NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
627656 |
5vto   |
30295 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5vto
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 2660
_Distance_constraint_stats_list.Viol_count 5130
_Distance_constraint_stats_list.Viol_total 5347.950
_Distance_constraint_stats_list.Viol_max 0.625
_Distance_constraint_stats_list.Viol_rms 0.0360
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0089
_Distance_constraint_stats_list.Viol_average_violations_only 0.0695
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 GLY 0.176 0.097 15 0 "[ . 1 .]"
1 4 VAL 1.512 0.152 5 0 "[ . 1 .]"
1 5 ARG 0.115 0.059 4 0 "[ . 1 .]"
1 6 SER 1.475 0.105 8 0 "[ . 1 .]"
1 7 VAL 2.327 0.129 11 0 "[ . 1 .]"
1 8 PHE 0.925 0.132 15 0 "[ . 1 .]"
1 9 LEU 0.440 0.090 5 0 "[ . 1 .]"
1 10 ALA 1.069 0.097 6 0 "[ . 1 .]"
1 11 GLY 0.000 0.000 . 0 "[ . 1 .]"
1 12 PRO 0.070 0.070 12 0 "[ . 1 .]"
1 13 PHE 4.715 0.281 10 0 "[ . 1 .]"
1 14 MET 3.543 0.281 10 0 "[ . 1 .]"
1 15 GLY 0.229 0.092 5 0 "[ . 1 .]"
1 16 LEU 4.566 0.237 11 0 "[ . 1 .]"
1 17 VAL 3.460 0.202 5 0 "[ . 1 .]"
1 18 ASN 0.871 0.090 10 0 "[ . 1 .]"
1 19 PRO 2.503 0.204 14 0 "[ . 1 .]"
1 20 GLU 1.355 0.156 11 0 "[ . 1 .]"
1 21 THR 1.317 0.197 2 0 "[ . 1 .]"
1 22 ASN 1.845 0.197 2 0 "[ . 1 .]"
1 23 SER 1.089 0.155 8 0 "[ . 1 .]"
1 24 MET 1.622 0.155 8 0 "[ . 1 .]"
1 25 PRO 1.624 0.573 10 1 "[ . + .]"
1 26 SER 1.441 0.573 10 1 "[ . + .]"
1 27 ALA 0.810 0.076 5 0 "[ . 1 .]"
1 28 GLU 0.627 0.095 10 0 "[ . 1 .]"
1 29 GLN 0.388 0.058 14 0 "[ . 1 .]"
1 30 LEU 2.527 0.233 12 0 "[ . 1 .]"
1 31 PRO 0.186 0.061 5 0 "[ . 1 .]"
1 32 PHE 2.665 0.178 12 0 "[ . 1 .]"
1 33 LEU 0.846 0.124 12 0 "[ . 1 .]"
1 34 THR 1.217 0.273 5 0 "[ . 1 .]"
1 35 LEU 2.388 0.120 4 0 "[ . 1 .]"
1 36 ILE 3.273 0.178 12 0 "[ . 1 .]"
1 37 GLU 0.370 0.064 8 0 "[ . 1 .]"
1 38 HIS 3.266 0.273 5 0 "[ . 1 .]"
1 39 PHE 4.499 0.152 5 0 "[ . 1 .]"
1 40 GLU 0.092 0.043 5 0 "[ . 1 .]"
1 41 LYS 0.153 0.089 11 0 "[ . 1 .]"
1 42 GLN 3.454 0.146 3 0 "[ . 1 .]"
1 43 GLY 2.593 0.175 12 0 "[ . 1 .]"
1 44 LEU 8.726 0.175 12 0 "[ . 1 .]"
1 45 GLU 1.263 0.158 15 0 "[ . 1 .]"
1 46 VAL 1.421 0.139 11 0 "[ . 1 .]"
1 47 PHE 0.261 0.158 15 0 "[ . 1 .]"
1 49 ALA 1.375 0.218 14 0 "[ . 1 .]"
1 50 HIS 0.182 0.060 13 0 "[ . 1 .]"
1 51 ARG 2.356 0.218 14 0 "[ . 1 .]"
1 53 GLU 0.139 0.068 11 0 "[ . 1 .]"
1 54 ALA 3.974 0.327 12 0 "[ . 1 .]"
1 55 TRP 6.613 0.327 12 0 "[ . 1 .]"
1 56 GLY 0.118 0.059 12 0 "[ . 1 .]"
1 57 ALA 0.032 0.032 14 0 "[ . 1 .]"
1 58 GLN 1.888 0.237 11 0 "[ . 1 .]"
1 59 VAL 7.506 0.204 15 0 "[ . 1 .]"
1 60 LEU 3.522 0.218 7 0 "[ . 1 .]"
1 61 THR 5.426 0.218 7 0 "[ . 1 .]"
1 62 PRO 0.115 0.065 3 0 "[ . 1 .]"
1 63 GLU 1.919 0.185 12 0 "[ . 1 .]"
1 64 GLU 0.762 0.123 8 0 "[ . 1 .]"
1 65 CYS 0.327 0.081 6 0 "[ . 1 .]"
1 66 THR 0.751 0.078 14 0 "[ . 1 .]"
1 67 PRO 0.322 0.089 3 0 "[ . 1 .]"
1 68 LEU 1.580 0.137 14 0 "[ . 1 .]"
1 69 ASP 0.550 0.072 11 0 "[ . 1 .]"
1 70 GLN 1.556 0.120 10 0 "[ . 1 .]"
1 71 LEU 4.205 0.156 2 0 "[ . 1 .]"
1 72 GLU 0.353 0.101 8 0 "[ . 1 .]"
1 73 ILE 1.594 0.137 7 0 "[ . 1 .]"
1 74 ARG 4.829 0.198 8 0 "[ . 1 .]"
1 75 LYS 0.552 0.101 8 0 "[ . 1 .]"
1 76 ALA 0.940 0.132 4 0 "[ . 1 .]"
1 77 ASP 0.121 0.071 6 0 "[ . 1 .]"
1 78 VAL 1.020 0.132 15 0 "[ . 1 .]"
1 79 PHE 2.097 0.132 4 0 "[ . 1 .]"
1 80 VAL 0.439 0.071 5 0 "[ . 1 .]"
1 81 ALA 0.456 0.085 15 0 "[ . 1 .]"
1 82 ILE 2.830 0.180 4 0 "[ . 1 .]"
1 83 PRO 10.500 0.623 15 15 [***-**********+]
1 84 GLY 11.212 0.623 15 15 [***-**********+]
1 85 ILE 3.501 0.222 4 0 "[ . 1 .]"
1 86 PRO 0.040 0.040 1 0 "[ . 1 .]"
1 87 PRO 0.835 0.101 6 0 "[ . 1 .]"
1 88 SER 0.006 0.006 8 0 "[ . 1 .]"
1 89 PRO 0.190 0.134 1 0 "[ . 1 .]"
1 90 GLY 1.558 0.167 13 0 "[ . 1 .]"
1 91 THR 3.082 0.167 13 0 "[ . 1 .]"
1 92 HIS 9.101 0.281 10 0 "[ . 1 .]"
1 93 VAL 6.233 0.281 10 0 "[ . 1 .]"
1 94 GLU 1.596 0.163 4 0 "[ . 1 .]"
1 95 ILE 2.596 0.198 7 0 "[ . 1 .]"
1 96 GLY 3.016 0.184 11 0 "[ . 1 .]"
1 97 TRP 3.599 0.157 14 0 "[ . 1 .]"
1 98 ALA 2.315 0.117 12 0 "[ . 1 .]"
1 99 SER 1.398 0.146 13 0 "[ . 1 .]"
1 100 ALA 6.212 0.251 8 0 "[ . 1 .]"
1 101 PHE 10.608 0.284 2 0 "[ . 1 .]"
1 102 ASP 1.322 0.121 2 0 "[ . 1 .]"
1 103 LYS 2.621 0.204 9 0 "[ . 1 .]"
1 104 PRO 0.041 0.030 12 0 "[ . 1 .]"
1 105 ILE 3.163 0.163 5 0 "[ . 1 .]"
1 106 VAL 2.319 0.163 5 0 "[ . 1 .]"
1 107 LEU 0.818 0.100 14 0 "[ . 1 .]"
1 108 LEU 1.791 0.118 15 0 "[ . 1 .]"
1 109 LEU 5.308 0.353 8 0 "[ . 1 .]"
1 110 GLU 6.505 0.353 8 0 "[ . 1 .]"
1 111 GLU 1.363 0.136 6 0 "[ . 1 .]"
1 112 GLY 0.000 0.000 . 0 "[ . 1 .]"
1 113 ARG 0.719 0.105 3 0 "[ . 1 .]"
1 114 GLU 11.681 0.321 9 0 "[ . 1 .]"
1 115 GLU 1.317 0.117 14 0 "[ . 1 .]"
1 116 GLU 0.566 0.074 9 0 "[ . 1 .]"
1 117 TYR 25.060 0.600 5 14 "[****+****- ****]"
1 118 GLY 0.000 0.000 . 0 "[ . 1 .]"
1 119 PHE 3.461 0.157 6 0 "[ . 1 .]"
1 120 LEU 7.196 0.387 13 0 "[ . 1 .]"
1 121 VAL 2.954 0.204 15 0 "[ . 1 .]"
1 122 ARG 0.899 0.116 6 0 "[ . 1 .]"
1 123 GLY 0.054 0.033 5 0 "[ . 1 .]"
1 124 LEU 6.410 0.204 15 0 "[ . 1 .]"
1 125 GLY 0.541 0.084 2 0 "[ . 1 .]"
1 126 THR 0.372 0.073 2 0 "[ . 1 .]"
1 127 VAL 2.421 0.159 11 0 "[ . 1 .]"
1 128 ALA 2.442 0.115 9 0 "[ . 1 .]"
1 129 ALA 1.625 0.191 15 0 "[ . 1 .]"
1 130 VAL 1.809 0.116 4 0 "[ . 1 .]"
1 131 GLU 0.346 0.063 9 0 "[ . 1 .]"
1 132 PHE 2.635 0.162 6 0 "[ . 1 .]"
1 133 VAL 4.880 0.162 3 0 "[ . 1 .]"
1 134 HIS 1.503 0.136 15 0 "[ . 1 .]"
1 135 TYR 4.342 0.229 8 0 "[ . 1 .]"
1 136 LYS 0.904 0.229 8 0 "[ . 1 .]"
1 137 ASP 0.036 0.019 14 0 "[ . 1 .]"
1 138 ILE 1.648 0.113 1 0 "[ . 1 .]"
1 139 ALA 1.931 0.122 4 0 "[ . 1 .]"
1 140 LEU 0.734 0.086 2 0 "[ . 1 .]"
1 141 ALA 2.453 0.122 15 0 "[ . 1 .]"
1 142 LYS 0.603 0.099 10 0 "[ . 1 .]"
1 143 PRO 0.718 0.067 13 0 "[ . 1 .]"
1 144 GLN 3.188 0.138 5 0 "[ . 1 .]"
1 145 ILE 1.114 0.108 9 0 "[ . 1 .]"
1 146 ASP 0.317 0.054 13 0 "[ . 1 .]"
1 147 ALA 1.238 0.107 14 0 "[ . 1 .]"
1 148 ALA 0.525 0.127 6 0 "[ . 1 .]"
1 149 ILE 0.352 0.054 13 0 "[ . 1 .]"
1 150 ARG 0.941 0.095 5 0 "[ . 1 .]"
1 151 LYS 0.817 0.114 8 0 "[ . 1 .]"
1 152 VAL 0.226 0.052 11 0 "[ . 1 .]"
1 153 VAL 0.762 0.077 6 0 "[ . 1 .]"
1 154 ASP 0.637 0.114 8 0 "[ . 1 .]"
1 155 ARG 0.057 0.035 13 0 "[ . 1 .]"
1 156 VAL 3.687 0.191 15 0 "[ . 1 .]"
1 157 ASN 0.461 0.095 15 0 "[ . 1 .]"
1 158 ASN 0.000 0.000 . 0 "[ . 1 .]"
2 3 GLY 0.169 0.072 5 0 "[ . 1 .]"
2 4 VAL 1.512 0.118 5 0 "[ . 1 .]"
2 5 ARG 0.182 0.063 4 0 "[ . 1 .]"
2 6 SER 1.591 0.152 3 0 "[ . 1 .]"
2 7 VAL 2.207 0.134 12 0 "[ . 1 .]"
2 8 PHE 0.878 0.105 15 0 "[ . 1 .]"
2 9 LEU 0.418 0.077 5 0 "[ . 1 .]"
2 10 ALA 1.274 0.082 8 0 "[ . 1 .]"
2 11 GLY 0.000 0.000 . 0 "[ . 1 .]"
2 12 PRO 0.054 0.054 12 0 "[ . 1 .]"
2 13 PHE 4.608 0.241 10 0 "[ . 1 .]"
2 14 MET 3.441 0.241 10 0 "[ . 1 .]"
2 15 GLY 0.309 0.102 5 0 "[ . 1 .]"
2 16 LEU 4.355 0.246 11 0 "[ . 1 .]"
2 17 VAL 3.603 0.228 5 0 "[ . 1 .]"
2 18 ASN 0.914 0.092 13 0 "[ . 1 .]"
2 19 PRO 2.651 0.196 14 0 "[ . 1 .]"
2 20 GLU 1.358 0.152 12 0 "[ . 1 .]"
2 21 THR 1.318 0.200 2 0 "[ . 1 .]"
2 22 ASN 2.015 0.200 2 0 "[ . 1 .]"
2 23 SER 1.057 0.170 8 0 "[ . 1 .]"
2 24 MET 1.526 0.170 8 0 "[ . 1 .]"
2 25 PRO 1.503 0.575 10 1 "[ . + .]"
2 26 SER 1.492 0.575 10 1 "[ . + .]"
2 27 ALA 0.897 0.086 11 0 "[ . 1 .]"
2 28 GLU 0.607 0.089 10 0 "[ . 1 .]"
2 29 GLN 0.422 0.091 14 0 "[ . 1 .]"
2 30 LEU 2.433 0.213 12 0 "[ . 1 .]"
2 31 PRO 0.213 0.070 5 0 "[ . 1 .]"
2 32 PHE 2.869 0.183 14 0 "[ . 1 .]"
2 33 LEU 0.838 0.172 12 0 "[ . 1 .]"
2 34 THR 1.250 0.250 5 0 "[ . 1 .]"
2 35 LEU 2.337 0.132 4 0 "[ . 1 .]"
2 36 ILE 3.222 0.183 14 0 "[ . 1 .]"
2 37 GLU 0.415 0.088 6 0 "[ . 1 .]"
2 38 HIS 3.233 0.250 5 0 "[ . 1 .]"
2 39 PHE 4.219 0.143 8 0 "[ . 1 .]"
2 40 GLU 0.103 0.045 11 0 "[ . 1 .]"
2 41 LYS 0.170 0.091 11 0 "[ . 1 .]"
2 42 GLN 3.406 0.154 13 0 "[ . 1 .]"
2 43 GLY 2.626 0.170 12 0 "[ . 1 .]"
2 44 LEU 8.691 0.170 12 0 "[ . 1 .]"
2 45 GLU 1.260 0.151 15 0 "[ . 1 .]"
2 46 VAL 1.373 0.152 3 0 "[ . 1 .]"
2 47 PHE 0.284 0.151 15 0 "[ . 1 .]"
2 49 ALA 1.430 0.193 14 0 "[ . 1 .]"
2 50 HIS 0.158 0.036 13 0 "[ . 1 .]"
2 51 ARG 2.355 0.193 14 0 "[ . 1 .]"
2 53 GLU 0.147 0.077 11 0 "[ . 1 .]"
2 54 ALA 3.792 0.334 12 0 "[ . 1 .]"
2 55 TRP 6.312 0.334 12 0 "[ . 1 .]"
2 56 GLY 0.114 0.037 13 0 "[ . 1 .]"
2 57 ALA 0.026 0.026 14 0 "[ . 1 .]"
2 58 GLN 1.955 0.246 11 0 "[ . 1 .]"
2 59 VAL 7.671 0.239 15 0 "[ . 1 .]"
2 60 LEU 3.354 0.210 7 0 "[ . 1 .]"
2 61 THR 5.370 0.239 15 0 "[ . 1 .]"
2 62 PRO 0.028 0.026 11 0 "[ . 1 .]"
2 63 GLU 1.808 0.173 12 0 "[ . 1 .]"
2 64 GLU 0.751 0.132 8 0 "[ . 1 .]"
2 65 CYS 0.320 0.092 6 0 "[ . 1 .]"
2 66 THR 0.880 0.114 10 0 "[ . 1 .]"
2 67 PRO 0.228 0.073 3 0 "[ . 1 .]"
2 68 LEU 1.665 0.136 14 0 "[ . 1 .]"
2 69 ASP 0.468 0.066 12 0 "[ . 1 .]"
2 70 GLN 1.399 0.117 13 0 "[ . 1 .]"
2 71 LEU 4.061 0.146 13 0 "[ . 1 .]"
2 72 GLU 0.373 0.123 8 0 "[ . 1 .]"
2 73 ILE 1.293 0.108 7 0 "[ . 1 .]"
2 74 ARG 4.590 0.180 8 0 "[ . 1 .]"
2 75 LYS 0.610 0.123 8 0 "[ . 1 .]"
2 76 ALA 0.847 0.107 3 0 "[ . 1 .]"
2 77 ASP 0.116 0.064 6 0 "[ . 1 .]"
2 78 VAL 0.898 0.105 15 0 "[ . 1 .]"
2 79 PHE 2.021 0.107 3 0 "[ . 1 .]"
2 80 VAL 0.430 0.069 5 0 "[ . 1 .]"
2 81 ALA 0.432 0.091 15 0 "[ . 1 .]"
2 82 ILE 2.844 0.162 14 0 "[ . 1 .]"
2 83 PRO 10.677 0.625 15 15 [*************-+]
2 84 GLY 11.127 0.625 15 15 [*************-+]
2 85 ILE 3.289 0.233 4 0 "[ . 1 .]"
2 86 PRO 0.001 0.001 1 0 "[ . 1 .]"
2 87 PRO 0.938 0.119 1 0 "[ . 1 .]"
2 88 SER 0.023 0.023 8 0 "[ . 1 .]"
2 89 PRO 0.177 0.119 1 0 "[ . 1 .]"
2 90 GLY 1.527 0.139 7 0 "[ . 1 .]"
2 91 THR 3.099 0.139 7 0 "[ . 1 .]"
2 92 HIS 9.181 0.297 7 0 "[ . 1 .]"
2 93 VAL 6.041 0.289 10 0 "[ . 1 .]"
2 94 GLU 1.635 0.177 4 0 "[ . 1 .]"
2 95 ILE 2.622 0.209 7 0 "[ . 1 .]"
2 96 GLY 3.214 0.173 10 0 "[ . 1 .]"
2 97 TRP 3.421 0.125 10 0 "[ . 1 .]"
2 98 ALA 2.158 0.123 15 0 "[ . 1 .]"
2 99 SER 1.282 0.118 6 0 "[ . 1 .]"
2 100 ALA 6.336 0.284 2 0 "[ . 1 .]"
2 101 PHE 10.489 0.251 8 0 "[ . 1 .]"
2 102 ASP 1.215 0.115 15 0 "[ . 1 .]"
2 103 LYS 2.488 0.175 9 0 "[ . 1 .]"
2 104 PRO 0.028 0.014 7 0 "[ . 1 .]"
2 105 ILE 3.056 0.145 5 0 "[ . 1 .]"
2 106 VAL 2.207 0.145 5 0 "[ . 1 .]"
2 107 LEU 0.860 0.113 14 0 "[ . 1 .]"
2 108 LEU 1.792 0.113 3 0 "[ . 1 .]"
2 109 LEU 5.519 0.334 8 0 "[ . 1 .]"
2 110 GLU 6.456 0.334 8 0 "[ . 1 .]"
2 111 GLU 1.531 0.151 15 0 "[ . 1 .]"
2 112 GLY 0.000 0.000 . 0 "[ . 1 .]"
2 113 ARG 0.670 0.092 9 0 "[ . 1 .]"
2 114 GLU 11.426 0.288 9 0 "[ . 1 .]"
2 115 GLU 1.259 0.105 4 0 "[ . 1 .]"
2 116 GLU 0.535 0.081 6 0 "[ . 1 .]"
2 117 TYR 24.878 0.604 5 14 "[****+****- ****]"
2 118 GLY 0.000 0.000 . 0 "[ . 1 .]"
2 119 PHE 3.930 0.206 7 0 "[ . 1 .]"
2 120 LEU 7.188 0.379 13 0 "[ . 1 .]"
2 121 VAL 2.934 0.208 15 0 "[ . 1 .]"
2 122 ARG 1.011 0.128 5 0 "[ . 1 .]"
2 123 GLY 0.057 0.026 10 0 "[ . 1 .]"
2 124 LEU 6.216 0.209 7 0 "[ . 1 .]"
2 125 GLY 0.526 0.081 2 0 "[ . 1 .]"
2 126 THR 0.361 0.058 2 0 "[ . 1 .]"
2 127 VAL 2.385 0.181 11 0 "[ . 1 .]"
2 128 ALA 2.449 0.122 8 0 "[ . 1 .]"
2 129 ALA 1.691 0.202 3 0 "[ . 1 .]"
2 130 VAL 1.716 0.105 4 0 "[ . 1 .]"
2 131 GLU 0.285 0.046 9 0 "[ . 1 .]"
2 132 PHE 2.523 0.168 6 0 "[ . 1 .]"
2 133 VAL 4.739 0.141 3 0 "[ . 1 .]"
2 134 HIS 1.494 0.151 15 0 "[ . 1 .]"
2 135 TYR 4.350 0.221 11 0 "[ . 1 .]"
2 136 LYS 0.921 0.221 11 0 "[ . 1 .]"
2 137 ASP 0.049 0.034 12 0 "[ . 1 .]"
2 138 ILE 1.575 0.104 1 0 "[ . 1 .]"
2 139 ALA 1.859 0.113 3 0 "[ . 1 .]"
2 140 LEU 0.732 0.095 7 0 "[ . 1 .]"
2 141 ALA 2.224 0.127 15 0 "[ . 1 .]"
2 142 LYS 0.470 0.087 10 0 "[ . 1 .]"
2 143 PRO 0.719 0.074 13 0 "[ . 1 .]"
2 144 GLN 3.251 0.138 5 0 "[ . 1 .]"
2 145 ILE 1.180 0.090 9 0 "[ . 1 .]"
2 146 ASP 0.313 0.062 13 0 "[ . 1 .]"
2 147 ALA 1.347 0.107 14 0 "[ . 1 .]"
2 148 ALA 0.499 0.122 6 0 "[ . 1 .]"
2 149 ILE 0.453 0.062 13 0 "[ . 1 .]"
2 150 ARG 1.015 0.118 5 0 "[ . 1 .]"
2 151 LYS 0.820 0.100 8 0 "[ . 1 .]"
2 152 VAL 0.289 0.062 15 0 "[ . 1 .]"
2 153 VAL 0.845 0.081 6 0 "[ . 1 .]"
2 154 ASP 0.627 0.100 8 0 "[ . 1 .]"
2 155 ARG 0.033 0.025 13 0 "[ . 1 .]"
2 156 VAL 3.887 0.202 3 0 "[ . 1 .]"
2 157 ASN 0.553 0.105 15 0 "[ . 1 .]"
2 158 ASN 0.000 0.000 . 0 "[ . 1 .]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 GLY H 1 4 VAL H 2.700 . 2.700 2.270 1.703 2.689 0.097 15 0 "[ . 1 .]" 1
2 1 3 GLY H 1 44 LEU MD2 5.000 . 5.500 5.004 4.078 5.537 0.037 14 0 "[ . 1 .]" 1
3 1 3 GLY QA 1 4 VAL MG2 3.500 . 4.300 3.562 3.029 4.071 . 0 0 "[ . 1 .]" 1
4 1 4 VAL HA 1 5 ARG H 2.700 . 2.700 2.220 2.134 2.474 . 0 0 "[ . 1 .]" 1
5 1 4 VAL H 1 4 VAL HB 2.700 . 2.700 2.632 2.396 2.794 0.094 5 0 "[ . 1 .]" 1
6 1 4 VAL HA 1 6 SER H 3.500 . 3.500 3.481 3.192 3.567 0.067 1 0 "[ . 1 .]" 1
7 1 4 VAL H 1 44 LEU MD2 5.000 . 5.500 3.579 2.786 4.000 . 0 0 "[ . 1 .]" 1
8 1 4 VAL HA 1 77 ASP QB 5.000 . 5.300 3.630 2.982 3.997 . 0 0 "[ . 1 .]" 1
9 1 4 VAL HB 1 44 LEU MD2 3.500 . 4.000 2.078 1.768 2.675 0.032 5 0 "[ . 1 .]" 1
10 1 4 VAL MG1 1 6 SER H 2.700 . 3.200 2.598 2.055 3.074 . 0 0 "[ . 1 .]" 1
11 1 4 VAL MG1 1 6 SER HA 5.000 . 5.500 3.617 3.310 3.958 . 0 0 "[ . 1 .]" 1
12 1 4 VAL MG1 1 39 PHE QD 5.000 . 5.800 3.975 3.042 5.034 . 0 0 "[ . 1 .]" 1
13 1 4 VAL MG1 1 39 PHE QE 5.000 . 5.800 3.651 2.661 4.830 . 0 0 "[ . 1 .]" 1
14 1 4 VAL MG1 1 39 PHE HZ 5.000 . 5.500 4.917 4.351 5.464 . 0 0 "[ . 1 .]" 1
15 1 4 VAL MG2 1 39 PHE QD 5.000 . 5.800 5.439 5.101 5.870 0.070 5 0 "[ . 1 .]" 1
16 1 4 VAL MG2 1 39 PHE QE 5.000 . 5.800 4.381 3.906 5.061 . 0 0 "[ . 1 .]" 1
17 1 4 VAL MG2 1 39 PHE HZ 5.000 . 5.500 5.531 5.473 5.652 0.152 5 0 "[ . 1 .]" 1
18 1 4 VAL MG1 1 44 LEU MD2 3.500 . 4.500 2.376 1.934 3.137 . 0 0 "[ . 1 .]" 1
19 1 4 VAL MG2 1 44 LEU MD2 3.500 . 4.500 3.456 2.714 3.861 . 0 0 "[ . 1 .]" 1
20 1 4 VAL MG1 1 77 ASP QB 3.500 . 4.300 3.374 2.377 4.167 . 0 0 "[ . 1 .]" 1
21 1 4 VAL MG1 1 78 VAL MG2 2.700 . 3.700 2.905 2.275 3.415 . 0 0 "[ . 1 .]" 1
22 1 4 VAL MG1 1 149 ILE MG 3.500 . 4.500 3.127 2.759 3.562 . 0 0 "[ . 1 .]" 1
23 1 4 VAL MG1 1 149 ILE MD 5.000 . 6.000 3.380 2.596 4.075 . 0 0 "[ . 1 .]" 1
24 1 4 VAL MG2 1 150 ARG HA 3.500 . 4.000 3.645 2.916 4.011 0.011 15 0 "[ . 1 .]" 1
25 1 4 VAL MG2 1 150 ARG QD 3.500 . 4.300 3.917 2.895 4.395 0.095 5 0 "[ . 1 .]" 1
26 1 4 VAL MG1 1 153 VAL MG2 3.500 . 4.500 4.084 3.523 4.472 . 0 0 "[ . 1 .]" 1
27 1 5 ARG H 1 6 SER H 2.700 . 2.700 2.290 1.924 2.759 0.059 4 0 "[ . 1 .]" 1
28 1 5 ARG HA 1 6 SER H 3.500 . 3.500 3.473 3.383 3.525 0.025 4 0 "[ . 1 .]" 1
29 1 5 ARG H 1 77 ASP QB 5.000 . 5.300 2.898 2.406 3.472 . 0 0 "[ . 1 .]" 1
30 1 5 ARG HA 1 44 LEU MD2 5.000 . 5.500 3.388 2.735 3.782 . 0 0 "[ . 1 .]" 1
31 1 5 ARG HA 1 45 GLU H 5.000 . 5.000 4.252 3.999 4.554 . 0 0 "[ . 1 .]" 1
32 1 5 ARG QD 1 44 LEU MD2 3.500 . 4.300 4.120 3.747 4.324 0.024 1 0 "[ . 1 .]" 1
33 1 6 SER HA 1 7 VAL H 2.700 . 2.700 2.141 2.104 2.184 . 0 0 "[ . 1 .]" 1
34 1 6 SER H 1 78 VAL H 5.000 . 5.000 3.970 3.739 4.224 . 0 0 "[ . 1 .]" 1
35 1 6 SER H 1 44 LEU MD2 5.000 . 5.500 4.275 3.732 4.655 . 0 0 "[ . 1 .]" 1
36 1 6 SER H 1 77 ASP QB 3.500 . 3.800 2.163 1.837 2.595 . 0 0 "[ . 1 .]" 1
37 1 6 SER HA 1 44 LEU MD2 5.000 . 5.500 4.354 4.135 4.559 . 0 0 "[ . 1 .]" 1
38 1 6 SER HA 1 44 LEU MD1 5.000 . 5.500 5.453 5.126 5.574 0.074 7 0 "[ . 1 .]" 1
39 1 6 SER HA 1 45 GLU H 3.500 . 3.500 1.952 1.773 2.074 0.027 5 0 "[ . 1 .]" 1
40 1 6 SER HA 1 45 GLU QB 3.500 . 3.800 2.605 2.108 3.059 . 0 0 "[ . 1 .]" 1
41 1 6 SER HA 1 46 VAL MG2 5.000 . 5.500 5.004 4.253 5.354 . 0 0 "[ . 1 .]" 1
42 1 6 SER QB 1 46 VAL MG1 5.000 . 5.800 5.836 5.614 5.905 0.105 8 0 "[ . 1 .]" 1
43 1 6 SER QB 1 46 VAL MG2 5.000 . 5.800 5.463 5.027 5.633 . 0 0 "[ . 1 .]" 1
44 1 6 SER HA 1 47 PHE QR 5.000 . 6.500 3.723 3.026 4.306 . 0 0 "[ . 1 .]" 1
45 1 6 SER QB 1 76 ALA HA 5.000 . 5.300 3.040 2.446 3.974 . 0 0 "[ . 1 .]" 1
46 1 6 SER QB 1 76 ALA MB 5.000 . 5.800 3.877 3.425 4.769 . 0 0 "[ . 1 .]" 1
47 1 7 VAL H 1 44 LEU MD2 5.000 . 5.500 4.733 4.394 4.978 . 0 0 "[ . 1 .]" 1
48 1 7 VAL H 1 44 LEU HA 3.500 . 3.500 3.595 3.549 3.629 0.129 11 0 "[ . 1 .]" 1
49 1 7 VAL H 1 45 GLU H 3.500 . 3.500 3.502 3.397 3.585 0.085 8 0 "[ . 1 .]" 1
50 1 7 VAL H 1 46 VAL HA 5.000 . 5.000 3.070 2.891 3.236 . 0 0 "[ . 1 .]" 1
51 1 7 VAL H 1 46 VAL MG2 5.000 . 5.500 3.697 2.637 3.970 . 0 0 "[ . 1 .]" 1
52 1 7 VAL H 1 47 PHE QR 3.500 . 5.000 3.959 3.143 4.499 . 0 0 "[ . 1 .]" 1
53 1 7 VAL H 1 76 ALA MB 5.000 . 5.500 5.078 4.686 5.501 0.001 15 0 "[ . 1 .]" 1
54 1 7 VAL HA 1 8 PHE H 2.700 . 2.700 2.159 2.136 2.199 . 0 0 "[ . 1 .]" 1
55 1 7 VAL HA 1 46 VAL HA 5.000 . 5.000 4.690 4.412 4.872 . 0 0 "[ . 1 .]" 1
56 1 7 VAL HA 1 76 ALA MB 3.500 . 4.000 3.783 3.375 4.014 0.014 3 0 "[ . 1 .]" 1
57 1 7 VAL HA 1 77 ASP H 5.000 . 5.000 4.439 3.877 4.865 . 0 0 "[ . 1 .]" 1
58 1 7 VAL HA 1 78 VAL H 3.500 . 3.500 2.916 2.460 3.386 . 0 0 "[ . 1 .]" 1
59 1 7 VAL HA 1 78 VAL MG1 3.500 . 4.000 2.258 1.801 3.174 . 0 0 "[ . 1 .]" 1
60 1 7 VAL HB 1 39 PHE HA 5.000 . 5.000 4.734 4.329 5.041 0.041 6 0 "[ . 1 .]" 1
61 1 7 VAL HB 1 46 VAL HA 5.000 . 5.000 3.557 3.201 4.496 . 0 0 "[ . 1 .]" 1
62 1 7 VAL HB 1 46 VAL MG1 5.000 . 5.500 4.516 3.733 5.422 . 0 0 "[ . 1 .]" 1
63 1 7 VAL HB 1 46 VAL MG2 5.000 . 5.500 3.248 1.826 4.375 . 0 0 "[ . 1 .]" 1
64 1 7 VAL HB 1 78 VAL MG1 3.500 . 4.000 3.914 3.714 4.044 0.044 5 0 "[ . 1 .]" 1
65 1 7 VAL MG1 1 39 PHE QB 5.000 . 5.800 3.836 2.486 4.716 . 0 0 "[ . 1 .]" 1
66 1 7 VAL MG2 1 39 PHE QB 5.000 . 5.800 4.162 3.780 4.738 . 0 0 "[ . 1 .]" 1
67 1 7 VAL MG1 1 39 PHE QE 3.500 . 4.300 2.306 1.805 2.833 . 0 0 "[ . 1 .]" 1
68 1 7 VAL MG1 1 39 PHE QD 3.500 . 4.300 3.017 2.065 3.552 . 0 0 "[ . 1 .]" 1
69 1 7 VAL MG1 1 39 PHE HZ 5.000 . 5.500 2.452 1.927 3.691 . 0 0 "[ . 1 .]" 1
70 1 7 VAL MG2 1 39 PHE QE 3.500 . 4.300 2.338 1.737 2.943 0.063 8 0 "[ . 1 .]" 1
71 1 7 VAL MG2 1 39 PHE QD 3.500 . 4.300 3.046 2.189 3.667 . 0 0 "[ . 1 .]" 1
72 1 7 VAL MG2 1 39 PHE HZ 5.000 . 5.500 2.779 2.052 3.116 . 0 0 "[ . 1 .]" 1
73 1 7 VAL MG1 1 46 VAL HA 3.500 . 4.000 3.374 2.130 4.030 0.030 4 0 "[ . 1 .]" 1
74 1 7 VAL MG2 1 78 VAL H 5.000 . 5.500 3.937 3.494 4.478 . 0 0 "[ . 1 .]" 1
75 1 7 VAL MG1 1 80 VAL H 5.000 . 5.500 3.616 2.965 4.907 . 0 0 "[ . 1 .]" 1
76 1 7 VAL MG1 1 9 LEU QB 3.500 . 4.300 3.485 3.051 3.872 . 0 0 "[ . 1 .]" 1
77 1 7 VAL MG1 1 9 LEU MD2 3.500 . 4.500 3.800 2.610 4.419 . 0 0 "[ . 1 .]" 1
78 1 7 VAL MG2 1 9 LEU MD2 5.000 . 6.000 5.489 3.202 6.054 0.054 9 0 "[ . 1 .]" 1
79 1 7 VAL MG2 1 44 LEU HA 5.000 . 5.500 4.188 3.368 5.445 . 0 0 "[ . 1 .]" 1
80 1 7 VAL MG2 1 44 LEU QB 3.500 . 4.300 2.262 1.843 3.453 . 0 0 "[ . 1 .]" 1
81 1 7 VAL MG2 1 44 LEU MD1 3.500 . 4.500 2.471 2.067 3.528 . 0 0 "[ . 1 .]" 1
82 1 7 VAL MG2 1 44 LEU MD2 3.500 . 4.500 3.610 3.273 4.470 . 0 0 "[ . 1 .]" 1
83 1 7 VAL MG1 1 44 LEU MD1 5.000 . 6.000 4.009 3.013 4.302 . 0 0 "[ . 1 .]" 1
84 1 7 VAL MG1 1 44 LEU MD2 5.000 . 6.000 5.386 4.483 5.710 . 0 0 "[ . 1 .]" 1
85 1 7 VAL MG1 1 46 VAL MG1 3.500 . 4.500 3.404 2.276 4.129 . 0 0 "[ . 1 .]" 1
86 1 7 VAL MG1 1 46 VAL MG2 3.500 . 4.500 3.068 1.848 4.405 . 0 0 "[ . 1 .]" 1
87 1 7 VAL MG2 1 46 VAL MG2 3.500 . 4.500 4.281 3.182 4.573 0.073 13 0 "[ . 1 .]" 1
88 1 7 VAL MG2 1 78 VAL MG1 2.700 . 3.700 1.881 1.778 2.184 0.022 8 0 "[ . 1 .]" 1
89 1 7 VAL MG2 1 78 VAL MG2 3.500 . 4.500 3.570 3.135 3.992 . 0 0 "[ . 1 .]" 1
90 1 7 VAL MG1 1 78 VAL MG1 3.500 . 4.500 2.739 1.804 4.209 . 0 0 "[ . 1 .]" 1
91 1 7 VAL MG1 1 80 VAL MG2 3.500 . 4.500 2.419 1.821 3.556 . 0 0 "[ . 1 .]" 1
92 1 7 VAL MG2 1 80 VAL MG2 5.000 . 6.000 2.640 1.783 4.518 0.017 11 0 "[ . 1 .]" 1
93 1 7 VAL MG1 1 149 ILE MD 6.000 . 7.000 3.181 2.464 4.403 . 0 0 "[ . 1 .]" 1
94 1 7 VAL MG1 1 149 ILE MG 6.000 . 7.000 4.800 3.799 5.791 . 0 0 "[ . 1 .]" 1
95 1 7 VAL MG2 1 149 ILE MG 5.000 . 6.000 3.321 2.814 3.874 . 0 0 "[ . 1 .]" 1
96 1 7 VAL MG2 1 149 ILE MD 5.000 . 6.000 2.353 1.783 3.144 0.017 3 0 "[ . 1 .]" 1
97 1 8 PHE H 1 78 VAL H 3.500 . 3.500 3.534 3.408 3.632 0.132 15 0 "[ . 1 .]" 1
98 1 8 PHE H 1 78 VAL QG 5.000 . 5.500 2.878 2.580 3.510 . 0 0 "[ . 1 .]" 1
99 1 8 PHE H 1 76 ALA MB 5.000 . 5.500 2.750 2.426 2.958 . 0 0 "[ . 1 .]" 1
100 1 8 PHE QR 1 10 ALA MB 2.700 . 4.700 1.872 1.745 2.305 0.055 11 0 "[ . 1 .]" 1
101 1 8 PHE QD 1 69 ASP HA 5.000 . 5.300 4.866 4.171 5.283 . 0 0 "[ . 1 .]" 1
102 1 8 PHE QD 1 73 ILE HA 5.000 . 5.300 3.413 1.808 4.635 . 0 0 "[ . 1 .]" 1
103 1 8 PHE QD 1 73 ILE MD 3.500 . 4.300 3.858 3.155 4.298 . 0 0 "[ . 1 .]" 1
104 1 8 PHE QR 1 81 ALA MB 5.000 . 7.000 2.725 1.784 4.474 0.016 1 0 "[ . 1 .]" 1
105 1 8 PHE QR 1 91 THR MG 5.000 . 7.000 3.550 2.844 4.670 . 0 0 "[ . 1 .]" 1
106 1 9 LEU HA 1 10 ALA H 2.700 . 2.700 2.179 2.097 2.312 . 0 0 "[ . 1 .]" 1
107 1 9 LEU HA 1 80 VAL H 5.000 . 5.000 3.892 3.639 4.168 . 0 0 "[ . 1 .]" 1
108 1 9 LEU QB 1 46 VAL MG1 5.000 . 5.800 2.324 1.710 3.184 0.090 5 0 "[ . 1 .]" 1
109 1 9 LEU MD1 1 32 PHE HA 5.000 . 5.500 4.065 2.880 5.390 . 0 0 "[ . 1 .]" 1
110 1 9 LEU MD2 1 32 PHE HA 5.000 . 5.500 4.375 3.237 5.172 . 0 0 "[ . 1 .]" 1
111 1 9 LEU MD2 1 32 PHE QD 3.500 . 4.300 3.361 2.250 4.169 . 0 0 "[ . 1 .]" 1
112 1 9 LEU MD2 1 32 PHE QE 5.000 . 5.800 2.939 1.964 4.119 . 0 0 "[ . 1 .]" 1
113 1 9 LEU MD1 1 32 PHE QD 3.500 . 4.300 3.541 2.240 4.344 0.044 11 0 "[ . 1 .]" 1
114 1 9 LEU MD1 1 35 LEU MD2 5.000 . 6.000 3.512 2.364 5.985 . 0 0 "[ . 1 .]" 1
115 1 9 LEU MD2 1 35 LEU MD2 5.000 . 6.000 3.813 3.068 5.289 . 0 0 "[ . 1 .]" 1
116 1 9 LEU MD2 1 36 ILE MD 5.000 . 6.000 2.877 1.755 3.940 0.045 5 0 "[ . 1 .]" 1
117 1 9 LEU MD2 1 46 VAL MG1 5.000 . 6.000 4.132 2.036 5.016 . 0 0 "[ . 1 .]" 1
118 1 9 LEU MD1 1 49 ALA MB 5.000 . 6.000 3.818 2.381 4.622 . 0 0 "[ . 1 .]" 1
119 1 9 LEU MD2 1 49 ALA MB 5.000 . 6.000 4.447 3.797 4.939 . 0 0 "[ . 1 .]" 1
120 1 9 LEU MD1 1 80 VAL QG 3.500 . 4.500 2.821 1.997 4.317 . 0 0 "[ . 1 .]" 1
121 1 9 LEU MD2 1 80 VAL QG 5.000 . 6.000 2.159 1.729 2.794 0.071 5 0 "[ . 1 .]" 1
122 1 9 LEU MD1 1 81 ALA HA 5.000 . 5.500 4.901 3.186 5.524 0.024 15 0 "[ . 1 .]" 1
123 1 9 LEU MD1 1 82 ILE MD 5.000 . 6.000 4.629 3.429 5.775 . 0 0 "[ . 1 .]" 1
124 1 10 ALA H 1 81 ALA HA 3.500 . 3.500 2.235 1.881 3.210 . 0 0 "[ . 1 .]" 1
125 1 10 ALA H 1 80 VAL QG 5.000 . 5.500 4.080 3.302 4.628 . 0 0 "[ . 1 .]" 1
126 1 10 ALA H 1 81 ALA MB 5.000 . 5.500 3.342 2.544 4.626 . 0 0 "[ . 1 .]" 1
127 1 10 ALA HA 1 11 GLY H 2.700 . 2.700 2.349 2.165 2.666 . 0 0 "[ . 1 .]" 1
128 1 10 ALA HA 1 91 THR MG 3.500 . 4.000 4.030 3.921 4.097 0.097 6 0 "[ . 1 .]" 1
129 1 10 ALA MB 1 13 PHE QE 5.000 . 5.800 5.418 4.731 5.789 . 0 0 "[ . 1 .]" 1
130 1 10 ALA MB 1 49 ALA HA 5.000 . 5.500 4.682 4.310 5.534 0.034 7 0 "[ . 1 .]" 1
131 1 10 ALA MB 1 50 HIS HE1 3.500 . 4.000 3.806 3.432 4.060 0.060 13 0 "[ . 1 .]" 1
132 1 10 ALA MB 1 81 ALA HA 3.500 . 4.000 3.341 2.647 3.713 . 0 0 "[ . 1 .]" 1
133 1 10 ALA MB 1 81 ALA MB 3.500 . 4.500 2.671 2.164 3.090 . 0 0 "[ . 1 .]" 1
134 1 10 ALA MB 1 82 ILE H 3.500 . 4.000 3.801 3.378 4.054 0.054 7 0 "[ . 1 .]" 1
135 1 10 ALA MB 1 79 PHE QE 3.500 . 4.300 3.988 3.685 4.250 . 0 0 "[ . 1 .]" 1
136 1 10 ALA MB 1 91 THR HA 5.000 . 5.500 2.843 2.206 3.191 . 0 0 "[ . 1 .]" 1
137 1 10 ALA MB 1 91 THR MG 3.500 . 4.500 1.998 1.845 2.182 . 0 0 "[ . 1 .]" 1
138 1 10 ALA MB 1 95 ILE MD 5.000 . 6.000 4.025 3.515 4.499 . 0 0 "[ . 1 .]" 1
139 1 11 GLY QA 1 82 ILE H 3.500 . 3.800 3.287 2.809 3.782 . 0 0 "[ . 1 .]" 1
140 1 11 GLY QA 1 82 ILE MG 5.000 . 5.800 3.047 2.097 4.175 . 0 0 "[ . 1 .]" 1
141 1 11 GLY QA 1 82 ILE MD 5.000 . 5.800 4.410 3.847 5.156 . 0 0 "[ . 1 .]" 1
142 1 11 GLY QA 1 91 THR MG 5.000 . 5.800 2.845 2.237 3.293 . 0 0 "[ . 1 .]" 1
143 1 12 PRO QD 1 16 LEU MD2 5.000 . 5.800 3.220 2.700 3.730 . 0 0 "[ . 1 .]" 1
144 1 12 PRO QD 1 82 ILE MD 5.000 . 5.800 4.483 3.813 5.208 . 0 0 "[ . 1 .]" 1
145 1 12 PRO QD 1 82 ILE MG 5.000 . 5.800 2.519 1.730 3.621 0.070 12 0 "[ . 1 .]" 1
146 1 13 PHE HA 1 17 VAL MG2 5.000 . 5.500 4.641 2.552 5.519 0.019 12 0 "[ . 1 .]" 1
147 1 13 PHE HA 1 17 VAL MG1 5.000 . 5.500 3.783 2.489 5.485 . 0 0 "[ . 1 .]" 1
148 1 13 PHE HA 1 59 VAL MG1 5.000 . 5.500 5.269 3.615 5.639 0.139 7 0 "[ . 1 .]" 1
149 1 13 PHE HA 1 59 VAL MG2 3.500 . 4.000 3.905 3.104 4.184 0.184 13 0 "[ . 1 .]" 1
150 1 13 PHE QD 1 14 MET HA 3.500 . 3.800 3.897 3.723 4.081 0.281 10 0 "[ . 1 .]" 1
151 1 13 PHE QD 1 14 MET ME 3.500 . 4.300 4.033 3.766 4.365 0.065 13 0 "[ . 1 .]" 1
152 1 13 PHE QE 1 14 MET ME 5.000 . 5.800 5.508 5.087 5.862 0.062 9 0 "[ . 1 .]" 1
153 1 13 PHE QD 1 16 LEU MD1 3.500 . 4.300 4.216 3.461 4.402 0.102 15 0 "[ . 1 .]" 1
154 1 13 PHE QE 1 16 LEU MD1 5.000 . 5.800 4.902 3.684 5.255 . 0 0 "[ . 1 .]" 1
155 1 13 PHE QD 1 16 LEU MD2 5.000 . 5.800 3.127 2.520 3.592 . 0 0 "[ . 1 .]" 1
156 1 13 PHE QE 1 16 LEU MD2 5.000 . 5.800 4.403 4.006 4.821 . 0 0 "[ . 1 .]" 1
157 1 13 PHE QD 1 17 VAL MG1 3.500 . 4.300 3.367 1.756 4.354 0.054 7 0 "[ . 1 .]" 1
158 1 13 PHE QE 1 17 VAL MG1 5.000 . 5.800 4.345 3.044 5.011 . 0 0 "[ . 1 .]" 1
159 1 13 PHE QD 1 17 VAL MG2 5.000 . 5.800 4.385 2.481 5.311 . 0 0 "[ . 1 .]" 1
160 1 13 PHE QE 1 17 VAL MG2 5.000 . 5.800 4.741 2.997 5.578 . 0 0 "[ . 1 .]" 1
161 1 24 MET ME 1 32 PHE QD 3.500 . 4.300 3.523 2.314 4.245 . 0 0 "[ . 1 .]" 1
162 1 24 MET ME 1 32 PHE QE 5.000 . 5.800 3.508 3.008 4.477 . 0 0 "[ . 1 .]" 1
163 1 24 MET ME 1 32 PHE HZ 5.000 . 5.500 4.829 3.556 5.530 0.030 13 0 "[ . 1 .]" 1
164 1 13 PHE QE 1 54 ALA MB 3.500 . 4.300 3.767 2.810 4.456 0.156 10 0 "[ . 1 .]" 1
165 1 13 PHE HZ 1 54 ALA MB 3.500 . 4.000 4.007 3.882 4.151 0.151 9 0 "[ . 1 .]" 1
166 1 13 PHE HZ 1 58 GLN QG 5.000 . 5.300 3.519 1.831 5.336 0.036 13 0 "[ . 1 .]" 1
167 1 13 PHE QE 1 59 VAL MG1 5.000 . 5.800 3.774 3.447 4.197 . 0 0 "[ . 1 .]" 1
168 1 13 PHE QE 1 59 VAL MG2 5.000 . 5.800 3.035 1.805 3.972 . 0 0 "[ . 1 .]" 1
169 1 13 PHE HZ 1 59 VAL MG1 5.000 . 5.500 5.420 4.907 5.582 0.082 11 0 "[ . 1 .]" 1
170 1 13 PHE HZ 1 59 VAL MG2 5.000 . 5.500 4.604 4.016 5.043 . 0 0 "[ . 1 .]" 1
171 1 13 PHE QE 1 60 LEU MD1 5.000 . 5.800 3.641 2.369 4.919 . 0 0 "[ . 1 .]" 1
172 1 13 PHE HZ 1 60 LEU MD1 5.000 . 5.500 3.267 2.312 4.488 . 0 0 "[ . 1 .]" 1
173 1 14 MET HA 1 17 VAL MG2 3.500 . 4.000 4.037 3.804 4.202 0.202 5 0 "[ . 1 .]" 1
174 1 14 MET HA 1 17 VAL MG1 5.000 . 5.500 2.289 1.694 3.584 0.106 3 0 "[ . 1 .]" 1
175 1 14 MET ME 1 17 VAL MG2 5.000 . 6.000 5.193 3.682 6.137 0.137 8 0 "[ . 1 .]" 1
176 1 14 MET ME 1 19 PRO QG 5.000 . 5.800 5.396 4.756 5.848 0.048 2 0 "[ . 1 .]" 1
177 1 14 MET ME 1 59 VAL MG1 5.000 . 6.000 3.685 1.752 5.441 0.048 5 0 "[ . 1 .]" 1
178 1 14 MET ME 1 59 VAL MG2 5.000 . 6.000 4.362 1.848 6.002 0.002 8 0 "[ . 1 .]" 1
179 1 14 MET ME 1 89 PRO QD 5.000 . 5.800 4.534 1.929 5.934 0.134 1 0 "[ . 1 .]" 1
180 1 14 MET ME 2 119 PHE QE 3.500 . 4.300 3.028 2.492 3.694 . 0 0 "[ . 1 .]" 1
181 1 14 MET ME 2 119 PHE QD 5.000 . 5.800 2.444 1.788 3.622 0.012 9 0 "[ . 1 .]" 1
182 1 15 GLY QA 1 16 LEU H 3.500 . 3.800 2.414 2.265 2.589 . 0 0 "[ . 1 .]" 1
183 1 15 GLY QA 1 17 VAL MG1 5.000 . 5.800 4.494 3.800 5.765 . 0 0 "[ . 1 .]" 1
184 1 15 GLY QA 1 19 PRO HA 5.000 . 5.300 5.123 4.383 5.392 0.092 5 0 "[ . 1 .]" 1
185 1 16 LEU HA 1 17 VAL H 3.500 . 3.500 3.463 3.380 3.531 0.031 14 0 "[ . 1 .]" 1
186 1 16 LEU QB 1 24 MET ME 5.000 . 5.800 4.402 2.719 5.558 . 0 0 "[ . 1 .]" 1
187 1 16 LEU MD2 1 17 VAL MG2 3.500 . 4.500 3.466 1.818 4.280 . 0 0 "[ . 1 .]" 1
188 1 16 LEU MD1 1 17 VAL MG2 5.000 . 6.000 3.928 1.842 5.069 . 0 0 "[ . 1 .]" 1
189 1 16 LEU MD1 1 24 MET HA 5.000 . 5.500 2.390 1.676 3.959 0.124 11 0 "[ . 1 .]" 1
190 1 16 LEU MD2 1 24 MET HA 5.000 . 5.500 4.242 3.483 5.546 0.046 10 0 "[ . 1 .]" 1
191 1 16 LEU MD1 1 24 MET ME 3.500 . 4.500 2.523 1.786 3.391 0.014 6 0 "[ . 1 .]" 1
192 1 16 LEU MD1 1 25 PRO QB 3.500 . 4.300 4.195 3.951 4.401 0.101 1 0 "[ . 1 .]" 1
193 1 16 LEU MD1 1 25 PRO QD 5.000 . 5.800 2.016 1.702 3.500 0.098 8 0 "[ . 1 .]" 1
194 1 16 LEU MD1 1 28 GLU QB 3.500 . 4.300 3.838 3.332 4.290 . 0 0 "[ . 1 .]" 1
195 1 16 LEU MD1 1 28 GLU QG 5.000 . 5.800 3.276 2.727 4.340 . 0 0 "[ . 1 .]" 1
196 1 16 LEU MD1 1 58 GLN QG 3.500 . 4.300 4.216 3.704 4.537 0.237 11 0 "[ . 1 .]" 1
197 1 16 LEU MD2 1 84 GLY QA 5.000 . 5.800 5.827 5.634 5.908 0.108 9 0 "[ . 1 .]" 1
198 1 16 LEU MD2 2 119 PHE QD 5.000 . 5.800 5.783 5.394 5.957 0.157 7 0 "[ . 1 .]" 1
199 1 16 LEU MD2 2 119 PHE QE 3.500 . 4.300 4.384 4.197 4.506 0.206 7 0 "[ . 1 .]" 1
200 1 16 LEU MD2 2 119 PHE HZ 5.000 . 5.500 5.462 5.191 5.569 0.069 15 0 "[ . 1 .]" 1
201 1 17 VAL HA 1 18 ASN H 2.700 . 2.700 2.410 2.173 2.773 0.073 3 0 "[ . 1 .]" 1
202 1 17 VAL HA 1 24 MET HA 5.000 . 5.000 4.565 3.659 5.065 0.065 14 0 "[ . 1 .]" 1
203 1 17 VAL MG1 1 24 MET HA 5.000 . 5.500 5.256 4.534 5.546 0.046 10 0 "[ . 1 .]" 1
204 1 17 VAL MG1 1 18 ASN H 3.500 . 4.000 2.909 2.113 4.081 0.081 13 0 "[ . 1 .]" 1
205 1 17 VAL MG1 1 18 ASN HA 5.000 . 5.500 4.054 3.452 5.010 . 0 0 "[ . 1 .]" 1
206 1 17 VAL MG1 1 19 PRO HA 5.000 . 5.500 4.004 3.362 5.074 . 0 0 "[ . 1 .]" 1
207 1 17 VAL MG1 1 20 GLU HA 3.500 . 4.000 4.034 3.891 4.130 0.130 12 0 "[ . 1 .]" 1
208 1 17 VAL MG1 1 22 ASN HA 5.000 . 5.500 4.675 3.552 5.641 0.141 8 0 "[ . 1 .]" 1
209 1 17 VAL MG1 1 22 ASN QB 5.000 . 5.800 3.828 1.749 5.706 0.051 11 0 "[ . 1 .]" 1
210 1 17 VAL MG1 2 119 PHE HZ 3.500 . 4.000 3.905 3.346 4.134 0.134 11 0 "[ . 1 .]" 1
211 1 17 VAL MG1 2 119 PHE QE 5.000 . 5.800 3.500 2.407 4.323 . 0 0 "[ . 1 .]" 1
212 1 17 VAL MG2 2 119 PHE HZ 5.000 . 5.500 5.045 4.106 5.519 0.019 2 0 "[ . 1 .]" 1
213 1 17 VAL MG2 2 119 PHE QE 5.000 . 5.800 4.906 3.658 5.603 . 0 0 "[ . 1 .]" 1
214 1 18 ASN H 1 19 PRO QD 5.000 . 5.300 4.153 3.978 4.291 . 0 0 "[ . 1 .]" 1
215 1 18 ASN H 1 22 ASN H 5.000 . 5.000 4.738 4.333 5.090 0.090 10 0 "[ . 1 .]" 1
216 1 18 ASN HA 1 19 PRO QD 2.700 . 3.000 1.833 1.745 1.918 0.055 8 0 "[ . 1 .]" 1
217 1 18 ASN HA 1 19 PRO QG 3.500 . 3.800 3.800 3.734 3.860 0.060 13 0 "[ . 1 .]" 1
218 1 18 ASN HA 1 20 GLU H 5.000 . 5.000 4.817 4.546 5.014 0.014 3 0 "[ . 1 .]" 1
219 1 18 ASN QB 1 20 GLU H 5.000 . 5.300 4.471 3.961 5.196 . 0 0 "[ . 1 .]" 1
220 1 18 ASN QB 1 23 SER H 5.000 . 5.300 4.920 4.364 5.356 0.056 8 0 "[ . 1 .]" 1
221 1 19 PRO HA 1 20 GLU H 2.700 . 2.700 2.470 2.390 2.625 . 0 0 "[ . 1 .]" 1
222 1 19 PRO QD 1 59 VAL MG2 5.000 . 5.800 5.802 5.388 5.971 0.171 8 0 "[ . 1 .]" 1
223 1 19 PRO QD 1 59 VAL MG1 5.000 . 5.800 5.756 5.271 6.004 0.204 14 0 "[ . 1 .]" 1
224 1 19 PRO HA 1 59 VAL QG 5.000 . 5.500 4.450 3.924 4.818 . 0 0 "[ . 1 .]" 1
225 1 20 GLU H 1 21 THR H 3.500 . 3.500 2.321 1.821 2.782 . 0 0 "[ . 1 .]" 1
226 1 20 GLU HA 1 21 THR H 2.700 . 2.700 2.706 2.580 2.856 0.156 11 0 "[ . 1 .]" 1
227 1 20 GLU QG 1 21 THR MG 5.000 . 5.800 5.334 4.614 5.842 0.042 15 0 "[ . 1 .]" 1
228 1 20 GLU HA 1 59 VAL MG1 5.000 . 5.500 2.438 1.833 3.177 . 0 0 "[ . 1 .]" 1
229 1 20 GLU HA 2 119 PHE QD 5.000 . 5.300 4.718 3.913 5.116 . 0 0 "[ . 1 .]" 1
230 1 20 GLU HA 2 119 PHE QE 5.000 . 5.300 4.290 3.299 5.127 . 0 0 "[ . 1 .]" 1
231 1 21 THR HA 1 22 ASN H 2.700 . 2.700 2.519 2.136 2.897 0.197 2 0 "[ . 1 .]" 1
232 1 21 THR MG 1 23 SER QB 5.000 . 5.800 5.154 3.259 5.888 0.088 10 0 "[ . 1 .]" 1
233 1 21 THR HA 1 59 VAL MG2 5.000 . 5.500 4.041 2.573 4.862 . 0 0 "[ . 1 .]" 1
234 1 22 ASN QB 1 24 MET QB 5.000 . 5.600 5.275 4.581 5.609 0.009 3 0 "[ . 1 .]" 1
235 1 22 ASN QB 1 59 VAL MG1 3.500 . 4.300 4.258 3.636 4.430 0.130 15 0 "[ . 1 .]" 1
236 1 23 SER HA 1 24 MET H 2.700 . 2.700 2.385 2.138 2.764 0.064 1 0 "[ . 1 .]" 1
237 1 23 SER QB 1 24 MET H 3.500 . 3.800 3.733 3.035 3.955 0.155 8 0 "[ . 1 .]" 1
238 1 24 MET HA 1 25 PRO QD 2.700 . 3.000 1.942 1.767 2.747 0.033 1 0 "[ . 1 .]" 1
239 1 24 MET HA 1 25 PRO QG 5.000 . 5.300 3.877 3.706 4.641 . 0 0 "[ . 1 .]" 1
240 1 24 MET HA 1 28 GLU QG 5.000 . 5.300 5.093 3.471 5.373 0.073 11 0 "[ . 1 .]" 1
241 1 24 MET HA 1 28 GLU QB 5.000 . 5.300 4.927 4.542 5.286 . 0 0 "[ . 1 .]" 1
242 1 25 PRO HA 1 26 SER H 2.700 . 2.700 2.244 2.134 3.273 0.573 10 1 "[ . + .]" 1
243 1 25 PRO QB 1 26 SER H 3.500 . 3.800 3.284 1.666 3.622 0.134 10 0 "[ . 1 .]" 1
244 1 25 PRO QB 1 28 GLU QB 3.500 . 4.100 2.093 1.725 4.188 0.088 10 0 "[ . 1 .]" 1
245 1 25 PRO QD 1 28 GLU QB 5.000 . 5.600 3.308 2.554 4.982 . 0 0 "[ . 1 .]" 1
246 1 25 PRO QB 1 28 GLU QG 3.500 . 4.100 3.470 1.996 4.195 0.095 10 0 "[ . 1 .]" 1
247 1 25 PRO QD 1 28 GLU QG 3.500 . 4.100 3.457 2.747 4.080 . 0 0 "[ . 1 .]" 1
248 1 26 SER HA 1 27 ALA H 3.500 . 3.500 3.534 3.421 3.557 0.057 12 0 "[ . 1 .]" 1
249 1 26 SER H 1 29 GLN H 5.000 . 5.000 4.808 3.368 5.058 0.058 14 0 "[ . 1 .]" 1
250 1 26 SER HA 1 29 GLN QG 5.000 . 5.300 3.898 1.868 5.147 . 0 0 "[ . 1 .]" 1
251 1 26 SER QB 1 28 GLU H 5.000 . 5.300 4.201 3.265 4.575 . 0 0 "[ . 1 .]" 1
252 1 27 ALA HA 1 30 LEU QB 3.500 . 3.800 2.675 2.298 3.239 . 0 0 "[ . 1 .]" 1
253 1 27 ALA HA 1 30 LEU HG 5.000 . 5.000 4.834 4.476 5.049 0.049 7 0 "[ . 1 .]" 1
254 1 27 ALA HA 1 30 LEU MD1 3.500 . 4.000 3.905 3.564 4.076 0.076 5 0 "[ . 1 .]" 1
255 1 27 ALA HA 1 30 LEU MD2 5.000 . 5.500 2.177 1.858 2.759 . 0 0 "[ . 1 .]" 1
256 1 28 GLU H 1 29 GLN H 3.500 . 3.500 2.380 2.230 2.485 . 0 0 "[ . 1 .]" 1
257 1 28 GLU HA 1 31 PRO QD 5.000 . 5.300 2.766 2.590 3.135 . 0 0 "[ . 1 .]" 1
258 1 28 GLU QG 1 32 PHE QD 5.000 . 5.600 3.985 2.173 5.580 . 0 0 "[ . 1 .]" 1
259 1 28 GLU QG 1 32 PHE QE 5.000 . 5.600 3.888 1.809 5.328 . 0 0 "[ . 1 .]" 1
260 1 29 GLN H 1 30 LEU H 2.700 . 2.700 2.691 2.558 2.742 0.042 10 0 "[ . 1 .]" 1
261 1 29 GLN HA 1 32 PHE H 3.500 . 3.500 3.397 3.301 3.481 . 0 0 "[ . 1 .]" 1
262 1 29 GLN HA 1 32 PHE QD 3.500 . 3.800 3.269 2.166 3.847 0.047 14 0 "[ . 1 .]" 1
263 1 29 GLN HA 1 33 LEU MD1 5.000 . 5.500 4.897 3.803 5.232 . 0 0 "[ . 1 .]" 1
264 1 29 GLN QG 1 55 TRP HD1 5.000 . 5.300 3.177 1.857 4.676 . 0 0 "[ . 1 .]" 1
265 1 30 LEU H 1 31 PRO QD 3.500 . 3.800 2.150 1.998 2.284 . 0 0 "[ . 1 .]" 1
266 1 30 LEU HA 1 33 LEU H 3.500 . 3.500 3.199 2.879 3.533 0.033 13 0 "[ . 1 .]" 1
267 1 30 LEU MD2 1 31 PRO QD 3.500 . 4.300 3.165 2.669 3.424 . 0 0 "[ . 1 .]" 1
268 1 30 LEU MD1 1 55 TRP HD1 5.000 . 5.500 5.525 5.302 5.733 0.233 12 0 "[ . 1 .]" 1
