4.770 . 4.770 2.631 2.118 3.058 . 0 0 "[ . 1 . 2]" 1
780 1 34 LYS QB 1 34 LYS QE 4.060 . 4.060 2.874 2.186 3.556 . 0 0 "[ . 1 . 2]" 1
781 1 14 LEU HA 1 17 LYS QB 3.440 . 3.440 2.917 2.473 3.439 . 0 0 "[ . 1 . 2]" 1
782 1 109 GLN HA 1 138 ILE H 4.510 . 4.510 3.550 3.325 3.889 . 0 0 "[ . 1 . 2]" 1
783 1 70 THR MG 1 117 THR HB 4.930 . 4.930 4.310 4.037 4.751 . 0 0 "[ . 1 . 2]" 1
784 1 60 GLU QB 1 103 PRO HA 4.700 . 4.700 4.474 4.109 4.716 0.016 2 0 "[ . 1 . 2]" 1
785 1 134 PHE QD 1 135 ALA MB 4.550 . 4.550 4.285 4.028 4.440 . 0 0 "[ . 1 . 2]" 1
786 1 78 GLU QB 1 79 ASN H 5.500 . 5.500 3.274 2.802 3.752 . 0 0 "[ . 1 . 2]" 1
787 1 105 SER HA 1 106 ASP H 2.950 . 2.950 2.380 2.267 2.623 . 0 0 "[ . 1 . 2]" 1
788 1 85 VAL HA 1 85 VAL QG 3.070 . 3.070 2.139 1.934 2.303 . 0 0 "[ . 1 . 2]" 1
789 1 109 GLN HA 1 138 ILE MD 4.890 . 4.890 4.112 3.850 4.549 . 0 0 "[ . 1 . 2]" 1
790 1 46 ILE MG 1 63 LEU QB 3.620 . 3.620 3.315 2.155 3.635 0.015 6 0 "[ . 1 . 2]" 1
791 1 111 LEU H 1 111 LEU QD 4.530 . 4.530 2.485 2.449 2.519 . 0 0 "[ . 1 . 2]" 1
792 1 86 ARG HA 1 86 ARG QD 4.090 . 4.090 3.912 3.609 4.186 0.096 14 0 "[ . 1 . 2]" 1
793 1 108 THR HA 1 111 LEU QD 4.940 . 4.940 4.227 3.957 4.501 . 0 0 "[ . 1 . 2]" 1
794 1 52 VAL QG 1 54 TYR QD 4.950 . 4.950 3.093 2.888 3.643 . 0 0 "[ . 1 . 2]" 1
795 1 101 ARG HA 1 101 ARG QD 4.460 . 4.460 4.027 3.201 4.377 . 0 0 "[ . 1 . 2]" 1
796 1 112 LYS HA 1 131 LYS HA 3.180 . 3.180 2.720 2.415 3.204 0.024 10 0 "[ . 1 . 2]" 1
797 1 16 ASN H 1 92 PRO QD 5.500 . 5.500 4.454 3.512 5.393 . 0 0 "[ . 1 . 2]" 1
798 1 35 ASN QB 1 37 GLU QG 4.160 . 4.160 3.443 1.847 4.130 . 0 0 "[ . 1 . 2]" 1
799 1 101 ARG HA 1 102 PHE H 3.510 . 3.510 2.342 2.244 2.457 . 0 0 "[ . 1 . 2]" 1
800 1 23 PRO QG 1 54 TYR QD 4.820 . 4.820 4.578 4.152 4.840 0.020 6 0 "[ . 1 . 2]" 1
801 1 54 TYR HA 1 54 TYR QD 3.490 . 3.490 1.951 1.911 2.040 . 0 0 "[ . 1 . 2]" 1
802 1 27 VAL QG 1 28 ASN HA 5.380 . 5.380 3.872 3.604 4.050 . 0 0 "[ . 1 . 2]" 1
803 1 88 VAL QG 1 90 TYR H 5.210 . 5.210 5.105 4.949 5.242 0.032 19 0 "[ . 1 . 2]" 1
804 1 123 GLU H 1 124 GLU H 4.830 . 4.830 4.509 4.279 4.659 . 0 0 "[ . 1 . 2]" 1
805 1 126 ASN H 1 126 ASN QD 5.120 . 5.120 4.410 3.308 4.811 . 0 0 "[ . 1 . 2]" 1
806 1 18 GLU QB 1 21 ILE MD 3.640 . 3.640 2.969 2.415 3.586 . 0 0 "[ . 1 . 2]" 1
807 1 9 ILE HA 1 90 TYR QD 4.900 . 4.900 3.526 3.205 4.144 . 0 0 "[ . 1 . 2]" 1
808 1 3 GLU QG 1 4 SER H 4.630 . 4.630 2.264 1.931 3.291 . 0 0 "[ . 1 . 2]" 1
809 1 30 GLN QB 1 32 LEU QD 3.800 . 3.800 2.496 2.166 2.738 . 0 0 "[ . 1 . 2]" 1
810 1 71 TRP HA 1 117 THR MG 3.670 . 3.670 2.329 1.892 3.033 . 0 0 "[ . 1 . 2]" 1
811 1 60 GLU HA 1 104 VAL H 5.500 . 5.500 4.053 3.601 4.339 . 0 0 "[ . 1 . 2]" 1
812 1 74 PHE HA 1 115 SER QB 4.200 . 4.200 2.160 1.920 3.631 . 0 0 "[ . 1 . 2]" 1
813 1 99 TYR H 1 99 TYR QD 3.810 . 3.810 2.910 2.433 3.527 . 0 0 "[ . 1 . 2]" 1
814 1 109 GLN HA 1 137 PRO HA 3.450 . 3.450 3.107 2.877 3.466 0.016 12 0 "[ . 1 . 2]" 1
815 1 74 PHE QE 1 85 VAL QG 5.440 . 5.440 2.378 1.799 3.740 0.001 12 0 "[ . 1 . 2]" 1
816 1 110 GLU H 1 134 PHE QE 5.500 . 5.500 5.324 4.726 5.544 0.044 13 0 "[ . 1 . 2]" 1
817 1 110 GLU QB 1 111 LEU H 3.740 . 3.740 3.468 3.261 3.849 0.109 1 0 "[ . 1 . 2]" 1
818 1 32 LEU QB 1 36 ASN QB 5.200 . 5.200 4.561 4.215 4.888 . 0 0 "[ . 1 . 2]" 1
819 1 18 GLU H 1 21 ILE QG 5.500 . 5.500 5.364 4.892 5.531 0.031 3 0 "[ . 1 . 2]" 1
820 1 102 PHE HA 1 102 PHE QD 4.470 . 4.470 3.644 3.597 3.682 . 0 0 "[ . 1 . 2]" 1
821 1 96 ASP QB 1 97 HIS H 5.050 . 5.050 3.936 3.579 4.014 . 0 0 "[ . 1 . 2]" 1
822 1 76 VAL QG 1 85 VAL HB 5.210 . 5.210 3.545 2.510 5.013 . 0 0 "[ . 1 . 2]" 1
823 1 110 GLU H 1 111 LEU H 5.130 . 5.130 4.196 4.010 4.343 . 0 0 "[ . 1 . 2]" 1
824 1 6 LYS HA 1 9 ILE MD 3.680 . 3.680 2.743 2.109 3.460 . 0 0 "[ . 1 . 2]" 1
825 1 75 GLU H 1 114 VAL HB 3.560 . 3.560 2.788 2.251 3.212 . 0 0 "[ . 1 . 2]" 1
826 1 32 LEU QB 1 37 GLU H 5.250 . 5.250 3.810 3.187 4.273 . 0 0 "[ . 1 . 2]" 1
827 1 138 ILE HA 1 139 TYR H 2.780 . 2.780 2.350 2.246 2.430 . 0 0 "[ . 1 . 2]" 1
828 1 63 LEU QB 1 64 ASP H 5.500 . 5.500 2.939 2.618 3.428 . 0 0 "[ . 1 . 2]" 1
829 1 50 ALA HA 1 62 GLU H 4.330 . 4.330 4.153 3.589 4.362 0.032 7 0 "[ . 1 . 2]" 1
830 1 95 GLU HA 1 95 GLU QB 2.770 . 2.770 2.470 2.427 2.509 . 0 0 "[ . 1 . 2]" 1
831 1 37 GLU H 1 38 THR H 5.280 . 5.280 4.295 3.933 4.520 . 0 0 "[ . 1 . 2]" 1
832 1 54 TYR QB 1 55 THR H 3.850 . 3.850 3.553 3.182 3.854 0.004 20 0 "[ . 1 . 2]" 1
833 1 78 GLU H 1 81 GLN H 3.540 . 3.540 3.135 2.877 3.342 . 0 0 "[ . 1 . 2]" 1
834 1 131 LYS HA 1 132 LEU H 3.480 . 3.480 2.302 2.258 2.427 . 0 0 "[ . 1 . 2]" 1
835 1 101 ARG QB 1 102 PHE H 4.340 . 4.340 2.809 2.540 3.176 . 0 0 "[ . 1 . 2]" 1
836 1 104 VAL QG 1 105 SER H 4.360 . 4.360 3.708 3.698 3.732 . 0 0 "[ . 1 . 2]" 1
837 1 96 ASP H 1 97 HIS QB 5.500 . 5.500 4.490 4.429 4.614 . 0 0 "[ . 1 . 2]" 1
838 1 55 THR MG 1 57 LYS H 4.890 . 4.890 4.232 4.044 4.373 . 0 0 "[ . 1 . 2]" 1
839 1 88 VAL QG 1 101 ARG QG 4.070 . 4.070 1.906 1.761 2.321 0.039 18 0 "[ . 1 . 2]" 1
840 1 6 LYS HA 1 6 LYS QE 4.500 . 4.500 4.070 3.361 4.506 0.006 11 0 "[ . 1 . 2]" 1
841 1 142 PRO QG 1 143 SER HA 4.880 . 4.880 4.714 4.622 4.883 0.003 7 0 "[ . 1 . 2]" 1
842 1 5 LEU HA 1 8 ALA MB 3.160 . 3.160 2.580 2.281 3.020 . 0 0 "[ . 1 . 2]" 1
843 1 52 VAL QG 1 59 ALA HA 4.810 . 4.810 3.708 3.285 4.531 . 0 0 "[ . 1 . 2]" 1
844 1 107 GLY H 1 108 THR HA 5.500 . 5.500 5.131 5.083 5.166 . 0 0 "[ . 1 . 2]" 1
845 1 63 LEU HA 1 64 ASP H 3.440 . 3.440 2.338 2.213 2.452 . 0 0 "[ . 1 . 2]" 1
846 1 112 LYS H 1 112 LYS QG 3.920 . 3.920 3.570 3.183 3.814 . 0 0 "[ . 1 . 2]" 1
847 1 88 VAL H 1 100 ILE H 5.250 . 5.250 4.739 4.453 5.012 . 0 0 "[ . 1 . 2]" 1
848 1 5 LEU QD 1 71 TRP H 5.210 . 5.210 4.484 3.956 5.096 . 0 0 "[ . 1 . 2]" 1
849 1 58 LYS QG 1 105 SER HA 4.900 . 4.900 3.770 3.141 4.829 . 0 0 "[ . 1 . 2]" 1
850 1 58 LYS QG 1 59 ALA H 4.360 . 4.360 2.898 1.941 4.306 . 0 0 "[ . 1 . 2]" 1
851 1 9 ILE HA 1 11 ASP H 5.380 . 5.380 4.334 3.671 5.310 . 0 0 "[ . 1 . 2]" 1
852 1 53 TYR HA 1 54 TYR H 3.430 . 3.430 2.353 2.288 2.394 . 0 0 "[ . 1 . 2]" 1
853 1 86 ARG H 1 87 LEU H 5.500 . 5.500 4.500 4.378 4.580 . 0 0 "[ . 1 . 2]" 1
854 1 74 PHE HZ 1 113 ILE MD 4.150 . 4.150 3.870 3.301 4.154 0.004 20 0 "[ . 1 . 2]" 1
855 1 5 LEU HA 1 5 LEU HG 3.460 . 3.460 2.303 1.942 3.508 0.048 11 0 "[ . 1 . 2]" 1
856 1 9 ILE MG 1 87 LEU QD 3.240 . 3.240 2.174 1.833 2.607 . 0 0 "[ . 1 . 2]" 1
857 1 10 LYS H 1 11 ASP QB 5.500 . 5.500 4.230 3.517 4.753 . 0 0 "[ . 1 . 2]" 1
858 1 6 LYS QB 1 6 LYS QE 3.930 . 3.930 2.572 1.904 3.436 . 0 0 "[ . 1 . 2]" 1
859 1 83 LEU QD 1 103 PRO QD 3.880 . 3.880 2.855 2.361 3.188 . 0 0 "[ . 1 . 2]" 1
860 1 135 ALA H 1 135 ALA MB 3.300 . 3.300 2.026 1.941 2.189 . 0 0 "[ . 1 . 2]" 1
861 1 89 SER HA 1 99 TYR QD 4.850 . 4.850 4.428 3.930 4.874 0.024 3 0 "[ . 1 . 2]" 1
862 1 104 VAL QG 1 108 THR HB 3.290 . 3.290 2.850 2.597 3.073 . 0 0 "[ . 1 . 2]" 1
863 1 50 ALA HA 1 64 ASP H 5.440 . 5.440 4.597 4.124 5.403 . 0 0 "[ . 1 . 2]" 1
864 1 70 THR HB 1 119 ILE MD 3.560 . 3.560 3.266 2.731 3.550 . 0 0 "[ . 1 . 2]" 1
865 1 50 ALA H 1 61 VAL QG 5.310 . 5.310 4.827 4.420 5.025 . 0 0 "[ . 1 . 2]" 1
866 1 67 THR H 1 70 THR H 5.500 . 5.500 5.467 5.358 5.551 0.051 13 0 "[ . 1 . 2]" 1
867 1 27 VAL H 1 50 ALA HA 5.500 . 5.500 4.709 4.493 4.891 . 0 0 "[ . 1 . 2]" 1
868 1 58 LYS QE 1 106 ASP H 4.740 . 4.740 3.593 2.721 4.713 . 0 0 "[ . 1 . 2]" 1
869 1 53 TYR H 1 53 TYR QD 4.140 . 4.140 2.806 2.048 3.543 . 0 0 "[ . 1 . 2]" 1
870 1 129 TYR QE 1 131 LYS QB 3.160 . 3.160 2.862 2.053 3.128 . 0 0 "[ . 1 . 2]" 1
871 1 67 THR H 1 68 ALA H 3.680 . 3.680 3.377 3.148 3.691 0.011 18 0 "[ . 1 . 2]" 1
872 1 91 SER HA 1 92 PRO QD 3.130 . 3.130 2.065 2.045 2.083 . 0 0 "[ . 1 . 2]" 1
873 1 78 GLU H 1 112 LYS H 4.700 . 4.700 4.672 4.531 4.749 0.049 2 0 "[ . 1 . 2]" 1
874 1 32 LEU H 1 130 THR MG 4.210 . 4.210 3.579 3.279 4.008 . 0 0 "[ . 1 . 2]" 1
875 1 98 ALA HA 1 99 TYR QD 4.120 . 4.120 3.766 3.184 4.147 0.027 7 0 "[ . 1 . 2]" 1
876 1 59 ALA H 1 103 PRO HA 5.500 . 5.500 5.189 4.862 5.494 . 0 0 "[ . 1 . 2]" 1
877 1 132 LEU QD 1 134 PHE QD 3.830 . 3.830 3.271 3.102 3.464 . 0 0 "[ . 1 . 2]" 1
878 1 14 LEU QD 1 87 LEU QB 3.290 . 3.290 2.220 1.852 2.727 . 0 0 "[ . 1 . 2]" 1
879 1 32 LEU QB 1 36 ASN H 4.610 . 4.610 3.593 2.861 3.963 . 0 0 "[ . 1 . 2]" 1
880 1 105 SER HA 1 108 THR H 4.940 . 4.940 4.317 4.140 4.426 . 0 0 "[ . 1 . 2]" 1
881 1 66 ASN HA 1 97 HIS HA 3.260 . 3.260 2.546 2.043 2.968 . 0 0 "[ . 1 . 2]" 1
882 1 32 LEU H 1 130 THR HA 5.500 . 5.500 4.967 4.657 5.203 . 0 0 "[ . 1 . 2]" 1
883 1 90 TYR HA 1 98 ALA MB 3.990 . 3.990 3.838 3.700 4.012 0.022 4 0 "[ . 1 . 2]" 1
884 1 15 GLU H 1 90 TYR H 4.720 . 4.720 4.519 4.138 4.728 0.008 11 0 "[ . 1 . 2]" 1
885 1 109 GLN HA 1 134 PHE QD 3.690 . 3.690 2.213 1.948 2.701 . 0 0 "[ . 1 . 2]" 1
886 1 88 VAL QG 1 101 ARG QB 4.260 . 4.260 2.937 2.163 3.354 . 0 0 "[ . 1 . 2]" 1
887 1 46 ILE MD 1 65 ILE MD 4.350 . 4.350 3.919 2.623 4.356 0.006 13 0 "[ . 1 . 2]" 1
888 1 82 LYS HA 1 82 LYS QD 4.320 . 4.320 2.900 2.247 3.891 . 0 0 "[ . 1 . 2]" 1
889 1 59 ALA MB 1 138 ILE MG 3.260 . 3.260 2.139 1.842 2.407 . 0 0 "[ . 1 . 2]" 1
890 1 61 VAL H 1 61 VAL HB 3.530 . 3.530 2.335 2.215 2.472 . 0 0 "[ . 1 . 2]" 1
891 1 21 ILE QG 1 22 GLY H 5.500 . 5.500 4.456 4.083 4.942 . 0 0 "[ . 1 . 2]" 1
892 1 90 TYR QE 1 92 PRO HA 3.170 . 3.170 2.340 2.292 2.458 . 0 0 "[ . 1 . 2]" 1
893 1 27 VAL HB 1 138 ILE MD 3.500 . 3.500 3.453 3.192 3.520 0.020 19 0 "[ . 1 . 2]" 1
894 1 122 GLY QA 1 123 GLU H 3.310 . 3.310 2.422 2.159 2.619 . 0 0 "[ . 1 . 2]" 1
895 1 9 ILE MG 1 10 LYS H 4.970 . 4.970 4.036 3.950 4.311 . 0 0 "[ . 1 . 2]" 1
896 1 60 GLU HA 1 60 GLU QG 3.410 . 3.410 2.196 1.961 2.605 . 0 0 "[ . 1 . 2]" 1
897 1 29 PHE QD 1 132 LEU HG 5.110 . 5.110 4.057 3.661 4.352 . 0 0 "[ . 1 . 2]" 1
