NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | in_dress | stage | program | type | subtype | subsubtype |
|
|
375713 |
1f3y   |
4448 | cing | recoord | dress | 4-filtered-FRED | Wattos | check | violation | distance |
data_1f3y
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 1998
_Distance_constraint_stats_list.Viol_count 7187
_Distance_constraint_stats_list.Viol_total 13498.567
_Distance_constraint_stats_list.Viol_max 0.486
_Distance_constraint_stats_list.Viol_rms 0.0347
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0108
_Distance_constraint_stats_list.Viol_average_violations_only 0.0751
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 2 PRO 0.547 0.379 20 0 "[ . 1 . 2 .]"
1 3 LEU 6.245 0.379 20 0 "[ . 1 . 2 .]"
1 4 GLY 0.148 0.053 3 0 "[ . 1 . 2 .]"
1 5 SER 8.595 0.413 9 0 "[ . 1 . 2 .]"
1 6 MET 8.256 0.336 25 0 "[ . 1 . 2 .]"
1 7 ASP 5.001 0.240 20 0 "[ . 1 . 2 .]"
1 8 SER 0.746 0.114 20 0 "[ . 1 . 2 .]"
1 9 PRO 8.349 0.250 3 0 "[ . 1 . 2 .]"
1 10 PRO 12.374 0.252 5 0 "[ . 1 . 2 .]"
1 11 GLU 3.011 0.250 20 0 "[ . 1 . 2 .]"
1 12 GLY 2.901 0.359 23 0 "[ . 1 . 2 .]"
1 13 TYR 5.122 0.324 17 0 "[ . 1 . 2 .]"
1 14 ARG 7.301 0.455 7 0 "[ . 1 . 2 .]"
1 15 ARG 6.024 0.455 7 0 "[ . 1 . 2 .]"
1 16 ASN 9.457 0.276 7 0 "[ . 1 . 2 .]"
1 17 VAL 13.415 0.217 4 0 "[ . 1 . 2 .]"
1 18 GLY 1.408 0.112 2 0 "[ . 1 . 2 .]"
1 19 ILE 4.070 0.321 11 0 "[ . 1 . 2 .]"
1 20 CYS 1.023 0.126 18 0 "[ . 1 . 2 .]"
1 21 LEU 9.111 0.486 3 0 "[ . 1 . 2 .]"
1 22 MET 10.643 0.320 24 0 "[ . 1 . 2 .]"
1 23 ASN 12.792 0.260 8 0 "[ . 1 . 2 .]"
1 24 ASN 2.183 0.260 8 0 "[ . 1 . 2 .]"
1 25 ASP 15.749 0.204 7 0 "[ . 1 . 2 .]"
1 26 LYS 8.243 0.240 7 0 "[ . 1 . 2 .]"
1 27 LYS 9.024 0.204 7 0 "[ . 1 . 2 .]"
1 28 ILE 12.336 0.282 3 0 "[ . 1 . 2 .]"
1 29 PHE 5.756 0.174 19 0 "[ . 1 . 2 .]"
1 30 ALA 10.040 0.351 3 0 "[ . 1 . 2 .]"
1 31 ALA 1.372 0.091 5 0 "[ . 1 . 2 .]"
1 32 SER 0.484 0.158 20 0 "[ . 1 . 2 .]"
1 33 ARG 9.272 0.212 2 0 "[ . 1 . 2 .]"
1 34 LEU 24.132 0.387 11 0 "[ . 1 . 2 .]"
1 35 ASP 3.154 0.176 9 0 "[ . 1 . 2 .]"
1 36 ILE 6.799 0.266 11 0 "[ . 1 . 2 .]"
1 37 PRO 1.852 0.077 8 0 "[ . 1 . 2 .]"
1 38 ASP 0.985 0.072 20 0 "[ . 1 . 2 .]"
1 39 ALA 6.044 0.266 11 0 "[ . 1 . 2 .]"
1 40 TRP 18.214 0.194 19 0 "[ . 1 . 2 .]"
1 41 GLN 4.846 0.385 18 0 "[ . 1 . 2 .]"
1 42 MET 6.688 0.385 18 0 "[ . 1 . 2 .]"
1 43 PRO 1.464 0.114 18 0 "[ . 1 . 2 .]"
1 44 GLN 2.194 0.321 11 0 "[ . 1 . 2 .]"
1 45 GLY 1.960 0.177 12 0 "[ . 1 . 2 .]"
1 46 GLY 6.630 0.228 13 0 "[ . 1 . 2 .]"
1 47 ILE 4.113 0.276 7 0 "[ . 1 . 2 .]"
1 48 ASP 1.194 0.098 9 0 "[ . 1 . 2 .]"
1 49 GLU 1.570 0.216 24 0 "[ . 1 . 2 .]"
1 50 GLY 0.620 0.216 24 0 "[ . 1 . 2 .]"
1 51 GLU 0.896 0.168 2 0 "[ . 1 . 2 .]"
1 52 ASP 0.505 0.120 23 0 "[ . 1 . 2 .]"
1 53 PRO 11.120 0.255 23 0 "[ . 1 . 2 .]"
1 54 ARG 17.747 0.326 3 0 "[ . 1 . 2 .]"
1 55 ASN 10.495 0.280 22 0 "[ . 1 . 2 .]"
1 56 ALA 3.977 0.169 3 0 "[ . 1 . 2 .]"
1 57 ALA 7.120 0.217 4 0 "[ . 1 . 2 .]"
1 58 ILE 7.606 0.326 3 0 "[ . 1 . 2 .]"
1 59 ARG 10.533 0.225 6 0 "[ . 1 . 2 .]"
1 60 GLU 2.057 0.174 19 0 "[ . 1 . 2 .]"
1 61 LEU 3.096 0.148 20 0 "[ . 1 . 2 .]"
1 62 ARG 11.318 0.174 6 0 "[ . 1 . 2 .]"
1 63 GLU 3.587 0.131 18 0 "[ . 1 . 2 .]"
1 64 GLU 3.179 0.131 18 0 "[ . 1 . 2 .]"
1 65 THR 8.229 0.200 9 0 "[ . 1 . 2 .]"
1 66 GLY 0.099 0.060 16 0 "[ . 1 . 2 .]"
1 67 VAL 10.456 0.246 16 0 "[ . 1 . 2 .]"
1 68 THR 4.650 0.165 9 0 "[ . 1 . 2 .]"
1 69 SER 10.857 0.219 9 0 "[ . 1 . 2 .]"
1 70 ALA 8.006 0.219 9 0 "[ . 1 . 2 .]"
1 71 GLU 3.622 0.127 9 0 "[ . 1 . 2 .]"
1 72 VAL 16.933 0.293 4 0 "[ . 1 . 2 .]"
1 73 ILE 13.639 0.320 24 0 "[ . 1 . 2 .]"
1 74 ALA 8.917 0.236 4 0 "[ . 1 . 2 .]"
1 75 GLU 1.528 0.110 18 0 "[ . 1 . 2 .]"
1 76 VAL 9.740 0.334 12 0 "[ . 1 . 2 .]"
1 77 PRO 7.515 0.218 24 0 "[ . 1 . 2 .]"
1 78 TYR 11.639 0.240 20 0 "[ . 1 . 2 .]"
1 79 TRP 6.491 0.223 9 0 "[ . 1 . 2 .]"
1 80 LEU 12.163 0.413 9 0 "[ . 1 . 2 .]"
1 81 THR 3.481 0.336 25 0 "[ . 1 . 2 .]"
1 82 TYR 1.802 0.098 9 0 "[ . 1 . 2 .]"
1 83 ASP 2.742 0.187 9 0 "[ . 1 . 2 .]"
1 84 PHE 6.261 0.264 10 0 "[ . 1 . 2 .]"
1 85 PRO 2.701 0.249 9 0 "[ . 1 . 2 .]"
1 86 PRO 0.682 0.139 16 0 "[ . 1 . 2 .]"
1 87 LYS 0.048 0.032 24 0 "[ . 1 . 2 .]"
1 88 VAL 4.795 0.263 23 0 "[ . 1 . 2 .]"
1 89 ARG 7.529 0.264 10 0 "[ . 1 . 2 .]"
1 90 GLU 6.243 0.387 10 0 "[ . 1 . 2 .]"
1 91 LYS 0.611 0.108 5 0 "[ . 1 . 2 .]"
1 92 LEU 5.189 0.394 20 0 "[ . 1 . 2 .]"
1 93 ASN 2.930 0.221 23 0 "[ . 1 . 2 .]"
1 94 ILE 6.185 0.387 10 0 "[ . 1 . 2 .]"
1 95 GLN 5.744 0.300 20 0 "[ . 1 . 2 .]"
1 96 TRP 11.103 0.394 20 0 "[ . 1 . 2 .]"
1 97 GLY 0.943 0.205 17 0 "[ . 1 . 2 .]"
1 98 SER 2.485 0.228 11 0 "[ . 1 . 2 .]"
1 99 ASP 2.419 0.228 11 0 "[ . 1 . 2 .]"
1 100 TRP 5.757 0.377 15 0 "[ . 1 . 2 .]"
1 101 LYS 7.941 0.252 2 0 "[ . 1 . 2 .]"
1 102 GLY 8.797 0.252 2 0 "[ . 1 . 2 .]"
1 103 GLN 1.455 0.209 10 0 "[ . 1 . 2 .]"
1 104 ALA 4.612 0.248 2 0 "[ . 1 . 2 .]"
1 105 GLN 6.078 0.248 2 0 "[ . 1 . 2 .]"
1 106 LYS 2.842 0.181 4 0 "[ . 1 . 2 .]"
1 107 TRP 1.483 0.175 19 0 "[ . 1 . 2 .]"
1 108 PHE 14.827 0.294 11 0 "[ . 1 . 2 .]"
1 109 LEU 6.478 0.264 5 0 "[ . 1 . 2 .]"
1 110 PHE 7.332 0.294 11 0 "[ . 1 . 2 .]"
1 111 LYS 10.767 0.293 4 0 "[ . 1 . 2 .]"
1 112 PHE 17.301 0.486 3 0 "[ . 1 . 2 .]"
1 113 THR 1.220 0.103 18 0 "[ . 1 . 2 .]"
1 114 GLY 3.908 0.114 13 0 "[ . 1 . 2 .]"
1 115 GLN 3.998 0.127 1 0 "[ . 1 . 2 .]"
1 116 ASP 8.125 0.286 16 0 "[ . 1 . 2 .]"
1 117 GLN 6.936 0.286 16 0 "[ . 1 . 2 .]"
1 118 GLU 4.332 0.282 16 0 "[ . 1 . 2 .]"
1 119 ILE 22.677 0.235 3 0 "[ . 1 . 2 .]"
1 120 ASN 1.114 0.074 20 0 "[ . 1 . 2 .]"
1 121 LEU 7.979 0.276 21 0 "[ . 1 . 2 .]"
1 122 LEU 5.727 0.329 19 0 "[ . 1 . 2 .]"
1 123 GLY 7.134 0.371 11 0 "[ . 1 . 2 .]"
1 124 ASP 6.687 0.371 11 0 "[ . 1 . 2 .]"
1 125 GLY 0.229 0.104 11 0 "[ . 1 . 2 .]"
1 126 SER 0.738 0.215 18 0 "[ . 1 . 2 .]"
1 127 GLU 1.124 0.215 18 0 "[ . 1 . 2 .]"
1 128 LYS 7.874 0.288 25 0 "[ . 1 . 2 .]"
1 129 PRO 18.547 0.387 11 0 "[ . 1 . 2 .]"
1 130 GLU 2.392 0.310 9 0 "[ . 1 . 2 .]"
1 131 PHE 7.310 0.180 21 0 "[ . 1 . 2 .]"
1 132 GLY 12.707 0.241 21 0 "[ . 1 . 2 .]"
1 133 GLU 9.684 0.186 5 0 "[ . 1 . 2 .]"
1 134 TRP 12.789 0.276 21 0 "[ . 1 . 2 .]"
1 135 SER 14.121 0.246 20 0 "[ . 1 . 2 .]"
1 136 TRP 11.431 0.246 20 0 "[ . 1 . 2 .]"
1 137 VAL 7.145 0.178 17 0 "[ . 1 . 2 .]"
1 138 THR 8.971 0.234 10 0 "[ . 1 . 2 .]"
1 139 PRO 14.529 0.319 10 0 "[ . 1 . 2 .]"
1 140 GLU 3.085 0.099 17 0 "[ . 1 . 2 .]"
1 141 GLN 5.065 0.153 14 0 "[ . 1 . 2 .]"
1 142 LEU 6.088 0.351 3 0 "[ . 1 . 2 .]"
1 143 ILE 14.402 0.255 20 0 "[ . 1 . 2 .]"
1 144 ASP 4.742 0.173 10 0 "[ . 1 . 2 .]"
1 145 LEU 6.491 0.173 10 0 "[ . 1 . 2 .]"
1 146 THR 4.225 0.196 22 0 "[ . 1 . 2 .]"
1 147 VAL 6.568 0.212 2 0 "[ . 1 . 2 .]"
1 148 GLU 3.037 0.371 10 0 "[ . 1 . 2 .]"
1 149 PHE 3.316 0.371 10 0 "[ . 1 . 2 .]"
1 150 LYS 2.787 0.166 14 0 "[ . 1 . 2 .]"
1 151 LYS 7.549 0.185 4 0 "[ . 1 . 2 .]"
1 152 PRO 4.115 0.298 17 0 "[ . 1 . 2 .]"
1 153 VAL 0.816 0.086 14 0 "[ . 1 . 2 .]"
1 154 TYR 5.688 0.185 4 0 "[ . 1 . 2 .]"
1 155 LYS 13.534 0.255 20 0 "[ . 1 . 2 .]"
1 156 GLU 10.563 0.210 11 0 "[ . 1 . 2 .]"
1 157 VAL 6.738 0.210 11 0 "[ . 1 . 2 .]"
1 158 LEU 16.080 0.319 10 0 "[ . 1 . 2 .]"
1 159 SER 2.217 0.123 10 0 "[ . 1 . 2 .]"
1 160 VAL 8.547 0.334 12 0 "[ . 1 . 2 .]"
1 161 PHE 8.650 0.179 2 0 "[ . 1 . 2 .]"
1 162 ALA 8.607 0.136 4 0 "[ . 1 . 2 .]"
1 163 PRO 0.761 0.051 17 0 "[ . 1 . 2 .]"
1 164 HIS 6.717 0.111 9 0 "[ . 1 . 2 .]"
1 165 LEU 6.599 0.240 7 0 "[ . 1 . 2 .]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 GLY QA 1 2 PRO QB 0.000 . 4.810 4.446 4.286 4.626 . 0 0 "[ . 1 . 2 .]" 1
2 1 2 PRO HA 1 3 LEU H 0.000 . 2.830 2.400 2.162 3.209 0.379 20 0 "[ . 1 . 2 .]" 1
3 1 2 PRO QB 1 3 LEU H 0.000 . 3.290 2.755 1.976 3.458 0.168 20 0 "[ . 1 . 2 .]" 1
4 1 3 LEU HA 1 4 GLY H 0.000 . 2.870 2.356 2.138 2.732 . 0 0 "[ . 1 . 2 .]" 1
5 1 3 LEU HA 1 82 TYR HA 0.000 . 3.640 3.284 1.751 3.666 0.049 4 0 "[ . 1 . 2 .]" 1
6 1 3 LEU HA 1 82 TYR QD 0.000 . 5.500 4.729 3.415 5.586 0.086 6 0 "[ . 1 . 2 .]" 1
7 1 3 LEU QB 1 4 GLY H 0.000 . 4.070 2.953 1.825 3.866 . 0 0 "[ . 1 . 2 .]" 1
8 1 3 LEU QB 1 80 LEU MD2 0.000 . 3.850 3.787 3.213 3.974 0.124 17 0 "[ . 1 . 2 .]" 1
9 1 3 LEU QB 1 153 VAL MG2 0.000 . 5.310 3.909 2.908 4.753 . 0 0 "[ . 1 . 2 .]" 1
10 1 3 LEU MD1 1 4 GLY H 0.000 . 5.500 4.102 3.049 5.108 . 0 0 "[ . 1 . 2 .]" 1
11 1 3 LEU MD1 1 6 MET ME 0.000 . 5.650 5.715 5.517 5.818 0.168 2 0 "[ . 1 . 2 .]" 1
12 1 3 LEU MD1 1 80 LEU HA 0.000 . 5.500 4.158 3.557 4.964 . 0 0 "[ . 1 . 2 .]" 1
13 1 3 LEU MD1 1 82 TYR HA 0.000 . 4.820 4.487 2.917 4.898 0.078 12 0 "[ . 1 . 2 .]" 1
14 1 3 LEU MD1 1 82 TYR QB 0.000 . 5.500 4.165 2.675 5.569 0.069 7 0 "[ . 1 . 2 .]" 1
15 1 3 LEU MD1 1 82 TYR QD 0.000 . 5.500 3.477 1.906 4.609 . 0 0 "[ . 1 . 2 .]" 1
16 1 3 LEU MD1 1 82 TYR QE 0.000 . 5.490 4.117 1.951 5.588 0.098 9 0 "[ . 1 . 2 .]" 1
17 1 3 LEU MD1 1 152 PRO QB 0.000 . 3.020 2.983 2.305 3.318 0.298 17 0 "[ . 1 . 2 .]" 1
18 1 3 LEU MD1 1 152 PRO QG 0.000 . 3.790 3.532 2.954 3.842 0.052 7 0 "[ . 1 . 2 .]" 1
19 1 3 LEU MD1 1 153 VAL HA 0.000 . 3.700 2.273 1.743 3.565 0.057 25 0 "[ . 1 . 2 .]" 1
20 1 3 LEU MD1 1 156 GLU QG 0.000 . 5.000 4.386 3.689 5.010 0.010 13 0 "[ . 1 . 2 .]" 1
21 1 3 LEU MD2 1 80 LEU MD2 0.000 . 5.500 4.169 1.685 5.313 0.115 16 0 "[ . 1 . 2 .]" 1
22 1 3 LEU MD2 1 82 TYR HA 0.000 . 5.500 3.841 1.968 5.416 . 0 0 "[ . 1 . 2 .]" 1
23 1 3 LEU MD2 1 82 TYR QB 0.000 . 5.500 3.748 2.078 5.187 . 0 0 "[ . 1 . 2 .]" 1
24 1 3 LEU MD2 1 82 TYR QD 0.000 . 5.500 3.031 1.746 4.378 0.054 7 0 "[ . 1 . 2 .]" 1
25 1 3 LEU MD2 1 82 TYR QE 0.000 . 5.490 3.545 1.920 5.565 0.075 3 0 "[ . 1 . 2 .]" 1
26 1 3 LEU MD2 1 153 VAL HA 0.000 . 5.500 3.337 1.891 4.112 . 0 0 "[ . 1 . 2 .]" 1
27 1 3 LEU MD2 1 153 VAL HB 0.000 . 4.940 4.676 3.773 5.026 0.086 14 0 "[ . 1 . 2 .]" 1
28 1 3 LEU MD2 1 156 GLU QB 0.000 . 5.340 4.577 2.238 5.383 0.043 17 0 "[ . 1 . 2 .]" 1
29 1 4 GLY H 1 5 SER H 0.000 . 5.500 2.780 1.847 4.587 . 0 0 "[ . 1 . 2 .]" 1
30 1 4 GLY H 1 81 THR H 0.000 . 4.170 3.766 2.891 4.223 0.053 3 0 "[ . 1 . 2 .]" 1
31 1 4 GLY HA3 1 6 MET ME 0.000 . 5.650 2.600 1.832 4.225 . 0 0 "[ . 1 . 2 .]" 1
32 1 4 GLY HA2 1 6 MET ME 0.000 . 5.650 3.774 2.834 4.782 . 0 0 "[ . 1 . 2 .]" 1
33 1 5 SER HA 1 6 MET H 0.000 . 3.280 3.021 2.141 3.519 0.239 19 0 "[ . 1 . 2 .]" 1
34 1 5 SER HA 1 78 TYR QD 0.000 . 5.100 4.428 3.848 5.174 0.074 25 0 "[ . 1 . 2 .]" 1
35 1 5 SER HA 1 80 LEU HA 0.000 . 2.970 1.935 1.387 2.461 0.413 9 0 "[ . 1 . 2 .]" 1
36 1 5 SER HA 1 80 LEU MD2 0.000 . 3.500 2.996 2.131 3.534 0.034 3 0 "[ . 1 . 2 .]" 1
37 1 5 SER HA 1 81 THR H 0.000 . 4.480 2.407 1.799 2.934 0.001 7 0 "[ . 1 . 2 .]" 1
38 1 5 SER HB2 1 78 TYR QD 0.000 . 3.860 2.997 2.212 3.980 0.120 2 0 "[ . 1 . 2 .]" 1
39 1 5 SER HB3 1 78 TYR QD 0.000 . 3.860 3.110 2.299 3.884 0.024 18 0 "[ . 1 . 2 .]" 1
40 1 5 SER HB3 1 80 LEU MD2 0.000 . 4.380 1.944 1.705 2.328 0.095 11 0 "[ . 1 . 2 .]" 1
41 1 5 SER HB2 1 80 LEU MD2 0.000 . 4.380 2.865 1.890 3.544 . 0 0 "[ . 1 . 2 .]" 1
42 1 5 SER QB 1 79 TRP HB2 0.000 . 5.500 4.824 4.621 5.019 . 0 0 "[ . 1 . 2 .]" 1
43 1 5 SER QB 1 79 TRP HB3 0.000 . 5.230 5.324 5.254 5.453 0.223 9 0 "[ . 1 . 2 .]" 1
44 1 5 SER QB 1 80 LEU HG 0.000 . 4.290 3.642 3.275 4.006 . 0 0 "[ . 1 . 2 .]" 1
45 1 6 MET H 1 78 TYR HB2 0.000 . 5.500 3.169 2.720 3.875 . 0 0 "[ . 1 . 2 .]" 1
46 1 6 MET H 1 78 TYR QD 0.000 . 5.500 4.153 3.214 5.253 . 0 0 "[ . 1 . 2 .]" 1
47 1 6 MET H 1 79 TRP H 0.000 . 4.290 3.902 2.548 4.375 0.085 13 0 "[ . 1 . 2 .]" 1
48 1 6 MET HB2 1 8 SER H 0.000 . 4.850 3.801 2.854 4.823 . 0 0 "[ . 1 . 2 .]" 1
49 1 6 MET HB2 1 81 THR MG 0.000 . 4.040 3.644 2.821 4.092 0.052 25 0 "[ . 1 . 2 .]" 1
50 1 6 MET HB2 1 104 ALA MB 0.000 . 4.870 4.890 4.304 5.027 0.157 20 0 "[ . 1 . 2 .]" 1
51 1 6 MET HB3 1 7 ASP H 0.000 . 5.100 3.096 2.623 3.465 . 0 0 "[ . 1 . 2 .]" 1
52 1 6 MET HB3 1 8 SER H 0.000 . 3.800 2.922 2.239 3.619 . 0 0 "[ . 1 . 2 .]" 1
53 1 6 MET HB3 1 81 THR MG 0.000 . 5.500 5.061 4.163 5.563 0.063 25 0 "[ . 1 . 2 .]" 1
54 1 6 MET QG 1 10 PRO QD 0.000 . 5.500 3.888 3.009 5.417 . 0 0 "[ . 1 . 2 .]" 1
55 1 6 MET QG 1 81 THR MG 0.000 . 4.840 4.308 2.649 4.815 . 0 0 "[ . 1 . 2 .]" 1
56 1 6 MET ME 1 10 PRO HG2 0.000 . 4.190 3.660 2.647 4.328 0.138 15 0 "[ . 1 . 2 .]" 1
57 1 6 MET ME 1 10 PRO HG3 0.000 . 4.190 3.027 1.968 4.209 0.019 14 0 "[ . 1 . 2 .]" 1
58 1 6 MET ME 1 10 PRO HD2 0.000 . 5.650 3.733 2.694 5.022 . 0 0 "[ . 1 . 2 .]" 1
59 1 6 MET ME 1 10 PRO HD3 0.000 . 5.650 3.576 2.636 4.705 . 0 0 "[ . 1 . 2 .]" 1
60 1 6 MET ME 1 10 PRO QD 0.000 . 4.380 3.198 2.414 4.317 . 0 0 "[ . 1 . 2 .]" 1
61 1 6 MET ME 1 13 TYR QE 0.000 . 4.830 4.056 3.170 4.881 0.051 15 0 "[ . 1 . 2 .]" 1
62 1 6 MET ME 1 81 THR HA 0.000 . 5.650 4.647 4.167 5.208 . 0 0 "[ . 1 . 2 .]" 1
63 1 6 MET ME 1 81 THR MG 0.000 . 5.650 1.967 1.464 2.598 0.336 25 0 "[ . 1 . 2 .]" 1
64 1 6 MET ME 1 104 ALA MB 0.000 . 5.800 4.041 3.347 4.727 . 0 0 "[ . 1 . 2 .]" 1
65 1 7 ASP H 1 8 SER H 0.000 . 3.980 2.651 2.534 2.852 . 0 0 "[ . 1 . 2 .]" 1
66 1 7 ASP HA 1 78 TYR H 0.000 . 4.290 4.356 4.274 4.416 0.126 6 0 "[ . 1 . 2 .]" 1
67 1 7 ASP HA 1 78 TYR HA 0.000 . 2.650 1.724 1.560 2.193 0.240 20 0 "[ . 1 . 2 .]" 1
68 1 7 ASP HA 1 78 TYR HB2 0.000 . 3.860 2.783 2.353 3.414 . 0 0 "[ . 1 . 2 .]" 1
69 1 7 ASP HA 1 78 TYR QD 0.000 . 5.500 4.312 3.906 4.750 . 0 0 "[ . 1 . 2 .]" 1
70 1 7 ASP QB 1 8 SER QB 0.000 . 5.500 4.038 3.390 4.800 . 0 0 "[ . 1 . 2 .]" 1
71 1 7 ASP QB 1 78 TYR HA 0.000 . 5.280 3.256 2.150 4.260 . 0 0 "[ . 1 . 2 .]" 1
72 1 7 ASP QB 1 78 TYR HB2 0.000 . 4.140 3.952 3.176 4.206 0.066 17 0 "[ . 1 . 2 .]" 1
73 1 8 SER HA 1 9 PRO HG2 0.000 . 5.500 4.421 4.095 4.622 . 0 0 "[ . 1 . 2 .]" 1
74 1 8 SER HA 1 9 PRO HG3 0.000 . 5.500 4.454 4.395 4.563 . 0 0 "[ . 1 . 2 .]" 1
75 1 8 SER HA 1 9 PRO QG 0.000 . 4.300 3.951 3.771 4.091 . 0 0 "[ . 1 . 2 .]" 1
76 1 8 SER HA 1 9 PRO HD2 0.000 . 2.590 2.279 1.909 2.551 . 0 0 "[ . 1 . 2 .]" 1
77 1 8 SER HA 1 9 PRO HD3 0.000 . 2.590 2.351 2.229 2.594 0.004 1 0 "[ . 1 . 2 .]" 1
78 1 8 SER HA 1 79 TRP HD1 0.000 . 3.730 3.679 3.135 3.844 0.114 20 0 "[ . 1 . 2 .]" 1
79 1 8 SER HA 1 79 TRP HE1 0.000 . 5.030 4.060 3.183 4.719 . 0 0 "[ . 1 . 2 .]" 1
80 1 8 SER QB 1 9 PRO QD 0.000 . 4.350 2.884 2.037 3.539 . 0 0 "[ . 1 . 2 .]" 1
81 1 8 SER QB 1 79 TRP HD1 0.000 . 5.500 5.329 4.752 5.555 0.055 7 0 "[ . 1 . 2 .]" 1
82 1 9 PRO HA 1 10 PRO QG 0.000 . 3.450 3.624 3.581 3.700 0.250 3 0 "[ . 1 . 2 .]" 1
83 1 9 PRO HA 1 10 PRO HD2 0.000 . 2.740 1.932 1.721 2.743 0.079 12 0 "[ . 1 . 2 .]" 1
84 1 9 PRO HA 1 10 PRO HD3 0.000 . 2.740 2.575 1.755 2.804 0.064 6 0 "[ . 1 . 2 .]" 1
85 1 9 PRO HA 1 104 ALA MB 0.000 . 4.750 3.077 2.475 4.107 . 0 0 "[ . 1 . 2 .]" 1
86 1 9 PRO HB2 1 10 PRO QD 0.000 . 3.670 3.747 3.422 3.839 0.169 20 0 "[ . 1 . 2 .]" 1
87 1 9 PRO HB2 1 15 ARG QG 0.000 . 5.500 5.186 4.618 5.548 0.048 15 0 "[ . 1 . 2 .]" 1
88 1 9 PRO QG 1 15 ARG QG 0.000 . 5.490 4.568 3.641 5.522 0.032 13 0 "[ . 1 . 2 .]" 1
89 1 9 PRO QG 1 15 ARG QD 0.000 . 5.500 2.983 1.831 4.453 . 0 0 "[ . 1 . 2 .]" 1
90 1 9 PRO QG 1 79 TRP HZ2 0.000 . 5.500 4.401 3.056 5.402 . 0 0 "[ . 1 . 2 .]" 1
91 1 9 PRO HD2 1 79 TRP HD1 0.000 . 5.500 5.010 4.164 5.512 0.012 4 0 "[ . 1 . 2 .]" 1
92 1 9 PRO HD2 1 79 TRP HE1 0.000 . 5.500 4.598 3.335 5.454 . 0 0 "[ . 1 . 2 .]" 1
93 1 9 PRO HD3 1 79 TRP HD1 0.000 . 5.500 3.599 2.484 4.178 . 0 0 "[ . 1 . 2 .]" 1
94 1 9 PRO HD3 1 79 TRP HE1 0.000 . 5.500 3.244 2.434 4.033 . 0 0 "[ . 1 . 2 .]" 1
95 1 10 PRO HA 1 11 GLU H 0.000 . 2.460 2.391 2.282 2.624 0.164 8 0 "[ . 1 . 2 .]" 1
96 1 10 PRO HA 1 11 GLU QB 0.000 . 4.720 4.581 4.161 4.766 0.046 17 0 "[ . 1 . 2 .]" 1
97 1 10 PRO HA 1 13 TYR QD 0.000 . 5.500 4.335 4.008 4.652 . 0 0 "[ . 1 . 2 .]" 1
98 1 10 PRO HB2 1 11 GLU H 0.000 . 2.740 2.705 2.000 2.875 0.135 5 0 "[ . 1 . 2 .]" 1
99 1 10 PRO HB2 1 13 TYR QD 0.000 . 4.350 2.460 1.988 3.135 . 0 0 "[ . 1 . 2 .]" 1
100 1 10 PRO HB3 1 11 GLU H 0.000 . 3.330 3.143 2.851 3.298 . 0 0 "[ . 1 . 2 .]" 1
101 1 10 PRO HB3 1 13 TYR QD 0.000 . 4.010 4.063 3.587 4.262 0.252 5 0 "[ . 1 . 2 .]" 1
102 1 10 PRO HG2 1 13 TYR QD 0.000 . 5.500 2.699 1.764 3.231 0.036 5 0 "[ . 1 . 2 .]" 1
103 1 10 PRO HG3 1 13 TYR QD 0.000 . 5.500 4.039 3.499 4.456 . 0 0 "[ . 1 . 2 .]" 1
104 1 10 PRO QG 1 81 THR MG 0.000 . 5.500 2.905 1.821 4.012 . 0 0 "[ . 1 . 2 .]" 1
105 1 10 PRO HD2 1 13 TYR QD 0.000 . 5.500 3.817 1.944 4.863 . 0 0 "[ . 1 . 2 .]" 1
106 1 10 PRO HD2 1 81 THR MG 0.000 . 5.500 3.008 1.951 3.504 . 0 0 "[ . 1 . 2 .]" 1
107 1 10 PRO HD2 1 104 ALA MB 0.000 . 5.650 3.096 2.377 4.228 . 0 0 "[ . 1 . 2 .]" 1
108 1 10 PRO HD3 1 13 TYR QD 0.000 . 5.500 4.767 3.648 5.368 . 0 0 "[ . 1 . 2 .]" 1
109 1 10 PRO HD3 1 81 THR MG 0.000 . 5.500 3.765 2.767 4.818 . 0 0 "[ . 1 . 2 .]" 1
110 1 10 PRO HD3 1 104 ALA MB 0.000 . 5.650 4.245 2.847 5.538 . 0 0 "[ . 1 . 2 .]" 1
111 1 11 GLU H 1 12 GLY H 0.000 . 4.790 4.551 4.397 4.645 . 0 0 "[ . 1 . 2 .]" 1
112 1 11 GLU HA 1 12 GLY H 0.000 . 2.750 2.283 2.086 2.985 0.235 20 0 "[ . 1 . 2 .]" 1
113 1 11 GLU QB 1 12 GLY H 0.000 . 3.140 2.883 1.550 3.343 0.250 20 0 "[ . 1 . 2 .]" 1
114 1 11 GLU QB 1 12 GLY HA3 0.000 . 5.160 3.938 3.609 4.126 . 0 0 "[ . 1 . 2 .]" 1
115 1 11 GLU QB 1 12 GLY HA2 0.000 . 5.160 4.568 4.067 4.817 . 0 0 "[ . 1 . 2 .]" 1
116 1 12 GLY H 1 13 TYR H 0.000 . 3.640 3.333 2.708 3.964 0.324 17 0 "[ . 1 . 2 .]" 1
117 1 12 GLY QA 1 13 TYR H 0.000 . 3.520 2.391 2.149 2.947 . 0 0 "[ . 1 . 2 .]" 1
118 1 12 GLY QA 1 100 TRP HA 0.000 . 4.140 2.420 1.441 4.219 0.359 23 0 "[ . 1 . 2 .]" 1
119 1 12 GLY QA 1 101 LYS QE 0.000 . 5.340 4.618 2.945 5.445 0.105 2 0 "[ . 1 . 2 .]" 1
120 1 13 TYR H 1 100 TRP HA 0.000 . 4.540 3.835 1.576 4.621 0.224 20 0 "[ . 1 . 2 .]" 1
121 1 13 TYR H 1 100 TRP HZ3 0.000 . 5.500 4.652 2.576 5.620 0.120 6 0 "[ . 1 . 2 .]" 1
122 1 13 TYR H 1 104 ALA MB 0.000 . 5.650 5.151 4.167 5.649 . 0 0 "[ . 1 . 2 .]" 1
123 1 13 TYR HA 1 14 ARG H 0.000 . 2.930 2.278 2.146 2.682 . 0 0 "[ . 1 . 2 .]" 1
124 1 13 TYR HA 1 100 TRP HE3 0.000 . 5.500 3.700 2.556 5.633 0.133 2 0 "[ . 1 . 2 .]" 1
125 1 13 TYR HA 1 104 ALA MB 0.000 . 5.650 4.441 4.013 4.934 . 0 0 "[ . 1 . 2 .]" 1
126 1 13 TYR HB2 1 104 ALA MB 0.000 . 4.900 3.144 2.210 3.966 . 0 0 "[ . 1 . 2 .]" 1
127 1 13 TYR HB3 1 104 ALA H 0.000 . 5.500 2.607 1.855 3.906 . 0 0 "[ . 1 . 2 .]" 1
128 1 13 TYR HB3 1 104 ALA MB 0.000 . 4.220 2.145 1.787 2.711 0.013 16 0 "[ . 1 . 2 .]" 1
129 1 13 TYR QD 1 81 THR HB 0.000 . 4.630 2.855 2.190 4.142 . 0 0 "[ . 1 . 2 .]" 1
130 1 13 TYR QD 1 101 LYS HB2 0.000 . 5.500 5.106 3.363 5.578 0.078 6 0 "[ . 1 . 2 .]" 1
131 1 13 TYR QD 1 101 LYS HB3 0.000 . 5.500 4.499 3.230 5.638 0.138 19 0 "[ . 1 . 2 .]" 1
132 1 13 TYR QD 1 101 LYS QG 0.000 . 5.500 4.542 2.631 5.511 0.011 24 0 "[ . 1 . 2 .]" 1
133 1 13 TYR QD 1 102 GLY H 0.000 . 5.500 4.265 2.751 5.316 . 0 0 "[ . 1 . 2 .]" 1
134 1 13 TYR QD 1 102 GLY HA3 0.000 . 5.500 2.952 2.341 3.561 . 0 0 "[ . 1 . 2 .]" 1
135 1 13 TYR QD 1 102 GLY HA2 0.000 . 5.500 4.251 3.793 5.027 . 0 0 "[ . 1 . 2 .]" 1
136 1 13 TYR QD 1 103 GLN H 0.000 . 4.720 2.710 2.124 3.485 . 0 0 "[ . 1 . 2 .]" 1
137 1 13 TYR QD 1 103 GLN HA 0.000 . 5.500 3.227 2.456 4.556 . 0 0 "[ . 1 . 2 .]" 1
138 1 13 TYR QD 1 104 ALA MB 0.000 . 4.500 3.286 2.843 3.824 . 0 0 "[ . 1 . 2 .]" 1
139 1 13 TYR QE 1 81 THR HA 0.000 . 5.490 4.809 3.919 5.535 0.045 5 0 "[ . 1 . 2 .]" 1
140 1 13 TYR QE 1 81 THR MG 0.000 . 3.780 3.416 2.843 3.779 . 0 0 "[ . 1 . 2 .]" 1
141 1 13 TYR QE 1 82 TYR H 0.000 . 5.490 4.132 2.509 5.526 0.036 1 0 "[ . 1 . 2 .]" 1
142 1 13 TYR QE 1 83 ASP HA 0.000 . 3.970 3.728 2.913 3.986 0.016 15 0 "[ . 1 . 2 .]" 1
143 1 13 TYR QE 1 101 LYS QE 0.000 . 4.870 3.800 1.981 4.840 . 0 0 "[ . 1 . 2 .]" 1
144 1 14 ARG H 1 15 ARG H 0.000 . 5.130 4.202 3.765 4.658 . 0 0 "[ . 1 . 2 .]" 1
145 1 14 ARG H 1 102 GLY H 0.000 . 4.230 4.191 3.806 4.470 0.240 14 0 "[ . 1 . 2 .]" 1
146 1 14 ARG H 1 103 GLN HA 0.000 . 4.110 2.314 1.690 3.747 0.110 11 0 "[ . 1 . 2 .]" 1
147 1 14 ARG HA 1 15 ARG H 0.000 . 2.800 2.472 2.147 2.930 0.130 21 0 "[ . 1 . 2 .]" 1
148 1 14 ARG HA 1 100 TRP HZ3 0.000 . 5.500 2.472 1.423 5.128 0.377 15 0 "[ . 1 . 2 .]" 1
149 1 14 ARG HA 1 103 GLN QG 0.000 . 4.380 4.354 4.159 4.566 0.186 15 0 "[ . 1 . 2 .]" 1
150 1 14 ARG HB2 1 103 GLN HA 0.000 . 5.500 2.908 1.802 4.752 . 0 0 "[ . 1 . 2 .]" 1
151 1 14 ARG HB3 1 15 ARG H 0.000 . 4.350 3.688 2.145 4.424 0.074 12 0 "[ . 1 . 2 .]" 1
152 1 14 ARG HB3 1 100 TRP HH2 0.000 . 5.500 5.370 3.982 5.663 0.163 4 0 "[ . 1 . 2 .]" 1
153 1 14 ARG HB3 1 103 GLN HA 0.000 . 3.800 2.480 1.890 3.564 . 0 0 "[ . 1 . 2 .]" 1
154 1 14 ARG HB3 1 103 GLN QG 0.000 . 4.140 2.147 1.591 2.915 0.209 10 0 "[ . 1 . 2 .]" 1
155 1 14 ARG QG 1 15 ARG H 0.000 . 5.500 3.105 1.345 4.009 0.455 7 0 "[ . 1 . 2 .]" 1
156 1 14 ARG QG 1 100 TRP HH2 0.000 . 5.190 3.332 2.276 4.555 . 0 0 "[ . 1 . 2 .]" 1
157 1 14 ARG QG 1 103 GLN HA 0.000 . 4.970 4.226 3.460 4.983 0.013 12 0 "[ . 1 . 2 .]" 1
158 1 14 ARG QD 1 100 TRP HH2 0.000 . 5.500 3.818 1.826 5.571 0.071 19 0 "[ . 1 . 2 .]" 1
159 1 15 ARG HA 1 16 ASN H 0.000 . 2.960 2.153 2.098 2.270 . 0 0 "[ . 1 . 2 .]" 1
160 1 15 ARG HA 1 47 ILE MD 0.000 . 5.030 3.669 3.112 4.377 . 0 0 "[ . 1 . 2 .]" 1
161 1 15 ARG HA 1 79 TRP HE3 0.000 . 4.350 3.847 3.213 4.364 0.014 16 0 "[ . 1 . 2 .]" 1
162 1 15 ARG HA 1 104 ALA MB 0.000 . 4.560 2.940 2.185 3.559 . 0 0 "[ . 1 . 2 .]" 1
163 1 15 ARG HA 1 105 GLN HA 0.000 . 4.170 4.172 3.551 4.386 0.216 20 0 "[ . 1 . 2 .]" 1
164 1 15 ARG QB 1 47 ILE MG 0.000 . 5.000 4.192 3.744 4.751 . 0 0 "[ . 1 . 2 .]" 1
165 1 15 ARG QB 1 47 ILE MD 0.000 . 4.040 3.179 2.265 3.707 . 0 0 "[ . 1 . 2 .]" 1
166 1 15 ARG HG2 1 79 TRP HE3 0.000 . 5.500 5.479 4.947 5.671 0.171 23 0 "[ . 1 . 2 .]" 1
167 1 15 ARG HG3 1 79 TRP HE3 0.000 . 5.500 3.966 3.452 5.234 . 0 0 "[ . 1 . 2 .]" 1
168 1 15 ARG QG 1 16 ASN H 0.000 . 4.910 3.324 2.944 4.380 . 0 0 "[ . 1 . 2 .]" 1
169 1 15 ARG QG 1 47 ILE HB 0.000 . 3.240 2.629 2.100 3.289 0.049 18 0 "[ . 1 . 2 .]" 1
170 1 15 ARG QG 1 47 ILE MG 0.000 . 3.200 3.228 3.114 3.297 0.097 12 0 "[ . 1 . 2 .]" 1
171 1 15 ARG QD 1 47 ILE HB 0.000 . 5.500 4.590 3.861 5.320 . 0 0 "[ . 1 . 2 .]" 1
172 1 15 ARG QD 1 47 ILE MG 0.000 . 5.460 4.500 3.953 4.958 . 0 0 "[ . 1 . 2 .]" 1
173 1 15 ARG QD 1 47 ILE MD 0.000 . 4.840 3.305 2.610 4.048 . 0 0 "[ . 1 . 2 .]" 1
174 1 15 ARG QD 1 79 TRP HZ2 0.000 . 5.500 3.786 2.632 5.450 . 0 0 "[ . 1 . 2 .]" 1
175 1 15 ARG QD 1 79 TRP HH2 0.000 . 4.320 3.068 2.022 4.414 0.094 23 0 "[ . 1 . 2 .]" 1
176 1 15 ARG QD 1 104 ALA MB 0.000 . 4.090 3.968 3.677 4.213 0.123 23 0 "[ . 1 . 2 .]" 1
177 1 16 ASN H 1 47 ILE MD 0.000 . 5.500 3.309 2.671 4.174 . 0 0 "[ . 1 . 2 .]" 1
178 1 16 ASN H 1 106 LYS H 0.000 . 5.500 4.002 3.569 4.544 . 0 0 "[ . 1 . 2 .]" 1
179 1 16 ASN HA 1 17 VAL H 0.000 . 2.800 2.557 2.476 2.642 . 0 0 "[ . 1 . 2 .]" 1
180 1 16 ASN HA 1 17 VAL MG2 0.000 . 4.690 4.016 3.648 4.344 . 0 0 "[ . 1 . 2 .]" 1
181 1 16 ASN HA 1 46 GLY H 0.000 . 4.540 4.534 4.359 4.655 0.115 10 0 "[ . 1 . 2 .]" 1
182 1 16 ASN HA 1 46 GLY HA3 0.000 . 3.050 3.170 3.070 3.273 0.223 3 0 "[ . 1 . 2 .]" 1
183 1 16 ASN HA 1 46 GLY HA2 0.000 . 3.050 1.695 1.572 1.842 0.228 13 0 "[ . 1 . 2 .]" 1
184 1 16 ASN HA 1 47 ILE H 0.000 . 3.670 2.177 1.524 3.666 0.276 7 0 "[ . 1 . 2 .]" 1
185 1 16 ASN HA 1 47 ILE HB 0.000 . 4.410 3.902 3.387 4.191 . 0 0 "[ . 1 . 2 .]" 1
186 1 16 ASN HA 1 47 ILE MG 0.000 . 5.500 4.904 4.544 5.190 . 0 0 "[ . 1 . 2 .]" 1
187 1 16 ASN HA 1 47 ILE MD 0.000 . 4.380 3.092 2.244 4.066 . 0 0 "[ . 1 . 2 .]" 1
188 1 16 ASN HB2 1 17 VAL H 0.000 . 3.610 3.414 2.246 3.697 0.087 4 0 "[ . 1 . 2 .]" 1
189 1 16 ASN HB3 1 17 VAL H 0.000 . 3.610 2.343 2.061 3.682 0.072 13 0 "[ . 1 . 2 .]" 1
190 1 16 ASN QB 1 17 VAL MG2 0.000 . 5.500 4.210 3.824 4.985 . 0 0 "[ . 1 . 2 .]" 1
191 1 16 ASN QB 1 47 ILE MD 0.000 . 5.500 4.394 3.808 5.133 . 0 0 "[ . 1 . 2 .]" 1
192 1 16 ASN QB 1 105 GLN HA 0.000 . 4.940 3.175 2.505 3.985 . 0 0 "[ . 1 . 2 .]" 1
193 1 16 ASN QB 1 105 GLN QB 0.000 . 3.550 2.890 1.722 3.672 0.122 2 0 "[ . 1 . 2 .]" 1