269 1 30 LEU MD1 1 55 TRP HZ2 5.000 . 5.500 5.553 5.217 5.676 0.176 12 0 "[ . 1 .]" 1
270 1 31 PRO HA 1 34 THR HB 5.000 . 5.000 2.568 2.029 2.865 . 0 0 "[ . 1 .]" 1
271 1 31 PRO HA 1 34 THR MG 3.500 . 4.000 3.809 3.174 4.061 0.061 5 0 "[ . 1 .]" 1
272 1 31 PRO HA 1 138 ILE MG 5.000 . 5.500 3.281 2.840 3.704 . 0 0 "[ . 1 .]" 1
273 1 31 PRO HA 1 138 ILE MD 5.000 . 5.500 4.424 3.372 5.220 . 0 0 "[ . 1 .]" 1
274 1 31 PRO QB 1 138 ILE MG 3.500 . 4.300 3.366 2.880 3.807 . 0 0 "[ . 1 .]" 1
275 1 31 PRO QB 1 138 ILE MD 3.500 . 4.300 3.049 2.346 3.811 . 0 0 "[ . 1 .]" 1
276 1 32 PHE H 1 33 LEU H 2.700 . 2.700 2.601 2.402 2.719 0.019 13 0 "[ . 1 .]" 1
277 1 32 PHE HA 1 35 LEU H 3.500 . 3.500 3.502 3.352 3.616 0.116 11 0 "[ . 1 .]" 1
278 1 32 PHE HA 1 35 LEU MD1 3.500 . 4.000 3.951 3.643 4.114 0.114 14 0 "[ . 1 .]" 1
279 1 32 PHE HA 1 36 ILE MG 5.000 . 5.500 5.602 5.494 5.678 0.178 12 0 "[ . 1 .]" 1
280 1 32 PHE HA 1 82 ILE MD 5.000 . 5.500 4.909 4.175 5.464 . 0 0 "[ . 1 .]" 1
281 1 32 PHE HA 1 108 LEU MD1 5.000 . 5.500 5.174 4.374 5.568 0.068 4 0 "[ . 1 .]" 1
282 1 32 PHE HA 1 138 ILE MD 5.000 . 5.500 4.572 3.989 5.109 . 0 0 "[ . 1 .]" 1
283 1 32 PHE QD 1 35 LEU H 5.000 . 5.300 4.941 4.389 5.317 0.017 2 0 "[ . 1 .]" 1
284 1 32 PHE QD 1 49 ALA MB 5.000 . 5.800 4.141 3.206 5.302 . 0 0 "[ . 1 .]" 1
285 1 32 PHE QE 1 49 ALA MB 5.000 . 5.800 5.197 3.523 5.801 0.001 6 0 "[ . 1 .]" 1
286 1 32 PHE QD 1 82 ILE MD 3.500 . 4.300 3.785 2.884 4.090 . 0 0 "[ . 1 .]" 1
287 1 32 PHE QD 1 82 ILE MG 5.000 . 5.800 5.042 4.218 5.809 0.009 4 0 "[ . 1 .]" 1
288 1 32 PHE QE 1 82 ILE MD 3.500 . 4.300 2.279 1.812 2.823 . 0 0 "[ . 1 .]" 1
289 1 32 PHE HZ 1 82 ILE MD 3.500 . 4.000 2.591 1.987 3.988 . 0 0 "[ . 1 .]" 1
290 1 32 PHE QD 1 138 ILE MD 5.000 . 5.800 4.363 3.496 5.427 . 0 0 "[ . 1 .]" 1
291 1 32 PHE QE 1 138 ILE MD 5.000 . 5.800 4.534 3.765 5.651 . 0 0 "[ . 1 .]" 1
292 1 33 LEU H 1 34 THR H 2.700 . 2.700 2.557 2.450 2.692 . 0 0 "[ . 1 .]" 1
293 1 33 LEU HA 1 36 ILE MD 3.500 . 4.000 3.804 2.817 4.055 0.055 9 0 "[ . 1 .]" 1
294 1 33 LEU HA 1 36 ILE MG 5.000 . 5.500 3.001 1.854 3.571 . 0 0 "[ . 1 .]" 1
295 1 33 LEU MD2 1 36 ILE MD 3.500 . 4.500 3.939 3.335 4.526 0.026 13 0 "[ . 1 .]" 1
296 1 33 LEU MD1 1 55 TRP HD1 5.000 . 5.500 5.196 4.199 5.547 0.047 2 0 "[ . 1 .]" 1
297 1 33 LEU MD1 1 55 TRP HZ2 3.500 . 4.000 3.453 2.737 4.124 0.124 12 0 "[ . 1 .]" 1
298 1 33 LEU MD2 1 55 TRP HZ2 3.500 . 4.000 2.004 1.706 4.020 0.094 3 0 "[ . 1 .]" 1
299 1 33 LEU MD2 1 55 TRP HD1 5.000 . 5.500 4.567 4.189 4.906 . 0 0 "[ . 1 .]" 1
300 1 33 LEU MD2 1 55 TRP HE1 2.700 . 3.200 2.887 2.357 3.257 0.057 13 0 "[ . 1 .]" 1
301 1 34 THR H 1 35 LEU H 3.500 . 3.500 2.777 2.478 2.974 . 0 0 "[ . 1 .]" 1
302 1 34 THR HA 1 37 GLU QB 3.500 . 3.800 2.445 1.861 2.856 . 0 0 "[ . 1 .]" 1
303 1 34 THR HA 1 37 GLU QG 5.000 . 5.300 4.062 3.466 4.801 . 0 0 "[ . 1 .]" 1
304 1 34 THR HB 1 138 ILE MG 5.000 . 5.500 2.839 2.462 3.199 . 0 0 "[ . 1 .]" 1
305 1 34 THR MG 1 35 LEU H 2.700 . 3.200 2.441 2.050 2.904 . 0 0 "[ . 1 .]" 1
306 1 34 THR MG 1 37 GLU QB 5.000 . 5.800 3.717 3.296 4.029 . 0 0 "[ . 1 .]" 1
307 1 34 THR MG 1 37 GLU QG 5.000 . 5.800 5.217 4.113 5.727 . 0 0 "[ . 1 .]" 1
308 1 34 THR MG 1 38 HIS QB 3.500 . 4.300 3.876 3.634 4.573 0.273 5 0 "[ . 1 .]" 1
309 1 34 THR MG 1 138 ILE MG 3.500 . 4.500 1.880 1.747 2.091 0.053 3 0 "[ . 1 .]" 1
310 1 34 THR MG 1 138 ILE MD 5.000 . 6.000 3.912 3.236 4.835 . 0 0 "[ . 1 .]" 1
311 1 34 THR MG 1 139 ALA HA 5.000 . 5.500 3.928 3.454 4.301 . 0 0 "[ . 1 .]" 1
312 1 34 THR MG 1 139 ALA MB 3.500 . 4.500 4.463 4.121 4.622 0.122 4 0 "[ . 1 .]" 1
313 1 34 THR MG 1 142 LYS HA 5.000 . 5.500 5.294 5.139 5.539 0.039 2 0 "[ . 1 .]" 1
314 1 34 THR MG 1 142 LYS QE 3.500 . 4.300 2.359 1.701 2.994 0.099 10 0 "[ . 1 .]" 1
315 1 35 LEU H 1 36 ILE H 3.500 . 3.500 2.743 2.387 3.012 . 0 0 "[ . 1 .]" 1
316 1 35 LEU HA 1 38 HIS H 3.500 . 3.500 3.136 2.940 3.571 0.071 5 0 "[ . 1 .]" 1
317 1 35 LEU HA 1 38 HIS QB 5.000 . 5.300 2.875 2.403 4.183 . 0 0 "[ . 1 .]" 1
318 1 35 LEU HA 1 138 ILE MD 5.000 . 5.500 5.139 4.181 5.534 0.034 4 0 "[ . 1 .]" 1
319 1 35 LEU MD1 1 38 HIS H 5.000 . 5.500 5.383 4.455 5.599 0.099 11 0 "[ . 1 .]" 1
320 1 35 LEU MD2 1 38 HIS H 5.000 . 5.500 5.303 4.241 5.620 0.120 4 0 "[ . 1 .]" 1
321 1 35 LEU MD1 1 38 HIS HD2 5.000 . 5.500 4.488 2.994 5.540 0.040 6 0 "[ . 1 .]" 1
322 1 35 LEU MD2 1 38 HIS HD2 5.000 . 5.500 3.352 2.112 5.289 . 0 0 "[ . 1 .]" 1
323 1 35 LEU MD2 1 39 PHE QE 3.500 . 4.300 2.683 1.865 3.560 . 0 0 "[ . 1 .]" 1
324 1 35 LEU MD2 1 39 PHE HZ 3.500 . 4.000 3.226 2.299 3.900 . 0 0 "[ . 1 .]" 1
325 1 35 LEU MD2 1 39 PHE QD 5.000 . 5.800 3.799 3.319 4.626 . 0 0 "[ . 1 .]" 1
326 1 35 LEU MD2 1 80 VAL QG 5.000 . 6.000 3.518 3.158 4.046 . 0 0 "[ . 1 .]" 1
327 1 35 LEU MD2 1 82 ILE MD 5.000 . 6.000 4.607 3.924 5.553 . 0 0 "[ . 1 .]" 1
328 1 35 LEU MD2 1 108 LEU MD1 3.500 . 4.500 2.422 1.790 3.389 0.010 11 0 "[ . 1 .]" 1
329 1 35 LEU MD2 1 108 LEU MD2 5.000 . 6.000 3.659 3.125 4.274 . 0 0 "[ . 1 .]" 1
330 1 35 LEU MD2 1 135 TYR QD 6.000 . 6.800 6.290 5.097 6.807 0.007 1 0 "[ . 1 .]" 1
331 1 35 LEU MD1 1 138 ILE MD 3.500 . 4.500 2.357 1.874 4.466 . 0 0 "[ . 1 .]" 1
332 1 35 LEU MD1 1 138 ILE MG 5.000 . 6.000 2.334 1.753 4.922 0.047 10 0 "[ . 1 .]" 1
333 1 35 LEU MD2 1 138 ILE MD 3.500 . 4.500 3.624 2.991 4.300 . 0 0 "[ . 1 .]" 1
334 1 35 LEU MD2 1 138 ILE MG 3.500 . 4.500 4.092 3.227 4.508 0.008 2 0 "[ . 1 .]" 1
335 1 35 LEU MD2 1 141 ALA MB 5.000 . 6.000 3.502 2.720 4.130 . 0 0 "[ . 1 .]" 1
336 1 35 LEU MD2 1 142 LYS HA 5.000 . 5.500 2.522 1.821 3.408 . 0 0 "[ . 1 .]" 1
337 1 35 LEU MD2 1 142 LYS QE 5.000 . 5.800 4.862 4.003 5.614 . 0 0 "[ . 1 .]" 1
338 1 35 LEU QB 1 145 ILE MD 5.000 . 5.800 4.248 3.601 4.802 . 0 0 "[ . 1 .]" 1
339 1 35 LEU MD2 1 145 ILE MD 3.500 . 4.500 2.173 1.814 2.819 . 0 0 "[ . 1 .]" 1
340 1 35 LEU MD2 1 145 ILE MG 3.500 . 4.500 2.147 1.717 2.721 0.083 12 0 "[ . 1 .]" 1
341 1 35 LEU MD1 1 145 ILE MD 3.500 . 4.500 3.534 3.133 4.286 . 0 0 "[ . 1 .]" 1
342 1 36 ILE H 1 37 GLU H 2.700 . 2.700 2.681 2.495 2.761 0.061 6 0 "[ . 1 .]" 1
343 1 36 ILE HA 1 39 PHE H 5.000 . 5.000 3.361 3.065 3.594 . 0 0 "[ . 1 .]" 1
344 1 36 ILE HA 1 39 PHE QB 5.000 . 5.300 2.128 1.868 2.396 . 0 0 "[ . 1 .]" 1
345 1 36 ILE HA 1 39 PHE QD 3.500 . 3.800 2.106 1.710 2.842 0.090 7 0 "[ . 1 .]" 1
346 1 36 ILE MG 1 37 GLU HA 3.500 . 4.000 3.217 2.915 3.736 . 0 0 "[ . 1 .]" 1
347 1 36 ILE MG 1 39 PHE QD 5.000 . 5.800 4.066 3.682 4.350 . 0 0 "[ . 1 .]" 1
348 1 36 ILE MG 1 39 PHE QE 5.000 . 5.800 5.790 5.490 5.934 0.134 7 0 "[ . 1 .]" 1
349 1 36 ILE MD 1 39 PHE QD 5.000 . 5.800 2.864 1.755 3.545 0.045 14 0 "[ . 1 .]" 1
350 1 36 ILE MD 1 39 PHE QE 5.000 . 5.800 3.493 2.963 4.001 . 0 0 "[ . 1 .]" 1
351 1 36 ILE MD 1 39 PHE HZ 5.000 . 5.500 5.451 4.952 5.594 0.094 8 0 "[ . 1 .]" 1
352 1 36 ILE MG 1 40 GLU QB 5.000 . 5.800 3.623 3.021 4.134 . 0 0 "[ . 1 .]" 1
353 1 36 ILE MD 1 46 VAL MG1 5.000 . 6.000 2.712 1.870 3.623 . 0 0 "[ . 1 .]" 1
354 1 36 ILE MG 1 46 VAL MG1 3.500 . 4.500 2.879 1.945 3.578 . 0 0 "[ . 1 .]" 1
355 1 36 ILE MG 1 46 VAL MG2 5.000 . 6.000 2.225 1.809 3.470 . 0 0 "[ . 1 .]" 1
356 1 36 ILE MG 1 49 ALA MB 3.500 . 4.500 4.007 3.122 4.518 0.018 3 0 "[ . 1 .]" 1
357 1 36 ILE MD 1 49 ALA MB 5.000 . 6.000 3.420 2.255 4.214 . 0 0 "[ . 1 .]" 1
358 1 36 ILE MG 1 51 ARG QD 3.500 . 4.300 3.120 2.190 4.161 . 0 0 "[ . 1 .]" 1
359 1 36 ILE MD 1 51 ARG QD 5.000 . 5.800 5.120 3.936 5.886 0.086 11 0 "[ . 1 .]" 1
360 1 36 ILE MD 1 55 TRP HZ2 5.000 . 5.500 5.401 4.688 5.575 0.075 8 0 "[ . 1 .]" 1
361 1 37 GLU H 1 38 HIS H 2.700 . 2.700 2.598 2.488 2.748 0.048 5 0 "[ . 1 .]" 1
362 1 37 GLU HA 1 40 GLU H 3.500 . 3.500 3.368 3.161 3.525 0.025 5 0 "[ . 1 .]" 1
363 1 37 GLU HA 1 40 GLU QB 3.500 . 3.800 3.070 2.781 3.372 . 0 0 "[ . 1 .]" 1
364 1 37 GLU HA 1 40 GLU QG 5.000 . 5.300 4.402 3.362 5.279 . 0 0 "[ . 1 .]" 1
365 1 37 GLU HA 1 41 LYS QG 5.000 . 5.300 4.353 3.184 5.364 0.064 8 0 "[ . 1 .]" 1
366 1 37 GLU HA 1 41 LYS QE 5.000 . 5.300 4.451 3.064 5.207 . 0 0 "[ . 1 .]" 1
367 1 37 GLU QG 1 41 LYS QG 5.000 . 5.600 3.348 2.236 4.357 . 0 0 "[ . 1 .]" 1
368 1 37 GLU QG 1 41 LYS QE 3.500 . 4.100 2.883 1.918 4.036 . 0 0 "[ . 1 .]" 1
369 1 38 HIS H 1 39 PHE H 2.700 . 2.700 2.509 2.407 2.648 . 0 0 "[ . 1 .]" 1
370 1 38 HIS HA 1 41 LYS H 3.500 . 3.500 3.325 3.040 3.589 0.089 11 0 "[ . 1 .]" 1
371 1 38 HIS HA 1 42 GLN H 3.500 . 3.500 3.586 3.489 3.646 0.146 3 0 "[ . 1 .]" 1
372 1 38 HIS HA 1 41 LYS QG 5.000 . 5.300 3.766 2.853 4.635 . 0 0 "[ . 1 .]" 1
373 1 38 HIS HA 1 41 LYS QE 3.500 . 3.800 2.847 1.965 3.790 . 0 0 "[ . 1 .]" 1
374 1 38 HIS HA 1 142 LYS QE 5.000 . 5.300 5.076 4.768 5.381 0.081 4 0 "[ . 1 .]" 1
375 1 38 HIS HD2 1 39 PHE HA 5.000 . 5.000 4.398 3.211 5.059 0.059 8 0 "[ . 1 .]" 1
376 1 38 HIS HD2 1 142 LYS HA 5.000 . 5.000 4.359 3.854 4.952 . 0 0 "[ . 1 .]" 1
377 1 38 HIS HD2 1 145 ILE MG 5.000 . 5.500 4.220 3.659 5.102 . 0 0 "[ . 1 .]" 1
378 1 39 PHE H 1 40 GLU H 2.700 . 2.700 2.561 2.375 2.743 0.043 5 0 "[ . 1 .]" 1
379 1 39 PHE HA 1 44 LEU MD1 2.700 . 3.200 2.170 1.898 2.434 . 0 0 "[ . 1 .]" 1
380 1 39 PHE HA 1 42 GLN QB 5.000 . 5.300 3.169 2.594 3.575 . 0 0 "[ . 1 .]" 1
381 1 39 PHE HA 1 42 GLN QG 3.500 . 3.800 3.759 3.589 3.844 0.044 12 0 "[ . 1 .]" 1
382 1 39 PHE HA 1 46 VAL MG2 5.000 . 5.500 4.128 3.862 4.555 . 0 0 "[ . 1 .]" 1
383 1 39 PHE QB 1 44 LEU MD2 5.000 . 5.800 4.836 4.662 5.041 . 0 0 "[ . 1 .]" 1
384 1 39 PHE QB 1 44 LEU MD1 3.500 . 4.300 3.657 3.350 3.881 . 0 0 "[ . 1 .]" 1
385 1 39 PHE QB 1 46 VAL MG2 3.500 . 4.300 1.849 1.661 2.216 0.139 11 0 "[ . 1 .]" 1
386 1 39 PHE QD 1 42 GLN H 5.000 . 5.300 4.947 4.567 5.378 0.078 8 0 "[ . 1 .]" 1
387 1 39 PHE QD 1 44 LEU MD1 3.500 . 4.300 1.730 1.656 1.836 0.144 7 0 "[ . 1 .]" 1
388 1 39 PHE QE 1 44 LEU MD1 3.500 . 4.300 2.143 1.783 2.553 0.017 2 0 "[ . 1 .]" 1
389 1 39 PHE HZ 1 44 LEU MD1 3.500 . 4.000 4.045 3.981 4.127 0.127 8 0 "[ . 1 .]" 1
390 1 39 PHE QD 1 44 LEU MD2 5.000 . 5.800 3.799 3.488 4.262 . 0 0 "[ . 1 .]" 1
391 1 39 PHE QD 1 46 VAL MG1 3.500 . 4.300 3.391 2.195 4.365 0.065 12 0 "[ . 1 .]" 1
392 1 39 PHE QE 1 46 VAL MG1 5.000 . 5.800 4.445 3.330 5.460 . 0 0 "[ . 1 .]" 1
393 1 39 PHE QD 1 46 VAL MG2 3.500 . 4.300 2.205 1.805 2.921 . 0 0 "[ . 1 .]" 1
394 1 39 PHE QE 1 46 VAL MG2 5.000 . 5.800 3.880 3.343 4.348 . 0 0 "[ . 1 .]" 1
395 1 39 PHE QD 1 80 VAL QG 5.000 . 5.800 4.427 3.805 4.872 . 0 0 "[ . 1 .]" 1
396 1 39 PHE QE 1 80 VAL QG 3.500 . 4.300 2.849 1.868 3.412 . 0 0 "[ . 1 .]" 1
397 1 39 PHE HZ 1 80 VAL QG 3.500 . 4.000 2.597 2.027 3.212 . 0 0 "[ . 1 .]" 1
398 1 39 PHE QE 1 145 ILE MG 3.500 . 4.300 3.515 2.634 4.227 . 0 0 "[ . 1 .]" 1
399 1 39 PHE HZ 1 145 ILE MG 3.500 . 4.000 3.133 2.117 3.894 . 0 0 "[ . 1 .]" 1
400 1 39 PHE HZ 1 145 ILE MD 5.000 . 5.500 2.648 2.031 3.342 . 0 0 "[ . 1 .]" 1
401 1 39 PHE QD 1 149 ILE MD 5.000 . 5.800 4.522 4.023 4.999 . 0 0 "[ . 1 .]" 1
402 1 39 PHE QE 1 149 ILE MD 2.700 . 3.500 2.711 2.156 3.139 . 0 0 "[ . 1 .]" 1
403 1 39 PHE HZ 1 149 ILE MD 2.700 . 3.200 2.470 2.037 3.156 . 0 0 "[ . 1 .]" 1
404 1 39 PHE QD 1 149 ILE MG 5.000 . 5.800 5.591 5.133 5.825 0.025 5 0 "[ . 1 .]" 1
405 1 39 PHE QE 1 149 ILE MG 5.000 . 5.800 4.023 3.337 4.480 . 0 0 "[ . 1 .]" 1
406 1 39 PHE HZ 1 149 ILE MG 5.000 . 5.500 4.801 4.182 5.301 . 0 0 "[ . 1 .]" 1
407 1 40 GLU H 1 41 LYS H 2.700 . 2.700 2.455 2.299 2.625 . 0 0 "[ . 1 .]" 1
408 1 40 GLU H 1 46 VAL MG2 3.500 . 4.000 3.328 2.551 3.840 . 0 0 "[ . 1 .]" 1
409 1 40 GLU HA 1 46 VAL MG2 5.000 . 5.500 4.270 3.755 4.909 . 0 0 "[ . 1 .]" 1
410 1 40 GLU HA 1 45 GLU HA 5.000 . 5.000 3.812 3.113 4.601 . 0 0 "[ . 1 .]" 1
411 1 40 GLU QG 1 46 VAL MG2 3.500 . 4.300 2.882 2.163 4.003 . 0 0 "[ . 1 .]" 1
412 1 40 GLU QG 1 46 VAL MG1 5.000 . 5.800 4.727 3.976 5.503 . 0 0 "[ . 1 .]" 1
413 1 41 LYS H 1 42 GLN H 2.700 . 2.700 2.357 2.090 2.531 . 0 0 "[ . 1 .]" 1
414 1 41 LYS H 1 43 GLY H 5.000 . 5.000 3.610 3.388 3.797 . 0 0 "[ . 1 .]" 1
415 1 42 GLN H 1 43 GLY H 2.700 . 2.700 2.421 2.316 2.492 . 0 0 "[ . 1 .]" 1
416 1 42 GLN H 1 44 LEU H 3.500 . 3.500 3.569 3.428 3.641 0.141 9 0 "[ . 1 .]" 1
417 1 42 GLN H 1 44 LEU MD1 3.500 . 4.000 4.034 3.967 4.120 0.120 15 0 "[ . 1 .]" 1
418 1 42 GLN H 1 44 LEU QB 5.000 . 5.300 4.996 4.858 5.145 . 0 0 "[ . 1 .]" 1
419 1 42 GLN HA 1 44 LEU H 5.000 . 5.000 4.938 4.703 5.043 0.043 7 0 "[ . 1 .]" 1
420 1 42 GLN QB 1 44 LEU MD1 3.500 . 4.300 2.396 2.125 2.751 . 0 0 "[ . 1 .]" 1
421 1 42 GLN QG 1 44 LEU MD1 3.500 . 4.300 2.832 1.901 3.132 . 0 0 "[ . 1 .]" 1
422 1 42 GLN QB 1 44 LEU MD2 5.000 . 5.800 2.636 1.977 3.536 . 0 0 "[ . 1 .]" 1
423 1 42 GLN QG 1 44 LEU MD2 5.000 . 5.800 3.780 1.793 4.752 0.007 10 0 "[ . 1 .]" 1
424 1 43 GLY H 1 44 LEU H 2.700 . 2.700 1.732 1.685 1.788 0.115 5 0 "[ . 1 .]" 1
425 1 43 GLY H 1 44 LEU QB 5.000 . 5.300 4.175 4.036 4.272 . 0 0 "[ . 1 .]" 1
426 1 43 GLY H 1 44 LEU MD1 3.500 . 4.000 4.105 4.072 4.175 0.175 12 0 "[ . 1 .]" 1
427 1 44 LEU HA 1 45 GLU H 2.700 . 2.700 2.198 2.160 2.245 . 0 0 "[ . 1 .]" 1
428 1 44 LEU MD2 1 45 GLU H 3.500 . 4.000 4.035 3.967 4.132 0.132 10 0 "[ . 1 .]" 1
429 1 44 LEU MD2 1 149 ILE MG 5.000 . 6.000 4.473 3.927 5.057 . 0 0 "[ . 1 .]" 1
430 1 45 GLU HA 1 46 VAL H 2.700 . 2.700 2.155 2.138 2.177 . 0 0 "[ . 1 .]" 1
431 1 45 GLU H 1 47 PHE QD 5.000 . 5.300 5.140 4.739 5.458 0.158 15 0 "[ . 1 .]" 1
432 1 45 GLU QB 1 47 PHE QD 3.500 . 4.100 2.770 2.234 3.333 . 0 0 "[ . 1 .]" 1
433 1 46 VAL MG1 1 49 ALA MB 3.500 . 4.500 2.486 1.821 3.200 . 0 0 "[ . 1 .]" 1
434 1 47 PHE QR 1 72 GLU HA 5.000 . 6.500 2.843 2.079 3.408 . 0 0 "[ . 1 .]" 1
435 1 47 PHE QR 1 76 ALA H 3.500 . 5.000 3.763 2.437 4.790 . 0 0 "[ . 1 .]" 1
436 1 47 PHE QR 1 76 ALA MB 2.700 . 4.700 3.408 2.545 3.890 . 0 0 "[ . 1 .]" 1
437 1 47 PHE QR 1 76 ALA HA 3.500 . 5.000 3.236 1.842 3.638 . 0 0 "[ . 1 .]" 1
438 1 47 PHE QR 1 75 LYS QB 3.500 . 5.300 2.685 1.824 3.959 . 0 0 "[ . 1 .]" 1
439 1 47 PHE QD 1 75 LYS QD 3.500 . 4.100 3.721 2.264 4.113 0.013 5 0 "[ . 1 .]" 1
440 1 47 PHE QE 1 75 LYS QD 3.500 . 4.100 2.547 1.839 3.811 . 0 0 "[ . 1 .]" 1
441 1 47 PHE QD 1 75 LYS QE 2.700 . 3.300 2.708 2.013 3.291 . 0 0 "[ . 1 .]" 1
442 1 47 PHE QE 1 75 LYS QE 2.700 . 3.300 2.619 1.818 3.234 . 0 0 "[ . 1 .]" 1
443 1 49 ALA MB 1 55 TRP HZ2 5.000 . 5.500 4.633 3.364 5.335 . 0 0 "[ . 1 .]" 1
444 1 49 ALA MB 1 51 ARG HA 3.500 . 4.000 4.058 3.736 4.218 0.218 14 0 "[ . 1 .]" 1
445 1 49 ALA MB 1 51 ARG QD 5.000 . 5.800 3.382 2.240 4.380 . 0 0 "[ . 1 .]" 1
446 1 50 HIS H 1 55 TRP HE1 5.000 . 5.000 4.771 4.368 5.054 0.054 13 0 "[ . 1 .]" 1
447 1 51 ARG HA 1 55 TRP HD1 3.500 . 3.500 3.449 2.706 3.620 0.120 14 0 "[ . 1 .]" 1
448 1 51 ARG HA 1 55 TRP HE1 3.500 . 3.500 2.112 1.756 2.473 0.044 2 0 "[ . 1 .]" 1
449 1 51 ARG HA 1 55 TRP HZ2 5.000 . 5.000 3.086 2.602 4.872 . 0 0 "[ . 1 .]" 1
450 1 53 GLU HA 1 58 GLN H 5.000 . 5.000 4.010 3.111 5.068 0.068 11 0 "[ . 1 .]" 1
451 1 53 GLU HA 1 60 LEU MD2 3.500 . 4.000 3.700 2.483 4.037 0.037 13 0 "[ . 1 .]" 1
452 1 53 GLU HA 1 60 LEU MD1 5.000 . 5.500 4.920 3.438 5.497 . 0 0 "[ . 1 .]" 1
453 1 53 GLU QG 1 60 LEU MD2 3.500 . 4.300 2.780 1.869 3.958 . 0 0 "[ . 1 .]" 1
454 1 53 GLU QG 1 60 LEU MD1 5.000 . 5.800 3.218 1.959 4.763 . 0 0 "[ . 1 .]" 1
455 1 54 ALA H 1 55 TRP H 2.700 . 2.700 2.651 2.403 2.787 0.087 12 0 "[ . 1 .]" 1
456 1 54 ALA H 1 55 TRP HE1 5.000 . 5.000 4.402 3.904 4.988 . 0 0 "[ . 1 .]" 1
457 1 54 ALA HA 1 55 TRP HE1 5.000 . 5.000 5.033 4.449 5.247 0.247 11 0 "[ . 1 .]" 1
458 1 54 ALA HA 1 55 TRP HD1 3.500 . 3.500 3.546 3.405 3.827 0.327 12 0 "[ . 1 .]" 1
459 1 54 ALA MB 1 55 TRP HD1 3.500 . 4.000 2.075 1.722 2.266 0.078 13 0 "[ . 1 .]" 1
460 1 54 ALA MB 1 55 TRP HE1 3.500 . 4.000 2.242 1.764 2.505 0.036 12 0 "[ . 1 .]" 1
461 1 54 ALA HA 1 56 GLY H 5.000 . 5.000 4.423 3.726 5.000 . 0 0 "[ . 1 .]" 1
462 1 54 ALA HA 1 57 ALA H 5.000 . 5.000 4.249 3.701 4.917 . 0 0 "[ . 1 .]" 1
463 1 54 ALA HA 1 58 GLN QB 5.000 . 5.300 2.823 1.748 5.225 0.052 10 0 "[ . 1 .]" 1
464 1 54 ALA HA 1 60 LEU MD2 5.000 . 5.500 4.087 2.858 5.390 . 0 0 "[ . 1 .]" 1
465 1 54 ALA MB 1 58 GLN QB 5.000 . 5.800 3.861 2.894 5.886 0.086 11 0 "[ . 1 .]" 1
466 1 54 ALA MB 1 58 GLN QG 5.000 . 5.800 3.425 1.776 4.779 0.024 10 0 "[ . 1 .]" 1
467 1 54 ALA MB 1 59 VAL QG 5.000 . 6.000 5.622 4.867 6.134 0.134 12 0 "[ . 1 .]" 1
468 1 54 ALA MB 1 60 LEU MD1 5.000 . 6.000 4.794 3.690 5.835 . 0 0 "[ . 1 .]" 1
469 1 54 ALA MB 1 60 LEU MD2 5.000 . 6.000 4.437 3.628 5.287 . 0 0 "[ . 1 .]" 1
470 1 55 TRP H 1 56 GLY H 2.700 . 2.700 1.946 1.741 2.263 0.059 12 0 "[ . 1 .]" 1
471 1 56 GLY H 1 57 ALA H 2.700 . 2.700 2.243 1.768 2.696 0.032 14 0 "[ . 1 .]" 1
472 1 56 GLY QA 1 57 ALA H 3.500 . 3.800 2.795 2.581 2.916 . 0 0 "[ . 1 .]" 1
473 1 57 ALA MB 1 58 GLN H 3.500 . 4.000 2.942 1.923 3.729 . 0 0 "[ . 1 .]" 1
474 1 58 GLN HA 1 59 VAL H 2.700 . 2.700 2.635 2.306 2.785 0.085 15 0 "[ . 1 .]" 1
475 1 58 GLN QB 1 60 LEU MD1 5.000 . 5.800 5.693 4.832 5.926 0.126 14 0 "[ . 1 .]" 1
476 1 58 GLN QG 1 60 LEU MD2 3.500 . 4.300 3.920 2.629 4.347 0.047 1 0 "[ . 1 .]" 1
477 1 59 VAL HA 1 60 LEU H 2.700 . 2.700 2.652 2.317 2.799 0.099 6 0 "[ . 1 .]" 1
478 1 59 VAL HB 1 60 LEU H 5.000 . 5.000 4.333 4.177 4.577 . 0 0 "[ . 1 .]" 1
479 1 59 VAL MG2 1 61 THR MG 5.000 . 6.000 6.141 6.049 6.204 0.204 15 0 "[ . 1 .]" 1
480 1 59 VAL MG1 1 61 THR MG 5.000 . 6.000 4.442 4.072 6.007 0.007 13 0 "[ . 1 .]" 1
481 1 59 VAL HA 2 119 PHE QD 5.000 . 5.300 5.179 4.771 5.486 0.186 11 0 "[ . 1 .]" 1
482 1 59 VAL MG1 2 119 PHE QD 3.500 . 4.300 3.959 3.445 4.342 0.042 1 0 "[ . 1 .]" 1
483 1 59 VAL MG1 2 119 PHE QE 3.500 . 4.300 2.609 1.992 2.997 . 0 0 "[ . 1 .]" 1
484 1 59 VAL MG2 2 119 PHE QE 5.000 . 5.800 3.536 1.872 4.294 . 0 0 "[ . 1 .]" 1
485 1 60 LEU HA 1 61 THR H 2.700 . 2.700 2.673 2.168 2.918 0.218 7 0 "[ . 1 .]" 1
486 1 60 LEU HA 1 61 THR MG 5.000 . 5.500 3.189 2.807 3.477 . 0 0 "[ . 1 .]" 1
487 1 60 LEU QB 1 61 THR MG 5.000 . 5.800 3.832 3.403 4.359 . 0 0 "[ . 1 .]" 1
488 1 60 LEU MD2 1 61 THR MG 3.500 . 4.500 4.502 4.075 4.623 0.123 14 0 "[ . 1 .]" 1
489 1 60 LEU MD2 1 61 THR H 3.500 . 4.000 3.917 3.758 4.141 0.141 14 0 "[ . 1 .]" 1
490 1 60 LEU MD2 1 64 GLU QB 3.500 . 4.300 4.207 3.793 4.345 0.045 14 0 "[ . 1 .]" 1
491 1 60 LEU MD2 1 64 GLU QG 5.000 . 5.800 4.954 3.225 5.781 . 0 0 "[ . 1 .]" 1
492 1 60 LEU QD 1 65 CYS H 3.500 . 4.000 3.754 3.225 4.047 0.047 5 0 "[ . 1 .]" 1
493 1 60 LEU MD1 1 65 CYS HA 5.000 . 5.500 3.378 2.565 5.446 . 0 0 "[ . 1 .]" 1
494 1 60 LEU MD1 1 65 CYS QB 3.500 . 4.300 3.380 2.326 4.321 0.021 15 0 "[ . 1 .]" 1
495 1 60 LEU MD2 1 65 CYS QB 5.000 . 5.800 4.579 3.520 5.262 . 0 0 "[ . 1 .]" 1
496 1 60 LEU MD1 2 119 PHE HZ 5.000 . 5.500 5.437 5.188 5.591 0.091 2 0 "[ . 1 .]" 1
497 1 60 LEU MD1 2 119 PHE QE 5.000 . 5.800 5.242 4.540 5.578 . 0 0 "[ . 1 .]" 1
498 1 60 LEU MD2 2 119 PHE HZ 5.000 . 5.500 4.988 3.902 5.519 0.019 7 0 "[ . 1 .]" 1
499 1 60 LEU MD2 2 119 PHE QE 5.000 . 5.800 5.084 4.092 5.465 . 0 0 "[ . 1 .]" 1
500 1 61 THR H 1 63 GLU H 5.000 . 5.000 5.081 5.026 5.185 0.185 12 0 "[ . 1 .]" 1
501 1 61 THR H 1 64 GLU H 6.000 . 6.000 4.032 3.694 5.143 . 0 0 "[ . 1 .]" 1
502 1 61 THR H 1 65 CYS H 6.000 . 6.000 3.433 2.670 4.685 . 0 0 "[ . 1 .]" 1
503 1 61 THR HA 1 62 PRO QD 2.700 . 3.000 1.984 1.839 2.241 . 0 0 "[ . 1 .]" 1
504 1 61 THR MG 1 62 PRO QD 3.500 . 4.300 3.222 2.957 3.569 . 0 0 "[ . 1 .]" 1
505 1 61 THR MG 1 64 GLU H 5.000 . 5.500 5.011 4.631 5.421 . 0 0 "[ . 1 .]" 1
506 1 61 THR MG 1 63 GLU QB 5.000 . 5.800 4.713 4.231 5.046 . 0 0 "[ . 1 .]" 1
507 1 61 THR MG 1 64 GLU QB 3.500 . 4.300 4.058 3.383 4.339 0.039 7 0 "[ . 1 .]" 1
508 1 61 THR MG 1 63 GLU QG 5.000 . 5.800 5.362 4.211 5.832 0.032 15 0 "[ . 1 .]" 1
509 1 61 THR MG 1 64 GLU QG 5.000 . 5.800 4.975 2.741 5.820 0.020 4 0 "[ . 1 .]" 1
510 1 61 THR MG 2 119 PHE QD 5.000 . 5.800 5.022 4.547 5.438 . 0 0 "[ . 1 .]" 1
511 1 61 THR MG 2 119 PHE QE 3.500 . 4.300 4.068 3.809 4.375 0.075 13 0 "[ . 1 .]" 1
512 1 62 PRO HA 2 119 PHE QD 3.500 . 3.800 3.503 2.689 3.865 0.065 3 0 "[ . 1 .]" 1
513 1 63 GLU H 1 64 GLU H 2.700 . 2.700 2.736 2.655 2.823 0.123 8 0 "[ . 1 .]" 1
514 1 63 GLU HA 1 66 THR H 5.000 . 5.000 4.824 4.658 4.998 . 0 0 "[ . 1 .]" 1
515 1 63 GLU HA 1 67 PRO QD 5.000 . 5.300 3.081 2.817 3.396 . 0 0 "[ . 1 .]" 1
516 1 63 GLU HA 2 123 GLY QA 5.000 . 5.300 3.440 3.098 3.791 . 0 0 "[ . 1 .]" 1
517 1 63 GLU HA 2 126 THR MG 2.700 . 3.200 2.539 1.889 2.991 . 0 0 "[ . 1 .]" 1
518 1 63 GLU QG 2 123 GLY QA 5.000 . 5.600 3.995 3.438 5.126 . 0 0 "[ . 1 .]" 1
519 1 63 GLU QG 2 126 THR MG 2.700 . 3.500 3.043 2.038 3.497 . 0 0 "[ . 1 .]" 1
520 1 63 GLU QB 2 127 VAL MG1 5.000 . 5.800 5.567 5.184 5.841 0.041 12 0 "[ . 1 .]" 1
521 1 64 GLU H 1 65 CYS H 2.700 . 2.700 2.292 2.057 2.482 . 0 0 "[ . 1 .]" 1
522 1 64 GLU HA 1 67 PRO QD 5.000 . 5.300 3.338 2.915 3.992 . 0 0 "[ . 1 .]" 1
523 1 65 CYS H 1 66 THR H 3.500 . 3.500 2.788 2.644 2.931 . 0 0 "[ . 1 .]" 1
524 1 65 CYS HA 1 68 LEU H 6.000 . 6.000 4.155 3.767 4.478 . 0 0 "[ . 1 .]" 1
525 1 65 CYS HA 1 68 LEU QB 5.000 . 5.300 3.301 2.856 4.415 . 0 0 "[ . 1 .]" 1
526 1 65 CYS HA 1 68 LEU MD1 3.500 . 4.000 3.521 2.945 3.982 . 0 0 "[ . 1 .]" 1
527 1 65 CYS HA 1 68 LEU MD2 5.000 . 5.500 4.760 1.777 5.581 0.081 6 0 "[ . 1 .]" 1
528 1 66 THR HA 1 69 ASP H 5.000 . 5.000 3.706 3.528 4.007 . 0 0 "[ . 1 .]" 1
529 1 66 THR MG 1 67 PRO QD 2.700 . 3.500 2.404 1.776 3.164 0.024 14 0 "[ . 1 .]" 1
530 1 66 THR MG 1 70 GLN QG 5.000 . 5.800 4.557 2.808 5.693 . 0 0 "[ . 1 .]" 1
531 1 66 THR MG 1 93 VAL MG1 5.000 . 6.000 4.732 4.320 5.142 . 0 0 "[ . 1 .]" 1
532 1 66 THR MG 1 97 TRP HZ2 3.500 . 4.000 3.308 2.702 3.802 . 0 0 "[ . 1 .]" 1
533 1 66 THR MG 1 97 TRP HH2 5.000 . 5.500 2.085 1.747 2.422 0.053 15 0 "[ . 1 .]" 1
534 1 66 THR HA 2 120 LEU MD2 3.500 . 4.000 3.425 2.801 3.875 . 0 0 "[ . 1 .]" 1
535 1 66 THR HB 2 120 LEU MD1 5.000 . 5.500 5.297 4.801 5.560 0.060 15 0 "[ . 1 .]" 1
536 1 66 THR HB 2 120 LEU MD2 5.000 . 5.500 4.782 4.223 5.320 . 0 0 "[ . 1 .]" 1
537 1 66 THR HB 2 126 THR MG 5.000 . 5.500 3.566 3.117 3.923 . 0 0 "[ . 1 .]" 1
538 1 66 THR HB 2 127 VAL MG1 3.500 . 4.000 3.267 2.470 3.964 . 0 0 "[ . 1 .]" 1
539 1 66 THR HB 2 127 VAL MG2 3.500 . 4.000 3.911 3.577 4.044 0.044 11 0 "[ . 1 .]" 1
540 1 66 THR MG 2 120 LEU HA 5.000 . 5.500 3.124 2.254 4.220 . 0 0 "[ . 1 .]" 1
541 1 66 THR MG 2 120 LEU MD1 3.500 . 4.500 3.821 2.848 4.483 . 0 0 "[ . 1 .]" 1
542 1 66 THR MG 2 120 LEU MD2 3.500 . 4.500 2.798 1.919 3.980 . 0 0 "[ . 1 .]" 1
543 1 66 THR MG 2 123 GLY QA 3.500 . 4.300 2.233 1.894 2.482 . 0 0 "[ . 1 .]" 1
544 1 66 THR MG 2 124 LEU HA 3.500 . 4.000 2.784 2.467 3.071 . 0 0 "[ . 1 .]" 1
545 1 66 THR MG 2 124 LEU MD1 3.500 . 4.500 2.561 1.829 3.578 . 0 0 "[ . 1 .]" 1
546 1 66 THR MG 2 124 LEU MD2 5.000 . 6.000 4.221 1.814 4.808 . 0 0 "[ . 1 .]" 1
547 1 66 THR MG 2 126 THR MG 3.500 . 4.500 3.108 2.516 3.651 . 0 0 "[ . 1 .]" 1
548 1 66 THR MG 2 127 VAL HB 3.500 . 4.000 3.767 3.512 4.039 0.039 7 0 "[ . 1 .]" 1
549 1 66 THR MG 2 127 VAL MG1 3.500 . 4.500 1.957 1.722 2.459 0.078 14 0 "[ . 1 .]" 1
550 1 66 THR MG 2 127 VAL MG2 2.700 . 3.700 1.884 1.760 2.360 0.040 6 0 "[ . 1 .]" 1
551 1 67 PRO HA 1 70 GLN QB 5.000 . 5.300 3.323 2.717 4.580 . 0 0 "[ . 1 .]" 1
552 1 67 PRO HA 1 70 GLN H 5.000 . 5.000 3.849 3.546 4.102 . 0 0 "[ . 1 .]" 1
553 1 67 PRO HA 2 126 THR MG 5.000 . 5.500 4.851 4.368 5.179 . 0 0 "[ . 1 .]" 1
554 1 67 PRO HA 2 127 VAL MG1 3.500 . 4.000 2.056 1.732 2.574 0.068 13 0 "[ . 1 .]" 1
555 1 67 PRO HA 2 127 VAL MG2 5.000 . 5.500 3.911 3.471 4.286 . 0 0 "[ . 1 .]" 1
556 1 67 PRO QD 2 120 LEU MD2 5.000 . 5.800 5.426 4.619 5.803 0.003 13 0 "[ . 1 .]" 1
557 1 67 PRO QD 2 123 GLY QA 5.000 . 5.600 2.932 2.642 3.482 . 0 0 "[ . 1 .]" 1
558 1 67 PRO QD 2 124 LEU MD1 5.000 . 5.800 5.540 5.031 5.889 0.089 3 0 "[ . 1 .]" 1
559 1 67 PRO QD 2 126 THR MG 3.500 . 4.300 3.075 2.680 3.407 . 0 0 "[ . 1 .]" 1
560 1 67 PRO QG 2 126 THR MG 5.000 . 5.800 3.108 2.044 4.030 . 0 0 "[ . 1 .]" 1
561 1 67 PRO QB 2 126 THR MG 5.000 . 5.800 4.075 3.491 4.510 . 0 0 "[ . 1 .]" 1
562 1 67 PRO QB 2 127 VAL MG1 3.500 . 4.300 2.329 1.778 2.940 0.022 15 0 "[ . 1 .]" 1
563 1 67 PRO QG 2 127 VAL MG1 3.500 . 4.300 2.616 1.869 3.618 . 0 0 "[ . 1 .]" 1
564 1 67 PRO QD 2 127 VAL MG2 5.000 . 5.800 3.834 3.239 4.338 . 0 0 "[ . 1 .]" 1
565 1 67 PRO QD 2 127 VAL MG1 5.000 . 5.800 2.523 1.887 3.014 . 0 0 "[ . 1 .]" 1
566 1 68 LEU H 1 69 ASP H 2.700 . 2.700 2.615 2.499 2.730 0.030 15 0 "[ . 1 .]" 1
567 1 68 LEU HA 1 71 LEU H 3.500 . 3.500 3.588 3.519 3.637 0.137 14 0 "[ . 1 .]" 1
568 1 69 ASP H 1 70 GLN H 2.700 . 2.700 2.705 2.527 2.772 0.072 11 0 "[ . 1 .]" 1
569 1 69 ASP HA 1 72 GLU QB 3.500 . 3.800 2.669 2.105 3.136 . 0 0 "[ . 1 .]" 1
570 1 70 GLN H 1 71 LEU H 2.700 . 2.700 2.732 2.651 2.756 0.056 13 0 "[ . 1 .]" 1
571 1 70 GLN HA 1 73 ILE H 5.000 . 5.000 3.253 2.892 3.487 . 0 0 "[ . 1 .]" 1
572 1 70 GLN HA 1 73 ILE MD 3.500 . 4.000 3.396 3.024 3.737 . 0 0 "[ . 1 .]" 1
573 1 70 GLN HA 1 73 ILE MG 5.000 . 5.500 3.706 3.074 4.315 . 0 0 "[ . 1 .]" 1
574 1 70 GLN HA 1 74 ARG QD 5.000 . 5.300 4.389 3.518 5.258 . 0 0 "[ . 1 .]" 1
575 1 70 GLN HA 1 101 PHE QD 5.000 . 5.300 5.267 4.834 5.420 0.120 10 0 "[ . 1 .]" 1
576 1 70 GLN HA 1 97 TRP HE3 3.500 . 3.500 3.098 2.346 3.535 0.035 10 0 "[ . 1 .]" 1
577 1 70 GLN HA 1 97 TRP HH2 5.000 . 5.000 4.293 3.859 4.972 . 0 0 "[ . 1 .]" 1
578 1 70 GLN HA 1 97 TRP HZ3 5.000 . 5.000 3.423 2.937 4.170 . 0 0 "[ . 1 .]" 1
579 1 71 LEU H 1 72 GLU H 2.700 . 2.700 2.654 2.549 2.754 0.054 4 0 "[ . 1 .]" 1
580 1 71 LEU HA 1 74 ARG H 3.500 . 3.500 3.588 3.515 3.656 0.156 2 0 "[ . 1 .]" 1
581 1 71 LEU HA 1 74 ARG QB 5.000 . 5.300 4.422 4.088 4.750 . 0 0 "[ . 1 .]" 1
582 1 71 LEU HA 1 74 ARG QG 3.500 . 3.800 2.490 2.077 3.295 . 0 0 "[ . 1 .]" 1
583 1 71 LEU HA 1 74 ARG QD 2.700 . 3.000 2.518 1.897 3.032 0.032 10 0 "[ . 1 .]" 1
584 1 71 LEU HG 1 75 LYS QE 5.000 . 5.300 4.644 3.463 5.295 . 0 0 "[ . 1 .]" 1
585 1 71 LEU MD1 1 74 ARG QD 5.000 . 5.800 3.281 2.358 5.610 . 0 0 "[ . 1 .]" 1
586 1 71 LEU MD1 1 75 LYS QB 5.000 . 5.800 4.770 3.256 5.795 . 0 0 "[ . 1 .]" 1
587 1 71 LEU MD1 1 75 LYS QE 3.500 . 4.300 4.005 3.595 4.331 0.031 15 0 "[ . 1 .]" 1
588 1 71 LEU QD 2 99 SER QB 5.000 . 5.800 5.809 5.605 5.918 0.118 6 0 "[ . 1 .]" 1
589 1 71 LEU QD 2 126 THR MG 5.000 . 6.000 5.920 5.529 6.052 0.052 2 0 "[ . 1 .]" 1
590 1 71 LEU QD 2 127 VAL MG1 3.500 . 4.500 3.633 3.152 3.946 . 0 0 "[ . 1 .]" 1
591 1 72 GLU H 1 73 ILE H 2.700 . 2.700 2.446 2.222 2.715 0.015 7 0 "[ . 1 .]" 1
592 1 72 GLU HA 1 75 LYS H 5.000 . 5.000 3.278 2.931 3.716 . 0 0 "[ . 1 .]" 1
593 1 72 GLU HA 1 75 LYS QB 3.500 . 3.800 2.045 1.749 2.440 0.051 1 0 "[ . 1 .]" 1
594 1 72 GLU HA 1 75 LYS QG 3.500 . 3.800 3.616 3.006 3.901 0.101 8 0 "[ . 1 .]" 1
595 1 72 GLU HA 1 76 ALA MB 5.000 . 5.500 3.810 3.333 4.424 . 0 0 "[ . 1 .]" 1
596 1 73 ILE H 1 74 ARG H 2.700 . 2.700 2.684 2.552 2.837 0.137 7 0 "[ . 1 .]" 1
597 1 73 ILE HA 1 76 ALA H 5.000 . 5.000 4.180 3.924 4.519 . 0 0 "[ . 1 .]" 1
598 1 73 ILE HA 1 76 ALA MB 5.000 . 5.500 3.285 3.043 3.625 . 0 0 "[ . 1 .]" 1
599 1 73 ILE HA 1 79 PHE HZ 5.000 . 5.000 4.951 4.715 5.082 0.082 10 0 "[ . 1 .]" 1
600 1 73 ILE MD 1 79 PHE QD 3.500 . 4.300 3.376 2.799 3.862 . 0 0 "[ . 1 .]" 1
601 1 73 ILE MD 1 79 PHE HZ 2.700 . 3.200 2.450 1.978 2.873 . 0 0 "[ . 1 .]" 1
602 1 73 ILE MG 1 79 PHE QD 5.000 . 5.800 3.182 2.599 3.629 . 0 0 "[ . 1 .]" 1
603 1 73 ILE MG 1 79 PHE HZ 3.500 . 4.000 3.864 3.414 4.042 0.042 6 0 "[ . 1 .]" 1
604 1 73 ILE MD 1 94 GLU HA 5.000 . 5.500 2.100 1.794 2.696 0.006 7 0 "[ . 1 .]" 1
605 1 73 ILE MD 1 97 TRP HE3 3.500 . 4.000 2.130 1.761 2.643 0.039 15 0 "[ . 1 .]" 1
606 1 73 ILE MD 1 97 TRP HZ3 3.500 . 4.000 3.821 3.472 4.034 0.034 11 0 "[ . 1 .]" 1
607 1 73 ILE MG 1 97 TRP HE3 5.000 . 5.500 3.697 3.277 4.013 . 0 0 "[ . 1 .]" 1
608 1 73 ILE MG 1 97 TRP HZ3 5.000 . 5.500 5.515 5.304 5.620 0.120 14 0 "[ . 1 .]" 1
609 1 73 ILE MD 1 98 ALA H 3.500 . 4.000 3.333 2.809 3.850 . 0 0 "[ . 1 .]" 1
610 1 73 ILE MG 1 98 ALA H 3.500 . 4.000 2.831 2.136 3.416 . 0 0 "[ . 1 .]" 1
611 1 73 ILE MD 1 98 ALA MB 2.700 . 3.700 3.313 2.950 3.694 . 0 0 "[ . 1 .]" 1
612 1 73 ILE MG 1 98 ALA HA 5.000 . 5.500 2.400 1.878 2.831 . 0 0 "[ . 1 .]" 1
613 1 73 ILE MG 1 98 ALA MB 2.700 . 3.700 2.547 2.064 3.068 . 0 0 "[ . 1 .]" 1
614 1 73 ILE MG 1 101 PHE QB 5.000 . 5.800 2.759 2.208 3.184 . 0 0 "[ . 1 .]" 1
615 1 73 ILE MG 1 101 PHE QD 5.000 . 5.800 2.948 2.120 3.848 . 0 0 "[ . 1 .]" 1
616 1 73 ILE MG 1 103 LYS QE 5.000 . 5.800 4.800 3.959 5.444 . 0 0 "[ . 1 .]" 1
617 1 74 ARG H 1 75 LYS H 2.700 . 2.700 2.439 2.146 2.768 0.068 7 0 "[ . 1 .]" 1
618 1 74 ARG H 1 101 PHE QD 3.500 . 3.800 3.816 3.259 3.998 0.198 8 0 "[ . 1 .]" 1
619 1 74 ARG HA 1 101 PHE QD 3.500 . 3.800 2.841 1.995 3.696 . 0 0 "[ . 1 .]" 1
620 1 74 ARG QG 1 101 PHE QD 3.500 . 4.100 3.953 3.501 4.234 0.134 12 0 "[ . 1 .]" 1
621 1 74 ARG QD 1 101 PHE QD 2.700 . 3.300 3.355 3.231 3.416 0.116 10 0 "[ . 1 .]" 1
622 1 74 ARG QD 1 101 PHE QE 3.500 . 4.100 1.842 1.709 2.272 0.091 12 0 "[ . 1 .]" 1
623 1 74 ARG HA 1 103 LYS QE 2.700 . 3.000 2.375 1.773 2.976 0.027 1 0 "[ . 1 .]" 1
624 1 75 LYS H 1 76 ALA H 2.700 . 2.700 2.592 2.197 2.768 0.068 6 0 "[ . 1 .]" 1
625 1 76 ALA HA 1 78 VAL H 5.000 . 5.000 3.985 3.533 4.605 . 0 0 "[ . 1 .]" 1
626 1 76 ALA MB 1 78 VAL H 3.500 . 4.000 3.060 2.767 3.466 . 0 0 "[ . 1 .]" 1
627 1 76 ALA MB 1 79 PHE HA 5.000 . 5.500 3.197 2.662 3.786 . 0 0 "[ . 1 .]" 1
628 1 76 ALA MB 1 79 PHE QD 5.000 . 5.800 3.060 2.704 3.332 . 0 0 "[ . 1 .]" 1
629 1 76 ALA MB 1 79 PHE QE 3.500 . 4.300 4.327 4.208 4.432 0.132 4 0 "[ . 1 .]" 1
630 1 76 ALA MB 1 103 LYS QE 5.000 . 5.800 4.840 3.252 5.826 0.026 15 0 "[ . 1 .]" 1
631 1 77 ASP H 1 78 VAL H 2.700 . 2.700 2.534 2.266 2.771 0.071 6 0 "[ . 1 .]" 1
632 1 77 ASP QB 1 78 VAL MG2 5.000 . 5.800 3.939 3.594 4.642 . 0 0 "[ . 1 .]" 1
633 1 77 ASP QB 1 78 VAL MG1 5.000 . 5.800 4.579 4.232 5.029 . 0 0 "[ . 1 .]" 1
634 1 78 VAL HA 1 79 PHE H 2.700 . 2.700 2.206 2.143 2.400 . 0 0 "[ . 1 .]" 1
635 1 78 VAL MG1 1 79 PHE HA 3.500 . 4.000 3.670 3.188 3.939 . 0 0 "[ . 1 .]" 1
636 1 78 VAL MG1 1 80 VAL H 5.000 . 5.500 3.641 3.235 3.982 . 0 0 "[ . 1 .]" 1
637 1 78 VAL MG1 1 80 VAL MG2 3.500 . 4.500 2.118 1.753 3.886 0.047 15 0 "[ . 1 .]" 1
638 1 78 VAL MG2 1 104 PRO QD 5.000 . 5.800 4.337 3.559 5.090 . 0 0 "[ . 1 .]" 1
639 1 78 VAL MG1 1 105 ILE HA 5.000 . 5.500 4.725 4.320 5.123 . 0 0 "[ . 1 .]" 1
640 1 78 VAL MG2 1 105 ILE HA 5.000 . 5.500 5.152 4.475 5.476 . 0 0 "[ . 1 .]" 1
641 1 78 VAL MG1 1 106 VAL H 5.000 . 5.500 4.755 4.451 5.062 . 0 0 "[ . 1 .]" 1
642 1 78 VAL MG2 1 149 ILE HA 5.000 . 5.500 4.049 3.486 4.680 . 0 0 "[ . 1 .]" 1
643 1 78 VAL MG1 1 149 ILE MG 2.700 . 3.700 2.736 1.789 3.096 0.011 5 0 "[ . 1 .]" 1
644 1 78 VAL MG1 1 149 ILE MD 3.500 . 4.500 2.515 1.788 3.067 0.012 3 0 "[ . 1 .]" 1
645 1 78 VAL MG2 1 149 ILE MG 2.700 . 3.700 2.562 1.811 3.110 . 0 0 "[ . 1 .]" 1
646 1 78 VAL MG2 1 149 ILE MD 3.500 . 4.500 3.763 3.158 4.317 . 0 0 "[ . 1 .]" 1
647 1 78 VAL MG2 1 152 VAL MG1 3.500 . 4.500 3.291 2.741 4.031 . 0 0 "[ . 1 .]" 1
648 1 78 VAL MG2 1 153 VAL HA 5.000 . 5.500 4.036 3.544 4.988 . 0 0 "[ . 1 .]" 1
649 1 79 PHE HA 1 80 VAL H 2.700 . 2.700 2.134 2.109 2.191 . 0 0 "[ . 1 .]" 1
650 1 79 PHE H 1 98 ALA MB 5.000 . 5.500 4.680 4.315 5.081 . 0 0 "[ . 1 .]" 1
651 1 79 PHE H 1 105 ILE HA 5.000 . 5.000 3.469 3.259 3.761 . 0 0 "[ . 1 .]" 1
652 1 79 PHE QE 1 81 ALA MB 3.500 . 4.300 2.583 2.017 3.187 . 0 0 "[ . 1 .]" 1
653 1 79 PHE QE 1 91 THR MG 3.500 . 4.300 4.032 3.670 4.286 . 0 0 "[ . 1 .]" 1
654 1 79 PHE HZ 1 91 THR MG 3.500 . 4.000 4.040 3.952 4.081 0.081 4 0 "[ . 1 .]" 1
655 1 79 PHE HZ 1 94 GLU HA 5.000 . 5.000 3.582 3.102 3.893 . 0 0 "[ . 1 .]" 1
656 1 79 PHE QD 1 95 ILE MD 5.000 . 5.800 4.731 4.190 5.095 . 0 0 "[ . 1 .]" 1
657 1 79 PHE QE 1 95 ILE MD 3.500 . 4.300 3.053 2.496 3.376 . 0 0 "[ . 1 .]" 1
658 1 79 PHE HZ 1 95 ILE MD 3.500 . 4.000 3.913 3.663 4.084 0.084 6 0 "[ . 1 .]" 1
659 1 79 PHE QE 1 98 ALA MB 3.500 . 4.300 3.133 2.844 3.404 . 0 0 "[ . 1 .]" 1
660 1 79 PHE QD 1 98 ALA MB 3.500 . 4.300 2.638 2.314 2.950 . 0 0 "[ . 1 .]" 1
661 1 79 PHE HZ 1 98 ALA MB 3.500 . 4.000 3.937 3.794 4.064 0.064 6 0 "[ . 1 .]" 1
662 1 79 PHE HZ 1 98 ALA H 5.000 . 5.000 4.581 4.246 4.802 . 0 0 "[ . 1 .]" 1
663 1 79 PHE QD 1 105 ILE MD 3.500 . 4.300 3.422 2.970 3.889 . 0 0 "[ . 1 .]" 1
664 1 79 PHE QE 1 105 ILE MD 5.000 . 5.800 4.128 3.496 4.591 . 0 0 "[ . 1 .]" 1
665 1 79 PHE QD 1 105 ILE MG 3.500 . 4.300 2.556 1.976 3.182 . 0 0 "[ . 1 .]" 1
666 1 79 PHE QE 1 105 ILE MG 5.000 . 5.800 3.887 3.211 4.339 . 0 0 "[ . 1 .]" 1
667 1 79 PHE QD 1 107 LEU MD2 3.500 . 4.300 3.596 2.911 4.347 0.047 6 0 "[ . 1 .]" 1
668 1 79 PHE QE 1 107 LEU MD2 5.000 . 5.800 3.214 2.606 3.742 . 0 0 "[ . 1 .]" 1
669 1 80 VAL HA 1 81 ALA H 2.700 . 2.700 2.179 2.143 2.290 . 0 0 "[ . 1 .]" 1
670 1 80 VAL QG 1 82 ILE MD 5.000 . 6.000 4.601 4.216 5.249 . 0 0 "[ . 1 .]" 1
671 1 80 VAL QG 1 106 VAL H 3.500 . 4.000 3.732 3.152 4.032 0.032 10 0 "[ . 1 .]" 1
672 1 80 VAL QG 1 106 VAL HB 3.500 . 4.000 2.122 1.745 2.819 0.055 9 0 "[ . 1 .]" 1
673 1 80 VAL QG 1 106 VAL MG1 5.000 . 6.000 2.441 1.875 3.325 . 0 0 "[ . 1 .]" 1
674 1 80 VAL QG 1 106 VAL MG2 3.500 . 4.500 3.258 2.686 3.796 . 0 0 "[ . 1 .]" 1
675 1 80 VAL QG 1 108 LEU QD 2.700 . 3.700 3.145 2.668 3.685 . 0 0 "[ . 1 .]" 1
676 1 80 VAL QG 1 145 ILE MD 3.500 . 4.500 1.904 1.765 2.211 0.035 1 0 "[ . 1 .]" 1
677 1 80 VAL QG 1 145 ILE MG 5.000 . 6.000 3.588 3.101 4.030 . 0 0 "[ . 1 .]" 1
678 1 80 VAL QG 1 149 ILE MD 3.500 . 4.500 2.059 1.773 2.809 0.027 3 0 "[ . 1 .]" 1
679 1 80 VAL QG 1 149 ILE MG 5.000 . 6.000 3.808 3.348 4.333 . 0 0 "[ . 1 .]" 1
680 1 81 ALA HA 1 82 ILE H 2.700 . 2.700 2.569 2.363 2.696 . 0 0 "[ . 1 .]" 1
681 1 81 ALA H 1 105 ILE MG 5.000 . 5.500 4.266 3.809 4.927 . 0 0 "[ . 1 .]" 1
682 1 81 ALA H 1 107 LEU HA 3.500 . 3.500 2.284 1.984 2.499 . 0 0 "[ . 1 .]" 1