898 1 95 GLU H 1 96 ASP H 3.890 . 3.890 2.271 2.237 2.320 . 0 0 "[ . 1 . 2]" 1
899 1 9 ILE MD 1 9 ILE MG 3.510 . 3.510 2.447 2.054 2.956 . 0 0 "[ . 1 . 2]" 1
900 1 133 VAL HB 1 134 PHE H 4.890 . 4.890 4.391 3.437 4.588 . 0 0 "[ . 1 . 2]" 1
901 1 86 ARG H 1 101 ARG HA 5.500 . 5.500 5.119 4.496 5.520 0.020 12 0 "[ . 1 . 2]" 1
902 1 85 VAL QG 1 100 ILE MD 3.140 . 3.140 1.876 1.742 2.157 0.058 1 0 "[ . 1 . 2]" 1
903 1 63 LEU QB 1 100 ILE H 5.500 . 5.500 3.912 3.558 5.042 . 0 0 "[ . 1 . 2]" 1
904 1 143 SER HA 1 143 SER QB 2.620 . 2.620 2.358 2.180 2.549 . 0 0 "[ . 1 . 2]" 1
905 1 100 ILE HB 1 101 ARG H 3.820 . 3.820 2.598 2.358 2.975 . 0 0 "[ . 1 . 2]" 1
906 1 27 VAL QG 1 134 PHE HA 4.120 . 4.120 3.472 3.260 3.666 . 0 0 "[ . 1 . 2]" 1
907 1 83 LEU QD 1 102 PHE QB 3.850 . 3.850 2.898 2.572 3.257 . 0 0 "[ . 1 . 2]" 1
908 1 31 LEU HA 1 31 LEU QD 3.160 . 3.160 2.063 1.880 2.377 . 0 0 "[ . 1 . 2]" 1
909 1 77 TYR QD 1 112 LYS H 4.870 . 4.870 3.847 3.573 4.158 . 0 0 "[ . 1 . 2]" 1
910 1 131 LYS H 1 132 LEU H 5.500 . 5.500 4.228 3.961 4.319 . 0 0 "[ . 1 . 2]" 1
911 1 107 GLY QA 1 138 ILE MG 5.060 . 5.060 4.351 4.254 4.545 . 0 0 "[ . 1 . 2]" 1
912 1 125 THR MG 1 126 ASN QB 4.930 . 4.930 4.855 4.580 4.976 0.046 7 0 "[ . 1 . 2]" 1
913 1 9 ILE H 1 9 ILE MG 3.980 . 3.980 2.124 1.990 2.251 . 0 0 "[ . 1 . 2]" 1
914 1 15 GLU HA 1 90 TYR QE 4.890 . 4.890 4.385 3.933 4.864 . 0 0 "[ . 1 . 2]" 1
915 1 133 VAL H 1 133 VAL HB 3.900 . 3.900 2.357 2.059 3.604 . 0 0 "[ . 1 . 2]" 1
916 1 133 VAL HA 1 134 PHE H 3.190 . 3.190 2.219 2.202 2.241 . 0 0 "[ . 1 . 2]" 1
917 1 53 TYR H 1 53 TYR QE 5.500 . 5.500 5.050 4.307 5.442 . 0 0 "[ . 1 . 2]" 1
918 1 85 VAL HB 1 86 ARG H 4.940 . 4.940 4.287 4.066 4.439 . 0 0 "[ . 1 . 2]" 1
919 1 46 ILE MD 1 71 TRP HZ2 5.280 . 5.280 2.473 1.967 2.919 . 0 0 "[ . 1 . 2]" 1
920 1 77 TYR QD 1 81 GLN H 4.390 . 4.390 2.034 1.934 2.358 . 0 0 "[ . 1 . 2]" 1
921 1 129 TYR QD 1 131 LYS QB 5.090 . 5.090 4.283 3.941 4.477 . 0 0 "[ . 1 . 2]" 1
922 1 100 ILE HA 1 101 ARG H 3.390 . 3.390 2.470 2.323 2.574 . 0 0 "[ . 1 . 2]" 1
923 1 3 GLU QG 1 7 ASP QB 4.870 . 4.870 3.154 2.353 3.942 . 0 0 "[ . 1 . 2]" 1
924 1 60 GLU HA 1 103 PRO QB 4.500 . 4.500 4.352 4.149 4.530 0.030 14 0 "[ . 1 . 2]" 1
925 1 134 PHE H 1 136 LYS H 5.450 . 5.450 5.266 5.119 5.426 . 0 0 "[ . 1 . 2]" 1
926 1 68 ALA MB 1 96 ASP H 5.500 . 5.500 5.419 5.042 5.528 0.028 2 0 "[ . 1 . 2]" 1
927 1 28 ASN H 1 135 ALA HA 5.370 . 5.370 5.019 4.756 5.314 . 0 0 "[ . 1 . 2]" 1
928 1 57 LYS HA 1 57 LYS QE 5.500 . 5.500 3.959 2.291 4.779 . 0 0 "[ . 1 . 2]" 1
929 1 90 TYR QD 1 98 ALA MB 3.840 . 3.840 2.067 1.924 2.718 . 0 0 "[ . 1 . 2]" 1
930 1 27 VAL QG 1 135 ALA H 4.120 . 4.120 2.418 2.252 2.590 . 0 0 "[ . 1 . 2]" 1
931 1 125 THR MG 1 127 TYR QE 3.670 . 3.670 2.580 2.089 2.978 . 0 0 "[ . 1 . 2]" 1
932 1 112 LYS HA 1 112 LYS QE 4.980 . 4.980 2.949 2.328 3.753 . 0 0 "[ . 1 . 2]" 1
933 1 52 VAL QG 1 61 VAL HA 4.230 . 4.230 2.786 2.302 3.145 . 0 0 "[ . 1 . 2]" 1
934 1 107 GLY H 1 138 ILE H 5.420 . 5.420 5.154 4.890 5.371 . 0 0 "[ . 1 . 2]" 1
935 1 8 ALA H 1 10 LYS H 5.500 . 5.500 3.957 3.560 4.949 . 0 0 "[ . 1 . 2]" 1
936 1 27 VAL HB 1 134 PHE QE 4.430 . 4.430 4.421 4.085 4.479 0.049 18 0 "[ . 1 . 2]" 1
937 1 65 ILE MG 1 98 ALA MB 4.260 . 4.260 2.500 2.131 2.799 . 0 0 "[ . 1 . 2]" 1
938 1 35 ASN H 1 35 ASN QD 4.580 . 4.580 3.770 3.005 4.326 . 0 0 "[ . 1 . 2]" 1
939 1 137 PRO HA 1 138 ILE QG 4.990 . 4.990 3.381 3.229 3.509 . 0 0 "[ . 1 . 2]" 1
940 1 58 LYS QG 1 105 SER QB 3.850 . 3.850 3.379 2.289 3.813 . 0 0 "[ . 1 . 2]" 1
941 1 113 ILE H 1 130 THR HB 4.550 . 4.550 2.741 2.503 2.913 . 0 0 "[ . 1 . 2]" 1
942 1 20 ASP H 1 21 ILE MD 5.500 . 5.500 3.903 2.265 4.818 . 0 0 "[ . 1 . 2]" 1
943 1 70 THR HA 1 70 THR HB 2.900 . 2.900 2.447 2.373 2.540 . 0 0 "[ . 1 . 2]" 1
944 1 48 ASP H 1 64 ASP H 5.500 . 5.500 4.166 3.500 4.765 . 0 0 "[ . 1 . 2]" 1
945 1 46 ILE HA 1 46 ILE MD 3.950 . 3.950 3.295 1.909 3.738 . 0 0 "[ . 1 . 2]" 1
946 1 85 VAL HA 1 100 ILE MD 4.620 . 4.620 4.372 4.114 4.607 . 0 0 "[ . 1 . 2]" 1
947 1 34 LYS H 1 35 ASN QB 5.500 . 5.500 4.047 3.737 4.705 . 0 0 "[ . 1 . 2]" 1
948 1 90 TYR QD 1 98 ALA HA 3.600 . 3.600 2.296 2.185 2.674 . 0 0 "[ . 1 . 2]" 1
949 1 52 VAL QG 1 138 ILE MG 3.620 . 3.620 1.819 1.740 2.057 0.060 3 0 "[ . 1 . 2]" 1
950 1 87 LEU HA 1 100 ILE HB 4.110 . 4.110 3.886 3.518 4.087 . 0 0 "[ . 1 . 2]" 1
951 1 35 ASN QB 1 37 GLU QB 4.750 . 4.750 2.611 2.129 3.244 . 0 0 "[ . 1 . 2]" 1
952 1 14 LEU H 1 14 LEU QB 3.660 . 3.660 2.348 2.038 2.578 . 0 0 "[ . 1 . 2]" 1
953 1 25 GLU H 1 26 GLN HA 4.850 . 4.850 4.714 4.618 4.842 . 0 0 "[ . 1 . 2]" 1
954 1 59 ALA HA 1 60 GLU QG 5.130 . 5.130 4.230 3.311 5.075 . 0 0 "[ . 1 . 2]" 1
955 1 111 LEU H 1 111 LEU HG 4.240 . 4.240 1.909 1.892 1.923 . 0 0 "[ . 1 . 2]" 1
956 1 101 ARG H 1 102 PHE QB 5.500 . 5.500 4.711 4.475 4.954 . 0 0 "[ . 1 . 2]" 1
957 1 30 GLN QE 1 136 LYS H 5.500 . 5.500 4.903 4.529 5.436 . 0 0 "[ . 1 . 2]" 1
958 1 107 GLY QA 1 138 ILE HA 4.560 . 4.560 4.091 3.948 4.232 . 0 0 "[ . 1 . 2]" 1
959 1 29 PHE QE 1 132 LEU QD 4.770 . 4.770 4.240 3.910 4.429 . 0 0 "[ . 1 . 2]" 1
960 1 62 GLU HA 1 102 PHE H 5.500 . 5.500 4.003 3.713 4.332 . 0 0 "[ . 1 . 2]" 1
961 1 142 PRO QG 1 143 SER H 4.150 . 4.150 2.861 2.569 3.178 . 0 0 "[ . 1 . 2]" 1
962 1 108 THR MG 1 134 PHE QD 4.750 . 4.750 3.318 3.058 3.672 . 0 0 "[ . 1 . 2]" 1
963 1 129 TYR QD 1 130 THR HA 4.280 . 4.280 4.163 3.944 4.303 0.023 9 0 "[ . 1 . 2]" 1
964 1 93 VAL QG 1 94 PRO HA 3.060 . 3.060 2.970 2.847 3.070 0.010 19 0 "[ . 1 . 2]" 1
965 1 76 VAL HA 1 76 VAL QG 3.230 . 3.230 2.121 1.917 2.402 . 0 0 "[ . 1 . 2]" 1
966 1 110 GLU QG 1 111 LEU H 4.670 . 4.670 4.090 2.550 4.616 . 0 0 "[ . 1 . 2]" 1
967 1 69 SER H 1 70 THR HA 5.330 . 5.330 5.229 5.013 5.339 0.009 19 0 "[ . 1 . 2]" 1
968 1 55 THR HA 1 55 THR HB 2.630 . 2.630 2.494 2.349 2.583 . 0 0 "[ . 1 . 2]" 1
969 1 71 TRP HZ3 1 115 SER QB 5.070 . 5.070 2.366 1.915 3.513 . 0 0 "[ . 1 . 2]" 1
970 1 2 ASP HA 1 3 GLU H 3.110 . 3.110 2.400 2.213 2.769 . 0 0 "[ . 1 . 2]" 1
971 1 131 LYS QE 1 133 VAL HA 4.800 . 4.800 4.614 4.370 4.799 . 0 0 "[ . 1 . 2]" 1
972 1 6 LYS QD 1 9 ILE MD 5.500 . 5.500 4.899 2.473 5.500 . 0 0 "[ . 1 . 2]" 1
973 1 88 VAL H 1 100 ILE HA 4.280 . 4.280 2.919 2.550 3.333 . 0 0 "[ . 1 . 2]" 1
974 1 138 ILE HB 1 139 TYR H 4.490 . 4.490 4.406 4.324 4.441 . 0 0 "[ . 1 . 2]" 1
975 1 108 THR H 1 108 THR MG 4.070 . 4.070 3.716 3.706 3.725 . 0 0 "[ . 1 . 2]" 1
976 1 31 LEU HA 1 31 LEU HG 3.950 . 3.950 2.782 2.348 3.547 . 0 0 "[ . 1 . 2]" 1
977 1 141 ASP H 1 144 LEU QD 5.500 . 5.500 4.634 4.129 5.195 . 0 0 "[ . 1 . 2]" 1
978 1 137 PRO HA 1 138 ILE HA 4.440 . 4.440 4.473 4.465 4.484 0.044 7 0 "[ . 1 . 2]" 1
979 1 102 PHE QD 1 104 VAL QG 3.600 . 3.600 2.413 2.175 2.759 . 0 0 "[ . 1 . 2]" 1
980 1 52 VAL H 1 53 TYR H 5.500 . 5.500 4.430 3.875 4.614 . 0 0 "[ . 1 . 2]" 1
981 1 125 THR HB 1 126 ASN H 5.500 . 5.500 4.329 4.151 4.424 . 0 0 "[ . 1 . 2]" 1
982 1 2 ASP HA 1 2 ASP QB 2.740 . 2.740 2.339 2.174 2.506 . 0 0 "[ . 1 . 2]" 1
983 1 8 ALA H 1 8 ALA MB 3.430 . 3.430 2.149 1.947 2.372 . 0 0 "[ . 1 . 2]" 1
984 1 82 LYS HA 1 82 LYS QG 3.540 . 3.540 2.224 1.955 2.601 . 0 0 "[ . 1 . 2]" 1
985 1 81 GLN QB 1 82 LYS H 4.210 . 4.210 3.828 3.393 4.014 . 0 0 "[ . 1 . 2]" 1
986 1 46 ILE HA 1 65 ILE HA 3.430 . 3.430 2.568 2.185 2.922 . 0 0 "[ . 1 . 2]" 1
987 1 90 TYR QE 1 98 ALA HA 4.420 . 4.420 4.484 4.453 4.514 0.094 4 0 "[ . 1 . 2]" 1
988 1 32 LEU H 1 131 LYS H 4.360 . 4.360 3.973 3.611 4.255 . 0 0 "[ . 1 . 2]" 1
989 1 34 LYS QB 1 35 ASN H 4.380 . 4.380 3.726 3.564 4.016 . 0 0 "[ . 1 . 2]" 1
990 1 134 PHE QB 1 136 LYS H 3.350 . 3.350 2.314 2.215 2.399 . 0 0 "[ . 1 . 2]" 1
991 1 134 PHE H 1 135 ALA H 4.800 . 4.800 4.692 4.657 4.704 . 0 0 "[ . 1 . 2]" 1
992 1 110 GLU HA 1 110 GLU QG 3.370 . 3.370 2.675 2.309 3.304 . 0 0 "[ . 1 . 2]" 1
993 1 28 ASN HA 1 49 PRO QB 4.820 . 4.820 2.699 2.284 3.255 . 0 0 "[ . 1 . 2]" 1
994 1 100 ILE MD 1 101 ARG H 4.470 . 4.470 2.912 2.444 3.780 . 0 0 "[ . 1 . 2]" 1
995 1 15 GLU H 1 15 GLU QB 3.180 . 3.180 2.148 1.930 2.266 . 0 0 "[ . 1 . 2]" 1
996 1 32 LEU H 1 32 LEU HG 4.270 . 4.270 3.004 2.740 3.271 . 0 0 "[ . 1 . 2]" 1
997 1 87 LEU QB 1 100 ILE MG 4.030 . 4.030 3.596 3.035 3.964 . 0 0 "[ . 1 . 2]" 1
998 1 71 TRP HA 1 73 LYS H 5.400 . 5.400 4.273 3.766 4.746 . 0 0 "[ . 1 . 2]" 1
999 1 14 LEU QD 1 17 LYS QG 4.800 . 4.800 4.189 3.686 4.592 . 0 0 "[ . 1 . 2]" 1
1000 1 62 GLU HA 1 101 ARG HA 3.510 . 3.510 2.278 1.962 2.630 . 0 0 "[ . 1 . 2]" 1
1001 1 100 ILE H 1 100 ILE QG 4.090 . 4.090 1.926 1.885 1.965 . 0 0 "[ . 1 . 2]" 1
1002 1 104 VAL QG 1 105 SER HA 5.430 . 5.430 4.049 3.995 4.236 . 0 0 "[ . 1 . 2]" 1
1003 1 47 LYS HA 1 47 LYS QD 4.260 . 4.260 3.662 3.018 4.034 . 0 0 "[ . 1 . 2]" 1
1004 1 14 LEU HA 1 14 LEU HG 3.470 . 3.470 3.022 2.117 3.562 0.092 15 0 "[ . 1 . 2]" 1
1005 1 141 ASP HA 1 143 SER H 3.590 . 3.590 3.234 3.126 3.353 . 0 0 "[ . 1 . 2]" 1
1006 1 83 LEU HA 1 84 PRO QD 3.640 . 3.640 1.978 1.964 1.993 . 0 0 "[ . 1 . 2]" 1
1007 1 27 VAL QG 1 134 PHE QE 4.360 . 4.360 3.403 2.620 3.952 . 0 0 "[ . 1 . 2]" 1
1008 1 32 LEU QD 1 37 GLU QG 4.980 . 4.980 4.789 3.677 5.009 0.029 16 0 "[ . 1 . 2]" 1
1009 1 17 LYS QB 1 89 SER HA 3.600 . 3.600 3.039 2.454 3.543 . 0 0 "[ . 1 . 2]" 1
1010 1 108 THR H 1 138 ILE HB 4.380 . 4.380 4.050 3.958 4.122 . 0 0 "[ . 1 . 2]" 1
1011 1 10 LYS QE 1 10 LYS QG 3.360 . 3.360 2.159 1.903 2.419 . 0 0 "[ . 1 . 2]" 1
1012 1 74 PHE QD 1 113 ILE MG 4.690 . 4.690 2.823 2.334 3.333 . 0 0 "[ . 1 . 2]" 1
1013 1 19 HIS H 1 20 ASP H 3.830 . 3.830 3.163 2.663 3.652 . 0 0 "[ . 1 . 2]" 1
1014 1 83 LEU H 1 102 PHE QB 5.500 . 5.500 5.467 5.254 5.556 0.056 6 0 "[ . 1 . 2]" 1
1015 1 107 GLY H 1 138 ILE MG 5.500 . 5.500 5.487 5.254 5.565 0.065 11 0 "[ . 1 . 2]" 1
1016 1 8 ALA MB 1 9 ILE HA 4.870 . 4.870 3.862 3.803 3.932 . 0 0 "[ . 1 . 2]" 1
