NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
648098 |
6ocv   |
27284 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6ocv
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 3247
_Distance_constraint_stats_list.Viol_count 8754
_Distance_constraint_stats_list.Viol_total 22692.789
_Distance_constraint_stats_list.Viol_max 0.468
_Distance_constraint_stats_list.Viol_rms 0.0571
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0175
_Distance_constraint_stats_list.Viol_average_violations_only 0.1296
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 7.052 0.365 7 0 "[ . 1 . 2]"
1 2 MET 9.037 0.344 16 0 "[ . 1 . 2]"
1 3 GLY 16.950 0.288 8 0 "[ . 1 . 2]"
1 4 MET 17.354 0.400 20 0 "[ . 1 . 2]"
1 5 VAL 6.145 0.392 18 0 "[ . 1 . 2]"
1 6 PHE 4.290 0.240 8 0 "[ . 1 . 2]"
1 7 THR 18.930 0.329 13 0 "[ . 1 . 2]"
1 8 GLY 9.043 0.318 20 0 "[ . 1 . 2]"
1 9 LEU 15.665 0.373 14 0 "[ . 1 . 2]"
1 10 MET 19.141 0.398 14 0 "[ . 1 . 2]"
1 11 GLU 5.033 0.156 14 0 "[ . 1 . 2]"
1 12 LEU 35.804 0.441 14 0 "[ . 1 . 2]"
1 13 ILE 29.853 0.450 3 0 "[ . 1 . 2]"
1 14 GLU 23.364 0.441 14 0 "[ . 1 . 2]"
1 15 ASP 4.958 0.169 16 0 "[ . 1 . 2]"
1 16 GLU 5.925 0.349 18 0 "[ . 1 . 2]"
1 17 PHE 4.619 0.239 6 0 "[ . 1 . 2]"
1 18 GLY 8.495 0.299 7 0 "[ . 1 . 2]"
1 19 TYR 6.642 0.358 11 0 "[ . 1 . 2]"
1 20 GLU 4.104 0.242 17 0 "[ . 1 . 2]"
1 21 THR 12.952 0.342 8 0 "[ . 1 . 2]"
1 22 LEU 22.723 0.413 19 0 "[ . 1 . 2]"
1 23 ASP 5.393 0.226 1 0 "[ . 1 . 2]"
1 24 THR 24.267 0.373 13 0 "[ . 1 . 2]"
1 25 LEU 38.372 0.450 3 0 "[ . 1 . 2]"
1 26 LEU 10.187 0.349 8 0 "[ . 1 . 2]"
1 27 GLU 16.793 0.340 12 0 "[ . 1 . 2]"
1 28 SER 9.611 0.351 8 0 "[ . 1 . 2]"
1 29 CYS 16.031 0.395 5 0 "[ . 1 . 2]"
1 30 GLU 6.121 0.340 12 0 "[ . 1 . 2]"
1 31 LEU 11.842 0.275 13 0 "[ . 1 . 2]"
1 32 GLN 3.369 0.312 11 0 "[ . 1 . 2]"
1 33 SER 3.571 0.312 11 0 "[ . 1 . 2]"
1 34 GLU 4.055 0.275 13 0 "[ . 1 . 2]"
1 35 GLY 1.949 0.104 4 0 "[ . 1 . 2]"
1 36 ILE 12.737 0.398 14 0 "[ . 1 . 2]"
1 37 TYR 7.399 0.288 8 0 "[ . 1 . 2]"
1 38 THR 2.073 0.309 13 0 "[ . 1 . 2]"
1 39 SER 10.278 0.329 13 0 "[ . 1 . 2]"
1 40 VAL 4.564 0.301 9 0 "[ . 1 . 2]"
1 41 GLY 6.083 0.400 20 0 "[ . 1 . 2]"
1 42 SER 18.214 0.444 14 0 "[ . 1 . 2]"
1 43 TYR 10.693 0.308 11 0 "[ . 1 . 2]"
1 44 ASP 2.745 0.147 3 0 "[ . 1 . 2]"
1 45 HIS 3.110 0.212 16 0 "[ . 1 . 2]"
1 46 GLN 9.723 0.385 4 0 "[ . 1 . 2]"
1 47 GLU 35.521 0.372 12 0 "[ . 1 . 2]"
1 48 LEU 9.703 0.409 15 0 "[ . 1 . 2]"
1 49 LEU 18.156 0.468 16 0 "[ . 1 . 2]"
1 50 GLN 25.736 0.385 4 0 "[ . 1 . 2]"
1 51 LEU 27.778 0.373 14 0 "[ . 1 . 2]"
1 52 VAL 29.918 0.468 16 0 "[ . 1 . 2]"
1 53 VAL 20.668 0.390 9 0 "[ . 1 . 2]"
1 54 LYS 31.623 0.427 5 0 "[ . 1 . 2]"
1 55 LEU 22.632 0.401 5 0 "[ . 1 . 2]"
1 56 SER 12.738 0.468 13 0 "[ . 1 . 2]"
1 57 GLU 12.406 0.277 4 0 "[ . 1 . 2]"
1 58 VAL 19.730 0.418 12 0 "[ . 1 . 2]"
1 59 SER 13.551 0.325 1 0 "[ . 1 . 2]"
1 60 SER 4.098 0.240 14 0 "[ . 1 . 2]"
1 61 VAL 8.014 0.401 5 0 "[ . 1 . 2]"
1 62 PRO 7.964 0.468 13 0 "[ . 1 . 2]"
1 63 VAL 18.551 0.424 5 0 "[ . 1 . 2]"
1 64 THR 13.264 0.357 15 0 "[ . 1 . 2]"
1 65 GLU 7.449 0.387 12 0 "[ . 1 . 2]"
1 66 LEU 10.229 0.387 12 0 "[ . 1 . 2]"
1 67 VAL 19.448 0.312 8 0 "[ . 1 . 2]"
1 68 ARG 15.368 0.286 17 0 "[ . 1 . 2]"
1 69 LEU 6.131 0.202 12 0 "[ . 1 . 2]"
1 70 PHE 5.306 0.198 5 0 "[ . 1 . 2]"
1 71 GLY 9.567 0.340 18 0 "[ . 1 . 2]"
1 72 LYS 13.734 0.271 2 0 "[ . 1 . 2]"
1 73 LYS 19.118 0.304 18 0 "[ . 1 . 2]"
1 74 LEU 16.508 0.392 18 0 "[ . 1 . 2]"
1 75 PHE 5.169 0.138 4 0 "[ . 1 . 2]"
1 76 VAL 19.599 0.326 7 0 "[ . 1 . 2]"
1 77 GLU 12.656 0.304 18 0 "[ . 1 . 2]"
1 78 LEU 10.921 0.295 13 0 "[ . 1 . 2]"
1 79 ILE 15.568 0.332 7 0 "[ . 1 . 2]"
1 80 GLU 14.070 0.467 18 0 "[ . 1 . 2]"
1 81 GLY 0.742 0.113 9 0 "[ . 1 . 2]"
1 82 HIS 16.184 0.467 18 0 "[ . 1 . 2]"
1 83 PRO 7.938 0.305 17 0 "[ . 1 . 2]"
1 84 GLU 12.488 0.305 10 0 "[ . 1 . 2]"
1 85 ILE 18.737 0.363 13 0 "[ . 1 . 2]"
1 86 ALA 8.943 0.351 18 0 "[ . 1 . 2]"
1 87 ASN 9.370 0.403 9 0 "[ . 1 . 2]"
1 88 GLU 12.777 0.403 9 0 "[ . 1 . 2]"
1 89 MET 31.772 0.384 16 0 "[ . 1 . 2]"
1 90 LYS 11.668 0.260 6 0 "[ . 1 . 2]"
1 91 ASP 9.791 0.358 10 0 "[ . 1 . 2]"
1 92 SER 5.160 0.204 2 0 "[ . 1 . 2]"
1 93 PHE 21.519 0.358 1 0 "[ . 1 . 2]"
1 94 ASP 7.318 0.229 7 0 "[ . 1 . 2]"
1 95 LEU 9.282 0.261 19 0 "[ . 1 . 2]"
1 96 LEU 12.010 0.273 13 0 "[ . 1 . 2]"
1 97 SER 8.432 0.227 18 0 "[ . 1 . 2]"
1 98 LYS 22.369 0.384 16 0 "[ . 1 . 2]"
1 99 ILE 8.029 0.282 2 0 "[ . 1 . 2]"
1 100 ASP 2.484 0.204 16 0 "[ . 1 . 2]"
1 101 SER 1.882 0.204 16 0 "[ . 1 . 2]"
1 102 PHE 8.487 0.281 16 0 "[ . 1 . 2]"
1 103 ILE 13.443 0.292 3 0 "[ . 1 . 2]"
1 104 HIS 0.530 0.094 5 0 "[ . 1 . 2]"
1 105 VAL 7.363 0.461 8 0 "[ . 1 . 2]"
1 106 GLU 14.077 0.461 8 0 "[ . 1 . 2]"
1 107 VAL 25.403 0.322 1 0 "[ . 1 . 2]"
1 108 TYR 4.477 0.288 7 0 "[ . 1 . 2]"
1 109 LYS 9.127 0.321 7 0 "[ . 1 . 2]"
1 110 LEU 12.759 0.441 17 0 "[ . 1 . 2]"
1 111 TYR 21.647 0.441 17 0 "[ . 1 . 2]"
1 112 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 GLN 6.787 0.278 5 0 "[ . 1 . 2]"
1 114 ALA 15.535 0.444 14 0 "[ . 1 . 2]"
1 115 GLU 1.407 0.088 14 0 "[ . 1 . 2]"
1 116 LEU 7.179 0.326 11 0 "[ . 1 . 2]"
1 117 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 118 LYS 16.474 0.382 8 0 "[ . 1 . 2]"
1 119 PHE 5.371 0.282 2 0 "[ . 1 . 2]"
1 120 THR 4.184 0.134 1 0 "[ . 1 . 2]"
1 121 CYS 9.259 0.274 16 0 "[ . 1 . 2]"
1 122 ASP 9.975 0.277 1 0 "[ . 1 . 2]"
1 123 ARG 15.106 0.372 12 0 "[ . 1 . 2]"
1 124 LEU 8.816 0.308 20 0 "[ . 1 . 2]"
1 125 GLY 4.029 0.188 16 0 "[ . 1 . 2]"
1 126 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 127 ASN 11.433 0.356 10 0 "[ . 1 . 2]"
1 128 ASP 8.490 0.266 10 0 "[ . 1 . 2]"
1 129 ILE 24.715 0.372 12 0 "[ . 1 . 2]"
1 130 ARG 40.909 0.386 7 0 "[ . 1 . 2]"
1 131 LEU 29.944 0.390 20 0 "[ . 1 . 2]"
1 132 HIS 13.862 0.319 7 0 "[ . 1 . 2]"
1 133 TYR 12.709 0.213 16 0 "[ . 1 . 2]"
1 134 GLN 25.311 0.382 8 0 "[ . 1 . 2]"
1 135 SER 5.897 0.424 7 0 "[ . 1 . 2]"
1 136 LYS 4.477 0.272 20 0 "[ . 1 . 2]"
1 137 ARG 0.128 0.053 7 0 "[ . 1 . 2]"
1 138 PRO 1.974 0.199 7 0 "[ . 1 . 2]"
1 139 PHE 8.664 0.257 9 0 "[ . 1 . 2]"
1 140 ALA 4.316 0.257 9 0 "[ . 1 . 2]"
1 141 SER 10.663 0.357 15 0 "[ . 1 . 2]"
1 142 PHE 8.087 0.207 13 0 "[ . 1 . 2]"
1 143 ALA 1.841 0.092 1 0 "[ . 1 . 2]"
1 144 GLU 5.289 0.196 16 0 "[ . 1 . 2]"
1 145 GLY 4.554 0.193 12 0 "[ . 1 . 2]"
1 146 LEU 11.385 0.340 18 0 "[ . 1 . 2]"
1 147 LEU 20.408 0.427 10 0 "[ . 1 . 2]"
1 148 ASP 22.103 0.444 18 0 "[ . 1 . 2]"
1 149 GLY 11.058 0.271 2 0 "[ . 1 . 2]"
1 150 CYS 12.073 0.326 7 0 "[ . 1 . 2]"
1 151 ALA 6.379 0.206 6 0 "[ . 1 . 2]"
1 152 GLU 14.953 0.381 15 0 "[ . 1 . 2]"
1 153 TYR 17.995 0.332 7 0 "[ . 1 . 2]"
1 154 PHE 25.279 0.358 10 0 "[ . 1 . 2]"
1 155 LYS 2.473 0.151 2 0 "[ . 1 . 2]"
1 156 GLU 5.096 0.282 14 0 "[ . 1 . 2]"
1 157 ASP 1.163 0.145 13 0 "[ . 1 . 2]"
1 158 PHE 9.529 0.384 10 0 "[ . 1 . 2]"
1 159 THR 2.893 0.287 1 0 "[ . 1 . 2]"
1 160 ILE 37.758 0.444 15 0 "[ . 1 . 2]"
1 161 SER 3.707 0.144 18 0 "[ . 1 . 2]"
1 162 ARG 12.699 0.342 15 0 "[ . 1 . 2]"
1 163 THR 19.296 0.365 13 0 "[ . 1 . 2]"
1 164 PRO 3.065 0.377 14 0 "[ . 1 . 2]"
1 165 GLU 1.319 0.167 15 0 "[ . 1 . 2]"
1 166 THR 15.563 0.399 2 0 "[ . 1 . 2]"
1 167 GLN 18.315 0.377 14 0 "[ . 1 . 2]"
1 168 ASP 2.055 0.129 2 0 "[ . 1 . 2]"
1 169 SER 9.309 0.399 2 0 "[ . 1 . 2]"
1 170 GLU 1.038 0.121 9 0 "[ . 1 . 2]"
1 171 THR 11.181 0.424 7 0 "[ . 1 . 2]"
1 172 ASP 9.085 0.358 13 0 "[ . 1 . 2]"
1 173 VAL 24.249 0.320 19 0 "[ . 1 . 2]"
1 174 ILE 11.900 0.365 13 0 "[ . 1 . 2]"
1 175 PHE 16.011 0.342 15 0 "[ . 1 . 2]"
1 176 ASN 15.549 0.390 20 0 "[ . 1 . 2]"
1 177 ILE 44.488 0.444 15 0 "[ . 1 . 2]"
1 178 THR 12.966 0.356 10 0 "[ . 1 . 2]"
1 179 ARG 33.685 0.468 15 0 "[ . 1 . 2]"
1 180 ALA 3.384 0.275 8 0 "[ . 1 . 2]"
1 181 PRO 4.977 0.436 13 0 "[ . 1 . 2]"
1 182 ARG 30.684 0.468 15 0 "[ . 1 . 2]"
1 183 GLY 5.302 0.439 6 0 "[ . 1 . 2]"
1 184 ALA 2.479 0.408 3 0 "[ . 1 . 2]"
1 185 GLU 5.742 0.408 3 0 "[ . 1 . 2]"
1 186 ASN 1.221 0.258 4 0 "[ . 1 . 2]"
1 187 LEU 0.756 0.258 4 0 "[ . 1 . 2]"
1 188 TYR 0.264 0.082 9 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 MET ME 1 40 VAL MG1 6.350 . 6.350 5.314 4.274 6.404 0.054 14 0 "[ . 1 . 2]" 1
2 1 1 MET ME 1 2 MET HA 6.660 . 6.660 6.518 6.088 6.830 0.170 11 0 "[ . 1 . 2]" 1
3 1 1 MET ME 1 4 MET HG2 4.660 . 4.660 4.610 3.879 4.803 0.143 13 0 "[ . 1 . 2]" 1
4 1 1 MET ME 1 1 MET HG2 5.150 2.750 5.150 2.972 2.385 3.371 0.365 7 0 "[ . 1 . 2]" 1
5 1 1 MET ME 1 111 TYR QD 5.830 . 5.830 3.349 2.937 3.896 . 0 0 "[ . 1 . 2]" 1
6 1 1 MET ME 1 111 TYR QE 5.830 . 5.830 3.294 2.930 4.030 . 0 0 "[ . 1 . 2]" 1
7 1 1 MET ME 1 114 ALA MB 5.150 . 5.150 5.283 5.214 5.399 0.249 14 0 "[ . 1 . 2]" 1
8 1 1 MET ME 1 4 MET HB3 5.590 . 5.590 4.826 3.552 5.735 0.145 7 0 "[ . 1 . 2]" 1
9 1 2 MET HG2 1 6 PHE QE 7.470 . 7.470 3.794 3.285 4.340 . 0 0 "[ . 1 . 2]" 1
10 1 2 MET HA 1 43 TYR QD 7.050 . 7.050 5.662 5.508 5.842 . 0 0 "[ . 1 . 2]" 1
11 1 2 MET ME 1 48 LEU MD2 6.950 . 6.950 3.575 2.306 4.690 . 0 0 "[ . 1 . 2]" 1
12 1 2 MET HG3 1 5 VAL H 6.740 . 6.740 5.055 4.816 5.307 . 0 0 "[ . 1 . 2]" 1
13 1 2 MET ME 1 48 LEU MD1 6.710 . 6.710 4.065 2.418 4.649 . 0 0 "[ . 1 . 2]" 1
14 1 2 MET HG3 1 6 PHE QE 6.540 . 6.540 3.816 3.477 4.736 . 0 0 "[ . 1 . 2]" 1
15 1 2 MET HG2 1 5 VAL MG1 6.290 . 6.290 5.784 5.462 6.166 . 0 0 "[ . 1 . 2]" 1
16 1 2 MET ME 1 48 LEU HA 6.110 . 6.110 5.193 4.768 5.589 . 0 0 "[ . 1 . 2]" 1
17 1 2 MET HG2 1 45 HIS HA 5.990 . 5.990 4.305 3.979 4.624 . 0 0 "[ . 1 . 2]" 1
18 1 2 MET HG2 1 48 LEU HA 5.980 . 5.980 5.804 5.338 6.027 0.047 18 0 "[ . 1 . 2]" 1
19 1 2 MET HA 1 6 PHE HB2 5.710 . 5.710 5.609 5.344 5.743 0.033 7 0 "[ . 1 . 2]" 1
20 1 2 MET HG3 1 45 HIS HA 5.570 . 5.570 5.054 4.671 5.489 . 0 0 "[ . 1 . 2]" 1
21 1 2 MET HB2 1 3 GLY H 5.480 . 5.480 3.657 3.504 3.797 . 0 0 "[ . 1 . 2]" 1
22 1 2 MET HG3 1 5 VAL MG2 5.470 . 5.470 2.491 2.228 2.756 . 0 0 "[ . 1 . 2]" 1
23 1 2 MET ME 1 45 HIS HB2 5.430 . 5.430 5.159 4.462 5.451 0.021 8 0 "[ . 1 . 2]" 1
24 1 2 MET HG2 1 5 VAL MG2 5.410 . 5.410 3.896 3.646 4.175 . 0 0 "[ . 1 . 2]" 1
25 1 2 MET HG3 1 3 GLY H 5.390 . 5.390 5.205 5.082 5.310 . 0 0 "[ . 1 . 2]" 1
26 1 2 MET ME 1 5 VAL MG2 5.350 . 5.350 2.570 2.204 2.976 . 0 0 "[ . 1 . 2]" 1
27 1 2 MET ME 1 48 LEU H 5.290 . 5.290 4.729 4.414 5.225 . 0 0 "[ . 1 . 2]" 1
28 1 2 MET HA 1 42 SER HA 4.860 . 4.860 4.990 4.834 5.121 0.261 2 0 "[ . 1 . 2]" 1
29 1 2 MET HG2 1 47 GLU HB2 4.840 . 4.840 5.104 4.998 5.184 0.344 16 0 "[ . 1 . 2]" 1
30 1 2 MET ME 1 45 HIS HA 4.680 . 4.680 3.497 3.114 4.071 . 0 0 "[ . 1 . 2]" 1
31 1 2 MET HA 1 3 GLY H 4.670 . 4.670 3.482 3.408 3.544 . 0 0 "[ . 1 . 2]" 1
32 1 2 MET ME 1 5 VAL MG1 4.660 . 4.660 3.296 2.834 3.677 . 0 0 "[ . 1 . 2]" 1
33 1 2 MET HB3 1 5 VAL MG2 4.430 . 4.430 3.618 3.279 3.997 . 0 0 "[ . 1 . 2]" 1
34 1 3 GLY HA3 1 43 TYR QE 6.810 . 6.810 5.568 5.366 5.701 . 0 0 "[ . 1 . 2]" 1
35 1 3 GLY H 1 43 TYR QE 6.380 . 6.380 6.389 6.289 6.449 0.069 16 0 "[ . 1 . 2]" 1
36 1 3 GLY HA3 1 43 TYR QD 6.310 . 6.310 5.199 5.050 5.344 . 0 0 "[ . 1 . 2]" 1
37 1 3 GLY HA3 1 42 SER H 6.070 . 6.070 5.764 4.792 6.054 . 0 0 "[ . 1 . 2]" 1
38 1 3 GLY HA2 1 43 TYR QD 5.900 . 5.900 4.013 3.905 4.140 . 0 0 "[ . 1 . 2]" 1
39 1 3 GLY H 1 41 GLY HA3 5.900 . 5.900 5.366 4.721 5.612 . 0 0 "[ . 1 . 2]" 1
40 1 3 GLY HA2 1 37 TYR HB3 5.890 . 5.890 5.625 5.310 5.908 0.018 13 0 "[ . 1 . 2]" 1
41 1 3 GLY HA3 1 6 PHE QD 5.890 . 5.890 5.405 4.303 5.808 . 0 0 "[ . 1 . 2]" 1
42 1 3 GLY H 1 6 PHE QD 5.870 . 5.870 5.497 4.614 5.900 0.030 5 0 "[ . 1 . 2]" 1
43 1 3 GLY HA2 1 6 PHE H 5.810 . 5.810 3.521 3.453 3.604 . 0 0 "[ . 1 . 2]" 1
44 1 3 GLY HA3 1 6 PHE HB2 5.780 . 5.780 4.376 4.248 4.482 . 0 0 "[ . 1 . 2]" 1
45 1 3 GLY HA3 1 37 TYR HB3 5.780 . 5.780 5.539 5.111 5.935 0.155 9 0 "[ . 1 . 2]" 1
46 1 3 GLY HA2 1 6 PHE HB2 5.780 . 5.780 2.833 2.716 2.924 . 0 0 "[ . 1 . 2]" 1
47 1 3 GLY HA2 1 37 TYR QD 5.770 . 5.770 5.894 5.833 5.972 0.202 14 0 "[ . 1 . 2]" 1
48 1 3 GLY H 1 42 SER H 5.660 . 5.660 5.644 4.789 5.782 0.122 6 0 "[ . 1 . 2]" 1
49 1 3 GLY HA2 1 6 PHE HA 5.650 . 5.650 5.550 5.417 5.664 0.014 15 0 "[ . 1 . 2]" 1
50 1 3 GLY HA2 1 41 GLY H 5.590 . 5.590 3.967 3.782 4.155 . 0 0 "[ . 1 . 2]" 1
51 1 3 GLY H 1 41 GLY H 5.570 . 5.570 4.479 4.156 4.734 . 0 0 "[ . 1 . 2]" 1
52 1 3 GLY HA2 1 4 MET H 5.520 . 5.520 3.643 3.619 3.660 . 0 0 "[ . 1 . 2]" 1
53 1 3 GLY HA2 1 6 PHE QD 5.450 . 5.450 3.867 2.516 4.352 . 0 0 "[ . 1 . 2]" 1
54 1 3 GLY HA3 1 39 SER H 5.410 . 5.410 5.182 4.473 5.454 0.044 1 0 "[ . 1 . 2]" 1
55 1 3 GLY H 1 6 PHE HB2 5.390 . 5.390 5.259 5.140 5.374 . 0 0 "[ . 1 . 2]" 1
56 1 3 GLY HA3 1 37 TYR QD 5.250 . 5.250 5.429 5.286 5.538 0.288 8 0 "[ . 1 . 2]" 1
57 1 3 GLY H 1 43 TYR H 5.250 . 5.250 4.762 4.552 4.887 . 0 0 "[ . 1 . 2]" 1
58 1 3 GLY H 1 43 TYR QD 5.120 . 5.120 5.174 5.126 5.214 0.094 10 0 "[ . 1 . 2]" 1
59 1 3 GLY O 1 7 THR N . 2.700 3.300 3.382 3.342 3.408 0.108 15 0 "[ . 1 . 2]" 1
60 1 3 GLY O 1 7 THR H . . 2.300 2.556 2.529 2.587 0.287 16 0 "[ . 1 . 2]" 1
61 1 4 MET HG2 1 5 VAL MG1 7.390 . 7.390 5.285 3.765 6.018 . 0 0 "[ . 1 . 2]" 1
62 1 4 MET ME 1 40 VAL MG2 7.310 . 7.310 6.641 5.727 7.299 . 0 0 "[ . 1 . 2]" 1
63 1 4 MET ME 1 74 LEU MD2 7.180 . 7.180 4.600 3.592 5.376 . 0 0 "[ . 1 . 2]" 1
64 1 4 MET ME 1 107 VAL MG1 6.920 . 6.920 5.476 4.664 6.368 . 0 0 "[ . 1 . 2]" 1
65 1 4 MET HG3 1 5 VAL MG1 6.850 . 6.850 5.351 4.749 6.005 . 0 0 "[ . 1 . 2]" 1
66 1 4 MET HB2 1 74 LEU MD2 6.550 . 6.550 4.726 4.036 5.495 . 0 0 "[ . 1 . 2]" 1
67 1 4 MET ME 1 111 TYR QE 6.330 . 6.330 5.817 5.313 6.321 . 0 0 "[ . 1 . 2]" 1
68 1 4 MET ME 1 39 SER HB2 6.310 . 6.310 3.594 2.620 4.501 . 0 0 "[ . 1 . 2]" 1
69 1 4 MET ME 1 39 SER HA 6.270 . 6.270 5.450 4.841 6.006 . 0 0 "[ . 1 . 2]" 1
70 1 4 MET ME 1 111 TYR QD 6.250 . 6.250 6.205 5.789 6.402 0.152 14 0 "[ . 1 . 2]" 1
71 1 4 MET HA 1 78 LEU MD2 6.240 . 6.240 6.234 5.735 6.419 0.179 6 0 "[ . 1 . 2]" 1
72 1 4 MET ME 1 78 LEU MD1 6.160 . 6.160 4.079 2.990 4.679 . 0 0 "[ . 1 . 2]" 1
73 1 4 MET HB3 1 39 SER HB2 6.150 . 6.150 5.095 3.944 5.687 . 0 0 "[ . 1 . 2]" 1
74 1 4 MET ME 1 82 HIS HE1 6.040 . 6.040 5.162 3.345 6.103 0.063 6 0 "[ . 1 . 2]" 1
75 1 4 MET H 1 7 THR H 6.020 . 6.020 4.950 4.903 5.014 . 0 0 "[ . 1 . 2]" 1
76 1 4 MET H 1 5 VAL H 6.010 . 6.010 2.672 2.617 2.765 . 0 0 "[ . 1 . 2]" 1
77 1 4 MET ME 1 78 LEU HA 5.990 . 5.990 5.544 4.972 5.933 . 0 0 "[ . 1 . 2]" 1
78 1 4 MET H 1 42 SER HA 5.920 . 5.920 6.055 5.900 6.172 0.252 15 0 "[ . 1 . 2]" 1
79 1 4 MET HA 1 4 MET ME 5.910 . 5.910 4.363 4.009 4.604 . 0 0 "[ . 1 . 2]" 1
80 1 4 MET ME 1 107 VAL MG2 5.890 . 5.890 4.747 4.043 5.446 . 0 0 "[ . 1 . 2]" 1
81 1 4 MET HG3 1 5 VAL H 5.850 . 5.850 4.725 4.455 5.068 . 0 0 "[ . 1 . 2]" 1
82 1 4 MET HA 1 8 GLY H 5.840 . 5.840 4.526 4.421 4.635 . 0 0 "[ . 1 . 2]" 1
83 1 4 MET HB3 1 5 VAL MG1 5.820 . 5.820 3.675 3.010 4.247 . 0 0 "[ . 1 . 2]" 1
84 1 4 MET ME 1 78 LEU HB3 5.820 . 5.820 5.753 5.162 5.956 0.136 7 0 "[ . 1 . 2]" 1
85 1 4 MET H 1 4 MET HG2 5.590 . 5.590 4.105 3.515 4.651 . 0 0 "[ . 1 . 2]" 1
86 1 4 MET HB2 1 39 SER HA 5.560 . 5.560 5.167 4.259 5.741 0.181 6 0 "[ . 1 . 2]" 1
87 1 4 MET HG3 1 39 SER HA 5.540 . 5.540 4.696 3.806 5.727 0.187 1 0 "[ . 1 . 2]" 1
88 1 4 MET H 1 41 GLY H 5.380 . 5.380 5.620 5.460 5.780 0.400 20 0 "[ . 1 . 2]" 1
89 1 4 MET HB3 1 39 SER HA 5.840 . 5.840 5.966 5.453 6.130 0.290 16 0 "[ . 1 . 2]" 1
90 1 4 MET H 1 4 MET HG3 5.260 . 5.260 3.440 2.377 4.412 . 0 0 "[ . 1 . 2]" 1
91 1 4 MET HG2 1 5 VAL H 5.190 . 5.190 4.996 4.071 5.413 0.223 16 0 "[ . 1 . 2]" 1
92 1 4 MET HA 1 7 THR H 5.010 . 5.010 3.243 3.124 3.343 . 0 0 "[ . 1 . 2]" 1
93 1 4 MET HA 1 39 SER HB3 4.780 . 4.780 3.102 2.073 3.876 . 0 0 "[ . 1 . 2]" 1
94 1 4 MET HB3 1 5 VAL H 4.760 . 4.760 3.287 2.710 3.850 . 0 0 "[ . 1 . 2]" 1
95 1 4 MET H 1 39 SER HA 4.740 . 4.740 4.033 3.492 4.437 . 0 0 "[ . 1 . 2]" 1
96 1 4 MET HA 1 6 PHE H 4.650 . 4.650 3.953 3.892 4.035 . 0 0 "[ . 1 . 2]" 1
97 1 4 MET ME 1 78 LEU MD2 4.610 . 4.610 2.784 2.199 3.186 . 0 0 "[ . 1 . 2]" 1
98 1 4 MET HB3 1 4 MET ME 4.600 . 4.600 3.197 2.217 4.049 . 0 0 "[ . 1 . 2]" 1
99 1 4 MET HA 1 7 THR HB 4.430 . 4.430 3.349 3.205 3.478 . 0 0 "[ . 1 . 2]" 1
100 1 4 MET HA 1 39 SER HB2 4.430 . 4.430 3.972 3.386 4.483 0.053 16 0 "[ . 1 . 2]" 1
101 1 4 MET HA 1 39 SER HA 4.410 . 4.410 3.813 3.565 3.937 . 0 0 "[ . 1 . 2]" 1
102 1 4 MET O 1 8 GLY N . 2.700 3.300 3.248 3.169 3.315 0.015 13 0 "[ . 1 . 2]" 1
103 1 4 MET O 1 8 GLY H . . 2.300 2.310 2.209 2.390 0.090 13 0 "[ . 1 . 2]" 1
104 1 5 VAL MG1 1 74 LEU MD2 7.270 . 7.270 3.595 3.315 3.907 . 0 0 "[ . 1 . 2]" 1
105 1 5 VAL MG2 1 9 LEU MD2 6.750 . 6.750 3.863 3.623 4.212 . 0 0 "[ . 1 . 2]" 1
106 1 5 VAL H 1 9 LEU H 6.330 . 6.330 6.185 6.092 6.287 . 0 0 "[ . 1 . 2]" 1
107 1 5 VAL HB 1 9 LEU H 6.110 . 6.110 4.792 4.677 4.938 . 0 0 "[ . 1 . 2]" 1
108 1 5 VAL MG2 1 48 LEU MD1 6.100 . 6.100 4.228 2.296 5.645 . 0 0 "[ . 1 . 2]" 1
109 1 5 VAL MG2 1 74 LEU HG 6.040 . 6.040 5.278 5.077 5.510 . 0 0 "[ . 1 . 2]" 1
110 1 5 VAL H 1 74 LEU MD2 5.940 . 5.940 5.014 4.842 5.163 . 0 0 "[ . 1 . 2]" 1
111 1 5 VAL HA 1 70 PHE QE 5.870 . 5.870 4.226 3.922 4.471 . 0 0 "[ . 1 . 2]" 1
112 1 5 VAL HB 1 70 PHE QD 5.810 . 5.810 5.412 5.235 5.562 . 0 0 "[ . 1 . 2]" 1
113 1 5 VAL MG1 1 48 LEU MD2 5.810 . 5.810 4.737 3.902 5.547 . 0 0 "[ . 1 . 2]" 1
114 1 5 VAL HB 1 6 PHE HA 5.740 . 5.740 4.514 4.485 4.545 . 0 0 "[ . 1 . 2]" 1
115 1 5 VAL MG2 1 9 LEU H 5.730 . 5.730 4.930 4.819 5.000 . 0 0 "[ . 1 . 2]" 1
116 1 5 VAL MG2 1 6 PHE QD 5.580 . 5.580 2.345 2.079 3.494 . 0 0 "[ . 1 . 2]" 1
117 1 5 VAL HA 1 74 LEU HG 5.530 . 5.530 3.199 3.056 3.359 . 0 0 "[ . 1 . 2]" 1
118 1 5 VAL H 1 6 PHE H 5.520 . 5.520 2.612 2.557 2.649 . 0 0 "[ . 1 . 2]" 1
119 1 5 VAL MG2 1 48 LEU HG 5.420 . 5.420 4.770 3.763 5.504 0.084 13 0 "[ . 1 . 2]" 1
120 1 5 VAL HA 1 74 LEU HB3 5.320 . 5.320 5.584 5.506 5.712 0.392 18 0 "[ . 1 . 2]" 1
121 1 5 VAL MG2 1 70 PHE QE 5.300 . 5.300 4.443 4.274 4.619 . 0 0 "[ . 1 . 2]" 1
122 1 5 VAL MG1 1 74 LEU HG 5.270 . 5.270 2.771 2.443 3.132 . 0 0 "[ . 1 . 2]" 1
123 1 5 VAL HA 1 70 PHE HZ 5.220 . 5.220 3.465 3.029 3.782 . 0 0 "[ . 1 . 2]" 1
124 1 5 VAL MG1 1 6 PHE H 5.210 . 5.210 4.145 4.114 4.171 . 0 0 "[ . 1 . 2]" 1
125 1 5 VAL MG2 1 6 PHE H 5.210 . 5.210 2.262 2.090 2.468 . 0 0 "[ . 1 . 2]" 1
126 1 5 VAL H 1 7 THR H 5.180 . 5.180 4.210 4.143 4.284 . 0 0 "[ . 1 . 2]" 1
127 1 5 VAL HB 1 48 LEU MD2 5.160 . 5.160 4.520 4.030 5.290 0.130 16 0 "[ . 1 . 2]" 1
128 1 5 VAL HA 1 74 LEU MD1 5.060 . 5.060 4.440 4.238 4.610 . 0 0 "[ . 1 . 2]" 1
129 1 5 VAL HB 1 6 PHE H 5.020 . 5.020 4.119 4.082 4.139 . 0 0 "[ . 1 . 2]" 1
130 1 5 VAL HA 1 74 LEU HB2 4.930 . 4.930 4.570 4.473 4.727 . 0 0 "[ . 1 . 2]" 1
131 1 5 VAL MG2 1 70 PHE HZ 4.750 . 4.750 3.741 3.536 3.951 . 0 0 "[ . 1 . 2]" 1
132 1 5 VAL MG2 1 48 LEU MD2 4.640 . 4.640 3.693 3.256 4.650 0.010 16 0 "[ . 1 . 2]" 1
133 1 5 VAL O 1 9 LEU N . 2.700 3.300 3.094 3.022 3.201 . 0 0 "[ . 1 . 2]" 1
134 1 5 VAL HA 1 74 LEU MD2 4.200 . 4.200 3.484 3.281 3.629 . 0 0 "[ . 1 . 2]" 1
135 1 5 VAL O 1 9 LEU H . . 2.300 2.195 2.124 2.306 0.006 15 0 "[ . 1 . 2]" 1
136 1 6 PHE H 1 48 LEU MD2 7.370 . 7.370 6.694 6.076 7.569 0.199 16 0 "[ . 1 . 2]" 1
137 1 6 PHE QE 1 48 LEU H 6.680 . 6.680 4.622 4.206 5.545 . 0 0 "[ . 1 . 2]" 1
138 1 6 PHE QD 1 48 LEU HA 6.110 . 6.110 5.442 4.852 6.054 . 0 0 "[ . 1 . 2]" 1
139 1 6 PHE H 1 9 LEU H 5.940 . 5.940 4.739 4.693 4.800 . 0 0 "[ . 1 . 2]" 1
140 1 6 PHE QE 1 48 LEU HA 5.930 . 5.930 3.849 2.934 4.845 . 0 0 "[ . 1 . 2]" 1
141 1 6 PHE QE 1 51 LEU MD2 5.830 . 5.830 5.036 4.169 5.895 0.065 13 0 "[ . 1 . 2]" 1
142 1 6 PHE QE 1 43 TYR HB3 5.760 . 5.760 4.370 3.537 4.863 . 0 0 "[ . 1 . 2]" 1
143 1 6 PHE QD 1 51 LEU MD1 5.680 . 5.680 3.923 3.065 4.279 . 0 0 "[ . 1 . 2]" 1
144 1 6 PHE HA 1 7 THR HA 5.650 . 5.650 4.739 4.728 4.751 . 0 0 "[ . 1 . 2]" 1
145 1 6 PHE H 1 6 PHE QD 5.620 . 5.620 2.850 2.664 3.253 . 0 0 "[ . 1 . 2]" 1
146 1 6 PHE HA 1 10 MET ME 5.420 . 5.420 4.479 4.109 4.728 . 0 0 "[ . 1 . 2]" 1
147 1 6 PHE H 1 7 THR H 5.380 . 5.380 2.547 2.510 2.574 . 0 0 "[ . 1 . 2]" 1
148 1 6 PHE QE 1 43 TYR HB2 5.320 . 5.320 3.404 2.281 4.116 . 0 0 "[ . 1 . 2]" 1
149 1 6 PHE HA 1 9 LEU HB2 5.300 . 5.300 2.681 2.514 2.815 . 0 0 "[ . 1 . 2]" 1
150 1 6 PHE HA 1 7 THR H 5.090 . 5.090 3.606 3.589 3.624 . 0 0 "[ . 1 . 2]" 1
151 1 6 PHE HA 1 9 LEU MD2 4.950 . 4.950 3.372 3.003 3.604 . 0 0 "[ . 1 . 2]" 1
152 1 6 PHE QE 1 47 GLU HB3 4.950 . 4.950 3.392 3.110 3.796 . 0 0 "[ . 1 . 2]" 1
153 1 6 PHE HB3 1 7 THR H 4.890 . 4.890 3.484 3.408 3.697 . 0 0 "[ . 1 . 2]" 1
154 1 6 PHE QD 1 10 MET ME 4.780 . 4.780 3.361 2.551 4.486 . 0 0 "[ . 1 . 2]" 1
155 1 6 PHE HB3 1 10 MET H 4.770 . 4.770 4.959 4.916 5.010 0.240 8 0 "[ . 1 . 2]" 1
156 1 6 PHE HA 1 10 MET H 4.580 . 4.580 4.345 4.287 4.439 . 0 0 "[ . 1 . 2]" 1
157 1 6 PHE HB2 1 7 THR H 4.530 . 4.530 3.078 2.996 3.152 . 0 0 "[ . 1 . 2]" 1
158 1 6 PHE HB3 1 10 MET ME 4.450 . 4.450 3.501 3.228 3.643 . 0 0 "[ . 1 . 2]" 1
159 1 6 PHE HA 1 9 LEU H 4.400 . 4.400 3.274 3.199 3.394 . 0 0 "[ . 1 . 2]" 1
160 1 6 PHE O 1 10 MET N . 2.700 3.300 3.176 3.153 3.211 . 0 0 "[ . 1 . 2]" 1
161 1 6 PHE O 1 10 MET H . . 2.300 2.255 2.227 2.295 . 0 0 "[ . 1 . 2]" 1
162 1 7 THR MG 1 36 ILE MG 6.740 . 6.740 3.176 3.022 3.371 . 0 0 "[ . 1 . 2]" 1
163 1 7 THR MG 1 11 GLU H 5.920 . 5.920 4.031 3.961 4.089 . 0 0 "[ . 1 . 2]" 1
164 1 7 THR MG 1 10 MET HG3 5.750 . 5.750 4.790 4.603 4.980 . 0 0 "[ . 1 . 2]" 1
165 1 7 THR H 1 9 LEU H 5.720 . 5.720 4.077 4.044 4.107 . 0 0 "[ . 1 . 2]" 1
166 1 7 THR MG 1 11 GLU HG2 5.600 . 5.600 4.215 4.172 4.276 . 0 0 "[ . 1 . 2]" 1
167 1 7 THR HB 1 11 GLU HG3 5.290 . 5.290 5.367 5.306 5.400 0.110 20 0 "[ . 1 . 2]" 1
168 1 7 THR MG 1 36 ILE HA 5.270 . 5.270 5.448 5.392 5.505 0.235 6 0 "[ . 1 . 2]" 1
169 1 7 THR HA 1 9 LEU H 5.270 . 5.270 4.327 4.258 4.369 . 0 0 "[ . 1 . 2]" 1
170 1 7 THR H 1 8 GLY H 5.260 . 5.260 2.591 2.567 2.615 . 0 0 "[ . 1 . 2]" 1
171 1 7 THR MG 1 36 ILE MD 5.160 . 5.160 4.075 3.868 4.376 . 0 0 "[ . 1 . 2]" 1
172 1 7 THR HA 1 8 GLY H 5.080 . 5.080 3.620 3.611 3.630 . 0 0 "[ . 1 . 2]" 1
173 1 7 THR MG 1 8 GLY H 5.060 . 5.060 3.599 3.556 3.638 . 0 0 "[ . 1 . 2]" 1
174 1 7 THR HA 1 11 GLU HG3 4.890 . 4.890 4.648 4.534 4.735 . 0 0 "[ . 1 . 2]" 1
175 1 7 THR HA 1 10 MET HB3 4.880 . 4.880 4.836 4.785 4.914 0.034 9 0 "[ . 1 . 2]" 1
176 1 7 THR HA 1 10 MET ME 4.880 . 4.880 4.624 4.508 4.785 . 0 0 "[ . 1 . 2]" 1
177 1 7 THR HA 1 36 ILE MD 4.780 . 4.780 4.869 4.805 4.941 0.161 9 0 "[ . 1 . 2]" 1
178 1 7 THR MG 1 39 SER HB3 5.140 2.150 5.140 5.365 5.274 5.469 0.329 13 0 "[ . 1 . 2]" 1
179 1 7 THR HA 1 10 MET HB2 4.640 . 4.640 3.170 3.127 3.235 . 0 0 "[ . 1 . 2]" 1
180 1 7 THR HB 1 8 GLY H 4.630 . 4.630 2.651 2.618 2.682 . 0 0 "[ . 1 . 2]" 1
181 1 7 THR HA 1 11 GLU H 4.580 . 4.580 4.477 4.429 4.525 . 0 0 "[ . 1 . 2]" 1
182 1 7 THR MG 1 11 GLU HG3 4.570 . 4.570 2.918 2.851 2.988 . 0 0 "[ . 1 . 2]" 1
183 1 7 THR HA 1 10 MET HG2 4.530 . 4.530 3.289 3.171 3.402 . 0 0 "[ . 1 . 2]" 1
184 1 7 THR HA 1 10 MET HG3 4.430 . 4.430 3.894 3.726 4.103 . 0 0 "[ . 1 . 2]" 1
185 1 7 THR O 1 11 GLU N . 2.700 3.300 3.289 3.265 3.308 0.008 14 0 "[ . 1 . 2]" 1
186 1 7 THR O 1 11 GLU H . . 2.300 2.335 2.316 2.361 0.061 2 0 "[ . 1 . 2]" 1
187 1 8 GLY HA2 1 74 LEU HG 6.310 . 6.310 5.918 5.678 6.110 . 0 0 "[ . 1 . 2]" 1
188 1 8 GLY HA3 1 74 LEU HG 6.200 . 6.200 4.394 4.160 4.604 . 0 0 "[ . 1 . 2]" 1
189 1 8 GLY HA2 1 12 LEU HB2 5.760 . 5.760 5.350 5.216 5.523 . 0 0 "[ . 1 . 2]" 1
190 1 8 GLY HA2 1 11 GLU HB3 5.760 . 5.760 4.883 4.787 4.928 . 0 0 "[ . 1 . 2]" 1
191 1 8 GLY H 1 11 GLU HB2 5.640 . 5.640 5.679 5.605 5.712 0.072 2 0 "[ . 1 . 2]" 1
192 1 8 GLY HA3 1 12 LEU H 5.610 . 5.610 5.180 5.083 5.253 . 0 0 "[ . 1 . 2]" 1
193 1 8 GLY HA3 1 11 GLU HB2 5.510 . 5.510 4.742 4.656 4.795 . 0 0 "[ . 1 . 2]" 1
194 1 8 GLY HA2 1 11 GLU HB2 5.440 . 5.440 3.163 3.080 3.202 . 0 0 "[ . 1 . 2]" 1
195 1 8 GLY H 1 9 LEU H 5.430 . 5.430 2.720 2.697 2.756 . 0 0 "[ . 1 . 2]" 1
196 1 8 GLY H 1 74 LEU MD2 5.180 . 5.180 4.052 3.812 4.199 . 0 0 "[ . 1 . 2]" 1
197 1 8 GLY HA2 1 9 LEU H 5.100 . 5.100 3.606 3.601 3.610 . 0 0 "[ . 1 . 2]" 1
198 1 8 GLY HA2 1 74 LEU HB2 5.000 . 5.000 5.277 5.224 5.318 0.318 20 0 "[ . 1 . 2]" 1
199 1 8 GLY H 1 74 LEU HB2 5.500 . 5.500 5.603 5.570 5.639 0.139 18 0 "[ . 1 . 2]" 1
200 1 8 GLY HA3 1 9 LEU H 4.950 . 4.950 2.880 2.856 2.909 . 0 0 "[ . 1 . 2]" 1
201 1 8 GLY HA3 1 74 LEU MD2 4.910 . 4.910 3.321 3.068 3.487 . 0 0 "[ . 1 . 2]" 1
202 1 8 GLY HA3 1 74 LEU HB2 4.910 . 4.910 3.929 3.889 3.972 . 0 0 "[ . 1 . 2]" 1
203 1 8 GLY HA2 1 74 LEU MD2 4.750 . 4.750 4.095 3.820 4.241 . 0 0 "[ . 1 . 2]" 1
204 1 8 GLY O 1 12 LEU N . 2.700 3.300 3.210 3.130 3.263 . 0 0 "[ . 1 . 2]" 1
205 1 8 GLY O 1 12 LEU H . . 2.300 2.256 2.166 2.317 0.017 13 0 "[ . 1 . 2]" 1
206 1 9 LEU MD2 1 10 MET ME 7.160 . 7.160 5.105 4.903 5.325 . 0 0 "[ . 1 . 2]" 1
207 1 9 LEU HA 1 70 PHE QE 6.380 . 6.380 3.290 3.089 3.547 . 0 0 "[ . 1 . 2]" 1
208 1 9 LEU H 1 70 PHE QD 6.260 . 6.260 5.347 5.140 5.442 . 0 0 "[ . 1 . 2]" 1
209 1 9 LEU MD2 1 48 LEU MD2 6.150 . 6.150 3.249 2.329 4.635 . 0 0 "[ . 1 . 2]" 1
210 1 9 LEU MD2 1 48 LEU HB2 6.030 . 6.030 5.204 5.058 5.512 . 0 0 "[ . 1 . 2]" 1
211 1 9 LEU MD1 1 13 ILE HG13 6.000 . 6.000 3.941 3.669 4.272 . 0 0 "[ . 1 . 2]" 1
212 1 9 LEU HA 1 11 GLU H 5.940 . 5.940 4.453 4.414 4.480 . 0 0 "[ . 1 . 2]" 1
213 1 9 LEU HA 1 12 LEU MD1 5.930 . 5.930 5.514 5.472 5.564 . 0 0 "[ . 1 . 2]" 1
214 1 9 LEU H 1 70 PHE QE 5.910 . 5.910 3.510 3.311 3.694 . 0 0 "[ . 1 . 2]" 1
215 1 9 LEU MD2 1 70 PHE QE 5.890 . 5.890 2.806 2.657 2.983 . 0 0 "[ . 1 . 2]" 1
216 1 9 LEU MD2 1 51 LEU HA 5.850 . 5.850 5.696 5.567 5.799 . 0 0 "[ . 1 . 2]" 1
217 1 9 LEU MD1 1 10 MET H 5.850 . 5.850 4.422 4.375 4.499 . 0 0 "[ . 1 . 2]" 1
218 1 9 LEU MD1 1 12 LEU H 5.850 . 5.850 4.054 3.953 4.276 . 0 0 "[ . 1 . 2]" 1
219 1 9 LEU H 1 12 LEU HB3 5.800 . 5.800 5.587 5.539 5.659 . 0 0 "[ . 1 . 2]" 1
220 1 9 LEU MD2 1 52 VAL H 5.800 . 5.800 4.916 4.530 5.214 . 0 0 "[ . 1 . 2]" 1
221 1 9 LEU HA 1 70 PHE QD 5.800 . 5.800 3.827 3.537 4.023 . 0 0 "[ . 1 . 2]" 1
222 1 9 LEU MD2 1 13 ILE MD 5.740 . 5.740 4.129 4.011 4.239 . 0 0 "[ . 1 . 2]" 1
223 1 9 LEU MD1 1 13 ILE MD 3.150 . 3.150 2.015 1.681 2.403 . 0 0 "[ . 1 . 2]" 1
224 1 9 LEU H 1 74 LEU MD2 5.720 . 5.720 5.595 5.383 5.746 0.026 1 0 "[ . 1 . 2]" 1
225 1 9 LEU MD2 1 55 LEU MD1 5.710 . 5.710 3.653 3.066 4.130 . 0 0 "[ . 1 . 2]" 1
226 1 9 LEU H 1 11 GLU H 5.680 . 5.680 4.323 4.288 4.351 . 0 0 "[ . 1 . 2]" 1
227 1 9 LEU MD2 1 51 LEU MD1 5.610 . 5.610 3.136 2.928 3.379 . 0 0 "[ . 1 . 2]" 1
228 1 9 LEU HA 1 13 ILE MD 5.570 . 5.570 3.403 3.309 3.619 . 0 0 "[ . 1 . 2]" 1
229 1 9 LEU HA 1 55 LEU MD1 5.570 . 5.570 5.084 4.900 5.302 . 0 0 "[ . 1 . 2]" 1
230 1 9 LEU MD2 1 51 LEU H 5.310 . 5.310 5.293 5.140 5.394 0.084 12 0 "[ . 1 . 2]" 1
231 1 9 LEU MD2 1 48 LEU HG 5.530 . 5.530 4.460 3.128 4.909 . 0 0 "[ . 1 . 2]" 1
232 1 9 LEU HA 1 12 LEU HB3 5.500 . 5.500 3.038 2.997 3.077 . 0 0 "[ . 1 . 2]" 1
233 1 9 LEU HA 1 10 MET H 5.430 . 5.430 3.643 3.636 3.653 . 0 0 "[ . 1 . 2]" 1
234 1 9 LEU HG 1 13 ILE H 5.420 . 5.420 5.487 5.409 5.559 0.139 9 0 "[ . 1 . 2]" 1
235 1 9 LEU MD1 1 13 ILE H 5.410 . 5.410 3.928 3.664 4.155 . 0 0 "[ . 1 . 2]" 1
236 1 9 LEU MD1 1 70 PHE QE 5.340 . 5.340 2.509 2.135 2.891 . 0 0 "[ . 1 . 2]" 1
237 1 9 LEU MD2 1 52 VAL HB 5.330 . 5.330 5.480 5.392 5.596 0.266 1 0 "[ . 1 . 2]" 1
238 1 9 LEU MD2 1 51 LEU HG 5.330 . 5.330 5.015 4.853 5.186 . 0 0 "[ . 1 . 2]" 1
239 1 9 LEU HA 1 12 LEU HG 5.320 . 5.320 5.473 5.439 5.517 0.197 13 0 "[ . 1 . 2]" 1
240 1 9 LEU H 1 12 LEU H 5.280 . 5.280 4.974 4.949 5.001 . 0 0 "[ . 1 . 2]" 1
241 1 9 LEU MD2 1 48 LEU HA 5.250 . 5.250 4.130 4.002 4.348 . 0 0 "[ . 1 . 2]" 1
242 1 9 LEU MD1 1 70 PHE QD 5.130 . 5.130 2.465 2.324 2.628 . 0 0 "[ . 1 . 2]" 1
243 1 9 LEU HG 1 55 LEU MD1 5.070 . 5.070 3.560 3.210 3.912 . 0 0 "[ . 1 . 2]" 1
244 1 9 LEU H 1 10 MET H 5.030 . 5.030 2.754 2.692 2.802 . 0 0 "[ . 1 . 2]" 1
245 1 9 LEU HB3 1 10 MET H 5.010 . 5.010 2.904 2.799 2.957 . 0 0 "[ . 1 . 2]" 1
246 1 9 LEU HA 1 12 LEU MD2 4.980 . 4.980 3.906 3.848 3.954 . 0 0 "[ . 1 . 2]" 1
247 1 9 LEU HG 1 10 MET H 4.930 . 4.930 4.973 4.776 5.057 0.127 18 0 "[ . 1 . 2]" 1
248 1 9 LEU MD2 1 51 LEU HB2 4.910 . 4.910 3.294 3.196 3.413 . 0 0 "[ . 1 . 2]" 1
249 1 9 LEU HA 1 12 LEU H 4.900 . 4.900 3.520 3.484 3.561 . 0 0 "[ . 1 . 2]" 1
250 1 9 LEU HG 1 52 VAL MG2 4.890 . 4.890 4.913 4.770 4.982 0.092 13 0 "[ . 1 . 2]" 1
251 1 9 LEU HB2 1 10 MET H 4.820 . 4.820 3.452 3.312 3.659 . 0 0 "[ . 1 . 2]" 1
252 1 9 LEU HG 1 13 ILE MD 4.800 . 4.800 3.171 3.101 3.243 . 0 0 "[ . 1 . 2]" 1
253 1 9 LEU HG 1 51 LEU MD1 4.540 . 4.540 3.621 3.408 3.897 . 0 0 "[ . 1 . 2]" 1
254 1 9 LEU MD2 1 52 VAL MG2 4.530 . 4.530 3.145 2.897 3.333 . 0 0 "[ . 1 . 2]" 1
255 1 9 LEU HG 1 51 LEU HB2 4.160 . 4.160 4.466 4.387 4.533 0.373 14 0 "[ . 1 . 2]" 1
256 1 9 LEU MD2 1 51 LEU HB3 4.150 . 4.150 3.806 3.689 3.937 . 0 0 "[ . 1 . 2]" 1
257 1 9 LEU O 1 13 ILE N . 2.700 3.300 3.224 3.174 3.265 . 0 0 "[ . 1 . 2]" 1
258 1 9 LEU O 1 13 ILE H . . 2.300 2.262 2.197 2.319 0.019 13 0 "[ . 1 . 2]" 1
259 1 10 MET ME 1 22 LEU MD2 7.010 . 7.010 4.418 3.812 4.849 . 0 0 "[ . 1 . 2]" 1
260 1 10 MET ME 1 36 ILE HG12 6.830 . 6.830 3.724 2.953 4.300 . 0 0 "[ . 1 . 2]" 1
261 1 10 MET HA 1 26 LEU MD1 6.510 . 6.510 5.441 4.388 5.946 . 0 0 "[ . 1 . 2]" 1
262 1 10 MET ME 1 35 GLY HA2 6.470 . 6.470 4.361 4.065 4.705 . 0 0 "[ . 1 . 2]" 1
263 1 10 MET ME 1 26 LEU HB3 6.430 . 6.430 4.843 4.732 5.108 . 0 0 "[ . 1 . 2]" 1
264 1 10 MET ME 1 22 LEU QD 6.410 . 6.410 3.597 3.361 3.870 . 0 0 "[ . 1 . 2]" 1
265 1 10 MET ME 1 22 LEU MD1 6.360 . 6.360 3.832 3.527 4.203 . 0 0 "[ . 1 . 2]" 1
266 1 10 MET HB3 1 11 GLU HA 6.050 . 6.050 4.151 4.111 4.185 . 0 0 "[ . 1 . 2]" 1
267 1 10 MET HB3 1 36 ILE HG12 6.030 . 6.030 4.234 3.902 4.536 . 0 0 "[ . 1 . 2]" 1
268 1 10 MET HA 1 14 GLU HA 6.350 2.050 6.350 6.270 6.178 6.364 0.014 13 0 "[ . 1 . 2]" 1
269 1 10 MET HA 1 13 ILE MG 5.770 . 5.770 5.319 5.182 5.418 . 0 0 "[ . 1 . 2]" 1
270 1 10 MET HB2 1 22 LEU MD2 5.710 . 5.710 5.018 4.456 5.831 0.121 7 0 "[ . 1 . 2]" 1
271 1 10 MET HA 1 11 GLU H 5.590 . 5.590 3.604 3.598 3.611 . 0 0 "[ . 1 . 2]" 1
272 1 10 MET HA 1 12 LEU H 5.580 . 5.580 4.553 4.493 4.608 . 0 0 "[ . 1 . 2]" 1
273 1 10 MET ME 1 13 ILE HG12 5.570 . 5.570 5.702 5.633 5.749 0.179 6 0 "[ . 1 . 2]" 1
274 1 10 MET ME 1 35 GLY HA3 5.520 . 5.520 4.077 3.662 4.350 . 0 0 "[ . 1 . 2]" 1
275 1 10 MET H 1 10 MET HG3 5.460 . 5.460 3.835 3.765 3.896 . 0 0 "[ . 1 . 2]" 1
276 1 10 MET HA 1 14 GLU H 5.370 . 5.370 4.217 4.132 4.294 . 0 0 "[ . 1 . 2]" 1
277 1 10 MET ME 1 36 ILE HG13 5.350 . 5.350 4.161 3.546 4.713 . 0 0 "[ . 1 . 2]" 1
278 1 10 MET HG3 1 22 LEU MD1 5.320 . 5.320 4.356 3.864 4.559 . 0 0 "[ . 1 . 2]" 1
279 1 10 MET HB3 1 36 ILE MD 5.320 . 5.320 3.716 3.101 4.187 . 0 0 "[ . 1 . 2]" 1
280 1 10 MET ME 1 36 ILE HA 5.270 . 5.270 4.212 3.819 4.565 . 0 0 "[ . 1 . 2]" 1
281 1 10 MET H 1 11 GLU H 5.260 . 5.260 2.738 2.704 2.761 . 0 0 "[ . 1 . 2]" 1
282 1 10 MET H 1 12 LEU H 5.220 . 5.220 4.349 4.313 4.395 . 0 0 "[ . 1 . 2]" 1
283 1 10 MET H 1 13 ILE MD 5.190 . 5.190 5.392 5.356 5.426 0.236 17 0 "[ . 1 . 2]" 1
284 1 10 MET HG2 1 11 GLU H 5.140 . 5.140 4.487 4.462 4.512 . 0 0 "[ . 1 . 2]" 1
285 1 10 MET ME 1 26 LEU MD1 5.100 . 5.100 3.091 1.950 3.624 . 0 0 "[ . 1 . 2]" 1
286 1 10 MET HG2 1 36 ILE HA 4.960 . 4.960 5.246 5.092 5.358 0.398 14 0 "[ . 1 . 2]" 1
287 1 10 MET HB2 1 22 LEU MD1 4.900 . 4.900 4.498 4.048 4.721 . 0 0 "[ . 1 . 2]" 1
288 1 10 MET HA 1 13 ILE HB 4.790 . 4.790 4.119 3.947 4.250 . 0 0 "[ . 1 . 2]" 1
289 1 10 MET HA 1 13 ILE MD 4.780 . 4.780 4.575 4.430 4.643 . 0 0 "[ . 1 . 2]" 1
290 1 10 MET HA 1 10 MET ME 4.780 . 4.780 3.900 3.847 3.983 . 0 0 "[ . 1 . 2]" 1
291 1 10 MET HB3 1 11 GLU H 4.730 . 4.730 3.647 3.615 3.694 . 0 0 "[ . 1 . 2]" 1
292 1 10 MET HB2 1 11 GLU H 4.680 . 4.680 2.681 2.648 2.718 . 0 0 "[ . 1 . 2]" 1
293 1 10 MET HB2 1 10 MET ME 4.590 . 4.590 4.178 4.144 4.223 . 0 0 "[ . 1 . 2]" 1
294 1 10 MET HA 1 22 LEU MD1 4.540 . 4.540 2.463 2.237 2.724 . 0 0 "[ . 1 . 2]" 1
295 1 10 MET HA 1 22 LEU QD 4.470 . 4.470 2.434 2.220 2.710 . 0 0 "[ . 1 . 2]" 1
296 1 10 MET HG3 1 36 ILE HA 5.430 2.650 5.430 4.378 4.108 4.663 . 0 0 "[ . 1 . 2]" 1
297 1 10 MET HB3 1 22 LEU MD1 4.160 . 4.160 3.266 2.624 3.662 . 0 0 "[ . 1 . 2]" 1
298 1 10 MET HA 1 13 ILE HG13 3.970 . 3.970 4.029 3.946 4.081 0.111 16 0 "[ . 1 . 2]" 1
299 1 10 MET O 1 14 GLU N . 2.700 3.300 3.256 3.193 3.296 . 0 0 "[ . 1 . 2]" 1
300 1 10 MET ME 1 51 LEU MD1 3.360 . 3.360 3.211 2.946 3.406 0.046 18 0 "[ . 1 . 2]" 1
301 1 10 MET O 1 14 GLU H . . 2.300 2.306 2.245 2.343 0.043 1 0 "[ . 1 . 2]" 1
302 1 11 GLU HA 1 22 LEU QD 6.370 . 6.370 4.488 4.410 4.577 . 0 0 "[ . 1 . 2]" 1
303 1 11 GLU HA 1 14 GLU HA 5.840 . 5.840 5.933 5.889 5.996 0.156 14 0 "[ . 1 . 2]" 1
304 1 11 GLU HB3 1 15 ASP H 5.430 . 5.430 5.018 4.919 5.143 . 0 0 "[ . 1 . 2]" 1
305 1 11 GLU H 1 11 GLU HG3 5.200 . 5.200 2.460 2.424 2.498 . 0 0 "[ . 1 . 2]" 1
306 1 11 GLU H 1 12 LEU HB2 5.200 . 5.200 5.157 5.124 5.184 . 0 0 "[ . 1 . 2]" 1
307 1 11 GLU HB3 1 73 LYS QE 5.090 . 5.090 4.326 4.021 4.542 . 0 0 "[ . 1 . 2]" 1
308 1 11 GLU H 1 12 LEU H 5.080 . 5.080 2.760 2.727 2.786 . 0 0 "[ . 1 . 2]" 1
309 1 11 GLU H 1 11 GLU HG2 5.080 . 5.080 3.638 3.569 3.706 . 0 0 "[ . 1 . 2]" 1
310 1 11 GLU HA 1 15 ASP H 4.980 . 4.980 4.048 3.948 4.231 . 0 0 "[ . 1 . 2]" 1
311 1 11 GLU HB2 1 12 LEU H 4.950 . 4.950 2.767 2.729 2.783 . 0 0 "[ . 1 . 2]" 1
312 1 11 GLU HA 1 14 GLU H 4.710 . 4.710 3.779 3.721 3.829 . 0 0 "[ . 1 . 2]" 1
313 1 11 GLU H 1 13 ILE H 4.690 . 4.690 4.464 4.413 4.494 . 0 0 "[ . 1 . 2]" 1
314 1 11 GLU HA 1 12 LEU H 4.690 . 4.690 3.624 3.618 3.630 . 0 0 "[ . 1 . 2]" 1
315 1 11 GLU O 1 15 ASP N . 2.700 3.300 3.219 3.128 3.313 0.013 18 0 "[ . 1 . 2]" 1
316 1 11 GLU HA 1 14 GLU HB3 3.650 . 3.650 3.467 3.380 3.518 . 0 0 "[ . 1 . 2]" 1
317 1 11 GLU O 1 15 ASP H . . 2.300 2.256 2.170 2.345 0.045 18 0 "[ . 1 . 2]" 1
318 1 12 LEU MD2 1 70 PHE QE 7.900 . 7.900 4.718 4.606 4.898 . 0 0 "[ . 1 . 2]" 1
319 1 12 LEU MD2 1 73 LYS H 6.550 . 6.550 5.372 5.258 5.538 . 0 0 "[ . 1 . 2]" 1
320 1 12 LEU HB2 1 16 GLU HB2 6.120 . 6.120 6.334 6.271 6.469 0.349 18 0 "[ . 1 . 2]" 1
321 1 12 LEU H 1 13 ILE MD 6.060 . 6.060 4.214 4.111 4.269 . 0 0 "[ . 1 . 2]" 1
322 1 12 LEU MD2 1 13 ILE HA 6.010 . 6.010 4.406 4.368 4.439 . 0 0 "[ . 1 . 2]" 1
323 1 12 LEU MD2 1 55 LEU MD2 5.800 . 5.800 4.258 4.010 4.509 . 0 0 "[ . 1 . 2]" 1
324 1 12 LEU MD1 1 13 ILE H 5.770 . 5.770 4.661 4.629 4.681 . 0 0 "[ . 1 . 2]" 1
325 1 12 LEU H 1 12 LEU MD2 5.690 . 5.690 4.327 4.315 4.337 . 0 0 "[ . 1 . 2]" 1
326 1 12 LEU H 1 12 LEU MD1 5.650 . 5.650 4.042 4.031 4.058 . 0 0 "[ . 1 . 2]" 1
327 1 12 LEU H 1 14 GLU HB2 5.640 . 5.640 5.952 5.895 6.081 0.441 14 0 "[ . 1 . 2]" 1
328 1 12 LEU MD1 1 73 LYS HD3 5.630 . 5.630 3.873 3.738 4.114 . 0 0 "[ . 1 . 2]" 1
329 1 12 LEU MD2 1 16 GLU HG2 5.550 . 5.550 5.069 4.566 5.596 0.046 11 0 "[ . 1 . 2]" 1
330 1 12 LEU H 1 14 GLU H 5.530 . 5.530 4.340 4.306 4.365 . 0 0 "[ . 1 . 2]" 1
331 1 12 LEU HA 1 13 ILE H 5.520 . 5.520 3.684 3.674 3.692 . 0 0 "[ . 1 . 2]" 1
