NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
444967 |
2kii   |
16276 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kii
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 2771
_Distance_constraint_stats_list.Viol_count 6951
_Distance_constraint_stats_list.Viol_total 7171.450
_Distance_constraint_stats_list.Viol_max 0.298
_Distance_constraint_stats_list.Viol_rms 0.0227
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0065
_Distance_constraint_stats_list.Viol_average_violations_only 0.0516
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 GLY 4.676 0.197 13 0 "[ . 1 . 2]"
1 4 ILE 1.404 0.073 13 0 "[ . 1 . 2]"
1 5 ILE 1.991 0.074 10 0 "[ . 1 . 2]"
1 6 PHE 2.258 0.074 10 0 "[ . 1 . 2]"
1 7 ASN 0.455 0.063 14 0 "[ . 1 . 2]"
1 8 VAL 10.862 0.134 20 0 "[ . 1 . 2]"
1 9 LEU 8.591 0.197 7 0 "[ . 1 . 2]"
1 10 GLU 3.212 0.125 8 0 "[ . 1 . 2]"
1 11 ASP 5.878 0.174 12 0 "[ . 1 . 2]"
1 12 MET 3.939 0.167 2 0 "[ . 1 . 2]"
1 13 VAL 15.822 0.197 7 0 "[ . 1 . 2]"
1 14 VAL 3.238 0.058 13 0 "[ . 1 . 2]"
1 15 ALA 4.014 0.077 20 0 "[ . 1 . 2]"
1 16 GLN 5.993 0.128 18 0 "[ . 1 . 2]"
1 17 CYS 3.989 0.090 14 0 "[ . 1 . 2]"
1 18 GLY 0.097 0.038 13 0 "[ . 1 . 2]"
1 19 MET 3.522 0.222 11 0 "[ . 1 . 2]"
1 20 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 VAL 5.930 0.171 20 0 "[ . 1 . 2]"
1 22 TRP 16.775 0.196 20 0 "[ . 1 . 2]"
1 23 ASN 0.848 0.071 9 0 "[ . 1 . 2]"
1 24 GLU 10.983 0.242 12 0 "[ . 1 . 2]"
1 25 LEU 6.677 0.130 10 0 "[ . 1 . 2]"
1 26 LEU 5.323 0.242 12 0 "[ . 1 . 2]"
1 27 GLU 1.314 0.092 5 0 "[ . 1 . 2]"
1 28 LYS 0.505 0.045 16 0 "[ . 1 . 2]"
1 29 HIS 0.216 0.045 16 0 "[ . 1 . 2]"
1 30 ALA 2.073 0.170 11 0 "[ . 1 . 2]"
1 31 PRO 0.379 0.042 18 0 "[ . 1 . 2]"
1 32 LYS 2.127 0.124 10 0 "[ . 1 . 2]"
1 33 ASP 0.785 0.069 3 0 "[ . 1 . 2]"
1 34 ARG 0.782 0.105 7 0 "[ . 1 . 2]"
1 35 VAL 3.950 0.216 5 0 "[ . 1 . 2]"
1 36 TYR 3.097 0.149 5 0 "[ . 1 . 2]"
1 37 VAL 5.372 0.216 5 0 "[ . 1 . 2]"
1 38 SER 1.075 0.073 13 0 "[ . 1 . 2]"
1 39 ALA 0.716 0.096 5 0 "[ . 1 . 2]"
1 40 LYS 4.477 0.137 5 0 "[ . 1 . 2]"
1 41 SER 0.353 0.050 15 0 "[ . 1 . 2]"
1 42 TYR 0.145 0.122 20 0 "[ . 1 . 2]"
1 43 ALA 0.507 0.122 20 0 "[ . 1 . 2]"
1 44 GLU 0.107 0.073 6 0 "[ . 1 . 2]"
1 45 SER 0.223 0.095 16 0 "[ . 1 . 2]"
1 46 GLU 1.562 0.170 11 0 "[ . 1 . 2]"
1 47 LEU 4.499 0.086 17 0 "[ . 1 . 2]"
1 48 PHE 0.500 0.058 17 0 "[ . 1 . 2]"
1 49 SER 0.323 0.093 15 0 "[ . 1 . 2]"
1 50 ILE 2.890 0.073 20 0 "[ . 1 . 2]"
1 51 VAL 7.889 0.102 18 0 "[ . 1 . 2]"
1 52 GLN 2.208 0.058 5 0 "[ . 1 . 2]"
1 53 ASP 3.586 0.136 15 0 "[ . 1 . 2]"
1 54 VAL 6.437 0.122 10 0 "[ . 1 . 2]"
1 55 ALA 10.868 0.128 2 0 "[ . 1 . 2]"
1 56 GLN 2.451 0.124 18 0 "[ . 1 . 2]"
1 57 ARG 8.285 0.158 18 0 "[ . 1 . 2]"
1 58 LEU 8.287 0.128 18 0 "[ . 1 . 2]"
1 59 ASN 2.785 0.144 8 0 "[ . 1 . 2]"
1 60 MET 8.358 0.144 8 0 "[ . 1 . 2]"
1 61 PRO 6.966 0.134 1 0 "[ . 1 . 2]"
1 62 ILE 5.143 0.103 3 0 "[ . 1 . 2]"
1 63 GLN 4.706 0.147 14 0 "[ . 1 . 2]"
1 64 ASP 10.190 0.147 14 0 "[ . 1 . 2]"
1 65 VAL 12.341 0.118 11 0 "[ . 1 . 2]"
1 66 VAL 5.208 0.130 14 0 "[ . 1 . 2]"
1 67 LYS 3.277 0.081 14 0 "[ . 1 . 2]"
1 68 ALA 3.727 0.114 3 0 "[ . 1 . 2]"
1 69 PHE 5.818 0.098 11 0 "[ . 1 . 2]"
1 70 GLY 1.077 0.083 18 0 "[ . 1 . 2]"
1 71 GLN 4.033 0.110 12 0 "[ . 1 . 2]"
1 72 PHE 3.308 0.100 15 0 "[ . 1 . 2]"
1 73 LEU 5.730 0.134 20 0 "[ . 1 . 2]"
1 74 PHE 5.860 0.120 18 0 "[ . 1 . 2]"
1 75 ASN 4.339 0.107 5 0 "[ . 1 . 2]"
1 76 GLY 1.389 0.104 20 0 "[ . 1 . 2]"
1 77 LEU 4.598 0.158 8 0 "[ . 1 . 2]"
1 78 ALA 4.783 0.107 5 0 "[ . 1 . 2]"
1 79 SER 1.347 0.117 16 0 "[ . 1 . 2]"
1 80 ARG 2.637 0.154 4 0 "[ . 1 . 2]"
1 81 HIS 2.070 0.154 4 0 "[ . 1 . 2]"
1 82 THR 4.505 0.144 17 0 "[ . 1 . 2]"
1 83 ASP 2.182 0.140 17 0 "[ . 1 . 2]"
1 84 VAL 4.749 0.100 7 0 "[ . 1 . 2]"
1 85 VAL 7.739 0.254 14 0 "[ . 1 . 2]"
1 86 ASP 1.198 0.130 2 0 "[ . 1 . 2]"
1 87 LYS 4.293 0.134 15 0 "[ . 1 . 2]"
1 88 PHE 6.371 0.254 14 0 "[ . 1 . 2]"
1 89 ASP 3.777 0.298 9 0 "[ . 1 . 2]"
1 90 ASP 3.122 0.298 9 0 "[ . 1 . 2]"
1 91 PHE 6.699 0.150 18 0 "[ . 1 . 2]"
1 92 THR 2.348 0.102 2 0 "[ . 1 . 2]"
1 93 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 LEU 3.955 0.124 16 0 "[ . 1 . 2]"
1 95 VAL 7.807 0.121 7 0 "[ . 1 . 2]"
1 96 MET 1.476 0.079 15 0 "[ . 1 . 2]"
1 97 GLY 9.897 0.159 3 0 "[ . 1 . 2]"
1 98 ILE 4.997 0.152 15 0 "[ . 1 . 2]"
1 99 HIS 3.886 0.160 18 0 "[ . 1 . 2]"
1 100 ASP 0.027 0.013 3 0 "[ . 1 . 2]"
1 101 VAL 12.007 0.212 14 0 "[ . 1 . 2]"
1 102 ILE 10.847 0.212 14 0 "[ . 1 . 2]"
1 103 HIS 2.116 0.160 18 0 "[ . 1 . 2]"
1 104 LEU 1.830 0.107 12 0 "[ . 1 . 2]"
1 105 GLU 2.590 0.104 11 0 "[ . 1 . 2]"
1 106 VAL 2.869 0.132 10 0 "[ . 1 . 2]"
1 107 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 LYS 3.172 0.224 3 0 "[ . 1 . 2]"
1 109 LEU 3.279 0.132 10 0 "[ . 1 . 2]"
1 115 LEU 1.401 0.112 17 0 "[ . 1 . 2]"
1 117 HIS 0.372 0.049 14 0 "[ . 1 . 2]"
1 119 ASN 1.650 0.124 13 0 "[ . 1 . 2]"
1 120 GLY 9.315 0.185 7 0 "[ . 1 . 2]"
1 121 GLN 6.722 0.160 1 0 "[ . 1 . 2]"
1 122 LEU 6.483 0.170 2 0 "[ . 1 . 2]"
1 123 LEU 9.967 0.177 12 0 "[ . 1 . 2]"
1 124 PRO 0.728 0.068 9 0 "[ . 1 . 2]"
1 125 ASN 1.551 0.186 19 0 "[ . 1 . 2]"
1 126 ASN 4.236 0.263 12 0 "[ . 1 . 2]"
1 127 GLN 5.338 0.263 12 0 "[ . 1 . 2]"
1 128 ILE 7.106 0.134 16 0 "[ . 1 . 2]"
1 129 ALA 11.497 0.196 15 0 "[ . 1 . 2]"
1 130 LEU 17.009 0.251 8 0 "[ . 1 . 2]"
1 131 ARG 6.593 0.160 1 0 "[ . 1 . 2]"
1 132 TYR 0.058 0.020 5 0 "[ . 1 . 2]"
1 133 SER 3.068 0.157 3 0 "[ . 1 . 2]"
1 134 SER 0.010 0.010 6 0 "[ . 1 . 2]"
1 135 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 136 ARG 0.010 0.010 6 0 "[ . 1 . 2]"
1 137 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 138 LEU 0.175 0.158 7 0 "[ . 1 . 2]"
1 139 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 140 PHE 5.681 0.149 17 0 "[ . 1 . 2]"
1 141 CYS 0.787 0.158 7 0 "[ . 1 . 2]"
1 142 ALA 2.921 0.215 17 0 "[ . 1 . 2]"
1 143 GLU 5.649 0.129 14 0 "[ . 1 . 2]"
1 144 GLY 0.024 0.022 8 0 "[ . 1 . 2]"
1 145 LEU 6.672 0.215 17 0 "[ . 1 . 2]"
1 146 LEU 2.488 0.110 17 0 "[ . 1 . 2]"
1 147 PHE 1.899 0.079 15 0 "[ . 1 . 2]"
1 148 GLY 0.877 0.115 18 0 "[ . 1 . 2]"
1 149 ALA 0.491 0.081 18 0 "[ . 1 . 2]"
1 150 ALA 1.127 0.082 2 0 "[ . 1 . 2]"
1 151 GLN 0.689 0.133 1 0 "[ . 1 . 2]"
1 152 HIS 1.171 0.115 18 0 "[ . 1 . 2]"
1 153 PHE 3.552 0.224 18 0 "[ . 1 . 2]"
1 154 GLN 0.736 0.255 4 0 "[ . 1 . 2]"
1 155 GLN 6.505 0.155 18 0 "[ . 1 . 2]"
1 156 LYS 2.255 0.240 7 0 "[ . 1 . 2]"
1 157 ILE 7.193 0.097 18 0 "[ . 1 . 2]"
1 158 GLN 2.017 0.092 18 0 "[ . 1 . 2]"
1 159 ILE 7.575 0.127 12 0 "[ . 1 . 2]"
1 160 SER 4.647 0.154 7 0 "[ . 1 . 2]"
1 161 HIS 2.584 0.114 12 0 "[ . 1 . 2]"
1 162 ASP 1.891 0.120 15 0 "[ . 1 . 2]"
1 163 THR 7.739 0.152 9 0 "[ . 1 . 2]"
1 164 CYS 0.438 0.079 8 0 "[ . 1 . 2]"
1 165 MET 0.705 0.115 9 0 "[ . 1 . 2]"
1 166 HIS 0.607 0.061 10 0 "[ . 1 . 2]"
1 167 THR 2.063 0.101 9 0 "[ . 1 . 2]"
1 168 GLY 0.544 0.056 15 0 "[ . 1 . 2]"
1 169 ALA 2.583 0.152 9 0 "[ . 1 . 2]"
1 170 ASP 0.820 0.085 11 0 "[ . 1 . 2]"
1 171 HIS 1.014 0.157 3 0 "[ . 1 . 2]"
1 172 CYS 1.178 0.191 9 0 "[ . 1 . 2]"
1 173 MET 2.866 0.076 2 0 "[ . 1 . 2]"
1 174 LEU 7.071 0.191 9 0 "[ . 1 . 2]"
1 175 ILE 8.643 0.196 15 0 "[ . 1 . 2]"
1 176 ILE 11.119 0.230 19 0 "[ . 1 . 2]"
1 177 GLU 2.481 0.146 19 0 "[ . 1 . 2]"
1 178 LEU 5.507 0.119 6 0 "[ . 1 . 2]"
1 179 GLN 0.967 0.058 13 0 "[ . 1 . 2]"
1 180 ASN 0.756 0.081 16 0 "[ . 1 . 2]"
1 181 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 1 HEM 2.245 0.158 8 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 86 ASP HA 1 88 PHE QE 4.520 . 4.520 2.779 2.474 3.209 . 0 0 "[ . 1 . 2]" 1
2 1 87 LYS H 1 88 PHE H 3.350 . 3.350 2.506 2.392 2.608 . 0 0 "[ . 1 . 2]" 1
3 1 87 LYS H 1 88 PHE QD 5.500 . 5.500 3.688 3.513 3.885 . 0 0 "[ . 1 . 2]" 1
4 1 85 VAL QG 1 88 PHE QD 3.620 . 3.620 2.992 2.024 3.315 . 0 0 "[ . 1 . 2]" 1
5 1 88 PHE H 1 89 ASP H 4.280 . 4.280 2.532 2.262 3.412 . 0 0 "[ . 1 . 2]" 1
6 1 87 LYS HA 1 88 PHE HA 5.410 . 5.410 4.700 4.655 4.804 . 0 0 "[ . 1 . 2]" 1
7 1 88 PHE QE 1 89 ASP HA 4.400 . 4.400 3.732 3.386 4.496 0.096 8 0 "[ . 1 . 2]" 1
8 1 86 ASP HA 1 88 PHE QD 3.950 . 3.950 2.756 2.569 2.972 . 0 0 "[ . 1 . 2]" 1
9 1 85 VAL HA 1 88 PHE QD 5.000 . 5.000 4.284 3.674 4.470 . 0 0 "[ . 1 . 2]" 1
10 1 86 ASP H 1 88 PHE QD 4.880 . 4.880 4.444 3.915 4.630 . 0 0 "[ . 1 . 2]" 1
11 1 87 LYS H 1 88 PHE QE 5.500 . 5.500 5.335 4.941 5.557 0.057 9 0 "[ . 1 . 2]" 1
12 1 87 LYS QB 1 88 PHE H 3.960 . 3.960 3.229 3.138 3.337 . 0 0 "[ . 1 . 2]" 1
13 1 88 PHE QB 1 89 ASP H 4.130 . 4.130 3.666 3.431 4.095 . 0 0 "[ . 1 . 2]" 1
14 1 88 PHE H 1 88 PHE QE 5.000 . 5.000 4.126 3.865 4.399 . 0 0 "[ . 1 . 2]" 1
15 1 85 VAL HA 1 88 PHE QE 5.420 . 5.420 5.390 4.521 5.674 0.254 14 0 "[ . 1 . 2]" 1
16 1 87 LYS HA 1 88 PHE H 3.460 . 3.460 3.345 3.279 3.393 . 0 0 "[ . 1 . 2]" 1
17 1 88 PHE H 1 88 PHE QD 3.020 . 3.020 1.849 1.752 2.475 . 0 0 "[ . 1 . 2]" 1
18 1 87 LYS H 1 88 PHE QB 4.910 . 4.910 4.273 4.158 4.392 . 0 0 "[ . 1 . 2]" 1
19 1 88 PHE HA 1 88 PHE QD 3.680 . 3.680 3.599 3.500 3.654 . 0 0 "[ . 1 . 2]" 1
20 1 84 VAL QG 1 88 PHE QB 5.500 . 5.500 5.528 5.380 5.589 0.089 5 0 "[ . 1 . 2]" 1
21 1 86 ASP H 1 88 PHE H 5.210 . 5.210 4.470 4.315 4.573 . 0 0 "[ . 1 . 2]" 1
22 1 88 PHE H 1 88 PHE QB 3.210 . 3.210 2.449 2.340 2.695 . 0 0 "[ . 1 . 2]" 1
23 1 88 PHE H 1 89 ASP HA 4.500 . 4.500 4.596 4.550 4.709 0.209 9 0 "[ . 1 . 2]" 1
24 1 88 PHE QB 1 94 LEU QD 2.780 . 2.780 2.795 2.164 2.904 0.124 16 0 "[ . 1 . 2]" 1
25 1 70 GLY HA2 1 145 LEU MD1 5.000 . 5.000 3.978 3.763 4.164 . 0 0 "[ . 1 . 2]" 1
26 1 73 LEU MD2 1 145 LEU HG 5.000 . 5.000 4.127 3.860 4.392 . 0 0 "[ . 1 . 2]" 1
27 1 70 GLY HA3 1 145 LEU MD1 5.000 . 5.000 4.113 3.794 4.299 . 0 0 "[ . 1 . 2]" 1
28 1 142 ALA H 1 145 LEU MD1 5.000 . 5.000 4.000 3.529 4.419 . 0 0 "[ . 1 . 2]" 1
29 1 142 ALA MB 1 145 LEU HG 5.000 . 5.000 5.146 5.099 5.215 0.215 17 0 "[ . 1 . 2]" 1
30 1 103 HIS HD1 1 115 LEU MD1 5.000 . 5.000 4.671 2.719 5.044 0.044 12 0 "[ . 1 . 2]" 1
31 1 142 ALA HA 1 145 LEU MD1 . . 3.000 2.222 2.136 2.267 . 0 0 "[ . 1 . 2]" 1
32 1 9 LEU MD1 1 22 TRP HH2 4.000 . 4.000 4.029 3.952 4.055 0.055 13 0 "[ . 1 . 2]" 1
33 1 5 ILE MG 1 73 LEU MD1 3.000 . 3.000 2.084 2.026 2.191 . 0 0 "[ . 1 . 2]" 1
34 1 102 ILE MG 2 1 HEM HAB 5.000 . 5.000 3.892 3.592 4.424 . 0 0 "[ . 1 . 2]" 1
35 1 60 MET HB3 1 65 VAL MG1 5.500 . 5.500 5.156 5.109 5.219 . 0 0 "[ . 1 . 2]" 1
36 1 102 ILE MG 2 1 HEM HAC 5.000 . 5.000 3.261 2.324 4.376 . 0 0 "[ . 1 . 2]" 1
37 1 70 GLY H 1 145 LEU HG 5.000 . 5.000 4.932 4.613 5.083 0.083 18 0 "[ . 1 . 2]" 1
38 1 14 VAL HA 1 19 MET QB 5.000 . 5.000 4.412 4.175 4.722 . 0 0 "[ . 1 . 2]" 1
39 1 59 ASN HA 1 60 MET HG3 5.000 . 5.000 4.323 4.265 4.700 . 0 0 "[ . 1 . 2]" 1
40 1 73 LEU MD2 1 145 LEU MD1 5.000 . 5.000 3.128 2.949 3.311 . 0 0 "[ . 1 . 2]" 1
41 1 70 GLY HA2 1 145 LEU HG 5.000 . 5.000 2.897 2.613 3.206 . 0 0 "[ . 1 . 2]" 1
42 1 9 LEU MD1 1 22 TRP HZ3 4.000 . 4.000 3.382 3.232 3.446 . 0 0 "[ . 1 . 2]" 1
43 1 70 GLY HA3 1 145 LEU HG 3.000 . 3.000 2.704 2.386 2.854 . 0 0 "[ . 1 . 2]" 1
44 1 97 GLY HA2 1 101 VAL MG2 4.500 . 4.500 4.071 3.880 4.250 . 0 0 "[ . 1 . 2]" 1
45 1 91 PHE QD 1 176 ILE MG 4.000 . 4.000 4.023 4.005 4.044 0.044 1 0 "[ . 1 . 2]" 1
46 1 129 ALA MB 1 176 ILE H 5.000 . 5.000 4.966 4.914 5.021 0.021 13 0 "[ . 1 . 2]" 1
47 1 129 ALA HA 1 175 ILE HB 5.000 . 5.000 5.161 5.133 5.196 0.196 15 0 "[ . 1 . 2]" 1
48 1 143 GLU HG3 1 147 PHE QE 5.000 . 5.000 5.049 5.028 5.075 0.075 11 0 "[ . 1 . 2]" 1
49 1 91 PHE QD 1 150 ALA HA 5.000 . 5.000 2.761 2.444 3.282 . 0 0 "[ . 1 . 2]" 1
50 1 120 GLY HA3 1 131 ARG H 5.000 . 5.000 5.010 4.819 5.076 0.076 16 0 "[ . 1 . 2]" 1
51 1 96 MET H 1 96 MET QG 4.010 . 4.010 2.637 1.767 4.055 0.045 9 0 "[ . 1 . 2]" 1
52 1 22 TRP HZ3 1 50 ILE MG 2.400 . 2.400 2.190 2.137 2.228 . 0 0 "[ . 1 . 2]" 1
53 1 161 HIS HD1 1 164 CYS QB 3.510 . 3.510 2.970 2.288 3.562 0.052 3 0 "[ . 1 . 2]" 1
54 1 135 PRO QD 1 136 ARG H 4.360 . 4.360 2.638 2.496 3.094 . 0 0 "[ . 1 . 2]" 1
55 1 9 LEU H 1 9 LEU HB3 3.840 . 3.840 2.363 2.328 2.399 . 0 0 "[ . 1 . 2]" 1
56 1 3 GLY H 1 36 TYR HB3 5.500 . 5.500 5.590 5.542 5.643 0.143 18 0 "[ . 1 . 2]" 1
57 1 25 LEU HA 1 28 LYS QE 3.810 . 3.810 2.814 2.640 2.917 . 0 0 "[ . 1 . 2]" 1
58 1 86 ASP H 1 87 LYS QG 5.250 . 5.250 4.414 3.945 4.848 . 0 0 "[ . 1 . 2]" 1
59 1 78 ALA H 1 79 SER H 3.670 . 3.670 2.872 2.840 2.984 . 0 0 "[ . 1 . 2]" 1
60 1 151 GLN H 1 151 GLN HG3 4.000 . 4.000 2.671 2.110 4.133 0.133 1 0 "[ . 1 . 2]" 1
61 1 60 MET HB2 1 65 VAL HA 4.660 . 4.660 4.640 4.606 4.671 0.011 3 0 "[ . 1 . 2]" 1
62 1 158 GLN QB 1 159 ILE H 4.010 . 4.010 3.360 2.880 3.625 . 0 0 "[ . 1 . 2]" 1
63 1 14 VAL H 1 22 TRP HE1 6.000 . 6.000 5.538 5.509 5.556 . 0 0 "[ . 1 . 2]" 1
64 1 54 VAL MG1 1 58 LEU MD1 2.830 . 2.830 2.446 2.343 2.505 . 0 0 "[ . 1 . 2]" 1
65 1 164 CYS HA 1 165 MET H 3.000 . 3.000 2.146 2.123 2.214 . 0 0 "[ . 1 . 2]" 1
66 1 67 LYS QB 1 67 LYS QD 2.550 . 2.550 2.280 2.233 2.350 . 0 0 "[ . 1 . 2]" 1
67 1 6 PHE QE 1 36 TYR HB2 5.500 . 5.500 3.956 3.412 5.197 . 0 0 "[ . 1 . 2]" 1
68 1 101 VAL HA 1 104 LEU QB 3.720 . 3.720 2.351 2.314 2.420 . 0 0 "[ . 1 . 2]" 1
69 1 47 LEU QB 1 48 PHE QD 5.140 . 5.140 4.784 2.678 5.170 0.030 5 0 "[ . 1 . 2]" 1
70 1 5 ILE MG 1 6 PHE HZ 5.260 . 5.260 5.200 5.099 5.267 0.007 8 0 "[ . 1 . 2]" 1
71 1 37 VAL MG2 1 40 LYS HG2 3.710 . 3.710 3.278 3.227 3.364 . 0 0 "[ . 1 . 2]" 1
72 1 58 LEU H 1 58 LEU MD2 3.750 . 3.750 3.587 3.563 3.608 . 0 0 "[ . 1 . 2]" 1
73 1 40 LYS H 1 40 LYS QD 4.250 . 4.250 3.531 3.336 3.635 . 0 0 "[ . 1 . 2]" 1
74 1 21 VAL H 1 22 TRP H 3.100 . 3.100 2.532 2.473 2.572 . 0 0 "[ . 1 . 2]" 1
75 1 157 ILE HA 1 157 ILE MG 3.090 . 3.090 2.252 2.240 2.259 . 0 0 "[ . 1 . 2]" 1
76 1 9 LEU MD1 1 13 VAL H 5.500 . 5.500 2.733 2.685 2.879 . 0 0 "[ . 1 . 2]" 1
77 1 122 LEU H 1 122 LEU MD1 3.280 . 3.280 3.073 2.903 3.293 0.013 16 0 "[ . 1 . 2]" 1
78 1 6 PHE H 1 6 PHE HZ 5.500 . 5.500 5.505 5.446 5.528 0.028 18 0 "[ . 1 . 2]" 1
79 1 85 VAL QG 1 94 LEU QD 4.670 . 4.670 2.625 2.205 3.516 . 0 0 "[ . 1 . 2]" 1
80 1 37 VAL HA 1 37 VAL MG1 2.950 . 2.950 2.229 2.195 2.287 . 0 0 "[ . 1 . 2]" 1
81 1 128 ILE H 1 128 ILE HB 3.960 . 3.960 2.763 2.730 2.796 . 0 0 "[ . 1 . 2]" 1
82 1 62 ILE HB 1 62 ILE MD 3.120 . 3.120 2.264 2.258 2.272 . 0 0 "[ . 1 . 2]" 1
83 1 142 ALA MB 1 146 LEU MD1 3.890 . 3.890 3.453 3.270 3.737 . 0 0 "[ . 1 . 2]" 1
84 1 121 GLN H 1 121 GLN QG 4.220 . 4.220 4.081 4.026 4.144 . 0 0 "[ . 1 . 2]" 1
85 1 67 LYS HG3 1 68 ALA H 4.160 . 4.160 4.156 4.024 4.211 0.051 9 0 "[ . 1 . 2]" 1
86 1 179 GLN QB 1 179 GLN QE . . 3.880 2.149 1.774 2.752 . 0 0 "[ . 1 . 2]" 1
87 1 15 ALA HA 1 17 CYS H 5.090 . 5.090 5.082 5.055 5.109 0.019 12 0 "[ . 1 . 2]" 1
88 1 143 GLU HA 1 143 GLU HG3 3.520 . 3.520 2.774 2.678 2.874 . 0 0 "[ . 1 . 2]" 1
89 1 139 CYS H 1 139 CYS QB 3.850 . 3.850 2.427 2.195 2.731 . 0 0 "[ . 1 . 2]" 1
90 1 40 LYS HB3 1 40 LYS QD 2.700 . 2.700 2.470 2.442 2.727 0.027 12 0 "[ . 1 . 2]" 1
91 1 47 LEU HA 1 50 ILE HB 3.920 . 3.920 2.571 2.540 2.610 . 0 0 "[ . 1 . 2]" 1
92 1 134 SER H 1 134 SER QB 3.820 . 3.820 3.166 2.920 3.513 . 0 0 "[ . 1 . 2]" 1
93 1 14 VAL MG1 1 19 MET HG3 4.480 . 4.480 4.184 2.253 4.505 0.025 9 0 "[ . 1 . 2]" 1
94 1 57 ARG QB 1 57 ARG HD2 3.170 . 3.170 2.462 2.438 2.655 . 0 0 "[ . 1 . 2]" 1
95 1 98 ILE MD 1 98 ILE MG 3.170 . 3.170 1.824 1.789 1.882 . 0 0 "[ . 1 . 2]" 1
96 1 143 GLU HA 1 146 LEU MD1 3.580 . 3.580 2.307 2.288 2.397 . 0 0 "[ . 1 . 2]" 1
97 1 95 VAL MG2 1 130 LEU MD1 3.910 . 3.910 3.733 3.395 3.947 0.037 8 0 "[ . 1 . 2]" 1
98 1 156 LYS H 1 156 LYS QB 3.600 . 3.600 2.491 2.372 2.834 . 0 0 "[ . 1 . 2]" 1
99 1 59 ASN HA 1 59 ASN HB2 2.710 . 2.710 2.572 2.566 2.582 . 0 0 "[ . 1 . 2]" 1
100 1 73 LEU HG 1 77 LEU HG 3.070 . 3.070 2.767 2.522 3.082 0.012 16 0 "[ . 1 . 2]" 1
101 1 94 LEU QD 2 1 HEM HAB 3.850 . 3.850 2.277 2.093 2.821 . 0 0 "[ . 1 . 2]" 1
102 1 55 ALA HA 1 58 LEU HG 4.330 . 4.330 4.345 4.337 4.356 0.026 12 0 "[ . 1 . 2]" 1
103 1 26 LEU HB3 1 28 LYS H 5.500 . 5.500 4.882 4.706 4.937 . 0 0 "[ . 1 . 2]" 1
104 1 92 THR HA 1 96 MET H 5.000 . 5.000 4.605 4.292 4.731 . 0 0 "[ . 1 . 2]" 1
105 1 26 LEU HB2 1 27 GLU H 4.140 . 4.140 3.963 3.848 3.989 . 0 0 "[ . 1 . 2]" 1
106 1 106 VAL HA 1 109 LEU HG 4.760 . 4.760 4.185 3.080 4.818 0.058 9 0 "[ . 1 . 2]" 1
107 1 158 GLN H 1 158 GLN QB . . 3.360 2.581 2.541 2.626 . 0 0 "[ . 1 . 2]" 1
108 1 13 VAL H 1 13 VAL MG2 4.060 . 4.060 1.888 1.859 1.931 . 0 0 "[ . 1 . 2]" 1
109 1 162 ASP HA 1 163 THR H 4.000 . 4.000 3.523 3.489 3.545 . 0 0 "[ . 1 . 2]" 1
110 1 16 GLN HG2 1 58 LEU MD2 4.570 . 4.570 4.370 4.312 4.424 . 0 0 "[ . 1 . 2]" 1
111 1 36 TYR HA 1 37 VAL H 3.000 . 3.000 2.175 2.144 2.261 . 0 0 "[ . 1 . 2]" 1
112 1 123 LEU MD1 1 127 GLN HA 5.000 . 5.000 4.090 4.043 4.210 . 0 0 "[ . 1 . 2]" 1
113 1 23 ASN H 1 23 ASN QD . . 4.220 3.029 2.366 4.242 0.022 18 0 "[ . 1 . 2]" 1
114 1 168 GLY HA2 1 169 ALA H 4.000 . 4.000 3.402 3.360 3.439 . 0 0 "[ . 1 . 2]" 1
115 1 101 VAL HB 1 102 ILE H 4.340 . 4.340 3.709 3.652 3.766 . 0 0 "[ . 1 . 2]" 1
116 1 102 ILE HA 1 102 ILE MG 3.370 . 3.370 2.490 2.470 2.518 . 0 0 "[ . 1 . 2]" 1
117 1 21 VAL HB 1 22 TRP H 3.810 . 3.810 3.652 3.635 3.686 . 0 0 "[ . 1 . 2]" 1
118 1 128 ILE H 1 128 ILE QG 4.170 . 4.170 2.694 2.581 2.752 . 0 0 "[ . 1 . 2]" 1
119 1 104 LEU QB 1 104 LEU HG 2.610 . 2.610 2.542 2.538 2.546 . 0 0 "[ . 1 . 2]" 1
120 1 50 ILE HA 1 54 VAL H 4.000 . 4.000 3.468 3.420 3.527 . 0 0 "[ . 1 . 2]" 1
121 1 107 ASN HB3 1 108 LYS H 3.940 . 3.940 2.517 2.388 2.673 . 0 0 "[ . 1 . 2]" 1
122 1 56 GLN H 1 57 ARG HD2 5.220 . 5.220 5.226 4.972 5.255 0.035 14 0 "[ . 1 . 2]" 1
123 1 91 PHE QD 1 149 ALA MB 4.470 . 4.470 2.763 2.450 3.147 . 0 0 "[ . 1 . 2]" 1
124 1 147 PHE QD 1 159 ILE MD 4.000 . 4.000 3.583 3.475 3.638 . 0 0 "[ . 1 . 2]" 1
125 1 171 HIS HA 1 172 CYS H 3.000 . 3.000 2.738 2.643 2.840 . 0 0 "[ . 1 . 2]" 1
126 1 73 LEU H 1 73 LEU MD2 4.520 . 4.520 4.401 4.384 4.413 . 0 0 "[ . 1 . 2]" 1
127 1 125 ASN HA 1 125 ASN QD 4.170 . 4.170 3.493 1.805 4.164 . 0 0 "[ . 1 . 2]" 1
128 1 5 ILE MG 1 47 LEU MD1 3.040 . 3.040 2.466 2.144 2.726 . 0 0 "[ . 1 . 2]" 1
129 1 119 ASN QD 1 120 GLY HA2 5.020 . 5.020 4.543 3.656 5.034 0.014 8 0 "[ . 1 . 2]" 1
130 1 163 THR H 1 163 THR HB 3.220 . 3.220 2.739 2.673 2.779 . 0 0 "[ . 1 . 2]" 1
131 1 130 LEU MD2 1 174 LEU MD2 2.700 . 2.700 2.723 2.574 2.749 0.049 1 0 "[ . 1 . 2]" 1
132 1 151 GLN QB 1 151 GLN HG3 . . 2.400 2.338 2.195 2.366 . 0 0 "[ . 1 . 2]" 1
133 1 69 PHE HA 1 69 PHE QD 3.130 . 3.130 2.307 2.290 2.322 . 0 0 "[ . 1 . 2]" 1
134 1 23 ASN HA 1 26 LEU HG 4.840 . 4.840 4.245 4.156 4.518 . 0 0 "[ . 1 . 2]" 1
135 1 6 PHE QE 1 50 ILE MD 4.210 . 4.210 2.367 2.164 2.523 . 0 0 "[ . 1 . 2]" 1
136 1 142 ALA MB 1 174 LEU MD2 3.940 . 3.940 3.166 2.882 3.398 . 0 0 "[ . 1 . 2]" 1
137 1 122 LEU QB 1 122 LEU MD2 2.540 . 2.540 2.097 2.090 2.100 . 0 0 "[ . 1 . 2]" 1
138 1 127 GLN HA 1 176 ILE H 5.000 . 5.000 5.173 5.123 5.230 0.230 19 0 "[ . 1 . 2]" 1
139 1 85 VAL H 1 87 LYS QB 5.500 . 5.500 5.239 5.186 5.364 . 0 0 "[ . 1 . 2]" 1
140 1 147 PHE QD 1 157 ILE QG 4.290 . 4.290 2.781 2.570 3.005 . 0 0 "[ . 1 . 2]" 1
141 1 177 GLU H 1 177 GLU QG . . 4.670 3.913 2.403 4.086 . 0 0 "[ . 1 . 2]" 1
142 1 104 LEU HA 1 115 LEU MD1 4.390 . 4.390 3.940 3.581 4.447 0.057 20 0 "[ . 1 . 2]" 1
143 1 36 TYR H 1 36 TYR QE 4.040 . 4.040 3.574 3.366 3.742 . 0 0 "[ . 1 . 2]" 1
144 1 27 GLU QB 1 28 LYS H . . 3.650 2.787 2.747 2.888 . 0 0 "[ . 1 . 2]" 1
145 1 9 LEU HB2 1 10 GLU H 3.710 . 3.710 3.804 3.794 3.818 0.108 20 0 "[ . 1 . 2]" 1
146 1 40 LYS HA 1 40 LYS QD 3.540 . 3.540 2.269 2.243 2.288 . 0 0 "[ . 1 . 2]" 1
147 1 127 GLN H 1 127 GLN QG 3.990 . 3.990 2.956 2.773 3.214 . 0 0 "[ . 1 . 2]" 1
148 1 172 CYS HA 1 173 MET H 3.380 . 3.380 2.341 2.292 2.365 . 0 0 "[ . 1 . 2]" 1
149 1 153 PHE H 1 153 PHE QB 3.420 . 3.420 2.789 2.646 2.814 . 0 0 "[ . 1 . 2]" 1
150 1 130 LEU MD1 1 131 ARG H 4.310 . 4.310 3.969 3.626 4.352 0.042 7 0 "[ . 1 . 2]" 1
151 1 130 LEU HG 1 131 ARG H 4.060 . 4.060 3.061 2.948 3.147 . 0 0 "[ . 1 . 2]" 1
152 1 153 PHE QB 1 155 GLN QB . . 3.360 2.642 2.518 2.718 . 0 0 "[ . 1 . 2]" 1
153 1 91 PHE HZ 1 157 ILE QG 4.370 . 4.370 4.394 4.173 4.442 0.072 17 0 "[ . 1 . 2]" 1
154 1 40 LYS HA 1 40 LYS QE 4.000 . 4.000 3.845 3.202 3.940 . 0 0 "[ . 1 . 2]" 1
155 1 155 GLN HA 1 155 GLN QG 3.150 . 3.150 3.036 2.950 3.065 . 0 0 "[ . 1 . 2]" 1
156 1 23 ASN QB 1 26 LEU H 5.220 . 5.220 5.019 4.949 5.152 . 0 0 "[ . 1 . 2]" 1
157 1 44 GLU HA 1 47 LEU H 4.000 . 4.000 3.477 3.167 3.854 . 0 0 "[ . 1 . 2]" 1
158 1 51 VAL HA 1 54 VAL MG1 2.830 . 2.830 2.243 2.202 2.311 . 0 0 "[ . 1 . 2]" 1
159 1 83 ASP H 1 83 ASP HB3 3.180 . 3.180 2.607 2.524 2.680 . 0 0 "[ . 1 . 2]" 1
160 1 9 LEU MD1 1 10 GLU H 5.000 . 5.000 3.938 3.914 3.987 . 0 0 "[ . 1 . 2]" 1
161 1 11 ASP H 1 12 MET HG3 5.500 . 5.500 4.533 3.684 5.588 0.088 11 0 "[ . 1 . 2]" 1
162 1 47 LEU MD1 1 50 ILE HB 4.450 . 4.450 3.347 3.240 3.401 . 0 0 "[ . 1 . 2]" 1
163 1 84 VAL HB 1 85 VAL H 3.440 . 3.440 2.423 2.370 2.492 . 0 0 "[ . 1 . 2]" 1
164 1 156 LYS QB 1 156 LYS QE 2.880 . 2.880 2.157 2.108 2.299 . 0 0 "[ . 1 . 2]" 1
165 1 179 GLN QE 1 181 ASP H 4.770 . 4.770 4.090 3.622 4.758 . 0 0 "[ . 1 . 2]" 1
166 1 149 ALA H 1 150 ALA H 3.510 . 3.510 2.468 2.380 2.557 . 0 0 "[ . 1 . 2]" 1
167 1 63 GLN HA 1 63 GLN HG2 3.840 . 3.840 3.679 3.657 3.709 . 0 0 "[ . 1 . 2]" 1
168 1 101 VAL H 1 102 ILE HB 4.510 . 4.510 4.687 4.642 4.722 0.212 14 0 "[ . 1 . 2]" 1
169 1 15 ALA MB 1 72 PHE HZ 4.440 . 4.440 4.474 4.413 4.515 0.075 11 0 "[ . 1 . 2]" 1
170 1 58 LEU HA 1 58 LEU HG 3.450 . 3.450 2.913 2.891 2.933 . 0 0 "[ . 1 . 2]" 1
171 1 72 PHE QD 1 73 LEU H 4.640 . 4.640 4.365 4.060 4.638 . 0 0 "[ . 1 . 2]" 1
172 1 72 PHE HA 1 75 ASN H 4.320 . 4.320 3.255 3.175 3.325 . 0 0 "[ . 1 . 2]" 1
173 1 109 LEU HA 1 109 LEU HG 3.820 . 3.820 2.696 2.300 3.630 . 0 0 "[ . 1 . 2]" 1
174 1 159 ILE HA 1 159 ILE MG 2.960 . 2.960 2.395 2.378 2.413 . 0 0 "[ . 1 . 2]" 1
175 1 3 GLY HA3 1 37 VAL HA 4.020 . 4.020 4.023 3.903 4.066 0.046 11 0 "[ . 1 . 2]" 1
176 1 165 MET H 1 171 HIS H 5.000 . 5.000 4.778 4.474 5.022 0.022 11 0 "[ . 1 . 2]" 1
177 1 84 VAL HA 1 87 LYS H 5.000 . 5.000 4.214 4.031 4.406 . 0 0 "[ . 1 . 2]" 1
178 1 81 HIS H 1 81 HIS HD1 5.500 . 5.500 2.981 1.580 3.561 0.020 17 0 "[ . 1 . 2]" 1
179 1 168 GLY H 1 169 ALA MB 5.000 . 5.000 4.220 4.079 4.307 . 0 0 "[ . 1 . 2]" 1
180 1 47 LEU HA 1 50 ILE MG 4.020 . 4.020 3.875 3.853 3.943 . 0 0 "[ . 1 . 2]" 1
181 1 70 GLY HA2 1 73 LEU H 4.510 . 4.510 3.396 3.220 3.595 . 0 0 "[ . 1 . 2]" 1
182 1 50 ILE HA 1 53 ASP H 4.000 . 4.000 3.597 3.568 3.647 . 0 0 "[ . 1 . 2]" 1
183 1 33 ASP HA 1 34 ARG H 4.000 . 4.000 2.875 2.352 3.573 . 0 0 "[ . 1 . 2]" 1
184 1 75 ASN HA 1 78 ALA H 4.000 . 4.000 4.057 3.991 4.107 0.107 5 0 "[ . 1 . 2]" 1
185 1 11 ASP HA 1 14 VAL HB 3.440 . 3.440 2.758 2.714 2.920 . 0 0 "[ . 1 . 2]" 1
186 1 125 ASN H 1 125 ASN QD 5.220 . 5.220 3.975 2.645 5.227 0.007 13 0 "[ . 1 . 2]" 1
187 1 178 LEU H 1 178 LEU MD1 3.500 . 3.500 3.436 3.351 3.502 0.002 15 0 "[ . 1 . 2]" 1
188 1 97 GLY HA2 1 101 VAL MG1 4.110 . 4.110 3.832 3.660 3.973 . 0 0 "[ . 1 . 2]" 1
189 1 5 ILE HB 1 6 PHE HB3 5.500 . 5.500 5.511 5.490 5.528 0.028 5 0 "[ . 1 . 2]" 1
190 1 161 HIS HA 1 163 THR H 4.330 . 4.330 3.527 3.413 3.619 . 0 0 "[ . 1 . 2]" 1
191 1 73 LEU HG 1 77 LEU MD1 3.600 . 3.600 2.439 2.139 2.690 . 0 0 "[ . 1 . 2]" 1
192 1 9 LEU HA 1 12 MET QB 3.940 . 3.940 3.029 2.562 4.096 0.156 20 0 "[ . 1 . 2]" 1
193 1 145 LEU H 1 145 LEU HB2 4.090 . 4.090 2.387 2.327 2.527 . 0 0 "[ . 1 . 2]" 1
194 1 153 PHE HA 1 153 PHE QE 4.570 . 4.570 4.598 4.557 4.614 0.044 14 0 "[ . 1 . 2]" 1
195 1 18 GLY HA3 1 19 MET H 3.000 . 3.000 2.533 2.499 2.614 . 0 0 "[ . 1 . 2]" 1
196 1 109 LEU H 1 109 LEU QD 3.960 . 3.960 2.556 2.064 3.341 . 0 0 "[ . 1 . 2]" 1
197 1 25 LEU MD1 1 26 LEU QD 3.970 . 3.970 3.288 3.201 3.315 . 0 0 "[ . 1 . 2]" 1
198 1 101 VAL H 1 101 VAL MG2 3.120 . 3.120 2.267 2.203 2.330 . 0 0 "[ . 1 . 2]" 1
199 1 104 LEU HA 1 107 ASN H 4.000 . 4.000 3.757 3.534 3.942 . 0 0 "[ . 1 . 2]" 1
200 1 100 ASP QB 1 101 VAL MG2 4.030 . 4.030 3.220 3.139 3.320 . 0 0 "[ . 1 . 2]" 1
201 1 108 LYS HA 1 108 LYS QD 3.860 . 3.860 3.896 3.782 4.084 0.224 3 0 "[ . 1 . 2]" 1
202 1 23 ASN HA 1 23 ASN QD 3.990 . 3.990 2.150 1.803 3.585 . 0 0 "[ . 1 . 2]" 1
203 1 91 PHE QE 1 95 VAL MG1 5.020 . 5.020 3.935 3.858 4.052 . 0 0 "[ . 1 . 2]" 1
204 1 58 LEU MD1 1 65 VAL MG2 5.000 . 5.000 3.481 3.438 3.532 . 0 0 "[ . 1 . 2]" 1
205 1 178 LEU HA 1 178 LEU MD2 2.940 . 2.940 2.241 2.211 2.270 . 0 0 "[ . 1 . 2]" 1
206 1 178 LEU HA 1 179 GLN H 2.950 . 2.950 2.168 2.157 2.178 . 0 0 "[ . 1 . 2]" 1
207 1 154 GLN HA 1 154 GLN QG 2.450 . 2.450 2.348 2.244 2.523 0.073 5 0 "[ . 1 . 2]" 1
208 1 154 GLN H 1 154 GLN HB3 3.880 . 3.880 3.646 3.608 3.957 0.077 4 0 "[ . 1 . 2]" 1
209 1 104 LEU QD 1 105 GLU H 2.920 . 2.920 2.855 2.706 2.940 0.020 3 0 "[ . 1 . 2]" 1
210 1 179 GLN HA 1 179 GLN QG 2.800 . 2.800 2.293 2.266 2.339 . 0 0 "[ . 1 . 2]" 1
211 1 72 PHE HA 1 72 PHE QE 5.010 . 5.010 4.310 4.178 4.438 . 0 0 "[ . 1 . 2]" 1
212 1 139 CYS HA 1 142 ALA H 4.000 . 4.000 3.051 2.899 3.234 . 0 0 "[ . 1 . 2]" 1
213 1 43 ALA MB 1 46 GLU QG 3.240 . 3.240 2.930 2.189 3.290 0.050 12 0 "[ . 1 . 2]" 1
214 1 55 ALA MB 1 62 ILE HB 3.430 . 3.430 3.472 3.453 3.487 0.057 20 0 "[ . 1 . 2]" 1
215 1 71 GLN HA 1 145 LEU HA 3.840 . 3.840 3.281 3.065 3.468 . 0 0 "[ . 1 . 2]" 1
216 1 52 GLN HA 1 55 ALA MB 3.740 . 3.740 2.792 2.770 2.807 . 0 0 "[ . 1 . 2]" 1
217 1 130 LEU H 1 176 ILE H 5.000 . 5.000 3.787 3.593 3.928 . 0 0 "[ . 1 . 2]" 1
218 1 5 ILE MD 1 5 ILE MG 3.360 . 3.360 1.927 1.919 1.935 . 0 0 "[ . 1 . 2]" 1
219 1 106 VAL MG1 1 109 LEU QD . . 3.600 3.396 3.130 3.677 0.077 8 0 "[ . 1 . 2]" 1
220 1 14 VAL H 1 14 VAL HB 3.160 . 3.160 2.396 2.384 2.422 . 0 0 "[ . 1 . 2]" 1
221 1 157 ILE H 1 157 ILE QG 3.960 . 3.960 2.376 2.304 2.405 . 0 0 "[ . 1 . 2]" 1
222 1 8 VAL HB 1 77 LEU HG 5.040 . 5.040 4.325 4.006 4.460 . 0 0 "[ . 1 . 2]" 1
223 1 65 VAL H 1 65 VAL HB 3.210 . 3.210 2.471 2.442 2.492 . 0 0 "[ . 1 . 2]" 1
224 1 126 ASN HA 1 127 GLN H 3.500 . 3.500 2.679 2.457 2.774 . 0 0 "[ . 1 . 2]" 1
225 1 78 ALA HA 1 81 HIS H 4.000 . 4.000 3.279 3.106 3.464 . 0 0 "[ . 1 . 2]" 1
226 1 133 SER HA 1 134 SER H 3.000 . 3.000 2.212 2.186 2.261 . 0 0 "[ . 1 . 2]" 1
227 1 162 ASP QB 1 163 THR H . . 3.270 2.786 2.647 3.390 0.120 15 0 "[ . 1 . 2]" 1
228 1 82 THR H 1 82 THR MG 3.500 . 3.500 3.614 3.535 3.644 0.144 17 0 "[ . 1 . 2]" 1
229 1 18 GLY H 1 18 GLY HA2 2.790 . 2.790 2.459 2.443 2.472 . 0 0 "[ . 1 . 2]" 1
230 1 4 ILE MD 1 8 VAL H 5.460 . 5.460 4.347 3.907 4.736 . 0 0 "[ . 1 . 2]" 1
231 1 74 PHE QE 1 94 LEU QD 4.110 . 4.110 2.610 2.537 2.706 . 0 0 "[ . 1 . 2]" 1
232 1 174 LEU HA 1 175 ILE HB 4.950 . 4.950 4.796 4.750 4.814 . 0 0 "[ . 1 . 2]" 1
233 1 11 ASP HA 1 13 VAL H 4.740 . 4.740 4.898 4.857 4.914 0.174 12 0 "[ . 1 . 2]" 1
234 1 37 VAL HA 1 38 SER H 3.550 . 3.550 2.170 2.130 2.219 . 0 0 "[ . 1 . 2]" 1
235 1 95 VAL MG1 1 130 LEU MD1 2.400 . 2.400 2.138 2.000 2.200 . 0 0 "[ . 1 . 2]" 1
236 1 171 HIS QB 1 172 CYS H . . 3.770 1.884 1.809 2.001 . 0 0 "[ . 1 . 2]" 1
237 1 160 SER H 1 160 SER QB 3.510 . 3.510 2.392 2.369 2.411 . 0 0 "[ . 1 . 2]" 1
238 1 143 GLU HG3 1 174 LEU MD2 3.330 . 3.330 2.241 2.221 2.292 . 0 0 "[ . 1 . 2]" 1
239 1 159 ILE MG 1 161 HIS HA 4.150 . 4.150 3.982 3.853 4.157 0.007 12 0 "[ . 1 . 2]" 1
240 1 140 PHE HA 1 140 PHE QD 4.060 . 4.060 2.343 2.317 2.387 . 0 0 "[ . 1 . 2]" 1
241 1 128 ILE HB 1 176 ILE H 4.120 . 4.120 3.474 3.277 3.617 . 0 0 "[ . 1 . 2]" 1
242 1 100 ASP QB 1 101 VAL MG1 2.980 . 2.980 2.475 2.318 2.702 . 0 0 "[ . 1 . 2]" 1
243 1 6 PHE QE 1 47 LEU HA 5.200 . 5.200 2.740 2.490 3.105 . 0 0 "[ . 1 . 2]" 1
244 1 71 GLN HB2 1 72 PHE H 3.910 . 3.910 2.622 2.566 2.790 . 0 0 "[ . 1 . 2]" 1
245 1 123 LEU QB 1 123 LEU HG 2.400 . 2.400 2.404 2.378 2.422 0.022 20 0 "[ . 1 . 2]" 1
246 1 14 VAL MG2 1 18 GLY HA3 4.870 . 4.870 4.714 4.593 4.908 0.038 13 0 "[ . 1 . 2]" 1
247 1 9 LEU MD2 1 22 TRP HZ2 3.820 . 3.820 3.703 3.659 3.744 . 0 0 "[ . 1 . 2]" 1
248 1 104 LEU H 1 104 LEU QD 4.560 . 4.560 3.600 3.568 3.637 . 0 0 "[ . 1 . 2]" 1
249 1 67 LYS H 1 67 LYS HG3 4.630 . 4.630 4.427 4.405 4.458 . 0 0 "[ . 1 . 2]" 1
250 1 126 ASN H 1 126 ASN QB 3.600 . 3.600 3.092 2.291 3.464 . 0 0 "[ . 1 . 2]" 1
251 1 156 LYS QG 1 179 GLN QE 5.500 . 5.500 4.361 1.940 5.166 . 0 0 "[ . 1 . 2]" 1
252 1 163 THR MG 1 167 THR H 5.500 . 5.500 5.553 5.526 5.601 0.101 9 0 "[ . 1 . 2]" 1
253 1 127 GLN QG 1 177 GLU HA . . 3.410 2.360 2.282 2.562 . 0 0 "[ . 1 . 2]" 1
254 1 51 VAL H 1 51 VAL HB 3.510 . 3.510 2.334 2.311 2.356 . 0 0 "[ . 1 . 2]" 1
255 1 52 GLN HG3 1 53 ASP HB2 3.430 . 3.430 3.046 3.021 3.066 . 0 0 "[ . 1 . 2]" 1
256 1 62 ILE HA 1 65 VAL H 4.000 . 4.000 3.372 3.347 3.397 . 0 0 "[ . 1 . 2]" 1
257 1 81 HIS HA 1 83 ASP H 3.760 . 3.760 3.310 3.027 3.508 . 0 0 "[ . 1 . 2]" 1
258 1 163 THR HB 1 169 ALA MB 4.430 . 4.430 4.524 4.476 4.582 0.152 9 0 "[ . 1 . 2]" 1
259 1 32 LYS HB3 1 32 LYS QG 2.660 . 2.660 2.306 2.191 2.325 . 0 0 "[ . 1 . 2]" 1
260 1 26 LEU HA 1 30 ALA MB 3.830 . 3.830 3.552 3.372 3.884 0.054 11 0 "[ . 1 . 2]" 1
261 1 26 LEU QD 1 36 TYR H 5.000 . 5.000 4.766 4.258 5.054 0.054 5 0 "[ . 1 . 2]" 1
262 1 55 ALA MB 1 62 ILE HA 2.940 . 2.940 2.609 2.591 2.620 . 0 0 "[ . 1 . 2]" 1
263 1 91 PHE QD 1 150 ALA MB 4.080 . 4.080 3.596 3.330 3.960 . 0 0 "[ . 1 . 2]" 1
264 1 47 LEU MD2 1 48 PHE QD 5.050 . 5.050 4.786 3.480 5.057 0.007 20 0 "[ . 1 . 2]" 1
265 1 128 ILE H 1 129 ALA MB 5.020 . 5.020 5.123 5.094 5.154 0.134 7 0 "[ . 1 . 2]" 1
266 1 84 VAL H 1 86 ASP H 4.290 . 4.290 4.229 4.152 4.269 . 0 0 "[ . 1 . 2]" 1
267 1 56 GLN QB 1 56 GLN QG 2.400 . 2.400 2.072 2.038 2.106 . 0 0 "[ . 1 . 2]" 1
268 1 147 PHE H 1 150 ALA MB 5.500 . 5.500 4.543 4.496 4.617 . 0 0 "[ . 1 . 2]" 1
269 1 83 ASP HA 1 86 ASP QB 3.370 . 3.370 3.012 2.881 3.476 0.106 2 0 "[ . 1 . 2]" 1
270 1 61 PRO HB2 1 62 ILE H 3.740 . 3.740 3.472 3.441 3.519 . 0 0 "[ . 1 . 2]" 1
271 1 6 PHE HA 1 9 LEU HB3 3.950 . 3.950 2.314 2.299 2.333 . 0 0 "[ . 1 . 2]" 1
272 1 155 GLN HE22 1 155 GLN QG 3.600 . 3.600 3.322 3.316 3.328 . 0 0 "[ . 1 . 2]" 1
273 1 55 ALA HA 1 58 LEU QB 3.130 . 3.130 2.490 2.464 2.518 . 0 0 "[ . 1 . 2]" 1
274 1 147 PHE QE 1 159 ILE MD 3.920 . 3.920 2.552 2.444 2.677 . 0 0 "[ . 1 . 2]" 1
275 1 46 GLU HA 1 49 SER H 4.000 . 4.000 3.305 3.145 3.466 . 0 0 "[ . 1 . 2]" 1
276 1 14 VAL HB 1 15 ALA HA 4.720 . 4.720 4.612 4.575 4.636 . 0 0 "[ . 1 . 2]" 1
277 1 123 LEU MD2 1 129 ALA MB 2.420 . 2.420 1.916 1.892 2.003 . 0 0 "[ . 1 . 2]" 1
278 1 105 GLU H 1 109 LEU QD 5.290 . 5.290 5.201 4.981 5.327 0.037 20 0 "[ . 1 . 2]" 1
279 1 22 TRP HB2 1 22 TRP HZ3 5.500 . 5.500 5.289 5.240 5.341 . 0 0 "[ . 1 . 2]" 1
280 1 51 VAL HA 1 54 VAL H 4.000 . 4.000 4.065 4.057 4.076 0.076 18 0 "[ . 1 . 2]" 1
281 1 87 LYS HA 1 87 LYS QG . . 2.860 2.357 2.283 2.431 . 0 0 "[ . 1 . 2]" 1
282 1 9 LEU HA 1 13 VAL H 4.100 . 4.100 4.248 4.209 4.297 0.197 7 0 "[ . 1 . 2]" 1
283 1 27 GLU QG 1 28 LYS H . . 5.050 4.255 4.192 4.612 . 0 0 "[ . 1 . 2]" 1
284 1 15 ALA MB 1 17 CYS H 5.000 . 5.000 5.040 5.035 5.056 0.056 18 0 "[ . 1 . 2]" 1
285 1 21 VAL H 1 23 ASN H 5.090 . 5.090 4.111 4.025 4.233 . 0 0 "[ . 1 . 2]" 1
286 1 53 ASP HA 1 56 GLN H 4.000 . 4.000 3.088 3.067 3.146 . 0 0 "[ . 1 . 2]" 1
287 1 50 ILE HB 1 50 ILE MD 3.190 . 3.190 2.286 2.224 2.345 . 0 0 "[ . 1 . 2]" 1
288 1 67 LYS H 1 68 ALA H 3.000 . 3.000 2.856 2.839 2.871 . 0 0 "[ . 1 . 2]" 1
289 1 105 GLU QB 1 106 VAL H 4.230 . 4.230 2.443 2.163 2.887 . 0 0 "[ . 1 . 2]" 1
290 1 51 VAL MG1 1 62 ILE MD 3.150 . 3.150 3.077 2.992 3.158 0.008 3 0 "[ . 1 . 2]" 1
291 1 77 LEU HA 1 77 LEU MD1 4.130 . 4.130 3.775 3.765 3.792 . 0 0 "[ . 1 . 2]" 1
292 1 130 LEU HB3 1 176 ILE MD 2.870 . 2.870 2.230 2.134 2.280 . 0 0 "[ . 1 . 2]" 1
293 1 6 PHE HZ 1 47 LEU MD1 5.010 . 5.010 3.278 3.128 3.509 . 0 0 "[ . 1 . 2]" 1
294 1 27 GLU H 1 28 LYS HB3 4.920 . 4.920 4.820 4.687 4.907 . 0 0 "[ . 1 . 2]" 1
295 1 120 GLY HA3 1 129 ALA H 6.000 . 6.000 6.014 5.990 6.035 0.035 1 0 "[ . 1 . 2]" 1
296 1 91 PHE HZ 1 95 VAL MG2 4.150 . 4.150 2.897 2.702 3.228 . 0 0 "[ . 1 . 2]" 1
297 1 147 PHE QE 1 159 ILE H 5.000 . 5.000 3.666 3.542 3.772 . 0 0 "[ . 1 . 2]" 1
