NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
619203 |
5lgf   |
25770 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5lgf
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 1195
_Distance_constraint_stats_list.Viol_count 3107
_Distance_constraint_stats_list.Viol_total 8526.464
_Distance_constraint_stats_list.Viol_max 1.802
_Distance_constraint_stats_list.Viol_rms 0.0792
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0178
_Distance_constraint_stats_list.Viol_average_violations_only 0.1372
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 4.109 0.249 17 0 "[ . 1 . 2]"
1 2 ARG 5.567 0.344 9 0 "[ . 1 . 2]"
1 3 PHE 9.841 0.472 11 0 "[ . 1 . 2]"
1 4 ASP 4.519 0.344 9 0 "[ . 1 . 2]"
1 5 GLN 2.052 0.348 20 0 "[ . 1 . 2]"
1 6 TYR 4.911 0.261 6 0 "[ . 1 . 2]"
1 7 VAL 9.377 0.261 6 0 "[ . 1 . 2]"
1 8 ASP 3.177 0.159 11 0 "[ . 1 . 2]"
1 9 GLU 5.019 0.236 19 0 "[ . 1 . 2]"
1 10 ASN 10.807 0.343 15 0 "[ . 1 . 2]"
1 11 LYS 8.714 0.272 19 0 "[ . 1 . 2]"
1 12 SER 18.012 0.878 9 19 "[********+***-** ****]"
1 13 SER 13.368 0.482 12 0 "[ . 1 . 2]"
1 14 ASP 0.634 0.120 10 0 "[ . 1 . 2]"
1 15 ASP 1.808 0.107 20 0 "[ . 1 . 2]"
1 16 PHE 59.279 1.046 13 20 [************+*******]
1 17 GLU 2.636 0.173 8 0 "[ . 1 . 2]"
1 18 PRO 10.301 0.283 16 0 "[ . 1 . 2]"
1 19 LEU 8.009 0.258 5 0 "[ . 1 . 2]"
1 20 ILE 28.071 1.046 13 20 [**********-*+*******]
1 21 HIS 4.536 0.311 16 0 "[ . 1 . 2]"
1 22 ASP 3.483 0.146 13 0 "[ . 1 . 2]"
1 23 LEU 4.201 0.257 2 0 "[ . 1 . 2]"
1 24 PHE 0.829 0.081 6 0 "[ . 1 . 2]"
1 25 GLU 0.427 0.031 19 0 "[ . 1 . 2]"
1 26 THR 5.516 1.006 2 3 "[ + . *1 . -2]"
1 27 ARG 0.095 0.031 19 0 "[ . 1 . 2]"
1 28 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 HIS 0.230 0.152 7 0 "[ . 1 . 2]"
1 31 THR 4.118 0.322 4 0 "[ . 1 . 2]"
1 32 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 ARG 3.773 0.405 18 0 "[ . 1 . 2]"
1 34 GLU 5.745 0.426 10 0 "[ . 1 . 2]"
1 35 ILE 13.214 0.472 11 0 "[ . 1 . 2]"
1 36 TRP 2.969 0.281 16 0 "[ . 1 . 2]"
1 37 ILE 19.016 0.483 4 0 "[ . 1 . 2]"
1 38 GLU 10.251 0.398 19 0 "[ . 1 . 2]"
1 39 ARG 2.259 0.327 17 0 "[ . 1 . 2]"
