NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
627359 |
6ckv   |
30423 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6ckv
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 1771
_Distance_constraint_stats_list.Viol_count 3652
_Distance_constraint_stats_list.Viol_total 4257.407
_Distance_constraint_stats_list.Viol_max 0.746
_Distance_constraint_stats_list.Viol_rms 0.0257
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0060
_Distance_constraint_stats_list.Viol_average_violations_only 0.0583
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 PRO 1.228 0.191 9 0 "[ . 1 . 2]"
1 4 THR 1.090 0.202 14 0 "[ . 1 . 2]"
1 5 ASP 2.750 0.180 1 0 "[ . 1 . 2]"
1 6 LYS 3.907 0.180 1 0 "[ . 1 . 2]"
1 7 GLU 0.506 0.127 18 0 "[ . 1 . 2]"
1 8 LEU 2.362 0.196 20 0 "[ . 1 . 2]"
1 9 VAL 1.327 0.196 20 0 "[ . 1 . 2]"
1 10 ALA 2.518 0.197 5 0 "[ . 1 . 2]"
1 11 GLN 4.953 0.340 5 0 "[ . 1 . 2]"
1 12 ALA 2.002 0.115 8 0 "[ . 1 . 2]"
1 13 LYS 4.899 0.197 5 0 "[ . 1 . 2]"
1 14 ALA 1.537 0.220 9 0 "[ . 1 . 2]"
1 15 LEU 4.045 0.349 19 0 "[ . 1 . 2]"
1 16 GLY 0.091 0.026 7 0 "[ . 1 . 2]"
1 17 ARG 5.253 0.220 9 0 "[ . 1 . 2]"
1 18 GLU 1.575 0.184 15 0 "[ . 1 . 2]"
1 19 TYR 4.847 0.234 19 0 "[ . 1 . 2]"
1 20 VAL 2.839 0.160 9 0 "[ . 1 . 2]"
1 21 HIS 3.078 0.167 20 0 "[ . 1 . 2]"
1 22 ALA 2.033 0.196 20 0 "[ . 1 . 2]"
1 23 ARG 3.495 0.167 11 0 "[ . 1 . 2]"
1 24 LEU 4.826 0.167 20 0 "[ . 1 . 2]"
1 25 LEU 6.297 0.196 20 0 "[ . 1 . 2]"
1 26 ARG 1.678 0.191 7 0 "[ . 1 . 2]"
1 27 ALA 0.091 0.060 1 0 "[ . 1 . 2]"
1 28 GLY 0.017 0.007 17 0 "[ . 1 . 2]"
1 29 LEU 1.679 0.184 9 0 "[ . 1 . 2]"
1 30 SER 2.074 0.395 7 0 "[ . 1 . 2]"
1 31 TRP 9.983 0.437 20 0 "[ . 1 . 2]"
1 32 SER 0.665 0.147 20 0 "[ . 1 . 2]"
1 33 ALA 1.890 0.116 4 0 "[ . 1 . 2]"
1 34 PRO 1.397 0.437 20 0 "[ . 1 . 2]"
1 35 GLU 2.271 0.333 1 0 "[ . 1 . 2]"
1 36 ARG 2.419 0.358 20 0 "[ . 1 . 2]"
1 37 ALA 1.978 0.488 8 0 "[ . 1 . 2]"
1 38 ALA 1.342 0.488 8 0 "[ . 1 . 2]"
1 39 PRO 0.061 0.021 8 0 "[ . 1 . 2]"
1 40 VAL 2.365 0.284 10 0 "[ . 1 . 2]"
1 41 PRO 0.727 0.284 10 0 "[ . 1 . 2]"
1 42 GLY 0.952 0.063 20 0 "[ . 1 . 2]"
1 43 ARG 3.964 0.384 16 0 "[ . 1 . 2]"
1 44 LEU 5.499 0.340 5 0 "[ . 1 . 2]"
1 45 ALA 1.346 0.273 10 0 "[ . 1 . 2]"
1 46 GLU 1.919 0.090 13 0 "[ . 1 . 2]"
1 47 VAL 4.284 0.158 13 0 "[ . 1 . 2]"
1 48 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 ALA 0.135 0.053 10 0 "[ . 1 . 2]"
1 50 VAL 1.591 0.146 19 0 "[ . 1 . 2]"
1 51 LEU 2.154 0.349 19 0 "[ . 1 . 2]"
1 52 LEU 6.938 0.381 18 0 "[ . 1 . 2]"
1 53 ARG 5.148 0.746 18 1 "[ . 1 . + 2]"
1 54 LEU 2.351 0.146 19 0 "[ . 1 . 2]"
1 55 GLY 4.601 0.746 18 1 "[ . 1 . + 2]"
1 56 ASP 1.751 0.145 8 0 "[ . 1 . 2]"
1 57 GLU 2.401 0.119 18 0 "[ . 1 . 2]"
1 58 LEU 4.778 0.251 17 0 "[ . 1 . 2]"
1 59 GLU 2.488 0.412 17 0 "[ . 1 . 2]"
1 60 MET 4.890 0.412 17 0 "[ . 1 . 2]"
1 61 ILE 2.095 0.161 3 0 "[ . 1 . 2]"
1 62 ARG 1.421 0.072 8 0 "[ . 1 . 2]"
1 63 PRO 4.396 0.173 4 0 "[ . 1 . 2]"
1 64 SER 2.303 0.160 19 0 "[ . 1 . 2]"
1 65 VAL 2.443 0.370 19 0 "[ . 1 . 2]"
1 66 TYR 12.759 0.242 11 0 "[ . 1 . 2]"
1 67 ARG 1.141 0.219 19 0 "[ . 1 . 2]"
1 68 ASN 6.365 0.370 19 0 "[ . 1 . 2]"
1 69 VAL 4.168 0.144 8 0 "[ . 1 . 2]"
1 70 ALA 3.132 0.099 8 0 "[ . 1 . 2]"
1 71 ARG 3.053 0.159 19 0 "[ . 1 . 2]"
1 72 GLN 1.062 0.095 17 0 "[ . 1 . 2]"
1 73 LEU 1.408 0.115 14 0 "[ . 1 . 2]"
1 74 HIS 0.184 0.058 7 0 "[ . 1 . 2]"
1 75 ILE 6.807 0.303 18 0 "[ . 1 . 2]"
1 76 SER 3.941 0.249 18 0 "[ . 1 . 2]"
1 77 LEU 3.814 0.145 8 0 "[ . 1 . 2]"
1 78 GLN 1.130 0.095 5 0 "[ . 1 . 2]"
1 79 SER 0.583 0.126 5 0 "[ . 1 . 2]"
1 80 GLU 0.738 0.149 2 0 "[ . 1 . 2]"
1 81 ARG 0.395 0.149 2 0 "[ . 1 . 2]"
1 82 VAL 1.245 0.112 17 0 "[ . 1 . 2]"
1 83 VAL 4.780 0.303 18 0 "[ . 1 . 2]"
1 84 THR 2.691 0.104 18 0 "[ . 1 . 2]"
1 85 ASP 1.745 0.127 20 0 "[ . 1 . 2]"
1 86 ALA 0.535 0.115 14 0 "[ . 1 . 2]"
1 87 PHE 4.410 0.107 18 0 "[ . 1 . 2]"
1 88 LEU 6.529 0.177 20 0 "[ . 1 . 2]"
1 89 ALA 0.976 0.085 19 0 "[ . 1 . 2]"
1 90 VAL 1.790 0.096 14 0 "[ . 1 . 2]"
1 91 ALA 5.417 0.177 20 0 "[ . 1 . 2]"
1 92 GLY 0.013 0.012 18 0 "[ . 1 . 2]"
1 93 HIS 0.063 0.021 14 0 "[ . 1 . 2]"
1 94 ILE 3.581 0.130 17 0 "[ . 1 . 2]"
1 95 PHE 1.995 0.128 17 0 "[ . 1 . 2]"
1 96 SER 0.497 0.113 17 0 "[ . 1 . 2]"
1 97 ALA 0.933 0.065 13 0 "[ . 1 . 2]"
1 98 GLY 0.984 0.065 13 0 "[ . 1 . 2]"
1 99 ILE 0.814 0.143 17 0 "[ . 1 . 2]"
1 100 THR 1.858 0.273 17 0 "[ . 1 . 2]"
1 101 TRP 12.041 0.308 9 0 "[ . 1 . 2]"
1 102 GLY 1.396 0.160 18 0 "[ . 1 . 2]"
1 103 LYS 0.974 0.150 15 0 "[ . 1 . 2]"
1 104 VAL 5.210 0.223 19 0 "[ . 1 . 2]"
1 105 VAL 1.605 0.192 13 0 "[ . 1 . 2]"
1 106 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 LEU 1.359 0.382 1 0 "[ . 1 . 2]"
1 108 TYR 4.986 0.382 1 0 "[ . 1 . 2]"
1 109 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 VAL 4.694 0.206 19 0 "[ . 1 . 2]"
1 111 ALA 1.129 0.118 7 0 "[ . 1 . 2]"
1 112 ALA 3.818 0.167 11 0 "[ . 1 . 2]"
1 113 GLY 2.819 0.216 14 0 "[ . 1 . 2]"
1 114 LEU 3.015 0.216 14 0 "[ . 1 . 2]"
1 115 ALA 0.275 0.106 20 0 "[ . 1 . 2]"
1 116 VAL 2.008 0.180 20 0 "[ . 1 . 2]"
1 117 ASP 0.905 0.180 20 0 "[ . 1 . 2]"
1 118 ALA 0.688 0.064 18 0 "[ . 1 . 2]"
1 119 VAL 1.632 0.106 13 0 "[ . 1 . 2]"
1 120 ARG 0.422 0.106 13 0 "[ . 1 . 2]"
1 121 GLN 0.859 0.129 13 0 "[ . 1 . 2]"
1 122 ALA 0.039 0.008 17 0 "[ . 1 . 2]"
1 123 GLN 0.621 0.080 13 0 "[ . 1 . 2]"
1 124 PRO 0.003 0.002 8 0 "[ . 1 . 2]"
1 125 ALA 1.033 0.207 9 0 "[ . 1 . 2]"
1 126 MET 6.993 0.305 9 0 "[ . 1 . 2]"
1 127 VAL 3.749 0.293 20 0 "[ . 1 . 2]"
1 128 HIS 0.000 0.000 10 0 "[ . 1 . 2]"
1 129 ALA 3.088 0.124 20 0 "[ . 1 . 2]"
1 130 LEU 1.543 0.084 13 0 "[ . 1 . 2]"
1 131 VAL 0.080 0.032 6 0 "[ . 1 . 2]"
1 132 ASP 0.674 0.077 20 0 "[ . 1 . 2]"
1 133 ALA 1.061 0.107 18 0 "[ . 1 . 2]"
1 134 LEU 2.637 0.184 7 0 "[ . 1 . 2]"
1 135 GLY 1.072 0.079 3 0 "[ . 1 . 2]"
1 136 GLU 0.718 0.199 7 0 "[ . 1 . 2]"
1 137 PHE 2.336 0.133 19 0 "[ . 1 . 2]"
1 138 VAL 0.998 0.079 3 0 "[ . 1 . 2]"
1 139 ARG 3.510 0.200 17 0 "[ . 1 . 2]"
1 140 LYS 0.358 0.042 19 0 "[ . 1 . 2]"
1 141 THR 4.866 0.171 20 0 "[ . 1 . 2]"
1 142 LEU 1.099 0.143 17 0 "[ . 1 . 2]"
1 143 ALA 1.431 0.115 9 0 "[ . 1 . 2]"
1 144 THR 1.517 0.109 8 0 "[ . 1 . 2]"
1 145 TRP 5.005 0.273 17 0 "[ . 1 . 2]"
1 146 LEU 4.973 0.220 17 0 "[ . 1 . 2]"
1 147 ARG 0.611 0.096 13 0 "[ . 1 . 2]"
1 148 ARG 1.347 0.096 13 0 "[ . 1 . 2]"
1 149 ARG 8.338 0.281 10 0 "[ . 1 . 2]"
1 150 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 151 GLY 0.337 0.099 9 0 "[ . 1 . 2]"
1 152 TRP 4.978 0.160 12 0 "[ . 1 . 2]"
1 153 THR 1.040 0.158 13 0 "[ . 1 . 2]"
1 154 ASP 18.471 0.308 9 0 "[ . 1 . 2]"
1 155 VAL 2.873 0.155 13 0 "[ . 1 . 2]"
1 156 LEU 1.575 0.115 10 0 "[ . 1 . 2]"
1 157 LYS 0.046 0.019 11 0 "[ . 1 . 2]"
1 158 CYS 0.031 0.019 11 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 31 TRP HE1 1 33 ALA H . . 4.820 3.447 2.698 4.667 . 0 0 "[ . 1 . 2]" 1
2 1 99 ILE HB 1 145 TRP HE1 . . 4.240 3.193 2.594 3.561 . 0 0 "[ . 1 . 2]" 1
3 1 100 THR HA 1 145 TRP HE1 . . 4.370 4.276 3.444 4.469 0.099 4 0 "[ . 1 . 2]" 1
4 1 80 GLU H 1 81 ARG H . . 4.690 2.146 1.942 2.360 . 0 0 "[ . 1 . 2]" 1
5 1 32 SER QB 1 33 ALA H . . 3.580 3.325 2.147 3.690 0.110 4 0 "[ . 1 . 2]" 1
6 1 33 ALA H 1 33 ALA MB . . 3.030 2.682 2.027 2.926 . 0 0 "[ . 1 . 2]" 1
7 1 144 THR MG 1 145 TRP H . . 4.460 3.327 3.081 3.560 . 0 0 "[ . 1 . 2]" 1
8 1 145 TRP H 1 146 LEU H . . 3.550 2.954 2.841 3.061 . 0 0 "[ . 1 . 2]" 1
9 1 144 THR HB 1 145 TRP H . . 3.970 2.455 2.249 2.667 . 0 0 "[ . 1 . 2]" 1
10 1 154 ASP H 1 154 ASP HB3 . . 3.390 2.831 2.546 3.093 . 0 0 "[ . 1 . 2]" 1
11 1 153 THR H 1 154 ASP H . . 3.230 2.776 2.717 2.812 . 0 0 "[ . 1 . 2]" 1
12 1 154 ASP H 1 155 VAL H . . 3.460 2.786 2.598 2.895 . 0 0 "[ . 1 . 2]" 1
13 1 154 ASP H 1 154 ASP HB2 . . 3.390 2.290 2.112 2.518 . 0 0 "[ . 1 . 2]" 1
14 1 157 LYS H 1 158 CYS H . . 3.090 2.371 2.030 2.736 . 0 0 "[ . 1 . 2]" 1
15 1 158 CYS H 1 158 CYS HB3 . . 3.440 3.069 2.524 3.443 0.003 18 0 "[ . 1 . 2]" 1
16 1 157 LYS HB3 1 158 CYS H . . 4.360 3.986 3.847 4.379 0.019 11 0 "[ . 1 . 2]" 1
17 1 77 LEU H 1 77 LEU HG . . 3.140 2.076 1.945 2.378 . 0 0 "[ . 1 . 2]" 1
18 1 77 LEU H 1 77 LEU MD1 . . 3.810 3.687 3.602 3.809 . 0 0 "[ . 1 . 2]" 1
19 1 89 ALA H 1 90 VAL H . . 3.350 2.850 2.810 2.913 . 0 0 "[ . 1 . 2]" 1
20 1 88 LEU HB2 1 89 ALA H . . 4.220 2.793 2.681 2.917 . 0 0 "[ . 1 . 2]" 1
21 1 157 LYS HB2 1 158 CYS H . . 4.360 3.005 2.933 4.018 . 0 0 "[ . 1 . 2]" 1
22 1 11 GLN QB 1 152 TRP HE1 . . 4.840 3.424 2.833 4.788 . 0 0 "[ . 1 . 2]" 1
23 1 12 ALA HA 1 152 TRP HE1 . . 4.560 4.632 4.571 4.672 0.112 19 0 "[ . 1 . 2]" 1
24 1 8 LEU MD1 1 152 TRP HE1 . . 4.640 4.262 2.705 4.723 0.083 14 0 "[ . 1 . 2]" 1
25 1 56 ASP H 1 56 ASP HB2 . . 3.500 2.374 2.121 2.638 . 0 0 "[ . 1 . 2]" 1
26 1 56 ASP H 1 57 GLU H . . 3.450 2.889 2.724 3.031 . 0 0 "[ . 1 . 2]" 1
27 1 131 VAL QG 1 133 ALA H . . 5.300 4.756 4.594 4.845 . 0 0 "[ . 1 . 2]" 1
28 1 13 LYS QB 1 14 ALA H . . 3.260 2.535 2.144 3.416 0.156 7 0 "[ . 1 . 2]" 1
29 1 88 LEU H 1 89 ALA H . . 3.470 2.783 2.662 2.849 . 0 0 "[ . 1 . 2]" 1
30 1 9 VAL HB 1 10 ALA H . . 3.500 2.259 2.102 2.588 . 0 0 "[ . 1 . 2]" 1
31 1 10 ALA H 1 11 GLN H . . 3.280 2.824 2.686 2.937 . 0 0 "[ . 1 . 2]" 1
32 1 6 LYS HA 1 10 ALA H . . 4.370 3.435 3.243 3.610 . 0 0 "[ . 1 . 2]" 1
33 1 143 ALA H 1 143 ALA MB . . 3.280 2.038 2.025 2.084 . 0 0 "[ . 1 . 2]" 1
34 1 119 VAL HA 1 120 ARG H . . 3.550 3.525 3.478 3.560 0.010 20 0 "[ . 1 . 2]" 1
35 1 124 PRO QG 1 125 ALA H . . 3.010 2.987 2.826 3.012 0.002 8 0 "[ . 1 . 2]" 1
36 1 83 VAL HA 1 86 ALA H . . 4.540 3.979 3.828 4.092 . 0 0 "[ . 1 . 2]" 1
37 1 86 ALA H 1 87 PHE H . . 3.520 2.872 2.742 2.982 . 0 0 "[ . 1 . 2]" 1
38 1 125 ALA H 1 126 MET H . . 3.300 2.685 2.493 2.809 . 0 0 "[ . 1 . 2]" 1
39 1 90 VAL H 1 91 ALA H . . 3.240 2.721 2.671 2.771 . 0 0 "[ . 1 . 2]" 1
40 1 91 ALA H 1 93 HIS H . . 4.840 3.823 3.744 3.972 . 0 0 "[ . 1 . 2]" 1
41 1 91 ALA H 1 92 GLY H . . 3.530 2.913 2.815 2.993 . 0 0 "[ . 1 . 2]" 1
42 1 18 GLU H 1 19 TYR H . . 3.390 2.747 2.556 2.834 . 0 0 "[ . 1 . 2]" 1
43 1 19 TYR H 1 19 TYR HB3 . . 3.370 2.978 2.654 3.280 . 0 0 "[ . 1 . 2]" 1
44 1 24 LEU H 1 25 LEU H . . 3.100 2.725 2.585 2.841 . 0 0 "[ . 1 . 2]" 1
45 1 87 PHE HA 1 91 ALA H . . 4.530 4.057 3.941 4.216 . 0 0 "[ . 1 . 2]" 1
46 1 40 VAL MG2 1 45 ALA H . . 3.970 2.697 1.897 3.716 . 0 0 "[ . 1 . 2]" 1
47 1 45 ALA H 1 46 GLU QB . . 4.670 4.635 4.485 4.760 0.090 13 0 "[ . 1 . 2]" 1
48 1 5 ASP H 1 5 ASP HB2 . . 3.840 3.002 2.066 3.624 . 0 0 "[ . 1 . 2]" 1
49 1 114 LEU H 1 114 LEU MD1 . . 4.250 2.150 1.890 3.676 . 0 0 "[ . 1 . 2]" 1
50 1 136 GLU H 1 137 PHE H . . 3.690 2.783 2.623 2.948 . 0 0 "[ . 1 . 2]" 1
51 1 114 LEU HB2 1 115 ALA H . . 4.170 2.619 2.465 2.852 . 0 0 "[ . 1 . 2]" 1
52 1 111 ALA H 1 112 ALA H . . 3.050 2.890 2.817 2.976 . 0 0 "[ . 1 . 2]" 1
53 1 110 VAL HB 1 111 ALA H . . 3.420 2.311 2.239 2.398 . 0 0 "[ . 1 . 2]" 1
54 1 103 LYS H 1 104 VAL H . . 3.370 2.734 2.615 2.808 . 0 0 "[ . 1 . 2]" 1
55 1 104 VAL H 1 104 VAL MG1 . . 4.050 3.449 1.831 3.765 . 0 0 "[ . 1 . 2]" 1
56 1 106 SER QB 1 107 LEU H . . 3.290 2.550 2.260 3.048 . 0 0 "[ . 1 . 2]" 1
57 1 103 LYS H 1 103 LYS HB3 . . 4.200 3.370 3.141 3.566 . 0 0 "[ . 1 . 2]" 1
58 1 101 TRP H 1 102 GLY H . . 3.750 2.482 2.268 2.795 . 0 0 "[ . 1 . 2]" 1
59 1 136 GLU QG 1 137 PHE H . . 4.940 4.118 2.804 4.603 . 0 0 "[ . 1 . 2]" 1
60 1 137 PHE H 1 138 VAL H . . 3.620 2.516 2.285 2.731 . 0 0 "[ . 1 . 2]" 1
61 1 137 PHE H 1 137 PHE QD . . 4.220 4.078 3.874 4.146 . 0 0 "[ . 1 . 2]" 1
62 1 137 PHE H 1 137 PHE QB . . 3.040 2.197 2.165 2.220 . 0 0 "[ . 1 . 2]" 1
63 1 136 GLU QB 1 137 PHE H . . 3.550 2.677 2.224 2.937 . 0 0 "[ . 1 . 2]" 1
64 1 70 ALA H 1 71 ARG QB . . 4.650 4.644 4.513 4.685 0.035 1 0 "[ . 1 . 2]" 1
65 1 85 ASP H 1 86 ALA H . . 4.350 2.818 2.697 2.924 . 0 0 "[ . 1 . 2]" 1
66 1 82 VAL HA 1 85 ASP H . . 4.350 3.766 3.606 4.067 . 0 0 "[ . 1 . 2]" 1
67 1 91 ALA HA 1 94 ILE H . . 3.670 3.753 3.719 3.800 0.130 17 0 "[ . 1 . 2]" 1
68 1 94 ILE H 1 94 ILE MG . . 3.900 3.765 3.758 3.772 . 0 0 "[ . 1 . 2]" 1
69 1 92 GLY QA 1 94 ILE H . . 4.540 4.226 3.980 4.399 . 0 0 "[ . 1 . 2]" 1
70 1 112 ALA HA 1 115 ALA H . . 4.400 3.652 3.444 3.736 . 0 0 "[ . 1 . 2]" 1
71 1 136 GLU H 1 137 PHE QB . . 4.700 4.511 4.370 4.568 . 0 0 "[ . 1 . 2]" 1
72 1 104 VAL H 1 105 VAL H . . 3.220 2.726 2.602 2.860 . 0 0 "[ . 1 . 2]" 1
73 1 101 TRP HA 1 104 VAL H . . 3.990 3.397 3.239 3.508 . 0 0 "[ . 1 . 2]" 1
74 1 95 PHE HZ 1 104 VAL H . . 4.180 3.802 3.149 4.192 0.012 5 0 "[ . 1 . 2]" 1
75 1 104 VAL H 1 104 VAL MG2 . . 4.050 2.507 1.929 3.543 . 0 0 "[ . 1 . 2]" 1
76 1 101 TRP H 1 145 TRP HZ2 . . 4.200 3.916 3.397 4.218 0.018 9 0 "[ . 1 . 2]" 1
77 1 101 TRP H 1 101 TRP HD1 . . 4.290 3.408 3.042 3.698 . 0 0 "[ . 1 . 2]" 1
78 1 101 TRP H 1 101 TRP QB . . 3.170 2.336 2.271 2.446 . 0 0 "[ . 1 . 2]" 1
79 1 100 THR MG 1 101 TRP H . . 4.170 3.621 1.904 4.014 . 0 0 "[ . 1 . 2]" 1
80 1 43 ARG H 1 43 ARG QD . . 4.420 3.945 1.891 4.467 0.047 12 0 "[ . 1 . 2]" 1
81 1 136 GLU H 1 138 VAL H . . 4.700 3.998 3.924 4.078 . 0 0 "[ . 1 . 2]" 1
82 1 43 ARG H 1 44 LEU H . . 3.430 2.873 2.715 2.969 . 0 0 "[ . 1 . 2]" 1
83 1 42 GLY HA2 1 43 ARG H . . 3.500 3.533 3.471 3.563 0.063 20 0 "[ . 1 . 2]" 1
84 1 42 GLY HA3 1 43 ARG H . . 3.500 2.830 2.696 3.005 . 0 0 "[ . 1 . 2]" 1
85 1 43 ARG H 1 43 ARG HB2 . . 3.640 3.208 2.770 3.589 . 0 0 "[ . 1 . 2]" 1
86 1 43 ARG H 1 43 ARG HB3 . . 3.640 2.527 2.217 3.511 . 0 0 "[ . 1 . 2]" 1
87 1 108 TYR H 1 109 ALA H . . 3.330 2.871 2.723 2.948 . 0 0 "[ . 1 . 2]" 1
88 1 108 TYR HB2 1 109 ALA H . . 3.840 2.635 2.522 2.738 . 0 0 "[ . 1 . 2]" 1
89 1 109 ALA H 1 109 ALA MB . . 3.230 2.056 2.024 2.141 . 0 0 "[ . 1 . 2]" 1
90 1 48 ALA H 1 49 ALA H . . 3.110 2.876 2.788 2.947 . 0 0 "[ . 1 . 2]" 1
91 1 11 GLN H 1 12 ALA H . . 3.140 2.848 2.621 2.974 . 0 0 "[ . 1 . 2]" 1
92 1 11 GLN QB 1 12 ALA H . . 4.290 2.357 2.188 3.431 . 0 0 "[ . 1 . 2]" 1
93 1 13 LYS QB 1 17 ARG H . . 4.410 4.494 4.402 4.595 0.185 14 0 "[ . 1 . 2]" 1
94 1 13 LYS HA 1 17 ARG H . . 3.560 3.648 3.560 3.726 0.166 4 0 "[ . 1 . 2]" 1
95 1 77 LEU MD2 1 118 ALA H . . 4.090 3.641 3.123 4.009 . 0 0 "[ . 1 . 2]" 1
96 1 31 TRP HD1 1 32 SER H . . 4.490 4.159 3.681 4.637 0.147 20 0 "[ . 1 . 2]" 1
97 1 31 TRP HA 1 32 SER H . . 2.940 2.198 2.140 2.270 . 0 0 "[ . 1 . 2]" 1
98 1 53 ARG H 1 54 LEU H . . 3.450 2.806 2.733 2.982 . 0 0 "[ . 1 . 2]" 1
99 1 52 LEU H 1 53 ARG H . . 3.550 2.902 2.703 3.056 . 0 0 "[ . 1 . 2]" 1
100 1 52 LEU MD1 1 53 ARG H . . 5.030 4.250 4.187 4.311 . 0 0 "[ . 1 . 2]" 1
101 1 110 VAL H 1 111 ALA H . . 3.630 2.861 2.818 2.923 . 0 0 "[ . 1 . 2]" 1
102 1 110 VAL H 1 110 VAL HB . . 3.170 2.716 2.656 2.743 . 0 0 "[ . 1 . 2]" 1
103 1 109 ALA MB 1 110 VAL H . . 4.060 2.463 2.330 2.647 . 0 0 "[ . 1 . 2]" 1
104 1 87 PHE QD 1 134 LEU H . . 4.600 4.169 3.938 4.490 . 0 0 "[ . 1 . 2]" 1
105 1 131 VAL HA 1 134 LEU H . . 4.040 3.712 3.577 3.928 . 0 0 "[ . 1 . 2]" 1
106 1 133 ALA H 1 134 LEU H . . 3.220 2.769 2.668 2.883 . 0 0 "[ . 1 . 2]" 1
107 1 134 LEU H 1 134 LEU HB2 . . 3.410 2.195 2.042 2.448 . 0 0 "[ . 1 . 2]" 1
108 1 33 ALA MB 1 36 ARG H . . 5.150 3.710 1.915 5.210 0.060 8 0 "[ . 1 . 2]" 1
109 1 7 GLU H 1 7 GLU QG . . 3.020 2.066 1.932 2.296 . 0 0 "[ . 1 . 2]" 1
110 1 9 VAL H 1 9 VAL HB . . 3.260 2.590 2.515 2.697 . 0 0 "[ . 1 . 2]" 1
111 1 68 ASN H 1 69 VAL H . . 3.140 2.185 1.676 2.592 . 0 0 "[ . 1 . 2]" 1
112 1 26 ARG H 1 27 ALA H . . 3.350 2.512 2.299 2.736 . 0 0 "[ . 1 . 2]" 1
113 1 50 VAL H 1 51 LEU H . . 3.390 2.878 2.837 2.916 . 0 0 "[ . 1 . 2]" 1
114 1 50 VAL H 1 50 VAL HB . . 3.040 2.596 2.573 2.619 . 0 0 "[ . 1 . 2]" 1
115 1 49 ALA MB 1 50 VAL H . . 3.690 2.350 2.211 2.532 . 0 0 "[ . 1 . 2]" 1
116 1 50 VAL H 1 50 VAL MG2 . . 3.990 2.066 1.953 2.231 . 0 0 "[ . 1 . 2]" 1
117 1 50 VAL HA 1 54 LEU H . . 4.780 3.862 3.709 3.988 . 0 0 "[ . 1 . 2]" 1
118 1 53 ARG QG 1 54 LEU H . . 4.150 1.997 1.877 3.506 . 0 0 "[ . 1 . 2]" 1
119 1 137 PHE QD 1 138 VAL H . . 4.800 3.733 3.457 4.067 . 0 0 "[ . 1 . 2]" 1
120 1 137 PHE QB 1 138 VAL H . . 3.730 2.976 2.899 3.169 . 0 0 "[ . 1 . 2]" 1
121 1 6 LYS HA 1 9 VAL H . . 4.850 3.735 3.448 4.007 . 0 0 "[ . 1 . 2]" 1
122 1 68 ASN HA 1 69 VAL H . . 3.380 3.380 2.701 3.471 0.091 20 0 "[ . 1 . 2]" 1
123 1 130 LEU H 1 130 LEU HB2 . . 3.740 2.407 2.264 2.564 . 0 0 "[ . 1 . 2]" 1
124 1 29 LEU H 1 29 LEU MD2 . . 3.910 3.483 1.922 3.950 0.040 1 0 "[ . 1 . 2]" 1
125 1 26 ARG H 1 26 ARG QB . . 3.160 2.210 2.057 2.346 . 0 0 "[ . 1 . 2]" 1
126 1 65 VAL H 1 65 VAL HB . . 4.080 3.865 3.627 3.918 . 0 0 "[ . 1 . 2]" 1
127 1 65 VAL H 1 65 VAL MG2 . . 4.600 2.521 2.194 4.024 . 0 0 "[ . 1 . 2]" 1
128 1 129 ALA H 1 132 ASP QB . . 4.630 4.664 4.635 4.707 0.077 20 0 "[ . 1 . 2]" 1
129 1 129 ALA H 1 130 LEU H . . 3.250 2.800 2.673 2.944 . 0 0 "[ . 1 . 2]" 1
130 1 138 VAL H 1 138 VAL HB . . 3.240 2.431 2.373 2.456 . 0 0 "[ . 1 . 2]" 1
131 1 81 ARG H 1 82 VAL H . . 3.400 2.609 2.506 2.835 . 0 0 "[ . 1 . 2]" 1
132 1 129 ALA HA 1 130 LEU H . . 3.570 3.565 3.535 3.572 0.002 14 0 "[ . 1 . 2]" 1
133 1 131 VAL HB 1 132 ASP H . . 3.390 2.596 2.511 2.656 . 0 0 "[ . 1 . 2]" 1
134 1 130 LEU H 1 130 LEU HG . . 3.180 2.388 2.097 2.717 . 0 0 "[ . 1 . 2]" 1
135 1 132 ASP H 1 134 LEU H . . 4.840 4.202 4.024 4.335 . 0 0 "[ . 1 . 2]" 1
136 1 82 VAL H 1 83 VAL H . . 3.820 2.638 2.470 2.807 . 0 0 "[ . 1 . 2]" 1
137 1 83 VAL H 1 83 VAL MG1 . . 4.010 1.999 1.868 3.684 . 0 0 "[ . 1 . 2]" 1
138 1 105 VAL H 1 106 SER H . . 3.250 2.849 2.701 3.001 . 0 0 "[ . 1 . 2]" 1
139 1 102 GLY QA 1 105 VAL H . . 4.340 3.454 3.350 3.575 . 0 0 "[ . 1 . 2]" 1
140 1 105 VAL H 1 105 VAL HB . . 3.340 2.631 2.514 2.690 . 0 0 "[ . 1 . 2]" 1
141 1 104 VAL MG2 1 105 VAL H . . 4.180 3.669 2.049 4.222 0.042 15 0 "[ . 1 . 2]" 1
142 1 105 VAL H 1 105 VAL MG2 . . 4.600 2.174 2.094 2.276 . 0 0 "[ . 1 . 2]" 1
143 1 101 TRP HA 1 105 VAL H . . 4.860 4.425 4.299 4.539 . 0 0 "[ . 1 . 2]" 1
144 1 147 ARG H 1 147 ARG QB . . 3.070 2.232 2.084 2.278 . 0 0 "[ . 1 . 2]" 1
145 1 139 ARG H 1 140 LYS H . . 3.730 2.442 2.277 2.665 . 0 0 "[ . 1 . 2]" 1
146 1 138 VAL HB 1 139 ARG H . . 3.990 2.954 2.588 3.056 . 0 0 "[ . 1 . 2]" 1
147 1 136 GLU HA 1 139 ARG H . . 4.490 3.390 3.220 3.757 . 0 0 "[ . 1 . 2]" 1
148 1 132 ASP H 1 132 ASP QB . . 3.100 2.122 2.049 2.206 . 0 0 "[ . 1 . 2]" 1
149 1 24 LEU HA 1 25 LEU H . . 3.480 3.556 3.540 3.570 0.090 11 0 "[ . 1 . 2]" 1
150 1 21 HIS QB 1 22 ALA H . . 3.300 2.666 2.499 2.933 . 0 0 "[ . 1 . 2]" 1
151 1 48 ALA HA 1 51 LEU H . . 4.010 3.730 3.604 3.848 . 0 0 "[ . 1 . 2]" 1
152 1 51 LEU H 1 51 LEU HB2 . . 3.780 2.638 2.248 2.707 . 0 0 "[ . 1 . 2]" 1
153 1 51 LEU H 1 51 LEU HG . . 3.460 2.074 1.921 3.567 0.107 19 0 "[ . 1 . 2]" 1
154 1 7 GLU H 1 8 LEU H . . 3.600 2.795 2.674 2.953 . 0 0 "[ . 1 . 2]" 1
155 1 22 ALA H 1 24 LEU H . . 4.170 4.002 3.774 4.191 0.021 18 0 "[ . 1 . 2]" 1
156 1 61 ILE H 1 62 ARG H . . 3.750 2.790 2.710 2.895 . 0 0 "[ . 1 . 2]" 1
157 1 47 VAL H 1 48 ALA H . . 3.500 2.870 2.803 2.957 . 0 0 "[ . 1 . 2]" 1
158 1 46 GLU H 1 47 VAL H . . 3.300 2.835 2.784 2.888 . 0 0 "[ . 1 . 2]" 1
159 1 46 GLU HA 1 47 VAL H . . 3.480 3.567 3.560 3.570 0.090 13 0 "[ . 1 . 2]" 1
160 1 47 VAL H 1 47 VAL HB . . 3.070 2.602 2.543 2.684 . 0 0 "[ . 1 . 2]" 1
161 1 45 ALA MB 1 47 VAL H . . 4.980 4.789 4.615 4.898 . 0 0 "[ . 1 . 2]" 1
162 1 67 ARG H 1 68 ASN H . . 4.360 2.393 1.911 2.804 . 0 0 "[ . 1 . 2]" 1
163 1 8 LEU H 1 8 LEU HB2 . . 3.880 2.489 2.050 2.744 . 0 0 "[ . 1 . 2]" 1
164 1 131 VAL H 1 131 VAL HB . . 3.230 2.518 2.492 2.553 . 0 0 "[ . 1 . 2]" 1
165 1 130 LEU HG 1 131 VAL H . . 4.630 4.383 4.218 4.548 . 0 0 "[ . 1 . 2]" 1
166 1 131 VAL H 1 131 VAL QG . . 3.290 2.125 2.031 2.213 . 0 0 "[ . 1 . 2]" 1
167 1 147 ARG H 1 148 ARG H . . 3.550 2.487 2.369 2.739 . 0 0 "[ . 1 . 2]" 1
168 1 148 ARG H 1 148 ARG QB . . 3.170 2.241 2.130 2.351 . 0 0 "[ . 1 . 2]" 1
169 1 27 ALA H 1 28 GLY H . . 3.230 2.864 2.390 3.236 0.006 18 0 "[ . 1 . 2]" 1
170 1 87 PHE H 1 87 PHE QD . . 4.500 4.173 4.157 4.182 . 0 0 "[ . 1 . 2]" 1
171 1 33 ALA MB 1 35 GLU H . . 3.850 2.807 2.092 3.119 . 0 0 "[ . 1 . 2]" 1
172 1 35 GLU H 1 36 ARG H . . 3.580 2.755 1.897 3.853 0.273 16 0 "[ . 1 . 2]" 1
173 1 34 PRO QD 1 35 GLU H . . 3.640 2.812 2.606 3.850 0.210 8 0 "[ . 1 . 2]" 1
174 1 75 ILE HB 1 76 SER H . . 3.980 3.933 3.788 3.970 . 0 0 "[ . 1 . 2]" 1
175 1 108 TYR H 1 108 TYR QD . . 3.690 2.983 1.941 3.446 . 0 0 "[ . 1 . 2]" 1
176 1 85 ASP H 1 87 PHE H . . 4.430 4.415 4.305 4.451 0.021 3 0 "[ . 1 . 2]" 1
177 1 119 VAL H 1 120 ARG H . . 3.340 2.798 2.707 2.899 . 0 0 "[ . 1 . 2]" 1
178 1 116 VAL HA 1 119 VAL H . . 3.720 3.703 3.571 3.819 0.099 18 0 "[ . 1 . 2]" 1
179 1 119 VAL H 1 119 VAL HB . . 3.190 2.564 2.485 2.606 . 0 0 "[ . 1 . 2]" 1
180 1 118 ALA MB 1 119 VAL H . . 3.680 2.278 2.079 2.635 . 0 0 "[ . 1 . 2]" 1
181 1 120 ARG H 1 122 ALA H . . 4.730 4.141 4.037 4.267 . 0 0 "[ . 1 . 2]" 1
182 1 45 ALA MB 1 46 GLU H . . 3.410 2.584 2.384 2.753 . 0 0 "[ . 1 . 2]" 1
183 1 45 ALA H 1 46 GLU H . . 3.690 2.828 2.747 2.904 . 0 0 "[ . 1 . 2]" 1
184 1 46 GLU H 1 46 GLU QB . . 3.420 2.228 2.058 2.358 . 0 0 "[ . 1 . 2]" 1