332 1 12 LEU MD2 1 70 PHE QD 5.510 . 5.510 3.077 2.953 3.252 . 0 0 "[ . 1 . 2]" 1
333 1 12 LEU MD1 1 16 GLU HB3 5.440 . 5.440 4.563 4.292 4.791 . 0 0 "[ . 1 . 2]" 1
334 1 12 LEU MD1 1 73 LYS H 5.440 . 5.440 5.238 5.161 5.404 . 0 0 "[ . 1 . 2]" 1
335 1 12 LEU HG 1 15 ASP HB3 5.420 . 5.420 5.565 5.525 5.589 0.169 16 0 "[ . 1 . 2]" 1
336 1 12 LEU MD1 1 16 GLU H 5.370 . 5.370 4.321 4.184 4.443 . 0 0 "[ . 1 . 2]" 1
337 1 12 LEU MD1 1 70 PHE H 5.350 . 5.350 5.510 5.465 5.548 0.198 5 0 "[ . 1 . 2]" 1
338 1 12 LEU MD2 1 55 LEU MD1 5.350 . 5.350 3.532 3.171 3.863 . 0 0 "[ . 1 . 2]" 1
339 1 12 LEU H 1 15 ASP H 5.340 . 5.340 5.022 4.955 5.105 . 0 0 "[ . 1 . 2]" 1
340 1 12 LEU H 1 73 LYS QE 5.260 . 5.260 4.958 4.865 5.041 . 0 0 "[ . 1 . 2]" 1
341 1 12 LEU MD2 1 70 PHE HB2 5.220 . 5.220 3.523 3.488 3.561 . 0 0 "[ . 1 . 2]" 1
342 1 12 LEU H 1 73 LYS HB3 5.850 . 5.850 6.071 5.999 6.121 0.271 7 0 "[ . 1 . 2]" 1
343 1 12 LEU MD2 1 16 GLU HG3 5.110 . 5.110 4.458 3.976 5.140 0.030 1 0 "[ . 1 . 2]" 1
344 1 12 LEU MD1 1 16 GLU HG3 5.030 . 5.030 2.673 2.341 2.829 . 0 0 "[ . 1 . 2]" 1
345 1 12 LEU H 1 73 LYS HD3 5.020 . 5.020 5.176 5.152 5.203 0.183 18 0 "[ . 1 . 2]" 1
346 1 12 LEU MD2 1 13 ILE MD 4.990 . 4.990 2.683 2.609 2.744 . 0 0 "[ . 1 . 2]" 1
347 1 12 LEU MD1 1 16 GLU HG2 4.960 . 4.960 2.689 2.191 3.095 . 0 0 "[ . 1 . 2]" 1
348 1 12 LEU MD2 1 70 PHE H 4.930 . 4.930 4.214 4.100 4.305 . 0 0 "[ . 1 . 2]" 1
349 1 12 LEU H 1 12 LEU HG 4.810 . 4.810 4.419 4.410 4.426 . 0 0 "[ . 1 . 2]" 1
350 1 12 LEU MD2 1 70 PHE HB3 4.780 . 4.780 4.875 4.843 4.920 0.140 7 0 "[ . 1 . 2]" 1
351 1 12 LEU MD1 1 73 LYS HD2 4.710 . 4.710 2.392 2.262 2.609 . 0 0 "[ . 1 . 2]" 1
352 1 12 LEU HG 1 16 GLU H 4.710 . 4.710 4.632 4.550 4.688 . 0 0 "[ . 1 . 2]" 1
353 1 12 LEU HA 1 15 ASP HB2 4.620 . 4.620 4.380 4.262 4.503 . 0 0 "[ . 1 . 2]" 1
354 1 12 LEU H 1 13 ILE H 4.500 . 4.500 2.882 2.846 2.907 . 0 0 "[ . 1 . 2]" 1
355 1 12 LEU MD1 1 70 PHE HA 4.470 . 4.470 4.331 4.279 4.397 . 0 0 "[ . 1 . 2]" 1
356 1 12 LEU HG 1 13 ILE H 4.460 . 4.460 3.756 3.717 3.798 . 0 0 "[ . 1 . 2]" 1
357 1 12 LEU MD2 1 70 PHE HA 4.440 . 4.440 2.979 2.907 3.072 . 0 0 "[ . 1 . 2]" 1
358 1 12 LEU H 1 73 LYS HD2 4.280 . 4.280 4.530 4.502 4.563 0.283 19 0 "[ . 1 . 2]" 1
359 1 12 LEU HA 1 73 LYS HD2 4.040 . 4.040 3.532 3.459 3.634 . 0 0 "[ . 1 . 2]" 1
360 1 12 LEU O 1 16 GLU N . 2.700 3.300 3.261 3.187 3.326 0.026 16 0 "[ . 1 . 2]" 1
361 1 12 LEU O 1 16 GLU H . . 2.300 2.371 2.323 2.395 0.095 3 0 "[ . 1 . 2]" 1
362 1 13 ILE MD 1 17 PHE QD 7.870 . 7.870 4.843 3.378 5.638 . 0 0 "[ . 1 . 2]" 1
363 1 13 ILE MG 1 17 PHE QE 7.610 . 7.610 4.954 3.627 5.728 . 0 0 "[ . 1 . 2]" 1
364 1 13 ILE HB 1 58 VAL MG1 6.940 . 6.940 6.282 6.152 6.487 . 0 0 "[ . 1 . 2]" 1
365 1 13 ILE MG 1 55 LEU MD2 3.940 . 3.940 3.094 2.222 4.024 0.084 11 0 "[ . 1 . 2]" 1
366 1 13 ILE MD 1 17 PHE HB2 6.550 . 6.550 5.670 4.598 6.288 . 0 0 "[ . 1 . 2]" 1
367 1 13 ILE HA 1 17 PHE QE 6.440 . 6.440 5.616 3.823 6.516 0.076 18 0 "[ . 1 . 2]" 1
368 1 13 ILE MG 1 16 GLU HB2 6.190 . 6.190 4.324 3.735 5.112 . 0 0 "[ . 1 . 2]" 1
369 1 13 ILE HA 1 16 GLU HB3 6.180 . 6.180 4.879 4.326 5.684 . 0 0 "[ . 1 . 2]" 1
370 1 13 ILE MG 1 25 LEU HG 6.070 . 6.070 3.629 2.885 5.693 . 0 0 "[ . 1 . 2]" 1
371 1 13 ILE HB 1 25 LEU MD2 6.030 . 6.030 5.883 3.785 6.208 0.178 14 0 "[ . 1 . 2]" 1
372 1 13 ILE MG 1 14 GLU HA 5.990 . 5.990 4.112 3.934 4.259 . 0 0 "[ . 1 . 2]" 1
373 1 13 ILE MG 1 59 SER HB2 5.930 . 5.930 4.805 4.451 5.938 0.008 8 0 "[ . 1 . 2]" 1
374 1 13 ILE MG 1 17 PHE QD 5.880 . 5.880 3.444 2.355 4.144 . 0 0 "[ . 1 . 2]" 1
375 1 13 ILE MD 1 25 LEU HB2 5.840 . 5.840 5.158 4.920 5.356 . 0 0 "[ . 1 . 2]" 1
376 1 13 ILE HA 1 15 ASP H 5.840 . 5.840 4.571 4.520 4.615 . 0 0 "[ . 1 . 2]" 1
377 1 13 ILE HG13 1 55 LEU MD2 5.830 . 5.830 4.538 3.083 5.911 0.081 9 0 "[ . 1 . 2]" 1
378 1 13 ILE MG 1 18 GLY H 5.760 . 5.760 4.266 3.928 4.625 . 0 0 "[ . 1 . 2]" 1
379 1 13 ILE MD 1 25 LEU HB3 5.730 . 5.730 5.296 5.148 5.520 . 0 0 "[ . 1 . 2]" 1
380 1 13 ILE MG 1 17 PHE H 5.680 . 5.680 3.830 3.634 4.048 . 0 0 "[ . 1 . 2]" 1
381 1 13 ILE MG 1 22 LEU HB3 5.670 . 5.670 4.898 4.613 5.150 . 0 0 "[ . 1 . 2]" 1
382 1 13 ILE HA 1 16 GLU HB2 5.570 . 5.570 3.320 2.804 4.105 . 0 0 "[ . 1 . 2]" 1
383 1 13 ILE HG13 1 25 LEU HG 5.570 . 5.570 4.311 3.272 5.140 . 0 0 "[ . 1 . 2]" 1
384 1 13 ILE MD 1 55 LEU HB3 5.560 . 5.560 4.885 4.546 5.114 . 0 0 "[ . 1 . 2]" 1
385 1 13 ILE MG 1 59 SER H 6.000 2.150 6.000 6.163 6.041 6.243 0.243 3 0 "[ . 1 . 2]" 1
386 1 13 ILE HA 1 55 LEU MD2 5.490 . 5.490 4.726 4.096 5.535 0.045 19 0 "[ . 1 . 2]" 1
387 1 13 ILE H 1 55 LEU MD1 5.480 . 5.480 5.306 4.976 5.597 0.117 1 0 "[ . 1 . 2]" 1
388 1 13 ILE H 1 13 ILE MD 5.460 . 5.460 2.638 2.548 2.688 . 0 0 "[ . 1 . 2]" 1
389 1 13 ILE HA 1 18 GLY H 5.440 . 5.440 5.079 4.758 5.288 . 0 0 "[ . 1 . 2]" 1
390 1 13 ILE HA 1 17 PHE H 5.440 . 5.440 3.907 3.504 4.124 . 0 0 "[ . 1 . 2]" 1
391 1 13 ILE HA 1 16 GLU H 5.420 . 5.420 3.625 3.472 3.832 . 0 0 "[ . 1 . 2]" 1
392 1 13 ILE MG 1 25 LEU HB3 5.410 . 5.410 4.812 4.548 5.026 . 0 0 "[ . 1 . 2]" 1
393 1 13 ILE HB 1 22 LEU QD 5.410 . 5.410 2.024 1.739 2.719 . 0 0 "[ . 1 . 2]" 1
394 1 13 ILE MG 1 17 PHE HB3 5.400 . 5.400 4.685 3.350 5.351 . 0 0 "[ . 1 . 2]" 1
395 1 13 ILE HA 1 55 LEU MD1 5.400 . 5.400 4.929 4.369 5.432 0.032 13 0 "[ . 1 . 2]" 1
396 1 13 ILE MG 1 25 LEU H 5.390 . 5.390 4.813 4.604 4.994 . 0 0 "[ . 1 . 2]" 1
397 1 13 ILE MG 1 59 SER HB3 5.350 . 5.350 5.458 4.772 5.555 0.205 12 0 "[ . 1 . 2]" 1
398 1 13 ILE HA 1 17 PHE QD 5.350 . 5.350 4.041 2.350 4.797 . 0 0 "[ . 1 . 2]" 1
399 1 13 ILE MD 1 25 LEU MD2 5.350 . 5.350 4.301 2.926 4.816 . 0 0 "[ . 1 . 2]" 1
400 1 13 ILE MD 1 55 LEU HA 5.340 . 5.340 4.970 4.844 5.098 . 0 0 "[ . 1 . 2]" 1
401 1 13 ILE MG 1 14 GLU H 5.330 . 5.330 4.091 4.013 4.157 . 0 0 "[ . 1 . 2]" 1
402 1 13 ILE H 1 14 GLU H 5.330 . 5.330 2.605 2.564 2.639 . 0 0 "[ . 1 . 2]" 1
403 1 13 ILE HG12 1 14 GLU H 5.330 . 5.330 3.691 3.612 3.815 . 0 0 "[ . 1 . 2]" 1
404 1 13 ILE MD 1 14 GLU H 5.270 . 5.270 4.519 4.480 4.553 . 0 0 "[ . 1 . 2]" 1
405 1 13 ILE HB 1 22 LEU MD1 5.210 . 5.210 2.029 1.740 2.731 . 0 0 "[ . 1 . 2]" 1
406 1 13 ILE MG 1 17 PHE HB2 5.190 . 5.190 3.270 2.047 3.946 . 0 0 "[ . 1 . 2]" 1
407 1 13 ILE MD 1 22 LEU HA 5.180 . 5.180 5.165 5.009 5.259 0.079 9 0 "[ . 1 . 2]" 1
408 1 13 ILE HA 1 14 GLU H 5.180 . 5.180 3.611 3.602 3.619 . 0 0 "[ . 1 . 2]" 1
409 1 13 ILE MD 1 55 LEU HB2 5.150 . 5.150 4.658 4.104 5.091 . 0 0 "[ . 1 . 2]" 1
410 1 13 ILE H 1 16 GLU H 5.110 . 5.110 4.951 4.843 5.090 . 0 0 "[ . 1 . 2]" 1
411 1 13 ILE HA 1 21 THR MG 5.050 . 5.050 5.001 4.796 5.068 0.018 20 0 "[ . 1 . 2]" 1
412 1 13 ILE MD 1 51 LEU HB3 5.020 . 5.020 5.118 5.020 5.209 0.189 18 0 "[ . 1 . 2]" 1
413 1 13 ILE MD 1 25 LEU MD1 5.000 . 5.000 3.002 2.477 3.958 . 0 0 "[ . 1 . 2]" 1
414 1 13 ILE MG 1 21 THR HA 4.950 . 4.950 4.953 4.779 5.055 0.105 14 0 "[ . 1 . 2]" 1
415 1 13 ILE MG 1 21 THR HB 4.660 . 4.660 3.160 2.919 3.372 . 0 0 "[ . 1 . 2]" 1
416 1 13 ILE MG 1 22 LEU H 4.590 . 4.590 3.814 3.615 4.102 . 0 0 "[ . 1 . 2]" 1
417 1 13 ILE MD 1 55 LEU HG 4.560 . 4.560 3.335 2.977 3.580 . 0 0 "[ . 1 . 2]" 1
418 1 13 ILE MD 1 55 LEU MD2 4.470 . 4.470 2.710 1.615 3.705 0.035 17 0 "[ . 1 . 2]" 1
419 1 13 ILE MG 1 25 LEU HB2 4.410 . 4.410 3.938 3.498 4.225 . 0 0 "[ . 1 . 2]" 1
420 1 13 ILE MD 1 51 LEU MD1 6.110 . 6.110 5.271 5.144 5.430 . 0 0 "[ . 1 . 2]" 1
421 1 13 ILE O 1 17 PHE N . 2.700 3.300 3.254 3.014 3.361 0.061 15 0 "[ . 1 . 2]" 1
422 1 13 ILE HB 1 14 GLU H 4.270 . 4.270 2.898 2.826 2.982 . 0 0 "[ . 1 . 2]" 1
423 1 13 ILE HB 1 25 LEU MD1 5.440 . 5.440 4.121 3.327 5.600 0.160 19 0 "[ . 1 . 2]" 1
424 1 13 ILE HG13 1 25 LEU HB3 4.200 . 4.200 4.506 4.317 4.650 0.450 3 0 "[ . 1 . 2]" 1
425 1 13 ILE HG13 1 25 LEU HB2 4.130 . 4.130 4.166 4.072 4.254 0.124 3 0 "[ . 1 . 2]" 1
426 1 13 ILE MG 1 22 LEU HA 3.800 . 3.800 2.804 2.377 3.043 . 0 0 "[ . 1 . 2]" 1
427 1 13 ILE O 1 17 PHE H . . 2.300 2.279 2.102 2.362 0.062 15 0 "[ . 1 . 2]" 1
428 1 14 GLU HB2 1 22 LEU H 6.500 . 6.500 5.947 5.832 6.045 . 0 0 "[ . 1 . 2]" 1
429 1 14 GLU HG3 1 15 ASP HA 6.280 . 6.280 5.607 5.417 5.668 . 0 0 "[ . 1 . 2]" 1
430 1 14 GLU H 1 18 GLY H 6.240 . 6.240 5.109 4.902 5.236 . 0 0 "[ . 1 . 2]" 1
431 1 14 GLU HA 1 18 GLY HA2 6.040 . 6.040 4.161 3.751 4.370 . 0 0 "[ . 1 . 2]" 1
432 1 14 GLU HA 1 16 GLU H 5.950 . 5.950 4.473 4.321 4.635 . 0 0 "[ . 1 . 2]" 1
433 1 14 GLU HA 1 19 TYR QD 5.900 . 5.900 5.146 4.436 5.820 . 0 0 "[ . 1 . 2]" 1
434 1 14 GLU HB3 1 17 PHE H 5.900 . 5.900 6.037 5.874 6.139 0.239 6 0 "[ . 1 . 2]" 1
435 1 14 GLU HA 1 17 PHE H 5.780 . 5.780 4.106 4.006 4.160 . 0 0 "[ . 1 . 2]" 1
436 1 14 GLU H 1 17 PHE H 5.750 . 5.750 5.094 4.785 5.251 . 0 0 "[ . 1 . 2]" 1
437 1 14 GLU H 1 22 LEU HB3 5.740 . 5.740 5.734 5.555 5.836 0.096 11 0 "[ . 1 . 2]" 1
438 1 14 GLU HB3 1 18 GLY H 5.730 . 5.730 5.436 5.322 5.509 . 0 0 "[ . 1 . 2]" 1
439 1 14 GLU H 1 22 LEU QD 5.630 . 5.630 2.836 2.731 2.960 . 0 0 "[ . 1 . 2]" 1
440 1 14 GLU HA 1 18 GLY HA3 5.570 . 5.570 4.948 4.819 5.023 . 0 0 "[ . 1 . 2]" 1
441 1 14 GLU HA 1 22 LEU QD 5.540 . 5.540 3.068 2.838 3.225 . 0 0 "[ . 1 . 2]" 1
442 1 14 GLU H 1 22 LEU HG 5.480 . 5.480 5.750 5.515 5.893 0.413 19 0 "[ . 1 . 2]" 1
443 1 14 GLU HG2 1 18 GLY H 5.460 . 5.460 4.641 4.494 4.794 . 0 0 "[ . 1 . 2]" 1
444 1 14 GLU H 1 16 GLU H 5.420 . 5.420 4.145 4.006 4.305 . 0 0 "[ . 1 . 2]" 1
445 1 14 GLU HG3 1 18 GLY H 5.400 . 5.400 4.982 4.857 5.184 . 0 0 "[ . 1 . 2]" 1
446 1 14 GLU H 1 14 GLU HG3 5.380 . 5.380 4.341 4.306 4.393 . 0 0 "[ . 1 . 2]" 1
447 1 14 GLU HA 1 22 LEU MD1 5.280 . 5.280 3.432 2.965 3.833 . 0 0 "[ . 1 . 2]" 1
448 1 14 GLU H 1 22 LEU HA 5.650 . 5.650 5.595 5.505 5.716 0.066 3 0 "[ . 1 . 2]" 1
449 1 14 GLU HG3 1 19 TYR H 5.150 . 5.150 4.568 3.657 5.074 . 0 0 "[ . 1 . 2]" 1
450 1 14 GLU HG3 1 22 LEU QD 5.080 . 5.080 2.461 1.884 2.986 . 0 0 "[ . 1 . 2]" 1
451 1 14 GLU HG2 1 19 TYR HB3 5.010 . 5.010 4.414 3.405 5.216 0.206 9 0 "[ . 1 . 2]" 1
452 1 14 GLU HG2 1 15 ASP H 4.990 . 4.990 4.260 4.123 4.315 . 0 0 "[ . 1 . 2]" 1
453 1 14 GLU HG3 1 15 ASP H 4.970 . 4.970 5.068 5.002 5.109 0.139 1 0 "[ . 1 . 2]" 1
454 1 14 GLU HG3 1 19 TYR HB2 4.860 . 4.860 3.321 2.599 3.736 . 0 0 "[ . 1 . 2]" 1
455 1 14 GLU HG2 1 19 TYR HB2 4.860 . 4.860 4.183 3.456 5.045 0.185 7 0 "[ . 1 . 2]" 1
456 1 14 GLU H 1 15 ASP H 4.850 . 4.850 2.631 2.578 2.716 . 0 0 "[ . 1 . 2]" 1
457 1 14 GLU HA 1 19 TYR HA 4.820 . 4.820 3.310 3.208 3.447 . 0 0 "[ . 1 . 2]" 1
458 1 14 GLU HB2 1 22 LEU MD1 4.800 . 4.800 2.779 1.822 3.264 . 0 0 "[ . 1 . 2]" 1
459 1 14 GLU HG3 1 19 TYR HB3 4.780 . 4.780 3.731 2.513 4.835 0.055 1 0 "[ . 1 . 2]" 1
460 1 14 GLU HA 1 15 ASP H 4.780 . 4.780 3.616 3.601 3.629 . 0 0 "[ . 1 . 2]" 1
461 1 14 GLU HG3 1 22 LEU MD1 4.700 . 4.700 3.872 2.691 4.474 . 0 0 "[ . 1 . 2]" 1
462 1 14 GLU HA 1 18 GLY H 4.440 . 4.440 3.018 2.845 3.122 . 0 0 "[ . 1 . 2]" 1
463 1 14 GLU HB3 1 15 ASP H 4.180 . 4.180 2.566 2.504 2.611 . 0 0 "[ . 1 . 2]" 1
464 1 14 GLU HG2 1 19 TYR HA 3.960 . 3.960 3.924 3.721 4.058 0.098 12 0 "[ . 1 . 2]" 1
465 1 14 GLU HG3 1 19 TYR HA 3.560 . 3.560 2.671 2.465 2.775 . 0 0 "[ . 1 . 2]" 1
466 1 15 ASP HB3 1 16 GLU HG2 6.070 . 6.070 3.422 2.830 3.824 . 0 0 "[ . 1 . 2]" 1
467 1 15 ASP H 1 16 GLU HA 5.690 . 5.690 5.145 5.060 5.225 . 0 0 "[ . 1 . 2]" 1
468 1 15 ASP H 1 18 GLY H 5.280 . 5.280 4.840 4.756 4.921 . 0 0 "[ . 1 . 2]" 1
469 1 15 ASP H 1 16 GLU H 5.010 . 5.010 2.684 2.596 2.785 . 0 0 "[ . 1 . 2]" 1
470 1 15 ASP HA 1 16 GLU H 4.820 . 4.820 3.617 3.584 3.659 . 0 0 "[ . 1 . 2]" 1
471 1 15 ASP HB2 1 16 GLU H 4.410 . 4.410 4.066 4.003 4.105 . 0 0 "[ . 1 . 2]" 1
472 1 15 ASP HB3 1 16 GLU H 4.400 . 4.400 2.928 2.877 3.008 . 0 0 "[ . 1 . 2]" 1
473 1 16 GLU HG2 1 17 PHE QE 6.800 . 6.800 5.910 5.700 6.221 . 0 0 "[ . 1 . 2]" 1
474 1 16 GLU HG2 1 17 PHE QD 6.580 . 6.580 5.488 5.326 5.794 . 0 0 "[ . 1 . 2]" 1
475 1 16 GLU H 1 17 PHE QD 6.280 . 6.280 4.717 4.168 5.129 . 0 0 "[ . 1 . 2]" 1
476 1 16 GLU HG3 1 17 PHE QD 6.220 . 6.220 4.873 4.459 5.642 . 0 0 "[ . 1 . 2]" 1
477 1 16 GLU HG3 1 17 PHE QE 5.740 . 5.740 4.786 4.407 5.163 . 0 0 "[ . 1 . 2]" 1
478 1 16 GLU HB2 1 18 GLY H 5.610 . 5.610 5.060 4.772 5.439 . 0 0 "[ . 1 . 2]" 1
479 1 16 GLU H 1 16 GLU HG3 5.580 . 5.580 4.140 4.012 4.233 . 0 0 "[ . 1 . 2]" 1
480 1 16 GLU HB3 1 17 PHE QE 5.280 . 5.280 3.534 3.183 4.239 . 0 0 "[ . 1 . 2]" 1
481 1 16 GLU H 1 16 GLU HG2 5.260 . 5.260 3.072 2.765 3.195 . 0 0 "[ . 1 . 2]" 1
482 1 16 GLU HB2 1 17 PHE QE 5.240 . 5.240 4.370 3.723 4.877 . 0 0 "[ . 1 . 2]" 1
483 1 16 GLU HB3 1 17 PHE QD 5.150 . 5.150 2.969 2.350 4.220 . 0 0 "[ . 1 . 2]" 1
484 1 16 GLU HB3 1 17 PHE H 5.010 . 5.010 3.532 3.185 4.005 . 0 0 "[ . 1 . 2]" 1
485 1 16 GLU HB2 1 17 PHE QD 5.010 . 5.010 3.364 2.907 3.574 . 0 0 "[ . 1 . 2]" 1
486 1 16 GLU H 1 17 PHE H 4.920 . 4.920 2.623 2.291 2.809 . 0 0 "[ . 1 . 2]" 1
487 1 16 GLU HB2 1 17 PHE H 4.910 . 4.910 3.071 2.945 3.276 . 0 0 "[ . 1 . 2]" 1
488 1 16 GLU HA 1 17 PHE H 4.870 . 4.870 3.668 3.588 3.710 . 0 0 "[ . 1 . 2]" 1
489 1 16 GLU H 1 18 GLY H 4.770 . 4.770 3.984 3.882 4.059 . 0 0 "[ . 1 . 2]" 1
490 1 17 PHE HB2 1 59 SER HB2 7.010 . 7.010 5.670 5.099 6.701 . 0 0 "[ . 1 . 2]" 1
491 1 17 PHE QE 1 69 LEU MD1 6.850 . 6.850 5.796 4.857 6.554 . 0 0 "[ . 1 . 2]" 1
492 1 17 PHE QE 1 61 VAL MG1 5.590 . 5.590 5.017 4.097 5.599 0.009 8 0 "[ . 1 . 2]" 1
493 1 17 PHE QE 1 55 LEU MD2 6.020 . 6.020 4.710 2.019 5.960 . 0 0 "[ . 1 . 2]" 1
494 1 17 PHE HA 1 21 THR MG 5.990 . 5.990 5.698 4.930 6.078 0.088 7 0 "[ . 1 . 2]" 1
495 1 17 PHE HB2 1 21 THR H 5.940 . 5.940 5.151 4.824 5.548 . 0 0 "[ . 1 . 2]" 1
496 1 17 PHE QD 1 59 SER HB2 5.760 . 5.760 4.566 2.909 5.242 . 0 0 "[ . 1 . 2]" 1
497 1 17 PHE QD 1 21 THR HB 5.650 . 5.650 4.808 4.063 5.039 . 0 0 "[ . 1 . 2]" 1
498 1 17 PHE H 1 17 PHE QD 5.640 . 5.640 3.270 3.010 3.479 . 0 0 "[ . 1 . 2]" 1
499 1 17 PHE HB3 1 21 THR HB 5.400 . 5.400 3.635 2.777 4.163 . 0 0 "[ . 1 . 2]" 1
500 1 17 PHE HB2 1 21 THR HB 5.350 . 5.350 3.202 3.074 3.346 . 0 0 "[ . 1 . 2]" 1
501 1 17 PHE QD 1 55 LEU MD2 5.340 . 5.340 4.845 3.257 5.429 0.089 5 0 "[ . 1 . 2]" 1
502 1 17 PHE QE 1 59 SER HB3 5.270 . 5.270 4.032 2.642 4.932 . 0 0 "[ . 1 . 2]" 1
503 1 17 PHE QD 1 61 VAL MG2 5.200 . 5.200 4.732 4.176 5.118 . 0 0 "[ . 1 . 2]" 1
504 1 17 PHE QE 1 59 SER HB2 5.190 . 5.190 4.495 2.832 5.109 . 0 0 "[ . 1 . 2]" 1
505 1 17 PHE QD 1 18 GLY H 5.190 . 5.190 4.699 4.446 4.859 . 0 0 "[ . 1 . 2]" 1
506 1 17 PHE QD 1 21 THR MG 5.140 . 5.140 3.952 2.570 4.254 . 0 0 "[ . 1 . 2]" 1
507 1 17 PHE H 1 21 THR HB 5.060 . 5.060 4.789 4.540 5.117 0.057 1 0 "[ . 1 . 2]" 1
508 1 17 PHE HB2 1 18 GLY H 4.930 . 4.930 3.304 2.937 3.504 . 0 0 "[ . 1 . 2]" 1
509 1 17 PHE HB3 1 18 GLY H 4.700 . 4.700 3.972 3.757 4.075 . 0 0 "[ . 1 . 2]" 1
510 1 17 PHE HB3 1 21 THR MG 4.570 . 4.570 3.725 2.681 4.360 . 0 0 "[ . 1 . 2]" 1
511 1 17 PHE HB2 1 21 THR MG 4.420 . 4.420 3.360 3.206 3.492 . 0 0 "[ . 1 . 2]" 1
512 1 17 PHE QE 1 61 VAL MG2 4.410 . 4.410 3.449 2.299 3.933 . 0 0 "[ . 1 . 2]" 1
513 1 17 PHE H 1 18 GLY H 3.890 . 3.890 2.089 1.967 2.207 . 0 0 "[ . 1 . 2]" 1
514 1 18 GLY H 1 20 GLU H 5.960 . 5.960 5.418 5.221 5.650 . 0 0 "[ . 1 . 2]" 1
515 1 18 GLY H 1 22 LEU HB2 5.780 . 5.780 4.802 4.519 5.111 . 0 0 "[ . 1 . 2]" 1
516 1 18 GLY HA2 1 21 THR H 5.770 . 5.770 4.938 4.730 5.109 . 0 0 "[ . 1 . 2]" 1
517 1 18 GLY H 1 19 TYR HA 5.580 . 5.580 4.631 4.565 4.856 . 0 0 "[ . 1 . 2]" 1
518 1 18 GLY H 1 19 TYR H 5.350 . 5.350 4.442 4.264 4.472 . 0 0 "[ . 1 . 2]" 1
519 1 18 GLY HA2 1 20 GLU H 5.110 . 5.110 4.230 4.136 4.295 . 0 0 "[ . 1 . 2]" 1
520 1 18 GLY HA3 1 21 THR H 5.060 . 5.060 3.527 3.228 3.879 . 0 0 "[ . 1 . 2]" 1
521 1 18 GLY H 1 21 THR HB 4.880 . 4.880 4.100 3.944 4.261 . 0 0 "[ . 1 . 2]" 1
522 1 18 GLY HA3 1 20 GLU H 4.870 . 4.870 3.256 3.121 3.461 . 0 0 "[ . 1 . 2]" 1
523 1 18 GLY HA2 1 19 TYR H 4.530 . 4.530 2.682 2.363 2.729 . 0 0 "[ . 1 . 2]" 1
524 1 18 GLY HA3 1 19 TYR H 4.410 . 4.410 2.647 2.591 2.803 . 0 0 "[ . 1 . 2]" 1
525 1 18 GLY O 1 22 LEU N . 2.700 3.300 3.460 3.274 3.531 0.231 7 0 "[ . 1 . 2]" 1
526 1 18 GLY O 1 22 LEU H . . 2.300 2.563 2.344 2.599 0.299 7 0 "[ . 1 . 2]" 1
527 1 19 TYR QE 1 20 GLU HG2 7.630 . 7.630 5.039 3.497 6.329 . 0 0 "[ . 1 . 2]" 1
528 1 19 TYR QD 1 20 GLU HB3 7.380 . 7.380 5.682 4.358 6.004 . 0 0 "[ . 1 . 2]" 1
529 1 19 TYR QE 1 20 GLU HG3 7.350 . 7.350 5.184 3.499 6.838 . 0 0 "[ . 1 . 2]" 1
530 1 19 TYR QD 1 23 ASP HB3 7.350 . 7.350 5.406 4.945 6.089 . 0 0 "[ . 1 . 2]" 1
531 1 19 TYR QE 1 23 ASP HB2 6.870 . 6.870 4.883 3.692 6.291 . 0 0 "[ . 1 . 2]" 1
532 1 19 TYR HB3 1 22 LEU MD1 6.540 . 6.540 6.234 4.560 6.898 0.358 11 0 "[ . 1 . 2]" 1
533 1 19 TYR H 1 22 LEU HB2 6.180 . 6.180 5.199 4.938 5.406 . 0 0 "[ . 1 . 2]" 1
534 1 19 TYR QD 1 20 GLU HA 5.680 . 5.680 3.618 3.347 3.874 . 0 0 "[ . 1 . 2]" 1
535 1 19 TYR HA 1 22 LEU MD2 5.330 . 5.330 3.163 2.751 3.701 . 0 0 "[ . 1 . 2]" 1
536 1 19 TYR HA 1 22 LEU HB3 5.290 . 5.290 2.258 2.124 2.471 . 0 0 "[ . 1 . 2]" 1
537 1 19 TYR HA 1 22 LEU QD 5.110 . 5.110 3.045 2.723 3.338 . 0 0 "[ . 1 . 2]" 1
538 1 19 TYR HA 1 22 LEU MD1 4.890 . 4.890 4.276 3.695 4.622 . 0 0 "[ . 1 . 2]" 1
539 1 19 TYR HA 1 22 LEU HB2 4.820 . 4.820 2.624 2.486 2.944 . 0 0 "[ . 1 . 2]" 1
540 1 19 TYR HB2 1 20 GLU H 4.700 . 4.700 4.265 4.153 4.381 . 0 0 "[ . 1 . 2]" 1
541 1 19 TYR HA 1 23 ASP H 4.620 . 4.620 3.998 3.838 4.162 . 0 0 "[ . 1 . 2]" 1
542 1 19 TYR QD 1 20 GLU H 4.610 . 4.610 3.909 3.561 4.207 . 0 0 "[ . 1 . 2]" 1
543 1 19 TYR HA 1 20 GLU H 4.570 . 4.570 3.520 3.468 3.593 . 0 0 "[ . 1 . 2]" 1
544 1 19 TYR HB3 1 20 GLU H 4.510 . 4.510 3.709 3.012 4.469 . 0 0 "[ . 1 . 2]" 1
545 1 19 TYR HA 1 22 LEU H 4.360 . 4.360 2.897 2.789 3.065 . 0 0 "[ . 1 . 2]" 1
546 1 19 TYR H 1 20 GLU H 4.200 . 4.200 2.070 1.896 2.796 . 0 0 "[ . 1 . 2]" 1
547 1 19 TYR O 1 23 ASP N . 2.700 3.300 2.892 2.809 3.021 . 0 0 "[ . 1 . 2]" 1
548 1 19 TYR O 1 23 ASP H . . 2.300 2.059 1.960 2.164 . 0 0 "[ . 1 . 2]" 1
549 1 20 GLU H 1 23 ASP HB2 5.950 . 5.950 5.346 5.205 5.481 . 0 0 "[ . 1 . 2]" 1
550 1 20 GLU H 1 23 ASP H 5.770 . 5.770 4.561 4.491 4.677 . 0 0 "[ . 1 . 2]" 1
551 1 20 GLU H 1 22 LEU H 5.580 . 5.580 3.814 3.756 3.899 . 0 0 "[ . 1 . 2]" 1
552 1 20 GLU HB3 1 23 ASP HB2 5.390 . 5.390 5.219 4.300 5.440 0.050 17 0 "[ . 1 . 2]" 1
553 1 20 GLU HG3 1 21 THR H 5.350 . 5.350 4.364 2.414 4.492 . 0 0 "[ . 1 . 2]" 1
554 1 20 GLU H 1 20 GLU HG3 5.330 . 5.330 2.519 2.445 3.256 . 0 0 "[ . 1 . 2]" 1
555 1 20 GLU HG2 1 21 THR H 5.310 . 5.310 5.016 2.622 5.182 . 0 0 "[ . 1 . 2]" 1
556 1 20 GLU HA 1 21 THR HA 5.210 . 5.210 4.741 4.725 4.758 . 0 0 "[ . 1 . 2]" 1
557 1 20 GLU HB2 1 21 THR HA 5.210 . 5.210 4.341 4.294 4.538 . 0 0 "[ . 1 . 2]" 1
558 1 20 GLU H 1 20 GLU HG2 4.810 . 4.810 3.622 2.072 3.764 . 0 0 "[ . 1 . 2]" 1
559 1 20 GLU H 1 21 THR H 4.810 . 4.810 2.538 2.481 2.717 . 0 0 "[ . 1 . 2]" 1
560 1 20 GLU HA 1 21 THR H 4.550 . 4.550 3.606 3.597 3.626 . 0 0 "[ . 1 . 2]" 1
561 1 20 GLU HB3 1 21 THR H 4.250 . 4.250 3.689 3.548 4.083 . 0 0 "[ . 1 . 2]" 1
562 1 20 GLU H 1 20 GLU HB3 4.250 . 4.250 3.585 2.717 3.639 . 0 0 "[ . 1 . 2]" 1
563 1 20 GLU HA 1 23 ASP H 4.230 . 4.230 3.251 3.149 3.357 . 0 0 "[ . 1 . 2]" 1
564 1 20 GLU HA 1 23 ASP HB3 4.170 . 4.170 3.342 3.066 4.343 0.173 1 0 "[ . 1 . 2]" 1
565 1 20 GLU O 1 24 THR N . 2.700 3.300 3.293 3.250 3.376 0.076 17 0 "[ . 1 . 2]" 1
566 1 20 GLU O 1 24 THR H . . 2.300 2.467 2.420 2.542 0.242 17 0 "[ . 1 . 2]" 1
567 1 21 THR MG 1 55 LEU MD2 6.850 . 6.850 4.190 3.552 5.006 . 0 0 "[ . 1 . 2]" 1
568 1 21 THR MG 1 24 THR H 6.420 . 6.420 4.257 4.195 4.338 . 0 0 "[ . 1 . 2]" 1
569 1 21 THR H 1 24 THR HB 6.020 . 6.020 6.029 5.991 6.071 0.051 17 0 "[ . 1 . 2]" 1
570 1 21 THR HB 1 24 THR HB 5.960 . 5.960 5.785 5.722 5.864 . 0 0 "[ . 1 . 2]" 1
571 1 21 THR H 1 58 VAL MG2 5.540 . 5.540 5.550 5.402 5.659 0.119 17 0 "[ . 1 . 2]" 1
572 1 21 THR MG 1 24 THR HB 5.430 . 5.430 3.444 3.363 3.552 . 0 0 "[ . 1 . 2]" 1
573 1 21 THR H 1 24 THR H 5.430 . 5.430 4.902 4.848 4.973 . 0 0 "[ . 1 . 2]" 1
574 1 21 THR HA 1 25 LEU H 5.080 . 5.080 4.606 4.554 4.659 . 0 0 "[ . 1 . 2]" 1
575 1 21 THR HA 1 22 LEU H 5.060 . 5.060 3.595 3.565 3.612 . 0 0 "[ . 1 . 2]" 1
576 1 21 THR H 1 23 ASP H 5.050 . 5.050 4.007 3.948 4.093 . 0 0 "[ . 1 . 2]" 1
577 1 21 THR H 1 22 LEU H 4.950 . 4.950 2.527 2.483 2.596 . 0 0 "[ . 1 . 2]" 1
578 1 21 THR MG 1 55 LEU HA 4.680 . 4.680 4.899 4.810 5.022 0.342 8 0 "[ . 1 . 2]" 1
579 1 21 THR MG 1 59 SER HB2 4.600 . 4.600 3.650 3.079 4.733 0.133 8 0 "[ . 1 . 2]" 1
580 1 21 THR HA 1 24 THR H 4.530 . 4.530 3.268 3.200 3.359 . 0 0 "[ . 1 . 2]" 1
581 1 21 THR MG 1 59 SER HB3 4.420 . 4.420 4.574 3.289 4.742 0.322 10 0 "[ . 1 . 2]" 1
582 1 21 THR HB 1 22 LEU H 4.250 . 4.250 2.691 2.667 2.716 . 0 0 "[ . 1 . 2]" 1
583 1 21 THR HA 1 24 THR HB 4.050 . 4.050 3.395 3.347 3.430 . 0 0 "[ . 1 . 2]" 1
584 1 21 THR O 1 25 LEU N . 2.700 3.300 3.314 3.230 3.370 0.070 2 0 "[ . 1 . 2]" 1
585 1 21 THR O 1 25 LEU H . . 2.300 2.381 2.317 2.437 0.137 2 0 "[ . 1 . 2]" 1
586 1 22 LEU HA 1 23 ASP HA 5.920 . 5.920 4.792 4.783 4.808 . 0 0 "[ . 1 . 2]" 1
587 1 22 LEU H 1 24 THR H 5.750 . 5.750 4.263 4.215 4.311 . 0 0 "[ . 1 . 2]" 1
588 1 22 LEU H 1 24 THR HB 5.620 . 5.620 5.744 5.711 5.778 0.158 7 0 "[ . 1 . 2]" 1
589 1 22 LEU HA 1 25 LEU HG 5.290 . 5.290 4.045 3.345 5.536 0.246 6 0 "[ . 1 . 2]" 1
590 1 22 LEU QD 1 23 ASP H 5.250 . 5.250 3.891 3.205 4.096 . 0 0 "[ . 1 . 2]" 1
591 1 22 LEU HA 1 25 LEU MD2 5.110 . 5.110 4.911 3.550 5.215 0.105 12 0 "[ . 1 . 2]" 1
592 1 22 LEU H 1 23 ASP H 4.930 . 4.930 2.738 2.703 2.773 . 0 0 "[ . 1 . 2]" 1
593 1 22 LEU HA 1 25 LEU MD1 4.800 . 4.800 3.811 2.945 4.955 0.155 18 0 "[ . 1 . 2]" 1
594 1 22 LEU HG 1 23 ASP H 4.930 . 4.930 4.115 3.952 4.459 . 0 0 "[ . 1 . 2]" 1
595 1 22 LEU HB3 1 23 ASP H 4.630 . 4.630 2.730 2.678 2.774 . 0 0 "[ . 1 . 2]" 1
596 1 22 LEU HB2 1 23 ASP H 4.480 . 4.480 3.990 3.940 4.058 . 0 0 "[ . 1 . 2]" 1
597 1 22 LEU HA 1 25 LEU H 4.130 . 4.130 3.516 3.381 3.622 . 0 0 "[ . 1 . 2]" 1
598 1 22 LEU O 1 26 LEU N . 2.700 3.300 3.156 3.060 3.236 . 0 0 "[ . 1 . 2]" 1
599 1 22 LEU O 1 26 LEU H . . 2.300 2.265 2.191 2.325 0.025 10 0 "[ . 1 . 2]" 1
600 1 23 ASP HB2 1 25 LEU H 6.040 . 6.040 5.804 5.112 5.989 . 0 0 "[ . 1 . 2]" 1
601 1 23 ASP HB3 1 25 LEU H 5.740 . 5.740 5.223 5.050 5.625 . 0 0 "[ . 1 . 2]" 1
602 1 23 ASP HA 1 26 LEU HB3 5.540 . 5.540 4.420 4.051 4.686 . 0 0 "[ . 1 . 2]" 1
603 1 23 ASP HA 1 24 THR HA 5.210 . 5.210 4.745 4.735 4.762 . 0 0 "[ . 1 . 2]" 1
604 1 23 ASP HA 1 27 GLU H 5.200 . 5.200 4.649 4.585 4.703 . 0 0 "[ . 1 . 2]" 1
605 1 23 ASP H 1 24 THR HB 5.100 . 5.100 5.148 5.130 5.169 0.069 8 0 "[ . 1 . 2]" 1
606 1 23 ASP HB3 1 24 THR HA 4.930 . 4.930 4.074 3.997 4.177 . 0 0 "[ . 1 . 2]" 1
607 1 23 ASP H 1 24 THR H 4.750 . 4.750 2.726 2.697 2.752 . 0 0 "[ . 1 . 2]" 1
608 1 23 ASP HA 1 26 LEU HB2 4.600 . 4.600 2.724 2.495 2.945 . 0 0 "[ . 1 . 2]" 1
609 1 23 ASP HA 1 24 THR H 4.250 . 4.250 3.624 3.617 3.633 . 0 0 "[ . 1 . 2]" 1
610 1 23 ASP HB3 1 24 THR H 3.990 . 3.990 2.981 2.805 3.768 . 0 0 "[ . 1 . 2]" 1
611 1 23 ASP O 1 27 GLU N . 2.700 3.300 3.125 3.062 3.189 . 0 0 "[ . 1 . 2]" 1
612 1 23 ASP O 1 27 GLU H . . 2.300 2.490 2.447 2.526 0.226 1 0 "[ . 1 . 2]" 1
613 1 24 THR MG 1 28 SER H 6.080 . 6.080 3.973 3.878 4.136 . 0 0 "[ . 1 . 2]" 1
614 1 24 THR HB 1 28 SER H 5.810 . 5.810 5.877 5.836 5.918 0.108 4 0 "[ . 1 . 2]" 1
615 1 24 THR MG 1 58 VAL MG1 5.740 . 5.740 4.103 3.898 4.355 . 0 0 "[ . 1 . 2]" 1
616 1 24 THR HA 1 27 GLU HG2 5.430 . 5.430 4.989 4.825 5.154 . 0 0 "[ . 1 . 2]" 1
617 1 24 THR HB 1 54 LYS HG3 5.410 . 5.410 5.269 5.129 5.445 0.035 5 0 "[ . 1 . 2]" 1
618 1 24 THR MG 1 54 LYS HE2 5.380 . 5.380 3.127 3.010 3.292 . 0 0 "[ . 1 . 2]" 1
619 1 24 THR HB 1 27 GLU H 5.340 . 5.340 5.241 5.207 5.270 . 0 0 "[ . 1 . 2]" 1
620 1 24 THR HB 1 27 GLU HB2 5.250 . 5.250 5.420 5.334 5.513 0.263 17 0 "[ . 1 . 2]" 1
621 1 24 THR HA 1 27 GLU HG3 5.190 . 5.190 3.634 3.469 3.798 . 0 0 "[ . 1 . 2]" 1
622 1 24 THR HB 1 54 LYS HG2 4.830 . 4.830 5.033 4.985 5.114 0.284 18 0 "[ . 1 . 2]" 1
623 1 24 THR MG 1 25 LEU HA 5.130 . 5.130 3.522 3.363 3.692 . 0 0 "[ . 1 . 2]" 1
624 1 24 THR HB 1 58 VAL HA 5.500 . 5.500 5.770 5.715 5.873 0.373 13 0 "[ . 1 . 2]" 1
625 1 24 THR HB 1 58 VAL MG2 4.950 . 4.950 2.569 2.396 2.713 . 0 0 "[ . 1 . 2]" 1
626 1 24 THR HB 1 58 VAL MG1 4.930 . 4.930 4.023 3.772 4.250 . 0 0 "[ . 1 . 2]" 1
627 1 24 THR H 1 27 GLU H 4.780 . 4.780 4.845 4.809 4.870 0.090 1 0 "[ . 1 . 2]" 1
628 1 24 THR MG 1 58 VAL HB 4.750 . 4.750 3.327 3.123 3.608 . 0 0 "[ . 1 . 2]" 1
629 1 24 THR H 1 25 LEU H 4.680 . 4.680 2.625 2.534 2.693 . 0 0 "[ . 1 . 2]" 1
630 1 24 THR MG 1 58 VAL HA 4.640 . 4.640 4.470 4.354 4.635 . 0 0 "[ . 1 . 2]" 1
631 1 24 THR MG 1 27 GLU HB2 4.570 . 4.570 3.334 3.171 3.487 . 0 0 "[ . 1 . 2]" 1
632 1 24 THR HA 1 27 GLU H 4.470 . 4.470 3.313 3.260 3.362 . 0 0 "[ . 1 . 2]" 1
633 1 24 THR H 1 26 LEU H 4.440 . 4.440 4.082 4.002 4.141 . 0 0 "[ . 1 . 2]" 1
634 1 24 THR MG 1 25 LEU H 4.380 . 4.380 3.638 3.557 3.725 . 0 0 "[ . 1 . 2]" 1
635 1 24 THR HA 1 25 LEU H 4.340 . 4.340 3.616 3.586 3.636 . 0 0 "[ . 1 . 2]" 1
636 1 24 THR H 1 24 THR HB 4.250 . 4.250 2.606 2.587 2.630 . 0 0 "[ . 1 . 2]" 1
637 1 24 THR HA 1 27 GLU HB2 4.180 . 4.180 2.824 2.751 2.895 . 0 0 "[ . 1 . 2]" 1
638 1 24 THR MG 1 58 VAL MG2 4.100 . 4.100 2.329 1.988 2.712 . 0 0 "[ . 1 . 2]" 1
639 1 24 THR HB 1 25 LEU H 4.050 . 4.050 2.702 2.658 2.752 . 0 0 "[ . 1 . 2]" 1
640 1 24 THR O 1 28 SER N . 2.700 3.300 3.208 3.174 3.233 . 0 0 "[ . 1 . 2]" 1
641 1 24 THR MG 1 54 LYS HG2 3.810 . 3.810 3.352 3.097 3.556 . 0 0 "[ . 1 . 2]" 1
642 1 24 THR O 1 28 SER H . . 2.300 2.379 2.335 2.426 0.126 4 0 "[ . 1 . 2]" 1
643 1 25 LEU MD2 1 58 VAL MG2 7.400 . 7.400 3.906 3.009 5.947 . 0 0 "[ . 1 . 2]" 1
644 1 25 LEU MD2 1 55 LEU MD2 7.350 . 7.350 3.938 2.752 5.454 . 0 0 "[ . 1 . 2]" 1
645 1 25 LEU MD2 1 58 VAL HB 7.020 . 7.020 3.536 2.759 6.626 . 0 0 "[ . 1 . 2]" 1
646 1 25 LEU H 1 29 CYS H 6.850 . 6.850 6.623 6.559 6.705 . 0 0 "[ . 1 . 2]" 1
647 1 25 LEU HB2 1 51 LEU MD1 6.850 . 6.850 5.079 4.745 5.599 . 0 0 "[ . 1 . 2]" 1
648 1 25 LEU HG 1 58 VAL MG2 6.760 . 6.760 4.622 3.701 6.873 0.113 6 0 "[ . 1 . 2]" 1
649 1 25 LEU MD1 1 51 LEU HB2 6.650 . 6.650 4.415 3.250 5.169 . 0 0 "[ . 1 . 2]" 1
650 1 25 LEU MD1 1 52 VAL H 6.470 . 6.470 5.844 4.802 6.543 0.073 15 0 "[ . 1 . 2]" 1
651 1 25 LEU MD1 1 55 LEU MD2 6.340 . 6.340 3.508 1.822 5.939 . 0 0 "[ . 1 . 2]" 1
652 1 25 LEU MD2 1 55 LEU HB3 6.190 . 6.190 4.868 4.481 5.901 . 0 0 "[ . 1 . 2]" 1
653 1 25 LEU MD2 1 26 LEU H 6.140 . 6.140 4.662 4.405 4.861 . 0 0 "[ . 1 . 2]" 1
654 1 25 LEU H 1 27 GLU HG3 6.030 . 6.030 5.876 5.727 6.081 0.051 12 0 "[ . 1 . 2]" 1
655 1 25 LEU MD2 1 55 LEU MD1 5.940 . 5.940 3.928 3.416 4.413 . 0 0 "[ . 1 . 2]" 1
656 1 25 LEU HA 1 51 LEU MD2 5.940 . 5.940 3.629 3.263 3.808 . 0 0 "[ . 1 . 2]" 1
657 1 25 LEU MD2 1 52 VAL HA 5.870 . 5.870 5.159 4.772 5.748 . 0 0 "[ . 1 . 2]" 1
658 1 25 LEU HA 1 54 LYS H 6.500 2.380 6.500 6.391 6.200 6.551 0.051 9 0 "[ . 1 . 2]" 1
659 1 25 LEU HB3 1 28 SER H 5.640 . 5.640 5.109 4.881 5.489 . 0 0 "[ . 1 . 2]" 1
660 1 25 LEU H 1 26 LEU HB2 5.620 . 5.620 4.898 4.709 4.993 . 0 0 "[ . 1 . 2]" 1
661 1 25 LEU MD2 1 51 LEU HB3 5.570 . 5.570 3.516 2.760 4.470 . 0 0 "[ . 1 . 2]" 1
662 1 25 LEU MD1 1 55 LEU MD1 5.560 . 5.560 3.228 2.808 4.171 . 0 0 "[ . 1 . 2]" 1
663 1 25 LEU HB2 1 27 GLU H 5.480 . 5.480 5.065 4.846 5.492 0.012 19 0 "[ . 1 . 2]" 1
664 1 25 LEU H 1 25 LEU MD1 5.460 . 5.460 3.974 3.649 4.507 . 0 0 "[ . 1 . 2]" 1
665 1 25 LEU HA 1 51 LEU MD1 5.400 . 5.400 5.423 5.091 5.546 0.146 3 0 "[ . 1 . 2]" 1
666 1 25 LEU HB2 1 26 LEU H 5.400 . 5.400 3.113 2.812 3.890 . 0 0 "[ . 1 . 2]" 1
667 1 25 LEU HA 1 54 LYS HB3 5.290 . 5.290 3.627 3.435 3.774 . 0 0 "[ . 1 . 2]" 1
668 1 25 LEU HB3 1 27 GLU H 5.200 . 5.200 5.083 4.801 5.289 0.089 13 0 "[ . 1 . 2]" 1
669 1 25 LEU HB2 1 54 LYS HB3 5.140 . 5.140 5.449 4.995 5.567 0.427 5 0 "[ . 1 . 2]" 1
670 1 25 LEU MD2 1 55 LEU HB2 5.080 . 5.080 4.046 3.371 4.789 . 0 0 "[ . 1 . 2]" 1
671 1 25 LEU H 1 27 GLU H 5.040 . 5.040 3.965 3.919 4.005 . 0 0 "[ . 1 . 2]" 1
672 1 25 LEU H 1 28 SER H 4.980 . 4.980 4.918 4.846 4.969 . 0 0 "[ . 1 . 2]" 1
673 1 25 LEU H 1 26 LEU H 4.930 . 4.930 2.702 2.657 2.734 . 0 0 "[ . 1 . 2]" 1
674 1 25 LEU HA 1 58 VAL HB 4.810 . 4.810 5.154 5.088 5.228 0.418 12 0 "[ . 1 . 2]" 1
675 1 25 LEU MD2 1 54 LYS HB3 4.800 . 4.800 2.135 1.716 4.844 0.044 19 0 "[ . 1 . 2]" 1
676 1 25 LEU MD1 1 55 LEU H 4.790 . 4.790 4.385 3.388 4.860 0.070 18 0 "[ . 1 . 2]" 1
677 1 25 LEU HA 1 28 SER H 4.770 . 4.770 3.266 3.096 3.444 . 0 0 "[ . 1 . 2]" 1
678 1 25 LEU MD2 1 51 LEU HA 4.730 . 4.730 3.452 2.875 4.474 . 0 0 "[ . 1 . 2]" 1
679 1 25 LEU H 1 58 VAL MG2 4.640 . 4.640 4.397 4.260 4.538 . 0 0 "[ . 1 . 2]" 1
680 1 25 LEU HA 1 25 LEU MD2 4.600 . 4.600 2.110 1.638 3.933 0.012 10 0 "[ . 1 . 2]" 1
681 1 25 LEU MD1 1 51 LEU HA 4.580 . 4.580 3.991 2.620 4.765 0.185 15 0 "[ . 1 . 2]" 1
682 1 25 LEU MD1 1 54 LYS HB3 4.520 . 4.520 3.718 2.180 4.240 . 0 0 "[ . 1 . 2]" 1
683 1 25 LEU H 1 25 LEU HG 4.490 . 4.490 3.076 2.252 4.467 . 0 0 "[ . 1 . 2]" 1
684 1 25 LEU HA 1 25 LEU MD1 4.490 . 4.490 3.488 2.025 3.898 . 0 0 "[ . 1 . 2]" 1
685 1 25 LEU HB3 1 51 LEU MD1 4.140 . 4.140 3.954 3.714 4.430 0.290 6 0 "[ . 1 . 2]" 1
686 1 25 LEU HA 1 26 LEU H 4.130 . 4.130 3.633 3.622 3.647 . 0 0 "[ . 1 . 2]" 1
687 1 25 LEU O 1 29 CYS N . 2.700 3.300 3.400 3.350 3.472 0.172 5 0 "[ . 1 . 2]" 1
688 1 25 LEU O 1 29 CYS H . . 2.300 2.581 2.509 2.695 0.395 5 0 "[ . 1 . 2]" 1
689 1 26 LEU MD2 1 29 CYS H 7.220 . 7.220 5.002 4.537 6.211 . 0 0 "[ . 1 . 2]" 1
690 1 26 LEU MD2 1 31 LEU H 6.300 . 6.300 4.864 4.084 5.094 . 0 0 "[ . 1 . 2]" 1
691 1 26 LEU HB3 1 51 LEU MD1 6.230 . 6.230 6.425 6.332 6.579 0.349 8 0 "[ . 1 . 2]" 1
692 1 26 LEU MD1 1 36 ILE H 6.220 . 6.220 5.973 5.539 6.341 0.121 8 0 "[ . 1 . 2]" 1
693 1 26 LEU HB2 1 31 LEU HB3 6.210 . 6.210 5.563 5.319 5.746 . 0 0 "[ . 1 . 2]" 1
694 1 26 LEU MD2 1 35 GLY H 6.090 . 6.090 5.628 4.714 5.994 . 0 0 "[ . 1 . 2]" 1
695 1 26 LEU HA 1 29 CYS HB3 5.790 . 5.790 4.954 4.740 5.252 . 0 0 "[ . 1 . 2]" 1
696 1 26 LEU MD1 1 35 GLY HA2 5.710 . 5.710 5.056 4.344 5.679 . 0 0 "[ . 1 . 2]" 1
697 1 26 LEU HB3 1 28 SER H 5.660 . 5.660 5.619 5.508 5.679 0.019 19 0 "[ . 1 . 2]" 1
698 1 26 LEU MD1 1 35 GLY HA3 5.610 . 5.610 4.015 3.407 4.747 . 0 0 "[ . 1 . 2]" 1
699 1 26 LEU HA 1 31 LEU H 5.550 . 5.550 5.620 5.546 5.718 0.168 2 0 "[ . 1 . 2]" 1
700 1 26 LEU MD2 1 35 GLY HA2 5.290 . 5.290 3.870 3.190 4.266 . 0 0 "[ . 1 . 2]" 1
701 1 26 LEU HB3 1 30 GLU HA 5.270 . 5.270 4.461 4.407 4.525 . 0 0 "[ . 1 . 2]" 1
702 1 26 LEU HB3 1 30 GLU H 5.660 . 5.660 4.195 4.130 4.302 . 0 0 "[ . 1 . 2]" 1
703 1 26 LEU HB3 1 29 CYS H 5.110 . 5.110 5.127 5.073 5.159 0.049 3 0 "[ . 1 . 2]" 1
704 1 26 LEU MD2 1 31 LEU HB3 5.050 . 5.050 3.395 2.363 3.907 . 0 0 "[ . 1 . 2]" 1
705 1 26 LEU HA 1 28 SER H 4.770 . 4.770 4.130 4.086 4.163 . 0 0 "[ . 1 . 2]" 1
706 1 26 LEU HB3 1 31 LEU HA 5.260 . 5.260 5.058 4.796 5.349 0.089 6 0 "[ . 1 . 2]" 1
707 1 26 LEU H 1 26 LEU HG 4.740 . 4.740 2.869 2.455 4.083 . 0 0 "[ . 1 . 2]" 1
708 1 26 LEU HB3 1 27 GLU H 4.720 . 4.720 4.064 3.845 4.170 . 0 0 "[ . 1 . 2]" 1
709 1 26 LEU HB2 1 27 GLU H 4.710 . 4.710 3.408 3.256 3.605 . 0 0 "[ . 1 . 2]" 1
710 1 26 LEU MD2 1 35 GLY HA3 4.600 . 4.600 3.329 2.501 3.711 . 0 0 "[ . 1 . 2]" 1
711 1 26 LEU HA 1 29 CYS H 4.560 . 4.560 3.331 3.215 3.459 . 0 0 "[ . 1 . 2]" 1
712 1 26 LEU HA 1 51 LEU MD2 4.470 . 4.470 3.755 3.413 3.997 . 0 0 "[ . 1 . 2]" 1
713 1 26 LEU HA 1 51 LEU MD1 4.370 . 4.370 4.413 4.286 4.479 0.109 10 0 "[ . 1 . 2]" 1
714 1 26 LEU H 1 28 SER H 4.340 . 4.340 4.200 4.168 4.243 . 0 0 "[ . 1 . 2]" 1
715 1 26 LEU HA 1 26 LEU MD2 4.340 . 4.340 2.411 1.884 3.755 . 0 0 "[ . 1 . 2]" 1
716 1 26 LEU H 1 27 GLU H 4.250 . 4.250 2.627 2.603 2.642 . 0 0 "[ . 1 . 2]" 1
717 1 26 LEU HB3 1 31 LEU H 4.110 . 4.110 4.245 4.152 4.311 0.201 20 0 "[ . 1 . 2]" 1
718 1 27 GLU HG2 1 28 SER H 6.110 . 6.110 5.361 5.330 5.391 . 0 0 "[ . 1 . 2]" 1
719 1 27 GLU HG2 1 31 LEU H 5.630 . 5.630 5.695 5.605 5.751 0.121 14 0 "[ . 1 . 2]" 1
720 1 27 GLU H 1 27 GLU HG3 . . 5.330 2.861 2.788 3.001 . 0 0 "[ . 1 . 2]" 1
721 1 27 GLU H 1 27 GLU HG2 5.330 . 5.330 4.066 4.019 4.161 . 0 0 "[ . 1 . 2]" 1
722 1 27 GLU HB2 1 29 CYS H 5.230 . 5.230 5.231 5.117 5.282 0.052 12 0 "[ . 1 . 2]" 1
723 1 27 GLU HA 1 29 CYS H 5.050 . 5.050 3.942 3.734 4.037 . 0 0 "[ . 1 . 2]" 1
724 1 27 GLU HG3 1 30 GLU HA 5.000 . 5.000 5.305 5.218 5.340 0.340 12 0 "[ . 1 . 2]" 1
725 1 27 GLU HG3 1 28 SER H 4.950 . 4.950 4.757 4.706 4.847 . 0 0 "[ . 1 . 2]" 1
726 1 27 GLU HB2 1 28 SER HA 4.790 . 4.790 4.515 4.470 4.584 . 0 0 "[ . 1 . 2]" 1
727 1 27 GLU HA 1 28 SER H 4.570 . 4.570 3.569 3.556 3.594 . 0 0 "[ . 1 . 2]" 1
728 1 27 GLU HA 1 31 LEU H 4.480 . 4.480 4.428 4.320 4.496 0.016 17 0 "[ . 1 . 2]" 1
729 1 27 GLU H 1 27 GLU HB2 4.360 . 4.360 2.389 2.329 2.425 . 0 0 "[ . 1 . 2]" 1
730 1 27 GLU HA 1 30 GLU HG3 4.340 . 4.340 3.808 3.591 4.355 0.015 8 0 "[ . 1 . 2]" 1
731 1 27 GLU H 1 29 CYS H 4.230 . 4.230 3.921 3.837 3.980 . 0 0 "[ . 1 . 2]" 1
732 1 27 GLU HB2 1 28 SER H 4.110 . 4.110 3.105 3.063 3.157 . 0 0 "[ . 1 . 2]" 1
733 1 28 SER HB2 1 54 LYS H 5.770 . 5.770 5.771 5.328 5.924 0.154 12 0 "[ . 1 . 2]" 1
734 1 28 SER H 1 54 LYS HB2 5.690 . 5.690 5.674 5.503 5.747 0.057 14 0 "[ . 1 . 2]" 1
735 1 28 SER HB2 1 29 CYS H 5.570 . 5.570 4.224 4.172 4.327 . 0 0 "[ . 1 . 2]" 1
736 1 28 SER HB2 1 50 GLN HG3 5.430 . 5.430 4.754 4.075 5.194 . 0 0 "[ . 1 . 2]" 1
737 1 28 SER HB3 1 54 LYS H 5.350 . 5.350 5.578 5.497 5.701 0.351 8 0 "[ . 1 . 2]" 1
738 1 28 SER HB3 1 54 LYS HG3 5.200 . 5.200 4.615 3.989 4.876 . 0 0 "[ . 1 . 2]" 1
739 1 28 SER HB3 1 54 LYS HB2 5.120 . 5.120 3.421 3.291 3.470 . 0 0 "[ . 1 . 2]" 1
740 1 28 SER HB3 1 54 LYS QE 5.020 . 5.020 3.749 3.142 3.980 . 0 0 "[ . 1 . 2]" 1
741 1 28 SER HB3 1 54 LYS HD3 4.990 . 4.990 3.236 2.491 3.602 . 0 0 "[ . 1 . 2]" 1
742 1 28 SER HB3 1 54 LYS HG2 4.940 . 4.940 2.897 2.293 3.164 . 0 0 "[ . 1 . 2]" 1
743 1 28 SER HA 1 29 CYS H 4.590 . 4.590 3.582 3.539 3.599 . 0 0 "[ . 1 . 2]" 1
744 1 28 SER H 1 29 CYS H 4.430 . 4.430 2.637 2.594 2.683 . 0 0 "[ . 1 . 2]" 1
745 1 28 SER HB3 1 29 CYS H 4.280 . 4.280 3.313 2.970 4.240 . 0 0 "[ . 1 . 2]" 1
746 1 29 CYS H 1 51 LEU MD2 5.870 . 5.870 3.259 3.121 3.458 . 0 0 "[ . 1 . 2]" 1
747 1 29 CYS H 1 30 GLU H 5.370 . 5.370 2.056 1.953 2.126 . 0 0 "[ . 1 . 2]" 1
748 1 29 CYS HB3 1 47 GLU HA 5.240 . 5.240 5.373 5.264 5.433 0.193 1 0 "[ . 1 . 2]" 1
749 1 29 CYS HB3 1 30 GLU H 4.620 . 4.620 4.163 3.786 4.256 . 0 0 "[ . 1 . 2]" 1
750 1 29 CYS HB3 1 47 GLU HG3 4.100 . 4.100 4.348 4.304 4.385 0.285 18 0 "[ . 1 . 2]" 1
751 1 30 GLU HA 1 31 LEU H . . 3.710 2.253 2.238 2.265 . 0 0 "[ . 1 . 2]" 1
752 1 30 GLU H 1 30 GLU HG2 5.390 . 5.390 4.650 4.266 4.929 . 0 0 "[ . 1 . 2]" 1
753 1 30 GLU HB3 1 31 LEU H 4.700 . 4.700 3.612 3.243 4.023 . 0 0 "[ . 1 . 2]" 1
754 1 30 GLU HA 1 31 LEU MD2 5.550 3.150 5.550 4.114 3.905 4.340 . 0 0 "[ . 1 . 2]" 1
755 1 31 LEU MD1 1 33 SER H 6.570 . 6.570 3.973 3.280 4.617 . 0 0 "[ . 1 . 2]" 1
756 1 31 LEU MD1 1 32 GLN H 6.390 . 6.390 3.323 2.864 4.754 . 0 0 "[ . 1 . 2]" 1
757 1 31 LEU MD1 1 34 GLU H 6.370 . 6.370 4.775 4.473 5.037 . 0 0 "[ . 1 . 2]" 1