298 1 119 ASN HA 1 119 ASN QB 2.720 . 2.720 2.392 2.344 2.455 . 0 0 "[ . 1 . 2]" 1
299 1 39 ALA H 1 40 LYS H 3.620 . 3.620 2.555 2.437 2.686 . 0 0 "[ . 1 . 2]" 1
300 1 120 GLY HA2 1 130 LEU HG 4.110 . 4.110 3.980 3.790 4.143 0.033 8 0 "[ . 1 . 2]" 1
301 1 13 VAL HB 1 22 TRP HE1 3.690 . 3.690 3.406 3.365 3.427 . 0 0 "[ . 1 . 2]" 1
302 1 75 ASN HA 1 78 ALA MB 3.340 . 3.340 3.159 3.063 3.288 . 0 0 "[ . 1 . 2]" 1
303 1 103 HIS QB 1 106 VAL MG1 5.500 . 5.500 4.753 4.567 4.913 . 0 0 "[ . 1 . 2]" 1
304 1 138 LEU QB 1 141 CYS H 4.550 . 4.550 3.594 2.805 4.127 . 0 0 "[ . 1 . 2]" 1
305 1 128 ILE QG 1 128 ILE MG 2.590 . 2.590 2.304 2.289 2.318 . 0 0 "[ . 1 . 2]" 1
306 1 14 VAL H 1 15 ALA MB 4.540 . 4.540 4.453 4.432 4.476 . 0 0 "[ . 1 . 2]" 1
307 1 67 LYS QB 1 67 LYS QE 3.700 . 3.700 2.219 2.132 2.284 . 0 0 "[ . 1 . 2]" 1
308 1 71 GLN H 1 72 PHE H 3.870 . 3.870 2.885 2.778 3.036 . 0 0 "[ . 1 . 2]" 1
309 1 62 ILE MG 1 63 GLN HG2 3.570 . 3.570 2.980 2.933 3.050 . 0 0 "[ . 1 . 2]" 1
310 1 107 ASN H 1 115 LEU MD1 5.000 . 5.000 3.295 3.066 3.774 . 0 0 "[ . 1 . 2]" 1
311 1 9 LEU MD1 1 12 MET H 5.000 . 5.000 3.281 3.220 3.524 . 0 0 "[ . 1 . 2]" 1
312 1 74 PHE HA 1 74 PHE QE 4.770 . 4.770 4.507 4.462 4.546 . 0 0 "[ . 1 . 2]" 1
313 1 105 GLU QG 1 109 LEU QD 3.830 . 3.830 2.223 2.003 2.705 . 0 0 "[ . 1 . 2]" 1
314 1 127 GLN HA 1 178 LEU H 4.160 . 4.160 3.010 2.886 3.089 . 0 0 "[ . 1 . 2]" 1
315 1 173 MET QB 1 174 LEU H 4.430 . 4.430 3.920 3.890 3.966 . 0 0 "[ . 1 . 2]" 1
316 1 105 GLU HA 1 108 LYS H 3.880 . 3.880 3.446 3.215 3.705 . 0 0 "[ . 1 . 2]" 1
317 1 172 CYS HA 1 174 LEU MD1 4.370 . 4.370 4.344 4.226 4.422 0.052 13 0 "[ . 1 . 2]" 1
318 1 155 GLN HE22 1 179 GLN H 3.670 . 3.670 3.583 3.454 3.681 0.011 15 0 "[ . 1 . 2]" 1
319 1 84 VAL QG 1 87 LYS QD 3.210 . 3.210 2.724 2.448 3.078 . 0 0 "[ . 1 . 2]" 1
320 1 13 VAL MG1 1 14 VAL H 4.510 . 4.510 3.840 3.821 3.858 . 0 0 "[ . 1 . 2]" 1
321 1 56 GLN H 1 57 ARG H 3.360 . 3.360 2.754 2.740 2.807 . 0 0 "[ . 1 . 2]" 1
322 1 74 PHE QD 1 149 ALA MB 4.090 . 4.090 3.129 2.963 3.561 . 0 0 "[ . 1 . 2]" 1
323 1 35 VAL QG 1 36 TYR HA 3.950 . 3.950 3.717 3.355 3.923 . 0 0 "[ . 1 . 2]" 1
324 1 21 VAL MG1 1 22 TRP H 3.080 . 3.080 1.840 1.768 1.978 . 0 0 "[ . 1 . 2]" 1
325 1 13 VAL HB 1 22 TRP H 4.540 . 4.540 4.364 4.323 4.413 . 0 0 "[ . 1 . 2]" 1
326 1 21 VAL HA 1 21 VAL MG2 2.980 . 2.980 2.216 2.197 2.265 . 0 0 "[ . 1 . 2]" 1
327 1 10 GLU H 1 11 ASP H 3.600 . 3.600 2.806 2.748 2.828 . 0 0 "[ . 1 . 2]" 1
328 1 121 GLN H 1 121 GLN HB3 3.740 . 3.740 2.686 2.653 2.721 . 0 0 "[ . 1 . 2]" 1
329 1 97 GLY HA2 1 101 VAL H 4.000 . 4.000 3.675 3.543 3.796 . 0 0 "[ . 1 . 2]" 1
330 1 160 SER QB 1 175 ILE HB 3.270 . 3.270 2.423 2.360 2.469 . 0 0 "[ . 1 . 2]" 1
331 1 151 GLN H 1 157 ILE QG 5.110 . 5.110 5.081 4.826 5.145 0.035 18 0 "[ . 1 . 2]" 1
332 1 145 LEU HB3 1 146 LEU H 4.260 . 4.260 3.421 3.305 3.517 . 0 0 "[ . 1 . 2]" 1
333 1 147 PHE HA 1 150 ALA MB 3.340 . 3.340 2.362 2.212 2.555 . 0 0 "[ . 1 . 2]" 1
334 1 55 ALA MB 1 65 VAL HB 3.680 . 3.680 2.857 2.824 2.870 . 0 0 "[ . 1 . 2]" 1
335 1 12 MET H 1 15 ALA MB 5.350 . 5.350 5.052 4.978 5.108 . 0 0 "[ . 1 . 2]" 1
336 1 50 ILE MG 1 51 VAL MG2 3.240 . 3.240 3.277 3.263 3.309 0.069 12 0 "[ . 1 . 2]" 1
337 1 55 ALA HA 1 58 LEU MD1 3.960 . 3.960 3.223 3.196 3.250 . 0 0 "[ . 1 . 2]" 1
338 1 151 GLN HA 1 154 GLN H 4.000 . 4.000 3.401 3.226 3.567 . 0 0 "[ . 1 . 2]" 1
339 1 146 LEU H 1 147 PHE H 3.870 . 3.870 2.761 2.719 2.795 . 0 0 "[ . 1 . 2]" 1
340 1 86 ASP QB 1 87 LYS QG 4.190 . 4.190 3.662 3.443 4.320 0.130 2 0 "[ . 1 . 2]" 1
341 1 28 LYS H 1 29 HIS H 3.430 . 3.430 2.556 2.521 2.583 . 0 0 "[ . 1 . 2]" 1
342 1 95 VAL HB 1 96 MET H 3.910 . 3.910 2.552 2.491 2.616 . 0 0 "[ . 1 . 2]" 1
343 1 81 HIS H 1 82 THR H 3.810 . 3.810 2.602 2.465 2.757 . 0 0 "[ . 1 . 2]" 1
344 1 159 ILE HG12 1 176 ILE QG 3.530 . 3.530 2.202 2.138 2.246 . 0 0 "[ . 1 . 2]" 1
345 1 82 THR MG 1 85 VAL H 5.200 . 5.200 4.949 4.678 5.174 . 0 0 "[ . 1 . 2]" 1
346 1 105 GLU HA 1 108 LYS QD 3.850 . 3.850 3.491 2.929 3.862 0.012 2 0 "[ . 1 . 2]" 1
347 1 141 CYS HA 1 144 GLY H 4.960 . 4.960 3.554 3.452 3.652 . 0 0 "[ . 1 . 2]" 1
348 1 25 LEU H 1 26 LEU H 3.720 . 3.720 2.571 2.537 2.596 . 0 0 "[ . 1 . 2]" 1
349 1 80 ARG HA 1 80 ARG QG 3.540 . 3.540 2.754 2.371 3.059 . 0 0 "[ . 1 . 2]" 1
350 1 162 ASP H 1 174 LEU HA 4.460 . 4.460 4.471 4.447 4.487 0.027 3 0 "[ . 1 . 2]" 1
351 1 28 LYS HB2 1 28 LYS QG 2.640 . 2.640 2.372 2.295 2.475 . 0 0 "[ . 1 . 2]" 1
352 1 105 GLU H 1 106 VAL MG2 4.760 . 4.760 3.684 3.595 3.791 . 0 0 "[ . 1 . 2]" 1
353 1 81 HIS HB2 1 82 THR H 4.520 . 4.520 4.212 4.025 4.531 0.011 4 0 "[ . 1 . 2]" 1
354 1 104 LEU HA 1 104 LEU QD 3.590 . 3.590 3.131 3.113 3.153 . 0 0 "[ . 1 . 2]" 1
355 1 86 ASP H 1 86 ASP QB 2.830 . 2.830 2.262 2.221 2.299 . 0 0 "[ . 1 . 2]" 1
356 1 67 LYS HA 1 67 LYS HG2 3.640 . 3.640 3.300 3.233 3.373 . 0 0 "[ . 1 . 2]" 1
357 1 160 SER QB 1 175 ILE H 4.040 . 4.040 3.190 3.016 3.320 . 0 0 "[ . 1 . 2]" 1
358 1 22 TRP HA 1 26 LEU H 4.540 . 4.540 4.183 3.978 4.248 . 0 0 "[ . 1 . 2]" 1
359 1 123 LEU MD1 1 129 ALA H 3.400 . 3.400 2.615 2.549 2.693 . 0 0 "[ . 1 . 2]" 1
360 1 56 GLN QG 1 57 ARG H 4.320 . 4.320 4.101 4.061 4.144 . 0 0 "[ . 1 . 2]" 1
361 1 55 ALA HA 1 65 VAL MG2 2.800 . 2.800 2.190 2.183 2.198 . 0 0 "[ . 1 . 2]" 1
362 1 175 ILE MG 1 176 ILE H 3.790 . 3.790 2.874 2.819 2.919 . 0 0 "[ . 1 . 2]" 1
363 1 7 ASN H 1 7 ASN QB 3.820 . 3.820 2.257 2.239 2.294 . 0 0 "[ . 1 . 2]" 1
364 1 108 LYS QB 1 108 LYS QE 3.850 . 3.850 3.144 2.032 3.660 . 0 0 "[ . 1 . 2]" 1
365 1 25 LEU MD2 1 50 ILE HA 2.940 . 2.940 2.239 2.227 2.251 . 0 0 "[ . 1 . 2]" 1
366 1 73 LEU QB 1 145 LEU MD2 4.700 . 4.700 2.155 2.102 2.230 . 0 0 "[ . 1 . 2]" 1
367 1 64 ASP H 1 64 ASP HB2 3.510 . 3.510 2.744 2.731 2.756 . 0 0 "[ . 1 . 2]" 1
368 1 61 PRO HB2 1 63 GLN HG3 2.810 . 2.810 2.322 2.312 2.330 . 0 0 "[ . 1 . 2]" 1
369 1 60 MET HA 1 60 MET HG3 3.850 . 3.850 3.441 3.418 3.552 . 0 0 "[ . 1 . 2]" 1
370 1 59 ASN HA 1 60 MET H 3.070 . 3.070 2.511 2.493 2.586 . 0 0 "[ . 1 . 2]" 1
371 1 60 MET HA 1 61 PRO HG3 4.600 . 4.600 4.502 4.494 4.512 . 0 0 "[ . 1 . 2]" 1
372 1 119 ASN H 1 119 ASN QB 3.450 . 3.450 2.587 2.551 2.622 . 0 0 "[ . 1 . 2]" 1
373 1 13 VAL HB 1 22 TRP HB3 5.110 . 5.110 5.121 5.084 5.153 0.043 18 0 "[ . 1 . 2]" 1
374 1 72 PHE HA 1 76 GLY H 5.000 . 5.000 4.208 4.130 4.357 . 0 0 "[ . 1 . 2]" 1
375 1 14 VAL MG2 1 15 ALA H 4.100 . 4.100 4.107 4.082 4.122 0.022 16 0 "[ . 1 . 2]" 1
376 1 13 VAL HA 1 15 ALA H 4.570 . 4.570 3.835 3.816 3.858 . 0 0 "[ . 1 . 2]" 1
377 1 126 ASN QB 1 127 GLN H 4.480 . 4.480 3.952 3.901 4.092 . 0 0 "[ . 1 . 2]" 1
378 1 52 GLN HA 1 56 GLN H 5.000 . 5.000 4.758 4.609 4.784 . 0 0 "[ . 1 . 2]" 1
379 1 128 ILE MG 1 176 ILE HB 3.880 . 3.880 3.897 3.847 3.947 0.067 12 0 "[ . 1 . 2]" 1
380 1 147 PHE QE 1 159 ILE HG13 4.160 . 4.160 3.076 2.923 3.236 . 0 0 "[ . 1 . 2]" 1
381 1 95 VAL MG2 1 149 ALA MB 5.230 . 5.230 4.606 4.322 4.878 . 0 0 "[ . 1 . 2]" 1
382 1 94 LEU H 1 95 VAL H 3.920 . 3.920 2.825 2.701 2.986 . 0 0 "[ . 1 . 2]" 1
383 1 69 PHE H 1 69 PHE QE 4.880 . 4.880 4.594 4.532 4.760 . 0 0 "[ . 1 . 2]" 1
384 1 133 SER H 1 134 SER H 4.710 . 4.710 4.203 4.178 4.248 . 0 0 "[ . 1 . 2]" 1
385 1 123 LEU H 1 127 GLN H 5.000 . 5.000 3.953 3.894 4.071 . 0 0 "[ . 1 . 2]" 1
386 1 82 THR MG 1 86 ASP H 4.850 . 4.850 3.617 3.472 3.915 . 0 0 "[ . 1 . 2]" 1
387 1 71 GLN HA 1 71 GLN HG2 3.520 . 3.520 2.501 2.399 2.553 . 0 0 "[ . 1 . 2]" 1
388 1 95 VAL H 1 96 MET H 3.570 . 3.570 3.081 2.979 3.187 . 0 0 "[ . 1 . 2]" 1
389 1 157 ILE HA 1 179 GLN QG 3.700 . 3.700 2.837 2.658 2.916 . 0 0 "[ . 1 . 2]" 1
390 1 32 LYS HA 1 33 ASP H 3.500 . 3.500 3.538 3.478 3.569 0.069 3 0 "[ . 1 . 2]" 1
391 1 175 ILE H 1 175 ILE QG . . 4.020 2.271 2.196 2.401 . 0 0 "[ . 1 . 2]" 1
392 1 78 ALA MB 1 85 VAL H 5.200 . 5.200 5.266 5.224 5.298 0.098 3 0 "[ . 1 . 2]" 1
393 1 129 ALA HA 1 175 ILE QG 5.480 . 5.480 4.275 4.241 4.300 . 0 0 "[ . 1 . 2]" 1
394 1 167 THR HA 1 168 GLY H 3.000 . 3.000 3.023 2.950 3.056 0.056 15 0 "[ . 1 . 2]" 1
395 1 67 LYS HA 1 67 LYS QE 4.190 . 4.190 3.411 3.290 3.537 . 0 0 "[ . 1 . 2]" 1
396 1 153 PHE H 1 153 PHE QE 4.430 . 4.430 4.414 4.357 4.453 0.023 19 0 "[ . 1 . 2]" 1
397 1 71 GLN H 1 71 GLN HB2 3.380 . 3.380 2.310 2.228 2.393 . 0 0 "[ . 1 . 2]" 1
398 1 143 GLU HA 1 143 GLU HG2 4.000 . 4.000 2.431 2.378 2.493 . 0 0 "[ . 1 . 2]" 1
399 1 12 MET H 1 12 MET HG2 3.760 . 3.760 2.982 1.910 3.125 . 0 0 "[ . 1 . 2]" 1
400 1 65 VAL H 1 65 VAL MG1 3.800 . 3.800 3.748 3.743 3.751 . 0 0 "[ . 1 . 2]" 1
401 1 48 PHE HA 1 51 VAL MG1 4.820 . 4.820 3.970 3.888 4.051 . 0 0 "[ . 1 . 2]" 1
402 1 9 LEU HG 1 13 VAL MG1 3.670 . 3.670 2.942 2.881 3.034 . 0 0 "[ . 1 . 2]" 1
403 1 62 ILE HA 1 62 ILE HG13 3.270 . 3.270 2.374 2.366 2.385 . 0 0 "[ . 1 . 2]" 1
404 1 69 PHE HA 1 69 PHE QE 4.370 . 4.370 4.222 4.184 4.240 . 0 0 "[ . 1 . 2]" 1
405 1 73 LEU H 1 73 LEU MD1 4.410 . 4.410 3.513 3.390 3.623 . 0 0 "[ . 1 . 2]" 1
406 1 151 GLN H 1 152 HIS H 3.000 . 3.000 2.710 2.671 2.759 . 0 0 "[ . 1 . 2]" 1
407 1 80 ARG H 1 80 ARG QD 5.120 . 5.120 3.898 3.135 4.599 . 0 0 "[ . 1 . 2]" 1
408 1 46 GLU HA 1 46 GLU QG 3.280 . 3.280 2.576 2.285 3.298 0.018 12 0 "[ . 1 . 2]" 1
409 1 9 LEU MD2 1 47 LEU HG 3.750 . 3.750 3.817 3.795 3.836 0.086 17 0 "[ . 1 . 2]" 1
410 1 73 LEU MD1 1 74 PHE H 5.150 . 5.150 4.791 4.768 4.804 . 0 0 "[ . 1 . 2]" 1
411 1 42 TYR QB 1 43 ALA H 3.740 . 3.740 2.516 1.783 3.572 . 0 0 "[ . 1 . 2]" 1
412 1 66 VAL HB 1 67 LYS H 4.000 . 4.000 3.943 3.926 3.967 . 0 0 "[ . 1 . 2]" 1
413 1 57 ARG H 1 58 LEU H 3.600 . 3.600 2.589 2.572 2.602 . 0 0 "[ . 1 . 2]" 1
414 1 132 TYR HA 1 132 TYR QE 5.500 . 5.500 4.577 4.394 4.815 . 0 0 "[ . 1 . 2]" 1
415 1 32 LYS H 1 32 LYS HB3 3.420 . 3.420 2.585 2.454 2.692 . 0 0 "[ . 1 . 2]" 1
416 1 85 VAL H 1 86 ASP HA 5.450 . 5.450 5.371 5.317 5.413 . 0 0 "[ . 1 . 2]" 1
417 1 95 VAL HA 1 95 VAL MG1 2.890 . 2.890 2.377 2.312 2.474 . 0 0 "[ . 1 . 2]" 1
418 1 127 GLN HB2 1 175 ILE MG 5.070 . 5.070 4.344 4.177 4.518 . 0 0 "[ . 1 . 2]" 1
419 1 120 GLY HA3 1 121 GLN H 4.000 . 4.000 3.177 3.156 3.201 . 0 0 "[ . 1 . 2]" 1
420 1 104 LEU QD 1 107 ASN HB2 5.490 . 5.490 5.135 4.797 5.335 . 0 0 "[ . 1 . 2]" 1
421 1 121 GLN HA 1 121 GLN HB2 2.910 . 2.910 2.486 2.463 2.510 . 0 0 "[ . 1 . 2]" 1
422 1 99 HIS H 1 102 ILE MD 4.840 . 4.840 4.936 4.914 4.973 0.133 3 0 "[ . 1 . 2]" 1
423 1 74 PHE HA 1 145 LEU HB3 5.320 . 5.320 5.096 4.883 5.216 . 0 0 "[ . 1 . 2]" 1
424 1 61 PRO HB3 1 64 ASP H 5.000 . 5.000 4.634 4.623 4.650 . 0 0 "[ . 1 . 2]" 1
425 1 62 ILE H 1 64 ASP H 4.930 . 4.930 4.406 4.397 4.420 . 0 0 "[ . 1 . 2]" 1
426 1 132 TYR H 1 173 MET HA 5.000 . 5.000 3.808 3.707 4.064 . 0 0 "[ . 1 . 2]" 1
427 1 74 PHE QD 1 85 VAL QG 5.250 . 5.250 4.326 4.014 4.520 . 0 0 "[ . 1 . 2]" 1
428 1 74 PHE QE 1 75 ASN HA 4.760 . 4.760 4.720 4.499 4.798 0.038 11 0 "[ . 1 . 2]" 1
429 1 5 ILE MD 1 73 LEU HG 3.660 . 3.660 3.609 3.529 3.699 0.039 16 0 "[ . 1 . 2]" 1
430 1 122 LEU H 1 129 ALA MB 5.330 . 5.330 5.363 5.262 5.399 0.069 8 0 "[ . 1 . 2]" 1
431 1 71 GLN HG3 1 148 GLY H 4.350 . 4.350 3.632 3.473 3.751 . 0 0 "[ . 1 . 2]" 1
432 1 165 MET HB3 1 166 HIS H 4.740 . 4.740 3.515 2.802 4.436 . 0 0 "[ . 1 . 2]" 1
433 1 52 GLN QB 1 52 GLN HG3 2.400 . 2.400 2.326 2.321 2.333 . 0 0 "[ . 1 . 2]" 1
434 1 9 LEU MD2 1 50 ILE MG 2.850 . 2.850 2.440 2.364 2.515 . 0 0 "[ . 1 . 2]" 1
435 1 21 VAL H 1 21 VAL MG2 3.850 . 3.850 3.710 3.687 3.727 . 0 0 "[ . 1 . 2]" 1
436 1 13 VAL MG2 1 14 VAL MG2 2.580 . 2.580 2.232 2.213 2.262 . 0 0 "[ . 1 . 2]" 1
437 1 97 GLY HA3 1 101 VAL H 4.000 . 4.000 4.023 3.981 4.056 0.056 16 0 "[ . 1 . 2]" 1
438 1 74 PHE QE 1 149 ALA MB 3.610 . 3.610 2.530 2.389 2.723 . 0 0 "[ . 1 . 2]" 1
439 1 82 THR MG 1 85 VAL QG 3.840 . 3.840 3.817 3.211 3.904 0.064 10 0 "[ . 1 . 2]" 1
440 1 54 VAL H 1 54 VAL HB 3.320 . 3.320 2.269 2.248 2.281 . 0 0 "[ . 1 . 2]" 1
441 1 140 PHE H 1 143 GLU QB 5.500 . 5.500 5.438 5.194 5.532 0.032 13 0 "[ . 1 . 2]" 1
442 1 22 TRP HH2 1 69 PHE QE 4.700 . 4.700 4.746 4.716 4.782 0.082 20 0 "[ . 1 . 2]" 1
443 1 57 ARG H 1 57 ARG HD2 4.310 . 4.310 3.347 3.193 3.372 . 0 0 "[ . 1 . 2]" 1
444 1 15 ALA MB 1 16 GLN HA 4.000 . 4.000 3.963 3.941 3.977 . 0 0 "[ . 1 . 2]" 1
445 1 121 GLN H 1 131 ARG H 4.300 . 4.300 4.427 4.402 4.460 0.160 1 0 "[ . 1 . 2]" 1
446 1 37 VAL HA 1 37 VAL MG2 2.720 . 2.720 2.462 2.412 2.552 . 0 0 "[ . 1 . 2]" 1
447 1 117 HIS QB 1 133 SER HB3 3.480 . 3.480 3.432 2.953 3.514 0.034 19 0 "[ . 1 . 2]" 1
448 1 6 PHE HA 1 6 PHE QE 4.960 . 4.960 4.629 4.551 4.667 . 0 0 "[ . 1 . 2]" 1
449 1 146 LEU HA 1 149 ALA H 4.000 . 4.000 3.753 3.695 3.831 . 0 0 "[ . 1 . 2]" 1
450 1 9 LEU MD2 1 13 VAL MG1 4.000 . 4.000 3.496 3.454 3.581 . 0 0 "[ . 1 . 2]" 1
451 1 70 GLY HA3 1 73 LEU MD2 4.800 . 4.800 4.823 4.808 4.851 0.051 3 0 "[ . 1 . 2]" 1
452 1 74 PHE HZ 1 94 LEU QD 3.240 . 3.240 2.218 2.047 2.526 . 0 0 "[ . 1 . 2]" 1
453 1 139 CYS H 1 141 CYS H 4.450 . 4.450 4.332 4.269 4.432 . 0 0 "[ . 1 . 2]" 1
454 1 91 PHE QD 1 157 ILE MD 4.450 . 4.450 3.962 3.884 4.049 . 0 0 "[ . 1 . 2]" 1
455 1 25 LEU MD1 1 50 ILE QG 4.120 . 4.120 3.419 3.347 3.523 . 0 0 "[ . 1 . 2]" 1
456 1 25 LEU MD2 1 50 ILE QG 3.320 . 3.320 2.025 2.011 2.033 . 0 0 "[ . 1 . 2]" 1
457 1 48 PHE QD 1 49 SER H 5.190 . 5.190 3.659 3.552 4.038 . 0 0 "[ . 1 . 2]" 1
458 1 73 LEU HA 1 73 LEU HG 3.740 . 3.740 2.373 2.332 2.409 . 0 0 "[ . 1 . 2]" 1
459 1 51 VAL H 1 51 VAL MG1 3.950 . 3.950 3.727 3.719 3.731 . 0 0 "[ . 1 . 2]" 1
460 1 4 ILE HA 1 7 ASN H 4.130 . 4.130 3.427 3.272 3.578 . 0 0 "[ . 1 . 2]" 1
461 1 130 LEU HB3 1 130 LEU MD1 3.240 . 3.240 3.062 2.851 3.133 . 0 0 "[ . 1 . 2]" 1
462 1 168 GLY HA3 1 169 ALA H 4.000 . 4.000 3.173 3.119 3.246 . 0 0 "[ . 1 . 2]" 1
463 1 53 ASP HA 1 57 ARG H 4.300 . 4.300 4.417 4.372 4.436 0.136 15 0 "[ . 1 . 2]" 1
464 1 87 LYS QE 1 87 LYS QG . . 3.270 2.748 2.396 2.905 . 0 0 "[ . 1 . 2]" 1
465 1 37 VAL H 1 37 VAL MG2 3.340 . 3.340 2.295 2.148 2.664 . 0 0 "[ . 1 . 2]" 1
466 1 32 LYS HA 1 32 LYS QD 4.210 . 4.210 3.941 2.291 4.155 . 0 0 "[ . 1 . 2]" 1
467 1 85 VAL HA 1 85 VAL QG . . 3.110 2.057 2.043 2.131 . 0 0 "[ . 1 . 2]" 1
468 1 164 CYS QB 1 167 THR H . . 4.560 3.312 2.889 4.099 . 0 0 "[ . 1 . 2]" 1
469 1 4 ILE HB 1 38 SER HB2 3.730 . 3.730 2.667 2.447 2.852 . 0 0 "[ . 1 . 2]" 1
470 1 147 PHE HA 1 157 ILE MG 5.500 . 5.500 5.393 5.150 5.539 0.039 16 0 "[ . 1 . 2]" 1
471 1 161 HIS HA 1 174 LEU HA 3.640 . 3.640 2.838 2.802 2.928 . 0 0 "[ . 1 . 2]" 1
472 1 52 GLN QB 1 62 ILE MG 4.140 . 4.140 4.186 4.174 4.198 0.058 5 0 "[ . 1 . 2]" 1
473 1 53 ASP H 1 55 ALA MB 4.730 . 4.730 4.506 4.495 4.518 . 0 0 "[ . 1 . 2]" 1
474 1 37 VAL MG1 1 40 LYS QE 4.390 . 4.390 4.177 4.039 4.421 0.031 12 0 "[ . 1 . 2]" 1
475 1 5 ILE MG 1 73 LEU MD2 3.810 . 3.810 2.243 2.181 2.409 . 0 0 "[ . 1 . 2]" 1
476 1 172 CYS HB2 1 174 LEU MD1 3.870 . 3.870 3.333 2.996 4.061 0.191 9 0 "[ . 1 . 2]" 1
477 1 25 LEU MD1 1 26 LEU H 3.590 . 3.590 1.827 1.763 1.853 . 0 0 "[ . 1 . 2]" 1
478 1 106 VAL MG1 1 115 LEU MD2 4.900 . 4.900 4.798 4.025 5.012 0.112 17 0 "[ . 1 . 2]" 1
479 1 6 PHE QD 1 7 ASN H 4.370 . 4.370 3.938 3.867 4.078 . 0 0 "[ . 1 . 2]" 1
480 1 156 LYS QD 1 156 LYS QG 2.400 . 2.400 2.029 2.009 2.057 . 0 0 "[ . 1 . 2]" 1
481 1 22 TRP HA 1 22 TRP HZ3 4.340 . 4.340 4.486 4.463 4.500 0.160 3 0 "[ . 1 . 2]" 1
482 1 155 GLN QB 1 156 LYS H 5.000 . 5.000 3.983 3.916 4.053 . 0 0 "[ . 1 . 2]" 1
483 1 138 LEU HA 1 139 CYS H 4.000 . 4.000 2.813 2.152 3.157 . 0 0 "[ . 1 . 2]" 1
484 1 120 GLY HA2 1 130 LEU MD1 3.570 . 3.570 2.739 2.396 3.540 . 0 0 "[ . 1 . 2]" 1
485 1 87 LYS H 1 87 LYS QE 4.690 . 4.690 4.609 4.201 4.754 0.064 3 0 "[ . 1 . 2]" 1
486 1 171 HIS H 1 171 HIS HD1 4.370 . 4.370 2.784 1.635 3.796 . 0 0 "[ . 1 . 2]" 1
487 1 5 ILE HB 1 6 PHE H 4.340 . 4.340 2.501 2.412 2.599 . 0 0 "[ . 1 . 2]" 1
488 1 166 HIS HA 1 167 THR H 4.000 . 4.000 3.455 3.423 3.468 . 0 0 "[ . 1 . 2]" 1
489 1 13 VAL H 1 22 TRP HE1 5.000 . 5.000 5.050 5.038 5.098 0.098 20 0 "[ . 1 . 2]" 1
490 1 143 GLU HG2 1 159 ILE HB 3.990 . 3.990 4.013 3.863 4.078 0.088 10 0 "[ . 1 . 2]" 1
491 1 33 ASP H 1 34 ARG H 3.910 . 3.910 3.095 2.511 3.908 . 0 0 "[ . 1 . 2]" 1
492 1 145 LEU H 1 145 LEU MD2 4.270 . 4.270 3.725 3.401 3.883 . 0 0 "[ . 1 . 2]" 1
493 1 145 LEU H 1 146 LEU QB 4.760 . 4.760 4.736 4.668 4.776 0.016 18 0 "[ . 1 . 2]" 1
494 1 158 GLN H 1 177 GLU QB 3.840 . 3.840 3.302 3.181 3.454 . 0 0 "[ . 1 . 2]" 1
495 1 77 LEU MD1 1 145 LEU MD2 3.940 . 3.940 2.896 2.697 3.085 . 0 0 "[ . 1 . 2]" 1
496 1 54 VAL HA 1 57 ARG H 4.060 . 4.060 3.622 3.602 3.686 . 0 0 "[ . 1 . 2]" 1
497 1 13 VAL MG1 1 22 TRP H 5.340 . 5.340 5.190 5.158 5.272 . 0 0 "[ . 1 . 2]" 1
498 1 16 GLN HA 1 17 CYS H 4.000 . 4.000 3.579 3.575 3.582 . 0 0 "[ . 1 . 2]" 1
499 1 43 ALA MB 1 46 GLU QB 3.580 . 3.580 3.202 2.277 3.615 0.035 11 0 "[ . 1 . 2]" 1
500 1 65 VAL HA 1 68 ALA MB 3.120 . 3.120 2.884 2.815 2.976 . 0 0 "[ . 1 . 2]" 1
501 1 23 ASN QD 1 24 GLU H 4.630 . 4.630 4.183 3.298 4.640 0.010 10 0 "[ . 1 . 2]" 1
502 1 84 VAL H 1 85 VAL H 3.300 . 3.300 2.610 2.527 2.675 . 0 0 "[ . 1 . 2]" 1
503 1 66 VAL MG1 1 67 LYS H 3.820 . 3.820 2.010 1.973 2.058 . 0 0 "[ . 1 . 2]" 1
504 1 16 GLN HB3 1 58 LEU MD2 3.950 . 3.950 2.282 2.214 2.335 . 0 0 "[ . 1 . 2]" 1
505 1 52 GLN HA 1 55 ALA H 4.000 . 4.000 3.796 3.773 3.810 . 0 0 "[ . 1 . 2]" 1
506 1 52 GLN QB 1 62 ILE HG13 3.270 . 3.270 3.233 3.183 3.277 0.007 17 0 "[ . 1 . 2]" 1
507 1 9 LEU HB2 1 47 LEU MD1 4.280 . 4.280 3.591 3.532 3.637 . 0 0 "[ . 1 . 2]" 1
508 1 95 VAL MG1 1 128 ILE MD 3.710 . 3.710 2.522 2.406 2.650 . 0 0 "[ . 1 . 2]" 1
509 1 55 ALA HA 1 65 VAL HB 4.570 . 4.570 4.633 4.620 4.645 0.075 14 0 "[ . 1 . 2]" 1
510 1 57 ARG QG 1 58 LEU H 3.490 . 3.490 2.018 1.955 2.054 . 0 0 "[ . 1 . 2]" 1
511 1 166 HIS QB 1 167 THR H . . 4.010 3.174 3.046 3.782 . 0 0 "[ . 1 . 2]" 1
512 1 72 PHE H 1 73 LEU H 3.720 . 3.720 2.580 2.536 2.626 . 0 0 "[ . 1 . 2]" 1
513 1 13 VAL H 1 22 TRP HZ3 5.500 . 5.500 5.594 5.571 5.696 0.196 20 0 "[ . 1 . 2]" 1
514 1 166 HIS H 1 167 THR H 3.450 . 3.450 2.609 2.502 2.735 . 0 0 "[ . 1 . 2]" 1
515 1 155 GLN HA 1 155 GLN HE21 4.070 . 4.070 2.881 2.611 3.030 . 0 0 "[ . 1 . 2]" 1
516 1 77 LEU H 1 78 ALA H 3.660 . 3.660 2.887 2.841 2.946 . 0 0 "[ . 1 . 2]" 1
517 1 63 GLN HB2 1 64 ASP H 4.130 . 4.130 3.663 3.635 3.680 . 0 0 "[ . 1 . 2]" 1
518 1 123 LEU HG 1 129 ALA H 3.450 . 3.450 2.521 2.300 2.592 . 0 0 "[ . 1 . 2]" 1
519 1 153 PHE HA 1 153 PHE QD 3.560 . 3.560 2.317 2.289 2.569 . 0 0 "[ . 1 . 2]" 1
520 1 6 PHE HA 1 9 LEU MD2 3.230 . 3.230 3.129 3.049 3.209 . 0 0 "[ . 1 . 2]" 1
521 1 55 ALA HA 1 60 MET H 4.550 . 4.550 3.453 3.375 3.480 . 0 0 "[ . 1 . 2]" 1
522 1 154 GLN H 1 154 GLN HA 2.770 . 2.770 2.317 2.311 2.324 . 0 0 "[ . 1 . 2]" 1
523 1 26 LEU H 1 30 ALA MB 5.500 . 5.500 5.532 5.482 5.579 0.079 14 0 "[ . 1 . 2]" 1
524 1 180 ASN HA 1 180 ASN QB 2.660 . 2.660 2.248 2.181 2.402 . 0 0 "[ . 1 . 2]" 1
525 1 106 VAL HB 1 107 ASN H 4.140 . 4.140 3.883 3.758 4.089 . 0 0 "[ . 1 . 2]" 1
526 1 22 TRP HZ3 1 25 LEU MD1 4.170 . 4.170 3.604 3.547 3.669 . 0 0 "[ . 1 . 2]" 1
527 1 56 GLN H 1 56 GLN QB 3.060 . 3.060 2.344 2.333 2.356 . 0 0 "[ . 1 . 2]" 1
528 1 71 GLN HA 1 148 GLY HA2 3.680 . 3.680 3.139 2.896 3.690 0.010 18 0 "[ . 1 . 2]" 1
529 1 23 ASN QB 1 24 GLU H 3.250 . 3.250 2.846 2.824 2.876 . 0 0 "[ . 1 . 2]" 1
530 1 138 LEU QB 1 141 CYS HB2 4.170 . 4.170 3.647 2.930 4.328 0.158 7 0 "[ . 1 . 2]" 1
531 1 140 PHE H 1 140 PHE QE 5.500 . 5.500 5.336 4.829 5.649 0.149 17 0 "[ . 1 . 2]" 1
532 1 123 LEU QB 1 129 ALA MB 4.170 . 4.170 4.037 3.991 4.195 0.025 19 0 "[ . 1 . 2]" 1
533 1 140 PHE HA 1 140 PHE QE 4.150 . 4.150 4.160 4.147 4.168 0.018 10 0 "[ . 1 . 2]" 1
534 1 73 LEU MD2 1 77 LEU HG 4.230 . 4.230 3.798 3.641 3.975 . 0 0 "[ . 1 . 2]" 1
535 1 51 VAL HB 1 52 GLN H 3.870 . 3.870 2.781 2.753 2.812 . 0 0 "[ . 1 . 2]" 1
536 1 145 LEU H 1 145 LEU MD1 3.950 . 3.950 3.399 3.295 3.459 . 0 0 "[ . 1 . 2]" 1
537 1 128 ILE HA 1 128 ILE QG 3.850 . 3.850 2.480 2.445 2.543 . 0 0 "[ . 1 . 2]" 1
538 1 71 GLN H 1 71 GLN HG3 3.910 . 3.910 2.531 2.383 2.756 . 0 0 "[ . 1 . 2]" 1
539 1 55 ALA HA 1 65 VAL MG1 3.730 . 3.730 3.454 3.428 3.480 . 0 0 "[ . 1 . 2]" 1
540 1 42 TYR QD 1 43 ALA H 4.610 . 4.610 3.586 2.568 4.623 0.013 20 0 "[ . 1 . 2]" 1
541 1 12 MET QB 1 69 PHE QD 4.730 . 4.730 4.272 4.140 4.742 0.012 20 0 "[ . 1 . 2]" 1
542 1 77 LEU MD2 1 79 SER H 5.500 . 5.500 5.564 5.523 5.617 0.117 16 0 "[ . 1 . 2]" 1
543 1 91 PHE HZ 1 157 ILE MG 4.200 . 4.200 4.088 3.944 4.198 . 0 0 "[ . 1 . 2]" 1
544 1 70 GLY HA2 1 145 LEU H 4.640 . 4.640 4.286 3.956 4.607 . 0 0 "[ . 1 . 2]" 1
545 1 106 VAL H 1 107 ASN H 3.690 . 3.690 2.692 2.370 2.868 . 0 0 "[ . 1 . 2]" 1
546 1 151 GLN H 1 152 HIS QB 5.180 . 5.180 4.396 4.332 4.650 . 0 0 "[ . 1 . 2]" 1
547 1 166 HIS H 1 167 THR HA 5.460 . 5.460 5.236 5.155 5.330 . 0 0 "[ . 1 . 2]" 1
548 1 66 VAL H 1 66 VAL HB 3.420 . 3.420 2.591 2.542 2.633 . 0 0 "[ . 1 . 2]" 1
549 1 5 ILE H 1 6 PHE QD 5.030 . 5.030 3.533 3.290 3.935 . 0 0 "[ . 1 . 2]" 1
550 1 143 GLU HA 1 147 PHE H 4.710 . 4.710 4.547 4.447 4.698 . 0 0 "[ . 1 . 2]" 1
551 1 91 PHE QE 1 128 ILE MG 5.500 . 5.500 5.043 4.892 5.301 . 0 0 "[ . 1 . 2]" 1
552 1 170 ASP H 1 170 ASP QB 3.650 . 3.650 2.428 2.298 2.689 . 0 0 "[ . 1 . 2]" 1
553 1 25 LEU QB 1 25 LEU MD2 2.400 . 2.400 2.186 2.181 2.195 . 0 0 "[ . 1 . 2]" 1
554 1 32 LYS HB2 1 32 LYS QE 3.060 . 3.060 2.485 2.285 3.130 0.070 10 0 "[ . 1 . 2]" 1
555 1 143 GLU QB 1 147 PHE QE 5.060 . 5.060 2.358 2.315 2.471 . 0 0 "[ . 1 . 2]" 1
556 1 101 VAL H 1 101 VAL HB 4.020 . 4.020 3.558 3.551 3.564 . 0 0 "[ . 1 . 2]" 1
557 1 160 SER H 1 176 ILE MG 5.450 . 5.450 5.428 5.386 5.467 0.017 8 0 "[ . 1 . 2]" 1
558 1 22 TRP HZ3 1 69 PHE QE 4.040 . 4.040 4.099 4.075 4.132 0.092 20 0 "[ . 1 . 2]" 1
559 1 145 LEU HA 1 145 LEU MD1 4.310 . 4.310 3.819 3.801 3.840 . 0 0 "[ . 1 . 2]" 1
560 1 51 VAL MG1 1 66 VAL HB 2.560 . 2.560 2.466 2.434 2.492 . 0 0 "[ . 1 . 2]" 1
561 1 17 CYS HB3 1 21 VAL H 4.160 . 4.160 4.117 4.092 4.151 . 0 0 "[ . 1 . 2]" 1
562 1 67 LYS HA 1 71 GLN H 4.800 . 4.800 4.653 4.454 4.839 0.039 14 0 "[ . 1 . 2]" 1
563 1 17 CYS HB3 1 21 VAL HB 3.660 . 3.660 2.324 2.313 2.338 . 0 0 "[ . 1 . 2]" 1
564 1 67 LYS QE 1 67 LYS HG2 3.420 . 3.420 3.316 3.259 3.439 0.019 1 0 "[ . 1 . 2]" 1
565 1 159 ILE HG12 1 176 ILE HA 3.830 . 3.830 2.669 2.591 2.762 . 0 0 "[ . 1 . 2]" 1
566 1 61 PRO HG2 1 63 GLN H 4.620 . 4.620 4.153 4.118 4.177 . 0 0 "[ . 1 . 2]" 1
567 1 159 ILE H 1 159 ILE MG 3.900 . 3.900 3.861 3.839 3.875 . 0 0 "[ . 1 . 2]" 1
568 1 107 ASN H 1 107 ASN HB2 3.830 . 3.830 2.392 2.213 2.550 . 0 0 "[ . 1 . 2]" 1
569 1 175 ILE HA 1 176 ILE H 3.450 . 3.450 2.163 2.159 2.169 . 0 0 "[ . 1 . 2]" 1
570 1 164 CYS HA 1 172 CYS HA 3.580 . 3.580 2.862 2.519 3.151 . 0 0 "[ . 1 . 2]" 1
571 1 22 TRP HZ2 1 50 ILE MG 4.750 . 4.750 4.103 4.047 4.199 . 0 0 "[ . 1 . 2]" 1
572 1 144 GLY HA2 1 147 PHE QE 5.050 . 5.050 4.422 4.340 4.520 . 0 0 "[ . 1 . 2]" 1
573 1 66 VAL HA 1 69 PHE H 4.010 . 4.010 3.681 3.656 3.724 . 0 0 "[ . 1 . 2]" 1
574 1 154 GLN H 1 154 GLN HB2 3.150 . 3.150 2.863 2.813 3.222 0.072 4 0 "[ . 1 . 2]" 1
575 1 78 ALA MB 1 85 VAL QG 2.400 . 2.400 2.390 2.282 2.445 0.045 4 0 "[ . 1 . 2]" 1
576 1 159 ILE HG12 1 176 ILE HB 4.980 . 4.980 4.460 4.403 4.522 . 0 0 "[ . 1 . 2]" 1
577 1 24 GLU HA 1 24 GLU QG . . 3.240 2.317 2.194 2.463 . 0 0 "[ . 1 . 2]" 1
578 1 47 LEU MD1 1 51 VAL H 4.850 . 4.850 4.716 4.679 4.770 . 0 0 "[ . 1 . 2]" 1
579 1 71 GLN H 1 71 GLN HG2 4.230 . 4.230 3.828 3.640 3.996 . 0 0 "[ . 1 . 2]" 1
580 1 87 LYS QD 1 87 LYS QG 2.460 . 2.460 2.030 2.003 2.040 . 0 0 "[ . 1 . 2]" 1
581 1 157 ILE MG 1 178 LEU MD2 2.800 . 2.800 2.014 1.994 2.045 . 0 0 "[ . 1 . 2]" 1
582 1 103 HIS HA 1 115 LEU MD1 4.550 . 4.550 3.016 2.713 3.444 . 0 0 "[ . 1 . 2]" 1
583 1 51 VAL MG1 1 62 ILE HG13 3.560 . 3.560 2.237 2.226 2.245 . 0 0 "[ . 1 . 2]" 1
584 1 54 VAL MG2 1 58 LEU MD1 2.580 . 2.580 1.967 1.959 1.973 . 0 0 "[ . 1 . 2]" 1
585 1 14 VAL MG1 1 19 MET QB 3.800 . 3.800 3.496 3.261 3.858 0.058 13 0 "[ . 1 . 2]" 1
586 1 9 LEU HA 1 11 ASP H 5.000 . 5.000 3.816 3.729 3.927 . 0 0 "[ . 1 . 2]" 1
587 1 51 VAL MG1 1 65 VAL HB 3.110 . 3.110 2.747 2.701 2.819 . 0 0 "[ . 1 . 2]" 1
588 1 25 LEU HA 1 25 LEU MD1 3.920 . 3.920 3.419 3.412 3.429 . 0 0 "[ . 1 . 2]" 1
589 1 176 ILE QG 1 177 GLU H 4.410 . 4.410 4.406 4.353 4.443 0.033 13 0 "[ . 1 . 2]" 1
590 1 43 ALA H 1 44 GLU H 5.000 . 5.000 2.831 2.562 3.356 . 0 0 "[ . 1 . 2]" 1
591 1 7 ASN H 1 8 VAL MG2 4.580 . 4.580 3.957 3.852 4.033 . 0 0 "[ . 1 . 2]" 1
592 1 50 ILE MG 1 51 VAL H 3.800 . 3.800 3.417 3.389 3.484 . 0 0 "[ . 1 . 2]" 1
593 1 163 THR HB 1 173 MET QB 3.320 . 3.320 2.197 2.179 2.208 . 0 0 "[ . 1 . 2]" 1
594 1 73 LEU HG 1 77 LEU H 4.660 . 4.660 4.271 4.134 4.430 . 0 0 "[ . 1 . 2]" 1
595 1 119 ASN H 1 131 ARG HG2 5.210 . 5.210 4.568 4.276 4.831 . 0 0 "[ . 1 . 2]" 1
596 1 3 GLY HA3 1 6 PHE HB3 4.680 . 4.680 4.548 4.382 4.689 0.009 7 0 "[ . 1 . 2]" 1
597 1 57 ARG H 1 57 ARG QG 3.490 . 3.490 1.797 1.776 1.803 . 0 0 "[ . 1 . 2]" 1
598 1 70 GLY HA3 1 141 CYS HA 3.790 . 3.790 3.632 3.423 3.831 0.041 2 0 "[ . 1 . 2]" 1
599 1 28 LYS HB2 1 28 LYS QE . . 3.490 2.555 2.147 3.085 . 0 0 "[ . 1 . 2]" 1
600 1 29 HIS HA 1 30 ALA H 5.000 . 5.000 3.305 3.261 3.378 . 0 0 "[ . 1 . 2]" 1
601 1 90 ASP QB 1 93 SER H 3.820 . 3.820 3.181 2.646 3.796 . 0 0 "[ . 1 . 2]" 1
602 1 120 GLY HA2 1 129 ALA H 5.000 . 5.000 5.041 5.013 5.070 0.070 5 0 "[ . 1 . 2]" 1
603 1 59 ASN HB3 1 60 MET H 4.180 . 4.180 4.319 4.296 4.324 0.144 8 0 "[ . 1 . 2]" 1
604 1 47 LEU HA 1 47 LEU MD2 4.190 . 4.190 3.835 3.822 3.852 . 0 0 "[ . 1 . 2]" 1
605 1 91 PHE QE 1 155 GLN QB 5.390 . 5.390 5.388 5.051 5.444 0.054 6 0 "[ . 1 . 2]" 1
606 1 75 ASN HB2 1 76 GLY H 4.070 . 4.070 2.482 2.353 2.646 . 0 0 "[ . 1 . 2]" 1
607 1 14 VAL H 1 22 TRP H 6.000 . 6.000 5.966 5.873 6.024 0.024 8 0 "[ . 1 . 2]" 1
608 1 47 LEU HA 1 47 LEU MD1 3.300 . 3.300 2.207 2.186 2.219 . 0 0 "[ . 1 . 2]" 1
609 1 170 ASP H 1 171 HIS HA 5.160 . 5.160 5.044 4.966 5.144 . 0 0 "[ . 1 . 2]" 1
610 1 117 HIS QB 1 133 SER HB2 4.390 . 4.390 3.762 2.286 4.395 0.005 3 0 "[ . 1 . 2]" 1
611 1 151 GLN QB 1 151 GLN QE . . 3.230 2.984 1.802 3.244 0.014 9 0 "[ . 1 . 2]" 1
612 1 155 GLN HA 1 155 GLN HE22 4.020 . 4.020 3.230 3.151 3.293 . 0 0 "[ . 1 . 2]" 1
613 1 27 GLU H 1 27 GLU QG 3.450 . 3.450 2.557 2.344 3.542 0.092 5 0 "[ . 1 . 2]" 1
614 1 74 PHE QE 1 78 ALA MB 3.790 . 3.790 3.069 2.780 3.543 . 0 0 "[ . 1 . 2]" 1
615 1 40 LYS HB2 1 40 LYS QD 3.470 . 3.470 3.446 3.440 3.520 0.050 12 0 "[ . 1 . 2]" 1
616 1 152 HIS H 1 152 HIS QB 3.370 . 3.370 2.254 2.160 2.557 . 0 0 "[ . 1 . 2]" 1
617 1 23 ASN HA 1 26 LEU HB2 3.720 . 3.720 3.632 3.591 3.749 0.029 12 0 "[ . 1 . 2]" 1
618 1 174 LEU HA 1 174 LEU MD1 3.730 . 3.730 2.420 2.356 2.466 . 0 0 "[ . 1 . 2]" 1
619 1 121 GLN QG 1 129 ALA MB 3.550 . 3.550 3.612 3.588 3.637 0.087 3 0 "[ . 1 . 2]" 1
620 1 155 GLN QG 1 178 LEU MD2 3.370 . 3.370 3.207 2.759 3.331 . 0 0 "[ . 1 . 2]" 1
621 1 51 VAL HA 1 51 VAL MG1 2.580 . 2.580 2.453 2.423 2.480 . 0 0 "[ . 1 . 2]" 1
622 1 30 ALA HA 1 46 GLU QG 4.520 . 4.520 4.185 3.224 4.572 0.052 18 0 "[ . 1 . 2]" 1
623 1 177 GLU QG 1 178 LEU H 3.980 . 3.980 2.717 2.577 4.013 0.033 13 0 "[ . 1 . 2]" 1
624 1 156 LYS HA 1 157 ILE H 2.910 . 2.910 2.199 2.162 2.218 . 0 0 "[ . 1 . 2]" 1
625 1 126 ASN H 1 127 GLN H 3.530 . 3.530 2.909 2.706 3.793 0.263 12 0 "[ . 1 . 2]" 1
626 1 4 ILE MD 1 38 SER HB3 4.250 . 4.250 4.167 4.042 4.271 0.021 16 0 "[ . 1 . 2]" 1
627 1 156 LYS HA 1 156 LYS QG 3.230 . 3.230 2.472 2.298 3.397 0.167 13 0 "[ . 1 . 2]" 1
628 1 24 GLU H 1 24 GLU HB2 2.960 . 2.960 2.111 2.088 2.138 . 0 0 "[ . 1 . 2]" 1
629 1 15 ALA MB 1 72 PHE QE 4.340 . 4.340 4.367 4.303 4.417 0.077 20 0 "[ . 1 . 2]" 1
630 1 42 TYR HA 1 42 TYR QE 4.840 . 4.840 4.528 4.440 4.681 . 0 0 "[ . 1 . 2]" 1
631 1 8 VAL MG1 1 73 LEU H 4.290 . 4.290 3.839 3.729 3.926 . 0 0 "[ . 1 . 2]" 1
632 1 12 MET HA 1 15 ALA MB 3.340 . 3.340 3.057 2.931 3.144 . 0 0 "[ . 1 . 2]" 1
633 1 122 LEU H 1 122 LEU HG 4.770 . 4.770 4.364 4.318 4.488 . 0 0 "[ . 1 . 2]" 1
634 1 143 GLU QB 1 146 LEU MD1 4.300 . 4.300 4.156 4.052 4.226 . 0 0 "[ . 1 . 2]" 1
635 1 63 GLN HB3 1 140 PHE QE 3.740 . 3.740 3.247 2.993 3.684 . 0 0 "[ . 1 . 2]" 1
636 1 87 LYS QD 1 101 VAL MG2 3.870 . 3.870 3.355 3.003 3.873 0.003 18 0 "[ . 1 . 2]" 1
637 1 35 VAL HA 1 35 VAL QG 2.980 . 2.980 2.369 2.075 2.523 . 0 0 "[ . 1 . 2]" 1
638 1 84 VAL H 1 84 VAL HB 3.110 . 3.110 2.447 2.337 2.525 . 0 0 "[ . 1 . 2]" 1
639 1 146 LEU MD1 1 176 ILE QG 3.090 . 3.090 2.518 2.386 2.634 . 0 0 "[ . 1 . 2]" 1
640 1 57 ARG HA 1 57 ARG HD3 5.500 . 5.500 5.481 5.465 5.484 . 0 0 "[ . 1 . 2]" 1
641 1 95 VAL HA 1 97 GLY H 4.130 . 4.130 4.128 4.047 4.205 0.075 8 0 "[ . 1 . 2]" 1
642 1 178 LEU HA 1 178 LEU MD1 4.030 . 4.030 3.898 3.877 3.920 . 0 0 "[ . 1 . 2]" 1
643 1 156 LYS QE 1 156 LYS QG . . 3.060 2.491 2.238 2.904 . 0 0 "[ . 1 . 2]" 1
644 1 4 ILE QG 1 4 ILE MG 3.050 . 3.050 2.108 2.102 2.114 . 0 0 "[ . 1 . 2]" 1
645 1 21 VAL HA 1 25 LEU H 4.420 . 4.420 3.876 3.835 3.927 . 0 0 "[ . 1 . 2]" 1
646 1 83 ASP H 1 84 VAL HA 5.360 . 5.360 5.334 5.294 5.371 0.011 15 0 "[ . 1 . 2]" 1
647 1 90 ASP H 1 91 PHE H 4.320 . 4.320 4.259 4.184 4.407 0.087 14 0 "[ . 1 . 2]" 1
648 1 127 GLN HA 1 127 GLN QG . . 3.680 2.320 2.283 2.359 . 0 0 "[ . 1 . 2]" 1
649 1 126 ASN H 1 178 LEU MD1 4.630 . 4.630 4.713 4.678 4.749 0.119 6 0 "[ . 1 . 2]" 1
650 1 91 PHE QD 1 128 ILE MD 4.250 . 4.250 3.332 3.215 3.564 . 0 0 "[ . 1 . 2]" 1
651 1 6 PHE HA 1 10 GLU H 4.070 . 4.070 3.753 3.671 3.869 . 0 0 "[ . 1 . 2]" 1
652 1 128 ILE MD 1 176 ILE HB 3.670 . 3.670 3.281 3.051 3.446 . 0 0 "[ . 1 . 2]" 1
653 1 85 VAL QG 1 86 ASP H 3.780 . 3.780 2.985 2.193 3.103 . 0 0 "[ . 1 . 2]" 1
654 1 120 GLY HA3 1 128 ILE MG 3.970 . 3.970 3.738 3.624 3.840 . 0 0 "[ . 1 . 2]" 1
655 1 130 LEU MD2 1 142 ALA MB 5.060 . 5.060 3.573 3.335 3.984 . 0 0 "[ . 1 . 2]" 1
656 1 157 ILE MD 1 159 ILE HG13 3.730 . 3.730 2.755 2.716 2.806 . 0 0 "[ . 1 . 2]" 1
657 1 108 LYS HG2 1 109 LEU H 5.000 . 5.000 4.886 3.897 5.033 0.033 3 0 "[ . 1 . 2]" 1
658 1 157 ILE HB 1 176 ILE MG 3.370 . 3.370 2.314 2.260 2.388 . 0 0 "[ . 1 . 2]" 1
659 1 91 PHE HZ 1 157 ILE MD 4.630 . 4.630 2.392 2.324 2.452 . 0 0 "[ . 1 . 2]" 1
660 1 64 ASP H 1 65 VAL MG2 5.500 . 5.500 3.815 3.775 3.872 . 0 0 "[ . 1 . 2]" 1
661 1 74 PHE QD 1 149 ALA HA 3.510 . 3.510 3.013 2.682 3.591 0.081 18 0 "[ . 1 . 2]" 1
662 1 46 GLU QG 1 47 LEU H 4.630 . 4.630 4.192 2.195 4.639 0.009 16 0 "[ . 1 . 2]" 1
663 1 58 LEU QB 1 60 MET H 3.960 . 3.960 3.638 3.540 3.663 . 0 0 "[ . 1 . 2]" 1
664 1 143 GLU HA 1 146 LEU QB 3.960 . 3.960 3.035 2.933 3.102 . 0 0 "[ . 1 . 2]" 1
665 1 73 LEU MD2 1 77 LEU MD1 4.230 . 4.230 2.173 2.001 2.292 . 0 0 "[ . 1 . 2]" 1
666 1 56 GLN QB 1 58 LEU H 4.450 . 4.450 4.554 4.545 4.574 0.124 18 0 "[ . 1 . 2]" 1
667 1 150 ALA H 1 151 GLN H 3.690 . 3.690 2.737 2.698 2.787 . 0 0 "[ . 1 . 2]" 1
668 1 62 ILE HA 1 62 ILE HB 2.920 . 2.920 2.502 2.494 2.508 . 0 0 "[ . 1 . 2]" 1
669 1 8 VAL H 1 8 VAL MG1 4.220 . 4.220 3.785 3.767 3.800 . 0 0 "[ . 1 . 2]" 1
670 1 132 TYR QD 1 133 SER H 4.460 . 4.460 2.997 2.460 3.336 . 0 0 "[ . 1 . 2]" 1
671 1 163 THR H 1 173 MET QB . . 3.800 2.747 2.610 2.819 . 0 0 "[ . 1 . 2]" 1
672 1 14 VAL H 1 14 VAL MG1 3.930 . 3.930 3.738 3.733 3.743 . 0 0 "[ . 1 . 2]" 1
673 1 106 VAL HA 1 109 LEU QB . . 4.060 2.308 2.278 2.342 . 0 0 "[ . 1 . 2]" 1
674 1 129 ALA HA 1 130 LEU HB3 4.460 . 4.460 4.545 4.501 4.574 0.114 8 0 "[ . 1 . 2]" 1
675 1 133 SER HB2 1 171 HIS HA 5.000 . 5.000 3.085 2.331 4.346 . 0 0 "[ . 1 . 2]" 1
676 1 14 VAL MG1 1 18 GLY HA2 3.110 . 3.110 2.713 2.613 2.821 . 0 0 "[ . 1 . 2]" 1
677 1 8 VAL MG1 1 74 PHE H 4.530 . 4.530 4.587 4.560 4.630 0.100 3 0 "[ . 1 . 2]" 1
678 1 106 VAL MG1 1 115 LEU MD1 4.320 . 4.320 4.257 3.936 4.411 0.091 8 0 "[ . 1 . 2]" 1
679 1 60 MET HB2 1 65 VAL MG1 4.640 . 4.640 4.224 4.186 4.265 . 0 0 "[ . 1 . 2]" 1
680 1 35 VAL QG 1 37 VAL MG2 2.780 . 2.780 2.193 1.766 2.811 0.031 6 0 "[ . 1 . 2]" 1
681 1 146 LEU MD1 1 159 ILE HG12 4.060 . 4.060 3.661 3.581 3.741 . 0 0 "[ . 1 . 2]" 1
682 1 153 PHE H 1 154 GLN H 2.900 . 2.900 2.659 2.536 2.783 . 0 0 "[ . 1 . 2]" 1