185 1 91 ALA MB 1 93 HIS H . . 4.960 4.157 4.100 4.291 . 0 0 "[ . 1 . 2]" 1
186 1 66 TYR QD 1 67 ARG H . . 4.410 4.389 4.277 4.497 0.087 18 0 "[ . 1 . 2]" 1
187 1 117 ASP H 1 118 ALA H . . 3.330 2.819 2.658 2.935 . 0 0 "[ . 1 . 2]" 1
188 1 116 VAL H 1 117 ASP H . . 3.280 2.844 2.771 2.891 . 0 0 "[ . 1 . 2]" 1
189 1 117 ASP H 1 117 ASP HB3 . . 3.550 3.228 3.003 3.461 . 0 0 "[ . 1 . 2]" 1
190 1 116 VAL HB 1 117 ASP H . . 3.340 2.569 2.231 3.520 0.180 20 0 "[ . 1 . 2]" 1
191 1 117 ASP H 1 118 ALA MB . . 4.810 4.438 4.317 4.527 . 0 0 "[ . 1 . 2]" 1
192 1 87 PHE QD 1 88 LEU H . . 3.910 3.157 3.101 3.248 . 0 0 "[ . 1 . 2]" 1
193 1 88 LEU H 1 88 LEU HG . . 3.100 3.070 2.795 3.121 0.021 6 0 "[ . 1 . 2]" 1
194 1 99 ILE H 1 100 THR H . . 4.610 2.822 2.213 3.078 . 0 0 "[ . 1 . 2]" 1
195 1 122 ALA H 1 123 GLN H . . 3.190 2.830 2.711 2.917 . 0 0 "[ . 1 . 2]" 1
196 1 69 VAL HA 1 72 GLN H . . 4.460 3.261 3.200 3.421 . 0 0 "[ . 1 . 2]" 1
197 1 71 ARG QB 1 72 GLN H . . 3.340 2.752 2.694 2.854 . 0 0 "[ . 1 . 2]" 1
198 1 92 GLY H 1 93 HIS H . . 3.240 2.688 2.615 2.771 . 0 0 "[ . 1 . 2]" 1
199 1 93 HIS H 1 93 HIS QB . . 3.100 2.226 2.072 2.271 . 0 0 "[ . 1 . 2]" 1
200 1 93 HIS H 1 94 ILE H . . 3.290 2.630 2.571 2.721 . 0 0 "[ . 1 . 2]" 1
201 1 92 GLY QA 1 93 HIS H . . 3.370 2.817 2.763 2.840 . 0 0 "[ . 1 . 2]" 1
202 1 88 LEU H 1 89 ALA MB . . 4.300 4.334 4.265 4.385 0.085 19 0 "[ . 1 . 2]" 1
203 1 51 LEU H 1 52 LEU H . . 3.980 2.641 2.578 2.933 . 0 0 "[ . 1 . 2]" 1
204 1 52 LEU H 1 52 LEU HB3 . . 3.670 3.506 3.425 3.581 . 0 0 "[ . 1 . 2]" 1
205 1 44 LEU H 1 45 ALA H . . 3.150 2.857 2.719 3.006 . 0 0 "[ . 1 . 2]" 1
206 1 44 LEU H 1 44 LEU HB2 . . 3.560 2.113 2.045 2.210 . 0 0 "[ . 1 . 2]" 1
207 1 47 VAL QG 1 152 TRP H . . 4.950 3.718 3.529 3.979 . 0 0 "[ . 1 . 2]" 1
208 1 152 TRP H 1 152 TRP HB2 . . 3.980 2.375 2.280 2.516 . 0 0 "[ . 1 . 2]" 1
209 1 151 GLY HA3 1 152 TRP H . . 3.510 2.544 2.500 2.593 . 0 0 "[ . 1 . 2]" 1
210 1 152 TRP H 1 152 TRP HD1 . . 4.400 2.302 2.018 2.604 . 0 0 "[ . 1 . 2]" 1
211 1 14 ALA H 1 15 LEU H . . 4.040 2.822 2.695 2.923 . 0 0 "[ . 1 . 2]" 1
212 1 15 LEU H 1 15 LEU HB3 . . 3.890 3.575 3.475 3.591 . 0 0 "[ . 1 . 2]" 1
213 1 15 LEU H 1 15 LEU HB2 . . 3.890 2.505 2.155 2.636 . 0 0 "[ . 1 . 2]" 1
214 1 116 VAL H 1 116 VAL HB . . 3.540 2.760 2.476 3.611 0.071 20 0 "[ . 1 . 2]" 1
215 1 115 ALA MB 1 116 VAL H . . 3.760 2.461 2.198 2.701 . 0 0 "[ . 1 . 2]" 1
216 1 116 VAL H 1 118 ALA H . . 4.540 4.249 3.981 4.544 0.004 11 0 "[ . 1 . 2]" 1
217 1 113 GLY QA 1 116 VAL H . . 4.320 3.580 3.464 3.757 . 0 0 "[ . 1 . 2]" 1
218 1 17 ARG H 1 18 GLU H . . 3.900 2.991 2.794 3.121 . 0 0 "[ . 1 . 2]" 1
219 1 17 ARG QB 1 18 GLU H . . 3.930 2.419 2.031 3.369 . 0 0 "[ . 1 . 2]" 1
220 1 6 LYS H 1 7 GLU H . . 3.680 2.846 2.624 2.998 . 0 0 "[ . 1 . 2]" 1
221 1 5 ASP H 1 6 LYS H . . 3.610 2.534 2.361 2.839 . 0 0 "[ . 1 . 2]" 1
222 1 127 VAL H 1 127 VAL HB . . 3.190 2.463 2.348 2.540 . 0 0 "[ . 1 . 2]" 1
223 1 127 VAL H 1 127 VAL MG2 . . 4.210 2.189 2.053 2.405 . 0 0 "[ . 1 . 2]" 1
224 1 142 LEU H 1 143 ALA H . . 3.530 2.281 2.130 2.529 . 0 0 "[ . 1 . 2]" 1
225 1 20 VAL MG1 1 21 HIS H . . 4.250 3.323 3.187 3.459 . 0 0 "[ . 1 . 2]" 1
226 1 20 VAL H 1 21 HIS H . . 3.760 2.897 2.775 2.963 . 0 0 "[ . 1 . 2]" 1
227 1 21 HIS H 1 21 HIS QB . . 3.100 2.186 2.076 2.249 . 0 0 "[ . 1 . 2]" 1
228 1 20 VAL HB 1 21 HIS H . . 3.530 2.456 2.354 2.674 . 0 0 "[ . 1 . 2]" 1
229 1 145 TRP HE3 1 146 LEU H . . 4.260 3.162 2.805 3.424 . 0 0 "[ . 1 . 2]" 1
230 1 6 LYS H 1 6 LYS HB3 . . 3.590 3.536 2.734 3.602 0.012 13 0 "[ . 1 . 2]" 1
231 1 23 ARG H 1 24 LEU H . . 3.580 2.725 2.546 2.808 . 0 0 "[ . 1 . 2]" 1
232 1 17 ARG HE 1 18 GLU QB . . 4.740 4.649 3.466 4.897 0.157 11 0 "[ . 1 . 2]" 1
233 1 13 LYS H 1 14 ALA H . . 4.060 2.812 2.614 2.932 . 0 0 "[ . 1 . 2]" 1
234 1 13 LYS H 1 13 LYS QB . . 3.180 2.375 2.225 2.580 . 0 0 "[ . 1 . 2]" 1
235 1 59 GLU H 1 59 GLU QB . . 3.270 2.167 2.066 2.610 . 0 0 "[ . 1 . 2]" 1
236 1 47 VAL HA 1 49 ALA H . . 4.610 4.472 4.090 4.663 0.053 10 0 "[ . 1 . 2]" 1
237 1 155 VAL HA 1 157 LYS H . . 4.760 3.702 3.548 3.892 . 0 0 "[ . 1 . 2]" 1
238 1 157 LYS H 1 157 LYS QG . . 3.510 2.361 1.949 2.807 . 0 0 "[ . 1 . 2]" 1
239 1 61 ILE H 1 61 ILE HB . . 4.080 2.483 2.419 2.521 . 0 0 "[ . 1 . 2]" 1
240 1 144 THR MG 1 148 ARG HE . . 4.940 4.649 4.229 5.007 0.067 15 0 "[ . 1 . 2]" 1
241 1 96 SER H 1 97 ALA MB . . 4.790 4.497 4.278 4.790 0.000 13 0 "[ . 1 . 2]" 1
242 1 95 PHE QD 1 96 SER H . . 4.930 4.400 4.304 4.684 . 0 0 "[ . 1 . 2]" 1
243 1 153 THR HA 1 155 VAL H . . 4.510 4.171 3.848 4.299 . 0 0 "[ . 1 . 2]" 1
244 1 149 ARG HB3 1 149 ARG HE . . 4.610 2.556 2.309 2.943 . 0 0 "[ . 1 . 2]" 1
245 1 70 ALA H 1 71 ARG H . . 3.320 2.927 2.886 2.958 . 0 0 "[ . 1 . 2]" 1
246 1 68 ASN HA 1 71 ARG H . . 4.470 3.476 3.393 3.773 . 0 0 "[ . 1 . 2]" 1
247 1 155 VAL H 1 156 LEU H . . 3.430 2.617 2.580 2.672 . 0 0 "[ . 1 . 2]" 1
248 1 155 VAL H 1 156 LEU MD1 . . 5.070 4.834 3.430 5.162 0.092 9 0 "[ . 1 . 2]" 1
249 1 20 VAL H 1 20 VAL HB . . 3.210 2.617 2.499 2.725 . 0 0 "[ . 1 . 2]" 1
250 1 127 VAL MG2 1 128 HIS H . . 4.360 3.806 3.713 3.965 . 0 0 "[ . 1 . 2]" 1
251 1 128 HIS H 1 131 VAL QG . . 4.930 4.478 4.400 4.593 . 0 0 "[ . 1 . 2]" 1
252 1 127 VAL MG1 1 128 HIS H . . 4.360 2.982 2.758 3.145 . 0 0 "[ . 1 . 2]" 1
253 1 119 VAL H 1 121 GLN H . . 4.790 4.062 3.911 4.221 . 0 0 "[ . 1 . 2]" 1
254 1 75 ILE H 1 75 ILE HG12 . . 4.670 4.475 4.454 4.487 . 0 0 "[ . 1 . 2]" 1
255 1 74 HIS H 1 75 ILE H . . 3.880 2.902 2.830 3.011 . 0 0 "[ . 1 . 2]" 1
256 1 74 HIS HA 1 75 ILE H . . 3.340 2.765 2.645 2.845 . 0 0 "[ . 1 . 2]" 1
257 1 75 ILE H 1 75 ILE HB . . 3.710 2.507 2.278 2.568 . 0 0 "[ . 1 . 2]" 1
258 1 75 ILE H 1 75 ILE HG13 . . 4.670 4.428 4.211 4.463 . 0 0 "[ . 1 . 2]" 1
259 1 72 GLN HA 1 74 HIS H . . 4.540 4.105 3.810 4.246 . 0 0 "[ . 1 . 2]" 1
260 1 128 HIS H 1 129 ALA H . . 3.430 2.605 2.568 2.716 . 0 0 "[ . 1 . 2]" 1
261 1 78 GLN H 1 78 GLN HB3 . . 3.560 3.504 3.359 3.655 0.095 5 0 "[ . 1 . 2]" 1
262 1 120 ARG H 1 121 GLN H . . 3.420 2.496 2.399 2.634 . 0 0 "[ . 1 . 2]" 1
263 1 121 GLN H 1 122 ALA H . . 3.300 2.713 2.666 2.783 . 0 0 "[ . 1 . 2]" 1
264 1 121 GLN H 1 121 GLN HB2 . . 3.540 2.272 2.181 3.669 0.129 13 0 "[ . 1 . 2]" 1
265 1 120 ARG HB3 1 120 ARG HE . . 4.250 2.619 1.985 3.611 . 0 0 "[ . 1 . 2]" 1
266 1 77 LEU H 1 78 GLN H . . 3.600 2.718 2.568 3.371 . 0 0 "[ . 1 . 2]" 1
267 1 78 GLN H 1 78 GLN QG . . 3.560 3.310 1.934 3.610 0.050 6 0 "[ . 1 . 2]" 1
268 1 139 ARG HE 1 140 LYS QD . . 4.940 4.273 3.426 4.962 0.022 8 0 "[ . 1 . 2]" 1
269 1 43 ARG HE 1 44 LEU HA . . 4.410 4.356 4.174 4.666 0.256 15 0 "[ . 1 . 2]" 1
270 1 121 GLN H 1 123 GLN H . . 3.970 3.961 3.763 4.050 0.080 13 0 "[ . 1 . 2]" 1
271 1 122 ALA MB 1 123 GLN H . . 4.160 3.718 3.715 3.720 . 0 0 "[ . 1 . 2]" 1
272 1 59 GLU H 1 60 MET H . . 3.690 2.607 2.545 2.669 . 0 0 "[ . 1 . 2]" 1
273 1 65 VAL MG1 1 66 TYR H . . 5.120 4.180 3.924 4.398 . 0 0 "[ . 1 . 2]" 1
274 1 66 TYR H 1 66 TYR QD . . 4.390 2.729 2.038 3.061 . 0 0 "[ . 1 . 2]" 1
275 1 65 VAL HB 1 66 TYR H . . 4.770 4.072 3.346 4.589 . 0 0 "[ . 1 . 2]" 1
276 1 65 VAL MG2 1 66 TYR H . . 5.120 3.450 1.853 4.175 . 0 0 "[ . 1 . 2]" 1
277 1 147 ARG HA 1 147 ARG HE . . 4.670 4.440 3.486 4.684 0.014 13 0 "[ . 1 . 2]" 1
278 1 148 ARG H 1 149 ARG H . . 3.430 2.407 2.289 2.619 . 0 0 "[ . 1 . 2]" 1
279 1 149 ARG H 1 149 ARG HB3 . . 4.140 3.567 3.529 3.599 . 0 0 "[ . 1 . 2]" 1
280 1 149 ARG H 1 149 ARG HG2 . . 3.950 3.116 2.807 3.339 . 0 0 "[ . 1 . 2]" 1
281 1 149 ARG H 1 149 ARG HG3 . . 3.950 3.138 3.037 3.342 . 0 0 "[ . 1 . 2]" 1
282 1 105 VAL HB 1 106 SER H . . 3.460 2.288 2.170 2.433 . 0 0 "[ . 1 . 2]" 1
283 1 29 LEU H 1 30 SER H . . 4.370 4.383 4.283 4.554 0.184 9 0 "[ . 1 . 2]" 1
284 1 29 LEU HA 1 30 SER H . . 3.090 2.521 2.304 2.700 . 0 0 "[ . 1 . 2]" 1
285 1 30 SER H 1 30 SER QB . . 3.040 2.516 2.142 2.976 . 0 0 "[ . 1 . 2]" 1
286 1 29 LEU HB2 1 30 SER H . . 4.160 2.482 1.931 3.603 . 0 0 "[ . 1 . 2]" 1
287 1 126 MET H 1 127 VAL H . . 3.550 2.651 2.572 2.822 . 0 0 "[ . 1 . 2]" 1
288 1 94 ILE MG 1 95 PHE H . . 4.370 3.569 3.201 3.788 . 0 0 "[ . 1 . 2]" 1
289 1 95 PHE H 1 95 PHE HB3 . . 3.890 3.546 3.507 3.579 . 0 0 "[ . 1 . 2]" 1
290 1 94 ILE H 1 95 PHE H . . 3.730 2.501 2.426 2.713 . 0 0 "[ . 1 . 2]" 1
291 1 92 GLY QA 1 95 PHE H . . 4.450 3.384 3.291 3.543 . 0 0 "[ . 1 . 2]" 1
292 1 95 PHE H 1 95 PHE QD . . 4.190 2.341 2.066 3.237 . 0 0 "[ . 1 . 2]" 1
293 1 94 ILE HB 1 95 PHE H . . 3.680 2.810 2.414 3.040 . 0 0 "[ . 1 . 2]" 1
294 1 68 ASN QB 1 68 ASN HD22 . . 3.570 2.251 2.089 2.548 . 0 0 "[ . 1 . 2]" 1
295 1 83 VAL HB 1 84 THR H . . 4.310 3.878 2.342 4.033 . 0 0 "[ . 1 . 2]" 1
296 1 83 VAL H 1 84 THR H . . 3.700 2.713 2.531 2.854 . 0 0 "[ . 1 . 2]" 1
297 1 100 THR H 1 100 THR MG . . 3.790 2.599 1.903 3.871 0.081 4 0 "[ . 1 . 2]" 1
298 1 4 THR H 1 7 GLU QG . . 4.240 3.655 2.344 4.266 0.026 20 0 "[ . 1 . 2]" 1
299 1 64 SER H 1 65 VAL H . . 3.300 2.855 2.770 2.968 . 0 0 "[ . 1 . 2]" 1
300 1 63 PRO HB2 1 64 SER H . . 4.500 3.340 3.043 3.533 . 0 0 "[ . 1 . 2]" 1
301 1 63 PRO HB3 1 64 SER H . . 4.500 3.874 3.690 4.000 . 0 0 "[ . 1 . 2]" 1
302 1 63 PRO QG 1 64 SER H . . 4.500 4.579 4.431 4.660 0.160 19 0 "[ . 1 . 2]" 1
303 1 143 ALA MB 1 144 THR H . . 3.550 2.410 2.275 2.492 . 0 0 "[ . 1 . 2]" 1
304 1 144 THR H 1 144 THR MG . . 4.420 3.765 3.757 3.768 . 0 0 "[ . 1 . 2]" 1
305 1 78 GLN H 1 79 SER H . . 3.140 2.640 1.906 2.861 . 0 0 "[ . 1 . 2]" 1
306 1 77 LEU H 1 79 SER H . . 4.990 4.669 4.400 5.116 0.126 5 0 "[ . 1 . 2]" 1
307 1 78 GLN QG 1 123 GLN HE21 . . 4.010 3.737 2.504 4.032 0.022 14 0 "[ . 1 . 2]" 1
308 1 141 THR H 1 142 LEU H . . 3.170 2.440 2.224 2.690 . 0 0 "[ . 1 . 2]" 1
309 1 137 PHE HA 1 141 THR H . . 3.760 3.088 2.917 3.379 . 0 0 "[ . 1 . 2]" 1
310 1 140 LYS QB 1 141 THR H . . 3.290 2.250 2.059 2.398 . 0 0 "[ . 1 . 2]" 1
311 1 78 GLN QG 1 123 GLN HE22 . . 4.010 3.520 2.915 4.010 0.000 7 0 "[ . 1 . 2]" 1
312 1 55 GLY H 1 56 ASP H . . 3.490 2.774 2.531 3.011 . 0 0 "[ . 1 . 2]" 1
313 1 53 ARG QG 1 55 GLY H . . 4.490 4.609 4.498 5.236 0.746 18 1 "[ . 1 . + 2]" 1
314 1 78 GLN HA 1 78 GLN HE21 . . 4.650 4.175 3.490 4.666 0.016 6 0 "[ . 1 . 2]" 1
315 1 41 PRO HA 1 42 GLY H . . 2.650 2.648 2.468 2.710 0.060 20 0 "[ . 1 . 2]" 1
316 1 41 PRO HB3 1 42 GLY H . . 3.900 3.210 3.161 3.380 . 0 0 "[ . 1 . 2]" 1
317 1 11 GLN HE21 1 44 LEU HG . . 4.880 2.685 2.056 3.946 . 0 0 "[ . 1 . 2]" 1
318 1 15 LEU H 1 16 GLY H . . 3.620 2.864 2.612 2.971 . 0 0 "[ . 1 . 2]" 1
319 1 15 LEU HB2 1 16 GLY H . . 4.150 2.260 2.098 2.758 . 0 0 "[ . 1 . 2]" 1
320 1 14 ALA MB 1 16 GLY H . . 5.320 4.775 4.483 4.913 . 0 0 "[ . 1 . 2]" 1
321 1 11 GLN HE22 1 44 LEU HG . . 4.880 3.039 2.391 4.020 . 0 0 "[ . 1 . 2]" 1
322 1 97 ALA H 1 98 GLY H . . 3.180 2.563 2.123 2.706 . 0 0 "[ . 1 . 2]" 1
323 1 97 ALA HA 1 98 GLY H . . 3.320 3.140 3.057 3.358 0.038 14 0 "[ . 1 . 2]" 1
324 1 149 ARG H 1 151 GLY H . . 4.430 4.428 4.380 4.456 0.026 19 0 "[ . 1 . 2]" 1
325 1 112 ALA MB 1 113 GLY H . . 3.860 2.644 2.589 2.736 . 0 0 "[ . 1 . 2]" 1
326 1 112 ALA H 1 113 GLY H . . 3.410 2.763 2.698 2.839 . 0 0 "[ . 1 . 2]" 1
327 1 113 GLY H 1 114 LEU H . . 3.110 2.814 2.724 2.926 . 0 0 "[ . 1 . 2]" 1
328 1 102 GLY H 1 103 LYS H . . 3.140 2.940 2.882 3.001 . 0 0 "[ . 1 . 2]" 1
329 1 134 LEU HB2 1 135 GLY H . . 4.420 3.343 2.896 3.706 . 0 0 "[ . 1 . 2]" 1
330 1 134 LEU HB3 1 135 GLY H . . 4.420 2.253 2.082 2.498 . 0 0 "[ . 1 . 2]" 1
331 1 150 GLY H 1 151 GLY H . . 3.270 3.017 2.982 3.063 . 0 0 "[ . 1 . 2]" 1
332 1 149 ARG H 1 150 GLY H . . 3.650 2.406 2.309 2.446 . 0 0 "[ . 1 . 2]" 1
333 1 152 TRP H 1 153 THR H . . 3.600 2.434 2.366 2.497 . 0 0 "[ . 1 . 2]" 1
334 1 92 GLY H 1 137 PHE QE . . 4.180 3.475 3.239 3.999 . 0 0 "[ . 1 . 2]" 1
335 1 91 ALA MB 1 92 GLY H . . 3.580 2.315 2.250 2.405 . 0 0 "[ . 1 . 2]" 1
336 1 100 THR HB 1 101 TRP H . . 3.680 2.789 2.409 3.633 . 0 0 "[ . 1 . 2]" 1
337 1 4 THR HB 1 5 ASP H . . 3.970 2.463 1.862 3.962 . 0 0 "[ . 1 . 2]" 1
338 1 141 THR H 1 141 THR HB . . 3.130 2.453 2.389 2.541 . 0 0 "[ . 1 . 2]" 1
339 1 137 PHE HA 1 141 THR HB . . 4.020 3.801 3.581 4.093 0.073 17 0 "[ . 1 . 2]" 1
340 1 141 THR HB 1 142 LEU HG . . 3.850 3.153 2.879 3.907 0.057 17 0 "[ . 1 . 2]" 1
341 1 141 THR HB 1 142 LEU H . . 3.470 2.631 2.311 2.922 . 0 0 "[ . 1 . 2]" 1
342 1 137 PHE HZ 1 141 THR HB . . 4.320 3.851 3.684 4.113 . 0 0 "[ . 1 . 2]" 1
343 1 153 THR H 1 153 THR HB . . 4.110 3.554 2.737 3.620 . 0 0 "[ . 1 . 2]" 1
344 1 84 THR H 1 84 THR HB . . 3.570 3.589 3.533 3.614 0.044 18 0 "[ . 1 . 2]" 1
345 1 84 THR HB 1 133 ALA MB . . 4.260 3.294 2.978 3.509 . 0 0 "[ . 1 . 2]" 1
346 1 144 THR H 1 144 THR HB . . 3.120 2.563 2.493 2.680 . 0 0 "[ . 1 . 2]" 1
347 1 104 VAL HA 1 104 VAL MG1 . . 3.440 2.464 2.173 3.088 . 0 0 "[ . 1 . 2]" 1
348 1 104 VAL HA 1 104 VAL MG2 . . 3.440 2.334 1.946 3.135 . 0 0 "[ . 1 . 2]" 1
349 1 95 PHE HZ 1 104 VAL HA . . 3.050 2.175 1.979 2.416 . 0 0 "[ . 1 . 2]" 1
350 1 104 VAL HA 1 108 TYR H . . 4.060 3.848 3.683 4.065 0.005 8 0 "[ . 1 . 2]" 1
351 1 105 VAL HA 1 108 TYR H . . 4.140 3.852 3.711 4.140 . 0 0 "[ . 1 . 2]" 1
352 1 105 VAL HA 1 108 TYR QD . . 4.200 3.327 2.664 4.392 0.192 13 0 "[ . 1 . 2]" 1
353 1 110 VAL HA 1 110 VAL MG2 . . 3.340 2.425 2.401 2.443 . 0 0 "[ . 1 . 2]" 1
354 1 110 VAL HA 1 110 VAL MG1 . . 3.340 2.305 2.196 2.376 . 0 0 "[ . 1 . 2]" 1
355 1 84 THR HA 1 88 LEU H . . 3.680 3.734 3.708 3.784 0.104 18 0 "[ . 1 . 2]" 1
356 1 84 THR HA 1 84 THR MG . . 3.330 2.142 2.030 2.242 . 0 0 "[ . 1 . 2]" 1
357 1 19 TYR QD 1 20 VAL HA . . 5.120 4.282 3.252 4.987 . 0 0 "[ . 1 . 2]" 1
358 1 119 VAL HA 1 124 PRO HA . . 4.130 2.616 2.483 2.959 . 0 0 "[ . 1 . 2]" 1
359 1 138 VAL HA 1 142 LEU HB2 . . 3.880 2.076 1.963 2.280 . 0 0 "[ . 1 . 2]" 1
360 1 144 THR HA 1 147 ARG H . . 3.720 3.509 3.443 3.634 . 0 0 "[ . 1 . 2]" 1
361 1 144 THR HA 1 147 ARG QB . . 3.360 2.250 2.122 2.606 . 0 0 "[ . 1 . 2]" 1
362 1 47 VAL HA 1 47 VAL QG . . 3.130 2.128 2.105 2.161 . 0 0 "[ . 1 . 2]" 1
363 1 138 VAL HA 1 142 LEU H . . 3.710 2.784 2.504 3.116 . 0 0 "[ . 1 . 2]" 1
364 1 47 VAL HA 1 50 VAL H . . 3.990 3.622 3.556 3.712 . 0 0 "[ . 1 . 2]" 1
365 1 47 VAL HA 1 50 VAL HB . . 3.560 2.974 2.856 3.108 . 0 0 "[ . 1 . 2]" 1
366 1 90 VAL HA 1 93 HIS H . . 3.820 3.611 3.465 3.726 . 0 0 "[ . 1 . 2]" 1
367 1 90 VAL HA 1 90 VAL MG1 . . 3.130 2.670 2.278 3.204 0.074 5 0 "[ . 1 . 2]" 1
368 1 118 ALA MB 1 124 PRO HA . . 4.540 3.498 3.155 3.866 . 0 0 "[ . 1 . 2]" 1
369 1 82 VAL HA 1 85 ASP HB2 . . 4.000 3.813 2.700 4.007 0.007 20 0 "[ . 1 . 2]" 1
370 1 82 VAL HA 1 85 ASP HB3 . . 4.000 3.120 2.838 4.044 0.044 12 0 "[ . 1 . 2]" 1
371 1 94 ILE HA 1 94 ILE HG12 . . 3.480 2.898 2.609 2.991 . 0 0 "[ . 1 . 2]" 1
372 1 94 ILE HA 1 94 ILE HG13 . . 3.800 3.495 2.689 3.743 . 0 0 "[ . 1 . 2]" 1
373 1 140 LYS QB 1 141 THR HA . . 4.070 3.875 3.759 3.961 . 0 0 "[ . 1 . 2]" 1
374 1 32 SER H 1 32 SER QB . . 3.470 2.645 2.153 3.201 . 0 0 "[ . 1 . 2]" 1
375 1 79 SER HB2 1 80 GLU H . . 3.940 3.069 2.243 3.898 . 0 0 "[ . 1 . 2]" 1
376 1 79 SER H 1 79 SER HB2 . . 3.970 2.781 2.196 3.337 . 0 0 "[ . 1 . 2]" 1
377 1 79 SER HB2 1 82 VAL H . . 3.980 2.958 2.295 3.993 0.013 20 0 "[ . 1 . 2]" 1
378 1 79 SER HB3 1 82 VAL H . . 3.980 3.204 2.346 4.007 0.027 16 0 "[ . 1 . 2]" 1
379 1 79 SER H 1 79 SER HB3 . . 3.970 3.575 3.201 3.807 . 0 0 "[ . 1 . 2]" 1
380 1 79 SER HB3 1 80 GLU H . . 3.940 2.467 2.094 3.081 . 0 0 "[ . 1 . 2]" 1
381 1 30 SER QB 1 31 TRP H . . 3.590 3.108 2.012 3.811 0.221 17 0 "[ . 1 . 2]" 1
382 1 153 THR HA 1 153 THR MG . . 3.380 2.351 1.975 3.187 . 0 0 "[ . 1 . 2]" 1
383 1 47 VAL QG 1 153 THR HA . . 3.170 3.032 2.247 3.227 0.057 8 0 "[ . 1 . 2]" 1
384 1 153 THR HA 1 156 LEU H . . 3.660 3.377 3.186 3.665 0.005 2 0 "[ . 1 . 2]" 1
385 1 108 TYR HA 1 108 TYR QD . . 3.880 2.328 1.983 3.051 . 0 0 "[ . 1 . 2]" 1
386 1 96 SER H 1 96 SER HB2 . . 3.220 2.595 2.071 3.076 . 0 0 "[ . 1 . 2]" 1
387 1 93 HIS HA 1 96 SER HB2 . . 3.970 3.107 2.273 3.750 . 0 0 "[ . 1 . 2]" 1
388 1 96 SER H 1 96 SER HB3 . . 3.220 2.613 2.121 3.333 0.113 17 0 "[ . 1 . 2]" 1
389 1 64 SER H 1 64 SER HB2 . . 3.720 2.420 2.072 2.819 . 0 0 "[ . 1 . 2]" 1
390 1 106 SER H 1 106 SER QB . . 3.560 2.199 2.049 2.761 . 0 0 "[ . 1 . 2]" 1
391 1 64 SER H 1 64 SER HB3 . . 3.720 3.092 2.291 3.592 . 0 0 "[ . 1 . 2]" 1
392 1 61 ILE HA 1 61 ILE HG12 . . 4.070 2.875 2.719 3.099 . 0 0 "[ . 1 . 2]" 1
393 1 61 ILE HA 1 61 ILE HG13 . . 4.070 2.850 2.587 3.705 . 0 0 "[ . 1 . 2]" 1
394 1 61 ILE HA 1 61 ILE MD . . 4.180 3.496 1.982 3.885 . 0 0 "[ . 1 . 2]" 1
395 1 137 PHE HA 1 140 LYS H . . 3.860 3.676 3.427 3.902 0.042 4 0 "[ . 1 . 2]" 1
396 1 137 PHE HA 1 137 PHE QD . . 3.330 2.720 2.462 2.862 . 0 0 "[ . 1 . 2]" 1
397 1 137 PHE HA 1 140 LYS QB . . 3.380 2.713 2.387 3.033 . 0 0 "[ . 1 . 2]" 1
398 1 95 PHE QD 1 99 ILE HA . . 3.500 2.549 1.958 3.371 . 0 0 "[ . 1 . 2]" 1
399 1 99 ILE HA 1 100 THR H . . 3.590 3.487 3.235 3.568 . 0 0 "[ . 1 . 2]" 1
400 1 99 ILE HA 1 99 ILE MD . . 4.060 3.565 3.199 3.896 . 0 0 "[ . 1 . 2]" 1
401 1 145 TRP HA 1 148 ARG QB . . 3.360 3.346 3.133 3.439 0.079 15 0 "[ . 1 . 2]" 1
402 1 145 TRP HA 1 145 TRP HD1 . . 3.820 2.841 2.622 3.045 . 0 0 "[ . 1 . 2]" 1
403 1 145 TRP HA 1 148 ARG QD . . 3.290 2.313 1.896 2.789 . 0 0 "[ . 1 . 2]" 1
404 1 4 THR HA 1 5 ASP H . . 3.650 3.485 2.777 3.570 . 0 0 "[ . 1 . 2]" 1
405 1 4 THR HA 1 4 THR MG . . 3.270 2.233 1.961 3.199 . 0 0 "[ . 1 . 2]" 1
406 1 19 TYR HA 1 22 ALA H . . 3.950 3.630 3.495 3.923 . 0 0 "[ . 1 . 2]" 1
407 1 19 TYR HA 1 52 LEU MD1 . . 3.960 3.499 2.097 4.173 0.213 19 0 "[ . 1 . 2]" 1
408 1 19 TYR HA 1 19 TYR QD . . 4.120 2.317 1.995 3.011 . 0 0 "[ . 1 . 2]" 1
409 1 19 TYR HA 1 52 LEU MD2 . . 3.960 2.612 1.894 4.063 0.103 17 0 "[ . 1 . 2]" 1
410 1 101 TRP HZ3 1 152 TRP HA . . 3.650 3.495 2.975 3.771 0.121 5 0 "[ . 1 . 2]" 1
411 1 101 TRP HH2 1 152 TRP HA . . 3.460 1.987 1.935 2.085 . 0 0 "[ . 1 . 2]" 1
412 1 101 TRP HZ2 1 152 TRP HA . . 4.350 3.336 2.995 3.751 . 0 0 "[ . 1 . 2]" 1
413 1 87 PHE HA 1 89 ALA H . . 4.490 4.473 4.272 4.514 0.024 18 0 "[ . 1 . 2]" 1
414 1 87 PHE HA 1 87 PHE QD . . 3.390 2.663 2.526 2.846 . 0 0 "[ . 1 . 2]" 1
415 1 47 VAL QG 1 152 TRP HA . . 4.060 3.628 3.370 3.818 . 0 0 "[ . 1 . 2]" 1
416 1 75 ILE HA 1 75 ILE MG . . 3.520 3.197 3.176 3.202 . 0 0 "[ . 1 . 2]" 1
417 1 75 ILE HA 1 76 SER H . . 3.460 3.526 3.505 3.535 0.075 16 0 "[ . 1 . 2]" 1
418 1 120 ARG HA 1 120 ARG QG . . 3.390 2.215 2.023 2.487 . 0 0 "[ . 1 . 2]" 1
419 1 6 LYS HA 1 9 VAL HB . . 3.190 2.656 2.340 3.003 . 0 0 "[ . 1 . 2]" 1
420 1 80 GLU HA 1 129 ALA MB . . 3.760 3.642 3.446 3.775 0.015 7 0 "[ . 1 . 2]" 1
421 1 139 ARG HA 1 139 ARG QG . . 3.070 2.886 2.337 3.270 0.200 17 0 "[ . 1 . 2]" 1
422 1 40 VAL HA 1 40 VAL MG1 . . 3.670 3.036 2.099 3.200 . 0 0 "[ . 1 . 2]" 1
423 1 21 HIS HA 1 24 LEU H . . 3.920 3.672 3.452 3.840 . 0 0 "[ . 1 . 2]" 1
424 1 21 HIS HA 1 21 HIS HD2 . . 4.260 3.617 2.803 4.226 . 0 0 "[ . 1 . 2]" 1
425 1 53 ARG HA 1 56 ASP H . . 4.100 3.725 3.493 4.006 . 0 0 "[ . 1 . 2]" 1
426 1 53 ARG HA 1 56 ASP HB2 . . 3.820 3.227 2.303 3.779 . 0 0 "[ . 1 . 2]" 1
427 1 53 ARG HA 1 56 ASP HB3 . . 3.820 2.800 2.296 3.777 . 0 0 "[ . 1 . 2]" 1
428 1 87 PHE HZ 1 134 LEU HA . . 3.890 3.605 3.292 3.910 0.020 9 0 "[ . 1 . 2]" 1
429 1 7 GLU HA 1 10 ALA MB . . 3.440 3.176 2.875 3.492 0.052 9 0 "[ . 1 . 2]" 1
430 1 46 GLU HA 1 49 ALA MB . . 3.290 2.848 2.672 3.005 . 0 0 "[ . 1 . 2]" 1
431 1 26 ARG HA 1 26 ARG QD . . 3.420 3.248 2.405 3.611 0.191 7 0 "[ . 1 . 2]" 1
432 1 11 GLN HA 1 44 LEU HG . . 3.790 3.294 2.709 3.812 0.022 1 0 "[ . 1 . 2]" 1
433 1 11 GLN HA 1 44 LEU MD2 . . 3.910 2.011 1.875 2.525 . 0 0 "[ . 1 . 2]" 1
434 1 94 ILE MG 1 103 LYS HA . . 4.210 4.128 3.880 4.231 0.021 3 0 "[ . 1 . 2]" 1
435 1 100 THR HA 1 101 TRP H . . 3.280 2.420 2.332 2.688 . 0 0 "[ . 1 . 2]" 1
436 1 100 THR HA 1 145 TRP HZ2 . . 4.610 2.496 1.923 2.833 . 0 0 "[ . 1 . 2]" 1
437 1 100 THR HA 1 100 THR MG . . 3.550 2.591 2.084 3.191 . 0 0 "[ . 1 . 2]" 1
438 1 95 PHE HA 1 96 SER H . . 3.550 3.435 3.383 3.514 . 0 0 "[ . 1 . 2]" 1
439 1 94 ILE MG 1 95 PHE HA . . 3.880 3.527 3.281 3.732 . 0 0 "[ . 1 . 2]" 1
440 1 95 PHE HA 1 95 PHE QD . . 3.350 2.923 2.078 3.049 . 0 0 "[ . 1 . 2]" 1
441 1 93 HIS HA 1 96 SER HB3 . . 3.970 3.165 2.464 3.991 0.021 14 0 "[ . 1 . 2]" 1
442 1 8 LEU HA 1 152 TRP HE1 . . 4.300 3.320 2.760 3.898 . 0 0 "[ . 1 . 2]" 1
443 1 8 LEU HA 1 8 LEU MD1 . . 4.020 3.469 2.070 3.849 . 0 0 "[ . 1 . 2]" 1
444 1 66 TYR HA 1 66 TYR QD . . 3.670 2.148 2.004 2.282 . 0 0 "[ . 1 . 2]" 1
445 1 136 GLU HA 1 139 ARG QB . . 3.780 3.250 2.834 3.871 0.091 17 0 "[ . 1 . 2]" 1
446 1 140 LYS HA 1 140 LYS HG3 . . 3.700 3.584 2.940 3.741 0.041 19 0 "[ . 1 . 2]" 1
447 1 51 LEU HA 1 51 LEU MD2 . . 4.480 2.647 2.368 3.604 . 0 0 "[ . 1 . 2]" 1
448 1 30 SER HA 1 31 TRP H . . 3.150 2.376 2.138 3.545 0.395 7 0 "[ . 1 . 2]" 1
449 1 85 ASP HA 1 88 LEU H . . 3.800 3.788 3.730 3.840 0.040 15 0 "[ . 1 . 2]" 1
450 1 131 VAL QG 1 132 ASP HA . . 4.540 3.337 3.235 3.441 . 0 0 "[ . 1 . 2]" 1
