NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
572260 |
2m98   |
19286 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2m98
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 1293
_Distance_constraint_stats_list.Viol_count 2457
_Distance_constraint_stats_list.Viol_total 6970.303
_Distance_constraint_stats_list.Viol_max 1.762
_Distance_constraint_stats_list.Viol_rms 0.0536
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0080
_Distance_constraint_stats_list.Viol_average_violations_only 0.1091
_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 5 THR 2.590 0.266 20 0 "[ . 1 . 2 . ]"
1 6 GLU 1.929 0.134 4 0 "[ . 1 . 2 . ]"
1 7 ARG 0.122 0.077 18 0 "[ . 1 . 2 . ]"
1 8 ARG 0.539 0.266 20 0 "[ . 1 . 2 . ]"
1 9 LEU 2.706 0.179 4 0 "[ . 1 . 2 . ]"
1 10 ARG 18.212 1.762 26 12 "[** ** ** 1**- . * * .+]"
1 11 VAL 1.081 0.182 18 0 "[ . 1 . 2 . ]"
1 12 LEU 3.372 0.242 26 0 "[ . 1 . 2 . ]"
1 13 VAL 7.994 0.260 16 0 "[ . 1 . 2 . ]"
1 14 VAL 4.420 0.231 6 0 "[ . 1 . 2 . ]"
1 15 GLU 0.223 0.091 18 0 "[ . 1 . 2 . ]"
1 16 ASP 1.736 0.261 22 0 "[ . 1 . 2 . ]"
1 17 GLU 4.412 0.528 11 1 "[ . 1+ . 2 . ]"
1 18 SER 1.425 0.106 17 0 "[ . 1 . 2 . ]"
1 19 MET 0.640 0.105 12 0 "[ . 1 . 2 . ]"
1 20 ILE 6.649 0.267 5 0 "[ . 1 . 2 . ]"
1 21 ALA 3.319 0.238 14 0 "[ . 1 . 2 . ]"
1 22 MET 4.843 0.249 14 0 "[ . 1 . 2 . ]"
1 23 LEU 0.463 0.222 24 0 "[ . 1 . 2 . ]"
1 24 ILE 5.320 0.260 16 0 "[ . 1 . 2 . ]"
1 25 GLU 1.698 0.124 17 0 "[ . 1 . 2 . ]"
1 26 ASP 2.327 0.162 12 0 "[ . 1 . 2 . ]"
1 27 THR 3.905 0.249 14 0 "[ . 1 . 2 . ]"
1 28 LEU 2.702 0.249 14 0 "[ . 1 . 2 . ]"
1 29 CYS 1.581 0.162 12 0 "[ . 1 . 2 . ]"
1 30 GLU 3.262 0.159 23 0 "[ . 1 . 2 . ]"
1 31 LEU 0.613 0.194 12 0 "[ . 1 . 2 . ]"
1 32 GLY 1.161 0.215 22 0 "[ . 1 . 2 . ]"
1 33 HIS 2.191 0.194 12 0 "[ . 1 . 2 . ]"
1 34 GLU 1.624 0.182 18 0 "[ . 1 . 2 . ]"
1 35 VAL 0.355 0.154 6 0 "[ . 1 . 2 . ]"
1 36 ALA 4.382 0.176 4 0 "[ . 1 . 2 . ]"
1 37 ALA 0.018 0.018 9 0 "[ . 1 . 2 . ]"
1 38 THR 8.971 0.238 14 0 "[ . 1 . 2 . ]"
1 39 ALA 4.727 0.144 9 0 "[ . 1 . 2 . ]"
1 40 SER 6.874 0.528 11 1 "[ . 1+ . 2 . ]"
1 41 ARG 4.405 0.178 3 0 "[ . 1 . 2 . ]"
1 42 MET 1.025 0.083 17 0 "[ . 1 . 2 . ]"
1 43 GLN 0.251 0.056 12 0 "[ . 1 . 2 . ]"
1 44 GLU 1.879 0.119 22 0 "[ . 1 . 2 . ]"
1 45 ALA 1.006 0.107 7 0 "[ . 1 . 2 . ]"
1 46 LEU 3.440 0.150 17 0 "[ . 1 . 2 . ]"
1 47 ASP 3.262 0.127 8 0 "[ . 1 . 2 . ]"
1 48 ILE 7.115 0.242 26 0 "[ . 1 . 2 . ]"
1 49 ALA 6.634 0.155 12 0 "[ . 1 . 2 . ]"
1 50 ARG 0.886 0.110 10 0 "[ . 1 . 2 . ]"
1 51 LYS 1.282 0.128 26 0 "[ . 1 . 2 . ]"
1 52 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 53 GLN 0.677 0.224 20 0 "[ . 1 . 2 . ]"
1 54 PHE 2.744 0.288 26 0 "[ . 1 . 2 . ]"
1 55 ASP 2.054 0.219 2 0 "[ . 1 . 2 . ]"
1 56 ILE 20.460 1.762 26 12 "[** ** ** 1**- . * * .+]"
1 57 ALA 1.972 0.135 24 0 "[ . 1 . 2 . ]"
1 58 ILE 2.922 0.209 9 0 "[ . 1 . 2 . ]"
1 59 ILE 6.582 0.219 20 0 "[ . 1 . 2 . ]"
1 60 ASP 5.663 0.200 18 0 "[ . 1 . 2 . ]"
1 61 VAL 2.562 0.191 6 0 "[ . 1 . 2 . ]"
1 62 ASN 1.028 0.152 1 0 "[ . 1 . 2 . ]"
1 63 LEU 1.183 0.281 18 0 "[ . 1 . 2 . ]"
1 64 ASP 0.521 0.107 12 0 "[ . 1 . 2 . ]"
1 65 GLY 0.025 0.019 12 0 "[ . 1 . 2 . ]"
1 66 GLU 1.079 0.281 18 0 "[ . 1 . 2 . ]"
1 67 PRO 0.001 0.001 6 0 "[ . 1 . 2 . ]"
1 68 SER 0.287 0.121 21 0 "[ . 1 . 2 . ]"
1 69 TYR 4.673 0.243 15 0 "[ . 1 . 2 . ]"
1 70 PRO 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 71 VAL 8.517 0.243 15 0 "[ . 1 . 2 . ]"
1 72 ALA 4.949 0.243 9 0 "[ . 1 . 2 . ]"
1 73 ASP 6.928 0.167 8 0 "[ . 1 . 2 . ]"
1 74 ILE 3.860 0.136 25 0 "[ . 1 . 2 . ]"
1 75 LEU 7.161 0.243 9 0 "[ . 1 . 2 . ]"
1 76 ALA 8.143 0.515 25 1 "[ . 1 . 2 + ]"
1 77 GLU 1.188 0.108 12 0 "[ . 1 . 2 . ]"
1 78 ARG 4.604 0.184 6 0 "[ . 1 . 2 . ]"
1 79 ASN 7.883 0.515 25 1 "[ . 1 . 2 + ]"
1 80 VAL 0.544 0.126 4 0 "[ . 1 . 2 . ]"
1 81 PRO 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 82 PHE 13.469 0.812 20 8 "[ *. * *1 * . * -+ * . ]"
1 83 ILE 19.358 1.663 15 15 "[** *.* ** +** ** **-* ]"
1 84 PHE 4.026 0.182 20 0 "[ . 1 . 2 . ]"
1 85 ALA 4.057 0.266 22 0 "[ . 1 . 2 . ]"
1 86 THR 4.711 0.274 3 0 "[ . 1 . 2 . ]"
1 87 GLY 1.028 0.152 1 0 "[ . 1 . 2 . ]"
1 88 TYR 0.372 0.082 10 0 "[ . 1 . 2 . ]"
1 89 GLY 2.611 0.274 3 0 "[ . 1 . 2 . ]"
1 90 SER 3.278 0.187 17 0 "[ . 1 . 2 . ]"
1 91 LYS 2.448 0.177 25 0 "[ . 1 . 2 . ]"
1 92 GLY 0.381 0.125 6 0 "[ . 1 . 2 . ]"
1 93 LEU 0.197 0.073 8 0 "[ . 1 . 2 . ]"
1 94 ASP 1.162 0.139 20 0 "[ . 1 . 2 . ]"
1 95 THR 3.271 0.196 18 0 "[ . 1 . 2 . ]"
1 96 ARG 0.774 0.142 2 0 "[ . 1 . 2 . ]"
1 97 TYR 14.834 0.812 20 8 "[ *. * *1 * . * -+ * . ]"
1 98 SER 3.428 0.275 23 0 "[ . 1 . 2 . ]"
1 99 ASN 2.801 0.275 23 0 "[ . 1 . 2 . ]"
1 100 ILE 20.000 1.663 15 15 "[** *.* ** +** ** **-* ]"
1 101 PRO 2.450 0.238 16 0 "[ . 1 . 2 . ]"
1 102 LEU 1.831 0.456 19 0 "[ . 1 . 2 . ]"
1 103 LEU 1.612 0.266 22 0 "[ . 1 . 2 . ]"
1 104 THR 7.238 0.200 18 0 "[ . 1 . 2 . ]"
1 105 LYS 0.321 0.070 23 0 "[ . 1 . 2 . ]"
1 107 PHE 0.076 0.044 14 0 "[ . 1 . 2 . ]"
1 108 LEU 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 109 ASP 0.256 0.083 4 0 "[ . 1 . 2 . ]"
1 110 SER 1.574 0.456 19 0 "[ . 1 . 2 . ]"
1 111 GLU 0.206 0.067 17 0 "[ . 1 . 2 . ]"
1 112 LEU 3.759 0.259 24 0 "[ . 1 . 2 . ]"
1 113 GLU 1.674 0.229 24 0 "[ . 1 . 2 . ]"
1 114 ALA 4.070 0.261 23 0 "[ . 1 . 2 . ]"
1 115 VAL 0.104 0.048 12 0 "[ . 1 . 2 . ]"
1 116 LEU 1.310 0.142 3 0 "[ . 1 . 2 . ]"
1 117 VAL 5.502 0.261 23 0 "[ . 1 . 2 . ]"
1 118 GLN 28.423 1.588 23 23 "[ **** ************-***+** ]"
1 119 ILE 29.566 1.588 23 23 "[ **** ************-***+** ]"
1 120 SER 0.344 0.127 15 0 "[ . 1 . 2 . ]"
1 121 LYS 1.304 0.170 24 0 "[ . 1 . 2 . ]"
1 122 GLU 3.349 0.265 10 0 "[ . 1 . 2 . ]"
1 123 VAL 5.530 0.265 10 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 5 THR H 1 6 GLU HA 1.800 . 5.000 4.993 4.802 5.134 0.134 4 0 "[ . 1 . 2 . ]" 1
2 1 5 THR H 1 6 GLU HB3 1.800 . 5.000 4.784 4.156 5.105 0.105 24 0 "[ . 1 . 2 . ]" 1
3 1 5 THR H 1 5 THR MG 1.800 . 6.500 2.994 2.301 3.609 . 0 0 "[ . 1 . 2 . ]" 1
4 1 5 THR HB 1 6 GLU H 1.800 . 2.800 2.790 2.633 2.898 0.098 5 0 "[ . 1 . 2 . ]" 1
5 1 5 THR MG 1 6 GLU H 1.800 . 6.500 3.690 3.011 4.094 . 0 0 "[ . 1 . 2 . ]" 1
6 1 5 THR HB 1 7 ARG H 1.800 . 3.800 3.367 2.506 3.877 0.077 18 0 "[ . 1 . 2 . ]" 1
7 1 5 THR HB 1 8 ARG H 1.800 . 5.000 4.518 2.945 5.266 0.266 20 0 "[ . 1 . 2 . ]" 1
8 1 7 ARG QD 1 8 ARG H 1.800 . 6.000 3.356 2.152 4.424 . 0 0 "[ . 1 . 2 . ]" 1
9 1 8 ARG H 1 8 ARG HB3 1.800 . 3.800 2.965 2.065 3.638 . 0 0 "[ . 1 . 2 . ]" 1
10 1 8 ARG H 1 8 ARG HB2 1.800 . 3.800 2.537 1.942 3.575 . 0 0 "[ . 1 . 2 . ]" 1
11 1 9 LEU H 1 9 LEU HA 1.800 . 2.800 2.899 2.802 2.979 0.179 4 0 "[ . 1 . 2 . ]" 1
12 1 7 ARG QB 1 9 LEU H 1.800 . 6.000 4.478 3.075 5.526 . 0 0 "[ . 1 . 2 . ]" 1
13 1 8 ARG HB3 1 9 LEU H 1.800 . 5.000 3.698 2.733 4.525 . 0 0 "[ . 1 . 2 . ]" 1
14 1 9 LEU H 1 9 LEU QB 1.800 . 6.000 2.247 1.926 3.111 . 0 0 "[ . 1 . 2 . ]" 1
15 1 9 LEU H 1 9 LEU QD 1.800 . 7.500 2.531 1.756 3.554 0.044 18 0 "[ . 1 . 2 . ]" 1
16 1 10 ARG H 1 55 ASP H 1.800 . 5.000 4.757 2.671 5.219 0.219 2 0 "[ . 1 . 2 . ]" 1
17 1 10 ARG H 1 11 VAL H 1.800 . 6.000 4.401 4.147 4.499 . 0 0 "[ . 1 . 2 . ]" 1
18 1 10 ARG H 1 10 ARG QD 1.800 . 6.000 3.751 1.847 4.958 . 0 0 "[ . 1 . 2 . ]" 1
19 1 9 LEU QD 1 10 ARG H 1.800 . 7.500 3.807 2.092 4.592 . 0 0 "[ . 1 . 2 . ]" 1
20 1 10 ARG H 1 10 ARG HB2 1.800 . 3.800 2.893 2.327 3.359 . 0 0 "[ . 1 . 2 . ]" 1
21 1 10 ARG H 1 10 ARG HB3 1.800 . 3.800 3.364 2.814 3.886 0.086 9 0 "[ . 1 . 2 . ]" 1
22 1 10 ARG H 1 56 ILE QG 1.800 . 6.000 4.964 4.337 5.263 . 0 0 "[ . 1 . 2 . ]" 1
23 1 9 LEU QB 1 10 ARG HA 1.800 . 6.000 4.198 3.964 4.432 . 0 0 "[ . 1 . 2 . ]" 1
24 1 10 ARG HA 1 11 VAL QG 1.800 . 7.500 3.106 2.773 3.762 . 0 0 "[ . 1 . 2 . ]" 1
25 1 10 ARG HA 1 11 VAL H 1.800 . 5.000 2.373 2.145 2.534 . 0 0 "[ . 1 . 2 . ]" 1
26 1 10 ARG HA 1 34 GLU QB 1.800 . 6.000 3.979 3.122 4.789 . 0 0 "[ . 1 . 2 . ]" 1
27 1 10 ARG HB3 1 10 ARG QD 1.800 . 6.000 3.046 2.312 3.488 . 0 0 "[ . 1 . 2 . ]" 1
28 1 10 ARG HB2 1 10 ARG QD 1.800 . 6.000 2.732 2.016 3.342 . 0 0 "[ . 1 . 2 . ]" 1
29 1 10 ARG HA 1 10 ARG QD 1.800 . 6.000 2.105 1.442 3.626 0.358 17 0 "[ . 1 . 2 . ]" 1
30 1 10 ARG QD 1 34 GLU QB 1.800 . 7.000 2.829 1.731 5.369 0.069 13 0 "[ . 1 . 2 . ]" 1
31 1 10 ARG QD 1 33 HIS HD2 1.800 . 6.000 4.245 3.481 5.247 . 0 0 "[ . 1 . 2 . ]" 1
32 1 10 ARG QD 1 11 VAL QG 1.800 . 8.500 3.720 2.400 5.464 . 0 0 "[ . 1 . 2 . ]" 1
33 1 10 ARG QD 1 31 LEU QD 1.800 . 8.500 5.425 3.394 5.733 . 0 0 "[ . 1 . 2 . ]" 1
34 1 11 VAL H 1 34 GLU H 1.800 . 5.000 4.951 4.352 5.182 0.182 18 0 "[ . 1 . 2 . ]" 1
35 1 10 ARG HB2 1 11 VAL H 1.800 . 5.000 4.002 3.446 4.587 . 0 0 "[ . 1 . 2 . ]" 1
36 1 10 ARG HB3 1 11 VAL H 1.800 . 3.800 3.264 2.572 3.805 0.005 22 0 "[ . 1 . 2 . ]" 1
37 1 11 VAL H 1 36 ALA HA 1.800 . 5.000 3.254 2.602 4.180 . 0 0 "[ . 1 . 2 . ]" 1
38 1 11 VAL HB 1 11 VAL QG 1.800 . 6.500 1.902 1.881 1.918 . 0 0 "[ . 1 . 2 . ]" 1
39 1 11 VAL QG 1 24 ILE HA 1.800 . 7.500 4.437 3.539 5.148 . 0 0 "[ . 1 . 2 . ]" 1
40 1 11 VAL QG 1 24 ILE QG 1.800 . 6.300 2.821 2.228 3.871 . 0 0 "[ . 1 . 2 . ]" 1
41 1 11 VAL QG 1 58 ILE MD 1.800 . 9.000 3.459 2.389 4.578 . 0 0 "[ . 1 . 2 . ]" 1
42 1 11 VAL HA 1 12 LEU H 1.800 . 3.800 2.280 2.192 2.397 . 0 0 "[ . 1 . 2 . ]" 1
43 1 12 LEU H 1 58 ILE H 1.800 . 5.300 4.779 4.284 5.295 . 0 0 "[ . 1 . 2 . ]" 1
44 1 12 LEU H 1 57 ALA HA 1.800 . 3.800 3.058 2.482 3.637 . 0 0 "[ . 1 . 2 . ]" 1
45 1 11 VAL QG 1 12 LEU H 1.800 . 5.300 3.553 3.039 3.760 . 0 0 "[ . 1 . 2 . ]" 1
46 1 12 LEU H 1 13 VAL HA 1.800 . 6.000 5.092 4.799 5.332 . 0 0 "[ . 1 . 2 . ]" 1
47 1 12 LEU H 1 58 ILE MD 1.800 . 6.500 4.126 3.625 4.530 . 0 0 "[ . 1 . 2 . ]" 1
48 1 12 LEU H 1 48 ILE MD 1.800 . 6.500 4.871 4.503 5.231 . 0 0 "[ . 1 . 2 . ]" 1
49 1 12 LEU H 1 48 ILE MG 1.800 . 6.500 4.208 3.961 4.658 . 0 0 "[ . 1 . 2 . ]" 1
50 1 12 LEU H 1 48 ILE HA 1.800 . 5.000 5.093 4.880 5.242 0.242 26 0 "[ . 1 . 2 . ]" 1
51 1 12 LEU QD 1 54 PHE QE 1.800 . 7.500 4.001 3.048 4.890 . 0 0 "[ . 1 . 2 . ]" 1
52 1 12 LEU MD1 1 54 PHE QD 1.800 . 6.500 3.449 1.684 4.653 0.116 3 0 "[ . 1 . 2 . ]" 1
53 1 13 VAL H 1 38 THR H 1.800 . 5.000 5.130 4.942 5.217 0.217 20 0 "[ . 1 . 2 . ]" 1
54 1 13 VAL H 1 36 ALA MB 1.800 . 6.500 3.664 2.883 4.787 . 0 0 "[ . 1 . 2 . ]" 1
55 1 13 VAL H 1 38 THR HA 1.800 . 5.000 4.426 3.810 4.819 . 0 0 "[ . 1 . 2 . ]" 1
56 1 13 VAL H 1 13 VAL HB 1.800 . 3.800 2.786 2.430 3.697 . 0 0 "[ . 1 . 2 . ]" 1
57 1 13 VAL H 1 13 VAL QG 1.800 . 5.300 2.142 1.770 2.618 0.030 17 0 "[ . 1 . 2 . ]" 1
58 1 13 VAL H 1 14 VAL H 1.800 . 5.000 4.505 4.237 4.654 . 0 0 "[ . 1 . 2 . ]" 1
59 1 12 LEU MD2 1 13 VAL H 1.800 . 6.500 4.399 3.742 5.149 . 0 0 "[ . 1 . 2 . ]" 1
60 1 12 LEU HA 1 13 VAL H 1.800 . 5.000 2.304 2.213 2.455 . 0 0 "[ . 1 . 2 . ]" 1
61 1 13 VAL H 1 58 ILE MD 1.800 . 5.300 4.217 4.095 4.327 . 0 0 "[ . 1 . 2 . ]" 1
62 1 13 VAL H 1 37 ALA H 1.800 . 5.000 2.368 1.884 3.030 . 0 0 "[ . 1 . 2 . ]" 1
63 1 13 VAL H 1 48 ILE MD 1.800 . 6.500 5.298 5.204 5.380 . 0 0 "[ . 1 . 2 . ]" 1
64 1 13 VAL HA 1 58 ILE HB 1.800 . 5.000 2.206 1.784 2.916 0.016 7 0 "[ . 1 . 2 . ]" 1
65 1 13 VAL HA 1 59 ILE HA 1.800 . 5.000 4.993 4.569 5.178 0.178 9 0 "[ . 1 . 2 . ]" 1
66 1 13 VAL HA 1 14 VAL HA 1.800 . 5.000 4.488 4.442 4.549 . 0 0 "[ . 1 . 2 . ]" 1
67 1 13 VAL HB 1 20 ILE MD 1.800 . 4.500 2.673 1.828 3.532 . 0 0 "[ . 1 . 2 . ]" 1
68 1 13 VAL HB 1 14 VAL HA 1.800 . 5.000 4.483 4.237 4.830 . 0 0 "[ . 1 . 2 . ]" 1
69 1 13 VAL HB 1 13 VAL QG 1.800 . 7.500 1.896 1.881 1.907 . 0 0 "[ . 1 . 2 . ]" 1
70 1 13 VAL QG 1 20 ILE MD 1.800 . 9.000 1.793 1.580 2.387 0.220 1 0 "[ . 1 . 2 . ]" 1
71 1 14 VAL H 1 37 ALA MB 1.800 . 6.500 4.819 3.927 5.339 . 0 0 "[ . 1 . 2 . ]" 1
72 1 14 VAL H 1 14 VAL HB 1.800 . 3.800 3.680 2.559 3.902 0.102 17 0 "[ . 1 . 2 . ]" 1
73 1 13 VAL HB 1 14 VAL H 1.800 . 5.000 3.853 2.993 4.271 . 0 0 "[ . 1 . 2 . ]" 1
74 1 13 VAL QG 1 14 VAL H 1.800 . 5.300 2.539 1.894 3.581 . 0 0 "[ . 1 . 2 . ]" 1
75 1 13 VAL HA 1 14 VAL H 1.800 . 3.800 2.278 2.191 2.390 . 0 0 "[ . 1 . 2 . ]" 1
76 1 14 VAL H 1 60 ASP H 1.800 . 5.000 3.528 3.151 3.809 . 0 0 "[ . 1 . 2 . ]" 1
77 1 14 VAL H 1 58 ILE MD 1.800 . 6.500 4.301 3.943 4.689 . 0 0 "[ . 1 . 2 . ]" 1
78 1 14 VAL HA 1 59 ILE HA 1.800 . 5.000 4.862 4.502 5.124 0.124 17 0 "[ . 1 . 2 . ]" 1
79 1 14 VAL HA 1 20 ILE MD 1.800 . 6.500 2.665 1.812 3.841 . 0 0 "[ . 1 . 2 . ]" 1
80 1 14 VAL HA 1 39 ALA MB 1.800 . 6.500 4.318 4.076 4.516 . 0 0 "[ . 1 . 2 . ]" 1
81 1 14 VAL HA 1 14 VAL QG 1.800 . 6.300 2.255 1.893 2.571 . 0 0 "[ . 1 . 2 . ]" 1
82 1 14 VAL HA 1 15 GLU H 1.800 . 3.800 2.193 2.144 2.284 . 0 0 "[ . 1 . 2 . ]" 1
83 1 14 VAL HA 1 38 THR MG 1.800 . 6.500 4.998 4.260 5.349 . 0 0 "[ . 1 . 2 . ]" 1
84 1 14 VAL HB 1 20 ILE MD 1.800 . 6.500 4.552 3.918 5.205 . 0 0 "[ . 1 . 2 . ]" 1
85 1 14 VAL HB 1 38 THR HA 1.800 . 5.000 5.084 4.697 5.231 0.231 6 0 "[ . 1 . 2 . ]" 1
86 1 14 VAL QG 1 24 ILE MD 1.800 . 7.700 4.345 3.817 4.751 . 0 0 "[ . 1 . 2 . ]" 1
87 1 14 VAL QG 1 15 GLU QB 1.800 . 8.500 4.062 3.789 4.311 . 0 0 "[ . 1 . 2 . ]" 1
88 1 13 VAL H 1 14 VAL QG 1.800 . 7.500 3.506 3.021 4.213 . 0 0 "[ . 1 . 2 . ]" 1
89 1 14 VAL QG 1 40 SER HB3 1.800 . 7.500 3.558 2.552 4.266 . 0 0 "[ . 1 . 2 . ]" 1
90 1 14 VAL QG 1 45 ALA HA 1.800 . 7.500 2.955 2.513 3.368 . 0 0 "[ . 1 . 2 . ]" 1
91 1 14 VAL QG 1 48 ILE MD 1.800 . 9.000 2.687 2.142 3.182 . 0 0 "[ . 1 . 2 . ]" 1
92 1 14 VAL QG 1 38 THR HA 1.800 . 7.500 3.469 2.754 4.757 . 0 0 "[ . 1 . 2 . ]" 1
93 1 14 VAL QG 1 60 ASP QB 1.800 . 8.500 4.766 4.086 5.401 . 0 0 "[ . 1 . 2 . ]" 1
94 1 13 VAL QG 1 15 GLU H 1.800 . 7.500 4.856 4.286 5.255 . 0 0 "[ . 1 . 2 . ]" 1
95 1 15 GLU H 1 40 SER HB2 1.800 . 5.000 4.555 4.166 4.819 . 0 0 "[ . 1 . 2 . ]" 1
96 1 15 GLU H 1 20 ILE QG 1.800 . 6.000 4.331 3.406 5.076 . 0 0 "[ . 1 . 2 . ]" 1
97 1 15 GLU H 1 16 ASP HA 1.800 . 5.000 4.872 4.526 5.091 0.091 18 0 "[ . 1 . 2 . ]" 1
98 1 14 VAL HB 1 15 GLU H 1.800 . 5.000 3.289 2.629 4.545 . 0 0 "[ . 1 . 2 . ]" 1
99 1 15 GLU QB 1 20 ILE MD 1.800 . 7.500 2.390 1.891 3.044 . 0 0 "[ . 1 . 2 . ]" 1
100 1 15 GLU QB 1 16 ASP H 1.800 . 6.000 3.135 2.635 3.793 . 0 0 "[ . 1 . 2 . ]" 1
101 1 14 VAL QG 1 16 ASP H 1.800 . 7.500 5.172 4.729 5.544 . 0 0 "[ . 1 . 2 . ]" 1
102 1 16 ASP H 1 17 GLU H 1.800 . 3.800 3.524 2.976 4.061 0.261 22 0 "[ . 1 . 2 . ]" 1
103 1 16 ASP H 1 16 ASP HA 1.800 . 2.800 2.740 2.544 2.912 0.112 9 0 "[ . 1 . 2 . ]" 1
104 1 15 GLU HA 1 16 ASP H 1.800 . 3.800 2.324 2.166 2.535 . 0 0 "[ . 1 . 2 . ]" 1
105 1 16 ASP HA 1 17 GLU H 1.800 . 5.000 3.208 2.341 3.619 . 0 0 "[ . 1 . 2 . ]" 1
106 1 17 GLU H 1 18 SER H 1.800 . 5.000 4.493 3.921 4.675 . 0 0 "[ . 1 . 2 . ]" 1
107 1 17 GLU HA 1 17 GLU QG 1.800 . 6.000 2.571 1.894 3.527 . 0 0 "[ . 1 . 2 . ]" 1
108 1 16 ASP HA 1 17 GLU HA 1.800 . 5.000 4.540 4.358 4.740 . 0 0 "[ . 1 . 2 . ]" 1
109 1 16 ASP QB 1 17 GLU HA 1.800 . 6.000 4.354 3.826 4.719 . 0 0 "[ . 1 . 2 . ]" 1
110 1 17 GLU HA 1 39 ALA HA 1.800 . 5.000 4.990 4.722 5.144 0.144 9 0 "[ . 1 . 2 . ]" 1
111 1 18 SER HA 1 19 MET HA 1.800 . 5.000 4.935 4.834 4.999 . 0 0 "[ . 1 . 2 . ]" 1
112 1 19 MET H 1 19 MET QG 1.800 . 6.000 3.468 1.770 3.984 0.030 4 0 "[ . 1 . 2 . ]" 1
113 1 19 MET H 1 20 ILE HB 1.800 . 5.000 5.009 4.914 5.105 0.105 12 0 "[ . 1 . 2 . ]" 1
114 1 18 SER HA 1 20 ILE H 1.800 . 5.000 3.335 3.113 3.955 . 0 0 "[ . 1 . 2 . ]" 1
115 1 20 ILE H 1 20 ILE QG 1.800 . 4.800 3.901 3.851 3.956 . 0 0 "[ . 1 . 2 . ]" 1
116 1 20 ILE HA 1 20 ILE QG 1.800 . 6.000 2.411 2.280 2.540 . 0 0 "[ . 1 . 2 . ]" 1
117 1 20 ILE HA 1 23 LEU MD1 1.800 . 6.500 2.772 1.817 3.898 . 0 0 "[ . 1 . 2 . ]" 1
