NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
389559 |
1nku   |
5668 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1nku
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 1626
_Distance_constraint_stats_list.Viol_count 5074
_Distance_constraint_stats_list.Viol_total 9061.103
_Distance_constraint_stats_list.Viol_max 0.493
_Distance_constraint_stats_list.Viol_rms 0.0320
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0089
_Distance_constraint_stats_list.Viol_average_violations_only 0.0714
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 1.791 0.325 9 0 "[ . 1 . 2 .]"
1 2 GLU 2.120 0.325 9 0 "[ . 1 . 2 .]"
1 3 ARG 0.666 0.121 9 0 "[ . 1 . 2 .]"
1 4 CYS 4.190 0.327 8 0 "[ . 1 . 2 .]"
1 5 GLY 0.017 0.010 25 0 "[ . 1 . 2 .]"
1 6 TRP 5.326 0.327 8 0 "[ . 1 . 2 .]"
1 7 VAL 3.541 0.257 15 0 "[ . 1 . 2 .]"
1 11 PRO 0.603 0.081 23 0 "[ . 1 . 2 .]"
1 12 LEU 2.654 0.231 20 0 "[ . 1 . 2 .]"
1 13 TYR 1.898 0.235 15 0 "[ . 1 . 2 .]"
1 14 ILE 0.761 0.081 23 0 "[ . 1 . 2 .]"
1 15 ALA 0.045 0.022 2 0 "[ . 1 . 2 .]"
1 16 TYR 1.607 0.093 15 0 "[ . 1 . 2 .]"
1 17 HIS 2.456 0.372 21 0 "[ . 1 . 2 .]"
1 18 ASP 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 19 ASN 4.278 0.211 19 0 "[ . 1 . 2 .]"
1 20 GLU 1.708 0.121 13 0 "[ . 1 . 2 .]"
1 21 TRP 5.351 0.410 15 0 "[ . 1 . 2 .]"
1 22 GLY 0.196 0.104 12 0 "[ . 1 . 2 .]"
1 23 VAL 1.518 0.173 15 0 "[ . 1 . 2 .]"
1 24 PRO 0.019 0.019 12 0 "[ . 1 . 2 .]"
1 25 GLU 4.996 0.235 11 0 "[ . 1 . 2 .]"
1 26 THR 2.391 0.162 11 0 "[ . 1 . 2 .]"
1 27 ASP 5.593 0.327 23 0 "[ . 1 . 2 .]"
1 28 SER 2.755 0.327 23 0 "[ . 1 . 2 .]"
1 29 LYS 0.033 0.015 20 0 "[ . 1 . 2 .]"
1 30 LYS 0.969 0.126 11 0 "[ . 1 . 2 .]"
1 31 LEU 5.353 0.218 21 0 "[ . 1 . 2 .]"
1 32 PHE 5.638 0.241 9 0 "[ . 1 . 2 .]"
1 33 GLU 4.987 0.216 15 0 "[ . 1 . 2 .]"
1 34 MET 6.393 0.216 15 0 "[ . 1 . 2 .]"
1 35 ILE 4.087 0.241 9 0 "[ . 1 . 2 .]"
1 36 CYS 1.613 0.082 11 0 "[ . 1 . 2 .]"
1 37 LEU 2.157 0.135 16 0 "[ . 1 . 2 .]"
1 38 GLU 3.226 0.169 20 0 "[ . 1 . 2 .]"
1 39 GLY 0.167 0.031 19 0 "[ . 1 . 2 .]"
1 40 GLN 2.585 0.203 10 0 "[ . 1 . 2 .]"
1 41 GLN 4.805 0.203 10 0 "[ . 1 . 2 .]"
1 42 ALA 3.009 0.123 10 0 "[ . 1 . 2 .]"
1 43 GLY 0.730 0.116 3 0 "[ . 1 . 2 .]"
1 44 LEU 7.351 0.243 3 0 "[ . 1 . 2 .]"
1 45 SER 3.227 0.203 10 0 "[ . 1 . 2 .]"
1 46 TRP 1.759 0.166 17 0 "[ . 1 . 2 .]"
1 47 ILE 2.219 0.247 8 0 "[ . 1 . 2 .]"
1 48 THR 9.061 0.254 8 0 "[ . 1 . 2 .]"
1 49 VAL 1.666 0.112 7 0 "[ . 1 . 2 .]"
1 50 LEU 3.191 0.410 15 0 "[ . 1 . 2 .]"
1 51 LYS 2.781 0.231 20 0 "[ . 1 . 2 .]"
1 52 LYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 53 ARG 0.376 0.097 20 0 "[ . 1 . 2 .]"
1 54 GLU 1.467 0.144 17 0 "[ . 1 . 2 .]"
1 55 ASN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 56 TYR 4.193 0.184 17 0 "[ . 1 . 2 .]"
1 57 ARG 3.897 0.222 17 0 "[ . 1 . 2 .]"
1 58 ALA 3.747 0.137 13 0 "[ . 1 . 2 .]"
1 59 CYS 6.755 0.321 21 0 "[ . 1 . 2 .]"
1 60 PHE 10.320 0.213 3 0 "[ . 1 . 2 .]"
1 61 HIS 2.503 0.110 10 0 "[ . 1 . 2 .]"
1 62 GLN 3.606 0.222 17 0 "[ . 1 . 2 .]"
1 63 PHE 2.347 0.135 9 0 "[ . 1 . 2 .]"
1 64 ASP 4.460 0.203 3 0 "[ . 1 . 2 .]"
1 65 PRO 1.203 0.162 11 0 "[ . 1 . 2 .]"
1 66 VAL 3.189 0.174 1 0 "[ . 1 . 2 .]"
1 67 LYS 3.436 0.176 5 0 "[ . 1 . 2 .]"
1 68 VAL 4.648 0.407 8 0 "[ . 1 . 2 .]"
1 69 ALA 7.143 0.407 8 0 "[ . 1 . 2 .]"
1 70 ALA 5.958 0.213 3 0 "[ . 1 . 2 .]"
1 71 MET 6.171 0.265 2 0 "[ . 1 . 2 .]"
1 72 GLN 3.072 0.265 2 0 "[ . 1 . 2 .]"
1 73 GLU 1.882 0.254 7 0 "[ . 1 . 2 .]"
1 74 GLU 1.183 0.138 20 0 "[ . 1 . 2 .]"
1 75 ASP 3.581 0.187 17 0 "[ . 1 . 2 .]"
1 76 VAL 2.328 0.396 6 0 "[ . 1 . 2 .]"
1 77 GLU 2.623 0.396 6 0 "[ . 1 . 2 .]"
1 78 ARG 3.219 0.088 21 0 "[ . 1 . 2 .]"
1 79 LEU 11.200 0.321 21 0 "[ . 1 . 2 .]"
1 80 VAL 2.431 0.149 21 0 "[ . 1 . 2 .]"
1 81 GLN 4.412 0.220 3 0 "[ . 1 . 2 .]"
1 82 ASP 0.912 0.099 24 0 "[ . 1 . 2 .]"
1 83 ALA 6.390 0.192 16 0 "[ . 1 . 2 .]"
1 84 GLY 3.848 0.192 16 0 "[ . 1 . 2 .]"
1 85 ILE 3.554 0.188 17 0 "[ . 1 . 2 .]"
1 86 ILE 3.641 0.464 20 0 "[ . 1 . 2 .]"
1 87 ARG 2.110 0.464 20 0 "[ . 1 . 2 .]"
1 88 HIS 5.316 0.493 10 0 "[ . 1 . 2 .]"
1 89 ARG 2.629 0.493 10 0 "[ . 1 . 2 .]"
1 90 GLY 2.549 0.153 13 0 "[ . 1 . 2 .]"
1 91 LYS 0.888 0.185 23 0 "[ . 1 . 2 .]"
1 92 ILE 2.326 0.262 12 0 "[ . 1 . 2 .]"
1 93 GLN 1.420 0.088 6 0 "[ . 1 . 2 .]"
1 94 ALA 2.387 0.072 24 0 "[ . 1 . 2 .]"
1 95 ILE 2.716 0.154 9 0 "[ . 1 . 2 .]"
1 96 ILE 2.749 0.135 4 0 "[ . 1 . 2 .]"
1 97 GLY 0.083 0.023 22 0 "[ . 1 . 2 .]"
1 98 ASN 5.441 0.298 1 0 "[ . 1 . 2 .]"
1 99 ALA 1.849 0.097 10 0 "[ . 1 . 2 .]"
1 100 ARG 3.630 0.170 22 0 "[ . 1 . 2 .]"
1 101 ALA 10.636 0.193 25 0 "[ . 1 . 2 .]"
1 102 TYR 6.422 0.178 9 0 "[ . 1 . 2 .]"
1 103 LEU 3.316 0.122 3 0 "[ . 1 . 2 .]"
1 104 GLN 0.187 0.051 21 0 "[ . 1 . 2 .]"
1 105 MET 2.466 0.175 9 0 "[ . 1 . 2 .]"
1 106 GLU 5.172 0.225 9 0 "[ . 1 . 2 .]"
1 107 GLN 1.922 0.122 3 0 "[ . 1 . 2 .]"
1 108 ASN 1.188 0.058 20 0 "[ . 1 . 2 .]"
1 109 GLY 3.539 0.225 9 0 "[ . 1 . 2 .]"
1 110 GLU 0.051 0.030 6 0 "[ . 1 . 2 .]"
1 111 PRO 1.552 0.126 11 0 "[ . 1 . 2 .]"
1 112 PHE 7.527 0.319 9 0 "[ . 1 . 2 .]"
1 113 ALA 9.539 0.319 9 0 "[ . 1 . 2 .]"
1 114 ASP 3.816 0.126 11 0 "[ . 1 . 2 .]"
1 115 PHE 3.469 0.114 2 0 "[ . 1 . 2 .]"
1 116 VAL 8.140 0.244 18 0 "[ . 1 . 2 .]"
1 117 TRP 2.170 0.126 1 0 "[ . 1 . 2 .]"
1 118 SER 0.121 0.039 2 0 "[ . 1 . 2 .]"
1 119 PHE 4.648 0.171 10 0 "[ . 1 . 2 .]"
1 120 VAL 2.780 0.135 23 0 "[ . 1 . 2 .]"
1 121 ASN 9.440 0.330 19 0 "[ . 1 . 2 .]"
1 122 HIS 9.414 0.330 19 0 "[ . 1 . 2 .]"
1 123 GLN 4.416 0.361 23 0 "[ . 1 . 2 .]"
1 124 PRO 1.720 0.361 23 0 "[ . 1 . 2 .]"
1 125 GLN 1.516 0.135 23 0 "[ . 1 . 2 .]"
1 126 MET 1.034 0.216 19 0 "[ . 1 . 2 .]"
1 127 THR 4.110 0.217 3 0 "[ . 1 . 2 .]"
1 128 GLN 3.389 0.135 20 0 "[ . 1 . 2 .]"
1 129 ALA 3.081 0.178 18 0 "[ . 1 . 2 .]"
1 130 THR 4.448 0.198 16 0 "[ . 1 . 2 .]"
1 131 THR 4.180 0.241 20 0 "[ . 1 . 2 .]"
1 132 LEU 4.287 0.241 20 0 "[ . 1 . 2 .]"
1 133 SER 2.521 0.125 1 0 "[ . 1 . 2 .]"
1 134 GLU 3.896 0.198 16 0 "[ . 1 . 2 .]"
1 135 ILE 7.101 0.252 3 0 "[ . 1 . 2 .]"
1 136 PRO 4.911 0.450 4 0 "[ . 1 . 2 .]"
1 137 THR 6.070 0.450 4 0 "[ . 1 . 2 .]"
1 138 SER 3.336 0.297 6 0 "[ . 1 . 2 .]"
1 139 THR 3.203 0.109 2 0 "[ . 1 . 2 .]"
1 140 PRO 1.240 0.067 11 0 "[ . 1 . 2 .]"
1 141 ALA 6.973 0.118 17 0 "[ . 1 . 2 .]"
1 142 SER 4.333 0.125 1 0 "[ . 1 . 2 .]"
1 143 ASP 5.224 0.163 1 0 "[ . 1 . 2 .]"
1 144 ALA 1.747 0.114 2 0 "[ . 1 . 2 .]"
1 145 LEU 14.691 0.272 12 0 "[ . 1 . 2 .]"
1 146 SER 2.834 0.205 12 0 "[ . 1 . 2 .]"
1 147 LYS 2.907 0.096 12 0 "[ . 1 . 2 .]"
1 148 ALA 4.302 0.115 3 0 "[ . 1 . 2 .]"
1 149 LEU 4.215 0.167 10 0 "[ . 1 . 2 .]"
1 150 LYS 4.741 0.272 12 0 "[ . 1 . 2 .]"
1 151 LYS 2.272 0.115 3 0 "[ . 1 . 2 .]"
1 152 ARG 2.950 0.075 21 0 "[ . 1 . 2 .]"
1 153 GLY 1.755 0.145 18 0 "[ . 1 . 2 .]"
1 154 PHE 5.633 0.298 1 0 "[ . 1 . 2 .]"
1 155 LYS 0.567 0.129 24 0 "[ . 1 . 2 .]"
1 156 PHE 3.980 0.298 1 0 "[ . 1 . 2 .]"
1 157 VAL 2.278 0.193 6 0 "[ . 1 . 2 .]"
1 158 GLY 3.562 0.215 15 0 "[ . 1 . 2 .]"
1 159 THR 0.690 0.051 3 0 "[ . 1 . 2 .]"
1 160 THR 5.891 0.215 15 0 "[ . 1 . 2 .]"
1 161 ILE 5.996 0.185 20 0 "[ . 1 . 2 .]"
1 162 CYS 3.709 0.113 21 0 "[ . 1 . 2 .]"
1 163 TYR 9.498 0.166 19 0 "[ . 1 . 2 .]"
1 164 SER 4.755 0.153 3 0 "[ . 1 . 2 .]"
1 165 PHE 1.482 0.137 20 0 "[ . 1 . 2 .]"
1 166 MET 4.425 0.150 8 0 "[ . 1 . 2 .]"
1 167 GLN 8.667 0.313 15 0 "[ . 1 . 2 .]"
1 168 ALA 6.365 0.208 20 0 "[ . 1 . 2 .]"
1 169 CYS 0.321 0.102 12 0 "[ . 1 . 2 .]"
1 170 GLY 1.801 0.223 12 0 "[ . 1 . 2 .]"
1 171 LEU 2.674 0.298 12 0 "[ . 1 . 2 .]"
1 172 VAL 5.459 0.332 12 0 "[ . 1 . 2 .]"
1 173 ASN 0.681 0.081 6 0 "[ . 1 . 2 .]"
1 174 ASP 0.190 0.130 24 0 "[ . 1 . 2 .]"
1 175 HIS 0.771 0.149 3 0 "[ . 1 . 2 .]"
1 176 VAL 6.104 0.375 17 0 "[ . 1 . 2 .]"
1 177 VAL 2.395 0.278 15 0 "[ . 1 . 2 .]"
1 178 GLY 0.050 0.050 18 0 "[ . 1 . 2 .]"
1 179 CYS 1.945 0.299 9 0 "[ . 1 . 2 .]"
1 180 CYS 5.887 0.375 17 0 "[ . 1 . 2 .]"
1 181 CYS 5.234 0.305 18 0 "[ . 1 . 2 .]"
1 182 TYR 3.199 0.266 8 0 "[ . 1 . 2 .]"
1 183 PRO 1.971 0.193 2 0 "[ . 1 . 2 .]"
1 184 GLY 1.619 0.082 17 0 "[ . 1 . 2 .]"
1 185 ASN 3.899 0.312 2 0 "[ . 1 . 2 .]"
1 186 LYS 5.691 0.312 2 0 "[ . 1 . 2 .]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 MET HA 1 2 GLU H 1.800 . 2.900 2.570 2.188 3.225 0.325 9 0 "[ . 1 . 2 .]" 1
2 1 1 MET QG 1 2 GLU H 1.800 . 3.500 2.784 1.718 3.709 0.209 19 0 "[ . 1 . 2 .]" 1
3 1 2 GLU H 1 3 ARG H 1.800 . 5.000 4.565 4.386 4.670 . 0 0 "[ . 1 . 2 .]" 1
4 1 2 GLU HA 1 3 ARG H 1.800 . 2.700 2.336 2.259 2.422 . 0 0 "[ . 1 . 2 .]" 1
5 1 2 GLU QB 1 3 ARG H 1.800 . 3.500 2.835 2.512 3.540 0.040 18 0 "[ . 1 . 2 .]" 1
6 1 3 ARG HE 1 7 VAL QG 1.800 . 5.000 3.948 2.299 5.050 0.050 4 0 "[ . 1 . 2 .]" 1
7 1 3 ARG HE 1 14 ILE MG 1.800 . 5.000 3.899 2.782 5.042 0.042 2 0 "[ . 1 . 2 .]" 1
8 1 3 ARG H 1 4 CYS H 1.800 . 5.000 4.490 4.425 4.590 . 0 0 "[ . 1 . 2 .]" 1
9 1 3 ARG HA 1 4 CYS H 1.800 . 2.900 2.400 2.324 2.595 . 0 0 "[ . 1 . 2 .]" 1
10 1 4 CYS H 1 7 VAL QG 1.800 . 5.000 3.773 2.532 5.038 0.038 4 0 "[ . 1 . 2 .]" 1
11 1 4 CYS H 1 179 CYS QB 1.800 . 5.000 3.708 2.485 4.961 . 0 0 "[ . 1 . 2 .]" 1
12 1 4 CYS H 1 5 GLY H 1.800 . 5.000 4.610 4.241 4.701 . 0 0 "[ . 1 . 2 .]" 1
13 1 4 CYS HA 1 5 GLY H 1.800 . 2.900 2.307 2.178 2.896 . 0 0 "[ . 1 . 2 .]" 1
14 1 5 GLY H 1 132 LEU QD 1.800 . 3.500 3.088 2.440 3.510 0.010 25 0 "[ . 1 . 2 .]" 1
15 1 6 TRP H 1 6 TRP HA 1.800 . 2.900 2.792 2.340 2.949 0.049 2 0 "[ . 1 . 2 .]" 1
16 1 6 TRP H 1 6 TRP QB 1.800 . 3.500 2.658 2.296 3.400 . 0 0 "[ . 1 . 2 .]" 1
17 1 6 TRP H 1 6 TRP HD1 1.800 . 3.500 2.379 1.757 3.135 0.043 25 0 "[ . 1 . 2 .]" 1
18 1 6 TRP H 1 6 TRP HE1 1.800 . 5.000 4.198 3.550 5.034 0.034 10 0 "[ . 1 . 2 .]" 1
19 1 5 GLY H 1 6 TRP H 1.800 . 3.500 2.531 2.124 2.779 . 0 0 "[ . 1 . 2 .]" 1
20 1 6 TRP H 1 7 VAL QG 1.800 . 5.000 3.749 3.245 4.177 . 0 0 "[ . 1 . 2 .]" 1
21 1 4 CYS HA 1 6 TRP H 1.800 . 4.000 3.872 3.068 4.175 0.175 2 0 "[ . 1 . 2 .]" 1
22 1 4 CYS QB 1 6 TRP HE1 1.800 . 4.000 3.817 1.861 4.327 0.327 8 0 "[ . 1 . 2 .]" 1
23 1 6 TRP H 1 132 LEU QD 1.800 . 3.500 2.621 2.150 3.166 . 0 0 "[ . 1 . 2 .]" 1
24 1 6 TRP HE1 1 132 LEU QD 1.800 . 3.500 2.897 2.214 3.604 0.104 3 0 "[ . 1 . 2 .]" 1
25 1 6 TRP HD1 1 132 LEU QD 1.800 . 3.500 3.008 1.962 3.576 0.076 5 0 "[ . 1 . 2 .]" 1
26 1 7 VAL H 1 7 VAL HB 1.800 . 3.500 3.193 2.343 3.757 0.257 15 0 "[ . 1 . 2 .]" 1
27 1 7 VAL H 1 7 VAL QG 1.800 . 2.900 1.980 1.764 2.604 0.036 1 0 "[ . 1 . 2 .]" 1
28 1 6 TRP H 1 7 VAL H 1.800 . 2.900 2.758 2.420 2.885 . 0 0 "[ . 1 . 2 .]" 1
29 1 6 TRP HA 1 7 VAL H 1.800 . 3.500 3.475 3.122 3.566 0.066 5 0 "[ . 1 . 2 .]" 1
30 1 7 VAL QG 1 14 ILE HA 1.800 . 3.300 2.945 2.445 3.379 0.079 10 0 "[ . 1 . 2 .]" 1
31 1 7 VAL QG 1 14 ILE QG 1.800 . 5.000 2.026 1.786 2.521 0.014 1 0 "[ . 1 . 2 .]" 1
32 1 7 VAL QG 1 14 ILE MG 1.800 . 5.000 3.430 2.839 4.075 . 0 0 "[ . 1 . 2 .]" 1
33 1 7 VAL QG 1 14 ILE MD 1.800 . 3.300 2.543 1.940 3.086 . 0 0 "[ . 1 . 2 .]" 1
34 1 7 VAL QG 1 14 ILE H 1.800 . 5.000 3.705 2.205 4.780 . 0 0 "[ . 1 . 2 .]" 1
35 1 7 VAL H 1 132 LEU QD 1.800 . 5.000 4.487 4.052 5.004 0.004 4 0 "[ . 1 . 2 .]" 1
36 1 7 VAL QG 1 132 LEU QD 1.800 . 5.000 4.704 4.230 5.089 0.089 22 0 "[ . 1 . 2 .]" 1
37 1 11 PRO HA 1 14 ILE H 1.800 . 5.000 3.421 3.108 3.636 . 0 0 "[ . 1 . 2 .]" 1
38 1 11 PRO HA 1 14 ILE HB 1.800 . 5.000 2.964 2.371 3.406 . 0 0 "[ . 1 . 2 .]" 1
39 1 11 PRO HA 1 14 ILE MD 1.800 . 3.300 3.001 2.245 3.358 0.058 4 0 "[ . 1 . 2 .]" 1
40 1 12 LEU H 1 12 LEU QB 1.800 . 5.000 2.279 2.257 2.300 . 0 0 "[ . 1 . 2 .]" 1
41 1 11 PRO QB 1 12 LEU H 1.800 . 5.000 3.082 2.591 3.408 . 0 0 "[ . 1 . 2 .]" 1
42 1 12 LEU QD 1 15 ALA MB 1.800 . 5.000 3.159 2.461 3.892 . 0 0 "[ . 1 . 2 .]" 1
43 1 12 LEU MD1 1 47 ILE MD 1.800 . 5.000 4.034 2.071 5.023 0.023 25 0 "[ . 1 . 2 .]" 1
44 1 12 LEU MD2 1 47 ILE MD 1.800 . 5.000 2.415 1.889 3.132 . 0 0 "[ . 1 . 2 .]" 1
45 1 12 LEU QD 1 50 LEU H 1.800 . 5.000 4.716 4.115 5.077 0.077 1 0 "[ . 1 . 2 .]" 1
46 1 12 LEU QD 1 50 LEU QB 1.800 . 5.000 2.530 2.013 2.962 . 0 0 "[ . 1 . 2 .]" 1
47 1 12 LEU QD 1 50 LEU HG 1.800 . 5.000 4.461 3.586 5.031 0.031 15 0 "[ . 1 . 2 .]" 1
48 1 12 LEU QD 1 51 LYS QG 1.800 . 5.000 2.568 2.026 3.904 . 0 0 "[ . 1 . 2 .]" 1
49 1 12 LEU QD 1 51 LYS QD 1.800 . 5.000 3.670 2.407 4.841 . 0 0 "[ . 1 . 2 .]" 1
50 1 12 LEU QD 1 51 LYS QE 1.800 . 5.000 2.713 1.989 4.149 . 0 0 "[ . 1 . 2 .]" 1
51 1 13 TYR QD 1 16 TYR QD 1.800 . 5.000 4.649 3.882 5.048 0.048 21 0 "[ . 1 . 2 .]" 1
52 1 13 TYR QD 1 46 TRP HD1 1.800 . 3.300 3.140 2.558 3.452 0.152 21 0 "[ . 1 . 2 .]" 1
53 1 13 TYR QD 1 47 ILE MG 1.800 . 5.000 4.842 4.254 5.235 0.235 15 0 "[ . 1 . 2 .]" 1
54 1 13 TYR QD 1 47 ILE MD 1.800 . 5.000 3.017 2.197 4.471 . 0 0 "[ . 1 . 2 .]" 1
55 1 13 TYR QE 1 47 ILE MD 1.800 . 5.000 4.308 2.631 5.157 0.157 5 0 "[ . 1 . 2 .]" 1
56 1 13 TYR QD 1 50 LEU QD 1.800 . 5.000 3.100 2.267 4.724 . 0 0 "[ . 1 . 2 .]" 1
57 1 13 TYR QE 1 50 LEU QD 1.800 . 5.000 3.741 3.200 4.785 . 0 0 "[ . 1 . 2 .]" 1
58 1 14 ILE H 1 14 ILE MD 1.800 . 3.500 3.171 1.845 3.266 . 0 0 "[ . 1 . 2 .]" 1
59 1 14 ILE MG 1 15 ALA MB 1.800 . 5.000 4.031 3.113 4.243 . 0 0 "[ . 1 . 2 .]" 1
60 1 11 PRO QB 1 14 ILE MG 1.800 . 5.000 4.852 3.601 5.081 0.081 23 0 "[ . 1 . 2 .]" 1
61 1 11 PRO QB 1 14 ILE MD 1.800 . 5.000 4.145 3.144 4.586 . 0 0 "[ . 1 . 2 .]" 1
62 1 14 ILE H 1 16 TYR H 1.800 . 5.000 4.254 4.068 4.508 . 0 0 "[ . 1 . 2 .]" 1
63 1 7 VAL QG 1 14 ILE HA 1.800 . 5.000 2.945 2.445 3.379 . 0 0 "[ . 1 . 2 .]" 1
64 1 14 ILE HA 1 15 ALA H 1.800 . 5.000 3.558 3.535 3.586 . 0 0 "[ . 1 . 2 .]" 1
65 1 14 ILE MG 1 15 ALA H 1.800 . 3.500 3.298 2.245 3.522 0.022 2 0 "[ . 1 . 2 .]" 1
66 1 14 ILE MG 1 15 ALA HA 1.800 . 5.000 3.354 2.861 3.576 . 0 0 "[ . 1 . 2 .]" 1
67 1 12 LEU HA 1 15 ALA MB 1.800 . 3.300 2.617 2.277 3.018 . 0 0 "[ . 1 . 2 .]" 1
68 1 12 LEU HA 1 15 ALA H 1.800 . 5.000 3.471 3.236 3.664 . 0 0 "[ . 1 . 2 .]" 1
69 1 15 ALA H 1 16 TYR H 1.800 . 3.500 2.689 2.603 2.771 . 0 0 "[ . 1 . 2 .]" 1
70 1 15 ALA MB 1 16 TYR H 1.800 . 3.500 2.509 2.368 2.664 . 0 0 "[ . 1 . 2 .]" 1
71 1 13 TYR HA 1 16 TYR QD 1.800 . 5.000 4.440 3.891 4.876 . 0 0 "[ . 1 . 2 .]" 1
72 1 16 TYR QD 1 46 TRP HD1 1.800 . 5.000 4.929 4.299 5.079 0.079 17 0 "[ . 1 . 2 .]" 1
73 1 16 TYR QD 1 50 LEU QD 1.800 . 5.000 2.766 2.265 3.539 . 0 0 "[ . 1 . 2 .]" 1
74 1 16 TYR H 1 17 HIS H 1.800 . 3.500 2.568 2.480 2.632 . 0 0 "[ . 1 . 2 .]" 1
75 1 16 TYR HA 1 17 HIS H 1.800 . 3.500 3.533 3.508 3.556 0.056 15 0 "[ . 1 . 2 .]" 1
76 1 14 ILE HA 1 17 HIS H 1.800 . 5.000 3.092 2.886 3.506 . 0 0 "[ . 1 . 2 .]" 1
77 1 14 ILE MD 1 17 HIS H 1.800 . 5.000 4.232 3.928 4.751 . 0 0 "[ . 1 . 2 .]" 1
78 1 15 ALA H 1 17 HIS H 1.800 . 5.000 3.965 3.823 4.173 . 0 0 "[ . 1 . 2 .]" 1
79 1 7 VAL QG 1 17 HIS H 1.800 . 5.000 4.732 3.997 5.123 0.123 1 0 "[ . 1 . 2 .]" 1
80 1 17 HIS H 1 18 ASP H 1.800 . 3.500 2.834 2.622 2.939 . 0 0 "[ . 1 . 2 .]" 1
81 1 14 ILE MG 1 18 ASP H 1.800 . 5.000 3.704 3.307 3.985 . 0 0 "[ . 1 . 2 .]" 1
82 1 15 ALA HA 1 18 ASP H 1.800 . 5.000 3.682 3.502 3.868 . 0 0 "[ . 1 . 2 .]" 1
83 1 16 TYR H 1 18 ASP H 1.800 . 5.000 4.355 3.835 4.591 . 0 0 "[ . 1 . 2 .]" 1
84 1 19 ASN H 1 19 ASN HA 1.800 . 2.700 2.844 2.804 2.911 0.211 19 0 "[ . 1 . 2 .]" 1
85 1 18 ASP H 1 19 ASN H 1.800 . 3.500 2.557 2.270 2.713 . 0 0 "[ . 1 . 2 .]" 1
86 1 18 ASP HA 1 19 ASN H 1.800 . 5.000 3.550 3.467 3.583 . 0 0 "[ . 1 . 2 .]" 1
87 1 15 ALA HA 1 19 ASN H 1.800 . 5.000 4.030 3.426 4.560 . 0 0 "[ . 1 . 2 .]" 1
88 1 15 ALA MB 1 19 ASN H 1.800 . 5.000 4.571 4.126 5.022 0.022 15 0 "[ . 1 . 2 .]" 1
89 1 16 TYR HA 1 19 ASN H 1.800 . 5.000 3.416 3.097 3.776 . 0 0 "[ . 1 . 2 .]" 1
90 1 16 TYR HA 1 19 ASN QB 1.800 . 5.000 2.435 2.155 3.508 . 0 0 "[ . 1 . 2 .]" 1
91 1 20 GLU H 1 20 GLU HA 1.800 . 2.900 2.928 2.822 2.989 0.089 10 0 "[ . 1 . 2 .]" 1
92 1 20 GLU H 1 20 GLU QG 1.800 . 3.300 2.931 2.440 3.264 . 0 0 "[ . 1 . 2 .]" 1
93 1 19 ASN H 1 20 GLU H 1.800 . 2.900 2.895 2.769 3.021 0.121 13 0 "[ . 1 . 2 .]" 1
94 1 19 ASN QB 1 20 GLU H 1.800 . 3.500 2.264 1.898 2.589 . 0 0 "[ . 1 . 2 .]" 1
95 1 16 TYR QD 1 20 GLU H 1.800 . 5.000 4.207 3.365 4.785 . 0 0 "[ . 1 . 2 .]" 1
96 1 20 GLU H 1 23 VAL QG 1.800 . 5.000 4.553 4.042 4.926 . 0 0 "[ . 1 . 2 .]" 1
97 1 17 HIS HA 1 21 TRP HD1 1.800 . 5.000 4.843 2.577 5.372 0.372 21 0 "[ . 1 . 2 .]" 1
98 1 21 TRP HA 1 23 VAL QG 1.800 . 5.000 3.892 3.412 4.684 . 0 0 "[ . 1 . 2 .]" 1
99 1 16 TYR QE 1 21 TRP HE1 1.800 . 5.000 4.319 3.219 5.093 0.093 15 0 "[ . 1 . 2 .]" 1
100 1 21 TRP HE1 1 167 GLN HA 1.800 . 5.000 5.066 4.925 5.313 0.313 15 0 "[ . 1 . 2 .]" 1
101 1 21 TRP HE1 1 167 GLN QB 1.800 . 5.000 3.135 2.442 3.934 . 0 0 "[ . 1 . 2 .]" 1
102 1 21 TRP HE1 1 168 ALA HA 1.800 . 5.000 4.431 3.528 5.012 0.012 18 0 "[ . 1 . 2 .]" 1
103 1 21 TRP HE1 1 168 ALA MB 1.800 . 5.000 4.728 4.169 5.195 0.195 15 0 "[ . 1 . 2 .]" 1
104 1 21 TRP HD1 1 168 ALA MB 1.800 . 5.000 3.732 2.923 4.969 . 0 0 "[ . 1 . 2 .]" 1
105 1 21 TRP HD1 1 168 ALA HA 1.800 . 5.000 3.052 2.375 4.390 . 0 0 "[ . 1 . 2 .]" 1
106 1 21 TRP HA 1 22 GLY H 1.800 . 2.900 2.242 2.179 2.311 . 0 0 "[ . 1 . 2 .]" 1
107 1 22 GLY H 1 23 VAL QG 1.800 . 6.000 3.456 3.064 4.079 . 0 0 "[ . 1 . 2 .]" 1
108 1 22 GLY H 1 168 ALA MB 1.800 . 5.000 4.563 3.372 5.054 0.054 23 0 "[ . 1 . 2 .]" 1
109 1 22 GLY H 1 170 GLY H 1.800 . 5.000 4.382 3.835 5.104 0.104 12 0 "[ . 1 . 2 .]" 1
110 1 23 VAL H 1 23 VAL HB 1.800 . 3.500 3.181 2.366 3.673 0.173 15 0 "[ . 1 . 2 .]" 1
111 1 23 VAL H 1 23 VAL QG 1.800 . 3.500 1.913 1.696 2.476 0.104 2 0 "[ . 1 . 2 .]" 1
112 1 22 GLY QA 1 23 VAL H 1.800 . 5.000 2.920 2.868 2.938 . 0 0 "[ . 1 . 2 .]" 1
113 1 23 VAL QG 1 24 PRO HA 1.800 . 5.000 4.368 3.842 4.745 . 0 0 "[ . 1 . 2 .]" 1
114 1 23 VAL QG 1 24 PRO QD 1.800 . 3.300 2.623 1.990 3.319 0.019 12 0 "[ . 1 . 2 .]" 1
115 1 20 GLU HA 1 23 VAL H 1.800 . 5.000 4.359 3.870 4.656 . 0 0 "[ . 1 . 2 .]" 1
116 1 20 GLU HA 1 23 VAL QG 1.800 . 5.000 2.398 2.003 2.879 . 0 0 "[ . 1 . 2 .]" 1
117 1 23 VAL HA 1 24 PRO QD 1.800 . 2.700 2.063 2.035 2.101 . 0 0 "[ . 1 . 2 .]" 1
118 1 24 PRO HA 1 25 GLU H 1.800 . 2.900 2.203 2.187 2.222 . 0 0 "[ . 1 . 2 .]" 1
119 1 25 GLU H 1 31 LEU QD 1.800 . 5.000 3.919 3.306 4.617 . 0 0 "[ . 1 . 2 .]" 1
120 1 25 GLU HA 1 31 LEU QD 1.800 . 5.000 4.553 3.654 5.062 0.062 23 0 "[ . 1 . 2 .]" 1
121 1 25 GLU H 1 26 THR HB 1.800 . 5.000 3.914 3.199 4.601 . 0 0 "[ . 1 . 2 .]" 1
122 1 25 GLU H 1 170 GLY QA 1.800 . 5.000 3.651 2.882 4.449 . 0 0 "[ . 1 . 2 .]" 1
123 1 25 GLU H 1 171 LEU QD 1.800 . 5.000 3.715 3.022 4.665 . 0 0 "[ . 1 . 2 .]" 1
124 1 25 GLU H 1 26 THR MG 1.800 . 5.000 4.099 3.878 4.434 . 0 0 "[ . 1 . 2 .]" 1
125 1 25 GLU H 1 170 GLY H 1.800 . 5.000 5.059 5.005 5.118 0.118 5 0 "[ . 1 . 2 .]" 1
126 1 26 THR H 1 26 THR MG 1.800 . 3.500 2.689 2.506 2.912 . 0 0 "[ . 1 . 2 .]" 1
127 1 25 GLU H 1 26 THR H 1.800 . 5.000 4.439 4.356 4.488 . 0 0 "[ . 1 . 2 .]" 1