683 1 76 GLY H 1 77 LEU MD1 5.500 . 5.500 5.279 5.026 5.409 . 0 0 "[ . 1 . 2]" 1
684 1 95 VAL MG1 1 130 LEU HB2 3.490 . 3.490 2.845 2.661 2.982 . 0 0 "[ . 1 . 2]" 1
685 1 37 VAL HA 1 40 LYS H 4.580 . 4.580 4.431 4.302 4.582 0.002 5 0 "[ . 1 . 2]" 1
686 1 121 GLN QG 1 123 LEU H 4.870 . 4.870 4.809 4.696 4.891 0.021 6 0 "[ . 1 . 2]" 1
687 1 128 ILE HB 1 176 ILE HB 3.400 . 3.400 2.471 2.374 2.551 . 0 0 "[ . 1 . 2]" 1
688 1 26 LEU H 1 28 LYS H 4.330 . 4.330 3.797 3.711 3.851 . 0 0 "[ . 1 . 2]" 1
689 1 71 GLN H 1 71 GLN HB3 3.480 . 3.480 3.559 3.530 3.590 0.110 12 0 "[ . 1 . 2]" 1
690 1 48 PHE HB2 1 51 VAL MG2 5.500 . 5.500 5.142 4.972 5.558 0.058 17 0 "[ . 1 . 2]" 1
691 1 108 LYS H 1 109 LEU QD 4.750 . 4.750 3.963 3.480 4.798 0.048 2 0 "[ . 1 . 2]" 1
692 1 16 GLN HA 1 16 GLN HG2 3.130 . 3.130 2.341 2.334 2.358 . 0 0 "[ . 1 . 2]" 1
693 1 62 ILE HA 1 65 VAL HB 3.330 . 3.330 2.533 2.510 2.564 . 0 0 "[ . 1 . 2]" 1
694 1 4 ILE MG 1 38 SER HB3 4.240 . 4.240 3.281 2.738 3.509 . 0 0 "[ . 1 . 2]" 1
695 1 28 LYS HB2 1 28 LYS QD 3.290 . 3.290 2.680 2.274 3.121 . 0 0 "[ . 1 . 2]" 1
696 1 150 ALA MB 1 155 GLN QB . . 3.960 3.254 3.027 3.478 . 0 0 "[ . 1 . 2]" 1
697 1 143 GLU HA 1 146 LEU H 4.400 . 4.400 3.589 3.508 3.693 . 0 0 "[ . 1 . 2]" 1
698 1 159 ILE H 1 176 ILE MG 4.900 . 4.900 4.920 4.898 4.943 0.043 9 0 "[ . 1 . 2]" 1
699 1 32 LYS HB3 1 33 ASP H 4.070 . 4.070 2.565 2.301 2.977 . 0 0 "[ . 1 . 2]" 1
700 1 150 ALA HA 1 153 PHE H 3.900 . 3.900 3.862 3.772 3.913 0.013 19 0 "[ . 1 . 2]" 1
701 1 128 ILE H 1 128 ILE MG 4.640 . 4.640 3.919 3.896 3.927 . 0 0 "[ . 1 . 2]" 1
702 1 13 VAL MG1 1 22 TRP HZ3 3.010 . 3.010 2.735 2.649 2.750 . 0 0 "[ . 1 . 2]" 1
703 1 25 LEU QB 1 29 HIS HD1 . . 3.640 2.787 2.615 3.171 . 0 0 "[ . 1 . 2]" 1
704 1 82 THR HA 1 85 VAL HB 3.850 . 3.850 2.635 2.479 3.945 0.095 8 0 "[ . 1 . 2]" 1
705 1 29 HIS HD1 1 50 ILE QG 5.260 . 5.260 4.351 4.202 4.738 . 0 0 "[ . 1 . 2]" 1
706 1 63 GLN HA 1 66 VAL HB 4.390 . 4.390 4.231 4.176 4.274 . 0 0 "[ . 1 . 2]" 1
707 1 13 VAL MG1 1 22 TRP HH2 4.490 . 4.490 4.484 4.450 4.503 0.013 15 0 "[ . 1 . 2]" 1
708 1 130 LEU MD1 1 174 LEU MD2 5.000 . 5.000 4.953 4.528 5.070 0.070 14 0 "[ . 1 . 2]" 1
709 1 61 PRO HB2 1 64 ASP HB3 4.130 . 4.130 4.215 4.207 4.225 0.095 14 0 "[ . 1 . 2]" 1
710 1 37 VAL HB 1 40 LYS QD 4.270 . 4.270 4.087 4.047 4.154 . 0 0 "[ . 1 . 2]" 1
711 1 145 LEU MD2 1 148 GLY H 5.500 . 5.500 5.032 4.921 5.209 . 0 0 "[ . 1 . 2]" 1
712 1 62 ILE MG 1 63 GLN HG3 4.300 . 4.300 4.070 4.045 4.092 . 0 0 "[ . 1 . 2]" 1
713 1 73 LEU H 1 73 LEU HG 4.610 . 4.610 4.410 4.382 4.432 . 0 0 "[ . 1 . 2]" 1
714 1 68 ALA MB 1 71 GLN HB2 4.290 . 4.290 3.950 3.825 4.176 . 0 0 "[ . 1 . 2]" 1
715 1 65 VAL MG1 1 66 VAL H 3.720 . 3.720 3.349 3.283 3.419 . 0 0 "[ . 1 . 2]" 1
716 1 87 LYS HA 1 87 LYS QB 2.660 . 2.660 2.401 2.335 2.471 . 0 0 "[ . 1 . 2]" 1
717 1 161 HIS HA 1 174 LEU HG 3.850 . 3.850 3.273 3.149 3.432 . 0 0 "[ . 1 . 2]" 1
718 1 22 TRP HH2 1 50 ILE MG 2.700 . 2.700 2.293 2.271 2.366 . 0 0 "[ . 1 . 2]" 1
719 1 6 PHE QD 1 9 LEU MD2 5.500 . 5.500 3.554 3.284 3.879 . 0 0 "[ . 1 . 2]" 1
720 1 59 ASN H 1 60 MET HA 5.480 . 5.480 5.365 5.350 5.373 . 0 0 "[ . 1 . 2]" 1
721 1 123 LEU H 1 129 ALA H 3.820 . 3.820 3.838 3.771 3.875 0.055 16 0 "[ . 1 . 2]" 1
722 1 177 GLU HA 1 178 LEU H 3.170 . 3.170 2.177 2.170 2.185 . 0 0 "[ . 1 . 2]" 1
723 1 87 LYS QE 1 101 VAL HB 2.950 . 2.950 2.860 2.227 2.992 0.042 20 0 "[ . 1 . 2]" 1
724 1 69 PHE HA 1 72 PHE H 5.000 . 5.000 3.843 3.747 4.009 . 0 0 "[ . 1 . 2]" 1
725 1 67 LYS QE 1 140 PHE QD 4.810 . 4.810 2.843 2.320 3.588 . 0 0 "[ . 1 . 2]" 1
726 1 8 VAL HA 1 11 ASP HB2 3.740 . 3.740 3.328 3.221 3.421 . 0 0 "[ . 1 . 2]" 1
727 1 35 VAL HB 1 36 TYR H 3.960 . 3.960 3.232 2.516 4.109 0.149 5 0 "[ . 1 . 2]" 1
728 1 71 GLN HG3 1 72 PHE H 5.050 . 5.050 4.590 4.536 4.764 . 0 0 "[ . 1 . 2]" 1
729 1 178 LEU H 1 178 LEU HB3 3.840 . 3.840 3.667 3.652 3.672 . 0 0 "[ . 1 . 2]" 1
730 1 133 SER HB3 1 171 HIS HA 3.510 . 3.510 3.427 3.222 3.667 0.157 3 0 "[ . 1 . 2]" 1
731 1 29 HIS QB 1 50 ILE MD 4.140 . 4.140 3.946 3.854 4.081 . 0 0 "[ . 1 . 2]" 1
732 1 146 LEU HA 1 146 LEU MD2 3.490 . 3.490 2.180 2.150 2.210 . 0 0 "[ . 1 . 2]" 1
733 1 128 ILE H 1 176 ILE H 4.200 . 4.200 3.257 3.188 3.316 . 0 0 "[ . 1 . 2]" 1
734 1 95 VAL MG2 1 176 ILE MD 2.850 . 2.850 2.933 2.895 2.965 0.115 13 0 "[ . 1 . 2]" 1
735 1 155 GLN HE21 1 156 LYS QG 5.230 . 5.230 4.180 2.588 4.482 . 0 0 "[ . 1 . 2]" 1
736 1 16 GLN HG3 1 58 LEU MD2 4.210 . 4.210 4.277 4.253 4.338 0.128 18 0 "[ . 1 . 2]" 1
737 1 87 LYS HA 1 87 LYS QE 4.310 . 4.310 4.383 4.147 4.444 0.134 15 0 "[ . 1 . 2]" 1
738 1 48 PHE HA 1 48 PHE QD 3.760 . 3.760 2.618 2.275 3.089 . 0 0 "[ . 1 . 2]" 1
739 1 67 LYS QE 1 140 PHE QE 3.570 . 3.570 2.928 2.280 3.610 0.040 20 0 "[ . 1 . 2]" 1
740 1 65 VAL HA 1 68 ALA H 3.770 . 3.770 3.702 3.679 3.718 . 0 0 "[ . 1 . 2]" 1
741 1 9 LEU HB2 1 9 LEU MD2 3.490 . 3.490 2.286 2.278 2.296 . 0 0 "[ . 1 . 2]" 1
742 1 29 HIS QB 1 50 ILE QG 4.100 . 4.100 3.096 2.970 3.185 . 0 0 "[ . 1 . 2]" 1
743 1 7 ASN H 1 8 VAL H 3.980 . 3.980 2.723 2.685 2.774 . 0 0 "[ . 1 . 2]" 1
744 1 158 GLN QG 1 159 ILE H 3.650 . 3.650 2.823 2.208 3.712 0.062 19 0 "[ . 1 . 2]" 1
745 1 14 VAL MG2 1 22 TRP H 5.030 . 5.030 4.471 4.396 4.522 . 0 0 "[ . 1 . 2]" 1
746 1 115 LEU H 1 115 LEU HG 4.450 . 4.450 2.998 1.905 4.379 . 0 0 "[ . 1 . 2]" 1
747 1 26 LEU HB2 1 26 LEU QD 3.070 . 3.070 2.086 2.059 2.093 . 0 0 "[ . 1 . 2]" 1
748 1 145 LEU HA 1 145 LEU HG 3.660 . 3.660 2.687 2.552 2.862 . 0 0 "[ . 1 . 2]" 1
749 1 21 VAL MG1 1 57 ARG HD3 5.320 . 5.320 3.875 3.631 4.451 . 0 0 "[ . 1 . 2]" 1
750 1 179 GLN H 1 179 GLN QB . . 3.280 2.356 2.325 2.409 . 0 0 "[ . 1 . 2]" 1
751 1 3 GLY HA3 1 6 PHE QE 5.500 . 5.500 4.387 4.101 5.064 . 0 0 "[ . 1 . 2]" 1
752 1 67 LYS H 1 67 LYS HG2 4.490 . 4.490 4.462 4.407 4.493 0.003 6 0 "[ . 1 . 2]" 1
753 1 64 ASP HA 1 67 LYS QB 3.120 . 3.120 2.632 2.570 2.672 . 0 0 "[ . 1 . 2]" 1
754 1 68 ALA MB 1 71 GLN HB3 5.240 . 5.240 5.154 5.054 5.272 0.032 8 0 "[ . 1 . 2]" 1
755 1 3 GLY H 1 35 VAL QG 5.280 . 5.280 5.342 4.997 5.477 0.197 13 0 "[ . 1 . 2]" 1
756 1 9 LEU H 1 9 LEU MD2 4.440 . 4.440 4.260 4.244 4.276 . 0 0 "[ . 1 . 2]" 1
757 1 53 ASP H 1 54 VAL MG1 4.510 . 4.510 4.028 3.994 4.096 . 0 0 "[ . 1 . 2]" 1
758 1 155 GLN QB 1 157 ILE MG 3.810 . 3.810 3.755 3.446 3.844 0.034 14 0 "[ . 1 . 2]" 1
759 1 14 VAL HA 1 19 MET HA 3.660 . 3.660 3.440 3.333 3.496 . 0 0 "[ . 1 . 2]" 1
760 1 85 VAL QG 1 94 LEU HG 4.910 . 4.910 4.399 3.949 4.561 . 0 0 "[ . 1 . 2]" 1
761 1 3 GLY HA3 1 7 ASN H 4.100 . 4.100 4.096 3.944 4.163 0.063 14 0 "[ . 1 . 2]" 1
762 1 5 ILE MD 1 77 LEU MD2 4.140 . 4.140 3.233 2.820 3.661 . 0 0 "[ . 1 . 2]" 1
763 1 14 VAL HA 1 16 GLN H 4.190 . 4.190 3.995 3.968 4.018 . 0 0 "[ . 1 . 2]" 1
764 1 161 HIS HD1 1 164 CYS HA 4.190 . 4.190 4.133 4.016 4.269 0.079 8 0 "[ . 1 . 2]" 1
765 1 74 PHE QD 1 75 ASN HA 4.070 . 4.070 3.008 2.894 3.083 . 0 0 "[ . 1 . 2]" 1
766 1 19 MET QB 1 22 TRP HB2 4.850 . 4.850 4.882 4.790 5.007 0.157 11 0 "[ . 1 . 2]" 1
767 1 28 LYS H 1 28 LYS HB3 3.060 . 3.060 2.590 2.421 2.657 . 0 0 "[ . 1 . 2]" 1
768 1 4 ILE QG 1 77 LEU MD2 3.620 . 3.620 2.227 2.011 2.536 . 0 0 "[ . 1 . 2]" 1
769 1 101 VAL MG1 1 104 LEU QB 5.000 . 5.000 4.149 4.088 4.218 . 0 0 "[ . 1 . 2]" 1
770 1 95 VAL H 1 95 VAL MG2 3.300 . 3.300 2.009 1.744 2.210 . 0 0 "[ . 1 . 2]" 1
771 1 7 ASN HA 1 10 GLU QB 3.560 . 3.560 3.168 3.067 3.547 . 0 0 "[ . 1 . 2]" 1
772 1 71 GLN HA 1 71 GLN HG3 3.850 . 3.850 2.598 2.492 2.724 . 0 0 "[ . 1 . 2]" 1
773 1 8 VAL MG1 1 76 GLY HA2 4.260 . 4.260 3.508 3.458 3.635 . 0 0 "[ . 1 . 2]" 1
774 1 130 LEU HA 1 130 LEU MD2 3.720 . 3.720 3.792 3.647 3.831 0.111 4 0 "[ . 1 . 2]" 1
775 1 59 ASN H 1 59 ASN HB3 3.970 . 3.970 3.715 3.705 3.726 . 0 0 "[ . 1 . 2]" 1
776 1 58 LEU QB 1 60 MET HG2 3.640 . 3.640 3.425 3.377 3.545 . 0 0 "[ . 1 . 2]" 1
777 1 4 ILE MD 1 8 VAL MG2 3.860 . 3.860 3.133 2.702 3.478 . 0 0 "[ . 1 . 2]" 1
778 1 103 HIS HA 1 106 VAL MG2 3.600 . 3.600 2.056 2.042 2.101 . 0 0 "[ . 1 . 2]" 1
779 1 4 ILE HA 1 4 ILE MD 3.330 . 3.330 2.135 2.120 2.181 . 0 0 "[ . 1 . 2]" 1
780 1 154 GLN HB2 1 154 GLN QG 2.550 . 2.550 2.362 2.198 2.464 . 0 0 "[ . 1 . 2]" 1
781 1 55 ALA HA 1 60 MET HG2 5.000 . 5.000 5.067 5.045 5.128 0.128 2 0 "[ . 1 . 2]" 1
782 1 8 VAL MG1 1 75 ASN HB3 4.970 . 4.970 5.040 5.017 5.061 0.091 6 0 "[ . 1 . 2]" 1
783 1 123 LEU QB 1 123 LEU MD2 2.800 . 2.800 2.294 2.218 2.335 . 0 0 "[ . 1 . 2]" 1
784 1 32 LYS HB3 1 32 LYS QE 4.690 . 4.690 3.046 2.209 3.537 . 0 0 "[ . 1 . 2]" 1
785 1 73 LEU HG 1 76 GLY H 5.500 . 5.500 5.427 5.259 5.508 0.008 15 0 "[ . 1 . 2]" 1
786 1 66 VAL H 1 69 PHE QB 4.900 . 4.900 4.608 4.477 4.689 . 0 0 "[ . 1 . 2]" 1
787 1 52 GLN H 1 52 GLN HG2 3.820 . 3.820 1.816 1.797 1.854 . 0 0 "[ . 1 . 2]" 1
788 1 3 GLY HA2 1 38 SER HA 3.500 . 3.500 2.512 2.310 3.430 . 0 0 "[ . 1 . 2]" 1
789 1 149 ALA H 1 149 ALA MB 3.200 . 3.200 2.214 2.191 2.246 . 0 0 "[ . 1 . 2]" 1
790 1 106 VAL HA 1 109 LEU H 4.100 . 4.100 3.273 3.133 3.464 . 0 0 "[ . 1 . 2]" 1
791 1 156 LYS QD 1 179 GLN QE . . 4.010 3.606 2.558 4.017 0.007 9 0 "[ . 1 . 2]" 1
792 1 24 GLU HB3 1 25 LEU H 3.670 . 3.670 2.671 2.588 2.763 . 0 0 "[ . 1 . 2]" 1
793 1 87 LYS QB 1 87 LYS QE 2.740 . 2.740 2.132 1.990 2.179 . 0 0 "[ . 1 . 2]" 1
794 1 126 ASN QB 1 178 LEU H 4.250 . 4.250 3.632 3.246 4.105 . 0 0 "[ . 1 . 2]" 1
795 1 9 LEU HA 1 9 LEU HB2 2.880 . 2.880 2.423 2.411 2.438 . 0 0 "[ . 1 . 2]" 1
796 1 56 GLN H 1 56 GLN QG 3.470 . 3.470 2.334 2.308 2.368 . 0 0 "[ . 1 . 2]" 1
797 1 58 LEU HA 1 58 LEU MD1 3.990 . 3.990 3.798 3.796 3.803 . 0 0 "[ . 1 . 2]" 1
798 1 8 VAL HA 1 10 GLU H 4.710 . 4.710 4.777 4.752 4.835 0.125 8 0 "[ . 1 . 2]" 1
799 1 101 VAL H 1 104 LEU QB 4.250 . 4.250 4.335 4.321 4.357 0.107 12 0 "[ . 1 . 2]" 1
800 1 163 THR MG 1 169 ALA H 4.960 . 4.960 4.838 4.746 4.970 0.010 9 0 "[ . 1 . 2]" 1
801 1 9 LEU HB3 1 22 TRP HZ3 5.340 . 5.340 5.027 4.844 5.140 . 0 0 "[ . 1 . 2]" 1
802 1 6 PHE QD 1 47 LEU MD1 4.280 . 4.280 3.131 2.966 3.477 . 0 0 "[ . 1 . 2]" 1
803 1 58 LEU QB 1 60 MET HG3 3.310 . 3.310 2.138 2.116 2.161 . 0 0 "[ . 1 . 2]" 1
804 1 35 VAL QG 1 37 VAL H 4.590 . 4.590 3.803 2.991 4.540 . 0 0 "[ . 1 . 2]" 1
805 1 39 ALA MB 1 40 LYS QD 3.370 . 3.370 3.405 3.388 3.466 0.096 5 0 "[ . 1 . 2]" 1
806 1 157 ILE MG 1 178 LEU MD1 4.220 . 4.220 4.273 4.243 4.312 0.092 2 0 "[ . 1 . 2]" 1
807 1 74 PHE QE 1 145 LEU MD2 4.240 . 4.240 4.327 4.286 4.360 0.120 18 0 "[ . 1 . 2]" 1
808 1 141 CYS H 1 141 CYS HB3 3.940 . 3.940 2.478 2.357 2.666 . 0 0 "[ . 1 . 2]" 1
809 1 146 LEU MD1 1 159 ILE MG 3.720 . 3.720 3.272 3.189 3.394 . 0 0 "[ . 1 . 2]" 1
810 1 99 HIS H 1 99 HIS QB . . 3.700 2.365 2.196 2.625 . 0 0 "[ . 1 . 2]" 1
811 1 67 LYS HG3 1 144 GLY HA2 4.380 . 4.380 2.944 2.692 3.175 . 0 0 "[ . 1 . 2]" 1
812 1 22 TRP HA 1 25 LEU MD1 2.550 . 2.550 2.219 2.203 2.243 . 0 0 "[ . 1 . 2]" 1
813 1 67 LYS QB 1 68 ALA MB 4.150 . 4.150 3.692 3.631 3.770 . 0 0 "[ . 1 . 2]" 1
814 1 24 GLU HB2 1 25 LEU QB 5.000 . 5.000 4.167 4.054 4.309 . 0 0 "[ . 1 . 2]" 1
815 1 25 LEU MD2 1 53 ASP HB3 3.040 . 3.040 3.050 3.019 3.069 0.029 19 0 "[ . 1 . 2]" 1
816 1 146 LEU H 1 146 LEU MD2 4.090 . 4.090 3.535 3.423 3.658 . 0 0 "[ . 1 . 2]" 1
817 1 25 LEU MD2 1 26 LEU H 3.560 . 3.560 3.303 3.169 3.355 . 0 0 "[ . 1 . 2]" 1
818 1 67 LYS HG3 1 143 GLU QB 4.450 . 4.450 3.650 3.272 4.006 . 0 0 "[ . 1 . 2]" 1
819 1 102 ILE MG 1 106 VAL H 5.050 . 5.050 4.708 4.537 4.843 . 0 0 "[ . 1 . 2]" 1
820 1 14 VAL HA 1 19 MET H 4.540 . 4.540 3.670 3.415 3.818 . 0 0 "[ . 1 . 2]" 1
821 1 22 TRP HE1 1 25 LEU MD1 2.850 . 2.850 2.784 2.729 2.823 . 0 0 "[ . 1 . 2]" 1
822 1 74 PHE QE 1 149 ALA HA 3.140 . 3.140 2.783 2.495 3.160 0.020 9 0 "[ . 1 . 2]" 1
823 1 57 ARG HD2 1 58 LEU H 4.850 . 4.850 4.503 4.359 4.545 . 0 0 "[ . 1 . 2]" 1
824 1 143 GLU HG3 1 159 ILE MD 4.170 . 4.170 4.178 4.126 4.214 0.044 17 0 "[ . 1 . 2]" 1
825 1 9 LEU MD2 1 22 TRP HH2 3.680 . 3.680 2.034 2.025 2.040 . 0 0 "[ . 1 . 2]" 1
826 1 8 VAL H 1 8 VAL HB 3.800 . 3.800 2.677 2.628 2.747 . 0 0 "[ . 1 . 2]" 1
827 1 91 PHE QE 1 176 ILE MG 4.230 . 4.230 2.232 2.204 2.268 . 0 0 "[ . 1 . 2]" 1
828 1 63 GLN H 1 64 ASP HB3 5.090 . 5.090 4.948 4.913 4.979 . 0 0 "[ . 1 . 2]" 1
829 1 84 VAL QG 1 85 VAL HA 3.310 . 3.310 3.303 3.193 3.352 0.042 2 0 "[ . 1 . 2]" 1
830 1 174 LEU MD1 1 175 ILE H 4.810 . 4.810 4.295 4.231 4.338 . 0 0 "[ . 1 . 2]" 1
831 1 121 GLN H 1 122 LEU H 4.630 . 4.630 4.359 4.224 4.446 . 0 0 "[ . 1 . 2]" 1
832 1 128 ILE HA 1 128 ILE MD 4.020 . 4.020 3.862 3.841 3.895 . 0 0 "[ . 1 . 2]" 1
833 1 108 LYS HG3 1 109 LEU H 4.670 . 4.670 4.220 2.163 4.488 . 0 0 "[ . 1 . 2]" 1
834 1 177 GLU H 1 178 LEU MD2 5.060 . 5.060 5.066 4.987 5.093 0.033 12 0 "[ . 1 . 2]" 1
835 1 66 VAL MG2 1 67 LYS H 3.710 . 3.710 3.506 3.435 3.588 . 0 0 "[ . 1 . 2]" 1
836 1 159 ILE HA 1 176 ILE QG 4.020 . 4.020 3.447 3.379 3.509 . 0 0 "[ . 1 . 2]" 1
837 1 9 LEU MD2 1 47 LEU MD1 2.850 . 2.850 2.253 2.211 2.308 . 0 0 "[ . 1 . 2]" 1
838 1 98 ILE H 1 99 HIS H 4.410 . 4.410 3.488 3.396 3.553 . 0 0 "[ . 1 . 2]" 1
839 1 16 GLN H 1 17 CYS H 3.190 . 3.190 2.451 2.430 2.476 . 0 0 "[ . 1 . 2]" 1
840 1 159 ILE MD 1 176 ILE HA 4.420 . 4.420 4.261 4.176 4.354 . 0 0 "[ . 1 . 2]" 1
841 1 161 HIS HB2 1 174 LEU MD2 4.370 . 4.370 3.434 3.229 3.694 . 0 0 "[ . 1 . 2]" 1
842 1 80 ARG QB 1 81 HIS H 3.570 . 3.570 2.712 2.632 2.832 . 0 0 "[ . 1 . 2]" 1
843 1 57 ARG QG 1 58 LEU HG 2.980 . 2.980 2.286 2.269 2.326 . 0 0 "[ . 1 . 2]" 1
844 1 53 ASP HB2 1 54 VAL H 3.890 . 3.890 3.567 3.545 3.587 . 0 0 "[ . 1 . 2]" 1
845 1 83 ASP HB3 1 84 VAL H 4.200 . 4.200 2.477 2.404 2.634 . 0 0 "[ . 1 . 2]" 1
846 1 55 ALA HA 1 60 MET HB2 3.040 . 3.040 2.920 2.893 2.945 . 0 0 "[ . 1 . 2]" 1
847 1 130 LEU MD2 1 159 ILE MD 4.170 . 4.170 4.171 4.028 4.217 0.047 8 0 "[ . 1 . 2]" 1
848 1 67 LYS HA 1 144 GLY HA3 3.500 . 3.500 3.234 3.026 3.463 . 0 0 "[ . 1 . 2]" 1
849 1 16 GLN H 1 17 CYS HA 5.210 . 5.210 5.040 5.020 5.063 . 0 0 "[ . 1 . 2]" 1
850 1 12 MET HA 1 12 MET HG3 3.860 . 3.860 3.414 3.238 3.686 . 0 0 "[ . 1 . 2]" 1
851 1 28 LYS HA 1 29 HIS HD1 5.050 . 5.050 4.944 4.728 5.066 0.016 11 0 "[ . 1 . 2]" 1
852 1 67 LYS HA 1 144 GLY HA2 4.510 . 4.510 4.240 3.984 4.512 0.002 15 0 "[ . 1 . 2]" 1
853 1 96 MET HA 1 98 ILE H 5.000 . 5.000 3.860 3.682 3.944 . 0 0 "[ . 1 . 2]" 1
854 1 13 VAL HB 1 22 TRP HA 4.250 . 4.250 4.299 4.283 4.310 0.060 3 0 "[ . 1 . 2]" 1
855 1 159 ILE MG 1 161 HIS HB2 4.510 . 4.510 3.330 2.782 4.181 . 0 0 "[ . 1 . 2]" 1
856 1 26 LEU QD 1 30 ALA MB 2.810 . 2.810 2.206 2.014 2.393 . 0 0 "[ . 1 . 2]" 1
857 1 28 LYS HB3 1 29 HIS HD1 4.210 . 4.210 2.414 2.210 2.703 . 0 0 "[ . 1 . 2]" 1
858 1 54 VAL HB 1 58 LEU MD1 5.120 . 5.120 4.291 4.234 4.321 . 0 0 "[ . 1 . 2]" 1
859 1 16 GLN HG3 1 58 LEU MD1 4.000 . 4.000 3.999 3.914 4.026 0.026 6 0 "[ . 1 . 2]" 1
860 1 4 ILE MD 1 77 LEU MD2 3.280 . 3.280 3.057 2.673 3.293 0.013 6 0 "[ . 1 . 2]" 1
861 1 162 ASP H 1 162 ASP QB 3.170 . 3.170 2.404 2.324 2.908 . 0 0 "[ . 1 . 2]" 1
862 1 19 MET QB 1 19 MET HG2 2.760 . 2.760 2.317 2.186 2.480 . 0 0 "[ . 1 . 2]" 1
863 1 13 VAL MG2 1 22 TRP H 4.010 . 4.010 3.797 3.752 3.832 . 0 0 "[ . 1 . 2]" 1
864 1 127 GLN QG 1 128 ILE H 5.110 . 5.110 3.885 3.685 3.997 . 0 0 "[ . 1 . 2]" 1
865 1 101 VAL HA 1 101 VAL MG1 2.840 . 2.840 2.441 2.411 2.476 . 0 0 "[ . 1 . 2]" 1
866 1 25 LEU H 1 25 LEU MD2 3.950 . 3.950 4.068 4.035 4.080 0.130 10 0 "[ . 1 . 2]" 1
867 1 4 ILE MD 1 4 ILE MG 3.270 . 3.270 3.244 3.237 3.247 . 0 0 "[ . 1 . 2]" 1
868 1 57 ARG HA 1 57 ARG QG . . 3.650 3.312 3.307 3.314 . 0 0 "[ . 1 . 2]" 1
869 1 108 LYS HA 1 108 LYS QE 4.490 . 4.490 4.402 3.585 4.600 0.110 14 0 "[ . 1 . 2]" 1
870 1 16 GLN H 1 16 GLN HG3 3.230 . 3.230 2.586 2.520 2.639 . 0 0 "[ . 1 . 2]" 1
871 1 24 GLU H 1 25 LEU H 3.210 . 3.210 2.914 2.891 2.937 . 0 0 "[ . 1 . 2]" 1
872 1 4 ILE QG 1 38 SER HB2 4.850 . 4.850 4.504 4.322 4.745 . 0 0 "[ . 1 . 2]" 1
873 1 78 ALA H 1 80 ARG QG 5.500 . 5.500 5.275 4.902 5.538 0.038 6 0 "[ . 1 . 2]" 1
874 1 13 VAL HA 1 21 VAL MG1 3.960 . 3.960 4.067 4.018 4.131 0.171 20 0 "[ . 1 . 2]" 1
875 1 97 GLY HA3 1 101 VAL MG1 3.650 . 3.650 3.789 3.781 3.809 0.159 3 0 "[ . 1 . 2]" 1
876 1 166 HIS H 1 169 ALA H 5.160 . 5.160 4.901 4.552 5.170 0.010 2 0 "[ . 1 . 2]" 1
877 1 131 ARG HA 1 172 CYS H 4.800 . 4.800 4.754 4.485 4.831 0.031 7 0 "[ . 1 . 2]" 1
878 1 129 ALA MB 1 175 ILE MD 2.710 . 2.710 2.405 2.355 2.461 . 0 0 "[ . 1 . 2]" 1
879 1 16 GLN HB2 1 16 GLN HG3 2.750 . 2.750 2.343 2.335 2.351 . 0 0 "[ . 1 . 2]" 1
880 1 174 LEU HA 1 176 ILE MD 5.500 . 5.500 5.115 4.970 5.350 . 0 0 "[ . 1 . 2]" 1
881 1 67 LYS HG3 1 144 GLY HA3 3.390 . 3.390 3.076 2.813 3.389 . 0 0 "[ . 1 . 2]" 1
882 1 54 VAL MG1 1 56 GLN H 4.590 . 4.590 4.183 4.164 4.233 . 0 0 "[ . 1 . 2]" 1
883 1 78 ALA MB 1 82 THR MG 3.410 . 3.410 3.395 3.300 3.490 0.080 8 0 "[ . 1 . 2]" 1
884 1 16 GLN HB3 1 16 GLN HG2 2.920 . 2.920 2.626 2.608 2.647 . 0 0 "[ . 1 . 2]" 1
885 1 28 LYS HB3 1 28 LYS QE . . 2.900 2.362 2.200 2.568 . 0 0 "[ . 1 . 2]" 1
886 1 119 ASN QB 1 120 GLY H 4.090 . 4.090 3.906 3.806 3.971 . 0 0 "[ . 1 . 2]" 1
887 1 130 LEU MD2 1 176 ILE MD 2.700 . 2.700 2.572 2.464 2.691 . 0 0 "[ . 1 . 2]" 1
888 1 54 VAL MG1 1 55 ALA H 3.640 . 3.640 1.963 1.943 1.990 . 0 0 "[ . 1 . 2]" 1
889 1 28 LYS H 1 28 LYS QD 4.910 . 4.910 4.721 4.589 4.849 . 0 0 "[ . 1 . 2]" 1
890 1 78 ALA HA 1 82 THR HA 4.220 . 4.220 3.478 3.261 3.836 . 0 0 "[ . 1 . 2]" 1
891 1 98 ILE HB 1 99 HIS H 3.720 . 3.720 1.855 1.795 1.905 . 0 0 "[ . 1 . 2]" 1
892 1 72 PHE HA 1 75 ASN HB3 4.110 . 4.110 4.164 4.129 4.210 0.100 15 0 "[ . 1 . 2]" 1
893 1 25 LEU HG 1 54 VAL H 4.140 . 4.140 4.008 3.973 4.058 . 0 0 "[ . 1 . 2]" 1
894 1 50 ILE MG 1 69 PHE QE 3.550 . 3.550 3.273 3.222 3.352 . 0 0 "[ . 1 . 2]" 1
895 1 96 MET HA 1 97 GLY H 4.000 . 4.000 3.427 3.384 3.448 . 0 0 "[ . 1 . 2]" 1
896 1 69 PHE H 1 69 PHE QB 3.570 . 3.570 2.200 2.148 2.221 . 0 0 "[ . 1 . 2]" 1
897 1 155 GLN HE22 1 156 LYS H 5.080 . 5.080 3.226 2.784 3.814 . 0 0 "[ . 1 . 2]" 1
898 1 29 HIS H 1 30 ALA HA 5.270 . 5.270 5.028 4.607 5.157 . 0 0 "[ . 1 . 2]" 1
899 1 63 GLN HG3 1 64 ASP H 3.780 . 3.780 2.092 2.061 2.119 . 0 0 "[ . 1 . 2]" 1
900 1 17 CYS H 1 18 GLY H 2.940 . 2.940 1.874 1.843 1.890 . 0 0 "[ . 1 . 2]" 1
901 1 6 PHE HB2 1 36 TYR HB2 4.040 . 4.040 2.976 2.601 3.261 . 0 0 "[ . 1 . 2]" 1
902 1 55 ALA HA 1 60 MET HB3 4.730 . 4.730 4.673 4.646 4.702 . 0 0 "[ . 1 . 2]" 1
903 1 62 ILE HG12 1 66 VAL HB 3.480 . 3.480 3.445 3.386 3.493 0.013 14 0 "[ . 1 . 2]" 1
904 1 105 GLU QB 1 109 LEU QD 5.500 . 5.500 3.621 3.268 3.972 . 0 0 "[ . 1 . 2]" 1
905 1 54 VAL MG2 1 58 LEU H 4.470 . 4.470 3.872 3.848 3.905 . 0 0 "[ . 1 . 2]" 1
906 1 127 GLN HA 1 178 LEU MD1 3.990 . 3.990 3.608 3.492 3.810 . 0 0 "[ . 1 . 2]" 1
907 1 40 LYS H 1 40 LYS QE 4.790 . 4.790 4.712 4.514 4.785 . 0 0 "[ . 1 . 2]" 1
908 1 143 GLU QB 1 159 ILE MD 3.880 . 3.880 3.250 3.136 3.372 . 0 0 "[ . 1 . 2]" 1
909 1 29 HIS HD1 1 30 ALA H 5.220 . 5.220 4.717 4.503 4.914 . 0 0 "[ . 1 . 2]" 1
910 1 17 CYS HA 1 58 LEU MD2 4.390 . 4.390 4.184 4.083 4.366 . 0 0 "[ . 1 . 2]" 1
911 1 131 ARG HA 1 173 MET HA 3.780 . 3.780 2.835 2.772 2.964 . 0 0 "[ . 1 . 2]" 1
912 1 94 LEU QD 1 95 VAL MG1 4.440 . 4.440 4.059 3.873 4.253 . 0 0 "[ . 1 . 2]" 1
913 1 157 ILE MD 1 159 ILE MD 3.430 . 3.430 2.762 2.708 2.823 . 0 0 "[ . 1 . 2]" 1
914 1 178 LEU HB2 1 178 LEU MD1 2.590 . 2.590 2.274 2.230 2.320 . 0 0 "[ . 1 . 2]" 1
915 1 71 GLN HB3 1 71 GLN HG2 2.680 . 2.680 2.389 2.370 2.440 . 0 0 "[ . 1 . 2]" 1
916 1 70 GLY H 1 141 CYS HA 5.000 . 5.000 4.005 3.811 4.161 . 0 0 "[ . 1 . 2]" 1
917 1 122 LEU HA 1 123 LEU H 3.220 . 3.220 2.145 2.136 2.155 . 0 0 "[ . 1 . 2]" 1
918 1 5 ILE MG 1 6 PHE HA 4.290 . 4.290 3.731 3.643 3.828 . 0 0 "[ . 1 . 2]" 1
919 1 52 GLN HA 1 52 GLN HG2 3.880 . 3.880 3.632 3.626 3.638 . 0 0 "[ . 1 . 2]" 1
920 1 64 ASP HB3 1 67 LYS H 5.500 . 5.500 5.545 5.522 5.562 0.062 5 0 "[ . 1 . 2]" 1
921 1 8 VAL MG1 1 73 LEU MD2 4.390 . 4.390 4.467 4.424 4.502 0.112 19 0 "[ . 1 . 2]" 1
922 1 128 ILE HA 1 128 ILE MG 3.260 . 3.260 2.234 2.223 2.254 . 0 0 "[ . 1 . 2]" 1
923 1 122 LEU HA 1 128 ILE MG 3.590 . 3.590 2.730 2.599 2.819 . 0 0 "[ . 1 . 2]" 1
924 1 178 LEU H 1 178 LEU HB2 3.880 . 3.880 2.571 2.546 2.599 . 0 0 "[ . 1 . 2]" 1
925 1 22 TRP HB3 1 23 ASN H 3.370 . 3.370 2.547 2.373 2.732 . 0 0 "[ . 1 . 2]" 1
926 1 122 LEU MD1 1 128 ILE QG 3.210 . 3.210 2.373 2.199 2.554 . 0 0 "[ . 1 . 2]" 1
927 1 26 LEU H 1 26 LEU HB3 3.520 . 3.520 2.374 2.348 2.457 . 0 0 "[ . 1 . 2]" 1
928 1 130 LEU HA 1 131 ARG H 3.330 . 3.330 2.161 2.147 2.174 . 0 0 "[ . 1 . 2]" 1
929 1 155 GLN HE22 1 179 GLN HA 5.500 . 5.500 5.489 5.324 5.533 0.033 19 0 "[ . 1 . 2]" 1
930 1 83 ASP HA 1 83 ASP HB2 2.870 . 2.870 2.499 2.462 2.526 . 0 0 "[ . 1 . 2]" 1
931 1 163 THR MG 1 171 HIS H 3.930 . 3.930 3.694 3.526 3.811 . 0 0 "[ . 1 . 2]" 1
932 1 101 VAL MG1 1 102 ILE H 4.520 . 4.520 3.548 3.500 3.587 . 0 0 "[ . 1 . 2]" 1
933 1 144 GLY H 1 145 LEU H 4.360 . 4.360 2.819 2.772 2.922 . 0 0 "[ . 1 . 2]" 1
934 1 14 VAL H 1 14 VAL MG2 3.200 . 3.200 2.283 2.243 2.315 . 0 0 "[ . 1 . 2]" 1
935 1 43 ALA MB 1 45 SER H 4.700 . 4.700 4.191 3.195 4.706 0.006 4 0 "[ . 1 . 2]" 1
936 1 9 LEU MD2 1 22 TRP HZ3 3.460 . 3.460 2.444 2.401 2.480 . 0 0 "[ . 1 . 2]" 1
937 1 100 ASP H 1 100 ASP QB . . 3.440 2.437 2.229 2.600 . 0 0 "[ . 1 . 2]" 1
938 1 126 ASN QB 1 178 LEU HB3 . . 3.760 3.443 3.360 3.562 . 0 0 "[ . 1 . 2]" 1
939 1 106 VAL H 1 109 LEU QB 4.700 . 4.700 4.766 4.698 4.832 0.132 10 0 "[ . 1 . 2]" 1
940 1 8 VAL MG1 1 73 LEU HG 3.220 . 3.220 3.294 3.241 3.331 0.111 19 0 "[ . 1 . 2]" 1
941 1 102 ILE HA 1 105 GLU H 4.050 . 4.050 4.010 3.903 4.063 0.013 8 0 "[ . 1 . 2]" 1
942 1 176 ILE QG 1 176 ILE MG 2.610 . 2.610 2.065 2.048 2.102 . 0 0 "[ . 1 . 2]" 1
943 1 176 ILE HB 1 176 ILE QG 2.700 . 2.700 2.574 2.562 2.586 . 0 0 "[ . 1 . 2]" 1
944 1 51 VAL HA 1 65 VAL MG1 3.030 . 3.030 3.081 3.068 3.103 0.073 18 0 "[ . 1 . 2]" 1
945 1 14 VAL MG2 1 19 MET QB 3.050 . 3.050 2.320 2.245 2.698 . 0 0 "[ . 1 . 2]" 1
946 1 19 MET QB 1 22 TRP HD1 5.500 . 5.500 4.916 4.746 5.308 . 0 0 "[ . 1 . 2]" 1
947 1 10 GLU QG 1 14 VAL MG1 5.500 . 5.500 4.408 4.316 4.950 . 0 0 "[ . 1 . 2]" 1
948 1 128 ILE MG 1 176 ILE MD 5.000 . 5.000 2.851 2.760 2.954 . 0 0 "[ . 1 . 2]" 1
949 1 54 VAL MG1 1 69 PHE QE 3.530 . 3.530 2.907 2.793 3.008 . 0 0 "[ . 1 . 2]" 1
950 1 27 GLU QB 1 28 LYS HB2 . . 4.640 4.120 4.060 4.186 . 0 0 "[ . 1 . 2]" 1
951 1 25 LEU MD2 1 50 ILE MG 2.680 . 2.680 2.261 2.216 2.328 . 0 0 "[ . 1 . 2]" 1
952 1 20 SER HA 1 23 ASN QB 3.580 . 3.580 2.884 2.817 3.003 . 0 0 "[ . 1 . 2]" 1
953 1 26 LEU QD 1 30 ALA H 4.520 . 4.520 4.082 3.464 4.361 . 0 0 "[ . 1 . 2]" 1
954 1 159 ILE MD 1 159 ILE MG 2.780 . 2.780 1.884 1.858 1.923 . 0 0 "[ . 1 . 2]" 1
955 1 32 LYS H 1 32 LYS QE 4.800 . 4.800 4.523 4.309 4.739 . 0 0 "[ . 1 . 2]" 1
956 1 77 LEU H 1 145 LEU MD2 5.500 . 5.500 5.454 5.247 5.522 0.022 17 0 "[ . 1 . 2]" 1
957 1 58 LEU H 1 58 LEU QB 3.200 . 3.200 2.355 2.347 2.367 . 0 0 "[ . 1 . 2]" 1
958 1 54 VAL H 1 54 VAL MG1 3.250 . 3.250 2.578 2.551 2.622 . 0 0 "[ . 1 . 2]" 1
959 1 17 CYS H 1 21 VAL MG1 3.500 . 3.500 3.388 3.240 3.506 0.006 12 0 "[ . 1 . 2]" 1
960 1 8 VAL MG1 1 11 ASP HB2 4.400 . 4.400 4.239 4.099 4.399 . 0 0 "[ . 1 . 2]" 1
961 1 32 LYS HB2 1 33 ASP H 5.500 . 5.500 3.842 3.741 4.055 . 0 0 "[ . 1 . 2]" 1
962 1 65 VAL MG2 1 68 ALA H 5.490 . 5.490 5.306 5.287 5.319 . 0 0 "[ . 1 . 2]" 1
963 1 55 ALA H 1 56 GLN HA 5.280 . 5.280 5.173 5.165 5.187 . 0 0 "[ . 1 . 2]" 1
964 1 47 LEU MD1 1 50 ILE MG 3.530 . 3.530 3.533 3.428 3.562 0.032 6 0 "[ . 1 . 2]" 1
965 1 91 PHE QE 1 157 ILE MD 4.420 . 4.420 2.688 2.592 2.748 . 0 0 "[ . 1 . 2]" 1
966 1 63 GLN HB3 1 140 PHE QD 4.040 . 4.040 4.075 4.042 4.093 0.053 17 0 "[ . 1 . 2]" 1
967 1 156 LYS H 1 156 LYS QE 4.630 . 4.630 4.283 3.578 4.727 0.097 11 0 "[ . 1 . 2]" 1
968 1 142 ALA HA 1 145 LEU HB3 5.500 . 5.500 4.244 3.930 4.617 . 0 0 "[ . 1 . 2]" 1
969 1 59 ASN H 1 60 MET HG3 5.500 . 5.500 3.669 3.617 4.014 . 0 0 "[ . 1 . 2]" 1
970 1 90 ASP HA 1 153 PHE QE 5.370 . 5.370 5.350 3.935 5.477 0.107 4 0 "[ . 1 . 2]" 1
971 1 117 HIS HA 1 117 HIS HD1 4.340 . 4.340 2.691 1.961 3.124 . 0 0 "[ . 1 . 2]" 1
972 1 28 LYS HA 1 28 LYS QG 3.280 . 3.280 2.307 2.252 2.350 . 0 0 "[ . 1 . 2]" 1
973 1 65 VAL H 1 66 VAL HB 5.290 . 5.290 5.159 5.118 5.212 . 0 0 "[ . 1 . 2]" 1
974 1 119 ASN H 1 130 LEU MD2 4.860 . 4.860 4.927 4.876 4.984 0.124 13 0 "[ . 1 . 2]" 1
975 1 177 GLU HA 1 178 LEU MD2 4.540 . 4.540 4.542 4.493 4.558 0.018 2 0 "[ . 1 . 2]" 1
976 1 84 VAL QG 1 105 GLU QG 3.080 . 3.080 2.155 2.077 2.228 . 0 0 "[ . 1 . 2]" 1
977 1 157 ILE MD 1 159 ILE H 5.000 . 5.000 4.957 4.898 5.016 0.016 6 0 "[ . 1 . 2]" 1
978 1 50 ILE H 1 50 ILE MD 3.580 . 3.580 3.321 3.294 3.479 . 0 0 "[ . 1 . 2]" 1
979 1 159 ILE MG 1 160 SER QB 5.050 . 5.050 4.180 4.112 4.247 . 0 0 "[ . 1 . 2]" 1
980 1 175 ILE MG 1 177 GLU QG 5.040 . 5.040 4.791 2.697 5.023 . 0 0 "[ . 1 . 2]" 1
981 1 134 SER HA 1 136 ARG H 4.830 . 4.830 4.328 3.947 4.689 . 0 0 "[ . 1 . 2]" 1
982 1 31 PRO HA 1 32 LYS HA 4.360 . 4.360 4.360 4.334 4.392 0.032 13 0 "[ . 1 . 2]" 1
983 1 16 GLN HB2 1 58 LEU MD2 3.950 . 3.950 2.563 2.505 2.705 . 0 0 "[ . 1 . 2]" 1
984 1 67 LYS QE 1 143 GLU QB 4.150 . 4.150 2.639 2.493 2.790 . 0 0 "[ . 1 . 2]" 1
985 1 74 PHE QD 1 148 GLY H 5.270 . 5.270 5.191 4.996 5.287 0.017 6 0 "[ . 1 . 2]" 1
986 1 55 ALA MB 1 65 VAL MG2 2.400 . 2.400 1.900 1.897 1.903 . 0 0 "[ . 1 . 2]" 1
987 1 95 VAL MG2 1 128 ILE MD 2.700 . 2.700 2.563 2.344 2.688 . 0 0 "[ . 1 . 2]" 1
988 1 91 PHE QD 1 92 THR H 4.810 . 4.810 3.709 3.574 3.797 . 0 0 "[ . 1 . 2]" 1
989 1 130 LEU HA 1 130 LEU HG 3.410 . 3.410 2.562 2.462 2.635 . 0 0 "[ . 1 . 2]" 1
990 1 4 ILE MD 1 80 ARG QD 3.610 . 3.610 2.951 2.045 3.422 . 0 0 "[ . 1 . 2]" 1
991 1 73 LEU MD2 1 145 LEU MD2 3.060 . 3.060 2.335 2.220 2.568 . 0 0 "[ . 1 . 2]" 1
992 1 64 ASP HB2 1 65 VAL H 3.890 . 3.890 3.953 3.935 3.977 0.087 20 0 "[ . 1 . 2]" 1
993 1 105 GLU QG 1 106 VAL H 5.480 . 5.480 3.631 3.141 4.121 . 0 0 "[ . 1 . 2]" 1
994 1 25 LEU HA 1 25 LEU MD2 3.260 . 3.260 3.135 3.126 3.150 . 0 0 "[ . 1 . 2]" 1
995 1 146 LEU MD1 1 159 ILE HG13 4.330 . 4.330 4.353 4.298 4.381 0.051 11 0 "[ . 1 . 2]" 1
996 1 81 HIS H 1 81 HIS HB3 3.670 . 3.670 3.532 3.017 3.718 0.048 16 0 "[ . 1 . 2]" 1
997 1 106 VAL H 1 106 VAL HB 4.170 . 4.170 3.604 3.590 3.635 . 0 0 "[ . 1 . 2]" 1
998 1 117 HIS H 1 132 TYR HA 5.500 . 5.500 5.215 4.721 5.520 0.020 5 0 "[ . 1 . 2]" 1
999 1 70 GLY HA2 1 73 LEU MD2 4.030 . 4.030 3.478 3.429 3.508 . 0 0 "[ . 1 . 2]" 1
1000 1 26 LEU H 1 26 LEU QD 3.730 . 3.730 3.740 3.725 3.749 0.019 19 0 "[ . 1 . 2]" 1
1001 1 63 GLN H 1 63 GLN HB2 3.730 . 3.730 3.577 3.569 3.583 . 0 0 "[ . 1 . 2]" 1
1002 1 127 GLN HB2 1 127 GLN QE . . 4.310 2.925 2.112 4.068 . 0 0 "[ . 1 . 2]" 1
1003 1 21 VAL HA 1 24 GLU H 3.870 . 3.870 3.416 3.322 3.503 . 0 0 "[ . 1 . 2]" 1
1004 1 121 GLN HB2 1 122 LEU H 5.000 . 5.000 4.284 4.144 4.402 . 0 0 "[ . 1 . 2]" 1
1005 1 4 ILE MG 1 38 SER HB2 4.390 . 4.390 2.649 2.358 2.951 . 0 0 "[ . 1 . 2]" 1
1006 1 141 CYS H 1 141 CYS HB2 3.930 . 3.930 2.616 2.431 2.749 . 0 0 "[ . 1 . 2]" 1
1007 1 5 ILE MG 1 9 LEU HB3 4.830 . 4.830 4.407 4.273 4.511 . 0 0 "[ . 1 . 2]" 1
1008 1 67 LYS H 1 67 LYS QE 4.830 . 4.830 4.521 4.293 4.759 . 0 0 "[ . 1 . 2]" 1
1009 1 50 ILE MG 1 54 VAL HB 3.160 . 3.160 2.821 2.764 2.888 . 0 0 "[ . 1 . 2]" 1
1010 1 13 VAL HB 1 14 VAL HA 4.820 . 4.820 4.406 4.391 4.421 . 0 0 "[ . 1 . 2]" 1
1011 1 32 LYS H 1 32 LYS QD 4.560 . 4.560 4.546 4.066 4.616 0.056 10 0 "[ . 1 . 2]" 1
1012 1 58 LEU H 1 59 ASN HB2 5.500 . 5.500 5.276 5.255 5.307 . 0 0 "[ . 1 . 2]" 1
1013 1 57 ARG H 1 57 ARG HD3 4.100 . 4.100 4.189 4.180 4.215 0.115 18 0 "[ . 1 . 2]" 1
1014 1 161 HIS HA 1 175 ILE H 4.150 . 4.150 4.014 3.903 4.131 . 0 0 "[ . 1 . 2]" 1
1015 1 22 TRP HA 1 23 ASN HA 4.740 . 4.740 4.702 4.669 4.727 . 0 0 "[ . 1 . 2]" 1
1016 1 133 SER H 1 133 SER HB3 3.780 . 3.780 3.316 3.046 3.901 0.121 15 0 "[ . 1 . 2]" 1
1017 1 6 PHE HA 1 9 LEU H 3.880 . 3.880 3.364 3.289 3.480 . 0 0 "[ . 1 . 2]" 1
1018 1 74 PHE HZ 1 149 ALA MB 3.440 . 3.440 2.540 2.428 2.610 . 0 0 "[ . 1 . 2]" 1
1019 1 133 SER H 1 133 SER HB2 3.910 . 3.910 3.768 2.873 4.051 0.141 9 0 "[ . 1 . 2]" 1
1020 1 24 GLU H 1 26 LEU QD 5.180 . 5.180 5.369 5.337 5.422 0.242 12 0 "[ . 1 . 2]" 1
1021 1 129 ALA HA 1 175 ILE HA 3.210 . 3.210 2.517 2.486 2.547 . 0 0 "[ . 1 . 2]" 1
1022 1 99 HIS HA 1 99 HIS HD1 4.540 . 4.540 3.219 2.220 3.916 . 0 0 "[ . 1 . 2]" 1
1023 1 25 LEU HG 1 54 VAL MG2 3.680 . 3.680 3.654 3.500 3.693 0.013 16 0 "[ . 1 . 2]" 1
1024 1 28 LYS H 1 28 LYS QE . . 4.830 4.273 4.053 4.590 . 0 0 "[ . 1 . 2]" 1
1025 1 132 TYR QB 1 133 SER H 4.020 . 4.020 3.489 3.377 3.645 . 0 0 "[ . 1 . 2]" 1
1026 1 143 GLU HG2 1 174 LEU MD1 4.230 . 4.230 4.265 4.143 4.305 0.075 10 0 "[ . 1 . 2]" 1
1027 1 17 CYS HB2 1 21 VAL MG1 2.960 . 2.960 2.231 2.224 2.239 . 0 0 "[ . 1 . 2]" 1
1028 1 163 THR HA 1 169 ALA MB 4.230 . 4.230 3.780 3.634 3.938 . 0 0 "[ . 1 . 2]" 1
1029 1 19 MET H 1 19 MET HG2 4.210 . 4.210 2.764 1.990 4.432 0.222 11 0 "[ . 1 . 2]" 1
1030 1 50 ILE MG 1 54 VAL H 3.740 . 3.740 3.637 3.603 3.695 . 0 0 "[ . 1 . 2]" 1
1031 1 9 LEU HA 1 12 MET HG3 3.870 . 3.870 2.658 2.111 3.259 . 0 0 "[ . 1 . 2]" 1
1032 1 67 LYS HA 1 70 GLY H 3.800 . 3.800 3.582 3.524 3.642 . 0 0 "[ . 1 . 2]" 1
1033 1 86 ASP H 1 87 LYS H 3.430 . 3.430 2.949 2.914 3.005 . 0 0 "[ . 1 . 2]" 1
1034 1 47 LEU MD1 1 51 VAL MG2 3.150 . 3.150 3.199 3.179 3.215 0.065 7 0 "[ . 1 . 2]" 1
1035 1 65 VAL MG1 1 68 ALA MB 4.190 . 4.190 3.875 3.849 3.915 . 0 0 "[ . 1 . 2]" 1
1036 1 30 ALA HA 1 31 PRO HG2 4.780 . 4.780 4.627 4.529 4.706 . 0 0 "[ . 1 . 2]" 1
1037 1 22 TRP H 1 22 TRP HE1 4.510 . 4.510 4.428 4.413 4.449 . 0 0 "[ . 1 . 2]" 1
1038 1 91 PHE HA 1 94 LEU QD 3.790 . 3.790 3.520 3.209 3.692 . 0 0 "[ . 1 . 2]" 1
1039 1 68 ALA H 1 69 PHE H 3.660 . 3.660 2.795 2.773 2.812 . 0 0 "[ . 1 . 2]" 1
1040 1 80 ARG QG 1 81 HIS H 5.290 . 5.290 3.968 3.779 4.228 . 0 0 "[ . 1 . 2]" 1
1041 1 125 ASN HA 1 126 ASN H 3.050 . 3.050 2.965 2.137 3.236 0.186 19 0 "[ . 1 . 2]" 1
1042 1 9 LEU HA 1 9 LEU MD2 3.810 . 3.810 3.712 3.691 3.729 . 0 0 "[ . 1 . 2]" 1
1043 1 4 ILE MG 1 5 ILE MD 3.960 . 3.960 2.446 2.194 2.602 . 0 0 "[ . 1 . 2]" 1
1044 1 32 LYS HB2 1 32 LYS QG 2.580 . 2.580 2.427 2.412 2.497 . 0 0 "[ . 1 . 2]" 1
1045 1 6 PHE QD 1 22 TRP HZ2 4.250 . 4.250 2.680 2.436 2.924 . 0 0 "[ . 1 . 2]" 1
1046 1 157 ILE HA 1 157 ILE MD 4.030 . 4.030 4.098 4.093 4.104 0.074 14 0 "[ . 1 . 2]" 1
1047 1 169 ALA MB 1 172 CYS HA 4.220 . 4.220 3.956 3.865 4.058 . 0 0 "[ . 1 . 2]" 1
1048 1 81 HIS HB3 1 85 VAL H 5.500 . 5.500 3.713 3.148 5.453 . 0 0 "[ . 1 . 2]" 1
1049 1 47 LEU HG 1 50 ILE MG 4.650 . 4.650 4.693 4.667 4.715 0.065 10 0 "[ . 1 . 2]" 1
1050 1 62 ILE HA 1 65 VAL MG1 3.860 . 3.860 3.944 3.921 3.963 0.103 3 0 "[ . 1 . 2]" 1
1051 1 28 LYS HB2 1 29 HIS HD1 4.460 . 4.460 4.083 3.856 4.327 . 0 0 "[ . 1 . 2]" 1
1052 1 121 GLN HB3 1 123 LEU MD2 3.250 . 3.250 2.827 2.739 3.212 . 0 0 "[ . 1 . 2]" 1
1053 1 8 VAL MG2 1 73 LEU HA 3.990 . 3.990 3.503 3.398 3.656 . 0 0 "[ . 1 . 2]" 1
1054 1 71 GLN HG2 1 72 PHE H 4.990 . 4.990 5.014 4.996 5.032 0.042 10 0 "[ . 1 . 2]" 1
1055 1 157 ILE H 1 179 GLN QG 5.300 . 5.300 4.749 4.589 5.030 . 0 0 "[ . 1 . 2]" 1
1056 1 37 VAL MG2 1 40 LYS QE 4.090 . 4.090 3.747 3.611 4.019 . 0 0 "[ . 1 . 2]" 1
1057 1 54 VAL MG2 1 55 ALA H 4.300 . 4.300 3.970 3.947 4.009 . 0 0 "[ . 1 . 2]" 1
1058 1 121 GLN H 1 121 GLN HB2 3.470 . 3.470 3.085 3.039 3.130 . 0 0 "[ . 1 . 2]" 1
1059 1 54 VAL MG1 1 65 VAL MG1 3.680 . 3.680 2.162 2.129 2.214 . 0 0 "[ . 1 . 2]" 1
1060 1 147 PHE QD 1 157 ILE MD 4.290 . 4.290 3.314 3.114 3.538 . 0 0 "[ . 1 . 2]" 1
1061 1 58 LEU QB 1 58 LEU MD1 2.730 . 2.730 2.097 2.095 2.102 . 0 0 "[ . 1 . 2]" 1
1062 1 146 LEU QB 1 159 ILE MD 3.900 . 3.900 2.175 2.099 2.253 . 0 0 "[ . 1 . 2]" 1
1063 1 101 VAL HA 1 104 LEU QD 3.930 . 3.930 2.968 2.923 3.005 . 0 0 "[ . 1 . 2]" 1
1064 1 28 LYS HA 1 28 LYS HB2 2.920 . 2.920 2.512 2.425 2.548 . 0 0 "[ . 1 . 2]" 1
1065 1 3 GLY HA3 1 6 PHE QD 3.560 . 3.560 2.559 2.340 3.224 . 0 0 "[ . 1 . 2]" 1
1066 1 84 VAL QG 1 102 ILE HA 3.670 . 3.670 2.167 2.046 2.272 . 0 0 "[ . 1 . 2]" 1
1067 1 159 ILE MG 1 174 LEU MD2 2.580 . 2.580 2.229 2.209 2.330 . 0 0 "[ . 1 . 2]" 1