118 1 20 ILE HA 1 20 ILE MG 1.800 . 6.500 3.199 3.182 3.219 . 0 0 "[ . 1 . 2 . ]" 1
119 1 19 MET QG 1 20 ILE HA 1.800 . 6.000 4.600 3.352 5.656 . 0 0 "[ . 1 . 2 . ]" 1
120 1 20 ILE HA 1 21 ALA HA 1.800 . 5.000 4.860 4.639 4.991 . 0 0 "[ . 1 . 2 . ]" 1
121 1 13 VAL QG 1 20 ILE QG 1.800 . 9.500 2.303 1.671 3.080 0.129 17 0 "[ . 1 . 2 . ]" 1
122 1 20 ILE QG 1 20 ILE MG 1.800 . 5.300 2.216 1.998 2.403 . 0 0 "[ . 1 . 2 . ]" 1
123 1 20 ILE QG 1 23 LEU MD1 1.800 . 5.300 2.770 2.302 3.590 . 0 0 "[ . 1 . 2 . ]" 1
124 1 20 ILE QG 1 24 ILE HA 1.800 . 6.000 5.133 4.564 5.440 . 0 0 "[ . 1 . 2 . ]" 1
125 1 20 ILE QG 1 24 ILE HB 1.800 . 4.800 3.712 3.158 3.989 . 0 0 "[ . 1 . 2 . ]" 1
126 1 20 ILE QG 1 21 ALA HA 1.800 . 6.000 3.804 3.416 4.104 . 0 0 "[ . 1 . 2 . ]" 1
127 1 20 ILE QG 1 39 ALA MB 1.800 . 7.300 5.107 4.477 5.327 . 0 0 "[ . 1 . 2 . ]" 1
128 1 15 GLU QB 1 20 ILE QG 1.800 . 7.000 4.264 3.314 5.117 . 0 0 "[ . 1 . 2 . ]" 1
129 1 20 ILE MD 1 20 ILE MG 1.800 . 6.800 2.146 1.533 3.083 0.267 5 0 "[ . 1 . 2 . ]" 1
130 1 20 ILE MG 1 38 THR HA 1.800 . 6.500 3.006 2.706 3.297 . 0 0 "[ . 1 . 2 . ]" 1
131 1 14 VAL H 1 20 ILE MG 1.800 . 6.500 4.966 4.580 5.263 . 0 0 "[ . 1 . 2 . ]" 1
132 1 14 VAL HA 1 20 ILE MG 1.800 . 6.500 3.146 2.369 3.708 . 0 0 "[ . 1 . 2 . ]" 1
133 1 20 ILE MG 1 38 THR MG 1.800 . 8.000 3.571 1.950 4.295 . 0 0 "[ . 1 . 2 . ]" 1
134 1 20 ILE HB 1 20 ILE MD 1.800 . 6.500 2.177 1.885 2.458 . 0 0 "[ . 1 . 2 . ]" 1
135 1 20 ILE MD 1 38 THR MG 1.800 . 9.000 4.927 3.166 6.253 . 0 0 "[ . 1 . 2 . ]" 1
136 1 21 ALA H 1 22 MET QB 1.800 . 6.000 4.613 4.204 4.952 . 0 0 "[ . 1 . 2 . ]" 1
137 1 21 ALA H 1 23 LEU QD 1.800 . 7.500 4.742 4.072 5.059 . 0 0 "[ . 1 . 2 . ]" 1
138 1 20 ILE MG 1 21 ALA HA 1.800 . 5.300 3.305 2.964 3.541 . 0 0 "[ . 1 . 2 . ]" 1
139 1 21 ALA HA 1 23 LEU HB3 1.800 . 5.000 4.860 4.550 5.222 0.222 24 0 "[ . 1 . 2 . ]" 1
140 1 20 ILE HA 1 21 ALA MB 1.800 . 6.500 4.847 4.725 4.937 . 0 0 "[ . 1 . 2 . ]" 1
141 1 20 ILE HB 1 21 ALA MB 1.800 . 6.500 5.372 5.315 5.450 . 0 0 "[ . 1 . 2 . ]" 1
142 1 20 ILE MG 1 21 ALA MB 1.800 . 6.800 3.003 2.821 3.272 . 0 0 "[ . 1 . 2 . ]" 1
143 1 20 ILE MD 1 21 ALA MB 1.800 . 8.300 5.369 4.910 5.739 . 0 0 "[ . 1 . 2 . ]" 1
144 1 21 ALA MB 1 24 ILE QG 1.800 . 8.000 3.906 3.397 4.401 . 0 0 "[ . 1 . 2 . ]" 1
145 1 21 ALA MB 1 23 LEU MD1 1.800 . 8.000 5.434 5.295 5.702 . 0 0 "[ . 1 . 2 . ]" 1
146 1 21 ALA MB 1 38 THR HA 1.800 . 6.500 4.370 3.422 5.108 . 0 0 "[ . 1 . 2 . ]" 1
147 1 21 ALA MB 1 38 THR MG 1.800 . 8.000 2.388 1.570 3.416 0.230 10 0 "[ . 1 . 2 . ]" 1
148 1 21 ALA MB 1 22 MET QB 1.800 . 7.500 3.360 3.179 3.501 . 0 0 "[ . 1 . 2 . ]" 1
149 1 22 MET H 1 23 LEU H 1.800 . 5.000 2.665 2.483 2.803 . 0 0 "[ . 1 . 2 . ]" 1
150 1 22 MET H 1 22 MET QB 1.800 . 3.800 2.106 1.936 2.200 . 0 0 "[ . 1 . 2 . ]" 1
151 1 22 MET H 1 22 MET QG 1.800 . 6.000 3.850 3.148 4.012 . 0 0 "[ . 1 . 2 . ]" 1
152 1 21 ALA MB 1 22 MET H 1.800 . 5.300 1.896 1.749 2.150 0.051 18 0 "[ . 1 . 2 . ]" 1
153 1 18 SER HA 1 22 MET H 1.800 . 5.000 5.001 4.107 5.106 0.106 17 0 "[ . 1 . 2 . ]" 1
154 1 22 MET H 1 23 LEU QB 1.800 . 6.000 4.245 4.016 4.389 . 0 0 "[ . 1 . 2 . ]" 1
155 1 22 MET HA 1 22 MET QG 1.800 . 4.800 2.486 1.985 3.195 . 0 0 "[ . 1 . 2 . ]" 1
156 1 22 MET HA 1 24 ILE HB 1.800 . 5.000 5.127 4.975 5.249 0.249 14 0 "[ . 1 . 2 . ]" 1
157 1 23 LEU H 1 23 LEU MD1 1.800 . 5.300 3.650 3.506 4.076 . 0 0 "[ . 1 . 2 . ]" 1
158 1 23 LEU H 1 23 LEU HG 1.800 . 5.000 4.397 2.822 4.547 . 0 0 "[ . 1 . 2 . ]" 1
159 1 23 LEU H 1 24 ILE H 1.800 . 3.800 2.579 2.460 2.672 . 0 0 "[ . 1 . 2 . ]" 1
160 1 20 ILE HA 1 23 LEU H 1.800 . 5.000 3.666 3.291 4.049 . 0 0 "[ . 1 . 2 . ]" 1
161 1 23 LEU H 1 23 LEU HB2 1.800 . 3.800 2.639 1.850 3.399 . 0 0 "[ . 1 . 2 . ]" 1
162 1 19 MET HA 1 23 LEU H 1.800 . 5.000 4.574 4.237 4.989 . 0 0 "[ . 1 . 2 . ]" 1
163 1 20 ILE HA 1 23 LEU QB 1.800 . 6.000 2.063 1.771 3.189 0.029 22 0 "[ . 1 . 2 . ]" 1
164 1 20 ILE MD 1 23 LEU QB 1.800 . 7.500 4.719 3.550 5.527 . 0 0 "[ . 1 . 2 . ]" 1
165 1 20 ILE QG 1 23 LEU HB3 1.800 . 6.000 3.546 2.740 4.742 . 0 0 "[ . 1 . 2 . ]" 1
166 1 19 MET HA 1 23 LEU QB 1.800 . 6.000 4.273 3.582 4.963 . 0 0 "[ . 1 . 2 . ]" 1
167 1 24 ILE H 1 25 GLU H 1.800 . 3.800 2.319 2.174 2.455 . 0 0 "[ . 1 . 2 . ]" 1
168 1 21 ALA HA 1 24 ILE H 1.800 . 5.000 3.835 3.396 4.345 . 0 0 "[ . 1 . 2 . ]" 1
169 1 24 ILE H 1 24 ILE HB 1.800 . 3.800 2.283 2.119 2.464 . 0 0 "[ . 1 . 2 . ]" 1
170 1 24 ILE H 1 24 ILE MG 1.800 . 5.300 2.605 2.447 3.055 . 0 0 "[ . 1 . 2 . ]" 1
171 1 24 ILE H 1 26 ASP HB3 1.800 . 5.000 5.023 4.894 5.066 0.066 9 0 "[ . 1 . 2 . ]" 1
172 1 22 MET H 1 24 ILE H 1.800 . 5.000 4.085 3.952 4.178 . 0 0 "[ . 1 . 2 . ]" 1
173 1 24 ILE H 1 26 ASP H 1.800 . 5.000 3.600 3.513 3.775 . 0 0 "[ . 1 . 2 . ]" 1
174 1 24 ILE H 1 24 ILE QG 1.800 . 6.000 3.928 3.740 4.017 . 0 0 "[ . 1 . 2 . ]" 1
175 1 24 ILE HA 1 24 ILE QG 1.800 . 6.000 2.020 1.921 2.149 . 0 0 "[ . 1 . 2 . ]" 1
176 1 24 ILE HA 1 24 ILE MG 1.800 . 6.500 3.123 2.970 3.167 . 0 0 "[ . 1 . 2 . ]" 1
177 1 24 ILE HA 1 24 ILE MD 1.800 . 6.500 3.370 2.532 3.652 . 0 0 "[ . 1 . 2 . ]" 1
178 1 23 LEU QD 1 24 ILE HA 1.800 . 6.300 2.852 2.487 4.321 . 0 0 "[ . 1 . 2 . ]" 1
179 1 24 ILE HA 1 27 THR HB 1.800 . 5.000 3.764 2.296 4.855 . 0 0 "[ . 1 . 2 . ]" 1
180 1 24 ILE HA 1 27 THR MG 1.800 . 6.500 3.573 1.785 4.930 0.015 19 0 "[ . 1 . 2 . ]" 1
181 1 23 LEU HB2 1 24 ILE HA 1.800 . 6.000 5.757 5.230 5.844 . 0 0 "[ . 1 . 2 . ]" 1
182 1 24 ILE HB 1 24 ILE MD 1.800 . 5.500 2.077 1.856 2.330 . 0 0 "[ . 1 . 2 . ]" 1
183 1 24 ILE HB 1 25 GLU HG3 1.800 . 6.000 5.442 4.511 5.988 . 0 0 "[ . 1 . 2 . ]" 1
184 1 20 ILE MD 1 24 ILE HB 1.800 . 6.500 5.195 4.653 5.473 . 0 0 "[ . 1 . 2 . ]" 1
185 1 13 VAL QG 1 24 ILE HB 1.800 . 6.800 4.195 3.321 4.702 . 0 0 "[ . 1 . 2 . ]" 1
186 1 13 VAL HB 1 24 ILE MD 1.800 . 6.500 2.338 1.755 4.158 0.045 5 0 "[ . 1 . 2 . ]" 1
187 1 13 VAL QG 1 24 ILE MD 1.800 . 6.300 1.993 1.540 2.746 0.260 16 0 "[ . 1 . 2 . ]" 1
188 1 24 ILE MD 1 36 ALA HA 1.800 . 6.500 4.155 2.799 5.275 . 0 0 "[ . 1 . 2 . ]" 1
189 1 24 ILE MD 1 36 ALA MB 1.800 . 8.000 2.326 1.753 3.236 0.047 13 0 "[ . 1 . 2 . ]" 1
190 1 20 ILE QG 1 24 ILE MD 1.800 . 7.500 2.836 2.157 3.386 . 0 0 "[ . 1 . 2 . ]" 1
191 1 21 ALA HA 1 24 ILE MD 1.800 . 6.500 3.645 2.479 4.575 . 0 0 "[ . 1 . 2 . ]" 1
192 1 24 ILE HA 1 25 GLU H 1.800 . 5.000 3.583 3.548 3.600 . 0 0 "[ . 1 . 2 . ]" 1
193 1 24 ILE HB 1 25 GLU H 1.800 . 3.800 3.353 2.975 3.577 . 0 0 "[ . 1 . 2 . ]" 1
194 1 24 ILE MG 1 25 GLU H 1.800 . 5.300 1.793 1.751 1.843 0.049 14 0 "[ . 1 . 2 . ]" 1
195 1 25 GLU H 1 25 GLU QB 1.800 . 3.800 2.180 1.956 2.419 . 0 0 "[ . 1 . 2 . ]" 1
196 1 25 GLU H 1 25 GLU QG 1.800 . 4.800 2.564 2.091 3.148 . 0 0 "[ . 1 . 2 . ]" 1
197 1 22 MET HA 1 25 GLU H 1.800 . 5.000 3.165 2.850 3.488 . 0 0 "[ . 1 . 2 . ]" 1
198 1 25 GLU HA 1 25 GLU QG 1.800 . 6.000 2.130 1.901 2.300 . 0 0 "[ . 1 . 2 . ]" 1
199 1 25 GLU HA 1 28 LEU QD 1.800 . 6.300 2.323 1.735 3.643 0.065 25 0 "[ . 1 . 2 . ]" 1
200 1 25 GLU HA 1 28 LEU HB2 1.800 . 5.000 4.094 2.022 4.997 . 0 0 "[ . 1 . 2 . ]" 1
201 1 24 ILE HA 1 25 GLU HA 1.800 . 5.000 4.872 4.743 4.964 . 0 0 "[ . 1 . 2 . ]" 1
202 1 25 GLU QG 1 28 LEU QD 1.800 . 8.500 3.271 2.517 4.094 . 0 0 "[ . 1 . 2 . ]" 1
203 1 24 ILE HB 1 25 GLU QG 1.800 . 6.000 4.795 4.071 5.432 . 0 0 "[ . 1 . 2 . ]" 1
204 1 23 LEU HA 1 26 ASP H 1.800 . 5.000 4.101 3.748 4.467 . 0 0 "[ . 1 . 2 . ]" 1
205 1 25 GLU H 1 26 ASP H 1.800 . 5.000 2.740 2.496 2.888 . 0 0 "[ . 1 . 2 . ]" 1
206 1 25 GLU QB 1 26 ASP H 1.800 . 4.800 2.826 2.609 3.106 . 0 0 "[ . 1 . 2 . ]" 1
207 1 26 ASP HA 1 29 CYS HA 1.800 . 5.000 5.060 4.988 5.162 0.162 12 0 "[ . 1 . 2 . ]" 1
208 1 26 ASP HA 1 29 CYS HB3 1.800 . 5.000 3.305 2.366 4.184 . 0 0 "[ . 1 . 2 . ]" 1
209 1 26 ASP HA 1 29 CYS HB2 1.800 . 5.000 2.558 2.169 4.037 . 0 0 "[ . 1 . 2 . ]" 1
210 1 26 ASP HA 1 28 LEU QD 1.800 . 7.500 4.688 3.909 5.762 . 0 0 "[ . 1 . 2 . ]" 1
211 1 22 MET HA 1 26 ASP QB 1.800 . 6.000 4.912 4.579 5.067 . 0 0 "[ . 1 . 2 . ]" 1
212 1 23 LEU HA 1 26 ASP QB 1.800 . 5.000 3.763 3.288 4.292 . 0 0 "[ . 1 . 2 . ]" 1
213 1 22 MET QG 1 26 ASP HB3 1.800 . 4.800 3.815 3.302 4.334 . 0 0 "[ . 1 . 2 . ]" 1
214 1 26 ASP HA 1 27 THR H 1.800 . 5.000 3.568 3.476 3.606 . 0 0 "[ . 1 . 2 . ]" 1
215 1 25 GLU QB 1 27 THR H 1.800 . 6.000 4.868 4.636 5.168 . 0 0 "[ . 1 . 2 . ]" 1
216 1 27 THR H 1 28 LEU HB3 1.800 . 5.000 4.451 4.058 5.249 0.249 14 0 "[ . 1 . 2 . ]" 1
217 1 27 THR H 1 28 LEU H 1.800 . 2.800 2.631 1.910 2.843 0.043 24 0 "[ . 1 . 2 . ]" 1
218 1 27 THR H 1 27 THR HA 1.800 . 2.800 2.872 2.847 2.963 0.163 18 0 "[ . 1 . 2 . ]" 1
219 1 23 LEU QD 1 27 THR H 1.800 . 7.500 3.872 3.456 4.755 . 0 0 "[ . 1 . 2 . ]" 1
220 1 27 THR HA 1 27 THR HB 1.800 . 2.800 2.741 2.388 3.007 0.207 16 0 "[ . 1 . 2 . ]" 1
221 1 27 THR HA 1 27 THR MG 1.800 . 5.300 2.233 1.900 3.211 . 0 0 "[ . 1 . 2 . ]" 1
222 1 27 THR HA 1 31 LEU QD 1.800 . 7.500 3.793 2.902 5.066 . 0 0 "[ . 1 . 2 . ]" 1
223 1 27 THR HA 1 30 GLU QB 1.800 . 6.000 3.323 2.775 4.325 . 0 0 "[ . 1 . 2 . ]" 1
224 1 27 THR HB 1 30 GLU QB 1.800 . 6.000 5.058 4.383 5.443 . 0 0 "[ . 1 . 2 . ]" 1
225 1 26 ASP H 1 28 LEU H 1.800 . 5.000 4.014 3.451 4.485 . 0 0 "[ . 1 . 2 . ]" 1
226 1 28 LEU H 1 28 LEU MD1 1.800 . 5.300 4.016 2.881 4.326 . 0 0 "[ . 1 . 2 . ]" 1
227 1 28 LEU H 1 29 CYS H 1.800 . 3.800 2.635 2.421 2.772 . 0 0 "[ . 1 . 2 . ]" 1
228 1 27 THR HA 1 28 LEU H 1.800 . 3.800 3.557 3.445 3.590 . 0 0 "[ . 1 . 2 . ]" 1
229 1 28 LEU HA 1 28 LEU QD 1.800 . 6.300 2.721 1.812 3.349 . 0 0 "[ . 1 . 2 . ]" 1
230 1 28 LEU HA 1 31 LEU HB2 1.800 . 5.000 2.459 1.790 3.306 0.010 22 0 "[ . 1 . 2 . ]" 1
231 1 24 ILE QG 1 28 LEU HB3 1.800 . 4.800 4.265 4.027 4.432 . 0 0 "[ . 1 . 2 . ]" 1
232 1 28 LEU HB3 1 28 LEU QD 1.800 . 6.300 2.066 1.875 2.288 . 0 0 "[ . 1 . 2 . ]" 1
233 1 24 ILE MG 1 28 LEU HB3 1.800 . 6.500 3.739 3.175 4.227 . 0 0 "[ . 1 . 2 . ]" 1
234 1 25 GLU QB 1 28 LEU HB3 1.800 . 6.000 4.847 4.194 5.413 . 0 0 "[ . 1 . 2 . ]" 1
235 1 25 GLU HA 1 28 LEU HB3 1.800 . 5.000 2.849 2.157 3.485 . 0 0 "[ . 1 . 2 . ]" 1
236 1 28 LEU HB3 1 32 GLY H 1.800 . 5.000 5.018 4.786 5.215 0.215 22 0 "[ . 1 . 2 . ]" 1
237 1 28 LEU HB3 1 31 LEU QD 1.800 . 7.500 4.845 3.868 5.374 . 0 0 "[ . 1 . 2 . ]" 1
238 1 27 THR MG 1 28 LEU H 1.800 . 6.500 3.674 1.766 4.128 0.034 19 0 "[ . 1 . 2 . ]" 1
239 1 29 CYS H 1 31 LEU H 1.800 . 5.000 4.264 3.900 4.520 . 0 0 "[ . 1 . 2 . ]" 1
240 1 26 ASP HA 1 29 CYS H 1.800 . 5.000 3.441 3.176 3.585 . 0 0 "[ . 1 . 2 . ]" 1
241 1 28 LEU HA 1 29 CYS H 1.800 . 5.000 3.518 3.442 3.578 . 0 0 "[ . 1 . 2 . ]" 1
242 1 29 CYS H 1 30 GLU QB 1.800 . 6.000 4.425 4.067 5.187 . 0 0 "[ . 1 . 2 . ]" 1
243 1 28 LEU HB2 1 29 CYS H 1.800 . 5.000 4.081 2.668 4.354 . 0 0 "[ . 1 . 2 . ]" 1
244 1 28 LEU QD 1 29 CYS H 1.800 . 7.500 2.824 1.891 4.016 . 0 0 "[ . 1 . 2 . ]" 1
245 1 29 CYS H 1 29 CYS QB 1.800 . 3.800 2.028 1.926 2.199 . 0 0 "[ . 1 . 2 . ]" 1
246 1 30 GLU H 1 31 LEU H 1.800 . 3.800 2.446 2.223 3.071 . 0 0 "[ . 1 . 2 . ]" 1
247 1 28 LEU H 1 30 GLU H 1.800 . 5.000 4.259 3.968 4.840 . 0 0 "[ . 1 . 2 . ]" 1
248 1 30 GLU H 1 30 GLU HA 1.800 . 2.800 2.924 2.771 2.959 0.159 23 0 "[ . 1 . 2 . ]" 1
249 1 30 GLU H 1 30 GLU QB 1.800 . 3.800 2.188 2.005 2.989 . 0 0 "[ . 1 . 2 . ]" 1
250 1 29 CYS QB 1 30 GLU H 1.800 . 4.800 2.734 1.980 3.464 . 0 0 "[ . 1 . 2 . ]" 1
251 1 27 THR HA 1 30 GLU H 1.800 . 5.000 3.597 3.318 3.922 . 0 0 "[ . 1 . 2 . ]" 1
252 1 30 GLU QB 1 31 LEU H 1.800 . 4.800 2.518 2.159 3.588 . 0 0 "[ . 1 . 2 . ]" 1
253 1 31 LEU H 1 31 LEU QD 1.800 . 6.300 2.639 1.777 3.312 0.023 20 0 "[ . 1 . 2 . ]" 1
254 1 31 LEU H 1 32 GLY H 1.800 . 5.000 2.483 2.123 2.714 . 0 0 "[ . 1 . 2 . ]" 1
255 1 31 LEU H 1 31 LEU HB2 1.800 . 2.800 2.307 1.988 2.835 0.035 13 0 "[ . 1 . 2 . ]" 1
256 1 31 LEU HB3 1 31 LEU QD 1.800 . 7.500 2.010 1.858 2.465 . 0 0 "[ . 1 . 2 . ]" 1
257 1 30 GLU QG 1 31 LEU HB3 1.800 . 6.000 5.069 4.456 5.371 . 0 0 "[ . 1 . 2 . ]" 1
258 1 31 LEU HB2 1 31 LEU QD 1.800 . 7.500 2.005 1.850 2.315 . 0 0 "[ . 1 . 2 . ]" 1
259 1 32 GLY H 1 33 HIS H 1.800 . 2.800 2.405 2.056 2.862 0.062 18 0 "[ . 1 . 2 . ]" 1
260 1 29 CYS HA 1 32 GLY QA 1.800 . 6.000 4.044 3.264 4.494 . 0 0 "[ . 1 . 2 . ]" 1
261 1 32 GLY QA 1 33 HIS HA 1.800 . 6.000 4.277 4.161 4.371 . 0 0 "[ . 1 . 2 . ]" 1
262 1 28 LEU HA 1 33 HIS H 1.800 . 5.000 2.969 1.956 3.492 . 0 0 "[ . 1 . 2 . ]" 1
263 1 33 HIS H 1 33 HIS HB3 1.800 . 3.800 3.441 2.799 3.566 . 0 0 "[ . 1 . 2 . ]" 1
264 1 33 HIS H 1 33 HIS HD2 1.800 . 5.000 4.149 3.169 5.115 0.115 12 0 "[ . 1 . 2 . ]" 1
265 1 33 HIS H 1 33 HIS HB2 1.800 . 3.800 2.210 1.938 3.510 . 0 0 "[ . 1 . 2 . ]" 1
266 1 28 LEU HB2 1 33 HIS H 1.800 . 5.000 3.846 2.616 5.106 0.106 18 0 "[ . 1 . 2 . ]" 1
267 1 31 LEU HB2 1 33 HIS H 1.800 . 5.000 2.752 2.267 3.320 . 0 0 "[ . 1 . 2 . ]" 1
268 1 31 LEU HB3 1 33 HIS H 1.800 . 5.000 3.103 2.102 4.170 . 0 0 "[ . 1 . 2 . ]" 1
269 1 32 GLY QA 1 33 HIS H 1.800 . 6.000 2.817 2.627 2.923 . 0 0 "[ . 1 . 2 . ]" 1
270 1 33 HIS HA 1 33 HIS HD2 1.800 . 5.000 2.420 1.917 4.266 . 0 0 "[ . 1 . 2 . ]" 1
271 1 10 ARG HA 1 33 HIS HA 1.800 . 5.000 4.416 3.455 5.159 0.159 20 0 "[ . 1 . 2 . ]" 1
272 1 31 LEU HB2 1 33 HIS HA 1.800 . 5.000 4.746 3.726 5.194 0.194 12 0 "[ . 1 . 2 . ]" 1
273 1 28 LEU HA 1 33 HIS HB3 1.800 . 5.000 4.808 3.661 5.165 0.165 26 0 "[ . 1 . 2 . ]" 1
274 1 9 LEU QB 1 33 HIS HB3 1.800 . 6.000 4.599 2.003 5.388 . 0 0 "[ . 1 . 2 . ]" 1
275 1 28 LEU QD 1 33 HIS HB3 1.800 . 7.500 3.672 2.541 4.767 . 0 0 "[ . 1 . 2 . ]" 1
276 1 28 LEU HA 1 33 HIS HB2 1.800 . 5.000 3.185 1.895 5.171 0.171 19 0 "[ . 1 . 2 . ]" 1
277 1 31 LEU QD 1 33 HIS HB2 1.800 . 6.300 3.932 3.097 4.576 . 0 0 "[ . 1 . 2 . ]" 1
278 1 9 LEU QD 1 33 HIS HD2 1.800 . 7.500 3.745 2.128 5.628 . 0 0 "[ . 1 . 2 . ]" 1
279 1 33 HIS HD2 1 34 GLU QB 1.800 . 6.000 5.093 4.676 5.369 . 0 0 "[ . 1 . 2 . ]" 1
280 1 31 LEU QD 1 33 HIS HD2 1.800 . 7.500 4.093 2.670 5.511 . 0 0 "[ . 1 . 2 . ]" 1
281 1 9 LEU QB 1 33 HIS HD2 1.800 . 6.000 2.996 1.768 5.196 0.032 13 0 "[ . 1 . 2 . ]" 1
282 1 33 HIS HE1 1 115 VAL MG1 1.800 . 6.500 4.709 3.152 5.329 . 0 0 "[ . 1 . 2 . ]" 1
283 1 33 HIS HE1 1 115 VAL MG2 1.800 . 6.500 4.899 3.401 5.457 . 0 0 "[ . 1 . 2 . ]" 1
284 1 33 HIS HA 1 34 GLU H 1.800 . 3.800 2.636 2.187 3.306 . 0 0 "[ . 1 . 2 . ]" 1
285 1 33 HIS HB3 1 34 GLU H 1.800 . 5.000 2.367 1.708 3.488 0.092 17 0 "[ . 1 . 2 . ]" 1
286 1 33 HIS HB2 1 34 GLU H 1.800 . 5.000 3.607 1.840 4.435 . 0 0 "[ . 1 . 2 . ]" 1
287 1 34 GLU H 1 34 GLU QB 1.800 . 3.800 2.130 1.909 2.561 . 0 0 "[ . 1 . 2 . ]" 1
288 1 11 VAL QG 1 34 GLU H 1.800 . 7.500 4.843 3.901 5.391 . 0 0 "[ . 1 . 2 . ]" 1
289 1 10 ARG QG 1 34 GLU H 1.800 . 6.000 3.699 1.813 5.026 . 0 0 "[ . 1 . 2 . ]" 1
290 1 35 VAL H 1 36 ALA H 1.800 . 5.000 4.016 3.469 4.551 . 0 0 "[ . 1 . 2 . ]" 1
291 1 34 GLU QB 1 35 VAL H 1.800 . 4.800 2.036 1.646 2.861 0.154 6 0 "[ . 1 . 2 . ]" 1
292 1 35 VAL H 1 35 VAL QG 1.800 . 7.500 2.343 1.837 3.237 . 0 0 "[ . 1 . 2 . ]" 1
293 1 11 VAL QG 1 35 VAL H 1.800 . 7.500 5.107 4.140 5.670 . 0 0 "[ . 1 . 2 . ]" 1
294 1 10 ARG HA 1 35 VAL H 1.800 . 5.000 4.201 2.655 5.024 0.024 12 0 "[ . 1 . 2 . ]" 1
295 1 36 ALA H 1 36 ALA HA 1.800 . 2.800 2.920 2.814 2.976 0.176 4 0 "[ . 1 . 2 . ]" 1
296 1 36 ALA H 1 36 ALA MB 1.800 . 4.300 2.131 1.903 2.756 . 0 0 "[ . 1 . 2 . ]" 1
297 1 35 VAL QG 1 36 ALA H 1.800 . 6.300 3.226 2.624 3.746 . 0 0 "[ . 1 . 2 . ]" 1
298 1 25 GLU HG2 1 36 ALA H 1.800 . 6.000 6.014 5.774 6.124 0.124 17 0 "[ . 1 . 2 . ]" 1
299 1 12 LEU HA 1 37 ALA H 1.800 . 5.000 2.159 1.782 3.126 0.018 9 0 "[ . 1 . 2 . ]" 1