128 1 25 GLU HA 1 26 THR H 1.800 . 2.900 2.202 2.177 2.235 . 0 0 "[ . 1 . 2 .]" 1
129 1 25 GLU QB 1 26 THR H 1.800 . 3.500 3.284 2.999 3.651 0.151 3 0 "[ . 1 . 2 .]" 1
130 1 25 GLU QG 1 26 THR H 1.800 . 5.000 3.721 2.224 4.687 . 0 0 "[ . 1 . 2 .]" 1
131 1 26 THR H 1 27 ASP QB 1.800 . 5.000 4.072 3.779 4.272 . 0 0 "[ . 1 . 2 .]" 1
132 1 26 THR H 1 30 LYS QD 1.800 . 5.000 4.815 4.376 5.093 0.093 5 0 "[ . 1 . 2 .]" 1
133 1 26 THR H 1 31 LEU QD 1.800 . 5.000 4.510 3.491 5.051 0.051 2 0 "[ . 1 . 2 .]" 1
134 1 26 THR MG 1 31 LEU QD 1.800 . 5.000 4.524 3.957 5.041 0.041 2 0 "[ . 1 . 2 .]" 1
135 1 26 THR MG 1 113 ALA MB 1.800 . 5.000 4.600 4.212 5.094 0.094 3 0 "[ . 1 . 2 .]" 1
136 1 26 THR MG 1 117 TRP HD1 1.800 . 5.000 4.584 3.695 5.002 0.002 18 0 "[ . 1 . 2 .]" 1
137 1 26 THR HB 1 117 TRP HE1 1.800 . 5.000 4.050 3.218 4.824 . 0 0 "[ . 1 . 2 .]" 1
138 1 27 ASP H 1 27 ASP QB 1.800 . 2.900 2.379 2.313 2.407 . 0 0 "[ . 1 . 2 .]" 1
139 1 26 THR H 1 27 ASP H 1.800 . 2.900 2.124 1.942 2.267 . 0 0 "[ . 1 . 2 .]" 1
140 1 26 THR HA 1 27 ASP H 1.800 . 5.000 3.253 3.134 3.310 . 0 0 "[ . 1 . 2 .]" 1
141 1 26 THR MG 1 27 ASP H 1.800 . 5.000 4.135 4.063 4.214 . 0 0 "[ . 1 . 2 .]" 1
142 1 25 GLU HA 1 27 ASP H 1.800 . 3.500 3.576 3.520 3.654 0.154 5 0 "[ . 1 . 2 .]" 1
143 1 25 GLU QB 1 27 ASP H 1.800 . 3.500 3.106 2.753 3.735 0.235 11 0 "[ . 1 . 2 .]" 1
144 1 27 ASP H 1 30 LYS QG 1.800 . 5.000 4.228 3.881 4.559 . 0 0 "[ . 1 . 2 .]" 1
145 1 27 ASP H 1 30 LYS QD 1.800 . 5.000 3.825 3.434 4.282 . 0 0 "[ . 1 . 2 .]" 1
146 1 27 ASP H 1 31 LEU QD 1.800 . 5.000 3.776 2.837 4.505 . 0 0 "[ . 1 . 2 .]" 1
147 1 27 ASP H 1 28 SER H 1.800 . 5.000 4.459 4.357 4.553 . 0 0 "[ . 1 . 2 .]" 1
148 1 27 ASP HA 1 28 SER H 1.800 . 2.900 2.181 2.131 2.203 . 0 0 "[ . 1 . 2 .]" 1
149 1 27 ASP QB 1 28 SER H 1.800 . 3.500 3.473 3.228 3.827 0.327 23 0 "[ . 1 . 2 .]" 1
150 1 28 SER H 1 29 LYS QD 1.800 . 5.000 4.081 3.750 4.609 . 0 0 "[ . 1 . 2 .]" 1
151 1 28 SER H 1 113 ALA MB 1.800 . 3.500 3.367 3.066 3.708 0.208 11 0 "[ . 1 . 2 .]" 1
152 1 29 LYS H 1 29 LYS HA 1.800 . 2.900 2.850 2.830 2.868 . 0 0 "[ . 1 . 2 .]" 1
153 1 29 LYS H 1 29 LYS QB 1.800 . 2.900 2.447 2.050 2.592 . 0 0 "[ . 1 . 2 .]" 1
154 1 28 SER H 1 29 LYS H 1.800 . 3.500 2.711 2.582 3.003 . 0 0 "[ . 1 . 2 .]" 1
155 1 28 SER QB 1 29 LYS H 1.800 . 3.500 2.892 2.517 3.515 0.015 20 0 "[ . 1 . 2 .]" 1
156 1 27 ASP QB 1 29 LYS H 1.800 . 5.000 3.272 2.877 4.007 . 0 0 "[ . 1 . 2 .]" 1
157 1 29 LYS HA 1 32 PHE QB 1.800 . 5.000 2.927 2.467 4.087 . 0 0 "[ . 1 . 2 .]" 1
158 1 27 ASP H 1 30 LYS H 1.800 . 5.000 4.971 4.734 5.126 0.126 11 0 "[ . 1 . 2 .]" 1
159 1 27 ASP QB 1 30 LYS H 1.800 . 3.500 2.504 2.347 2.810 . 0 0 "[ . 1 . 2 .]" 1
160 1 28 SER H 1 30 LYS H 1.800 . 5.000 4.438 4.288 4.617 . 0 0 "[ . 1 . 2 .]" 1
161 1 30 LYS HA 1 33 GLU QB 1.800 . 5.000 2.994 2.525 4.224 . 0 0 "[ . 1 . 2 .]" 1
162 1 31 LEU H 1 31 LEU QD 1.800 . 3.500 2.915 1.837 3.678 0.178 9 0 "[ . 1 . 2 .]" 1
163 1 30 LYS H 1 31 LEU H 1.800 . 2.900 2.703 2.594 2.850 . 0 0 "[ . 1 . 2 .]" 1
164 1 27 ASP QB 1 31 LEU QD 1.800 . 5.000 4.206 3.060 4.985 . 0 0 "[ . 1 . 2 .]" 1
165 1 31 LEU H 1 33 GLU H 1.800 . 5.000 4.321 4.102 4.734 . 0 0 "[ . 1 . 2 .]" 1
166 1 25 GLU QB 1 31 LEU QD 1.800 . 3.300 2.429 1.838 3.036 . 0 0 "[ . 1 . 2 .]" 1
167 1 25 GLU QG 1 31 LEU QD 1.800 . 5.000 3.689 1.891 4.670 . 0 0 "[ . 1 . 2 .]" 1
168 1 31 LEU QD 1 113 ALA MB 1.800 . 2.700 2.159 1.854 2.749 0.049 16 0 "[ . 1 . 2 .]" 1
169 1 31 LEU QD 1 116 VAL QG 1.800 . 5.000 2.500 1.950 3.087 . 0 0 "[ . 1 . 2 .]" 1
170 1 31 LEU QD 1 171 LEU QD 1.800 . 3.300 3.018 2.379 3.385 0.085 7 0 "[ . 1 . 2 .]" 1
171 1 25 GLU HA 1 31 LEU QD 1.800 . 5.000 4.529 3.648 5.022 0.022 23 0 "[ . 1 . 2 .]" 1
172 1 31 LEU HA 1 32 PHE H 1.800 . 3.500 3.553 3.535 3.575 0.075 21 0 "[ . 1 . 2 .]" 1
173 1 31 LEU QD 1 32 PHE H 1.800 . 4.000 3.879 3.437 4.105 0.105 3 0 "[ . 1 . 2 .]" 1
174 1 29 LYS HA 1 32 PHE H 1.800 . 5.000 3.693 3.459 4.122 . 0 0 "[ . 1 . 2 .]" 1
175 1 30 LYS H 1 32 PHE H 1.800 . 5.000 4.226 4.013 4.629 . 0 0 "[ . 1 . 2 .]" 1
176 1 32 PHE HA 1 35 ILE HB 1.800 . 3.300 2.871 2.242 3.352 0.052 3 0 "[ . 1 . 2 .]" 1
177 1 32 PHE H 1 32 PHE QE 1.800 . 5.000 4.399 3.659 5.126 0.126 1 0 "[ . 1 . 2 .]" 1
178 1 32 PHE H 1 102 TYR QE 1.800 . 5.000 4.633 4.105 5.119 0.119 21 0 "[ . 1 . 2 .]" 1
179 1 33 GLU H 1 33 GLU HA 1.800 . 2.900 2.860 2.839 2.884 . 0 0 "[ . 1 . 2 .]" 1
180 1 32 PHE H 1 33 GLU H 1.800 . 2.900 2.772 2.577 2.924 0.024 23 0 "[ . 1 . 2 .]" 1
181 1 30 LYS HA 1 33 GLU H 1.800 . 5.000 3.645 3.361 3.921 . 0 0 "[ . 1 . 2 .]" 1
182 1 34 MET H 1 34 MET QG 1.800 . 5.000 4.055 3.928 4.088 . 0 0 "[ . 1 . 2 .]" 1
183 1 33 GLU H 1 34 MET H 1.800 . 2.900 2.623 2.541 2.706 . 0 0 "[ . 1 . 2 .]" 1
184 1 33 GLU HA 1 34 MET H 1.800 . 3.300 3.499 3.479 3.516 0.216 15 0 "[ . 1 . 2 .]" 1
185 1 31 LEU QD 1 34 MET H 1.800 . 5.000 4.780 4.196 5.123 0.123 21 0 "[ . 1 . 2 .]" 1
186 1 32 PHE H 1 34 MET H 1.800 . 5.000 4.009 3.882 4.117 . 0 0 "[ . 1 . 2 .]" 1
187 1 34 MET ME 1 37 LEU QD 1.800 . 5.000 4.321 2.836 5.135 0.135 16 0 "[ . 1 . 2 .]" 1
188 1 34 MET ME 1 168 ALA MB 1.800 . 3.300 2.172 1.934 2.790 . 0 0 "[ . 1 . 2 .]" 1
189 1 35 ILE H 1 35 ILE MG 1.800 . 5.000 2.866 2.063 3.759 . 0 0 "[ . 1 . 2 .]" 1
190 1 35 ILE H 1 35 ILE HB 1.800 . 2.900 2.349 2.084 2.631 . 0 0 "[ . 1 . 2 .]" 1
191 1 34 MET H 1 35 ILE H 1.800 . 3.500 2.832 2.729 2.957 . 0 0 "[ . 1 . 2 .]" 1
192 1 34 MET QB 1 35 ILE H 1.800 . 3.500 2.396 2.294 2.545 . 0 0 "[ . 1 . 2 .]" 1
193 1 32 PHE HA 1 35 ILE MG 1.800 . 5.000 3.410 2.249 4.711 . 0 0 "[ . 1 . 2 .]" 1
194 1 32 PHE HA 1 35 ILE H 1.800 . 5.000 3.730 3.488 4.310 . 0 0 "[ . 1 . 2 .]" 1
195 1 33 GLU HA 1 35 ILE H 1.800 . 5.000 4.595 4.282 4.986 . 0 0 "[ . 1 . 2 .]" 1
196 1 33 GLU H 1 35 ILE H 1.800 . 5.000 4.543 4.299 4.710 . 0 0 "[ . 1 . 2 .]" 1
197 1 35 ILE H 1 37 LEU H 1.800 . 5.000 4.397 3.963 4.619 . 0 0 "[ . 1 . 2 .]" 1
198 1 35 ILE MG 1 112 PHE HZ 1.800 . 5.000 3.979 3.084 4.937 . 0 0 "[ . 1 . 2 .]" 1
199 1 32 PHE QD 1 35 ILE MG 1.800 . 5.000 3.555 2.491 4.773 . 0 0 "[ . 1 . 2 .]" 1
200 1 35 ILE MD 1 112 PHE HZ 1.800 . 5.000 3.089 2.322 3.786 . 0 0 "[ . 1 . 2 .]" 1
201 1 32 PHE QD 1 35 ILE MD 1.800 . 5.000 4.792 3.591 5.241 0.241 9 0 "[ . 1 . 2 .]" 1
202 1 35 ILE MD 1 145 LEU QD 1.800 . 5.000 3.261 2.804 3.597 . 0 0 "[ . 1 . 2 .]" 1
203 1 35 ILE MD 1 149 LEU QD 1.800 . 3.300 2.149 1.870 2.472 . 0 0 "[ . 1 . 2 .]" 1
204 1 35 ILE MD 1 157 VAL QG 1.800 . 3.300 3.166 2.219 3.397 0.097 4 0 "[ . 1 . 2 .]" 1
205 1 35 ILE MD 1 157 VAL HB 1.800 . 5.000 4.446 3.460 4.972 . 0 0 "[ . 1 . 2 .]" 1
206 1 35 ILE MD 1 161 ILE MG 1.800 . 3.300 2.628 2.091 3.248 . 0 0 "[ . 1 . 2 .]" 1
207 1 35 ILE H 1 36 CYS H 1.800 . 2.900 2.709 2.576 2.828 . 0 0 "[ . 1 . 2 .]" 1
208 1 35 ILE HB 1 36 CYS H 1.800 . 3.500 2.172 1.820 2.592 . 0 0 "[ . 1 . 2 .]" 1
209 1 35 ILE MD 1 36 CYS H 1.800 . 5.000 4.730 4.250 4.999 . 0 0 "[ . 1 . 2 .]" 1
210 1 33 GLU HA 1 36 CYS H 1.800 . 5.000 3.501 3.257 3.854 . 0 0 "[ . 1 . 2 .]" 1
211 1 34 MET H 1 36 CYS H 1.800 . 5.000 4.154 3.992 4.387 . 0 0 "[ . 1 . 2 .]" 1
212 1 36 CYS HA 1 37 LEU H 1.800 . 3.500 3.565 3.521 3.582 0.082 11 0 "[ . 1 . 2 .]" 1
213 1 36 CYS QB 1 37 LEU H 1.800 . 3.500 2.589 2.344 3.368 . 0 0 "[ . 1 . 2 .]" 1
214 1 35 ILE MG 1 37 LEU H 1.800 . 5.000 4.510 4.222 4.944 . 0 0 "[ . 1 . 2 .]" 1
215 1 34 MET HA 1 37 LEU H 1.800 . 5.000 3.774 3.527 3.977 . 0 0 "[ . 1 . 2 .]" 1
216 1 37 LEU H 1 39 GLY H 1.800 . 5.000 4.192 3.995 4.414 . 0 0 "[ . 1 . 2 .]" 1
217 1 34 MET QG 1 37 LEU QD 1.800 . 5.000 3.165 2.188 4.484 . 0 0 "[ . 1 . 2 .]" 1
218 1 37 LEU QD 1 49 VAL QG 1.800 . 5.000 2.664 1.849 4.096 . 0 0 "[ . 1 . 2 .]" 1
219 1 37 LEU QD 1 53 ARG HA 1.800 . 5.000 2.316 1.951 3.033 . 0 0 "[ . 1 . 2 .]" 1
220 1 38 GLU H 1 38 GLU HA 1.800 . 2.700 2.829 2.795 2.869 0.169 20 0 "[ . 1 . 2 .]" 1
221 1 35 ILE HA 1 38 GLU H 1.800 . 5.000 3.578 3.233 4.144 . 0 0 "[ . 1 . 2 .]" 1
222 1 35 ILE QG 1 38 GLU H 1.800 . 5.000 4.292 3.799 4.980 . 0 0 "[ . 1 . 2 .]" 1
223 1 38 GLU H 1 49 VAL QG 1.800 . 5.000 4.122 3.435 4.773 . 0 0 "[ . 1 . 2 .]" 1
224 1 39 GLY H 1 39 GLY QA 1.800 . 2.700 2.241 2.235 2.248 . 0 0 "[ . 1 . 2 .]" 1
225 1 38 GLU H 1 39 GLY H 1.800 . 2.900 2.737 2.622 2.840 . 0 0 "[ . 1 . 2 .]" 1
226 1 39 GLY H 1 156 PHE QB 1.800 . 5.000 4.669 3.738 5.031 0.031 19 0 "[ . 1 . 2 .]" 1
227 1 39 GLY H 1 161 ILE MD 1.800 . 5.000 3.551 2.831 4.562 . 0 0 "[ . 1 . 2 .]" 1
228 1 39 GLY H 1 161 ILE QG 1.800 . 5.000 4.374 3.264 5.027 0.027 7 0 "[ . 1 . 2 .]" 1
229 1 39 GLY QA 1 161 ILE MG 1.800 . 5.000 2.923 2.174 3.675 . 0 0 "[ . 1 . 2 .]" 1
230 1 40 GLN H 1 41 GLN H 1.800 . 5.000 2.685 2.483 2.785 . 0 0 "[ . 1 . 2 .]" 1
231 1 40 GLN H 1 49 VAL QG 1.800 . 5.000 3.955 3.266 4.600 . 0 0 "[ . 1 . 2 .]" 1
232 1 41 GLN H 1 41 GLN QB 1.800 . 2.900 2.246 2.090 2.529 . 0 0 "[ . 1 . 2 .]" 1
233 1 40 GLN HA 1 41 GLN H 1.800 . 5.000 3.530 3.415 3.561 . 0 0 "[ . 1 . 2 .]" 1
234 1 41 GLN H 1 42 ALA MB 1.800 . 5.000 4.445 4.304 4.540 . 0 0 "[ . 1 . 2 .]" 1
235 1 41 GLN H 1 49 VAL QG 1.800 . 3.500 2.704 1.951 3.292 . 0 0 "[ . 1 . 2 .]" 1
236 1 41 GLN HA 1 49 VAL QG 1.800 . 3.300 2.400 1.975 2.707 . 0 0 "[ . 1 . 2 .]" 1
237 1 41 GLN QB 1 49 VAL QG 1.800 . 5.000 2.206 1.878 3.422 . 0 0 "[ . 1 . 2 .]" 1
238 1 41 GLN HA 1 44 LEU QD 1.800 . 5.000 3.444 2.868 3.953 . 0 0 "[ . 1 . 2 .]" 1
239 1 42 ALA H 1 42 ALA HA 1.800 . 2.700 2.757 2.746 2.782 0.082 23 0 "[ . 1 . 2 .]" 1
240 1 41 GLN H 1 42 ALA H 1.800 . 2.900 2.812 2.678 2.952 0.052 23 0 "[ . 1 . 2 .]" 1
241 1 41 GLN HA 1 42 ALA H 1.800 . 5.000 3.520 3.447 3.562 . 0 0 "[ . 1 . 2 .]" 1
242 1 41 GLN QB 1 42 ALA H 1.800 . 3.500 3.212 2.589 3.595 0.095 9 0 "[ . 1 . 2 .]" 1
243 1 42 ALA MB 1 43 GLY QA 1.800 . 5.000 3.803 3.731 3.846 . 0 0 "[ . 1 . 2 .]" 1
244 1 42 ALA H 1 49 VAL QG 1.800 . 5.000 4.568 4.100 4.959 . 0 0 "[ . 1 . 2 .]" 1
245 1 42 ALA MB 1 156 PHE QD 1.800 . 5.000 3.777 2.120 5.078 0.078 22 0 "[ . 1 . 2 .]" 1
246 1 42 ALA H 1 161 ILE MD 1.800 . 3.500 3.513 3.286 3.623 0.123 10 0 "[ . 1 . 2 .]" 1
247 1 42 ALA MB 1 161 ILE MD 1.800 . 3.300 2.636 2.255 3.272 . 0 0 "[ . 1 . 2 .]" 1
248 1 42 ALA HA 1 43 GLY H 1.800 . 2.700 2.196 2.182 2.208 . 0 0 "[ . 1 . 2 .]" 1
249 1 42 ALA MB 1 43 GLY H 1.800 . 3.500 3.390 3.191 3.441 . 0 0 "[ . 1 . 2 .]" 1
250 1 44 LEU H 1 44 LEU HA 1.800 . 2.900 2.973 2.914 2.990 0.090 19 0 "[ . 1 . 2 .]" 1
251 1 44 LEU H 1 44 LEU QB 1.800 . 3.500 2.492 2.205 2.741 . 0 0 "[ . 1 . 2 .]" 1
252 1 44 LEU H 1 44 LEU HG 1.800 . 3.500 3.008 2.300 3.743 0.243 3 0 "[ . 1 . 2 .]" 1
253 1 44 LEU H 1 44 LEU QD 1.800 . 2.900 2.806 1.919 3.112 0.212 1 0 "[ . 1 . 2 .]" 1
254 1 43 GLY H 1 44 LEU H 1.800 . 2.900 2.794 2.476 3.016 0.116 3 0 "[ . 1 . 2 .]" 1
255 1 43 GLY QA 1 44 LEU H 1.800 . 3.500 2.838 2.755 2.955 . 0 0 "[ . 1 . 2 .]" 1
256 1 41 GLN HA 1 44 LEU H 1.800 . 5.000 3.439 3.257 3.663 . 0 0 "[ . 1 . 2 .]" 1
257 1 41 GLN QB 1 44 LEU H 1.800 . 5.000 4.477 3.940 4.829 . 0 0 "[ . 1 . 2 .]" 1
258 1 41 GLN QG 1 44 LEU H 1.800 . 5.000 4.198 3.385 5.160 0.160 19 0 "[ . 1 . 2 .]" 1
259 1 44 LEU QD 1 48 THR MG 1.800 . 5.000 2.224 1.871 2.752 . 0 0 "[ . 1 . 2 .]" 1
260 1 44 LEU QD 1 49 VAL QG 1.800 . 5.000 3.550 2.770 4.201 . 0 0 "[ . 1 . 2 .]" 1
261 1 44 LEU QD 1 86 ILE MD 1.800 . 5.000 2.026 1.750 2.750 0.050 16 0 "[ . 1 . 2 .]" 1
262 1 44 LEU QD 1 86 ILE QG 1.800 . 5.000 2.992 2.355 3.559 . 0 0 "[ . 1 . 2 .]" 1
263 1 45 SER H 1 45 SER QB 1.800 . 3.500 2.547 2.279 3.133 . 0 0 "[ . 1 . 2 .]" 1
264 1 44 LEU H 1 45 SER H 1.800 . 5.000 4.419 4.053 4.588 . 0 0 "[ . 1 . 2 .]" 1
265 1 44 LEU QB 1 45 SER H 1.800 . 2.900 2.221 1.698 2.860 0.102 24 0 "[ . 1 . 2 .]" 1
266 1 44 LEU HG 1 45 SER H 1.800 . 5.000 4.455 4.077 5.104 0.104 5 0 "[ . 1 . 2 .]" 1
267 1 44 LEU QD 1 45 SER H 1.800 . 3.500 3.291 2.797 3.527 0.027 16 0 "[ . 1 . 2 .]" 1
268 1 40 GLN QB 1 45 SER H 1.800 . 5.000 5.101 4.995 5.203 0.203 10 0 "[ . 1 . 2 .]" 1
269 1 45 SER QB 1 47 ILE MG 1.800 . 5.000 2.403 2.104 3.388 . 0 0 "[ . 1 . 2 .]" 1
270 1 45 SER QB 1 47 ILE H 1.800 . 5.000 2.973 2.492 3.466 . 0 0 "[ . 1 . 2 .]" 1
271 1 45 SER H 1 48 THR MG 1.800 . 5.000 4.054 3.333 5.056 0.056 21 0 "[ . 1 . 2 .]" 1
272 1 45 SER HA 1 46 TRP H 1.800 . 2.900 2.352 2.295 2.463 . 0 0 "[ . 1 . 2 .]" 1
273 1 45 SER QB 1 46 TRP H 1.800 . 3.500 2.949 2.456 3.526 0.026 25 0 "[ . 1 . 2 .]" 1
274 1 46 TRP H 1 47 ILE MG 1.800 . 5.000 4.314 3.757 4.696 . 0 0 "[ . 1 . 2 .]" 1
275 1 41 GLN QB 1 46 TRP H 1.800 . 5.000 4.455 3.540 5.166 0.166 17 0 "[ . 1 . 2 .]" 1
276 1 47 ILE H 1 47 ILE HB 1.800 . 2.900 2.354 2.126 2.643 . 0 0 "[ . 1 . 2 .]" 1
277 1 47 ILE H 1 47 ILE MG 1.800 . 2.900 2.420 1.823 2.841 . 0 0 "[ . 1 . 2 .]" 1
278 1 46 TRP H 1 47 ILE H 1.800 . 3.500 2.808 2.686 2.962 . 0 0 "[ . 1 . 2 .]" 1
279 1 46 TRP QB 1 47 ILE H 1.800 . 3.500 2.887 2.410 3.576 0.076 25 0 "[ . 1 . 2 .]" 1
280 1 47 ILE MG 1 48 THR HA 1.800 . 5.000 3.053 2.919 3.439 . 0 0 "[ . 1 . 2 .]" 1
281 1 47 ILE HA 1 50 LEU QB 1.800 . 5.000 3.342 2.798 3.835 . 0 0 "[ . 1 . 2 .]" 1
282 1 47 ILE MD 1 51 LYS QE 1.800 . 5.000 3.614 2.056 5.058 0.058 1 0 "[ . 1 . 2 .]" 1
283 1 47 ILE MG 1 51 LYS QE 1.800 . 5.000 4.319 3.211 5.054 0.054 9 0 "[ . 1 . 2 .]" 1
284 1 12 LEU QB 1 47 ILE MD 1.800 . 5.000 2.490 2.008 3.291 . 0 0 "[ . 1 . 2 .]" 1
285 1 48 THR H 1 48 THR HB 1.800 . 2.900 2.525 2.408 2.604 . 0 0 "[ . 1 . 2 .]" 1
286 1 48 THR H 1 48 THR MG 1.800 . 3.500 3.740 3.730 3.754 0.254 8 0 "[ . 1 . 2 .]" 1
287 1 47 ILE H 1 48 THR H 1.800 . 2.900 2.774 2.480 2.925 0.025 15 0 "[ . 1 . 2 .]" 1
288 1 47 ILE HB 1 48 THR H 1.800 . 5.000 3.766 3.477 4.116 . 0 0 "[ . 1 . 2 .]" 1
289 1 47 ILE MG 1 48 THR H 1.800 . 2.900 1.866 1.748 2.375 0.052 18 0 "[ . 1 . 2 .]" 1
290 1 47 ILE MG 1 48 THR MG 1.800 . 5.000 4.085 3.945 4.418 . 0 0 "[ . 1 . 2 .]" 1
291 1 48 THR H 1 49 VAL QG 1.800 . 5.000 4.038 3.758 4.294 . 0 0 "[ . 1 . 2 .]" 1
292 1 44 LEU QD 1 48 THR H 1.800 . 5.000 5.043 4.903 5.148 0.148 11 0 "[ . 1 . 2 .]" 1
293 1 44 LEU QD 1 48 THR HB 1.800 . 5.000 3.185 2.972 3.405 . 0 0 "[ . 1 . 2 .]" 1
294 1 45 SER H 1 48 THR H 1.800 . 5.000 3.843 3.484 4.260 . 0 0 "[ . 1 . 2 .]" 1
295 1 48 THR HA 1 51 LYS QD 1.800 . 5.000 3.481 2.232 4.770 . 0 0 "[ . 1 . 2 .]" 1
296 1 48 THR MG 1 86 ILE MD 1.800 . 3.300 2.961 1.994 3.380 0.080 11 0 "[ . 1 . 2 .]" 1
297 1 49 VAL H 1 49 VAL HB 1.800 . 2.900 2.484 2.439 2.572 . 0 0 "[ . 1 . 2 .]" 1
298 1 49 VAL H 1 49 VAL QG 1.800 . 3.500 2.214 1.948 2.390 . 0 0 "[ . 1 . 2 .]" 1
299 1 48 THR H 1 49 VAL H 1.800 . 2.900 2.623 2.504 2.786 . 0 0 "[ . 1 . 2 .]" 1
300 1 48 THR HA 1 49 VAL H 1.800 . 5.000 3.536 3.519 3.555 . 0 0 "[ . 1 . 2 .]" 1
301 1 48 THR HB 1 49 VAL H 1.800 . 2.900 2.620 2.541 2.714 . 0 0 "[ . 1 . 2 .]" 1
302 1 48 THR MG 1 49 VAL H 1.800 . 3.500 3.549 3.484 3.612 0.112 7 0 "[ . 1 . 2 .]" 1
303 1 49 VAL H 1 50 LEU H 1.800 . 2.900 2.784 2.694 2.888 . 0 0 "[ . 1 . 2 .]" 1
304 1 47 ILE MG 1 49 VAL H 1.800 . 5.000 4.100 3.975 4.440 . 0 0 "[ . 1 . 2 .]" 1
305 1 37 LEU HA 1 49 VAL QG 1.800 . 5.000 3.922 3.217 4.456 . 0 0 "[ . 1 . 2 .]" 1
306 1 37 LEU MD1 1 49 VAL QG 1.800 . 5.000 3.340 2.054 4.771 . 0 0 "[ . 1 . 2 .]" 1
307 1 37 LEU MD2 1 49 VAL QG 1.800 . 5.000 3.196 1.871 4.579 . 0 0 "[ . 1 . 2 .]" 1
308 1 50 LEU H 1 50 LEU HA 1.800 . 2.900 2.831 2.812 2.858 . 0 0 "[ . 1 . 2 .]" 1
309 1 50 LEU H 1 50 LEU HG 1.800 . 3.500 2.160 1.885 3.763 0.263 15 0 "[ . 1 . 2 .]" 1
310 1 49 VAL HB 1 50 LEU H 1.800 . 2.900 2.648 2.414 2.836 . 0 0 "[ . 1 . 2 .]" 1
311 1 47 ILE HA 1 50 LEU H 1.800 . 5.000 3.558 2.892 3.877 . 0 0 "[ . 1 . 2 .]" 1
312 1 47 ILE MD 1 50 LEU H 1.800 . 5.000 4.561 3.823 5.247 0.247 8 0 "[ . 1 . 2 .]" 1
313 1 47 ILE MD 1 50 LEU QB 1.800 . 5.000 3.289 2.707 3.679 . 0 0 "[ . 1 . 2 .]" 1
314 1 47 ILE MD 1 50 LEU QD 1.800 . 5.000 2.835 2.101 4.051 . 0 0 "[ . 1 . 2 .]" 1
315 1 48 THR H 1 50 LEU H 1.800 . 5.000 4.316 4.146 4.506 . 0 0 "[ . 1 . 2 .]" 1
316 1 50 LEU H 1 52 LYS H 1.800 . 5.000 4.250 4.011 4.659 . 0 0 "[ . 1 . 2 .]" 1
317 1 50 LEU QD 1 53 ARG QB 1.800 . 5.000 3.261 3.008 3.668 . 0 0 "[ . 1 . 2 .]" 1
318 1 12 LEU QD 1 50 LEU MD1 1.800 . 5.000 2.990 1.935 4.737 . 0 0 "[ . 1 . 2 .]" 1
319 1 12 LEU QD 1 50 LEU MD2 1.800 . 5.000 4.217 3.430 4.680 . 0 0 "[ . 1 . 2 .]" 1
320 1 12 LEU HG 1 50 LEU QD 1.800 . 5.000 3.599 2.798 4.952 . 0 0 "[ . 1 . 2 .]" 1
321 1 16 TYR QB 1 50 LEU QD 1.800 . 5.000 2.425 2.102 2.964 . 0 0 "[ . 1 . 2 .]" 1
322 1 21 TRP HD1 1 50 LEU QD 1.800 . 5.000 5.073 4.871 5.410 0.410 15 0 "[ . 1 . 2 .]" 1
323 1 51 LYS H 1 51 LYS QB 1.800 . 2.900 2.448 2.251 2.699 . 0 0 "[ . 1 . 2 .]" 1
324 1 50 LEU HA 1 51 LYS H 1.800 . 5.000 3.591 3.560 3.614 . 0 0 "[ . 1 . 2 .]" 1
325 1 50 LEU QB 1 51 LYS H 1.800 . 3.500 2.384 2.261 2.591 . 0 0 "[ . 1 . 2 .]" 1
326 1 47 ILE MD 1 51 LYS H 1.800 . 5.000 4.360 3.168 5.071 0.071 17 0 "[ . 1 . 2 .]" 1
327 1 49 VAL H 1 51 LYS H 1.800 . 5.000 4.565 4.246 4.779 . 0 0 "[ . 1 . 2 .]" 1
328 1 12 LEU QD 1 51 LYS H 1.800 . 5.000 3.456 2.817 3.732 . 0 0 "[ . 1 . 2 .]" 1
329 1 12 LEU QD 1 51 LYS HA 1.800 . 3.300 3.395 3.260 3.531 0.231 20 0 "[ . 1 . 2 .]" 1
330 1 51 LYS H 1 52 LYS H 1.800 . 2.900 2.726 2.644 2.853 . 0 0 "[ . 1 . 2 .]" 1
331 1 51 LYS HA 1 52 LYS H 1.800 . 5.000 3.558 3.527 3.590 . 0 0 "[ . 1 . 2 .]" 1
332 1 49 VAL HA 1 52 LYS H 1.800 . 5.000 3.495 3.168 3.803 . 0 0 "[ . 1 . 2 .]" 1
333 1 49 VAL QG 1 52 LYS H 1.800 . 5.000 4.312 3.980 4.607 . 0 0 "[ . 1 . 2 .]" 1
334 1 53 ARG H 1 53 ARG QB 1.800 . 2.900 2.280 2.256 2.299 . 0 0 "[ . 1 . 2 .]" 1
335 1 52 LYS H 1 53 ARG H 1.800 . 2.900 2.604 2.482 2.679 . 0 0 "[ . 1 . 2 .]" 1
336 1 53 ARG H 1 54 GLU H 1.800 . 3.500 2.832 2.757 2.917 . 0 0 "[ . 1 . 2 .]" 1
337 1 49 VAL HA 1 53 ARG H 1.800 . 5.000 3.819 3.546 4.173 . 0 0 "[ . 1 . 2 .]" 1
338 1 49 VAL QG 1 53 ARG H 1.800 . 5.000 3.573 3.312 3.791 . 0 0 "[ . 1 . 2 .]" 1
339 1 50 LEU HA 1 53 ARG H 1.800 . 3.500 3.298 3.014 3.548 0.048 22 0 "[ . 1 . 2 .]" 1
340 1 50 LEU QD 1 53 ARG H 1.800 . 5.000 4.592 4.371 4.827 . 0 0 "[ . 1 . 2 .]" 1
341 1 51 LYS HA 1 53 ARG H 1.800 . 5.000 4.190 4.011 4.342 . 0 0 "[ . 1 . 2 .]" 1
342 1 51 LYS H 1 53 ARG H 1.800 . 5.000 3.877 3.760 3.994 . 0 0 "[ . 1 . 2 .]" 1
343 1 37 LEU QD 1 53 ARG H 1.800 . 5.000 3.833 2.990 4.789 . 0 0 "[ . 1 . 2 .]" 1
344 1 37 LEU QD 1 53 ARG HE 1.800 . 5.000 3.683 1.992 5.019 0.019 24 0 "[ . 1 . 2 .]" 1
345 1 37 LEU QD 1 53 ARG H 1.800 . 5.000 3.829 2.991 4.794 . 0 0 "[ . 1 . 2 .]" 1
346 1 50 LEU QD 1 53 ARG HE 1.800 . 5.000 4.017 2.789 5.097 0.097 20 0 "[ . 1 . 2 .]" 1
347 1 54 GLU H 1 54 GLU HA 1.800 . 2.900 2.889 2.870 2.905 0.005 15 0 "[ . 1 . 2 .]" 1
348 1 54 GLU H 1 54 GLU QB 1.800 . 2.900 2.394 2.281 2.697 . 0 0 "[ . 1 . 2 .]" 1
349 1 53 ARG HA 1 54 GLU H 1.800 . 5.000 3.570 3.548 3.594 . 0 0 "[ . 1 . 2 .]" 1
350 1 53 ARG QB 1 54 GLU H 1.800 . 3.500 2.480 2.333 2.580 . 0 0 "[ . 1 . 2 .]" 1