758 1 31 LEU MD2 1 35 GLY HA3 6.340 . 6.340 4.055 3.554 4.419 . 0 0 "[ . 1 . 2]" 1
759 1 31 LEU MD2 1 35 GLY HA2 6.150 . 6.150 4.644 4.241 4.905 . 0 0 "[ . 1 . 2]" 1
760 1 31 LEU H 1 32 GLN H 6.020 . 6.020 4.416 4.314 4.470 . 0 0 "[ . 1 . 2]" 1
761 1 31 LEU HB3 1 32 GLN H 4.530 . 4.530 3.338 3.027 4.260 . 0 0 "[ . 1 . 2]" 1
762 1 31 LEU QD 1 35 GLY H 5.920 . 5.920 4.918 4.747 5.014 . 0 0 "[ . 1 . 2]" 1
763 1 31 LEU MD1 1 35 GLY HA2 5.880 . 5.880 5.410 5.108 5.715 . 0 0 "[ . 1 . 2]" 1
764 1 31 LEU QD 1 35 GLY HA2 5.720 . 5.720 4.389 4.045 4.638 . 0 0 "[ . 1 . 2]" 1
765 1 31 LEU QD 1 35 GLY HA3 5.500 . 5.500 3.926 3.484 4.240 . 0 0 "[ . 1 . 2]" 1
766 1 31 LEU MD1 1 35 GLY H 5.450 . 5.450 5.495 5.242 5.554 0.104 4 0 "[ . 1 . 2]" 1
767 1 31 LEU MD1 1 35 GLY HA3 5.360 . 5.360 5.274 4.841 5.462 0.102 8 0 "[ . 1 . 2]" 1
768 1 31 LEU HB3 1 34 GLU HA 5.350 . 5.350 5.079 4.459 5.290 . 0 0 "[ . 1 . 2]" 1
769 1 31 LEU HA 1 33 SER H 5.230 . 5.230 4.287 3.672 4.863 . 0 0 "[ . 1 . 2]" 1
770 1 31 LEU HB3 1 33 SER H 5.130 . 5.130 4.518 3.952 5.215 0.085 15 0 "[ . 1 . 2]" 1
771 1 31 LEU HB3 1 35 GLY H 4.940 . 4.940 4.787 4.529 5.007 0.067 6 0 "[ . 1 . 2]" 1
772 1 31 LEU HB3 1 34 GLU H 4.830 . 4.830 5.033 4.986 5.105 0.275 13 0 "[ . 1 . 2]" 1
773 1 31 LEU HA 1 32 GLN H 4.530 . 4.530 2.716 2.209 2.883 . 0 0 "[ . 1 . 2]" 1
774 1 32 GLN H 1 33 SER H 5.700 . 5.700 1.936 1.507 2.455 0.143 20 0 "[ . 1 . 2]" 1
775 1 32 GLN HG2 1 33 SER HA 5.650 . 5.650 4.295 3.700 5.962 0.312 11 0 "[ . 1 . 2]" 1
776 1 32 GLN H 1 32 GLN HG3 5.470 . 5.470 4.685 3.505 4.840 . 0 0 "[ . 1 . 2]" 1
777 1 32 GLN HB2 1 33 SER H 5.440 . 5.440 3.855 2.604 4.209 . 0 0 "[ . 1 . 2]" 1
778 1 32 GLN HB3 1 33 SER H 5.140 . 5.140 2.749 2.001 3.759 . 0 0 "[ . 1 . 2]" 1
779 1 32 GLN HG3 1 33 SER H 4.910 . 4.910 4.884 4.394 5.083 0.173 18 0 "[ . 1 . 2]" 1
780 1 32 GLN HA 1 33 SER H 4.640 . 4.640 3.575 3.520 3.644 . 0 0 "[ . 1 . 2]" 1
781 1 32 GLN HA 1 32 GLN HG3 4.290 . 4.290 2.567 2.506 2.833 . 0 0 "[ . 1 . 2]" 1
782 1 33 SER H 1 35 GLY HA2 6.620 . 6.620 4.643 4.288 5.128 . 0 0 "[ . 1 . 2]" 1
783 1 33 SER H 1 35 GLY H 5.630 . 5.630 3.881 3.365 4.486 . 0 0 "[ . 1 . 2]" 1
784 1 33 SER H 1 34 GLU HA 5.450 . 5.450 4.465 4.178 4.788 . 0 0 "[ . 1 . 2]" 1
785 1 33 SER H 1 34 GLU H 5.410 . 5.410 2.564 2.346 2.948 . 0 0 "[ . 1 . 2]" 1
786 1 33 SER HB2 1 34 GLU H 5.370 . 5.370 3.314 2.431 3.479 . 0 0 "[ . 1 . 2]" 1
787 1 33 SER HA 1 34 GLU H 4.920 . 4.920 3.666 3.616 3.687 . 0 0 "[ . 1 . 2]" 1
788 1 33 SER HB3 1 35 GLY H 4.640 . 4.640 3.640 3.269 4.619 . 0 0 "[ . 1 . 2]" 1
789 1 34 GLU HB2 1 37 TYR H 6.440 . 6.440 5.783 5.587 5.946 . 0 0 "[ . 1 . 2]" 1
790 1 34 GLU H 1 36 ILE H 5.820 . 5.820 4.357 3.861 4.846 . 0 0 "[ . 1 . 2]" 1
791 1 34 GLU HB2 1 35 GLY HA2 5.690 . 5.690 4.931 4.765 5.031 . 0 0 "[ . 1 . 2]" 1
792 1 34 GLU H 1 35 GLY H 5.440 . 5.440 1.959 1.776 2.139 . 0 0 "[ . 1 . 2]" 1
793 1 34 GLU HB2 1 36 ILE H 4.820 . 4.820 3.089 2.699 3.562 . 0 0 "[ . 1 . 2]" 1
794 1 34 GLU HB2 1 35 GLY H 4.740 . 4.740 2.652 2.462 2.887 . 0 0 "[ . 1 . 2]" 1
795 1 34 GLU HA 1 35 GLY H 4.500 . 4.500 3.642 3.596 3.667 . 0 0 "[ . 1 . 2]" 1
796 1 35 GLY H 1 36 ILE H 5.090 . 5.090 2.740 2.571 2.980 . 0 0 "[ . 1 . 2]" 1
797 1 35 GLY HA3 1 36 ILE H 4.900 . 4.900 2.928 2.731 3.071 . 0 0 "[ . 1 . 2]" 1
798 1 35 GLY HA2 1 36 ILE H 4.520 . 4.520 3.621 3.561 3.657 . 0 0 "[ . 1 . 2]" 1
799 1 36 ILE H 1 37 TYR H 6.000 . 6.000 4.121 4.078 4.164 . 0 0 "[ . 1 . 2]" 1
800 1 36 ILE HA 1 38 THR H 5.910 . 5.910 4.318 3.203 6.219 0.309 13 0 "[ . 1 . 2]" 1
801 1 36 ILE HA 1 37 TYR HB3 5.710 . 5.710 5.014 4.778 5.417 . 0 0 "[ . 1 . 2]" 1
802 1 36 ILE H 1 36 ILE MD 5.630 . 5.630 3.870 3.709 3.948 . 0 0 "[ . 1 . 2]" 1
803 1 36 ILE H 1 36 ILE HG13 5.620 . 5.620 2.659 2.445 2.760 . 0 0 "[ . 1 . 2]" 1
804 1 36 ILE H 1 36 ILE HG12 5.530 . 5.530 3.903 3.753 3.970 . 0 0 "[ . 1 . 2]" 1
805 1 36 ILE HG13 1 37 TYR H 5.400 . 5.400 5.196 5.167 5.232 . 0 0 "[ . 1 . 2]" 1
806 1 36 ILE MG 1 37 TYR H 5.350 . 5.350 3.192 3.009 3.417 . 0 0 "[ . 1 . 2]" 1
807 1 36 ILE HG12 1 37 TYR H 5.090 . 5.090 4.872 4.769 5.004 . 0 0 "[ . 1 . 2]" 1
808 1 36 ILE HB 1 37 TYR H 5.040 . 5.040 4.501 4.467 4.533 . 0 0 "[ . 1 . 2]" 1
809 1 36 ILE HA 1 37 TYR HB2 4.980 . 4.980 4.561 4.301 4.770 . 0 0 "[ . 1 . 2]" 1
810 1 36 ILE HA 1 36 ILE MD 4.740 . 4.740 3.908 3.899 3.920 . 0 0 "[ . 1 . 2]" 1
811 1 36 ILE HA 1 37 TYR H 3.750 . 3.750 2.306 2.244 2.379 . 0 0 "[ . 1 . 2]" 1
812 1 37 TYR HB3 1 38 THR H 5.590 . 5.590 2.690 1.547 3.853 0.103 2 0 "[ . 1 . 2]" 1
813 1 37 TYR QD 1 41 GLY HA2 5.490 . 5.490 4.340 3.420 5.133 . 0 0 "[ . 1 . 2]" 1
814 1 37 TYR QD 1 41 GLY H 5.480 . 5.480 3.133 2.540 3.795 . 0 0 "[ . 1 . 2]" 1
815 1 37 TYR HB2 1 38 THR H 5.420 . 5.420 3.844 3.247 4.566 . 0 0 "[ . 1 . 2]" 1
816 1 37 TYR QD 1 41 GLY HA3 5.330 . 5.330 3.567 2.848 4.173 . 0 0 "[ . 1 . 2]" 1
817 1 37 TYR HA 1 38 THR H 4.150 . 4.150 3.362 3.037 3.640 . 0 0 "[ . 1 . 2]" 1
818 1 37 TYR QD 1 38 THR H 5.150 . 5.150 4.059 2.676 4.812 . 0 0 "[ . 1 . 2]" 1
819 1 38 THR HB 1 39 SER HB3 5.770 . 5.770 5.375 4.780 5.865 0.095 12 0 "[ . 1 . 2]" 1
820 1 38 THR HB 1 40 VAL MG2 5.610 . 5.610 3.233 2.293 5.337 . 0 0 "[ . 1 . 2]" 1
821 1 38 THR MG 1 40 VAL MG2 4.750 . 4.750 3.517 1.976 4.852 0.102 5 0 "[ . 1 . 2]" 1
822 1 39 SER HB2 1 40 VAL H 5.510 . 5.510 4.165 3.586 4.545 . 0 0 "[ . 1 . 2]" 1
823 1 39 SER HA 1 40 VAL H 4.950 . 4.950 2.557 2.224 3.242 . 0 0 "[ . 1 . 2]" 1
824 1 39 SER HB3 1 40 VAL H 4.720 . 4.720 4.639 4.409 4.793 0.073 14 0 "[ . 1 . 2]" 1
825 1 40 VAL MG1 1 111 TYR QD 5.900 . 5.900 5.304 4.391 5.935 0.035 11 0 "[ . 1 . 2]" 1
826 1 40 VAL MG1 1 41 GLY H 5.840 . 5.840 4.146 2.986 4.574 . 0 0 "[ . 1 . 2]" 1
827 1 40 VAL MG2 1 111 TYR QE 5.470 . 5.470 5.225 2.627 5.771 0.301 9 0 "[ . 1 . 2]" 1
828 1 40 VAL HA 1 41 GLY H 4.910 . 5.410 3.432 3.314 3.551 . 0 0 "[ . 1 . 2]" 1
829 1 40 VAL H 1 41 GLY H 4.860 . 5.360 1.775 1.485 2.580 0.165 19 0 "[ . 1 . 2]" 1
830 1 40 VAL MG1 1 111 TYR QE 4.520 . 4.520 3.951 3.208 4.658 0.138 15 0 "[ . 1 . 2]" 1
831 1 40 VAL MG2 1 41 GLY H 4.510 . 4.510 3.760 2.851 4.527 0.017 11 0 "[ . 1 . 2]" 1
832 1 41 GLY HA3 1 42 SER H 4.180 . 4.180 2.925 2.211 3.150 . 0 0 "[ . 1 . 2]" 1
833 1 41 GLY HA2 1 42 SER H 3.820 . 3.820 2.443 2.258 3.212 . 0 0 "[ . 1 . 2]" 1
834 1 42 SER H 1 43 TYR H 6.070 . 6.070 4.193 2.920 4.370 . 0 0 "[ . 1 . 2]" 1
835 1 42 SER HA 1 113 GLN HG3 5.560 . 5.560 5.564 5.368 5.838 0.278 5 0 "[ . 1 . 2]" 1
836 1 42 SER HA 1 43 TYR QD 5.480 . 5.480 3.863 3.716 4.233 . 0 0 "[ . 1 . 2]" 1
837 1 42 SER HB3 1 114 ALA HA 5.350 . 5.350 5.604 5.470 5.794 0.444 14 0 "[ . 1 . 2]" 1
838 1 42 SER HB3 1 113 GLN HB3 5.190 . 5.190 3.064 2.724 3.190 . 0 0 "[ . 1 . 2]" 1
839 1 42 SER HB3 1 43 TYR HA 5.180 . 5.180 4.628 4.457 4.768 . 0 0 "[ . 1 . 2]" 1
840 1 42 SER HB2 1 113 GLN HG3 5.170 . 5.170 2.852 2.530 3.737 . 0 0 "[ . 1 . 2]" 1
841 1 42 SER HB3 1 113 GLN HB2 5.150 . 5.150 3.586 3.292 3.749 . 0 0 "[ . 1 . 2]" 1
842 1 42 SER HA 1 43 TYR HA 5.100 . 5.100 4.379 4.353 4.417 . 0 0 "[ . 1 . 2]" 1
843 1 42 SER HB2 1 43 TYR H 5.050 . 5.050 4.320 4.147 4.734 . 0 0 "[ . 1 . 2]" 1
844 1 42 SER HB3 1 113 GLN HA 5.500 2.150 5.500 5.607 5.223 5.716 0.216 8 0 "[ . 1 . 2]" 1
845 1 42 SER HB3 1 113 GLN HG2 4.970 . 4.970 5.100 4.699 5.198 0.228 1 0 "[ . 1 . 2]" 1
846 1 42 SER HB3 1 113 GLN HG3 4.910 . 4.910 3.601 3.084 3.711 . 0 0 "[ . 1 . 2]" 1
847 1 42 SER HA 1 43 TYR H 4.590 . 4.590 2.276 2.239 2.352 . 0 0 "[ . 1 . 2]" 1
848 1 42 SER H 1 42 SER HB2 4.180 . 4.180 2.791 2.659 3.402 . 0 0 "[ . 1 . 2]" 1
849 1 43 TYR H 1 44 ASP H 5.690 . 5.690 4.480 4.453 4.525 . 0 0 "[ . 1 . 2]" 1
850 1 43 TYR H 1 47 GLU HG2 5.450 . 5.450 5.670 5.521 5.758 0.308 11 0 "[ . 1 . 2]" 1
851 1 43 TYR HB3 1 47 GLU HA 5.200 . 5.200 5.090 4.959 5.214 0.014 18 0 "[ . 1 . 2]" 1
852 1 43 TYR HA 1 47 GLU HG2 5.120 . 5.120 5.220 5.160 5.278 0.158 18 0 "[ . 1 . 2]" 1
853 1 43 TYR HB3 1 47 GLU H 5.050 . 5.050 4.257 4.084 4.443 . 0 0 "[ . 1 . 2]" 1
854 1 43 TYR QD 1 44 ASP H 4.980 . 4.980 3.281 3.215 3.325 . 0 0 "[ . 1 . 2]" 1
855 1 43 TYR HB3 1 44 ASP H 4.860 . 4.860 2.142 2.040 2.252 . 0 0 "[ . 1 . 2]" 1
856 1 43 TYR HB3 1 47 GLU HB3 4.420 . 4.420 2.983 2.841 3.154 . 0 0 "[ . 1 . 2]" 1
857 1 43 TYR HA 1 44 ASP H 4.210 . 4.210 2.616 2.571 2.668 . 0 0 "[ . 1 . 2]" 1
858 1 43 TYR HB3 1 47 GLU HG3 4.230 . 4.230 4.364 4.305 4.400 0.170 18 0 "[ . 1 . 2]" 1
859 1 44 ASP HB3 1 45 HIS H 6.440 . 6.440 1.965 1.819 2.139 . 0 0 "[ . 1 . 2]" 1
860 1 44 ASP HB3 1 47 GLU H 5.880 . 5.880 3.918 3.464 4.215 . 0 0 "[ . 1 . 2]" 1
861 1 44 ASP HA 1 46 GLN H 5.880 . 5.880 4.292 4.211 4.362 . 0 0 "[ . 1 . 2]" 1
862 1 44 ASP H 1 47 GLU HG3 5.860 . 5.860 5.926 5.883 5.991 0.131 9 0 "[ . 1 . 2]" 1
863 1 44 ASP HA 1 47 GLU HB3 5.550 . 5.550 5.613 5.431 5.697 0.147 3 0 "[ . 1 . 2]" 1
864 1 44 ASP HB3 1 46 GLN H 5.500 . 5.500 2.498 2.093 2.679 . 0 0 "[ . 1 . 2]" 1
865 1 44 ASP HA 1 45 HIS H 5.480 . 5.480 2.736 2.592 2.824 . 0 0 "[ . 1 . 2]" 1
866 1 44 ASP HB2 1 47 GLU H 5.390 . 5.390 2.973 2.802 3.380 . 0 0 "[ . 1 . 2]" 1
867 1 44 ASP HB2 1 46 GLN H 5.260 . 5.260 2.821 2.550 3.277 . 0 0 "[ . 1 . 2]" 1
868 1 44 ASP H 1 47 GLU HG2 5.050 . 5.050 4.665 4.534 4.755 . 0 0 "[ . 1 . 2]" 1
869 1 45 HIS H 1 47 GLU H 6.300 . 6.300 3.934 3.867 4.021 . 0 0 "[ . 1 . 2]" 1
870 1 45 HIS H 1 47 GLU HB2 6.260 . 6.260 5.426 5.251 5.572 . 0 0 "[ . 1 . 2]" 1
871 1 45 HIS H 1 47 GLU HB3 6.260 . 6.260 5.692 5.502 5.782 . 0 0 "[ . 1 . 2]" 1
872 1 45 HIS H 1 46 GLN H 5.850 . 5.850 2.231 2.159 2.297 . 0 0 "[ . 1 . 2]" 1
873 1 45 HIS HA 1 46 GLN H 5.640 . 5.640 3.493 3.471 3.539 . 0 0 "[ . 1 . 2]" 1
874 1 45 HIS HD2 1 48 LEU MD1 5.610 . 5.610 4.792 3.593 5.731 0.121 2 0 "[ . 1 . 2]" 1
875 1 45 HIS HA 1 48 LEU H 5.550 . 5.550 3.021 2.927 3.201 . 0 0 "[ . 1 . 2]" 1
876 1 45 HIS HA 1 47 GLU HB2 5.450 . 5.450 5.120 4.967 5.302 . 0 0 "[ . 1 . 2]" 1
877 1 45 HIS HB2 1 46 GLN H 5.370 . 5.370 3.534 3.283 3.973 . 0 0 "[ . 1 . 2]" 1
878 1 45 HIS HD2 1 48 LEU HB3 4.020 . 4.020 4.024 3.188 4.232 0.212 16 0 "[ . 1 . 2]" 1
879 1 45 HIS O 1 49 LEU N . 2.700 3.300 3.132 2.978 3.265 . 0 0 "[ . 1 . 2]" 1
880 1 45 HIS O 1 49 LEU H . . 2.300 2.295 2.151 2.421 0.121 15 0 "[ . 1 . 2]" 1
881 1 46 GLN HA 1 50 GLN H 5.940 . 5.940 4.120 3.999 4.438 . 0 0 "[ . 1 . 2]" 1
882 1 46 GLN HB3 1 48 LEU H 5.900 . 5.900 5.241 5.150 5.294 . 0 0 "[ . 1 . 2]" 1
883 1 46 GLN HB3 1 50 GLN H 5.750 . 5.750 5.436 5.353 5.727 . 0 0 "[ . 1 . 2]" 1
884 1 46 GLN H 1 48 LEU H 5.670 . 5.670 4.189 4.129 4.329 . 0 0 "[ . 1 . 2]" 1
885 1 46 GLN HG3 1 49 LEU HG 5.550 . 5.550 4.782 3.343 5.100 . 0 0 "[ . 1 . 2]" 1
886 1 46 GLN HG2 1 49 LEU HG 5.390 . 5.390 5.515 4.535 5.704 0.314 9 0 "[ . 1 . 2]" 1
887 1 46 GLN H 1 47 GLU H 5.310 . 5.310 2.541 2.477 2.649 . 0 0 "[ . 1 . 2]" 1
888 1 46 GLN HA 1 48 LEU HB3 5.240 . 5.240 4.975 4.884 5.294 0.054 16 0 "[ . 1 . 2]" 1
889 1 46 GLN HA 1 48 LEU H 5.220 . 5.220 4.181 4.112 4.236 . 0 0 "[ . 1 . 2]" 1
890 1 46 GLN HA 1 49 LEU H 5.110 . 5.110 3.049 2.985 3.231 . 0 0 "[ . 1 . 2]" 1
891 1 46 GLN HA 1 49 LEU HB2 5.090 . 5.090 3.567 3.225 5.148 0.058 2 0 "[ . 1 . 2]" 1
892 1 46 GLN H 1 46 GLN HG3 5.080 . 5.080 4.459 4.420 4.488 . 0 0 "[ . 1 . 2]" 1
893 1 46 GLN H 1 46 GLN HG2 5.030 . 5.030 4.589 4.556 4.690 . 0 0 "[ . 1 . 2]" 1
894 1 46 GLN HA 1 47 GLU H 4.980 . 4.980 3.540 3.522 3.567 . 0 0 "[ . 1 . 2]" 1
895 1 46 GLN HG3 1 50 GLN H 4.410 . 4.410 4.694 4.530 4.795 0.385 4 0 "[ . 1 . 2]" 1
896 1 46 GLN O 1 50 GLN N . 2.700 3.300 2.864 2.808 3.051 . 0 0 "[ . 1 . 2]" 1
897 1 46 GLN O 1 50 GLN H . . 2.300 2.053 1.977 2.339 0.039 15 0 "[ . 1 . 2]" 1
898 1 47 GLU HB2 1 48 LEU H 6.280 . 6.280 3.685 3.595 3.750 . 0 0 "[ . 1 . 2]" 1
899 1 47 GLU H 1 48 LEU HA 6.150 . 6.150 5.204 5.174 5.235 . 0 0 "[ . 1 . 2]" 1
900 1 47 GLU HA 1 51 LEU H 5.600 . 5.600 4.472 4.420 4.566 . 0 0 "[ . 1 . 2]" 1
901 1 47 GLU HB3 1 50 GLN H 5.400 . 5.400 5.369 5.281 5.463 0.063 14 0 "[ . 1 . 2]" 1
902 1 47 GLU HA 1 48 LEU H 5.400 . 5.400 3.631 3.622 3.646 . 0 0 "[ . 1 . 2]" 1
903 1 47 GLU HA 1 50 GLN HG3 5.350 . 5.350 5.657 5.565 5.722 0.372 12 0 "[ . 1 . 2]" 1
904 1 47 GLU H 1 48 LEU H 5.340 . 5.340 2.657 2.624 2.690 . 0 0 "[ . 1 . 2]" 1
905 1 47 GLU HG3 1 51 LEU H 5.260 . 5.260 4.833 4.718 5.017 . 0 0 "[ . 1 . 2]" 1
906 1 47 GLU HG3 1 48 LEU H 5.220 . 5.220 4.361 4.201 4.455 . 0 0 "[ . 1 . 2]" 1
907 1 47 GLU HA 1 50 GLN H 5.170 . 5.170 3.472 3.369 3.555 . 0 0 "[ . 1 . 2]" 1
908 1 47 GLU HB3 1 48 LEU H 5.080 . 5.080 2.575 2.515 2.634 . 0 0 "[ . 1 . 2]" 1
909 1 47 GLU HA 1 50 GLN HG2 4.910 . 4.910 4.873 4.644 5.147 0.237 5 0 "[ . 1 . 2]" 1
910 1 47 GLU HA 1 50 GLN HB2 4.730 . 4.730 3.415 3.243 3.618 . 0 0 "[ . 1 . 2]" 1
911 1 47 GLU O 1 51 LEU N . 2.700 3.300 3.358 3.301 3.410 0.110 11 0 "[ . 1 . 2]" 1
912 1 47 GLU O 1 51 LEU H . . 2.300 2.408 2.356 2.461 0.161 11 0 "[ . 1 . 2]" 1
913 1 48 LEU MD2 1 70 PHE QD 7.590 . 7.590 5.080 4.858 5.447 . 0 0 "[ . 1 . 2]" 1
914 1 48 LEU MD2 1 70 PHE QE 5.670 . 5.670 4.287 4.046 4.550 . 0 0 "[ . 1 . 2]" 1
915 1 48 LEU MD2 1 49 LEU HA 6.470 . 6.470 4.306 3.223 4.786 . 0 0 "[ . 1 . 2]" 1
916 1 48 LEU MD2 1 52 VAL MG2 6.450 . 6.450 2.762 1.861 3.685 . 0 0 "[ . 1 . 2]" 1
917 1 48 LEU HA 1 50 GLN H 6.270 . 6.270 4.236 4.051 4.358 . 0 0 "[ . 1 . 2]" 1
918 1 48 LEU HA 1 52 VAL H 5.990 . 5.990 4.382 4.092 4.465 . 0 0 "[ . 1 . 2]" 1
919 1 48 LEU MD1 1 52 VAL MG1 5.940 . 5.940 4.159 3.382 5.660 . 0 0 "[ . 1 . 2]" 1
920 1 48 LEU MD1 1 70 PHE QE 5.810 . 5.810 4.747 3.807 5.576 . 0 0 "[ . 1 . 2]" 1
921 1 48 LEU MD2 1 49 LEU H 5.800 . 5.800 4.384 3.875 4.594 . 0 0 "[ . 1 . 2]" 1
922 1 48 LEU HA 1 51 LEU MD2 5.790 . 5.790 5.603 5.412 5.783 . 0 0 "[ . 1 . 2]" 1
923 1 48 LEU MD1 1 52 VAL H 5.520 . 5.520 4.152 3.719 5.833 0.313 16 0 "[ . 1 . 2]" 1
924 1 48 LEU MD2 1 70 PHE HZ 5.450 . 5.450 4.556 4.178 5.073 . 0 0 "[ . 1 . 2]" 1
925 1 48 LEU H 1 48 LEU MD1 5.350 . 5.350 4.143 4.027 4.225 . 0 0 "[ . 1 . 2]" 1
926 1 48 LEU H 1 49 LEU H 5.290 . 5.290 2.645 2.519 2.805 . 0 0 "[ . 1 . 2]" 1
927 1 48 LEU HA 1 51 LEU H 5.290 . 5.290 3.673 3.513 3.824 . 0 0 "[ . 1 . 2]" 1
928 1 48 LEU MD1 1 49 LEU HA 5.260 . 5.260 3.554 2.471 5.355 0.095 16 0 "[ . 1 . 2]" 1
929 1 48 LEU HG 1 52 VAL HB 5.200 . 5.200 5.028 4.137 5.609 0.409 15 0 "[ . 1 . 2]" 1
930 1 48 LEU MD1 1 49 LEU H 5.180 . 5.180 3.951 3.250 4.966 . 0 0 "[ . 1 . 2]" 1
931 1 48 LEU MD1 1 52 VAL HB 5.010 . 5.010 3.685 2.548 5.389 0.379 16 0 "[ . 1 . 2]" 1
932 1 48 LEU HA 1 49 LEU H 4.910 . 4.910 3.601 3.572 3.651 . 0 0 "[ . 1 . 2]" 1
933 1 48 LEU HA 1 52 VAL HB 5.370 2.150 5.370 5.167 4.865 5.606 0.236 2 0 "[ . 1 . 2]" 1
934 1 48 LEU MD1 1 52 VAL MG2 4.390 . 4.390 2.307 1.634 3.844 0.016 20 0 "[ . 1 . 2]" 1
935 1 48 LEU HB2 1 49 LEU H 4.250 . 4.250 4.038 3.833 4.107 . 0 0 "[ . 1 . 2]" 1
936 1 48 LEU O 1 52 VAL N . 2.700 3.300 3.050 2.921 3.286 . 0 0 "[ . 1 . 2]" 1
937 1 48 LEU O 1 52 VAL H . . 2.300 2.231 1.975 2.358 0.058 2 0 "[ . 1 . 2]" 1
938 1 49 LEU HB2 1 53 VAL H 6.180 . 6.180 5.757 4.578 5.991 . 0 0 "[ . 1 . 2]" 1
939 1 49 LEU HB3 1 51 LEU H 5.980 . 5.980 5.435 5.280 6.098 0.118 2 0 "[ . 1 . 2]" 1
940 1 49 LEU H 1 51 LEU H 5.790 . 5.790 4.273 4.193 4.410 . 0 0 "[ . 1 . 2]" 1
941 1 49 LEU H 1 49 LEU MD1 5.750 . 5.750 4.169 4.087 4.329 . 0 0 "[ . 1 . 2]" 1
942 1 49 LEU H 1 50 GLN HA 5.710 . 5.710 4.992 4.869 5.072 . 0 0 "[ . 1 . 2]" 1
943 1 49 LEU H 1 50 GLN H 5.470 . 5.470 2.471 2.396 2.540 . 0 0 "[ . 1 . 2]" 1
944 1 49 LEU HA 1 53 VAL HA 5.930 . 5.930 5.918 5.702 6.029 0.099 13 0 "[ . 1 . 2]" 1
945 1 49 LEU MD1 1 53 VAL H 5.260 . 5.260 3.593 3.326 4.031 . 0 0 "[ . 1 . 2]" 1
946 1 49 LEU HB3 1 52 VAL MG1 5.630 2.150 5.630 5.701 5.032 5.923 0.293 1 0 "[ . 1 . 2]" 1
947 1 49 LEU HA 1 50 GLN H 5.110 . 5.110 3.559 3.464 3.608 . 0 0 "[ . 1 . 2]" 1
948 1 49 LEU HA 1 51 LEU HB2 5.530 2.150 5.530 5.703 5.451 5.838 0.308 6 0 "[ . 1 . 2]" 1
949 1 49 LEU MD1 1 53 VAL MG1 5.030 . 5.030 4.421 3.960 4.666 . 0 0 "[ . 1 . 2]" 1
950 1 49 LEU HB3 1 50 GLN H 4.910 . 4.910 3.096 2.871 4.132 . 0 0 "[ . 1 . 2]" 1
951 1 49 LEU MD1 1 50 GLN H 4.890 . 4.890 4.634 4.252 4.716 . 0 0 "[ . 1 . 2]" 1
952 1 49 LEU HG 1 50 GLN H 4.800 . 4.800 3.933 2.774 4.183 . 0 0 "[ . 1 . 2]" 1
953 1 49 LEU HA 1 52 VAL HA 4.770 . 4.770 5.094 4.926 5.238 0.468 16 0 "[ . 1 . 2]" 1
954 1 49 LEU HA 1 52 VAL H 4.740 . 4.740 3.166 2.931 3.294 . 0 0 "[ . 1 . 2]" 1
955 1 49 LEU HA 1 53 VAL H 4.740 . 4.740 3.836 3.565 3.999 . 0 0 "[ . 1 . 2]" 1
956 1 49 LEU HA 1 52 VAL MG2 4.720 . 4.720 3.360 2.793 3.765 . 0 0 "[ . 1 . 2]" 1
957 1 49 LEU HA 1 52 VAL HB 4.630 . 4.630 2.255 2.106 2.387 . 0 0 "[ . 1 . 2]" 1
958 1 49 LEU HA 1 51 LEU H 4.390 . 4.390 4.409 4.252 4.477 0.087 4 0 "[ . 1 . 2]" 1
959 1 49 LEU O 1 53 VAL N . 2.700 3.300 2.916 2.838 3.045 . 0 0 "[ . 1 . 2]" 1
960 1 49 LEU O 1 53 VAL H . . 2.300 1.976 1.884 2.102 . 0 0 "[ . 1 . 2]" 1
961 1 50 GLN HG3 1 51 LEU H 6.250 . 6.250 4.266 4.035 4.789 . 0 0 "[ . 1 . 2]" 1
962 1 50 GLN H 1 54 LYS H 5.900 . 5.900 6.098 5.982 6.157 0.257 4 0 "[ . 1 . 2]" 1
963 1 50 GLN H 1 51 LEU MD2 5.730 . 5.730 5.207 5.049 5.656 . 0 0 "[ . 1 . 2]" 1
964 1 50 GLN HG3 1 54 LYS HD2 5.710 . 5.710 5.930 5.866 6.008 0.298 2 0 "[ . 1 . 2]" 1
965 1 50 GLN H 1 52 VAL H 5.610 . 5.610 3.848 3.684 4.061 . 0 0 "[ . 1 . 2]" 1
966 1 50 GLN H 1 50 GLN HG2 5.580 . 5.580 4.639 4.498 4.720 . 0 0 "[ . 1 . 2]" 1
967 1 50 GLN H 1 51 LEU HG 5.560 . 5.560 4.596 4.423 4.826 . 0 0 "[ . 1 . 2]" 1
968 1 50 GLN HG2 1 51 LEU H 5.520 . 5.520 4.619 3.872 4.937 . 0 0 "[ . 1 . 2]" 1
969 1 50 GLN H 1 51 LEU H 5.330 . 5.330 2.649 2.526 2.717 . 0 0 "[ . 1 . 2]" 1
970 1 50 GLN HA 1 52 VAL H 4.940 . 4.940 4.270 4.109 4.536 . 0 0 "[ . 1 . 2]" 1
971 1 50 GLN HA 1 54 LYS H 4.760 . 4.760 4.324 4.264 4.405 . 0 0 "[ . 1 . 2]" 1
972 1 50 GLN HA 1 53 VAL H 4.590 . 4.590 3.597 3.455 3.754 . 0 0 "[ . 1 . 2]" 1
973 1 50 GLN HB2 1 51 LEU H 4.560 . 4.560 3.941 3.878 3.997 . 0 0 "[ . 1 . 2]" 1
974 1 50 GLN HB3 1 51 LEU H 4.410 . 4.410 2.657 2.618 2.704 . 0 0 "[ . 1 . 2]" 1
975 1 50 GLN HA 1 53 VAL MG1 4.270 . 4.270 4.189 2.359 4.576 0.306 15 0 "[ . 1 . 2]" 1
976 1 50 GLN O 1 54 LYS N . 2.700 3.300 3.229 3.157 3.314 0.014 12 0 "[ . 1 . 2]" 1
977 1 50 GLN O 1 54 LYS H . . 2.300 2.292 2.216 2.408 0.108 12 0 "[ . 1 . 2]" 1
978 1 51 LEU MD1 1 54 LYS HB3 6.290 . 6.290 5.818 5.593 6.051 . 0 0 "[ . 1 . 2]" 1
979 1 51 LEU H 1 55 LEU H 6.210 . 6.210 6.071 5.970 6.177 . 0 0 "[ . 1 . 2]" 1
980 1 51 LEU HB2 1 55 LEU H 5.820 . 5.820 5.770 5.671 5.858 0.038 2 0 "[ . 1 . 2]" 1
981 1 51 LEU MD2 1 52 VAL H 5.770 . 5.770 4.697 4.641 4.884 . 0 0 "[ . 1 . 2]" 1
982 1 51 LEU HA 1 52 VAL H 5.620 . 5.620 3.534 3.486 3.604 . 0 0 "[ . 1 . 2]" 1
983 1 51 LEU H 1 53 VAL H 5.550 . 5.550 4.218 4.134 4.345 . 0 0 "[ . 1 . 2]" 1
984 1 51 LEU H 1 51 LEU MD1 5.340 . 5.340 3.884 3.814 3.948 . 0 0 "[ . 1 . 2]" 1
985 1 51 LEU HA 1 55 LEU H 5.250 . 5.250 4.189 4.011 4.384 . 0 0 "[ . 1 . 2]" 1
986 1 51 LEU H 1 52 VAL H 5.220 . 5.220 2.532 2.494 2.571 . 0 0 "[ . 1 . 2]" 1
987 1 51 LEU H 1 52 VAL HB 5.170 . 5.170 4.517 4.416 4.703 . 0 0 "[ . 1 . 2]" 1
988 1 51 LEU HG 1 52 VAL H 5.150 . 5.150 4.568 4.446 4.773 . 0 0 "[ . 1 . 2]" 1
989 1 51 LEU H 1 51 LEU MD2 5.110 . 5.110 3.369 3.253 3.698 . 0 0 "[ . 1 . 2]" 1
990 1 51 LEU H 1 51 LEU HG 5.040 . 5.040 2.449 2.407 2.639 . 0 0 "[ . 1 . 2]" 1
991 1 51 LEU HB2 1 52 VAL H 4.890 . 4.890 3.140 2.876 3.382 . 0 0 "[ . 1 . 2]" 1
992 1 51 LEU HA 1 54 LYS HB3 4.860 . 4.860 3.224 3.030 3.480 . 0 0 "[ . 1 . 2]" 1
993 1 51 LEU HA 1 54 LYS H 4.760 . 4.760 3.192 3.116 3.263 . 0 0 "[ . 1 . 2]" 1
994 1 51 LEU H 1 54 LYS H 4.730 . 4.730 4.800 4.752 4.868 0.138 4 0 "[ . 1 . 2]" 1
995 1 51 LEU HA 1 51 LEU MD1 4.500 . 4.500 3.875 3.850 3.896 . 0 0 "[ . 1 . 2]" 1
996 1 51 LEU HB3 1 52 VAL H 4.470 . 4.470 4.067 3.864 4.243 . 0 0 "[ . 1 . 2]" 1
997 1 51 LEU O 1 55 LEU N . 2.700 3.300 3.113 2.898 3.240 . 0 0 "[ . 1 . 2]" 1
998 1 51 LEU O 1 55 LEU H . . 2.300 2.318 2.101 2.441 0.141 7 0 "[ . 1 . 2]" 1
999 1 52 VAL MG1 1 67 VAL H 6.190 . 6.190 5.436 5.116 5.704 . 0 0 "[ . 1 . 2]" 1
1000 1 52 VAL MG1 1 56 SER H 6.110 . 6.110 3.987 3.892 4.049 . 0 0 "[ . 1 . 2]" 1
1001 1 52 VAL MG1 1 56 SER HB2 5.940 . 5.940 5.177 4.084 5.566 . 0 0 "[ . 1 . 2]" 1
1002 1 52 VAL HA 1 55 LEU MD2 5.840 . 5.840 4.859 4.741 5.081 . 0 0 "[ . 1 . 2]" 1
1003 1 52 VAL H 1 53 VAL HA 5.740 . 5.740 5.096 4.915 5.273 . 0 0 "[ . 1 . 2]" 1
1004 1 52 VAL MG1 1 67 VAL HA 5.600 . 5.600 5.579 5.264 5.810 0.210 9 0 "[ . 1 . 2]" 1
1005 1 52 VAL HA 1 55 LEU HA 5.170 . 5.170 5.245 5.166 5.307 0.137 1 0 "[ . 1 . 2]" 1
1006 1 52 VAL HA 1 53 VAL H 5.450 . 5.450 3.609 3.572 3.639 . 0 0 "[ . 1 . 2]" 1
1007 1 52 VAL MG1 1 63 VAL MG1 5.320 . 5.320 2.893 2.331 3.266 . 0 0 "[ . 1 . 2]" 1
1008 1 52 VAL HA 1 54 LYS H 5.060 . 5.060 4.399 4.240 4.490 . 0 0 "[ . 1 . 2]" 1
1009 1 52 VAL HA 1 55 LEU HB2 4.850 . 4.850 2.647 2.368 2.813 . 0 0 "[ . 1 . 2]" 1
1010 1 52 VAL H 1 53 VAL H 4.840 . 4.840 2.547 2.314 2.774 . 0 0 "[ . 1 . 2]" 1
1011 1 52 VAL MG1 1 63 VAL HA 4.840 . 4.840 3.683 3.395 3.995 . 0 0 "[ . 1 . 2]" 1
1012 1 52 VAL HB 1 66 LEU MD1 4.820 . 4.820 4.946 4.869 5.003 0.183 6 0 "[ . 1 . 2]" 1
1013 1 52 VAL HA 1 56 SER H 4.750 . 4.750 4.607 4.496 4.704 . 0 0 "[ . 1 . 2]" 1
1014 1 52 VAL HA 1 55 LEU HB3 4.740 . 4.740 3.832 3.194 4.419 . 0 0 "[ . 1 . 2]" 1
1015 1 52 VAL HA 1 66 LEU MD1 4.700 . 4.700 3.266 3.048 3.429 . 0 0 "[ . 1 . 2]" 1
1016 1 52 VAL H 1 52 VAL MG1 4.590 . 4.590 3.613 3.501 3.742 . 0 0 "[ . 1 . 2]" 1
1017 1 52 VAL H 1 52 VAL MG2 4.590 . 4.590 2.816 2.263 3.122 . 0 0 "[ . 1 . 2]" 1
1018 1 52 VAL HA 1 55 LEU MD1 4.480 . 4.480 2.873 2.273 3.518 . 0 0 "[ . 1 . 2]" 1
1019 1 52 VAL HA 1 55 LEU H 4.480 . 4.480 3.303 3.247 3.362 . 0 0 "[ . 1 . 2]" 1
1020 1 52 VAL MG1 1 66 LEU MD1 4.460 . 4.460 3.205 2.702 3.493 . 0 0 "[ . 1 . 2]" 1
1021 1 52 VAL H 1 55 LEU H 4.450 . 4.450 4.625 4.517 4.742 0.292 16 0 "[ . 1 . 2]" 1
1022 1 52 VAL MG1 1 53 VAL H 4.030 . 4.030 3.171 2.995 3.413 . 0 0 "[ . 1 . 2]" 1
1023 1 52 VAL O 1 56 SER N . 2.700 3.300 3.270 3.214 3.347 0.047 12 0 "[ . 1 . 2]" 1
1024 1 52 VAL O 1 56 SER H . . 2.300 2.414 2.371 2.457 0.157 16 0 "[ . 1 . 2]" 1
1025 1 53 VAL MG1 1 55 LEU H 6.370 . 6.370 4.542 4.041 4.757 . 0 0 "[ . 1 . 2]" 1
1026 1 53 VAL MG2 1 57 GLU H 5.900 . 5.900 5.792 4.117 6.104 0.204 4 0 "[ . 1 . 2]" 1
1027 1 53 VAL HA 1 56 SER HA 5.550 . 5.550 5.537 5.445 5.636 0.086 13 0 "[ . 1 . 2]" 1
1028 1 53 VAL MG2 1 56 SER H 5.390 . 5.390 4.850 4.142 5.116 . 0 0 "[ . 1 . 2]" 1
1029 1 53 VAL HA 1 57 GLU H 5.010 . 5.010 4.746 4.532 4.816 . 0 0 "[ . 1 . 2]" 1
1030 1 53 VAL HA 1 56 SER HB3 4.980 . 4.980 3.654 3.330 4.925 . 0 0 "[ . 1 . 2]" 1
1031 1 53 VAL HA 1 63 VAL HB 5.570 2.250 5.570 5.894 5.757 5.960 0.390 9 0 "[ . 1 . 2]" 1
1032 1 53 VAL HA 1 57 GLU HG2 4.890 . 4.890 4.857 4.569 5.048 0.158 6 0 "[ . 1 . 2]" 1
1033 1 53 VAL HA 1 54 LYS H 4.880 . 4.880 3.666 3.629 3.687 . 0 0 "[ . 1 . 2]" 1
1034 1 53 VAL HA 1 56 SER HB2 4.840 . 4.840 4.644 3.221 4.988 0.148 8 0 "[ . 1 . 2]" 1
1035 1 53 VAL H 1 53 VAL MG1 4.690 . 4.690 3.556 2.457 3.756 . 0 0 "[ . 1 . 2]" 1
1036 1 53 VAL MG2 1 56 SER HB2 5.920 . 5.920 5.585 4.289 5.962 0.042 2 0 "[ . 1 . 2]" 1
1037 1 53 VAL HA 1 55 LEU H 4.610 . 4.610 3.991 3.827 4.183 . 0 0 "[ . 1 . 2]" 1
1038 1 53 VAL HA 1 56 SER H 4.600 . 4.600 3.207 3.102 3.346 . 0 0 "[ . 1 . 2]" 1
1039 1 53 VAL MG1 1 54 LYS H 4.370 . 4.370 3.240 1.906 3.489 . 0 0 "[ . 1 . 2]" 1
1040 1 53 VAL HB 1 54 LYS H 4.360 . 4.360 3.012 2.785 4.078 . 0 0 "[ . 1 . 2]" 1
1041 1 53 VAL H 1 54 LYS H 4.170 . 4.170 2.683 2.630 2.750 . 0 0 "[ . 1 . 2]" 1
1042 1 53 VAL O 1 57 GLU N . 2.700 3.300 3.286 3.210 3.327 0.027 11 0 "[ . 1 . 2]" 1
1043 1 53 VAL O 1 57 GLU H . . 2.300 2.513 2.384 2.577 0.277 4 0 "[ . 1 . 2]" 1
1044 1 54 LYS HE2 1 58 VAL MG2 6.310 . 6.310 5.249 5.084 5.442 . 0 0 "[ . 1 . 2]" 1
1045 1 54 LYS HB3 1 55 LEU HA 6.280 . 6.280 3.986 3.937 4.041 . 0 0 "[ . 1 . 2]" 1
1046 1 54 LYS H 1 57 GLU H 5.510 . 5.510 4.954 4.850 4.993 . 0 0 "[ . 1 . 2]" 1
1047 1 54 LYS HG3 1 58 VAL H 5.440 . 5.440 3.552 3.452 3.627 . 0 0 "[ . 1 . 2]" 1
1048 1 54 LYS HA 1 58 VAL H 5.440 . 5.440 3.787 3.696 3.863 . 0 0 "[ . 1 . 2]" 1
1049 1 54 LYS HB3 1 57 GLU H 5.390 . 5.390 5.213 5.054 5.420 0.030 12 0 "[ . 1 . 2]" 1
1050 1 54 LYS HG2 1 58 VAL H 5.260 . 5.260 5.260 5.094 5.326 0.066 11 0 "[ . 1 . 2]" 1
1051 1 54 LYS HG2 1 55 LEU H 5.230 . 5.230 5.289 5.198 5.428 0.198 2 0 "[ . 1 . 2]" 1
1052 1 54 LYS H 1 56 SER H 5.200 . 5.200 4.287 4.216 4.378 . 0 0 "[ . 1 . 2]" 1
1053 1 54 LYS HA 1 54 LYS HD2 5.160 . 5.160 2.186 2.117 2.283 . 0 0 "[ . 1 . 2]" 1
1054 1 54 LYS H 1 55 LEU H 5.130 . 5.130 2.570 2.492 2.633 . 0 0 "[ . 1 . 2]" 1
1055 1 54 LYS H 1 54 LYS HD2 5.050 . 5.050 4.247 4.018 4.396 . 0 0 "[ . 1 . 2]" 1
1056 1 54 LYS QE 1 58 VAL HA 5.020 . 5.020 4.923 4.840 5.002 . 0 0 "[ . 1 . 2]" 1
1057 1 54 LYS HA 1 55 LEU H 4.950 . 4.950 3.537 3.486 3.585 . 0 0 "[ . 1 . 2]" 1
1058 1 54 LYS HG3 1 58 VAL HB 4.930 . 4.930 2.703 2.555 2.866 . 0 0 "[ . 1 . 2]" 1
1059 1 54 LYS QE 1 58 VAL MG2 4.880 . 4.880 4.176 3.960 4.468 . 0 0 "[ . 1 . 2]" 1
1060 1 54 LYS HD2 1 57 GLU HG3 4.850 . 4.850 4.463 4.284 4.614 . 0 0 "[ . 1 . 2]" 1
1061 1 54 LYS HD2 1 57 GLU HB3 4.740 . 4.740 4.766 4.648 4.869 0.129 4 0 "[ . 1 . 2]" 1
1062 1 54 LYS HA 1 57 GLU HG3 4.590 . 4.590 4.232 3.965 4.447 . 0 0 "[ . 1 . 2]" 1
1063 1 54 LYS HG3 1 58 VAL MG2 4.550 . 4.550 4.073 3.916 4.214 . 0 0 "[ . 1 . 2]" 1
1064 1 54 LYS HA 1 57 GLU HB3 4.490 . 4.490 4.560 4.348 4.677 0.187 17 0 "[ . 1 . 2]" 1
1065 1 54 LYS HB3 1 55 LEU H 4.390 . 4.390 3.074 2.951 3.269 . 0 0 "[ . 1 . 2]" 1
1066 1 54 LYS O 1 58 VAL N . 2.700 3.300 2.760 2.728 2.823 . 0 0 "[ . 1 . 2]" 1
1067 1 54 LYS HA 1 57 GLU HB2 4.330 . 4.330 2.803 2.588 2.915 . 0 0 "[ . 1 . 2]" 1
1068 1 54 LYS O 1 58 VAL H . . 2.300 1.790 1.753 1.859 . 0 0 "[ . 1 . 2]" 1
1069 1 55 LEU MD2 1 59 SER HA 6.620 . 6.620 5.356 4.961 5.630 . 0 0 "[ . 1 . 2]" 1
1070 1 55 LEU MD2 1 66 LEU MD1 6.130 . 6.130 2.879 1.979 3.518 . 0 0 "[ . 1 . 2]" 1
1071 1 55 LEU MD2 1 56 SER H 6.090 . 6.090 4.370 3.702 4.866 . 0 0 "[ . 1 . 2]" 1
1072 1 55 LEU H 1 55 LEU MD2 5.830 . 5.830 4.242 3.948 4.431 . 0 0 "[ . 1 . 2]" 1
1073 1 55 LEU HG 1 59 SER H 5.730 . 5.730 5.407 4.564 6.055 0.325 1 0 "[ . 1 . 2]" 1
1074 1 55 LEU HA 1 58 VAL MG2 5.720 . 5.720 4.864 4.729 5.017 . 0 0 "[ . 1 . 2]" 1
1075 1 55 LEU H 1 58 VAL MG1 5.590 . 5.590 4.263 4.090 4.384 . 0 0 "[ . 1 . 2]" 1
1076 1 55 LEU MD2 1 58 VAL MG1 5.590 . 5.590 3.013 2.432 3.683 . 0 0 "[ . 1 . 2]" 1
1077 1 55 LEU MD2 1 59 SER HB2 5.560 . 5.560 3.335 2.305 4.752 . 0 0 "[ . 1 . 2]" 1
1078 1 55 LEU H 1 55 LEU MD1 5.520 . 5.520 3.888 3.615 4.143 . 0 0 "[ . 1 . 2]" 1
1079 1 55 LEU MD2 1 59 SER H 5.490 . 5.490 3.886 3.501 4.166 . 0 0 "[ . 1 . 2]" 1
1080 1 55 LEU H 1 56 SER H 5.280 . 5.280 2.683 2.595 2.758 . 0 0 "[ . 1 . 2]" 1
1081 1 55 LEU HG 1 56 SER H 5.270 . 5.270 4.953 4.778 5.170 . 0 0 "[ . 1 . 2]" 1
1082 1 55 LEU H 1 57 GLU H 5.250 . 5.250 4.007 3.873 4.219 . 0 0 "[ . 1 . 2]" 1
1083 1 55 LEU MD1 1 66 LEU HA 5.240 . 5.240 5.340 5.196 5.460 0.220 20 0 "[ . 1 . 2]" 1
1084 1 55 LEU MD2 1 61 VAL MG2 5.190 . 5.190 3.167 2.177 4.276 . 0 0 "[ . 1 . 2]" 1
1085 1 55 LEU HA 1 61 VAL H 5.170 . 5.170 5.368 5.235 5.571 0.401 5 0 "[ . 1 . 2]" 1
1086 1 55 LEU HB2 1 66 LEU MD1 5.140 . 5.140 3.371 3.097 3.618 . 0 0 "[ . 1 . 2]" 1
1087 1 55 LEU HA 1 59 SER H 5.120 . 5.120 3.628 3.361 3.898 . 0 0 "[ . 1 . 2]" 1
1088 1 55 LEU HB3 1 56 SER H 4.980 . 4.980 3.150 2.696 3.614 . 0 0 "[ . 1 . 2]" 1
1089 1 55 LEU MD2 1 59 SER HB3 4.980 . 4.980 3.622 2.932 4.597 . 0 0 "[ . 1 . 2]" 1
1090 1 55 LEU HA 1 58 VAL HB 4.840 . 4.840 4.078 3.890 4.268 . 0 0 "[ . 1 . 2]" 1
1091 1 55 LEU HB2 1 56 SER H 4.790 . 4.790 3.339 2.882 3.805 . 0 0 "[ . 1 . 2]" 1
1092 1 55 LEU HA 1 58 VAL H 4.720 . 4.720 3.438 3.301 3.593 . 0 0 "[ . 1 . 2]" 1
1093 1 55 LEU MD2 1 66 LEU HB2 4.520 . 4.520 3.831 2.662 4.692 0.172 17 0 "[ . 1 . 2]" 1
1094 1 55 LEU HA 1 58 VAL MG1 4.200 . 4.200 2.083 1.869 2.270 . 0 0 "[ . 1 . 2]" 1
1095 1 55 LEU O 1 59 SER N . 2.700 3.300 3.238 3.076 3.316 0.016 9 0 "[ . 1 . 2]" 1
1096 1 55 LEU O 1 59 SER H . . 2.300 2.272 2.114 2.354 0.054 9 0 "[ . 1 . 2]" 1
1097 1 56 SER HA 1 63 VAL MG1 6.080 . 6.080 4.327 4.174 4.487 . 0 0 "[ . 1 . 2]" 1
1098 1 56 SER H 1 57 GLU HG2 6.030 . 6.030 4.540 4.368 4.730 . 0 0 "[ . 1 . 2]" 1
1099 1 56 SER H 1 63 VAL HA 5.910 . 5.910 5.888 5.622 5.997 0.087 14 0 "[ . 1 . 2]" 1
1100 1 56 SER H 1 59 SER H 5.830 . 5.830 5.078 4.977 5.145 . 0 0 "[ . 1 . 2]" 1
1101 1 56 SER HA 1 61 VAL MG1 5.740 . 5.740 4.595 4.336 4.679 . 0 0 "[ . 1 . 2]" 1
1102 1 56 SER HA 1 63 VAL HA 5.500 . 5.500 5.562 5.434 5.634 0.134 2 0 "[ . 1 . 2]" 1
1103 1 56 SER H 1 63 VAL MG1 5.310 . 5.310 4.258 3.789 4.560 . 0 0 "[ . 1 . 2]" 1
1104 1 56 SER HB3 1 63 VAL H 5.300 . 5.300 4.593 4.339 5.421 0.121 11 0 "[ . 1 . 2]" 1
1105 1 56 SER HB3 1 61 VAL H 5.160 . 5.160 4.674 3.706 5.240 0.080 13 0 "[ . 1 . 2]" 1
1106 1 56 SER H 1 66 LEU MD1 5.150 . 5.150 5.194 4.976 5.249 0.099 20 0 "[ . 1 . 2]" 1
1107 1 56 SER HB2 1 61 VAL HB 5.350 . 5.350 5.372 5.195 5.692 0.342 5 0 "[ . 1 . 2]" 1
1108 1 56 SER H 1 57 GLU H 5.080 . 5.080 2.673 2.576 2.773 . 0 0 "[ . 1 . 2]" 1
1109 1 56 SER HB2 1 63 VAL H 5.040 . 5.040 4.424 3.824 5.464 0.424 5 0 "[ . 1 . 2]" 1
1110 1 56 SER HB3 1 62 PRO HA 4.550 . 4.550 4.659 4.081 5.018 0.468 13 0 "[ . 1 . 2]" 1
1111 1 56 SER HB2 1 57 GLU H 4.320 . 4.320 4.270 3.326 4.373 0.053 10 0 "[ . 1 . 2]" 1
1112 1 56 SER HB3 1 63 VAL MG1 4.320 . 4.320 2.654 2.254 3.494 . 0 0 "[ . 1 . 2]" 1
1113 1 56 SER HB2 1 63 VAL MG1 4.100 . 4.100 2.997 2.244 3.292 . 0 0 "[ . 1 . 2]" 1
1114 1 57 GLU H 1 60 SER H 5.460 . 5.460 4.157 4.064 4.458 . 0 0 "[ . 1 . 2]" 1
1115 1 57 GLU H 1 59 SER H 5.280 . 5.280 3.997 3.889 4.372 . 0 0 "[ . 1 . 2]" 1
1116 1 57 GLU HG3 1 58 VAL H 5.130 . 5.130 5.231 5.206 5.264 0.134 19 0 "[ . 1 . 2]" 1
1117 1 57 GLU H 1 58 VAL H 4.900 . 4.900 2.342 2.243 2.609 . 0 0 "[ . 1 . 2]" 1
1118 1 57 GLU HA 1 58 VAL H 4.650 . 4.650 3.627 3.609 3.647 . 0 0 "[ . 1 . 2]" 1
1119 1 57 GLU HB3 1 58 VAL HA 4.610 . 4.610 4.132 4.082 4.172 . 0 0 "[ . 1 . 2]" 1
1120 1 57 GLU HB2 1 58 VAL HA 4.530 . 4.530 4.335 4.281 4.446 . 0 0 "[ . 1 . 2]" 1
1121 1 57 GLU HA 1 60 SER H 4.480 . 4.480 3.544 3.431 3.750 . 0 0 "[ . 1 . 2]" 1
1122 1 57 GLU HB2 1 58 VAL H 4.360 . 4.360 2.830 2.797 2.898 . 0 0 "[ . 1 . 2]" 1
1123 1 57 GLU HB3 1 58 VAL H 4.200 . 4.200 3.710 3.657 3.754 . 0 0 "[ . 1 . 2]" 1
1124 1 58 VAL MG2 1 59 SER HB3 6.500 . 6.500 5.402 4.051 5.648 . 0 0 "[ . 1 . 2]" 1
1125 1 58 VAL HB 1 60 SER H 5.590 . 5.590 5.566 5.540 5.589 . 0 0 "[ . 1 . 2]" 1
1126 1 58 VAL MG1 1 59 SER HA 5.590 . 5.590 3.327 3.136 3.513 . 0 0 "[ . 1 . 2]" 1
1127 1 58 VAL HA 1 59 SER H 5.220 . 5.220 3.627 3.609 3.652 . 0 0 "[ . 1 . 2]" 1
1128 1 58 VAL H 1 60 SER HA 5.200 . 5.200 5.405 5.377 5.440 0.240 14 0 "[ . 1 . 2]" 1
1129 1 58 VAL H 1 59 SER H 4.960 . 4.960 2.688 2.649 2.767 . 0 0 "[ . 1 . 2]" 1
1130 1 58 VAL MG2 1 59 SER H 4.710 . 4.710 3.974 3.905 4.028 . 0 0 "[ . 1 . 2]" 1
1131 1 58 VAL H 1 58 VAL MG2 4.670 . 4.670 3.774 3.765 3.791 . 0 0 "[ . 1 . 2]" 1
1132 1 58 VAL HA 1 60 SER H 4.620 . 4.620 4.424 4.286 4.507 . 0 0 "[ . 1 . 2]" 1
1133 1 58 VAL HB 1 59 SER H 4.510 . 4.510 4.014 3.973 4.052 . 0 0 "[ . 1 . 2]" 1
1134 1 59 SER HA 1 60 SER HB3 6.150 . 6.150 5.148 4.819 5.826 . 0 0 "[ . 1 . 2]" 1
1135 1 59 SER H 1 60 SER HA 5.610 . 5.610 4.217 4.095 4.397 . 0 0 "[ . 1 . 2]" 1
1136 1 59 SER HB3 1 61 VAL H 5.460 . 5.460 3.779 3.211 5.366 . 0 0 "[ . 1 . 2]" 1
1137 1 59 SER H 1 61 VAL MG2 5.400 . 5.400 4.005 3.804 4.323 . 0 0 "[ . 1 . 2]" 1
1138 1 59 SER HB3 1 60 SER H 5.330 . 5.330 3.845 3.537 4.544 . 0 0 "[ . 1 . 2]" 1
1139 1 59 SER HB2 1 60 SER H 5.310 . 5.310 4.073 3.500 4.414 . 0 0 "[ . 1 . 2]" 1
1140 1 59 SER HB2 1 61 VAL H 4.800 . 4.800 4.441 3.209 4.922 0.122 1 0 "[ . 1 . 2]" 1
1141 1 59 SER H 1 60 SER H 4.770 . 4.770 2.047 1.925 2.226 . 0 0 "[ . 1 . 2]" 1
1142 1 59 SER H 1 61 VAL H 4.760 . 4.760 3.593 3.426 3.719 . 0 0 "[ . 1 . 2]" 1
1143 1 59 SER HB3 1 61 VAL MG2 4.420 . 4.420 2.161 1.730 3.704 . 0 0 "[ . 1 . 2]" 1
1144 1 60 SER H 1 61 VAL HB 6.170 . 6.170 4.990 4.933 5.036 . 0 0 "[ . 1 . 2]" 1
1145 1 60 SER H 1 61 VAL MG2 5.550 . 5.550 3.828 3.659 3.991 . 0 0 "[ . 1 . 2]" 1
1146 1 60 SER H 1 61 VAL H 4.710 . 4.710 2.686 2.603 2.727 . 0 0 "[ . 1 . 2]" 1
1147 1 60 SER HA 1 61 VAL H 4.180 . 4.180 2.775 2.689 2.893 . 0 0 "[ . 1 . 2]" 1
1148 1 61 VAL MG1 1 66 LEU MD1 6.710 . 6.710 3.975 3.657 4.530 . 0 0 "[ . 1 . 2]" 1
1149 1 61 VAL MG1 1 66 LEU MD2 6.270 . 6.270 4.002 3.106 4.168 . 0 0 "[ . 1 . 2]" 1
1150 1 61 VAL MG1 1 65 GLU HG3 6.220 . 6.220 4.926 4.634 5.174 . 0 0 "[ . 1 . 2]" 1
1151 1 61 VAL MG2 1 62 PRO HD2 6.160 . 6.160 3.751 3.409 3.943 . 0 0 "[ . 1 . 2]" 1
1152 1 61 VAL MG1 1 65 GLU HG2 6.140 . 6.140 5.422 3.529 5.802 . 0 0 "[ . 1 . 2]" 1
1153 1 61 VAL HB 1 66 LEU HB3 6.070 . 6.070 4.095 3.882 5.286 . 0 0 "[ . 1 . 2]" 1
1154 1 61 VAL MG1 1 62 PRO HD3 5.700 . 5.700 2.929 2.708 3.214 . 0 0 "[ . 1 . 2]" 1
1155 1 61 VAL MG1 1 66 LEU HG 5.590 . 5.590 4.942 3.557 5.126 . 0 0 "[ . 1 . 2]" 1
1156 1 61 VAL H 1 62 PRO HD2 5.570 . 5.570 5.030 4.706 5.160 . 0 0 "[ . 1 . 2]" 1
1157 1 61 VAL MG1 1 65 GLU HA 5.520 . 5.520 5.163 4.860 5.369 . 0 0 "[ . 1 . 2]" 1
1158 1 61 VAL HB 1 66 LEU H 5.520 . 5.520 5.552 5.292 5.612 0.092 11 0 "[ . 1 . 2]" 1
1159 1 61 VAL MG1 1 65 GLU H 5.520 . 5.520 4.168 4.036 4.307 . 0 0 "[ . 1 . 2]" 1
1160 1 61 VAL HB 1 66 LEU MD1 5.510 . 5.510 4.339 3.975 5.153 . 0 0 "[ . 1 . 2]" 1
1161 1 61 VAL MG1 1 62 PRO HD2 5.440 . 5.440 1.811 1.646 2.178 0.004 7 0 "[ . 1 . 2]" 1
1162 1 61 VAL HA 1 62 PRO HD2 5.090 . 5.090 2.406 2.012 2.593 . 0 0 "[ . 1 . 2]" 1
1163 1 61 VAL HA 1 62 PRO HG2 4.980 . 4.980 4.330 4.249 4.409 . 0 0 "[ . 1 . 2]" 1
1164 1 61 VAL HB 1 66 LEU MD2 4.600 . 4.600 4.619 3.951 4.700 0.100 20 0 "[ . 1 . 2]" 1
1165 1 61 VAL HA 1 62 PRO HD3 4.600 . 4.600 1.894 1.704 2.300 . 0 0 "[ . 1 . 2]" 1
1166 1 61 VAL H 1 61 VAL MG2 4.540 . 4.540 2.565 2.437 2.686 . 0 0 "[ . 1 . 2]" 1
1167 1 61 VAL MG1 1 66 LEU HB2 4.270 . 4.270 2.735 2.405 3.050 . 0 0 "[ . 1 . 2]" 1
1168 1 61 VAL MG1 1 65 GLU HB3 4.230 . 4.230 3.819 2.437 4.182 . 0 0 "[ . 1 . 2]" 1
1169 1 61 VAL MG1 1 66 LEU H 4.210 . 4.210 3.373 3.233 3.477 . 0 0 "[ . 1 . 2]" 1
1170 1 61 VAL MG1 1 66 LEU HA 4.200 . 4.200 3.308 3.148 3.421 . 0 0 "[ . 1 . 2]" 1
1171 1 61 VAL MG1 1 65 GLU HB2 3.820 . 3.820 3.046 2.762 3.822 0.002 10 0 "[ . 1 . 2]" 1
1172 1 62 PRO HD3 1 66 LEU H 6.400 . 6.400 6.259 6.049 6.406 0.006 11 0 "[ . 1 . 2]" 1
1173 1 62 PRO HA 1 63 VAL MG2 5.840 . 5.840 4.190 4.039 4.313 . 0 0 "[ . 1 . 2]" 1
1174 1 62 PRO HA 1 66 LEU H 5.830 . 5.830 5.320 5.226 5.449 . 0 0 "[ . 1 . 2]" 1
1175 1 62 PRO HD2 1 64 THR H 5.820 . 5.820 5.536 5.130 5.950 0.130 7 0 "[ . 1 . 2]" 1
1176 1 62 PRO HD3 1 63 VAL H 5.800 . 5.800 5.780 5.581 5.859 0.059 12 0 "[ . 1 . 2]" 1
1177 1 62 PRO HA 1 66 LEU HB3 5.660 . 5.660 5.278 5.095 5.849 0.189 12 0 "[ . 1 . 2]" 1
1178 1 62 PRO HA 1 63 VAL MG1 5.650 . 5.650 3.377 3.212 3.515 . 0 0 "[ . 1 . 2]" 1
1179 1 62 PRO HB3 1 66 LEU H 5.610 . 5.610 5.437 5.225 5.823 0.213 13 0 "[ . 1 . 2]" 1
1180 1 62 PRO HB2 1 64 THR MG 5.530 . 5.530 4.425 4.002 4.704 . 0 0 "[ . 1 . 2]" 1