1017 1 46 ILE HA 1 65 ILE MD 4.770 . 4.770 4.387 3.994 4.745 . 0 0 "[ . 1 . 2]" 1
1018 1 21 ILE MG 1 22 GLY H 3.930 . 3.930 3.024 2.072 3.853 . 0 0 "[ . 1 . 2]" 1
1019 1 8 ALA MB 1 9 ILE MG 3.650 . 3.650 3.151 2.766 3.489 . 0 0 "[ . 1 . 2]" 1
1020 1 111 LEU H 1 112 LYS H 4.600 . 4.600 4.432 4.329 4.474 . 0 0 "[ . 1 . 2]" 1
1021 1 106 ASP H 1 108 THR H 5.500 . 5.500 4.349 4.283 4.427 . 0 0 "[ . 1 . 2]" 1
1022 1 9 ILE MG 1 68 ALA MB 3.490 . 3.490 2.428 2.028 2.894 . 0 0 "[ . 1 . 2]" 1
1023 1 54 TYR QE 1 60 GLU H 5.500 . 5.500 4.610 4.099 5.111 . 0 0 "[ . 1 . 2]" 1
1024 1 55 THR H 1 55 THR HB 3.750 . 3.750 3.643 3.540 3.770 0.020 13 0 "[ . 1 . 2]" 1
1025 1 81 GLN QB 1 82 LYS HA 5.210 . 5.210 4.772 4.525 5.060 . 0 0 "[ . 1 . 2]" 1
1026 1 30 GLN QE 1 134 PHE QB 5.500 . 5.500 4.887 4.548 5.299 . 0 0 "[ . 1 . 2]" 1
1027 1 76 VAL QG 1 83 LEU QB 4.190 . 4.190 2.703 1.909 3.602 . 0 0 "[ . 1 . 2]" 1
1028 1 28 ASN HA 1 29 PHE QE 4.960 . 4.960 4.009 3.741 4.265 . 0 0 "[ . 1 . 2]" 1
1029 1 90 TYR QE 1 96 ASP H 5.500 . 5.500 4.918 4.839 4.972 . 0 0 "[ . 1 . 2]" 1
1030 1 88 VAL HB 1 101 ARG QG 4.540 . 4.540 4.147 2.390 4.555 0.015 15 0 "[ . 1 . 2]" 1
1031 1 111 LEU QB 1 111 LEU QD 2.850 . 2.850 1.843 1.799 1.874 0.001 20 0 "[ . 1 . 2]" 1
1032 1 28 ASN HA 1 29 PHE H 3.150 . 3.150 2.452 2.274 2.645 . 0 0 "[ . 1 . 2]" 1
1033 1 92 PRO HA 1 96 ASP H 5.000 . 5.000 4.533 4.443 4.592 . 0 0 "[ . 1 . 2]" 1
1034 1 88 VAL H 1 101 ARG H 5.180 . 5.180 4.697 3.801 5.201 0.021 5 0 "[ . 1 . 2]" 1
1035 1 11 ASP QB 1 12 PRO QD 4.550 . 4.550 2.883 2.200 3.420 . 0 0 "[ . 1 . 2]" 1
1036 1 29 PHE QD 1 31 LEU HG 4.070 . 4.070 2.595 2.131 4.043 . 0 0 "[ . 1 . 2]" 1
1037 1 116 SER HA 1 127 TYR QD 3.960 . 3.960 3.043 2.562 3.541 . 0 0 "[ . 1 . 2]" 1
1038 1 27 VAL HA 1 28 ASN QB 4.830 . 4.830 3.985 3.934 4.038 . 0 0 "[ . 1 . 2]" 1
1039 1 117 THR H 1 125 THR H 5.010 . 5.010 4.283 3.867 4.604 . 0 0 "[ . 1 . 2]" 1
1040 1 92 PRO QD 1 93 VAL H 5.500 . 5.500 4.957 4.946 4.965 . 0 0 "[ . 1 . 2]" 1
1041 1 92 PRO HA 1 93 VAL QG 4.980 . 4.980 4.004 3.886 4.134 . 0 0 "[ . 1 . 2]" 1
1042 1 110 GLU HA 1 132 LEU QD 4.330 . 4.330 3.967 3.380 4.273 . 0 0 "[ . 1 . 2]" 1
1043 1 25 GLU QG 1 52 VAL HB 4.010 . 4.010 3.817 3.371 4.018 0.008 18 0 "[ . 1 . 2]" 1
1044 1 19 HIS QB 1 88 VAL HB 4.350 . 4.350 3.109 1.922 4.355 0.005 16 0 "[ . 1 . 2]" 1
1045 1 77 TYR QB 1 82 LYS H 4.510 . 4.510 3.778 3.139 4.511 0.001 6 0 "[ . 1 . 2]" 1
1046 1 74 PHE HA 1 74 PHE QD 4.090 . 4.090 1.932 1.877 2.018 . 0 0 "[ . 1 . 2]" 1
1047 1 138 ILE HB 1 138 ILE MD 3.200 . 3.200 3.187 3.178 3.199 . 0 0 "[ . 1 . 2]" 1
1048 1 58 LYS QD 1 105 SER HA 3.520 . 3.520 3.123 2.288 3.542 0.022 13 0 "[ . 1 . 2]" 1
1049 1 97 HIS HA 1 97 HIS HD2 4.350 . 4.350 4.267 3.915 4.353 0.003 7 0 "[ . 1 . 2]" 1
1050 1 139 TYR QB 1 140 ASN H 4.670 . 4.670 3.395 3.097 3.548 . 0 0 "[ . 1 . 2]" 1
1051 1 106 ASP QB 1 108 THR H 5.260 . 5.260 3.386 3.296 3.505 . 0 0 "[ . 1 . 2]" 1
1052 1 72 LYS H 1 117 THR H 5.500 . 5.500 5.121 4.811 5.451 . 0 0 "[ . 1 . 2]" 1
1053 1 67 THR H 1 71 TRP HE1 5.500 . 5.500 3.592 3.025 4.349 . 0 0 "[ . 1 . 2]" 1
1054 1 74 PHE QD 1 75 GLU HA 4.200 . 4.200 4.103 3.840 4.241 0.041 18 0 "[ . 1 . 2]" 1
1055 1 107 GLY H 1 108 THR H 3.390 . 3.390 2.619 2.577 2.657 . 0 0 "[ . 1 . 2]" 1
1056 1 114 VAL QG 1 128 ASP HA 3.360 . 3.360 3.203 2.863 3.384 0.024 4 0 "[ . 1 . 2]" 1
1057 1 60 GLU H 1 60 GLU QB 3.610 . 3.610 2.466 2.302 2.618 . 0 0 "[ . 1 . 2]" 1
1058 1 95 GLU QB 1 96 ASP H 3.600 . 3.600 2.672 2.533 2.738 . 0 0 "[ . 1 . 2]" 1
1059 1 130 THR HA 1 131 LYS QB 4.950 . 4.950 4.097 4.063 4.139 . 0 0 "[ . 1 . 2]" 1
1060 1 110 GLU HA 1 133 VAL HA 2.950 . 2.950 2.045 1.936 2.239 . 0 0 "[ . 1 . 2]" 1
1061 1 133 VAL QG 1 134 PHE H 4.200 . 4.200 3.039 2.815 3.609 . 0 0 "[ . 1 . 2]" 1
1062 1 64 ASP HA 1 98 ALA H 5.500 . 5.500 5.017 4.361 5.522 0.022 12 0 "[ . 1 . 2]" 1
1063 1 16 ASN QD 1 92 PRO QD 4.790 . 4.790 2.884 1.930 4.159 . 0 0 "[ . 1 . 2]" 1
1064 1 29 PHE QB 1 30 GLN H 3.870 . 3.870 3.117 2.999 3.195 . 0 0 "[ . 1 . 2]" 1
1065 1 68 ALA MB 1 96 ASP HA 5.120 . 5.120 3.485 3.095 3.684 . 0 0 "[ . 1 . 2]" 1
1066 1 55 THR H 1 60 GLU H 5.360 . 5.360 4.396 3.799 5.039 . 0 0 "[ . 1 . 2]" 1
1067 1 61 VAL H 1 102 PHE QD 5.000 . 5.000 4.250 4.023 4.606 . 0 0 "[ . 1 . 2]" 1
1068 1 113 ILE MG 1 114 VAL H 5.070 . 5.070 2.456 2.078 2.888 . 0 0 "[ . 1 . 2]" 1
1069 1 117 THR MG 1 125 THR MG 5.090 . 5.090 3.768 2.571 4.371 . 0 0 "[ . 1 . 2]" 1
1070 1 15 GLU QG 1 92 PRO QD 4.330 . 4.330 2.979 2.116 4.223 . 0 0 "[ . 1 . 2]" 1
1071 1 106 ASP HA 1 107 GLY H 3.070 . 3.070 3.089 3.047 3.126 0.056 18 0 "[ . 1 . 2]" 1
1072 1 110 GLU HA 1 111 LEU H 2.930 . 2.930 2.216 2.193 2.233 . 0 0 "[ . 1 . 2]" 1
1073 1 109 GLN QG 1 134 PHE QD 4.630 . 4.630 3.711 3.433 4.083 . 0 0 "[ . 1 . 2]" 1
1074 1 87 LEU QD 1 100 ILE HA 4.860 . 4.860 3.811 3.335 4.226 . 0 0 "[ . 1 . 2]" 1
1075 1 104 VAL H 1 105 SER H 5.500 . 5.500 3.759 3.608 3.927 . 0 0 "[ . 1 . 2]" 1
1076 1 22 GLY QA 1 23 PRO QD 3.720 . 3.720 1.973 1.903 2.035 . 0 0 "[ . 1 . 2]" 1
1077 1 19 HIS QB 1 99 TYR QB 4.720 . 4.720 4.070 3.126 4.738 0.018 8 0 "[ . 1 . 2]" 1
1078 1 86 ARG H 1 102 PHE HA 5.500 . 5.500 4.031 3.620 4.312 . 0 0 "[ . 1 . 2]" 1
1079 1 18 GLU H 1 18 GLU QB 3.470 . 3.470 2.345 1.984 3.129 . 0 0 "[ . 1 . 2]" 1
1080 1 31 LEU H 1 32 LEU H 5.070 . 5.070 4.475 4.443 4.503 . 0 0 "[ . 1 . 2]" 1
1081 1 133 VAL HA 1 133 VAL QG 3.060 . 3.060 2.051 1.947 2.328 . 0 0 "[ . 1 . 2]" 1
1082 1 93 VAL QG 1 96 ASP QB 4.100 . 4.100 4.133 4.024 4.179 0.079 17 0 "[ . 1 . 2]" 1
1083 1 4 SER QB 1 7 ASP QB 3.260 . 3.260 2.280 1.874 2.995 . 0 0 "[ . 1 . 2]" 1
1084 1 74 PHE QE 1 100 ILE MD 4.020 . 4.020 1.993 1.799 2.602 0.001 9 0 "[ . 1 . 2]" 1
1085 1 60 GLU HA 1 103 PRO HA 3.090 . 3.090 2.656 2.486 2.801 . 0 0 "[ . 1 . 2]" 1
1086 1 117 THR HB 1 118 GLN H 4.480 . 4.480 2.892 2.418 3.264 . 0 0 "[ . 1 . 2]" 1
1087 1 19 HIS HA 1 19 HIS HD2 4.500 . 4.500 4.403 4.155 4.486 . 0 0 "[ . 1 . 2]" 1
1088 1 46 ILE MG 1 65 ILE MD 4.540 . 4.540 4.341 3.857 4.539 . 0 0 "[ . 1 . 2]" 1
1089 1 108 THR H 1 139 TYR QD 5.500 . 5.500 5.430 5.310 5.510 0.010 5 0 "[ . 1 . 2]" 1
1090 1 127 TYR HA 1 127 TYR QD 3.780 . 3.780 2.537 1.973 3.010 . 0 0 "[ . 1 . 2]" 1
1091 1 20 ASP HA 1 53 TYR QE 4.370 . 4.370 2.822 2.103 4.348 . 0 0 "[ . 1 . 2]" 1
1092 1 27 VAL HA 1 135 ALA MB 4.380 . 4.380 3.586 3.329 3.973 . 0 0 "[ . 1 . 2]" 1
1093 1 5 LEU QD 1 6 LYS H 5.500 . 5.500 4.104 3.811 4.279 . 0 0 "[ . 1 . 2]" 1
1094 1 77 TYR H 1 77 TYR QD 3.800 . 3.800 3.384 2.618 3.800 0.000 18 0 "[ . 1 . 2]" 1
1095 1 32 LEU QD 1 38 THR H 4.590 . 4.590 3.142 2.811 3.588 . 0 0 "[ . 1 . 2]" 1
1096 1 5 LEU QD 1 74 PHE QD 4.010 . 4.010 2.359 2.003 3.016 . 0 0 "[ . 1 . 2]" 1
1097 1 58 LYS QB 1 59 ALA H 4.170 . 4.170 3.083 2.565 3.494 . 0 0 "[ . 1 . 2]" 1
1098 1 105 SER H 1 108 THR H 5.360 . 5.360 4.233 4.038 4.443 . 0 0 "[ . 1 . 2]" 1
1099 1 37 GLU H 1 37 GLU QB 3.300 . 3.300 2.303 2.124 2.817 . 0 0 "[ . 1 . 2]" 1
1100 1 75 GLU H 1 114 VAL H 4.550 . 4.550 2.578 2.278 2.949 . 0 0 "[ . 1 . 2]" 1
1101 1 52 VAL HB 1 54 TYR QE 3.780 . 3.780 3.609 3.046 3.785 0.005 12 0 "[ . 1 . 2]" 1
1102 1 113 ILE QG 1 114 VAL H 5.500 . 5.500 3.714 3.467 3.977 . 0 0 "[ . 1 . 2]" 1
1103 1 68 ALA H 1 70 THR MG 5.150 . 5.150 4.923 4.622 5.163 0.013 18 0 "[ . 1 . 2]" 1
1104 1 13 ALA H 1 13 ALA MB 3.000 . 3.000 2.054 1.914 2.170 . 0 0 "[ . 1 . 2]" 1
1105 1 17 LYS HA 1 17 LYS QG 3.070 . 3.070 2.241 1.996 2.772 . 0 0 "[ . 1 . 2]" 1
1106 1 64 ASP H 1 99 TYR QD 5.180 . 5.180 4.780 4.251 5.060 . 0 0 "[ . 1 . 2]" 1
1107 1 95 GLU HA 1 95 GLU QG 3.250 . 3.250 2.250 2.026 2.534 . 0 0 "[ . 1 . 2]" 1
1108 1 10 LYS H 1 10 LYS QB 3.710 . 3.710 2.158 1.992 2.559 . 0 0 "[ . 1 . 2]" 1
1109 1 27 VAL QG 1 52 VAL QG 3.420 . 3.420 1.816 1.745 2.042 0.055 1 0 "[ . 1 . 2]" 1
1110 1 5 LEU HG 1 71 TRP QB 4.540 . 4.540 4.115 2.150 4.520 . 0 0 "[ . 1 . 2]" 1
1111 1 4 SER QB 1 8 ALA H 5.230 . 5.230 4.113 3.647 4.818 . 0 0 "[ . 1 . 2]" 1
1112 1 110 GLU QG 1 134 PHE H 5.040 . 5.040 4.034 3.067 4.890 . 0 0 "[ . 1 . 2]" 1
1113 1 89 SER QB 1 90 TYR H 4.060 . 4.060 3.315 2.570 3.583 . 0 0 "[ . 1 . 2]" 1
1114 1 119 ILE HB 1 122 GLY H 5.490 . 5.490 5.069 3.639 5.481 . 0 0 "[ . 1 . 2]" 1
1115 1 5 LEU QD 1 71 TRP QB 3.100 . 3.100 2.203 1.899 2.684 . 0 0 "[ . 1 . 2]" 1
1116 1 25 GLU HA 1 26 GLN H 3.050 . 3.050 2.635 2.434 2.744 . 0 0 "[ . 1 . 2]" 1
1117 1 104 VAL HB 1 105 SER H 3.940 . 3.940 4.027 3.966 4.082 0.142 15 0 "[ . 1 . 2]" 1
1118 1 64 ASP HA 1 99 TYR QD 3.650 . 3.650 2.660 1.947 3.124 . 0 0 "[ . 1 . 2]" 1
1119 1 110 GLU HA 1 134 PHE H 4.030 . 4.030 2.862 2.185 3.307 . 0 0 "[ . 1 . 2]" 1
1120 1 77 TYR HA 1 83 LEU H 4.260 . 4.260 2.666 2.388 3.293 . 0 0 "[ . 1 . 2]" 1
1121 1 18 GLU H 1 19 HIS H 5.500 . 5.500 3.796 2.530 4.196 . 0 0 "[ . 1 . 2]" 1
1122 1 65 ILE HB 1 100 ILE H 5.360 . 5.360 5.253 4.946 5.381 0.021 5 0 "[ . 1 . 2]" 1
1123 1 84 PRO HA 1 85 VAL QG 4.210 . 4.210 3.861 3.506 4.218 0.008 15 0 "[ . 1 . 2]" 1
1124 1 83 LEU QB 1 103 PRO QG 4.930 . 4.930 3.233 2.805 3.548 . 0 0 "[ . 1 . 2]" 1
1125 1 83 LEU H 1 83 LEU HG 3.990 . 3.990 2.231 1.951 2.739 . 0 0 "[ . 1 . 2]" 1
1126 1 29 PHE H 1 30 GLN QE 4.430 . 4.430 3.862 3.058 4.435 0.005 11 0 "[ . 1 . 2]" 1
1127 1 64 ASP HA 1 65 ILE H 3.200 . 3.200 2.285 2.210 2.426 . 0 0 "[ . 1 . 2]" 1
1128 1 29 PHE HZ 1 46 ILE MG 3.720 . 3.720 2.213 1.898 2.478 . 0 0 "[ . 1 . 2]" 1
1129 1 31 LEU QD 1 132 LEU QD 2.930 . 2.930 2.058 1.792 2.623 0.008 10 0 "[ . 1 . 2]" 1
1130 1 29 PHE HA 1 134 PHE QD 4.380 . 4.380 3.150 2.912 3.445 . 0 0 "[ . 1 . 2]" 1
1131 1 45 SER QB 1 65 ILE HA 4.240 . 4.240 3.550 2.760 3.850 . 0 0 "[ . 1 . 2]" 1
1132 1 54 TYR QD 1 60 GLU H 5.500 . 5.500 3.842 3.251 4.318 . 0 0 "[ . 1 . 2]" 1
1133 1 87 LEU H 1 100 ILE HA 5.500 . 5.500 4.750 4.340 5.024 . 0 0 "[ . 1 . 2]" 1
1134 1 7 ASP QB 1 8 ALA H 3.640 . 3.640 3.105 2.908 3.552 . 0 0 "[ . 1 . 2]" 1