683 1 81 ALA H 1 107 LEU MD2 5.000 . 5.500 2.637 1.787 3.842 0.013 15 0 "[ . 1 .]" 1
684 1 81 ALA HA 1 91 THR MG 5.000 . 5.500 3.355 3.010 3.752 . 0 0 "[ . 1 .]" 1
685 1 81 ALA MB 1 83 PRO HA 5.000 . 5.500 4.699 4.503 4.936 . 0 0 "[ . 1 .]" 1
686 1 81 ALA MB 1 83 PRO QD 5.000 . 5.800 3.407 3.108 3.882 . 0 0 "[ . 1 .]" 1
687 1 81 ALA MB 1 91 THR MG 3.500 . 4.500 1.832 1.715 2.052 0.085 15 0 "[ . 1 .]" 1
688 1 81 ALA MB 1 95 ILE HA 5.000 . 5.500 4.052 3.508 4.789 . 0 0 "[ . 1 .]" 1
689 1 81 ALA MB 1 95 ILE MD 3.500 . 4.500 2.103 1.767 2.490 0.033 12 0 "[ . 1 .]" 1
690 1 81 ALA MB 1 95 ILE MG 5.000 . 6.000 4.361 3.437 5.251 . 0 0 "[ . 1 .]" 1
691 1 81 ALA MB 1 107 LEU HA 5.000 . 5.500 3.515 3.287 3.757 . 0 0 "[ . 1 .]" 1
692 1 81 ALA MB 1 107 LEU MD1 3.500 . 4.500 3.572 3.036 4.166 . 0 0 "[ . 1 .]" 1
693 1 82 ILE H 1 83 PRO QD 5.000 . 5.300 3.658 3.467 3.885 . 0 0 "[ . 1 .]" 1
694 1 82 ILE HA 1 83 PRO QD 3.500 . 3.800 1.818 1.747 1.885 0.053 2 0 "[ . 1 .]" 1
695 1 82 ILE HA 1 84 GLY H 5.000 . 5.000 5.122 5.034 5.180 0.180 4 0 "[ . 1 .]" 1
696 1 82 ILE HA 1 108 LEU H 5.000 . 5.000 2.478 2.203 2.760 . 0 0 "[ . 1 .]" 1
697 1 82 ILE HA 1 108 LEU MD1 5.000 . 5.500 4.517 4.069 5.036 . 0 0 "[ . 1 .]" 1
698 1 82 ILE MG 1 84 GLY H 3.500 . 4.000 3.589 3.317 3.709 . 0 0 "[ . 1 .]" 1
699 1 82 ILE MG 1 84 GLY QA 3.500 . 4.300 3.145 3.031 3.416 . 0 0 "[ . 1 .]" 1
700 1 82 ILE MG 1 85 ILE H 5.000 . 5.500 5.517 5.373 5.617 0.117 4 0 "[ . 1 .]" 1
701 1 82 ILE MG 1 108 LEU MD1 3.500 . 4.500 4.056 3.667 4.461 . 0 0 "[ . 1 .]" 1
702 1 82 ILE MD 1 108 LEU MD1 3.500 . 4.500 2.000 1.788 2.339 0.012 2 0 "[ . 1 .]" 1
703 1 82 ILE MG 1 109 LEU MD2 5.000 . 6.000 5.344 4.867 5.847 . 0 0 "[ . 1 .]" 1
704 1 82 ILE MG 1 110 GLU HA 5.000 . 5.500 5.040 4.292 5.551 0.051 12 0 "[ . 1 .]" 1
705 1 82 ILE MD 1 110 GLU HA 5.000 . 5.500 5.276 4.404 5.571 0.071 3 0 "[ . 1 .]" 1
706 1 82 ILE MD 1 135 TYR QE 5.000 . 5.800 2.367 1.796 3.103 0.004 3 0 "[ . 1 .]" 1
707 1 82 ILE MG 1 135 TYR QE 3.500 . 4.300 2.938 1.844 3.852 . 0 0 "[ . 1 .]" 1
708 1 82 ILE MG 1 135 TYR QD 5.000 . 5.800 4.630 3.498 5.543 . 0 0 "[ . 1 .]" 1
709 1 82 ILE MG 1 138 ILE MD 5.000 . 6.000 5.289 4.770 5.706 . 0 0 "[ . 1 .]" 1
710 1 82 ILE MD 1 138 ILE MD 3.500 . 4.500 3.480 2.429 4.061 . 0 0 "[ . 1 .]" 1
711 1 83 PRO HA 1 84 GLY H 2.700 . 2.700 3.276 3.237 3.323 0.623 15 15 [***-**********+] 1
712 1 83 PRO HA 1 87 PRO HA 5.000 . 5.000 5.023 4.766 5.101 0.101 6 0 "[ . 1 .]" 1
713 1 83 PRO HA 1 88 SER H 5.000 . 5.000 4.125 3.646 4.725 . 0 0 "[ . 1 .]" 1
714 1 83 PRO HA 1 91 THR MG 3.500 . 4.000 3.809 3.414 3.994 . 0 0 "[ . 1 .]" 1
715 1 83 PRO QD 1 91 THR MG 5.000 . 5.800 3.946 3.538 4.336 . 0 0 "[ . 1 .]" 1
716 1 83 PRO HA 1 92 HIS HE1 5.000 . 5.000 5.054 4.893 5.155 0.155 14 0 "[ . 1 .]" 1
717 1 83 PRO HA 1 95 ILE MD 5.000 . 5.500 3.924 3.465 4.379 . 0 0 "[ . 1 .]" 1
718 1 83 PRO HA 1 117 TYR QE 5.000 . 5.300 3.057 2.865 3.436 . 0 0 "[ . 1 .]" 1
719 1 83 PRO QG 1 107 LEU MD2 3.500 . 4.300 3.669 2.703 4.242 . 0 0 "[ . 1 .]" 1
720 1 83 PRO QD 1 107 LEU MD2 5.000 . 5.800 2.602 1.977 3.411 . 0 0 "[ . 1 .]" 1
721 1 83 PRO QD 1 108 LEU H 5.000 . 5.300 2.680 2.228 3.066 . 0 0 "[ . 1 .]" 1
722 1 83 PRO QG 1 109 LEU MD2 3.500 . 4.300 2.137 1.841 2.457 . 0 0 "[ . 1 .]" 1
723 1 83 PRO QD 1 109 LEU MD2 3.500 . 4.300 2.994 2.787 3.382 . 0 0 "[ . 1 .]" 1
724 1 84 GLY H 1 85 ILE H 2.700 . 2.700 2.537 2.433 2.640 . 0 0 "[ . 1 .]" 1
725 1 84 GLY QA 1 85 ILE H 3.500 . 3.800 2.640 2.561 2.753 . 0 0 "[ . 1 .]" 1
726 1 84 GLY QA 1 88 SER H 5.000 . 5.300 4.754 4.370 5.046 . 0 0 "[ . 1 .]" 1
727 1 84 GLY H 1 109 LEU MD2 5.000 . 5.500 5.094 4.575 5.403 . 0 0 "[ . 1 .]" 1
728 1 84 GLY H 1 114 GLU HA 5.000 . 5.000 4.765 4.298 5.075 0.075 9 0 "[ . 1 .]" 1
729 1 84 GLY H 1 117 TYR QE 5.000 . 5.300 2.422 2.238 2.654 . 0 0 "[ . 1 .]" 1
730 1 85 ILE H 1 114 GLU HA 5.000 . 5.000 5.121 5.047 5.222 0.222 4 0 "[ . 1 .]" 1
731 1 85 ILE H 1 117 TYR QE 3.500 . 3.800 1.903 1.736 2.089 0.064 9 0 "[ . 1 .]" 1
732 1 85 ILE H 1 117 TYR QD 5.000 . 5.300 4.102 3.909 4.281 . 0 0 "[ . 1 .]" 1
733 1 85 ILE HA 1 86 PRO HA 2.700 . 2.700 2.568 2.276 2.740 0.040 1 0 "[ . 1 .]" 1
734 1 85 ILE HA 1 86 PRO QB 5.000 . 5.300 3.861 3.778 3.960 . 0 0 "[ . 1 .]" 1
735 1 85 ILE MG 1 86 PRO HA 2.700 . 3.200 2.239 1.907 2.703 . 0 0 "[ . 1 .]" 1
736 1 85 ILE MG 1 86 PRO QB 3.500 . 4.300 3.612 3.368 4.000 . 0 0 "[ . 1 .]" 1
737 1 85 ILE MG 1 86 PRO QG 5.000 . 5.800 3.728 3.173 4.070 . 0 0 "[ . 1 .]" 1
738 1 85 ILE MG 1 87 PRO QD 5.000 . 5.800 3.525 3.148 4.242 . 0 0 "[ . 1 .]" 1
739 1 85 ILE MD 1 87 PRO QD 5.000 . 5.800 2.800 2.427 3.346 . 0 0 "[ . 1 .]" 1
740 1 85 ILE MD 1 109 LEU MD2 5.000 . 6.000 5.536 5.131 5.781 . 0 0 "[ . 1 .]" 1
741 1 85 ILE MD 1 113 ARG H 5.000 . 5.500 4.688 4.369 4.990 . 0 0 "[ . 1 .]" 1
742 1 85 ILE MG 1 113 ARG H 5.000 . 5.500 4.873 4.568 5.249 . 0 0 "[ . 1 .]" 1
743 1 85 ILE MD 1 113 ARG HA 3.500 . 4.000 2.596 2.225 3.010 . 0 0 "[ . 1 .]" 1
744 1 85 ILE MD 1 113 ARG QD 3.500 . 4.300 3.770 3.073 4.353 0.053 10 0 "[ . 1 .]" 1
745 1 85 ILE MD 1 113 ARG QG 5.000 . 5.800 3.907 3.415 4.476 . 0 0 "[ . 1 .]" 1
746 1 85 ILE MD 1 114 GLU H 3.500 . 4.000 4.007 3.800 4.107 0.107 7 0 "[ . 1 .]" 1
747 1 85 ILE MD 1 116 GLU H 3.500 . 4.000 3.276 3.138 3.463 . 0 0 "[ . 1 .]" 1
748 1 85 ILE MG 1 116 GLU H 5.000 . 5.500 5.169 4.750 5.571 0.071 11 0 "[ . 1 .]" 1
749 1 85 ILE MD 1 116 GLU QB 3.500 . 4.300 1.848 1.735 2.102 0.065 6 0 "[ . 1 .]" 1
750 1 85 ILE MD 1 116 GLU QG 3.500 . 4.300 3.574 3.420 3.748 . 0 0 "[ . 1 .]" 1
751 1 85 ILE MG 1 116 GLU QB 3.500 . 4.300 3.225 2.824 3.665 . 0 0 "[ . 1 .]" 1
752 1 85 ILE MG 1 116 GLU QG 3.500 . 4.300 3.395 2.813 4.208 . 0 0 "[ . 1 .]" 1
753 1 85 ILE MD 1 117 TYR H 3.500 . 4.000 2.244 1.877 2.965 . 0 0 "[ . 1 .]" 1
754 1 85 ILE MD 1 117 TYR HA 2.700 . 3.200 2.632 2.183 3.148 . 0 0 "[ . 1 .]" 1
755 1 85 ILE MD 1 117 TYR QD 5.000 . 5.800 2.346 2.190 2.558 . 0 0 "[ . 1 .]" 1
756 1 85 ILE MD 1 117 TYR QE 3.500 . 4.300 2.230 2.091 2.404 . 0 0 "[ . 1 .]" 1
757 1 85 ILE MG 1 117 TYR QE 5.000 . 5.800 4.449 4.244 4.632 . 0 0 "[ . 1 .]" 1
758 1 86 PRO HA 1 87 PRO QD 2.700 . 3.000 2.091 1.977 2.279 . 0 0 "[ . 1 .]" 1
759 1 87 PRO HA 1 92 HIS HE1 2.700 . 2.700 2.118 1.769 2.752 0.052 8 0 "[ . 1 .]" 1
760 1 88 SER H 1 92 HIS HE1 5.000 . 5.000 3.915 3.334 4.801 . 0 0 "[ . 1 .]" 1
761 1 88 SER HA 1 89 PRO QD 2.700 . 3.000 1.923 1.794 2.045 0.006 8 0 "[ . 1 .]" 1
762 1 88 SER QB 1 91 THR MG 5.000 . 5.800 3.559 3.136 4.469 . 0 0 "[ . 1 .]" 1
763 1 90 GLY H 1 91 THR H 2.700 . 2.700 2.796 2.740 2.867 0.167 13 0 "[ . 1 .]" 1
764 1 90 GLY QA 1 93 VAL MG2 5.000 . 5.800 3.322 2.233 4.339 . 0 0 "[ . 1 .]" 1
765 1 90 GLY QA 2 120 LEU MD1 3.500 . 4.300 2.748 2.091 4.412 0.112 6 0 "[ . 1 .]" 1
766 1 90 GLY QA 2 120 LEU MD2 5.000 . 5.800 3.870 1.792 5.041 0.008 6 0 "[ . 1 .]" 1
767 1 91 THR H 1 92 HIS H 3.500 . 3.500 3.073 2.940 3.205 . 0 0 "[ . 1 .]" 1
768 1 91 THR MG 1 94 GLU QG 5.000 . 5.800 4.124 2.703 5.096 . 0 0 "[ . 1 .]" 1
769 1 91 THR MG 1 95 ILE MD 2.700 . 3.700 2.091 1.792 2.591 0.008 2 0 "[ . 1 .]" 1
770 1 91 THR HB 1 95 ILE MD 5.000 . 5.500 2.434 1.775 2.888 0.025 2 0 "[ . 1 .]" 1
771 1 91 THR MG 1 117 TYR QE 5.000 . 5.800 5.534 5.142 5.776 . 0 0 "[ . 1 .]" 1
772 1 92 HIS H 1 93 VAL H 3.500 . 3.500 3.325 3.072 3.482 . 0 0 "[ . 1 .]" 1
773 1 92 HIS H 1 117 TYR QE 5.000 . 5.300 4.568 4.326 4.802 . 0 0 "[ . 1 .]" 1
774 1 92 HIS H 1 117 TYR QD 5.000 . 5.300 5.501 5.403 5.576 0.276 2 0 "[ . 1 .]" 1
775 1 92 HIS HA 1 95 ILE H 3.500 . 3.500 3.190 3.010 3.556 0.056 2 0 "[ . 1 .]" 1
776 1 92 HIS HA 1 96 GLY H 3.500 . 3.500 3.605 3.500 3.684 0.184 11 0 "[ . 1 .]" 1
777 1 92 HIS HA 1 95 ILE MD 3.500 . 4.000 2.077 1.756 2.338 0.044 6 0 "[ . 1 .]" 1
778 1 92 HIS HA 1 95 ILE MG 5.000 . 5.500 3.483 2.482 4.194 . 0 0 "[ . 1 .]" 1
779 1 92 HIS HD2 1 93 VAL H 5.000 . 5.000 5.139 4.912 5.281 0.281 10 0 "[ . 1 .]" 1
780 1 92 HIS HD2 1 95 ILE MD 5.000 . 5.500 3.469 1.875 4.183 . 0 0 "[ . 1 .]" 1
781 1 92 HIS HE1 1 95 ILE MD 5.000 . 5.500 5.487 4.951 5.596 0.096 9 0 "[ . 1 .]" 1
782 1 92 HIS HD2 1 121 VAL MG1 5.000 . 5.500 5.494 5.250 5.599 0.099 13 0 "[ . 1 .]" 1
783 1 92 HIS HD2 1 121 VAL MG2 3.500 . 4.000 3.119 2.586 3.701 . 0 0 "[ . 1 .]" 1
784 1 92 HIS HE1 1 121 VAL MG2 5.000 . 5.500 3.501 2.150 4.684 . 0 0 "[ . 1 .]" 1
785 1 92 HIS HA 2 93 VAL MG2 5.000 . 5.500 3.116 2.403 3.549 . 0 0 "[ . 1 .]" 1
786 1 92 HIS HD2 2 93 VAL MG2 3.500 . 4.000 3.053 2.028 4.162 0.162 9 0 "[ . 1 .]" 1
787 1 93 VAL H 1 94 GLU H 2.700 . 2.700 2.782 2.618 2.863 0.163 4 0 "[ . 1 .]" 1
788 1 93 VAL HA 1 96 GLY H 3.500 . 3.500 3.553 3.499 3.608 0.108 11 0 "[ . 1 .]" 1
789 1 93 VAL MG1 1 97 TRP H 5.000 . 5.500 3.968 3.598 4.449 . 0 0 "[ . 1 .]" 1
790 1 93 VAL MG1 1 97 TRP HZ2 5.000 . 5.500 4.273 3.554 5.242 . 0 0 "[ . 1 .]" 1
791 1 93 VAL MG1 1 97 TRP HE1 5.000 . 5.500 4.292 3.445 5.377 . 0 0 "[ . 1 .]" 1
792 1 93 VAL MG1 1 97 TRP HE3 5.000 . 5.500 3.733 2.976 4.407 . 0 0 "[ . 1 .]" 1
793 1 93 VAL MG2 2 93 VAL HA 5.000 . 5.500 2.588 1.938 3.458 . 0 0 "[ . 1 .]" 1
794 1 93 VAL MG2 2 93 VAL HB 5.000 . 5.500 4.340 3.585 5.414 . 0 0 "[ . 1 .]" 1
795 1 93 VAL MG1 2 95 ILE MG 3.500 . 4.500 3.555 2.486 4.397 . 0 0 "[ . 1 .]" 1
796 1 93 VAL MG2 2 95 ILE MG 3.500 . 4.500 4.096 2.937 4.577 0.077 10 0 "[ . 1 .]" 1
797 1 93 VAL MG2 2 95 ILE MD 5.000 . 6.000 4.375 3.423 4.965 . 0 0 "[ . 1 .]" 1
798 1 93 VAL MG1 2 96 GLY H 2.700 . 3.200 2.660 1.836 3.200 0.000 9 0 "[ . 1 .]" 1
799 1 93 VAL MG1 2 96 GLY QA 3.500 . 4.300 1.896 1.674 2.590 0.126 3 0 "[ . 1 .]" 1
800 1 93 VAL HB 2 120 LEU MD1 2.700 . 3.200 2.607 1.891 3.293 0.093 6 0 "[ . 1 .]" 1
801 1 93 VAL MG1 2 120 LEU MD1 3.500 . 4.500 2.320 1.663 3.563 0.137 6 0 "[ . 1 .]" 1
802 1 93 VAL MG1 2 120 LEU MD2 5.000 . 6.000 1.864 1.685 2.932 0.115 1 0 "[ . 1 .]" 1
803 1 93 VAL MG1 2 121 VAL MG2 5.000 . 6.000 5.604 4.951 6.008 0.008 15 0 "[ . 1 .]" 1
804 1 93 VAL MG2 2 121 VAL MG2 5.000 . 6.000 5.071 4.376 5.843 . 0 0 "[ . 1 .]" 1
805 1 93 VAL MG1 2 124 LEU MD1 3.500 . 4.500 3.185 2.459 4.154 . 0 0 "[ . 1 .]" 1
806 1 93 VAL MG1 2 124 LEU MD2 5.000 . 6.000 4.146 3.356 4.809 . 0 0 "[ . 1 .]" 1
807 1 93 VAL MG1 2 127 VAL MG2 5.000 . 6.000 5.836 5.371 6.138 0.138 1 0 "[ . 1 .]" 1
808 1 94 GLU H 1 95 ILE H 2.700 . 2.700 2.517 2.364 2.661 . 0 0 "[ . 1 .]" 1
809 1 94 GLU HA 1 97 TRP H 3.500 . 3.500 3.477 3.248 3.569 0.069 10 0 "[ . 1 .]" 1
810 1 94 GLU HA 1 97 TRP HE3 5.000 . 5.000 2.134 1.759 2.705 0.041 3 0 "[ . 1 .]" 1
811 1 95 ILE H 1 96 GLY H 2.700 . 2.700 2.719 2.657 2.782 0.082 7 0 "[ . 1 .]" 1
812 1 95 ILE HA 1 98 ALA MB 5.000 . 5.500 2.672 2.415 3.049 . 0 0 "[ . 1 .]" 1
813 1 95 ILE MG 1 98 ALA MB 5.000 . 6.000 3.572 3.270 4.037 . 0 0 "[ . 1 .]" 1
814 1 95 ILE MG 1 105 ILE MD 5.000 . 6.000 2.418 1.958 3.222 . 0 0 "[ . 1 .]" 1
815 1 95 ILE MD 1 107 LEU MD2 3.500 . 4.500 2.118 1.813 2.592 . 0 0 "[ . 1 .]" 1
816 1 95 ILE MD 1 107 LEU MD1 3.500 . 4.500 3.144 1.948 4.365 . 0 0 "[ . 1 .]" 1
817 1 95 ILE MG 1 107 LEU MD2 5.000 . 6.000 3.009 1.963 3.852 . 0 0 "[ . 1 .]" 1
818 1 95 ILE MG 1 107 LEU MD1 5.000 . 6.000 2.671 2.027 4.065 . 0 0 "[ . 1 .]" 1
819 1 95 ILE MD 1 117 TYR QE 5.000 . 5.800 4.960 4.536 5.358 . 0 0 "[ . 1 .]" 1
820 1 95 ILE MD 1 121 VAL MG2 3.500 . 4.500 3.395 2.741 3.998 . 0 0 "[ . 1 .]" 1
821 1 95 ILE MD 1 121 VAL MG1 5.000 . 6.000 5.028 4.516 5.670 . 0 0 "[ . 1 .]" 1
822 1 95 ILE MG 1 121 VAL MG2 5.000 . 6.000 3.424 2.861 4.445 . 0 0 "[ . 1 .]" 1
823 1 95 ILE MG 1 124 LEU MD1 3.500 . 4.500 2.264 1.698 3.309 0.102 14 0 "[ . 1 .]" 1
824 1 95 ILE MG 1 124 LEU MD2 3.500 . 4.500 1.805 1.602 2.888 0.198 7 0 "[ . 1 .]" 1
825 1 96 GLY H 1 97 TRP H 2.700 . 2.700 2.656 2.567 2.738 0.038 15 0 "[ . 1 .]" 1
826 1 96 GLY QA 1 99 SER H 5.000 . 5.300 3.064 2.883 3.285 . 0 0 "[ . 1 .]" 1
827 1 96 GLY QA 1 100 ALA H 5.000 . 5.300 3.902 3.613 4.199 . 0 0 "[ . 1 .]" 1
828 1 96 GLY QA 1 100 ALA MB 5.000 . 5.800 4.575 4.176 4.945 . 0 0 "[ . 1 .]" 1
829 1 97 TRP H 1 98 ALA H 2.700 . 2.700 2.696 2.544 2.817 0.117 12 0 "[ . 1 .]" 1
830 1 97 TRP HA 1 100 ALA H 3.500 . 3.500 3.562 3.495 3.606 0.106 10 0 "[ . 1 .]" 1
831 1 97 TRP HA 2 100 ALA MB 3.500 . 4.000 2.429 1.755 3.144 0.045 2 0 "[ . 1 .]" 1
832 1 97 TRP HE1 2 99 SER HG 5.000 . 5.000 3.423 2.204 4.439 . 0 0 "[ . 1 .]" 1
833 1 97 TRP HD1 2 100 ALA MB 3.500 . 4.000 1.905 1.700 2.198 0.100 5 0 "[ . 1 .]" 1
834 1 97 TRP HE1 2 100 ALA MB 3.500 . 4.000 3.281 2.725 3.711 . 0 0 "[ . 1 .]" 1
835 1 97 TRP HD1 2 100 ALA H 3.500 . 3.500 2.323 1.933 2.839 . 0 0 "[ . 1 .]" 1
836 1 97 TRP HE1 2 100 ALA H 5.000 . 5.000 2.224 1.762 2.868 0.038 11 0 "[ . 1 .]" 1
837 1 97 TRP HE1 2 100 ALA HA 5.000 . 5.000 4.128 3.370 4.743 . 0 0 "[ . 1 .]" 1
838 1 97 TRP HZ2 2 120 LEU MD2 5.000 . 5.500 3.464 2.164 5.462 . 0 0 "[ . 1 .]" 1
839 1 97 TRP HZ3 2 120 LEU MD2 3.500 . 4.000 3.199 2.768 3.771 . 0 0 "[ . 1 .]" 1
840 1 97 TRP HE3 2 120 LEU MD2 3.500 . 4.000 4.012 3.614 4.157 0.157 14 0 "[ . 1 .]" 1
841 1 97 TRP HZ3 2 120 LEU MD1 5.000 . 5.500 3.801 3.196 4.602 . 0 0 "[ . 1 .]" 1
842 1 97 TRP HE3 2 120 LEU MD1 5.000 . 5.500 4.662 3.940 5.333 . 0 0 "[ . 1 .]" 1
843 1 97 TRP HZ2 2 124 LEU MD1 3.500 . 4.000 2.672 1.845 3.799 . 0 0 "[ . 1 .]" 1
844 1 97 TRP HH2 2 124 LEU MD1 5.000 . 5.500 3.474 2.674 5.030 . 0 0 "[ . 1 .]" 1
845 1 97 TRP HZ2 2 127 VAL MG2 3.500 . 4.000 3.378 3.096 3.824 . 0 0 "[ . 1 .]" 1
846 1 97 TRP HH2 2 127 VAL MG2 5.000 . 5.500 3.716 3.053 4.026 . 0 0 "[ . 1 .]" 1
847 1 98 ALA H 1 99 SER H 2.700 . 2.700 2.563 2.483 2.615 . 0 0 "[ . 1 .]" 1
848 1 98 ALA HA 1 101 PHE H 3.500 . 3.500 3.490 3.341 3.611 0.111 15 0 "[ . 1 .]" 1
849 1 98 ALA HA 1 101 PHE QB 5.000 . 5.300 2.204 1.707 2.806 0.093 10 0 "[ . 1 .]" 1
850 1 98 ALA HA 1 101 PHE QD 5.000 . 5.300 4.103 3.506 4.763 . 0 0 "[ . 1 .]" 1
851 1 98 ALA HA 1 103 LYS H 3.500 . 3.500 3.491 3.320 3.572 0.072 3 0 "[ . 1 .]" 1
852 1 98 ALA MB 1 103 LYS H 5.000 . 5.500 4.039 3.682 4.208 . 0 0 "[ . 1 .]" 1
853 1 98 ALA MB 1 103 LYS QB 5.000 . 5.800 2.829 2.343 3.489 . 0 0 "[ . 1 .]" 1
854 1 98 ALA MB 1 104 PRO HA 5.000 . 5.500 5.065 4.867 5.415 . 0 0 "[ . 1 .]" 1
855 1 98 ALA MB 1 105 ILE MD 2.700 . 3.700 1.881 1.719 2.248 0.081 11 0 "[ . 1 .]" 1
856 1 98 ALA MB 1 105 ILE QG 5.000 . 5.800 1.849 1.705 2.006 0.095 13 0 "[ . 1 .]" 1
857 1 98 ALA MB 1 124 LEU MD1 5.000 . 6.000 5.117 3.980 5.805 . 0 0 "[ . 1 .]" 1
858 1 98 ALA MB 1 130 VAL MG2 5.000 . 6.000 4.324 4.023 4.685 . 0 0 "[ . 1 .]" 1
859 1 98 ALA H 2 100 ALA MB 5.000 . 5.500 4.706 3.950 5.374 . 0 0 "[ . 1 .]" 1
860 1 99 SER H 1 100 ALA H 2.700 . 2.700 2.719 2.502 2.810 0.110 4 0 "[ . 1 .]" 1
861 1 99 SER H 1 105 ILE MD 5.000 . 5.500 2.959 2.259 3.582 . 0 0 "[ . 1 .]" 1
862 1 99 SER HA 1 105 ILE MD 3.500 . 4.000 2.973 2.635 3.276 . 0 0 "[ . 1 .]" 1
863 1 99 SER HA 1 124 LEU MD1 5.000 . 5.500 4.866 3.725 5.504 0.004 8 0 "[ . 1 .]" 1
864 1 99 SER HA 1 128 ALA MB 5.000 . 5.500 2.854 2.587 3.186 . 0 0 "[ . 1 .]" 1
865 1 99 SER QB 1 105 ILE MD 3.500 . 4.300 3.506 2.839 4.270 . 0 0 "[ . 1 .]" 1
866 1 99 SER QB 1 124 LEU MD1 3.500 . 4.300 3.101 2.239 3.958 . 0 0 "[ . 1 .]" 1
867 1 99 SER QB 1 128 ALA MB 3.500 . 4.300 3.311 2.657 4.202 . 0 0 "[ . 1 .]" 1
868 1 100 ALA H 1 101 PHE H 2.700 . 2.700 2.512 2.381 2.658 . 0 0 "[ . 1 .]" 1
869 1 100 ALA H 2 101 PHE QD 3.500 . 3.800 4.003 3.938 4.051 0.251 8 0 "[ . 1 .]" 1
870 1 100 ALA H 2 101 PHE QE 5.000 . 5.300 4.069 3.236 4.846 . 0 0 "[ . 1 .]" 1
871 1 100 ALA HA 2 101 PHE QE 5.000 . 5.300 2.580 1.711 3.394 0.089 6 0 "[ . 1 .]" 1
872 1 100 ALA MB 2 100 ALA HA 5.000 . 5.500 4.189 3.413 4.468 . 0 0 "[ . 1 .]" 1
873 1 100 ALA MB 2 100 ALA MB 3.500 . 4.500 1.880 1.698 2.184 0.102 6 0 "[ . 1 .]" 1
874 1 100 ALA MB 2 101 PHE HA 5.000 . 5.500 2.971 2.691 3.235 . 0 0 "[ . 1 .]" 1
875 1 100 ALA MB 2 101 PHE QD 2.700 . 3.500 1.739 1.689 1.775 0.111 11 0 "[ . 1 .]" 1
876 1 100 ALA MB 2 101 PHE QE 3.500 . 4.300 2.724 1.764 3.602 0.036 1 0 "[ . 1 .]" 1
877 1 101 PHE H 1 102 ASP H 2.700 . 2.700 2.421 2.138 2.733 0.033 1 0 "[ . 1 .]" 1
878 1 101 PHE H 1 103 LYS H 5.000 . 5.000 4.246 3.808 4.687 . 0 0 "[ . 1 .]" 1
879 1 101 PHE QB 1 103 LYS H 3.500 . 3.800 2.279 2.078 2.488 . 0 0 "[ . 1 .]" 1
880 1 101 PHE QD 1 103 LYS H 3.500 . 3.800 3.912 3.841 4.004 0.204 9 0 "[ . 1 .]" 1
881 1 101 PHE QD 1 103 LYS QE 5.000 . 5.600 3.605 1.972 5.328 . 0 0 "[ . 1 .]" 1
882 1 101 PHE QD 2 101 PHE QD 5.000 . 5.600 5.410 4.799 5.730 0.130 15 0 "[ . 1 .]" 1
883 1 102 ASP H 1 103 LYS H 2.700 . 2.700 2.667 2.231 2.821 0.121 2 0 "[ . 1 .]" 1
884 1 102 ASP HA 1 128 ALA MB 3.500 . 4.000 4.026 3.802 4.115 0.115 9 0 "[ . 1 .]" 1
885 1 102 ASP QB 1 128 ALA MB 5.000 . 5.800 5.426 4.922 5.609 . 0 0 "[ . 1 .]" 1
886 1 102 ASP QB 1 156 VAL MG1 5.000 . 5.800 5.209 3.784 5.801 0.001 12 0 "[ . 1 .]" 1
887 1 104 PRO HA 1 105 ILE H 2.700 . 2.700 2.271 2.204 2.353 . 0 0 "[ . 1 .]" 1
888 1 104 PRO HA 1 129 ALA MB 3.500 . 4.000 2.811 2.175 3.458 . 0 0 "[ . 1 .]" 1
889 1 104 PRO HA 1 130 VAL MG2 5.000 . 5.500 5.254 4.966 5.498 . 0 0 "[ . 1 .]" 1
890 1 104 PRO HA 1 152 VAL MG2 5.000 . 5.500 4.558 3.774 5.474 . 0 0 "[ . 1 .]" 1
891 1 104 PRO HA 1 156 VAL MG1 3.500 . 4.000 3.588 2.818 4.030 0.030 12 0 "[ . 1 .]" 1
892 1 104 PRO HA 1 156 VAL MG2 5.000 . 5.500 3.474 2.288 4.663 . 0 0 "[ . 1 .]" 1
893 1 105 ILE H 1 129 ALA MB 5.000 . 5.500 2.840 2.246 3.343 . 0 0 "[ . 1 .]" 1
894 1 105 ILE H 1 130 VAL HA 5.000 . 5.000 3.505 3.310 3.807 . 0 0 "[ . 1 .]" 1
895 1 105 ILE H 1 130 VAL MG1 5.000 . 5.500 5.093 4.691 5.314 . 0 0 "[ . 1 .]" 1
896 1 105 ILE H 1 130 VAL MG2 5.000 . 5.500 3.845 3.553 4.184 . 0 0 "[ . 1 .]" 1
897 1 105 ILE H 1 131 GLU H 5.000 . 5.000 4.294 4.010 4.543 . 0 0 "[ . 1 .]" 1
898 1 105 ILE H 1 152 VAL QG 5.000 . 5.500 3.163 2.310 3.971 . 0 0 "[ . 1 .]" 1
899 1 105 ILE HA 1 106 VAL H 2.700 . 2.700 2.201 2.132 2.290 . 0 0 "[ . 1 .]" 1
900 1 105 ILE HB 1 130 VAL MG1 5.000 . 5.500 3.402 2.944 3.719 . 0 0 "[ . 1 .]" 1
901 1 105 ILE HB 1 130 VAL MG2 5.000 . 5.500 1.973 1.755 2.479 0.045 13 0 "[ . 1 .]" 1
902 1 105 ILE HG12 1 106 VAL H 3.500 . 3.500 3.578 3.504 3.663 0.163 5 0 "[ . 1 .]" 1
903 1 105 ILE MG 1 106 VAL H 3.500 . 4.000 1.976 1.767 2.310 0.033 5 0 "[ . 1 .]" 1
904 1 105 ILE MG 1 106 VAL HA 5.000 . 5.500 2.875 2.749 3.061 . 0 0 "[ . 1 .]" 1
905 1 105 ILE MG 1 107 LEU H 5.000 . 5.500 3.394 3.067 3.686 . 0 0 "[ . 1 .]" 1
906 1 105 ILE MG 1 107 LEU MD2 3.500 . 4.500 2.807 2.068 3.452 . 0 0 "[ . 1 .]" 1
907 1 105 ILE MD 1 124 LEU MD1 5.000 . 6.000 3.661 2.060 3.932 . 0 0 "[ . 1 .]" 1
908 1 105 ILE MD 1 124 LEU MD2 5.000 . 6.000 2.095 1.699 4.249 0.101 3 0 "[ . 1 .]" 1
909 1 105 ILE MG 1 124 LEU MD1 5.000 . 6.000 4.636 2.911 4.943 . 0 0 "[ . 1 .]" 1
910 1 105 ILE MG 1 124 LEU MD2 5.000 . 6.000 2.982 2.385 5.223 . 0 0 "[ . 1 .]" 1
911 1 105 ILE MD 1 128 ALA MB 3.500 . 4.500 2.789 2.525 2.970 . 0 0 "[ . 1 .]" 1
912 1 105 ILE MD 1 128 ALA HA 5.000 . 5.500 5.376 4.981 5.527 0.027 10 0 "[ . 1 .]" 1
913 1 105 ILE MG 1 130 VAL HA 5.000 . 5.500 2.076 1.764 2.680 0.036 9 0 "[ . 1 .]" 1
914 1 105 ILE MD 1 130 VAL MG2 2.700 . 3.700 1.981 1.790 2.393 0.010 9 0 "[ . 1 .]" 1
915 1 105 ILE MD 1 130 VAL MG1 5.000 . 6.000 3.329 2.992 3.601 . 0 0 "[ . 1 .]" 1
916 1 105 ILE MG 1 130 VAL MG2 3.500 . 4.500 2.007 1.777 2.296 0.023 4 0 "[ . 1 .]" 1
917 1 105 ILE MG 1 130 VAL MG1 3.500 . 4.500 1.774 1.684 1.876 0.116 4 0 "[ . 1 .]" 1
918 1 105 ILE MG 1 131 GLU H 5.000 . 5.500 3.003 2.587 3.698 . 0 0 "[ . 1 .]" 1
919 1 106 VAL HA 1 107 LEU H 2.700 . 2.700 2.178 2.162 2.193 . 0 0 "[ . 1 .]" 1
920 1 106 VAL HA 1 130 VAL MG1 5.000 . 5.500 3.555 2.880 3.908 . 0 0 "[ . 1 .]" 1
921 1 106 VAL HA 1 131 GLU H 3.500 . 3.500 2.425 2.062 2.709 . 0 0 "[ . 1 .]" 1
922 1 106 VAL HA 1 133 VAL H 5.000 . 5.000 5.047 4.938 5.100 0.100 15 0 "[ . 1 .]" 1
923 1 106 VAL HA 1 152 VAL MG1 5.000 . 5.500 4.402 3.987 4.660 . 0 0 "[ . 1 .]" 1
924 1 106 VAL MG1 1 108 LEU MD2 5.000 . 6.000 4.356 3.682 5.225 . 0 0 "[ . 1 .]" 1
925 1 106 VAL MG1 1 108 LEU MD1 5.000 . 6.000 5.040 4.478 5.791 . 0 0 "[ . 1 .]" 1
926 1 106 VAL MG1 1 131 GLU QB 5.000 . 5.800 2.198 1.753 3.148 0.047 5 0 "[ . 1 .]" 1
927 1 106 VAL MG1 1 145 ILE HA 5.000 . 5.500 3.447 2.948 3.928 . 0 0 "[ . 1 .]" 1
928 1 106 VAL MG2 1 145 ILE MG 5.000 . 6.000 5.756 5.239 6.043 0.043 9 0 "[ . 1 .]" 1
929 1 106 VAL MG2 1 145 ILE MD 5.000 . 6.000 5.076 4.357 5.503 . 0 0 "[ . 1 .]" 1
930 1 106 VAL MG1 1 148 ALA MB 3.500 . 4.500 2.878 2.210 3.565 . 0 0 "[ . 1 .]" 1
931 1 106 VAL MG2 1 148 ALA MB 3.500 . 4.500 3.593 2.751 4.363 . 0 0 "[ . 1 .]" 1
932 1 106 VAL MG2 1 149 ILE HA 5.000 . 5.500 2.212 1.849 2.546 . 0 0 "[ . 1 .]" 1
933 1 106 VAL MG2 1 149 ILE MG 3.500 . 4.500 3.648 2.671 4.270 . 0 0 "[ . 1 .]" 1
934 1 106 VAL MG2 1 149 ILE MD 5.000 . 6.000 3.820 3.275 4.551 . 0 0 "[ . 1 .]" 1
935 1 106 VAL MG1 1 149 ILE MG 5.000 . 6.000 4.158 3.472 4.685 . 0 0 "[ . 1 .]" 1
936 1 106 VAL MG1 1 149 ILE MD 5.000 . 6.000 3.059 2.047 4.056 . 0 0 "[ . 1 .]" 1
937 1 106 VAL MG2 1 153 VAL HA 5.000 . 5.500 5.385 4.949 5.533 0.033 15 0 "[ . 1 .]" 1
938 1 107 LEU HA 1 108 LEU H 2.700 . 2.700 2.265 2.208 2.363 . 0 0 "[ . 1 .]" 1
939 1 107 LEU H 1 130 VAL MG1 3.500 . 4.000 3.412 2.797 3.871 . 0 0 "[ . 1 .]" 1
940 1 107 LEU H 1 131 GLU H 5.000 . 5.000 3.961 3.513 4.514 . 0 0 "[ . 1 .]" 1
941 1 107 LEU H 1 132 PHE HA 3.500 . 3.500 3.386 3.113 3.600 0.100 14 0 "[ . 1 .]" 1
942 1 107 LEU H 1 132 PHE QD 5.000 . 5.300 3.668 3.099 4.014 . 0 0 "[ . 1 .]" 1
943 1 107 LEU H 1 133 VAL H 5.000 . 5.000 3.604 3.382 3.836 . 0 0 "[ . 1 .]" 1
944 1 107 LEU H 1 133 VAL MG2 5.000 . 5.500 4.298 3.905 4.844 . 0 0 "[ . 1 .]" 1
945 1 107 LEU HB3 1 108 LEU H 2.700 . 2.700 2.685 2.452 2.792 0.092 8 0 "[ . 1 .]" 1
946 1 107 LEU QB 1 109 LEU MD1 5.000 . 5.800 4.417 3.911 4.851 . 0 0 "[ . 1 .]" 1
947 1 107 LEU MD1 1 109 LEU MD1 5.000 . 6.000 4.709 4.105 5.516 . 0 0 "[ . 1 .]" 1
948 1 107 LEU MD1 1 109 LEU MD2 5.000 . 6.000 3.104 2.524 3.920 . 0 0 "[ . 1 .]" 1
949 1 107 LEU MD2 1 109 LEU MD2 5.000 . 6.000 4.054 3.315 4.564 . 0 0 "[ . 1 .]" 1
950 1 107 LEU MD1 1 121 VAL HA 5.000 . 5.500 3.444 2.769 5.173 . 0 0 "[ . 1 .]" 1
951 1 107 LEU MD1 1 121 VAL MG1 3.500 . 4.500 2.681 1.808 4.344 . 0 0 "[ . 1 .]" 1
952 1 107 LEU MD2 1 121 VAL MG1 5.000 . 6.000 4.203 2.706 5.097 . 0 0 "[ . 1 .]" 1
953 1 107 LEU MD1 1 124 LEU MD1 5.000 . 6.000 4.671 3.623 5.550 . 0 0 "[ . 1 .]" 1
954 1 107 LEU MD1 1 124 LEU MD2 5.000 . 6.000 3.639 2.887 4.845 . 0 0 "[ . 1 .]" 1
955 1 107 LEU MD1 1 130 VAL MG1 3.500 . 4.500 2.242 1.710 3.296 0.090 5 0 "[ . 1 .]" 1
956 1 107 LEU MD2 1 130 VAL MG1 3.500 . 4.500 3.635 3.013 4.471 . 0 0 "[ . 1 .]" 1
957 1 107 LEU MD1 1 132 PHE QD 3.500 . 4.300 3.041 2.378 3.901 . 0 0 "[ . 1 .]" 1
958 1 107 LEU MD1 1 132 PHE QE 5.000 . 5.800 2.505 1.962 3.654 . 0 0 "[ . 1 .]" 1
959 1 108 LEU HA 1 109 LEU H 2.700 . 2.700 2.366 2.240 2.454 . 0 0 "[ . 1 .]" 1
960 1 108 LEU HA 1 133 VAL H 3.500 . 3.500 3.382 3.135 3.571 0.071 3 0 "[ . 1 .]" 1
961 1 108 LEU HA 1 133 VAL MG1 5.000 . 5.500 2.870 2.482 3.263 . 0 0 "[ . 1 .]" 1
962 1 108 LEU HA 1 133 VAL MG2 5.000 . 5.500 3.927 3.416 4.337 . 0 0 "[ . 1 .]" 1
963 1 108 LEU MD2 1 133 VAL H 5.000 . 5.500 4.327 3.824 4.968 . 0 0 "[ . 1 .]" 1
964 1 108 LEU MD2 1 133 VAL MG1 2.700 . 3.700 1.805 1.682 2.058 0.118 15 0 "[ . 1 .]" 1
965 1 108 LEU MD2 1 133 VAL MG2 2.700 . 3.700 3.327 2.409 3.803 0.103 2 0 "[ . 1 .]" 1
966 1 108 LEU MD1 1 133 VAL MG1 5.000 . 6.000 3.881 3.576 4.128 . 0 0 "[ . 1 .]" 1
967 1 108 LEU MD1 1 133 VAL MG2 5.000 . 6.000 5.051 4.620 5.568 . 0 0 "[ . 1 .]" 1
968 1 108 LEU MD2 1 133 VAL HB 3.500 . 4.000 2.516 1.925 3.148 . 0 0 "[ . 1 .]" 1
969 1 108 LEU MD2 1 134 HIS HA 5.000 . 5.500 4.675 3.931 5.324 . 0 0 "[ . 1 .]" 1
970 1 108 LEU MD1 1 135 TYR QD 3.500 . 4.300 3.881 3.449 4.371 0.071 3 0 "[ . 1 .]" 1
971 1 108 LEU MD1 1 135 TYR QE 3.500 . 4.300 3.617 2.483 4.208 . 0 0 "[ . 1 .]" 1
972 1 108 LEU MD2 1 135 TYR QD 3.500 . 4.300 2.823 1.974 3.755 . 0 0 "[ . 1 .]" 1
973 1 108 LEU MD2 1 135 TYR QE 3.500 . 4.300 3.821 2.462 4.354 0.054 14 0 "[ . 1 .]" 1
974 1 108 LEU MD2 1 138 ILE HA 5.000 . 5.500 4.767 4.229 5.416 . 0 0 "[ . 1 .]" 1
975 1 108 LEU MD1 1 138 ILE MD 3.500 . 4.500 2.893 2.148 3.722 . 0 0 "[ . 1 .]" 1
976 1 108 LEU MD2 1 138 ILE MD 3.500 . 4.500 3.611 3.049 4.491 . 0 0 "[ . 1 .]" 1
977 1 108 LEU MD2 1 138 ILE MG 5.000 . 6.000 5.366 4.494 5.728 . 0 0 "[ . 1 .]" 1
978 1 108 LEU MD2 1 141 ALA MB 3.500 . 4.500 1.948 1.713 2.603 0.087 9 0 "[ . 1 .]" 1
979 1 108 LEU MD2 1 141 ALA HA 5.000 . 5.500 3.277 2.600 4.060 . 0 0 "[ . 1 .]" 1
980 1 108 LEU MD2 1 144 GLN QG 3.500 . 4.300 4.163 3.656 4.348 0.048 11 0 "[ . 1 .]" 1
981 1 108 LEU MD1 1 145 ILE HA 5.000 . 5.500 5.330 4.775 5.530 0.030 15 0 "[ . 1 .]" 1
982 1 108 LEU MD2 1 145 ILE HA 5.000 . 5.500 3.759 3.108 4.877 . 0 0 "[ . 1 .]" 1
983 1 108 LEU MD1 1 145 ILE MD 2.700 . 3.700 2.077 1.804 2.603 . 0 0 "[ . 1 .]" 1
984 1 108 LEU MD2 1 145 ILE MD 3.500 . 4.500 2.591 1.857 3.358 . 0 0 "[ . 1 .]" 1
985 1 108 LEU MD1 1 145 ILE MG 5.000 . 6.000 3.508 2.913 3.921 . 0 0 "[ . 1 .]" 1
986 1 108 LEU MD2 1 145 ILE MG 5.000 . 6.000 3.522 2.315 5.031 . 0 0 "[ . 1 .]" 1
987 1 109 LEU H 1 133 VAL H 5.000 . 5.000 2.647 2.440 2.910 . 0 0 "[ . 1 .]" 1
988 1 109 LEU H 1 133 VAL MG1 5.000 . 5.500 3.956 3.585 4.145 . 0 0 "[ . 1 .]" 1
989 1 109 LEU H 1 134 HIS HA 5.000 . 5.000 3.650 3.270 4.114 . 0 0 "[ . 1 .]" 1
990 1 109 LEU H 1 135 TYR QD 5.000 . 5.300 3.996 3.677 4.390 . 0 0 "[ . 1 .]" 1
991 1 109 LEU H 1 135 TYR QE 5.000 . 5.300 5.017 4.582 5.286 . 0 0 "[ . 1 .]" 1
992 1 109 LEU HA 1 110 GLU H 2.700 . 2.700 2.194 2.133 2.276 . 0 0 "[ . 1 .]" 1
993 1 109 LEU HA 1 117 TYR QE 5.000 . 5.300 5.124 4.892 5.319 0.019 11 0 "[ . 1 .]" 1
994 1 109 LEU HA 1 135 TYR QE 5.000 . 5.300 4.810 4.129 5.436 0.136 8 0 "[ . 1 .]" 1
995 1 109 LEU MD1 1 110 GLU H 3.500 . 4.000 4.180 4.110 4.353 0.353 8 0 "[ . 1 .]" 1
996 1 109 LEU MD2 1 110 GLU H 3.500 . 4.000 3.216 2.999 3.552 . 0 0 "[ . 1 .]" 1
997 1 109 LEU MD1 1 114 GLU HA 5.000 . 5.500 3.600 3.186 3.852 . 0 0 "[ . 1 .]" 1
998 1 109 LEU MD1 1 114 GLU QB 5.000 . 5.800 1.747 1.682 1.869 0.118 3 0 "[ . 1 .]" 1
999 1 109 LEU MD1 1 114 GLU QG 3.500 . 4.300 1.798 1.701 1.974 0.099 10 0 "[ . 1 .]" 1
1000 1 109 LEU MD2 1 114 GLU QG 5.000 . 5.800 3.307 2.622 3.865 . 0 0 "[ . 1 .]" 1
1001 1 109 LEU MD1 1 117 TYR QD 5.000 . 5.800 4.814 4.403 5.021 . 0 0 "[ . 1 .]" 1
1002 1 109 LEU MD2 1 117 TYR QB 5.000 . 5.800 4.129 3.867 4.426 . 0 0 "[ . 1 .]" 1
1003 1 109 LEU MD2 1 117 TYR QD 3.500 . 4.300 4.184 3.828 4.388 0.088 1 0 "[ . 1 .]" 1
1004 1 109 LEU MD2 1 117 TYR QE 5.000 . 5.800 4.815 4.420 5.029 . 0 0 "[ . 1 .]" 1
1005 1 109 LEU MD2 1 121 VAL HB 5.000 . 5.500 4.521 4.048 4.924 . 0 0 "[ . 1 .]" 1
1006 1 109 LEU MD2 1 121 VAL MG2 5.000 . 6.000 3.333 2.742 3.772 . 0 0 "[ . 1 .]" 1
1007 1 109 LEU MD2 1 121 VAL MG1 3.500 . 4.500 2.300 2.049 2.553 . 0 0 "[ . 1 .]" 1
1008 1 109 LEU MD1 1 121 VAL MG1 3.500 . 4.500 2.904 2.353 3.222 . 0 0 "[ . 1 .]" 1
1009 1 109 LEU MD1 1 121 VAL MG2 5.000 . 6.000 4.538 3.728 5.123 . 0 0 "[ . 1 .]" 1
1010 1 109 LEU MD1 1 122 ARG HA 5.000 . 5.500 5.203 4.919 5.592 0.092 4 0 "[ . 1 .]" 1
1011 1 109 LEU MD1 1 122 ARG QB 5.000 . 5.800 5.561 5.006 5.787 . 0 0 "[ . 1 .]" 1
1012 1 109 LEU MD1 1 132 PHE QB 3.500 . 4.300 1.858 1.740 2.137 0.060 3 0 "[ . 1 .]" 1
1013 1 109 LEU MD1 1 132 PHE QD 3.500 . 4.300 3.010 2.547 3.246 . 0 0 "[ . 1 .]" 1
1014 1 109 LEU MD1 1 132 PHE QE 3.500 . 4.300 4.096 3.650 4.328 0.028 3 0 "[ . 1 .]" 1
1015 1 109 LEU MD1 1 132 PHE HZ 5.000 . 5.500 5.152 4.623 5.436 . 0 0 "[ . 1 .]" 1
1016 1 109 LEU MD2 1 132 PHE QD 5.000 . 5.800 2.375 1.973 2.911 . 0 0 "[ . 1 .]" 1
1017 1 109 LEU MD2 1 132 PHE QE 5.000 . 5.800 3.498 2.761 3.870 . 0 0 "[ . 1 .]" 1
1018 1 109 LEU MD2 1 132 PHE HZ 5.000 . 5.500 5.141 4.522 5.487 . 0 0 "[ . 1 .]" 1
1019 1 109 LEU MD1 1 133 VAL H 5.000 . 5.500 4.222 3.865 4.511 . 0 0 "[ . 1 .]" 1
1020 1 109 LEU MD1 1 134 HIS HA 5.000 . 5.500 3.910 3.303 4.395 . 0 0 "[ . 1 .]" 1
1021 1 109 LEU MD1 1 134 HIS HD2 5.000 . 5.500 3.153 2.012 3.749 . 0 0 "[ . 1 .]" 1
1022 1 109 LEU MD1 1 134 HIS HE1 3.500 . 4.000 2.825 2.215 3.700 . 0 0 "[ . 1 .]" 1
1023 1 109 LEU MD2 1 134 HIS HE1 5.000 . 5.500 5.173 4.192 5.571 0.071 15 0 "[ . 1 .]" 1
1024 1 109 LEU MD2 1 134 HIS HD2 5.000 . 5.500 5.094 4.000 5.516 0.016 3 0 "[ . 1 .]" 1
1025 1 109 LEU MD2 1 135 TYR QE 5.000 . 5.800 5.427 4.873 5.849 0.049 3 0 "[ . 1 .]" 1
1026 1 110 GLU HA 1 111 GLU H 2.700 . 2.700 2.572 2.285 2.752 0.052 4 0 "[ . 1 .]" 1
1027 1 110 GLU H 1 114 GLU H 5.000 . 5.000 2.444 2.124 2.934 . 0 0 "[ . 1 .]" 1
1028 1 110 GLU H 1 114 GLU HA 5.000 . 5.000 3.577 3.072 4.194 . 0 0 "[ . 1 .]" 1
1029 1 110 GLU H 1 117 TYR QD 5.000 . 5.300 4.475 4.242 4.724 . 0 0 "[ . 1 .]" 1
1030 1 110 GLU H 1 117 TYR QE 3.500 . 3.800 3.966 3.897 4.019 0.219 9 0 "[ . 1 .]" 1
1031 1 110 GLU H 1 135 TYR QE 5.000 . 5.300 4.647 3.778 5.474 0.174 3 0 "[ . 1 .]" 1
1032 1 110 GLU HA 1 135 TYR H 3.500 . 3.500 3.467 3.188 3.604 0.104 13 0 "[ . 1 .]" 1
1033 1 110 GLU HA 1 134 HIS HA 5.000 . 5.000 4.653 4.168 5.054 0.054 8 0 "[ . 1 .]" 1
1034 1 110 GLU HA 1 135 TYR QE 5.000 . 5.300 3.379 2.287 4.295 . 0 0 "[ . 1 .]" 1
1035 1 110 GLU HA 1 135 TYR QD 5.000 . 5.300 3.253 2.091 3.909 . 0 0 "[ . 1 .]" 1
1036 1 110 GLU QG 1 135 TYR QD 5.000 . 5.600 4.006 2.944 5.386 . 0 0 "[ . 1 .]" 1
1037 1 110 GLU QG 1 135 TYR QE 5.000 . 5.600 3.079 2.154 4.114 . 0 0 "[ . 1 .]" 1
1038 1 111 GLU H 1 112 GLY H 5.000 . 5.000 3.714 3.066 4.193 . 0 0 "[ . 1 .]" 1
1039 1 111 GLU H 1 135 TYR H 3.500 . 3.500 2.571 1.757 3.026 0.043 15 0 "[ . 1 .]" 1
1040 1 111 GLU H 1 135 TYR QD 5.000 . 5.300 4.210 3.573 4.945 . 0 0 "[ . 1 .]" 1
1041 1 111 GLU H 1 134 HIS HA 5.000 . 5.000 3.116 2.808 3.840 . 0 0 "[ . 1 .]" 1
1042 1 111 GLU HA 1 112 GLY H 3.500 . 3.500 2.392 2.140 2.915 . 0 0 "[ . 1 .]" 1
1043 1 111 GLU HA 1 134 HIS HA 5.000 . 5.000 4.291 3.869 4.674 . 0 0 "[ . 1 .]" 1
1044 1 111 GLU HA 1 134 HIS QB 3.500 . 3.800 3.566 3.099 3.883 0.083 11 0 "[ . 1 .]" 1
1045 1 111 GLU HA 1 134 HIS HD2 5.000 . 5.000 3.322 1.766 5.136 0.136 15 0 "[ . 1 .]" 1
1046 1 111 GLU QB 1 135 TYR H 3.500 . 3.800 3.721 3.277 3.936 0.136 6 0 "[ . 1 .]" 1
1047 1 111 GLU QG 1 112 GLY QA 5.000 . 5.600 5.231 4.824 5.408 . 0 0 "[ . 1 .]" 1
1048 1 111 GLU QG 1 134 HIS HA 3.500 . 3.800 3.635 2.870 3.918 0.118 1 0 "[ . 1 .]" 1
1049 1 111 GLU QG 1 134 HIS QB 3.500 . 4.100 2.098 1.743 2.500 0.057 1 0 "[ . 1 .]" 1
1050 1 111 GLU QG 1 134 HIS HD2 5.000 . 5.300 3.640 2.436 5.152 . 0 0 "[ . 1 .]" 1
1051 1 111 GLU QG 1 136 LYS QB 5.000 . 5.600 3.726 2.435 4.856 . 0 0 "[ . 1 .]" 1
1052 1 111 GLU QG 1 136 LYS QG 3.500 . 4.100 2.868 1.882 4.080 . 0 0 "[ . 1 .]" 1
1053 1 111 GLU QG 1 136 LYS QD 5.000 . 5.600 3.621 1.914 5.515 . 0 0 "[ . 1 .]" 1
1054 1 111 GLU QG 1 136 LYS QE 3.500 . 4.100 3.486 1.817 4.105 0.005 6 0 "[ . 1 .]" 1
1055 1 112 GLY H 1 113 ARG H 3.500 . 3.500 3.130 2.687 3.485 . 0 0 "[ . 1 .]" 1
1056 1 113 ARG H 1 114 GLU H 2.700 . 2.700 2.735 2.639 2.805 0.105 3 0 "[ . 1 .]" 1
1057 1 113 ARG HA 1 116 GLU H 3.500 . 3.500 3.057 2.757 3.321 . 0 0 "[ . 1 .]" 1
1058 1 113 ARG HA 1 116 GLU QB 5.000 . 5.300 2.356 1.807 2.762 . 0 0 "[ . 1 .]" 1
1059 1 113 ARG HA 1 116 GLU QG 3.500 . 3.800 3.275 2.767 3.845 0.045 3 0 "[ . 1 .]" 1
1060 1 114 GLU H 1 115 GLU H 2.700 . 2.700 2.782 2.739 2.817 0.117 14 0 "[ . 1 .]" 1
1061 1 114 GLU H 1 117 TYR QD 2.700 . 3.000 3.129 3.065 3.168 0.168 1 0 "[ . 1 .]" 1
1062 1 114 GLU HA 1 117 TYR H 3.500 . 3.500 3.344 3.070 3.505 0.005 13 0 "[ . 1 .]" 1
1063 1 114 GLU HA 1 117 TYR QD 3.500 . 3.800 1.610 1.479 1.686 0.321 9 0 "[ . 1 .]" 1
1064 1 114 GLU HA 1 117 TYR QE 5.000 . 5.300 3.218 3.020 3.473 . 0 0 "[ . 1 .]" 1
1065 1 114 GLU HA 1 121 VAL MG1 5.000 . 5.500 3.490 3.082 3.969 . 0 0 "[ . 1 .]" 1
1066 1 114 GLU QG 1 117 TYR QD 5.000 . 5.600 4.201 3.783 4.476 . 0 0 "[ . 1 .]" 1
1067 1 114 GLU QG 1 117 TYR QE 5.000 . 5.600 5.422 4.885 5.662 0.062 1 0 "[ . 1 .]" 1
1068 1 114 GLU QG 1 121 VAL MG1 5.000 . 5.800 4.290 2.397 5.161 . 0 0 "[ . 1 .]" 1
1069 1 114 GLU QG 1 122 ARG QD 5.000 . 5.600 5.057 3.782 5.625 0.025 5 0 "[ . 1 .]" 1
1070 1 114 GLU QG 1 134 HIS HE1 3.500 . 3.800 3.351 2.268 3.861 0.061 11 0 "[ . 1 .]" 1
1071 1 114 GLU HA 1 117 TYR HB2 2.700 . 2.700 2.697 2.278 2.841 0.141 13 0 "[ . 1 .]" 1
1072 1 115 GLU H 1 116 GLU H 2.700 . 2.700 2.615 2.381 2.774 0.074 9 0 "[ . 1 .]" 1
1073 1 115 GLU H 1 117 TYR QD 5.000 . 5.300 3.760 3.453 4.096 . 0 0 "[ . 1 .]" 1
1074 1 115 GLU HA 1 122 ARG QD 5.000 . 5.300 4.120 3.252 5.144 . 0 0 "[ . 1 .]" 1
1075 1 115 GLU QG 1 122 ARG QD 5.000 . 5.600 4.816 4.288 5.551 . 0 0 "[ . 1 .]" 1
1076 1 116 GLU H 1 117 TYR H 3.500 . 3.500 2.633 2.485 2.837 . 0 0 "[ . 1 .]" 1
1077 1 116 GLU H 1 117 TYR QD 3.500 . 3.800 3.609 3.388 3.801 0.001 9 0 "[ . 1 .]" 1
1078 1 117 TYR HA 1 117 TYR QD 3.500 . 3.800 2.749 2.657 2.832 . 0 0 "[ . 1 .]" 1
1079 1 117 TYR HA 1 117 TYR QE 3.500 . 3.800 4.352 4.290 4.400 0.600 5 14 "[****+****- ****]" 1
1080 1 117 TYR QB 1 120 LEU H 3.500 . 3.800 4.122 4.035 4.187 0.387 13 0 "[ . 1 .]" 1
1081 1 117 TYR QB 1 121 VAL MG1 3.500 . 4.300 2.736 2.229 3.208 . 0 0 "[ . 1 .]" 1
1082 1 117 TYR QB 1 121 VAL MG2 3.500 . 4.300 2.021 1.752 3.017 0.048 14 0 "[ . 1 .]" 1
1083 1 117 TYR QE 1 121 VAL MG2 5.000 . 5.800 3.826 3.461 4.344 . 0 0 "[ . 1 .]" 1
1084 1 117 TYR QE 1 121 VAL MG1 5.000 . 5.800 5.255 4.926 5.599 . 0 0 "[ . 1 .]" 1
1085 1 117 TYR QD 1 121 VAL MG1 3.500 . 4.300 3.981 3.648 4.329 0.029 6 0 "[ . 1 .]" 1
1086 1 117 TYR QD 1 121 VAL MG2 3.500 . 4.300 2.515 2.028 3.338 . 0 0 "[ . 1 .]" 1
1087 1 117 TYR HA 1 121 VAL H 5.000 . 5.000 4.566 4.377 4.778 . 0 0 "[ . 1 .]" 1
1088 1 117 TYR QB 1 121 VAL H 5.000 . 5.300 2.836 2.642 3.018 . 0 0 "[ . 1 .]" 1
1089 1 117 TYR H 1 117 TYR HB2 2.700 . 2.700 2.474 2.341 2.606 . 0 0 "[ . 1 .]" 1
1090 1 118 GLY QA 1 121 VAL MG2 5.000 . 5.800 4.820 4.434 5.183 . 0 0 "[ . 1 .]" 1