451 1 5 ASP HA 1 7 GLU H . . 4.090 4.007 3.660 4.122 0.032 16 0 "[ . 1 . 2]" 1
452 1 5 ASP HA 1 8 LEU H . . 3.810 3.333 3.195 3.538 . 0 0 "[ . 1 . 2]" 1
453 1 25 LEU HA 1 25 LEU HG . . 3.160 2.482 2.134 2.665 . 0 0 "[ . 1 . 2]" 1
454 1 19 TYR QE 1 52 LEU HA . . 3.770 2.974 1.942 3.763 . 0 0 "[ . 1 . 2]" 1
455 1 130 LEU HA 1 130 LEU MD1 . . 4.340 3.876 3.838 3.920 . 0 0 "[ . 1 . 2]" 1
456 1 130 LEU HA 1 133 ALA H . . 3.760 3.566 3.472 3.646 . 0 0 "[ . 1 . 2]" 1
457 1 87 PHE QD 1 130 LEU HA . . 4.070 3.891 3.540 4.087 0.017 2 0 "[ . 1 . 2]" 1
458 1 76 SER HA 1 77 LEU H . . 3.190 2.296 2.196 2.427 . 0 0 "[ . 1 . 2]" 1
459 1 154 ASP HA 1 156 LEU H . . 4.150 3.725 3.545 4.015 . 0 0 "[ . 1 . 2]" 1
460 1 60 MET HA 1 60 MET HG3 . . 3.890 3.065 2.576 3.754 . 0 0 "[ . 1 . 2]" 1
461 1 15 LEU HA 1 15 LEU HG . . 3.630 3.068 2.812 3.653 0.023 19 0 "[ . 1 . 2]" 1
462 1 15 LEU HA 1 15 LEU MD2 . . 4.060 2.200 1.948 2.621 . 0 0 "[ . 1 . 2]" 1
463 1 130 LEU HA 1 130 LEU HG . . 3.990 2.954 2.832 3.046 . 0 0 "[ . 1 . 2]" 1
464 1 88 LEU HA 1 88 LEU HG . . 3.460 2.441 2.349 2.692 . 0 0 "[ . 1 . 2]" 1
465 1 87 PHE QE 1 88 LEU HA . . 4.350 4.354 4.220 4.405 0.055 14 0 "[ . 1 . 2]" 1
466 1 88 LEU HA 1 91 ALA MB . . 3.520 2.461 2.394 2.555 . 0 0 "[ . 1 . 2]" 1
467 1 145 TRP HE3 1 146 LEU HA . . 3.840 3.218 2.699 3.755 . 0 0 "[ . 1 . 2]" 1
468 1 146 LEU HA 1 146 LEU HG . . 4.150 3.379 2.468 3.669 . 0 0 "[ . 1 . 2]" 1
469 1 78 GLN HA 1 78 GLN HE22 . . 4.650 3.033 2.269 3.997 . 0 0 "[ . 1 . 2]" 1
470 1 44 LEU HA 1 47 VAL H . . 3.620 3.653 3.562 3.723 0.103 15 0 "[ . 1 . 2]" 1
471 1 44 LEU HA 1 47 VAL HB . . 3.280 3.096 2.766 3.304 0.024 20 0 "[ . 1 . 2]" 1
472 1 44 LEU HA 1 47 VAL QG . . 3.420 3.170 2.907 3.447 0.027 15 0 "[ . 1 . 2]" 1
473 1 23 ARG HA 1 23 ARG QD . . 3.800 2.631 2.034 3.693 . 0 0 "[ . 1 . 2]" 1
474 1 157 LYS HA 1 157 LYS QG . . 3.210 2.609 2.289 3.039 . 0 0 "[ . 1 . 2]" 1
475 1 157 LYS HA 1 158 CYS H . . 3.470 3.444 2.998 3.472 0.002 4 0 "[ . 1 . 2]" 1
476 1 126 MET HA 1 129 ALA H . . 3.380 3.482 3.456 3.504 0.124 20 0 "[ . 1 . 2]" 1
477 1 126 MET HA 1 129 ALA MB . . 3.300 2.260 2.048 2.488 . 0 0 "[ . 1 . 2]" 1
478 1 36 ARG HA 1 37 ALA H . . 3.160 2.758 2.474 3.518 0.358 20 0 "[ . 1 . 2]" 1
479 1 156 LEU HA 1 156 LEU MD1 . . 3.950 3.316 1.955 3.896 . 0 0 "[ . 1 . 2]" 1
480 1 156 LEU HA 1 156 LEU MD2 . . 3.950 2.537 1.964 3.837 . 0 0 "[ . 1 . 2]" 1
481 1 118 ALA HA 1 121 GLN H . . 4.000 3.321 3.198 3.543 . 0 0 "[ . 1 . 2]" 1
482 1 88 LEU MD2 1 133 ALA HA . . 4.400 3.365 2.997 3.881 . 0 0 "[ . 1 . 2]" 1
483 1 73 LEU HA 1 73 LEU HG . . 4.010 3.619 3.609 3.645 . 0 0 "[ . 1 . 2]" 1
484 1 129 ALA HA 1 132 ASP QB . . 3.140 2.774 2.671 2.879 . 0 0 "[ . 1 . 2]" 1
485 1 91 ALA HA 1 93 HIS H . . 4.610 4.226 4.119 4.429 . 0 0 "[ . 1 . 2]" 1
486 1 91 ALA HA 1 94 ILE HB . . 3.470 3.429 3.250 3.491 0.021 2 0 "[ . 1 . 2]" 1
487 1 89 ALA HA 1 90 VAL HA . . 4.820 4.796 4.784 4.808 . 0 0 "[ . 1 . 2]" 1
488 1 149 ARG HA 1 149 ARG HG3 . . 3.940 3.538 3.435 3.672 . 0 0 "[ . 1 . 2]" 1
489 1 149 ARG HA 1 149 ARG HE . . 3.820 3.625 3.286 3.823 0.003 6 0 "[ . 1 . 2]" 1
490 1 20 VAL MG1 1 112 ALA HA . . 3.500 2.989 2.887 3.126 . 0 0 "[ . 1 . 2]" 1
491 1 49 ALA HA 1 52 LEU H . . 3.820 3.413 3.324 3.814 . 0 0 "[ . 1 . 2]" 1
492 1 12 ALA HA 1 152 TRP HZ2 . . 3.900 3.712 3.563 3.882 . 0 0 "[ . 1 . 2]" 1
493 1 68 ASN HA 1 71 ARG QB . . 3.910 3.545 3.285 3.950 0.040 14 0 "[ . 1 . 2]" 1
494 1 77 LEU HA 1 78 GLN H . . 3.350 3.266 2.676 3.432 0.082 18 0 "[ . 1 . 2]" 1
495 1 77 LEU HA 1 126 MET ME . . 4.600 3.142 2.590 3.523 . 0 0 "[ . 1 . 2]" 1
496 1 77 LEU HA 1 79 SER H . . 4.010 3.594 3.375 4.020 0.010 2 0 "[ . 1 . 2]" 1
497 1 29 LEU HA 1 29 LEU MD2 . . 4.150 3.581 2.373 4.091 . 0 0 "[ . 1 . 2]" 1
498 1 123 GLN HA 1 125 ALA H . . 3.880 3.049 3.035 3.101 . 0 0 "[ . 1 . 2]" 1
499 1 123 GLN HA 1 124 PRO QG . . 5.000 4.007 3.959 4.035 . 0 0 "[ . 1 . 2]" 1
500 1 122 ALA HA 1 123 GLN HA . . 4.370 4.312 4.303 4.341 . 0 0 "[ . 1 . 2]" 1
501 1 122 ALA HA 1 123 GLN H . . 3.380 2.551 2.512 2.637 . 0 0 "[ . 1 . 2]" 1
502 1 37 ALA HA 1 38 ALA H . . 3.160 2.579 2.287 2.722 . 0 0 "[ . 1 . 2]" 1
503 1 38 ALA HA 1 39 PRO QG . . 5.070 4.069 4.011 4.094 . 0 0 "[ . 1 . 2]" 1
504 1 33 ALA HA 1 34 PRO QD . . 3.780 2.143 1.860 2.231 . 0 0 "[ . 1 . 2]" 1
505 1 33 ALA HA 1 34 PRO QG . . 4.840 4.060 3.771 4.152 . 0 0 "[ . 1 . 2]" 1
506 1 123 GLN HA 1 124 PRO HD2 . . 3.300 2.201 2.136 2.239 . 0 0 "[ . 1 . 2]" 1
507 1 124 PRO HD2 1 125 ALA H . . 4.210 2.839 2.758 2.852 . 0 0 "[ . 1 . 2]" 1
508 1 38 ALA HA 1 39 PRO HD2 . . 3.130 2.504 2.415 2.541 . 0 0 "[ . 1 . 2]" 1
509 1 31 TRP HZ2 1 34 PRO QD . . 4.240 2.536 1.960 3.868 . 0 0 "[ . 1 . 2]" 1
510 1 38 ALA HA 1 39 PRO HD3 . . 3.130 2.345 2.305 2.365 . 0 0 "[ . 1 . 2]" 1
511 1 124 PRO HD3 1 125 ALA H . . 4.210 3.944 3.902 3.951 . 0 0 "[ . 1 . 2]" 1
512 1 123 GLN HA 1 124 PRO HD3 . . 3.300 3.074 2.993 3.119 . 0 0 "[ . 1 . 2]" 1
513 1 135 GLY HA2 1 138 VAL HB . . 4.150 2.587 2.453 2.657 . 0 0 "[ . 1 . 2]" 1
514 1 135 GLY HA3 1 138 VAL HB . . 4.150 4.195 4.085 4.229 0.079 3 0 "[ . 1 . 2]" 1
515 1 16 GLY HA2 1 108 TYR QE . . 3.550 3.171 2.622 3.551 0.001 6 0 "[ . 1 . 2]" 1
516 1 113 GLY QA 1 116 VAL MG1 . . 4.120 4.006 3.489 4.161 0.041 6 0 "[ . 1 . 2]" 1
517 1 16 GLY HA3 1 108 TYR QE . . 3.550 3.201 2.355 3.576 0.026 7 0 "[ . 1 . 2]" 1
518 1 16 GLY HA3 1 108 TYR QD . . 4.350 4.051 3.628 4.366 0.016 13 0 "[ . 1 . 2]" 1
519 1 42 GLY HA2 1 45 ALA MB . . 4.520 2.679 2.298 3.004 . 0 0 "[ . 1 . 2]" 1
520 1 92 GLY QA 1 137 PHE QD . . 4.040 3.807 3.648 4.052 0.012 18 0 "[ . 1 . 2]" 1
521 1 102 GLY QA 1 105 VAL HB . . 4.010 3.124 2.871 3.392 . 0 0 "[ . 1 . 2]" 1
522 1 113 GLY QA 1 116 VAL MG2 . . 4.120 2.587 2.035 3.081 . 0 0 "[ . 1 . 2]" 1
523 1 42 GLY HA3 1 45 ALA MB . . 4.520 4.139 3.762 4.403 . 0 0 "[ . 1 . 2]" 1
524 1 138 VAL HA 1 142 LEU HB3 . . 3.880 3.652 3.533 3.834 . 0 0 "[ . 1 . 2]" 1
525 1 98 GLY HA2 1 99 ILE H . . 3.520 2.185 2.138 2.403 . 0 0 "[ . 1 . 2]" 1
526 1 98 GLY HA3 1 99 ILE H . . 3.520 3.300 2.991 3.546 0.026 15 0 "[ . 1 . 2]" 1
527 1 146 LEU H 1 146 LEU HB2 . . 3.680 2.315 2.057 2.385 . 0 0 "[ . 1 . 2]" 1
528 1 29 LEU H 1 29 LEU HB2 . . 4.160 3.738 2.220 4.047 . 0 0 "[ . 1 . 2]" 1
529 1 29 LEU H 1 29 LEU HB3 . . 4.160 3.544 3.087 4.023 . 0 0 "[ . 1 . 2]" 1
530 1 146 LEU H 1 146 LEU HB3 . . 3.680 3.547 3.342 3.575 . 0 0 "[ . 1 . 2]" 1
531 1 151 GLY HA2 1 152 TRP H . . 3.510 2.581 2.532 2.625 . 0 0 "[ . 1 . 2]" 1
532 1 120 ARG HB3 1 120 ARG QD . . 3.680 2.540 2.189 3.005 . 0 0 "[ . 1 . 2]" 1
533 1 81 ARG QD 1 82 VAL H . . 3.650 3.211 1.921 3.662 0.012 9 0 "[ . 1 . 2]" 1
534 1 36 ARG QD 1 37 ALA H . . 3.920 3.235 2.158 3.937 0.017 8 0 "[ . 1 . 2]" 1
535 1 26 ARG QB 1 26 ARG QD . . 3.170 2.376 2.073 2.798 . 0 0 "[ . 1 . 2]" 1
536 1 148 ARG QB 1 148 ARG QD . . 2.470 2.091 1.973 2.339 . 0 0 "[ . 1 . 2]" 1
537 1 148 ARG H 1 148 ARG QD . . 3.980 3.621 3.337 3.895 . 0 0 "[ . 1 . 2]" 1
538 1 144 THR MG 1 148 ARG QD . . 3.470 3.160 2.676 3.501 0.031 9 0 "[ . 1 . 2]" 1
539 1 148 ARG QD 1 149 ARG HG3 . . 3.850 3.872 3.814 3.923 0.073 10 0 "[ . 1 . 2]" 1
540 1 101 TRP HE1 1 154 ASP HB3 . . 4.590 2.366 1.963 3.071 . 0 0 "[ . 1 . 2]" 1
541 1 29 LEU HB3 1 30 SER H . . 4.160 3.279 2.010 4.001 . 0 0 "[ . 1 . 2]" 1
542 1 80 GLU H 1 81 ARG QD . . 3.630 3.130 2.647 3.779 0.149 2 0 "[ . 1 . 2]" 1
543 1 81 ARG HA 1 81 ARG QD . . 4.080 3.793 3.635 3.975 . 0 0 "[ . 1 . 2]" 1
544 1 81 ARG H 1 81 ARG QD . . 3.290 2.260 1.865 3.309 0.019 8 0 "[ . 1 . 2]" 1
545 1 6 LYS HB3 1 6 LYS QE . . 4.070 3.205 1.970 3.662 . 0 0 "[ . 1 . 2]" 1
546 1 8 LEU HB2 1 139 ARG QB . . 4.210 3.616 3.020 4.295 0.085 20 0 "[ . 1 . 2]" 1
547 1 114 LEU H 1 114 LEU HB2 . . 3.670 2.313 2.184 2.807 . 0 0 "[ . 1 . 2]" 1
548 1 8 LEU H 1 8 LEU HB3 . . 3.880 3.499 3.131 3.593 . 0 0 "[ . 1 . 2]" 1
549 1 8 LEU HB3 1 139 ARG QB . . 4.210 3.904 2.895 4.268 0.058 9 0 "[ . 1 . 2]" 1
550 1 114 LEU HB3 1 115 ALA H . . 4.170 3.349 3.166 3.797 . 0 0 "[ . 1 . 2]" 1
551 1 114 LEU H 1 114 LEU HB3 . . 3.670 3.539 3.496 3.581 . 0 0 "[ . 1 . 2]" 1
552 1 130 LEU H 1 130 LEU HB3 . . 3.740 3.572 3.539 3.588 . 0 0 "[ . 1 . 2]" 1
553 1 140 LYS HA 1 140 LYS QE . . 3.860 3.438 2.007 3.887 0.027 17 0 "[ . 1 . 2]" 1
554 1 54 LEU H 1 54 LEU HB2 . . 3.760 2.243 2.130 2.321 . 0 0 "[ . 1 . 2]" 1
555 1 131 VAL HA 1 134 LEU HB2 . . 4.020 3.208 2.904 3.721 . 0 0 "[ . 1 . 2]" 1
556 1 25 LEU H 1 25 LEU HB2 . . 3.400 2.089 2.041 2.156 . 0 0 "[ . 1 . 2]" 1
557 1 95 PHE QE 1 107 LEU HB2 . . 3.900 2.598 1.996 3.935 0.035 18 0 "[ . 1 . 2]" 1
558 1 95 PHE HZ 1 107 LEU HB2 . . 3.600 3.270 2.233 3.610 0.010 19 0 "[ . 1 . 2]" 1
559 1 95 PHE QE 1 107 LEU HB3 . . 3.900 3.572 3.085 3.936 0.036 8 0 "[ . 1 . 2]" 1
560 1 95 PHE HZ 1 107 LEU HB3 . . 3.600 3.083 2.470 3.609 0.009 8 0 "[ . 1 . 2]" 1
561 1 25 LEU HB2 1 26 ARG H . . 3.860 3.483 3.051 3.658 . 0 0 "[ . 1 . 2]" 1
562 1 15 LEU HB2 1 108 TYR QE . . 4.290 3.234 1.990 4.331 0.041 8 0 "[ . 1 . 2]" 1
563 1 52 LEU H 1 52 LEU HB2 . . 3.670 2.229 2.105 2.633 . 0 0 "[ . 1 . 2]" 1
564 1 131 VAL HA 1 134 LEU HB3 . . 4.020 3.181 2.718 3.731 . 0 0 "[ . 1 . 2]" 1
565 1 134 LEU H 1 134 LEU HB3 . . 3.410 2.911 2.560 3.314 . 0 0 "[ . 1 . 2]" 1
566 1 25 LEU HB3 1 26 ARG H . . 3.860 3.144 2.609 3.436 . 0 0 "[ . 1 . 2]" 1
567 1 25 LEU H 1 25 LEU HB3 . . 3.400 3.140 2.991 3.347 . 0 0 "[ . 1 . 2]" 1
568 1 54 LEU HB3 1 105 VAL MG1 . . 4.950 2.400 2.191 2.488 . 0 0 "[ . 1 . 2]" 1
569 1 54 LEU HB2 1 105 VAL MG1 . . 4.950 2.936 2.338 3.225 . 0 0 "[ . 1 . 2]" 1
570 1 54 LEU H 1 54 LEU HB3 . . 3.760 3.523 3.452 3.556 . 0 0 "[ . 1 . 2]" 1
571 1 51 LEU H 1 51 LEU HB3 . . 3.780 3.581 3.530 3.588 . 0 0 "[ . 1 . 2]" 1
572 1 15 LEU HB3 1 108 TYR QE . . 4.290 3.494 2.476 4.199 . 0 0 "[ . 1 . 2]" 1
573 1 15 LEU HB3 1 16 GLY H . . 4.150 3.309 3.081 3.812 . 0 0 "[ . 1 . 2]" 1
574 1 117 ASP H 1 117 ASP HB2 . . 3.550 2.093 2.067 2.156 . 0 0 "[ . 1 . 2]" 1
575 1 101 TRP HE1 1 149 ARG HD2 . . 4.500 3.612 3.394 3.829 . 0 0 "[ . 1 . 2]" 1
576 1 101 TRP HZ2 1 149 ARG HD2 . . 4.210 3.721 3.335 4.206 . 0 0 "[ . 1 . 2]" 1
577 1 85 ASP HA 1 88 LEU HB2 . . 3.910 2.688 2.583 2.769 . 0 0 "[ . 1 . 2]" 1
578 1 88 LEU H 1 88 LEU HB2 . . 3.630 2.162 2.128 2.226 . 0 0 "[ . 1 . 2]" 1
579 1 101 TRP HZ2 1 149 ARG HD3 . . 4.210 2.115 1.979 2.473 . 0 0 "[ . 1 . 2]" 1
580 1 44 LEU H 1 44 LEU HB3 . . 3.560 3.419 3.267 3.510 . 0 0 "[ . 1 . 2]" 1
581 1 88 LEU H 1 88 LEU HB3 . . 3.630 3.478 3.451 3.519 . 0 0 "[ . 1 . 2]" 1
582 1 85 ASP HA 1 88 LEU HB3 . . 3.910 3.978 3.949 4.037 0.127 20 0 "[ . 1 . 2]" 1
583 1 88 LEU HB3 1 89 ALA H . . 4.220 3.153 3.026 3.348 . 0 0 "[ . 1 . 2]" 1
584 1 117 ASP HB2 1 118 ALA H . . 3.990 3.201 2.687 3.498 . 0 0 "[ . 1 . 2]" 1
585 1 114 LEU HA 1 117 ASP HB2 . . 3.950 3.027 2.611 3.389 . 0 0 "[ . 1 . 2]" 1
586 1 114 LEU HA 1 117 ASP HB3 . . 3.950 3.785 3.322 3.963 0.013 9 0 "[ . 1 . 2]" 1
587 1 117 ASP HB3 1 118 ALA H . . 3.990 2.765 2.363 3.118 . 0 0 "[ . 1 . 2]" 1
588 1 24 LEU HB2 1 25 LEU H . . 4.000 3.959 3.745 4.043 0.043 16 0 "[ . 1 . 2]" 1
589 1 24 LEU H 1 24 LEU HB2 . . 4.100 2.915 2.631 3.047 . 0 0 "[ . 1 . 2]" 1
590 1 70 ALA HA 1 75 ILE HB . . 3.850 3.225 2.842 3.539 . 0 0 "[ . 1 . 2]" 1
591 1 77 LEU H 1 77 LEU HB2 . . 3.610 3.579 3.558 3.609 . 0 0 "[ . 1 . 2]" 1
592 1 24 LEU H 1 24 LEU HB3 . . 4.100 2.178 2.111 2.383 . 0 0 "[ . 1 . 2]" 1
593 1 24 LEU HB3 1 25 LEU H . . 4.000 2.644 2.350 2.773 . 0 0 "[ . 1 . 2]" 1
594 1 19 TYR H 1 19 TYR HB2 . . 3.370 2.193 2.065 2.428 . 0 0 "[ . 1 . 2]" 1
595 1 56 ASP H 1 56 ASP HB3 . . 3.500 2.829 2.427 3.507 0.007 19 0 "[ . 1 . 2]" 1
596 1 77 LEU H 1 77 LEU HB3 . . 3.610 2.729 2.565 2.844 . 0 0 "[ . 1 . 2]" 1
597 1 5 ASP HB2 1 6 LYS H . . 4.220 3.575 3.063 3.885 . 0 0 "[ . 1 . 2]" 1
598 1 129 ALA MB 1 132 ASP QB . . 4.340 4.145 4.075 4.225 . 0 0 "[ . 1 . 2]" 1
599 1 132 ASP QB 1 133 ALA H . . 3.300 2.507 2.429 2.659 . 0 0 "[ . 1 . 2]" 1
600 1 5 ASP H 1 5 ASP HB3 . . 3.840 2.924 2.522 3.331 . 0 0 "[ . 1 . 2]" 1
601 1 5 ASP HB3 1 6 LYS H . . 4.220 3.750 3.036 4.213 . 0 0 "[ . 1 . 2]" 1
602 1 99 ILE H 1 99 ILE HB . . 3.670 2.556 2.357 2.764 . 0 0 "[ . 1 . 2]" 1
603 1 136 GLU QB 1 137 PHE QB . . 4.190 3.933 3.764 4.204 0.014 7 0 "[ . 1 . 2]" 1
604 1 87 PHE H 1 87 PHE HB2 . . 3.260 2.640 2.596 2.680 . 0 0 "[ . 1 . 2]" 1
605 1 87 PHE H 1 87 PHE HB3 . . 3.260 2.424 2.387 2.464 . 0 0 "[ . 1 . 2]" 1
606 1 66 TYR H 1 66 TYR HB3 . . 4.000 3.644 3.485 4.008 0.008 4 0 "[ . 1 . 2]" 1
607 1 61 ILE HB 1 62 ARG H . . 3.710 2.134 2.019 2.201 . 0 0 "[ . 1 . 2]" 1
608 1 61 ILE HB 1 61 ILE MD . . 3.550 2.372 2.053 3.218 . 0 0 "[ . 1 . 2]" 1
609 1 95 PHE H 1 95 PHE HB2 . . 3.890 2.270 2.224 2.372 . 0 0 "[ . 1 . 2]" 1
610 1 66 TYR H 1 66 TYR HB2 . . 4.000 2.472 2.186 3.173 . 0 0 "[ . 1 . 2]" 1
611 1 68 ASN QB 1 69 VAL H . . 4.050 3.181 2.983 4.056 0.006 14 0 "[ . 1 . 2]" 1
612 1 68 ASN H 1 68 ASN QB . . 3.300 2.553 2.163 3.099 . 0 0 "[ . 1 . 2]" 1
613 1 67 ARG QG 1 68 ASN QB . . 3.800 3.539 2.965 4.019 0.219 19 0 "[ . 1 . 2]" 1
614 1 94 ILE HB 1 95 PHE QD . . 4.380 2.595 2.393 4.225 . 0 0 "[ . 1 . 2]" 1
615 1 94 ILE HB 1 94 ILE MD . . 3.530 3.002 2.293 3.229 . 0 0 "[ . 1 . 2]" 1
616 1 94 ILE H 1 94 ILE HB . . 3.300 2.492 2.461 2.538 . 0 0 "[ . 1 . 2]" 1
617 1 108 TYR HB3 1 109 ALA H . . 3.840 3.101 2.924 3.308 . 0 0 "[ . 1 . 2]" 1
618 1 7 GLU QG 1 8 LEU H . . 3.740 3.623 1.870 3.777 0.037 6 0 "[ . 1 . 2]" 1
619 1 7 GLU HA 1 7 GLU QG . . 3.230 2.695 2.429 3.357 0.127 18 0 "[ . 1 . 2]" 1
620 1 57 GLU HA 1 57 GLU QG . . 3.860 2.157 2.081 2.293 . 0 0 "[ . 1 . 2]" 1
621 1 57 GLU H 1 57 GLU QG . . 3.970 3.915 3.778 3.986 0.016 1 0 "[ . 1 . 2]" 1
622 1 57 GLU QG 1 60 MET QB . . 3.630 3.690 3.629 3.749 0.119 18 0 "[ . 1 . 2]" 1
623 1 46 GLU H 1 46 GLU QG . . 3.800 2.705 2.398 3.215 . 0 0 "[ . 1 . 2]" 1
624 1 46 GLU HA 1 46 GLU QG . . 3.410 2.449 2.266 2.645 . 0 0 "[ . 1 . 2]" 1
625 1 45 ALA MB 1 46 GLU QG . . 4.620 3.556 3.286 4.031 . 0 0 "[ . 1 . 2]" 1
626 1 35 GLU QG 1 36 ARG H . . 4.150 3.878 2.304 4.317 0.167 10 0 "[ . 1 . 2]" 1
627 1 35 GLU H 1 35 GLU QG . . 3.220 3.064 2.313 3.353 0.133 16 0 "[ . 1 . 2]" 1
628 1 35 GLU HA 1 35 GLU QG . . 3.000 2.510 2.029 3.333 0.333 1 0 "[ . 1 . 2]" 1
629 1 18 GLU H 1 18 GLU HG2 . . 3.610 3.304 2.136 3.690 0.080 12 0 "[ . 1 . 2]" 1
630 1 136 GLU H 1 136 GLU QG . . 3.570 3.063 2.108 3.769 0.199 7 0 "[ . 1 . 2]" 1
631 1 136 GLU HA 1 136 GLU QG . . 3.590 2.331 2.060 3.294 . 0 0 "[ . 1 . 2]" 1
632 1 18 GLU H 1 18 GLU HG3 . . 3.610 3.385 2.648 3.657 0.047 15 0 "[ . 1 . 2]" 1
633 1 121 GLN HA 1 121 GLN HG2 . . 3.740 2.493 2.101 3.764 0.024 13 0 "[ . 1 . 2]" 1
634 1 72 GLN HA 1 72 GLN HG2 . . 3.780 3.269 3.184 3.331 . 0 0 "[ . 1 . 2]" 1
635 1 72 GLN H 1 72 GLN HG2 . . 3.840 2.016 1.941 2.134 . 0 0 "[ . 1 . 2]" 1
636 1 121 GLN HA 1 121 GLN HG3 . . 3.740 2.673 2.359 3.701 . 0 0 "[ . 1 . 2]" 1
637 1 72 GLN H 1 72 GLN HG3 . . 3.840 3.558 3.501 3.645 . 0 0 "[ . 1 . 2]" 1
638 1 121 GLN H 1 121 GLN HG2 . . 4.500 4.285 2.237 4.506 0.006 6 0 "[ . 1 . 2]" 1
639 1 121 GLN H 1 121 GLN HG3 . . 3.830 3.621 3.413 3.843 0.013 2 0 "[ . 1 . 2]" 1
640 1 78 GLN HA 1 78 GLN QG . . 3.230 2.322 2.008 3.109 . 0 0 "[ . 1 . 2]" 1
641 1 72 GLN HA 1 72 GLN HG3 . . 3.780 3.763 3.721 3.792 0.012 8 0 "[ . 1 . 2]" 1
642 1 118 ALA MB 1 126 MET HG2 . . 4.510 2.332 2.134 2.471 . 0 0 "[ . 1 . 2]" 1
643 1 126 MET H 1 126 MET HG2 . . 3.640 2.360 2.200 3.945 0.305 9 0 "[ . 1 . 2]" 1
644 1 126 MET HA 1 126 MET HG2 . . 3.800 3.053 2.949 3.575 . 0 0 "[ . 1 . 2]" 1
645 1 126 MET H 1 126 MET HG3 . . 3.640 3.659 3.482 3.703 0.063 14 0 "[ . 1 . 2]" 1
646 1 126 MET HA 1 126 MET HG3 . . 3.800 3.652 2.294 3.732 . 0 0 "[ . 1 . 2]" 1
647 1 118 ALA MB 1 126 MET HG3 . . 4.510 1.979 1.872 3.429 . 0 0 "[ . 1 . 2]" 1
648 1 140 LYS H 1 140 LYS QB . . 3.120 2.528 2.340 2.666 . 0 0 "[ . 1 . 2]" 1
649 1 140 LYS QB 1 142 LEU H . . 4.460 4.327 4.123 4.474 0.014 20 0 "[ . 1 . 2]" 1
650 1 103 LYS H 1 103 LYS HB2 . . 4.200 2.156 2.059 2.349 . 0 0 "[ . 1 . 2]" 1
651 1 60 MET H 1 60 MET QB . . 3.030 2.235 2.121 2.707 . 0 0 "[ . 1 . 2]" 1
652 1 41 PRO HB2 1 42 GLY H . . 3.900 2.065 1.938 2.460 . 0 0 "[ . 1 . 2]" 1
653 1 60 MET QB 1 61 ILE HA . . 4.050 3.887 3.809 3.947 . 0 0 "[ . 1 . 2]" 1
654 1 6 LYS HB2 1 6 LYS QE . . 4.070 3.813 3.349 3.958 . 0 0 "[ . 1 . 2]" 1
655 1 6 LYS H 1 6 LYS HB2 . . 3.590 2.553 2.261 3.582 . 0 0 "[ . 1 . 2]" 1
656 1 60 MET HA 1 60 MET HG2 . . 3.890 2.283 2.123 2.855 . 0 0 "[ . 1 . 2]" 1
657 1 60 MET H 1 60 MET HG2 . . 4.060 3.826 2.283 4.096 0.036 16 0 "[ . 1 . 2]" 1
658 1 60 MET H 1 60 MET HG3 . . 4.060 3.114 2.366 3.566 . 0 0 "[ . 1 . 2]" 1
659 1 123 GLN HA 1 123 GLN HG2 . . 4.000 3.298 2.107 3.771 . 0 0 "[ . 1 . 2]" 1
660 1 124 PRO QB 1 125 ALA H . . 3.830 3.584 3.500 3.597 . 0 0 "[ . 1 . 2]" 1
661 1 123 GLN HA 1 123 GLN HG3 . . 4.000 2.774 2.079 3.735 . 0 0 "[ . 1 . 2]" 1
662 1 39 PRO HB2 1 40 VAL H . . 3.860 2.543 2.025 3.352 . 0 0 "[ . 1 . 2]" 1
663 1 82 VAL H 1 82 VAL HB . . 3.140 2.543 2.407 2.667 . 0 0 "[ . 1 . 2]" 1
664 1 83 VAL HB 1 126 MET ME . . 3.190 3.248 3.122 3.316 0.126 15 0 "[ . 1 . 2]" 1
665 1 83 VAL H 1 83 VAL HB . . 3.170 2.616 2.295 2.722 . 0 0 "[ . 1 . 2]" 1
666 1 69 VAL H 1 69 VAL HB . . 3.740 2.582 2.531 2.648 . 0 0 "[ . 1 . 2]" 1
667 1 69 VAL HB 1 70 ALA H . . 3.880 3.944 3.913 3.979 0.099 8 0 "[ . 1 . 2]" 1
668 1 67 ARG H 1 67 ARG QB . . 3.590 3.147 2.212 3.444 . 0 0 "[ . 1 . 2]" 1
669 1 39 PRO HB3 1 40 VAL H . . 3.860 3.449 3.191 3.881 0.021 8 0 "[ . 1 . 2]" 1
670 1 126 MET H 1 126 MET HB3 . . 3.630 3.583 3.564 3.587 . 0 0 "[ . 1 . 2]" 1
671 1 31 TRP HB2 1 31 TRP HE3 . . 3.920 2.527 2.473 2.688 . 0 0 "[ . 1 . 2]" 1
672 1 31 TRP H 1 31 TRP HB2 . . 4.030 3.479 2.584 3.928 . 0 0 "[ . 1 . 2]" 1
673 1 31 TRP HB3 1 31 TRP HE3 . . 3.920 4.078 4.031 4.170 0.250 13 0 "[ . 1 . 2]" 1
674 1 31 TRP H 1 31 TRP HB3 . . 4.030 2.884 2.265 3.453 . 0 0 "[ . 1 . 2]" 1
675 1 101 TRP HA 1 104 VAL HB . . 4.420 3.110 2.498 4.643 0.223 19 0 "[ . 1 . 2]" 1
676 1 104 VAL H 1 104 VAL HB . . 3.400 2.563 2.098 3.547 0.147 19 0 "[ . 1 . 2]" 1
677 1 104 VAL HB 1 152 TRP HZ3 . . 3.520 3.601 3.497 3.680 0.160 12 0 "[ . 1 . 2]" 1
678 1 87 PHE QE 1 110 VAL HB . . 4.160 4.212 4.172 4.255 0.095 18 0 "[ . 1 . 2]" 1
679 1 47 VAL HB 1 48 ALA H . . 3.610 2.273 2.150 2.377 . 0 0 "[ . 1 . 2]" 1
680 1 126 MET H 1 126 MET HB2 . . 3.630 2.441 2.338 2.485 . 0 0 "[ . 1 . 2]" 1
681 1 90 VAL H 1 90 VAL HB . . 3.110 2.611 2.446 2.688 . 0 0 "[ . 1 . 2]" 1
682 1 87 PHE HA 1 90 VAL HB . . 4.190 3.553 3.025 4.255 0.065 4 0 "[ . 1 . 2]" 1
683 1 50 VAL HB 1 51 LEU H . . 3.750 2.511 2.345 2.588 . 0 0 "[ . 1 . 2]" 1
684 1 128 HIS HA 1 131 VAL HB . . 3.440 2.756 2.606 2.923 . 0 0 "[ . 1 . 2]" 1
685 1 127 VAL HB 1 128 HIS H . . 3.130 2.346 2.170 2.583 . 0 0 "[ . 1 . 2]" 1
686 1 155 VAL H 1 155 VAL HB . . 3.540 3.026 2.287 3.618 0.078 11 0 "[ . 1 . 2]" 1
687 1 120 ARG HB2 1 120 ARG QD . . 3.680 3.114 2.245 3.491 . 0 0 "[ . 1 . 2]" 1
688 1 120 ARG H 1 120 ARG HB2 . . 3.690 2.116 2.073 2.186 . 0 0 "[ . 1 . 2]" 1
689 1 120 ARG HB2 1 120 ARG HE . . 4.250 3.479 2.377 4.247 . 0 0 "[ . 1 . 2]" 1
690 1 78 GLN H 1 78 GLN HB2 . . 3.560 2.261 2.078 2.713 . 0 0 "[ . 1 . 2]" 1
691 1 120 ARG H 1 120 ARG HB3 . . 3.690 3.216 2.972 3.448 . 0 0 "[ . 1 . 2]" 1
692 1 81 ARG QB 1 81 ARG QD . . 3.170 2.121 1.967 2.398 . 0 0 "[ . 1 . 2]" 1
693 1 81 ARG H 1 81 ARG QB . . 3.130 2.575 2.314 2.657 . 0 0 "[ . 1 . 2]" 1
694 1 81 ARG QB 1 82 VAL H . . 3.730 3.192 2.229 3.590 . 0 0 "[ . 1 . 2]" 1
695 1 71 ARG H 1 71 ARG QB . . 3.110 2.211 2.058 2.247 . 0 0 "[ . 1 . 2]" 1
696 1 70 ALA MB 1 71 ARG QB . . 4.050 3.899 3.742 4.117 0.067 8 0 "[ . 1 . 2]" 1
697 1 36 ARG H 1 36 ARG HB2 . . 3.820 3.124 2.225 4.070 0.250 4 0 "[ . 1 . 2]" 1
698 1 71 ARG QB 1 72 GLN HE21 . . 4.300 3.554 3.287 3.908 . 0 0 "[ . 1 . 2]" 1
699 1 47 VAL QG 1 152 TRP HB2 . . 4.160 2.024 1.866 2.264 . 0 0 "[ . 1 . 2]" 1
700 1 152 TRP HB2 1 153 THR H . . 4.230 3.383 3.172 3.534 . 0 0 "[ . 1 . 2]" 1
701 1 101 TRP QB 1 102 GLY H . . 3.910 2.607 2.454 2.775 . 0 0 "[ . 1 . 2]" 1
702 1 47 VAL QG 1 152 TRP HB3 . . 4.160 1.870 1.704 2.066 . 0 0 "[ . 1 . 2]" 1
703 1 152 TRP H 1 152 TRP HB3 . . 3.980 3.592 3.556 3.624 . 0 0 "[ . 1 . 2]" 1
704 1 152 TRP HB3 1 153 THR H . . 4.230 4.106 3.871 4.264 0.034 12 0 "[ . 1 . 2]" 1
705 1 46 GLU QB 1 47 VAL QG . . 4.330 2.983 2.892 3.062 . 0 0 "[ . 1 . 2]" 1
706 1 69 VAL HA 1 72 GLN QB . . 3.740 2.931 2.719 3.365 . 0 0 "[ . 1 . 2]" 1
707 1 120 ARG HB2 1 121 GLN H . . 3.660 3.377 3.012 3.709 0.049 9 0 "[ . 1 . 2]" 1
708 1 7 GLU H 1 7 GLU QB . . 3.130 2.605 2.514 2.641 . 0 0 "[ . 1 . 2]" 1
709 1 18 GLU QB 1 19 TYR H . . 4.190 2.954 2.512 3.495 . 0 0 "[ . 1 . 2]" 1
710 1 18 GLU H 1 18 GLU QB . . 3.030 2.179 2.065 2.624 . 0 0 "[ . 1 . 2]" 1
711 1 17 ARG QB 1 131 VAL QG . . 3.820 2.862 2.448 3.608 . 0 0 "[ . 1 . 2]" 1
712 1 80 GLU H 1 80 GLU QB . . 3.460 2.410 2.297 2.545 . 0 0 "[ . 1 . 2]" 1
713 1 80 GLU QB 1 81 ARG H . . 3.640 2.506 2.212 2.765 . 0 0 "[ . 1 . 2]" 1
714 1 120 ARG HB3 1 121 GLN H . . 3.660 3.203 2.931 3.410 . 0 0 "[ . 1 . 2]" 1
715 1 147 ARG QB 1 147 ARG HE . . 4.150 3.491 2.521 4.223 0.073 13 0 "[ . 1 . 2]" 1