1135 1 77 TYR H 1 83 LEU H 5.380 . 5.380 4.702 4.364 4.985 . 0 0 "[ . 1 . 2]" 1
1136 1 111 LEU HG 1 132 LEU H 4.550 . 4.550 4.159 3.705 4.396 . 0 0 "[ . 1 . 2]" 1
1137 1 86 ARG QB 1 88 VAL QG 4.940 . 4.940 4.210 3.777 4.937 . 0 0 "[ . 1 . 2]" 1
1138 1 88 VAL HA 1 88 VAL HB 2.850 . 2.850 2.503 2.328 3.007 0.157 13 0 "[ . 1 . 2]" 1
1139 1 75 GLU HA 1 76 VAL H 3.280 . 3.280 2.330 2.209 2.423 . 0 0 "[ . 1 . 2]" 1
1140 1 114 VAL HA 1 114 VAL QG 3.260 . 3.260 2.052 1.972 2.140 . 0 0 "[ . 1 . 2]" 1
1141 1 11 ASP H 1 11 ASP QB 3.780 . 3.780 2.563 2.171 2.847 . 0 0 "[ . 1 . 2]" 1
1142 1 111 LEU HA 1 112 LYS H 3.180 . 3.180 2.330 2.235 2.443 . 0 0 "[ . 1 . 2]" 1
1143 1 99 TYR HA 1 100 ILE MG 4.260 . 4.260 3.550 3.287 3.933 . 0 0 "[ . 1 . 2]" 1
1144 1 60 GLU HA 1 104 VAL QG 4.480 . 4.480 3.211 2.657 3.429 . 0 0 "[ . 1 . 2]" 1
1145 1 131 LYS QG 1 132 LEU H 4.040 . 4.040 3.486 3.306 3.771 . 0 0 "[ . 1 . 2]" 1
1146 1 142 PRO QB 1 144 LEU H 5.240 . 5.240 5.141 5.009 5.243 0.003 2 0 "[ . 1 . 2]" 1
1147 1 82 LYS H 1 82 LYS QG 4.810 . 4.810 3.665 2.733 4.059 . 0 0 "[ . 1 . 2]" 1
1148 1 29 PHE QD 1 31 LEU H 5.120 . 5.120 3.680 3.565 3.826 . 0 0 "[ . 1 . 2]" 1
1149 1 77 TYR QD 1 80 ASN HA 4.060 . 4.060 3.352 2.649 3.861 . 0 0 "[ . 1 . 2]" 1
1150 1 70 THR H 1 71 TRP HD1 5.500 . 5.500 3.459 3.091 3.916 . 0 0 "[ . 1 . 2]" 1
1151 1 65 ILE MD 1 71 TRP HE1 4.950 . 4.950 4.819 4.632 4.961 0.011 2 0 "[ . 1 . 2]" 1
1152 1 93 VAL H 1 93 VAL QG 3.640 . 3.640 2.267 2.078 2.465 . 0 0 "[ . 1 . 2]" 1
1153 1 54 TYR H 1 55 THR H 5.500 . 5.500 4.439 4.096 4.637 . 0 0 "[ . 1 . 2]" 1
1154 1 72 LYS H 1 73 LYS H 4.980 . 4.980 2.189 1.966 2.725 . 0 0 "[ . 1 . 2]" 1
1155 1 29 PHE QE 1 31 LEU HG 4.290 . 4.290 3.749 3.257 4.286 . 0 0 "[ . 1 . 2]" 1
1156 1 35 ASN QD 1 36 ASN H 5.500 . 5.500 5.178 4.645 5.498 . 0 0 "[ . 1 . 2]" 1
1157 1 90 TYR QD 1 91 SER H 4.390 . 4.390 3.574 3.508 3.601 . 0 0 "[ . 1 . 2]" 1
1158 1 76 VAL H 1 82 LYS QG 5.500 . 5.500 4.392 2.914 5.490 . 0 0 "[ . 1 . 2]" 1
1159 1 109 GLN H 1 111 LEU QD 5.500 . 5.500 3.844 3.638 4.115 . 0 0 "[ . 1 . 2]" 1
1160 1 77 TYR QD 1 80 ASN H 5.500 . 5.500 3.764 3.332 4.389 . 0 0 "[ . 1 . 2]" 1
1161 1 29 PHE QE 1 31 LEU QD 3.280 . 3.280 2.583 2.200 2.848 . 0 0 "[ . 1 . 2]" 1
1162 1 28 ASN HA 1 29 PHE QD 4.200 . 4.200 3.355 3.189 3.540 . 0 0 "[ . 1 . 2]" 1
1163 1 118 GLN HA 1 118 GLN QG 3.420 . 3.420 2.478 2.082 3.305 . 0 0 "[ . 1 . 2]" 1
1164 1 70 THR HA 1 119 ILE QG 4.830 . 4.830 3.975 3.205 4.637 . 0 0 "[ . 1 . 2]" 1
1165 1 55 THR H 1 55 THR MG 4.080 . 4.080 2.560 2.023 3.119 . 0 0 "[ . 1 . 2]" 1
1166 1 4 SER QB 1 72 LYS HA 3.690 . 3.690 3.467 3.008 3.679 . 0 0 "[ . 1 . 2]" 1
1167 1 104 VAL QG 1 138 ILE MD 4.240 . 4.240 3.629 3.513 3.759 . 0 0 "[ . 1 . 2]" 1
1168 1 52 VAL HA 1 61 VAL HA 3.180 . 3.180 2.068 1.931 2.300 . 0 0 "[ . 1 . 2]" 1
1169 1 85 VAL H 1 86 ARG H 4.620 . 4.620 4.623 4.373 4.669 0.049 15 0 "[ . 1 . 2]" 1
1170 1 108 THR MG 1 111 LEU HA 5.040 . 5.040 4.121 3.969 4.291 . 0 0 "[ . 1 . 2]" 1
1171 1 62 GLU HA 1 100 ILE H 5.500 . 5.500 4.535 4.351 4.827 . 0 0 "[ . 1 . 2]" 1
1172 1 27 VAL H 1 27 VAL QG 4.250 . 4.250 2.893 2.616 3.159 . 0 0 "[ . 1 . 2]" 1
1173 1 5 LEU HA 1 5 LEU QD 2.780 . 2.780 2.297 1.795 2.805 0.025 13 0 "[ . 1 . 2]" 1
1174 1 109 GLN QB 1 110 GLU H 3.570 . 3.570 3.263 3.059 3.597 0.027 19 0 "[ . 1 . 2]" 1
1175 1 76 VAL HA 1 113 ILE QG 4.640 . 4.640 3.257 2.889 3.703 . 0 0 "[ . 1 . 2]" 1
1176 1 47 LYS H 1 64 ASP H 5.130 . 5.130 4.079 3.673 4.488 . 0 0 "[ . 1 . 2]" 1
1177 1 17 LYS H 1 18 GLU H 5.150 . 5.150 4.507 4.251 4.689 . 0 0 "[ . 1 . 2]" 1
1178 1 141 ASP HA 1 142 PRO QD 3.090 . 3.090 1.986 1.923 2.088 . 0 0 "[ . 1 . 2]" 1
1179 1 32 LEU H 1 133 VAL H 5.050 . 5.050 4.294 4.010 4.659 . 0 0 "[ . 1 . 2]" 1
1180 1 61 VAL H 1 103 PRO HA 4.370 . 4.370 3.882 3.564 4.240 . 0 0 "[ . 1 . 2]" 1
1181 1 137 PRO HA 1 138 ILE MD 4.580 . 4.580 3.652 3.332 4.029 . 0 0 "[ . 1 . 2]" 1
1182 1 117 THR MG 1 118 GLN H 5.500 . 5.500 4.121 3.874 4.295 . 0 0 "[ . 1 . 2]" 1
1183 1 52 VAL QG 1 54 TYR QE 3.930 . 3.930 2.417 2.247 2.778 . 0 0 "[ . 1 . 2]" 1
1184 1 38 THR MG 1 39 GLN H 5.440 . 5.440 3.031 2.393 4.009 . 0 0 "[ . 1 . 2]" 1
1185 1 133 VAL QG 1 135 ALA HA 5.170 . 5.170 4.077 3.804 4.999 . 0 0 "[ . 1 . 2]" 1
1186 1 88 VAL QG 1 89 SER QB 3.990 . 3.990 2.146 1.913 3.074 . 0 0 "[ . 1 . 2]" 1
1187 1 31 LEU HA 1 113 ILE MD 5.160 . 5.160 5.083 4.801 5.186 0.026 20 0 "[ . 1 . 2]" 1
1188 1 7 ASP QB 1 8 ALA MB 4.770 . 4.770 3.829 3.654 3.939 . 0 0 "[ . 1 . 2]" 1
1189 1 47 LYS QB 1 64 ASP QB 4.080 . 4.080 3.726 3.174 4.019 . 0 0 "[ . 1 . 2]" 1
1190 1 65 ILE QG 1 100 ILE QG 5.090 . 5.090 3.813 3.556 4.084 . 0 0 "[ . 1 . 2]" 1
1191 1 54 TYR HA 1 59 ALA HA 3.440 . 3.440 2.045 1.912 2.284 . 0 0 "[ . 1 . 2]" 1
1192 1 45 SER HA 1 66 ASN QB 4.150 . 4.150 2.845 2.325 3.774 . 0 0 "[ . 1 . 2]" 1
1193 1 47 LYS QE 1 48 ASP H 5.500 . 5.500 4.289 2.936 5.243 . 0 0 "[ . 1 . 2]" 1
1194 1 140 ASN QB 1 142 PRO QD 4.770 . 4.770 3.444 2.483 4.015 . 0 0 "[ . 1 . 2]" 1
1195 1 76 VAL QG 1 83 LEU HG 5.270 . 5.270 3.882 2.494 4.889 . 0 0 "[ . 1 . 2]" 1
1196 1 27 VAL H 1 51 ASP HA 4.600 . 4.600 2.913 2.443 3.402 . 0 0 "[ . 1 . 2]" 1
1197 1 68 ALA MB 1 98 ALA HA 4.550 . 4.550 3.550 3.391 3.753 . 0 0 "[ . 1 . 2]" 1
1198 1 135 ALA H 1 136 LYS H 3.580 . 3.580 2.379 2.312 2.432 . 0 0 "[ . 1 . 2]" 1
1199 1 85 VAL HB 1 102 PHE QB 4.320 . 4.320 3.964 3.008 4.370 0.050 1 0 "[ . 1 . 2]" 1
1200 1 110 GLU HA 1 133 VAL HB 4.910 . 4.910 4.826 4.029 4.954 0.044 15 0 "[ . 1 . 2]" 1
1201 1 140 ASN HA 1 141 ASP H 3.400 . 3.400 2.484 2.250 2.740 . 0 0 "[ . 1 . 2]" 1
1202 1 100 ILE HA 1 100 ILE MD 4.160 . 4.160 3.646 3.516 3.999 . 0 0 "[ . 1 . 2]" 1
1203 1 86 ARG H 1 86 ARG QD 4.990 . 4.990 2.678 1.948 4.145 . 0 0 "[ . 1 . 2]" 1
1204 1 133 VAL H 1 133 VAL QG 3.770 . 3.770 2.531 1.808 2.914 . 0 0 "[ . 1 . 2]" 1
1205 1 25 GLU QB 1 26 GLN QG 4.440 . 4.440 3.981 3.445 4.451 0.011 20 0 "[ . 1 . 2]" 1
1206 1 65 ILE H 1 98 ALA H 5.050 . 5.050 3.171 2.489 3.559 . 0 0 "[ . 1 . 2]" 1
1207 1 93 VAL HA 1 93 VAL QG 3.110 . 3.110 2.012 1.933 2.092 . 0 0 "[ . 1 . 2]" 1
1208 1 54 TYR HA 1 59 ALA MB 4.250 . 4.250 3.207 2.727 3.588 . 0 0 "[ . 1 . 2]" 1
1209 1 27 VAL HA 1 28 ASN H 2.920 . 2.920 2.259 2.212 2.335 . 0 0 "[ . 1 . 2]" 1
1210 1 81 GLN QB 1 81 GLN QG 2.400 . 2.400 2.080 2.044 2.108 . 0 0 "[ . 1 . 2]" 1
1211 1 78 GLU QB 1 111 LEU QD 3.260 . 3.260 3.060 2.797 3.270 0.010 5 0 "[ . 1 . 2]" 1
1212 1 52 VAL QG 1 53 TYR QB 5.500 . 5.500 4.209 3.848 4.818 . 0 0 "[ . 1 . 2]" 1
1213 1 17 LYS QE 1 19 HIS H 5.500 . 5.500 4.107 3.306 5.034 . 0 0 "[ . 1 . 2]" 1
1214 1 5 LEU QB 1 6 LYS H 4.150 . 4.150 2.849 2.593 3.017 . 0 0 "[ . 1 . 2]" 1
1215 1 138 ILE MD 1 138 ILE MG 2.950 . 2.950 1.892 1.798 2.073 0.002 15 0 "[ . 1 . 2]" 1
1216 1 35 ASN H 1 35 ASN QB 3.340 . 3.340 2.626 2.369 3.093 . 0 0 "[ . 1 . 2]" 1
1217 1 34 LYS QG 1 35 ASN H 4.640 . 4.640 4.381 3.225 4.648 0.008 20 0 "[ . 1 . 2]" 1
1218 1 14 LEU QB 1 90 TYR HA 4.990 . 4.990 4.816 4.426 5.011 0.021 18 0 "[ . 1 . 2]" 1
1219 1 143 SER HA 1 144 LEU QB 4.770 . 4.770 4.119 3.597 4.602 . 0 0 "[ . 1 . 2]" 1
1220 1 52 VAL QG 1 61 VAL QG 4.040 . 4.040 2.119 1.832 2.835 . 0 0 "[ . 1 . 2]" 1
1221 1 47 LYS QB 1 48 ASP H 3.160 . 3.160 2.394 2.164 2.656 . 0 0 "[ . 1 . 2]" 1
1222 1 21 ILE HB 1 21 ILE MD 3.150 . 3.150 2.556 2.124 3.190 0.040 10 0 "[ . 1 . 2]" 1
1223 1 101 ARG H 1 102 PHE H 5.030 . 5.030 4.350 4.228 4.429 . 0 0 "[ . 1 . 2]" 1
1224 1 12 PRO QD 1 13 ALA H 4.290 . 4.290 2.447 2.368 2.527 . 0 0 "[ . 1 . 2]" 1
1225 1 32 LEU HG 1 38 THR HA 4.720 . 4.720 4.293 3.854 4.717 . 0 0 "[ . 1 . 2]" 1
1226 1 117 THR MG 1 125 THR HB 4.730 . 4.730 3.467 2.069 3.961 . 0 0 "[ . 1 . 2]" 1
1227 1 68 ALA HA 1 71 TRP HE1 5.290 . 5.290 4.290 4.107 4.540 . 0 0 "[ . 1 . 2]" 1
1228 1 29 PHE H 1 135 ALA MB 5.500 . 5.500 4.149 3.825 4.448 . 0 0 "[ . 1 . 2]" 1
1229 1 46 ILE MG 1 65 ILE QG 4.390 . 4.390 4.210 3.953 4.419 0.029 2 0 "[ . 1 . 2]" 1
1230 1 59 ALA MB 1 139 TYR H 5.090 . 5.090 4.622 4.246 4.959 . 0 0 "[ . 1 . 2]" 1
1231 1 50 ALA MB 1 63 LEU HA 4.780 . 4.780 3.915 3.397 4.655 . 0 0 "[ . 1 . 2]" 1
1232 1 45 SER QB 1 71 TRP HE1 5.130 . 5.130 2.091 1.848 2.668 . 0 0 "[ . 1 . 2]" 1
1233 1 77 TYR HA 1 82 LYS HA 3.420 . 3.420 2.042 1.930 2.350 . 0 0 "[ . 1 . 2]" 1
1234 1 27 VAL QG 1 138 ILE MD 3.110 . 3.110 1.895 1.758 2.054 0.042 16 0 "[ . 1 . 2]" 1
1235 1 29 PHE QE 1 46 ILE MG 4.290 . 4.290 2.880 2.507 3.081 . 0 0 "[ . 1 . 2]" 1
1236 1 107 GLY QA 1 138 ILE H 5.410 . 5.410 2.991 2.787 3.174 . 0 0 "[ . 1 . 2]" 1
1237 1 132 LEU QD 1 134 PHE HA 3.370 . 3.370 3.245 2.900 3.379 0.009 18 0 "[ . 1 . 2]" 1
1238 1 65 ILE MD 1 68 ALA MB 5.500 . 5.500 4.660 4.045 5.216 . 0 0 "[ . 1 . 2]" 1
1239 1 18 GLU H 1 19 HIS HA 5.500 . 5.500 4.894 4.459 5.206 . 0 0 "[ . 1 . 2]" 1
1240 1 105 SER QB 1 106 ASP H 3.730 . 3.730 3.110 2.237 3.547 . 0 0 "[ . 1 . 2]" 1
1241 1 142 PRO QD 1 144 LEU H 4.590 . 4.590 4.044 3.397 4.604 0.014 5 0 "[ . 1 . 2]" 1
1242 1 8 ALA H 1 9 ILE H 4.070 . 4.070 2.263 1.959 2.518 . 0 0 "[ . 1 . 2]" 1
1243 1 78 GLU QB 1 79 ASN QB 4.800 . 4.800 3.502 3.108 3.870 . 0 0 "[ . 1 . 2]" 1
1244 1 74 PHE QD 1 114 VAL HA 5.020 . 5.020 5.061 5.007 5.119 0.099 17 0 "[ . 1 . 2]" 1
1245 1 65 ILE MD 1 74 PHE QD 5.500 . 5.500 4.626 3.982 5.086 . 0 0 "[ . 1 . 2]" 1
1246 1 30 GLN QE 1 134 PHE H 5.500 . 5.500 5.266 4.769 5.503 0.003 15 0 "[ . 1 . 2]" 1
1247 1 132 LEU HA 1 132 LEU HG 3.280 . 3.280 2.412 2.334 2.492 . 0 0 "[ . 1 . 2]" 1
1248 1 140 ASN H 1 140 ASN QD 5.500 . 5.500 4.333 4.014 4.663 . 0 0 "[ . 1 . 2]" 1
1249 1 50 ALA MB 1 61 VAL HA 4.990 . 4.990 4.285 3.981 4.630 . 0 0 "[ . 1 . 2]" 1
1250 1 72 LYS QE 1 73 LYS HA 4.300 . 4.300 3.926 3.281 4.310 0.010 7 0 "[ . 1 . 2]" 1
1251 1 58 LYS QB 1 103 PRO QB 4.090 . 4.090 3.115 2.849 3.476 . 0 0 "[ . 1 . 2]" 1