1091 1 119 PHE HA 1 122 ARG H 5.000 . 5.000 5.013 4.898 5.077 0.077 3 0 "[ . 1 .]" 1
1092 1 120 LEU H 1 121 VAL H 3.500 . 3.500 2.374 2.224 2.670 . 0 0 "[ . 1 .]" 1
1093 1 120 LEU HA 1 123 GLY H 5.000 . 5.000 3.272 3.081 3.802 . 0 0 "[ . 1 .]" 1
1094 1 120 LEU HA 1 124 LEU MD1 5.000 . 5.500 3.389 2.826 5.366 . 0 0 "[ . 1 .]" 1
1095 1 120 LEU MD2 1 127 VAL MG2 5.000 . 6.000 4.394 3.887 5.622 . 0 0 "[ . 1 .]" 1
1096 1 120 LEU MD1 1 127 VAL MG2 5.000 . 6.000 5.622 4.174 6.147 0.147 12 0 "[ . 1 .]" 1
1097 1 121 VAL H 1 122 ARG H 2.700 . 2.700 2.698 2.616 2.816 0.116 6 0 "[ . 1 .]" 1
1098 1 121 VAL HA 1 124 LEU H 3.500 . 3.500 3.618 3.504 3.704 0.204 15 0 "[ . 1 .]" 1
1099 1 121 VAL HA 1 124 LEU MD1 3.500 . 4.000 3.584 2.793 4.192 0.192 14 0 "[ . 1 .]" 1
1100 1 121 VAL MG1 1 132 PHE QE 3.500 . 4.300 2.018 1.818 2.391 . 0 0 "[ . 1 .]" 1
1101 1 121 VAL MG1 1 132 PHE HZ 3.500 . 4.000 2.791 2.070 3.365 . 0 0 "[ . 1 .]" 1
1102 1 122 ARG H 1 123 GLY H 3.500 . 3.500 2.614 2.450 2.728 . 0 0 "[ . 1 .]" 1
1103 1 122 ARG HA 1 125 GLY H 5.000 . 5.000 3.092 2.916 3.278 . 0 0 "[ . 1 .]" 1
1104 1 122 ARG HA 1 132 PHE QE 3.500 . 3.800 2.445 1.978 2.805 . 0 0 "[ . 1 .]" 1
1105 1 122 ARG HA 1 132 PHE HZ 3.500 . 3.500 2.257 1.897 2.719 . 0 0 "[ . 1 .]" 1
1106 1 123 GLY H 1 124 LEU H 3.500 . 3.500 2.722 2.606 2.868 . 0 0 "[ . 1 .]" 1
1107 1 123 GLY QA 1 126 THR H 5.000 . 5.300 3.509 3.314 3.782 . 0 0 "[ . 1 .]" 1
1108 1 123 GLY QA 1 126 THR MG 3.500 . 4.300 1.952 1.767 2.260 0.033 5 0 "[ . 1 .]" 1
1109 1 123 GLY QA 1 127 VAL MG2 5.000 . 5.800 3.577 3.428 3.786 . 0 0 "[ . 1 .]" 1
1110 1 124 LEU H 1 125 GLY H 2.700 . 2.700 2.451 2.341 2.579 . 0 0 "[ . 1 .]" 1
1111 1 124 LEU H 1 132 PHE HZ 3.500 . 3.500 3.528 3.309 3.662 0.162 6 0 "[ . 1 .]" 1
1112 1 124 LEU HA 1 126 THR MG 5.000 . 5.500 3.847 3.568 4.181 . 0 0 "[ . 1 .]" 1
1113 1 124 LEU HA 1 127 VAL H 3.500 . 3.500 3.064 2.790 3.250 . 0 0 "[ . 1 .]" 1
1114 1 124 LEU HA 1 128 ALA H 3.500 . 3.500 2.972 2.720 3.290 . 0 0 "[ . 1 .]" 1
1115 1 124 LEU HA 1 127 VAL MG1 5.000 . 5.500 3.717 3.426 3.970 . 0 0 "[ . 1 .]" 1
1116 1 124 LEU HA 1 127 VAL MG2 3.500 . 4.000 1.724 1.641 1.769 0.159 11 0 "[ . 1 .]" 1
1117 1 124 LEU HA 1 128 ALA MB 5.000 . 5.500 3.798 3.409 4.302 . 0 0 "[ . 1 .]" 1
1118 1 124 LEU QB 1 130 VAL MG2 5.000 . 5.800 1.816 1.734 1.969 0.066 7 0 "[ . 1 .]" 1
1119 1 124 LEU MD1 1 127 VAL H 5.000 . 5.500 5.143 4.173 5.564 0.064 3 0 "[ . 1 .]" 1
1120 1 124 LEU MD1 1 127 VAL MG2 3.500 . 4.500 3.019 2.103 3.564 . 0 0 "[ . 1 .]" 1
1121 1 124 LEU MD2 1 127 VAL MG2 5.000 . 6.000 3.614 2.294 4.246 . 0 0 "[ . 1 .]" 1
1122 1 124 LEU MD1 1 128 ALA MB 5.000 . 6.000 4.217 3.130 4.548 . 0 0 "[ . 1 .]" 1
1123 1 124 LEU MD2 1 128 ALA MB 5.000 . 6.000 3.203 2.250 5.728 . 0 0 "[ . 1 .]" 1
1124 1 124 LEU MD1 1 130 VAL MG2 3.500 . 4.500 3.524 1.764 3.902 0.036 14 0 "[ . 1 .]" 1
1125 1 124 LEU MD2 1 130 VAL MG2 5.000 . 6.000 2.162 1.740 3.698 0.060 12 0 "[ . 1 .]" 1
1126 1 124 LEU MD2 1 130 VAL MG1 5.000 . 6.000 2.957 2.110 4.410 . 0 0 "[ . 1 .]" 1
1127 1 124 LEU MD1 1 130 VAL MG1 3.500 . 4.500 4.207 3.085 4.508 0.008 6 0 "[ . 1 .]" 1
1128 1 124 LEU MD2 1 132 PHE HZ 5.000 . 5.500 5.143 4.362 5.519 0.019 11 0 "[ . 1 .]" 1
1129 1 124 LEU MD2 1 132 PHE QE 5.000 . 5.800 4.756 3.621 5.390 . 0 0 "[ . 1 .]" 1
1130 1 125 GLY H 1 126 THR H 2.700 . 2.700 2.630 2.535 2.768 0.068 15 0 "[ . 1 .]" 1
1131 1 125 GLY H 1 128 ALA H 5.000 . 5.000 4.942 4.748 5.084 0.084 2 0 "[ . 1 .]" 1
1132 1 125 GLY H 1 126 THR MG 3.500 . 4.000 3.859 3.462 4.073 0.073 2 0 "[ . 1 .]" 1
1133 1 125 GLY H 1 130 VAL MG2 3.500 . 4.000 3.615 3.292 3.823 . 0 0 "[ . 1 .]" 1
1134 1 125 GLY H 1 130 VAL MG1 3.500 . 4.000 3.184 2.832 3.635 . 0 0 "[ . 1 .]" 1
1135 1 125 GLY H 1 132 PHE HZ 3.500 . 3.500 1.905 1.719 2.489 0.081 11 0 "[ . 1 .]" 1
1136 1 125 GLY H 1 132 PHE QE 3.500 . 3.800 3.166 2.835 3.425 . 0 0 "[ . 1 .]" 1
1137 1 125 GLY QA 1 126 THR MG 5.000 . 5.800 4.217 3.889 4.383 . 0 0 "[ . 1 .]" 1
1138 1 125 GLY QA 1 130 VAL MG1 5.000 . 5.800 2.773 2.499 3.029 . 0 0 "[ . 1 .]" 1
1139 1 125 GLY QA 1 130 VAL MG2 3.500 . 4.300 2.999 2.652 3.299 . 0 0 "[ . 1 .]" 1
1140 1 126 THR H 1 127 VAL H 2.700 . 2.700 2.309 2.206 2.401 . 0 0 "[ . 1 .]" 1
1141 1 126 THR MG 1 127 VAL HA 5.000 . 5.500 3.368 3.188 3.784 . 0 0 "[ . 1 .]" 1
1142 1 126 THR MG 1 127 VAL MG1 3.500 . 4.500 2.065 1.921 2.528 . 0 0 "[ . 1 .]" 1
1143 1 127 VAL H 1 128 ALA H 2.700 . 2.700 2.583 2.353 2.763 0.063 13 0 "[ . 1 .]" 1
1144 1 127 VAL H 1 130 VAL MG2 5.000 . 5.500 4.456 4.027 4.854 . 0 0 "[ . 1 .]" 1
1145 1 127 VAL MG2 1 130 VAL MG2 5.000 . 6.000 3.370 2.969 3.658 . 0 0 "[ . 1 .]" 1
1146 1 128 ALA H 1 130 VAL MG2 3.500 . 4.000 3.058 2.645 3.457 . 0 0 "[ . 1 .]" 1
1147 1 128 ALA H 1 130 VAL MG1 5.000 . 5.500 5.370 5.016 5.613 0.113 11 0 "[ . 1 .]" 1
1148 1 128 ALA HA 1 129 ALA H 2.700 . 2.700 2.331 2.241 2.481 . 0 0 "[ . 1 .]" 1
1149 1 128 ALA HA 1 156 VAL MG1 5.000 . 5.500 5.529 5.305 5.615 0.115 3 0 "[ . 1 .]" 1
1150 1 128 ALA HA 1 156 VAL MG2 5.000 . 5.500 5.487 5.177 5.598 0.098 8 0 "[ . 1 .]" 1
1151 1 128 ALA MB 1 130 VAL MG1 5.000 . 6.000 4.728 4.521 4.931 . 0 0 "[ . 1 .]" 1
1152 1 128 ALA MB 1 130 VAL MG2 2.700 . 3.700 2.484 2.256 2.691 . 0 0 "[ . 1 .]" 1
1153 1 129 ALA HA 1 130 VAL H 2.700 . 2.700 2.310 2.194 2.436 . 0 0 "[ . 1 .]" 1
1154 1 129 ALA HA 1 130 VAL MG2 5.000 . 5.500 4.110 3.834 4.534 . 0 0 "[ . 1 .]" 1
1155 1 129 ALA HA 1 156 VAL MG2 5.000 . 5.500 3.546 2.651 4.027 . 0 0 "[ . 1 .]" 1
1156 1 129 ALA MB 1 152 VAL HA 5.000 . 5.500 4.135 3.081 5.346 . 0 0 "[ . 1 .]" 1
1157 1 129 ALA MB 1 152 VAL MG2 3.500 . 4.500 2.405 1.818 3.236 . 0 0 "[ . 1 .]" 1
1158 1 129 ALA MB 1 155 ARG QG 3.500 . 4.300 3.598 2.559 4.320 0.020 7 0 "[ . 1 .]" 1
1159 1 129 ALA MB 1 155 ARG QD 3.500 . 4.300 3.147 1.859 4.302 0.002 7 0 "[ . 1 .]" 1
1160 1 129 ALA MB 1 156 VAL HA 5.000 . 5.500 4.044 3.022 4.582 . 0 0 "[ . 1 .]" 1
1161 1 129 ALA MB 1 156 VAL MG2 2.700 . 3.700 1.694 1.609 1.769 0.191 15 0 "[ . 1 .]" 1
1162 1 129 ALA MB 1 156 VAL MG1 3.500 . 4.500 2.577 1.782 3.059 0.018 1 0 "[ . 1 .]" 1
1163 1 130 VAL HA 1 131 GLU H 2.700 . 2.700 2.195 2.157 2.246 . 0 0 "[ . 1 .]" 1
1164 1 130 VAL HA 1 152 VAL MG2 5.000 . 5.500 3.679 2.879 4.402 . 0 0 "[ . 1 .]" 1
1165 1 130 VAL MG1 1 131 GLU H 2.700 . 3.200 3.117 2.842 3.263 0.063 9 0 "[ . 1 .]" 1
1166 1 130 VAL MG1 1 132 PHE QD 3.500 . 4.300 3.057 2.617 3.356 . 0 0 "[ . 1 .]" 1
1167 1 130 VAL MG1 1 132 PHE QE 3.500 . 4.300 1.962 1.764 2.284 0.036 14 0 "[ . 1 .]" 1
1168 1 130 VAL MG1 1 132 PHE HZ 3.500 . 4.000 2.774 2.319 3.284 . 0 0 "[ . 1 .]" 1
1169 1 131 GLU HA 1 132 PHE H 2.700 . 2.700 2.166 2.117 2.268 . 0 0 "[ . 1 .]" 1
1170 1 131 GLU HA 1 148 ALA MB 5.000 . 5.500 4.313 3.799 5.182 . 0 0 "[ . 1 .]" 1
1171 1 131 GLU QB 1 152 VAL MG2 3.500 . 4.300 2.322 1.755 3.502 0.045 13 0 "[ . 1 .]" 1
1172 1 131 GLU QG 1 152 VAL MG2 5.000 . 5.800 2.598 1.783 4.290 0.017 10 0 "[ . 1 .]" 1
1173 1 131 GLU QB 1 152 VAL MG1 5.000 . 5.800 3.044 1.820 3.834 . 0 0 "[ . 1 .]" 1
1174 1 132 PHE HA 1 133 VAL H 2.700 . 2.700 2.181 2.112 2.254 . 0 0 "[ . 1 .]" 1
1175 1 132 PHE HA 1 133 VAL MG2 3.500 . 4.000 4.050 3.947 4.121 0.121 1 0 "[ . 1 .]" 1
1176 1 132 PHE QD 1 133 VAL H 3.500 . 3.800 3.732 3.503 3.851 0.051 14 0 "[ . 1 .]" 1
1177 1 133 VAL HA 1 134 HIS H 2.700 . 2.700 2.212 2.162 2.296 . 0 0 "[ . 1 .]" 1
1178 1 133 VAL MG1 1 134 HIS H 2.700 . 3.200 3.160 2.909 3.319 0.119 11 0 "[ . 1 .]" 1
1179 1 133 VAL MG1 1 135 TYR HA 5.000 . 5.500 3.946 3.537 4.434 . 0 0 "[ . 1 .]" 1
1180 1 133 VAL MG1 1 135 TYR QD 3.500 . 4.300 3.983 3.474 4.462 0.162 3 0 "[ . 1 .]" 1
1181 1 133 VAL MG1 1 135 TYR QE 5.000 . 5.800 5.418 4.829 5.882 0.082 1 0 "[ . 1 .]" 1
1182 1 133 VAL MG1 1 141 ALA HA 5.000 . 5.500 3.161 2.645 3.610 . 0 0 "[ . 1 .]" 1
1183 1 133 VAL MG1 1 144 GLN H 5.000 . 5.500 4.422 4.022 4.789 . 0 0 "[ . 1 .]" 1
1184 1 133 VAL MG2 1 144 GLN H 5.000 . 5.500 5.477 4.918 5.638 0.138 5 0 "[ . 1 .]" 1
1185 1 133 VAL MG1 1 144 GLN HA 5.000 . 5.500 4.295 3.592 4.702 . 0 0 "[ . 1 .]" 1
1186 1 133 VAL MG2 1 144 GLN HA 5.000 . 5.500 4.507 3.830 4.847 . 0 0 "[ . 1 .]" 1
1187 1 133 VAL MG1 1 144 GLN QG 2.700 . 3.500 1.882 1.742 2.460 0.058 15 0 "[ . 1 .]" 1
1188 1 133 VAL MG2 1 144 GLN QG 2.700 . 3.500 2.571 1.990 3.434 . 0 0 "[ . 1 .]" 1
1189 1 133 VAL MG2 1 144 GLN QB 3.500 . 4.300 3.804 2.308 4.224 . 0 0 "[ . 1 .]" 1
1190 1 133 VAL MG1 1 145 ILE H 5.000 . 5.500 3.016 2.412 3.365 . 0 0 "[ . 1 .]" 1
1191 1 133 VAL MG1 1 145 ILE HA 5.000 . 5.500 2.673 2.305 3.385 . 0 0 "[ . 1 .]" 1
1192 1 133 VAL MG2 1 145 ILE HA 3.500 . 4.000 1.923 1.776 2.383 0.024 3 0 "[ . 1 .]" 1
1193 1 133 VAL MG2 1 145 ILE MD 3.500 . 4.500 3.940 3.232 4.413 . 0 0 "[ . 1 .]" 1
1194 1 133 VAL MG2 1 148 ALA MB 3.500 . 4.500 2.007 1.673 2.628 0.127 6 0 "[ . 1 .]" 1
1195 1 134 HIS HA 1 135 TYR H 2.700 . 2.700 2.218 2.121 2.339 . 0 0 "[ . 1 .]" 1
1196 1 134 HIS HA 1 135 TYR QD 5.000 . 5.300 3.923 3.179 4.704 . 0 0 "[ . 1 .]" 1
1197 1 135 TYR HA 1 141 ALA MB 3.500 . 4.000 3.448 2.810 3.908 . 0 0 "[ . 1 .]" 1
1198 1 135 TYR HA 1 138 ILE MD 5.000 . 5.500 5.430 5.102 5.543 0.043 4 0 "[ . 1 .]" 1
1199 1 135 TYR QB 1 141 ALA MB 3.500 . 4.300 2.495 1.721 4.395 0.095 3 0 "[ . 1 .]" 1
1200 1 135 TYR QD 1 136 LYS HA 5.000 . 5.300 3.825 3.334 4.596 . 0 0 "[ . 1 .]" 1
1201 1 135 TYR QE 1 136 LYS HA 5.000 . 5.300 5.017 4.134 5.529 0.229 8 0 "[ . 1 .]" 1
1202 1 135 TYR QD 1 137 ASP HA 5.000 . 5.300 4.287 3.249 5.285 . 0 0 "[ . 1 .]" 1
1203 1 135 TYR QD 1 138 ILE HA 5.000 . 5.300 3.774 2.905 4.701 . 0 0 "[ . 1 .]" 1
1204 1 135 TYR QD 1 138 ILE MD 3.500 . 4.300 3.077 1.960 4.049 . 0 0 "[ . 1 .]" 1
1205 1 135 TYR QE 1 138 ILE MD 3.500 . 4.300 2.925 1.892 4.248 . 0 0 "[ . 1 .]" 1
1206 1 135 TYR QD 1 141 ALA HA 5.000 . 5.300 5.088 4.367 5.422 0.122 15 0 "[ . 1 .]" 1
1207 1 135 TYR QD 1 141 ALA MB 3.500 . 4.300 2.974 2.224 3.535 . 0 0 "[ . 1 .]" 1
1208 1 135 TYR QE 1 141 ALA MB 5.000 . 5.800 3.996 2.752 5.026 . 0 0 "[ . 1 .]" 1
1209 1 136 LYS QB 1 137 ASP QB 5.000 . 5.600 3.704 3.259 4.553 . 0 0 "[ . 1 .]" 1
1210 1 136 LYS QB 1 140 LEU MD1 5.000 . 5.800 4.485 2.623 5.737 . 0 0 "[ . 1 .]" 1
1211 1 136 LYS QB 1 140 LEU MD2 5.000 . 5.800 5.194 4.221 5.825 0.025 13 0 "[ . 1 .]" 1
1212 1 136 LYS QE 1 140 LEU MD1 5.000 . 5.800 5.166 4.305 5.810 0.010 1 0 "[ . 1 .]" 1
1213 1 137 ASP HA 1 138 ILE H 2.700 . 2.700 2.214 2.141 2.340 . 0 0 "[ . 1 .]" 1
1214 1 137 ASP QB 1 139 ALA H 3.500 . 3.800 3.422 2.780 3.819 0.019 14 0 "[ . 1 .]" 1
1215 1 137 ASP QB 1 139 ALA MB 5.000 . 5.800 3.333 2.631 3.850 . 0 0 "[ . 1 .]" 1
1216 1 137 ASP QB 1 140 LEU MD1 2.700 . 3.500 2.522 1.892 3.303 . 0 0 "[ . 1 .]" 1
1217 1 137 ASP QB 1 140 LEU MD2 3.500 . 4.300 3.660 1.863 4.317 0.017 10 0 "[ . 1 .]" 1
1218 1 138 ILE H 1 139 ALA H 2.700 . 2.700 2.723 2.563 2.813 0.113 1 0 "[ . 1 .]" 1
1219 1 138 ILE MG 1 139 ALA H 2.700 . 3.200 2.974 2.648 3.255 0.055 1 0 "[ . 1 .]" 1
1220 1 138 ILE MG 1 139 ALA HA 5.000 . 5.500 3.059 2.760 3.297 . 0 0 "[ . 1 .]" 1
1221 1 138 ILE MG 1 139 ALA MB 5.000 . 6.000 3.751 3.479 4.023 . 0 0 "[ . 1 .]" 1
1222 1 138 ILE HA 1 141 ALA MB 3.500 . 4.000 1.977 1.753 2.207 0.047 7 0 "[ . 1 .]" 1
1223 1 138 ILE HA 1 141 ALA H 5.000 . 5.000 2.747 2.600 2.968 . 0 0 "[ . 1 .]" 1
1224 1 138 ILE MD 1 141 ALA H 5.000 . 5.500 3.778 3.511 4.194 . 0 0 "[ . 1 .]" 1
1225 1 138 ILE MD 1 141 ALA MB 3.500 . 4.500 2.135 1.786 2.520 0.014 5 0 "[ . 1 .]" 1
1226 1 138 ILE MG 1 141 ALA MB 3.500 . 4.500 3.344 2.846 3.570 . 0 0 "[ . 1 .]" 1
1227 1 138 ILE MG 1 141 ALA H 3.500 . 4.000 4.003 3.896 4.068 0.068 11 0 "[ . 1 .]" 1
1228 1 138 ILE MG 1 142 LYS H 3.500 . 4.000 3.423 2.512 3.744 . 0 0 "[ . 1 .]" 1
1229 1 138 ILE MG 1 142 LYS QE 5.000 . 5.800 3.363 2.541 3.993 . 0 0 "[ . 1 .]" 1
1230 1 138 ILE MD 1 142 LYS QE 5.000 . 5.800 5.358 4.536 5.665 . 0 0 "[ . 1 .]" 1
1231 1 138 ILE MD 1 145 ILE MD 5.000 . 6.000 4.727 3.985 5.209 . 0 0 "[ . 1 .]" 1
1232 1 138 ILE MD 1 145 ILE MG 5.000 . 6.000 4.991 4.260 6.022 0.022 11 0 "[ . 1 .]" 1
1233 1 139 ALA H 1 140 LEU H 2.700 . 2.700 2.715 2.589 2.786 0.086 2 0 "[ . 1 .]" 1
1234 1 139 ALA H 1 141 ALA H 5.000 . 5.000 4.032 3.677 4.317 . 0 0 "[ . 1 .]" 1
1235 1 139 ALA HA 1 142 LYS H 5.000 . 5.000 4.163 3.625 4.560 . 0 0 "[ . 1 .]" 1
1236 1 139 ALA HA 1 142 LYS QE 3.500 . 3.800 3.390 2.461 3.810 0.010 8 0 "[ . 1 .]" 1
1237 1 139 ALA HA 1 142 LYS QD 3.500 . 3.800 2.441 1.799 3.819 0.019 4 0 "[ . 1 .]" 1
1238 1 139 ALA MB 1 140 LEU MD2 5.000 . 6.000 4.456 2.873 5.719 . 0 0 "[ . 1 .]" 1
1239 1 139 ALA MB 1 140 LEU MD1 5.000 . 6.000 3.840 2.301 5.331 . 0 0 "[ . 1 .]" 1
1240 1 140 LEU H 1 141 ALA H 2.700 . 2.700 2.002 1.788 2.258 0.012 8 0 "[ . 1 .]" 1
1241 1 140 LEU H 1 142 LYS H 5.000 . 5.000 3.660 3.231 4.211 . 0 0 "[ . 1 .]" 1
1242 1 140 LEU HA 1 141 ALA H 3.500 . 3.500 3.486 3.393 3.546 0.046 13 0 "[ . 1 .]" 1
1243 1 140 LEU MD2 1 143 PRO QD 5.000 . 5.800 4.445 3.802 5.304 . 0 0 "[ . 1 .]" 1
1244 1 141 ALA H 1 142 LYS H 2.700 . 2.700 2.601 2.352 2.756 0.056 6 0 "[ . 1 .]" 1
1245 1 141 ALA HA 1 144 GLN H 3.500 . 3.500 3.443 3.158 3.558 0.058 15 0 "[ . 1 .]" 1
1246 1 141 ALA HA 1 145 ILE H 5.000 . 5.000 3.469 2.967 4.032 . 0 0 "[ . 1 .]" 1
1247 1 141 ALA HA 1 144 GLN QB 3.500 . 3.800 2.336 2.186 2.604 . 0 0 "[ . 1 .]" 1
1248 1 141 ALA HA 1 144 GLN QG 3.500 . 3.800 3.752 3.304 3.897 0.097 10 0 "[ . 1 .]" 1
1249 1 141 ALA HA 1 145 ILE MD 5.000 . 5.500 5.302 4.933 5.608 0.108 9 0 "[ . 1 .]" 1
1250 1 141 ALA MB 1 145 ILE MD 5.000 . 6.000 3.847 3.583 4.217 . 0 0 "[ . 1 .]" 1
1251 1 142 LYS H 1 144 GLN H 5.000 . 5.000 4.031 3.687 4.434 . 0 0 "[ . 1 .]" 1
1252 1 142 LYS H 1 143 PRO QD 3.500 . 3.800 2.096 1.828 2.472 . 0 0 "[ . 1 .]" 1
1253 1 142 LYS HA 1 145 ILE H 5.000 . 5.000 3.856 3.513 4.384 . 0 0 "[ . 1 .]" 1
1254 1 142 LYS HA 1 146 ASP H 5.000 . 5.000 4.192 3.990 4.399 . 0 0 "[ . 1 .]" 1
1255 1 142 LYS HA 1 145 ILE MD 3.500 . 4.000 3.927 3.620 4.046 0.046 5 0 "[ . 1 .]" 1
1256 1 142 LYS HA 1 145 ILE MG 5.000 . 5.500 2.105 1.826 2.690 . 0 0 "[ . 1 .]" 1
1257 1 143 PRO HA 1 144 GLN H 3.500 . 3.500 3.541 3.499 3.567 0.067 13 0 "[ . 1 .]" 1
1258 1 143 PRO HA 1 146 ASP H 3.500 . 3.500 3.436 3.332 3.536 0.036 2 0 "[ . 1 .]" 1
1259 1 143 PRO HA 1 147 ALA H 5.000 . 5.000 3.966 3.659 4.241 . 0 0 "[ . 1 .]" 1
1260 1 143 PRO HA 1 146 ASP QB 3.500 . 3.800 2.480 2.172 2.794 . 0 0 "[ . 1 .]" 1
1261 1 144 GLN H 1 145 ILE H 2.700 . 2.700 2.560 2.274 2.735 0.035 1 0 "[ . 1 .]" 1
1262 1 144 GLN H 1 146 ASP H 5.000 . 5.000 3.825 3.500 4.011 . 0 0 "[ . 1 .]" 1
1263 1 144 GLN HA 1 145 ILE H 3.500 . 3.500 3.525 3.489 3.541 0.041 4 0 "[ . 1 .]" 1
1264 1 144 GLN HA 1 147 ALA H 3.500 . 3.500 3.522 3.430 3.607 0.107 14 0 "[ . 1 .]" 1
1265 1 144 GLN HA 1 148 ALA H 5.000 . 5.000 3.912 3.540 4.150 . 0 0 "[ . 1 .]" 1
1266 1 144 GLN HA 1 147 ALA MB 3.500 . 4.000 2.865 2.484 3.210 . 0 0 "[ . 1 .]" 1
1267 1 145 ILE H 1 146 ASP H 2.700 . 2.700 2.517 2.332 2.637 . 0 0 "[ . 1 .]" 1
1268 1 145 ILE H 1 147 ALA H 5.000 . 5.000 4.173 3.755 4.473 . 0 0 "[ . 1 .]" 1
1269 1 145 ILE HA 1 148 ALA H 5.000 . 5.000 3.672 3.488 3.900 . 0 0 "[ . 1 .]" 1
1270 1 145 ILE HA 1 148 ALA MB 3.500 . 4.000 2.780 2.414 3.255 . 0 0 "[ . 1 .]" 1
1271 1 145 ILE MG 1 149 ILE MD 2.700 . 3.700 2.546 1.864 3.319 . 0 0 "[ . 1 .]" 1
1272 1 145 ILE MD 1 149 ILE MD 3.500 . 4.500 2.740 1.913 4.081 . 0 0 "[ . 1 .]" 1
1273 1 146 ASP H 1 147 ALA H 2.700 . 2.700 2.594 2.437 2.688 . 0 0 "[ . 1 .]" 1
1274 1 146 ASP H 1 148 ALA H 5.000 . 5.000 4.146 3.724 4.620 . 0 0 "[ . 1 .]" 1
1275 1 146 ASP HA 1 149 ILE H 3.500 . 3.500 3.458 3.244 3.554 0.054 13 0 "[ . 1 .]" 1
1276 1 146 ASP HA 1 150 ARG H 5.000 . 5.000 4.015 3.715 4.292 . 0 0 "[ . 1 .]" 1
1277 1 146 ASP HA 1 149 ILE HB 3.500 . 3.500 2.215 1.906 2.551 . 0 0 "[ . 1 .]" 1
1278 1 146 ASP HA 1 149 ILE MD 5.000 . 5.500 2.580 2.130 3.277 . 0 0 "[ . 1 .]" 1
1279 1 146 ASP HA 1 149 ILE MG 5.000 . 5.500 3.147 2.432 3.760 . 0 0 "[ . 1 .]" 1
1280 1 147 ALA H 1 148 ALA H 2.700 . 2.700 2.667 2.527 2.784 0.084 6 0 "[ . 1 .]" 1
1281 1 147 ALA H 1 149 ILE H 5.000 . 5.000 3.746 3.315 4.046 . 0 0 "[ . 1 .]" 1
1282 1 147 ALA HA 1 150 ARG H 3.500 . 3.500 3.500 3.334 3.572 0.072 14 0 "[ . 1 .]" 1
1283 1 147 ALA HA 1 150 ARG QB 3.500 . 3.800 3.241 2.590 3.832 0.032 9 0 "[ . 1 .]" 1
1284 1 147 ALA HA 1 150 ARG QG 3.500 . 3.800 2.941 2.313 3.810 0.010 5 0 "[ . 1 .]" 1
1285 1 147 ALA HA 1 150 ARG QD 5.000 . 5.300 4.416 2.122 4.894 . 0 0 "[ . 1 .]" 1
1286 1 147 ALA MB 1 150 ARG QB 5.000 . 5.800 4.459 4.083 4.930 . 0 0 "[ . 1 .]" 1
1287 1 147 ALA MB 1 150 ARG QD 5.000 . 5.800 5.458 3.605 5.853 0.053 5 0 "[ . 1 .]" 1
1288 1 147 ALA MB 1 151 LYS QE 5.000 . 5.800 5.167 4.381 5.857 0.057 11 0 "[ . 1 .]" 1
1289 1 148 ALA H 1 149 ILE H 2.700 . 2.700 2.540 2.409 2.655 . 0 0 "[ . 1 .]" 1
1290 1 148 ALA HA 1 151 LYS QB 3.500 . 3.800 2.496 2.140 3.384 . 0 0 "[ . 1 .]" 1
1291 1 148 ALA HA 1 151 LYS QD 3.500 . 3.800 3.049 1.964 3.813 0.013 2 0 "[ . 1 .]" 1
1292 1 148 ALA HA 1 151 LYS QE 5.000 . 5.300 3.553 1.859 5.274 . 0 0 "[ . 1 .]" 1
1293 1 148 ALA HA 1 151 LYS QG 5.000 . 5.300 3.899 2.677 4.568 . 0 0 "[ . 1 .]" 1
1294 1 149 ILE H 1 150 ARG H 2.700 . 2.700 2.628 2.533 2.709 0.009 11 0 "[ . 1 .]" 1
1295 1 149 ILE H 1 151 LYS H 5.000 . 5.000 3.937 3.453 4.461 . 0 0 "[ . 1 .]" 1
1296 1 149 ILE HA 1 152 VAL H 5.000 . 5.000 3.733 3.437 3.941 . 0 0 "[ . 1 .]" 1
1297 1 149 ILE HA 1 152 VAL MG1 3.500 . 4.000 2.663 1.791 3.784 0.009 14 0 "[ . 1 .]" 1
1298 1 149 ILE MG 1 150 ARG HA 5.000 . 5.500 2.862 2.674 3.030 . 0 0 "[ . 1 .]" 1
1299 1 149 ILE MG 1 152 VAL MG1 5.000 . 6.000 3.658 3.241 4.205 . 0 0 "[ . 1 .]" 1
1300 1 149 ILE MG 1 153 VAL MG2 3.500 . 4.500 2.645 2.000 3.450 . 0 0 "[ . 1 .]" 1
1301 1 150 ARG H 1 151 LYS H 2.700 . 2.700 2.577 2.396 2.737 0.037 14 0 "[ . 1 .]" 1
1302 1 150 ARG H 1 152 VAL H 5.000 . 5.000 4.217 3.923 4.601 . 0 0 "[ . 1 .]" 1
1303 1 150 ARG HA 1 153 VAL H 3.500 . 3.500 3.489 3.291 3.565 0.065 1 0 "[ . 1 .]" 1
1304 1 150 ARG HA 1 154 ASP H 5.000 . 5.000 3.968 3.629 4.188 . 0 0 "[ . 1 .]" 1
1305 1 150 ARG HA 1 153 VAL MG1 5.000 . 5.500 3.556 2.313 4.351 . 0 0 "[ . 1 .]" 1
1306 1 150 ARG HA 1 153 VAL MG2 3.500 . 4.000 3.310 1.946 3.868 . 0 0 "[ . 1 .]" 1
1307 1 151 LYS H 1 152 VAL H 2.700 . 2.700 2.668 2.568 2.752 0.052 11 0 "[ . 1 .]" 1
1308 1 151 LYS HA 1 154 ASP H 3.500 . 3.500 3.526 3.442 3.614 0.114 8 0 "[ . 1 .]" 1
1309 1 151 LYS HA 1 154 ASP QB 3.500 . 3.800 2.798 2.335 3.294 . 0 0 "[ . 1 .]" 1
1310 1 151 LYS QE 1 152 VAL MG2 5.000 . 5.800 5.081 3.461 5.809 0.009 6 0 "[ . 1 .]" 1
1311 1 152 VAL H 1 153 VAL H 3.500 . 3.500 2.620 2.513 2.755 . 0 0 "[ . 1 .]" 1
1312 1 152 VAL H 1 154 ASP H 5.000 . 5.000 4.091 3.677 4.556 . 0 0 "[ . 1 .]" 1
1313 1 152 VAL HA 1 155 ARG H 3.500 . 3.500 3.280 3.082 3.473 . 0 0 "[ . 1 .]" 1
1314 1 152 VAL HA 1 155 ARG QB 3.500 . 3.800 2.312 1.815 3.428 . 0 0 "[ . 1 .]" 1
1315 1 152 VAL HA 1 155 ARG QD 3.500 . 3.800 2.795 1.834 3.772 . 0 0 "[ . 1 .]" 1
1316 1 152 VAL MG2 1 155 ARG QD 3.500 . 4.300 2.759 1.976 3.691 . 0 0 "[ . 1 .]" 1
1317 1 153 VAL H 1 154 ASP H 2.700 . 2.700 2.622 2.466 2.728 0.028 11 0 "[ . 1 .]" 1
1318 1 153 VAL HA 1 156 VAL H 3.500 . 3.500 3.485 3.256 3.577 0.077 6 0 "[ . 1 .]" 1
1319 1 153 VAL HA 1 157 ASN H 5.000 . 5.000 3.929 3.676 4.222 . 0 0 "[ . 1 .]" 1
1320 1 153 VAL HA 1 156 VAL HB 5.000 . 5.000 3.344 2.844 4.073 . 0 0 "[ . 1 .]" 1
1321 1 153 VAL HA 1 156 VAL MG2 3.500 . 4.000 3.475 2.850 4.046 0.046 8 0 "[ . 1 .]" 1
1322 1 154 ASP H 1 155 ARG H 2.700 . 2.700 2.419 2.268 2.625 . 0 0 "[ . 1 .]" 1
1323 1 154 ASP HA 1 157 ASN H 3.500 . 3.500 3.367 3.132 3.543 0.043 13 0 "[ . 1 .]" 1
1324 1 154 ASP HA 1 158 ASN H 5.000 . 5.000 2.872 2.086 3.326 . 0 0 "[ . 1 .]" 1
1325 1 154 ASP HA 1 157 ASN QB 3.500 . 3.800 3.195 2.676 3.826 0.026 4 0 "[ . 1 .]" 1
1326 1 155 ARG H 1 156 VAL H 2.700 . 2.700 2.445 2.316 2.645 . 0 0 "[ . 1 .]" 1
1327 1 155 ARG HA 1 158 ASN H 5.000 . 5.000 4.003 3.709 4.278 . 0 0 "[ . 1 .]" 1
1328 1 155 ARG QB 1 156 VAL MG2 5.000 . 5.800 3.129 2.454 3.717 . 0 0 "[ . 1 .]" 1
1329 1 155 ARG QD 1 156 VAL MG2 3.500 . 4.300 2.998 1.829 4.335 0.035 13 0 "[ . 1 .]" 1
1330 1 156 VAL H 1 157 ASN H 2.700 . 2.700 2.206 2.036 2.397 . 0 0 "[ . 1 .]" 1
1331 1 156 VAL MG1 1 157 ASN QB 3.500 . 4.300 4.243 3.853 4.395 0.095 15 0 "[ . 1 .]" 1
1332 2 3 GLY H 2 4 VAL H 2.700 . 2.700 2.277 1.760 2.684 0.040 15 0 "[ . 1 .]" 1
1333 2 3 GLY H 2 44 LEU MD2 5.000 . 5.500 5.004 4.049 5.572 0.072 5 0 "[ . 1 .]" 1
1334 2 3 GLY QA 2 4 VAL MG2 3.500 . 4.300 3.562 3.011 4.058 . 0 0 "[ . 1 .]" 1
1335 2 4 VAL HA 2 5 ARG H 2.700 . 2.700 2.217 2.131 2.478 . 0 0 "[ . 1 .]" 1
1336 2 4 VAL H 2 4 VAL HB 2.700 . 2.700 2.640 2.435 2.792 0.092 5 0 "[ . 1 .]" 1
1337 2 4 VAL HA 2 6 SER H 3.500 . 3.500 3.482 3.152 3.584 0.084 1 0 "[ . 1 .]" 1
1338 2 4 VAL H 2 44 LEU MD2 5.000 . 5.500 3.573 2.724 4.077 . 0 0 "[ . 1 .]" 1
1339 2 4 VAL HA 2 77 ASP QB 5.000 . 5.300 3.641 3.029 3.983 . 0 0 "[ . 1 .]" 1
1340 2 4 VAL HB 2 44 LEU MD2 3.500 . 4.000 2.080 1.738 2.693 0.062 5 0 "[ . 1 .]" 1
1341 2 4 VAL MG1 2 6 SER H 2.700 . 3.200 2.600 2.020 3.054 . 0 0 "[ . 1 .]" 1
1342 2 4 VAL MG1 2 6 SER HA 5.000 . 5.500 3.620 3.330 3.987 . 0 0 "[ . 1 .]" 1
1343 2 4 VAL MG1 2 39 PHE QD 5.000 . 5.800 3.983 3.076 5.101 . 0 0 "[ . 1 .]" 1
1344 2 4 VAL MG1 2 39 PHE QE 5.000 . 5.800 3.654 2.674 4.918 . 0 0 "[ . 1 .]" 1
1345 2 4 VAL MG1 2 39 PHE HZ 5.000 . 5.500 4.920 4.369 5.509 0.009 1 0 "[ . 1 .]" 1
1346 2 4 VAL MG2 2 39 PHE QD 5.000 . 5.800 5.447 5.110 5.859 0.059 9 0 "[ . 1 .]" 1
1347 2 4 VAL MG2 2 39 PHE QE 5.000 . 5.800 4.390 3.946 5.008 . 0 0 "[ . 1 .]" 1
1348 2 4 VAL MG2 2 39 PHE HZ 5.000 . 5.500 5.526 5.421 5.609 0.109 11 0 "[ . 1 .]" 1
1349 2 4 VAL MG1 2 44 LEU MD2 3.500 . 4.500 2.361 1.870 3.158 . 0 0 "[ . 1 .]" 1
1350 2 4 VAL MG2 2 44 LEU MD2 3.500 . 4.500 3.451 2.670 3.887 . 0 0 "[ . 1 .]" 1
1351 2 4 VAL MG1 2 77 ASP QB 3.500 . 4.300 3.368 2.363 4.150 . 0 0 "[ . 1 .]" 1
1352 2 4 VAL MG1 2 78 VAL MG2 2.700 . 3.700 2.921 2.416 3.455 . 0 0 "[ . 1 .]" 1
1353 2 4 VAL MG1 2 149 ILE MG 3.500 . 4.500 3.146 2.795 3.576 . 0 0 "[ . 1 .]" 1
1354 2 4 VAL MG1 2 149 ILE MD 5.000 . 6.000 3.404 2.609 4.010 . 0 0 "[ . 1 .]" 1
1355 2 4 VAL MG2 2 150 ARG HA 3.500 . 4.000 3.646 2.960 3.997 . 0 0 "[ . 1 .]" 1
1356 2 4 VAL MG2 2 150 ARG QD 3.500 . 4.300 3.926 2.914 4.418 0.118 5 0 "[ . 1 .]" 1
1357 2 4 VAL MG1 2 153 VAL MG2 3.500 . 4.500 4.097 3.417 4.500 0.000 12 0 "[ . 1 .]" 1
1358 2 5 ARG H 2 6 SER H 2.700 . 2.700 2.294 1.952 2.763 0.063 4 0 "[ . 1 .]" 1
1359 2 5 ARG HA 2 6 SER H 3.500 . 3.500 3.475 3.376 3.528 0.028 4 0 "[ . 1 .]" 1
1360 2 5 ARG H 2 77 ASP QB 5.000 . 5.300 2.901 2.378 3.396 . 0 0 "[ . 1 .]" 1
1361 2 5 ARG HA 2 44 LEU MD2 5.000 . 5.500 3.394 2.776 3.802 . 0 0 "[ . 1 .]" 1
1362 2 5 ARG HA 2 45 GLU H 5.000 . 5.000 4.257 3.952 4.549 . 0 0 "[ . 1 .]" 1
1363 2 5 ARG QD 2 44 LEU MD2 3.500 . 4.300 4.125 3.823 4.340 0.040 1 0 "[ . 1 .]" 1
1364 2 6 SER HA 2 7 VAL H 2.700 . 2.700 2.143 2.101 2.174 . 0 0 "[ . 1 .]" 1
1365 2 6 SER H 2 78 VAL H 5.000 . 5.000 3.969 3.733 4.261 . 0 0 "[ . 1 .]" 1
1366 2 6 SER H 2 44 LEU MD2 5.000 . 5.500 4.273 3.741 4.724 . 0 0 "[ . 1 .]" 1
1367 2 6 SER H 2 77 ASP QB 3.500 . 3.800 2.146 1.795 2.568 0.005 6 0 "[ . 1 .]" 1
1368 2 6 SER HA 2 44 LEU MD2 5.000 . 5.500 4.350 4.156 4.582 . 0 0 "[ . 1 .]" 1
1369 2 6 SER HA 2 44 LEU MD1 5.000 . 5.500 5.454 5.113 5.569 0.069 7 0 "[ . 1 .]" 1
1370 2 6 SER HA 2 45 GLU H 3.500 . 3.500 1.959 1.769 2.107 0.031 5 0 "[ . 1 .]" 1
1371 2 6 SER HA 2 45 GLU QB 3.500 . 3.800 2.615 2.079 3.048 . 0 0 "[ . 1 .]" 1
1372 2 6 SER HA 2 46 VAL MG2 5.000 . 5.500 5.013 4.288 5.341 . 0 0 "[ . 1 .]" 1
1373 2 6 SER QB 2 46 VAL MG1 5.000 . 5.800 5.840 5.615 5.952 0.152 3 0 "[ . 1 .]" 1
1374 2 6 SER QB 2 46 VAL MG2 5.000 . 5.800 5.473 5.077 5.672 . 0 0 "[ . 1 .]" 1
1375 2 6 SER HA 2 47 PHE QR 5.000 . 6.500 3.726 3.011 4.293 . 0 0 "[ . 1 .]" 1
1376 2 6 SER QB 2 76 ALA HA 5.000 . 5.300 3.048 2.575 3.839 . 0 0 "[ . 1 .]" 1
1377 2 6 SER QB 2 76 ALA MB 5.000 . 5.800 3.890 3.481 4.685 . 0 0 "[ . 1 .]" 1
1378 2 7 VAL H 2 44 LEU MD2 5.000 . 5.500 4.725 4.395 4.942 . 0 0 "[ . 1 .]" 1
1379 2 7 VAL H 2 44 LEU HA 3.500 . 3.500 3.589 3.540 3.634 0.134 12 0 "[ . 1 .]" 1
1380 2 7 VAL H 2 45 GLU H 3.500 . 3.500 3.506 3.426 3.593 0.093 12 0 "[ . 1 .]" 1
1381 2 7 VAL H 2 46 VAL HA 5.000 . 5.000 3.074 2.882 3.311 . 0 0 "[ . 1 .]" 1
1382 2 7 VAL H 2 46 VAL MG2 5.000 . 5.500 3.707 2.659 3.980 . 0 0 "[ . 1 .]" 1
1383 2 7 VAL H 2 47 PHE QR 3.500 . 5.000 3.959 3.127 4.541 . 0 0 "[ . 1 .]" 1
1384 2 7 VAL H 2 76 ALA MB 5.000 . 5.500 5.085 4.625 5.516 0.016 15 0 "[ . 1 .]" 1
1385 2 7 VAL HA 2 8 PHE H 2.700 . 2.700 2.157 2.120 2.207 . 0 0 "[ . 1 .]" 1
1386 2 7 VAL HA 2 46 VAL HA 5.000 . 5.000 4.688 4.415 4.847 . 0 0 "[ . 1 .]" 1
1387 2 7 VAL HA 2 76 ALA MB 3.500 . 4.000 3.780 3.349 4.004 0.004 3 0 "[ . 1 .]" 1
1388 2 7 VAL HA 2 77 ASP H 5.000 . 5.000 4.437 3.827 4.866 . 0 0 "[ . 1 .]" 1
1389 2 7 VAL HA 2 78 VAL H 3.500 . 3.500 2.908 2.425 3.427 . 0 0 "[ . 1 .]" 1
1390 2 7 VAL HA 2 78 VAL MG1 3.500 . 4.000 2.278 1.801 3.248 . 0 0 "[ . 1 .]" 1
1391 2 7 VAL HB 2 39 PHE HA 5.000 . 5.000 4.733 4.312 5.030 0.030 6 0 "[ . 1 .]" 1
1392 2 7 VAL HB 2 46 VAL HA 5.000 . 5.000 3.552 3.246 4.464 . 0 0 "[ . 1 .]" 1
1393 2 7 VAL HB 2 46 VAL MG1 5.000 . 5.500 4.507 3.696 5.430 . 0 0 "[ . 1 .]" 1
1394 2 7 VAL HB 2 46 VAL MG2 5.000 . 5.500 3.241 1.842 4.336 . 0 0 "[ . 1 .]" 1
1395 2 7 VAL HB 2 78 VAL MG1 3.500 . 4.000 3.926 3.674 4.026 0.026 11 0 "[ . 1 .]" 1
1396 2 7 VAL MG1 2 39 PHE QB 5.000 . 5.800 3.833 2.412 4.683 . 0 0 "[ . 1 .]" 1
1397 2 7 VAL MG2 2 39 PHE QB 5.000 . 5.800 4.162 3.811 4.816 . 0 0 "[ . 1 .]" 1
1398 2 7 VAL MG1 2 39 PHE QE 3.500 . 4.300 2.301 1.822 2.855 . 0 0 "[ . 1 .]" 1
1399 2 7 VAL MG1 2 39 PHE QD 3.500 . 4.300 3.011 2.046 3.535 . 0 0 "[ . 1 .]" 1
1400 2 7 VAL MG1 2 39 PHE HZ 5.000 . 5.500 2.459 1.944 3.741 . 0 0 "[ . 1 .]" 1
1401 2 7 VAL MG2 2 39 PHE QE 3.500 . 4.300 2.338 1.758 3.031 0.042 8 0 "[ . 1 .]" 1
1402 2 7 VAL MG2 2 39 PHE QD 3.500 . 4.300 3.053 2.305 3.777 . 0 0 "[ . 1 .]" 1
1403 2 7 VAL MG2 2 39 PHE HZ 5.000 . 5.500 2.771 2.063 3.191 . 0 0 "[ . 1 .]" 1
1404 2 7 VAL MG1 2 46 VAL HA 3.500 . 4.000 3.364 1.993 4.039 0.039 5 0 "[ . 1 .]" 1
1405 2 7 VAL MG2 2 78 VAL H 5.000 . 5.500 3.930 3.416 4.512 . 0 0 "[ . 1 .]" 1
1406 2 7 VAL MG1 2 80 VAL H 5.000 . 5.500 3.619 2.975 4.928 . 0 0 "[ . 1 .]" 1
1407 2 7 VAL MG1 2 9 LEU QB 3.500 . 4.300 3.490 3.012 3.892 . 0 0 "[ . 1 .]" 1
1408 2 7 VAL MG1 2 9 LEU MD2 3.500 . 4.500 3.790 2.605 4.396 . 0 0 "[ . 1 .]" 1
1409 2 7 VAL MG2 2 9 LEU MD2 5.000 . 6.000 5.485 3.177 6.072 0.072 13 0 "[ . 1 .]" 1
1410 2 7 VAL MG2 2 44 LEU HA 5.000 . 5.500 4.174 3.311 5.451 . 0 0 "[ . 1 .]" 1
1411 2 7 VAL MG2 2 44 LEU QB 3.500 . 4.300 2.248 1.807 3.524 . 0 0 "[ . 1 .]" 1
1412 2 7 VAL MG2 2 44 LEU MD1 3.500 . 4.500 2.468 2.046 3.610 . 0 0 "[ . 1 .]" 1
1413 2 7 VAL MG2 2 44 LEU MD2 3.500 . 4.500 3.603 3.244 4.475 . 0 0 "[ . 1 .]" 1
1414 2 7 VAL MG1 2 44 LEU MD1 5.000 . 6.000 4.005 2.946 4.323 . 0 0 "[ . 1 .]" 1
1415 2 7 VAL MG1 2 44 LEU MD2 5.000 . 6.000 5.378 4.427 5.699 . 0 0 "[ . 1 .]" 1
1416 2 7 VAL MG1 2 46 VAL MG1 3.500 . 4.500 3.401 2.275 4.052 . 0 0 "[ . 1 .]" 1
1417 2 7 VAL MG1 2 46 VAL MG2 3.500 . 4.500 3.077 1.969 4.382 . 0 0 "[ . 1 .]" 1
1418 2 7 VAL MG2 2 46 VAL MG2 3.500 . 4.500 4.279 3.195 4.546 0.046 13 0 "[ . 1 .]" 1
1419 2 7 VAL MG2 2 78 VAL MG1 2.700 . 3.700 1.886 1.787 2.195 0.013 10 0 "[ . 1 .]" 1
1420 2 7 VAL MG2 2 78 VAL MG2 3.500 . 4.500 3.575 3.132 4.076 . 0 0 "[ . 1 .]" 1
1421 2 7 VAL MG1 2 78 VAL MG1 3.500 . 4.500 2.733 1.776 4.284 0.024 5 0 "[ . 1 .]" 1
1422 2 7 VAL MG1 2 80 VAL MG2 3.500 . 4.500 2.430 1.837 3.637 . 0 0 "[ . 1 .]" 1
1423 2 7 VAL MG2 2 80 VAL MG2 5.000 . 6.000 2.661 1.773 4.481 0.027 11 0 "[ . 1 .]" 1
1424 2 7 VAL MG1 2 149 ILE MD 6.000 . 7.000 3.184 2.406 4.414 . 0 0 "[ . 1 .]" 1
1425 2 7 VAL MG1 2 149 ILE MG 6.000 . 7.000 4.802 3.787 5.801 . 0 0 "[ . 1 .]" 1
1426 2 7 VAL MG2 2 149 ILE MG 5.000 . 6.000 3.333 2.825 3.804 . 0 0 "[ . 1 .]" 1
1427 2 7 VAL MG2 2 149 ILE MD 5.000 . 6.000 2.368 1.772 3.172 0.028 3 0 "[ . 1 .]" 1
1428 2 8 PHE H 2 78 VAL H 3.500 . 3.500 3.526 3.417 3.605 0.105 15 0 "[ . 1 .]" 1
1429 2 8 PHE H 2 78 VAL QG 5.000 . 5.500 2.877 2.576 3.608 . 0 0 "[ . 1 .]" 1
1430 2 8 PHE H 2 76 ALA MB 5.000 . 5.500 2.743 2.336 2.951 . 0 0 "[ . 1 .]" 1
1431 2 8 PHE QR 2 10 ALA MB 2.700 . 4.700 1.856 1.733 2.279 0.067 9 0 "[ . 1 .]" 1
1432 2 8 PHE QD 2 69 ASP HA 5.000 . 5.300 4.864 4.161 5.309 0.009 14 0 "[ . 1 .]" 1
1433 2 8 PHE QD 2 73 ILE HA 5.000 . 5.300 3.410 1.803 4.610 . 0 0 "[ . 1 .]" 1
1434 2 8 PHE QD 2 73 ILE MD 3.500 . 4.300 3.877 3.167 4.285 . 0 0 "[ . 1 .]" 1
1435 2 8 PHE QR 2 81 ALA MB 5.000 . 7.000 2.712 1.814 4.434 . 0 0 "[ . 1 .]" 1
1436 2 8 PHE QR 2 91 THR MG 5.000 . 7.000 3.544 2.819 4.694 . 0 0 "[ . 1 .]" 1
1437 2 9 LEU HA 2 10 ALA H 2.700 . 2.700 2.175 2.104 2.284 . 0 0 "[ . 1 .]" 1
1438 2 9 LEU HA 2 80 VAL H 5.000 . 5.000 3.888 3.673 4.162 . 0 0 "[ . 1 .]" 1
1439 2 9 LEU QB 2 46 VAL MG1 5.000 . 5.800 2.320 1.723 3.126 0.077 5 0 "[ . 1 .]" 1
1440 2 9 LEU MD1 2 32 PHE HA 5.000 . 5.500 4.050 2.849 5.329 . 0 0 "[ . 1 .]" 1
1441 2 9 LEU MD2 2 32 PHE HA 5.000 . 5.500 4.393 3.279 5.128 . 0 0 "[ . 1 .]" 1
1442 2 9 LEU MD2 2 32 PHE QD 3.500 . 4.300 3.364 2.318 4.193 . 0 0 "[ . 1 .]" 1
1443 2 9 LEU MD2 2 32 PHE QE 5.000 . 5.800 2.931 2.003 4.144 . 0 0 "[ . 1 .]" 1
1444 2 9 LEU MD1 2 32 PHE QD 3.500 . 4.300 3.520 2.281 4.340 0.040 11 0 "[ . 1 .]" 1
1445 2 9 LEU MD1 2 35 LEU MD2 5.000 . 6.000 3.520 2.331 6.020 0.020 1 0 "[ . 1 .]" 1
1446 2 9 LEU MD2 2 35 LEU MD2 5.000 . 6.000 3.824 3.111 5.366 . 0 0 "[ . 1 .]" 1
1447 2 9 LEU MD2 2 36 ILE MD 5.000 . 6.000 2.882 1.748 3.930 0.052 5 0 "[ . 1 .]" 1
1448 2 9 LEU MD2 2 46 VAL MG1 5.000 . 6.000 4.126 2.072 4.993 . 0 0 "[ . 1 .]" 1
1449 2 9 LEU MD1 2 49 ALA MB 5.000 . 6.000 3.818 2.443 4.653 . 0 0 "[ . 1 .]" 1
1450 2 9 LEU MD2 2 49 ALA MB 5.000 . 6.000 4.456 3.837 4.936 . 0 0 "[ . 1 .]" 1
1451 2 9 LEU MD1 2 80 VAL QG 3.500 . 4.500 2.838 2.069 4.320 . 0 0 "[ . 1 .]" 1
1452 2 9 LEU MD2 2 80 VAL QG 5.000 . 6.000 2.138 1.731 2.764 0.069 5 0 "[ . 1 .]" 1
1453 2 9 LEU MD1 2 81 ALA HA 5.000 . 5.500 4.902 3.124 5.510 0.010 15 0 "[ . 1 .]" 1
1454 2 9 LEU MD1 2 82 ILE MD 5.000 . 6.000 4.626 3.413 5.790 . 0 0 "[ . 1 .]" 1
1455 2 10 ALA H 2 81 ALA HA 3.500 . 3.500 2.229 1.903 3.266 . 0 0 "[ . 1 .]" 1
1456 2 10 ALA H 2 80 VAL QG 5.000 . 5.500 4.076 3.289 4.601 . 0 0 "[ . 1 .]" 1
1457 2 10 ALA H 2 81 ALA MB 5.000 . 5.500 3.331 2.505 4.678 . 0 0 "[ . 1 .]" 1
1458 2 10 ALA HA 2 11 GLY H 2.700 . 2.700 2.346 2.159 2.668 . 0 0 "[ . 1 .]" 1
1459 2 10 ALA HA 2 91 THR MG 3.500 . 4.000 4.037 3.959 4.082 0.082 8 0 "[ . 1 .]" 1
1460 2 10 ALA MB 2 13 PHE QE 5.000 . 5.800 5.446 4.717 5.798 . 0 0 "[ . 1 .]" 1
1461 2 10 ALA MB 2 49 ALA HA 5.000 . 5.500 4.685 4.252 5.532 0.032 7 0 "[ . 1 .]" 1
1462 2 10 ALA MB 2 50 HIS HE1 3.500 . 4.000 3.806 3.463 4.032 0.032 5 0 "[ . 1 .]" 1
1463 2 10 ALA MB 2 81 ALA HA 3.500 . 4.000 3.351 2.654 3.733 . 0 0 "[ . 1 .]" 1
1464 2 10 ALA MB 2 81 ALA MB 3.500 . 4.500 2.665 2.184 3.066 . 0 0 "[ . 1 .]" 1
1465 2 10 ALA MB 2 82 ILE H 3.500 . 4.000 3.798 3.385 4.061 0.061 7 0 "[ . 1 .]" 1
1466 2 10 ALA MB 2 79 PHE QE 3.500 . 4.300 3.974 3.678 4.246 . 0 0 "[ . 1 .]" 1
1467 2 10 ALA MB 2 91 THR HA 5.000 . 5.500 2.857 2.272 3.230 . 0 0 "[ . 1 .]" 1
1468 2 10 ALA MB 2 91 THR MG 3.500 . 4.500 1.995 1.832 2.172 . 0 0 "[ . 1 .]" 1
1469 2 10 ALA MB 2 95 ILE MD 5.000 . 6.000 4.022 3.514 4.556 . 0 0 "[ . 1 .]" 1
1470 2 11 GLY QA 2 82 ILE H 3.500 . 3.800 3.278 2.827 3.781 . 0 0 "[ . 1 .]" 1
1471 2 11 GLY QA 2 82 ILE MG 5.000 . 5.800 3.050 2.100 4.204 . 0 0 "[ . 1 .]" 1
1472 2 11 GLY QA 2 82 ILE MD 5.000 . 5.800 4.404 3.866 5.140 . 0 0 "[ . 1 .]" 1
1473 2 11 GLY QA 2 91 THR MG 5.000 . 5.800 2.833 2.227 3.314 . 0 0 "[ . 1 .]" 1
1474 2 12 PRO QD 2 16 LEU MD2 5.000 . 5.800 3.248 2.625 3.803 . 0 0 "[ . 1 .]" 1
1475 2 12 PRO QD 2 82 ILE MD 5.000 . 5.800 4.473 3.800 5.206 . 0 0 "[ . 1 .]" 1
1476 2 12 PRO QD 2 82 ILE MG 5.000 . 5.800 2.521 1.746 3.661 0.054 12 0 "[ . 1 .]" 1
1477 2 13 PHE HA 2 17 VAL MG2 5.000 . 5.500 4.645 2.558 5.475 . 0 0 "[ . 1 .]" 1
1478 2 13 PHE HA 2 17 VAL MG1 5.000 . 5.500 3.784 2.459 5.502 0.002 11 0 "[ . 1 .]" 1
1479 2 13 PHE HA 2 59 VAL MG1 5.000 . 5.500 5.264 3.642 5.654 0.154 11 0 "[ . 1 .]" 1
1480 2 13 PHE HA 2 59 VAL MG2 3.500 . 4.000 3.906 3.099 4.164 0.164 13 0 "[ . 1 .]" 1
1481 2 13 PHE QD 2 14 MET HA 3.500 . 3.800 3.895 3.740 4.041 0.241 10 0 "[ . 1 .]" 1
1482 2 13 PHE QD 2 14 MET ME 3.500 . 4.300 4.037 3.799 4.352 0.052 13 0 "[ . 1 .]" 1
1483 2 13 PHE QE 2 14 MET ME 5.000 . 5.800 5.513 5.113 5.878 0.078 9 0 "[ . 1 .]" 1
1484 2 13 PHE QD 2 16 LEU MD1 3.500 . 4.300 4.207 3.450 4.446 0.146 1 0 "[ . 1 .]" 1
1485 2 13 PHE QE 2 16 LEU MD1 5.000 . 5.800 4.893 3.710 5.325 . 0 0 "[ . 1 .]" 1
1486 2 13 PHE QD 2 16 LEU MD2 5.000 . 5.800 3.127 2.496 3.550 . 0 0 "[ . 1 .]" 1
1487 2 13 PHE QE 2 16 LEU MD2 5.000 . 5.800 4.406 3.996 4.828 . 0 0 "[ . 1 .]" 1
1488 2 13 PHE QD 2 17 VAL MG1 3.500 . 4.300 3.359 1.779 4.373 0.073 7 0 "[ . 1 .]" 1
1489 2 13 PHE QE 2 17 VAL MG1 5.000 . 5.800 4.338 3.064 4.987 . 0 0 "[ . 1 .]" 1
1490 2 13 PHE QD 2 17 VAL MG2 5.000 . 5.800 4.375 2.465 5.230 . 0 0 "[ . 1 .]" 1
1491 2 13 PHE QE 2 17 VAL MG2 5.000 . 5.800 4.725 2.979 5.563 . 0 0 "[ . 1 .]" 1
1492 2 24 MET ME 2 32 PHE QD 3.500 . 4.300 3.516 2.262 4.243 . 0 0 "[ . 1 .]" 1
1493 2 24 MET ME 2 32 PHE QE 5.000 . 5.800 3.522 3.062 4.455 . 0 0 "[ . 1 .]" 1
1494 2 24 MET ME 2 32 PHE HZ 5.000 . 5.500 4.834 3.543 5.546 0.046 12 0 "[ . 1 .]" 1
1495 2 13 PHE QE 2 54 ALA MB 3.500 . 4.300 3.757 2.808 4.464 0.164 10 0 "[ . 1 .]" 1
1496 2 13 PHE HZ 2 54 ALA MB 3.500 . 4.000 4.008 3.886 4.107 0.107 9 0 "[ . 1 .]" 1