716 1 71 ARG QB 1 72 GLN HE22 . . 4.300 2.457 2.200 2.993 . 0 0 "[ . 1 . 2]" 1
717 1 36 ARG H 1 36 ARG HB3 . . 3.820 3.484 2.687 3.902 0.082 17 0 "[ . 1 . 2]" 1
718 1 145 TRP H 1 145 TRP HB2 . . 3.830 2.313 2.234 2.408 . 0 0 "[ . 1 . 2]" 1
719 1 145 TRP H 1 145 TRP HB3 . . 3.830 2.775 2.663 2.890 . 0 0 "[ . 1 . 2]" 1
720 1 57 GLU QB 1 58 LEU H . . 3.610 2.395 2.115 2.608 . 0 0 "[ . 1 . 2]" 1
721 1 136 GLU H 1 136 GLU QB . . 3.150 2.190 2.042 2.473 . 0 0 "[ . 1 . 2]" 1
722 1 57 GLU H 1 57 GLU QB . . 3.280 2.139 2.101 2.219 . 0 0 "[ . 1 . 2]" 1
723 1 72 GLN H 1 72 GLN QB . . 3.190 2.571 2.512 2.611 . 0 0 "[ . 1 . 2]" 1
724 1 149 ARG HB2 1 149 ARG HE . . 4.610 4.126 3.947 4.414 . 0 0 "[ . 1 . 2]" 1
725 1 149 ARG H 1 149 ARG HB2 . . 4.140 2.316 2.240 2.400 . 0 0 "[ . 1 . 2]" 1
726 1 128 HIS HB2 1 129 ALA H . . 3.750 3.552 2.558 3.745 . 0 0 "[ . 1 . 2]" 1
727 1 128 HIS HB3 1 129 ALA H . . 3.750 2.756 2.430 3.624 . 0 0 "[ . 1 . 2]" 1
728 1 93 HIS QB 1 94 ILE H . . 3.620 2.498 2.331 2.664 . 0 0 "[ . 1 . 2]" 1
729 1 158 CYS H 1 158 CYS HB2 . . 3.440 2.649 2.097 3.263 . 0 0 "[ . 1 . 2]" 1
730 1 11 GLN QB 1 44 LEU HG . . 3.480 3.508 2.230 3.820 0.340 5 0 "[ . 1 . 2]" 1
731 1 123 GLN H 1 123 GLN QB . . 3.900 2.891 2.784 2.965 . 0 0 "[ . 1 . 2]" 1
732 1 23 ARG HB2 1 24 LEU H . . 4.190 3.740 2.817 4.033 . 0 0 "[ . 1 . 2]" 1
733 1 23 ARG H 1 23 ARG HB2 . . 3.760 2.407 2.066 2.660 . 0 0 "[ . 1 . 2]" 1
734 1 23 ARG H 1 23 ARG HB3 . . 3.760 2.730 2.416 3.457 . 0 0 "[ . 1 . 2]" 1
735 1 23 ARG HB3 1 24 LEU H . . 4.190 2.774 2.485 3.363 . 0 0 "[ . 1 . 2]" 1
736 1 120 ARG H 1 120 ARG QG . . 3.780 3.481 3.087 3.788 0.008 16 0 "[ . 1 . 2]" 1
737 1 94 ILE H 1 94 ILE HG12 . . 4.000 2.601 2.171 3.778 . 0 0 "[ . 1 . 2]" 1
738 1 147 ARG H 1 147 ARG QG . . 4.030 3.920 3.030 4.041 0.011 11 0 "[ . 1 . 2]" 1
739 1 94 ILE H 1 94 ILE HG13 . . 4.000 3.279 2.121 3.682 . 0 0 "[ . 1 . 2]" 1
740 1 121 GLN H 1 121 GLN HB3 . . 3.540 3.319 2.635 3.445 . 0 0 "[ . 1 . 2]" 1
741 1 61 ILE H 1 61 ILE HG12 . . 3.780 3.491 2.254 3.824 0.044 4 0 "[ . 1 . 2]" 1
742 1 61 ILE H 1 61 ILE HG13 . . 3.780 2.599 2.162 3.734 . 0 0 "[ . 1 . 2]" 1
743 1 19 TYR QD 1 52 LEU HG . . 4.330 3.602 2.794 4.397 0.067 7 0 "[ . 1 . 2]" 1
744 1 19 TYR HA 1 52 LEU HG . . 4.110 3.855 3.285 4.132 0.022 19 0 "[ . 1 . 2]" 1
745 1 52 LEU H 1 52 LEU HG . . 3.910 3.130 1.988 4.241 0.331 3 0 "[ . 1 . 2]" 1
746 1 29 LEU HA 1 29 LEU MD1 . . 4.150 3.736 2.198 4.107 . 0 0 "[ . 1 . 2]" 1
747 1 29 LEU H 1 29 LEU MD1 . . 3.910 3.812 3.176 3.950 0.040 7 0 "[ . 1 . 2]" 1
748 1 41 PRO QG 1 43 ARG H . . 4.260 3.474 3.112 3.831 . 0 0 "[ . 1 . 2]" 1
749 1 3 PRO QG 1 4 THR H . . 4.010 3.050 1.760 4.158 0.148 3 0 "[ . 1 . 2]" 1
750 1 87 PHE QD 1 88 LEU HG . . 3.990 3.005 2.791 3.207 . 0 0 "[ . 1 . 2]" 1
751 1 34 PRO QG 1 35 GLU H . . 4.540 2.355 1.926 4.243 . 0 0 "[ . 1 . 2]" 1
752 1 54 LEU H 1 54 LEU HG . . 3.620 2.759 2.557 3.114 . 0 0 "[ . 1 . 2]" 1
753 1 73 LEU HG 1 74 HIS H . . 3.580 3.240 3.154 3.485 . 0 0 "[ . 1 . 2]" 1
754 1 67 ARG HA 1 67 ARG QG . . 3.820 2.941 2.281 3.336 . 0 0 "[ . 1 . 2]" 1
755 1 107 LEU HG 1 108 TYR H . . 3.800 3.804 3.694 4.182 0.382 1 0 "[ . 1 . 2]" 1
756 1 71 ARG HA 1 71 ARG QG . . 3.450 2.388 2.012 2.557 . 0 0 "[ . 1 . 2]" 1
757 1 36 ARG HA 1 36 ARG QG . . 3.180 2.396 2.049 3.350 0.170 4 0 "[ . 1 . 2]" 1
758 1 145 TRP HE3 1 146 LEU HG . . 3.990 3.620 2.042 4.210 0.220 17 0 "[ . 1 . 2]" 1
759 1 108 TYR QE 1 134 LEU HG . . 4.230 4.085 2.639 4.289 0.059 3 0 "[ . 1 . 2]" 1
760 1 134 LEU HA 1 134 LEU HG . . 3.610 2.466 2.180 3.364 . 0 0 "[ . 1 . 2]" 1
761 1 52 LEU HA 1 52 LEU HG . . 3.850 2.787 2.474 2.986 . 0 0 "[ . 1 . 2]" 1
762 1 74 HIS H 1 74 HIS HB3 . . 4.030 3.814 3.610 4.030 0.000 2 0 "[ . 1 . 2]" 1
763 1 54 LEU HA 1 54 LEU HG . . 4.100 2.799 2.353 2.927 . 0 0 "[ . 1 . 2]" 1
764 1 26 ARG HA 1 26 ARG QG . . 3.480 2.797 2.027 3.415 . 0 0 "[ . 1 . 2]" 1
765 1 26 ARG H 1 26 ARG QG . . 3.860 3.337 2.640 3.942 0.082 4 0 "[ . 1 . 2]" 1
766 1 73 LEU HG 1 75 ILE H . . 3.490 2.090 1.945 2.418 . 0 0 "[ . 1 . 2]" 1
767 1 73 LEU H 1 73 LEU HG . . 3.440 2.683 2.608 2.780 . 0 0 "[ . 1 . 2]" 1
768 1 73 LEU HG 1 75 ILE HA . . 3.640 3.409 3.311 3.466 . 0 0 "[ . 1 . 2]" 1
769 1 24 LEU HG 1 25 LEU HA . . 3.480 3.410 3.007 3.611 0.131 5 0 "[ . 1 . 2]" 1
770 1 43 ARG QG 1 44 LEU H . . 3.550 2.315 1.806 3.819 0.269 15 0 "[ . 1 . 2]" 1
771 1 43 ARG HE 1 43 ARG QG . . 3.900 2.462 2.092 3.327 . 0 0 "[ . 1 . 2]" 1
772 1 43 ARG H 1 43 ARG QG . . 3.700 2.824 1.874 3.909 0.209 8 0 "[ . 1 . 2]" 1
773 1 81 ARG H 1 81 ARG QG . . 3.720 2.349 1.756 3.281 . 0 0 "[ . 1 . 2]" 1
774 1 81 ARG HA 1 81 ARG QG . . 3.880 3.031 2.334 3.425 . 0 0 "[ . 1 . 2]" 1
775 1 43 ARG HA 1 43 ARG QG . . 3.520 3.011 2.658 3.445 . 0 0 "[ . 1 . 2]" 1
776 1 25 LEU H 1 25 LEU HG . . 4.300 3.899 3.407 4.234 . 0 0 "[ . 1 . 2]" 1
777 1 8 LEU HG 1 9 VAL H . . 4.290 4.142 3.787 4.486 0.196 20 0 "[ . 1 . 2]" 1
778 1 8 LEU MD2 1 152 TRP HE1 . . 4.640 3.195 2.524 4.702 0.062 20 0 "[ . 1 . 2]" 1
779 1 8 LEU MD2 1 147 ARG HA . . 3.800 3.468 2.851 3.837 0.037 9 0 "[ . 1 . 2]" 1
780 1 8 LEU HA 1 8 LEU MD2 . . 4.020 2.455 1.943 3.778 . 0 0 "[ . 1 . 2]" 1
781 1 146 LEU H 1 146 LEU MD1 . . 4.200 3.277 2.613 3.558 . 0 0 "[ . 1 . 2]" 1
782 1 74 HIS H 1 74 HIS HB2 . . 4.030 3.033 2.862 3.464 . 0 0 "[ . 1 . 2]" 1
783 1 29 LEU HA 1 29 LEU HG . . 4.190 3.506 2.780 3.711 . 0 0 "[ . 1 . 2]" 1
784 1 29 LEU H 1 29 LEU HG . . 3.760 2.597 2.003 3.848 0.088 9 0 "[ . 1 . 2]" 1
785 1 15 LEU H 1 15 LEU HG . . 3.970 2.295 1.991 4.065 0.095 19 0 "[ . 1 . 2]" 1
786 1 75 ILE HA 1 75 ILE HG12 . . 4.160 2.964 2.513 3.094 . 0 0 "[ . 1 . 2]" 1
787 1 95 PHE QE 1 107 LEU MD1 . . 3.970 2.216 1.917 4.012 0.042 1 0 "[ . 1 . 2]" 1
788 1 75 ILE HA 1 75 ILE HG13 . . 4.160 2.567 2.544 2.626 . 0 0 "[ . 1 . 2]" 1
789 1 51 LEU HA 1 51 LEU MD1 . . 4.480 3.925 3.046 3.988 . 0 0 "[ . 1 . 2]" 1
790 1 145 TRP HE3 1 146 LEU MD1 . . 4.690 2.404 1.877 3.867 . 0 0 "[ . 1 . 2]" 1
791 1 88 LEU MD1 1 133 ALA HA . . 4.400 3.090 2.760 3.548 . 0 0 "[ . 1 . 2]" 1
792 1 77 LEU MD1 1 118 ALA H . . 4.090 3.999 3.637 4.128 0.038 9 0 "[ . 1 . 2]" 1
793 1 142 LEU HA 1 142 LEU MD1 . . 3.940 3.834 3.521 3.946 0.006 15 0 "[ . 1 . 2]" 1
794 1 138 VAL HA 1 142 LEU MD1 . . 4.150 2.304 1.904 2.608 . 0 0 "[ . 1 . 2]" 1
795 1 6 LYS H 1 6 LYS HG2 . . 3.920 2.237 1.930 2.704 . 0 0 "[ . 1 . 2]" 1
796 1 140 LYS H 1 140 LYS HG2 . . 4.310 3.480 3.114 4.194 . 0 0 "[ . 1 . 2]" 1
797 1 140 LYS HA 1 140 LYS HG2 . . 3.700 2.578 2.124 3.008 . 0 0 "[ . 1 . 2]" 1
798 1 6 LYS H 1 6 LYS HG3 . . 3.920 3.433 2.776 3.789 . 0 0 "[ . 1 . 2]" 1
799 1 156 LEU H 1 157 LYS QG . . 3.750 3.633 3.424 3.767 0.017 2 0 "[ . 1 . 2]" 1
800 1 140 LYS H 1 140 LYS HG3 . . 4.310 4.006 3.052 4.352 0.042 19 0 "[ . 1 . 2]" 1
801 1 99 ILE MG 1 142 LEU MD1 . . 4.130 2.996 2.367 3.862 . 0 0 "[ . 1 . 2]" 1
802 1 91 ALA MB 1 107 LEU MD2 . . 4.270 2.978 2.235 3.329 . 0 0 "[ . 1 . 2]" 1
803 1 22 ALA MB 1 52 LEU MD1 . . 3.360 3.100 2.740 3.399 0.039 14 0 "[ . 1 . 2]" 1
804 1 52 LEU H 1 52 LEU MD1 . . 3.800 3.320 2.165 3.825 0.025 16 0 "[ . 1 . 2]" 1
805 1 52 LEU HA 1 52 LEU MD1 . . 4.270 3.341 2.011 3.957 . 0 0 "[ . 1 . 2]" 1
806 1 130 LEU H 1 130 LEU MD1 . . 3.780 3.542 3.373 3.715 . 0 0 "[ . 1 . 2]" 1
807 1 108 TYR QD 1 134 LEU MD2 . . 3.920 3.233 2.087 3.528 . 0 0 "[ . 1 . 2]" 1
808 1 134 LEU HA 1 134 LEU MD2 . . 3.580 3.221 2.767 3.764 0.184 7 0 "[ . 1 . 2]" 1
809 1 108 TYR QE 1 134 LEU MD2 . . 3.620 2.153 1.874 2.980 . 0 0 "[ . 1 . 2]" 1
810 1 77 LEU HA 1 83 VAL MG1 . . 4.140 3.675 3.454 3.992 . 0 0 "[ . 1 . 2]" 1
811 1 83 VAL HA 1 83 VAL MG1 . . 3.160 3.165 2.525 3.202 0.042 1 0 "[ . 1 . 2]" 1
812 1 119 VAL MG2 1 120 ARG H . . 4.620 3.780 3.518 3.939 . 0 0 "[ . 1 . 2]" 1
813 1 119 VAL H 1 119 VAL MG2 . . 4.110 2.730 1.927 3.763 . 0 0 "[ . 1 . 2]" 1
814 1 119 VAL HA 1 119 VAL MG2 . . 3.190 2.359 2.240 2.431 . 0 0 "[ . 1 . 2]" 1
815 1 11 GLN HA 1 44 LEU MD1 . . 3.910 3.058 2.006 3.833 . 0 0 "[ . 1 . 2]" 1
816 1 149 ARG HA 1 149 ARG HG2 . . 3.940 2.290 2.189 2.442 . 0 0 "[ . 1 . 2]" 1
817 1 148 ARG QD 1 149 ARG HG2 . . 3.850 3.615 3.354 3.861 0.011 5 0 "[ . 1 . 2]" 1
818 1 108 TYR QD 1 134 LEU MD1 . . 3.920 2.795 2.221 3.916 . 0 0 "[ . 1 . 2]" 1
819 1 108 TYR QE 1 134 LEU MD1 . . 3.620 2.605 2.047 3.624 0.004 13 0 "[ . 1 . 2]" 1
820 1 134 LEU HA 1 134 LEU MD1 . . 3.580 3.201 1.923 3.632 0.052 9 0 "[ . 1 . 2]" 1
821 1 15 LEU H 1 15 LEU MD2 . . 3.840 3.343 2.279 3.750 . 0 0 "[ . 1 . 2]" 1
822 1 15 LEU MD2 1 108 TYR QE . . 4.600 4.546 4.125 4.666 0.066 8 0 "[ . 1 . 2]" 1
823 1 105 VAL H 1 105 VAL MG1 . . 4.600 3.763 3.756 3.771 . 0 0 "[ . 1 . 2]" 1
824 1 105 VAL HA 1 105 VAL MG1 . . 3.130 2.278 2.199 2.388 . 0 0 "[ . 1 . 2]" 1
825 1 50 VAL HA 1 50 VAL MG1 . . 3.140 2.359 2.321 2.370 . 0 0 "[ . 1 . 2]" 1
826 1 50 VAL H 1 50 VAL MG1 . . 3.990 3.767 3.764 3.770 . 0 0 "[ . 1 . 2]" 1
827 1 8 LEU MD1 1 147 ARG HA . . 3.800 3.259 2.845 3.690 . 0 0 "[ . 1 . 2]" 1
828 1 77 LEU H 1 77 LEU MD2 . . 3.810 2.539 1.995 2.873 . 0 0 "[ . 1 . 2]" 1
829 1 15 LEU MD1 1 108 TYR QE . . 4.600 3.162 2.640 3.817 . 0 0 "[ . 1 . 2]" 1
830 1 15 LEU H 1 15 LEU MD1 . . 3.840 3.470 3.059 3.840 . 0 0 "[ . 1 . 2]" 1
831 1 15 LEU HA 1 15 LEU MD1 . . 4.060 3.807 2.094 3.972 . 0 0 "[ . 1 . 2]" 1
832 1 138 VAL MG1 1 152 TRP HZ2 . . 4.440 2.211 1.929 2.689 . 0 0 "[ . 1 . 2]" 1
833 1 138 VAL HA 1 138 VAL MG1 . . 3.210 2.393 2.348 2.473 . 0 0 "[ . 1 . 2]" 1
834 1 110 VAL MG1 1 111 ALA H . . 3.710 3.465 3.383 3.523 . 0 0 "[ . 1 . 2]" 1
835 1 9 VAL HA 1 9 VAL MG1 . . 3.430 2.342 2.264 2.400 . 0 0 "[ . 1 . 2]" 1
836 1 119 VAL MG1 1 120 ARG H . . 4.620 2.915 2.083 3.608 . 0 0 "[ . 1 . 2]" 1
837 1 90 VAL H 1 90 VAL MG1 . . 3.840 3.099 2.003 3.758 . 0 0 "[ . 1 . 2]" 1
838 1 127 VAL H 1 127 VAL MG1 . . 4.210 3.751 3.714 3.764 . 0 0 "[ . 1 . 2]" 1
839 1 127 VAL HA 1 127 VAL MG1 . . 3.170 2.447 2.407 2.517 . 0 0 "[ . 1 . 2]" 1
840 1 130 LEU H 1 130 LEU MD2 . . 3.780 3.534 3.281 3.740 . 0 0 "[ . 1 . 2]" 1
841 1 130 LEU HA 1 130 LEU MD2 . . 4.340 2.179 1.966 2.334 . 0 0 "[ . 1 . 2]" 1
842 1 52 LEU H 1 52 LEU MD2 . . 3.800 3.724 3.488 3.898 0.098 17 0 "[ . 1 . 2]" 1
843 1 52 LEU HA 1 52 LEU MD2 . . 4.270 2.540 1.939 3.805 . 0 0 "[ . 1 . 2]" 1
844 1 52 LEU MD2 1 53 ARG H . . 5.030 4.424 4.236 4.909 . 0 0 "[ . 1 . 2]" 1
845 1 142 LEU HA 1 142 LEU MD2 . . 3.940 2.405 2.135 3.280 . 0 0 "[ . 1 . 2]" 1
846 1 138 VAL HA 1 142 LEU MD2 . . 4.150 3.823 3.692 4.187 0.037 19 0 "[ . 1 . 2]" 1
847 1 146 LEU H 1 146 LEU MD2 . . 4.200 2.463 1.863 4.053 . 0 0 "[ . 1 . 2]" 1
848 1 145 TRP HE3 1 146 LEU MD2 . . 4.690 2.250 1.887 4.421 . 0 0 "[ . 1 . 2]" 1
849 1 119 VAL HA 1 119 VAL MG1 . . 3.190 2.680 2.284 3.204 0.014 2 0 "[ . 1 . 2]" 1
850 1 119 VAL H 1 119 VAL MG1 . . 4.110 3.096 1.928 3.767 . 0 0 "[ . 1 . 2]" 1
851 1 116 VAL HA 1 116 VAL MG1 . . 3.130 2.336 2.169 2.442 . 0 0 "[ . 1 . 2]" 1
852 1 47 VAL QG 1 153 THR H . . 4.020 3.625 3.017 3.865 . 0 0 "[ . 1 . 2]" 1
853 1 47 VAL H 1 47 VAL QG . . 3.080 2.000 1.900 2.120 . 0 0 "[ . 1 . 2]" 1
854 1 47 VAL QG 1 153 THR MG . . 3.700 3.481 2.798 3.858 0.158 13 0 "[ . 1 . 2]" 1
855 1 47 VAL QG 1 48 ALA H . . 3.920 3.028 2.881 3.157 . 0 0 "[ . 1 . 2]" 1
856 1 101 TRP HA 1 104 VAL MG2 . . 4.240 2.633 1.939 4.293 0.053 14 0 "[ . 1 . 2]" 1
857 1 114 LEU H 1 114 LEU MD2 . . 4.250 3.609 1.908 4.096 . 0 0 "[ . 1 . 2]" 1
858 1 155 VAL H 1 156 LEU MD2 . . 5.070 4.339 3.131 5.137 0.067 20 0 "[ . 1 . 2]" 1
859 1 155 VAL H 1 155 VAL QG . . 3.000 2.247 1.927 2.573 . 0 0 "[ . 1 . 2]" 1
860 1 155 VAL HA 1 155 VAL QG . . 2.930 2.140 2.013 2.298 . 0 0 "[ . 1 . 2]" 1
861 1 101 TRP HA 1 104 VAL MG1 . . 4.240 3.780 1.931 4.289 0.049 4 0 "[ . 1 . 2]" 1
862 1 104 VAL MG1 1 105 VAL H . . 4.180 3.073 2.114 3.537 . 0 0 "[ . 1 . 2]" 1
863 1 4 THR MG 1 5 ASP H . . 4.440 3.238 1.837 4.049 . 0 0 "[ . 1 . 2]" 1
864 1 4 THR H 1 4 THR MG . . 3.850 3.397 1.928 4.052 0.202 14 0 "[ . 1 . 2]" 1
865 1 153 THR H 1 153 THR MG . . 3.050 2.214 1.908 3.043 . 0 0 "[ . 1 . 2]" 1
866 1 84 THR MG 1 130 LEU HA . . 3.850 3.909 3.859 3.934 0.084 13 0 "[ . 1 . 2]" 1
867 1 84 THR H 1 84 THR MG . . 3.640 2.592 2.346 2.857 . 0 0 "[ . 1 . 2]" 1
868 1 144 THR MG 1 148 ARG H . . 4.340 3.979 3.784 4.142 . 0 0 "[ . 1 . 2]" 1
869 1 100 THR MG 1 145 TRP HZ2 . . 4.380 4.310 4.129 4.653 0.273 17 0 "[ . 1 . 2]" 1
870 1 90 VAL H 1 90 VAL MG2 . . 3.840 2.749 2.065 3.764 . 0 0 "[ . 1 . 2]" 1
871 1 20 VAL H 1 20 VAL MG1 . . 3.780 3.763 3.753 3.770 . 0 0 "[ . 1 . 2]" 1
872 1 50 VAL HA 1 50 VAL MG2 . . 3.140 2.379 2.273 2.418 . 0 0 "[ . 1 . 2]" 1
873 1 20 VAL HA 1 20 VAL MG1 . . 3.430 2.334 2.248 2.440 . 0 0 "[ . 1 . 2]" 1
874 1 127 VAL HA 1 131 VAL QG . . 3.980 3.455 3.338 3.575 . 0 0 "[ . 1 . 2]" 1
875 1 128 HIS HA 1 131 VAL QG . . 4.030 3.194 3.037 3.384 . 0 0 "[ . 1 . 2]" 1
876 1 131 VAL HA 1 131 VAL QG . . 3.180 2.116 2.090 2.133 . 0 0 "[ . 1 . 2]" 1
877 1 17 ARG H 1 131 VAL QG . . 4.200 3.059 2.647 3.437 . 0 0 "[ . 1 . 2]" 1
878 1 65 VAL H 1 65 VAL MG1 . . 4.600 3.307 2.548 3.523 . 0 0 "[ . 1 . 2]" 1
879 1 65 VAL HA 1 65 VAL MG1 . . 3.430 2.278 2.082 3.184 . 0 0 "[ . 1 . 2]" 1
880 1 144 THR HA 1 144 THR MG . . 3.060 2.364 2.222 2.422 . 0 0 "[ . 1 . 2]" 1
881 1 144 THR MG 1 148 ARG QB . . 4.190 3.094 2.888 3.309 . 0 0 "[ . 1 . 2]" 1
882 1 110 VAL MG2 1 111 ALA H . . 3.710 3.586 3.520 3.667 . 0 0 "[ . 1 . 2]" 1
883 1 105 VAL HA 1 105 VAL MG2 . . 3.130 2.356 2.302 2.412 . 0 0 "[ . 1 . 2]" 1
884 1 54 LEU HB2 1 105 VAL MG2 . . 4.950 4.146 3.716 4.381 . 0 0 "[ . 1 . 2]" 1
885 1 40 VAL HA 1 40 VAL MG2 . . 3.670 2.517 2.385 3.152 . 0 0 "[ . 1 . 2]" 1
886 1 90 VAL HA 1 90 VAL MG2 . . 3.130 2.371 2.228 2.424 . 0 0 "[ . 1 . 2]" 1
887 1 141 THR H 1 141 THR MG . . 3.610 3.760 3.733 3.781 0.171 20 0 "[ . 1 . 2]" 1
888 1 141 THR MG 1 142 LEU H . . 3.390 3.357 3.093 3.449 0.059 12 0 "[ . 1 . 2]" 1
889 1 137 PHE QD 1 141 THR MG . . 3.530 3.588 3.557 3.663 0.133 19 0 "[ . 1 . 2]" 1
890 1 141 THR HA 1 141 THR MG . . 3.130 2.413 2.343 2.480 . 0 0 "[ . 1 . 2]" 1
891 1 141 THR MG 1 142 LEU HA . . 3.870 3.469 3.282 3.610 . 0 0 "[ . 1 . 2]" 1
892 1 20 VAL MG2 1 112 ALA HA . . 3.500 2.190 1.914 2.486 . 0 0 "[ . 1 . 2]" 1
893 1 20 VAL HA 1 20 VAL MG2 . . 3.430 2.290 2.189 2.368 . 0 0 "[ . 1 . 2]" 1
894 1 20 VAL H 1 20 VAL MG2 . . 3.780 2.193 2.052 2.363 . 0 0 "[ . 1 . 2]" 1
895 1 20 VAL MG2 1 115 ALA MB . . 3.850 2.533 2.093 2.808 . 0 0 "[ . 1 . 2]" 1
896 1 20 VAL MG2 1 21 HIS H . . 4.250 3.769 3.651 3.929 . 0 0 "[ . 1 . 2]" 1
897 1 127 VAL HA 1 127 VAL MG2 . . 3.170 2.323 2.206 2.378 . 0 0 "[ . 1 . 2]" 1
898 1 9 VAL HA 1 9 VAL MG2 . . 3.430 2.347 2.254 2.428 . 0 0 "[ . 1 . 2]" 1
899 1 138 VAL HA 1 138 VAL MG2 . . 3.210 2.318 2.224 2.383 . 0 0 "[ . 1 . 2]" 1
900 1 12 ALA MB 1 138 VAL MG2 . . 3.270 2.689 2.281 3.152 . 0 0 "[ . 1 . 2]" 1
901 1 116 VAL HA 1 116 VAL MG2 . . 3.130 2.492 2.241 3.196 0.066 2 0 "[ . 1 . 2]" 1
902 1 83 VAL H 1 83 VAL MG2 . . 4.010 3.711 2.722 3.767 . 0 0 "[ . 1 . 2]" 1
903 1 77 LEU HA 1 83 VAL MG2 . . 4.140 3.273 1.920 3.765 . 0 0 "[ . 1 . 2]" 1
904 1 83 VAL HA 1 83 VAL MG2 . . 3.160 2.360 2.096 2.419 . 0 0 "[ . 1 . 2]" 1
905 1 12 ALA MB 1 152 TRP HE1 . . 4.170 3.871 3.603 4.193 0.023 19 0 "[ . 1 . 2]" 1
906 1 12 ALA H 1 12 ALA MB . . 3.050 2.150 2.039 2.232 . 0 0 "[ . 1 . 2]" 1
907 1 12 ALA MB 1 152 TRP HZ2 . . 3.590 3.005 2.564 3.275 . 0 0 "[ . 1 . 2]" 1
908 1 12 ALA MB 1 152 TRP HH2 . . 4.500 4.354 3.764 4.615 0.115 8 0 "[ . 1 . 2]" 1
909 1 12 ALA MB 1 138 VAL MG1 . . 3.270 2.224 1.853 2.580 . 0 0 "[ . 1 . 2]" 1
910 1 12 ALA MB 1 138 VAL HB . . 4.020 2.715 2.395 3.030 . 0 0 "[ . 1 . 2]" 1
911 1 40 VAL MG1 1 45 ALA H . . 3.970 3.968 3.719 4.243 0.273 10 0 "[ . 1 . 2]" 1
912 1 65 VAL HA 1 65 VAL MG2 . . 3.430 3.103 2.349 3.191 . 0 0 "[ . 1 . 2]" 1
913 1 27 ALA MB 1 28 GLY H . . 3.200 2.589 1.983 3.207 0.007 17 0 "[ . 1 . 2]" 1
914 1 27 ALA H 1 27 ALA MB . . 3.160 2.127 2.027 2.239 . 0 0 "[ . 1 . 2]" 1
915 1 22 ALA H 1 22 ALA MB . . 3.150 2.150 2.023 2.236 . 0 0 "[ . 1 . 2]" 1
916 1 22 ALA MB 1 24 LEU H . . 4.370 4.277 4.113 4.379 0.009 3 0 "[ . 1 . 2]" 1
917 1 22 ALA MB 1 52 LEU MD2 . . 3.360 2.366 1.848 3.298 . 0 0 "[ . 1 . 2]" 1
918 1 115 ALA MB 1 127 VAL MG1 . . 3.450 3.411 3.176 3.556 0.106 20 0 "[ . 1 . 2]" 1
919 1 115 ALA H 1 115 ALA MB . . 3.180 2.152 2.025 2.232 . 0 0 "[ . 1 . 2]" 1
920 1 112 ALA HA 1 115 ALA MB . . 3.660 2.749 2.619 2.892 . 0 0 "[ . 1 . 2]" 1
921 1 115 ALA MB 1 127 VAL HA . . 4.410 2.394 2.131 2.575 . 0 0 "[ . 1 . 2]" 1
922 1 115 ALA MB 1 127 VAL MG2 . . 3.450 1.961 1.821 2.127 . 0 0 "[ . 1 . 2]" 1
923 1 97 ALA MB 1 98 GLY H . . 3.480 3.436 3.143 3.545 0.065 13 0 "[ . 1 . 2]" 1
924 1 97 ALA H 1 97 ALA MB . . 3.240 2.317 2.223 2.464 . 0 0 "[ . 1 . 2]" 1
925 1 37 ALA H 1 37 ALA MB . . 3.110 2.387 2.031 2.916 . 0 0 "[ . 1 . 2]" 1
926 1 112 ALA H 1 112 ALA MB . . 3.000 2.027 2.023 2.037 . 0 0 "[ . 1 . 2]" 1
927 1 19 TYR QD 1 112 ALA MB . . 4.800 2.670 1.965 3.150 . 0 0 "[ . 1 . 2]" 1
928 1 19 TYR QE 1 112 ALA MB . . 5.310 3.289 1.928 3.767 . 0 0 "[ . 1 . 2]" 1
929 1 20 VAL HA 1 112 ALA MB . . 3.370 2.191 1.989 2.369 . 0 0 "[ . 1 . 2]" 1
930 1 20 VAL MG1 1 112 ALA MB . . 3.570 3.633 3.533 3.730 0.160 9 0 "[ . 1 . 2]" 1
931 1 86 ALA MB 1 87 PHE H . . 3.270 2.314 2.210 2.431 . 0 0 "[ . 1 . 2]" 1
932 1 86 ALA H 1 86 ALA MB . . 3.150 2.201 2.035 2.234 . 0 0 "[ . 1 . 2]" 1
933 1 83 VAL HA 1 86 ALA MB . . 3.300 2.860 2.756 3.098 . 0 0 "[ . 1 . 2]" 1
934 1 38 ALA MB 1 39 PRO HD2 . . 3.490 2.062 1.957 2.212 . 0 0 "[ . 1 . 2]" 1
935 1 125 ALA H 1 126 MET ME . . 4.150 4.191 4.151 4.224 0.074 18 0 "[ . 1 . 2]" 1
936 1 126 MET H 1 126 MET ME . . 3.220 2.851 2.683 2.963 . 0 0 "[ . 1 . 2]" 1
937 1 126 MET ME 1 126 MET HG2 . . 3.310 2.143 2.015 3.092 . 0 0 "[ . 1 . 2]" 1
938 1 126 MET ME 1 126 MET HG3 . . 3.310 3.202 2.128 3.318 0.008 18 0 "[ . 1 . 2]" 1
939 1 125 ALA MB 1 126 MET ME . . 3.140 2.557 2.225 2.908 . 0 0 "[ . 1 . 2]" 1
940 1 6 LYS HA 1 10 ALA MB . . 3.770 3.869 3.798 3.925 0.155 16 0 "[ . 1 . 2]" 1
941 1 10 ALA MB 1 11 GLN H . . 3.300 2.453 2.124 2.773 . 0 0 "[ . 1 . 2]" 1
942 1 10 ALA H 1 10 ALA MB . . 3.120 2.141 2.069 2.227 . 0 0 "[ . 1 . 2]" 1
943 1 133 ALA MB 1 134 LEU H . . 3.450 2.485 2.353 2.664 . 0 0 "[ . 1 . 2]" 1
944 1 133 ALA H 1 133 ALA MB . . 3.180 2.078 2.047 2.122 . 0 0 "[ . 1 . 2]" 1
945 1 87 PHE QD 1 133 ALA MB . . 3.220 2.014 1.934 2.273 . 0 0 "[ . 1 . 2]" 1
946 1 130 LEU HA 1 133 ALA MB . . 3.430 2.927 2.746 3.055 . 0 0 "[ . 1 . 2]" 1
947 1 125 ALA H 1 125 ALA MB . . 3.160 2.134 2.023 2.236 . 0 0 "[ . 1 . 2]" 1
948 1 89 ALA MB 1 90 VAL HA . . 3.960 3.656 3.593 3.723 . 0 0 "[ . 1 . 2]" 1
949 1 89 ALA H 1 89 ALA MB . . 3.160 2.053 2.024 2.148 . 0 0 "[ . 1 . 2]" 1
950 1 89 ALA MB 1 90 VAL H . . 3.430 2.444 2.300 2.548 . 0 0 "[ . 1 . 2]" 1
951 1 14 ALA H 1 14 ALA MB . . 3.120 2.114 2.024 2.231 . 0 0 "[ . 1 . 2]" 1
952 1 14 ALA MB 1 15 LEU H . . 3.270 2.564 2.374 2.760 . 0 0 "[ . 1 . 2]" 1
953 1 49 ALA H 1 49 ALA MB . . 3.100 2.198 2.039 2.241 . 0 0 "[ . 1 . 2]" 1
954 1 38 ALA MB 1 39 PRO HD3 . . 3.490 3.132 3.055 3.266 . 0 0 "[ . 1 . 2]" 1
955 1 38 ALA H 1 38 ALA MB . . 3.170 2.789 2.038 2.914 . 0 0 "[ . 1 . 2]" 1
956 1 37 ALA HA 1 38 ALA MB . . 3.640 3.707 3.648 4.128 0.488 8 0 "[ . 1 . 2]" 1
957 1 33 ALA MB 1 34 PRO QD . . 3.290 2.054 1.905 2.992 . 0 0 "[ . 1 . 2]" 1
958 1 33 ALA MB 1 34 PRO QG . . 4.380 3.530 3.338 4.375 . 0 0 "[ . 1 . 2]" 1
959 1 32 SER HA 1 33 ALA MB . . 4.010 3.832 3.665 4.028 0.018 20 0 "[ . 1 . 2]" 1
960 1 61 ILE H 1 61 ILE MG . . 3.870 3.762 3.747 3.775 . 0 0 "[ . 1 . 2]" 1
961 1 74 HIS HA 1 75 ILE MG . . 4.050 3.825 3.740 4.081 0.031 18 0 "[ . 1 . 2]" 1
962 1 46 GLU QB 1 49 ALA MB . . 4.550 4.421 4.263 4.560 0.010 15 0 "[ . 1 . 2]" 1
963 1 45 ALA H 1 45 ALA MB . . 3.130 2.153 2.031 2.238 . 0 0 "[ . 1 . 2]" 1
964 1 80 GLU QB 1 129 ALA MB . . 3.740 3.689 3.465 3.823 0.083 20 0 "[ . 1 . 2]" 1
965 1 129 ALA H 1 129 ALA MB . . 3.110 2.108 2.033 2.237 . 0 0 "[ . 1 . 2]" 1
966 1 118 ALA MB 1 119 VAL HA . . 3.860 3.694 3.644 3.733 . 0 0 "[ . 1 . 2]" 1
967 1 118 ALA H 1 118 ALA MB . . 3.170 2.155 2.058 2.204 . 0 0 "[ . 1 . 2]" 1
968 1 70 ALA MB 1 71 ARG H . . 3.070 2.559 2.441 2.610 . 0 0 "[ . 1 . 2]" 1
969 1 70 ALA H 1 70 ALA MB . . 3.010 2.103 2.040 2.236 . 0 0 "[ . 1 . 2]" 1
970 1 87 PHE HZ 1 111 ALA MB . . 3.550 3.155 2.921 3.388 . 0 0 "[ . 1 . 2]" 1
971 1 111 ALA MB 1 112 ALA H . . 3.280 2.518 2.378 2.586 . 0 0 "[ . 1 . 2]" 1
972 1 111 ALA H 1 111 ALA MB . . 3.070 2.142 2.028 2.236 . 0 0 "[ . 1 . 2]" 1
973 1 61 ILE HA 1 61 ILE MG . . 3.040 2.351 2.312 2.403 . 0 0 "[ . 1 . 2]" 1
974 1 61 ILE MG 1 62 ARG H . . 4.150 2.926 2.766 3.096 . 0 0 "[ . 1 . 2]" 1
975 1 75 ILE MG 1 76 SER H . . 3.370 2.038 1.899 2.117 . 0 0 "[ . 1 . 2]" 1
976 1 75 ILE H 1 75 ILE MG . . 3.890 2.107 1.988 2.594 . 0 0 "[ . 1 . 2]" 1
977 1 75 ILE MG 1 77 LEU H . . 4.310 2.961 2.544 3.410 . 0 0 "[ . 1 . 2]" 1
978 1 60 MET H 1 60 MET ME . . 3.920 3.876 3.648 4.045 0.125 17 0 "[ . 1 . 2]" 1
979 1 60 MET HA 1 60 MET ME . . 4.230 4.257 4.213 4.373 0.143 17 0 "[ . 1 . 2]" 1