1252 1 86 ARG HA 1 100 ILE MG 5.240 . 5.240 5.108 4.740 5.267 0.027 3 0 "[ . 1 . 2]" 1
1253 1 17 LYS H 1 17 LYS QB 3.690 . 3.690 2.242 1.980 2.495 . 0 0 "[ . 1 . 2]" 1
1254 1 52 VAL QG 1 138 ILE MD 3.480 . 3.480 2.187 1.894 2.550 . 0 0 "[ . 1 . 2]" 1
1255 1 117 THR HA 1 117 THR MG 3.450 . 3.450 2.550 2.434 2.762 . 0 0 "[ . 1 . 2]" 1
1256 1 46 ILE H 1 67 THR H 5.370 . 5.370 5.237 4.226 5.390 0.020 6 0 "[ . 1 . 2]" 1
1257 1 90 TYR QE 1 96 ASP HA 3.370 . 3.370 3.442 3.413 3.466 0.096 19 0 "[ . 1 . 2]" 1
1258 1 28 ASN HA 1 135 ALA MB 5.170 . 5.170 3.810 3.561 4.039 . 0 0 "[ . 1 . 2]" 1
1259 1 15 GLU QG 1 16 ASN QD 4.890 . 4.890 3.944 2.540 4.799 . 0 0 "[ . 1 . 2]" 1
1260 1 91 SER HA 1 95 GLU QB 4.880 . 4.880 3.514 3.435 3.617 . 0 0 "[ . 1 . 2]" 1
1261 1 70 THR MG 1 119 ILE HA 3.280 . 3.280 3.138 2.754 3.281 0.001 15 0 "[ . 1 . 2]" 1
1262 1 110 GLU HA 1 134 PHE QD 4.980 . 4.980 4.348 3.865 4.688 . 0 0 "[ . 1 . 2]" 1
1263 1 75 GLU H 1 113 ILE MG 4.430 . 4.430 3.843 3.205 4.315 . 0 0 "[ . 1 . 2]" 1
1264 1 14 LEU H 1 15 GLU H 3.480 . 3.480 2.524 1.947 2.997 . 0 0 "[ . 1 . 2]" 1
1265 1 102 PHE QB 1 103 PRO QD 4.090 . 4.090 2.077 1.896 2.381 . 0 0 "[ . 1 . 2]" 1
1266 1 14 LEU QD 1 90 TYR QD 5.090 . 5.090 4.746 4.338 5.064 . 0 0 "[ . 1 . 2]" 1
1267 1 82 LYS QG 1 83 LEU H 4.740 . 4.740 3.495 2.864 4.342 . 0 0 "[ . 1 . 2]" 1
1268 1 134 PHE HA 1 136 LYS H 4.580 . 4.580 4.082 4.035 4.128 . 0 0 "[ . 1 . 2]" 1
1269 1 3 GLU H 1 3 GLU QG 3.910 . 3.910 3.293 1.974 3.967 0.057 18 0 "[ . 1 . 2]" 1
1270 1 86 ARG HA 1 87 LEU H 3.010 . 3.010 2.410 2.221 2.681 . 0 0 "[ . 1 . 2]" 1
1271 1 24 ARG QB 1 53 TYR HA 4.080 . 4.080 3.449 2.445 4.080 0.000 19 0 "[ . 1 . 2]" 1
1272 1 68 ALA MB 1 97 HIS H 5.500 . 5.500 3.493 2.951 4.753 . 0 0 "[ . 1 . 2]" 1
1273 1 4 SER H 1 7 ASP H 5.420 . 5.420 4.035 3.645 4.616 . 0 0 "[ . 1 . 2]" 1
1274 1 54 TYR QB 1 141 ASP H 4.450 . 4.450 2.916 2.155 3.875 . 0 0 "[ . 1 . 2]" 1
1275 1 11 ASP H 1 14 LEU H 5.500 . 5.500 4.496 3.982 4.963 . 0 0 "[ . 1 . 2]" 1
1276 1 85 VAL HA 1 102 PHE QB 3.790 . 3.790 2.668 2.351 2.912 . 0 0 "[ . 1 . 2]" 1
1277 1 76 VAL QG 1 111 LEU HA 4.420 . 4.420 3.951 3.550 4.442 0.022 19 0 "[ . 1 . 2]" 1
1278 1 11 ASP QB 1 14 LEU QB 2.600 . 2.600 2.355 1.893 2.616 0.016 11 0 "[ . 1 . 2]" 1
1279 1 38 THR HA 1 38 THR MG 3.590 . 3.590 2.465 1.987 3.185 . 0 0 "[ . 1 . 2]" 1
1280 1 68 ALA MB 1 98 ALA MB 3.350 . 3.350 1.799 1.731 2.024 0.069 13 0 "[ . 1 . 2]" 1
1281 1 90 TYR QD 1 99 TYR H 5.500 . 5.500 4.244 4.167 4.297 . 0 0 "[ . 1 . 2]" 1
1282 1 25 GLU QG 1 52 VAL QG 5.300 . 5.300 3.858 3.435 4.265 . 0 0 "[ . 1 . 2]" 1
1283 1 11 ASP HA 1 12 PRO HA 4.660 . 4.660 4.416 4.390 4.460 . 0 0 "[ . 1 . 2]" 1
1284 1 9 ILE HB 1 90 TYR QD 4.800 . 4.800 2.979 2.785 3.278 . 0 0 "[ . 1 . 2]" 1
1285 1 119 ILE HA 1 119 ILE QG 3.570 . 3.570 2.336 2.211 2.428 . 0 0 "[ . 1 . 2]" 1
1286 1 55 THR MG 1 60 GLU QB 3.400 . 3.400 3.128 2.426 3.402 0.002 9 0 "[ . 1 . 2]" 1
1287 1 2 ASP QB 1 3 GLU H 4.250 . 4.250 3.132 2.068 3.881 . 0 0 "[ . 1 . 2]" 1
1288 1 77 TYR H 1 111 LEU QB 5.490 . 5.490 3.620 3.407 4.056 . 0 0 "[ . 1 . 2]" 1
1289 1 71 TRP QB 1 72 LYS H 5.500 . 5.500 3.088 2.189 3.485 . 0 0 "[ . 1 . 2]" 1
1290 1 113 ILE HA 1 130 THR HB 4.470 . 4.470 4.315 4.149 4.479 0.009 19 0 "[ . 1 . 2]" 1
1291 1 113 ILE H 1 113 ILE HB 3.590 . 3.590 2.123 1.984 2.463 . 0 0 "[ . 1 . 2]" 1
1292 1 88 VAL H 1 88 VAL QG 4.150 . 4.150 1.945 1.714 2.823 0.086 7 0 "[ . 1 . 2]" 1
1293 1 109 GLN HA 1 109 GLN QG 3.230 . 3.230 2.277 2.029 2.416 . 0 0 "[ . 1 . 2]" 1
1294 1 31 LEU HA 1 32 LEU H 3.310 . 3.310 2.212 2.207 2.217 . 0 0 "[ . 1 . 2]" 1
1295 1 62 GLU QG 1 63 LEU H 4.400 . 4.400 2.513 1.908 4.268 . 0 0 "[ . 1 . 2]" 1
1296 1 104 VAL HA 1 108 THR MG 5.150 . 5.150 3.459 3.254 3.755 . 0 0 "[ . 1 . 2]" 1
1297 1 11 ASP H 1 15 GLU H 5.500 . 5.500 4.817 3.814 5.502 0.002 3 0 "[ . 1 . 2]" 1
1298 1 68 ALA HA 1 71 TRP QB 4.190 . 4.190 2.805 2.475 3.321 . 0 0 "[ . 1 . 2]" 1
1299 1 51 ASP H 1 61 VAL QG 4.670 . 4.670 3.361 2.684 4.034 . 0 0 "[ . 1 . 2]" 1
1300 1 85 VAL HA 1 86 ARG H 3.110 . 3.110 2.267 2.215 2.334 . 0 0 "[ . 1 . 2]" 1
1301 1 111 LEU HG 1 132 LEU QD 4.620 . 4.620 2.356 1.917 2.801 . 0 0 "[ . 1 . 2]" 1
1302 1 27 VAL QG 1 50 ALA MB 4.910 . 4.910 2.774 1.976 3.204 . 0 0 "[ . 1 . 2]" 1
1303 1 46 ILE MG 1 47 LYS H 4.660 . 4.660 1.964 1.841 2.250 . 0 0 "[ . 1 . 2]" 1
1304 1 22 GLY H 1 23 PRO QD 4.940 . 4.940 4.350 4.240 4.397 . 0 0 "[ . 1 . 2]" 1
1305 1 113 ILE HA 1 113 ILE MG 3.270 . 3.270 2.619 2.451 2.751 . 0 0 "[ . 1 . 2]" 1
1306 1 113 ILE MG 1 114 VAL HA 4.480 . 4.480 3.427 3.225 3.635 . 0 0 "[ . 1 . 2]" 1
1307 1 11 ASP H 1 13 ALA H 5.500 . 5.500 5.301 4.980 5.511 0.011 10 0 "[ . 1 . 2]" 1
1308 1 48 ASP H 1 49 PRO HA 5.500 . 5.500 5.527 5.370 5.618 0.118 18 0 "[ . 1 . 2]" 1
1309 1 52 VAL HA 1 52 VAL QG 3.330 . 3.330 2.054 1.888 2.106 . 0 0 "[ . 1 . 2]" 1
1310 1 81 GLN H 1 81 GLN QE 5.500 . 5.500 5.036 4.467 5.499 . 0 0 "[ . 1 . 2]" 1
1311 1 28 ASN QD 1 135 ALA H 5.430 . 5.430 5.086 4.073 5.451 0.021 2 0 "[ . 1 . 2]" 1
1312 1 87 LEU HA 1 87 LEU HG 4.000 . 4.000 2.063 1.933 2.394 . 0 0 "[ . 1 . 2]" 1
1313 1 91 SER HA 1 95 GLU QG 4.920 . 4.920 4.563 4.212 4.910 . 0 0 "[ . 1 . 2]" 1
1314 1 110 GLU QG 1 133 VAL HA 4.040 . 4.040 3.113 2.113 4.037 . 0 0 "[ . 1 . 2]" 1
1315 1 89 SER QB 1 99 TYR H 5.500 . 5.500 4.589 4.024 5.141 . 0 0 "[ . 1 . 2]" 1
1316 1 17 LYS H 1 19 HIS H 5.500 . 5.500 4.945 4.221 5.509 0.009 2 0 "[ . 1 . 2]" 1
1317 1 29 PHE QD 1 31 LEU HA 4.760 . 4.760 4.627 4.400 4.741 . 0 0 "[ . 1 . 2]" 1
1318 1 107 GLY H 1 140 ASN H 5.400 . 5.400 4.310 4.072 4.851 . 0 0 "[ . 1 . 2]" 1
1319 1 60 GLU HA 1 61 VAL H 3.190 . 3.190 2.276 2.220 2.324 . 0 0 "[ . 1 . 2]" 1
1320 1 116 SER HA 1 126 ASN QB 4.760 . 4.760 4.296 3.863 4.672 . 0 0 "[ . 1 . 2]" 1
1321 1 113 ILE MG 1 130 THR HB 3.860 . 3.860 2.481 2.037 3.181 . 0 0 "[ . 1 . 2]" 1
1322 1 109 GLN H 1 110 GLU H 2.860 . 2.860 2.041 1.929 2.277 . 0 0 "[ . 1 . 2]" 1
1323 1 104 VAL HB 1 138 ILE H 4.310 . 4.310 4.345 4.291 4.396 0.086 18 0 "[ . 1 . 2]" 1
1324 1 38 THR H 1 39 GLN H 4.760 . 4.760 4.531 4.335 4.655 . 0 0 "[ . 1 . 2]" 1
1325 1 83 LEU QB 1 103 PRO QD 4.870 . 4.870 2.628 2.412 2.900 . 0 0 "[ . 1 . 2]" 1
1326 1 74 PHE QD 1 115 SER HA 4.490 . 4.490 4.401 3.905 4.550 0.060 7 0 "[ . 1 . 2]" 1
1327 1 55 THR HA 1 55 THR MG 2.890 . 2.890 2.299 2.114 2.525 . 0 0 "[ . 1 . 2]" 1
1328 1 104 VAL HA 1 105 SER H 3.140 . 3.140 2.293 2.271 2.322 . 0 0 "[ . 1 . 2]" 1
1329 1 26 GLN QG 1 27 VAL H 5.500 . 5.500 4.331 3.674 4.746 . 0 0 "[ . 1 . 2]" 1
1330 1 65 ILE MD 1 98 ALA MB 4.470 . 4.470 2.984 2.605 3.514 . 0 0 "[ . 1 . 2]" 1
1331 1 110 GLU HA 1 133 VAL QG 3.790 . 3.790 2.871 2.580 3.438 . 0 0 "[ . 1 . 2]" 1
1332 1 65 ILE MG 1 68 ALA H 5.500 . 5.500 2.662 2.331 3.116 . 0 0 "[ . 1 . 2]" 1
1333 1 83 LEU H 1 84 PRO QD 5.500 . 5.500 4.339 4.260 4.382 . 0 0 "[ . 1 . 2]" 1
1334 1 70 THR MG 1 117 THR MG 5.440 . 5.440 5.061 4.822 5.357 . 0 0 "[ . 1 . 2]" 1
1335 1 52 VAL QG 1 60 GLU H 5.240 . 5.240 2.908 2.505 3.554 . 0 0 "[ . 1 . 2]" 1
1336 1 15 GLU HA 1 15 GLU QG 3.450 . 3.450 2.289 1.932 2.565 . 0 0 "[ . 1 . 2]" 1
1337 1 76 VAL QG 1 111 LEU QB 3.450 . 3.450 2.023 1.792 2.493 0.008 10 0 "[ . 1 . 2]" 1
1338 1 112 LYS QE 1 112 LYS QG 3.350 . 3.350 2.089 1.923 2.558 . 0 0 "[ . 1 . 2]" 1
1339 1 21 ILE H 1 22 GLY QA 5.500 . 5.500 4.690 4.421 4.983 . 0 0 "[ . 1 . 2]" 1
1340 1 88 VAL QG 1 89 SER H 4.090 . 4.090 2.011 1.845 2.299 . 0 0 "[ . 1 . 2]" 1
1341 1 87 LEU HG 1 100 ILE HA 4.810 . 4.810 3.401 2.780 4.182 . 0 0 "[ . 1 . 2]" 1
1342 1 58 LYS HA 1 58 LYS QD 4.050 . 4.050 2.288 1.910 3.330 . 0 0 "[ . 1 . 2]" 1
1343 1 63 LEU QD 1 64 ASP H 4.690 . 4.690 3.350 2.496 4.130 . 0 0 "[ . 1 . 2]" 1
1344 1 14 LEU QD 1 89 SER HA 3.930 . 3.930 2.636 1.815 3.747 . 0 0 "[ . 1 . 2]" 1
1345 1 129 TYR QB 1 130 THR H 5.500 . 5.500 3.964 3.914 4.014 . 0 0 "[ . 1 . 2]" 1
1346 1 68 ALA MB 1 71 TRP HD1 4.730 . 4.730 3.826 3.587 4.308 . 0 0 "[ . 1 . 2]" 1
1347 1 85 VAL H 1 85 VAL HB 2.890 . 2.890 2.301 2.025 2.544 . 0 0 "[ . 1 . 2]" 1
1348 1 9 ILE MD 1 68 ALA MB 3.900 . 3.900 3.036 2.335 3.860 . 0 0 "[ . 1 . 2]" 1
1349 1 99 TYR HA 1 100 ILE H 3.240 . 3.240 2.221 2.197 2.255 . 0 0 "[ . 1 . 2]" 1
1350 1 45 SER HA 1 71 TRP HE1 5.500 . 5.500 3.722 2.971 4.755 . 0 0 "[ . 1 . 2]" 1
1351 1 67 THR HA 1 68 ALA H 3.570 . 3.570 2.693 2.519 2.845 . 0 0 "[ . 1 . 2]" 1
1352 1 88 VAL QG 1 100 ILE HA 4.500 . 4.500 3.067 2.768 3.872 . 0 0 "[ . 1 . 2]" 1
1353 1 34 LYS QE 1 35 ASN QD 5.500 . 5.500 4.595 3.610 5.460 . 0 0 "[ . 1 . 2]" 1
1354 1 78 GLU HA 1 81 GLN H 5.500 . 5.500 4.733 4.392 5.028 . 0 0 "[ . 1 . 2]" 1
1355 1 90 TYR QE 1 93 VAL QG 4.570 . 4.570 4.208 4.114 4.310 . 0 0 "[ . 1 . 2]" 1
1356 1 108 THR HA 1 108 THR HB 2.970 . 2.970 3.027 3.024 3.030 0.060 18 0 "[ . 1 . 2]" 1
1357 1 28 ASN HA 1 28 ASN QD 4.450 . 4.450 3.465 2.695 4.164 . 0 0 "[ . 1 . 2]" 1
1358 1 46 ILE H 1 65 ILE HA 4.950 . 4.950 3.814 1.943 4.358 . 0 0 "[ . 1 . 2]" 1
1359 1 108 THR MG 1 110 GLU H 3.510 . 3.510 2.571 2.067 2.989 . 0 0 "[ . 1 . 2]" 1
1360 1 112 LYS QG 1 130 THR H 5.500 . 5.500 3.904 3.449 4.351 . 0 0 "[ . 1 . 2]" 1
1361 1 87 LEU QD 1 90 TYR HA 4.210 . 4.210 3.632 3.232 4.214 0.004 4 0 "[ . 1 . 2]" 1
1362 1 125 THR MG 1 126 ASN HA 4.950 . 4.950 4.449 3.997 4.810 . 0 0 "[ . 1 . 2]" 1
1363 1 65 ILE MG 1 71 TRP HE1 4.550 . 4.550 2.119 1.874 2.529 . 0 0 "[ . 1 . 2]" 1
1364 1 68 ALA H 1 68 ALA MB 3.470 . 3.470 2.097 1.941 2.150 . 0 0 "[ . 1 . 2]" 1
1365 1 45 SER QB 1 67 THR MG 5.230 . 5.230 3.878 3.025 4.806 . 0 0 "[ . 1 . 2]" 1
1366 1 102 PHE HA 1 103 PRO QD 3.350 . 3.350 2.096 2.024 2.157 . 0 0 "[ . 1 . 2]" 1
1367 1 100 ILE HB 1 102 PHE QD 5.040 . 5.040 4.419 3.967 4.823 . 0 0 "[ . 1 . 2]" 1
1368 1 87 LEU HA 1 100 ILE HA 3.040 . 3.040 2.266 1.933 2.579 . 0 0 "[ . 1 . 2]" 1
1369 1 77 TYR H 1 112 LYS H 3.990 . 3.990 2.849 2.196 3.314 . 0 0 "[ . 1 . 2]" 1