194 1 16 ASN QD 1 17 VAL H 0.000 . 5.340 4.388 2.430 4.970 . 0 0 "[ . 1 . 2 .]" 1
195 1 16 ASN QD 1 46 GLY QA 0.000 . 5.500 2.859 1.708 4.107 0.092 5 0 "[ . 1 . 2 .]" 1
196 1 16 ASN QD 1 47 ILE MD 0.000 . 5.340 5.134 4.337 5.479 0.139 18 0 "[ . 1 . 2 .]" 1
197 1 16 ASN QD 1 103 GLN QB 0.000 . 5.340 4.053 1.799 5.389 0.049 3 0 "[ . 1 . 2 .]" 1
198 1 16 ASN QD 1 105 GLN QB 0.000 . 5.330 4.609 2.191 5.484 0.154 10 0 "[ . 1 . 2 .]" 1
199 1 17 VAL H 1 44 GLN QB 0.000 . 5.500 4.685 3.987 5.594 0.094 20 0 "[ . 1 . 2 .]" 1
200 1 17 VAL H 1 45 GLY H 0.000 . 3.670 3.049 2.724 3.321 . 0 0 "[ . 1 . 2 .]" 1
201 1 17 VAL H 1 46 GLY HA3 0.000 . 5.030 4.350 4.104 4.598 . 0 0 "[ . 1 . 2 .]" 1
202 1 17 VAL H 1 46 GLY HA2 0.000 . 5.030 2.706 2.426 3.014 . 0 0 "[ . 1 . 2 .]" 1
203 1 17 VAL H 1 47 ILE H 0.000 . 4.910 3.845 3.417 5.018 0.108 9 0 "[ . 1 . 2 .]" 1
204 1 17 VAL H 1 47 ILE MD 0.000 . 5.500 4.100 3.539 4.643 . 0 0 "[ . 1 . 2 .]" 1
205 1 17 VAL H 1 56 ALA MB 0.000 . 5.550 4.405 4.188 4.660 . 0 0 "[ . 1 . 2 .]" 1
206 1 17 VAL HA 1 18 GLY H 0.000 . 2.710 2.384 2.303 2.464 . 0 0 "[ . 1 . 2 .]" 1
207 1 17 VAL HA 1 106 LYS H 0.000 . 3.860 2.382 2.100 2.767 . 0 0 "[ . 1 . 2 .]" 1
208 1 17 VAL HB 1 18 GLY H 0.000 . 3.330 2.308 2.210 2.476 . 0 0 "[ . 1 . 2 .]" 1
209 1 17 VAL HB 1 56 ALA MB 0.000 . 3.970 3.998 3.865 4.070 0.100 6 0 "[ . 1 . 2 .]" 1
210 1 17 VAL HB 1 57 ALA MB 0.000 . 3.350 2.619 2.280 3.032 . 0 0 "[ . 1 . 2 .]" 1
211 1 17 VAL MG1 1 18 GLY H 0.000 . 3.730 3.686 3.517 3.807 0.077 6 0 "[ . 1 . 2 .]" 1
212 1 17 VAL MG1 1 45 GLY H 0.000 . 4.820 4.886 4.693 4.997 0.177 12 0 "[ . 1 . 2 .]" 1
213 1 17 VAL MG1 1 47 ILE MD 0.000 . 3.450 1.854 1.645 2.120 0.155 2 0 "[ . 1 . 2 .]" 1
214 1 17 VAL MG1 1 53 PRO HA 0.000 . 3.390 1.892 1.772 2.086 0.028 2 0 "[ . 1 . 2 .]" 1
215 1 17 VAL MG1 1 55 ASN H 0.000 . 5.500 5.271 4.976 5.502 0.002 8 0 "[ . 1 . 2 .]" 1
216 1 17 VAL MG1 1 56 ALA H 0.000 . 4.290 4.051 3.761 4.210 . 0 0 "[ . 1 . 2 .]" 1
217 1 17 VAL MG1 1 56 ALA HA 0.000 . 5.500 4.963 4.647 5.187 . 0 0 "[ . 1 . 2 .]" 1
218 1 17 VAL MG1 1 56 ALA MB 0.000 . 3.350 2.242 1.944 2.574 . 0 0 "[ . 1 . 2 .]" 1
219 1 17 VAL MG1 1 57 ALA H 0.000 . 4.010 3.309 3.040 3.500 . 0 0 "[ . 1 . 2 .]" 1
220 1 17 VAL MG1 1 57 ALA HA 0.000 . 4.070 4.220 4.131 4.287 0.217 4 0 "[ . 1 . 2 .]" 1
221 1 17 VAL MG1 1 60 GLU QG 0.000 . 5.500 4.917 4.570 5.459 . 0 0 "[ . 1 . 2 .]" 1
222 1 17 VAL MG1 1 106 LYS H 0.000 . 5.500 3.081 2.836 3.503 . 0 0 "[ . 1 . 2 .]" 1
223 1 17 VAL MG1 1 106 LYS HB2 0.000 . 5.500 3.881 3.440 4.380 . 0 0 "[ . 1 . 2 .]" 1
224 1 17 VAL MG1 1 108 PHE QE 0.000 . 3.770 2.540 1.979 3.094 . 0 0 "[ . 1 . 2 .]" 1
225 1 17 VAL MG2 1 18 GLY H 0.000 . 3.390 3.244 2.868 3.419 0.029 12 0 "[ . 1 . 2 .]" 1
226 1 17 VAL MG2 1 19 ILE MD 0.000 . 3.730 2.929 2.702 3.421 . 0 0 "[ . 1 . 2 .]" 1
227 1 17 VAL MG2 1 45 GLY H 0.000 . 4.440 2.589 2.295 2.862 . 0 0 "[ . 1 . 2 .]" 1
228 1 17 VAL MG2 1 53 PRO HA 0.000 . 5.130 3.498 3.371 3.647 . 0 0 "[ . 1 . 2 .]" 1
229 1 17 VAL MG2 1 56 ALA MB 0.000 . 4.250 1.949 1.830 2.130 . 0 0 "[ . 1 . 2 .]" 1
230 1 17 VAL MG2 1 57 ALA H 0.000 . 3.480 2.306 2.080 2.486 . 0 0 "[ . 1 . 2 .]" 1
231 1 17 VAL MG2 1 57 ALA HA 0.000 . 2.650 1.858 1.648 2.004 0.152 11 0 "[ . 1 . 2 .]" 1
232 1 17 VAL MG2 1 57 ALA MB 0.000 . 2.760 2.152 1.719 2.400 0.081 6 0 "[ . 1 . 2 .]" 1
233 1 17 VAL MG2 1 108 PHE QD 0.000 . 3.680 3.732 3.656 3.827 0.147 6 0 "[ . 1 . 2 .]" 1
234 1 17 VAL MG2 1 108 PHE QE 0.000 . 3.530 3.646 3.591 3.721 0.191 9 0 "[ . 1 . 2 .]" 1
235 1 18 GLY H 1 44 GLN QB 0.000 . 5.500 4.535 4.118 5.534 0.034 2 0 "[ . 1 . 2 .]" 1
236 1 18 GLY H 1 45 GLY H 0.000 . 4.910 4.675 4.509 4.851 . 0 0 "[ . 1 . 2 .]" 1
237 1 18 GLY H 1 57 ALA MB 0.000 . 5.650 3.450 3.219 3.666 . 0 0 "[ . 1 . 2 .]" 1
238 1 18 GLY H 1 106 LYS H 0.000 . 4.790 4.169 3.935 4.635 . 0 0 "[ . 1 . 2 .]" 1
239 1 18 GLY H 1 107 TRP HA 0.000 . 3.420 2.179 1.977 2.402 . 0 0 "[ . 1 . 2 .]" 1
240 1 18 GLY H 1 108 PHE H 0.000 . 4.480 3.955 3.685 4.211 . 0 0 "[ . 1 . 2 .]" 1
241 1 18 GLY HA3 1 19 ILE H 0.000 . 2.990 2.842 2.721 2.966 . 0 0 "[ . 1 . 2 .]" 1
242 1 18 GLY HA3 1 44 GLN HA 0.000 . 3.640 3.666 3.522 3.713 0.073 10 0 "[ . 1 . 2 .]" 1
243 1 18 GLY HA3 1 45 GLY H 0.000 . 5.130 4.634 4.406 4.781 . 0 0 "[ . 1 . 2 .]" 1
244 1 18 GLY HA2 1 19 ILE H 0.000 . 2.990 2.344 2.258 2.454 . 0 0 "[ . 1 . 2 .]" 1
245 1 18 GLY HA2 1 44 GLN HA 0.000 . 3.640 1.966 1.875 2.037 . 0 0 "[ . 1 . 2 .]" 1
246 1 18 GLY HA2 1 45 GLY H 0.000 . 5.130 3.143 2.946 3.344 . 0 0 "[ . 1 . 2 .]" 1
247 1 18 GLY QA 1 19 ILE MD 0.000 . 4.200 2.582 2.087 3.264 . 0 0 "[ . 1 . 2 .]" 1
248 1 18 GLY QA 1 44 GLN QB 0.000 . 5.490 2.142 1.870 2.971 . 0 0 "[ . 1 . 2 .]" 1
249 1 18 GLY QA 1 44 GLN QG 0.000 . 5.500 3.401 1.688 4.096 0.112 2 0 "[ . 1 . 2 .]" 1
250 1 19 ILE H 1 43 PRO QB 0.000 . 5.500 3.616 3.012 3.929 . 0 0 "[ . 1 . 2 .]" 1
251 1 19 ILE H 1 44 GLN HA 0.000 . 3.730 2.929 2.685 3.296 . 0 0 "[ . 1 . 2 .]" 1
252 1 19 ILE H 1 44 GLN HB2 0.000 . 5.500 3.970 2.814 4.461 . 0 0 "[ . 1 . 2 .]" 1
253 1 19 ILE H 1 44 GLN HB3 0.000 . 5.500 3.352 2.523 5.076 . 0 0 "[ . 1 . 2 .]" 1
254 1 19 ILE H 1 107 TRP HZ3 0.000 . 4.820 2.790 2.212 3.557 . 0 0 "[ . 1 . 2 .]" 1
255 1 19 ILE H 1 107 TRP HH2 0.000 . 5.470 3.759 3.300 4.366 . 0 0 "[ . 1 . 2 .]" 1
256 1 19 ILE HA 1 20 CYS H 0.000 . 2.650 2.114 2.082 2.141 . 0 0 "[ . 1 . 2 .]" 1
257 1 19 ILE HA 1 108 PHE H 0.000 . 4.200 2.772 2.418 3.089 . 0 0 "[ . 1 . 2 .]" 1
258 1 19 ILE HA 1 108 PHE QB 0.000 . 5.000 3.091 2.880 3.570 . 0 0 "[ . 1 . 2 .]" 1
259 1 19 ILE HA 1 110 PHE QD 0.000 . 5.480 3.683 3.227 4.684 . 0 0 "[ . 1 . 2 .]" 1
260 1 19 ILE MG 1 20 CYS H 0.000 . 3.300 2.835 2.496 3.366 0.066 21 0 "[ . 1 . 2 .]" 1
261 1 19 ILE MG 1 21 LEU MD1 0.000 . 5.060 4.099 3.476 5.105 0.045 10 0 "[ . 1 . 2 .]" 1
262 1 19 ILE MG 1 57 ALA MB 0.000 . 5.650 2.863 1.728 3.734 0.072 21 0 "[ . 1 . 2 .]" 1
263 1 19 ILE MG 1 61 LEU HA 0.000 . 5.060 4.452 3.844 4.895 . 0 0 "[ . 1 . 2 .]" 1
264 1 19 ILE MG 1 109 LEU HA 0.000 . 5.400 4.593 4.067 5.173 . 0 0 "[ . 1 . 2 .]" 1
265 1 19 ILE MG 1 110 PHE HB2 0.000 . 5.470 3.213 2.432 4.373 . 0 0 "[ . 1 . 2 .]" 1
266 1 19 ILE MG 1 110 PHE QD 0.000 . 3.370 2.306 1.880 3.158 . 0 0 "[ . 1 . 2 .]" 1
267 1 19 ILE QG 1 20 CYS H 0.000 . 4.760 4.361 4.098 4.627 . 0 0 "[ . 1 . 2 .]" 1
268 1 19 ILE QG 1 43 PRO QB 0.000 . 5.340 2.929 1.742 3.617 0.058 20 0 "[ . 1 . 2 .]" 1
269 1 19 ILE QG 1 60 GLU H 0.000 . 5.500 5.341 4.876 5.674 0.174 19 0 "[ . 1 . 2 .]" 1
270 1 19 ILE QG 1 61 LEU H 0.000 . 4.910 3.359 2.883 3.832 . 0 0 "[ . 1 . 2 .]" 1
271 1 19 ILE MD 1 20 CYS H 0.000 . 5.500 5.049 4.850 5.302 . 0 0 "[ . 1 . 2 .]" 1
272 1 19 ILE MD 1 43 PRO HB2 0.000 . 5.500 2.238 1.724 3.027 0.076 15 0 "[ . 1 . 2 .]" 1
273 1 19 ILE MD 1 43 PRO HB3 0.000 . 5.500 3.441 2.602 4.411 . 0 0 "[ . 1 . 2 .]" 1
274 1 19 ILE MD 1 43 PRO QG 0.000 . 3.880 3.545 2.967 3.924 0.044 14 0 "[ . 1 . 2 .]" 1
275 1 19 ILE MD 1 43 PRO QD 0.000 . 5.500 4.726 4.210 5.231 . 0 0 "[ . 1 . 2 .]" 1
276 1 19 ILE MD 1 44 GLN HA 0.000 . 4.010 1.929 1.479 2.397 0.321 11 0 "[ . 1 . 2 .]" 1
277 1 19 ILE MD 1 45 GLY H 0.000 . 5.500 3.328 2.911 3.770 . 0 0 "[ . 1 . 2 .]" 1
278 1 19 ILE MD 1 57 ALA HA 0.000 . 3.170 2.125 1.898 2.459 . 0 0 "[ . 1 . 2 .]" 1
279 1 19 ILE MD 1 57 ALA MB 0.000 . 3.350 2.765 2.012 3.104 . 0 0 "[ . 1 . 2 .]" 1
280 1 19 ILE MD 1 60 GLU H 0.000 . 5.250 4.225 3.890 4.438 . 0 0 "[ . 1 . 2 .]" 1
281 1 19 ILE MD 1 60 GLU HA 0.000 . 4.780 4.750 4.469 4.910 0.130 12 0 "[ . 1 . 2 .]" 1
282 1 19 ILE MD 1 60 GLU HB2 0.000 . 4.780 2.813 2.384 3.907 . 0 0 "[ . 1 . 2 .]" 1
283 1 19 ILE MD 1 60 GLU HB3 0.000 . 4.780 3.228 2.788 4.356 . 0 0 "[ . 1 . 2 .]" 1
284 1 19 ILE MD 1 60 GLU HG2 0.000 . 5.500 4.411 2.099 5.016 . 0 0 "[ . 1 . 2 .]" 1
285 1 19 ILE MD 1 60 GLU HG3 0.000 . 5.500 4.303 1.970 5.244 . 0 0 "[ . 1 . 2 .]" 1
286 1 19 ILE MD 1 61 LEU H 0.000 . 3.360 2.522 2.257 2.799 . 0 0 "[ . 1 . 2 .]" 1
287 1 19 ILE MD 1 61 LEU HA 0.000 . 3.510 2.695 2.143 3.423 . 0 0 "[ . 1 . 2 .]" 1
288 1 19 ILE MD 1 61 LEU MD1 0.000 . 3.260 3.175 2.513 3.403 0.143 18 0 "[ . 1 . 2 .]" 1
289 1 19 ILE MD 1 108 PHE QD 0.000 . 5.480 4.718 3.848 5.244 . 0 0 "[ . 1 . 2 .]" 1
290 1 19 ILE MD 1 110 PHE QE 0.000 . 5.480 4.669 3.786 5.419 . 0 0 "[ . 1 . 2 .]" 1
291 1 20 CYS H 1 21 LEU H 0.000 . 4.260 4.076 3.923 4.246 . 0 0 "[ . 1 . 2 .]" 1
292 1 20 CYS H 1 107 TRP HE3 0.000 . 5.500 3.140 2.813 3.578 . 0 0 "[ . 1 . 2 .]" 1
293 1 20 CYS H 1 108 PHE H 0.000 . 4.970 3.157 2.987 3.410 . 0 0 "[ . 1 . 2 .]" 1
294 1 20 CYS H 1 109 LEU HA 0.000 . 3.860 3.095 2.864 3.405 . 0 0 "[ . 1 . 2 .]" 1
295 1 20 CYS H 1 109 LEU MD1 0.000 . 4.070 4.005 3.809 4.152 0.082 12 0 "[ . 1 . 2 .]" 1
296 1 20 CYS H 1 110 PHE QD 0.000 . 5.480 3.294 2.618 4.696 . 0 0 "[ . 1 . 2 .]" 1
297 1 20 CYS HA 1 21 LEU H 0.000 . 3.110 2.158 2.124 2.207 . 0 0 "[ . 1 . 2 .]" 1
298 1 20 CYS HA 1 28 ILE MG 0.000 . 4.440 3.238 2.740 3.681 . 0 0 "[ . 1 . 2 .]" 1
299 1 20 CYS HA 1 42 MET ME 0.000 . 4.130 3.533 2.525 4.066 . 0 0 "[ . 1 . 2 .]" 1
300 1 20 CYS HB2 1 21 LEU H 0.000 . 4.850 4.496 4.338 4.629 . 0 0 "[ . 1 . 2 .]" 1
301 1 20 CYS HB2 1 109 LEU HA 0.000 . 5.440 3.752 3.116 3.989 . 0 0 "[ . 1 . 2 .]" 1
302 1 20 CYS HB2 1 109 LEU MD1 0.000 . 3.670 3.514 3.213 3.710 0.040 9 0 "[ . 1 . 2 .]" 1
303 1 20 CYS HB2 1 161 PHE QE 0.000 . 5.480 1.937 1.674 2.198 0.126 18 0 "[ . 1 . 2 .]" 1
304 1 20 CYS HB3 1 21 LEU H 0.000 . 4.850 4.338 4.065 4.458 . 0 0 "[ . 1 . 2 .]" 1
305 1 20 CYS HB3 1 109 LEU HA 0.000 . 5.440 2.204 1.987 2.655 . 0 0 "[ . 1 . 2 .]" 1
306 1 20 CYS HB3 1 109 LEU MD1 0.000 . 3.670 2.069 1.848 2.284 . 0 0 "[ . 1 . 2 .]" 1
307 1 20 CYS HB3 1 161 PHE QE 0.000 . 5.480 2.047 1.699 2.564 0.101 16 0 "[ . 1 . 2 .]" 1
308 1 20 CYS QB 1 28 ILE MG 0.000 . 5.190 3.757 3.405 3.988 . 0 0 "[ . 1 . 2 .]" 1
309 1 20 CYS QB 1 110 PHE H 0.000 . 5.500 3.461 3.150 3.680 . 0 0 "[ . 1 . 2 .]" 1
310 1 21 LEU H 1 28 ILE MG 0.000 . 5.220 3.130 2.462 3.747 . 0 0 "[ . 1 . 2 .]" 1
311 1 21 LEU H 1 43 PRO QG 0.000 . 5.500 3.640 3.053 5.559 0.059 23 0 "[ . 1 . 2 .]" 1
312 1 21 LEU HA 1 22 MET H 0.000 . 2.680 2.120 2.098 2.139 . 0 0 "[ . 1 . 2 .]" 1
313 1 21 LEU HA 1 109 LEU MD1 0.000 . 3.450 3.480 3.351 3.552 0.102 1 0 "[ . 1 . 2 .]" 1
314 1 21 LEU HA 1 110 PHE H 0.000 . 3.420 2.755 2.531 2.923 . 0 0 "[ . 1 . 2 .]" 1
315 1 21 LEU HA 1 110 PHE HB2 0.000 . 4.040 2.483 2.159 2.891 . 0 0 "[ . 1 . 2 .]" 1
316 1 21 LEU HB3 1 61 LEU MD1 0.000 . 5.160 3.654 3.093 4.303 . 0 0 "[ . 1 . 2 .]" 1
317 1 21 LEU HG 1 22 MET H 0.000 . 5.500 3.226 2.974 3.445 . 0 0 "[ . 1 . 2 .]" 1
318 1 21 LEU HG 1 29 PHE H 0.000 . 5.500 3.982 3.612 4.224 . 0 0 "[ . 1 . 2 .]" 1
319 1 21 LEU HG 1 112 PHE H 0.000 . 3.650 3.661 3.416 3.806 0.156 2 0 "[ . 1 . 2 .]" 1
320 1 21 LEU HG 1 112 PHE HA 0.000 . 5.500 4.411 4.218 4.570 . 0 0 "[ . 1 . 2 .]" 1
321 1 21 LEU HG 1 112 PHE HB3 0.000 . 5.500 3.933 3.624 4.106 . 0 0 "[ . 1 . 2 .]" 1
322 1 21 LEU MD1 1 22 MET H 0.000 . 3.640 2.760 2.501 2.927 . 0 0 "[ . 1 . 2 .]" 1
323 1 21 LEU MD1 1 22 MET HA 0.000 . 4.410 4.452 4.413 4.521 0.111 18 0 "[ . 1 . 2 .]" 1
324 1 21 LEU MD1 1 70 ALA H 0.000 . 5.130 5.105 4.989 5.191 0.061 22 0 "[ . 1 . 2 .]" 1
325 1 21 LEU MD1 1 70 ALA HA 0.000 . 3.980 3.783 3.659 3.886 . 0 0 "[ . 1 . 2 .]" 1
326 1 21 LEU MD1 1 70 ALA MB 0.000 . 4.440 1.958 1.886 2.043 . 0 0 "[ . 1 . 2 .]" 1
327 1 21 LEU MD1 1 110 PHE H 0.000 . 5.500 4.145 3.824 4.327 . 0 0 "[ . 1 . 2 .]" 1
328 1 21 LEU MD1 1 110 PHE HB2 0.000 . 3.170 2.476 2.143 2.789 . 0 0 "[ . 1 . 2 .]" 1
329 1 21 LEU MD1 1 110 PHE HB3 0.000 . 4.010 2.487 1.963 3.272 . 0 0 "[ . 1 . 2 .]" 1
330 1 21 LEU MD1 1 110 PHE QD 0.000 . 5.480 3.703 2.984 4.028 . 0 0 "[ . 1 . 2 .]" 1
331 1 21 LEU MD1 1 111 LYS H 0.000 . 5.500 3.654 3.432 3.851 . 0 0 "[ . 1 . 2 .]" 1
332 1 21 LEU MD1 1 111 LYS HA 0.000 . 4.260 2.982 2.635 3.165 . 0 0 "[ . 1 . 2 .]" 1
333 1 21 LEU MD1 1 112 PHE H 0.000 . 4.040 2.395 2.215 2.573 . 0 0 "[ . 1 . 2 .]" 1
334 1 21 LEU MD1 1 112 PHE HA 0.000 . 3.050 2.267 2.104 2.441 . 0 0 "[ . 1 . 2 .]" 1
335 1 21 LEU MD1 1 112 PHE HB2 0.000 . 5.500 2.069 1.842 2.331 . 0 0 "[ . 1 . 2 .]" 1
336 1 21 LEU MD1 1 112 PHE HB3 0.000 . 3.830 3.395 3.182 3.618 . 0 0 "[ . 1 . 2 .]" 1
337 1 21 LEU MD1 1 112 PHE QD 0.000 . 4.240 2.123 1.872 2.669 . 0 0 "[ . 1 . 2 .]" 1
338 1 21 LEU MD1 1 113 THR H 0.000 . 5.500 4.061 3.931 4.210 . 0 0 "[ . 1 . 2 .]" 1
339 1 21 LEU MD1 1 136 TRP HH2 0.000 . 4.660 3.979 3.004 4.457 . 0 0 "[ . 1 . 2 .]" 1
340 1 21 LEU MD2 1 22 MET H 0.000 . 5.500 4.638 4.479 4.803 . 0 0 "[ . 1 . 2 .]" 1
341 1 21 LEU MD2 1 29 PHE H 0.000 . 5.500 4.262 3.726 4.705 . 0 0 "[ . 1 . 2 .]" 1
342 1 21 LEU MD2 1 29 PHE HB2 0.000 . 5.160 2.343 1.927 2.809 . 0 0 "[ . 1 . 2 .]" 1
343 1 21 LEU MD2 1 29 PHE HB3 0.000 . 3.920 2.857 2.294 3.286 . 0 0 "[ . 1 . 2 .]" 1
344 1 21 LEU MD2 1 29 PHE QD 0.000 . 4.210 2.853 2.119 3.502 . 0 0 "[ . 1 . 2 .]" 1
345 1 21 LEU MD2 1 70 ALA HA 0.000 . 5.500 5.506 5.172 5.632 0.132 3 0 "[ . 1 . 2 .]" 1
346 1 21 LEU MD2 1 70 ALA MB 0.000 . 5.650 3.320 3.004 3.498 . 0 0 "[ . 1 . 2 .]" 1
347 1 21 LEU MD2 1 110 PHE HB2 0.000 . 4.510 4.531 4.367 4.610 0.100 6 0 "[ . 1 . 2 .]" 1
348 1 21 LEU MD2 1 112 PHE HA 0.000 . 5.500 3.705 3.425 3.894 . 0 0 "[ . 1 . 2 .]" 1
349 1 21 LEU MD2 1 112 PHE HB2 0.000 . 5.500 2.424 1.993 2.767 . 0 0 "[ . 1 . 2 .]" 1
350 1 21 LEU MD2 1 112 PHE HB3 0.000 . 4.790 3.791 3.426 4.171 . 0 0 "[ . 1 . 2 .]" 1
351 1 21 LEU MD2 1 112 PHE QD 0.000 . 4.180 1.689 1.314 1.925 0.486 3 0 "[ . 1 . 2 .]" 1
352 1 21 LEU MD2 1 112 PHE QE 0.000 . 4.410 3.170 2.921 3.413 . 0 0 "[ . 1 . 2 .]" 1
353 1 21 LEU MD2 1 119 ILE MD 0.000 . 5.500 3.184 2.807 3.530 . 0 0 "[ . 1 . 2 .]" 1
354 1 21 LEU MD2 1 136 TRP HH2 0.000 . 3.480 2.329 1.747 3.077 0.053 12 0 "[ . 1 . 2 .]" 1
355 1 22 MET H 1 23 ASN H 0.000 . 5.380 4.480 4.432 4.505 . 0 0 "[ . 1 . 2 .]" 1
356 1 22 MET H 1 110 PHE H 0.000 . 3.610 3.510 3.360 3.689 0.079 18 0 "[ . 1 . 2 .]" 1
357 1 22 MET H 1 111 LYS HA 0.000 . 3.240 2.986 2.684 3.261 0.021 6 0 "[ . 1 . 2 .]" 1
358 1 22 MET H 1 112 PHE H 0.000 . 4.110 3.610 3.368 3.716 . 0 0 "[ . 1 . 2 .]" 1
359 1 22 MET H 1 112 PHE HB3 0.000 . 5.500 5.496 5.095 5.602 0.102 1 0 "[ . 1 . 2 .]" 1
360 1 22 MET HA 1 23 ASN H 0.000 . 2.620 2.336 2.170 2.446 . 0 0 "[ . 1 . 2 .]" 1
361 1 22 MET HA 1 27 LYS H 0.000 . 4.910 4.434 4.061 4.709 . 0 0 "[ . 1 . 2 .]" 1
362 1 22 MET HA 1 28 ILE HA 0.000 . 3.270 2.262 1.991 2.460 . 0 0 "[ . 1 . 2 .]" 1
363 1 22 MET HA 1 28 ILE MG 0.000 . 3.850 3.635 3.456 3.906 0.056 7 0 "[ . 1 . 2 .]" 1
364 1 22 MET HA 1 28 ILE QG 0.000 . 5.650 4.424 3.329 5.112 . 0 0 "[ . 1 . 2 .]" 1
365 1 22 MET HA 1 29 PHE H 0.000 . 3.520 3.103 2.801 3.555 0.035 21 0 "[ . 1 . 2 .]" 1
366 1 22 MET HA 1 136 TRP HE3 0.000 . 5.280 3.718 2.989 4.508 . 0 0 "[ . 1 . 2 .]" 1
367 1 22 MET HA 1 136 TRP HZ3 0.000 . 5.500 3.552 1.997 4.203 . 0 0 "[ . 1 . 2 .]" 1
368 1 22 MET HB2 1 23 ASN H 0.000 . 3.490 2.657 2.335 3.273 . 0 0 "[ . 1 . 2 .]" 1
369 1 22 MET HB3 1 23 ASN H 0.000 . 3.490 3.502 3.382 3.564 0.074 11 0 "[ . 1 . 2 .]" 1
370 1 22 MET QB 1 25 ASP H 0.000 . 4.940 4.982 4.923 5.046 0.106 21 0 "[ . 1 . 2 .]" 1
371 1 22 MET QB 1 26 LYS HA 0.000 . 4.380 2.932 2.595 3.194 . 0 0 "[ . 1 . 2 .]" 1
372 1 22 MET QB 1 27 LYS H 0.000 . 4.350 3.419 3.219 3.644 . 0 0 "[ . 1 . 2 .]" 1
373 1 22 MET QB 1 28 ILE MG 0.000 . 5.500 3.430 2.836 4.354 . 0 0 "[ . 1 . 2 .]" 1
374 1 22 MET QB 1 28 ILE QG 0.000 . 5.500 3.355 2.030 4.561 . 0 0 "[ . 1 . 2 .]" 1
375 1 22 MET QB 1 28 ILE MD 0.000 . 3.170 2.752 2.243 3.289 0.119 7 0 "[ . 1 . 2 .]" 1
376 1 22 MET HG2 1 23 ASN H 0.000 . 5.500 5.005 4.802 5.206 . 0 0 "[ . 1 . 2 .]" 1
377 1 22 MET HG2 1 109 LEU MD1 0.000 . 4.440 2.071 1.862 2.608 . 0 0 "[ . 1 . 2 .]" 1
378 1 22 MET HG2 1 111 LYS HA 0.000 . 5.350 4.437 3.557 4.935 . 0 0 "[ . 1 . 2 .]" 1
379 1 22 MET HG2 1 111 LYS QG 0.000 . 5.500 5.410 5.033 5.537 0.037 6 0 "[ . 1 . 2 .]" 1
380 1 22 MET HG3 1 23 ASN H 0.000 . 5.500 4.648 4.079 5.072 . 0 0 "[ . 1 . 2 .]" 1
381 1 22 MET HG3 1 109 LEU MD1 0.000 . 4.440 2.681 1.823 3.176 . 0 0 "[ . 1 . 2 .]" 1
382 1 22 MET HG3 1 111 LYS HA 0.000 . 5.350 3.296 2.702 3.851 . 0 0 "[ . 1 . 2 .]" 1
383 1 22 MET HG3 1 111 LYS QG 0.000 . 5.500 4.294 3.523 5.334 . 0 0 "[ . 1 . 2 .]" 1
384 1 22 MET QG 1 26 LYS HA 0.000 . 5.350 4.347 3.856 4.740 . 0 0 "[ . 1 . 2 .]" 1
385 1 22 MET QG 1 109 LEU MD1 0.000 . 3.200 1.930 1.657 2.150 0.143 4 0 "[ . 1 . 2 .]" 1
386 1 22 MET QG 1 111 LYS HA 0.000 . 3.610 3.209 2.624 3.723 0.113 11 0 "[ . 1 . 2 .]" 1
387 1 22 MET QG 1 111 LYS HB2 0.000 . 5.380 4.450 3.523 5.169 . 0 0 "[ . 1 . 2 .]" 1
388 1 22 MET QG 1 112 PHE H 0.000 . 5.500 4.479 3.994 4.896 . 0 0 "[ . 1 . 2 .]" 1
389 1 22 MET QG 1 165 LEU MD2 0.000 . 3.670 3.178 2.169 3.693 0.023 17 0 "[ . 1 . 2 .]" 1
390 1 22 MET ME 1 26 LYS HA 0.000 . 3.170 3.145 2.993 3.247 0.077 5 0 "[ . 1 . 2 .]" 1
391 1 22 MET ME 1 26 LYS HE2 0.000 . 3.420 2.717 1.807 3.570 0.150 10 0 "[ . 1 . 2 .]" 1
392 1 22 MET ME 1 26 LYS HE3 0.000 . 3.420 2.700 1.880 3.542 0.122 7 0 "[ . 1 . 2 .]" 1
393 1 22 MET ME 1 73 ILE MG 0.000 . 5.300 2.922 2.526 3.287 . 0 0 "[ . 1 . 2 .]" 1
394 1 22 MET ME 1 73 ILE HG12 0.000 . 5.650 3.564 3.193 3.951 . 0 0 "[ . 1 . 2 .]" 1
395 1 22 MET ME 1 73 ILE HG13 0.000 . 5.650 4.140 2.086 4.465 . 0 0 "[ . 1 . 2 .]" 1
396 1 22 MET ME 1 73 ILE MD 0.000 . 3.540 1.899 1.480 3.519 0.320 24 0 "[ . 1 . 2 .]" 1
397 1 22 MET ME 1 109 LEU HA 0.000 . 5.650 5.701 5.623 5.807 0.157 22 0 "[ . 1 . 2 .]" 1
398 1 22 MET ME 1 109 LEU MD1 0.000 . 4.810 3.111 2.786 3.550 . 0 0 "[ . 1 . 2 .]" 1
399 1 22 MET ME 1 109 LEU MD2 0.000 . 3.630 2.511 2.166 2.789 . 0 0 "[ . 1 . 2 .]" 1
400 1 22 MET ME 1 111 LYS HA 0.000 . 3.850 3.896 3.770 3.976 0.126 20 0 "[ . 1 . 2 .]" 1
401 1 22 MET ME 1 111 LYS QG 0.000 . 4.120 3.652 2.952 3.971 . 0 0 "[ . 1 . 2 .]" 1
402 1 22 MET ME 1 111 LYS QE 0.000 . 4.120 3.347 1.971 4.104 . 0 0 "[ . 1 . 2 .]" 1
403 1 22 MET ME 1 164 HIS HA 0.000 . 4.750 4.727 4.557 4.828 0.078 8 0 "[ . 1 . 2 .]" 1
404 1 22 MET ME 1 165 LEU HA 0.000 . 3.510 3.500 3.381 3.693 0.183 3 0 "[ . 1 . 2 .]" 1
405 1 22 MET ME 1 165 LEU MD2 0.000 . 3.290 2.654 2.479 2.758 . 0 0 "[ . 1 . 2 .]" 1
406 1 23 ASN H 1 25 ASP H 0.000 . 3.670 3.814 3.691 3.861 0.191 6 0 "[ . 1 . 2 .]" 1
407 1 23 ASN H 1 26 LYS H 0.000 . 3.980 3.751 3.519 3.854 . 0 0 "[ . 1 . 2 .]" 1
408 1 23 ASN H 1 26 LYS HA 0.000 . 4.760 4.319 3.971 4.498 . 0 0 "[ . 1 . 2 .]" 1
409 1 23 ASN H 1 27 LYS H 0.000 . 3.420 2.756 2.505 3.032 . 0 0 "[ . 1 . 2 .]" 1
410 1 23 ASN H 1 27 LYS QB 0.000 . 4.410 3.230 2.955 3.575 . 0 0 "[ . 1 . 2 .]" 1
411 1 23 ASN H 1 28 ILE HA 0.000 . 3.950 3.947 3.726 4.076 0.126 16 0 "[ . 1 . 2 .]" 1
412 1 23 ASN H 1 28 ILE MG 0.000 . 5.500 5.433 5.330 5.558 0.058 7 0 "[ . 1 . 2 .]" 1
413 1 23 ASN H 1 29 PHE H 0.000 . 5.000 5.022 4.943 5.111 0.111 19 0 "[ . 1 . 2 .]" 1
414 1 23 ASN HA 1 24 ASN H 0.000 . 3.140 2.509 2.435 2.654 . 0 0 "[ . 1 . 2 .]" 1
415 1 23 ASN HA 1 25 ASP H 0.000 . 5.160 3.924 3.816 4.103 . 0 0 "[ . 1 . 2 .]" 1
416 1 23 ASN HA 1 112 PHE H 0.000 . 5.130 2.913 2.686 3.260 . 0 0 "[ . 1 . 2 .]" 1
417 1 23 ASN HA 1 112 PHE QD 0.000 . 4.800 4.549 4.411 4.639 . 0 0 "[ . 1 . 2 .]" 1
418 1 23 ASN HA 1 136 TRP HE3 0.000 . 5.380 5.251 4.946 5.523 0.143 4 0 "[ . 1 . 2 .]" 1
419 1 23 ASN HA 1 136 TRP HH2 0.000 . 5.500 5.383 4.314 5.632 0.132 12 0 "[ . 1 . 2 .]" 1
420 1 23 ASN HB2 1 24 ASN H 0.000 . 3.180 3.081 2.795 3.440 0.260 8 0 "[ . 1 . 2 .]" 1
421 1 23 ASN HB3 1 24 ASN H 0.000 . 3.080 2.287 1.832 2.530 . 0 0 "[ . 1 . 2 .]" 1
422 1 23 ASN HB3 1 25 ASP H 0.000 . 3.890 3.126 2.427 3.390 . 0 0 "[ . 1 . 2 .]" 1
423 1 23 ASN HB2 1 136 TRP HE3 0.000 . 5.400 4.468 3.335 5.081 . 0 0 "[ . 1 . 2 .]" 1
424 1 23 ASN HB3 1 136 TRP HE3 0.000 . 4.860 5.004 4.876 5.096 0.236 17 0 "[ . 1 . 2 .]" 1
425 1 24 ASN H 1 24 ASN QD 0.000 . 5.340 3.502 1.860 4.471 . 0 0 "[ . 1 . 2 .]" 1
426 1 24 ASN H 1 25 ASP H 0.000 . 3.420 2.801 2.732 2.937 . 0 0 "[ . 1 . 2 .]" 1
427 1 24 ASN H 1 112 PHE QD 0.000 . 5.480 5.454 5.267 5.551 0.071 6 0 "[ . 1 . 2 .]" 1
428 1 24 ASN HA 1 25 ASP H 0.000 . 3.360 3.342 3.323 3.380 0.020 7 0 "[ . 1 . 2 .]" 1
429 1 24 ASN HA 1 26 LYS H 0.000 . 3.890 3.657 3.563 3.785 . 0 0 "[ . 1 . 2 .]" 1
430 1 24 ASN HA 1 111 LYS QE 0.000 . 3.540 2.398 1.671 3.426 0.129 3 0 "[ . 1 . 2 .]" 1
431 1 25 ASP H 1 26 LYS H 0.000 . 2.800 2.306 2.177 2.370 . 0 0 "[ . 1 . 2 .]" 1
432 1 25 ASP H 1 27 LYS H 0.000 . 3.050 3.174 3.137 3.254 0.204 7 0 "[ . 1 . 2 .]" 1
433 1 25 ASP HA 1 26 LYS QG 0.000 . 4.660 4.119 3.731 4.725 0.065 7 0 "[ . 1 . 2 .]" 1
434 1 25 ASP HB2 1 26 LYS H 0.000 . 3.580 3.622 3.478 3.659 0.079 11 0 "[ . 1 . 2 .]" 1
435 1 25 ASP HB2 1 27 LYS H 0.000 . 3.550 3.243 3.089 3.289 . 0 0 "[ . 1 . 2 .]" 1
436 1 25 ASP HB2 1 27 LYS QB 0.000 . 3.490 3.409 2.805 3.547 0.057 2 0 "[ . 1 . 2 .]" 1
437 1 25 ASP HB2 1 27 LYS HG2 0.000 . 5.100 3.757 3.068 5.181 0.081 12 0 "[ . 1 . 2 .]" 1
438 1 25 ASP HB2 1 27 LYS HG3 0.000 . 5.100 2.666 2.026 4.414 . 0 0 "[ . 1 . 2 .]" 1
439 1 25 ASP HB2 1 27 LYS QE 0.000 . 4.440 4.316 3.846 4.490 0.050 20 0 "[ . 1 . 2 .]" 1
440 1 25 ASP HB3 1 26 LYS H 0.000 . 3.800 3.978 3.909 4.001 0.201 25 0 "[ . 1 . 2 .]" 1
441 1 25 ASP HB3 1 27 LYS H 0.000 . 3.490 3.529 3.315 3.586 0.096 23 0 "[ . 1 . 2 .]" 1
442 1 25 ASP HB3 1 27 LYS QG 0.000 . 3.520 2.238 1.827 3.509 . 0 0 "[ . 1 . 2 .]" 1
443 1 25 ASP HB3 1 27 LYS QD 0.000 . 4.320 3.427 1.970 4.140 . 0 0 "[ . 1 . 2 .]" 1
444 1 26 LYS H 1 27 LYS H 0.000 . 2.930 2.409 2.368 2.453 . 0 0 "[ . 1 . 2 .]" 1
445 1 26 LYS H 1 165 LEU MD2 0.000 . 5.500 5.538 5.432 5.640 0.140 7 0 "[ . 1 . 2 .]" 1
446 1 26 LYS HA 1 27 LYS H 0.000 . 3.110 3.017 2.952 3.058 . 0 0 "[ . 1 . 2 .]" 1
447 1 26 LYS HA 1 165 LEU MD2 0.000 . 4.160 3.679 3.562 3.911 . 0 0 "[ . 1 . 2 .]" 1
448 1 26 LYS QB 1 165 LEU MD2 0.000 . 4.160 3.559 3.224 3.842 . 0 0 "[ . 1 . 2 .]" 1
449 1 26 LYS QG 1 165 LEU HA 0.000 . 5.220 4.197 3.744 4.685 . 0 0 "[ . 1 . 2 .]" 1
450 1 26 LYS QD 1 165 LEU HA 0.000 . 3.450 2.281 1.872 3.089 . 0 0 "[ . 1 . 2 .]" 1
451 1 26 LYS QD 1 165 LEU MD2 0.000 . 3.170 2.750 2.088 3.265 0.095 5 0 "[ . 1 . 2 .]" 1
452 1 26 LYS QE 1 165 LEU HA 0.000 . 4.450 2.842 1.560 3.572 0.240 7 0 "[ . 1 . 2 .]" 1
453 1 27 LYS H 1 28 ILE H 0.000 . 4.450 4.502 4.341 4.540 0.090 24 0 "[ . 1 . 2 .]" 1
454 1 27 LYS HA 1 28 ILE H 0.000 . 2.930 2.366 2.201 2.882 . 0 0 "[ . 1 . 2 .]" 1
455 1 27 LYS HA 1 28 ILE MD 0.000 . 5.500 2.922 2.314 3.606 . 0 0 "[ . 1 . 2 .]" 1
456 1 27 LYS HA 1 138 THR HA 0.000 . 4.200 2.504 2.015 2.874 . 0 0 "[ . 1 . 2 .]" 1
457 1 27 LYS H 1 136 TRP HB3 0.000 . 5.100 5.155 4.964 5.299 0.199 4 0 "[ . 1 . 2 .]" 1
458 1 27 LYS HB2 1 28 ILE H 0.000 . 3.860 3.695 2.750 3.934 0.074 10 0 "[ . 1 . 2 .]" 1
459 1 27 LYS HB3 1 28 ILE H 0.000 . 3.860 2.674 1.900 3.039 . 0 0 "[ . 1 . 2 .]" 1
460 1 27 LYS QB 1 136 TRP HB2 0.000 . 5.500 3.596 3.219 4.411 . 0 0 "[ . 1 . 2 .]" 1
461 1 27 LYS QB 1 136 TRP HB3 0.000 . 5.500 2.465 2.154 3.071 . 0 0 "[ . 1 . 2 .]" 1
462 1 27 LYS QB 1 137 VAL H 0.000 . 5.500 3.558 3.043 3.969 . 0 0 "[ . 1 . 2 .]" 1
463 1 27 LYS QG 1 28 ILE H 0.000 . 5.500 4.159 3.256 4.461 . 0 0 "[ . 1 . 2 .]" 1
464 1 27 LYS QG 1 136 TRP HB3 0.000 . 5.500 3.981 3.416 4.610 . 0 0 "[ . 1 . 2 .]" 1
465 1 27 LYS QG 1 138 THR HA 0.000 . 4.940 3.786 1.878 4.807 . 0 0 "[ . 1 . 2 .]" 1
466 1 27 LYS QD 1 28 ILE H 0.000 . 5.500 4.132 3.646 4.693 . 0 0 "[ . 1 . 2 .]" 1
467 1 27 LYS QD 1 136 TRP H 0.000 . 5.500 5.339 4.730 5.588 0.088 20 0 "[ . 1 . 2 .]" 1
468 1 27 LYS QD 1 136 TRP HA 0.000 . 5.500 4.679 3.903 5.078 . 0 0 "[ . 1 . 2 .]" 1
469 1 27 LYS QD 1 136 TRP HB2 0.000 . 3.920 3.580 3.175 3.925 0.005 23 0 "[ . 1 . 2 .]" 1
470 1 27 LYS QD 1 136 TRP HB3 0.000 . 4.040 3.385 2.742 3.810 . 0 0 "[ . 1 . 2 .]" 1
471 1 27 LYS QD 1 137 VAL H 0.000 . 5.500 4.382 3.469 5.090 . 0 0 "[ . 1 . 2 .]" 1
472 1 27 LYS QD 1 137 VAL HA 0.000 . 4.850 3.127 2.278 4.063 . 0 0 "[ . 1 . 2 .]" 1