300 1 36 ALA H 1 37 ALA H 1.800 . 5.000 4.459 3.157 4.677 . 0 0 "[ . 1 . 2 . ]" 1
301 1 36 ALA HA 1 37 ALA H 1.800 . 3.800 2.607 2.248 3.497 . 0 0 "[ . 1 . 2 . ]" 1
302 1 37 ALA H 1 37 ALA MB 1.800 . 4.300 2.373 2.265 2.565 . 0 0 "[ . 1 . 2 . ]" 1
303 1 13 VAL QG 1 37 ALA H 1.800 . 7.500 3.480 2.899 4.458 . 0 0 "[ . 1 . 2 . ]" 1
304 1 12 LEU QD 1 37 ALA H 1.800 . 6.500 3.081 2.333 4.610 . 0 0 "[ . 1 . 2 . ]" 1
305 1 13 VAL HB 1 37 ALA MB 1.800 . 6.500 4.615 4.124 5.297 . 0 0 "[ . 1 . 2 . ]" 1
306 1 37 ALA MB 1 48 ILE MG 1.800 . 8.000 3.115 2.624 3.621 . 0 0 "[ . 1 . 2 . ]" 1
307 1 20 ILE MG 1 38 THR H 1.800 . 6.500 5.138 4.607 5.279 . 0 0 "[ . 1 . 2 . ]" 1
308 1 38 THR H 1 38 THR MG 1.800 . 5.300 2.503 1.842 3.663 . 0 0 "[ . 1 . 2 . ]" 1
309 1 37 ALA HA 1 38 THR H 1.800 . 3.800 2.302 2.203 2.433 . 0 0 "[ . 1 . 2 . ]" 1
310 1 37 ALA MB 1 38 THR H 1.800 . 4.300 2.880 2.424 3.247 . 0 0 "[ . 1 . 2 . ]" 1
311 1 24 ILE MG 1 38 THR H 1.800 . 6.500 4.958 4.598 5.301 . 0 0 "[ . 1 . 2 . ]" 1
312 1 21 ALA HA 1 38 THR H 1.800 . 5.000 5.061 4.861 5.238 0.238 14 0 "[ . 1 . 2 . ]" 1
313 1 24 ILE MD 1 38 THR H 1.800 . 6.500 4.214 3.272 5.305 . 0 0 "[ . 1 . 2 . ]" 1
314 1 38 THR HA 1 38 THR MG 1.800 . 6.500 2.829 2.002 3.194 . 0 0 "[ . 1 . 2 . ]" 1
315 1 13 VAL QG 1 38 THR HA 1.800 . 7.500 3.964 2.430 4.870 . 0 0 "[ . 1 . 2 . ]" 1
316 1 13 VAL HB 1 38 THR HA 1.800 . 5.000 3.957 2.802 5.116 0.116 16 0 "[ . 1 . 2 . ]" 1
317 1 21 ALA HA 1 38 THR HB 1.800 . 5.000 2.238 1.759 3.930 0.041 2 0 "[ . 1 . 2 . ]" 1
318 1 38 THR HA 1 39 ALA H 1.800 . 5.000 2.378 2.211 2.550 . 0 0 "[ . 1 . 2 . ]" 1
319 1 39 ALA H 1 40 SER H 1.800 . 5.000 4.468 4.381 4.591 . 0 0 "[ . 1 . 2 . ]" 1
320 1 39 ALA H 1 39 ALA MB 1.800 . 4.300 2.832 2.745 3.055 . 0 0 "[ . 1 . 2 . ]" 1
321 1 38 THR MG 1 39 ALA H 1.800 . 5.300 3.431 1.994 4.336 . 0 0 "[ . 1 . 2 . ]" 1
322 1 14 VAL HB 1 39 ALA H 1.800 . 5.000 4.951 4.481 5.142 0.142 9 0 "[ . 1 . 2 . ]" 1
323 1 14 VAL HA 1 39 ALA H 1.800 . 5.000 3.044 2.243 3.401 . 0 0 "[ . 1 . 2 . ]" 1
324 1 38 THR H 1 39 ALA H 1.800 . 5.000 4.452 4.340 4.511 . 0 0 "[ . 1 . 2 . ]" 1
325 1 20 ILE MG 1 39 ALA H 1.800 . 6.500 1.686 1.660 1.729 0.140 25 0 "[ . 1 . 2 . ]" 1
326 1 13 VAL QG 1 39 ALA H 1.800 . 7.500 4.839 3.690 5.564 . 0 0 "[ . 1 . 2 . ]" 1
327 1 38 THR HB 1 39 ALA H 1.800 . 5.000 3.456 2.405 4.383 . 0 0 "[ . 1 . 2 . ]" 1
328 1 15 GLU H 1 39 ALA H 1.800 . 5.000 3.074 2.234 3.424 . 0 0 "[ . 1 . 2 . ]" 1
329 1 38 THR HA 1 39 ALA HA 1.800 . 5.000 4.573 4.490 4.684 . 0 0 "[ . 1 . 2 . ]" 1
330 1 20 ILE H 1 39 ALA MB 1.800 . 6.300 5.121 4.740 5.235 . 0 0 "[ . 1 . 2 . ]" 1
331 1 20 ILE MG 1 39 ALA MB 1.800 . 7.300 3.219 2.639 3.427 . 0 0 "[ . 1 . 2 . ]" 1
332 1 16 ASP QB 1 39 ALA MB 1.800 . 7.300 5.403 5.301 5.496 . 0 0 "[ . 1 . 2 . ]" 1
333 1 38 THR HA 1 39 ALA MB 1.800 . 6.300 4.182 4.058 4.266 . 0 0 "[ . 1 . 2 . ]" 1
334 1 39 ALA MB 1 41 ARG H 1.800 . 6.500 4.873 4.118 5.315 . 0 0 "[ . 1 . 2 . ]" 1
335 1 17 GLU H 1 39 ALA MB 1.800 . 6.500 4.258 2.695 5.315 . 0 0 "[ . 1 . 2 . ]" 1
336 1 39 ALA MB 1 40 SER H 1.800 . 4.300 2.669 2.542 2.867 . 0 0 "[ . 1 . 2 . ]" 1
337 1 39 ALA HA 1 40 SER H 1.800 . 5.000 2.406 2.317 2.504 . 0 0 "[ . 1 . 2 . ]" 1
338 1 40 SER H 1 41 ARG H 1.800 . 5.000 4.507 4.161 4.645 . 0 0 "[ . 1 . 2 . ]" 1
339 1 17 GLU QB 1 40 SER H 1.800 . 6.000 5.827 4.705 6.528 0.528 11 1 "[ . 1+ . 2 . ]" 1
340 1 20 ILE MG 1 40 SER H 1.800 . 5.000 4.191 4.093 4.295 . 0 0 "[ . 1 . 2 . ]" 1
341 1 40 SER HA 1 41 ARG QD 1.800 . 6.000 5.156 4.923 5.415 . 0 0 "[ . 1 . 2 . ]" 1
342 1 39 ALA HA 1 40 SER HA 1.800 . 5.000 4.389 4.347 4.415 . 0 0 "[ . 1 . 2 . ]" 1
343 1 15 GLU QB 1 40 SER HB2 1.800 . 6.000 5.288 5.007 5.517 . 0 0 "[ . 1 . 2 . ]" 1
344 1 40 SER HB2 1 41 ARG HA 1.800 . 5.000 4.751 4.499 5.032 0.032 16 0 "[ . 1 . 2 . ]" 1
345 1 39 ALA MB 1 40 SER HB2 1.800 . 6.500 5.441 5.363 5.524 . 0 0 "[ . 1 . 2 . ]" 1
346 1 15 GLU HA 1 40 SER HB2 1.800 . 5.000 3.549 3.155 3.801 . 0 0 "[ . 1 . 2 . ]" 1
347 1 40 SER HB2 1 42 MET QG 1.800 . 6.000 5.302 5.046 5.462 . 0 0 "[ . 1 . 2 . ]" 1
348 1 41 ARG H 1 41 ARG HA 1.800 . 2.800 2.957 2.925 2.978 0.178 3 0 "[ . 1 . 2 . ]" 1
349 1 41 ARG H 1 41 ARG HB2 1.800 . 3.800 2.820 2.484 3.009 . 0 0 "[ . 1 . 2 . ]" 1
350 1 41 ARG H 1 42 MET QG 1.800 . 6.000 5.012 4.599 5.377 . 0 0 "[ . 1 . 2 . ]" 1
351 1 14 VAL HB 1 41 ARG H 1.800 . 5.000 2.864 1.896 4.987 . 0 0 "[ . 1 . 2 . ]" 1
352 1 14 VAL QG 1 41 ARG H 1.800 . 7.500 2.549 1.755 2.929 0.045 20 0 "[ . 1 . 2 . ]" 1
353 1 41 ARG HB2 1 41 ARG QD 1.800 . 3.800 2.242 1.924 2.494 . 0 0 "[ . 1 . 2 . ]" 1
354 1 14 VAL QG 1 41 ARG HB2 1.800 . 5.300 3.678 3.156 3.984 . 0 0 "[ . 1 . 2 . ]" 1
355 1 41 ARG HB2 1 44 GLU H 1.800 . 5.000 4.109 3.728 4.468 . 0 0 "[ . 1 . 2 . ]" 1
356 1 37 ALA MB 1 41 ARG HB2 1.800 . 6.500 5.208 4.928 5.420 . 0 0 "[ . 1 . 2 . ]" 1
357 1 41 ARG HB2 1 43 GLN QB 1.800 . 6.000 4.954 4.651 5.322 . 0 0 "[ . 1 . 2 . ]" 1
358 1 40 SER HA 1 41 ARG HB2 1.800 . 5.000 4.144 3.965 4.399 . 0 0 "[ . 1 . 2 . ]" 1
359 1 41 ARG QG 1 42 MET H 1.800 . 6.000 3.108 2.722 3.484 . 0 0 "[ . 1 . 2 . ]" 1
360 1 41 ARG H 1 42 MET H 1.800 . 5.000 4.144 3.983 4.424 . 0 0 "[ . 1 . 2 . ]" 1
361 1 42 MET H 1 42 MET HA 1.800 . 2.800 2.839 2.778 2.883 0.083 17 0 "[ . 1 . 2 . ]" 1
362 1 42 MET H 1 42 MET QB 1.800 . 3.800 2.299 2.082 2.558 . 0 0 "[ . 1 . 2 . ]" 1
363 1 41 ARG HB2 1 42 MET H 1.800 . 5.000 4.570 4.468 4.632 . 0 0 "[ . 1 . 2 . ]" 1
364 1 42 MET H 1 43 GLN HA 1.800 . 6.000 5.365 5.236 5.506 . 0 0 "[ . 1 . 2 . ]" 1
365 1 42 MET QB 1 43 GLN HA 1.800 . 6.000 3.981 3.936 4.047 . 0 0 "[ . 1 . 2 . ]" 1
366 1 43 GLN H 1 46 LEU QD 1.800 . 7.500 5.496 5.353 5.584 . 0 0 "[ . 1 . 2 . ]" 1
367 1 42 MET QG 1 43 GLN H 1.800 . 6.000 4.133 3.956 4.340 . 0 0 "[ . 1 . 2 . ]" 1
368 1 42 MET H 1 43 GLN H 1.800 . 5.000 2.714 2.554 2.876 . 0 0 "[ . 1 . 2 . ]" 1
369 1 43 GLN H 1 44 GLU H 1.800 . 3.800 2.849 2.532 3.160 . 0 0 "[ . 1 . 2 . ]" 1
370 1 43 GLN H 1 43 GLN HB3 1.800 . 3.800 2.980 2.314 3.530 . 0 0 "[ . 1 . 2 . ]" 1
371 1 43 GLN H 1 43 GLN HB2 1.800 . 2.800 2.209 1.945 2.574 . 0 0 "[ . 1 . 2 . ]" 1
372 1 41 ARG HB2 1 43 GLN H 1.800 . 5.000 4.896 4.465 5.056 0.056 12 0 "[ . 1 . 2 . ]" 1
373 1 44 GLU H 1 46 LEU HB3 1.800 . 6.000 5.200 4.936 5.611 . 0 0 "[ . 1 . 2 . ]" 1
374 1 44 GLU H 1 44 GLU HA 1.800 . 2.800 2.854 2.805 2.919 0.119 22 0 "[ . 1 . 2 . ]" 1
375 1 44 GLU H 1 44 GLU QB 1.800 . 3.800 2.225 1.939 2.507 . 0 0 "[ . 1 . 2 . ]" 1
376 1 44 GLU H 1 45 ALA MB 1.800 . 6.500 4.214 3.995 4.349 . 0 0 "[ . 1 . 2 . ]" 1
377 1 43 GLN QG 1 44 GLU H 1.800 . 6.000 3.742 3.020 4.232 . 0 0 "[ . 1 . 2 . ]" 1
378 1 44 GLU HA 1 47 ASP QB 1.800 . 4.800 2.447 1.983 3.175 . 0 0 "[ . 1 . 2 . ]" 1
379 1 44 GLU QB 1 44 GLU QG 1.800 . 4.800 2.062 1.997 2.109 . 0 0 "[ . 1 . 2 . ]" 1
380 1 37 ALA MB 1 44 GLU QB 1.800 . 6.300 2.646 2.112 3.353 . 0 0 "[ . 1 . 2 . ]" 1
381 1 41 ARG QG 1 44 GLU QB 1.800 . 5.800 3.222 2.555 3.789 . 0 0 "[ . 1 . 2 . ]" 1
382 1 14 VAL QG 1 44 GLU QB 1.800 . 6.300 2.966 2.370 4.024 . 0 0 "[ . 1 . 2 . ]" 1
383 1 44 GLU QB 1 48 ILE MG 1.800 . 7.500 3.499 3.091 3.938 . 0 0 "[ . 1 . 2 . ]" 1
384 1 44 GLU QB 1 48 ILE MD 1.800 . 7.500 4.830 4.477 5.185 . 0 0 "[ . 1 . 2 . ]" 1
385 1 44 GLU QB 1 45 ALA HA 1.800 . 6.000 3.886 3.742 3.950 . 0 0 "[ . 1 . 2 . ]" 1
386 1 44 GLU HA 1 44 GLU QG 1.800 . 3.800 2.388 2.056 3.122 . 0 0 "[ . 1 . 2 . ]" 1
387 1 44 GLU HA 1 45 ALA H 1.800 . 3.800 3.578 3.550 3.592 . 0 0 "[ . 1 . 2 . ]" 1
388 1 44 GLU HB2 1 45 ALA H 1.800 . 2.800 2.528 2.190 2.907 0.107 7 0 "[ . 1 . 2 . ]" 1
389 1 45 ALA H 1 46 LEU HB3 1.800 . 5.000 4.908 4.679 5.088 0.088 2 0 "[ . 1 . 2 . ]" 1
390 1 45 ALA H 1 46 LEU QD 1.800 . 7.500 5.443 5.147 5.628 . 0 0 "[ . 1 . 2 . ]" 1
391 1 44 GLU QG 1 45 ALA H 1.800 . 6.000 4.108 3.699 4.445 . 0 0 "[ . 1 . 2 . ]" 1
392 1 44 GLU H 1 45 ALA H 1.800 . 2.800 2.741 2.512 2.858 0.058 7 0 "[ . 1 . 2 . ]" 1
393 1 45 ALA H 1 46 LEU H 1.800 . 3.800 2.941 2.636 3.239 . 0 0 "[ . 1 . 2 . ]" 1
394 1 45 ALA H 1 45 ALA MB 1.800 . 4.300 2.130 1.949 2.175 . 0 0 "[ . 1 . 2 . ]" 1
395 1 45 ALA HA 1 48 ILE HB 1.800 . 5.000 4.514 4.261 4.824 . 0 0 "[ . 1 . 2 . ]" 1
396 1 45 ALA HA 1 48 ILE QG 1.800 . 4.800 3.230 2.799 3.608 . 0 0 "[ . 1 . 2 . ]" 1
397 1 45 ALA HA 1 59 ILE MD 1.800 . 6.500 3.136 2.587 3.718 . 0 0 "[ . 1 . 2 . ]" 1
398 1 45 ALA MB 1 48 ILE QG 1.800 . 7.500 3.808 3.575 4.119 . 0 0 "[ . 1 . 2 . ]" 1
399 1 46 LEU H 1 47 ASP H 1.800 . 2.800 2.757 2.466 2.896 0.096 5 0 "[ . 1 . 2 . ]" 1
400 1 46 LEU H 1 46 LEU HA 1.800 . 2.800 2.811 2.749 2.886 0.086 26 0 "[ . 1 . 2 . ]" 1
401 1 46 LEU H 1 46 LEU HB2 1.800 . 2.800 2.373 2.013 2.667 . 0 0 "[ . 1 . 2 . ]" 1
402 1 46 LEU H 1 46 LEU HB3 1.800 . 2.800 2.477 2.161 2.809 0.009 2 0 "[ . 1 . 2 . ]" 1
403 1 46 LEU H 1 49 ALA H 1.800 . 5.000 4.969 4.791 5.150 0.150 17 0 "[ . 1 . 2 . ]" 1
404 1 46 LEU H 1 46 LEU QD 1.800 . 5.300 3.519 3.220 3.674 . 0 0 "[ . 1 . 2 . ]" 1
405 1 44 GLU HA 1 46 LEU H 1.800 . 5.000 4.454 3.918 5.017 0.017 17 0 "[ . 1 . 2 . ]" 1
406 1 44 GLU H 1 46 LEU H 1.800 . 5.000 4.376 4.063 4.720 . 0 0 "[ . 1 . 2 . ]" 1
407 1 46 LEU H 1 48 ILE MD 1.800 . 6.500 4.708 4.329 4.995 . 0 0 "[ . 1 . 2 . ]" 1
408 1 46 LEU H 1 59 ILE MD 1.800 . 6.500 5.167 4.698 5.380 . 0 0 "[ . 1 . 2 . ]" 1
409 1 46 LEU HB3 1 46 LEU QD 1.800 . 4.300 2.120 1.856 2.444 . 0 0 "[ . 1 . 2 . ]" 1
410 1 46 LEU HB3 1 50 ARG QD 1.800 . 6.000 4.235 2.236 5.357 . 0 0 "[ . 1 . 2 . ]" 1
411 1 44 GLU HA 1 46 LEU HB3 1.800 . 5.000 4.724 4.371 5.074 0.074 13 0 "[ . 1 . 2 . ]" 1
412 1 43 GLN HA 1 46 LEU HB3 1.800 . 3.800 3.421 2.922 3.808 0.008 25 0 "[ . 1 . 2 . ]" 1
413 1 46 LEU QD 1 47 ASP H 1.800 . 6.300 3.199 2.165 4.069 . 0 0 "[ . 1 . 2 . ]" 1
414 1 45 ALA HA 1 47 ASP H 1.800 . 5.000 4.232 3.922 4.477 . 0 0 "[ . 1 . 2 . ]" 1
415 1 46 LEU HB3 1 47 ASP H 1.800 . 2.800 2.546 2.405 2.800 . 0 0 "[ . 1 . 2 . ]" 1
416 1 46 LEU HB2 1 47 ASP H 1.800 . 3.800 3.790 3.516 3.927 0.127 8 0 "[ . 1 . 2 . ]" 1
417 1 47 ASP H 1 48 ILE H 1.800 . 2.800 2.686 2.479 2.847 0.047 22 0 "[ . 1 . 2 . ]" 1
418 1 44 GLU H 1 47 ASP H 1.800 . 5.000 4.877 4.582 5.022 0.022 11 0 "[ . 1 . 2 . ]" 1
419 1 47 ASP H 1 47 ASP HA 1.800 . 2.800 2.858 2.820 2.909 0.109 4 0 "[ . 1 . 2 . ]" 1
420 1 47 ASP H 1 47 ASP QB 1.800 . 3.800 2.070 1.903 2.426 . 0 0 "[ . 1 . 2 . ]" 1
421 1 45 ALA MB 1 47 ASP H 1.800 . 6.500 4.293 4.045 4.517 . 0 0 "[ . 1 . 2 . ]" 1
422 1 46 LEU HA 1 48 ILE H 1.800 . 5.000 4.082 3.542 4.917 . 0 0 "[ . 1 . 2 . ]" 1
423 1 48 ILE H 1 48 ILE HA 1.800 . 2.800 2.910 2.776 2.956 0.156 18 0 "[ . 1 . 2 . ]" 1
424 1 48 ILE H 1 48 ILE HB 1.800 . 3.800 3.560 3.477 3.626 . 0 0 "[ . 1 . 2 . ]" 1
425 1 48 ILE H 1 48 ILE QG 1.800 . 4.800 2.676 2.459 3.038 . 0 0 "[ . 1 . 2 . ]" 1
426 1 47 ASP QB 1 48 ILE H 1.800 . 3.800 2.856 2.281 3.345 . 0 0 "[ . 1 . 2 . ]" 1
427 1 48 ILE H 1 54 PHE QD 1.800 . 6.000 5.378 4.227 5.829 . 0 0 "[ . 1 . 2 . ]" 1
428 1 44 GLU HA 1 48 ILE H 1.800 . 5.000 4.751 4.119 4.989 . 0 0 "[ . 1 . 2 . ]" 1
429 1 48 ILE MD 1 48 ILE QG 1.800 . 7.500 1.896 1.881 1.921 . 0 0 "[ . 1 . 2 . ]" 1
430 1 48 ILE QG 1 48 ILE MG 1.800 . 7.500 2.406 2.327 2.509 . 0 0 "[ . 1 . 2 . ]" 1
431 1 48 ILE QG 1 75 LEU QD 1.800 . 8.500 2.242 1.781 2.641 0.019 15 0 "[ . 1 . 2 . ]" 1
432 1 46 LEU HA 1 48 ILE QG 1.800 . 6.000 4.270 3.857 4.715 . 0 0 "[ . 1 . 2 . ]" 1
433 1 48 ILE QG 1 57 ALA HA 1.800 . 4.800 3.991 3.603 4.169 . 0 0 "[ . 1 . 2 . ]" 1
434 1 48 ILE MG 1 57 ALA MB 1.800 . 8.000 3.131 2.946 3.576 . 0 0 "[ . 1 . 2 . ]" 1
435 1 45 ALA MB 1 48 ILE MG 1.800 . 8.000 3.408 3.278 3.701 . 0 0 "[ . 1 . 2 . ]" 1
436 1 12 LEU MD1 1 48 ILE MG 1.800 . 8.000 2.323 1.706 3.281 0.094 15 0 "[ . 1 . 2 . ]" 1
437 1 12 LEU HG 1 48 ILE MG 1.800 . 6.500 2.934 1.766 3.778 0.034 6 0 "[ . 1 . 2 . ]" 1
438 1 47 ASP QB 1 48 ILE MG 1.800 . 7.500 2.916 2.675 3.452 . 0 0 "[ . 1 . 2 . ]" 1
439 1 48 ILE HB 1 49 ALA H 1.800 . 5.000 4.207 3.956 4.458 . 0 0 "[ . 1 . 2 . ]" 1
440 1 48 ILE MD 1 49 ALA H 1.800 . 6.500 3.900 3.527 4.371 . 0 0 "[ . 1 . 2 . ]" 1
441 1 48 ILE H 1 49 ALA H 1.800 . 2.800 2.431 2.206 2.870 0.070 17 0 "[ . 1 . 2 . ]" 1
442 1 49 ALA H 1 50 ARG H 1.800 . 2.800 2.652 2.444 2.782 . 0 0 "[ . 1 . 2 . ]" 1
443 1 49 ALA H 1 49 ALA HA 1.800 . 2.800 2.941 2.900 2.955 0.155 12 0 "[ . 1 . 2 . ]" 1
444 1 49 ALA H 1 49 ALA MB 1.800 . 4.300 2.143 2.009 2.231 . 0 0 "[ . 1 . 2 . ]" 1
445 1 46 LEU QD 1 49 ALA H 1.800 . 6.300 4.408 3.583 4.800 . 0 0 "[ . 1 . 2 . ]" 1
446 1 45 ALA HA 1 49 ALA H 1.800 . 5.000 4.696 4.430 4.876 . 0 0 "[ . 1 . 2 . ]" 1
447 1 49 ALA H 1 54 PHE QD 1.800 . 6.000 5.138 4.375 5.539 . 0 0 "[ . 1 . 2 . ]" 1
448 1 48 ILE MD 1 49 ALA HA 1.800 . 6.500 4.798 4.692 4.929 . 0 0 "[ . 1 . 2 . ]" 1
449 1 48 ILE QG 1 49 ALA HA 1.800 . 4.800 3.194 3.095 3.309 . 0 0 "[ . 1 . 2 . ]" 1
450 1 49 ALA HA 1 52 GLY QA 1.800 . 6.000 4.908 3.682 5.288 . 0 0 "[ . 1 . 2 . ]" 1
451 1 49 ALA HA 1 54 PHE QD 1.800 . 5.000 4.543 3.964 4.835 . 0 0 "[ . 1 . 2 . ]" 1
452 1 49 ALA HA 1 54 PHE QE 1.800 . 5.000 3.470 3.158 4.286 . 0 0 "[ . 1 . 2 . ]" 1
453 1 49 ALA HA 1 54 PHE HZ 1.800 . 5.000 4.012 3.328 4.830 . 0 0 "[ . 1 . 2 . ]" 1
454 1 49 ALA HA 1 75 LEU HG 1.800 . 4.300 4.278 4.005 4.420 0.120 12 0 "[ . 1 . 2 . ]" 1
455 1 49 ALA HA 1 75 LEU QD 1.800 . 6.800 1.772 1.666 1.963 0.134 25 0 "[ . 1 . 2 . ]" 1
456 1 49 ALA HA 1 80 VAL QG 1.800 . 7.500 4.697 3.969 5.314 . 0 0 "[ . 1 . 2 . ]" 1
457 1 46 LEU HA 1 49 ALA MB 1.800 . 6.500 2.886 2.485 3.279 . 0 0 "[ . 1 . 2 . ]" 1
458 1 46 LEU HG 1 49 ALA MB 1.800 . 6.500 4.303 3.579 5.408 . 0 0 "[ . 1 . 2 . ]" 1
459 1 48 ILE MG 1 49 ALA MB 1.800 . 8.000 4.355 4.205 4.493 . 0 0 "[ . 1 . 2 . ]" 1
460 1 48 ILE MD 1 49 ALA MB 1.800 . 8.000 3.776 3.554 4.061 . 0 0 "[ . 1 . 2 . ]" 1
461 1 49 ALA MB 1 50 ARG QD 1.800 . 7.500 3.205 1.995 4.487 . 0 0 "[ . 1 . 2 . ]" 1
462 1 48 ILE QG 1 49 ALA MB 1.800 . 7.500 2.659 2.449 2.849 . 0 0 "[ . 1 . 2 . ]" 1
463 1 48 ILE H 1 50 ARG H 1.800 . 5.000 4.516 3.865 5.043 0.043 4 0 "[ . 1 . 2 . ]" 1
464 1 50 ARG H 1 50 ARG QD 1.800 . 6.000 2.655 1.895 3.841 . 0 0 "[ . 1 . 2 . ]" 1
465 1 50 ARG H 1 50 ARG HA 1.800 . 2.800 2.826 2.767 2.910 0.110 10 0 "[ . 1 . 2 . ]" 1
466 1 50 ARG H 1 50 ARG QB 1.800 . 3.800 2.176 1.920 2.797 . 0 0 "[ . 1 . 2 . ]" 1
467 1 46 LEU QD 1 50 ARG QB 1.800 . 6.300 2.729 1.760 3.970 0.040 2 0 "[ . 1 . 2 . ]" 1
468 1 47 ASP HA 1 50 ARG QB 1.800 . 6.000 3.703 2.040 4.997 . 0 0 "[ . 1 . 2 . ]" 1
469 1 50 ARG HA 1 50 ARG QD 1.800 . 6.000 3.400 2.069 4.332 . 0 0 "[ . 1 . 2 . ]" 1
470 1 46 LEU HA 1 50 ARG QD 1.800 . 3.800 3.338 2.842 3.615 . 0 0 "[ . 1 . 2 . ]" 1
471 1 46 LEU QD 1 51 LYS H 1.800 . 7.500 4.843 3.864 5.748 . 0 0 "[ . 1 . 2 . ]" 1
472 1 48 ILE HA 1 51 LYS H 1.800 . 5.000 4.269 3.623 4.519 . 0 0 "[ . 1 . 2 . ]" 1
473 1 51 LYS H 1 51 LYS HA 1.800 . 2.800 2.840 2.799 2.928 0.128 26 0 "[ . 1 . 2 . ]" 1
474 1 51 LYS H 1 51 LYS QB 1.800 . 3.800 2.175 1.948 2.598 . 0 0 "[ . 1 . 2 . ]" 1
475 1 51 LYS H 1 51 LYS QG 1.800 . 4.800 3.697 1.751 3.970 0.049 4 0 "[ . 1 . 2 . ]" 1
476 1 51 LYS H 1 52 GLY H 1.800 . 5.000 2.801 2.515 2.919 . 0 0 "[ . 1 . 2 . ]" 1
477 1 52 GLY H 1 53 GLN H 1.800 . 5.000 3.202 2.558 3.774 . 0 0 "[ . 1 . 2 . ]" 1
478 1 52 GLY H 1 54 PHE H 1.800 . 5.000 3.723 3.331 4.591 . 0 0 "[ . 1 . 2 . ]" 1
479 1 51 LYS HA 1 52 GLY H 1.800 . 5.000 3.580 3.546 3.606 . 0 0 "[ . 1 . 2 . ]" 1
480 1 51 LYS QB 1 52 GLY H 1.800 . 3.800 2.431 2.220 2.666 . 0 0 "[ . 1 . 2 . ]" 1
481 1 51 LYS QG 1 52 GLY H 1.800 . 6.000 3.336 2.801 4.030 . 0 0 "[ . 1 . 2 . ]" 1
482 1 53 GLN H 1 54 PHE H 1.800 . 5.000 2.629 1.767 3.476 0.033 6 0 "[ . 1 . 2 . ]" 1
483 1 52 GLY QA 1 53 GLN H 1.800 . 3.800 2.711 2.433 2.937 . 0 0 "[ . 1 . 2 . ]" 1