980 1 57 GLU HA 1 60 MET ME . . 3.530 2.208 1.929 3.634 0.104 17 0 "[ . 1 . 2]" 1
981 1 48 ALA H 1 48 ALA MB . . 3.030 2.097 2.030 2.196 . 0 0 "[ . 1 . 2]" 1
982 1 48 ALA MB 1 49 ALA H . . 3.160 2.516 2.316 2.799 . 0 0 "[ . 1 . 2]" 1
983 1 110 VAL HB 1 111 ALA MB . . 4.560 3.860 3.774 3.943 . 0 0 "[ . 1 . 2]" 1
984 1 111 ALA MB 1 112 ALA MB . . 4.430 3.727 3.650 3.778 . 0 0 "[ . 1 . 2]" 1
985 1 88 LEU H 1 91 ALA MB . . 4.260 4.379 4.307 4.437 0.177 20 0 "[ . 1 . 2]" 1
986 1 91 ALA H 1 91 ALA MB . . 3.150 2.042 2.023 2.078 . 0 0 "[ . 1 . 2]" 1
987 1 87 PHE QD 1 91 ALA MB . . 4.190 3.910 3.813 4.031 . 0 0 "[ . 1 . 2]" 1
988 1 91 ALA MB 1 107 LEU MD1 . . 4.270 2.291 2.012 3.481 . 0 0 "[ . 1 . 2]" 1
989 1 99 ILE MG 1 145 TRP HE1 . . 4.440 4.136 3.687 4.443 0.003 6 0 "[ . 1 . 2]" 1
990 1 99 ILE MG 1 145 TRP HB3 . . 4.270 3.104 2.430 3.487 . 0 0 "[ . 1 . 2]" 1
991 1 95 PHE QD 1 99 ILE MG . . 3.810 2.308 1.996 3.201 . 0 0 "[ . 1 . 2]" 1
992 1 95 PHE QE 1 99 ILE MG . . 3.560 2.601 1.972 3.562 0.002 13 0 "[ . 1 . 2]" 1
993 1 99 ILE MG 1 145 TRP HE3 . . 4.340 2.842 2.478 3.234 . 0 0 "[ . 1 . 2]" 1
994 1 99 ILE HA 1 99 ILE MG . . 3.290 2.323 2.199 2.481 . 0 0 "[ . 1 . 2]" 1
995 1 99 ILE MG 1 145 TRP HB2 . . 4.270 3.414 2.087 3.969 . 0 0 "[ . 1 . 2]" 1
996 1 99 ILE MG 1 142 LEU MD2 . . 4.130 2.143 1.713 2.902 . 0 0 "[ . 1 . 2]" 1
997 1 99 ILE H 1 99 ILE MG . . 4.010 3.774 3.718 3.844 . 0 0 "[ . 1 . 2]" 1
998 1 121 GLN HA 1 122 ALA MB . . 4.600 3.747 3.704 3.787 . 0 0 "[ . 1 . 2]" 1
999 1 122 ALA H 1 122 ALA MB . . 3.120 2.901 2.888 2.915 . 0 0 "[ . 1 . 2]" 1
1000 1 91 ALA MB 1 92 GLY QA . . 3.590 3.357 3.329 3.412 . 0 0 "[ . 1 . 2]" 1
1001 1 91 ALA MB 1 95 PHE QD . . 4.460 3.912 3.319 4.073 . 0 0 "[ . 1 . 2]" 1
1002 1 94 ILE HA 1 94 ILE MG . . 3.060 2.359 2.288 2.410 . 0 0 "[ . 1 . 2]" 1
1003 1 94 ILE MG 1 103 LYS HG3 . . 3.680 2.512 2.130 3.552 . 0 0 "[ . 1 . 2]" 1
1004 1 99 ILE MD 1 145 TRP H . . 3.950 3.881 3.472 4.026 0.076 17 0 "[ . 1 . 2]" 1
1005 1 99 ILE MD 1 145 TRP HD1 . . 4.220 2.422 2.164 2.993 . 0 0 "[ . 1 . 2]" 1
1006 1 99 ILE MD 1 142 LEU HA . . 3.550 3.410 2.689 3.595 0.045 5 0 "[ . 1 . 2]" 1
1007 1 99 ILE MD 1 141 THR MG . . 4.070 3.859 3.405 4.116 0.046 18 0 "[ . 1 . 2]" 1
1008 1 99 ILE MD 1 99 ILE MG . . 3.180 2.716 1.891 3.179 . 0 0 "[ . 1 . 2]" 1
1009 1 99 ILE H 1 99 ILE MD . . 3.820 2.576 1.886 3.793 . 0 0 "[ . 1 . 2]" 1
1010 1 75 ILE HB 1 75 ILE MD . . 3.090 2.442 2.395 2.618 . 0 0 "[ . 1 . 2]" 1
1011 1 75 ILE MD 1 76 SER H . . 4.310 4.432 4.397 4.559 0.249 18 0 "[ . 1 . 2]" 1
1012 1 75 ILE HA 1 75 ILE MD . . 4.270 3.841 3.779 3.855 . 0 0 "[ . 1 . 2]" 1
1013 1 94 ILE H 1 94 ILE MD . . 3.460 3.417 3.152 3.477 0.017 20 0 "[ . 1 . 2]" 1
1014 1 94 ILE MD 1 94 ILE MG . . 3.010 2.020 1.926 2.271 . 0 0 "[ . 1 . 2]" 1
1015 1 61 ILE H 1 61 ILE MD . . 3.900 3.182 3.016 3.625 . 0 0 "[ . 1 . 2]" 1
1016 1 19 TYR QD 1 20 VAL H . . 4.550 3.922 3.341 4.317 . 0 0 "[ . 1 . 2]" 1
1017 1 19 TYR QD 1 51 LEU HB3 . . 4.270 3.893 3.113 4.289 0.019 20 0 "[ . 1 . 2]" 1
1018 1 19 TYR QD 1 51 LEU HB2 . . 4.270 3.829 2.685 4.261 . 0 0 "[ . 1 . 2]" 1
1019 1 19 TYR QE 1 51 LEU HB2 . . 4.070 3.336 2.079 4.130 0.060 5 0 "[ . 1 . 2]" 1
1020 1 108 TYR QD 1 109 ALA H . . 5.200 4.438 4.334 4.529 . 0 0 "[ . 1 . 2]" 1
1021 1 16 GLY HA2 1 108 TYR QD . . 4.350 3.076 2.713 3.378 . 0 0 "[ . 1 . 2]" 1
1022 1 87 PHE QE 1 134 LEU HA . . 4.600 2.416 2.022 2.955 . 0 0 "[ . 1 . 2]" 1
1023 1 92 GLY QA 1 137 PHE QE . . 4.040 2.064 1.921 2.466 . 0 0 "[ . 1 . 2]" 1
1024 1 95 PHE QE 1 104 VAL HA . . 4.330 3.428 2.975 3.744 . 0 0 "[ . 1 . 2]" 1
1025 1 95 PHE QE 1 107 LEU MD2 . . 3.970 2.841 2.102 3.382 . 0 0 "[ . 1 . 2]" 1
1026 1 95 PHE HZ 1 107 LEU MD2 . . 3.570 2.542 2.018 3.667 0.097 1 0 "[ . 1 . 2]" 1
1027 1 95 PHE QE 1 104 VAL H . . 4.780 4.134 2.983 4.585 . 0 0 "[ . 1 . 2]" 1
1028 1 87 PHE HZ 1 133 ALA MB . . 4.580 4.633 4.612 4.687 0.107 18 0 "[ . 1 . 2]" 1
1029 1 87 PHE HZ 1 134 LEU H . . 4.770 4.627 4.343 4.779 0.009 9 0 "[ . 1 . 2]" 1
1030 1 95 PHE HZ 1 107 LEU MD1 . . 3.570 3.534 3.031 3.591 0.021 15 0 "[ . 1 . 2]" 1
1031 1 11 GLN QB 1 152 TRP HD1 . . 4.540 3.677 3.040 4.566 0.026 8 0 "[ . 1 . 2]" 1
1032 1 47 VAL QG 1 152 TRP HD1 . . 4.200 4.097 3.872 4.223 0.023 16 0 "[ . 1 . 2]" 1
1033 1 152 TRP HA 1 152 TRP HD1 . . 4.660 3.673 3.528 3.889 . 0 0 "[ . 1 . 2]" 1
1034 1 145 TRP HD1 1 148 ARG QD . . 4.120 2.926 2.344 3.617 . 0 0 "[ . 1 . 2]" 1
1035 1 99 ILE MG 1 145 TRP HD1 . . 4.610 4.218 3.228 4.630 0.020 6 0 "[ . 1 . 2]" 1
1036 1 31 TRP HD1 1 32 SER HA . . 4.100 3.759 3.339 4.140 0.040 1 0 "[ . 1 . 2]" 1
1037 1 31 TRP HD1 1 33 ALA H . . 5.130 3.757 3.094 5.191 0.061 19 0 "[ . 1 . 2]" 1
1038 1 104 VAL HA 1 152 TRP HH2 . . 5.000 4.944 4.704 5.090 0.090 19 0 "[ . 1 . 2]" 1
1039 1 12 ALA HA 1 152 TRP HH2 . . 4.850 4.643 4.410 4.800 . 0 0 "[ . 1 . 2]" 1
1040 1 104 VAL MG2 1 145 TRP HZ3 . . 5.010 3.682 2.563 4.887 . 0 0 "[ . 1 . 2]" 1
1041 1 104 VAL MG1 1 145 TRP HZ3 . . 5.010 4.726 3.542 5.022 0.012 16 0 "[ . 1 . 2]" 1
1042 1 101 TRP HE3 1 145 TRP HZ3 . . 4.840 3.537 3.196 3.869 . 0 0 "[ . 1 . 2]" 1
1043 1 101 TRP HZ3 1 152 TRP HZ3 . . 3.650 3.274 2.968 3.511 . 0 0 "[ . 1 . 2]" 1
1044 1 128 HIS HD2 1 129 ALA H . . 4.870 4.634 3.810 4.870 0.000 10 0 "[ . 1 . 2]" 1
1045 1 74 HIS H 1 74 HIS HD2 . . 4.650 4.150 3.206 4.624 . 0 0 "[ . 1 . 2]" 1
1046 1 66 TYR QE 1 110 VAL HA . . 5.180 4.809 4.311 5.060 . 0 0 "[ . 1 . 2]" 1
1047 1 19 TYR QE 1 51 LEU HB3 . . 4.070 2.771 1.955 3.848 . 0 0 "[ . 1 . 2]" 1
1048 1 16 GLY H 1 108 TYR QE . . 4.240 3.190 2.520 3.961 . 0 0 "[ . 1 . 2]" 1
1049 1 31 TRP HZ2 1 33 ALA HA . . 4.770 2.592 2.203 4.862 0.092 20 0 "[ . 1 . 2]" 1
1050 1 138 VAL MG2 1 152 TRP HZ2 . . 4.440 3.445 3.101 3.835 . 0 0 "[ . 1 . 2]" 1
1051 1 99 ILE MG 1 145 TRP HZ2 . . 5.050 3.845 3.319 4.434 . 0 0 "[ . 1 . 2]" 1
1052 1 101 TRP HE1 1 149 ARG HD3 . . 4.500 3.081 2.864 3.402 . 0 0 "[ . 1 . 2]" 1
1053 1 101 TRP HE1 1 149 ARG HE . . 3.500 3.437 3.268 3.530 0.030 9 0 "[ . 1 . 2]" 1
1054 1 149 ARG HE 1 154 ASP OD2 . . 1.800 2.053 2.031 2.081 0.281 10 0 "[ . 1 . 2]" 1
1055 1 149 ARG NE 1 154 ASP OD2 . . 2.700 2.826 2.797 2.919 0.219 10 0 "[ . 1 . 2]" 1
1056 1 101 TRP NE1 1 154 ASP OD1 . . 2.700 2.916 2.741 2.999 0.299 9 0 "[ . 1 . 2]" 1
1057 1 101 TRP HE1 1 154 ASP OD1 . . 1.800 2.058 2.025 2.108 0.308 9 0 "[ . 1 . 2]" 1
1058 1 101 TRP HZ2 1 154 ASP HB3 . . 3.700 2.099 1.851 2.402 . 0 0 "[ . 1 . 2]" 1
1059 1 101 TRP HZ2 1 154 ASP HA . . 4.690 4.736 4.636 4.843 0.153 15 0 "[ . 1 . 2]" 1
1060 1 101 TRP HZ2 1 154 ASP HB2 . . 3.700 2.677 2.038 3.466 . 0 0 "[ . 1 . 2]" 1
1061 1 101 TRP HE1 1 154 ASP HB2 . . 4.590 3.605 3.270 4.167 . 0 0 "[ . 1 . 2]" 1
1062 1 101 TRP HZ2 1 154 ASP H . . 3.870 3.582 3.403 3.922 0.052 13 0 "[ . 1 . 2]" 1
1063 1 66 TYR QD 1 110 VAL MG1 . . 4.300 4.420 4.341 4.506 0.206 19 0 "[ . 1 . 2]" 1
1064 1 66 TYR QD 1 110 VAL MG2 . . 3.890 3.499 3.430 3.618 . 0 0 "[ . 1 . 2]" 1
1065 1 66 TYR QD 1 109 ALA MB . . 5.000 3.207 2.966 3.401 . 0 0 "[ . 1 . 2]" 1
1066 1 66 TYR QE 1 109 ALA MB . . 4.500 2.320 2.009 2.660 . 0 0 "[ . 1 . 2]" 1
1067 1 63 PRO HA 1 66 TYR QD . . 4.500 4.573 4.454 4.673 0.173 4 0 "[ . 1 . 2]" 1
1068 1 63 PRO QG 1 66 TYR QE . . 4.900 4.957 4.827 5.025 0.125 1 0 "[ . 1 . 2]" 1
1069 1 65 VAL HB 1 68 ASN HD22 . . 4.500 3.088 2.903 4.375 . 0 0 "[ . 1 . 2]" 1
1070 1 65 VAL HB 1 68 ASN HD21 . . 4.500 4.588 4.517 4.704 0.204 12 0 "[ . 1 . 2]" 1
1071 1 68 ASN HD21 1 71 ARG QB . . 4.500 3.840 3.461 4.225 . 0 0 "[ . 1 . 2]" 1
1072 1 68 ASN HD22 1 71 ARG QB . . 4.500 4.547 4.329 4.659 0.159 19 0 "[ . 1 . 2]" 1
1073 1 80 GLU HA 1 126 MET ME . . 3.870 2.760 2.231 3.127 . 0 0 "[ . 1 . 2]" 1
1074 1 83 VAL MG1 1 126 MET ME . . 3.070 1.997 1.883 3.151 0.081 18 0 "[ . 1 . 2]" 1
1075 1 83 VAL MG2 1 126 MET ME . . 3.070 3.144 3.098 3.207 0.137 2 0 "[ . 1 . 2]" 1
1076 1 75 ILE MG 1 83 VAL HA . . 4.640 4.195 3.918 4.360 . 0 0 "[ . 1 . 2]" 1
1077 1 75 ILE MD 1 83 VAL HA . . 4.640 2.276 1.957 2.598 . 0 0 "[ . 1 . 2]" 1
1078 1 75 ILE MG 1 83 VAL HB . . 4.640 4.362 4.106 4.943 0.303 18 0 "[ . 1 . 2]" 1
1079 1 75 ILE MD 1 83 VAL HB . . 4.640 2.990 2.448 3.773 . 0 0 "[ . 1 . 2]" 1
1080 1 67 ARG HE 1 117 ASP OD1 . . 4.940 3.934 3.011 4.891 . 0 0 "[ . 1 . 2]" 1
1081 1 70 ALA HA 1 75 ILE MD . . 4.000 3.823 3.630 3.992 . 0 0 "[ . 1 . 2]" 1
1082 1 70 ALA HA 1 75 ILE MG . . 4.000 2.654 1.954 3.441 . 0 0 "[ . 1 . 2]" 1
1083 1 69 VAL MG2 1 70 ALA HA . . 4.000 3.503 3.288 3.678 . 0 0 "[ . 1 . 2]" 1
1084 1 69 VAL MG1 1 70 ALA HA . . 4.000 3.387 3.219 3.537 . 0 0 "[ . 1 . 2]" 1
1085 1 70 ALA MB 1 117 ASP HB3 . . 5.140 4.976 4.568 5.149 0.009 10 0 "[ . 1 . 2]" 1
1086 1 70 ALA MB 1 117 ASP HB2 . . 5.140 5.095 4.829 5.176 0.036 11 0 "[ . 1 . 2]" 1
1087 1 70 ALA MB 1 114 LEU MD1 . . 4.140 2.808 1.787 4.001 . 0 0 "[ . 1 . 2]" 1
1088 1 70 ALA MB 1 114 LEU MD2 . . 4.140 2.297 1.932 3.777 . 0 0 "[ . 1 . 2]" 1
1089 1 75 ILE QG 1 86 ALA MB . . 4.500 2.155 1.882 2.491 . 0 0 "[ . 1 . 2]" 1
1090 1 75 ILE MD 1 86 ALA MB . . 4.500 3.110 2.597 3.515 . 0 0 "[ . 1 . 2]" 1
1091 1 101 TRP HZ3 1 155 VAL QG . . 3.650 3.376 3.148 3.468 . 0 0 "[ . 1 . 2]" 1
1092 1 101 TRP HE3 1 155 VAL QG . . 3.650 2.526 2.268 2.789 . 0 0 "[ . 1 . 2]" 1
1093 1 31 TRP HZ3 1 127 VAL MG1 . . 4.000 3.851 2.833 4.045 0.045 8 0 "[ . 1 . 2]" 1
1094 1 31 TRP HZ3 1 127 VAL MG2 . . 4.000 3.355 1.949 4.006 0.006 7 0 "[ . 1 . 2]" 1
1095 1 31 TRP HE1 1 33 ALA MB . . 5.300 2.665 1.858 4.220 . 0 0 "[ . 1 . 2]" 1
1096 1 31 TRP HH2 1 33 ALA MB . . 4.900 4.875 3.186 5.016 0.116 4 0 "[ . 1 . 2]" 1
1097 1 31 TRP HZ2 1 33 ALA MB . . 4.500 3.123 2.031 3.853 . 0 0 "[ . 1 . 2]" 1
1098 1 5 ASP HB2 1 143 ALA MB . . 5.000 5.040 5.012 5.085 0.085 12 0 "[ . 1 . 2]" 1
1099 1 5 ASP HB3 1 143 ALA MB . . 5.000 4.917 4.334 5.056 0.056 16 0 "[ . 1 . 2]" 1
1100 1 5 ASP HA 1 139 ARG QG . . 5.300 4.572 3.153 5.382 0.082 10 0 "[ . 1 . 2]" 1
1101 1 92 GLY QA 1 137 PHE HZ . . 4.000 2.360 1.971 2.836 . 0 0 "[ . 1 . 2]" 1
1102 1 91 ALA HA 1 137 PHE HZ . . 4.500 4.547 4.520 4.595 0.095 17 0 "[ . 1 . 2]" 1
1103 1 91 ALA HA 1 137 PHE QE . . 4.800 4.355 4.170 4.553 . 0 0 "[ . 1 . 2]" 1
1104 1 91 ALA MB 1 137 PHE HZ . . 4.000 3.161 3.056 3.261 . 0 0 "[ . 1 . 2]" 1
1105 1 91 ALA MB 1 137 PHE QE . . 4.500 2.790 2.629 2.950 . 0 0 "[ . 1 . 2]" 1
1106 1 20 VAL MG1 1 127 VAL MG1 . . 3.530 2.349 2.023 2.572 . 0 0 "[ . 1 . 2]" 1
1107 1 20 VAL MG1 1 127 VAL MG2 . . 3.530 1.914 1.856 1.962 . 0 0 "[ . 1 . 2]" 1
1108 1 20 VAL MG2 1 127 VAL MG1 . . 3.530 3.189 2.923 3.535 0.005 20 0 "[ . 1 . 2]" 1
1109 1 20 VAL MG2 1 127 VAL MG2 . . 3.530 3.604 3.563 3.664 0.134 20 0 "[ . 1 . 2]" 1
1110 1 20 VAL MG1 1 115 ALA MB . . 3.850 1.781 1.715 1.970 . 0 0 "[ . 1 . 2]" 1
1111 1 94 ILE MG 1 103 LYS HG2 . . 3.680 2.286 1.891 3.052 . 0 0 "[ . 1 . 2]" 1
1112 1 94 ILE MG 1 103 LYS HB2 . . 4.380 4.263 4.045 4.416 0.036 19 0 "[ . 1 . 2]" 1
1113 1 94 ILE MG 1 103 LYS HB3 . . 4.380 3.644 2.865 4.131 . 0 0 "[ . 1 . 2]" 1
1114 1 100 THR MG 1 103 LYS HD2 . . 3.940 3.429 2.235 3.958 0.018 19 0 "[ . 1 . 2]" 1
1115 1 100 THR MG 1 103 LYS HD3 . . 3.940 3.705 2.883 3.963 0.023 10 0 "[ . 1 . 2]" 1
1116 1 65 VAL H 1 66 TYR H . . 3.570 2.705 2.029 3.189 . 0 0 "[ . 1 . 2]" 1
1117 1 66 TYR H 1 67 ARG H . . 3.570 2.776 2.415 3.066 . 0 0 "[ . 1 . 2]" 1
1118 1 69 VAL H 1 70 ALA H . . 3.270 2.899 2.847 2.950 . 0 0 "[ . 1 . 2]" 1
1119 1 71 ARG H 1 72 GLN H . . 3.270 2.664 2.638 2.743 . 0 0 "[ . 1 . 2]" 1
1120 1 72 GLN H 1 73 LEU H . . 3.270 2.669 2.640 2.701 . 0 0 "[ . 1 . 2]" 1
1121 1 73 LEU H 1 74 HIS H . . 3.270 2.048 1.990 2.421 . 0 0 "[ . 1 . 2]" 1
1122 1 75 ILE H 1 76 SER H . . 3.270 2.831 2.781 2.860 . 0 0 "[ . 1 . 2]" 1
1123 1 76 SER H 1 77 LEU H . . 3.570 3.226 3.003 3.464 . 0 0 "[ . 1 . 2]" 1
1124 1 79 SER H 1 80 GLU H . . 4.570 4.454 4.358 4.518 . 0 0 "[ . 1 . 2]" 1
1125 1 8 LEU H 1 9 VAL H . . 3.070 2.746 2.552 2.935 . 0 0 "[ . 1 . 2]" 1
1126 1 9 VAL H 1 10 ALA H . . 3.070 2.919 2.729 3.060 . 0 0 "[ . 1 . 2]" 1
1127 1 12 ALA H 1 13 LYS H . . 3.070 2.876 2.719 2.940 . 0 0 "[ . 1 . 2]" 1
1128 1 16 GLY H 1 17 ARG H . . 3.070 2.839 2.712 3.007 . 0 0 "[ . 1 . 2]" 1
1129 1 19 TYR H 1 20 VAL H . . 3.070 2.959 2.845 3.073 0.003 17 0 "[ . 1 . 2]" 1
1130 1 21 HIS H 1 22 ALA H . . 3.070 2.779 2.647 2.894 . 0 0 "[ . 1 . 2]" 1
1131 1 25 LEU H 1 26 ARG H . . 3.070 2.561 2.414 2.759 . 0 0 "[ . 1 . 2]" 1
1132 1 54 LEU H 1 55 GLY H . . 3.070 3.022 2.782 3.075 0.005 16 0 "[ . 1 . 2]" 1
1133 1 58 LEU H 1 59 GLU H . . 3.070 2.751 2.648 2.922 . 0 0 "[ . 1 . 2]" 1
1134 1 118 ALA H 1 119 VAL H . . 3.070 2.836 2.790 2.882 . 0 0 "[ . 1 . 2]" 1
1135 1 127 VAL H 1 128 HIS H . . 3.070 2.850 2.717 2.949 . 0 0 "[ . 1 . 2]" 1
1136 1 60 MET H 1 61 ILE H . . 3.070 2.321 2.260 2.463 . 0 0 "[ . 1 . 2]" 1
1137 1 49 ALA H 1 50 VAL H . . 3.070 2.825 2.767 2.883 . 0 0 "[ . 1 . 2]" 1
1138 1 130 LEU H 1 131 VAL H . . 3.570 2.837 2.725 2.965 . 0 0 "[ . 1 . 2]" 1
1139 1 132 ASP H 1 133 ALA H . . 3.570 2.770 2.701 2.826 . 0 0 "[ . 1 . 2]" 1
1140 1 134 LEU H 1 135 GLY H . . 3.570 2.921 2.839 2.990 . 0 0 "[ . 1 . 2]" 1
1141 1 138 VAL H 1 139 ARG H . . 3.070 2.354 2.328 2.430 . 0 0 "[ . 1 . 2]" 1
1142 1 144 THR H 1 146 LEU H . . 4.500 4.569 4.531 4.609 0.109 8 0 "[ . 1 . 2]" 1
1143 1 8 LEU HA 1 11 GLN QB . . 3.750 2.696 2.472 3.830 0.080 8 0 "[ . 1 . 2]" 1
1144 1 9 VAL HA 1 12 ALA MB . . 3.750 2.890 2.443 3.102 . 0 0 "[ . 1 . 2]" 1
1145 1 10 ALA HA 1 13 LYS QB . . 3.750 3.009 2.597 3.947 0.197 5 0 "[ . 1 . 2]" 1
1146 1 11 GLN HA 1 14 ALA MB . . 3.750 2.738 2.346 3.016 . 0 0 "[ . 1 . 2]" 1
1147 1 12 ALA HA 1 15 LEU HG . . 4.000 3.650 3.021 4.016 0.016 19 0 "[ . 1 . 2]" 1
1148 1 14 ALA HA 1 17 ARG QB . . 3.750 2.860 2.459 3.860 0.110 10 0 "[ . 1 . 2]" 1
1149 1 14 ALA HA 1 17 ARG QG . . 4.000 3.694 1.937 4.220 0.220 9 0 "[ . 1 . 2]" 1
1150 1 15 LEU HA 1 18 GLU QB . . 3.750 3.489 2.850 3.934 0.184 15 0 "[ . 1 . 2]" 1
1151 1 25 LEU MD2 1 31 TRP HD1 . . 4.200 4.229 4.116 4.265 0.065 20 0 "[ . 1 . 2]" 1
1152 1 25 LEU MD1 1 31 TRP HD1 . . 4.200 2.916 1.902 4.197 . 0 0 "[ . 1 . 2]" 1
1153 1 17 ARG HA 1 20 VAL HB . . 3.750 3.452 3.091 3.822 0.072 20 0 "[ . 1 . 2]" 1
1154 1 18 GLU HA 1 21 HIS QB . . 3.750 2.572 2.323 2.797 . 0 0 "[ . 1 . 2]" 1
1155 1 19 TYR HA 1 22 ALA MB . . 3.750 2.782 2.500 3.136 . 0 0 "[ . 1 . 2]" 1
1156 1 22 ALA HA 1 25 LEU HB2 . . 3.750 3.418 2.669 3.795 0.045 11 0 "[ . 1 . 2]" 1
1157 1 22 ALA HA 1 25 LEU HB3 . . 3.750 3.839 3.778 3.946 0.196 20 0 "[ . 1 . 2]" 1
1158 1 23 ARG HD2 1 112 ALA MB . . 4.250 4.108 3.011 4.417 0.167 11 0 "[ . 1 . 2]" 1
1159 1 23 ARG HD3 1 112 ALA MB . . 4.250 4.207 3.684 4.374 0.124 13 0 "[ . 1 . 2]" 1
1160 1 56 ASP H 1 66 TYR QE . . 5.200 5.283 5.225 5.345 0.145 8 0 "[ . 1 . 2]" 1
1161 1 55 GLY H 1 66 TYR QE . . 5.300 5.383 5.110 5.542 0.242 11 0 "[ . 1 . 2]" 1
1162 1 24 LEU HA 1 27 ALA MB . . 3.750 2.859 2.061 3.533 . 0 0 "[ . 1 . 2]" 1
1163 1 127 VAL HA 1 130 LEU H . . 4.500 3.984 3.822 4.135 . 0 0 "[ . 1 . 2]" 1
1164 1 128 HIS HA 1 131 VAL H . . 4.500 3.848 3.707 3.947 . 0 0 "[ . 1 . 2]" 1
1165 1 128 HIS HA 1 132 ASP H . . 5.000 3.875 3.715 4.104 . 0 0 "[ . 1 . 2]" 1
1166 1 57 GLU HA 1 58 LEU H . . 3.500 3.553 3.531 3.571 0.071 12 0 "[ . 1 . 2]" 1
1167 1 57 GLU HA 1 60 MET H . . 3.800 3.549 3.492 3.613 . 0 0 "[ . 1 . 2]" 1
1168 1 57 GLU HA 1 61 ILE H . . 4.500 4.255 3.872 4.453 . 0 0 "[ . 1 . 2]" 1
1169 1 58 LEU HA 1 59 GLU H . . 3.500 3.555 3.539 3.568 0.068 3 0 "[ . 1 . 2]" 1
1170 1 58 LEU HA 1 60 MET H . . 3.800 3.909 3.869 4.051 0.251 17 0 "[ . 1 . 2]" 1
1171 1 58 LEU HA 1 61 ILE H . . 4.200 3.304 3.175 3.449 . 0 0 "[ . 1 . 2]" 1
1172 1 61 ILE HA 1 62 ARG H . . 3.500 3.571 3.567 3.572 0.072 8 0 "[ . 1 . 2]" 1
1173 1 63 PRO HA 1 64 SER H . . 3.500 2.181 2.155 2.251 . 0 0 "[ . 1 . 2]" 1
1174 1 65 VAL HA 1 68 ASN H . . 4.500 3.900 3.191 4.870 0.370 19 0 "[ . 1 . 2]" 1
1175 1 65 VAL HA 1 66 TYR H . . 3.500 2.756 2.300 3.560 0.060 4 0 "[ . 1 . 2]" 1
1176 1 66 TYR HA 1 69 VAL H . . 4.800 4.753 3.753 4.944 0.144 8 0 "[ . 1 . 2]" 1
1177 1 66 TYR HA 1 68 ASN H . . 5.000 4.834 4.656 5.141 0.141 17 0 "[ . 1 . 2]" 1
1178 1 67 ARG HA 1 68 ASN H . . 3.500 3.159 2.531 3.570 0.070 14 0 "[ . 1 . 2]" 1
1179 1 67 ARG HA 1 69 VAL H . . 5.000 4.101 3.676 4.986 . 0 0 "[ . 1 . 2]" 1
1180 1 68 ASN HA 1 70 ALA H . . 4.500 3.875 3.541 4.052 . 0 0 "[ . 1 . 2]" 1
1181 1 69 VAL HA 1 73 LEU H . . 5.000 5.029 4.943 5.097 0.097 14 0 "[ . 1 . 2]" 1
1182 1 70 ALA HA 1 71 ARG H . . 3.500 3.558 3.551 3.563 0.063 7 0 "[ . 1 . 2]" 1
1183 1 70 ALA HA 1 73 LEU H . . 4.500 3.717 3.469 3.843 . 0 0 "[ . 1 . 2]" 1
1184 1 70 ALA HA 1 75 ILE H . . 4.000 3.617 3.350 4.047 0.047 14 0 "[ . 1 . 2]" 1
1185 1 71 ARG HA 1 72 GLN H . . 3.500 3.509 3.503 3.513 0.013 4 0 "[ . 1 . 2]" 1
1186 1 78 GLN HA 1 79 SER H . . 3.500 3.471 3.372 3.548 0.048 20 0 "[ . 1 . 2]" 1
1187 1 9 VAL HA 1 12 ALA H . . 4.500 3.893 3.613 4.104 . 0 0 "[ . 1 . 2]" 1
1188 1 9 VAL HA 1 13 LYS H . . 5.200 3.872 3.718 4.184 . 0 0 "[ . 1 . 2]" 1
1189 1 10 ALA HA 1 13 LYS H . . 4.500 3.863 3.637 4.002 . 0 0 "[ . 1 . 2]" 1
1190 1 10 ALA HA 1 14 ALA H . . 5.200 4.038 3.842 4.297 . 0 0 "[ . 1 . 2]" 1
1191 1 11 GLN HA 1 13 LYS H . . 4.500 4.495 4.254 4.654 0.154 9 0 "[ . 1 . 2]" 1
1192 1 11 GLN HA 1 14 ALA H . . 4.500 3.640 3.461 3.842 . 0 0 "[ . 1 . 2]" 1
1193 1 11 GLN HA 1 15 LEU H . . 5.200 4.066 3.732 4.313 . 0 0 "[ . 1 . 2]" 1
1194 1 13 LYS HA 1 16 GLY H . . 4.500 3.776 3.469 4.036 . 0 0 "[ . 1 . 2]" 1
1195 1 88 LEU HA 1 91 ALA H . . 4.500 3.602 3.477 3.742 . 0 0 "[ . 1 . 2]" 1
1196 1 88 LEU HA 1 92 GLY H . . 5.000 3.897 3.701 4.033 . 0 0 "[ . 1 . 2]" 1
1197 1 87 PHE HA 1 90 VAL H . . 4.500 3.710 3.581 3.914 . 0 0 "[ . 1 . 2]" 1
1198 1 89 ALA HA 1 92 GLY H . . 4.500 3.916 3.734 4.024 . 0 0 "[ . 1 . 2]" 1
1199 1 91 ALA HA 1 95 PHE H . . 4.800 4.144 3.845 4.266 . 0 0 "[ . 1 . 2]" 1
1200 1 69 VAL MG1 1 114 LEU MD1 . . 3.940 1.940 1.749 3.036 . 0 0 "[ . 1 . 2]" 1
1201 1 69 VAL MG2 1 114 LEU MD1 . . 3.940 3.523 3.013 4.017 0.077 14 0 "[ . 1 . 2]" 1
1202 1 69 VAL MG1 1 114 LEU MD2 . . 3.940 2.817 1.764 3.229 . 0 0 "[ . 1 . 2]" 1
1203 1 69 VAL MG2 1 114 LEU MD2 . . 3.940 3.820 3.197 3.996 0.056 1 0 "[ . 1 . 2]" 1
1204 1 40 VAL MG1 1 45 ALA MB . . 3.800 3.037 2.477 4.009 0.209 14 0 "[ . 1 . 2]" 1
1205 1 40 VAL MG2 1 45 ALA MB . . 3.800 2.779 1.964 3.323 . 0 0 "[ . 1 . 2]" 1
1206 1 40 VAL HB 1 44 LEU MD1 . . 4.300 4.200 3.645 4.371 0.071 12 0 "[ . 1 . 2]" 1
1207 1 40 VAL HB 1 44 LEU MD2 . . 4.300 4.029 3.421 4.366 0.066 8 0 "[ . 1 . 2]" 1
1208 1 73 LEU HG 1 86 ALA MB . . 4.500 4.470 4.191 4.546 0.046 2 0 "[ . 1 . 2]" 1
1209 1 50 VAL HA 1 53 ARG QB . . 4.500 4.183 2.545 4.306 . 0 0 "[ . 1 . 2]" 1
1210 1 54 LEU HA 1 57 GLU QB . . 4.000 3.334 3.070 3.567 . 0 0 "[ . 1 . 2]" 1
1211 1 56 ASP HA 1 59 GLU QB . . 4.000 3.218 2.864 3.791 . 0 0 "[ . 1 . 2]" 1
1212 1 57 GLU HA 1 60 MET HB2 . . 4.500 2.562 2.390 3.267 . 0 0 "[ . 1 . 2]" 1
1213 1 57 GLU HA 1 60 MET HB3 . . 4.500 3.972 3.623 4.511 0.011 17 0 "[ . 1 . 2]" 1
1214 1 58 LEU HA 1 61 ILE HB . . 4.000 2.869 2.603 3.140 . 0 0 "[ . 1 . 2]" 1
1215 1 58 LEU HA 1 61 ILE MD . . 4.500 2.659 1.901 4.661 0.161 3 0 "[ . 1 . 2]" 1
1216 1 20 VAL HA 1 112 ALA HA . . 4.070 2.688 2.424 3.015 . 0 0 "[ . 1 . 2]" 1
1217 1 20 VAL MG2 1 112 ALA MB . . 3.570 2.729 2.433 3.015 . 0 0 "[ . 1 . 2]" 1
1218 1 104 VAL MG1 1 108 TYR QE . . 4.200 2.371 1.882 4.283 0.083 19 0 "[ . 1 . 2]" 1
1219 1 104 VAL MG2 1 108 TYR QE . . 4.200 3.597 2.018 4.384 0.184 8 0 "[ . 1 . 2]" 1
1220 1 19 TYR QD 1 52 LEU HA . . 4.600 3.859 2.794 4.398 . 0 0 "[ . 1 . 2]" 1
1221 1 19 TYR QE 1 108 TYR HA . . 4.350 4.410 3.969 4.584 0.234 19 0 "[ . 1 . 2]" 1
1222 1 19 TYR QE 1 108 TYR HB2 . . 3.500 3.149 2.606 3.661 0.161 8 0 "[ . 1 . 2]" 1
1223 1 19 TYR QE 1 108 TYR HB3 . . 3.500 2.356 1.990 2.934 . 0 0 "[ . 1 . 2]" 1
1224 1 15 LEU MD2 1 51 LEU MD1 . . 4.500 2.012 1.835 3.544 . 0 0 "[ . 1 . 2]" 1
1225 1 15 LEU MD1 1 51 LEU MD1 . . 4.500 2.382 1.824 3.091 . 0 0 "[ . 1 . 2]" 1
1226 1 15 LEU MD2 1 51 LEU MD2 . . 4.500 3.984 3.685 4.386 . 0 0 "[ . 1 . 2]" 1
1227 1 15 LEU MD1 1 51 LEU MD2 . . 4.500 3.612 1.762 4.376 . 0 0 "[ . 1 . 2]" 1
1228 1 3 PRO HA 1 6 LYS HB3 . . 4.900 4.547 3.708 5.072 0.172 3 0 "[ . 1 . 2]" 1
1229 1 3 PRO HA 1 6 LYS HB2 . . 4.500 3.232 2.252 4.546 0.046 9 0 "[ . 1 . 2]" 1
1230 1 19 TYR QE 1 109 ALA H . . 4.500 2.968 2.659 3.753 . 0 0 "[ . 1 . 2]" 1
1231 1 19 TYR QE 1 109 ALA HA . . 4.000 2.484 1.936 3.306 . 0 0 "[ . 1 . 2]" 1
1232 1 3 PRO QB 1 4 THR H . . 3.780 2.867 1.923 3.971 0.191 9 0 "[ . 1 . 2]" 1
1233 1 5 ASP H 1 5 ASP QB . . 3.290 2.404 2.046 2.775 . 0 0 "[ . 1 . 2]" 1
1234 1 5 ASP H 1 6 LYS QG . . 4.280 4.050 3.381 4.311 0.031 3 0 "[ . 1 . 2]" 1
1235 1 5 ASP HA 1 8 LEU QD . . 3.750 3.270 2.795 3.663 . 0 0 "[ . 1 . 2]" 1
1236 1 5 ASP QB 1 6 LYS H . . 3.350 3.247 2.717 3.505 0.155 11 0 "[ . 1 . 2]" 1
1237 1 5 ASP QB 1 6 LYS QE . . 4.110 4.030 3.749 4.290 0.180 1 0 "[ . 1 . 2]" 1
1238 1 6 LYS H 1 6 LYS QB . . 3.040 2.461 2.236 2.657 . 0 0 "[ . 1 . 2]" 1
1239 1 6 LYS HA 1 6 LYS QG . . 3.520 2.730 2.549 3.336 . 0 0 "[ . 1 . 2]" 1
1240 1 6 LYS QB 1 6 LYS QD . . 3.040 2.151 1.959 2.923 . 0 0 "[ . 1 . 2]" 1