351 1 52 LYS H 1 54 GLU H 1.800 . 5.000 4.431 4.323 4.579 . 0 0 "[ . 1 . 2 .]" 1
352 1 54 GLU H 1 56 TYR H 1.800 . 5.000 4.023 3.930 4.188 . 0 0 "[ . 1 . 2 .]" 1
353 1 37 LEU QD 1 54 GLU H 1.800 . 5.000 4.772 4.430 5.023 0.023 23 0 "[ . 1 . 2 .]" 1
354 1 55 ASN H 1 55 ASN HA 1.800 . 2.900 2.874 2.858 2.887 . 0 0 "[ . 1 . 2 .]" 1
355 1 55 ASN H 1 55 ASN QB 1.800 . 2.900 2.391 2.230 2.528 . 0 0 "[ . 1 . 2 .]" 1
356 1 54 GLU H 1 55 ASN H 1.800 . 2.900 2.635 2.584 2.665 . 0 0 "[ . 1 . 2 .]" 1
357 1 54 GLU QB 1 55 ASN H 1.800 . 3.500 2.571 2.435 3.369 . 0 0 "[ . 1 . 2 .]" 1
358 1 52 LYS HA 1 55 ASN H 1.800 . 5.000 3.060 2.815 3.273 . 0 0 "[ . 1 . 2 .]" 1
359 1 53 ARG HA 1 55 ASN H 1.800 . 5.000 4.588 4.324 4.822 . 0 0 "[ . 1 . 2 .]" 1
360 1 55 ASN HA 1 58 ALA MB 1.800 . 3.300 2.586 2.254 2.968 . 0 0 "[ . 1 . 2 .]" 1
361 1 37 LEU QD 1 55 ASN H 1.800 . 5.000 4.342 3.974 4.725 . 0 0 "[ . 1 . 2 .]" 1
362 1 55 ASN QB 1 85 ILE MG 1.800 . 5.000 2.174 1.904 2.878 . 0 0 "[ . 1 . 2 .]" 1
363 1 56 TYR H 1 56 TYR HA 1.800 . 2.900 2.831 2.818 2.859 . 0 0 "[ . 1 . 2 .]" 1
364 1 56 TYR H 1 56 TYR QD 1.800 . 4.000 3.871 2.127 4.184 0.184 17 0 "[ . 1 . 2 .]" 1
365 1 55 ASN H 1 56 TYR H 1.800 . 2.900 2.640 2.575 2.717 . 0 0 "[ . 1 . 2 .]" 1
366 1 55 ASN HA 1 56 TYR H 1.800 . 5.000 3.545 3.524 3.575 . 0 0 "[ . 1 . 2 .]" 1
367 1 55 ASN QB 1 56 TYR H 1.800 . 3.500 2.580 2.438 2.671 . 0 0 "[ . 1 . 2 .]" 1
368 1 56 TYR HA 1 59 CYS QB 1.800 . 5.000 3.512 2.821 4.333 . 0 0 "[ . 1 . 2 .]" 1
369 1 56 TYR QE 1 60 PHE QD 1.800 . 5.000 3.364 2.738 4.690 . 0 0 "[ . 1 . 2 .]" 1
370 1 56 TYR QE 1 60 PHE QE 1.800 . 5.000 3.099 2.373 4.338 . 0 0 "[ . 1 . 2 .]" 1
371 1 37 LEU QD 1 56 TYR H 1.800 . 3.500 3.238 2.575 3.557 0.057 4 0 "[ . 1 . 2 .]" 1
372 1 56 TYR HA 1 85 ILE MG 1.800 . 5.000 2.803 2.161 3.337 . 0 0 "[ . 1 . 2 .]" 1
373 1 56 TYR QB 1 85 ILE MG 1.800 . 5.000 3.709 2.409 4.560 . 0 0 "[ . 1 . 2 .]" 1
374 1 37 LEU QD 1 56 TYR QD 1.800 . 5.000 2.862 2.196 3.616 . 0 0 "[ . 1 . 2 .]" 1
375 1 37 LEU QD 1 56 TYR QE 1.800 . 5.000 3.428 2.575 4.354 . 0 0 "[ . 1 . 2 .]" 1
376 1 56 TYR QD 1 95 ILE MD 1.800 . 5.000 4.200 3.107 5.025 0.025 8 0 "[ . 1 . 2 .]" 1
377 1 56 TYR QE 1 95 ILE MD 1.800 . 5.000 2.815 1.982 4.090 . 0 0 "[ . 1 . 2 .]" 1
378 1 56 TYR QD 1 95 ILE QG 1.800 . 5.000 4.948 4.139 5.154 0.154 9 0 "[ . 1 . 2 .]" 1
379 1 56 TYR QE 1 95 ILE QG 1.800 . 5.000 3.349 2.683 4.854 . 0 0 "[ . 1 . 2 .]" 1
380 1 57 ARG H 1 57 ARG HE 1.800 . 5.000 4.985 3.798 5.201 0.201 3 0 "[ . 1 . 2 .]" 1
381 1 56 TYR HA 1 57 ARG H 1.800 . 5.000 3.570 3.536 3.599 . 0 0 "[ . 1 . 2 .]" 1
382 1 56 TYR QB 1 57 ARG H 1.800 . 3.500 2.505 2.381 2.681 . 0 0 "[ . 1 . 2 .]" 1
383 1 56 TYR QD 1 57 ARG H 1.800 . 5.000 3.381 2.688 4.529 . 0 0 "[ . 1 . 2 .]" 1
384 1 54 GLU HA 1 57 ARG H 1.800 . 3.500 3.555 3.476 3.644 0.144 17 0 "[ . 1 . 2 .]" 1
385 1 37 LEU QD 1 57 ARG H 1.800 . 5.000 4.200 3.584 4.713 . 0 0 "[ . 1 . 2 .]" 1
386 1 58 ALA H 1 58 ALA HA 1.800 . 2.900 2.848 2.807 2.874 . 0 0 "[ . 1 . 2 .]" 1
387 1 58 ALA H 1 58 ALA MB 1.800 . 3.500 2.143 2.046 2.255 . 0 0 "[ . 1 . 2 .]" 1
388 1 57 ARG H 1 58 ALA H 1.800 . 2.900 2.689 2.551 2.752 . 0 0 "[ . 1 . 2 .]" 1
389 1 57 ARG HA 1 58 ALA H 1.800 . 5.000 3.532 3.477 3.555 . 0 0 "[ . 1 . 2 .]" 1
390 1 55 ASN HA 1 58 ALA H 1.800 . 3.500 3.314 3.168 3.487 . 0 0 "[ . 1 . 2 .]" 1
391 1 58 ALA H 1 60 PHE H 1.800 . 5.000 4.171 3.757 4.631 . 0 0 "[ . 1 . 2 .]" 1
392 1 58 ALA MB 1 60 PHE H 1.800 . 5.000 4.544 4.169 4.995 . 0 0 "[ . 1 . 2 .]" 1
393 1 58 ALA H 1 85 ILE MG 1.800 . 5.000 5.068 5.008 5.137 0.137 13 0 "[ . 1 . 2 .]" 1
394 1 59 CYS H 1 59 CYS HA 1.800 . 2.900 2.946 2.885 2.960 0.060 18 0 "[ . 1 . 2 .]" 1
395 1 59 CYS H 1 59 CYS QB 1.800 . 2.900 2.503 2.158 2.930 0.030 12 0 "[ . 1 . 2 .]" 1
396 1 58 ALA H 1 59 CYS H 1.800 . 2.900 2.762 2.637 2.896 . 0 0 "[ . 1 . 2 .]" 1
397 1 58 ALA HA 1 59 CYS H 1.800 . 3.500 3.554 3.490 3.590 0.090 4 0 "[ . 1 . 2 .]" 1
398 1 58 ALA MB 1 59 CYS H 1.800 . 2.900 2.605 2.339 2.899 . 0 0 "[ . 1 . 2 .]" 1
399 1 57 ARG H 1 59 CYS H 1.800 . 5.000 4.376 4.030 4.705 . 0 0 "[ . 1 . 2 .]" 1
400 1 59 CYS H 1 85 ILE MG 1.800 . 5.000 4.274 3.913 4.572 . 0 0 "[ . 1 . 2 .]" 1
401 1 59 CYS H 1 79 LEU QD 1.800 . 5.000 5.114 4.835 5.321 0.321 21 0 "[ . 1 . 2 .]" 1
402 1 59 CYS HB3 1 79 LEU QD 1.800 . 5.000 2.636 2.185 4.085 . 0 0 "[ . 1 . 2 .]" 1
403 1 59 CYS HB2 1 79 LEU QD 1.800 . 5.000 3.325 2.574 3.862 . 0 0 "[ . 1 . 2 .]" 1
404 1 60 PHE H 1 60 PHE HA 1.800 . 2.900 2.953 2.870 2.993 0.093 7 0 "[ . 1 . 2 .]" 1
405 1 59 CYS H 1 60 PHE H 1.800 . 2.900 2.407 2.225 2.636 . 0 0 "[ . 1 . 2 .]" 1
406 1 59 CYS HA 1 60 PHE H 1.800 . 3.500 3.542 3.446 3.603 0.103 3 0 "[ . 1 . 2 .]" 1
407 1 56 TYR HA 1 60 PHE QD 1.800 . 5.000 2.767 2.287 3.533 . 0 0 "[ . 1 . 2 .]" 1
408 1 57 ARG HA 1 60 PHE H 1.800 . 5.000 3.467 2.884 4.038 . 0 0 "[ . 1 . 2 .]" 1
409 1 58 ALA HA 1 60 PHE H 1.800 . 5.000 4.829 4.258 5.110 0.110 23 0 "[ . 1 . 2 .]" 1
410 1 60 PHE HA 1 68 VAL QG 1.800 . 5.000 3.943 3.414 5.050 0.050 18 0 "[ . 1 . 2 .]" 1
411 1 60 PHE QD 1 68 VAL QG 1.800 . 5.000 2.638 2.192 3.429 . 0 0 "[ . 1 . 2 .]" 1
412 1 60 PHE QD 1 71 MET ME 1.800 . 5.000 3.914 2.992 4.631 . 0 0 "[ . 1 . 2 .]" 1
413 1 60 PHE QD 1 85 ILE MG 1.800 . 5.000 4.492 3.395 4.993 . 0 0 "[ . 1 . 2 .]" 1
414 1 60 PHE QD 1 85 ILE MD 1.800 . 5.000 3.660 3.019 4.318 . 0 0 "[ . 1 . 2 .]" 1
415 1 60 PHE QD 1 95 ILE MG 1.800 . 5.000 3.081 2.385 3.815 . 0 0 "[ . 1 . 2 .]" 1
416 1 60 PHE QD 1 95 ILE MD 1.800 . 5.000 4.396 3.317 5.066 0.066 22 0 "[ . 1 . 2 .]" 1
417 1 60 PHE QE 1 95 ILE MD 1.800 . 5.000 3.486 2.172 4.534 . 0 0 "[ . 1 . 2 .]" 1
418 1 61 HIS H 1 61 HIS HA 1.800 . 2.900 2.823 2.794 2.850 . 0 0 "[ . 1 . 2 .]" 1
419 1 60 PHE H 1 61 HIS H 1.800 . 2.900 2.497 2.035 2.874 . 0 0 "[ . 1 . 2 .]" 1
420 1 60 PHE HA 1 61 HIS H 1.800 . 3.500 3.497 3.003 3.610 0.110 10 0 "[ . 1 . 2 .]" 1
421 1 59 CYS H 1 61 HIS H 1.800 . 5.000 4.069 3.724 4.420 . 0 0 "[ . 1 . 2 .]" 1
422 1 61 HIS H 1 63 PHE H 1.800 . 5.000 4.227 3.976 4.460 . 0 0 "[ . 1 . 2 .]" 1
423 1 61 HIS HA 1 63 PHE H 1.800 . 5.000 4.081 3.282 4.978 . 0 0 "[ . 1 . 2 .]" 1
424 1 62 GLN H 1 62 GLN HA 1.800 . 2.900 2.856 2.808 2.946 0.046 18 0 "[ . 1 . 2 .]" 1
425 1 61 HIS H 1 62 GLN H 1.800 . 3.500 2.803 2.702 2.918 . 0 0 "[ . 1 . 2 .]" 1
426 1 61 HIS HA 1 62 GLN H 1.800 . 3.500 3.535 3.442 3.564 0.064 5 0 "[ . 1 . 2 .]" 1
427 1 60 PHE H 1 62 GLN H 1.800 . 5.000 4.178 3.552 5.067 0.067 17 0 "[ . 1 . 2 .]" 1
428 1 62 GLN H 1 64 ASP H 1.800 . 5.000 4.463 3.855 5.203 0.203 3 0 "[ . 1 . 2 .]" 1
429 1 57 ARG HA 1 62 GLN H 1.800 . 5.000 4.855 4.262 5.222 0.222 17 0 "[ . 1 . 2 .]" 1
430 1 63 PHE H 1 63 PHE HA 1.800 . 2.900 2.908 2.364 2.968 0.068 20 0 "[ . 1 . 2 .]" 1
431 1 63 PHE H 1 63 PHE QD 1.800 . 5.000 2.648 1.772 4.191 0.028 5 0 "[ . 1 . 2 .]" 1
432 1 62 GLN H 1 63 PHE H 1.800 . 3.500 2.692 2.522 2.829 . 0 0 "[ . 1 . 2 .]" 1
433 1 62 GLN QB 1 63 PHE H 1.800 . 4.000 2.816 2.357 3.675 . 0 0 "[ . 1 . 2 .]" 1
434 1 61 HIS QB 1 63 PHE H 1.800 . 5.000 4.622 4.296 4.854 . 0 0 "[ . 1 . 2 .]" 1
435 1 63 PHE H 1 68 VAL QG 1.800 . 5.000 4.582 3.880 5.044 0.044 1 0 "[ . 1 . 2 .]" 1
436 1 63 PHE HA 1 68 VAL QG 1.800 . 5.000 4.374 2.044 5.101 0.101 22 0 "[ . 1 . 2 .]" 1
437 1 64 ASP H 1 64 ASP QB 1.800 . 2.900 2.778 2.089 3.072 0.172 5 0 "[ . 1 . 2 .]" 1
438 1 63 PHE H 1 64 ASP H 1.800 . 3.500 2.893 2.309 3.588 0.088 12 0 "[ . 1 . 2 .]" 1
439 1 63 PHE HA 1 64 ASP H 1.800 . 3.500 3.054 2.486 3.527 0.027 5 0 "[ . 1 . 2 .]" 1
440 1 63 PHE QD 1 64 ASP H 1.800 . 5.000 4.562 3.438 4.919 . 0 0 "[ . 1 . 2 .]" 1
441 1 62 GLN QB 1 64 ASP H 1.800 . 5.000 4.490 2.753 5.057 0.057 24 0 "[ . 1 . 2 .]" 1
442 1 64 ASP H 1 67 LYS QB 1.800 . 5.000 4.164 2.809 5.109 0.109 11 0 "[ . 1 . 2 .]" 1
443 1 64 ASP H 1 67 LYS QD 1.800 . 5.000 4.317 2.241 5.126 0.126 13 0 "[ . 1 . 2 .]" 1
444 1 64 ASP H 1 68 VAL QG 1.800 . 5.000 4.352 2.867 5.017 0.017 10 0 "[ . 1 . 2 .]" 1
445 1 64 ASP HA 1 65 PRO QD 1.800 . 3.300 2.125 2.049 2.209 . 0 0 "[ . 1 . 2 .]" 1
446 1 65 PRO QB 1 66 VAL H 1.800 . 3.500 2.872 2.212 3.318 . 0 0 "[ . 1 . 2 .]" 1
447 1 65 PRO HA 1 68 VAL H 1.800 . 5.000 3.506 3.191 4.193 . 0 0 "[ . 1 . 2 .]" 1
448 1 65 PRO HA 1 69 ALA H 1.800 . 5.000 4.329 3.939 4.701 . 0 0 "[ . 1 . 2 .]" 1
449 1 66 VAL H 1 66 VAL HA 1.800 . 2.900 2.851 2.797 2.900 0.000 10 0 "[ . 1 . 2 .]" 1
450 1 66 VAL H 1 66 VAL HB 1.800 . 2.900 2.418 2.242 2.490 . 0 0 "[ . 1 . 2 .]" 1
451 1 65 PRO QB 1 66 VAL HA 1.800 . 5.000 3.894 3.770 4.005 . 0 0 "[ . 1 . 2 .]" 1
452 1 65 PRO QG 1 66 VAL H 1.800 . 4.000 2.765 1.900 3.744 . 0 0 "[ . 1 . 2 .]" 1
453 1 65 PRO QD 1 66 VAL H 1.800 . 5.000 2.918 2.327 3.273 . 0 0 "[ . 1 . 2 .]" 1
454 1 65 PRO QD 1 66 VAL QG 1.800 . 5.000 3.943 3.340 4.375 . 0 0 "[ . 1 . 2 .]" 1
455 1 66 VAL QG 1 67 LYS QG 1.800 . 5.000 3.388 2.020 5.043 0.043 2 0 "[ . 1 . 2 .]" 1
456 1 66 VAL QG 1 67 LYS QD 1.800 . 5.000 4.575 2.436 5.125 0.125 13 0 "[ . 1 . 2 .]" 1
457 1 66 VAL HA 1 69 ALA MB 1.800 . 5.000 3.065 2.471 3.453 . 0 0 "[ . 1 . 2 .]" 1
458 1 66 VAL QG 1 70 ALA MB 1.800 . 5.000 3.312 2.812 3.657 . 0 0 "[ . 1 . 2 .]" 1
459 1 66 VAL HA 1 103 LEU QD 1.800 . 3.300 3.022 2.373 3.353 0.053 2 0 "[ . 1 . 2 .]" 1
460 1 66 VAL H 1 103 LEU QD 1.800 . 5.000 4.637 3.737 5.096 0.096 7 0 "[ . 1 . 2 .]" 1
461 1 66 VAL QG 1 103 LEU QD 1.800 . 3.300 2.579 2.051 2.989 . 0 0 "[ . 1 . 2 .]" 1
462 1 66 VAL QG 1 103 LEU QB 1.800 . 5.000 4.636 3.935 5.040 0.040 15 0 "[ . 1 . 2 .]" 1
463 1 67 LYS H 1 67 LYS HA 1.800 . 2.900 2.865 2.841 2.892 . 0 0 "[ . 1 . 2 .]" 1
464 1 64 ASP QB 1 67 LYS H 1.800 . 3.500 2.970 2.270 3.676 0.176 5 0 "[ . 1 . 2 .]" 1
465 1 67 LYS H 1 67 LYS QG 1.800 . 4.000 2.678 1.979 4.053 0.053 10 0 "[ . 1 . 2 .]" 1
466 1 67 LYS HA 1 67 LYS QD 1.800 . 5.000 3.678 2.221 4.134 . 0 0 "[ . 1 . 2 .]" 1
467 1 66 VAL H 1 67 LYS H 1.800 . 2.900 2.755 2.569 2.869 . 0 0 "[ . 1 . 2 .]" 1
468 1 66 VAL HA 1 67 LYS H 1.800 . 3.500 3.559 3.527 3.578 0.078 11 0 "[ . 1 . 2 .]" 1
469 1 66 VAL HB 1 67 LYS H 1.800 . 3.500 2.743 2.452 3.674 0.174 1 0 "[ . 1 . 2 .]" 1
470 1 67 LYS H 1 69 ALA H 1.800 . 5.000 4.308 4.118 4.433 . 0 0 "[ . 1 . 2 .]" 1
471 1 67 LYS HA 1 70 ALA MB 1.800 . 3.300 2.586 2.262 3.109 . 0 0 "[ . 1 . 2 .]" 1
472 1 67 LYS QG 1 70 ALA MB 1.800 . 5.000 3.920 2.961 4.582 . 0 0 "[ . 1 . 2 .]" 1
473 1 68 VAL H 1 68 VAL HA 1.800 . 2.900 2.848 2.817 2.906 0.006 3 0 "[ . 1 . 2 .]" 1
474 1 67 LYS H 1 68 VAL H 1.800 . 2.900 2.682 2.569 2.911 0.011 1 0 "[ . 1 . 2 .]" 1
475 1 67 LYS HA 1 68 VAL H 1.800 . 5.000 3.550 3.517 3.616 . 0 0 "[ . 1 . 2 .]" 1
476 1 67 LYS QB 1 68 VAL H 1.800 . 3.500 2.654 2.438 2.861 . 0 0 "[ . 1 . 2 .]" 1
477 1 64 ASP QB 1 68 VAL H 1.800 . 5.000 4.358 3.143 4.799 . 0 0 "[ . 1 . 2 .]" 1
478 1 66 VAL H 1 68 VAL H 1.800 . 5.000 4.115 3.898 4.643 . 0 0 "[ . 1 . 2 .]" 1
479 1 65 PRO HA 1 68 VAL QG 1.800 . 5.000 2.331 2.105 3.437 . 0 0 "[ . 1 . 2 .]" 1
480 1 60 PHE QE 1 68 VAL QG 1.800 . 5.000 2.980 2.254 3.411 . 0 0 "[ . 1 . 2 .]" 1
481 1 68 VAL QG 1 96 ILE H 1.800 . 5.000 3.996 3.674 4.614 . 0 0 "[ . 1 . 2 .]" 1
482 1 68 VAL H 1 99 ALA MB 1.800 . 5.000 4.267 3.818 4.614 . 0 0 "[ . 1 . 2 .]" 1
483 1 68 VAL QG 1 99 ALA MB 1.800 . 3.300 1.929 1.789 2.116 0.011 25 0 "[ . 1 . 2 .]" 1
484 1 68 VAL H 1 69 ALA H 1.800 . 2.900 2.735 2.523 2.820 . 0 0 "[ . 1 . 2 .]" 1
485 1 65 PRO HA 1 69 ALA H 1.800 . 3.500 3.393 3.302 3.446 . 0 0 "[ . 1 . 2 .]" 1
486 1 68 VAL HB 1 69 ALA H 1.800 . 3.500 2.967 2.545 3.907 0.407 8 0 "[ . 1 . 2 .]" 1
487 1 68 VAL QG 1 69 ALA H 1.800 . 3.500 2.766 1.715 3.290 0.085 25 0 "[ . 1 . 2 .]" 1
488 1 66 VAL QG 1 69 ALA MB 1.800 . 5.000 3.655 3.340 3.985 . 0 0 "[ . 1 . 2 .]" 1
489 1 60 PHE HA 1 69 ALA H 1.800 . 5.000 5.152 5.074 5.213 0.213 3 0 "[ . 1 . 2 .]" 1
490 1 69 ALA HA 1 96 ILE MG 1.800 . 5.000 2.822 2.240 3.405 . 0 0 "[ . 1 . 2 .]" 1
491 1 69 ALA H 1 99 ALA MB 1.800 . 3.500 2.710 2.364 3.053 . 0 0 "[ . 1 . 2 .]" 1
492 1 69 ALA MB 1 99 ALA MB 1.800 . 3.300 2.123 1.896 2.486 . 0 0 "[ . 1 . 2 .]" 1
493 1 69 ALA MB 1 100 ARG HA 1.800 . 5.000 2.527 2.253 2.991 . 0 0 "[ . 1 . 2 .]" 1
494 1 69 ALA MB 1 100 ARG H 1.800 . 5.000 3.161 2.734 3.492 . 0 0 "[ . 1 . 2 .]" 1
495 1 69 ALA MB 1 100 ARG QB 1.800 . 5.000 3.553 2.947 4.130 . 0 0 "[ . 1 . 2 .]" 1
496 1 69 ALA H 1 103 LEU QD 1.800 . 5.000 4.636 3.711 5.068 0.068 10 0 "[ . 1 . 2 .]" 1
497 1 69 ALA MB 1 103 LEU QD 1.800 . 3.300 2.643 1.847 3.287 . 0 0 "[ . 1 . 2 .]" 1
498 1 70 ALA H 1 70 ALA HA 1.800 . 2.900 2.956 2.867 2.984 0.084 11 0 "[ . 1 . 2 .]" 1
499 1 70 ALA H 1 70 ALA MB 1.800 . 2.900 2.298 2.120 2.487 . 0 0 "[ . 1 . 2 .]" 1
500 1 69 ALA H 1 70 ALA H 1.800 . 2.900 2.478 2.373 2.564 . 0 0 "[ . 1 . 2 .]" 1
501 1 69 ALA HA 1 70 ALA H 1.800 . 5.000 3.477 3.424 3.511 . 0 0 "[ . 1 . 2 .]" 1
502 1 67 LYS HA 1 70 ALA H 1.800 . 5.000 3.234 2.958 3.617 . 0 0 "[ . 1 . 2 .]" 1
503 1 68 VAL H 1 70 ALA H 1.800 . 5.000 3.873 3.734 3.964 . 0 0 "[ . 1 . 2 .]" 1
504 1 68 VAL HA 1 70 ALA H 1.800 . 5.000 4.035 3.727 4.216 . 0 0 "[ . 1 . 2 .]" 1
505 1 70 ALA H 1 99 ALA MB 1.800 . 5.000 4.508 4.237 4.858 . 0 0 "[ . 1 . 2 .]" 1
506 1 71 MET H 1 71 MET HA 1.800 . 2.900 2.911 2.807 2.969 0.069 13 0 "[ . 1 . 2 .]" 1
507 1 71 MET H 1 71 MET ME 1.800 . 5.000 4.365 3.523 4.893 . 0 0 "[ . 1 . 2 .]" 1
508 1 71 MET HA 1 71 MET ME 1.800 . 5.000 4.204 3.886 4.636 . 0 0 "[ . 1 . 2 .]" 1
509 1 70 ALA H 1 71 MET H 1.800 . 2.900 2.553 2.329 2.681 . 0 0 "[ . 1 . 2 .]" 1
510 1 70 ALA HA 1 71 MET H 1.800 . 3.500 3.148 2.977 3.421 . 0 0 "[ . 1 . 2 .]" 1
511 1 70 ALA MB 1 71 MET H 1.800 . 3.500 3.470 3.038 3.588 0.088 8 0 "[ . 1 . 2 .]" 1
512 1 68 VAL HA 1 71 MET H 1.800 . 3.500 3.424 3.114 3.538 0.038 25 0 "[ . 1 . 2 .]" 1
513 1 68 VAL HA 1 71 MET ME 1.800 . 5.000 2.779 2.122 3.911 . 0 0 "[ . 1 . 2 .]" 1
514 1 68 VAL QG 1 71 MET H 1.800 . 5.000 4.168 3.715 4.375 . 0 0 "[ . 1 . 2 .]" 1
515 1 69 ALA H 1 71 MET H 1.800 . 5.000 4.024 3.728 4.143 . 0 0 "[ . 1 . 2 .]" 1
516 1 71 MET ME 1 75 ASP HA 1.800 . 5.000 4.852 4.153 5.121 0.121 9 0 "[ . 1 . 2 .]" 1
517 1 60 PHE H 1 71 MET ME 1.800 . 5.000 4.238 3.620 4.928 . 0 0 "[ . 1 . 2 .]" 1
518 1 60 PHE HA 1 71 MET ME 1.800 . 5.000 5.014 4.690 5.150 0.150 3 0 "[ . 1 . 2 .]" 1
519 1 63 PHE QD 1 71 MET ME 1.800 . 5.000 4.311 2.922 5.135 0.135 9 0 "[ . 1 . 2 .]" 1
520 1 71 MET ME 1 76 VAL QG 1.800 . 5.000 3.167 2.444 3.859 . 0 0 "[ . 1 . 2 .]" 1
521 1 71 MET ME 1 79 LEU QD 1.800 . 3.300 2.618 1.961 3.348 0.048 1 0 "[ . 1 . 2 .]" 1
522 1 71 MET H 1 96 ILE MD 1.800 . 5.000 4.622 3.701 5.051 0.051 13 0 "[ . 1 . 2 .]" 1
523 1 71 MET H 1 96 ILE MG 1.800 . 5.000 3.577 2.696 4.694 . 0 0 "[ . 1 . 2 .]" 1
524 1 71 MET ME 1 96 ILE MD 1.800 . 5.000 2.745 1.914 3.928 . 0 0 "[ . 1 . 2 .]" 1
525 1 71 MET ME 1 96 ILE H 1.800 . 5.000 5.037 4.954 5.131 0.131 1 0 "[ . 1 . 2 .]" 1
526 1 72 GLN H 1 72 GLN QB 1.800 . 2.900 2.492 2.368 2.897 . 0 0 "[ . 1 . 2 .]" 1
527 1 71 MET H 1 72 GLN H 1.800 . 5.000 4.634 4.579 4.695 . 0 0 "[ . 1 . 2 .]" 1
528 1 71 MET HA 1 72 GLN H 1.800 . 2.900 2.397 2.217 2.622 . 0 0 "[ . 1 . 2 .]" 1
529 1 71 MET ME 1 72 GLN H 1.800 . 5.000 4.377 3.865 4.752 . 0 0 "[ . 1 . 2 .]" 1
530 1 71 MET QG 1 72 GLN H 1.800 . 3.500 2.987 1.753 3.765 0.265 2 0 "[ . 1 . 2 .]" 1
531 1 73 GLU H 1 73 GLU HA 1.800 . 2.900 2.837 2.816 2.859 . 0 0 "[ . 1 . 2 .]" 1
532 1 73 GLU H 1 73 GLU QB 1.800 . 2.900 2.453 2.265 2.504 . 0 0 "[ . 1 . 2 .]" 1
533 1 72 GLN H 1 73 GLU H 1.800 . 5.000 4.555 4.491 4.602 . 0 0 "[ . 1 . 2 .]" 1
534 1 72 GLN HA 1 73 GLU H 1.800 . 2.900 2.412 2.325 2.543 . 0 0 "[ . 1 . 2 .]" 1
535 1 72 GLN QB 1 73 GLU H 1.800 . 2.900 2.634 2.224 3.154 0.254 7 0 "[ . 1 . 2 .]" 1
536 1 73 GLU H 1 75 ASP H 1.800 . 5.000 4.295 4.164 4.488 . 0 0 "[ . 1 . 2 .]" 1
537 1 73 GLU H 1 76 VAL QG 1.800 . 5.000 4.579 4.257 4.997 . 0 0 "[ . 1 . 2 .]" 1
538 1 73 GLU HA 1 76 VAL QG 1.800 . 3.300 2.399 2.137 2.848 . 0 0 "[ . 1 . 2 .]" 1
539 1 73 GLU QG 1 76 VAL QG 1.800 . 5.000 3.699 2.490 4.224 . 0 0 "[ . 1 . 2 .]" 1
540 1 73 GLU QG 1 96 ILE MG 1.800 . 5.000 4.993 4.603 5.089 0.089 25 0 "[ . 1 . 2 .]" 1
541 1 74 GLU H 1 74 GLU HA 1.800 . 2.900 2.846 2.807 2.901 0.001 20 0 "[ . 1 . 2 .]" 1
542 1 72 GLN H 1 74 GLU H 1.800 . 5.000 4.809 4.424 4.997 . 0 0 "[ . 1 . 2 .]" 1
543 1 72 GLN HA 1 74 GLU H 1.800 . 5.000 4.202 4.036 4.335 . 0 0 "[ . 1 . 2 .]" 1
544 1 72 GLN QB 1 74 GLU H 1.800 . 5.000 2.619 2.283 2.949 . 0 0 "[ . 1 . 2 .]" 1
545 1 74 GLU HA 1 77 GLU QB 1.800 . 5.000 2.976 2.714 3.195 . 0 0 "[ . 1 . 2 .]" 1
546 1 74 GLU HA 1 77 GLU QG 1.800 . 5.000 3.861 2.700 5.044 0.044 17 0 "[ . 1 . 2 .]" 1
547 1 75 ASP H 1 75 ASP QB 1.800 . 2.900 2.373 2.197 2.442 . 0 0 "[ . 1 . 2 .]" 1
548 1 74 GLU H 1 75 ASP H 1.800 . 2.900 2.692 2.485 2.803 . 0 0 "[ . 1 . 2 .]" 1
549 1 74 GLU HA 1 75 ASP H 1.800 . 3.500 3.537 3.493 3.556 0.056 17 0 "[ . 1 . 2 .]" 1
550 1 75 ASP H 1 76 VAL QG 1.800 . 5.000 4.062 3.461 4.297 . 0 0 "[ . 1 . 2 .]" 1
551 1 71 MET ME 1 75 ASP QB 1.800 . 5.000 2.564 1.933 3.003 . 0 0 "[ . 1 . 2 .]" 1
552 1 72 GLN H 1 75 ASP H 1.800 . 3.500 3.512 3.160 3.687 0.187 17 0 "[ . 1 . 2 .]" 1
553 1 75 ASP H 1 77 GLU H 1.800 . 5.000 4.268 4.139 4.439 . 0 0 "[ . 1 . 2 .]" 1
554 1 76 VAL H 1 76 VAL HB 1.800 . 3.500 2.650 2.422 3.612 0.112 20 0 "[ . 1 . 2 .]" 1
555 1 75 ASP HA 1 76 VAL H 1.800 . 5.000 3.552 3.535 3.602 . 0 0 "[ . 1 . 2 .]" 1
556 1 75 ASP QB 1 76 VAL H 1.800 . 3.500 2.584 2.457 2.635 . 0 0 "[ . 1 . 2 .]" 1
557 1 73 GLU HA 1 76 VAL H 1.800 . 3.500 3.256 3.079 3.534 0.034 1 0 "[ . 1 . 2 .]" 1
558 1 73 GLU HA 1 76 VAL HB 1.800 . 5.000 3.427 2.875 5.100 0.100 20 0 "[ . 1 . 2 .]" 1
559 1 74 GLU H 1 76 VAL H 1.800 . 5.000 4.239 4.125 4.442 . 0 0 "[ . 1 . 2 .]" 1
560 1 76 VAL HA 1 79 LEU QD 1.800 . 5.000 3.042 2.406 3.599 . 0 0 "[ . 1 . 2 .]" 1
561 1 76 VAL HA 1 80 VAL QG 1.800 . 5.000 4.098 3.519 5.063 0.063 6 0 "[ . 1 . 2 .]" 1
562 1 76 VAL QG 1 89 ARG HA 1.800 . 5.000 2.977 2.002 4.288 . 0 0 "[ . 1 . 2 .]" 1
563 1 76 VAL QG 1 89 ARG QG 1.800 . 5.000 3.122 2.041 4.359 . 0 0 "[ . 1 . 2 .]" 1
564 1 76 VAL QG 1 89 ARG QD 1.800 . 5.000 3.969 2.378 5.049 0.049 24 0 "[ . 1 . 2 .]" 1
565 1 76 VAL H 1 92 ILE MG 1.800 . 5.000 4.554 4.085 4.964 . 0 0 "[ . 1 . 2 .]" 1
566 1 76 VAL QG 1 92 ILE HB 1.800 . 5.000 2.490 2.078 3.183 . 0 0 "[ . 1 . 2 .]" 1
567 1 76 VAL QG 1 93 GLN QB 1.800 . 5.000 3.566 2.713 4.173 . 0 0 "[ . 1 . 2 .]" 1
568 1 76 VAL MG1 1 93 GLN QG 1.800 . 5.000 3.745 2.195 5.027 0.027 18 0 "[ . 1 . 2 .]" 1
569 1 76 VAL MG2 1 93 GLN QG 1.800 . 5.000 3.649 2.178 4.860 . 0 0 "[ . 1 . 2 .]" 1
570 1 76 VAL H 1 96 ILE MD 1.800 . 5.000 4.233 3.281 5.031 0.031 22 0 "[ . 1 . 2 .]" 1
571 1 76 VAL QG 1 96 ILE MD 1.800 . 3.300 2.076 1.823 2.738 . 0 0 "[ . 1 . 2 .]" 1
572 1 76 VAL QG 1 93 GLN HA 1.800 . 5.000 3.026 2.360 3.343 . 0 0 "[ . 1 . 2 .]" 1
573 1 77 GLU H 1 77 GLU HA 1.800 . 2.900 2.852 2.824 2.877 . 0 0 "[ . 1 . 2 .]" 1