473 1 27 LYS QD 1 138 THR H 0.000 . 5.500 4.069 3.294 5.090 . 0 0 "[ . 1 . 2 .]" 1
474 1 27 LYS QE 1 28 ILE H 0.000 . 5.500 5.076 4.606 5.516 0.016 12 0 "[ . 1 . 2 .]" 1
475 1 27 LYS QE 1 137 VAL HA 0.000 . 5.470 4.197 2.863 4.794 . 0 0 "[ . 1 . 2 .]" 1
476 1 27 LYS QE 1 138 THR HA 0.000 . 5.190 3.739 3.382 4.227 . 0 0 "[ . 1 . 2 .]" 1
477 1 27 LYS QE 1 138 THR MG 0.000 . 2.390 2.113 1.790 2.376 0.010 23 0 "[ . 1 . 2 .]" 1
478 1 28 ILE H 1 136 TRP HA 0.000 . 4.380 4.373 3.939 4.482 0.102 25 0 "[ . 1 . 2 .]" 1
479 1 28 ILE H 1 136 TRP HB3 0.000 . 5.500 4.608 4.175 5.002 . 0 0 "[ . 1 . 2 .]" 1
480 1 28 ILE H 1 137 VAL H 0.000 . 3.330 3.338 3.120 3.438 0.108 10 0 "[ . 1 . 2 .]" 1
481 1 28 ILE H 1 137 VAL MG2 0.000 . 4.780 3.631 3.234 3.828 . 0 0 "[ . 1 . 2 .]" 1
482 1 28 ILE HA 1 29 PHE H 0.000 . 2.930 2.160 2.123 2.206 . 0 0 "[ . 1 . 2 .]" 1
483 1 28 ILE HA 1 136 TRP HE3 0.000 . 4.450 3.985 3.345 4.330 . 0 0 "[ . 1 . 2 .]" 1
484 1 28 ILE HB 1 29 PHE H 0.000 . 3.700 3.710 3.575 3.822 0.122 18 0 "[ . 1 . 2 .]" 1
485 1 28 ILE HB 1 42 MET ME 0.000 . 5.650 5.261 4.482 5.742 0.092 10 0 "[ . 1 . 2 .]" 1
486 1 28 ILE MG 1 29 PHE H 0.000 . 3.230 2.235 1.870 2.525 . 0 0 "[ . 1 . 2 .]" 1
487 1 28 ILE MG 1 42 MET QB 0.000 . 4.720 3.481 2.510 4.243 . 0 0 "[ . 1 . 2 .]" 1
488 1 28 ILE MG 1 42 MET ME 0.000 . 4.680 3.414 2.854 3.830 . 0 0 "[ . 1 . 2 .]" 1
489 1 28 ILE QG 1 139 PRO HA 0.000 . 3.490 2.240 1.527 3.303 0.273 3 0 "[ . 1 . 2 .]" 1
490 1 28 ILE QG 1 139 PRO HB3 0.000 . 3.390 3.220 2.765 3.538 0.148 7 0 "[ . 1 . 2 .]" 1
491 1 28 ILE QG 1 139 PRO QG 0.000 . 5.500 3.196 2.932 3.673 . 0 0 "[ . 1 . 2 .]" 1
492 1 28 ILE MD 1 29 PHE H 0.000 . 5.280 4.410 4.086 4.781 . 0 0 "[ . 1 . 2 .]" 1
493 1 28 ILE MD 1 137 VAL H 0.000 . 5.500 5.132 4.375 5.628 0.128 22 0 "[ . 1 . 2 .]" 1
494 1 28 ILE MD 1 138 THR HA 0.000 . 5.500 3.201 2.339 3.892 . 0 0 "[ . 1 . 2 .]" 1
495 1 28 ILE MD 1 138 THR HB 0.000 . 5.500 4.426 3.678 5.060 . 0 0 "[ . 1 . 2 .]" 1
496 1 28 ILE MD 1 138 THR MG 0.000 . 5.500 4.756 4.070 5.338 . 0 0 "[ . 1 . 2 .]" 1
497 1 28 ILE MD 1 139 PRO HA 0.000 . 3.080 2.373 1.940 2.704 . 0 0 "[ . 1 . 2 .]" 1
498 1 28 ILE MD 1 139 PRO HB2 0.000 . 3.520 3.593 3.341 3.802 0.282 3 0 "[ . 1 . 2 .]" 1
499 1 28 ILE MD 1 139 PRO HB3 0.000 . 3.060 2.386 2.093 2.604 . 0 0 "[ . 1 . 2 .]" 1
500 1 28 ILE MD 1 139 PRO QG 0.000 . 3.500 1.873 1.771 2.274 0.029 3 0 "[ . 1 . 2 .]" 1
501 1 28 ILE MD 1 139 PRO QD 0.000 . 4.720 2.564 2.079 2.986 . 0 0 "[ . 1 . 2 .]" 1
502 1 29 PHE H 1 30 ALA H 0.000 . 5.440 4.464 4.271 4.595 . 0 0 "[ . 1 . 2 .]" 1
503 1 29 PHE HA 1 30 ALA H 0.000 . 2.560 2.196 2.150 2.236 . 0 0 "[ . 1 . 2 .]" 1
504 1 29 PHE HA 1 30 ALA MB 0.000 . 5.620 4.011 3.911 4.143 . 0 0 "[ . 1 . 2 .]" 1
505 1 29 PHE HA 1 135 SER H 0.000 . 5.500 4.477 4.316 4.734 . 0 0 "[ . 1 . 2 .]" 1
506 1 29 PHE HA 1 136 TRP HA 0.000 . 4.070 2.825 2.435 3.314 . 0 0 "[ . 1 . 2 .]" 1
507 1 29 PHE HA 1 136 TRP HE3 0.000 . 4.290 2.877 2.492 3.409 . 0 0 "[ . 1 . 2 .]" 1
508 1 29 PHE HB2 1 30 ALA H 0.000 . 4.730 4.248 4.062 4.477 . 0 0 "[ . 1 . 2 .]" 1
509 1 29 PHE QD 1 30 ALA H 0.000 . 5.480 3.123 2.252 3.873 . 0 0 "[ . 1 . 2 .]" 1
510 1 29 PHE QD 1 30 ALA HA 0.000 . 5.480 4.272 3.611 4.799 . 0 0 "[ . 1 . 2 .]" 1
511 1 29 PHE QD 1 42 MET HA 0.000 . 5.480 3.787 2.629 4.773 . 0 0 "[ . 1 . 2 .]" 1
512 1 29 PHE QD 1 43 PRO QG 0.000 . 5.480 2.502 1.918 3.129 . 0 0 "[ . 1 . 2 .]" 1
513 1 29 PHE QD 1 43 PRO HD2 0.000 . 5.480 2.508 1.786 3.422 0.014 7 0 "[ . 1 . 2 .]" 1
514 1 29 PHE QD 1 43 PRO HD3 0.000 . 5.480 2.323 1.857 3.325 . 0 0 "[ . 1 . 2 .]" 1
515 1 29 PHE QE 1 30 ALA H 0.000 . 5.480 4.381 3.724 4.958 . 0 0 "[ . 1 . 2 .]" 1
516 1 29 PHE QE 1 31 ALA MB 0.000 . 4.420 3.074 2.417 3.532 . 0 0 "[ . 1 . 2 .]" 1
517 1 29 PHE QE 1 65 THR HB 0.000 . 5.480 3.410 2.525 4.188 . 0 0 "[ . 1 . 2 .]" 1
518 1 29 PHE QE 1 119 ILE MG 0.000 . 3.740 2.529 2.296 2.813 . 0 0 "[ . 1 . 2 .]" 1
519 1 29 PHE QE 1 119 ILE MD 0.000 . 4.080 2.063 1.726 2.590 0.074 24 0 "[ . 1 . 2 .]" 1
520 1 29 PHE QE 1 121 LEU MD1 0.000 . 5.480 4.688 3.746 5.091 . 0 0 "[ . 1 . 2 .]" 1
521 1 29 PHE QE 1 121 LEU MD2 0.000 . 3.500 3.461 2.916 3.674 0.174 19 0 "[ . 1 . 2 .]" 1
522 1 29 PHE HZ 1 31 ALA MB 0.000 . 3.200 3.163 2.971 3.291 0.091 5 0 "[ . 1 . 2 .]" 1
523 1 29 PHE HZ 1 43 PRO QG 0.000 . 5.500 5.040 3.885 5.428 . 0 0 "[ . 1 . 2 .]" 1
524 1 29 PHE HZ 1 119 ILE MG 0.000 . 2.830 2.161 1.893 2.483 . 0 0 "[ . 1 . 2 .]" 1
525 1 29 PHE HZ 1 119 ILE QG 0.000 . 5.500 4.435 3.902 4.746 . 0 0 "[ . 1 . 2 .]" 1
526 1 29 PHE HZ 1 119 ILE MD 0.000 . 2.800 2.881 2.833 2.936 0.136 20 0 "[ . 1 . 2 .]" 1
527 1 29 PHE HZ 1 121 LEU MD1 0.000 . 5.470 4.335 3.106 4.862 . 0 0 "[ . 1 . 2 .]" 1
528 1 29 PHE HZ 1 121 LEU MD2 0.000 . 3.760 2.516 2.103 2.890 . 0 0 "[ . 1 . 2 .]" 1
529 1 30 ALA H 1 134 TRP HA 0.000 . 5.410 4.791 4.408 5.368 . 0 0 "[ . 1 . 2 .]" 1
530 1 30 ALA H 1 135 SER H 0.000 . 3.420 2.801 2.506 3.272 . 0 0 "[ . 1 . 2 .]" 1
531 1 30 ALA H 1 136 TRP HA 0.000 . 4.010 3.351 2.950 3.758 . 0 0 "[ . 1 . 2 .]" 1
532 1 30 ALA H 1 136 TRP HE3 0.000 . 5.500 4.741 3.920 5.437 . 0 0 "[ . 1 . 2 .]" 1
533 1 30 ALA H 1 137 VAL H 0.000 . 5.500 3.836 3.277 4.307 . 0 0 "[ . 1 . 2 .]" 1
534 1 30 ALA H 1 137 VAL MG1 0.000 . 5.500 4.517 4.200 4.851 . 0 0 "[ . 1 . 2 .]" 1
535 1 30 ALA H 1 137 VAL MG2 0.000 . 4.260 3.959 3.485 4.335 0.075 3 0 "[ . 1 . 2 .]" 1
536 1 30 ALA HA 1 31 ALA H 0.000 . 2.830 2.229 2.166 2.310 . 0 0 "[ . 1 . 2 .]" 1
537 1 30 ALA HA 1 41 GLN H 0.000 . 4.820 3.626 3.165 3.912 . 0 0 "[ . 1 . 2 .]" 1
538 1 30 ALA HA 1 42 MET HA 0.000 . 4.350 3.150 2.620 3.971 . 0 0 "[ . 1 . 2 .]" 1
539 1 30 ALA HA 1 142 LEU MD1 0.000 . 5.400 2.470 1.980 2.868 . 0 0 "[ . 1 . 2 .]" 1
540 1 30 ALA MB 1 31 ALA H 0.000 . 3.290 2.743 2.471 2.911 . 0 0 "[ . 1 . 2 .]" 1
541 1 30 ALA MB 1 40 TRP HA 0.000 . 3.790 3.918 3.828 3.983 0.193 16 0 "[ . 1 . 2 .]" 1
542 1 30 ALA MB 1 40 TRP HB2 0.000 . 3.600 3.739 3.676 3.794 0.194 19 0 "[ . 1 . 2 .]" 1
543 1 30 ALA MB 1 40 TRP HB3 0.000 . 3.380 2.239 2.154 2.312 . 0 0 "[ . 1 . 2 .]" 1
544 1 30 ALA MB 1 40 TRP HE3 0.000 . 3.010 1.819 1.719 1.888 0.081 7 0 "[ . 1 . 2 .]" 1
545 1 30 ALA MB 1 40 TRP HZ3 0.000 . 4.410 2.720 2.559 2.899 . 0 0 "[ . 1 . 2 .]" 1
546 1 30 ALA MB 1 41 GLN H 0.000 . 5.000 3.111 2.641 3.455 . 0 0 "[ . 1 . 2 .]" 1
547 1 30 ALA MB 1 134 TRP HA 0.000 . 5.650 4.079 3.969 4.188 . 0 0 "[ . 1 . 2 .]" 1
548 1 30 ALA MB 1 135 SER H 0.000 . 5.650 3.046 2.828 3.279 . 0 0 "[ . 1 . 2 .]" 1
549 1 30 ALA MB 1 137 VAL HB 0.000 . 5.650 4.577 4.111 5.003 . 0 0 "[ . 1 . 2 .]" 1
550 1 30 ALA MB 1 137 VAL MG1 0.000 . 3.940 2.965 2.650 3.282 . 0 0 "[ . 1 . 2 .]" 1
551 1 30 ALA MB 1 137 VAL MG2 0.000 . 3.260 2.161 1.756 2.512 0.044 7 0 "[ . 1 . 2 .]" 1
552 1 30 ALA MB 1 142 LEU HG 0.000 . 4.590 3.783 3.352 4.252 . 0 0 "[ . 1 . 2 .]" 1
553 1 30 ALA MB 1 142 LEU MD1 0.000 . 2.980 1.683 1.449 1.782 0.351 3 0 "[ . 1 . 2 .]" 1
554 1 30 ALA MB 1 142 LEU MD2 0.000 . 4.870 3.771 2.475 4.087 . 0 0 "[ . 1 . 2 .]" 1
555 1 30 ALA MB 1 145 LEU MD1 0.000 . 5.650 4.537 4.254 4.863 . 0 0 "[ . 1 . 2 .]" 1
556 1 31 ALA H 1 41 GLN H 0.000 . 3.270 2.004 1.836 2.172 . 0 0 "[ . 1 . 2 .]" 1
557 1 31 ALA H 1 42 MET QB 0.000 . 5.500 4.834 3.808 5.553 0.053 9 0 "[ . 1 . 2 .]" 1
558 1 31 ALA HA 1 40 TRP HE3 0.000 . 4.790 3.143 3.008 3.236 . 0 0 "[ . 1 . 2 .]" 1
559 1 31 ALA HA 1 40 TRP HZ3 0.000 . 3.640 2.753 2.469 2.909 . 0 0 "[ . 1 . 2 .]" 1
560 1 31 ALA HA 1 134 TRP HA 0.000 . 2.650 1.902 1.732 2.059 0.068 13 0 "[ . 1 . 2 .]" 1
561 1 31 ALA HA 1 134 TRP HB2 0.000 . 4.790 2.991 2.509 3.394 . 0 0 "[ . 1 . 2 .]" 1
562 1 31 ALA HA 1 134 TRP HB3 0.000 . 4.690 2.771 2.596 3.091 . 0 0 "[ . 1 . 2 .]" 1
563 1 31 ALA HA 1 135 SER H 0.000 . 3.550 3.561 3.446 3.616 0.066 8 0 "[ . 1 . 2 .]" 1
564 1 31 ALA MB 1 40 TRP HZ3 0.000 . 5.650 4.178 3.913 4.334 . 0 0 "[ . 1 . 2 .]" 1
565 1 31 ALA MB 1 41 GLN H 0.000 . 5.650 3.668 3.448 3.897 . 0 0 "[ . 1 . 2 .]" 1
566 1 31 ALA MB 1 43 PRO HA 0.000 . 4.970 4.728 4.290 4.978 0.008 18 0 "[ . 1 . 2 .]" 1
567 1 31 ALA MB 1 131 PHE HA 0.000 . 5.210 3.999 3.791 4.308 . 0 0 "[ . 1 . 2 .]" 1
568 1 31 ALA MB 1 131 PHE HB2 0.000 . 4.160 2.526 2.204 2.846 . 0 0 "[ . 1 . 2 .]" 1
569 1 31 ALA MB 1 131 PHE HB3 0.000 . 3.910 1.995 1.740 2.326 0.060 21 0 "[ . 1 . 2 .]" 1
570 1 31 ALA MB 1 131 PHE QD 0.000 . 3.210 2.546 2.315 2.741 . 0 0 "[ . 1 . 2 .]" 1
571 1 31 ALA MB 1 133 GLU H 0.000 . 5.490 4.265 3.544 4.716 . 0 0 "[ . 1 . 2 .]" 1
572 1 31 ALA MB 1 134 TRP HA 0.000 . 3.660 3.304 2.980 3.578 . 0 0 "[ . 1 . 2 .]" 1
573 1 31 ALA MB 1 134 TRP HB2 0.000 . 5.120 2.838 2.589 3.161 . 0 0 "[ . 1 . 2 .]" 1
574 1 31 ALA MB 1 134 TRP HB3 0.000 . 5.240 2.451 2.255 2.667 . 0 0 "[ . 1 . 2 .]" 1
575 1 31 ALA MB 1 135 SER H 0.000 . 5.150 4.274 4.151 4.360 . 0 0 "[ . 1 . 2 .]" 1
576 1 32 SER H 1 40 TRP HZ3 0.000 . 5.500 3.961 3.737 4.146 . 0 0 "[ . 1 . 2 .]" 1
577 1 32 SER H 1 133 GLU H 0.000 . 3.240 2.948 2.647 3.195 . 0 0 "[ . 1 . 2 .]" 1
578 1 32 SER H 1 134 TRP HA 0.000 . 4.170 3.094 2.853 3.338 . 0 0 "[ . 1 . 2 .]" 1
579 1 32 SER HA 1 40 TRP HA 0.000 . 2.460 2.315 2.120 2.491 0.031 11 0 "[ . 1 . 2 .]" 1
580 1 32 SER HA 1 41 GLN H 0.000 . 4.040 3.603 3.266 4.073 0.033 10 0 "[ . 1 . 2 .]" 1
581 1 32 SER HB2 1 33 ARG H 0.000 . 4.290 3.076 2.752 4.086 . 0 0 "[ . 1 . 2 .]" 1
582 1 32 SER HB2 1 40 TRP HA 0.000 . 3.980 3.831 3.364 4.138 0.158 20 0 "[ . 1 . 2 .]" 1
583 1 32 SER HB3 1 33 ARG H 0.000 . 4.290 3.885 2.641 4.214 . 0 0 "[ . 1 . 2 .]" 1
584 1 32 SER HB3 1 40 TRP HA 0.000 . 3.980 3.360 2.950 4.027 0.047 19 0 "[ . 1 . 2 .]" 1
585 1 32 SER QB 1 37 PRO HA 0.000 . 4.450 2.849 2.138 3.486 . 0 0 "[ . 1 . 2 .]" 1
586 1 32 SER QB 1 40 TRP HE3 0.000 . 5.500 4.205 3.967 4.729 . 0 0 "[ . 1 . 2 .]" 1
587 1 32 SER QB 1 133 GLU QG 0.000 . 5.500 4.944 2.120 5.530 0.030 2 0 "[ . 1 . 2 .]" 1
588 1 33 ARG H 1 36 ILE H 0.000 . 3.980 4.057 3.996 4.095 0.115 5 0 "[ . 1 . 2 .]" 1
589 1 33 ARG H 1 40 TRP HA 0.000 . 5.130 4.235 4.029 4.411 . 0 0 "[ . 1 . 2 .]" 1
590 1 33 ARG HA 1 34 LEU H 0.000 . 2.900 2.158 2.119 2.180 . 0 0 "[ . 1 . 2 .]" 1
591 1 33 ARG HA 1 131 PHE HA 0.000 . 2.770 2.633 2.274 2.870 0.100 9 0 "[ . 1 . 2 .]" 1
592 1 33 ARG HA 1 131 PHE HB2 0.000 . 5.440 5.369 5.091 5.528 0.088 5 0 "[ . 1 . 2 .]" 1
593 1 33 ARG HA 1 131 PHE QD 0.000 . 3.560 3.459 3.071 3.594 0.034 17 0 "[ . 1 . 2 .]" 1
594 1 33 ARG HA 1 132 GLY H 0.000 . 3.520 3.385 3.202 3.524 0.004 1 0 "[ . 1 . 2 .]" 1
595 1 33 ARG HB2 1 34 LEU H 0.000 . 4.060 4.124 3.979 4.224 0.164 11 0 "[ . 1 . 2 .]" 1
596 1 33 ARG HB3 1 34 LEU H 0.000 . 4.180 3.270 3.060 3.348 . 0 0 "[ . 1 . 2 .]" 1
597 1 33 ARG HB2 1 35 ASP H 0.000 . 3.900 3.596 3.385 3.819 . 0 0 "[ . 1 . 2 .]" 1
598 1 33 ARG HB3 1 35 ASP H 0.000 . 4.430 3.390 2.793 4.130 . 0 0 "[ . 1 . 2 .]" 1
599 1 33 ARG HB2 1 36 ILE H 0.000 . 3.310 2.411 2.095 2.834 . 0 0 "[ . 1 . 2 .]" 1
600 1 33 ARG HB3 1 36 ILE H 0.000 . 4.100 3.306 2.962 3.736 . 0 0 "[ . 1 . 2 .]" 1
601 1 33 ARG HB2 1 39 ALA MB 0.000 . 3.880 3.000 2.496 3.258 . 0 0 "[ . 1 . 2 .]" 1
602 1 33 ARG HB3 1 36 ILE MG 0.000 . 5.500 5.569 5.333 5.653 0.153 24 0 "[ . 1 . 2 .]" 1
603 1 33 ARG HB3 1 39 ALA MB 0.000 . 4.870 4.357 3.906 4.617 . 0 0 "[ . 1 . 2 .]" 1
604 1 33 ARG HG2 1 131 PHE QD 0.000 . 5.480 4.393 3.846 5.195 . 0 0 "[ . 1 . 2 .]" 1
605 1 33 ARG HG3 1 131 PHE QD 0.000 . 5.480 4.097 3.576 4.838 . 0 0 "[ . 1 . 2 .]" 1
606 1 33 ARG QG 1 131 PHE QE 0.000 . 5.360 4.535 4.119 4.799 . 0 0 "[ . 1 . 2 .]" 1
607 1 33 ARG HD2 1 39 ALA MB 0.000 . 5.520 2.970 1.704 3.461 0.096 10 0 "[ . 1 . 2 .]" 1
608 1 33 ARG HD2 1 147 VAL HB 0.000 . 5.500 5.544 5.443 5.614 0.114 15 0 "[ . 1 . 2 .]" 1
609 1 33 ARG HD3 1 39 ALA MB 0.000 . 5.520 2.137 1.742 3.724 0.058 22 0 "[ . 1 . 2 .]" 1
610 1 33 ARG HD3 1 147 VAL HB 0.000 . 5.500 5.548 5.461 5.712 0.212 2 0 "[ . 1 . 2 .]" 1
611 1 33 ARG QD 1 36 ILE MG 0.000 . 5.500 3.888 3.579 4.309 . 0 0 "[ . 1 . 2 .]" 1
612 1 33 ARG QD 1 36 ILE MD 0.000 . 5.000 3.447 1.966 5.018 0.018 13 0 "[ . 1 . 2 .]" 1
613 1 34 LEU H 1 35 ASP H 0.000 . 3.560 3.171 2.802 3.653 0.093 1 0 "[ . 1 . 2 .]" 1
614 1 34 LEU H 1 36 ILE H 0.000 . 4.820 4.387 4.128 4.669 . 0 0 "[ . 1 . 2 .]" 1
615 1 34 LEU H 1 131 PHE HA 0.000 . 3.420 2.752 2.484 3.020 . 0 0 "[ . 1 . 2 .]" 1
616 1 34 LEU H 1 131 PHE QD 0.000 . 4.990 4.867 4.408 5.023 0.033 21 0 "[ . 1 . 2 .]" 1
617 1 34 LEU H 1 132 GLY H 0.000 . 3.950 2.892 2.652 3.109 . 0 0 "[ . 1 . 2 .]" 1
618 1 34 LEU HA 1 35 ASP H 0.000 . 3.340 3.147 2.598 3.516 0.176 9 0 "[ . 1 . 2 .]" 1
619 1 34 LEU HA 1 36 ILE H 0.000 . 4.820 4.386 4.214 4.560 . 0 0 "[ . 1 . 2 .]" 1
620 1 34 LEU HA 1 132 GLY H 0.000 . 4.540 3.088 2.822 3.405 . 0 0 "[ . 1 . 2 .]" 1
621 1 34 LEU HA 1 132 GLY HA3 0.000 . 3.420 2.437 2.281 2.660 . 0 0 "[ . 1 . 2 .]" 1
622 1 34 LEU HA 1 132 GLY HA2 0.000 . 3.420 3.590 3.488 3.661 0.241 21 0 "[ . 1 . 2 .]" 1
623 1 34 LEU HB2 1 131 PHE HA 0.000 . 5.280 4.607 4.249 5.367 0.087 19 0 "[ . 1 . 2 .]" 1
624 1 34 LEU HG 1 35 ASP H 0.000 . 5.190 4.689 4.073 4.823 . 0 0 "[ . 1 . 2 .]" 1
625 1 34 LEU HG 1 132 GLY QA 0.000 . 5.500 2.142 1.700 4.852 0.100 3 0 "[ . 1 . 2 .]" 1
626 1 34 LEU MD1 1 129 PRO HB2 0.000 . 3.420 2.000 1.654 2.342 0.146 14 0 "[ . 1 . 2 .]" 1
627 1 34 LEU MD1 1 129 PRO HB3 0.000 . 3.420 3.330 3.025 3.513 0.093 10 0 "[ . 1 . 2 .]" 1
628 1 34 LEU MD1 1 129 PRO HG2 0.000 . 3.080 1.731 1.413 2.129 0.387 11 0 "[ . 1 . 2 .]" 1
629 1 34 LEU MD1 1 129 PRO HG3 0.000 . 3.080 3.077 2.716 3.324 0.244 14 0 "[ . 1 . 2 .]" 1
630 1 34 LEU MD1 1 129 PRO QD 0.000 . 4.630 2.818 1.711 3.459 0.089 19 0 "[ . 1 . 2 .]" 1
631 1 34 LEU MD1 1 130 GLU HA 0.000 . 3.570 3.420 3.082 3.880 0.310 9 0 "[ . 1 . 2 .]" 1
632 1 34 LEU MD1 1 131 PHE H 0.000 . 4.540 2.995 2.598 3.695 . 0 0 "[ . 1 . 2 .]" 1
633 1 34 LEU MD1 1 131 PHE HA 0.000 . 5.500 2.901 2.392 4.143 . 0 0 "[ . 1 . 2 .]" 1
634 1 34 LEU MD1 1 131 PHE QD 0.000 . 5.480 4.681 4.328 5.656 0.176 9 0 "[ . 1 . 2 .]" 1
635 1 34 LEU MD1 1 132 GLY H 0.000 . 4.410 3.199 2.730 4.000 . 0 0 "[ . 1 . 2 .]" 1
636 1 34 LEU MD1 1 132 GLY HA3 0.000 . 3.420 3.598 3.426 3.657 0.237 9 0 "[ . 1 . 2 .]" 1
637 1 34 LEU MD1 1 132 GLY HA2 0.000 . 3.420 2.854 2.650 3.064 . 0 0 "[ . 1 . 2 .]" 1
638 1 34 LEU MD2 1 128 LYS QG 0.000 . 5.060 4.913 2.986 5.130 0.070 19 0 "[ . 1 . 2 .]" 1
639 1 34 LEU MD2 1 128 LYS QD 0.000 . 4.690 4.437 3.199 4.848 0.158 19 0 "[ . 1 . 2 .]" 1
640 1 34 LEU MD2 1 128 LYS QE 0.000 . 5.490 5.021 3.216 5.498 0.008 13 0 "[ . 1 . 2 .]" 1
641 1 34 LEU MD2 1 129 PRO QB 0.000 . 3.230 3.110 2.529 3.414 0.184 14 0 "[ . 1 . 2 .]" 1
642 1 34 LEU MD2 1 129 PRO QD 0.000 . 4.100 3.183 2.203 3.994 . 0 0 "[ . 1 . 2 .]" 1
643 1 34 LEU MD2 1 131 PHE HA 0.000 . 5.500 4.617 1.926 5.244 . 0 0 "[ . 1 . 2 .]" 1
644 1 34 LEU MD2 1 132 GLY H 0.000 . 4.440 3.923 1.920 4.372 . 0 0 "[ . 1 . 2 .]" 1
645 1 34 LEU MD2 1 132 GLY HA3 0.000 . 2.830 2.908 2.847 2.957 0.127 16 0 "[ . 1 . 2 .]" 1
646 1 34 LEU MD2 1 132 GLY HA2 0.000 . 2.830 2.501 2.222 2.876 0.046 19 0 "[ . 1 . 2 .]" 1
647 1 35 ASP H 1 36 ILE H 0.000 . 3.050 2.246 1.713 2.614 0.087 3 0 "[ . 1 . 2 .]" 1
648 1 36 ILE H 1 37 PRO QD 0.000 . 5.500 3.890 3.749 4.090 . 0 0 "[ . 1 . 2 .]" 1
649 1 36 ILE HA 1 37 PRO HD2 0.000 . 2.460 2.326 2.028 2.528 0.068 15 0 "[ . 1 . 2 .]" 1
650 1 36 ILE HA 1 37 PRO HD3 0.000 . 2.460 2.149 1.951 2.462 0.002 12 0 "[ . 1 . 2 .]" 1
651 1 36 ILE HB 1 37 PRO HD2 0.000 . 5.500 4.701 4.472 4.938 . 0 0 "[ . 1 . 2 .]" 1
652 1 36 ILE HB 1 37 PRO HD3 0.000 . 5.500 4.842 4.688 5.069 . 0 0 "[ . 1 . 2 .]" 1
653 1 36 ILE HB 1 39 ALA H 0.000 . 4.660 3.148 2.987 3.454 . 0 0 "[ . 1 . 2 .]" 1
654 1 36 ILE HB 1 39 ALA MB 0.000 . 4.160 1.755 1.618 1.875 0.182 23 0 "[ . 1 . 2 .]" 1
655 1 36 ILE MG 1 37 PRO QG 0.000 . 4.380 4.137 3.690 4.457 0.077 8 0 "[ . 1 . 2 .]" 1
656 1 36 ILE MG 1 37 PRO HD2 0.000 . 3.850 2.628 2.265 2.918 . 0 0 "[ . 1 . 2 .]" 1
657 1 36 ILE MG 1 37 PRO HD3 0.000 . 3.850 3.574 3.397 3.843 . 0 0 "[ . 1 . 2 .]" 1
658 1 36 ILE MG 1 38 ASP H 0.000 . 3.540 2.426 1.996 3.363 . 0 0 "[ . 1 . 2 .]" 1
659 1 36 ILE MG 1 38 ASP QB 0.000 . 5.490 3.130 2.421 4.356 . 0 0 "[ . 1 . 2 .]" 1
660 1 36 ILE MG 1 39 ALA H 0.000 . 3.790 2.259 1.842 2.903 . 0 0 "[ . 1 . 2 .]" 1
661 1 36 ILE MG 1 39 ALA HA 0.000 . 5.220 3.434 3.238 3.828 . 0 0 "[ . 1 . 2 .]" 1
662 1 36 ILE MG 1 39 ALA MB 0.000 . 3.270 1.823 1.534 2.088 0.266 11 0 "[ . 1 . 2 .]" 1
663 1 37 PRO HB2 1 38 ASP H 0.000 . 3.550 3.077 1.985 3.622 0.072 20 0 "[ . 1 . 2 .]" 1
664 1 37 PRO HB3 1 38 ASP H 0.000 . 4.260 4.120 3.527 4.320 0.060 13 0 "[ . 1 . 2 .]" 1
665 1 37 PRO HD2 1 38 ASP H 0.000 . 5.500 2.590 2.400 2.865 . 0 0 "[ . 1 . 2 .]" 1
666 1 37 PRO HD3 1 38 ASP H 0.000 . 5.500 3.872 3.697 4.242 . 0 0 "[ . 1 . 2 .]" 1
667 1 38 ASP H 1 39 ALA H 0.000 . 2.870 2.448 2.285 2.830 . 0 0 "[ . 1 . 2 .]" 1
668 1 38 ASP H 1 39 ALA MB 0.000 . 5.650 3.994 3.790 4.367 . 0 0 "[ . 1 . 2 .]" 1
669 1 38 ASP HA 1 40 TRP HD1 0.000 . 5.500 3.300 3.027 3.583 . 0 0 "[ . 1 . 2 .]" 1
670 1 38 ASP HA 1 40 TRP HE1 0.000 . 4.320 3.554 3.368 3.871 . 0 0 "[ . 1 . 2 .]" 1
671 1 38 ASP QB 1 40 TRP HD1 0.000 . 5.500 4.577 4.262 5.121 . 0 0 "[ . 1 . 2 .]" 1
672 1 39 ALA HA 1 40 TRP H 0.000 . 2.990 2.195 2.134 2.244 . 0 0 "[ . 1 . 2 .]" 1
673 1 39 ALA HA 1 40 TRP HD1 0.000 . 4.260 4.281 4.126 4.353 0.093 1 0 "[ . 1 . 2 .]" 1
674 1 39 ALA HA 1 147 VAL HA 0.000 . 3.760 3.803 3.637 3.863 0.103 10 0 "[ . 1 . 2 .]" 1
675 1 39 ALA HA 1 147 VAL MG1 0.000 . 3.050 2.219 1.942 2.615 . 0 0 "[ . 1 . 2 .]" 1
676 1 39 ALA HA 1 147 VAL MG2 0.000 . 4.750 4.595 4.350 4.746 . 0 0 "[ . 1 . 2 .]" 1
677 1 39 ALA MB 1 146 THR HA 0.000 . 5.650 4.648 4.240 5.001 . 0 0 "[ . 1 . 2 .]" 1
678 1 39 ALA MB 1 147 VAL H 0.000 . 5.060 4.166 3.798 4.511 . 0 0 "[ . 1 . 2 .]" 1
679 1 39 ALA MB 1 147 VAL HA 0.000 . 4.440 4.005 3.743 4.257 . 0 0 "[ . 1 . 2 .]" 1
680 1 39 ALA MB 1 147 VAL HB 0.000 . 4.690 3.955 3.668 4.146 . 0 0 "[ . 1 . 2 .]" 1
681 1 39 ALA MB 1 147 VAL MG1 0.000 . 3.290 1.751 1.661 1.868 0.139 10 0 "[ . 1 . 2 .]" 1
682 1 39 ALA MB 1 147 VAL MG2 0.000 . 3.820 3.629 3.419 3.803 . 0 0 "[ . 1 . 2 .]" 1
683 1 39 ALA MB 1 149 PHE QD 0.000 . 5.630 5.412 4.993 5.746 0.116 23 0 "[ . 1 . 2 .]" 1
684 1 40 TRP H 1 147 VAL MG1 0.000 . 5.500 3.362 2.615 3.862 . 0 0 "[ . 1 . 2 .]" 1
685 1 40 TRP HA 1 41 GLN H 0.000 . 3.390 2.291 2.197 2.407 . 0 0 "[ . 1 . 2 .]" 1
686 1 40 TRP HB2 1 145 LEU HB3 0.000 . 5.500 2.331 2.216 2.532 . 0 0 "[ . 1 . 2 .]" 1
687 1 40 TRP HB2 1 146 THR HA 0.000 . 4.040 2.461 2.137 2.743 . 0 0 "[ . 1 . 2 .]" 1
688 1 40 TRP HB2 1 146 THR MG 0.000 . 5.500 4.725 4.554 4.853 . 0 0 "[ . 1 . 2 .]" 1
689 1 40 TRP HB3 1 41 GLN H 0.000 . 5.350 2.818 2.430 3.122 . 0 0 "[ . 1 . 2 .]" 1
690 1 40 TRP HB3 1 142 LEU HG 0.000 . 4.380 4.367 4.205 4.505 0.125 7 0 "[ . 1 . 2 .]" 1
691 1 40 TRP HB3 1 145 LEU HB2 0.000 . 4.230 3.870 3.620 4.039 . 0 0 "[ . 1 . 2 .]" 1
692 1 40 TRP HB3 1 145 LEU MD1 0.000 . 5.190 4.997 4.659 5.153 . 0 0 "[ . 1 . 2 .]" 1
693 1 40 TRP HB3 1 145 LEU MD2 0.000 . 4.820 4.322 4.112 4.480 . 0 0 "[ . 1 . 2 .]" 1
694 1 40 TRP HD1 1 145 LEU HA 0.000 . 5.500 3.780 3.549 3.938 . 0 0 "[ . 1 . 2 .]" 1
695 1 40 TRP HD1 1 145 LEU HB2 0.000 . 5.500 4.097 3.778 4.320 . 0 0 "[ . 1 . 2 .]" 1
696 1 40 TRP HD1 1 145 LEU HB3 0.000 . 5.500 2.366 2.066 2.588 . 0 0 "[ . 1 . 2 .]" 1
697 1 40 TRP HD1 1 145 LEU HG 0.000 . 5.500 4.351 4.242 4.501 . 0 0 "[ . 1 . 2 .]" 1
698 1 40 TRP HD1 1 145 LEU MD1 0.000 . 5.500 4.772 4.475 5.006 . 0 0 "[ . 1 . 2 .]" 1
699 1 40 TRP HD1 1 145 LEU MD2 0.000 . 3.820 2.497 2.152 2.823 . 0 0 "[ . 1 . 2 .]" 1
700 1 40 TRP HE3 1 41 GLN H 0.000 . 5.500 3.085 2.809 3.299 . 0 0 "[ . 1 . 2 .]" 1
701 1 40 TRP HE3 1 134 TRP HA . . 5.500 3.611 3.558 3.685 . 0 0 "[ . 1 . 2 .]" 1
702 1 40 TRP HE3 1 135 SER H 0.000 . 5.500 3.757 3.689 3.871 . 0 0 "[ . 1 . 2 .]" 1
703 1 40 TRP HE1 1 133 GLU QB 0.000 . 5.500 5.617 5.531 5.686 0.186 5 0 "[ . 1 . 2 .]" 1
704 1 40 TRP HE1 1 145 LEU HG 0.000 . 5.410 5.277 5.059 5.399 . 0 0 "[ . 1 . 2 .]" 1
705 1 40 TRP HE1 1 145 LEU MD1 0.000 . 5.470 5.190 4.802 5.442 . 0 0 "[ . 1 . 2 .]" 1
706 1 40 TRP HE1 1 145 LEU MD2 0.000 . 5.400 2.627 2.343 2.804 . 0 0 "[ . 1 . 2 .]" 1
707 1 40 TRP HZ3 1 133 GLU QG 0.000 . 5.500 5.406 5.049 5.532 0.032 18 0 "[ . 1 . 2 .]" 1
708 1 40 TRP HZ3 1 134 TRP HA 0.000 . 3.980 1.792 1.606 1.889 0.194 11 0 "[ . 1 . 2 .]" 1
709 1 40 TRP HZ3 1 135 SER H 0.000 . 3.580 1.825 1.722 1.886 0.078 10 0 "[ . 1 . 2 .]" 1
710 1 40 TRP HZ3 1 135 SER HB2 0.000 . 4.000 3.397 3.247 3.761 . 0 0 "[ . 1 . 2 .]" 1
711 1 40 TRP HZ3 1 135 SER HB3 0.000 . 5.460 2.868 2.572 3.089 . 0 0 "[ . 1 . 2 .]" 1
712 1 40 TRP HZ2 1 133 GLU HB2 0.000 . 5.410 5.148 3.693 5.475 0.065 6 0 "[ . 1 . 2 .]" 1
713 1 40 TRP HZ2 1 133 GLU HB3 0.000 . 5.410 4.119 3.727 5.354 . 0 0 "[ . 1 . 2 .]" 1
714 1 40 TRP HZ2 1 133 GLU QG 0.000 . 5.500 4.387 3.304 4.879 . 0 0 "[ . 1 . 2 .]" 1
715 1 40 TRP HZ2 1 135 SER HB2 0.000 . 3.790 3.880 3.843 3.932 0.142 7 0 "[ . 1 . 2 .]" 1
716 1 40 TRP HZ2 1 135 SER HB3 0.000 . 4.220 4.181 3.868 4.293 0.073 20 0 "[ . 1 . 2 .]" 1
717 1 40 TRP HH2 1 133 GLU HB2 0.000 . 5.500 4.935 3.148 5.460 . 0 0 "[ . 1 . 2 .]" 1
718 1 40 TRP HH2 1 133 GLU HB3 0.000 . 5.500 3.736 3.230 5.119 . 0 0 "[ . 1 . 2 .]" 1
719 1 40 TRP HH2 1 133 GLU QG 0.000 . 5.370 3.914 3.373 4.405 . 0 0 "[ . 1 . 2 .]" 1
720 1 40 TRP HH2 1 135 SER HB2 0.000 . 5.500 2.239 2.066 2.573 . 0 0 "[ . 1 . 2 .]" 1
721 1 40 TRP HH2 1 135 SER HB3 0.000 . 5.500 2.855 2.624 2.991 . 0 0 "[ . 1 . 2 .]" 1
722 1 41 GLN H 1 142 LEU MD1 0.000 . 5.500 3.503 2.260 4.228 . 0 0 "[ . 1 . 2 .]" 1
723 1 41 GLN HA 1 42 MET H 0.000 . 3.420 2.636 2.305 3.278 . 0 0 "[ . 1 . 2 .]" 1
724 1 41 GLN HA 1 142 LEU MD1 0.000 . 5.370 2.901 2.226 3.746 . 0 0 "[ . 1 . 2 .]" 1
725 1 41 GLN HA 1 142 LEU MD2 0.000 . 5.500 3.755 2.714 4.306 . 0 0 "[ . 1 . 2 .]" 1
726 1 41 GLN HA 1 146 THR MG 0.000 . 5.500 4.369 4.077 4.608 . 0 0 "[ . 1 . 2 .]" 1
727 1 41 GLN HA 1 154 TYR QD 0.000 . 5.500 3.770 3.392 4.070 . 0 0 "[ . 1 . 2 .]" 1
728 1 41 GLN HA 1 154 TYR QE 0.000 . 3.480 1.828 1.690 1.982 0.110 20 0 "[ . 1 . 2 .]" 1
729 1 41 GLN HB2 1 42 MET H 0.000 . 2.870 2.746 1.457 3.221 0.351 11 0 "[ . 1 . 2 .]" 1
730 1 41 GLN HB2 1 131 PHE QE 0.000 . 5.480 3.892 2.953 4.863 . 0 0 "[ . 1 . 2 .]" 1
731 1 41 GLN HB3 1 42 MET H 0.000 . 2.870 2.402 1.415 3.109 0.385 18 0 "[ . 1 . 2 .]" 1
732 1 41 GLN HB3 1 131 PHE QE 0.000 . 5.480 5.002 3.827 5.542 0.062 10 0 "[ . 1 . 2 .]" 1
733 1 42 MET H 1 154 TYR QE 0.000 . 5.490 2.650 1.957 3.853 . 0 0 "[ . 1 . 2 .]" 1
734 1 42 MET HA 1 43 PRO HD2 0.000 . 3.520 2.324 2.089 2.864 . 0 0 "[ . 1 . 2 .]" 1
735 1 42 MET HA 1 43 PRO HD3 0.000 . 3.520 2.605 2.079 2.820 . 0 0 "[ . 1 . 2 .]" 1
736 1 42 MET HA 1 142 LEU MD2 0.000 . 5.280 4.552 3.430 5.065 . 0 0 "[ . 1 . 2 .]" 1
737 1 42 MET HB2 1 107 TRP HH2 0.000 . 5.500 3.524 1.990 5.492 . 0 0 "[ . 1 . 2 .]" 1
738 1 42 MET HB3 1 107 TRP HH2 0.000 . 5.500 3.696 1.935 5.547 0.047 15 0 "[ . 1 . 2 .]" 1
739 1 42 MET QB 1 43 PRO QD 0.000 . 5.490 2.196 1.686 3.247 0.114 18 0 "[ . 1 . 2 .]" 1
740 1 42 MET QB 1 142 LEU MD2 0.000 . 2.890 2.885 2.566 3.032 0.142 19 0 "[ . 1 . 2 .]" 1
741 1 42 MET ME 1 107 TRP HZ3 0.000 . 3.070 2.545 1.970 3.008 . 0 0 "[ . 1 . 2 .]" 1
742 1 42 MET ME 1 107 TRP HZ2 0.000 . 4.500 3.962 3.422 4.503 0.003 9 0 "[ . 1 . 2 .]" 1
743 1 42 MET ME 1 107 TRP HH2 0.000 . 3.010 2.867 2.315 3.106 0.096 15 0 "[ . 1 . 2 .]" 1
744 1 42 MET ME 1 154 TYR HA 0.000 . 4.040 3.027 2.357 3.651 . 0 0 "[ . 1 . 2 .]" 1
745 1 42 MET ME 1 154 TYR QD 0.000 . 3.730 2.623 2.284 3.212 . 0 0 "[ . 1 . 2 .]" 1
746 1 42 MET ME 1 154 TYR QE 0.000 . 3.500 3.145 2.495 3.560 0.060 5 0 "[ . 1 . 2 .]" 1
747 1 42 MET ME 1 157 VAL HB 0.000 . 5.650 3.364 2.921 3.981 . 0 0 "[ . 1 . 2 .]" 1
748 1 42 MET ME 1 157 VAL MG1 0.000 . 3.630 3.026 2.282 3.532 . 0 0 "[ . 1 . 2 .]" 1
749 1 42 MET ME 1 157 VAL MG2 0.000 . 5.150 3.368 2.488 3.938 . 0 0 "[ . 1 . 2 .]" 1
750 1 43 PRO HA 1 44 GLN H 0.000 . 2.740 2.227 2.121 2.343 . 0 0 "[ . 1 . 2 .]" 1