1068 1 24 GLU HA 1 27 GLU H 4.190 . 4.190 3.752 3.657 4.013 . 0 0 "[ . 1 . 2]" 1
1069 1 161 HIS H 1 161 HIS HB2 3.820 . 3.820 3.226 2.801 3.796 . 0 0 "[ . 1 . 2]" 1
1070 1 27 GLU H 1 28 LYS H 3.160 . 3.160 2.458 2.427 2.516 . 0 0 "[ . 1 . 2]" 1
1071 1 179 GLN HA 1 180 ASN H 3.000 . 3.000 2.208 2.179 2.264 . 0 0 "[ . 1 . 2]" 1
1072 1 22 TRP HA 1 25 LEU H 4.290 . 4.290 4.205 4.115 4.303 0.013 5 0 "[ . 1 . 2]" 1
1073 1 63 GLN HA 1 63 GLN HG3 3.920 . 3.920 3.653 3.642 3.664 . 0 0 "[ . 1 . 2]" 1
1074 1 95 VAL MG1 1 96 MET H 4.050 . 4.050 3.303 2.902 3.514 . 0 0 "[ . 1 . 2]" 1
1075 1 121 GLN QG 1 123 LEU MD2 3.320 . 3.320 2.586 2.436 2.726 . 0 0 "[ . 1 . 2]" 1
1076 1 64 ASP HA 1 68 ALA H 4.010 . 4.010 3.903 3.853 3.948 . 0 0 "[ . 1 . 2]" 1
1077 1 102 ILE MG 1 106 VAL MG1 3.700 . 3.700 3.104 2.898 3.277 . 0 0 "[ . 1 . 2]" 1
1078 1 120 GLY HA2 1 121 GLN H 3.210 . 3.210 2.145 2.135 2.154 . 0 0 "[ . 1 . 2]" 1
1079 1 5 ILE H 1 38 SER HA 4.490 . 4.490 4.384 4.143 4.539 0.049 8 0 "[ . 1 . 2]" 1
1080 1 99 HIS HA 1 103 HIS H 4.210 . 4.210 3.513 3.396 3.581 . 0 0 "[ . 1 . 2]" 1
1081 1 132 TYR H 1 133 SER H 4.700 . 4.700 4.399 4.341 4.427 . 0 0 "[ . 1 . 2]" 1
1082 1 164 CYS HA 1 173 MET H 4.590 . 4.590 4.070 3.925 4.355 . 0 0 "[ . 1 . 2]" 1
1083 1 79 SER H 1 81 HIS H 4.300 . 4.300 4.062 3.929 4.282 . 0 0 "[ . 1 . 2]" 1
1084 1 91 PHE QD 1 178 LEU MD2 3.860 . 3.860 2.375 2.241 2.489 . 0 0 "[ . 1 . 2]" 1
1085 1 32 LYS HB2 1 32 LYS QD 2.550 . 2.550 2.473 2.307 2.594 0.044 19 0 "[ . 1 . 2]" 1
1086 1 175 ILE QG 1 175 ILE MG . . 3.160 2.287 2.276 2.296 . 0 0 "[ . 1 . 2]" 1
1087 1 132 TYR QD 1 133 SER HA 4.580 . 4.580 3.210 2.723 4.025 . 0 0 "[ . 1 . 2]" 1
1088 1 147 PHE QE 1 176 ILE MG 5.000 . 5.000 4.724 4.524 4.941 . 0 0 "[ . 1 . 2]" 1
1089 1 123 LEU MD1 1 127 GLN HB3 2.400 . 2.400 2.270 2.229 2.310 . 0 0 "[ . 1 . 2]" 1
1090 1 78 ALA H 1 78 ALA MB 3.040 . 3.040 2.239 2.228 2.262 . 0 0 "[ . 1 . 2]" 1
1091 1 129 ALA HA 1 175 ILE MG 3.350 . 3.350 3.021 2.938 3.147 . 0 0 "[ . 1 . 2]" 1
1092 1 30 ALA MB 1 31 PRO QD 3.010 . 3.010 2.238 2.176 2.318 . 0 0 "[ . 1 . 2]" 1
1093 1 87 LYS QB 1 101 VAL MG2 3.850 . 3.850 3.193 2.819 3.311 . 0 0 "[ . 1 . 2]" 1
1094 1 71 GLN HB3 1 72 PHE H 3.920 . 3.920 3.247 3.121 3.304 . 0 0 "[ . 1 . 2]" 1
1095 1 62 ILE H 1 62 ILE HG13 4.470 . 4.470 4.281 4.267 4.295 . 0 0 "[ . 1 . 2]" 1
1096 1 37 VAL MG1 1 38 SER HB3 4.780 . 4.780 4.577 4.392 4.732 . 0 0 "[ . 1 . 2]" 1
1097 1 83 ASP H 1 84 VAL H 3.280 . 3.280 2.721 2.665 2.763 . 0 0 "[ . 1 . 2]" 1
1098 1 61 PRO HA 1 63 GLN H 4.290 . 4.290 4.036 4.023 4.049 . 0 0 "[ . 1 . 2]" 1
1099 1 55 ALA H 1 65 VAL MG1 3.530 . 3.530 3.601 3.592 3.620 0.090 18 0 "[ . 1 . 2]" 1
1100 1 161 HIS HA 1 174 LEU MD2 4.700 . 4.700 4.650 4.538 4.782 0.082 10 0 "[ . 1 . 2]" 1
1101 1 84 VAL QG 1 85 VAL H 3.270 . 3.270 3.070 3.000 3.110 . 0 0 "[ . 1 . 2]" 1
1102 1 129 ALA HA 1 175 ILE MD 3.120 . 3.120 2.171 2.143 2.194 . 0 0 "[ . 1 . 2]" 1
1103 1 175 ILE MD 1 176 ILE H 4.070 . 4.070 3.845 3.793 3.876 . 0 0 "[ . 1 . 2]" 1
1104 1 123 LEU HA 1 123 LEU MD1 4.130 . 4.130 4.045 3.925 4.076 . 0 0 "[ . 1 . 2]" 1
1105 1 108 LYS H 1 108 LYS HG2 3.450 . 3.450 3.274 2.701 3.470 0.020 14 0 "[ . 1 . 2]" 1
1106 1 13 VAL MG1 1 69 PHE QD 4.980 . 4.980 5.021 4.977 5.049 0.069 11 0 "[ . 1 . 2]" 1
1107 1 40 LYS H 1 40 LYS HG2 3.790 . 3.790 1.934 1.798 2.043 . 0 0 "[ . 1 . 2]" 1
1108 1 101 VAL H 1 102 ILE MD 4.000 . 4.000 3.953 3.829 4.012 0.012 9 0 "[ . 1 . 2]" 1
1109 1 157 ILE QG 1 157 ILE MG . . 2.930 2.132 2.111 2.152 . 0 0 "[ . 1 . 2]" 1
1110 1 62 ILE HG13 1 66 VAL HB 4.180 . 4.180 4.221 4.213 4.233 0.053 17 0 "[ . 1 . 2]" 1
1111 1 146 LEU HA 1 146 LEU MD1 4.320 . 4.320 3.826 3.810 3.846 . 0 0 "[ . 1 . 2]" 1
1112 1 6 PHE H 1 7 ASN H 4.120 . 4.120 2.576 2.542 2.614 . 0 0 "[ . 1 . 2]" 1
1113 1 57 ARG HD3 1 58 LEU H 4.830 . 4.830 4.321 4.290 4.367 . 0 0 "[ . 1 . 2]" 1
1114 1 104 LEU HG 1 105 GLU H 4.440 . 4.440 4.225 4.145 4.277 . 0 0 "[ . 1 . 2]" 1
1115 1 167 THR H 1 167 THR MG 3.810 . 3.810 3.830 3.823 3.843 0.033 9 0 "[ . 1 . 2]" 1
1116 1 78 ALA MB 1 85 VAL HB 3.880 . 3.880 3.561 3.404 3.711 . 0 0 "[ . 1 . 2]" 1
1117 1 28 LYS HA 1 28 LYS QE 5.170 . 5.170 4.372 4.026 4.723 . 0 0 "[ . 1 . 2]" 1
1118 1 49 SER HA 1 49 SER QB 2.650 . 2.650 2.285 2.188 2.439 . 0 0 "[ . 1 . 2]" 1
1119 1 71 GLN HB2 1 71 GLN HG3 2.520 . 2.520 2.547 2.489 2.576 0.056 9 0 "[ . 1 . 2]" 1
1120 1 21 VAL MG1 1 24 GLU HB2 5.000 . 5.000 4.743 4.669 4.806 . 0 0 "[ . 1 . 2]" 1
1121 1 94 LEU HB2 1 94 LEU HG 3.010 . 3.010 2.652 2.406 2.770 . 0 0 "[ . 1 . 2]" 1
1122 1 25 LEU HA 1 29 HIS HD1 3.840 . 3.840 2.580 2.414 2.875 . 0 0 "[ . 1 . 2]" 1
1123 1 160 SER QB 1 175 ILE MD 4.710 . 4.710 4.597 4.497 4.659 . 0 0 "[ . 1 . 2]" 1
1124 1 43 ALA H 1 43 ALA MB 2.850 . 2.850 2.415 2.211 2.876 0.026 12 0 "[ . 1 . 2]" 1
1125 1 159 ILE MG 1 161 HIS H 4.900 . 4.900 3.493 3.277 3.735 . 0 0 "[ . 1 . 2]" 1
1126 1 96 MET QB 1 122 LEU MD1 3.290 . 3.290 2.215 2.014 3.015 . 0 0 "[ . 1 . 2]" 1
1127 1 94 LEU HB2 1 94 LEU QD 2.510 . 2.510 2.181 2.120 2.330 . 0 0 "[ . 1 . 2]" 1
1128 1 128 ILE MG 1 129 ALA H 3.390 . 3.390 2.658 2.587 2.705 . 0 0 "[ . 1 . 2]" 1
1129 1 91 PHE HA 1 153 PHE QD 5.000 . 5.000 3.718 3.459 4.343 . 0 0 "[ . 1 . 2]" 1
1130 1 169 ALA MB 1 171 HIS H 2.940 . 2.940 2.319 2.133 2.481 . 0 0 "[ . 1 . 2]" 1
1131 1 6 PHE QD 1 50 ILE MD 4.690 . 4.690 2.998 2.813 3.183 . 0 0 "[ . 1 . 2]" 1
1132 1 91 PHE HZ 1 150 ALA MB 5.000 . 5.000 3.696 3.157 4.025 . 0 0 "[ . 1 . 2]" 1
1133 1 87 LYS H 1 87 LYS QD 3.800 . 3.800 3.467 3.385 3.563 . 0 0 "[ . 1 . 2]" 1
1134 1 119 ASN HA 1 120 GLY H 2.740 . 2.740 2.168 2.140 2.204 . 0 0 "[ . 1 . 2]" 1
1135 1 60 MET HA 1 61 PRO HB3 5.500 . 5.500 4.849 4.831 4.864 . 0 0 "[ . 1 . 2]" 1
1136 1 3 GLY HA3 1 36 TYR HB2 3.960 . 3.960 2.285 2.254 2.315 . 0 0 "[ . 1 . 2]" 1
1137 1 82 THR HA 1 82 THR MG 2.740 . 2.740 2.208 2.181 2.234 . 0 0 "[ . 1 . 2]" 1
1138 1 157 ILE MD 1 158 GLN H 4.190 . 4.190 3.841 3.761 3.912 . 0 0 "[ . 1 . 2]" 1
1139 1 5 ILE H 1 5 ILE MD 4.270 . 4.270 3.189 3.020 3.296 . 0 0 "[ . 1 . 2]" 1
1140 1 92 THR MG 1 95 VAL H 5.370 . 5.370 5.298 5.162 5.391 0.021 14 0 "[ . 1 . 2]" 1
1141 1 47 LEU H 1 50 ILE MD 3.900 . 3.900 3.652 3.542 3.916 0.016 12 0 "[ . 1 . 2]" 1
1142 1 117 HIS H 1 133 SER H 5.000 . 5.000 3.696 3.150 3.952 . 0 0 "[ . 1 . 2]" 1
1143 1 36 TYR QD 1 37 VAL H 5.040 . 5.040 4.738 4.393 4.882 . 0 0 "[ . 1 . 2]" 1
1144 1 37 VAL HB 1 41 SER H 5.130 . 5.130 4.551 3.029 5.168 0.038 9 0 "[ . 1 . 2]" 1
1145 1 155 GLN QB 1 155 GLN HE22 5.000 . 5.000 4.238 4.165 4.269 . 0 0 "[ . 1 . 2]" 1
1146 1 17 CYS HA 1 21 VAL MG2 5.130 . 5.130 5.168 5.150 5.184 0.054 1 0 "[ . 1 . 2]" 1
1147 1 84 VAL H 1 84 VAL QG 2.810 . 2.810 2.174 2.088 2.303 . 0 0 "[ . 1 . 2]" 1
1148 1 63 GLN HG3 1 140 PHE QE 5.500 . 5.500 5.033 4.647 5.275 . 0 0 "[ . 1 . 2]" 1
1149 1 33 ASP QB 1 34 ARG H . . 4.130 3.468 2.242 4.049 . 0 0 "[ . 1 . 2]" 1
1150 1 3 GLY HA2 1 6 PHE QE 5.500 . 5.500 4.248 4.074 4.453 . 0 0 "[ . 1 . 2]" 1
1151 1 28 LYS HA 1 28 LYS QD 4.300 . 4.300 3.965 3.743 4.129 . 0 0 "[ . 1 . 2]" 1
1152 1 13 VAL HA 1 16 GLN HB3 4.180 . 4.180 4.224 4.210 4.234 0.054 20 0 "[ . 1 . 2]" 1
1153 1 87 LYS HA 1 89 ASP H 4.460 . 4.460 4.068 3.271 4.339 . 0 0 "[ . 1 . 2]" 1
1154 1 4 ILE HA 1 8 VAL H 4.550 . 4.550 4.338 4.181 4.502 . 0 0 "[ . 1 . 2]" 1
1155 1 94 LEU HB3 1 95 VAL H 3.960 . 3.960 2.189 1.829 2.432 . 0 0 "[ . 1 . 2]" 1
1156 1 80 ARG H 1 80 ARG QG 3.960 . 3.960 2.346 2.065 2.714 . 0 0 "[ . 1 . 2]" 1
1157 1 57 ARG H 1 58 LEU QB 4.470 . 4.470 4.544 4.535 4.553 0.083 3 0 "[ . 1 . 2]" 1
1158 1 89 ASP QB 1 90 ASP H . . 4.370 3.112 2.154 3.717 . 0 0 "[ . 1 . 2]" 1
1159 1 40 LYS QE 1 40 LYS HG2 3.350 . 3.350 3.270 3.253 3.423 0.073 5 0 "[ . 1 . 2]" 1
1160 1 151 GLN H 1 151 GLN QB 3.320 . 3.320 2.386 2.152 2.464 . 0 0 "[ . 1 . 2]" 1
1161 1 96 MET H 1 96 MET QB 3.660 . 3.660 2.487 2.266 2.789 . 0 0 "[ . 1 . 2]" 1
1162 1 70 GLY HA2 1 145 LEU MD2 3.770 . 3.770 2.935 2.727 3.160 . 0 0 "[ . 1 . 2]" 1
1163 1 21 VAL MG1 1 22 TRP HE1 3.630 . 3.630 3.531 3.499 3.577 . 0 0 "[ . 1 . 2]" 1
1164 1 99 HIS HA 1 103 HIS QB 3.390 . 3.390 2.125 2.092 2.165 . 0 0 "[ . 1 . 2]" 1
1165 1 36 TYR HA 1 36 TYR QD 4.500 . 4.500 3.601 3.508 3.667 . 0 0 "[ . 1 . 2]" 1
1166 1 94 LEU HG 1 95 VAL MG2 5.440 . 5.440 5.017 4.679 5.441 0.001 19 0 "[ . 1 . 2]" 1
1167 1 55 ALA MB 1 61 PRO HA 3.780 . 3.780 3.802 3.787 3.812 0.032 9 0 "[ . 1 . 2]" 1
1168 1 92 THR MG 1 95 VAL MG2 5.120 . 5.120 4.736 4.547 4.854 . 0 0 "[ . 1 . 2]" 1
1169 1 29 HIS QB 1 30 ALA H . . 3.970 3.414 3.337 3.460 . 0 0 "[ . 1 . 2]" 1
1170 1 147 PHE HA 1 150 ALA H 4.100 . 4.100 3.215 3.058 3.375 . 0 0 "[ . 1 . 2]" 1
1171 1 163 THR MG 1 169 ALA HA 5.000 . 5.000 4.419 4.344 4.477 . 0 0 "[ . 1 . 2]" 1
1172 1 131 ARG H 1 131 ARG QD 4.610 . 4.610 4.552 4.473 4.672 0.062 9 0 "[ . 1 . 2]" 1
1173 1 71 GLN H 1 72 PHE QB 5.000 . 5.000 4.611 4.490 4.759 . 0 0 "[ . 1 . 2]" 1
1174 1 127 GLN HB3 1 127 GLN QE 4.570 . 4.570 2.851 1.824 4.115 . 0 0 "[ . 1 . 2]" 1
1175 1 37 VAL MG1 1 40 LYS HG2 2.920 . 2.920 2.201 2.142 2.255 . 0 0 "[ . 1 . 2]" 1
1176 1 18 GLY H 1 21 VAL MG1 3.530 . 3.530 3.425 3.328 3.526 . 0 0 "[ . 1 . 2]" 1
1177 1 25 LEU HA 1 28 LYS QD 4.680 . 4.680 4.117 3.695 4.549 . 0 0 "[ . 1 . 2]" 1
1178 1 73 LEU MD1 1 77 LEU MD1 4.410 . 4.410 3.645 3.308 3.812 . 0 0 "[ . 1 . 2]" 1
1179 1 30 ALA MB 1 31 PRO HG2 5.000 . 5.000 4.147 3.930 4.330 . 0 0 "[ . 1 . 2]" 1
1180 1 22 TRP HH2 1 47 LEU MD1 3.590 . 3.590 3.479 3.387 3.602 0.012 20 0 "[ . 1 . 2]" 1
1181 1 17 CYS HB2 1 21 VAL MG2 3.300 . 3.300 2.985 2.803 3.105 . 0 0 "[ . 1 . 2]" 1
1182 1 6 PHE H 1 36 TYR HB2 5.500 . 5.500 4.411 3.890 4.834 . 0 0 "[ . 1 . 2]" 1
1183 1 126 ASN QB 1 178 LEU MD1 3.580 . 3.580 2.255 2.157 2.467 . 0 0 "[ . 1 . 2]" 1
1184 1 143 GLU QB 1 159 ILE HB 4.640 . 4.640 4.528 4.321 4.655 0.015 20 0 "[ . 1 . 2]" 1
1185 1 32 LYS QE 1 32 LYS QG 2.710 . 2.710 2.329 2.190 2.618 . 0 0 "[ . 1 . 2]" 1
1186 1 71 GLN HG2 1 148 GLY HA2 3.670 . 3.670 3.054 2.908 3.126 . 0 0 "[ . 1 . 2]" 1
1187 1 96 MET QB 1 128 ILE MD 4.920 . 4.920 4.041 3.698 4.645 . 0 0 "[ . 1 . 2]" 1
1188 1 147 PHE QE 1 157 ILE MD 4.060 . 4.060 3.354 3.115 3.603 . 0 0 "[ . 1 . 2]" 1
1189 1 101 VAL HB 1 102 ILE MD 4.820 . 4.820 4.967 4.926 4.995 0.175 11 0 "[ . 1 . 2]" 1
1190 1 98 ILE MG 1 100 ASP H 4.950 . 4.950 4.562 4.504 4.642 . 0 0 "[ . 1 . 2]" 1
1191 1 55 ALA HA 1 57 ARG H 4.780 . 4.780 4.731 4.710 4.752 . 0 0 "[ . 1 . 2]" 1
1192 1 140 PHE HA 1 143 GLU H 3.690 . 3.690 3.544 3.315 3.743 0.053 4 0 "[ . 1 . 2]" 1
1193 1 74 PHE H 1 77 LEU HG 5.500 . 5.500 5.386 5.239 5.565 0.065 16 0 "[ . 1 . 2]" 1
1194 1 62 ILE H 1 63 GLN H 3.740 . 3.740 2.973 2.946 3.005 . 0 0 "[ . 1 . 2]" 1
1195 1 159 ILE HA 1 175 ILE HB 4.720 . 4.720 4.612 4.560 4.667 . 0 0 "[ . 1 . 2]" 1
1196 1 4 ILE MG 1 7 ASN H 5.000 . 5.000 4.706 4.602 4.797 . 0 0 "[ . 1 . 2]" 1
1197 1 14 VAL MG1 1 15 ALA H 5.000 . 5.000 3.479 3.439 3.498 . 0 0 "[ . 1 . 2]" 1
1198 1 147 PHE QD 1 150 ALA MB 4.270 . 4.270 3.254 3.038 3.505 . 0 0 "[ . 1 . 2]" 1
1199 1 163 THR MG 1 173 MET QB 3.980 . 3.980 3.238 3.151 3.313 . 0 0 "[ . 1 . 2]" 1
1200 1 5 ILE HA 1 8 VAL HB 4.310 . 4.310 3.634 3.505 3.793 . 0 0 "[ . 1 . 2]" 1
1201 1 103 HIS HA 1 105 GLU H 4.580 . 4.580 4.154 4.008 4.245 . 0 0 "[ . 1 . 2]" 1
1202 1 102 ILE HA 1 102 ILE MD 3.890 . 3.890 3.612 3.577 3.627 . 0 0 "[ . 1 . 2]" 1
1203 1 51 VAL MG1 1 52 GLN HA 3.800 . 3.800 3.347 3.314 3.371 . 0 0 "[ . 1 . 2]" 1
1204 1 143 GLU HG2 1 174 LEU HG 4.550 . 4.550 3.740 3.561 3.828 . 0 0 "[ . 1 . 2]" 1
1205 1 71 GLN H 1 144 GLY HA3 3.200 . 3.200 2.825 2.477 2.969 . 0 0 "[ . 1 . 2]" 1
1206 1 104 LEU H 1 104 LEU QB 3.640 . 3.640 2.255 2.235 2.271 . 0 0 "[ . 1 . 2]" 1
1207 1 128 ILE QG 1 129 ALA H 4.670 . 4.670 4.243 4.210 4.321 . 0 0 "[ . 1 . 2]" 1
1208 1 127 GLN QE 1 177 GLU QG . . 4.480 3.922 2.675 4.498 0.018 9 0 "[ . 1 . 2]" 1
1209 1 38 SER H 1 38 SER HB3 4.200 . 4.200 2.461 2.308 2.619 . 0 0 "[ . 1 . 2]" 1
1210 1 60 MET HB3 1 65 VAL MG2 3.040 . 3.040 2.768 2.742 2.797 . 0 0 "[ . 1 . 2]" 1
1211 1 77 LEU HA 1 80 ARG H 3.820 . 3.820 3.242 3.145 3.494 . 0 0 "[ . 1 . 2]" 1
1212 1 81 HIS HB2 1 84 VAL QG 4.300 . 4.300 3.837 2.243 4.282 . 0 0 "[ . 1 . 2]" 1
1213 1 40 LYS HB3 1 40 LYS HG3 2.980 . 2.980 2.613 2.583 2.621 . 0 0 "[ . 1 . 2]" 1
1214 1 13 VAL H 1 14 VAL H 3.680 . 3.680 2.783 2.757 2.805 . 0 0 "[ . 1 . 2]" 1
1215 1 73 LEU H 1 74 PHE H 4.250 . 4.250 2.850 2.771 2.942 . 0 0 "[ . 1 . 2]" 1
1216 1 8 VAL MG1 1 77 LEU QB 4.390 . 4.390 4.411 4.335 4.467 0.077 17 0 "[ . 1 . 2]" 1
1217 1 87 LYS H 1 89 ASP H 5.260 . 5.260 4.485 4.223 5.330 0.070 8 0 "[ . 1 . 2]" 1
1218 1 22 TRP HZ3 1 50 ILE MD 5.280 . 5.280 4.031 3.751 4.129 . 0 0 "[ . 1 . 2]" 1
1219 1 121 GLN HA 1 122 LEU H 2.870 . 2.870 2.215 2.175 2.275 . 0 0 "[ . 1 . 2]" 1
1220 1 23 ASN H 1 26 LEU QD 5.000 . 5.000 4.774 4.730 4.867 . 0 0 "[ . 1 . 2]" 1
1221 1 160 SER QB 1 175 ILE MG 3.800 . 3.800 3.856 3.828 3.875 0.075 19 0 "[ . 1 . 2]" 1
1222 1 159 ILE MG 1 174 LEU QB 3.980 . 3.980 2.606 2.550 2.679 . 0 0 "[ . 1 . 2]" 1
1223 1 132 TYR H 1 172 CYS H 4.570 . 4.570 3.174 2.982 3.262 . 0 0 "[ . 1 . 2]" 1
1224 1 14 VAL HA 1 14 VAL MG2 3.000 . 3.000 2.306 2.298 2.319 . 0 0 "[ . 1 . 2]" 1
1225 1 65 VAL HA 1 65 VAL MG2 3.090 . 3.090 2.244 2.225 2.257 . 0 0 "[ . 1 . 2]" 1
1226 1 147 PHE HA 1 147 PHE QE 4.360 . 4.360 4.324 4.298 4.354 . 0 0 "[ . 1 . 2]" 1
1227 1 156 LYS QB 1 157 ILE H 4.030 . 4.030 2.977 2.909 3.152 . 0 0 "[ . 1 . 2]" 1
1228 1 157 ILE H 1 179 GLN QB 5.500 . 5.500 5.282 4.997 5.478 . 0 0 "[ . 1 . 2]" 1
1229 1 59 ASN H 1 59 ASN HA 2.650 . 2.650 2.285 2.282 2.287 . 0 0 "[ . 1 . 2]" 1
1230 1 147 PHE QB 1 148 GLY H 3.960 . 3.960 2.716 2.677 2.755 . 0 0 "[ . 1 . 2]" 1
1231 1 95 VAL MG2 1 178 LEU MD2 4.240 . 4.240 3.910 3.709 4.002 . 0 0 "[ . 1 . 2]" 1
1232 1 58 LEU MD2 1 59 ASN H 4.880 . 4.880 4.739 4.724 4.757 . 0 0 "[ . 1 . 2]" 1
1233 1 36 TYR H 1 36 TYR HB3 3.870 . 3.870 3.280 2.968 3.550 . 0 0 "[ . 1 . 2]" 1
1234 1 163 THR HB 1 173 MET HG3 4.910 . 4.910 4.962 4.928 4.986 0.076 2 0 "[ . 1 . 2]" 1
1235 1 66 VAL MG2 1 141 CYS HB2 3.850 . 3.850 2.443 2.078 2.665 . 0 0 "[ . 1 . 2]" 1
1236 1 55 ALA MB 1 65 VAL MG1 2.870 . 2.870 2.642 2.613 2.661 . 0 0 "[ . 1 . 2]" 1
1237 1 104 LEU QD 1 106 VAL H 4.970 . 4.970 4.759 4.606 4.830 . 0 0 "[ . 1 . 2]" 1
1238 1 36 TYR H 1 37 VAL H 4.510 . 4.510 4.323 3.882 4.562 0.052 6 0 "[ . 1 . 2]" 1
1239 1 152 HIS QB 1 153 PHE H 3.610 . 3.610 2.815 2.712 2.845 . 0 0 "[ . 1 . 2]" 1
1240 1 153 PHE HA 1 154 GLN H 3.530 . 3.530 2.943 2.876 3.025 . 0 0 "[ . 1 . 2]" 1
1241 1 100 ASP H 1 101 VAL H 3.790 . 3.790 3.764 3.739 3.803 0.013 3 0 "[ . 1 . 2]" 1
1242 1 145 LEU HA 1 145 LEU MD2 3.650 . 3.650 2.197 2.159 2.245 . 0 0 "[ . 1 . 2]" 1
1243 1 125 ASN QB 1 126 ASN H 4.400 . 4.400 3.108 1.698 3.829 . 0 0 "[ . 1 . 2]" 1
1244 1 102 ILE MD 2 1 HEM HAB 4.160 . 4.160 3.939 3.695 4.184 0.024 19 0 "[ . 1 . 2]" 1
1245 1 81 HIS HB3 1 84 VAL H 5.050 . 5.050 3.592 3.179 4.911 . 0 0 "[ . 1 . 2]" 1
1246 1 148 GLY HA2 1 151 GLN H 4.130 . 4.130 3.924 3.680 4.084 . 0 0 "[ . 1 . 2]" 1
1247 1 37 VAL HB 1 40 LYS H 3.560 . 3.560 2.454 2.332 2.668 . 0 0 "[ . 1 . 2]" 1
1248 1 157 ILE MG 1 176 ILE MG 3.270 . 3.270 2.778 2.712 2.887 . 0 0 "[ . 1 . 2]" 1
1249 1 173 MET QB 1 175 ILE MD . . 4.270 4.008 3.885 4.192 . 0 0 "[ . 1 . 2]" 1
1250 1 61 PRO HB2 1 64 ASP H 3.840 . 3.840 3.113 3.089 3.136 . 0 0 "[ . 1 . 2]" 1
1251 1 160 SER HA 1 161 HIS H 3.240 . 3.240 2.141 2.131 2.165 . 0 0 "[ . 1 . 2]" 1
1252 1 94 LEU HA 1 94 LEU HG 3.530 . 3.530 2.454 2.268 2.547 . 0 0 "[ . 1 . 2]" 1
1253 1 98 ILE HB 1 98 ILE MD 2.930 . 2.930 2.337 2.269 2.372 . 0 0 "[ . 1 . 2]" 1
1254 1 52 GLN QB 1 62 ILE HB 3.580 . 3.580 3.553 3.517 3.585 0.005 16 0 "[ . 1 . 2]" 1
1255 1 120 GLY HA3 1 130 LEU HA 3.880 . 3.880 3.800 3.706 3.858 . 0 0 "[ . 1 . 2]" 1
1256 1 47 LEU MD1 1 50 ILE MD 4.590 . 4.590 3.098 3.013 3.182 . 0 0 "[ . 1 . 2]" 1
1257 1 178 LEU H 1 178 LEU HG 3.720 . 3.720 2.267 2.179 2.350 . 0 0 "[ . 1 . 2]" 1
1258 1 17 CYS HA 1 21 VAL MG1 4.720 . 4.720 4.556 4.514 4.609 . 0 0 "[ . 1 . 2]" 1
1259 1 157 ILE HB 1 158 GLN HA 4.480 . 4.480 4.386 4.359 4.408 . 0 0 "[ . 1 . 2]" 1
1260 1 174 LEU QB 1 176 ILE QG 3.450 . 3.450 3.336 3.285 3.369 . 0 0 "[ . 1 . 2]" 1
1261 1 103 HIS QB 1 105 GLU H 5.500 . 5.500 4.981 4.918 5.067 . 0 0 "[ . 1 . 2]" 1
1262 1 75 ASN HB3 1 78 ALA MB 5.500 . 5.500 4.958 4.915 5.004 . 0 0 "[ . 1 . 2]" 1
1263 1 178 LEU H 1 178 LEU MD2 3.950 . 3.950 3.586 3.554 3.624 . 0 0 "[ . 1 . 2]" 1
1264 1 5 ILE MG 1 6 PHE QE 4.430 . 4.430 4.457 4.433 4.504 0.074 10 0 "[ . 1 . 2]" 1
1265 1 154 GLN H 1 155 GLN H 3.290 . 3.290 3.008 2.965 3.041 . 0 0 "[ . 1 . 2]" 1
1266 1 46 GLU QB 1 47 LEU H 3.860 . 3.860 2.865 2.646 3.596 . 0 0 "[ . 1 . 2]" 1
1267 1 95 VAL MG1 1 176 ILE MD 2.400 . 2.400 2.161 2.088 2.216 . 0 0 "[ . 1 . 2]" 1
1268 1 157 ILE HA 1 178 LEU HA 3.580 . 3.580 3.257 3.070 3.354 . 0 0 "[ . 1 . 2]" 1
1269 1 21 VAL H 1 21 VAL MG1 2.760 . 2.760 2.515 2.416 2.637 . 0 0 "[ . 1 . 2]" 1
1270 1 85 VAL H 1 85 VAL QG 3.740 . 3.740 2.091 1.627 2.294 . 0 0 "[ . 1 . 2]" 1
1271 1 150 ALA HA 1 155 GLN QG 3.950 . 3.950 3.776 3.589 4.014 0.064 18 0 "[ . 1 . 2]" 1
1272 1 91 PHE QE 1 178 LEU MD2 3.700 . 3.700 2.926 2.739 3.221 . 0 0 "[ . 1 . 2]" 1
1273 1 61 PRO HB3 1 63 GLN H 4.470 . 4.470 4.433 4.405 4.467 . 0 0 "[ . 1 . 2]" 1
1274 1 139 CYS QB 1 174 LEU MD1 4.880 . 4.880 3.645 3.115 4.320 . 0 0 "[ . 1 . 2]" 1
1275 1 124 PRO QG 1 125 ASN H 4.850 . 4.850 4.226 3.699 4.443 . 0 0 "[ . 1 . 2]" 1
1276 1 13 VAL MG2 1 14 VAL HB 3.850 . 3.850 3.639 3.622 3.665 . 0 0 "[ . 1 . 2]" 1
1277 1 81 HIS HD1 1 84 VAL H 4.980 . 4.980 4.703 4.114 4.992 0.012 2 0 "[ . 1 . 2]" 1
1278 1 77 LEU MD2 1 80 ARG H 4.590 . 4.590 4.543 4.464 4.658 0.068 8 0 "[ . 1 . 2]" 1
1279 1 14 VAL MG2 1 19 MET HA 3.210 . 3.210 2.242 2.205 2.305 . 0 0 "[ . 1 . 2]" 1
1280 1 106 VAL H 1 109 LEU QD 4.240 . 4.240 3.878 3.544 4.115 . 0 0 "[ . 1 . 2]" 1
1281 1 71 GLN H 1 144 GLY HA2 4.250 . 4.250 3.742 3.452 3.919 . 0 0 "[ . 1 . 2]" 1
1282 1 17 CYS H 1 18 GLY HA3 4.690 . 4.690 4.681 4.652 4.696 0.006 1 0 "[ . 1 . 2]" 1
1283 1 157 ILE MD 1 157 ILE MG 3.070 . 3.070 2.152 2.106 2.192 . 0 0 "[ . 1 . 2]" 1
1284 1 85 VAL HA 1 87 LYS H 4.300 . 4.300 3.481 3.338 3.651 . 0 0 "[ . 1 . 2]" 1
1285 1 73 LEU MD1 1 145 LEU MD2 4.360 . 4.360 4.289 4.217 4.374 0.014 12 0 "[ . 1 . 2]" 1
1286 1 22 TRP HE1 1 26 LEU QD 3.410 . 3.410 2.600 2.233 2.764 . 0 0 "[ . 1 . 2]" 1
1287 1 166 HIS H 1 166 HIS QB . . 3.710 2.279 2.229 2.501 . 0 0 "[ . 1 . 2]" 1
1288 1 83 ASP H 1 85 VAL H 4.130 . 4.130 4.205 4.171 4.270 0.140 17 0 "[ . 1 . 2]" 1
1289 1 8 VAL MG2 1 77 LEU MD2 3.640 . 3.640 2.860 2.439 3.313 . 0 0 "[ . 1 . 2]" 1
1290 1 9 LEU MD2 1 50 ILE HB 4.180 . 4.180 3.792 3.687 3.864 . 0 0 "[ . 1 . 2]" 1
1291 1 23 ASN H 1 23 ASN QB 2.800 . 2.800 2.367 2.258 2.444 . 0 0 "[ . 1 . 2]" 1
1292 1 48 PHE HA 1 51 VAL HB 3.620 . 3.620 2.528 2.415 2.619 . 0 0 "[ . 1 . 2]" 1
1293 1 163 THR MG 1 171 HIS HD1 5.500 . 5.500 3.336 2.421 5.117 . 0 0 "[ . 1 . 2]" 1
1294 1 46 GLU QG 1 50 ILE MD 4.300 . 4.300 4.113 2.183 4.306 0.006 13 0 "[ . 1 . 2]" 1
1295 1 81 HIS HB2 1 84 VAL HB 3.980 . 3.980 3.618 2.296 4.003 0.023 12 0 "[ . 1 . 2]" 1
1296 1 115 LEU QB 1 115 LEU HG 2.460 . 2.460 2.437 2.201 2.499 0.039 17 0 "[ . 1 . 2]" 1
1297 1 8 VAL MG2 1 76 GLY HA2 4.410 . 4.410 4.125 3.922 4.387 . 0 0 "[ . 1 . 2]" 1
1298 1 84 VAL QG 1 105 GLU QB 3.580 . 3.580 2.402 2.261 2.549 . 0 0 "[ . 1 . 2]" 1
1299 1 129 ALA HA 1 130 LEU H 3.310 . 3.310 2.131 2.124 2.141 . 0 0 "[ . 1 . 2]" 1
1300 1 9 LEU HB3 1 47 LEU MD1 4.390 . 4.390 4.027 3.969 4.124 . 0 0 "[ . 1 . 2]" 1
1301 1 14 VAL MG1 1 15 ALA MB 3.770 . 3.770 3.779 3.764 3.803 0.033 18 0 "[ . 1 . 2]" 1
1302 1 123 LEU HA 1 123 LEU MD2 2.470 . 2.470 2.326 2.222 2.383 . 0 0 "[ . 1 . 2]" 1
1303 1 101 VAL H 1 102 ILE QG 4.930 . 4.930 4.937 4.912 4.964 0.034 3 0 "[ . 1 . 2]" 1
1304 1 158 GLN H 1 177 GLU H 3.960 . 3.960 3.123 2.976 3.234 . 0 0 "[ . 1 . 2]" 1
1305 1 154 GLN HA 1 154 GLN HB2 2.730 . 2.730 2.619 2.587 2.985 0.255 4 0 "[ . 1 . 2]" 1
1306 1 181 ASP H 1 181 ASP QB 2.620 . 2.620 2.351 2.238 2.603 . 0 0 "[ . 1 . 2]" 1
1307 1 26 LEU HA 1 26 LEU QD 3.260 . 3.260 2.136 2.111 2.158 . 0 0 "[ . 1 . 2]" 1
1308 1 74 PHE QD 1 145 LEU MD2 3.600 . 3.600 2.326 2.284 2.482 . 0 0 "[ . 1 . 2]" 1
1309 1 91 PHE QE 1 95 VAL MG2 3.650 . 3.650 2.238 2.222 2.274 . 0 0 "[ . 1 . 2]" 1
1310 1 66 VAL HB 1 69 PHE QB 5.430 . 5.430 4.703 4.624 4.756 . 0 0 "[ . 1 . 2]" 1
1311 1 52 GLN H 1 52 GLN QB 3.340 . 3.340 2.605 2.591 2.620 . 0 0 "[ . 1 . 2]" 1
1312 1 84 VAL QG 1 102 ILE MG 3.400 . 3.400 3.202 2.723 3.444 0.044 16 0 "[ . 1 . 2]" 1
1313 1 174 LEU QB 1 175 ILE H . . 4.440 3.562 3.459 3.601 . 0 0 "[ . 1 . 2]" 1
1314 1 14 VAL HA 1 18 GLY HA3 4.010 . 4.010 3.874 3.744 4.006 . 0 0 "[ . 1 . 2]" 1
1315 1 10 GLU QG 1 11 ASP H 4.160 . 4.160 3.707 2.029 3.855 . 0 0 "[ . 1 . 2]" 1
1316 1 159 ILE HA 1 160 SER H 3.310 . 3.310 2.115 2.109 2.120 . 0 0 "[ . 1 . 2]" 1
1317 1 161 HIS HA 1 161 HIS HD1 4.380 . 4.380 2.898 2.349 3.717 . 0 0 "[ . 1 . 2]" 1
1318 1 65 VAL MG1 1 67 LYS H 5.060 . 5.060 4.892 4.836 4.935 . 0 0 "[ . 1 . 2]" 1
1319 1 180 ASN H 1 180 ASN QB 3.470 . 3.470 2.618 2.228 2.832 . 0 0 "[ . 1 . 2]" 1
1320 1 23 ASN HA 1 27 GLU H 3.890 . 3.890 3.903 3.666 3.961 0.071 9 0 "[ . 1 . 2]" 1
1321 1 145 LEU HB2 1 146 LEU H 4.370 . 4.370 2.600 2.504 2.657 . 0 0 "[ . 1 . 2]" 1
1322 1 78 ALA HA 1 80 ARG H 4.000 . 4.000 3.976 3.797 4.019 0.019 18 0 "[ . 1 . 2]" 1
1323 1 62 ILE HG12 1 62 ILE MG 2.750 . 2.750 2.276 2.268 2.283 . 0 0 "[ . 1 . 2]" 1
1324 1 158 GLN H 1 179 GLN QG 4.780 . 4.780 4.076 3.806 4.232 . 0 0 "[ . 1 . 2]" 1
1325 1 122 LEU MD1 1 128 ILE MG 2.640 . 2.640 2.289 2.211 2.413 . 0 0 "[ . 1 . 2]" 1
1326 1 160 SER QB 1 161 HIS H 3.890 . 3.890 3.838 3.478 3.948 0.058 17 0 "[ . 1 . 2]" 1
1327 1 122 LEU HA 1 122 LEU MD2 3.840 . 3.840 3.705 3.699 3.720 . 0 0 "[ . 1 . 2]" 1
1328 1 163 THR HA 1 163 THR MG 2.820 . 2.820 2.284 2.267 2.304 . 0 0 "[ . 1 . 2]" 1
1329 1 130 LEU MD2 1 131 ARG H 4.580 . 4.580 4.405 3.990 4.585 0.005 8 0 "[ . 1 . 2]" 1
1330 1 64 ASP H 1 65 VAL H 3.350 . 3.350 2.349 2.339 2.362 . 0 0 "[ . 1 . 2]" 1
1331 1 44 GLU HA 1 44 GLU QG 3.370 . 3.370 2.633 2.249 3.443 0.073 6 0 "[ . 1 . 2]" 1
1332 1 14 VAL HA 1 18 GLY H 3.150 . 3.150 2.619 2.576 2.715 . 0 0 "[ . 1 . 2]" 1
1333 1 109 LEU HA 1 109 LEU QD 3.000 . 3.000 2.221 1.922 2.472 . 0 0 "[ . 1 . 2]" 1
1334 1 149 ALA MB 2 1 HEM HAB 5.500 . 5.500 4.513 4.104 5.498 . 0 0 "[ . 1 . 2]" 1
1335 1 6 PHE QE 1 47 LEU MD1 3.300 . 3.300 2.677 2.377 3.106 . 0 0 "[ . 1 . 2]" 1
1336 1 28 LYS H 1 28 LYS HB2 2.990 . 2.990 2.502 2.436 2.670 . 0 0 "[ . 1 . 2]" 1
1337 1 177 GLU QB 1 177 GLU QG . . 2.400 2.099 2.047 2.110 . 0 0 "[ . 1 . 2]" 1
1338 1 65 VAL H 1 67 LYS H 4.310 . 4.310 3.999 3.932 4.068 . 0 0 "[ . 1 . 2]" 1
1339 1 65 VAL MG2 1 68 ALA MB 4.270 . 4.270 4.239 4.178 4.276 0.006 8 0 "[ . 1 . 2]" 1
1340 1 157 ILE HA 1 176 ILE MG 4.850 . 4.850 4.234 4.174 4.301 . 0 0 "[ . 1 . 2]" 1
1341 1 104 LEU H 1 104 LEU HG 4.490 . 4.490 4.458 4.453 4.463 . 0 0 "[ . 1 . 2]" 1
1342 1 120 GLY H 1 130 LEU MD1 5.020 . 5.020 3.844 3.518 4.502 . 0 0 "[ . 1 . 2]" 1
1343 1 119 ASN HA 1 119 ASN QD . . 2.570 1.999 1.784 2.283 . 0 0 "[ . 1 . 2]" 1
1344 1 13 VAL MG1 1 69 PHE QE 3.480 . 3.480 3.561 3.531 3.578 0.098 11 0 "[ . 1 . 2]" 1
1345 1 13 VAL MG1 1 22 TRP HE1 2.780 . 2.780 2.290 2.282 2.298 . 0 0 "[ . 1 . 2]" 1
1346 1 127 GLN HA 1 128 ILE H 3.400 . 3.400 2.260 2.224 2.278 . 0 0 "[ . 1 . 2]" 1
1347 1 19 MET HA 1 22 TRP HB3 3.690 . 3.690 2.845 2.623 3.085 . 0 0 "[ . 1 . 2]" 1
1348 1 159 ILE HG13 1 176 ILE HA 3.800 . 3.800 3.827 3.803 3.848 0.048 9 0 "[ . 1 . 2]" 1
1349 1 121 GLN HA 1 121 GLN QG 3.220 . 3.220 2.529 2.289 2.817 . 0 0 "[ . 1 . 2]" 1
1350 1 50 ILE QG 1 50 ILE MG 2.750 . 2.750 2.243 2.232 2.298 . 0 0 "[ . 1 . 2]" 1
1351 1 9 LEU MD2 1 51 VAL HA 4.700 . 4.700 4.323 4.247 4.445 . 0 0 "[ . 1 . 2]" 1
1352 1 72 PHE HA 1 72 PHE QD 3.610 . 3.610 2.693 2.334 2.997 . 0 0 "[ . 1 . 2]" 1
1353 1 17 CYS HB3 1 21 VAL MG2 3.310 . 3.310 2.967 2.927 3.041 . 0 0 "[ . 1 . 2]" 1
1354 1 159 ILE HA 1 176 ILE MG 3.990 . 3.990 3.834 3.791 3.869 . 0 0 "[ . 1 . 2]" 1
1355 1 12 MET H 1 13 VAL H 3.530 . 3.530 2.685 2.653 2.706 . 0 0 "[ . 1 . 2]" 1
1356 1 134 SER HA 1 135 PRO QD 3.500 . 3.500 2.099 2.052 2.139 . 0 0 "[ . 1 . 2]" 1
1357 1 109 LEU H 1 109 LEU HG 4.320 . 4.320 3.583 2.232 4.326 0.006 6 0 "[ . 1 . 2]" 1
1358 1 122 LEU MD1 1 123 LEU H 3.970 . 3.970 3.894 3.619 3.988 0.018 9 0 "[ . 1 . 2]" 1
1359 1 87 LYS H 1 87 LYS QG 3.720 . 3.720 2.447 1.985 2.858 . 0 0 "[ . 1 . 2]" 1
1360 1 16 GLN H 1 16 GLN HG2 3.390 . 3.390 3.345 3.297 3.372 . 0 0 "[ . 1 . 2]" 1
1361 1 130 LEU H 1 130 LEU MD1 4.610 . 4.610 4.393 4.294 4.536 . 0 0 "[ . 1 . 2]" 1
1362 1 49 SER H 1 50 ILE H 4.030 . 4.030 2.637 2.597 2.684 . 0 0 "[ . 1 . 2]" 1
1363 1 115 LEU H 1 115 LEU MD1 4.490 . 4.490 3.708 3.289 4.262 . 0 0 "[ . 1 . 2]" 1
1364 1 19 MET QB 1 22 TRP HB3 4.610 . 4.610 4.004 3.879 4.262 . 0 0 "[ . 1 . 2]" 1
1365 1 6 PHE HA 1 9 LEU HB2 3.300 . 3.300 3.320 3.163 3.351 0.051 12 0 "[ . 1 . 2]" 1
1366 1 5 ILE HA 1 73 LEU MD2 4.400 . 4.400 3.304 3.168 3.385 . 0 0 "[ . 1 . 2]" 1
1367 1 160 SER QB 1 175 ILE QG . . 4.440 3.171 3.089 3.280 . 0 0 "[ . 1 . 2]" 1
1368 1 71 GLN HG3 1 148 GLY HA2 4.510 . 4.510 4.541 4.512 4.569 0.059 6 0 "[ . 1 . 2]" 1
1369 1 8 VAL H 1 8 VAL MG2 3.460 . 3.460 1.895 1.808 1.987 . 0 0 "[ . 1 . 2]" 1
1370 1 51 VAL MG1 1 55 ALA H 4.730 . 4.730 4.561 4.543 4.573 . 0 0 "[ . 1 . 2]" 1
1371 1 55 ALA H 1 56 GLN QB 4.770 . 4.770 4.511 4.478 4.523 . 0 0 "[ . 1 . 2]" 1
1372 1 46 GLU QB 1 50 ILE MD 3.650 . 3.650 2.571 2.398 3.438 . 0 0 "[ . 1 . 2]" 1
1373 1 131 ARG H 1 131 ARG HB2 3.810 . 3.810 2.635 2.563 2.741 . 0 0 "[ . 1 . 2]" 1
1374 1 94 LEU HA 1 94 LEU QD 3.560 . 3.560 2.823 2.235 3.082 . 0 0 "[ . 1 . 2]" 1
1375 1 101 VAL HA 1 104 LEU H 4.620 . 4.620 3.508 3.424 3.605 . 0 0 "[ . 1 . 2]" 1
1376 1 120 GLY HA2 1 130 LEU HA 3.600 . 3.600 2.244 2.198 2.279 . 0 0 "[ . 1 . 2]" 1
1377 1 156 LYS QG 1 157 ILE H . . 4.960 4.066 3.936 4.281 . 0 0 "[ . 1 . 2]" 1
1378 1 17 CYS HB3 1 18 GLY H 5.000 . 5.000 3.780 3.751 3.836 . 0 0 "[ . 1 . 2]" 1
1379 1 143 GLU HG2 1 159 ILE MD 3.310 . 3.310 2.876 2.830 2.947 . 0 0 "[ . 1 . 2]" 1
1380 1 115 LEU HA 1 115 LEU MD2 4.200 . 4.200 2.258 2.079 2.999 . 0 0 "[ . 1 . 2]" 1
1381 1 74 PHE HZ 1 149 ALA HA 4.250 . 4.250 4.224 3.482 4.306 0.056 12 0 "[ . 1 . 2]" 1
1382 1 128 ILE H 1 176 ILE MD 4.230 . 4.230 4.162 3.992 4.278 0.048 7 0 "[ . 1 . 2]" 1
1383 1 128 ILE HB 1 176 ILE MD 2.770 . 2.770 2.704 2.574 2.804 0.034 12 0 "[ . 1 . 2]" 1
1384 1 60 MET HB3 1 65 VAL HA 4.810 . 4.810 4.852 4.812 4.869 0.059 20 0 "[ . 1 . 2]" 1
1385 1 72 PHE H 1 72 PHE QD 3.940 . 3.940 3.714 3.219 4.000 0.060 4 0 "[ . 1 . 2]" 1
1386 1 52 GLN HG2 1 54 VAL H 5.280 . 5.280 4.986 4.943 5.037 . 0 0 "[ . 1 . 2]" 1
1387 1 67 LYS H 1 67 LYS QB 3.120 . 3.120 2.256 2.248 2.261 . 0 0 "[ . 1 . 2]" 1
1388 1 47 LEU MD1 1 51 VAL HA 5.500 . 5.500 5.412 5.377 5.438 . 0 0 "[ . 1 . 2]" 1
1389 1 35 VAL HA 1 36 TYR QD 4.470 . 4.470 3.499 2.692 4.053 . 0 0 "[ . 1 . 2]" 1
1390 1 26 LEU HB3 1 26 LEU QD 2.940 . 2.940 2.245 2.201 2.270 . 0 0 "[ . 1 . 2]" 1
1391 1 103 HIS H 1 103 HIS QB 3.040 . 3.040 2.260 2.189 2.296 . 0 0 "[ . 1 . 2]" 1
1392 1 62 ILE HA 1 66 VAL H 4.040 . 4.040 3.798 3.765 3.827 . 0 0 "[ . 1 . 2]" 1
1393 1 22 TRP HE1 1 50 ILE MG 4.480 . 4.480 3.759 3.724 3.809 . 0 0 "[ . 1 . 2]" 1
1394 1 25 LEU QB 1 25 LEU MD1 2.830 . 2.830 2.416 2.414 2.419 . 0 0 "[ . 1 . 2]" 1
1395 1 98 ILE MG 1 103 HIS H 5.000 . 5.000 4.163 4.044 4.298 . 0 0 "[ . 1 . 2]" 1
1396 1 149 ALA HA 1 152 HIS H 4.460 . 4.460 3.662 3.517 3.757 . 0 0 "[ . 1 . 2]" 1
1397 1 130 LEU HA 1 130 LEU MD1 3.650 . 3.650 2.689 2.377 3.177 . 0 0 "[ . 1 . 2]" 1
1398 1 23 ASN QD 1 26 LEU HB3 5.500 . 5.500 3.767 2.800 4.877 . 0 0 "[ . 1 . 2]" 1
1399 1 70 GLY HA2 1 73 LEU QB 4.650 . 4.650 2.445 2.338 2.562 . 0 0 "[ . 1 . 2]" 1
1400 1 105 GLU QG 1 108 LYS H 5.500 . 5.500 4.753 4.300 5.252 . 0 0 "[ . 1 . 2]" 1
1401 1 5 ILE HA 1 5 ILE MG 3.570 . 3.570 2.241 2.225 2.254 . 0 0 "[ . 1 . 2]" 1
1402 1 87 LYS H 1 87 LYS QB 3.530 . 3.530 2.349 2.245 2.488 . 0 0 "[ . 1 . 2]" 1
1403 1 120 GLY HA3 1 130 LEU MD1 3.680 . 3.680 2.892 2.690 3.476 . 0 0 "[ . 1 . 2]" 1
1404 1 130 LEU MD2 1 132 TYR HA 4.960 . 4.960 4.754 4.352 4.977 0.017 9 0 "[ . 1 . 2]" 1
1405 1 131 ARG HB3 1 131 ARG HG3 2.910 . 2.910 3.016 3.010 3.019 0.109 12 0 "[ . 1 . 2]" 1
1406 1 12 MET HA 1 12 MET HG2 3.830 . 3.830 2.496 2.261 3.154 . 0 0 "[ . 1 . 2]" 1
1407 1 37 VAL MG2 1 40 LYS HG3 3.780 . 3.780 2.536 2.437 2.667 . 0 0 "[ . 1 . 2]" 1
1408 1 44 GLU H 1 44 GLU QG 4.490 . 4.490 2.941 1.991 3.999 . 0 0 "[ . 1 . 2]" 1
1409 1 66 VAL MG2 1 141 CYS HA 3.480 . 3.480 2.593 2.266 2.887 . 0 0 "[ . 1 . 2]" 1
1410 1 66 VAL HA 1 66 VAL MG1 3.210 . 3.210 3.188 3.184 3.192 . 0 0 "[ . 1 . 2]" 1
1411 1 22 TRP HB2 1 22 TRP HE1 5.120 . 5.120 5.155 5.152 5.162 0.042 20 0 "[ . 1 . 2]" 1
1412 1 62 ILE H 1 62 ILE HB 3.150 . 3.150 2.346 2.335 2.358 . 0 0 "[ . 1 . 2]" 1
1413 1 30 ALA MB 1 34 ARG H 4.350 . 4.350 3.812 3.169 4.388 0.038 13 0 "[ . 1 . 2]" 1
1414 1 163 THR H 1 164 CYS H 4.930 . 4.930 4.414 4.365 4.472 . 0 0 "[ . 1 . 2]" 1
1415 1 115 LEU H 1 115 LEU MD2 4.740 . 4.740 3.837 2.658 4.410 . 0 0 "[ . 1 . 2]" 1
1416 1 123 LEU MD1 1 175 ILE MG 2.550 . 2.550 2.419 2.324 2.459 . 0 0 "[ . 1 . 2]" 1
1417 1 22 TRP HA 1 50 ILE MG 4.870 . 4.870 4.902 4.881 4.943 0.073 20 0 "[ . 1 . 2]" 1
1418 1 95 VAL HA 1 95 VAL MG2 3.320 . 3.320 2.281 2.215 2.416 . 0 0 "[ . 1 . 2]" 1
1419 1 159 ILE MD 1 176 ILE QG 4.020 . 4.020 2.657 2.575 2.752 . 0 0 "[ . 1 . 2]" 1
1420 1 3 GLY HA3 1 6 PHE HB2 4.790 . 4.790 2.875 2.702 2.993 . 0 0 "[ . 1 . 2]" 1
1421 1 153 PHE H 1 155 GLN QB . . 4.630 4.002 3.895 4.118 . 0 0 "[ . 1 . 2]" 1
1422 1 15 ALA MB 1 16 GLN HG2 3.630 . 3.630 3.577 3.525 3.621 . 0 0 "[ . 1 . 2]" 1
1423 1 145 LEU H 1 145 LEU HB3 3.960 . 3.960 3.584 3.563 3.604 . 0 0 "[ . 1 . 2]" 1
1424 1 37 VAL MG1 1 40 LYS QD 3.640 . 3.640 3.428 3.323 3.544 . 0 0 "[ . 1 . 2]" 1
1425 1 66 VAL MG1 1 141 CYS H 4.460 . 4.460 4.386 4.176 4.539 0.079 12 0 "[ . 1 . 2]" 1
1426 1 21 VAL MG2 1 24 GLU HB2 3.790 . 3.790 3.742 3.713 3.796 0.006 1 0 "[ . 1 . 2]" 1
1427 1 15 ALA H 1 16 GLN HG2 4.910 . 4.910 4.955 4.936 4.972 0.062 14 0 "[ . 1 . 2]" 1
1428 1 35 VAL HA 1 36 TYR H 2.950 . 2.950 2.213 2.138 2.380 . 0 0 "[ . 1 . 2]" 1
1429 1 40 LYS HG2 1 41 SER H 5.210 . 5.210 4.439 3.869 4.689 . 0 0 "[ . 1 . 2]" 1
1430 1 34 ARG H 1 35 VAL QG 4.530 . 4.530 4.117 3.167 4.635 0.105 7 0 "[ . 1 . 2]" 1
1431 1 78 ALA MB 1 80 ARG H 4.340 . 4.340 4.335 4.276 4.380 0.040 4 0 "[ . 1 . 2]" 1
1432 1 78 ALA HA 1 85 VAL HB 4.300 . 4.300 3.534 2.989 4.227 . 0 0 "[ . 1 . 2]" 1
1433 1 95 VAL MG2 1 146 LEU MD2 2.550 . 2.550 2.581 2.555 2.617 0.067 19 0 "[ . 1 . 2]" 1
1434 1 40 LYS H 1 41 SER H 4.710 . 4.710 3.964 2.618 4.519 . 0 0 "[ . 1 . 2]" 1
1435 1 141 CYS HB3 1 142 ALA H 4.460 . 4.460 2.612 2.480 2.747 . 0 0 "[ . 1 . 2]" 1
1436 1 67 LYS QB 1 69 PHE H 5.150 . 5.150 4.430 4.311 4.470 . 0 0 "[ . 1 . 2]" 1
1437 1 8 VAL HA 1 11 ASP HB3 3.920 . 3.920 3.428 3.284 3.468 . 0 0 "[ . 1 . 2]" 1
1438 1 150 ALA HA 1 157 ILE MG 4.480 . 4.480 4.262 4.024 4.424 . 0 0 "[ . 1 . 2]" 1
1439 1 54 VAL H 1 55 ALA H 3.450 . 3.450 2.774 2.767 2.786 . 0 0 "[ . 1 . 2]" 1
1440 1 173 MET HA 1 174 LEU H 3.410 . 3.410 2.174 2.161 2.201 . 0 0 "[ . 1 . 2]" 1
1441 1 54 VAL MG1 1 58 LEU H 4.590 . 4.590 4.695 4.672 4.712 0.122 10 0 "[ . 1 . 2]" 1
1442 1 147 PHE QE 1 159 ILE HB 4.310 . 4.310 3.328 3.191 3.457 . 0 0 "[ . 1 . 2]" 1
1443 1 122 LEU HA 1 122 LEU HG 3.000 . 3.000 2.334 2.309 2.421 . 0 0 "[ . 1 . 2]" 1
1444 1 84 VAL HA 1 87 LYS QB 4.030 . 4.030 4.000 3.924 4.094 0.064 8 0 "[ . 1 . 2]" 1
1445 1 25 LEU H 1 25 LEU QB 3.310 . 3.310 2.159 2.145 2.192 . 0 0 "[ . 1 . 2]" 1
1446 1 65 VAL MG1 1 69 PHE H 4.480 . 4.480 4.046 3.997 4.074 . 0 0 "[ . 1 . 2]" 1
1447 1 156 LYS QB 1 156 LYS QD 2.400 . 2.400 2.276 2.212 2.341 . 0 0 "[ . 1 . 2]" 1
1448 1 5 ILE MG 1 6 PHE QD 4.350 . 4.350 4.300 4.254 4.353 0.003 10 0 "[ . 1 . 2]" 1