484 1 53 GLN H 1 53 GLN QB 1.800 . 3.800 2.785 2.287 3.234 . 0 0 "[ . 1 . 2 . ]" 1
485 1 51 LYS HA 1 53 GLN QG 1.800 . 6.000 4.239 3.184 5.512 . 0 0 "[ . 1 . 2 . ]" 1
486 1 51 LYS QG 1 53 GLN QG 1.800 . 7.000 2.708 1.686 5.135 0.114 25 0 "[ . 1 . 2 . ]" 1
487 1 52 GLY QA 1 54 PHE H 1.800 . 6.000 3.917 3.525 4.426 . 0 0 "[ . 1 . 2 . ]" 1
488 1 53 GLN QB 1 54 PHE H 1.800 . 4.800 3.836 2.776 4.080 . 0 0 "[ . 1 . 2 . ]" 1
489 1 53 GLN HA 1 54 PHE H 1.800 . 3.800 3.017 2.649 3.512 . 0 0 "[ . 1 . 2 . ]" 1
490 1 54 PHE HA 1 54 PHE QD 1.800 . 5.000 3.653 3.409 3.727 . 0 0 "[ . 1 . 2 . ]" 1
491 1 10 ARG HB2 1 54 PHE HA 1.800 . 5.000 4.143 2.487 5.288 0.288 26 0 "[ . 1 . 2 . ]" 1
492 1 10 ARG HB3 1 54 PHE HA 1.800 . 5.000 4.153 2.500 5.184 0.184 2 0 "[ . 1 . 2 . ]" 1
493 1 53 GLN HA 1 54 PHE HA 1.800 . 5.000 4.747 4.503 5.030 0.030 18 0 "[ . 1 . 2 . ]" 1
494 1 53 GLN HG2 1 54 PHE HA 1.800 . 6.000 5.337 3.929 6.224 0.224 20 0 "[ . 1 . 2 . ]" 1
495 1 48 ILE QG 1 54 PHE QD 1.800 . 6.000 4.098 3.036 4.590 . 0 0 "[ . 1 . 2 . ]" 1
496 1 51 LYS QG 1 54 PHE QD 1.800 . 6.000 2.881 2.133 3.627 . 0 0 "[ . 1 . 2 . ]" 1
497 1 54 PHE QD 1 56 ILE HA 1.800 . 5.000 4.019 3.518 4.906 . 0 0 "[ . 1 . 2 . ]" 1
498 1 12 LEU HG 1 54 PHE QD 1.800 . 5.000 3.492 2.599 4.352 . 0 0 "[ . 1 . 2 . ]" 1
499 1 48 ILE HA 1 54 PHE QD 1.800 . 3.800 3.022 1.724 3.576 0.076 13 0 "[ . 1 . 2 . ]" 1
500 1 48 ILE MG 1 54 PHE QD 1.800 . 6.500 4.173 3.194 4.740 . 0 0 "[ . 1 . 2 . ]" 1
501 1 54 PHE QD 1 75 LEU MD1 1.800 . 6.500 4.565 3.407 4.963 . 0 0 "[ . 1 . 2 . ]" 1
502 1 54 PHE QD 1 75 LEU MD2 1.800 . 6.500 4.633 3.969 4.961 . 0 0 "[ . 1 . 2 . ]" 1
503 1 48 ILE MG 1 54 PHE QE 1.800 . 6.500 4.746 3.589 5.171 . 0 0 "[ . 1 . 2 . ]" 1
504 1 48 ILE MD 1 54 PHE QE 1.800 . 6.500 4.188 2.902 4.696 . 0 0 "[ . 1 . 2 . ]" 1
505 1 51 LYS QG 1 54 PHE QE 1.800 . 6.000 4.786 4.258 5.187 . 0 0 "[ . 1 . 2 . ]" 1
506 1 51 LYS QB 1 54 PHE QE 1.800 . 6.000 4.215 3.407 4.816 . 0 0 "[ . 1 . 2 . ]" 1
507 1 48 ILE HA 1 54 PHE QE 1.800 . 5.000 4.178 3.189 4.632 . 0 0 "[ . 1 . 2 . ]" 1
508 1 48 ILE QG 1 54 PHE QE 1.800 . 6.000 3.312 1.775 3.864 0.025 26 0 "[ . 1 . 2 . ]" 1
509 1 48 ILE QG 1 54 PHE HZ 1.800 . 4.800 4.013 3.671 4.177 . 0 0 "[ . 1 . 2 . ]" 1
510 1 55 ASP H 1 80 VAL QG 1.800 . 7.500 4.796 3.900 5.243 . 0 0 "[ . 1 . 2 . ]" 1
511 1 55 ASP H 1 55 ASP QB 1.800 . 3.800 2.896 2.106 3.455 . 0 0 "[ . 1 . 2 . ]" 1
512 1 55 ASP H 1 56 ILE H 1.800 . 3.800 3.540 1.872 3.983 0.183 21 0 "[ . 1 . 2 . ]" 1
513 1 54 PHE H 1 55 ASP H 1.800 . 5.000 2.891 1.883 4.684 . 0 0 "[ . 1 . 2 . ]" 1
514 1 54 PHE HA 1 55 ASP H 1.800 . 3.800 3.177 2.335 3.558 . 0 0 "[ . 1 . 2 . ]" 1
515 1 54 PHE QD 1 55 ASP H 1.800 . 5.000 3.207 1.816 4.219 . 0 0 "[ . 1 . 2 . ]" 1
516 1 55 ASP H 1 56 ILE HB 1.800 . 7.500 6.063 4.560 6.566 . 0 0 "[ . 1 . 2 . ]" 1
517 1 55 ASP HA 1 56 ILE HA 1.800 . 5.000 4.591 4.502 4.649 . 0 0 "[ . 1 . 2 . ]" 1
518 1 54 PHE QD 1 56 ILE H 1.800 . 5.000 2.860 2.157 3.857 . 0 0 "[ . 1 . 2 . ]" 1
519 1 11 VAL HA 1 56 ILE H 1.800 . 5.000 2.870 2.095 3.450 . 0 0 "[ . 1 . 2 . ]" 1
520 1 55 ASP QB 1 56 ILE H 1.800 . 4.800 2.273 1.825 3.153 . 0 0 "[ . 1 . 2 . ]" 1
521 1 56 ILE H 1 56 ILE QG 1.800 . 6.000 2.914 2.298 3.398 . 0 0 "[ . 1 . 2 . ]" 1
522 1 56 ILE H 1 56 ILE MG 1.800 . 6.500 3.864 3.762 3.983 . 0 0 "[ . 1 . 2 . ]" 1
523 1 56 ILE H 1 57 ALA MB 1.800 . 6.500 4.572 4.310 5.009 . 0 0 "[ . 1 . 2 . ]" 1
524 1 54 PHE HA 1 56 ILE H 1.800 . 5.000 4.624 4.179 5.177 0.177 2 0 "[ . 1 . 2 . ]" 1
525 1 10 ARG HE 1 56 ILE H 1.800 . 6.000 6.318 4.692 7.762 1.762 26 12 "[** ** ** 1**- . * * .+]" 1
526 1 56 ILE HA 1 57 ALA H 1.800 . 3.800 2.362 2.209 2.455 . 0 0 "[ . 1 . 2 . ]" 1
527 1 56 ILE HA 1 57 ALA MB 1.800 . 6.500 3.794 3.667 3.864 . 0 0 "[ . 1 . 2 . ]" 1
528 1 56 ILE HA 1 82 PHE HA 1.800 . 5.000 1.964 1.791 2.163 0.009 14 0 "[ . 1 . 2 . ]" 1
529 1 56 ILE HA 1 56 ILE QG 1.800 . 6.000 2.331 2.137 2.589 . 0 0 "[ . 1 . 2 . ]" 1
530 1 56 ILE HA 1 56 ILE MG 1.800 . 5.300 2.354 2.160 2.552 . 0 0 "[ . 1 . 2 . ]" 1
531 1 56 ILE HA 1 56 ILE MD 1.800 . 6.500 3.658 2.394 3.842 . 0 0 "[ . 1 . 2 . ]" 1
532 1 56 ILE HA 1 57 ALA HA 1.800 . 5.000 4.570 4.499 4.628 . 0 0 "[ . 1 . 2 . ]" 1
533 1 56 ILE HB 1 57 ALA H 1.800 . 5.000 3.948 3.493 4.206 . 0 0 "[ . 1 . 2 . ]" 1
534 1 11 VAL HA 1 56 ILE HB 1.800 . 5.000 2.209 1.814 2.905 . 0 0 "[ . 1 . 2 . ]" 1
535 1 11 VAL HB 1 56 ILE HB 1.800 . 5.000 3.087 1.883 4.413 . 0 0 "[ . 1 . 2 . ]" 1
536 1 56 ILE HB 1 56 ILE MD 1.800 . 5.300 2.459 2.124 3.153 . 0 0 "[ . 1 . 2 . ]" 1
537 1 55 ASP QB 1 56 ILE QG 1.800 . 7.000 2.788 2.149 3.475 . 0 0 "[ . 1 . 2 . ]" 1
538 1 55 ASP H 1 56 ILE QG 1.800 . 6.000 4.981 4.297 5.260 . 0 0 "[ . 1 . 2 . ]" 1
539 1 56 ILE QG 1 82 PHE H 1.800 . 6.000 4.326 4.006 5.254 . 0 0 "[ . 1 . 2 . ]" 1
540 1 56 ILE QG 1 83 ILE H 1.800 . 6.000 3.770 3.146 4.413 . 0 0 "[ . 1 . 2 . ]" 1
541 1 56 ILE QG 1 82 PHE HA 1.800 . 6.000 2.161 1.855 2.813 . 0 0 "[ . 1 . 2 . ]" 1
542 1 56 ILE MG 1 82 PHE HA 1.800 . 6.500 3.254 2.414 3.910 . 0 0 "[ . 1 . 2 . ]" 1
543 1 56 ILE MG 1 82 PHE HB2 1.800 . 6.500 3.344 2.863 3.903 . 0 0 "[ . 1 . 2 . ]" 1
544 1 56 ILE MG 1 58 ILE MD 1.800 . 8.000 1.715 1.591 1.922 0.209 9 0 "[ . 1 . 2 . ]" 1
545 1 56 ILE MD 1 56 ILE QG 1.800 . 6.800 1.893 1.876 1.917 . 0 0 "[ . 1 . 2 . ]" 1
546 1 56 ILE MD 1 56 ILE MG 1.800 . 5.800 1.728 1.539 2.236 0.261 14 0 "[ . 1 . 2 . ]" 1
547 1 56 ILE H 1 57 ALA H 1.800 . 5.000 4.513 4.395 4.601 . 0 0 "[ . 1 . 2 . ]" 1
548 1 57 ALA H 1 82 PHE HB3 1.800 . 5.000 4.201 3.851 4.569 . 0 0 "[ . 1 . 2 . ]" 1
549 1 57 ALA H 1 82 PHE HB2 1.800 . 5.000 2.475 2.173 2.831 . 0 0 "[ . 1 . 2 . ]" 1
550 1 57 ALA H 1 57 ALA MB 1.800 . 4.300 2.556 2.441 2.629 . 0 0 "[ . 1 . 2 . ]" 1
551 1 56 ILE MG 1 57 ALA H 1.800 . 5.300 2.051 1.823 2.389 . 0 0 "[ . 1 . 2 . ]" 1
552 1 57 ALA H 1 82 PHE HA 1.800 . 3.800 3.835 3.662 3.935 0.135 24 0 "[ . 1 . 2 . ]" 1
553 1 57 ALA H 1 58 ILE H 1.800 . 5.000 4.282 4.173 4.428 . 0 0 "[ . 1 . 2 . ]" 1
554 1 12 LEU MD1 1 57 ALA HA 1.800 . 6.500 4.535 2.859 5.290 . 0 0 "[ . 1 . 2 . ]" 1
555 1 56 ILE MG 1 57 ALA HA 1.800 . 6.500 3.522 3.153 3.830 . 0 0 "[ . 1 . 2 . ]" 1
556 1 57 ALA HA 1 58 ILE MD 1.800 . 6.500 2.692 2.435 2.921 . 0 0 "[ . 1 . 2 . ]" 1
557 1 13 VAL MG1 1 57 ALA HA 1.800 . 6.500 4.786 3.167 5.292 . 0 0 "[ . 1 . 2 . ]" 1
558 1 12 LEU MD2 1 57 ALA HA 1.800 . 6.500 4.503 2.641 5.464 . 0 0 "[ . 1 . 2 . ]" 1
559 1 48 ILE MD 1 57 ALA HA 1.800 . 6.500 3.075 2.677 3.527 . 0 0 "[ . 1 . 2 . ]" 1
560 1 48 ILE MG 1 57 ALA HA 1.800 . 6.500 3.786 3.341 4.186 . 0 0 "[ . 1 . 2 . ]" 1
561 1 48 ILE HB 1 57 ALA HA 1.800 . 5.000 3.212 2.719 3.590 . 0 0 "[ . 1 . 2 . ]" 1
562 1 48 ILE QG 1 57 ALA MB 1.800 . 5.300 1.831 1.689 2.127 0.111 16 0 "[ . 1 . 2 . ]" 1
563 1 57 ALA MB 1 58 ILE H 1.800 . 4.300 3.169 2.930 3.350 . 0 0 "[ . 1 . 2 . ]" 1
564 1 49 ALA HA 1 57 ALA MB 1.800 . 6.500 4.235 3.791 4.747 . 0 0 "[ . 1 . 2 . ]" 1
565 1 57 ALA HA 1 58 ILE H 1.800 . 3.800 2.288 2.239 2.362 . 0 0 "[ . 1 . 2 . ]" 1
566 1 58 ILE H 1 58 ILE MD 1.800 . 4.300 2.212 2.010 2.508 . 0 0 "[ . 1 . 2 . ]" 1
567 1 58 ILE H 1 59 ILE HA 1.800 . 5.000 4.781 4.687 4.906 . 0 0 "[ . 1 . 2 . ]" 1
568 1 13 VAL QG 1 58 ILE H 1.800 . 5.000 3.074 2.787 3.601 . 0 0 "[ . 1 . 2 . ]" 1
569 1 13 VAL HA 1 58 ILE H 1.800 . 5.000 1.992 1.825 2.225 . 0 0 "[ . 1 . 2 . ]" 1
570 1 13 VAL HB 1 58 ILE H 1.800 . 5.000 4.809 3.785 5.117 0.117 6 0 "[ . 1 . 2 . ]" 1
571 1 58 ILE HA 1 58 ILE MG 1.800 . 5.300 2.405 2.278 2.564 . 0 0 "[ . 1 . 2 . ]" 1
572 1 58 ILE HA 1 59 ILE MD 1.800 . 6.500 4.233 3.603 4.857 . 0 0 "[ . 1 . 2 . ]" 1
573 1 58 ILE HA 1 59 ILE H 1.800 . 3.800 2.278 2.163 2.326 . 0 0 "[ . 1 . 2 . ]" 1
574 1 58 ILE QG 1 84 PHE QD 1.800 . 6.000 3.781 2.721 4.383 . 0 0 "[ . 1 . 2 . ]" 1
575 1 58 ILE QG 1 58 ILE MG 1.800 . 5.300 2.027 1.916 2.102 . 0 0 "[ . 1 . 2 . ]" 1
576 1 58 ILE MD 1 58 ILE QG 1.800 . 6.300 1.879 1.874 1.898 . 0 0 "[ . 1 . 2 . ]" 1
577 1 57 ALA HA 1 58 ILE QG 1.800 . 6.000 4.464 4.015 4.787 . 0 0 "[ . 1 . 2 . ]" 1
578 1 58 ILE QG 1 59 ILE H 1.800 . 6.000 4.358 4.241 4.491 . 0 0 "[ . 1 . 2 . ]" 1
579 1 20 ILE MD 1 58 ILE QG 1.800 . 7.500 4.981 4.389 5.484 . 0 0 "[ . 1 . 2 . ]" 1
580 1 58 ILE MD 1 58 ILE MG 1.800 . 7.300 3.169 3.109 3.204 . 0 0 "[ . 1 . 2 . ]" 1
581 1 58 ILE HB 1 58 ILE MD 1.800 . 6.500 2.093 2.020 2.186 . 0 0 "[ . 1 . 2 . ]" 1
582 1 13 VAL HB 1 58 ILE MD 1.800 . 6.500 4.052 2.865 4.620 . 0 0 "[ . 1 . 2 . ]" 1
583 1 56 ILE HB 1 58 ILE MD 1.800 . 6.500 3.601 3.074 3.937 . 0 0 "[ . 1 . 2 . ]" 1
584 1 56 ILE MD 1 58 ILE MD 1.800 . 8.000 3.700 3.378 4.045 . 0 0 "[ . 1 . 2 . ]" 1
585 1 58 ILE MD 1 84 PHE QD 1.800 . 6.500 4.517 4.110 4.909 . 0 0 "[ . 1 . 2 . ]" 1
586 1 59 ILE H 1 59 ILE MD 1.800 . 6.500 2.793 2.211 3.270 . 0 0 "[ . 1 . 2 . ]" 1
587 1 59 ILE H 1 84 PHE HA 1.800 . 5.000 4.254 3.965 4.631 . 0 0 "[ . 1 . 2 . ]" 1
588 1 59 ILE H 1 84 PHE QD 1.800 . 5.000 3.485 2.769 3.911 . 0 0 "[ . 1 . 2 . ]" 1
589 1 58 ILE MD 1 59 ILE H 1.800 . 6.500 4.781 4.646 4.913 . 0 0 "[ . 1 . 2 . ]" 1
590 1 58 ILE HB 1 59 ILE H 1.800 . 5.000 4.500 4.344 4.557 . 0 0 "[ . 1 . 2 . ]" 1
591 1 59 ILE H 1 59 ILE QG 1.800 . 4.800 2.918 1.907 3.773 . 0 0 "[ . 1 . 2 . ]" 1
592 1 48 ILE MD 1 59 ILE H 1.800 . 6.500 3.755 3.228 4.327 . 0 0 "[ . 1 . 2 . ]" 1
593 1 59 ILE HA 1 59 ILE QG 1.800 . 6.000 2.406 2.086 3.266 . 0 0 "[ . 1 . 2 . ]" 1
594 1 59 ILE HA 1 59 ILE MG 1.800 . 6.300 2.473 2.165 2.754 . 0 0 "[ . 1 . 2 . ]" 1
595 1 59 ILE HA 1 59 ILE MD 1.800 . 6.500 3.244 1.845 3.872 . 0 0 "[ . 1 . 2 . ]" 1
596 1 59 ILE HA 1 60 ASP HA 1.800 . 5.000 4.707 4.553 4.799 . 0 0 "[ . 1 . 2 . ]" 1
597 1 59 ILE HA 1 84 PHE QE 1.800 . 5.000 4.598 3.552 4.969 . 0 0 "[ . 1 . 2 . ]" 1
598 1 59 ILE HA 1 84 PHE HZ 1.800 . 5.000 4.667 4.390 4.988 . 0 0 "[ . 1 . 2 . ]" 1
599 1 20 ILE MD 1 59 ILE HA 1.800 . 6.500 4.867 4.377 5.382 . 0 0 "[ . 1 . 2 . ]" 1
600 1 14 VAL HB 1 59 ILE HA 1.800 . 5.000 4.204 2.763 4.779 . 0 0 "[ . 1 . 2 . ]" 1
601 1 14 VAL H 1 59 ILE HA 1.800 . 5.000 3.205 2.796 3.430 . 0 0 "[ . 1 . 2 . ]" 1
602 1 40 SER HB2 1 59 ILE HA 1.800 . 5.000 5.098 4.847 5.219 0.219 20 0 "[ . 1 . 2 . ]" 1
603 1 40 SER HB3 1 59 ILE HA 1.800 . 5.000 5.071 5.013 5.169 0.169 11 0 "[ . 1 . 2 . ]" 1
604 1 58 ILE MG 1 59 ILE HB 1.800 . 6.500 4.980 4.747 5.161 . 0 0 "[ . 1 . 2 . ]" 1
605 1 59 ILE HB 1 72 ALA H 1.800 . 5.000 4.931 4.580 5.079 0.079 18 0 "[ . 1 . 2 . ]" 1
606 1 59 ILE HB 1 72 ALA HA 1.800 . 5.000 4.023 3.693 4.673 . 0 0 "[ . 1 . 2 . ]" 1
607 1 59 ILE HB 1 75 LEU QD 1.800 . 7.400 4.785 4.246 5.198 . 0 0 "[ . 1 . 2 . ]" 1
608 1 59 ILE HB 1 84 PHE HZ 1.800 . 5.000 1.952 1.757 2.358 0.043 17 0 "[ . 1 . 2 . ]" 1
609 1 59 ILE MD 1 69 TYR QD 1.800 . 6.500 3.558 2.561 4.501 . 0 0 "[ . 1 . 2 . ]" 1
610 1 59 ILE MD 1 69 TYR QE 1.800 . 6.500 2.289 1.780 3.050 0.020 22 0 "[ . 1 . 2 . ]" 1
611 1 59 ILE MD 1 72 ALA HA 1.800 . 6.500 2.863 2.178 4.476 . 0 0 "[ . 1 . 2 . ]" 1
612 1 59 ILE MD 1 84 PHE QD 1.800 . 6.500 4.461 4.231 4.819 . 0 0 "[ . 1 . 2 . ]" 1
613 1 59 ILE MD 1 84 PHE QE 1.800 . 6.500 2.849 2.204 3.649 . 0 0 "[ . 1 . 2 . ]" 1
614 1 60 ASP H 1 60 ASP QB 1.800 . 3.800 2.038 1.890 2.476 . 0 0 "[ . 1 . 2 . ]" 1
615 1 59 ILE HA 1 60 ASP H 1.800 . 3.800 2.534 2.407 2.676 . 0 0 "[ . 1 . 2 . ]" 1
616 1 60 ASP H 1 86 THR HB 1.800 . 6.000 5.195 4.426 6.060 0.060 12 0 "[ . 1 . 2 . ]" 1
617 1 59 ILE MD 1 60 ASP H 1.800 . 6.300 3.697 3.401 3.882 . 0 0 "[ . 1 . 2 . ]" 1
618 1 59 ILE HB 1 60 ASP H 1.800 . 5.000 4.396 4.241 4.461 . 0 0 "[ . 1 . 2 . ]" 1
619 1 58 ILE HA 1 60 ASP H 1.800 . 5.000 4.090 3.687 4.572 . 0 0 "[ . 1 . 2 . ]" 1
620 1 15 GLU QB 1 60 ASP H 1.800 . 6.000 3.332 2.743 3.841 . 0 0 "[ . 1 . 2 . ]" 1
621 1 15 GLU HA 1 60 ASP H 1.800 . 5.000 4.284 3.927 4.837 . 0 0 "[ . 1 . 2 . ]" 1
622 1 14 VAL QG 1 60 ASP H 1.800 . 6.500 3.617 3.225 4.213 . 0 0 "[ . 1 . 2 . ]" 1
623 1 60 ASP HA 1 84 PHE QE 1.800 . 5.000 3.641 3.196 4.700 . 0 0 "[ . 1 . 2 . ]" 1
624 1 60 ASP HA 1 62 ASN QB 1.800 . 6.000 4.971 4.293 5.437 . 0 0 "[ . 1 . 2 . ]" 1
625 1 60 ASP HA 1 85 ALA MB 1.800 . 6.500 4.059 3.429 4.495 . 0 0 "[ . 1 . 2 . ]" 1
626 1 59 ILE MG 1 60 ASP HA 1.800 . 6.500 4.454 4.161 4.951 . 0 0 "[ . 1 . 2 . ]" 1
627 1 60 ASP HA 1 85 ALA HA 1.800 . 5.000 5.048 4.913 5.182 0.182 10 0 "[ . 1 . 2 . ]" 1
628 1 60 ASP HA 1 84 PHE HZ 1.800 . 5.000 5.017 4.588 5.175 0.175 17 0 "[ . 1 . 2 . ]" 1
629 1 60 ASP QB 1 61 VAL HA 1.800 . 6.000 4.681 3.966 5.092 . 0 0 "[ . 1 . 2 . ]" 1
630 1 15 GLU QB 1 60 ASP QB 1.800 . 7.000 2.932 1.818 4.108 . 0 0 "[ . 1 . 2 . ]" 1
631 1 61 VAL H 1 86 THR HA 1.800 . 5.000 2.110 1.779 2.577 0.021 8 0 "[ . 1 . 2 . ]" 1
632 1 60 ASP QB 1 61 VAL H 1.800 . 4.800 2.735 1.826 3.607 . 0 0 "[ . 1 . 2 . ]" 1
633 1 61 VAL H 1 85 ALA MB 1.800 . 6.500 4.907 3.990 5.355 . 0 0 "[ . 1 . 2 . ]" 1
634 1 60 ASP HA 1 61 VAL H 1.800 . 5.000 2.512 2.090 2.844 . 0 0 "[ . 1 . 2 . ]" 1
635 1 61 VAL H 1 62 ASN QD 1.800 . 6.000 3.852 2.527 4.775 . 0 0 "[ . 1 . 2 . ]" 1
636 1 61 VAL HA 1 61 VAL HB 1.800 . 2.800 2.670 2.404 2.931 0.131 8 0 "[ . 1 . 2 . ]" 1
637 1 61 VAL HA 1 61 VAL MG1 1.800 . 4.300 3.109 2.679 3.219 . 0 0 "[ . 1 . 2 . ]" 1
638 1 61 VAL HA 1 61 VAL MG2 1.800 . 6.500 2.086 1.900 2.386 . 0 0 "[ . 1 . 2 . ]" 1
639 1 15 GLU QB 1 61 VAL HA 1.800 . 6.000 5.289 5.143 5.461 . 0 0 "[ . 1 . 2 . ]" 1
640 1 61 VAL HA 1 63 LEU QD 1.800 . 7.500 3.843 1.928 4.716 . 0 0 "[ . 1 . 2 . ]" 1
641 1 61 VAL HA 1 62 ASN QD 1.800 . 6.000 3.895 2.976 4.695 . 0 0 "[ . 1 . 2 . ]" 1
642 1 60 ASP HA 1 61 VAL HB 1.800 . 5.000 4.641 4.348 5.144 0.144 7 0 "[ . 1 . 2 . ]" 1
643 1 61 VAL HB 1 62 ASN QD 1.800 . 6.000 4.952 4.470 5.540 . 0 0 "[ . 1 . 2 . ]" 1
644 1 61 VAL HB 1 105 LYS QB 1.800 . 6.000 5.247 4.211 5.553 . 0 0 "[ . 1 . 2 . ]" 1
645 1 61 VAL QG 1 62 ASN H 1.800 . 5.300 3.356 2.602 3.544 . 0 0 "[ . 1 . 2 . ]" 1
646 1 62 ASN H 1 87 GLY QA 1.800 . 6.000 3.519 2.986 4.057 . 0 0 "[ . 1 . 2 . ]" 1
647 1 62 ASN HA 1 66 GLU QB 1.800 . 4.800 3.865 2.791 4.503 . 0 0 "[ . 1 . 2 . ]" 1
648 1 62 ASN HA 1 63 LEU QB 1.800 . 6.000 4.484 3.807 4.991 . 0 0 "[ . 1 . 2 . ]" 1
649 1 61 VAL H 1 62 ASN QB 1.800 . 6.000 4.583 3.662 5.399 . 0 0 "[ . 1 . 2 . ]" 1
650 1 63 LEU H 1 66 GLU H 1.800 . 3.800 3.126 2.555 3.514 . 0 0 "[ . 1 . 2 . ]" 1
651 1 62 ASN HA 1 63 LEU H 1.800 . 3.800 2.614 2.227 3.039 . 0 0 "[ . 1 . 2 . ]" 1
652 1 62 ASN QB 1 63 LEU H 1.800 . 4.800 3.814 2.919 4.067 . 0 0 "[ . 1 . 2 . ]" 1
653 1 63 LEU H 1 66 GLU HA 1.800 . 5.000 3.261 2.651 5.281 0.281 18 0 "[ . 1 . 2 . ]" 1
654 1 63 LEU H 1 63 LEU QB 1.800 . 4.800 2.648 2.199 3.171 . 0 0 "[ . 1 . 2 . ]" 1
655 1 63 LEU H 1 63 LEU QD 1.800 . 7.500 3.100 1.838 3.855 . 0 0 "[ . 1 . 2 . ]" 1
656 1 63 LEU H 1 65 GLY QA 1.800 . 6.000 5.309 4.024 5.523 . 0 0 "[ . 1 . 2 . ]" 1
657 1 63 LEU H 1 66 GLU QB 1.800 . 6.000 4.484 1.765 5.356 0.035 6 0 "[ . 1 . 2 . ]" 1
658 1 62 ASN QD 1 63 LEU H 1.800 . 6.000 4.250 2.593 5.334 . 0 0 "[ . 1 . 2 . ]" 1
659 1 63 LEU HA 1 63 LEU QD 1.800 . 7.500 2.450 1.662 3.431 0.138 6 0 "[ . 1 . 2 . ]" 1
660 1 63 LEU HA 1 64 ASP QB 1.800 . 6.000 4.326 4.115 4.611 . 0 0 "[ . 1 . 2 . ]" 1
661 1 62 ASN HA 1 63 LEU HA 1.800 . 5.000 4.489 4.434 4.617 . 0 0 "[ . 1 . 2 . ]" 1
662 1 63 LEU HA 1 64 ASP H 1.800 . 3.800 2.587 2.345 2.776 . 0 0 "[ . 1 . 2 . ]" 1
663 1 64 ASP H 1 64 ASP HA 1.800 . 2.800 2.373 2.355 2.392 . 0 0 "[ . 1 . 2 . ]" 1
664 1 64 ASP HA 1 65 GLY QA 1.800 . 6.000 4.134 4.098 4.257 . 0 0 "[ . 1 . 2 . ]" 1
665 1 63 LEU HA 1 64 ASP HA 1.800 . 5.000 4.705 4.597 4.834 . 0 0 "[ . 1 . 2 . ]" 1
666 1 63 LEU HG 1 64 ASP HA 1.800 . 5.000 4.933 4.480 5.107 0.107 12 0 "[ . 1 . 2 . ]" 1