1181 1 62 PRO HG2 1 63 VAL H 5.520 . 5.520 5.369 4.799 5.575 0.055 5 0 "[ . 1 . 2]" 1
1182 1 62 PRO HA 1 65 GLU H 5.450 . 5.450 4.704 4.496 4.981 . 0 0 "[ . 1 . 2]" 1
1183 1 62 PRO HD2 1 65 GLU H 5.090 . 5.090 4.409 4.114 4.919 . 0 0 "[ . 1 . 2]" 1
1184 1 62 PRO HB3 1 64 THR H 5.030 . 5.030 3.377 3.133 3.954 . 0 0 "[ . 1 . 2]" 1
1185 1 62 PRO HB2 1 64 THR H 5.010 . 5.010 2.600 2.236 2.782 . 0 0 "[ . 1 . 2]" 1
1186 1 62 PRO HA 1 64 THR H 4.970 . 4.970 3.910 3.836 4.061 . 0 0 "[ . 1 . 2]" 1
1187 1 62 PRO HB3 1 63 VAL H 4.850 . 4.850 3.327 3.035 3.714 . 0 0 "[ . 1 . 2]" 1
1188 1 62 PRO HG2 1 64 THR H 4.820 . 4.820 4.770 3.828 5.074 0.254 15 0 "[ . 1 . 2]" 1
1189 1 62 PRO HB2 1 65 GLU H 4.790 . 4.790 2.203 1.912 2.764 . 0 0 "[ . 1 . 2]" 1
1190 1 62 PRO HD3 1 65 GLU HB2 4.700 . 4.700 4.550 4.419 4.821 0.121 12 0 "[ . 1 . 2]" 1
1191 1 62 PRO HB2 1 63 VAL H 4.590 . 4.590 3.514 2.929 3.723 . 0 0 "[ . 1 . 2]" 1
1192 1 62 PRO HB3 1 65 GLU H 4.440 . 4.440 3.804 3.485 4.453 0.013 13 0 "[ . 1 . 2]" 1
1193 1 62 PRO HA 1 63 VAL H 3.900 . 3.900 2.276 2.248 2.313 . 0 0 "[ . 1 . 2]" 1
1194 1 62 PRO O 1 66 LEU N . 2.700 3.300 3.118 3.050 3.181 . 0 0 "[ . 1 . 2]" 1
1195 1 62 PRO HD2 1 65 GLU HB2 3.650 . 3.650 2.954 2.687 3.501 . 0 0 "[ . 1 . 2]" 1
1196 1 62 PRO O 1 66 LEU H . . 2.300 2.305 2.182 2.378 0.078 11 0 "[ . 1 . 2]" 1
1197 1 63 VAL MG1 1 66 LEU MD1 6.600 . 6.600 4.925 4.245 5.187 . 0 0 "[ . 1 . 2]" 1
1198 1 63 VAL H 1 66 LEU H 6.400 . 6.400 4.855 4.821 4.911 . 0 0 "[ . 1 . 2]" 1
1199 1 63 VAL HA 1 67 VAL H 5.910 . 5.910 3.988 3.757 4.067 . 0 0 "[ . 1 . 2]" 1
1200 1 63 VAL H 1 64 THR MG 5.790 . 5.790 3.934 3.825 4.070 . 0 0 "[ . 1 . 2]" 1
1201 1 63 VAL MG1 1 64 THR H 5.770 . 5.770 4.088 4.015 4.230 . 0 0 "[ . 1 . 2]" 1
1202 1 63 VAL HA 1 66 LEU HG 5.740 . 5.740 4.298 3.874 4.598 . 0 0 "[ . 1 . 2]" 1
1203 1 63 VAL HB 1 64 THR MG 5.690 . 5.690 4.325 4.179 4.430 . 0 0 "[ . 1 . 2]" 1
1204 1 63 VAL HA 1 65 GLU H 5.590 . 5.590 4.578 4.521 4.630 . 0 0 "[ . 1 . 2]" 1
1205 1 63 VAL HA 1 66 LEU H 5.520 . 5.520 3.497 3.464 3.586 . 0 0 "[ . 1 . 2]" 1
1206 1 63 VAL H 1 65 GLU H 5.330 . 5.330 4.439 4.315 4.618 . 0 0 "[ . 1 . 2]" 1
1207 1 63 VAL H 1 64 THR H 5.230 . 5.230 2.709 2.676 2.754 . 0 0 "[ . 1 . 2]" 1
1208 1 63 VAL HA 1 66 LEU MD2 5.090 . 5.090 1.996 1.627 5.063 0.023 13 0 "[ . 1 . 2]" 1
1209 1 63 VAL HA 1 64 THR HA 5.080 . 5.080 4.486 4.476 4.499 . 0 0 "[ . 1 . 2]" 1
1210 1 63 VAL HA 1 64 THR H 4.850 . 4.850 3.512 3.483 3.538 . 0 0 "[ . 1 . 2]" 1
1211 1 63 VAL HB 1 64 THR H . 2.090 4.630 4.423 4.373 4.477 . 0 0 "[ . 1 . 2]" 1
1212 1 63 VAL MG2 1 64 THR MG 4.680 . 4.680 2.073 1.824 2.297 . 0 0 "[ . 1 . 2]" 1
1213 1 63 VAL H 1 63 VAL MG1 4.630 . 4.630 2.035 1.817 2.252 . 0 0 "[ . 1 . 2]" 1
1214 1 63 VAL MG2 1 64 THR H 4.540 . 4.540 2.590 2.410 2.828 . 0 0 "[ . 1 . 2]" 1
1215 1 63 VAL HA 1 66 LEU HB3 4.480 . 4.480 2.824 2.440 3.019 . 0 0 "[ . 1 . 2]" 1
1216 1 63 VAL HA 1 67 VAL HB 4.430 . 4.430 4.684 4.578 4.742 0.312 8 0 "[ . 1 . 2]" 1
1217 1 63 VAL O 1 67 VAL N . 2.700 3.300 3.468 3.432 3.499 0.199 5 0 "[ . 1 . 2]" 1
1218 1 63 VAL HA 1 66 LEU MD1 4.410 . 4.410 4.255 3.605 4.426 0.016 10 0 "[ . 1 . 2]" 1
1219 1 63 VAL O 1 67 VAL H . 2.200 2.800 2.567 2.507 2.609 . 0 0 "[ . 1 . 2]" 1
1220 1 64 THR H 1 67 VAL H 6.650 . 6.650 4.516 4.457 4.572 . 0 0 "[ . 1 . 2]" 1
1221 1 64 THR HA 1 66 LEU H 6.040 . 6.040 3.947 3.861 4.072 . 0 0 "[ . 1 . 2]" 1
1222 1 64 THR HB 1 141 SER H 6.010 . 6.010 6.307 6.242 6.367 0.357 15 0 "[ . 1 . 2]" 1
1223 1 64 THR MG 1 141 SER H 6.010 . 6.010 5.400 5.155 5.638 . 0 0 "[ . 1 . 2]" 1
1224 1 64 THR HB 1 66 LEU H 5.970 . 5.970 5.445 5.388 5.560 . 0 0 "[ . 1 . 2]" 1
1225 1 64 THR MG 1 67 VAL MG1 5.970 . 5.970 3.633 3.457 3.807 . 0 0 "[ . 1 . 2]" 1
1226 1 64 THR H 1 67 VAL MG1 5.880 . 5.880 4.692 4.533 4.849 . 0 0 "[ . 1 . 2]" 1
1227 1 64 THR HB 1 68 ARG H 5.790 . 5.790 5.357 5.223 5.456 . 0 0 "[ . 1 . 2]" 1
1228 1 64 THR MG 1 67 VAL HB 5.780 . 5.780 4.811 4.664 5.094 . 0 0 "[ . 1 . 2]" 1
1229 1 64 THR MG 1 141 SER HB3 5.310 . 5.310 4.238 3.886 4.519 . 0 0 "[ . 1 . 2]" 1
1230 1 64 THR H 1 66 LEU H 5.270 . 5.270 3.516 3.384 3.628 . 0 0 "[ . 1 . 2]" 1
1231 1 64 THR HA 1 67 VAL MG2 5.190 . 5.190 4.554 4.430 4.726 . 0 0 "[ . 1 . 2]" 1
1232 1 64 THR HA 1 67 VAL H 5.060 . 5.060 3.223 3.142 3.373 . 0 0 "[ . 1 . 2]" 1
1233 1 64 THR H 1 65 GLU H 4.950 . 4.950 2.281 2.221 2.335 . 0 0 "[ . 1 . 2]" 1
1234 1 64 THR H 1 66 LEU HB3 4.900 . 4.900 4.755 4.619 4.937 0.037 10 0 "[ . 1 . 2]" 1
1235 1 64 THR MG 1 65 GLU H 4.810 . 4.810 4.014 3.971 4.051 . 0 0 "[ . 1 . 2]" 1
1236 1 64 THR HB 1 65 GLU HA 4.780 . 4.780 4.527 4.464 4.605 . 0 0 "[ . 1 . 2]" 1
1237 1 64 THR HA 1 65 GLU H 4.750 . 4.750 3.620 3.594 3.644 . 0 0 "[ . 1 . 2]" 1
1238 1 64 THR HB 1 65 GLU H 4.670 . 4.670 4.014 3.935 4.074 . 0 0 "[ . 1 . 2]" 1
1239 1 64 THR MG 1 141 SER HB2 4.620 . 4.620 4.011 3.711 4.373 . 0 0 "[ . 1 . 2]" 1
1240 1 64 THR H 1 64 THR MG 4.560 . 4.560 2.515 2.413 2.649 . 0 0 "[ . 1 . 2]" 1
1241 1 64 THR HA 1 67 VAL HB 4.510 . 4.510 3.287 3.148 3.621 . 0 0 "[ . 1 . 2]" 1
1242 1 64 THR HA 1 67 VAL MG1 4.320 . 4.320 2.159 1.937 2.490 . 0 0 "[ . 1 . 2]" 1
1243 1 64 THR O 1 68 ARG N . 2.700 3.300 3.318 3.224 3.362 0.062 12 0 "[ . 1 . 2]" 1
1244 1 64 THR O 1 68 ARG H . . 2.300 2.481 2.403 2.526 0.226 18 0 "[ . 1 . 2]" 1
1245 1 65 GLU H 1 66 LEU HG 6.220 . 6.220 6.172 5.869 6.607 0.387 12 0 "[ . 1 . 2]" 1
1246 1 65 GLU HA 1 67 VAL H 6.210 . 6.210 4.372 4.283 4.448 . 0 0 "[ . 1 . 2]" 1
1247 1 65 GLU HA 1 68 ARG H 6.170 . 6.170 3.294 3.126 3.491 . 0 0 "[ . 1 . 2]" 1
1248 1 65 GLU H 1 66 LEU HA 5.810 . 5.810 5.003 4.856 5.117 . 0 0 "[ . 1 . 2]" 1
1249 1 65 GLU HB2 1 67 VAL H 5.810 . 5.810 5.398 5.328 5.899 0.089 10 0 "[ . 1 . 2]" 1
1250 1 65 GLU HG2 1 66 LEU H 5.780 . 5.780 5.247 4.301 5.346 . 0 0 "[ . 1 . 2]" 1
1251 1 65 GLU H 1 67 VAL H 5.530 . 5.530 4.140 4.103 4.185 . 0 0 "[ . 1 . 2]" 1
1252 1 65 GLU HG3 1 66 LEU H 5.310 . 5.310 4.659 4.554 5.108 . 0 0 "[ . 1 . 2]" 1
1253 1 65 GLU H 1 65 GLU HG2 5.290 . 5.290 3.728 3.628 4.551 . 0 0 "[ . 1 . 2]" 1
1254 1 65 GLU H 1 65 GLU HG3 5.280 . 5.280 2.596 2.459 4.444 . 0 0 "[ . 1 . 2]" 1
1255 1 65 GLU HA 1 66 LEU H 5.060 . 5.060 3.516 3.490 3.554 . 0 0 "[ . 1 . 2]" 1
1256 1 65 GLU HA 1 69 LEU H 5.020 . 5.020 4.295 4.217 4.342 . 0 0 "[ . 1 . 2]" 1
1257 1 65 GLU HB2 1 66 LEU H 4.950 . 4.950 3.214 3.082 4.003 . 0 0 "[ . 1 . 2]" 1
1258 1 65 GLU H 1 66 LEU H 4.850 . 4.850 2.475 2.288 2.563 . 0 0 "[ . 1 . 2]" 1
1259 1 65 GLU HA 1 69 LEU HG 4.790 . 4.790 4.792 4.718 4.868 0.078 12 0 "[ . 1 . 2]" 1
1260 1 65 GLU HB3 1 66 LEU H 4.500 . 4.500 4.010 2.901 4.113 . 0 0 "[ . 1 . 2]" 1
1261 1 65 GLU HA 1 68 ARG HG3 4.310 . 4.310 3.637 2.825 4.260 . 0 0 "[ . 1 . 2]" 1
1262 1 65 GLU HA 1 68 ARG HB3 4.300 . 4.300 4.424 4.224 4.586 0.286 17 0 "[ . 1 . 2]" 1
1263 1 65 GLU O 1 69 LEU N . 2.700 3.300 3.391 3.347 3.430 0.130 11 0 "[ . 1 . 2]" 1
1264 1 65 GLU O 1 69 LEU H . . 2.300 2.394 2.360 2.430 0.130 11 0 "[ . 1 . 2]" 1
1265 1 66 LEU H 1 67 VAL MG1 6.430 . 6.430 4.253 4.140 4.333 . 0 0 "[ . 1 . 2]" 1
1266 1 66 LEU HG 1 67 VAL MG1 6.530 2.250 6.530 4.724 4.411 6.735 0.205 12 0 "[ . 1 . 2]" 1
1267 1 66 LEU H 1 66 LEU MD1 5.620 . 5.620 4.504 4.218 4.544 . 0 0 "[ . 1 . 2]" 1
1268 1 66 LEU H 1 66 LEU HG 5.500 . 5.500 3.791 3.577 4.501 . 0 0 "[ . 1 . 2]" 1
1269 1 66 LEU HB3 1 67 VAL HB 5.470 . 5.470 5.060 4.003 5.314 . 0 0 "[ . 1 . 2]" 1
1270 1 66 LEU H 1 66 LEU MD2 5.400 . 5.400 3.240 3.060 3.895 . 0 0 "[ . 1 . 2]" 1
1271 1 66 LEU H 1 68 ARG HB2 5.280 . 5.280 5.107 5.003 5.317 0.037 7 0 "[ . 1 . 2]" 1
1272 1 66 LEU H 1 67 VAL H 5.250 . 5.250 2.423 2.360 2.584 . 0 0 "[ . 1 . 2]" 1
1273 1 66 LEU HA 1 69 LEU HG 5.220 . 5.220 4.253 4.128 4.370 . 0 0 "[ . 1 . 2]" 1
1274 1 66 LEU MD2 1 67 VAL H 5.220 . 5.220 2.707 2.494 4.146 . 0 0 "[ . 1 . 2]" 1
1275 1 66 LEU HA 1 67 VAL H 5.190 . 5.190 3.615 3.603 3.634 . 0 0 "[ . 1 . 2]" 1
1276 1 66 LEU HA 1 70 PHE H 5.060 . 5.060 4.069 3.975 4.392 . 0 0 "[ . 1 . 2]" 1
1277 1 66 LEU HB3 1 67 VAL H 4.850 . 4.850 3.328 2.490 3.553 . 0 0 "[ . 1 . 2]" 1
1278 1 66 LEU HA 1 69 LEU H 4.410 . 4.410 3.526 3.445 3.701 . 0 0 "[ . 1 . 2]" 1
1279 1 66 LEU O 1 70 PHE N . 2.700 3.300 3.028 2.983 3.111 . 0 0 "[ . 1 . 2]" 1
1280 1 66 LEU O 1 70 PHE H . . 2.300 2.115 2.073 2.200 . 0 0 "[ . 1 . 2]" 1
1281 1 67 VAL HB 1 70 PHE QD 7.150 . 7.150 6.028 5.900 6.152 . 0 0 "[ . 1 . 2]" 1
1282 1 67 VAL MG2 1 139 PHE HA 7.060 . 7.060 6.705 6.523 6.871 . 0 0 "[ . 1 . 2]" 1
1283 1 67 VAL MG2 1 141 SER H 6.710 . 6.710 5.510 5.376 5.660 . 0 0 "[ . 1 . 2]" 1
1284 1 67 VAL HA 1 68 ARG H 6.520 . 6.520 3.594 3.577 3.621 . 0 0 "[ . 1 . 2]" 1
1285 1 67 VAL MG2 1 68 ARG HA 6.340 . 6.340 4.254 4.056 4.340 . 0 0 "[ . 1 . 2]" 1
1286 1 67 VAL MG1 1 69 LEU H 6.270 . 6.270 4.527 4.442 4.679 . 0 0 "[ . 1 . 2]" 1
1287 1 67 VAL MG1 1 139 PHE QD 6.220 . 6.220 5.652 5.298 5.898 . 0 0 "[ . 1 . 2]" 1
1288 1 67 VAL MG2 1 70 PHE QD 6.170 . 6.170 3.550 3.370 3.677 . 0 0 "[ . 1 . 2]" 1
1289 1 67 VAL H 1 141 SER HB2 6.010 . 6.010 6.099 6.056 6.133 0.123 19 0 "[ . 1 . 2]" 1
1290 1 67 VAL H 1 69 LEU H 5.980 . 5.980 4.649 4.580 4.718 . 0 0 "[ . 1 . 2]" 1
1291 1 67 VAL MG2 1 141 SER HB3 5.870 . 5.870 3.994 3.877 4.086 . 0 0 "[ . 1 . 2]" 1
1292 1 67 VAL MG2 1 139 PHE HB2 5.630 . 5.630 4.845 4.661 5.106 . 0 0 "[ . 1 . 2]" 1
1293 1 67 VAL HA 1 71 GLY H 5.520 . 5.520 4.117 4.056 4.180 . 0 0 "[ . 1 . 2]" 1
1294 1 67 VAL MG1 1 139 PHE HB3 5.480 . 5.480 4.798 4.519 4.994 . 0 0 "[ . 1 . 2]" 1
1295 1 67 VAL HA 1 70 PHE QD 5.430 . 5.430 4.009 3.921 4.141 . 0 0 "[ . 1 . 2]" 1
1296 1 67 VAL H 1 141 SER HB3 5.420 . 5.420 5.429 5.372 5.479 0.059 20 0 "[ . 1 . 2]" 1
1297 1 67 VAL HA 1 70 PHE HB3 5.420 . 5.420 2.621 2.528 2.691 . 0 0 "[ . 1 . 2]" 1
1298 1 67 VAL HA 1 69 LEU H 5.400 . 5.400 4.801 4.616 4.870 . 0 0 "[ . 1 . 2]" 1
1299 1 67 VAL MG2 1 142 PHE HB2 5.290 . 5.290 2.860 2.759 3.210 . 0 0 "[ . 1 . 2]" 1
1300 1 67 VAL HA 1 70 PHE HB2 5.190 . 5.190 3.456 3.289 3.552 . 0 0 "[ . 1 . 2]" 1
1301 1 67 VAL MG2 1 142 PHE H 5.090 . 5.090 4.094 3.974 4.238 . 0 0 "[ . 1 . 2]" 1
1302 1 67 VAL MG1 1 142 PHE HB3 5.070 . 5.070 5.196 5.133 5.277 0.207 13 0 "[ . 1 . 2]" 1
1303 1 67 VAL MG2 1 142 PHE QD 5.030 . 5.030 2.255 2.148 2.473 . 0 0 "[ . 1 . 2]" 1
1304 1 67 VAL MG2 1 139 PHE QD 4.860 . 4.860 5.030 4.979 5.107 0.247 18 0 "[ . 1 . 2]" 1
1305 1 67 VAL MG1 1 141 SER HB2 4.830 . 4.830 2.542 2.290 2.670 . 0 0 "[ . 1 . 2]" 1
1306 1 67 VAL HA 1 70 PHE H 4.780 . 4.780 3.476 3.276 3.545 . 0 0 "[ . 1 . 2]" 1
1307 1 67 VAL MG1 1 142 PHE HA 4.770 . 4.770 3.067 2.891 3.278 . 0 0 "[ . 1 . 2]" 1
1308 1 67 VAL MG2 1 142 PHE HB3 4.740 . 4.740 4.259 4.157 4.383 . 0 0 "[ . 1 . 2]" 1
1309 1 67 VAL MG2 1 139 PHE HB3 4.700 . 4.700 4.470 4.273 4.661 . 0 0 "[ . 1 . 2]" 1
1310 1 67 VAL MG2 1 142 PHE HA 4.430 . 4.430 2.461 2.324 2.674 . 0 0 "[ . 1 . 2]" 1
1311 1 67 VAL O 1 71 GLY N . 2.700 3.300 3.310 3.231 3.351 0.051 18 0 "[ . 1 . 2]" 1
1312 1 67 VAL O 1 71 GLY H . . 2.300 2.344 2.253 2.386 0.086 18 0 "[ . 1 . 2]" 1
1313 1 68 ARG H 1 142 PHE HA 6.300 . 6.300 6.347 6.263 6.429 0.129 2 0 "[ . 1 . 2]" 1
1314 1 68 ARG H 1 70 PHE H 6.300 . 6.300 3.954 3.853 4.056 . 0 0 "[ . 1 . 2]" 1
1315 1 68 ARG HA 1 72 LYS H 6.170 . 6.170 4.680 4.636 4.724 . 0 0 "[ . 1 . 2]" 1
1316 1 68 ARG HA 1 145 GLY HA2 5.820 . 5.820 3.719 3.503 3.941 . 0 0 "[ . 1 . 2]" 1
1317 1 68 ARG HG2 1 145 GLY HA2 5.740 . 5.740 4.204 3.630 4.469 . 0 0 "[ . 1 . 2]" 1
1318 1 68 ARG HE 1 148 ASP HB3 5.700 . 5.700 5.599 5.246 5.773 0.073 10 0 "[ . 1 . 2]" 1
1319 1 68 ARG HA 1 71 GLY H 5.670 . 5.670 3.704 3.655 3.743 . 0 0 "[ . 1 . 2]" 1
1320 1 68 ARG HB3 1 69 LEU H 5.530 . 5.530 3.099 2.816 3.430 . 0 0 "[ . 1 . 2]" 1
1321 1 68 ARG HG2 1 145 GLY HA3 5.400 . 5.400 4.473 4.174 4.644 . 0 0 "[ . 1 . 2]" 1
1322 1 68 ARG HE 1 69 LEU H 5.350 . 5.350 5.333 5.077 5.552 0.202 12 0 "[ . 1 . 2]" 1
1323 1 68 ARG HA 1 145 GLY HA3 5.320 . 5.320 3.368 3.286 3.463 . 0 0 "[ . 1 . 2]" 1
1324 1 68 ARG HG2 1 69 LEU H 5.290 . 5.290 4.957 4.871 5.073 . 0 0 "[ . 1 . 2]" 1
1325 1 68 ARG HG3 1 69 LEU H 5.140 . 5.140 4.815 4.410 5.006 . 0 0 "[ . 1 . 2]" 1
1326 1 68 ARG HB2 1 69 LEU HA 5.120 . 5.120 4.622 4.226 4.863 . 0 0 "[ . 1 . 2]" 1
1327 1 68 ARG H 1 71 GLY H 4.940 . 4.940 4.941 4.878 5.025 0.085 12 0 "[ . 1 . 2]" 1
1328 1 68 ARG HA 1 145 GLY H 4.880 . 4.880 4.707 4.655 4.789 . 0 0 "[ . 1 . 2]" 1
1329 1 68 ARG HB2 1 69 LEU H 4.870 . 4.870 2.680 2.449 2.863 . 0 0 "[ . 1 . 2]" 1
1330 1 68 ARG HA 1 69 LEU H 4.830 . 4.830 3.659 3.637 3.668 . 0 0 "[ . 1 . 2]" 1
1331 1 68 ARG HG2 1 145 GLY H 4.750 . 4.750 4.839 4.713 4.943 0.193 12 0 "[ . 1 . 2]" 1
1332 1 68 ARG O 1 72 LYS N . 2.700 3.300 3.362 3.349 3.380 0.080 11 0 "[ . 1 . 2]" 1
1333 1 68 ARG O 1 72 LYS H . . 2.300 2.446 2.424 2.468 0.168 6 0 "[ . 1 . 2]" 1
1334 1 69 LEU MD2 1 70 PHE H 6.110 . 6.110 4.829 4.800 4.859 . 0 0 "[ . 1 . 2]" 1
1335 1 69 LEU HA 1 72 LYS HA 5.780 . 5.780 5.593 5.517 5.713 . 0 0 "[ . 1 . 2]" 1
1336 1 69 LEU MD1 1 70 PHE H 5.760 . 5.760 4.782 4.731 4.830 . 0 0 "[ . 1 . 2]" 1
1337 1 69 LEU H 1 69 LEU MD1 . . 5.400 3.635 3.602 3.678 . 0 0 "[ . 1 . 2]" 1
1338 1 69 LEU H 1 69 LEU MD2 5.400 . 5.400 3.537 3.495 3.578 . 0 0 "[ . 1 . 2]" 1
1339 1 69 LEU H 1 69 LEU HG 5.290 . 5.290 2.354 2.332 2.374 . 0 0 "[ . 1 . 2]" 1
1340 1 69 LEU HA 1 70 PHE HA 5.250 . 5.250 4.787 4.780 4.793 . 0 0 "[ . 1 . 2]" 1
1341 1 69 LEU H 1 71 GLY H 5.160 . 5.160 4.544 4.515 4.572 . 0 0 "[ . 1 . 2]" 1
1342 1 69 LEU HG 1 70 PHE H 5.130 . 5.130 4.593 4.575 4.610 . 0 0 "[ . 1 . 2]" 1
1343 1 69 LEU HA 1 70 PHE H 4.870 . 4.870 3.580 3.569 3.589 . 0 0 "[ . 1 . 2]" 1
1344 1 69 LEU HB3 1 70 PHE H 4.730 . 4.730 3.789 3.764 3.827 . 0 0 "[ . 1 . 2]" 1
1345 1 69 LEU HB2 1 70 PHE H 4.720 . 4.720 2.901 2.872 2.941 . 0 0 "[ . 1 . 2]" 1
1346 1 69 LEU O 1 73 LYS N . 2.700 3.300 3.322 3.279 3.349 0.049 6 0 "[ . 1 . 2]" 1
1347 1 69 LEU O 1 73 LYS H . . 2.300 2.333 2.289 2.364 0.064 6 0 "[ . 1 . 2]" 1
1348 1 70 PHE QD 1 74 LEU MD2 7.830 . 7.830 5.971 5.813 6.033 . 0 0 "[ . 1 . 2]" 1
1349 1 70 PHE QE 1 74 LEU MD2 6.880 . 6.880 4.994 4.842 5.033 . 0 0 "[ . 1 . 2]" 1
1350 1 70 PHE HA 1 71 GLY H 6.130 . 6.130 3.648 3.640 3.654 . 0 0 "[ . 1 . 2]" 1
1351 1 70 PHE H 1 72 LYS H 5.970 . 5.970 4.221 4.186 4.267 . 0 0 "[ . 1 . 2]" 1
1352 1 70 PHE QD 1 71 GLY H 5.660 . 5.660 3.355 3.310 3.384 . 0 0 "[ . 1 . 2]" 1
1353 1 70 PHE HA 1 73 LYS H 5.480 . 5.480 3.811 3.771 3.860 . 0 0 "[ . 1 . 2]" 1
1354 1 70 PHE H 1 71 GLY H 5.460 . 5.460 2.783 2.768 2.801 . 0 0 "[ . 1 . 2]" 1
1355 1 70 PHE HB2 1 71 GLY H 5.090 . 5.090 3.985 3.972 4.001 . 0 0 "[ . 1 . 2]" 1
1356 1 70 PHE HB3 1 71 GLY H 5.050 . 5.050 2.576 2.556 2.588 . 0 0 "[ . 1 . 2]" 1
1357 1 70 PHE O 1 74 LEU N . 2.700 3.300 3.291 3.241 3.321 0.021 18 0 "[ . 1 . 2]" 1
1358 1 70 PHE O 1 74 LEU H . . 2.300 2.301 2.254 2.330 0.030 18 0 "[ . 1 . 2]" 1
1359 1 71 GLY HA3 1 146 LEU MD2 6.640 . 6.640 3.518 3.339 3.663 . 0 0 "[ . 1 . 2]" 1
1360 1 71 GLY HA3 1 146 LEU MD1 6.320 . 6.320 5.443 5.309 5.615 . 0 0 "[ . 1 . 2]" 1
1361 1 71 GLY HA3 1 142 PHE QE 6.230 . 6.230 5.436 4.393 5.640 . 0 0 "[ . 1 . 2]" 1
1362 1 71 GLY HA2 1 74 LEU H 6.220 . 6.220 3.824 3.759 3.849 . 0 0 "[ . 1 . 2]" 1
1363 1 71 GLY H 1 142 PHE QD 6.150 . 6.150 5.537 5.048 5.727 . 0 0 "[ . 1 . 2]" 1
1364 1 71 GLY HA2 1 146 LEU MD2 6.140 . 6.140 3.002 2.844 3.215 . 0 0 "[ . 1 . 2]" 1
1365 1 71 GLY H 1 145 GLY HA3 6.110 . 6.110 4.216 4.141 4.278 . 0 0 "[ . 1 . 2]" 1
1366 1 71 GLY HA2 1 146 LEU MD1 6.070 . 6.070 5.223 5.086 5.406 . 0 0 "[ . 1 . 2]" 1
1367 1 71 GLY HA2 1 142 PHE QD 5.950 . 5.950 5.643 5.052 5.818 . 0 0 "[ . 1 . 2]" 1
1368 1 71 GLY HA2 1 142 PHE QE 5.920 . 5.920 4.849 3.904 5.032 . 0 0 "[ . 1 . 2]" 1
1369 1 71 GLY H 1 73 LYS H 5.900 . 5.900 4.668 4.609 4.720 . 0 0 "[ . 1 . 2]" 1
1370 1 71 GLY H 1 146 LEU H 5.890 . 5.890 6.165 6.120 6.230 0.340 18 0 "[ . 1 . 2]" 1
1371 1 71 GLY HA3 1 146 LEU H 5.820 . 5.820 4.322 4.293 4.372 . 0 0 "[ . 1 . 2]" 1
1372 1 71 GLY HA3 1 142 PHE QD 5.700 . 5.700 5.504 4.620 5.720 0.020 19 0 "[ . 1 . 2]" 1
1373 1 71 GLY H 1 72 LYS H 5.640 . 5.640 2.836 2.822 2.855 . 0 0 "[ . 1 . 2]" 1
1374 1 71 GLY H 1 145 GLY HA2 5.640 . 5.640 5.309 5.132 5.425 . 0 0 "[ . 1 . 2]" 1
1375 1 71 GLY HA2 1 146 LEU H 5.260 . 5.260 5.379 5.333 5.447 0.187 11 0 "[ . 1 . 2]" 1
1376 1 71 GLY HA3 1 72 LYS H 5.170 . 5.170 2.942 2.929 2.959 . 0 0 "[ . 1 . 2]" 1
1377 1 71 GLY HA2 1 72 LYS H 5.110 . 5.110 3.626 3.613 3.637 . 0 0 "[ . 1 . 2]" 1
1378 1 71 GLY O 1 75 PHE N . 2.700 3.300 3.208 3.147 3.265 . 0 0 "[ . 1 . 2]" 1
1379 1 71 GLY O 1 75 PHE H . . 2.300 2.238 2.174 2.290 . 0 0 "[ . 1 . 2]" 1
1380 1 72 LYS HG3 1 149 GLY H 6.250 . 6.250 5.569 5.342 5.793 . 0 0 "[ . 1 . 2]" 1
1381 1 72 LYS HB2 1 149 GLY H 5.980 . 5.980 5.655 5.534 5.795 . 0 0 "[ . 1 . 2]" 1
1382 1 72 LYS HB3 1 73 LYS H 5.920 . 5.920 2.476 2.423 2.573 . 0 0 "[ . 1 . 2]" 1
1383 1 72 LYS HG3 1 73 LYS H 5.770 . 5.770 4.764 4.709 4.855 . 0 0 "[ . 1 . 2]" 1
1384 1 72 LYS HG2 1 149 GLY H 6.250 . 6.850 7.043 6.982 7.121 0.271 2 0 "[ . 1 . 2]" 1
1385 1 72 LYS HA 1 76 VAL H 5.720 . 5.720 4.270 4.117 4.375 . 0 0 "[ . 1 . 2]" 1
1386 1 72 LYS H 1 73 LYS H 5.440 . 5.440 2.815 2.748 2.861 . 0 0 "[ . 1 . 2]" 1
1387 1 72 LYS H 1 145 GLY HA2 5.200 . 5.200 5.169 5.075 5.259 0.059 19 0 "[ . 1 . 2]" 1
1388 1 72 LYS HA 1 73 LYS H 5.040 . 5.040 3.651 3.641 3.659 . 0 0 "[ . 1 . 2]" 1
1389 1 72 LYS HA 1 75 PHE H 4.800 . 4.800 4.073 3.981 4.145 . 0 0 "[ . 1 . 2]" 1
1390 1 72 LYS HA 1 149 GLY H 4.380 . 4.380 4.571 4.509 4.633 0.253 10 0 "[ . 1 . 2]" 1
1391 1 72 LYS O 1 76 VAL N . 2.700 3.300 3.335 3.291 3.366 0.066 2 0 "[ . 1 . 2]" 1
1392 1 72 LYS O 1 76 VAL H . . 2.300 2.351 2.308 2.387 0.087 2 0 "[ . 1 . 2]" 1
1393 1 73 LYS H 1 74 LEU HA 6.230 . 6.230 5.418 5.400 5.438 . 0 0 "[ . 1 . 2]" 1
1394 1 73 LYS HA 1 73 LYS HD3 5.770 . 5.770 4.022 3.999 4.047 . 0 0 "[ . 1 . 2]" 1
1395 1 73 LYS H 1 73 LYS HG3 5.770 . 5.770 3.306 3.147 3.423 . 0 0 "[ . 1 . 2]" 1
1396 1 73 LYS H 1 73 LYS HG2 5.750 . 5.750 3.891 3.786 3.973 . 0 0 "[ . 1 . 2]" 1
1397 1 73 LYS HG3 1 74 LEU H 5.720 . 5.720 5.144 5.096 5.211 . 0 0 "[ . 1 . 2]" 1
1398 1 73 LYS HG2 1 74 LEU H 5.600 . 5.600 5.064 5.035 5.106 . 0 0 "[ . 1 . 2]" 1
1399 1 73 LYS HA 1 75 PHE H 5.560 . 5.560 4.716 4.678 4.768 . 0 0 "[ . 1 . 2]" 1
1400 1 73 LYS HA 1 73 LYS HD2 5.510 . 5.510 4.579 4.563 4.597 . 0 0 "[ . 1 . 2]" 1
1401 1 73 LYS H 1 75 PHE H 5.250 . 5.250 4.509 4.459 4.541 . 0 0 "[ . 1 . 2]" 1
1402 1 73 LYS H 1 74 LEU H 5.220 . 5.220 2.978 2.950 3.006 . 0 0 "[ . 1 . 2]" 1
1403 1 73 LYS HA 1 74 LEU H 5.150 . 5.150 3.669 3.662 3.674 . 0 0 "[ . 1 . 2]" 1
1404 1 73 LYS HB3 1 74 LEU H 4.710 . 4.710 3.124 3.046 3.246 . 0 0 "[ . 1 . 2]" 1
1405 1 73 LYS HB2 1 74 LEU H 4.590 . 4.590 3.086 3.028 3.175 . 0 0 "[ . 1 . 2]" 1
1406 1 73 LYS O 1 77 GLU N . 2.700 3.300 3.139 3.102 3.175 . 0 0 "[ . 1 . 2]" 1
1407 1 73 LYS O 1 77 GLU H . . 2.300 2.571 2.538 2.604 0.304 18 0 "[ . 1 . 2]" 1
1408 1 74 LEU HG 1 78 LEU MD2 6.850 . 6.850 5.403 5.132 5.525 . 0 0 "[ . 1 . 2]" 1
1409 1 74 LEU HG 1 142 PHE QE 6.750 . 6.750 6.853 6.811 6.893 0.143 14 0 "[ . 1 . 2]" 1
1410 1 74 LEU MD2 1 78 LEU HA 6.670 . 6.670 4.616 4.441 4.735 . 0 0 "[ . 1 . 2]" 1
1411 1 74 LEU MD2 1 77 GLU H 6.410 . 6.410 3.731 3.590 3.849 . 0 0 "[ . 1 . 2]" 1
1412 1 74 LEU MD2 1 78 LEU MD1 6.350 . 6.350 3.571 3.400 3.728 . 0 0 "[ . 1 . 2]" 1
1413 1 74 LEU HA 1 75 PHE HA 6.210 . 6.210 4.716 4.695 4.727 . 0 0 "[ . 1 . 2]" 1
1414 1 74 LEU MD1 1 77 GLU H 6.180 . 6.180 4.386 4.290 4.467 . 0 0 "[ . 1 . 2]" 1
1415 1 74 LEU MD2 1 77 GLU HG2 6.150 . 6.150 3.751 2.895 4.574 . 0 0 "[ . 1 . 2]" 1
1416 1 74 LEU HA 1 77 GLU HA 6.020 . 6.020 5.004 4.903 5.146 . 0 0 "[ . 1 . 2]" 1
1417 1 74 LEU H 1 76 VAL H 5.950 . 5.950 4.458 4.422 4.519 . 0 0 "[ . 1 . 2]" 1
1418 1 74 LEU HG 1 78 LEU MD1 5.850 . 5.850 4.764 4.532 4.892 . 0 0 "[ . 1 . 2]" 1
1419 1 74 LEU MD2 1 78 LEU H 5.710 . 5.710 3.535 3.448 3.641 . 0 0 "[ . 1 . 2]" 1
1420 1 74 LEU HA 1 78 LEU H 5.640 . 5.640 4.541 4.438 4.581 . 0 0 "[ . 1 . 2]" 1
1421 1 74 LEU HA 1 77 GLU HG2 5.590 . 5.590 3.139 2.623 4.565 . 0 0 "[ . 1 . 2]" 1
1422 1 74 LEU HA 1 77 GLU HG3 5.230 . 5.230 3.128 2.728 4.912 . 0 0 "[ . 1 . 2]" 1
1423 1 74 LEU HG 1 75 PHE H 5.510 . 5.510 5.177 5.112 5.226 . 0 0 "[ . 1 . 2]" 1
1424 1 74 LEU HA 1 78 LEU HG 5.450 . 5.450 4.918 4.752 5.006 . 0 0 "[ . 1 . 2]" 1
1425 1 74 LEU HA 1 76 VAL H 5.450 . 5.450 4.592 4.527 4.658 . 0 0 "[ . 1 . 2]" 1
1426 1 74 LEU MD1 1 78 LEU H 5.430 . 5.430 3.858 3.736 3.977 . 0 0 "[ . 1 . 2]" 1
1427 1 74 LEU MD2 1 77 GLU HB2 5.350 . 5.350 2.231 1.886 3.109 . 0 0 "[ . 1 . 2]" 1
1428 1 74 LEU MD1 1 78 LEU MD2 5.350 . 5.350 3.428 3.022 3.541 . 0 0 "[ . 1 . 2]" 1
1429 1 74 LEU H 1 75 PHE H 5.280 . 5.280 2.713 2.693 2.742 . 0 0 "[ . 1 . 2]" 1
1430 1 74 LEU HA 1 77 GLU HB2 5.260 . 5.260 2.448 2.201 2.671 . 0 0 "[ . 1 . 2]" 1
1431 1 74 LEU HA 1 77 GLU HB3 5.260 . 5.260 3.832 2.593 4.140 . 0 0 "[ . 1 . 2]" 1
1432 1 74 LEU HB3 1 75 PHE H 4.780 . 4.780 2.851 2.822 2.907 . 0 0 "[ . 1 . 2]" 1
1433 1 74 LEU MD2 1 78 LEU HG 4.760 . 4.760 2.819 2.671 3.009 . 0 0 "[ . 1 . 2]" 1
1434 1 74 LEU MD2 1 77 GLU HB3 4.730 . 4.730 3.046 2.122 3.456 . 0 0 "[ . 1 . 2]" 1
1435 1 74 LEU HB2 1 75 PHE H 4.720 . 4.720 4.105 4.059 4.146 . 0 0 "[ . 1 . 2]" 1
1436 1 74 LEU HA 1 77 GLU H 4.690 . 4.690 3.359 3.325 3.413 . 0 0 "[ . 1 . 2]" 1
1437 1 74 LEU HA 1 75 PHE H 4.650 . 4.650 3.638 3.632 3.649 . 0 0 "[ . 1 . 2]" 1
1438 1 74 LEU O 1 78 LEU N . 2.700 3.300 3.207 3.116 3.249 . 0 0 "[ . 1 . 2]" 1
1439 1 74 LEU O 1 78 LEU H . . 2.300 2.367 2.297 2.393 0.093 9 0 "[ . 1 . 2]" 1
1440 1 75 PHE H 1 76 VAL MG2 6.050 . 6.050 6.151 6.134 6.171 0.121 1 0 "[ . 1 . 2]" 1
1441 1 75 PHE HA 1 79 ILE MD 6.050 . 6.050 5.086 4.978 5.241 . 0 0 "[ . 1 . 2]" 1
1442 1 75 PHE HA 1 146 LEU MD2 6.010 . 6.010 3.882 3.792 4.000 . 0 0 "[ . 1 . 2]" 1
1443 1 75 PHE HA 1 78 LEU HB3 6.010 . 6.010 5.135 4.918 5.241 . 0 0 "[ . 1 . 2]" 1
1444 1 75 PHE HB2 1 146 LEU MD2 5.150 . 5.150 2.514 2.360 2.741 . 0 0 "[ . 1 . 2]" 1
1445 1 75 PHE HA 1 77 GLU H 5.830 . 5.830 3.721 3.676 3.750 . 0 0 "[ . 1 . 2]" 1
1446 1 75 PHE QD 1 79 ILE MD 5.780 . 5.780 3.612 3.397 3.797 . 0 0 "[ . 1 . 2]" 1
1447 1 75 PHE H 1 78 LEU HG 5.660 . 5.660 5.689 5.474 5.759 0.099 7 0 "[ . 1 . 2]" 1
1448 1 75 PHE HA 1 79 ILE H 5.640 . 5.640 4.685 4.618 4.716 . 0 0 "[ . 1 . 2]" 1
1449 1 75 PHE HA 1 76 VAL HA 5.630 . 5.630 4.672 4.658 4.683 . 0 0 "[ . 1 . 2]" 1
1450 1 75 PHE H 1 77 GLU H 5.570 . 5.570 3.825 3.771 3.874 . 0 0 "[ . 1 . 2]" 1
1451 1 75 PHE HA 1 76 VAL H 5.570 . 5.570 3.663 3.658 3.672 . 0 0 "[ . 1 . 2]" 1
1452 1 75 PHE HB3 1 77 GLU H 5.560 . 5.560 4.642 4.588 4.684 . 0 0 "[ . 1 . 2]" 1
1453 1 75 PHE HA 1 78 LEU MD1 5.480 . 5.480 3.084 2.831 3.240 . 0 0 "[ . 1 . 2]" 1
1454 1 75 PHE H 1 76 VAL H 5.470 . 5.470 2.878 2.856 2.902 . 0 0 "[ . 1 . 2]" 1
1455 1 75 PHE H 1 146 LEU HA 5.400 . 5.400 5.243 5.168 5.317 . 0 0 "[ . 1 . 2]" 1
1456 1 75 PHE HB2 1 76 VAL H 4.930 . 4.930 3.940 3.907 3.966 . 0 0 "[ . 1 . 2]" 1
1457 1 75 PHE HB3 1 76 VAL H 4.550 . 4.550 2.671 2.621 2.741 . 0 0 "[ . 1 . 2]" 1
1458 1 75 PHE O 1 79 ILE N . 2.700 3.300 3.288 3.242 3.337 0.037 4 0 "[ . 1 . 2]" 1
1459 1 75 PHE O 1 79 ILE H . . 2.300 2.410 2.393 2.438 0.138 4 0 "[ . 1 . 2]" 1
1460 1 76 VAL MG1 1 80 GLU HG3 6.720 . 6.720 4.888 3.815 5.307 . 0 0 "[ . 1 . 2]" 1
1461 1 76 VAL MG1 1 77 GLU HB3 6.290 . 6.290 4.791 4.434 4.877 . 0 0 "[ . 1 . 2]" 1
1462 1 76 VAL MG2 1 80 GLU HG3 6.250 . 6.250 4.254 2.305 4.923 . 0 0 "[ . 1 . 2]" 1
1463 1 76 VAL HB 1 153 TYR QD 6.180 . 6.180 4.643 4.445 4.928 . 0 0 "[ . 1 . 2]" 1
1464 1 76 VAL HA 1 80 GLU HG3 6.130 . 6.130 5.801 4.260 6.316 0.186 8 0 "[ . 1 . 2]" 1
1465 1 76 VAL HA 1 78 LEU H 5.920 . 5.920 4.092 3.996 4.178 . 0 0 "[ . 1 . 2]" 1
1466 1 76 VAL HA 1 80 GLU HG2 5.900 . 5.900 5.064 4.757 6.022 0.122 18 0 "[ . 1 . 2]" 1
1467 1 76 VAL H 1 149 GLY HA3 5.720 . 5.720 5.095 5.017 5.241 . 0 0 "[ . 1 . 2]" 1
1468 1 76 VAL HA 1 77 GLU HA 5.710 . 5.710 4.683 4.601 4.712 . 0 0 "[ . 1 . 2]" 1
1469 1 76 VAL HA 1 79 ILE HA 5.710 . 5.710 5.050 4.947 5.152 . 0 0 "[ . 1 . 2]" 1
1470 1 76 VAL MG2 1 150 CYS HA 5.690 . 5.690 5.610 5.431 5.717 0.027 1 0 "[ . 1 . 2]" 1
1471 1 76 VAL MG2 1 79 ILE H 5.640 . 5.640 4.032 3.908 4.211 . 0 0 "[ . 1 . 2]" 1
1472 1 76 VAL MG2 1 77 GLU HA 5.620 . 5.620 4.079 3.991 4.157 . 0 0 "[ . 1 . 2]" 1
1473 1 76 VAL H 1 78 LEU H 5.610 . 5.610 4.335 4.228 4.401 . 0 0 "[ . 1 . 2]" 1
1474 1 76 VAL HA 1 79 ILE HG13 5.530 . 5.530 2.907 2.837 2.969 . 0 0 "[ . 1 . 2]" 1
1475 1 76 VAL HA 1 80 GLU H 5.510 . 5.510 4.074 3.960 4.144 . 0 0 "[ . 1 . 2]" 1
1476 1 76 VAL HA 1 79 ILE MD 5.430 . 5.430 4.133 4.014 4.222 . 0 0 "[ . 1 . 2]" 1
1477 1 76 VAL HA 1 153 TYR QD 5.350 . 5.350 4.704 4.555 4.924 . 0 0 "[ . 1 . 2]" 1
1478 1 76 VAL MG1 1 80 GLU HG2 5.350 . 5.350 4.237 3.803 5.402 0.052 18 0 "[ . 1 . 2]" 1
1479 1 76 VAL HA 1 79 ILE MG 5.290 . 5.290 4.187 4.151 4.242 . 0 0 "[ . 1 . 2]" 1
1480 1 76 VAL HA 1 79 ILE HG12 5.260 . 5.260 2.527 2.362 2.656 . 0 0 "[ . 1 . 2]" 1
1481 1 76 VAL MG2 1 80 GLU H 5.240 . 5.240 3.413 3.230 3.578 . 0 0 "[ . 1 . 2]" 1
1482 1 76 VAL H 1 77 GLU H 5.100 . 5.100 2.536 2.505 2.565 . 0 0 "[ . 1 . 2]" 1
1483 1 76 VAL MG2 1 77 GLU H 5.070 . 5.070 4.163 4.128 4.205 . 0 0 "[ . 1 . 2]" 1
1484 1 76 VAL HA 1 79 ILE HB 4.990 . 4.990 2.785 2.740 2.871 . 0 0 "[ . 1 . 2]" 1
1485 1 76 VAL MG2 1 79 ILE HB 4.980 . 4.980 2.758 2.564 2.927 . 0 0 "[ . 1 . 2]" 1
1486 1 76 VAL MG1 1 77 GLU H 4.940 . 4.940 2.677 2.479 2.777 . 0 0 "[ . 1 . 2]" 1
1487 1 76 VAL HA 1 77 GLU H 4.920 . 4.920 3.390 3.374 3.405 . 0 0 "[ . 1 . 2]" 1
1488 1 76 VAL H 1 150 CYS HA 5.920 . 5.920 6.201 6.126 6.246 0.326 7 0 "[ . 1 . 2]" 1
1489 1 76 VAL MG2 1 153 TYR QD 4.830 . 4.830 2.363 2.166 2.585 . 0 0 "[ . 1 . 2]" 1
1490 1 76 VAL HB 1 79 ILE HG13 4.800 . 4.800 4.823 4.719 4.939 0.139 7 0 "[ . 1 . 2]" 1
1491 1 76 VAL HA 1 79 ILE H 4.750 . 4.750 2.977 2.900 3.098 . 0 0 "[ . 1 . 2]" 1
1492 1 76 VAL HB 1 153 TYR H 4.510 . 4.510 4.750 4.696 4.786 0.276 1 0 "[ . 1 . 2]" 1
1493 1 76 VAL MG2 1 80 GLU HG2 4.620 . 4.620 3.329 3.118 3.783 . 0 0 "[ . 1 . 2]" 1
1494 1 76 VAL HB 1 77 GLU H 4.230 . 4.230 4.245 4.214 4.282 0.052 18 0 "[ . 1 . 2]" 1
1495 1 76 VAL O 1 80 GLU N . 2.700 3.300 3.328 3.197 3.365 0.065 14 0 "[ . 1 . 2]" 1
1496 1 76 VAL O 1 80 GLU H . . 2.300 2.340 2.202 2.384 0.084 14 0 "[ . 1 . 2]" 1
1497 1 77 GLU HB3 1 78 LEU MD2 6.160 . 6.160 4.440 4.082 4.787 . 0 0 "[ . 1 . 2]" 1
1498 1 77 GLU H 1 78 LEU HG 6.110 . 6.110 4.443 4.337 4.494 . 0 0 "[ . 1 . 2]" 1
1499 1 77 GLU H 1 78 LEU HB2 6.100 . 6.100 4.612 4.510 4.673 . 0 0 "[ . 1 . 2]" 1
1500 1 77 GLU H 1 79 ILE HG13 5.730 . 5.730 5.983 5.932 6.012 0.282 1 0 "[ . 1 . 2]" 1
1501 1 77 GLU H 1 79 ILE HG12 5.560 . 5.560 4.753 4.683 4.812 . 0 0 "[ . 1 . 2]" 1
1502 1 77 GLU HB2 1 78 LEU H 5.500 . 5.500 2.977 2.775 3.976 . 0 0 "[ . 1 . 2]" 1
1503 1 77 GLU HA 1 81 GLY H 5.400 . 5.400 4.311 3.954 4.516 . 0 0 "[ . 1 . 2]" 1
1504 1 77 GLU HA 1 80 GLU HG3 5.190 . 5.190 3.444 3.251 3.944 . 0 0 "[ . 1 . 2]" 1
1505 1 77 GLU HA 1 80 GLU HG2 5.150 . 5.150 3.476 2.715 5.416 0.266 7 0 "[ . 1 . 2]" 1
1506 1 77 GLU H 1 77 GLU HG2 5.080 . 5.080 3.126 2.721 4.763 . 0 0 "[ . 1 . 2]" 1
1507 1 77 GLU H 1 78 LEU H 5.030 . 5.030 2.424 2.305 2.466 . 0 0 "[ . 1 . 2]" 1
1508 1 77 GLU H 1 77 GLU HG3 4.890 . 4.890 4.078 3.265 4.548 . 0 0 "[ . 1 . 2]" 1
1509 1 77 GLU HA 1 80 GLU H 4.750 . 4.750 3.889 3.520 4.041 . 0 0 "[ . 1 . 2]" 1
1510 1 77 GLU HB3 1 78 LEU H 4.500 . 4.500 3.553 2.680 3.864 . 0 0 "[ . 1 . 2]" 1
1511 1 77 GLU HA 1 79 ILE H 4.450 . 4.450 4.271 4.171 4.341 . 0 0 "[ . 1 . 2]" 1
1512 1 77 GLU O 1 81 GLY N . 2.700 3.300 2.948 2.860 3.031 . 0 0 "[ . 1 . 2]" 1
1513 1 77 GLU O 1 81 GLY H . . 2.300 2.329 2.138 2.413 0.113 9 0 "[ . 1 . 2]" 1
1514 1 78 LEU HA 1 79 ILE MD 6.410 . 6.410 5.439 5.396 5.512 . 0 0 "[ . 1 . 2]" 1
1515 1 78 LEU HB2 1 79 ILE HB 6.130 . 6.130 5.324 5.218 5.445 . 0 0 "[ . 1 . 2]" 1
1516 1 78 LEU MD1 1 79 ILE H 6.070 . 6.070 4.786 4.630 4.914 . 0 0 "[ . 1 . 2]" 1
1517 1 78 LEU HB2 1 80 GLU H 5.650 . 5.650 5.637 5.445 5.733 0.083 13 0 "[ . 1 . 2]" 1
1518 1 78 LEU H 1 78 LEU MD2 5.460 . 5.460 3.714 3.692 3.764 . 0 0 "[ . 1 . 2]" 1
1519 1 78 LEU H 1 80 GLU H 5.450 . 5.450 4.672 4.441 4.771 . 0 0 "[ . 1 . 2]" 1
1520 1 78 LEU HG 1 79 ILE H 5.380 . 5.380 4.630 4.572 4.671 . 0 0 "[ . 1 . 2]" 1
1521 1 78 LEU HB3 1 85 ILE HB 5.370 . 5.370 5.599 5.516 5.665 0.295 13 0 "[ . 1 . 2]" 1
1522 1 78 LEU HB2 1 79 ILE H 5.250 . 5.250 2.948 2.810 3.075 . 0 0 "[ . 1 . 2]" 1
1523 1 78 LEU HB3 1 79 ILE MD 5.220 . 5.220 4.245 4.100 4.379 . 0 0 "[ . 1 . 2]" 1
1524 1 78 LEU H 1 78 LEU HG 5.200 . 5.200 2.503 2.481 2.561 . 0 0 "[ . 1 . 2]" 1
1525 1 78 LEU H 1 79 ILE H 5.160 . 5.160 2.596 2.529 2.632 . 0 0 "[ . 1 . 2]" 1
1526 1 78 LEU HB2 1 79 ILE MD 5.110 . 5.110 3.741 3.634 3.856 . 0 0 "[ . 1 . 2]" 1
1527 1 78 LEU HA 1 82 HIS HB2 4.970 . 4.970 4.905 4.523 5.089 0.119 19 0 "[ . 1 . 2]" 1
1528 1 78 LEU HA 1 82 HIS H 4.860 . 4.860 4.243 4.056 4.526 . 0 0 "[ . 1 . 2]" 1
1529 1 78 LEU HA 1 79 ILE H 4.850 . 4.850 3.608 3.598 3.618 . 0 0 "[ . 1 . 2]" 1
1530 1 78 LEU HB3 1 79 ILE H 4.340 . 4.340 3.853 3.735 3.972 . 0 0 "[ . 1 . 2]" 1
1531 1 78 LEU O 1 82 HIS N . 2.700 3.300 2.954 2.854 3.007 . 0 0 "[ . 1 . 2]" 1
1532 1 78 LEU O 1 82 HIS H . . 2.300 2.285 2.179 2.442 0.142 12 0 "[ . 1 . 2]" 1
1533 1 79 ILE MD 1 82 HIS H 6.660 . 6.660 5.156 5.073 5.256 . 0 0 "[ . 1 . 2]" 1
1534 1 79 ILE MG 1 81 GLY H 6.440 . 6.440 4.579 4.504 4.700 . 0 0 "[ . 1 . 2]" 1
1535 1 79 ILE MG 1 80 GLU HB3 6.310 . 6.310 4.283 3.917 5.292 . 0 0 "[ . 1 . 2]" 1
1536 1 79 ILE MD 1 154 PHE QE 6.170 . 6.170 3.976 3.405 4.584 . 0 0 "[ . 1 . 2]" 1
1537 1 79 ILE HA 1 80 GLU HG3 6.160 . 6.160 6.011 5.405 6.233 0.073 9 0 "[ . 1 . 2]" 1
1538 1 79 ILE HA 1 82 HIS HA 6.150 . 6.150 6.243 5.825 6.370 0.220 1 0 "[ . 1 . 2]" 1
1539 1 79 ILE MD 1 86 ALA H 6.120 . 6.120 5.044 4.812 5.175 . 0 0 "[ . 1 . 2]" 1
1540 1 79 ILE H 1 80 GLU HG3 5.990 . 5.990 4.933 4.277 5.196 . 0 0 "[ . 1 . 2]" 1
1541 1 79 ILE HG12 1 89 MET ME 5.980 . 5.980 5.344 4.986 5.539 . 0 0 "[ . 1 . 2]" 1
1542 1 79 ILE H 1 80 GLU HA 5.980 . 5.980 5.303 5.278 5.331 . 0 0 "[ . 1 . 2]" 1
1543 1 79 ILE MG 1 153 TYR QD 5.960 . 5.960 2.987 2.841 3.117 . 0 0 "[ . 1 . 2]" 1
1544 1 79 ILE HB 1 153 TYR QD 5.910 . 5.910 4.225 4.102 4.409 . 0 0 "[ . 1 . 2]" 1
1545 1 79 ILE HG12 1 80 GLU H 5.880 . 5.880 4.179 4.097 4.240 . 0 0 "[ . 1 . 2]" 1
1546 1 79 ILE MD 1 95 LEU MD1 5.790 . 5.790 4.286 4.198 4.438 . 0 0 "[ . 1 . 2]" 1
1547 1 79 ILE MG 1 154 PHE HZ 5.760 . 5.760 5.511 5.058 5.849 0.089 17 0 "[ . 1 . 2]" 1
1548 1 79 ILE MG 1 85 ILE MG 5.660 . 5.660 3.910 3.731 4.039 . 0 0 "[ . 1 . 2]" 1
1549 1 79 ILE MD 1 154 PHE HZ 5.650 . 5.650 4.933 4.635 5.269 . 0 0 "[ . 1 . 2]" 1
1550 1 79 ILE H 1 79 ILE HG12 5.530 . 5.530 2.078 2.032 2.129 . 0 0 "[ . 1 . 2]" 1
1551 1 79 ILE H 1 80 GLU H 5.500 . 5.500 2.868 2.780 2.921 . 0 0 "[ . 1 . 2]" 1
1552 1 79 ILE MD 1 80 GLU H 5.490 . 5.490 4.661 4.639 4.685 . 0 0 "[ . 1 . 2]" 1
1553 1 79 ILE H 1 79 ILE MD 5.400 . 5.400 3.294 3.228 3.355 . 0 0 "[ . 1 . 2]" 1
1554 1 79 ILE MG 1 80 GLU HA 5.390 . 5.390 3.280 3.119 3.443 . 0 0 "[ . 1 . 2]" 1
1555 1 79 ILE HB 1 86 ALA MB 5.240 . 5.240 4.859 4.682 5.057 . 0 0 "[ . 1 . 2]" 1
1556 1 79 ILE MG 1 86 ALA H 5.230 . 5.230 4.783 4.623 4.932 . 0 0 "[ . 1 . 2]" 1
1557 1 79 ILE HA 1 81 GLY H 5.170 . 5.170 3.968 3.908 4.145 . 0 0 "[ . 1 . 2]" 1
1558 1 79 ILE MD 1 89 MET ME 4.950 . 4.950 2.660 2.388 2.850 . 0 0 "[ . 1 . 2]" 1
1559 1 79 ILE MD 1 85 ILE MG 4.930 . 4.930 3.103 2.833 3.239 . 0 0 "[ . 1 . 2]" 1
1560 1 79 ILE MG 1 86 ALA HA 4.920 . 4.920 4.409 4.104 4.623 . 0 0 "[ . 1 . 2]" 1
1561 1 79 ILE HG12 1 153 TYR HB3 4.800 . 4.800 5.001 4.947 5.132 0.332 7 0 "[ . 1 . 2]" 1
1562 1 79 ILE HG13 1 80 GLU H 4.790 . 4.790 4.692 4.653 4.736 . 0 0 "[ . 1 . 2]" 1
1563 1 79 ILE HA 1 86 ALA MB 4.780 . 4.780 3.330 3.234 3.589 . 0 0 "[ . 1 . 2]" 1
1564 1 79 ILE MG 1 80 GLU H 4.670 . 4.670 3.177 3.111 3.276 . 0 0 "[ . 1 . 2]" 1
1565 1 79 ILE HA 1 80 GLU H 4.600 . 4.600 3.672 3.644 3.687 . 0 0 "[ . 1 . 2]" 1
1566 1 79 ILE MD 1 86 ALA HA 4.570 . 4.570 4.008 3.724 4.227 . 0 0 "[ . 1 . 2]" 1
1567 1 79 ILE HA 1 82 HIS H 4.560 . 4.560 3.657 3.537 3.695 . 0 0 "[ . 1 . 2]" 1
1568 1 79 ILE HB 1 80 GLU H 4.540 . 4.540 2.271 2.247 2.320 . 0 0 "[ . 1 . 2]" 1
1569 1 79 ILE MG 1 153 TYR HB2 4.520 . 4.520 3.749 3.584 3.944 . 0 0 "[ . 1 . 2]" 1
1570 1 79 ILE MG 1 153 TYR HB3 4.340 . 4.340 3.617 3.429 3.854 . 0 0 "[ . 1 . 2]" 1
1571 1 80 GLU HG3 1 153 TYR QD 7.370 . 7.370 6.707 4.442 7.453 0.083 10 0 "[ . 1 . 2]" 1
1572 1 80 GLU HG2 1 153 TYR QD 6.270 . 6.270 5.561 4.299 5.895 . 0 0 "[ . 1 . 2]" 1
1573 1 80 GLU H 1 81 GLY HA2 6.130 . 6.130 5.095 5.013 5.291 . 0 0 "[ . 1 . 2]" 1
1574 1 80 GLU HG2 1 81 GLY H 5.850 . 5.850 3.950 3.481 5.281 . 0 0 "[ . 1 . 2]" 1
1575 1 80 GLU HG3 1 81 GLY H 5.810 . 5.810 3.262 2.810 4.580 . 0 0 "[ . 1 . 2]" 1
1576 1 80 GLU H 1 153 TYR HB2 5.790 . 5.790 6.044 5.991 6.107 0.317 18 0 "[ . 1 . 2]" 1
1577 1 80 GLU HG3 1 82 HIS H 5.650 . 5.650 5.399 5.084 6.117 0.467 18 0 "[ . 1 . 2]" 1
1578 1 80 GLU H 1 80 GLU HG3 5.330 . 5.330 2.757 1.871 3.040 . 0 0 "[ . 1 . 2]" 1
1579 1 80 GLU H 1 82 HIS H 5.130 . 5.130 4.425 4.217 4.520 . 0 0 "[ . 1 . 2]" 1
1580 1 80 GLU HB2 1 81 GLY H 5.050 . 5.050 3.972 2.927 4.316 . 0 0 "[ . 1 . 2]" 1
1581 1 80 GLU H 1 80 GLU HG2 5.030 . 5.030 2.422 2.130 3.358 . 0 0 "[ . 1 . 2]" 1
1582 1 80 GLU H 1 81 GLY H 4.740 . 4.740 2.660 2.577 2.843 . 0 0 "[ . 1 . 2]" 1
1583 1 80 GLU HA 1 82 HIS H 4.700 . 4.700 3.983 3.798 4.063 . 0 0 "[ . 1 . 2]" 1
1584 1 81 GLY H 1 82 HIS H 4.650 . 4.650 2.575 2.390 2.682 . 0 0 "[ . 1 . 2]" 1
1585 1 81 GLY HA2 1 82 HIS H 4.400 . 4.400 3.577 3.394 3.644 . 0 0 "[ . 1 . 2]" 1
1586 1 81 GLY HA3 1 82 HIS H 4.330 . 4.330 3.123 3.011 3.403 . 0 0 "[ . 1 . 2]" 1
1587 1 82 HIS HB2 1 84 GLU H 6.630 . 6.630 4.558 4.386 4.999 . 0 0 "[ . 1 . 2]" 1
1588 1 82 HIS H 1 84 GLU H 6.230 . 6.230 5.374 5.281 5.479 . 0 0 "[ . 1 . 2]" 1
1589 1 82 HIS HB3 1 86 ALA H 6.200 . 6.200 4.574 4.214 4.742 . 0 0 "[ . 1 . 2]" 1
1590 1 82 HIS H 1 86 ALA MB 6.190 . 6.190 4.734 4.600 4.876 . 0 0 "[ . 1 . 2]" 1
1591 1 82 HIS HB2 1 85 ILE H 6.060 . 6.060 3.402 3.211 3.738 . 0 0 "[ . 1 . 2]" 1
1592 1 82 HIS HA 1 85 ILE H 6.050 . 6.050 4.154 3.991 4.240 . 0 0 "[ . 1 . 2]" 1
1593 1 82 HIS HA 1 83 PRO HB3 6.050 . 6.050 5.013 4.873 5.466 . 0 0 "[ . 1 . 2]" 1
1594 1 82 HIS H 1 82 HIS HD2 5.770 . 5.770 4.017 3.793 5.729 . 0 0 "[ . 1 . 2]" 1
1595 1 82 HIS HB2 1 85 ILE HB 5.750 . 5.750 2.217 1.982 2.696 . 0 0 "[ . 1 . 2]" 1
1596 1 82 HIS HA 1 85 ILE HB 5.740 . 5.740 4.419 4.165 4.597 . 0 0 "[ . 1 . 2]" 1
1597 1 82 HIS HB3 1 85 ILE HB 5.720 . 5.720 2.036 1.627 2.269 0.023 17 0 "[ . 1 . 2]" 1
1598 1 82 HIS HD2 1 85 ILE HB 5.690 . 5.690 4.328 3.980 4.765 . 0 0 "[ . 1 . 2]" 1
1599 1 82 HIS HB3 1 85 ILE H 5.690 . 5.690 2.749 2.510 2.864 . 0 0 "[ . 1 . 2]" 1
1600 1 82 HIS HB2 1 85 ILE MD 5.450 . 5.450 3.739 3.381 4.278 . 0 0 "[ . 1 . 2]" 1
1601 1 82 HIS H 1 85 ILE HB 5.390 . 5.390 4.781 4.543 5.155 . 0 0 "[ . 1 . 2]" 1
1602 1 82 HIS HB2 1 85 ILE MG 5.370 . 5.370 1.996 1.650 2.208 . 0 0 "[ . 1 . 2]" 1