751 1 43 PRO HA 1 131 PHE HZ 0.000 . 2.900 2.528 1.955 2.958 0.058 2 0 "[ . 1 . 2 .]" 1
752 1 43 PRO QB 1 131 PHE HZ 0.000 . 4.570 3.899 3.336 4.400 . 0 0 "[ . 1 . 2 .]" 1
753 1 43 PRO QG 1 61 LEU MD1 0.000 . 4.690 1.932 1.702 2.331 0.098 4 0 "[ . 1 . 2 .]" 1
754 1 43 PRO QG 1 65 THR MG 0.000 . 4.380 3.544 2.040 4.181 . 0 0 "[ . 1 . 2 .]" 1
755 1 43 PRO QG 1 131 PHE HZ 0.000 . 5.500 5.219 3.684 5.569 0.069 9 0 "[ . 1 . 2 .]" 1
756 1 44 GLN H 1 131 PHE HZ 0.000 . 5.440 3.405 2.804 4.016 . 0 0 "[ . 1 . 2 .]" 1
757 1 44 GLN HA 1 45 GLY H 0.000 . 2.900 2.345 2.206 2.613 . 0 0 "[ . 1 . 2 .]" 1
758 1 44 GLN QG 1 45 GLY H 0.000 . 4.320 3.508 2.103 4.350 0.030 1 0 "[ . 1 . 2 .]" 1
759 1 45 GLY QA 1 46 GLY H 0.000 . 3.000 2.252 2.191 2.325 . 0 0 "[ . 1 . 2 .]" 1
760 1 46 GLY H 1 47 ILE H 0.000 . 4.540 4.241 2.507 4.573 0.033 8 0 "[ . 1 . 2 .]" 1
761 1 47 ILE HA 1 48 ASP H 0.000 . 2.680 2.227 2.153 2.273 . 0 0 "[ . 1 . 2 .]" 1
762 1 47 ILE HA 1 56 ALA MB 0.000 . 3.380 2.204 1.778 2.705 0.022 18 0 "[ . 1 . 2 .]" 1
763 1 47 ILE HB 1 48 ASP H 0.000 . 5.280 3.869 3.789 4.083 . 0 0 "[ . 1 . 2 .]" 1
764 1 47 ILE MG 1 48 ASP H 0.000 . 3.230 2.216 1.953 2.662 . 0 0 "[ . 1 . 2 .]" 1
765 1 47 ILE MG 1 48 ASP QB 0.000 . 5.500 3.541 3.313 4.171 . 0 0 "[ . 1 . 2 .]" 1
766 1 47 ILE MG 1 51 GLU H 0.000 . 3.920 2.785 2.436 3.500 . 0 0 "[ . 1 . 2 .]" 1
767 1 47 ILE MG 1 51 GLU QB 0.000 . 5.100 2.155 1.948 2.594 . 0 0 "[ . 1 . 2 .]" 1
768 1 47 ILE MG 1 51 GLU HG2 0.000 . 5.500 3.680 3.087 4.260 . 0 0 "[ . 1 . 2 .]" 1
769 1 47 ILE MG 1 51 GLU HG3 0.000 . 5.500 3.489 3.054 3.999 . 0 0 "[ . 1 . 2 .]" 1
770 1 47 ILE MG 1 52 ASP HA 0.000 . 5.500 3.716 3.371 3.898 . 0 0 "[ . 1 . 2 .]" 1
771 1 47 ILE MG 1 53 PRO QG 0.000 . 4.470 3.972 3.300 4.488 0.018 15 0 "[ . 1 . 2 .]" 1
772 1 47 ILE MG 1 53 PRO HD2 0.000 . 5.500 5.119 4.609 5.458 . 0 0 "[ . 1 . 2 .]" 1
773 1 47 ILE MG 1 53 PRO HD3 0.000 . 5.500 4.186 3.669 4.652 . 0 0 "[ . 1 . 2 .]" 1
774 1 47 ILE MG 1 56 ALA H 0.000 . 4.200 3.983 3.624 4.218 0.018 5 0 "[ . 1 . 2 .]" 1
775 1 47 ILE MG 1 56 ALA HA 0.000 . 4.570 4.568 4.355 4.644 0.074 12 0 "[ . 1 . 2 .]" 1
776 1 47 ILE MG 1 56 ALA MB 0.000 . 3.200 2.282 2.114 2.386 . 0 0 "[ . 1 . 2 .]" 1
777 1 47 ILE MG 1 79 TRP HH2 0.000 . 5.440 3.997 3.673 4.294 . 0 0 "[ . 1 . 2 .]" 1
778 1 47 ILE QG 1 48 ASP H 0.000 . 5.350 4.183 4.048 4.509 . 0 0 "[ . 1 . 2 .]" 1
779 1 47 ILE QG 1 56 ALA MB 0.000 . 3.040 2.201 2.026 2.487 . 0 0 "[ . 1 . 2 .]" 1
780 1 47 ILE MD 1 53 PRO HA 0.000 . 2.710 2.383 1.847 2.771 0.061 22 0 "[ . 1 . 2 .]" 1
781 1 47 ILE MD 1 53 PRO HG2 0.000 . 5.500 4.047 3.583 4.652 . 0 0 "[ . 1 . 2 .]" 1
782 1 47 ILE MD 1 53 PRO HG3 0.000 . 5.500 2.811 2.275 3.520 . 0 0 "[ . 1 . 2 .]" 1
783 1 47 ILE MD 1 79 TRP HZ3 0.000 . 4.600 2.103 1.827 2.763 . 0 0 "[ . 1 . 2 .]" 1
784 1 47 ILE MD 1 79 TRP HZ2 0.000 . 4.350 3.870 3.533 4.346 . 0 0 "[ . 1 . 2 .]" 1
785 1 47 ILE MD 1 79 TRP HH2 0.000 . 2.740 1.958 1.751 2.474 0.049 7 0 "[ . 1 . 2 .]" 1
786 1 47 ILE MD 1 106 LYS H 0.000 . 5.500 3.808 3.305 4.258 . 0 0 "[ . 1 . 2 .]" 1
787 1 48 ASP H 1 49 GLU H 0.000 . 4.850 4.510 4.474 4.581 . 0 0 "[ . 1 . 2 .]" 1
788 1 48 ASP H 1 51 GLU H 0.000 . 4.730 4.087 3.752 4.290 . 0 0 "[ . 1 . 2 .]" 1
789 1 48 ASP H 1 51 GLU HB2 0.000 . 3.860 3.428 2.507 3.797 . 0 0 "[ . 1 . 2 .]" 1
790 1 48 ASP H 1 51 GLU HB3 0.000 . 3.860 2.385 2.106 2.526 . 0 0 "[ . 1 . 2 .]" 1
791 1 48 ASP H 1 51 GLU HG2 0.000 . 5.500 3.634 3.141 4.413 . 0 0 "[ . 1 . 2 .]" 1
792 1 48 ASP H 1 51 GLU HG3 0.000 . 5.500 4.434 3.357 4.769 . 0 0 "[ . 1 . 2 .]" 1
793 1 48 ASP H 1 56 ALA MB 0.000 . 3.910 3.322 2.806 3.952 0.042 2 0 "[ . 1 . 2 .]" 1
794 1 48 ASP HA 1 49 GLU H 0.000 . 2.620 2.637 2.448 2.697 0.077 24 0 "[ . 1 . 2 .]" 1
795 1 48 ASP HB2 1 49 GLU H 0.000 . 2.960 2.944 2.861 3.058 0.098 9 0 "[ . 1 . 2 .]" 1
796 1 48 ASP HB3 1 49 GLU H 0.000 . 2.960 2.097 2.029 2.458 . 0 0 "[ . 1 . 2 .]" 1
797 1 48 ASP QB 1 51 GLU H 0.000 . 3.390 3.348 3.055 3.435 0.045 11 0 "[ . 1 . 2 .]" 1
798 1 48 ASP QB 1 51 GLU QB 0.000 . 5.050 2.001 1.789 2.112 0.011 23 0 "[ . 1 . 2 .]" 1
799 1 48 ASP QB 1 51 GLU QG 0.000 . 4.130 3.518 3.218 3.828 . 0 0 "[ . 1 . 2 .]" 1
800 1 49 GLU H 1 50 GLY H 0.000 . 4.450 3.220 2.898 3.425 . 0 0 "[ . 1 . 2 .]" 1
801 1 49 GLU H 1 51 GLU H 0.000 . 4.910 4.542 4.212 4.790 . 0 0 "[ . 1 . 2 .]" 1
802 1 49 GLU HB2 1 50 GLY H 0.000 . 4.910 2.802 1.897 3.419 . 0 0 "[ . 1 . 2 .]" 1
803 1 49 GLU HB3 1 50 GLY H 0.000 . 4.910 2.587 1.775 3.979 0.025 12 0 "[ . 1 . 2 .]" 1
804 1 49 GLU QG 1 50 GLY H 0.000 . 5.500 3.372 1.584 4.317 0.216 24 0 "[ . 1 . 2 .]" 1
805 1 50 GLY H 1 51 GLU H 0.000 . 3.450 3.162 2.795 3.279 . 0 0 "[ . 1 . 2 .]" 1
806 1 51 GLU H 1 52 ASP H 0.000 . 4.480 4.483 4.350 4.512 0.032 24 0 "[ . 1 . 2 .]" 1
807 1 51 GLU HA 1 52 ASP H 0.000 . 2.400 2.274 2.175 2.336 . 0 0 "[ . 1 . 2 .]" 1
808 1 51 GLU HB2 1 52 ASP H 0.000 . 4.880 4.066 3.896 4.464 . 0 0 "[ . 1 . 2 .]" 1
809 1 51 GLU HB3 1 52 ASP H 0.000 . 4.880 3.770 3.589 4.077 . 0 0 "[ . 1 . 2 .]" 1
810 1 51 GLU HG2 1 52 ASP H 0.000 . 4.690 3.812 2.974 4.683 . 0 0 "[ . 1 . 2 .]" 1
811 1 51 GLU HG2 1 56 ALA MB 0.000 . 3.850 3.424 2.598 4.013 0.163 2 0 "[ . 1 . 2 .]" 1
812 1 51 GLU HG3 1 52 ASP H 0.000 . 4.690 2.291 1.945 4.609 . 0 0 "[ . 1 . 2 .]" 1
813 1 51 GLU HG3 1 56 ALA MB 0.000 . 3.850 3.503 2.761 4.018 0.168 2 0 "[ . 1 . 2 .]" 1
814 1 51 GLU QG 1 55 ASN QB 0.000 . 4.230 2.846 2.274 3.884 . 0 0 "[ . 1 . 2 .]" 1
815 1 51 GLU QG 1 56 ALA H 0.000 . 5.500 3.528 3.090 4.479 . 0 0 "[ . 1 . 2 .]" 1
816 1 52 ASP H 1 55 ASN HD21 0.000 . 5.500 3.806 2.834 5.246 . 0 0 "[ . 1 . 2 .]" 1
817 1 52 ASP H 1 55 ASN HD22 0.000 . 5.500 4.568 1.680 5.477 0.120 23 0 "[ . 1 . 2 .]" 1
818 1 52 ASP HA 1 53 PRO HG2 0.000 . 5.500 4.582 4.449 4.827 . 0 0 "[ . 1 . 2 .]" 1
819 1 52 ASP HA 1 53 PRO HG3 0.000 . 5.500 3.930 3.841 4.132 . 0 0 "[ . 1 . 2 .]" 1
820 1 52 ASP HA 1 53 PRO HD2 0.000 . 3.980 3.107 2.697 3.406 . 0 0 "[ . 1 . 2 .]" 1
821 1 52 ASP HA 1 53 PRO HD3 0.000 . 3.980 1.965 1.842 2.169 . 0 0 "[ . 1 . 2 .]" 1
822 1 52 ASP HB2 1 55 ASN H 0.000 . 3.760 3.182 2.626 3.625 . 0 0 "[ . 1 . 2 .]" 1
823 1 52 ASP HB3 1 55 ASN H 0.000 . 3.760 2.992 2.372 3.721 . 0 0 "[ . 1 . 2 .]" 1
824 1 52 ASP QB 1 53 PRO QD 0.000 . 5.500 2.323 1.973 2.833 . 0 0 "[ . 1 . 2 .]" 1
825 1 52 ASP QB 1 54 ARG H 0.000 . 3.800 3.056 2.893 3.208 . 0 0 "[ . 1 . 2 .]" 1
826 1 52 ASP QB 1 55 ASN QD 0.000 . 5.500 2.251 1.749 3.721 0.051 16 0 "[ . 1 . 2 .]" 1
827 1 53 PRO HA 1 55 ASN H 0.000 . 4.410 4.493 4.420 4.665 0.255 23 0 "[ . 1 . 2 .]" 1
828 1 53 PRO HA 1 56 ALA MB 0.000 . 2.920 2.577 2.431 2.817 . 0 0 "[ . 1 . 2 .]" 1
829 1 53 PRO HA 1 57 ALA H 0.000 . 3.760 3.818 3.742 3.921 0.161 3 0 "[ . 1 . 2 .]" 1
830 1 53 PRO HA 1 108 PHE QE 0.000 . 5.480 3.697 3.440 4.142 . 0 0 "[ . 1 . 2 .]" 1
831 1 53 PRO HB2 1 54 ARG H 0.000 . 3.800 2.442 2.347 2.567 . 0 0 "[ . 1 . 2 .]" 1
832 1 53 PRO HB2 1 55 ASN H 0.000 . 5.310 4.973 4.884 5.087 . 0 0 "[ . 1 . 2 .]" 1
833 1 53 PRO HB2 1 108 PHE QE 0.000 . 4.440 2.137 2.035 2.255 . 0 0 "[ . 1 . 2 .]" 1
834 1 53 PRO HB3 1 54 ARG H 0.000 . 3.610 3.803 3.764 3.836 0.226 25 0 "[ . 1 . 2 .]" 1
835 1 53 PRO HB3 1 108 PHE QE 0.000 . 4.910 2.932 2.417 3.334 . 0 0 "[ . 1 . 2 .]" 1
836 1 53 PRO HG2 1 79 TRP HZ2 0.000 . 5.500 3.292 2.313 4.376 . 0 0 "[ . 1 . 2 .]" 1
837 1 53 PRO HG3 1 79 TRP HZ2 0.000 . 5.500 2.714 2.345 3.496 . 0 0 "[ . 1 . 2 .]" 1
838 1 53 PRO QG 1 54 ARG H 0.000 . 4.480 3.236 2.669 3.654 . 0 0 "[ . 1 . 2 .]" 1
839 1 53 PRO QG 1 108 PHE QE 0.000 . 5.300 3.856 3.730 3.934 . 0 0 "[ . 1 . 2 .]" 1
840 1 53 PRO QG 1 108 PHE HZ 0.000 . 5.030 2.923 2.558 3.281 . 0 0 "[ . 1 . 2 .]" 1
841 1 53 PRO HD2 1 54 ARG H 0.000 . 4.730 2.148 1.876 2.732 . 0 0 "[ . 1 . 2 .]" 1
842 1 53 PRO HD2 1 108 PHE QE 0.000 . 5.480 4.484 4.288 4.690 . 0 0 "[ . 1 . 2 .]" 1
843 1 53 PRO HD3 1 54 ARG H 0.000 . 4.730 3.664 3.456 4.034 . 0 0 "[ . 1 . 2 .]" 1
844 1 53 PRO HD3 1 108 PHE QE 0.000 . 5.480 5.582 5.547 5.660 0.180 15 0 "[ . 1 . 2 .]" 1
845 1 54 ARG H 1 55 ASN H 0.000 . 3.080 2.840 2.743 3.037 . 0 0 "[ . 1 . 2 .]" 1
846 1 54 ARG H 1 108 PHE QE 0.000 . 4.300 3.330 3.185 3.565 . 0 0 "[ . 1 . 2 .]" 1
847 1 54 ARG HA 1 57 ALA H 0.000 . 3.550 3.563 3.279 3.637 0.087 18 0 "[ . 1 . 2 .]" 1
848 1 54 ARG HA 1 57 ALA MB 0.000 . 2.670 2.553 2.317 2.728 0.058 15 0 "[ . 1 . 2 .]" 1
849 1 54 ARG HA 1 58 ILE H 0.000 . 5.310 4.019 3.554 4.266 . 0 0 "[ . 1 . 2 .]" 1
850 1 54 ARG HA 1 58 ILE MD 0.000 . 4.070 3.837 2.638 4.224 0.154 6 0 "[ . 1 . 2 .]" 1
851 1 54 ARG HA 1 108 PHE QE 0.000 . 3.310 2.946 2.783 3.233 . 0 0 "[ . 1 . 2 .]" 1
852 1 54 ARG HA 1 108 PHE HZ . . 3.550 3.224 3.020 3.430 . 0 0 "[ . 1 . 2 .]" 1
853 1 54 ARG HB2 1 55 ASN H 0.000 . 3.350 3.430 3.298 3.630 0.280 22 0 "[ . 1 . 2 .]" 1
854 1 54 ARG HB2 1 108 PHE QE 0.000 . 4.740 3.022 2.195 3.417 . 0 0 "[ . 1 . 2 .]" 1
855 1 54 ARG HB2 1 108 PHE HZ . . 3.300 3.127 2.897 3.344 0.044 6 0 "[ . 1 . 2 .]" 1
856 1 54 ARG HB3 1 55 ASN H 0.000 . 3.630 2.478 2.319 2.729 . 0 0 "[ . 1 . 2 .]" 1
857 1 54 ARG HB3 1 108 PHE QE 0.000 . 4.680 4.409 3.764 4.786 0.106 9 0 "[ . 1 . 2 .]" 1
858 1 54 ARG HG2 1 55 ASN H 0.000 . 5.500 4.878 4.484 5.092 . 0 0 "[ . 1 . 2 .]" 1
859 1 54 ARG HG2 1 72 VAL MG2 0.000 . 4.540 3.599 3.283 3.904 . 0 0 "[ . 1 . 2 .]" 1
860 1 54 ARG HG2 1 108 PHE QE 0.000 . 5.480 2.933 2.379 4.656 . 0 0 "[ . 1 . 2 .]" 1
861 1 54 ARG HG3 1 55 ASN H 0.000 . 5.500 4.759 3.843 5.067 . 0 0 "[ . 1 . 2 .]" 1
862 1 54 ARG HG3 1 72 VAL MG2 0.000 . 4.540 3.630 3.419 3.809 . 0 0 "[ . 1 . 2 .]" 1
863 1 54 ARG HG3 1 108 PHE QE 0.000 . 5.480 3.635 2.204 5.247 . 0 0 "[ . 1 . 2 .]" 1
864 1 54 ARG QG 1 55 ASN H 0.000 . 4.350 4.270 3.678 4.491 0.141 6 0 "[ . 1 . 2 .]" 1
865 1 54 ARG QG 1 72 VAL MG2 0.000 . 3.110 3.211 3.074 3.279 0.169 12 0 "[ . 1 . 2 .]" 1
866 1 54 ARG QD 1 58 ILE QG 0.000 . 2.400 2.505 2.329 2.726 0.326 3 0 "[ . 1 . 2 .]" 1
867 1 54 ARG QD 1 58 ILE MD 0.000 . 3.270 1.964 1.663 2.598 0.137 16 0 "[ . 1 . 2 .]" 1
868 1 54 ARG QD 1 72 VAL MG1 0.000 . 3.200 2.736 1.999 3.259 0.059 17 0 "[ . 1 . 2 .]" 1
869 1 54 ARG QD 1 72 VAL MG2 0.000 . 3.390 1.966 1.659 2.622 0.141 15 0 "[ . 1 . 2 .]" 1
870 1 54 ARG QD 1 108 PHE QE 0.000 . 4.090 4.006 2.851 4.279 0.189 6 0 "[ . 1 . 2 .]" 1
871 1 55 ASN H 1 56 ALA H 0.000 . 2.830 2.617 2.529 2.804 . 0 0 "[ . 1 . 2 .]" 1
872 1 55 ASN H 1 56 ALA MB 0.000 . 5.030 4.286 4.202 4.428 . 0 0 "[ . 1 . 2 .]" 1
873 1 55 ASN HA 1 58 ILE H 0.000 . 3.610 3.481 3.325 3.647 0.037 22 0 "[ . 1 . 2 .]" 1
874 1 55 ASN HA 1 58 ILE HB 0.000 . 3.020 2.834 2.417 2.973 . 0 0 "[ . 1 . 2 .]" 1
875 1 55 ASN HA 1 58 ILE MG 0.000 . 4.200 4.179 3.686 4.277 0.077 21 0 "[ . 1 . 2 .]" 1
876 1 55 ASN HA 1 58 ILE QG 0.000 . 4.380 3.535 3.140 4.217 . 0 0 "[ . 1 . 2 .]" 1
877 1 55 ASN HA 1 58 ILE MD 0.000 . 3.330 2.300 1.927 3.026 . 0 0 "[ . 1 . 2 .]" 1
878 1 55 ASN HA 1 59 ARG H 0.000 . 4.510 3.736 3.334 3.910 . 0 0 "[ . 1 . 2 .]" 1
879 1 55 ASN HB2 1 56 ALA H 0.000 . 3.920 2.697 2.440 3.893 . 0 0 "[ . 1 . 2 .]" 1
880 1 55 ASN HB3 1 56 ALA H 0.000 . 3.920 3.627 3.414 4.053 0.133 2 0 "[ . 1 . 2 .]" 1
881 1 55 ASN QB 1 56 ALA HA 0.000 . 4.820 3.888 3.708 4.442 . 0 0 "[ . 1 . 2 .]" 1
882 1 55 ASN QB 1 56 ALA MB 0.000 . 5.650 3.858 3.681 4.646 . 0 0 "[ . 1 . 2 .]" 1
883 1 55 ASN QB 1 58 ILE HB 0.000 . 5.470 4.389 4.139 4.611 . 0 0 "[ . 1 . 2 .]" 1
884 1 55 ASN QB 1 58 ILE MD 0.000 . 4.200 3.975 3.599 4.449 0.249 3 0 "[ . 1 . 2 .]" 1
885 1 55 ASN QB 1 59 ARG H 0.000 . 4.230 4.379 4.282 4.455 0.225 6 0 "[ . 1 . 2 .]" 1
886 1 56 ALA H 1 57 ALA H 0.000 . 2.930 2.633 2.539 2.692 . 0 0 "[ . 1 . 2 .]" 1
887 1 56 ALA HA 1 59 ARG H 0.000 . 3.520 3.598 3.528 3.689 0.169 3 0 "[ . 1 . 2 .]" 1
888 1 56 ALA HA 1 59 ARG QB 0.000 . 3.730 2.786 2.546 3.812 0.082 6 0 "[ . 1 . 2 .]" 1
889 1 56 ALA HA 1 60 GLU H 0.000 . 3.520 3.279 3.072 3.474 . 0 0 "[ . 1 . 2 .]" 1
890 1 56 ALA MB 1 57 ALA H 0.000 . 3.380 2.496 2.426 2.570 . 0 0 "[ . 1 . 2 .]" 1
891 1 56 ALA MB 1 57 ALA MB 0.000 . 4.400 3.738 3.627 3.816 . 0 0 "[ . 1 . 2 .]" 1
892 1 56 ALA MB 1 58 ILE H 0.000 . 5.650 4.696 4.564 4.820 . 0 0 "[ . 1 . 2 .]" 1
893 1 56 ALA MB 1 59 ARG H 0.000 . 5.650 4.752 4.685 4.800 . 0 0 "[ . 1 . 2 .]" 1
894 1 56 ALA MB 1 59 ARG QB 0.000 . 5.240 4.167 4.012 4.992 . 0 0 "[ . 1 . 2 .]" 1
895 1 56 ALA MB 1 60 GLU H 0.000 . 4.310 4.086 4.000 4.182 . 0 0 "[ . 1 . 2 .]" 1
896 1 56 ALA MB 1 108 PHE QE 0.000 . 5.630 4.624 4.444 4.983 . 0 0 "[ . 1 . 2 .]" 1
897 1 57 ALA H 1 58 ILE H 0.000 . 3.210 2.813 2.777 2.884 . 0 0 "[ . 1 . 2 .]" 1
898 1 57 ALA H 1 58 ILE MD 0.000 . 5.500 4.684 3.567 5.129 . 0 0 "[ . 1 . 2 .]" 1
899 1 57 ALA H 1 108 PHE QE 0.000 . 5.480 4.052 3.805 4.519 . 0 0 "[ . 1 . 2 .]" 1
900 1 57 ALA HA 1 60 GLU H 0.000 . 4.380 4.099 3.844 4.281 . 0 0 "[ . 1 . 2 .]" 1
901 1 57 ALA HA 1 60 GLU QG 0.000 . 4.510 3.928 2.132 4.520 0.010 17 0 "[ . 1 . 2 .]" 1
902 1 57 ALA MB 1 108 PHE QD 0.000 . 3.270 2.087 1.871 2.955 . 0 0 "[ . 1 . 2 .]" 1
903 1 57 ALA MB 1 108 PHE QE 0.000 . 3.520 2.892 2.391 3.245 . 0 0 "[ . 1 . 2 .]" 1
904 1 57 ALA MB 1 110 PHE QE 0.000 . 3.520 2.836 2.495 3.611 0.091 6 0 "[ . 1 . 2 .]" 1
905 1 57 ALA MB 1 110 PHE HZ 0.000 . 3.420 2.877 2.147 3.561 0.141 6 0 "[ . 1 . 2 .]" 1
906 1 58 ILE H 1 59 ARG H 0.000 . 3.240 2.865 2.772 2.923 . 0 0 "[ . 1 . 2 .]" 1
907 1 58 ILE H 1 110 PHE QE 0.000 . 5.480 4.160 3.247 4.916 . 0 0 "[ . 1 . 2 .]" 1
908 1 58 ILE H 1 110 PHE HZ 0.000 . 4.730 3.479 3.127 4.132 . 0 0 "[ . 1 . 2 .]" 1
909 1 58 ILE HA 1 61 LEU H 0.000 . 4.170 3.929 3.807 4.035 . 0 0 "[ . 1 . 2 .]" 1
910 1 58 ILE HA 1 61 LEU HB3 0.000 . 3.800 2.786 2.591 3.046 . 0 0 "[ . 1 . 2 .]" 1
911 1 58 ILE HA 1 61 LEU MD2 0.000 . 5.500 3.143 2.576 4.274 . 0 0 "[ . 1 . 2 .]" 1
912 1 58 ILE HA 1 110 PHE QE 0.000 . 4.710 3.465 2.385 4.008 . 0 0 "[ . 1 . 2 .]" 1
913 1 58 ILE HA 1 110 PHE HZ 0.000 . 3.950 3.795 3.347 4.049 0.099 19 0 "[ . 1 . 2 .]" 1
914 1 58 ILE HB 1 59 ARG H 0.000 . 2.590 2.361 2.221 2.641 0.051 23 0 "[ . 1 . 2 .]" 1
915 1 58 ILE MG 1 59 ARG H 0.000 . 3.640 3.352 3.135 3.470 . 0 0 "[ . 1 . 2 .]" 1
916 1 58 ILE MG 1 59 ARG HA 0.000 . 3.890 3.490 3.106 3.582 . 0 0 "[ . 1 . 2 .]" 1
917 1 58 ILE MG 1 61 LEU H 0.000 . 5.500 4.949 4.813 5.048 . 0 0 "[ . 1 . 2 .]" 1
918 1 58 ILE MG 1 61 LEU MD1 0.000 . 5.500 5.042 4.206 5.561 0.061 5 0 "[ . 1 . 2 .]" 1
919 1 58 ILE MG 1 110 PHE QE 0.000 . 5.140 3.271 2.662 4.386 . 0 0 "[ . 1 . 2 .]" 1
920 1 58 ILE MG 1 110 PHE HZ 0.000 . 4.750 4.286 3.805 4.907 0.157 16 0 "[ . 1 . 2 .]" 1
921 1 58 ILE HG12 1 110 PHE QE 0.000 . 5.480 2.210 1.557 4.044 0.243 2 0 "[ . 1 . 2 .]" 1
922 1 58 ILE HG12 1 110 PHE HZ 0.000 . 5.500 2.683 1.944 4.061 . 0 0 "[ . 1 . 2 .]" 1
923 1 58 ILE HG13 1 110 PHE QE 0.000 . 5.480 3.014 1.878 4.027 . 0 0 "[ . 1 . 2 .]" 1
924 1 58 ILE HG13 1 110 PHE HZ 0.000 . 5.500 2.276 1.940 3.078 . 0 0 "[ . 1 . 2 .]" 1
925 1 58 ILE QG 1 59 ARG H 0.000 . 4.540 3.986 3.770 4.492 . 0 0 "[ . 1 . 2 .]" 1
926 1 58 ILE QG 1 72 VAL MG2 0.000 . 5.350 3.042 2.714 3.679 . 0 0 "[ . 1 . 2 .]" 1
927 1 58 ILE MD 1 59 ARG H 0.000 . 5.500 4.064 3.812 4.344 . 0 0 "[ . 1 . 2 .]" 1
928 1 58 ILE MD 1 72 VAL MG2 0.000 . 4.320 2.780 1.929 3.581 . 0 0 "[ . 1 . 2 .]" 1
929 1 58 ILE MD 1 110 PHE QE 0.000 . 4.210 2.977 1.964 3.975 . 0 0 "[ . 1 . 2 .]" 1
930 1 58 ILE MD 1 110 PHE HZ 0.000 . 4.040 2.989 1.714 3.971 0.086 16 0 "[ . 1 . 2 .]" 1
931 1 59 ARG H 1 60 GLU H 0.000 . 3.270 2.922 2.842 2.993 . 0 0 "[ . 1 . 2 .]" 1
932 1 59 ARG H 1 61 LEU H 0.000 . 4.120 4.116 3.948 4.179 0.059 19 0 "[ . 1 . 2 .]" 1
933 1 59 ARG HA 1 62 ARG H 0.000 . 3.250 3.335 3.279 3.424 0.174 6 0 "[ . 1 . 2 .]" 1
934 1 59 ARG HA 1 62 ARG HB2 0.000 . 3.300 3.382 3.323 3.439 0.139 9 0 "[ . 1 . 2 .]" 1
935 1 60 GLU H 1 61 LEU H 0.000 . 3.240 2.872 2.789 2.947 . 0 0 "[ . 1 . 2 .]" 1
936 1 60 GLU HA 1 63 GLU H 0.000 . 3.760 3.729 3.619 3.799 0.039 21 0 "[ . 1 . 2 .]" 1
937 1 60 GLU HA 1 63 GLU HG2 0.000 . 4.970 4.593 4.230 4.861 . 0 0 "[ . 1 . 2 .]" 1
938 1 60 GLU HA 1 63 GLU HG3 0.000 . 4.970 3.487 3.023 4.841 . 0 0 "[ . 1 . 2 .]" 1
939 1 60 GLU HB2 1 61 LEU H 0.000 . 4.140 2.736 2.450 3.856 . 0 0 "[ . 1 . 2 .]" 1
940 1 60 GLU HB3 1 61 LEU H 0.000 . 4.140 3.335 2.762 3.919 . 0 0 "[ . 1 . 2 .]" 1
941 1 61 LEU H 1 62 ARG H 0.000 . 3.050 2.826 2.780 2.872 . 0 0 "[ . 1 . 2 .]" 1
942 1 61 LEU HA 1 64 GLU H 0.000 . 5.030 3.894 3.824 4.007 . 0 0 "[ . 1 . 2 .]" 1
943 1 61 LEU HB2 1 62 ARG H 0.000 . 4.660 3.866 3.573 4.001 . 0 0 "[ . 1 . 2 .]" 1
944 1 61 LEU HB3 1 62 ARG H 0.000 . 3.920 2.527 2.269 2.703 . 0 0 "[ . 1 . 2 .]" 1
945 1 61 LEU HG 1 62 ARG H 0.000 . 4.600 3.559 2.926 4.634 0.034 1 0 "[ . 1 . 2 .]" 1
946 1 61 LEU HG 1 67 VAL H 0.000 . 5.500 4.229 3.554 5.546 0.046 1 0 "[ . 1 . 2 .]" 1
947 1 61 LEU HG 1 67 VAL MG1 0.000 . 5.500 3.453 2.987 4.298 . 0 0 "[ . 1 . 2 .]" 1
948 1 61 LEU MD1 1 62 ARG H 0.000 . 5.500 4.302 3.685 4.649 . 0 0 "[ . 1 . 2 .]" 1
949 1 61 LEU MD1 1 68 THR HA 0.000 . 5.500 5.452 5.162 5.614 0.114 8 0 "[ . 1 . 2 .]" 1
950 1 61 LEU MD1 1 110 PHE QD 0.000 . 5.480 4.429 2.969 5.458 . 0 0 "[ . 1 . 2 .]" 1
951 1 61 LEU MD2 1 62 ARG H 0.000 . 4.690 3.538 2.472 4.205 . 0 0 "[ . 1 . 2 .]" 1
952 1 61 LEU MD2 1 67 VAL MG1 0.000 . 4.350 2.032 1.652 2.486 0.148 20 0 "[ . 1 . 2 .]" 1
953 1 61 LEU MD2 1 70 ALA MB 0.000 . 3.910 3.347 2.978 3.876 . 0 0 "[ . 1 . 2 .]" 1
954 1 61 LEU MD2 1 110 PHE HB2 0.000 . 5.500 4.242 3.489 5.306 . 0 0 "[ . 1 . 2 .]" 1
955 1 61 LEU MD2 1 110 PHE QD 0.000 . 5.260 3.804 2.195 5.357 0.097 19 0 "[ . 1 . 2 .]" 1
956 1 62 ARG H 1 63 GLU H 0.000 . 3.240 2.887 2.817 2.934 . 0 0 "[ . 1 . 2 .]" 1
957 1 62 ARG H 1 64 GLU H 0.000 . 4.940 3.876 3.810 3.937 . 0 0 "[ . 1 . 2 .]" 1
958 1 62 ARG HA 1 65 THR H 0.000 . 3.270 3.390 3.333 3.422 0.152 10 0 "[ . 1 . 2 .]" 1
959 1 62 ARG HA 1 66 GLY H 0.000 . 4.350 2.574 2.080 2.974 . 0 0 "[ . 1 . 2 .]" 1
960 1 62 ARG HA 1 68 THR MG 0.000 . 3.480 3.536 3.401 3.617 0.137 9 0 "[ . 1 . 2 .]" 1
961 1 62 ARG HB2 1 63 GLU H 0.000 . 3.550 3.496 3.333 3.580 0.030 10 0 "[ . 1 . 2 .]" 1
962 1 62 ARG HB2 1 68 THR MG 0.000 . 2.490 2.537 2.410 2.587 0.097 21 0 "[ . 1 . 2 .]" 1
963 1 62 ARG HB3 1 63 GLU H 0.000 . 5.500 2.043 1.982 2.087 . 0 0 "[ . 1 . 2 .]" 1
964 1 62 ARG HB3 1 68 THR MG 0.000 . 4.200 3.697 3.618 3.780 . 0 0 "[ . 1 . 2 .]" 1
965 1 62 ARG HG2 1 68 THR MG 0.000 . 3.450 2.830 1.767 3.220 0.033 6 0 "[ . 1 . 2 .]" 1
966 1 62 ARG HG3 1 68 THR MG 0.000 . 3.450 2.020 1.743 3.518 0.068 10 0 "[ . 1 . 2 .]" 1
967 1 62 ARG QG 1 63 GLU H 0.000 . 5.190 3.453 3.072 4.014 . 0 0 "[ . 1 . 2 .]" 1
968 1 62 ARG QG 1 63 GLU QG 0.000 . 4.250 3.918 3.244 4.349 0.099 21 0 "[ . 1 . 2 .]" 1
969 1 62 ARG QG 1 66 GLY QA 0.000 . 5.510 2.679 2.178 3.576 . 0 0 "[ . 1 . 2 .]" 1
970 1 62 ARG QD 1 68 THR MG 0.000 . 2.890 2.406 1.744 3.055 0.165 9 0 "[ . 1 . 2 .]" 1
971 1 63 GLU H 1 64 GLU H 0.000 . 3.500 2.860 2.806 2.906 . 0 0 "[ . 1 . 2 .]" 1
972 1 63 GLU HA 1 64 GLU H 0.000 . 3.330 3.449 3.430 3.461 0.131 18 0 "[ . 1 . 2 .]" 1
973 1 63 GLU QG 1 64 GLU H 0.000 . 5.070 4.153 4.002 4.428 . 0 0 "[ . 1 . 2 .]" 1
974 1 64 GLU H 1 65 THR H 0.000 . 3.020 2.366 2.311 2.442 . 0 0 "[ . 1 . 2 .]" 1
975 1 64 GLU H 1 65 THR MG 0.000 . 5.280 4.930 4.338 5.124 . 0 0 "[ . 1 . 2 .]" 1
976 1 64 GLU H 1 66 GLY H 0.000 . 4.140 3.471 3.357 3.929 . 0 0 "[ . 1 . 2 .]" 1
977 1 64 GLU HA 1 65 THR MG 0.000 . 5.500 4.552 4.338 4.772 . 0 0 "[ . 1 . 2 .]" 1
978 1 64 GLU HA 1 131 PHE HZ 0.000 . 5.500 5.394 5.071 5.623 0.123 7 0 "[ . 1 . 2 .]" 1
979 1 64 GLU HB2 1 65 THR H 0.000 . 3.580 2.855 2.734 3.020 . 0 0 "[ . 1 . 2 .]" 1
980 1 64 GLU HB2 1 65 THR MG 0.000 . 3.980 3.798 3.023 3.987 0.007 12 0 "[ . 1 . 2 .]" 1
981 1 64 GLU HB2 1 131 PHE HZ 0.000 . 5.500 3.955 3.672 4.299 . 0 0 "[ . 1 . 2 .]" 1
982 1 64 GLU HB3 1 65 THR H 0.000 . 4.290 3.658 3.416 3.812 . 0 0 "[ . 1 . 2 .]" 1
983 1 64 GLU HB3 1 65 THR MG 0.000 . 4.440 3.370 2.949 3.623 . 0 0 "[ . 1 . 2 .]" 1
984 1 64 GLU QG 1 65 THR MG 0.000 . 5.500 4.951 4.560 5.168 . 0 0 "[ . 1 . 2 .]" 1
985 1 65 THR H 1 66 GLY H 0.000 . 2.900 1.950 1.859 2.075 . 0 0 "[ . 1 . 2 .]" 1
986 1 65 THR H 1 67 VAL MG2 0.000 . 5.400 4.724 4.369 5.082 . 0 0 "[ . 1 . 2 .]" 1
987 1 65 THR HA 1 67 VAL MG2 0.000 . 4.820 4.518 4.209 4.890 0.070 19 0 "[ . 1 . 2 .]" 1
988 1 65 THR HA 1 119 ILE MG 0.000 . 4.600 3.219 2.933 3.492 . 0 0 "[ . 1 . 2 .]" 1
989 1 65 THR HA 1 120 ASN H 0.000 . 5.350 4.300 3.656 5.315 . 0 0 "[ . 1 . 2 .]" 1
990 1 65 THR HA 1 121 LEU HA 0.000 . 2.710 2.473 1.907 2.811 0.101 19 0 "[ . 1 . 2 .]" 1
991 1 65 THR HA 1 121 LEU MD2 0.000 . 2.680 2.463 1.979 2.773 0.093 18 0 "[ . 1 . 2 .]" 1
992 1 65 THR HB 1 66 GLY H 0.000 . 4.290 3.877 3.318 4.158 . 0 0 "[ . 1 . 2 .]" 1
993 1 65 THR HB 1 67 VAL H 0.000 . 3.580 2.838 2.676 3.075 . 0 0 "[ . 1 . 2 .]" 1
994 1 65 THR HB 1 67 VAL MG1 0.000 . 5.500 4.782 4.541 5.162 . 0 0 "[ . 1 . 2 .]" 1
995 1 65 THR HB 1 67 VAL MG2 0.000 . 3.270 2.381 2.030 2.728 . 0 0 "[ . 1 . 2 .]" 1
996 1 65 THR HB 1 119 ILE MG 0.000 . 3.730 2.052 1.725 2.449 0.075 18 0 "[ . 1 . 2 .]" 1
997 1 65 THR HB 1 119 ILE MD 0.000 . 3.700 3.771 3.632 3.865 0.165 1 0 "[ . 1 . 2 .]" 1
998 1 65 THR HB 1 121 LEU MD2 0.000 . 3.980 3.200 2.580 3.403 . 0 0 "[ . 1 . 2 .]" 1
999 1 65 THR MG 1 67 VAL H 0.000 . 5.000 4.259 4.162 4.375 . 0 0 "[ . 1 . 2 .]" 1
1000 1 65 THR MG 1 67 VAL MG2 0.000 . 3.510 3.343 3.103 3.565 0.055 10 0 "[ . 1 . 2 .]" 1
1001 1 65 THR MG 1 119 ILE MG 0.000 . 5.500 2.510 1.960 3.217 . 0 0 "[ . 1 . 2 .]" 1
1002 1 65 THR MG 1 119 ILE MD 0.000 . 5.280 3.859 3.618 4.362 . 0 0 "[ . 1 . 2 .]" 1
1003 1 65 THR MG 1 121 LEU MD1 0.000 . 3.760 3.836 3.610 3.960 0.200 9 0 "[ . 1 . 2 .]" 1
1004 1 65 THR MG 1 121 LEU MD2 0.000 . 2.980 1.800 1.679 1.935 0.121 25 0 "[ . 1 . 2 .]" 1
1005 1 66 GLY H 1 67 VAL H 0.000 . 3.490 2.648 2.238 2.852 . 0 0 "[ . 1 . 2 .]" 1
1006 1 66 GLY QA 1 67 VAL H 0.000 . 3.890 2.894 2.859 2.919 . 0 0 "[ . 1 . 2 .]" 1
1007 1 66 GLY QA 1 120 ASN H 0.000 . 3.730 3.036 2.067 3.790 0.060 16 0 "[ . 1 . 2 .]" 1
1008 1 66 GLY QA 1 120 ASN QB 0.000 . 5.500 4.005 2.864 5.163 . 0 0 "[ . 1 . 2 .]" 1
1009 1 67 VAL H 1 68 THR H 0.000 . 4.450 4.388 4.302 4.464 0.014 9 0 "[ . 1 . 2 .]" 1
1010 1 67 VAL HA 1 68 THR H 0.000 . 2.620 2.097 2.071 2.117 . 0 0 "[ . 1 . 2 .]" 1
1011 1 67 VAL HA 1 68 THR MG 0.000 . 4.850 4.511 4.289 4.610 . 0 0 "[ . 1 . 2 .]" 1
1012 1 67 VAL HA 1 69 SER H 0.000 . 3.560 3.668 3.613 3.712 0.152 11 0 "[ . 1 . 2 .]" 1
1013 1 67 VAL HA 1 112 PHE QD 0.000 . 5.330 4.528 4.289 4.709 . 0 0 "[ . 1 . 2 .]" 1
1014 1 67 VAL HA 1 118 GLU QG 0.000 . 3.080 3.062 2.861 3.326 0.246 16 0 "[ . 1 . 2 .]" 1
1015 1 67 VAL HA 1 119 ILE MD 0.000 . 5.500 4.619 4.283 4.911 . 0 0 "[ . 1 . 2 .]" 1
1016 1 67 VAL MG1 1 68 THR H 0.000 . 3.850 2.832 2.538 3.078 . 0 0 "[ . 1 . 2 .]" 1
1017 1 67 VAL MG1 1 68 THR HA 0.000 . 4.540 3.517 3.317 3.658 . 0 0 "[ . 1 . 2 .]" 1
1018 1 67 VAL MG1 1 69 SER H 0.000 . 4.290 3.507 3.262 3.806 . 0 0 "[ . 1 . 2 .]" 1
1019 1 67 VAL MG1 1 70 ALA MB 0.000 . 3.350 2.589 2.425 2.760 . 0 0 "[ . 1 . 2 .]" 1
1020 1 67 VAL MG1 1 112 PHE HA 0.000 . 5.500 3.834 3.739 3.996 . 0 0 "[ . 1 . 2 .]" 1
1021 1 67 VAL MG1 1 112 PHE QD 0.000 . 2.660 1.838 1.684 2.090 0.116 19 0 "[ . 1 . 2 .]" 1
1022 1 67 VAL MG1 1 119 ILE QG 0.000 . 5.500 3.764 3.598 3.970 . 0 0 "[ . 1 . 2 .]" 1
1023 1 67 VAL MG1 1 119 ILE MD 0.000 . 5.500 3.701 3.372 4.116 . 0 0 "[ . 1 . 2 .]" 1
1024 1 67 VAL MG2 1 68 THR H 0.000 . 4.970 4.029 3.922 4.108 . 0 0 "[ . 1 . 2 .]" 1
1025 1 67 VAL MG2 1 68 THR MG 0.000 . 5.500 5.473 5.290 5.547 0.047 10 0 "[ . 1 . 2 .]" 1
1026 1 67 VAL MG2 1 69 SER H 0.000 . 5.500 5.115 4.977 5.263 . 0 0 "[ . 1 . 2 .]" 1
1027 1 67 VAL MG2 1 112 PHE QD 0.000 . 2.970 3.052 2.910 3.157 0.187 23 0 "[ . 1 . 2 .]" 1
1028 1 67 VAL MG2 1 118 GLU QB 0.000 . 4.570 3.979 3.226 4.422 . 0 0 "[ . 1 . 2 .]" 1
1029 1 67 VAL MG2 1 118 GLU HG2 0.000 . 5.500 4.519 4.114 4.967 . 0 0 "[ . 1 . 2 .]" 1
1030 1 67 VAL MG2 1 118 GLU HG3 0.000 . 5.500 4.984 4.155 5.511 0.011 7 0 "[ . 1 . 2 .]" 1
1031 1 67 VAL MG2 1 119 ILE H 0.000 . 5.500 4.220 4.041 4.411 . 0 0 "[ . 1 . 2 .]" 1