1497 2 13 PHE HZ 2 58 GLN QG 5.000 . 5.300 3.489 1.832 5.344 0.044 13 0 "[ . 1 .]" 1
1498 2 13 PHE QE 2 59 VAL MG1 5.000 . 5.800 3.773 3.472 4.222 . 0 0 "[ . 1 .]" 1
1499 2 13 PHE QE 2 59 VAL MG2 5.000 . 5.800 3.033 1.797 3.992 0.003 14 0 "[ . 1 .]" 1
1500 2 13 PHE HZ 2 59 VAL MG1 5.000 . 5.500 5.414 4.922 5.594 0.094 11 0 "[ . 1 .]" 1
1501 2 13 PHE HZ 2 59 VAL MG2 5.000 . 5.500 4.592 4.000 5.050 . 0 0 "[ . 1 .]" 1
1502 2 13 PHE QE 2 60 LEU MD1 5.000 . 5.800 3.639 2.427 4.939 . 0 0 "[ . 1 .]" 1
1503 2 13 PHE HZ 2 60 LEU MD1 5.000 . 5.500 3.276 2.404 4.506 . 0 0 "[ . 1 .]" 1
1504 2 14 MET HA 2 17 VAL MG2 3.500 . 4.000 4.037 3.830 4.228 0.228 5 0 "[ . 1 .]" 1
1505 2 14 MET HA 2 17 VAL MG1 5.000 . 5.500 2.289 1.682 3.637 0.118 3 0 "[ . 1 .]" 1
1506 2 14 MET ME 2 17 VAL MG2 5.000 . 6.000 5.194 3.751 6.106 0.106 8 0 "[ . 1 .]" 1
1507 2 14 MET ME 2 19 PRO QG 5.000 . 5.800 5.391 4.731 5.804 0.004 2 0 "[ . 1 .]" 1
1508 2 14 MET ME 2 59 VAL MG1 5.000 . 6.000 3.690 1.796 5.374 0.004 5 0 "[ . 1 .]" 1
1509 2 14 MET ME 2 59 VAL MG2 5.000 . 6.000 4.368 1.946 5.993 . 0 0 "[ . 1 .]" 1
1510 2 14 MET ME 2 89 PRO QD 5.000 . 5.800 4.522 1.963 5.919 0.119 1 0 "[ . 1 .]" 1
1511 1 119 PHE QE 2 14 MET ME 3.500 . 4.300 3.048 2.507 3.769 . 0 0 "[ . 1 .]" 1
1512 1 119 PHE QD 2 14 MET ME 5.000 . 5.800 2.452 1.780 3.631 0.020 4 0 "[ . 1 .]" 1
1513 2 15 GLY QA 2 16 LEU H 3.500 . 3.800 2.407 2.236 2.610 . 0 0 "[ . 1 .]" 1
1514 2 15 GLY QA 2 17 VAL MG1 5.000 . 5.800 4.498 3.799 5.803 0.003 11 0 "[ . 1 .]" 1
1515 2 15 GLY QA 2 19 PRO HA 5.000 . 5.300 5.148 4.433 5.402 0.102 5 0 "[ . 1 .]" 1
1516 2 16 LEU HA 2 17 VAL H 3.500 . 3.500 3.468 3.372 3.530 0.030 14 0 "[ . 1 .]" 1
1517 2 16 LEU QB 2 24 MET ME 5.000 . 5.800 4.413 2.695 5.492 . 0 0 "[ . 1 .]" 1
1518 2 16 LEU MD2 2 17 VAL MG2 3.500 . 4.500 3.469 1.816 4.345 . 0 0 "[ . 1 .]" 1
1519 2 16 LEU MD1 2 17 VAL MG2 5.000 . 6.000 3.927 1.869 5.061 . 0 0 "[ . 1 .]" 1
1520 2 16 LEU MD1 2 24 MET HA 5.000 . 5.500 2.373 1.684 3.943 0.116 11 0 "[ . 1 .]" 1
1521 2 16 LEU MD2 2 24 MET HA 5.000 . 5.500 4.232 3.502 5.513 0.013 10 0 "[ . 1 .]" 1
1522 2 16 LEU MD1 2 24 MET ME 3.500 . 4.500 2.545 1.773 3.395 0.027 6 0 "[ . 1 .]" 1
1523 2 16 LEU MD1 2 25 PRO QB 3.500 . 4.300 4.194 3.984 4.381 0.081 11 0 "[ . 1 .]" 1
1524 2 16 LEU MD1 2 25 PRO QD 5.000 . 5.800 2.006 1.715 3.503 0.085 8 0 "[ . 1 .]" 1
1525 2 16 LEU MD1 2 28 GLU QB 3.500 . 4.300 3.832 3.354 4.288 . 0 0 "[ . 1 .]" 1
1526 2 16 LEU MD1 2 28 GLU QG 5.000 . 5.800 3.277 2.706 4.360 . 0 0 "[ . 1 .]" 1
1527 2 16 LEU MD1 2 58 GLN QG 3.500 . 4.300 4.217 3.735 4.546 0.246 11 0 "[ . 1 .]" 1
1528 2 16 LEU MD2 2 84 GLY QA 5.000 . 5.800 5.833 5.646 5.943 0.143 9 0 "[ . 1 .]" 1
1529 1 119 PHE QD 2 16 LEU MD2 5.000 . 5.800 5.784 5.427 5.921 0.121 13 0 "[ . 1 .]" 1
1530 1 119 PHE QE 2 16 LEU MD2 3.500 . 4.300 4.380 4.232 4.457 0.157 6 0 "[ . 1 .]" 1
1531 1 119 PHE HZ 2 16 LEU MD2 5.000 . 5.500 5.446 5.306 5.553 0.053 5 0 "[ . 1 .]" 1
1532 2 17 VAL HA 2 18 ASN H 2.700 . 2.700 2.405 2.167 2.740 0.040 3 0 "[ . 1 .]" 1
1533 2 17 VAL HA 2 24 MET HA 5.000 . 5.000 4.556 3.698 5.063 0.063 14 0 "[ . 1 .]" 1
1534 2 17 VAL MG1 2 24 MET HA 5.000 . 5.500 5.267 4.525 5.517 0.017 10 0 "[ . 1 .]" 1
1535 2 17 VAL MG1 2 18 ASN H 3.500 . 4.000 2.920 2.178 4.092 0.092 13 0 "[ . 1 .]" 1
1536 2 17 VAL MG1 2 18 ASN HA 5.000 . 5.500 4.065 3.442 5.032 . 0 0 "[ . 1 .]" 1
1537 2 17 VAL MG1 2 19 PRO HA 5.000 . 5.500 4.003 3.351 5.099 . 0 0 "[ . 1 .]" 1
1538 2 17 VAL MG1 2 20 GLU HA 3.500 . 4.000 4.030 3.887 4.152 0.152 12 0 "[ . 1 .]" 1
1539 2 17 VAL MG1 2 22 ASN HA 5.000 . 5.500 4.680 3.535 5.667 0.167 8 0 "[ . 1 .]" 1
1540 2 17 VAL MG1 2 22 ASN QB 5.000 . 5.800 3.837 1.760 5.754 0.040 11 0 "[ . 1 .]" 1
1541 1 119 PHE HZ 2 17 VAL MG1 3.500 . 4.000 3.907 3.309 4.143 0.143 11 0 "[ . 1 .]" 1
1542 1 119 PHE QE 2 17 VAL MG1 5.000 . 5.800 3.514 2.402 4.310 . 0 0 "[ . 1 .]" 1
1543 1 119 PHE HZ 2 17 VAL MG2 5.000 . 5.500 5.028 4.036 5.560 0.060 15 0 "[ . 1 .]" 1
1544 1 119 PHE QE 2 17 VAL MG2 5.000 . 5.800 4.902 3.625 5.531 . 0 0 "[ . 1 .]" 1
1545 2 18 ASN H 2 19 PRO QD 5.000 . 5.300 4.159 3.982 4.308 . 0 0 "[ . 1 .]" 1
1546 2 18 ASN H 2 22 ASN H 5.000 . 5.000 4.722 4.297 5.083 0.083 10 0 "[ . 1 .]" 1
1547 2 18 ASN HA 2 19 PRO QD 2.700 . 3.000 1.836 1.729 1.944 0.071 12 0 "[ . 1 .]" 1
1548 2 18 ASN HA 2 19 PRO QG 3.500 . 3.800 3.803 3.718 3.876 0.076 13 0 "[ . 1 .]" 1
1549 2 18 ASN HA 2 20 GLU H 5.000 . 5.000 4.806 4.539 5.007 0.007 7 0 "[ . 1 .]" 1
1550 2 18 ASN QB 2 20 GLU H 5.000 . 5.300 4.457 3.945 5.165 . 0 0 "[ . 1 .]" 1
1551 2 18 ASN QB 2 23 SER H 5.000 . 5.300 4.923 4.332 5.348 0.048 15 0 "[ . 1 .]" 1
1552 2 19 PRO HA 2 20 GLU H 2.700 . 2.700 2.471 2.367 2.616 . 0 0 "[ . 1 .]" 1
1553 2 19 PRO QD 2 59 VAL MG2 5.000 . 5.800 5.799 5.402 5.993 0.193 8 0 "[ . 1 .]" 1
1554 2 19 PRO QD 2 59 VAL MG1 5.000 . 5.800 5.751 5.275 5.996 0.196 14 0 "[ . 1 .]" 1
1555 2 19 PRO HA 2 59 VAL QG 5.000 . 5.500 4.450 3.924 4.836 . 0 0 "[ . 1 .]" 1
1556 2 20 GLU H 2 21 THR H 3.500 . 3.500 2.315 1.880 2.778 . 0 0 "[ . 1 .]" 1
1557 2 20 GLU HA 2 21 THR H 2.700 . 2.700 2.713 2.590 2.822 0.122 11 0 "[ . 1 .]" 1
1558 2 20 GLU QG 2 21 THR MG 5.000 . 5.800 5.330 4.626 5.875 0.075 15 0 "[ . 1 .]" 1
1559 2 20 GLU HA 2 59 VAL MG1 5.000 . 5.500 2.451 1.855 3.235 . 0 0 "[ . 1 .]" 1
1560 1 119 PHE QD 2 20 GLU HA 5.000 . 5.300 4.743 3.812 5.126 . 0 0 "[ . 1 .]" 1
1561 1 119 PHE QE 2 20 GLU HA 5.000 . 5.300 4.347 3.200 5.128 . 0 0 "[ . 1 .]" 1
1562 2 21 THR HA 2 22 ASN H 2.700 . 2.700 2.521 2.140 2.900 0.200 2 0 "[ . 1 .]" 1
1563 2 21 THR MG 2 23 SER QB 5.000 . 5.800 5.151 3.217 5.888 0.088 10 0 "[ . 1 .]" 1
1564 2 21 THR HA 2 59 VAL MG2 5.000 . 5.500 4.049 2.587 4.860 . 0 0 "[ . 1 .]" 1
1565 2 22 ASN QB 2 24 MET QB 5.000 . 5.600 5.270 4.547 5.579 . 0 0 "[ . 1 .]" 1
1566 2 22 ASN QB 2 59 VAL MG1 3.500 . 4.300 4.262 3.576 4.460 0.160 15 0 "[ . 1 .]" 1
1567 2 23 SER HA 2 24 MET H 2.700 . 2.700 2.385 2.115 2.765 0.065 1 0 "[ . 1 .]" 1
1568 2 23 SER QB 2 24 MET H 3.500 . 3.800 3.724 3.023 3.970 0.170 8 0 "[ . 1 .]" 1
1569 2 24 MET HA 2 25 PRO QD 2.700 . 3.000 1.941 1.784 2.746 0.016 1 0 "[ . 1 .]" 1
1570 2 24 MET HA 2 25 PRO QG 5.000 . 5.300 3.874 3.727 4.643 . 0 0 "[ . 1 .]" 1
1571 2 24 MET HA 2 28 GLU QG 5.000 . 5.300 5.092 3.500 5.368 0.068 11 0 "[ . 1 .]" 1
1572 2 24 MET HA 2 28 GLU QB 5.000 . 5.300 4.924 4.584 5.263 . 0 0 "[ . 1 .]" 1
1573 2 25 PRO HA 2 26 SER H 2.700 . 2.700 2.249 2.144 3.275 0.575 10 1 "[ . + .]" 1
1574 2 25 PRO QB 2 26 SER H 3.500 . 3.800 3.293 1.664 3.622 0.136 10 0 "[ . 1 .]" 1
1575 2 25 PRO QB 2 28 GLU QB 3.500 . 4.100 2.085 1.719 4.157 0.081 15 0 "[ . 1 .]" 1
1576 2 25 PRO QD 2 28 GLU QB 5.000 . 5.600 3.298 2.505 4.968 . 0 0 "[ . 1 .]" 1
1577 2 25 PRO QB 2 28 GLU QG 3.500 . 4.100 3.465 2.011 4.189 0.089 10 0 "[ . 1 .]" 1
1578 2 25 PRO QD 2 28 GLU QG 3.500 . 4.100 3.447 2.786 4.002 . 0 0 "[ . 1 .]" 1
1579 2 26 SER HA 2 27 ALA H 3.500 . 3.500 3.533 3.399 3.569 0.069 13 0 "[ . 1 .]" 1
1580 2 26 SER H 2 29 GLN H 5.000 . 5.000 4.806 3.348 5.091 0.091 14 0 "[ . 1 .]" 1
1581 2 26 SER HA 2 29 GLN QG 5.000 . 5.300 3.897 1.840 5.190 . 0 0 "[ . 1 .]" 1
1582 2 26 SER QB 2 28 GLU H 5.000 . 5.300 4.202 3.246 4.560 . 0 0 "[ . 1 .]" 1
1583 2 27 ALA HA 2 30 LEU QB 3.500 . 3.800 2.683 2.319 3.295 . 0 0 "[ . 1 .]" 1
1584 2 27 ALA HA 2 30 LEU HG 5.000 . 5.000 4.827 4.484 5.059 0.059 7 0 "[ . 1 .]" 1
1585 2 27 ALA HA 2 30 LEU MD1 3.500 . 4.000 3.910 3.611 4.086 0.086 11 0 "[ . 1 .]" 1
1586 2 27 ALA HA 2 30 LEU MD2 5.000 . 5.500 2.160 1.869 2.763 . 0 0 "[ . 1 .]" 1
1587 2 28 GLU H 2 29 GLN H 3.500 . 3.500 2.375 2.249 2.480 . 0 0 "[ . 1 .]" 1
1588 2 28 GLU HA 2 31 PRO QD 5.000 . 5.300 2.771 2.528 3.113 . 0 0 "[ . 1 .]" 1
1589 2 28 GLU QG 2 32 PHE QD 5.000 . 5.600 3.985 2.190 5.500 . 0 0 "[ . 1 .]" 1
1590 2 28 GLU QG 2 32 PHE QE 5.000 . 5.600 3.880 1.808 5.350 . 0 0 "[ . 1 .]" 1
1591 2 29 GLN H 2 30 LEU H 2.700 . 2.700 2.683 2.569 2.747 0.047 13 0 "[ . 1 .]" 1
1592 2 29 GLN HA 2 32 PHE H 3.500 . 3.500 3.410 3.305 3.492 . 0 0 "[ . 1 .]" 1
1593 2 29 GLN HA 2 32 PHE QD 3.500 . 3.800 3.250 2.136 3.845 0.045 14 0 "[ . 1 .]" 1
1594 2 29 GLN HA 2 33 LEU MD1 5.000 . 5.500 4.897 3.829 5.244 . 0 0 "[ . 1 .]" 1
1595 2 29 GLN QG 2 55 TRP HD1 5.000 . 5.300 3.169 1.898 4.677 . 0 0 "[ . 1 .]" 1
1596 2 30 LEU H 2 31 PRO QD 3.500 . 3.800 2.143 1.957 2.295 . 0 0 "[ . 1 .]" 1
1597 2 30 LEU HA 2 33 LEU H 3.500 . 3.500 3.192 2.891 3.509 0.009 13 0 "[ . 1 .]" 1
1598 2 30 LEU MD2 2 31 PRO QD 3.500 . 4.300 3.152 2.678 3.403 . 0 0 "[ . 1 .]" 1
1599 2 30 LEU MD1 2 55 TRP HD1 5.000 . 5.500 5.519 5.277 5.713 0.213 12 0 "[ . 1 .]" 1
1600 2 30 LEU MD1 2 55 TRP HZ2 5.000 . 5.500 5.549 5.176 5.672 0.172 12 0 "[ . 1 .]" 1
1601 2 31 PRO HA 2 34 THR HB 5.000 . 5.000 2.554 2.069 2.841 . 0 0 "[ . 1 .]" 1
1602 2 31 PRO HA 2 34 THR MG 3.500 . 4.000 3.790 3.181 4.070 0.070 5 0 "[ . 1 .]" 1
1603 2 31 PRO HA 2 138 ILE MG 5.000 . 5.500 3.268 2.862 3.695 . 0 0 "[ . 1 .]" 1
1604 2 31 PRO HA 2 138 ILE MD 5.000 . 5.500 4.417 3.358 5.175 . 0 0 "[ . 1 .]" 1
1605 2 31 PRO QB 2 138 ILE MG 3.500 . 4.300 3.353 2.879 3.764 . 0 0 "[ . 1 .]" 1
1606 2 31 PRO QB 2 138 ILE MD 3.500 . 4.300 3.035 2.321 3.780 . 0 0 "[ . 1 .]" 1
1607 2 32 PHE H 2 33 LEU H 2.700 . 2.700 2.617 2.455 2.745 0.045 12 0 "[ . 1 .]" 1
1608 2 32 PHE HA 2 35 LEU H 3.500 . 3.500 3.505 3.369 3.602 0.102 8 0 "[ . 1 .]" 1
1609 2 32 PHE HA 2 35 LEU MD1 3.500 . 4.000 3.957 3.607 4.111 0.111 6 0 "[ . 1 .]" 1
1610 2 32 PHE HA 2 36 ILE MG 5.000 . 5.500 5.612 5.492 5.683 0.183 14 0 "[ . 1 .]" 1
1611 2 32 PHE HA 2 82 ILE MD 5.000 . 5.500 4.910 4.165 5.489 . 0 0 "[ . 1 .]" 1
1612 2 32 PHE HA 2 108 LEU MD1 5.000 . 5.500 5.172 4.387 5.551 0.051 4 0 "[ . 1 .]" 1
1613 2 32 PHE HA 2 138 ILE MD 5.000 . 5.500 4.564 3.948 5.103 . 0 0 "[ . 1 .]" 1
1614 2 32 PHE QD 2 35 LEU H 5.000 . 5.300 4.936 4.368 5.334 0.034 3 0 "[ . 1 .]" 1
1615 2 32 PHE QD 2 49 ALA MB 5.000 . 5.800 4.161 3.161 5.351 . 0 0 "[ . 1 .]" 1
1616 2 32 PHE QE 2 49 ALA MB 5.000 . 5.800 5.211 3.451 5.828 0.028 6 0 "[ . 1 .]" 1
1617 2 32 PHE QD 2 82 ILE MD 3.500 . 4.300 3.788 2.883 4.122 . 0 0 "[ . 1 .]" 1
1618 2 32 PHE QD 2 82 ILE MG 5.000 . 5.800 5.053 4.224 5.747 . 0 0 "[ . 1 .]" 1
1619 2 32 PHE QE 2 82 ILE MD 3.500 . 4.300 2.277 1.799 2.770 0.001 14 0 "[ . 1 .]" 1
1620 2 32 PHE HZ 2 82 ILE MD 3.500 . 4.000 2.592 2.005 3.978 . 0 0 "[ . 1 .]" 1
1621 2 32 PHE QD 2 138 ILE MD 5.000 . 5.800 4.350 3.502 5.399 . 0 0 "[ . 1 .]" 1
1622 2 32 PHE QE 2 138 ILE MD 5.000 . 5.800 4.524 3.740 5.673 . 0 0 "[ . 1 .]" 1
1623 2 33 LEU H 2 34 THR H 2.700 . 2.700 2.565 2.422 2.718 0.018 11 0 "[ . 1 .]" 1
1624 2 33 LEU HA 2 36 ILE MD 3.500 . 4.000 3.786 2.812 4.036 0.036 9 0 "[ . 1 .]" 1
1625 2 33 LEU HA 2 36 ILE MG 5.000 . 5.500 3.007 1.852 3.645 . 0 0 "[ . 1 .]" 1
1626 2 33 LEU MD2 2 36 ILE MD 3.500 . 4.500 3.924 3.362 4.521 0.021 13 0 "[ . 1 .]" 1
1627 2 33 LEU MD1 2 55 TRP HD1 5.000 . 5.500 5.183 4.172 5.541 0.041 2 0 "[ . 1 .]" 1
1628 2 33 LEU MD1 2 55 TRP HZ2 3.500 . 4.000 3.459 2.728 4.172 0.172 12 0 "[ . 1 .]" 1
1629 2 33 LEU MD2 2 55 TRP HZ2 3.500 . 4.000 2.002 1.732 4.032 0.068 5 0 "[ . 1 .]" 1
1630 2 33 LEU MD2 2 55 TRP HD1 5.000 . 5.500 4.560 4.206 4.911 . 0 0 "[ . 1 .]" 1
1631 2 33 LEU MD2 2 55 TRP HE1 2.700 . 3.200 2.875 2.379 3.273 0.073 13 0 "[ . 1 .]" 1
1632 2 34 THR H 2 35 LEU H 3.500 . 3.500 2.786 2.536 2.966 . 0 0 "[ . 1 .]" 1
1633 2 34 THR HA 2 37 GLU QB 3.500 . 3.800 2.439 1.860 2.849 . 0 0 "[ . 1 .]" 1
1634 2 34 THR HA 2 37 GLU QG 5.000 . 5.300 4.069 3.423 4.799 . 0 0 "[ . 1 .]" 1
1635 2 34 THR HB 2 138 ILE MG 5.000 . 5.500 2.832 2.419 3.229 . 0 0 "[ . 1 .]" 1
1636 2 34 THR MG 2 35 LEU H 2.700 . 3.200 2.418 1.989 2.918 . 0 0 "[ . 1 .]" 1
1637 2 34 THR MG 2 37 GLU QB 5.000 . 5.800 3.729 3.325 4.057 . 0 0 "[ . 1 .]" 1
1638 2 34 THR MG 2 37 GLU QG 5.000 . 5.800 5.234 4.181 5.764 . 0 0 "[ . 1 .]" 1
1639 2 34 THR MG 2 38 HIS QB 3.500 . 4.300 3.878 3.632 4.550 0.250 5 0 "[ . 1 .]" 1
1640 2 34 THR MG 2 138 ILE MG 3.500 . 4.500 1.873 1.737 2.114 0.063 3 0 "[ . 1 .]" 1
1641 2 34 THR MG 2 138 ILE MD 5.000 . 6.000 3.903 3.173 4.876 . 0 0 "[ . 1 .]" 1
1642 2 34 THR MG 2 139 ALA HA 5.000 . 5.500 3.926 3.483 4.310 . 0 0 "[ . 1 .]" 1
1643 2 34 THR MG 2 139 ALA MB 3.500 . 4.500 4.465 4.147 4.613 0.113 3 0 "[ . 1 .]" 1
1644 2 34 THR MG 2 142 LYS HA 5.000 . 5.500 5.290 5.130 5.531 0.031 10 0 "[ . 1 .]" 1
1645 2 34 THR MG 2 142 LYS QE 3.500 . 4.300 2.382 1.713 3.073 0.087 10 0 "[ . 1 .]" 1
1646 2 35 LEU H 2 36 ILE H 3.500 . 3.500 2.745 2.402 3.049 . 0 0 "[ . 1 .]" 1
1647 2 35 LEU HA 2 38 HIS H 3.500 . 3.500 3.143 2.944 3.563 0.063 5 0 "[ . 1 .]" 1
1648 2 35 LEU HA 2 38 HIS QB 5.000 . 5.300 2.873 2.392 4.202 . 0 0 "[ . 1 .]" 1
1649 2 35 LEU HA 2 138 ILE MD 5.000 . 5.500 5.136 4.156 5.508 0.008 10 0 "[ . 1 .]" 1
1650 2 35 LEU MD1 2 38 HIS H 5.000 . 5.500 5.386 4.459 5.620 0.120 12 0 "[ . 1 .]" 1
1651 2 35 LEU MD2 2 38 HIS H 5.000 . 5.500 5.315 4.213 5.632 0.132 4 0 "[ . 1 .]" 1
1652 2 35 LEU MD1 2 38 HIS HD2 5.000 . 5.500 4.473 3.000 5.519 0.019 6 0 "[ . 1 .]" 1
1653 2 35 LEU MD2 2 38 HIS HD2 5.000 . 5.500 3.345 2.139 5.346 . 0 0 "[ . 1 .]" 1
1654 2 35 LEU MD2 2 39 PHE QE 3.500 . 4.300 2.719 1.911 3.522 . 0 0 "[ . 1 .]" 1
1655 2 35 LEU MD2 2 39 PHE HZ 3.500 . 4.000 3.245 2.339 3.877 . 0 0 "[ . 1 .]" 1
1656 2 35 LEU MD2 2 39 PHE QD 5.000 . 5.800 3.822 3.251 4.651 . 0 0 "[ . 1 .]" 1
1657 2 35 LEU MD2 2 80 VAL QG 5.000 . 6.000 3.523 3.157 4.021 . 0 0 "[ . 1 .]" 1
1658 2 35 LEU MD2 2 82 ILE MD 5.000 . 6.000 4.606 3.903 5.548 . 0 0 "[ . 1 .]" 1
1659 2 35 LEU MD2 2 108 LEU MD1 3.500 . 4.500 2.427 1.799 3.429 0.001 11 0 "[ . 1 .]" 1
1660 2 35 LEU MD2 2 108 LEU MD2 5.000 . 6.000 3.650 3.115 4.286 . 0 0 "[ . 1 .]" 1
1661 2 35 LEU MD2 2 135 TYR QD 6.000 . 6.800 6.280 5.125 6.829 0.029 1 0 "[ . 1 .]" 1
1662 2 35 LEU MD1 2 138 ILE MD 3.500 . 4.500 2.348 1.864 4.441 . 0 0 "[ . 1 .]" 1
1663 2 35 LEU MD1 2 138 ILE MG 5.000 . 6.000 2.328 1.752 4.938 0.048 4 0 "[ . 1 .]" 1
1664 2 35 LEU MD2 2 138 ILE MD 3.500 . 4.500 3.618 2.989 4.253 . 0 0 "[ . 1 .]" 1
1665 2 35 LEU MD2 2 138 ILE MG 3.500 . 4.500 4.089 3.219 4.513 0.013 2 0 "[ . 1 .]" 1
1666 2 35 LEU MD2 2 141 ALA MB 5.000 . 6.000 3.481 2.734 4.076 . 0 0 "[ . 1 .]" 1
1667 2 35 LEU MD2 2 142 LYS HA 5.000 . 5.500 2.527 1.840 3.372 . 0 0 "[ . 1 .]" 1
1668 2 35 LEU MD2 2 142 LYS QE 5.000 . 5.800 4.872 3.964 5.596 . 0 0 "[ . 1 .]" 1
1669 2 35 LEU QB 2 145 ILE MD 5.000 . 5.800 4.242 3.607 4.782 . 0 0 "[ . 1 .]" 1
1670 2 35 LEU MD2 2 145 ILE MD 3.500 . 4.500 2.176 1.799 2.846 0.001 3 0 "[ . 1 .]" 1
1671 2 35 LEU MD2 2 145 ILE MG 3.500 . 4.500 2.133 1.736 2.694 0.064 12 0 "[ . 1 .]" 1
1672 2 35 LEU MD1 2 145 ILE MD 3.500 . 4.500 3.533 3.075 4.203 . 0 0 "[ . 1 .]" 1
1673 2 36 ILE H 2 37 GLU H 2.700 . 2.700 2.674 2.476 2.788 0.088 6 0 "[ . 1 .]" 1
1674 2 36 ILE HA 2 39 PHE H 5.000 . 5.000 3.352 3.064 3.551 . 0 0 "[ . 1 .]" 1
1675 2 36 ILE HA 2 39 PHE QB 5.000 . 5.300 2.125 1.848 2.394 . 0 0 "[ . 1 .]" 1
1676 2 36 ILE HA 2 39 PHE QD 3.500 . 3.800 2.120 1.702 2.858 0.098 7 0 "[ . 1 .]" 1
1677 2 36 ILE MG 2 37 GLU HA 3.500 . 4.000 3.220 2.908 3.740 . 0 0 "[ . 1 .]" 1
1678 2 36 ILE MG 2 39 PHE QD 5.000 . 5.800 4.059 3.713 4.359 . 0 0 "[ . 1 .]" 1
1679 2 36 ILE MG 2 39 PHE QE 5.000 . 5.800 5.791 5.516 5.921 0.121 7 0 "[ . 1 .]" 1
1680 2 36 ILE MD 2 39 PHE QD 5.000 . 5.800 2.871 1.767 3.529 0.033 14 0 "[ . 1 .]" 1
1681 2 36 ILE MD 2 39 PHE QE 5.000 . 5.800 3.505 2.971 4.042 . 0 0 "[ . 1 .]" 1
1682 2 36 ILE MD 2 39 PHE HZ 5.000 . 5.500 5.462 4.964 5.571 0.071 8 0 "[ . 1 .]" 1
1683 2 36 ILE MG 2 40 GLU QB 5.000 . 5.800 3.612 3.043 4.133 . 0 0 "[ . 1 .]" 1
1684 2 36 ILE MD 2 46 VAL MG1 5.000 . 6.000 2.703 1.831 3.543 . 0 0 "[ . 1 .]" 1
1685 2 36 ILE MG 2 46 VAL MG1 3.500 . 4.500 2.881 1.880 3.678 . 0 0 "[ . 1 .]" 1
1686 2 36 ILE MG 2 46 VAL MG2 5.000 . 6.000 2.220 1.819 3.470 . 0 0 "[ . 1 .]" 1
1687 2 36 ILE MG 2 49 ALA MB 3.500 . 4.500 4.006 3.141 4.511 0.011 3 0 "[ . 1 .]" 1
1688 2 36 ILE MD 2 49 ALA MB 5.000 . 6.000 3.429 2.261 4.182 . 0 0 "[ . 1 .]" 1
1689 2 36 ILE MG 2 51 ARG QD 3.500 . 4.300 3.127 2.167 4.206 . 0 0 "[ . 1 .]" 1
1690 2 36 ILE MD 2 51 ARG QD 5.000 . 5.800 5.130 3.969 5.829 0.029 11 0 "[ . 1 .]" 1
1691 2 36 ILE MD 2 55 TRP HZ2 5.000 . 5.500 5.384 4.629 5.582 0.082 8 0 "[ . 1 .]" 1
1692 2 37 GLU H 2 38 HIS H 2.700 . 2.700 2.605 2.463 2.764 0.064 5 0 "[ . 1 .]" 1
1693 2 37 GLU HA 2 40 GLU H 3.500 . 3.500 3.374 3.191 3.545 0.045 11 0 "[ . 1 .]" 1
1694 2 37 GLU HA 2 40 GLU QB 3.500 . 3.800 3.081 2.814 3.330 . 0 0 "[ . 1 .]" 1
1695 2 37 GLU HA 2 40 GLU QG 5.000 . 5.300 4.426 3.331 5.277 . 0 0 "[ . 1 .]" 1
1696 2 37 GLU HA 2 41 LYS QG 5.000 . 5.300 4.348 3.223 5.373 0.073 8 0 "[ . 1 .]" 1
1697 2 37 GLU HA 2 41 LYS QE 5.000 . 5.300 4.440 3.081 5.158 . 0 0 "[ . 1 .]" 1
1698 2 37 GLU QG 2 41 LYS QG 5.000 . 5.600 3.339 2.275 4.380 . 0 0 "[ . 1 .]" 1
1699 2 37 GLU QG 2 41 LYS QE 3.500 . 4.100 2.876 1.924 3.957 . 0 0 "[ . 1 .]" 1
1700 2 38 HIS H 2 39 PHE H 2.700 . 2.700 2.515 2.393 2.657 . 0 0 "[ . 1 .]" 1
1701 2 38 HIS HA 2 41 LYS H 3.500 . 3.500 3.325 3.015 3.591 0.091 11 0 "[ . 1 .]" 1
1702 2 38 HIS HA 2 42 GLN H 3.500 . 3.500 3.588 3.517 3.654 0.154 13 0 "[ . 1 .]" 1
1703 2 38 HIS HA 2 41 LYS QG 5.000 . 5.300 3.762 2.800 4.654 . 0 0 "[ . 1 .]" 1
1704 2 38 HIS HA 2 41 LYS QE 3.500 . 3.800 2.863 1.911 3.744 . 0 0 "[ . 1 .]" 1
1705 2 38 HIS HA 2 142 LYS QE 5.000 . 5.300 5.076 4.768 5.366 0.066 4 0 "[ . 1 .]" 1
1706 2 38 HIS HD2 2 39 PHE HA 5.000 . 5.000 4.410 3.191 5.050 0.050 2 0 "[ . 1 .]" 1
1707 2 38 HIS HD2 2 142 LYS HA 5.000 . 5.000 4.346 3.763 5.017 0.017 1 0 "[ . 1 .]" 1
1708 2 38 HIS HD2 2 145 ILE MG 5.000 . 5.500 4.222 3.622 5.155 . 0 0 "[ . 1 .]" 1
1709 2 39 PHE H 2 40 GLU H 2.700 . 2.700 2.572 2.380 2.712 0.012 8 0 "[ . 1 .]" 1
1710 2 39 PHE HA 2 44 LEU MD1 2.700 . 3.200 2.173 1.894 2.417 . 0 0 "[ . 1 .]" 1
1711 2 39 PHE HA 2 42 GLN QB 5.000 . 5.300 3.183 2.640 3.662 . 0 0 "[ . 1 .]" 1
1712 2 39 PHE HA 2 42 GLN QG 3.500 . 3.800 3.770 3.631 3.862 0.062 12 0 "[ . 1 .]" 1
1713 2 39 PHE HA 2 46 VAL MG2 5.000 . 5.500 4.118 3.866 4.530 . 0 0 "[ . 1 .]" 1
1714 2 39 PHE QB 2 44 LEU MD2 5.000 . 5.800 4.840 4.640 5.036 . 0 0 "[ . 1 .]" 1
1715 2 39 PHE QB 2 44 LEU MD1 3.500 . 4.300 3.661 3.357 3.880 . 0 0 "[ . 1 .]" 1
1716 2 39 PHE QB 2 46 VAL MG2 3.500 . 4.300 1.841 1.667 2.197 0.133 11 0 "[ . 1 .]" 1
1717 2 39 PHE QD 2 42 GLN H 5.000 . 5.300 4.941 4.578 5.352 0.052 8 0 "[ . 1 .]" 1
1718 2 39 PHE QD 2 44 LEU MD1 3.500 . 4.300 1.731 1.657 1.781 0.143 15 0 "[ . 1 .]" 1
1719 2 39 PHE QE 2 44 LEU MD1 3.500 . 4.300 2.134 1.795 2.550 0.005 2 0 "[ . 1 .]" 1
1720 2 39 PHE HZ 2 44 LEU MD1 3.500 . 4.000 4.038 3.928 4.143 0.143 8 0 "[ . 1 .]" 1
1721 2 39 PHE QD 2 44 LEU MD2 5.000 . 5.800 3.802 3.470 4.290 . 0 0 "[ . 1 .]" 1
1722 2 39 PHE QD 2 46 VAL MG1 3.500 . 4.300 3.355 2.162 4.337 0.037 12 0 "[ . 1 .]" 1
1723 2 39 PHE QE 2 46 VAL MG1 5.000 . 5.800 4.417 3.348 5.481 . 0 0 "[ . 1 .]" 1
1724 2 39 PHE QD 2 46 VAL MG2 3.500 . 4.300 2.187 1.774 2.947 0.026 1 0 "[ . 1 .]" 1
1725 2 39 PHE QE 2 46 VAL MG2 5.000 . 5.800 3.877 3.397 4.403 . 0 0 "[ . 1 .]" 1
1726 2 39 PHE QD 2 80 VAL QG 5.000 . 5.800 4.436 3.813 4.889 . 0 0 "[ . 1 .]" 1
1727 2 39 PHE QE 2 80 VAL QG 3.500 . 4.300 2.859 1.908 3.423 . 0 0 "[ . 1 .]" 1
1728 2 39 PHE HZ 2 80 VAL QG 3.500 . 4.000 2.601 2.051 3.269 . 0 0 "[ . 1 .]" 1
1729 2 39 PHE QE 2 145 ILE MG 3.500 . 4.300 3.527 2.670 4.203 . 0 0 "[ . 1 .]" 1
1730 2 39 PHE HZ 2 145 ILE MG 3.500 . 4.000 3.162 2.298 3.852 . 0 0 "[ . 1 .]" 1
1731 2 39 PHE HZ 2 145 ILE MD 5.000 . 5.500 2.658 2.063 3.397 . 0 0 "[ . 1 .]" 1
1732 2 39 PHE QD 2 149 ILE MD 5.000 . 5.800 4.522 4.057 5.032 . 0 0 "[ . 1 .]" 1
1733 2 39 PHE QE 2 149 ILE MD 2.700 . 3.500 2.708 2.190 3.126 . 0 0 "[ . 1 .]" 1
1734 2 39 PHE HZ 2 149 ILE MD 2.700 . 3.200 2.462 2.018 3.172 . 0 0 "[ . 1 .]" 1
1735 2 39 PHE QD 2 149 ILE MG 5.000 . 5.800 5.592 5.125 5.815 0.015 5 0 "[ . 1 .]" 1
1736 2 39 PHE QE 2 149 ILE MG 5.000 . 5.800 4.016 3.338 4.446 . 0 0 "[ . 1 .]" 1
1737 2 39 PHE HZ 2 149 ILE MG 5.000 . 5.500 4.796 4.149 5.260 . 0 0 "[ . 1 .]" 1
1738 2 40 GLU H 2 41 LYS H 2.700 . 2.700 2.459 2.326 2.665 . 0 0 "[ . 1 .]" 1
1739 2 40 GLU H 2 46 VAL MG2 3.500 . 4.000 3.310 2.496 3.786 . 0 0 "[ . 1 .]" 1
1740 2 40 GLU HA 2 46 VAL MG2 5.000 . 5.500 4.250 3.708 4.865 . 0 0 "[ . 1 .]" 1
1741 2 40 GLU HA 2 45 GLU HA 5.000 . 5.000 3.812 3.140 4.555 . 0 0 "[ . 1 .]" 1
1742 2 40 GLU QG 2 46 VAL MG2 3.500 . 4.300 2.860 2.135 4.016 . 0 0 "[ . 1 .]" 1
1743 2 40 GLU QG 2 46 VAL MG1 5.000 . 5.800 4.734 3.975 5.559 . 0 0 "[ . 1 .]" 1
1744 2 41 LYS H 2 42 GLN H 2.700 . 2.700 2.362 2.097 2.525 . 0 0 "[ . 1 .]" 1
1745 2 41 LYS H 2 43 GLY H 5.000 . 5.000 3.617 3.365 3.852 . 0 0 "[ . 1 .]" 1
1746 2 42 GLN H 2 43 GLY H 2.700 . 2.700 2.424 2.350 2.489 . 0 0 "[ . 1 .]" 1
1747 2 42 GLN H 2 44 LEU H 3.500 . 3.500 3.570 3.460 3.639 0.139 9 0 "[ . 1 .]" 1
1748 2 42 GLN H 2 44 LEU MD1 3.500 . 4.000 4.041 4.002 4.099 0.099 10 0 "[ . 1 .]" 1
1749 2 42 GLN H 2 44 LEU QB 5.000 . 5.300 5.001 4.869 5.139 . 0 0 "[ . 1 .]" 1
1750 2 42 GLN HA 2 44 LEU H 5.000 . 5.000 4.938 4.719 5.043 0.043 7 0 "[ . 1 .]" 1
1751 2 42 GLN QB 2 44 LEU MD1 3.500 . 4.300 2.406 2.132 2.682 . 0 0 "[ . 1 .]" 1
1752 2 42 GLN QG 2 44 LEU MD1 3.500 . 4.300 2.840 1.846 3.184 . 0 0 "[ . 1 .]" 1
1753 2 42 GLN QB 2 44 LEU MD2 5.000 . 5.800 2.639 1.986 3.529 . 0 0 "[ . 1 .]" 1
1754 2 42 GLN QG 2 44 LEU MD2 5.000 . 5.800 3.785 1.778 4.799 0.022 10 0 "[ . 1 .]" 1
1755 2 43 GLY H 2 44 LEU H 2.700 . 2.700 1.730 1.688 1.781 0.112 5 0 "[ . 1 .]" 1
1756 2 43 GLY H 2 44 LEU QB 5.000 . 5.300 4.176 4.049 4.286 . 0 0 "[ . 1 .]" 1
1757 2 43 GLY H 2 44 LEU MD1 3.500 . 4.000 4.106 4.062 4.170 0.170 12 0 "[ . 1 .]" 1
1758 2 44 LEU HA 2 45 GLU H 2.700 . 2.700 2.205 2.170 2.249 . 0 0 "[ . 1 .]" 1
1759 2 44 LEU MD2 2 45 GLU H 3.500 . 4.000 4.037 3.966 4.109 0.109 11 0 "[ . 1 .]" 1
1760 2 44 LEU MD2 2 149 ILE MG 5.000 . 6.000 4.474 3.986 5.052 . 0 0 "[ . 1 .]" 1
1761 2 45 GLU HA 2 46 VAL H 2.700 . 2.700 2.153 2.129 2.193 . 0 0 "[ . 1 .]" 1
1762 2 45 GLU H 2 47 PHE QD 5.000 . 5.300 5.146 4.765 5.451 0.151 15 0 "[ . 1 .]" 1
1763 2 45 GLU QB 2 47 PHE QD 3.500 . 4.100 2.779 2.328 3.320 . 0 0 "[ . 1 .]" 1
1764 2 46 VAL MG1 2 49 ALA MB 3.500 . 4.500 2.484 1.835 3.193 . 0 0 "[ . 1 .]" 1
1765 2 47 PHE QR 2 72 GLU HA 5.000 . 6.500 2.848 2.127 3.452 . 0 0 "[ . 1 .]" 1
1766 2 47 PHE QR 2 76 ALA H 3.500 . 5.000 3.778 2.445 4.851 . 0 0 "[ . 1 .]" 1
1767 2 47 PHE QR 2 76 ALA MB 2.700 . 4.700 3.412 2.549 3.920 . 0 0 "[ . 1 .]" 1
1768 2 47 PHE QR 2 76 ALA HA 3.500 . 5.000 3.239 1.827 3.621 . 0 0 "[ . 1 .]" 1
1769 2 47 PHE QR 2 75 LYS QB 3.500 . 5.300 2.683 1.827 3.974 . 0 0 "[ . 1 .]" 1
1770 2 47 PHE QD 2 75 LYS QD 3.500 . 4.100 3.704 2.231 4.111 0.011 5 0 "[ . 1 .]" 1
1771 2 47 PHE QE 2 75 LYS QD 3.500 . 4.100 2.531 1.820 3.833 . 0 0 "[ . 1 .]" 1
1772 2 47 PHE QD 2 75 LYS QE 2.700 . 3.300 2.714 2.010 3.336 0.036 5 0 "[ . 1 .]" 1
1773 2 47 PHE QE 2 75 LYS QE 2.700 . 3.300 2.645 1.845 3.299 . 0 0 "[ . 1 .]" 1
1774 2 49 ALA MB 2 55 TRP HZ2 5.000 . 5.500 4.637 3.389 5.313 . 0 0 "[ . 1 .]" 1
1775 2 49 ALA MB 2 51 ARG HA 3.500 . 4.000 4.065 3.755 4.193 0.193 14 0 "[ . 1 .]" 1
1776 2 49 ALA MB 2 51 ARG QD 5.000 . 5.800 3.382 2.236 4.415 . 0 0 "[ . 1 .]" 1
1777 2 50 HIS H 2 55 TRP HE1 5.000 . 5.000 4.775 4.311 5.036 0.036 13 0 "[ . 1 .]" 1
1778 2 51 ARG HA 2 55 TRP HD1 3.500 . 3.500 3.446 2.663 3.638 0.138 14 0 "[ . 1 .]" 1
1779 2 51 ARG HA 2 55 TRP HE1 3.500 . 3.500 2.111 1.777 2.508 0.023 12 0 "[ . 1 .]" 1
1780 2 51 ARG HA 2 55 TRP HZ2 5.000 . 5.000 3.074 2.642 4.876 . 0 0 "[ . 1 .]" 1
1781 2 53 GLU HA 2 58 GLN H 5.000 . 5.000 4.016 3.119 5.077 0.077 11 0 "[ . 1 .]" 1
1782 2 53 GLU HA 2 60 LEU MD2 3.500 . 4.000 3.705 2.504 4.033 0.033 13 0 "[ . 1 .]" 1
1783 2 53 GLU HA 2 60 LEU MD1 5.000 . 5.500 4.929 3.435 5.501 0.001 8 0 "[ . 1 .]" 1
1784 2 53 GLU QG 2 60 LEU MD2 3.500 . 4.300 2.801 1.923 3.935 . 0 0 "[ . 1 .]" 1
1785 2 53 GLU QG 2 60 LEU MD1 5.000 . 5.800 3.249 2.038 4.849 . 0 0 "[ . 1 .]" 1
1786 2 54 ALA H 2 55 TRP H 2.700 . 2.700 2.644 2.418 2.799 0.099 12 0 "[ . 1 .]" 1
1787 2 54 ALA H 2 55 TRP HE1 5.000 . 5.000 4.403 3.909 4.973 . 0 0 "[ . 1 .]" 1
1788 2 54 ALA HA 2 55 TRP HE1 5.000 . 5.000 5.025 4.486 5.235 0.235 9 0 "[ . 1 .]" 1
1789 2 54 ALA HA 2 55 TRP HD1 3.500 . 3.500 3.543 3.419 3.834 0.334 12 0 "[ . 1 .]" 1
1790 2 54 ALA MB 2 55 TRP HD1 3.500 . 4.000 2.064 1.709 2.246 0.091 13 0 "[ . 1 .]" 1
1791 2 54 ALA MB 2 55 TRP HE1 3.500 . 4.000 2.240 1.772 2.529 0.028 12 0 "[ . 1 .]" 1
1792 2 54 ALA HA 2 56 GLY H 5.000 . 5.000 4.420 3.782 4.942 . 0 0 "[ . 1 .]" 1
1793 2 54 ALA HA 2 57 ALA H 5.000 . 5.000 4.249 3.752 4.900 . 0 0 "[ . 1 .]" 1
1794 2 54 ALA HA 2 58 GLN QB 5.000 . 5.300 2.824 1.716 5.237 0.084 9 0 "[ . 1 .]" 1
1795 2 54 ALA HA 2 60 LEU MD2 5.000 . 5.500 4.111 2.881 5.426 . 0 0 "[ . 1 .]" 1
1796 2 54 ALA MB 2 58 GLN QB 5.000 . 5.800 3.864 2.902 5.903 0.103 11 0 "[ . 1 .]" 1
1797 2 54 ALA MB 2 58 GLN QG 5.000 . 5.800 3.425 1.797 4.806 0.003 10 0 "[ . 1 .]" 1
1798 2 54 ALA MB 2 59 VAL QG 5.000 . 6.000 5.626 4.840 6.141 0.141 12 0 "[ . 1 .]" 1
1799 2 54 ALA MB 2 60 LEU MD1 5.000 . 6.000 4.798 3.722 5.841 . 0 0 "[ . 1 .]" 1
1800 2 54 ALA MB 2 60 LEU MD2 5.000 . 6.000 4.454 3.701 5.251 . 0 0 "[ . 1 .]" 1
1801 2 55 TRP H 2 56 GLY H 2.700 . 2.700 1.945 1.763 2.280 0.037 13 0 "[ . 1 .]" 1
1802 2 56 GLY H 2 57 ALA H 2.700 . 2.700 2.249 1.774 2.624 0.026 14 0 "[ . 1 .]" 1
1803 2 56 GLY QA 2 57 ALA H 3.500 . 3.800 2.800 2.583 2.936 . 0 0 "[ . 1 .]" 1
1804 2 57 ALA MB 2 58 GLN H 3.500 . 4.000 2.939 1.942 3.725 . 0 0 "[ . 1 .]" 1
1805 2 58 GLN HA 2 59 VAL H 2.700 . 2.700 2.630 2.331 2.788 0.088 10 0 "[ . 1 .]" 1
1806 2 58 GLN QB 2 60 LEU MD1 5.000 . 5.800 5.691 4.864 5.939 0.139 15 0 "[ . 1 .]" 1
1807 2 58 GLN QG 2 60 LEU MD2 3.500 . 4.300 3.924 2.614 4.353 0.053 9 0 "[ . 1 .]" 1
1808 2 59 VAL HA 2 60 LEU H 2.700 . 2.700 2.653 2.297 2.785 0.085 6 0 "[ . 1 .]" 1
1809 2 59 VAL HB 2 60 LEU H 5.000 . 5.000 4.329 4.171 4.554 . 0 0 "[ . 1 .]" 1
1810 2 59 VAL MG2 2 61 THR MG 5.000 . 6.000 6.151 6.063 6.239 0.239 15 0 "[ . 1 .]" 1
1811 2 59 VAL MG1 2 61 THR MG 5.000 . 6.000 4.457 4.079 6.004 0.004 13 0 "[ . 1 .]" 1
1812 1 119 PHE QD 2 59 VAL HA 5.000 . 5.300 5.162 4.756 5.454 0.154 11 0 "[ . 1 .]" 1
1813 1 119 PHE QD 2 59 VAL MG1 3.500 . 4.300 3.949 3.406 4.326 0.026 6 0 "[ . 1 .]" 1
1814 1 119 PHE QE 2 59 VAL MG1 3.500 . 4.300 2.608 2.065 3.071 . 0 0 "[ . 1 .]" 1
1815 1 119 PHE QE 2 59 VAL MG2 5.000 . 5.800 3.556 1.824 4.307 . 0 0 "[ . 1 .]" 1
1816 2 60 LEU HA 2 61 THR H 2.700 . 2.700 2.667 2.145 2.910 0.210 7 0 "[ . 1 .]" 1
1817 2 60 LEU HA 2 61 THR MG 5.000 . 5.500 3.194 2.800 3.477 . 0 0 "[ . 1 .]" 1
1818 2 60 LEU QB 2 61 THR MG 5.000 . 5.800 3.831 3.444 4.324 . 0 0 "[ . 1 .]" 1
1819 2 60 LEU MD2 2 61 THR MG 3.500 . 4.500 4.505 4.083 4.654 0.154 14 0 "[ . 1 .]" 1
1820 2 60 LEU MD2 2 61 THR H 3.500 . 4.000 3.913 3.707 4.143 0.143 14 0 "[ . 1 .]" 1
1821 2 60 LEU MD2 2 64 GLU QB 3.500 . 4.300 4.210 3.868 4.345 0.045 14 0 "[ . 1 .]" 1
1822 2 60 LEU MD2 2 64 GLU QG 5.000 . 5.800 4.950 3.176 5.769 . 0 0 "[ . 1 .]" 1
1823 2 60 LEU QD 2 65 CYS H 3.500 . 4.000 3.758 3.242 4.019 0.019 15 0 "[ . 1 .]" 1
1824 2 60 LEU MD1 2 65 CYS HA 5.000 . 5.500 3.362 2.566 5.430 . 0 0 "[ . 1 .]" 1
1825 2 60 LEU MD1 2 65 CYS QB 3.500 . 4.300 3.363 2.342 4.312 0.012 15 0 "[ . 1 .]" 1
1826 2 60 LEU MD2 2 65 CYS QB 5.000 . 5.800 4.575 3.487 5.203 . 0 0 "[ . 1 .]" 1
1827 1 119 PHE HZ 2 60 LEU MD1 5.000 . 5.500 5.416 5.188 5.576 0.076 15 0 "[ . 1 .]" 1
1828 1 119 PHE QE 2 60 LEU MD1 5.000 . 5.800 5.210 4.576 5.613 . 0 0 "[ . 1 .]" 1
1829 1 119 PHE HZ 2 60 LEU MD2 5.000 . 5.500 4.982 3.800 5.430 . 0 0 "[ . 1 .]" 1
1830 1 119 PHE QE 2 60 LEU MD2 5.000 . 5.800 5.063 4.042 5.394 . 0 0 "[ . 1 .]" 1
1831 2 61 THR H 2 63 GLU H 5.000 . 5.000 5.070 5.010 5.173 0.173 12 0 "[ . 1 .]" 1
1832 2 61 THR H 2 64 GLU H 6.000 . 6.000 4.052 3.683 5.138 . 0 0 "[ . 1 .]" 1
1833 2 61 THR H 2 65 CYS H 6.000 . 6.000 3.443 2.613 4.696 . 0 0 "[ . 1 .]" 1
1834 2 61 THR HA 2 62 PRO QD 2.700 . 3.000 1.977 1.836 2.247 . 0 0 "[ . 1 .]" 1
1835 2 61 THR MG 2 62 PRO QD 3.500 . 4.300 3.219 2.964 3.537 . 0 0 "[ . 1 .]" 1
1836 2 61 THR MG 2 64 GLU H 5.000 . 5.500 5.024 4.612 5.448 . 0 0 "[ . 1 .]" 1
1837 2 61 THR MG 2 63 GLU QB 5.000 . 5.800 4.713 4.260 5.124 . 0 0 "[ . 1 .]" 1
1838 2 61 THR MG 2 64 GLU QB 3.500 . 4.300 4.065 3.363 4.321 0.021 7 0 "[ . 1 .]" 1
1839 2 61 THR MG 2 63 GLU QG 5.000 . 5.800 5.376 4.197 5.832 0.032 15 0 "[ . 1 .]" 1
1840 2 61 THR MG 2 64 GLU QG 5.000 . 5.800 4.975 2.682 5.814 0.014 4 0 "[ . 1 .]" 1
1841 1 119 PHE QD 2 61 THR MG 5.000 . 5.800 5.017 4.577 5.502 . 0 0 "[ . 1 .]" 1
1842 1 119 PHE QE 2 61 THR MG 3.500 . 4.300 4.092 3.792 4.375 0.075 7 0 "[ . 1 .]" 1
1843 1 119 PHE QD 2 62 PRO HA 3.500 . 3.800 3.503 2.871 3.826 0.026 11 0 "[ . 1 .]" 1
1844 2 63 GLU H 2 64 GLU H 2.700 . 2.700 2.736 2.650 2.832 0.132 8 0 "[ . 1 .]" 1
1845 2 63 GLU HA 2 66 THR H 5.000 . 5.000 4.821 4.626 4.990 . 0 0 "[ . 1 .]" 1
1846 2 63 GLU HA 2 67 PRO QD 5.000 . 5.300 3.085 2.802 3.389 . 0 0 "[ . 1 .]" 1
1847 1 123 GLY QA 2 63 GLU HA 5.000 . 5.300 3.393 3.072 3.788 . 0 0 "[ . 1 .]" 1
1848 1 126 THR MG 2 63 GLU HA 2.700 . 3.200 2.493 1.753 3.101 0.047 10 0 "[ . 1 .]" 1
1849 1 123 GLY QA 2 63 GLU QG 5.000 . 5.600 3.985 3.312 5.155 . 0 0 "[ . 1 .]" 1
1850 1 126 THR MG 2 63 GLU QG 2.700 . 3.500 3.031 2.017 3.484 . 0 0 "[ . 1 .]" 1
1851 1 127 VAL MG1 2 63 GLU QB 5.000 . 5.800 5.579 5.261 5.821 0.021 6 0 "[ . 1 .]" 1
1852 2 64 GLU H 2 65 CYS H 2.700 . 2.700 2.278 2.072 2.481 . 0 0 "[ . 1 .]" 1
1853 2 64 GLU HA 2 67 PRO QD 5.000 . 5.300 3.338 2.933 4.079 . 0 0 "[ . 1 .]" 1
1854 2 65 CYS H 2 66 THR H 3.500 . 3.500 2.787 2.635 2.940 . 0 0 "[ . 1 .]" 1
1855 2 65 CYS HA 2 68 LEU H 6.000 . 6.000 4.151 3.763 4.492 . 0 0 "[ . 1 .]" 1
1856 2 65 CYS HA 2 68 LEU QB 5.000 . 5.300 3.300 2.882 4.463 . 0 0 "[ . 1 .]" 1
1857 2 65 CYS HA 2 68 LEU MD1 3.500 . 4.000 3.508 2.881 4.002 0.002 11 0 "[ . 1 .]" 1
1858 2 65 CYS HA 2 68 LEU MD2 5.000 . 5.500 4.764 1.767 5.592 0.092 6 0 "[ . 1 .]" 1
1859 2 66 THR HA 2 69 ASP H 5.000 . 5.000 3.700 3.552 4.060 . 0 0 "[ . 1 .]" 1
1860 2 66 THR MG 2 67 PRO QD 2.700 . 3.500 2.412 1.799 3.163 0.001 14 0 "[ . 1 .]" 1
1861 2 66 THR MG 2 70 GLN QG 5.000 . 5.800 4.552 2.794 5.736 . 0 0 "[ . 1 .]" 1
1862 2 66 THR MG 2 93 VAL MG1 5.000 . 6.000 4.721 4.358 5.077 . 0 0 "[ . 1 .]" 1
1863 2 66 THR MG 2 97 TRP HZ2 3.500 . 4.000 3.300 2.685 3.764 . 0 0 "[ . 1 .]" 1
1864 2 66 THR MG 2 97 TRP HH2 5.000 . 5.500 2.059 1.723 2.513 0.077 15 0 "[ . 1 .]" 1
1865 1 120 LEU MD2 2 66 THR HA 3.500 . 4.000 3.397 2.740 3.877 . 0 0 "[ . 1 .]" 1
1866 1 120 LEU MD1 2 66 THR HB 5.000 . 5.500 5.297 4.792 5.614 0.114 10 0 "[ . 1 .]" 1
1867 1 120 LEU MD2 2 66 THR HB 5.000 . 5.500 4.763 4.205 5.342 . 0 0 "[ . 1 .]" 1
1868 1 126 THR MG 2 66 THR HB 5.000 . 5.500 3.535 3.043 3.925 . 0 0 "[ . 1 .]" 1
1869 1 127 VAL MG1 2 66 THR HB 3.500 . 4.000 3.257 2.336 3.862 . 0 0 "[ . 1 .]" 1
1870 1 127 VAL MG2 2 66 THR HB 3.500 . 4.000 3.894 3.463 4.071 0.071 15 0 "[ . 1 .]" 1
1871 1 120 LEU HA 2 66 THR MG 5.000 . 5.500 3.088 2.131 4.242 . 0 0 "[ . 1 .]" 1
1872 1 120 LEU MD1 2 66 THR MG 3.500 . 4.500 3.800 2.611 4.513 0.013 11 0 "[ . 1 .]" 1
1873 1 120 LEU MD2 2 66 THR MG 3.500 . 4.500 2.762 1.974 4.042 . 0 0 "[ . 1 .]" 1
1874 1 123 GLY QA 2 66 THR MG 3.500 . 4.300 2.221 1.799 2.493 0.001 15 0 "[ . 1 .]" 1
1875 1 124 LEU HA 2 66 THR MG 3.500 . 4.000 2.748 2.566 2.966 . 0 0 "[ . 1 .]" 1
1876 1 124 LEU MD1 2 66 THR MG 3.500 . 4.500 2.546 1.805 3.628 . 0 0 "[ . 1 .]" 1
1877 1 124 LEU MD2 2 66 THR MG 5.000 . 6.000 4.209 1.784 4.856 0.016 14 0 "[ . 1 .]" 1
1878 1 126 THR MG 2 66 THR MG 3.500 . 4.500 3.114 2.540 3.647 . 0 0 "[ . 1 .]" 1
1879 1 127 VAL HB 2 66 THR MG 3.500 . 4.000 3.779 3.453 4.030 0.030 8 0 "[ . 1 .]" 1
1880 1 127 VAL MG1 2 66 THR MG 3.500 . 4.500 1.974 1.782 2.473 0.018 6 0 "[ . 1 .]" 1
1881 1 127 VAL MG2 2 66 THR MG 2.700 . 3.700 1.889 1.735 2.269 0.065 1 0 "[ . 1 .]" 1
1882 2 67 PRO HA 2 70 GLN QB 5.000 . 5.300 3.327 2.696 4.573 . 0 0 "[ . 1 .]" 1
1883 2 67 PRO HA 2 70 GLN H 5.000 . 5.000 3.847 3.540 4.094 . 0 0 "[ . 1 .]" 1
1884 1 126 THR MG 2 67 PRO HA 5.000 . 5.500 4.806 4.368 5.233 . 0 0 "[ . 1 .]" 1
1885 1 127 VAL MG1 2 67 PRO HA 3.500 . 4.000 2.003 1.777 2.612 0.023 12 0 "[ . 1 .]" 1
1886 1 127 VAL MG2 2 67 PRO HA 5.000 . 5.500 3.884 3.407 4.250 . 0 0 "[ . 1 .]" 1
1887 1 120 LEU MD2 2 67 PRO QD 5.000 . 5.800 5.405 4.607 5.804 0.004 1 0 "[ . 1 .]" 1
1888 1 123 GLY QA 2 67 PRO QD 5.000 . 5.600 2.883 2.572 3.196 . 0 0 "[ . 1 .]" 1
1889 1 124 LEU MD1 2 67 PRO QD 5.000 . 5.800 5.524 4.847 5.864 0.064 14 0 "[ . 1 .]" 1
1890 1 126 THR MG 2 67 PRO QD 3.500 . 4.300 3.029 2.693 3.478 . 0 0 "[ . 1 .]" 1
1891 1 126 THR MG 2 67 PRO QG 5.000 . 5.800 3.052 2.004 4.116 . 0 0 "[ . 1 .]" 1
1892 1 126 THR MG 2 67 PRO QB 5.000 . 5.800 4.035 3.536 4.564 . 0 0 "[ . 1 .]" 1
1893 1 127 VAL MG1 2 67 PRO QB 3.500 . 4.300 2.307 1.727 2.969 0.073 3 0 "[ . 1 .]" 1
1894 1 127 VAL MG1 2 67 PRO QG 3.500 . 4.300 2.588 1.870 3.621 . 0 0 "[ . 1 .]" 1
1895 1 127 VAL MG2 2 67 PRO QD 5.000 . 5.800 3.814 3.223 4.245 . 0 0 "[ . 1 .]" 1
1896 1 127 VAL MG1 2 67 PRO QD 5.000 . 5.800 2.510 1.967 2.946 . 0 0 "[ . 1 .]" 1
1897 2 68 LEU H 2 69 ASP H 2.700 . 2.700 2.605 2.473 2.754 0.054 15 0 "[ . 1 .]" 1
1898 2 68 LEU HA 2 71 LEU H 3.500 . 3.500 3.589 3.530 3.636 0.136 14 0 "[ . 1 .]" 1
1899 2 69 ASP H 2 70 GLN H 2.700 . 2.700 2.696 2.546 2.766 0.066 12 0 "[ . 1 .]" 1
1900 2 69 ASP HA 2 72 GLU QB 3.500 . 3.800 2.679 2.079 3.138 . 0 0 "[ . 1 .]" 1
1901 2 70 GLN H 2 71 LEU H 2.700 . 2.700 2.728 2.634 2.763 0.063 15 0 "[ . 1 .]" 1
1902 2 70 GLN HA 2 73 ILE H 5.000 . 5.000 3.246 2.876 3.501 . 0 0 "[ . 1 .]" 1
1903 2 70 GLN HA 2 73 ILE MD 3.500 . 4.000 3.388 3.053 3.678 . 0 0 "[ . 1 .]" 1