1603 1 82 HIS H 1 83 PRO HD2 5.370 . 5.370 4.384 4.090 4.838 . 0 0 "[ . 1 . 2]" 1
1604 1 82 HIS HB3 1 85 ILE MG 5.320 . 5.320 3.015 2.372 3.314 . 0 0 "[ . 1 . 2]" 1
1605 1 82 HIS HB3 1 85 ILE MD 5.280 . 5.280 3.250 2.971 3.376 . 0 0 "[ . 1 . 2]" 1
1606 1 82 HIS HA 1 84 GLU H 5.210 . 5.210 3.552 3.450 3.688 . 0 0 "[ . 1 . 2]" 1
1607 1 82 HIS HA 1 83 PRO HB2 5.190 . 5.190 5.280 4.826 5.397 0.207 12 0 "[ . 1 . 2]" 1
1608 1 82 HIS HD2 1 85 ILE MG 4.870 . 4.870 3.837 3.491 5.019 0.149 5 0 "[ . 1 . 2]" 1
1609 1 82 HIS HA 1 83 PRO HD2 4.480 . 4.480 1.849 1.739 2.313 . 0 0 "[ . 1 . 2]" 1
1610 1 82 HIS HA 1 83 PRO HD3 4.400 . 4.400 2.298 1.809 2.556 . 0 0 "[ . 1 . 2]" 1
1611 1 82 HIS O 1 86 ALA N . 2.700 3.300 3.326 3.282 3.356 0.056 6 0 "[ . 1 . 2]" 1
1612 1 82 HIS O 1 86 ALA H . . 2.300 2.615 2.567 2.651 0.351 18 0 "[ . 1 . 2]" 1
1613 1 83 PRO HA 1 85 ILE H 6.370 . 6.370 3.769 3.686 3.904 . 0 0 "[ . 1 . 2]" 1
1614 1 83 PRO HB2 1 86 ALA MB 6.350 . 6.350 5.475 5.080 6.080 . 0 0 "[ . 1 . 2]" 1
1615 1 83 PRO HB3 1 87 ASN H 5.710 . 5.710 5.945 5.782 6.015 0.305 17 0 "[ . 1 . 2]" 1
1616 1 83 PRO HB3 1 86 ALA MB 5.620 . 5.620 5.246 4.906 5.616 . 0 0 "[ . 1 . 2]" 1
1617 1 83 PRO HD2 1 84 GLU H 5.180 . 5.180 2.831 2.673 2.943 . 0 0 "[ . 1 . 2]" 1
1618 1 83 PRO HA 1 84 GLU H 5.150 . 5.150 3.596 3.577 3.631 . 0 0 "[ . 1 . 2]" 1
1619 1 83 PRO HD3 1 84 GLU H 5.040 . 5.040 4.059 3.972 4.133 . 0 0 "[ . 1 . 2]" 1
1620 1 83 PRO HA 1 86 ALA H 4.760 . 4.760 3.520 3.409 3.782 . 0 0 "[ . 1 . 2]" 1
1621 1 83 PRO HA 1 87 ASN H 4.650 . 4.650 4.207 4.125 4.445 . 0 0 "[ . 1 . 2]" 1
1622 1 83 PRO HA 1 86 ALA MB 3.860 . 3.860 3.390 3.002 3.783 . 0 0 "[ . 1 . 2]" 1
1623 1 83 PRO O 1 87 ASN N . 2.700 3.300 3.072 3.004 3.185 . 0 0 "[ . 1 . 2]" 1
1624 1 83 PRO O 1 87 ASN H . . 2.300 2.298 2.223 2.395 0.095 5 0 "[ . 1 . 2]" 1
1625 1 84 GLU HB2 1 87 ASN HB3 6.800 . 6.800 5.262 3.955 6.799 . 0 0 "[ . 1 . 2]" 1
1626 1 84 GLU H 1 86 ALA MB 5.970 . 5.970 5.260 5.068 5.412 . 0 0 "[ . 1 . 2]" 1
1627 1 84 GLU HG2 1 86 ALA H 5.760 . 5.760 5.595 5.317 6.065 0.305 10 0 "[ . 1 . 2]" 1
1628 1 84 GLU HB3 1 88 GLU H 5.710 . 5.710 5.386 4.520 5.885 0.175 19 0 "[ . 1 . 2]" 1
1629 1 84 GLU HB3 1 87 ASN H 5.640 . 5.640 5.150 4.809 5.382 . 0 0 "[ . 1 . 2]" 1
1630 1 84 GLU HG2 1 85 ILE H 5.500 . 5.500 4.048 3.379 5.252 . 0 0 "[ . 1 . 2]" 1
1631 1 84 GLU H 1 86 ALA H 5.410 . 5.410 3.941 3.850 4.069 . 0 0 "[ . 1 . 2]" 1
1632 1 84 GLU HB2 1 87 ASN H 5.300 . 5.300 5.073 4.785 5.355 0.055 10 0 "[ . 1 . 2]" 1
1633 1 84 GLU HA 1 88 GLU H 5.240 . 5.240 3.713 3.564 3.813 . 0 0 "[ . 1 . 2]" 1
1634 1 84 GLU H 1 85 ILE H 5.190 . 5.190 2.372 2.316 2.417 . 0 0 "[ . 1 . 2]" 1
1635 1 84 GLU H 1 84 GLU HG2 5.020 . 5.020 2.546 1.860 3.628 . 0 0 "[ . 1 . 2]" 1
1636 1 84 GLU HA 1 87 ASN HB3 4.930 . 4.930 3.256 2.331 3.971 . 0 0 "[ . 1 . 2]" 1
1637 1 84 GLU HA 1 85 ILE H 4.780 . 4.780 3.358 3.326 3.382 . 0 0 "[ . 1 . 2]" 1
1638 1 84 GLU HA 1 87 ASN H 4.720 . 4.720 2.843 2.731 2.957 . 0 0 "[ . 1 . 2]" 1
1639 1 84 GLU HA 1 87 ASN HB2 4.690 . 4.690 2.272 2.057 2.815 . 0 0 "[ . 1 . 2]" 1
1640 1 84 GLU HB2 1 88 GLU HG2 4.520 . 4.520 4.140 3.532 4.720 0.200 8 0 "[ . 1 . 2]" 1
1641 1 84 GLU O 1 88 GLU N . 2.700 3.300 3.458 3.417 3.504 0.204 13 0 "[ . 1 . 2]" 1
1642 1 84 GLU O 1 88 GLU H . . 2.300 2.514 2.492 2.546 0.246 13 0 "[ . 1 . 2]" 1
1643 1 85 ILE HA 1 102 PHE QD 7.350 . 7.350 6.021 5.780 6.162 . 0 0 "[ . 1 . 2]" 1
1644 1 85 ILE MD 1 102 PHE HZ 6.760 . 6.760 6.405 6.132 6.810 0.050 10 0 "[ . 1 . 2]" 1
1645 1 85 ILE MD 1 98 LYS HD3 6.300 . 6.300 5.981 5.605 6.319 0.019 11 0 "[ . 1 . 2]" 1
1646 1 85 ILE MD 1 103 ILE MD 6.260 . 6.260 4.030 3.080 5.111 . 0 0 "[ . 1 . 2]" 1
1647 1 85 ILE HA 1 102 PHE QE 6.190 . 6.190 6.225 5.883 6.289 0.099 14 0 "[ . 1 . 2]" 1
1648 1 85 ILE MD 1 102 PHE QE 6.160 . 6.160 4.425 4.143 4.757 . 0 0 "[ . 1 . 2]" 1
1649 1 85 ILE H 1 86 ALA MB 6.160 . 6.160 3.886 3.796 3.973 . 0 0 "[ . 1 . 2]" 1
1650 1 85 ILE HG12 1 89 MET ME 6.080 . 6.080 5.818 5.237 6.126 0.046 16 0 "[ . 1 . 2]" 1
1651 1 85 ILE HG13 1 98 LYS HD2 6.040 . 6.040 6.209 6.057 6.403 0.363 13 0 "[ . 1 . 2]" 1
1652 1 85 ILE HG12 1 86 ALA H 5.940 . 5.940 5.538 5.445 5.621 . 0 0 "[ . 1 . 2]" 1
1653 1 85 ILE MD 1 107 VAL H 5.930 . 5.930 5.996 5.872 6.105 0.175 18 0 "[ . 1 . 2]" 1
1654 1 85 ILE HG13 1 89 MET ME 5.690 . 5.690 5.287 4.917 5.472 . 0 0 "[ . 1 . 2]" 1
1655 1 85 ILE MD 1 102 PHE QD 5.690 . 5.690 4.350 3.856 4.630 . 0 0 "[ . 1 . 2]" 1
1656 1 85 ILE MD 1 106 GLU HG3 5.650 . 5.650 5.682 5.282 5.865 0.215 16 0 "[ . 1 . 2]" 1
1657 1 85 ILE HA 1 89 MET ME 5.540 . 5.540 5.557 5.238 5.679 0.139 4 0 "[ . 1 . 2]" 1
1658 1 85 ILE MD 1 103 ILE MG 5.510 . 5.510 3.960 3.385 4.417 . 0 0 "[ . 1 . 2]" 1
1659 1 85 ILE MG 1 86 ALA H 5.460 . 5.460 2.728 2.600 2.821 . 0 0 "[ . 1 . 2]" 1
1660 1 85 ILE HB 1 86 ALA H 5.380 . 5.380 3.932 3.899 3.984 . 0 0 "[ . 1 . 2]" 1
1661 1 85 ILE MG 1 86 ALA MB 5.340 . 5.340 2.869 2.753 2.990 . 0 0 "[ . 1 . 2]" 1
1662 1 85 ILE HG12 1 103 ILE MD 5.250 . 5.250 3.857 2.948 4.960 . 0 0 "[ . 1 . 2]" 1
1663 1 85 ILE MD 1 107 VAL MG2 5.240 . 5.240 4.855 4.505 5.532 0.292 11 0 "[ . 1 . 2]" 1
1664 1 85 ILE MD 1 106 GLU HB3 5.160 . 5.160 4.400 4.291 4.547 . 0 0 "[ . 1 . 2]" 1
1665 1 85 ILE MD 1 106 GLU HB2 5.110 . 5.110 5.026 4.826 5.257 0.147 5 0 "[ . 1 . 2]" 1
1666 1 85 ILE MD 1 103 ILE HA 4.880 . 4.880 4.113 3.853 4.315 . 0 0 "[ . 1 . 2]" 1
1667 1 85 ILE H 1 86 ALA H 4.830 . 4.830 2.080 2.021 2.139 . 0 0 "[ . 1 . 2]" 1
1668 1 85 ILE HA 1 89 MET H 4.750 . 4.750 4.885 4.763 5.020 0.270 5 0 "[ . 1 . 2]" 1
1669 1 85 ILE MG 1 89 MET ME 4.690 . 4.690 3.594 3.193 3.823 . 0 0 "[ . 1 . 2]" 1
1670 1 85 ILE HG13 1 103 ILE MD 4.520 . 4.520 3.510 2.701 4.531 0.011 14 0 "[ . 1 . 2]" 1
1671 1 85 ILE MG 1 103 ILE MD 6.610 . 6.610 4.190 3.648 4.896 . 0 0 "[ . 1 . 2]" 1
1672 1 85 ILE H 1 87 ASN H 4.140 . 4.140 3.368 3.276 3.442 . 0 0 "[ . 1 . 2]" 1
1673 1 86 ALA MB 1 153 TYR QD 6.080 . 6.080 4.769 4.563 4.975 . 0 0 "[ . 1 . 2]" 1
1674 1 86 ALA HA 1 154 PHE QE 5.960 . 5.960 5.749 5.326 6.024 0.064 19 0 "[ . 1 . 2]" 1
1675 1 86 ALA MB 1 88 GLU H 5.890 . 5.890 4.745 4.657 4.829 . 0 0 "[ . 1 . 2]" 1
1676 1 86 ALA MB 1 89 MET ME 5.870 . 5.870 2.658 2.081 3.105 . 0 0 "[ . 1 . 2]" 1
1677 1 86 ALA MB 1 87 ASN HB2 5.830 . 5.830 4.680 4.456 4.941 . 0 0 "[ . 1 . 2]" 1
1678 1 86 ALA HA 1 89 MET HB3 5.540 . 5.540 2.719 2.513 3.045 . 0 0 "[ . 1 . 2]" 1
1679 1 86 ALA MB 1 87 ASN HA 5.050 . 5.050 3.797 3.719 3.910 . 0 0 "[ . 1 . 2]" 1
1680 1 86 ALA HA 1 89 MET HG2 5.090 . 5.090 4.801 4.609 5.152 0.062 19 0 "[ . 1 . 2]" 1
1681 1 86 ALA H 1 87 ASN H 4.980 . 4.980 2.043 1.989 2.087 . 0 0 "[ . 1 . 2]" 1
1682 1 86 ALA HA 1 89 MET H 4.850 . 4.850 3.184 3.090 3.308 . 0 0 "[ . 1 . 2]" 1
1683 1 86 ALA HA 1 87 ASN H 4.580 . 4.580 3.529 3.488 3.567 . 0 0 "[ . 1 . 2]" 1
1684 1 86 ALA HA 1 89 MET ME 4.410 . 4.410 2.190 1.793 2.514 . 0 0 "[ . 1 . 2]" 1
1685 1 86 ALA MB 1 87 ASN H 3.920 . 3.920 3.071 2.920 3.216 . 0 0 "[ . 1 . 2]" 1
1686 1 87 ASN HA 1 88 GLU HA 6.190 . 6.190 4.733 4.718 4.750 . 0 0 "[ . 1 . 2]" 1
1687 1 87 ASN HB2 1 88 GLU HG3 6.050 . 6.050 5.902 5.015 6.453 0.403 9 0 "[ . 1 . 2]" 1
1688 1 87 ASN H 1 89 MET HB3 5.780 . 5.780 5.304 5.133 5.558 . 0 0 "[ . 1 . 2]" 1
1689 1 87 ASN H 1 88 GLU HB2 5.690 . 5.690 4.754 4.665 4.842 . 0 0 "[ . 1 . 2]" 1
1690 1 87 ASN HB2 1 88 GLU HA 5.540 . 5.540 4.932 4.436 5.535 . 0 0 "[ . 1 . 2]" 1
1691 1 87 ASN HB3 1 88 GLU HA 5.420 . 5.420 3.985 3.725 4.218 . 0 0 "[ . 1 . 2]" 1
1692 1 87 ASN HB2 1 89 MET H 5.370 . 5.370 5.378 5.177 5.667 0.297 12 0 "[ . 1 . 2]" 1
1693 1 87 ASN H 1 88 GLU H 4.800 . 4.800 2.576 2.505 2.631 . 0 0 "[ . 1 . 2]" 1
1694 1 87 ASN H 1 89 MET H 4.760 . 4.760 4.011 3.895 4.136 . 0 0 "[ . 1 . 2]" 1
1695 1 87 ASN HB2 1 88 GLU H 4.750 . 4.750 3.295 2.903 3.895 . 0 0 "[ . 1 . 2]" 1
1696 1 87 ASN HB3 1 88 GLU H 4.660 . 4.660 3.169 2.571 3.769 . 0 0 "[ . 1 . 2]" 1
1697 1 87 ASN HA 1 89 MET H 4.620 . 4.620 4.157 4.101 4.211 . 0 0 "[ . 1 . 2]" 1
1698 1 87 ASN HA 1 88 GLU H 4.420 . 4.420 3.614 3.601 3.626 . 0 0 "[ . 1 . 2]" 1
1699 1 88 GLU HB3 1 102 PHE QD 5.600 . 5.600 5.388 4.886 5.619 0.019 2 0 "[ . 1 . 2]" 1
1700 1 88 GLU HB2 1 102 PHE QD 5.590 . 5.590 5.405 5.128 5.616 0.026 8 0 "[ . 1 . 2]" 1
1701 1 88 GLU HB2 1 89 MET HA 5.310 . 5.310 4.449 4.408 4.489 . 0 0 "[ . 1 . 2]" 1
1702 1 88 GLU HB3 1 89 MET HA 5.310 . 5.310 4.306 4.234 4.396 . 0 0 "[ . 1 . 2]" 1
1703 1 88 GLU H 1 89 MET HB3 4.980 . 4.980 4.661 4.551 4.735 . 0 0 "[ . 1 . 2]" 1
1704 1 88 GLU HB3 1 89 MET H 4.950 . 4.950 3.853 3.753 3.949 . 0 0 "[ . 1 . 2]" 1
1705 1 88 GLU H 1 88 GLU HG3 4.570 . 4.570 3.583 2.377 3.835 . 0 0 "[ . 1 . 2]" 1
1706 1 88 GLU HA 1 89 MET H 4.350 . 4.350 3.586 3.564 3.612 . 0 0 "[ . 1 . 2]" 1
1707 1 88 GLU HB2 1 89 MET H 3.370 . 3.370 2.953 2.893 3.059 . 0 0 "[ . 1 . 2]" 1
1708 1 88 GLU H 1 89 MET H 3.730 . 3.730 2.678 2.644 2.723 . 0 0 "[ . 1 . 2]" 1
1709 1 89 MET HA 1 154 PHE QE 6.770 . 6.770 6.708 6.594 6.793 0.023 15 0 "[ . 1 . 2]" 1
1710 1 89 MET ME 1 103 ILE HG12 6.310 . 6.310 6.368 6.235 6.494 0.184 17 0 "[ . 1 . 2]" 1
1711 1 89 MET H 1 154 PHE HZ 6.260 . 6.260 6.107 5.859 6.282 0.022 2 0 "[ . 1 . 2]" 1
1712 1 89 MET HG2 1 90 LYS HB2 6.250 . 6.250 4.779 4.300 4.997 . 0 0 "[ . 1 . 2]" 1
1713 1 89 MET HG2 1 90 LYS H 5.970 . 5.970 2.546 2.077 2.810 . 0 0 "[ . 1 . 2]" 1
1714 1 89 MET H 1 90 LYS H 5.950 . 5.950 4.675 4.667 4.690 . 0 0 "[ . 1 . 2]" 1
1715 1 89 MET ME 1 103 ILE MD 5.930 . 5.930 4.519 4.226 4.811 . 0 0 "[ . 1 . 2]" 1
1716 1 89 MET HA 1 95 LEU HB2 5.920 . 5.920 6.005 5.923 6.079 0.159 14 0 "[ . 1 . 2]" 1
1717 1 89 MET HB2 1 95 LEU HA 5.910 . 5.910 3.834 3.498 4.015 . 0 0 "[ . 1 . 2]" 1
1718 1 89 MET HB2 1 90 LYS H 5.890 . 5.890 3.714 3.318 3.925 . 0 0 "[ . 1 . 2]" 1
1719 1 89 MET HA 1 154 PHE HZ 5.810 . 5.810 6.075 6.001 6.148 0.338 10 0 "[ . 1 . 2]" 1
1720 1 89 MET HA 1 90 LYS HG3 5.630 . 5.630 3.917 3.760 4.485 . 0 0 "[ . 1 . 2]" 1
1721 1 89 MET HG3 1 95 LEU HA 5.630 . 5.630 3.607 3.351 4.059 . 0 0 "[ . 1 . 2]" 1
1722 1 89 MET H 1 90 LYS QD 5.590 . 5.590 5.611 5.474 5.748 0.158 12 0 "[ . 1 . 2]" 1
1723 1 89 MET HG3 1 95 LEU MD1 5.590 . 5.590 3.501 2.901 3.859 . 0 0 "[ . 1 . 2]" 1
1724 1 89 MET ME 1 154 PHE QE 5.550 . 5.550 2.688 2.268 3.252 . 0 0 "[ . 1 . 2]" 1
1725 1 89 MET HB3 1 91 ASP H 5.240 . 5.240 4.913 4.797 5.128 . 0 0 "[ . 1 . 2]" 1
1726 1 89 MET HG2 1 90 LYS HD3 5.220 . 5.220 5.424 5.317 5.480 0.260 6 0 "[ . 1 . 2]" 1
1727 1 89 MET HG2 1 95 LEU H 5.140 . 5.140 5.141 4.839 5.230 0.090 18 0 "[ . 1 . 2]" 1
1728 1 89 MET HB2 1 94 ASP HB2 5.140 . 5.140 5.133 4.635 5.264 0.124 5 0 "[ . 1 . 2]" 1
1729 1 89 MET HB3 1 90 LYS H 5.090 . 5.090 4.194 4.133 4.298 . 0 0 "[ . 1 . 2]" 1
1730 1 89 MET H 1 89 MET ME 5.030 . 5.030 3.647 3.520 3.928 . 0 0 "[ . 1 . 2]" 1
1731 1 89 MET HG2 1 95 LEU HB2 5.010 . 5.010 4.438 4.243 4.687 . 0 0 "[ . 1 . 2]" 1
1732 1 89 MET HA 1 91 ASP H 4.990 . 4.990 4.114 4.032 4.228 . 0 0 "[ . 1 . 2]" 1
1733 1 89 MET HB3 1 98 LYS HE2 4.930 . 4.930 5.153 4.897 5.312 0.382 18 0 "[ . 1 . 2]" 1
1734 1 89 MET HA 1 90 LYS HA 4.770 . 4.770 4.358 4.347 4.366 . 0 0 "[ . 1 . 2]" 1
1735 1 89 MET ME 1 95 LEU MD1 4.760 . 4.760 3.101 2.559 3.390 . 0 0 "[ . 1 . 2]" 1
1736 1 89 MET H 1 89 MET HG2 4.750 . 4.750 4.087 4.026 4.225 . 0 0 "[ . 1 . 2]" 1
1737 1 89 MET HA 1 94 ASP HB2 4.740 . 4.740 4.556 4.380 4.730 . 0 0 "[ . 1 . 2]" 1
1738 1 89 MET HA 1 98 LYS HE2 4.690 . 4.690 3.471 2.729 4.524 . 0 0 "[ . 1 . 2]" 1
1739 1 89 MET HB3 1 89 MET ME 4.620 . 4.620 2.008 1.806 2.356 . 0 0 "[ . 1 . 2]" 1
1740 1 89 MET H 1 98 LYS HE2 4.550 . 4.550 4.644 4.513 4.804 0.254 12 0 "[ . 1 . 2]" 1
1741 1 89 MET ME 1 154 PHE HZ 4.540 . 4.540 2.327 1.705 3.029 . 0 0 "[ . 1 . 2]" 1
1742 1 89 MET HB2 1 98 LYS HD3 4.470 . 4.470 4.684 4.161 4.854 0.384 16 0 "[ . 1 . 2]" 1
1743 1 89 MET HA 1 90 LYS H 4.360 . 4.360 2.426 2.395 2.457 . 0 0 "[ . 1 . 2]" 1
1744 1 89 MET HG2 1 91 ASP H 3.900 . 3.900 2.461 2.109 2.658 . 0 0 "[ . 1 . 2]" 1
1745 1 89 MET HB2 1 98 LYS HD2 3.570 . 3.570 3.330 3.091 3.698 0.128 13 0 "[ . 1 . 2]" 1
1746 1 90 LYS H 1 90 LYS HE2 6.290 . 6.290 4.458 4.327 4.509 . 0 0 "[ . 1 . 2]" 1
1747 1 90 LYS HG3 1 91 ASP H 5.940 . 5.940 4.791 4.709 5.027 . 0 0 "[ . 1 . 2]" 1
1748 1 90 LYS H 1 94 ASP H 5.900 . 5.900 5.074 4.986 5.167 . 0 0 "[ . 1 . 2]" 1
1749 1 90 LYS H 1 91 ASP HB3 5.750 . 5.750 5.061 4.982 5.152 . 0 0 "[ . 1 . 2]" 1
1750 1 90 LYS HA 1 154 PHE QE 5.670 . 5.670 4.928 4.565 5.703 0.033 3 0 "[ . 1 . 2]" 1
1751 1 90 LYS HE2 1 94 ASP HA 5.430 . 5.430 5.581 5.503 5.659 0.229 7 0 "[ . 1 . 2]" 1
1752 1 90 LYS HE2 1 91 ASP H 5.340 . 5.340 5.320 5.185 5.369 0.029 9 0 "[ . 1 . 2]" 1
1753 1 90 LYS HB2 1 91 ASP HB2 5.320 . 5.320 3.485 3.350 3.910 . 0 0 "[ . 1 . 2]" 1
1754 1 90 LYS H 1 90 LYS HG3 5.190 . 5.190 3.245 3.111 3.671 . 0 0 "[ . 1 . 2]" 1
1755 1 90 LYS HB3 1 94 ASP HB2 5.150 . 5.150 4.989 4.347 5.197 0.047 4 0 "[ . 1 . 2]" 1
1756 1 90 LYS HB2 1 94 ASP H 5.100 . 5.100 5.186 5.124 5.225 0.125 14 0 "[ . 1 . 2]" 1
1757 1 90 LYS H 1 94 ASP HB2 5.030 . 5.030 2.810 2.719 2.896 . 0 0 "[ . 1 . 2]" 1
1758 1 90 LYS H 1 94 ASP HB3 4.790 . 4.790 3.404 3.320 3.489 . 0 0 "[ . 1 . 2]" 1
1759 1 90 LYS H 1 91 ASP H 4.730 . 4.730 1.985 1.946 2.043 . 0 0 "[ . 1 . 2]" 1
1760 1 90 LYS HA 1 90 LYS HD3 4.710 . 4.710 4.178 4.038 4.292 . 0 0 "[ . 1 . 2]" 1
1761 1 90 LYS HA 1 90 LYS HD2 4.710 . 4.710 4.784 4.610 4.833 0.123 16 0 "[ . 1 . 2]" 1
1762 1 90 LYS HB2 1 91 ASP H 4.610 . 4.610 3.197 3.141 3.220 . 0 0 "[ . 1 . 2]" 1
1763 1 90 LYS HA 1 91 ASP H 4.420 . 4.420 3.567 3.546 3.597 . 0 0 "[ . 1 . 2]" 1
1764 1 90 LYS HB3 1 91 ASP H 4.290 . 4.290 4.138 3.780 4.244 . 0 0 "[ . 1 . 2]" 1
1765 1 91 ASP HB2 1 95 LEU H 6.020 . 6.020 5.660 5.587 5.730 . 0 0 "[ . 1 . 2]" 1
1766 1 91 ASP HA 1 154 PHE HZ 5.870 . 5.870 3.484 3.044 4.076 . 0 0 "[ . 1 . 2]" 1
1767 1 91 ASP HB2 1 93 PHE H 5.780 . 5.780 4.427 4.261 4.523 . 0 0 "[ . 1 . 2]" 1
1768 1 91 ASP H 1 154 PHE QD 6.050 . 6.050 6.235 6.023 6.324 0.274 19 0 "[ . 1 . 2]" 1
1769 1 91 ASP HA 1 95 LEU H 5.470 . 5.470 5.286 5.239 5.327 . 0 0 "[ . 1 . 2]" 1
1770 1 91 ASP HA 1 154 PHE HB3 5.390 . 5.390 5.657 5.570 5.748 0.358 10 0 "[ . 1 . 2]" 1
1771 1 91 ASP H 1 92 SER H 5.370 . 5.370 4.355 4.347 4.363 . 0 0 "[ . 1 . 2]" 1
1772 1 91 ASP HA 1 154 PHE QE 5.030 . 5.030 2.839 2.497 3.212 . 0 0 "[ . 1 . 2]" 1
1773 1 91 ASP HB2 1 94 ASP H 5.010 . 5.010 3.886 3.813 3.973 . 0 0 "[ . 1 . 2]" 1
1774 1 91 ASP HB2 1 94 ASP HB2 4.990 . 4.990 3.866 3.744 3.954 . 0 0 "[ . 1 . 2]" 1
1775 1 91 ASP H 1 95 LEU H 4.770 . 4.770 3.955 3.876 4.012 . 0 0 "[ . 1 . 2]" 1
1776 1 91 ASP HA 1 154 PHE QD 4.710 . 4.710 4.084 3.888 4.307 . 0 0 "[ . 1 . 2]" 1
1777 1 91 ASP HA 1 94 ASP HB2 4.560 . 4.560 4.583 4.534 4.642 0.082 11 0 "[ . 1 . 2]" 1
1778 1 91 ASP HB3 1 93 PHE H 4.490 . 4.490 2.663 2.497 2.789 . 0 0 "[ . 1 . 2]" 1
1779 1 91 ASP HB3 1 92 SER H 4.430 . 4.430 2.971 2.883 3.077 . 0 0 "[ . 1 . 2]" 1
1780 1 91 ASP HB2 1 92 SER H 4.280 . 4.280 3.966 3.905 3.998 . 0 0 "[ . 1 . 2]" 1
1781 1 91 ASP H 1 94 ASP H 4.130 . 4.130 3.771 3.711 3.819 . 0 0 "[ . 1 . 2]" 1
1782 1 91 ASP HA 1 92 SER H 4.090 . 4.090 2.561 2.536 2.601 . 0 0 "[ . 1 . 2]" 1
1783 1 91 ASP HB3 1 94 ASP H 4.000 . 4.000 2.440 2.368 2.511 . 0 0 "[ . 1 . 2]" 1
1784 1 91 ASP H 1 94 ASP HB2 3.900 . 3.900 2.265 2.201 2.321 . 0 0 "[ . 1 . 2]" 1
1785 1 91 ASP H 1 94 ASP HB3 3.890 . 3.890 3.779 3.723 3.850 . 0 0 "[ . 1 . 2]" 1
1786 1 91 ASP O 1 95 LEU N . 2.700 3.300 2.967 2.917 3.026 . 0 0 "[ . 1 . 2]" 1
1787 1 91 ASP O 1 95 LEU H . . 2.300 2.275 2.226 2.325 0.025 4 0 "[ . 1 . 2]" 1
1788 1 92 SER HB3 1 154 PHE QE 6.620 . 6.620 5.028 2.750 6.124 . 0 0 "[ . 1 . 2]" 1
1789 1 92 SER HA 1 158 PHE QE 6.380 . 6.380 5.130 4.735 5.552 . 0 0 "[ . 1 . 2]" 1
1790 1 92 SER HB2 1 154 PHE HZ 6.260 . 6.260 6.103 5.587 6.417 0.157 20 0 "[ . 1 . 2]" 1
1791 1 92 SER HA 1 95 LEU MD1 6.120 . 6.120 4.610 4.433 4.760 . 0 0 "[ . 1 . 2]" 1
1792 1 92 SER H 1 94 ASP H 5.960 . 5.960 4.254 4.233 4.279 . 0 0 "[ . 1 . 2]" 1
1793 1 92 SER H 1 154 PHE HZ 5.870 . 5.870 4.732 4.439 5.302 . 0 0 "[ . 1 . 2]" 1
1794 1 92 SER HB3 1 158 PHE QE 5.810 . 5.810 2.917 1.900 4.261 . 0 0 "[ . 1 . 2]" 1
1795 1 92 SER HB2 1 154 PHE QE 5.170 . 5.170 4.800 3.265 5.374 0.204 2 0 "[ . 1 . 2]" 1
1796 1 92 SER HA 1 154 PHE QE 5.370 . 5.370 3.568 2.405 4.398 . 0 0 "[ . 1 . 2]" 1
1797 1 92 SER HA 1 94 ASP H 5.230 . 5.230 4.499 4.397 4.595 . 0 0 "[ . 1 . 2]" 1
1798 1 92 SER H 1 93 PHE H 5.210 . 5.210 2.791 2.689 2.844 . 0 0 "[ . 1 . 2]" 1
1799 1 92 SER H 1 154 PHE QD 5.150 . 5.150 4.175 3.016 4.583 . 0 0 "[ . 1 . 2]" 1
1800 1 92 SER H 1 154 PHE QE 5.140 . 5.140 3.924 2.619 4.473 . 0 0 "[ . 1 . 2]" 1
1801 1 92 SER H 1 158 PHE QE 4.940 . 4.940 4.606 4.306 4.807 . 0 0 "[ . 1 . 2]" 1
1802 1 92 SER O 1 96 LEU N . 2.700 3.300 3.326 3.306 3.356 0.056 14 0 "[ . 1 . 2]" 1
1803 1 92 SER O 1 96 LEU H . . 2.300 2.421 2.399 2.458 0.158 14 0 "[ . 1 . 2]" 1
1804 1 93 PHE QE 1 96 LEU MD2 7.930 . 7.930 5.504 4.786 5.740 . 0 0 "[ . 1 . 2]" 1
1805 1 93 PHE QD 1 96 LEU MD2 7.560 . 7.560 4.692 4.559 4.861 . 0 0 "[ . 1 . 2]" 1
1806 1 93 PHE HB3 1 158 PHE QD 7.040 . 7.040 7.287 7.169 7.345 0.305 13 0 "[ . 1 . 2]" 1
1807 1 93 PHE QD 1 129 ILE MG 6.440 . 6.440 4.348 4.220 4.940 . 0 0 "[ . 1 . 2]" 1
1808 1 93 PHE QE 1 129 ILE MG 6.420 . 6.420 4.605 4.367 4.788 . 0 0 "[ . 1 . 2]" 1
1809 1 93 PHE HA 1 129 ILE MG 6.050 . 6.050 5.430 5.274 5.568 . 0 0 "[ . 1 . 2]" 1
1810 1 93 PHE HA 1 158 PHE QD 6.030 . 6.030 5.713 5.526 6.098 0.068 14 0 "[ . 1 . 2]" 1
1811 1 93 PHE HA 1 129 ILE MD 5.990 . 5.990 5.305 5.106 5.477 . 0 0 "[ . 1 . 2]" 1
1812 1 93 PHE HA 1 96 LEU MD2 5.930 . 5.930 4.529 4.451 4.636 . 0 0 "[ . 1 . 2]" 1
1813 1 93 PHE QE 1 179 ARG HA 5.830 . 5.830 5.333 4.918 5.835 0.005 11 0 "[ . 1 . 2]" 1
1814 1 93 PHE HB2 1 95 LEU H 5.710 . 5.710 4.882 4.835 5.022 . 0 0 "[ . 1 . 2]" 1
1815 1 93 PHE QD 1 129 ILE HB 5.650 . 5.650 4.644 4.437 5.330 . 0 0 "[ . 1 . 2]" 1
1816 1 93 PHE HA 1 96 LEU HB3 5.630 . 5.630 4.974 4.904 5.153 . 0 0 "[ . 1 . 2]" 1
1817 1 93 PHE H 1 158 PHE QE 5.530 . 5.530 3.943 3.660 4.468 . 0 0 "[ . 1 . 2]" 1
1818 1 93 PHE H 1 94 ASP HB2 5.470 . 5.470 4.763 4.682 4.816 . 0 0 "[ . 1 . 2]" 1
1819 1 93 PHE H 1 93 PHE QD 5.460 . 5.460 2.512 2.371 3.089 . 0 0 "[ . 1 . 2]" 1
1820 1 93 PHE HA 1 96 LEU HB2 5.410 . 5.410 3.216 3.149 3.394 . 0 0 "[ . 1 . 2]" 1
1821 1 93 PHE HA 1 96 LEU HG 5.410 . 5.410 5.429 5.193 5.553 0.143 11 0 "[ . 1 . 2]" 1
1822 1 93 PHE QE 1 128 ASP HA 5.400 . 5.400 5.561 5.493 5.599 0.199 2 0 "[ . 1 . 2]" 1
1823 1 93 PHE HB3 1 129 ILE MD 5.380 . 5.380 4.557 4.366 4.718 . 0 0 "[ . 1 . 2]" 1
1824 1 93 PHE HA 1 96 LEU MD1 5.320 . 5.320 2.734 2.409 2.964 . 0 0 "[ . 1 . 2]" 1
1825 1 93 PHE QE 1 129 ILE H 5.290 . 5.290 5.361 5.312 5.433 0.143 20 0 "[ . 1 . 2]" 1
1826 1 93 PHE QE 1 178 THR HA 5.250 . 5.250 5.297 5.036 5.426 0.176 20 0 "[ . 1 . 2]" 1
1827 1 93 PHE QE 1 129 ILE HB 5.200 . 5.200 3.838 3.619 4.076 . 0 0 "[ . 1 . 2]" 1
1828 1 93 PHE QD 1 94 ASP H 5.130 . 5.130 4.290 4.177 4.655 . 0 0 "[ . 1 . 2]" 1
1829 1 93 PHE QE 1 177 ILE MG 5.040 . 5.040 3.891 2.641 4.138 . 0 0 "[ . 1 . 2]" 1
1830 1 93 PHE QE 1 127 ASN HA 5.010 . 5.010 4.000 3.250 4.483 . 0 0 "[ . 1 . 2]" 1
1831 1 93 PHE H 1 95 LEU H 5.000 . 5.000 3.792 3.711 3.865 . 0 0 "[ . 1 . 2]" 1
1832 1 93 PHE H 1 158 PHE QD 6.000 . 6.000 5.965 5.767 6.229 0.229 14 0 "[ . 1 . 2]" 1
1833 1 93 PHE QE 1 179 ARG H 4.940 . 4.940 5.143 5.012 5.298 0.358 1 0 "[ . 1 . 2]" 1
1834 1 93 PHE HA 1 94 ASP H 4.870 . 4.870 3.628 3.617 3.637 . 0 0 "[ . 1 . 2]" 1
1835 1 93 PHE H 1 94 ASP H 4.790 . 4.790 2.639 2.570 2.682 . 0 0 "[ . 1 . 2]" 1
1836 1 93 PHE HB2 1 94 ASP H 4.790 . 4.790 2.783 2.743 3.093 . 0 0 "[ . 1 . 2]" 1
1837 1 93 PHE HA 1 96 LEU H 4.790 . 4.790 3.319 3.226 3.368 . 0 0 "[ . 1 . 2]" 1
1838 1 93 PHE HA 1 95 LEU H 4.580 . 4.580 3.837 3.753 3.896 . 0 0 "[ . 1 . 2]" 1
1839 1 93 PHE O 1 97 SER N . 2.700 3.300 3.363 3.324 3.407 0.107 14 0 "[ . 1 . 2]" 1
1840 1 93 PHE O 1 97 SER H . . 2.300 2.478 2.448 2.527 0.227 18 0 "[ . 1 . 2]" 1
1841 1 94 ASP H 1 95 LEU HB2 6.130 . 6.130 5.016 4.976 5.067 . 0 0 "[ . 1 . 2]" 1
1842 1 94 ASP HB3 1 98 LYS H 5.690 . 5.690 4.796 4.606 5.138 . 0 0 "[ . 1 . 2]" 1
1843 1 94 ASP H 1 95 LEU H 5.080 . 5.080 2.633 2.606 2.656 . 0 0 "[ . 1 . 2]" 1
1844 1 94 ASP HA 1 97 SER HB3 4.670 . 4.670 2.922 2.807 3.870 . 0 0 "[ . 1 . 2]" 1
1845 1 94 ASP HB3 1 95 LEU H 4.650 . 4.650 3.976 3.943 4.013 . 0 0 "[ . 1 . 2]" 1
1846 1 94 ASP HB2 1 95 LEU H 4.640 . 4.640 3.103 3.051 3.150 . 0 0 "[ . 1 . 2]" 1
1847 1 94 ASP O 1 98 LYS N . 2.700 3.300 3.113 2.920 3.311 0.011 9 0 "[ . 1 . 2]" 1
1848 1 94 ASP O 1 98 LYS H . . 2.300 2.231 2.025 2.426 0.126 7 0 "[ . 1 . 2]" 1
1849 1 95 LEU MD1 1 99 ILE MG 7.530 . 7.530 4.853 4.406 5.140 . 0 0 "[ . 1 . 2]" 1
1850 1 95 LEU MD2 1 154 PHE QE 7.320 . 7.320 3.985 3.599 4.618 . 0 0 "[ . 1 . 2]" 1
1851 1 95 LEU MD1 1 103 ILE MG 6.990 . 6.990 4.048 3.870 4.212 . 0 0 "[ . 1 . 2]" 1
1852 1 95 LEU HB2 1 99 ILE MD 6.800 . 6.800 5.418 4.524 6.485 . 0 0 "[ . 1 . 2]" 1
1853 1 95 LEU MD1 1 99 ILE HG12 6.370 . 6.370 4.280 3.065 5.387 . 0 0 "[ . 1 . 2]" 1
1854 1 95 LEU MD2 1 146 LEU HB2 6.850 . 6.850 6.610 6.454 6.853 0.003 15 0 "[ . 1 . 2]" 1
1855 1 95 LEU HA 1 96 LEU HB2 6.150 . 6.150 5.767 5.737 5.814 . 0 0 "[ . 1 . 2]" 1
1856 1 95 LEU H 1 96 LEU HB2 6.010 . 6.010 4.675 4.623 4.774 . 0 0 "[ . 1 . 2]" 1
1857 1 95 LEU HB3 1 99 ILE MD 5.990 . 5.990 4.609 4.112 5.600 . 0 0 "[ . 1 . 2]" 1
1858 1 95 LEU HA 1 99 ILE HA 5.910 . 5.910 5.040 4.675 5.401 . 0 0 "[ . 1 . 2]" 1
1859 1 95 LEU HG 1 103 ILE MD 5.850 . 5.850 4.458 3.514 5.608 . 0 0 "[ . 1 . 2]" 1
1860 1 95 LEU MD1 1 98 LYS H 5.850 . 5.850 4.547 4.313 4.683 . 0 0 "[ . 1 . 2]" 1
1861 1 95 LEU HA 1 99 ILE H 5.810 . 5.810 4.675 4.556 4.830 . 0 0 "[ . 1 . 2]" 1
1862 1 95 LEU MD1 1 96 LEU H 5.790 . 5.790 4.556 4.530 4.591 . 0 0 "[ . 1 . 2]" 1
1863 1 95 LEU MD1 1 154 PHE HZ 5.750 . 5.750 5.216 4.997 5.458 . 0 0 "[ . 1 . 2]" 1
1864 1 95 LEU MD1 1 99 ILE HA 5.680 . 5.680 3.447 3.059 3.803 . 0 0 "[ . 1 . 2]" 1
1865 1 95 LEU MD1 1 150 CYS HB3 5.620 . 5.620 5.785 5.374 5.839 0.219 9 0 "[ . 1 . 2]" 1
1866 1 95 LEU HB3 1 96 LEU H 5.460 . 5.460 2.494 2.454 2.553 . 0 0 "[ . 1 . 2]" 1
1867 1 95 LEU HG 1 96 LEU H 5.460 . 5.460 3.628 3.572 3.700 . 0 0 "[ . 1 . 2]" 1
1868 1 95 LEU MD1 1 99 ILE MD 5.420 . 5.420 3.480 1.950 4.364 . 0 0 "[ . 1 . 2]" 1
1869 1 95 LEU HA 1 103 ILE MD 5.380 . 5.380 4.489 3.690 5.437 0.057 15 0 "[ . 1 . 2]" 1
1870 1 95 LEU HG 1 99 ILE MD 5.340 . 5.340 2.835 1.779 3.892 . 0 0 "[ . 1 . 2]" 1
1871 1 95 LEU MD1 1 99 ILE H 5.250 . 5.250 4.596 4.290 4.779 . 0 0 "[ . 1 . 2]" 1
1872 1 95 LEU H 1 96 LEU H 5.170 . 5.170 2.727 2.691 2.766 . 0 0 "[ . 1 . 2]" 1
1873 1 95 LEU HB2 1 154 PHE QE 5.060 . 5.060 4.273 3.818 4.810 . 0 0 "[ . 1 . 2]" 1
1874 1 95 LEU HB2 1 96 LEU H 4.990 . 4.990 3.904 3.870 3.947 . 0 0 "[ . 1 . 2]" 1
1875 1 95 LEU HA 1 98 LYS H 4.830 . 4.830 3.432 3.214 3.621 . 0 0 "[ . 1 . 2]" 1
1876 1 95 LEU HA 1 96 LEU H 4.630 . 4.630 3.647 3.638 3.660 . 0 0 "[ . 1 . 2]" 1
1877 1 95 LEU HA 1 97 SER H 4.600 . 4.600 4.231 4.192 4.313 . 0 0 "[ . 1 . 2]" 1
1878 1 95 LEU HA 1 98 LYS HD2 4.570 . 4.570 4.016 3.360 4.519 . 0 0 "[ . 1 . 2]" 1
1879 1 95 LEU H 1 97 SER H 4.550 . 4.550 3.990 3.932 4.046 . 0 0 "[ . 1 . 2]" 1
1880 1 95 LEU MD1 1 103 ILE MD 4.430 . 4.430 2.500 1.915 3.268 . 0 0 "[ . 1 . 2]" 1
1881 1 95 LEU MD2 1 150 CYS HB3 4.160 . 4.160 3.431 3.227 3.514 . 0 0 "[ . 1 . 2]" 1
1882 1 95 LEU O 1 99 ILE N . 2.700 3.300 2.834 2.757 2.908 . 0 0 "[ . 1 . 2]" 1
1883 1 95 LEU O 1 99 ILE H . . 2.300 2.456 2.397 2.561 0.261 19 0 "[ . 1 . 2]" 1
1884 1 96 LEU MD2 1 97 SER H 6.650 . 6.650 5.062 5.014 5.126 . 0 0 "[ . 1 . 2]" 1
1885 1 96 LEU MD2 1 147 LEU MD2 6.560 . 6.560 3.563 3.393 3.725 . 0 0 "[ . 1 . 2]" 1
1886 1 96 LEU HB3 1 129 ILE MD 6.470 . 6.470 4.728 4.329 4.934 . 0 0 "[ . 1 . 2]" 1
1887 1 96 LEU HB2 1 97 SER HA 6.150 . 6.150 4.623 4.527 4.696 . 0 0 "[ . 1 . 2]" 1
1888 1 96 LEU MD1 1 129 ILE HG13 6.140 . 6.140 4.548 4.345 4.646 . 0 0 "[ . 1 . 2]" 1
1889 1 96 LEU HG 1 147 LEU MD2 6.140 . 6.140 3.557 3.379 3.748 . 0 0 "[ . 1 . 2]" 1
1890 1 96 LEU MD1 1 97 SER H 6.110 . 6.110 4.355 4.238 4.430 . 0 0 "[ . 1 . 2]" 1
1891 1 96 LEU MD1 1 129 ILE HG12 6.100 . 6.100 6.072 5.879 6.156 0.056 16 0 "[ . 1 . 2]" 1
1892 1 96 LEU HA 1 99 ILE HB 5.960 . 5.960 2.720 2.164 3.523 . 0 0 "[ . 1 . 2]" 1
1893 1 96 LEU H 1 98 LYS H 5.950 . 5.950 4.419 4.081 4.664 . 0 0 "[ . 1 . 2]" 1
1894 1 96 LEU HB2 1 97 SER H 5.920 . 5.920 3.036 2.928 3.123 . 0 0 "[ . 1 . 2]" 1
1895 1 96 LEU H 1 96 LEU MD2 5.830 . 5.830 4.258 4.216 4.297 . 0 0 "[ . 1 . 2]" 1
1896 1 96 LEU HB3 1 177 ILE MD 5.780 . 5.780 5.502 5.349 5.663 . 0 0 "[ . 1 . 2]" 1
1897 1 96 LEU MD2 1 177 ILE MG 5.700 . 5.700 4.007 3.854 4.094 . 0 0 "[ . 1 . 2]" 1
1898 1 96 LEU MD2 1 131 LEU HA 5.680 . 5.680 4.557 4.295 4.821 . 0 0 "[ . 1 . 2]" 1
1899 1 96 LEU HG 1 177 ILE MD 5.660 . 5.660 4.911 4.539 5.121 . 0 0 "[ . 1 . 2]" 1
1900 1 96 LEU H 1 97 SER H 5.640 . 5.640 2.789 2.769 2.867 . 0 0 "[ . 1 . 2]" 1
1901 1 96 LEU HB3 1 129 ILE HG13 5.570 . 5.570 5.639 5.542 5.730 0.160 13 0 "[ . 1 . 2]" 1
1902 1 96 LEU MD2 1 147 LEU HB3 5.560 . 5.560 5.546 5.360 5.624 0.064 6 0 "[ . 1 . 2]" 1
1903 1 96 LEU H 1 96 LEU HG 5.460 . 5.460 3.564 3.390 3.669 . 0 0 "[ . 1 . 2]" 1
1904 1 96 LEU MD2 1 131 LEU H 5.240 . 5.240 5.378 5.286 5.460 0.220 17 0 "[ . 1 . 2]" 1
1905 1 96 LEU HA 1 99 ILE H 5.230 . 5.230 3.422 3.340 3.584 . 0 0 "[ . 1 . 2]" 1
1906 1 96 LEU MD2 1 129 ILE HB 5.150 . 5.150 4.211 4.001 4.390 . 0 0 "[ . 1 . 2]" 1
1907 1 96 LEU HA 1 98 LYS H 5.080 . 5.080 4.415 3.917 4.549 . 0 0 "[ . 1 . 2]" 1
1908 1 96 LEU HA 1 97 SER HA 4.930 . 4.930 4.735 4.561 4.775 . 0 0 "[ . 1 . 2]" 1
1909 1 96 LEU MD2 1 177 ILE HG12 4.920 . 4.920 3.890 3.609 4.993 0.073 11 0 "[ . 1 . 2]" 1
1910 1 96 LEU HB3 1 97 SER H 4.840 . 4.840 3.566 3.476 3.652 . 0 0 "[ . 1 . 2]" 1
1911 1 96 LEU MD2 1 177 ILE HG13 4.790 . 4.790 4.948 4.820 5.063 0.273 13 0 "[ . 1 . 2]" 1
1912 1 96 LEU HA 1 99 ILE MD 4.620 . 4.620 2.928 1.727 4.306 . 0 0 "[ . 1 . 2]" 1
1913 1 96 LEU MD2 1 177 ILE HB 4.610 . 4.610 4.084 3.946 4.238 . 0 0 "[ . 1 . 2]" 1
1914 1 96 LEU HB3 1 129 ILE MG 4.470 . 4.470 4.088 3.963 4.204 . 0 0 "[ . 1 . 2]" 1
1915 1 96 LEU MD2 1 129 ILE MG 4.200 . 4.200 2.246 2.023 2.394 . 0 0 "[ . 1 . 2]" 1
1916 1 97 SER HA 1 99 ILE H 5.530 . 5.530 4.019 3.826 4.208 . 0 0 "[ . 1 . 2]" 1
1917 1 97 SER HA 1 121 CYS HB3 5.390 . 5.390 5.489 5.441 5.530 0.140 7 0 "[ . 1 . 2]" 1
1918 1 97 SER H 1 98 LYS H 5.230 . 5.230 2.728 2.507 2.928 . 0 0 "[ . 1 . 2]" 1
1919 1 97 SER HA 1 121 CYS HB2 5.160 . 5.160 5.240 5.139 5.363 0.203 8 0 "[ . 1 . 2]" 1
1920 1 97 SER HB3 1 98 LYS H 5.110 . 5.110 2.816 2.673 4.475 . 0 0 "[ . 1 . 2]" 1
1921 1 97 SER HA 1 98 LYS H 4.670 . 4.670 3.642 3.434 3.709 . 0 0 "[ . 1 . 2]" 1
1922 1 97 SER HB2 1 98 LYS H 4.590 . 4.590 4.065 4.014 4.450 . 0 0 "[ . 1 . 2]" 1
1923 1 98 LYS HB3 1 103 ILE MD 6.770 . 6.770 4.531 2.724 6.057 . 0 0 "[ . 1 . 2]" 1
1924 1 98 LYS HE2 1 103 ILE MD 6.690 . 6.690 4.861 3.826 5.780 . 0 0 "[ . 1 . 2]" 1
1925 1 98 LYS HG2 1 99 ILE H 6.230 . 6.230 5.063 4.445 5.401 . 0 0 "[ . 1 . 2]" 1
1926 1 98 LYS HB3 1 103 ILE H 6.160 . 6.160 4.931 4.480 5.583 . 0 0 "[ . 1 . 2]" 1
1927 1 98 LYS HA 1 102 PHE H 6.030 . 6.030 3.681 3.456 3.925 . 0 0 "[ . 1 . 2]" 1
1928 1 98 LYS HD3 1 102 PHE H 5.960 . 5.960 4.254 3.866 4.708 . 0 0 "[ . 1 . 2]" 1
1929 1 98 LYS HG2 1 103 ILE H 5.930 . 5.930 4.672 3.074 6.184 0.254 1 0 "[ . 1 . 2]" 1
1930 1 98 LYS HG2 1 103 ILE HG13 5.840 . 5.840 4.972 2.855 5.943 0.103 19 0 "[ . 1 . 2]" 1
1931 1 98 LYS HG2 1 99 ILE HA 6.430 . 6.430 5.436 4.122 6.191 . 0 0 "[ . 1 . 2]" 1
1932 1 98 LYS H 1 99 ILE HB 5.680 . 5.680 4.615 4.083 5.079 . 0 0 "[ . 1 . 2]" 1
1933 1 98 LYS HB3 1 102 PHE H 5.630 . 5.630 4.485 3.775 5.119 . 0 0 "[ . 1 . 2]" 1
1934 1 98 LYS HD3 1 103 ILE HA 5.570 . 5.570 4.876 4.371 5.220 . 0 0 "[ . 1 . 2]" 1
1935 1 98 LYS HG2 1 102 PHE H 5.990 2.150 5.990 3.984 2.479 6.228 0.238 10 0 "[ . 1 . 2]" 1
1936 1 98 LYS HD3 1 102 PHE HB3 5.460 . 5.460 3.024 2.362 3.756 . 0 0 "[ . 1 . 2]" 1
1937 1 98 LYS HA 1 102 PHE HB2 5.410 . 5.410 5.045 4.059 5.435 0.025 8 0 "[ . 1 . 2]" 1
1938 1 98 LYS HA 1 99 ILE H 5.410 . 5.410 3.242 3.032 3.411 . 0 0 "[ . 1 . 2]" 1
1939 1 98 LYS HA 1 99 ILE HA 5.310 . 5.310 4.753 4.690 4.809 . 0 0 "[ . 1 . 2]" 1
1940 1 98 LYS HD3 1 103 ILE MD 5.250 . 5.250 3.193 2.546 3.942 . 0 0 "[ . 1 . 2]" 1
1941 1 98 LYS H 1 99 ILE H 5.200 . 5.200 2.619 2.178 2.687 . 0 0 "[ . 1 . 2]" 1
1942 1 98 LYS HD2 1 103 ILE MD 4.910 . 4.910 3.546 2.830 4.443 . 0 0 "[ . 1 . 2]" 1
1943 1 98 LYS HA 1 101 SER H 4.870 . 4.870 2.931 2.606 3.263 . 0 0 "[ . 1 . 2]" 1
1944 1 98 LYS HB2 1 99 ILE H 4.740 . 4.740 4.364 4.059 4.673 . 0 0 "[ . 1 . 2]" 1
1945 1 98 LYS O 1 102 PHE N . 2.700 3.300 3.385 3.271 3.463 0.163 20 0 "[ . 1 . 2]" 1
1946 1 98 LYS O 1 102 PHE H . . 2.300 2.447 2.359 2.581 0.281 16 0 "[ . 1 . 2]" 1
1947 1 99 ILE MD 1 103 ILE MD 7.840 . 7.840 4.371 1.818 6.275 . 0 0 "[ . 1 . 2]" 1
1948 1 99 ILE MD 1 131 LEU MD1 7.580 . 7.580 5.128 4.232 6.535 . 0 0 "[ . 1 . 2]" 1
1949 1 99 ILE MD 1 131 LEU QD 7.270 . 7.270 4.605 3.818 5.966 . 0 0 "[ . 1 . 2]" 1
1950 1 99 ILE HG12 1 103 ILE MD 7.010 . 7.010 4.677 2.855 6.445 . 0 0 "[ . 1 . 2]" 1
1951 1 99 ILE H 1 103 ILE MD 6.410 . 6.410 5.029 3.791 6.239 . 0 0 "[ . 1 . 2]" 1
1952 1 99 ILE HG13 1 103 ILE MD 6.350 . 6.350 4.251 2.409 5.992 . 0 0 "[ . 1 . 2]" 1
1953 1 99 ILE MD 1 100 ASP H 6.310 . 6.310 4.891 4.594 5.162 . 0 0 "[ . 1 . 2]" 1
1954 1 99 ILE HB 1 100 ASP HB3 6.030 . 6.030 5.337 4.150 6.223 0.193 7 0 "[ . 1 . 2]" 1
1955 1 99 ILE HB 1 119 PHE QD 5.930 . 5.930 5.991 4.877 6.212 0.282 2 0 "[ . 1 . 2]" 1
1956 1 99 ILE MG 1 119 PHE QE 5.820 . 5.820 3.825 2.733 4.284 . 0 0 "[ . 1 . 2]" 1
1957 1 99 ILE MG 1 103 ILE HB 5.700 . 5.700 4.296 3.290 4.999 . 0 0 "[ . 1 . 2]" 1
1958 1 99 ILE H 1 99 ILE HG13 5.640 . 5.640 3.776 2.347 4.575 . 0 0 "[ . 1 . 2]" 1
1959 1 99 ILE MG 1 119 PHE HB3 5.590 . 5.590 4.388 3.787 5.194 . 0 0 "[ . 1 . 2]" 1
1960 1 99 ILE MG 1 100 ASP HA 5.570 . 5.570 3.229 2.863 3.571 . 0 0 "[ . 1 . 2]" 1
1961 1 99 ILE H 1 99 ILE MD 5.560 . 5.560 3.990 3.550 4.350 . 0 0 "[ . 1 . 2]" 1
1962 1 99 ILE H 1 103 ILE HG13 5.530 . 5.530 5.285 4.861 5.639 0.109 9 0 "[ . 1 . 2]" 1
1963 1 99 ILE H 1 103 ILE HB 5.280 . 5.280 5.312 5.118 5.484 0.204 4 0 "[ . 1 . 2]" 1
1964 1 99 ILE HA 1 103 ILE H 5.270 . 5.270 3.812 3.475 4.103 . 0 0 "[ . 1 . 2]" 1
1965 1 99 ILE H 1 100 ASP H 5.070 . 5.070 2.881 2.797 2.978 . 0 0 "[ . 1 . 2]" 1
1966 1 99 ILE HA 1 104 HIS H 4.960 . 4.960 4.598 4.284 4.872 . 0 0 "[ . 1 . 2]" 1
1967 1 99 ILE MG 1 119 PHE QD 4.950 . 4.950 3.724 3.010 4.407 . 0 0 "[ . 1 . 2]" 1
1968 1 99 ILE HA 1 103 ILE HB 4.920 . 4.920 2.785 2.420 3.078 . 0 0 "[ . 1 . 2]" 1
1969 1 99 ILE HA 1 103 ILE MD 4.900 . 4.900 3.175 1.865 4.383 . 0 0 "[ . 1 . 2]" 1
1970 1 99 ILE MG 1 100 ASP H 4.690 . 4.690 2.361 1.695 3.195 . 0 0 "[ . 1 . 2]" 1
1971 1 99 ILE HB 1 100 ASP H 4.510 . 4.510 3.579 2.683 4.107 . 0 0 "[ . 1 . 2]" 1
1972 1 99 ILE MG 1 104 HIS HD1 4.500 . 4.500 3.922 2.496 4.510 0.010 16 0 "[ . 1 . 2]" 1
1973 1 100 ASP HA 1 104 HIS H 6.060 . 6.060 2.866 2.266 3.384 . 0 0 "[ . 1 . 2]" 1
1974 1 100 ASP H 1 104 HIS H 6.060 . 6.060 5.017 4.604 5.393 . 0 0 "[ . 1 . 2]" 1
1975 1 100 ASP HB3 1 119 PHE HB2 5.790 . 5.790 4.029 3.226 5.213 . 0 0 "[ . 1 . 2]" 1
1976 1 100 ASP HA 1 102 PHE H 5.600 . 5.600 4.345 3.534 4.706 . 0 0 "[ . 1 . 2]" 1
1977 1 100 ASP H 1 101 SER HB3 5.560 . 5.560 4.750 4.201 5.469 . 0 0 "[ . 1 . 2]" 1
1978 1 100 ASP HA 1 104 HIS HB2 5.400 . 5.400 2.550 1.949 3.210 . 0 0 "[ . 1 . 2]" 1
1979 1 100 ASP HB3 1 119 PHE QD 5.380 . 5.380 3.967 2.595 5.451 0.071 3 0 "[ . 1 . 2]" 1
1980 1 100 ASP H 1 102 PHE H 5.240 . 5.240 4.295 3.728 4.673 . 0 0 "[ . 1 . 2]" 1
1981 1 100 ASP H 1 101 SER H 4.980 . 4.980 2.109 1.787 2.415 . 0 0 "[ . 1 . 2]" 1
1982 1 100 ASP HB3 1 101 SER H 4.290 . 4.290 4.047 3.080 4.494 0.204 16 0 "[ . 1 . 2]" 1
1983 1 100 ASP HA 1 101 SER H 4.210 . 4.210 3.526 3.454 3.600 . 0 0 "[ . 1 . 2]" 1
1984 1 101 SER HA 1 105 VAL QG 6.410 . 6.410 3.659 2.637 4.406 . 0 0 "[ . 1 . 2]" 1
1985 1 101 SER H 1 103 ILE H 5.740 . 5.740 4.107 3.909 4.254 . 0 0 "[ . 1 . 2]" 1
1986 1 101 SER HA 1 105 VAL MG1 5.580 . 5.580 5.057 4.376 5.621 0.041 14 0 "[ . 1 . 2]" 1
1987 1 101 SER HA 1 102 PHE H 5.390 . 5.390 3.650 3.409 3.725 . 0 0 "[ . 1 . 2]" 1
1988 1 101 SER HB2 1 102 PHE H 5.270 . 5.270 3.946 3.707 4.031 . 0 0 "[ . 1 . 2]" 1
1989 1 101 SER H 1 102 PHE H 5.040 . 5.040 2.856 2.552 3.039 . 0 0 "[ . 1 . 2]" 1
1990 1 102 PHE QD 1 103 ILE HA 6.290 . 6.290 3.899 3.545 4.200 . 0 0 "[ . 1 . 2]" 1
1991 1 102 PHE H 1 104 HIS H 6.190 . 6.190 3.931 3.091 4.273 . 0 0 "[ . 1 . 2]" 1
1992 1 102 PHE QD 1 103 ILE H 5.810 . 5.810 4.468 3.955 4.755 . 0 0 "[ . 1 . 2]" 1
1993 1 102 PHE H 1 103 ILE HB 5.690 . 5.690 4.221 3.950 4.353 . 0 0 "[ . 1 . 2]" 1
1994 1 102 PHE HB2 1 103 ILE H 5.650 . 5.650 4.140 3.683 4.360 . 0 0 "[ . 1 . 2]" 1
1995 1 102 PHE HA 1 105 VAL MG1 5.640 . 5.640 2.782 1.646 3.890 0.004 3 0 "[ . 1 . 2]" 1
1996 1 102 PHE HB3 1 103 ILE H 5.570 . 5.570 3.169 2.565 3.478 . 0 0 "[ . 1 . 2]" 1
1997 1 102 PHE H 1 103 ILE H 5.160 . 5.160 2.013 1.963 2.065 . 0 0 "[ . 1 . 2]" 1
1998 1 102 PHE HA 1 105 VAL HB 4.930 . 4.930 2.615 2.116 3.252 . 0 0 "[ . 1 . 2]" 1
1999 1 102 PHE HA 1 105 VAL QG 4.290 . 4.290 2.196 1.645 2.851 0.005 3 0 "[ . 1 . 2]" 1
2000 1 102 PHE O 1 106 GLU N . 2.700 3.300 3.298 3.182 3.363 0.063 9 0 "[ . 1 . 2]" 1
2001 1 102 PHE O 1 106 GLU H . . 2.300 2.356 2.220 2.423 0.123 9 0 "[ . 1 . 2]" 1
2002 1 103 ILE MG 1 107 VAL MG1 7.340 . 7.340 4.578 3.752 5.016 . 0 0 "[ . 1 . 2]" 1
2003 1 103 ILE MG 1 104 HIS HB3 6.990 . 6.990 4.865 4.671 4.995 . 0 0 "[ . 1 . 2]" 1
2004 1 103 ILE H 1 104 HIS H 6.070 . 6.070 2.739 2.724 2.778 . 0 0 "[ . 1 . 2]" 1
2005 1 103 ILE HB 1 105 VAL H 5.740 . 5.740 4.642 4.569 4.722 . 0 0 "[ . 1 . 2]" 1
2006 1 103 ILE HG12 1 104 HIS H 5.620 . 5.620 4.837 4.401 5.176 . 0 0 "[ . 1 . 2]" 1
2007 1 103 ILE HA 1 106 GLU HB2 5.570 . 5.570 4.701 4.323 5.020 . 0 0 "[ . 1 . 2]" 1
2008 1 103 ILE HG13 1 104 HIS H 5.060 . 5.060 4.683 4.468 4.963 . 0 0 "[ . 1 . 2]" 1
2009 1 103 ILE MG 1 107 VAL MG2 5.040 . 5.040 3.464 2.660 4.995 . 0 0 "[ . 1 . 2]" 1
2010 1 103 ILE HA 1 104 HIS H 4.780 . 4.780 3.682 3.669 3.690 . 0 0 "[ . 1 . 2]" 1
2011 1 103 ILE MG 1 104 HIS H 4.530 . 4.530 3.217 3.113 3.298 . 0 0 "[ . 1 . 2]" 1
2012 1 103 ILE HB 1 104 HIS H 4.500 . 4.500 2.576 2.494 2.662 . 0 0 "[ . 1 . 2]" 1
2013 1 103 ILE O 1 107 VAL N . 2.700 3.300 3.513 3.456 3.563 0.263 3 0 "[ . 1 . 2]" 1
2014 1 103 ILE O 1 107 VAL H . . 2.300 2.542 2.486 2.592 0.292 3 0 "[ . 1 . 2]" 1
2015 1 104 HIS H 1 116 LEU MD1 7.850 . 7.850 5.543 4.823 7.003 . 0 0 "[ . 1 . 2]" 1
2016 1 104 HIS H 1 105 VAL QG 6.770 . 6.770 3.991 3.539 4.381 . 0 0 "[ . 1 . 2]" 1
2017 1 104 HIS H 1 108 TYR H 6.300 . 6.300 5.821 5.662 5.928 . 0 0 "[ . 1 . 2]" 1
2018 1 104 HIS HB2 1 105 VAL H 5.960 . 5.960 3.781 3.695 3.850 . 0 0 "[ . 1 . 2]" 1
2019 1 104 HIS HA 1 107 VAL HA 5.930 . 5.930 5.165 5.000 5.495 . 0 0 "[ . 1 . 2]" 1
2020 1 104 HIS HA 1 105 VAL H 5.860 . 5.860 3.350 3.310 3.395 . 0 0 "[ . 1 . 2]" 1