1370 1 29 PHE H 1 29 PHE QE 5.500 . 5.500 3.874 3.788 4.057 . 0 0 "[ . 1 . 2]" 1
1371 1 134 PHE QB 1 137 PRO HA 4.850 . 4.850 4.040 3.960 4.153 . 0 0 "[ . 1 . 2]" 1
1372 1 28 ASN QB 1 29 PHE H 3.870 . 3.870 3.241 2.736 3.656 . 0 0 "[ . 1 . 2]" 1
1373 1 29 PHE H 1 29 PHE QD 3.950 . 3.950 2.925 2.760 3.095 . 0 0 "[ . 1 . 2]" 1
1374 1 66 ASN QB 1 68 ALA H 5.500 . 5.500 4.995 4.656 5.380 . 0 0 "[ . 1 . 2]" 1
1375 1 99 TYR QD 1 100 ILE H 4.820 . 4.820 3.997 3.554 4.276 . 0 0 "[ . 1 . 2]" 1
1376 1 29 PHE HZ 1 50 ALA MB 5.500 . 5.500 5.294 5.073 5.519 0.019 5 0 "[ . 1 . 2]" 1
1377 1 83 LEU QD 1 84 PRO QD 3.600 . 3.600 2.633 2.168 2.990 . 0 0 "[ . 1 . 2]" 1
1378 1 7 ASP H 1 9 ILE MG 5.500 . 5.500 4.739 4.387 5.062 . 0 0 "[ . 1 . 2]" 1
1379 1 78 GLU H 1 78 GLU QB 3.590 . 3.590 2.748 2.230 3.148 . 0 0 "[ . 1 . 2]" 1
1380 1 18 GLU QG 1 21 ILE MD 4.860 . 4.860 3.213 1.870 4.365 . 0 0 "[ . 1 . 2]" 1
1381 1 119 ILE HB 1 119 ILE MD 2.920 . 2.920 2.008 1.926 2.151 . 0 0 "[ . 1 . 2]" 1
1382 1 85 VAL HA 1 102 PHE QD 3.920 . 3.920 3.804 3.444 3.940 0.020 4 0 "[ . 1 . 2]" 1
1383 1 29 PHE HA 1 132 LEU QD 4.230 . 4.230 3.513 3.130 3.736 . 0 0 "[ . 1 . 2]" 1
1384 1 46 ILE MD 1 65 ILE MG 4.390 . 4.390 4.157 3.310 4.417 0.027 3 0 "[ . 1 . 2]" 1
1385 1 46 ILE QG 1 65 ILE QG 4.500 . 4.500 2.506 2.132 3.953 . 0 0 "[ . 1 . 2]" 1
1386 1 70 THR MG 1 71 TRP H 5.500 . 5.500 3.851 3.657 4.053 . 0 0 "[ . 1 . 2]" 1
1387 1 9 ILE MG 1 98 ALA HA 4.400 . 4.400 3.644 3.267 4.041 . 0 0 "[ . 1 . 2]" 1
1388 1 14 LEU QB 1 89 SER HA 4.230 . 4.230 2.903 2.047 3.524 . 0 0 "[ . 1 . 2]" 1
1389 1 28 ASN H 1 29 PHE H 5.190 . 5.190 4.611 4.536 4.653 . 0 0 "[ . 1 . 2]" 1
1390 1 6 LYS H 1 6 LYS QE 5.500 . 5.500 5.003 3.732 5.515 0.015 10 0 "[ . 1 . 2]" 1
1391 1 57 LYS QB 1 58 LYS HA 4.780 . 4.780 4.234 4.148 4.346 . 0 0 "[ . 1 . 2]" 1
1392 1 51 ASP H 1 62 GLU H 4.910 . 4.910 2.700 1.957 3.525 . 0 0 "[ . 1 . 2]" 1
1393 1 98 ALA HA 1 99 TYR H 3.500 . 3.500 2.264 2.217 2.416 . 0 0 "[ . 1 . 2]" 1
1394 1 104 VAL QG 1 108 THR H 4.650 . 4.650 4.074 3.914 4.287 . 0 0 "[ . 1 . 2]" 1
1395 1 65 ILE H 1 65 ILE HB 3.960 . 3.960 2.335 2.163 2.693 . 0 0 "[ . 1 . 2]" 1
1396 1 134 PHE H 1 134 PHE QE 5.500 . 5.500 4.804 4.669 4.941 . 0 0 "[ . 1 . 2]" 1
1397 1 110 GLU H 1 134 PHE QD 5.500 . 5.500 3.924 3.248 4.255 . 0 0 "[ . 1 . 2]" 1
1398 1 6 LYS HA 1 9 ILE QG 3.520 . 3.520 2.366 2.009 2.859 . 0 0 "[ . 1 . 2]" 1
1399 1 65 ILE QG 1 100 ILE MG 4.990 . 4.990 4.032 3.670 4.370 . 0 0 "[ . 1 . 2]" 1
1400 1 77 TYR QB 1 112 LYS QB 5.490 . 5.490 3.343 2.721 3.968 . 0 0 "[ . 1 . 2]" 1
1401 1 27 VAL QG 1 52 VAL H 5.500 . 5.500 3.662 2.819 4.583 . 0 0 "[ . 1 . 2]" 1
1402 1 87 LEU QD 1 90 TYR QD 4.260 . 4.260 3.438 3.044 3.855 . 0 0 "[ . 1 . 2]" 1
1403 1 70 THR HB 1 117 THR HB 3.800 . 3.800 2.777 2.389 3.239 . 0 0 "[ . 1 . 2]" 1
1404 1 32 LEU HA 1 32 LEU HG 3.470 . 3.470 2.873 2.740 2.960 . 0 0 "[ . 1 . 2]" 1
1405 1 9 ILE H 1 87 LEU QD 5.350 . 5.350 3.463 2.924 3.880 . 0 0 "[ . 1 . 2]" 1
1406 1 27 VAL HB 1 52 VAL QG 3.730 . 3.730 2.628 2.295 2.827 . 0 0 "[ . 1 . 2]" 1
1407 1 76 VAL HA 1 113 ILE HA 3.300 . 3.300 2.185 1.979 2.479 . 0 0 "[ . 1 . 2]" 1
1408 1 13 ALA MB 1 14 LEU QD 3.180 . 3.180 2.746 2.028 3.203 0.023 3 0 "[ . 1 . 2]" 1
1409 1 80 ASN QB 1 81 GLN H 5.210 . 5.210 3.915 3.795 4.072 . 0 0 "[ . 1 . 2]" 1
1410 1 71 TRP HA 1 117 THR HA 3.370 . 3.370 3.101 2.244 3.374 0.004 9 0 "[ . 1 . 2]" 1
1411 1 108 THR HA 1 138 ILE H 4.990 . 4.990 4.856 4.769 4.980 . 0 0 "[ . 1 . 2]" 1
1412 1 129 TYR H 1 129 TYR QB 3.430 . 3.430 2.557 2.263 2.734 . 0 0 "[ . 1 . 2]" 1
1413 1 58 LYS QE 1 104 VAL QG 3.810 . 3.810 3.657 2.857 3.863 0.053 5 0 "[ . 1 . 2]" 1
1414 1 51 ASP QB 1 53 TYR QE 3.530 . 3.530 2.409 1.935 3.201 . 0 0 "[ . 1 . 2]" 1
1415 1 29 PHE QD 1 31 LEU QD 3.940 . 3.940 2.687 1.820 3.185 . 0 0 "[ . 1 . 2]" 1
1416 1 53 TYR QE 1 62 GLU QB 3.820 . 3.820 2.733 1.942 3.661 . 0 0 "[ . 1 . 2]" 1
1417 1 45 SER QB 1 46 ILE H 4.210 . 4.210 2.153 1.897 3.177 . 0 0 "[ . 1 . 2]" 1
1418 1 108 THR HB 1 138 ILE QG 4.000 . 4.000 3.921 3.734 4.030 0.030 19 0 "[ . 1 . 2]" 1
1419 1 34 LYS H 1 34 LYS QG 4.600 . 4.600 3.789 2.105 3.977 . 0 0 "[ . 1 . 2]" 1
1420 1 8 ALA H 1 9 ILE MG 5.110 . 5.110 3.685 3.436 3.956 . 0 0 "[ . 1 . 2]" 1
1421 1 45 SER QB 1 46 ILE HA 4.930 . 4.930 3.975 3.770 4.595 . 0 0 "[ . 1 . 2]" 1
1422 1 51 ASP HA 1 52 VAL H 3.290 . 3.290 2.340 2.214 2.505 . 0 0 "[ . 1 . 2]" 1
1423 1 30 GLN H 1 133 VAL H 4.250 . 4.250 3.291 2.963 3.638 . 0 0 "[ . 1 . 2]" 1
1424 1 19 HIS QB 1 88 VAL QG 4.050 . 4.050 2.176 1.762 2.926 0.038 3 0 "[ . 1 . 2]" 1
1425 1 46 ILE MD 1 65 ILE QG 4.570 . 4.570 3.049 1.929 3.468 . 0 0 "[ . 1 . 2]" 1
1426 1 65 ILE MG 1 66 ASN HA 5.210 . 5.210 3.803 3.517 4.304 . 0 0 "[ . 1 . 2]" 1
1427 1 76 VAL QG 1 113 ILE MG 4.570 . 4.570 3.409 2.972 4.212 . 0 0 "[ . 1 . 2]" 1
1428 1 81 GLN QG 1 83 LEU QD 4.190 . 4.190 3.119 2.143 4.148 . 0 0 "[ . 1 . 2]" 1
1429 1 16 ASN QD 1 91 SER HA 5.500 . 5.500 3.598 1.972 5.468 . 0 0 "[ . 1 . 2]" 1
1430 1 117 THR MG 1 127 TYR QE 3.540 . 3.540 2.135 1.884 2.548 . 0 0 "[ . 1 . 2]" 1
1431 1 3 GLU QG 1 8 ALA MB 4.250 . 4.250 3.275 1.899 4.276 0.026 13 0 "[ . 1 . 2]" 1
1432 1 50 ALA MB 1 134 PHE QD 4.760 . 4.760 3.195 2.923 3.462 . 0 0 "[ . 1 . 2]" 1
1433 1 52 VAL QG 1 60 GLU HA 5.170 . 5.170 4.548 4.255 4.985 . 0 0 "[ . 1 . 2]" 1
1434 1 5 LEU QD 1 65 ILE MG 3.480 . 3.480 3.217 2.860 3.493 0.013 11 0 "[ . 1 . 2]" 1
1435 1 30 GLN H 1 135 ALA HA 4.880 . 4.880 4.891 4.811 4.930 0.050 18 0 "[ . 1 . 2]" 1
1436 1 59 ALA HA 1 60 GLU QB 5.390 . 5.390 3.965 3.763 4.315 . 0 0 "[ . 1 . 2]" 1
1437 1 113 ILE H 1 132 LEU H 5.380 . 5.380 3.519 3.225 4.369 . 0 0 "[ . 1 . 2]" 1
1438 1 5 LEU QB 1 74 PHE QB 3.860 . 3.860 3.554 3.227 3.862 0.002 11 0 "[ . 1 . 2]" 1
1439 1 15 GLU QG 1 90 TYR QD 5.010 . 5.010 3.958 2.919 4.738 . 0 0 "[ . 1 . 2]" 1
1440 1 21 ILE HA 1 21 ILE MG 3.110 . 3.110 2.308 2.154 2.509 . 0 0 "[ . 1 . 2]" 1
1441 1 58 LYS QG 1 105 SER H 5.470 . 5.470 4.683 3.551 5.521 0.051 14 0 "[ . 1 . 2]" 1
1442 1 102 PHE QD 1 103 PRO QD 4.530 . 4.530 3.794 3.657 4.007 . 0 0 "[ . 1 . 2]" 1
1443 1 142 PRO QD 1 143 SER H 3.080 . 3.080 2.596 2.500 2.736 . 0 0 "[ . 1 . 2]" 1
1444 1 12 PRO QD 1 13 ALA MB 5.330 . 5.330 3.519 3.395 3.653 . 0 0 "[ . 1 . 2]" 1
1445 1 29 PHE QB 1 134 PHE QD 4.250 . 4.250 2.799 2.152 3.194 . 0 0 "[ . 1 . 2]" 1
1446 1 112 LYS HA 1 132 LEU H 4.840 . 4.840 3.174 2.690 3.521 . 0 0 "[ . 1 . 2]" 1
1447 1 99 TYR QB 1 100 ILE H 4.090 . 4.090 3.362 3.088 3.682 . 0 0 "[ . 1 . 2]" 1
1448 1 4 SER QB 1 6 LYS H 5.080 . 5.080 2.741 2.416 3.496 . 0 0 "[ . 1 . 2]" 1
1449 1 34 LYS HA 1 129 TYR QD 3.800 . 3.800 3.355 2.764 3.775 . 0 0 "[ . 1 . 2]" 1
1450 1 52 VAL QG 1 53 TYR H 4.560 . 4.560 2.706 2.121 3.507 . 0 0 "[ . 1 . 2]" 1
1451 1 32 LEU QD 1 36 ASN HA 3.300 . 3.300 2.432 2.008 2.817 . 0 0 "[ . 1 . 2]" 1
1452 1 18 GLU QG 1 21 ILE QG 4.570 . 4.570 3.091 2.255 4.192 . 0 0 "[ . 1 . 2]" 1
1453 1 142 PRO HA 1 144 LEU H 5.500 . 5.500 4.605 4.118 5.257 . 0 0 "[ . 1 . 2]" 1
1454 1 87 LEU HA 1 100 ILE MG 3.110 . 3.110 2.629 2.322 3.107 . 0 0 "[ . 1 . 2]" 1
1455 1 11 ASP H 1 12 PRO QD 4.580 . 4.580 4.267 4.110 4.392 . 0 0 "[ . 1 . 2]" 1
1456 1 3 GLU H 1 8 ALA MB 5.500 . 5.500 4.712 3.842 5.518 0.018 10 0 "[ . 1 . 2]" 1
1457 1 85 VAL QG 1 86 ARG H 3.750 . 3.750 2.356 1.937 2.916 . 0 0 "[ . 1 . 2]" 1
1458 1 74 PHE HA 1 113 ILE MG 4.610 . 4.610 4.065 3.671 4.413 . 0 0 "[ . 1 . 2]" 1
1459 1 65 ILE MG 1 71 TRP QB 5.360 . 5.360 3.604 3.246 4.045 . 0 0 "[ . 1 . 2]" 1
1460 1 24 ARG QB 1 53 TYR QE 4.580 . 4.580 3.115 2.201 3.704 . 0 0 "[ . 1 . 2]" 1
1461 1 57 LYS H 1 57 LYS QB 3.350 . 3.350 2.223 2.003 2.629 . 0 0 "[ . 1 . 2]" 1
1462 1 138 ILE H 1 138 ILE QG 3.660 . 3.660 1.944 1.922 2.108 . 0 0 "[ . 1 . 2]" 1
1463 1 55 THR HB 1 56 LYS H 3.090 . 3.090 2.058 1.935 2.472 . 0 0 "[ . 1 . 2]" 1
1464 1 27 VAL H 1 51 ASP QB 5.270 . 5.270 4.826 4.523 5.251 . 0 0 "[ . 1 . 2]" 1
1465 1 9 ILE H 1 9 ILE QG 4.110 . 4.110 1.952 1.896 2.036 . 0 0 "[ . 1 . 2]" 1
1466 1 85 VAL H 1 85 VAL QG 3.340 . 3.340 2.266 1.955 2.668 . 0 0 "[ . 1 . 2]" 1
1467 1 110 GLU HA 1 111 LEU HG 4.670 . 4.670 3.520 3.436 3.586 . 0 0 "[ . 1 . 2]" 1
1468 1 91 SER HA 1 97 HIS H 5.500 . 5.500 4.809 4.432 5.014 . 0 0 "[ . 1 . 2]" 1
1469 1 105 SER HA 1 107 GLY H 3.910 . 3.910 3.396 3.192 3.548 . 0 0 "[ . 1 . 2]" 1
1470 1 70 THR H 1 71 TRP QB 5.500 . 5.500 4.005 3.733 4.333 . 0 0 "[ . 1 . 2]" 1
1471 1 19 HIS HD2 1 89 SER QB 4.210 . 4.210 3.557 2.817 4.132 . 0 0 "[ . 1 . 2]" 1
1472 1 63 LEU HA 1 63 LEU HG 3.840 . 3.840 2.262 1.963 3.530 . 0 0 "[ . 1 . 2]" 1
1473 1 68 ALA H 1 71 TRP H 5.500 . 5.500 5.201 4.963 5.462 . 0 0 "[ . 1 . 2]" 1
1474 1 74 PHE QD 1 113 ILE HA 4.990 . 4.990 4.212 3.736 4.563 . 0 0 "[ . 1 . 2]" 1
1475 1 130 THR MG 1 131 LYS H 4.980 . 4.980 3.220 2.874 3.402 . 0 0 "[ . 1 . 2]" 1
1476 1 108 THR MG 1 111 LEU QD 2.840 . 2.840 1.830 1.744 1.966 0.056 3 0 "[ . 1 . 2]" 1
1477 1 21 ILE H 1 21 ILE QG 4.630 . 4.630 2.448 1.950 3.018 . 0 0 "[ . 1 . 2]" 1
1478 1 9 ILE MG 1 90 TYR HA 4.700 . 4.700 4.550 4.222 4.718 0.018 19 0 "[ . 1 . 2]" 1
1479 1 60 GLU QG 1 61 VAL H 5.370 . 5.370 4.149 3.837 4.648 . 0 0 "[ . 1 . 2]" 1
1480 1 117 THR HB 1 127 TYR QE 4.880 . 4.880 4.655 4.099 4.876 . 0 0 "[ . 1 . 2]" 1
1481 1 74 PHE H 1 114 VAL HB 5.500 . 5.500 5.538 5.497 5.561 0.061 9 0 "[ . 1 . 2]" 1
1482 1 135 ALA MB 1 136 LYS H 4.150 . 4.150 2.796 2.728 2.855 . 0 0 "[ . 1 . 2]" 1
1483 1 110 GLU HA 1 112 LYS QE 4.990 . 4.990 4.874 4.644 5.016 0.026 13 0 "[ . 1 . 2]" 1
1484 1 29 PHE QE 1 50 ALA HA 4.210 . 4.210 3.680 3.379 4.032 . 0 0 "[ . 1 . 2]" 1
1485 1 31 LEU QD 1 132 LEU HG 3.900 . 3.900 3.346 2.786 3.833 . 0 0 "[ . 1 . 2]" 1
1486 1 93 VAL QG 1 94 PRO QB 4.280 . 4.280 3.521 3.381 3.736 . 0 0 "[ . 1 . 2]" 1
1487 1 134 PHE QD 1 138 ILE QG 4.850 . 4.850 2.855 2.564 3.058 . 0 0 "[ . 1 . 2]" 1