1 40 VAL 4.374 0.277 8 0 "[ . 1 . 2]"
1 41 LYS 2.606 0.285 13 0 "[ . 1 . 2]"
1 42 ASP 0.018 0.018 8 0 "[ . 1 . 2]"
1 44 LYS 0.496 0.198 12 0 "[ . 1 . 2]"
1 45 ILE 11.687 0.348 20 0 "[ . 1 . 2]"
1 46 PRO 2.548 0.321 6 0 "[ . 1 . 2]"
1 47 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 THR 1.736 0.166 10 0 "[ . 1 . 2]"
1 49 LEU 19.244 0.548 13 4 "[ .* 1- + . * 2]"
1 50 VAL 5.732 0.337 13 0 "[ . 1 . 2]"
1 51 LYS 0.808 0.192 13 0 "[ . 1 . 2]"
1 52 PRO 3.073 0.192 13 0 "[ . 1 . 2]"
1 53 ASN 0.944 0.499 8 0 "[ . 1 . 2]"
1 54 TYR 4.508 0.499 8 0 "[ . 1 . 2]"
1 55 SER 5.072 0.338 20 0 "[ . 1 . 2]"
1 56 HIS 1.788 0.208 5 0 "[ . 1 . 2]"
1 57 GLU 5.688 0.257 7 0 "[ . 1 . 2]"
1 58 GLU 2.793 0.249 19 0 "[ . 1 . 2]"
1 59 LEU 9.967 0.338 20 0 "[ . 1 . 2]"
1 60 ILE 15.843 1.153 3 8 "[ +-* *1*** .* 2]"
1 61 ASP 2.144 0.174 12 0 "[ . 1 . 2]"
1 62 MET 3.670 0.485 9 0 "[ . 1 . 2]"
1 63 LEU 15.332 0.548 13 4 "[ .* 1- + . * 2]"
1 64 ILE 37.064 1.802 6 19 "[*****+********** *-*]"
1 65 GLY 0.260 0.129 16 0 "[ . 1 . 2]"
1 66 TYR 8.922 0.309 3 0 "[ . 1 . 2]"
1 67 LEU 1.513 0.180 7 0 "[ . 1 . 2]"
1 68 ALA 0.150 0.149 9 0 "[ . 1 . 2]"
1 75 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 ILE 1.829 0.405 5 0 "[ . 1 . 2]"
1 78 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 LEU 0.368 0.298 4 0 "[ . 1 . 2]"
1 81 VAL 0.706 0.298 4 0 "[ . 1 . 2]"
1 82 THR 0.571 0.090 2 0 "[ . 1 . 2]"
1 84 ASP 1.129 0.311 18 0 "[ . 1 . 2]"
1 85 ASP 3.678 0.290 6 0 "[ . 1 . 2]"
1 86 LEU 5.735 0.340 2 0 "[ . 1 . 2]"
1 87 GLU 0.971 0.151 2 0 "[ . 1 . 2]"
1 88 ILE 5.806 0.297 18 0 "[ . 1 . 2]"
1 89 ALA 5.136 0.340 2 0 "[ . 1 . 2]"
1 90 ASN 1.692 0.151 2 0 "[ . 1 . 2]"
1 91 SER 0.171 0.028 1 0 "[ . 1 . 2]"
1 92 TYR 1.536 0.282 6 0 "[ . 1 . 2]"
1 94 PHE 1.475 0.428 17 0 "[ . 1 . 2]"
1 95 LYS 0.371 0.219 11 0 "[ . 1 . 2]"
1 96 GLY 0.371 0.219 11 0 "[ . 1 . 2]"
1 99 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 VAL 11.169 0.776 2 6 "[ + . * -* * . *2]"
1 101 THR 32.006 1.802 6 19 "[*****+*-******** ***]"
1 102 ASN 0.326 0.087 20 0 "[ . 1 . 2]"
1 103 LEU 2.984 0.469 1 0 "[ . 1 . 2]"