1904 2 70 GLN HA 2 73 ILE MG 5.000 . 5.500 3.696 3.101 4.311 . 0 0 "[ . 1 .]" 1
1905 2 70 GLN HA 2 74 ARG QD 5.000 . 5.300 4.394 3.568 5.238 . 0 0 "[ . 1 .]" 1
1906 2 70 GLN HA 2 101 PHE QD 5.000 . 5.300 5.261 4.852 5.417 0.117 13 0 "[ . 1 .]" 1
1907 2 70 GLN HA 2 97 TRP HE3 3.500 . 3.500 3.097 2.324 3.539 0.039 10 0 "[ . 1 .]" 1
1908 2 70 GLN HA 2 97 TRP HH2 5.000 . 5.000 4.303 3.837 4.931 . 0 0 "[ . 1 .]" 1
1909 2 70 GLN HA 2 97 TRP HZ3 5.000 . 5.000 3.431 2.865 4.131 . 0 0 "[ . 1 .]" 1
1910 2 71 LEU H 2 72 GLU H 2.700 . 2.700 2.656 2.530 2.767 0.067 6 0 "[ . 1 .]" 1
1911 2 71 LEU HA 2 74 ARG H 3.500 . 3.500 3.584 3.509 3.641 0.141 8 0 "[ . 1 .]" 1
1912 2 71 LEU HA 2 74 ARG QB 5.000 . 5.300 4.419 4.032 4.757 . 0 0 "[ . 1 .]" 1
1913 2 71 LEU HA 2 74 ARG QG 3.500 . 3.800 2.484 2.043 3.325 . 0 0 "[ . 1 .]" 1
1914 2 71 LEU HA 2 74 ARG QD 2.700 . 3.000 2.515 1.899 3.028 0.028 10 0 "[ . 1 .]" 1
1915 2 71 LEU HG 2 75 LYS QE 5.000 . 5.300 4.626 3.417 5.329 0.029 12 0 "[ . 1 .]" 1
1916 2 71 LEU MD1 2 74 ARG QD 5.000 . 5.800 3.280 2.388 5.622 . 0 0 "[ . 1 .]" 1
1917 2 71 LEU MD1 2 75 LYS QB 5.000 . 5.800 4.775 3.251 5.776 . 0 0 "[ . 1 .]" 1
1918 2 71 LEU MD1 2 75 LYS QE 3.500 . 4.300 3.994 3.558 4.302 0.002 15 0 "[ . 1 .]" 1
1919 1 99 SER QB 2 71 LEU QD 5.000 . 5.800 5.791 5.520 5.946 0.146 13 0 "[ . 1 .]" 1
1920 1 126 THR MG 2 71 LEU QD 5.000 . 6.000 5.884 5.543 6.070 0.070 11 0 "[ . 1 .]" 1
1921 1 127 VAL MG1 2 71 LEU QD 3.500 . 4.500 3.594 3.273 3.866 . 0 0 "[ . 1 .]" 1
1922 2 72 GLU H 2 73 ILE H 2.700 . 2.700 2.456 2.236 2.704 0.004 7 0 "[ . 1 .]" 1
1923 2 72 GLU HA 2 75 LYS H 5.000 . 5.000 3.271 2.908 3.698 . 0 0 "[ . 1 .]" 1
1924 2 72 GLU HA 2 75 LYS QB 3.500 . 3.800 2.037 1.743 2.401 0.057 1 0 "[ . 1 .]" 1
1925 2 72 GLU HA 2 75 LYS QG 3.500 . 3.800 3.603 3.016 3.923 0.123 8 0 "[ . 1 .]" 1
1926 2 72 GLU HA 2 76 ALA MB 5.000 . 5.500 3.815 3.340 4.481 . 0 0 "[ . 1 .]" 1
1927 2 73 ILE H 2 74 ARG H 2.700 . 2.700 2.683 2.559 2.808 0.108 7 0 "[ . 1 .]" 1
1928 2 73 ILE HA 2 76 ALA H 5.000 . 5.000 4.172 3.959 4.521 . 0 0 "[ . 1 .]" 1
1929 2 73 ILE HA 2 76 ALA MB 5.000 . 5.500 3.279 3.035 3.597 . 0 0 "[ . 1 .]" 1
1930 2 73 ILE HA 2 79 PHE HZ 5.000 . 5.000 4.948 4.676 5.082 0.082 10 0 "[ . 1 .]" 1
1931 2 73 ILE MD 2 79 PHE QD 3.500 . 4.300 3.378 2.819 3.822 . 0 0 "[ . 1 .]" 1
1932 2 73 ILE MD 2 79 PHE HZ 2.700 . 3.200 2.438 1.983 2.911 . 0 0 "[ . 1 .]" 1
1933 2 73 ILE MG 2 79 PHE QD 5.000 . 5.800 3.165 2.610 3.606 . 0 0 "[ . 1 .]" 1
1934 2 73 ILE MG 2 79 PHE HZ 3.500 . 4.000 3.857 3.459 4.055 0.055 5 0 "[ . 1 .]" 1
1935 2 73 ILE MD 2 94 GLU HA 5.000 . 5.500 2.078 1.781 2.656 0.019 3 0 "[ . 1 .]" 1
1936 2 73 ILE MD 2 97 TRP HE3 3.500 . 4.000 2.107 1.813 2.590 . 0 0 "[ . 1 .]" 1
1937 2 73 ILE MD 2 97 TRP HZ3 3.500 . 4.000 3.812 3.473 4.022 0.022 6 0 "[ . 1 .]" 1
1938 2 73 ILE MG 2 97 TRP HE3 5.000 . 5.500 3.686 3.228 3.959 . 0 0 "[ . 1 .]" 1
1939 2 73 ILE MG 2 97 TRP HZ3 5.000 . 5.500 5.508 5.334 5.606 0.106 14 0 "[ . 1 .]" 1
1940 2 73 ILE MD 2 98 ALA H 3.500 . 4.000 3.306 2.732 3.847 . 0 0 "[ . 1 .]" 1
1941 2 73 ILE MG 2 98 ALA H 3.500 . 4.000 2.814 2.128 3.396 . 0 0 "[ . 1 .]" 1
1942 2 73 ILE MD 2 98 ALA MB 2.700 . 3.700 3.303 2.899 3.667 . 0 0 "[ . 1 .]" 1
1943 2 73 ILE MG 2 98 ALA HA 5.000 . 5.500 2.399 1.860 2.833 . 0 0 "[ . 1 .]" 1
1944 2 73 ILE MG 2 98 ALA MB 2.700 . 3.700 2.532 2.039 3.072 . 0 0 "[ . 1 .]" 1
1945 2 73 ILE MG 2 101 PHE QB 5.000 . 5.800 2.767 2.289 3.188 . 0 0 "[ . 1 .]" 1
1946 2 73 ILE MG 2 101 PHE QD 5.000 . 5.800 2.939 2.122 3.852 . 0 0 "[ . 1 .]" 1
1947 2 73 ILE MG 2 103 LYS QE 5.000 . 5.800 4.803 3.958 5.359 . 0 0 "[ . 1 .]" 1
1948 2 74 ARG H 2 75 LYS H 2.700 . 2.700 2.426 2.112 2.748 0.048 7 0 "[ . 1 .]" 1
1949 2 74 ARG H 2 101 PHE QD 3.500 . 3.800 3.810 3.231 3.980 0.180 8 0 "[ . 1 .]" 1
1950 2 74 ARG HA 2 101 PHE QD 3.500 . 3.800 2.832 1.937 3.681 . 0 0 "[ . 1 .]" 1
1951 2 74 ARG QG 2 101 PHE QD 3.500 . 4.100 3.950 3.490 4.231 0.131 2 0 "[ . 1 .]" 1
1952 2 74 ARG QD 2 101 PHE QD 2.700 . 3.300 3.372 3.295 3.432 0.132 6 0 "[ . 1 .]" 1
1953 2 74 ARG QD 2 101 PHE QE 3.500 . 4.100 1.851 1.686 2.310 0.114 12 0 "[ . 1 .]" 1
1954 2 74 ARG HA 2 103 LYS QE 2.700 . 3.000 2.378 1.789 3.004 0.011 1 0 "[ . 1 .]" 1
1955 2 75 LYS H 2 76 ALA H 2.700 . 2.700 2.593 2.189 2.760 0.060 12 0 "[ . 1 .]" 1
1956 2 76 ALA HA 2 78 VAL H 5.000 . 5.000 3.986 3.521 4.611 . 0 0 "[ . 1 .]" 1
1957 2 76 ALA MB 2 78 VAL H 3.500 . 4.000 3.063 2.777 3.432 . 0 0 "[ . 1 .]" 1
1958 2 76 ALA MB 2 79 PHE HA 5.000 . 5.500 3.186 2.705 3.793 . 0 0 "[ . 1 .]" 1
1959 2 76 ALA MB 2 79 PHE QD 5.000 . 5.800 3.045 2.674 3.294 . 0 0 "[ . 1 .]" 1
1960 2 76 ALA MB 2 79 PHE QE 3.500 . 4.300 4.316 4.166 4.407 0.107 3 0 "[ . 1 .]" 1
1961 2 76 ALA MB 2 103 LYS QE 5.000 . 5.800 4.829 3.214 5.779 . 0 0 "[ . 1 .]" 1
1962 2 77 ASP H 2 78 VAL H 2.700 . 2.700 2.547 2.254 2.764 0.064 6 0 "[ . 1 .]" 1
1963 2 77 ASP QB 2 78 VAL MG2 5.000 . 5.800 3.953 3.607 4.629 . 0 0 "[ . 1 .]" 1
1964 2 77 ASP QB 2 78 VAL MG1 5.000 . 5.800 4.586 4.204 5.061 . 0 0 "[ . 1 .]" 1
1965 2 78 VAL HA 2 79 PHE H 2.700 . 2.700 2.209 2.137 2.387 . 0 0 "[ . 1 .]" 1
1966 2 78 VAL MG1 2 79 PHE HA 3.500 . 4.000 3.675 3.172 3.921 . 0 0 "[ . 1 .]" 1
1967 2 78 VAL MG1 2 80 VAL H 5.000 . 5.500 3.641 3.241 4.017 . 0 0 "[ . 1 .]" 1
1968 2 78 VAL MG1 2 80 VAL MG2 3.500 . 4.500 2.124 1.744 3.867 0.056 15 0 "[ . 1 .]" 1
1969 2 78 VAL MG2 2 104 PRO QD 5.000 . 5.800 4.360 3.569 5.039 . 0 0 "[ . 1 .]" 1
1970 2 78 VAL MG1 2 105 ILE HA 5.000 . 5.500 4.725 4.258 5.149 . 0 0 "[ . 1 .]" 1
1971 2 78 VAL MG2 2 105 ILE HA 5.000 . 5.500 5.158 4.396 5.506 0.006 4 0 "[ . 1 .]" 1
1972 2 78 VAL MG1 2 106 VAL H 5.000 . 5.500 4.745 4.405 5.069 . 0 0 "[ . 1 .]" 1
1973 2 78 VAL MG2 2 149 ILE HA 5.000 . 5.500 4.034 3.518 4.693 . 0 0 "[ . 1 .]" 1
1974 2 78 VAL MG1 2 149 ILE MG 2.700 . 3.700 2.739 1.786 3.138 0.014 5 0 "[ . 1 .]" 1
1975 2 78 VAL MG1 2 149 ILE MD 3.500 . 4.500 2.523 1.776 3.127 0.024 3 0 "[ . 1 .]" 1
1976 2 78 VAL MG2 2 149 ILE MG 2.700 . 3.700 2.557 1.775 3.143 0.025 5 0 "[ . 1 .]" 1
1977 2 78 VAL MG2 2 149 ILE MD 3.500 . 4.500 3.770 3.124 4.334 . 0 0 "[ . 1 .]" 1
1978 2 78 VAL MG2 2 152 VAL MG1 3.500 . 4.500 3.293 2.748 3.995 . 0 0 "[ . 1 .]" 1
1979 2 78 VAL MG2 2 153 VAL HA 5.000 . 5.500 4.037 3.554 4.964 . 0 0 "[ . 1 .]" 1
1980 2 79 PHE HA 2 80 VAL H 2.700 . 2.700 2.134 2.115 2.175 . 0 0 "[ . 1 .]" 1
1981 2 79 PHE H 2 98 ALA MB 5.000 . 5.500 4.676 4.304 5.095 . 0 0 "[ . 1 .]" 1
1982 2 79 PHE H 2 105 ILE HA 5.000 . 5.000 3.470 3.255 3.763 . 0 0 "[ . 1 .]" 1
1983 2 79 PHE QE 2 81 ALA MB 3.500 . 4.300 2.576 1.985 3.215 . 0 0 "[ . 1 .]" 1
1984 2 79 PHE QE 2 91 THR MG 3.500 . 4.300 4.029 3.650 4.275 . 0 0 "[ . 1 .]" 1
1985 2 79 PHE HZ 2 91 THR MG 3.500 . 4.000 4.041 3.945 4.082 0.082 14 0 "[ . 1 .]" 1
1986 2 79 PHE HZ 2 94 GLU HA 5.000 . 5.000 3.584 3.159 3.914 . 0 0 "[ . 1 .]" 1
1987 2 79 PHE QD 2 95 ILE MD 5.000 . 5.800 4.731 4.255 5.105 . 0 0 "[ . 1 .]" 1
1988 2 79 PHE QE 2 95 ILE MD 3.500 . 4.300 3.049 2.544 3.390 . 0 0 "[ . 1 .]" 1
1989 2 79 PHE HZ 2 95 ILE MD 3.500 . 4.000 3.916 3.677 4.062 0.062 6 0 "[ . 1 .]" 1
1990 2 79 PHE QE 2 98 ALA MB 3.500 . 4.300 3.143 2.822 3.411 . 0 0 "[ . 1 .]" 1
1991 2 79 PHE QD 2 98 ALA MB 3.500 . 4.300 2.648 2.292 2.960 . 0 0 "[ . 1 .]" 1
1992 2 79 PHE HZ 2 98 ALA MB 3.500 . 4.000 3.945 3.783 4.056 0.056 6 0 "[ . 1 .]" 1
1993 2 79 PHE HZ 2 98 ALA H 5.000 . 5.000 4.579 4.325 4.816 . 0 0 "[ . 1 .]" 1
1994 2 79 PHE QD 2 105 ILE MD 3.500 . 4.300 3.426 2.995 3.862 . 0 0 "[ . 1 .]" 1
1995 2 79 PHE QE 2 105 ILE MD 5.000 . 5.800 4.122 3.476 4.572 . 0 0 "[ . 1 .]" 1
1996 2 79 PHE QD 2 105 ILE MG 3.500 . 4.300 2.569 1.994 3.151 . 0 0 "[ . 1 .]" 1
1997 2 79 PHE QE 2 105 ILE MG 5.000 . 5.800 3.898 3.256 4.343 . 0 0 "[ . 1 .]" 1
1998 2 79 PHE QD 2 107 LEU MD2 3.500 . 4.300 3.586 2.896 4.362 0.062 6 0 "[ . 1 .]" 1
1999 2 79 PHE QE 2 107 LEU MD2 5.000 . 5.800 3.217 2.603 3.747 . 0 0 "[ . 1 .]" 1
2000 2 80 VAL HA 2 81 ALA H 2.700 . 2.700 2.179 2.132 2.291 . 0 0 "[ . 1 .]" 1
2001 2 80 VAL QG 2 82 ILE MD 5.000 . 6.000 4.597 4.224 5.229 . 0 0 "[ . 1 .]" 1
2002 2 80 VAL QG 2 106 VAL H 3.500 . 4.000 3.723 3.115 4.017 0.017 10 0 "[ . 1 .]" 1
2003 2 80 VAL QG 2 106 VAL HB 3.500 . 4.000 2.113 1.773 2.806 0.027 13 0 "[ . 1 .]" 1
2004 2 80 VAL QG 2 106 VAL MG1 5.000 . 6.000 2.413 1.842 3.295 . 0 0 "[ . 1 .]" 1
2005 2 80 VAL QG 2 106 VAL MG2 3.500 . 4.500 3.252 2.709 3.774 . 0 0 "[ . 1 .]" 1
2006 2 80 VAL QG 2 108 LEU QD 2.700 . 3.700 3.148 2.705 3.669 . 0 0 "[ . 1 .]" 1
2007 2 80 VAL QG 2 145 ILE MD 3.500 . 4.500 1.926 1.771 2.271 0.029 1 0 "[ . 1 .]" 1
2008 2 80 VAL QG 2 145 ILE MG 5.000 . 6.000 3.597 3.164 4.073 . 0 0 "[ . 1 .]" 1
2009 2 80 VAL QG 2 149 ILE MD 3.500 . 4.500 2.075 1.744 2.836 0.056 10 0 "[ . 1 .]" 1
2010 2 80 VAL QG 2 149 ILE MG 5.000 . 6.000 3.814 3.359 4.336 . 0 0 "[ . 1 .]" 1
2011 2 81 ALA HA 2 82 ILE H 2.700 . 2.700 2.574 2.342 2.708 0.008 1 0 "[ . 1 .]" 1
2012 2 81 ALA H 2 105 ILE MG 5.000 . 5.500 4.268 3.816 4.937 . 0 0 "[ . 1 .]" 1
2013 2 81 ALA H 2 107 LEU HA 3.500 . 3.500 2.273 2.028 2.494 . 0 0 "[ . 1 .]" 1
2014 2 81 ALA H 2 107 LEU MD2 5.000 . 5.500 2.641 1.766 3.913 0.034 15 0 "[ . 1 .]" 1
2015 2 81 ALA HA 2 91 THR MG 5.000 . 5.500 3.367 3.019 3.717 . 0 0 "[ . 1 .]" 1
2016 2 81 ALA MB 2 83 PRO HA 5.000 . 5.500 4.696 4.500 4.941 . 0 0 "[ . 1 .]" 1
2017 2 81 ALA MB 2 83 PRO QD 5.000 . 5.800 3.395 3.026 3.914 . 0 0 "[ . 1 .]" 1
2018 2 81 ALA MB 2 91 THR MG 3.500 . 4.500 1.851 1.709 2.164 0.091 15 0 "[ . 1 .]" 1
2019 2 81 ALA MB 2 95 ILE HA 5.000 . 5.500 4.057 3.509 4.796 . 0 0 "[ . 1 .]" 1
2020 2 81 ALA MB 2 95 ILE MD 3.500 . 4.500 2.114 1.773 2.552 0.027 12 0 "[ . 1 .]" 1
2021 2 81 ALA MB 2 95 ILE MG 5.000 . 6.000 4.369 3.481 5.225 . 0 0 "[ . 1 .]" 1
2022 2 81 ALA MB 2 107 LEU HA 5.000 . 5.500 3.519 3.297 3.758 . 0 0 "[ . 1 .]" 1
2023 2 81 ALA MB 2 107 LEU MD1 3.500 . 4.500 3.571 3.026 4.177 . 0 0 "[ . 1 .]" 1
2024 2 82 ILE H 2 83 PRO QD 5.000 . 5.300 3.647 3.416 3.889 . 0 0 "[ . 1 .]" 1
2025 2 82 ILE HA 2 83 PRO QD 3.500 . 3.800 1.808 1.741 1.882 0.059 2 0 "[ . 1 .]" 1
2026 2 82 ILE HA 2 84 GLY H 5.000 . 5.000 5.113 5.045 5.162 0.162 14 0 "[ . 1 .]" 1
2027 2 82 ILE HA 2 108 LEU H 5.000 . 5.000 2.479 2.188 2.769 . 0 0 "[ . 1 .]" 1
2028 2 82 ILE HA 2 108 LEU MD1 5.000 . 5.500 4.520 4.093 5.070 . 0 0 "[ . 1 .]" 1
2029 2 82 ILE MG 2 84 GLY H 3.500 . 4.000 3.585 3.368 3.704 . 0 0 "[ . 1 .]" 1
2030 2 82 ILE MG 2 84 GLY QA 3.500 . 4.300 3.138 2.999 3.421 . 0 0 "[ . 1 .]" 1
2031 2 82 ILE MG 2 85 ILE H 5.000 . 5.500 5.515 5.394 5.646 0.146 4 0 "[ . 1 .]" 1
2032 2 82 ILE MG 2 108 LEU MD1 3.500 . 4.500 4.051 3.680 4.414 . 0 0 "[ . 1 .]" 1
2033 2 82 ILE MD 2 108 LEU MD1 3.500 . 4.500 2.003 1.787 2.308 0.013 10 0 "[ . 1 .]" 1
2034 2 82 ILE MG 2 109 LEU MD2 5.000 . 6.000 5.342 4.863 5.827 . 0 0 "[ . 1 .]" 1
2035 2 82 ILE MG 2 110 GLU HA 5.000 . 5.500 5.031 4.269 5.579 0.079 12 0 "[ . 1 .]" 1
2036 2 82 ILE MD 2 110 GLU HA 5.000 . 5.500 5.274 4.378 5.552 0.052 3 0 "[ . 1 .]" 1
2037 2 82 ILE MD 2 135 TYR QE 5.000 . 5.800 2.351 1.774 3.097 0.026 3 0 "[ . 1 .]" 1
2038 2 82 ILE MG 2 135 TYR QE 3.500 . 4.300 2.924 1.842 3.848 . 0 0 "[ . 1 .]" 1
2039 2 82 ILE MG 2 135 TYR QD 5.000 . 5.800 4.619 3.457 5.489 . 0 0 "[ . 1 .]" 1
2040 2 82 ILE MG 2 138 ILE MD 5.000 . 6.000 5.278 4.816 5.736 . 0 0 "[ . 1 .]" 1
2041 2 82 ILE MD 2 138 ILE MD 3.500 . 4.500 3.479 2.477 4.010 . 0 0 "[ . 1 .]" 1
2042 2 83 PRO HA 2 84 GLY H 2.700 . 2.700 3.279 3.242 3.325 0.625 15 15 [*************-+] 1
2043 2 83 PRO HA 2 87 PRO HA 5.000 . 5.000 5.031 4.768 5.119 0.119 1 0 "[ . 1 .]" 1
2044 2 83 PRO HA 2 88 SER H 5.000 . 5.000 4.134 3.657 4.702 . 0 0 "[ . 1 .]" 1
2045 2 83 PRO HA 2 91 THR MG 3.500 . 4.000 3.807 3.404 4.043 0.043 6 0 "[ . 1 .]" 1
2046 2 83 PRO QD 2 91 THR MG 5.000 . 5.800 3.941 3.554 4.336 . 0 0 "[ . 1 .]" 1
2047 2 83 PRO HA 2 92 HIS HE1 5.000 . 5.000 5.042 4.866 5.152 0.152 14 0 "[ . 1 .]" 1
2048 2 83 PRO HA 2 95 ILE MD 5.000 . 5.500 3.918 3.488 4.353 . 0 0 "[ . 1 .]" 1
2049 2 83 PRO HA 2 117 TYR QE 5.000 . 5.300 3.057 2.889 3.423 . 0 0 "[ . 1 .]" 1
2050 2 83 PRO QG 2 107 LEU MD2 3.500 . 4.300 3.679 2.749 4.224 . 0 0 "[ . 1 .]" 1
2051 2 83 PRO QD 2 107 LEU MD2 5.000 . 5.800 2.609 2.059 3.486 . 0 0 "[ . 1 .]" 1
2052 2 83 PRO QD 2 108 LEU H 5.000 . 5.300 2.677 2.176 3.121 . 0 0 "[ . 1 .]" 1
2053 2 83 PRO QG 2 109 LEU MD2 3.500 . 4.300 2.134 1.854 2.480 . 0 0 "[ . 1 .]" 1
2054 2 83 PRO QD 2 109 LEU MD2 3.500 . 4.300 2.998 2.779 3.413 . 0 0 "[ . 1 .]" 1
2055 2 84 GLY H 2 85 ILE H 2.700 . 2.700 2.543 2.453 2.629 . 0 0 "[ . 1 .]" 1
2056 2 84 GLY QA 2 85 ILE H 3.500 . 3.800 2.630 2.558 2.718 . 0 0 "[ . 1 .]" 1
2057 2 84 GLY QA 2 88 SER H 5.000 . 5.300 4.759 4.375 5.072 . 0 0 "[ . 1 .]" 1
2058 2 84 GLY H 2 109 LEU MD2 5.000 . 5.500 5.087 4.539 5.437 . 0 0 "[ . 1 .]" 1
2059 2 84 GLY H 2 114 GLU HA 5.000 . 5.000 4.750 4.265 5.030 0.030 9 0 "[ . 1 .]" 1
2060 2 84 GLY H 2 117 TYR QE 5.000 . 5.300 2.432 2.224 2.663 . 0 0 "[ . 1 .]" 1
2061 2 85 ILE H 2 114 GLU HA 5.000 . 5.000 5.118 5.048 5.233 0.233 4 0 "[ . 1 .]" 1
2062 2 85 ILE H 2 117 TYR QE 3.500 . 3.800 1.902 1.713 2.125 0.087 9 0 "[ . 1 .]" 1
2063 2 85 ILE H 2 117 TYR QD 5.000 . 5.300 4.108 3.915 4.312 . 0 0 "[ . 1 .]" 1
2064 2 85 ILE HA 2 86 PRO HA 2.700 . 2.700 2.567 2.286 2.701 0.001 1 0 "[ . 1 .]" 1
2065 2 85 ILE HA 2 86 PRO QB 5.000 . 5.300 3.868 3.786 3.972 . 0 0 "[ . 1 .]" 1
2066 2 85 ILE MG 2 86 PRO HA 2.700 . 3.200 2.235 1.915 2.737 . 0 0 "[ . 1 .]" 1
2067 2 85 ILE MG 2 86 PRO QB 3.500 . 4.300 3.608 3.386 3.997 . 0 0 "[ . 1 .]" 1
2068 2 85 ILE MG 2 86 PRO QG 5.000 . 5.800 3.724 3.152 4.129 . 0 0 "[ . 1 .]" 1
2069 2 85 ILE MG 2 87 PRO QD 5.000 . 5.800 3.536 3.236 4.263 . 0 0 "[ . 1 .]" 1
2070 2 85 ILE MD 2 87 PRO QD 5.000 . 5.800 2.799 2.338 3.345 . 0 0 "[ . 1 .]" 1
2071 2 85 ILE MD 2 109 LEU MD2 5.000 . 6.000 5.540 5.124 5.810 . 0 0 "[ . 1 .]" 1
2072 2 85 ILE MD 2 113 ARG H 5.000 . 5.500 4.674 4.409 4.948 . 0 0 "[ . 1 .]" 1
2073 2 85 ILE MG 2 113 ARG H 5.000 . 5.500 4.870 4.579 5.268 . 0 0 "[ . 1 .]" 1
2074 2 85 ILE MD 2 113 ARG HA 3.500 . 4.000 2.585 2.290 2.975 . 0 0 "[ . 1 .]" 1
2075 2 85 ILE MD 2 113 ARG QD 3.500 . 4.300 3.750 3.031 4.364 0.064 10 0 "[ . 1 .]" 1
2076 2 85 ILE MD 2 113 ARG QG 5.000 . 5.800 3.894 3.435 4.434 . 0 0 "[ . 1 .]" 1
2077 2 85 ILE MD 2 114 GLU H 3.500 . 4.000 3.995 3.819 4.063 0.063 7 0 "[ . 1 .]" 1
2078 2 85 ILE MD 2 116 GLU H 3.500 . 4.000 3.271 3.128 3.456 . 0 0 "[ . 1 .]" 1
2079 2 85 ILE MG 2 116 GLU H 5.000 . 5.500 5.178 4.759 5.560 0.060 11 0 "[ . 1 .]" 1
2080 2 85 ILE MD 2 116 GLU QB 3.500 . 4.300 1.854 1.719 2.073 0.081 6 0 "[ . 1 .]" 1
2081 2 85 ILE MD 2 116 GLU QG 3.500 . 4.300 3.581 3.382 3.832 . 0 0 "[ . 1 .]" 1
2082 2 85 ILE MG 2 116 GLU QB 3.500 . 4.300 3.239 2.840 3.665 . 0 0 "[ . 1 .]" 1
2083 2 85 ILE MG 2 116 GLU QG 3.500 . 4.300 3.412 2.784 4.241 . 0 0 "[ . 1 .]" 1
2084 2 85 ILE MD 2 117 TYR H 3.500 . 4.000 2.259 1.883 2.985 . 0 0 "[ . 1 .]" 1
2085 2 85 ILE MD 2 117 TYR HA 2.700 . 3.200 2.648 2.206 3.126 . 0 0 "[ . 1 .]" 1
2086 2 85 ILE MD 2 117 TYR QD 5.000 . 5.800 2.342 2.167 2.532 . 0 0 "[ . 1 .]" 1
2087 2 85 ILE MD 2 117 TYR QE 3.500 . 4.300 2.215 2.070 2.404 . 0 0 "[ . 1 .]" 1
2088 2 85 ILE MG 2 117 TYR QE 5.000 . 5.800 4.445 4.219 4.633 . 0 0 "[ . 1 .]" 1
2089 2 86 PRO HA 2 87 PRO QD 2.700 . 3.000 2.092 1.977 2.277 . 0 0 "[ . 1 .]" 1
2090 2 87 PRO HA 2 92 HIS HE1 2.700 . 2.700 2.121 1.759 2.758 0.058 8 0 "[ . 1 .]" 1
2091 2 88 SER H 2 92 HIS HE1 5.000 . 5.000 3.914 3.387 4.786 . 0 0 "[ . 1 .]" 1
2092 2 88 SER HA 2 89 PRO QD 2.700 . 3.000 1.915 1.777 2.042 0.023 8 0 "[ . 1 .]" 1
2093 2 88 SER QB 2 91 THR MG 5.000 . 5.800 3.549 3.132 4.400 . 0 0 "[ . 1 .]" 1
2094 2 90 GLY H 2 91 THR H 2.700 . 2.700 2.792 2.733 2.839 0.139 7 0 "[ . 1 .]" 1
2095 2 90 GLY QA 2 93 VAL MG2 5.000 . 5.800 3.309 2.265 4.304 . 0 0 "[ . 1 .]" 1
2096 1 120 LEU MD1 2 90 GLY QA 3.500 . 4.300 2.746 2.093 4.429 0.129 6 0 "[ . 1 .]" 1
2097 1 120 LEU MD2 2 90 GLY QA 5.000 . 5.800 3.858 1.784 5.010 0.016 6 0 "[ . 1 .]" 1
2098 2 91 THR H 2 92 HIS H 3.500 . 3.500 3.071 2.931 3.174 . 0 0 "[ . 1 .]" 1
2099 2 91 THR MG 2 94 GLU QG 5.000 . 5.800 4.117 2.655 5.107 . 0 0 "[ . 1 .]" 1
2100 2 91 THR MG 2 95 ILE MD 2.700 . 3.700 2.101 1.890 2.575 . 0 0 "[ . 1 .]" 1
2101 2 91 THR HB 2 95 ILE MD 5.000 . 5.500 2.435 1.773 2.931 0.027 2 0 "[ . 1 .]" 1
2102 2 91 THR MG 2 117 TYR QE 5.000 . 5.800 5.536 5.113 5.787 . 0 0 "[ . 1 .]" 1
2103 2 92 HIS H 2 93 VAL H 3.500 . 3.500 3.322 3.069 3.476 . 0 0 "[ . 1 .]" 1
2104 2 92 HIS H 2 117 TYR QE 5.000 . 5.300 4.569 4.327 4.790 . 0 0 "[ . 1 .]" 1
2105 2 92 HIS H 2 117 TYR QD 5.000 . 5.300 5.508 5.382 5.597 0.297 7 0 "[ . 1 .]" 1
2106 2 92 HIS HA 2 95 ILE H 3.500 . 3.500 3.191 3.020 3.536 0.036 2 0 "[ . 1 .]" 1
2107 2 92 HIS HA 2 96 GLY H 3.500 . 3.500 3.606 3.501 3.673 0.173 10 0 "[ . 1 .]" 1
2108 2 92 HIS HA 2 95 ILE MD 3.500 . 4.000 2.066 1.748 2.364 0.052 2 0 "[ . 1 .]" 1
2109 2 92 HIS HA 2 95 ILE MG 5.000 . 5.500 3.467 2.413 4.092 . 0 0 "[ . 1 .]" 1
2110 2 92 HIS HD2 2 93 VAL H 5.000 . 5.000 5.137 4.909 5.289 0.289 10 0 "[ . 1 .]" 1
2111 2 92 HIS HD2 2 95 ILE MD 5.000 . 5.500 3.428 1.897 4.145 . 0 0 "[ . 1 .]" 1
2112 2 92 HIS HE1 2 95 ILE MD 5.000 . 5.500 5.480 5.005 5.621 0.121 9 0 "[ . 1 .]" 1
2113 2 92 HIS HD2 2 121 VAL MG1 5.000 . 5.500 5.485 5.185 5.606 0.106 13 0 "[ . 1 .]" 1
2114 2 92 HIS HD2 2 121 VAL MG2 3.500 . 4.000 3.112 2.531 3.656 . 0 0 "[ . 1 .]" 1
2115 2 92 HIS HE1 2 121 VAL MG2 5.000 . 5.500 3.499 2.175 4.652 . 0 0 "[ . 1 .]" 1
2116 1 93 VAL MG2 2 92 HIS HA 5.000 . 5.500 3.131 2.450 3.614 . 0 0 "[ . 1 .]" 1
2117 1 93 VAL MG2 2 92 HIS HD2 3.500 . 4.000 3.090 2.074 4.169 0.169 9 0 "[ . 1 .]" 1
2118 2 93 VAL H 2 94 GLU H 2.700 . 2.700 2.784 2.620 2.877 0.177 4 0 "[ . 1 .]" 1
2119 2 93 VAL HA 2 96 GLY H 3.500 . 3.500 3.552 3.459 3.588 0.088 8 0 "[ . 1 .]" 1
2120 2 93 VAL MG1 2 97 TRP H 5.000 . 5.500 3.964 3.613 4.479 . 0 0 "[ . 1 .]" 1
2121 2 93 VAL MG1 2 97 TRP HZ2 5.000 . 5.500 4.260 3.531 5.285 . 0 0 "[ . 1 .]" 1
2122 2 93 VAL MG1 2 97 TRP HE1 5.000 . 5.500 4.280 3.448 5.387 . 0 0 "[ . 1 .]" 1
2123 2 93 VAL MG1 2 97 TRP HE3 5.000 . 5.500 3.731 3.036 4.314 . 0 0 "[ . 1 .]" 1
2124 1 93 VAL HA 2 93 VAL MG2 5.000 . 5.500 2.589 1.893 3.384 . 0 0 "[ . 1 .]" 1
2125 1 93 VAL HB 2 93 VAL MG2 5.000 . 5.500 4.348 3.647 5.365 . 0 0 "[ . 1 .]" 1
2126 1 95 ILE MG 2 93 VAL MG1 3.500 . 4.500 3.565 2.424 4.383 . 0 0 "[ . 1 .]" 1
2127 1 95 ILE MG 2 93 VAL MG2 3.500 . 4.500 4.123 2.969 4.613 0.113 2 0 "[ . 1 .]" 1
2128 1 95 ILE MD 2 93 VAL MG2 5.000 . 6.000 4.370 3.389 4.964 . 0 0 "[ . 1 .]" 1
2129 1 96 GLY H 2 93 VAL MG1 2.700 . 3.200 2.648 1.783 3.237 0.037 9 0 "[ . 1 .]" 1
2130 1 96 GLY QA 2 93 VAL MG1 3.500 . 4.300 1.903 1.753 2.593 0.047 1 0 "[ . 1 .]" 1
2131 1 120 LEU MD1 2 93 VAL HB 2.700 . 3.200 2.601 1.893 3.304 0.104 6 0 "[ . 1 .]" 1
2132 1 120 LEU MD1 2 93 VAL MG1 3.500 . 4.500 2.310 1.674 3.511 0.126 6 0 "[ . 1 .]" 1
2133 1 120 LEU MD2 2 93 VAL MG1 5.000 . 6.000 1.868 1.692 2.980 0.108 13 0 "[ . 1 .]" 1
2134 1 121 VAL MG2 2 93 VAL MG1 5.000 . 6.000 5.589 5.022 6.000 0.000 10 0 "[ . 1 .]" 1
2135 1 121 VAL MG2 2 93 VAL MG2 5.000 . 6.000 5.056 4.389 5.897 . 0 0 "[ . 1 .]" 1
2136 1 124 LEU MD1 2 93 VAL MG1 3.500 . 4.500 3.184 2.510 4.202 . 0 0 "[ . 1 .]" 1
2137 1 124 LEU MD2 2 93 VAL MG1 5.000 . 6.000 4.151 3.364 4.765 . 0 0 "[ . 1 .]" 1
2138 1 127 VAL MG2 2 93 VAL MG1 5.000 . 6.000 5.844 5.437 6.084 0.084 1 0 "[ . 1 .]" 1
2139 2 94 GLU H 2 95 ILE H 2.700 . 2.700 2.512 2.400 2.665 . 0 0 "[ . 1 .]" 1
2140 2 94 GLU HA 2 97 TRP H 3.500 . 3.500 3.470 3.205 3.561 0.061 10 0 "[ . 1 .]" 1
2141 2 94 GLU HA 2 97 TRP HE3 5.000 . 5.000 2.130 1.751 2.656 0.049 3 0 "[ . 1 .]" 1
2142 2 95 ILE H 2 96 GLY H 2.700 . 2.700 2.718 2.650 2.772 0.072 14 0 "[ . 1 .]" 1
2143 2 95 ILE HA 2 98 ALA MB 5.000 . 5.500 2.688 2.409 3.066 . 0 0 "[ . 1 .]" 1
2144 2 95 ILE MG 2 98 ALA MB 5.000 . 6.000 3.587 3.247 4.061 . 0 0 "[ . 1 .]" 1
2145 2 95 ILE MG 2 105 ILE MD 5.000 . 6.000 2.418 1.893 3.200 . 0 0 "[ . 1 .]" 1
2146 2 95 ILE MD 2 107 LEU MD2 3.500 . 4.500 2.132 1.835 2.596 . 0 0 "[ . 1 .]" 1
2147 2 95 ILE MD 2 107 LEU MD1 3.500 . 4.500 3.142 1.949 4.368 . 0 0 "[ . 1 .]" 1
2148 2 95 ILE MG 2 107 LEU MD2 5.000 . 6.000 3.011 1.933 3.837 . 0 0 "[ . 1 .]" 1
2149 2 95 ILE MG 2 107 LEU MD1 5.000 . 6.000 2.678 2.048 4.120 . 0 0 "[ . 1 .]" 1
2150 2 95 ILE MD 2 117 TYR QE 5.000 . 5.800 4.960 4.560 5.337 . 0 0 "[ . 1 .]" 1
2151 2 95 ILE MD 2 121 VAL MG2 3.500 . 4.500 3.407 2.758 3.952 . 0 0 "[ . 1 .]" 1
2152 2 95 ILE MD 2 121 VAL MG1 5.000 . 6.000 5.028 4.461 5.624 . 0 0 "[ . 1 .]" 1
2153 2 95 ILE MG 2 121 VAL MG2 5.000 . 6.000 3.424 2.883 4.425 . 0 0 "[ . 1 .]" 1
2154 2 95 ILE MG 2 124 LEU MD1 3.500 . 4.500 2.270 1.703 3.329 0.097 14 0 "[ . 1 .]" 1
2155 2 95 ILE MG 2 124 LEU MD2 3.500 . 4.500 1.814 1.591 2.902 0.209 7 0 "[ . 1 .]" 1
2156 2 96 GLY H 2 97 TRP H 2.700 . 2.700 2.656 2.556 2.744 0.044 15 0 "[ . 1 .]" 1
2157 2 96 GLY QA 2 99 SER H 5.000 . 5.300 3.075 2.889 3.302 . 0 0 "[ . 1 .]" 1
2158 2 96 GLY QA 2 100 ALA H 5.000 . 5.300 3.902 3.622 4.207 . 0 0 "[ . 1 .]" 1
2159 2 96 GLY QA 2 100 ALA MB 5.000 . 5.800 4.584 4.189 4.964 . 0 0 "[ . 1 .]" 1
2160 2 97 TRP H 2 98 ALA H 2.700 . 2.700 2.706 2.568 2.823 0.123 15 0 "[ . 1 .]" 1
2161 2 97 TRP HA 2 100 ALA H 3.500 . 3.500 3.564 3.467 3.625 0.125 10 0 "[ . 1 .]" 1
2162 1 100 ALA MB 2 97 TRP HA 3.500 . 4.000 2.440 1.845 3.068 . 0 0 "[ . 1 .]" 1
2163 1 99 SER HG 2 97 TRP HE1 5.000 . 5.000 3.405 2.090 4.504 . 0 0 "[ . 1 .]" 1
2164 1 100 ALA MB 2 97 TRP HD1 3.500 . 4.000 1.917 1.744 2.405 0.056 9 0 "[ . 1 .]" 1
2165 1 100 ALA MB 2 97 TRP HE1 3.500 . 4.000 3.295 2.635 3.744 . 0 0 "[ . 1 .]" 1
2166 1 100 ALA H 2 97 TRP HD1 3.500 . 3.500 2.352 2.001 2.906 . 0 0 "[ . 1 .]" 1
2167 1 100 ALA H 2 97 TRP HE1 5.000 . 5.000 2.264 1.725 2.927 0.075 11 0 "[ . 1 .]" 1
2168 1 100 ALA HA 2 97 TRP HE1 5.000 . 5.000 4.171 3.414 4.773 . 0 0 "[ . 1 .]" 1
2169 1 120 LEU MD2 2 97 TRP HZ2 5.000 . 5.500 3.430 2.133 5.342 . 0 0 "[ . 1 .]" 1
2170 1 120 LEU MD2 2 97 TRP HZ3 3.500 . 4.000 3.178 2.767 3.758 . 0 0 "[ . 1 .]" 1
2171 1 120 LEU MD2 2 97 TRP HE3 3.500 . 4.000 3.990 3.672 4.099 0.099 6 0 "[ . 1 .]" 1
2172 1 120 LEU MD1 2 97 TRP HZ3 5.000 . 5.500 3.766 3.012 4.685 . 0 0 "[ . 1 .]" 1
2173 1 120 LEU MD1 2 97 TRP HE3 5.000 . 5.500 4.628 3.906 5.418 . 0 0 "[ . 1 .]" 1
2174 1 124 LEU MD1 2 97 TRP HZ2 3.500 . 4.000 2.654 1.724 3.805 0.076 3 0 "[ . 1 .]" 1
2175 1 124 LEU MD1 2 97 TRP HH2 5.000 . 5.500 3.455 2.590 4.996 . 0 0 "[ . 1 .]" 1
2176 1 127 VAL MG2 2 97 TRP HZ2 3.500 . 4.000 3.393 3.155 3.872 . 0 0 "[ . 1 .]" 1
2177 1 127 VAL MG2 2 97 TRP HH2 5.000 . 5.500 3.721 3.138 4.078 . 0 0 "[ . 1 .]" 1
2178 2 98 ALA H 2 99 SER H 2.700 . 2.700 2.573 2.498 2.660 . 0 0 "[ . 1 .]" 1
2179 2 98 ALA HA 2 101 PHE H 3.500 . 3.500 3.487 3.326 3.559 0.059 7 0 "[ . 1 .]" 1
2180 2 98 ALA HA 2 101 PHE QB 5.000 . 5.300 2.194 1.703 2.840 0.097 4 0 "[ . 1 .]" 1
2181 2 98 ALA HA 2 101 PHE QD 5.000 . 5.300 4.087 3.502 4.781 . 0 0 "[ . 1 .]" 1
2182 2 98 ALA HA 2 103 LYS H 3.500 . 3.500 3.471 3.300 3.541 0.041 15 0 "[ . 1 .]" 1
2183 2 98 ALA MB 2 103 LYS H 5.000 . 5.500 4.016 3.640 4.199 . 0 0 "[ . 1 .]" 1
2184 2 98 ALA MB 2 103 LYS QB 5.000 . 5.800 2.804 2.331 3.355 . 0 0 "[ . 1 .]" 1
2185 2 98 ALA MB 2 104 PRO HA 5.000 . 5.500 5.068 4.840 5.427 . 0 0 "[ . 1 .]" 1
2186 2 98 ALA MB 2 105 ILE MD 2.700 . 3.700 1.883 1.719 2.196 0.081 11 0 "[ . 1 .]" 1
2187 2 98 ALA MB 2 105 ILE QG 5.000 . 5.800 1.855 1.716 2.026 0.084 13 0 "[ . 1 .]" 1
2188 2 98 ALA MB 2 124 LEU MD1 5.000 . 6.000 5.129 3.990 5.784 . 0 0 "[ . 1 .]" 1
2189 2 98 ALA MB 2 130 VAL MG2 5.000 . 6.000 4.332 4.015 4.686 . 0 0 "[ . 1 .]" 1
2190 1 100 ALA MB 2 98 ALA H 5.000 . 5.500 4.699 3.940 5.446 . 0 0 "[ . 1 .]" 1
2191 2 99 SER H 2 100 ALA H 2.700 . 2.700 2.721 2.480 2.795 0.095 14 0 "[ . 1 .]" 1
2192 2 99 SER H 2 105 ILE MD 5.000 . 5.500 2.969 2.235 3.595 . 0 0 "[ . 1 .]" 1
2193 2 99 SER HA 2 105 ILE MD 3.500 . 4.000 2.959 2.624 3.228 . 0 0 "[ . 1 .]" 1
2194 2 99 SER HA 2 124 LEU MD1 5.000 . 5.500 4.863 3.751 5.481 . 0 0 "[ . 1 .]" 1
2195 2 99 SER HA 2 128 ALA MB 5.000 . 5.500 2.848 2.606 3.174 . 0 0 "[ . 1 .]" 1
2196 2 99 SER QB 2 105 ILE MD 3.500 . 4.300 3.499 2.822 4.285 . 0 0 "[ . 1 .]" 1
2197 2 99 SER QB 2 124 LEU MD1 3.500 . 4.300 3.096 2.345 3.958 . 0 0 "[ . 1 .]" 1
2198 2 99 SER QB 2 128 ALA MB 3.500 . 4.300 3.303 2.600 4.183 . 0 0 "[ . 1 .]" 1
2199 2 100 ALA H 2 101 PHE H 2.700 . 2.700 2.516 2.376 2.668 . 0 0 "[ . 1 .]" 1
2200 1 101 PHE QD 2 100 ALA H 3.500 . 3.800 4.021 3.929 4.084 0.284 2 0 "[ . 1 .]" 1
2201 1 101 PHE QE 2 100 ALA H 5.000 . 5.300 4.096 3.227 4.957 . 0 0 "[ . 1 .]" 1
2202 1 101 PHE QE 2 100 ALA HA 5.000 . 5.300 2.625 1.698 3.476 0.102 6 0 "[ . 1 .]" 1
2203 1 100 ALA HA 2 100 ALA MB 5.000 . 5.500 4.190 3.418 4.514 . 0 0 "[ . 1 .]" 1
2204 1 101 PHE HA 2 100 ALA MB 5.000 . 5.500 2.998 2.635 3.253 . 0 0 "[ . 1 .]" 1
2205 1 101 PHE QD 2 100 ALA MB 2.700 . 3.500 1.756 1.674 1.848 0.126 6 0 "[ . 1 .]" 1
2206 1 101 PHE QE 2 100 ALA MB 3.500 . 4.300 2.745 1.730 3.628 0.070 1 0 "[ . 1 .]" 1
2207 2 101 PHE H 2 102 ASP H 2.700 . 2.700 2.427 2.128 2.737 0.037 1 0 "[ . 1 .]" 1
2208 2 101 PHE H 2 103 LYS H 5.000 . 5.000 4.239 3.815 4.693 . 0 0 "[ . 1 .]" 1
2209 2 101 PHE QB 2 103 LYS H 3.500 . 3.800 2.267 2.091 2.477 . 0 0 "[ . 1 .]" 1
2210 2 101 PHE QD 2 103 LYS H 3.500 . 3.800 3.918 3.848 3.975 0.175 9 0 "[ . 1 .]" 1
2211 2 101 PHE QD 2 103 LYS QE 5.000 . 5.600 3.614 1.960 5.332 . 0 0 "[ . 1 .]" 1
2212 2 102 ASP H 2 103 LYS H 2.700 . 2.700 2.658 2.147 2.815 0.115 15 0 "[ . 1 .]" 1
2213 2 102 ASP HA 2 128 ALA MB 3.500 . 4.000 4.020 3.768 4.099 0.099 13 0 "[ . 1 .]" 1
2214 2 102 ASP QB 2 128 ALA MB 5.000 . 5.800 5.423 4.897 5.620 . 0 0 "[ . 1 .]" 1
2215 2 102 ASP QB 2 156 VAL MG1 5.000 . 5.800 5.208 3.759 5.818 0.018 10 0 "[ . 1 .]" 1
2216 2 104 PRO HA 2 105 ILE H 2.700 . 2.700 2.269 2.203 2.368 . 0 0 "[ . 1 .]" 1
2217 2 104 PRO HA 2 129 ALA MB 3.500 . 4.000 2.808 2.189 3.472 . 0 0 "[ . 1 .]" 1
2218 2 104 PRO HA 2 130 VAL MG2 5.000 . 5.500 5.257 4.927 5.476 . 0 0 "[ . 1 .]" 1
2219 2 104 PRO HA 2 152 VAL MG2 5.000 . 5.500 4.568 3.783 5.501 0.001 1 0 "[ . 1 .]" 1
2220 2 104 PRO HA 2 156 VAL MG1 3.500 . 4.000 3.593 2.868 4.014 0.014 7 0 "[ . 1 .]" 1
2221 2 104 PRO HA 2 156 VAL MG2 5.000 . 5.500 3.483 2.267 4.629 . 0 0 "[ . 1 .]" 1
2222 2 105 ILE H 2 129 ALA MB 5.000 . 5.500 2.835 2.191 3.399 . 0 0 "[ . 1 .]" 1
2223 2 105 ILE H 2 130 VAL HA 5.000 . 5.000 3.509 3.289 3.778 . 0 0 "[ . 1 .]" 1
2224 2 105 ILE H 2 130 VAL MG1 5.000 . 5.500 5.109 4.694 5.318 . 0 0 "[ . 1 .]" 1
2225 2 105 ILE H 2 130 VAL MG2 5.000 . 5.500 3.821 3.491 4.097 . 0 0 "[ . 1 .]" 1
2226 2 105 ILE H 2 131 GLU H 5.000 . 5.000 4.301 4.034 4.535 . 0 0 "[ . 1 .]" 1
2227 2 105 ILE H 2 152 VAL QG 5.000 . 5.500 3.186 2.319 4.017 . 0 0 "[ . 1 .]" 1
2228 2 105 ILE HA 2 106 VAL H 2.700 . 2.700 2.201 2.124 2.281 . 0 0 "[ . 1 .]" 1
2229 2 105 ILE HB 2 130 VAL MG1 5.000 . 5.500 3.417 2.954 3.726 . 0 0 "[ . 1 .]" 1
2230 2 105 ILE HB 2 130 VAL MG2 5.000 . 5.500 1.950 1.729 2.430 0.071 8 0 "[ . 1 .]" 1
2231 2 105 ILE HG12 2 106 VAL H 3.500 . 3.500 3.568 3.469 3.645 0.145 5 0 "[ . 1 .]" 1
2232 2 105 ILE MG 2 106 VAL H 3.500 . 4.000 1.981 1.756 2.313 0.044 5 0 "[ . 1 .]" 1
2233 2 105 ILE MG 2 106 VAL HA 5.000 . 5.500 2.873 2.758 3.041 . 0 0 "[ . 1 .]" 1
2234 2 105 ILE MG 2 107 LEU H 5.000 . 5.500 3.393 3.130 3.668 . 0 0 "[ . 1 .]" 1
2235 2 105 ILE MG 2 107 LEU MD2 3.500 . 4.500 2.791 2.017 3.402 . 0 0 "[ . 1 .]" 1
2236 2 105 ILE MD 2 124 LEU MD1 5.000 . 6.000 3.657 2.045 3.953 . 0 0 "[ . 1 .]" 1
2237 2 105 ILE MD 2 124 LEU MD2 5.000 . 6.000 2.111 1.703 4.228 0.097 4 0 "[ . 1 .]" 1
2238 2 105 ILE MG 2 124 LEU MD1 5.000 . 6.000 4.640 2.936 4.947 . 0 0 "[ . 1 .]" 1
2239 2 105 ILE MG 2 124 LEU MD2 5.000 . 6.000 2.984 2.447 5.226 . 0 0 "[ . 1 .]" 1
2240 2 105 ILE MD 2 128 ALA MB 3.500 . 4.500 2.805 2.595 2.996 . 0 0 "[ . 1 .]" 1
2241 2 105 ILE MD 2 128 ALA HA 5.000 . 5.500 5.393 5.017 5.536 0.036 10 0 "[ . 1 .]" 1
2242 2 105 ILE MG 2 130 VAL HA 5.000 . 5.500 2.076 1.806 2.695 . 0 0 "[ . 1 .]" 1
2243 2 105 ILE MD 2 130 VAL MG2 2.700 . 3.700 1.973 1.764 2.370 0.036 9 0 "[ . 1 .]" 1
2244 2 105 ILE MD 2 130 VAL MG1 5.000 . 6.000 3.342 3.017 3.638 . 0 0 "[ . 1 .]" 1
2245 2 105 ILE MG 2 130 VAL MG2 3.500 . 4.500 2.000 1.764 2.394 0.036 8 0 "[ . 1 .]" 1
2246 2 105 ILE MG 2 130 VAL MG1 3.500 . 4.500 1.782 1.695 1.889 0.105 4 0 "[ . 1 .]" 1
2247 2 105 ILE MG 2 131 GLU H 5.000 . 5.500 2.990 2.597 3.772 . 0 0 "[ . 1 .]" 1
2248 2 106 VAL HA 2 107 LEU H 2.700 . 2.700 2.178 2.147 2.206 . 0 0 "[ . 1 .]" 1
2249 2 106 VAL HA 2 130 VAL MG1 5.000 . 5.500 3.578 2.911 3.953 . 0 0 "[ . 1 .]" 1
2250 2 106 VAL HA 2 131 GLU H 3.500 . 3.500 2.428 2.046 2.776 . 0 0 "[ . 1 .]" 1
2251 2 106 VAL HA 2 133 VAL H 5.000 . 5.000 5.046 4.962 5.100 0.100 15 0 "[ . 1 .]" 1
2252 2 106 VAL HA 2 152 VAL MG1 5.000 . 5.500 4.400 3.915 4.666 . 0 0 "[ . 1 .]" 1
2253 2 106 VAL MG1 2 108 LEU MD2 5.000 . 6.000 4.326 3.640 5.255 . 0 0 "[ . 1 .]" 1
2254 2 106 VAL MG1 2 108 LEU MD1 5.000 . 6.000 5.034 4.503 5.747 . 0 0 "[ . 1 .]" 1
2255 2 106 VAL MG1 2 131 GLU QB 5.000 . 5.800 2.198 1.756 3.146 0.044 5 0 "[ . 1 .]" 1
2256 2 106 VAL MG1 2 145 ILE HA 5.000 . 5.500 3.448 2.935 3.965 . 0 0 "[ . 1 .]" 1
2257 2 106 VAL MG2 2 145 ILE MG 5.000 . 6.000 5.762 5.282 6.053 0.053 6 0 "[ . 1 .]" 1
2258 2 106 VAL MG2 2 145 ILE MD 5.000 . 6.000 5.082 4.394 5.476 . 0 0 "[ . 1 .]" 1
2259 2 106 VAL MG1 2 148 ALA MB 3.500 . 4.500 2.881 2.208 3.517 . 0 0 "[ . 1 .]" 1
2260 2 106 VAL MG2 2 148 ALA MB 3.500 . 4.500 3.578 2.757 4.398 . 0 0 "[ . 1 .]" 1
2261 2 106 VAL MG2 2 149 ILE HA 5.000 . 5.500 2.205 1.879 2.520 . 0 0 "[ . 1 .]" 1
2262 2 106 VAL MG2 2 149 ILE MG 3.500 . 4.500 3.646 2.724 4.220 . 0 0 "[ . 1 .]" 1
2263 2 106 VAL MG2 2 149 ILE MD 5.000 . 6.000 3.831 3.269 4.581 . 0 0 "[ . 1 .]" 1
2264 2 106 VAL MG1 2 149 ILE MG 5.000 . 6.000 4.158 3.471 4.672 . 0 0 "[ . 1 .]" 1
2265 2 106 VAL MG1 2 149 ILE MD 5.000 . 6.000 3.066 1.978 4.039 . 0 0 "[ . 1 .]" 1
2266 2 106 VAL MG2 2 153 VAL HA 5.000 . 5.500 5.388 4.941 5.546 0.046 15 0 "[ . 1 .]" 1
2267 2 107 LEU HA 2 108 LEU H 2.700 . 2.700 2.268 2.210 2.357 . 0 0 "[ . 1 .]" 1
2268 2 107 LEU H 2 130 VAL MG1 3.500 . 4.000 3.428 2.802 3.845 . 0 0 "[ . 1 .]" 1
2269 2 107 LEU H 2 131 GLU H 5.000 . 5.000 3.962 3.529 4.588 . 0 0 "[ . 1 .]" 1
2270 2 107 LEU H 2 132 PHE HA 3.500 . 3.500 3.379 3.096 3.613 0.113 14 0 "[ . 1 .]" 1
2271 2 107 LEU H 2 132 PHE QD 5.000 . 5.300 3.660 3.105 4.064 . 0 0 "[ . 1 .]" 1
2272 2 107 LEU H 2 133 VAL H 5.000 . 5.000 3.595 3.363 3.835 . 0 0 "[ . 1 .]" 1
2273 2 107 LEU H 2 133 VAL MG2 5.000 . 5.500 4.287 3.887 4.832 . 0 0 "[ . 1 .]" 1
2274 2 107 LEU HB3 2 108 LEU H 2.700 . 2.700 2.689 2.509 2.782 0.082 8 0 "[ . 1 .]" 1
2275 2 107 LEU QB 2 109 LEU MD1 5.000 . 5.800 4.419 3.910 4.874 . 0 0 "[ . 1 .]" 1
2276 2 107 LEU MD1 2 109 LEU MD1 5.000 . 6.000 4.711 4.109 5.491 . 0 0 "[ . 1 .]" 1
2277 2 107 LEU MD1 2 109 LEU MD2 5.000 . 6.000 3.103 2.558 3.872 . 0 0 "[ . 1 .]" 1
2278 2 107 LEU MD2 2 109 LEU MD2 5.000 . 6.000 4.054 3.300 4.586 . 0 0 "[ . 1 .]" 1
2279 2 107 LEU MD1 2 121 VAL HA 5.000 . 5.500 3.445 2.778 5.165 . 0 0 "[ . 1 .]" 1
2280 2 107 LEU MD1 2 121 VAL MG1 3.500 . 4.500 2.680 1.803 4.298 . 0 0 "[ . 1 .]" 1
2281 2 107 LEU MD2 2 121 VAL MG1 5.000 . 6.000 4.196 2.603 5.067 . 0 0 "[ . 1 .]" 1
2282 2 107 LEU MD1 2 124 LEU MD1 5.000 . 6.000 4.675 3.641 5.585 . 0 0 "[ . 1 .]" 1
2283 2 107 LEU MD1 2 124 LEU MD2 5.000 . 6.000 3.645 2.867 4.822 . 0 0 "[ . 1 .]" 1
2284 2 107 LEU MD1 2 130 VAL MG1 3.500 . 4.500 2.240 1.742 3.331 0.058 5 0 "[ . 1 .]" 1
2285 2 107 LEU MD2 2 130 VAL MG1 3.500 . 4.500 3.637 3.003 4.491 . 0 0 "[ . 1 .]" 1
2286 2 107 LEU MD1 2 132 PHE QD 3.500 . 4.300 3.042 2.347 3.956 . 0 0 "[ . 1 .]" 1
2287 2 107 LEU MD1 2 132 PHE QE 5.000 . 5.800 2.506 1.951 3.645 . 0 0 "[ . 1 .]" 1
2288 2 108 LEU HA 2 109 LEU H 2.700 . 2.700 2.367 2.242 2.449 . 0 0 "[ . 1 .]" 1
2289 2 108 LEU HA 2 133 VAL H 3.500 . 3.500 3.369 3.066 3.568 0.068 3 0 "[ . 1 .]" 1
2290 2 108 LEU HA 2 133 VAL MG1 5.000 . 5.500 2.856 2.411 3.218 . 0 0 "[ . 1 .]" 1
2291 2 108 LEU HA 2 133 VAL MG2 5.000 . 5.500 3.915 3.385 4.365 . 0 0 "[ . 1 .]" 1
2292 2 108 LEU MD2 2 133 VAL H 5.000 . 5.500 4.320 3.816 4.985 . 0 0 "[ . 1 .]" 1
2293 2 108 LEU MD2 2 133 VAL MG1 2.700 . 3.700 1.794 1.687 2.039 0.113 3 0 "[ . 1 .]" 1
2294 2 108 LEU MD2 2 133 VAL MG2 2.700 . 3.700 3.307 2.426 3.788 0.088 2 0 "[ . 1 .]" 1
2295 2 108 LEU MD1 2 133 VAL MG1 5.000 . 6.000 3.867 3.584 4.104 . 0 0 "[ . 1 .]" 1
2296 2 108 LEU MD1 2 133 VAL MG2 5.000 . 6.000 5.039 4.656 5.570 . 0 0 "[ . 1 .]" 1
2297 2 108 LEU MD2 2 133 VAL HB 3.500 . 4.000 2.509 1.907 3.126 . 0 0 "[ . 1 .]" 1
2298 2 108 LEU MD2 2 134 HIS HA 5.000 . 5.500 4.673 3.912 5.273 . 0 0 "[ . 1 .]" 1
2299 2 108 LEU MD1 2 135 TYR QD 3.500 . 4.300 3.865 3.399 4.377 0.077 3 0 "[ . 1 .]" 1
2300 2 108 LEU MD1 2 135 TYR QE 3.500 . 4.300 3.613 2.586 4.185 . 0 0 "[ . 1 .]" 1
2301 2 108 LEU MD2 2 135 TYR QD 3.500 . 4.300 2.821 1.891 3.805 . 0 0 "[ . 1 .]" 1
2302 2 108 LEU MD2 2 135 TYR QE 3.500 . 4.300 3.834 2.497 4.360 0.060 13 0 "[ . 1 .]" 1
2303 2 108 LEU MD2 2 138 ILE HA 5.000 . 5.500 4.781 4.224 5.432 . 0 0 "[ . 1 .]" 1
2304 2 108 LEU MD1 2 138 ILE MD 3.500 . 4.500 2.885 2.168 3.698 . 0 0 "[ . 1 .]" 1
2305 2 108 LEU MD2 2 138 ILE MD 3.500 . 4.500 3.622 3.029 4.501 0.001 3 0 "[ . 1 .]" 1
2306 2 108 LEU MD2 2 138 ILE MG 5.000 . 6.000 5.371 4.484 5.734 . 0 0 "[ . 1 .]" 1
2307 2 108 LEU MD2 2 141 ALA MB 3.500 . 4.500 1.950 1.714 2.568 0.086 9 0 "[ . 1 .]" 1
2308 2 108 LEU MD2 2 141 ALA HA 5.000 . 5.500 3.273 2.561 4.016 . 0 0 "[ . 1 .]" 1
2309 2 108 LEU MD2 2 144 GLN QG 3.500 . 4.300 4.148 3.660 4.383 0.083 11 0 "[ . 1 .]" 1