2021 1 104 HIS HB3 1 116 LEU MD2 5.850 . 5.850 3.718 1.828 4.776 . 0 0 "[ . 1 . 2]" 1
2022 1 104 HIS H 1 105 VAL H 5.590 . 5.590 2.549 2.474 2.604 . 0 0 "[ . 1 . 2]" 1
2023 1 104 HIS HA 1 108 TYR H 5.270 . 5.270 3.654 3.420 3.754 . 0 0 "[ . 1 . 2]" 1
2024 1 104 HIS HB3 1 105 VAL H 5.210 . 5.210 4.307 4.190 4.387 . 0 0 "[ . 1 . 2]" 1
2025 1 104 HIS HA 1 107 VAL MG2 5.140 . 5.140 3.347 2.608 4.741 . 0 0 "[ . 1 . 2]" 1
2026 1 104 HIS HA 1 107 VAL MG1 5.120 . 5.120 3.407 2.160 3.956 . 0 0 "[ . 1 . 2]" 1
2027 1 104 HIS HA 1 107 VAL H 4.930 . 4.930 3.076 2.971 3.262 . 0 0 "[ . 1 . 2]" 1
2028 1 104 HIS HA 1 107 VAL HB 4.780 . 4.780 2.694 2.302 3.716 . 0 0 "[ . 1 . 2]" 1
2029 1 104 HIS QB 1 104 HIS HD1 3.500 . 3.500 2.512 2.446 2.552 . 0 0 "[ . 1 . 2]" 1
2030 1 104 HIS O 1 108 TYR N . 2.700 3.300 3.247 3.142 3.304 0.004 11 0 "[ . 1 . 2]" 1
2031 1 104 HIS O 1 108 TYR H . . 2.300 2.303 2.183 2.394 0.094 5 0 "[ . 1 . 2]" 1
2032 1 105 VAL MG2 1 106 GLU HG3 7.560 . 7.560 6.883 6.225 7.512 . 0 0 "[ . 1 . 2]" 1
2033 1 105 VAL MG2 1 107 VAL H 6.400 . 6.400 5.399 5.338 5.491 . 0 0 "[ . 1 . 2]" 1
2034 1 105 VAL QG 1 108 TYR H 6.300 . 6.300 4.365 4.241 4.485 . 0 0 "[ . 1 . 2]" 1
2035 1 105 VAL HA 1 109 LYS H 6.120 . 6.120 3.996 3.653 4.293 . 0 0 "[ . 1 . 2]" 1
2036 1 105 VAL QG 1 109 LYS HG2 5.830 . 5.830 4.207 2.420 4.478 . 0 0 "[ . 1 . 2]" 1
2037 1 105 VAL QG 1 107 VAL H 5.800 . 5.800 4.342 4.034 4.610 . 0 0 "[ . 1 . 2]" 1
2038 1 105 VAL MG2 1 109 LYS QE 5.680 . 5.680 3.493 2.420 4.555 . 0 0 "[ . 1 . 2]" 1
2039 1 105 VAL QG 1 106 GLU HA 5.670 . 5.670 3.070 2.857 3.355 . 0 0 "[ . 1 . 2]" 1
2040 1 105 VAL QG 1 109 LYS QE 5.500 . 5.500 2.552 2.389 2.832 . 0 0 "[ . 1 . 2]" 1
2041 1 105 VAL H 1 107 VAL H 5.440 . 5.440 3.729 3.639 3.815 . 0 0 "[ . 1 . 2]" 1
2042 1 105 VAL MG1 1 109 LYS HE2 5.420 . 5.420 3.575 2.682 5.095 . 0 0 "[ . 1 . 2]" 1
2043 1 105 VAL HA 1 109 LYS HD2 5.890 . 5.890 5.455 5.302 6.211 0.321 7 0 "[ . 1 . 2]" 1
2044 1 105 VAL HB 1 106 GLU H 5.350 . 5.350 3.226 2.537 3.890 . 0 0 "[ . 1 . 2]" 1
2045 1 105 VAL H 1 106 GLU H 5.290 . 5.290 2.274 2.126 2.448 . 0 0 "[ . 1 . 2]" 1
2046 1 105 VAL HA 1 108 TYR QD 5.280 . 5.280 4.314 3.986 4.653 . 0 0 "[ . 1 . 2]" 1
2047 1 105 VAL MG1 1 106 GLU H 5.240 . 5.240 2.697 1.896 3.440 . 0 0 "[ . 1 . 2]" 1
2048 1 105 VAL QG 1 106 GLU H 5.220 . 5.220 2.599 1.893 3.221 . 0 0 "[ . 1 . 2]" 1
2049 1 105 VAL HA 1 106 GLU H 5.210 . 5.210 3.600 3.565 3.623 . 0 0 "[ . 1 . 2]" 1
2050 1 105 VAL HA 1 108 TYR H 5.100 . 5.100 3.488 3.283 3.732 . 0 0 "[ . 1 . 2]" 1
2051 1 105 VAL HA 1 108 TYR HB2 4.930 . 4.930 3.712 3.310 4.003 . 0 0 "[ . 1 . 2]" 1
2052 1 105 VAL HA 1 109 LYS HE2 4.930 . 4.930 5.052 5.030 5.075 0.145 15 0 "[ . 1 . 2]" 1
2053 1 105 VAL HA 1 109 LYS HD3 4.910 . 4.910 4.134 3.963 4.706 . 0 0 "[ . 1 . 2]" 1
2054 1 105 VAL MG2 1 106 GLU HA 4.880 . 4.880 4.805 4.133 5.341 0.461 8 0 "[ . 1 . 2]" 1
2055 1 105 VAL MG2 1 109 LYS HE2 4.770 . 4.770 3.651 2.489 4.791 0.021 9 0 "[ . 1 . 2]" 1
2056 1 105 VAL QG 1 109 LYS HE2 4.480 . 4.480 2.677 2.470 2.906 . 0 0 "[ . 1 . 2]" 1
2057 1 105 VAL O 1 109 LYS N . 2.700 3.300 3.115 3.000 3.234 . 0 0 "[ . 1 . 2]" 1
2058 1 105 VAL O 1 109 LYS H . . 2.300 2.127 2.011 2.250 . 0 0 "[ . 1 . 2]" 1
2059 1 106 GLU HA 1 107 VAL HB 6.160 . 6.160 5.769 5.686 5.827 . 0 0 "[ . 1 . 2]" 1
2060 1 106 GLU H 1 107 VAL HA 5.640 . 5.640 5.127 5.064 5.181 . 0 0 "[ . 1 . 2]" 1
2061 1 106 GLU H 1 107 VAL H 5.630 . 5.630 2.591 2.494 2.686 . 0 0 "[ . 1 . 2]" 1
2062 1 106 GLU HA 1 110 LEU MD1 5.560 . 5.560 4.747 4.593 4.904 . 0 0 "[ . 1 . 2]" 1
2063 1 106 GLU HB2 1 109 LYS HB2 5.410 . 5.410 5.510 5.395 5.616 0.206 4 0 "[ . 1 . 2]" 1
2064 1 106 GLU HA 1 110 LEU HB2 5.390 . 5.390 5.573 5.482 5.687 0.297 4 0 "[ . 1 . 2]" 1
2065 1 106 GLU H 1 106 GLU HG3 5.370 . 5.370 4.510 4.432 4.540 . 0 0 "[ . 1 . 2]" 1
2066 1 106 GLU HB2 1 107 VAL H 5.190 . 5.190 3.998 3.949 4.063 . 0 0 "[ . 1 . 2]" 1
2067 1 106 GLU HA 1 109 LYS HG2 5.170 . 5.170 4.986 3.849 5.130 . 0 0 "[ . 1 . 2]" 1
2068 1 106 GLU HA 1 108 TYR H 5.080 . 5.080 4.631 4.478 4.785 . 0 0 "[ . 1 . 2]" 1
2069 1 106 GLU HG3 1 107 VAL H 5.070 . 5.070 4.596 3.924 4.944 . 0 0 "[ . 1 . 2]" 1
2070 1 106 GLU HA 1 110 LEU H 4.930 . 4.930 4.152 4.015 4.319 . 0 0 "[ . 1 . 2]" 1
2071 1 106 GLU HA 1 109 LYS HB3 4.590 . 4.590 4.340 4.166 4.714 0.124 7 0 "[ . 1 . 2]" 1
2072 1 106 GLU HA 1 109 LYS HB2 4.560 . 4.560 3.016 2.903 3.134 . 0 0 "[ . 1 . 2]" 1
2073 1 106 GLU HA 1 109 LYS H 4.550 . 4.550 3.623 3.534 3.705 . 0 0 "[ . 1 . 2]" 1
2074 1 106 GLU O 1 110 LEU N . 2.700 3.300 3.121 3.033 3.259 . 0 0 "[ . 1 . 2]" 1
2075 1 106 GLU O 1 110 LEU H . . 2.300 2.172 2.090 2.302 0.002 4 0 "[ . 1 . 2]" 1
2076 1 107 VAL MG1 1 111 TYR QE 8.040 . 8.040 6.183 5.602 7.228 . 0 0 "[ . 1 . 2]" 1
2077 1 107 VAL MG2 1 116 LEU MD2 7.540 . 7.540 5.621 4.931 6.460 . 0 0 "[ . 1 . 2]" 1
2078 1 107 VAL MG2 1 111 TYR QE 7.430 . 7.430 6.101 4.838 6.728 . 0 0 "[ . 1 . 2]" 1
2079 1 107 VAL MG2 1 111 TYR QD 6.730 . 6.730 5.115 3.532 5.839 . 0 0 "[ . 1 . 2]" 1
2080 1 107 VAL MG1 1 116 LEU HB3 6.500 . 6.500 6.726 6.520 6.822 0.322 1 0 "[ . 1 . 2]" 1
2081 1 107 VAL MG1 1 111 TYR QD 6.360 . 6.360 4.638 4.087 5.716 . 0 0 "[ . 1 . 2]" 1
2082 1 107 VAL HA 1 108 TYR H 6.280 . 6.280 3.657 3.633 3.670 . 0 0 "[ . 1 . 2]" 1
2083 1 107 VAL MG1 1 108 TYR HB2 6.070 . 6.070 4.050 3.149 4.445 . 0 0 "[ . 1 . 2]" 1
2084 1 107 VAL HA 1 111 TYR QE 6.050 . 6.050 6.213 6.131 6.295 0.245 7 0 "[ . 1 . 2]" 1
2085 1 107 VAL H 1 109 LYS H 5.930 . 5.930 4.450 4.394 4.490 . 0 0 "[ . 1 . 2]" 1
2086 1 107 VAL HA 1 110 LEU HB3 5.650 . 5.650 4.357 4.102 4.546 . 0 0 "[ . 1 . 2]" 1
2087 1 107 VAL H 1 108 TYR H 5.570 . 5.570 2.769 2.610 2.868 . 0 0 "[ . 1 . 2]" 1
2088 1 107 VAL H 1 110 LEU HG 5.560 . 5.560 5.577 5.464 5.630 0.070 4 0 "[ . 1 . 2]" 1
2089 1 107 VAL MG1 1 108 TYR H 5.510 . 5.510 2.884 1.765 3.362 . 0 0 "[ . 1 . 2]" 1
2090 1 107 VAL MG2 1 108 TYR H 5.510 . 5.510 4.008 3.938 4.187 . 0 0 "[ . 1 . 2]" 1
2091 1 107 VAL HA 1 110 LEU HB2 5.340 . 5.340 2.710 2.451 2.888 . 0 0 "[ . 1 . 2]" 1
2092 1 107 VAL HA 1 111 TYR H 5.170 . 5.170 4.264 4.091 4.352 . 0 0 "[ . 1 . 2]" 1
2093 1 107 VAL HA 1 110 LEU HG 5.120 . 5.120 3.900 3.629 4.063 . 0 0 "[ . 1 . 2]" 1
2094 1 107 VAL HA 1 111 TYR QD 5.080 . 5.080 4.933 4.844 5.072 . 0 0 "[ . 1 . 2]" 1
2095 1 107 VAL MG1 1 114 ALA MB 4.820 . 4.820 3.027 2.785 3.414 . 0 0 "[ . 1 . 2]" 1
2096 1 107 VAL HA 1 109 LYS H 4.690 . 4.690 4.726 4.594 4.791 0.101 7 0 "[ . 1 . 2]" 1
2097 1 107 VAL HB 1 108 TYR H 4.670 . 4.670 2.936 2.510 3.921 . 0 0 "[ . 1 . 2]" 1
2098 1 107 VAL HA 1 110 LEU H 4.580 . 4.580 3.539 3.319 3.685 . 0 0 "[ . 1 . 2]" 1
2099 1 107 VAL O 1 111 TYR N . 2.700 3.300 3.273 3.162 3.347 0.047 14 0 "[ . 1 . 2]" 1
2100 1 107 VAL O 1 111 TYR H . . 2.300 2.486 2.376 2.560 0.260 16 0 "[ . 1 . 2]" 1
2101 1 108 TYR HB2 1 116 LEU MD1 7.360 . 7.360 3.899 2.560 5.679 . 0 0 "[ . 1 . 2]" 1
2102 1 108 TYR QE 1 114 ALA H 6.540 . 6.540 6.112 5.468 6.353 . 0 0 "[ . 1 . 2]" 1
2103 1 108 TYR QD 1 109 LYS HA 6.270 . 6.270 3.333 3.256 3.387 . 0 0 "[ . 1 . 2]" 1
2104 1 108 TYR HA 1 109 LYS HD2 6.270 . 6.270 6.207 6.111 6.558 0.288 7 0 "[ . 1 . 2]" 1
2105 1 108 TYR H 1 110 LEU HG 6.210 . 6.210 6.212 6.142 6.257 0.047 7 0 "[ . 1 . 2]" 1
2106 1 108 TYR QE 1 112 PRO HA 6.140 . 6.140 4.143 3.955 4.527 . 0 0 "[ . 1 . 2]" 1
2107 1 108 TYR QD 1 114 ALA H 6.110 . 6.110 5.416 5.040 5.647 . 0 0 "[ . 1 . 2]" 1
2108 1 108 TYR HA 1 114 ALA H 6.010 . 6.010 5.127 5.014 5.252 . 0 0 "[ . 1 . 2]" 1
2109 1 108 TYR H 1 110 LEU HB2 5.890 . 5.890 5.139 5.020 5.256 . 0 0 "[ . 1 . 2]" 1
2110 1 108 TYR HB2 1 114 ALA MB 5.370 . 5.370 4.822 4.674 4.988 . 0 0 "[ . 1 . 2]" 1
2111 1 108 TYR H 1 109 LYS HB2 5.750 . 5.750 4.883 4.833 5.124 . 0 0 "[ . 1 . 2]" 1
2112 1 108 TYR HA 1 108 TYR QE 5.710 . 5.710 4.655 4.632 4.678 . 0 0 "[ . 1 . 2]" 1
2113 1 108 TYR QD 1 112 PRO HA 5.590 . 5.590 4.235 4.012 4.679 . 0 0 "[ . 1 . 2]" 1
2114 1 108 TYR HB2 1 109 LYS H 5.490 . 5.490 3.974 3.950 3.992 . 0 0 "[ . 1 . 2]" 1
2115 1 108 TYR HA 1 110 LEU H 5.340 . 5.340 4.434 4.385 4.498 . 0 0 "[ . 1 . 2]" 1
2116 1 108 TYR QE 1 115 GLU HA 5.300 . 5.300 4.272 3.777 4.745 . 0 0 "[ . 1 . 2]" 1
2117 1 108 TYR H 1 109 LYS H 5.250 . 5.250 2.975 2.949 2.994 . 0 0 "[ . 1 . 2]" 1
2118 1 108 TYR QD 1 114 ALA MB 5.200 . 5.200 3.882 3.624 4.099 . 0 0 "[ . 1 . 2]" 1
2119 1 108 TYR HA 1 109 LYS H 5.170 . 5.170 3.685 3.673 3.691 . 0 0 "[ . 1 . 2]" 1
2120 1 108 TYR HA 1 109 LYS HA 5.090 . 5.090 4.748 4.714 4.767 . 0 0 "[ . 1 . 2]" 1
2121 1 108 TYR H 1 114 ALA MB 5.030 . 5.030 5.197 5.107 5.249 0.219 1 0 "[ . 1 . 2]" 1
2122 1 108 TYR HA 1 111 TYR H 4.970 . 4.970 4.292 4.190 4.426 . 0 0 "[ . 1 . 2]" 1
2123 1 108 TYR HA 1 114 ALA MB 4.840 . 4.840 3.602 3.476 3.822 . 0 0 "[ . 1 . 2]" 1
2124 1 109 LYS HB2 1 110 LEU MD1 6.000 . 6.000 5.630 5.233 5.764 . 0 0 "[ . 1 . 2]" 1
2125 1 109 LYS H 1 110 LEU HG 5.920 . 5.920 5.093 5.037 5.176 . 0 0 "[ . 1 . 2]" 1
2126 1 109 LYS HG3 1 110 LEU H 5.720 . 5.720 5.103 5.078 5.189 . 0 0 "[ . 1 . 2]" 1
2127 1 109 LYS HB2 1 110 LEU MD2 5.510 . 5.510 5.358 4.757 5.476 . 0 0 "[ . 1 . 2]" 1
2128 1 109 LYS H 1 109 LYS HE2 5.490 . 5.490 5.029 4.876 5.137 . 0 0 "[ . 1 . 2]" 1
2129 1 109 LYS H 1 109 LYS HG3 5.440 . 5.440 4.143 3.835 4.208 . 0 0 "[ . 1 . 2]" 1
2130 1 109 LYS H 1 109 LYS HG2 . . 4.930 4.238 2.386 4.382 . 0 0 "[ . 1 . 2]" 1
2131 1 109 LYS H 1 111 TYR H 5.220 . 5.220 5.359 5.282 5.460 0.240 9 0 "[ . 1 . 2]" 1
2132 1 109 LYS HA 1 109 LYS HD2 5.080 . 5.080 2.728 2.128 2.846 . 0 0 "[ . 1 . 2]" 1
2133 1 109 LYS H 1 110 LEU H 5.050 . 5.050 2.788 2.749 2.831 . 0 0 "[ . 1 . 2]" 1
2134 1 109 LYS HB3 1 110 LEU H 4.740 . 4.740 3.204 3.134 3.653 . 0 0 "[ . 1 . 2]" 1
2135 1 109 LYS HA 1 110 LEU H 4.730 . 4.730 3.614 3.608 3.622 . 0 0 "[ . 1 . 2]" 1
2136 1 109 LYS HB2 1 109 LYS HD2 4.230 . 4.230 3.488 3.446 3.678 . 0 0 "[ . 1 . 2]" 1
2137 1 109 LYS HB2 1 110 LEU H 4.220 . 4.220 3.126 2.712 3.198 . 0 0 "[ . 1 . 2]" 1
2138 1 110 LEU MD1 1 111 TYR QE 6.060 . 6.060 3.311 3.188 3.494 . 0 0 "[ . 1 . 2]" 1
2139 1 110 LEU HB2 1 111 TYR QD 5.680 . 5.680 3.151 3.005 3.358 . 0 0 "[ . 1 . 2]" 1
2140 1 110 LEU H 1 111 TYR HB2 5.440 . 5.440 5.853 5.821 5.881 0.441 17 0 "[ . 1 . 2]" 1
2141 1 110 LEU H 1 110 LEU MD1 5.440 . 5.440 3.717 3.682 3.759 . 0 0 "[ . 1 . 2]" 1
2142 1 110 LEU H 1 110 LEU MD2 5.340 . 5.340 3.806 3.765 3.852 . 0 0 "[ . 1 . 2]" 1
2143 1 110 LEU H 1 110 LEU HG 4.900 . 4.900 2.677 2.622 2.733 . 0 0 "[ . 1 . 2]" 1
2144 1 110 LEU H 1 111 TYR H 4.800 . 4.800 3.396 3.375 3.431 . 0 0 "[ . 1 . 2]" 1
2145 1 110 LEU HB3 1 111 TYR H 4.700 . 4.700 2.593 2.460 2.711 . 0 0 "[ . 1 . 2]" 1
2146 1 110 LEU HA 1 111 TYR H 4.590 . 4.590 3.714 3.700 3.747 . 0 0 "[ . 1 . 2]" 1
2147 1 110 LEU HB2 1 111 TYR H 4.510 . 4.510 2.355 2.315 2.449 . 0 0 "[ . 1 . 2]" 1
2148 1 110 LEU HA 1 110 LEU MD2 4.290 . 4.290 2.157 2.080 2.206 . 0 0 "[ . 1 . 2]" 1
2149 1 111 TYR QD 1 114 ALA H 6.340 . 6.340 5.586 5.391 5.963 . 0 0 "[ . 1 . 2]" 1
2150 1 111 TYR HA 1 114 ALA H 6.140 . 6.140 5.445 5.239 5.554 . 0 0 "[ . 1 . 2]" 1
2151 1 111 TYR QD 1 114 ALA MB 6.070 . 6.070 5.282 4.907 5.578 . 0 0 "[ . 1 . 2]" 1
2152 1 111 TYR H 1 114 ALA H 5.940 . 5.940 5.265 5.083 5.546 . 0 0 "[ . 1 . 2]" 1
2153 1 111 TYR QD 1 113 GLN H 5.880 . 5.880 4.413 4.287 4.567 . 0 0 "[ . 1 . 2]" 1
2154 1 111 TYR HB2 1 113 GLN H 5.850 . 5.850 3.577 3.446 3.703 . 0 0 "[ . 1 . 2]" 1
2155 1 111 TYR HB3 1 114 ALA H 5.690 . 5.690 4.066 3.769 4.385 . 0 0 "[ . 1 . 2]" 1
2156 1 111 TYR H 1 111 TYR QD 5.670 . 5.670 2.473 2.254 2.719 . 0 0 "[ . 1 . 2]" 1
2157 1 111 TYR HB3 1 113 GLN H 5.510 . 5.510 2.591 2.508 2.657 . 0 0 "[ . 1 . 2]" 1
2158 1 111 TYR HA 1 113 GLN H 5.510 . 5.510 3.878 3.805 4.055 . 0 0 "[ . 1 . 2]" 1
2159 1 111 TYR H 1 112 PRO HD2 5.430 . 5.430 4.934 4.896 4.994 . 0 0 "[ . 1 . 2]" 1
2160 1 111 TYR HA 1 112 PRO HD2 5.260 . 5.260 2.373 2.268 2.509 . 0 0 "[ . 1 . 2]" 1
2161 1 111 TYR HB3 1 114 ALA MB 5.250 . 5.250 4.908 4.472 5.140 . 0 0 "[ . 1 . 2]" 1
2162 1 111 TYR HB2 1 114 ALA MB 5.240 . 5.240 4.046 3.574 4.350 . 0 0 "[ . 1 . 2]" 1
2163 1 111 TYR HA 1 112 PRO HD3 5.230 . 5.230 1.854 1.765 1.897 . 0 0 "[ . 1 . 2]" 1
2164 1 112 PRO HB2 1 113 GLN H 6.150 . 6.150 4.065 4.010 4.126 . 0 0 "[ . 1 . 2]" 1
2165 1 112 PRO HA 1 114 ALA H 5.440 . 5.440 3.905 3.282 4.005 . 0 0 "[ . 1 . 2]" 1
2166 1 112 PRO HD2 1 114 ALA H 5.430 . 5.430 5.015 4.658 5.191 . 0 0 "[ . 1 . 2]" 1
2167 1 112 PRO HD3 1 113 GLN H 5.340 . 5.340 3.933 3.802 4.007 . 0 0 "[ . 1 . 2]" 1
2168 1 112 PRO HA 1 113 GLN H 5.270 . 5.270 3.459 3.428 3.505 . 0 0 "[ . 1 . 2]" 1
2169 1 112 PRO HD2 1 113 GLN H 5.270 . 5.270 2.598 2.406 2.711 . 0 0 "[ . 1 . 2]" 1
2170 1 112 PRO HG3 1 113 GLN H 5.100 . 5.100 4.575 4.452 4.638 . 0 0 "[ . 1 . 2]" 1
2171 1 112 PRO HG2 1 113 GLN H 4.980 . 4.980 3.318 3.178 3.412 . 0 0 "[ . 1 . 2]" 1
2172 1 113 GLN H 1 114 ALA MB 6.070 . 6.070 4.316 4.060 4.414 . 0 0 "[ . 1 . 2]" 1
2173 1 113 GLN H 1 113 GLN HG3 5.500 . 5.500 3.838 3.794 3.912 . 0 0 "[ . 1 . 2]" 1
2174 1 113 GLN HG3 1 114 ALA H 5.490 . 5.490 5.269 5.142 5.747 0.257 16 0 "[ . 1 . 2]" 1
2175 1 113 GLN H 1 114 ALA H 5.200 . 5.200 2.615 2.428 2.662 . 0 0 "[ . 1 . 2]" 1
2176 1 114 ALA HA 1 116 LEU MD1 7.100 . 7.100 5.561 4.665 6.242 . 0 0 "[ . 1 . 2]" 1
2177 1 114 ALA MB 1 116 LEU MD2 6.920 . 6.920 3.334 2.437 5.103 . 0 0 "[ . 1 . 2]" 1
2178 1 114 ALA MB 1 116 LEU HG 6.130 . 6.130 4.240 3.142 6.237 0.107 11 0 "[ . 1 . 2]" 1
2179 1 114 ALA MB 1 115 GLU HA 5.320 . 5.320 3.931 3.868 3.990 . 0 0 "[ . 1 . 2]" 1
2180 1 114 ALA MB 1 116 LEU H 4.870 . 4.870 4.998 4.906 5.196 0.326 11 0 "[ . 1 . 2]" 1
2181 1 114 ALA HA 1 115 GLU HG2 4.860 . 4.860 4.877 3.801 4.948 0.088 14 0 "[ . 1 . 2]" 1
2182 1 114 ALA MB 1 115 GLU H 4.780 . 4.780 2.822 2.752 2.944 . 0 0 "[ . 1 . 2]" 1
2183 1 114 ALA HA 1 115 GLU H 4.680 . 4.680 2.313 2.298 2.342 . 0 0 "[ . 1 . 2]" 1
2184 1 115 GLU H 1 116 LEU H 5.680 . 5.680 4.412 4.340 4.499 . 0 0 "[ . 1 . 2]" 1
2185 1 115 GLU HG3 1 116 LEU H 5.500 . 5.500 5.171 3.975 5.326 . 0 0 "[ . 1 . 2]" 1
2186 1 115 GLU HB2 1 116 LEU H 5.230 . 5.230 3.973 2.567 4.158 . 0 0 "[ . 1 . 2]" 1
2187 1 115 GLU HA 1 116 LEU H 3.960 . 3.960 2.308 2.289 2.437 . 0 0 "[ . 1 . 2]" 1
2188 1 116 LEU MD2 1 117 PRO HD2 6.350 2.350 6.850 3.449 2.428 4.782 . 0 0 "[ . 1 . 2]" 1
2189 1 116 LEU MD1 1 117 PRO HD2 6.310 2.450 6.810 3.368 2.601 3.912 . 0 0 "[ . 1 . 2]" 1
2190 1 116 LEU H 1 116 LEU HG 5.430 . 5.430 3.790 2.929 4.740 . 0 0 "[ . 1 . 2]" 1
2191 1 117 PRO HA 1 118 LYS HG3 5.890 . 6.390 4.755 3.666 5.509 . 0 0 "[ . 1 . 2]" 1
2192 1 117 PRO HA 1 118 LYS QE 5.540 . 6.040 4.989 4.742 5.332 . 0 0 "[ . 1 . 2]" 1
2193 1 117 PRO HA 1 118 LYS H 4.510 . 5.010 2.974 2.908 3.028 . 0 0 "[ . 1 . 2]" 1
2194 1 118 LYS HG2 1 119 PHE HA 6.760 . 6.760 6.490 6.348 6.599 . 0 0 "[ . 1 . 2]" 1
2195 1 118 LYS HG2 1 134 GLN H 6.170 . 6.170 5.957 5.386 6.552 0.382 8 0 "[ . 1 . 2]" 1
2196 1 118 LYS H 1 135 SER H 5.910 . 5.910 5.660 5.629 5.703 . 0 0 "[ . 1 . 2]" 1
2197 1 118 LYS HA 1 119 PHE HA 5.770 . 5.770 4.399 4.378 4.439 . 0 0 "[ . 1 . 2]" 1
2198 1 118 LYS H 1 135 SER HB2 5.660 . 5.660 4.329 3.951 5.549 . 0 0 "[ . 1 . 2]" 1
2199 1 118 LYS HA 1 134 GLN H 5.360 . 5.360 5.251 5.178 5.359 . 0 0 "[ . 1 . 2]" 1
2200 1 118 LYS HB2 1 134 GLN HB3 5.240 . 5.240 2.910 2.164 3.926 . 0 0 "[ . 1 . 2]" 1
2201 1 118 LYS HG2 1 119 PHE H 5.110 . 5.110 4.720 4.120 5.123 0.013 9 0 "[ . 1 . 2]" 1
2202 1 118 LYS HB3 1 134 GLN HB2 5.030 . 5.030 4.257 3.632 4.775 . 0 0 "[ . 1 . 2]" 1
2203 1 118 LYS HB2 1 119 PHE H 4.740 . 4.740 4.053 3.912 4.119 . 0 0 "[ . 1 . 2]" 1
2204 1 118 LYS HB3 1 119 PHE H 4.660 . 4.660 2.945 2.787 3.050 . 0 0 "[ . 1 . 2]" 1
2205 1 118 LYS H 1 134 GLN H 4.570 . 4.570 3.327 3.131 3.566 . 0 0 "[ . 1 . 2]" 1
2206 1 118 LYS H 1 134 GLN HB3 4.470 . 4.470 3.716 3.102 4.569 0.099 17 0 "[ . 1 . 2]" 1
2207 1 118 LYS H 1 134 GLN HB2 4.310 . 4.310 4.067 3.304 4.581 0.271 14 0 "[ . 1 . 2]" 1
2208 1 118 LYS HA 1 119 PHE H 4.090 . 4.090 2.327 2.291 2.388 . 0 0 "[ . 1 . 2]" 1
2209 1 118 LYS O 1 134 GLN N . 2.700 3.300 3.366 3.288 3.429 0.129 12 0 "[ . 1 . 2]" 1
2210 1 118 LYS N 1 134 GLN O . 2.700 3.300 3.508 3.484 3.545 0.245 13 0 "[ . 1 . 2]" 1
2211 1 118 LYS H 1 134 GLN O . . 2.300 2.516 2.484 2.562 0.262 13 0 "[ . 1 . 2]" 1
2212 1 118 LYS O 1 134 GLN H . . 2.300 2.376 2.305 2.435 0.135 12 0 "[ . 1 . 2]" 1
2213 1 119 PHE QD 1 131 LEU MD2 7.250 . 7.250 4.504 3.819 5.753 . 0 0 "[ . 1 . 2]" 1
2214 1 119 PHE QE 1 131 LEU HB2 7.060 . 7.060 6.103 2.944 7.112 0.052 7 0 "[ . 1 . 2]" 1
2215 1 119 PHE QE 1 131 LEU MD2 7.040 . 7.040 4.256 3.530 5.805 . 0 0 "[ . 1 . 2]" 1
2216 1 119 PHE HA 1 131 LEU QD 6.850 . 6.850 3.930 3.551 5.093 . 0 0 "[ . 1 . 2]" 1
2217 1 119 PHE QD 1 134 GLN H 6.190 . 6.190 4.945 3.659 5.643 . 0 0 "[ . 1 . 2]" 1
2218 1 119 PHE QD 1 120 THR H 6.150 . 6.150 4.096 2.722 4.414 . 0 0 "[ . 1 . 2]" 1
2219 1 119 PHE H 1 120 THR H 6.150 . 6.150 4.328 4.187 4.400 . 0 0 "[ . 1 . 2]" 1
2220 1 119 PHE QD 1 131 LEU HB2 6.010 . 6.010 5.355 4.253 6.024 0.014 7 0 "[ . 1 . 2]" 1
2221 1 119 PHE QD 1 132 HIS H 6.000 . 6.000 5.312 4.189 5.800 . 0 0 "[ . 1 . 2]" 1
2222 1 119 PHE HB2 1 120 THR H 5.740 . 5.740 4.307 4.088 4.615 . 0 0 "[ . 1 . 2]" 1
2223 1 119 PHE H 1 133 TYR HA 5.740 . 5.740 5.860 5.731 5.953 0.213 16 0 "[ . 1 . 2]" 1
2224 1 119 PHE HA 1 132 HIS H 5.730 . 5.730 4.940 4.619 5.335 . 0 0 "[ . 1 . 2]" 1
2225 1 119 PHE HB3 1 120 THR H 5.210 . 5.210 3.416 3.107 4.142 . 0 0 "[ . 1 . 2]" 1
2226 1 119 PHE HA 1 133 TYR HA 5.200 . 5.200 3.314 3.181 3.435 . 0 0 "[ . 1 . 2]" 1
2227 1 119 PHE QE 1 131 LEU MD1 5.040 . 5.040 3.299 1.663 3.979 . 0 0 "[ . 1 . 2]" 1
2228 1 119 PHE HA 1 132 HIS HB2 4.950 . 4.950 4.515 4.253 4.833 . 0 0 "[ . 1 . 2]" 1
2229 1 119 PHE HA 1 134 GLN H 4.930 . 4.930 3.883 3.735 4.071 . 0 0 "[ . 1 . 2]" 1
2230 1 119 PHE QD 1 131 LEU MD1 4.700 . 4.700 2.721 2.204 3.717 . 0 0 "[ . 1 . 2]" 1
2231 1 119 PHE HA 1 120 THR H 4.050 . 4.050 2.247 2.234 2.259 . 0 0 "[ . 1 . 2]" 1
2232 1 120 THR H 1 131 LEU QD 6.350 . 6.350 3.781 3.363 5.097 . 0 0 "[ . 1 . 2]" 1
2233 1 120 THR H 1 134 GLN H 5.880 . 5.880 5.076 4.760 5.236 . 0 0 "[ . 1 . 2]" 1
2234 1 120 THR H 1 131 LEU HA 5.730 . 5.730 4.964 4.628 5.295 . 0 0 "[ . 1 . 2]" 1
2235 1 120 THR H 1 133 TYR HA 5.700 . 5.700 4.150 3.892 4.330 . 0 0 "[ . 1 . 2]" 1
2236 1 120 THR H 1 121 CYS H 5.580 . 5.580 4.380 4.348 4.414 . 0 0 "[ . 1 . 2]" 1
2237 1 120 THR H 1 132 HIS HD2 5.220 . 5.220 5.301 5.260 5.354 0.134 1 0 "[ . 1 . 2]" 1
2238 1 120 THR H 1 132 HIS HB3 5.040 . 5.040 3.958 3.766 4.202 . 0 0 "[ . 1 . 2]" 1
2239 1 120 THR H 1 132 HIS H 4.710 . 4.710 3.236 2.891 3.584 . 0 0 "[ . 1 . 2]" 1
2240 1 120 THR H 1 132 HIS HB2 4.670 . 4.670 2.641 2.462 2.871 . 0 0 "[ . 1 . 2]" 1
2241 1 120 THR N 1 132 HIS O . 2.700 3.300 3.352 3.335 3.371 0.071 4 0 "[ . 1 . 2]" 1
2242 1 120 THR O 1 132 HIS N . 2.700 3.300 2.952 2.901 2.980 . 0 0 "[ . 1 . 2]" 1
2243 1 120 THR O 1 132 HIS H . . 2.300 1.977 1.905 2.004 . 0 0 "[ . 1 . 2]" 1
2244 1 120 THR H 1 132 HIS O . . 2.300 2.376 2.358 2.395 0.095 11 0 "[ . 1 . 2]" 1
2245 1 121 CYS HB3 1 131 LEU MD2 6.580 . 6.580 6.549 5.869 6.673 0.093 7 0 "[ . 1 . 2]" 1
2246 1 121 CYS HA 1 131 LEU HB3 6.210 . 6.210 5.531 4.589 6.036 . 0 0 "[ . 1 . 2]" 1
2247 1 121 CYS HA 1 130 ARG H 5.990 . 5.990 5.099 4.850 5.392 . 0 0 "[ . 1 . 2]" 1
2248 1 121 CYS HA 1 129 ILE MG 5.880 . 5.880 4.804 4.649 4.893 . 0 0 "[ . 1 . 2]" 1
2249 1 121 CYS HA 1 122 ASP HB3 5.470 . 5.470 5.066 4.926 5.186 . 0 0 "[ . 1 . 2]" 1
2250 1 121 CYS HB3 1 130 ARG H 5.460 . 5.460 5.185 4.945 5.690 0.230 9 0 "[ . 1 . 2]" 1
2251 1 121 CYS HA 1 131 LEU H 5.230 . 5.230 5.434 5.373 5.504 0.274 16 0 "[ . 1 . 2]" 1
2252 1 121 CYS HB2 1 122 ASP H 5.170 . 5.170 4.136 3.250 4.269 . 0 0 "[ . 1 . 2]" 1
2253 1 121 CYS HA 1 132 HIS H 5.100 . 5.100 3.273 3.057 3.445 . 0 0 "[ . 1 . 2]" 1
2254 1 121 CYS H 1 132 HIS H 5.090 . 5.090 5.097 5.048 5.125 0.035 8 0 "[ . 1 . 2]" 1
2255 1 121 CYS HB3 1 122 ASP H 5.090 . 5.090 3.354 3.232 3.940 . 0 0 "[ . 1 . 2]" 1
2256 1 121 CYS HA 1 131 LEU HA 4.530 . 4.530 2.891 2.691 3.067 . 0 0 "[ . 1 . 2]" 1
2257 1 121 CYS HA 1 122 ASP H 3.910 . 3.910 2.200 2.182 2.220 . 0 0 "[ . 1 . 2]" 1
2258 1 122 ASP HA 1 124 LEU MD2 6.470 . 6.470 5.564 5.251 6.052 . 0 0 "[ . 1 . 2]" 1
2259 1 122 ASP HB2 1 130 ARG H 6.040 . 6.040 5.116 4.881 5.348 . 0 0 "[ . 1 . 2]" 1
2260 1 122 ASP H 1 130 ARG HG3 5.850 . 5.850 5.464 5.174 5.815 . 0 0 "[ . 1 . 2]" 1
2261 1 122 ASP H 1 131 LEU H 5.700 . 5.700 5.160 5.075 5.235 . 0 0 "[ . 1 . 2]" 1
2262 1 122 ASP HB3 1 130 ARG HG2 5.570 . 5.570 5.243 5.140 5.366 . 0 0 "[ . 1 . 2]" 1
2263 1 122 ASP HB2 1 130 ARG HD2 5.470 . 5.470 5.576 5.509 5.683 0.213 20 0 "[ . 1 . 2]" 1
2264 1 122 ASP HB3 1 124 LEU HG 5.470 . 5.470 3.880 3.775 4.048 . 0 0 "[ . 1 . 2]" 1
2265 1 122 ASP HB3 1 130 ARG HG3 5.470 . 5.470 4.003 3.783 4.374 . 0 0 "[ . 1 . 2]" 1
2266 1 122 ASP H 1 132 HIS H 5.440 . 5.440 4.408 4.041 4.585 . 0 0 "[ . 1 . 2]" 1
2267 1 122 ASP HB2 1 123 ARG H 5.360 . 5.360 4.483 4.295 4.656 . 0 0 "[ . 1 . 2]" 1
2268 1 122 ASP HB3 1 130 ARG H 5.260 . 5.260 3.919 3.729 4.137 . 0 0 "[ . 1 . 2]" 1
2269 1 122 ASP HB2 1 130 ARG HB3 5.070 . 5.070 4.451 4.334 4.625 . 0 0 "[ . 1 . 2]" 1
2270 1 122 ASP HB3 1 130 ARG HB3 5.040 . 5.040 3.903 3.521 4.019 . 0 0 "[ . 1 . 2]" 1
2271 1 122 ASP H 1 131 LEU HA 5.000 . 5.000 3.668 3.307 3.995 . 0 0 "[ . 1 . 2]" 1
2272 1 122 ASP HB3 1 130 ARG HB2 4.990 . 4.990 2.431 2.354 2.491 . 0 0 "[ . 1 . 2]" 1
2273 1 122 ASP H 1 130 ARG HA 4.820 . 4.820 5.051 4.961 5.097 0.277 1 0 "[ . 1 . 2]" 1
2274 1 122 ASP H 1 130 ARG H 4.820 . 4.820 3.522 3.307 3.788 . 0 0 "[ . 1 . 2]" 1
2275 1 122 ASP H 1 130 ARG HB2 4.790 . 4.790 3.234 2.998 3.509 . 0 0 "[ . 1 . 2]" 1
2276 1 122 ASP HB3 1 130 ARG HD2 4.730 . 4.730 4.869 4.775 4.929 0.199 10 0 "[ . 1 . 2]" 1
2277 1 122 ASP HA 1 123 ARG H 4.240 . 4.240 2.359 2.289 2.458 . 0 0 "[ . 1 . 2]" 1
2278 1 122 ASP O 1 130 ARG N . 2.700 3.300 3.102 3.007 3.197 . 0 0 "[ . 1 . 2]" 1
2279 1 122 ASP N 1 130 ARG O . 2.700 3.300 3.233 3.105 3.299 . 0 0 "[ . 1 . 2]" 1
2280 1 122 ASP O 1 130 ARG H . . 2.300 2.149 2.077 2.253 . 0 0 "[ . 1 . 2]" 1
2281 1 122 ASP H 1 130 ARG O . . 2.300 2.286 2.133 2.363 0.063 8 0 "[ . 1 . 2]" 1
2282 1 123 ARG HD2 1 125 GLY H 6.350 . 6.350 4.235 4.171 4.629 . 0 0 "[ . 1 . 2]" 1
2283 1 123 ARG H 1 125 GLY H 6.110 . 6.110 5.629 5.491 6.060 . 0 0 "[ . 1 . 2]" 1
2284 1 123 ARG HD3 1 129 ILE HG13 6.000 . 6.000 5.556 4.818 5.770 . 0 0 "[ . 1 . 2]" 1
2285 1 123 ARG HG3 1 129 ILE HB 5.930 . 5.930 5.764 5.281 5.850 . 0 0 "[ . 1 . 2]" 1
2286 1 123 ARG HB2 1 124 LEU H 6.080 . 6.580 4.463 3.707 4.626 . 0 0 "[ . 1 . 2]" 1
2287 1 123 ARG H 1 123 ARG HG3 5.630 . 5.630 4.602 4.425 4.669 . 0 0 "[ . 1 . 2]" 1
2288 1 123 ARG HD3 1 129 ILE MG 5.620 . 5.620 5.628 5.488 5.725 0.105 13 0 "[ . 1 . 2]" 1
2289 1 123 ARG HA 1 129 ILE MD 5.410 . 5.410 2.289 2.120 2.402 . 0 0 "[ . 1 . 2]" 1
2290 1 123 ARG HB2 1 125 GLY H 5.360 . 5.360 4.883 4.798 5.300 . 0 0 "[ . 1 . 2]" 1
2291 1 123 ARG HD3 1 129 ILE HG12 5.320 . 5.320 5.357 4.303 5.503 0.183 16 0 "[ . 1 . 2]" 1
2292 1 123 ARG HA 1 129 ILE HB 5.290 . 5.290 5.631 5.602 5.662 0.372 12 0 "[ . 1 . 2]" 1
2293 1 123 ARG HA 1 130 ARG H 5.280 . 5.280 3.271 2.998 3.402 . 0 0 "[ . 1 . 2]" 1
2294 1 123 ARG HD2 1 129 ILE HG12 5.210 . 5.210 5.288 5.079 5.531 0.321 20 0 "[ . 1 . 2]" 1
2295 1 123 ARG HA 1 129 ILE HG13 5.170 . 5.170 5.258 5.221 5.340 0.170 10 0 "[ . 1 . 2]" 1
2296 1 123 ARG HG3 1 129 ILE HA 5.130 . 5.130 3.797 3.511 3.905 . 0 0 "[ . 1 . 2]" 1
2297 1 123 ARG HG3 1 124 LEU HA 5.080 . 5.580 5.310 5.229 5.888 0.308 20 0 "[ . 1 . 2]" 1
2298 1 123 ARG HD3 1 125 GLY H 5.020 . 5.020 5.080 4.984 5.208 0.188 16 0 "[ . 1 . 2]" 1
2299 1 123 ARG HA 1 129 ILE HG12 4.970 . 4.970 4.527 4.231 4.674 . 0 0 "[ . 1 . 2]" 1
2300 1 123 ARG HA 1 129 ILE MG 4.970 . 4.970 3.956 3.796 4.096 . 0 0 "[ . 1 . 2]" 1
2301 1 123 ARG HA 1 124 LEU HB2 4.890 . 4.890 4.645 4.324 4.713 . 0 0 "[ . 1 . 2]" 1
2302 1 123 ARG HA 1 129 ILE HA 4.620 . 4.620 2.860 2.766 2.935 . 0 0 "[ . 1 . 2]" 1
2303 1 123 ARG HG2 1 125 GLY H 4.550 . 4.550 2.433 2.305 2.584 . 0 0 "[ . 1 . 2]" 1
2304 1 123 ARG HB3 1 125 GLY H 4.430 . 4.430 4.474 4.300 4.535 0.105 18 0 "[ . 1 . 2]" 1
2305 1 123 ARG HA 1 124 LEU H 4.500 . 4.500 2.267 2.224 2.926 . 0 0 "[ . 1 . 2]" 1
2306 1 123 ARG HG2 1 125 GLY HA2 4.220 . 4.220 3.442 3.272 3.797 . 0 0 "[ . 1 . 2]" 1
2307 1 123 ARG HG3 1 125 GLY H 4.100 . 4.100 2.860 2.714 3.814 . 0 0 "[ . 1 . 2]" 1
2308 1 124 LEU MD1 1 125 GLY H 6.190 . 6.190 5.028 4.700 5.178 . 0 0 "[ . 1 . 2]" 1
2309 1 124 LEU MD1 1 130 ARG HD2 6.150 . 6.150 3.915 3.730 4.191 . 0 0 "[ . 1 . 2]" 1
2310 1 124 LEU MD2 1 130 ARG HD2 6.130 . 6.130 4.913 4.810 5.366 . 0 0 "[ . 1 . 2]" 1
2311 1 124 LEU MD2 1 125 GLY H 6.120 . 6.120 4.802 4.728 4.843 . 0 0 "[ . 1 . 2]" 1
2312 1 124 LEU HG 1 129 ILE H 6.080 . 6.080 5.444 5.280 5.751 . 0 0 "[ . 1 . 2]" 1
2313 1 124 LEU MD2 1 128 ASP HB3 5.940 . 5.940 4.783 4.623 4.901 . 0 0 "[ . 1 . 2]" 1
2314 1 124 LEU MD2 1 130 ARG H 5.810 . 5.810 5.332 5.169 5.489 . 0 0 "[ . 1 . 2]" 1
2315 1 124 LEU HB3 1 128 ASP H 5.760 . 5.760 5.507 5.266 5.777 0.017 9 0 "[ . 1 . 2]" 1
2316 1 124 LEU MD1 1 130 ARG H 5.750 . 5.750 4.681 4.309 4.880 . 0 0 "[ . 1 . 2]" 1
2317 1 124 LEU H 1 129 ILE HG12 6.090 . 6.590 4.737 4.608 5.222 . 0 0 "[ . 1 . 2]" 1
2318 1 124 LEU HA 1 128 ASP HB2 5.680 . 6.180 4.511 4.327 4.805 . 0 0 "[ . 1 . 2]" 1
2319 1 124 LEU HB3 1 128 ASP HA 5.610 . 5.610 5.824 5.712 5.876 0.266 10 0 "[ . 1 . 2]" 1
2320 1 124 LEU H 1 128 ASP H 5.560 . 6.060 4.855 4.646 5.029 . 0 0 "[ . 1 . 2]" 1
2321 1 124 LEU HB2 1 128 ASP HB3 5.500 . 5.500 2.271 1.943 2.672 . 0 0 "[ . 1 . 2]" 1
2322 1 124 LEU H 1 124 LEU HG 5.490 . 5.990 2.644 2.538 3.915 . 0 0 "[ . 1 . 2]" 1
2323 1 124 LEU HB2 1 128 ASP H 5.470 . 5.470 4.334 4.208 4.492 . 0 0 "[ . 1 . 2]" 1
2324 1 124 LEU HB2 1 128 ASP HB2 5.420 . 5.420 1.899 1.742 2.192 . 0 0 "[ . 1 . 2]" 1
2325 1 124 LEU HB3 1 128 ASP HB2 5.380 . 5.380 3.021 2.842 3.217 . 0 0 "[ . 1 . 2]" 1
2326 1 124 LEU MD2 1 130 ARG HB3 5.350 . 5.350 5.471 5.449 5.611 0.261 16 0 "[ . 1 . 2]" 1
2327 1 124 LEU HG 1 128 ASP HB2 5.340 . 5.340 4.302 4.092 4.599 . 0 0 "[ . 1 . 2]" 1
2328 1 124 LEU HB3 1 128 ASP HB3 5.330 . 5.330 3.573 3.393 3.700 . 0 0 "[ . 1 . 2]" 1
2329 1 124 LEU HB2 1 129 ILE HA 5.330 . 5.330 4.253 3.868 4.618 . 0 0 "[ . 1 . 2]" 1
2330 1 124 LEU H 1 130 ARG H 5.220 . 5.720 3.879 3.710 5.265 . 0 0 "[ . 1 . 2]" 1
2331 1 124 LEU HG 1 130 ARG H 5.170 . 5.170 4.144 4.020 4.235 . 0 0 "[ . 1 . 2]" 1
2332 1 124 LEU MD1 1 128 ASP HB2 4.950 . 4.950 3.396 3.081 3.771 . 0 0 "[ . 1 . 2]" 1
2333 1 124 LEU H 1 129 ILE HA 4.800 . 5.300 2.955 2.827 4.172 . 0 0 "[ . 1 . 2]" 1
2334 1 124 LEU H 1 125 GLY H 4.610 . 5.110 2.397 1.719 2.512 . 0 0 "[ . 1 . 2]" 1
2335 1 124 LEU MD2 1 130 ARG HB2 4.590 . 4.590 4.407 4.247 4.616 0.026 16 0 "[ . 1 . 2]" 1
2336 1 124 LEU HG 1 125 GLY H 4.570 . 4.570 4.658 4.551 4.710 0.140 17 0 "[ . 1 . 2]" 1
2337 1 124 LEU MD1 1 130 ARG HG2 4.450 . 4.450 3.145 2.888 3.460 . 0 0 "[ . 1 . 2]" 1
2338 1 124 LEU HB3 1 125 GLY H 4.420 . 4.420 4.043 3.610 4.226 . 0 0 "[ . 1 . 2]" 1
2339 1 124 LEU MD1 1 128 ASP HB3 4.290 . 4.290 2.553 2.188 2.794 . 0 0 "[ . 1 . 2]" 1
2340 1 124 LEU HA 1 124 LEU MD2 4.140 . 4.140 1.841 1.786 2.145 . 0 0 "[ . 1 . 2]" 1
2341 1 124 LEU HA 1 125 GLY H 4.140 . 4.640 3.546 3.504 3.606 . 0 0 "[ . 1 . 2]" 1
2342 1 124 LEU HB2 1 125 GLY H 4.030 . 4.030 3.178 2.802 3.373 . 0 0 "[ . 1 . 2]" 1
2343 1 125 GLY HA2 1 127 ASN H 5.980 . 5.980 4.995 4.885 5.162 . 0 0 "[ . 1 . 2]" 1
2344 1 125 GLY H 1 128 ASP HA 5.780 . 5.780 5.210 4.867 5.318 . 0 0 "[ . 1 . 2]" 1
2345 1 125 GLY H 1 127 ASN H 5.520 . 5.520 5.064 4.850 5.145 . 0 0 "[ . 1 . 2]" 1
2346 1 125 GLY HA3 1 127 ASN H 5.510 . 5.510 3.690 3.594 3.852 . 0 0 "[ . 1 . 2]" 1
2347 1 125 GLY H 1 126 ASP HA 5.340 . 5.340 4.562 4.533 4.641 . 0 0 "[ . 1 . 2]" 1
2348 1 125 GLY HA2 1 128 ASP H 5.260 . 5.260 4.669 4.570 4.746 . 0 0 "[ . 1 . 2]" 1
2349 1 125 GLY H 1 129 ILE HA 5.160 . 5.160 4.210 4.118 4.394 . 0 0 "[ . 1 . 2]" 1
2350 1 125 GLY HA3 1 128 ASP H 5.140 . 5.140 3.391 3.257 3.504 . 0 0 "[ . 1 . 2]" 1
2351 1 125 GLY H 1 128 ASP HB3 4.930 . 4.930 4.521 4.111 4.706 . 0 0 "[ . 1 . 2]" 1
2352 1 125 GLY H 1 128 ASP HB2 4.780 . 4.780 3.092 2.641 3.265 . 0 0 "[ . 1 . 2]" 1
2353 1 125 GLY H 1 128 ASP H 4.440 . 4.440 3.454 3.157 3.560 . 0 0 "[ . 1 . 2]" 1
2354 1 126 ASP HB2 1 127 ASN H 5.440 . 5.440 2.757 2.665 3.714 . 0 0 "[ . 1 . 2]" 1
2355 1 126 ASP HA 1 128 ASP H 5.090 . 5.090 4.015 3.932 4.078 . 0 0 "[ . 1 . 2]" 1
2356 1 126 ASP HA 1 127 ASN H 4.990 . 4.990 3.627 3.608 3.652 . 0 0 "[ . 1 . 2]" 1
2357 1 126 ASP HB3 1 127 ASN H 4.360 . 4.360 3.780 2.554 3.898 . 0 0 "[ . 1 . 2]" 1
2358 1 127 ASN HB2 1 178 THR MG 6.270 . 6.270 3.415 2.944 4.733 . 0 0 "[ . 1 . 2]" 1
2359 1 127 ASN HB3 1 178 THR MG 6.160 . 6.160 4.932 4.475 6.173 0.013 6 0 "[ . 1 . 2]" 1
2360 1 127 ASN HB2 1 179 ARG HG2 5.910 . 5.910 4.504 1.856 5.745 . 0 0 "[ . 1 . 2]" 1
2361 1 127 ASN HB2 1 179 ARG HD2 5.760 . 5.760 5.122 3.540 5.815 0.055 5 0 "[ . 1 . 2]" 1
2362 1 127 ASN HA 1 178 THR HA 5.660 . 5.660 4.831 4.469 5.080 . 0 0 "[ . 1 . 2]" 1
2363 1 127 ASN QD 1 178 THR MG 5.480 . 5.480 3.251 2.474 5.548 0.068 10 0 "[ . 1 . 2]" 1
2364 1 127 ASN H 1 128 ASP HB2 5.310 . 5.310 4.517 4.267 4.672 . 0 0 "[ . 1 . 2]" 1
2365 1 127 ASN HA 1 179 ARG HG2 5.260 . 5.260 4.972 2.959 5.613 0.353 16 0 "[ . 1 . 2]" 1
2366 1 127 ASN QD 1 178 THR HA 5.850 2.250 5.850 5.095 4.539 6.206 0.356 10 0 "[ . 1 . 2]" 1
2367 1 127 ASN HB2 1 128 ASP H 5.240 . 5.240 4.467 4.290 4.600 . 0 0 "[ . 1 . 2]" 1
2368 1 127 ASN HB3 1 179 ARG H 5.170 . 5.170 4.348 3.760 4.549 . 0 0 "[ . 1 . 2]" 1
2369 1 127 ASN HA 1 179 ARG HD2 5.140 . 5.140 4.970 4.120 5.404 0.264 20 0 "[ . 1 . 2]" 1
2370 1 127 ASN QD 1 128 ASP H 5.090 . 5.090 4.668 3.796 5.180 0.090 20 0 "[ . 1 . 2]" 1
2371 1 127 ASN HB2 1 179 ARG H 5.030 . 5.030 2.740 2.028 3.017 . 0 0 "[ . 1 . 2]" 1
2372 1 127 ASN QD 1 179 ARG H 4.940 . 4.940 4.093 3.620 5.076 0.136 9 0 "[ . 1 . 2]" 1
2373 1 127 ASN HA 1 128 ASP H 4.900 . 4.900 3.321 3.246 3.369 . 0 0 "[ . 1 . 2]" 1
2374 1 127 ASN H 1 128 ASP H 4.610 . 4.610 2.402 2.344 2.486 . 0 0 "[ . 1 . 2]" 1
2375 1 127 ASN O 1 179 ARG N . 2.700 3.300 3.421 3.309 3.496 0.196 17 0 "[ . 1 . 2]" 1
2376 1 127 ASN O 1 179 ARG H . . 2.300 2.540 2.429 2.620 0.320 11 0 "[ . 1 . 2]" 1
2377 1 128 ASP HB2 1 178 THR MG 6.340 . 6.340 5.681 4.890 5.924 . 0 0 "[ . 1 . 2]" 1
2378 1 128 ASP H 1 178 THR MG 6.260 . 6.260 5.263 5.084 5.539 . 0 0 "[ . 1 . 2]" 1
2379 1 128 ASP H 1 179 ARG H 6.030 . 6.030 5.592 5.459 5.703 . 0 0 "[ . 1 . 2]" 1
2380 1 128 ASP H 1 129 ILE H 5.990 . 5.990 4.406 4.325 4.453 . 0 0 "[ . 1 . 2]" 1
2381 1 128 ASP HA 1 129 ILE HB 5.720 . 5.720 4.386 4.346 4.486 . 0 0 "[ . 1 . 2]" 1
2382 1 128 ASP HA 1 178 THR HB 5.690 . 5.690 5.479 4.578 5.830 0.140 5 0 "[ . 1 . 2]" 1
2383 1 128 ASP HA 1 179 ARG H 5.600 . 5.600 4.467 4.260 4.649 . 0 0 "[ . 1 . 2]" 1
2384 1 128 ASP H 1 178 THR HA 5.470 . 5.470 5.420 5.215 5.532 0.062 20 0 "[ . 1 . 2]" 1
2385 1 128 ASP HB3 1 129 ILE H 5.300 . 5.300 3.261 3.126 3.425 . 0 0 "[ . 1 . 2]" 1
2386 1 128 ASP HB2 1 129 ILE H 4.830 . 4.830 4.198 4.114 4.343 . 0 0 "[ . 1 . 2]" 1
2387 1 128 ASP HA 1 178 THR HA 4.590 . 4.590 3.181 3.088 3.239 . 0 0 "[ . 1 . 2]" 1
2388 1 128 ASP HA 1 178 THR MG 4.520 . 4.520 3.568 2.829 3.848 . 0 0 "[ . 1 . 2]" 1
2389 1 128 ASP HA 1 129 ILE H 4.100 . 4.100 2.236 2.212 2.269 . 0 0 "[ . 1 . 2]" 1
2390 1 129 ILE HG12 1 177 ILE MG 6.960 . 6.960 5.070 4.509 5.364 . 0 0 "[ . 1 . 2]" 1
2391 1 129 ILE H 1 179 ARG H 6.310 . 6.310 5.668 5.320 5.884 . 0 0 "[ . 1 . 2]" 1
2392 1 129 ILE MG 1 177 ILE MG 6.260 . 6.260 3.727 3.563 3.825 . 0 0 "[ . 1 . 2]" 1
2393 1 129 ILE H 1 130 ARG H 6.170 . 6.170 4.294 4.273 4.313 . 0 0 "[ . 1 . 2]" 1
2394 1 129 ILE H 1 177 ILE MG 5.960 . 5.960 4.634 4.240 4.759 . 0 0 "[ . 1 . 2]" 1
2395 1 129 ILE MD 1 130 ARG H 5.820 . 5.820 3.090 2.927 3.254 . 0 0 "[ . 1 . 2]" 1
2396 1 129 ILE MG 1 177 ILE HG12 5.710 . 5.710 4.294 3.977 5.118 . 0 0 "[ . 1 . 2]" 1
2397 1 129 ILE HB 1 178 THR H 5.620 . 5.620 5.787 5.721 5.830 0.210 3 0 "[ . 1 . 2]" 1
2398 1 129 ILE MG 1 130 ARG HB2 5.520 . 5.520 4.355 4.285 4.445 . 0 0 "[ . 1 . 2]" 1
2399 1 129 ILE MG 1 131 LEU HA 5.490 . 5.490 4.131 4.023 4.268 . 0 0 "[ . 1 . 2]" 1
2400 1 129 ILE HB 1 177 ILE HB 5.450 . 5.450 2.496 2.403 2.602 . 0 0 "[ . 1 . 2]" 1
2401 1 129 ILE MG 1 131 LEU H 5.440 . 5.440 3.927 3.831 3.993 . 0 0 "[ . 1 . 2]" 1
2402 1 129 ILE H 1 177 ILE HB 5.230 . 5.230 3.878 3.693 3.993 . 0 0 "[ . 1 . 2]" 1
2403 1 129 ILE HG13 1 130 ARG H 5.180 . 5.180 5.205 5.145 5.284 0.104 10 0 "[ . 1 . 2]" 1
2404 1 129 ILE H 1 178 THR HA 5.170 . 5.170 3.766 3.526 3.860 . 0 0 "[ . 1 . 2]" 1
2405 1 129 ILE HG12 1 130 ARG H 5.130 . 5.130 4.866 4.710 4.957 . 0 0 "[ . 1 . 2]" 1
2406 1 129 ILE HB 1 177 ILE HG12 5.060 . 5.060 5.124 5.005 5.382 0.322 11 0 "[ . 1 . 2]" 1
2407 1 129 ILE H 1 177 ILE H 5.040 . 5.040 3.367 3.060 4.260 . 0 0 "[ . 1 . 2]" 1
2408 1 129 ILE MG 1 130 ARG HA 5.030 . 5.030 3.101 3.048 3.181 . 0 0 "[ . 1 . 2]" 1
2409 1 129 ILE HB 1 177 ILE HA 5.020 . 5.020 5.183 5.105 5.225 0.205 20 0 "[ . 1 . 2]" 1
2410 1 129 ILE HB 1 177 ILE MD 5.020 . 5.020 3.438 3.228 3.656 . 0 0 "[ . 1 . 2]" 1
2411 1 129 ILE MG 1 177 ILE MD 4.990 . 4.990 2.311 2.022 2.760 . 0 0 "[ . 1 . 2]" 1
2412 1 129 ILE HB 1 130 ARG H 4.960 . 4.960 4.293 4.268 4.361 . 0 0 "[ . 1 . 2]" 1
2413 1 129 ILE MG 1 177 ILE H 4.890 . 4.890 3.696 3.542 3.924 . 0 0 "[ . 1 . 2]" 1
2414 1 129 ILE MG 1 131 LEU HB3 4.820 . 4.820 3.820 3.296 4.172 . 0 0 "[ . 1 . 2]" 1
2415 1 129 ILE MG 1 130 ARG H 4.780 . 4.780 2.367 2.219 2.480 . 0 0 "[ . 1 . 2]" 1
2416 1 129 ILE HB 1 177 ILE H 4.680 . 4.680 3.800 3.686 4.276 . 0 0 "[ . 1 . 2]" 1
2417 1 129 ILE HB 1 177 ILE MG 4.500 . 4.500 3.389 2.978 3.480 . 0 0 "[ . 1 . 2]" 1
2418 1 129 ILE HA 1 130 ARG H 4.350 . 4.350 2.273 2.239 2.295 . 0 0 "[ . 1 . 2]" 1
2419 1 129 ILE MG 1 177 ILE HB 4.300 . 4.300 2.813 2.534 3.034 . 0 0 "[ . 1 . 2]" 1
2420 1 129 ILE O 1 177 ILE N . 2.700 3.300 2.958 2.919 2.999 . 0 0 "[ . 1 . 2]" 1
2421 1 129 ILE O 1 177 ILE H . . 2.300 2.037 1.930 2.470 0.170 20 0 "[ . 1 . 2]" 1
2422 1 130 ARG H 1 131 LEU HA 6.240 . 6.240 4.790 4.692 4.845 . 0 0 "[ . 1 . 2]" 1
2423 1 130 ARG H 1 177 ILE H 6.000 . 6.000 5.095 5.032 5.312 . 0 0 "[ . 1 . 2]" 1
2424 1 130 ARG HA 1 131 LEU HB2 5.950 . 5.950 5.059 4.708 5.719 . 0 0 "[ . 1 . 2]" 1
2425 1 130 ARG HG2 1 176 ASN H 5.930 . 5.930 5.692 5.305 5.856 . 0 0 "[ . 1 . 2]" 1
2426 1 130 ARG HA 1 175 PHE H 5.870 . 5.870 4.819 4.635 4.931 . 0 0 "[ . 1 . 2]" 1
2427 1 130 ARG HA 1 177 ILE HG13 5.850 . 5.850 5.538 5.037 5.677 . 0 0 "[ . 1 . 2]" 1
2428 1 130 ARG HA 1 131 LEU HB3 5.830 . 5.830 4.198 4.095 4.446 . 0 0 "[ . 1 . 2]" 1
2429 1 130 ARG HB2 1 174 ILE MG 5.820 . 5.820 5.019 4.550 5.122 . 0 0 "[ . 1 . 2]" 1
2430 1 130 ARG HA 1 174 ILE MG 5.800 . 5.800 4.622 4.085 4.711 . 0 0 "[ . 1 . 2]" 1
2431 1 130 ARG H 1 176 ASN HA 5.690 . 5.690 5.429 5.382 5.493 . 0 0 "[ . 1 . 2]" 1
2432 1 130 ARG HA 1 131 LEU HG 5.680 . 5.680 5.666 4.567 6.062 0.382 6 0 "[ . 1 . 2]" 1
2433 1 130 ARG HD2 1 174 ILE HG13 5.660 . 5.660 5.719 5.655 5.946 0.286 13 0 "[ . 1 . 2]" 1