1241 1 6 LYS QB 1 6 LYS QE . . 3.200 3.026 1.957 3.312 0.112 11 0 "[ . 1 . 2]" 1
1242 1 6 LYS QB 1 7 GLU H . . 3.390 2.657 2.344 3.387 . 0 0 "[ . 1 . 2]" 1
1243 1 6 LYS QE 1 6 LYS QG . . 3.430 2.070 1.967 2.399 . 0 0 "[ . 1 . 2]" 1
1244 1 6 LYS QE 1 9 VAL QG . . 4.050 3.109 2.519 4.181 0.131 9 0 "[ . 1 . 2]" 1
1245 1 8 LEU H 1 8 LEU QB . . 3.240 2.436 2.027 2.659 . 0 0 "[ . 1 . 2]" 1
1246 1 8 LEU H 1 8 LEU QD . . 3.850 2.767 2.405 3.136 . 0 0 "[ . 1 . 2]" 1
1247 1 8 LEU HA 1 8 LEU QD . . 3.060 2.108 1.938 2.211 . 0 0 "[ . 1 . 2]" 1
1248 1 8 LEU HA 1 11 GLN QG . . 3.930 3.797 2.301 4.004 0.074 5 0 "[ . 1 . 2]" 1
1249 1 8 LEU QB 1 9 VAL H . . 3.710 2.356 2.097 2.700 . 0 0 "[ . 1 . 2]" 1
1250 1 8 LEU QB 1 139 ARG HA . . 3.720 3.280 2.865 3.755 0.035 12 0 "[ . 1 . 2]" 1
1251 1 8 LEU QB 1 139 ARG QB . . 3.570 3.206 2.852 3.588 0.018 15 0 "[ . 1 . 2]" 1
1252 1 8 LEU QD 1 146 LEU QD . . 3.880 2.529 1.714 3.057 . 0 0 "[ . 1 . 2]" 1
1253 1 8 LEU QD 1 147 ARG H . . 3.510 3.001 2.663 3.430 . 0 0 "[ . 1 . 2]" 1
1254 1 8 LEU QD 1 147 ARG HA . . 3.240 2.976 2.642 3.319 0.079 17 0 "[ . 1 . 2]" 1
1255 1 8 LEU QD 1 151 GLY QA . . 3.510 3.369 2.824 3.539 0.029 2 0 "[ . 1 . 2]" 1
1256 1 8 LEU QD 1 152 TRP HD1 . . 4.030 3.426 3.063 3.737 . 0 0 "[ . 1 . 2]" 1
1257 1 8 LEU QD 1 152 TRP HE1 . . 3.940 2.809 2.511 3.145 . 0 0 "[ . 1 . 2]" 1
1258 1 9 VAL H 1 9 VAL QG . . 3.300 2.136 1.927 2.309 . 0 0 "[ . 1 . 2]" 1
1259 1 9 VAL QG 1 10 ALA HA . . 4.260 3.331 3.132 3.516 . 0 0 "[ . 1 . 2]" 1
1260 1 9 VAL QG 1 135 GLY QA . . 3.740 3.554 3.064 3.813 0.073 7 0 "[ . 1 . 2]" 1
1261 1 9 VAL QG 1 139 ARG HA . . 3.820 3.766 3.488 3.922 0.102 20 0 "[ . 1 . 2]" 1
1262 1 9 VAL QG 1 139 ARG QB . . 3.840 1.889 1.757 1.982 . 0 0 "[ . 1 . 2]" 1
1263 1 9 VAL QG 1 139 ARG QD . . 4.140 2.059 1.715 3.231 . 0 0 "[ . 1 . 2]" 1
1264 1 11 GLN H 1 11 GLN QE . . 5.420 5.107 4.670 5.564 0.144 5 0 "[ . 1 . 2]" 1
1265 1 11 GLN HA 1 11 GLN QG . . 3.580 2.637 2.047 3.461 . 0 0 "[ . 1 . 2]" 1
1266 1 11 GLN HA 1 11 GLN QE . . 4.130 3.099 2.654 3.961 . 0 0 "[ . 1 . 2]" 1
1267 1 11 GLN HA 1 44 LEU QD . . 3.260 1.959 1.784 2.397 . 0 0 "[ . 1 . 2]" 1
1268 1 11 GLN QB 1 44 LEU QD . . 3.650 3.026 1.779 3.323 . 0 0 "[ . 1 . 2]" 1
1269 1 11 GLN QG 1 44 LEU QD . . 3.270 2.852 1.873 3.368 0.098 3 0 "[ . 1 . 2]" 1
1270 1 11 GLN QE 1 15 LEU QB . . 3.990 4.009 3.858 4.124 0.134 19 0 "[ . 1 . 2]" 1
1271 1 11 GLN QE 1 44 LEU QB . . 4.500 3.607 2.986 4.573 0.073 5 0 "[ . 1 . 2]" 1
1272 1 12 ALA H 1 138 VAL QG . . 5.200 4.091 3.740 4.572 . 0 0 "[ . 1 . 2]" 1
1273 1 12 ALA HA 1 15 LEU QB . . 3.690 2.883 2.532 3.404 . 0 0 "[ . 1 . 2]" 1
1274 1 12 ALA HA 1 15 LEU QD . . 3.670 2.458 1.910 3.188 . 0 0 "[ . 1 . 2]" 1
1275 1 12 ALA HA 1 138 VAL QG . . 4.450 3.718 3.390 4.149 . 0 0 "[ . 1 . 2]" 1
1276 1 12 ALA MB 1 15 LEU QB . . 4.430 4.163 3.948 4.518 0.088 15 0 "[ . 1 . 2]" 1
1277 1 12 ALA MB 1 15 LEU QD . . 4.320 3.662 3.151 4.331 0.011 19 0 "[ . 1 . 2]" 1
1278 1 12 ALA MB 1 138 VAL QG . . 3.800 2.115 1.780 2.442 . 0 0 "[ . 1 . 2]" 1
1279 1 15 LEU H 1 15 LEU QB . . 3.340 2.457 2.136 2.572 . 0 0 "[ . 1 . 2]" 1
1280 1 15 LEU HA 1 15 LEU QD . . 3.150 2.163 1.943 2.585 . 0 0 "[ . 1 . 2]" 1
1281 1 15 LEU HA 1 51 LEU QD . . 3.640 3.725 3.669 3.989 0.349 19 0 "[ . 1 . 2]" 1
1282 1 15 LEU QD 1 44 LEU HA . . 4.310 3.471 3.047 3.879 . 0 0 "[ . 1 . 2]" 1
1283 1 15 LEU QD 1 44 LEU QB . . 4.180 4.010 3.735 4.273 0.093 19 0 "[ . 1 . 2]" 1
1284 1 15 LEU QD 1 44 LEU QD . . 4.130 2.890 2.211 3.658 . 0 0 "[ . 1 . 2]" 1
1285 1 15 LEU QD 1 47 VAL HB . . 3.530 2.352 1.939 2.859 . 0 0 "[ . 1 . 2]" 1
1286 1 15 LEU QD 1 48 ALA H . . 3.440 2.459 2.193 3.094 . 0 0 "[ . 1 . 2]" 1
1287 1 15 LEU QD 1 48 ALA HA . . 3.640 1.932 1.857 2.153 . 0 0 "[ . 1 . 2]" 1
1288 1 15 LEU QD 1 48 ALA MB . . 3.250 2.018 1.831 2.574 . 0 0 "[ . 1 . 2]" 1
1289 1 15 LEU QD 1 51 LEU QD . . 3.020 1.786 1.624 1.902 . 0 0 "[ . 1 . 2]" 1
1290 1 15 LEU QD 1 108 TYR QE . . 3.640 3.092 2.624 3.642 0.002 2 0 "[ . 1 . 2]" 1
1291 1 15 LEU QD 1 152 TRP QB . . 3.920 3.378 2.969 3.797 . 0 0 "[ . 1 . 2]" 1
1292 1 15 LEU QD 1 152 TRP HZ3 . . 4.470 3.423 2.982 4.120 . 0 0 "[ . 1 . 2]" 1
1293 1 15 LEU QD 1 152 TRP HH2 . . 4.170 3.613 2.971 4.235 0.065 19 0 "[ . 1 . 2]" 1
1294 1 16 GLY H 1 134 LEU QD . . 5.160 4.040 3.244 4.612 . 0 0 "[ . 1 . 2]" 1
1295 1 16 GLY QA 1 19 TYR QB . . 3.920 2.474 2.107 2.848 . 0 0 "[ . 1 . 2]" 1
1296 1 16 GLY QA 1 108 TYR QD . . 3.770 2.980 2.659 3.261 . 0 0 "[ . 1 . 2]" 1
1297 1 17 ARG HA 1 20 VAL QG . . 3.980 3.399 3.005 3.917 . 0 0 "[ . 1 . 2]" 1
1298 1 18 GLU HA 1 18 GLU QG . . 3.600 2.522 2.011 3.452 . 0 0 "[ . 1 . 2]" 1
1299 1 19 TYR H 1 20 VAL QG . . 5.100 4.326 4.145 4.591 . 0 0 "[ . 1 . 2]" 1
1300 1 19 TYR H 1 52 LEU QD . . 4.210 3.789 3.342 4.262 0.052 5 0 "[ . 1 . 2]" 1
1301 1 19 TYR HA 1 52 LEU QD . . 3.400 2.128 1.890 2.458 . 0 0 "[ . 1 . 2]" 1
1302 1 19 TYR QB 1 20 VAL H . . 3.380 2.079 1.967 2.299 . 0 0 "[ . 1 . 2]" 1
1303 1 19 TYR QB 1 52 LEU QD . . 3.600 3.425 2.747 3.657 0.057 19 0 "[ . 1 . 2]" 1
1304 1 19 TYR QB 1 112 ALA MB . . 5.010 3.162 2.584 3.925 . 0 0 "[ . 1 . 2]" 1
1305 1 19 TYR QD 1 20 VAL QG . . 5.140 4.050 2.925 4.459 . 0 0 "[ . 1 . 2]" 1
1306 1 19 TYR QD 1 52 LEU QD . . 3.970 2.532 1.946 3.207 . 0 0 "[ . 1 . 2]" 1
1307 1 19 TYR QE 1 51 LEU QB . . 3.470 2.578 1.928 3.517 0.047 17 0 "[ . 1 . 2]" 1
1308 1 19 TYR QE 1 52 LEU QD . . 3.540 3.170 2.829 3.666 0.126 3 0 "[ . 1 . 2]" 1
1309 1 20 VAL H 1 20 VAL QG . . 3.030 2.178 2.043 2.339 . 0 0 "[ . 1 . 2]" 1
1310 1 20 VAL HA 1 23 ARG QB . . 4.400 3.065 2.702 3.346 . 0 0 "[ . 1 . 2]" 1
1311 1 20 VAL HB 1 127 VAL QG . . 4.610 2.963 2.789 3.185 . 0 0 "[ . 1 . 2]" 1
1312 1 20 VAL QG 1 21 HIS H . . 3.580 3.112 3.032 3.194 . 0 0 "[ . 1 . 2]" 1
1313 1 20 VAL QG 1 21 HIS QB . . 4.180 4.009 3.881 4.131 . 0 0 "[ . 1 . 2]" 1
1314 1 20 VAL QG 1 111 ALA MB . . 4.260 3.308 2.986 3.546 . 0 0 "[ . 1 . 2]" 1
1315 1 20 VAL QG 1 115 ALA MB . . 3.240 1.745 1.645 1.929 . 0 0 "[ . 1 . 2]" 1
1316 1 20 VAL QG 1 127 VAL HA . . 4.550 2.690 2.485 2.906 . 0 0 "[ . 1 . 2]" 1
1317 1 21 HIS H 1 127 VAL QG . . 4.360 4.376 4.238 4.434 0.074 16 0 "[ . 1 . 2]" 1
1318 1 21 HIS HA 1 24 LEU QB . . 4.400 2.417 2.196 2.748 . 0 0 "[ . 1 . 2]" 1
1319 1 21 HIS HA 1 24 LEU QD . . 4.470 2.452 2.287 2.605 . 0 0 "[ . 1 . 2]" 1
1320 1 21 HIS QB 1 24 LEU QD . . 3.580 3.668 3.510 3.747 0.167 20 0 "[ . 1 . 2]" 1
1321 1 21 HIS HD2 1 24 LEU QD . . 4.420 3.712 2.088 4.473 0.053 19 0 "[ . 1 . 2]" 1
1322 1 21 HIS HD2 1 25 LEU QB . . 4.800 3.575 2.683 4.703 . 0 0 "[ . 1 . 2]" 1
1323 1 21 HIS HE1 1 25 LEU QB . . 4.480 4.429 4.091 4.555 0.075 5 0 "[ . 1 . 2]" 1
1324 1 21 HIS HE1 1 25 LEU QD . . 3.880 2.963 2.319 3.695 . 0 0 "[ . 1 . 2]" 1
1325 1 22 ALA H 1 52 LEU QD . . 4.850 4.006 3.481 4.598 . 0 0 "[ . 1 . 2]" 1
1326 1 22 ALA MB 1 52 LEU QD . . 3.810 2.276 1.823 2.970 . 0 0 "[ . 1 . 2]" 1
1327 1 23 ARG H 1 116 VAL QG . . 4.790 4.178 3.974 4.516 . 0 0 "[ . 1 . 2]" 1
1328 1 23 ARG QB 1 23 ARG QD . . 3.490 2.306 1.894 2.624 . 0 0 "[ . 1 . 2]" 1
1329 1 23 ARG QB 1 23 ARG HE . . 4.330 2.841 2.350 3.658 . 0 0 "[ . 1 . 2]" 1
1330 1 23 ARG QB 1 24 LEU H . . 3.640 2.659 2.449 2.941 . 0 0 "[ . 1 . 2]" 1
1331 1 23 ARG QG 1 24 LEU H . . 4.620 3.860 3.574 4.534 . 0 0 "[ . 1 . 2]" 1
1332 1 23 ARG QD 1 59 GLU QG . . 3.800 3.838 3.699 3.950 0.150 3 0 "[ . 1 . 2]" 1
1333 1 24 LEU H 1 24 LEU QB . . 3.470 2.117 2.074 2.215 . 0 0 "[ . 1 . 2]" 1
1334 1 24 LEU H 1 24 LEU QD . . 3.950 3.484 3.278 3.755 . 0 0 "[ . 1 . 2]" 1
1335 1 24 LEU HA 1 24 LEU QD . . 3.970 2.951 2.143 3.255 . 0 0 "[ . 1 . 2]" 1
1336 1 24 LEU QB 1 25 LEU H . . 3.390 2.606 2.327 2.728 . 0 0 "[ . 1 . 2]" 1
1337 1 24 LEU QD 1 25 LEU H . . 4.310 2.541 1.921 3.643 . 0 0 "[ . 1 . 2]" 1
1338 1 24 LEU QD 1 25 LEU HA . . 3.760 2.968 2.504 3.770 0.010 1 0 "[ . 1 . 2]" 1
1339 1 24 LEU QD 1 30 SER H . . 5.170 5.066 4.057 5.246 0.076 13 0 "[ . 1 . 2]" 1
1340 1 24 LEU QD 1 31 TRP HA . . 4.400 3.876 3.213 4.344 . 0 0 "[ . 1 . 2]" 1
1341 1 24 LEU QD 1 31 TRP QB . . 3.510 1.995 1.758 2.506 . 0 0 "[ . 1 . 2]" 1
1342 1 24 LEU QD 1 31 TRP HD1 . . 4.410 3.314 2.799 4.066 . 0 0 "[ . 1 . 2]" 1
1343 1 24 LEU QD 1 31 TRP HE3 . . 3.980 2.440 1.808 3.122 . 0 0 "[ . 1 . 2]" 1
1344 1 24 LEU QD 1 31 TRP HE1 . . 4.470 3.805 3.364 4.476 0.006 20 0 "[ . 1 . 2]" 1
1345 1 25 LEU H 1 25 LEU QB . . 3.900 2.059 2.022 2.112 . 0 0 "[ . 1 . 2]" 1
1346 1 25 LEU HA 1 25 LEU QD . . 3.170 2.293 1.963 2.921 . 0 0 "[ . 1 . 2]" 1
1347 1 25 LEU QB 1 26 ARG H . . 3.290 2.918 2.503 3.089 . 0 0 "[ . 1 . 2]" 1
1348 1 25 LEU HG 1 31 TRP QB . . 3.130 3.150 2.812 3.198 0.068 14 0 "[ . 1 . 2]" 1
1349 1 25 LEU QD 1 31 TRP QB . . 3.710 3.138 1.940 3.657 . 0 0 "[ . 1 . 2]" 1
1350 1 25 LEU QD 1 31 TRP HE1 . . 4.470 4.212 3.612 4.566 0.096 20 0 "[ . 1 . 2]" 1
1351 1 27 ALA MB 1 29 LEU QD . . 3.120 2.576 1.815 3.180 0.060 1 0 "[ . 1 . 2]" 1
1352 1 28 GLY H 1 29 LEU QD . . 4.960 3.276 2.415 4.016 . 0 0 "[ . 1 . 2]" 1
1353 1 28 GLY QA 1 29 LEU QD . . 5.250 3.865 3.497 4.487 . 0 0 "[ . 1 . 2]" 1
1354 1 29 LEU H 1 29 LEU QB . . 3.590 3.174 2.198 3.398 . 0 0 "[ . 1 . 2]" 1
1355 1 29 LEU HA 1 29 LEU QD . . 3.380 3.173 2.048 3.436 0.056 6 0 "[ . 1 . 2]" 1
1356 1 29 LEU QB 1 30 SER H . . 3.400 2.190 1.921 2.658 . 0 0 "[ . 1 . 2]" 1
1357 1 29 LEU HG 1 119 VAL QG . . 4.280 4.040 3.417 4.330 0.050 1 0 "[ . 1 . 2]" 1
1358 1 29 LEU QD 1 30 SER H . . 3.550 2.932 2.076 3.584 0.034 1 0 "[ . 1 . 2]" 1
1359 1 29 LEU QD 1 119 VAL HB . . 3.920 3.317 2.454 3.999 0.079 18 0 "[ . 1 . 2]" 1
1360 1 29 LEU QD 1 119 VAL QG . . 3.110 1.880 1.568 3.105 . 0 0 "[ . 1 . 2]" 1
1361 1 29 LEU QD 1 120 ARG H . . 3.720 3.427 3.013 3.736 0.016 16 0 "[ . 1 . 2]" 1
1362 1 29 LEU QD 1 120 ARG HA . . 3.370 2.783 1.866 3.378 0.008 14 0 "[ . 1 . 2]" 1
1363 1 29 LEU QD 1 120 ARG QB . . 3.340 3.061 2.575 3.369 0.029 2 0 "[ . 1 . 2]" 1
1364 1 29 LEU QD 1 120 ARG QG . . 3.670 1.934 1.650 2.625 . 0 0 "[ . 1 . 2]" 1
1365 1 29 LEU QD 1 120 ARG QD . . 3.130 2.928 1.975 3.148 0.018 6 0 "[ . 1 . 2]" 1
1366 1 31 TRP H 1 31 TRP QB . . 3.490 2.733 2.217 2.991 . 0 0 "[ . 1 . 2]" 1
1367 1 31 TRP HZ2 1 34 PRO QB . . 5.300 5.169 4.100 5.737 0.437 20 0 "[ . 1 . 2]" 1
1368 1 31 TRP HZ2 1 127 VAL QG . . 3.980 4.012 3.408 4.273 0.293 20 0 "[ . 1 . 2]" 1
1369 1 31 TRP HH2 1 127 VAL QG . . 4.470 2.846 2.475 3.196 . 0 0 "[ . 1 . 2]" 1
1370 1 34 PRO QB 1 35 GLU H . . 4.000 3.101 2.840 4.001 0.001 8 0 "[ . 1 . 2]" 1
1371 1 35 GLU H 1 35 GLU QB . . 3.010 2.726 2.168 3.111 0.101 16 0 "[ . 1 . 2]" 1
1372 1 35 GLU QB 1 36 ARG H . . 4.070 2.838 1.945 3.989 . 0 0 "[ . 1 . 2]" 1
1373 1 36 ARG H 1 36 ARG QB . . 3.190 2.858 2.202 3.304 0.114 4 0 "[ . 1 . 2]" 1
1374 1 36 ARG QB 1 36 ARG QD . . 3.130 2.114 1.963 2.387 . 0 0 "[ . 1 . 2]" 1
1375 1 38 ALA H 1 39 PRO QD . . 4.470 4.273 4.100 4.328 . 0 0 "[ . 1 . 2]" 1
1376 1 38 ALA MB 1 39 PRO QD . . 3.930 2.035 1.935 2.178 . 0 0 "[ . 1 . 2]" 1
1377 1 39 PRO HA 1 40 VAL QG . . 3.680 3.391 2.942 3.690 0.010 8 0 "[ . 1 . 2]" 1
1378 1 39 PRO QB 1 40 VAL H . . 3.270 2.471 2.004 3.163 . 0 0 "[ . 1 . 2]" 1
1379 1 40 VAL H 1 40 VAL QG . . 3.070 2.425 2.007 2.830 . 0 0 "[ . 1 . 2]" 1
1380 1 40 VAL HB 1 41 PRO QD . . 4.130 3.364 2.055 3.989 . 0 0 "[ . 1 . 2]" 1
1381 1 40 VAL QG 1 41 PRO QG . . 3.680 3.182 2.957 3.964 0.284 10 0 "[ . 1 . 2]" 1
1382 1 40 VAL QG 1 41 PRO QD . . 3.500 2.008 1.872 2.940 . 0 0 "[ . 1 . 2]" 1
1383 1 40 VAL QG 1 44 LEU QB . . 3.040 1.907 1.781 2.542 . 0 0 "[ . 1 . 2]" 1
1384 1 40 VAL QG 1 44 LEU QD . . 3.370 2.172 1.716 2.730 . 0 0 "[ . 1 . 2]" 1
1385 1 40 VAL QG 1 45 ALA H . . 3.450 2.628 1.895 3.388 . 0 0 "[ . 1 . 2]" 1
1386 1 40 VAL QG 1 45 ALA HA . . 3.470 3.062 2.291 3.525 0.055 16 0 "[ . 1 . 2]" 1
1387 1 41 PRO QB 1 42 GLY H . . 3.280 2.041 1.921 2.404 . 0 0 "[ . 1 . 2]" 1
1388 1 41 PRO QG 1 44 LEU QB . . 3.720 2.219 1.879 2.746 . 0 0 "[ . 1 . 2]" 1
1389 1 41 PRO QD 1 44 LEU QB . . 3.920 2.359 1.902 2.659 . 0 0 "[ . 1 . 2]" 1
1390 1 41 PRO QD 1 44 LEU QD . . 4.360 1.980 1.854 2.404 . 0 0 "[ . 1 . 2]" 1
1391 1 42 GLY QA 1 43 ARG H . . 3.010 2.719 2.620 2.834 . 0 0 "[ . 1 . 2]" 1
1392 1 42 GLY QA 1 45 ALA MB . . 3.860 2.647 2.278 2.957 . 0 0 "[ . 1 . 2]" 1
1393 1 43 ARG H 1 43 ARG QB . . 3.870 2.416 2.148 2.795 . 0 0 "[ . 1 . 2]" 1
1394 1 43 ARG H 1 44 LEU QD . . 5.180 4.835 4.247 5.226 0.046 14 0 "[ . 1 . 2]" 1
1395 1 43 ARG QB 1 43 ARG QD . . 3.390 2.194 1.934 2.591 . 0 0 "[ . 1 . 2]" 1
1396 1 43 ARG QB 1 43 ARG HE . . 3.690 3.125 2.075 4.074 0.384 16 0 "[ . 1 . 2]" 1
1397 1 43 ARG QB 1 44 LEU H . . 4.150 2.774 2.169 3.423 . 0 0 "[ . 1 . 2]" 1
1398 1 43 ARG QD 1 44 LEU QD . . 4.190 3.618 1.960 4.227 0.037 2 0 "[ . 1 . 2]" 1
1399 1 43 ARG HE 1 44 LEU QD . . 3.810 3.409 2.213 3.846 0.036 17 0 "[ . 1 . 2]" 1
1400 1 44 LEU H 1 44 LEU QD . . 4.260 2.910 2.440 3.383 . 0 0 "[ . 1 . 2]" 1
1401 1 44 LEU HA 1 44 LEU QD . . 3.850 2.860 2.637 2.948 . 0 0 "[ . 1 . 2]" 1
1402 1 44 LEU QB 1 45 ALA H . . 4.380 2.445 2.333 2.624 . 0 0 "[ . 1 . 2]" 1
1403 1 47 VAL HA 1 50 VAL QG . . 3.700 2.740 2.514 3.169 . 0 0 "[ . 1 . 2]" 1
1404 1 47 VAL HA 1 155 VAL QG . . 3.620 2.929 2.728 3.401 . 0 0 "[ . 1 . 2]" 1
1405 1 47 VAL HA 1 156 LEU QD . . 3.100 2.056 1.877 2.723 . 0 0 "[ . 1 . 2]" 1
1406 1 47 VAL HB 1 155 VAL QG . . 4.290 4.311 4.132 4.445 0.155 13 0 "[ . 1 . 2]" 1
1407 1 47 VAL QG 1 152 TRP QB . . 3.560 1.717 1.625 1.851 . 0 0 "[ . 1 . 2]" 1
1408 1 48 ALA HA 1 51 LEU QB . . 4.150 3.150 2.809 3.283 . 0 0 "[ . 1 . 2]" 1
1409 1 48 ALA HA 1 51 LEU QD . . 3.940 2.054 1.882 2.880 . 0 0 "[ . 1 . 2]" 1
1410 1 49 ALA HA 1 52 LEU QB . . 3.580 2.394 2.237 2.968 . 0 0 "[ . 1 . 2]" 1
1411 1 49 ALA HA 1 52 LEU QD . . 3.100 2.654 2.322 2.998 . 0 0 "[ . 1 . 2]" 1
1412 1 50 VAL H 1 50 VAL QG . . 3.020 2.057 1.947 2.216 . 0 0 "[ . 1 . 2]" 1
1413 1 50 VAL HB 1 155 VAL QG . . 4.220 3.383 3.124 3.641 . 0 0 "[ . 1 . 2]" 1
1414 1 50 VAL HB 1 156 LEU QD . . 4.470 3.337 2.966 3.739 . 0 0 "[ . 1 . 2]" 1
1415 1 50 VAL QG 1 51 LEU H . . 3.520 3.181 3.044 3.223 . 0 0 "[ . 1 . 2]" 1
1416 1 50 VAL QG 1 54 LEU H . . 3.780 3.857 3.725 3.926 0.146 19 0 "[ . 1 . 2]" 1
1417 1 50 VAL QG 1 54 LEU HG . . 4.460 2.517 2.335 4.168 . 0 0 "[ . 1 . 2]" 1
1418 1 50 VAL QG 1 155 VAL QG . . 3.110 2.826 2.523 3.114 0.004 13 0 "[ . 1 . 2]" 1
1419 1 50 VAL QG 1 156 LEU HA . . 4.020 3.071 2.415 3.578 . 0 0 "[ . 1 . 2]" 1
1420 1 50 VAL QG 1 156 LEU QD . . 3.940 1.980 1.744 2.177 . 0 0 "[ . 1 . 2]" 1
1421 1 51 LEU H 1 51 LEU QB . . 3.010 2.572 2.224 2.630 . 0 0 "[ . 1 . 2]" 1
1422 1 51 LEU H 1 51 LEU QD . . 4.150 2.834 2.155 2.947 . 0 0 "[ . 1 . 2]" 1
1423 1 51 LEU HA 1 51 LEU QD . . 3.020 2.580 2.351 2.892 . 0 0 "[ . 1 . 2]" 1
1424 1 51 LEU HA 1 54 LEU QB . . 4.400 2.484 2.237 3.442 . 0 0 "[ . 1 . 2]" 1
1425 1 51 LEU HA 1 105 VAL QG . . 4.470 2.905 2.181 3.205 . 0 0 "[ . 1 . 2]" 1
1426 1 51 LEU QB 1 52 LEU H . . 3.770 2.523 2.167 2.746 . 0 0 "[ . 1 . 2]" 1
1427 1 51 LEU QB 1 52 LEU HA . . 3.900 3.816 3.771 3.871 . 0 0 "[ . 1 . 2]" 1
1428 1 51 LEU QD 1 52 LEU QD . . 4.570 4.090 3.369 4.550 . 0 0 "[ . 1 . 2]" 1
1429 1 51 LEU QD 1 105 VAL QG . . 3.110 2.334 2.034 3.010 . 0 0 "[ . 1 . 2]" 1
1430 1 52 LEU H 1 52 LEU QB . . 3.000 2.204 2.086 2.570 . 0 0 "[ . 1 . 2]" 1
1431 1 52 LEU HA 1 52 LEU QD . . 3.950 2.059 1.933 2.547 . 0 0 "[ . 1 . 2]" 1
1432 1 52 LEU QB 1 53 ARG H . . 3.830 2.318 2.242 2.810 . 0 0 "[ . 1 . 2]" 1
1433 1 52 LEU QB 1 53 ARG HA . . 3.990 3.722 3.666 3.902 . 0 0 "[ . 1 . 2]" 1
1434 1 52 LEU QB 1 53 ARG QD . . 3.830 3.964 3.914 4.211 0.381 18 0 "[ . 1 . 2]" 1
1435 1 52 LEU QD 1 53 ARG H . . 4.040 3.855 3.753 4.048 0.008 18 0 "[ . 1 . 2]" 1
1436 1 53 ARG H 1 53 ARG QD . . 3.830 2.922 2.825 3.622 . 0 0 "[ . 1 . 2]" 1
1437 1 53 ARG HA 1 56 ASP QB . . 3.280 2.480 2.248 2.871 . 0 0 "[ . 1 . 2]" 1
1438 1 53 ARG QB 1 56 ASP QB . . 4.620 4.083 3.805 4.699 0.079 18 0 "[ . 1 . 2]" 1
1439 1 54 LEU H 1 54 LEU QD . . 3.810 3.306 3.099 3.464 . 0 0 "[ . 1 . 2]" 1
1440 1 54 LEU HA 1 105 VAL QG . . 4.470 4.477 4.267 4.578 0.108 13 0 "[ . 1 . 2]" 1
1441 1 54 LEU QB 1 55 GLY H . . 4.090 2.274 2.190 2.862 . 0 0 "[ . 1 . 2]" 1
1442 1 54 LEU QB 1 105 VAL QG . . 3.980 2.267 2.081 2.340 . 0 0 "[ . 1 . 2]" 1
1443 1 54 LEU HB3 1 105 VAL MG2 . . 4.950 4.000 3.824 4.298 . 0 0 "[ . 1 . 2]" 1
1444 1 54 LEU HG 1 105 VAL QG . . 4.080 4.004 3.690 4.135 0.055 19 0 "[ . 1 . 2]" 1
1445 1 54 LEU QD 1 55 GLY H . . 4.700 3.838 3.774 4.226 . 0 0 "[ . 1 . 2]" 1
1446 1 54 LEU QD 1 105 VAL QG . . 3.140 1.930 1.682 2.256 . 0 0 "[ . 1 . 2]" 1
1447 1 55 GLY H 1 105 VAL QG . . 3.550 3.440 3.249 3.574 0.024 9 0 "[ . 1 . 2]" 1
1448 1 55 GLY QA 1 58 LEU QB . . 4.340 2.711 2.548 2.915 . 0 0 "[ . 1 . 2]" 1
1449 1 55 GLY QA 1 105 VAL QG . . 3.540 3.454 3.232 3.622 0.082 17 0 "[ . 1 . 2]" 1
1450 1 56 ASP H 1 56 ASP QB . . 3.000 2.210 2.085 2.257 . 0 0 "[ . 1 . 2]" 1
1451 1 56 ASP HA 1 59 GLU QG . . 4.400 2.611 1.956 3.021 . 0 0 "[ . 1 . 2]" 1
1452 1 56 ASP QB 1 57 GLU H . . 3.670 2.315 2.156 2.457 . 0 0 "[ . 1 . 2]" 1
1453 1 58 LEU HA 1 58 LEU QD . . 3.950 2.387 2.098 2.784 . 0 0 "[ . 1 . 2]" 1
1454 1 58 LEU HA 1 61 ILE QG . . 4.400 3.578 2.897 4.034 . 0 0 "[ . 1 . 2]" 1
1455 1 58 LEU QD 1 105 VAL HB . . 4.860 4.806 4.638 4.881 0.021 5 0 "[ . 1 . 2]" 1
1456 1 58 LEU QD 1 105 VAL QG . . 3.980 3.119 2.930 3.424 . 0 0 "[ . 1 . 2]" 1
1457 1 59 GLU H 1 59 GLU QG . . 3.780 2.900 1.856 3.192 . 0 0 "[ . 1 . 2]" 1
1458 1 59 GLU QG 1 60 MET H . . 3.490 2.631 2.495 3.902 0.412 17 0 "[ . 1 . 2]" 1
1459 1 60 MET H 1 60 MET QG . . 3.470 2.974 2.069 3.358 . 0 0 "[ . 1 . 2]" 1
1460 1 60 MET HA 1 60 MET QG . . 3.320 2.209 2.081 2.660 . 0 0 "[ . 1 . 2]" 1
1461 1 60 MET QB 1 61 ILE H . . 4.100 2.797 2.636 2.968 . 0 0 "[ . 1 . 2]" 1
1462 1 60 MET QB 1 61 ILE MD . . 4.400 3.972 3.221 4.269 . 0 0 "[ . 1 . 2]" 1
1463 1 60 MET ME 1 60 MET QG . . 3.020 2.514 2.136 2.607 . 0 0 "[ . 1 . 2]" 1
1464 1 61 ILE HA 1 61 ILE QG . . 3.390 2.518 2.402 2.946 . 0 0 "[ . 1 . 2]" 1
1465 1 62 ARG QB 1 63 PRO QD . . 4.300 3.754 3.559 3.817 . 0 0 "[ . 1 . 2]" 1
1466 1 64 SER QB 1 65 VAL H . . 4.100 2.381 2.231 2.665 . 0 0 "[ . 1 . 2]" 1
1467 1 64 SER QB 1 66 TYR QD . . 4.400 4.331 3.943 4.532 0.132 19 0 "[ . 1 . 2]" 1
1468 1 64 SER QB 1 66 TYR QE . . 4.640 4.443 3.868 4.670 0.030 3 0 "[ . 1 . 2]" 1
1469 1 65 VAL H 1 65 VAL QG . . 3.340 2.336 2.163 2.556 . 0 0 "[ . 1 . 2]" 1
1470 1 65 VAL QG 1 66 TYR H . . 4.390 3.201 1.849 3.746 . 0 0 "[ . 1 . 2]" 1
1471 1 65 VAL QG 1 66 TYR QD . . 4.470 3.396 3.220 3.648 . 0 0 "[ . 1 . 2]" 1
1472 1 66 TYR QD 1 110 VAL QG . . 3.310 3.372 3.330 3.457 0.147 7 0 "[ . 1 . 2]" 1
1473 1 66 TYR QE 1 110 VAL QG . . 3.370 3.197 2.670 3.381 0.011 4 0 "[ . 1 . 2]" 1
1474 1 68 ASN QB 1 72 GLN QE . . 4.130 4.147 3.664 4.225 0.095 17 0 "[ . 1 . 2]" 1
1475 1 69 VAL H 1 69 VAL QG . . 3.820 2.074 1.983 2.164 . 0 0 "[ . 1 . 2]" 1
1476 1 69 VAL HA 1 72 GLN QE . . 4.130 3.891 3.330 4.151 0.021 11 0 "[ . 1 . 2]" 1
1477 1 69 VAL QG 1 70 ALA H . . 3.950 1.865 1.806 1.978 . 0 0 "[ . 1 . 2]" 1
1478 1 72 GLN H 1 72 GLN QG . . 3.260 2.005 1.932 2.120 . 0 0 "[ . 1 . 2]" 1
1479 1 72 GLN HA 1 72 GLN QG . . 3.220 3.080 3.027 3.125 . 0 0 "[ . 1 . 2]" 1
1480 1 72 GLN HA 1 72 GLN QE . . 4.850 2.918 2.367 3.482 . 0 0 "[ . 1 . 2]" 1
1481 1 72 GLN QB 1 72 GLN QE . . 4.010 3.477 3.268 3.662 . 0 0 "[ . 1 . 2]" 1
1482 1 72 GLN QG 1 73 LEU H . . 5.260 4.099 3.873 4.220 . 0 0 "[ . 1 . 2]" 1
1483 1 73 LEU H 1 73 LEU QB . . 3.220 2.822 2.553 3.030 . 0 0 "[ . 1 . 2]" 1
1484 1 73 LEU H 1 73 LEU QD . . 4.250 2.774 2.390 3.142 . 0 0 "[ . 1 . 2]" 1
1485 1 73 LEU HA 1 73 LEU QD . . 3.570 3.418 3.343 3.469 . 0 0 "[ . 1 . 2]" 1
1486 1 73 LEU QB 1 74 HIS H . . 3.910 3.909 3.858 3.968 0.058 7 0 "[ . 1 . 2]" 1
1487 1 73 LEU QB 1 86 ALA MB . . 4.400 4.388 4.227 4.515 0.115 14 0 "[ . 1 . 2]" 1
1488 1 73 LEU QD 1 86 ALA MB . . 4.470 2.209 1.930 2.430 . 0 0 "[ . 1 . 2]" 1
1489 1 74 HIS H 1 74 HIS QB . . 3.520 2.919 2.777 3.267 . 0 0 "[ . 1 . 2]" 1
1490 1 75 ILE H 1 75 ILE QG . . 4.040 3.965 3.849 3.976 . 0 0 "[ . 1 . 2]" 1
1491 1 75 ILE HA 1 75 ILE QG . . 3.560 2.417 2.285 2.443 . 0 0 "[ . 1 . 2]" 1
1492 1 75 ILE HB 1 82 VAL QG . . 4.800 4.835 4.674 4.912 0.112 17 0 "[ . 1 . 2]" 1
1493 1 75 ILE QG 1 75 ILE MG . . 3.020 2.360 2.318 2.459 . 0 0 "[ . 1 . 2]" 1
1494 1 75 ILE MG 1 77 LEU QB . . 3.300 3.345 2.973 3.398 0.098 13 0 "[ . 1 . 2]" 1
1495 1 75 ILE MG 1 82 VAL QG . . 4.610 4.315 3.848 4.511 . 0 0 "[ . 1 . 2]" 1
1496 1 75 ILE MG 1 83 VAL QG . . 4.610 3.635 2.301 3.787 . 0 0 "[ . 1 . 2]" 1
1497 1 75 ILE MG 1 114 LEU QD . . 3.980 2.591 2.100 3.332 . 0 0 "[ . 1 . 2]" 1
1498 1 75 ILE MD 1 77 LEU QB . . 3.590 3.609 3.547 3.691 0.101 18 0 "[ . 1 . 2]" 1
1499 1 75 ILE MD 1 82 VAL QG . . 4.610 4.155 3.900 4.479 . 0 0 "[ . 1 . 2]" 1
1500 1 75 ILE MD 1 83 VAL QG . . 4.610 1.774 1.664 1.866 . 0 0 "[ . 1 . 2]" 1
1501 1 75 ILE MD 1 114 LEU QD . . 3.980 2.184 1.823 3.544 . 0 0 "[ . 1 . 2]" 1
1502 1 76 SER QB 1 82 VAL HB . . 3.980 3.773 3.284 4.032 0.052 20 0 "[ . 1 . 2]" 1
1503 1 77 LEU H 1 78 GLN QE . . 4.390 3.703 2.265 4.396 0.006 5 0 "[ . 1 . 2]" 1
1504 1 77 LEU HA 1 83 VAL QG . . 3.050 3.034 1.914 3.195 0.145 8 0 "[ . 1 . 2]" 1