1032 1 67 VAL MG2 1 119 ILE HA 0.000 . 3.110 2.959 2.485 3.228 0.118 15 0 "[ . 1 . 2 .]" 1
1033 1 67 VAL MG2 1 119 ILE MG 0.000 . 5.060 2.532 2.267 2.747 . 0 0 "[ . 1 . 2 .]" 1
1034 1 67 VAL MG2 1 119 ILE HG12 0.000 . 3.070 1.736 1.666 1.789 0.134 10 0 "[ . 1 . 2 .]" 1
1035 1 67 VAL MG2 1 119 ILE HG13 0.000 . 3.070 3.135 3.055 3.220 0.150 9 0 "[ . 1 . 2 .]" 1
1036 1 67 VAL MG2 1 119 ILE MD 0.000 . 3.540 2.250 1.914 2.575 . 0 0 "[ . 1 . 2 .]" 1
1037 1 67 VAL MG2 1 120 ASN H 0.000 . 5.500 4.654 4.089 4.977 . 0 0 "[ . 1 . 2 .]" 1
1038 1 67 VAL MG2 1 136 TRP HH2 0.000 . 4.470 3.780 3.333 4.468 . 0 0 "[ . 1 . 2 .]" 1
1039 1 68 THR H 1 69 SER H 0.000 . 2.930 1.864 1.813 1.897 . 0 0 "[ . 1 . 2 .]" 1
1040 1 68 THR H 1 112 PHE QD 0.000 . 5.480 5.107 4.834 5.309 . 0 0 "[ . 1 . 2 .]" 1
1041 1 68 THR H 1 118 GLU QB 0.000 . 4.970 4.154 3.236 4.765 . 0 0 "[ . 1 . 2 .]" 1
1042 1 68 THR MG 1 69 SER H 0.000 . 5.500 4.143 4.042 4.229 . 0 0 "[ . 1 . 2 .]" 1
1043 1 69 SER H 1 70 ALA H 0.000 . 5.280 3.906 3.819 3.969 . 0 0 "[ . 1 . 2 .]" 1
1044 1 69 SER H 1 112 PHE QD 0.000 . 5.480 5.148 4.892 5.427 . 0 0 "[ . 1 . 2 .]" 1
1045 1 69 SER HA 1 70 ALA H 0.000 . 2.400 2.405 2.388 2.427 0.027 9 0 "[ . 1 . 2 .]" 1
1046 1 69 SER HA 1 114 GLY QA 0.000 . 4.230 4.290 4.244 4.344 0.114 13 0 "[ . 1 . 2 .]" 1
1047 1 69 SER HB2 1 70 ALA H 0.000 . 4.600 4.420 4.390 4.454 . 0 0 "[ . 1 . 2 .]" 1
1048 1 69 SER HB2 1 112 PHE QD 0.000 . 4.180 4.250 4.203 4.304 0.124 3 0 "[ . 1 . 2 .]" 1
1049 1 69 SER HB2 1 113 THR H 0.000 . 5.500 4.081 3.905 4.409 . 0 0 "[ . 1 . 2 .]" 1
1050 1 69 SER HB2 1 114 GLY H 0.000 . 5.500 3.539 3.369 3.796 . 0 0 "[ . 1 . 2 .]" 1
1051 1 69 SER HB2 1 114 GLY HA3 0.000 . 5.280 2.026 1.925 2.119 . 0 0 "[ . 1 . 2 .]" 1
1052 1 69 SER HB2 1 114 GLY HA2 0.000 . 5.280 3.584 3.366 3.734 . 0 0 "[ . 1 . 2 .]" 1
1053 1 69 SER HB3 1 70 ALA H 0.000 . 4.040 4.229 4.216 4.259 0.219 9 0 "[ . 1 . 2 .]" 1
1054 1 69 SER HB3 1 112 PHE QD 0.000 . 5.480 5.247 4.889 5.353 . 0 0 "[ . 1 . 2 .]" 1
1055 1 69 SER HB3 1 114 GLY H 0.000 . 5.500 3.706 3.512 3.900 . 0 0 "[ . 1 . 2 .]" 1
1056 1 69 SER HB3 1 114 GLY QA 0.000 . 3.180 2.212 2.117 2.329 . 0 0 "[ . 1 . 2 .]" 1
1057 1 70 ALA H 1 71 GLU H 0.000 . 5.130 4.351 4.312 4.370 . 0 0 "[ . 1 . 2 .]" 1
1058 1 70 ALA H 1 112 PHE HA 0.000 . 4.690 4.746 4.682 4.809 0.119 20 0 "[ . 1 . 2 .]" 1
1059 1 70 ALA HA 1 71 GLU H 0.000 . 2.460 2.313 2.277 2.352 . 0 0 "[ . 1 . 2 .]" 1
1060 1 70 ALA HA 1 71 GLU QG 0.000 . 5.500 3.217 3.158 3.289 . 0 0 "[ . 1 . 2 .]" 1
1061 1 70 ALA HA 1 112 PHE HA 0.000 . 2.800 2.664 2.544 2.763 . 0 0 "[ . 1 . 2 .]" 1
1062 1 70 ALA HA 1 112 PHE HB2 0.000 . 5.500 5.139 5.035 5.233 . 0 0 "[ . 1 . 2 .]" 1
1063 1 70 ALA HA 1 112 PHE QD 0.000 . 5.020 4.780 4.574 5.000 . 0 0 "[ . 1 . 2 .]" 1
1064 1 70 ALA HA 1 113 THR H 0.000 . 3.450 1.876 1.747 1.950 0.053 11 0 "[ . 1 . 2 .]" 1
1065 1 70 ALA HA 1 113 THR MG 0.000 . 3.050 2.702 2.460 2.986 . 0 0 "[ . 1 . 2 .]" 1
1066 1 70 ALA MB 1 71 GLU H 0.000 . 3.230 2.615 2.463 2.734 . 0 0 "[ . 1 . 2 .]" 1
1067 1 70 ALA MB 1 110 PHE HB2 0.000 . 5.590 3.580 2.953 4.061 . 0 0 "[ . 1 . 2 .]" 1
1068 1 70 ALA MB 1 110 PHE HB3 0.000 . 5.650 2.401 2.166 2.679 . 0 0 "[ . 1 . 2 .]" 1
1069 1 70 ALA MB 1 110 PHE QD 0.000 . 3.830 2.921 1.920 3.825 . 0 0 "[ . 1 . 2 .]" 1
1070 1 70 ALA MB 1 111 LYS H 0.000 . 5.400 3.349 3.109 3.584 . 0 0 "[ . 1 . 2 .]" 1
1071 1 70 ALA MB 1 112 PHE HA 0.000 . 3.290 1.943 1.732 2.119 0.068 11 0 "[ . 1 . 2 .]" 1
1072 1 70 ALA MB 1 112 PHE HB2 0.000 . 5.650 3.544 3.409 3.658 . 0 0 "[ . 1 . 2 .]" 1
1073 1 70 ALA MB 1 112 PHE QD 0.000 . 4.050 2.977 2.680 3.293 . 0 0 "[ . 1 . 2 .]" 1
1074 1 70 ALA MB 1 113 THR H 0.000 . 5.650 2.965 2.787 3.120 . 0 0 "[ . 1 . 2 .]" 1
1075 1 71 GLU H 1 110 PHE QD 0.000 . 5.480 4.226 3.652 5.412 . 0 0 "[ . 1 . 2 .]" 1
1076 1 71 GLU H 1 111 LYS H 0.000 . 3.240 2.545 2.442 2.649 . 0 0 "[ . 1 . 2 .]" 1
1077 1 71 GLU H 1 111 LYS HB2 0.000 . 5.500 4.058 3.762 4.581 . 0 0 "[ . 1 . 2 .]" 1
1078 1 71 GLU H 1 113 THR MG 0.000 . 4.820 2.917 2.741 3.078 . 0 0 "[ . 1 . 2 .]" 1
1079 1 71 GLU HA 1 72 VAL H 0.000 . 2.710 2.280 2.241 2.339 . 0 0 "[ . 1 . 2 .]" 1
1080 1 71 GLU HA 1 72 VAL MG2 0.000 . 5.500 3.502 3.354 3.607 . 0 0 "[ . 1 . 2 .]" 1
1081 1 71 GLU HA 1 113 THR MG 0.000 . 5.500 4.642 4.545 4.800 . 0 0 "[ . 1 . 2 .]" 1
1082 1 71 GLU HB2 1 72 VAL H 0.000 . 3.420 3.402 2.629 3.515 0.095 1 0 "[ . 1 . 2 .]" 1
1083 1 71 GLU HB2 1 111 LYS H 0.000 . 5.500 3.941 3.792 4.590 . 0 0 "[ . 1 . 2 .]" 1
1084 1 71 GLU HB2 1 113 THR MG 0.000 . 4.350 3.684 3.455 4.415 0.065 4 0 "[ . 1 . 2 .]" 1
1085 1 71 GLU HB3 1 72 VAL H 0.000 . 3.420 2.935 2.798 3.469 0.049 5 0 "[ . 1 . 2 .]" 1
1086 1 71 GLU HB3 1 111 LYS H 0.000 . 5.500 5.152 5.042 5.399 . 0 0 "[ . 1 . 2 .]" 1
1087 1 71 GLU HB3 1 113 THR MG 0.000 . 4.350 4.335 3.937 4.422 0.072 18 0 "[ . 1 . 2 .]" 1
1088 1 71 GLU QB 1 73 ILE MD 0.000 . 4.720 4.665 3.309 4.847 0.127 9 0 "[ . 1 . 2 .]" 1
1089 1 71 GLU QG 1 72 VAL H 0.000 . 4.690 4.418 4.173 4.498 . 0 0 "[ . 1 . 2 .]" 1
1090 1 71 GLU QG 1 111 LYS H 0.000 . 5.500 4.354 3.450 4.530 . 0 0 "[ . 1 . 2 .]" 1
1091 1 71 GLU QG 1 111 LYS HB2 0.000 . 4.850 4.615 4.112 4.778 . 0 0 "[ . 1 . 2 .]" 1
1092 1 71 GLU QG 1 113 THR MG 0.000 . 3.230 1.830 1.710 1.987 0.090 10 0 "[ . 1 . 2 .]" 1
1093 1 72 VAL H 1 73 ILE H 0.000 . 5.100 4.511 4.492 4.531 . 0 0 "[ . 1 . 2 .]" 1
1094 1 72 VAL H 1 110 PHE QD 0.000 . 5.480 3.972 3.489 4.880 . 0 0 "[ . 1 . 2 .]" 1
1095 1 72 VAL HA 1 73 ILE H 0.000 . 2.710 2.102 2.090 2.116 . 0 0 "[ . 1 . 2 .]" 1
1096 1 72 VAL HA 1 73 ILE HB 0.000 . 4.850 4.865 4.813 4.905 0.055 4 0 "[ . 1 . 2 .]" 1
1097 1 72 VAL HA 1 73 ILE MD 0.000 . 5.500 3.988 2.736 4.446 . 0 0 "[ . 1 . 2 .]" 1
1098 1 72 VAL HA 1 74 ALA H 0.000 . 3.300 3.487 3.452 3.536 0.236 4 0 "[ . 1 . 2 .]" 1
1099 1 72 VAL HA 1 110 PHE HA 0.000 . 3.110 2.206 2.091 2.314 . 0 0 "[ . 1 . 2 .]" 1
1100 1 72 VAL HA 1 110 PHE QD 0.000 . 5.480 3.027 1.623 3.587 0.177 3 0 "[ . 1 . 2 .]" 1
1101 1 72 VAL HA 1 111 LYS H 0.000 . 3.390 3.583 3.448 3.683 0.293 4 0 "[ . 1 . 2 .]" 1
1102 1 72 VAL HB 1 73 ILE H 0.000 . 4.410 4.036 3.925 4.109 . 0 0 "[ . 1 . 2 .]" 1
1103 1 72 VAL HB 1 110 PHE HA 0.000 . 5.500 5.216 5.110 5.327 . 0 0 "[ . 1 . 2 .]" 1
1104 1 72 VAL MG1 1 73 ILE H 0.000 . 3.390 2.486 2.278 2.647 . 0 0 "[ . 1 . 2 .]" 1
1105 1 72 VAL MG1 1 73 ILE HA 0.000 . 5.500 4.008 3.818 4.148 . 0 0 "[ . 1 . 2 .]" 1
1106 1 72 VAL MG1 1 74 ALA H 0.000 . 3.420 2.241 2.042 2.393 . 0 0 "[ . 1 . 2 .]" 1
1107 1 72 VAL MG1 1 74 ALA HA 0.000 . 5.500 3.532 3.298 3.674 . 0 0 "[ . 1 . 2 .]" 1
1108 1 72 VAL MG1 1 108 PHE HA 0.000 . 5.500 4.308 4.048 4.464 . 0 0 "[ . 1 . 2 .]" 1
1109 1 72 VAL MG1 1 108 PHE QD 0.000 . 3.030 3.081 3.036 3.157 0.127 4 0 "[ . 1 . 2 .]" 1
1110 1 72 VAL MG1 1 109 LEU H 0.000 . 5.370 3.091 2.847 3.285 . 0 0 "[ . 1 . 2 .]" 1
1111 1 72 VAL MG1 1 110 PHE HA 0.000 . 5.500 3.657 3.486 3.861 . 0 0 "[ . 1 . 2 .]" 1
1112 1 72 VAL MG1 1 110 PHE QE 0.000 . 3.560 3.181 1.859 3.675 0.115 7 0 "[ . 1 . 2 .]" 1
1113 1 72 VAL MG2 1 73 ILE H 0.000 . 4.540 4.117 3.977 4.213 . 0 0 "[ . 1 . 2 .]" 1
1114 1 72 VAL MG2 1 74 ALA H 0.000 . 5.310 4.670 4.486 4.770 . 0 0 "[ . 1 . 2 .]" 1
1115 1 72 VAL MG2 1 108 PHE QB 0.000 . 5.500 3.714 3.240 4.006 . 0 0 "[ . 1 . 2 .]" 1
1116 1 72 VAL MG2 1 108 PHE QD 0.000 . 4.430 4.289 4.108 4.534 0.104 15 0 "[ . 1 . 2 .]" 1
1117 1 72 VAL MG2 1 109 LEU H 0.000 . 5.500 5.039 4.730 5.241 . 0 0 "[ . 1 . 2 .]" 1
1118 1 72 VAL MG2 1 110 PHE HA 0.000 . 5.500 3.903 3.722 4.142 . 0 0 "[ . 1 . 2 .]" 1
1119 1 72 VAL MG2 1 110 PHE QE 0.000 . 3.680 2.173 1.856 2.550 . 0 0 "[ . 1 . 2 .]" 1
1120 1 72 VAL MG2 1 110 PHE HZ 0.000 . 5.000 2.876 2.328 3.687 . 0 0 "[ . 1 . 2 .]" 1
1121 1 73 ILE H 1 74 ALA H 0.000 . 2.710 1.957 1.917 2.001 . 0 0 "[ . 1 . 2 .]" 1
1122 1 73 ILE H 1 109 LEU MD2 0.000 . 5.500 4.259 3.853 4.589 . 0 0 "[ . 1 . 2 .]" 1
1123 1 73 ILE H 1 110 PHE HA 0.000 . 3.300 2.651 2.482 2.853 . 0 0 "[ . 1 . 2 .]" 1
1124 1 73 ILE H 1 110 PHE QD 0.000 . 5.480 4.263 2.938 4.681 . 0 0 "[ . 1 . 2 .]" 1
1125 1 73 ILE H 1 111 LYS H 0.000 . 3.950 3.949 3.784 4.092 0.142 5 0 "[ . 1 . 2 .]" 1
1126 1 73 ILE HA 1 74 ALA H 0.000 . 3.360 3.414 3.400 3.428 0.068 4 0 "[ . 1 . 2 .]" 1
1127 1 73 ILE HA 1 109 LEU MD2 0.000 . 5.500 4.850 4.301 5.369 . 0 0 "[ . 1 . 2 .]" 1
1128 1 73 ILE HB 1 74 ALA H 0.000 . 3.140 3.110 3.037 3.161 0.021 14 0 "[ . 1 . 2 .]" 1
1129 1 73 ILE HB 1 109 LEU MD2 0.000 . 3.510 2.377 1.770 2.862 0.030 4 0 "[ . 1 . 2 .]" 1
1130 1 73 ILE HB 1 111 LYS H 0.000 . 5.500 5.163 5.046 5.438 . 0 0 "[ . 1 . 2 .]" 1
1131 1 73 ILE MG 1 74 ALA H 0.000 . 4.010 4.082 4.063 4.101 0.091 5 0 "[ . 1 . 2 .]" 1
1132 1 73 ILE MG 1 74 ALA HA 0.000 . 5.340 4.645 4.579 4.717 . 0 0 "[ . 1 . 2 .]" 1
1133 1 73 ILE MG 1 74 ALA MB 0.000 . 5.650 3.417 3.288 3.510 . 0 0 "[ . 1 . 2 .]" 1
1134 1 73 ILE MG 1 109 LEU MD2 0.000 . 3.600 3.029 2.311 3.590 . 0 0 "[ . 1 . 2 .]" 1
1135 1 73 ILE MG 1 110 PHE HA 0.000 . 5.280 5.313 5.218 5.362 0.082 11 0 "[ . 1 . 2 .]" 1
1136 1 73 ILE MG 1 111 LYS H 0.000 . 5.130 5.210 5.121 5.268 0.138 9 0 "[ . 1 . 2 .]" 1
1137 1 73 ILE MG 1 164 HIS HB2 0.000 . 4.380 4.330 3.941 4.429 0.049 6 0 "[ . 1 . 2 .]" 1
1138 1 73 ILE MG 1 164 HIS HB3 0.000 . 4.440 2.879 2.490 3.009 . 0 0 "[ . 1 . 2 .]" 1
1139 1 73 ILE MG 1 164 HIS HD2 0.000 . 5.500 5.487 5.234 5.560 0.060 21 0 "[ . 1 . 2 .]" 1
1140 1 73 ILE HG12 1 74 ALA H 0.000 . 5.500 5.076 3.820 5.252 . 0 0 "[ . 1 . 2 .]" 1
1141 1 73 ILE HG12 1 111 LYS H 0.000 . 5.030 3.796 3.132 3.958 . 0 0 "[ . 1 . 2 .]" 1
1142 1 73 ILE HG13 1 74 ALA H 0.000 . 5.500 4.090 3.927 5.114 . 0 0 "[ . 1 . 2 .]" 1
1143 1 73 ILE HG13 1 111 LYS H 0.000 . 5.030 2.868 2.680 3.896 . 0 0 "[ . 1 . 2 .]" 1
1144 1 73 ILE QG 1 109 LEU MD2 0.000 . 5.500 4.035 2.556 4.486 . 0 0 "[ . 1 . 2 .]" 1
1145 1 73 ILE QG 1 110 PHE HA 0.000 . 5.500 2.917 2.737 3.165 . 0 0 "[ . 1 . 2 .]" 1
1146 1 73 ILE QG 1 111 LYS H 0.000 . 5.030 2.743 2.622 3.021 . 0 0 "[ . 1 . 2 .]" 1
1147 1 73 ILE QG 1 111 LYS HA 0.000 . 5.500 3.876 3.678 4.307 . 0 0 "[ . 1 . 2 .]" 1
1148 1 73 ILE MD 1 74 ALA H 0.000 . 5.470 4.010 3.677 4.315 . 0 0 "[ . 1 . 2 .]" 1
1149 1 73 ILE MD 1 109 LEU H 0.000 . 5.500 5.407 5.078 5.764 0.264 5 0 "[ . 1 . 2 .]" 1
1150 1 73 ILE MD 1 109 LEU MD2 0.000 . 3.760 2.927 2.669 3.931 0.171 4 0 "[ . 1 . 2 .]" 1
1151 1 73 ILE MD 1 110 PHE HA 0.000 . 5.500 2.826 2.486 3.193 . 0 0 "[ . 1 . 2 .]" 1
1152 1 73 ILE MD 1 110 PHE QD 0.000 . 5.480 4.669 4.090 4.992 . 0 0 "[ . 1 . 2 .]" 1
1153 1 73 ILE MD 1 111 LYS H 0.000 . 4.070 2.572 2.120 2.800 . 0 0 "[ . 1 . 2 .]" 1
1154 1 73 ILE MD 1 111 LYS HA 0.000 . 5.130 2.380 2.113 3.657 . 0 0 "[ . 1 . 2 .]" 1
1155 1 73 ILE MD 1 111 LYS HB2 0.000 . 5.500 1.774 1.585 1.901 0.215 5 0 "[ . 1 . 2 .]" 1
1156 1 73 ILE MD 1 111 LYS HB3 0.000 . 3.210 3.114 2.033 3.257 0.047 18 0 "[ . 1 . 2 .]" 1
1157 1 73 ILE MD 1 111 LYS QG 0.000 . 4.840 3.014 2.279 3.646 . 0 0 "[ . 1 . 2 .]" 1
1158 1 73 ILE MD 1 111 LYS QD 0.000 . 2.990 2.729 2.263 3.047 0.057 5 0 "[ . 1 . 2 .]" 1
1159 1 73 ILE MD 1 111 LYS QE 0.000 . 4.320 3.780 2.703 4.364 0.044 18 0 "[ . 1 . 2 .]" 1
1160 1 73 ILE MD 1 164 HIS HB3 0.000 . 5.500 4.353 3.935 5.480 . 0 0 "[ . 1 . 2 .]" 1
1161 1 74 ALA H 1 75 GLU H 0.000 . 4.760 4.367 4.355 4.380 . 0 0 "[ . 1 . 2 .]" 1
1162 1 74 ALA H 1 109 LEU H 0.000 . 3.450 3.265 2.876 3.435 . 0 0 "[ . 1 . 2 .]" 1
1163 1 74 ALA H 1 109 LEU QB 0.000 . 4.230 2.206 1.990 2.637 . 0 0 "[ . 1 . 2 .]" 1
1164 1 74 ALA H 1 109 LEU MD1 0.000 . 5.500 4.750 4.535 5.028 . 0 0 "[ . 1 . 2 .]" 1
1165 1 74 ALA H 1 109 LEU MD2 0.000 . 4.540 3.794 3.544 4.118 . 0 0 "[ . 1 . 2 .]" 1
1166 1 74 ALA H 1 110 PHE HA 0.000 . 4.790 4.299 4.089 4.601 . 0 0 "[ . 1 . 2 .]" 1
1167 1 74 ALA H 1 110 PHE QD 0.000 . 5.480 5.017 3.778 5.496 0.016 1 0 "[ . 1 . 2 .]" 1
1168 1 74 ALA HA 1 75 GLU H 0.000 . 2.490 2.522 2.498 2.548 0.058 21 0 "[ . 1 . 2 .]" 1
1169 1 74 ALA HA 1 75 GLU QB 0.000 . 5.030 4.193 4.136 4.248 . 0 0 "[ . 1 . 2 .]" 1
1170 1 74 ALA HA 1 109 LEU H 0.000 . 4.880 4.650 4.429 4.807 . 0 0 "[ . 1 . 2 .]" 1
1171 1 74 ALA MB 1 75 GLU H 0.000 . 2.920 2.190 2.047 2.309 . 0 0 "[ . 1 . 2 .]" 1
1172 1 74 ALA MB 1 109 LEU H 0.000 . 4.500 3.558 3.246 3.825 . 0 0 "[ . 1 . 2 .]" 1
1173 1 74 ALA MB 1 109 LEU QB 0.000 . 4.280 2.051 1.886 2.384 . 0 0 "[ . 1 . 2 .]" 1
1174 1 74 ALA MB 1 109 LEU MD2 0.000 . 3.570 2.131 1.799 2.563 0.001 17 0 "[ . 1 . 2 .]" 1
1175 1 74 ALA MB 1 161 PHE HB3 0.000 . 5.650 4.357 4.053 4.705 . 0 0 "[ . 1 . 2 .]" 1
1176 1 74 ALA MB 1 161 PHE QD 0.000 . 3.300 2.744 2.457 3.249 . 0 0 "[ . 1 . 2 .]" 1
1177 1 74 ALA MB 1 164 HIS HD2 0.000 . 2.550 2.516 2.390 2.582 0.032 4 0 "[ . 1 . 2 .]" 1
1178 1 75 GLU HA 1 76 VAL H 0.000 . 3.080 2.269 2.209 2.324 . 0 0 "[ . 1 . 2 .]" 1
1179 1 75 GLU HA 1 108 PHE HA 0.000 . 2.620 1.948 1.755 2.135 0.045 6 0 "[ . 1 . 2 .]" 1
1180 1 75 GLU HA 1 108 PHE QD 0.000 . 4.210 2.975 2.426 3.615 . 0 0 "[ . 1 . 2 .]" 1
1181 1 75 GLU HA 1 109 LEU H 0.000 . 3.180 2.638 2.439 3.134 . 0 0 "[ . 1 . 2 .]" 1
1182 1 75 GLU HA 1 161 PHE QE 0.000 . 3.440 2.726 2.366 3.302 . 0 0 "[ . 1 . 2 .]" 1
1183 1 75 GLU HB2 1 108 PHE QE 0.000 . 5.200 2.694 2.382 3.440 . 0 0 "[ . 1 . 2 .]" 1
1184 1 75 GLU HB3 1 108 PHE QE 0.000 . 5.200 3.121 2.816 3.629 . 0 0 "[ . 1 . 2 .]" 1
1185 1 75 GLU QB 1 108 PHE QD 0.000 . 5.480 1.806 1.690 2.139 0.110 18 0 "[ . 1 . 2 .]" 1
1186 1 75 GLU QB 1 108 PHE QE 0.000 . 4.030 2.540 2.264 3.141 . 0 0 "[ . 1 . 2 .]" 1
1187 1 75 GLU HG2 1 76 VAL H 0.000 . 5.500 4.296 4.128 4.518 . 0 0 "[ . 1 . 2 .]" 1
1188 1 75 GLU HG2 1 77 PRO HA 0.000 . 5.500 5.035 4.571 5.350 . 0 0 "[ . 1 . 2 .]" 1
1189 1 75 GLU HG2 1 108 PHE QE 0.000 . 5.480 4.855 4.572 5.343 . 0 0 "[ . 1 . 2 .]" 1
1190 1 75 GLU HG3 1 76 VAL H 0.000 . 5.500 4.543 4.125 4.916 . 0 0 "[ . 1 . 2 .]" 1
1191 1 75 GLU HG3 1 77 PRO HA 0.000 . 5.500 5.028 4.556 5.386 . 0 0 "[ . 1 . 2 .]" 1
1192 1 75 GLU HG3 1 108 PHE QE 0.000 . 5.480 3.559 3.216 3.921 . 0 0 "[ . 1 . 2 .]" 1
1193 1 75 GLU QG 1 106 LYS QG 0.000 . 5.500 5.345 5.005 5.531 0.031 19 0 "[ . 1 . 2 .]" 1
1194 1 75 GLU QG 1 108 PHE QD 0.000 . 5.300 3.808 3.512 3.968 . 0 0 "[ . 1 . 2 .]" 1
1195 1 76 VAL H 1 108 PHE HA 0.000 . 4.290 2.763 2.594 2.941 . 0 0 "[ . 1 . 2 .]" 1
1196 1 76 VAL H 1 160 VAL MG1 0.000 . 5.500 3.827 3.753 3.921 . 0 0 "[ . 1 . 2 .]" 1
1197 1 76 VAL HA 1 77 PRO QD 0.000 . 2.780 1.957 1.902 2.014 . 0 0 "[ . 1 . 2 .]" 1
1198 1 76 VAL HA 1 78 TYR H 0.000 . 5.130 4.669 4.312 5.003 . 0 0 "[ . 1 . 2 .]" 1
1199 1 76 VAL HA 1 160 VAL MG1 0.000 . 3.140 1.639 1.466 1.852 0.334 12 0 "[ . 1 . 2 .]" 1
1200 1 76 VAL HA 1 160 VAL MG2 0.000 . 5.470 2.976 2.645 3.295 . 0 0 "[ . 1 . 2 .]" 1
1201 1 76 VAL HB 1 78 TYR QE 0.000 . 5.490 5.470 5.304 5.588 0.098 3 0 "[ . 1 . 2 .]" 1
1202 1 76 VAL HB 1 107 TRP H 0.000 . 5.410 2.344 2.103 2.629 . 0 0 "[ . 1 . 2 .]" 1
1203 1 76 VAL HB 1 107 TRP HB2 0.000 . 5.500 3.269 2.676 3.586 . 0 0 "[ . 1 . 2 .]" 1
1204 1 76 VAL HB 1 107 TRP HB3 0.000 . 5.500 4.429 4.046 4.720 . 0 0 "[ . 1 . 2 .]" 1
1205 1 76 VAL HB 1 157 VAL MG2 0.000 . 4.720 4.565 4.307 4.746 0.026 13 0 "[ . 1 . 2 .]" 1
1206 1 76 VAL HB 1 160 VAL MG2 0.000 . 4.290 4.328 4.269 4.360 0.070 1 0 "[ . 1 . 2 .]" 1
1207 1 76 VAL MG1 1 77 PRO HA 0.000 . 5.500 3.985 3.839 4.109 . 0 0 "[ . 1 . 2 .]" 1
1208 1 76 VAL MG1 1 77 PRO QG 0.000 . 5.500 2.748 2.435 3.142 . 0 0 "[ . 1 . 2 .]" 1
1209 1 76 VAL MG1 1 77 PRO HD2 0.000 . 3.230 1.892 1.753 2.009 0.047 19 0 "[ . 1 . 2 .]" 1
1210 1 76 VAL MG1 1 77 PRO HD3 0.000 . 3.230 3.274 3.224 3.327 0.097 9 0 "[ . 1 . 2 .]" 1
1211 1 76 VAL MG1 1 78 TYR H 0.000 . 2.770 2.431 2.086 2.818 0.048 14 0 "[ . 1 . 2 .]" 1
1212 1 76 VAL MG1 1 78 TYR QE 0.000 . 3.070 2.678 2.571 2.845 . 0 0 "[ . 1 . 2 .]" 1
1213 1 76 VAL MG1 1 80 LEU HG 0.000 . 5.500 3.006 2.251 3.587 . 0 0 "[ . 1 . 2 .]" 1
1214 1 76 VAL MG1 1 80 LEU MD1 0.000 . 4.260 3.082 2.485 3.520 . 0 0 "[ . 1 . 2 .]" 1
1215 1 76 VAL MG1 1 80 LEU MD2 0.000 . 4.880 3.085 2.417 3.527 . 0 0 "[ . 1 . 2 .]" 1
1216 1 76 VAL MG1 1 107 TRP H 0.000 . 5.500 3.048 2.780 3.406 . 0 0 "[ . 1 . 2 .]" 1
1217 1 76 VAL MG1 1 107 TRP HB2 0.000 . 4.970 3.695 3.318 3.885 . 0 0 "[ . 1 . 2 .]" 1
1218 1 76 VAL MG1 1 107 TRP HB3 0.000 . 5.500 5.025 4.781 5.198 . 0 0 "[ . 1 . 2 .]" 1
1219 1 76 VAL MG1 1 157 VAL MG2 0.000 . 5.500 3.758 3.404 4.102 . 0 0 "[ . 1 . 2 .]" 1
1220 1 76 VAL MG1 1 160 VAL H 0.000 . 5.500 5.217 5.085 5.508 0.008 17 0 "[ . 1 . 2 .]" 1
1221 1 76 VAL MG1 1 160 VAL HB 0.000 . 4.690 3.919 3.665 4.349 . 0 0 "[ . 1 . 2 .]" 1
1222 1 76 VAL MG1 1 160 VAL MG1 0.000 . 3.540 3.130 2.750 3.528 . 0 0 "[ . 1 . 2 .]" 1
1223 1 76 VAL MG1 1 160 VAL MG2 0.000 . 3.480 2.197 1.949 2.630 . 0 0 "[ . 1 . 2 .]" 1
1224 1 76 VAL MG2 1 77 PRO QD 0.000 . 2.830 2.932 2.862 3.000 0.170 1 0 "[ . 1 . 2 .]" 1
1225 1 76 VAL MG2 1 78 TYR H 0.000 . 5.500 5.015 4.618 5.325 . 0 0 "[ . 1 . 2 .]" 1
1226 1 76 VAL MG2 1 80 LEU MD1 0.000 . 5.500 3.027 2.268 3.684 . 0 0 "[ . 1 . 2 .]" 1
1227 1 76 VAL MG2 1 107 TRP H 0.000 . 4.720 2.852 2.596 3.182 . 0 0 "[ . 1 . 2 .]" 1
1228 1 76 VAL MG2 1 107 TRP HB2 0.000 . 2.860 1.972 1.793 2.235 0.007 7 0 "[ . 1 . 2 .]" 1
1229 1 76 VAL MG2 1 107 TRP HB3 0.000 . 3.020 2.956 2.726 3.074 0.054 15 0 "[ . 1 . 2 .]" 1
1230 1 76 VAL MG2 1 108 PHE H 0.000 . 5.500 4.183 4.020 4.405 . 0 0 "[ . 1 . 2 .]" 1
1231 1 76 VAL MG2 1 108 PHE HA 0.000 . 4.570 3.653 3.395 3.911 . 0 0 "[ . 1 . 2 .]" 1
1232 1 76 VAL MG2 1 157 VAL HA 0.000 . 5.500 2.451 2.189 2.771 . 0 0 "[ . 1 . 2 .]" 1
1233 1 76 VAL MG2 1 157 VAL MG1 0.000 . 4.190 2.115 1.882 2.751 . 0 0 "[ . 1 . 2 .]" 1
1234 1 76 VAL MG2 1 157 VAL MG2 0.000 . 4.130 2.566 2.264 2.754 . 0 0 "[ . 1 . 2 .]" 1
1235 1 76 VAL MG2 1 160 VAL H 0.000 . 5.500 4.301 4.167 4.428 . 0 0 "[ . 1 . 2 .]" 1
1236 1 76 VAL MG2 1 160 VAL HB 0.000 . 3.450 2.447 2.187 2.673 . 0 0 "[ . 1 . 2 .]" 1
1237 1 76 VAL MG2 1 160 VAL MG1 0.000 . 3.330 2.375 1.918 2.743 . 0 0 "[ . 1 . 2 .]" 1
1238 1 76 VAL MG2 1 160 VAL MG2 0.000 . 3.850 2.229 1.979 2.370 . 0 0 "[ . 1 . 2 .]" 1
1239 1 76 VAL MG2 1 161 PHE H 0.000 . 5.500 4.375 4.161 4.598 . 0 0 "[ . 1 . 2 .]" 1
1240 1 76 VAL MG2 1 161 PHE QD 0.000 . 5.480 3.906 3.550 4.109 . 0 0 "[ . 1 . 2 .]" 1
1241 1 76 VAL MG2 1 161 PHE QE 0.000 . 2.910 2.779 2.212 2.970 0.060 13 0 "[ . 1 . 2 .]" 1
1242 1 77 PRO HA 1 78 TYR QD 0.000 . 5.500 5.527 5.257 5.620 0.120 14 0 "[ . 1 . 2 .]" 1
1243 1 77 PRO HB2 1 78 TYR H 0.000 . 3.420 2.476 2.120 3.047 . 0 0 "[ . 1 . 2 .]" 1
1244 1 77 PRO HB2 1 78 TYR QD 0.000 . 5.500 3.767 3.501 4.014 . 0 0 "[ . 1 . 2 .]" 1
1245 1 77 PRO HB3 1 78 TYR QD 0.000 . 5.190 5.152 4.942 5.291 0.101 17 0 "[ . 1 . 2 .]" 1
1246 1 77 PRO HG2 1 78 TYR QD 0.000 . 4.570 3.207 2.782 3.421 . 0 0 "[ . 1 . 2 .]" 1
1247 1 77 PRO HG3 1 78 TYR QD 0.000 . 4.570 4.484 4.086 4.670 0.100 4 0 "[ . 1 . 2 .]" 1
1248 1 77 PRO HD2 1 78 TYR QE 0.000 . 5.490 4.073 3.600 4.472 . 0 0 "[ . 1 . 2 .]" 1
1249 1 77 PRO HD2 1 160 VAL MG1 0.000 . 4.040 2.199 1.911 2.570 . 0 0 "[ . 1 . 2 .]" 1
1250 1 77 PRO HD3 1 78 TYR QE 0.000 . 5.490 5.409 5.020 5.679 0.189 11 0 "[ . 1 . 2 .]" 1
1251 1 77 PRO HD3 1 160 VAL MG1 0.000 . 4.040 1.825 1.582 2.141 0.218 24 0 "[ . 1 . 2 .]" 1
1252 1 77 PRO QD 1 160 VAL MG2 0.000 . 3.200 2.024 1.739 2.379 0.061 17 0 "[ . 1 . 2 .]" 1
1253 1 78 TYR H 1 79 TRP H 0.000 . 4.820 4.478 4.379 4.610 . 0 0 "[ . 1 . 2 .]" 1
1254 1 78 TYR H 1 160 VAL MG2 0.000 . 5.500 4.222 3.951 4.657 . 0 0 "[ . 1 . 2 .]" 1
1255 1 78 TYR HA 1 79 TRP H 0.000 . 3.180 2.555 2.329 2.679 . 0 0 "[ . 1 . 2 .]" 1
1256 1 78 TYR HA 1 79 TRP HD1 0.000 . 4.230 3.202 2.834 3.557 . 0 0 "[ . 1 . 2 .]" 1
1257 1 78 TYR HB2 1 79 TRP H 0.000 . 2.740 2.074 1.850 2.577 . 0 0 "[ . 1 . 2 .]" 1
1258 1 78 TYR HB3 1 79 TRP H 0.000 . 3.700 3.379 3.291 3.632 . 0 0 "[ . 1 . 2 .]" 1
1259 1 78 TYR QD 1 79 TRP H 0.000 . 5.310 3.522 3.300 3.924 . 0 0 "[ . 1 . 2 .]" 1
1260 1 78 TYR QD 1 80 LEU MD1 0.000 . 4.250 4.297 4.186 4.422 0.172 3 0 "[ . 1 . 2 .]" 1
1261 1 78 TYR QD 1 80 LEU MD2 0.000 . 4.000 2.398 1.757 3.093 0.043 14 0 "[ . 1 . 2 .]" 1
1262 1 78 TYR QE 1 80 LEU MD1 0.000 . 3.960 3.712 3.446 3.919 . 0 0 "[ . 1 . 2 .]" 1
1263 1 78 TYR QE 1 80 LEU MD2 0.000 . 3.340 2.111 1.704 2.768 0.096 3 0 "[ . 1 . 2 .]" 1
1264 1 78 TYR QE 1 80 LEU HA 0.000 . 5.490 5.183 4.634 5.525 0.035 19 0 "[ . 1 . 2 .]" 1
1265 1 78 TYR QE 1 80 LEU HG 0.000 . 3.850 3.859 3.372 4.018 0.168 24 0 "[ . 1 . 2 .]" 1
1266 1 78 TYR QE 1 156 GLU QG 0.000 . 5.490 2.217 1.823 2.774 . 0 0 "[ . 1 . 2 .]" 1
1267 1 78 TYR QE 1 160 VAL MG1 0.000 . 5.490 4.932 4.465 5.377 . 0 0 "[ . 1 . 2 .]" 1
1268 1 78 TYR QE 1 160 VAL MG2 0.000 . 4.220 3.129 2.851 3.499 . 0 0 "[ . 1 . 2 .]" 1
1269 1 79 TRP HA 1 80 LEU H 0.000 . 2.960 2.653 2.175 2.971 0.011 23 0 "[ . 1 . 2 .]" 1
1270 1 79 TRP HA 1 104 ALA MB 0.000 . 5.620 4.722 4.276 5.293 . 0 0 "[ . 1 . 2 .]" 1
1271 1 79 TRP HB2 1 80 LEU H 0.000 . 5.500 3.511 2.708 4.558 . 0 0 "[ . 1 . 2 .]" 1
1272 1 79 TRP HB2 1 104 ALA MB 0.000 . 4.840 3.219 2.552 3.923 . 0 0 "[ . 1 . 2 .]" 1
1273 1 79 TRP HB2 1 105 GLN H 0.000 . 5.500 4.962 4.579 5.364 . 0 0 "[ . 1 . 2 .]" 1
1274 1 79 TRP HB3 1 80 LEU H 0.000 . 5.500 2.486 1.648 3.944 0.152 6 0 "[ . 1 . 2 .]" 1
1275 1 79 TRP HB3 1 104 ALA MB 0.000 . 4.220 2.562 2.148 3.124 . 0 0 "[ . 1 . 2 .]" 1
1276 1 79 TRP HE3 1 80 LEU H 0.000 . 5.500 3.880 2.968 5.542 0.042 12 0 "[ . 1 . 2 .]" 1
1277 1 79 TRP HE3 1 104 ALA MB 0.000 . 2.760 2.653 2.434 2.809 0.049 1 0 "[ . 1 . 2 .]" 1
1278 1 79 TRP HE3 1 105 GLN H 0.000 . 5.500 3.517 3.000 4.407 . 0 0 "[ . 1 . 2 .]" 1
1279 1 79 TRP HE3 1 105 GLN HA 0.000 . 5.500 2.797 2.431 3.558 . 0 0 "[ . 1 . 2 .]" 1
1280 1 79 TRP HE3 1 106 LYS H 0.000 . 5.220 2.915 2.523 3.424 . 0 0 "[ . 1 . 2 .]" 1
1281 1 79 TRP HE3 1 106 LYS HA 0.000 . 5.410 4.285 3.964 4.863 . 0 0 "[ . 1 . 2 .]" 1
1282 1 79 TRP HE1 1 106 LYS QE 0.000 . 5.500 2.813 2.345 3.443 . 0 0 "[ . 1 . 2 .]" 1
1283 1 79 TRP HZ2 1 106 LYS QE 0.000 . 5.500 2.920 2.553 3.206 . 0 0 "[ . 1 . 2 .]" 1
1284 1 79 TRP HH2 1 106 LYS HE2 0.000 . 5.500 4.722 3.988 5.507 0.007 15 0 "[ . 1 . 2 .]" 1
1285 1 79 TRP HH2 1 106 LYS HE3 0.000 . 5.500 4.697 3.947 5.553 0.053 21 0 "[ . 1 . 2 .]" 1
1286 1 79 TRP HH2 1 106 LYS QE 0.000 . 4.220 4.078 3.851 4.325 0.105 15 0 "[ . 1 . 2 .]" 1
1287 1 80 LEU H 1 105 GLN H 0.000 . 4.110 2.911 2.109 4.127 0.017 8 0 "[ . 1 . 2 .]" 1
1288 1 80 LEU HA 1 81 THR H 0.000 . 2.680 2.158 2.127 2.200 . 0 0 "[ . 1 . 2 .]" 1
1289 1 80 LEU HB2 1 107 TRP HD1 0.000 . 5.350 3.384 2.439 4.217 . 0 0 "[ . 1 . 2 .]" 1
1290 1 80 LEU HB3 1 107 TRP HD1 0.000 . 5.350 4.600 3.681 5.388 0.038 9 0 "[ . 1 . 2 .]" 1
1291 1 80 LEU QB 1 81 THR H 0.000 . 3.480 3.499 3.219 3.589 0.109 6 0 "[ . 1 . 2 .]" 1
1292 1 80 LEU QB 1 153 VAL MG1 0.000 . 3.510 2.458 2.135 2.762 . 0 0 "[ . 1 . 2 .]" 1
1293 1 80 LEU QB 1 153 VAL MG2 0.000 . 4.200 3.874 3.526 4.215 0.015 7 0 "[ . 1 . 2 .]" 1
1294 1 80 LEU MD1 1 81 THR H 0.000 . 5.500 5.372 5.145 5.496 . 0 0 "[ . 1 . 2 .]" 1
1295 1 80 LEU MD1 1 107 TRP H 0.000 . 5.500 3.385 2.908 4.372 . 0 0 "[ . 1 . 2 .]" 1
1296 1 80 LEU MD1 1 153 VAL HA 0.000 . 5.500 3.310 2.535 3.781 . 0 0 "[ . 1 . 2 .]" 1
1297 1 80 LEU MD1 1 154 TYR QE 0.000 . 5.490 5.362 5.168 5.542 0.052 13 0 "[ . 1 . 2 .]" 1
1298 1 80 LEU MD1 1 156 GLU QB 0.000 . 2.990 2.762 2.118 3.049 0.059 11 0 "[ . 1 . 2 .]" 1
1299 1 80 LEU MD1 1 156 GLU QG 0.000 . 3.320 3.295 3.036 3.403 0.083 3 0 "[ . 1 . 2 .]" 1
1300 1 80 LEU MD1 1 157 VAL H 0.000 . 5.500 3.584 3.020 4.291 . 0 0 "[ . 1 . 2 .]" 1
1301 1 80 LEU MD1 1 157 VAL HA 0.000 . 5.220 3.617 2.847 4.449 . 0 0 "[ . 1 . 2 .]" 1
1302 1 80 LEU MD1 1 157 VAL MG2 0.000 . 3.540 2.004 1.653 2.832 0.147 8 0 "[ . 1 . 2 .]" 1
1303 1 80 LEU MD2 1 81 THR H 0.000 . 4.940 3.826 3.621 4.042 . 0 0 "[ . 1 . 2 .]" 1
1304 1 80 LEU MD2 1 106 LYS QG 0.000 . 4.940 5.024 4.853 5.121 0.181 4 0 "[ . 1 . 2 .]" 1
1305 1 80 LEU MD2 1 156 GLU QB 0.000 . 3.230 2.601 1.863 2.870 . 0 0 "[ . 1 . 2 .]" 1
1306 1 80 LEU MD2 1 157 VAL MG2 0.000 . 4.910 3.523 3.102 4.088 . 0 0 "[ . 1 . 2 .]" 1