1488 1 81 GLN HA 1 81 GLN QG 2.950 . 2.950 2.311 1.952 2.735 . 0 0 "[ . 1 . 2]" 1
1489 1 75 GLU HA 1 85 VAL QG 4.700 . 4.700 3.541 2.848 4.318 . 0 0 "[ . 1 . 2]" 1
1490 1 53 TYR QD 1 62 GLU QB 5.070 . 5.070 2.873 2.275 3.758 . 0 0 "[ . 1 . 2]" 1
1491 1 69 SER H 1 90 TYR QE 5.500 . 5.500 4.592 4.167 5.053 . 0 0 "[ . 1 . 2]" 1
1492 1 55 THR HB 1 56 LYS QB 5.480 . 5.480 3.939 3.599 4.454 . 0 0 "[ . 1 . 2]" 1
1493 1 134 PHE QD 1 135 ALA H 4.500 . 4.500 2.968 2.721 3.121 . 0 0 "[ . 1 . 2]" 1
1494 1 29 PHE HZ 1 50 ALA H 4.730 . 4.730 4.645 4.361 4.762 0.032 13 0 "[ . 1 . 2]" 1
1495 1 5 LEU QB 1 71 TRP QB 3.730 . 3.730 2.269 1.785 2.591 0.015 4 0 "[ . 1 . 2]" 1
1496 1 27 VAL QG 1 136 LYS H 3.360 . 3.360 2.701 2.553 2.856 . 0 0 "[ . 1 . 2]" 1
1497 1 58 LYS QD 1 106 ASP H 4.680 . 4.680 4.519 4.084 4.748 0.068 5 0 "[ . 1 . 2]" 1
1498 1 24 ARG H 1 24 ARG QB 3.780 . 3.780 3.195 2.857 3.405 . 0 0 "[ . 1 . 2]" 1
1499 1 25 GLU QB 1 26 GLN H 2.850 . 2.850 2.204 1.965 2.626 . 0 0 "[ . 1 . 2]" 1
1500 1 13 ALA H 1 14 LEU H 3.230 . 3.230 2.491 2.297 2.951 . 0 0 "[ . 1 . 2]" 1
1501 1 54 TYR QD 1 59 ALA MB 4.030 . 4.030 1.946 1.843 2.209 . 0 0 "[ . 1 . 2]" 1
1502 1 9 ILE QG 1 10 LYS H 5.210 . 5.210 2.141 1.933 3.713 . 0 0 "[ . 1 . 2]" 1
1503 1 30 GLN QG 1 133 VAL QG 3.840 . 3.840 3.583 3.079 3.846 0.006 2 0 "[ . 1 . 2]" 1
1504 1 78 GLU H 1 82 LYS HA 4.660 . 4.660 3.810 3.632 4.174 . 0 0 "[ . 1 . 2]" 1
1505 1 81 GLN H 1 81 GLN QB 2.990 . 2.990 2.750 2.511 2.883 . 0 0 "[ . 1 . 2]" 1
1506 1 45 SER QB 1 67 THR H 5.500 . 5.500 3.357 2.318 4.042 . 0 0 "[ . 1 . 2]" 1
1507 1 18 GLU HA 1 19 HIS H 3.340 . 3.340 2.471 2.309 3.224 . 0 0 "[ . 1 . 2]" 1
1508 1 57 LYS QB 1 58 LYS QB 4.630 . 4.630 3.035 2.836 3.263 . 0 0 "[ . 1 . 2]" 1
1509 1 65 ILE MD 1 99 TYR QD 4.830 . 4.830 4.608 4.180 4.839 0.009 13 0 "[ . 1 . 2]" 1
1510 1 35 ASN QB 1 36 ASN H 4.850 . 4.850 3.659 3.583 3.779 . 0 0 "[ . 1 . 2]" 1
1511 1 58 LYS H 1 59 ALA H 4.730 . 4.730 4.451 4.373 4.515 . 0 0 "[ . 1 . 2]" 1
1512 1 93 VAL H 1 95 GLU H 5.480 . 5.480 4.433 4.381 4.513 . 0 0 "[ . 1 . 2]" 1
1513 1 108 THR HB 1 109 GLN H 4.600 . 4.600 4.328 4.235 4.440 . 0 0 "[ . 1 . 2]" 1
1514 1 5 LEU QD 1 74 PHE QB 4.180 . 4.180 2.438 1.880 3.503 . 0 0 "[ . 1 . 2]" 1
1515 1 77 TYR QB 1 82 LYS HA 4.440 . 4.440 2.174 1.878 2.935 . 0 0 "[ . 1 . 2]" 1
1516 1 93 VAL QG 1 94 PRO QD 3.200 . 3.200 2.238 2.046 2.513 . 0 0 "[ . 1 . 2]" 1
1517 1 29 PHE QD 1 132 LEU QD 3.470 . 3.470 3.004 2.788 3.211 . 0 0 "[ . 1 . 2]" 1
1518 1 64 ASP HA 1 99 TYR HA 3.630 . 3.630 2.898 2.670 3.064 . 0 0 "[ . 1 . 2]" 1
1519 1 98 ALA MB 1 99 TYR H 4.370 . 4.370 3.066 2.632 3.414 . 0 0 "[ . 1 . 2]" 1
1520 1 10 LYS QD 1 93 VAL H 5.400 . 5.400 5.313 4.978 5.430 0.030 11 0 "[ . 1 . 2]" 1
1521 1 53 TYR HA 1 53 TYR QD 4.060 . 4.060 2.920 2.308 3.055 . 0 0 "[ . 1 . 2]" 1
1522 1 124 GLU QG 1 125 THR H 5.290 . 5.290 2.732 2.130 3.263 . 0 0 "[ . 1 . 2]" 1
1523 1 32 LEU QD 1 37 GLU HA 3.940 . 3.940 3.654 3.127 3.894 . 0 0 "[ . 1 . 2]" 1
1524 1 104 VAL HB 1 107 GLY H 5.500 . 5.500 4.926 4.692 5.273 . 0 0 "[ . 1 . 2]" 1
1525 1 48 ASP QB 1 49 PRO HA 4.760 . 4.760 4.462 4.417 4.528 . 0 0 "[ . 1 . 2]" 1
1526 1 56 LYS H 1 56 LYS QG 3.910 . 3.910 3.080 1.923 3.959 0.049 1 0 "[ . 1 . 2]" 1
1527 1 85 VAL QG 1 100 ILE QG 5.020 . 5.020 3.256 3.042 3.393 . 0 0 "[ . 1 . 2]" 1
1528 1 137 PRO HA 1 138 ILE H 3.110 . 3.110 2.232 2.220 2.250 . 0 0 "[ . 1 . 2]" 1
1529 1 116 SER QB 1 126 ASN QB 4.600 . 4.600 3.425 2.465 4.258 . 0 0 "[ . 1 . 2]" 1
1530 1 68 ALA MB 1 90 TYR QD 4.240 . 4.240 2.719 2.525 3.117 . 0 0 "[ . 1 . 2]" 1
1531 1 85 VAL H 1 86 ARG HA 5.420 . 5.420 5.384 5.066 5.510 0.090 5 0 "[ . 1 . 2]" 1
1532 1 142 PRO QB 1 143 SER QB 4.680 . 4.680 3.955 3.311 4.601 . 0 0 "[ . 1 . 2]" 1
1533 1 61 VAL H 1 102 PHE H 4.220 . 4.220 3.312 2.588 3.720 . 0 0 "[ . 1 . 2]" 1
1534 1 73 LYS QB 1 115 SER HA 4.850 . 4.850 2.879 2.407 4.102 . 0 0 "[ . 1 . 2]" 1
1535 1 25 GLU HA 1 26 GLN HA 4.600 . 4.600 4.536 4.467 4.579 . 0 0 "[ . 1 . 2]" 1
1536 1 134 PHE HA 1 135 ALA H 3.300 . 3.300 2.443 2.390 2.475 . 0 0 "[ . 1 . 2]" 1
1537 1 47 LYS QB 1 64 ASP H 5.500 . 5.500 5.499 5.388 5.546 0.046 6 0 "[ . 1 . 2]" 1
1538 1 61 VAL QG 1 62 GLU HA 4.830 . 4.830 3.624 3.369 3.844 . 0 0 "[ . 1 . 2]" 1
1539 1 62 GLU HA 1 63 LEU H 3.410 . 3.410 2.286 2.200 2.471 . 0 0 "[ . 1 . 2]" 1
1540 1 81 GLN H 1 82 LYS H 4.960 . 4.960 3.925 3.027 4.320 . 0 0 "[ . 1 . 2]" 1
1541 1 31 LEU QD 1 132 LEU H 5.240 . 5.240 4.872 4.574 5.240 0.000 1 0 "[ . 1 . 2]" 1
1542 1 33 ASP QB 1 130 THR HA 5.010 . 5.010 4.809 4.502 5.031 0.021 11 0 "[ . 1 . 2]" 1
1543 1 52 VAL QG 1 54 TYR HA 5.200 . 5.200 3.863 3.554 4.515 . 0 0 "[ . 1 . 2]" 1
1544 1 134 PHE QB 1 138 ILE MD 4.190 . 4.190 2.925 2.609 3.216 . 0 0 "[ . 1 . 2]" 1
1545 1 34 LYS QD 1 129 TYR QD 4.660 . 4.660 3.158 2.244 4.292 . 0 0 "[ . 1 . 2]" 1
1546 1 5 LEU QD 1 71 TRP HD1 4.420 . 4.420 3.809 3.420 4.426 0.006 20 0 "[ . 1 . 2]" 1
1547 1 47 LYS H 1 48 ASP H 4.880 . 4.880 2.079 1.929 2.422 . 0 0 "[ . 1 . 2]" 1
1548 1 136 LYS HA 1 137 PRO QD 2.990 . 2.990 2.191 2.136 2.255 . 0 0 "[ . 1 . 2]" 1
1549 1 19 HIS H 1 19 HIS HD2 4.250 . 4.250 2.040 1.938 2.958 . 0 0 "[ . 1 . 2]" 1
1550 1 14 LEU H 1 15 GLU QB 4.770 . 4.770 3.921 3.605 4.363 . 0 0 "[ . 1 . 2]" 1
1551 1 136 LYS HA 1 137 PRO QG 4.940 . 4.940 4.120 4.061 4.184 . 0 0 "[ . 1 . 2]" 1
1552 1 83 LEU H 1 83 LEU QD 4.150 . 4.150 3.029 2.774 3.317 . 0 0 "[ . 1 . 2]" 1
1553 1 138 ILE MG 1 139 TYR HA 4.390 . 4.390 4.354 4.207 4.414 0.024 5 0 "[ . 1 . 2]" 1
1554 1 20 ASP H 1 21 ILE QG 5.500 . 5.500 2.812 2.176 4.084 . 0 0 "[ . 1 . 2]" 1
1555 1 77 TYR QD 1 83 LEU H 5.500 . 5.500 5.176 4.825 5.499 . 0 0 "[ . 1 . 2]" 1
1556 1 138 ILE HA 1 138 ILE MG 3.200 . 3.200 2.256 2.113 2.329 . 0 0 "[ . 1 . 2]" 1
1557 1 113 ILE MG 1 114 VAL QG 5.220 . 5.220 3.720 3.559 3.841 . 0 0 "[ . 1 . 2]" 1
1558 1 27 VAL QG 1 138 ILE MG 4.900 . 4.900 3.420 3.299 3.635 . 0 0 "[ . 1 . 2]" 1
1559 1 116 SER QB 1 126 ASN HA 3.480 . 3.480 2.447 1.926 3.212 . 0 0 "[ . 1 . 2]" 1
1560 1 8 ALA MB 1 9 ILE H 4.730 . 4.730 2.684 2.505 2.952 . 0 0 "[ . 1 . 2]" 1
1561 1 7 ASP H 1 9 ILE H 5.500 . 5.500 3.983 3.601 4.297 . 0 0 "[ . 1 . 2]" 1
1562 1 57 LYS HA 1 57 LYS QG 3.130 . 3.130 2.148 1.922 2.579 . 0 0 "[ . 1 . 2]" 1
1563 1 87 LEU QD 1 90 TYR QB 4.200 . 4.200 2.142 1.838 2.934 . 0 0 "[ . 1 . 2]" 1
1564 1 27 VAL QG 1 138 ILE HA 4.510 . 4.510 3.973 3.681 4.247 . 0 0 "[ . 1 . 2]" 1
1565 1 27 VAL H 1 27 VAL HB 3.750 . 3.750 2.583 2.398 2.712 . 0 0 "[ . 1 . 2]" 1
1566 1 6 LYS H 1 6 LYS QG 3.680 . 3.680 3.311 2.029 3.732 0.052 16 0 "[ . 1 . 2]" 1
1567 1 62 GLU HA 1 101 ARG QD 4.790 . 4.790 4.347 3.422 4.772 . 0 0 "[ . 1 . 2]" 1
1568 1 65 ILE HA 1 65 ILE MD 4.060 . 4.060 3.227 3.061 3.423 . 0 0 "[ . 1 . 2]" 1
1569 1 94 PRO QD 1 95 GLU H 3.780 . 3.780 2.952 2.920 2.995 . 0 0 "[ . 1 . 2]" 1
1570 1 77 TYR QD 1 82 LYS HA 3.970 . 3.970 3.681 3.288 4.008 0.038 12 0 "[ . 1 . 2]" 1
1571 1 140 ASN QD 1 141 ASP H 5.170 . 5.170 3.135 2.289 3.621 . 0 0 "[ . 1 . 2]" 1
1572 1 59 ALA H 1 140 ASN H 4.060 . 4.060 4.017 3.849 4.092 0.032 14 0 "[ . 1 . 2]" 1
1573 1 29 PHE QB 1 132 LEU HG 4.490 . 4.490 2.355 2.140 2.618 . 0 0 "[ . 1 . 2]" 1
1574 1 81 GLN QB 1 83 LEU H 5.500 . 5.500 4.932 4.273 5.485 . 0 0 "[ . 1 . 2]" 1
1575 1 60 GLU H 1 61 VAL H 5.090 . 5.090 3.945 3.719 4.418 . 0 0 "[ . 1 . 2]" 1
1576 1 34 LYS HA 1 129 TYR QE 3.260 . 3.260 2.098 1.934 2.529 . 0 0 "[ . 1 . 2]" 1
1577 1 59 ALA MB 1 104 VAL QG 4.090 . 4.090 1.830 1.748 1.920 0.052 10 0 "[ . 1 . 2]" 1
1578 1 17 LYS QB 1 19 HIS H 4.290 . 4.290 3.806 2.194 4.226 . 0 0 "[ . 1 . 2]" 1
1579 1 125 THR HA 1 126 ASN H 3.370 . 3.370 2.289 2.215 2.380 . 0 0 "[ . 1 . 2]" 1
1580 1 109 GLN HA 1 134 PHE QB 3.930 . 3.930 2.112 1.936 2.313 . 0 0 "[ . 1 . 2]" 1
1581 1 29 PHE HA 1 30 GLN H 3.380 . 3.380 2.242 2.219 2.280 . 0 0 "[ . 1 . 2]" 1
1582 1 124 GLU HA 1 124 GLU QG 3.610 . 3.610 2.469 2.277 2.823 . 0 0 "[ . 1 . 2]" 1
1583 1 84 PRO HA 1 85 VAL H 2.950 . 2.950 2.269 2.217 2.392 . 0 0 "[ . 1 . 2]" 1
1584 1 16 ASN QD 1 92 PRO QG 5.280 . 5.280 3.716 2.400 4.545 . 0 0 "[ . 1 . 2]" 1
1585 1 98 ALA H 1 99 TYR HA 5.500 . 5.500 4.993 4.904 5.034 . 0 0 "[ . 1 . 2]" 1
1586 1 18 GLU HA 1 18 GLU QG 3.310 . 3.310 2.469 1.972 3.327 0.017 7 0 "[ . 1 . 2]" 1
1587 1 29 PHE HA 1 134 PHE HA 3.400 . 3.400 2.197 2.050 2.313 . 0 0 "[ . 1 . 2]" 1
1588 1 5 LEU QB 1 7 ASP H 5.500 . 5.500 4.622 4.370 4.909 . 0 0 "[ . 1 . 2]" 1
1589 1 29 PHE QD 1 49 PRO HA 4.880 . 4.880 3.403 3.323 3.534 . 0 0 "[ . 1 . 2]" 1
1590 1 29 PHE H 1 50 ALA H 5.020 . 5.020 4.138 3.701 4.592 . 0 0 "[ . 1 . 2]" 1
1591 1 90 TYR QB 1 98 ALA HA 4.710 . 4.710 2.604 2.364 3.512 . 0 0 "[ . 1 . 2]" 1
1592 1 34 LYS HA 1 36 ASN H 4.610 . 4.610 3.901 3.763 4.069 . 0 0 "[ . 1 . 2]" 1
1593 1 21 ILE H 1 22 GLY H 4.490 . 4.490 4.186 3.638 4.515 0.025 2 0 "[ . 1 . 2]" 1
1594 1 30 GLN HA 1 32 LEU HG 4.440 . 4.440 4.462 4.412 4.503 0.063 1 0 "[ . 1 . 2]" 1
1595 1 57 LYS H 1 57 LYS QG 4.710 . 4.710 3.016 2.552 3.857 . 0 0 "[ . 1 . 2]" 1
1596 1 138 ILE HA 1 138 ILE QG 3.660 . 3.660 3.103 3.035 3.156 . 0 0 "[ . 1 . 2]" 1
1597 1 65 ILE MG 1 71 TRP HZ2 4.660 . 4.660 4.088 3.758 4.592 . 0 0 "[ . 1 . 2]" 1
1598 1 29 PHE H 1 29 PHE HZ 5.500 . 5.500 4.800 4.703 5.007 . 0 0 "[ . 1 . 2]" 1
1599 1 77 TYR HA 1 78 GLU H 3.090 . 3.090 2.226 2.201 2.325 . 0 0 "[ . 1 . 2]" 1
1600 1 37 GLU HA 1 37 GLU QG 3.440 . 3.440 2.334 1.931 3.298 . 0 0 "[ . 1 . 2]" 1
1601 1 89 SER QB 1 99 TYR QD 4.080 . 4.080 2.977 2.043 3.903 . 0 0 "[ . 1 . 2]" 1
1602 1 117 THR H 1 124 GLU QG 5.500 . 5.500 4.343 3.646 4.838 . 0 0 "[ . 1 . 2]" 1
1603 1 76 VAL QG 1 112 LYS H 5.050 . 5.050 3.462 2.671 4.439 . 0 0 "[ . 1 . 2]" 1
1604 1 65 ILE HB 1 100 ILE MG 4.320 . 4.320 4.129 3.937 4.335 0.015 3 0 "[ . 1 . 2]" 1
1605 1 26 GLN H 1 27 VAL H 4.400 . 4.400 4.370 4.209 4.466 0.066 16 0 "[ . 1 . 2]" 1