574 1 77 GLU H 1 77 GLU QB 1.800 . 2.900 2.374 2.256 2.513 . 0 0 "[ . 1 . 2 .]" 1
575 1 77 GLU H 1 77 GLU QG 1.800 . 4.000 2.960 2.052 4.070 0.070 13 0 "[ . 1 . 2 .]" 1
576 1 76 VAL H 1 77 GLU H 1.800 . 2.900 2.728 2.633 2.847 . 0 0 "[ . 1 . 2 .]" 1
577 1 76 VAL HA 1 77 GLU H 1.800 . 5.000 3.559 3.522 3.595 . 0 0 "[ . 1 . 2 .]" 1
578 1 76 VAL HB 1 77 GLU H 1.800 . 3.500 2.772 2.507 3.896 0.396 6 0 "[ . 1 . 2 .]" 1
579 1 76 VAL QG 1 77 GLU H 1.800 . 3.500 2.956 1.751 3.254 0.049 10 0 "[ . 1 . 2 .]" 1
580 1 74 GLU HA 1 77 GLU H 1.800 . 3.500 3.387 3.228 3.638 0.138 20 0 "[ . 1 . 2 .]" 1
581 1 77 GLU HA 1 80 VAL H 1.800 . 5.000 3.401 3.188 3.688 . 0 0 "[ . 1 . 2 .]" 1
582 1 77 GLU HA 1 80 VAL QG 1.800 . 5.000 2.438 2.197 3.040 . 0 0 "[ . 1 . 2 .]" 1
583 1 77 GLU QB 1 80 VAL QG 1.800 . 5.000 3.964 3.463 4.523 . 0 0 "[ . 1 . 2 .]" 1
584 1 77 GLU QG 1 80 VAL QG 1.800 . 5.000 3.635 2.876 4.216 . 0 0 "[ . 1 . 2 .]" 1
585 1 78 ARG H 1 78 ARG HA 1.800 . 2.900 2.859 2.839 2.882 . 0 0 "[ . 1 . 2 .]" 1
586 1 78 ARG H 1 78 ARG QB 1.800 . 2.900 2.283 2.054 2.459 . 0 0 "[ . 1 . 2 .]" 1
587 1 78 ARG H 1 78 ARG QG 1.800 . 4.000 3.663 2.155 3.990 . 0 0 "[ . 1 . 2 .]" 1
588 1 78 ARG H 1 78 ARG QD 1.800 . 5.000 4.526 3.829 4.853 . 0 0 "[ . 1 . 2 .]" 1
589 1 77 GLU H 1 78 ARG H 1.800 . 2.900 2.694 2.604 2.816 . 0 0 "[ . 1 . 2 .]" 1
590 1 77 GLU HA 1 78 ARG H 1.800 . 3.500 3.543 3.522 3.576 0.076 25 0 "[ . 1 . 2 .]" 1
591 1 77 GLU QG 1 78 ARG H 1.800 . 5.000 3.973 3.661 4.584 . 0 0 "[ . 1 . 2 .]" 1
592 1 78 ARG HE 1 79 LEU QD 1.800 . 5.000 4.428 2.784 5.088 0.088 21 0 "[ . 1 . 2 .]" 1
593 1 75 ASP HA 1 78 ARG H 1.800 . 3.500 3.389 3.192 3.531 0.031 10 0 "[ . 1 . 2 .]" 1
594 1 76 VAL H 1 78 ARG H 1.800 . 5.000 4.145 3.968 4.364 . 0 0 "[ . 1 . 2 .]" 1
595 1 79 LEU H 1 79 LEU QB 1.800 . 2.900 2.388 2.175 2.548 . 0 0 "[ . 1 . 2 .]" 1
596 1 79 LEU H 1 79 LEU HG 1.800 . 2.900 2.391 2.055 2.997 0.097 20 0 "[ . 1 . 2 .]" 1
597 1 78 ARG H 1 79 LEU H 1.800 . 2.900 2.731 2.633 2.800 . 0 0 "[ . 1 . 2 .]" 1
598 1 78 ARG HA 1 79 LEU H 1.800 . 3.500 3.563 3.546 3.581 0.081 21 0 "[ . 1 . 2 .]" 1
599 1 78 ARG QB 1 79 LEU H 1.800 . 3.500 2.487 2.371 2.877 . 0 0 "[ . 1 . 2 .]" 1
600 1 75 ASP HA 1 79 LEU QD 1.800 . 5.000 4.707 4.165 5.160 0.160 1 0 "[ . 1 . 2 .]" 1
601 1 75 ASP QB 1 79 LEU QD 1.800 . 5.000 3.731 2.835 4.487 . 0 0 "[ . 1 . 2 .]" 1
602 1 76 VAL HA 1 79 LEU H 1.800 . 5.000 3.484 3.276 3.688 . 0 0 "[ . 1 . 2 .]" 1
603 1 76 VAL QG 1 79 LEU QD 1.800 . 5.000 3.516 3.037 4.084 . 0 0 "[ . 1 . 2 .]" 1
604 1 77 GLU H 1 79 LEU H 1.800 . 5.000 4.339 4.167 4.571 . 0 0 "[ . 1 . 2 .]" 1
605 1 79 LEU HA 1 82 ASP QB 1.800 . 5.000 3.170 2.020 4.548 . 0 0 "[ . 1 . 2 .]" 1
606 1 79 LEU QD 1 82 ASP QB 1.800 . 5.000 3.341 2.492 4.528 . 0 0 "[ . 1 . 2 .]" 1
607 1 60 PHE QE 1 79 LEU QD 1.800 . 5.000 2.866 2.166 3.474 . 0 0 "[ . 1 . 2 .]" 1
608 1 79 LEU QD 1 85 ILE QG 1.800 . 5.000 4.408 3.579 5.022 0.022 25 0 "[ . 1 . 2 .]" 1
609 1 79 LEU QD 1 92 ILE MG 1.800 . 5.000 2.596 2.106 2.955 . 0 0 "[ . 1 . 2 .]" 1
610 1 79 LEU QD 1 92 ILE MD 1.800 . 5.000 2.918 2.341 3.769 . 0 0 "[ . 1 . 2 .]" 1
611 1 68 VAL QG 1 79 LEU H 1.800 . 5.000 4.707 4.383 5.088 0.088 21 0 "[ . 1 . 2 .]" 1
612 1 80 VAL H 1 80 VAL HB 1.800 . 2.900 2.432 2.156 2.514 . 0 0 "[ . 1 . 2 .]" 1
613 1 80 VAL H 1 80 VAL QG 1.800 . 2.900 2.304 2.132 2.794 . 0 0 "[ . 1 . 2 .]" 1
614 1 79 LEU H 1 80 VAL H 1.800 . 3.500 2.601 2.477 2.752 . 0 0 "[ . 1 . 2 .]" 1
615 1 79 LEU HA 1 80 VAL H 1.800 . 3.500 3.516 3.449 3.551 0.051 24 0 "[ . 1 . 2 .]" 1
616 1 79 LEU QB 1 80 VAL H 1.800 . 4.000 2.858 2.554 3.647 . 0 0 "[ . 1 . 2 .]" 1
617 1 79 LEU HG 1 80 VAL H 1.800 . 5.000 4.185 2.368 4.704 . 0 0 "[ . 1 . 2 .]" 1
618 1 79 LEU QD 1 80 VAL H 1.800 . 5.000 4.067 3.197 4.300 . 0 0 "[ . 1 . 2 .]" 1
619 1 80 VAL QG 1 81 GLN HA 1.800 . 5.000 3.379 2.856 3.596 . 0 0 "[ . 1 . 2 .]" 1
620 1 78 ARG H 1 80 VAL H 1.800 . 5.000 4.010 3.828 4.218 . 0 0 "[ . 1 . 2 .]" 1
621 1 80 VAL H 1 82 ASP H 1.800 . 5.000 4.364 3.843 4.710 . 0 0 "[ . 1 . 2 .]" 1
622 1 80 VAL QG 1 88 HIS HA 1.800 . 5.000 4.464 3.595 5.094 0.094 22 0 "[ . 1 . 2 .]" 1
623 1 80 VAL QG 1 89 ARG HA 1.800 . 5.000 2.701 2.197 3.411 . 0 0 "[ . 1 . 2 .]" 1
624 1 80 VAL QG 1 89 ARG QB 1.800 . 5.000 2.597 2.130 3.706 . 0 0 "[ . 1 . 2 .]" 1
625 1 80 VAL QG 1 89 ARG QD 1.800 . 5.000 3.493 2.403 4.498 . 0 0 "[ . 1 . 2 .]" 1
626 1 81 GLN H 1 81 GLN HA 1.800 . 2.900 2.918 2.799 2.979 0.079 4 0 "[ . 1 . 2 .]" 1
627 1 81 GLN H 1 81 GLN QB 1.800 . 3.500 2.373 2.159 2.509 . 0 0 "[ . 1 . 2 .]" 1
628 1 81 GLN H 1 81 GLN QG 1.800 . 4.000 3.073 2.098 4.058 0.058 19 0 "[ . 1 . 2 .]" 1
629 1 80 VAL H 1 81 GLN H 1.800 . 2.900 2.753 2.612 2.849 . 0 0 "[ . 1 . 2 .]" 1
630 1 80 VAL HA 1 81 GLN HA 1.800 . 5.000 4.718 4.584 4.934 . 0 0 "[ . 1 . 2 .]" 1
631 1 80 VAL HB 1 81 GLN H 1.800 . 3.500 2.842 2.649 3.649 0.149 21 0 "[ . 1 . 2 .]" 1
632 1 80 VAL QG 1 81 GLN H 1.800 . 3.500 3.062 1.829 3.299 . 0 0 "[ . 1 . 2 .]" 1
633 1 80 VAL QG 1 81 GLN QG 1.800 . 5.000 3.677 2.098 5.024 0.024 19 0 "[ . 1 . 2 .]" 1
634 1 81 GLN H 1 82 ASP QB 1.800 . 5.000 4.615 4.012 5.086 0.086 11 0 "[ . 1 . 2 .]" 1
635 1 79 LEU H 1 81 GLN H 1.800 . 5.000 4.281 4.040 4.539 . 0 0 "[ . 1 . 2 .]" 1
636 1 79 LEU HA 1 81 GLN H 1.800 . 5.000 3.972 3.581 4.146 . 0 0 "[ . 1 . 2 .]" 1
637 1 79 LEU QD 1 81 GLN H 1.800 . 5.000 5.043 4.205 5.220 0.220 3 0 "[ . 1 . 2 .]" 1
638 1 82 ASP H 1 82 ASP QB 1.800 . 2.900 2.403 2.253 2.692 . 0 0 "[ . 1 . 2 .]" 1
639 1 81 GLN H 1 82 ASP H 1.800 . 2.900 2.607 2.145 2.936 0.036 18 0 "[ . 1 . 2 .]" 1
640 1 82 ASP HA 1 83 ALA MB 1.800 . 5.000 4.051 3.861 4.192 . 0 0 "[ . 1 . 2 .]" 1
641 1 79 LEU HA 1 82 ASP H 1.800 . 3.500 3.252 2.845 3.558 0.058 18 0 "[ . 1 . 2 .]" 1
642 1 79 LEU QB 1 82 ASP H 1.800 . 5.000 4.756 4.246 5.099 0.099 24 0 "[ . 1 . 2 .]" 1
643 1 79 LEU QD 1 82 ASP H 1.800 . 5.000 4.310 3.506 4.700 . 0 0 "[ . 1 . 2 .]" 1
644 1 80 VAL QG 1 82 ASP H 1.800 . 5.000 4.660 4.011 5.018 0.018 5 0 "[ . 1 . 2 .]" 1
645 1 83 ALA H 1 83 ALA HA 1.800 . 2.900 2.660 2.334 2.985 0.085 1 0 "[ . 1 . 2 .]" 1
646 1 83 ALA H 1 83 ALA MB 1.800 . 2.900 2.768 2.022 3.065 0.165 4 0 "[ . 1 . 2 .]" 1
647 1 82 ASP H 1 83 ALA H 1.800 . 5.000 4.491 4.275 4.652 . 0 0 "[ . 1 . 2 .]" 1
648 1 82 ASP HA 1 83 ALA H 1.800 . 2.700 2.259 2.169 2.471 . 0 0 "[ . 1 . 2 .]" 1
649 1 82 ASP QB 1 83 ALA H 1.800 . 4.000 3.344 2.339 3.960 . 0 0 "[ . 1 . 2 .]" 1
650 1 83 ALA HA 1 84 GLY H 1.800 . 3.500 3.066 2.284 3.579 0.079 24 0 "[ . 1 . 2 .]" 1
651 1 79 LEU QD 1 83 ALA MB 1.800 . 5.000 3.769 2.139 5.164 0.164 2 0 "[ . 1 . 2 .]" 1
652 1 84 GLY H 1 84 GLY QA 1.800 . 2.700 2.266 2.238 2.530 . 0 0 "[ . 1 . 2 .]" 1
653 1 83 ALA H 1 84 GLY H 1.800 . 2.900 2.871 2.272 3.087 0.187 17 0 "[ . 1 . 2 .]" 1
654 1 83 ALA MB 1 84 GLY H 1.800 . 3.500 3.010 1.904 3.692 0.192 16 0 "[ . 1 . 2 .]" 1
655 1 84 GLY H 1 85 ILE MD 1.800 . 6.000 5.272 3.242 5.809 . 0 0 "[ . 1 . 2 .]" 1
656 1 84 GLY H 1 85 ILE QG 1.800 . 6.000 3.986 3.128 4.583 . 0 0 "[ . 1 . 2 .]" 1
657 1 82 ASP HA 1 84 GLY H 1.800 . 5.000 4.340 3.347 5.054 0.054 25 0 "[ . 1 . 2 .]" 1
658 1 85 ILE H 1 85 ILE MG 1.800 . 3.500 2.554 2.028 3.457 . 0 0 "[ . 1 . 2 .]" 1
659 1 85 ILE H 1 85 ILE MD 1.800 . 5.000 3.660 1.805 4.347 . 0 0 "[ . 1 . 2 .]" 1
660 1 84 GLY H 1 85 ILE H 1.800 . 2.900 2.670 1.732 3.088 0.188 17 0 "[ . 1 . 2 .]" 1
661 1 84 GLY QA 1 85 ILE H 1.800 . 3.500 2.847 2.672 2.976 . 0 0 "[ . 1 . 2 .]" 1
662 1 83 ALA H 1 85 ILE H 1.800 . 5.000 4.853 4.175 5.160 0.160 4 0 "[ . 1 . 2 .]" 1
663 1 58 ALA MB 1 85 ILE MG 1.800 . 5.000 4.247 3.754 4.664 . 0 0 "[ . 1 . 2 .]" 1
664 1 60 PHE QE 1 85 ILE MG 1.800 . 5.000 4.073 3.036 4.895 . 0 0 "[ . 1 . 2 .]" 1
665 1 79 LEU QD 1 85 ILE MG 1.800 . 5.000 4.752 3.976 5.055 0.055 22 0 "[ . 1 . 2 .]" 1
666 1 79 LEU MD1 1 85 ILE MD 1.800 . 5.000 3.991 3.036 4.637 . 0 0 "[ . 1 . 2 .]" 1
667 1 79 LEU MD2 1 85 ILE MD 1.800 . 5.000 4.126 3.016 5.105 0.105 21 0 "[ . 1 . 2 .]" 1
668 1 85 ILE MD 1 92 ILE QG 1.800 . 5.000 3.679 2.899 4.541 . 0 0 "[ . 1 . 2 .]" 1
669 1 85 ILE MD 1 92 ILE MG 1.800 . 5.000 4.710 3.319 5.144 0.144 2 0 "[ . 1 . 2 .]" 1
670 1 85 ILE HA 1 86 ILE H 1.800 . 3.500 2.686 2.184 3.465 . 0 0 "[ . 1 . 2 .]" 1
671 1 85 ILE MG 1 86 ILE H 1.800 . 5.000 3.773 3.216 4.383 . 0 0 "[ . 1 . 2 .]" 1
672 1 40 GLN HA 1 86 ILE MD 1.800 . 5.000 4.314 2.758 5.048 0.048 8 0 "[ . 1 . 2 .]" 1
673 1 41 GLN HA 1 86 ILE MD 1.800 . 5.000 4.892 4.178 5.118 0.118 24 0 "[ . 1 . 2 .]" 1
674 1 44 LEU QD 1 86 ILE MG 1.800 . 5.000 3.086 2.159 4.663 . 0 0 "[ . 1 . 2 .]" 1
675 1 49 VAL MG1 1 86 ILE MD 1.800 . 5.000 4.918 4.106 5.053 0.053 15 0 "[ . 1 . 2 .]" 1
676 1 86 ILE H 1 87 ARG H 1.800 . 5.000 4.386 2.714 4.715 . 0 0 "[ . 1 . 2 .]" 1
677 1 86 ILE HA 1 87 ARG H 1.800 . 2.900 2.462 2.164 3.364 0.464 20 0 "[ . 1 . 2 .]" 1
678 1 86 ILE MD 1 87 ARG H 1.800 . 5.000 4.673 3.276 5.338 0.338 16 0 "[ . 1 . 2 .]" 1
679 1 86 ILE MG 1 87 ARG H 1.800 . 5.000 2.525 1.772 4.038 0.028 17 0 "[ . 1 . 2 .]" 1
680 1 88 HIS H 1 88 HIS QB 1.800 . 3.500 2.944 2.304 3.491 . 0 0 "[ . 1 . 2 .]" 1
681 1 87 ARG H 1 88 HIS H 1.800 . 5.000 4.538 4.346 4.709 . 0 0 "[ . 1 . 2 .]" 1
682 1 87 ARG HA 1 88 HIS H 1.800 . 2.900 2.238 2.169 2.339 . 0 0 "[ . 1 . 2 .]" 1
683 1 86 ILE MG 1 88 HIS QB 1.800 . 5.000 3.634 2.568 5.053 0.053 12 0 "[ . 1 . 2 .]" 1
684 1 86 ILE MG 1 88 HIS H 1.800 . 5.000 4.631 4.014 5.025 0.025 20 0 "[ . 1 . 2 .]" 1
685 1 88 HIS H 1 92 ILE MD 1.800 . 5.000 3.759 2.741 5.123 0.123 25 0 "[ . 1 . 2 .]" 1
686 1 88 HIS H 1 92 ILE QG 1.800 . 5.000 3.802 2.337 4.966 . 0 0 "[ . 1 . 2 .]" 1
687 1 89 ARG H 1 89 ARG QB 1.800 . 2.900 2.558 2.259 2.991 0.091 15 0 "[ . 1 . 2 .]" 1
688 1 88 HIS H 1 89 ARG H 1.800 . 5.000 3.238 1.591 4.526 0.209 10 0 "[ . 1 . 2 .]" 1
689 1 88 HIS HA 1 89 ARG H 1.800 . 2.900 2.576 2.229 3.393 0.493 10 0 "[ . 1 . 2 .]" 1
690 1 88 HIS QB 1 89 ARG H 1.800 . 5.000 3.400 1.942 3.952 . 0 0 "[ . 1 . 2 .]" 1
691 1 80 VAL QG 1 89 ARG H 1.800 . 3.500 3.114 2.323 3.555 0.055 24 0 "[ . 1 . 2 .]" 1
692 1 80 VAL QG 1 89 ARG QG 1.800 . 5.000 2.917 1.920 4.145 . 0 0 "[ . 1 . 2 .]" 1
693 1 89 ARG H 1 90 GLY H 1.800 . 4.000 3.180 2.723 4.052 0.052 25 0 "[ . 1 . 2 .]" 1
694 1 89 ARG HA 1 90 GLY H 1.800 . 5.000 3.544 3.501 3.590 . 0 0 "[ . 1 . 2 .]" 1
695 1 89 ARG QD 1 90 GLY H 1.800 . 5.000 4.259 2.489 5.153 0.153 13 0 "[ . 1 . 2 .]" 1
696 1 88 HIS HA 1 90 GLY H 1.800 . 5.000 3.992 3.393 4.711 . 0 0 "[ . 1 . 2 .]" 1
697 1 88 HIS H 1 90 GLY H 1.800 . 5.000 4.840 4.239 5.149 0.149 5 0 "[ . 1 . 2 .]" 1
698 1 80 VAL QG 1 90 GLY H 1.800 . 5.000 4.962 4.696 5.140 0.140 23 0 "[ . 1 . 2 .]" 1
699 1 90 GLY H 1 91 LYS H 1.800 . 2.900 2.749 2.518 2.874 . 0 0 "[ . 1 . 2 .]" 1
700 1 88 HIS H 1 91 LYS H 1.800 . 5.000 4.535 2.955 5.185 0.185 23 0 "[ . 1 . 2 .]" 1
701 1 91 LYS HA 1 94 ALA MB 1.800 . 3.300 2.620 2.251 2.872 . 0 0 "[ . 1 . 2 .]" 1
702 1 92 ILE H 1 92 ILE HB 1.800 . 3.500 2.567 2.441 2.665 . 0 0 "[ . 1 . 2 .]" 1
703 1 92 ILE H 1 92 ILE MD 1.800 . 3.500 3.445 3.260 3.561 0.061 12 0 "[ . 1 . 2 .]" 1
704 1 92 ILE H 1 92 ILE MG 1.800 . 5.000 3.776 3.763 3.795 . 0 0 "[ . 1 . 2 .]" 1
705 1 92 ILE HA 1 92 ILE MG 1.800 . 3.300 2.346 2.267 2.457 . 0 0 "[ . 1 . 2 .]" 1
706 1 91 LYS H 1 92 ILE H 1.800 . 2.900 2.736 2.598 2.814 . 0 0 "[ . 1 . 2 .]" 1
707 1 91 LYS HA 1 92 ILE H 1.800 . 5.000 3.573 3.552 3.614 . 0 0 "[ . 1 . 2 .]" 1
708 1 92 ILE H 1 93 GLN H 1.800 . 2.900 2.754 2.657 2.882 . 0 0 "[ . 1 . 2 .]" 1
709 1 88 HIS H 1 92 ILE H 1.800 . 5.000 4.556 2.943 5.262 0.262 12 0 "[ . 1 . 2 .]" 1
710 1 89 ARG HA 1 92 ILE H 1.800 . 5.000 3.732 3.302 4.406 . 0 0 "[ . 1 . 2 .]" 1
711 1 89 ARG HA 1 92 ILE MG 1.800 . 5.000 4.305 3.827 4.908 . 0 0 "[ . 1 . 2 .]" 1
712 1 89 ARG HA 1 92 ILE MD 1.800 . 5.000 2.613 2.175 4.029 . 0 0 "[ . 1 . 2 .]" 1
713 1 90 GLY H 1 92 ILE H 1.800 . 5.000 4.238 3.974 4.444 . 0 0 "[ . 1 . 2 .]" 1
714 1 60 PHE QE 1 92 ILE MG 1.800 . 5.000 3.021 2.378 3.803 . 0 0 "[ . 1 . 2 .]" 1
715 1 60 PHE HZ 1 92 ILE MG 1.800 . 5.000 2.789 2.247 3.558 . 0 0 "[ . 1 . 2 .]" 1
716 1 76 VAL HA 1 92 ILE MG 1.800 . 3.300 2.561 2.204 2.909 . 0 0 "[ . 1 . 2 .]" 1
717 1 76 VAL MG1 1 92 ILE MG 1.800 . 5.000 2.285 1.852 2.819 . 0 0 "[ . 1 . 2 .]" 1
718 1 76 VAL MG2 1 92 ILE MG 1.800 . 5.000 2.334 1.865 3.548 . 0 0 "[ . 1 . 2 .]" 1
719 1 79 LEU QB 1 92 ILE MD 1.800 . 5.000 2.558 1.961 4.795 . 0 0 "[ . 1 . 2 .]" 1
720 1 79 LEU MD1 1 92 ILE MD 1.800 . 5.000 2.997 2.363 3.912 . 0 0 "[ . 1 . 2 .]" 1
721 1 79 LEU MD2 1 92 ILE MD 1.800 . 5.000 4.134 2.667 4.924 . 0 0 "[ . 1 . 2 .]" 1
722 1 80 VAL HA 1 92 ILE MD 1.800 . 3.300 2.995 2.442 3.365 0.065 24 0 "[ . 1 . 2 .]" 1
723 1 80 VAL HB 1 92 ILE MD 1.800 . 5.000 4.338 3.157 4.989 . 0 0 "[ . 1 . 2 .]" 1
724 1 80 VAL QG 1 92 ILE MD 1.800 . 3.300 2.251 1.898 2.723 . 0 0 "[ . 1 . 2 .]" 1
725 1 93 GLN H 1 93 GLN HA 1.800 . 2.900 2.841 2.827 2.856 . 0 0 "[ . 1 . 2 .]" 1
726 1 93 GLN H 1 93 GLN QB 1.800 . 3.500 2.344 2.253 2.493 . 0 0 "[ . 1 . 2 .]" 1
727 1 93 GLN H 1 93 GLN QG 1.800 . 5.000 3.181 2.009 4.075 . 0 0 "[ . 1 . 2 .]" 1
728 1 92 ILE HA 1 93 GLN H 1.800 . 5.000 3.559 3.539 3.581 . 0 0 "[ . 1 . 2 .]" 1
729 1 92 ILE HB 1 93 GLN H 1.800 . 3.500 2.580 2.385 2.748 . 0 0 "[ . 1 . 2 .]" 1
730 1 92 ILE MG 1 93 GLN H 1.800 . 5.000 3.454 3.227 3.598 . 0 0 "[ . 1 . 2 .]" 1
731 1 89 ARG HA 1 93 GLN H 1.800 . 5.000 4.230 3.650 5.062 0.062 24 0 "[ . 1 . 2 .]" 1
732 1 90 GLY H 1 93 GLN H 1.800 . 5.000 4.849 4.626 5.082 0.082 24 0 "[ . 1 . 2 .]" 1
733 1 91 LYS H 1 93 GLN H 1.800 . 5.000 4.216 4.079 4.452 . 0 0 "[ . 1 . 2 .]" 1
734 1 93 GLN H 1 95 ILE H 1.800 . 5.000 4.247 4.126 4.493 . 0 0 "[ . 1 . 2 .]" 1
735 1 93 GLN HA 1 96 ILE MD 1.800 . 5.000 2.675 2.215 4.388 . 0 0 "[ . 1 . 2 .]" 1
736 1 93 GLN HA 1 96 ILE HB 1.800 . 5.000 3.131 2.704 3.480 . 0 0 "[ . 1 . 2 .]" 1
737 1 76 VAL QG 1 93 GLN H 1.800 . 3.500 3.383 2.878 3.588 0.088 6 0 "[ . 1 . 2 .]" 1
738 1 94 ALA H 1 94 ALA HA 1.800 . 2.900 2.857 2.834 2.888 . 0 0 "[ . 1 . 2 .]" 1
739 1 94 ALA H 1 94 ALA MB 1.800 . 2.900 2.142 2.045 2.254 . 0 0 "[ . 1 . 2 .]" 1
740 1 93 GLN H 1 94 ALA H 1.800 . 2.900 2.698 2.641 2.746 . 0 0 "[ . 1 . 2 .]" 1
741 1 93 GLN HA 1 94 ALA H 1.800 . 3.500 3.535 3.524 3.544 0.044 15 0 "[ . 1 . 2 .]" 1
742 1 93 GLN QG 1 94 ALA H 1.800 . 5.000 3.928 3.744 4.147 . 0 0 "[ . 1 . 2 .]" 1
743 1 90 GLY QA 1 94 ALA H 1.800 . 5.000 4.307 3.946 4.504 . 0 0 "[ . 1 . 2 .]" 1
744 1 91 LYS HA 1 94 ALA H 1.800 . 3.500 3.332 3.112 3.546 0.046 5 0 "[ . 1 . 2 .]" 1
745 1 92 ILE H 1 94 ALA H 1.800 . 5.000 4.122 3.987 4.244 . 0 0 "[ . 1 . 2 .]" 1
746 1 94 ALA H 1 96 ILE H 1.800 . 5.000 4.321 4.195 4.452 . 0 0 "[ . 1 . 2 .]" 1
747 1 94 ALA HA 1 97 GLY H 1.800 . 5.000 3.432 3.291 3.591 . 0 0 "[ . 1 . 2 .]" 1
748 1 94 ALA MB 1 155 LYS QB 1.800 . 5.000 3.095 2.597 3.844 . 0 0 "[ . 1 . 2 .]" 1
749 1 94 ALA MB 1 155 LYS QG 1.800 . 5.000 4.223 3.556 5.010 0.010 2 0 "[ . 1 . 2 .]" 1
750 1 94 ALA MB 1 156 PHE QD 1.800 . 3.300 3.141 2.593 3.350 0.050 24 0 "[ . 1 . 2 .]" 1
751 1 94 ALA MB 1 156 PHE QE 1.800 . 5.000 2.444 2.011 3.363 . 0 0 "[ . 1 . 2 .]" 1
752 1 95 ILE H 1 95 ILE HA 1.800 . 2.900 2.845 2.829 2.860 . 0 0 "[ . 1 . 2 .]" 1
753 1 95 ILE H 1 95 ILE HB 1.800 . 2.900 2.511 2.269 2.652 . 0 0 "[ . 1 . 2 .]" 1
754 1 95 ILE H 1 95 ILE MD 1.800 . 3.500 2.868 1.744 3.503 0.056 20 0 "[ . 1 . 2 .]" 1
755 1 95 ILE H 1 95 ILE MG 1.800 . 5.000 3.758 3.686 3.781 . 0 0 "[ . 1 . 2 .]" 1
756 1 94 ALA H 1 95 ILE H 1.800 . 2.900 2.687 2.584 2.811 . 0 0 "[ . 1 . 2 .]" 1
757 1 94 ALA HA 1 95 ILE H 1.800 . 3.500 3.549 3.536 3.572 0.072 24 0 "[ . 1 . 2 .]" 1
758 1 95 ILE H 1 96 ILE H 1.800 . 2.900 2.782 2.695 2.904 0.004 9 0 "[ . 1 . 2 .]" 1
759 1 95 ILE MG 1 96 ILE HA 1.800 . 5.000 3.466 3.008 3.786 . 0 0 "[ . 1 . 2 .]" 1
760 1 92 ILE HA 1 95 ILE H 1.800 . 5.000 3.318 3.105 3.647 . 0 0 "[ . 1 . 2 .]" 1
761 1 92 ILE MG 1 95 ILE MD 1.800 . 5.000 3.684 2.354 5.077 0.077 25 0 "[ . 1 . 2 .]" 1
762 1 95 ILE HA 1 98 ASN QB 1.800 . 5.000 2.696 2.362 3.209 . 0 0 "[ . 1 . 2 .]" 1
763 1 60 PHE QE 1 95 ILE MG 1.800 . 5.000 2.701 2.156 3.965 . 0 0 "[ . 1 . 2 .]" 1
764 1 68 VAL QG 1 95 ILE MG 1.800 . 3.300 2.287 1.835 2.748 . 0 0 "[ . 1 . 2 .]" 1
765 1 96 ILE H 1 96 ILE HB 1.800 . 2.900 2.537 2.302 2.687 . 0 0 "[ . 1 . 2 .]" 1
766 1 96 ILE H 1 96 ILE MG 1.800 . 4.000 3.763 3.709 3.779 . 0 0 "[ . 1 . 2 .]" 1
767 1 96 ILE H 1 96 ILE MD 1.800 . 3.500 3.160 1.793 3.543 0.043 13 0 "[ . 1 . 2 .]" 1
768 1 95 ILE MG 1 96 ILE H 1.800 . 5.000 3.304 2.781 3.568 . 0 0 "[ . 1 . 2 .]" 1
769 1 95 ILE MD 1 96 ILE H 1.800 . 5.000 4.281 3.919 4.508 . 0 0 "[ . 1 . 2 .]" 1
770 1 92 ILE MG 1 96 ILE MD 1.800 . 5.000 2.907 2.354 3.460 . 0 0 "[ . 1 . 2 .]" 1
771 1 93 GLN HA 1 96 ILE H 1.800 . 5.000 3.461 3.250 3.798 . 0 0 "[ . 1 . 2 .]" 1
772 1 96 ILE H 1 98 ASN H 1.800 . 5.000 4.197 4.043 4.388 . 0 0 "[ . 1 . 2 .]" 1
773 1 96 ILE HA 1 99 ALA MB 1.800 . 3.300 3.001 2.643 3.256 . 0 0 "[ . 1 . 2 .]" 1
774 1 94 ALA MB 1 96 ILE MG 1.800 . 5.000 3.603 3.273 3.998 . 0 0 "[ . 1 . 2 .]" 1
775 1 68 VAL QG 1 96 ILE HA 1.800 . 5.000 2.358 2.009 3.011 . 0 0 "[ . 1 . 2 .]" 1
776 1 68 VAL QG 1 96 ILE MD 1.800 . 5.000 3.714 2.023 4.878 . 0 0 "[ . 1 . 2 .]" 1
777 1 68 VAL QG 1 96 ILE MG 1.800 . 5.000 3.371 2.724 4.036 . 0 0 "[ . 1 . 2 .]" 1
778 1 69 ALA MB 1 96 ILE MG 1.800 . 5.000 4.110 3.478 4.561 . 0 0 "[ . 1 . 2 .]" 1
779 1 79 LEU QD 1 96 ILE MD 1.800 . 5.000 4.605 3.902 5.028 0.028 25 0 "[ . 1 . 2 .]" 1
780 1 96 ILE H 1 97 GLY H 1.800 . 2.900 2.792 2.690 2.870 . 0 0 "[ . 1 . 2 .]" 1
781 1 96 ILE HB 1 97 GLY H 1.800 . 2.900 2.513 2.389 2.669 . 0 0 "[ . 1 . 2 .]" 1
782 1 96 ILE MG 1 97 GLY H 1.800 . 3.500 3.361 2.830 3.523 0.023 22 0 "[ . 1 . 2 .]" 1
783 1 96 ILE MD 1 97 GLY H 1.800 . 5.000 4.344 3.819 4.559 . 0 0 "[ . 1 . 2 .]" 1
784 1 97 GLY H 1 98 ASN H 1.800 . 2.900 2.722 2.664 2.808 . 0 0 "[ . 1 . 2 .]" 1
785 1 95 ILE H 1 97 GLY H 1.800 . 5.000 4.256 4.081 4.416 . 0 0 "[ . 1 . 2 .]" 1
786 1 98 ASN H 1 98 ASN HA 1.800 . 2.900 2.838 2.816 2.853 . 0 0 "[ . 1 . 2 .]" 1
787 1 98 ASN H 1 98 ASN QB 1.800 . 3.500 2.322 2.049 2.547 . 0 0 "[ . 1 . 2 .]" 1
788 1 97 GLY QA 1 98 ASN H 1.800 . 2.900 2.750 2.706 2.803 . 0 0 "[ . 1 . 2 .]" 1
789 1 98 ASN H 1 99 ALA H 1.800 . 2.900 2.758 2.695 2.828 . 0 0 "[ . 1 . 2 .]" 1
790 1 95 ILE HA 1 98 ASN H 1.800 . 3.500 3.419 3.244 3.552 0.052 5 0 "[ . 1 . 2 .]" 1
791 1 98 ASN H 1 100 ARG H 1.800 . 5.000 4.240 4.070 4.392 . 0 0 "[ . 1 . 2 .]" 1
792 1 98 ASN H 1 101 ALA H 1.800 . 5.000 4.821 4.626 5.004 0.004 25 0 "[ . 1 . 2 .]" 1
793 1 98 ASN HA 1 101 ALA MB 1.800 . 3.300 2.768 2.599 3.144 . 0 0 "[ . 1 . 2 .]" 1
794 1 68 VAL QG 1 98 ASN H 1.800 . 5.000 5.024 4.767 5.188 0.188 3 0 "[ . 1 . 2 .]" 1
795 1 98 ASN H 1 154 PHE QE 1.800 . 5.000 4.965 4.767 5.093 0.093 12 0 "[ . 1 . 2 .]" 1
796 1 98 ASN H 1 154 PHE HZ 1.800 . 5.000 5.040 4.350 5.298 0.298 1 0 "[ . 1 . 2 .]" 1