1307 1 81 THR HA 1 82 TYR H 0.000 . 2.930 2.495 2.112 2.877 . 0 0 "[ . 1 . 2 .]" 1
1308 1 81 THR HA 1 104 ALA HA 0.000 . 3.000 2.312 1.912 3.010 0.010 20 0 "[ . 1 . 2 .]" 1
1309 1 81 THR HA 1 104 ALA MB 0.000 . 4.560 3.788 3.308 4.402 . 0 0 "[ . 1 . 2 .]" 1
1310 1 81 THR HB 1 82 TYR H 0.000 . 3.890 2.716 1.906 3.958 0.068 20 0 "[ . 1 . 2 .]" 1
1311 1 81 THR HB 1 104 ALA MB 0.000 . 5.650 3.694 2.998 4.167 . 0 0 "[ . 1 . 2 .]" 1
1312 1 81 THR MG 1 82 TYR H 0.000 . 4.290 3.903 3.519 4.379 0.089 9 0 "[ . 1 . 2 .]" 1
1313 1 81 THR MG 1 104 ALA HA 0.000 . 4.570 1.957 1.605 2.311 0.195 20 0 "[ . 1 . 2 .]" 1
1314 1 81 THR MG 1 104 ALA MB 0.000 . 3.630 1.849 1.690 2.080 0.110 5 0 "[ . 1 . 2 .]" 1
1315 1 81 THR MG 1 105 GLN H 0.000 . 5.500 3.249 2.596 3.924 . 0 0 "[ . 1 . 2 .]" 1
1316 1 82 TYR HA 1 83 ASP H 0.000 . 2.830 2.547 2.233 2.857 0.027 2 0 "[ . 1 . 2 .]" 1
1317 1 82 TYR QB 1 83 ASP H 0.000 . 4.000 3.860 1.907 4.032 0.032 20 0 "[ . 1 . 2 .]" 1
1318 1 82 TYR QD 1 83 ASP H 0.000 . 5.500 4.288 3.170 4.856 . 0 0 "[ . 1 . 2 .]" 1
1319 1 82 TYR QD 1 153 VAL MG2 0.000 . 5.500 2.631 1.815 3.548 . 0 0 "[ . 1 . 2 .]" 1
1320 1 82 TYR QE 1 153 VAL MG1 0.000 . 5.210 4.258 2.313 5.263 0.053 12 0 "[ . 1 . 2 .]" 1
1321 1 82 TYR QE 1 153 VAL MG2 0.000 . 5.490 2.732 1.946 4.142 . 0 0 "[ . 1 . 2 .]" 1
1322 1 83 ASP HA 1 84 PHE H 0.000 . 3.330 2.503 2.181 3.394 0.064 2 0 "[ . 1 . 2 .]" 1
1323 1 83 ASP HA 1 102 GLY HA3 0.000 . 2.900 2.899 2.300 3.054 0.154 9 0 "[ . 1 . 2 .]" 1
1324 1 83 ASP HA 1 102 GLY HA2 0.000 . 2.900 2.912 2.654 3.052 0.152 16 0 "[ . 1 . 2 .]" 1
1325 1 83 ASP HA 1 103 GLN H 0.000 . 4.410 3.816 2.913 4.445 0.035 5 0 "[ . 1 . 2 .]" 1
1326 1 83 ASP HB2 1 84 PHE H 0.000 . 4.450 2.786 1.778 4.242 0.022 20 0 "[ . 1 . 2 .]" 1
1327 1 83 ASP HB3 1 84 PHE H 0.000 . 4.450 3.558 1.613 4.066 0.187 9 0 "[ . 1 . 2 .]" 1
1328 1 84 PHE HA 1 85 PRO QG 0.000 . 4.380 3.905 3.705 4.088 . 0 0 "[ . 1 . 2 .]" 1
1329 1 84 PHE HA 1 85 PRO HD2 0.000 . 3.800 3.065 2.646 3.372 . 0 0 "[ . 1 . 2 .]" 1
1330 1 84 PHE HA 1 85 PRO HD3 0.000 . 3.800 2.107 1.911 2.356 . 0 0 "[ . 1 . 2 .]" 1
1331 1 84 PHE HA 1 88 VAL MG1 0.000 . 5.500 4.520 3.332 5.370 . 0 0 "[ . 1 . 2 .]" 1
1332 1 84 PHE HA 1 88 VAL MG2 0.000 . 5.500 4.756 4.111 5.568 0.068 2 0 "[ . 1 . 2 .]" 1
1333 1 84 PHE HB2 1 88 VAL MG1 0.000 . 5.500 3.090 1.887 4.455 . 0 0 "[ . 1 . 2 .]" 1
1334 1 84 PHE HB3 1 88 VAL MG1 0.000 . 5.500 2.788 2.165 3.462 . 0 0 "[ . 1 . 2 .]" 1
1335 1 84 PHE QB 1 85 PRO QD 0.000 . 5.500 2.032 1.758 2.603 0.042 17 0 "[ . 1 . 2 .]" 1
1336 1 84 PHE QB 1 88 VAL HB 0.000 . 3.760 1.945 1.537 2.908 0.263 23 0 "[ . 1 . 2 .]" 1
1337 1 84 PHE QB 1 89 ARG H 0.000 . 5.500 3.418 2.531 4.596 . 0 0 "[ . 1 . 2 .]" 1
1338 1 84 PHE QB 1 89 ARG QB 0.000 . 5.490 3.932 1.924 5.619 0.129 16 0 "[ . 1 . 2 .]" 1
1339 1 84 PHE QD 1 85 PRO QD 0.000 . 5.480 2.636 1.551 3.874 0.249 9 0 "[ . 1 . 2 .]" 1
1340 1 84 PHE QD 1 88 VAL HB 0.000 . 5.480 2.829 1.848 3.973 . 0 0 "[ . 1 . 2 .]" 1
1341 1 84 PHE QD 1 88 VAL MG1 0.000 . 3.460 2.311 1.715 3.210 0.085 3 0 "[ . 1 . 2 .]" 1
1342 1 84 PHE QD 1 88 VAL MG2 0.000 . 4.180 3.256 2.171 4.179 . 0 0 "[ . 1 . 2 .]" 1
1343 1 84 PHE QD 1 89 ARG HA 0.000 . 5.480 4.104 2.463 4.622 . 0 0 "[ . 1 . 2 .]" 1
1344 1 84 PHE QD 1 89 ARG QB 0.000 . 5.480 5.256 3.498 5.679 0.199 11 0 "[ . 1 . 2 .]" 1
1345 1 84 PHE QD 1 89 ARG QG 0.000 . 5.480 4.780 2.461 5.744 0.264 10 0 "[ . 1 . 2 .]" 1
1346 1 84 PHE QD 1 89 ARG QD 0.000 . 5.480 4.978 3.746 5.605 0.125 8 0 "[ . 1 . 2 .]" 1
1347 1 84 PHE QD 1 92 LEU MD1 0.000 . 4.020 2.317 1.601 3.920 0.199 16 0 "[ . 1 . 2 .]" 1
1348 1 85 PRO HA 1 86 PRO HD2 0.000 . 3.080 2.725 2.360 3.017 . 0 0 "[ . 1 . 2 .]" 1
1349 1 85 PRO HA 1 86 PRO HD3 0.000 . 3.080 2.650 2.400 2.921 . 0 0 "[ . 1 . 2 .]" 1
1350 1 85 PRO HB2 1 88 VAL MG2 0.000 . 4.910 3.203 1.885 3.886 . 0 0 "[ . 1 . 2 .]" 1
1351 1 85 PRO HB3 1 88 VAL MG2 0.000 . 4.910 4.409 2.785 5.019 0.109 9 0 "[ . 1 . 2 .]" 1
1352 1 85 PRO QB 1 86 PRO QD 0.000 . 5.190 1.823 1.684 2.227 0.116 3 0 "[ . 1 . 2 .]" 1
1353 1 85 PRO HD2 1 88 VAL MG1 0.000 . 5.370 3.356 2.133 4.235 . 0 0 "[ . 1 . 2 .]" 1
1354 1 85 PRO HD2 1 88 VAL MG2 0.000 . 3.610 2.281 1.771 2.796 0.029 16 0 "[ . 1 . 2 .]" 1
1355 1 85 PRO HD3 1 88 VAL MG1 0.000 . 5.370 4.363 3.389 5.140 . 0 0 "[ . 1 . 2 .]" 1
1356 1 85 PRO HD3 1 88 VAL MG2 0.000 . 3.610 3.607 3.226 3.811 0.201 22 0 "[ . 1 . 2 .]" 1
1357 1 85 PRO QD 1 88 VAL H 0.000 . 5.350 3.502 2.875 4.645 . 0 0 "[ . 1 . 2 .]" 1
1358 1 86 PRO HA 1 89 ARG QG 0.000 . 4.750 3.501 1.862 4.889 0.139 16 0 "[ . 1 . 2 .]" 1
1359 1 87 LYS QB 1 88 VAL MG2 0.000 . 4.010 2.924 2.481 3.523 . 0 0 "[ . 1 . 2 .]" 1
1360 1 87 LYS QG 1 88 VAL HA 0.000 . 5.500 4.850 3.753 5.532 0.032 24 0 "[ . 1 . 2 .]" 1
1361 1 88 VAL H 1 89 ARG H 0.000 . 3.050 2.518 2.004 2.741 . 0 0 "[ . 1 . 2 .]" 1
1362 1 88 VAL HA 1 92 LEU QB 0.000 . 4.790 4.359 3.346 4.832 0.042 20 0 "[ . 1 . 2 .]" 1
1363 1 88 VAL HB 1 89 ARG H 0.000 . 4.850 3.107 2.594 3.613 . 0 0 "[ . 1 . 2 .]" 1
1364 1 88 VAL MG1 1 89 ARG H 0.000 . 4.070 3.918 3.504 4.074 0.004 8 0 "[ . 1 . 2 .]" 1
1365 1 88 VAL MG1 1 89 ARG HA 0.000 . 4.290 3.951 3.465 4.342 0.052 9 0 "[ . 1 . 2 .]" 1
1366 1 88 VAL MG1 1 92 LEU MD1 0.000 . 3.670 3.382 1.838 3.837 0.167 12 0 "[ . 1 . 2 .]" 1
1367 1 88 VAL MG2 1 89 ARG H 0.000 . 4.040 3.896 3.650 4.105 0.065 4 0 "[ . 1 . 2 .]" 1
1368 1 88 VAL MG2 1 92 LEU QB 0.000 . 4.690 4.622 3.856 4.835 0.145 9 0 "[ . 1 . 2 .]" 1
1369 1 89 ARG HA 1 92 LEU QB 0.000 . 5.190 3.761 2.282 5.252 0.062 20 0 "[ . 1 . 2 .]" 1
1370 1 89 ARG HA 1 92 LEU MD1 0.000 . 4.910 3.626 2.178 4.705 . 0 0 "[ . 1 . 2 .]" 1
1371 1 89 ARG QG 1 93 ASN QD 0.000 . 5.340 3.515 1.735 4.875 0.065 15 0 "[ . 1 . 2 .]" 1
1372 1 89 ARG HD2 1 101 LYS HA 0.000 . 3.860 3.863 2.935 4.079 0.219 10 0 "[ . 1 . 2 .]" 1
1373 1 89 ARG HD3 1 101 LYS HA 0.000 . 3.860 3.901 3.514 4.053 0.193 11 0 "[ . 1 . 2 .]" 1
1374 1 90 GLU H 1 91 LYS H 0.000 . 3.210 2.411 1.842 2.881 . 0 0 "[ . 1 . 2 .]" 1
1375 1 90 GLU HA 1 93 ASN QB 0.000 . 3.730 3.814 3.590 3.951 0.221 23 0 "[ . 1 . 2 .]" 1
1376 1 90 GLU HA 1 94 ILE HB 0.000 . 2.400 2.369 2.205 2.583 0.183 20 0 "[ . 1 . 2 .]" 1
1377 1 90 GLU HA 1 94 ILE MG 0.000 . 3.790 3.699 1.775 3.848 0.058 17 0 "[ . 1 . 2 .]" 1
1378 1 90 GLU HA 1 94 ILE QG 0.000 . 5.500 3.015 1.413 3.930 0.387 10 0 "[ . 1 . 2 .]" 1
1379 1 90 GLU HA 1 94 ILE MD 0.000 . 3.110 2.007 1.522 3.415 0.305 20 0 "[ . 1 . 2 .]" 1
1380 1 90 GLU QB 1 91 LYS H 0.000 . 3.110 3.011 2.270 3.218 0.108 5 0 "[ . 1 . 2 .]" 1
1381 1 91 LYS H 1 92 LEU H 0.000 . 3.730 2.312 1.997 2.872 . 0 0 "[ . 1 . 2 .]" 1
1382 1 92 LEU HB2 1 93 ASN H 0.000 . 3.830 3.739 3.334 4.020 0.190 15 0 "[ . 1 . 2 .]" 1
1383 1 92 LEU HB3 1 93 ASN H 0.000 . 3.830 2.427 2.045 3.841 0.011 15 0 "[ . 1 . 2 .]" 1
1384 1 92 LEU HG 1 93 ASN H 0.000 . 5.310 4.388 3.278 4.813 . 0 0 "[ . 1 . 2 .]" 1
1385 1 92 LEU MD1 1 94 ILE MD 0.000 . 5.500 5.242 4.175 5.843 0.343 20 0 "[ . 1 . 2 .]" 1
1386 1 92 LEU MD2 1 96 TRP HD1 0.000 . 3.480 3.435 3.007 3.668 0.188 20 0 "[ . 1 . 2 .]" 1
1387 1 92 LEU MD2 1 96 TRP HE1 0.000 . 5.500 2.214 1.406 3.250 0.394 20 0 "[ . 1 . 2 .]" 1
1388 1 92 LEU MD2 1 96 TRP HZ2 0.000 . 5.470 2.978 1.837 4.052 . 0 0 "[ . 1 . 2 .]" 1
1389 1 93 ASN H 1 94 ILE H 0.000 . 3.470 2.908 2.556 3.282 . 0 0 "[ . 1 . 2 .]" 1
1390 1 93 ASN HA 1 96 TRP HD1 0.000 . 5.500 2.366 1.774 3.278 0.026 5 0 "[ . 1 . 2 .]" 1
1391 1 93 ASN HB2 1 94 ILE H 0.000 . 4.260 3.164 2.069 3.821 . 0 0 "[ . 1 . 2 .]" 1
1392 1 93 ASN HB3 1 94 ILE H 0.000 . 4.260 2.827 2.023 4.034 . 0 0 "[ . 1 . 2 .]" 1
1393 1 94 ILE H 1 95 GLN H 0.000 . 3.210 2.539 2.064 2.861 . 0 0 "[ . 1 . 2 .]" 1
1394 1 94 ILE HA 1 95 GLN H 0.000 . 3.380 3.354 3.293 3.518 0.138 20 0 "[ . 1 . 2 .]" 1
1395 1 94 ILE HB 1 95 GLN H 0.000 . 3.520 3.491 3.375 3.820 0.300 20 0 "[ . 1 . 2 .]" 1
1396 1 94 ILE MG 1 95 GLN H 0.000 . 5.500 3.648 1.674 4.070 0.126 20 0 "[ . 1 . 2 .]" 1
1397 1 94 ILE MG 1 95 GLN HA 0.000 . 3.980 3.547 3.143 3.867 . 0 0 "[ . 1 . 2 .]" 1
1398 1 94 ILE MG 1 95 GLN QG 0.000 . 5.500 4.769 3.439 5.449 . 0 0 "[ . 1 . 2 .]" 1
1399 1 94 ILE QG 1 95 GLN H 0.000 . 5.500 4.688 3.575 4.914 . 0 0 "[ . 1 . 2 .]" 1
1400 1 94 ILE MD 1 96 TRP HD1 0.000 . 5.340 5.269 4.518 5.557 0.217 20 0 "[ . 1 . 2 .]" 1
1401 1 95 GLN HA 1 96 TRP H 0.000 . 3.270 3.362 3.280 3.445 0.175 10 0 "[ . 1 . 2 .]" 1
1402 1 95 GLN HB2 1 96 TRP HD1 0.000 . 5.500 4.627 3.994 5.431 . 0 0 "[ . 1 . 2 .]" 1
1403 1 95 GLN HB2 1 96 TRP HE1 0.000 . 5.500 5.384 3.984 5.618 0.118 23 0 "[ . 1 . 2 .]" 1
1404 1 95 GLN HB3 1 96 TRP HD1 0.000 . 5.500 4.266 3.822 5.352 . 0 0 "[ . 1 . 2 .]" 1
1405 1 95 GLN HB3 1 96 TRP HE1 0.000 . 5.500 4.982 4.032 5.593 0.093 17 0 "[ . 1 . 2 .]" 1
1406 1 95 GLN QG 1 96 TRP HD1 0.000 . 5.500 5.292 2.579 5.629 0.129 21 0 "[ . 1 . 2 .]" 1
1407 1 96 TRP H 1 97 GLY H 0.000 . 3.550 2.853 2.085 3.755 0.205 17 0 "[ . 1 . 2 .]" 1
1408 1 96 TRP HB2 1 100 TRP HE1 0.000 . 5.250 4.545 3.161 5.399 0.149 8 0 "[ . 1 . 2 .]" 1
1409 1 96 TRP HB3 1 100 TRP HE1 0.000 . 5.250 3.728 2.935 4.834 . 0 0 "[ . 1 . 2 .]" 1
1410 1 96 TRP HD1 1 102 GLY H 0.000 . 4.380 4.415 4.248 4.504 0.124 20 0 "[ . 1 . 2 .]" 1
1411 1 96 TRP HZ2 1 102 GLY H 0.000 . 5.500 5.431 4.322 5.641 0.141 4 0 "[ . 1 . 2 .]" 1
1412 1 97 GLY H 1 98 SER H 0.000 . 3.890 3.212 2.235 4.023 0.133 5 0 "[ . 1 . 2 .]" 1
1413 1 98 SER HA 1 99 ASP H 0.000 . 2.740 2.535 2.129 2.914 0.174 9 0 "[ . 1 . 2 .]" 1
1414 1 98 SER HB2 1 99 ASP H 0.000 . 3.950 3.509 1.898 4.178 0.228 11 0 "[ . 1 . 2 .]" 1
1415 1 98 SER HB3 1 99 ASP H 0.000 . 3.950 3.111 1.778 4.153 0.203 1 0 "[ . 1 . 2 .]" 1
1416 1 99 ASP HA 1 100 TRP H 0.000 . 3.520 3.011 2.132 3.556 0.036 11 0 "[ . 1 . 2 .]" 1
1417 1 100 TRP HA 1 101 LYS QB 0.000 . 4.540 4.090 3.765 4.547 0.007 25 0 "[ . 1 . 2 .]" 1
1418 1 100 TRP QB 1 101 LYS H 0.000 . 4.290 2.187 1.703 3.103 0.097 11 0 "[ . 1 . 2 .]" 1
1419 1 100 TRP QB 1 102 GLY H 0.000 . 3.730 3.160 2.637 3.809 0.079 20 0 "[ . 1 . 2 .]" 1
1420 1 101 LYS H 1 102 GLY H 0.000 . 3.270 2.050 1.548 3.400 0.252 2 0 "[ . 1 . 2 .]" 1
1421 1 101 LYS HB2 1 102 GLY H 0.000 . 5.500 4.411 3.107 4.717 . 0 0 "[ . 1 . 2 .]" 1
1422 1 101 LYS HB3 1 102 GLY H 0.000 . 5.500 4.173 3.028 4.672 . 0 0 "[ . 1 . 2 .]" 1
1423 1 101 LYS QG 1 102 GLY H 0.000 . 5.500 4.095 2.885 4.733 . 0 0 "[ . 1 . 2 .]" 1
1424 1 103 GLN HA 1 104 ALA H 0.000 . 2.830 2.159 2.131 2.213 . 0 0 "[ . 1 . 2 .]" 1
1425 1 104 ALA HA 1 105 GLN H 0.000 . 2.800 2.117 2.075 2.180 . 0 0 "[ . 1 . 2 .]" 1
1426 1 104 ALA HA 1 105 GLN QB 0.000 . 4.350 4.442 4.363 4.598 0.248 2 0 "[ . 1 . 2 .]" 1
1427 1 105 GLN H 1 106 LYS H 0.000 . 5.500 4.302 4.204 4.382 . 0 0 "[ . 1 . 2 .]" 1
1428 1 105 GLN HA 1 106 LYS H 0.000 . 2.770 2.129 2.096 2.161 . 0 0 "[ . 1 . 2 .]" 1
1429 1 105 GLN HB2 1 106 LYS H 0.000 . 4.140 4.031 3.200 4.257 0.117 23 0 "[ . 1 . 2 .]" 1
1430 1 105 GLN HB2 1 107 TRP HE1 0.000 . 3.920 3.506 2.705 3.884 . 0 0 "[ . 1 . 2 .]" 1
1431 1 105 GLN HB3 1 106 LYS H 0.000 . 4.140 3.446 3.133 4.218 0.078 9 0 "[ . 1 . 2 .]" 1
1432 1 105 GLN HB3 1 107 TRP HE1 0.000 . 3.920 3.879 3.411 4.095 0.175 19 0 "[ . 1 . 2 .]" 1
1433 1 106 LYS HA 1 107 TRP H 0.000 . 3.110 2.195 2.163 2.228 . 0 0 "[ . 1 . 2 .]" 1
1434 1 106 LYS HB3 1 107 TRP H 0.000 . 4.570 3.802 3.701 3.897 . 0 0 "[ . 1 . 2 .]" 1
1435 1 107 TRP H 1 157 VAL MG1 0.000 . 5.500 4.361 3.970 5.319 . 0 0 "[ . 1 . 2 .]" 1
1436 1 107 TRP HA 1 108 PHE H 0.000 . 2.740 2.365 2.313 2.454 . 0 0 "[ . 1 . 2 .]" 1
1437 1 107 TRP HA 1 108 PHE QD 0.000 . 5.480 3.285 2.856 3.680 . 0 0 "[ . 1 . 2 .]" 1
1438 1 107 TRP HB3 1 157 VAL MG1 0.000 . 5.370 2.294 2.073 2.946 . 0 0 "[ . 1 . 2 .]" 1
1439 1 107 TRP HD1 1 157 VAL MG2 0.000 . 3.200 2.942 2.525 3.205 0.005 19 0 "[ . 1 . 2 .]" 1
1440 1 107 TRP HE3 1 108 PHE H 0.000 . 4.940 3.054 2.866 3.663 . 0 0 "[ . 1 . 2 .]" 1
1441 1 107 TRP HE3 1 157 VAL MG1 0.000 . 4.570 3.006 2.460 3.485 . 0 0 "[ . 1 . 2 .]" 1
1442 1 107 TRP HE3 1 157 VAL MG2 0.000 . 5.500 3.938 3.571 4.382 . 0 0 "[ . 1 . 2 .]" 1
1443 1 107 TRP HE1 1 153 VAL MG1 0.000 . 3.580 2.600 1.883 3.119 . 0 0 "[ . 1 . 2 .]" 1
1444 1 107 TRP HZ2 1 153 VAL MG1 0.000 . 4.470 3.829 2.860 4.410 . 0 0 "[ . 1 . 2 .]" 1
1445 1 107 TRP HZ2 1 154 TYR QE . . 3.070 1.897 1.746 2.227 0.054 15 0 "[ . 1 . 2 .]" 1
1446 1 108 PHE HA 1 109 LEU H 0.000 . 2.710 2.310 2.257 2.393 . 0 0 "[ . 1 . 2 .]" 1
1447 1 108 PHE HA 1 157 VAL MG1 0.000 . 5.500 4.722 4.444 5.174 . 0 0 "[ . 1 . 2 .]" 1
1448 1 108 PHE HA 1 160 VAL MG1 0.000 . 5.500 5.492 5.344 5.558 0.058 23 0 "[ . 1 . 2 .]" 1
1449 1 108 PHE HB2 1 109 LEU H 0.000 . 3.760 3.836 3.524 3.909 0.149 3 0 "[ . 1 . 2 .]" 1
1450 1 108 PHE HB2 1 110 PHE QE 0.000 . 5.480 2.046 1.506 3.075 0.294 11 0 "[ . 1 . 2 .]" 1
1451 1 108 PHE HB3 1 109 LEU H 0.000 . 3.760 2.682 2.513 2.782 . 0 0 "[ . 1 . 2 .]" 1
1452 1 108 PHE HB3 1 110 PHE QE 0.000 . 5.480 2.230 1.983 2.963 . 0 0 "[ . 1 . 2 .]" 1
1453 1 108 PHE QD 1 109 LEU H 0.000 . 5.480 3.735 3.445 4.091 . 0 0 "[ . 1 . 2 .]" 1
1454 1 109 LEU H 1 110 PHE QD 0.000 . 4.240 3.987 3.756 4.286 0.046 16 0 "[ . 1 . 2 .]" 1
1455 1 109 LEU HA 1 110 PHE H 0.000 . 2.710 2.205 2.161 2.236 . 0 0 "[ . 1 . 2 .]" 1
1456 1 109 LEU HA 1 110 PHE QD 0.000 . 5.480 3.418 2.821 4.313 . 0 0 "[ . 1 . 2 .]" 1
1457 1 109 LEU QB 1 110 PHE H 0.000 . 5.250 3.641 3.540 3.813 . 0 0 "[ . 1 . 2 .]" 1
1458 1 109 LEU MD1 1 110 PHE H 0.000 . 3.080 2.017 1.828 2.407 . 0 0 "[ . 1 . 2 .]" 1
1459 1 109 LEU MD1 1 161 PHE HB3 0.000 . 4.010 3.305 3.119 3.684 . 0 0 "[ . 1 . 2 .]" 1
1460 1 109 LEU MD1 1 161 PHE QD 0.000 . 4.180 2.899 2.396 3.493 . 0 0 "[ . 1 . 2 .]" 1
1461 1 109 LEU MD2 1 110 PHE H 0.000 . 5.500 4.309 4.136 4.642 . 0 0 "[ . 1 . 2 .]" 1
1462 1 109 LEU MD2 1 161 PHE HA 0.000 . 4.720 3.102 2.765 3.552 . 0 0 "[ . 1 . 2 .]" 1
1463 1 109 LEU MD2 1 161 PHE HB2 0.000 . 5.500 3.761 3.310 4.252 . 0 0 "[ . 1 . 2 .]" 1
1464 1 109 LEU MD2 1 161 PHE HB3 0.000 . 5.060 2.342 1.948 2.881 . 0 0 "[ . 1 . 2 .]" 1
1465 1 109 LEU MD2 1 161 PHE QD 0.000 . 5.390 2.913 2.569 3.455 . 0 0 "[ . 1 . 2 .]" 1
1466 1 109 LEU MD2 1 164 HIS H 0.000 . 5.500 4.248 3.992 4.446 . 0 0 "[ . 1 . 2 .]" 1
1467 1 109 LEU MD2 1 164 HIS HA 0.000 . 4.410 4.205 3.871 4.437 0.027 16 0 "[ . 1 . 2 .]" 1
1468 1 109 LEU MD2 1 164 HIS HB2 0.000 . 3.790 2.210 1.963 2.385 . 0 0 "[ . 1 . 2 .]" 1
1469 1 109 LEU MD2 1 164 HIS HB3 0.000 . 3.450 2.237 1.923 2.437 . 0 0 "[ . 1 . 2 .]" 1
1470 1 109 LEU MD2 1 165 LEU MD2 0.000 . 5.500 2.719 2.188 3.023 . 0 0 "[ . 1 . 2 .]" 1
1471 1 110 PHE HA 1 111 LYS H 0.000 . 2.650 2.173 2.137 2.219 . 0 0 "[ . 1 . 2 .]" 1
1472 1 110 PHE HB2 1 111 LYS H 0.000 . 4.230 3.967 3.687 4.180 . 0 0 "[ . 1 . 2 .]" 1
1473 1 110 PHE HB3 1 111 LYS H 0.000 . 3.640 2.849 2.673 3.055 . 0 0 "[ . 1 . 2 .]" 1
1474 1 110 PHE QD 1 111 LYS H 0.000 . 5.480 3.872 3.633 4.189 . 0 0 "[ . 1 . 2 .]" 1
1475 1 111 LYS HA 1 112 PHE H 0.000 . 2.960 2.189 2.169 2.214 . 0 0 "[ . 1 . 2 .]" 1
1476 1 111 LYS HB3 1 112 PHE H 0.000 . 4.200 4.074 3.977 4.209 0.009 4 0 "[ . 1 . 2 .]" 1
1477 1 111 LYS QG 1 112 PHE H 0.000 . 5.000 2.906 2.485 4.051 . 0 0 "[ . 1 . 2 .]" 1
1478 1 111 LYS QG 1 113 THR MG 0.000 . 2.610 2.586 2.323 2.713 0.103 18 0 "[ . 1 . 2 .]" 1
1479 1 111 LYS QE 1 112 PHE H 0.000 . 5.500 4.740 3.746 5.323 . 0 0 "[ . 1 . 2 .]" 1
1480 1 111 LYS QE 1 113 THR MG 0.000 . 4.940 4.307 3.612 4.878 . 0 0 "[ . 1 . 2 .]" 1
1481 1 112 PHE H 1 136 TRP HH2 0.000 . 5.500 5.276 4.111 5.583 0.083 4 0 "[ . 1 . 2 .]" 1
1482 1 112 PHE HA 1 113 THR H 0.000 . 3.550 2.182 2.162 2.208 . 0 0 "[ . 1 . 2 .]" 1
1483 1 112 PHE HA 1 113 THR MG 0.000 . 4.540 3.854 3.677 3.986 . 0 0 "[ . 1 . 2 .]" 1
1484 1 112 PHE HB3 1 136 TRP HH2 0.000 . 5.500 3.442 2.786 3.848 . 0 0 "[ . 1 . 2 .]" 1
1485 1 112 PHE QD 1 113 THR H 0.000 . 5.260 4.139 4.067 4.217 . 0 0 "[ . 1 . 2 .]" 1
1486 1 112 PHE QD 1 113 THR MG 0.000 . 5.480 5.242 5.167 5.289 . 0 0 "[ . 1 . 2 .]" 1
1487 1 112 PHE QD 1 114 GLY H 0.000 . 4.710 2.494 2.125 2.721 . 0 0 "[ . 1 . 2 .]" 1
1488 1 112 PHE QD 1 114 GLY HA3 0.000 . 4.860 4.162 3.697 4.323 . 0 0 "[ . 1 . 2 .]" 1
1489 1 112 PHE QD 1 114 GLY HA2 0.000 . 4.860 4.831 4.405 4.950 0.090 15 0 "[ . 1 . 2 .]" 1
1490 1 112 PHE QD 1 115 GLN H 0.000 . 4.710 4.657 4.146 4.773 0.063 20 0 "[ . 1 . 2 .]" 1
1491 1 112 PHE QD 1 115 GLN HA 0.000 . 4.120 4.145 3.837 4.247 0.127 1 0 "[ . 1 . 2 .]" 1
1492 1 112 PHE QD 1 116 ASP H 0.000 . 5.260 5.033 4.881 5.159 . 0 0 "[ . 1 . 2 .]" 1
1493 1 112 PHE HZ 1 118 GLU HG2 0.000 . 5.140 4.021 1.999 4.635 . 0 0 "[ . 1 . 2 .]" 1
1494 1 112 PHE HZ 1 118 GLU HG3 0.000 . 5.140 4.983 1.727 5.187 0.073 16 0 "[ . 1 . 2 .]" 1
1495 1 112 PHE QD 1 136 TRP HH2 . . 5.480 3.014 2.206 3.423 . 0 0 "[ . 1 . 2 .]" 1
1496 1 112 PHE QE 1 117 GLN H 0.000 . 5.480 4.996 4.806 5.136 . 0 0 "[ . 1 . 2 .]" 1
1497 1 112 PHE QE 1 119 ILE MD 0.000 . 3.220 3.295 3.102 3.388 0.168 21 0 "[ . 1 . 2 .]" 1
1498 1 112 PHE HZ 1 118 GLU HB2 0.000 . 3.520 3.528 2.694 3.609 0.089 13 0 "[ . 1 . 2 .]" 1
1499 1 112 PHE HZ 1 118 GLU HB3 0.000 . 3.520 2.544 2.195 3.802 0.282 16 0 "[ . 1 . 2 .]" 1
1500 1 113 THR H 1 114 GLY H 0.000 . 3.440 3.179 3.025 3.408 . 0 0 "[ . 1 . 2 .]" 1
1501 1 113 THR HA 1 114 GLY H 0.000 . 3.020 2.709 2.577 2.805 . 0 0 "[ . 1 . 2 .]" 1
1502 1 114 GLY H 1 115 GLN H 0.000 . 4.220 4.120 4.067 4.147 . 0 0 "[ . 1 . 2 .]" 1
1503 1 114 GLY HA3 1 115 GLN H 0.000 . 2.900 2.222 2.172 2.245 . 0 0 "[ . 1 . 2 .]" 1
1504 1 114 GLY HA2 1 115 GLN H 0.000 . 2.900 2.967 2.937 3.012 0.112 2 0 "[ . 1 . 2 .]" 1
1505 1 114 GLY QA 1 115 GLN QG 0.000 . 5.500 3.227 2.986 3.620 . 0 0 "[ . 1 . 2 .]" 1
1506 1 115 GLN HA 1 116 ASP H 0.000 . 3.050 2.263 2.207 2.372 . 0 0 "[ . 1 . 2 .]" 1
1507 1 115 GLN HA 1 117 GLN QG 0.000 . 5.500 4.445 3.981 5.119 . 0 0 "[ . 1 . 2 .]" 1
1508 1 115 GLN HB2 1 116 ASP H 0.000 . 3.670 3.395 2.676 3.750 0.080 17 0 "[ . 1 . 2 .]" 1
1509 1 115 GLN HB3 1 116 ASP H 0.000 . 3.670 3.085 2.539 3.743 0.073 20 0 "[ . 1 . 2 .]" 1
1510 1 115 GLN QB 1 117 GLN H 0.000 . 3.240 2.681 2.424 2.878 . 0 0 "[ . 1 . 2 .]" 1
1511 1 115 GLN QG 1 116 ASP H 0.000 . 5.470 4.255 4.041 4.558 . 0 0 "[ . 1 . 2 .]" 1
1512 1 116 ASP H 1 117 GLN H 0.000 . 3.420 2.664 2.571 2.728 . 0 0 "[ . 1 . 2 .]" 1
1513 1 116 ASP H 1 119 ILE MD 0.000 . 5.500 5.124 4.932 5.259 . 0 0 "[ . 1 . 2 .]" 1
1514 1 116 ASP HA 1 119 ILE QG 0.000 . 5.500 2.609 2.401 2.876 . 0 0 "[ . 1 . 2 .]" 1
1515 1 116 ASP HA 1 119 ILE MD 0.000 . 2.830 2.810 2.618 2.871 0.041 5 0 "[ . 1 . 2 .]" 1
1516 1 116 ASP HA 1 136 TRP HE1 0.000 . 5.500 4.061 3.559 4.529 . 0 0 "[ . 1 . 2 .]" 1
1517 1 116 ASP HB2 1 117 GLN H 0.000 . 3.580 3.202 2.665 3.810 0.230 16 0 "[ . 1 . 2 .]" 1
1518 1 116 ASP HB2 1 119 ILE MD 0.000 . 4.630 4.218 3.466 4.735 0.105 10 0 "[ . 1 . 2 .]" 1
1519 1 116 ASP HB2 1 134 TRP HZ2 0.000 . 3.890 3.016 1.882 3.981 0.091 2 0 "[ . 1 . 2 .]" 1
1520 1 116 ASP HB3 1 117 GLN H 0.000 . 3.610 3.792 3.697 3.896 0.286 16 0 "[ . 1 . 2 .]" 1
1521 1 116 ASP HB3 1 119 ILE MD 0.000 . 4.630 3.706 3.134 4.323 . 0 0 "[ . 1 . 2 .]" 1
1522 1 116 ASP HB3 1 134 TRP HZ2 0.000 . 3.640 2.802 2.012 3.620 . 0 0 "[ . 1 . 2 .]" 1
1523 1 116 ASP HB3 1 134 TRP HH2 0.000 . 4.730 2.057 1.677 2.356 0.123 10 0 "[ . 1 . 2 .]" 1
1524 1 116 ASP HB3 1 136 TRP HE1 0.000 . 5.190 2.884 1.989 3.640 . 0 0 "[ . 1 . 2 .]" 1
1525 1 117 GLN H 1 119 ILE MD 0.000 . 5.500 5.529 5.357 5.611 0.111 13 0 "[ . 1 . 2 .]" 1
1526 1 117 GLN QG 1 118 GLU H 0.000 . 4.160 3.369 2.722 4.227 0.067 5 0 "[ . 1 . 2 .]" 1
1527 1 118 GLU H 1 119 ILE H 0.000 . 3.390 2.240 2.168 2.288 . 0 0 "[ . 1 . 2 .]" 1
1528 1 118 GLU H 1 119 ILE MD 0.000 . 5.500 4.670 4.557 4.807 . 0 0 "[ . 1 . 2 .]" 1
1529 1 118 GLU HA 1 119 ILE H 0.000 . 3.330 3.398 3.386 3.423 0.093 16 0 "[ . 1 . 2 .]" 1
1530 1 118 GLU QG 1 119 ILE H 0.000 . 5.500 4.097 3.306 4.322 . 0 0 "[ . 1 . 2 .]" 1
1531 1 118 GLU QG 1 119 ILE MG 0.000 . 5.500 5.367 5.159 5.604 0.104 16 0 "[ . 1 . 2 .]" 1
1532 1 119 ILE H 1 120 ASN H 0.000 . 4.230 4.263 4.183 4.304 0.074 20 0 "[ . 1 . 2 .]" 1
1533 1 119 ILE HA 1 120 ASN H 0.000 . 2.520 2.173 2.150 2.205 . 0 0 "[ . 1 . 2 .]" 1
1534 1 119 ILE HA 1 134 TRP HZ2 0.000 . 5.500 5.589 5.491 5.684 0.184 21 0 "[ . 1 . 2 .]" 1
1535 1 119 ILE HB 1 120 ASN H 0.000 . 4.380 4.318 4.224 4.393 0.013 14 0 "[ . 1 . 2 .]" 1
1536 1 119 ILE HB 1 134 TRP HE1 0.000 . 5.500 2.117 1.765 2.459 0.035 21 0 "[ . 1 . 2 .]" 1
1537 1 119 ILE HB 1 134 TRP HZ2 0.000 . 4.940 2.730 2.609 2.876 . 0 0 "[ . 1 . 2 .]" 1
1538 1 119 ILE MG 1 120 ASN H 0.000 . 3.760 3.172 2.955 3.366 . 0 0 "[ . 1 . 2 .]" 1
1539 1 119 ILE MG 1 120 ASN HA 0.000 . 4.440 4.113 3.948 4.271 . 0 0 "[ . 1 . 2 .]" 1
1540 1 119 ILE MG 1 121 LEU H 0.000 . 5.500 3.097 2.261 3.640 . 0 0 "[ . 1 . 2 .]" 1
1541 1 119 ILE MG 1 121 LEU HA 0.000 . 5.500 3.784 3.363 4.122 . 0 0 "[ . 1 . 2 .]" 1
1542 1 119 ILE MG 1 121 LEU HG 0.000 . 5.130 2.611 2.054 3.100 . 0 0 "[ . 1 . 2 .]" 1
1543 1 119 ILE MG 1 134 TRP HD1 0.000 . 4.290 2.628 2.195 3.495 . 0 0 "[ . 1 . 2 .]" 1
1544 1 119 ILE MG 1 134 TRP HE1 0.000 . 3.610 2.502 2.147 3.216 . 0 0 "[ . 1 . 2 .]" 1
1545 1 119 ILE MG 1 134 TRP HZ2 0.000 . 5.500 3.941 3.750 4.123 . 0 0 "[ . 1 . 2 .]" 1
1546 1 119 ILE HG12 1 120 ASN H 0.000 . 5.440 4.738 4.587 4.859 . 0 0 "[ . 1 . 2 .]" 1
1547 1 119 ILE HG13 1 120 ASN H 0.000 . 5.440 5.231 5.187 5.294 . 0 0 "[ . 1 . 2 .]" 1
1548 1 119 ILE QG 1 134 TRP HZ2 0.000 . 5.500 3.432 3.182 3.693 . 0 0 "[ . 1 . 2 .]" 1
1549 1 119 ILE MD 1 120 ASN H 0.000 . 5.500 5.403 5.350 5.476 . 0 0 "[ . 1 . 2 .]" 1
1550 1 119 ILE MD 1 121 LEU MD1 0.000 . 5.500 5.169 4.768 5.477 . 0 0 "[ . 1 . 2 .]" 1
1551 1 119 ILE MD 1 121 LEU MD2 0.000 . 3.790 3.853 3.696 3.958 0.168 19 0 "[ . 1 . 2 .]" 1
1552 1 119 ILE MD 1 134 TRP HZ3 0.000 . 5.370 3.591 3.314 3.956 . 0 0 "[ . 1 . 2 .]" 1
1553 1 119 ILE MD 1 134 TRP HZ2 0.000 . 2.520 2.664 2.602 2.755 0.235 3 0 "[ . 1 . 2 .]" 1
1554 1 119 ILE MD 1 134 TRP HH2 0.000 . 3.510 2.962 2.633 3.278 . 0 0 "[ . 1 . 2 .]" 1
1555 1 119 ILE MD 1 136 TRP HE1 0.000 . 5.310 3.971 2.717 4.592 . 0 0 "[ . 1 . 2 .]" 1
1556 1 120 ASN H 1 121 LEU H 0.000 . 5.500 2.851 2.020 4.119 . 0 0 "[ . 1 . 2 .]" 1
1557 1 120 ASN HA 1 121 LEU HB2 0.000 . 5.500 4.559 4.276 5.005 . 0 0 "[ . 1 . 2 .]" 1
1558 1 120 ASN QB 1 122 LEU H 0.000 . 4.540 3.270 2.428 4.602 0.062 23 0 "[ . 1 . 2 .]" 1
1559 1 120 ASN QD 1 123 GLY H 0.000 . 5.340 4.557 1.879 5.352 0.012 12 0 "[ . 1 . 2 .]" 1
1560 1 121 LEU H 1 122 LEU H 0.000 . 3.140 2.982 2.545 3.262 0.122 19 0 "[ . 1 . 2 .]" 1
1561 1 121 LEU HG 1 134 TRP HD1 0.000 . 4.200 2.241 1.524 2.566 0.276 21 0 "[ . 1 . 2 .]" 1
1562 1 121 LEU HG 1 134 TRP HE1 0.000 . 5.350 3.400 2.954 3.841 . 0 0 "[ . 1 . 2 .]" 1
1563 1 121 LEU MD1 1 131 PHE HA 0.000 . 5.500 4.355 3.951 4.963 . 0 0 "[ . 1 . 2 .]" 1
1564 1 121 LEU MD1 1 131 PHE HB2 0.000 . 3.230 2.340 1.877 3.093 . 0 0 "[ . 1 . 2 .]" 1
1565 1 121 LEU MD1 1 131 PHE HB3 0.000 . 4.470 3.368 2.621 3.967 . 0 0 "[ . 1 . 2 .]" 1
1566 1 121 LEU MD1 1 132 GLY H 0.000 . 5.500 3.967 3.549 4.457 . 0 0 "[ . 1 . 2 .]" 1
1567 1 121 LEU MD1 1 133 GLU HA 0.000 . 2.520 2.492 1.948 2.665 0.145 8 0 "[ . 1 . 2 .]" 1
1568 1 121 LEU MD1 1 134 TRP H 0.000 . 4.040 3.004 2.527 3.322 . 0 0 "[ . 1 . 2 .]" 1
1569 1 121 LEU MD1 1 134 TRP HA 0.000 . 5.280 4.058 3.205 4.495 . 0 0 "[ . 1 . 2 .]" 1
1570 1 121 LEU MD1 1 134 TRP HB2 0.000 . 5.130 4.071 3.280 4.526 . 0 0 "[ . 1 . 2 .]" 1
1571 1 121 LEU MD1 1 134 TRP HB3 0.000 . 3.950 2.563 1.835 3.090 . 0 0 "[ . 1 . 2 .]" 1
1572 1 121 LEU MD1 1 134 TRP HD1 0.000 . 2.610 1.912 1.799 2.054 0.001 21 0 "[ . 1 . 2 .]" 1
1573 1 121 LEU MD2 1 131 PHE H 0.000 . 5.500 3.741 3.461 4.043 . 0 0 "[ . 1 . 2 .]" 1
1574 1 121 LEU MD2 1 131 PHE HB2 0.000 . 3.700 2.155 1.966 2.380 . 0 0 "[ . 1 . 2 .]" 1
1575 1 121 LEU MD2 1 131 PHE HB3 0.000 . 3.580 3.530 3.258 3.637 0.057 13 0 "[ . 1 . 2 .]" 1
1576 1 121 LEU MD2 1 134 TRP HB3 0.000 . 4.820 2.698 2.452 2.955 . 0 0 "[ . 1 . 2 .]" 1
1577 1 121 LEU MD2 1 134 TRP HD1 0.000 . 2.740 2.158 1.819 2.801 0.061 21 0 "[ . 1 . 2 .]" 1