667 1 63 LEU QD 1 64 ASP HA 1.800 . 7.500 4.787 4.222 5.100 . 0 0 "[ . 1 . 2 . ]" 1
668 1 64 ASP QB 1 67 PRO QB 1.800 . 7.000 4.683 4.232 5.082 . 0 0 "[ . 1 . 2 . ]" 1
669 1 64 ASP QB 1 65 GLY QA 1.800 . 7.000 4.038 3.878 4.597 . 0 0 "[ . 1 . 2 . ]" 1
670 1 65 GLY H 1 66 GLU H 1.800 . 3.800 2.065 1.781 2.975 0.019 12 0 "[ . 1 . 2 . ]" 1
671 1 63 LEU H 1 65 GLY H 1.800 . 5.000 4.348 3.443 4.932 . 0 0 "[ . 1 . 2 . ]" 1
672 1 63 LEU QD 1 65 GLY H 1.800 . 6.500 4.645 4.145 4.866 . 0 0 "[ . 1 . 2 . ]" 1
673 1 64 ASP QB 1 65 GLY H 1.800 . 6.000 3.659 3.557 3.866 . 0 0 "[ . 1 . 2 . ]" 1
674 1 66 GLU H 1 66 GLU QB 1.800 . 3.800 2.849 2.164 3.346 . 0 0 "[ . 1 . 2 . ]" 1
675 1 64 ASP H 1 66 GLU H 1.800 . 5.000 4.026 3.716 4.857 . 0 0 "[ . 1 . 2 . ]" 1
676 1 66 GLU H 1 66 GLU HA 1.800 . 2.800 2.414 2.347 2.951 0.151 4 0 "[ . 1 . 2 . ]" 1
677 1 63 LEU QD 1 66 GLU H 1.800 . 7.500 4.567 4.215 5.507 . 0 0 "[ . 1 . 2 . ]" 1
678 1 64 ASP QB 1 66 GLU H 1.800 . 5.000 4.097 3.521 4.444 . 0 0 "[ . 1 . 2 . ]" 1
679 1 66 GLU HA 1 67 PRO QB 1.800 . 6.000 4.949 4.554 5.450 . 0 0 "[ . 1 . 2 . ]" 1
680 1 66 GLU HA 1 67 PRO QD 1.800 . 3.800 2.316 1.799 3.500 0.001 6 0 "[ . 1 . 2 . ]" 1
681 1 66 GLU HA 1 66 GLU QG 1.800 . 6.000 2.555 1.925 3.375 . 0 0 "[ . 1 . 2 . ]" 1
682 1 65 GLY QA 1 66 GLU HA 1.800 . 5.000 4.533 3.979 4.596 . 0 0 "[ . 1 . 2 . ]" 1
683 1 67 PRO QB 1 69 TYR QE 1.800 . 6.000 3.412 1.841 4.590 . 0 0 "[ . 1 . 2 . ]" 1
684 1 66 GLU HA 1 68 SER H 1.800 . 5.000 4.363 3.685 5.121 0.121 21 0 "[ . 1 . 2 . ]" 1
685 1 67 PRO HA 1 68 SER H 1.800 . 3.800 2.810 2.417 3.587 . 0 0 "[ . 1 . 2 . ]" 1
686 1 67 PRO QD 1 68 SER H 1.800 . 4.800 3.938 3.130 4.405 . 0 0 "[ . 1 . 2 . ]" 1
687 1 67 PRO QB 1 68 SER H 1.800 . 4.800 3.605 1.846 4.027 . 0 0 "[ . 1 . 2 . ]" 1
688 1 68 SER H 1 69 TYR H 1.800 . 3.800 2.210 1.769 2.870 0.031 18 0 "[ . 1 . 2 . ]" 1
689 1 67 PRO QB 1 69 TYR H 1.800 . 6.000 4.257 2.475 5.322 . 0 0 "[ . 1 . 2 . ]" 1
690 1 69 TYR H 1 69 TYR HA 1.800 . 2.800 2.338 2.321 2.359 . 0 0 "[ . 1 . 2 . ]" 1
691 1 69 TYR H 1 69 TYR QB 1.800 . 3.800 3.288 3.191 3.378 . 0 0 "[ . 1 . 2 . ]" 1
692 1 69 TYR H 1 69 TYR QD 1.800 . 5.000 2.586 2.047 3.270 . 0 0 "[ . 1 . 2 . ]" 1
693 1 69 TYR H 1 69 TYR QE 1.800 . 5.000 4.159 3.804 4.508 . 0 0 "[ . 1 . 2 . ]" 1
694 1 67 PRO HA 1 69 TYR H 1.800 . 5.000 3.385 3.094 4.050 . 0 0 "[ . 1 . 2 . ]" 1
695 1 69 TYR H 1 70 PRO QD 1.800 . 6.000 4.215 3.985 4.314 . 0 0 "[ . 1 . 2 . ]" 1
696 1 69 TYR HA 1 70 PRO HA 1.800 . 5.000 4.348 4.324 4.376 . 0 0 "[ . 1 . 2 . ]" 1
697 1 69 TYR HA 1 70 PRO QB 1.800 . 6.000 4.614 4.544 4.676 . 0 0 "[ . 1 . 2 . ]" 1
698 1 69 TYR QD 1 71 VAL MG1 1.800 . 6.500 3.046 1.663 3.958 0.137 18 0 "[ . 1 . 2 . ]" 1
699 1 68 SER HA 1 69 TYR QD 1.800 . 5.000 3.680 3.435 3.878 . 0 0 "[ . 1 . 2 . ]" 1
700 1 69 TYR QE 1 71 VAL MG2 1.800 . 6.500 3.544 2.218 4.570 . 0 0 "[ . 1 . 2 . ]" 1
701 1 48 ILE MD 1 69 TYR QE 1.800 . 6.500 3.792 3.588 4.062 . 0 0 "[ . 1 . 2 . ]" 1
702 1 59 ILE HB 1 69 TYR QE 1.800 . 5.000 4.088 3.263 4.752 . 0 0 "[ . 1 . 2 . ]" 1
703 1 59 ILE QG 1 69 TYR QE 1.800 . 6.000 2.138 1.729 2.817 0.071 6 0 "[ . 1 . 2 . ]" 1
704 1 14 VAL QG 1 69 TYR QE 1.800 . 7.500 3.377 2.698 3.946 . 0 0 "[ . 1 . 2 . ]" 1
705 1 45 ALA MB 1 69 TYR QE 1.800 . 6.500 2.072 1.714 2.967 0.086 4 0 "[ . 1 . 2 . ]" 1
706 1 42 MET QG 1 69 TYR QE 1.800 . 4.800 3.553 2.219 4.068 . 0 0 "[ . 1 . 2 . ]" 1
707 1 70 PRO HA 1 73 ASP QB 1.800 . 6.000 2.585 2.170 3.143 . 0 0 "[ . 1 . 2 . ]" 1
708 1 71 VAL H 1 72 ALA H 1.800 . 5.000 2.599 2.319 2.928 . 0 0 "[ . 1 . 2 . ]" 1
709 1 69 TYR H 1 71 VAL H 1.800 . 5.000 5.158 5.049 5.243 0.243 15 0 "[ . 1 . 2 . ]" 1
710 1 71 VAL H 1 71 VAL MG2 1.800 . 4.300 2.290 1.758 3.722 0.042 26 0 "[ . 1 . 2 . ]" 1
711 1 71 VAL H 1 71 VAL MG1 1.800 . 6.500 2.747 1.733 3.741 0.067 18 0 "[ . 1 . 2 . ]" 1
712 1 71 VAL H 1 71 VAL HA 1.800 . 2.800 2.934 2.881 2.964 0.164 15 0 "[ . 1 . 2 . ]" 1
713 1 71 VAL H 1 71 VAL HB 1.800 . 3.800 3.056 1.960 3.660 . 0 0 "[ . 1 . 2 . ]" 1
714 1 70 PRO HA 1 71 VAL H 1.800 . 5.000 3.380 3.307 3.428 . 0 0 "[ . 1 . 2 . ]" 1
715 1 70 PRO QB 1 71 VAL H 1.800 . 6.000 3.669 3.550 3.778 . 0 0 "[ . 1 . 2 . ]" 1
716 1 70 PRO QD 1 71 VAL H 1.800 . 6.000 2.727 2.450 2.977 . 0 0 "[ . 1 . 2 . ]" 1
717 1 71 VAL HA 1 74 ILE MG 1.800 . 6.500 3.648 3.173 4.340 . 0 0 "[ . 1 . 2 . ]" 1
718 1 71 VAL HB 1 74 ILE MD 1.800 . 6.500 5.103 4.268 5.554 . 0 0 "[ . 1 . 2 . ]" 1
719 1 71 VAL HB 1 75 LEU QD 1.800 . 7.500 4.609 3.911 5.496 . 0 0 "[ . 1 . 2 . ]" 1
720 1 71 VAL MG2 1 72 ALA HA 1.800 . 6.500 4.120 3.006 5.429 . 0 0 "[ . 1 . 2 . ]" 1
721 1 71 VAL MG2 1 75 LEU QD 1.800 . 7.800 4.157 3.113 4.799 . 0 0 "[ . 1 . 2 . ]" 1
722 1 42 MET HA 1 71 VAL MG2 1.800 . 6.500 4.371 3.339 5.240 . 0 0 "[ . 1 . 2 . ]" 1
723 1 71 VAL MG2 1 72 ALA H 1.800 . 4.300 2.589 1.682 3.770 0.118 13 0 "[ . 1 . 2 . ]" 1
724 1 72 ALA H 1 72 ALA MB 1.800 . 4.300 1.958 1.871 2.122 . 0 0 "[ . 1 . 2 . ]" 1
725 1 69 TYR QE 1 72 ALA H 1.800 . 5.000 3.799 3.113 4.317 . 0 0 "[ . 1 . 2 . ]" 1
726 1 71 VAL HB 1 72 ALA H 1.800 . 5.000 3.039 1.860 4.105 . 0 0 "[ . 1 . 2 . ]" 1
727 1 59 ILE MD 1 72 ALA H 1.800 . 6.500 3.424 2.558 5.222 . 0 0 "[ . 1 . 2 . ]" 1
728 1 69 TYR QD 1 72 ALA H 1.800 . 5.000 2.435 1.780 3.111 0.020 18 0 "[ . 1 . 2 . ]" 1
729 1 68 SER QB 1 72 ALA H 1.800 . 6.000 4.400 3.823 5.371 . 0 0 "[ . 1 . 2 . ]" 1
730 1 72 ALA HA 1 75 LEU HB2 1.800 . 5.000 2.644 2.145 3.103 . 0 0 "[ . 1 . 2 . ]" 1
731 1 72 ALA HA 1 75 LEU QD 1.800 . 7.500 2.714 2.424 3.108 . 0 0 "[ . 1 . 2 . ]" 1
732 1 69 TYR QD 1 72 ALA MB 1.800 . 8.500 2.959 2.016 3.708 . 0 0 "[ . 1 . 2 . ]" 1
733 1 72 ALA MB 1 84 PHE QE 1.800 . 6.500 2.571 1.940 3.021 . 0 0 "[ . 1 . 2 . ]" 1
734 1 69 TYR QB 1 72 ALA MB 1.800 . 7.500 4.162 3.662 4.603 . 0 0 "[ . 1 . 2 . ]" 1
735 1 71 VAL H 1 72 ALA MB 1.800 . 6.500 4.008 3.843 4.242 . 0 0 "[ . 1 . 2 . ]" 1
736 1 71 VAL HA 1 72 ALA MB 1.800 . 6.500 4.940 4.908 4.967 . 0 0 "[ . 1 . 2 . ]" 1
737 1 68 SER HA 1 72 ALA MB 1.800 . 6.500 2.923 2.410 3.354 . 0 0 "[ . 1 . 2 . ]" 1
738 1 68 SER QB 1 72 ALA MB 1.800 . 6.500 2.267 1.796 3.419 0.004 19 0 "[ . 1 . 2 . ]" 1
739 1 72 ALA MB 1 75 LEU QD 1.800 . 9.000 3.706 3.474 3.992 . 0 0 "[ . 1 . 2 . ]" 1
740 1 72 ALA H 1 73 ASP H 1.800 . 3.800 2.784 2.440 3.010 . 0 0 "[ . 1 . 2 . ]" 1
741 1 71 VAL H 1 73 ASP H 1.800 . 5.000 3.887 3.615 4.142 . 0 0 "[ . 1 . 2 . ]" 1
742 1 73 ASP H 1 73 ASP QB 1.800 . 3.800 2.055 2.012 2.105 . 0 0 "[ . 1 . 2 . ]" 1
743 1 70 PRO QB 1 73 ASP H 1.800 . 6.000 5.423 4.842 5.564 . 0 0 "[ . 1 . 2 . ]" 1
744 1 72 ALA MB 1 73 ASP H 1.800 . 4.300 2.255 2.094 2.488 . 0 0 "[ . 1 . 2 . ]" 1
745 1 73 ASP H 1 76 ALA MB 1.800 . 6.500 4.581 4.048 5.106 . 0 0 "[ . 1 . 2 . ]" 1
746 1 71 VAL QG 1 73 ASP H 1.800 . 6.500 4.172 3.785 4.713 . 0 0 "[ . 1 . 2 . ]" 1
747 1 73 ASP HA 1 73 ASP HB2 1.800 . 2.800 2.963 2.949 2.967 0.167 8 0 "[ . 1 . 2 . ]" 1
748 1 73 ASP HB2 1 74 ILE HA 1.800 . 5.000 4.758 4.726 4.788 . 0 0 "[ . 1 . 2 . ]" 1
749 1 72 ALA H 1 74 ILE H 1.800 . 5.000 4.319 4.042 4.489 . 0 0 "[ . 1 . 2 . ]" 1
750 1 71 VAL HA 1 74 ILE H 1.800 . 5.000 3.730 2.881 4.281 . 0 0 "[ . 1 . 2 . ]" 1
751 1 74 ILE H 1 74 ILE HA 1.800 . 2.800 2.840 2.806 2.860 0.060 4 0 "[ . 1 . 2 . ]" 1
752 1 74 ILE H 1 74 ILE QG 1.800 . 6.000 2.501 2.023 3.441 . 0 0 "[ . 1 . 2 . ]" 1
753 1 74 ILE H 1 74 ILE MG 1.800 . 4.300 3.664 3.569 3.704 . 0 0 "[ . 1 . 2 . ]" 1
754 1 73 ASP HB3 1 74 ILE H 1.800 . 2.800 2.884 2.841 2.936 0.136 25 0 "[ . 1 . 2 . ]" 1
755 1 74 ILE H 1 75 LEU HB2 1.800 . 5.000 4.572 4.254 4.767 . 0 0 "[ . 1 . 2 . ]" 1
756 1 74 ILE H 1 74 ILE HB 1.800 . 3.800 2.226 2.083 2.356 . 0 0 "[ . 1 . 2 . ]" 1
757 1 72 ALA MB 1 74 ILE H 1.800 . 5.300 4.506 4.463 4.545 . 0 0 "[ . 1 . 2 . ]" 1
758 1 74 ILE H 1 74 ILE MD 1.800 . 5.300 3.262 1.715 3.681 0.085 25 0 "[ . 1 . 2 . ]" 1
759 1 73 ASP HA 1 74 ILE H 1.800 . 3.800 3.570 3.551 3.588 . 0 0 "[ . 1 . 2 . ]" 1
760 1 71 VAL QG 1 74 ILE H 1.800 . 7.500 4.512 4.197 4.737 . 0 0 "[ . 1 . 2 . ]" 1
761 1 74 ILE HA 1 74 ILE QG 1.800 . 4.800 2.134 1.951 2.398 . 0 0 "[ . 1 . 2 . ]" 1
762 1 74 ILE HB 1 74 ILE MD 1.800 . 5.300 2.314 2.090 3.122 . 0 0 "[ . 1 . 2 . ]" 1
763 1 74 ILE HB 1 75 LEU QD 1.800 . 6.300 4.510 4.026 4.679 . 0 0 "[ . 1 . 2 . ]" 1
764 1 73 ASP HB3 1 74 ILE HB 1.800 . 5.000 4.993 4.764 5.094 0.094 9 0 "[ . 1 . 2 . ]" 1
765 1 74 ILE HB 1 75 LEU HA 1.800 . 5.000 4.520 4.265 4.745 . 0 0 "[ . 1 . 2 . ]" 1
766 1 74 ILE HB 1 77 GLU QG 1.800 . 6.000 4.863 4.414 5.374 . 0 0 "[ . 1 . 2 . ]" 1
767 1 71 VAL HA 1 74 ILE HB 1.800 . 5.000 2.597 1.831 3.362 . 0 0 "[ . 1 . 2 . ]" 1
768 1 72 ALA H 1 75 LEU H 1.800 . 5.000 4.491 4.390 4.583 . 0 0 "[ . 1 . 2 . ]" 1
769 1 75 LEU H 1 76 ALA H 1.800 . 3.800 2.700 2.553 2.823 . 0 0 "[ . 1 . 2 . ]" 1
770 1 73 ASP H 1 75 LEU H 1.800 . 5.000 4.081 3.956 4.355 . 0 0 "[ . 1 . 2 . ]" 1
771 1 72 ALA HA 1 75 LEU H 1.800 . 5.000 3.490 3.251 3.845 . 0 0 "[ . 1 . 2 . ]" 1
772 1 75 LEU H 1 75 LEU HA 1.800 . 2.800 2.817 2.774 2.864 0.064 2 0 "[ . 1 . 2 . ]" 1
773 1 75 LEU H 1 75 LEU QB 1.800 . 4.300 2.016 1.895 2.118 . 0 0 "[ . 1 . 2 . ]" 1
774 1 75 LEU H 1 75 LEU QD 1.800 . 5.300 3.303 2.972 3.455 . 0 0 "[ . 1 . 2 . ]" 1
775 1 74 ILE H 1 75 LEU H 1.800 . 2.800 2.721 2.636 2.815 0.015 9 0 "[ . 1 . 2 . ]" 1
776 1 73 ASP HA 1 75 LEU H 1.800 . 5.000 4.488 4.320 4.818 . 0 0 "[ . 1 . 2 . ]" 1
777 1 75 LEU H 1 75 LEU HG 1.800 . 5.000 4.379 4.064 4.496 . 0 0 "[ . 1 . 2 . ]" 1
778 1 72 ALA MB 1 75 LEU H 1.800 . 5.300 4.501 4.340 4.593 . 0 0 "[ . 1 . 2 . ]" 1
779 1 75 LEU H 1 77 GLU H 1.800 . 6.000 4.354 3.929 5.048 . 0 0 "[ . 1 . 2 . ]" 1
780 1 71 VAL HA 1 75 LEU H 1.800 . 5.000 3.796 3.412 4.148 . 0 0 "[ . 1 . 2 . ]" 1
781 1 75 LEU HA 1 75 LEU QD 1.800 . 7.500 2.190 1.805 2.763 . 0 0 "[ . 1 . 2 . ]" 1
782 1 75 LEU HB3 1 75 LEU QD 1.800 . 7.500 2.177 1.943 2.359 . 0 0 "[ . 1 . 2 . ]" 1
783 1 72 ALA H 1 75 LEU HB3 1.800 . 5.000 5.104 5.023 5.243 0.243 9 0 "[ . 1 . 2 . ]" 1
784 1 75 LEU QD 1 75 LEU HG 1.800 . 7.500 1.899 1.884 1.914 . 0 0 "[ . 1 . 2 . ]" 1
785 1 75 LEU MD1 1 75 LEU MD2 1.800 . 8.000 1.983 1.850 2.074 . 0 0 "[ . 1 . 2 . ]" 1
786 1 71 VAL HA 1 75 LEU QD 1.800 . 7.500 4.496 3.640 5.061 . 0 0 "[ . 1 . 2 . ]" 1
787 1 76 ALA H 1 76 ALA HA 1.800 . 2.800 2.927 2.860 2.949 0.149 14 0 "[ . 1 . 2 . ]" 1
788 1 73 ASP H 1 76 ALA H 1.800 . 5.000 4.743 4.454 5.009 0.009 5 0 "[ . 1 . 2 . ]" 1
789 1 74 ILE H 1 76 ALA H 1.800 . 5.000 3.909 3.737 4.161 . 0 0 "[ . 1 . 2 . ]" 1
790 1 72 ALA HA 1 76 ALA H 1.800 . 5.000 4.510 3.952 4.830 . 0 0 "[ . 1 . 2 . ]" 1
791 1 75 LEU HA 1 76 ALA H 1.800 . 5.000 3.486 3.412 3.568 . 0 0 "[ . 1 . 2 . ]" 1
792 1 76 ALA H 1 76 ALA MB 1.800 . 4.300 2.068 1.933 2.194 . 0 0 "[ . 1 . 2 . ]" 1
793 1 76 ALA H 1 77 GLU QG 1.800 . 6.000 4.091 3.192 5.129 . 0 0 "[ . 1 . 2 . ]" 1
794 1 75 LEU QD 1 76 ALA H 1.800 . 7.500 4.178 3.986 4.342 . 0 0 "[ . 1 . 2 . ]" 1
795 1 72 ALA MB 1 76 ALA H 1.800 . 6.500 4.907 4.523 5.226 . 0 0 "[ . 1 . 2 . ]" 1
796 1 76 ALA H 1 79 ASN QD 1.800 . 4.800 4.585 3.027 5.315 0.515 25 1 "[ . 1 . 2 + ]" 1
797 1 76 ALA HA 1 79 ASN HB2 1.800 . 5.000 4.232 2.466 5.045 0.045 10 0 "[ . 1 . 2 . ]" 1
798 1 75 LEU QD 1 76 ALA HA 1.800 . 7.500 4.661 4.306 4.921 . 0 0 "[ . 1 . 2 . ]" 1
799 1 76 ALA HA 1 77 GLU HA 1.800 . 5.000 4.867 4.736 4.977 . 0 0 "[ . 1 . 2 . ]" 1
800 1 76 ALA HA 1 78 ARG QG 1.800 . 6.000 4.878 4.110 5.333 . 0 0 "[ . 1 . 2 . ]" 1
801 1 74 ILE H 1 76 ALA MB 1.800 . 6.500 4.591 4.398 4.972 . 0 0 "[ . 1 . 2 . ]" 1
802 1 73 ASP HA 1 76 ALA MB 1.800 . 6.500 2.546 2.218 3.061 . 0 0 "[ . 1 . 2 . ]" 1
803 1 76 ALA MB 1 79 ASN QD 1.800 . 7.500 3.311 2.429 4.102 . 0 0 "[ . 1 . 2 . ]" 1
804 1 73 ASP HB2 1 76 ALA MB 1.800 . 6.500 4.947 4.633 5.377 . 0 0 "[ . 1 . 2 . ]" 1
805 1 76 ALA MB 1 77 GLU QG 1.800 . 7.500 4.001 2.838 5.151 . 0 0 "[ . 1 . 2 . ]" 1
806 1 74 ILE HA 1 77 GLU H 1.800 . 3.800 3.151 2.701 3.657 . 0 0 "[ . 1 . 2 . ]" 1
807 1 73 ASP HA 1 77 GLU H 1.800 . 5.000 4.441 3.931 4.879 . 0 0 "[ . 1 . 2 . ]" 1
808 1 77 GLU H 1 77 GLU HA 1.800 . 2.800 2.836 2.738 2.908 0.108 12 0 "[ . 1 . 2 . ]" 1
809 1 77 GLU H 1 77 GLU QG 1.800 . 4.800 2.520 1.847 3.413 . 0 0 "[ . 1 . 2 . ]" 1
810 1 77 GLU H 1 77 GLU QB 1.800 . 3.800 2.215 1.905 2.610 . 0 0 "[ . 1 . 2 . ]" 1
811 1 76 ALA HA 1 77 GLU H 1.800 . 5.000 3.545 3.392 3.604 . 0 0 "[ . 1 . 2 . ]" 1
812 1 77 GLU H 1 91 LYS QE 1.800 . 6.000 4.118 2.821 5.114 . 0 0 "[ . 1 . 2 . ]" 1
813 1 78 ARG H 1 91 LYS QE 1.800 . 6.000 5.342 4.915 5.609 . 0 0 "[ . 1 . 2 . ]" 1
814 1 77 GLU H 1 78 ARG H 1.800 . 3.800 2.722 2.450 3.053 . 0 0 "[ . 1 . 2 . ]" 1
815 1 78 ARG H 1 79 ASN QD 1.800 . 7.000 4.144 2.963 5.702 . 0 0 "[ . 1 . 2 . ]" 1
816 1 78 ARG H 1 78 ARG HA 1.800 . 2.800 2.964 2.913 2.984 0.184 6 0 "[ . 1 . 2 . ]" 1
817 1 77 GLU QG 1 78 ARG H 1.800 . 4.800 2.985 1.784 4.345 0.016 18 0 "[ . 1 . 2 . ]" 1
818 1 78 ARG H 1 78 ARG HB2 1.800 . 3.800 3.721 3.532 3.862 0.062 22 0 "[ . 1 . 2 . ]" 1
819 1 75 LEU QD 1 78 ARG H 1.800 . 7.500 5.213 4.685 5.519 . 0 0 "[ . 1 . 2 . ]" 1
820 1 78 ARG H 1 78 ARG QG 1.800 . 6.000 2.004 1.778 2.424 0.022 1 0 "[ . 1 . 2 . ]" 1
821 1 79 ASN H 1 79 ASN HA 1.800 . 2.800 2.572 2.334 2.973 0.173 26 0 "[ . 1 . 2 . ]" 1
822 1 79 ASN H 1 79 ASN HB3 1.800 . 3.800 3.438 2.604 3.950 0.150 1 0 "[ . 1 . 2 . ]" 1
823 1 79 ASN H 1 79 ASN HB2 1.800 . 3.800 3.093 1.952 3.911 0.111 17 0 "[ . 1 . 2 . ]" 1
824 1 79 ASN H 1 79 ASN QD 1.800 . 6.000 3.252 2.189 4.328 . 0 0 "[ . 1 . 2 . ]" 1
825 1 78 ARG QG 1 79 ASN H 1.800 . 4.800 2.804 1.764 4.284 0.036 8 0 "[ . 1 . 2 . ]" 1
826 1 79 ASN H 1 80 VAL QG 1.800 . 7.500 4.714 3.468 5.697 . 0 0 "[ . 1 . 2 . ]" 1
827 1 79 ASN HA 1 82 PHE QD 1.800 . 5.000 4.402 3.820 4.986 . 0 0 "[ . 1 . 2 . ]" 1
828 1 79 ASN HA 1 82 PHE QE 1.800 . 5.000 3.552 2.410 4.747 . 0 0 "[ . 1 . 2 . ]" 1
829 1 76 ALA MB 1 82 PHE HZ 1.800 . 6.500 4.509 3.599 5.241 . 0 0 "[ . 1 . 2 . ]" 1
830 1 79 ASN HA 1 80 VAL HA 1.800 . 5.000 4.510 4.409 4.654 . 0 0 "[ . 1 . 2 . ]" 1
831 1 75 LEU HA 1 79 ASN HA 1.800 . 5.000 4.143 3.288 4.925 . 0 0 "[ . 1 . 2 . ]" 1
832 1 75 LEU HG 1 79 ASN HA 1.800 . 3.800 3.654 2.418 3.971 0.171 17 0 "[ . 1 . 2 . ]" 1
833 1 79 ASN HA 1 79 ASN QD 1.800 . 5.000 3.364 1.824 4.250 . 0 0 "[ . 1 . 2 . ]" 1
834 1 78 ARG QG 1 79 ASN HA 1.800 . 6.000 3.698 3.267 4.373 . 0 0 "[ . 1 . 2 . ]" 1
835 1 78 ARG H 1 79 ASN HA 1.800 . 5.000 4.267 3.995 4.732 . 0 0 "[ . 1 . 2 . ]" 1
836 1 76 ALA HA 1 79 ASN HA 1.800 . 5.000 3.681 2.626 4.723 . 0 0 "[ . 1 . 2 . ]" 1
837 1 79 ASN HA 1 80 VAL H 1.800 . 5.000 2.210 2.098 2.481 . 0 0 "[ . 1 . 2 . ]" 1
838 1 79 ASN HB2 1 80 VAL H 1.800 . 5.000 4.196 3.312 4.624 . 0 0 "[ . 1 . 2 . ]" 1
839 1 78 ARG QG 1 80 VAL H 1.800 . 6.000 4.239 3.093 5.400 . 0 0 "[ . 1 . 2 . ]" 1
840 1 80 VAL H 1 80 VAL HB 1.800 . 3.800 2.866 1.947 3.730 . 0 0 "[ . 1 . 2 . ]" 1
841 1 80 VAL H 1 80 VAL QG 1.800 . 5.300 2.264 1.742 2.777 0.058 4 0 "[ . 1 . 2 . ]" 1
842 1 80 VAL H 1 82 PHE QE 1.800 . 5.000 4.214 3.151 4.875 . 0 0 "[ . 1 . 2 . ]" 1
843 1 75 LEU QD 1 80 VAL H 1.800 . 7.500 3.826 2.972 4.342 . 0 0 "[ . 1 . 2 . ]" 1
844 1 75 LEU HA 1 80 VAL H 1.800 . 5.000 4.807 4.327 5.126 0.126 4 0 "[ . 1 . 2 . ]" 1
845 1 80 VAL HA 1 80 VAL QG 1.800 . 5.300 2.183 1.913 2.519 . 0 0 "[ . 1 . 2 . ]" 1
846 1 80 VAL QG 1 81 PRO HA 1.800 . 7.500 3.789 3.641 4.467 . 0 0 "[ . 1 . 2 . ]" 1
847 1 81 PRO HA 1 82 PHE H 1.800 . 3.800 2.204 2.159 2.246 . 0 0 "[ . 1 . 2 . ]" 1
848 1 82 PHE H 1 82 PHE QD 1.800 . 5.000 1.819 1.746 2.027 0.054 17 0 "[ . 1 . 2 . ]" 1
849 1 82 PHE H 1 82 PHE QE 1.800 . 5.000 4.029 3.885 4.096 . 0 0 "[ . 1 . 2 . ]" 1