1 104 LEU 1.905 0.259 2 0 "[ . 1 . 2]"
1 105 LYS 9.978 1.153 3 8 "[ +-* *1*** .* 2]"
1 106 SER 4.625 0.469 1 0 "[ . 1 . 2]"
1 107 PRO 1.893 0.225 15 0 "[ . 1 . 2]"
1 108 GLU 4.965 1.006 2 3 "[ + . *1 . -2]"
1 109 PHE 1.075 0.107 13 0 "[ . 1 . 2]"
1 110 ARG 0.137 0.090 3 0 "[ . 1 . 2]"
1 111 LEU 6.912 0.336 16 0 "[ . 1 . 2]"
1 112 VAL 1.307 0.257 2 0 "[ . 1 . 2]"
1 113 HIS 5.425 0.159 5 0 "[ . 1 . 2]"
1 114 THR 4.748 0.336 16 0 "[ . 1 . 2]"
1 115 ILE 24.838 1.008 1 20 [+******-************]
1 116 ILE 5.812 0.220 15 0 "[ . 1 . 2]"
1 117 GLY 3.707 0.163 19 0 "[ . 1 . 2]"
1 118 THR 4.458 0.228 7 0 "[ . 1 . 2]"
1 119 GLU 9.843 0.348 20 0 "[ . 1 . 2]"
1 120 THR 4.101 0.233 15 0 "[ . 1 . 2]"
1 121 PHE 6.329 0.220 15 0 "[ . 1 . 2]"
1 122 LEU 8.427 0.318 4 0 "[ . 1 . 2]"
1 123 ASP 1.865 0.249 13 0 "[ . 1 . 2]"
1 124 LEU 5.900 0.658 10 6 "[ * -* + * . *2]"
1 125 LEU 5.335 0.776 2 4 "[ + . * -1 * . 2]"
1 126 ILE 2.214 0.346 19 0 "[ . 1 . 2]"
1 127 ASN 2.002 0.231 13 0 "[ . 1 . 2]"
1 128 TYR 8.270 0.327 17 0 "[ . 1 . 2]"
1 129 SER 8.693 0.297 6 0 "[ . 1 . 2]"
1 130 ALA 18.401 0.483 4 0 "[ . 1 . 2]"
1 131 ARG 0.592 0.163 18 0 "[ . 1 . 2]"
1 132 MET 21.505 0.449 5 0 "[ . 1 . 2]"
1 133 GLY 0.160 0.160 18 0 "[ . 1 . 2]"
1 134 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 135 VAL 0.420 0.056 17 0 "[ . 1 . 2]"
1 136 TYR 1.086 0.172 11 0 "[ . 1 . 2]"
1 137 LEU 5.361 0.544 13 1 "[ . 1 + . 2]"
1 138 TRP 6.412 0.658 10 7 "[ * -* + ** . *2]"
1 140 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 141 LEU 2.177 0.256 6 0 "[ . 1 . 2]"
1 142 ASN 1.087 0.357 1 0 "[ . 1 . 2]"
1 143 GLU 0.913 0.357 1 0 "[ . 1 . 2]"
1 144 SER 0.176 0.097 3 0 "[ . 1 . 2]"
1 145 ASN 0.377 0.136 9 0 "[ . 1 . 2]"
1 146 TYR 2.279 0.175 9 0 "[ . 1 . 2]"
1 147 LYS 1.321 0.158 8 0 "[ . 1 . 2]"
1 148 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 150 CYS 0.203 0.088 1 0 "[ . 1 . 2]"
1 152 SER 0.023 0.023 18 0 "[ . 1 . 2]"
1 153 SER 0.460 0.090 10 0 "[ . 1 . 2]"
1 154 GLU 0.267 0.146 14 0 "[ . 1 . 2]"
1 155 ASN 1.070 0.469 2 0 "[ . 1 . 2]"
1 156 LEU 1.282 0.469 2 0 "[ . 1 . 2]"