2434 1 130 ARG H 1 131 LEU H 5.640 . 5.640 4.444 4.403 4.463 . 0 0 "[ . 1 . 2]" 1
2435 1 130 ARG HD2 1 174 ILE MD 5.590 . 5.590 4.373 3.595 4.524 . 0 0 "[ . 1 . 2]" 1
2436 1 130 ARG HG3 1 174 ILE MG 5.580 . 5.580 5.193 4.514 5.287 . 0 0 "[ . 1 . 2]" 1
2437 1 130 ARG HA 1 130 ARG HD2 5.530 . 5.530 4.135 4.084 4.180 . 0 0 "[ . 1 . 2]" 1
2438 1 130 ARG HA 1 177 ILE MD 5.390 . 5.390 3.401 3.032 4.683 . 0 0 "[ . 1 . 2]" 1
2439 1 130 ARG HB3 1 174 ILE MG 5.370 . 5.370 3.593 3.142 3.707 . 0 0 "[ . 1 . 2]" 1
2440 1 130 ARG HG2 1 176 ASN HA 5.360 . 5.360 3.081 2.804 3.257 . 0 0 "[ . 1 . 2]" 1
2441 1 130 ARG HA 1 175 PHE HB2 5.330 . 5.330 4.723 4.521 4.889 . 0 0 "[ . 1 . 2]" 1
2442 1 130 ARG H 1 177 ILE HB 5.280 . 5.280 5.609 5.493 5.666 0.386 7 0 "[ . 1 . 2]" 1
2443 1 130 ARG HA 1 177 ILE HB 5.260 . 5.260 4.874 4.687 4.976 . 0 0 "[ . 1 . 2]" 1
2444 1 130 ARG HD2 1 131 LEU H 5.230 . 5.230 4.855 4.748 4.979 . 0 0 "[ . 1 . 2]" 1
2445 1 130 ARG HB2 1 131 LEU H 5.170 . 5.170 4.159 4.110 4.347 . 0 0 "[ . 1 . 2]" 1
2446 1 130 ARG HA 1 177 ILE H 5.120 . 5.120 3.355 3.255 3.471 . 0 0 "[ . 1 . 2]" 1
2447 1 130 ARG HG2 1 174 ILE MG 5.080 . 5.080 4.104 3.440 4.215 . 0 0 "[ . 1 . 2]" 1
2448 1 130 ARG HB3 1 131 LEU H 5.080 . 5.080 3.009 2.939 3.194 . 0 0 "[ . 1 . 2]" 1
2449 1 130 ARG HD2 1 176 ASN HB2 5.050 . 5.050 5.223 5.164 5.277 0.227 16 0 "[ . 1 . 2]" 1
2450 1 130 ARG HD2 1 175 PHE H 5.040 . 5.040 5.255 5.179 5.293 0.253 11 0 "[ . 1 . 2]" 1
2451 1 130 ARG HB3 1 131 LEU HA 5.040 . 5.040 4.280 4.089 4.369 . 0 0 "[ . 1 . 2]" 1
2452 1 130 ARG HA 1 176 ASN HA 4.970 . 4.970 2.824 2.755 2.936 . 0 0 "[ . 1 . 2]" 1
2453 1 130 ARG HA 1 176 ASN H 4.940 . 4.940 5.178 5.099 5.308 0.368 13 0 "[ . 1 . 2]" 1
2454 1 130 ARG HG2 1 131 LEU H 4.900 . 4.900 4.099 3.959 4.226 . 0 0 "[ . 1 . 2]" 1
2455 1 130 ARG HD2 1 163 THR MG 4.800 . 4.800 4.903 4.583 4.993 0.193 20 0 "[ . 1 . 2]" 1
2456 1 130 ARG HG2 1 177 ILE H 4.460 . 4.460 4.396 4.189 4.656 0.196 5 0 "[ . 1 . 2]" 1
2457 1 130 ARG HD2 1 174 ILE MG 4.210 . 4.210 2.916 2.258 2.988 . 0 0 "[ . 1 . 2]" 1
2458 1 130 ARG HA 1 131 LEU H 4.080 . 4.080 2.239 2.198 2.294 . 0 0 "[ . 1 . 2]" 1
2459 1 131 LEU MD1 1 147 LEU MD2 6.980 . 6.980 4.965 4.664 5.210 . 0 0 "[ . 1 . 2]" 1
2460 1 131 LEU HA 1 174 ILE MD 6.710 . 6.710 6.192 5.889 6.880 0.170 13 0 "[ . 1 . 2]" 1
2461 1 131 LEU HB2 1 175 PHE QD 6.640 . 6.640 4.910 4.699 5.291 . 0 0 "[ . 1 . 2]" 1
2462 1 131 LEU H 1 133 TYR H 6.490 . 6.490 6.426 6.311 6.519 0.029 14 0 "[ . 1 . 2]" 1
2463 1 131 LEU HB2 1 175 PHE HB3 6.480 . 6.480 5.486 4.947 6.547 0.067 13 0 "[ . 1 . 2]" 1
2464 1 131 LEU HG 1 176 ASN H 6.250 . 6.250 6.344 5.479 6.640 0.390 20 0 "[ . 1 . 2]" 1
2465 1 131 LEU HB3 1 175 PHE HB2 6.170 . 6.170 2.871 2.154 4.181 . 0 0 "[ . 1 . 2]" 1
2466 1 131 LEU HB3 1 175 PHE HB3 6.170 . 6.170 3.956 3.214 5.395 . 0 0 "[ . 1 . 2]" 1
2467 1 131 LEU HB3 1 175 PHE QD 6.010 . 6.010 4.110 3.564 5.127 . 0 0 "[ . 1 . 2]" 1
2468 1 131 LEU HG 1 132 HIS H 6.000 . 6.000 3.831 3.558 4.402 . 0 0 "[ . 1 . 2]" 1
2469 1 131 LEU HB2 1 175 PHE HB2 5.930 . 5.930 4.286 3.908 5.028 . 0 0 "[ . 1 . 2]" 1
2470 1 131 LEU HG 1 160 ILE MG 5.840 . 5.840 5.793 5.219 5.973 0.133 4 0 "[ . 1 . 2]" 1
2471 1 131 LEU HB2 1 175 PHE H 5.840 . 5.840 5.762 5.603 5.989 0.149 3 0 "[ . 1 . 2]" 1
2472 1 131 LEU QD 1 132 HIS H 5.790 . 5.790 2.862 2.317 3.842 . 0 0 "[ . 1 . 2]" 1
2473 1 131 LEU H 1 175 PHE HB3 5.700 . 5.700 4.143 3.978 4.508 . 0 0 "[ . 1 . 2]" 1
2474 1 131 LEU HA 1 177 ILE MD 5.680 . 5.680 4.376 4.064 5.462 . 0 0 "[ . 1 . 2]" 1
2475 1 131 LEU QD 1 175 PHE H 5.670 . 5.670 4.282 3.667 4.637 . 0 0 "[ . 1 . 2]" 1
2476 1 131 LEU HB3 1 132 HIS HD2 5.630 . 5.630 5.557 5.393 5.719 0.089 3 0 "[ . 1 . 2]" 1
2477 1 131 LEU HB2 1 147 LEU MD1 5.620 . 5.620 5.040 4.703 5.477 . 0 0 "[ . 1 . 2]" 1
2478 1 131 LEU HA 1 175 PHE H 5.590 . 5.590 5.147 5.081 5.204 . 0 0 "[ . 1 . 2]" 1
2479 1 131 LEU HG 1 174 ILE HA 5.580 . 5.580 5.251 4.634 5.577 . 0 0 "[ . 1 . 2]" 1
2480 1 131 LEU H 1 174 ILE MG 5.550 . 5.550 4.105 3.607 4.231 . 0 0 "[ . 1 . 2]" 1
2481 1 131 LEU HB2 1 132 HIS H 5.550 . 5.550 3.950 3.345 4.249 . 0 0 "[ . 1 . 2]" 1
2482 1 131 LEU H 1 177 ILE HB 5.530 . 5.530 5.707 5.606 5.761 0.231 1 0 "[ . 1 . 2]" 1
2483 1 131 LEU H 1 177 ILE H 5.530 . 5.530 4.555 3.950 4.963 . 0 0 "[ . 1 . 2]" 1
2484 1 131 LEU H 1 177 ILE HG13 5.510 . 5.510 5.467 5.155 5.542 0.032 18 0 "[ . 1 . 2]" 1
2485 1 131 LEU HB2 1 132 HIS HD2 5.500 . 5.500 5.519 5.302 5.610 0.110 8 0 "[ . 1 . 2]" 1
2486 1 131 LEU HB3 1 175 PHE H 5.500 . 5.500 4.658 4.154 5.534 0.034 11 0 "[ . 1 . 2]" 1
2487 1 131 LEU H 1 176 ASN H 5.470 . 5.470 4.959 4.788 5.303 . 0 0 "[ . 1 . 2]" 1
2488 1 131 LEU H 1 175 PHE HA 5.420 . 5.420 4.857 4.753 5.032 . 0 0 "[ . 1 . 2]" 1
2489 1 131 LEU HB3 1 132 HIS H 5.310 . 5.310 4.544 4.377 4.622 . 0 0 "[ . 1 . 2]" 1
2490 1 131 LEU QD 1 177 ILE MD 5.290 . 5.290 2.343 1.675 2.743 . 0 0 "[ . 1 . 2]" 1
2491 1 131 LEU H 1 131 LEU HG 5.280 . 5.280 3.510 2.453 3.930 . 0 0 "[ . 1 . 2]" 1
2492 1 131 LEU QD 1 175 PHE HB2 5.180 . 5.180 2.575 1.868 3.101 . 0 0 "[ . 1 . 2]" 1
2493 1 131 LEU HG 1 132 HIS HD2 5.170 . 5.170 5.273 5.023 5.376 0.206 16 0 "[ . 1 . 2]" 1
2494 1 131 LEU MD2 1 147 LEU MD2 5.060 . 5.060 3.755 3.498 4.048 . 0 0 "[ . 1 . 2]" 1
2495 1 131 LEU HB2 1 177 ILE MD 5.050 . 5.050 3.212 2.549 4.664 . 0 0 "[ . 1 . 2]" 1
2496 1 131 LEU H 1 177 ILE MD 5.030 . 5.030 3.251 3.052 4.446 . 0 0 "[ . 1 . 2]" 1
2497 1 131 LEU H 1 175 PHE HB2 5.030 . 5.030 2.935 2.741 3.241 . 0 0 "[ . 1 . 2]" 1
2498 1 131 LEU H 1 176 ASN HA 5.020 . 5.020 3.836 3.634 4.158 . 0 0 "[ . 1 . 2]" 1
2499 1 131 LEU H 1 175 PHE H 4.930 . 4.930 3.197 3.057 3.293 . 0 0 "[ . 1 . 2]" 1
2500 1 131 LEU MD1 1 132 HIS H 4.710 . 4.710 2.888 2.322 3.946 . 0 0 "[ . 1 . 2]" 1
2501 1 131 LEU HB3 1 147 LEU MD1 4.640 . 4.640 4.722 4.599 4.859 0.219 10 0 "[ . 1 . 2]" 1
2502 1 131 LEU HB3 1 177 ILE MD 4.590 . 4.590 2.366 1.959 3.388 . 0 0 "[ . 1 . 2]" 1
2503 1 131 LEU HA 1 132 HIS H 4.220 . 4.220 2.190 2.166 2.205 . 0 0 "[ . 1 . 2]" 1
2504 1 131 LEU N 1 175 PHE O . 2.700 3.300 3.335 3.303 3.355 0.055 10 0 "[ . 1 . 2]" 1
2505 1 131 LEU O 1 175 PHE N . 2.700 3.300 3.169 3.084 3.306 0.006 10 0 "[ . 1 . 2]" 1
2506 1 131 LEU H 1 175 PHE O . . 2.300 2.384 2.358 2.429 0.129 10 0 "[ . 1 . 2]" 1
2507 1 131 LEU O 1 175 PHE H . . 2.300 2.272 2.201 2.370 0.070 10 0 "[ . 1 . 2]" 1
2508 1 132 HIS H 1 132 HIS HD2 6.200 . 6.200 2.607 2.404 2.849 . 0 0 "[ . 1 . 2]" 1
2509 1 132 HIS HD2 1 133 TYR H 6.150 . 6.150 5.510 5.132 5.752 . 0 0 "[ . 1 . 2]" 1
2510 1 132 HIS HB3 1 174 ILE HA 6.150 . 6.150 5.061 4.919 5.209 . 0 0 "[ . 1 . 2]" 1
2511 1 132 HIS H 1 133 TYR H 6.140 . 6.140 4.540 4.512 4.561 . 0 0 "[ . 1 . 2]" 1
2512 1 132 HIS HB2 1 174 ILE HA 6.040 . 6.040 6.015 5.849 6.122 0.082 1 0 "[ . 1 . 2]" 1
2513 1 132 HIS HD2 1 174 ILE MD 6.010 . 6.010 3.959 3.608 4.436 . 0 0 "[ . 1 . 2]" 1
2514 1 132 HIS HE1 1 174 ILE HG12 5.970 . 5.970 5.900 4.327 6.007 0.037 15 0 "[ . 1 . 2]" 1
2515 1 132 HIS HB3 1 172 ASP HA 5.920 . 5.920 5.671 5.345 5.794 . 0 0 "[ . 1 . 2]" 1
2516 1 132 HIS HA 1 174 ILE HG12 5.890 . 5.890 5.526 3.307 5.764 . 0 0 "[ . 1 . 2]" 1
2517 1 132 HIS HB3 1 133 TYR H 5.850 . 5.850 3.175 3.024 3.235 . 0 0 "[ . 1 . 2]" 1
2518 1 132 HIS HE1 1 174 ILE HG13 5.840 . 5.840 5.257 5.124 5.460 . 0 0 "[ . 1 . 2]" 1
2519 1 132 HIS HB2 1 174 ILE MD 5.520 . 5.520 4.772 4.585 5.759 0.239 13 0 "[ . 1 . 2]" 1
2520 1 132 HIS HA 1 174 ILE MG 5.490 . 5.490 4.166 3.698 4.307 . 0 0 "[ . 1 . 2]" 1
2521 1 132 HIS HA 1 174 ILE HA 5.310 . 5.310 3.189 2.929 3.261 . 0 0 "[ . 1 . 2]" 1
2522 1 132 HIS H 1 175 PHE H 5.260 . 5.260 5.207 5.120 5.364 0.104 11 0 "[ . 1 . 2]" 1
2523 1 132 HIS HE1 1 174 ILE MD 5.080 . 5.080 2.981 2.873 3.138 . 0 0 "[ . 1 . 2]" 1
2524 1 132 HIS HA 1 174 ILE MD 5.020 . 5.020 3.251 2.913 4.738 . 0 0 "[ . 1 . 2]" 1
2525 1 132 HIS HA 1 175 PHE H 4.930 . 4.930 3.570 3.405 3.814 . 0 0 "[ . 1 . 2]" 1
2526 1 132 HIS HA 1 133 TYR H 3.750 . 3.750 2.246 2.221 2.261 . 0 0 "[ . 1 . 2]" 1
2527 1 132 HIS HA 1 173 VAL H 4.570 . 4.570 4.791 4.712 4.889 0.319 7 0 "[ . 1 . 2]" 1
2528 1 133 TYR QE 1 173 VAL H 6.930 . 6.930 6.908 6.759 7.050 0.120 2 0 "[ . 1 . 2]" 1
2529 1 133 TYR H 1 173 VAL MG2 6.360 . 6.360 4.865 4.800 4.919 . 0 0 "[ . 1 . 2]" 1
2530 1 133 TYR QE 1 143 ALA MB 6.230 . 6.230 4.666 4.428 4.829 . 0 0 "[ . 1 . 2]" 1
2531 1 133 TYR H 1 175 PHE QE 6.190 . 6.190 4.030 3.621 4.562 . 0 0 "[ . 1 . 2]" 1
2532 1 133 TYR QD 1 173 VAL MG2 6.150 . 6.150 3.665 3.475 3.965 . 0 0 "[ . 1 . 2]" 1
2533 1 133 TYR HB2 1 175 PHE QE 6.150 . 6.150 2.458 2.216 2.840 . 0 0 "[ . 1 . 2]" 1
2534 1 133 TYR QE 1 134 GLN H 6.100 . 6.100 4.938 4.882 5.037 . 0 0 "[ . 1 . 2]" 1
2535 1 133 TYR HB2 1 173 VAL H 5.810 . 5.810 5.353 5.222 5.477 . 0 0 "[ . 1 . 2]" 1
2536 1 133 TYR H 1 173 VAL HB 5.760 . 5.760 3.619 3.553 3.697 . 0 0 "[ . 1 . 2]" 1
2537 1 133 TYR QD 1 172 ASP HA 5.710 . 5.710 5.821 5.759 5.868 0.158 19 0 "[ . 1 . 2]" 1
2538 1 133 TYR H 1 175 PHE H 5.710 . 5.710 4.765 4.576 4.938 . 0 0 "[ . 1 . 2]" 1
2539 1 133 TYR HB3 1 173 VAL H 5.560 . 5.560 3.919 3.790 4.007 . 0 0 "[ . 1 . 2]" 1
2540 1 133 TYR HB3 1 175 PHE QE 5.400 . 5.400 2.250 1.925 2.699 . 0 0 "[ . 1 . 2]" 1
2541 1 133 TYR H 1 134 GLN H 5.350 . 5.350 4.245 4.229 4.274 . 0 0 "[ . 1 . 2]" 1
2542 1 133 TYR H 1 174 ILE HA 5.340 . 5.340 4.011 3.737 4.088 . 0 0 "[ . 1 . 2]" 1
2543 1 133 TYR H 1 173 VAL H 5.190 . 5.190 3.204 3.143 3.319 . 0 0 "[ . 1 . 2]" 1
2544 1 133 TYR QD 1 173 VAL H 5.160 . 5.160 4.768 4.606 4.879 . 0 0 "[ . 1 . 2]" 1
2545 1 133 TYR HB3 1 134 GLN H 5.130 . 5.130 4.310 4.240 4.366 . 0 0 "[ . 1 . 2]" 1
2546 1 133 TYR H 1 172 ASP HA 5.090 . 5.090 4.804 4.709 4.964 . 0 0 "[ . 1 . 2]" 1
2547 1 133 TYR HB2 1 134 GLN H 5.090 . 5.090 4.536 4.495 4.588 . 0 0 "[ . 1 . 2]" 1
2548 1 133 TYR HA 1 134 GLN H 3.840 . 3.840 2.250 2.231 2.275 . 0 0 "[ . 1 . 2]" 1
2549 1 133 TYR O 1 173 VAL N . 2.700 3.300 3.360 3.344 3.374 0.074 14 0 "[ . 1 . 2]" 1
2550 1 133 TYR N 1 173 VAL O . 2.700 3.300 3.375 3.226 3.397 0.097 16 0 "[ . 1 . 2]" 1
2551 1 133 TYR H 1 173 VAL O . . 2.300 2.393 2.261 2.425 0.125 1 0 "[ . 1 . 2]" 1
2552 1 133 TYR O 1 173 VAL H . . 2.300 2.452 2.397 2.467 0.167 12 0 "[ . 1 . 2]" 1
2553 1 134 GLN H 1 135 SER H 6.060 . 6.060 4.241 4.180 4.273 . 0 0 "[ . 1 . 2]" 1
2554 1 134 GLN HG2 1 173 VAL H 5.930 . 5.930 5.413 4.335 6.170 0.240 6 0 "[ . 1 . 2]" 1
2555 1 134 GLN H 1 135 SER HA 5.830 . 5.830 5.161 5.124 5.185 . 0 0 "[ . 1 . 2]" 1
2556 1 134 GLN HA 1 173 VAL H 5.720 . 5.720 3.855 3.737 3.924 . 0 0 "[ . 1 . 2]" 1
2557 1 134 GLN HG3 1 135 SER H 5.590 . 5.590 4.497 3.909 5.235 . 0 0 "[ . 1 . 2]" 1
2558 1 134 GLN HB2 1 172 ASP HA 5.530 . 5.530 5.091 4.602 5.705 0.175 12 0 "[ . 1 . 2]" 1
2559 1 134 GLN H 1 172 ASP HA 5.430 . 5.430 5.725 5.677 5.788 0.358 13 0 "[ . 1 . 2]" 1
2560 1 134 GLN HG3 1 172 ASP HA 5.340 . 5.340 3.710 3.224 4.304 . 0 0 "[ . 1 . 2]" 1
2561 1 134 GLN HG2 1 172 ASP HA 5.180 . 5.180 3.979 2.903 4.738 . 0 0 "[ . 1 . 2]" 1
2562 1 134 GLN HG2 1 135 SER H 4.980 . 4.980 3.711 3.182 4.446 . 0 0 "[ . 1 . 2]" 1
2563 1 134 GLN H 1 134 GLN HG3 4.970 . 4.970 4.073 3.135 4.644 . 0 0 "[ . 1 . 2]" 1
2564 1 134 GLN HB2 1 135 SER H 4.890 . 4.890 4.570 4.447 4.648 . 0 0 "[ . 1 . 2]" 1
2565 1 134 GLN HA 1 172 ASP HA 4.630 . 4.630 3.297 3.190 3.382 . 0 0 "[ . 1 . 2]" 1
2566 1 134 GLN HB3 1 135 SER H 4.590 . 4.590 3.976 3.578 4.247 . 0 0 "[ . 1 . 2]" 1
2567 1 134 GLN HA 1 135 SER H 4.210 . 4.210 2.195 2.171 2.212 . 0 0 "[ . 1 . 2]" 1
2568 1 135 SER H 1 136 LYS HG2 6.210 . 6.210 5.658 5.503 5.950 . 0 0 "[ . 1 . 2]" 1
2569 1 135 SER H 1 173 VAL H 5.400 . 5.400 4.991 4.817 5.086 . 0 0 "[ . 1 . 2]" 1
2570 1 135 SER H 1 136 LYS H 5.370 . 5.370 4.311 4.281 4.365 . 0 0 "[ . 1 . 2]" 1
2571 1 135 SER HB2 1 136 LYS H 5.200 . 5.200 4.039 2.526 4.152 . 0 0 "[ . 1 . 2]" 1
2572 1 135 SER H 1 172 ASP HA 5.000 . 5.000 4.493 4.365 4.561 . 0 0 "[ . 1 . 2]" 1
2573 1 135 SER H 1 171 THR HA 4.750 . 4.750 2.572 2.512 2.671 . 0 0 "[ . 1 . 2]" 1
2574 1 135 SER HA 1 136 LYS H 3.870 . 3.870 2.425 2.395 2.502 . 0 0 "[ . 1 . 2]" 1
2575 1 135 SER N 1 171 THR O . 2.700 3.300 3.237 3.171 3.302 0.002 13 0 "[ . 1 . 2]" 1
2576 1 135 SER O 1 171 THR N . 2.700 3.300 3.119 3.051 3.150 . 0 0 "[ . 1 . 2]" 1
2577 1 135 SER O 1 171 THR H . . 2.300 2.477 2.410 2.724 0.424 7 0 "[ . 1 . 2]" 1
2578 1 135 SER H 1 171 THR O . . 2.300 2.418 2.363 2.472 0.172 13 0 "[ . 1 . 2]" 1
2579 1 136 LYS HB3 1 137 ARG H 5.910 . 5.910 4.419 4.406 4.448 . 0 0 "[ . 1 . 2]" 1
2580 1 136 LYS QG 1 171 THR HB 5.530 . 5.530 4.804 4.686 4.851 . 0 0 "[ . 1 . 2]" 1
2581 1 136 LYS H 1 136 LYS QD 5.480 . 5.480 4.279 3.951 4.621 . 0 0 "[ . 1 . 2]" 1
2582 1 136 LYS H 1 137 ARG H 5.140 . 5.140 2.548 2.400 2.627 . 0 0 "[ . 1 . 2]" 1
2583 1 136 LYS H 1 136 LYS QG 5.050 . 5.050 2.654 2.585 2.734 . 0 0 "[ . 1 . 2]" 1
2584 1 136 LYS HA 1 137 ARG HG3 5.040 . 5.040 4.862 4.626 5.072 0.032 3 0 "[ . 1 . 2]" 1
2585 1 136 LYS HA 1 136 LYS QD 4.940 . 4.940 4.030 3.963 4.256 . 0 0 "[ . 1 . 2]" 1
2586 1 136 LYS HG2 1 171 THR HB 4.790 . 4.790 5.007 4.932 5.062 0.272 20 0 "[ . 1 . 2]" 1
2587 1 136 LYS HB2 1 137 ARG HG3 4.560 . 4.560 3.325 3.132 3.984 . 0 0 "[ . 1 . 2]" 1
2588 1 136 LYS HB3 1 137 ARG HG3 4.370 . 4.370 4.040 3.734 4.423 0.053 7 0 "[ . 1 . 2]" 1
2589 1 138 PRO HB2 1 139 PHE H 5.650 . 5.650 4.109 3.987 4.300 . 0 0 "[ . 1 . 2]" 1
2590 1 138 PRO HA 1 140 ALA H 5.640 . 5.640 5.381 5.190 5.467 . 0 0 "[ . 1 . 2]" 1
2591 1 138 PRO HG2 1 139 PHE H 5.550 . 5.550 5.242 5.115 5.295 . 0 0 "[ . 1 . 2]" 1
2592 1 138 PRO HG3 1 170 GLU H 5.310 . 5.310 5.292 4.788 5.431 0.121 9 0 "[ . 1 . 2]" 1
2593 1 138 PRO HB2 1 140 ALA H 5.290 . 5.290 4.738 4.576 4.947 . 0 0 "[ . 1 . 2]" 1
2594 1 138 PRO HD2 1 171 THR H 4.810 . 4.810 4.854 4.780 5.009 0.199 7 0 "[ . 1 . 2]" 1
2595 1 138 PRO HG2 1 170 GLU HA 4.780 . 4.780 3.131 2.752 3.370 . 0 0 "[ . 1 . 2]" 1
2596 1 138 PRO HG2 1 171 THR H 4.580 . 4.580 4.051 3.838 4.398 . 0 0 "[ . 1 . 2]" 1
2597 1 138 PRO HA 1 139 PHE H 4.450 . 4.450 2.320 2.257 2.449 . 0 0 "[ . 1 . 2]" 1
2598 1 138 PRO HG3 1 173 VAL MG2 4.240 . 4.240 3.312 3.168 3.707 . 0 0 "[ . 1 . 2]" 1
2599 1 138 PRO HG3 1 170 GLU HA 4.230 . 4.230 2.512 2.141 2.618 . 0 0 "[ . 1 . 2]" 1
2600 1 139 PHE HB3 1 143 ALA H 5.940 . 5.940 4.690 4.540 4.810 . 0 0 "[ . 1 . 2]" 1
2601 1 139 PHE HB3 1 140 ALA H 5.930 . 5.930 3.697 3.620 3.827 . 0 0 "[ . 1 . 2]" 1
2602 1 139 PHE QE 1 140 ALA H 5.910 . 5.910 6.081 6.021 6.167 0.257 9 0 "[ . 1 . 2]" 1
2603 1 139 PHE HB2 1 142 PHE QD 5.890 . 5.890 4.161 3.502 4.429 . 0 0 "[ . 1 . 2]" 1
2604 1 139 PHE HB3 1 142 PHE QD 5.860 . 5.860 5.042 4.805 5.207 . 0 0 "[ . 1 . 2]" 1
2605 1 139 PHE QD 1 140 ALA H 5.640 . 5.640 4.023 3.853 4.357 . 0 0 "[ . 1 . 2]" 1
2606 1 139 PHE H 1 139 PHE QD 5.540 . 5.540 3.340 2.983 3.560 . 0 0 "[ . 1 . 2]" 1
2607 1 139 PHE HA 1 141 SER H 5.510 . 5.510 3.873 3.645 3.919 . 0 0 "[ . 1 . 2]" 1
2608 1 139 PHE H 1 142 PHE H 5.440 . 5.440 4.701 4.624 4.855 . 0 0 "[ . 1 . 2]" 1
2609 1 139 PHE QD 1 142 PHE H 5.380 . 5.380 4.666 4.466 4.771 . 0 0 "[ . 1 . 2]" 1
2610 1 139 PHE HB2 1 142 PHE H 5.300 . 5.300 3.281 3.094 3.525 . 0 0 "[ . 1 . 2]" 1
2611 1 139 PHE H 1 140 ALA H 5.260 . 5.260 4.254 4.198 4.307 . 0 0 "[ . 1 . 2]" 1
2612 1 139 PHE HA 1 142 PHE H 5.250 . 5.250 4.358 4.308 4.408 . 0 0 "[ . 1 . 2]" 1
2613 1 139 PHE HA 1 140 ALA H 4.940 . 4.940 2.209 2.193 2.217 . 0 0 "[ . 1 . 2]" 1
2614 1 139 PHE O 1 143 ALA N . 2.700 3.300 3.326 3.281 3.351 0.051 1 0 "[ . 1 . 2]" 1
2615 1 139 PHE O 1 143 ALA H . . 2.300 2.366 2.308 2.392 0.092 1 0 "[ . 1 . 2]" 1
2616 1 140 ALA MB 1 173 VAL HB 6.280 . 6.280 6.254 6.137 6.375 0.095 7 0 "[ . 1 . 2]" 1
2617 1 140 ALA MB 1 173 VAL MG2 6.040 . 6.040 4.881 4.764 5.033 . 0 0 "[ . 1 . 2]" 1
2618 1 140 ALA MB 1 175 PHE QD 6.010 . 6.010 4.634 4.418 4.988 . 0 0 "[ . 1 . 2]" 1
2619 1 140 ALA MB 1 143 ALA MB 6.000 . 6.000 4.202 3.975 4.295 . 0 0 "[ . 1 . 2]" 1
2620 1 140 ALA MB 1 142 PHE H 5.850 . 5.850 4.412 4.367 4.499 . 0 0 "[ . 1 . 2]" 1
2621 1 140 ALA HA 1 173 VAL MG2 5.820 . 5.820 5.715 5.577 5.830 0.010 8 0 "[ . 1 . 2]" 1
2622 1 140 ALA H 1 175 PHE QE 5.710 . 5.710 5.336 5.125 5.709 . 0 0 "[ . 1 . 2]" 1
2623 1 140 ALA H 1 141 SER H 5.700 . 5.700 2.785 2.611 2.828 . 0 0 "[ . 1 . 2]" 1
2624 1 140 ALA H 1 173 VAL MG2 5.600 . 5.600 5.619 5.509 5.661 0.061 9 0 "[ . 1 . 2]" 1
2625 1 140 ALA HA 1 142 PHE H 5.300 . 5.300 3.910 3.849 4.026 . 0 0 "[ . 1 . 2]" 1
2626 1 140 ALA HA 1 141 SER H 5.270 . 5.270 3.628 3.586 3.642 . 0 0 "[ . 1 . 2]" 1
2627 1 140 ALA HA 1 143 ALA H 5.150 . 5.150 3.398 3.227 3.484 . 0 0 "[ . 1 . 2]" 1
2628 1 140 ALA HA 1 175 PHE QE 5.070 . 5.070 3.434 3.200 3.781 . 0 0 "[ . 1 . 2]" 1
2629 1 140 ALA HA 1 143 ALA MB 4.630 . 4.630 3.054 2.830 3.171 . 0 0 "[ . 1 . 2]" 1
2630 1 140 ALA MB 1 141 SER H 4.440 . 4.440 2.748 2.639 2.901 . 0 0 "[ . 1 . 2]" 1
2631 1 140 ALA MB 1 175 PHE QE 4.050 . 4.050 2.827 2.512 3.192 . 0 0 "[ . 1 . 2]" 1
2632 1 140 ALA O 1 144 GLU N . 2.700 3.300 3.010 2.969 3.042 . 0 0 "[ . 1 . 2]" 1
2633 1 140 ALA O 1 144 GLU H . . 2.300 2.025 1.988 2.058 . 0 0 "[ . 1 . 2]" 1
2634 1 141 SER H 1 143 ALA MB 6.370 . 6.370 5.378 5.210 5.454 . 0 0 "[ . 1 . 2]" 1
2635 1 141 SER H 1 143 ALA H 5.420 . 5.420 4.518 4.347 4.572 . 0 0 "[ . 1 . 2]" 1
2636 1 141 SER H 1 142 PHE H 5.400 . 5.400 2.755 2.701 2.769 . 0 0 "[ . 1 . 2]" 1
2637 1 141 SER HB2 1 142 PHE H 5.040 . 5.040 3.149 3.001 3.219 . 0 0 "[ . 1 . 2]" 1
2638 1 141 SER O 1 145 GLY N . 2.700 3.300 3.299 3.255 3.321 0.021 2 0 "[ . 1 . 2]" 1
2639 1 141 SER O 1 145 GLY H . . 2.300 2.420 2.380 2.447 0.147 2 0 "[ . 1 . 2]" 1
2640 1 142 PHE H 1 143 ALA MB 5.640 . 5.640 4.153 4.120 4.197 . 0 0 "[ . 1 . 2]" 1
2641 1 142 PHE H 1 143 ALA H 5.190 . 5.190 2.472 2.446 2.523 . 0 0 "[ . 1 . 2]" 1
2642 1 142 PHE HB3 1 143 ALA H 4.940 . 4.940 2.585 2.549 2.631 . 0 0 "[ . 1 . 2]" 1
2643 1 142 PHE HA 1 145 GLY H 4.920 . 4.920 3.566 3.511 3.608 . 0 0 "[ . 1 . 2]" 1
2644 1 142 PHE H 1 144 GLU H 4.850 . 4.850 3.970 3.922 4.028 . 0 0 "[ . 1 . 2]" 1
2645 1 142 PHE HB2 1 143 ALA H 4.810 . 4.810 3.952 3.708 3.979 . 0 0 "[ . 1 . 2]" 1
2646 1 142 PHE O 1 146 LEU N . 2.700 3.300 3.330 3.314 3.369 0.069 14 0 "[ . 1 . 2]" 1
2647 1 142 PHE O 1 146 LEU H . . 2.300 2.393 2.382 2.427 0.127 14 0 "[ . 1 . 2]" 1
2648 1 143 ALA MB 1 146 LEU MD1 6.500 . 6.500 4.101 3.949 4.211 . 0 0 "[ . 1 . 2]" 1
2649 1 143 ALA MB 1 147 LEU MD1 6.300 . 6.300 3.226 3.107 3.346 . 0 0 "[ . 1 . 2]" 1
2650 1 143 ALA MB 1 146 LEU H 6.290 . 6.290 4.609 4.528 4.675 . 0 0 "[ . 1 . 2]" 1
2651 1 143 ALA MB 1 147 LEU MD2 6.180 . 6.180 4.567 4.459 4.665 . 0 0 "[ . 1 . 2]" 1
2652 1 143 ALA HA 1 147 LEU H 6.120 . 6.120 4.324 4.287 4.394 . 0 0 "[ . 1 . 2]" 1
2653 1 143 ALA HA 1 144 GLU H 5.600 . 5.600 3.637 3.628 3.642 . 0 0 "[ . 1 . 2]" 1
2654 1 143 ALA MB 1 144 GLU HB2 5.430 . 5.430 4.236 4.171 4.302 . 0 0 "[ . 1 . 2]" 1
2655 1 143 ALA MB 1 144 GLU HA 5.370 . 5.370 3.631 3.610 3.651 . 0 0 "[ . 1 . 2]" 1
2656 1 143 ALA HA 1 146 LEU MD1 5.090 . 5.090 3.058 2.900 3.248 . 0 0 "[ . 1 . 2]" 1
2657 1 143 ALA HA 1 146 LEU H 4.970 . 4.970 3.402 3.307 3.487 . 0 0 "[ . 1 . 2]" 1
2658 1 143 ALA H 1 144 GLU H 4.430 . 4.430 2.760 2.732 2.773 . 0 0 "[ . 1 . 2]" 1
2659 1 143 ALA MB 1 175 PHE QE 4.420 . 4.420 3.820 3.644 3.942 . 0 0 "[ . 1 . 2]" 1
2660 1 143 ALA MB 1 144 GLU H 4.260 . 4.260 2.779 2.742 2.816 . 0 0 "[ . 1 . 2]" 1
2661 1 143 ALA O 1 147 LEU N . 2.700 3.300 3.051 3.020 3.105 . 0 0 "[ . 1 . 2]" 1
2662 1 143 ALA O 1 147 LEU H . . 2.300 2.107 2.075 2.163 . 0 0 "[ . 1 . 2]" 1
2663 1 144 GLU H 1 147 LEU MD2 6.780 . 6.780 6.651 6.586 6.702 . 0 0 "[ . 1 . 2]" 1
2664 1 144 GLU HA 1 145 GLY H 6.080 . 6.080 3.571 3.560 3.582 . 0 0 "[ . 1 . 2]" 1
2665 1 144 GLU HG2 1 145 GLY H 5.990 . 5.990 3.942 3.919 3.968 . 0 0 "[ . 1 . 2]" 1
2666 1 144 GLU HB2 1 145 GLY H 5.990 . 5.990 4.042 4.025 4.064 . 0 0 "[ . 1 . 2]" 1
2667 1 144 GLU HG2 1 160 ILE MG 5.910 . 5.910 5.359 5.178 5.502 . 0 0 "[ . 1 . 2]" 1
2668 1 144 GLU HG2 1 147 LEU H 5.750 . 5.750 5.262 5.225 5.294 . 0 0 "[ . 1 . 2]" 1
2669 1 144 GLU HB3 1 147 LEU H 5.690 . 5.690 5.596 5.579 5.612 . 0 0 "[ . 1 . 2]" 1
2670 1 144 GLU HB2 1 147 LEU H 5.650 . 5.650 5.672 5.657 5.690 0.040 14 0 "[ . 1 . 2]" 1
2671 1 144 GLU H 1 145 GLY H 5.590 . 5.590 2.682 2.655 2.703 . 0 0 "[ . 1 . 2]" 1
2672 1 144 GLU HG2 1 160 ILE MD 5.540 . 5.540 4.021 3.774 4.295 . 0 0 "[ . 1 . 2]" 1
2673 1 144 GLU HA 1 147 LEU H 5.520 . 5.520 3.265 3.247 3.283 . 0 0 "[ . 1 . 2]" 1
2674 1 144 GLU HG3 1 160 ILE MD 5.490 . 5.490 2.771 2.450 3.127 . 0 0 "[ . 1 . 2]" 1
2675 1 144 GLU HB3 1 160 ILE MG 5.450 . 5.450 5.194 4.971 5.327 . 0 0 "[ . 1 . 2]" 1
2676 1 144 GLU HA 1 160 ILE HB 5.200 . 5.200 4.200 4.088 4.344 . 0 0 "[ . 1 . 2]" 1
2677 1 144 GLU HA 1 147 LEU MD2 5.160 . 5.160 5.210 5.179 5.240 0.080 13 0 "[ . 1 . 2]" 1
2678 1 144 GLU HG2 1 160 ILE HB 5.160 . 5.160 4.789 4.581 4.960 . 0 0 "[ . 1 . 2]" 1
2679 1 144 GLU HA 1 148 ASP HB3 5.150 . 5.150 5.141 5.051 5.178 0.028 9 0 "[ . 1 . 2]" 1
2680 1 144 GLU HA 1 160 ILE MD 5.150 . 5.150 3.859 3.686 4.160 . 0 0 "[ . 1 . 2]" 1
2681 1 144 GLU HG3 1 147 LEU H 5.140 . 5.140 5.168 5.142 5.195 0.055 18 0 "[ . 1 . 2]" 1
2682 1 144 GLU HB3 1 145 GLY H 5.070 . 5.070 2.787 2.759 2.810 . 0 0 "[ . 1 . 2]" 1
2683 1 144 GLU HG3 1 148 ASP H 5.060 . 5.060 4.077 4.041 4.109 . 0 0 "[ . 1 . 2]" 1
2684 1 144 GLU HG3 1 160 ILE HB 5.050 . 5.050 3.016 2.820 3.186 . 0 0 "[ . 1 . 2]" 1
2685 1 144 GLU HA 1 147 LEU MD1 5.040 . 5.040 3.426 3.220 3.535 . 0 0 "[ . 1 . 2]" 1
2686 1 144 GLU HA 1 160 ILE MG 5.040 . 5.040 3.724 3.515 3.934 . 0 0 "[ . 1 . 2]" 1
2687 1 144 GLU HA 1 148 ASP H 5.020 . 5.020 3.655 3.596 3.695 . 0 0 "[ . 1 . 2]" 1
2688 1 144 GLU H 1 144 GLU HG2 4.890 . 4.890 4.514 4.510 4.521 . 0 0 "[ . 1 . 2]" 1
2689 1 144 GLU HG2 1 148 ASP H 4.490 . 4.490 3.981 3.921 4.039 . 0 0 "[ . 1 . 2]" 1
2690 1 144 GLU HG3 1 148 ASP HB3 4.280 . 4.280 4.437 4.385 4.476 0.196 16 0 "[ . 1 . 2]" 1
2691 1 144 GLU HG2 1 148 ASP HB2 4.120 . 4.120 3.192 3.036 3.279 . 0 0 "[ . 1 . 2]" 1
2692 1 144 GLU O 1 148 ASP N . 2.700 3.300 2.939 2.871 2.974 . 0 0 "[ . 1 . 2]" 1
2693 1 144 GLU O 1 148 ASP H . . 2.300 1.953 1.886 1.989 . 0 0 "[ . 1 . 2]" 1
2694 1 145 GLY HA3 1 148 ASP HB3 5.830 . 5.830 5.086 4.927 5.185 . 0 0 "[ . 1 . 2]" 1
2695 1 145 GLY H 1 146 LEU H 5.820 . 5.820 2.782 2.753 2.815 . 0 0 "[ . 1 . 2]" 1
2696 1 145 GLY HA3 1 148 ASP H 5.520 . 5.520 5.164 5.096 5.214 . 0 0 "[ . 1 . 2]" 1
2697 1 145 GLY O 1 149 GLY N . 2.700 3.300 3.051 2.993 3.089 . 0 0 "[ . 1 . 2]" 1
2698 1 145 GLY O 1 149 GLY H . . 2.300 2.247 2.170 2.308 0.008 15 0 "[ . 1 . 2]" 1
2699 1 146 LEU HB2 1 147 LEU H 5.990 . 5.990 2.817 2.792 2.840 . 0 0 "[ . 1 . 2]" 1
2700 1 146 LEU MD1 1 147 LEU H 5.820 . 5.820 4.707 4.662 4.743 . 0 0 "[ . 1 . 2]" 1
2701 1 146 LEU HG 1 147 LEU H 5.760 . 5.760 4.646 4.620 4.671 . 0 0 "[ . 1 . 2]" 1
2702 1 146 LEU HA 1 148 ASP H 5.650 . 5.650 4.761 4.716 4.791 . 0 0 "[ . 1 . 2]" 1
2703 1 146 LEU H 1 147 LEU H 5.620 . 5.620 2.814 2.793 2.841 . 0 0 "[ . 1 . 2]" 1
2704 1 146 LEU HA 1 149 GLY H 5.330 . 5.330 3.520 3.484 3.566 . 0 0 "[ . 1 . 2]" 1
2705 1 146 LEU HB3 1 147 LEU H 5.220 . 5.220 3.692 3.677 3.713 . 0 0 "[ . 1 . 2]" 1
2706 1 143 ALA HA 1 146 LEU HB2 5.350 . 5.350 3.094 2.979 3.188 . 0 0 "[ . 1 . 2]" 1
2707 1 146 LEU O 1 150 CYS N . 2.700 3.300 3.307 3.290 3.323 0.023 13 0 "[ . 1 . 2]" 1
2708 1 146 LEU O 1 150 CYS H . . 2.300 2.344 2.333 2.364 0.064 19 0 "[ . 1 . 2]" 1
2709 1 147 LEU MD2 1 177 ILE MD 7.210 . 7.210 4.354 3.374 4.624 . 0 0 "[ . 1 . 2]" 1
2710 1 147 LEU HB3 1 151 ALA MB 7.080 . 7.080 4.988 4.803 5.078 . 0 0 "[ . 1 . 2]" 1
2711 1 147 LEU H 1 160 ILE HG13 6.370 . 6.370 6.642 6.592 6.692 0.322 1 0 "[ . 1 . 2]" 1
2712 1 147 LEU HG 1 148 ASP H 6.270 . 6.270 4.456 4.414 4.503 . 0 0 "[ . 1 . 2]" 1
2713 1 147 LEU H 1 148 ASP HA 6.180 . 6.180 5.179 5.158 5.190 . 0 0 "[ . 1 . 2]" 1
2714 1 147 LEU HA 1 148 ASP HA 6.110 . 6.110 4.680 4.665 4.701 . 0 0 "[ . 1 . 2]" 1
2715 1 147 LEU H 1 160 ILE MD 5.980 . 5.980 4.905 4.830 5.017 . 0 0 "[ . 1 . 2]" 1
2716 1 147 LEU HA 1 160 ILE MD 5.980 . 5.980 5.061 4.991 5.160 . 0 0 "[ . 1 . 2]" 1
2717 1 147 LEU H 1 147 LEU MD1 5.810 . 5.810 3.746 3.698 3.791 . 0 0 "[ . 1 . 2]" 1
2718 1 147 LEU MD2 1 148 ASP H 5.740 . 5.740 4.759 4.714 4.781 . 0 0 "[ . 1 . 2]" 1
2719 1 147 LEU MD1 1 148 ASP H 5.740 . 5.740 4.639 4.590 4.696 . 0 0 "[ . 1 . 2]" 1
2720 1 147 LEU H 1 147 LEU HG 5.620 . 5.620 2.442 2.411 2.489 . 0 0 "[ . 1 . 2]" 1
2721 1 147 LEU HB3 1 177 ILE HG13 6.190 2.350 6.190 6.278 6.228 6.442 0.252 10 0 "[ . 1 . 2]" 1
2722 1 147 LEU HA 1 151 ALA H 5.390 . 5.390 4.692 4.618 4.735 . 0 0 "[ . 1 . 2]" 1
2723 1 147 LEU HB2 1 177 ILE MG 5.280 . 5.280 5.599 5.554 5.707 0.427 10 0 "[ . 1 . 2]" 1
2724 1 147 LEU HG 1 160 ILE MD 5.240 . 5.240 5.027 4.971 5.143 . 0 0 "[ . 1 . 2]" 1
2725 1 147 LEU HA 1 148 ASP H 5.210 . 5.210 3.624 3.612 3.631 . 0 0 "[ . 1 . 2]" 1
2726 1 147 LEU MD1 1 160 ILE MD 5.210 . 5.210 3.373 3.289 3.485 . 0 0 "[ . 1 . 2]" 1
2727 1 147 LEU HA 1 150 CYS H 5.150 . 5.150 3.565 3.518 3.641 . 0 0 "[ . 1 . 2]" 1
2728 1 147 LEU HB3 1 160 ILE MD 5.120 . 5.120 3.175 3.047 3.323 . 0 0 "[ . 1 . 2]" 1
2729 1 147 LEU HB3 1 148 ASP H 4.850 . 4.850 3.665 3.638 3.723 . 0 0 "[ . 1 . 2]" 1
2730 1 147 LEU HB2 1 160 ILE MD 4.550 . 4.550 2.905 2.827 3.017 . 0 0 "[ . 1 . 2]" 1
2731 1 147 LEU H 1 148 ASP H 4.440 . 4.440 2.651 2.616 2.670 . 0 0 "[ . 1 . 2]" 1
2732 1 147 LEU MD1 1 177 ILE MD 4.260 . 4.260 3.123 1.961 3.386 . 0 0 "[ . 1 . 2]" 1
2733 1 147 LEU O 1 151 ALA N . 2.700 3.300 3.327 3.284 3.363 0.063 15 0 "[ . 1 . 2]" 1
2734 1 147 LEU O 1 151 ALA H . . 2.300 2.412 2.358 2.445 0.145 15 0 "[ . 1 . 2]" 1
2735 1 148 ASP H 1 151 ALA MB 6.260 . 6.260 4.977 4.840 5.073 . 0 0 "[ . 1 . 2]" 1
2736 1 148 ASP HB2 1 151 ALA H 5.930 . 5.930 5.451 5.391 5.516 . 0 0 "[ . 1 . 2]" 1
2737 1 148 ASP H 1 149 GLY HA3 5.740 . 5.740 4.924 4.891 4.946 . 0 0 "[ . 1 . 2]" 1
2738 1 148 ASP H 1 150 CYS HB3 6.290 . 6.290 5.573 5.493 6.353 0.063 15 0 "[ . 1 . 2]" 1
2739 1 148 ASP HB3 1 151 ALA H 5.580 . 5.580 5.396 5.340 5.458 . 0 0 "[ . 1 . 2]" 1
2740 1 148 ASP H 1 150 CYS H 5.420 . 5.420 4.327 4.293 4.432 . 0 0 "[ . 1 . 2]" 1
2741 1 148 ASP HB2 1 160 ILE H 5.400 . 5.400 5.755 5.709 5.844 0.444 18 0 "[ . 1 . 2]" 1
2742 1 148 ASP HA 1 149 GLY H 5.390 . 5.390 3.575 3.558 3.588 . 0 0 "[ . 1 . 2]" 1
2743 1 148 ASP HA 1 160 ILE MD 5.280 . 5.280 3.515 3.425 3.666 . 0 0 "[ . 1 . 2]" 1
2744 1 148 ASP HB3 1 160 ILE MD 5.230 . 5.230 4.513 4.417 4.621 . 0 0 "[ . 1 . 2]" 1
2745 1 148 ASP HA 1 150 CYS H 5.210 . 5.210 4.287 4.218 4.365 . 0 0 "[ . 1 . 2]" 1
2746 1 148 ASP H 1 149 GLY H 5.190 . 5.190 2.689 2.656 2.711 . 0 0 "[ . 1 . 2]" 1
2747 1 148 ASP HB3 1 149 GLY H 5.080 . 5.080 3.080 3.030 3.124 . 0 0 "[ . 1 . 2]" 1
2748 1 148 ASP HA 1 151 ALA H 5.010 . 5.010 3.019 2.945 3.084 . 0 0 "[ . 1 . 2]" 1
2749 1 148 ASP HB2 1 149 GLY H 4.960 . 4.960 4.213 4.182 4.229 . 0 0 "[ . 1 . 2]" 1
2750 1 148 ASP HB2 1 160 ILE MD 4.920 . 4.920 3.056 2.936 3.175 . 0 0 "[ . 1 . 2]" 1
2751 1 148 ASP HB2 1 160 ILE HG12 4.840 . 4.840 5.054 4.979 5.107 0.267 14 0 "[ . 1 . 2]" 1
2752 1 148 ASP H 1 160 ILE MD 4.650 . 4.650 3.627 3.511 3.733 . 0 0 "[ . 1 . 2]" 1
2753 1 148 ASP HA 1 151 ALA MB 4.560 . 4.560 2.617 2.428 2.775 . 0 0 "[ . 1 . 2]" 1
2754 1 148 ASP O 1 152 GLU N . 2.700 3.300 2.952 2.897 2.996 . 0 0 "[ . 1 . 2]" 1
2755 1 148 ASP O 1 152 GLU H . . 2.300 2.644 2.615 2.681 0.381 15 0 "[ . 1 . 2]" 1
2756 1 149 GLY H 1 150 CYS HB3 6.130 . 6.130 4.895 4.854 5.040 . 0 0 "[ . 1 . 2]" 1
2757 1 149 GLY H 1 152 GLU H 5.750 . 5.750 4.829 4.792 4.847 . 0 0 "[ . 1 . 2]" 1
2758 1 149 GLY HA2 1 152 GLU H 5.620 . 5.620 3.375 3.329 3.409 . 0 0 "[ . 1 . 2]" 1
2759 1 149 GLY H 1 151 ALA H 5.580 . 5.580 4.079 4.019 4.116 . 0 0 "[ . 1 . 2]" 1
2760 1 149 GLY H 1 150 CYS H 5.510 . 5.510 2.576 2.545 2.657 . 0 0 "[ . 1 . 2]" 1
2761 1 149 GLY HA2 1 152 GLU HB2 5.500 . 5.500 2.579 2.130 2.709 . 0 0 "[ . 1 . 2]" 1
2762 1 149 GLY HA2 1 152 GLU HA 5.340 . 5.340 4.790 4.680 4.844 . 0 0 "[ . 1 . 2]" 1
2763 1 149 GLY HA3 1 152 GLU H 5.310 . 5.310 4.362 4.331 4.387 . 0 0 "[ . 1 . 2]" 1
2764 1 149 GLY HA2 1 150 CYS H 5.210 . 5.210 3.584 3.576 3.622 . 0 0 "[ . 1 . 2]" 1
2765 1 149 GLY HA3 1 150 CYS H 4.870 . 4.870 2.784 2.772 2.804 . 0 0 "[ . 1 . 2]" 1
2766 1 149 GLY O 1 153 TYR N . 2.700 3.300 3.323 3.310 3.335 0.035 17 0 "[ . 1 . 2]" 1
2767 1 149 GLY O 1 153 TYR H . . 2.300 2.446 2.427 2.463 0.163 18 0 "[ . 1 . 2]" 1
2768 1 150 CYS HA 1 154 PHE QD 6.530 . 6.530 4.375 3.908 5.628 . 0 0 "[ . 1 . 2]" 1
2769 1 150 CYS H 1 151 ALA MB 6.230 . 6.230 4.588 4.489 4.642 . 0 0 "[ . 1 . 2]" 1
2770 1 150 CYS HA 1 153 TYR QD 5.990 . 5.990 5.587 5.408 5.808 . 0 0 "[ . 1 . 2]" 1
2771 1 150 CYS HA 1 154 PHE QE 5.940 . 5.940 5.029 4.579 6.007 0.067 10 0 "[ . 1 . 2]" 1
2772 1 150 CYS H 1 152 GLU H 5.880 . 5.880 3.839 3.816 3.864 . 0 0 "[ . 1 . 2]" 1
2773 1 150 CYS HB3 1 152 GLU H 5.740 . 5.740 4.612 4.565 5.224 . 0 0 "[ . 1 . 2]" 1
2774 1 150 CYS H 1 152 GLU HB2 5.330 . 5.330 4.945 4.682 5.035 . 0 0 "[ . 1 . 2]" 1
2775 1 150 CYS H 1 151 ALA H 5.250 . 5.250 2.869 2.844 2.891 . 0 0 "[ . 1 . 2]" 1
2776 1 150 CYS HA 1 151 ALA H 4.950 . 4.950 3.653 3.636 3.659 . 0 0 "[ . 1 . 2]" 1
2777 1 150 CYS HA 1 152 GLU H 4.840 . 4.840 3.474 3.345 3.511 . 0 0 "[ . 1 . 2]" 1
2778 1 150 CYS HB2 1 151 ALA H 4.760 . 4.760 3.972 3.938 4.201 . 0 0 "[ . 1 . 2]" 1
2779 1 150 CYS HB3 1 151 ALA H 4.470 . 4.470 2.737 2.639 4.102 . 0 0 "[ . 1 . 2]" 1
2780 1 150 CYS O 1 154 PHE N . 2.700 3.300 3.338 3.318 3.366 0.066 18 0 "[ . 1 . 2]" 1
2781 1 150 CYS O 1 154 PHE H . . 2.300 2.344 2.324 2.369 0.069 18 0 "[ . 1 . 2]" 1
2782 1 151 ALA MB 1 160 ILE MD 6.770 . 6.770 4.353 4.200 4.548 . 0 0 "[ . 1 . 2]" 1
2783 1 151 ALA MB 1 154 PHE QD 6.540 . 6.540 4.681 4.527 4.881 . 0 0 "[ . 1 . 2]" 1
2784 1 151 ALA H 1 154 PHE QD 6.450 . 6.450 5.070 4.772 5.881 . 0 0 "[ . 1 . 2]" 1
2785 1 151 ALA MB 1 156 GLU HB2 6.240 . 6.240 3.114 2.044 4.342 . 0 0 "[ . 1 . 2]" 1
2786 1 151 ALA MB 1 152 GLU HB2 6.050 . 6.050 5.123 4.679 5.234 . 0 0 "[ . 1 . 2]" 1
2787 1 151 ALA MB 1 153 TYR H 6.030 . 6.030 5.104 5.072 5.145 . 0 0 "[ . 1 . 2]" 1
2788 1 151 ALA MB 1 158 PHE HA 6.020 . 6.020 5.273 5.040 5.455 . 0 0 "[ . 1 . 2]" 1
2789 1 151 ALA MB 1 158 PHE QE 5.990 . 5.990 4.370 2.639 4.819 . 0 0 "[ . 1 . 2]" 1
2790 1 151 ALA H 1 152 GLU HB2 5.790 . 5.790 4.810 4.501 4.898 . 0 0 "[ . 1 . 2]" 1
2791 1 151 ALA HA 1 156 GLU HB2 5.720 . 5.720 3.691 3.138 4.783 . 0 0 "[ . 1 . 2]" 1
2792 1 151 ALA MB 1 158 PHE HB3 5.600 . 5.600 4.881 4.641 5.086 . 0 0 "[ . 1 . 2]" 1
2793 1 151 ALA H 1 153 TYR H 5.560 . 5.560 4.696 4.631 4.740 . 0 0 "[ . 1 . 2]" 1
2794 1 151 ALA HA 1 156 GLU HB3 5.480 . 5.480 4.326 3.961 5.068 . 0 0 "[ . 1 . 2]" 1
2795 1 151 ALA MB 1 152 GLU HA 5.400 . 5.400 3.920 3.840 3.965 . 0 0 "[ . 1 . 2]" 1
2796 1 151 ALA HA 1 154 PHE QE 5.370 . 5.370 5.432 5.305 5.576 0.206 6 0 "[ . 1 . 2]" 1
2797 1 151 ALA HA 1 154 PHE QD 5.250 . 5.250 3.385 3.121 3.807 . 0 0 "[ . 1 . 2]" 1
2798 1 151 ALA MB 1 156 GLU HB3 5.160 . 5.160 2.938 2.352 3.874 . 0 0 "[ . 1 . 2]" 1
2799 1 151 ALA H 1 152 GLU H 5.140 . 5.140 2.621 2.594 2.663 . 0 0 "[ . 1 . 2]" 1
2800 1 151 ALA MB 1 158 PHE HB2 5.060 . 5.060 3.426 3.168 3.633 . 0 0 "[ . 1 . 2]" 1
2801 1 151 ALA HA 1 156 GLU H 4.980 . 4.980 3.797 3.604 3.916 . 0 0 "[ . 1 . 2]" 1
2802 1 151 ALA MB 1 156 GLU H 4.770 . 4.770 2.892 2.730 3.115 . 0 0 "[ . 1 . 2]" 1
2803 1 151 ALA MB 1 157 ASP HA 4.750 . 4.750 3.697 3.389 4.050 . 0 0 "[ . 1 . 2]" 1
2804 1 151 ALA MB 1 158 PHE QD 4.660 . 4.660 3.646 1.942 4.108 . 0 0 "[ . 1 . 2]" 1
2805 1 151 ALA HA 1 154 PHE H 4.580 . 4.580 3.276 3.187 3.324 . 0 0 "[ . 1 . 2]" 1
2806 1 151 ALA HA 1 152 GLU H 4.510 . 4.510 3.261 3.236 3.281 . 0 0 "[ . 1 . 2]" 1
2807 1 151 ALA MB 1 158 PHE H 4.370 . 4.370 3.299 3.047 3.566 . 0 0 "[ . 1 . 2]" 1
2808 1 151 ALA MB 1 152 GLU H 3.960 . 3.960 3.377 3.338 3.435 . 0 0 "[ . 1 . 2]" 1
2809 1 151 ALA O 1 155 LYS N . 2.700 3.300 3.078 3.040 3.117 . 0 0 "[ . 1 . 2]" 1
2810 1 151 ALA O 1 155 LYS H . . 2.300 2.409 2.377 2.451 0.151 2 0 "[ . 1 . 2]" 1
2811 1 152 GLU H 1 154 PHE QD 6.730 . 6.730 5.047 4.685 5.922 . 0 0 "[ . 1 . 2]" 1
2812 1 152 GLU H 1 155 LYS H 6.000 . 6.000 4.272 4.196 4.328 . 0 0 "[ . 1 . 2]" 1
2813 1 152 GLU HA 1 154 PHE HB2 5.450 . 5.450 5.655 5.581 5.703 0.253 15 0 "[ . 1 . 2]" 1
2814 1 152 GLU H 1 153 TYR H 5.140 . 5.140 2.407 2.348 2.440 . 0 0 "[ . 1 . 2]" 1
2815 1 152 GLU H 1 156 GLU H 5.000 . 5.000 5.199 5.108 5.282 0.282 14 0 "[ . 1 . 2]" 1
2816 1 152 GLU HA 1 153 TYR H 5.000 . 5.000 3.659 3.652 3.667 . 0 0 "[ . 1 . 2]" 1
2817 1 152 GLU HA 1 156 GLU H 4.950 . 4.950 3.988 3.893 4.132 . 0 0 "[ . 1 . 2]" 1
2818 1 152 GLU HA 1 155 LYS H 4.820 . 4.820 3.339 3.284 3.399 . 0 0 "[ . 1 . 2]" 1
2819 1 152 GLU HB3 1 153 TYR H 4.800 . 4.800 3.479 2.501 3.601 . 0 0 "[ . 1 . 2]" 1
2820 1 152 GLU HB2 1 153 TYR H 4.380 . 4.380 2.725 2.624 3.678 . 0 0 "[ . 1 . 2]" 1
2821 1 153 TYR HB2 1 154 PHE QD 6.080 . 6.080 5.349 4.965 5.750 . 0 0 "[ . 1 . 2]" 1
2822 1 153 TYR QD 1 154 PHE QD 5.930 . 5.930 3.546 2.148 4.146 . 0 0 "[ . 1 . 2]" 1
2823 1 153 TYR HB2 1 155 LYS H 5.730 . 5.730 5.732 5.694 5.760 0.030 6 0 "[ . 1 . 2]" 1
2824 1 153 TYR H 1 155 LYS H 5.650 . 5.650 3.962 3.921 4.011 . 0 0 "[ . 1 . 2]" 1
2825 1 153 TYR H 1 154 PHE H 5.440 . 5.440 2.744 2.701 2.775 . 0 0 "[ . 1 . 2]" 1
2826 1 153 TYR HA 1 154 PHE H 5.120 . 5.120 3.665 3.655 3.673 . 0 0 "[ . 1 . 2]" 1
2827 1 153 TYR QD 1 154 PHE H 4.990 . 4.990 3.591 3.487 3.748 . 0 0 "[ . 1 . 2]" 1
2828 1 153 TYR HB2 1 154 PHE H 4.450 . 4.450 4.076 4.054 4.113 . 0 0 "[ . 1 . 2]" 1
2829 1 154 PHE H 1 155 LYS HA 5.980 . 5.980 4.868 4.837 4.891 . 0 0 "[ . 1 . 2]" 1
2830 1 154 PHE HA 1 156 GLU H 5.820 . 5.820 5.840 5.663 5.953 0.133 18 0 "[ . 1 . 2]" 1
2831 1 154 PHE HB2 1 155 LYS H 5.650 . 5.650 3.207 3.172 3.243 . 0 0 "[ . 1 . 2]" 1
2832 1 154 PHE HB2 1 156 GLU H 5.260 . 5.260 4.248 4.019 4.399 . 0 0 "[ . 1 . 2]" 1
2833 1 154 PHE H 1 155 LYS H 5.220 . 5.220 2.655 2.625 2.674 . 0 0 "[ . 1 . 2]" 1
2834 1 154 PHE H 1 156 GLU H 5.080 . 5.080 4.961 4.767 5.095 0.015 18 0 "[ . 1 . 2]" 1
2835 1 154 PHE HA 1 155 LYS H 4.840 . 4.840 3.562 3.551 3.571 . 0 0 "[ . 1 . 2]" 1
2836 1 155 LYS H 1 156 GLU HB2 5.570 . 5.570 4.519 4.364 4.862 . 0 0 "[ . 1 . 2]" 1
2837 1 155 LYS HA 1 155 LYS HD3 5.460 . 5.460 4.634 4.377 4.730 . 0 0 "[ . 1 . 2]" 1
2838 1 155 LYS HB3 1 156 GLU H 5.430 . 5.430 4.457 4.294 4.542 . 0 0 "[ . 1 . 2]" 1
2839 1 155 LYS HA 1 155 LYS HD2 5.380 . 5.380 4.447 4.105 4.807 . 0 0 "[ . 1 . 2]" 1
2840 1 155 LYS HG3 1 156 GLU H 5.150 . 5.150 4.698 4.387 5.240 0.090 2 0 "[ . 1 . 2]" 1
2841 1 155 LYS H 1 155 LYS QG 5.040 . 5.040 3.876 3.077 4.168 . 0 0 "[ . 1 . 2]" 1
2842 1 155 LYS H 1 156 GLU H 4.960 . 4.960 2.942 2.819 3.040 . 0 0 "[ . 1 . 2]" 1
2843 1 155 LYS HB2 1 156 GLU H 4.920 . 4.920 4.732 4.576 4.784 . 0 0 "[ . 1 . 2]" 1
2844 1 155 LYS HA 1 155 LYS HG3 4.410 . 4.410 2.566 2.209 3.035 . 0 0 "[ . 1 . 2]" 1
2845 1 155 LYS HA 1 155 LYS HG2 4.410 . 4.410 2.863 2.403 3.086 . 0 0 "[ . 1 . 2]" 1
2846 1 155 LYS HA 1 156 GLU H 4.130 . 4.130 2.447 2.384 2.522 . 0 0 "[ . 1 . 2]" 1