1505 1 77 LEU QB 1 78 GLN QE . . 4.440 4.258 3.638 4.447 0.007 1 0 "[ . 1 . 2]" 1
1506 1 77 LEU HG 1 78 GLN QE . . 3.610 2.620 2.121 3.328 . 0 0 "[ . 1 . 2]" 1
1507 1 77 LEU QD 1 78 GLN H . . 5.280 3.522 3.126 4.302 . 0 0 "[ . 1 . 2]" 1
1508 1 77 LEU QD 1 78 GLN HA . . 3.860 3.441 3.132 3.866 0.006 17 0 "[ . 1 . 2]" 1
1509 1 77 LEU QD 1 78 GLN QG . . 4.530 3.862 3.395 4.323 . 0 0 "[ . 1 . 2]" 1
1510 1 77 LEU QD 1 78 GLN QE . . 4.080 2.522 1.945 3.325 . 0 0 "[ . 1 . 2]" 1
1511 1 77 LEU QD 1 117 ASP QB . . 3.350 3.068 2.815 3.364 0.014 11 0 "[ . 1 . 2]" 1
1512 1 77 LEU QD 1 118 ALA H . . 3.390 3.357 3.025 3.454 0.064 18 0 "[ . 1 . 2]" 1
1513 1 77 LEU QD 1 118 ALA HA . . 3.210 2.011 1.813 2.360 . 0 0 "[ . 1 . 2]" 1
1514 1 77 LEU QD 1 118 ALA MB . . 3.460 1.980 1.792 2.338 . 0 0 "[ . 1 . 2]" 1
1515 1 77 LEU QD 1 126 MET QG . . 4.420 2.693 2.452 3.029 . 0 0 "[ . 1 . 2]" 1
1516 1 78 GLN H 1 78 GLN QB . . 3.010 2.233 2.059 2.636 . 0 0 "[ . 1 . 2]" 1
1517 1 78 GLN H 1 78 GLN QE . . 4.910 2.891 1.941 4.472 . 0 0 "[ . 1 . 2]" 1
1518 1 78 GLN HA 1 78 GLN QE . . 3.820 2.922 2.248 3.672 . 0 0 "[ . 1 . 2]" 1
1519 1 78 GLN QB 1 79 SER H . . 3.660 2.888 2.497 3.162 . 0 0 "[ . 1 . 2]" 1
1520 1 78 GLN QG 1 123 GLN QE . . 3.440 3.168 2.462 3.471 0.031 11 0 "[ . 1 . 2]" 1
1521 1 78 GLN QE 1 121 GLN QE . . 4.190 3.734 2.899 4.192 0.002 17 0 "[ . 1 . 2]" 1
1522 1 79 SER QB 1 80 GLU H . . 3.380 2.276 2.034 2.587 . 0 0 "[ . 1 . 2]" 1
1523 1 79 SER QB 1 81 ARG H . . 4.040 3.211 2.793 3.694 . 0 0 "[ . 1 . 2]" 1
1524 1 79 SER QB 1 82 VAL H . . 3.370 2.447 2.277 2.758 . 0 0 "[ . 1 . 2]" 1
1525 1 79 SER QB 1 82 VAL QG . . 3.030 2.020 1.727 2.269 . 0 0 "[ . 1 . 2]" 1
1526 1 80 GLU H 1 80 GLU QG . . 3.950 3.375 2.879 3.935 . 0 0 "[ . 1 . 2]" 1
1527 1 80 GLU HA 1 80 GLU QG . . 3.460 2.399 2.221 2.593 . 0 0 "[ . 1 . 2]" 1
1528 1 80 GLU QG 1 129 ALA MB . . 3.430 3.067 2.195 3.441 0.011 8 0 "[ . 1 . 2]" 1
1529 1 81 ARG QD 1 82 VAL QG . . 4.500 3.488 1.805 4.388 . 0 0 "[ . 1 . 2]" 1
1530 1 82 VAL H 1 82 VAL QG . . 3.040 2.181 1.889 2.498 . 0 0 "[ . 1 . 2]" 1
1531 1 82 VAL HA 1 82 VAL QG . . 3.090 2.165 2.045 2.331 . 0 0 "[ . 1 . 2]" 1
1532 1 82 VAL HA 1 85 ASP QB . . 3.420 2.899 2.661 3.084 . 0 0 "[ . 1 . 2]" 1
1533 1 82 VAL QG 1 83 VAL HA . . 4.550 3.183 2.986 3.444 . 0 0 "[ . 1 . 2]" 1
1534 1 82 VAL QG 1 86 ALA H . . 4.630 3.765 3.643 3.900 . 0 0 "[ . 1 . 2]" 1
1535 1 83 VAL H 1 83 VAL QG . . 3.480 1.942 1.863 2.654 . 0 0 "[ . 1 . 2]" 1
1536 1 83 VAL QG 1 84 THR H . . 3.840 2.012 1.923 2.558 . 0 0 "[ . 1 . 2]" 1
1537 1 83 VAL QG 1 87 PHE H . . 4.840 3.771 3.618 3.935 . 0 0 "[ . 1 . 2]" 1
1538 1 83 VAL QG 1 87 PHE QB . . 4.080 2.988 2.852 3.134 . 0 0 "[ . 1 . 2]" 1
1539 1 83 VAL QG 1 126 MET QG . . 3.790 3.445 1.859 3.579 . 0 0 "[ . 1 . 2]" 1
1540 1 83 VAL QG 1 130 LEU QD . . 3.030 2.294 2.039 2.599 . 0 0 "[ . 1 . 2]" 1
1541 1 84 THR HA 1 87 PHE QB . . 3.830 2.859 2.788 2.958 . 0 0 "[ . 1 . 2]" 1
1542 1 84 THR HA 1 88 LEU QD . . 4.150 3.451 2.961 3.967 . 0 0 "[ . 1 . 2]" 1
1543 1 84 THR MG 1 130 LEU QD . . 4.070 4.039 3.942 4.076 0.006 20 0 "[ . 1 . 2]" 1
1544 1 85 ASP H 1 85 ASP QB . . 3.420 2.219 2.132 2.255 . 0 0 "[ . 1 . 2]" 1
1545 1 85 ASP HA 1 88 LEU QD . . 3.360 2.955 2.581 3.225 . 0 0 "[ . 1 . 2]" 1
1546 1 85 ASP QB 1 86 ALA H . . 3.910 2.356 2.173 2.530 . 0 0 "[ . 1 . 2]" 1
1547 1 86 ALA HA 1 90 VAL QG . . 4.570 3.989 3.700 4.399 . 0 0 "[ . 1 . 2]" 1
1548 1 86 ALA MB 1 87 PHE QB . . 4.450 3.724 3.669 3.793 . 0 0 "[ . 1 . 2]" 1
1549 1 86 ALA MB 1 90 VAL QG . . 3.980 3.552 3.288 3.935 . 0 0 "[ . 1 . 2]" 1
1550 1 87 PHE HA 1 90 VAL QG . . 3.540 2.448 2.002 2.764 . 0 0 "[ . 1 . 2]" 1
1551 1 87 PHE QB 1 130 LEU QD . . 3.650 2.714 2.553 2.902 . 0 0 "[ . 1 . 2]" 1
1552 1 87 PHE QD 1 88 LEU QD . . 4.310 3.662 3.475 3.856 . 0 0 "[ . 1 . 2]" 1
1553 1 87 PHE QD 1 90 VAL QG . . 3.990 3.773 3.228 4.086 0.096 14 0 "[ . 1 . 2]" 1
1554 1 87 PHE QD 1 130 LEU QD . . 3.550 3.078 2.748 3.287 . 0 0 "[ . 1 . 2]" 1
1555 1 87 PHE QE 1 88 LEU QD . . 4.330 4.289 3.844 4.360 0.030 7 0 "[ . 1 . 2]" 1
1556 1 87 PHE QE 1 134 LEU QB . . 4.740 2.850 2.241 3.291 . 0 0 "[ . 1 . 2]" 1
1557 1 87 PHE HZ 1 130 LEU QB . . 4.810 4.825 4.796 4.873 0.063 20 0 "[ . 1 . 2]" 1
1558 1 88 LEU H 1 88 LEU QD . . 3.580 3.220 3.065 3.405 . 0 0 "[ . 1 . 2]" 1
1559 1 88 LEU HA 1 88 LEU QD . . 3.160 2.450 2.196 2.683 . 0 0 "[ . 1 . 2]" 1
1560 1 88 LEU QB 1 89 ALA H . . 3.600 2.613 2.551 2.746 . 0 0 "[ . 1 . 2]" 1
1561 1 88 LEU QD 1 133 ALA HA . . 3.590 2.846 2.569 3.177 . 0 0 "[ . 1 . 2]" 1
1562 1 88 LEU QD 1 133 ALA MB . . 3.790 2.147 1.905 2.598 . 0 0 "[ . 1 . 2]" 1
1563 1 88 LEU QD 1 137 PHE QB . . 3.470 1.892 1.860 2.071 . 0 0 "[ . 1 . 2]" 1
1564 1 89 ALA H 1 90 VAL QG . . 4.130 3.968 3.618 4.131 0.001 6 0 "[ . 1 . 2]" 1
1565 1 90 VAL H 1 90 VAL QG . . 3.990 2.080 1.995 2.208 . 0 0 "[ . 1 . 2]" 1
1566 1 90 VAL QG 1 91 ALA H . . 3.390 2.834 2.059 3.338 . 0 0 "[ . 1 . 2]" 1
1567 1 90 VAL QG 1 92 GLY H . . 5.100 4.757 4.325 5.094 . 0 0 "[ . 1 . 2]" 1
1568 1 90 VAL QG 1 93 HIS QB . . 4.610 3.361 3.228 3.508 . 0 0 "[ . 1 . 2]" 1
1569 1 90 VAL QG 1 94 ILE QG . . 3.400 2.343 2.090 2.561 . 0 0 "[ . 1 . 2]" 1
1570 1 91 ALA H 1 107 LEU QD . . 4.070 4.044 3.812 4.192 0.122 1 0 "[ . 1 . 2]" 1
1571 1 91 ALA HA 1 107 LEU QD . . 3.280 2.489 2.120 2.804 . 0 0 "[ . 1 . 2]" 1
1572 1 91 ALA MB 1 107 LEU QD . . 3.100 2.168 1.995 2.311 . 0 0 "[ . 1 . 2]" 1
1573 1 93 HIS HA 1 96 SER QB . . 3.280 2.578 2.250 2.799 . 0 0 "[ . 1 . 2]" 1
1574 1 94 ILE H 1 94 ILE QG . . 3.140 2.224 2.105 2.320 . 0 0 "[ . 1 . 2]" 1
1575 1 94 ILE HA 1 94 ILE QG . . 3.010 2.750 2.421 2.876 . 0 0 "[ . 1 . 2]" 1
1576 1 94 ILE MG 1 103 LYS QB . . 3.690 3.417 2.808 3.730 0.040 9 0 "[ . 1 . 2]" 1
1577 1 94 ILE MG 1 103 LYS QD . . 4.570 3.054 2.037 4.499 . 0 0 "[ . 1 . 2]" 1
1578 1 94 ILE QG 1 95 PHE H . . 4.010 4.081 3.951 4.138 0.128 17 0 "[ . 1 . 2]" 1
1579 1 95 PHE H 1 95 PHE QB . . 3.260 2.245 2.202 2.340 . 0 0 "[ . 1 . 2]" 1
1580 1 95 PHE QB 1 96 SER H . . 4.110 3.004 2.740 3.143 . 0 0 "[ . 1 . 2]" 1
1581 1 95 PHE QD 1 99 ILE QG . . 4.230 2.621 1.986 3.585 . 0 0 "[ . 1 . 2]" 1
1582 1 95 PHE QD 1 142 LEU QB . . 4.840 4.209 3.787 4.895 0.055 18 0 "[ . 1 . 2]" 1
1583 1 95 PHE QE 1 104 VAL QG . . 4.200 2.463 2.026 3.130 . 0 0 "[ . 1 . 2]" 1
1584 1 95 PHE QE 1 107 LEU QD . . 3.240 2.066 1.871 2.764 . 0 0 "[ . 1 . 2]" 1
1585 1 95 PHE QE 1 142 LEU QD . . 3.910 2.127 1.764 2.528 . 0 0 "[ . 1 . 2]" 1
1586 1 95 PHE HZ 1 104 VAL QG . . 3.140 2.743 2.444 3.154 0.014 17 0 "[ . 1 . 2]" 1
1587 1 96 SER QB 1 97 ALA H . . 3.960 2.853 2.517 3.084 . 0 0 "[ . 1 . 2]" 1
1588 1 97 ALA MB 1 98 GLY QA . . 4.260 3.874 3.720 3.958 . 0 0 "[ . 1 . 2]" 1
1589 1 98 GLY QA 1 99 ILE H . . 3.520 2.155 2.110 2.367 . 0 0 "[ . 1 . 2]" 1
1590 1 99 ILE H 1 99 ILE QG . . 3.940 2.596 1.948 3.087 . 0 0 "[ . 1 . 2]" 1
1591 1 99 ILE MG 1 142 LEU QD . . 3.220 2.048 1.710 2.698 . 0 0 "[ . 1 . 2]" 1
1592 1 99 ILE MG 1 145 TRP QB . . 3.730 2.856 1.991 3.174 . 0 0 "[ . 1 . 2]" 1
1593 1 99 ILE MD 1 142 LEU QD . . 3.350 3.186 2.305 3.493 0.143 17 0 "[ . 1 . 2]" 1
1594 1 99 ILE MD 1 145 TRP QB . . 3.220 2.145 1.858 2.573 . 0 0 "[ . 1 . 2]" 1
1595 1 100 THR MG 1 103 LYS QG . . 4.350 4.281 3.637 4.500 0.150 15 0 "[ . 1 . 2]" 1
1596 1 101 TRP HA 1 104 VAL QG . . 3.630 2.284 1.898 3.201 . 0 0 "[ . 1 . 2]" 1
1597 1 101 TRP QB 1 155 VAL QG . . 3.580 2.114 1.881 2.400 . 0 0 "[ . 1 . 2]" 1
1598 1 101 TRP HD1 1 154 ASP QB . . 4.940 4.425 4.063 5.005 0.065 2 0 "[ . 1 . 2]" 1
1599 1 101 TRP HD1 1 155 VAL QG . . 4.490 3.530 3.222 3.713 . 0 0 "[ . 1 . 2]" 1
1600 1 101 TRP HE3 1 146 LEU QD . . 4.840 4.345 3.983 4.745 . 0 0 "[ . 1 . 2]" 1
1601 1 101 TRP HE1 1 149 ARG QD . . 3.940 2.909 2.764 3.122 . 0 0 "[ . 1 . 2]" 1
1602 1 101 TRP HE1 1 154 ASP QB . . 3.920 2.332 1.953 2.996 . 0 0 "[ . 1 . 2]" 1
1603 1 101 TRP HZ3 1 146 LEU QD . . 3.760 2.670 2.348 3.199 . 0 0 "[ . 1 . 2]" 1
1604 1 101 TRP HZ2 1 149 ARG QD . . 3.620 2.103 1.968 2.456 . 0 0 "[ . 1 . 2]" 1
1605 1 101 TRP HZ2 1 155 VAL QG . . 4.610 4.011 3.732 4.282 . 0 0 "[ . 1 . 2]" 1
1606 1 101 TRP HH2 1 146 LEU QD . . 3.430 2.362 1.931 3.155 . 0 0 "[ . 1 . 2]" 1
1607 1 102 GLY H 1 104 VAL QG . . 5.290 4.487 4.088 5.061 . 0 0 "[ . 1 . 2]" 1
1608 1 102 GLY QA 1 104 VAL QG . . 4.380 4.384 3.894 4.540 0.160 18 0 "[ . 1 . 2]" 1
1609 1 102 GLY QA 1 105 VAL QG . . 4.330 2.584 2.174 2.920 . 0 0 "[ . 1 . 2]" 1
1610 1 103 LYS H 1 103 LYS QB . . 3.500 2.132 2.039 2.319 . 0 0 "[ . 1 . 2]" 1
1611 1 103 LYS QE 1 103 LYS QG . . 3.330 2.035 1.938 2.315 . 0 0 "[ . 1 . 2]" 1
1612 1 104 VAL H 1 104 VAL QG . . 3.350 2.276 1.804 2.905 . 0 0 "[ . 1 . 2]" 1
1613 1 104 VAL HA 1 107 LEU QB . . 3.540 2.655 2.479 2.806 . 0 0 "[ . 1 . 2]" 1
1614 1 104 VAL HA 1 107 LEU QD . . 3.650 3.088 2.743 3.772 0.122 1 0 "[ . 1 . 2]" 1
1615 1 104 VAL QG 1 105 VAL H . . 3.580 2.784 2.035 3.167 . 0 0 "[ . 1 . 2]" 1
1616 1 104 VAL QG 1 105 VAL HA . . 4.090 3.372 2.787 3.743 . 0 0 "[ . 1 . 2]" 1
1617 1 104 VAL QG 1 108 TYR QE . . 3.340 2.062 1.880 2.722 . 0 0 "[ . 1 . 2]" 1
1618 1 104 VAL QG 1 145 TRP HZ3 . . 4.160 3.497 2.528 4.157 . 0 0 "[ . 1 . 2]" 1
1619 1 104 VAL QG 1 152 TRP HZ3 . . 3.550 1.887 1.710 2.297 . 0 0 "[ . 1 . 2]" 1
1620 1 104 VAL QG 1 152 TRP HH2 . . 4.250 2.024 1.887 3.111 . 0 0 "[ . 1 . 2]" 1
1621 1 105 VAL H 1 105 VAL QG . . 3.110 2.161 2.083 2.258 . 0 0 "[ . 1 . 2]" 1
1622 1 105 VAL QG 1 106 SER H . . 3.380 3.070 2.984 3.155 . 0 0 "[ . 1 . 2]" 1
1623 1 105 VAL QG 1 106 SER QB . . 4.440 4.209 4.029 4.382 . 0 0 "[ . 1 . 2]" 1
1624 1 107 LEU H 1 107 LEU QB . . 3.570 2.228 2.219 2.232 . 0 0 "[ . 1 . 2]" 1
1625 1 107 LEU HA 1 107 LEU QD . . 3.520 2.640 1.969 2.922 . 0 0 "[ . 1 . 2]" 1
1626 1 107 LEU QD 1 108 TYR H . . 4.480 3.226 2.359 3.561 . 0 0 "[ . 1 . 2]" 1
1627 1 107 LEU QD 1 134 LEU QD . . 3.690 2.092 1.718 2.514 . 0 0 "[ . 1 . 2]" 1
1628 1 108 TYR H 1 108 TYR QB . . 3.110 2.216 2.142 2.319 . 0 0 "[ . 1 . 2]" 1
1629 1 108 TYR HA 1 134 LEU QD . . 3.410 2.875 2.582 3.079 . 0 0 "[ . 1 . 2]" 1
1630 1 108 TYR QE 1 134 LEU QD . . 3.010 2.006 1.794 2.559 . 0 0 "[ . 1 . 2]" 1
1631 1 110 VAL H 1 110 VAL QG . . 3.130 2.032 2.001 2.071 . 0 0 "[ . 1 . 2]" 1
1632 1 110 VAL QG 1 111 ALA H . . 3.220 3.137 3.090 3.173 . 0 0 "[ . 1 . 2]" 1
1633 1 111 ALA H 1 134 LEU QD . . 4.410 4.466 4.404 4.528 0.118 7 0 "[ . 1 . 2]" 1
1634 1 111 ALA HA 1 114 LEU QB . . 3.680 2.969 2.799 3.333 . 0 0 "[ . 1 . 2]" 1
1635 1 111 ALA HA 1 114 LEU QD . . 3.790 2.663 1.961 3.111 . 0 0 "[ . 1 . 2]" 1
1636 1 111 ALA HA 1 130 LEU QD . . 4.070 2.762 2.531 3.021 . 0 0 "[ . 1 . 2]" 1
1637 1 111 ALA MB 1 130 LEU QD . . 3.480 2.668 2.147 3.018 . 0 0 "[ . 1 . 2]" 1
1638 1 112 ALA MB 1 116 VAL QG . . 4.110 3.218 3.034 3.301 . 0 0 "[ . 1 . 2]" 1
1639 1 113 GLY H 1 114 LEU QD . . 3.630 3.765 3.654 3.846 0.216 14 0 "[ . 1 . 2]" 1
1640 1 113 GLY QA 1 114 LEU QD . . 4.370 3.276 3.094 3.711 . 0 0 "[ . 1 . 2]" 1
1641 1 113 GLY QA 1 116 VAL QG . . 3.460 2.553 2.022 3.004 . 0 0 "[ . 1 . 2]" 1
1642 1 114 LEU H 1 114 LEU QB . . 3.130 2.283 2.163 2.707 . 0 0 "[ . 1 . 2]" 1
1643 1 114 LEU H 1 114 LEU QD . . 3.670 1.978 1.886 2.294 . 0 0 "[ . 1 . 2]" 1
1644 1 114 LEU HA 1 114 LEU QD . . 3.140 2.564 1.904 3.049 . 0 0 "[ . 1 . 2]" 1
1645 1 114 LEU HA 1 117 ASP QB . . 3.470 2.898 2.574 3.107 . 0 0 "[ . 1 . 2]" 1
1646 1 114 LEU QB 1 115 ALA H . . 3.630 2.525 2.402 2.720 . 0 0 "[ . 1 . 2]" 1
1647 1 114 LEU QB 1 115 ALA HA . . 4.420 3.813 3.763 3.875 . 0 0 "[ . 1 . 2]" 1
1648 1 114 LEU QB 1 130 LEU QD . . 3.640 2.264 2.047 2.513 . 0 0 "[ . 1 . 2]" 1
1649 1 114 LEU QD 1 130 LEU QD . . 3.530 2.687 2.459 3.278 . 0 0 "[ . 1 . 2]" 1
1650 1 115 ALA H 1 130 LEU QD . . 3.630 2.693 2.511 2.859 . 0 0 "[ . 1 . 2]" 1
1651 1 115 ALA HA 1 127 VAL QG . . 3.830 3.389 2.964 3.615 . 0 0 "[ . 1 . 2]" 1
1652 1 115 ALA MB 1 127 VAL QG . . 3.560 1.950 1.812 2.108 . 0 0 "[ . 1 . 2]" 1
1653 1 116 VAL H 1 116 VAL QG . . 3.180 2.154 1.838 2.354 . 0 0 "[ . 1 . 2]" 1
1654 1 116 VAL QG 1 117 ASP H . . 3.500 2.788 1.919 3.137 . 0 0 "[ . 1 . 2]" 1
1655 1 116 VAL QG 1 117 ASP HA . . 3.970 3.260 3.091 3.444 . 0 0 "[ . 1 . 2]" 1
1656 1 117 ASP HA 1 120 ARG QB . . 3.430 2.850 2.512 3.136 . 0 0 "[ . 1 . 2]" 1
1657 1 117 ASP QB 1 118 ALA H . . 3.490 2.588 2.311 2.822 . 0 0 "[ . 1 . 2]" 1
1658 1 118 ALA H 1 119 VAL QG . . 4.150 3.989 3.657 4.212 0.062 13 0 "[ . 1 . 2]" 1
1659 1 118 ALA HA 1 121 GLN QB . . 4.160 2.779 2.405 3.916 . 0 0 "[ . 1 . 2]" 1
1660 1 118 ALA MB 1 121 GLN QE . . 5.070 4.712 4.047 5.069 . 0 0 "[ . 1 . 2]" 1
1661 1 118 ALA MB 1 126 MET QB . . 3.660 2.165 1.967 2.407 . 0 0 "[ . 1 . 2]" 1
1662 1 118 ALA MB 1 126 MET QG . . 3.710 1.838 1.808 2.114 . 0 0 "[ . 1 . 2]" 1
1663 1 119 VAL H 1 119 VAL QG . . 3.970 2.053 1.921 2.161 . 0 0 "[ . 1 . 2]" 1
1664 1 119 VAL QG 1 120 ARG H . . 3.670 2.776 2.069 3.339 . 0 0 "[ . 1 . 2]" 1
1665 1 119 VAL QG 1 120 ARG HA . . 4.060 3.304 3.045 3.537 . 0 0 "[ . 1 . 2]" 1
1666 1 119 VAL QG 1 120 ARG QB . . 4.090 3.661 2.859 4.196 0.106 13 0 "[ . 1 . 2]" 1
1667 1 119 VAL QG 1 124 PRO HA . . 3.600 2.395 1.878 3.225 . 0 0 "[ . 1 . 2]" 1
1668 1 120 ARG H 1 120 ARG QB . . 3.220 2.087 2.052 2.138 . 0 0 "[ . 1 . 2]" 1
1669 1 120 ARG QB 1 120 ARG QD . . 3.200 2.362 2.160 2.836 . 0 0 "[ . 1 . 2]" 1
1670 1 120 ARG QB 1 120 ARG HE . . 3.540 2.504 1.975 3.421 . 0 0 "[ . 1 . 2]" 1
1671 1 121 GLN H 1 121 GLN QG . . 3.850 3.400 2.211 3.623 . 0 0 "[ . 1 . 2]" 1
1672 1 121 GLN HA 1 121 GLN QG . . 3.270 2.255 2.062 3.324 0.054 13 0 "[ . 1 . 2]" 1
1673 1 121 GLN HA 1 121 GLN QE . . 4.560 4.361 4.115 4.566 0.006 13 0 "[ . 1 . 2]" 1
1674 1 121 GLN QG 1 122 ALA H . . 4.710 4.588 3.564 4.652 . 0 0 "[ . 1 . 2]" 1
1675 1 121 GLN QG 1 122 ALA MB . . 4.820 4.703 3.916 4.828 0.008 17 0 "[ . 1 . 2]" 1
1676 1 122 ALA HA 1 124 PRO QD . . 3.570 3.100 2.929 3.273 . 0 0 "[ . 1 . 2]" 1
1677 1 122 ALA MB 1 124 PRO QD . . 4.290 4.074 3.820 4.194 . 0 0 "[ . 1 . 2]" 1
1678 1 123 GLN H 1 124 PRO QD . . 3.300 2.246 2.130 2.506 . 0 0 "[ . 1 . 2]" 1
1679 1 123 GLN HA 1 124 PRO QD . . 3.870 2.155 2.092 2.192 . 0 0 "[ . 1 . 2]" 1
1680 1 124 PRO HA 1 127 VAL QG . . 3.700 2.890 2.703 3.299 . 0 0 "[ . 1 . 2]" 1
1681 1 124 PRO QD 1 125 ALA H . . 3.490 2.778 2.704 2.790 . 0 0 "[ . 1 . 2]" 1
1682 1 124 PRO QD 1 125 ALA MB . . 4.420 3.889 3.818 3.952 . 0 0 "[ . 1 . 2]" 1
1683 1 125 ALA MB 1 126 MET QG . . 4.060 3.723 3.548 4.267 0.207 9 0 "[ . 1 . 2]" 1
1684 1 126 MET H 1 126 MET QG . . 3.040 2.306 2.182 3.265 0.225 9 0 "[ . 1 . 2]" 1
1685 1 126 MET H 1 127 VAL QG . . 4.180 4.010 3.880 4.184 0.004 17 0 "[ . 1 . 2]" 1
1686 1 126 MET HA 1 126 MET QG . . 3.320 2.869 2.268 2.933 . 0 0 "[ . 1 . 2]" 1
1687 1 126 MET QB 1 127 VAL HA . . 4.280 3.915 3.831 3.940 . 0 0 "[ . 1 . 2]" 1
1688 1 127 VAL H 1 127 VAL QG . . 3.970 2.174 2.044 2.377 . 0 0 "[ . 1 . 2]" 1
1689 1 127 VAL QG 1 128 HIS HA . . 4.000 3.112 3.021 3.227 . 0 0 "[ . 1 . 2]" 1
1690 1 128 HIS H 1 128 HIS QB . . 3.150 2.210 2.115 2.399 . 0 0 "[ . 1 . 2]" 1
1691 1 128 HIS QB 1 128 HIS HE1 . . 4.610 4.419 4.344 4.513 . 0 0 "[ . 1 . 2]" 1
1692 1 128 HIS QB 1 129 ALA H . . 3.190 2.597 2.401 2.754 . 0 0 "[ . 1 . 2]" 1
1693 1 128 HIS QB 1 129 ALA MB . . 4.130 3.851 3.759 3.934 . 0 0 "[ . 1 . 2]" 1
1694 1 130 LEU HA 1 130 LEU QD . . 3.100 2.167 1.960 2.317 . 0 0 "[ . 1 . 2]" 1
1695 1 130 LEU QB 1 131 VAL H . . 4.000 2.288 2.220 2.359 . 0 0 "[ . 1 . 2]" 1
1696 1 131 VAL HA 1 134 LEU QB . . 3.410 2.787 2.646 2.901 . 0 0 "[ . 1 . 2]" 1
1697 1 131 VAL HA 1 134 LEU QD . . 3.500 3.435 3.230 3.532 0.032 6 0 "[ . 1 . 2]" 1
1698 1 134 LEU H 1 134 LEU QD . . 3.640 3.579 3.328 3.692 0.052 18 0 "[ . 1 . 2]" 1
1699 1 134 LEU QB 1 135 GLY H . . 3.710 2.211 2.067 2.381 . 0 0 "[ . 1 . 2]" 1
1700 1 134 LEU QD 1 135 GLY H . . 4.050 3.464 2.873 3.787 . 0 0 "[ . 1 . 2]" 1
1701 1 135 GLY QA 1 138 VAL HB . . 3.630 2.564 2.435 2.629 . 0 0 "[ . 1 . 2]" 1
1702 1 135 GLY QA 1 138 VAL QG . . 3.550 2.835 2.547 3.029 . 0 0 "[ . 1 . 2]" 1
1703 1 137 PHE QD 1 138 VAL QG . . 5.260 2.533 2.232 3.008 . 0 0 "[ . 1 . 2]" 1
1704 1 137 PHE QD 1 142 LEU QD . . 5.010 2.910 2.624 3.226 . 0 0 "[ . 1 . 2]" 1
1705 1 138 VAL H 1 138 VAL QG . . 3.030 2.494 2.407 2.614 . 0 0 "[ . 1 . 2]" 1
1706 1 138 VAL HA 1 142 LEU QB . . 3.230 2.064 1.955 2.262 . 0 0 "[ . 1 . 2]" 1
1707 1 138 VAL HA 1 142 LEU QD . . 3.370 2.281 1.900 2.559 . 0 0 "[ . 1 . 2]" 1
1708 1 138 VAL QG 1 142 LEU QD . . 3.440 1.947 1.708 2.292 . 0 0 "[ . 1 . 2]" 1
1709 1 138 VAL QG 1 143 ALA H . . 5.100 4.339 4.185 4.463 . 0 0 "[ . 1 . 2]" 1
1710 1 138 VAL QG 1 152 TRP HZ2 . . 3.440 2.184 1.913 2.618 . 0 0 "[ . 1 . 2]" 1
1711 1 138 VAL QG 1 152 TRP HH2 . . 4.380 3.287 2.816 3.775 . 0 0 "[ . 1 . 2]" 1
1712 1 140 LYS H 1 140 LYS QG . . 3.530 3.205 2.924 3.513 . 0 0 "[ . 1 . 2]" 1
1713 1 140 LYS HA 1 140 LYS QG . . 3.240 2.515 2.099 2.884 . 0 0 "[ . 1 . 2]" 1
1714 1 140 LYS QE 1 140 LYS QG . . 3.480 2.140 1.946 2.297 . 0 0 "[ . 1 . 2]" 1
1715 1 141 THR H 1 142 LEU QD . . 4.780 4.198 3.703 4.455 . 0 0 "[ . 1 . 2]" 1
1716 1 141 THR HB 1 142 LEU QD . . 4.230 2.887 2.491 3.429 . 0 0 "[ . 1 . 2]" 1
1717 1 141 THR MG 1 142 LEU QD . . 3.430 2.160 1.886 3.275 . 0 0 "[ . 1 . 2]" 1
1718 1 142 LEU H 1 142 LEU QD . . 4.060 2.780 2.480 3.229 . 0 0 "[ . 1 . 2]" 1
1719 1 142 LEU HA 1 142 LEU QD . . 3.950 2.361 2.125 3.016 . 0 0 "[ . 1 . 2]" 1
1720 1 142 LEU HA 1 146 LEU QD . . 4.160 3.630 3.325 4.195 0.035 10 0 "[ . 1 . 2]" 1
1721 1 142 LEU QB 1 146 LEU QD . . 4.480 2.015 1.824 2.293 . 0 0 "[ . 1 . 2]" 1
1722 1 143 ALA HA 1 146 LEU QB . . 3.610 3.183 2.886 3.464 . 0 0 "[ . 1 . 2]" 1
1723 1 143 ALA HA 1 146 LEU QD . . 3.570 3.489 3.177 3.685 0.115 9 0 "[ . 1 . 2]" 1
1724 1 145 TRP HA 1 148 ARG QG . . 3.980 3.115 2.974 3.410 . 0 0 "[ . 1 . 2]" 1
1725 1 145 TRP QB 1 146 LEU QB . . 3.980 4.019 3.772 4.091 0.111 12 0 "[ . 1 . 2]" 1
1726 1 145 TRP HE3 1 146 LEU QD . . 3.370 1.971 1.708 2.955 . 0 0 "[ . 1 . 2]" 1
1727 1 145 TRP HZ3 1 146 LEU QD . . 3.470 2.403 2.182 2.846 . 0 0 "[ . 1 . 2]" 1
1728 1 145 TRP HH2 1 146 LEU QD . . 4.270 4.218 4.068 4.339 0.069 9 0 "[ . 1 . 2]" 1
1729 1 146 LEU H 1 146 LEU QD . . 3.540 2.237 1.849 3.244 . 0 0 "[ . 1 . 2]" 1
1730 1 146 LEU HA 1 146 LEU QD . . 3.180 2.004 1.876 2.357 . 0 0 "[ . 1 . 2]" 1
1731 1 146 LEU QD 1 151 GLY H . . 4.800 4.455 3.969 4.899 0.099 9 0 "[ . 1 . 2]" 1
1732 1 146 LEU QD 1 152 TRP HA . . 4.340 3.405 3.084 4.199 . 0 0 "[ . 1 . 2]" 1
1733 1 146 LEU QD 1 152 TRP HE1 . . 4.490 2.857 1.834 3.464 . 0 0 "[ . 1 . 2]" 1
1734 1 146 LEU QD 1 152 TRP HZ2 . . 3.880 2.898 1.936 3.319 . 0 0 "[ . 1 . 2]" 1
1735 1 146 LEU QD 1 152 TRP HH2 . . 4.400 3.829 3.086 4.321 . 0 0 "[ . 1 . 2]" 1
1736 1 147 ARG HA 1 147 ARG QD . . 4.250 3.624 2.007 4.243 . 0 0 "[ . 1 . 2]" 1
1737 1 147 ARG QB 1 147 ARG QD . . 3.340 2.131 1.954 2.379 . 0 0 "[ . 1 . 2]" 1
1738 1 147 ARG QD 1 148 ARG H . . 4.570 4.268 3.185 4.666 0.096 13 0 "[ . 1 . 2]" 1
1739 1 148 ARG H 1 148 ARG QG . . 4.310 2.818 2.695 2.990 . 0 0 "[ . 1 . 2]" 1
1740 1 148 ARG QG 1 149 ARG H . . 4.130 2.238 2.173 2.300 . 0 0 "[ . 1 . 2]" 1
1741 1 149 ARG H 1 149 ARG QB . . 3.320 2.288 2.217 2.367 . 0 0 "[ . 1 . 2]" 1
1742 1 149 ARG H 1 149 ARG QG . . 3.340 2.781 2.626 2.916 . 0 0 "[ . 1 . 2]" 1
1743 1 149 ARG HA 1 149 ARG QG . . 3.350 2.263 2.166 2.409 . 0 0 "[ . 1 . 2]" 1
1744 1 149 ARG HA 1 149 ARG QD . . 3.860 3.783 3.696 3.855 . 0 0 "[ . 1 . 2]" 1
1745 1 149 ARG QB 1 149 ARG QD . . 3.330 2.254 2.039 2.401 . 0 0 "[ . 1 . 2]" 1
1746 1 149 ARG QB 1 149 ARG HE . . 3.900 2.532 2.294 2.901 . 0 0 "[ . 1 . 2]" 1
1747 1 149 ARG QB 1 151 GLY H . . 4.100 2.726 2.674 2.766 . 0 0 "[ . 1 . 2]" 1
1748 1 151 GLY QA 1 152 TRP H . . 2.990 2.282 2.278 2.283 . 0 0 "[ . 1 . 2]" 1
1749 1 151 GLY QA 1 152 TRP HD1 . . 4.170 3.170 2.932 3.471 . 0 0 "[ . 1 . 2]" 1
1750 1 151 GLY QA 1 153 THR H . . 3.990 2.953 2.884 3.074 . 0 0 "[ . 1 . 2]" 1
1751 1 152 TRP H 1 152 TRP QB . . 3.440 2.343 2.255 2.472 . 0 0 "[ . 1 . 2]" 1
1752 1 152 TRP QB 1 153 THR H . . 3.510 3.232 3.057 3.359 . 0 0 "[ . 1 . 2]" 1
1753 1 153 THR H 1 156 LEU QD . . 4.660 4.001 3.791 4.282 . 0 0 "[ . 1 . 2]" 1
1754 1 153 THR HA 1 155 VAL QG . . 4.490 3.618 3.078 3.787 . 0 0 "[ . 1 . 2]" 1
1755 1 153 THR HA 1 156 LEU QD . . 3.860 1.976 1.846 2.251 . 0 0 "[ . 1 . 2]" 1
1756 1 153 THR HB 1 156 LEU QD . . 3.280 3.120 2.632 3.395 0.115 10 0 "[ . 1 . 2]" 1
1757 1 154 ASP H 1 154 ASP QB . . 2.920 2.170 2.078 2.257 . 0 0 "[ . 1 . 2]" 1
1758 1 155 VAL H 1 156 LEU QD . . 4.060 3.900 3.105 4.096 0.036 19 0 "[ . 1 . 2]" 1
1759 1 155 VAL QG 1 156 LEU H . . 3.530 2.351 2.029 2.456 . 0 0 "[ . 1 . 2]" 1
1760 1 155 VAL QG 1 156 LEU HA . . 3.660 3.359 3.076 3.703 0.043 15 0 "[ . 1 . 2]" 1
1761 1 155 VAL QG 1 156 LEU QB . . 3.740 3.682 3.383 3.778 0.038 19 0 "[ . 1 . 2]" 1
1762 1 155 VAL QG 1 156 LEU QD . . 2.990 1.943 1.730 2.128 . 0 0 "[ . 1 . 2]" 1
1763 1 156 LEU H 1 156 LEU QB . . 2.940 2.471 2.133 2.621 . 0 0 "[ . 1 . 2]" 1
1764 1 156 LEU H 1 156 LEU QD . . 3.690 2.714 1.893 3.053 . 0 0 "[ . 1 . 2]" 1
1765 1 156 LEU HA 1 156 LEU QD . . 3.080 2.064 1.949 2.284 . 0 0 "[ . 1 . 2]" 1