850 1 56 ILE HA 1 82 PHE H 1.800 . 5.000 4.758 4.603 5.027 0.027 2 0 "[ . 1 . 2 . ]" 1
851 1 82 PHE H 1 83 ILE MD 1.800 . 6.500 4.554 3.879 4.913 . 0 0 "[ . 1 . 2 . ]" 1
852 1 82 PHE H 1 97 TYR QB 1.800 . 5.000 4.445 4.014 4.742 . 0 0 "[ . 1 . 2 . ]" 1
853 1 82 PHE H 1 97 TYR QD 1.800 . 3.800 3.150 1.923 4.078 0.278 21 0 "[ . 1 . 2 . ]" 1
854 1 82 PHE H 1 97 TYR QE 1.800 . 5.000 2.624 2.013 3.691 . 0 0 "[ . 1 . 2 . ]" 1
855 1 81 PRO QB 1 82 PHE H 1.800 . 3.800 3.500 3.417 3.570 . 0 0 "[ . 1 . 2 . ]" 1
856 1 56 ILE MD 1 82 PHE H 1.800 . 6.500 5.221 3.826 5.390 . 0 0 "[ . 1 . 2 . ]" 1
857 1 81 PRO QG 1 82 PHE H 1.800 . 6.000 4.731 4.702 4.783 . 0 0 "[ . 1 . 2 . ]" 1
858 1 82 PHE HA 1 83 ILE H 1.800 . 3.800 2.908 2.813 3.054 . 0 0 "[ . 1 . 2 . ]" 1
859 1 82 PHE HA 1 83 ILE MG 1.800 . 6.500 5.133 4.765 5.395 . 0 0 "[ . 1 . 2 . ]" 1
860 1 81 PRO QG 1 82 PHE HA 1.800 . 6.000 5.084 4.966 5.187 . 0 0 "[ . 1 . 2 . ]" 1
861 1 82 PHE HA 1 82 PHE QD 1.800 . 5.000 3.504 3.401 3.621 . 0 0 "[ . 1 . 2 . ]" 1
862 1 82 PHE HA 1 95 THR HG1 1.800 . 5.000 4.749 4.270 5.147 0.147 20 0 "[ . 1 . 2 . ]" 1
863 1 54 PHE QE 1 82 PHE HA 1.800 . 5.000 4.245 3.844 4.613 . 0 0 "[ . 1 . 2 . ]" 1
864 1 56 ILE MD 1 82 PHE HA 1.800 . 6.500 3.714 1.920 4.120 . 0 0 "[ . 1 . 2 . ]" 1
865 1 80 VAL QG 1 82 PHE HA 1.800 . 7.500 4.481 4.145 5.636 . 0 0 "[ . 1 . 2 . ]" 1
866 1 54 PHE QE 1 82 PHE HB3 1.800 . 5.000 3.352 2.544 4.153 . 0 0 "[ . 1 . 2 . ]" 1
867 1 82 PHE HB3 1 95 THR HG1 1.800 . 5.000 4.658 4.009 5.011 0.011 10 0 "[ . 1 . 2 . ]" 1
868 1 75 LEU QD 1 82 PHE HB3 1.800 . 6.300 4.184 3.733 4.593 . 0 0 "[ . 1 . 2 . ]" 1
869 1 82 PHE HA 1 82 PHE HB2 1.800 . 2.800 2.381 2.344 2.429 . 0 0 "[ . 1 . 2 . ]" 1
870 1 82 PHE HB2 1 97 TYR QE 1.800 . 5.000 5.394 4.697 5.812 0.812 20 8 "[ *. * *1 * . * -+ * . ]" 1
871 1 75 LEU QD 1 82 PHE HB2 1.800 . 7.500 3.894 3.154 4.433 . 0 0 "[ . 1 . 2 . ]" 1
872 1 82 PHE HB2 1 83 ILE MG 1.800 . 6.500 5.061 4.610 5.363 . 0 0 "[ . 1 . 2 . ]" 1
873 1 57 ALA MB 1 82 PHE HB2 1.800 . 5.300 3.225 2.884 3.595 . 0 0 "[ . 1 . 2 . ]" 1
874 1 56 ILE HA 1 82 PHE HB2 1.800 . 3.800 2.171 1.848 2.499 . 0 0 "[ . 1 . 2 . ]" 1
875 1 82 PHE QD 1 83 ILE HB 1.800 . 5.000 4.768 4.323 4.928 . 0 0 "[ . 1 . 2 . ]" 1
876 1 82 PHE QD 1 95 THR HG1 1.800 . 5.000 2.175 1.810 2.856 . 0 0 "[ . 1 . 2 . ]" 1
877 1 81 PRO HA 1 82 PHE QD 1.800 . 5.000 3.254 2.857 3.538 . 0 0 "[ . 1 . 2 . ]" 1
878 1 82 PHE QD 1 83 ILE MG 1.800 . 6.500 4.971 4.722 5.113 . 0 0 "[ . 1 . 2 . ]" 1
879 1 75 LEU QD 1 82 PHE QE 1.800 . 7.500 3.206 2.325 4.022 . 0 0 "[ . 1 . 2 . ]" 1
880 1 82 PHE QE 1 95 THR HB 1.800 . 5.000 2.242 1.761 3.709 0.039 8 0 "[ . 1 . 2 . ]" 1
881 1 82 PHE QE 1 95 THR HG1 1.800 . 5.000 3.242 2.019 3.864 . 0 0 "[ . 1 . 2 . ]" 1
882 1 80 VAL QG 1 82 PHE QE 1.800 . 7.500 4.612 3.784 4.989 . 0 0 "[ . 1 . 2 . ]" 1
883 1 75 LEU QD 1 82 PHE HZ 1.800 . 7.500 4.993 4.323 5.600 . 0 0 "[ . 1 . 2 . ]" 1
884 1 56 ILE HA 1 83 ILE H 1.800 . 5.000 2.834 2.521 3.080 . 0 0 "[ . 1 . 2 . ]" 1
885 1 56 ILE HB 1 83 ILE H 1.800 . 5.500 5.094 4.741 5.368 . 0 0 "[ . 1 . 2 . ]" 1
886 1 57 ALA MB 1 83 ILE H 1.800 . 6.500 4.001 3.735 4.268 . 0 0 "[ . 1 . 2 . ]" 1
887 1 82 PHE HB3 1 83 ILE H 1.800 . 3.800 3.362 3.289 3.447 . 0 0 "[ . 1 . 2 . ]" 1
888 1 56 ILE MD 1 83 ILE H 1.800 . 6.500 4.426 2.695 4.928 . 0 0 "[ . 1 . 2 . ]" 1
889 1 83 ILE H 1 83 ILE QG 1.800 . 4.800 3.892 3.485 4.126 . 0 0 "[ . 1 . 2 . ]" 1
890 1 82 PHE HB2 1 83 ILE H 1.800 . 5.000 1.957 1.852 2.161 . 0 0 "[ . 1 . 2 . ]" 1
891 1 82 PHE QD 1 83 ILE H 1.800 . 7.000 2.712 2.323 2.997 . 0 0 "[ . 1 . 2 . ]" 1
892 1 83 ILE H 1 83 ILE HB 1.800 . 3.800 2.837 2.662 2.992 . 0 0 "[ . 1 . 2 . ]" 1
893 1 57 ALA H 1 83 ILE H 1.800 . 5.000 2.377 2.198 2.623 . 0 0 "[ . 1 . 2 . ]" 1
894 1 82 PHE QD 1 83 ILE HA 1.800 . 5.000 3.720 3.322 3.987 . 0 0 "[ . 1 . 2 . ]" 1
895 1 83 ILE HA 1 83 ILE HB 1.800 . 2.800 2.908 2.806 2.971 0.171 15 0 "[ . 1 . 2 . ]" 1
896 1 83 ILE HA 1 83 ILE QG 1.800 . 3.800 2.343 1.912 2.900 . 0 0 "[ . 1 . 2 . ]" 1
897 1 58 ILE MD 1 83 ILE HA 1.800 . 6.500 4.846 4.443 5.329 . 0 0 "[ . 1 . 2 . ]" 1
898 1 82 PHE HB2 1 83 ILE HA 1.800 . 5.000 4.671 4.566 4.850 . 0 0 "[ . 1 . 2 . ]" 1
899 1 83 ILE HA 1 100 ILE MD 1.800 . 6.500 7.067 5.642 8.163 1.663 15 15 "[** *.* ** +** ** **-* ]" 1
900 1 56 ILE MD 1 83 ILE HB 1.800 . 4.300 2.583 1.801 3.185 . 0 0 "[ . 1 . 2 . ]" 1
901 1 83 ILE HB 1 97 TYR QE 1.800 . 5.000 3.933 2.700 4.688 . 0 0 "[ . 1 . 2 . ]" 1
902 1 83 ILE HA 1 83 ILE MG 1.800 . 6.500 2.805 2.532 3.014 . 0 0 "[ . 1 . 2 . ]" 1
903 1 56 ILE HA 1 83 ILE MG 1.800 . 6.500 4.762 4.156 5.142 . 0 0 "[ . 1 . 2 . ]" 1
904 1 83 ILE MG 1 101 PRO QB 1.800 . 7.500 3.581 2.949 4.156 . 0 0 "[ . 1 . 2 . ]" 1
905 1 83 ILE H 1 84 PHE H 1.800 . 5.000 4.264 4.169 4.349 . 0 0 "[ . 1 . 2 . ]" 1
906 1 83 ILE HA 1 84 PHE H 1.800 . 3.800 2.370 2.279 2.436 . 0 0 "[ . 1 . 2 . ]" 1
907 1 84 PHE H 1 84 PHE QB 1.800 . 3.800 2.650 2.568 2.723 . 0 0 "[ . 1 . 2 . ]" 1
908 1 83 ILE QG 1 84 PHE H 1.800 . 4.800 3.621 2.643 4.362 . 0 0 "[ . 1 . 2 . ]" 1
909 1 84 PHE H 1 85 ALA HA 1.800 . 5.000 4.850 4.716 4.940 . 0 0 "[ . 1 . 2 . ]" 1
910 1 84 PHE HA 1 84 PHE QE 1.800 . 5.000 4.430 4.137 4.591 . 0 0 "[ . 1 . 2 . ]" 1
911 1 84 PHE HA 1 84 PHE QD 1.800 . 5.000 2.753 1.787 3.070 0.013 4 0 "[ . 1 . 2 . ]" 1
912 1 83 ILE MG 1 84 PHE HA 1.800 . 6.000 3.150 3.074 3.270 . 0 0 "[ . 1 . 2 . ]" 1
913 1 56 ILE MG 1 84 PHE QB 1.800 . 7.500 5.080 4.758 5.345 . 0 0 "[ . 1 . 2 . ]" 1
914 1 84 PHE QB 1 85 ALA HA 1.800 . 4.800 4.068 3.987 4.193 . 0 0 "[ . 1 . 2 . ]" 1
915 1 83 ILE HB 1 84 PHE QB 1.800 . 6.000 5.389 5.267 5.464 . 0 0 "[ . 1 . 2 . ]" 1
916 1 83 ILE MG 1 84 PHE QB 1.800 . 7.500 3.940 3.855 3.988 . 0 0 "[ . 1 . 2 . ]" 1
917 1 84 PHE QB 1 85 ALA MB 1.800 . 6.500 4.403 4.290 4.513 . 0 0 "[ . 1 . 2 . ]" 1
918 1 59 ILE HB 1 84 PHE QD 1.800 . 5.000 4.657 4.265 4.898 . 0 0 "[ . 1 . 2 . ]" 1
919 1 75 LEU QD 1 84 PHE QD 1.800 . 7.500 3.113 2.402 4.051 . 0 0 "[ . 1 . 2 . ]" 1
920 1 73 ASP HA 1 84 PHE QE 1.800 . 5.500 5.051 3.744 5.414 . 0 0 "[ . 1 . 2 . ]" 1
921 1 59 ILE MG 1 84 PHE QE 1.800 . 6.500 3.685 3.137 4.143 . 0 0 "[ . 1 . 2 . ]" 1
922 1 84 PHE QE 1 86 THR MG 1.800 . 6.500 2.229 1.681 3.258 0.119 9 0 "[ . 1 . 2 . ]" 1
923 1 76 ALA MB 1 84 PHE QE 1.800 . 6.500 4.115 2.267 4.942 . 0 0 "[ . 1 . 2 . ]" 1
924 1 59 ILE QG 1 84 PHE HZ 1.800 . 6.000 3.912 2.160 4.586 . 0 0 "[ . 1 . 2 . ]" 1
925 1 59 ILE MG 1 84 PHE HZ 1.800 . 6.500 2.944 2.212 3.530 . 0 0 "[ . 1 . 2 . ]" 1
926 1 72 ALA MB 1 84 PHE HZ 1.800 . 5.300 1.905 1.719 2.394 0.081 17 0 "[ . 1 . 2 . ]" 1
927 1 72 ALA HA 1 84 PHE HZ 1.800 . 3.800 3.789 3.393 3.953 0.153 23 0 "[ . 1 . 2 . ]" 1
928 1 84 PHE HA 1 85 ALA H 1.800 . 3.800 2.410 2.286 2.500 . 0 0 "[ . 1 . 2 . ]" 1
929 1 60 ASP HA 1 85 ALA H 1.800 . 5.000 3.708 3.386 3.962 . 0 0 "[ . 1 . 2 . ]" 1
930 1 84 PHE QD 1 85 ALA H 1.800 . 7.000 2.210 1.618 2.892 0.182 20 0 "[ . 1 . 2 . ]" 1
931 1 84 PHE QB 1 85 ALA H 1.800 . 3.800 3.250 3.087 3.519 . 0 0 "[ . 1 . 2 . ]" 1
932 1 85 ALA H 1 85 ALA MB 1.800 . 4.300 2.675 2.567 2.816 . 0 0 "[ . 1 . 2 . ]" 1
933 1 58 ILE HA 1 85 ALA H 1.800 . 5.000 3.398 3.260 3.657 . 0 0 "[ . 1 . 2 . ]" 1
934 1 83 ILE MG 1 85 ALA HA 1.800 . 6.500 5.282 5.000 5.401 . 0 0 "[ . 1 . 2 . ]" 1
935 1 84 PHE H 1 85 ALA MB 1.800 . 6.500 4.200 3.881 4.441 . 0 0 "[ . 1 . 2 . ]" 1
936 1 83 ILE MG 1 85 ALA MB 1.800 . 8.300 3.700 3.512 3.945 . 0 0 "[ . 1 . 2 . ]" 1
937 1 85 ALA MB 1 103 LEU H 1.800 . 5.300 2.165 1.809 2.975 . 0 0 "[ . 1 . 2 . ]" 1
938 1 85 ALA MB 1 86 THR MG 1.800 . 8.000 3.926 3.658 4.504 . 0 0 "[ . 1 . 2 . ]" 1
939 1 58 ILE QG 1 85 ALA MB 1.800 . 5.300 3.351 2.958 3.746 . 0 0 "[ . 1 . 2 . ]" 1
940 1 85 ALA MB 1 102 LEU HA 1.800 . 5.300 3.395 2.890 4.309 . 0 0 "[ . 1 . 2 . ]" 1
941 1 85 ALA MB 1 104 THR MG 1.800 . 8.000 4.441 3.855 5.007 . 0 0 "[ . 1 . 2 . ]" 1
942 1 85 ALA MB 1 105 LYS QD 1.800 . 7.500 3.720 2.344 5.269 . 0 0 "[ . 1 . 2 . ]" 1
943 1 85 ALA MB 1 103 LEU MD1 1.800 . 8.000 3.221 1.534 5.480 0.266 22 0 "[ . 1 . 2 . ]" 1
944 1 86 THR H 1 104 THR HA 1.800 . 5.000 2.591 1.802 3.293 . 0 0 "[ . 1 . 2 . ]" 1
945 1 86 THR H 1 104 THR MG 1.800 . 6.500 4.789 4.186 5.459 . 0 0 "[ . 1 . 2 . ]" 1
946 1 60 ASP HA 1 86 THR H 1.800 . 5.000 4.494 4.172 4.716 . 0 0 "[ . 1 . 2 . ]" 1
947 1 85 ALA MB 1 86 THR H 1.800 . 4.300 3.107 2.663 3.395 . 0 0 "[ . 1 . 2 . ]" 1
948 1 86 THR H 1 86 THR MG 1.800 . 6.000 2.396 1.977 2.717 . 0 0 "[ . 1 . 2 . ]" 1
949 1 85 ALA HA 1 86 THR H 1.800 . 5.000 2.273 2.177 2.401 . 0 0 "[ . 1 . 2 . ]" 1
950 1 86 THR H 1 103 LEU HA 1.800 . 5.000 4.428 3.715 5.069 0.069 10 0 "[ . 1 . 2 . ]" 1
951 1 86 THR H 1 104 THR H 1.800 . 5.000 4.536 3.255 5.057 0.057 19 0 "[ . 1 . 2 . ]" 1
952 1 86 THR HA 1 86 THR MG 1.800 . 5.300 2.957 2.378 3.193 . 0 0 "[ . 1 . 2 . ]" 1
953 1 85 ALA HA 1 86 THR HA 1.800 . 5.000 4.547 4.447 4.683 . 0 0 "[ . 1 . 2 . ]" 1
954 1 86 THR HA 1 87 GLY QA 1.800 . 4.800 4.106 3.983 4.212 . 0 0 "[ . 1 . 2 . ]" 1
955 1 86 THR HA 1 104 THR HA 1.800 . 5.000 2.950 2.277 3.660 . 0 0 "[ . 1 . 2 . ]" 1
956 1 61 VAL HB 1 86 THR HA 1.800 . 5.000 4.945 4.218 5.139 0.139 3 0 "[ . 1 . 2 . ]" 1
957 1 61 VAL HA 1 86 THR HA 1.800 . 5.000 3.618 2.423 3.942 . 0 0 "[ . 1 . 2 . ]" 1
958 1 85 ALA MB 1 86 THR HA 1.800 . 6.500 3.962 3.751 4.145 . 0 0 "[ . 1 . 2 . ]" 1
959 1 62 ASN QB 1 86 THR HB 1.800 . 6.000 2.933 1.849 3.946 . 0 0 "[ . 1 . 2 . ]" 1
960 1 61 VAL HA 1 86 THR HB 1.800 . 4.300 4.184 3.630 4.491 0.191 6 0 "[ . 1 . 2 . ]" 1
961 1 59 ILE MG 1 86 THR HB 1.800 . 6.500 5.094 4.613 5.429 . 0 0 "[ . 1 . 2 . ]" 1
962 1 60 ASP HA 1 86 THR HB 1.800 . 5.000 2.519 1.778 3.580 0.022 6 0 "[ . 1 . 2 . ]" 1
963 1 87 GLY H 1 89 GLY H 1.800 . 5.000 4.117 3.426 4.955 . 0 0 "[ . 1 . 2 . ]" 1
964 1 86 THR HA 1 87 GLY H 1.800 . 4.800 2.803 2.184 3.374 . 0 0 "[ . 1 . 2 . ]" 1
965 1 86 THR HB 1 87 GLY H 1.800 . 5.000 2.989 1.922 3.746 . 0 0 "[ . 1 . 2 . ]" 1
966 1 63 LEU QD 1 87 GLY H 1.800 . 7.500 3.345 2.690 3.962 . 0 0 "[ . 1 . 2 . ]" 1
967 1 63 LEU QB 1 87 GLY H 1.800 . 6.000 4.666 3.669 5.158 . 0 0 "[ . 1 . 2 . ]" 1
968 1 62 ASN HA 1 87 GLY H 1.800 . 5.000 4.863 4.326 5.152 0.152 1 0 "[ . 1 . 2 . ]" 1
969 1 62 ASN QB 1 87 GLY H 1.800 . 6.000 2.875 1.830 4.452 . 0 0 "[ . 1 . 2 . ]" 1
970 1 87 GLY QA 1 88 TYR HA 1.800 . 4.800 4.044 3.992 4.170 . 0 0 "[ . 1 . 2 . ]" 1
971 1 88 TYR H 1 89 GLY H 1.800 . 3.800 2.512 1.854 3.082 . 0 0 "[ . 1 . 2 . ]" 1
972 1 88 TYR H 1 90 SER H 1.800 . 5.000 4.688 3.971 5.063 0.063 22 0 "[ . 1 . 2 . ]" 1
973 1 87 GLY QA 1 88 TYR H 1.800 . 3.800 2.710 2.266 2.937 . 0 0 "[ . 1 . 2 . ]" 1
974 1 88 TYR H 1 88 TYR QB 1.800 . 3.800 2.567 2.018 3.422 . 0 0 "[ . 1 . 2 . ]" 1
975 1 86 THR MG 1 88 TYR QD 1.800 . 6.500 3.354 1.776 4.746 0.024 20 0 "[ . 1 . 2 . ]" 1
976 1 89 GLY H 1 90 SER H 1.800 . 5.000 2.991 1.989 4.019 . 0 0 "[ . 1 . 2 . ]" 1
977 1 88 TYR QD 1 89 GLY H 1.800 . 5.000 2.667 1.767 4.220 0.033 4 0 "[ . 1 . 2 . ]" 1
978 1 88 TYR HA 1 89 GLY H 1.800 . 3.800 3.433 3.057 3.611 . 0 0 "[ . 1 . 2 . ]" 1
979 1 86 THR HB 1 89 GLY H 1.800 . 5.000 4.928 4.392 5.274 0.274 3 0 "[ . 1 . 2 . ]" 1
980 1 87 GLY QA 1 89 GLY H 1.800 . 6.000 3.915 3.550 4.716 . 0 0 "[ . 1 . 2 . ]" 1
981 1 88 TYR QB 1 89 GLY H 1.800 . 6.000 3.509 2.134 4.028 . 0 0 "[ . 1 . 2 . ]" 1
982 1 85 ALA MB 1 89 GLY H 1.800 . 6.500 5.237 4.389 5.440 . 0 0 "[ . 1 . 2 . ]" 1
983 1 88 TYR HA 1 89 GLY QA 1.800 . 6.000 4.266 4.093 4.392 . 0 0 "[ . 1 . 2 . ]" 1
984 1 88 TYR QD 1 90 SER H 1.800 . 5.000 2.624 1.718 3.345 0.082 10 0 "[ . 1 . 2 . ]" 1
985 1 85 ALA HA 1 90 SER H 1.800 . 5.000 4.284 3.196 5.187 0.187 10 0 "[ . 1 . 2 . ]" 1
986 1 89 GLY H 1 90 SER HA 1.800 . 5.000 4.913 4.333 5.187 0.187 17 0 "[ . 1 . 2 . ]" 1
987 1 89 GLY QA 1 90 SER HA 1.800 . 6.000 4.333 4.020 4.614 . 0 0 "[ . 1 . 2 . ]" 1
988 1 90 SER HA 1 91 LYS QG 1.800 . 6.000 3.958 3.035 5.533 . 0 0 "[ . 1 . 2 . ]" 1
989 1 88 TYR QE 1 90 SER HA 1.800 . 5.000 2.683 1.836 4.797 . 0 0 "[ . 1 . 2 . ]" 1
990 1 88 TYR QD 1 90 SER HA 1.800 . 5.000 3.640 2.893 4.493 . 0 0 "[ . 1 . 2 . ]" 1
991 1 90 SER HA 1 91 LYS QB 1.800 . 6.000 4.154 3.530 4.882 . 0 0 "[ . 1 . 2 . ]" 1
992 1 90 SER HA 1 93 LEU MD1 1.800 . 6.500 4.095 2.832 5.214 . 0 0 "[ . 1 . 2 . ]" 1
993 1 90 SER HA 1 93 LEU MD2 1.800 . 6.500 5.241 4.157 5.608 . 0 0 "[ . 1 . 2 . ]" 1
994 1 85 ALA HA 1 90 SER HA 1.800 . 5.000 4.896 4.554 5.145 0.145 11 0 "[ . 1 . 2 . ]" 1
995 1 90 SER QB 1 91 LYS QG 1.800 . 7.000 4.431 3.584 5.516 . 0 0 "[ . 1 . 2 . ]" 1
996 1 91 LYS H 1 92 GLY H 1.800 . 5.000 2.784 1.807 4.212 . 0 0 "[ . 1 . 2 . ]" 1
997 1 90 SER HA 1 91 LYS H 1.800 . 3.800 2.604 2.178 3.574 . 0 0 "[ . 1 . 2 . ]" 1
998 1 91 LYS H 1 91 LYS HA 1.800 . 2.800 2.804 2.353 2.977 0.177 25 0 "[ . 1 . 2 . ]" 1
999 1 90 SER QB 1 91 LYS H 1.800 . 6.000 2.979 1.814 4.072 . 0 0 "[ . 1 . 2 . ]" 1
1000 1 92 GLY H 1 93 LEU H 1.800 . 5.000 2.148 1.799 2.790 0.001 1 0 "[ . 1 . 2 . ]" 1
1001 1 91 LYS HA 1 92 GLY H 1.800 . 3.800 3.220 2.447 3.600 . 0 0 "[ . 1 . 2 . ]" 1
1002 1 91 LYS QB 1 92 GLY H 1.800 . 6.000 3.394 1.675 4.061 0.125 6 0 "[ . 1 . 2 . ]" 1
1003 1 90 SER HA 1 92 GLY H 1.800 . 5.000 4.326 3.190 5.085 0.085 20 0 "[ . 1 . 2 . ]" 1
1004 1 92 GLY QA 1 93 LEU H 1.800 . 3.800 2.792 2.566 2.920 . 0 0 "[ . 1 . 2 . ]" 1
1005 1 90 SER QB 1 93 LEU H 1.800 . 6.000 3.203 1.871 4.525 . 0 0 "[ . 1 . 2 . ]" 1
1006 1 90 SER HA 1 93 LEU H 1.800 . 5.000 4.349 3.308 5.029 0.029 2 0 "[ . 1 . 2 . ]" 1
1007 1 93 LEU H 1 93 LEU MD2 1.800 . 6.500 3.228 1.816 4.081 . 0 0 "[ . 1 . 2 . ]" 1
1008 1 93 LEU H 1 93 LEU QB 1.800 . 3.800 2.147 1.955 2.725 . 0 0 "[ . 1 . 2 . ]" 1
1009 1 91 LYS QE 1 93 LEU H 1.800 . 6.000 4.089 2.725 4.839 . 0 0 "[ . 1 . 2 . ]" 1
1010 1 93 LEU HA 1 94 ASP HA 1.800 . 5.000 4.473 4.438 4.542 . 0 0 "[ . 1 . 2 . ]" 1
1011 1 93 LEU HA 1 94 ASP HB3 1.800 . 5.000 4.500 4.137 4.908 . 0 0 "[ . 1 . 2 . ]" 1
1012 1 91 LYS QE 1 93 LEU HA 1.800 . 4.800 3.523 2.051 4.315 . 0 0 "[ . 1 . 2 . ]" 1
1013 1 92 GLY QA 1 93 LEU HA 1.800 . 6.000 4.288 4.139 4.382 . 0 0 "[ . 1 . 2 . ]" 1
1014 1 93 LEU QB 1 93 LEU MD2 1.800 . 6.300 2.186 1.922 2.561 . 0 0 "[ . 1 . 2 . ]" 1
1015 1 90 SER QB 1 93 LEU QB 1.800 . 7.000 3.131 1.727 4.730 0.073 8 0 "[ . 1 . 2 . ]" 1
1016 1 79 ASN QD 1 93 LEU QB 1.800 . 7.000 3.384 1.809 5.219 . 0 0 "[ . 1 . 2 . ]" 1
1017 1 92 GLY QA 1 93 LEU MD2 1.800 . 7.500 4.357 2.842 5.427 . 0 0 "[ . 1 . 2 . ]" 1
1018 1 93 LEU MD2 1 94 ASP HB3 1.800 . 6.500 5.005 4.601 5.315 . 0 0 "[ . 1 . 2 . ]" 1
1019 1 93 LEU MD2 1 99 ASN HB2 1.800 . 6.500 4.527 3.847 5.285 . 0 0 "[ . 1 . 2 . ]" 1
1020 1 79 ASN HB2 1 93 LEU MD2 1.800 . 6.500 4.715 2.837 5.520 . 0 0 "[ . 1 . 2 . ]" 1
1021 1 82 PHE QE 1 94 ASP H 1.800 . 5.000 4.199 3.903 4.676 . 0 0 "[ . 1 . 2 . ]" 1
1022 1 94 ASP H 1 99 ASN QD 1.800 . 6.000 4.339 3.800 5.262 . 0 0 "[ . 1 . 2 . ]" 1
1023 1 93 LEU H 1 94 ASP H 1.800 . 5.000 4.571 4.256 4.698 . 0 0 "[ . 1 . 2 . ]" 1
1024 1 94 ASP H 1 95 THR H 1.800 . 5.000 4.501 4.004 4.588 . 0 0 "[ . 1 . 2 . ]" 1
1025 1 93 LEU HA 1 94 ASP H 1.800 . 3.800 2.242 2.157 2.458 . 0 0 "[ . 1 . 2 . ]" 1
1026 1 94 ASP H 1 94 ASP HB2 1.800 . 3.800 3.645 3.593 3.718 . 0 0 "[ . 1 . 2 . ]" 1
1027 1 93 LEU QB 1 94 ASP H 1.800 . 4.800 3.377 2.402 4.032 . 0 0 "[ . 1 . 2 . ]" 1
1028 1 93 LEU MD2 1 94 ASP H 1.800 . 6.500 3.588 2.657 4.381 . 0 0 "[ . 1 . 2 . ]" 1
1029 1 93 LEU HA 1 94 ASP QB 1.800 . 6.000 4.331 4.030 4.659 . 0 0 "[ . 1 . 2 . ]" 1
1030 1 95 THR H 1 95 THR HB 1.800 . 3.800 3.415 2.899 3.778 . 0 0 "[ . 1 . 2 . ]" 1
1031 1 94 ASP HA 1 95 THR H 1.800 . 5.000 2.315 2.230 2.382 . 0 0 "[ . 1 . 2 . ]" 1