2847 1 156 GLU H 1 156 GLU HG3 5.630 . 5.630 4.514 3.375 4.790 . 0 0 "[ . 1 . 2]" 1
2848 1 156 GLU H 1 157 ASP H 5.580 . 5.580 4.323 3.985 4.425 . 0 0 "[ . 1 . 2]" 1
2849 1 156 GLU HG3 1 157 ASP H 4.970 . 4.970 2.788 1.765 4.657 . 0 0 "[ . 1 . 2]" 1
2850 1 156 GLU HG2 1 157 ASP H 4.880 . 4.880 3.662 3.085 4.800 . 0 0 "[ . 1 . 2]" 1
2851 1 156 GLU HB2 1 157 ASP H 4.760 . 4.760 3.638 3.122 4.644 . 0 0 "[ . 1 . 2]" 1
2852 1 156 GLU HB3 1 157 ASP H 4.570 . 4.570 2.420 1.741 4.098 . 0 0 "[ . 1 . 2]" 1
2853 1 156 GLU HA 1 157 ASP H 4.090 . 4.090 2.767 2.239 2.878 . 0 0 "[ . 1 . 2]" 1
2854 1 157 ASP H 1 180 ALA MB 6.260 . 6.260 5.754 4.871 6.357 0.097 6 0 "[ . 1 . 2]" 1
2855 1 157 ASP HB2 1 180 ALA H 6.050 . 6.050 5.856 4.738 6.185 0.135 18 0 "[ . 1 . 2]" 1
2856 1 157 ASP HB3 1 180 ALA H 5.510 . 5.510 5.058 4.543 5.655 0.145 13 0 "[ . 1 . 2]" 1
2857 1 157 ASP HB2 1 180 ALA MB 5.160 . 5.160 4.500 3.094 5.140 . 0 0 "[ . 1 . 2]" 1
2858 1 157 ASP H 1 158 PHE H 5.070 . 5.070 3.751 3.546 4.360 . 0 0 "[ . 1 . 2]" 1
2859 1 157 ASP HB2 1 158 PHE H 4.880 . 4.880 4.668 4.539 4.732 . 0 0 "[ . 1 . 2]" 1
2860 1 157 ASP HB3 1 158 PHE H 4.680 . 4.680 3.982 3.626 4.130 . 0 0 "[ . 1 . 2]" 1
2861 1 157 ASP HA 1 158 PHE H 4.050 . 4.050 2.271 2.174 2.325 . 0 0 "[ . 1 . 2]" 1
2862 1 158 PHE QD 1 179 ARG HB2 6.640 . 6.640 4.661 3.402 5.813 . 0 0 "[ . 1 . 2]" 1
2863 1 158 PHE HA 1 160 ILE MD 6.340 . 6.340 4.811 4.703 4.941 . 0 0 "[ . 1 . 2]" 1
2864 1 158 PHE H 1 160 ILE MD 6.230 . 6.230 4.356 4.225 4.463 . 0 0 "[ . 1 . 2]" 1
2865 1 158 PHE HA 1 179 ARG H 5.940 . 5.940 5.875 5.710 6.036 0.096 17 0 "[ . 1 . 2]" 1
2866 1 158 PHE QD 1 179 ARG HB3 5.770 . 5.770 5.119 3.891 5.788 0.018 8 0 "[ . 1 . 2]" 1
2867 1 158 PHE QE 1 179 ARG HA 5.740 . 5.740 4.572 4.036 4.982 . 0 0 "[ . 1 . 2]" 1
2868 1 158 PHE QD 1 177 ILE MG 5.720 . 5.720 3.348 3.207 3.493 . 0 0 "[ . 1 . 2]" 1
2869 1 158 PHE HA 1 179 ARG HB3 5.700 . 5.700 5.652 4.597 6.084 0.384 10 0 "[ . 1 . 2]" 1
2870 1 158 PHE HA 1 180 ALA MB 5.610 . 5.610 3.996 3.182 4.877 . 0 0 "[ . 1 . 2]" 1
2871 1 158 PHE HB2 1 177 ILE MG 5.300 . 5.300 3.906 3.651 4.150 . 0 0 "[ . 1 . 2]" 1
2872 1 158 PHE HB2 1 159 THR H 5.180 . 5.180 3.868 3.786 3.922 . 0 0 "[ . 1 . 2]" 1
2873 1 158 PHE H 1 159 THR H 5.160 . 5.160 4.540 4.425 4.577 . 0 0 "[ . 1 . 2]" 1
2874 1 158 PHE HB3 1 160 ILE MD 5.140 . 5.140 3.460 3.265 3.735 . 0 0 "[ . 1 . 2]" 1
2875 1 158 PHE HB3 1 177 ILE MG 5.120 . 5.120 2.785 2.627 3.002 . 0 0 "[ . 1 . 2]" 1
2876 1 158 PHE HB3 1 159 THR H 5.030 . 5.030 2.617 2.448 2.831 . 0 0 "[ . 1 . 2]" 1
2877 1 158 PHE HA 1 180 ALA H 5.010 . 5.010 3.174 2.607 3.829 . 0 0 "[ . 1 . 2]" 1
2878 1 158 PHE HB2 1 160 ILE MD 4.990 . 4.990 3.257 3.092 3.478 . 0 0 "[ . 1 . 2]" 1
2879 1 158 PHE QD 1 159 THR H 4.860 . 4.860 4.134 4.013 4.206 . 0 0 "[ . 1 . 2]" 1
2880 1 158 PHE QD 1 180 ALA H 4.850 . 4.850 4.146 3.245 5.054 0.204 14 0 "[ . 1 . 2]" 1
2881 1 158 PHE HA 1 179 ARG HA 4.810 . 4.810 3.147 2.929 3.255 . 0 0 "[ . 1 . 2]" 1
2882 1 158 PHE QD 1 179 ARG HA 4.810 . 4.810 3.492 3.111 3.788 . 0 0 "[ . 1 . 2]" 1
2883 1 158 PHE HA 1 159 THR H 4.220 . 4.220 2.501 2.417 2.598 . 0 0 "[ . 1 . 2]" 1
2884 1 159 THR H 1 180 ALA H 6.240 . 6.240 3.702 3.348 4.312 . 0 0 "[ . 1 . 2]" 1
2885 1 159 THR MG 1 161 SER H 6.030 . 6.030 3.946 3.790 4.052 . 0 0 "[ . 1 . 2]" 1
2886 1 159 THR HB 1 180 ALA H 5.700 . 5.700 4.401 3.680 5.115 . 0 0 "[ . 1 . 2]" 1
2887 1 159 THR HB 1 161 SER HB2 5.660 . 5.660 5.550 5.101 5.657 . 0 0 "[ . 1 . 2]" 1
2888 1 159 THR HA 1 178 THR H 5.570 . 5.570 5.147 5.009 5.249 . 0 0 "[ . 1 . 2]" 1
2889 1 159 THR HB 1 178 THR HA 5.540 . 5.540 5.552 5.416 5.620 0.080 11 0 "[ . 1 . 2]" 1
2890 1 159 THR H 1 177 ILE HA 5.500 . 5.500 4.657 4.505 4.808 . 0 0 "[ . 1 . 2]" 1
2891 1 159 THR H 1 177 ILE MG 5.410 . 5.410 3.262 3.134 3.406 . 0 0 "[ . 1 . 2]" 1
2892 1 159 THR HB 1 178 THR MG 5.340 . 5.340 4.564 4.325 4.791 . 0 0 "[ . 1 . 2]" 1
2893 1 159 THR H 1 178 THR HB 5.080 . 5.080 4.799 4.155 5.367 0.287 1 0 "[ . 1 . 2]" 1
2894 1 159 THR H 1 179 ARG HA 4.990 . 4.990 3.535 3.143 3.815 . 0 0 "[ . 1 . 2]" 1
2895 1 159 THR HB 1 160 ILE H 4.950 . 4.950 4.214 4.180 4.268 . 0 0 "[ . 1 . 2]" 1
2896 1 159 THR HB 1 178 THR H 4.860 . 4.860 3.423 3.339 3.557 . 0 0 "[ . 1 . 2]" 1
2897 1 159 THR H 1 178 THR H 4.720 . 4.720 3.429 3.158 3.686 . 0 0 "[ . 1 . 2]" 1
2898 1 159 THR HB 1 178 THR HB 4.700 . 4.700 3.752 3.166 4.890 0.190 9 0 "[ . 1 . 2]" 1
2899 1 159 THR MG 1 160 ILE H 4.110 . 4.110 2.488 2.258 2.631 . 0 0 "[ . 1 . 2]" 1
2900 1 159 THR HA 1 160 ILE H 3.790 . 3.790 2.165 2.144 2.185 . 0 0 "[ . 1 . 2]" 1
2901 1 159 THR O 1 178 THR N . 2.700 3.300 3.123 3.053 3.174 . 0 0 "[ . 1 . 2]" 1
2902 1 159 THR N 1 178 THR O . 2.700 3.300 3.248 3.128 3.333 0.033 3 0 "[ . 1 . 2]" 1
2903 1 159 THR O 1 178 THR H . . 2.300 2.200 2.102 2.259 . 0 0 "[ . 1 . 2]" 1
2904 1 159 THR H 1 178 THR O . . 2.300 2.299 2.131 2.422 0.122 18 0 "[ . 1 . 2]" 1
2905 1 160 ILE MG 1 162 ARG H 6.630 . 6.630 5.103 5.044 5.205 . 0 0 "[ . 1 . 2]" 1
2906 1 160 ILE MG 1 175 PHE HZ 6.470 . 6.470 5.503 5.268 5.677 . 0 0 "[ . 1 . 2]" 1
2907 1 160 ILE HG13 1 177 ILE HG12 6.360 . 6.360 2.629 1.907 2.805 . 0 0 "[ . 1 . 2]" 1
2908 1 160 ILE MG 1 161 SER HB2 6.330 . 6.330 4.621 4.543 4.735 . 0 0 "[ . 1 . 2]" 1
2909 1 160 ILE HG13 1 177 ILE HG13 6.190 . 6.190 3.088 2.999 3.523 . 0 0 "[ . 1 . 2]" 1
2910 1 160 ILE MG 1 162 ARG HA 6.180 . 6.180 4.766 4.704 4.872 . 0 0 "[ . 1 . 2]" 1
2911 1 160 ILE HA 1 161 SER HA 6.170 . 6.170 4.371 4.363 4.379 . 0 0 "[ . 1 . 2]" 1
2912 1 160 ILE MG 1 177 ILE MG 6.150 . 6.150 3.974 3.834 4.048 . 0 0 "[ . 1 . 2]" 1
2913 1 160 ILE MG 1 161 SER HA 5.740 . 5.740 3.608 3.502 3.754 . 0 0 "[ . 1 . 2]" 1
2914 1 160 ILE HG12 1 161 SER H 5.670 . 5.670 5.486 5.453 5.535 . 0 0 "[ . 1 . 2]" 1
2915 1 160 ILE MD 1 177 ILE HA 5.660 . 5.660 4.767 4.704 4.829 . 0 0 "[ . 1 . 2]" 1
2916 1 160 ILE H 1 160 ILE MD 5.580 . 5.580 2.053 1.875 2.162 . 0 0 "[ . 1 . 2]" 1
2917 1 160 ILE MD 1 177 ILE HG12 5.510 . 5.510 4.192 3.669 4.353 . 0 0 "[ . 1 . 2]" 1
2918 1 160 ILE MG 1 175 PHE QE 5.490 . 5.490 3.905 3.624 4.064 . 0 0 "[ . 1 . 2]" 1
2919 1 160 ILE MG 1 175 PHE HA 5.490 . 5.490 4.442 4.291 4.538 . 0 0 "[ . 1 . 2]" 1
2920 1 160 ILE HA 1 177 ILE MG 5.430 . 5.430 3.338 3.112 3.566 . 0 0 "[ . 1 . 2]" 1
2921 1 160 ILE MG 1 175 PHE HB3 5.390 . 5.390 3.046 2.778 3.168 . 0 0 "[ . 1 . 2]" 1
2922 1 160 ILE MG 1 175 PHE HB2 5.380 . 5.380 4.387 4.058 4.521 . 0 0 "[ . 1 . 2]" 1
2923 1 160 ILE HA 1 177 ILE MD 5.370 . 5.370 4.427 4.206 4.491 . 0 0 "[ . 1 . 2]" 1
2924 1 160 ILE HG13 1 178 THR H 5.350 . 5.350 5.251 5.077 5.345 . 0 0 "[ . 1 . 2]" 1
2925 1 160 ILE HB 1 161 SER H 5.300 . 5.300 4.284 4.231 4.343 . 0 0 "[ . 1 . 2]" 1
2926 1 160 ILE HA 1 177 ILE H 5.280 . 5.280 5.056 4.628 5.159 . 0 0 "[ . 1 . 2]" 1
2927 1 160 ILE MG 1 177 ILE HA 5.220 . 5.220 3.877 3.676 4.010 . 0 0 "[ . 1 . 2]" 1
2928 1 160 ILE HA 1 177 ILE HA 5.200 . 5.200 2.552 2.417 2.600 . 0 0 "[ . 1 . 2]" 1
2929 1 160 ILE HA 1 178 THR H 5.180 . 5.180 3.826 3.627 3.922 . 0 0 "[ . 1 . 2]" 1
2930 1 160 ILE HG12 1 177 ILE MG 5.170 . 5.170 4.128 4.033 4.286 . 0 0 "[ . 1 . 2]" 1
2931 1 160 ILE HG13 1 177 ILE HA 5.150 . 5.150 3.928 3.888 3.993 . 0 0 "[ . 1 . 2]" 1
2932 1 160 ILE H 1 178 THR H 5.150 . 5.150 5.330 5.249 5.390 0.240 2 0 "[ . 1 . 2]" 1
2933 1 160 ILE HG13 1 177 ILE MG 5.130 . 5.130 2.644 2.535 2.851 . 0 0 "[ . 1 . 2]" 1
2934 1 160 ILE HG12 1 177 ILE HG13 4.520 . 4.520 4.236 4.181 4.502 . 0 0 "[ . 1 . 2]" 1
2935 1 160 ILE HA 1 161 SER HB2 4.970 . 4.970 4.405 4.320 4.476 . 0 0 "[ . 1 . 2]" 1
2936 1 160 ILE MG 1 177 ILE HG12 4.920 . 4.920 3.183 2.468 3.384 . 0 0 "[ . 1 . 2]" 1
2937 1 160 ILE H 1 177 ILE HA 4.810 . 4.810 5.065 5.018 5.100 0.290 7 0 "[ . 1 . 2]" 1
2938 1 160 ILE HB 1 177 ILE HG13 4.850 2.150 4.850 4.986 4.913 5.263 0.413 10 0 "[ . 1 . 2]" 1
2939 1 160 ILE MG 1 177 ILE MD 4.730 . 4.730 3.342 2.978 3.486 . 0 0 "[ . 1 . 2]" 1
2940 1 160 ILE HG13 1 177 ILE HB 4.540 . 4.540 4.956 4.850 4.984 0.444 15 0 "[ . 1 . 2]" 1
2941 1 160 ILE MG 1 175 PHE QD 4.370 . 4.370 2.877 2.671 3.023 . 0 0 "[ . 1 . 2]" 1
2942 1 160 ILE HA 1 161 SER H 4.220 . 4.220 2.239 2.227 2.268 . 0 0 "[ . 1 . 2]" 1
2943 1 160 ILE HA 1 177 ILE HG13 4.170 . 4.170 2.846 2.739 3.230 . 0 0 "[ . 1 . 2]" 1
2944 1 160 ILE MG 1 161 SER H 4.080 . 4.080 2.535 2.419 2.699 . 0 0 "[ . 1 . 2]" 1
2945 1 161 SER H 1 162 ARG HA 6.250 . 6.250 4.854 4.798 4.895 . 0 0 "[ . 1 . 2]" 1
2946 1 161 SER HA 1 176 ASN H 6.090 . 6.090 4.823 4.711 4.878 . 0 0 "[ . 1 . 2]" 1
2947 1 161 SER H 1 177 ILE HB 5.960 . 5.960 5.789 5.582 5.899 . 0 0 "[ . 1 . 2]" 1
2948 1 161 SER H 1 177 ILE MG 5.950 . 5.950 4.713 4.458 4.934 . 0 0 "[ . 1 . 2]" 1
2949 1 161 SER HB2 1 178 THR H 5.900 . 5.900 4.847 4.256 5.147 . 0 0 "[ . 1 . 2]" 1
2950 1 161 SER H 1 177 ILE HG12 5.720 . 5.720 5.083 4.189 5.267 . 0 0 "[ . 1 . 2]" 1
2951 1 161 SER H 1 178 THR H 5.640 . 5.640 4.372 3.947 4.582 . 0 0 "[ . 1 . 2]" 1
2952 1 161 SER HB2 1 177 ILE H 5.620 . 5.620 5.628 5.389 5.701 0.081 1 0 "[ . 1 . 2]" 1
2953 1 161 SER H 1 177 ILE MD 5.530 . 5.530 4.778 4.647 5.180 . 0 0 "[ . 1 . 2]" 1
2954 1 161 SER H 1 175 PHE HA 5.510 . 5.510 4.975 4.813 5.051 . 0 0 "[ . 1 . 2]" 1
2955 1 161 SER H 1 176 ASN HB3 5.350 . 5.350 3.642 3.535 3.850 . 0 0 "[ . 1 . 2]" 1
2956 1 161 SER H 1 176 ASN HB2 5.350 . 5.350 5.079 5.001 5.225 . 0 0 "[ . 1 . 2]" 1
2957 1 161 SER HB2 1 176 ASN HB3 5.290 . 5.290 2.548 2.401 3.019 . 0 0 "[ . 1 . 2]" 1
2958 1 161 SER HB2 1 176 ASN HB2 5.210 . 5.210 4.287 4.144 4.778 . 0 0 "[ . 1 . 2]" 1
2959 1 161 SER H 1 176 ASN HA 5.110 . 5.110 4.828 4.780 4.883 . 0 0 "[ . 1 . 2]" 1
2960 1 161 SER H 1 162 ARG H 4.930 . 4.930 4.387 4.357 4.443 . 0 0 "[ . 1 . 2]" 1
2961 1 161 SER H 1 176 ASN H 4.770 . 4.770 3.051 2.945 3.121 . 0 0 "[ . 1 . 2]" 1
2962 1 161 SER HB2 1 162 ARG H 4.550 . 4.550 3.415 3.342 3.729 . 0 0 "[ . 1 . 2]" 1
2963 1 161 SER H 1 177 ILE HA 4.340 . 4.340 3.117 2.824 3.243 . 0 0 "[ . 1 . 2]" 1
2964 1 161 SER H 1 177 ILE HG13 4.170 . 4.170 3.594 3.521 3.802 . 0 0 "[ . 1 . 2]" 1
2965 1 161 SER HA 1 162 ARG H 3.850 . 3.850 2.747 2.696 2.793 . 0 0 "[ . 1 . 2]" 1
2966 1 161 SER O 1 176 ASN N . 2.700 3.300 3.354 3.315 3.373 0.073 7 0 "[ . 1 . 2]" 1
2967 1 161 SER N 1 176 ASN O . 2.700 3.300 2.871 2.762 3.306 0.006 20 0 "[ . 1 . 2]" 1
2968 1 161 SER H 1 176 ASN O . . 2.300 1.920 1.794 2.444 0.144 18 0 "[ . 1 . 2]" 1
2969 1 161 SER O 1 176 ASN H . . 2.300 2.378 2.329 2.399 0.099 19 0 "[ . 1 . 2]" 1
2970 1 162 ARG HD3 1 173 VAL MG1 6.310 . 6.310 5.297 4.633 5.544 . 0 0 "[ . 1 . 2]" 1
2971 1 162 ARG HB3 1 163 THR H 6.270 . 6.270 3.772 3.338 3.943 . 0 0 "[ . 1 . 2]" 1
2972 1 162 ARG HB2 1 176 ASN H 6.190 . 6.190 5.884 5.658 6.109 . 0 0 "[ . 1 . 2]" 1
2973 1 162 ARG HA 1 163 THR MG 6.100 . 6.100 3.752 3.637 3.966 . 0 0 "[ . 1 . 2]" 1
2974 1 162 ARG HD2 1 167 GLN H 5.980 . 5.980 5.675 5.428 5.998 0.018 17 0 "[ . 1 . 2]" 1
2975 1 162 ARG H 1 176 ASN HB3 5.940 . 5.940 4.447 4.399 4.525 . 0 0 "[ . 1 . 2]" 1
2976 1 162 ARG HD2 1 173 VAL MG1 5.800 . 5.800 5.490 5.109 5.876 0.076 3 0 "[ . 1 . 2]" 1
2977 1 162 ARG HA 1 175 PHE HB2 5.700 . 5.700 5.488 5.367 5.582 . 0 0 "[ . 1 . 2]" 1
2978 1 162 ARG HG2 1 163 THR H 5.530 . 5.530 5.131 4.970 5.354 . 0 0 "[ . 1 . 2]" 1
2979 1 162 ARG HD2 1 167 GLN HB2 5.440 . 5.440 2.899 2.491 3.534 . 0 0 "[ . 1 . 2]" 1
2980 1 162 ARG HB2 1 175 PHE HA 5.410 . 5.410 4.719 4.519 4.987 . 0 0 "[ . 1 . 2]" 1
2981 1 162 ARG HA 1 175 PHE QD 5.370 . 5.370 3.467 3.345 3.575 . 0 0 "[ . 1 . 2]" 1
2982 1 162 ARG HB2 1 167 GLN H 5.370 . 5.370 5.200 5.006 5.401 0.031 1 0 "[ . 1 . 2]" 1
2983 1 162 ARG HD3 1 167 GLN HB3 5.320 . 5.320 4.774 4.174 5.629 0.309 20 0 "[ . 1 . 2]" 1
2984 1 162 ARG HB2 1 167 GLN HA 5.280 . 5.280 3.958 3.675 4.206 . 0 0 "[ . 1 . 2]" 1
2985 1 162 ARG HA 1 173 VAL MG1 5.270 . 5.270 4.491 4.378 4.604 . 0 0 "[ . 1 . 2]" 1
2986 1 162 ARG HD3 1 167 GLN HB2 5.270 . 5.270 4.220 3.524 4.715 . 0 0 "[ . 1 . 2]" 1
2987 1 162 ARG H 1 162 ARG HG2 5.230 . 5.230 2.742 2.343 3.772 . 0 0 "[ . 1 . 2]" 1
2988 1 162 ARG HD2 1 167 GLN HB3 5.220 . 5.220 3.312 2.943 4.622 . 0 0 "[ . 1 . 2]" 1
2989 1 162 ARG HD3 1 167 GLN HA 5.210 . 5.210 5.069 3.907 5.349 0.139 13 0 "[ . 1 . 2]" 1
2990 1 162 ARG HA 1 175 PHE H 5.160 . 5.160 5.234 5.148 5.302 0.142 12 0 "[ . 1 . 2]" 1
2991 1 162 ARG HB2 1 167 GLN HG2 5.120 . 5.120 5.304 4.976 5.455 0.335 14 0 "[ . 1 . 2]" 1
2992 1 162 ARG HD2 1 167 GLN HA 4.860 . 4.860 4.208 3.764 4.896 0.036 17 0 "[ . 1 . 2]" 1
2993 1 162 ARG H 1 175 PHE HA 4.770 . 4.770 5.064 4.976 5.112 0.342 15 0 "[ . 1 . 2]" 1
2994 1 162 ARG HB2 1 163 THR H 4.740 . 4.740 2.732 2.558 2.855 . 0 0 "[ . 1 . 2]" 1
2995 1 162 ARG HA 1 176 ASN H 4.060 . 4.060 3.266 3.065 3.454 . 0 0 "[ . 1 . 2]" 1
2996 1 162 ARG HA 1 163 THR H 4.040 . 4.040 2.470 2.444 2.527 . 0 0 "[ . 1 . 2]" 1
2997 1 163 THR HB 1 166 THR MG 6.670 . 6.670 5.541 5.329 5.724 . 0 0 "[ . 1 . 2]" 1
2998 1 163 THR HA 1 166 THR H 5.150 . 5.150 5.263 5.188 5.297 0.147 1 0 "[ . 1 . 2]" 1
2999 1 163 THR MG 1 167 GLN H 6.220 . 6.220 5.968 5.934 6.000 . 0 0 "[ . 1 . 2]" 1
3000 1 163 THR HB 1 164 PRO HG2 6.120 . 6.120 4.083 3.922 4.785 . 0 0 "[ . 1 . 2]" 1
3001 1 163 THR HA 1 164 PRO HA 6.110 . 6.110 4.303 4.294 4.321 . 0 0 "[ . 1 . 2]" 1
3002 1 163 THR H 1 164 PRO HD3 6.100 . 6.100 4.749 4.462 4.811 . 0 0 "[ . 1 . 2]" 1
3003 1 163 THR HB 1 164 PRO HG3 6.050 . 6.050 4.825 4.762 5.014 . 0 0 "[ . 1 . 2]" 1
3004 1 163 THR MG 1 176 ASN H 5.840 . 5.840 4.637 4.452 4.881 . 0 0 "[ . 1 . 2]" 1
3005 1 163 THR MG 1 165 GLU HB3 5.810 . 5.810 4.920 4.744 5.977 0.167 15 0 "[ . 1 . 2]" 1
3006 1 163 THR MG 1 164 PRO HD3 5.780 . 5.780 3.621 3.049 3.719 . 0 0 "[ . 1 . 2]" 1
3007 1 163 THR H 1 167 GLN H 5.660 . 5.660 5.043 4.969 5.115 . 0 0 "[ . 1 . 2]" 1
3008 1 163 THR MG 1 166 THR H 5.630 . 5.630 4.908 4.817 5.010 . 0 0 "[ . 1 . 2]" 1
3009 1 163 THR H 1 164 PRO HD2 5.600 . 5.600 4.860 4.782 5.242 . 0 0 "[ . 1 . 2]" 1
3010 1 163 THR H 1 165 GLU H 5.580 . 5.580 4.954 4.885 5.034 . 0 0 "[ . 1 . 2]" 1
3011 1 163 THR HA 1 174 ILE HB 5.570 . 5.570 5.289 5.194 5.683 0.113 13 0 "[ . 1 . 2]" 1
3012 1 163 THR MG 1 174 ILE HG12 5.560 . 5.560 4.898 4.749 5.462 . 0 0 "[ . 1 . 2]" 1
3013 1 163 THR HB 1 174 ILE MG 5.490 . 5.490 4.526 4.381 4.939 . 0 0 "[ . 1 . 2]" 1
3014 1 163 THR HB 1 165 GLU HB3 5.380 . 5.380 3.873 3.653 5.112 . 0 0 "[ . 1 . 2]" 1
3015 1 163 THR H 1 174 ILE H 5.360 . 5.360 3.984 3.929 4.035 . 0 0 "[ . 1 . 2]" 1
3016 1 163 THR MG 1 165 GLU H 5.350 . 5.350 4.200 4.111 4.245 . 0 0 "[ . 1 . 2]" 1
3017 1 163 THR HB 1 165 GLU HB2 5.330 . 5.330 3.961 3.366 4.078 . 0 0 "[ . 1 . 2]" 1
3018 1 163 THR MG 1 174 ILE HA 5.270 . 5.270 4.979 4.883 5.225 . 0 0 "[ . 1 . 2]" 1
3019 1 163 THR MG 1 175 PHE HA 5.140 . 5.140 4.289 4.209 4.404 . 0 0 "[ . 1 . 2]" 1
3020 1 163 THR H 1 166 THR H 5.140 . 5.140 4.678 4.561 4.739 . 0 0 "[ . 1 . 2]" 1
3021 1 163 THR H 1 174 ILE HA 5.140 . 5.140 5.426 5.392 5.505 0.365 13 0 "[ . 1 . 2]" 1
3022 1 163 THR H 1 167 GLN HA 5.090 . 5.090 4.953 4.628 5.101 0.011 2 0 "[ . 1 . 2]" 1
3023 1 163 THR H 1 167 GLN HB3 6.070 . 6.070 4.488 4.210 6.303 0.233 1 0 "[ . 1 . 2]" 1
3024 1 163 THR H 1 174 ILE HB 4.980 . 4.980 3.501 3.423 3.961 . 0 0 "[ . 1 . 2]" 1
3025 1 163 THR HA 1 164 PRO HD3 4.970 . 4.970 1.972 1.613 2.039 0.037 10 0 "[ . 1 . 2]" 1
3026 1 163 THR HA 1 165 GLU H 4.940 . 4.940 4.011 3.968 4.041 . 0 0 "[ . 1 . 2]" 1
3027 1 163 THR HA 1 164 PRO HG2 4.860 . 4.860 4.445 4.303 4.485 . 0 0 "[ . 1 . 2]" 1
3028 1 163 THR HB 1 165 GLU H 4.790 . 4.790 2.510 2.393 2.578 . 0 0 "[ . 1 . 2]" 1
3029 1 163 THR H 1 163 THR MG 4.630 . 4.630 2.779 2.716 2.866 . 0 0 "[ . 1 . 2]" 1
3030 1 163 THR HB 1 164 PRO HD3 4.340 . 4.340 3.358 2.995 3.465 . 0 0 "[ . 1 . 2]" 1
3031 1 163 THR H 1 175 PHE HA 4.120 . 4.120 3.815 3.730 3.892 . 0 0 "[ . 1 . 2]" 1
3032 1 163 THR MG 1 174 ILE HB 3.870 . 3.870 2.832 2.687 3.072 . 0 0 "[ . 1 . 2]" 1
3033 1 163 THR MG 1 174 ILE MG 3.710 . 3.710 2.319 1.984 2.683 . 0 0 "[ . 1 . 2]" 1
3034 1 163 THR O 1 167 GLN N . 2.700 3.300 3.037 2.912 3.083 . 0 0 "[ . 1 . 2]" 1
3035 1 163 THR N 1 174 ILE O . 2.700 3.300 3.351 3.335 3.366 0.066 10 0 "[ . 1 . 2]" 1
3036 1 163 THR H 1 174 ILE O . . 2.300 2.438 2.417 2.471 0.171 1 0 "[ . 1 . 2]" 1
3037 1 163 THR O 1 167 GLN H . . 2.300 2.514 2.468 2.559 0.259 2 0 "[ . 1 . 2]" 1
3038 1 164 PRO HD2 1 167 GLN H 5.980 . 5.980 5.624 5.467 5.684 . 0 0 "[ . 1 . 2]" 1
3039 1 164 PRO HA 1 168 ASP H 5.910 . 5.910 5.140 4.521 5.344 . 0 0 "[ . 1 . 2]" 1
3040 1 164 PRO HG3 1 167 GLN HG3 6.560 2.350 6.560 6.618 6.529 6.937 0.377 14 0 "[ . 1 . 2]" 1
3041 1 164 PRO HG2 1 165 GLU H 5.340 . 5.340 3.280 3.053 4.468 . 0 0 "[ . 1 . 2]" 1
3042 1 164 PRO HB2 1 165 GLU HB2 5.260 . 5.260 5.310 5.259 5.403 0.143 15 0 "[ . 1 . 2]" 1
3043 1 164 PRO HB2 1 165 GLU H 5.100 . 5.100 3.860 3.381 3.946 . 0 0 "[ . 1 . 2]" 1
3044 1 164 PRO HG3 1 165 GLU H 5.070 . 5.070 4.536 4.446 4.803 . 0 0 "[ . 1 . 2]" 1
3045 1 164 PRO HA 1 167 GLN HB2 5.050 . 5.050 3.633 1.501 4.119 0.149 1 0 "[ . 1 . 2]" 1
3046 1 164 PRO HD2 1 165 GLU H 4.880 . 4.880 2.780 2.661 2.900 . 0 0 "[ . 1 . 2]" 1
3047 1 164 PRO HA 1 165 GLU H 4.790 . 4.790 3.493 3.470 3.514 . 0 0 "[ . 1 . 2]" 1
3048 1 164 PRO HB3 1 165 GLU H 4.720 . 4.720 4.551 4.497 4.617 . 0 0 "[ . 1 . 2]" 1
3049 1 164 PRO HA 1 167 GLN HB3 4.720 . 4.720 2.553 2.239 2.860 . 0 0 "[ . 1 . 2]" 1
3050 1 164 PRO HA 1 167 GLN H 4.640 . 4.640 3.040 2.814 3.235 . 0 0 "[ . 1 . 2]" 1
3051 1 164 PRO HB2 1 165 GLU HA 4.610 . 4.610 4.118 3.872 4.160 . 0 0 "[ . 1 . 2]" 1
3052 1 164 PRO HD3 1 165 GLU H 4.390 . 4.390 4.023 3.858 4.114 . 0 0 "[ . 1 . 2]" 1
3053 1 164 PRO HA 1 167 GLN HG2 4.110 . 4.110 1.912 1.435 4.218 0.215 14 0 "[ . 1 . 2]" 1
3054 1 164 PRO HA 1 167 GLN HG3 3.970 . 3.970 2.890 2.642 3.632 . 0 0 "[ . 1 . 2]" 1
3055 1 165 GLU HG2 1 166 THR H 6.150 . 6.150 4.101 3.909 5.212 . 0 0 "[ . 1 . 2]" 1
3056 1 165 GLU H 1 166 THR MG 6.110 . 6.110 4.607 4.514 4.714 . 0 0 "[ . 1 . 2]" 1
3057 1 165 GLU HA 1 168 ASP H 5.620 . 5.620 5.538 5.446 5.594 . 0 0 "[ . 1 . 2]" 1
3058 1 165 GLU H 1 165 GLU HG2 5.100 . 5.100 4.439 3.782 4.692 . 0 0 "[ . 1 . 2]" 1
3059 1 165 GLU H 1 166 THR H 4.980 . 4.980 2.535 2.474 2.576 . 0 0 "[ . 1 . 2]" 1
3060 1 165 GLU H 1 167 GLN H 4.840 . 4.840 3.578 3.322 3.677 . 0 0 "[ . 1 . 2]" 1
3061 1 165 GLU HA 1 166 THR H 3.880 . 3.880 3.626 3.610 3.635 . 0 0 "[ . 1 . 2]" 1
3062 1 166 THR MG 1 174 ILE MG 6.690 . 6.690 5.101 4.962 5.349 . 0 0 "[ . 1 . 2]" 1
3063 1 166 THR MG 1 168 ASP H 6.650 . 6.650 4.862 4.778 5.276 . 0 0 "[ . 1 . 2]" 1
3064 1 166 THR MG 1 169 SER H 6.590 . 6.590 4.935 4.835 5.069 . 0 0 "[ . 1 . 2]" 1
3065 1 166 THR MG 1 173 VAL H 6.080 . 6.080 5.227 5.090 5.335 . 0 0 "[ . 1 . 2]" 1
3066 1 166 THR H 1 167 GLN HG3 5.910 . 5.910 4.816 4.453 6.129 0.219 1 0 "[ . 1 . 2]" 1
3067 1 166 THR H 1 167 GLN HA 5.800 . 5.800 4.407 4.248 4.448 . 0 0 "[ . 1 . 2]" 1
3068 1 166 THR H 1 167 GLN HB2 5.730 . 5.730 5.617 4.084 5.820 0.090 15 0 "[ . 1 . 2]" 1
3069 1 166 THR HA 1 169 SER HB2 5.580 . 5.580 3.008 2.738 4.844 . 0 0 "[ . 1 . 2]" 1
3070 1 166 THR H 1 169 SER H 5.510 . 5.510 5.806 5.770 5.909 0.399 2 0 "[ . 1 . 2]" 1
3071 1 166 THR HB 1 167 GLN H 5.460 . 5.460 4.457 4.431 4.472 . 0 0 "[ . 1 . 2]" 1
3072 1 166 THR HA 1 167 GLN HA 5.460 . 5.460 4.699 4.683 4.785 . 0 0 "[ . 1 . 2]" 1
3073 1 166 THR HB 1 169 SER H 5.440 . 5.440 3.950 3.880 4.088 . 0 0 "[ . 1 . 2]" 1
3074 1 166 THR HB 1 174 ILE MD 5.420 . 5.420 5.335 5.120 5.468 0.048 13 0 "[ . 1 . 2]" 1
3075 1 166 THR MG 1 167 GLN H 5.350 . 5.350 4.383 4.305 4.428 . 0 0 "[ . 1 . 2]" 1
3076 1 166 THR MG 1 174 ILE MD 5.280 . 5.280 3.925 3.464 4.085 . 0 0 "[ . 1 . 2]" 1
3077 1 166 THR HB 1 173 VAL MG2 5.050 . 5.050 3.781 3.687 3.840 . 0 0 "[ . 1 . 2]" 1
3078 1 166 THR MG 1 174 ILE HG12 5.000 . 5.000 3.090 2.800 5.056 0.056 13 0 "[ . 1 . 2]" 1
3079 1 166 THR HA 1 173 VAL HA 4.940 . 4.940 5.234 5.169 5.260 0.320 19 0 "[ . 1 . 2]" 1
3080 1 166 THR MG 1 174 ILE HG13 4.900 . 4.900 3.697 3.499 3.923 . 0 0 "[ . 1 . 2]" 1
3081 1 166 THR H 1 168 ASP H 4.860 . 4.860 4.537 4.481 4.773 . 0 0 "[ . 1 . 2]" 1
3082 1 166 THR MG 1 174 ILE HB 4.790 . 4.790 4.441 4.324 4.545 . 0 0 "[ . 1 . 2]" 1
3083 1 166 THR MG 1 174 ILE H 4.750 . 4.750 4.158 4.049 4.300 . 0 0 "[ . 1 . 2]" 1
3084 1 166 THR HB 1 174 ILE H 4.730 . 4.730 3.948 3.839 4.047 . 0 0 "[ . 1 . 2]" 1
3085 1 166 THR HA 1 167 GLN H 4.710 . 4.710 3.212 3.154 3.237 . 0 0 "[ . 1 . 2]" 1
3086 1 166 THR MG 1 173 VAL HA 4.660 . 4.660 3.959 3.906 4.009 . 0 0 "[ . 1 . 2]" 1
3087 1 166 THR HB 1 173 VAL HA 4.590 . 4.590 2.897 2.845 2.933 . 0 0 "[ . 1 . 2]" 1
3088 1 166 THR H 1 167 GLN H 4.430 . 4.430 2.343 2.193 2.375 . 0 0 "[ . 1 . 2]" 1
3089 1 166 THR HA 1 169 SER H 4.250 . 4.250 3.803 3.715 3.938 . 0 0 "[ . 1 . 2]" 1
3090 1 166 THR HA 1 168 ASP H 4.070 . 4.070 3.072 2.983 3.574 . 0 0 "[ . 1 . 2]" 1
3091 1 167 GLN HA 1 175 PHE QE 6.600 . 6.600 6.625 6.584 6.677 0.077 20 0 "[ . 1 . 2]" 1
3092 1 167 GLN HG2 1 168 ASP HA 6.180 . 6.180 5.628 3.903 5.944 . 0 0 "[ . 1 . 2]" 1
3093 1 167 GLN H 1 173 VAL MG2 5.920 . 5.920 6.001 5.926 6.055 0.135 18 0 "[ . 1 . 2]" 1
3094 1 167 GLN HB3 1 169 SER H 5.860 . 5.860 5.858 5.180 5.990 0.130 13 0 "[ . 1 . 2]" 1
3095 1 167 GLN H 1 168 ASP HA 5.790 . 5.790 5.276 5.228 5.364 . 0 0 "[ . 1 . 2]" 1
3096 1 167 GLN H 1 167 GLN HG3 5.440 . 5.440 2.643 2.253 4.366 . 0 0 "[ . 1 . 2]" 1
3097 1 167 GLN H 1 167 GLN HG2 5.380 . 5.380 3.242 2.250 4.498 . 0 0 "[ . 1 . 2]" 1
3098 1 167 GLN HG3 1 169 SER H 6.160 2.450 6.160 5.317 5.059 6.251 0.091 20 0 "[ . 1 . 2]" 1
3099 1 167 GLN H 1 169 SER H 5.180 . 5.180 4.649 4.608 4.714 . 0 0 "[ . 1 . 2]" 1
3100 1 167 GLN HA 1 173 VAL HA 5.000 . 5.000 5.010 4.913 5.115 0.115 1 0 "[ . 1 . 2]" 1
3101 1 167 GLN H 1 168 ASP H 4.900 . 4.900 2.846 2.812 2.964 . 0 0 "[ . 1 . 2]" 1
3102 1 167 GLN HG2 1 168 ASP H 4.650 . 4.650 4.411 3.658 4.628 . 0 0 "[ . 1 . 2]" 1
3103 1 167 GLN HB2 1 168 ASP H 4.620 . 4.620 4.344 3.998 4.433 . 0 0 "[ . 1 . 2]" 1
3104 1 167 GLN HB3 1 168 ASP H 4.440 . 4.440 4.306 2.739 4.522 0.082 14 0 "[ . 1 . 2]" 1
3105 1 167 GLN HA 1 168 ASP H 4.430 . 4.430 3.507 3.470 3.670 . 0 0 "[ . 1 . 2]" 1
3106 1 167 GLN HG3 1 168 ASP H 5.020 2.250 5.020 3.089 2.797 5.112 0.092 20 0 "[ . 1 . 2]" 1
3107 1 167 GLN HA 1 169 SER H 4.210 . 4.210 3.876 3.750 4.066 . 0 0 "[ . 1 . 2]" 1
3108 1 168 ASP H 1 169 SER HA 6.690 2.150 6.690 4.628 4.551 4.824 . 0 0 "[ . 1 . 2]" 1
3109 1 168 ASP HA 1 169 SER H 5.650 2.150 5.650 2.866 2.768 2.928 . 0 0 "[ . 1 . 2]" 1
3110 1 168 ASP HB2 1 169 SER H 4.960 . 4.960 4.634 4.562 4.755 . 0 0 "[ . 1 . 2]" 1
3111 1 168 ASP HB3 1 169 SER H 4.660 . 4.660 4.566 4.288 4.789 0.129 2 0 "[ . 1 . 2]" 1
3112 1 168 ASP H 1 169 SER H 3.840 . 3.840 2.692 2.603 3.074 . 0 0 "[ . 1 . 2]" 1
3113 1 169 SER HA 1 170 GLU HA 5.990 . 5.990 4.339 4.331 4.371 . 0 0 "[ . 1 . 2]" 1
3114 1 169 SER H 1 170 GLU H 5.870 . 5.870 4.383 4.363 4.412 . 0 0 "[ . 1 . 2]" 1
3115 1 169 SER H 1 173 VAL HA 5.340 . 5.340 5.372 5.281 5.497 0.157 2 0 "[ . 1 . 2]" 1
3116 1 169 SER HB2 1 170 GLU H 4.990 . 4.990 4.061 2.601 4.250 . 0 0 "[ . 1 . 2]" 1
3117 1 169 SER HA 1 170 GLU H 4.080 . 4.080 2.345 2.319 2.429 . 0 0 "[ . 1 . 2]" 1
3118 1 170 GLU HB3 1 172 ASP H 6.190 . 6.190 5.117 5.005 5.372 . 0 0 "[ . 1 . 2]" 1
3119 1 170 GLU HG3 1 171 THR H 5.490 . 5.490 4.889 4.144 5.087 . 0 0 "[ . 1 . 2]" 1
3120 1 170 GLU H 1 170 GLU HG2 5.330 . 5.330 3.785 3.679 4.261 . 0 0 "[ . 1 . 2]" 1
3121 1 170 GLU HA 1 172 ASP H 5.210 . 5.210 3.950 3.801 4.020 . 0 0 "[ . 1 . 2]" 1
3122 1 170 GLU H 1 171 THR H 4.990 . 4.990 4.575 4.503 4.606 . 0 0 "[ . 1 . 2]" 1
3123 1 170 GLU HA 1 171 THR H 4.390 . 4.390 2.513 2.302 2.571 . 0 0 "[ . 1 . 2]" 1
3124 1 171 THR HB 1 172 ASP HB2 6.990 . 6.990 4.429 4.058 4.635 . 0 0 "[ . 1 . 2]" 1
3125 1 171 THR MG 1 172 ASP HB2 6.390 . 6.390 3.852 2.574 4.109 . 0 0 "[ . 1 . 2]" 1
3126 1 171 THR HB 1 172 ASP H 5.070 . 5.070 2.444 2.322 2.633 . 0 0 "[ . 1 . 2]" 1
3127 1 171 THR HA 1 172 ASP H 4.650 . 4.650 3.607 3.600 3.617 . 0 0 "[ . 1 . 2]" 1
3128 1 171 THR H 1 172 ASP H 4.090 . 4.090 3.552 3.061 3.612 . 0 0 "[ . 1 . 2]" 1
3129 1 172 ASP H 1 173 VAL H 6.220 . 6.220 4.371 4.266 4.407 . 0 0 "[ . 1 . 2]" 1
3130 1 172 ASP HA 1 173 VAL MG2 5.600 . 5.600 3.752 3.713 3.847 . 0 0 "[ . 1 . 2]" 1
3131 1 172 ASP HB2 1 173 VAL H 5.130 . 5.130 4.411 4.313 4.607 . 0 0 "[ . 1 . 2]" 1
3132 1 172 ASP HB3 1 173 VAL H 5.130 . 5.130 3.614 3.540 4.387 . 0 0 "[ . 1 . 2]" 1
3133 1 172 ASP HA 1 173 VAL H 4.020 . 4.020 2.209 2.200 2.236 . 0 0 "[ . 1 . 2]" 1
3134 1 173 VAL MG2 1 175 PHE QE 6.110 . 6.110 4.004 3.920 4.254 . 0 0 "[ . 1 . 2]" 1
3135 1 173 VAL HA 1 174 ILE MD 6.030 . 6.030 4.369 4.248 5.213 . 0 0 "[ . 1 . 2]" 1
3136 1 173 VAL H 1 174 ILE H 5.740 . 5.740 4.374 4.347 4.424 . 0 0 "[ . 1 . 2]" 1
3137 1 173 VAL HB 1 175 PHE QE 5.460 . 5.460 2.949 2.776 3.298 . 0 0 "[ . 1 . 2]" 1
3138 1 173 VAL MG2 1 174 ILE H 5.250 . 5.250 4.061 4.033 4.094 . 0 0 "[ . 1 . 2]" 1
3139 1 173 VAL MG1 1 175 PHE QE 4.760 . 4.760 2.710 2.348 2.865 . 0 0 "[ . 1 . 2]" 1
3140 1 173 VAL HA 1 174 ILE H 4.470 . 4.470 2.287 2.269 2.305 . 0 0 "[ . 1 . 2]" 1
3141 1 173 VAL MG1 1 174 ILE H 4.440 . 4.440 2.318 2.084 2.474 . 0 0 "[ . 1 . 2]" 1
3142 1 174 ILE H 1 175 PHE H 6.150 . 6.150 4.420 4.387 4.453 . 0 0 "[ . 1 . 2]" 1
3143 1 174 ILE HG13 1 175 PHE H 5.830 . 5.830 5.471 5.036 5.540 . 0 0 "[ . 1 . 2]" 1
3144 1 174 ILE H 1 174 ILE MD 5.590 . 5.590 3.647 3.566 4.177 . 0 0 "[ . 1 . 2]" 1
3145 1 174 ILE HB 1 175 PHE H 5.550 . 5.550 4.215 4.193 4.241 . 0 0 "[ . 1 . 2]" 1
3146 1 174 ILE MG 1 175 PHE HA 5.250 . 5.250 3.619 3.525 3.739 . 0 0 "[ . 1 . 2]" 1
3147 1 174 ILE MD 1 175 PHE H 5.210 . 5.210 3.715 3.531 4.993 . 0 0 "[ . 1 . 2]" 1
3148 1 174 ILE MG 1 175 PHE H 4.420 . 4.420 2.494 2.231 2.651 . 0 0 "[ . 1 . 2]" 1
3149 1 174 ILE HA 1 175 PHE H 4.210 . 4.210 2.204 2.145 2.232 . 0 0 "[ . 1 . 2]" 1
3150 1 175 PHE HB2 1 177 ILE H 6.020 . 6.020 5.407 4.349 5.632 . 0 0 "[ . 1 . 2]" 1
3151 1 175 PHE H 1 177 ILE MD 5.880 . 5.880 5.001 4.585 6.004 0.124 11 0 "[ . 1 . 2]" 1
3152 1 175 PHE HA 1 176 ASN HB2 5.860 . 5.860 4.224 4.183 4.303 . 0 0 "[ . 1 . 2]" 1
3153 1 175 PHE HA 1 177 ILE MD 5.840 . 5.840 4.914 4.679 5.897 0.057 11 0 "[ . 1 . 2]" 1
3154 1 175 PHE HB3 1 177 ILE H 5.750 . 5.750 4.879 3.759 5.103 . 0 0 "[ . 1 . 2]" 1
3155 1 175 PHE HB2 1 176 ASN H 5.380 . 5.380 3.842 3.722 3.997 . 0 0 "[ . 1 . 2]" 1
3156 1 175 PHE QD 1 177 ILE MD 5.260 . 5.260 4.387 4.029 4.936 . 0 0 "[ . 1 . 2]" 1
3157 1 175 PHE H 1 176 ASN H 5.250 . 5.250 4.476 4.463 4.500 . 0 0 "[ . 1 . 2]" 1
3158 1 175 PHE HB2 1 177 ILE HG13 5.180 . 5.180 4.690 4.261 4.870 . 0 0 "[ . 1 . 2]" 1
3159 1 175 PHE QD 1 176 ASN H 5.130 . 5.130 3.595 3.483 3.739 . 0 0 "[ . 1 . 2]" 1
3160 1 175 PHE HB3 1 177 ILE MD 5.120 . 5.120 3.005 2.649 3.837 . 0 0 "[ . 1 . 2]" 1
3161 1 175 PHE HB2 1 177 ILE MD 5.080 . 5.080 3.168 2.813 3.997 . 0 0 "[ . 1 . 2]" 1
3162 1 175 PHE HB3 1 176 ASN H 4.850 . 4.850 2.619 2.473 2.843 . 0 0 "[ . 1 . 2]" 1
3163 1 175 PHE HA 1 176 ASN H 3.990 . 3.990 2.299 2.249 2.347 . 0 0 "[ . 1 . 2]" 1
3164 1 176 ASN H 1 177 ILE HA 6.640 . 6.640 4.535 4.368 4.669 . 0 0 "[ . 1 . 2]" 1
3165 1 176 ASN H 1 177 ILE H 6.420 . 6.420 4.121 3.516 4.320 . 0 0 "[ . 1 . 2]" 1
3166 1 176 ASN H 1 177 ILE HG13 5.860 . 5.860 4.054 3.932 4.322 . 0 0 "[ . 1 . 2]" 1
3167 1 176 ASN HA 1 177 ILE HG13 5.390 . 5.390 4.449 4.115 4.782 . 0 0 "[ . 1 . 2]" 1
3168 1 176 ASN HA 1 177 ILE HB 5.360 . 5.360 4.717 4.549 4.876 . 0 0 "[ . 1 . 2]" 1
3169 1 176 ASN HB3 1 177 ILE H 4.900 . 4.900 4.329 4.265 4.545 . 0 0 "[ . 1 . 2]" 1
3170 1 176 ASN HA 1 177 ILE H 4.020 . 4.020 2.282 2.239 2.450 . 0 0 "[ . 1 . 2]" 1
3171 1 177 ILE MG 1 178 THR HA 6.280 . 6.280 3.718 3.507 3.829 . 0 0 "[ . 1 . 2]" 1
3172 1 177 ILE H 1 177 ILE MD 5.770 . 5.770 2.570 1.821 3.909 . 0 0 "[ . 1 . 2]" 1
3173 1 177 ILE H 1 177 ILE HG13 5.740 . 5.740 3.251 2.663 3.408 . 0 0 "[ . 1 . 2]" 1
3174 1 177 ILE H 1 177 ILE HG12 5.280 . 5.280 4.293 3.791 4.395 . 0 0 "[ . 1 . 2]" 1
3175 1 177 ILE HB 1 178 THR H 5.220 . 5.220 4.314 4.280 4.434 . 0 0 "[ . 1 . 2]" 1
3176 1 177 ILE HG13 1 178 THR H 4.770 . 4.770 4.584 4.535 4.833 0.063 11 0 "[ . 1 . 2]" 1
3177 1 177 ILE MG 1 178 THR H 4.340 . 4.340 2.522 2.412 2.651 . 0 0 "[ . 1 . 2]" 1
3178 1 177 ILE HA 1 178 THR H 4.080 . 4.080 2.175 2.138 2.190 . 0 0 "[ . 1 . 2]" 1
3179 1 178 THR HA 1 180 ALA H 6.300 . 6.300 5.794 5.691 5.924 . 0 0 "[ . 1 . 2]" 1
3180 1 178 THR MG 1 180 ALA H 6.220 . 6.220 4.562 3.972 6.181 . 0 0 "[ . 1 . 2]" 1
3181 1 178 THR MG 1 180 ALA HA 5.940 . 5.940 4.002 3.296 5.965 0.025 10 0 "[ . 1 . 2]" 1
3182 1 178 THR H 1 179 ARG H 5.930 . 5.930 4.565 4.513 4.603 . 0 0 "[ . 1 . 2]" 1
3183 1 178 THR HB 1 179 ARG H 5.170 . 5.170 3.718 2.478 4.077 . 0 0 "[ . 1 . 2]" 1
3184 1 178 THR MG 1 179 ARG H 4.340 . 4.340 2.408 1.802 3.706 . 0 0 "[ . 1 . 2]" 1
3185 1 178 THR HA 1 179 ARG H 4.180 . 4.180 2.403 2.372 2.466 . 0 0 "[ . 1 . 2]" 1
3186 1 179 ARG HD2 1 180 ALA H 6.760 . 6.760 5.712 4.902 5.960 . 0 0 "[ . 1 . 2]" 1
3187 1 179 ARG HA 1 180 ALA MB 6.280 . 6.280 4.101 4.019 4.160 . 0 0 "[ . 1 . 2]" 1
3188 1 179 ARG HG2 1 182 ARG HG2 6.220 . 6.220 5.162 3.711 6.456 0.236 7 0 "[ . 1 . 2]" 1
3189 1 179 ARG HD2 1 182 ARG H 6.140 . 6.140 5.781 4.768 6.436 0.296 19 0 "[ . 1 . 2]" 1
3190 1 179 ARG HA 1 182 ARG HE 5.450 . 5.450 5.694 5.559 5.849 0.399 9 0 "[ . 1 . 2]" 1
3191 1 179 ARG H 1 180 ALA H 5.410 . 5.410 4.397 4.211 4.517 . 0 0 "[ . 1 . 2]" 1
3192 1 179 ARG HA 1 182 ARG HG3 5.840 2.150 5.840 6.107 5.965 6.232 0.392 14 0 "[ . 1 . 2]" 1
3193 1 179 ARG H 1 179 ARG HG2 5.270 . 5.270 3.895 2.237 4.499 . 0 0 "[ . 1 . 2]" 1
3194 1 179 ARG HB2 1 180 ALA H 4.810 . 4.810 4.367 3.399 4.729 . 0 0 "[ . 1 . 2]" 1
3195 1 179 ARG HB3 1 182 ARG HG2 6.000 3.350 6.000 5.946 4.733 6.468 0.468 15 0 "[ . 1 . 2]" 1
3196 1 179 ARG HA 1 180 ALA H 4.010 . 4.010 2.241 2.199 2.272 . 0 0 "[ . 1 . 2]" 1
3197 1 180 ALA MB 1 181 PRO HB2 6.130 . 6.130 4.529 4.105 5.047 . 0 0 "[ . 1 . 2]" 1
3198 1 180 ALA MB 1 181 PRO HA 6.090 . 6.090 4.407 4.340 4.478 . 0 0 "[ . 1 . 2]" 1
3199 1 180 ALA MB 1 181 PRO HG3 6.090 . 6.090 4.544 4.185 4.792 . 0 0 "[ . 1 . 2]" 1
3200 1 180 ALA HA 1 181 PRO HB3 5.990 . 5.990 5.245 4.828 5.525 . 0 0 "[ . 1 . 2]" 1
3201 1 180 ALA HA 1 181 PRO HB2 5.970 . 5.970 5.289 5.013 5.619 . 0 0 "[ . 1 . 2]" 1
3202 1 180 ALA H 1 182 ARG HE 5.910 . 5.910 5.786 3.980 6.185 0.275 8 0 "[ . 1 . 2]" 1
3203 1 180 ALA MB 1 181 PRO HG2 5.820 . 5.820 4.037 3.306 4.552 . 0 0 "[ . 1 . 2]" 1
3204 1 180 ALA HA 1 181 PRO HG2 5.060 . 5.060 4.472 4.370 4.550 . 0 0 "[ . 1 . 2]" 1
3205 1 180 ALA H 1 182 ARG HG3 5.750 2.350 5.750 5.563 5.012 5.916 0.166 15 0 "[ . 1 . 2]" 1
3206 1 180 ALA HA 1 181 PRO HG3 4.670 . 4.670 4.212 3.979 4.543 . 0 0 "[ . 1 . 2]" 1
3207 1 180 ALA MB 1 181 PRO HD3 4.280 . 4.280 3.101 2.775 3.385 . 0 0 "[ . 1 . 2]" 1
3208 1 180 ALA HA 1 181 PRO HD3 3.930 . 3.930 2.013 1.749 2.373 . 0 0 "[ . 1 . 2]" 1
3209 1 180 ALA HA 1 181 PRO HD2 3.900 . 3.900 2.548 2.218 2.825 . 0 0 "[ . 1 . 2]" 1
3210 1 180 ALA MB 1 181 PRO HD2 3.830 . 3.830 2.178 1.795 2.564 . 0 0 "[ . 1 . 2]" 1
3211 1 181 PRO HB2 1 182 ARG HG3 6.290 . 6.290 5.850 5.315 6.614 0.324 19 0 "[ . 1 . 2]" 1
3212 1 181 PRO HA 1 182 ARG HB3 5.890 . 5.890 5.482 4.823 5.739 . 0 0 "[ . 1 . 2]" 1
3213 1 181 PRO HA 1 182 ARG HG2 5.730 . 5.730 4.651 3.607 5.442 . 0 0 "[ . 1 . 2]" 1
3214 1 181 PRO HD2 1 182 ARG H 5.730 . 5.730 5.615 5.439 5.788 0.058 10 0 "[ . 1 . 2]" 1
3215 1 181 PRO HD3 1 182 ARG H 5.540 . 5.540 5.593 5.442 5.718 0.178 6 0 "[ . 1 . 2]" 1
3216 1 181 PRO HG3 1 182 ARG H 5.350 . 5.350 5.332 4.980 5.786 0.436 13 0 "[ . 1 . 2]" 1
3217 1 181 PRO HA 1 182 ARG HG3 5.030 . 5.030 3.858 3.245 5.178 0.148 19 0 "[ . 1 . 2]" 1
3218 1 181 PRO HB3 1 182 ARG H 5.010 . 5.010 3.804 3.537 4.061 . 0 0 "[ . 1 . 2]" 1
3219 1 181 PRO HB2 1 182 ARG H 5.000 . 5.000 3.902 3.413 4.272 . 0 0 "[ . 1 . 2]" 1
3220 1 181 PRO HA 1 182 ARG H 3.330 . 3.330 2.158 2.109 2.207 . 0 0 "[ . 1 . 2]" 1
3221 1 182 ARG HA 1 182 ARG HD3 5.670 . 5.670 4.408 2.394 4.835 . 0 0 "[ . 1 . 2]" 1
3222 1 182 ARG HA 1 182 ARG HD2 5.550 . 5.550 4.397 3.402 5.198 . 0 0 "[ . 1 . 2]" 1
3223 1 182 ARG H 1 182 ARG HG2 4.630 . 4.630 3.462 3.029 3.864 . 0 0 "[ . 1 . 2]" 1
3224 1 182 ARG H 1 182 ARG HG3 4.020 . 4.020 2.541 1.876 4.212 0.192 19 0 "[ . 1 . 2]" 1
3225 1 182 ARG HA 1 183 GLY H 3.560 2.200 3.560 2.713 2.223 3.683 0.123 3 0 "[ . 1 . 2]" 1
3226 1 182 ARG HD2 1 183 GLY H 6.140 2.700 6.140 5.085 3.667 6.500 0.360 2 0 "[ . 1 . 2]" 1
3227 1 182 ARG H 1 183 GLY H 4.330 2.200 4.330 3.761 2.508 4.454 0.124 11 0 "[ . 1 . 2]" 1
3228 1 182 ARG HG2 1 183 GLY H 5.500 3.420 5.500 5.010 4.340 5.561 0.061 5 0 "[ . 1 . 2]" 1
3229 1 182 ARG HG3 1 183 GLY H 4.840 3.000 4.840 4.791 3.507 5.279 0.439 6 0 "[ . 1 . 2]" 1
3230 1 182 ARG H 1 183 GLY HA3 6.000 2.460 6.000 4.905 4.467 5.713 . 0 0 "[ . 1 . 2]" 1
3231 1 183 GLY HA2 1 184 ALA H 3.670 2.200 3.670 2.747 2.177 3.614 0.023 15 0 "[ . 1 . 2]" 1
3232 1 183 GLY HA3 1 184 ALA H 3.760 2.200 3.760 3.201 2.281 3.662 . 0 0 "[ . 1 . 2]" 1
3233 1 184 ALA HA 1 185 GLU H 3.520 2.200 3.520 2.672 2.221 3.606 0.086 1 0 "[ . 1 . 2]" 1
3234 1 184 ALA MB 1 185 GLU H 3.860 2.200 3.860 2.868 1.792 3.807 0.408 3 0 "[ . 1 . 2]" 1
3235 1 184 ALA H 1 185 GLU H 4.290 2.200 4.290 3.785 2.418 4.573 0.283 14 0 "[ . 1 . 2]" 1
3236 1 183 GLY H 1 184 ALA H 4.730 2.200 4.730 3.398 2.427 4.687 . 0 0 "[ . 1 . 2]" 1
3237 1 182 ARG H 1 185 GLU HA 5.600 2.430 5.600 5.607 4.593 5.899 0.299 19 0 "[ . 1 . 2]" 1
3238 1 185 GLU H 1 186 ASN H 5.000 2.910 5.000 4.033 2.722 4.671 0.188 19 0 "[ . 1 . 2]" 1
3239 1 185 GLU HA 1 186 ASN H 3.910 2.200 3.910 2.374 2.200 2.773 0.000 17 0 "[ . 1 . 2]" 1
3240 1 185 GLU HB2 1 186 ASN H 5.000 . 5.000 3.714 1.962 4.826 . 0 0 "[ . 1 . 2]" 1
3241 1 186 ASN HA 1 187 LEU H 3.530 2.200 3.530 2.269 2.220 2.516 . 0 0 "[ . 1 . 2]" 1
3242 1 186 ASN HB2 1 187 LEU H 4.500 2.200 4.500 4.380 4.112 4.758 0.258 4 0 "[ . 1 . 2]" 1
3243 1 186 ASN HA 1 188 TYR H 5.000 . 5.000 4.505 3.944 5.082 0.082 20 0 "[ . 1 . 2]" 1
3244 1 186 ASN H 1 187 LEU H 4.380 2.200 4.380 4.227 2.693 4.436 0.056 11 0 "[ . 1 . 2]" 1
3245 1 187 LEU H 1 188 TYR H 3.890 2.200 3.890 2.512 2.200 2.938 0.000 6 0 "[ . 1 . 2]" 1
3246 1 187 LEU HA 1 188 TYR H 4.170 2.900 4.170 3.656 3.617 3.668 . 0 0 "[ . 1 . 2]" 1
3247 1 187 LEU HB2 1 188 TYR H 4.280 2.200 4.280 2.717 2.118 3.898 0.082 9 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 2
_Distance_constraint_stats_list.Viol_count 20
_Distance_constraint_stats_list.Viol_total 53.850
_Distance_constraint_stats_list.Viol_max 0.179
_Distance_constraint_stats_list.Viol_rms 0.0693
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0673
_Distance_constraint_stats_list.Viol_average_violations_only 0.1346
_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 1 MET 2.692 0.179 15 0 "[ . 1 . 2]"
1 4 MET 2.692 0.179 15 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 MET O 1 4 MET H 2.500 2.200 2.800 2.935 2.914 2.979 0.179 15 0 "[ . 1 . 2]" 2
2 1 1 MET O 1 4 MET N 3.500 3.200 3.800 3.593 3.547 3.693 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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