1606 1 85 VAL HA 1 102 PHE HA 4.010 . 4.010 3.598 3.166 3.939 . 0 0 "[ . 1 . 2]" 1
1607 1 53 TYR H 1 54 TYR H 5.500 . 5.500 3.928 3.771 4.072 . 0 0 "[ . 1 . 2]" 1
1608 1 108 THR MG 1 134 PHE QE 4.300 . 4.300 3.201 2.828 3.510 . 0 0 "[ . 1 . 2]" 1
1609 1 77 TYR QD 1 81 GLN HA 4.420 . 4.420 4.078 3.717 4.442 0.022 11 0 "[ . 1 . 2]" 1
1610 1 139 TYR QD 1 140 ASN H 4.470 . 4.470 3.400 3.097 3.641 . 0 0 "[ . 1 . 2]" 1
1611 1 139 TYR H 1 139 TYR QB 3.610 . 3.610 2.132 2.076 2.235 . 0 0 "[ . 1 . 2]" 1
1612 1 121 ASP HA 1 121 ASP QB 2.620 . 2.620 2.441 2.198 2.550 . 0 0 "[ . 1 . 2]" 1
1613 1 50 ALA H 1 51 ASP H 4.650 . 4.650 4.573 3.978 4.691 0.041 5 0 "[ . 1 . 2]" 1
1614 1 140 ASN QB 1 141 ASP H 5.140 . 5.140 2.961 2.170 3.697 . 0 0 "[ . 1 . 2]" 1
1615 1 90 TYR QE 1 98 ALA MB 4.190 . 4.190 3.431 3.294 3.847 . 0 0 "[ . 1 . 2]" 1
1616 1 106 ASP QB 1 139 TYR QE 4.610 . 4.610 4.542 4.061 4.636 0.026 10 0 "[ . 1 . 2]" 1
1617 1 90 TYR HA 1 99 TYR QB 4.850 . 4.850 4.078 3.860 4.163 . 0 0 "[ . 1 . 2]" 1
1618 1 53 TYR QB 1 60 GLU QB 4.850 . 4.850 1.958 1.849 2.130 . 0 0 "[ . 1 . 2]" 1
1619 1 103 PRO QG 1 104 VAL H 5.500 . 5.500 4.362 4.208 4.526 . 0 0 "[ . 1 . 2]" 1
1620 1 29 PHE HA 1 132 LEU HG 4.740 . 4.740 3.999 3.787 4.550 . 0 0 "[ . 1 . 2]" 1
1621 1 11 ASP HA 1 13 ALA MB 5.160 . 5.160 5.020 4.787 5.171 0.011 13 0 "[ . 1 . 2]" 1
1622 1 77 TYR H 1 82 LYS HA 5.500 . 5.500 4.384 4.074 4.646 . 0 0 "[ . 1 . 2]" 1
1623 1 138 ILE H 1 138 ILE MG 4.570 . 4.570 3.742 3.724 3.763 . 0 0 "[ . 1 . 2]" 1
1624 1 63 LEU QB 1 65 ILE MD 4.580 . 4.580 2.729 2.294 3.586 . 0 0 "[ . 1 . 2]" 1
1625 1 10 LYS HA 1 10 LYS QG 3.200 . 3.200 2.554 2.136 2.919 . 0 0 "[ . 1 . 2]" 1
1626 1 134 PHE QD 1 138 ILE MD 3.870 . 3.870 3.497 3.179 3.732 . 0 0 "[ . 1 . 2]" 1
1627 1 68 ALA H 1 71 TRP HE1 5.500 . 5.500 5.203 4.769 5.514 0.014 13 0 "[ . 1 . 2]" 1
1628 1 46 ILE HA 1 47 LYS H 3.400 . 3.400 2.433 2.273 2.631 . 0 0 "[ . 1 . 2]" 1
1629 1 139 TYR H 1 139 TYR QD 4.080 . 4.080 3.246 3.088 3.598 . 0 0 "[ . 1 . 2]" 1
1630 1 12 PRO QB 1 13 ALA H 4.060 . 4.060 3.290 3.146 3.461 . 0 0 "[ . 1 . 2]" 1
1631 1 108 THR H 1 108 THR HB 3.030 . 3.030 2.595 2.511 2.693 . 0 0 "[ . 1 . 2]" 1
1632 1 46 ILE MG 1 63 LEU QD 3.340 . 3.340 2.296 1.800 3.335 0.000 18 0 "[ . 1 . 2]" 1
1633 1 66 ASN HA 1 97 HIS HD2 4.620 . 4.620 4.554 4.418 4.645 0.025 10 0 "[ . 1 . 2]" 1
1634 1 138 ILE H 1 138 ILE MD 4.660 . 4.660 2.874 2.568 3.175 . 0 0 "[ . 1 . 2]" 1
1635 1 76 VAL QG 1 113 ILE HA 3.890 . 3.890 2.419 2.089 2.865 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 66
_Distance_constraint_stats_list.Viol_count 68
_Distance_constraint_stats_list.Viol_total 18.949
_Distance_constraint_stats_list.Viol_max 0.059
_Distance_constraint_stats_list.Viol_rms 0.0042
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0007
_Distance_constraint_stats_list.Viol_average_violations_only 0.0139
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 4 SER 0.059 0.029 1 0 "[ . 1 . 2]"
1 5 LEU 0.040 0.017 2 0 "[ . 1 . 2]"
1 8 ALA 0.059 0.029 1 0 "[ . 1 . 2]"
1 9 ILE 0.040 0.017 2 0 "[ . 1 . 2]"
1 25 GLU 0.053 0.017 3 0 "[ . 1 . 2]"
1 27 VAL 0.051 0.051 4 0 "[ . 1 . 2]"
1 30 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 LEU 0.033 0.013 14 0 "[ . 1 . 2]"
1 50 ALA 0.051 0.051 4 0 "[ . 1 . 2]"
1 51 ASP 0.012 0.012 18 0 "[ . 1 . 2]"
1 52 VAL 0.053 0.017 3 0 "[ . 1 . 2]"
1 53 TYR 0.092 0.027 14 0 "[ . 1 . 2]"
1 60 GLU 0.092 0.027 14 0 "[ . 1 . 2]"
1 61 VAL 0.032 0.024 9 0 "[ . 1 . 2]"
1 62 GLU 0.012 0.012 18 0 "[ . 1 . 2]"
1 63 LEU 0.382 0.059 6 0 "[ . 1 . 2]"
1 65 ILE 0.084 0.033 11 0 "[ . 1 . 2]"
1 67 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 ALA 0.084 0.033 11 0 "[ . 1 . 2]"
1 99 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 ILE 0.382 0.059 6 0 "[ . 1 . 2]"
1 102 PHE 0.032 0.024 9 0 "[ . 1 . 2]"
1 105 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 LEU 0.020 0.020 5 0 "[ . 1 . 2]"
1 112 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 ILE 0.045 0.014 6 0 "[ . 1 . 2]"
1 117 THR 0.045 0.011 7 0 "[ . 1 . 2]"
1 125 THR 0.045 0.011 7 0 "[ . 1 . 2]"
1 130 THR 0.045 0.014 6 0 "[ . 1 . 2]"
1 131 LYS 0.033 0.013 14 0 "[ . 1 . 2]"
1 132 LEU 0.020 0.020 5 0 "[ . 1 . 2]"
1 133 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 134 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 27 VAL O 1 50 ALA N 3.300 2.300 3.500 2.592 2.515 2.813 . 0 0 "[ . 1 . 2]" 2
2 1 27 VAL O 1 50 ALA H 2.300 . 2.500 2.202 1.863 2.444 . 0 0 "[ . 1 . 2]" 2
3 1 27 VAL N 1 50 ALA O 3.300 2.300 3.500 2.684 2.521 3.276 . 0 0 "[ . 1 . 2]" 2
4 1 27 VAL H 1 50 ALA O 2.300 . 2.500 1.838 1.548 2.551 0.051 4 0 "[ . 1 . 2]" 2
5 1 30 GLN O 1 133 VAL N 3.300 2.300 3.500 3.046 2.856 3.246 . 0 0 "[ . 1 . 2]" 2
6 1 30 GLN O 1 133 VAL H 2.300 . 2.500 2.192 1.960 2.384 . 0 0 "[ . 1 . 2]" 2
7 1 30 GLN N 1 133 VAL O 3.300 2.300 3.500 2.764 2.603 2.910 . 0 0 "[ . 1 . 2]" 2
8 1 30 GLN H 1 133 VAL O 2.300 . 2.500 1.827 1.640 1.977 . 0 0 "[ . 1 . 2]" 2
9 1 32 LEU O 1 131 LYS N 3.300 2.300 3.500 3.083 2.870 3.303 . 0 0 "[ . 1 . 2]" 2
10 1 32 LEU O 1 131 LYS H 2.300 . 2.500 2.344 2.130 2.513 0.013 14 0 "[ . 1 . 2]" 2
11 1 32 LEU N 1 131 LYS O 3.300 2.300 3.500 3.185 3.037 3.307 . 0 0 "[ . 1 . 2]" 2
12 1 32 LEU H 1 131 LYS O 2.300 . 2.500 2.383 2.240 2.502 0.002 20 0 "[ . 1 . 2]" 2
13 1 61 VAL O 1 102 PHE N 3.300 2.300 3.500 3.081 2.802 3.331 . 0 0 "[ . 1 . 2]" 2
14 1 61 VAL O 1 102 PHE H 2.300 . 2.500 2.276 1.940 2.524 0.024 9 0 "[ . 1 . 2]" 2
15 1 61 VAL N 1 102 PHE O 3.300 2.300 3.500 3.063 2.894 3.234 . 0 0 "[ . 1 . 2]" 2
16 1 61 VAL H 1 102 PHE O 2.300 . 2.500 2.272 2.076 2.505 0.005 9 0 "[ . 1 . 2]" 2
17 1 63 LEU O 1 100 ILE N 3.300 2.300 3.500 3.410 3.148 3.504 0.004 10 0 "[ . 1 . 2]" 2
18 1 63 LEU O 1 100 ILE H 2.300 . 2.500 2.471 2.302 2.559 0.059 6 0 "[ . 1 . 2]" 2
19 1 63 LEU N 1 100 ILE O 3.300 2.300 3.500 3.001 2.730 3.416 . 0 0 "[ . 1 . 2]" 2
20 1 63 LEU H 1 100 ILE O 2.300 . 2.500 2.105 1.799 2.533 0.033 4 0 "[ . 1 . 2]" 2
21 1 65 ILE O 1 98 ALA N 3.300 2.300 3.500 3.097 2.675 3.279 . 0 0 "[ . 1 . 2]" 2
22 1 65 ILE O 1 98 ALA H 2.300 . 2.500 2.296 1.806 2.533 0.033 11 0 "[ . 1 . 2]" 2
23 1 65 ILE N 1 98 ALA O 3.300 2.300 3.500 2.974 2.752 3.333 . 0 0 "[ . 1 . 2]" 2
24 1 65 ILE H 1 98 ALA O 2.300 . 2.500 2.170 1.795 2.497 . 0 0 "[ . 1 . 2]" 2
25 1 77 TYR N 1 112 LYS O 3.300 2.300 3.500 2.925 2.533 3.195 . 0 0 "[ . 1 . 2]" 2
26 1 77 TYR H 1 112 LYS O 2.300 . 2.500 2.055 1.588 2.458 . 0 0 "[ . 1 . 2]" 2
27 1 77 TYR O 1 112 LYS N 3.300 2.300 3.500 2.918 2.572 3.313 . 0 0 "[ . 1 . 2]" 2
28 1 77 TYR O 1 112 LYS H 2.300 . 2.500 1.990 1.639 2.397 . 0 0 "[ . 1 . 2]" 2
29 1 89 SER O 1 99 TYR N 3.300 2.300 3.500 2.757 2.609 3.172 . 0 0 "[ . 1 . 2]" 2
30 1 89 SER O 1 99 TYR H 2.300 . 2.500 1.924 1.692 2.491 . 0 0 "[ . 1 . 2]" 2
31 1 53 TYR O 1 60 GLU N 3.300 2.300 3.500 3.051 2.905 3.220 . 0 0 "[ . 1 . 2]" 2
32 1 53 TYR O 1 60 GLU H 2.300 . 2.500 2.452 2.207 2.527 0.027 14 0 "[ . 1 . 2]" 2
33 1 53 TYR N 1 60 GLU O 3.300 2.300 3.500 2.675 2.526 2.922 . 0 0 "[ . 1 . 2]" 2
34 1 53 TYR H 1 60 GLU O 2.300 . 2.500 1.842 1.558 2.261 . 0 0 "[ . 1 . 2]" 2
35 1 51 ASP O 1 62 GLU N 3.300 2.300 3.500 2.681 2.518 3.130 . 0 0 "[ . 1 . 2]" 2
36 1 51 ASP O 1 62 GLU H 2.300 . 2.500 1.840 1.577 2.241 . 0 0 "[ . 1 . 2]" 2
37 1 51 ASP N 1 62 GLU O 3.300 2.300 3.500 2.894 2.648 3.153 . 0 0 "[ . 1 . 2]" 2
38 1 51 ASP H 1 62 GLU O 2.300 . 2.500 2.049 1.769 2.512 0.012 18 0 "[ . 1 . 2]" 2
39 1 25 GLU N 1 52 VAL O 3.300 2.300 3.500 2.882 2.547 3.165 . 0 0 "[ . 1 . 2]" 2
40 1 25 GLU H 1 52 VAL O 2.300 . 2.500 2.177 1.647 2.512 0.012 14 0 "[ . 1 . 2]" 2
41 1 25 GLU O 1 52 VAL N 3.300 2.300 3.500 3.171 2.957 3.363 . 0 0 "[ . 1 . 2]" 2
42 1 25 GLU O 1 52 VAL H 2.300 . 2.500 2.359 2.148 2.517 0.017 3 0 "[ . 1 . 2]" 2
43 1 111 LEU O 1 132 LEU N 3.300 2.300 3.500 3.067 2.781 3.367 . 0 0 "[ . 1 . 2]" 2
44 1 111 LEU O 1 132 LEU H 2.300 . 2.500 2.167 1.905 2.486 . 0 0 "[ . 1 . 2]" 2
45 1 111 LEU N 1 132 LEU O 3.300 2.300 3.500 3.226 2.972 3.477 . 0 0 "[ . 1 . 2]" 2
46 1 111 LEU H 1 132 LEU O 2.300 . 2.500 2.267 2.021 2.520 0.020 5 0 "[ . 1 . 2]" 2
47 1 117 THR O 1 125 THR N 3.300 2.300 3.500 3.062 2.745 3.224 . 0 0 "[ . 1 . 2]" 2
48 1 117 THR O 1 125 THR H 2.300 . 2.500 2.365 2.091 2.511 0.011 7 0 "[ . 1 . 2]" 2
49 1 117 THR N 1 125 THR O 3.300 2.300 3.500 2.960 2.625 3.189 . 0 0 "[ . 1 . 2]" 2
50 1 117 THR H 1 125 THR O 2.300 . 2.500 2.225 1.689 2.511 0.011 16 0 "[ . 1 . 2]" 2
51 1 109 GLN O 1 134 PHE N 3.300 2.300 3.500 2.579 2.517 2.707 . 0 0 "[ . 1 . 2]" 2
52 1 109 GLN O 1 134 PHE H 2.300 . 2.500 1.827 1.559 2.046 . 0 0 "[ . 1 . 2]" 2
53 1 113 ILE O 1 130 THR N 3.300 2.300 3.500 3.258 3.120 3.347 . 0 0 "[ . 1 . 2]" 2
54 1 113 ILE O 1 130 THR H 2.300 . 2.500 2.459 2.290 2.514 0.014 6 0 "[ . 1 . 2]" 2
55 1 113 ILE N 1 130 THR O 3.300 2.300 3.500 2.877 2.586 3.106 . 0 0 "[ . 1 . 2]" 2
56 1 113 ILE H 1 130 THR O 2.300 . 2.500 2.011 1.647 2.301 . 0 0 "[ . 1 . 2]" 2
57 1 5 LEU O 1 9 ILE H 2.300 . 2.500 2.384 2.093 2.517 0.017 2 0 "[ . 1 . 2]" 2
58 1 5 LEU O 1 9 ILE N 3.300 2.500 3.500 3.280 3.010 3.445 . 0 0 "[ . 1 . 2]" 2
59 1 4 SER O 1 8 ALA H 2.300 . 2.500 2.188 1.786 2.529 0.029 1 0 "[ . 1 . 2]" 2
60 1 4 SER O 1 8 ALA N 3.300 2.500 3.500 2.911 2.607 3.269 . 0 0 "[ . 1 . 2]" 2
61 1 76 VAL O 1 83 LEU N 3.300 2.300 3.500 2.742 2.563 2.932 . 0 0 "[ . 1 . 2]" 2
62 1 76 VAL O 1 83 LEU H 2.300 . 2.500 2.000 1.689 2.369 . 0 0 "[ . 1 . 2]" 2
63 1 105 SER O 1 108 THR N 3.300 2.300 3.500 3.150 2.825 3.266 . 0 0 "[ . 1 . 2]" 2
64 1 105 SER O 1 108 THR H 2.300 . 2.500 2.307 1.930 2.475 . 0 0 "[ . 1 . 2]" 2
65 1 67 THR O 1 70 THR N 3.300 2.300 3.500 2.861 2.591 3.187 . 0 0 "[ . 1 . 2]" 2
66 1 67 THR O 1 70 THR H 2.300 . 2.500 1.920 1.633 2.297 . 0 0 "[ . 1 . 2]" 2
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