1766 1 157 LYS H 1 157 LYS QB . . 3.070 2.476 2.344 2.611 . 0 0 "[ . 1 . 2]" 1
1767 1 157 LYS H 1 157 LYS QE . . 4.520 3.935 2.888 4.492 . 0 0 "[ . 1 . 2]" 1
1768 1 157 LYS QB 1 157 LYS QE . . 3.630 3.120 2.076 3.620 . 0 0 "[ . 1 . 2]" 1
1769 1 157 LYS QB 1 158 CYS H . . 3.830 2.917 2.860 3.716 . 0 0 "[ . 1 . 2]" 1
1770 1 157 LYS QE 1 157 LYS QG . . 3.220 2.089 1.948 2.368 . 0 0 "[ . 1 . 2]" 1
1771 1 158 CYS H 1 158 CYS QB . . 2.940 2.467 2.077 2.895 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 190
_Distance_constraint_stats_list.Viol_count 3587
_Distance_constraint_stats_list.Viol_total 15576.695
_Distance_constraint_stats_list.Viol_max 0.751
_Distance_constraint_stats_list.Viol_rms 0.1184
_Distance_constraint_stats_list.Viol_average_all_restraints 0.2050
_Distance_constraint_stats_list.Viol_average_violations_only 0.2171
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 5 ASP 2.931 0.284 1 0 "[ . 1 . 2]"
1 6 LYS 3.461 0.241 14 0 "[ . 1 . 2]"
1 7 GLU 9.901 0.299 18 0 "[ . 1 . 2]"
1 8 LEU 0.898 0.076 8 0 "[ . 1 . 2]"
1 9 VAL 8.626 0.284 1 0 "[ . 1 . 2]"
1 10 ALA 14.156 0.374 5 0 "[ . 1 . 2]"
1 11 GLN 17.042 0.345 11 0 "[ . 1 . 2]"
1 12 ALA 9.673 0.437 9 0 "[ . 1 . 2]"
1 13 LYS 6.398 0.283 8 0 "[ . 1 . 2]"
1 14 ALA 20.821 0.374 5 0 "[ . 1 . 2]"
1 15 LEU 16.095 0.397 16 0 "[ . 1 . 2]"
1 16 GLY 16.906 0.437 9 0 "[ . 1 . 2]"
1 17 ARG 12.351 0.365 19 0 "[ . 1 . 2]"
1 18 GLU 18.054 0.336 9 0 "[ . 1 . 2]"
1 19 TYR 20.873 0.397 16 0 "[ . 1 . 2]"
1 20 VAL 10.322 0.316 16 0 "[ . 1 . 2]"
1 21 HIS 13.311 0.365 19 0 "[ . 1 . 2]"
1 22 ALA 13.175 0.334 12 0 "[ . 1 . 2]"
1 23 ARG 49.216 0.751 13 6 "[ * . -1* +*. * 2]"
1 24 LEU 2.191 0.222 15 0 "[ . 1 . 2]"
1 25 LEU 1.662 0.214 7 0 "[ . 1 . 2]"
1 26 ARG 30.289 0.548 1 2 "[+ . 1* . 2]"
1 27 ALA 9.378 0.340 18 0 "[ . 1 . 2]"
1 42 GLY 6.978 0.312 18 0 "[ . 1 . 2]"
1 43 ARG 12.098 0.394 17 0 "[ . 1 . 2]"
1 44 LEU 2.865 0.289 5 0 "[ . 1 . 2]"
1 45 ALA 8.820 0.319 5 0 "[ . 1 . 2]"
1 46 GLU 17.569 0.345 19 0 "[ . 1 . 2]"
1 47 VAL 25.103 0.431 17 0 "[ . 1 . 2]"
1 48 ALA 10.871 0.289 5 0 "[ . 1 . 2]"
1 49 ALA 14.197 0.319 5 0 "[ . 1 . 2]"
1 50 VAL 20.307 0.345 19 0 "[ . 1 . 2]"
1 51 LEU 21.779 0.431 17 0 "[ . 1 . 2]"
1 52 LEU 9.861 0.284 18 0 "[ . 1 . 2]"
1 53 ARG 7.388 0.256 13 0 "[ . 1 . 2]"
1 54 LEU 25.684 0.482 18 0 "[ . 1 . 2]"
1 55 GLY 9.930 0.327 2 0 "[ . 1 . 2]"
1 56 ASP 27.073 0.548 1 2 "[+ . 1* . 2]"
1 57 GLU 9.782 0.313 17 0 "[ . 1 . 2]"
1 58 LEU 30.067 0.482 18 0 "[ . 1 . 2]"
1 59 GLU 16.698 0.623 18 5 "[ * . -1* *. + 2]"
1 60 MET 7.326 0.407 3 0 "[ . 1 . 2]"
1 61 ILE 7.771 0.313 17 0 "[ . 1 . 2]"
1 62 ARG 14.099 0.439 11 0 "[ . 1 . 2]"
1 66 TYR 12.031 0.751 13 1 "[ . 1 + . 2]"
1 68 ASN 7.357 0.297 16 0 "[ . 1 . 2]"
1 69 VAL 7.137 0.363 7 0 "[ . 1 . 2]"
1 70 ALA 10.765 0.329 7 0 "[ . 1 . 2]"
1 71 ARG 18.811 0.353 7 0 "[ . 1 . 2]"
1 72 GLN 7.137 0.363 7 0 "[ . 1 . 2]"
1 73 LEU 10.765 0.329 7 0 "[ . 1 . 2]"
1 74 HIS 11.454 0.353 7 0 "[ . 1 . 2]"
1 80 GLU 11.137 0.346 16 0 "[ . 1 . 2]"
1 81 ARG 9.924 0.348 2 0 "[ . 1 . 2]"
1 82 VAL 3.330 0.250 2 0 "[ . 1 . 2]"
1 83 VAL 11.028 0.342 14 0 "[ . 1 . 2]"
1 84 THR 12.786 0.346 16 0 "[ . 1 . 2]"
1 85 ASP 13.854 0.348 2 0 "[ . 1 . 2]"
1 86 ALA 13.219 0.314 20 0 "[ . 1 . 2]"
1 87 PHE 16.969 0.342 14 0 "[ . 1 . 2]"
1 88 LEU 11.456 0.323 18 0 "[ . 1 . 2]"
1 89 ALA 10.456 0.228 5 0 "[ . 1 . 2]"
1 90 VAL 18.836 0.314 20 0 "[ . 1 . 2]"
1 91 ALA 12.407 0.312 18 0 "[ . 1 . 2]"
1 92 GLY 15.932 0.339 6 0 "[ . 1 . 2]"
1 93 HIS 6.526 0.228 5 0 "[ . 1 . 2]"
1 94 ILE 8.947 0.284 4 0 "[ . 1 . 2]"
1 95 PHE 6.465 0.312 18 0 "[ . 1 . 2]"
1 96 SER 6.125 0.339 6 0 "[ . 1 . 2]"
1 101 TRP 14.479 0.421 4 0 "[ . 1 . 2]"
1 102 GLY 13.340 0.464 19 0 "[ . 1 . 2]"
1 103 LYS 6.091 0.280 19 0 "[ . 1 . 2]"
1 104 VAL 8.151 0.373 6 0 "[ . 1 . 2]"
1 105 VAL 28.001 0.421 4 0 "[ . 1 . 2]"
1 106 SER 24.908 0.464 19 0 "[ . 1 . 2]"
1 107 LEU 16.566 0.342 1 0 "[ . 1 . 2]"
1 108 TYR 20.417 0.415 9 0 "[ . 1 . 2]"
1 109 ALA 37.379 0.509 14 1 "[ . 1 +. 2]"
1 110 VAL 26.026 0.473 13 0 "[ . 1 . 2]"
1 111 ALA 22.936 0.390 14 0 "[ . 1 . 2]"
1 112 ALA 22.245 0.415 9 0 "[ . 1 . 2]"
1 113 GLY 29.365 0.509 14 1 "[ . 1 +. 2]"
1 114 LEU 26.255 0.473 13 0 "[ . 1 . 2]"
1 115 ALA 20.529 0.390 14 0 "[ . 1 . 2]"
1 116 VAL 20.796 0.359 14 0 "[ . 1 . 2]"
1 117 ASP 23.306 0.399 13 0 "[ . 1 . 2]"
1 118 ALA 11.797 0.368 20 0 "[ . 1 . 2]"
1 119 VAL 8.067 0.312 6 0 "[ . 1 . 2]"
1 120 ARG 10.817 0.355 20 0 "[ . 1 . 2]"
1 121 GLN 10.303 0.386 20 0 "[ . 1 . 2]"
1 125 ALA 9.264 0.312 5 0 "[ . 1 . 2]"
1 126 MET 0.593 0.039 4 0 "[ . 1 . 2]"
1 127 VAL 11.768 0.351 20 0 "[ . 1 . 2]"
1 128 HIS 8.984 0.255 15 0 "[ . 1 . 2]"
1 129 ALA 19.167 0.312 5 0 "[ . 1 . 2]"
1 130 LEU 2.513 0.125 9 0 "[ . 1 . 2]"
1 131 VAL 21.723 0.351 20 0 "[ . 1 . 2]"
1 132 ASP 19.317 0.323 4 0 "[ . 1 . 2]"
1 133 ALA 14.408 0.310 10 0 "[ . 1 . 2]"
1 134 LEU 7.070 0.293 20 0 "[ . 1 . 2]"
1 135 GLY 15.413 0.305 3 0 "[ . 1 . 2]"
1 136 GLU 10.334 0.323 4 0 "[ . 1 . 2]"
1 137 PHE 4.506 0.207 19 0 "[ . 1 . 2]"
1 138 VAL 5.149 0.293 20 0 "[ . 1 . 2]"
1 139 ARG 5.458 0.289 20 0 "[ . 1 . 2]"
1 142 LEU 3.254 0.272 4 0 "[ . 1 . 2]"
1 143 ALA 6.400 0.264 15 0 "[ . 1 . 2]"
1 144 THR 3.682 0.232 17 0 "[ . 1 . 2]"
1 145 TRP 12.029 0.365 13 0 "[ . 1 . 2]"
1 146 LEU 3.254 0.272 4 0 "[ . 1 . 2]"
1 147 ARG 6.400 0.264 15 0 "[ . 1 . 2]"
1 148 ARG 3.682 0.232 17 0 "[ . 1 . 2]"
1 149 ARG 18.564 0.365 13 0 "[ . 1 . 2]"
1 152 TRP 8.392 0.372 19 0 "[ . 1 . 2]"
1 153 THR 5.406 0.324 10 0 "[ . 1 . 2]"
1 154 ASP 16.525 0.347 20 0 "[ . 1 . 2]"
1 155 VAL 8.392 0.372 19 0 "[ . 1 . 2]"
1 156 LEU 5.406 0.324 10 0 "[ . 1 . 2]"
1 157 LYS 9.990 0.347 20 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 23 ARG O 1 27 ALA H . . 1.800 2.069 2.028 2.128 0.328 20 0 "[ . 1 . 2]" 2
2 1 23 ARG O 1 27 ALA N . . 2.700 2.900 2.730 3.040 0.340 18 0 "[ . 1 . 2]" 2
3 1 22 ALA O 1 26 ARG H . . 1.800 1.977 1.786 2.068 0.268 18 0 "[ . 1 . 2]" 2
4 1 22 ALA O 1 26 ARG N . . 2.700 2.783 2.683 2.908 0.208 8 0 "[ . 1 . 2]" 2
5 1 21 HIS O 1 25 LEU H . . 1.800 1.816 1.774 2.006 0.206 7 0 "[ . 1 . 2]" 2
6 1 21 HIS O 1 25 LEU N . . 2.700 2.759 2.705 2.914 0.214 7 0 "[ . 1 . 2]" 2
7 1 20 VAL O 1 24 LEU H . . 1.800 1.853 1.780 2.022 0.222 15 0 "[ . 1 . 2]" 2
8 1 20 VAL O 1 24 LEU N . . 2.700 2.753 2.708 2.881 0.181 15 0 "[ . 1 . 2]" 2
9 1 19 TYR O 1 23 ARG H . . 1.800 2.071 1.988 2.134 0.334 17 0 "[ . 1 . 2]" 2
10 1 19 TYR O 1 23 ARG N . . 2.700 3.025 2.937 3.095 0.395 17 0 "[ . 1 . 2]" 2
11 1 18 GLU O 1 22 ALA H . . 1.800 2.002 1.861 2.134 0.334 12 0 "[ . 1 . 2]" 2
12 1 18 GLU O 1 22 ALA N . . 2.700 2.895 2.751 3.024 0.324 12 0 "[ . 1 . 2]" 2
13 1 17 ARG O 1 21 HIS H . . 1.800 2.060 1.945 2.130 0.330 16 0 "[ . 1 . 2]" 2
14 1 17 ARG O 1 21 HIS N . . 2.700 3.023 2.887 3.065 0.365 19 0 "[ . 1 . 2]" 2
15 1 16 GLY O 1 20 VAL H . . 1.800 1.976 1.835 2.059 0.259 16 0 "[ . 1 . 2]" 2
16 1 16 GLY O 1 20 VAL N . . 2.700 2.930 2.797 3.016 0.316 16 0 "[ . 1 . 2]" 2
17 1 15 LEU O 1 19 TYR H . . 1.800 2.038 1.834 2.197 0.397 16 0 "[ . 1 . 2]" 2
18 1 15 LEU O 1 19 TYR N . . 2.700 2.910 2.708 3.033 0.333 18 0 "[ . 1 . 2]" 2
19 1 14 ALA O 1 18 GLU H . . 1.800 2.036 1.884 2.098 0.298 16 0 "[ . 1 . 2]" 2
20 1 14 ALA O 1 18 GLU N . . 2.700 2.970 2.794 3.036 0.336 9 0 "[ . 1 . 2]" 2
21 1 13 LYS O 1 17 ARG H . . 1.800 1.787 1.739 1.846 0.046 19 0 "[ . 1 . 2]" 2
22 1 13 LYS O 1 17 ARG N . . 2.700 2.728 2.697 2.776 0.076 19 0 "[ . 1 . 2]" 2
23 1 12 ALA O 1 16 GLY H . . 1.800 1.991 1.796 2.162 0.362 9 0 "[ . 1 . 2]" 2
24 1 12 ALA O 1 16 GLY N . . 2.700 2.947 2.726 3.137 0.437 9 0 "[ . 1 . 2]" 2
25 1 11 GLN O 1 15 LEU H . . 1.800 1.949 1.784 2.142 0.342 8 0 "[ . 1 . 2]" 2
26 1 11 GLN O 1 15 LEU N . . 2.700 2.907 2.746 3.045 0.345 11 0 "[ . 1 . 2]" 2
27 1 10 ALA O 1 14 ALA H . . 1.800 2.047 2.001 2.174 0.374 5 0 "[ . 1 . 2]" 2
28 1 10 ALA O 1 14 ALA N . . 2.700 2.988 2.900 3.041 0.341 5 0 "[ . 1 . 2]" 2
29 1 9 VAL O 1 13 LYS H . . 1.800 1.920 1.795 2.058 0.258 8 0 "[ . 1 . 2]" 2
30 1 9 VAL O 1 13 LYS N . . 2.700 2.865 2.763 2.983 0.283 8 0 "[ . 1 . 2]" 2
31 1 8 LEU O 1 12 ALA H . . 1.800 1.803 1.754 1.876 0.076 8 0 "[ . 1 . 2]" 2
32 1 8 LEU O 1 12 ALA N . . 2.700 2.734 2.707 2.770 0.070 13 0 "[ . 1 . 2]" 2
33 1 7 GLU O 1 11 GLN H . . 1.800 2.046 2.016 2.099 0.299 18 0 "[ . 1 . 2]" 2
34 1 7 GLU O 1 11 GLN N . . 2.700 2.949 2.874 2.997 0.297 18 0 "[ . 1 . 2]" 2
35 1 6 LYS O 1 10 ALA H . . 1.800 1.877 1.794 2.017 0.217 14 0 "[ . 1 . 2]" 2
36 1 6 LYS O 1 10 ALA N . . 2.700 2.796 2.731 2.941 0.241 14 0 "[ . 1 . 2]" 2
37 1 5 ASP O 1 9 VAL H . . 1.800 1.844 1.760 2.016 0.216 1 0 "[ . 1 . 2]" 2
38 1 5 ASP O 1 9 VAL N . . 2.700 2.795 2.714 2.984 0.284 1 0 "[ . 1 . 2]" 2
39 1 58 LEU O 1 62 ARG H . . 1.800 2.153 2.100 2.209 0.409 11 0 "[ . 1 . 2]" 2
40 1 58 LEU O 1 62 ARG N . . 2.700 3.052 2.963 3.139 0.439 11 0 "[ . 1 . 2]" 2
41 1 57 GLU O 1 61 ILE H . . 1.800 2.027 1.816 2.113 0.313 17 0 "[ . 1 . 2]" 2
42 1 57 GLU O 1 61 ILE N . . 2.700 2.861 2.739 3.010 0.310 17 0 "[ . 1 . 2]" 2
43 1 56 ASP O 1 60 MET H . . 1.800 2.083 2.010 2.207 0.407 3 0 "[ . 1 . 2]" 2
44 1 56 ASP O 1 60 MET N . . 2.700 2.783 2.718 3.002 0.302 17 0 "[ . 1 . 2]" 2
45 1 55 GLY O 1 59 GLU H . . 1.800 1.794 1.742 2.063 0.263 17 0 "[ . 1 . 2]" 2
46 1 55 GLY O 1 59 GLU N . . 2.700 2.744 2.707 2.984 0.284 17 0 "[ . 1 . 2]" 2
47 1 54 LEU O 1 58 LEU H . . 1.800 2.170 2.095 2.282 0.482 18 0 "[ . 1 . 2]" 2
48 1 54 LEU O 1 58 LEU N . . 2.700 3.128 3.072 3.162 0.462 16 0 "[ . 1 . 2]" 2
49 1 53 ARG O 1 57 GLU H . . 1.800 1.814 1.770 1.972 0.172 18 0 "[ . 1 . 2]" 2
50 1 53 ARG O 1 57 GLU N . . 2.700 2.774 2.726 2.946 0.246 18 0 "[ . 1 . 2]" 2
51 1 52 LEU O 1 56 ASP H . . 1.800 1.835 1.779 2.007 0.207 17 0 "[ . 1 . 2]" 2
52 1 52 LEU O 1 56 ASP N . . 2.700 2.751 2.676 2.941 0.241 17 0 "[ . 1 . 2]" 2
53 1 51 LEU O 1 55 GLY H . . 1.800 1.998 1.855 2.078 0.278 2 0 "[ . 1 . 2]" 2
54 1 51 LEU O 1 55 GLY N . . 2.700 2.941 2.813 3.027 0.327 2 0 "[ . 1 . 2]" 2
55 1 50 VAL O 1 54 LEU H . . 1.800 2.043 1.977 2.101 0.301 13 0 "[ . 1 . 2]" 2
56 1 50 VAL O 1 54 LEU N . . 2.700 2.943 2.886 3.010 0.310 18 0 "[ . 1 . 2]" 2
57 1 49 ALA O 1 53 ARG H . . 1.800 1.914 1.819 2.010 0.210 13 0 "[ . 1 . 2]" 2
58 1 49 ALA O 1 53 ARG N . . 2.700 2.855 2.772 2.956 0.256 13 0 "[ . 1 . 2]" 2
59 1 48 ALA O 1 52 LEU H . . 1.800 1.994 1.922 2.046 0.246 5 0 "[ . 1 . 2]" 2
60 1 48 ALA O 1 52 LEU N . . 2.700 2.906 2.835 2.984 0.284 18 0 "[ . 1 . 2]" 2
61 1 47 VAL O 1 51 LEU H . . 1.800 2.097 2.034 2.192 0.392 17 0 "[ . 1 . 2]" 2
62 1 47 VAL O 1 51 LEU N . . 2.700 3.054 3.010 3.131 0.431 17 0 "[ . 1 . 2]" 2
63 1 46 GLU O 1 50 VAL H . . 1.800 2.030 1.928 2.070 0.270 19 0 "[ . 1 . 2]" 2
64 1 46 GLU O 1 50 VAL N . . 2.700 3.000 2.900 3.045 0.345 19 0 "[ . 1 . 2]" 2
65 1 45 ALA O 1 49 ALA H . . 1.800 2.021 1.883 2.072 0.272 14 0 "[ . 1 . 2]" 2
66 1 45 ALA O 1 49 ALA N . . 2.700 2.920 2.803 3.019 0.319 5 0 "[ . 1 . 2]" 2
67 1 44 LEU O 1 48 ALA H . . 1.800 1.845 1.779 2.010 0.210 5 0 "[ . 1 . 2]" 2
68 1 44 LEU O 1 48 ALA N . . 2.700 2.794 2.700 2.989 0.289 5 0 "[ . 1 . 2]" 2
69 1 43 ARG O 1 47 VAL H . . 1.800 2.066 2.014 2.115 0.315 17 0 "[ . 1 . 2]" 2
70 1 43 ARG O 1 47 VAL N . . 2.700 3.039 2.984 3.094 0.394 17 0 "[ . 1 . 2]" 2
71 1 42 GLY O 1 46 GLU H . . 1.800 1.975 1.797 2.090 0.290 4 0 "[ . 1 . 2]" 2
72 1 42 GLY O 1 46 GLU N . . 2.700 2.874 2.736 3.012 0.312 18 0 "[ . 1 . 2]" 2
73 1 71 ARG O 1 74 HIS H . . 1.800 2.083 2.054 2.113 0.313 7 0 "[ . 1 . 2]" 2
74 1 71 ARG O 1 74 HIS N . . 2.700 2.990 2.939 3.053 0.353 7 0 "[ . 1 . 2]" 2
75 1 70 ALA O 1 73 LEU H . . 1.800 2.080 2.055 2.129 0.329 7 0 "[ . 1 . 2]" 2
76 1 70 ALA O 1 73 LEU N . . 2.700 2.959 2.833 3.029 0.329 7 0 "[ . 1 . 2]" 2
77 1 69 VAL O 1 72 GLN H . . 1.800 2.120 2.069 2.163 0.363 7 0 "[ . 1 . 2]" 2
78 1 69 VAL O 1 72 GLN N . . 2.700 2.737 2.726 2.786 0.086 14 0 "[ . 1 . 2]" 2
79 1 92 GLY O 1 96 SER H . . 1.800 2.074 2.022 2.139 0.339 6 0 "[ . 1 . 2]" 2
80 1 92 GLY O 1 96 SER N . . 2.700 2.732 2.691 2.867 0.167 12 0 "[ . 1 . 2]" 2
81 1 91 ALA O 1 95 PHE H . . 1.800 1.958 1.787 2.034 0.234 18 0 "[ . 1 . 2]" 2
82 1 91 ALA O 1 95 PHE N . . 2.700 2.865 2.750 3.012 0.312 18 0 "[ . 1 . 2]" 2
83 1 90 VAL O 1 94 ILE H . . 1.800 2.008 1.823 2.036 0.236 4 0 "[ . 1 . 2]" 2
84 1 90 VAL O 1 94 ILE N . . 2.700 2.940 2.760 2.984 0.284 4 0 "[ . 1 . 2]" 2
85 1 89 ALA O 1 93 HIS H . . 1.800 1.994 1.900 2.023 0.223 6 0 "[ . 1 . 2]" 2
86 1 89 ALA O 1 93 HIS N . . 2.700 2.832 2.737 2.928 0.228 5 0 "[ . 1 . 2]" 2
87 1 88 LEU O 1 92 GLY H . . 1.800 2.011 1.896 2.043 0.243 18 0 "[ . 1 . 2]" 2
88 1 88 LEU O 1 92 GLY N . . 2.700 2.979 2.852 3.023 0.323 18 0 "[ . 1 . 2]" 2
89 1 87 PHE O 1 91 ALA H . . 1.800 1.946 1.800 2.063 0.263 3 0 "[ . 1 . 2]" 2
90 1 87 PHE O 1 91 ALA N . . 2.700 2.851 2.749 2.929 0.229 4 0 "[ . 1 . 2]" 2
91 1 86 ALA O 1 90 VAL H . . 1.800 2.012 1.953 2.043 0.243 14 0 "[ . 1 . 2]" 2
92 1 86 ALA O 1 90 VAL N . . 2.700 2.982 2.910 3.014 0.314 20 0 "[ . 1 . 2]" 2
93 1 85 ASP O 1 89 ALA H . . 1.800 1.884 1.795 2.015 0.215 1 0 "[ . 1 . 2]" 2
94 1 85 ASP O 1 89 ALA N . . 2.700 2.813 2.737 2.922 0.222 19 0 "[ . 1 . 2]" 2
95 1 84 THR O 1 88 LEU H . . 1.800 1.815 1.778 1.939 0.139 18 0 "[ . 1 . 2]" 2
96 1 84 THR O 1 88 LEU N . . 2.700 2.763 2.726 2.867 0.167 18 0 "[ . 1 . 2]" 2
97 1 83 VAL O 1 87 PHE H . . 1.800 2.066 1.787 2.122 0.322 14 0 "[ . 1 . 2]" 2
98 1 83 VAL O 1 87 PHE N . . 2.700 2.985 2.742 3.042 0.342 14 0 "[ . 1 . 2]" 2
99 1 82 VAL O 1 86 ALA H . . 1.800 1.869 1.781 2.050 0.250 2 0 "[ . 1 . 2]" 2
100 1 82 VAL O 1 86 ALA N . . 2.700 2.794 2.723 2.934 0.234 1 0 "[ . 1 . 2]" 2
101 1 81 ARG O 1 85 ASP H . . 1.800 2.040 1.794 2.148 0.348 2 0 "[ . 1 . 2]" 2
102 1 81 ARG O 1 85 ASP N . . 2.700 2.956 2.746 3.039 0.339 2 0 "[ . 1 . 2]" 2
103 1 80 GLU O 1 84 THR H . . 1.800 2.062 1.796 2.129 0.329 1 0 "[ . 1 . 2]" 2
104 1 80 GLU O 1 84 THR N . . 2.700 2.995 2.742 3.046 0.346 16 0 "[ . 1 . 2]" 2
105 1 117 ASP O 1 121 GLN H . . 1.800 2.119 2.076 2.186 0.386 20 0 "[ . 1 . 2]" 2
106 1 117 ASP O 1 121 GLN N . . 2.700 2.896 2.820 2.998 0.298 20 0 "[ . 1 . 2]" 2
107 1 116 VAL O 1 120 ARG H . . 1.800 2.065 2.003 2.126 0.326 14 0 "[ . 1 . 2]" 2
108 1 116 VAL O 1 120 ARG N . . 2.700 2.975 2.871 3.055 0.355 20 0 "[ . 1 . 2]" 2
109 1 115 ALA O 1 119 VAL H . . 1.800 1.967 1.897 2.034 0.234 6 0 "[ . 1 . 2]" 2
110 1 115 ALA O 1 119 VAL N . . 2.700 2.936 2.871 3.012 0.312 6 0 "[ . 1 . 2]" 2
111 1 114 LEU O 1 118 ALA H . . 1.800 2.076 2.047 2.098 0.298 2 0 "[ . 1 . 2]" 2
112 1 114 LEU O 1 118 ALA N . . 2.700 3.014 2.949 3.068 0.368 20 0 "[ . 1 . 2]" 2
113 1 113 GLY O 1 117 ASP H . . 1.800 2.091 2.035 2.163 0.363 20 0 "[ . 1 . 2]" 2
114 1 113 GLY O 1 117 ASP N . . 2.700 3.059 3.012 3.099 0.399 13 0 "[ . 1 . 2]" 2
115 1 112 ALA O 1 116 VAL H . . 1.800 2.024 1.878 2.135 0.335 14 0 "[ . 1 . 2]" 2
116 1 112 ALA O 1 116 VAL N . . 2.700 2.975 2.834 3.059 0.359 14 0 "[ . 1 . 2]" 2
117 1 111 ALA O 1 115 ALA H . . 1.800 2.082 2.048 2.141 0.341 7 0 "[ . 1 . 2]" 2
118 1 111 ALA O 1 115 ALA N . . 2.700 3.041 3.003 3.090 0.390 14 0 "[ . 1 . 2]" 2
119 1 110 VAL O 1 114 LEU H . . 1.800 2.137 2.032 2.227 0.427 7 0 "[ . 1 . 2]" 2
120 1 110 VAL O 1 114 LEU N . . 2.700 3.086 2.998 3.173 0.473 13 0 "[ . 1 . 2]" 2
121 1 109 ALA O 1 113 GLY H . . 1.800 2.199 2.146 2.273 0.473 14 0 "[ . 1 . 2]" 2
122 1 109 ALA O 1 113 GLY N . . 2.700 3.119 3.061 3.209 0.509 14 1 "[ . 1 +. 2]" 2
123 1 108 TYR O 1 112 ALA H . . 1.800 2.078 1.816 2.163 0.363 9 0 "[ . 1 . 2]" 2
124 1 108 TYR O 1 112 ALA N . . 2.700 3.035 2.761 3.115 0.415 9 0 "[ . 1 . 2]" 2
125 1 107 LEU O 1 111 ALA H . . 1.800 2.025 1.962 2.076 0.276 1 0 "[ . 1 . 2]" 2
126 1 107 LEU O 1 111 ALA N . . 2.700 2.999 2.938 3.042 0.342 1 0 "[ . 1 . 2]" 2
127 1 106 SER O 1 110 VAL H . . 1.800 2.057 2.024 2.098 0.298 19 0 "[ . 1 . 2]" 2
128 1 106 SER O 1 110 VAL N . . 2.700 3.022 2.988 3.057 0.357 13 0 "[ . 1 . 2]" 2
129 1 105 VAL O 1 109 ALA H . . 1.800 2.104 2.063 2.154 0.354 1 0 "[ . 1 . 2]" 2
130 1 105 VAL O 1 109 ALA N . . 2.700 3.072 3.032 3.112 0.412 1 0 "[ . 1 . 2]" 2
131 1 104 VAL O 1 108 TYR H . . 1.800 1.978 1.813 2.126 0.326 13 0 "[ . 1 . 2]" 2
132 1 104 VAL O 1 108 TYR N . . 2.700 2.930 2.793 3.073 0.373 6 0 "[ . 1 . 2]" 2
133 1 103 LYS O 1 107 LEU H . . 1.800 1.941 1.827 2.035 0.235 19 0 "[ . 1 . 2]" 2
134 1 103 LYS O 1 107 LEU N . . 2.700 2.863 2.743 2.980 0.280 19 0 "[ . 1 . 2]" 2
135 1 102 GLY O 1 106 SER H . . 1.800 2.096 2.042 2.185 0.385 19 0 "[ . 1 . 2]" 2
136 1 102 GLY O 1 106 SER N . . 2.700 3.071 3.016 3.164 0.464 19 0 "[ . 1 . 2]" 2
137 1 101 TRP O 1 105 VAL H . . 1.800 2.146 2.077 2.195 0.395 12 0 "[ . 1 . 2]" 2
138 1 101 TRP O 1 105 VAL N . . 2.700 3.078 3.002 3.121 0.421 4 0 "[ . 1 . 2]" 2
139 1 135 GLY O 1 139 ARG H . . 1.800 1.980 1.855 2.089 0.289 20 0 "[ . 1 . 2]" 2
140 1 135 GLY O 1 139 ARG N . . 2.700 2.793 2.720 2.924 0.224 20 0 "[ . 1 . 2]" 2
141 1 134 LEU O 1 138 VAL H . . 1.800 2.004 1.928 2.093 0.293 20 0 "[ . 1 . 2]" 2
142 1 134 LEU O 1 138 VAL N . . 2.700 2.754 2.709 2.825 0.125 20 0 "[ . 1 . 2]" 2
143 1 133 ALA O 1 137 PHE H . . 1.800 1.920 1.803 2.007 0.207 19 0 "[ . 1 . 2]" 2
144 1 133 ALA O 1 137 PHE N . . 2.700 2.805 2.740 2.904 0.204 4 0 "[ . 1 . 2]" 2
145 1 132 ASP O 1 136 GLU H . . 1.800 2.032 2.006 2.055 0.255 1 0 "[ . 1 . 2]" 2
146 1 132 ASP O 1 136 GLU N . . 2.700 2.985 2.922 3.023 0.323 4 0 "[ . 1 . 2]" 2
147 1 131 VAL O 1 135 GLY H . . 1.800 2.015 1.938 2.044 0.244 20 0 "[ . 1 . 2]" 2
148 1 131 VAL O 1 135 GLY N . . 2.700 2.983 2.899 3.005 0.305 3 0 "[ . 1 . 2]" 2
149 1 130 LEU O 1 134 LEU H . . 1.800 1.809 1.776 1.864 0.064 9 0 "[ . 1 . 2]" 2
150 1 130 LEU O 1 134 LEU N . . 2.700 2.781 2.744 2.825 0.125 9 0 "[ . 1 . 2]" 2
151 1 129 ALA O 1 133 ALA H . . 1.800 2.017 1.861 2.039 0.239 13 0 "[ . 1 . 2]" 2
152 1 129 ALA O 1 133 ALA N . . 2.700 2.979 2.838 3.010 0.310 10 0 "[ . 1 . 2]" 2
153 1 128 HIS O 1 132 ASP H . . 1.800 2.026 2.008 2.040 0.240 17 0 "[ . 1 . 2]" 2
154 1 128 HIS O 1 132 ASP N . . 2.700 2.924 2.888 2.955 0.255 15 0 "[ . 1 . 2]" 2
155 1 127 VAL O 1 131 VAL H . . 1.800 2.074 2.057 2.114 0.314 20 0 "[ . 1 . 2]" 2
156 1 127 VAL O 1 131 VAL N . . 2.700 3.015 2.995 3.051 0.351 20 0 "[ . 1 . 2]" 2
157 1 126 MET O 1 130 LEU H . . 1.800 1.786 1.758 1.819 0.019 9 0 "[ . 1 . 2]" 2
158 1 126 MET O 1 130 LEU N . . 2.700 2.729 2.706 2.739 0.039 4 0 "[ . 1 . 2]" 2
159 1 125 ALA O 1 129 ALA H . . 1.800 2.009 1.932 2.040 0.240 5 0 "[ . 1 . 2]" 2
160 1 125 ALA O 1 129 ALA N . . 2.700 2.954 2.884 3.012 0.312 5 0 "[ . 1 . 2]" 2
161 1 145 TRP O 1 149 ARG H . . 1.800 2.117 2.074 2.165 0.365 13 0 "[ . 1 . 2]" 2
162 1 145 TRP O 1 149 ARG N . . 2.700 2.984 2.907 3.047 0.347 13 0 "[ . 1 . 2]" 2
163 1 144 THR O 1 148 ARG H . . 1.800 1.932 1.792 2.032 0.232 17 0 "[ . 1 . 2]" 2
164 1 144 THR O 1 148 ARG N . . 2.700 2.752 2.698 2.867 0.167 9 0 "[ . 1 . 2]" 2
165 1 143 ALA O 1 147 ARG H . . 1.800 2.034 1.949 2.064 0.264 15 0 "[ . 1 . 2]" 2
166 1 143 ALA O 1 147 ARG N . . 2.700 2.786 2.724 2.901 0.201 4 0 "[ . 1 . 2]" 2
167 1 142 LEU O 1 146 LEU H . . 1.800 1.851 1.779 2.010 0.210 4 0 "[ . 1 . 2]" 2
168 1 142 LEU O 1 146 LEU N . . 2.700 2.808 2.712 2.972 0.272 4 0 "[ . 1 . 2]" 2
169 1 154 ASP O 1 157 LYS H . . 1.800 2.041 2.007 2.110 0.310 20 0 "[ . 1 . 2]" 2
170 1 154 ASP O 1 157 LYS N . . 2.700 2.959 2.881 3.047 0.347 20 0 "[ . 1 . 2]" 2
171 1 153 THR O 1 156 LEU H . . 1.800 1.970 1.860 2.121 0.321 10 0 "[ . 1 . 2]" 2
172 1 153 THR O 1 156 LEU N . . 2.700 2.800 2.688 3.024 0.324 10 0 "[ . 1 . 2]" 2
173 1 152 TRP O 1 155 VAL H . . 1.800 2.056 1.851 2.172 0.372 19 0 "[ . 1 . 2]" 2
174 1 152 TRP O 1 155 VAL N . . 2.700 2.864 2.726 3.062 0.362 15 0 "[ . 1 . 2]" 2
175 1 149 ARG HH21 1 154 ASP OD2 . . 1.800 2.021 1.999 2.048 0.248 10 0 "[ . 1 . 2]" 2
176 1 149 ARG NH2 1 154 ASP OD2 . . 2.700 2.805 2.787 2.898 0.198 10 0 "[ . 1 . 2]" 2
177 1 26 ARG QH1 1 59 GLU OE1 . . 1.800 2.107 2.024 2.155 0.355 18 0 "[ . 1 . 2]" 2
178 1 26 ARG NH1 1 59 GLU OE1 . . 2.700 2.751 2.702 2.955 0.255 11 0 "[ . 1 . 2]" 2
179 1 26 ARG QH1 1 56 ASP OD1 . . 1.800 2.087 1.869 2.308 0.508 1 1 "[+ . 1 . 2]" 2
180 1 26 ARG NH1 1 56 ASP OD1 . . 2.700 2.748 2.578 2.889 0.189 8 0 "[ . 1 . 2]" 2
181 1 26 ARG HH22 1 56 ASP OD2 . . 1.800 2.091 2.027 2.348 0.548 1 2 "[+ . 1- . 2]" 2
182 1 26 ARG NH2 1 56 ASP OD2 . . 2.700 2.956 2.742 3.033 0.333 12 0 "[ . 1 . 2]" 2
183 1 23 ARG HH12 1 66 TYR O . . 1.800 2.140 2.051 2.551 0.751 13 1 "[ . 1 + . 2]" 2
184 1 23 ARG NH1 1 66 TYR O . . 2.700 2.961 2.719 3.047 0.347 14 0 "[ . 1 . 2]" 2
185 1 23 ARG QH2 1 109 ALA O . . 1.800 2.144 2.101 2.221 0.421 10 0 "[ . 1 . 2]" 2
186 1 23 ARG NH2 1 109 ALA O . . 2.700 2.729 2.675 2.777 0.077 13 0 "[ . 1 . 2]" 2
187 1 23 ARG HE 1 59 GLU OE2 . . 1.800 2.219 2.130 2.423 0.623 18 5 "[ * . -1* *. + 2]" 2
188 1 23 ARG NE 1 59 GLU OE2 . . 2.700 2.684 2.650 2.706 0.006 13 0 "[ . 1 . 2]" 2
189 1 68 ASN OD1 1 71 ARG HE . . 1.800 1.993 1.854 2.063 0.263 19 0 "[ . 1 . 2]" 2
190 1 68 ASN OD1 1 71 ARG NE . . 2.700 2.875 2.787 2.997 0.297 16 0 "[ . 1 . 2]" 2
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