2310 2 108 LEU MD1 2 145 ILE HA 5.000 . 5.500 5.338 4.818 5.564 0.064 15 0 "[ . 1 .]" 1
2311 2 108 LEU MD2 2 145 ILE HA 5.000 . 5.500 3.748 3.088 4.867 . 0 0 "[ . 1 .]" 1
2312 2 108 LEU MD1 2 145 ILE MD 2.700 . 3.700 2.073 1.790 2.558 0.010 5 0 "[ . 1 .]" 1
2313 2 108 LEU MD2 2 145 ILE MD 3.500 . 4.500 2.572 1.884 3.356 . 0 0 "[ . 1 .]" 1
2314 2 108 LEU MD1 2 145 ILE MG 5.000 . 6.000 3.504 2.904 3.838 . 0 0 "[ . 1 .]" 1
2315 2 108 LEU MD2 2 145 ILE MG 5.000 . 6.000 3.502 2.312 4.984 . 0 0 "[ . 1 .]" 1
2316 2 109 LEU H 2 133 VAL H 5.000 . 5.000 2.643 2.462 2.879 . 0 0 "[ . 1 .]" 1
2317 2 109 LEU H 2 133 VAL MG1 5.000 . 5.500 3.953 3.548 4.130 . 0 0 "[ . 1 .]" 1
2318 2 109 LEU H 2 134 HIS HA 5.000 . 5.000 3.648 3.225 4.136 . 0 0 "[ . 1 .]" 1
2319 2 109 LEU H 2 135 TYR QD 5.000 . 5.300 4.000 3.714 4.357 . 0 0 "[ . 1 .]" 1
2320 2 109 LEU H 2 135 TYR QE 5.000 . 5.300 5.014 4.576 5.286 . 0 0 "[ . 1 .]" 1
2321 2 109 LEU HA 2 110 GLU H 2.700 . 2.700 2.192 2.140 2.285 . 0 0 "[ . 1 .]" 1
2322 2 109 LEU HA 2 117 TYR QE 5.000 . 5.300 5.129 4.889 5.316 0.016 11 0 "[ . 1 .]" 1
2323 2 109 LEU HA 2 135 TYR QE 5.000 . 5.300 4.818 4.174 5.410 0.110 11 0 "[ . 1 .]" 1
2324 2 109 LEU MD1 2 110 GLU H 3.500 . 4.000 4.177 4.087 4.334 0.334 8 0 "[ . 1 .]" 1
2325 2 109 LEU MD2 2 110 GLU H 3.500 . 4.000 3.218 2.961 3.570 . 0 0 "[ . 1 .]" 1
2326 2 109 LEU MD1 2 114 GLU HA 5.000 . 5.500 3.589 3.210 3.837 . 0 0 "[ . 1 .]" 1
2327 2 109 LEU MD1 2 114 GLU QB 5.000 . 5.800 1.734 1.670 1.862 0.130 3 0 "[ . 1 .]" 1
2328 2 109 LEU MD1 2 114 GLU QG 3.500 . 4.300 1.809 1.701 2.008 0.099 10 0 "[ . 1 .]" 1
2329 2 109 LEU MD2 2 114 GLU QG 5.000 . 5.800 3.312 2.511 3.840 . 0 0 "[ . 1 .]" 1
2330 2 109 LEU MD1 2 117 TYR QD 5.000 . 5.800 4.809 4.378 5.037 . 0 0 "[ . 1 .]" 1
2331 2 109 LEU MD2 2 117 TYR QB 5.000 . 5.800 4.136 3.828 4.436 . 0 0 "[ . 1 .]" 1
2332 2 109 LEU MD2 2 117 TYR QD 3.500 . 4.300 4.200 3.853 4.404 0.104 1 0 "[ . 1 .]" 1
2333 2 109 LEU MD2 2 117 TYR QE 5.000 . 5.800 4.826 4.404 5.099 . 0 0 "[ . 1 .]" 1
2334 2 109 LEU MD2 2 121 VAL HB 5.000 . 5.500 4.510 3.959 4.932 . 0 0 "[ . 1 .]" 1
2335 2 109 LEU MD2 2 121 VAL MG2 5.000 . 6.000 3.329 2.736 3.790 . 0 0 "[ . 1 .]" 1
2336 2 109 LEU MD2 2 121 VAL MG1 3.500 . 4.500 2.303 2.018 2.569 . 0 0 "[ . 1 .]" 1
2337 2 109 LEU MD1 2 121 VAL MG1 3.500 . 4.500 2.897 2.368 3.214 . 0 0 "[ . 1 .]" 1
2338 2 109 LEU MD1 2 121 VAL MG2 5.000 . 6.000 4.525 3.748 5.069 . 0 0 "[ . 1 .]" 1
2339 2 109 LEU MD1 2 122 ARG HA 5.000 . 5.500 5.199 4.904 5.547 0.047 4 0 "[ . 1 .]" 1
2340 2 109 LEU MD1 2 122 ARG QB 5.000 . 5.800 5.556 4.987 5.855 0.055 3 0 "[ . 1 .]" 1
2341 2 109 LEU MD1 2 132 PHE QB 3.500 . 4.300 1.879 1.746 2.216 0.054 9 0 "[ . 1 .]" 1
2342 2 109 LEU MD1 2 132 PHE QD 3.500 . 4.300 3.015 2.594 3.248 . 0 0 "[ . 1 .]" 1
2343 2 109 LEU MD1 2 132 PHE QE 3.500 . 4.300 4.089 3.641 4.348 0.048 3 0 "[ . 1 .]" 1
2344 2 109 LEU MD1 2 132 PHE HZ 5.000 . 5.500 5.138 4.604 5.423 . 0 0 "[ . 1 .]" 1
2345 2 109 LEU MD2 2 132 PHE QD 5.000 . 5.800 2.383 1.919 2.940 . 0 0 "[ . 1 .]" 1
2346 2 109 LEU MD2 2 132 PHE QE 5.000 . 5.800 3.502 2.857 3.903 . 0 0 "[ . 1 .]" 1
2347 2 109 LEU MD2 2 132 PHE HZ 5.000 . 5.500 5.136 4.520 5.479 . 0 0 "[ . 1 .]" 1
2348 2 109 LEU MD1 2 133 VAL H 5.000 . 5.500 4.231 3.924 4.486 . 0 0 "[ . 1 .]" 1
2349 2 109 LEU MD1 2 134 HIS HA 5.000 . 5.500 3.921 3.344 4.404 . 0 0 "[ . 1 .]" 1
2350 2 109 LEU MD1 2 134 HIS HD2 5.000 . 5.500 3.170 2.010 3.760 . 0 0 "[ . 1 .]" 1
2351 2 109 LEU MD1 2 134 HIS HE1 3.500 . 4.000 2.828 2.228 3.717 . 0 0 "[ . 1 .]" 1
2352 2 109 LEU MD2 2 134 HIS HE1 5.000 . 5.500 5.178 4.228 5.631 0.131 15 0 "[ . 1 .]" 1
2353 2 109 LEU MD2 2 134 HIS HD2 5.000 . 5.500 5.107 4.028 5.544 0.044 11 0 "[ . 1 .]" 1
2354 2 109 LEU MD2 2 135 TYR QE 5.000 . 5.800 5.423 4.901 5.828 0.028 3 0 "[ . 1 .]" 1
2355 2 110 GLU HA 2 111 GLU H 2.700 . 2.700 2.570 2.275 2.769 0.069 4 0 "[ . 1 .]" 1
2356 2 110 GLU H 2 114 GLU H 5.000 . 5.000 2.442 2.097 2.974 . 0 0 "[ . 1 .]" 1
2357 2 110 GLU H 2 114 GLU HA 5.000 . 5.000 3.566 3.037 4.198 . 0 0 "[ . 1 .]" 1
2358 2 110 GLU H 2 117 TYR QD 5.000 . 5.300 4.476 4.193 4.772 . 0 0 "[ . 1 .]" 1
2359 2 110 GLU H 2 117 TYR QE 3.500 . 3.800 3.965 3.859 4.031 0.231 9 0 "[ . 1 .]" 1
2360 2 110 GLU H 2 135 TYR QE 5.000 . 5.300 4.657 3.758 5.471 0.171 3 0 "[ . 1 .]" 1
2361 2 110 GLU HA 2 135 TYR H 3.500 . 3.500 3.472 3.191 3.598 0.098 7 0 "[ . 1 .]" 1
2362 2 110 GLU HA 2 134 HIS HA 5.000 . 5.000 4.650 4.185 5.040 0.040 3 0 "[ . 1 .]" 1
2363 2 110 GLU HA 2 135 TYR QE 5.000 . 5.300 3.397 2.336 4.300 . 0 0 "[ . 1 .]" 1
2364 2 110 GLU HA 2 135 TYR QD 5.000 . 5.300 3.272 2.072 4.015 . 0 0 "[ . 1 .]" 1
2365 2 110 GLU QG 2 135 TYR QD 5.000 . 5.600 4.028 2.930 5.408 . 0 0 "[ . 1 .]" 1
2366 2 110 GLU QG 2 135 TYR QE 5.000 . 5.600 3.107 2.272 4.080 . 0 0 "[ . 1 .]" 1
2367 2 111 GLU H 2 112 GLY H 5.000 . 5.000 3.718 3.075 4.216 . 0 0 "[ . 1 .]" 1
2368 2 111 GLU H 2 135 TYR H 3.500 . 3.500 2.579 1.750 3.046 0.050 15 0 "[ . 1 .]" 1
2369 2 111 GLU H 2 135 TYR QD 5.000 . 5.300 4.228 3.568 4.965 . 0 0 "[ . 1 .]" 1
2370 2 111 GLU H 2 134 HIS HA 5.000 . 5.000 3.114 2.796 3.793 . 0 0 "[ . 1 .]" 1
2371 2 111 GLU HA 2 112 GLY H 3.500 . 3.500 2.395 2.143 2.927 . 0 0 "[ . 1 .]" 1
2372 2 111 GLU HA 2 134 HIS HA 5.000 . 5.000 4.287 3.852 4.701 . 0 0 "[ . 1 .]" 1
2373 2 111 GLU HA 2 134 HIS QB 3.500 . 3.800 3.574 3.116 3.900 0.100 11 0 "[ . 1 .]" 1
2374 2 111 GLU HA 2 134 HIS HD2 5.000 . 5.000 3.304 1.793 5.151 0.151 15 0 "[ . 1 .]" 1
2375 2 111 GLU QB 2 135 TYR H 3.500 . 3.800 3.732 3.279 3.924 0.124 2 0 "[ . 1 .]" 1
2376 2 111 GLU QG 2 112 GLY QA 5.000 . 5.600 5.238 4.833 5.447 . 0 0 "[ . 1 .]" 1
2377 2 111 GLU QG 2 134 HIS HA 3.500 . 3.800 3.621 2.831 3.878 0.078 14 0 "[ . 1 .]" 1
2378 2 111 GLU QG 2 134 HIS QB 3.500 . 4.100 2.091 1.728 2.505 0.072 1 0 "[ . 1 .]" 1
2379 2 111 GLU QG 2 134 HIS HD2 5.000 . 5.300 3.622 2.399 5.090 . 0 0 "[ . 1 .]" 1
2380 2 111 GLU QG 2 136 LYS QB 5.000 . 5.600 3.704 2.432 4.838 . 0 0 "[ . 1 .]" 1
2381 2 111 GLU QG 2 136 LYS QG 3.500 . 4.100 2.847 1.939 4.075 . 0 0 "[ . 1 .]" 1
2382 2 111 GLU QG 2 136 LYS QD 5.000 . 5.600 3.614 1.864 5.509 . 0 0 "[ . 1 .]" 1
2383 2 111 GLU QG 2 136 LYS QE 3.500 . 4.100 3.485 1.858 4.122 0.022 6 0 "[ . 1 .]" 1
2384 2 112 GLY H 2 113 ARG H 3.500 . 3.500 3.136 2.674 3.483 . 0 0 "[ . 1 .]" 1
2385 2 113 ARG H 2 114 GLU H 2.700 . 2.700 2.730 2.643 2.792 0.092 9 0 "[ . 1 .]" 1
2386 2 113 ARG HA 2 116 GLU H 3.500 . 3.500 3.044 2.733 3.296 . 0 0 "[ . 1 .]" 1
2387 2 113 ARG HA 2 116 GLU QB 5.000 . 5.300 2.357 1.801 2.764 . 0 0 "[ . 1 .]" 1
2388 2 113 ARG HA 2 116 GLU QG 3.500 . 3.800 3.269 2.748 3.845 0.045 11 0 "[ . 1 .]" 1
2389 2 114 GLU H 2 115 GLU H 2.700 . 2.700 2.779 2.750 2.805 0.105 4 0 "[ . 1 .]" 1
2390 2 114 GLU H 2 117 TYR QD 2.700 . 3.000 3.127 3.090 3.157 0.157 4 0 "[ . 1 .]" 1
2391 2 114 GLU HA 2 117 TYR H 3.500 . 3.500 3.357 3.066 3.516 0.016 13 0 "[ . 1 .]" 1
2392 2 114 GLU HA 2 117 TYR QD 3.500 . 3.800 1.618 1.512 1.676 0.288 9 0 "[ . 1 .]" 1
2393 2 114 GLU HA 2 117 TYR QE 5.000 . 5.300 3.215 2.992 3.465 . 0 0 "[ . 1 .]" 1
2394 2 114 GLU HA 2 121 VAL MG1 5.000 . 5.500 3.493 3.052 3.988 . 0 0 "[ . 1 .]" 1
2395 2 114 GLU QG 2 117 TYR QD 5.000 . 5.600 4.190 3.773 4.483 . 0 0 "[ . 1 .]" 1
2396 2 114 GLU QG 2 117 TYR QE 5.000 . 5.600 5.411 4.934 5.686 0.086 1 0 "[ . 1 .]" 1
2397 2 114 GLU QG 2 121 VAL MG1 5.000 . 5.800 4.298 2.388 5.189 . 0 0 "[ . 1 .]" 1
2398 2 114 GLU QG 2 122 ARG QD 5.000 . 5.600 5.060 3.824 5.632 0.032 12 0 "[ . 1 .]" 1
2399 2 114 GLU QG 2 134 HIS HE1 3.500 . 3.800 3.356 2.250 3.825 0.025 11 0 "[ . 1 .]" 1
2400 2 114 GLU HA 2 117 TYR HB2 2.700 . 2.700 2.704 2.320 2.842 0.142 13 0 "[ . 1 .]" 1
2401 2 115 GLU H 2 116 GLU H 2.700 . 2.700 2.611 2.410 2.764 0.064 9 0 "[ . 1 .]" 1
2402 2 115 GLU H 2 117 TYR QD 5.000 . 5.300 3.742 3.416 4.054 . 0 0 "[ . 1 .]" 1
2403 2 115 GLU HA 2 122 ARG QD 5.000 . 5.300 4.119 3.276 5.110 . 0 0 "[ . 1 .]" 1
2404 2 115 GLU QG 2 122 ARG QD 5.000 . 5.600 4.814 4.306 5.564 . 0 0 "[ . 1 .]" 1
2405 2 116 GLU H 2 117 TYR H 3.500 . 3.500 2.629 2.474 2.848 . 0 0 "[ . 1 .]" 1
2406 2 116 GLU H 2 117 TYR QD 3.500 . 3.800 3.594 3.326 3.786 . 0 0 "[ . 1 .]" 1
2407 2 117 TYR HA 2 117 TYR QD 3.500 . 3.800 2.747 2.665 2.812 . 0 0 "[ . 1 .]" 1
2408 2 117 TYR HA 2 117 TYR QE 3.500 . 3.800 4.351 4.292 4.404 0.604 5 14 "[****+****- ****]" 1
2409 2 117 TYR QB 2 120 LEU H 3.500 . 3.800 4.116 4.052 4.179 0.379 13 0 "[ . 1 .]" 1
2410 2 117 TYR QB 2 121 VAL MG1 3.500 . 4.300 2.752 2.184 3.211 . 0 0 "[ . 1 .]" 1
2411 2 117 TYR QB 2 121 VAL MG2 3.500 . 4.300 2.015 1.760 3.008 0.040 7 0 "[ . 1 .]" 1
2412 2 117 TYR QE 2 121 VAL MG2 5.000 . 5.800 3.823 3.456 4.323 . 0 0 "[ . 1 .]" 1
2413 2 117 TYR QE 2 121 VAL MG1 5.000 . 5.800 5.261 4.967 5.605 . 0 0 "[ . 1 .]" 1
2414 2 117 TYR QD 2 121 VAL MG1 3.500 . 4.300 3.989 3.652 4.319 0.019 6 0 "[ . 1 .]" 1
2415 2 117 TYR QD 2 121 VAL MG2 3.500 . 4.300 2.513 2.092 3.314 . 0 0 "[ . 1 .]" 1
2416 2 117 TYR HA 2 121 VAL H 5.000 . 5.000 4.562 4.346 4.786 . 0 0 "[ . 1 .]" 1
2417 2 117 TYR QB 2 121 VAL H 5.000 . 5.300 2.831 2.617 3.039 . 0 0 "[ . 1 .]" 1
2418 2 117 TYR H 2 117 TYR HB2 2.700 . 2.700 2.468 2.329 2.597 . 0 0 "[ . 1 .]" 1
2419 2 118 GLY QA 2 121 VAL MG2 5.000 . 5.800 4.816 4.421 5.185 . 0 0 "[ . 1 .]" 1
2420 2 119 PHE HA 2 122 ARG H 5.000 . 5.000 5.021 4.886 5.066 0.066 11 0 "[ . 1 .]" 1
2421 2 120 LEU H 2 121 VAL H 3.500 . 3.500 2.376 2.222 2.685 . 0 0 "[ . 1 .]" 1
2422 2 120 LEU HA 2 123 GLY H 5.000 . 5.000 3.279 3.132 3.793 . 0 0 "[ . 1 .]" 1
2423 2 120 LEU HA 2 124 LEU MD1 5.000 . 5.500 3.385 2.824 5.323 . 0 0 "[ . 1 .]" 1
2424 2 120 LEU MD2 2 127 VAL MG2 5.000 . 6.000 4.393 3.858 5.591 . 0 0 "[ . 1 .]" 1
2425 2 120 LEU MD1 2 127 VAL MG2 5.000 . 6.000 5.620 4.162 6.144 0.144 12 0 "[ . 1 .]" 1
2426 2 121 VAL H 2 122 ARG H 2.700 . 2.700 2.695 2.587 2.828 0.128 5 0 "[ . 1 .]" 1
2427 2 121 VAL HA 2 124 LEU H 3.500 . 3.500 3.615 3.514 3.708 0.208 15 0 "[ . 1 .]" 1
2428 2 121 VAL HA 2 124 LEU MD1 3.500 . 4.000 3.595 2.825 4.182 0.182 14 0 "[ . 1 .]" 1
2429 2 121 VAL MG1 2 132 PHE QE 3.500 . 4.300 2.013 1.781 2.403 0.019 9 0 "[ . 1 .]" 1
2430 2 121 VAL MG1 2 132 PHE HZ 3.500 . 4.000 2.793 2.135 3.379 . 0 0 "[ . 1 .]" 1
2431 2 122 ARG H 2 123 GLY H 3.500 . 3.500 2.623 2.480 2.719 . 0 0 "[ . 1 .]" 1
2432 2 122 ARG HA 2 125 GLY H 5.000 . 5.000 3.080 2.874 3.279 . 0 0 "[ . 1 .]" 1
2433 2 122 ARG HA 2 132 PHE QE 3.500 . 3.800 2.436 1.962 2.775 . 0 0 "[ . 1 .]" 1
2434 2 122 ARG HA 2 132 PHE HZ 3.500 . 3.500 2.250 1.908 2.733 . 0 0 "[ . 1 .]" 1
2435 2 123 GLY H 2 124 LEU H 3.500 . 3.500 2.734 2.607 2.834 . 0 0 "[ . 1 .]" 1
2436 2 123 GLY QA 2 126 THR H 5.000 . 5.300 3.508 3.305 3.788 . 0 0 "[ . 1 .]" 1
2437 2 123 GLY QA 2 126 THR MG 3.500 . 4.300 1.949 1.774 2.287 0.026 10 0 "[ . 1 .]" 1
2438 2 123 GLY QA 2 127 VAL MG2 5.000 . 5.800 3.577 3.419 3.797 . 0 0 "[ . 1 .]" 1
2439 2 124 LEU H 2 125 GLY H 2.700 . 2.700 2.447 2.340 2.563 . 0 0 "[ . 1 .]" 1
2440 2 124 LEU H 2 132 PHE HZ 3.500 . 3.500 3.537 3.375 3.668 0.168 6 0 "[ . 1 .]" 1
2441 2 124 LEU HA 2 126 THR MG 5.000 . 5.500 3.844 3.583 4.209 . 0 0 "[ . 1 .]" 1
2442 2 124 LEU HA 2 127 VAL H 3.500 . 3.500 3.057 2.779 3.252 . 0 0 "[ . 1 .]" 1
2443 2 124 LEU HA 2 128 ALA H 3.500 . 3.500 2.963 2.757 3.280 . 0 0 "[ . 1 .]" 1
2444 2 124 LEU HA 2 127 VAL MG1 5.000 . 5.500 3.725 3.474 3.972 . 0 0 "[ . 1 .]" 1
2445 2 124 LEU HA 2 127 VAL MG2 3.500 . 4.000 1.725 1.619 1.788 0.181 11 0 "[ . 1 .]" 1
2446 2 124 LEU HA 2 128 ALA MB 5.000 . 5.500 3.789 3.424 4.239 . 0 0 "[ . 1 .]" 1
2447 2 124 LEU QB 2 130 VAL MG2 5.000 . 5.800 1.819 1.723 1.937 0.077 7 0 "[ . 1 .]" 1
2448 2 124 LEU MD1 2 127 VAL H 5.000 . 5.500 5.133 4.146 5.553 0.053 15 0 "[ . 1 .]" 1
2449 2 124 LEU MD1 2 127 VAL MG2 3.500 . 4.500 3.010 2.103 3.577 . 0 0 "[ . 1 .]" 1
2450 2 124 LEU MD2 2 127 VAL MG2 5.000 . 6.000 3.613 2.367 4.241 . 0 0 "[ . 1 .]" 1
2451 2 124 LEU MD1 2 128 ALA MB 5.000 . 6.000 4.205 3.136 4.574 . 0 0 "[ . 1 .]" 1
2452 2 124 LEU MD2 2 128 ALA MB 5.000 . 6.000 3.197 2.231 5.683 . 0 0 "[ . 1 .]" 1
2453 2 124 LEU MD1 2 130 VAL MG2 3.500 . 4.500 3.524 1.757 3.864 0.043 14 0 "[ . 1 .]" 1
2454 2 124 LEU MD2 2 130 VAL MG2 5.000 . 6.000 2.156 1.750 3.682 0.050 6 0 "[ . 1 .]" 1
2455 2 124 LEU MD2 2 130 VAL MG1 5.000 . 6.000 2.980 2.058 4.403 . 0 0 "[ . 1 .]" 1
2456 2 124 LEU MD1 2 130 VAL MG1 3.500 . 4.500 4.218 3.102 4.562 0.062 6 0 "[ . 1 .]" 1
2457 2 124 LEU MD2 2 132 PHE HZ 5.000 . 5.500 5.166 4.369 5.512 0.012 11 0 "[ . 1 .]" 1
2458 2 124 LEU MD2 2 132 PHE QE 5.000 . 5.800 4.778 3.683 5.350 . 0 0 "[ . 1 .]" 1
2459 2 125 GLY H 2 126 THR H 2.700 . 2.700 2.621 2.539 2.726 0.026 15 0 "[ . 1 .]" 1
2460 2 125 GLY H 2 128 ALA H 5.000 . 5.000 4.942 4.769 5.081 0.081 2 0 "[ . 1 .]" 1
2461 2 125 GLY H 2 126 THR MG 3.500 . 4.000 3.854 3.531 4.058 0.058 2 0 "[ . 1 .]" 1
2462 2 125 GLY H 2 130 VAL MG2 3.500 . 4.000 3.638 3.339 3.872 . 0 0 "[ . 1 .]" 1
2463 2 125 GLY H 2 130 VAL MG1 3.500 . 4.000 3.168 2.857 3.565 . 0 0 "[ . 1 .]" 1
2464 2 125 GLY H 2 132 PHE HZ 3.500 . 3.500 1.916 1.727 2.494 0.073 11 0 "[ . 1 .]" 1
2465 2 125 GLY H 2 132 PHE QE 3.500 . 3.800 3.175 2.818 3.447 . 0 0 "[ . 1 .]" 1
2466 2 125 GLY QA 2 126 THR MG 5.000 . 5.800 4.217 3.928 4.386 . 0 0 "[ . 1 .]" 1
2467 2 125 GLY QA 2 130 VAL MG1 5.000 . 5.800 2.758 2.492 3.032 . 0 0 "[ . 1 .]" 1
2468 2 125 GLY QA 2 130 VAL MG2 3.500 . 4.300 3.016 2.640 3.266 . 0 0 "[ . 1 .]" 1
2469 2 126 THR H 2 127 VAL H 2.700 . 2.700 2.309 2.199 2.376 . 0 0 "[ . 1 .]" 1
2470 2 126 THR MG 2 127 VAL HA 5.000 . 5.500 3.376 3.199 3.726 . 0 0 "[ . 1 .]" 1
2471 2 126 THR MG 2 127 VAL MG1 3.500 . 4.500 2.047 1.874 2.476 . 0 0 "[ . 1 .]" 1
2472 2 127 VAL H 2 128 ALA H 2.700 . 2.700 2.577 2.387 2.727 0.027 13 0 "[ . 1 .]" 1
2473 2 127 VAL H 2 130 VAL MG2 5.000 . 5.500 4.460 4.036 4.852 . 0 0 "[ . 1 .]" 1
2474 2 127 VAL MG2 2 130 VAL MG2 5.000 . 6.000 3.382 3.023 3.733 . 0 0 "[ . 1 .]" 1
2475 2 128 ALA H 2 130 VAL MG2 3.500 . 4.000 3.057 2.637 3.431 . 0 0 "[ . 1 .]" 1
2476 2 128 ALA H 2 130 VAL MG1 5.000 . 5.500 5.364 4.978 5.587 0.087 11 0 "[ . 1 .]" 1
2477 2 128 ALA HA 2 129 ALA H 2.700 . 2.700 2.332 2.231 2.476 . 0 0 "[ . 1 .]" 1
2478 2 128 ALA HA 2 156 VAL MG1 5.000 . 5.500 5.537 5.380 5.616 0.116 3 0 "[ . 1 .]" 1
2479 2 128 ALA HA 2 156 VAL MG2 5.000 . 5.500 5.487 5.206 5.622 0.122 8 0 "[ . 1 .]" 1
2480 2 128 ALA MB 2 130 VAL MG1 5.000 . 6.000 4.733 4.497 4.908 . 0 0 "[ . 1 .]" 1
2481 2 128 ALA MB 2 130 VAL MG2 2.700 . 3.700 2.485 2.216 2.658 . 0 0 "[ . 1 .]" 1
2482 2 129 ALA HA 2 130 VAL H 2.700 . 2.700 2.314 2.215 2.415 . 0 0 "[ . 1 .]" 1
2483 2 129 ALA HA 2 130 VAL MG2 5.000 . 5.500 4.122 3.785 4.541 . 0 0 "[ . 1 .]" 1
2484 2 129 ALA HA 2 156 VAL MG2 5.000 . 5.500 3.535 2.658 4.046 . 0 0 "[ . 1 .]" 1
2485 2 129 ALA MB 2 152 VAL HA 5.000 . 5.500 4.153 3.045 5.386 . 0 0 "[ . 1 .]" 1
2486 2 129 ALA MB 2 152 VAL MG2 3.500 . 4.500 2.408 1.802 3.218 . 0 0 "[ . 1 .]" 1
2487 2 129 ALA MB 2 155 ARG QG 3.500 . 4.300 3.609 2.521 4.296 . 0 0 "[ . 1 .]" 1
2488 2 129 ALA MB 2 155 ARG QD 3.500 . 4.300 3.173 1.904 4.280 . 0 0 "[ . 1 .]" 1
2489 2 129 ALA MB 2 156 VAL HA 5.000 . 5.500 4.046 3.030 4.571 . 0 0 "[ . 1 .]" 1
2490 2 129 ALA MB 2 156 VAL MG2 2.700 . 3.700 1.688 1.598 1.759 0.202 3 0 "[ . 1 .]" 1
2491 2 129 ALA MB 2 156 VAL MG1 3.500 . 4.500 2.573 1.782 3.076 0.018 1 0 "[ . 1 .]" 1
2492 2 130 VAL HA 2 131 GLU H 2.700 . 2.700 2.186 2.141 2.242 . 0 0 "[ . 1 .]" 1
2493 2 130 VAL HA 2 152 VAL MG2 5.000 . 5.500 3.685 2.837 4.458 . 0 0 "[ . 1 .]" 1
2494 2 130 VAL MG1 2 131 GLU H 2.700 . 3.200 3.121 2.886 3.246 0.046 9 0 "[ . 1 .]" 1
2495 2 130 VAL MG1 2 132 PHE QD 3.500 . 4.300 3.048 2.690 3.370 . 0 0 "[ . 1 .]" 1
2496 2 130 VAL MG1 2 132 PHE QE 3.500 . 4.300 1.944 1.760 2.198 0.040 14 0 "[ . 1 .]" 1
2497 2 130 VAL MG1 2 132 PHE HZ 3.500 . 4.000 2.746 2.219 3.222 . 0 0 "[ . 1 .]" 1
2498 2 131 GLU HA 2 132 PHE H 2.700 . 2.700 2.169 2.125 2.266 . 0 0 "[ . 1 .]" 1
2499 2 131 GLU HA 2 148 ALA MB 5.000 . 5.500 4.320 3.753 5.161 . 0 0 "[ . 1 .]" 1
2500 2 131 GLU QB 2 152 VAL MG2 3.500 . 4.300 2.326 1.758 3.506 0.042 13 0 "[ . 1 .]" 1
2501 2 131 GLU QG 2 152 VAL MG2 5.000 . 5.800 2.580 1.775 4.308 0.025 10 0 "[ . 1 .]" 1
2502 2 131 GLU QB 2 152 VAL MG1 5.000 . 5.800 3.038 1.837 3.824 . 0 0 "[ . 1 .]" 1
2503 2 132 PHE HA 2 133 VAL H 2.700 . 2.700 2.184 2.125 2.251 . 0 0 "[ . 1 .]" 1
2504 2 132 PHE HA 2 133 VAL MG2 3.500 . 4.000 4.053 3.934 4.123 0.123 1 0 "[ . 1 .]" 1
2505 2 132 PHE QD 2 133 VAL H 3.500 . 3.800 3.723 3.491 3.840 0.040 14 0 "[ . 1 .]" 1
2506 2 133 VAL HA 2 134 HIS H 2.700 . 2.700 2.212 2.152 2.279 . 0 0 "[ . 1 .]" 1
2507 2 133 VAL MG1 2 134 HIS H 2.700 . 3.200 3.143 2.900 3.292 0.092 11 0 "[ . 1 .]" 1
2508 2 133 VAL MG1 2 135 TYR HA 5.000 . 5.500 3.947 3.547 4.439 . 0 0 "[ . 1 .]" 1
2509 2 133 VAL MG1 2 135 TYR QD 3.500 . 4.300 3.966 3.459 4.441 0.141 3 0 "[ . 1 .]" 1
2510 2 133 VAL MG1 2 135 TYR QE 5.000 . 5.800 5.407 4.777 5.866 0.066 1 0 "[ . 1 .]" 1
2511 2 133 VAL MG1 2 141 ALA HA 5.000 . 5.500 3.162 2.655 3.610 . 0 0 "[ . 1 .]" 1
2512 2 133 VAL MG1 2 144 GLN H 5.000 . 5.500 4.431 4.024 4.809 . 0 0 "[ . 1 .]" 1
2513 2 133 VAL MG2 2 144 GLN H 5.000 . 5.500 5.478 4.892 5.638 0.138 5 0 "[ . 1 .]" 1
2514 2 133 VAL MG1 2 144 GLN HA 5.000 . 5.500 4.302 3.577 4.750 . 0 0 "[ . 1 .]" 1
2515 2 133 VAL MG2 2 144 GLN HA 5.000 . 5.500 4.510 3.775 4.848 . 0 0 "[ . 1 .]" 1
2516 2 133 VAL MG1 2 144 GLN QG 2.700 . 3.500 1.891 1.738 2.532 0.062 15 0 "[ . 1 .]" 1
2517 2 133 VAL MG2 2 144 GLN QG 2.700 . 3.500 2.566 1.979 3.463 . 0 0 "[ . 1 .]" 1
2518 2 133 VAL MG2 2 144 GLN QB 3.500 . 4.300 3.801 2.293 4.202 . 0 0 "[ . 1 .]" 1
2519 2 133 VAL MG1 2 145 ILE H 5.000 . 5.500 3.024 2.400 3.310 . 0 0 "[ . 1 .]" 1
2520 2 133 VAL MG1 2 145 ILE HA 5.000 . 5.500 2.682 2.315 3.347 . 0 0 "[ . 1 .]" 1
2521 2 133 VAL MG2 2 145 ILE HA 3.500 . 4.000 1.922 1.761 2.367 0.039 15 0 "[ . 1 .]" 1
2522 2 133 VAL MG2 2 145 ILE MD 3.500 . 4.500 3.924 3.220 4.419 . 0 0 "[ . 1 .]" 1
2523 2 133 VAL MG2 2 148 ALA MB 3.500 . 4.500 2.012 1.678 2.638 0.122 6 0 "[ . 1 .]" 1
2524 2 134 HIS HA 2 135 TYR H 2.700 . 2.700 2.219 2.113 2.343 . 0 0 "[ . 1 .]" 1
2525 2 134 HIS HA 2 135 TYR QD 5.000 . 5.300 3.932 3.253 4.696 . 0 0 "[ . 1 .]" 1
2526 2 135 TYR HA 2 141 ALA MB 3.500 . 4.000 3.444 2.878 3.839 . 0 0 "[ . 1 .]" 1
2527 2 135 TYR HA 2 138 ILE MD 5.000 . 5.500 5.423 5.052 5.562 0.062 4 0 "[ . 1 .]" 1
2528 2 135 TYR QB 2 141 ALA MB 3.500 . 4.300 2.493 1.741 4.403 0.103 15 0 "[ . 1 .]" 1
2529 2 135 TYR QD 2 136 LYS HA 5.000 . 5.300 3.812 3.302 4.570 . 0 0 "[ . 1 .]" 1
2530 2 135 TYR QE 2 136 LYS HA 5.000 . 5.300 5.013 4.105 5.521 0.221 11 0 "[ . 1 .]" 1
2531 2 135 TYR QD 2 137 ASP HA 5.000 . 5.300 4.288 3.232 5.311 0.011 8 0 "[ . 1 .]" 1
2532 2 135 TYR QD 2 138 ILE HA 5.000 . 5.300 3.788 2.945 4.748 . 0 0 "[ . 1 .]" 1
2533 2 135 TYR QD 2 138 ILE MD 3.500 . 4.300 3.086 1.981 4.043 . 0 0 "[ . 1 .]" 1
2534 2 135 TYR QE 2 138 ILE MD 3.500 . 4.300 2.941 1.861 4.240 . 0 0 "[ . 1 .]" 1
2535 2 135 TYR QD 2 141 ALA HA 5.000 . 5.300 5.100 4.369 5.427 0.127 15 0 "[ . 1 .]" 1
2536 2 135 TYR QD 2 141 ALA MB 3.500 . 4.300 2.992 2.279 3.498 . 0 0 "[ . 1 .]" 1
2537 2 135 TYR QE 2 141 ALA MB 5.000 . 5.800 4.013 2.751 5.002 . 0 0 "[ . 1 .]" 1
2538 2 136 LYS QB 2 137 ASP QB 5.000 . 5.600 3.713 3.236 4.569 . 0 0 "[ . 1 .]" 1
2539 2 136 LYS QB 2 140 LEU MD1 5.000 . 5.800 4.487 2.583 5.692 . 0 0 "[ . 1 .]" 1
2540 2 136 LYS QB 2 140 LEU MD2 5.000 . 5.800 5.195 4.218 5.831 0.031 13 0 "[ . 1 .]" 1
2541 2 136 LYS QE 2 140 LEU MD1 5.000 . 5.800 5.150 4.213 5.827 0.027 1 0 "[ . 1 .]" 1
2542 2 137 ASP HA 2 138 ILE H 2.700 . 2.700 2.210 2.149 2.313 . 0 0 "[ . 1 .]" 1
2543 2 137 ASP QB 2 139 ALA H 3.500 . 3.800 3.408 2.758 3.799 . 0 0 "[ . 1 .]" 1
2544 2 137 ASP QB 2 139 ALA MB 5.000 . 5.800 3.321 2.586 3.889 . 0 0 "[ . 1 .]" 1
2545 2 137 ASP QB 2 140 LEU MD1 2.700 . 3.500 2.529 1.897 3.310 . 0 0 "[ . 1 .]" 1
2546 2 137 ASP QB 2 140 LEU MD2 3.500 . 4.300 3.643 1.842 4.334 0.034 12 0 "[ . 1 .]" 1
2547 2 138 ILE H 2 139 ALA H 2.700 . 2.700 2.724 2.519 2.804 0.104 1 0 "[ . 1 .]" 1
2548 2 138 ILE MG 2 139 ALA H 2.700 . 3.200 2.974 2.591 3.239 0.039 1 0 "[ . 1 .]" 1
2549 2 138 ILE MG 2 139 ALA HA 5.000 . 5.500 3.062 2.746 3.283 . 0 0 "[ . 1 .]" 1
2550 2 138 ILE MG 2 139 ALA MB 5.000 . 6.000 3.751 3.404 4.014 . 0 0 "[ . 1 .]" 1
2551 2 138 ILE HA 2 141 ALA MB 3.500 . 4.000 1.982 1.772 2.155 0.028 7 0 "[ . 1 .]" 1
2552 2 138 ILE HA 2 141 ALA H 5.000 . 5.000 2.741 2.574 2.931 . 0 0 "[ . 1 .]" 1
2553 2 138 ILE MD 2 141 ALA H 5.000 . 5.500 3.783 3.545 4.176 . 0 0 "[ . 1 .]" 1
2554 2 138 ILE MD 2 141 ALA MB 3.500 . 4.500 2.131 1.805 2.516 . 0 0 "[ . 1 .]" 1
2555 2 138 ILE MG 2 141 ALA MB 3.500 . 4.500 3.335 2.855 3.552 . 0 0 "[ . 1 .]" 1
2556 2 138 ILE MG 2 141 ALA H 3.500 . 4.000 3.994 3.830 4.076 0.076 7 0 "[ . 1 .]" 1
2557 2 138 ILE MG 2 142 LYS H 3.500 . 4.000 3.436 2.429 3.727 . 0 0 "[ . 1 .]" 1
2558 2 138 ILE MG 2 142 LYS QE 5.000 . 5.800 3.389 2.611 3.988 . 0 0 "[ . 1 .]" 1
2559 2 138 ILE MD 2 142 LYS QE 5.000 . 5.800 5.376 4.544 5.731 . 0 0 "[ . 1 .]" 1
2560 2 138 ILE MD 2 145 ILE MD 5.000 . 6.000 4.724 3.996 5.218 . 0 0 "[ . 1 .]" 1
2561 2 138 ILE MD 2 145 ILE MG 5.000 . 6.000 4.983 4.225 6.003 0.003 11 0 "[ . 1 .]" 1
2562 2 139 ALA H 2 140 LEU H 2.700 . 2.700 2.713 2.579 2.795 0.095 7 0 "[ . 1 .]" 1
2563 2 139 ALA H 2 141 ALA H 5.000 . 5.000 4.025 3.715 4.296 . 0 0 "[ . 1 .]" 1
2564 2 139 ALA HA 2 142 LYS H 5.000 . 5.000 4.153 3.625 4.532 . 0 0 "[ . 1 .]" 1
2565 2 139 ALA HA 2 142 LYS QE 3.500 . 3.800 3.391 2.446 3.812 0.012 8 0 "[ . 1 .]" 1
2566 2 139 ALA HA 2 142 LYS QD 3.500 . 3.800 2.430 1.775 3.803 0.025 11 0 "[ . 1 .]" 1
2567 2 139 ALA MB 2 140 LEU MD2 5.000 . 6.000 4.452 2.793 5.695 . 0 0 "[ . 1 .]" 1
2568 2 139 ALA MB 2 140 LEU MD1 5.000 . 6.000 3.837 2.247 5.354 . 0 0 "[ . 1 .]" 1
2569 2 140 LEU H 2 141 ALA H 2.700 . 2.700 1.999 1.797 2.271 0.003 5 0 "[ . 1 .]" 1
2570 2 140 LEU H 2 142 LYS H 5.000 . 5.000 3.657 3.229 4.167 . 0 0 "[ . 1 .]" 1
2571 2 140 LEU HA 2 141 ALA H 3.500 . 3.500 3.483 3.406 3.542 0.042 13 0 "[ . 1 .]" 1
2572 2 140 LEU MD2 2 143 PRO QD 5.000 . 5.800 4.446 3.787 5.345 . 0 0 "[ . 1 .]" 1
2573 2 141 ALA H 2 142 LYS H 2.700 . 2.700 2.591 2.328 2.727 0.027 6 0 "[ . 1 .]" 1
2574 2 141 ALA HA 2 144 GLN H 3.500 . 3.500 3.446 3.175 3.577 0.077 13 0 "[ . 1 .]" 1
2575 2 141 ALA HA 2 145 ILE H 5.000 . 5.000 3.470 2.965 4.004 . 0 0 "[ . 1 .]" 1
2576 2 141 ALA HA 2 144 GLN QB 3.500 . 3.800 2.333 2.154 2.601 . 0 0 "[ . 1 .]" 1
2577 2 141 ALA HA 2 144 GLN QG 3.500 . 3.800 3.751 3.273 3.924 0.124 10 0 "[ . 1 .]" 1
2578 2 141 ALA HA 2 145 ILE MD 5.000 . 5.500 5.277 4.940 5.590 0.090 9 0 "[ . 1 .]" 1
2579 2 141 ALA MB 2 145 ILE MD 5.000 . 6.000 3.827 3.605 4.223 . 0 0 "[ . 1 .]" 1
2580 2 142 LYS H 2 144 GLN H 5.000 . 5.000 4.024 3.664 4.399 . 0 0 "[ . 1 .]" 1
2581 2 142 LYS H 2 143 PRO QD 3.500 . 3.800 2.088 1.838 2.420 . 0 0 "[ . 1 .]" 1
2582 2 142 LYS HA 2 145 ILE H 5.000 . 5.000 3.861 3.519 4.370 . 0 0 "[ . 1 .]" 1
2583 2 142 LYS HA 2 146 ASP H 5.000 . 5.000 4.208 3.981 4.409 . 0 0 "[ . 1 .]" 1
2584 2 142 LYS HA 2 145 ILE MD 3.500 . 4.000 3.937 3.647 4.029 0.029 4 0 "[ . 1 .]" 1
2585 2 142 LYS HA 2 145 ILE MG 5.000 . 5.500 2.111 1.829 2.739 . 0 0 "[ . 1 .]" 1
2586 2 143 PRO HA 2 144 GLN H 3.500 . 3.500 3.541 3.494 3.574 0.074 13 0 "[ . 1 .]" 1
2587 2 143 PRO HA 2 146 ASP H 3.500 . 3.500 3.439 3.334 3.533 0.033 2 0 "[ . 1 .]" 1
2588 2 143 PRO HA 2 147 ALA H 5.000 . 5.000 3.966 3.669 4.247 . 0 0 "[ . 1 .]" 1
2589 2 143 PRO HA 2 146 ASP QB 3.500 . 3.800 2.479 2.177 2.811 . 0 0 "[ . 1 .]" 1
2590 2 144 GLN H 2 145 ILE H 2.700 . 2.700 2.562 2.292 2.726 0.026 1 0 "[ . 1 .]" 1
2591 2 144 GLN H 2 146 ASP H 5.000 . 5.000 3.820 3.506 4.029 . 0 0 "[ . 1 .]" 1
2592 2 144 GLN HA 2 145 ILE H 3.500 . 3.500 3.525 3.494 3.551 0.051 8 0 "[ . 1 .]" 1
2593 2 144 GLN HA 2 147 ALA H 3.500 . 3.500 3.530 3.449 3.607 0.107 14 0 "[ . 1 .]" 1
2594 2 144 GLN HA 2 148 ALA H 5.000 . 5.000 3.915 3.535 4.170 . 0 0 "[ . 1 .]" 1
2595 2 144 GLN HA 2 147 ALA MB 3.500 . 4.000 2.865 2.494 3.191 . 0 0 "[ . 1 .]" 1
2596 2 145 ILE H 2 146 ASP H 2.700 . 2.700 2.513 2.336 2.620 . 0 0 "[ . 1 .]" 1
2597 2 145 ILE H 2 147 ALA H 5.000 . 5.000 4.173 3.762 4.456 . 0 0 "[ . 1 .]" 1
2598 2 145 ILE HA 2 148 ALA H 5.000 . 5.000 3.666 3.437 3.946 . 0 0 "[ . 1 .]" 1
2599 2 145 ILE HA 2 148 ALA MB 3.500 . 4.000 2.775 2.404 3.256 . 0 0 "[ . 1 .]" 1
2600 2 145 ILE MG 2 149 ILE MD 2.700 . 3.700 2.547 1.880 3.382 . 0 0 "[ . 1 .]" 1
2601 2 145 ILE MD 2 149 ILE MD 3.500 . 4.500 2.734 1.860 4.109 . 0 0 "[ . 1 .]" 1
2602 2 146 ASP H 2 147 ALA H 2.700 . 2.700 2.575 2.407 2.683 . 0 0 "[ . 1 .]" 1
2603 2 146 ASP H 2 148 ALA H 5.000 . 5.000 4.133 3.760 4.655 . 0 0 "[ . 1 .]" 1
2604 2 146 ASP HA 2 149 ILE H 3.500 . 3.500 3.459 3.256 3.562 0.062 13 0 "[ . 1 .]" 1
2605 2 146 ASP HA 2 150 ARG H 5.000 . 5.000 4.016 3.728 4.254 . 0 0 "[ . 1 .]" 1
2606 2 146 ASP HA 2 149 ILE HB 3.500 . 3.500 2.224 1.894 2.587 . 0 0 "[ . 1 .]" 1
2607 2 146 ASP HA 2 149 ILE MD 5.000 . 5.500 2.565 2.137 3.218 . 0 0 "[ . 1 .]" 1
2608 2 146 ASP HA 2 149 ILE MG 5.000 . 5.500 3.156 2.490 3.811 . 0 0 "[ . 1 .]" 1
2609 2 147 ALA H 2 148 ALA H 2.700 . 2.700 2.671 2.527 2.771 0.071 6 0 "[ . 1 .]" 1
2610 2 147 ALA H 2 149 ILE H 5.000 . 5.000 3.752 3.350 4.026 . 0 0 "[ . 1 .]" 1
2611 2 147 ALA HA 2 150 ARG H 3.500 . 3.500 3.511 3.357 3.583 0.083 4 0 "[ . 1 .]" 1
2612 2 147 ALA HA 2 150 ARG QB 3.500 . 3.800 3.251 2.649 3.843 0.043 1 0 "[ . 1 .]" 1
2613 2 147 ALA HA 2 150 ARG QG 3.500 . 3.800 2.961 2.334 3.814 0.014 5 0 "[ . 1 .]" 1
2614 2 147 ALA HA 2 150 ARG QD 5.000 . 5.300 4.423 2.133 4.886 . 0 0 "[ . 1 .]" 1
2615 2 147 ALA MB 2 150 ARG QB 5.000 . 5.800 4.470 4.129 4.985 . 0 0 "[ . 1 .]" 1
2616 2 147 ALA MB 2 150 ARG QD 5.000 . 5.800 5.466 3.624 5.857 0.057 5 0 "[ . 1 .]" 1
2617 2 147 ALA MB 2 151 LYS QE 5.000 . 5.800 5.147 4.336 5.850 0.050 1 0 "[ . 1 .]" 1
2618 2 148 ALA H 2 149 ILE H 2.700 . 2.700 2.549 2.433 2.657 . 0 0 "[ . 1 .]" 1
2619 2 148 ALA HA 2 151 LYS QB 3.500 . 3.800 2.493 2.109 3.408 . 0 0 "[ . 1 .]" 1
2620 2 148 ALA HA 2 151 LYS QD 3.500 . 3.800 3.031 2.004 3.777 . 0 0 "[ . 1 .]" 1
2621 2 148 ALA HA 2 151 LYS QE 5.000 . 5.300 3.528 1.918 5.258 . 0 0 "[ . 1 .]" 1
2622 2 148 ALA HA 2 151 LYS QG 5.000 . 5.300 3.884 2.652 4.562 . 0 0 "[ . 1 .]" 1
2623 2 149 ILE H 2 150 ARG H 2.700 . 2.700 2.631 2.573 2.715 0.015 14 0 "[ . 1 .]" 1
2624 2 149 ILE H 2 151 LYS H 5.000 . 5.000 3.936 3.459 4.451 . 0 0 "[ . 1 .]" 1
2625 2 149 ILE HA 2 152 VAL H 5.000 . 5.000 3.738 3.503 3.964 . 0 0 "[ . 1 .]" 1
2626 2 149 ILE HA 2 152 VAL MG1 3.500 . 4.000 2.680 1.799 3.788 0.001 14 0 "[ . 1 .]" 1
2627 2 149 ILE MG 2 150 ARG HA 5.000 . 5.500 2.856 2.672 3.115 . 0 0 "[ . 1 .]" 1
2628 2 149 ILE MG 2 152 VAL MG1 5.000 . 6.000 3.676 3.241 4.239 . 0 0 "[ . 1 .]" 1
2629 2 149 ILE MG 2 153 VAL MG2 3.500 . 4.500 2.641 1.921 3.475 . 0 0 "[ . 1 .]" 1
2630 2 150 ARG H 2 151 LYS H 2.700 . 2.700 2.576 2.403 2.718 0.018 14 0 "[ . 1 .]" 1
2631 2 150 ARG H 2 152 VAL H 5.000 . 5.000 4.225 3.912 4.609 . 0 0 "[ . 1 .]" 1
2632 2 150 ARG HA 2 153 VAL H 3.500 . 3.500 3.484 3.304 3.567 0.067 8 0 "[ . 1 .]" 1
2633 2 150 ARG HA 2 154 ASP H 5.000 . 5.000 3.965 3.617 4.197 . 0 0 "[ . 1 .]" 1
2634 2 150 ARG HA 2 153 VAL MG1 5.000 . 5.500 3.546 2.230 4.283 . 0 0 "[ . 1 .]" 1
2635 2 150 ARG HA 2 153 VAL MG2 3.500 . 4.000 3.304 2.007 3.872 . 0 0 "[ . 1 .]" 1
2636 2 151 LYS H 2 152 VAL H 2.700 . 2.700 2.668 2.564 2.762 0.062 15 0 "[ . 1 .]" 1
2637 2 151 LYS HA 2 154 ASP H 3.500 . 3.500 3.522 3.414 3.600 0.100 8 0 "[ . 1 .]" 1
2638 2 151 LYS HA 2 154 ASP QB 3.500 . 3.800 2.791 2.379 3.290 . 0 0 "[ . 1 .]" 1
2639 2 151 LYS QE 2 152 VAL MG2 5.000 . 5.800 5.069 3.506 5.819 0.019 3 0 "[ . 1 .]" 1
2640 2 152 VAL H 2 153 VAL H 3.500 . 3.500 2.613 2.476 2.768 . 0 0 "[ . 1 .]" 1
2641 2 152 VAL H 2 154 ASP H 5.000 . 5.000 4.081 3.695 4.516 . 0 0 "[ . 1 .]" 1
2642 2 152 VAL HA 2 155 ARG H 3.500 . 3.500 3.271 3.065 3.442 . 0 0 "[ . 1 .]" 1
2643 2 152 VAL HA 2 155 ARG QB 3.500 . 3.800 2.314 1.825 3.385 . 0 0 "[ . 1 .]" 1
2644 2 152 VAL HA 2 155 ARG QD 3.500 . 3.800 2.791 1.817 3.781 . 0 0 "[ . 1 .]" 1
2645 2 152 VAL MG2 2 155 ARG QD 3.500 . 4.300 2.752 1.954 3.697 . 0 0 "[ . 1 .]" 1
2646 2 153 VAL H 2 154 ASP H 2.700 . 2.700 2.613 2.459 2.728 0.028 14 0 "[ . 1 .]" 1
2647 2 153 VAL HA 2 156 VAL H 3.500 . 3.500 3.486 3.245 3.581 0.081 6 0 "[ . 1 .]" 1
2648 2 153 VAL HA 2 157 ASN H 5.000 . 5.000 3.932 3.687 4.217 . 0 0 "[ . 1 .]" 1
2649 2 153 VAL HA 2 156 VAL HB 5.000 . 5.000 3.335 2.809 4.056 . 0 0 "[ . 1 .]" 1
2650 2 153 VAL HA 2 156 VAL MG2 3.500 . 4.000 3.495 2.889 4.066 0.066 8 0 "[ . 1 .]" 1
2651 2 154 ASP H 2 155 ARG H 2.700 . 2.700 2.422 2.251 2.609 . 0 0 "[ . 1 .]" 1
2652 2 154 ASP HA 2 157 ASN H 3.500 . 3.500 3.370 3.102 3.513 0.013 13 0 "[ . 1 .]" 1
2653 2 154 ASP HA 2 158 ASN H 5.000 . 5.000 2.864 2.129 3.286 . 0 0 "[ . 1 .]" 1
2654 2 154 ASP HA 2 157 ASN QB 3.500 . 3.800 3.202 2.607 3.846 0.046 4 0 "[ . 1 .]" 1
2655 2 155 ARG H 2 156 VAL H 2.700 . 2.700 2.440 2.333 2.616 . 0 0 "[ . 1 .]" 1
2656 2 155 ARG HA 2 158 ASN H 5.000 . 5.000 3.994 3.677 4.255 . 0 0 "[ . 1 .]" 1
2657 2 155 ARG QB 2 156 VAL MG2 5.000 . 5.800 3.136 2.458 3.720 . 0 0 "[ . 1 .]" 1
2658 2 155 ARG QD 2 156 VAL MG2 3.500 . 4.300 2.984 1.792 4.325 0.025 13 0 "[ . 1 .]" 1
2659 2 156 VAL H 2 157 ASN H 2.700 . 2.700 2.212 2.090 2.417 . 0 0 "[ . 1 .]" 1
2660 2 156 VAL MG1 2 157 ASN QB 3.500 . 4.300 4.240 3.863 4.405 0.105 15 0 "[ . 1 .]" 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 348
_Distance_constraint_stats_list.Viol_count 1822
_Distance_constraint_stats_list.Viol_total 1510.397
_Distance_constraint_stats_list.Viol_max 0.266
_Distance_constraint_stats_list.Viol_rms 0.0379
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0193
_Distance_constraint_stats_list.Viol_average_violations_only 0.0553
_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 5 ARG 0.063 0.033 11 0 "[ . 1 .]"
1 6 SER 0.239 0.127 8 0 "[ . 1 .]"
1 7 VAL 1.496 0.124 15 0 "[ . 1 .]"
1 8 PHE 0.311 0.077 6 0 "[ . 1 .]"
1 9 LEU 0.593 0.110 7 0 "[ . 1 .]"
1 12 PRO 0.179 0.049 4 0 "[ . 1 .]"
1 13 PHE 0.313 0.066 11 0 "[ . 1 .]"
1 16 LEU 0.179 0.049 4 0 "[ . 1 .]"
1 17 VAL 0.313 0.066 11 0 "[ . 1 .]"
1 18 ASN 2.566 0.168 10 0 "[ . 1 .]"
1 21 THR 2.566 0.168 10 0 "[ . 1 .]"
1 25 PRO 0.684 0.091 4 0 "[ . 1 .]"
1 26 SER 0.097 0.075 15 0 "[ . 1 .]"
1 28 GLU 1.746 0.129 14 0 "[ . 1 .]"
1 29 GLN 0.789 0.091 4 0 "[ . 1 .]"
1 30 LEU 0.545 0.107 10 0 "[ . 1 .]"
1 31 PRO 0.128 0.032 14 0 "[ . 1 .]"
1 32 PHE 2.725 0.150 14 0 "[ . 1 .]"
1 33 LEU 0.726 0.061 12 0 "[ . 1 .]"
1 34 THR 1.039 0.112 11 0 "[ . 1 .]"
1 35 LEU 0.467 0.104 1 0 "[ . 1 .]"
1 36 ILE 1.095 0.150 14 0 "[ . 1 .]"
1 37 GLU 1.066 0.105 10 0 "[ . 1 .]"
1 38 HIS 0.672 0.112 11 0 "[ . 1 .]"
1 39 PHE 0.370 0.104 1 0 "[ . 1 .]"
1 40 GLU 0.116 0.042 12 0 "[ . 1 .]"
1 41 LYS 0.444 0.105 10 0 "[ . 1 .]"
1 42 GLN 0.081 0.036 6 0 "[ . 1 .]"
1 43 GLY 0.031 0.013 6 0 "[ . 1 .]"
1 45 GLU 1.387 0.106 9 0 "[ . 1 .]"
1 47 PHE 0.458 0.124 15 0 "[ . 1 .]"
1 49 ALA 0.307 0.073 13 0 "[ . 1 .]"
1 50 HIS 0.125 0.043 11 0 "[ . 1 .]"
1 51 ARG 0.609 0.140 12 0 "[ . 1 .]"
1 52 ARG 0.420 0.088 9 0 "[ . 1 .]"
1 53 GLU 1.094 0.152 4 0 "[ . 1 .]"
1 54 ALA 0.125 0.043 11 0 "[ . 1 .]"
1 55 TRP 0.609 0.140 12 0 "[ . 1 .]"
1 56 GLY 0.420 0.088 9 0 "[ . 1 .]"
1 57 ALA 1.094 0.152 4 0 "[ . 1 .]"
1 61 THR 0.018 0.009 8 0 "[ . 1 .]"
1 62 PRO 1.455 0.171 9 0 "[ . 1 .]"
1 64 GLU 0.295 0.071 7 0 "[ . 1 .]"
1 65 CYS 0.266 0.074 2 0 "[ . 1 .]"
1 66 THR 1.617 0.171 9 0 "[ . 1 .]"
1 67 PRO 0.148 0.067 14 0 "[ . 1 .]"
1 68 LEU 0.508 0.071 7 0 "[ . 1 .]"
1 69 ASP 0.876 0.172 6 0 "[ . 1 .]"
1 70 GLN 1.564 0.145 6 0 "[ . 1 .]"
1 71 LEU 0.489 0.079 9 0 "[ . 1 .]"
1 72 GLU 0.357 0.062 6 0 "[ . 1 .]"
1 73 ILE 0.629 0.172 6 0 "[ . 1 .]"
1 74 ARG 1.402 0.145 6 0 "[ . 1 .]"
1 75 LYS 0.341 0.079 9 0 "[ . 1 .]"
1 76 ALA 0.143 0.046 12 0 "[ . 1 .]"
1 78 VAL 0.333 0.127 8 0 "[ . 1 .]"
1 79 PHE 1.510 0.106 14 0 "[ . 1 .]"
1 80 VAL 0.217 0.077 6 0 "[ . 1 .]"
1 81 ALA 0.640 0.130 10 0 "[ . 1 .]"
1 88 SER 0.458 0.157 14 0 "[ . 1 .]"
1 89 PRO 0.817 0.104 3 0 "[ . 1 .]"
1 90 GLY 0.415 0.092 13 0 "[ . 1 .]"
1 91 THR 1.128 0.159 13 0 "[ . 1 .]"
1 92 HIS 1.779 0.157 14 0 "[ . 1 .]"
1 93 VAL 1.578 0.139 13 0 "[ . 1 .]"
1 94 GLU 0.623 0.092 13 0 "[ . 1 .]"
1 95 ILE 2.380 0.159 13 0 "[ . 1 .]"
1 96 GLY 2.035 0.120 7 0 "[ . 1 .]"
1 97 TRP 1.494 0.144 1 0 "[ . 1 .]"
1 98 ALA 1.142 0.104 8 0 "[ . 1 .]"
1 99 SER 1.252 0.145 7 0 "[ . 1 .]"
1 100 ALA 0.715 0.100 14 0 "[ . 1 .]"
1 101 PHE 0.733 0.144 1 0 "[ . 1 .]"
1 102 ASP 0.934 0.104 8 0 "[ . 1 .]"
1 104 PRO 0.444 0.106 14 0 "[ . 1 .]"
1 105 ILE 0.614 0.082 14 0 "[ . 1 .]"
1 106 VAL 1.661 0.130 10 0 "[ . 1 .]"
1 107 LEU 0.239 0.056 11 0 "[ . 1 .]"
1 108 LEU 0.044 0.044 8 0 "[ . 1 .]"
1 109 LEU 5.217 0.226 2 0 "[ . 1 .]"
1 112 GLY 0.787 0.094 7 0 "[ . 1 .]"
1 113 ARG 0.111 0.068 14 0 "[ . 1 .]"
1 116 GLU 0.787 0.094 7 0 "[ . 1 .]"
1 117 TYR 0.111 0.068 14 0 "[ . 1 .]"
1 118 GLY 0.948 0.168 6 0 "[ . 1 .]"
1 119 PHE 3.790 0.266 15 0 "[ . 1 .]"
1 120 LEU 1.180 0.149 10 0 "[ . 1 .]"
1 121 VAL 0.764 0.106 10 0 "[ . 1 .]"
1 122 ARG 2.646 0.174 4 0 "[ . 1 .]"
1 123 GLY 4.487 0.266 15 0 "[ . 1 .]"
1 124 LEU 1.335 0.149 10 0 "[ . 1 .]"
1 125 GLY 0.764 0.106 10 0 "[ . 1 .]"
1 126 THR 1.697 0.174 4 0 "[ . 1 .]"
1 127 VAL 0.696 0.138 6 0 "[ . 1 .]"
1 128 ALA 0.155 0.074 15 0 "[ . 1 .]"
1 129 ALA 0.315 0.082 14 0 "[ . 1 .]"
1 131 GLU 0.523 0.056 11 0 "[ . 1 .]"
1 133 VAL 4.156 0.226 2 0 "[ . 1 .]"
1 135 TYR 1.076 0.151 11 0 "[ . 1 .]"
1 137 ASP 0.123 0.041 10 0 "[ . 1 .]"
1 138 ILE 0.307 0.077 13 0 "[ . 1 .]"
1 140 LEU 0.618 0.096 2 0 "[ . 1 .]"
1 141 ALA 0.710 0.120 1 0 "[ . 1 .]"
1 142 LYS 0.580 0.086 15 0 "[ . 1 .]"