1449 1 154 GLN H 1 155 GLN QB 5.450 . 5.450 4.610 4.539 4.648 . 0 0 "[ . 1 . 2]" 1
1450 1 9 LEU HB3 1 9 LEU MD2 2.400 . 2.400 2.451 2.437 2.472 0.072 5 0 "[ . 1 . 2]" 1
1451 1 31 PRO QD 1 32 LYS H 5.500 . 5.500 4.816 4.610 4.981 . 0 0 "[ . 1 . 2]" 1
1452 1 175 ILE H 1 176 ILE H 4.670 . 4.670 4.382 4.361 4.401 . 0 0 "[ . 1 . 2]" 1
1453 1 91 PHE QD 1 95 VAL MG2 3.930 . 3.930 2.985 2.860 3.075 . 0 0 "[ . 1 . 2]" 1
1454 1 37 VAL MG1 1 40 LYS HG3 3.210 . 3.210 2.799 2.638 2.890 . 0 0 "[ . 1 . 2]" 1
1455 1 59 ASN HB2 1 60 MET H 4.660 . 4.660 4.604 4.601 4.607 . 0 0 "[ . 1 . 2]" 1
1456 1 5 ILE HA 1 8 VAL MG2 3.600 . 3.600 3.390 3.065 3.603 0.003 16 0 "[ . 1 . 2]" 1
1457 1 126 ASN H 1 126 ASN QD 5.030 . 5.030 4.301 3.410 4.614 . 0 0 "[ . 1 . 2]" 1
1458 1 48 PHE HA 1 51 VAL MG2 3.580 . 3.580 3.111 2.897 3.193 . 0 0 "[ . 1 . 2]" 1
1459 1 53 ASP HA 1 56 GLN QG 3.720 . 3.720 2.839 2.673 3.042 . 0 0 "[ . 1 . 2]" 1
1460 1 16 GLN HA 1 16 GLN HG3 3.690 . 3.690 3.299 3.273 3.326 . 0 0 "[ . 1 . 2]" 1
1461 1 61 PRO HG2 1 63 GLN HG3 3.340 . 3.340 2.738 2.705 2.763 . 0 0 "[ . 1 . 2]" 1
1462 1 163 THR HB 1 173 MET HG2 4.630 . 4.630 4.661 4.642 4.683 0.053 12 0 "[ . 1 . 2]" 1
1463 1 73 LEU HG 1 77 LEU MD2 4.290 . 4.290 3.836 3.566 4.077 . 0 0 "[ . 1 . 2]" 1
1464 1 96 MET QG 1 122 LEU MD1 3.760 . 3.760 2.956 2.259 3.747 . 0 0 "[ . 1 . 2]" 1
1465 1 8 VAL MG2 1 73 LEU HG 3.360 . 3.360 3.166 3.119 3.274 . 0 0 "[ . 1 . 2]" 1
1466 1 141 CYS H 1 142 ALA MB 4.480 . 4.480 4.173 4.132 4.218 . 0 0 "[ . 1 . 2]" 1
1467 1 164 CYS H 1 164 CYS QB 3.690 . 3.690 2.817 2.628 3.280 . 0 0 "[ . 1 . 2]" 1
1468 1 8 VAL MG1 1 76 GLY H 4.160 . 4.160 2.685 2.613 2.777 . 0 0 "[ . 1 . 2]" 1
1469 1 78 ALA MB 1 79 SER H 3.230 . 3.230 2.612 2.546 2.704 . 0 0 "[ . 1 . 2]" 1
1470 1 67 LYS QD 1 68 ALA H 5.420 . 5.420 4.313 4.219 4.404 . 0 0 "[ . 1 . 2]" 1
1471 1 11 ASP HB3 1 12 MET H 3.710 . 3.710 2.817 2.681 2.888 . 0 0 "[ . 1 . 2]" 1
1472 1 73 LEU QB 1 74 PHE H 4.540 . 4.540 2.568 2.522 2.606 . 0 0 "[ . 1 . 2]" 1
1473 1 156 LYS QD 1 156 LYS QE 2.400 . 2.400 2.056 1.988 2.103 . 0 0 "[ . 1 . 2]" 1
1474 1 51 VAL MG1 1 62 ILE HA 4.140 . 4.140 3.449 3.422 3.471 . 0 0 "[ . 1 . 2]" 1
1475 1 8 VAL MG2 1 77 LEU HG 2.400 . 2.400 2.448 2.338 2.489 0.089 19 0 "[ . 1 . 2]" 1
1476 1 79 SER H 1 80 ARG H 3.570 . 3.570 2.585 2.522 2.650 . 0 0 "[ . 1 . 2]" 1
1477 1 65 VAL H 1 66 VAL H 3.600 . 3.600 2.685 2.647 2.716 . 0 0 "[ . 1 . 2]" 1
1478 1 98 ILE HA 1 102 ILE HB 3.750 . 3.750 2.410 2.290 2.650 . 0 0 "[ . 1 . 2]" 1
1479 1 176 ILE MG 1 178 LEU MD2 2.850 . 2.850 2.648 2.569 2.730 . 0 0 "[ . 1 . 2]" 1
1480 1 84 VAL HA 1 87 LYS QG 3.950 . 3.950 3.428 2.873 4.006 0.056 8 0 "[ . 1 . 2]" 1
1481 1 50 ILE H 1 50 ILE HB 3.670 . 3.670 2.356 2.333 2.378 . 0 0 "[ . 1 . 2]" 1
1482 1 175 ILE HA 1 176 ILE QG 4.090 . 4.090 3.946 3.797 4.020 . 0 0 "[ . 1 . 2]" 1
1483 1 140 PHE H 1 140 PHE QD 5.110 . 5.110 3.263 2.527 3.765 . 0 0 "[ . 1 . 2]" 1
1484 1 29 HIS H 1 29 HIS QB 3.560 . 3.560 2.364 2.319 2.553 . 0 0 "[ . 1 . 2]" 1
1485 1 32 LYS HB3 1 34 ARG H 5.500 . 5.500 5.215 4.697 5.535 0.035 7 0 "[ . 1 . 2]" 1
1486 1 139 CYS HA 1 142 ALA MB 3.440 . 3.440 2.636 2.515 2.751 . 0 0 "[ . 1 . 2]" 1
1487 1 32 LYS QG 1 33 ASP H 4.200 . 4.200 3.564 3.115 3.987 . 0 0 "[ . 1 . 2]" 1
1488 1 173 MET HA 1 173 MET HG3 3.910 . 3.910 2.427 2.415 2.441 . 0 0 "[ . 1 . 2]" 1
1489 1 176 ILE HA 1 176 ILE MD 3.790 . 3.790 3.670 3.610 3.778 . 0 0 "[ . 1 . 2]" 1
1490 1 58 LEU QB 1 58 LEU MD2 2.490 . 2.490 2.229 2.222 2.237 . 0 0 "[ . 1 . 2]" 1
1491 1 4 ILE MD 1 38 SER HB2 4.520 . 4.520 4.443 4.268 4.552 0.032 15 0 "[ . 1 . 2]" 1
1492 1 123 LEU HG 1 128 ILE H 4.090 . 4.090 4.018 3.932 4.192 0.102 19 0 "[ . 1 . 2]" 1
1493 1 62 ILE MG 1 63 GLN HB3 3.450 . 3.450 3.277 3.253 3.306 . 0 0 "[ . 1 . 2]" 1
1494 1 178 LEU MD2 1 179 GLN H 3.970 . 3.970 3.827 3.782 3.878 . 0 0 "[ . 1 . 2]" 1
1495 1 47 LEU QB 1 50 ILE H 5.500 . 5.500 4.942 4.909 4.973 . 0 0 "[ . 1 . 2]" 1
1496 1 30 ALA HA 1 31 PRO QD 3.350 . 3.350 2.099 2.069 2.129 . 0 0 "[ . 1 . 2]" 1
1497 1 66 VAL HA 1 69 PHE QB 3.900 . 3.900 2.424 2.343 2.492 . 0 0 "[ . 1 . 2]" 1
1498 1 14 VAL H 1 19 MET HA 4.790 . 4.790 4.783 4.667 4.827 0.037 20 0 "[ . 1 . 2]" 1
1499 1 123 LEU MD1 1 128 ILE H 3.260 . 3.260 3.308 3.291 3.347 0.087 12 0 "[ . 1 . 2]" 1
1500 1 37 VAL HA 1 39 ALA H 4.280 . 4.280 3.810 3.602 4.010 . 0 0 "[ . 1 . 2]" 1
1501 1 92 THR HA 1 128 ILE MD 3.290 . 3.290 2.437 2.280 2.580 . 0 0 "[ . 1 . 2]" 1
1502 1 28 LYS QE 1 28 LYS QG 3.310 . 3.310 2.457 2.223 2.910 . 0 0 "[ . 1 . 2]" 1
1503 1 22 TRP HB3 1 22 TRP HE1 5.130 . 5.130 4.727 4.724 4.728 . 0 0 "[ . 1 . 2]" 1
1504 1 104 LEU QB 1 104 LEU QD 2.690 . 2.690 1.903 1.897 1.906 . 0 0 "[ . 1 . 2]" 1
1505 1 149 ALA HA 1 151 GLN H 5.010 . 5.010 4.687 4.437 4.775 . 0 0 "[ . 1 . 2]" 1
1506 1 12 MET H 1 13 VAL MG1 5.500 . 5.500 4.159 4.129 4.181 . 0 0 "[ . 1 . 2]" 1
1507 1 103 HIS QB 1 115 LEU MD1 . . 3.460 2.199 2.042 2.294 . 0 0 "[ . 1 . 2]" 1
1508 1 25 LEU HG 1 50 ILE MG 3.140 . 3.140 3.156 3.129 3.197 0.057 12 0 "[ . 1 . 2]" 1
1509 1 65 VAL MG1 1 68 ALA H 4.930 . 4.930 5.029 5.008 5.044 0.114 3 0 "[ . 1 . 2]" 1
1510 1 71 GLN HA 1 148 GLY H 3.670 . 3.670 2.741 2.584 3.072 . 0 0 "[ . 1 . 2]" 1
1511 1 173 MET HA 1 173 MET HG2 3.930 . 3.930 3.249 3.209 3.280 . 0 0 "[ . 1 . 2]" 1
1512 1 107 ASN HB2 1 108 LYS H 3.950 . 3.950 3.748 3.601 3.925 . 0 0 "[ . 1 . 2]" 1
1513 1 3 GLY HA2 1 6 PHE H 4.710 . 4.710 3.948 3.839 4.034 . 0 0 "[ . 1 . 2]" 1
1514 1 176 ILE H 1 176 ILE MG 3.850 . 3.850 3.823 3.819 3.830 . 0 0 "[ . 1 . 2]" 1
1515 1 140 PHE HB3 1 141 CYS H 4.720 . 4.720 3.201 3.039 3.380 . 0 0 "[ . 1 . 2]" 1
1516 1 68 ALA MB 1 69 PHE H 3.500 . 3.500 2.566 2.528 2.618 . 0 0 "[ . 1 . 2]" 1
1517 1 4 ILE HB 1 4 ILE MD 3.660 . 3.660 2.246 2.222 2.273 . 0 0 "[ . 1 . 2]" 1
1518 1 164 CYS H 1 167 THR H 4.750 . 4.750 4.028 3.906 4.237 . 0 0 "[ . 1 . 2]" 1
1519 1 6 PHE QD 1 9 LEU HB3 4.940 . 4.940 4.414 4.137 4.604 . 0 0 "[ . 1 . 2]" 1
1520 1 12 MET QB 1 13 VAL H 3.440 . 3.440 2.369 2.246 2.833 . 0 0 "[ . 1 . 2]" 1
1521 1 130 LEU HB2 1 130 LEU MD2 3.430 . 3.430 2.780 2.620 3.016 . 0 0 "[ . 1 . 2]" 1
1522 1 74 PHE QD 1 78 ALA MB 4.040 . 4.040 3.459 3.216 3.845 . 0 0 "[ . 1 . 2]" 1
1523 1 25 LEU MD2 1 28 LYS QE 5.020 . 5.020 4.621 4.108 5.036 0.016 15 0 "[ . 1 . 2]" 1
1524 1 104 LEU QD 1 107 ASN HB3 5.490 . 5.490 4.504 4.315 4.622 . 0 0 "[ . 1 . 2]" 1
1525 1 128 ILE HB 1 128 ILE MD 2.950 . 2.950 2.280 2.248 2.364 . 0 0 "[ . 1 . 2]" 1
1526 1 157 ILE H 1 157 ILE MG 3.430 . 3.430 3.121 3.016 3.159 . 0 0 "[ . 1 . 2]" 1
1527 1 128 ILE MD 1 128 ILE MG 2.750 . 2.750 1.888 1.793 1.941 . 0 0 "[ . 1 . 2]" 1
1528 1 141 CYS HA 1 143 GLU H 4.740 . 4.740 4.236 4.144 4.326 . 0 0 "[ . 1 . 2]" 1
1529 1 55 ALA HA 1 58 LEU H 4.320 . 4.320 3.648 3.627 3.671 . 0 0 "[ . 1 . 2]" 1
1530 1 147 PHE QD 1 159 ILE HG13 4.660 . 4.660 4.599 4.528 4.674 0.014 7 0 "[ . 1 . 2]" 1
1531 1 121 GLN H 1 130 LEU HA 3.740 . 3.740 3.317 3.261 3.358 . 0 0 "[ . 1 . 2]" 1
1532 1 14 VAL H 1 16 GLN H 4.330 . 4.330 4.081 4.063 4.098 . 0 0 "[ . 1 . 2]" 1
1533 1 159 ILE HG12 1 176 ILE MG 2.850 . 2.850 2.625 2.521 2.715 . 0 0 "[ . 1 . 2]" 1
1534 1 98 ILE HA 1 98 ILE MD 4.310 . 4.310 3.814 3.793 3.843 . 0 0 "[ . 1 . 2]" 1
1535 1 70 GLY HA3 1 145 LEU MD2 4.500 . 4.500 3.541 3.232 3.866 . 0 0 "[ . 1 . 2]" 1
1536 1 8 VAL MG2 1 80 ARG H 5.500 . 5.500 5.439 5.155 5.557 0.057 4 0 "[ . 1 . 2]" 1
1537 1 5 ILE HA 1 73 LEU HG 3.870 . 3.870 3.912 3.890 3.937 0.067 19 0 "[ . 1 . 2]" 1
1538 1 62 ILE MG 1 64 ASP H 4.400 . 4.400 4.209 4.187 4.230 . 0 0 "[ . 1 . 2]" 1
1539 1 131 ARG HA 1 174 LEU H 4.690 . 4.690 3.136 2.943 3.321 . 0 0 "[ . 1 . 2]" 1
1540 1 169 ALA MB 1 170 ASP H 3.040 . 3.040 2.611 2.505 2.777 . 0 0 "[ . 1 . 2]" 1
1541 1 40 LYS QE 1 40 LYS HG3 3.310 . 3.310 2.261 2.223 2.406 . 0 0 "[ . 1 . 2]" 1
1542 1 51 VAL HA 1 51 VAL MG2 2.770 . 2.770 2.305 2.296 2.321 . 0 0 "[ . 1 . 2]" 1
1543 1 128 ILE H 1 175 ILE MG 4.830 . 4.830 3.449 3.291 3.620 . 0 0 "[ . 1 . 2]" 1
1544 1 74 PHE QD 1 77 LEU H 5.500 . 5.500 5.466 5.301 5.589 0.089 18 0 "[ . 1 . 2]" 1
1545 1 141 CYS H 1 143 GLU H 4.740 . 4.740 4.085 3.955 4.166 . 0 0 "[ . 1 . 2]" 1
1546 1 6 PHE QD 1 22 TRP HE1 5.500 . 5.500 5.175 4.805 5.493 . 0 0 "[ . 1 . 2]" 1
1547 1 126 ASN QB 1 178 LEU HB2 3.720 . 3.720 2.206 2.064 2.309 . 0 0 "[ . 1 . 2]" 1
1548 1 8 VAL HB 1 73 LEU HG 3.710 . 3.710 3.299 3.131 3.405 . 0 0 "[ . 1 . 2]" 1
1549 1 42 TYR H 1 43 ALA H 5.050 . 5.050 3.274 2.013 4.605 . 0 0 "[ . 1 . 2]" 1
1550 1 131 ARG HB3 1 131 ARG QD 3.220 . 3.220 2.320 2.248 2.387 . 0 0 "[ . 1 . 2]" 1
1551 1 90 ASP H 1 90 ASP QB . . 3.910 2.952 2.648 3.298 . 0 0 "[ . 1 . 2]" 1
1552 1 63 GLN HB2 1 67 LYS H 5.470 . 5.470 5.526 5.510 5.551 0.081 14 0 "[ . 1 . 2]" 1
1553 1 159 ILE HA 1 159 ILE HG12 3.980 . 3.980 2.389 2.367 2.419 . 0 0 "[ . 1 . 2]" 1
1554 1 120 GLY HA2 1 128 ILE MG 3.870 . 3.870 3.604 3.534 3.677 . 0 0 "[ . 1 . 2]" 1
1555 1 123 LEU H 1 123 LEU QB 3.920 . 3.920 2.902 2.636 2.955 . 0 0 "[ . 1 . 2]" 1
1556 1 82 THR HB 1 86 ASP QB 4.360 . 4.360 4.347 4.198 4.396 0.036 2 0 "[ . 1 . 2]" 1
1557 1 143 GLU HG2 1 147 PHE QE 4.770 . 4.770 3.790 3.713 3.868 . 0 0 "[ . 1 . 2]" 1
1558 1 168 GLY HA3 1 169 ALA MB 4.830 . 4.830 4.725 4.693 4.748 . 0 0 "[ . 1 . 2]" 1
1559 1 104 LEU QD 1 105 GLU HA 4.230 . 4.230 2.717 2.668 2.771 . 0 0 "[ . 1 . 2]" 1
1560 1 95 VAL MG2 1 128 ILE MG 3.450 . 3.450 3.465 3.393 3.531 0.081 16 0 "[ . 1 . 2]" 1
1561 1 161 HIS H 1 161 HIS HD1 5.500 . 5.500 4.011 3.138 4.505 . 0 0 "[ . 1 . 2]" 1
1562 1 52 GLN HA 1 52 GLN HG3 3.910 . 3.910 3.758 3.750 3.767 . 0 0 "[ . 1 . 2]" 1
1563 1 146 LEU MD1 1 157 ILE MD 4.420 . 4.420 4.022 3.898 4.121 . 0 0 "[ . 1 . 2]" 1
1564 1 117 HIS HA 1 133 SER H 5.290 . 5.290 5.162 4.914 5.339 0.049 14 0 "[ . 1 . 2]" 1
1565 1 46 GLU H 1 46 GLU QG 3.740 . 3.740 2.461 2.126 3.312 . 0 0 "[ . 1 . 2]" 1
1566 1 10 GLU HA 1 13 VAL MG1 3.660 . 3.660 3.627 3.589 3.662 0.002 16 0 "[ . 1 . 2]" 1
1567 1 22 TRP HA 1 22 TRP HD1 4.780 . 4.780 4.446 4.433 4.459 . 0 0 "[ . 1 . 2]" 1
1568 1 15 ALA H 1 18 GLY H 4.910 . 4.910 4.358 4.315 4.413 . 0 0 "[ . 1 . 2]" 1
1569 1 104 LEU H 1 106 VAL MG1 5.500 . 5.500 4.699 4.566 4.803 . 0 0 "[ . 1 . 2]" 1
1570 1 179 GLN QB 1 180 ASN H . . 3.760 2.936 2.709 3.074 . 0 0 "[ . 1 . 2]" 1
1571 1 123 LEU MD1 1 129 ALA MB 2.400 . 2.400 2.037 2.013 2.111 . 0 0 "[ . 1 . 2]" 1
1572 1 50 ILE H 1 50 ILE MG 3.980 . 3.980 3.723 3.715 3.731 . 0 0 "[ . 1 . 2]" 1
1573 1 67 LYS QE 1 67 LYS HG3 2.800 . 2.800 2.279 2.228 2.420 . 0 0 "[ . 1 . 2]" 1
1574 1 150 ALA MB 1 157 ILE QG . . 3.320 2.084 2.020 2.159 . 0 0 "[ . 1 . 2]" 1
1575 1 40 LYS QD 1 40 LYS HG3 2.750 . 2.750 2.485 2.393 2.493 . 0 0 "[ . 1 . 2]" 1
1576 1 55 ALA MB 1 60 MET H 3.760 . 3.760 3.415 3.394 3.452 . 0 0 "[ . 1 . 2]" 1
1577 1 8 VAL HB 1 73 LEU HA 4.390 . 4.390 3.040 2.891 3.193 . 0 0 "[ . 1 . 2]" 1
1578 1 108 LYS QB 1 109 LEU H 3.760 . 3.760 2.847 2.686 3.619 . 0 0 "[ . 1 . 2]" 1
1579 1 24 GLU HA 1 27 GLU QG 4.310 . 4.310 4.247 3.945 4.386 0.076 20 0 "[ . 1 . 2]" 1
1580 1 24 GLU HB3 1 25 LEU QB 3.760 . 3.760 3.812 3.784 3.829 0.069 10 0 "[ . 1 . 2]" 1
1581 1 14 VAL MG1 1 18 GLY HA3 4.280 . 4.280 4.179 4.089 4.257 . 0 0 "[ . 1 . 2]" 1
1582 1 66 VAL MG2 1 70 GLY H 4.390 . 4.390 4.350 4.280 4.395 0.005 12 0 "[ . 1 . 2]" 1
1583 1 47 LEU HA 1 50 ILE H 4.170 . 4.170 3.534 3.480 3.607 . 0 0 "[ . 1 . 2]" 1
1584 1 121 GLN H 1 130 LEU MD1 5.480 . 5.480 4.421 4.149 5.083 . 0 0 "[ . 1 . 2]" 1
1585 1 67 LYS H 1 67 LYS QD 5.020 . 5.020 4.605 4.552 4.679 . 0 0 "[ . 1 . 2]" 1
1586 1 60 MET HA 1 60 MET HG2 3.630 . 3.630 2.615 2.536 2.637 . 0 0 "[ . 1 . 2]" 1
1587 1 79 SER H 1 79 SER QB 3.140 . 3.140 2.270 2.233 2.365 . 0 0 "[ . 1 . 2]" 1
1588 1 147 PHE HA 1 147 PHE QD 3.770 . 3.770 2.349 2.318 2.443 . 0 0 "[ . 1 . 2]" 1
1589 1 9 LEU HB3 1 11 ASP H 5.180 . 5.180 4.687 4.639 4.743 . 0 0 "[ . 1 . 2]" 1
1590 1 77 LEU H 1 77 LEU MD2 4.110 . 4.110 3.769 3.622 3.990 . 0 0 "[ . 1 . 2]" 1
1591 1 101 VAL H 1 102 ILE MG 6.000 . 6.000 5.845 5.808 5.872 . 0 0 "[ . 1 . 2]" 1
1592 1 19 MET QB 1 19 MET HG3 2.670 . 2.670 2.409 2.250 2.478 . 0 0 "[ . 1 . 2]" 1
1593 1 91 PHE HA 1 153 PHE QE 4.540 . 4.540 3.616 3.320 4.194 . 0 0 "[ . 1 . 2]" 1
1594 1 127 GLN HA 1 127 GLN QE . . 4.710 4.414 4.069 4.761 0.051 6 0 "[ . 1 . 2]" 1
1595 1 121 GLN HB3 1 122 LEU H 5.000 . 5.000 4.153 4.011 4.301 . 0 0 "[ . 1 . 2]" 1
1596 1 143 GLU HG3 1 159 ILE MG 4.020 . 4.020 3.932 3.810 3.997 . 0 0 "[ . 1 . 2]" 1
1597 1 177 GLU H 1 177 GLU QB 3.620 . 3.620 2.310 2.286 2.369 . 0 0 "[ . 1 . 2]" 1
1598 1 50 ILE HA 1 50 ILE QG 3.850 . 3.850 2.376 2.361 2.386 . 0 0 "[ . 1 . 2]" 1
1599 1 82 THR HA 1 82 THR HB 2.950 . 2.950 2.999 2.983 3.003 0.053 11 0 "[ . 1 . 2]" 1
1600 1 146 LEU HA 1 146 LEU HG 2.940 . 2.940 2.807 2.736 2.881 . 0 0 "[ . 1 . 2]" 1
1601 1 64 ASP HB3 1 65 VAL H 3.970 . 3.970 2.711 2.669 2.756 . 0 0 "[ . 1 . 2]" 1
1602 1 22 TRP HH2 1 50 ILE MD 3.570 . 3.570 2.743 2.605 2.822 . 0 0 "[ . 1 . 2]" 1
1603 1 5 ILE MD 1 77 LEU MD1 4.310 . 4.310 3.020 2.619 3.339 . 0 0 "[ . 1 . 2]" 1
1604 1 159 ILE HA 1 159 ILE HG13 3.940 . 3.940 3.034 2.997 3.075 . 0 0 "[ . 1 . 2]" 1
1605 1 65 VAL HA 1 65 VAL MG1 3.050 . 3.050 2.373 2.357 2.389 . 0 0 "[ . 1 . 2]" 1
1606 1 81 HIS HB3 2 1 HEM HAC 5.500 . 5.500 4.213 3.576 5.333 . 0 0 "[ . 1 . 2]" 1
1607 1 54 VAL HA 1 54 VAL MG2 2.790 . 2.790 2.276 2.261 2.285 . 0 0 "[ . 1 . 2]" 1
1608 1 27 GLU HA 1 27 GLU QG 3.180 . 3.180 2.430 2.262 2.747 . 0 0 "[ . 1 . 2]" 1
1609 1 63 GLN H 1 63 GLN HG3 3.790 . 3.790 2.505 2.491 2.523 . 0 0 "[ . 1 . 2]" 1
1610 1 99 HIS HD1 1 100 ASP H 5.270 . 5.270 3.245 2.302 4.170 . 0 0 "[ . 1 . 2]" 1
1611 1 30 ALA HA 1 31 PRO HG3 4.490 . 4.490 4.456 4.357 4.507 0.017 11 0 "[ . 1 . 2]" 1
1612 1 159 ILE HA 1 176 ILE HA 3.100 . 3.100 2.615 2.564 2.662 . 0 0 "[ . 1 . 2]" 1
1613 1 74 PHE HA 1 75 ASN HA 4.870 . 4.870 4.840 4.830 4.857 . 0 0 "[ . 1 . 2]" 1
1614 1 22 TRP HD1 1 23 ASN HA 4.430 . 4.430 3.983 3.792 4.109 . 0 0 "[ . 1 . 2]" 1
1615 1 26 LEU H 1 26 LEU HB2 3.120 . 3.120 2.740 2.637 2.762 . 0 0 "[ . 1 . 2]" 1
1616 1 176 ILE HB 1 176 ILE MD 2.430 . 2.430 2.168 2.156 2.182 . 0 0 "[ . 1 . 2]" 1
1617 1 153 PHE QB 1 154 GLN H 4.710 . 4.710 3.839 3.786 3.879 . 0 0 "[ . 1 . 2]" 1
1618 1 72 PHE QB 1 73 LEU H 3.810 . 3.810 2.650 2.515 2.756 . 0 0 "[ . 1 . 2]" 1
1619 1 8 VAL HA 1 8 VAL MG1 3.340 . 3.340 2.215 2.179 2.235 . 0 0 "[ . 1 . 2]" 1
1620 1 21 VAL MG2 1 22 TRP H 4.180 . 4.180 3.908 3.809 4.035 . 0 0 "[ . 1 . 2]" 1
1621 1 50 ILE HA 1 50 ILE MD 3.980 . 3.980 3.826 3.809 3.833 . 0 0 "[ . 1 . 2]" 1
1622 1 176 ILE MG 1 177 GLU QB 5.100 . 5.100 4.482 4.376 4.614 . 0 0 "[ . 1 . 2]" 1
1623 1 63 GLN HG2 1 64 ASP H 3.760 . 3.760 3.301 3.282 3.314 . 0 0 "[ . 1 . 2]" 1
1624 1 91 PHE HA 1 95 VAL MG2 4.090 . 4.090 3.903 3.825 3.978 . 0 0 "[ . 1 . 2]" 1
1625 1 54 VAL HA 1 57 ARG QG 3.380 . 3.380 2.299 2.292 2.337 . 0 0 "[ . 1 . 2]" 1
1626 1 62 ILE H 1 62 ILE MG 3.010 . 3.010 2.342 2.306 2.377 . 0 0 "[ . 1 . 2]" 1
1627 1 65 VAL HB 1 66 VAL H 3.410 . 3.410 2.543 2.506 2.582 . 0 0 "[ . 1 . 2]" 1
1628 1 26 LEU HA 1 29 HIS H 4.040 . 4.040 3.654 3.519 3.744 . 0 0 "[ . 1 . 2]" 1
1629 1 104 LEU QD 1 107 ASN H 5.230 . 5.230 4.916 4.793 5.072 . 0 0 "[ . 1 . 2]" 1
1630 1 56 GLN HA 1 58 LEU H 5.500 . 5.500 4.629 4.597 4.698 . 0 0 "[ . 1 . 2]" 1
1631 1 43 ALA HA 1 44 GLU H 3.410 . 3.410 3.125 2.260 3.426 0.016 11 0 "[ . 1 . 2]" 1
1632 1 19 MET HA 1 21 VAL H 4.630 . 4.630 4.084 4.055 4.114 . 0 0 "[ . 1 . 2]" 1
1633 1 95 VAL MG2 1 96 MET H 4.250 . 4.250 3.868 3.796 3.948 . 0 0 "[ . 1 . 2]" 1
1634 1 54 VAL HA 1 57 ARG HD3 2.770 . 2.770 2.280 2.273 2.320 . 0 0 "[ . 1 . 2]" 1
1635 1 22 TRP HB2 1 23 ASN H 5.000 . 5.000 3.814 3.715 3.923 . 0 0 "[ . 1 . 2]" 1
1636 1 102 ILE HB 1 102 ILE MD 3.410 . 3.410 2.159 2.155 2.171 . 0 0 "[ . 1 . 2]" 1
1637 1 22 TRP HB3 1 24 GLU H 5.000 . 5.000 4.783 4.654 4.895 . 0 0 "[ . 1 . 2]" 1
1638 1 28 LYS HB2 1 29 HIS H 4.220 . 4.220 3.794 3.716 3.946 . 0 0 "[ . 1 . 2]" 1
1639 1 150 ALA MB 1 155 GLN QG 3.930 . 3.930 3.306 2.839 3.702 . 0 0 "[ . 1 . 2]" 1
1640 1 163 THR MG 1 172 CYS HA 3.670 . 3.670 2.696 2.493 2.870 . 0 0 "[ . 1 . 2]" 1
1641 1 85 VAL HA 1 94 LEU HG 5.200 . 5.200 5.210 4.629 5.310 0.110 2 0 "[ . 1 . 2]" 1
1642 1 19 MET QB 1 21 VAL H 5.500 . 5.500 4.957 4.817 5.055 . 0 0 "[ . 1 . 2]" 1
1643 1 36 TYR H 1 36 TYR QD 4.660 . 4.660 2.450 2.011 2.779 . 0 0 "[ . 1 . 2]" 1
1644 1 53 ASP HB3 1 54 VAL H 3.750 . 3.750 2.221 2.184 2.251 . 0 0 "[ . 1 . 2]" 1
1645 1 26 LEU HA 1 30 ALA H 4.510 . 4.510 4.263 3.690 4.498 . 0 0 "[ . 1 . 2]" 1
1646 1 25 LEU MD2 1 29 HIS H 4.230 . 4.230 3.476 3.397 3.542 . 0 0 "[ . 1 . 2]" 1
1647 1 21 VAL MG2 1 25 LEU H 4.350 . 4.350 3.954 3.857 4.050 . 0 0 "[ . 1 . 2]" 1
1648 1 39 ALA MB 1 40 LYS HG2 3.480 . 3.480 2.730 2.632 2.821 . 0 0 "[ . 1 . 2]" 1
1649 1 106 VAL H 1 115 LEU MD1 5.500 . 5.500 4.689 4.109 5.036 . 0 0 "[ . 1 . 2]" 1
1650 1 144 GLY HA2 1 147 PHE H 4.180 . 4.180 3.459 3.409 3.504 . 0 0 "[ . 1 . 2]" 1
1651 1 156 LYS H 1 157 ILE H 5.000 . 5.000 4.600 4.573 4.616 . 0 0 "[ . 1 . 2]" 1
1652 1 40 LYS H 1 40 LYS HB2 3.560 . 3.560 2.671 2.642 2.714 . 0 0 "[ . 1 . 2]" 1
1653 1 155 GLN QB 1 155 GLN HE21 . . 4.070 3.689 3.636 3.725 . 0 0 "[ . 1 . 2]" 1
1654 1 25 LEU H 1 25 LEU HG 4.020 . 4.020 3.934 3.925 3.939 . 0 0 "[ . 1 . 2]" 1
1655 1 26 LEU HA 1 28 LYS H 4.330 . 4.330 4.313 4.126 4.369 0.039 9 0 "[ . 1 . 2]" 1
1656 1 4 ILE MG 1 38 SER HA 4.240 . 4.240 3.365 3.169 3.550 . 0 0 "[ . 1 . 2]" 1
1657 1 12 MET H 1 14 VAL H 4.570 . 4.570 4.043 3.977 4.098 . 0 0 "[ . 1 . 2]" 1
1658 1 106 VAL MG2 1 115 LEU MD1 3.700 . 3.700 2.175 1.995 2.344 . 0 0 "[ . 1 . 2]" 1
1659 1 14 VAL HB 1 15 ALA H 3.020 . 3.020 2.993 2.956 3.019 . 0 0 "[ . 1 . 2]" 1
1660 1 95 VAL HA 1 98 ILE QG 4.170 . 4.170 2.297 2.236 2.500 . 0 0 "[ . 1 . 2]" 1
1661 1 60 MET H 1 60 MET HB3 4.110 . 4.110 3.926 3.902 3.933 . 0 0 "[ . 1 . 2]" 1
1662 1 89 ASP H 1 89 ASP QB 3.880 . 3.880 2.940 2.221 3.274 . 0 0 "[ . 1 . 2]" 1
1663 1 71 GLN HA 1 73 LEU H 5.000 . 5.000 4.706 4.665 4.803 . 0 0 "[ . 1 . 2]" 1
1664 1 108 LYS H 1 108 LYS QE 4.890 . 4.890 4.494 3.692 4.913 0.023 16 0 "[ . 1 . 2]" 1
1665 1 74 PHE HA 1 74 PHE QD 4.340 . 4.340 2.933 2.854 2.986 . 0 0 "[ . 1 . 2]" 1
1666 1 55 ALA H 1 55 ALA MB 2.870 . 2.870 2.208 2.203 2.212 . 0 0 "[ . 1 . 2]" 1
1667 1 102 ILE MG 1 104 LEU H 4.750 . 4.750 4.588 4.487 4.660 . 0 0 "[ . 1 . 2]" 1
1668 1 8 VAL MG2 1 77 LEU H 4.020 . 4.020 3.275 3.104 3.385 . 0 0 "[ . 1 . 2]" 1
1669 1 31 PRO HB2 1 32 LYS H 3.720 . 3.720 2.403 1.806 3.109 . 0 0 "[ . 1 . 2]" 1
1670 1 23 ASN HA 1 26 LEU H 3.880 . 3.880 3.731 3.707 3.788 . 0 0 "[ . 1 . 2]" 1
1671 1 37 VAL MG2 1 40 LYS QD 5.000 . 5.000 4.095 3.905 4.233 . 0 0 "[ . 1 . 2]" 1
1672 1 22 TRP H 1 22 TRP HB2 3.240 . 3.240 2.503 2.492 2.533 . 0 0 "[ . 1 . 2]" 1
1673 1 4 ILE QG 1 38 SER HB3 4.950 . 4.950 4.843 4.434 4.963 0.013 5 0 "[ . 1 . 2]" 1
1674 1 98 ILE MD 2 1 HEM HAB 4.200 . 4.200 3.683 2.647 4.194 . 0 0 "[ . 1 . 2]" 1
1675 1 64 ASP H 1 64 ASP HB3 3.490 . 3.490 2.469 2.460 2.489 . 0 0 "[ . 1 . 2]" 1
1676 1 82 THR MG 1 86 ASP QB 4.300 . 4.300 2.681 2.443 3.106 . 0 0 "[ . 1 . 2]" 1
1677 1 43 ALA MB 1 44 GLU H 3.870 . 3.870 3.325 2.967 3.715 . 0 0 "[ . 1 . 2]" 1
1678 1 8 VAL MG1 1 77 LEU H 3.780 . 3.780 2.885 2.775 2.970 . 0 0 "[ . 1 . 2]" 1
1679 1 102 ILE H 1 103 HIS H 4.160 . 4.160 3.005 2.953 3.069 . 0 0 "[ . 1 . 2]" 1
1680 1 130 LEU H 1 174 LEU QB 4.310 . 4.310 3.810 3.681 3.865 . 0 0 "[ . 1 . 2]" 1
1681 1 84 VAL HB 1 85 VAL QG 3.350 . 3.350 3.106 2.979 3.187 . 0 0 "[ . 1 . 2]" 1
1682 1 175 ILE H 1 175 ILE MD 3.590 . 3.590 3.030 2.960 3.165 . 0 0 "[ . 1 . 2]" 1
1683 1 24 GLU HB2 1 25 LEU H 3.440 . 3.440 2.626 2.552 2.719 . 0 0 "[ . 1 . 2]" 1
1684 1 176 ILE HA 1 176 ILE QG 3.030 . 3.030 2.447 2.433 2.470 . 0 0 "[ . 1 . 2]" 1
1685 1 62 ILE HG12 1 63 GLN H 4.200 . 4.200 4.011 3.973 4.053 . 0 0 "[ . 1 . 2]" 1
1686 1 89 ASP HA 1 90 ASP H 3.410 . 3.410 3.449 3.426 3.520 0.110 14 0 "[ . 1 . 2]" 1
1687 1 15 ALA MB 1 16 GLN HG3 4.300 . 4.300 3.308 3.271 3.369 . 0 0 "[ . 1 . 2]" 1
1688 1 173 MET H 1 173 MET HG3 4.670 . 4.670 4.644 4.631 4.668 . 0 0 "[ . 1 . 2]" 1
1689 1 67 LYS QE 1 143 GLU H 4.910 . 4.910 4.930 4.916 4.954 0.044 14 0 "[ . 1 . 2]" 1
1690 1 143 GLU HA 1 174 LEU MD2 3.490 . 3.490 3.167 3.046 3.264 . 0 0 "[ . 1 . 2]" 1
1691 1 131 ARG H 1 131 ARG HG3 5.050 . 5.050 4.508 4.478 4.550 . 0 0 "[ . 1 . 2]" 1
1692 1 72 PHE HA 1 75 ASN HB2 4.000 . 4.000 2.569 2.526 2.641 . 0 0 "[ . 1 . 2]" 1
1693 1 165 MET HB2 1 169 ALA MB 4.250 . 4.250 4.232 3.978 4.365 0.115 9 0 "[ . 1 . 2]" 1
1694 1 108 LYS H 1 108 LYS QB 2.940 . 2.940 2.426 2.342 2.635 . 0 0 "[ . 1 . 2]" 1
1695 1 150 ALA MB 1 151 GLN H 3.360 . 3.360 2.310 2.220 2.526 . 0 0 "[ . 1 . 2]" 1
1696 1 159 ILE H 1 159 ILE HG12 4.560 . 4.560 3.951 3.897 4.032 . 0 0 "[ . 1 . 2]" 1
1697 1 146 LEU H 1 147 PHE QB 5.050 . 5.050 4.713 4.662 4.778 . 0 0 "[ . 1 . 2]" 1
1698 1 40 LYS HB2 1 41 SER H 4.560 . 4.560 2.702 1.914 2.975 . 0 0 "[ . 1 . 2]" 1
1699 1 37 VAL MG1 1 40 LYS H 3.660 . 3.660 2.246 2.179 2.392 . 0 0 "[ . 1 . 2]" 1
1700 1 60 MET H 1 60 MET HB2 3.600 . 3.600 2.982 2.902 3.004 . 0 0 "[ . 1 . 2]" 1
1701 1 32 LYS H 1 32 LYS QG 4.050 . 4.050 3.958 3.935 4.051 0.001 14 0 "[ . 1 . 2]" 1
1702 1 4 ILE HB 1 38 SER HB3 3.710 . 3.710 2.796 2.361 2.910 . 0 0 "[ . 1 . 2]" 1
1703 1 32 LYS HA 1 32 LYS QG 2.990 . 2.990 2.335 2.237 2.546 . 0 0 "[ . 1 . 2]" 1
1704 1 14 VAL HA 1 14 VAL MG1 3.040 . 3.040 2.465 2.446 2.481 . 0 0 "[ . 1 . 2]" 1
1705 1 14 VAL MG1 1 16 GLN H 4.740 . 4.740 4.767 4.733 4.783 0.043 13 0 "[ . 1 . 2]" 1
1706 1 176 ILE MG 1 177 GLU H 3.480 . 3.480 3.149 2.940 3.277 . 0 0 "[ . 1 . 2]" 1
1707 1 80 ARG H 1 80 ARG QB 3.700 . 3.700 2.478 2.347 2.582 . 0 0 "[ . 1 . 2]" 1
1708 1 82 THR HA 1 85 VAL QG 4.090 . 4.090 3.135 1.991 3.344 . 0 0 "[ . 1 . 2]" 1
1709 1 151 GLN QB 1 152 HIS HA 4.040 . 4.040 3.812 3.781 3.831 . 0 0 "[ . 1 . 2]" 1
1710 1 146 LEU MD1 1 174 LEU MD2 3.000 . 3.000 2.688 2.523 2.918 . 0 0 "[ . 1 . 2]" 1
1711 1 21 VAL MG2 1 24 GLU HB3 4.370 . 4.370 4.364 4.267 4.406 0.036 20 0 "[ . 1 . 2]" 1
1712 1 165 MET H 1 165 MET HA 2.940 . 2.940 2.780 2.763 2.810 . 0 0 "[ . 1 . 2]" 1
1713 1 157 ILE MD 1 158 GLN HA 4.450 . 4.450 4.518 4.497 4.542 0.092 18 0 "[ . 1 . 2]" 1
1714 1 94 LEU QD 1 95 VAL H 3.980 . 3.980 2.566 2.254 2.855 . 0 0 "[ . 1 . 2]" 1
1715 1 92 THR MG 1 96 MET H 4.770 . 4.770 4.612 4.340 4.733 . 0 0 "[ . 1 . 2]" 1
1716 1 54 VAL MG2 1 58 LEU HG 3.140 . 3.140 2.416 2.389 2.446 . 0 0 "[ . 1 . 2]" 1
1717 1 123 LEU HA 1 124 PRO QG 4.080 . 4.080 4.111 4.052 4.148 0.068 9 0 "[ . 1 . 2]" 1
1718 1 128 ILE H 1 176 ILE HB 3.650 . 3.650 3.507 3.383 3.608 . 0 0 "[ . 1 . 2]" 1
1719 1 61 PRO HG3 1 64 ASP H 4.160 . 4.160 4.269 4.259 4.279 0.119 9 0 "[ . 1 . 2]" 1
1720 1 9 LEU HA 1 9 LEU HG 3.640 . 3.640 3.400 3.382 3.424 . 0 0 "[ . 1 . 2]" 1
1721 1 131 ARG HA 1 131 ARG QD 4.130 . 4.130 4.041 3.907 4.146 0.016 15 0 "[ . 1 . 2]" 1
1722 1 8 VAL HB 1 9 LEU H 3.650 . 3.650 2.875 2.741 2.954 . 0 0 "[ . 1 . 2]" 1
1723 1 156 LYS HA 1 156 LYS QD 4.090 . 4.090 4.013 3.448 4.330 0.240 7 0 "[ . 1 . 2]" 1
1724 1 119 ASN H 1 119 ASN QD 5.220 . 5.220 4.439 4.213 4.707 . 0 0 "[ . 1 . 2]" 1
1725 1 92 THR MG 1 128 ILE MD 2.780 . 2.780 2.433 2.223 2.662 . 0 0 "[ . 1 . 2]" 1
1726 1 164 CYS HA 1 172 CYS HB3 4.430 . 4.430 2.946 2.516 4.489 0.059 9 0 "[ . 1 . 2]" 1
1727 1 67 LYS QB 1 68 ALA H 3.420 . 3.420 2.139 2.061 2.175 . 0 0 "[ . 1 . 2]" 1
1728 1 21 VAL HA 1 23 ASN H 5.340 . 5.340 4.462 4.251 4.659 . 0 0 "[ . 1 . 2]" 1
1729 1 161 HIS HA 1 162 ASP H 3.160 . 3.160 2.292 2.205 2.390 . 0 0 "[ . 1 . 2]" 1
1730 1 165 MET HA 1 169 ALA MB 2.730 . 2.730 2.335 2.112 2.609 . 0 0 "[ . 1 . 2]" 1
1731 1 21 VAL MG2 1 57 ARG HD2 4.110 . 4.110 3.461 3.362 4.038 . 0 0 "[ . 1 . 2]" 1
1732 1 79 SER H 1 85 VAL QG 5.060 . 5.060 4.938 4.612 5.017 . 0 0 "[ . 1 . 2]" 1
1733 1 130 LEU HB3 1 174 LEU QB 4.150 . 4.150 2.714 2.576 2.912 . 0 0 "[ . 1 . 2]" 1
1734 1 167 THR H 1 167 THR HB 2.850 . 2.850 2.790 2.774 2.812 . 0 0 "[ . 1 . 2]" 1
1735 1 10 GLU QG 1 13 VAL MG1 6.000 2.330 6.000 4.985 4.911 5.741 . 0 0 "[ . 1 . 2]" 1
1736 1 173 MET HG3 1 175 ILE MD 3.190 . 3.190 2.479 2.393 2.680 . 0 0 "[ . 1 . 2]" 1
1737 1 147 PHE HA 1 157 ILE MD 3.540 . 3.540 2.979 2.789 3.071 . 0 0 "[ . 1 . 2]" 1
1738 1 159 ILE MD 1 175 ILE H 5.500 . 5.500 5.605 5.581 5.627 0.127 12 0 "[ . 1 . 2]" 1
1739 1 94 LEU QD 1 98 ILE HA 4.280 . 4.280 3.438 2.686 3.937 . 0 0 "[ . 1 . 2]" 1
1740 1 52 GLN QB 1 55 ALA MB 4.050 . 4.050 4.068 4.047 4.085 0.035 5 0 "[ . 1 . 2]" 1
1741 1 50 ILE HB 1 51 VAL MG2 3.600 . 3.600 3.341 3.277 3.409 . 0 0 "[ . 1 . 2]" 1
1742 1 80 ARG H 1 81 HIS H 3.450 . 3.450 2.224 2.156 2.365 . 0 0 "[ . 1 . 2]" 1
1743 1 122 LEU H 1 123 LEU MD2 4.500 . 4.500 4.085 3.905 4.430 . 0 0 "[ . 1 . 2]" 1
1744 1 155 GLN QG 1 157 ILE MG 3.320 . 3.320 2.179 2.133 2.190 . 0 0 "[ . 1 . 2]" 1
1745 1 37 VAL H 1 37 VAL MG1 4.140 . 4.140 3.855 3.813 3.954 . 0 0 "[ . 1 . 2]" 1
1746 1 155 GLN HE22 1 179 GLN QB . . 4.800 3.359 3.149 3.641 . 0 0 "[ . 1 . 2]" 1
1747 1 133 SER HB2 1 171 HIS QB 4.160 . 4.160 3.455 2.331 4.132 . 0 0 "[ . 1 . 2]" 1
1748 1 54 VAL MG1 1 58 LEU HG 5.000 . 5.000 4.094 4.057 4.124 . 0 0 "[ . 1 . 2]" 1
1749 1 13 VAL HA 1 13 VAL MG1 2.550 . 2.550 2.273 2.261 2.374 . 0 0 "[ . 1 . 2]" 1
1750 1 78 ALA HA 1 85 VAL QG 3.830 . 3.830 2.215 2.136 2.250 . 0 0 "[ . 1 . 2]" 1
1751 1 32 LYS H 1 32 LYS HB2 3.300 . 3.300 2.488 2.364 2.605 . 0 0 "[ . 1 . 2]" 1
1752 1 25 LEU HA 1 28 LYS HB3 3.180 . 3.180 2.499 2.343 2.629 . 0 0 "[ . 1 . 2]" 1
1753 1 73 LEU HA 1 73 LEU MD1 4.170 . 4.170 2.281 2.270 2.289 . 0 0 "[ . 1 . 2]" 1
1754 1 163 THR MG 1 169 ALA MB 2.460 . 2.460 2.288 2.215 2.347 . 0 0 "[ . 1 . 2]" 1
1755 1 63 GLN H 1 65 VAL HB 5.500 . 5.500 5.199 5.158 5.228 . 0 0 "[ . 1 . 2]" 1
1756 1 8 VAL H 1 9 LEU H 3.810 . 3.810 2.523 2.455 2.558 . 0 0 "[ . 1 . 2]" 1
1757 1 29 HIS HD1 1 50 ILE HA 5.500 . 5.500 4.781 4.519 5.319 . 0 0 "[ . 1 . 2]" 1
1758 1 85 VAL H 1 85 VAL HB 3.300 . 3.300 2.508 2.312 3.401 0.101 8 0 "[ . 1 . 2]" 1
1759 1 51 VAL HA 1 54 VAL HB 3.890 . 3.890 3.910 3.896 3.922 0.032 18 0 "[ . 1 . 2]" 1
1760 1 4 ILE H 1 38 SER HA 3.820 . 3.820 2.734 2.594 3.155 . 0 0 "[ . 1 . 2]" 1
1761 1 119 ASN H 1 131 ARG HB3 4.420 . 4.420 2.938 2.653 3.140 . 0 0 "[ . 1 . 2]" 1
1762 1 84 VAL QG 1 104 LEU H 5.080 . 5.080 4.895 4.759 5.016 . 0 0 "[ . 1 . 2]" 1
1763 1 62 ILE HG13 1 65 VAL MG1 5.500 . 5.500 4.477 4.418 4.522 . 0 0 "[ . 1 . 2]" 1
1764 1 102 ILE H 1 102 ILE MD 3.920 . 3.920 2.410 2.304 2.463 . 0 0 "[ . 1 . 2]" 1
1765 1 56 GLN HA 1 56 GLN QG 3.810 . 3.810 2.495 2.309 2.696 . 0 0 "[ . 1 . 2]" 1
1766 1 59 ASN HA 1 60 MET HG2 4.680 . 4.680 4.644 4.609 4.685 0.005 14 0 "[ . 1 . 2]" 1
1767 1 52 GLN HG2 1 53 ASP H 4.350 . 4.350 2.395 2.334 2.451 . 0 0 "[ . 1 . 2]" 1
1768 1 51 VAL MG1 1 66 VAL H 4.110 . 4.110 3.201 3.153 3.245 . 0 0 "[ . 1 . 2]" 1
1769 1 95 VAL MG1 1 128 ILE MG 2.400 . 2.400 1.889 1.847 1.974 . 0 0 "[ . 1 . 2]" 1
1770 1 156 LYS H 1 156 LYS QD 4.860 . 4.860 3.679 1.763 4.354 . 0 0 "[ . 1 . 2]" 1
1771 1 101 VAL HA 1 101 VAL MG2 3.200 . 3.200 3.192 3.190 3.196 . 0 0 "[ . 1 . 2]" 1
1772 1 145 LEU MD2 1 146 LEU H 4.860 . 4.860 4.728 4.696 4.755 . 0 0 "[ . 1 . 2]" 1
1773 1 55 ALA HA 1 60 MET HG3 4.660 . 4.660 3.509 3.474 3.668 . 0 0 "[ . 1 . 2]" 1
1774 1 91 PHE HA 1 91 PHE QE 4.510 . 4.510 4.494 4.433 4.548 0.038 16 0 "[ . 1 . 2]" 1
1775 1 151 GLN QB 1 152 HIS H . . 4.060 2.384 2.331 2.450 . 0 0 "[ . 1 . 2]" 1
1776 1 62 ILE H 1 62 ILE MD 4.610 . 4.610 4.242 4.238 4.247 . 0 0 "[ . 1 . 2]" 1
1777 1 103 HIS HA 1 106 VAL H 4.690 . 4.690 3.597 3.329 3.812 . 0 0 "[ . 1 . 2]" 1
1778 1 10 GLU H 1 13 VAL MG2 5.400 . 5.400 4.112 4.067 4.146 . 0 0 "[ . 1 . 2]" 1
1779 1 67 LYS HA 1 144 GLY H 4.350 . 4.350 3.477 3.309 3.692 . 0 0 "[ . 1 . 2]" 1
1780 1 11 ASP H 1 12 MET HG2 5.000 . 5.000 5.054 3.963 5.167 0.167 2 0 "[ . 1 . 2]" 1
1781 1 11 ASP HA 1 14 VAL H 3.880 . 3.880 3.856 3.837 3.890 0.010 20 0 "[ . 1 . 2]" 1
1782 1 5 ILE MD 1 6 PHE H 4.960 . 4.960 4.667 4.596 4.703 . 0 0 "[ . 1 . 2]" 1
1783 1 19 MET QB 1 23 ASN H 4.710 . 4.710 4.521 4.311 4.736 0.026 7 0 "[ . 1 . 2]" 1
1784 1 101 VAL H 1 101 VAL MG1 2.960 . 2.960 1.869 1.833 1.913 . 0 0 "[ . 1 . 2]" 1
1785 1 3 GLY H 1 3 GLY HA2 2.850 . 2.850 2.325 2.301 2.337 . 0 0 "[ . 1 . 2]" 1
1786 1 140 PHE H 1 141 CYS H 4.530 . 4.530 2.780 2.637 2.852 . 0 0 "[ . 1 . 2]" 1
1787 1 26 LEU HA 1 26 LEU HG 4.000 . 4.000 3.219 3.080 3.263 . 0 0 "[ . 1 . 2]" 1
1788 1 94 LEU QD 1 95 VAL HA 3.080 . 3.080 2.499 2.294 2.804 . 0 0 "[ . 1 . 2]" 1
1789 1 119 ASN H 1 120 GLY H 4.630 . 4.630 4.077 3.948 4.207 . 0 0 "[ . 1 . 2]" 1
1790 1 105 GLU H 1 105 GLU QG 4.110 . 4.110 4.058 4.001 4.079 . 0 0 "[ . 1 . 2]" 1
1791 1 68 ALA H 1 69 PHE QB 4.570 . 4.570 4.561 4.508 4.582 0.012 14 0 "[ . 1 . 2]" 1
1792 1 139 CYS H 1 140 PHE H 3.860 . 3.860 2.779 2.529 2.921 . 0 0 "[ . 1 . 2]" 1
1793 1 66 VAL MG2 1 140 PHE HB2 3.610 . 3.610 3.381 3.031 3.625 0.015 7 0 "[ . 1 . 2]" 1
1794 1 90 ASP H 1 92 THR H 5.410 . 5.410 5.049 4.892 5.314 . 0 0 "[ . 1 . 2]" 1
1795 1 159 ILE HG13 1 176 ILE MG 4.070 . 4.070 3.118 3.075 3.166 . 0 0 "[ . 1 . 2]" 1
1796 1 95 VAL HA 1 98 ILE H 4.140 . 4.140 3.831 3.769 3.953 . 0 0 "[ . 1 . 2]" 1
1797 1 166 HIS HD1 1 167 THR H 5.360 . 5.360 4.451 2.861 5.383 0.023 19 0 "[ . 1 . 2]" 1
1798 1 9 LEU H 1 11 ASP H 4.280 . 4.280 3.895 3.848 3.957 . 0 0 "[ . 1 . 2]" 1
1799 1 4 ILE H 1 5 ILE QG 4.330 . 4.330 3.684 3.533 3.779 . 0 0 "[ . 1 . 2]" 1
1800 1 9 LEU MD2 1 10 GLU H 4.770 . 4.770 4.250 4.194 4.337 . 0 0 "[ . 1 . 2]" 1
1801 1 70 GLY H 1 71 GLN H 3.890 . 3.890 2.731 2.650 2.895 . 0 0 "[ . 1 . 2]" 1
1802 1 5 ILE MG 1 8 VAL HB 4.570 . 4.570 4.311 4.203 4.494 . 0 0 "[ . 1 . 2]" 1
1803 1 21 VAL HB 1 58 LEU MD2 5.000 . 5.000 5.039 5.016 5.104 0.104 18 0 "[ . 1 . 2]" 1
1804 1 91 PHE HZ 1 159 ILE MD 5.170 . 5.170 4.223 4.122 4.416 . 0 0 "[ . 1 . 2]" 1
1805 1 60 MET HA 1 61 PRO HG2 4.620 . 4.620 4.621 4.608 4.628 0.008 10 0 "[ . 1 . 2]" 1
1806 1 54 VAL MG2 1 55 ALA HA 4.510 . 4.510 4.200 4.163 4.264 . 0 0 "[ . 1 . 2]" 1
1807 1 54 VAL MG2 1 58 LEU QB 3.860 . 3.860 3.583 3.553 3.630 . 0 0 "[ . 1 . 2]" 1
1808 1 90 ASP HA 1 153 PHE QD 5.310 . 5.310 4.516 3.741 4.844 . 0 0 "[ . 1 . 2]" 1
1809 1 17 CYS H 1 17 CYS HB3 3.720 . 3.720 3.594 3.582 3.628 . 0 0 "[ . 1 . 2]" 1
1810 1 70 GLY HA3 1 145 LEU H 4.220 . 4.220 3.013 2.795 3.303 . 0 0 "[ . 1 . 2]" 1
1811 1 150 ALA MB 1 155 GLN HA 4.880 . 4.880 4.904 4.785 4.962 0.082 2 0 "[ . 1 . 2]" 1
1812 1 6 PHE H 1 6 PHE QD 3.690 . 3.690 1.916 1.793 2.234 . 0 0 "[ . 1 . 2]" 1
1813 1 13 VAL H 1 13 VAL HB 3.710 . 3.710 3.582 3.579 3.587 . 0 0 "[ . 1 . 2]" 1
1814 1 5 ILE MG 1 9 LEU H 4.450 . 4.450 4.413 4.318 4.471 0.021 17 0 "[ . 1 . 2]" 1
1815 1 96 MET QB 1 97 GLY H 4.120 . 4.120 3.471 2.998 3.748 . 0 0 "[ . 1 . 2]" 1
1816 1 6 PHE QE 1 36 TYR HA 5.000 . 5.000 4.941 4.634 5.044 0.044 19 0 "[ . 1 . 2]" 1
1817 1 56 GLN QB 1 57 ARG H 3.690 . 3.690 2.408 2.395 2.429 . 0 0 "[ . 1 . 2]" 1
1818 1 157 ILE HA 1 178 LEU MD2 4.950 . 4.950 4.056 3.973 4.118 . 0 0 "[ . 1 . 2]" 1
1819 1 119 ASN H 1 130 LEU MD1 4.780 . 4.780 4.195 3.830 4.841 0.061 7 0 "[ . 1 . 2]" 1
1820 1 143 GLU HG2 1 159 ILE MG 3.780 . 3.780 2.524 2.390 2.617 . 0 0 "[ . 1 . 2]" 1
1821 1 123 LEU QB 1 127 GLN HB2 2.790 . 2.790 2.288 2.268 2.331 . 0 0 "[ . 1 . 2]" 1
1822 1 108 LYS HA 1 108 LYS HG3 3.630 . 3.630 3.137 2.997 3.572 . 0 0 "[ . 1 . 2]" 1
1823 1 151 GLN HA 1 151 GLN HG2 3.990 . 3.990 2.580 2.391 3.635 . 0 0 "[ . 1 . 2]" 1
1824 1 39 ALA H 1 40 LYS HG2 4.210 . 4.210 3.894 3.730 4.008 . 0 0 "[ . 1 . 2]" 1
1825 1 4 ILE QG 1 8 VAL MG2 3.440 . 3.440 2.948 2.705 3.310 . 0 0 "[ . 1 . 2]" 1
1826 1 94 LEU QD 1 95 VAL MG2 3.040 . 3.040 2.820 2.445 3.157 0.117 12 0 "[ . 1 . 2]" 1
1827 1 174 LEU HA 1 174 LEU HG 3.480 . 3.480 2.302 2.283 2.319 . 0 0 "[ . 1 . 2]" 1
1828 1 17 CYS HB2 1 21 VAL H 5.000 . 5.000 5.003 4.847 5.033 0.033 11 0 "[ . 1 . 2]" 1
1829 1 175 ILE MG 1 177 GLU QB 4.480 . 4.480 3.781 3.676 4.469 . 0 0 "[ . 1 . 2]" 1
1830 1 157 ILE MG 1 179 GLN H 3.450 . 3.450 3.017 2.920 3.095 . 0 0 "[ . 1 . 2]" 1
1831 1 139 CYS QB 1 140 PHE H 4.690 . 4.690 3.017 2.529 3.536 . 0 0 "[ . 1 . 2]" 1