797 1 99 ALA H 1 99 ALA MB 1.800 . 3.500 2.218 2.082 2.263 . 0 0 "[ . 1 . 2 .]" 1
798 1 98 ASN QB 1 99 ALA H 1.800 . 5.000 2.663 2.421 3.133 . 0 0 "[ . 1 . 2 .]" 1
799 1 95 ILE MG 1 99 ALA MB 1.800 . 5.000 3.751 3.222 4.203 . 0 0 "[ . 1 . 2 .]" 1
800 1 65 PRO HA 1 99 ALA MB 1.800 . 3.300 2.766 2.188 3.104 . 0 0 "[ . 1 . 2 .]" 1
801 1 96 ILE MG 1 99 ALA MB 1.800 . 5.000 3.623 3.282 4.034 . 0 0 "[ . 1 . 2 .]" 1
802 1 97 GLY QA 1 99 ALA H 1.800 . 5.000 4.024 3.925 4.179 . 0 0 "[ . 1 . 2 .]" 1
803 1 97 GLY H 1 99 ALA H 1.800 . 5.000 4.290 4.085 4.412 . 0 0 "[ . 1 . 2 .]" 1
804 1 99 ALA HA 1 102 TYR QB 1.800 . 5.000 2.353 2.154 2.838 . 0 0 "[ . 1 . 2 .]" 1
805 1 65 PRO QG 1 99 ALA MB 1.800 . 5.000 3.808 2.971 4.267 . 0 0 "[ . 1 . 2 .]" 1
806 1 65 PRO QB 1 99 ALA MB 1.800 . 5.000 3.652 2.684 4.498 . 0 0 "[ . 1 . 2 .]" 1
807 1 66 VAL HA 1 99 ALA MB 1.800 . 5.000 4.365 3.445 4.854 . 0 0 "[ . 1 . 2 .]" 1
808 1 68 VAL HB 1 99 ALA MB 1.800 . 5.000 2.945 2.080 4.180 . 0 0 "[ . 1 . 2 .]" 1
809 1 68 VAL QG 1 99 ALA H 1.800 . 3.500 3.450 3.200 3.597 0.097 10 0 "[ . 1 . 2 .]" 1
810 1 69 ALA MB 1 99 ALA H 1.800 . 5.000 4.545 4.006 4.865 . 0 0 "[ . 1 . 2 .]" 1
811 1 69 ALA HA 1 99 ALA H 1.800 . 5.000 4.726 4.170 5.022 0.022 3 0 "[ . 1 . 2 .]" 1
812 1 69 ALA HA 1 99 ALA MB 1.800 . 5.000 2.503 2.132 2.962 . 0 0 "[ . 1 . 2 .]" 1
813 1 100 ARG H 1 100 ARG HA 1.800 . 2.900 2.852 2.834 2.865 . 0 0 "[ . 1 . 2 .]" 1
814 1 100 ARG H 1 100 ARG QD 1.800 . 5.000 4.258 3.617 4.782 . 0 0 "[ . 1 . 2 .]" 1
815 1 99 ALA H 1 100 ARG H 1.800 . 2.900 2.655 2.566 2.733 . 0 0 "[ . 1 . 2 .]" 1
816 1 99 ALA HA 1 100 ARG H 1.800 . 3.500 3.554 3.530 3.565 0.065 23 0 "[ . 1 . 2 .]" 1
817 1 99 ALA MB 1 100 ARG H 1.800 . 3.500 2.520 2.369 2.680 . 0 0 "[ . 1 . 2 .]" 1
818 1 100 ARG HA 1 103 LEU QB 1.800 . 3.300 3.082 2.842 3.342 0.042 21 0 "[ . 1 . 2 .]" 1
819 1 96 ILE MG 1 100 ARG HE 1.800 . 5.000 3.506 2.428 5.135 0.135 4 0 "[ . 1 . 2 .]" 1
820 1 97 GLY QA 1 100 ARG H 1.800 . 3.500 3.305 3.136 3.426 . 0 0 "[ . 1 . 2 .]" 1
821 1 100 ARG H 1 102 TYR H 1.800 . 5.000 4.060 3.905 4.300 . 0 0 "[ . 1 . 2 .]" 1
822 1 100 ARG HA 1 103 LEU QD 1.800 . 5.000 3.609 2.675 4.697 . 0 0 "[ . 1 . 2 .]" 1
823 1 100 ARG HA 1 103 LEU H 1.800 . 5.000 3.676 3.477 3.907 . 0 0 "[ . 1 . 2 .]" 1
824 1 69 ALA MB 1 100 ARG HE 1.800 . 5.000 4.432 3.594 5.040 0.040 15 0 "[ . 1 . 2 .]" 1
825 1 69 ALA HA 1 100 ARG HE 1.800 . 5.000 4.391 3.023 5.090 0.090 6 0 "[ . 1 . 2 .]" 1
826 1 101 ALA H 1 101 ALA HA 1.800 . 2.700 2.875 2.836 2.893 0.193 25 0 "[ . 1 . 2 .]" 1
827 1 100 ARG H 1 101 ALA H 1.800 . 2.900 2.728 2.688 2.793 . 0 0 "[ . 1 . 2 .]" 1
828 1 100 ARG HA 1 101 ALA H 1.800 . 3.500 3.560 3.544 3.585 0.085 1 0 "[ . 1 . 2 .]" 1
829 1 100 ARG QB 1 101 ALA H 1.800 . 3.500 2.504 2.446 2.557 . 0 0 "[ . 1 . 2 .]" 1
830 1 100 ARG QD 1 101 ALA H 1.800 . 5.000 4.680 4.407 5.170 0.170 22 0 "[ . 1 . 2 .]" 1
831 1 98 ASN HA 1 101 ALA H 1.800 . 3.500 3.555 3.475 3.659 0.159 1 0 "[ . 1 . 2 .]" 1
832 1 99 ALA H 1 101 ALA H 1.800 . 5.000 4.182 4.057 4.329 . 0 0 "[ . 1 . 2 .]" 1
833 1 101 ALA HA 1 104 GLN QB 1.800 . 3.300 2.742 2.454 3.197 . 0 0 "[ . 1 . 2 .]" 1
834 1 101 ALA HA 1 104 GLN QG 1.800 . 5.000 4.120 2.657 4.917 . 0 0 "[ . 1 . 2 .]" 1
835 1 69 ALA MB 1 101 ALA H 1.800 . 5.000 4.980 4.754 5.109 0.109 18 0 "[ . 1 . 2 .]" 1
836 1 101 ALA H 1 154 PHE QE 1.800 . 5.000 4.266 3.599 4.957 . 0 0 "[ . 1 . 2 .]" 1
837 1 101 ALA MB 1 154 PHE QD 1.800 . 5.000 3.147 2.504 3.728 . 0 0 "[ . 1 . 2 .]" 1
838 1 101 ALA MB 1 154 PHE HZ 1.800 . 5.000 3.311 2.290 4.142 . 0 0 "[ . 1 . 2 .]" 1
839 1 102 TYR H 1 102 TYR HA 1.800 . 2.900 2.846 2.831 2.873 . 0 0 "[ . 1 . 2 .]" 1
840 1 102 TYR H 1 102 TYR QB 1.800 . 3.500 2.234 2.106 2.256 . 0 0 "[ . 1 . 2 .]" 1
841 1 102 TYR H 1 102 TYR QD 1.800 . 4.000 4.154 4.048 4.178 0.178 9 0 "[ . 1 . 2 .]" 1
842 1 101 ALA H 1 102 TYR H 1.800 . 2.900 2.564 2.508 2.728 . 0 0 "[ . 1 . 2 .]" 1
843 1 101 ALA HA 1 102 TYR H 1.800 . 3.500 3.534 3.508 3.551 0.051 7 0 "[ . 1 . 2 .]" 1
844 1 101 ALA MB 1 102 TYR H 1.800 . 3.500 2.622 2.482 2.731 . 0 0 "[ . 1 . 2 .]" 1
845 1 102 TYR QD 1 103 LEU QD 1.800 . 3.300 2.894 2.231 3.363 0.063 4 0 "[ . 1 . 2 .]" 1
846 1 99 ALA HA 1 102 TYR H 1.800 . 5.000 3.371 3.072 3.571 . 0 0 "[ . 1 . 2 .]" 1
847 1 102 TYR HA 1 105 MET H 1.800 . 5.000 3.595 3.462 3.837 . 0 0 "[ . 1 . 2 .]" 1
848 1 28 SER QB 1 102 TYR QE 1.800 . 5.000 3.656 2.246 5.038 0.038 23 0 "[ . 1 . 2 .]" 1
849 1 26 THR HA 1 102 TYR QE 1.800 . 5.000 4.671 3.572 5.162 0.162 11 0 "[ . 1 . 2 .]" 1
850 1 29 LYS HA 1 102 TYR QE 1.800 . 5.000 4.566 3.697 5.010 0.010 11 0 "[ . 1 . 2 .]" 1
851 1 29 LYS QB 1 102 TYR QE 1.800 . 5.000 4.591 4.129 4.945 . 0 0 "[ . 1 . 2 .]" 1
852 1 32 PHE QB 1 102 TYR QE 1.800 . 5.000 2.642 2.207 3.690 . 0 0 "[ . 1 . 2 .]" 1
853 1 102 TYR H 1 154 PHE QE 1.800 . 5.000 3.504 2.985 4.291 . 0 0 "[ . 1 . 2 .]" 1
854 1 102 TYR HA 1 154 PHE QE 1.800 . 5.000 4.087 3.313 4.717 . 0 0 "[ . 1 . 2 .]" 1
855 1 102 TYR H 1 154 PHE HZ 1.800 . 5.000 3.716 3.008 4.139 . 0 0 "[ . 1 . 2 .]" 1
856 1 102 TYR HA 1 154 PHE HZ 1.800 . 5.000 4.013 2.411 4.639 . 0 0 "[ . 1 . 2 .]" 1
857 1 32 PHE QD 1 102 TYR QE 1.800 . 5.000 3.098 2.237 4.178 . 0 0 "[ . 1 . 2 .]" 1
858 1 103 LEU H 1 103 LEU QD 1.800 . 3.500 3.291 1.799 3.594 0.094 6 0 "[ . 1 . 2 .]" 1
859 1 102 TYR H 1 103 LEU H 1.800 . 2.900 2.759 2.705 2.859 . 0 0 "[ . 1 . 2 .]" 1
860 1 102 TYR QB 1 103 LEU H 1.800 . 5.000 2.435 2.257 2.510 . 0 0 "[ . 1 . 2 .]" 1
861 1 102 TYR QD 1 103 LEU H 1.800 . 5.000 3.105 2.600 3.925 . 0 0 "[ . 1 . 2 .]" 1
862 1 99 ALA HA 1 103 LEU H 1.800 . 5.000 3.815 3.374 4.346 . 0 0 "[ . 1 . 2 .]" 1
863 1 101 ALA H 1 103 LEU H 1.800 . 5.000 4.236 4.150 4.551 . 0 0 "[ . 1 . 2 .]" 1
864 1 103 LEU H 1 105 MET H 1.800 . 5.000 4.260 4.109 4.388 . 0 0 "[ . 1 . 2 .]" 1
865 1 103 LEU QD 1 107 GLN H 1.800 . 5.000 4.593 3.712 5.106 0.106 23 0 "[ . 1 . 2 .]" 1
866 1 103 LEU QD 1 107 GLN QG 1.800 . 5.000 4.370 3.262 5.122 0.122 3 0 "[ . 1 . 2 .]" 1
867 1 65 PRO QB 1 103 LEU QD 1.800 . 5.000 3.986 2.589 4.777 . 0 0 "[ . 1 . 2 .]" 1
868 1 65 PRO QG 1 103 LEU QD 1.800 . 5.000 4.751 3.684 5.096 0.096 25 0 "[ . 1 . 2 .]" 1
869 1 66 VAL MG1 1 103 LEU QD 1.800 . 5.000 3.533 2.794 4.633 . 0 0 "[ . 1 . 2 .]" 1
870 1 66 VAL MG2 1 103 LEU QD 1.800 . 5.000 2.707 2.074 3.339 . 0 0 "[ . 1 . 2 .]" 1
871 1 104 GLN H 1 104 GLN QB 1.800 . 2.900 2.319 2.241 2.470 . 0 0 "[ . 1 . 2 .]" 1
872 1 103 LEU H 1 104 GLN H 1.800 . 2.900 2.696 2.619 2.800 . 0 0 "[ . 1 . 2 .]" 1
873 1 103 LEU QB 1 104 GLN H 1.800 . 3.500 2.593 2.487 2.693 . 0 0 "[ . 1 . 2 .]" 1
874 1 103 LEU QD 1 104 GLN H 1.800 . 5.000 3.994 3.729 4.134 . 0 0 "[ . 1 . 2 .]" 1
875 1 102 TYR H 1 104 GLN H 1.800 . 5.000 4.140 4.000 4.333 . 0 0 "[ . 1 . 2 .]" 1
876 1 104 GLN H 1 106 GLU H 1.800 . 5.000 4.218 4.136 4.307 . 0 0 "[ . 1 . 2 .]" 1
877 1 104 GLN HA 1 107 GLN QB 1.800 . 3.300 2.953 2.430 3.351 0.051 21 0 "[ . 1 . 2 .]" 1
878 1 105 MET H 1 105 MET HA 1.800 . 2.900 2.862 2.848 2.891 . 0 0 "[ . 1 . 2 .]" 1
879 1 105 MET H 1 105 MET QB 1.800 . 2.900 2.294 2.253 2.397 . 0 0 "[ . 1 . 2 .]" 1
880 1 105 MET HA 1 105 MET QG 1.800 . 2.700 2.407 2.270 2.750 0.050 1 0 "[ . 1 . 2 .]" 1
881 1 105 MET QB 1 105 MET ME 1.800 . 5.000 3.162 2.091 3.559 . 0 0 "[ . 1 . 2 .]" 1
882 1 104 GLN H 1 105 MET H 1.800 . 2.900 2.746 2.670 2.815 . 0 0 "[ . 1 . 2 .]" 1
883 1 105 MET HA 1 108 ASN H 1.800 . 5.000 3.755 3.577 4.022 . 0 0 "[ . 1 . 2 .]" 1
884 1 105 MET ME 1 112 PHE HA 1.800 . 5.000 2.560 2.120 3.090 . 0 0 "[ . 1 . 2 .]" 1
885 1 105 MET ME 1 112 PHE H 1.800 . 5.000 4.159 2.747 5.005 0.005 5 0 "[ . 1 . 2 .]" 1
886 1 32 PHE QE 1 105 MET ME 1.800 . 5.000 3.241 2.063 4.043 . 0 0 "[ . 1 . 2 .]" 1
887 1 105 MET ME 1 114 ASP H 1.800 . 6.000 5.620 4.912 6.112 0.112 13 0 "[ . 1 . 2 .]" 1
888 1 105 MET ME 1 115 PHE H 1.800 . 5.000 4.100 3.594 4.603 . 0 0 "[ . 1 . 2 .]" 1
889 1 105 MET ME 1 115 PHE QB 1.800 . 5.000 2.378 1.987 2.890 . 0 0 "[ . 1 . 2 .]" 1
890 1 105 MET ME 1 115 PHE QD 1.800 . 5.000 3.151 2.626 3.892 . 0 0 "[ . 1 . 2 .]" 1
891 1 32 PHE QD 1 105 MET ME 1.800 . 5.000 3.399 2.555 4.069 . 0 0 "[ . 1 . 2 .]" 1
892 1 105 MET ME 1 116 VAL H 1.800 . 5.000 4.935 4.474 5.175 0.175 9 0 "[ . 1 . 2 .]" 1
893 1 105 MET ME 1 116 VAL QG 1.800 . 6.000 4.743 4.042 5.744 . 0 0 "[ . 1 . 2 .]" 1
894 1 105 MET ME 1 149 LEU QD 1.800 . 5.000 4.518 3.624 5.034 0.034 10 0 "[ . 1 . 2 .]" 1
895 1 105 MET ME 1 152 ARG QD 1.800 . 5.000 3.977 2.650 4.970 . 0 0 "[ . 1 . 2 .]" 1
896 1 105 MET ME 1 152 ARG HE 1.800 . 5.000 3.546 2.514 4.974 . 0 0 "[ . 1 . 2 .]" 1
897 1 106 GLU H 1 106 GLU HA 1.800 . 2.900 2.868 2.841 2.898 . 0 0 "[ . 1 . 2 .]" 1
898 1 106 GLU H 1 106 GLU QB 1.800 . 2.900 2.292 2.282 2.301 . 0 0 "[ . 1 . 2 .]" 1
899 1 105 MET H 1 106 GLU H 1.800 . 2.900 2.680 2.595 2.740 . 0 0 "[ . 1 . 2 .]" 1
900 1 105 MET HA 1 106 GLU H 1.800 . 3.500 3.550 3.538 3.561 0.061 12 0 "[ . 1 . 2 .]" 1
901 1 105 MET QB 1 106 GLU H 1.800 . 3.500 2.555 2.449 2.669 . 0 0 "[ . 1 . 2 .]" 1
902 1 105 MET ME 1 106 GLU H 1.800 . 6.000 5.574 5.037 5.994 . 0 0 "[ . 1 . 2 .]" 1
903 1 103 LEU HA 1 106 GLU H 1.800 . 3.500 3.383 3.235 3.519 0.019 7 0 "[ . 1 . 2 .]" 1
904 1 103 LEU QD 1 106 GLU H 1.800 . 5.000 4.484 3.748 4.706 . 0 0 "[ . 1 . 2 .]" 1
905 1 106 GLU H 1 108 ASN H 1.800 . 5.000 4.287 4.114 4.483 . 0 0 "[ . 1 . 2 .]" 1
906 1 107 GLN H 1 107 GLN HA 1.800 . 2.900 2.813 2.804 2.820 . 0 0 "[ . 1 . 2 .]" 1
907 1 107 GLN H 1 107 GLN QB 1.800 . 2.900 2.391 2.222 2.536 . 0 0 "[ . 1 . 2 .]" 1
908 1 106 GLU H 1 107 GLN H 1.800 . 2.900 2.628 2.515 2.684 . 0 0 "[ . 1 . 2 .]" 1
909 1 106 GLU HA 1 107 GLN H 1.800 . 3.500 3.516 3.495 3.550 0.050 9 0 "[ . 1 . 2 .]" 1
910 1 107 GLN H 1 108 ASN H 1.800 . 2.900 2.758 2.709 2.843 . 0 0 "[ . 1 . 2 .]" 1
911 1 104 GLN HA 1 107 GLN H 1.800 . 3.500 3.403 3.281 3.514 0.014 3 0 "[ . 1 . 2 .]" 1
912 1 104 GLN HA 1 107 GLN QG 1.800 . 5.000 3.237 2.154 4.906 . 0 0 "[ . 1 . 2 .]" 1
913 1 108 ASN H 1 108 ASN HA 1.800 . 2.900 2.929 2.908 2.958 0.058 20 0 "[ . 1 . 2 .]" 1
914 1 108 ASN H 1 108 ASN QB 1.800 . 2.900 2.401 2.271 2.580 . 0 0 "[ . 1 . 2 .]" 1
915 1 107 GLN HA 1 108 ASN H 1.800 . 3.500 3.517 3.460 3.541 0.041 1 0 "[ . 1 . 2 .]" 1
916 1 107 GLN QB 1 108 ASN H 1.800 . 3.500 2.726 2.632 2.943 . 0 0 "[ . 1 . 2 .]" 1
917 1 107 GLN QG 1 108 ASN H 1.800 . 5.000 4.045 3.827 4.183 . 0 0 "[ . 1 . 2 .]" 1
918 1 109 GLY H 1 109 GLY QA 1.800 . 2.700 2.266 2.241 2.313 . 0 0 "[ . 1 . 2 .]" 1
919 1 108 ASN HA 1 109 GLY H 1.800 . 3.500 3.362 3.263 3.457 . 0 0 "[ . 1 . 2 .]" 1
920 1 108 ASN QB 1 109 GLY H 1.800 . 5.000 3.290 3.040 3.904 . 0 0 "[ . 1 . 2 .]" 1
921 1 106 GLU HA 1 109 GLY H 1.800 . 3.500 3.095 2.763 3.345 . 0 0 "[ . 1 . 2 .]" 1
922 1 106 GLU QG 1 109 GLY H 1.800 . 3.500 3.640 3.584 3.725 0.225 9 0 "[ . 1 . 2 .]" 1
923 1 107 GLN H 1 109 GLY H 1.800 . 5.000 3.957 3.784 4.121 . 0 0 "[ . 1 . 2 .]" 1
924 1 110 GLU H 1 110 GLU QB 1.800 . 2.900 2.434 2.231 2.652 . 0 0 "[ . 1 . 2 .]" 1
925 1 109 GLY H 1 110 GLU H 1.800 . 2.900 2.495 2.301 2.784 . 0 0 "[ . 1 . 2 .]" 1
926 1 109 GLY QA 1 110 GLU H 1.800 . 2.900 2.834 2.701 2.930 0.030 6 0 "[ . 1 . 2 .]" 1
927 1 106 GLU HA 1 110 GLU H 1.800 . 3.500 3.082 2.627 3.387 . 0 0 "[ . 1 . 2 .]" 1
928 1 108 ASN QB 1 110 GLU H 1.800 . 5.000 3.013 2.584 3.942 . 0 0 "[ . 1 . 2 .]" 1
929 1 110 GLU HA 1 111 PRO QD 1.800 . 3.300 2.073 2.038 2.117 . 0 0 "[ . 1 . 2 .]" 1
930 1 111 PRO QB 1 112 PHE H 1.800 . 5.000 3.184 2.942 3.347 . 0 0 "[ . 1 . 2 .]" 1
931 1 111 PRO QB 1 113 ALA H 1.800 . 5.000 3.173 2.704 3.541 . 0 0 "[ . 1 . 2 .]" 1
932 1 111 PRO QB 1 114 ASP H 1.800 . 5.000 2.206 2.083 2.451 . 0 0 "[ . 1 . 2 .]" 1
933 1 111 PRO QG 1 114 ASP QB 1.800 . 3.300 3.005 2.622 3.345 0.045 1 0 "[ . 1 . 2 .]" 1
934 1 111 PRO QD 1 114 ASP QB 1.800 . 5.000 2.859 2.237 3.426 . 0 0 "[ . 1 . 2 .]" 1
935 1 112 PHE H 1 112 PHE QB 1.800 . 3.500 2.341 2.146 2.774 . 0 0 "[ . 1 . 2 .]" 1
936 1 112 PHE H 1 112 PHE QD 1.800 . 5.000 3.231 1.731 4.191 0.069 2 0 "[ . 1 . 2 .]" 1
937 1 111 PRO HA 1 112 PHE H 1.800 . 2.700 2.228 2.185 2.308 . 0 0 "[ . 1 . 2 .]" 1
938 1 111 PRO QG 1 112 PHE H 1.800 . 5.000 4.715 4.613 4.835 . 0 0 "[ . 1 . 2 .]" 1
939 1 111 PRO QD 1 112 PHE H 1.800 . 5.000 5.010 4.975 5.050 0.050 21 0 "[ . 1 . 2 .]" 1
940 1 112 PHE HA 1 115 PHE QB 1.800 . 5.000 2.659 2.194 3.164 . 0 0 "[ . 1 . 2 .]" 1
941 1 112 PHE HA 1 115 PHE H 1.800 . 5.000 3.449 2.971 3.666 . 0 0 "[ . 1 . 2 .]" 1
942 1 112 PHE HA 1 116 VAL H 1.800 . 5.000 4.252 3.396 4.797 . 0 0 "[ . 1 . 2 .]" 1
943 1 31 LEU QD 1 112 PHE QD 1.800 . 5.000 3.944 2.190 5.218 0.218 21 0 "[ . 1 . 2 .]" 1
944 1 102 TYR QE 1 112 PHE H 1.800 . 5.000 4.243 3.826 5.103 0.103 21 0 "[ . 1 . 2 .]" 1
945 1 102 TYR QD 1 112 PHE HZ 1.800 . 5.000 4.310 2.601 5.074 0.074 8 0 "[ . 1 . 2 .]" 1
946 1 105 MET ME 1 112 PHE QD 1.800 . 5.000 3.246 2.063 4.046 . 0 0 "[ . 1 . 2 .]" 1
947 1 105 MET QB 1 112 PHE QE 1.800 . 5.000 3.678 2.250 5.148 0.148 1 0 "[ . 1 . 2 .]" 1
948 1 112 PHE HZ 1 154 PHE QE 1.800 . 5.000 4.061 3.006 4.799 . 0 0 "[ . 1 . 2 .]" 1
949 1 112 PHE HZ 1 154 PHE HZ 1.800 . 5.000 4.705 2.959 5.147 0.147 1 0 "[ . 1 . 2 .]" 1
950 1 112 PHE HA 1 113 ALA H 1.800 . 3.500 3.544 3.466 3.567 0.067 11 0 "[ . 1 . 2 .]" 1
951 1 112 PHE QB 1 113 ALA H 1.800 . 3.500 2.516 2.394 3.526 0.026 1 0 "[ . 1 . 2 .]" 1
952 1 112 PHE QD 1 113 ALA H 1.800 . 3.500 3.532 2.636 3.819 0.319 9 0 "[ . 1 . 2 .]" 1
953 1 111 PRO HA 1 113 ALA H 1.800 . 5.000 4.087 3.716 4.259 . 0 0 "[ . 1 . 2 .]" 1
954 1 113 ALA HA 1 116 VAL QG 1.800 . 5.000 2.702 2.077 3.281 . 0 0 "[ . 1 . 2 .]" 1
955 1 113 ALA MB 1 116 VAL QG 1.800 . 5.000 3.741 3.205 4.251 . 0 0 "[ . 1 . 2 .]" 1
956 1 26 THR HA 1 113 ALA MB 1.800 . 5.000 3.313 2.858 3.974 . 0 0 "[ . 1 . 2 .]" 1
957 1 27 ASP HA 1 113 ALA MB 1.800 . 5.000 4.337 3.879 4.715 . 0 0 "[ . 1 . 2 .]" 1
958 1 27 ASP QB 1 113 ALA MB 1.800 . 5.000 5.001 4.677 5.172 0.172 3 0 "[ . 1 . 2 .]" 1
959 1 28 SER H 1 113 ALA H 1.800 . 6.000 5.127 4.298 6.051 0.051 11 0 "[ . 1 . 2 .]" 1
960 1 28 SER HA 1 113 ALA MB 1.800 . 3.300 2.199 1.992 2.481 . 0 0 "[ . 1 . 2 .]" 1
961 1 31 LEU QD 1 113 ALA H 1.800 . 5.000 3.852 2.694 4.756 . 0 0 "[ . 1 . 2 .]" 1
962 1 31 LEU QD 1 113 ALA HA 1.800 . 3.300 2.344 2.060 3.207 . 0 0 "[ . 1 . 2 .]" 1
963 1 32 PHE H 1 113 ALA MB 1.800 . 5.000 5.097 4.889 5.237 0.237 3 0 "[ . 1 . 2 .]" 1
964 1 112 PHE QD 1 113 ALA MB 1.800 . 5.000 2.982 2.501 3.517 . 0 0 "[ . 1 . 2 .]" 1
965 1 114 ASP H 1 114 ASP HA 1.800 . 2.900 2.862 2.828 2.892 . 0 0 "[ . 1 . 2 .]" 1
966 1 113 ALA H 1 114 ASP H 1.800 . 2.900 2.779 2.616 2.858 . 0 0 "[ . 1 . 2 .]" 1
967 1 113 ALA HA 1 114 ASP H 1.800 . 3.500 3.566 3.531 3.584 0.084 10 0 "[ . 1 . 2 .]" 1
968 1 113 ALA MB 1 114 ASP H 1.800 . 2.900 2.563 2.372 2.729 . 0 0 "[ . 1 . 2 .]" 1
969 1 111 PRO QG 1 114 ASP H 1.800 . 4.000 3.999 3.795 4.126 0.126 11 0 "[ . 1 . 2 .]" 1
970 1 114 ASP HA 1 117 TRP QB 1.800 . 5.000 2.610 2.276 2.995 . 0 0 "[ . 1 . 2 .]" 1
971 1 114 ASP HA 1 117 TRP H 1.800 . 5.000 3.550 3.294 3.916 . 0 0 "[ . 1 . 2 .]" 1
972 1 115 PHE H 1 115 PHE HA 1.800 . 2.900 2.850 2.828 2.882 . 0 0 "[ . 1 . 2 .]" 1
973 1 115 PHE H 1 115 PHE QB 1.800 . 2.900 2.233 2.062 2.282 . 0 0 "[ . 1 . 2 .]" 1
974 1 115 PHE H 1 115 PHE QD 1.800 . 5.000 4.127 3.690 4.205 . 0 0 "[ . 1 . 2 .]" 1
975 1 115 PHE HA 1 115 PHE QD 1.800 . 3.500 2.722 2.576 2.980 . 0 0 "[ . 1 . 2 .]" 1
976 1 114 ASP H 1 115 PHE H 1.800 . 2.900 2.646 2.523 2.761 . 0 0 "[ . 1 . 2 .]" 1
977 1 114 ASP HA 1 115 PHE H 1.800 . 3.500 3.531 3.515 3.556 0.056 17 0 "[ . 1 . 2 .]" 1
978 1 114 ASP QB 1 115 PHE H 1.800 . 2.900 2.615 2.469 2.717 . 0 0 "[ . 1 . 2 .]" 1
979 1 115 PHE QD 1 116 VAL QG 1.800 . 5.000 2.924 2.172 4.085 . 0 0 "[ . 1 . 2 .]" 1
980 1 112 PHE QD 1 115 PHE QD 1.800 . 5.000 4.791 3.317 5.092 0.092 5 0 "[ . 1 . 2 .]" 1
981 1 115 PHE HA 1 118 SER QB 1.800 . 5.000 3.038 2.497 3.522 . 0 0 "[ . 1 . 2 .]" 1
982 1 115 PHE QD 1 119 PHE QD 1.800 . 5.000 4.184 3.443 4.606 . 0 0 "[ . 1 . 2 .]" 1
983 1 115 PHE QD 1 119 PHE QE 1.800 . 5.000 3.897 2.986 4.420 . 0 0 "[ . 1 . 2 .]" 1
984 1 115 PHE QE 1 119 PHE QE 1.800 . 5.000 2.795 2.236 3.079 . 0 0 "[ . 1 . 2 .]" 1
985 1 115 PHE QD 1 145 LEU QD 1.800 . 5.000 4.193 3.468 4.832 . 0 0 "[ . 1 . 2 .]" 1
986 1 115 PHE QD 1 148 ALA MB 1.800 . 5.000 3.955 3.570 4.425 . 0 0 "[ . 1 . 2 .]" 1
987 1 115 PHE QD 1 149 LEU QD 1.800 . 5.000 3.884 3.199 4.686 . 0 0 "[ . 1 . 2 .]" 1
988 1 116 VAL H 1 116 VAL HB 1.800 . 3.500 2.771 2.232 3.623 0.123 20 0 "[ . 1 . 2 .]" 1
989 1 116 VAL H 1 116 VAL MG1 1.800 . 3.500 3.017 1.755 3.744 0.244 18 0 "[ . 1 . 2 .]" 1
990 1 116 VAL H 1 116 VAL MG2 1.800 . 3.500 2.423 1.773 3.736 0.236 1 0 "[ . 1 . 2 .]" 1
991 1 115 PHE H 1 116 VAL H 1.800 . 2.900 2.795 2.652 2.903 0.003 1 0 "[ . 1 . 2 .]" 1
992 1 115 PHE HA 1 116 VAL H 1.800 . 3.500 3.576 3.553 3.594 0.094 1 0 "[ . 1 . 2 .]" 1
993 1 115 PHE QB 1 116 VAL H 1.800 . 3.500 2.422 2.281 2.869 . 0 0 "[ . 1 . 2 .]" 1
994 1 115 PHE QD 1 116 VAL H 1.800 . 3.500 3.262 2.621 3.591 0.091 2 0 "[ . 1 . 2 .]" 1
995 1 116 VAL QG 1 117 TRP HA 1.800 . 5.000 3.223 2.882 3.555 . 0 0 "[ . 1 . 2 .]" 1
996 1 116 VAL QG 1 117 TRP HE1 1.800 . 5.000 4.520 3.757 5.044 0.044 24 0 "[ . 1 . 2 .]" 1
997 1 113 ALA MB 1 116 VAL H 1.800 . 6.000 4.714 4.466 4.931 . 0 0 "[ . 1 . 2 .]" 1
998 1 114 ASP H 1 116 VAL H 1.800 . 5.000 4.396 4.127 4.589 . 0 0 "[ . 1 . 2 .]" 1
999 1 116 VAL HA 1 119 PHE QD 1.800 . 5.000 3.820 2.246 4.621 . 0 0 "[ . 1 . 2 .]" 1
1000 1 117 TRP HE3 1 120 VAL QG 1.800 . 5.000 2.259 2.013 2.648 . 0 0 "[ . 1 . 2 .]" 1
1001 1 31 LEU QD 1 116 VAL H 1.800 . 5.000 4.644 3.929 5.031 0.031 7 0 "[ . 1 . 2 .]" 1
1002 1 116 VAL H 1 145 LEU QD 1.800 . 5.000 4.874 4.444 5.086 0.086 4 0 "[ . 1 . 2 .]" 1
1003 1 116 VAL QG 1 145 LEU QD 1.800 . 5.000 2.142 1.843 2.507 . 0 0 "[ . 1 . 2 .]" 1
1004 1 116 VAL QG 1 149 LEU QD 1.800 . 5.000 3.368 2.747 4.439 . 0 0 "[ . 1 . 2 .]" 1
1005 1 112 PHE HZ 1 116 VAL QG 1.800 . 5.000 3.744 3.202 4.357 . 0 0 "[ . 1 . 2 .]" 1
1006 1 117 TRP H 1 117 TRP QB 1.800 . 3.500 2.269 2.161 2.350 . 0 0 "[ . 1 . 2 .]" 1
1007 1 117 TRP QB 1 117 TRP HE3 1.800 . 3.300 2.886 2.790 2.990 . 0 0 "[ . 1 . 2 .]" 1
1008 1 117 TRP H 1 117 TRP HD1 1.800 . 3.500 3.157 2.842 3.453 . 0 0 "[ . 1 . 2 .]" 1
1009 1 117 TRP H 1 117 TRP HE1 1.800 . 6.000 5.091 4.778 5.426 . 0 0 "[ . 1 . 2 .]" 1
1010 1 117 TRP H 1 117 TRP HE3 1.800 . 5.000 5.002 4.846 5.118 0.118 1 0 "[ . 1 . 2 .]" 1
1011 1 117 TRP HA 1 117 TRP HE3 1.800 . 5.000 2.459 2.282 2.618 . 0 0 "[ . 1 . 2 .]" 1
1012 1 116 VAL H 1 117 TRP H 1.800 . 3.500 2.759 2.643 2.866 . 0 0 "[ . 1 . 2 .]" 1
1013 1 116 VAL HA 1 117 TRP H 1.800 . 5.000 3.571 3.556 3.589 . 0 0 "[ . 1 . 2 .]" 1
1014 1 116 VAL QG 1 117 TRP H 1.800 . 3.500 2.529 1.836 3.161 . 0 0 "[ . 1 . 2 .]" 1
1015 1 116 VAL QG 1 117 TRP HD1 1.800 . 5.000 3.920 3.020 4.691 . 0 0 "[ . 1 . 2 .]" 1