1 157 TYR 5.363 0.295 3 0 "[ . 1 . 2]"
1 158 PHE 6.286 0.406 3 0 "[ . 1 . 2]"
1 159 GLN 0.960 0.208 17 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 MET HA 1 1 MET HB3 3.100 . 3.100 2.616 2.356 3.022 . 0 0 "[ . 1 . 2]" 1
2 1 1 MET HA 1 1 MET HG2 3.800 . 3.800 3.256 2.361 3.765 . 0 0 "[ . 1 . 2]" 1
3 1 1 MET HA 1 1 MET HG3 4.300 . 4.300 3.344 2.239 4.053 . 0 0 "[ . 1 . 2]" 1
4 1 1 MET HA 1 36 TRP HH2 4.200 . 4.200 3.284 2.341 4.417 0.217 16 0 "[ . 1 . 2]" 1
5 1 1 MET HA 1 36 TRP HZ3 4.200 . 4.200 3.978 3.623 4.449 0.249 17 0 "[ . 1 . 2]" 1
6 1 1 MET HB3 1 1 MET HG2 2.800 . 2.800 2.538 2.303 3.003 0.203 13 0 "[ . 1 . 2]" 1
7 1 1 MET HB3 1 1 MET HG3 3.000 . 3.000 2.952 2.426 3.009 0.009 11 0 "[ . 1 . 2]" 1
8 1 1 MET ME 1 1 MET HG3 2.600 . 2.600 2.483 2.095 2.727 0.127 2 0 "[ . 1 . 2]" 1
9 1 1 MET ME 1 6 TYR HA 2.600 . 2.600 2.343 1.891 2.699 0.099 8 0 "[ . 1 . 2]" 1
10 1 1 MET ME 1 6 TYR HB2 3.400 . 3.400 2.873 1.986 3.473 0.073 4 0 "[ . 1 . 2]" 1
11 1 1 MET ME 1 37 ILE MG 3.900 . 3.900 3.925 3.234 4.106 0.206 2 0 "[ . 1 . 2]" 1
12 1 2 ARG H 1 2 ARG HA 3.000 . 3.000 2.836 2.786 2.919 . 0 0 "[ . 1 . 2]" 1
13 1 2 ARG H 1 2 ARG HB3 4.100 . 4.100 3.286 2.569 3.655 . 0 0 "[ . 1 . 2]" 1
14 1 2 ARG H 1 2 ARG HG2 4.500 . 4.500 4.069 2.229 4.693 0.193 16 0 "[ . 1 . 2]" 1
15 1 2 ARG H 1 2 ARG HG3 4.300 . 4.300 3.409 2.580 4.335 0.035 11 0 "[ . 1 . 2]" 1
16 1 2 ARG H 1 36 TRP HH2 4.200 . 4.200 3.893 3.373 4.426 0.226 16 0 "[ . 1 . 2]" 1
17 1 2 ARG H 1 36 TRP HZ3 3.300 . 3.300 3.190 2.822 3.345 0.045 5 0 "[ . 1 . 2]" 1
18 1 2 ARG HA 1 3 PHE H 3.600 . 3.600 2.270 2.158 2.494 . 0 0 "[ . 1 . 2]" 1
19 1 2 ARG HA 1 3 PHE HB3 4.600 . 4.600 4.686 4.576 4.836 0.236 13 0 "[ . 1 . 2]" 1
20 1 2 ARG HA 1 36 TRP HA 3.400 . 3.400 3.009 2.491 3.681 0.281 16 0 "[ . 1 . 2]" 1
21 1 2 ARG HA 1 36 TRP HE3 4.100 . 4.100 2.518 2.188 2.889 . 0 0 "[ . 1 . 2]" 1
22 1 2 ARG HB2 1 5 GLN H 4.500 . 4.500 3.406 2.940 3.965 . 0 0 "[ . 1 . 2]" 1
23 1 2 ARG HB3 1 2 ARG HD2 4.000 . 4.000 3.131 2.273 4.114 0.114 3 0 "[ . 1 . 2]" 1
24 1 2 ARG HB3 1 2 ARG HD3 4.100 . 4.100 3.001 2.191 3.834 . 0 0 "[ . 1 . 2]" 1