1832 1 5 ILE H 1 6 PHE H 3.970 . 3.970 2.696 2.616 2.756 . 0 0 "[ . 1 . 2]" 1
1833 1 38 SER HB2 1 39 ALA H 4.070 . 4.070 3.990 3.893 4.078 0.008 17 0 "[ . 1 . 2]" 1
1834 1 13 VAL HB 1 14 VAL H 3.920 . 3.920 3.580 3.560 3.599 . 0 0 "[ . 1 . 2]" 1
1835 1 4 ILE MG 1 7 ASN QB 4.830 . 4.830 4.637 4.529 4.760 . 0 0 "[ . 1 . 2]" 1
1836 1 175 ILE HB 1 175 ILE MD 3.270 . 3.270 3.202 3.199 3.204 . 0 0 "[ . 1 . 2]" 1
1837 1 77 LEU HA 1 77 LEU HG 4.230 . 4.230 2.664 2.476 2.751 . 0 0 "[ . 1 . 2]" 1
1838 1 25 LEU H 1 26 LEU HB3 4.960 . 4.960 4.721 4.696 4.774 . 0 0 "[ . 1 . 2]" 1
1839 1 68 ALA HA 1 72 PHE H 4.590 . 4.590 4.392 4.254 4.538 . 0 0 "[ . 1 . 2]" 1
1840 1 155 GLN HE21 1 179 GLN QB 4.760 . 4.760 3.626 3.179 3.865 . 0 0 "[ . 1 . 2]" 1
1841 1 58 LEU QB 1 65 VAL MG2 3.670 . 3.670 3.573 3.547 3.601 . 0 0 "[ . 1 . 2]" 1
1842 1 8 VAL MG1 1 73 LEU HA 3.140 . 3.140 2.022 2.000 2.036 . 0 0 "[ . 1 . 2]" 1
1843 1 87 LYS HA 1 87 LYS QD 4.380 . 4.380 4.122 4.060 4.221 . 0 0 "[ . 1 . 2]" 1
1844 1 143 GLU H 1 174 LEU MD2 4.410 . 4.410 3.876 3.710 4.012 . 0 0 "[ . 1 . 2]" 1
1845 1 57 ARG H 1 57 ARG QB 3.420 . 3.420 2.635 2.624 2.642 . 0 0 "[ . 1 . 2]" 1
1846 1 89 ASP H 1 90 ASP H 3.320 . 3.320 3.111 2.838 3.618 0.298 9 0 "[ . 1 . 2]" 1
1847 1 51 VAL MG2 1 52 GLN H 4.050 . 4.050 4.051 4.027 4.069 0.019 6 0 "[ . 1 . 2]" 1
1848 1 47 LEU MD1 1 69 PHE QD 3.950 . 3.950 3.986 3.966 4.007 0.057 12 0 "[ . 1 . 2]" 1
1849 1 63 GLN H 1 63 GLN HB3 3.800 . 3.800 2.822 2.799 2.847 . 0 0 "[ . 1 . 2]" 1
1850 1 5 ILE MG 1 73 LEU HG 4.090 . 4.090 3.797 3.709 3.951 . 0 0 "[ . 1 . 2]" 1
1851 1 40 LYS H 1 40 LYS HB3 3.760 . 3.760 3.617 3.580 3.646 . 0 0 "[ . 1 . 2]" 1
1852 1 87 LYS QB 1 87 LYS QD 2.590 . 2.590 2.268 2.219 2.416 . 0 0 "[ . 1 . 2]" 1
1853 1 55 ALA MB 1 65 VAL H 3.990 . 3.990 4.024 4.000 4.037 0.047 4 0 "[ . 1 . 2]" 1
1854 1 126 ASN HA 1 178 LEU MD1 3.020 . 3.020 2.764 2.704 2.852 . 0 0 "[ . 1 . 2]" 1
1855 1 84 VAL QG 2 1 HEM HAC 5.500 . 5.500 4.025 3.317 5.566 0.066 4 0 "[ . 1 . 2]" 1
1856 1 161 HIS HD1 1 173 MET H 4.950 . 4.950 3.689 2.707 4.990 0.040 10 0 "[ . 1 . 2]" 1
1857 1 60 MET H 1 60 MET HG2 3.920 . 3.920 3.479 3.368 3.502 . 0 0 "[ . 1 . 2]" 1
1858 1 145 LEU H 1 145 LEU HG 5.440 . 5.440 2.397 2.062 2.533 . 0 0 "[ . 1 . 2]" 1
1859 1 131 ARG H 1 131 ARG HG2 4.500 . 4.500 4.456 4.428 4.487 . 0 0 "[ . 1 . 2]" 1
1860 1 100 ASP HA 1 104 LEU H 5.320 . 5.320 5.222 5.120 5.299 . 0 0 "[ . 1 . 2]" 1
1861 1 22 TRP HB2 1 22 TRP HD1 3.560 . 3.560 3.615 3.598 3.635 0.075 20 0 "[ . 1 . 2]" 1
1862 1 157 ILE MD 1 159 ILE MG 4.730 . 4.730 4.753 4.724 4.784 0.054 15 0 "[ . 1 . 2]" 1
1863 1 162 ASP H 1 173 MET QB . . 4.510 3.860 3.636 3.996 . 0 0 "[ . 1 . 2]" 1
1864 1 161 HIS HB2 1 162 ASP H 5.000 . 5.000 4.433 4.082 4.640 . 0 0 "[ . 1 . 2]" 1
1865 1 13 VAL HA 1 16 GLN HB2 3.750 . 3.750 2.600 2.578 2.659 . 0 0 "[ . 1 . 2]" 1
1866 1 80 ARG H 1 85 VAL QG 5.200 . 5.200 5.174 4.607 5.257 0.057 16 0 "[ . 1 . 2]" 1
1867 1 28 LYS HA 1 30 ALA H 5.000 . 5.000 4.009 3.809 4.336 . 0 0 "[ . 1 . 2]" 1
1868 1 51 VAL MG1 1 55 ALA MB 3.380 . 3.380 3.455 3.424 3.472 0.092 12 0 "[ . 1 . 2]" 1
1869 1 60 MET HB2 1 65 VAL MG2 2.400 . 2.400 2.043 2.030 2.079 . 0 0 "[ . 1 . 2]" 1
1870 1 129 ALA HA 1 176 ILE MD 4.500 . 4.500 3.787 3.673 3.963 . 0 0 "[ . 1 . 2]" 1
1871 1 177 GLU QB 1 178 LEU H . . 4.140 3.708 3.127 3.757 . 0 0 "[ . 1 . 2]" 1
1872 1 147 PHE H 1 157 ILE MD 4.580 . 4.580 4.337 4.148 4.470 . 0 0 "[ . 1 . 2]" 1
1873 1 159 ILE MG 1 160 SER HA 3.560 . 3.560 3.653 3.636 3.666 0.106 9 0 "[ . 1 . 2]" 1
1874 1 38 SER HA 1 38 SER HB2 2.500 . 2.500 2.385 2.341 2.416 . 0 0 "[ . 1 . 2]" 1
1875 1 130 LEU HG 1 131 ARG HB3 5.090 . 5.090 5.007 4.887 5.110 0.020 18 0 "[ . 1 . 2]" 1
1876 1 12 MET H 1 12 MET QB 3.170 . 3.170 2.460 2.173 2.997 . 0 0 "[ . 1 . 2]" 1
1877 1 104 LEU HA 1 107 ASN HB3 4.420 . 4.420 3.303 3.111 3.463 . 0 0 "[ . 1 . 2]" 1
1878 1 77 LEU H 1 78 ALA HA 5.500 . 5.500 5.442 5.412 5.491 . 0 0 "[ . 1 . 2]" 1
1879 1 54 VAL HB 1 55 ALA H 3.830 . 3.830 3.826 3.815 3.838 0.008 10 0 "[ . 1 . 2]" 1
1880 1 163 THR HA 1 164 CYS H 2.870 . 2.870 2.151 2.141 2.159 . 0 0 "[ . 1 . 2]" 1
1881 1 130 LEU MD2 1 174 LEU MD1 5.000 . 5.000 3.810 3.546 3.985 . 0 0 "[ . 1 . 2]" 1
1882 1 25 LEU H 1 29 HIS HD1 5.500 . 5.500 5.080 4.896 5.522 0.022 16 0 "[ . 1 . 2]" 1
1883 1 131 ARG HG2 1 172 CYS H 4.920 . 4.920 3.537 3.352 3.806 . 0 0 "[ . 1 . 2]" 1
1884 1 176 ILE H 1 176 ILE MD 3.760 . 3.760 2.165 1.999 2.481 . 0 0 "[ . 1 . 2]" 1
1885 1 56 GLN H 1 58 LEU H 4.090 . 4.090 4.013 3.994 4.098 0.008 18 0 "[ . 1 . 2]" 1
1886 1 129 ALA HA 1 176 ILE H 3.720 . 3.720 3.589 3.510 3.676 . 0 0 "[ . 1 . 2]" 1
1887 1 28 LYS HB3 1 29 HIS H 3.610 . 3.610 2.550 2.476 2.636 . 0 0 "[ . 1 . 2]" 1
1888 1 51 VAL MG2 1 69 PHE QD 4.190 . 4.190 2.353 2.283 2.449 . 0 0 "[ . 1 . 2]" 1
1889 1 65 VAL H 1 65 VAL MG2 3.130 . 3.130 2.254 2.216 2.294 . 0 0 "[ . 1 . 2]" 1
1890 1 8 VAL MG1 1 11 ASP HB3 4.090 . 4.090 3.557 3.439 3.641 . 0 0 "[ . 1 . 2]" 1
1891 1 159 ILE HA 1 159 ILE MD 3.900 . 3.900 3.730 3.711 3.750 . 0 0 "[ . 1 . 2]" 1
1892 1 92 THR HA 1 95 VAL MG2 4.110 . 4.110 3.508 3.401 3.624 . 0 0 "[ . 1 . 2]" 1
1893 1 146 LEU HA 1 150 ALA H 4.590 . 4.590 4.493 4.277 4.638 0.048 12 0 "[ . 1 . 2]" 1
1894 1 30 ALA MB 1 46 GLU QG 4.360 . 4.360 4.217 3.515 4.530 0.170 11 0 "[ . 1 . 2]" 1
1895 1 95 VAL MG1 1 96 MET HA 4.070 . 4.070 3.361 3.178 3.521 . 0 0 "[ . 1 . 2]" 1
1896 1 17 CYS HA 1 21 VAL HB 5.010 . 5.010 4.927 4.894 4.943 . 0 0 "[ . 1 . 2]" 1
1897 1 56 GLN HA 1 59 ASN HA 4.400 . 4.400 3.676 3.634 3.776 . 0 0 "[ . 1 . 2]" 1
1898 1 61 PRO HB2 1 63 GLN H 4.240 . 4.240 2.835 2.802 2.874 . 0 0 "[ . 1 . 2]" 1
1899 1 144 GLY HA3 1 147 PHE H 4.940 . 4.940 4.653 4.626 4.691 . 0 0 "[ . 1 . 2]" 1
1900 1 48 PHE HA 1 48 PHE QE 4.640 . 4.640 4.450 4.328 4.695 0.055 7 0 "[ . 1 . 2]" 1
1901 1 179 GLN QG 1 180 ASN H 3.890 . 3.890 3.900 3.869 3.913 0.023 17 0 "[ . 1 . 2]" 1
1902 1 92 THR H 1 92 THR HB 3.340 . 3.340 2.533 2.470 2.699 . 0 0 "[ . 1 . 2]" 1
1903 1 127 GLN H 1 127 GLN QE 5.220 . 5.220 4.812 4.131 5.245 0.025 18 0 "[ . 1 . 2]" 1
1904 1 74 PHE QB 1 77 LEU H 5.500 . 5.500 5.135 5.013 5.231 . 0 0 "[ . 1 . 2]" 1
1905 1 4 ILE MD 1 80 ARG QG 3.410 . 3.410 2.541 2.164 3.452 0.042 16 0 "[ . 1 . 2]" 1
1906 1 106 VAL HA 1 106 VAL MG2 3.480 . 3.480 3.191 3.186 3.196 . 0 0 "[ . 1 . 2]" 1
1907 1 61 PRO HG2 1 64 ASP HA 5.170 . 5.170 4.253 4.243 4.276 . 0 0 "[ . 1 . 2]" 1
1908 1 67 LYS HA 1 67 LYS QD 4.200 . 4.200 4.106 4.073 4.127 . 0 0 "[ . 1 . 2]" 1
1909 1 96 MET HA 1 96 MET QG 3.790 . 3.790 2.975 2.280 3.419 . 0 0 "[ . 1 . 2]" 1
1910 1 101 VAL H 1 104 LEU QD . . 5.000 4.843 4.803 4.869 . 0 0 "[ . 1 . 2]" 1
1911 1 67 LYS HA 1 67 LYS HG3 3.780 . 3.780 2.379 2.337 2.453 . 0 0 "[ . 1 . 2]" 1
1912 1 121 GLN H 1 129 ALA MB 3.830 . 3.830 3.335 3.260 3.394 . 0 0 "[ . 1 . 2]" 1
1913 1 60 MET HG3 1 65 VAL MG2 3.830 . 3.830 3.624 3.562 3.647 . 0 0 "[ . 1 . 2]" 1
1914 1 81 HIS HB3 1 84 VAL HB 4.450 . 4.450 2.620 2.268 4.005 . 0 0 "[ . 1 . 2]" 1
1915 1 61 PRO HB2 1 63 GLN HG2 3.360 . 3.360 2.294 2.284 2.304 . 0 0 "[ . 1 . 2]" 1
1916 1 101 VAL MG2 1 102 ILE H 3.390 . 3.390 1.680 1.664 1.694 . 0 0 "[ . 1 . 2]" 1
1917 1 62 ILE HA 1 62 ILE HG12 3.570 . 3.570 2.998 2.978 3.016 . 0 0 "[ . 1 . 2]" 1
1918 1 131 ARG H 1 131 ARG HB3 3.860 . 3.860 2.602 2.524 2.683 . 0 0 "[ . 1 . 2]" 1
1919 1 90 ASP QB 1 92 THR H 4.510 . 4.510 2.918 2.691 3.401 . 0 0 "[ . 1 . 2]" 1
1920 1 178 LEU HB3 1 178 LEU MD2 3.590 . 3.590 2.214 2.211 2.218 . 0 0 "[ . 1 . 2]" 1
1921 1 22 TRP H 1 23 ASN H 3.340 . 3.340 2.642 2.611 2.681 . 0 0 "[ . 1 . 2]" 1
1922 1 6 PHE HA 1 6 PHE QD 3.610 . 3.610 2.961 2.757 3.038 . 0 0 "[ . 1 . 2]" 1
1923 1 23 ASN HA 1 26 LEU QD 3.630 . 3.630 2.756 2.671 2.922 . 0 0 "[ . 1 . 2]" 1
1924 1 66 VAL MG2 1 140 PHE HB3 2.400 . 2.400 2.482 2.427 2.530 0.130 14 0 "[ . 1 . 2]" 1
1925 1 9 LEU HG 1 22 TRP HZ3 4.380 . 4.380 2.968 2.732 3.066 . 0 0 "[ . 1 . 2]" 1
1926 1 98 ILE MG 1 99 HIS HA 4.010 . 4.010 2.980 2.960 3.060 . 0 0 "[ . 1 . 2]" 1
1927 1 127 GLN QG 1 177 GLU QG 3.460 . 3.460 2.271 2.200 2.310 . 0 0 "[ . 1 . 2]" 1
1928 1 24 GLU H 1 24 GLU QG . . 4.000 3.149 2.874 3.736 . 0 0 "[ . 1 . 2]" 1
1929 1 91 PHE QD 1 155 GLN QG 4.600 . 4.600 3.713 3.528 3.873 . 0 0 "[ . 1 . 2]" 1
1930 1 120 GLY H 1 130 LEU HA 4.520 . 4.520 4.652 4.613 4.683 0.163 16 0 "[ . 1 . 2]" 1
1931 1 95 VAL HA 1 98 ILE MD 2.710 . 2.710 2.163 2.073 2.262 . 0 0 "[ . 1 . 2]" 1
1932 1 26 LEU HB3 1 27 GLU H 3.320 . 3.320 2.652 2.509 2.693 . 0 0 "[ . 1 . 2]" 1
1933 1 150 ALA H 1 157 ILE MD 5.050 . 5.050 4.154 3.992 4.264 . 0 0 "[ . 1 . 2]" 1
1934 1 102 ILE HB 1 103 HIS H 3.810 . 3.810 2.673 2.551 2.773 . 0 0 "[ . 1 . 2]" 1
1935 1 167 THR HA 1 167 THR MG 2.400 . 2.400 2.237 2.212 2.273 . 0 0 "[ . 1 . 2]" 1
1936 1 166 HIS HA 1 166 HIS HD1 4.360 . 4.360 2.957 2.119 3.802 . 0 0 "[ . 1 . 2]" 1
1937 1 75 ASN HA 1 75 ASN QD . . 4.130 2.569 1.796 3.626 . 0 0 "[ . 1 . 2]" 1
1938 1 58 LEU H 1 58 LEU HG 3.490 . 3.490 2.455 2.439 2.470 . 0 0 "[ . 1 . 2]" 1
1939 1 25 LEU MD2 1 50 ILE MD 4.020 . 4.020 3.323 3.177 3.345 . 0 0 "[ . 1 . 2]" 1
1940 1 98 ILE MG 1 102 ILE HB 4.200 . 4.200 3.406 3.272 3.451 . 0 0 "[ . 1 . 2]" 1
1941 1 155 GLN HE21 1 156 LYS H 3.860 . 3.860 2.528 2.164 2.983 . 0 0 "[ . 1 . 2]" 1
1942 1 51 VAL MG1 1 62 ILE HG12 3.230 . 3.230 2.959 2.891 3.031 . 0 0 "[ . 1 . 2]" 1
1943 1 107 ASN H 1 107 ASN HB3 3.750 . 3.750 2.679 2.509 2.896 . 0 0 "[ . 1 . 2]" 1
1944 1 130 LEU H 1 175 ILE MD 3.790 . 3.790 2.967 2.894 3.010 . 0 0 "[ . 1 . 2]" 1
1945 1 164 CYS HA 1 169 ALA MB 4.440 . 4.440 3.932 3.823 3.984 . 0 0 "[ . 1 . 2]" 1
1946 1 26 LEU H 1 26 LEU HG 4.510 . 4.510 4.342 4.318 4.413 . 0 0 "[ . 1 . 2]" 1
1947 1 3 GLY HA3 1 6 PHE H 4.540 . 4.540 3.519 3.351 3.858 . 0 0 "[ . 1 . 2]" 1
1948 1 94 LEU H 1 94 LEU QD 3.880 . 3.880 3.729 3.685 3.775 . 0 0 "[ . 1 . 2]" 1
1949 1 87 LYS QE 1 101 VAL MG2 3.920 . 3.920 2.689 2.178 3.028 . 0 0 "[ . 1 . 2]" 1
1950 1 80 ARG HA 1 80 ARG QD 4.480 . 4.480 2.623 2.181 4.082 . 0 0 "[ . 1 . 2]" 1
1951 1 48 PHE QD 1 51 VAL MG2 5.010 . 5.010 4.300 3.511 4.721 . 0 0 "[ . 1 . 2]" 1
1952 1 25 LEU H 1 28 LYS HB3 5.500 . 5.500 5.204 4.985 5.360 . 0 0 "[ . 1 . 2]" 1
1953 1 172 CYS HB3 1 173 MET H 4.250 . 4.250 2.792 2.579 3.730 . 0 0 "[ . 1 . 2]" 1
1954 1 51 VAL MG1 1 66 VAL HA 3.710 . 3.710 2.609 2.571 2.682 . 0 0 "[ . 1 . 2]" 1
1955 1 71 GLN HG2 1 148 GLY H 4.270 . 4.270 2.888 2.463 3.134 . 0 0 "[ . 1 . 2]" 1
1956 1 50 ILE HA 1 50 ILE MG 2.550 . 2.550 2.409 2.389 2.429 . 0 0 "[ . 1 . 2]" 1
1957 1 177 GLU HA 1 177 GLU QG 3.440 . 3.440 2.360 2.320 2.378 . 0 0 "[ . 1 . 2]" 1
1958 1 37 VAL HB 1 40 LYS HB3 3.630 . 3.630 3.742 3.725 3.767 0.137 5 0 "[ . 1 . 2]" 1
1959 1 103 HIS HA 1 106 VAL MG1 4.090 . 4.090 3.061 2.896 3.212 . 0 0 "[ . 1 . 2]" 1
1960 1 98 ILE MG 1 102 ILE MD 3.590 . 3.590 3.539 3.329 3.648 0.058 3 0 "[ . 1 . 2]" 1
1961 1 126 ASN H 1 127 GLN QG 5.500 . 5.500 3.840 2.824 4.348 . 0 0 "[ . 1 . 2]" 1
1962 1 178 LEU HG 1 179 GLN H 5.210 . 5.210 5.031 5.021 5.052 . 0 0 "[ . 1 . 2]" 1
1963 1 64 ASP HA 1 67 LYS QD 3.840 . 3.840 3.671 3.546 3.797 . 0 0 "[ . 1 . 2]" 1
1964 1 170 ASP H 1 171 HIS H 3.400 . 3.400 2.367 2.258 2.517 . 0 0 "[ . 1 . 2]" 1
1965 1 157 ILE HB 1 158 GLN H 3.430 . 3.430 2.312 2.207 2.383 . 0 0 "[ . 1 . 2]" 1
1966 1 132 TYR QB 1 174 LEU MD1 4.210 . 4.210 3.185 3.051 3.382 . 0 0 "[ . 1 . 2]" 1
1967 1 123 LEU MD1 1 127 GLN H 4.570 . 4.570 4.439 4.365 4.585 0.015 19 0 "[ . 1 . 2]" 1
1968 1 175 ILE HA 1 175 ILE MD 3.120 . 3.120 2.118 2.102 2.135 . 0 0 "[ . 1 . 2]" 1
1969 1 151 GLN QB 1 151 GLN HG2 2.780 . 2.780 2.369 2.197 2.418 . 0 0 "[ . 1 . 2]" 1
1970 1 17 CYS HB2 1 21 VAL HB 3.510 . 3.510 3.207 2.974 3.280 . 0 0 "[ . 1 . 2]" 1
1971 1 18 GLY H 1 21 VAL H 5.000 . 5.000 4.930 4.877 4.958 . 0 0 "[ . 1 . 2]" 1
1972 1 84 VAL HB 1 105 GLU QG 4.640 . 4.640 4.693 4.655 4.740 0.100 7 0 "[ . 1 . 2]" 1
1973 1 37 VAL HB 1 38 SER H 4.570 . 4.570 3.997 3.807 4.169 . 0 0 "[ . 1 . 2]" 1
1974 1 166 HIS H 1 169 ALA MB 5.060 . 5.060 4.399 4.188 4.657 . 0 0 "[ . 1 . 2]" 1
1975 1 130 LEU H 1 175 ILE MG 5.430 . 5.430 4.432 4.335 4.580 . 0 0 "[ . 1 . 2]" 1
1976 1 90 ASP QB 1 91 PHE H 3.770 . 3.770 3.018 2.621 3.605 . 0 0 "[ . 1 . 2]" 1
1977 1 155 GLN HE21 1 179 GLN H 3.560 . 3.560 3.531 3.208 3.618 0.058 13 0 "[ . 1 . 2]" 1
1978 1 22 TRP HD1 1 26 LEU QD 3.860 . 3.860 3.378 3.238 3.509 . 0 0 "[ . 1 . 2]" 1
1979 1 77 LEU H 1 77 LEU HG 3.910 . 3.910 2.554 2.366 2.746 . 0 0 "[ . 1 . 2]" 1
1980 1 130 LEU HB2 1 176 ILE MD 3.960 . 3.960 2.184 2.106 2.330 . 0 0 "[ . 1 . 2]" 1
1981 1 158 GLN HA 1 158 GLN QB 2.700 . 2.700 2.422 2.397 2.465 . 0 0 "[ . 1 . 2]" 1
1982 1 54 VAL HA 1 57 ARG QB 4.340 . 4.340 4.233 4.217 4.251 . 0 0 "[ . 1 . 2]" 1
1983 1 170 ASP QB 1 171 HIS H 3.690 . 3.690 3.451 3.223 3.775 0.085 11 0 "[ . 1 . 2]" 1
1984 1 84 VAL QG 1 101 VAL MG2 3.300 . 3.300 2.618 2.162 3.125 . 0 0 "[ . 1 . 2]" 1
1985 1 153 PHE H 1 155 GLN H 4.110 . 4.110 3.342 3.228 3.446 . 0 0 "[ . 1 . 2]" 1
1986 1 172 CYS HB3 1 174 LEU MD1 3.780 . 3.780 2.914 2.756 3.437 . 0 0 "[ . 1 . 2]" 1
1987 1 83 ASP HA 1 85 VAL H 4.790 . 4.790 4.806 4.722 4.838 0.048 13 0 "[ . 1 . 2]" 1
1988 1 75 ASN H 1 75 ASN QD 2.580 . 2.580 2.442 1.706 2.587 0.007 17 0 "[ . 1 . 2]" 1
1989 1 53 ASP H 1 55 ALA H 4.600 . 4.600 3.797 3.785 3.808 . 0 0 "[ . 1 . 2]" 1
1990 1 68 ALA HA 1 71 GLN HB3 4.380 . 4.380 4.301 4.176 4.386 0.006 12 0 "[ . 1 . 2]" 1
1991 1 13 VAL MG1 1 22 TRP HB2 3.970 . 3.970 3.894 3.870 3.918 . 0 0 "[ . 1 . 2]" 1
1992 1 173 MET HG2 1 175 ILE MD 3.590 . 3.590 2.497 2.344 2.680 . 0 0 "[ . 1 . 2]" 1
1993 1 122 LEU HA 1 122 LEU MD1 3.000 . 3.000 2.235 2.157 2.251 . 0 0 "[ . 1 . 2]" 1
1994 1 85 VAL QG 1 87 LYS H 5.180 . 5.180 3.981 3.844 4.099 . 0 0 "[ . 1 . 2]" 1
1995 1 77 LEU HA 1 77 LEU MD2 3.250 . 3.250 2.145 2.115 2.213 . 0 0 "[ . 1 . 2]" 1
1996 1 73 LEU H 1 145 LEU MD2 4.650 . 4.650 4.028 3.870 4.213 . 0 0 "[ . 1 . 2]" 1
1997 1 5 ILE HA 1 5 ILE MD 3.560 . 3.560 2.213 2.199 2.232 . 0 0 "[ . 1 . 2]" 1
1998 1 23 ASN H 1 26 LEU H 5.050 . 5.050 4.763 4.740 4.792 . 0 0 "[ . 1 . 2]" 1
1999 1 91 PHE HZ 1 176 ILE MG 3.670 . 3.670 2.810 2.461 3.197 . 0 0 "[ . 1 . 2]" 1
2000 1 147 PHE H 1 147 PHE QE 4.940 . 4.940 4.528 4.471 4.592 . 0 0 "[ . 1 . 2]" 1
2001 1 10 GLU H 1 10 GLU QG 4.140 . 4.140 3.906 2.842 3.968 . 0 0 "[ . 1 . 2]" 1
2002 1 122 LEU QB 1 122 LEU MD1 2.950 . 2.950 2.207 2.192 2.262 . 0 0 "[ . 1 . 2]" 1
2003 1 108 LYS QB 1 108 LYS QD 2.550 . 2.550 2.172 2.111 2.321 . 0 0 "[ . 1 . 2]" 1
2004 1 22 TRP HA 1 22 TRP HE1 3.460 . 3.460 2.287 2.256 2.311 . 0 0 "[ . 1 . 2]" 1
2005 1 143 GLU HA 1 159 ILE MD 3.760 . 3.760 2.844 2.662 3.040 . 0 0 "[ . 1 . 2]" 1
2006 1 74 PHE H 1 74 PHE QD 4.250 . 4.250 4.141 4.109 4.168 . 0 0 "[ . 1 . 2]" 1
2007 1 26 LEU HG 1 30 ALA MB 3.510 . 3.510 3.121 2.800 3.268 . 0 0 "[ . 1 . 2]" 1
2008 1 36 TYR H 1 37 VAL MG2 5.000 . 5.000 4.155 3.466 4.466 . 0 0 "[ . 1 . 2]" 1
2009 1 102 ILE MD 1 102 ILE MG 3.120 . 3.120 2.737 2.702 2.809 . 0 0 "[ . 1 . 2]" 1
2010 1 66 VAL MG1 1 140 PHE HB3 3.640 . 3.640 2.167 2.064 2.238 . 0 0 "[ . 1 . 2]" 1
2011 1 58 LEU MD1 1 60 MET HG3 4.020 . 4.020 3.799 3.721 3.822 . 0 0 "[ . 1 . 2]" 1
2012 1 163 THR H 1 173 MET HG2 4.410 . 4.410 4.442 4.417 4.462 0.052 17 0 "[ . 1 . 2]" 1
2013 1 55 ALA MB 1 62 ILE H 3.770 . 3.770 3.337 3.290 3.366 . 0 0 "[ . 1 . 2]" 1
2014 1 107 ASN H 1 109 LEU H 4.270 . 4.270 3.942 3.720 4.066 . 0 0 "[ . 1 . 2]" 1
2015 1 85 VAL HB 1 86 ASP H 3.470 . 3.470 2.427 2.322 2.965 . 0 0 "[ . 1 . 2]" 1
2016 1 70 GLY HA3 1 144 GLY HA3 3.330 . 3.330 2.726 2.343 3.021 . 0 0 "[ . 1 . 2]" 1
2017 1 21 VAL MG2 1 22 TRP HA 4.500 . 4.500 4.177 4.015 4.364 . 0 0 "[ . 1 . 2]" 1
2018 1 73 LEU HG 1 145 LEU MD2 4.460 . 4.460 3.921 3.819 4.067 . 0 0 "[ . 1 . 2]" 1
2019 1 62 ILE HB 1 63 GLN H 4.110 . 4.110 3.930 3.911 3.948 . 0 0 "[ . 1 . 2]" 1
2020 1 23 ASN HA 1 26 LEU HB3 3.620 . 3.620 2.360 2.328 2.476 . 0 0 "[ . 1 . 2]" 1
2021 1 105 GLU QG 1 109 LEU H 4.740 . 4.740 4.361 3.914 4.722 . 0 0 "[ . 1 . 2]" 1
2022 1 151 GLN H 1 151 GLN HG2 5.310 . 5.310 3.419 2.062 4.514 . 0 0 "[ . 1 . 2]" 1
2023 1 25 LEU MD2 1 53 ASP HB2 3.960 . 3.960 3.992 3.981 4.004 0.044 12 0 "[ . 1 . 2]" 1
2024 1 128 ILE H 1 128 ILE MD 4.390 . 4.390 3.929 3.875 3.987 . 0 0 "[ . 1 . 2]" 1
2025 1 11 ASP HA 1 14 VAL MG2 3.280 . 3.280 3.278 3.185 3.308 0.028 5 0 "[ . 1 . 2]" 1
2026 1 175 ILE MD 1 175 ILE MG 2.400 . 2.400 1.799 1.790 1.813 . 0 0 "[ . 1 . 2]" 1
2027 1 20 SER HA 1 20 SER QB 2.430 . 2.430 2.300 2.187 2.394 . 0 0 "[ . 1 . 2]" 1
2028 1 122 LEU QB 1 122 LEU HG 2.400 . 2.400 2.421 2.405 2.446 0.046 19 0 "[ . 1 . 2]" 1
2029 1 50 ILE H 1 51 VAL MG2 4.390 . 4.390 4.202 4.137 4.248 . 0 0 "[ . 1 . 2]" 1
2030 1 28 LYS H 1 29 HIS HD1 4.050 . 4.050 3.917 3.655 4.095 0.045 16 0 "[ . 1 . 2]" 1
2031 1 178 LEU HB2 1 179 GLN H 5.000 . 5.000 4.149 4.093 4.202 . 0 0 "[ . 1 . 2]" 1
2032 1 67 LYS HA 1 141 CYS HA 3.440 . 3.440 3.356 3.199 3.460 0.020 3 0 "[ . 1 . 2]" 1
2033 1 4 ILE HB 1 38 SER HA 4.420 . 4.420 4.456 4.394 4.493 0.073 13 0 "[ . 1 . 2]" 1
2034 1 4 ILE HA 1 7 ASN QB 3.740 . 3.740 2.576 2.409 2.744 . 0 0 "[ . 1 . 2]" 1
2035 1 156 LYS HA 1 156 LYS QE 5.000 . 5.000 4.292 3.506 4.599 . 0 0 "[ . 1 . 2]" 1
2036 1 68 ALA HA 1 71 GLN HB2 3.790 . 3.790 2.715 2.605 2.786 . 0 0 "[ . 1 . 2]" 1
2037 1 40 LYS HA 1 40 LYS HG2 3.330 . 3.330 3.007 2.984 3.035 . 0 0 "[ . 1 . 2]" 1
2038 1 8 VAL HA 1 8 VAL MG2 3.160 . 3.160 2.499 2.464 2.534 . 0 0 "[ . 1 . 2]" 1
2039 1 129 ALA H 1 129 ALA MB 3.190 . 3.190 2.336 2.289 2.361 . 0 0 "[ . 1 . 2]" 1
2040 1 66 VAL MG2 1 141 CYS H 3.510 . 3.510 3.040 2.884 3.132 . 0 0 "[ . 1 . 2]" 1
2041 1 54 VAL H 1 55 ALA MB 4.420 . 4.420 4.429 4.418 4.444 0.024 18 0 "[ . 1 . 2]" 1
2042 1 159 ILE MG 1 174 LEU HG 2.870 . 2.870 2.351 2.272 2.398 . 0 0 "[ . 1 . 2]" 1
2043 1 99 HIS H 1 100 ASP H 3.750 . 3.750 2.953 2.929 2.992 . 0 0 "[ . 1 . 2]" 1
2044 1 123 LEU MD1 1 175 ILE HA 3.920 . 3.920 3.935 3.798 3.988 0.068 6 0 "[ . 1 . 2]" 1
2045 1 29 HIS H 1 30 ALA MB 4.240 . 4.240 4.066 3.992 4.137 . 0 0 "[ . 1 . 2]" 1
2046 1 25 LEU MD2 1 29 HIS HD1 3.310 . 3.310 2.171 1.788 2.658 . 0 0 "[ . 1 . 2]" 1
2047 1 51 VAL MG1 1 62 ILE HB 4.510 . 4.510 4.423 4.407 4.440 . 0 0 "[ . 1 . 2]" 1
2048 1 123 LEU MD2 1 129 ALA HA 4.180 . 4.180 3.901 3.838 4.206 0.026 19 0 "[ . 1 . 2]" 1
2049 1 174 LEU MD1 1 175 ILE MD 4.950 . 4.950 4.964 4.946 4.990 0.040 15 0 "[ . 1 . 2]" 1
2050 1 121 GLN HB3 1 129 ALA MB 2.920 . 2.920 2.319 2.297 2.343 . 0 0 "[ . 1 . 2]" 1
2051 1 91 PHE QD 1 178 LEU MD1 4.990 . 4.990 3.826 3.607 4.063 . 0 0 "[ . 1 . 2]" 1
2052 1 96 MET QG 1 128 ILE MD 5.250 . 5.250 4.855 4.280 5.280 0.030 12 0 "[ . 1 . 2]" 1
2053 1 5 ILE MD 1 73 LEU MD2 3.830 . 3.830 2.035 2.024 2.098 . 0 0 "[ . 1 . 2]" 1
2054 1 172 CYS H 1 172 CYS HB2 3.930 . 3.930 2.932 2.806 3.245 . 0 0 "[ . 1 . 2]" 1
2055 1 158 GLN H 1 176 ILE MG 3.690 . 3.690 3.298 3.212 3.364 . 0 0 "[ . 1 . 2]" 1
2056 1 159 ILE H 1 159 ILE HB 3.280 . 3.280 2.641 2.591 2.680 . 0 0 "[ . 1 . 2]" 1
2057 1 62 ILE HA 1 65 VAL MG2 3.310 . 3.310 2.926 2.870 2.991 . 0 0 "[ . 1 . 2]" 1
2058 1 42 TYR HA 1 43 ALA HA 4.960 . 4.960 4.719 4.474 5.082 0.122 20 0 "[ . 1 . 2]" 1
2059 1 50 ILE H 1 51 VAL H 3.910 . 3.910 2.505 2.489 2.518 . 0 0 "[ . 1 . 2]" 1
2060 1 125 ASN HA 1 126 ASN QB 4.750 . 4.750 4.489 4.168 4.931 0.181 2 0 "[ . 1 . 2]" 1
2061 1 121 GLN HB2 1 129 ALA MB 3.790 . 3.790 3.813 3.763 3.840 0.050 19 0 "[ . 1 . 2]" 1
2062 1 117 HIS H 1 117 HIS QB 3.760 . 3.760 2.416 2.316 2.624 . 0 0 "[ . 1 . 2]" 1
2063 1 29 HIS H 1 50 ILE QG 5.290 . 5.290 5.229 4.969 5.320 0.030 4 0 "[ . 1 . 2]" 1
2064 1 161 HIS HD1 1 172 CYS HB3 4.970 . 4.970 4.242 2.941 5.032 0.062 3 0 "[ . 1 . 2]" 1
2065 1 22 TRP HB3 1 22 TRP HD1 2.810 . 2.810 2.522 2.517 2.527 . 0 0 "[ . 1 . 2]" 1
2066 1 150 ALA MB 1 157 ILE MG 3.020 . 3.020 2.804 2.456 3.031 0.011 17 0 "[ . 1 . 2]" 1
2067 1 24 GLU H 1 24 GLU HA 2.910 . 2.910 2.838 2.830 2.849 . 0 0 "[ . 1 . 2]" 1
2068 1 62 ILE H 1 62 ILE HG12 4.590 . 4.590 4.528 4.522 4.535 . 0 0 "[ . 1 . 2]" 1
2069 1 164 CYS HA 1 172 CYS HB2 5.160 . 5.160 4.039 2.907 4.796 . 0 0 "[ . 1 . 2]" 1
2070 1 91 PHE H 1 91 PHE QB 3.760 . 3.760 2.192 2.168 2.209 . 0 0 "[ . 1 . 2]" 1
2071 1 6 PHE HB2 1 36 TYR HB3 3.890 . 3.890 3.846 3.072 3.959 0.069 7 0 "[ . 1 . 2]" 1
2072 1 51 VAL MG2 1 69 PHE QE 4.360 . 4.360 2.451 2.349 2.594 . 0 0 "[ . 1 . 2]" 1
2073 1 77 LEU HG 1 145 LEU MD2 5.180 . 5.180 4.965 4.788 5.165 . 0 0 "[ . 1 . 2]" 1
2074 1 122 LEU H 1 123 LEU H 4.460 . 4.460 4.534 4.516 4.556 0.096 20 0 "[ . 1 . 2]" 1
2075 1 16 GLN H 1 16 GLN HB3 3.690 . 3.690 3.645 3.636 3.652 . 0 0 "[ . 1 . 2]" 1
2076 1 76 GLY HA2 1 78 ALA MB 4.710 . 4.710 4.776 4.736 4.814 0.104 20 0 "[ . 1 . 2]" 1
2077 1 5 ILE MG 1 6 PHE H 3.920 . 3.920 3.621 3.509 3.710 . 0 0 "[ . 1 . 2]" 1
2078 1 21 VAL MG2 1 57 ARG HD3 3.300 . 3.300 2.431 2.346 2.713 . 0 0 "[ . 1 . 2]" 1
2079 1 55 ALA MB 1 60 MET HB3 4.180 . 4.180 4.207 4.187 4.219 0.039 17 0 "[ . 1 . 2]" 1
2080 1 108 LYS H 1 109 LEU QB 5.070 . 5.070 4.361 4.216 4.599 . 0 0 "[ . 1 . 2]" 1
2081 1 25 LEU MD1 1 26 LEU HB2 2.400 . 2.400 2.391 2.320 2.414 0.014 3 0 "[ . 1 . 2]" 1
2082 1 159 ILE HB 1 159 ILE MD 3.380 . 3.380 2.382 2.362 2.403 . 0 0 "[ . 1 . 2]" 1
2083 1 163 THR MG 1 164 CYS HA 4.260 . 4.260 3.820 3.751 3.905 . 0 0 "[ . 1 . 2]" 1
2084 1 10 GLU HA 1 22 TRP HE1 4.560 . 4.560 3.732 3.609 3.793 . 0 0 "[ . 1 . 2]" 1
2085 1 48 PHE HA 1 51 VAL H 4.370 . 4.370 3.205 3.088 3.301 . 0 0 "[ . 1 . 2]" 1
2086 1 150 ALA MB 1 156 LYS HA 3.710 . 3.710 3.575 3.345 3.726 0.016 14 0 "[ . 1 . 2]" 1
2087 1 177 GLU HA 1 178 LEU MD1 4.900 . 4.900 4.721 4.631 4.784 . 0 0 "[ . 1 . 2]" 1
2088 1 60 MET H 1 60 MET HG3 4.030 . 4.030 2.795 2.717 3.035 . 0 0 "[ . 1 . 2]" 1
2089 1 157 ILE MD 1 176 ILE MG 2.990 . 2.990 1.944 1.919 2.027 . 0 0 "[ . 1 . 2]" 1
2090 1 22 TRP HZ2 1 26 LEU QD 3.770 . 3.770 3.334 2.858 3.487 . 0 0 "[ . 1 . 2]" 1
2091 1 37 VAL MG1 1 39 ALA MB 3.260 . 3.260 2.366 2.264 2.469 . 0 0 "[ . 1 . 2]" 1
2092 1 37 VAL MG1 1 40 LYS HB3 4.530 . 4.530 4.547 4.446 4.622 0.092 4 0 "[ . 1 . 2]" 1
2093 1 37 VAL H 1 37 VAL HB 3.770 . 3.770 2.724 2.638 2.894 . 0 0 "[ . 1 . 2]" 1
2094 1 173 MET H 1 174 LEU MD1 3.930 . 3.930 3.002 2.874 3.079 . 0 0 "[ . 1 . 2]" 1
2095 1 157 ILE MD 1 178 LEU MD2 4.130 . 4.130 3.562 3.516 3.622 . 0 0 "[ . 1 . 2]" 1
2096 1 91 PHE HA 1 95 VAL H 3.950 . 3.950 4.019 3.975 4.069 0.119 19 0 "[ . 1 . 2]" 1
2097 1 124 PRO QB 1 125 ASN H 4.020 . 4.020 2.487 1.645 2.671 . 0 0 "[ . 1 . 2]" 1
2098 1 127 GLN H 1 127 GLN HB2 3.320 . 3.320 2.608 2.551 2.718 . 0 0 "[ . 1 . 2]" 1
2099 1 51 VAL H 1 52 GLN H 4.090 . 4.090 2.615 2.559 2.637 . 0 0 "[ . 1 . 2]" 1
2100 1 124 PRO HA 1 127 GLN H 5.500 . 5.500 4.623 4.118 5.386 . 0 0 "[ . 1 . 2]" 1
2101 1 51 VAL MG1 1 53 ASP H 5.000 . 5.000 4.996 4.966 5.009 0.009 13 0 "[ . 1 . 2]" 1
2102 1 143 GLU QB 1 144 GLY H 4.060 . 4.060 2.404 2.329 2.503 . 0 0 "[ . 1 . 2]" 1
2103 1 63 GLN H 1 64 ASP HB2 5.180 . 5.180 5.185 5.164 5.204 0.024 9 0 "[ . 1 . 2]" 1
2104 1 155 GLN HE22 1 157 ILE MG 4.350 . 4.350 3.908 3.737 4.359 0.009 18 0 "[ . 1 . 2]" 1
2105 1 28 LYS H 1 30 ALA H 4.040 . 4.040 3.740 3.634 3.819 . 0 0 "[ . 1 . 2]" 1
2106 1 174 LEU H 1 174 LEU MD1 3.330 . 3.330 2.882 2.769 2.928 . 0 0 "[ . 1 . 2]" 1
2107 1 94 LEU QD 1 149 ALA MB 2.790 . 2.790 2.645 2.058 2.804 0.014 3 0 "[ . 1 . 2]" 1
2108 1 144 GLY HA2 1 147 PHE QB 4.430 . 4.430 2.809 2.715 2.938 . 0 0 "[ . 1 . 2]" 1
2109 1 7 ASN QB 1 8 VAL H 3.950 . 3.950 2.426 2.280 2.569 . 0 0 "[ . 1 . 2]" 1
2110 1 27 GLU H 1 27 GLU QB 2.900 . 2.900 2.300 2.190 2.359 . 0 0 "[ . 1 . 2]" 1
2111 1 81 HIS HA 1 84 VAL HB 4.740 . 4.740 4.190 3.654 4.754 0.014 8 0 "[ . 1 . 2]" 1
2112 1 10 GLU QB 1 11 ASP H 3.620 . 3.620 2.817 2.704 3.482 . 0 0 "[ . 1 . 2]" 1
2113 1 64 ASP H 1 66 VAL H 4.320 . 4.320 4.086 4.072 4.113 . 0 0 "[ . 1 . 2]" 1
2114 1 4 ILE H 1 7 ASN QB 4.750 . 4.750 4.647 4.550 4.798 0.048 12 0 "[ . 1 . 2]" 1
2115 1 38 SER H 1 39 ALA H 4.560 . 4.560 2.490 2.318 2.662 . 0 0 "[ . 1 . 2]" 1
2116 1 173 MET HA 1 174 LEU MD1 4.010 . 4.010 3.650 3.620 3.679 . 0 0 "[ . 1 . 2]" 1
2117 1 97 GLY H 1 98 ILE QG 4.690 . 4.690 3.402 3.322 3.450 . 0 0 "[ . 1 . 2]" 1
2118 1 55 ALA H 1 65 VAL MG2 3.640 . 3.640 3.738 3.720 3.758 0.118 11 0 "[ . 1 . 2]" 1
2119 1 61 PRO HG2 1 64 ASP H 3.770 . 3.770 2.585 2.573 2.597 . 0 0 "[ . 1 . 2]" 1
2120 1 151 GLN H 1 151 GLN QE 5.500 . 5.500 4.677 2.957 5.327 . 0 0 "[ . 1 . 2]" 1
2121 1 15 ALA H 1 16 GLN H 3.260 . 3.260 2.383 2.366 2.420 . 0 0 "[ . 1 . 2]" 1
2122 1 26 LEU H 1 27 GLU QB 4.550 . 4.550 4.432 4.339 4.541 . 0 0 "[ . 1 . 2]" 1
2123 1 19 MET HA 1 22 TRP HD1 5.190 . 5.190 4.720 4.508 4.963 . 0 0 "[ . 1 . 2]" 1
2124 1 78 ALA MB 1 82 THR HA 4.630 . 4.630 3.519 3.459 3.644 . 0 0 "[ . 1 . 2]" 1
2125 1 75 ASN HB3 1 76 GLY H 4.060 . 4.060 3.137 3.037 3.334 . 0 0 "[ . 1 . 2]" 1
2126 1 121 GLN QG 1 122 LEU QB 4.480 . 4.480 4.070 3.866 4.203 . 0 0 "[ . 1 . 2]" 1
2127 1 108 LYS H 1 109 LEU HA 5.080 . 5.080 5.139 5.070 5.185 0.105 18 0 "[ . 1 . 2]" 1
2128 1 123 LEU QB 1 128 ILE HA 4.050 . 4.050 4.122 3.675 4.184 0.134 16 0 "[ . 1 . 2]" 1
2129 1 66 VAL HA 1 66 VAL MG2 3.230 . 3.230 2.323 2.292 2.344 . 0 0 "[ . 1 . 2]" 1
2130 1 127 GLN HB3 1 175 ILE MG 3.650 . 3.650 3.021 2.857 3.149 . 0 0 "[ . 1 . 2]" 1
2131 1 158 GLN HA 1 159 ILE H 2.400 . 2.400 2.225 2.199 2.251 . 0 0 "[ . 1 . 2]" 1
2132 1 131 ARG HA 1 173 MET H 5.180 . 5.180 5.190 5.115 5.233 0.053 9 0 "[ . 1 . 2]" 1
2133 1 32 LYS H 1 33 ASP H 3.910 . 3.910 2.769 2.482 3.049 . 0 0 "[ . 1 . 2]" 1
2134 1 73 LEU MD2 1 74 PHE H 4.860 . 4.860 4.311 4.247 4.385 . 0 0 "[ . 1 . 2]" 1
2135 1 176 ILE MG 1 178 LEU HA 4.300 . 4.300 4.086 4.032 4.158 . 0 0 "[ . 1 . 2]" 1
2136 1 102 ILE MG 1 103 HIS H 3.920 . 3.920 3.009 2.851 3.129 . 0 0 "[ . 1 . 2]" 1
2137 1 47 LEU HA 1 50 ILE MD 4.350 . 4.350 2.285 2.269 2.315 . 0 0 "[ . 1 . 2]" 1
2138 1 68 ALA H 1 69 PHE QD 4.930 . 4.930 4.486 4.438 4.570 . 0 0 "[ . 1 . 2]" 1
2139 1 37 VAL MG2 1 40 LYS HB3 4.410 . 4.410 4.441 4.335 4.482 0.072 4 0 "[ . 1 . 2]" 1
2140 1 9 LEU HG 1 10 GLU H 4.820 . 4.820 3.253 3.174 3.380 . 0 0 "[ . 1 . 2]" 1
2141 1 73 LEU HG 1 74 PHE H 4.700 . 4.700 4.411 4.346 4.473 . 0 0 "[ . 1 . 2]" 1
2142 1 25 LEU QB 1 26 LEU H 3.880 . 3.880 3.614 3.586 3.628 . 0 0 "[ . 1 . 2]" 1
2143 1 103 HIS HA 1 106 VAL HB 4.750 . 4.750 4.667 4.603 4.736 . 0 0 "[ . 1 . 2]" 1
2144 1 130 LEU MD2 1 176 ILE QG 3.700 . 3.700 3.829 3.783 3.916 0.216 5 0 "[ . 1 . 2]" 1
2145 1 52 GLN HG3 1 53 ASP H 4.540 . 4.540 2.225 2.183 2.255 . 0 0 "[ . 1 . 2]" 1
2146 1 123 LEU QB 1 123 LEU MD1 2.400 . 2.400 2.077 2.072 2.092 . 0 0 "[ . 1 . 2]" 1
2147 1 174 LEU HA 1 174 LEU MD2 3.790 . 3.790 3.711 3.701 3.718 . 0 0 "[ . 1 . 2]" 1
2148 1 50 ILE HB 1 51 VAL H 3.800 . 3.800 2.787 2.743 2.906 . 0 0 "[ . 1 . 2]" 1
2149 1 62 ILE MG 1 63 GLN H 3.190 . 3.190 2.034 1.999 2.071 . 0 0 "[ . 1 . 2]" 1
2150 1 92 THR HA 1 92 THR MG 3.020 . 3.020 2.316 2.292 2.333 . 0 0 "[ . 1 . 2]" 1
2151 1 173 MET H 1 173 MET QB . . 3.910 2.578 2.533 2.604 . 0 0 "[ . 1 . 2]" 1
2152 1 178 LEU HB2 1 178 LEU MD2 3.350 . 3.350 3.188 3.180 3.195 . 0 0 "[ . 1 . 2]" 1
2153 1 81 HIS HA 1 84 VAL QG 4.380 . 4.380 3.639 3.538 3.759 . 0 0 "[ . 1 . 2]" 1
2154 1 13 VAL H 1 13 VAL MG1 2.890 . 2.890 2.104 2.042 2.132 . 0 0 "[ . 1 . 2]" 1
2155 1 23 ASN H 1 26 LEU HB3 4.770 . 4.770 4.607 4.584 4.670 . 0 0 "[ . 1 . 2]" 1
2156 1 123 LEU HA 1 123 LEU HG 3.390 . 3.390 3.406 3.229 3.448 0.058 16 0 "[ . 1 . 2]" 1
2157 1 163 THR H 1 164 CYS HA 5.500 . 5.500 5.233 5.125 5.316 . 0 0 "[ . 1 . 2]" 1
2158 1 167 THR H 1 169 ALA H 4.590 . 4.590 3.079 2.947 3.214 . 0 0 "[ . 1 . 2]" 1
2159 1 143 GLU H 1 143 GLU HG3 3.450 . 3.450 2.458 2.390 2.531 . 0 0 "[ . 1 . 2]" 1
2160 1 83 ASP H 1 83 ASP HB2 3.300 . 3.300 2.456 2.384 2.541 . 0 0 "[ . 1 . 2]" 1
2161 1 56 GLN HA 1 60 MET H 4.200 . 4.200 3.673 3.636 3.732 . 0 0 "[ . 1 . 2]" 1
2162 1 119 ASN H 1 131 ARG H 3.430 . 3.430 3.130 3.023 3.218 . 0 0 "[ . 1 . 2]" 1
2163 1 43 ALA MB 1 46 GLU H 3.930 . 3.930 3.643 2.968 3.959 0.029 7 0 "[ . 1 . 2]" 1
2164 1 107 ASN HA 1 109 LEU H 4.480 . 4.480 4.212 4.049 4.465 . 0 0 "[ . 1 . 2]" 1
2165 1 122 LEU HA 1 128 ILE QG 3.400 . 3.400 3.012 2.876 3.408 0.008 2 0 "[ . 1 . 2]" 1
2166 1 91 PHE QE 1 128 ILE MD 4.450 . 4.450 3.163 2.922 3.531 . 0 0 "[ . 1 . 2]" 1
2167 1 63 GLN H 1 64 ASP H 3.740 . 3.740 2.671 2.646 2.689 . 0 0 "[ . 1 . 2]" 1
2168 1 178 LEU HB3 1 178 LEU MD1 3.140 . 3.140 2.488 2.431 2.536 . 0 0 "[ . 1 . 2]" 1
2169 1 180 ASN HA 1 181 ASP HA 4.940 . 4.940 4.797 4.653 4.931 . 0 0 "[ . 1 . 2]" 1
2170 1 8 VAL MG1 1 75 ASN HB2 4.590 . 4.590 4.295 4.122 4.425 . 0 0 "[ . 1 . 2]" 1
2171 1 171 HIS H 1 172 CYS H 4.540 . 4.540 4.307 4.243 4.348 . 0 0 "[ . 1 . 2]" 1
2172 1 45 SER H 1 46 GLU H 4.940 . 4.940 2.687 2.599 2.755 . 0 0 "[ . 1 . 2]" 1
2173 1 76 GLY H 1 77 LEU H 3.480 . 3.480 2.704 2.624 2.758 . 0 0 "[ . 1 . 2]" 1
2174 1 151 GLN HA 1 151 GLN QE 4.390 . 4.390 4.187 2.059 4.396 0.006 11 0 "[ . 1 . 2]" 1
2175 1 21 VAL HA 1 21 VAL MG1 3.200 . 3.200 3.186 3.175 3.192 . 0 0 "[ . 1 . 2]" 1
2176 1 106 VAL MG2 2 1 HEM HAC 4.370 . 4.370 4.197 3.833 4.439 0.069 4 0 "[ . 1 . 2]" 1
2177 1 8 VAL MG1 1 72 PHE QB 3.750 . 3.750 3.309 3.014 3.521 . 0 0 "[ . 1 . 2]" 1
2178 1 28 LYS H 1 28 LYS QG 4.030 . 4.030 3.955 3.944 3.981 . 0 0 "[ . 1 . 2]" 1
2179 1 91 PHE QE 1 150 ALA MB 4.040 . 4.040 2.905 2.444 3.279 . 0 0 "[ . 1 . 2]" 1
2180 1 146 LEU HA 2 1 HEM HAB 5.110 . 5.110 5.142 4.998 5.220 0.110 17 0 "[ . 1 . 2]" 1
2181 1 119 ASN H 1 132 TYR HA 4.070 . 4.070 3.929 3.711 4.057 . 0 0 "[ . 1 . 2]" 1
2182 1 92 THR H 1 92 THR MG 3.730 . 3.730 3.748 3.734 3.756 0.026 11 0 "[ . 1 . 2]" 1
2183 1 6 PHE HA 1 47 LEU MD1 4.110 . 4.110 3.484 3.330 3.587 . 0 0 "[ . 1 . 2]" 1
2184 1 92 THR MG 1 128 ILE MG 5.000 . 5.000 4.284 4.086 4.462 . 0 0 "[ . 1 . 2]" 1
2185 1 21 VAL H 1 24 GLU H 4.750 . 4.750 4.607 4.583 4.635 . 0 0 "[ . 1 . 2]" 1
2186 1 25 LEU MD1 1 54 VAL HA 5.000 . 5.000 4.932 4.861 5.014 0.014 18 0 "[ . 1 . 2]" 1
2187 1 60 MET HG2 1 65 VAL MG2 4.370 . 4.370 4.302 4.286 4.363 . 0 0 "[ . 1 . 2]" 1
2188 1 126 ASN QD 1 180 ASN QB 4.720 . 4.720 3.455 2.454 4.801 0.081 16 0 "[ . 1 . 2]" 1
2189 1 85 VAL HB 1 87 LYS H 4.800 . 4.800 4.635 4.519 4.699 . 0 0 "[ . 1 . 2]" 1
2190 1 32 LYS HA 1 32 LYS HB2 2.840 . 2.840 2.474 2.414 2.542 . 0 0 "[ . 1 . 2]" 1
2191 1 147 PHE H 1 147 PHE QD 3.870 . 3.870 2.819 2.733 2.879 . 0 0 "[ . 1 . 2]" 1
2192 1 55 ALA H 1 58 LEU MD1 5.120 . 5.120 4.391 4.328 4.429 . 0 0 "[ . 1 . 2]" 1
2193 1 48 PHE HB3 1 49 SER H 4.440 . 4.440 2.686 2.358 3.789 . 0 0 "[ . 1 . 2]" 1
2194 1 172 CYS H 1 173 MET H 5.070 . 5.070 4.438 4.412 4.460 . 0 0 "[ . 1 . 2]" 1
2195 1 102 ILE MD 1 103 HIS H 5.000 . 5.000 4.216 4.154 4.271 . 0 0 "[ . 1 . 2]" 1
2196 1 166 HIS H 1 166 HIS HD1 4.510 . 4.510 4.320 1.645 4.571 0.061 10 0 "[ . 1 . 2]" 1
2197 1 108 LYS HA 1 108 LYS QB 2.740 . 2.740 2.363 2.188 2.404 . 0 0 "[ . 1 . 2]" 1
2198 1 51 VAL MG1 1 52 GLN H 4.250 . 4.250 3.319 3.271 3.340 . 0 0 "[ . 1 . 2]" 1
2199 1 10 GLU HA 1 13 VAL MG2 3.930 . 3.930 2.105 2.080 2.125 . 0 0 "[ . 1 . 2]" 1
2200 1 179 GLN H 1 179 GLN QG 3.410 . 3.410 2.430 2.336 2.472 . 0 0 "[ . 1 . 2]" 1
2201 1 104 LEU HA 1 104 LEU HG 3.110 . 3.110 2.572 2.537 2.615 . 0 0 "[ . 1 . 2]" 1
2202 1 123 LEU QB 1 125 ASN H 6.000 . 6.000 5.590 4.810 5.808 . 0 0 "[ . 1 . 2]" 1
2203 1 19 MET HA 1 19 MET HG3 3.830 . 3.830 3.302 2.646 3.652 . 0 0 "[ . 1 . 2]" 1
2204 1 84 VAL HA 1 87 LYS QE 3.860 . 3.860 3.912 3.896 3.951 0.091 2 0 "[ . 1 . 2]" 1
2205 1 73 LEU HA 1 73 LEU MD2 4.310 . 4.310 3.730 3.709 3.748 . 0 0 "[ . 1 . 2]" 1
2206 1 146 LEU MD1 1 159 ILE MD 3.470 . 3.470 2.027 1.969 2.072 . 0 0 "[ . 1 . 2]" 1
2207 1 175 ILE HA 1 175 ILE MG 3.180 . 3.180 2.295 2.277 2.315 . 0 0 "[ . 1 . 2]" 1
2208 1 26 LEU QD 1 36 TYR QD 4.940 . 4.940 3.038 2.711 3.512 . 0 0 "[ . 1 . 2]" 1
2209 1 126 ASN QD 1 180 ASN HA 4.290 . 4.290 4.195 3.396 4.320 0.030 13 0 "[ . 1 . 2]" 1
2210 1 143 GLU H 1 146 LEU H 5.280 . 5.280 4.920 4.767 5.047 . 0 0 "[ . 1 . 2]" 1
2211 1 40 LYS HB3 1 40 LYS QE 2.730 . 2.730 2.291 2.137 2.310 . 0 0 "[ . 1 . 2]" 1
2212 1 58 LEU H 1 58 LEU MD1 4.000 . 4.000 3.644 3.619 3.659 . 0 0 "[ . 1 . 2]" 1