1016 1 113 ALA MB 1 117 TRP H 1.800 . 5.000 4.646 4.238 4.932 . 0 0 "[ . 1 . 2 .]" 1
1017 1 113 ALA MB 1 117 TRP HE1 1.800 . 5.000 3.520 2.870 4.424 . 0 0 "[ . 1 . 2 .]" 1
1018 1 115 PHE H 1 117 TRP H 1.800 . 5.000 4.206 4.086 4.346 . 0 0 "[ . 1 . 2 .]" 1
1019 1 117 TRP HH2 1 120 VAL QG 1.800 . 5.000 4.657 4.212 4.919 . 0 0 "[ . 1 . 2 .]" 1
1020 1 117 TRP HZ3 1 120 VAL QG 1.800 . 5.000 2.974 2.504 3.421 . 0 0 "[ . 1 . 2 .]" 1
1021 1 26 THR HA 1 117 TRP HE1 1.800 . 3.500 2.582 1.791 3.236 0.009 6 0 "[ . 1 . 2 .]" 1
1022 1 26 THR MG 1 117 TRP HE1 1.800 . 3.500 2.919 2.219 3.452 . 0 0 "[ . 1 . 2 .]" 1
1023 1 31 LEU QD 1 117 TRP H 1.800 . 5.000 4.762 4.328 5.095 0.095 3 0 "[ . 1 . 2 .]" 1
1024 1 31 LEU QD 1 117 TRP HE1 1.800 . 5.000 3.597 2.721 4.432 . 0 0 "[ . 1 . 2 .]" 1
1025 1 31 LEU QD 1 117 TRP HD1 1.800 . 5.000 4.234 3.504 4.824 . 0 0 "[ . 1 . 2 .]" 1
1026 1 117 TRP HE3 1 122 HIS HA 1.800 . 5.000 2.408 2.247 2.736 . 0 0 "[ . 1 . 2 .]" 1
1027 1 117 TRP HE3 1 122 HIS QB 1.800 . 5.000 4.247 4.005 4.435 . 0 0 "[ . 1 . 2 .]" 1
1028 1 117 TRP HZ3 1 123 GLN HA 1.800 . 5.000 4.615 3.523 5.029 0.029 15 0 "[ . 1 . 2 .]" 1
1029 1 117 TRP HE3 1 123 GLN QG 1.800 . 5.000 4.966 4.623 5.078 0.078 25 0 "[ . 1 . 2 .]" 1
1030 1 25 GLU HA 1 117 TRP HZ3 1.800 . 5.000 2.567 2.288 2.899 . 0 0 "[ . 1 . 2 .]" 1
1031 1 117 TRP H 1 171 LEU QD 1.800 . 5.000 4.176 3.542 4.610 . 0 0 "[ . 1 . 2 .]" 1
1032 1 117 TRP HE1 1 171 LEU QD 1.800 . 5.000 3.709 3.185 4.236 . 0 0 "[ . 1 . 2 .]" 1
1033 1 117 TRP HZ3 1 122 HIS QB 1.800 . 5.000 3.564 2.700 4.594 . 0 0 "[ . 1 . 2 .]" 1
1034 1 118 SER H 1 118 SER QB 1.800 . 2.900 2.451 2.257 2.582 . 0 0 "[ . 1 . 2 .]" 1
1035 1 117 TRP H 1 118 SER H 1.800 . 3.500 2.703 2.624 2.780 . 0 0 "[ . 1 . 2 .]" 1
1036 1 117 TRP HA 1 118 SER H 1.800 . 5.000 3.537 3.518 3.552 . 0 0 "[ . 1 . 2 .]" 1
1037 1 116 VAL HA 1 118 SER H 1.800 . 5.000 4.228 4.101 4.329 . 0 0 "[ . 1 . 2 .]" 1
1038 1 116 VAL H 1 118 SER H 1.800 . 5.000 4.113 3.897 4.252 . 0 0 "[ . 1 . 2 .]" 1
1039 1 119 PHE H 1 119 PHE HA 1.800 . 2.900 2.857 2.840 2.881 . 0 0 "[ . 1 . 2 .]" 1
1040 1 119 PHE H 1 119 PHE QB 1.800 . 3.500 2.183 2.138 2.226 . 0 0 "[ . 1 . 2 .]" 1
1041 1 119 PHE H 1 119 PHE QE 1.800 . 5.000 4.744 4.472 5.053 0.053 24 0 "[ . 1 . 2 .]" 1
1042 1 118 SER H 1 119 PHE H 1.800 . 2.900 2.723 2.637 2.818 . 0 0 "[ . 1 . 2 .]" 1
1043 1 118 SER QB 1 119 PHE H 1.800 . 3.500 2.984 2.593 3.539 0.039 2 0 "[ . 1 . 2 .]" 1
1044 1 119 PHE H 1 120 VAL H 1.800 . 2.900 2.697 2.643 2.800 . 0 0 "[ . 1 . 2 .]" 1
1045 1 115 PHE QD 1 119 PHE QE 1.800 . 5.000 3.891 2.985 4.412 . 0 0 "[ . 1 . 2 .]" 1
1046 1 119 PHE H 1 141 ALA MB 1.800 . 6.000 5.984 5.697 6.079 0.079 25 0 "[ . 1 . 2 .]" 1
1047 1 115 PHE HA 1 119 PHE QD 1.800 . 5.000 4.368 3.965 5.114 0.114 2 0 "[ . 1 . 2 .]" 1
1048 1 115 PHE HA 1 119 PHE QE 1.800 . 5.000 3.968 3.633 4.556 . 0 0 "[ . 1 . 2 .]" 1
1049 1 119 PHE H 1 145 LEU QD 1.800 . 5.000 4.974 4.519 5.140 0.140 2 0 "[ . 1 . 2 .]" 1
1050 1 119 PHE QE 1 145 LEU QD 1.800 . 5.000 4.260 3.279 4.940 . 0 0 "[ . 1 . 2 .]" 1
1051 1 119 PHE QD 1 148 ALA MB 1.800 . 5.000 3.969 3.591 4.542 . 0 0 "[ . 1 . 2 .]" 1
1052 1 119 PHE QE 1 148 ALA MB 1.800 . 3.300 2.455 2.173 2.927 . 0 0 "[ . 1 . 2 .]" 1
1053 1 120 VAL H 1 120 VAL QG 1.800 . 3.500 1.897 1.747 2.426 0.053 11 0 "[ . 1 . 2 .]" 1
1054 1 119 PHE HA 1 120 VAL H 1.800 . 3.500 3.518 3.488 3.550 0.050 2 0 "[ . 1 . 2 .]" 1
1055 1 117 TRP HA 1 120 VAL QG 1.800 . 5.000 2.225 2.096 2.689 . 0 0 "[ . 1 . 2 .]" 1
1056 1 120 VAL H 1 122 HIS H 1.800 . 4.000 3.340 3.091 4.091 0.091 24 0 "[ . 1 . 2 .]" 1
1057 1 120 VAL QG 1 141 ALA MB 1.800 . 5.000 2.472 2.259 2.964 . 0 0 "[ . 1 . 2 .]" 1
1058 1 120 VAL QG 1 166 MET ME 1.800 . 3.300 2.751 2.032 3.359 0.059 23 0 "[ . 1 . 2 .]" 1
1059 1 120 VAL H 1 171 LEU QD 1.800 . 5.000 4.550 3.916 5.023 0.023 4 0 "[ . 1 . 2 .]" 1
1060 1 120 VAL QG 1 171 LEU HG 1.800 . 5.000 4.069 2.459 5.002 0.002 20 0 "[ . 1 . 2 .]" 1
1061 1 120 VAL QG 1 171 LEU HA 1.800 . 5.000 4.230 3.623 4.866 . 0 0 "[ . 1 . 2 .]" 1
1062 1 121 ASN H 1 121 ASN HA 1.800 . 2.900 2.350 2.341 2.360 . 0 0 "[ . 1 . 2 .]" 1
1063 1 121 ASN H 1 121 ASN QB 1.800 . 3.500 3.125 2.940 3.514 0.014 23 0 "[ . 1 . 2 .]" 1
1064 1 120 VAL H 1 121 ASN H 1.800 . 2.900 2.572 2.400 2.751 . 0 0 "[ . 1 . 2 .]" 1
1065 1 120 VAL HA 1 121 ASN H 1.800 . 3.500 3.077 3.020 3.173 . 0 0 "[ . 1 . 2 .]" 1
1066 1 120 VAL QG 1 121 ASN H 1.800 . 3.500 3.188 2.968 3.517 0.017 11 0 "[ . 1 . 2 .]" 1
1067 1 118 SER HA 1 121 ASN H 1.800 . 5.000 3.519 3.169 3.734 . 0 0 "[ . 1 . 2 .]" 1
1068 1 119 PHE H 1 121 ASN H 1.800 . 5.000 4.074 3.840 4.246 . 0 0 "[ . 1 . 2 .]" 1
1069 1 119 PHE HA 1 121 ASN H 1.800 . 3.500 3.593 3.539 3.671 0.171 10 0 "[ . 1 . 2 .]" 1
1070 1 122 HIS H 1 122 HIS HA 1.800 . 2.900 2.370 2.346 2.677 . 0 0 "[ . 1 . 2 .]" 1
1071 1 121 ASN H 1 122 HIS H 1.800 . 3.500 2.701 2.491 3.396 . 0 0 "[ . 1 . 2 .]" 1
1072 1 121 ASN HA 1 122 HIS H 1.800 . 3.500 2.920 2.810 3.551 0.051 24 0 "[ . 1 . 2 .]" 1
1073 1 121 ASN QB 1 122 HIS H 1.800 . 3.500 3.726 2.285 3.830 0.330 19 0 "[ . 1 . 2 .]" 1
1074 1 120 VAL QG 1 122 HIS H 1.800 . 5.000 2.453 2.180 3.174 . 0 0 "[ . 1 . 2 .]" 1
1075 1 123 GLN H 1 123 GLN HA 1.800 . 2.900 2.977 2.938 2.987 0.087 10 0 "[ . 1 . 2 .]" 1
1076 1 123 GLN H 1 123 GLN QB 1.800 . 2.900 2.435 2.267 2.866 . 0 0 "[ . 1 . 2 .]" 1
1077 1 123 GLN H 1 123 GLN QG 1.800 . 4.000 3.608 2.543 4.176 0.176 22 0 "[ . 1 . 2 .]" 1
1078 1 122 HIS H 1 123 GLN H 1.800 . 2.900 2.798 1.874 2.944 0.044 17 0 "[ . 1 . 2 .]" 1
1079 1 122 HIS HA 1 123 GLN H 1.800 . 3.500 3.049 2.828 3.430 . 0 0 "[ . 1 . 2 .]" 1
1080 1 122 HIS QB 1 123 GLN H 1.800 . 5.000 3.693 3.153 3.926 . 0 0 "[ . 1 . 2 .]" 1
1081 1 123 GLN QG 1 124 PRO QD 1.800 . 3.300 3.067 2.412 3.661 0.361 23 0 "[ . 1 . 2 .]" 1
1082 1 120 VAL QG 1 123 GLN H 1.800 . 3.500 2.458 1.803 3.572 0.072 11 0 "[ . 1 . 2 .]" 1
1083 1 121 ASN H 1 123 GLN H 1.800 . 5.000 4.307 4.176 5.152 0.152 24 0 "[ . 1 . 2 .]" 1
1084 1 121 ASN HA 1 123 GLN H 1.800 . 5.000 4.304 3.938 4.840 . 0 0 "[ . 1 . 2 .]" 1
1085 1 121 ASN HB3 1 123 GLN H 1.800 . 5.000 3.543 2.488 4.917 . 0 0 "[ . 1 . 2 .]" 1
1086 1 121 ASN HB3 1 123 GLN QG 1.800 . 5.000 4.180 2.498 5.021 0.021 2 0 "[ . 1 . 2 .]" 1
1087 1 117 TRP HA 1 123 GLN H 1.800 . 5.000 3.871 3.394 4.307 . 0 0 "[ . 1 . 2 .]" 1
1088 1 123 GLN HA 1 124 PRO QD 1.800 . 3.300 2.060 2.023 2.093 . 0 0 "[ . 1 . 2 .]" 1
1089 1 125 GLN H 1 125 GLN QB 1.800 . 3.500 2.516 2.337 2.594 . 0 0 "[ . 1 . 2 .]" 1
1090 1 125 GLN H 1 125 GLN QG 1.800 . 5.000 2.648 2.395 3.654 . 0 0 "[ . 1 . 2 .]" 1
1091 1 124 PRO HA 1 125 GLN H 1.800 . 2.500 2.291 2.264 2.346 . 0 0 "[ . 1 . 2 .]" 1
1092 1 124 PRO QB 1 125 GLN H 1.800 . 3.500 3.013 2.850 3.111 . 0 0 "[ . 1 . 2 .]" 1
1093 1 120 VAL QG 1 125 GLN H 1.800 . 5.000 4.402 3.584 4.797 . 0 0 "[ . 1 . 2 .]" 1
1094 1 120 VAL HB 1 125 GLN HG3 1.800 . 5.000 3.853 2.924 5.066 0.066 18 0 "[ . 1 . 2 .]" 1
1095 1 120 VAL HB 1 125 GLN HG2 1.800 . 5.000 4.517 3.176 5.135 0.135 23 0 "[ . 1 . 2 .]" 1
1096 1 120 VAL QG 1 125 GLN HG3 1.800 . 5.000 3.504 2.166 4.853 . 0 0 "[ . 1 . 2 .]" 1
1097 1 120 VAL QG 1 125 GLN HG2 1.800 . 5.000 4.149 2.162 5.071 0.071 7 0 "[ . 1 . 2 .]" 1
1098 1 125 GLN H 1 172 VAL HA 1.800 . 3.500 2.789 2.244 3.520 0.020 18 0 "[ . 1 . 2 .]" 1
1099 1 125 GLN H 1 172 VAL QG 1.800 . 5.000 3.449 2.565 4.105 . 0 0 "[ . 1 . 2 .]" 1
1100 1 125 GLN HA 1 172 VAL QG 1.800 . 5.000 4.474 3.990 4.860 . 0 0 "[ . 1 . 2 .]" 1
1101 1 125 GLN QB 1 172 VAL QG 1.800 . 2.700 2.171 1.958 2.412 . 0 0 "[ . 1 . 2 .]" 1
1102 1 125 GLN H 1 173 ASN H 1.800 . 5.000 4.356 3.893 4.836 . 0 0 "[ . 1 . 2 .]" 1
1103 1 126 MET H 1 126 MET QB 1.800 . 2.900 2.690 2.490 3.116 0.216 19 0 "[ . 1 . 2 .]" 1
1104 1 126 MET H 1 126 MET QG 1.800 . 4.000 3.051 1.808 4.106 0.106 3 0 "[ . 1 . 2 .]" 1
1105 1 125 GLN H 1 126 MET H 1.800 . 5.000 4.544 4.505 4.590 . 0 0 "[ . 1 . 2 .]" 1
1106 1 125 GLN HA 1 126 MET H 1.800 . 2.900 2.291 2.219 2.355 . 0 0 "[ . 1 . 2 .]" 1
1107 1 127 THR H 1 127 THR HA 1.800 . 2.900 2.980 2.944 2.994 0.094 15 0 "[ . 1 . 2 .]" 1
1108 1 127 THR H 1 127 THR MG 1.800 . 3.500 2.313 2.038 2.552 . 0 0 "[ . 1 . 2 .]" 1
1109 1 126 MET H 1 127 THR H 1.800 . 5.000 4.475 4.419 4.545 . 0 0 "[ . 1 . 2 .]" 1
1110 1 126 MET HA 1 127 THR H 1.800 . 2.700 2.343 2.257 2.397 . 0 0 "[ . 1 . 2 .]" 1
1111 1 126 MET HA 1 127 THR MG 1.800 . 5.000 4.202 3.961 4.521 . 0 0 "[ . 1 . 2 .]" 1
1112 1 127 THR MG 1 129 ALA MB 1.800 . 5.000 2.905 2.209 4.492 . 0 0 "[ . 1 . 2 .]" 1
1113 1 127 THR MG 1 135 ILE MD 1.800 . 5.000 2.939 2.062 3.838 . 0 0 "[ . 1 . 2 .]" 1
1114 1 127 THR H 1 173 ASN H 1.800 . 5.000 3.743 3.272 4.181 . 0 0 "[ . 1 . 2 .]" 1
1115 1 127 THR MG 1 173 ASN HA 1.800 . 5.000 4.997 4.787 5.081 0.081 6 0 "[ . 1 . 2 .]" 1
1116 1 127 THR H 1 174 ASP HA 1.800 . 5.000 4.242 3.920 4.646 . 0 0 "[ . 1 . 2 .]" 1
1117 1 127 THR MG 1 174 ASP HA 1.800 . 2.900 2.164 2.002 2.598 . 0 0 "[ . 1 . 2 .]" 1
1118 1 127 THR MG 1 176 VAL QG 1.800 . 5.000 4.701 4.093 5.217 0.217 3 0 "[ . 1 . 2 .]" 1
1119 1 128 GLN H 1 128 GLN HA 1.800 . 2.900 2.975 2.925 2.987 0.087 13 0 "[ . 1 . 2 .]" 1
1120 1 128 GLN H 1 128 GLN QB 1.800 . 3.500 2.710 2.477 3.203 . 0 0 "[ . 1 . 2 .]" 1
1121 1 127 THR H 1 128 GLN H 1.800 . 5.000 4.509 4.441 4.634 . 0 0 "[ . 1 . 2 .]" 1
1122 1 127 THR HA 1 128 GLN H 1.800 . 2.500 2.328 2.230 2.378 . 0 0 "[ . 1 . 2 .]" 1
1123 1 128 GLN HA 1 177 VAL QG 1.800 . 5.000 3.510 2.154 4.366 . 0 0 "[ . 1 . 2 .]" 1
1124 1 128 GLN QG 1 177 VAL QG 1.800 . 5.000 3.781 2.005 4.902 . 0 0 "[ . 1 . 2 .]" 1
1125 1 129 ALA H 1 129 ALA MB 1.800 . 3.500 2.162 2.021 2.493 . 0 0 "[ . 1 . 2 .]" 1
1126 1 128 GLN H 1 129 ALA H 1.800 . 2.900 2.823 2.387 2.986 0.086 4 0 "[ . 1 . 2 .]" 1
1127 1 128 GLN HA 1 129 ALA H 1.800 . 2.700 2.717 2.584 2.835 0.135 20 0 "[ . 1 . 2 .]" 1
1128 1 128 GLN QB 1 129 ALA H 1.800 . 5.000 3.876 3.708 4.000 . 0 0 "[ . 1 . 2 .]" 1
1129 1 127 THR MG 1 129 ALA H 1.800 . 5.000 2.231 1.779 3.401 0.021 21 0 "[ . 1 . 2 .]" 1
1130 1 129 ALA HA 1 131 THR H 1.800 . 5.000 4.132 3.746 4.827 . 0 0 "[ . 1 . 2 .]" 1
1131 1 129 ALA MB 1 131 THR H 1.800 . 3.500 3.011 2.498 3.449 . 0 0 "[ . 1 . 2 .]" 1
1132 1 129 ALA MB 1 134 GLU QB 1.800 . 5.000 2.011 1.851 3.660 . 0 0 "[ . 1 . 2 .]" 1
1133 1 129 ALA MB 1 134 GLU QG 1.800 . 5.000 3.386 1.983 4.019 . 0 0 "[ . 1 . 2 .]" 1
1134 1 129 ALA MB 1 135 ILE HG13 1.800 . 5.000 2.710 1.975 3.974 . 0 0 "[ . 1 . 2 .]" 1
1135 1 129 ALA MB 1 135 ILE HG12 1.800 . 5.000 3.015 1.972 4.576 . 0 0 "[ . 1 . 2 .]" 1
1136 1 129 ALA MB 1 135 ILE MG 1.800 . 5.000 4.060 3.176 5.029 0.029 18 0 "[ . 1 . 2 .]" 1
1137 1 129 ALA MB 1 135 ILE MD 1.800 . 3.300 2.440 1.837 3.065 . 0 0 "[ . 1 . 2 .]" 1
1138 1 129 ALA H 1 135 ILE MD 1.800 . 5.000 3.995 3.003 5.045 0.045 6 0 "[ . 1 . 2 .]" 1
1139 1 129 ALA MB 1 176 VAL QG 1.800 . 5.000 3.785 3.029 4.636 . 0 0 "[ . 1 . 2 .]" 1
1140 1 129 ALA H 1 177 VAL QG 1.800 . 5.000 4.267 3.208 5.089 0.089 17 0 "[ . 1 . 2 .]" 1
1141 1 130 THR H 1 130 THR MG 1.800 . 5.000 3.803 3.683 4.031 . 0 0 "[ . 1 . 2 .]" 1
1142 1 129 ALA HA 1 130 THR H 1.800 . 2.900 2.243 2.082 2.914 0.014 15 0 "[ . 1 . 2 .]" 1
1143 1 129 ALA MB 1 130 THR H 1.800 . 3.500 2.804 1.771 3.321 0.029 5 0 "[ . 1 . 2 .]" 1
1144 1 129 ALA MB 1 130 THR MG 1.800 . 6.000 5.137 4.684 5.340 . 0 0 "[ . 1 . 2 .]" 1
1145 1 130 THR H 1 134 GLU H 1.800 . 5.000 5.079 4.765 5.198 0.198 16 0 "[ . 1 . 2 .]" 1
1146 1 130 THR H 1 134 GLU QB 1.800 . 5.000 3.029 2.677 3.454 . 0 0 "[ . 1 . 2 .]" 1
1147 1 130 THR HA 1 177 VAL HB 1.800 . 5.000 3.976 2.418 5.059 0.059 16 0 "[ . 1 . 2 .]" 1
1148 1 130 THR H 1 177 VAL QG 1.800 . 5.000 4.290 3.555 4.912 . 0 0 "[ . 1 . 2 .]" 1
1149 1 130 THR MG 1 177 VAL HB 1.800 . 5.000 4.244 2.676 5.061 0.061 20 0 "[ . 1 . 2 .]" 1
1150 1 130 THR HA 1 131 THR H 1.800 . 3.500 2.772 2.624 3.038 . 0 0 "[ . 1 . 2 .]" 1
1151 1 130 THR H 1 131 THR H 1.800 . 2.900 2.280 1.770 2.636 0.030 5 0 "[ . 1 . 2 .]" 1
1152 1 130 THR HB 1 131 THR H 1.800 . 2.900 2.754 2.557 2.986 0.086 18 0 "[ . 1 . 2 .]" 1
1153 1 131 THR H 1 133 SER H 1.800 . 5.000 4.909 4.715 5.073 0.073 5 0 "[ . 1 . 2 .]" 1
1154 1 131 THR H 1 134 GLU H 1.800 . 5.000 3.567 3.277 3.813 . 0 0 "[ . 1 . 2 .]" 1
1155 1 131 THR H 1 134 GLU QB 1.800 . 3.500 2.713 2.301 3.116 . 0 0 "[ . 1 . 2 .]" 1
1156 1 131 THR H 1 134 GLU QG 1.800 . 3.500 2.720 2.058 3.291 . 0 0 "[ . 1 . 2 .]" 1
1157 1 131 THR MG 1 134 GLU QG 1.800 . 5.000 3.481 2.015 5.025 0.025 6 0 "[ . 1 . 2 .]" 1
1158 1 131 THR MG 1 133 SER H 1.800 . 2.900 2.221 1.787 2.827 0.013 2 0 "[ . 1 . 2 .]" 1
1159 1 131 THR H 1 176 VAL QG 1.800 . 5.000 4.113 3.488 4.872 . 0 0 "[ . 1 . 2 .]" 1
1160 1 132 LEU H 1 132 LEU HG 1.800 . 2.900 2.052 1.864 2.915 0.015 18 0 "[ . 1 . 2 .]" 1
1161 1 131 THR H 1 132 LEU H 1.800 . 5.000 4.482 4.429 4.537 . 0 0 "[ . 1 . 2 .]" 1
1162 1 131 THR HA 1 132 LEU H 1.800 . 2.900 2.376 2.301 2.499 . 0 0 "[ . 1 . 2 .]" 1
1163 1 131 THR HB 1 132 LEU H 1.800 . 3.500 3.628 3.561 3.741 0.241 20 0 "[ . 1 . 2 .]" 1
1164 1 131 THR MG 1 132 LEU H 1.800 . 5.000 2.278 1.750 3.588 0.050 19 0 "[ . 1 . 2 .]" 1
1165 1 4 CYS HA 1 132 LEU QD 1.800 . 5.000 4.327 3.512 4.849 . 0 0 "[ . 1 . 2 .]" 1
1166 1 4 CYS QB 1 132 LEU QD 1.800 . 5.000 3.836 2.935 4.612 . 0 0 "[ . 1 . 2 .]" 1
1167 1 5 GLY QA 1 132 LEU QD 1.800 . 5.000 2.889 2.109 4.492 . 0 0 "[ . 1 . 2 .]" 1
1168 1 6 TRP HA 1 132 LEU QD 1.800 . 5.000 2.798 2.059 3.587 . 0 0 "[ . 1 . 2 .]" 1
1169 1 6 TRP QB 1 132 LEU QD 1.800 . 5.000 3.153 1.802 3.908 . 0 0 "[ . 1 . 2 .]" 1
1170 1 132 LEU H 1 176 VAL QG 1.800 . 5.000 3.793 3.062 4.900 . 0 0 "[ . 1 . 2 .]" 1
1171 1 132 LEU HA 1 176 VAL QG 1.800 . 5.000 4.036 2.914 5.087 0.087 15 0 "[ . 1 . 2 .]" 1
1172 1 132 LEU QD 1 176 VAL QG 1.800 . 5.000 2.724 1.987 3.453 . 0 0 "[ . 1 . 2 .]" 1
1173 1 133 SER H 1 133 SER HA 1.800 . 2.900 2.842 2.817 2.875 . 0 0 "[ . 1 . 2 .]" 1
1174 1 133 SER H 1 133 SER QB 1.800 . 2.900 2.430 2.138 2.605 . 0 0 "[ . 1 . 2 .]" 1
1175 1 132 LEU H 1 133 SER H 1.800 . 3.500 2.709 2.610 2.818 . 0 0 "[ . 1 . 2 .]" 1
1176 1 132 LEU QB 1 133 SER H 1.800 . 3.500 2.689 2.573 2.787 . 0 0 "[ . 1 . 2 .]" 1
1177 1 133 SER H 1 134 GLU QB 1.800 . 5.000 4.753 4.549 4.839 . 0 0 "[ . 1 . 2 .]" 1
1178 1 134 GLU H 1 134 GLU QG 1.800 . 2.900 2.246 2.127 2.893 . 0 0 "[ . 1 . 2 .]" 1
1179 1 133 SER H 1 134 GLU H 1.800 . 2.900 2.748 2.639 2.833 . 0 0 "[ . 1 . 2 .]" 1
1180 1 133 SER HA 1 134 GLU H 1.800 . 2.700 2.747 2.728 2.759 0.059 20 0 "[ . 1 . 2 .]" 1
1181 1 130 THR MG 1 134 GLU H 1.800 . 5.000 3.185 1.813 3.949 . 0 0 "[ . 1 . 2 .]" 1
1182 1 129 ALA MB 1 134 GLU H 1.800 . 5.000 3.809 3.523 4.349 . 0 0 "[ . 1 . 2 .]" 1
1183 1 134 GLU HA 1 135 ILE H 1.800 . 3.500 3.510 3.479 3.530 0.030 17 0 "[ . 1 . 2 .]" 1
1184 1 135 ILE H 1 135 ILE MG 1.800 . 3.500 3.674 3.582 3.752 0.252 3 0 "[ . 1 . 2 .]" 1
1185 1 135 ILE H 1 135 ILE MD 1.800 . 3.500 3.079 1.956 3.575 0.075 3 0 "[ . 1 . 2 .]" 1
1186 1 134 GLU H 1 135 ILE H 1.800 . 2.900 2.653 2.596 2.730 . 0 0 "[ . 1 . 2 .]" 1
1187 1 135 ILE HA 1 136 PRO QD 1.800 . 3.300 2.033 2.027 2.047 . 0 0 "[ . 1 . 2 .]" 1
1188 1 135 ILE MG 1 136 PRO QD 1.800 . 3.300 2.362 2.192 2.586 . 0 0 "[ . 1 . 2 .]" 1
1189 1 131 THR H 1 135 ILE H 1.800 . 5.000 4.930 4.679 5.047 0.047 18 0 "[ . 1 . 2 .]" 1
1190 1 133 SER QB 1 135 ILE H 1.800 . 5.000 3.978 3.886 4.110 . 0 0 "[ . 1 . 2 .]" 1
1191 1 132 LEU HA 1 135 ILE MD 1.800 . 5.000 2.539 2.062 3.926 . 0 0 "[ . 1 . 2 .]" 1
1192 1 132 LEU QD 1 135 ILE MD 1.800 . 5.000 2.884 2.060 4.237 . 0 0 "[ . 1 . 2 .]" 1
1193 1 129 ALA MB 1 135 ILE H 1.800 . 5.000 3.162 2.704 3.898 . 0 0 "[ . 1 . 2 .]" 1
1194 1 129 ALA MB 1 135 ILE MG 1.800 . 5.000 4.074 3.177 5.048 0.048 18 0 "[ . 1 . 2 .]" 1
1195 1 135 ILE MG 1 163 TYR QD 1.800 . 5.000 4.973 4.539 5.112 0.112 7 0 "[ . 1 . 2 .]" 1
1196 1 135 ILE MG 1 163 TYR QE 1.800 . 3.300 3.282 2.747 3.411 0.111 7 0 "[ . 1 . 2 .]" 1
1197 1 135 ILE MD 1 174 ASP QB 1.800 . 5.000 2.972 2.147 4.963 . 0 0 "[ . 1 . 2 .]" 1
1198 1 135 ILE MD 1 176 VAL QG 1.800 . 4.000 3.500 2.328 4.075 0.075 6 0 "[ . 1 . 2 .]" 1
1199 1 136 PRO QB 1 138 SER H 1.800 . 2.900 2.586 2.287 2.899 . 0 0 "[ . 1 . 2 .]" 1
1200 1 136 PRO QB 1 139 THR MG 1.800 . 5.000 3.201 2.199 4.373 . 0 0 "[ . 1 . 2 .]" 1
1201 1 136 PRO QG 1 139 THR MG 1.800 . 3.300 2.834 2.391 3.275 . 0 0 "[ . 1 . 2 .]" 1
1202 1 137 THR H 1 137 THR HA 1.800 . 2.900 2.889 2.337 2.981 0.081 21 0 "[ . 1 . 2 .]" 1
1203 1 137 THR H 1 137 THR MG 1.800 . 3.500 2.271 1.756 3.675 0.175 6 0 "[ . 1 . 2 .]" 1
1204 1 136 PRO HA 1 137 THR H 1.800 . 2.900 2.365 2.208 3.350 0.450 4 0 "[ . 1 . 2 .]" 1
1205 1 136 PRO QB 1 137 THR H 1.800 . 3.500 3.220 3.088 3.552 0.052 22 0 "[ . 1 . 2 .]" 1
1206 1 136 PRO QD 1 137 THR H 1.800 . 5.000 4.708 2.548 5.029 0.029 19 0 "[ . 1 . 2 .]" 1
1207 1 137 THR H 1 139 THR MG 1.800 . 5.000 4.827 4.278 5.039 0.039 12 0 "[ . 1 . 2 .]" 1
1208 1 137 THR HA 1 163 TYR QD 1.800 . 5.000 3.542 3.208 4.079 . 0 0 "[ . 1 . 2 .]" 1
1209 1 137 THR H 1 138 SER H 1.800 . 2.900 2.356 2.149 2.893 . 0 0 "[ . 1 . 2 .]" 1
1210 1 137 THR HA 1 138 SER H 1.800 . 3.500 3.161 2.968 3.287 . 0 0 "[ . 1 . 2 .]" 1
1211 1 137 THR MG 1 138 SER H 1.800 . 4.000 3.100 2.559 4.297 0.297 6 0 "[ . 1 . 2 .]" 1
1212 1 137 THR MG 1 138 SER HA 1.800 . 5.000 4.199 3.313 5.129 0.129 22 0 "[ . 1 . 2 .]" 1
1213 1 136 PRO HA 1 138 SER H 1.800 . 3.500 3.592 3.524 3.695 0.195 22 0 "[ . 1 . 2 .]" 1
1214 1 136 PRO QG 1 138 SER H 1.800 . 5.000 4.102 2.804 4.832 . 0 0 "[ . 1 . 2 .]" 1
1215 1 139 THR H 1 139 THR MG 1.800 . 5.000 2.075 1.709 2.867 0.091 12 0 "[ . 1 . 2 .]" 1
1216 1 138 SER H 1 139 THR H 1.800 . 5.000 3.769 3.319 4.219 . 0 0 "[ . 1 . 2 .]" 1
1217 1 138 SER HA 1 139 THR H 1.800 . 2.900 2.307 2.221 2.420 . 0 0 "[ . 1 . 2 .]" 1
1218 1 138 SER QB 1 139 THR H 1.800 . 4.000 3.893 3.722 4.028 0.028 6 0 "[ . 1 . 2 .]" 1
1219 1 138 SER HA 1 139 THR MG 1.800 . 5.000 3.691 3.421 4.302 . 0 0 "[ . 1 . 2 .]" 1
1220 1 139 THR MG 1 140 PRO QD 1.800 . 5.000 3.548 2.946 3.756 . 0 0 "[ . 1 . 2 .]" 1
1221 1 127 THR MG 1 139 THR H 1.800 . 5.000 4.442 3.669 5.051 0.051 3 0 "[ . 1 . 2 .]" 1
1222 1 139 THR H 1 141 ALA H 1.800 . 5.000 5.053 5.004 5.105 0.105 21 0 "[ . 1 . 2 .]" 1
1223 1 139 THR MG 1 141 ALA MB 1.800 . 5.000 4.232 3.699 4.536 . 0 0 "[ . 1 . 2 .]" 1
1224 1 139 THR H 1 142 SER H 1.800 . 5.000 3.757 3.548 4.021 . 0 0 "[ . 1 . 2 .]" 1
1225 1 137 THR HA 1 139 THR H 1.800 . 5.000 5.010 4.641 5.109 0.109 2 0 "[ . 1 . 2 .]" 1
1226 1 139 THR H 1 163 TYR QD 1.800 . 5.000 3.578 2.831 4.268 . 0 0 "[ . 1 . 2 .]" 1
1227 1 140 PRO HA 1 143 ASP QB 1.800 . 3.300 3.079 2.769 3.302 0.002 6 0 "[ . 1 . 2 .]" 1
1228 1 141 ALA H 1 141 ALA HA 1.800 . 2.900 2.893 2.875 2.909 0.009 13 0 "[ . 1 . 2 .]" 1
1229 1 141 ALA H 1 141 ALA MB 1.800 . 2.500 2.175 2.052 2.268 . 0 0 "[ . 1 . 2 .]" 1
1230 1 140 PRO HA 1 141 ALA H 1.800 . 3.500 3.550 3.526 3.567 0.067 11 0 "[ . 1 . 2 .]" 1