1032 1 94 ASP HB2 1 95 THR H 1.800 . 5.000 3.156 2.871 4.120 . 0 0 "[ . 1 . 2 . ]" 1
1033 1 96 ARG H 1 97 TYR H 1.800 . 3.800 2.601 2.197 2.941 . 0 0 "[ . 1 . 2 . ]" 1
1034 1 95 THR H 1 96 ARG H 1.800 . 5.000 4.384 4.201 4.521 . 0 0 "[ . 1 . 2 . ]" 1
1035 1 95 THR HB 1 96 ARG H 1.800 . 5.000 3.605 1.777 4.152 0.023 6 0 "[ . 1 . 2 . ]" 1
1036 1 95 THR HA 1 96 ARG H 1.800 . 3.800 2.592 2.347 3.001 . 0 0 "[ . 1 . 2 . ]" 1
1037 1 95 THR MG 1 96 ARG H 1.800 . 5.300 3.100 1.843 3.832 . 0 0 "[ . 1 . 2 . ]" 1
1038 1 96 ARG H 1 96 ARG HB3 1.800 . 3.800 3.516 3.442 3.631 . 0 0 "[ . 1 . 2 . ]" 1
1039 1 95 THR HB 1 97 TYR H 1.800 . 3.800 3.881 3.479 3.996 0.196 18 0 "[ . 1 . 2 . ]" 1
1040 1 82 PHE H 1 97 TYR H 1.800 . 5.000 4.560 4.116 5.010 0.010 20 0 "[ . 1 . 2 . ]" 1
1041 1 97 TYR H 1 98 SER H 1.800 . 2.800 2.611 2.296 2.831 0.031 3 0 "[ . 1 . 2 . ]" 1
1042 1 97 TYR H 1 97 TYR QD 1.800 . 3.800 2.058 1.802 2.891 . 0 0 "[ . 1 . 2 . ]" 1
1043 1 97 TYR H 1 97 TYR QB 1.800 . 3.800 2.184 2.112 2.265 . 0 0 "[ . 1 . 2 . ]" 1
1044 1 97 TYR H 1 98 SER HA 1.800 . 5.000 4.827 4.636 5.015 0.015 24 0 "[ . 1 . 2 . ]" 1
1045 1 96 ARG HD2 1 97 TYR H 1.800 . 6.000 5.536 4.280 6.066 0.066 10 0 "[ . 1 . 2 . ]" 1
1046 1 96 ARG HB3 1 97 TYR HA 1.800 . 5.000 4.669 4.331 4.998 . 0 0 "[ . 1 . 2 . ]" 1
1047 1 97 TYR HA 1 100 ILE MD 1.800 . 6.500 4.101 3.260 5.012 . 0 0 "[ . 1 . 2 . ]" 1
1048 1 96 ARG HB2 1 97 TYR HA 1.800 . 5.000 4.553 4.276 4.858 . 0 0 "[ . 1 . 2 . ]" 1
1049 1 97 TYR QB 1 98 SER H 1.800 . 5.000 2.712 1.993 3.500 . 0 0 "[ . 1 . 2 . ]" 1
1050 1 93 LEU MD2 1 97 TYR QB 1.800 . 6.500 4.025 3.034 4.397 . 0 0 "[ . 1 . 2 . ]" 1
1051 1 97 TYR QB 1 100 ILE MD 1.800 . 6.500 3.106 2.097 3.772 . 0 0 "[ . 1 . 2 . ]" 1
1052 1 97 TYR HA 1 97 TYR QD 1.800 . 3.800 2.830 2.077 3.090 . 0 0 "[ . 1 . 2 . ]" 1
1053 1 97 TYR QD 1 118 GLN QG 1.800 . 6.000 4.292 3.090 5.132 . 0 0 "[ . 1 . 2 . ]" 1
1054 1 97 TYR QD 1 100 ILE MD 1.800 . 6.500 4.285 3.332 4.967 . 0 0 "[ . 1 . 2 . ]" 1
1055 1 96 ARG HB2 1 97 TYR QD 1.800 . 5.000 3.038 2.642 4.352 . 0 0 "[ . 1 . 2 . ]" 1
1056 1 56 ILE MG 1 97 TYR QE 1.800 . 6.500 4.141 3.070 4.644 . 0 0 "[ . 1 . 2 . ]" 1
1057 1 97 TYR HA 1 97 TYR QE 1.800 . 5.000 4.470 4.194 4.613 . 0 0 "[ . 1 . 2 . ]" 1
1058 1 96 ARG HB2 1 97 TYR QE 1.800 . 5.000 3.521 3.247 4.732 . 0 0 "[ . 1 . 2 . ]" 1
1059 1 81 PRO QB 1 97 TYR QE 1.800 . 6.000 2.750 2.281 3.748 . 0 0 "[ . 1 . 2 . ]" 1
1060 1 98 SER H 1 99 ASN HB2 1.800 . 5.000 5.042 4.706 5.275 0.275 23 0 "[ . 1 . 2 . ]" 1
1061 1 98 SER H 1 98 SER HB2 1.800 . 3.800 3.374 3.103 3.854 0.054 12 0 "[ . 1 . 2 . ]" 1
1062 1 97 TYR HA 1 98 SER H 1.800 . 5.000 3.459 3.227 3.597 . 0 0 "[ . 1 . 2 . ]" 1
1063 1 96 ARG HA 1 98 SER H 1.800 . 5.000 4.191 3.271 5.142 0.142 2 0 "[ . 1 . 2 . ]" 1
1064 1 98 SER HA 1 98 SER HB3 1.800 . 2.800 2.667 2.305 3.004 0.204 17 0 "[ . 1 . 2 . ]" 1
1065 1 98 SER HB2 1 100 ILE MD 1.800 . 6.500 2.328 1.701 3.476 0.099 23 0 "[ . 1 . 2 . ]" 1
1066 1 98 SER HB2 1 100 ILE MG 1.800 . 6.500 3.840 1.771 5.373 0.029 4 0 "[ . 1 . 2 . ]" 1
1067 1 98 SER HB2 1 100 ILE QG 1.800 . 6.000 3.275 1.846 5.182 . 0 0 "[ . 1 . 2 . ]" 1
1068 1 98 SER HB2 1 121 LYS QD 1.800 . 6.000 4.486 2.642 5.446 . 0 0 "[ . 1 . 2 . ]" 1
1069 1 97 TYR HA 1 98 SER HB2 1.800 . 5.000 4.126 3.655 4.688 . 0 0 "[ . 1 . 2 . ]" 1
1070 1 97 TYR QB 1 98 SER HB2 1.800 . 5.000 4.055 3.283 4.648 . 0 0 "[ . 1 . 2 . ]" 1
1071 1 98 SER HB2 1 99 ASN HB2 1.800 . 6.000 5.458 4.558 6.000 . 0 0 "[ . 1 . 2 . ]" 1
1072 1 99 ASN H 1 100 ILE H 1.800 . 3.800 3.148 2.513 3.759 . 0 0 "[ . 1 . 2 . ]" 1
1073 1 99 ASN H 1 99 ASN QD 1.800 . 6.000 2.010 1.818 2.362 . 0 0 "[ . 1 . 2 . ]" 1
1074 1 99 ASN H 1 99 ASN HA 1.800 . 2.800 2.366 2.350 2.404 . 0 0 "[ . 1 . 2 . ]" 1
1075 1 98 SER HA 1 99 ASN H 1.800 . 3.800 3.172 2.883 3.397 . 0 0 "[ . 1 . 2 . ]" 1
1076 1 94 ASP HA 1 99 ASN H 1.800 . 5.000 4.887 3.831 5.139 0.139 20 0 "[ . 1 . 2 . ]" 1
1077 1 100 ILE H 1 100 ILE HB 1.800 . 3.800 3.643 3.042 3.972 0.172 12 0 "[ . 1 . 2 . ]" 1
1078 1 100 ILE H 1 100 ILE MG 1.800 . 6.500 3.139 1.827 3.999 . 0 0 "[ . 1 . 2 . ]" 1
1079 1 100 ILE H 1 100 ILE MD 1.800 . 5.300 2.542 1.767 3.986 0.033 23 0 "[ . 1 . 2 . ]" 1
1080 1 99 ASN QD 1 100 ILE H 1.800 . 4.800 4.052 3.926 4.256 . 0 0 "[ . 1 . 2 . ]" 1
1081 1 99 ASN HA 1 100 ILE H 1.800 . 5.000 2.752 2.242 3.529 . 0 0 "[ . 1 . 2 . ]" 1
1082 1 100 ILE HA 1 100 ILE MG 1.800 . 6.500 2.192 1.880 2.668 . 0 0 "[ . 1 . 2 . ]" 1
1083 1 100 ILE QG 1 100 ILE MG 1.800 . 7.500 2.221 1.830 2.585 . 0 0 "[ . 1 . 2 . ]" 1
1084 1 100 ILE MD 1 100 ILE MG 1.800 . 8.000 2.336 1.448 3.215 0.352 19 0 "[ . 1 . 2 . ]" 1
1085 1 99 ASN QB 1 100 ILE MG 1.800 . 7.500 3.807 3.064 5.095 . 0 0 "[ . 1 . 2 . ]" 1
1086 1 98 SER HB3 1 100 ILE MG 1.800 . 5.800 3.274 1.705 4.702 0.095 24 0 "[ . 1 . 2 . ]" 1
1087 1 100 ILE MG 1 117 VAL HB 1.800 . 6.500 4.700 2.791 5.527 . 0 0 "[ . 1 . 2 . ]" 1
1088 1 101 PRO QB 1 114 ALA MB 1.800 . 7.500 3.000 2.189 3.660 . 0 0 "[ . 1 . 2 . ]" 1
1089 1 101 PRO QB 1 115 VAL MG2 1.800 . 7.500 5.161 4.381 5.527 . 0 0 "[ . 1 . 2 . ]" 1
1090 1 101 PRO QB 1 117 VAL QG 1.800 . 8.500 2.191 1.562 3.230 0.238 16 0 "[ . 1 . 2 . ]" 1
1091 1 102 LEU H 1 102 LEU QB 1.800 . 4.800 2.724 2.093 3.344 . 0 0 "[ . 1 . 2 . ]" 1
1092 1 101 PRO HA 1 102 LEU H 1.800 . 3.800 2.845 2.420 3.355 . 0 0 "[ . 1 . 2 . ]" 1
1093 1 101 PRO QB 1 102 LEU H 1.800 . 4.800 3.944 3.667 4.031 . 0 0 "[ . 1 . 2 . ]" 1
1094 1 101 PRO QD 1 102 LEU H 1.800 . 6.000 3.615 2.309 4.489 . 0 0 "[ . 1 . 2 . ]" 1
1095 1 102 LEU H 1 102 LEU QD 1.800 . 6.300 2.256 1.619 3.435 0.181 20 0 "[ . 1 . 2 . ]" 1
1096 1 100 ILE MD 1 102 LEU H 1.800 . 6.500 5.224 4.247 5.686 . 0 0 "[ . 1 . 2 . ]" 1
1097 1 102 LEU HA 1 102 LEU QD 1.800 . 7.500 2.601 1.786 3.433 0.014 15 0 "[ . 1 . 2 . ]" 1
1098 1 102 LEU HA 1 103 LEU MD1 1.800 . 6.500 4.531 2.386 5.555 . 0 0 "[ . 1 . 2 . ]" 1
1099 1 84 PHE QB 1 102 LEU HA 1.800 . 6.000 4.878 4.497 5.384 . 0 0 "[ . 1 . 2 . ]" 1
1100 1 102 LEU QB 1 102 LEU QD 1.800 . 8.500 1.926 1.688 2.052 0.112 12 0 "[ . 1 . 2 . ]" 1
1101 1 84 PHE QB 1 102 LEU QB 1.800 . 7.000 4.114 3.377 5.203 . 0 0 "[ . 1 . 2 . ]" 1
1102 1 102 LEU HA 1 103 LEU H 1.800 . 5.000 2.324 2.203 2.511 . 0 0 "[ . 1 . 2 . ]" 1
1103 1 85 ALA HA 1 103 LEU H 1.800 . 5.000 2.352 2.005 2.977 . 0 0 "[ . 1 . 2 . ]" 1
1104 1 102 LEU H 1 103 LEU H 1.800 . 5.000 4.531 4.308 4.692 . 0 0 "[ . 1 . 2 . ]" 1
1105 1 103 LEU H 1 103 LEU QB 1.800 . 3.800 3.178 2.707 3.474 . 0 0 "[ . 1 . 2 . ]" 1
1106 1 103 LEU H 1 103 LEU MD2 1.800 . 5.300 3.742 1.918 4.390 . 0 0 "[ . 1 . 2 . ]" 1
1107 1 102 LEU QD 1 103 LEU H 1.800 . 6.300 3.461 1.904 4.223 . 0 0 "[ . 1 . 2 . ]" 1
1108 1 103 LEU HA 1 103 LEU MD2 1.800 . 5.300 3.257 1.819 4.125 . 0 0 "[ . 1 . 2 . ]" 1
1109 1 103 LEU HA 1 104 THR H 1.800 . 5.000 2.886 2.409 3.407 . 0 0 "[ . 1 . 2 . ]" 1
1110 1 102 LEU QD 1 103 LEU HA 1.800 . 7.500 4.093 2.036 5.245 . 0 0 "[ . 1 . 2 . ]" 1
1111 1 103 LEU HA 1 104 THR HB 1.800 . 6.500 4.608 4.044 5.019 . 0 0 "[ . 1 . 2 . ]" 1
1112 1 103 LEU MD2 1 104 THR H 1.800 . 5.300 3.015 1.720 4.387 0.080 18 0 "[ . 1 . 2 . ]" 1
1113 1 103 LEU HB3 1 103 LEU MD2 1.800 . 4.300 2.393 1.915 3.182 . 0 0 "[ . 1 . 2 . ]" 1
1114 1 104 THR H 1 105 LYS H 1.800 . 5.000 3.101 2.292 4.507 . 0 0 "[ . 1 . 2 . ]" 1
1115 1 104 THR H 1 104 THR HA 1.800 . 2.800 2.960 2.826 2.988 0.188 19 0 "[ . 1 . 2 . ]" 1
1116 1 104 THR H 1 104 THR HB 1.800 . 3.800 2.943 2.174 3.429 . 0 0 "[ . 1 . 2 . ]" 1
1117 1 104 THR H 1 104 THR MG 1.800 . 5.300 2.100 1.717 3.694 0.083 10 0 "[ . 1 . 2 . ]" 1
1118 1 103 LEU MD1 1 104 THR H 1.800 . 5.300 2.783 1.786 3.761 0.014 17 0 "[ . 1 . 2 . ]" 1
1119 1 87 GLY QA 1 104 THR HA 1.800 . 6.000 4.463 3.742 5.242 . 0 0 "[ . 1 . 2 . ]" 1
1120 1 60 ASP HA 1 104 THR HA 1.800 . 5.000 5.041 4.335 5.200 0.200 18 0 "[ . 1 . 2 . ]" 1
1121 1 104 THR HA 1 105 LYS QD 1.800 . 5.000 4.213 2.671 4.699 . 0 0 "[ . 1 . 2 . ]" 1
1122 1 103 LEU MD1 1 104 THR HB 1.800 . 6.500 4.902 3.710 5.572 . 0 0 "[ . 1 . 2 . ]" 1
1123 1 63 LEU QD 1 104 THR HB 1.800 . 7.500 5.484 5.234 5.719 . 0 0 "[ . 1 . 2 . ]" 1
1124 1 105 LYS H 1 105 LYS QD 1.800 . 6.000 3.917 1.951 4.511 . 0 0 "[ . 1 . 2 . ]" 1
1125 1 105 LYS HA 1 105 LYS QG 1.800 . 4.800 2.280 1.871 3.382 . 0 0 "[ . 1 . 2 . ]" 1
1126 1 104 THR HA 1 105 LYS HA 1.800 . 5.000 4.836 4.419 5.070 0.070 23 0 "[ . 1 . 2 . ]" 1
1127 1 103 LEU MD1 1 105 LYS HA 1.800 . 6.500 3.924 2.436 5.545 . 0 0 "[ . 1 . 2 . ]" 1
1128 1 103 LEU MD2 1 105 LYS HA 1.800 . 6.500 4.597 2.946 5.400 . 0 0 "[ . 1 . 2 . ]" 1
1129 1 105 LYS HA 1 107 PHE QD 1.800 . 5.000 3.706 2.730 4.808 . 0 0 "[ . 1 . 2 . ]" 1
1130 1 105 LYS HA 1 107 PHE QE 1.800 . 5.000 3.946 3.075 4.969 . 0 0 "[ . 1 . 2 . ]" 1
1131 1 105 LYS HA 1 105 LYS QD 1.800 . 6.000 3.535 2.599 4.161 . 0 0 "[ . 1 . 2 . ]" 1
1132 1 105 LYS QB 1 105 LYS QD 1.800 . 7.000 2.093 1.872 2.474 . 0 0 "[ . 1 . 2 . ]" 1
1133 1 104 THR HG1 1 105 LYS QD 1.800 . 7.500 4.051 1.752 5.168 0.048 3 0 "[ . 1 . 2 . ]" 1
1134 1 86 THR HA 1 105 LYS QD 1.800 . 6.000 4.457 2.477 5.254 . 0 0 "[ . 1 . 2 . ]" 1
1135 1 61 VAL HB 1 105 LYS QD 1.800 . 6.000 4.576 3.311 5.235 . 0 0 "[ . 1 . 2 . ]" 1
1136 1 105 LYS QB 1 107 PHE H 1.800 . 6.000 4.281 3.592 4.722 . 0 0 "[ . 1 . 2 . ]" 1
1137 1 105 LYS QG 1 107 PHE H 1.800 . 6.000 4.058 2.686 4.701 . 0 0 "[ . 1 . 2 . ]" 1
1138 1 103 LEU MD2 1 107 PHE H 1.800 . 6.500 4.811 3.458 5.365 . 0 0 "[ . 1 . 2 . ]" 1
1139 1 104 THR MG 1 107 PHE H 1.800 . 6.500 4.917 4.211 5.435 . 0 0 "[ . 1 . 2 . ]" 1
1140 1 23 LEU MD2 1 107 PHE HZ 1.800 . 6.500 3.593 2.388 4.775 . 0 0 "[ . 1 . 2 . ]" 1
1141 1 23 LEU MD1 1 107 PHE HZ 1.800 . 6.500 3.444 1.767 4.904 0.033 19 0 "[ . 1 . 2 . ]" 1
1142 1 109 ASP H 1 110 SER H 1.800 . 5.000 2.093 1.717 2.689 0.083 4 0 "[ . 1 . 2 . ]" 1
1143 1 108 LEU HA 1 109 ASP H 1.800 . 5.000 3.073 2.222 3.600 . 0 0 "[ . 1 . 2 . ]" 1
1144 1 110 SER H 1 111 GLU H 1.800 . 5.000 3.387 2.348 4.021 . 0 0 "[ . 1 . 2 . ]" 1
1145 1 110 SER H 1 112 LEU QD 1.800 . 7.500 3.024 2.011 4.002 . 0 0 "[ . 1 . 2 . ]" 1
1146 1 109 ASP HA 1 110 SER H 1.800 . 5.000 3.265 3.197 3.475 . 0 0 "[ . 1 . 2 . ]" 1
1147 1 107 PHE H 1 110 SER H 1.800 . 5.000 3.953 2.953 5.044 0.044 14 0 "[ . 1 . 2 . ]" 1
1148 1 109 ASP HA 1 110 SER HA 1.800 . 5.000 4.777 4.639 5.026 0.026 10 0 "[ . 1 . 2 . ]" 1
1149 1 110 SER HA 1 113 GLU QB 1.800 . 4.800 3.421 2.477 4.083 . 0 0 "[ . 1 . 2 . ]" 1
1150 1 103 LEU HG 1 110 SER HA 1.800 . 5.000 4.226 2.422 5.037 0.037 26 0 "[ . 1 . 2 . ]" 1
1151 1 103 LEU MD1 1 110 SER HA 1.800 . 5.800 2.899 1.745 4.953 0.055 6 0 "[ . 1 . 2 . ]" 1
1152 1 103 LEU MD2 1 110 SER HA 1.800 . 6.500 3.054 1.659 5.465 0.141 24 0 "[ . 1 . 2 . ]" 1
1153 1 102 LEU QD 1 110 SER HA 1.800 . 7.500 6.400 4.682 7.956 0.456 19 0 "[ . 1 . 2 . ]" 1
1154 1 110 SER QB 1 114 ALA MB 1.800 . 7.500 5.038 4.455 5.483 . 0 0 "[ . 1 . 2 . ]" 1
1155 1 110 SER QB 1 112 LEU HG 1.800 . 6.000 4.354 3.613 5.234 . 0 0 "[ . 1 . 2 . ]" 1
1156 1 110 SER QB 1 112 LEU QD 1.800 . 7.300 3.907 3.320 4.654 . 0 0 "[ . 1 . 2 . ]" 1
1157 1 108 LEU QD 1 110 SER QB 1.800 . 7.300 4.564 3.854 4.945 . 0 0 "[ . 1 . 2 . ]" 1
1158 1 111 GLU H 1 112 LEU H 1.800 . 3.800 3.051 2.790 3.197 . 0 0 "[ . 1 . 2 . ]" 1
1159 1 110 SER HA 1 111 GLU H 1.800 . 3.800 3.446 3.194 3.579 . 0 0 "[ . 1 . 2 . ]" 1
1160 1 110 SER QB 1 111 GLU H 1.800 . 6.000 1.928 1.733 2.754 0.067 17 0 "[ . 1 . 2 . ]" 1
1161 1 111 GLU H 1 112 LEU QD 1.800 . 7.500 3.914 3.124 4.731 . 0 0 "[ . 1 . 2 . ]" 1
1162 1 105 LYS QG 1 111 GLU H 1.800 . 6.000 5.167 3.546 5.521 . 0 0 "[ . 1 . 2 . ]" 1
1163 1 111 GLU HA 1 114 ALA MB 1.800 . 5.300 2.295 1.753 3.249 0.047 9 0 "[ . 1 . 2 . ]" 1
1164 1 110 SER QB 1 111 GLU HA 1.800 . 5.300 4.186 3.613 4.648 . 0 0 "[ . 1 . 2 . ]" 1
1165 1 110 SER HA 1 111 GLU QB 1.800 . 6.000 5.122 4.890 5.444 . 0 0 "[ . 1 . 2 . ]" 1
1166 1 111 GLU QB 1 112 LEU HG 1.800 . 4.800 3.762 2.854 4.369 . 0 0 "[ . 1 . 2 . ]" 1
1167 1 112 LEU H 1 113 GLU H 1.800 . 3.800 3.038 2.738 3.275 . 0 0 "[ . 1 . 2 . ]" 1
1168 1 110 SER QB 1 112 LEU H 1.800 . 4.800 3.942 3.308 4.420 . 0 0 "[ . 1 . 2 . ]" 1
1169 1 111 GLU QG 1 112 LEU H 1.800 . 4.800 3.744 1.820 4.405 . 0 0 "[ . 1 . 2 . ]" 1
1170 1 112 LEU H 1 114 ALA MB 1.800 . 6.500 4.317 3.833 5.248 . 0 0 "[ . 1 . 2 . ]" 1
1171 1 112 LEU H 1 112 LEU QD 1.800 . 7.500 2.250 1.809 2.834 . 0 0 "[ . 1 . 2 . ]" 1
1172 1 112 LEU HA 1 112 LEU QD 1.800 . 7.500 2.606 1.845 3.397 . 0 0 "[ . 1 . 2 . ]" 1
1173 1 112 LEU HA 1 114 ALA MB 1.800 . 6.500 4.500 4.194 5.163 . 0 0 "[ . 1 . 2 . ]" 1
1174 1 112 LEU HA 1 116 LEU QD 1.800 . 6.300 3.549 2.471 4.630 . 0 0 "[ . 1 . 2 . ]" 1
1175 1 112 LEU HA 1 116 LEU QB 1.800 . 6.000 3.932 3.117 5.175 . 0 0 "[ . 1 . 2 . ]" 1
1176 1 112 LEU QB 1 112 LEU QD 1.800 . 8.500 1.843 1.664 1.980 0.136 4 0 "[ . 1 . 2 . ]" 1
1177 1 112 LEU QB 1 116 LEU QD 1.800 . 8.500 2.716 1.722 3.834 0.078 7 0 "[ . 1 . 2 . ]" 1
1178 1 112 LEU QB 1 113 GLU H 1.800 . 6.000 2.288 1.834 3.428 . 0 0 "[ . 1 . 2 . ]" 1
1179 1 112 LEU QB 1 113 GLU QB 1.800 . 5.800 3.925 3.269 4.581 . 0 0 "[ . 1 . 2 . ]" 1
1180 1 112 LEU QB 1 113 GLU HA 1.800 . 6.000 3.886 3.649 4.372 . 0 0 "[ . 1 . 2 . ]" 1
1181 1 111 GLU H 1 112 LEU QB 1.800 . 6.000 5.239 4.835 5.494 . 0 0 "[ . 1 . 2 . ]" 1
1182 1 109 ASP QB 1 112 LEU QB 1.800 . 7.000 4.909 3.386 5.645 . 0 0 "[ . 1 . 2 . ]" 1
1183 1 112 LEU MD1 1 112 LEU MD2 1.800 . 8.000 1.978 1.869 2.071 . 0 0 "[ . 1 . 2 . ]" 1
1184 1 111 GLU QG 1 112 LEU QD 1.800 . 8.500 4.121 1.746 5.433 0.054 2 0 "[ . 1 . 2 . ]" 1
1185 1 112 LEU QD 1 116 LEU QB 1.800 . 8.500 4.230 2.848 5.289 . 0 0 "[ . 1 . 2 . ]" 1
1186 1 110 SER QB 1 113 GLU H 1.800 . 6.000 5.043 4.660 5.350 . 0 0 "[ . 1 . 2 . ]" 1
1187 1 113 GLU H 1 113 GLU QB 1.800 . 3.800 2.116 1.937 2.635 . 0 0 "[ . 1 . 2 . ]" 1
1188 1 112 LEU HG 1 113 GLU H 1.800 . 5.000 3.055 1.816 4.162 . 0 0 "[ . 1 . 2 . ]" 1
1189 1 113 GLU H 1 114 ALA MB 1.800 . 6.500 4.279 4.083 4.500 . 0 0 "[ . 1 . 2 . ]" 1
1190 1 113 GLU HA 1 113 GLU QG 1.800 . 6.000 2.246 1.897 3.298 . 0 0 "[ . 1 . 2 . ]" 1
1191 1 112 LEU QD 1 113 GLU HA 1.800 . 7.500 4.572 2.608 5.171 . 0 0 "[ . 1 . 2 . ]" 1
1192 1 101 PRO HA 1 113 GLU HA 1.800 . 5.000 4.863 3.876 5.229 0.229 24 0 "[ . 1 . 2 . ]" 1
1193 1 113 GLU HA 1 117 VAL MG2 1.800 . 6.500 4.241 1.795 5.505 0.005 2 0 "[ . 1 . 2 . ]" 1
1194 1 113 GLU HA 1 117 VAL MG1 1.800 . 6.500 3.603 2.132 5.008 . 0 0 "[ . 1 . 2 . ]" 1
1195 1 113 GLU HA 1 116 LEU QD 1.800 . 7.500 3.109 1.788 4.536 0.012 12 0 "[ . 1 . 2 . ]" 1
1196 1 113 GLU HA 1 116 LEU HA 1.800 . 5.000 4.927 4.566 5.090 0.090 15 0 "[ . 1 . 2 . ]" 1
1197 1 113 GLU HA 1 114 ALA HA 1.800 . 5.000 4.909 4.844 4.988 . 0 0 "[ . 1 . 2 . ]" 1
1198 1 113 GLU QB 1 113 GLU QG 1.800 . 7.000 2.079 2.036 2.108 . 0 0 "[ . 1 . 2 . ]" 1
1199 1 113 GLU QB 1 114 ALA HA 1.800 . 6.000 3.935 3.680 4.648 . 0 0 "[ . 1 . 2 . ]" 1
1200 1 101 PRO QB 1 113 GLU QB 1.800 . 7.000 3.170 1.717 4.954 0.083 15 0 "[ . 1 . 2 . ]" 1
1201 1 102 LEU HA 1 113 GLU QB 1.800 . 6.500 5.803 5.557 6.027 . 0 0 "[ . 1 . 2 . ]" 1
1202 1 112 LEU QD 1 113 GLU QG 1.800 . 8.500 4.440 2.010 5.601 . 0 0 "[ . 1 . 2 . ]" 1
1203 1 113 GLU H 1 114 ALA H 1.800 . 3.800 2.839 2.578 3.159 . 0 0 "[ . 1 . 2 . ]" 1
1204 1 113 GLU HA 1 114 ALA H 1.800 . 5.000 3.532 3.457 3.587 . 0 0 "[ . 1 . 2 . ]" 1
1205 1 113 GLU QB 1 114 ALA H 1.800 . 3.800 2.581 1.945 3.479 . 0 0 "[ . 1 . 2 . ]" 1
1206 1 113 GLU QG 1 114 ALA H 1.800 . 4.800 3.873 2.004 4.426 . 0 0 "[ . 1 . 2 . ]" 1
1207 1 114 ALA H 1 115 VAL MG2 1.800 . 6.500 4.060 3.480 4.642 . 0 0 "[ . 1 . 2 . ]" 1
1208 1 112 LEU HG 1 114 ALA H 1.800 . 5.000 4.918 4.046 5.259 0.259 24 0 "[ . 1 . 2 . ]" 1