2213 1 157 ILE HB 1 178 LEU HA 4.370 . 4.370 3.851 3.730 3.911 . 0 0 "[ . 1 . 2]" 1
2214 1 17 CYS HB2 1 18 GLY H 5.000 . 5.000 3.440 3.396 3.496 . 0 0 "[ . 1 . 2]" 1
2215 1 79 SER H 1 80 ARG QG 4.210 . 4.210 3.967 3.731 4.213 0.003 8 0 "[ . 1 . 2]" 1
2216 1 120 GLY HA2 1 130 LEU MD2 4.940 . 4.940 5.043 4.984 5.125 0.185 7 0 "[ . 1 . 2]" 1
2217 1 123 LEU QB 1 127 GLN H 3.510 . 3.510 3.539 3.238 3.687 0.177 12 0 "[ . 1 . 2]" 1
2218 1 8 VAL MG2 1 76 GLY H 4.310 . 4.310 4.258 4.146 4.331 0.021 16 0 "[ . 1 . 2]" 1
2219 1 36 TYR H 1 36 TYR HB2 3.850 . 3.850 3.510 3.252 3.632 . 0 0 "[ . 1 . 2]" 1
2220 1 12 MET QB 1 13 VAL MG1 3.900 . 3.900 3.084 2.966 3.345 . 0 0 "[ . 1 . 2]" 1
2221 1 151 GLN H 1 153 PHE H 5.500 . 5.500 4.108 4.060 4.215 . 0 0 "[ . 1 . 2]" 1
2222 1 98 ILE HA 1 102 ILE MG 5.000 . 5.000 3.384 3.152 3.644 . 0 0 "[ . 1 . 2]" 1
2223 1 96 MET QB 1 128 ILE MG 3.480 . 3.480 3.526 3.495 3.559 0.079 15 0 "[ . 1 . 2]" 1
2224 1 91 PHE QD 1 94 LEU QD 5.500 . 5.500 3.754 3.460 3.913 . 0 0 "[ . 1 . 2]" 1
2225 1 50 ILE H 1 50 ILE QG 3.890 . 3.890 2.404 2.325 2.446 . 0 0 "[ . 1 . 2]" 1
2226 1 97 GLY H 1 98 ILE MG 5.500 . 5.500 5.635 5.613 5.652 0.152 15 0 "[ . 1 . 2]" 1
2227 1 130 LEU HB3 1 130 LEU MD2 2.730 . 2.730 2.153 2.134 2.193 . 0 0 "[ . 1 . 2]" 1
2228 1 24 GLU H 1 25 LEU MD1 3.740 . 3.740 3.637 3.554 3.678 . 0 0 "[ . 1 . 2]" 1
2229 1 63 GLN HA 1 67 LYS H 4.380 . 4.380 4.349 4.321 4.376 . 0 0 "[ . 1 . 2]" 1
2230 1 19 MET HA 1 19 MET HG2 4.140 . 4.140 3.316 2.446 3.850 . 0 0 "[ . 1 . 2]" 1
2231 1 52 GLN HA 1 62 ILE HG13 3.740 . 3.740 2.465 2.418 2.502 . 0 0 "[ . 1 . 2]" 1
2232 1 147 PHE H 1 148 GLY H 3.830 . 3.830 2.538 2.504 2.574 . 0 0 "[ . 1 . 2]" 1
2233 1 9 LEU H 1 10 GLU H 3.690 . 3.690 2.715 2.694 2.764 . 0 0 "[ . 1 . 2]" 1
2234 1 163 THR MG 1 172 CYS H 4.520 . 4.520 4.292 4.108 4.525 0.005 7 0 "[ . 1 . 2]" 1
2235 1 121 GLN H 1 129 ALA H 4.340 . 4.340 3.344 3.316 3.375 . 0 0 "[ . 1 . 2]" 1
2236 1 90 ASP H 1 91 PHE HA 5.410 . 5.410 4.949 4.897 5.077 . 0 0 "[ . 1 . 2]" 1
2237 1 24 GLU HB2 1 25 LEU MD1 4.130 . 4.130 4.132 4.022 4.172 0.042 15 0 "[ . 1 . 2]" 1
2238 1 84 VAL HB 1 86 ASP H 5.370 . 5.370 5.094 5.033 5.134 . 0 0 "[ . 1 . 2]" 1
2239 1 134 SER QB 1 136 ARG H 4.320 . 4.320 3.394 2.397 4.330 0.010 6 0 "[ . 1 . 2]" 1
2240 1 128 ILE HA 1 129 ALA H 3.150 . 3.150 2.159 2.150 2.170 . 0 0 "[ . 1 . 2]" 1
2241 1 145 LEU H 1 146 LEU H 4.230 . 4.230 2.788 2.748 2.866 . 0 0 "[ . 1 . 2]" 1
2242 1 122 LEU HG 1 123 LEU H 4.100 . 4.100 3.084 2.912 3.258 . 0 0 "[ . 1 . 2]" 1
2243 1 62 ILE MD 1 66 VAL H 5.500 . 5.500 5.413 5.395 5.436 . 0 0 "[ . 1 . 2]" 1
2244 1 158 GLN HA 1 158 GLN QG 2.400 . 2.400 2.306 2.242 2.446 0.046 15 0 "[ . 1 . 2]" 1
2245 1 86 ASP H 1 86 ASP HA 2.780 . 2.780 2.736 2.701 2.759 . 0 0 "[ . 1 . 2]" 1
2246 1 106 VAL H 1 106 VAL MG1 3.760 . 3.760 1.836 1.739 2.070 . 0 0 "[ . 1 . 2]" 1
2247 1 91 PHE HA 1 91 PHE QD 3.840 . 3.840 2.733 2.665 2.800 . 0 0 "[ . 1 . 2]" 1
2248 1 40 LYS HA 1 40 LYS HG3 3.950 . 3.950 3.874 3.856 3.889 . 0 0 "[ . 1 . 2]" 1
2249 1 22 TRP H 1 22 TRP HD1 5.160 . 5.160 5.034 5.017 5.051 . 0 0 "[ . 1 . 2]" 1
2250 1 131 ARG QD 1 172 CYS H 4.810 . 4.810 4.664 4.261 4.852 0.042 18 0 "[ . 1 . 2]" 1
2251 1 65 VAL MG2 1 69 PHE QD 4.990 . 4.990 4.832 4.705 4.885 . 0 0 "[ . 1 . 2]" 1
2252 1 17 CYS HB3 1 21 VAL MG1 3.190 . 3.190 2.801 2.742 2.997 . 0 0 "[ . 1 . 2]" 1
2253 1 4 ILE QG 1 7 ASN QB 4.460 . 4.460 3.897 3.692 4.153 . 0 0 "[ . 1 . 2]" 1
2254 1 53 ASP HB3 1 55 ALA H 4.780 . 4.780 4.574 4.559 4.590 . 0 0 "[ . 1 . 2]" 1
2255 1 74 PHE H 1 145 LEU MD2 3.920 . 3.920 2.493 2.410 2.603 . 0 0 "[ . 1 . 2]" 1
2256 1 91 PHE QD 1 95 VAL MG1 4.950 . 4.950 4.989 4.962 5.025 0.075 16 0 "[ . 1 . 2]" 1
2257 1 130 LEU H 1 176 ILE MD 4.230 . 4.230 2.913 2.812 3.024 . 0 0 "[ . 1 . 2]" 1
2258 1 102 ILE H 1 102 ILE QG 4.500 . 4.500 2.660 2.633 2.724 . 0 0 "[ . 1 . 2]" 1
2259 1 104 LEU HA 1 107 ASN HB2 4.020 . 4.020 3.262 2.876 3.574 . 0 0 "[ . 1 . 2]" 1
2260 1 4 ILE MG 1 5 ILE H 3.190 . 3.190 1.839 1.726 1.934 . 0 0 "[ . 1 . 2]" 1
2261 1 91 PHE QD 1 157 ILE MG 4.180 . 4.180 3.472 3.381 3.595 . 0 0 "[ . 1 . 2]" 1
2262 1 32 LYS HA 1 32 LYS QE 4.470 . 4.470 4.017 3.615 4.594 0.124 10 0 "[ . 1 . 2]" 1
2263 1 146 LEU H 1 146 LEU MD1 3.760 . 3.760 3.374 3.294 3.447 . 0 0 "[ . 1 . 2]" 1
2264 1 71 GLN HG2 1 148 GLY HA3 3.790 . 3.790 3.588 3.279 3.793 0.003 14 0 "[ . 1 . 2]" 1
2265 1 92 THR MG 1 96 MET QG 5.000 . 5.000 4.354 3.551 5.071 0.071 15 0 "[ . 1 . 2]" 1
2266 1 94 LEU H 1 95 VAL MG2 4.620 . 4.620 4.173 4.075 4.305 . 0 0 "[ . 1 . 2]" 1
2267 1 73 LEU HA 1 76 GLY HA3 4.690 . 4.690 4.432 4.335 4.530 . 0 0 "[ . 1 . 2]" 1
2268 1 157 ILE HB 1 157 ILE MD 3.550 . 3.550 2.254 2.244 2.266 . 0 0 "[ . 1 . 2]" 1
2269 1 152 HIS H 1 153 PHE H 2.850 . 2.850 2.898 2.875 2.946 0.096 18 0 "[ . 1 . 2]" 1
2270 1 13 VAL MG1 1 22 TRP HA 4.130 . 4.130 4.057 4.020 4.160 0.030 20 0 "[ . 1 . 2]" 1
2271 1 143 GLU QB 1 174 LEU MD2 3.730 . 3.730 3.787 3.769 3.806 0.076 20 0 "[ . 1 . 2]" 1
2272 1 91 PHE QB 1 92 THR H 4.840 . 4.840 2.647 2.550 2.707 . 0 0 "[ . 1 . 2]" 1
2273 1 127 GLN HA 1 175 ILE MG 4.960 . 4.960 4.348 4.192 4.519 . 0 0 "[ . 1 . 2]" 1
2274 1 153 PHE QD 1 155 GLN QB 5.500 . 5.500 3.568 3.439 3.669 . 0 0 "[ . 1 . 2]" 1
2275 1 98 ILE MG 2 1 HEM HAB 5.030 . 5.030 3.555 2.656 4.009 . 0 0 "[ . 1 . 2]" 1
2276 1 83 ASP HB2 1 84 VAL H 4.150 . 4.150 3.771 3.725 3.852 . 0 0 "[ . 1 . 2]" 1
2277 1 38 SER HB3 1 39 ALA H 4.620 . 4.620 3.902 3.782 3.988 . 0 0 "[ . 1 . 2]" 1
2278 1 120 GLY HA2 1 130 LEU H 4.820 . 4.820 4.765 4.742 4.791 . 0 0 "[ . 1 . 2]" 1
2279 1 47 LEU H 1 47 LEU HG 4.670 . 4.670 4.489 4.483 4.495 . 0 0 "[ . 1 . 2]" 1
2280 1 39 ALA H 1 39 ALA MB 2.950 . 2.950 2.225 2.195 2.256 . 0 0 "[ . 1 . 2]" 1
2281 1 131 ARG HG2 1 132 TYR H 4.380 . 4.380 2.314 2.141 2.555 . 0 0 "[ . 1 . 2]" 1
2282 1 140 PHE HA 1 143 GLU QB 3.380 . 3.380 3.095 2.782 3.263 . 0 0 "[ . 1 . 2]" 1
2283 1 174 LEU H 1 174 LEU HG 5.110 . 5.110 4.385 4.334 4.420 . 0 0 "[ . 1 . 2]" 1
2284 1 101 VAL H 1 102 ILE H 3.690 . 3.690 2.716 2.688 2.750 . 0 0 "[ . 1 . 2]" 1
2285 1 98 ILE MD 1 130 LEU MD1 2.400 . 2.400 1.911 1.839 2.046 . 0 0 "[ . 1 . 2]" 1
2286 1 169 ALA H 1 169 ALA MB 2.790 . 2.790 2.196 2.045 2.244 . 0 0 "[ . 1 . 2]" 1
2287 1 31 PRO HA 1 32 LYS H 3.100 . 3.100 2.649 2.456 2.841 . 0 0 "[ . 1 . 2]" 1
2288 1 121 GLN H 1 128 ILE MG 4.060 . 4.060 3.081 2.989 3.196 . 0 0 "[ . 1 . 2]" 1
2289 1 53 ASP HA 1 56 GLN QB 3.320 . 3.320 2.798 2.772 2.822 . 0 0 "[ . 1 . 2]" 1
2290 1 159 ILE H 1 160 SER H 4.470 . 4.470 4.358 4.342 4.379 . 0 0 "[ . 1 . 2]" 1
2291 1 85 VAL H 1 86 ASP H 3.320 . 3.320 2.807 2.752 2.849 . 0 0 "[ . 1 . 2]" 1
2292 1 80 ARG H 1 81 HIS HA 4.900 . 4.900 4.961 4.917 5.054 0.154 4 0 "[ . 1 . 2]" 1
2293 1 175 ILE H 1 175 ILE HB 3.620 . 3.620 2.665 2.653 2.679 . 0 0 "[ . 1 . 2]" 1
2294 1 159 ILE MD 1 176 ILE MG 3.440 . 3.440 3.299 3.225 3.374 . 0 0 "[ . 1 . 2]" 1
2295 1 94 LEU H 1 94 LEU HB2 3.610 . 3.610 2.587 2.286 2.783 . 0 0 "[ . 1 . 2]" 1
2296 1 108 LYS H 1 108 LYS HG3 3.910 . 3.910 2.242 1.913 2.373 . 0 0 "[ . 1 . 2]" 1
2297 1 3 GLY HA2 1 36 TYR HA 5.500 . 5.500 5.096 4.682 5.367 . 0 0 "[ . 1 . 2]" 1
2298 1 137 ARG H 1 138 LEU H 5.000 . 5.000 3.653 2.783 4.652 . 0 0 "[ . 1 . 2]" 1
2299 1 73 LEU HA 1 76 GLY H 4.300 . 4.300 3.794 3.707 3.872 . 0 0 "[ . 1 . 2]" 1
2300 1 167 THR H 1 168 GLY H 3.380 . 3.380 2.667 2.555 2.835 . 0 0 "[ . 1 . 2]" 1
2301 1 146 LEU H 1 146 LEU HG 3.830 . 3.830 2.190 2.103 2.315 . 0 0 "[ . 1 . 2]" 1
2302 1 11 ASP H 1 12 MET H 3.360 . 3.360 2.546 2.512 2.660 . 0 0 "[ . 1 . 2]" 1
2303 1 66 VAL MG1 1 140 PHE H 5.000 . 5.000 4.881 4.745 5.001 0.001 9 0 "[ . 1 . 2]" 1
2304 1 99 HIS QB 1 100 ASP H . . 4.280 2.658 2.217 3.198 . 0 0 "[ . 1 . 2]" 1
2305 1 66 VAL MG2 1 69 PHE H 4.780 . 4.780 4.803 4.781 4.853 0.073 6 0 "[ . 1 . 2]" 1
2306 1 18 GLY HA2 1 19 MET H 3.040 . 3.040 2.571 2.486 2.612 . 0 0 "[ . 1 . 2]" 1
2307 1 51 VAL H 1 51 VAL MG2 3.220 . 3.220 2.422 2.362 2.487 . 0 0 "[ . 1 . 2]" 1
2308 1 70 GLY HA3 1 144 GLY HA2 4.650 . 4.650 4.361 3.994 4.672 0.022 8 0 "[ . 1 . 2]" 1
2309 1 30 ALA MB 1 31 PRO HG3 4.740 . 4.740 4.707 4.535 4.777 0.037 18 0 "[ . 1 . 2]" 1
2310 1 54 VAL HA 1 54 VAL MG1 3.670 . 3.670 3.180 3.178 3.182 . 0 0 "[ . 1 . 2]" 1
2311 1 74 PHE QE 1 85 VAL QG 4.160 . 4.160 3.030 2.780 3.405 . 0 0 "[ . 1 . 2]" 1
2312 1 130 LEU MD2 1 174 LEU QB 2.750 . 2.750 2.493 2.183 2.688 . 0 0 "[ . 1 . 2]" 1
2313 1 22 TRP H 1 25 LEU MD1 4.620 . 4.620 4.289 4.231 4.312 . 0 0 "[ . 1 . 2]" 1
2314 1 62 ILE HA 1 62 ILE MG 3.330 . 3.330 3.190 3.189 3.191 . 0 0 "[ . 1 . 2]" 1
2315 1 129 ALA MB 1 130 LEU H 3.560 . 3.560 3.354 3.329 3.391 . 0 0 "[ . 1 . 2]" 1
2316 1 159 ILE H 1 159 ILE HG13 3.870 . 3.870 2.955 2.898 3.014 . 0 0 "[ . 1 . 2]" 1
2317 1 106 VAL HA 1 106 VAL MG1 3.740 . 3.740 2.480 2.457 2.507 . 0 0 "[ . 1 . 2]" 1
2318 1 71 GLN HA 1 148 GLY HA3 2.940 . 2.940 2.404 2.296 2.884 . 0 0 "[ . 1 . 2]" 1
2319 1 77 LEU QB 1 78 ALA MB 4.670 . 4.670 3.854 3.814 3.917 . 0 0 "[ . 1 . 2]" 1
2320 1 6 PHE QE 1 36 TYR HB3 4.810 . 4.810 4.083 3.112 4.843 0.033 5 0 "[ . 1 . 2]" 1
2321 1 150 ALA MB 1 157 ILE MD 3.180 . 3.180 2.287 2.211 2.361 . 0 0 "[ . 1 . 2]" 1
2322 1 55 ALA MB 1 66 VAL H 5.500 . 5.500 4.914 4.881 4.949 . 0 0 "[ . 1 . 2]" 1
2323 1 45 SER H 1 46 GLU QG 5.230 . 5.230 4.486 4.131 5.325 0.095 16 0 "[ . 1 . 2]" 1
2324 1 163 THR MG 1 164 CYS H 3.340 . 3.340 2.736 2.568 2.817 . 0 0 "[ . 1 . 2]" 1
2325 1 66 VAL H 1 67 LYS H 3.720 . 3.720 2.627 2.588 2.667 . 0 0 "[ . 1 . 2]" 1
2326 1 119 ASN QB 1 131 ARG H 4.240 . 4.240 3.443 3.281 3.781 . 0 0 "[ . 1 . 2]" 1
2327 1 52 GLN HG3 1 62 ILE MD 4.530 . 4.530 4.556 4.544 4.569 0.039 10 0 "[ . 1 . 2]" 1
2328 1 16 GLN H 1 17 CYS HB2 5.310 . 5.310 4.807 4.785 4.843 . 0 0 "[ . 1 . 2]" 1
2329 1 84 VAL QG 1 105 GLU H 4.680 . 4.680 3.949 3.790 4.093 . 0 0 "[ . 1 . 2]" 1
2330 1 49 SER QB 1 53 ASP H 5.150 . 5.150 4.988 4.849 5.243 0.093 15 0 "[ . 1 . 2]" 1
2331 1 78 ALA H 1 85 VAL QG 4.730 . 4.730 3.833 3.529 4.088 . 0 0 "[ . 1 . 2]" 1
2332 1 108 LYS H 1 109 LEU H 3.370 . 3.370 2.522 2.479 2.563 . 0 0 "[ . 1 . 2]" 1
2333 1 132 TYR HA 1 133 SER H 3.380 . 3.380 2.276 2.178 2.353 . 0 0 "[ . 1 . 2]" 1
2334 1 14 VAL H 1 15 ALA H 3.280 . 3.280 2.748 2.729 2.767 . 0 0 "[ . 1 . 2]" 1
2335 1 5 ILE QG 1 6 PHE H 4.680 . 4.680 3.740 3.668 3.781 . 0 0 "[ . 1 . 2]" 1
2336 1 29 HIS H 1 30 ALA H 3.060 . 3.060 2.495 2.286 2.580 . 0 0 "[ . 1 . 2]" 1
2337 1 8 VAL MG2 1 73 LEU MD2 4.160 . 4.160 4.220 4.184 4.294 0.134 20 0 "[ . 1 . 2]" 1
2338 1 94 LEU QD 1 153 PHE HZ 5.370 . 5.370 4.076 3.522 4.755 . 0 0 "[ . 1 . 2]" 1
2339 1 96 MET H 1 122 LEU MD1 4.450 . 4.450 3.890 3.763 4.475 0.025 16 0 "[ . 1 . 2]" 1
2340 1 150 ALA HA 1 155 GLN QB 4.370 . 4.370 2.767 2.694 2.856 . 0 0 "[ . 1 . 2]" 1
2341 1 73 LEU HG 1 77 LEU QB 4.560 . 4.560 4.253 4.029 4.418 . 0 0 "[ . 1 . 2]" 1
2342 1 155 GLN HE22 1 178 LEU HA 4.850 . 4.850 4.821 4.715 4.861 0.011 8 0 "[ . 1 . 2]" 1
2343 1 140 PHE HB2 1 141 CYS H 4.740 . 4.740 3.281 3.076 3.421 . 0 0 "[ . 1 . 2]" 1
2344 1 63 GLN H 1 63 GLN HG2 3.820 . 3.820 1.854 1.814 1.912 . 0 0 "[ . 1 . 2]" 1
2345 1 37 VAL MG2 1 38 SER H 4.230 . 4.230 4.162 4.050 4.226 . 0 0 "[ . 1 . 2]" 1
2346 1 4 ILE H 1 4 ILE HB 3.890 . 3.890 2.554 2.490 2.635 . 0 0 "[ . 1 . 2]" 1
2347 1 174 LEU HG 1 175 ILE H 3.900 . 3.900 3.955 3.916 3.977 0.077 8 0 "[ . 1 . 2]" 1
2348 1 62 ILE HG13 1 62 ILE MG 3.200 . 3.200 3.187 3.186 3.189 . 0 0 "[ . 1 . 2]" 1
2349 1 57 ARG QB 1 58 LEU H 4.090 . 4.090 3.351 3.312 3.378 . 0 0 "[ . 1 . 2]" 1
2350 1 5 ILE MG 1 8 VAL H 5.110 . 5.110 4.879 4.776 5.040 . 0 0 "[ . 1 . 2]" 1
2351 1 62 ILE MG 1 63 GLN HA 3.630 . 3.630 3.105 3.090 3.119 . 0 0 "[ . 1 . 2]" 1
2352 1 94 LEU QD 1 98 ILE QG 4.030 . 4.030 2.251 1.861 2.575 . 0 0 "[ . 1 . 2]" 1
2353 1 68 ALA H 1 70 GLY H 4.610 . 4.610 4.408 4.349 4.463 . 0 0 "[ . 1 . 2]" 1
2354 1 179 GLN HA 1 179 GLN QE 4.110 . 4.110 4.101 3.985 4.128 0.018 17 0 "[ . 1 . 2]" 1
2355 1 117 HIS H 1 117 HIS HD1 5.320 . 5.320 3.602 2.433 4.513 . 0 0 "[ . 1 . 2]" 1
2356 1 20 SER HA 1 23 ASN H 3.930 . 3.930 3.514 3.440 3.591 . 0 0 "[ . 1 . 2]" 1
2357 1 121 GLN HB3 1 129 ALA H 4.260 . 4.260 3.601 3.535 3.673 . 0 0 "[ . 1 . 2]" 1
2358 1 105 GLU H 1 105 GLU QB 3.350 . 3.350 2.278 2.241 2.298 . 0 0 "[ . 1 . 2]" 1
2359 1 4 ILE H 1 4 ILE MD 4.410 . 4.410 4.021 3.945 4.078 . 0 0 "[ . 1 . 2]" 1
2360 1 3 GLY H 1 4 ILE H 4.940 . 4.940 3.800 3.735 3.913 . 0 0 "[ . 1 . 2]" 1
2361 1 13 VAL HA 1 16 GLN H 3.710 . 3.710 3.102 3.085 3.115 . 0 0 "[ . 1 . 2]" 1
2362 1 155 GLN H 1 155 GLN QB 3.290 . 3.290 2.407 2.369 2.428 . 0 0 "[ . 1 . 2]" 1
2363 1 10 GLU HA 1 10 GLU QG 3.690 . 3.690 2.401 2.346 3.270 . 0 0 "[ . 1 . 2]" 1
2364 1 123 LEU MD1 1 177 GLU HA 5.260 . 5.260 5.353 5.317 5.406 0.146 19 0 "[ . 1 . 2]" 1
2365 1 148 GLY H 1 149 ALA H 3.980 . 3.980 2.714 2.679 2.737 . 0 0 "[ . 1 . 2]" 1
2366 1 150 ALA H 1 157 ILE QG 4.960 . 4.960 4.774 4.654 4.933 . 0 0 "[ . 1 . 2]" 1
2367 1 121 GLN QG 1 122 LEU H 3.500 . 3.500 2.679 2.355 2.940 . 0 0 "[ . 1 . 2]" 1
2368 1 40 LYS QE 1 41 SER H 5.330 . 5.330 4.398 3.933 5.380 0.050 15 0 "[ . 1 . 2]" 1
2369 1 98 ILE HA 1 102 ILE H 4.660 . 4.660 3.930 3.827 4.035 . 0 0 "[ . 1 . 2]" 1
2370 1 159 ILE HG13 1 160 SER H 5.140 . 5.140 5.035 4.987 5.074 . 0 0 "[ . 1 . 2]" 1
2371 1 57 ARG H 1 59 ASN H 4.090 . 4.090 3.722 3.712 3.732 . 0 0 "[ . 1 . 2]" 1
2372 1 106 VAL MG1 2 1 HEM HAC 4.170 . 4.170 2.109 2.006 2.505 . 0 0 "[ . 1 . 2]" 1
2373 1 60 MET HA 1 61 PRO HB2 5.500 . 5.500 5.630 5.625 5.634 0.134 1 0 "[ . 1 . 2]" 1
2374 1 7 ASN H 1 9 LEU HB3 5.500 . 5.500 4.815 4.724 4.890 . 0 0 "[ . 1 . 2]" 1
2375 1 20 SER QB 1 21 VAL H 3.630 . 3.630 2.965 2.641 3.515 . 0 0 "[ . 1 . 2]" 1
2376 1 163 THR MG 1 173 MET H 3.790 . 3.790 3.582 3.479 3.692 . 0 0 "[ . 1 . 2]" 1
2377 1 13 VAL H 1 15 ALA H 4.480 . 4.480 4.086 4.048 4.115 . 0 0 "[ . 1 . 2]" 1
2378 1 74 PHE H 1 75 ASN HB2 5.000 . 5.000 4.616 4.562 4.733 . 0 0 "[ . 1 . 2]" 1
2379 1 6 PHE HB3 1 7 ASN H 4.320 . 4.320 3.931 3.889 3.994 . 0 0 "[ . 1 . 2]" 1
2380 1 8 VAL HA 1 11 ASP H 3.710 . 3.710 3.693 3.660 3.742 0.032 8 0 "[ . 1 . 2]" 1
2381 1 131 ARG HA 1 132 TYR H 3.530 . 3.530 2.245 2.228 2.254 . 0 0 "[ . 1 . 2]" 1
2382 1 93 SER H 1 94 LEU H 3.860 . 3.860 2.626 2.514 2.714 . 0 0 "[ . 1 . 2]" 1
2383 1 22 TRP H 1 22 TRP HB3 3.240 . 3.240 2.568 2.559 2.580 . 0 0 "[ . 1 . 2]" 1
2384 1 4 ILE MG 1 6 PHE H 4.850 . 4.850 4.091 3.919 4.192 . 0 0 "[ . 1 . 2]" 1
2385 1 50 ILE MG 1 51 VAL HA 3.810 . 3.810 3.356 3.330 3.388 . 0 0 "[ . 1 . 2]" 1
2386 1 147 PHE QE 1 158 GLN QG 4.640 . 4.640 4.585 4.244 4.719 0.079 15 0 "[ . 1 . 2]" 1
2387 1 67 LYS QD 1 143 GLU QB 4.550 . 4.550 4.163 3.759 4.510 . 0 0 "[ . 1 . 2]" 1
2388 1 98 ILE HA 1 100 ASP H 4.990 . 4.990 4.706 4.604 4.789 . 0 0 "[ . 1 . 2]" 1
2389 1 4 ILE MG 1 5 ILE QG 2.990 . 2.990 2.042 1.993 2.070 . 0 0 "[ . 1 . 2]" 1
2390 1 98 ILE H 1 98 ILE HB 3.940 . 3.940 2.577 2.532 2.666 . 0 0 "[ . 1 . 2]" 1
2391 1 120 GLY HA2 1 122 LEU MD1 5.500 . 5.500 5.500 5.374 5.670 0.170 2 0 "[ . 1 . 2]" 1
2392 1 52 GLN H 1 53 ASP H 3.820 . 3.820 2.540 2.527 2.559 . 0 0 "[ . 1 . 2]" 1
2393 1 65 VAL MG2 1 67 LYS H 5.500 . 5.500 5.294 5.255 5.330 . 0 0 "[ . 1 . 2]" 1
2394 1 176 ILE HA 1 177 GLU H 3.320 . 3.320 2.167 2.138 2.189 . 0 0 "[ . 1 . 2]" 1
2395 1 16 GLN HG3 1 17 CYS H 4.430 . 4.430 4.201 4.172 4.226 . 0 0 "[ . 1 . 2]" 1
2396 1 123 LEU MD1 1 127 GLN HB2 2.960 . 2.960 2.559 2.446 2.843 . 0 0 "[ . 1 . 2]" 1
2397 1 155 GLN H 1 157 ILE MG 5.410 . 5.410 5.265 4.973 5.411 0.001 10 0 "[ . 1 . 2]" 1
2398 1 26 LEU QD 1 50 ILE MD 3.080 . 3.080 2.686 2.252 2.802 . 0 0 "[ . 1 . 2]" 1
2399 1 96 MET H 1 97 GLY H 3.580 . 3.580 2.467 2.411 2.532 . 0 0 "[ . 1 . 2]" 1
2400 1 25 LEU MD1 1 29 HIS HD1 4.950 . 4.950 4.277 4.001 4.743 . 0 0 "[ . 1 . 2]" 1
2401 1 82 THR H 1 85 VAL H 5.030 . 5.030 4.855 4.705 5.108 0.078 8 0 "[ . 1 . 2]" 1
2402 1 78 ALA MB 1 79 SER QB 4.110 . 4.110 3.861 3.798 4.176 0.066 20 0 "[ . 1 . 2]" 1
2403 1 62 ILE HA 1 62 ILE MD 3.970 . 3.970 3.727 3.721 3.733 . 0 0 "[ . 1 . 2]" 1
2404 1 102 ILE H 1 102 ILE MG 4.360 . 4.360 3.717 3.703 3.732 . 0 0 "[ . 1 . 2]" 1
2405 1 98 ILE H 1 98 ILE QG 4.080 . 4.080 1.953 1.839 2.019 . 0 0 "[ . 1 . 2]" 1
2406 1 4 ILE H 1 4 ILE QG 4.680 . 4.680 4.057 4.040 4.092 . 0 0 "[ . 1 . 2]" 1
2407 1 52 GLN QB 1 62 ILE MD 3.260 . 3.260 2.022 2.019 2.027 . 0 0 "[ . 1 . 2]" 1
2408 1 66 VAL MG2 1 140 PHE HA 4.730 . 4.730 4.551 4.460 4.681 . 0 0 "[ . 1 . 2]" 1
2409 1 81 HIS H 1 81 HIS HB2 3.980 . 3.980 2.711 2.398 3.860 . 0 0 "[ . 1 . 2]" 1
2410 1 58 LEU HA 1 58 LEU MD2 2.540 . 2.540 2.110 2.101 2.129 . 0 0 "[ . 1 . 2]" 1
2411 1 157 ILE MD 1 178 LEU HA 5.000 . 5.000 5.055 5.024 5.097 0.097 18 0 "[ . 1 . 2]" 1
2412 1 127 GLN HA 1 177 GLU HA 3.400 . 3.400 2.631 2.529 2.716 . 0 0 "[ . 1 . 2]" 1
2413 1 159 ILE MD 1 160 SER H 4.960 . 4.960 4.922 4.892 4.960 . 15 0 "[ . 1 . 2]" 1
2414 1 4 ILE MD 1 7 ASN QB 4.380 . 4.380 2.910 2.642 3.287 . 0 0 "[ . 1 . 2]" 1
2415 1 123 LEU H 1 128 ILE QG 4.260 . 4.260 3.536 3.361 3.811 . 0 0 "[ . 1 . 2]" 1
2416 1 74 PHE HZ 1 85 VAL QG 4.050 . 4.050 2.784 2.388 3.261 . 0 0 "[ . 1 . 2]" 1
2417 1 36 TYR HA 1 37 VAL HA 4.450 . 4.450 4.434 4.414 4.460 0.010 5 0 "[ . 1 . 2]" 1
2418 1 92 THR MG 1 122 LEU MD1 2.520 . 2.520 2.575 2.557 2.622 0.102 2 0 "[ . 1 . 2]" 1
2419 1 24 GLU HB3 1 24 GLU QG 2.550 . 2.550 2.345 2.200 2.412 . 0 0 "[ . 1 . 2]" 1
2420 1 104 LEU QD 1 108 LYS H 5.500 . 5.500 4.627 4.419 4.714 . 0 0 "[ . 1 . 2]" 1
2421 1 130 LEU H 1 130 LEU HG 4.530 . 4.530 4.404 4.390 4.433 . 0 0 "[ . 1 . 2]" 1
2422 1 161 HIS HB3 1 174 LEU MD2 4.620 . 4.620 4.275 3.603 4.659 0.039 4 0 "[ . 1 . 2]" 1
2423 1 176 ILE HA 1 176 ILE MG 2.400 . 2.400 2.230 2.217 2.242 . 0 0 "[ . 1 . 2]" 1
2424 1 40 LYS HB2 1 40 LYS QE 3.840 . 3.840 3.404 3.323 3.463 . 0 0 "[ . 1 . 2]" 1
2425 1 130 LEU HB2 1 174 LEU QB 5.450 . 5.450 4.207 4.044 4.436 . 0 0 "[ . 1 . 2]" 1
2426 1 67 LYS HG2 1 68 ALA H 4.500 . 4.500 3.183 3.003 3.287 . 0 0 "[ . 1 . 2]" 1
2427 1 105 GLU HA 1 105 GLU QG 3.120 . 3.120 2.751 2.463 3.041 . 0 0 "[ . 1 . 2]" 1
2428 1 127 GLN H 1 178 LEU MD1 5.000 . 5.000 3.937 3.709 4.155 . 0 0 "[ . 1 . 2]" 1
2429 1 21 VAL MG2 1 22 TRP HE1 5.260 . 5.260 5.015 4.822 5.193 . 0 0 "[ . 1 . 2]" 1
2430 1 77 LEU H 1 77 LEU MD1 5.390 . 5.390 3.516 3.344 3.615 . 0 0 "[ . 1 . 2]" 1
2431 1 5 ILE H 1 5 ILE HB 3.670 . 3.670 2.700 2.653 2.754 . 0 0 "[ . 1 . 2]" 1
2432 1 150 ALA MB 1 157 ILE H 4.000 . 4.000 3.702 3.467 3.864 . 0 0 "[ . 1 . 2]" 1
2433 1 66 VAL MG2 1 141 CYS HB3 3.940 . 3.940 3.742 3.383 3.941 0.001 12 0 "[ . 1 . 2]" 1
2434 1 142 ALA H 1 143 GLU H 4.050 . 4.050 2.745 2.656 2.832 . 0 0 "[ . 1 . 2]" 1
2435 1 148 GLY H 1 150 ALA H 4.710 . 4.710 3.950 3.898 4.003 . 0 0 "[ . 1 . 2]" 1
2436 1 159 ILE MG 1 160 SER H 3.350 . 3.350 2.623 2.540 2.679 . 0 0 "[ . 1 . 2]" 1
2437 1 162 ASP H 1 163 THR H 3.200 . 3.200 2.237 2.163 2.320 . 0 0 "[ . 1 . 2]" 1
2438 1 159 ILE MG 1 175 ILE H 3.410 . 3.410 3.252 3.179 3.309 . 0 0 "[ . 1 . 2]" 1
2439 1 6 PHE H 1 47 LEU MD1 5.250 . 5.250 4.329 4.163 4.454 . 0 0 "[ . 1 . 2]" 1
2440 1 14 VAL MG2 1 19 MET HG3 4.160 . 4.160 3.570 2.282 4.204 0.044 17 0 "[ . 1 . 2]" 1
2441 1 4 ILE HA 1 4 ILE QG 3.650 . 3.650 2.797 2.716 2.887 . 0 0 "[ . 1 . 2]" 1
2442 1 130 LEU H 1 130 LEU HB3 3.770 . 3.770 2.473 2.433 2.490 . 0 0 "[ . 1 . 2]" 1
2443 1 78 ALA MB 1 79 SER HA 4.020 . 4.020 3.827 3.805 3.862 . 0 0 "[ . 1 . 2]" 1
2444 1 22 TRP HH2 1 25 LEU MD1 4.870 . 4.870 4.701 4.632 4.778 . 0 0 "[ . 1 . 2]" 1
2445 1 81 HIS HA 1 82 THR H 3.090 . 3.090 2.908 2.773 2.992 . 0 0 "[ . 1 . 2]" 1
2446 1 143 GLU HG2 1 174 LEU MD2 3.270 . 3.270 2.232 2.172 2.290 . 0 0 "[ . 1 . 2]" 1
2447 1 67 LYS HG3 1 144 GLY H 4.620 . 4.620 3.328 3.015 3.536 . 0 0 "[ . 1 . 2]" 1
2448 1 52 GLN HA 1 62 ILE MG 4.630 . 4.630 4.449 4.437 4.458 . 0 0 "[ . 1 . 2]" 1
2449 1 10 GLU H 1 13 VAL MG1 5.460 . 5.460 4.909 4.849 4.977 . 0 0 "[ . 1 . 2]" 1
2450 1 25 LEU MD1 1 54 VAL HB 4.150 . 4.150 4.230 4.188 4.257 0.107 17 0 "[ . 1 . 2]" 1
2451 1 150 ALA H 1 150 ALA MB 3.130 . 3.130 2.196 2.160 2.223 . 0 0 "[ . 1 . 2]" 1
2452 1 105 GLU H 1 115 LEU MD1 5.500 . 5.500 5.358 5.125 5.537 0.037 5 0 "[ . 1 . 2]" 1
2453 1 164 CYS H 1 169 ALA MB 3.720 . 3.720 2.988 2.897 3.085 . 0 0 "[ . 1 . 2]" 1
2454 1 174 LEU HA 1 175 ILE H 3.220 . 3.220 2.152 2.148 2.156 . 0 0 "[ . 1 . 2]" 1
2455 1 17 CYS H 1 17 CYS HB2 3.400 . 3.400 2.503 2.492 2.522 . 0 0 "[ . 1 . 2]" 1
2456 1 140 PHE HA 1 143 GLU HG3 4.230 . 4.230 3.608 3.081 4.088 . 0 0 "[ . 1 . 2]" 1
2457 1 145 LEU HA 1 148 GLY H 4.400 . 4.400 3.454 3.384 3.595 . 0 0 "[ . 1 . 2]" 1
2458 1 174 LEU H 1 174 LEU MD2 4.570 . 4.570 4.316 4.247 4.347 . 0 0 "[ . 1 . 2]" 1
2459 1 176 ILE H 1 176 ILE QG 3.870 . 3.870 2.783 2.672 2.824 . 0 0 "[ . 1 . 2]" 1
2460 1 83 ASP HA 1 86 ASP H 4.030 . 4.030 3.998 3.933 4.040 0.010 3 0 "[ . 1 . 2]" 1
2461 1 12 MET HG2 1 13 VAL H 5.000 . 5.000 4.654 3.939 4.727 . 0 0 "[ . 1 . 2]" 1
2462 1 51 VAL MG2 1 66 VAL HB 4.100 . 4.100 4.185 4.163 4.202 0.102 18 0 "[ . 1 . 2]" 1
2463 1 22 TRP HZ2 1 50 ILE MD 4.520 . 4.520 3.741 3.673 3.816 . 0 0 "[ . 1 . 2]" 1
2464 1 123 LEU HG 1 129 ALA MB 3.330 . 3.330 3.336 3.105 3.373 0.043 18 0 "[ . 1 . 2]" 1
2465 1 58 LEU MD2 1 60 MET HG3 5.020 . 5.020 4.263 4.233 4.276 . 0 0 "[ . 1 . 2]" 1
2466 1 94 LEU HB2 1 95 VAL H 3.930 . 3.930 3.628 3.284 3.852 . 0 0 "[ . 1 . 2]" 1
2467 1 94 LEU H 1 94 LEU HG 4.420 . 4.420 4.387 4.245 4.455 0.035 7 0 "[ . 1 . 2]" 1
2468 1 143 GLU QB 1 143 GLU HG3 2.640 . 2.640 2.387 2.362 2.415 . 0 0 "[ . 1 . 2]" 1
2469 1 81 HIS HB2 1 84 VAL H 4.910 . 4.910 4.478 2.736 4.919 0.009 12 0 "[ . 1 . 2]" 1
2470 1 143 GLU H 1 144 GLY H 3.970 . 3.970 2.771 2.744 2.798 . 0 0 "[ . 1 . 2]" 1
2471 1 24 GLU H 1 24 GLU HB3 3.440 . 3.440 3.432 3.389 3.463 0.023 12 0 "[ . 1 . 2]" 1
2472 1 95 VAL HB 1 97 GLY H 4.680 . 4.680 4.712 4.607 4.773 0.093 15 0 "[ . 1 . 2]" 1
2473 1 51 VAL H 1 53 ASP H 4.580 . 4.580 4.088 4.061 4.113 . 0 0 "[ . 1 . 2]" 1
2474 1 21 VAL H 1 21 VAL HB 2.940 . 2.940 2.326 2.292 2.368 . 0 0 "[ . 1 . 2]" 1
2475 1 92 THR H 1 94 LEU H 4.620 . 4.620 4.056 3.916 4.138 . 0 0 "[ . 1 . 2]" 1
2476 1 6 PHE H 1 6 PHE HB3 4.050 . 4.050 3.600 3.597 3.603 . 0 0 "[ . 1 . 2]" 1
2477 1 69 PHE H 1 69 PHE QD 4.020 . 4.020 2.348 2.300 2.474 . 0 0 "[ . 1 . 2]" 1
2478 1 155 GLN HA 1 156 LYS QG 3.850 . 3.850 3.853 3.668 3.891 0.041 3 0 "[ . 1 . 2]" 1
2479 1 5 ILE MG 1 47 LEU MD2 3.080 . 3.080 2.356 2.077 2.571 . 0 0 "[ . 1 . 2]" 1
2480 1 40 LYS H 1 40 LYS HG3 3.680 . 3.680 3.308 3.218 3.372 . 0 0 "[ . 1 . 2]" 1
2481 1 169 ALA H 1 170 ASP H 4.840 . 4.840 4.665 4.658 4.672 . 0 0 "[ . 1 . 2]" 1
2482 1 170 ASP H 1 171 HIS HD1 5.500 . 5.500 3.239 2.355 4.549 . 0 0 "[ . 1 . 2]" 1
2483 1 154 GLN HA 1 155 GLN H 3.210 . 3.210 2.788 2.751 2.875 . 0 0 "[ . 1 . 2]" 1
2484 1 122 LEU H 1 122 LEU QB 2.950 . 2.950 2.095 2.048 2.150 . 0 0 "[ . 1 . 2]" 1
2485 1 153 PHE H 1 153 PHE HZ 5.500 . 5.500 5.521 5.463 5.724 0.224 18 0 "[ . 1 . 2]" 1
2486 1 8 VAL H 1 11 ASP H 5.170 . 5.170 5.090 5.033 5.142 . 0 0 "[ . 1 . 2]" 1
2487 1 156 LYS H 1 156 LYS QG . . 3.660 2.127 1.784 2.411 . 0 0 "[ . 1 . 2]" 1
2488 1 8 VAL MG1 1 73 LEU MD1 4.000 . 4.000 2.786 2.681 2.874 . 0 0 "[ . 1 . 2]" 1
2489 1 61 PRO HA 1 62 ILE H 3.000 . 3.000 2.171 2.163 2.177 . 0 0 "[ . 1 . 2]" 1
2490 1 74 PHE H 1 145 LEU HB3 5.240 . 5.240 5.302 5.278 5.324 0.084 8 0 "[ . 1 . 2]" 1
2491 1 74 PHE H 1 74 PHE QB 3.660 . 3.660 2.235 2.213 2.262 . 0 0 "[ . 1 . 2]" 1
2492 1 136 ARG H 1 136 ARG QB 3.750 . 3.750 2.394 2.166 2.593 . 0 0 "[ . 1 . 2]" 1
2493 1 95 VAL MG1 1 130 LEU MD2 3.870 . 3.870 3.707 3.385 3.991 0.121 7 0 "[ . 1 . 2]" 1
2494 1 42 TYR HA 1 42 TYR QD 3.540 . 3.540 2.744 2.607 2.983 . 0 0 "[ . 1 . 2]" 1
2495 1 26 LEU QD 1 29 HIS H 4.740 . 4.740 4.565 4.327 4.720 . 0 0 "[ . 1 . 2]" 1
2496 1 157 ILE H 1 157 ILE MD 4.260 . 4.260 4.060 3.987 4.084 . 0 0 "[ . 1 . 2]" 1
2497 1 10 GLU QG 1 14 VAL H 5.100 . 5.100 4.092 3.999 4.903 . 0 0 "[ . 1 . 2]" 1
2498 1 178 LEU HA 1 178 LEU HG 3.380 . 3.380 2.976 2.960 2.996 . 0 0 "[ . 1 . 2]" 1
2499 1 54 VAL H 1 57 ARG HD3 4.710 . 4.710 4.747 4.740 4.754 0.044 17 0 "[ . 1 . 2]" 1
2500 1 11 ASP H 1 11 ASP HB2 3.380 . 3.380 2.450 2.422 2.499 . 0 0 "[ . 1 . 2]" 1
2501 1 155 GLN HE21 1 178 LEU HA 5.110 . 5.110 4.436 4.265 4.548 . 0 0 "[ . 1 . 2]" 1
2502 1 160 SER H 1 176 ILE MD 5.500 . 5.500 5.559 5.526 5.654 0.154 7 0 "[ . 1 . 2]" 1
2503 1 71 GLN HB3 1 148 GLY H 4.910 . 4.910 4.500 4.272 4.913 0.003 18 0 "[ . 1 . 2]" 1
2504 1 157 ILE MD 1 159 ILE HG12 3.290 . 3.290 3.259 3.228 3.291 0.001 15 0 "[ . 1 . 2]" 1
2505 1 79 SER HA 1 79 SER QB 2.590 . 2.590 2.341 2.178 2.441 . 0 0 "[ . 1 . 2]" 1
2506 1 94 LEU HG 1 102 ILE MD 3.180 . 3.180 2.280 2.065 2.727 . 0 0 "[ . 1 . 2]" 1
2507 1 108 LYS QD 1 108 LYS HG2 2.400 . 2.400 2.359 2.197 2.484 0.084 20 0 "[ . 1 . 2]" 1
2508 1 25 LEU H 1 25 LEU MD1 3.470 . 3.470 2.027 1.967 2.053 . 0 0 "[ . 1 . 2]" 1
2509 1 70 GLY H 1 73 LEU MD2 6.000 . 6.000 5.593 5.552 5.626 . 0 0 "[ . 1 . 2]" 1
2510 1 92 THR MG 1 93 SER H 3.970 . 3.970 3.430 3.311 3.756 . 0 0 "[ . 1 . 2]" 1
2511 1 82 THR H 1 83 ASP HB3 5.230 . 5.230 5.188 5.125 5.236 0.006 8 0 "[ . 1 . 2]" 1
2512 1 132 TYR H 1 132 TYR QD 4.650 . 4.650 4.278 4.021 4.384 . 0 0 "[ . 1 . 2]" 1
2513 1 81 HIS HD1 1 84 VAL QG 3.480 . 3.480 2.763 2.122 3.510 0.030 16 0 "[ . 1 . 2]" 1
2514 1 98 ILE MG 1 99 HIS H 4.070 . 4.070 2.233 2.184 2.369 . 0 0 "[ . 1 . 2]" 1
2515 1 35 VAL HB 1 37 VAL MG2 3.770 . 3.770 3.807 3.459 3.986 0.216 5 0 "[ . 1 . 2]" 1
2516 1 107 ASN H 1 108 LYS H 3.580 . 3.580 2.750 2.588 2.837 . 0 0 "[ . 1 . 2]" 1
2517 1 21 VAL HA 1 24 GLU HB2 3.450 . 3.450 2.346 2.334 2.389 . 0 0 "[ . 1 . 2]" 1
2518 1 84 VAL HA 1 84 VAL QG 2.790 . 2.790 2.067 2.042 2.104 . 0 0 "[ . 1 . 2]" 1
2519 1 3 GLY H 1 36 TYR QD 4.280 . 4.280 3.760 3.292 4.278 . 0 0 "[ . 1 . 2]" 1
2520 1 9 LEU HB3 1 10 GLU H 3.700 . 3.700 2.382 2.367 2.414 . 0 0 "[ . 1 . 2]" 1
2521 1 42 TYR H 1 42 TYR QD 4.240 . 4.240 3.668 2.076 4.249 0.009 7 0 "[ . 1 . 2]" 1
2522 1 156 LYS H 1 157 ILE MG 4.500 . 4.500 4.212 4.123 4.325 . 0 0 "[ . 1 . 2]" 1
2523 1 180 ASN H 1 181 ASP H 3.350 . 3.350 2.505 2.231 2.987 . 0 0 "[ . 1 . 2]" 1
2524 1 26 LEU QD 1 27 GLU H 3.960 . 3.960 3.825 3.756 3.885 . 0 0 "[ . 1 . 2]" 1
2525 1 52 GLN HA 1 62 ILE HG12 4.330 . 4.330 4.160 4.124 4.189 . 0 0 "[ . 1 . 2]" 1
2526 1 157 ILE MG 1 178 LEU HA 3.440 . 3.440 2.298 2.282 2.333 . 0 0 "[ . 1 . 2]" 1
2527 1 119 ASN QB 1 131 ARG QD 3.580 . 3.580 3.246 3.056 3.580 . 0 0 "[ . 1 . 2]" 1
2528 1 98 ILE MG 1 102 ILE MG 4.260 . 4.260 3.132 2.990 3.273 . 0 0 "[ . 1 . 2]" 1
2529 1 47 LEU H 1 47 LEU MD2 4.480 . 4.480 4.339 4.326 4.346 . 0 0 "[ . 1 . 2]" 1
2530 1 123 LEU H 1 123 LEU MD1 3.800 . 3.800 3.649 3.609 3.728 . 0 0 "[ . 1 . 2]" 1
2531 1 4 ILE QG 1 80 ARG QD 4.820 . 4.820 4.651 2.796 4.861 0.041 5 0 "[ . 1 . 2]" 1
2532 1 133 SER HA 1 171 HIS HA 3.300 . 3.300 3.307 3.094 3.349 0.049 5 0 "[ . 1 . 2]" 1
2533 1 75 ASN H 1 145 LEU MD2 4.960 . 4.960 4.649 4.558 4.775 . 0 0 "[ . 1 . 2]" 1
2534 1 14 VAL HA 1 17 CYS H 3.940 . 3.940 3.960 3.893 3.993 0.053 13 0 "[ . 1 . 2]" 1
2535 1 108 LYS H 1 108 LYS QD 3.900 . 3.900 3.918 3.887 3.976 0.076 12 0 "[ . 1 . 2]" 1
2536 1 52 GLN HA 1 65 VAL HB 5.500 . 5.500 4.852 4.802 4.885 . 0 0 "[ . 1 . 2]" 1
2537 1 3 GLY HA3 1 5 ILE H 4.970 . 4.970 4.442 4.241 4.781 . 0 0 "[ . 1 . 2]" 1
2538 1 55 ALA MB 1 56 GLN H 3.100 . 3.100 2.675 2.576 2.698 . 0 0 "[ . 1 . 2]" 1
2539 1 62 ILE HG13 1 63 GLN H 5.070 . 5.070 4.854 4.823 4.882 . 0 0 "[ . 1 . 2]" 1
2540 1 14 VAL MG2 1 19 MET HG2 3.480 . 3.480 3.280 2.291 3.531 0.051 11 0 "[ . 1 . 2]" 1
2541 1 145 LEU HB3 1 147 PHE H 5.500 . 5.500 5.506 5.443 5.552 0.052 18 0 "[ . 1 . 2]" 1
2542 1 40 LYS HB3 1 41 SER H 4.110 . 4.110 2.517 2.058 3.831 . 0 0 "[ . 1 . 2]" 1
2543 1 82 THR H 1 83 ASP H 3.430 . 3.430 2.845 2.804 2.910 . 0 0 "[ . 1 . 2]" 1
2544 1 103 HIS H 1 105 GLU H 4.900 . 4.900 4.239 4.101 4.407 . 0 0 "[ . 1 . 2]" 1
2545 1 157 ILE MG 1 178 LEU HG 3.970 . 3.970 3.998 3.978 4.031 0.061 14 0 "[ . 1 . 2]" 1
2546 1 146 LEU H 1 147 PHE QD 5.340 . 5.340 4.567 4.471 4.646 . 0 0 "[ . 1 . 2]" 1
2547 1 14 VAL MG1 1 15 ALA HA 3.540 . 3.540 3.387 3.353 3.406 . 0 0 "[ . 1 . 2]" 1
2548 1 52 GLN HA 1 62 ILE MD 3.060 . 3.060 2.815 2.785 2.849 . 0 0 "[ . 1 . 2]" 1
2549 1 173 MET H 1 173 MET HG2 4.980 . 4.980 4.406 4.390 4.429 . 0 0 "[ . 1 . 2]" 1
2550 1 128 ILE MG 1 130 LEU H 4.080 . 4.080 4.017 3.863 4.066 . 0 0 "[ . 1 . 2]" 1
2551 1 81 HIS HB3 1 82 THR H 4.680 . 4.680 4.418 4.327 4.684 0.004 8 0 "[ . 1 . 2]" 1
2552 1 37 VAL MG1 1 38 SER H 3.820 . 3.820 2.610 2.318 2.894 . 0 0 "[ . 1 . 2]" 1
2553 1 122 LEU H 1 122 LEU MD2 4.090 . 4.090 4.195 4.140 4.246 0.156 13 0 "[ . 1 . 2]" 1
2554 1 81 HIS HD1 1 84 VAL HB 4.190 . 4.190 3.296 2.003 4.243 0.053 16 0 "[ . 1 . 2]" 1
2555 1 15 ALA H 1 16 GLN HG3 4.750 . 4.750 3.878 3.832 3.933 . 0 0 "[ . 1 . 2]" 1
2556 1 123 LEU H 1 123 LEU MD2 3.200 . 3.200 3.032 2.969 3.231 0.031 19 0 "[ . 1 . 2]" 1
2557 1 97 GLY H 1 98 ILE H 3.380 . 3.380 2.392 2.327 2.481 . 0 0 "[ . 1 . 2]" 1
2558 1 69 PHE H 1 70 GLY H 3.950 . 3.950 2.789 2.765 2.811 . 0 0 "[ . 1 . 2]" 1
2559 1 14 VAL MG2 1 19 MET H 4.110 . 4.110 3.260 2.947 3.553 . 0 0 "[ . 1 . 2]" 1
2560 1 31 PRO HB3 1 33 ASP H 4.670 . 4.670 4.216 3.468 4.656 . 0 0 "[ . 1 . 2]" 1
2561 1 8 VAL MG2 1 76 GLY HA3 3.490 . 3.490 2.818 2.612 3.071 . 0 0 "[ . 1 . 2]" 1
2562 1 92 THR H 1 178 LEU MD2 4.570 . 4.570 4.602 4.578 4.640 0.070 12 0 "[ . 1 . 2]" 1
2563 1 83 ASP H 1 84 VAL QG 4.660 . 4.660 4.149 4.007 4.267 . 0 0 "[ . 1 . 2]" 1
2564 1 79 SER QB 1 80 ARG H 3.840 . 3.840 3.130 2.839 3.644 . 0 0 "[ . 1 . 2]" 1
2565 1 22 TRP HD1 1 23 ASN H 5.000 . 5.000 4.078 3.893 4.286 . 0 0 "[ . 1 . 2]" 1
2566 1 91 PHE H 1 91 PHE QD 3.970 . 3.970 4.075 4.039 4.120 0.150 18 0 "[ . 1 . 2]" 1
2567 1 91 PHE H 1 92 THR H 3.960 . 3.960 2.963 2.750 3.048 . 0 0 "[ . 1 . 2]" 1
2568 1 38 SER H 1 38 SER HB2 3.910 . 3.910 3.590 3.552 3.626 . 0 0 "[ . 1 . 2]" 1
2569 1 159 ILE HA 1 176 ILE MD 5.480 . 5.480 4.987 4.955 5.049 . 0 0 "[ . 1 . 2]" 1
2570 1 161 HIS HD1 1 162 ASP H 4.220 . 4.220 3.602 3.000 4.334 0.114 12 0 "[ . 1 . 2]" 1
2571 1 157 ILE HA 1 158 GLN H 3.280 . 3.280 2.420 2.377 2.453 . 0 0 "[ . 1 . 2]" 1
2572 1 16 GLN HB2 1 17 CYS H 3.450 . 3.450 2.381 2.366 2.407 . 0 0 "[ . 1 . 2]" 1
2573 1 140 PHE QD 1 143 GLU H 5.130 . 5.130 5.022 4.614 5.259 0.129 14 0 "[ . 1 . 2]" 1
2574 1 64 ASP H 1 65 VAL HB 4.630 . 4.630 4.520 4.486 4.553 . 0 0 "[ . 1 . 2]" 1
2575 1 164 CYS HA 1 166 HIS H 4.640 . 4.640 3.592 3.398 3.928 . 0 0 "[ . 1 . 2]" 1
2576 1 19 MET H 1 19 MET HG3 4.350 . 4.350 2.506 1.833 4.335 . 0 0 "[ . 1 . 2]" 1
2577 1 84 VAL QG 1 85 VAL QG 3.250 . 3.250 3.187 3.007 3.250 . 9 0 "[ . 1 . 2]" 1
2578 1 174 LEU MD2 1 175 ILE H 5.000 . 5.000 5.012 4.944 5.045 0.045 20 0 "[ . 1 . 2]" 1
2579 1 123 LEU H 1 123 LEU HG 2.720 . 2.720 1.983 1.939 2.222 . 0 0 "[ . 1 . 2]" 1
2580 1 13 VAL H 1 16 GLN H 5.000 . 5.000 4.914 4.873 4.947 . 0 0 "[ . 1 . 2]" 1
2581 1 4 ILE H 1 4 ILE MG 3.810 . 3.810 2.009 1.899 2.081 . 0 0 "[ . 1 . 2]" 1
2582 1 77 LEU H 1 77 LEU QB 3.760 . 3.760 2.274 2.221 2.347 . 0 0 "[ . 1 . 2]" 1
2583 1 69 PHE HA 1 72 PHE QB 3.370 . 3.370 3.321 3.245 3.406 0.036 15 0 "[ . 1 . 2]" 1
2584 1 15 ALA HA 1 16 GLN H 3.560 . 3.560 3.432 3.427 3.436 . 0 0 "[ . 1 . 2]" 1
2585 1 3 GLY HA2 1 5 ILE QG 5.420 . 5.420 4.728 4.505 5.120 . 0 0 "[ . 1 . 2]" 1
2586 1 106 VAL H 1 106 VAL MG2 3.670 . 3.670 2.193 2.010 2.321 . 0 0 "[ . 1 . 2]" 1
2587 1 94 LEU H 1 94 LEU HB3 3.570 . 3.570 2.551 2.404 2.803 . 0 0 "[ . 1 . 2]" 1
2588 1 25 LEU H 1 27 GLU H 4.390 . 4.390 4.322 4.258 4.406 0.016 16 0 "[ . 1 . 2]" 1
2589 1 16 GLN H 1 16 GLN HB2 3.210 . 3.210 2.471 2.461 2.481 . 0 0 "[ . 1 . 2]" 1
2590 1 155 GLN H 1 155 GLN HE21 5.070 . 5.070 5.102 5.081 5.135 0.065 13 0 "[ . 1 . 2]" 1
2591 1 98 ILE H 1 98 ILE MD 3.840 . 3.840 3.373 3.352 3.399 . 0 0 "[ . 1 . 2]" 1
2592 1 9 LEU H 1 9 LEU HG 4.640 . 4.640 4.379 4.343 4.415 . 0 0 "[ . 1 . 2]" 1
2593 1 115 LEU HA 1 115 LEU MD1 4.180 . 4.180 3.703 2.154 3.867 . 0 0 "[ . 1 . 2]" 1
2594 1 147 PHE H 1 147 PHE QB 3.410 . 3.410 2.323 2.303 2.350 . 0 0 "[ . 1 . 2]" 1