1231 1 140 PRO QB 1 141 ALA H 1.800 . 3.500 2.858 2.565 3.221 . 0 0 "[ . 1 . 2 .]" 1
1232 1 139 THR HB 1 141 ALA H 1.800 . 4.000 3.461 2.756 4.003 0.003 12 0 "[ . 1 . 2 .]" 1
1233 1 139 THR MG 1 141 ALA H 1.800 . 5.000 4.381 4.033 4.555 . 0 0 "[ . 1 . 2 .]" 1
1234 1 139 THR HB 1 141 ALA MB 1.800 . 5.000 4.092 3.475 4.626 . 0 0 "[ . 1 . 2 .]" 1
1235 1 141 ALA H 1 143 ASP H 1.800 . 5.000 4.200 4.086 4.350 . 0 0 "[ . 1 . 2 .]" 1
1236 1 119 PHE HB3 1 141 ALA MB 1.800 . 5.000 3.288 2.729 3.446 . 0 0 "[ . 1 . 2 .]" 1
1237 1 119 PHE HB2 1 141 ALA MB 1.800 . 5.000 4.473 3.879 4.690 . 0 0 "[ . 1 . 2 .]" 1
1238 1 120 VAL QG 1 141 ALA H 1.800 . 5.000 5.057 4.930 5.118 0.118 17 0 "[ . 1 . 2 .]" 1
1239 1 141 ALA H 1 166 MET ME 1.800 . 5.000 4.808 4.334 5.097 0.097 1 0 "[ . 1 . 2 .]" 1
1240 1 141 ALA MB 1 166 MET ME 1.800 . 3.300 2.467 2.203 2.926 . 0 0 "[ . 1 . 2 .]" 1
1241 1 141 ALA H 1 142 SER H 1.800 . 2.900 2.578 2.496 2.661 . 0 0 "[ . 1 . 2 .]" 1
1242 1 141 ALA HA 1 142 SER H 1.800 . 3.500 3.548 3.534 3.565 0.065 17 0 "[ . 1 . 2 .]" 1
1243 1 141 ALA MB 1 142 SER H 1.800 . 2.900 2.585 2.457 2.712 . 0 0 "[ . 1 . 2 .]" 1
1244 1 139 THR HB 1 142 SER H 1.800 . 5.000 4.060 3.255 4.631 . 0 0 "[ . 1 . 2 .]" 1
1245 1 139 THR MG 1 142 SER H 1.800 . 5.000 3.744 3.173 4.384 . 0 0 "[ . 1 . 2 .]" 1
1246 1 140 PRO QD 1 142 SER H 1.800 . 5.000 4.500 4.397 4.582 . 0 0 "[ . 1 . 2 .]" 1
1247 1 142 SER H 1 166 MET ME 1.800 . 5.000 3.880 3.156 4.272 . 0 0 "[ . 1 . 2 .]" 1
1248 1 143 ASP H 1 143 ASP HA 1.800 . 2.700 2.849 2.836 2.863 0.163 1 0 "[ . 1 . 2 .]" 1
1249 1 142 SER H 1 143 ASP H 1.800 . 2.900 2.748 2.671 2.798 . 0 0 "[ . 1 . 2 .]" 1
1250 1 142 SER HA 1 143 ASP H 1.800 . 3.500 3.560 3.545 3.574 0.074 5 0 "[ . 1 . 2 .]" 1
1251 1 142 SER QB 1 143 ASP H 1.800 . 3.500 2.809 2.376 3.423 . 0 0 "[ . 1 . 2 .]" 1
1252 1 140 PRO HA 1 143 ASP H 1.800 . 3.500 2.693 2.350 3.171 . 0 0 "[ . 1 . 2 .]" 1
1253 1 139 THR H 1 143 ASP H 1.800 . 5.000 4.284 3.479 4.803 . 0 0 "[ . 1 . 2 .]" 1
1254 1 141 ALA MB 1 143 ASP H 1.800 . 5.000 4.049 3.376 4.555 . 0 0 "[ . 1 . 2 .]" 1
1255 1 144 ALA H 1 144 ALA MB 1.800 . 2.900 2.169 2.059 2.258 . 0 0 "[ . 1 . 2 .]" 1
1256 1 143 ASP H 1 144 ALA H 1.800 . 2.900 2.715 2.658 2.772 . 0 0 "[ . 1 . 2 .]" 1
1257 1 143 ASP QB 1 144 ALA H 1.800 . 3.500 2.461 2.391 2.546 . 0 0 "[ . 1 . 2 .]" 1
1258 1 140 PRO HA 1 144 ALA H 1.800 . 5.000 4.255 3.710 4.560 . 0 0 "[ . 1 . 2 .]" 1
1259 1 141 ALA HA 1 144 ALA H 1.800 . 3.500 3.503 3.312 3.567 0.067 17 0 "[ . 1 . 2 .]" 1
1260 1 141 ALA HA 1 144 ALA MB 1.800 . 3.300 2.802 2.594 3.044 . 0 0 "[ . 1 . 2 .]" 1
1261 1 141 ALA MB 1 144 ALA MB 1.800 . 5.000 4.027 3.782 4.191 . 0 0 "[ . 1 . 2 .]" 1
1262 1 142 SER HA 1 144 ALA H 1.800 . 6.000 4.577 4.473 4.670 . 0 0 "[ . 1 . 2 .]" 1
1263 1 143 ASP QB 1 144 ALA HA 1.800 . 5.000 3.715 3.129 4.057 . 0 0 "[ . 1 . 2 .]" 1
1264 1 119 PHE QB 1 144 ALA MB 1.800 . 5.000 4.049 3.654 4.596 . 0 0 "[ . 1 . 2 .]" 1
1265 1 119 PHE QD 1 144 ALA MB 1.800 . 3.300 2.698 2.252 3.225 . 0 0 "[ . 1 . 2 .]" 1
1266 1 119 PHE QE 1 144 ALA MB 1.800 . 3.300 2.580 2.062 3.102 . 0 0 "[ . 1 . 2 .]" 1
1267 1 145 LEU H 1 145 LEU HA 1.800 . 2.900 2.839 2.813 2.855 . 0 0 "[ . 1 . 2 .]" 1
1268 1 145 LEU H 1 145 LEU QB 1.800 . 3.500 2.233 2.159 2.256 . 0 0 "[ . 1 . 2 .]" 1
1269 1 145 LEU H 1 145 LEU QD 1.800 . 3.500 3.657 3.327 3.742 0.242 5 0 "[ . 1 . 2 .]" 1
1270 1 144 ALA H 1 145 LEU H 1.800 . 2.900 2.592 2.519 2.664 . 0 0 "[ . 1 . 2 .]" 1
1271 1 144 ALA HA 1 145 LEU H 1.800 . 3.500 3.543 3.505 3.563 0.063 19 0 "[ . 1 . 2 .]" 1
1272 1 144 ALA MB 1 145 LEU H 1.800 . 2.900 2.614 2.505 2.748 . 0 0 "[ . 1 . 2 .]" 1
1273 1 141 ALA HA 1 145 LEU H 1.800 . 5.000 3.774 3.566 4.154 . 0 0 "[ . 1 . 2 .]" 1
1274 1 142 SER HA 1 145 LEU H 1.800 . 3.500 3.488 3.263 3.575 0.075 6 0 "[ . 1 . 2 .]" 1
1275 1 143 ASP H 1 145 LEU H 1.800 . 5.000 4.044 3.841 4.173 . 0 0 "[ . 1 . 2 .]" 1
1276 1 145 LEU QD 1 149 LEU HA 1.800 . 5.000 4.800 4.277 5.067 0.067 10 0 "[ . 1 . 2 .]" 1
1277 1 115 PHE QE 1 145 LEU QD 1.800 . 3.300 2.620 1.929 3.319 0.019 3 0 "[ . 1 . 2 .]" 1
1278 1 116 VAL HA 1 145 LEU QD 1.800 . 5.000 3.034 2.669 3.335 . 0 0 "[ . 1 . 2 .]" 1
1279 1 119 PHE QD 1 145 LEU H 1.800 . 5.000 3.564 3.078 4.985 . 0 0 "[ . 1 . 2 .]" 1
1280 1 119 PHE QD 1 145 LEU QD 1.800 . 5.000 3.450 2.505 4.041 . 0 0 "[ . 1 . 2 .]" 1
1281 1 145 LEU QD 1 161 ILE MG 1.800 . 5.000 4.926 4.605 5.133 0.133 13 0 "[ . 1 . 2 .]" 1
1282 1 145 LEU QD 1 162 CYS HA 1.800 . 5.000 3.404 2.931 3.786 . 0 0 "[ . 1 . 2 .]" 1
1283 1 145 LEU QD 1 162 CYS QB 1.800 . 3.300 2.522 2.091 2.984 . 0 0 "[ . 1 . 2 .]" 1
1284 1 145 LEU QD 1 165 PHE QD 1.800 . 5.000 3.109 2.631 3.715 . 0 0 "[ . 1 . 2 .]" 1
1285 1 145 LEU QD 1 166 MET ME 1.800 . 3.300 3.258 2.159 3.414 0.114 22 0 "[ . 1 . 2 .]" 1
1286 1 146 SER H 1 146 SER HA 1.800 . 2.900 2.849 2.826 2.878 . 0 0 "[ . 1 . 2 .]" 1
1287 1 145 LEU H 1 146 SER H 1.800 . 2.900 2.775 2.675 2.897 . 0 0 "[ . 1 . 2 .]" 1
1288 1 145 LEU QB 1 146 SER H 1.800 . 5.000 2.472 2.344 2.589 . 0 0 "[ . 1 . 2 .]" 1
1289 1 145 LEU QD 1 146 SER H 1.800 . 3.500 3.167 2.589 3.705 0.205 12 0 "[ . 1 . 2 .]" 1
1290 1 145 LEU HG 1 146 SER H 1.800 . 5.000 4.323 3.272 4.755 . 0 0 "[ . 1 . 2 .]" 1
1291 1 147 LYS H 1 147 LYS HA 1.800 . 2.900 2.857 2.845 2.866 . 0 0 "[ . 1 . 2 .]" 1
1292 1 147 LYS H 1 147 LYS QB 1.800 . 2.900 2.317 2.225 2.453 . 0 0 "[ . 1 . 2 .]" 1
1293 1 147 LYS HA 1 147 LYS QD 1.800 . 5.000 3.581 2.192 4.177 . 0 0 "[ . 1 . 2 .]" 1
1294 1 146 SER H 1 147 LYS H 1.800 . 2.900 2.717 2.586 2.818 . 0 0 "[ . 1 . 2 .]" 1
1295 1 146 SER HA 1 147 LYS H 1.800 . 3.500 3.547 3.529 3.572 0.072 21 0 "[ . 1 . 2 .]" 1
1296 1 146 SER QB 1 147 LYS H 1.800 . 3.500 2.794 2.339 3.460 . 0 0 "[ . 1 . 2 .]" 1
1297 1 144 ALA HA 1 147 LYS QB 1.800 . 3.300 2.777 2.373 3.084 . 0 0 "[ . 1 . 2 .]" 1
1298 1 147 LYS H 1 149 LEU H 1.800 . 5.000 4.408 4.237 4.558 . 0 0 "[ . 1 . 2 .]" 1
1299 1 148 ALA H 1 148 ALA HA 1.800 . 2.900 2.867 2.854 2.884 . 0 0 "[ . 1 . 2 .]" 1
1300 1 147 LYS HA 1 148 ALA H 1.800 . 3.500 3.540 3.529 3.554 0.054 12 0 "[ . 1 . 2 .]" 1
1301 1 147 LYS QG 1 148 ALA H 1.800 . 5.000 3.891 3.706 4.328 . 0 0 "[ . 1 . 2 .]" 1
1302 1 148 ALA MB 1 149 LEU QD 1.800 . 5.000 2.911 2.142 3.945 . 0 0 "[ . 1 . 2 .]" 1
1303 1 144 ALA HA 1 148 ALA H 1.800 . 5.000 4.304 3.966 4.495 . 0 0 "[ . 1 . 2 .]" 1
1304 1 144 ALA HA 1 148 ALA MB 1.800 . 5.000 4.923 4.609 5.053 0.053 24 0 "[ . 1 . 2 .]" 1
1305 1 145 LEU HA 1 148 ALA H 1.800 . 3.500 3.399 3.251 3.557 0.057 22 0 "[ . 1 . 2 .]" 1
1306 1 145 LEU HA 1 148 ALA MB 1.800 . 3.300 2.687 2.281 3.047 . 0 0 "[ . 1 . 2 .]" 1
1307 1 145 LEU QD 1 148 ALA H 1.800 . 5.000 4.268 3.779 4.587 . 0 0 "[ . 1 . 2 .]" 1
1308 1 145 LEU QD 1 148 ALA MB 1.800 . 5.000 3.363 2.574 3.820 . 0 0 "[ . 1 . 2 .]" 1
1309 1 146 SER H 1 148 ALA H 1.800 . 5.000 4.141 4.030 4.266 . 0 0 "[ . 1 . 2 .]" 1
1310 1 146 SER HA 1 148 ALA H 1.800 . 5.000 4.297 4.228 4.426 . 0 0 "[ . 1 . 2 .]" 1
1311 1 148 ALA HA 1 151 LYS QB 1.800 . 3.300 3.119 2.808 3.324 0.024 21 0 "[ . 1 . 2 .]" 1
1312 1 115 PHE HZ 1 148 ALA MB 1.800 . 3.300 2.609 2.024 3.185 . 0 0 "[ . 1 . 2 .]" 1
1313 1 119 PHE QE 1 148 ALA H 1.800 . 5.000 3.811 3.306 5.034 0.034 24 0 "[ . 1 . 2 .]" 1
1314 1 119 PHE HZ 1 148 ALA MB 1.800 . 3.300 2.386 2.006 3.141 . 0 0 "[ . 1 . 2 .]" 1
1315 1 149 LEU H 1 149 LEU QB 1.800 . 3.500 2.459 2.189 2.559 . 0 0 "[ . 1 . 2 .]" 1
1316 1 149 LEU H 1 149 LEU HG 1.800 . 3.500 2.419 2.009 3.667 0.167 10 0 "[ . 1 . 2 .]" 1
1317 1 149 LEU H 1 149 LEU QD 1.800 . 3.500 2.727 1.830 3.390 . 0 0 "[ . 1 . 2 .]" 1
1318 1 148 ALA H 1 149 LEU H 1.800 . 2.900 2.756 2.669 2.829 . 0 0 "[ . 1 . 2 .]" 1
1319 1 148 ALA HA 1 149 LEU H 1.800 . 3.500 3.577 3.559 3.592 0.092 3 0 "[ . 1 . 2 .]" 1
1320 1 148 ALA MB 1 149 LEU H 1.800 . 2.900 2.416 2.276 2.618 . 0 0 "[ . 1 . 2 .]" 1
1321 1 145 LEU HA 1 149 LEU H 1.800 . 5.000 4.195 4.014 4.495 . 0 0 "[ . 1 . 2 .]" 1
1322 1 145 LEU QD 1 149 LEU H 1.800 . 5.000 3.418 3.099 3.728 . 0 0 "[ . 1 . 2 .]" 1
1323 1 145 LEU QD 1 149 LEU QD 1.800 . 3.300 1.947 1.821 2.305 . 0 0 "[ . 1 . 2 .]" 1
1324 1 146 SER HA 1 149 LEU H 1.800 . 3.500 3.535 3.494 3.578 0.078 3 0 "[ . 1 . 2 .]" 1
1325 1 35 ILE MG 1 149 LEU QD 1.800 . 5.000 3.109 2.179 3.876 . 0 0 "[ . 1 . 2 .]" 1
1326 1 149 LEU QD 1 154 PHE QB 1.800 . 5.000 3.269 2.578 3.689 . 0 0 "[ . 1 . 2 .]" 1
1327 1 149 LEU H 1 157 VAL QG 1.800 . 5.000 4.255 3.716 4.877 . 0 0 "[ . 1 . 2 .]" 1
1328 1 149 LEU QD 1 157 VAL QG 1.800 . 5.000 2.507 1.998 3.169 . 0 0 "[ . 1 . 2 .]" 1
1329 1 32 PHE QD 1 149 LEU H 1.800 . 5.000 4.475 3.759 5.000 . 0 0 "[ . 1 . 2 .]" 1
1330 1 32 PHE QD 1 149 LEU QD 1.800 . 5.000 2.679 2.068 3.410 . 0 0 "[ . 1 . 2 .]" 1
1331 1 150 LYS H 1 150 LYS HA 1.800 . 2.900 2.846 2.837 2.863 . 0 0 "[ . 1 . 2 .]" 1
1332 1 150 LYS H 1 150 LYS QB 1.800 . 2.900 2.301 2.242 2.466 . 0 0 "[ . 1 . 2 .]" 1
1333 1 150 LYS H 1 150 LYS QG 1.800 . 4.000 3.704 2.177 4.047 0.047 13 0 "[ . 1 . 2 .]" 1
1334 1 149 LEU H 1 150 LYS H 1.800 . 2.900 2.637 2.561 2.687 . 0 0 "[ . 1 . 2 .]" 1
1335 1 145 LEU QD 1 150 LYS H 1.800 . 5.000 5.139 5.030 5.272 0.272 12 0 "[ . 1 . 2 .]" 1
1336 1 146 SER HA 1 150 LYS H 1.800 . 5.000 4.007 3.693 4.441 . 0 0 "[ . 1 . 2 .]" 1
1337 1 147 LYS HA 1 150 LYS H 1.800 . 3.500 3.511 3.402 3.596 0.096 12 0 "[ . 1 . 2 .]" 1
1338 1 147 LYS HA 1 150 LYS QB 1.800 . 3.300 2.542 2.219 2.833 . 0 0 "[ . 1 . 2 .]" 1
1339 1 150 LYS HA 1 153 GLY H 1.800 . 3.500 3.411 3.201 3.550 0.050 12 0 "[ . 1 . 2 .]" 1
1340 1 150 LYS HA 1 154 PHE H 1.800 . 3.500 3.100 2.833 3.388 . 0 0 "[ . 1 . 2 .]" 1
1341 1 150 LYS QB 1 157 VAL QG 1.800 . 5.000 2.831 2.232 4.209 . 0 0 "[ . 1 . 2 .]" 1
1342 1 150 LYS HG3 1 157 VAL QG 1.800 . 5.000 3.298 2.308 4.421 . 0 0 "[ . 1 . 2 .]" 1
1343 1 150 LYS HG2 1 157 VAL QG 1.800 . 5.000 4.156 2.098 4.767 . 0 0 "[ . 1 . 2 .]" 1
1344 1 151 LYS H 1 151 LYS HA 1.800 . 2.900 2.852 2.840 2.867 . 0 0 "[ . 1 . 2 .]" 1
1345 1 151 LYS H 1 151 LYS QB 1.800 . 2.900 2.315 2.254 2.544 . 0 0 "[ . 1 . 2 .]" 1
1346 1 150 LYS H 1 151 LYS H 1.800 . 2.900 2.750 2.678 2.792 . 0 0 "[ . 1 . 2 .]" 1
1347 1 150 LYS QB 1 151 LYS H 1.800 . 3.500 2.565 2.414 2.763 . 0 0 "[ . 1 . 2 .]" 1
1348 1 147 LYS HA 1 151 LYS H 1.800 . 5.000 4.276 3.900 4.715 . 0 0 "[ . 1 . 2 .]" 1
1349 1 148 ALA HA 1 151 LYS H 1.800 . 3.500 3.533 3.385 3.615 0.115 3 0 "[ . 1 . 2 .]" 1
1350 1 152 ARG H 1 152 ARG HA 1.800 . 2.800 2.860 2.851 2.875 0.075 21 0 "[ . 1 . 2 .]" 1
1351 1 152 ARG H 1 152 ARG HE 1.800 . 5.000 4.666 4.017 5.057 0.057 16 0 "[ . 1 . 2 .]" 1
1352 1 151 LYS H 1 152 ARG H 1.800 . 2.900 2.699 2.618 2.801 . 0 0 "[ . 1 . 2 .]" 1
1353 1 151 LYS HA 1 152 ARG H 1.800 . 3.500 3.542 3.523 3.573 0.073 6 0 "[ . 1 . 2 .]" 1
1354 1 151 LYS QB 1 152 ARG H 1.800 . 3.500 2.597 2.542 2.718 . 0 0 "[ . 1 . 2 .]" 1
1355 1 151 LYS QG 1 152 ARG H 1.800 . 5.000 3.812 3.651 4.133 . 0 0 "[ . 1 . 2 .]" 1
1356 1 149 LEU HA 1 152 ARG H 1.800 . 5.000 3.328 3.174 3.517 . 0 0 "[ . 1 . 2 .]" 1
1357 1 149 LEU QD 1 152 ARG H 1.800 . 5.000 4.684 4.313 5.009 0.009 25 0 "[ . 1 . 2 .]" 1
1358 1 150 LYS H 1 152 ARG H 1.800 . 5.000 4.210 4.032 4.409 . 0 0 "[ . 1 . 2 .]" 1
1359 1 152 ARG H 1 154 PHE H 1.800 . 5.000 3.914 3.729 4.092 . 0 0 "[ . 1 . 2 .]" 1
1360 1 101 ALA MB 1 152 ARG H 1.800 . 6.000 5.701 5.335 6.051 0.051 12 0 "[ . 1 . 2 .]" 1
1361 1 153 GLY H 1 153 GLY QA 1.800 . 2.700 2.338 2.304 2.406 . 0 0 "[ . 1 . 2 .]" 1
1362 1 152 ARG H 1 153 GLY H 1.800 . 2.900 2.616 2.570 2.648 . 0 0 "[ . 1 . 2 .]" 1
1363 1 152 ARG QB 1 153 GLY H 1.800 . 3.500 3.002 2.963 3.066 . 0 0 "[ . 1 . 2 .]" 1
1364 1 151 LYS H 1 153 GLY H 1.800 . 4.000 3.990 3.919 4.041 0.041 16 0 "[ . 1 . 2 .]" 1
1365 1 151 LYS HA 1 153 GLY H 1.800 . 5.000 3.814 3.718 3.973 . 0 0 "[ . 1 . 2 .]" 1
1366 1 101 ALA MB 1 153 GLY H 1.800 . 5.000 5.048 4.902 5.145 0.145 18 0 "[ . 1 . 2 .]" 1
1367 1 101 ALA MB 1 153 GLY QA 1.800 . 5.000 3.948 3.531 4.444 . 0 0 "[ . 1 . 2 .]" 1
1368 1 154 PHE H 1 154 PHE QD 1.800 . 2.900 2.890 2.602 2.996 0.096 6 0 "[ . 1 . 2 .]" 1
1369 1 153 GLY H 1 154 PHE H 1.800 . 2.900 2.137 1.939 2.290 . 0 0 "[ . 1 . 2 .]" 1
1370 1 153 GLY QA 1 154 PHE H 1.800 . 3.500 2.873 2.782 2.948 . 0 0 "[ . 1 . 2 .]" 1
1371 1 150 LYS H 1 154 PHE H 1.800 . 5.000 4.938 4.771 5.081 0.081 23 0 "[ . 1 . 2 .]" 1
1372 1 154 PHE H 1 157 VAL QG 1.800 . 5.000 3.947 3.545 4.285 . 0 0 "[ . 1 . 2 .]" 1
1373 1 101 ALA MB 1 154 PHE H 1.800 . 5.000 4.761 4.169 5.048 0.048 10 0 "[ . 1 . 2 .]" 1
1374 1 102 TYR QD 1 154 PHE QE 1.800 . 5.000 4.691 4.055 5.148 0.148 11 0 "[ . 1 . 2 .]" 1
1375 1 155 LYS H 1 155 LYS QB 1.800 . 2.900 2.439 2.276 2.554 . 0 0 "[ . 1 . 2 .]" 1
1376 1 154 PHE H 1 155 LYS H 1.800 . 5.000 4.578 4.509 4.649 . 0 0 "[ . 1 . 2 .]" 1
1377 1 154 PHE HA 1 155 LYS H 1.800 . 2.700 2.208 2.175 2.250 . 0 0 "[ . 1 . 2 .]" 1
1378 1 154 PHE QD 1 155 LYS H 1.800 . 4.000 3.738 3.136 4.129 0.129 24 0 "[ . 1 . 2 .]" 1
1379 1 155 LYS H 1 157 VAL QG 1.800 . 5.000 3.932 3.299 4.907 . 0 0 "[ . 1 . 2 .]" 1
1380 1 98 ASN HA 1 155 LYS H 1.800 . 5.000 4.858 4.667 5.039 0.039 13 0 "[ . 1 . 2 .]" 1
1381 1 155 LYS H 1 156 PHE H 1.800 . 5.000 4.545 4.440 4.615 . 0 0 "[ . 1 . 2 .]" 1
1382 1 155 LYS HA 1 156 PHE H 1.800 . 2.900 2.518 2.357 2.733 . 0 0 "[ . 1 . 2 .]" 1
1383 1 155 LYS QB 1 156 PHE H 1.800 . 3.500 2.360 1.958 3.396 . 0 0 "[ . 1 . 2 .]" 1
1384 1 156 PHE H 1 157 VAL QG 1.800 . 5.000 3.631 3.226 4.280 . 0 0 "[ . 1 . 2 .]" 1
1385 1 157 VAL H 1 157 VAL QG 1.800 . 2.900 1.936 1.837 2.139 . 0 0 "[ . 1 . 2 .]" 1
1386 1 156 PHE H 1 157 VAL H 1.800 . 2.900 2.837 2.564 3.005 0.105 22 0 "[ . 1 . 2 .]" 1
1387 1 156 PHE HA 1 157 VAL H 1.800 . 2.700 2.733 2.629 2.893 0.193 6 0 "[ . 1 . 2 .]" 1
1388 1 156 PHE QD 1 157 VAL H 1.800 . 5.000 4.750 4.286 4.934 . 0 0 "[ . 1 . 2 .]" 1
1389 1 154 PHE HA 1 157 VAL QG 1.800 . 5.000 4.200 3.685 4.963 . 0 0 "[ . 1 . 2 .]" 1
1390 1 154 PHE QB 1 157 VAL QG 1.800 . 3.300 2.328 1.937 2.980 . 0 0 "[ . 1 . 2 .]" 1
1391 1 155 LYS HA 1 157 VAL H 1.800 . 5.000 3.678 3.212 3.971 . 0 0 "[ . 1 . 2 .]" 1
1392 1 155 LYS HA 1 157 VAL QG 1.800 . 5.000 3.135 2.699 3.806 . 0 0 "[ . 1 . 2 .]" 1
1393 1 155 LYS QB 1 157 VAL H 1.800 . 5.000 4.680 4.262 5.062 0.062 16 0 "[ . 1 . 2 .]" 1
1394 1 157 VAL H 1 161 ILE MD 1.800 . 5.000 4.000 3.346 4.392 . 0 0 "[ . 1 . 2 .]" 1
1395 1 157 VAL HA 1 161 ILE MD 1.800 . 5.000 2.518 2.089 3.073 . 0 0 "[ . 1 . 2 .]" 1
1396 1 157 VAL QG 1 161 ILE MG 1.800 . 5.000 3.436 2.668 4.253 . 0 0 "[ . 1 . 2 .]" 1
1397 1 35 ILE QG 1 157 VAL QG 1.800 . 5.000 4.157 3.044 5.080 0.080 3 0 "[ . 1 . 2 .]" 1
1398 1 35 ILE MG 1 157 VAL QG 1.800 . 5.000 4.125 2.891 5.025 0.025 2 0 "[ . 1 . 2 .]" 1
1399 1 39 GLY QA 1 157 VAL H 1.800 . 5.000 3.957 3.786 4.073 . 0 0 "[ . 1 . 2 .]" 1
1400 1 149 LEU HA 1 157 VAL QG 1.800 . 5.000 4.347 4.039 4.763 . 0 0 "[ . 1 . 2 .]" 1
1401 1 150 LYS H 1 157 VAL QG 1.800 . 5.000 3.299 2.835 3.792 . 0 0 "[ . 1 . 2 .]" 1
1402 1 150 LYS HA 1 157 VAL QG 1.800 . 5.000 2.862 2.436 3.499 . 0 0 "[ . 1 . 2 .]" 1
1403 1 150 LYS QE 1 157 VAL QG 1.800 . 5.000 4.198 2.048 5.028 0.028 11 0 "[ . 1 . 2 .]" 1
1404 1 158 GLY H 1 158 GLY QA 1.800 . 2.700 2.231 2.226 2.233 . 0 0 "[ . 1 . 2 .]" 1
1405 1 157 VAL HA 1 158 GLY H 1.800 . 3.500 3.039 3.025 3.051 . 0 0 "[ . 1 . 2 .]" 1
1406 1 157 VAL QG 1 158 GLY H 1.800 . 5.000 3.238 3.136 3.703 . 0 0 "[ . 1 . 2 .]" 1
1407 1 156 PHE HA 1 158 GLY H 1.800 . 3.500 3.246 3.129 3.340 . 0 0 "[ . 1 . 2 .]" 1
1408 1 156 PHE H 1 158 GLY H 1.800 . 5.000 4.718 4.491 4.946 . 0 0 "[ . 1 . 2 .]" 1
1409 1 158 GLY H 1 160 THR H 1.800 . 5.000 5.142 5.091 5.215 0.215 15 0 "[ . 1 . 2 .]" 1
1410 1 158 GLY H 1 161 ILE MD 1.800 . 3.500 2.784 1.991 3.465 . 0 0 "[ . 1 . 2 .]" 1
1411 1 158 GLY H 1 161 ILE H 1.800 . 5.000 4.182 3.963 4.408 . 0 0 "[ . 1 . 2 .]" 1
1412 1 158 GLY H 1 161 ILE QG 1.800 . 5.000 4.047 3.407 4.648 . 0 0 "[ . 1 . 2 .]" 1
1413 1 159 THR MG 1 160 THR HA 1.800 . 5.000 3.621 2.988 3.896 . 0 0 "[ . 1 . 2 .]" 1
1414 1 138 SER HA 1 159 THR MG 1.800 . 5.000 3.644 2.365 4.600 . 0 0 "[ . 1 . 2 .]" 1
1415 1 138 SER QB 1 159 THR MG 1.800 . 5.000 3.807 2.668 4.859 . 0 0 "[ . 1 . 2 .]" 1
1416 1 160 THR H 1 160 THR HA 1.800 . 2.900 2.878 2.850 2.902 0.002 22 0 "[ . 1 . 2 .]" 1
1417 1 159 THR HB 1 160 THR H 1.800 . 3.500 2.763 2.394 3.407 . 0 0 "[ . 1 . 2 .]" 1
1418 1 159 THR H 1 160 THR H 1.800 . 3.500 2.728 2.650 2.764 . 0 0 "[ . 1 . 2 .]" 1
1419 1 159 THR HA 1 160 THR H 1.800 . 3.500 3.512 3.479 3.535 0.035 23 0 "[ . 1 . 2 .]" 1
1420 1 160 THR H 1 161 ILE HB 1.800 . 5.000 4.658 4.457 4.796 . 0 0 "[ . 1 . 2 .]" 1
1421 1 160 THR H 1 161 ILE MD 1.800 . 5.000 4.384 3.535 5.133 0.133 19 0 "[ . 1 . 2 .]" 1
1422 1 161 ILE H 1 161 ILE HB 1.800 . 2.900 2.296 2.124 2.451 . 0 0 "[ . 1 . 2 .]" 1
1423 1 160 THR H 1 161 ILE H 1.800 . 3.500 2.670 2.572 2.774 . 0 0 "[ . 1 . 2 .]" 1
1424 1 160 THR HA 1 161 ILE H 1.800 . 4.000 3.561 3.540 3.581 . 0 0 "[ . 1 . 2 .]" 1
1425 1 160 THR HB 1 161 ILE H 1.800 . 4.000 3.329 2.426 3.995 . 0 0 "[ . 1 . 2 .]" 1
1426 1 157 VAL HA 1 161 ILE MG 1.800 . 5.000 2.681 2.093 3.447 . 0 0 "[ . 1 . 2 .]" 1
1427 1 157 VAL HA 1 161 ILE MD 1.800 . 5.000 3.694 2.255 4.662 . 0 0 "[ . 1 . 2 .]" 1
1428 1 157 VAL QG 1 161 ILE MD 1.800 . 5.000 4.363 3.486 5.007 0.007 4 0 "[ . 1 . 2 .]" 1
1429 1 159 THR HA 1 161 ILE H 1.800 . 5.000 4.438 4.266 4.607 . 0 0 "[ . 1 . 2 .]" 1
1430 1 35 ILE HB 1 161 ILE QG 1.800 . 5.000 5.001 4.289 5.185 0.185 20 0 "[ . 1 . 2 .]" 1
1431 1 41 GLN QB 1 161 ILE MD 1.800 . 5.000 4.366 3.313 5.014 0.014 10 0 "[ . 1 . 2 .]" 1
1432 1 39 GLY QA 1 161 ILE MD 1.800 . 5.000 2.885 1.998 4.351 . 0 0 "[ . 1 . 2 .]" 1
1433 1 41 GLN QG 1 161 ILE MD 1.800 . 5.000 3.890 2.786 5.184 0.184 19 0 "[ . 1 . 2 .]" 1
1434 1 42 ALA HA 1 161 ILE MD 1.800 . 5.000 3.618 2.364 4.623 . 0 0 "[ . 1 . 2 .]" 1
1435 1 156 PHE HA 1 161 ILE MD 1.800 . 5.000 3.648 2.779 4.466 . 0 0 "[ . 1 . 2 .]" 1
1436 1 156 PHE QD 1 161 ILE MD 1.800 . 5.000 4.019 2.490 5.017 0.017 24 0 "[ . 1 . 2 .]" 1
1437 1 162 CYS H 1 162 CYS HA 1.800 . 2.900 2.860 2.830 2.886 . 0 0 "[ . 1 . 2 .]" 1
1438 1 161 ILE H 1 162 CYS H 1.800 . 2.900 2.640 2.559 2.753 . 0 0 "[ . 1 . 2 .]" 1
1439 1 161 ILE HA 1 162 CYS H 1.800 . 3.500 3.542 3.523 3.566 0.066 20 0 "[ . 1 . 2 .]" 1
1440 1 161 ILE HB 1 162 CYS H 1.800 . 3.500 2.774 2.684 2.885 . 0 0 "[ . 1 . 2 .]" 1
1441 1 161 ILE QG 1 162 CYS H 1.800 . 5.000 4.358 4.109 4.561 . 0 0 "[ . 1 . 2 .]" 1
1442 1 161 ILE MD 1 162 CYS H 1.800 . 3.500 3.037 2.506 3.429 . 0 0 "[ . 1 . 2 .]" 1
1443 1 159 THR HA 1 162 CYS H 1.800 . 3.500 3.374 3.210 3.522 0.022 4 0 "[ . 1 . 2 .]" 1
1444 1 160 THR H 1 162 CYS H 1.800 . 5.000 4.053 3.892 4.270 . 0 0 "[ . 1 . 2 .]" 1
1445 1 145 LEU QD 1 162 CYS H 1.800 . 5.000 5.020 4.869 5.113 0.113 21 0 "[ . 1 . 2 .]" 1
1446 1 35 ILE MD 1 162 CYS HA 1.800 . 5.000 2.823 2.501 3.553 . 0 0 "[ . 1 . 2 .]" 1