25 1 2 ARG HB3 1 3 PHE H 4.100 . 4.100 3.091 2.243 3.905 . 0 0 "[ . 1 . 2]" 1
26 1 2 ARG HB3 1 4 ASP H 4.100 . 4.100 3.029 2.539 4.444 0.344 9 0 "[ . 1 . 2]" 1
27 1 2 ARG HB3 1 33 ARG HA 4.300 . 4.300 3.985 3.335 4.420 0.120 6 0 "[ . 1 . 2]" 1
28 1 2 ARG HG2 1 3 PHE H 4.500 . 4.500 3.465 2.776 4.332 . 0 0 "[ . 1 . 2]" 1
29 1 2 ARG HG2 1 4 ASP H 4.500 . 4.500 4.105 3.133 4.713 0.213 16 0 "[ . 1 . 2]" 1
30 1 3 PHE H 1 3 PHE HB2 3.800 . 3.800 2.597 2.518 2.728 . 0 0 "[ . 1 . 2]" 1
31 1 3 PHE H 1 3 PHE HB3 3.800 . 3.800 2.425 2.297 2.502 . 0 0 "[ . 1 . 2]" 1
32 1 3 PHE H 1 4 ASP H 3.100 . 3.100 2.745 2.679 2.824 . 0 0 "[ . 1 . 2]" 1
33 1 3 PHE H 1 35 ILE MG 6.000 . 6.000 4.018 3.596 4.463 . 0 0 "[ . 1 . 2]" 1
34 1 3 PHE H 1 36 TRP HA 3.500 . 3.500 3.338 2.917 3.666 0.166 9 0 "[ . 1 . 2]" 1
35 1 3 PHE HA 1 3 PHE HD1 3.500 . 3.500 2.163 2.003 2.314 . 0 0 "[ . 1 . 2]" 1
36 1 3 PHE HA 1 4 ASP H 3.600 . 3.600 3.548 3.518 3.569 . 0 0 "[ . 1 . 2]" 1
37 1 3 PHE HA 1 6 TYR H 3.600 . 3.600 3.435 3.277 3.591 . 0 0 "[ . 1 . 2]" 1
38 1 3 PHE HA 1 6 TYR HB3 4.100 . 4.100 2.590 2.154 2.899 . 0 0 "[ . 1 . 2]" 1
39 1 3 PHE HA 1 37 ILE MD 3.700 . 3.700 2.125 1.923 2.537 . 0 0 "[ . 1 . 2]" 1
40 1 3 PHE HB2 1 4 ASP H 3.800 . 3.800 3.919 3.825 4.048 0.248 7 0 "[ . 1 . 2]" 1
41 1 3 PHE HB2 1 35 ILE MD 4.300 . 4.300 3.934 3.556 4.487 0.187 11 0 "[ . 1 . 2]" 1
42 1 3 PHE HB2 1 35 ILE MG 3.600 . 3.600 2.062 1.889 2.284 . 0 0 "[ . 1 . 2]" 1
43 1 3 PHE HB3 1 4 ASP H 3.800 . 3.800 2.586 2.437 2.780 . 0 0 "[ . 1 . 2]" 1
44 1 3 PHE HB3 1 35 ILE HB 4.000 . 4.000 2.410 1.949 2.703 . 0 0 "[ . 1 . 2]" 1
45 1 3 PHE HB3 1 35 ILE MD 4.500 . 4.500 4.224 3.762 4.972 0.472 11 0 "[ . 1 . 2]" 1
46 1 3 PHE HB3 1 35 ILE MG 3.700 . 3.700 3.374 3.027 3.574 . 0 0 "[ . 1 . 2]" 1
47 1 3 PHE HD1 1 7 VAL MG2 3.500 . 3.500 3.565 3.351 3.709 0.209 15 0 "[ . 1 . 2]" 1
48 1 3 PHE HD1 1 35 ILE MG 4.100 . 4.100 3.644 3.234 3.933 . 0 0 "[ . 1 . 2]" 1
49 1 3 PHE HD1 1 37 ILE MD 3.600 . 3.600 1.892 1.788 2.051 . 0 0 "[ . 1 . 2]" 1
50 1 3 PHE HE1 1 7 VAL MG2 3.200 . 3.200 3.143 2.777 3.320 0.120 18 0 "[ . 1 . 2]" 1