2595 1 71 GLN HG3 1 147 PHE H 4.320 . 4.320 4.318 4.027 4.360 0.040 9 0 "[ . 1 . 2]" 1
2596 1 106 VAL HB 1 115 LEU MD1 4.690 . 4.690 4.366 4.181 4.618 . 0 0 "[ . 1 . 2]" 1
2597 1 131 ARG HG3 1 132 TYR H 4.430 . 4.430 2.967 2.620 3.192 . 0 0 "[ . 1 . 2]" 1
2598 1 35 VAL QG 1 36 TYR H 3.610 . 3.610 3.076 1.849 3.525 . 0 0 "[ . 1 . 2]" 1
2599 1 64 ASP HA 1 67 LYS H 3.850 . 3.850 3.502 3.483 3.524 . 0 0 "[ . 1 . 2]" 1
2600 1 173 MET H 1 174 LEU H 4.920 . 4.920 4.083 3.976 4.136 . 0 0 "[ . 1 . 2]" 1
2601 1 142 ALA MB 1 143 GLU H 3.530 . 3.530 2.606 2.527 2.717 . 0 0 "[ . 1 . 2]" 1
2602 1 18 GLY H 1 19 MET H 4.630 . 4.630 4.461 4.411 4.481 . 0 0 "[ . 1 . 2]" 1
2603 1 90 ASP HA 1 91 PHE H 3.440 . 3.440 2.194 2.161 2.251 . 0 0 "[ . 1 . 2]" 1
2604 1 48 PHE HB2 1 49 SER H 4.050 . 4.050 3.473 2.440 3.756 . 0 0 "[ . 1 . 2]" 1
2605 1 22 TRP HA 1 24 GLU H 4.100 . 4.100 4.243 4.193 4.266 0.166 18 0 "[ . 1 . 2]" 1
2606 1 9 LEU H 1 9 LEU HB2 3.650 . 3.650 2.655 2.601 2.684 . 0 0 "[ . 1 . 2]" 1
2607 1 8 VAL HA 1 12 MET H 5.000 . 5.000 5.048 4.982 5.094 0.094 9 0 "[ . 1 . 2]" 1
2608 1 135 PRO QG 1 136 ARG H 4.550 . 4.550 2.313 1.757 3.937 . 0 0 "[ . 1 . 2]" 1
2609 1 101 VAL MG2 1 105 GLU H 5.260 . 5.260 4.918 4.805 5.019 . 0 0 "[ . 1 . 2]" 1
2610 1 29 HIS H 1 29 HIS HD1 3.900 . 3.900 2.454 2.215 2.678 . 0 0 "[ . 1 . 2]" 1
2611 1 117 HIS QB 1 117 HIS HE1 4.870 . 4.870 4.488 4.375 4.607 . 0 0 "[ . 1 . 2]" 1
2612 1 8 VAL MG2 1 9 LEU H 4.210 . 4.210 3.747 3.665 3.808 . 0 0 "[ . 1 . 2]" 1
2613 1 163 THR H 1 163 THR MG 3.960 . 3.960 3.838 3.809 3.859 . 0 0 "[ . 1 . 2]" 1
2614 1 65 VAL MG2 1 66 VAL H 4.110 . 4.110 3.854 3.829 3.882 . 0 0 "[ . 1 . 2]" 1
2615 1 4 ILE H 1 5 ILE H 4.110 . 4.110 2.482 2.387 2.552 . 0 0 "[ . 1 . 2]" 1
2616 1 167 THR H 1 169 ALA MB 4.400 . 4.400 3.586 3.302 3.741 . 0 0 "[ . 1 . 2]" 1
2617 1 82 THR H 1 85 VAL QG 4.490 . 4.490 4.294 3.501 4.521 0.031 15 0 "[ . 1 . 2]" 1
2618 1 127 GLN HB3 1 128 ILE H 3.860 . 3.860 2.856 2.816 2.937 . 0 0 "[ . 1 . 2]" 1
2619 1 57 ARG HA 1 57 ARG HD2 4.610 . 4.610 4.688 4.677 4.768 0.158 18 0 "[ . 1 . 2]" 1
2620 1 68 ALA H 1 68 ALA MB 2.870 . 2.870 2.217 2.190 2.235 . 0 0 "[ . 1 . 2]" 1
2621 1 59 ASN H 1 59 ASN HB2 3.510 . 3.510 3.098 3.093 3.105 . 0 0 "[ . 1 . 2]" 1
2622 1 74 PHE QD 1 146 LEU H 5.500 . 5.500 5.510 5.393 5.563 0.063 5 0 "[ . 1 . 2]" 1
2623 1 12 MET H 1 12 MET HG3 3.480 . 3.480 2.611 1.806 3.575 0.095 11 0 "[ . 1 . 2]" 1
2624 1 144 GLY H 1 146 LEU H 4.950 . 4.950 4.368 4.325 4.409 . 0 0 "[ . 1 . 2]" 1
2625 1 162 ASP H 1 163 THR HA 4.930 . 4.930 4.970 4.920 5.023 0.093 8 0 "[ . 1 . 2]" 1
2626 1 64 ASP HB3 1 68 ALA H 5.500 . 5.500 5.563 5.542 5.580 0.080 14 0 "[ . 1 . 2]" 1
2627 1 123 LEU H 1 128 ILE MG 4.380 . 4.380 3.992 3.843 4.078 . 0 0 "[ . 1 . 2]" 1
2628 1 7 ASN HA 1 11 ASP H 4.960 . 4.960 4.867 4.782 4.952 . 0 0 "[ . 1 . 2]" 1
2629 1 75 ASN H 1 75 ASN HB3 3.520 . 3.520 3.545 3.532 3.561 0.041 9 0 "[ . 1 . 2]" 1
2630 1 72 PHE QD 1 75 ASN H 4.930 . 4.930 4.761 4.608 4.926 . 0 0 "[ . 1 . 2]" 1
2631 1 54 VAL H 1 54 VAL MG2 3.760 . 3.760 3.684 3.671 3.691 . 0 0 "[ . 1 . 2]" 1
2632 1 179 GLN QB 1 181 ASP H 3.780 . 3.780 2.564 2.468 2.881 . 0 0 "[ . 1 . 2]" 1
2633 1 139 CYS HA 1 143 GLU H 4.880 . 4.880 4.534 4.256 4.789 . 0 0 "[ . 1 . 2]" 1
2634 1 155 GLN H 1 155 GLN QG 3.880 . 3.880 4.021 4.006 4.035 0.155 18 0 "[ . 1 . 2]" 1
2635 1 46 GLU H 1 46 GLU QB 3.790 . 3.790 2.349 2.290 2.443 . 0 0 "[ . 1 . 2]" 1
2636 1 52 GLN QB 1 53 ASP H 3.580 . 3.580 3.423 3.414 3.434 . 0 0 "[ . 1 . 2]" 1
2637 1 66 VAL HA 1 70 GLY H 4.510 . 4.510 4.487 4.425 4.536 0.026 15 0 "[ . 1 . 2]" 1
2638 1 132 TYR H 1 132 TYR QB 3.880 . 3.880 2.642 2.601 2.668 . 0 0 "[ . 1 . 2]" 1
2639 1 15 ALA H 1 15 ALA MB 2.600 . 2.600 2.283 2.267 2.288 . 0 0 "[ . 1 . 2]" 1
2640 1 119 ASN H 1 131 ARG QD 4.610 . 4.610 4.556 4.259 4.652 0.042 20 0 "[ . 1 . 2]" 1
2641 1 72 PHE H 1 72 PHE QB 3.140 . 3.140 2.113 2.059 2.155 . 0 0 "[ . 1 . 2]" 1
2642 1 82 THR HB 1 83 ASP H 3.410 . 3.410 2.784 2.595 3.096 . 0 0 "[ . 1 . 2]" 1
2643 1 163 THR MG 1 170 ASP H 4.500 . 4.500 4.508 4.369 4.555 0.055 9 0 "[ . 1 . 2]" 1
2644 1 104 LEU H 1 115 LEU MD1 5.500 . 5.500 4.711 4.475 4.954 . 0 0 "[ . 1 . 2]" 1
2645 1 5 ILE H 1 5 ILE QG 3.760 . 3.760 1.805 1.751 1.859 . 0 0 "[ . 1 . 2]" 1
2646 1 105 GLU H 1 106 VAL MG1 5.000 . 5.000 3.797 3.657 3.901 . 0 0 "[ . 1 . 2]" 1
2647 1 39 ALA MB 1 40 LYS H 3.570 . 3.570 2.531 2.299 2.739 . 0 0 "[ . 1 . 2]" 1
2648 1 148 GLY HA2 1 152 HIS H 4.300 . 4.300 4.191 3.995 4.415 0.115 18 0 "[ . 1 . 2]" 1
2649 1 143 GLU H 1 143 GLU QB 3.450 . 3.450 2.306 2.287 2.329 . 0 0 "[ . 1 . 2]" 1
2650 1 53 ASP H 1 53 ASP HB2 3.390 . 3.390 2.434 2.415 2.465 . 0 0 "[ . 1 . 2]" 1
2651 1 23 ASN H 1 24 GLU H 3.210 . 3.210 2.463 2.367 2.536 . 0 0 "[ . 1 . 2]" 1
2652 1 49 SER HA 1 53 ASP H 4.170 . 4.170 4.148 4.078 4.191 0.021 10 0 "[ . 1 . 2]" 1
2653 1 104 LEU H 1 105 GLU H 3.720 . 3.720 2.325 2.261 2.409 . 0 0 "[ . 1 . 2]" 1
2654 1 66 VAL H 1 68 ALA H 4.850 . 4.850 4.587 4.558 4.627 . 0 0 "[ . 1 . 2]" 1
2655 1 47 LEU H 1 47 LEU QB 3.780 . 3.780 2.264 2.256 2.273 . 0 0 "[ . 1 . 2]" 1
2656 1 143 GLU H 1 145 LEU HB2 5.460 . 5.460 5.043 4.806 5.278 . 0 0 "[ . 1 . 2]" 1
2657 1 82 THR MG 1 83 ASP H 4.380 . 4.380 3.965 3.822 4.184 . 0 0 "[ . 1 . 2]" 1
2658 1 163 THR HB 1 173 MET H 3.780 . 3.780 2.090 2.010 2.211 . 0 0 "[ . 1 . 2]" 1
2659 1 77 LEU MD2 2 1 HEM HAC 4.700 . 4.700 4.255 2.360 4.803 0.103 8 0 "[ . 1 . 2]" 1
2660 1 12 MET H 1 13 VAL MG2 4.230 . 4.230 3.487 3.456 3.528 . 0 0 "[ . 1 . 2]" 1
2661 1 66 VAL H 1 66 VAL MG2 3.850 . 3.850 3.755 3.751 3.762 . 0 0 "[ . 1 . 2]" 1
2662 1 127 GLN H 1 127 GLN HB3 3.940 . 3.940 3.766 3.724 3.827 . 0 0 "[ . 1 . 2]" 1
2663 1 23 ASN HA 1 24 GLU H 3.530 . 3.530 3.488 3.481 3.492 . 0 0 "[ . 1 . 2]" 1
2664 1 13 VAL HA 1 17 CYS H 4.320 . 4.320 3.740 3.647 3.876 . 0 0 "[ . 1 . 2]" 1
2665 1 73 LEU MD2 1 77 LEU H 5.500 . 5.500 5.331 5.255 5.414 . 0 0 "[ . 1 . 2]" 1
2666 1 53 ASP H 1 53 ASP HB3 3.500 . 3.500 2.699 2.662 2.726 . 0 0 "[ . 1 . 2]" 1
2667 1 181 ASP H 1 181 ASP HA 2.940 . 2.940 2.833 2.751 2.927 . 0 0 "[ . 1 . 2]" 1
2668 1 8 VAL MG1 1 76 GLY HA3 3.560 . 3.560 2.092 2.064 2.208 . 0 0 "[ . 1 . 2]" 1
2669 1 98 ILE H 1 98 ILE MG 4.200 . 4.200 3.753 3.746 3.760 . 0 0 "[ . 1 . 2]" 1
2670 1 163 THR H 1 174 LEU H 6.000 . 6.000 6.051 6.021 6.076 0.076 8 0 "[ . 1 . 2]" 1
2671 1 103 HIS H 1 104 LEU H 4.180 . 4.180 2.435 2.346 2.535 . 0 0 "[ . 1 . 2]" 1
2672 1 160 SER H 1 175 ILE H 4.050 . 4.050 2.764 2.656 2.836 . 0 0 "[ . 1 . 2]" 1
2673 1 95 VAL H 1 95 VAL MG1 3.930 . 3.930 3.774 3.740 3.789 . 0 0 "[ . 1 . 2]" 1
2674 1 60 MET H 1 65 VAL MG2 4.050 . 4.050 4.055 3.998 4.072 0.022 5 0 "[ . 1 . 2]" 1
2675 1 130 LEU H 1 130 LEU HB2 3.840 . 3.840 2.852 2.777 2.975 . 0 0 "[ . 1 . 2]" 1
2676 1 131 ARG HG3 1 172 CYS H 4.970 . 4.970 3.735 3.404 4.052 . 0 0 "[ . 1 . 2]" 1
2677 1 105 GLU H 1 106 VAL H 3.710 . 3.710 2.590 2.432 2.727 . 0 0 "[ . 1 . 2]" 1
2678 1 46 GLU H 1 47 LEU H 4.080 . 4.080 2.644 2.402 2.809 . 0 0 "[ . 1 . 2]" 1
2679 1 172 CYS H 1 172 CYS HB3 4.080 . 4.080 3.784 2.694 3.942 . 0 0 "[ . 1 . 2]" 1
2680 1 155 GLN H 1 156 LYS H 4.120 . 4.120 4.026 3.816 4.182 0.062 10 0 "[ . 1 . 2]" 1
2681 1 69 PHE QD 1 70 GLY H 4.560 . 4.560 4.448 4.429 4.489 . 0 0 "[ . 1 . 2]" 1
2682 1 69 PHE QB 1 70 GLY H 4.020 . 4.020 2.662 2.614 2.708 . 0 0 "[ . 1 . 2]" 1
2683 1 165 MET H 1 166 HIS H 4.210 . 4.210 2.710 2.630 2.779 . 0 0 "[ . 1 . 2]" 1
2684 1 15 ALA H 1 17 CYS H 5.000 . 5.000 4.394 4.361 4.443 . 0 0 "[ . 1 . 2]" 1
2685 1 169 ALA HA 1 170 ASP H 3.200 . 3.200 2.347 2.300 2.380 . 0 0 "[ . 1 . 2]" 1
2686 1 146 LEU H 1 159 ILE MD 4.900 . 4.900 4.318 4.189 4.413 . 0 0 "[ . 1 . 2]" 1
2687 1 47 LEU H 1 47 LEU MD1 4.250 . 4.250 3.970 3.929 4.002 . 0 0 "[ . 1 . 2]" 1
2688 1 143 GLU H 1 143 GLU HG2 3.990 . 3.990 3.708 3.594 3.810 . 0 0 "[ . 1 . 2]" 1
2689 1 82 THR H 1 82 THR HB 3.570 . 3.570 2.929 2.848 3.093 . 0 0 "[ . 1 . 2]" 1
2690 1 109 LEU H 1 109 LEU QB . . 3.720 2.209 2.058 2.456 . 0 0 "[ . 1 . 2]" 1
2691 1 158 GLN H 1 159 ILE H 4.530 . 4.530 4.391 4.369 4.413 . 0 0 "[ . 1 . 2]" 1
2692 1 92 THR H 1 93 SER H 3.680 . 3.680 2.715 2.633 2.770 . 0 0 "[ . 1 . 2]" 1
2693 1 31 PRO HG2 1 32 LYS H 5.000 . 5.000 4.245 3.488 5.042 0.042 18 0 "[ . 1 . 2]" 1
2694 1 176 ILE H 1 176 ILE HB 3.860 . 3.860 2.607 2.592 2.630 . 0 0 "[ . 1 . 2]" 1
2695 1 130 LEU H 1 130 LEU MD2 4.000 . 4.000 4.170 3.989 4.251 0.251 8 0 "[ . 1 . 2]" 1
2696 1 145 LEU H 1 147 PHE H 4.500 . 4.500 4.251 4.191 4.329 . 0 0 "[ . 1 . 2]" 1
2697 1 81 HIS HA 1 84 VAL H 4.350 . 4.350 3.532 3.362 3.727 . 0 0 "[ . 1 . 2]" 1
2698 1 63 GLN HB3 1 64 ASP H 4.040 . 4.040 4.177 4.167 4.187 0.147 14 0 "[ . 1 . 2]" 1
2699 1 159 ILE H 1 159 ILE MD 4.300 . 4.300 4.154 4.083 4.198 . 0 0 "[ . 1 . 2]" 1
2700 1 81 HIS HD1 1 102 ILE MG 4.650 . 4.650 4.517 3.523 4.788 0.138 16 0 "[ . 1 . 2]" 1
2701 1 32 LYS QG 1 34 ARG H 5.500 . 5.500 5.056 3.992 5.564 0.064 6 0 "[ . 1 . 2]" 1
2702 1 10 GLU H 1 10 GLU QB 3.300 . 3.300 2.270 2.218 2.277 . 0 0 "[ . 1 . 2]" 1
2703 1 136 ARG QB 1 137 ARG H 4.440 . 4.440 3.090 2.442 3.752 . 0 0 "[ . 1 . 2]" 1
2704 1 8 VAL MG1 1 9 LEU H 4.070 . 4.070 3.870 3.748 3.954 . 0 0 "[ . 1 . 2]" 1
2705 1 30 ALA H 1 30 ALA MB 2.970 . 2.970 2.491 2.139 2.754 . 0 0 "[ . 1 . 2]" 1
2706 1 24 GLU QG 1 25 LEU H 4.780 . 4.780 4.233 4.211 4.265 . 0 0 "[ . 1 . 2]" 1
2707 1 120 GLY H 1 121 GLN HB2 5.320 . 5.320 5.439 5.406 5.462 0.142 8 0 "[ . 1 . 2]" 1
2708 1 66 VAL H 1 66 VAL MG1 3.150 . 3.150 1.891 1.853 1.982 . 0 0 "[ . 1 . 2]" 1
2709 1 53 ASP H 1 56 GLN H 4.950 . 4.950 4.715 4.700 4.730 . 0 0 "[ . 1 . 2]" 1
2710 1 16 GLN HB3 1 17 CYS H 3.370 . 3.370 3.449 3.439 3.460 0.090 14 0 "[ . 1 . 2]" 1
2711 1 53 ASP H 1 54 VAL H 3.650 . 3.650 2.738 2.722 2.765 . 0 0 "[ . 1 . 2]" 1
2712 1 104 LEU H 1 106 VAL MG2 4.220 . 4.220 3.967 3.913 4.047 . 0 0 "[ . 1 . 2]" 1
2713 1 164 CYS HA 1 167 THR H 4.900 . 4.900 4.696 4.547 4.808 . 0 0 "[ . 1 . 2]" 1
2714 1 120 GLY H 1 121 GLN H 5.000 . 5.000 4.468 4.453 4.486 . 0 0 "[ . 1 . 2]" 1
2715 1 55 ALA H 1 56 GLN H 3.300 . 3.300 2.543 2.533 2.554 . 0 0 "[ . 1 . 2]" 1
2716 1 136 ARG H 1 137 ARG H 4.730 . 4.730 2.633 2.410 2.796 . 0 0 "[ . 1 . 2]" 1
2717 1 82 THR H 1 83 ASP HB2 5.310 . 5.310 5.119 5.030 5.244 . 0 0 "[ . 1 . 2]" 1
2718 1 37 VAL MG1 1 39 ALA H 3.290 . 3.290 1.862 1.788 2.128 . 0 0 "[ . 1 . 2]" 1
2719 1 75 ASN H 1 76 GLY H 3.920 . 3.920 2.921 2.850 2.957 . 0 0 "[ . 1 . 2]" 1
2720 1 15 ALA MB 1 16 GLN H 2.980 . 2.980 3.008 3.003 3.017 0.037 18 0 "[ . 1 . 2]" 1
2721 1 104 LEU QB 1 105 GLU H 3.480 . 3.480 2.839 2.783 2.912 . 0 0 "[ . 1 . 2]" 1
2722 1 127 GLN H 1 128 ILE H 4.640 . 4.640 4.449 4.374 4.488 . 0 0 "[ . 1 . 2]" 1
2723 1 11 ASP H 1 11 ASP HB3 3.480 . 3.480 2.671 2.610 2.700 . 0 0 "[ . 1 . 2]" 1
2724 1 95 VAL MG2 1 97 GLY H 5.100 . 5.100 5.131 5.101 5.154 0.054 11 0 "[ . 1 . 2]" 1
2725 1 5 ILE H 1 5 ILE MG 4.080 . 4.080 3.755 3.743 3.771 . 0 0 "[ . 1 . 2]" 1
2726 1 97 GLY H 1 98 ILE MD 4.560 . 4.560 4.664 4.634 4.701 0.141 3 0 "[ . 1 . 2]" 1
2727 1 59 ASN H 1 60 MET H 3.800 . 3.800 2.814 2.773 2.832 . 0 0 "[ . 1 . 2]" 1
2728 1 14 VAL MG1 1 19 MET H 4.120 . 4.120 3.337 3.184 3.401 . 0 0 "[ . 1 . 2]" 1
2729 1 99 HIS H 1 103 HIS QB 4.340 . 4.340 4.438 4.365 4.500 0.160 18 0 "[ . 1 . 2]" 1
2730 1 161 HIS HD1 1 163 THR H 4.260 . 4.260 3.261 2.474 4.279 0.019 15 0 "[ . 1 . 2]" 1
2731 1 141 CYS H 1 142 ALA H 4.200 . 4.200 2.518 2.473 2.557 . 0 0 "[ . 1 . 2]" 1
2732 1 47 LEU H 1 50 ILE QG 5.180 . 5.180 4.996 4.859 5.082 . 0 0 "[ . 1 . 2]" 1
2733 1 161 HIS H 1 162 ASP H 4.570 . 4.570 3.890 3.773 3.992 . 0 0 "[ . 1 . 2]" 1
2734 1 160 SER H 1 175 ILE HB 4.280 . 4.280 3.178 3.137 3.225 . 0 0 "[ . 1 . 2]" 1
2735 1 52 GLN H 1 52 GLN HG3 4.170 . 4.170 3.149 3.107 3.196 . 0 0 "[ . 1 . 2]" 1
2736 1 11 ASP HB2 1 12 MET H 3.880 . 3.880 3.892 3.869 3.903 0.023 17 0 "[ . 1 . 2]" 1
2737 1 92 THR HB 1 93 SER H 3.300 . 3.300 2.563 2.452 2.669 . 0 0 "[ . 1 . 2]" 1
2738 1 58 LEU H 1 59 ASN H 3.500 . 3.500 2.540 2.520 2.569 . 0 0 "[ . 1 . 2]" 1
2739 1 22 TRP H 1 24 GLU H 3.860 . 3.860 3.883 3.806 3.931 0.071 18 0 "[ . 1 . 2]" 1
2740 1 102 ILE MG 1 105 GLU H 4.980 . 4.980 5.042 4.962 5.084 0.104 11 0 "[ . 1 . 2]" 1
2741 1 21 VAL H 1 22 TRP HB3 5.210 . 5.210 4.796 4.760 4.835 . 0 0 "[ . 1 . 2]" 1
2742 1 56 GLN QB 1 59 ASN H 4.890 . 4.890 4.627 4.615 4.666 . 0 0 "[ . 1 . 2]" 1
2743 1 55 ALA HA 1 59 ASN H 4.640 . 4.640 4.288 4.257 4.337 . 0 0 "[ . 1 . 2]" 1
2744 1 19 MET H 1 19 MET QB 3.410 . 3.410 2.738 2.211 2.924 . 0 0 "[ . 1 . 2]" 1
2745 1 94 LEU QD 1 97 GLY H 4.430 . 4.430 4.030 3.515 4.342 . 0 0 "[ . 1 . 2]" 1
2746 1 26 LEU H 1 27 GLU H 3.320 . 3.320 2.504 2.468 2.584 . 0 0 "[ . 1 . 2]" 1
2747 1 133 SER HB2 1 172 CYS H 5.270 . 5.270 4.381 2.849 4.896 . 0 0 "[ . 1 . 2]" 1
2748 1 162 ASP H 1 173 MET H 4.840 . 4.840 4.629 4.502 4.745 . 0 0 "[ . 1 . 2]" 1
2749 1 74 PHE QB 1 75 ASN H 4.000 . 4.000 2.447 2.362 2.498 . 0 0 "[ . 1 . 2]" 1
2750 1 125 ASN H 1 126 ASN H 5.000 . 5.000 3.353 2.548 4.545 . 0 0 "[ . 1 . 2]" 1
2751 1 51 VAL MG1 1 66 VAL MG1 4.330 . 4.330 3.698 3.684 3.729 . 0 0 "[ . 1 . 2]" 1
2752 1 166 HIS H 1 168 GLY H 5.000 . 5.000 4.365 4.204 4.491 . 0 0 "[ . 1 . 2]" 1
2753 1 74 PHE H 1 75 ASN H 3.840 . 3.840 2.690 2.663 2.717 . 0 0 "[ . 1 . 2]" 1
2754 1 53 ASP H 1 62 ILE MD 5.270 . 5.270 5.200 5.182 5.224 . 0 0 "[ . 1 . 2]" 1
2755 1 84 VAL HA 1 87 LYS QD 3.800 . 3.800 2.194 2.084 2.348 . 0 0 "[ . 1 . 2]" 1
2756 1 77 LEU MD1 2 1 HEM HAC 4.890 . 4.890 4.701 3.671 5.048 0.158 8 0 "[ . 1 . 2]" 1
2757 1 75 ASN H 1 75 ASN HB2 3.480 . 3.480 2.301 2.255 2.378 . 0 0 "[ . 1 . 2]" 1
2758 1 91 PHE HA 1 94 LEU H 3.550 . 3.550 3.521 3.334 3.603 0.053 16 0 "[ . 1 . 2]" 1
2759 1 73 LEU H 1 75 ASN H 4.510 . 4.510 4.326 4.275 4.396 . 0 0 "[ . 1 . 2]" 1
2760 1 158 GLN H 1 158 GLN QG 4.310 . 4.310 3.802 3.213 4.226 . 0 0 "[ . 1 . 2]" 1
2761 1 157 ILE HA 1 179 GLN H 3.610 . 3.610 3.147 2.934 3.298 . 0 0 "[ . 1 . 2]" 1
2762 1 84 VAL HA 1 86 ASP H 4.790 . 4.790 4.819 4.759 4.863 0.073 19 0 "[ . 1 . 2]" 1
2763 1 21 VAL HA 1 24 GLU HB3 3.630 . 3.630 3.719 3.687 3.732 0.102 20 0 "[ . 1 . 2]" 1
2764 1 52 GLN HG2 1 62 ILE MD 4.060 . 4.060 4.074 4.058 4.086 0.026 13 0 "[ . 1 . 2]" 1
2765 1 81 HIS HB3 1 84 VAL QG 4.160 . 4.160 3.070 2.781 3.785 . 0 0 "[ . 1 . 2]" 1
2766 1 8 VAL MG1 1 72 PHE QD 5.000 . 5.000 3.233 2.324 4.462 . 0 0 "[ . 1 . 2]" 1
2767 1 87 LYS H 1 101 VAL MG2 5.500 . 5.500 5.137 4.924 5.362 . 0 0 "[ . 1 . 2]" 1
2768 1 153 PHE H 1 153 PHE QD 3.220 . 3.220 3.192 2.804 3.251 0.031 19 0 "[ . 1 . 2]" 1
2769 1 71 GLN HA 1 74 PHE H 4.040 . 4.040 4.038 3.968 4.077 0.037 5 0 "[ . 1 . 2]" 1
2770 1 165 MET HB2 1 166 HIS H 4.440 . 4.440 4.015 3.077 4.298 . 0 0 "[ . 1 . 2]" 1
2771 1 142 ALA MB 1 145 LEU MD1 3.920 . 3.920 3.477 3.329 3.605 . 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 150
_Distance_constraint_stats_list.Viol_count 757
_Distance_constraint_stats_list.Viol_total 659.173
_Distance_constraint_stats_list.Viol_max 0.157
_Distance_constraint_stats_list.Viol_rms 0.0252
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0110
_Distance_constraint_stats_list.Viol_average_violations_only 0.0435
_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 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 PHE 1.434 0.081 6 0 "[ . 1 . 2]"
1 7 ASN 0.618 0.088 8 0 "[ . 1 . 2]"
1 8 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 GLU 1.434 0.081 6 0 "[ . 1 . 2]"
1 11 ASP 1.685 0.092 20 0 "[ . 1 . 2]"
1 12 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 ALA 1.067 0.092 20 0 "[ . 1 . 2]"
1 20 SER 0.033 0.011 7 0 "[ . 1 . 2]"
1 21 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 GLU 0.033 0.011 7 0 "[ . 1 . 2]"
1 25 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 GLU 1.086 0.069 16 0 "[ . 1 . 2]"
1 47 LEU 0.949 0.068 3 0 "[ . 1 . 2]"
1 48 PHE 0.001 0.001 13 0 "[ . 1 . 2]"
1 49 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 ILE 1.196 0.069 16 0 "[ . 1 . 2]"
1 51 VAL 0.949 0.068 3 0 "[ . 1 . 2]"
1 52 GLN 0.001 0.001 13 0 "[ . 1 . 2]"
1 53 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 VAL 0.121 0.016 16 0 "[ . 1 . 2]"
1 55 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 LEU 0.012 0.003 4 0 "[ . 1 . 2]"
1 61 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 ILE 0.101 0.019 20 0 "[ . 1 . 2]"
1 63 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 ASP 0.799 0.050 18 0 "[ . 1 . 2]"
1 65 VAL 0.833 0.056 20 0 "[ . 1 . 2]"
1 66 VAL 0.101 0.019 20 0 "[ . 1 . 2]"
1 67 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 ALA 0.799 0.050 18 0 "[ . 1 . 2]"
1 69 PHE 1.828 0.056 20 0 "[ . 1 . 2]"
1 70 GLY 0.069 0.043 18 0 "[ . 1 . 2]"
1 71 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 LEU 1.456 0.054 18 0 "[ . 1 . 2]"
1 74 PHE 0.770 0.078 6 0 "[ . 1 . 2]"
1 75 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 LEU 0.460 0.047 8 0 "[ . 1 . 2]"
1 78 ALA 0.701 0.078 6 0 "[ . 1 . 2]"
1 90 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 THR 0.415 0.051 16 0 "[ . 1 . 2]"
1 93 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 LEU 2.550 0.153 8 0 "[ . 1 . 2]"
1 95 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 MET 0.415 0.051 16 0 "[ . 1 . 2]"
1 97 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 ILE 4.057 0.153 8 0 "[ . 1 . 2]"
1 99 HIS 1.939 0.130 5 0 "[ . 1 . 2]"
1 100 ASP 0.216 0.069 5 0 "[ . 1 . 2]"
1 101 VAL 0.050 0.017 13 0 "[ . 1 . 2]"
1 102 ILE 1.597 0.112 3 0 "[ . 1 . 2]"
1 103 HIS 2.164 0.130 5 0 "[ . 1 . 2]"
1 104 LEU 0.874 0.070 18 0 "[ . 1 . 2]"
1 105 GLU 0.050 0.017 13 0 "[ . 1 . 2]"
1 106 VAL 0.090 0.047 20 0 "[ . 1 . 2]"
1 107 ASN 0.224 0.043 12 0 "[ . 1 . 2]"
1 108 LYS 0.658 0.070 18 0 "[ . 1 . 2]"
1 109 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 117 HIS 0.053 0.034 8 0 "[ . 1 . 2]"
1 119 ASN 0.708 0.081 17 0 "[ . 1 . 2]"
1 121 GLN 3.620 0.116 13 0 "[ . 1 . 2]"
1 123 LEU 0.683 0.051 8 0 "[ . 1 . 2]"
1 124 PRO 0.511 0.093 6 0 "[ . 1 . 2]"
1 126 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 127 GLN 1.194 0.093 6 0 "[ . 1 . 2]"
1 128 ILE 2.456 0.098 1 0 "[ . 1 . 2]"
1 129 ALA 3.620 0.116 13 0 "[ . 1 . 2]"
1 130 LEU 3.527 0.124 14 0 "[ . 1 . 2]"
1 131 ARG 0.708 0.081 17 0 "[ . 1 . 2]"
1 132 TYR 0.800 0.157 3 0 "[ . 1 . 2]"
1 133 SER 0.053 0.034 8 0 "[ . 1 . 2]"
1 138 LEU 0.866 0.121 7 0 "[ . 1 . 2]"
1 139 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 140 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 141 CYS 0.054 0.040 17 0 "[ . 1 . 2]"
1 142 ALA 0.866 0.121 7 0 "[ . 1 . 2]"
1 143 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 144 GLY 0.874 0.047 5 0 "[ . 1 . 2]"
1 145 LEU 0.054 0.040 17 0 "[ . 1 . 2]"
1 146 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 147 PHE 0.145 0.033 6 0 "[ . 1 . 2]"
1 148 GLY 0.874 0.047 5 0 "[ . 1 . 2]"
1 149 ALA 0.764 0.108 15 0 "[ . 1 . 2]"
1 150 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 151 GLN 0.145 0.033 6 0 "[ . 1 . 2]"
1 152 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 153 PHE 0.764 0.108 15 0 "[ . 1 . 2]"
1 158 GLN 0.956 0.051 16 0 "[ . 1 . 2]"
1 160 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 163 THR 0.024 0.016 14 0 "[ . 1 . 2]"
1 172 CYS 0.800 0.157 3 0 "[ . 1 . 2]"
1 173 MET 0.024 0.016 14 0 "[ . 1 . 2]"
1 174 LEU 3.527 0.124 14 0 "[ . 1 . 2]"
1 175 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 176 ILE 2.456 0.098 1 0 "[ . 1 . 2]"
1 177 GLU 0.956 0.051 16 0 "[ . 1 . 2]"
1 178 LEU 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 4 ILE O 1 8 VAL H 2.300 . 2.800 2.271 2.093 2.481 . 0 0 "[ . 1 . 2]" 2
2 1 4 ILE O 1 8 VAL N 3.300 2.900 3.800 3.212 3.039 3.416 . 0 0 "[ . 1 . 2]" 2
3 1 5 ILE O 1 9 LEU H 2.300 . 2.800 2.276 2.177 2.374 . 0 0 "[ . 1 . 2]" 2
4 1 5 ILE O 1 9 LEU N 3.300 2.900 3.800 3.140 3.043 3.230 . 0 0 "[ . 1 . 2]" 2
5 1 6 PHE O 1 10 GLU H 2.300 . 2.800 1.931 1.919 1.954 0.081 6 0 "[ . 1 . 2]" 2
6 1 6 PHE O 1 10 GLU N 3.300 2.900 3.800 2.902 2.889 2.927 0.011 12 0 "[ . 1 . 2]" 2
7 1 7 ASN O 1 11 ASP H 2.300 . 2.800 2.831 2.806 2.888 0.088 8 0 "[ . 1 . 2]" 2
8 1 7 ASN O 1 11 ASP N 3.300 2.900 3.800 3.641 3.616 3.728 . 0 0 "[ . 1 . 2]" 2
9 1 8 VAL O 1 12 MET H 2.300 . 2.800 2.758 2.681 2.799 . 0 0 "[ . 1 . 2]" 2
10 1 8 VAL O 1 12 MET N 3.300 2.900 3.800 3.507 3.423 3.563 . 0 0 "[ . 1 . 2]" 2
11 1 9 LEU O 1 13 VAL H 2.300 . 2.800 2.255 2.203 2.312 . 0 0 "[ . 1 . 2]" 2
12 1 9 LEU O 1 13 VAL N 3.300 2.900 3.800 3.171 3.115 3.225 . 0 0 "[ . 1 . 2]" 2
13 1 10 GLU O 1 14 VAL H 2.300 . 2.800 2.237 2.181 2.427 . 0 0 "[ . 1 . 2]" 2
14 1 10 GLU O 1 14 VAL N 3.300 2.900 3.800 3.152 3.099 3.328 . 0 0 "[ . 1 . 2]" 2
15 1 11 ASP O 1 15 ALA H 2.300 . 2.800 2.853 2.827 2.892 0.092 20 0 "[ . 1 . 2]" 2
16 1 11 ASP O 1 15 ALA N 3.300 2.900 3.800 3.559 3.513 3.618 . 0 0 "[ . 1 . 2]" 2
17 1 20 SER O 1 24 GLU H 2.300 . 2.800 2.112 2.074 2.160 . 0 0 "[ . 1 . 2]" 2
18 1 20 SER O 1 24 GLU N 3.300 2.900 3.800 2.912 2.889 2.953 0.011 7 0 "[ . 1 . 2]" 2
19 1 21 VAL O 1 25 LEU H 2.300 . 2.800 2.219 2.187 2.260 . 0 0 "[ . 1 . 2]" 2
20 1 21 VAL O 1 25 LEU N 3.300 2.900 3.800 3.173 3.148 3.201 . 0 0 "[ . 1 . 2]" 2
21 1 22 TRP O 1 26 LEU H 2.300 . 2.800 2.463 2.178 2.691 . 0 0 "[ . 1 . 2]" 2
22 1 22 TRP O 1 26 LEU N 3.300 2.900 3.800 3.186 2.975 3.404 . 0 0 "[ . 1 . 2]" 2
23 1 23 ASN O 1 27 GLU H 2.300 . 2.800 2.231 2.160 2.301 . 0 0 "[ . 1 . 2]" 2
24 1 23 ASN O 1 27 GLU N 3.300 2.900 3.800 3.087 3.040 3.178 . 0 0 "[ . 1 . 2]" 2
25 1 46 GLU O 1 50 ILE H 2.300 . 2.800 1.991 1.972 2.016 0.028 16 0 "[ . 1 . 2]" 2
26 1 46 GLU O 1 50 ILE N 3.300 2.900 3.800 2.856 2.831 2.872 0.069 16 0 "[ . 1 . 2]" 2
27 1 47 LEU O 1 51 VAL H 2.300 . 2.800 2.023 1.999 2.099 0.001 16 0 "[ . 1 . 2]" 2
28 1 47 LEU O 1 51 VAL N 3.300 2.900 3.800 2.853 2.832 2.867 0.068 3 0 "[ . 1 . 2]" 2
29 1 48 PHE O 1 52 GLN H 2.300 . 2.800 2.048 1.999 2.137 0.001 13 0 "[ . 1 . 2]" 2
30 1 48 PHE O 1 52 GLN N 3.300 2.900 3.800 2.991 2.942 3.074 . 0 0 "[ . 1 . 2]" 2
31 1 49 SER O 1 53 ASP H 2.300 . 2.800 2.263 2.210 2.294 . 0 0 "[ . 1 . 2]" 2
32 1 49 SER O 1 53 ASP N 3.300 2.900 3.800 3.165 3.114 3.211 . 0 0 "[ . 1 . 2]" 2
33 1 50 ILE O 1 54 VAL H 2.300 . 2.800 2.028 1.984 2.149 0.016 16 0 "[ . 1 . 2]" 2
34 1 50 ILE O 1 54 VAL N 3.300 2.900 3.800 2.931 2.888 3.043 0.012 11 0 "[ . 1 . 2]" 2
35 1 51 VAL O 1 55 ALA H 2.300 . 2.800 2.624 2.573 2.655 . 0 0 "[ . 1 . 2]" 2
36 1 51 VAL O 1 55 ALA N 3.300 2.900 3.800 3.392 3.348 3.423 . 0 0 "[ . 1 . 2]" 2
37 1 52 GLN O 1 56 GLN H 2.300 . 2.800 2.553 2.412 2.580 . 0 0 "[ . 1 . 2]" 2
38 1 52 GLN O 1 56 GLN N 3.300 2.900 3.800 3.300 3.220 3.319 . 0 0 "[ . 1 . 2]" 2
39 1 53 ASP O 1 57 ARG H 2.300 . 2.800 2.292 2.265 2.308 . 0 0 "[ . 1 . 2]" 2
40 1 53 ASP O 1 57 ARG N 3.300 2.900 3.800 3.210 3.194 3.224 . 0 0 "[ . 1 . 2]" 2
41 1 54 VAL O 1 58 LEU H 2.300 . 2.800 2.004 1.997 2.022 0.003 4 0 "[ . 1 . 2]" 2
42 1 54 VAL O 1 58 LEU N 3.300 2.900 3.800 2.915 2.910 2.932 . 0 0 "[ . 1 . 2]" 2
43 1 61 PRO O 1 65 VAL H 2.300 . 2.800 2.100 2.079 2.122 . 0 0 "[ . 1 . 2]" 2
44 1 61 PRO O 1 65 VAL N 3.300 2.900 3.800 3.043 3.021 3.067 . 0 0 "[ . 1 . 2]" 2
45 1 62 ILE O 1 66 VAL H 2.300 . 2.800 1.998 1.981 2.019 0.019 20 0 "[ . 1 . 2]" 2
46 1 62 ILE O 1 66 VAL N 3.300 2.900 3.800 2.961 2.939 2.983 . 0 0 "[ . 1 . 2]" 2
47 1 63 GLN O 1 67 LYS H 2.300 . 2.800 2.644 2.626 2.684 . 0 0 "[ . 1 . 2]" 2
48 1 63 GLN O 1 67 LYS N 3.300 2.900 3.800 3.508 3.480 3.565 . 0 0 "[ . 1 . 2]" 2
49 1 64 ASP O 1 68 ALA H 2.300 . 2.800 1.960 1.950 1.970 0.050 18 0 "[ . 1 . 2]" 2
50 1 64 ASP O 1 68 ALA N 3.300 2.900 3.800 2.935 2.925 2.947 . 0 0 "[ . 1 . 2]" 2
51 1 65 VAL O 1 69 PHE H 2.300 . 2.800 1.979 1.960 1.989 0.040 12 0 "[ . 1 . 2]" 2
52 1 65 VAL O 1 69 PHE N 3.300 2.900 3.800 2.879 2.844 2.895 0.056 20 0 "[ . 1 . 2]" 2
53 1 66 VAL O 1 70 GLY H 2.300 . 2.800 2.407 2.341 2.471 . 0 0 "[ . 1 . 2]" 2
54 1 66 VAL O 1 70 GLY N 3.300 2.900 3.800 3.274 3.235 3.339 . 0 0 "[ . 1 . 2]" 2
55 1 68 ALA O 1 72 PHE H 2.300 . 2.800 2.285 2.241 2.358 . 0 0 "[ . 1 . 2]" 2
56 1 68 ALA O 1 72 PHE N 3.300 2.900 3.800 3.242 3.197 3.316 . 0 0 "[ . 1 . 2]" 2
57 1 69 PHE O 1 73 LEU H 2.300 . 2.800 1.969 1.946 2.017 0.054 18 0 "[ . 1 . 2]" 2
58 1 69 PHE O 1 73 LEU N 3.300 2.900 3.800 2.892 2.850 2.963 0.050 18 0 "[ . 1 . 2]" 2
59 1 70 GLY O 1 74 PHE H 2.300 . 2.800 2.163 1.957 2.466 0.043 18 0 "[ . 1 . 2]" 2
60 1 70 GLY O 1 74 PHE N 3.300 2.900 3.800 3.102 2.894 3.405 0.006 18 0 "[ . 1 . 2]" 2
61 1 71 GLN O 1 75 ASN H 2.300 . 2.800 2.658 2.602 2.724 . 0 0 "[ . 1 . 2]" 2
62 1 71 GLN O 1 75 ASN N 3.300 2.900 3.800 3.584 3.518 3.644 . 0 0 "[ . 1 . 2]" 2
63 1 73 LEU O 1 77 LEU H 2.300 . 2.800 1.983 1.953 2.042 0.047 8 0 "[ . 1 . 2]" 2
64 1 73 LEU O 1 77 LEU N 3.300 2.900 3.800 2.917 2.872 2.969 0.028 8 0 "[ . 1 . 2]" 2
65 1 74 PHE O 1 78 ALA H 2.300 . 2.800 1.989 1.922 2.124 0.078 6 0 "[ . 1 . 2]" 2
66 1 74 PHE O 1 78 ALA N 3.300 2.900 3.800 2.962 2.891 3.101 0.009 3 0 "[ . 1 . 2]" 2
67 1 90 ASP O 1 94 LEU H 2.300 . 2.800 2.435 2.173 2.542 . 0 0 "[ . 1 . 2]" 2
68 1 90 ASP O 1 94 LEU N 3.300 2.900 3.800 3.296 2.989 3.433 . 0 0 "[ . 1 . 2]" 2
69 1 91 PHE O 1 95 VAL H 2.300 . 2.800 2.239 2.166 2.314 . 0 0 "[ . 1 . 2]" 2
70 1 91 PHE O 1 95 VAL N 3.300 2.900 3.800 3.188 3.082 3.256 . 0 0 "[ . 1 . 2]" 2
71 1 92 THR O 1 96 MET H 2.300 . 2.800 2.762 2.456 2.851 0.051 16 0 "[ . 1 . 2]" 2
72 1 92 THR O 1 96 MET N 3.300 2.900 3.800 3.721 3.405 3.830 0.030 16 0 "[ . 1 . 2]" 2
73 1 93 SER O 1 97 GLY H 2.300 . 2.800 2.645 2.476 2.790 . 0 0 "[ . 1 . 2]" 2
74 1 93 SER O 1 97 GLY N 3.300 2.900 3.800 3.215 3.064 3.327 . 0 0 "[ . 1 . 2]" 2
75 1 94 LEU O 1 98 ILE H 2.300 . 2.800 2.226 2.106 2.369 . 0 0 "[ . 1 . 2]" 2
76 1 94 LEU O 1 98 ILE N 3.300 2.900 3.800 2.772 2.747 2.812 0.153 8 0 "[ . 1 . 2]" 2
77 1 98 ILE O 1 102 ILE H 2.300 . 2.800 2.875 2.840 2.912 0.112 3 0 "[ . 1 . 2]" 2
78 1 98 ILE O 1 102 ILE N 3.300 2.900 3.800 3.273 3.238 3.325 . 0 0 "[ . 1 . 2]" 2
79 1 99 HIS O 1 103 HIS H 2.300 . 2.800 2.897 2.855 2.930 0.130 5 0 "[ . 1 . 2]" 2
80 1 99 HIS O 1 103 HIS N 3.300 2.900 3.800 3.604 3.555 3.660 . 0 0 "[ . 1 . 2]" 2
81 1 100 ASP O 1 104 LEU H 2.300 . 2.800 2.791 2.687 2.869 0.069 5 0 "[ . 1 . 2]" 2
82 1 100 ASP O 1 104 LEU N 3.300 2.900 3.800 3.355 3.292 3.409 . 0 0 "[ . 1 . 2]" 2
83 1 101 VAL O 1 105 GLU H 2.300 . 2.800 2.074 1.983 2.206 0.017 13 0 "[ . 1 . 2]" 2
84 1 101 VAL O 1 105 GLU N 3.300 2.900 3.800 2.974 2.887 3.066 0.013 6 0 "[ . 1 . 2]" 2
85 1 102 ILE O 1 106 VAL H 2.300 . 2.800 2.737 2.633 2.847 0.047 20 0 "[ . 1 . 2]" 2
86 1 102 ILE O 1 106 VAL N 3.300 2.900 3.800 3.675 3.575 3.754 . 0 0 "[ . 1 . 2]" 2
87 1 103 HIS O 1 107 ASN H 2.300 . 2.800 2.801 2.698 2.843 0.043 12 0 "[ . 1 . 2]" 2
88 1 103 HIS O 1 107 ASN N 3.300 2.900 3.800 3.611 3.523 3.683 . 0 0 "[ . 1 . 2]" 2
89 1 104 LEU O 1 108 LYS H 2.300 . 2.800 2.791 2.506 2.870 0.070 18 0 "[ . 1 . 2]" 2
90 1 104 LEU O 1 108 LYS N 3.300 2.900 3.800 3.669 3.460 3.744 . 0 0 "[ . 1 . 2]" 2
91 1 105 GLU O 1 109 LEU H 2.300 . 2.800 2.311 2.036 2.657 . 0 0 "[ . 1 . 2]" 2
92 1 105 GLU O 1 109 LEU N 3.300 2.900 3.800 3.169 2.923 3.449 . 0 0 "[ . 1 . 2]" 2
93 1 123 LEU H 1 127 GLN O 2.300 . 2.800 2.005 1.967 2.174 0.033 15 0 "[ . 1 . 2]" 2
94 1 123 LEU N 1 127 GLN O 3.300 2.900 3.800 2.892 2.849 3.060 0.051 8 0 "[ . 1 . 2]" 2
95 1 124 PRO O 1 127 GLN H 2.300 . 2.800 2.787 2.413 2.893 0.093 6 0 "[ . 1 . 2]" 2
96 1 124 PRO O 1 127 GLN N 3.300 2.900 3.800 3.516 3.318 3.789 . 0 0 "[ . 1 . 2]" 2
97 1 128 ILE H 1 176 ILE O 2.300 . 2.800 2.191 2.027 2.321 . 0 0 "[ . 1 . 2]" 2
98 1 128 ILE N 1 176 ILE O 3.300 2.900 3.800 3.098 2.978 3.194 . 0 0 "[ . 1 . 2]" 2
99 1 121 GLN O 1 129 ALA H 2.300 . 2.800 1.905 1.884 1.941 0.116 13 0 "[ . 1 . 2]" 2
100 1 121 GLN O 1 129 ALA N 3.300 2.900 3.800 2.814 2.795 2.852 0.105 18 0 "[ . 1 . 2]" 2
101 1 130 LEU H 1 174 LEU O 2.300 . 2.800 1.907 1.876 1.933 0.124 14 0 "[ . 1 . 2]" 2
102 1 130 LEU N 1 174 LEU O 3.300 2.900 3.800 2.817 2.782 2.834 0.118 7 0 "[ . 1 . 2]" 2
103 1 119 ASN O 1 131 ARG H 2.300 . 2.800 1.982 1.919 2.087 0.081 17 0 "[ . 1 . 2]" 2
104 1 119 ASN O 1 131 ARG N 3.300 2.900 3.800 2.952 2.877 3.067 0.023 15 0 "[ . 1 . 2]" 2
105 1 132 TYR H 1 172 CYS O 2.300 . 2.800 2.431 2.279 2.556 . 0 0 "[ . 1 . 2]" 2
106 1 132 TYR N 1 172 CYS O 3.300 2.900 3.800 3.398 3.248 3.523 . 0 0 "[ . 1 . 2]" 2
107 1 117 HIS O 1 133 SER H 2.300 . 2.800 2.425 2.102 2.834 0.034 8 0 "[ . 1 . 2]" 2
108 1 117 HIS O 1 133 SER N 3.300 2.900 3.800 3.229 2.902 3.530 . 0 0 "[ . 1 . 2]" 2
109 1 138 LEU O 1 142 ALA H 2.300 . 2.800 2.814 2.570 2.921 0.121 7 0 "[ . 1 . 2]" 2
110 1 138 LEU O 1 142 ALA N 3.300 2.900 3.800 3.701 3.443 3.854 0.054 7 0 "[ . 1 . 2]" 2
111 1 139 CYS O 1 143 GLU H 2.300 . 2.800 2.240 2.045 2.421 . 0 0 "[ . 1 . 2]" 2
112 1 139 CYS O 1 143 GLU N 3.300 2.900 3.800 3.131 2.955 3.278 . 0 0 "[ . 1 . 2]" 2
113 1 140 PHE O 1 144 GLY H 2.300 . 2.800 2.582 2.293 2.756 . 0 0 "[ . 1 . 2]" 2
114 1 140 PHE O 1 144 GLY N 3.300 2.900 3.800 3.541 3.271 3.694 . 0 0 "[ . 1 . 2]" 2
115 1 141 CYS O 1 145 LEU H 2.300 . 2.800 2.158 1.960 2.505 0.040 17 0 "[ . 1 . 2]" 2
116 1 141 CYS O 1 145 LEU N 3.300 2.900 3.800 3.098 2.897 3.448 0.003 17 0 "[ . 1 . 2]" 2
117 1 142 ALA O 1 146 LEU H 2.300 . 2.800 2.209 2.064 2.406 . 0 0 "[ . 1 . 2]" 2
118 1 142 ALA O 1 146 LEU N 3.300 2.900 3.800 3.143 2.996 3.333 . 0 0 "[ . 1 . 2]" 2
119 1 143 GLU O 1 147 PHE H 2.300 . 2.800 2.250 2.165 2.375 . 0 0 "[ . 1 . 2]" 2
120 1 143 GLU O 1 147 PHE N 3.300 2.900 3.800 3.166 3.086 3.273 . 0 0 "[ . 1 . 2]" 2
121 1 144 GLY O 1 148 GLY H 2.300 . 2.800 1.983 1.953 2.088 0.047 5 0 "[ . 1 . 2]" 2
122 1 144 GLY O 1 148 GLY N 3.300 2.900 3.800 2.882 2.864 2.978 0.036 7 0 "[ . 1 . 2]" 2
123 1 145 LEU O 1 149 ALA H 2.300 . 2.800 2.313 2.186 2.557 . 0 0 "[ . 1 . 2]" 2
124 1 145 LEU O 1 149 ALA N 3.300 2.900 3.800 3.233 3.130 3.440 . 0 0 "[ . 1 . 2]" 2
125 1 146 LEU O 1 150 ALA H 2.300 . 2.800 2.335 2.199 2.465 . 0 0 "[ . 1 . 2]" 2
126 1 146 LEU O 1 150 ALA N 3.300 2.900 3.800 3.160 3.078 3.243 . 0 0 "[ . 1 . 2]" 2
127 1 147 PHE O 1 151 GLN H 2.300 . 2.800 2.022 1.967 2.154 0.033 6 0 "[ . 1 . 2]" 2
128 1 147 PHE O 1 151 GLN N 3.300 2.900 3.800 2.993 2.941 3.084 . 0 0 "[ . 1 . 2]" 2
129 1 148 GLY O 1 152 HIS H 2.300 . 2.800 2.308 2.100 2.526 . 0 0 "[ . 1 . 2]" 2
130 1 148 GLY O 1 152 HIS N 3.300 2.900 3.800 3.241 3.040 3.458 . 0 0 "[ . 1 . 2]" 2
131 1 149 ALA O 1 153 PHE H 2.300 . 2.800 2.834 2.743 2.908 0.108 15 0 "[ . 1 . 2]" 2
132 1 149 ALA O 1 153 PHE N 3.300 2.900 3.800 3.558 3.491 3.656 . 0 0 "[ . 1 . 2]" 2
133 1 158 GLN H 1 177 GLU O 2.300 . 2.800 2.250 2.161 2.339 . 0 0 "[ . 1 . 2]" 2
134 1 158 GLN N 1 177 GLU O 3.300 2.900 3.800 3.187 3.091 3.263 . 0 0 "[ . 1 . 2]" 2
135 1 160 SER H 1 175 ILE O 2.300 . 2.800 2.089 2.036 2.155 . 0 0 "[ . 1 . 2]" 2
136 1 160 SER N 1 175 ILE O 3.300 2.900 3.800 3.027 2.981 3.079 . 0 0 "[ . 1 . 2]" 2
137 1 132 TYR O 1 172 CYS H 2.300 . 2.800 2.214 1.993 2.365 0.007 9 0 "[ . 1 . 2]" 2
138 1 132 TYR O 1 172 CYS N 3.300 2.900 3.800 2.861 2.743 2.916 0.157 3 0 "[ . 1 . 2]" 2
139 1 163 THR O 1 173 MET H 2.300 . 2.800 2.071 1.984 2.294 0.016 14 0 "[ . 1 . 2]" 2
140 1 163 THR O 1 173 MET N 3.300 2.900 3.800 2.987 2.912 3.190 . 0 0 "[ . 1 . 2]" 2
141 1 130 LEU O 1 174 LEU H 2.300 . 2.800 2.105 2.016 2.231 . 0 0 "[ . 1 . 2]" 2
142 1 130 LEU O 1 174 LEU N 3.300 2.900 3.800 2.992 2.925 3.105 . 0 0 "[ . 1 . 2]" 2
143 1 160 SER O 1 175 ILE H 2.300 . 2.800 2.264 2.096 2.435 . 0 0 "[ . 1 . 2]" 2
144 1 160 SER O 1 175 ILE N 3.300 2.900 3.800 3.229 3.063 3.392 . 0 0 "[ . 1 . 2]" 2
145 1 128 ILE O 1 176 ILE H 2.300 . 2.800 1.914 1.902 1.933 0.098 1 0 "[ . 1 . 2]" 2
146 1 128 ILE O 1 176 ILE N 3.300 2.900 3.800 2.863 2.837 2.885 0.063 16 0 "[ . 1 . 2]" 2
147 1 158 GLN O 1 177 GLU H 2.300 . 2.800 1.981 1.961 2.001 0.039 5 0 "[ . 1 . 2]" 2
148 1 158 GLN O 1 177 GLU N 3.300 2.900 3.800 2.873 2.849 2.911 0.051 16 0 "[ . 1 . 2]" 2
149 1 126 ASN O 1 178 LEU H 2.300 . 2.800 2.185 2.026 2.272 . 0 0 "[ . 1 . 2]" 2
150 1 126 ASN O 1 178 LEU N 3.300 2.900 3.800 3.070 2.935 3.148 . 0 0 "[ . 1 . 2]" 2
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