1447 1 163 TYR H 1 163 TYR HA 1.800 . 2.700 2.843 2.832 2.866 0.166 19 0 "[ . 1 . 2 .]" 1
1448 1 162 CYS H 1 163 TYR H 1.800 . 2.900 2.705 2.598 2.787 . 0 0 "[ . 1 . 2 .]" 1
1449 1 162 CYS HA 1 163 TYR H 1.800 . 3.500 3.564 3.552 3.580 0.080 15 0 "[ . 1 . 2 .]" 1
1450 1 160 THR HA 1 163 TYR H 1.800 . 3.500 3.542 3.461 3.593 0.093 13 0 "[ . 1 . 2 .]" 1
1451 1 160 THR HA 1 163 TYR QD 1.800 . 5.000 4.677 4.348 5.015 0.015 7 0 "[ . 1 . 2 .]" 1
1452 1 161 ILE H 1 163 TYR H 1.800 . 5.000 4.228 4.060 4.390 . 0 0 "[ . 1 . 2 .]" 1
1453 1 136 PRO HA 1 163 TYR QD 1.800 . 5.000 4.611 4.313 4.929 . 0 0 "[ . 1 . 2 .]" 1
1454 1 136 PRO QD 1 163 TYR QD 1.800 . 5.000 4.218 3.345 4.891 . 0 0 "[ . 1 . 2 .]" 1
1455 1 133 SER QB 1 163 TYR QD 1.800 . 5.000 5.038 4.860 5.125 0.125 1 0 "[ . 1 . 2 .]" 1
1456 1 137 THR HB 1 163 TYR QE 1.800 . 5.000 4.534 3.312 5.044 0.044 10 0 "[ . 1 . 2 .]" 1
1457 1 139 THR MG 1 163 TYR QD 1.800 . 3.300 2.848 2.131 3.242 . 0 0 "[ . 1 . 2 .]" 1
1458 1 163 TYR QD 1 166 MET ME 1.800 . 5.000 4.862 4.117 5.033 0.033 5 0 "[ . 1 . 2 .]" 1
1459 1 163 TYR QD 1 172 VAL QG 1.800 . 5.000 4.437 3.692 4.946 . 0 0 "[ . 1 . 2 .]" 1
1460 1 163 TYR QE 1 172 VAL QG 1.800 . 5.000 3.597 2.696 4.106 . 0 0 "[ . 1 . 2 .]" 1
1461 1 164 SER H 1 164 SER HA 1.800 . 2.700 2.839 2.828 2.853 0.153 3 0 "[ . 1 . 2 .]" 1
1462 1 164 SER H 1 164 SER QB 1.800 . 3.500 2.406 2.224 2.573 . 0 0 "[ . 1 . 2 .]" 1
1463 1 163 TYR H 1 164 SER H 1.800 . 2.900 2.726 2.632 2.793 . 0 0 "[ . 1 . 2 .]" 1
1464 1 163 TYR HA 1 164 SER H 1.800 . 5.000 3.564 3.535 3.579 . 0 0 "[ . 1 . 2 .]" 1
1465 1 163 TYR QB 1 164 SER H 1.800 . 3.500 2.520 2.433 2.707 . 0 0 "[ . 1 . 2 .]" 1
1466 1 164 SER H 1 165 PHE H 1.800 . 2.900 2.689 2.590 2.826 . 0 0 "[ . 1 . 2 .]" 1
1467 1 160 THR HA 1 164 SER H 1.800 . 5.000 4.170 3.702 4.547 . 0 0 "[ . 1 . 2 .]" 1
1468 1 161 ILE HA 1 164 SER H 1.800 . 3.500 3.466 3.203 3.604 0.104 24 0 "[ . 1 . 2 .]" 1
1469 1 161 ILE MG 1 164 SER H 1.800 . 5.000 4.609 4.323 4.780 . 0 0 "[ . 1 . 2 .]" 1
1470 1 160 THR MG 1 164 SER H 1.800 . 5.000 4.605 3.935 5.073 0.073 6 0 "[ . 1 . 2 .]" 1
1471 1 162 CYS H 1 164 SER H 1.800 . 5.000 4.172 4.041 4.300 . 0 0 "[ . 1 . 2 .]" 1
1472 1 35 ILE MD 1 164 SER H 1.800 . 6.000 5.911 5.660 6.121 0.121 3 0 "[ . 1 . 2 .]" 1
1473 1 165 PHE H 1 165 PHE QB 1.800 . 3.500 2.179 2.042 2.648 . 0 0 "[ . 1 . 2 .]" 1
1474 1 165 PHE H 1 165 PHE QD 1.800 . 5.000 3.905 2.955 4.194 . 0 0 "[ . 1 . 2 .]" 1
1475 1 164 SER HA 1 165 PHE H 1.800 . 5.000 3.538 3.509 3.584 . 0 0 "[ . 1 . 2 .]" 1
1476 1 164 SER QB 1 165 PHE H 1.800 . 3.500 2.734 2.401 3.439 . 0 0 "[ . 1 . 2 .]" 1
1477 1 161 ILE HA 1 165 PHE H 1.800 . 5.000 4.203 3.907 4.761 . 0 0 "[ . 1 . 2 .]" 1
1478 1 162 CYS HA 1 165 PHE H 1.800 . 3.500 3.446 3.343 3.515 0.015 15 0 "[ . 1 . 2 .]" 1
1479 1 163 TYR H 1 165 PHE H 1.800 . 5.000 4.126 3.998 4.420 . 0 0 "[ . 1 . 2 .]" 1
1480 1 162 CYS HA 1 165 PHE QD 1.800 . 5.000 3.545 2.273 4.611 . 0 0 "[ . 1 . 2 .]" 1
1481 1 165 PHE QD 1 168 ALA MB 1.800 . 5.000 4.121 2.814 4.770 . 0 0 "[ . 1 . 2 .]" 1
1482 1 165 PHE QD 1 166 MET HA 1.800 . 5.000 2.958 2.305 4.301 . 0 0 "[ . 1 . 2 .]" 1
1483 1 34 MET QG 1 165 PHE H 1.800 . 5.000 5.037 4.984 5.095 0.095 20 0 "[ . 1 . 2 .]" 1
1484 1 34 MET QG 1 165 PHE QD 1.800 . 3.500 2.534 2.027 3.380 . 0 0 "[ . 1 . 2 .]" 1
1485 1 149 LEU QD 1 165 PHE QD 1.800 . 5.000 4.443 3.284 4.922 . 0 0 "[ . 1 . 2 .]" 1
1486 1 35 ILE MD 1 165 PHE H 1.800 . 5.000 4.431 4.130 5.030 0.030 20 0 "[ . 1 . 2 .]" 1
1487 1 35 ILE QG 1 165 PHE H 1.800 . 6.000 3.822 3.632 4.050 . 0 0 "[ . 1 . 2 .]" 1
1488 1 35 ILE MD 1 165 PHE QD 1.800 . 5.000 3.141 2.324 3.795 . 0 0 "[ . 1 . 2 .]" 1
1489 1 35 ILE MG 1 165 PHE QD 1.800 . 5.000 4.688 3.786 5.137 0.137 20 0 "[ . 1 . 2 .]" 1
1490 1 166 MET H 1 166 MET ME 1.800 . 5.000 4.636 3.845 4.797 . 0 0 "[ . 1 . 2 .]" 1
1491 1 166 MET H 1 167 GLN H 1.800 . 2.900 2.696 2.632 2.769 . 0 0 "[ . 1 . 2 .]" 1
1492 1 162 CYS HA 1 166 MET H 1.800 . 5.000 4.378 4.091 4.621 . 0 0 "[ . 1 . 2 .]" 1
1493 1 163 TYR HA 1 166 MET H 1.800 . 5.000 3.376 3.230 3.572 . 0 0 "[ . 1 . 2 .]" 1
1494 1 163 TYR HA 1 166 MET ME 1.800 . 5.000 4.652 3.580 4.999 . 0 0 "[ . 1 . 2 .]" 1
1495 1 164 SER H 1 166 MET H 1.800 . 5.000 4.254 4.117 4.572 . 0 0 "[ . 1 . 2 .]" 1
1496 1 166 MET HA 1 171 LEU QB 1.800 . 5.000 3.078 2.237 3.832 . 0 0 "[ . 1 . 2 .]" 1
1497 1 141 ALA HA 1 166 MET ME 1.800 . 5.000 4.927 4.514 5.066 0.066 16 0 "[ . 1 . 2 .]" 1
1498 1 166 MET ME 1 171 LEU QB 1.800 . 5.000 2.528 2.123 3.262 . 0 0 "[ . 1 . 2 .]" 1
1499 1 166 MET ME 1 171 LEU HG 1.800 . 5.000 4.135 2.817 4.842 . 0 0 "[ . 1 . 2 .]" 1
1500 1 166 MET H 1 171 LEU QD 1.800 . 5.000 4.844 4.094 5.142 0.142 1 0 "[ . 1 . 2 .]" 1
1501 1 166 MET HA 1 171 LEU QD 1.800 . 3.300 2.900 2.245 3.318 0.018 17 0 "[ . 1 . 2 .]" 1
1502 1 166 MET H 1 172 VAL QG 1.800 . 5.000 4.901 4.468 5.150 0.150 8 0 "[ . 1 . 2 .]" 1
1503 1 166 MET HA 1 172 VAL QG 1.800 . 5.000 3.971 3.390 4.247 . 0 0 "[ . 1 . 2 .]" 1
1504 1 166 MET ME 1 172 VAL H 1.800 . 5.000 4.427 3.857 5.096 0.096 19 0 "[ . 1 . 2 .]" 1
1505 1 167 GLN H 1 167 GLN HA 1.800 . 2.700 2.847 2.828 2.905 0.205 6 0 "[ . 1 . 2 .]" 1
1506 1 166 MET HA 1 167 GLN H 1.800 . 3.500 3.545 3.530 3.569 0.069 6 0 "[ . 1 . 2 .]" 1
1507 1 163 TYR QD 1 167 GLN H 1.800 . 5.000 4.934 4.743 5.079 0.079 25 0 "[ . 1 . 2 .]" 1
1508 1 164 SER HA 1 167 GLN H 1.800 . 3.500 3.409 3.292 3.601 0.101 6 0 "[ . 1 . 2 .]" 1
1509 1 167 GLN H 1 172 VAL QG 1.800 . 5.000 4.015 3.513 4.275 . 0 0 "[ . 1 . 2 .]" 1
1510 1 168 ALA H 1 168 ALA HA 1.800 . 2.700 2.883 2.833 2.908 0.208 20 0 "[ . 1 . 2 .]" 1
1511 1 167 GLN HA 1 168 ALA H 1.800 . 3.500 3.555 3.542 3.575 0.075 1 0 "[ . 1 . 2 .]" 1
1512 1 167 GLN QB 1 168 ALA H 1.800 . 3.500 2.505 2.296 3.386 . 0 0 "[ . 1 . 2 .]" 1
1513 1 168 ALA H 1 169 CYS H 1.800 . 2.900 2.602 2.462 2.895 . 0 0 "[ . 1 . 2 .]" 1
1514 1 165 PHE HA 1 168 ALA H 1.800 . 5.000 3.482 3.299 3.664 . 0 0 "[ . 1 . 2 .]" 1
1515 1 165 PHE HA 1 168 ALA MB 1.800 . 3.300 2.922 2.589 3.244 . 0 0 "[ . 1 . 2 .]" 1
1516 1 164 SER HA 1 168 ALA H 1.800 . 5.000 4.349 3.917 4.709 . 0 0 "[ . 1 . 2 .]" 1
1517 1 169 CYS QB 1 171 LEU QD 1.800 . 5.000 2.620 1.812 3.319 . 0 0 "[ . 1 . 2 .]" 1
1518 1 31 LEU QD 1 169 CYS QB 1.800 . 3.300 2.537 2.002 3.327 0.027 18 0 "[ . 1 . 2 .]" 1
1519 1 169 CYS H 1 170 GLY H 1.800 . 2.900 2.719 2.583 2.900 . 0 0 "[ . 1 . 2 .]" 1
1520 1 170 GLY H 1 171 LEU QD 1.800 . 5.000 3.993 2.849 4.636 . 0 0 "[ . 1 . 2 .]" 1
1521 1 168 ALA H 1 170 GLY H 1.800 . 5.000 4.080 3.922 4.518 . 0 0 "[ . 1 . 2 .]" 1
1522 1 22 GLY QA 1 170 GLY H 1.800 . 5.000 4.022 3.335 4.482 . 0 0 "[ . 1 . 2 .]" 1
1523 1 171 LEU H 1 171 LEU HG 1.800 . 5.000 2.810 1.895 4.392 . 0 0 "[ . 1 . 2 .]" 1
1524 1 171 LEU H 1 171 LEU QB 1.800 . 3.500 2.448 2.070 3.447 . 0 0 "[ . 1 . 2 .]" 1
1525 1 171 LEU H 1 171 LEU QD 1.800 . 3.500 2.543 1.768 3.099 0.032 18 0 "[ . 1 . 2 .]" 1
1526 1 171 LEU HA 1 171 LEU HG 1.800 . 3.300 2.924 2.248 3.584 0.284 5 0 "[ . 1 . 2 .]" 1
1527 1 170 GLY H 1 171 LEU H 1.800 . 3.500 2.341 1.894 3.723 0.223 12 0 "[ . 1 . 2 .]" 1
1528 1 166 MET HA 1 171 LEU H 1.800 . 5.000 2.622 2.296 4.789 . 0 0 "[ . 1 . 2 .]" 1
1529 1 169 CYS H 1 171 LEU QD 1.800 . 5.000 4.629 4.067 5.061 0.061 17 0 "[ . 1 . 2 .]" 1
1530 1 113 ALA HA 1 171 LEU QD 1.800 . 5.000 4.560 4.084 4.813 . 0 0 "[ . 1 . 2 .]" 1
1531 1 116 VAL QG 1 171 LEU QD 1.800 . 4.000 2.141 1.807 2.892 . 0 0 "[ . 1 . 2 .]" 1
1532 1 117 TRP HA 1 171 LEU QD 1.800 . 5.000 3.164 2.529 3.729 . 0 0 "[ . 1 . 2 .]" 1
1533 1 169 CYS HA 1 171 LEU QD 1.800 . 5.000 4.470 3.809 5.102 0.102 12 0 "[ . 1 . 2 .]" 1
1534 1 120 VAL QG 1 171 LEU QD 1.800 . 3.300 2.393 1.958 2.745 . 0 0 "[ . 1 . 2 .]" 1
1535 1 124 PRO QB 1 171 LEU QD 1.800 . 5.000 4.631 3.884 5.045 0.045 17 0 "[ . 1 . 2 .]" 1
1536 1 124 PRO QG 1 171 LEU QD 1.800 . 5.000 4.650 4.005 5.104 0.104 6 0 "[ . 1 . 2 .]" 1
1537 1 166 MET ME 1 171 LEU QD 1.800 . 5.000 2.444 1.988 3.853 . 0 0 "[ . 1 . 2 .]" 1
1538 1 172 VAL H 1 172 VAL HB 1.800 . 3.500 3.495 2.480 3.832 0.332 12 0 "[ . 1 . 2 .]" 1
1539 1 172 VAL H 1 172 VAL QG 1.800 . 3.500 1.939 1.783 2.859 0.017 8 0 "[ . 1 . 2 .]" 1
1540 1 172 VAL HA 1 172 VAL QG 1.800 . 5.000 2.240 2.104 2.348 . 0 0 "[ . 1 . 2 .]" 1
1541 1 171 LEU H 1 172 VAL H 1.800 . 2.900 2.719 2.639 3.198 0.298 12 0 "[ . 1 . 2 .]" 1
1542 1 171 LEU HA 1 172 VAL H 1.800 . 5.000 3.519 3.493 3.541 . 0 0 "[ . 1 . 2 .]" 1
1543 1 171 LEU QB 1 172 VAL H 1.800 . 3.500 2.680 2.587 2.857 . 0 0 "[ . 1 . 2 .]" 1
1544 1 171 LEU QD 1 172 VAL H 1.800 . 5.000 3.983 3.694 4.122 . 0 0 "[ . 1 . 2 .]" 1
1545 1 166 MET HA 1 172 VAL H 1.800 . 5.000 4.094 3.377 4.736 . 0 0 "[ . 1 . 2 .]" 1
1546 1 120 VAL QG 1 172 VAL QG 1.800 . 5.000 4.003 2.925 4.885 . 0 0 "[ . 1 . 2 .]" 1
1547 1 125 GLN QB 1 172 VAL H 1.800 . 5.000 4.889 4.595 5.061 0.061 8 0 "[ . 1 . 2 .]" 1
1548 1 125 GLN QG 1 172 VAL QG 1.800 . 5.000 3.440 2.666 4.136 . 0 0 "[ . 1 . 2 .]" 1
1549 1 166 MET ME 1 172 VAL QG 1.800 . 3.300 2.780 2.001 3.299 . 0 0 "[ . 1 . 2 .]" 1
1550 1 167 GLN HA 1 172 VAL QG 1.800 . 3.300 3.076 2.449 3.395 0.095 18 0 "[ . 1 . 2 .]" 1
1551 1 173 ASN H 1 173 ASN QB 1.800 . 3.500 2.420 2.295 2.517 . 0 0 "[ . 1 . 2 .]" 1
1552 1 172 VAL HA 1 173 ASN H 1.800 . 2.500 2.286 2.206 2.377 . 0 0 "[ . 1 . 2 .]" 1
1553 1 172 VAL HB 1 173 ASN H 1.800 . 5.000 3.442 2.793 4.321 . 0 0 "[ . 1 . 2 .]" 1
1554 1 172 VAL QG 1 173 ASN H 1.800 . 3.500 3.016 2.138 3.519 0.019 3 0 "[ . 1 . 2 .]" 1
1555 1 126 MET H 1 173 ASN H 1.800 . 5.000 4.532 4.183 4.845 . 0 0 "[ . 1 . 2 .]" 1
1556 1 126 MET HA 1 173 ASN H 1.800 . 3.500 2.332 1.960 2.669 . 0 0 "[ . 1 . 2 .]" 1
1557 1 173 ASN HA 1 174 ASP H 1.800 . 2.500 2.214 2.195 2.245 . 0 0 "[ . 1 . 2 .]" 1
1558 1 172 VAL QG 1 174 ASP H 1.800 . 5.000 3.571 3.271 4.095 . 0 0 "[ . 1 . 2 .]" 1
1559 1 135 ILE MG 1 174 ASP HA 1.800 . 5.000 4.548 3.718 5.130 0.130 24 0 "[ . 1 . 2 .]" 1
1560 1 135 ILE MD 1 174 ASP HA 1.800 . 5.000 3.671 2.578 4.633 . 0 0 "[ . 1 . 2 .]" 1
1561 1 174 ASP H 1 175 HIS H 1.800 . 5.000 4.023 3.860 4.456 . 0 0 "[ . 1 . 2 .]" 1
1562 1 174 ASP HA 1 175 HIS H 1.800 . 4.000 2.349 2.263 2.598 . 0 0 "[ . 1 . 2 .]" 1
1563 1 175 HIS H 1 176 VAL QG 1.800 . 5.000 4.478 3.438 5.075 0.075 2 0 "[ . 1 . 2 .]" 1
1564 1 127 THR MG 1 175 HIS H 1.800 . 5.000 2.991 1.781 3.838 0.019 7 0 "[ . 1 . 2 .]" 1
1565 1 175 HIS H 1 182 TYR QD 1.800 . 5.000 4.635 3.852 5.149 0.149 3 0 "[ . 1 . 2 .]" 1
1566 1 175 HIS H 1 176 VAL H 1.800 . 5.000 2.696 1.690 4.382 0.110 9 0 "[ . 1 . 2 .]" 1
1567 1 176 VAL QG 1 177 VAL QG 1.800 . 5.000 3.035 2.247 3.971 . 0 0 "[ . 1 . 2 .]" 1
1568 1 176 VAL QG 1 179 CYS H 1.800 . 3.500 2.616 1.706 3.456 0.094 15 0 "[ . 1 . 2 .]" 1
1569 1 176 VAL QG 1 179 CYS QB 1.800 . 5.000 2.478 2.022 3.226 . 0 0 "[ . 1 . 2 .]" 1
1570 1 4 CYS HA 1 176 VAL QG 1.800 . 5.000 2.749 2.007 3.773 . 0 0 "[ . 1 . 2 .]" 1
1571 1 4 CYS H 1 176 VAL QG 1.800 . 5.000 4.336 3.628 5.065 0.065 6 0 "[ . 1 . 2 .]" 1
1572 1 129 ALA MB 1 176 VAL HA 1.800 . 5.000 4.010 3.113 4.931 . 0 0 "[ . 1 . 2 .]" 1
1573 1 129 ALA H 1 176 VAL QG 1.800 . 5.000 5.002 4.749 5.178 0.178 18 0 "[ . 1 . 2 .]" 1
1574 1 130 THR HA 1 176 VAL QG 1.800 . 5.000 3.295 2.809 3.833 . 0 0 "[ . 1 . 2 .]" 1
1575 1 130 THR HB 1 176 VAL QG 1.800 . 5.000 4.987 4.589 5.145 0.145 4 0 "[ . 1 . 2 .]" 1
1576 1 176 VAL H 1 182 TYR QB 1.800 . 5.000 4.359 2.952 5.266 0.266 8 0 "[ . 1 . 2 .]" 1
1577 1 176 VAL HA 1 177 VAL QG 1.800 . 5.000 3.696 3.232 4.120 . 0 0 "[ . 1 . 2 .]" 1
1578 1 128 GLN QB 1 177 VAL QG 1.800 . 5.000 3.805 2.385 4.823 . 0 0 "[ . 1 . 2 .]" 1
1579 1 130 THR HA 1 177 VAL QG 1.800 . 3.300 2.523 2.179 3.288 . 0 0 "[ . 1 . 2 .]" 1
1580 1 130 THR HB 1 177 VAL QG 1.800 . 5.000 4.637 3.947 5.058 0.058 18 0 "[ . 1 . 2 .]" 1
1581 1 130 THR MG 1 177 VAL QG 1.800 . 3.300 2.895 2.142 3.386 0.086 3 0 "[ . 1 . 2 .]" 1
1582 1 177 VAL QG 1 182 TYR QD 1.800 . 5.000 3.617 2.120 4.947 . 0 0 "[ . 1 . 2 .]" 1
1583 1 177 VAL HA 1 179 CYS H 1.800 . 5.000 3.990 3.281 5.278 0.278 15 0 "[ . 1 . 2 .]" 1
1584 1 177 VAL QG 1 179 CYS H 1.800 . 5.000 4.363 3.976 5.031 0.031 23 0 "[ . 1 . 2 .]" 1
1585 1 179 CYS H 1 180 CYS H 1.800 . 5.000 3.737 2.455 4.620 . 0 0 "[ . 1 . 2 .]" 1
1586 1 179 CYS HA 1 180 CYS H 1.800 . 2.900 2.585 2.166 3.199 0.299 9 0 "[ . 1 . 2 .]" 1
1587 1 176 VAL QG 1 180 CYS H 1.800 . 5.000 4.944 3.885 5.375 0.375 17 0 "[ . 1 . 2 .]" 1
1588 1 1 MET QG 1 180 CYS H 1.800 . 5.000 4.583 3.314 5.099 0.099 18 0 "[ . 1 . 2 .]" 1
1589 1 2 GLU QG 1 180 CYS H 1.800 . 5.000 4.476 2.896 5.115 0.115 22 0 "[ . 1 . 2 .]" 1
1590 1 3 ARG HA 1 180 CYS H 1.800 . 5.000 4.300 2.961 5.121 0.121 9 0 "[ . 1 . 2 .]" 1
1591 1 181 CYS H 1 181 CYS HA 1.800 . 2.700 2.833 2.726 2.967 0.267 15 0 "[ . 1 . 2 .]" 1
1592 1 181 CYS H 1 181 CYS QB 1.800 . 3.500 2.548 2.068 3.322 . 0 0 "[ . 1 . 2 .]" 1
1593 1 180 CYS H 1 181 CYS H 1.800 . 5.000 3.521 2.668 4.260 . 0 0 "[ . 1 . 2 .]" 1
1594 1 180 CYS HA 1 181 CYS H 1.800 . 3.500 3.479 2.170 3.580 0.080 1 0 "[ . 1 . 2 .]" 1
1595 1 180 CYS QB 1 181 CYS H 1.800 . 3.300 2.446 1.802 3.605 0.305 18 0 "[ . 1 . 2 .]" 1
1596 1 178 GLY QA 1 181 CYS H 1.800 . 5.000 4.225 3.499 5.050 0.050 18 0 "[ . 1 . 2 .]" 1
1597 1 182 TYR H 1 182 TYR QB 1.800 . 2.900 2.427 2.229 2.535 . 0 0 "[ . 1 . 2 .]" 1
1598 1 129 ALA HA 1 182 TYR QE 1.800 . 5.000 4.527 4.384 4.864 . 0 0 "[ . 1 . 2 .]" 1
1599 1 181 CYS H 1 182 TYR H 1.800 . 2.900 2.630 1.772 2.873 0.028 18 0 "[ . 1 . 2 .]" 1
1600 1 181 CYS HA 1 182 TYR H 1.800 . 3.500 3.323 2.482 3.571 0.071 15 0 "[ . 1 . 2 .]" 1
1601 1 179 CYS H 1 182 TYR H 1.800 . 5.000 3.955 3.034 5.025 0.025 15 0 "[ . 1 . 2 .]" 1
1602 1 180 CYS H 1 182 TYR H 1.800 . 5.000 4.196 3.418 5.069 0.069 16 0 "[ . 1 . 2 .]" 1
1603 1 127 THR MG 1 182 TYR QD 1.800 . 5.000 4.642 3.537 5.126 0.126 12 0 "[ . 1 . 2 .]" 1
1604 1 127 THR MG 1 182 TYR QE 1.800 . 5.000 3.690 2.838 4.643 . 0 0 "[ . 1 . 2 .]" 1
1605 1 128 GLN QG 1 182 TYR QE 1.800 . 5.000 3.937 2.399 4.974 . 0 0 "[ . 1 . 2 .]" 1
1606 1 128 GLN HA 1 182 TYR QE 1.800 . 5.000 3.255 2.292 4.026 . 0 0 "[ . 1 . 2 .]" 1
1607 1 177 VAL HA 1 182 TYR QE 1.800 . 4.000 3.046 2.270 4.035 0.035 21 0 "[ . 1 . 2 .]" 1
1608 1 177 VAL HB 1 182 TYR QE 1.800 . 5.000 4.636 3.560 5.151 0.151 15 0 "[ . 1 . 2 .]" 1
1609 1 177 VAL MG1 1 182 TYR QE 1.800 . 5.000 4.014 2.409 5.074 0.074 20 0 "[ . 1 . 2 .]" 1
1610 1 177 VAL MG2 1 182 TYR QE 1.800 . 5.000 3.555 2.309 5.092 0.092 1 0 "[ . 1 . 2 .]" 1
1611 1 182 TYR HA 1 183 PRO QD 1.800 . 3.300 2.103 2.032 2.155 . 0 0 "[ . 1 . 2 .]" 1
1612 1 182 TYR QD 1 183 PRO QD 1.800 . 5.000 3.375 2.621 3.896 . 0 0 "[ . 1 . 2 .]" 1
1613 1 182 TYR QE 1 183 PRO QD 1.800 . 5.000 4.661 3.841 5.007 0.007 13 0 "[ . 1 . 2 .]" 1
1614 1 183 PRO HA 1 186 LYS H 1.800 . 5.000 4.888 4.122 5.193 0.193 2 0 "[ . 1 . 2 .]" 1
1615 1 183 PRO HA 1 184 GLY H 1.800 . 3.500 3.448 2.649 3.582 0.082 17 0 "[ . 1 . 2 .]" 1
1616 1 183 PRO QB 1 184 GLY H 1.800 . 5.000 2.585 1.751 3.984 0.049 3 0 "[ . 1 . 2 .]" 1
1617 1 183 PRO QG 1 184 GLY H 1.800 . 5.000 2.746 1.777 4.066 0.023 23 0 "[ . 1 . 2 .]" 1
1618 1 182 TYR QE 1 184 GLY H 1.800 . 5.000 4.166 3.150 5.079 0.079 19 0 "[ . 1 . 2 .]" 1
1619 1 185 ASN H 1 185 ASN HA 1.800 . 2.900 2.695 2.337 2.982 0.082 20 0 "[ . 1 . 2 .]" 1
1620 1 184 GLY H 1 185 ASN H 1.800 . 3.500 2.501 2.260 2.881 . 0 0 "[ . 1 . 2 .]" 1
1621 1 184 GLY QA 1 185 ASN H 1.800 . 2.900 2.903 2.843 2.946 0.046 15 0 "[ . 1 . 2 .]" 1
1622 1 183 PRO HA 1 185 ASN H 1.800 . 5.000 3.966 3.050 4.771 . 0 0 "[ . 1 . 2 .]" 1
1623 1 186 LYS H 1 186 LYS HA 1.800 . 2.900 2.974 2.942 2.989 0.089 21 0 "[ . 1 . 2 .]" 1
1624 1 185 ASN HA 1 186 LYS H 1.800 . 2.900 2.983 2.765 3.212 0.312 2 0 "[ . 1 . 2 .]" 1
1625 1 185 ASN QB 1 186 LYS H 1.800 . 4.000 3.774 3.371 4.057 0.057 24 0 "[ . 1 . 2 .]" 1
1626 1 184 GLY QA 1 186 LYS H 1.800 . 5.000 3.823 3.185 4.341 . 0 0 "[ . 1 . 2 .]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 8
_Distance_constraint_stats_list.Viol_count 100
_Distance_constraint_stats_list.Viol_total 376.890
_Distance_constraint_stats_list.Viol_max 0.375
_Distance_constraint_stats_list.Viol_rms 0.1008
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0754
_Distance_constraint_stats_list.Viol_average_violations_only 0.1508
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 4 CYS 0.044 0.033 21 0 "[ . 1 . 2 .]"
1 6 TRP 1.820 0.149 12 0 "[ . 1 . 2 .]"
1 7 VAL 1.190 0.148 12 0 "[ . 1 . 2 .]"
1 14 ILE 4.373 0.277 25 0 "[ . 1 . 2 .]"
1 17 HIS 12.381 0.375 3 0 "[ . 1 . 2 .]"
1 21 TRP 6.774 0.375 3 0 "[ . 1 . 2 .]"
1 61 HIS 0.771 0.175 18 0 "[ . 1 . 2 .]"
1 117 TRP 0.104 0.104 24 0 "[ . 1 . 2 .]"
1 122 HIS 0.104 0.104 24 0 "[ . 1 . 2 .]"
1 175 HIS 1.820 0.149 12 0 "[ . 1 . 2 .]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 6 TRP HE1 1 175 HIS HD2 1.800 . 5.000 5.054 4.753 5.149 0.149 12 0 "[ . 1 . 2 .]" 2
2 1 4 CYS QB 1 17 HIS HD2 1.800 . 5.000 3.223 2.301 5.033 0.033 21 0 "[ . 1 . 2 .]" 2
3 1 7 VAL H 1 17 HIS HD2 1.800 . 5.000 4.944 4.441 5.148 0.148 12 0 "[ . 1 . 2 .]" 2
4 1 7 VAL QG 1 17 HIS HD2 1.800 . 5.000 3.077 2.074 4.990 . 0 0 "[ . 1 . 2 .]" 2
5 1 14 ILE QG 1 17 HIS HD2 1.800 . 5.000 5.175 5.089 5.277 0.277 25 0 "[ . 1 . 2 .]" 2
6 1 17 HIS HD2 1 21 TRP HZ2 1.800 . 5.000 5.271 5.173 5.375 0.375 3 0 "[ . 1 . 2 .]" 2
7 1 61 HIS HA 1 61 HIS HE1 1.800 . 5.000 4.762 4.271 5.175 0.175 18 0 "[ . 1 . 2 .]" 2
8 1 117 TRP HE3 1 122 HIS HD2 1.800 . 5.000 4.402 3.223 5.104 0.104 24 0 "[ . 1 . 2 .]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 8
_Distance_constraint_stats_list.Viol_count 7
_Distance_constraint_stats_list.Viol_total 5.727
_Distance_constraint_stats_list.Viol_max 0.060
_Distance_constraint_stats_list.Viol_rms 0.0068
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0011
_Distance_constraint_stats_list.Viol_average_violations_only 0.0327
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 4 CYS 0.119 0.060 17 0 "[ . 1 . 2 .]"
1 17 HIS 0.060 0.060 17 0 "[ . 1 . 2 .]"
1 175 HIS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 179 CYS 0.111 0.050 12 0 "[ . 1 . 2 .]"
2 1 ZN 0.169 0.050 12 0 "[ . 1 . 2 .]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 4 CYS SG 1 179 CYS SG 3.600 3.600 3.900 3.757 3.674 3.869 . 0 0 "[ . 1 . 2 .]" 3
2 1 4 CYS SG 1 175 HIS ND1 3.600 3.400 3.800 3.578 3.477 3.676 . 0 0 "[ . 1 . 2 .]" 3
3 1 4 CYS SG 1 17 HIS NE2 3.600 3.400 3.800 3.480 3.340 3.589 0.060 17 0 "[ . 1 . 2 .]" 3
4 1 17 HIS NE2 1 179 CYS SG 3.600 3.400 3.800 3.555 3.481 3.666 . 0 0 "[ . 1 . 2 .]" 3
5 1 175 HIS ND1 1 179 CYS SG 3.600 3.400 3.800 3.549 3.478 3.641 . 0 0 "[ . 1 . 2 .]" 3
6 1 17 HIS NE2 1 175 HIS ND1 3.100 3.100 3.500 3.212 3.152 3.287 . 0 0 "[ . 1 . 2 .]" 3
7 1 4 CYS CB 2 1 ZN ZN 3.380 3.250 3.510 3.393 3.241 3.538 0.028 17 0 "[ . 1 . 2 .]" 3
8 1 179 CYS CB 2 1 ZN ZN 3.380 3.250 3.510 3.429 3.289 3.560 0.050 12 0 "[ . 1 . 2 .]" 3
stop_
save_
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