1209 1 114 ALA HA 1 117 VAL MG1 1.800 . 6.500 3.490 2.155 5.567 . 0 0 "[ . 1 . 2 . ]" 1
1210 1 114 ALA HA 1 117 VAL HB 1.800 . 5.000 4.754 3.916 5.261 0.261 23 0 "[ . 1 . 2 . ]" 1
1211 1 101 PRO HA 1 114 ALA HA 1.800 . 5.000 3.778 2.319 4.860 . 0 0 "[ . 1 . 2 . ]" 1
1212 1 114 ALA HA 1 117 VAL MG2 1.800 . 6.500 4.029 2.221 5.423 . 0 0 "[ . 1 . 2 . ]" 1
1213 1 114 ALA MB 1 115 VAL MG1 1.800 . 6.800 4.326 2.539 4.657 . 0 0 "[ . 1 . 2 . ]" 1
1214 1 114 ALA MB 1 115 VAL HB 1.800 . 6.500 4.387 3.906 4.927 . 0 0 "[ . 1 . 2 . ]" 1
1215 1 112 LEU HA 1 115 VAL H 1.800 . 3.800 3.598 3.301 3.848 0.048 12 0 "[ . 1 . 2 . ]" 1
1216 1 115 VAL H 1 115 VAL HB 1.800 . 3.800 2.712 2.353 3.651 . 0 0 "[ . 1 . 2 . ]" 1
1217 1 115 VAL H 1 115 VAL QG 1.800 . 5.300 2.198 1.814 2.552 . 0 0 "[ . 1 . 2 . ]" 1
1218 1 113 GLU HA 1 115 VAL H 1.800 . 5.000 4.086 3.719 4.473 . 0 0 "[ . 1 . 2 . ]" 1
1219 1 114 ALA MB 1 115 VAL H 1.800 . 4.300 2.612 2.385 2.888 . 0 0 "[ . 1 . 2 . ]" 1
1220 1 113 GLU QG 1 115 VAL H 1.800 . 6.000 5.282 4.386 5.546 . 0 0 "[ . 1 . 2 . ]" 1
1221 1 115 VAL HA 1 115 VAL MG1 1.800 . 6.500 2.231 2.043 2.333 . 0 0 "[ . 1 . 2 . ]" 1
1222 1 115 VAL HA 1 115 VAL MG2 1.800 . 6.500 2.534 2.198 3.188 . 0 0 "[ . 1 . 2 . ]" 1
1223 1 114 ALA MB 1 115 VAL HA 1.800 . 6.500 3.956 3.887 4.011 . 0 0 "[ . 1 . 2 . ]" 1
1224 1 115 VAL HA 1 118 GLN QB 1.800 . 6.000 4.039 2.884 5.407 . 0 0 "[ . 1 . 2 . ]" 1
1225 1 31 LEU MD2 1 115 VAL MG1 1.800 . 8.000 3.130 1.871 4.425 . 0 0 "[ . 1 . 2 . ]" 1
1226 1 113 GLU HA 1 116 LEU H 1.800 . 3.800 3.132 2.828 3.477 . 0 0 "[ . 1 . 2 . ]" 1
1227 1 116 LEU H 1 116 LEU QD 1.800 . 6.300 3.150 1.997 3.707 . 0 0 "[ . 1 . 2 . ]" 1
1228 1 116 LEU HA 1 116 LEU QD 1.800 . 5.300 2.447 1.776 3.363 0.024 13 0 "[ . 1 . 2 . ]" 1
1229 1 115 VAL HB 1 116 LEU HA 1.800 . 5.000 4.302 3.992 4.740 . 0 0 "[ . 1 . 2 . ]" 1
1230 1 116 LEU HA 1 119 ILE MD 1.800 . 6.500 4.227 1.751 5.409 0.049 7 0 "[ . 1 . 2 . ]" 1
1231 1 116 LEU HA 1 119 ILE MG 1.800 . 6.500 3.450 1.821 4.987 . 0 0 "[ . 1 . 2 . ]" 1
1232 1 116 LEU H 1 117 VAL H 1.800 . 3.800 2.483 2.285 2.861 . 0 0 "[ . 1 . 2 . ]" 1
1233 1 113 GLU HA 1 117 VAL H 1.800 . 5.000 3.155 1.827 3.855 . 0 0 "[ . 1 . 2 . ]" 1
1234 1 114 ALA HA 1 117 VAL H 1.800 . 5.000 4.479 4.056 5.061 0.061 13 0 "[ . 1 . 2 . ]" 1
1235 1 117 VAL H 1 117 VAL MG2 1.800 . 4.300 2.835 1.758 3.720 0.042 22 0 "[ . 1 . 2 . ]" 1
1236 1 117 VAL H 1 117 VAL MG1 1.800 . 5.300 2.323 1.692 3.784 0.108 17 0 "[ . 1 . 2 . ]" 1
1237 1 117 VAL H 1 117 VAL QG 1.800 . 6.300 1.932 1.689 2.540 0.111 17 0 "[ . 1 . 2 . ]" 1
1238 1 116 LEU HG 1 117 VAL H 1.800 . 5.000 4.471 2.379 5.142 0.142 3 0 "[ . 1 . 2 . ]" 1
1239 1 117 VAL HA 1 117 VAL MG2 1.800 . 5.300 2.690 2.273 3.194 . 0 0 "[ . 1 . 2 . ]" 1
1240 1 117 VAL HA 1 117 VAL HB 1.800 . 2.800 2.546 2.333 3.007 0.207 4 0 "[ . 1 . 2 . ]" 1
1241 1 100 ILE HB 1 117 VAL HB 1.800 . 5.000 4.049 2.317 5.161 0.161 17 0 "[ . 1 . 2 . ]" 1
1242 1 101 PRO QD 1 117 VAL HB 1.800 . 6.000 3.604 2.254 5.273 . 0 0 "[ . 1 . 2 . ]" 1
1243 1 100 ILE QG 1 117 VAL HB 1.800 . 4.800 3.519 1.799 4.399 0.001 24 0 "[ . 1 . 2 . ]" 1
1244 1 117 VAL HA 1 117 VAL MG1 1.800 . 4.300 2.748 2.001 3.193 . 0 0 "[ . 1 . 2 . ]" 1
1245 1 116 LEU QD 1 117 VAL MG1 1.800 . 7.800 4.307 3.272 4.900 . 0 0 "[ . 1 . 2 . ]" 1
1246 1 117 VAL MG1 1 118 GLN HA 1.800 . 6.500 4.308 2.852 5.521 . 0 0 "[ . 1 . 2 . ]" 1
1247 1 117 VAL H 1 118 GLN H 1.800 . 3.800 2.698 2.301 3.111 . 0 0 "[ . 1 . 2 . ]" 1
1248 1 118 GLN H 1 118 GLN QB 1.800 . 3.800 2.352 1.943 3.175 . 0 0 "[ . 1 . 2 . ]" 1
1249 1 118 GLN H 1 120 SER H 1.800 . 5.000 4.344 3.295 5.127 0.127 15 0 "[ . 1 . 2 . ]" 1
1250 1 118 GLN H 1 118 GLN QE 1.800 . 4.800 3.912 3.185 4.319 . 0 0 "[ . 1 . 2 . ]" 1
1251 1 117 VAL QG 1 118 GLN H 1.800 . 6.300 2.323 1.654 3.552 0.146 17 0 "[ . 1 . 2 . ]" 1
1252 1 118 GLN QB 1 119 ILE HA 1.800 . 6.000 4.211 3.712 4.823 . 0 0 "[ . 1 . 2 . ]" 1
1253 1 117 VAL H 1 119 ILE H 1.800 . 5.000 4.649 4.253 5.226 0.226 17 0 "[ . 1 . 2 . ]" 1
1254 1 118 GLN H 1 119 ILE H 1.800 . 3.800 2.728 1.933 3.845 0.045 17 0 "[ . 1 . 2 . ]" 1
1255 1 118 GLN HA 1 119 ILE H 1.800 . 5.000 3.329 2.650 3.597 . 0 0 "[ . 1 . 2 . ]" 1
1256 1 118 GLN QB 1 119 ILE H 1.800 . 4.800 3.041 1.856 4.097 . 0 0 "[ . 1 . 2 . ]" 1
1257 1 119 ILE H 1 119 ILE QG 1.800 . 4.800 2.671 1.759 3.941 0.041 22 0 "[ . 1 . 2 . ]" 1
1258 1 119 ILE H 1 119 ILE MG 1.800 . 5.300 2.602 1.758 3.946 0.042 12 0 "[ . 1 . 2 . ]" 1
1259 1 119 ILE H 1 119 ILE MD 1.800 . 5.300 2.734 1.761 4.191 0.039 7 0 "[ . 1 . 2 . ]" 1
1260 1 119 ILE HA 1 119 ILE MD 1.800 . 6.500 3.235 1.806 4.113 . 0 0 "[ . 1 . 2 . ]" 1
1261 1 119 ILE HA 1 119 ILE MG 1.800 . 6.500 2.502 2.080 3.193 . 0 0 "[ . 1 . 2 . ]" 1
1262 1 119 ILE HA 1 119 ILE QG 1.800 . 3.800 3.149 2.407 3.489 . 0 0 "[ . 1 . 2 . ]" 1
1263 1 119 ILE HA 1 119 ILE HB 1.800 . 2.800 2.572 2.267 2.998 0.198 16 0 "[ . 1 . 2 . ]" 1
1264 1 119 ILE HB 1 119 ILE MD 1.800 . 4.300 2.539 1.909 3.207 . 0 0 "[ . 1 . 2 . ]" 1
1265 1 118 GLN HA 1 119 ILE HB 1.800 . 5.000 6.047 4.465 6.588 1.588 23 23 "[ **** ************-***+** ]" 1
1266 1 120 SER H 1 121 LYS H 1.800 . 5.000 3.514 2.146 4.604 . 0 0 "[ . 1 . 2 . ]" 1
1267 1 120 SER H 1 120 SER QB 1.800 . 3.800 2.682 1.947 3.471 . 0 0 "[ . 1 . 2 . ]" 1
1268 1 119 ILE QG 1 120 SER H 1.800 . 6.000 3.489 1.862 4.926 . 0 0 "[ . 1 . 2 . ]" 1
1269 1 119 ILE MG 1 120 SER H 1.800 . 5.300 3.714 1.791 4.403 0.009 12 0 "[ . 1 . 2 . ]" 1
1270 1 119 ILE MD 1 120 SER H 1.800 . 5.300 2.920 1.772 4.468 0.028 8 0 "[ . 1 . 2 . ]" 1
1271 1 120 SER H 1 121 LYS HB2 1.800 . 5.000 4.022 3.009 5.096 0.096 17 0 "[ . 1 . 2 . ]" 1
1272 1 118 GLN QB 1 120 SER H 1.800 . 6.000 4.444 2.305 5.139 . 0 0 "[ . 1 . 2 . ]" 1
1273 1 118 GLN QG 1 120 SER H 1.800 . 6.000 5.158 3.761 5.509 . 0 0 "[ . 1 . 2 . ]" 1
1274 1 119 ILE HA 1 120 SER H 1.800 . 5.000 3.348 2.941 3.575 . 0 0 "[ . 1 . 2 . ]" 1
1275 1 121 LYS H 1 121 LYS HB2 1.800 . 3.800 3.058 2.154 3.669 . 0 0 "[ . 1 . 2 . ]" 1
1276 1 121 LYS H 1 121 LYS QG 1.800 . 4.800 3.964 3.029 4.346 . 0 0 "[ . 1 . 2 . ]" 1
1277 1 120 SER HA 1 121 LYS H 1.800 . 5.300 3.003 2.224 3.589 . 0 0 "[ . 1 . 2 . ]" 1
1278 1 121 LYS H 1 123 VAL HA 1.800 . 5.000 4.867 3.697 5.170 0.170 24 0 "[ . 1 . 2 . ]" 1
1279 1 120 SER QB 1 121 LYS HA 1.800 . 4.800 4.052 3.775 4.298 . 0 0 "[ . 1 . 2 . ]" 1
1280 1 121 LYS HA 1 121 LYS QG 1.800 . 3.800 2.288 1.921 2.925 . 0 0 "[ . 1 . 2 . ]" 1
1281 1 121 LYS HA 1 122 GLU QG 1.800 . 4.800 3.969 3.242 4.418 . 0 0 "[ . 1 . 2 . ]" 1
1282 1 119 ILE MD 1 121 LYS HB2 1.800 . 6.500 5.049 3.294 5.475 . 0 0 "[ . 1 . 2 . ]" 1
1283 1 122 GLU H 1 123 VAL HA 1.800 . 5.000 4.734 3.858 5.192 0.192 2 0 "[ . 1 . 2 . ]" 1
1284 1 121 LYS QG 1 122 GLU H 1.800 . 6.000 3.797 1.875 4.483 . 0 0 "[ . 1 . 2 . ]" 1
1285 1 122 GLU H 1 123 VAL QG 1.800 . 7.500 3.894 2.464 5.081 . 0 0 "[ . 1 . 2 . ]" 1
1286 1 121 LYS HB3 1 122 GLU H 1.800 . 5.000 3.554 1.945 4.398 . 0 0 "[ . 1 . 2 . ]" 1
1287 1 122 GLU H 1 123 VAL H 1.800 . 2.800 2.460 1.786 2.863 0.063 9 0 "[ . 1 . 2 . ]" 1
1288 1 122 GLU HA 1 123 VAL H 1.800 . 3.800 3.138 2.810 3.578 . 0 0 "[ . 1 . 2 . ]" 1
1289 1 121 LYS QB 1 123 VAL H 1.800 . 6.000 4.100 2.271 5.077 . 0 0 "[ . 1 . 2 . ]" 1
1290 1 121 LYS QG 1 123 VAL H 1.800 . 6.000 4.982 3.856 5.592 . 0 0 "[ . 1 . 2 . ]" 1
1291 1 123 VAL HA 1 123 VAL MG1 1.800 . 6.500 2.516 1.980 3.188 . 0 0 "[ . 1 . 2 . ]" 1
1292 1 122 GLU HA 1 123 VAL HA 1.800 . 5.000 4.921 4.582 5.265 0.265 10 0 "[ . 1 . 2 . ]" 1
1293 1 123 VAL HA 1 123 VAL HB 1.800 . 2.800 2.624 2.272 3.005 0.205 5 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 62
_Distance_constraint_stats_list.Viol_count 458
_Distance_constraint_stats_list.Viol_total 1004.353
_Distance_constraint_stats_list.Viol_max 0.298
_Distance_constraint_stats_list.Viol_rms 0.0528
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0240
_Distance_constraint_stats_list.Viol_average_violations_only 0.0843
_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 9 LEU 2.788 0.210 11 0 "[ . 1 . 2 . ]"
1 10 ARG 1.959 0.222 13 0 "[ . 1 . 2 . ]"
1 11 VAL 1.312 0.138 24 0 "[ . 1 . 2 . ]"
1 12 LEU 0.061 0.060 18 0 "[ . 1 . 2 . ]"
1 13 VAL 1.375 0.182 10 0 "[ . 1 . 2 . ]"
1 14 VAL 3.302 0.212 20 0 "[ . 1 . 2 . ]"
1 15 GLU 4.165 0.298 18 0 "[ . 1 . 2 . ]"
1 21 ALA 1.497 0.173 19 0 "[ . 1 . 2 . ]"
1 24 ILE 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 25 GLU 1.770 0.173 19 0 "[ . 1 . 2 . ]"
1 27 THR 0.232 0.064 21 0 "[ . 1 . 2 . ]"
1 28 LEU 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 29 CYS 0.273 0.036 5 0 "[ . 1 . 2 . ]"
1 31 LEU 0.232 0.064 21 0 "[ . 1 . 2 . ]"
1 34 GLU 2.788 0.210 11 0 "[ . 1 . 2 . ]"
1 37 ALA 2.687 0.182 10 0 "[ . 1 . 2 . ]"
1 39 ALA 4.165 0.298 18 0 "[ . 1 . 2 . ]"
1 41 ARG 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 42 MET 0.077 0.037 9 0 "[ . 1 . 2 . ]"
1 44 GLU 0.362 0.074 2 0 "[ . 1 . 2 . ]"
1 45 ALA 0.165 0.064 12 0 "[ . 1 . 2 . ]"
1 46 LEU 0.181 0.063 13 0 "[ . 1 . 2 . ]"
1 48 ILE 0.362 0.074 2 0 "[ . 1 . 2 . ]"
1 49 ALA 0.165 0.064 12 0 "[ . 1 . 2 . ]"
1 50 ARG 0.104 0.063 13 0 "[ . 1 . 2 . ]"
1 56 ILE 1.960 0.222 13 0 "[ . 1 . 2 . ]"
1 57 ALA 8.159 0.295 23 0 "[ . 1 . 2 . ]"
1 58 ILE 0.198 0.062 16 0 "[ . 1 . 2 . ]"
1 60 ASP 3.164 0.212 20 0 "[ . 1 . 2 . ]"
1 68 SER 0.581 0.116 9 0 "[ . 1 . 2 . ]"
1 69 TYR 1.529 0.122 9 0 "[ . 1 . 2 . ]"
1 70 PRO 0.716 0.108 25 0 "[ . 1 . 2 . ]"
1 71 VAL 0.339 0.061 5 0 "[ . 1 . 2 . ]"
1 72 ALA 0.830 0.116 9 0 "[ . 1 . 2 . ]"
1 73 ASP 1.538 0.122 9 0 "[ . 1 . 2 . ]"
1 74 ILE 1.096 0.108 25 0 "[ . 1 . 2 . ]"
1 75 LEU 0.339 0.061 5 0 "[ . 1 . 2 . ]"
1 76 ALA 0.249 0.100 6 0 "[ . 1 . 2 . ]"
1 77 GLU 0.009 0.009 2 0 "[ . 1 . 2 . ]"
1 78 ARG 0.380 0.087 25 0 "[ . 1 . 2 . ]"
1 83 ILE 8.159 0.295 23 0 "[ . 1 . 2 . ]"
1 84 PHE 6.885 0.287 6 0 "[ . 1 . 2 . ]"
1 86 THR 0.907 0.107 18 0 "[ . 1 . 2 . ]"
1 103 LEU 7.792 0.287 6 0 "[ . 1 . 2 . ]"
1 111 GLU 0.884 0.136 4 0 "[ . 1 . 2 . ]"
1 112 LEU 0.289 0.080 21 0 "[ . 1 . 2 . ]"
1 113 GLU 0.030 0.030 24 0 "[ . 1 . 2 . ]"
1 115 VAL 0.884 0.136 4 0 "[ . 1 . 2 . ]"
1 116 LEU 0.289 0.080 21 0 "[ . 1 . 2 . ]"
1 117 VAL 0.030 0.030 24 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 12 LEU H 1 56 ILE O 1.500 . 2.500 1.974 1.554 2.497 . 0 0 "[ . 1 . 2 . ]" 2
2 1 12 LEU N 1 56 ILE O 2.500 2.500 3.500 2.853 2.498 3.293 0.002 6 0 "[ . 1 . 2 . ]" 2
3 1 13 VAL H 1 37 ALA O 1.500 . 2.500 2.496 2.081 2.682 0.182 10 0 "[ . 1 . 2 . ]" 2
4 1 13 VAL N 1 37 ALA O 2.500 2.500 3.500 3.195 2.638 3.417 . 0 0 "[ . 1 . 2 . ]" 2
5 1 14 VAL H 1 58 ILE O 1.500 . 2.500 1.759 1.516 2.140 . 0 0 "[ . 1 . 2 . ]" 2
6 1 14 VAL N 1 58 ILE O 2.500 2.500 3.500 2.689 2.438 3.089 0.062 16 0 "[ . 1 . 2 . ]" 2
7 1 15 GLU H 1 39 ALA O 1.500 . 2.500 2.659 2.574 2.798 0.298 18 0 "[ . 1 . 2 . ]" 2
8 1 15 GLU N 1 39 ALA O 2.500 2.500 3.500 3.320 3.110 3.524 0.024 18 0 "[ . 1 . 2 . ]" 2
9 1 9 LEU O 1 34 GLU H 1.500 . 2.500 2.527 2.049 2.710 0.210 11 0 "[ . 1 . 2 . ]" 2
10 1 9 LEU O 1 34 GLU N 2.500 2.500 3.500 3.424 2.982 3.641 0.141 13 0 "[ . 1 . 2 . ]" 2
11 1 11 VAL O 1 37 ALA H 1.500 . 2.500 2.486 2.070 2.638 0.138 24 0 "[ . 1 . 2 . ]" 2
12 1 11 VAL O 1 37 ALA N 2.500 2.500 3.500 3.361 2.927 3.542 0.042 17 0 "[ . 1 . 2 . ]" 2
13 1 10 ARG O 1 56 ILE H 1.500 . 2.500 2.517 2.059 2.722 0.222 13 0 "[ . 1 . 2 . ]" 2
14 1 10 ARG O 1 56 ILE N 2.500 2.500 3.500 3.301 2.892 3.544 0.044 26 0 "[ . 1 . 2 . ]" 2
15 1 57 ALA H 1 83 ILE O 1.500 . 2.500 2.736 2.677 2.795 0.295 23 0 "[ . 1 . 2 . ]" 2
16 1 57 ALA N 1 83 ILE O 2.500 2.500 3.500 3.578 3.530 3.622 0.122 20 0 "[ . 1 . 2 . ]" 2
17 1 12 LEU O 1 58 ILE H 1.500 . 2.500 2.008 1.540 2.459 . 0 0 "[ . 1 . 2 . ]" 2
18 1 12 LEU O 1 58 ILE N 2.500 2.500 3.500 2.888 2.440 3.292 0.060 18 0 "[ . 1 . 2 . ]" 2
19 1 14 VAL O 1 60 ASP H 1.500 . 2.500 2.622 2.510 2.712 0.212 20 0 "[ . 1 . 2 . ]" 2
20 1 14 VAL O 1 60 ASP N 2.500 2.500 3.500 3.165 2.950 3.394 . 0 0 "[ . 1 . 2 . ]" 2
21 1 86 THR H 1 103 LEU O 1.500 . 2.500 2.141 1.615 2.607 0.107 18 0 "[ . 1 . 2 . ]" 2
22 1 86 THR N 1 103 LEU O 2.500 2.500 3.500 2.668 2.400 3.263 0.100 8 0 "[ . 1 . 2 . ]" 2
23 1 84 PHE O 1 103 LEU H 1.500 . 2.500 2.681 2.579 2.787 0.287 6 0 "[ . 1 . 2 . ]" 2
24 1 84 PHE O 1 103 LEU N 2.500 2.500 3.500 3.578 3.432 3.680 0.180 25 0 "[ . 1 . 2 . ]" 2
25 1 21 ALA O 1 25 GLU H 1.500 . 2.500 2.536 2.299 2.673 0.173 19 0 "[ . 1 . 2 . ]" 2
26 1 21 ALA O 1 25 GLU N 2.500 2.500 3.500 3.435 3.198 3.538 0.038 14 0 "[ . 1 . 2 . ]" 2
27 1 24 ILE O 1 28 LEU H 1.500 . 2.500 1.882 1.525 2.285 . 0 0 "[ . 1 . 2 . ]" 2
28 1 24 ILE O 1 28 LEU N 2.500 2.500 3.500 2.837 2.501 3.262 . 0 0 "[ . 1 . 2 . ]" 2
29 1 25 GLU O 1 29 CYS H 1.500 . 2.500 2.413 2.011 2.536 0.036 5 0 "[ . 1 . 2 . ]" 2
30 1 25 GLU O 1 29 CYS N 2.500 2.500 3.500 3.136 2.841 3.391 . 0 0 "[ . 1 . 2 . ]" 2
31 1 27 THR O 1 31 LEU H 1.500 . 2.500 2.202 1.726 2.564 0.064 21 0 "[ . 1 . 2 . ]" 2
32 1 27 THR O 1 31 LEU N 2.500 2.500 3.500 3.137 2.552 3.533 0.033 18 0 "[ . 1 . 2 . ]" 2
33 1 41 ARG O 1 45 ALA H 1.500 . 2.500 1.834 1.620 2.134 . 0 0 "[ . 1 . 2 . ]" 2
34 1 41 ARG O 1 45 ALA N 2.500 2.500 3.500 2.728 2.502 3.010 . 0 0 "[ . 1 . 2 . ]" 2
35 1 42 MET O 1 46 LEU H 1.500 . 2.500 2.327 1.863 2.537 0.037 9 0 "[ . 1 . 2 . ]" 2
36 1 42 MET O 1 46 LEU N 2.500 2.500 3.500 3.216 2.811 3.455 . 0 0 "[ . 1 . 2 . ]" 2
37 1 44 GLU O 1 48 ILE H 1.500 . 2.500 2.389 1.892 2.574 0.074 2 0 "[ . 1 . 2 . ]" 2
38 1 44 GLU O 1 48 ILE N 2.500 2.500 3.500 3.130 2.816 3.370 . 0 0 "[ . 1 . 2 . ]" 2
39 1 45 ALA O 1 49 ALA H 1.500 . 2.500 2.378 2.097 2.564 0.064 12 0 "[ . 1 . 2 . ]" 2
40 1 45 ALA O 1 49 ALA N 2.500 2.500 3.500 3.202 2.943 3.483 . 0 0 "[ . 1 . 2 . ]" 2
41 1 46 LEU O 1 50 ARG H 1.500 . 2.500 2.152 1.510 2.527 0.027 4 0 "[ . 1 . 2 . ]" 2
42 1 46 LEU O 1 50 ARG N 2.500 2.500 3.500 2.957 2.437 3.449 0.063 13 0 "[ . 1 . 2 . ]" 2
43 1 68 SER O 1 72 ALA H 1.500 . 2.500 2.481 2.215 2.616 0.116 9 0 "[ . 1 . 2 . ]" 2
44 1 68 SER O 1 72 ALA N 2.500 2.500 3.500 3.205 2.926 3.473 . 0 0 "[ . 1 . 2 . ]" 2
45 1 69 TYR O 1 73 ASP H 1.500 . 2.500 2.529 2.279 2.622 0.122 9 0 "[ . 1 . 2 . ]" 2
46 1 69 TYR O 1 73 ASP N 2.500 2.500 3.500 3.474 3.221 3.600 0.100 9 0 "[ . 1 . 2 . ]" 2
47 1 70 PRO O 1 74 ILE H 1.500 . 2.500 2.381 1.636 2.608 0.108 25 0 "[ . 1 . 2 . ]" 2
48 1 70 PRO O 1 74 ILE N 2.500 2.500 3.500 3.229 2.583 3.454 . 0 0 "[ . 1 . 2 . ]" 2
49 1 71 VAL O 1 75 LEU H 1.500 . 2.500 1.737 1.468 2.443 0.032 8 0 "[ . 1 . 2 . ]" 2
50 1 71 VAL O 1 75 LEU N 2.500 2.500 3.500 2.670 2.439 3.317 0.061 5 0 "[ . 1 . 2 . ]" 2
51 1 72 ALA O 1 76 ALA H 1.500 . 2.500 2.233 1.793 2.600 0.100 6 0 "[ . 1 . 2 . ]" 2
52 1 72 ALA O 1 76 ALA N 2.500 2.500 3.500 2.897 2.504 3.386 . 0 0 "[ . 1 . 2 . ]" 2
53 1 73 ASP O 1 77 GLU H 1.500 . 2.500 2.100 1.585 2.426 . 0 0 "[ . 1 . 2 . ]" 2
54 1 73 ASP O 1 77 GLU N 2.500 2.500 3.500 2.937 2.491 3.313 0.009 2 0 "[ . 1 . 2 . ]" 2
55 1 74 ILE O 1 78 ARG H 1.500 . 2.500 2.350 1.651 2.587 0.087 25 0 "[ . 1 . 2 . ]" 2
56 1 74 ILE O 1 78 ARG N 2.500 2.500 3.500 3.214 2.577 3.440 . 0 0 "[ . 1 . 2 . ]" 2
57 1 111 GLU O 1 115 VAL H 1.500 . 2.500 2.490 1.773 2.636 0.136 4 0 "[ . 1 . 2 . ]" 2
58 1 111 GLU O 1 115 VAL N 2.500 2.500 3.500 3.294 2.612 3.499 . 0 0 "[ . 1 . 2 . ]" 2
59 1 112 LEU O 1 116 LEU H 1.500 . 2.500 1.745 1.500 2.162 . 0 0 "[ . 1 . 2 . ]" 2
60 1 112 LEU O 1 116 LEU N 2.500 2.500 3.500 2.624 2.420 3.004 0.080 21 0 "[ . 1 . 2 . ]" 2
61 1 113 GLU O 1 117 VAL H 1.500 . 2.500 2.029 1.595 2.497 . 0 0 "[ . 1 . 2 . ]" 2
62 1 113 GLU O 1 117 VAL N 2.500 2.500 3.500 2.875 2.470 3.351 0.030 24 0 "[ . 1 . 2 . ]" 2
stop_
save_
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