1578 1 121 LEU MD2 1 134 TRP HE1 0.000 . 4.260 3.673 3.369 4.321 0.061 21 0 "[ . 1 . 2 .]" 1
1579 1 122 LEU HA 1 123 GLY H 0.000 . 3.110 2.630 2.225 3.191 0.081 21 0 "[ . 1 . 2 .]" 1
1580 1 122 LEU HB2 1 123 GLY H 0.000 . 3.640 3.446 2.512 3.766 0.126 21 0 "[ . 1 . 2 .]" 1
1581 1 122 LEU MD1 1 129 PRO QG 0.000 . 4.630 3.819 1.731 4.717 0.087 13 0 "[ . 1 . 2 .]" 1
1582 1 122 LEU MD1 1 129 PRO QD 0.000 . 5.470 4.714 1.750 5.616 0.146 13 0 "[ . 1 . 2 .]" 1
1583 1 122 LEU MD2 1 123 GLY H 0.000 . 5.220 3.697 2.446 5.156 . 0 0 "[ . 1 . 2 .]" 1
1584 1 122 LEU MD2 1 129 PRO HA 0.000 . 3.760 3.600 2.729 3.911 0.151 12 0 "[ . 1 . 2 .]" 1
1585 1 122 LEU MD2 1 129 PRO HB2 0.000 . 3.080 2.832 2.232 3.254 0.174 7 0 "[ . 1 . 2 .]" 1
1586 1 122 LEU MD2 1 129 PRO HB3 0.000 . 3.080 1.828 1.471 2.101 0.329 19 0 "[ . 1 . 2 .]" 1
1587 1 122 LEU MD2 1 129 PRO HG2 0.000 . 3.520 3.218 2.354 3.777 0.257 19 0 "[ . 1 . 2 .]" 1
1588 1 122 LEU MD2 1 129 PRO HG3 0.000 . 3.520 2.172 1.739 3.396 0.061 16 0 "[ . 1 . 2 .]" 1
1589 1 122 LEU MD2 1 129 PRO HD2 0.000 . 5.500 4.226 3.552 5.134 . 0 0 "[ . 1 . 2 .]" 1
1590 1 122 LEU MD2 1 129 PRO HD3 0.000 . 5.500 3.477 2.435 5.101 . 0 0 "[ . 1 . 2 .]" 1
1591 1 123 GLY H 1 124 ASP H 0.000 . 3.800 3.023 1.537 3.980 0.263 19 0 "[ . 1 . 2 .]" 1
1592 1 123 GLY HA3 1 124 ASP H 0.000 . 3.100 2.951 2.088 3.471 0.371 11 0 "[ . 1 . 2 .]" 1
1593 1 123 GLY HA2 1 124 ASP H 0.000 . 3.100 2.838 2.088 3.313 0.213 12 0 "[ . 1 . 2 .]" 1
1594 1 123 GLY QA 1 124 ASP HA 0.000 . 4.450 4.071 3.916 4.547 0.097 25 0 "[ . 1 . 2 .]" 1
1595 1 124 ASP HA 1 125 GLY H 0.000 . 3.330 2.566 2.146 3.434 0.104 11 0 "[ . 1 . 2 .]" 1
1596 1 124 ASP HA 1 125 GLY QA 0.000 . 4.730 4.034 3.899 4.264 . 0 0 "[ . 1 . 2 .]" 1
1597 1 126 SER H 1 127 GLU H 0.000 . 2.740 2.441 1.947 2.781 0.041 16 0 "[ . 1 . 2 .]" 1
1598 1 126 SER HA 1 127 GLU H 0.000 . 3.520 3.371 2.985 3.569 0.049 13 0 "[ . 1 . 2 .]" 1
1599 1 126 SER HB2 1 127 GLU H 0.000 . 4.230 3.631 2.083 4.445 0.215 18 0 "[ . 1 . 2 .]" 1
1600 1 126 SER HB3 1 127 GLU H 0.000 . 4.230 3.681 2.626 4.287 0.057 11 0 "[ . 1 . 2 .]" 1
1601 1 127 GLU H 1 128 LYS H 0.000 . 3.300 2.541 1.906 3.433 0.133 19 0 "[ . 1 . 2 .]" 1
1602 1 127 GLU HB2 1 128 LYS H 0.000 . 3.210 2.901 2.122 3.259 0.049 9 0 "[ . 1 . 2 .]" 1
1603 1 127 GLU HB3 1 128 LYS H 0.000 . 2.870 2.475 1.841 2.863 . 0 0 "[ . 1 . 2 .]" 1
1604 1 127 GLU HG2 1 128 LYS H 0.000 . 5.500 4.596 3.909 5.022 . 0 0 "[ . 1 . 2 .]" 1
1605 1 127 GLU HG3 1 128 LYS H 0.000 . 5.500 4.773 4.343 5.194 . 0 0 "[ . 1 . 2 .]" 1
1606 1 128 LYS H 1 129 PRO QD 0.000 . 5.500 4.217 4.083 4.366 . 0 0 "[ . 1 . 2 .]" 1
1607 1 128 LYS HA 1 129 PRO QG 0.000 . 3.920 3.963 3.744 4.090 0.170 6 0 "[ . 1 . 2 .]" 1
1608 1 128 LYS HA 1 129 PRO HD2 0.000 . 2.600 2.601 2.342 2.751 0.151 18 0 "[ . 1 . 2 .]" 1
1609 1 128 LYS HA 1 129 PRO HD3 0.000 . 2.600 2.163 1.832 2.649 0.049 25 0 "[ . 1 . 2 .]" 1
1610 1 128 LYS QB 1 129 PRO HD2 0.000 . 2.910 1.911 1.512 2.455 0.288 25 0 "[ . 1 . 2 .]" 1
1611 1 128 LYS QB 1 129 PRO HD3 0.000 . 2.910 3.034 2.951 3.122 0.212 3 0 "[ . 1 . 2 .]" 1
1612 1 128 LYS QG 1 129 PRO QG 0.000 . 5.500 4.467 3.609 5.207 . 0 0 "[ . 1 . 2 .]" 1
1613 1 128 LYS QG 1 129 PRO HD2 0.000 . 5.120 3.269 2.455 3.938 . 0 0 "[ . 1 . 2 .]" 1
1614 1 128 LYS QG 1 129 PRO HD3 0.000 . 5.120 4.153 2.834 4.451 . 0 0 "[ . 1 . 2 .]" 1
1615 1 129 PRO HA 1 130 GLU H 0.000 . 2.590 2.575 2.365 2.713 0.123 19 0 "[ . 1 . 2 .]" 1
1616 1 129 PRO HB2 1 130 GLU H 0.000 . 3.330 2.265 2.083 2.683 . 0 0 "[ . 1 . 2 .]" 1
1617 1 129 PRO HB2 1 131 PHE H 0.000 . 5.070 3.261 2.502 3.749 . 0 0 "[ . 1 . 2 .]" 1
1618 1 129 PRO HB3 1 130 GLU H 0.000 . 3.330 3.035 2.344 3.379 0.049 21 0 "[ . 1 . 2 .]" 1
1619 1 129 PRO HB3 1 131 PHE H 0.000 . 5.070 4.572 3.309 5.099 0.029 10 0 "[ . 1 . 2 .]" 1
1620 1 129 PRO HG2 1 130 GLU H 0.000 . 5.280 4.312 4.133 4.590 . 0 0 "[ . 1 . 2 .]" 1
1621 1 129 PRO HG3 1 130 GLU H 0.000 . 5.280 4.797 4.465 5.130 . 0 0 "[ . 1 . 2 .]" 1
1622 1 129 PRO HD2 1 130 GLU H 0.000 . 5.500 5.306 4.925 5.587 0.087 21 0 "[ . 1 . 2 .]" 1
1623 1 129 PRO HD3 1 130 GLU H 0.000 . 5.500 5.502 5.240 5.580 0.080 9 0 "[ . 1 . 2 .]" 1
1624 1 130 GLU QB 1 131 PHE H 0.000 . 3.640 2.355 1.995 2.769 . 0 0 "[ . 1 . 2 .]" 1
1625 1 130 GLU QB 1 131 PHE QD 0.000 . 5.080 3.022 2.485 3.426 . 0 0 "[ . 1 . 2 .]" 1
1626 1 130 GLU QG 1 131 PHE H 0.000 . 5.130 4.055 3.106 4.553 . 0 0 "[ . 1 . 2 .]" 1
1627 1 130 GLU QG 1 131 PHE QE 0.000 . 5.480 3.602 2.138 4.655 . 0 0 "[ . 1 . 2 .]" 1
1628 1 131 PHE HA 1 132 GLY H 0.000 . 2.960 2.197 2.163 2.228 . 0 0 "[ . 1 . 2 .]" 1
1629 1 131 PHE HA 1 133 GLU H 0.000 . 3.890 4.018 3.941 4.070 0.180 21 0 "[ . 1 . 2 .]" 1
1630 1 131 PHE HB2 1 132 GLY H 0.000 . 3.640 3.695 3.659 3.751 0.111 9 0 "[ . 1 . 2 .]" 1
1631 1 131 PHE HB2 1 133 GLU H 0.000 . 5.500 3.851 3.707 3.976 . 0 0 "[ . 1 . 2 .]" 1
1632 1 131 PHE HB3 1 132 GLY H 0.000 . 3.760 3.022 2.877 3.114 . 0 0 "[ . 1 . 2 .]" 1
1633 1 131 PHE HB3 1 133 GLU H 0.000 . 4.040 3.345 3.190 3.461 . 0 0 "[ . 1 . 2 .]" 1
1634 1 131 PHE QD 1 132 GLY H 0.000 . 5.480 4.424 4.304 4.584 . 0 0 "[ . 1 . 2 .]" 1
1635 1 131 PHE QD 1 133 GLU H 0.000 . 5.480 5.193 5.054 5.284 . 0 0 "[ . 1 . 2 .]" 1
1636 1 132 GLY H 1 133 GLU H 0.000 . 2.870 2.322 2.196 2.441 . 0 0 "[ . 1 . 2 .]" 1
1637 1 132 GLY HA3 1 133 GLU H 0.000 . 3.520 2.871 2.830 2.948 . 0 0 "[ . 1 . 2 .]" 1
1638 1 132 GLY HA2 1 133 GLU H 0.000 . 3.520 3.496 3.478 3.510 . 0 0 "[ . 1 . 2 .]" 1
1639 1 132 GLY QA 1 133 GLU QG 0.000 . 5.500 4.753 3.094 5.205 . 0 0 "[ . 1 . 2 .]" 1
1640 1 133 GLU H 1 134 TRP H 0.000 . 5.190 4.341 4.292 4.390 . 0 0 "[ . 1 . 2 .]" 1
1641 1 133 GLU HA 1 134 TRP H 0.000 . 2.520 2.267 2.196 2.330 . 0 0 "[ . 1 . 2 .]" 1
1642 1 133 GLU HA 1 134 TRP HD1 0.000 . 3.920 3.992 3.909 4.078 0.158 19 0 "[ . 1 . 2 .]" 1
1643 1 133 GLU QG 1 134 TRP H 0.000 . 4.260 2.836 2.336 4.361 0.101 15 0 "[ . 1 . 2 .]" 1
1644 1 133 GLU QG 1 134 TRP HA 0.000 . 5.500 4.643 4.509 4.725 . 0 0 "[ . 1 . 2 .]" 1
1645 1 134 TRP H 1 135 SER H 0.000 . 5.470 4.437 4.408 4.456 . 0 0 "[ . 1 . 2 .]" 1
1646 1 134 TRP HA 1 135 SER H 0.000 . 3.140 2.441 2.385 2.524 . 0 0 "[ . 1 . 2 .]" 1
1647 1 134 TRP HB2 1 135 SER H 0.000 . 3.180 2.379 2.302 2.460 . 0 0 "[ . 1 . 2 .]" 1
1648 1 134 TRP HB3 1 135 SER H 0.000 . 3.650 3.773 3.710 3.823 0.173 9 0 "[ . 1 . 2 .]" 1
1649 1 134 TRP HE3 1 135 SER H 0.000 . 3.670 2.295 2.038 2.606 . 0 0 "[ . 1 . 2 .]" 1
1650 1 134 TRP HE3 1 135 SER HA 0.000 . 3.550 2.359 1.995 2.897 . 0 0 "[ . 1 . 2 .]" 1
1651 1 134 TRP HE3 1 136 TRP H 0.000 . 5.500 4.055 3.749 4.398 . 0 0 "[ . 1 . 2 .]" 1
1652 1 134 TRP HZ3 1 136 TRP HD1 . . 3.450 2.906 1.808 3.485 0.035 18 0 "[ . 1 . 2 .]" 1
1653 1 134 TRP HZ3 1 136 TRP HE1 0.000 . 4.170 2.471 2.047 2.912 . 0 0 "[ . 1 . 2 .]" 1
1654 1 134 TRP HH2 1 136 TRP HE1 0.000 . 3.860 2.041 1.779 2.755 0.021 8 0 "[ . 1 . 2 .]" 1
1655 1 135 SER HA 1 136 TRP H 0.000 . 2.520 2.473 2.361 2.538 0.018 12 0 "[ . 1 . 2 .]" 1
1656 1 135 SER HB2 1 136 TRP H 0.000 . 3.450 3.585 3.532 3.696 0.246 20 0 "[ . 1 . 2 .]" 1
1657 1 135 SER HB2 1 137 VAL MG1 0.000 . 3.940 4.089 4.034 4.118 0.178 17 0 "[ . 1 . 2 .]" 1
1658 1 135 SER HB3 1 136 TRP H 0.000 . 4.570 3.349 3.097 3.741 . 0 0 "[ . 1 . 2 .]" 1
1659 1 135 SER HB3 1 137 VAL MG1 0.000 . 2.960 2.786 2.667 3.028 0.068 3 0 "[ . 1 . 2 .]" 1
1660 1 136 TRP H 1 137 VAL H 0.000 . 5.500 4.091 4.000 4.168 . 0 0 "[ . 1 . 2 .]" 1
1661 1 136 TRP H 1 137 VAL MG1 0.000 . 5.250 3.640 3.546 3.736 . 0 0 "[ . 1 . 2 .]" 1
1662 1 136 TRP HA 1 137 VAL H 0.000 . 2.710 2.163 2.100 2.198 . 0 0 "[ . 1 . 2 .]" 1
1663 1 136 TRP HE3 1 137 VAL H 0.000 . 5.500 4.432 3.967 4.671 . 0 0 "[ . 1 . 2 .]" 1
1664 1 137 VAL HA 1 138 THR H 0.000 . 2.800 2.507 2.432 2.563 . 0 0 "[ . 1 . 2 .]" 1
1665 1 137 VAL HA 1 138 THR MG 0.000 . 5.500 3.612 3.538 3.687 . 0 0 "[ . 1 . 2 .]" 1
1666 1 137 VAL HA 1 141 GLN HB2 0.000 . 4.170 4.188 4.068 4.274 0.104 10 0 "[ . 1 . 2 .]" 1
1667 1 137 VAL HA 1 141 GLN HB3 0.000 . 4.350 4.219 4.123 4.392 0.042 10 0 "[ . 1 . 2 .]" 1
1668 1 137 VAL HB 1 138 THR H 0.000 . 3.390 2.363 2.247 2.487 . 0 0 "[ . 1 . 2 .]" 1
1669 1 137 VAL MG1 1 138 THR H 0.000 . 3.920 3.754 3.694 3.813 . 0 0 "[ . 1 . 2 .]" 1
1670 1 137 VAL MG1 1 141 GLN HB2 0.000 . 5.060 4.308 4.178 4.423 . 0 0 "[ . 1 . 2 .]" 1
1671 1 137 VAL MG1 1 141 GLN HB3 0.000 . 4.600 3.412 3.176 3.568 . 0 0 "[ . 1 . 2 .]" 1
1672 1 137 VAL MG1 1 142 LEU MD1 0.000 . 4.160 4.071 3.800 4.208 0.048 21 0 "[ . 1 . 2 .]" 1
1673 1 137 VAL MG1 1 145 LEU MD1 0.000 . 3.330 2.539 2.194 2.787 . 0 0 "[ . 1 . 2 .]" 1
1674 1 137 VAL MG2 1 138 THR H 0.000 . 4.290 3.231 3.136 3.362 . 0 0 "[ . 1 . 2 .]" 1
1675 1 137 VAL MG2 1 139 PRO HA 0.000 . 5.500 4.403 4.165 4.537 . 0 0 "[ . 1 . 2 .]" 1
1676 1 137 VAL MG2 1 141 GLN HB3 0.000 . 5.500 3.048 2.879 3.256 . 0 0 "[ . 1 . 2 .]" 1
1677 1 137 VAL MG2 1 142 LEU H 0.000 . 3.640 2.375 2.225 2.626 . 0 0 "[ . 1 . 2 .]" 1
1678 1 137 VAL MG2 1 142 LEU HA 0.000 . 3.580 2.132 1.906 2.424 . 0 0 "[ . 1 . 2 .]" 1
1679 1 137 VAL MG2 1 142 LEU HB2 0.000 . 2.920 1.883 1.776 1.942 0.024 7 0 "[ . 1 . 2 .]" 1
1680 1 137 VAL MG2 1 142 LEU HB3 0.000 . 3.140 3.105 3.039 3.165 0.025 3 0 "[ . 1 . 2 .]" 1
1681 1 137 VAL MG2 1 142 LEU MD1 0.000 . 2.950 2.443 2.295 2.548 . 0 0 "[ . 1 . 2 .]" 1
1682 1 137 VAL MG2 1 145 LEU MD1 0.000 . 5.500 3.042 2.619 3.279 . 0 0 "[ . 1 . 2 .]" 1
1683 1 138 THR H 1 141 GLN H 0.000 . 4.540 3.873 3.811 3.957 . 0 0 "[ . 1 . 2 .]" 1
1684 1 138 THR H 1 141 GLN HB2 0.000 . 3.270 2.005 1.940 2.136 . 0 0 "[ . 1 . 2 .]" 1
1685 1 138 THR H 1 142 LEU H 0.000 . 4.730 4.013 3.905 4.100 . 0 0 "[ . 1 . 2 .]" 1
1686 1 138 THR HA 1 139 PRO HG2 0.000 . 5.130 4.794 4.709 4.979 . 0 0 "[ . 1 . 2 .]" 1
1687 1 138 THR HA 1 139 PRO HG3 0.000 . 5.130 4.228 4.161 4.497 . 0 0 "[ . 1 . 2 .]" 1
1688 1 138 THR HA 1 139 PRO HD2 0.000 . 3.130 3.130 3.041 3.212 0.082 21 0 "[ . 1 . 2 .]" 1
1689 1 138 THR HA 1 139 PRO HD3 0.000 . 3.130 2.160 2.087 2.329 . 0 0 "[ . 1 . 2 .]" 1
1690 1 138 THR HB 1 139 PRO HA 0.000 . 5.100 4.938 4.918 4.980 . 0 0 "[ . 1 . 2 .]" 1
1691 1 138 THR HB 1 139 PRO QG 0.000 . 5.500 3.764 3.657 3.842 . 0 0 "[ . 1 . 2 .]" 1
1692 1 138 THR HB 1 139 PRO HD2 0.000 . 3.360 1.816 1.733 1.865 0.067 10 0 "[ . 1 . 2 .]" 1
1693 1 138 THR HB 1 139 PRO HD3 0.000 . 3.360 2.428 2.319 2.577 . 0 0 "[ . 1 . 2 .]" 1
1694 1 138 THR HB 1 140 GLU H 0.000 . 3.550 3.478 3.377 3.621 0.071 21 0 "[ . 1 . 2 .]" 1
1695 1 138 THR MG 1 139 PRO HD2 0.000 . 3.430 3.542 3.493 3.596 0.166 21 0 "[ . 1 . 2 .]" 1
1696 1 138 THR MG 1 139 PRO HD3 0.000 . 3.430 3.561 3.499 3.664 0.234 10 0 "[ . 1 . 2 .]" 1
1697 1 138 THR MG 1 140 GLU H 0.000 . 5.500 4.712 4.575 4.845 . 0 0 "[ . 1 . 2 .]" 1
1698 1 138 THR MG 1 140 GLU HB2 0.000 . 5.500 5.048 4.744 5.348 . 0 0 "[ . 1 . 2 .]" 1
1699 1 138 THR MG 1 140 GLU HB3 0.000 . 5.500 5.526 5.383 5.584 0.084 7 0 "[ . 1 . 2 .]" 1
1700 1 138 THR MG 1 141 GLN H 0.000 . 4.100 3.959 3.858 4.062 . 0 0 "[ . 1 . 2 .]" 1
1701 1 138 THR MG 1 141 GLN HB3 0.000 . 3.980 4.022 3.946 4.107 0.127 3 0 "[ . 1 . 2 .]" 1
1702 1 138 THR MG 1 141 GLN QG 0.000 . 5.060 2.618 2.203 3.101 . 0 0 "[ . 1 . 2 .]" 1
1703 1 139 PRO HA 1 142 LEU H 0.000 . 4.410 3.651 3.417 3.770 . 0 0 "[ . 1 . 2 .]" 1
1704 1 139 PRO HA 1 142 LEU HB3 0.000 . 5.280 3.083 2.805 3.261 . 0 0 "[ . 1 . 2 .]" 1
1705 1 139 PRO HA 1 142 LEU MD1 0.000 . 5.500 5.067 4.737 5.560 0.060 7 0 "[ . 1 . 2 .]" 1
1706 1 139 PRO HA 1 142 LEU MD2 0.000 . 4.350 3.585 3.379 3.871 . 0 0 "[ . 1 . 2 .]" 1
1707 1 139 PRO HA 1 158 LEU MD1 0.000 . 3.300 2.628 2.323 3.366 0.066 10 0 "[ . 1 . 2 .]" 1
1708 1 139 PRO HA 1 158 LEU MD2 0.000 . 3.760 2.692 2.437 3.920 0.160 10 0 "[ . 1 . 2 .]" 1
1709 1 139 PRO HB2 1 140 GLU H 0.000 . 2.940 2.321 2.153 2.902 . 0 0 "[ . 1 . 2 .]" 1
1710 1 139 PRO HB2 1 158 LEU MD1 0.000 . 2.960 2.174 1.893 2.330 . 0 0 "[ . 1 . 2 .]" 1
1711 1 139 PRO HB2 1 158 LEU MD2 0.000 . 2.920 2.944 1.481 3.171 0.319 10 0 "[ . 1 . 2 .]" 1
1712 1 139 PRO HB3 1 140 GLU H 0.000 . 3.980 3.744 3.638 3.973 . 0 0 "[ . 1 . 2 .]" 1
1713 1 139 PRO HB3 1 143 ILE MD 0.000 . 5.500 5.141 4.892 5.501 0.001 17 0 "[ . 1 . 2 .]" 1
1714 1 139 PRO HB3 1 165 LEU MD1 0.000 . 5.500 2.293 1.968 3.080 . 0 0 "[ . 1 . 2 .]" 1
1715 1 139 PRO QG 1 140 GLU H 0.000 . 4.440 3.253 2.548 3.435 . 0 0 "[ . 1 . 2 .]" 1
1716 1 139 PRO QG 1 158 LEU HB3 0.000 . 4.690 4.603 4.092 4.752 0.062 10 0 "[ . 1 . 2 .]" 1
1717 1 139 PRO QG 1 158 LEU MD1 0.000 . 3.860 3.677 3.541 3.816 . 0 0 "[ . 1 . 2 .]" 1
1718 1 139 PRO QG 1 158 LEU MD2 0.000 . 5.500 3.219 1.913 3.417 . 0 0 "[ . 1 . 2 .]" 1
1719 1 139 PRO QG 1 165 LEU MD1 0.000 . 5.500 2.024 1.843 2.374 . 0 0 "[ . 1 . 2 .]" 1
1720 1 140 GLU H 1 141 GLN H 0.000 . 3.140 2.599 2.550 2.697 . 0 0 "[ . 1 . 2 .]" 1
1721 1 140 GLU HA 1 143 ILE H 0.000 . 3.490 3.528 3.488 3.576 0.086 20 0 "[ . 1 . 2 .]" 1
1722 1 140 GLU HA 1 143 ILE HB 0.000 . 3.080 2.970 2.674 3.082 0.002 13 0 "[ . 1 . 2 .]" 1
1723 1 140 GLU QG 1 158 LEU MD1 0.000 . 3.420 3.442 3.181 3.519 0.099 17 0 "[ . 1 . 2 .]" 1
1724 1 141 GLN H 1 142 LEU H 0.000 . 3.080 2.579 2.538 2.622 . 0 0 "[ . 1 . 2 .]" 1
1725 1 141 GLN H 1 143 ILE H 0.000 . 3.800 3.912 3.838 3.953 0.153 14 0 "[ . 1 . 2 .]" 1
1726 1 141 GLN HA 1 143 ILE H 0.000 . 4.230 4.246 4.198 4.277 0.047 9 0 "[ . 1 . 2 .]" 1
1727 1 141 GLN HA 1 144 ASP QB 0.000 . 2.680 2.601 2.524 2.681 0.001 16 0 "[ . 1 . 2 .]" 1
1728 1 141 GLN HA 1 145 LEU MD1 0.000 . 5.500 3.402 3.212 3.610 . 0 0 "[ . 1 . 2 .]" 1
1729 1 141 GLN HB2 1 142 LEU H 0.000 . 3.270 2.715 2.629 2.836 . 0 0 "[ . 1 . 2 .]" 1
1730 1 141 GLN HB2 1 145 LEU MD1 0.000 . 4.200 4.091 3.886 4.209 0.009 1 0 "[ . 1 . 2 .]" 1
1731 1 141 GLN HB3 1 142 LEU H 0.000 . 4.820 3.170 3.097 3.250 . 0 0 "[ . 1 . 2 .]" 1
1732 1 141 GLN HB3 1 145 LEU MD1 0.000 . 4.100 2.680 2.473 2.800 . 0 0 "[ . 1 . 2 .]" 1
1733 1 141 GLN HG2 1 145 LEU MD1 0.000 . 5.500 3.966 3.340 4.651 . 0 0 "[ . 1 . 2 .]" 1
1734 1 141 GLN HG3 1 145 LEU MD1 0.000 . 5.500 4.289 3.192 4.836 . 0 0 "[ . 1 . 2 .]" 1
1735 1 141 GLN QE 1 145 LEU MD1 0.000 . 5.490 4.017 2.020 5.458 . 0 0 "[ . 1 . 2 .]" 1
1736 1 142 LEU H 1 143 ILE H 0.000 . 3.360 2.684 2.635 2.725 . 0 0 "[ . 1 . 2 .]" 1
1737 1 142 LEU HA 1 145 LEU H 0.000 . 3.640 3.437 3.319 3.523 . 0 0 "[ . 1 . 2 .]" 1
1738 1 142 LEU HA 1 145 LEU HB2 0.000 . 3.830 2.753 2.617 2.841 . 0 0 "[ . 1 . 2 .]" 1
1739 1 142 LEU HA 1 145 LEU HB3 0.000 . 4.850 4.254 4.132 4.372 . 0 0 "[ . 1 . 2 .]" 1
1740 1 142 LEU HA 1 145 LEU HG 0.000 . 5.500 5.454 5.248 5.541 0.041 2 0 "[ . 1 . 2 .]" 1
1741 1 142 LEU HA 1 145 LEU MD1 0.000 . 4.350 3.157 3.007 3.314 . 0 0 "[ . 1 . 2 .]" 1
1742 1 142 LEU HA 1 145 LEU MD2 0.000 . 4.880 4.819 4.661 4.923 0.043 23 0 "[ . 1 . 2 .]" 1
1743 1 142 LEU HA 1 146 THR MG 0.000 . 5.500 4.605 4.508 4.744 . 0 0 "[ . 1 . 2 .]" 1
1744 1 142 LEU HB2 1 143 ILE H 0.000 . 4.260 3.952 3.849 4.022 . 0 0 "[ . 1 . 2 .]" 1
1745 1 142 LEU HB3 1 143 ILE H 0.000 . 3.800 2.654 2.520 2.745 . 0 0 "[ . 1 . 2 .]" 1
1746 1 142 LEU HG 1 146 THR HA 0.000 . 4.880 4.615 4.425 4.897 0.017 10 0 "[ . 1 . 2 .]" 1
1747 1 142 LEU HG 1 146 THR HB 0.000 . 3.700 2.460 2.331 2.727 . 0 0 "[ . 1 . 2 .]" 1
1748 1 142 LEU HG 1 154 TYR QD 0.000 . 5.500 2.960 2.511 3.220 . 0 0 "[ . 1 . 2 .]" 1
1749 1 142 LEU HG 1 154 TYR QE 0.000 . 5.490 3.843 3.410 4.168 . 0 0 "[ . 1 . 2 .]" 1
1750 1 142 LEU MD1 1 145 LEU MD1 0.000 . 5.220 4.717 3.932 5.037 . 0 0 "[ . 1 . 2 .]" 1
1751 1 142 LEU MD1 1 145 LEU MD2 0.000 . 5.500 5.316 4.616 5.575 0.075 2 0 "[ . 1 . 2 .]" 1
1752 1 142 LEU MD1 1 146 THR HB 0.000 . 3.790 3.362 2.453 3.783 . 0 0 "[ . 1 . 2 .]" 1
1753 1 142 LEU MD1 1 154 TYR QD 0.000 . 4.880 3.744 3.412 3.993 . 0 0 "[ . 1 . 2 .]" 1
1754 1 142 LEU MD1 1 154 TYR QE 0.000 . 3.660 3.509 2.819 3.773 0.113 11 0 "[ . 1 . 2 .]" 1
1755 1 142 LEU MD2 1 143 ILE H 0.000 . 5.500 3.704 3.338 4.577 . 0 0 "[ . 1 . 2 .]" 1
1756 1 142 LEU MD2 1 154 TYR HB3 0.000 . 5.160 2.847 2.422 4.247 . 0 0 "[ . 1 . 2 .]" 1
1757 1 142 LEU MD2 1 154 TYR QD 0.000 . 4.260 2.129 1.806 3.354 . 0 0 "[ . 1 . 2 .]" 1
1758 1 142 LEU MD2 1 154 TYR QE 0.000 . 4.870 3.240 2.801 3.547 . 0 0 "[ . 1 . 2 .]" 1
1759 1 143 ILE H 1 144 ASP H 0.000 . 3.020 2.637 2.597 2.698 . 0 0 "[ . 1 . 2 .]" 1
1760 1 143 ILE H 1 144 ASP QB 0.000 . 4.720 4.341 4.304 4.387 . 0 0 "[ . 1 . 2 .]" 1
1761 1 143 ILE HA 1 144 ASP H 0.000 . 3.580 3.514 3.483 3.533 . 0 0 "[ . 1 . 2 .]" 1
1762 1 143 ILE HA 1 146 THR H 0.000 . 3.830 3.532 3.444 3.622 . 0 0 "[ . 1 . 2 .]" 1
1763 1 143 ILE HA 1 146 THR HB 0.000 . 3.300 3.359 3.251 3.430 0.130 24 0 "[ . 1 . 2 .]" 1
1764 1 143 ILE HA 1 146 THR MG 0.000 . 3.050 1.795 1.604 1.870 0.196 22 0 "[ . 1 . 2 .]" 1
1765 1 143 ILE HA 1 154 TYR QD 0.000 . 5.500 3.704 3.477 3.838 . 0 0 "[ . 1 . 2 .]" 1
1766 1 143 ILE HA 1 154 TYR QE 0.000 . 5.490 5.543 5.410 5.631 0.141 11 0 "[ . 1 . 2 .]" 1
1767 1 143 ILE HB 1 144 ASP H 0.000 . 3.110 2.726 2.616 2.851 . 0 0 "[ . 1 . 2 .]" 1
1768 1 143 ILE HB 1 144 ASP QB 0.000 . 5.500 4.087 3.982 4.199 . 0 0 "[ . 1 . 2 .]" 1
1769 1 143 ILE MG 1 144 ASP H 0.000 . 3.820 3.653 3.414 3.775 . 0 0 "[ . 1 . 2 .]" 1
1770 1 143 ILE MG 1 144 ASP HA 0.000 . 4.130 3.700 3.379 3.853 . 0 0 "[ . 1 . 2 .]" 1
1771 1 143 ILE MG 1 146 THR H 0.000 . 4.940 4.670 4.577 4.753 . 0 0 "[ . 1 . 2 .]" 1
1772 1 143 ILE MG 1 151 LYS HA 0.000 . 3.360 2.705 2.395 3.055 . 0 0 "[ . 1 . 2 .]" 1
1773 1 143 ILE MG 1 151 LYS QB 0.000 . 2.490 2.502 2.300 2.633 0.143 14 0 "[ . 1 . 2 .]" 1
1774 1 143 ILE MG 1 152 PRO HA 0.000 . 5.500 4.208 3.919 4.493 . 0 0 "[ . 1 . 2 .]" 1
1775 1 143 ILE MG 1 154 TYR HB3 0.000 . 5.030 4.625 4.345 5.001 . 0 0 "[ . 1 . 2 .]" 1
1776 1 143 ILE MG 1 154 TYR QD 0.000 . 5.500 4.770 4.589 4.967 . 0 0 "[ . 1 . 2 .]" 1
1777 1 143 ILE MG 1 155 LYS HB2 0.000 . 5.500 3.101 2.805 3.440 . 0 0 "[ . 1 . 2 .]" 1
1778 1 143 ILE MG 1 155 LYS HB3 0.000 . 5.500 4.257 3.963 4.621 . 0 0 "[ . 1 . 2 .]" 1
1779 1 143 ILE MG 1 155 LYS QG 0.000 . 3.000 2.222 1.590 3.205 0.210 21 0 "[ . 1 . 2 .]" 1
1780 1 143 ILE MG 1 155 LYS HD2 0.000 . 4.270 3.739 2.063 4.335 0.065 5 0 "[ . 1 . 2 .]" 1
1781 1 143 ILE MG 1 155 LYS HD3 0.000 . 4.270 2.886 1.545 4.368 0.255 20 0 "[ . 1 . 2 .]" 1
1782 1 143 ILE MG 1 155 LYS HE2 0.000 . 3.870 3.560 1.932 4.008 0.138 20 0 "[ . 1 . 2 .]" 1
1783 1 143 ILE MG 1 155 LYS HE3 0.000 . 3.870 3.446 2.395 4.004 0.134 12 0 "[ . 1 . 2 .]" 1
1784 1 143 ILE HG12 1 155 LYS HA 0.000 . 5.500 4.377 4.185 4.581 . 0 0 "[ . 1 . 2 .]" 1
1785 1 143 ILE HG13 1 155 LYS HA 0.000 . 5.500 3.183 2.922 3.439 . 0 0 "[ . 1 . 2 .]" 1
1786 1 143 ILE MD 1 146 THR HB 0.000 . 5.500 4.392 4.237 4.621 . 0 0 "[ . 1 . 2 .]" 1
1787 1 143 ILE MD 1 146 THR MG 0.000 . 3.600 2.681 2.567 2.868 . 0 0 "[ . 1 . 2 .]" 1
1788 1 143 ILE MD 1 151 LYS HA 0.000 . 3.420 2.790 2.528 3.103 . 0 0 "[ . 1 . 2 .]" 1
1789 1 143 ILE MD 1 154 TYR HB2 0.000 . 3.140 1.974 1.816 2.118 . 0 0 "[ . 1 . 2 .]" 1
1790 1 143 ILE MD 1 154 TYR HB3 0.000 . 3.300 2.082 1.882 2.376 . 0 0 "[ . 1 . 2 .]" 1
1791 1 143 ILE MD 1 154 TYR QD 0.000 . 4.660 3.046 2.865 3.357 . 0 0 "[ . 1 . 2 .]" 1
1792 1 143 ILE MD 1 155 LYS H 0.000 . 4.350 2.417 2.304 2.580 . 0 0 "[ . 1 . 2 .]" 1
1793 1 143 ILE MD 1 155 LYS HA 0.000 . 2.400 2.159 1.892 2.387 . 0 0 "[ . 1 . 2 .]" 1
1794 1 143 ILE MD 1 155 LYS HB2 0.000 . 4.010 2.949 2.686 3.174 . 0 0 "[ . 1 . 2 .]" 1
1795 1 143 ILE MD 1 155 LYS HB3 0.000 . 4.010 3.965 3.701 4.095 0.085 22 0 "[ . 1 . 2 .]" 1
1796 1 143 ILE MD 1 155 LYS HD2 0.000 . 4.010 3.468 1.791 4.124 0.114 15 0 "[ . 1 . 2 .]" 1
1797 1 143 ILE MD 1 155 LYS HD3 0.000 . 4.010 2.922 1.736 3.940 0.064 19 0 "[ . 1 . 2 .]" 1
1798 1 143 ILE MD 1 155 LYS HE2 0.000 . 5.500 4.298 2.219 5.196 . 0 0 "[ . 1 . 2 .]" 1
1799 1 143 ILE MD 1 155 LYS HE3 0.000 . 5.500 4.399 3.006 5.251 . 0 0 "[ . 1 . 2 .]" 1
1800 1 143 ILE MD 1 156 GLU H 0.000 . 5.500 4.404 4.294 4.584 . 0 0 "[ . 1 . 2 .]" 1
1801 1 144 ASP H 1 145 LEU H 0.000 . 3.450 2.606 2.552 2.653 . 0 0 "[ . 1 . 2 .]" 1
1802 1 144 ASP HA 1 145 LEU H 0.000 . 3.360 3.521 3.513 3.533 0.173 10 0 "[ . 1 . 2 .]" 1
1803 1 144 ASP QB 1 145 LEU H 0.000 . 3.330 2.449 2.356 2.563 . 0 0 "[ . 1 . 2 .]" 1
1804 1 144 ASP QB 1 145 LEU HG 0.000 . 3.980 3.597 3.426 3.700 . 0 0 "[ . 1 . 2 .]" 1
1805 1 144 ASP QB 1 145 LEU MD1 0.000 . 5.490 2.875 2.570 3.227 . 0 0 "[ . 1 . 2 .]" 1
1806 1 144 ASP QB 1 145 LEU MD2 0.000 . 4.780 4.805 4.735 4.846 0.066 2 0 "[ . 1 . 2 .]" 1
1807 1 145 LEU H 1 146 THR H 0.000 . 2.900 2.600 2.559 2.632 . 0 0 "[ . 1 . 2 .]" 1
1808 1 145 LEU HB2 1 146 THR H 0.000 . 3.270 3.200 3.086 3.278 0.008 23 0 "[ . 1 . 2 .]" 1
1809 1 145 LEU MD2 1 146 THR H 0.000 . 5.370 5.158 5.104 5.190 . 0 0 "[ . 1 . 2 .]" 1
1810 1 145 LEU MD2 1 146 THR HA 0.000 . 5.500 5.545 5.518 5.571 0.071 7 0 "[ . 1 . 2 .]" 1
1811 1 146 THR HA 1 147 VAL MG2 0.000 . 4.820 4.199 4.042 4.367 . 0 0 "[ . 1 . 2 .]" 1
1812 1 146 THR HB 1 147 VAL H 0.000 . 3.640 3.668 3.608 3.725 0.085 2 0 "[ . 1 . 2 .]" 1
1813 1 146 THR HB 1 151 LYS HA 0.000 . 5.500 4.684 4.444 4.840 . 0 0 "[ . 1 . 2 .]" 1
1814 1 146 THR HB 1 154 TYR QD 0.000 . 5.500 3.182 2.922 3.492 . 0 0 "[ . 1 . 2 .]" 1
1815 1 146 THR HB 1 154 TYR QE 0.000 . 4.750 3.478 3.302 3.717 . 0 0 "[ . 1 . 2 .]" 1
1816 1 146 THR MG 1 147 VAL H 0.000 . 3.230 2.958 2.745 3.071 . 0 0 "[ . 1 . 2 .]" 1
1817 1 146 THR MG 1 148 GLU HA 0.000 . 5.500 4.251 4.123 4.446 . 0 0 "[ . 1 . 2 .]" 1
1818 1 146 THR MG 1 151 LYS HA 0.000 . 2.650 2.137 1.931 2.270 . 0 0 "[ . 1 . 2 .]" 1
1819 1 146 THR MG 1 151 LYS HB2 0.000 . 4.440 2.977 2.208 3.761 . 0 0 "[ . 1 . 2 .]" 1
1820 1 146 THR MG 1 151 LYS HB3 0.000 . 4.440 3.555 3.249 3.948 . 0 0 "[ . 1 . 2 .]" 1
1821 1 146 THR MG 1 154 TYR HB2 0.000 . 4.260 3.240 3.046 3.593 . 0 0 "[ . 1 . 2 .]" 1
1822 1 146 THR MG 1 154 TYR QD 0.000 . 3.820 2.650 2.283 3.123 . 0 0 "[ . 1 . 2 .]" 1
1823 1 146 THR MG 1 154 TYR QE 0.000 . 4.250 3.744 3.491 3.932 . 0 0 "[ . 1 . 2 .]" 1
1824 1 146 THR HG1 1 147 VAL H 0.000 . 4.010 2.387 1.649 2.990 0.151 7 0 "[ . 1 . 2 .]" 1
1825 1 147 VAL HA 1 148 GLU H 0.000 . 2.560 2.296 2.230 2.407 . 0 0 "[ . 1 . 2 .]" 1
1826 1 147 VAL MG1 1 148 GLU H 0.000 . 4.820 3.778 3.670 3.914 . 0 0 "[ . 1 . 2 .]" 1
1827 1 147 VAL MG1 1 149 PHE QD 0.000 . 3.900 3.662 3.267 3.993 0.093 2 0 "[ . 1 . 2 .]" 1
1828 1 147 VAL MG1 1 149 PHE QE 0.000 . 4.150 2.798 2.109 4.025 . 0 0 "[ . 1 . 2 .]" 1
1829 1 147 VAL MG1 1 150 LYS QE 0.000 . 5.000 4.577 3.662 5.017 0.017 25 0 "[ . 1 . 2 .]" 1
1830 1 147 VAL MG2 1 148 GLU H 0.000 . 5.500 3.680 3.488 3.804 . 0 0 "[ . 1 . 2 .]" 1
1831 1 147 VAL MG2 1 148 GLU HA 0.000 . 5.500 4.521 4.345 4.661 . 0 0 "[ . 1 . 2 .]" 1
1832 1 147 VAL MG2 1 149 PHE H 0.000 . 4.290 3.283 2.980 3.644 . 0 0 "[ . 1 . 2 .]" 1
1833 1 147 VAL MG2 1 149 PHE QB 0.000 . 5.440 3.391 2.436 4.074 . 0 0 "[ . 1 . 2 .]" 1
1834 1 147 VAL MG2 1 149 PHE QD 0.000 . 3.560 2.571 1.869 3.181 . 0 0 "[ . 1 . 2 .]" 1
1835 1 147 VAL MG2 1 149 PHE QE 0.000 . 3.810 3.191 2.645 3.880 0.070 11 0 "[ . 1 . 2 .]" 1
1836 1 147 VAL MG2 1 150 LYS HA 0.000 . 5.500 3.952 3.729 4.258 . 0 0 "[ . 1 . 2 .]" 1
1837 1 147 VAL MG2 1 150 LYS QE 0.000 . 4.040 3.052 2.211 3.501 . 0 0 "[ . 1 . 2 .]" 1
1838 1 148 GLU H 1 149 PHE H 0.000 . 3.950 2.862 2.652 2.972 . 0 0 "[ . 1 . 2 .]" 1
1839 1 148 GLU H 1 149 PHE QB 0.000 . 5.280 5.097 4.893 5.272 . 0 0 "[ . 1 . 2 .]" 1
1840 1 148 GLU HA 1 150 LYS H 0.000 . 3.760 3.536 3.479 3.597 . 0 0 "[ . 1 . 2 .]" 1
1841 1 148 GLU HA 1 151 LYS H 0.000 . 3.700 3.090 2.910 3.213 . 0 0 "[ . 1 . 2 .]" 1
1842 1 148 GLU HA 1 151 LYS QB 0.000 . 2.490 2.384 2.254 2.513 0.023 10 0 "[ . 1 . 2 .]" 1
1843 1 148 GLU HA 1 151 LYS HE2 0.000 . 3.020 2.808 1.732 3.092 0.072 2 0 "[ . 1 . 2 .]" 1
1844 1 148 GLU HA 1 151 LYS HE3 0.000 . 3.020 2.686 1.840 3.097 0.077 12 0 "[ . 1 . 2 .]" 1
1845 1 148 GLU HB2 1 149 PHE H 0.000 . 3.420 2.755 2.300 3.572 0.152 19 0 "[ . 1 . 2 .]" 1
1846 1 148 GLU HB3 1 149 PHE H 0.000 . 3.420 3.166 2.494 3.699 0.279 17 0 "[ . 1 . 2 .]" 1
1847 1 148 GLU QB 1 150 LYS H 0.000 . 5.250 4.270 4.171 4.545 . 0 0 "[ . 1 . 2 .]" 1
1848 1 148 GLU QB 1 151 LYS QE 0.000 . 5.510 3.431 2.462 3.923 . 0 0 "[ . 1 . 2 .]" 1