1 143 PRO 0.138 0.057 13 0 "[ . 1 .]"
1 144 GLN 0.733 0.096 2 0 "[ . 1 .]"
1 145 ILE 0.762 0.120 1 0 "[ . 1 .]"
1 146 ASP 0.330 0.086 15 0 "[ . 1 .]"
1 147 ALA 0.286 0.057 13 0 "[ . 1 .]"
1 148 ALA 0.115 0.049 12 0 "[ . 1 .]"
1 149 ILE 0.419 0.084 8 0 "[ . 1 .]"
1 150 ARG 0.098 0.041 3 0 "[ . 1 .]"
1 151 LYS 0.311 0.056 8 0 "[ . 1 .]"
1 152 VAL 0.409 0.075 5 0 "[ . 1 .]"
1 153 VAL 0.486 0.084 8 0 "[ . 1 .]"
1 154 ASP 0.498 0.086 4 0 "[ . 1 .]"
1 155 ARG 0.163 0.034 9 0 "[ . 1 .]"
1 156 VAL 0.409 0.075 5 0 "[ . 1 .]"
1 157 ASN 0.242 0.060 5 0 "[ . 1 .]"
1 158 ASN 0.457 0.086 4 0 "[ . 1 .]"
2 5 ARG 0.086 0.043 2 0 "[ . 1 .]"
2 6 SER 0.285 0.121 8 0 "[ . 1 .]"
2 7 VAL 1.553 0.112 9 0 "[ . 1 .]"
2 8 PHE 0.126 0.032 6 0 "[ . 1 .]"
2 9 LEU 0.630 0.096 7 0 "[ . 1 .]"
2 12 PRO 0.249 0.048 10 0 "[ . 1 .]"
2 13 PHE 0.293 0.073 14 0 "[ . 1 .]"
2 16 LEU 0.249 0.048 10 0 "[ . 1 .]"
2 17 VAL 0.293 0.073 14 0 "[ . 1 .]"
2 18 ASN 2.652 0.185 10 0 "[ . 1 .]"
2 21 THR 2.652 0.185 10 0 "[ . 1 .]"
2 25 PRO 0.647 0.083 8 0 "[ . 1 .]"
2 26 SER 0.117 0.074 15 0 "[ . 1 .]"
2 28 GLU 1.777 0.135 11 0 "[ . 1 .]"
2 29 GLN 0.781 0.083 8 0 "[ . 1 .]"
2 30 LEU 0.555 0.111 12 0 "[ . 1 .]"
2 31 PRO 0.089 0.034 14 0 "[ . 1 .]"
2 32 PHE 2.963 0.167 14 0 "[ . 1 .]"
2 33 LEU 0.703 0.079 10 0 "[ . 1 .]"
2 34 THR 0.984 0.111 12 0 "[ . 1 .]"
2 35 LEU 0.445 0.095 5 0 "[ . 1 .]"
2 36 ILE 1.294 0.167 14 0 "[ . 1 .]"
2 37 GLU 0.990 0.106 1 0 "[ . 1 .]"
2 38 HIS 0.612 0.105 8 0 "[ . 1 .]"
2 39 PHE 0.497 0.095 5 0 "[ . 1 .]"
2 40 GLU 0.107 0.028 12 0 "[ . 1 .]"
2 41 LYS 0.422 0.106 1 0 "[ . 1 .]"
2 42 GLN 0.065 0.024 4 0 "[ . 1 .]"
2 43 GLY 0.141 0.044 7 0 "[ . 1 .]"
2 45 GLU 1.481 0.112 9 0 "[ . 1 .]"
2 47 PHE 0.481 0.107 15 0 "[ . 1 .]"
2 49 ALA 0.308 0.067 4 0 "[ . 1 .]"
2 50 HIS 0.190 0.085 14 0 "[ . 1 .]"
2 51 ARG 0.586 0.122 11 0 "[ . 1 .]"
2 52 ARG 0.390 0.071 14 0 "[ . 1 .]"
2 53 GLU 0.921 0.158 4 0 "[ . 1 .]"
2 54 ALA 0.190 0.085 14 0 "[ . 1 .]"
2 55 TRP 0.586 0.122 11 0 "[ . 1 .]"
2 56 GLY 0.390 0.071 14 0 "[ . 1 .]"
2 57 ALA 0.921 0.158 4 0 "[ . 1 .]"
2 61 THR 0.021 0.015 13 0 "[ . 1 .]"
2 62 PRO 1.686 0.191 9 0 "[ . 1 .]"
2 64 GLU 0.214 0.068 2 0 "[ . 1 .]"
2 65 CYS 0.253 0.089 2 0 "[ . 1 .]"
2 66 THR 1.835 0.191 9 0 "[ . 1 .]"
2 67 PRO 0.145 0.054 14 0 "[ . 1 .]"
2 68 LEU 0.392 0.068 2 0 "[ . 1 .]"
2 69 ASP 0.830 0.144 6 0 "[ . 1 .]"
2 70 GLN 1.363 0.154 6 0 "[ . 1 .]"
2 71 LEU 0.540 0.106 9 0 "[ . 1 .]"
2 72 GLU 0.316 0.057 14 0 "[ . 1 .]"
2 73 ILE 0.599 0.144 6 0 "[ . 1 .]"
2 74 ARG 1.214 0.154 6 0 "[ . 1 .]"
2 75 LYS 0.394 0.106 9 0 "[ . 1 .]"
2 76 ALA 0.138 0.057 14 0 "[ . 1 .]"
2 78 VAL 0.307 0.121 8 0 "[ . 1 .]"
2 79 PHE 1.396 0.094 1 0 "[ . 1 .]"
2 80 VAL 0.103 0.032 6 0 "[ . 1 .]"
2 81 ALA 0.665 0.117 10 0 "[ . 1 .]"
2 88 SER 0.467 0.151 14 0 "[ . 1 .]"
2 89 PRO 1.002 0.107 7 0 "[ . 1 .]"
2 90 GLY 0.449 0.106 13 0 "[ . 1 .]"
2 91 THR 0.961 0.145 13 0 "[ . 1 .]"
2 92 HIS 1.765 0.151 14 0 "[ . 1 .]"
2 93 VAL 1.720 0.114 6 0 "[ . 1 .]"
2 94 GLU 0.616 0.106 13 0 "[ . 1 .]"
2 95 ILE 2.164 0.145 13 0 "[ . 1 .]"
2 96 GLY 2.105 0.118 14 0 "[ . 1 .]"
2 97 TRP 1.401 0.144 1 0 "[ . 1 .]"
2 98 ALA 0.977 0.086 12 0 "[ . 1 .]"
2 99 SER 1.203 0.145 3 0 "[ . 1 .]"
2 100 ALA 0.807 0.118 14 0 "[ . 1 .]"
2 101 PHE 0.683 0.144 1 0 "[ . 1 .]"
2 102 ASP 0.810 0.086 12 0 "[ . 1 .]"
2 104 PRO 0.300 0.070 6 0 "[ . 1 .]"
2 105 ILE 0.728 0.082 14 0 "[ . 1 .]"
2 106 VAL 1.718 0.117 10 0 "[ . 1 .]"
2 107 LEU 0.227 0.057 11 0 "[ . 1 .]"
2 108 LEU 0.043 0.028 8 0 "[ . 1 .]"
2 109 LEU 5.203 0.229 15 0 "[ . 1 .]"
2 112 GLY 0.785 0.092 6 0 "[ . 1 .]"
2 113 ARG 0.109 0.062 14 0 "[ . 1 .]"
2 116 GLU 0.785 0.092 6 0 "[ . 1 .]"
2 117 TYR 0.109 0.062 14 0 "[ . 1 .]"
2 118 GLY 0.892 0.159 6 0 "[ . 1 .]"
2 119 PHE 3.829 0.265 15 0 "[ . 1 .]"
2 120 LEU 1.110 0.148 10 0 "[ . 1 .]"
2 121 VAL 0.633 0.106 10 0 "[ . 1 .]"
2 122 ARG 2.525 0.212 4 0 "[ . 1 .]"
2 123 GLY 4.564 0.265 15 0 "[ . 1 .]"
2 124 LEU 1.192 0.148 10 0 "[ . 1 .]"
2 125 GLY 0.633 0.106 10 0 "[ . 1 .]"
2 126 THR 1.633 0.212 4 0 "[ . 1 .]"
2 127 VAL 0.736 0.118 5 0 "[ . 1 .]"
2 128 ALA 0.082 0.045 15 0 "[ . 1 .]"
2 129 ALA 0.441 0.082 14 0 "[ . 1 .]"
2 131 GLU 0.498 0.059 1 0 "[ . 1 .]"
2 133 VAL 4.158 0.229 15 0 "[ . 1 .]"
2 135 TYR 1.061 0.134 11 0 "[ . 1 .]"
2 137 ASP 0.102 0.065 10 0 "[ . 1 .]"
2 138 ILE 0.227 0.056 7 0 "[ . 1 .]"
2 140 LEU 0.654 0.094 2 0 "[ . 1 .]"
2 141 ALA 0.663 0.135 1 0 "[ . 1 .]"
2 142 LYS 0.501 0.078 15 0 "[ . 1 .]"
2 143 PRO 0.176 0.058 13 0 "[ . 1 .]"
2 144 GLN 0.720 0.094 2 0 "[ . 1 .]"
2 145 ILE 0.779 0.135 1 0 "[ . 1 .]"
2 146 ASP 0.314 0.078 15 0 "[ . 1 .]"
2 147 ALA 0.282 0.063 8 0 "[ . 1 .]"
2 148 ALA 0.096 0.029 12 0 "[ . 1 .]"
2 149 ILE 0.431 0.075 8 0 "[ . 1 .]"
2 150 ARG 0.102 0.053 3 0 "[ . 1 .]"
2 151 LYS 0.260 0.063 8 0 "[ . 1 .]"
2 152 VAL 0.389 0.074 1 0 "[ . 1 .]"
2 153 VAL 0.433 0.075 8 0 "[ . 1 .]"
2 154 ASP 0.517 0.093 4 0 "[ . 1 .]"
2 155 ARG 0.155 0.059 13 0 "[ . 1 .]"
2 156 VAL 0.359 0.074 1 0 "[ . 1 .]"
2 157 ASN 0.220 0.061 5 0 "[ . 1 .]"
2 158 ASN 0.455 0.093 4 0 "[ . 1 .]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 5 ARG O 1 45 GLU H 1.900 . 2.100 1.996 1.769 2.133 0.033 11 0 "[ . 1 .]" 2
2 1 5 ARG O 1 45 GLU N 2.900 2.700 3.100 2.950 2.727 3.106 0.006 11 0 "[ . 1 .]" 2
3 1 6 SER O 1 78 VAL H 1.900 . 2.100 2.034 1.797 2.227 0.127 8 0 "[ . 1 .]" 2
4 1 6 SER O 1 78 VAL N 2.900 2.700 3.100 2.907 2.696 3.071 0.004 6 0 "[ . 1 .]" 2
5 1 7 VAL H 1 45 GLU O 1.900 . 2.100 2.143 2.025 2.206 0.106 9 0 "[ . 1 .]" 2
6 1 7 VAL N 1 45 GLU O 2.900 2.700 3.100 2.662 2.610 2.719 0.090 7 0 "[ . 1 .]" 2
7 1 7 VAL O 1 47 PHE H 1.900 . 2.100 1.959 1.799 2.224 0.124 15 0 "[ . 1 .]" 2
8 1 7 VAL O 1 47 PHE N 2.900 2.700 3.100 2.803 2.675 3.043 0.025 12 0 "[ . 1 .]" 2
9 1 8 PHE H 1 78 VAL O 1.900 . 2.100 1.881 1.692 2.133 0.033 10 0 "[ . 1 .]" 2
10 1 8 PHE N 1 78 VAL O 2.900 2.700 3.100 2.848 2.660 3.097 0.040 6 0 "[ . 1 .]" 2
11 1 8 PHE O 1 80 VAL H 1.900 . 2.100 2.039 1.886 2.177 0.077 6 0 "[ . 1 .]" 2
12 1 8 PHE O 1 80 VAL N 2.900 2.700 3.100 2.752 2.652 2.895 0.048 9 0 "[ . 1 .]" 2
13 1 9 LEU H 1 47 PHE O 1.900 . 2.100 2.040 1.778 2.210 0.110 7 0 "[ . 1 .]" 2
14 1 9 LEU N 1 47 PHE O 2.900 2.700 3.100 2.961 2.693 3.114 0.014 15 0 "[ . 1 .]" 2
15 1 9 LEU O 1 49 ALA H 1.900 . 2.100 2.054 1.785 2.158 0.058 7 0 "[ . 1 .]" 2
16 1 9 LEU O 1 49 ALA N 2.900 2.700 3.100 2.867 2.627 3.115 0.073 13 0 "[ . 1 .]" 2
17 1 12 PRO O 1 16 LEU H 1.900 . 2.100 2.041 1.912 2.149 0.049 4 0 "[ . 1 .]" 2
18 1 12 PRO O 1 16 LEU N 2.900 2.700 3.100 2.857 2.673 3.041 0.027 10 0 "[ . 1 .]" 2
19 1 13 PHE O 1 17 VAL H 1.900 . 2.100 2.085 1.933 2.166 0.066 11 0 "[ . 1 .]" 2
20 1 13 PHE O 1 17 VAL N 2.900 2.700 3.100 3.008 2.854 3.132 0.032 14 0 "[ . 1 .]" 2
21 1 18 ASN O 1 21 THR H 1.900 . 2.100 2.138 1.910 2.223 0.123 12 0 "[ . 1 .]" 2
22 1 18 ASN O 1 21 THR N 2.900 2.700 3.100 2.598 2.532 2.726 0.168 10 0 "[ . 1 .]" 2
23 1 25 PRO O 1 29 GLN H 1.900 . 2.100 2.136 2.044 2.191 0.091 4 0 "[ . 1 .]" 2
24 1 25 PRO O 1 29 GLN N 2.900 2.700 3.100 3.068 2.994 3.128 0.028 7 0 "[ . 1 .]" 2
25 1 26 SER O 1 30 LEU H 1.900 . 2.100 1.980 1.792 2.175 0.075 15 0 "[ . 1 .]" 2
26 1 26 SER O 1 30 LEU N 2.900 2.700 3.100 2.910 2.685 3.108 0.015 5 0 "[ . 1 .]" 2
27 1 28 GLU O 1 32 PHE H 1.900 . 2.100 2.185 2.114 2.229 0.129 14 0 "[ . 1 .]" 2
28 1 28 GLU O 1 32 PHE N 2.900 2.700 3.100 3.123 3.037 3.178 0.078 14 0 "[ . 1 .]" 2
29 1 29 GLN O 1 33 LEU H 1.900 . 2.100 1.998 1.737 2.135 0.035 1 0 "[ . 1 .]" 2
30 1 29 GLN O 1 33 LEU N 2.900 2.700 3.100 2.785 2.654 2.954 0.046 6 0 "[ . 1 .]" 2
31 1 30 LEU O 1 34 THR H 1.900 . 2.100 2.071 1.801 2.207 0.107 10 0 "[ . 1 .]" 2
32 1 30 LEU O 1 34 THR N 2.900 2.700 3.100 2.923 2.595 3.063 0.105 12 0 "[ . 1 .]" 2
33 1 31 PRO O 1 35 LEU H 1.900 . 2.100 2.047 1.871 2.132 0.032 14 0 "[ . 1 .]" 2
34 1 31 PRO O 1 35 LEU N 2.900 2.700 3.100 3.007 2.827 3.111 0.011 14 0 "[ . 1 .]" 2
35 1 32 PHE O 1 36 ILE H 1.900 . 2.100 1.774 1.644 1.881 0.056 14 0 "[ . 1 .]" 2
36 1 32 PHE O 1 36 ILE N 2.900 2.700 3.100 2.640 2.550 2.719 0.150 14 0 "[ . 1 .]" 2
37 1 33 LEU O 1 37 GLU H 1.900 . 2.100 2.086 1.952 2.155 0.055 12 0 "[ . 1 .]" 2
38 1 33 LEU O 1 37 GLU N 2.900 2.700 3.100 2.705 2.639 2.867 0.061 12 0 "[ . 1 .]" 2
39 1 34 THR O 1 38 HIS H 1.900 . 2.100 2.119 1.915 2.212 0.112 11 0 "[ . 1 .]" 2
40 1 34 THR O 1 38 HIS N 2.900 2.700 3.100 3.011 2.823 3.088 . 0 0 "[ . 1 .]" 2
41 1 35 LEU O 1 39 PHE H 1.900 . 2.100 2.053 1.914 2.204 0.104 1 0 "[ . 1 .]" 2
42 1 35 LEU O 1 39 PHE N 2.900 2.700 3.100 2.834 2.655 2.998 0.045 14 0 "[ . 1 .]" 2
43 1 36 ILE O 1 40 GLU H 1.900 . 2.100 2.015 1.689 2.142 0.042 12 0 "[ . 1 .]" 2
44 1 36 ILE O 1 40 GLU N 2.900 2.700 3.100 2.952 2.670 3.103 0.030 11 0 "[ . 1 .]" 2
45 1 37 GLU O 1 41 LYS H 1.900 . 2.100 2.011 1.838 2.128 0.028 4 0 "[ . 1 .]" 2
46 1 37 GLU O 1 41 LYS N 2.900 2.700 3.100 2.696 2.595 2.818 0.105 10 0 "[ . 1 .]" 2
47 1 38 HIS O 1 42 GLN H 1.900 . 2.100 1.969 1.811 2.112 0.012 4 0 "[ . 1 .]" 2
48 1 38 HIS O 1 42 GLN N 2.900 2.700 3.100 2.837 2.664 3.057 0.036 6 0 "[ . 1 .]" 2
49 1 39 PHE O 1 43 GLY H 1.900 . 2.100 2.032 1.862 2.113 0.013 6 0 "[ . 1 .]" 2
50 1 39 PHE O 1 43 GLY N 2.900 2.700 3.100 2.927 2.806 3.008 . 0 0 "[ . 1 .]" 2
51 1 50 HIS O 1 54 ALA H 1.900 . 2.100 1.926 1.745 2.099 . 0 0 "[ . 1 .]" 2
52 1 50 HIS O 1 54 ALA N 2.900 2.700 3.100 2.794 2.657 3.068 0.043 11 0 "[ . 1 .]" 2
53 1 51 ARG O 1 55 TRP H 1.900 . 2.100 2.086 1.874 2.240 0.140 12 0 "[ . 1 .]" 2
54 1 51 ARG O 1 55 TRP N 2.900 2.700 3.100 2.772 2.641 3.061 0.059 1 0 "[ . 1 .]" 2
55 1 52 ARG O 1 56 GLY H 1.900 . 2.100 2.041 1.705 2.188 0.088 9 0 "[ . 1 .]" 2
56 1 52 ARG O 1 56 GLY N 2.900 2.700 3.100 2.746 2.627 3.040 0.073 10 0 "[ . 1 .]" 2
57 1 53 GLU O 1 57 ALA H 1.900 . 2.100 2.006 1.764 2.166 0.066 6 0 "[ . 1 .]" 2
58 1 53 GLU O 1 57 ALA N 2.900 2.700 3.100 2.703 2.548 3.055 0.152 4 0 "[ . 1 .]" 2
59 1 61 THR O 1 65 CYS H 1.900 . 2.100 1.969 1.758 2.104 0.004 2 0 "[ . 1 .]" 2
60 1 61 THR O 1 65 CYS N 2.900 2.700 3.100 2.841 2.691 2.998 0.009 8 0 "[ . 1 .]" 2
61 1 62 PRO O 1 66 THR H 1.900 . 2.100 2.196 2.139 2.271 0.171 9 0 "[ . 1 .]" 2
62 1 62 PRO O 1 66 THR N 2.900 2.700 3.100 2.991 2.864 3.109 0.009 12 0 "[ . 1 .]" 2
63 1 64 GLU O 1 68 LEU H 1.900 . 2.100 2.086 1.949 2.171 0.071 7 0 "[ . 1 .]" 2
64 1 64 GLU O 1 68 LEU N 2.900 2.700 3.100 2.977 2.804 3.112 0.012 2 0 "[ . 1 .]" 2
65 1 65 CYS O 1 69 ASP H 1.900 . 2.100 2.039 1.816 2.174 0.074 2 0 "[ . 1 .]" 2
66 1 65 CYS O 1 69 ASP N 2.900 2.700 3.100 2.787 2.663 2.905 0.037 1 0 "[ . 1 .]" 2
67 1 66 THR O 1 70 GLN H 1.900 . 2.100 1.915 1.716 2.135 0.035 9 0 "[ . 1 .]" 2
68 1 66 THR O 1 70 GLN N 2.900 2.700 3.100 2.863 2.641 3.074 0.059 3 0 "[ . 1 .]" 2
69 1 67 PRO O 1 71 LEU H 1.900 . 2.100 1.978 1.667 2.121 0.033 14 0 "[ . 1 .]" 2
70 1 67 PRO O 1 71 LEU N 2.900 2.700 3.100 2.930 2.633 3.101 0.067 14 0 "[ . 1 .]" 2
71 1 68 LEU O 1 72 GLU H 1.900 . 2.100 1.915 1.732 2.089 . 0 0 "[ . 1 .]" 2
72 1 68 LEU O 1 72 GLU N 2.900 2.700 3.100 2.763 2.638 2.970 0.062 6 0 "[ . 1 .]" 2
73 1 69 ASP O 1 73 ILE H 1.900 . 2.100 2.062 1.944 2.190 0.090 7 0 "[ . 1 .]" 2
74 1 69 ASP O 1 73 ILE N 2.900 2.700 3.100 2.738 2.528 2.931 0.172 6 0 "[ . 1 .]" 2
75 1 70 GLN O 1 74 ARG H 1.900 . 2.100 2.162 1.995 2.245 0.145 6 0 "[ . 1 .]" 2
76 1 70 GLN O 1 74 ARG N 2.900 2.700 3.100 3.078 2.815 3.194 0.094 15 0 "[ . 1 .]" 2
77 1 71 LEU O 1 75 LYS H 1.900 . 2.100 2.000 1.819 2.154 0.054 7 0 "[ . 1 .]" 2
78 1 71 LEU O 1 75 LYS N 2.900 2.700 3.100 2.749 2.621 2.926 0.079 9 0 "[ . 1 .]" 2
79 1 72 GLU O 1 76 ALA H 1.900 . 2.100 1.995 1.792 2.131 0.031 13 0 "[ . 1 .]" 2
80 1 72 GLU O 1 76 ALA N 2.900 2.700 3.100 2.794 2.654 2.989 0.046 12 0 "[ . 1 .]" 2
81 1 79 PHE H 1 104 PRO O 1.900 . 2.100 2.123 2.044 2.206 0.106 14 0 "[ . 1 .]" 2
82 1 79 PHE N 1 104 PRO O 2.900 2.700 3.100 2.865 2.745 2.977 . 0 0 "[ . 1 .]" 2
83 1 79 PHE O 1 106 VAL H 1.900 . 2.100 2.105 1.961 2.192 0.092 14 0 "[ . 1 .]" 2
84 1 79 PHE O 1 106 VAL N 2.900 2.700 3.100 2.663 2.612 2.802 0.088 7 0 "[ . 1 .]" 2
85 1 81 ALA H 1 106 VAL O 1.900 . 2.100 2.134 2.043 2.230 0.130 10 0 "[ . 1 .]" 2
86 1 81 ALA N 1 106 VAL O 2.900 2.700 3.100 2.970 2.843 3.096 . 0 0 "[ . 1 .]" 2
87 1 81 ALA O 1 108 LEU H 1.900 . 2.100 1.953 1.763 2.096 . 0 0 "[ . 1 .]" 2
88 1 81 ALA O 1 108 LEU N 2.900 2.700 3.100 2.834 2.656 3.002 0.044 8 0 "[ . 1 .]" 2
89 1 88 SER O 1 92 HIS H 1.900 . 2.100 2.015 1.792 2.210 0.110 13 0 "[ . 1 .]" 2
90 1 88 SER O 1 92 HIS N 2.900 2.700 3.100 2.797 2.543 3.038 0.157 14 0 "[ . 1 .]" 2
91 1 89 PRO O 1 93 VAL H 1.900 . 2.100 2.141 1.951 2.204 0.104 3 0 "[ . 1 .]" 2
92 1 89 PRO O 1 93 VAL N 2.900 2.700 3.100 3.042 2.745 3.137 0.037 14 0 "[ . 1 .]" 2
93 1 90 GLY O 1 94 GLU H 1.900 . 2.100 2.114 2.016 2.192 0.092 13 0 "[ . 1 .]" 2
94 1 90 GLY O 1 94 GLU N 2.900 2.700 3.100 2.950 2.734 3.113 0.013 9 0 "[ . 1 .]" 2
95 1 91 THR O 1 95 ILE H 1.900 . 2.100 1.770 1.650 1.877 0.050 13 0 "[ . 1 .]" 2
96 1 91 THR O 1 95 ILE N 2.900 2.700 3.100 2.634 2.541 2.736 0.159 13 0 "[ . 1 .]" 2
97 1 92 HIS O 1 96 GLY H 1.900 . 2.100 1.707 1.653 1.810 0.047 7 0 "[ . 1 .]" 2
98 1 92 HIS O 1 96 GLY N 2.900 2.700 3.100 2.625 2.580 2.683 0.120 7 0 "[ . 1 .]" 2
99 1 93 VAL O 1 97 TRP H 1.900 . 2.100 1.913 1.731 2.119 0.019 9 0 "[ . 1 .]" 2
100 1 93 VAL O 1 97 TRP N 2.900 2.700 3.100 2.693 2.561 2.991 0.139 13 0 "[ . 1 .]" 2
101 1 94 GLU O 1 98 ALA H 1.900 . 2.100 2.069 1.957 2.168 0.068 7 0 "[ . 1 .]" 2
102 1 94 GLU O 1 98 ALA N 2.900 2.700 3.100 2.937 2.768 3.034 . 0 0 "[ . 1 .]" 2
103 1 95 ILE O 1 99 SER H 1.900 . 2.100 2.183 2.100 2.245 0.145 7 0 "[ . 1 .]" 2
104 1 95 ILE O 1 99 SER N 2.900 2.700 3.100 2.931 2.795 3.081 . 0 0 "[ . 1 .]" 2
105 1 96 GLY O 1 100 ALA H 1.900 . 2.100 1.958 1.724 2.200 0.100 14 0 "[ . 1 .]" 2
106 1 96 GLY O 1 100 ALA N 2.900 2.700 3.100 2.888 2.637 3.126 0.063 8 0 "[ . 1 .]" 2
107 1 97 TRP O 1 101 PHE H 1.900 . 2.100 1.917 1.643 2.127 0.057 1 0 "[ . 1 .]" 2
108 1 97 TRP O 1 101 PHE N 2.900 2.700 3.100 2.700 2.556 2.925 0.144 1 0 "[ . 1 .]" 2
109 1 98 ALA O 1 102 ASP H 1.900 . 2.100 2.044 1.744 2.177 0.077 7 0 "[ . 1 .]" 2
110 1 98 ALA O 1 102 ASP N 2.900 2.700 3.100 2.724 2.596 2.915 0.104 8 0 "[ . 1 .]" 2
111 1 105 ILE H 1 129 ALA O 1.900 . 2.100 2.027 1.852 2.182 0.082 14 0 "[ . 1 .]" 2
112 1 105 ILE N 1 129 ALA O 2.900 2.700 3.100 2.836 2.652 3.043 0.048 12 0 "[ . 1 .]" 2
113 1 105 ILE O 1 131 GLU H 1.900 . 2.100 2.068 1.814 2.152 0.052 1 0 "[ . 1 .]" 2
114 1 105 ILE O 1 131 GLU N 2.900 2.700 3.100 3.026 2.785 3.122 0.022 12 0 "[ . 1 .]" 2
115 1 107 LEU H 1 131 GLU O 1.900 . 2.100 1.992 1.757 2.156 0.056 11 0 "[ . 1 .]" 2
116 1 107 LEU N 1 131 GLU O 2.900 2.700 3.100 2.904 2.681 3.098 0.019 8 0 "[ . 1 .]" 2
117 1 107 LEU O 1 133 VAL H 1.900 . 2.100 1.921 1.732 2.048 . 0 0 "[ . 1 .]" 2
118 1 107 LEU O 1 133 VAL N 2.900 2.700 3.100 2.836 2.684 2.972 0.016 6 0 "[ . 1 .]" 2
119 1 109 LEU H 1 133 VAL O 1.900 . 2.100 2.234 2.165 2.326 0.226 2 0 "[ . 1 .]" 2
120 1 109 LEU N 1 133 VAL O 2.900 2.700 3.100 2.558 2.480 2.645 0.220 15 0 "[ . 1 .]" 2
121 1 109 LEU O 1 135 TYR H 1.900 . 2.100 2.127 1.901 2.211 0.111 3 0 "[ . 1 .]" 2
122 1 109 LEU O 1 135 TYR N 2.900 2.700 3.100 2.884 2.549 3.092 0.151 11 0 "[ . 1 .]" 2
123 1 112 GLY O 1 116 GLU H 1.900 . 2.100 2.152 2.107 2.194 0.094 7 0 "[ . 1 .]" 2
124 1 112 GLY O 1 116 GLU N 2.900 2.700 3.100 3.022 2.863 3.101 0.001 6 0 "[ . 1 .]" 2
125 1 113 ARG O 1 117 TYR H 1.900 . 2.100 1.844 1.686 2.053 0.014 14 0 "[ . 1 .]" 2
126 1 113 ARG O 1 117 TYR N 2.900 2.700 3.100 2.738 2.632 2.908 0.068 14 0 "[ . 1 .]" 2
127 1 118 GLY O 1 122 ARG H 1.900 . 2.100 1.879 1.719 2.037 . 0 0 "[ . 1 .]" 2
128 1 118 GLY O 1 122 ARG N 2.900 2.700 3.100 2.643 2.532 2.758 0.168 6 0 "[ . 1 .]" 2
129 1 119 PHE O 1 123 GLY H 1.900 . 2.100 2.323 2.298 2.366 0.266 15 0 "[ . 1 .]" 2
130 1 119 PHE O 1 123 GLY N 2.900 2.700 3.100 3.128 3.070 3.168 0.068 14 0 "[ . 1 .]" 2
131 1 120 LEU O 1 124 LEU H 1.900 . 2.100 1.927 1.758 2.139 0.039 3 0 "[ . 1 .]" 2
132 1 120 LEU O 1 124 LEU N 2.900 2.700 3.100 2.643 2.551 2.936 0.149 10 0 "[ . 1 .]" 2
133 1 121 VAL O 1 125 GLY H 1.900 . 2.100 2.130 1.940 2.206 0.106 10 0 "[ . 1 .]" 2
134 1 121 VAL O 1 125 GLY N 2.900 2.700 3.100 3.011 2.844 3.120 0.020 10 0 "[ . 1 .]" 2
135 1 122 ARG O 1 126 THR H 1.900 . 2.100 2.213 2.154 2.274 0.174 4 0 "[ . 1 .]" 2
136 1 122 ARG O 1 126 THR N 2.900 2.700 3.100 3.023 2.831 3.096 . 0 0 "[ . 1 .]" 2
137 1 123 GLY O 1 127 VAL H 1.900 . 2.100 2.131 1.944 2.238 0.138 6 0 "[ . 1 .]" 2
138 1 123 GLY O 1 127 VAL N 2.900 2.700 3.100 2.966 2.693 3.094 0.007 10 0 "[ . 1 .]" 2
139 1 124 LEU O 1 128 ALA H 1.900 . 2.100 1.967 1.657 2.107 0.043 15 0 "[ . 1 .]" 2
140 1 124 LEU O 1 128 ALA N 2.900 2.700 3.100 2.777 2.626 2.903 0.074 15 0 "[ . 1 .]" 2
141 1 137 ASP O 1 141 ALA H 1.900 . 2.100 2.024 1.884 2.141 0.041 10 0 "[ . 1 .]" 2
142 1 137 ASP O 1 141 ALA N 2.900 2.700 3.100 2.852 2.685 3.033 0.015 2 0 "[ . 1 .]" 2
143 1 138 ILE O 1 142 LYS H 1.900 . 2.100 2.030 1.797 2.177 0.077 13 0 "[ . 1 .]" 2
144 1 138 ILE O 1 142 LYS N 2.900 2.700 3.100 2.919 2.686 3.065 0.014 14 0 "[ . 1 .]" 2
145 1 140 LEU O 1 144 GLN H 1.900 . 2.100 2.121 2.034 2.196 0.096 2 0 "[ . 1 .]" 2
146 1 140 LEU O 1 144 GLN N 2.900 2.700 3.100 3.038 2.888 3.151 0.051 2 0 "[ . 1 .]" 2
147 1 141 ALA O 1 145 ILE H 1.900 . 2.100 1.833 1.653 1.984 0.047 6 0 "[ . 1 .]" 2
148 1 141 ALA O 1 145 ILE N 2.900 2.700 3.100 2.704 2.580 2.830 0.120 1 0 "[ . 1 .]" 2
149 1 142 LYS O 1 146 ASP H 1.900 . 2.100 2.066 1.936 2.186 0.086 15 0 "[ . 1 .]" 2
150 1 142 LYS O 1 146 ASP N 2.900 2.700 3.100 2.883 2.747 3.023 . 0 0 "[ . 1 .]" 2
151 1 143 PRO O 1 147 ALA H 1.900 . 2.100 1.996 1.763 2.157 0.057 13 0 "[ . 1 .]" 2
152 1 143 PRO O 1 147 ALA N 2.900 2.700 3.100 2.903 2.690 3.115 0.015 13 0 "[ . 1 .]" 2
153 1 144 GLN O 1 148 ALA H 1.900 . 2.100 2.016 1.774 2.149 0.049 12 0 "[ . 1 .]" 2
154 1 144 GLN O 1 148 ALA N 2.900 2.700 3.100 2.956 2.702 3.082 . 0 0 "[ . 1 .]" 2
155 1 145 ILE O 1 149 ILE H 1.900 . 2.100 2.055 1.868 2.142 0.042 9 0 "[ . 1 .]" 2
156 1 145 ILE O 1 149 ILE N 2.900 2.700 3.100 2.766 2.639 2.871 0.061 1 0 "[ . 1 .]" 2
157 1 146 ASP O 1 150 ARG H 1.900 . 2.100 2.006 1.825 2.136 0.036 14 0 "[ . 1 .]" 2
158 1 146 ASP O 1 150 ARG N 2.900 2.700 3.100 2.923 2.799 3.055 . 0 0 "[ . 1 .]" 2
159 1 147 ALA O 1 151 LYS H 1.900 . 2.100 2.009 1.790 2.156 0.056 8 0 "[ . 1 .]" 2
160 1 147 ALA O 1 151 LYS N 2.900 2.700 3.100 2.919 2.668 3.090 0.032 1 0 "[ . 1 .]" 2
161 1 148 ALA O 1 152 VAL H 1.900 . 2.100 1.974 1.837 2.098 . 0 0 "[ . 1 .]" 2
162 1 148 ALA O 1 152 VAL N 2.900 2.700 3.100 2.895 2.773 3.058 . 0 0 "[ . 1 .]" 2
163 1 149 ILE O 1 153 VAL H 1.900 . 2.100 2.035 1.858 2.153 0.053 14 0 "[ . 1 .]" 2
164 1 149 ILE O 1 153 VAL N 2.900 2.700 3.100 2.917 2.616 3.085 0.084 8 0 "[ . 1 .]" 2
165 1 150 ARG O 1 154 ASP H 1.900 . 2.100 2.011 1.807 2.088 . 0 0 "[ . 1 .]" 2
166 1 150 ARG O 1 154 ASP N 2.900 2.700 3.100 2.881 2.659 3.062 0.041 3 0 "[ . 1 .]" 2
167 1 151 LYS O 1 155 ARG H 1.900 . 2.100 2.060 1.828 2.134 0.034 9 0 "[ . 1 .]" 2
168 1 151 LYS O 1 155 ARG N 2.900 2.700 3.100 2.797 2.693 2.969 0.007 15 0 "[ . 1 .]" 2
169 1 152 VAL O 1 156 VAL H 1.900 . 2.100 2.097 1.861 2.175 0.075 5 0 "[ . 1 .]" 2
170 1 152 VAL O 1 156 VAL N 2.900 2.700 3.100 2.897 2.709 3.060 . 0 0 "[ . 1 .]" 2
171 1 153 VAL O 1 157 ASN H 1.900 . 2.100 2.006 1.759 2.143 0.043 10 0 "[ . 1 .]" 2
172 1 153 VAL O 1 157 ASN N 2.900 2.700 3.100 2.763 2.640 3.015 0.060 5 0 "[ . 1 .]" 2
173 1 154 ASP O 1 158 ASN H 1.900 . 2.100 2.060 1.857 2.171 0.071 6 0 "[ . 1 .]" 2
174 1 154 ASP O 1 158 ASN N 2.900 2.700 3.100 2.725 2.614 2.880 0.086 4 0 "[ . 1 .]" 2
175 2 5 ARG O 2 45 GLU H 1.900 . 2.100 2.005 1.782 2.143 0.043 2 0 "[ . 1 .]" 2
176 2 5 ARG O 2 45 GLU N 2.900 2.700 3.100 2.958 2.734 3.096 . 0 0 "[ . 1 .]" 2
177 2 6 SER O 2 78 VAL H 1.900 . 2.100 2.039 1.832 2.221 0.121 8 0 "[ . 1 .]" 2
178 2 6 SER O 2 78 VAL N 2.900 2.700 3.100 2.910 2.714 3.067 . 0 0 "[ . 1 .]" 2
179 2 7 VAL H 2 45 GLU O 1.900 . 2.100 2.157 2.082 2.212 0.112 9 0 "[ . 1 .]" 2
180 2 7 VAL N 2 45 GLU O 2.900 2.700 3.100 2.672 2.602 2.750 0.098 9 0 "[ . 1 .]" 2
181 2 7 VAL O 2 47 PHE H 1.900 . 2.100 1.950 1.806 2.207 0.107 15 0 "[ . 1 .]" 2
182 2 7 VAL O 2 47 PHE N 2.900 2.700 3.100 2.801 2.649 3.018 0.051 12 0 "[ . 1 .]" 2
183 2 8 PHE H 2 78 VAL O 1.900 . 2.100 1.884 1.724 2.105 0.005 15 0 "[ . 1 .]" 2
184 2 8 PHE N 2 78 VAL O 2.900 2.700 3.100 2.851 2.687 3.081 0.013 14 0 "[ . 1 .]" 2
185 2 8 PHE O 2 80 VAL H 1.900 . 2.100 2.042 1.878 2.132 0.032 6 0 "[ . 1 .]" 2
186 2 8 PHE O 2 80 VAL N 2.900 2.700 3.100 2.756 2.675 2.867 0.025 9 0 "[ . 1 .]" 2
187 2 9 LEU H 2 47 PHE O 1.900 . 2.100 2.041 1.795 2.196 0.096 7 0 "[ . 1 .]" 2
188 2 9 LEU N 2 47 PHE O 2.900 2.700 3.100 2.964 2.727 3.122 0.022 11 0 "[ . 1 .]" 2
189 2 9 LEU O 2 49 ALA H 1.900 . 2.100 2.051 1.765 2.167 0.067 4 0 "[ . 1 .]" 2
190 2 9 LEU O 2 49 ALA N 2.900 2.700 3.100 2.863 2.666 3.071 0.034 13 0 "[ . 1 .]" 2
191 2 12 PRO O 2 16 LEU H 1.900 . 2.100 2.051 1.907 2.142 0.042 4 0 "[ . 1 .]" 2
192 2 12 PRO O 2 16 LEU N 2.900 2.700 3.100 2.859 2.652 3.018 0.048 10 0 "[ . 1 .]" 2
193 2 13 PHE O 2 17 VAL H 1.900 . 2.100 2.077 1.895 2.173 0.073 14 0 "[ . 1 .]" 2
194 2 13 PHE O 2 17 VAL N 2.900 2.700 3.100 3.004 2.830 3.149 0.049 14 0 "[ . 1 .]" 2
195 2 18 ASN O 2 21 THR H 1.900 . 2.100 2.123 1.867 2.280 0.180 11 0 "[ . 1 .]" 2
196 2 18 ASN O 2 21 THR N 2.900 2.700 3.100 2.590 2.515 2.691 0.185 10 0 "[ . 1 .]" 2
197 2 25 PRO O 2 29 GLN H 1.900 . 2.100 2.133 2.033 2.183 0.083 8 0 "[ . 1 .]" 2
198 2 25 PRO O 2 29 GLN N 2.900 2.700 3.100 3.066 2.981 3.126 0.026 9 0 "[ . 1 .]" 2
199 2 26 SER O 2 30 LEU H 1.900 . 2.100 1.977 1.749 2.174 0.074 15 0 "[ . 1 .]" 2
200 2 26 SER O 2 30 LEU N 2.900 2.700 3.100 2.908 2.659 3.101 0.041 5 0 "[ . 1 .]" 2
201 2 28 GLU O 2 32 PHE H 1.900 . 2.100 2.184 2.099 2.235 0.135 11 0 "[ . 1 .]" 2
202 2 28 GLU O 2 32 PHE N 2.900 2.700 3.100 3.125 3.031 3.180 0.080 6 0 "[ . 1 .]" 2
203 2 29 GLN O 2 33 LEU H 1.900 . 2.100 1.992 1.763 2.133 0.033 9 0 "[ . 1 .]" 2
204 2 29 GLN O 2 33 LEU N 2.900 2.700 3.100 2.785 2.631 2.954 0.069 6 0 "[ . 1 .]" 2
205 2 30 LEU O 2 34 THR H 1.900 . 2.100 2.059 1.786 2.187 0.087 10 0 "[ . 1 .]" 2
206 2 30 LEU O 2 34 THR N 2.900 2.700 3.100 2.912 2.589 3.069 0.111 12 0 "[ . 1 .]" 2
207 2 31 PRO O 2 35 LEU H 1.900 . 2.100 2.035 1.867 2.134 0.034 14 0 "[ . 1 .]" 2
208 2 31 PRO O 2 35 LEU N 2.900 2.700 3.100 2.994 2.822 3.110 0.010 14 0 "[ . 1 .]" 2
209 2 32 PHE O 2 36 ILE H 1.900 . 2.100 1.762 1.634 1.870 0.066 14 0 "[ . 1 .]" 2
210 2 32 PHE O 2 36 ILE N 2.900 2.700 3.100 2.627 2.533 2.724 0.167 14 0 "[ . 1 .]" 2
211 2 33 LEU O 2 37 GLU H 1.900 . 2.100 2.078 1.921 2.144 0.044 5 0 "[ . 1 .]" 2
212 2 33 LEU O 2 37 GLU N 2.900 2.700 3.100 2.699 2.621 2.855 0.079 10 0 "[ . 1 .]" 2
213 2 34 THR O 2 38 HIS H 1.900 . 2.100 2.112 1.897 2.205 0.105 8 0 "[ . 1 .]" 2
214 2 34 THR O 2 38 HIS N 2.900 2.700 3.100 3.003 2.811 3.099 . 0 0 "[ . 1 .]" 2
215 2 35 LEU O 2 39 PHE H 1.900 . 2.100 2.047 1.912 2.195 0.095 5 0 "[ . 1 .]" 2
216 2 35 LEU O 2 39 PHE N 2.900 2.700 3.100 2.829 2.665 3.014 0.035 4 0 "[ . 1 .]" 2
217 2 36 ILE O 2 40 GLU H 1.900 . 2.100 2.012 1.695 2.128 0.028 12 0 "[ . 1 .]" 2
218 2 36 ILE O 2 40 GLU N 2.900 2.700 3.100 2.950 2.677 3.094 0.023 11 0 "[ . 1 .]" 2
219 2 37 GLU O 2 41 LYS H 1.900 . 2.100 2.005 1.852 2.119 0.019 4 0 "[ . 1 .]" 2
220 2 37 GLU O 2 41 LYS N 2.900 2.700 3.100 2.692 2.594 2.798 0.106 1 0 "[ . 1 .]" 2
221 2 38 HIS O 2 42 GLN H 1.900 . 2.100 1.962 1.828 2.124 0.024 4 0 "[ . 1 .]" 2
222 2 38 HIS O 2 42 GLN N 2.900 2.700 3.100 2.835 2.679 3.069 0.021 2 0 "[ . 1 .]" 2
223 2 39 PHE O 2 43 GLY H 1.900 . 2.100 2.034 1.877 2.144 0.044 7 0 "[ . 1 .]" 2
224 2 39 PHE O 2 43 GLY N 2.900 2.700 3.100 2.931 2.788 3.052 . 0 0 "[ . 1 .]" 2
225 2 50 HIS O 2 54 ALA H 1.900 . 2.100 1.913 1.746 2.062 . 0 0 "[ . 1 .]" 2
226 2 50 HIS O 2 54 ALA N 2.900 2.700 3.100 2.783 2.615 3.018 0.085 14 0 "[ . 1 .]" 2
227 2 51 ARG O 2 55 TRP H 1.900 . 2.100 2.074 1.863 2.222 0.122 11 0 "[ . 1 .]" 2
228 2 51 ARG O 2 55 TRP N 2.900 2.700 3.100 2.758 2.604 3.011 0.096 1 0 "[ . 1 .]" 2
229 2 52 ARG O 2 56 GLY H 1.900 . 2.100 2.031 1.723 2.150 0.050 14 0 "[ . 1 .]" 2
230 2 52 ARG O 2 56 GLY N 2.900 2.700 3.100 2.740 2.629 3.019 0.071 14 0 "[ . 1 .]" 2
231 2 53 GLU O 2 57 ALA H 1.900 . 2.100 2.014 1.782 2.139 0.039 4 0 "[ . 1 .]" 2
232 2 53 GLU O 2 57 ALA N 2.900 2.700 3.100 2.705 2.542 3.030 0.158 4 0 "[ . 1 .]" 2
233 2 61 THR O 2 65 CYS H 1.900 . 2.100 1.968 1.762 2.115 0.015 13 0 "[ . 1 .]" 2
234 2 61 THR O 2 65 CYS N 2.900 2.700 3.100 2.844 2.694 3.027 0.006 8 0 "[ . 1 .]" 2
235 2 62 PRO O 2 66 THR H 1.900 . 2.100 2.209 2.149 2.291 0.191 9 0 "[ . 1 .]" 2
236 2 62 PRO O 2 66 THR N 2.900 2.700 3.100 3.004 2.870 3.128 0.028 12 0 "[ . 1 .]" 2
237 2 64 GLU O 2 68 LEU H 1.900 . 2.100 2.078 2.006 2.168 0.068 2 0 "[ . 1 .]" 2
238 2 64 GLU O 2 68 LEU N 2.900 2.700 3.100 2.970 2.830 3.112 0.012 2 0 "[ . 1 .]" 2
239 2 65 CYS O 2 69 ASP H 1.900 . 2.100 2.044 1.858 2.189 0.089 2 0 "[ . 1 .]" 2
240 2 65 CYS O 2 69 ASP N 2.900 2.700 3.100 2.786 2.644 2.924 0.056 6 0 "[ . 1 .]" 2
241 2 66 THR O 2 70 GLN H 1.900 . 2.100 1.920 1.716 2.141 0.041 9 0 "[ . 1 .]" 2
242 2 66 THR O 2 70 GLN N 2.900 2.700 3.100 2.866 2.646 3.076 0.054 3 0 "[ . 1 .]" 2
243 2 67 PRO O 2 71 LEU H 1.900 . 2.100 1.982 1.678 2.127 0.027 9 0 "[ . 1 .]" 2
244 2 67 PRO O 2 71 LEU N 2.900 2.700 3.100 2.933 2.646 3.111 0.054 14 0 "[ . 1 .]" 2
245 2 68 LEU O 2 72 GLU H 1.900 . 2.100 1.928 1.729 2.121 0.021 4 0 "[ . 1 .]" 2
246 2 68 LEU O 2 72 GLU N 2.900 2.700 3.100 2.779 2.653 2.996 0.047 1 0 "[ . 1 .]" 2
247 2 69 ASP O 2 73 ILE H 1.900 . 2.100 2.065 1.937 2.209 0.109 7 0 "[ . 1 .]" 2
248 2 69 ASP O 2 73 ILE N 2.900 2.700 3.100 2.740 2.556 2.934 0.144 6 0 "[ . 1 .]" 2
249 2 70 GLN O 2 74 ARG H 1.900 . 2.100 2.157 2.009 2.254 0.154 6 0 "[ . 1 .]" 2
250 2 70 GLN O 2 74 ARG N 2.900 2.700 3.100 3.070 2.850 3.166 0.066 8 0 "[ . 1 .]" 2
251 2 71 LEU O 2 75 LYS H 1.900 . 2.100 1.986 1.826 2.154 0.054 7 0 "[ . 1 .]" 2
252 2 71 LEU O 2 75 LYS N 2.900 2.700 3.100 2.740 2.594 2.905 0.106 9 0 "[ . 1 .]" 2
253 2 72 GLU O 2 76 ALA H 1.900 . 2.100 1.999 1.738 2.120 0.020 4 0 "[ . 1 .]" 2
254 2 72 GLU O 2 76 ALA N 2.900 2.700 3.100 2.791 2.643 2.983 0.057 14 0 "[ . 1 .]" 2
255 2 79 PHE H 2 104 PRO O 1.900 . 2.100 2.101 2.022 2.170 0.070 6 0 "[ . 1 .]" 2
256 2 79 PHE N 2 104 PRO O 2.900 2.700 3.100 2.848 2.737 2.974 . 0 0 "[ . 1 .]" 2
257 2 79 PHE O 2 106 VAL H 1.900 . 2.100 2.093 1.966 2.169 0.069 14 0 "[ . 1 .]" 2
258 2 79 PHE O 2 106 VAL N 2.900 2.700 3.100 2.655 2.606 2.795 0.094 1 0 "[ . 1 .]" 2
259 2 81 ALA H 2 106 VAL O 1.900 . 2.100 2.133 2.051 2.217 0.117 10 0 "[ . 1 .]" 2
260 2 81 ALA N 2 106 VAL O 2.900 2.700 3.100 2.968 2.793 3.074 . 0 0 "[ . 1 .]" 2
261 2 81 ALA O 2 108 LEU H 1.900 . 2.100 1.960 1.772 2.108 0.008 14 0 "[ . 1 .]" 2
262 2 81 ALA O 2 108 LEU N 2.900 2.700 3.100 2.838 2.672 2.972 0.028 8 0 "[ . 1 .]" 2
263 2 88 SER O 2 92 HIS H 1.900 . 2.100 2.024 1.792 2.189 0.089 13 0 "[ . 1 .]" 2
264 2 88 SER O 2 92 HIS N 2.900 2.700 3.100 2.803 2.549 3.023 0.151 14 0 "[ . 1 .]" 2
265 2 89 PRO O 2 93 VAL H 1.900 . 2.100 2.144 1.903 2.207 0.107 7 0 "[ . 1 .]" 2
266 2 89 PRO O 2 93 VAL N 2.900 2.700 3.100 3.047 2.710 3.153 0.053 14 0 "[ . 1 .]" 2
267 2 90 GLY O 2 94 GLU H 1.900 . 2.100 2.120 2.043 2.206 0.106 13 0 "[ . 1 .]" 2
268 2 90 GLY O 2 94 GLU N 2.900 2.700 3.100 2.958 2.746 3.122 0.022 9 0 "[ . 1 .]" 2
269 2 91 THR O 2 95 ILE H 1.900 . 2.100 1.779 1.659 1.868 0.041 13 0 "[ . 1 .]" 2
270 2 91 THR O 2 95 ILE N 2.900 2.700 3.100 2.642 2.555 2.727 0.145 13 0 "[ . 1 .]" 2
271 2 92 HIS O 2 96 GLY H 1.900 . 2.100 1.708 1.656 1.789 0.044 7 0 "[ . 1 .]" 2
272 2 92 HIS O 2 96 GLY N 2.900 2.700 3.100 2.625 2.585 2.693 0.115 7 0 "[ . 1 .]" 2
273 2 93 VAL O 2 97 TRP H 1.900 . 2.100 1.908 1.759 2.116 0.016 9 0 "[ . 1 .]" 2
274 2 93 VAL O 2 97 TRP N 2.900 2.700 3.100 2.689 2.586 2.990 0.114 6 0 "[ . 1 .]" 2
275 2 94 GLU O 2 98 ALA H 1.900 . 2.100 2.052 1.926 2.182 0.082 7 0 "[ . 1 .]" 2
276 2 94 GLU O 2 98 ALA N 2.900 2.700 3.100 2.930 2.763 3.041 . 0 0 "[ . 1 .]" 2
277 2 95 ILE O 2 99 SER H 1.900 . 2.100 2.180 2.098 2.245 0.145 3 0 "[ . 1 .]" 2
278 2 95 ILE O 2 99 SER N 2.900 2.700 3.100 2.925 2.766 3.084 . 0 0 "[ . 1 .]" 2
279 2 96 GLY O 2 100 ALA H 1.900 . 2.100 1.955 1.723 2.218 0.118 14 0 "[ . 1 .]" 2
280 2 96 GLY O 2 100 ALA N 2.900 2.700 3.100 2.885 2.630 3.132 0.070 8 0 "[ . 1 .]" 2
281 2 97 TRP O 2 101 PHE H 1.900 . 2.100 1.906 1.626 2.074 0.074 1 0 "[ . 1 .]" 2
282 2 97 TRP O 2 101 PHE N 2.900 2.700 3.100 2.695 2.556 2.946 0.144 1 0 "[ . 1 .]" 2
283 2 98 ALA O 2 102 ASP H 1.900 . 2.100 2.043 1.753 2.159 0.059 7 0 "[ . 1 .]" 2
284 2 98 ALA O 2 102 ASP N 2.900 2.700 3.100 2.728 2.614 2.909 0.086 12 0 "[ . 1 .]" 2
285 2 105 ILE H 2 129 ALA O 1.900 . 2.100 2.031 1.840 2.182 0.082 14 0 "[ . 1 .]" 2
286 2 105 ILE N 2 129 ALA O 2.900 2.700 3.100 2.840 2.640 3.041 0.060 12 0 "[ . 1 .]" 2
287 2 105 ILE O 2 131 GLU H 1.900 . 2.100 2.065 1.822 2.159 0.059 1 0 "[ . 1 .]" 2
288 2 105 ILE O 2 131 GLU N 2.900 2.700 3.100 3.023 2.797 3.113 0.013 1 0 "[ . 1 .]" 2
289 2 107 LEU H 2 131 GLU O 1.900 . 2.100 1.992 1.773 2.157 0.057 11 0 "[ . 1 .]" 2
290 2 107 LEU N 2 131 GLU O 2.900 2.700 3.100 2.906 2.669 3.104 0.031 8 0 "[ . 1 .]" 2
291 2 107 LEU O 2 133 VAL H 1.900 . 2.100 1.909 1.764 2.086 . 0 0 "[ . 1 .]" 2
292 2 107 LEU O 2 133 VAL N 2.900 2.700 3.100 2.825 2.683 3.016 0.017 5 0 "[ . 1 .]" 2
293 2 109 LEU H 2 133 VAL O 1.900 . 2.100 2.233 2.164 2.299 0.199 12 0 "[ . 1 .]" 2
294 2 109 LEU N 2 133 VAL O 2.900 2.700 3.100 2.557 2.471 2.646 0.229 15 0 "[ . 1 .]" 2
295 2 109 LEU O 2 135 TYR H 1.900 . 2.100 2.136 1.918 2.225 0.125 3 0 "[ . 1 .]" 2
296 2 109 LEU O 2 135 TYR N 2.900 2.700 3.100 2.892 2.566 3.092 0.134 11 0 "[ . 1 .]" 2
297 2 112 GLY O 2 116 GLU H 1.900 . 2.100 2.152 2.102 2.192 0.092 6 0 "[ . 1 .]" 2
298 2 112 GLY O 2 116 GLU N 2.900 2.700 3.100 3.019 2.863 3.098 . 0 0 "[ . 1 .]" 2
299 2 113 ARG O 2 117 TYR H 1.900 . 2.100 1.849 1.688 2.046 0.012 14 0 "[ . 1 .]" 2
300 2 113 ARG O 2 117 TYR N 2.900 2.700 3.100 2.740 2.638 2.902 0.062 14 0 "[ . 1 .]" 2
301 2 118 GLY O 2 122 ARG H 1.900 . 2.100 1.887 1.741 2.026 . 0 0 "[ . 1 .]" 2
302 2 118 GLY O 2 122 ARG N 2.900 2.700 3.100 2.647 2.541 2.754 0.159 6 0 "[ . 1 .]" 2
303 2 119 PHE O 2 123 GLY H 1.900 . 2.100 2.325 2.290 2.365 0.265 15 0 "[ . 1 .]" 2
304 2 119 PHE O 2 123 GLY N 2.900 2.700 3.100 3.128 3.079 3.175 0.075 14 0 "[ . 1 .]" 2
305 2 120 LEU O 2 124 LEU H 1.900 . 2.100 1.925 1.767 2.120 0.020 3 0 "[ . 1 .]" 2
306 2 120 LEU O 2 124 LEU N 2.900 2.700 3.100 2.644 2.552 2.924 0.148 10 0 "[ . 1 .]" 2
307 2 121 VAL O 2 125 GLY H 1.900 . 2.100 2.124 1.964 2.206 0.106 10 0 "[ . 1 .]" 2
308 2 121 VAL O 2 125 GLY N 2.900 2.700 3.100 2.999 2.868 3.119 0.019 10 0 "[ . 1 .]" 2
309 2 122 ARG O 2 126 THR H 1.900 . 2.100 2.209 2.132 2.312 0.212 4 0 "[ . 1 .]" 2
310 2 122 ARG O 2 126 THR N 2.900 2.700 3.100 3.019 2.822 3.100 . 0 0 "[ . 1 .]" 2
311 2 123 GLY O 2 127 VAL H 1.900 . 2.100 2.130 1.936 2.218 0.118 5 0 "[ . 1 .]" 2
312 2 123 GLY O 2 127 VAL N 2.900 2.700 3.100 2.963 2.669 3.092 0.031 10 0 "[ . 1 .]" 2
313 2 124 LEU O 2 128 ALA H 1.900 . 2.100 1.970 1.685 2.101 0.015 15 0 "[ . 1 .]" 2
314 2 124 LEU O 2 128 ALA N 2.900 2.700 3.100 2.782 2.655 2.896 0.045 15 0 "[ . 1 .]" 2
315 2 137 ASP O 2 141 ALA H 1.900 . 2.100 2.031 1.852 2.165 0.065 10 0 "[ . 1 .]" 2
316 2 137 ASP O 2 141 ALA N 2.900 2.700 3.100 2.852 2.678 3.000 0.022 8 0 "[ . 1 .]" 2
317 2 138 ILE O 2 142 LYS H 1.900 . 2.100 2.039 1.814 2.156 0.056 7 0 "[ . 1 .]" 2
318 2 138 ILE O 2 142 LYS N 2.900 2.700 3.100 2.925 2.714 3.063 . 0 0 "[ . 1 .]" 2
319 2 140 LEU O 2 144 GLN H 1.900 . 2.100 2.126 2.030 2.194 0.094 2 0 "[ . 1 .]" 2
320 2 140 LEU O 2 144 GLN N 2.900 2.700 3.100 3.041 2.870 3.151 0.051 2 0 "[ . 1 .]" 2
321 2 141 ALA O 2 145 ILE H 1.900 . 2.100 1.834 1.636 2.002 0.064 6 0 "[ . 1 .]" 2
322 2 141 ALA O 2 145 ILE N 2.900 2.700 3.100 2.706 2.565 2.827 0.135 1 0 "[ . 1 .]" 2
323 2 142 LYS O 2 146 ASP H 1.900 . 2.100 2.081 1.918 2.178 0.078 15 0 "[ . 1 .]" 2
324 2 142 LYS O 2 146 ASP N 2.900 2.700 3.100 2.889 2.711 3.030 . 0 0 "[ . 1 .]" 2
325 2 143 PRO O 2 147 ALA H 1.900 . 2.100 2.000 1.750 2.158 0.058 13 0 "[ . 1 .]" 2
326 2 143 PRO O 2 147 ALA N 2.900 2.700 3.100 2.910 2.678 3.117 0.022 3 0 "[ . 1 .]" 2
327 2 144 GLN O 2 148 ALA H 1.900 . 2.100 2.021 1.800 2.129 0.029 12 0 "[ . 1 .]" 2
328 2 144 GLN O 2 148 ALA N 2.900 2.700 3.100 2.962 2.722 3.093 . 0 0 "[ . 1 .]" 2
329 2 145 ILE O 2 149 ILE H 1.900 . 2.100 2.066 1.873 2.127 0.027 8 0 "[ . 1 .]" 2
330 2 145 ILE O 2 149 ILE N 2.900 2.700 3.100 2.777 2.635 2.886 0.065 1 0 "[ . 1 .]" 2
331 2 146 ASP O 2 150 ARG H 1.900 . 2.100 2.002 1.862 2.129 0.029 14 0 "[ . 1 .]" 2
332 2 146 ASP O 2 150 ARG N 2.900 2.700 3.100 2.924 2.791 3.049 . 0 0 "[ . 1 .]" 2
333 2 147 ALA O 2 151 LYS H 1.900 . 2.100 2.015 1.825 2.163 0.063 8 0 "[ . 1 .]" 2
334 2 147 ALA O 2 151 LYS N 2.900 2.700 3.100 2.922 2.713 3.083 . 0 0 "[ . 1 .]" 2
335 2 148 ALA O 2 152 VAL H 1.900 . 2.100 1.979 1.839 2.119 0.019 4 0 "[ . 1 .]" 2
336 2 148 ALA O 2 152 VAL N 2.900 2.700 3.100 2.902 2.766 3.063 . 0 0 "[ . 1 .]" 2
337 2 149 ILE O 2 153 VAL H 1.900 . 2.100 2.037 1.869 2.143 0.043 9 0 "[ . 1 .]" 2
338 2 149 ILE O 2 153 VAL N 2.900 2.700 3.100 2.916 2.625 3.083 0.075 8 0 "[ . 1 .]" 2
339 2 150 ARG O 2 154 ASP H 1.900 . 2.100 2.008 1.799 2.109 0.009 12 0 "[ . 1 .]" 2
340 2 150 ARG O 2 154 ASP N 2.900 2.700 3.100 2.876 2.647 3.045 0.053 3 0 "[ . 1 .]" 2
341 2 151 LYS O 2 155 ARG H 1.900 . 2.100 2.061 1.855 2.159 0.059 13 0 "[ . 1 .]" 2
342 2 151 LYS O 2 155 ARG N 2.900 2.700 3.100 2.798 2.711 2.976 . 0 0 "[ . 1 .]" 2
343 2 152 VAL O 2 156 VAL H 1.900 . 2.100 2.087 1.810 2.174 0.074 1 0 "[ . 1 .]" 2
344 2 152 VAL O 2 156 VAL N 2.900 2.700 3.100 2.892 2.681 3.024 0.019 15 0 "[ . 1 .]" 2
345 2 153 VAL O 2 157 ASN H 1.900 . 2.100 2.016 1.758 2.125 0.025 10 0 "[ . 1 .]" 2
346 2 153 VAL O 2 157 ASN N 2.900 2.700 3.100 2.766 2.639 2.994 0.061 5 0 "[ . 1 .]" 2
347 2 154 ASP O 2 158 ASN H 1.900 . 2.100 2.056 1.875 2.157 0.057 6 0 "[ . 1 .]" 2
348 2 154 ASP O 2 158 ASN N 2.900 2.700 3.100 2.720 2.607 2.878 0.093 4 0 "[ . 1 .]" 2
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