1849 1 148 GLU QG 1 149 PHE H 0.000 . 5.500 3.757 1.429 4.360 0.371 10 0 "[ . 1 . 2 .]" 1
1850 1 149 PHE H 1 150 LYS H 0.000 . 3.670 2.934 2.883 2.981 . 0 0 "[ . 1 . 2 .]" 1
1851 1 150 LYS HA 1 153 VAL H 0.000 . 4.320 3.270 3.141 3.390 . 0 0 "[ . 1 . 2 .]" 1
1852 1 150 LYS HA 1 153 VAL MG1 0.000 . 5.500 3.838 3.644 4.070 . 0 0 "[ . 1 . 2 .]" 1
1853 1 150 LYS HA 1 153 VAL MG2 0.000 . 4.750 2.032 1.791 2.369 0.009 6 0 "[ . 1 . 2 .]" 1
1854 1 150 LYS QB 1 151 LYS H 0.000 . 3.180 3.290 3.239 3.346 0.166 14 0 "[ . 1 . 2 .]" 1
1855 1 151 LYS HA 1 154 TYR HB2 0.000 . 4.010 2.954 2.903 3.038 . 0 0 "[ . 1 . 2 .]" 1
1856 1 151 LYS HA 1 154 TYR HB3 0.000 . 4.480 4.603 4.547 4.665 0.185 4 0 "[ . 1 . 2 .]" 1
1857 1 151 LYS QB 1 152 PRO QD 0.000 . 2.400 1.976 1.798 2.230 0.002 4 0 "[ . 1 . 2 .]" 1
1858 1 152 PRO HA 1 155 LYS H 0.000 . 4.290 3.361 3.292 3.414 . 0 0 "[ . 1 . 2 .]" 1
1859 1 152 PRO HA 1 155 LYS HB2 0.000 . 2.770 2.099 1.976 2.290 . 0 0 "[ . 1 . 2 .]" 1
1860 1 152 PRO HA 1 155 LYS HB3 0.000 . 2.770 2.846 2.765 2.909 0.139 12 0 "[ . 1 . 2 .]" 1
1861 1 152 PRO HA 1 155 LYS QG 0.000 . 3.330 3.337 3.268 3.392 0.062 14 0 "[ . 1 . 2 .]" 1
1862 1 152 PRO HB2 1 153 VAL H 0.000 . 4.350 3.342 2.970 3.430 . 0 0 "[ . 1 . 2 .]" 1
1863 1 152 PRO HB3 1 153 VAL H 0.000 . 4.350 4.202 4.150 4.254 . 0 0 "[ . 1 . 2 .]" 1
1864 1 152 PRO QB 1 155 LYS QG 0.000 . 4.660 4.663 4.594 4.738 0.078 15 0 "[ . 1 . 2 .]" 1
1865 1 152 PRO HG2 1 153 VAL H 0.000 . 5.500 2.629 2.440 3.935 . 0 0 "[ . 1 . 2 .]" 1
1866 1 152 PRO HG3 1 153 VAL H 0.000 . 5.500 4.070 3.932 4.495 . 0 0 "[ . 1 . 2 .]" 1
1867 1 152 PRO HD2 1 153 VAL H 0.000 . 4.730 2.812 2.412 3.104 . 0 0 "[ . 1 . 2 .]" 1
1868 1 152 PRO HD3 1 153 VAL H 0.000 . 4.730 3.928 3.734 4.091 . 0 0 "[ . 1 . 2 .]" 1
1869 1 153 VAL H 1 154 TYR H 0.000 . 2.900 2.598 2.557 2.631 . 0 0 "[ . 1 . 2 .]" 1
1870 1 153 VAL H 1 155 LYS H 0.000 . 4.480 3.686 3.622 3.769 . 0 0 "[ . 1 . 2 .]" 1
1871 1 153 VAL HA 1 156 GLU H 0.000 . 3.670 3.650 3.561 3.719 0.049 19 0 "[ . 1 . 2 .]" 1
1872 1 153 VAL HA 1 156 GLU QG 0.000 . 5.500 4.918 4.570 5.201 . 0 0 "[ . 1 . 2 .]" 1
1873 1 153 VAL HA 1 157 VAL MG2 0.000 . 5.500 4.008 3.893 4.320 . 0 0 "[ . 1 . 2 .]" 1
1874 1 153 VAL HB 1 154 TYR H 0.000 . 2.990 2.301 2.176 2.374 . 0 0 "[ . 1 . 2 .]" 1
1875 1 153 VAL MG1 1 154 TYR H 0.000 . 4.320 3.428 3.350 3.546 . 0 0 "[ . 1 . 2 .]" 1
1876 1 153 VAL MG1 1 154 TYR HA 0.000 . 3.700 3.636 3.565 3.739 0.039 19 0 "[ . 1 . 2 .]" 1
1877 1 153 VAL MG1 1 154 TYR QD 0.000 . 3.390 2.772 2.637 3.177 . 0 0 "[ . 1 . 2 .]" 1
1878 1 153 VAL MG1 1 154 TYR QE 0.000 . 4.100 3.452 3.253 3.903 . 0 0 "[ . 1 . 2 .]" 1
1879 1 153 VAL MG1 1 156 GLU H 0.000 . 5.000 4.815 4.672 4.909 . 0 0 "[ . 1 . 2 .]" 1
1880 1 153 VAL MG1 1 157 VAL MG1 0.000 . 5.500 4.952 4.787 5.408 . 0 0 "[ . 1 . 2 .]" 1
1881 1 153 VAL MG1 1 157 VAL MG2 0.000 . 3.110 2.840 2.686 3.182 0.072 10 0 "[ . 1 . 2 .]" 1
1882 1 154 TYR H 1 155 LYS H 0.000 . 2.710 2.543 2.490 2.596 . 0 0 "[ . 1 . 2 .]" 1
1883 1 154 TYR HA 1 157 VAL H 0.000 . 3.700 3.203 3.132 3.274 . 0 0 "[ . 1 . 2 .]" 1
1884 1 154 TYR HA 1 157 VAL HB 0.000 . 3.110 2.471 2.331 2.685 . 0 0 "[ . 1 . 2 .]" 1
1885 1 154 TYR HA 1 157 VAL MG1 0.000 . 3.920 3.727 3.619 3.865 . 0 0 "[ . 1 . 2 .]" 1
1886 1 154 TYR HA 1 157 VAL MG2 0.000 . 3.580 2.072 1.857 2.421 . 0 0 "[ . 1 . 2 .]" 1
1887 1 154 TYR HB2 1 155 LYS H 0.000 . 2.960 2.621 2.538 2.683 . 0 0 "[ . 1 . 2 .]" 1
1888 1 154 TYR HB2 1 158 LEU MD1 0.000 . 5.000 4.456 4.234 4.691 . 0 0 "[ . 1 . 2 .]" 1
1889 1 154 TYR HB3 1 155 LYS H 0.000 . 3.860 3.617 3.496 3.711 . 0 0 "[ . 1 . 2 .]" 1
1890 1 154 TYR HB3 1 158 LEU MD1 0.000 . 4.720 3.846 3.590 4.091 . 0 0 "[ . 1 . 2 .]" 1
1891 1 154 TYR QD 1 158 LEU MD1 0.000 . 5.500 5.097 4.864 5.278 . 0 0 "[ . 1 . 2 .]" 1
1892 1 155 LYS H 1 156 GLU H 0.000 . 3.110 2.756 2.701 2.837 . 0 0 "[ . 1 . 2 .]" 1
1893 1 155 LYS HA 1 156 GLU H 0.000 . 3.520 3.529 3.505 3.545 0.025 21 0 "[ . 1 . 2 .]" 1
1894 1 155 LYS HA 1 158 LEU H 0.000 . 3.140 3.284 3.219 3.318 0.178 1 0 "[ . 1 . 2 .]" 1
1895 1 155 LYS HB2 1 156 GLU H 0.000 . 3.140 3.194 3.087 3.301 0.161 14 0 "[ . 1 . 2 .]" 1
1896 1 155 LYS HB3 1 156 GLU H 0.000 . 3.140 2.814 2.538 3.042 . 0 0 "[ . 1 . 2 .]" 1
1897 1 156 GLU H 1 157 VAL H 0.000 . 3.050 2.434 2.399 2.464 . 0 0 "[ . 1 . 2 .]" 1
1898 1 156 GLU H 1 157 VAL HA 0.000 . 4.880 5.065 5.040 5.090 0.210 11 0 "[ . 1 . 2 .]" 1
1899 1 156 GLU H 1 157 VAL MG2 0.000 . 5.500 3.812 3.678 3.963 . 0 0 "[ . 1 . 2 .]" 1
1900 1 156 GLU HA 1 158 LEU H 0.000 . 4.140 4.284 4.194 4.315 0.175 6 0 "[ . 1 . 2 .]" 1
1901 1 156 GLU HA 1 159 SER H 0.000 . 3.520 3.370 3.291 3.475 . 0 0 "[ . 1 . 2 .]" 1
1902 1 156 GLU HB2 1 157 VAL H 0.000 . 4.510 3.904 3.774 3.991 . 0 0 "[ . 1 . 2 .]" 1
1903 1 156 GLU HB3 1 157 VAL H 0.000 . 4.510 2.770 2.674 2.915 . 0 0 "[ . 1 . 2 .]" 1
1904 1 156 GLU QG 1 157 VAL H 0.000 . 5.500 3.912 3.782 4.336 . 0 0 "[ . 1 . 2 .]" 1
1905 1 156 GLU QG 1 157 VAL MG2 0.000 . 5.490 4.012 3.715 4.547 . 0 0 "[ . 1 . 2 .]" 1
1906 1 156 GLU QG 1 159 SER QB 0.000 . 5.490 3.595 3.247 4.448 . 0 0 "[ . 1 . 2 .]" 1
1907 1 156 GLU QG 1 160 VAL MG2 0.000 . 3.320 3.074 2.798 3.383 0.063 3 0 "[ . 1 . 2 .]" 1
1908 1 157 VAL H 1 158 LEU H 0.000 . 2.900 2.575 2.535 2.622 . 0 0 "[ . 1 . 2 .]" 1
1909 1 157 VAL H 1 160 VAL MG2 0.000 . 5.500 4.596 4.473 4.691 . 0 0 "[ . 1 . 2 .]" 1
1910 1 157 VAL HA 1 158 LEU H 0.000 . 3.640 3.539 3.526 3.553 . 0 0 "[ . 1 . 2 .]" 1
1911 1 157 VAL HA 1 160 VAL H 0.000 . 3.580 3.559 3.468 3.628 0.048 15 0 "[ . 1 . 2 .]" 1
1912 1 157 VAL HA 1 160 VAL HB 0.000 . 3.330 3.056 2.949 3.115 . 0 0 "[ . 1 . 2 .]" 1
1913 1 157 VAL HA 1 160 VAL MG1 0.000 . 4.260 4.288 4.215 4.324 0.064 5 0 "[ . 1 . 2 .]" 1
1914 1 157 VAL HA 1 160 VAL MG2 0.000 . 3.140 2.890 2.738 3.014 . 0 0 "[ . 1 . 2 .]" 1
1915 1 157 VAL HA 1 161 PHE H 0.000 . 4.370 4.299 4.070 4.389 0.019 19 0 "[ . 1 . 2 .]" 1
1916 1 157 VAL HB 1 158 LEU H 0.000 . 3.080 2.612 2.579 2.706 . 0 0 "[ . 1 . 2 .]" 1
1917 1 157 VAL MG1 1 158 LEU H 0.000 . 3.760 3.528 3.430 3.591 . 0 0 "[ . 1 . 2 .]" 1
1918 1 157 VAL MG1 1 158 LEU HA 0.000 . 4.350 3.564 3.428 3.670 . 0 0 "[ . 1 . 2 .]" 1
1919 1 157 VAL MG1 1 158 LEU MD2 0.000 . 5.060 3.450 3.087 5.107 0.047 10 0 "[ . 1 . 2 .]" 1
1920 1 157 VAL MG1 1 160 VAL HB 0.000 . 4.540 3.595 3.455 3.735 . 0 0 "[ . 1 . 2 .]" 1
1921 1 157 VAL MG1 1 161 PHE QD 0.000 . 3.590 2.571 2.314 2.909 . 0 0 "[ . 1 . 2 .]" 1
1922 1 157 VAL MG1 1 161 PHE QE 0.000 . 3.120 2.116 2.003 2.293 . 0 0 "[ . 1 . 2 .]" 1
1923 1 157 VAL MG2 1 158 LEU H 0.000 . 4.160 3.785 3.714 3.898 . 0 0 "[ . 1 . 2 .]" 1
1924 1 157 VAL MG2 1 160 VAL MG2 0.000 . 5.500 4.243 4.137 4.386 . 0 0 "[ . 1 . 2 .]" 1
1925 1 157 VAL MG2 1 161 PHE QD 0.000 . 5.480 5.095 4.865 5.234 . 0 0 "[ . 1 . 2 .]" 1
1926 1 158 LEU H 1 159 SER H 0.000 . 3.050 2.692 2.608 2.784 . 0 0 "[ . 1 . 2 .]" 1
1927 1 158 LEU H 1 160 VAL H 0.000 . 4.040 4.087 4.045 4.150 0.110 10 0 "[ . 1 . 2 .]" 1
1928 1 158 LEU HA 1 161 PHE H 0.000 . 3.670 3.024 2.919 3.170 . 0 0 "[ . 1 . 2 .]" 1
1929 1 158 LEU HA 1 161 PHE HB2 0.000 . 3.240 2.137 2.081 2.207 . 0 0 "[ . 1 . 2 .]" 1
1930 1 158 LEU HA 1 161 PHE HB3 0.000 . 3.670 3.808 3.763 3.849 0.179 2 0 "[ . 1 . 2 .]" 1
1931 1 158 LEU HA 1 161 PHE QD 0.000 . 5.480 3.182 2.780 3.774 . 0 0 "[ . 1 . 2 .]" 1
1932 1 158 LEU HA 1 165 LEU MD1 0.000 . 4.010 2.787 2.531 3.006 . 0 0 "[ . 1 . 2 .]" 1
1933 1 158 LEU HB2 1 159 SER H 0.000 . 5.500 2.559 2.462 2.676 . 0 0 "[ . 1 . 2 .]" 1
1934 1 158 LEU HB3 1 159 SER H 0.000 . 3.640 3.518 3.054 3.667 0.027 7 0 "[ . 1 . 2 .]" 1
1935 1 158 LEU HG 1 159 SER H 0.000 . 5.500 4.382 4.120 4.828 . 0 0 "[ . 1 . 2 .]" 1
1936 1 158 LEU MD1 1 159 SER H 0.000 . 4.910 4.549 4.312 4.663 . 0 0 "[ . 1 . 2 .]" 1
1937 1 158 LEU MD1 1 161 PHE QD 0.000 . 5.480 5.423 5.077 5.559 0.079 14 0 "[ . 1 . 2 .]" 1
1938 1 158 LEU MD2 1 161 PHE HB2 0.000 . 4.200 3.076 2.758 4.258 0.058 10 0 "[ . 1 . 2 .]" 1
1939 1 159 SER H 1 160 VAL H 0.000 . 2.930 2.715 2.650 2.784 . 0 0 "[ . 1 . 2 .]" 1
1940 1 159 SER H 1 160 VAL MG2 0.000 . 5.500 4.167 4.100 4.281 . 0 0 "[ . 1 . 2 .]" 1
1941 1 159 SER HA 1 162 ALA H 0.000 . 3.420 3.507 3.449 3.543 0.123 10 0 "[ . 1 . 2 .]" 1
1942 1 159 SER HA 1 162 ALA MB 0.000 . 3.170 2.643 2.518 2.747 . 0 0 "[ . 1 . 2 .]" 1
1943 1 159 SER QB 1 160 VAL H 0.000 . 3.420 2.663 2.522 3.302 . 0 0 "[ . 1 . 2 .]" 1
1944 1 159 SER QB 1 160 VAL MG2 0.000 . 3.980 3.182 2.997 3.844 . 0 0 "[ . 1 . 2 .]" 1
1945 1 159 SER QB 1 162 ALA MB 0.000 . 5.640 4.107 3.869 4.338 . 0 0 "[ . 1 . 2 .]" 1
1946 1 160 VAL H 1 162 ALA H 0.000 . 4.010 3.848 3.781 3.922 . 0 0 "[ . 1 . 2 .]" 1
1947 1 160 VAL HB 1 161 PHE H 0.000 . 2.960 2.506 2.439 2.553 . 0 0 "[ . 1 . 2 .]" 1
1948 1 160 VAL MG1 1 161 PHE H 0.000 . 3.730 3.436 3.348 3.525 . 0 0 "[ . 1 . 2 .]" 1
1949 1 160 VAL MG1 1 161 PHE HA 0.000 . 5.500 3.485 3.379 3.602 . 0 0 "[ . 1 . 2 .]" 1
1950 1 160 VAL MG1 1 164 HIS HD2 0.000 . 3.820 3.670 3.522 3.816 . 0 0 "[ . 1 . 2 .]" 1
1951 1 160 VAL MG2 1 161 PHE H 0.000 . 4.040 3.732 3.684 3.780 . 0 0 "[ . 1 . 2 .]" 1
1952 1 160 VAL MG2 1 161 PHE QD 0.000 . 5.480 4.676 4.409 4.878 . 0 0 "[ . 1 . 2 .]" 1
1953 1 160 VAL MG2 1 162 ALA H 0.000 . 5.500 5.006 4.968 5.052 . 0 0 "[ . 1 . 2 .]" 1
1954 1 161 PHE H 1 162 ALA H 0.000 . 3.110 2.702 2.676 2.729 . 0 0 "[ . 1 . 2 .]" 1
1955 1 161 PHE H 1 164 HIS HD2 0.000 . 5.500 4.662 4.559 4.729 . 0 0 "[ . 1 . 2 .]" 1
1956 1 161 PHE HA 1 164 HIS HD2 0.000 . 2.650 1.996 1.913 2.090 . 0 0 "[ . 1 . 2 .]" 1
1957 1 161 PHE HA 1 165 LEU MD1 0.000 . 5.500 4.442 3.966 4.664 . 0 0 "[ . 1 . 2 .]" 1
1958 1 161 PHE HB2 1 162 ALA H 0.000 . 4.380 3.692 3.628 3.740 . 0 0 "[ . 1 . 2 .]" 1
1959 1 161 PHE HB2 1 164 HIS HD2 0.000 . 5.070 4.962 4.890 5.085 0.015 7 0 "[ . 1 . 2 .]" 1
1960 1 161 PHE HB2 1 165 LEU MD1 0.000 . 3.890 2.494 1.963 2.677 . 0 0 "[ . 1 . 2 .]" 1
1961 1 161 PHE HB2 1 165 LEU MD2 0.000 . 3.950 3.914 3.826 4.012 0.062 10 0 "[ . 1 . 2 .]" 1
1962 1 161 PHE HB3 1 164 HIS HD2 0.000 . 5.500 4.071 3.935 4.226 . 0 0 "[ . 1 . 2 .]" 1
1963 1 161 PHE HB3 1 165 LEU MD1 0.000 . 5.500 2.741 2.131 3.024 . 0 0 "[ . 1 . 2 .]" 1
1964 1 161 PHE QD 1 162 ALA H 0.000 . 5.480 4.530 4.402 4.638 . 0 0 "[ . 1 . 2 .]" 1
1965 1 161 PHE QD 1 162 ALA MB 0.000 . 5.630 5.715 5.659 5.766 0.136 4 0 "[ . 1 . 2 .]" 1
1966 1 161 PHE QD 1 164 HIS HD2 . . 2.910 2.652 2.414 2.904 . 0 0 "[ . 1 . 2 .]" 1
1967 1 161 PHE QD 1 165 LEU MD1 0.000 . 5.480 3.317 2.766 3.535 . 0 0 "[ . 1 . 2 .]" 1
1968 1 161 PHE QE 1 165 LEU MD1 0.000 . 5.480 5.286 4.767 5.491 0.011 15 0 "[ . 1 . 2 .]" 1
1969 1 161 PHE QE 1 165 LEU MD2 0.000 . 5.480 5.551 5.312 5.610 0.130 9 0 "[ . 1 . 2 .]" 1
1970 1 162 ALA H 1 163 PRO QD 0.000 . 4.170 2.035 1.964 2.257 . 0 0 "[ . 1 . 2 .]" 1
1971 1 162 ALA H 1 164 HIS HD2 0.000 . 5.500 4.602 4.320 4.800 . 0 0 "[ . 1 . 2 .]" 1
1972 1 162 ALA HA 1 164 HIS H 0.000 . 3.580 3.672 3.660 3.691 0.111 9 0 "[ . 1 . 2 .]" 1
1973 1 162 ALA HA 1 165 LEU H 0.000 . 3.390 3.052 2.941 3.099 . 0 0 "[ . 1 . 2 .]" 1
1974 1 162 ALA HA 1 165 LEU HB2 0.000 . 3.450 2.485 2.398 2.547 . 0 0 "[ . 1 . 2 .]" 1
1975 1 162 ALA HA 1 165 LEU HB3 0.000 . 4.230 4.199 4.111 4.260 0.030 14 0 "[ . 1 . 2 .]" 1
1976 1 162 ALA HA 1 165 LEU MD1 0.000 . 2.990 3.020 2.936 3.096 0.106 7 0 "[ . 1 . 2 .]" 1
1977 1 162 ALA MB 1 163 PRO HA 0.000 . 4.380 3.766 3.710 3.846 . 0 0 "[ . 1 . 2 .]" 1
1978 1 162 ALA MB 1 163 PRO HD2 0.000 . 3.040 2.706 2.573 3.091 0.051 17 0 "[ . 1 . 2 .]" 1
1979 1 162 ALA MB 1 163 PRO HD3 0.000 . 3.040 2.198 1.816 2.350 . 0 0 "[ . 1 . 2 .]" 1
1980 1 162 ALA MB 1 164 HIS H 0.000 . 4.040 4.074 4.040 4.095 0.055 12 0 "[ . 1 . 2 .]" 1
1981 1 162 ALA MB 1 165 LEU MD1 0.000 . 4.250 4.031 3.964 4.084 . 0 0 "[ . 1 . 2 .]" 1
1982 1 163 PRO HA 1 164 HIS H 0.000 . 3.520 3.424 3.415 3.437 . 0 0 "[ . 1 . 2 .]" 1
1983 1 163 PRO QB 1 164 HIS H 0.000 . 3.460 3.430 3.140 3.503 0.043 1 0 "[ . 1 . 2 .]" 1
1984 1 163 PRO HG2 1 164 HIS HD2 0.000 . 5.500 3.129 2.595 4.206 . 0 0 "[ . 1 . 2 .]" 1
1985 1 163 PRO HG3 1 164 HIS HD2 0.000 . 5.500 4.714 4.262 5.514 0.014 12 0 "[ . 1 . 2 .]" 1
1986 1 163 PRO HD2 1 164 HIS H 0.000 . 5.500 3.025 2.758 3.122 . 0 0 "[ . 1 . 2 .]" 1
1987 1 163 PRO HD2 1 164 HIS HD2 0.000 . 5.500 3.659 2.865 3.993 . 0 0 "[ . 1 . 2 .]" 1
1988 1 163 PRO HD3 1 164 HIS H 0.000 . 5.500 4.028 3.831 4.095 . 0 0 "[ . 1 . 2 .]" 1
1989 1 163 PRO HD3 1 164 HIS HD2 0.000 . 5.500 5.216 4.634 5.506 0.006 6 0 "[ . 1 . 2 .]" 1
1990 1 164 HIS H 1 165 LEU H 0.000 . 2.680 2.024 1.981 2.053 . 0 0 "[ . 1 . 2 .]" 1
1991 1 164 HIS HA 1 165 LEU H 0.000 . 3.490 3.429 3.411 3.464 . 0 0 "[ . 1 . 2 .]" 1
1992 1 164 HIS HB3 1 165 LEU H 0.000 . 4.170 4.114 4.015 4.183 0.013 3 0 "[ . 1 . 2 .]" 1
1993 1 164 HIS HB3 1 165 LEU MD2 0.000 . 4.160 4.212 4.179 4.255 0.095 7 0 "[ . 1 . 2 .]" 1
1994 1 40 TRP HA 1 40 TRP HE3 0.000 . 3.140 3.216 3.161 3.291 0.151 14 0 "[ . 1 . 2 .]" 1
1995 1 96 TRP HA 1 96 TRP HE3 0.000 . 3.550 3.267 2.748 3.620 0.070 19 0 "[ . 1 . 2 .]" 1
1996 1 100 TRP HA 1 100 TRP HE3 0.000 . 5.500 3.060 1.505 4.271 0.295 25 0 "[ . 1 . 2 .]" 1
1997 1 134 TRP H 1 134 TRP HE1 0.000 . 5.500 4.822 4.734 4.917 . 0 0 "[ . 1 . 2 .]" 1
1998 1 136 TRP HA 1 136 TRP HE3 0.000 . 3.240 2.872 2.460 3.263 0.023 2 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 80
_Distance_constraint_stats_list.Viol_count 7
_Distance_constraint_stats_list.Viol_total 5.676
_Distance_constraint_stats_list.Viol_max 0.067
_Distance_constraint_stats_list.Viol_rms 0.0025
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0324
_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 16 ASN 0.057 0.057 8 0 "[ . 1 . 2 .]"
1 17 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 18 GLY 0.102 0.055 23 0 "[ . 1 . 2 .]"
1 19 ILE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 20 CYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 21 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 22 MET 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 28 ILE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 29 PHE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 30 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 31 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 32 SER 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 33 ARG 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 36 ILE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 41 GLN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 43 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 45 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 52 ASP 0.068 0.067 23 0 "[ . 1 . 2 .]"
1 53 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 54 ARG 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 55 ASN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 56 ALA 0.068 0.067 23 0 "[ . 1 . 2 .]"
1 57 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 58 ILE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 59 ARG 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 60 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 61 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 62 ARG 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 63 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 64 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 65 THR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 71 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 73 ILE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 74 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 76 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 80 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 104 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 105 GLN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 106 LYS 0.057 0.057 8 0 "[ . 1 . 2 .]"
1 107 TRP 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 108 PHE 0.102 0.055 23 0 "[ . 1 . 2 .]"
1 109 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 110 PHE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 111 LYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 112 PHE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 133 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 135 SER 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 137 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 138 THR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 141 GLN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 142 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 145 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 151 LYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 153 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 154 TYR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 155 LYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 156 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 157 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 158 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 159 SER 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 160 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 161 PHE 0.000 0.000 . 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 16 ASN H 1 104 ALA O 2.000 . 2.500 1.749 1.421 2.235 . 0 0 "[ . 1 . 2 .]" 2
2 1 16 ASN N 1 104 ALA O 3.000 2.300 3.500 2.689 2.370 3.176 . 0 0 "[ . 1 . 2 .]" 2
3 1 17 VAL H 1 45 GLY O 2.000 . 2.500 1.630 1.512 1.706 . 0 0 "[ . 1 . 2 .]" 2
4 1 17 VAL N 1 45 GLY O 3.000 2.300 3.500 2.558 2.440 2.657 . 0 0 "[ . 1 . 2 .]" 2
5 1 18 GLY H 1 106 LYS O 2.000 . 2.500 1.933 1.705 2.238 . 0 0 "[ . 1 . 2 .]" 2
6 1 18 GLY N 1 106 LYS O 3.000 2.300 3.500 2.810 2.511 3.070 . 0 0 "[ . 1 . 2 .]" 2
7 1 19 ILE H 1 43 PRO O 2.000 . 2.500 1.803 1.631 2.062 . 0 0 "[ . 1 . 2 .]" 2
8 1 19 ILE N 1 43 PRO O 3.000 2.300 3.500 2.748 2.575 2.957 . 0 0 "[ . 1 . 2 .]" 2
9 1 20 CYS H 1 108 PHE O 2.000 . 2.500 1.670 1.546 1.901 . 0 0 "[ . 1 . 2 .]" 2
10 1 20 CYS N 1 108 PHE O 3.000 2.300 3.500 2.611 2.521 2.811 . 0 0 "[ . 1 . 2 .]" 2
11 1 22 MET H 1 110 PHE O 2.000 . 2.500 1.713 1.527 1.907 . 0 0 "[ . 1 . 2 .]" 2
12 1 22 MET N 1 110 PHE O 3.000 2.300 3.500 2.673 2.482 2.869 . 0 0 "[ . 1 . 2 .]" 2
13 1 28 ILE H 1 137 VAL O 2.000 . 2.500 1.525 1.423 1.602 . 0 0 "[ . 1 . 2 .]" 2
14 1 28 ILE N 1 137 VAL O 3.000 2.300 3.500 2.433 2.307 2.564 . 0 0 "[ . 1 . 2 .]" 2
15 1 21 LEU O 1 29 PHE H 2.000 . 2.500 1.636 1.560 1.712 . 0 0 "[ . 1 . 2 .]" 2
16 1 21 LEU O 1 29 PHE N 3.000 2.300 3.500 2.536 2.480 2.576 . 0 0 "[ . 1 . 2 .]" 2
17 1 30 ALA H 1 135 SER O 2.000 . 2.500 1.796 1.614 2.074 . 0 0 "[ . 1 . 2 .]" 2
18 1 30 ALA N 1 135 SER O 3.000 2.300 3.500 2.684 2.526 2.913 . 0 0 "[ . 1 . 2 .]" 2
19 1 31 ALA H 1 41 GLN O 2.000 . 2.500 1.855 1.601 2.437 . 0 0 "[ . 1 . 2 .]" 2
20 1 31 ALA N 1 41 GLN O 3.000 2.300 3.500 2.712 2.482 3.302 . 0 0 "[ . 1 . 2 .]" 2
21 1 32 SER H 1 133 GLU O 2.000 . 2.500 1.616 1.557 1.717 . 0 0 "[ . 1 . 2 .]" 2
22 1 32 SER N 1 133 GLU O 3.000 2.300 3.500 2.578 2.525 2.642 . 0 0 "[ . 1 . 2 .]" 2
23 1 33 ARG O 1 36 ILE H 2.000 . 2.500 1.961 1.770 2.100 . 0 0 "[ . 1 . 2 .]" 2
24 1 33 ARG O 1 36 ILE N 3.000 2.300 3.500 2.653 2.533 2.856 . 0 0 "[ . 1 . 2 .]" 2
25 1 52 ASP O 1 56 ALA H 2.000 . 2.500 2.271 1.932 2.567 0.067 23 0 "[ . 1 . 2 .]" 2
26 1 52 ASP O 1 56 ALA N 3.000 2.300 3.500 3.157 2.858 3.411 . 0 0 "[ . 1 . 2 .]" 2
27 1 53 PRO O 1 57 ALA H 2.000 . 2.500 1.657 1.578 1.741 . 0 0 "[ . 1 . 2 .]" 2
28 1 53 PRO O 1 57 ALA N 3.000 2.300 3.500 2.607 2.544 2.691 . 0 0 "[ . 1 . 2 .]" 2
29 1 54 ARG O 1 58 ILE H 2.000 . 2.500 1.963 1.599 2.157 . 0 0 "[ . 1 . 2 .]" 2
30 1 54 ARG O 1 58 ILE N 3.000 2.300 3.500 2.931 2.562 3.101 . 0 0 "[ . 1 . 2 .]" 2
31 1 55 ASN O 1 59 ARG H 2.000 . 2.500 1.754 1.645 1.866 . 0 0 "[ . 1 . 2 .]" 2
32 1 55 ASN O 1 59 ARG N 3.000 2.300 3.500 2.728 2.587 2.853 . 0 0 "[ . 1 . 2 .]" 2
33 1 56 ALA O 1 60 GLU H 2.000 . 2.500 1.735 1.658 1.848 . 0 0 "[ . 1 . 2 .]" 2
34 1 56 ALA O 1 60 GLU N 3.000 2.300 3.500 2.619 2.560 2.730 . 0 0 "[ . 1 . 2 .]" 2
35 1 57 ALA O 1 61 LEU H 2.000 . 2.500 1.925 1.622 2.047 . 0 0 "[ . 1 . 2 .]" 2
36 1 57 ALA O 1 61 LEU N 3.000 2.300 3.500 2.834 2.553 2.958 . 0 0 "[ . 1 . 2 .]" 2
37 1 58 ILE O 1 62 ARG H 2.000 . 2.500 2.235 2.053 2.467 . 0 0 "[ . 1 . 2 .]" 2
38 1 58 ILE O 1 62 ARG N 3.000 2.300 3.500 3.133 2.978 3.353 . 0 0 "[ . 1 . 2 .]" 2
39 1 59 ARG O 1 63 GLU H 2.000 . 2.500 2.016 1.786 2.257 . 0 0 "[ . 1 . 2 .]" 2
40 1 59 ARG O 1 63 GLU N 3.000 2.300 3.500 2.912 2.707 3.135 . 0 0 "[ . 1 . 2 .]" 2
41 1 60 GLU O 1 64 GLU H 2.000 . 2.500 2.111 1.867 2.270 . 0 0 "[ . 1 . 2 .]" 2
42 1 60 GLU O 1 64 GLU N 3.000 2.300 3.500 2.860 2.657 3.022 . 0 0 "[ . 1 . 2 .]" 2
43 1 61 LEU O 1 65 THR H 2.000 . 2.500 1.914 1.750 2.122 . 0 0 "[ . 1 . 2 .]" 2
44 1 61 LEU O 1 65 THR N 3.000 2.300 3.500 2.806 2.661 3.014 . 0 0 "[ . 1 . 2 .]" 2
45 1 73 ILE H 1 109 LEU O 2.000 . 2.500 2.092 1.849 2.247 . 0 0 "[ . 1 . 2 .]" 2
46 1 73 ILE N 1 109 LEU O 3.000 2.300 3.500 3.006 2.788 3.137 . 0 0 "[ . 1 . 2 .]" 2
47 1 76 VAL H 1 107 TRP O 2.000 . 2.500 1.966 1.807 2.171 . 0 0 "[ . 1 . 2 .]" 2
48 1 76 VAL N 1 107 TRP O 3.000 2.300 3.500 2.921 2.752 3.108 . 0 0 "[ . 1 . 2 .]" 2
49 1 80 LEU O 1 105 GLN H 2.000 . 2.500 1.696 1.532 1.949 . 0 0 "[ . 1 . 2 .]" 2
50 1 80 LEU O 1 105 GLN N 3.000 2.300 3.500 2.601 2.484 2.857 . 0 0 "[ . 1 . 2 .]" 2
51 1 16 ASN O 1 106 LYS H 2.000 . 2.500 2.113 1.813 2.557 0.057 8 0 "[ . 1 . 2 .]" 2
52 1 16 ASN O 1 106 LYS N 3.000 2.300 3.500 2.999 2.783 3.361 . 0 0 "[ . 1 . 2 .]" 2
53 1 18 GLY O 1 108 PHE H 2.000 . 2.500 2.251 1.916 2.555 0.055 23 0 "[ . 1 . 2 .]" 2
54 1 18 GLY O 1 108 PHE N 3.000 2.300 3.500 2.982 2.642 3.313 . 0 0 "[ . 1 . 2 .]" 2
55 1 74 ALA O 1 109 LEU H 2.000 . 2.500 1.787 1.692 1.908 . 0 0 "[ . 1 . 2 .]" 2
56 1 74 ALA O 1 109 LEU N 3.000 2.300 3.500 2.725 2.647 2.861 . 0 0 "[ . 1 . 2 .]" 2
57 1 20 CYS O 1 110 PHE H 2.000 . 2.500 1.682 1.608 1.865 . 0 0 "[ . 1 . 2 .]" 2
58 1 20 CYS O 1 110 PHE N 3.000 2.300 3.500 2.581 2.458 2.805 . 0 0 "[ . 1 . 2 .]" 2
59 1 71 GLU O 1 111 LYS H 2.000 . 2.500 1.576 1.520 1.651 . 0 0 "[ . 1 . 2 .]" 2
60 1 71 GLU O 1 111 LYS N 3.000 2.300 3.500 2.543 2.488 2.617 . 0 0 "[ . 1 . 2 .]" 2
61 1 22 MET O 1 112 PHE H 2.000 . 2.500 1.888 1.665 2.203 . 0 0 "[ . 1 . 2 .]" 2
62 1 22 MET O 1 112 PHE N 3.000 2.300 3.500 2.848 2.626 3.146 . 0 0 "[ . 1 . 2 .]" 2
63 1 30 ALA O 1 135 SER H 2.000 . 2.500 1.720 1.652 1.809 . 0 0 "[ . 1 . 2 .]" 2
64 1 30 ALA O 1 135 SER N 3.000 2.300 3.500 2.636 2.585 2.713 . 0 0 "[ . 1 . 2 .]" 2
65 1 138 THR O 1 142 LEU H 2.000 . 2.500 1.778 1.643 1.919 . 0 0 "[ . 1 . 2 .]" 2
66 1 138 THR O 1 142 LEU N 3.000 2.300 3.500 2.727 2.587 2.850 . 0 0 "[ . 1 . 2 .]" 2
67 1 141 GLN O 1 145 LEU H 2.000 . 2.500 1.877 1.721 1.970 . 0 0 "[ . 1 . 2 .]" 2
68 1 141 GLN O 1 145 LEU N 3.000 2.300 3.500 2.849 2.692 2.937 . 0 0 "[ . 1 . 2 .]" 2
69 1 151 LYS O 1 155 LYS H 2.000 . 2.500 1.717 1.644 1.795 . 0 0 "[ . 1 . 2 .]" 2
70 1 151 LYS O 1 155 LYS N 3.000 2.300 3.500 2.624 2.538 2.699 . 0 0 "[ . 1 . 2 .]" 2
71 1 153 VAL O 1 157 VAL H 2.000 . 2.500 2.283 2.149 2.492 . 0 0 "[ . 1 . 2 .]" 2
72 1 153 VAL O 1 157 VAL N 3.000 2.300 3.500 3.126 3.020 3.281 . 0 0 "[ . 1 . 2 .]" 2
73 1 154 TYR O 1 158 LEU H 2.000 . 2.500 1.810 1.644 2.227 . 0 0 "[ . 1 . 2 .]" 2
74 1 154 TYR O 1 158 LEU N 3.000 2.300 3.500 2.704 2.546 3.068 . 0 0 "[ . 1 . 2 .]" 2
75 1 155 LYS O 1 159 SER H 2.000 . 2.500 2.083 1.973 2.445 . 0 0 "[ . 1 . 2 .]" 2
76 1 155 LYS O 1 159 SER N 3.000 2.300 3.500 3.028 2.900 3.401 . 0 0 "[ . 1 . 2 .]" 2
77 1 156 GLU O 1 160 VAL H 2.000 . 2.500 2.351 2.171 2.452 . 0 0 "[ . 1 . 2 .]" 2
78 1 156 GLU O 1 160 VAL N 3.000 2.300 3.500 3.246 3.070 3.334 . 0 0 "[ . 1 . 2 .]" 2
79 1 157 VAL O 1 161 PHE H 2.000 . 2.500 1.977 1.814 2.074 . 0 0 "[ . 1 . 2 .]" 2
80 1 157 VAL O 1 161 PHE N 3.000 2.300 3.500 2.877 2.717 2.954 . 0 0 "[ . 1 . 2 .]" 2
stop_
save_
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