51 1 3 PHE HE1 1 35 ILE MG 4.700 . 4.700 4.762 4.486 4.877 0.177 10 0 "[ . 1 . 2]" 1
52 1 3 PHE HE1 1 37 ILE MD 4.000 . 4.000 3.160 2.808 3.714 . 0 0 "[ . 1 . 2]" 1
53 1 3 PHE HE1 1 112 VAL MG2 3.200 . 3.200 3.062 2.442 3.266 0.066 14 0 "[ . 1 . 2]" 1
54 1 3 PHE HE1 1 124 LEU QD 3.900 . 3.900 3.510 2.900 3.821 . 0 0 "[ . 1 . 2]" 1
55 1 4 ASP H 1 4 ASP HB3 4.300 . 4.300 3.170 2.408 3.586 . 0 0 "[ . 1 . 2]" 1
56 1 4 ASP H 1 5 GLN H 3.100 . 3.100 2.757 2.634 2.860 . 0 0 "[ . 1 . 2]" 1
57 1 4 ASP H 1 33 ARG HA 3.000 . 3.000 2.944 2.687 3.060 0.060 2 0 "[ . 1 . 2]" 1
58 1 4 ASP HA 1 5 GLN H 3.900 . 3.900 3.552 3.527 3.570 . 0 0 "[ . 1 . 2]" 1
59 1 4 ASP HA 1 7 VAL H 3.900 . 3.900 3.799 3.640 3.988 0.088 18 0 "[ . 1 . 2]" 1
60 1 4 ASP HA 1 7 VAL HB 4.100 . 4.100 3.896 3.680 4.048 . 0 0 "[ . 1 . 2]" 1
61 1 4 ASP HA 1 7 VAL MG2 4.800 . 4.800 2.952 2.508 3.374 . 0 0 "[ . 1 . 2]" 1
62 1 4 ASP HA 1 24 PHE HD1 4.900 . 4.900 4.736 4.178 4.969 0.069 19 0 "[ . 1 . 2]" 1
63 1 4 ASP HA 1 24 PHE HE1 4.300 . 4.300 4.122 3.477 4.326 0.026 14 0 "[ . 1 . 2]" 1
64 1 4 ASP HA 1 24 PHE HZ 4.700 . 4.700 4.500 4.162 4.722 0.022 10 0 "[ . 1 . 2]" 1
65 1 4 ASP HB2 1 5 GLN H 4.600 . 4.600 3.052 2.552 3.806 . 0 0 "[ . 1 . 2]" 1
66 1 4 ASP HB3 1 5 GLN H 4.300 . 4.300 3.238 2.359 3.921 . 0 0 "[ . 1 . 2]" 1
67 1 5 GLN H 1 5 GLN HB2 4.200 . 4.200 2.476 2.146 3.601 . 0 0 "[ . 1 . 2]" 1
68 1 5 GLN H 1 5 GLN HB3 4.200 . 4.200 2.855 2.462 3.583 . 0 0 "[ . 1 . 2]" 1
69 1 5 GLN H 1 6 TYR H 3.200 . 3.200 2.547 2.474 2.661 . 0 0 "[ . 1 . 2]" 1
70 1 5 GLN HA 1 5 GLN HG3 3.300 . 3.300 2.736 2.320 3.648 0.348 20 0 "[ . 1 . 2]" 1
71 1 5 GLN HA 1 6 TYR H 3.700 . 3.700 3.484 3.465 3.517 . 0 0 "[ . 1 . 2]" 1
72 1 5 GLN HA 1 8 ASP H 3.700 . 3.700 3.467 3.331 3.546 . 0 0 "[ . 1 . 2]" 1
73 1 5 GLN HA 1 8 ASP HB2 3.000 . 3.000 3.048 2.690 3.143 0.143 12 0 "[ . 1 . 2]" 1
74 1 6 TYR H 1 6 TYR HB2 3.900 . 3.900 2.618 2.398 3.138 . 0 0 "[ . 1 . 2]" 1
75 1 6 TYR H 1 6 TYR HB3 3.800 . 3.800 2.457 2.061 2.647 . 0 0 "[ . 1 . 2]" 1
76 1 6 TYR H 1 7 VAL H 3.200 . 3.200 2.746 2.688 2.845 . 0 0 "[ . 1 . 2]" 1
77 1 6 TYR HA 1 7 VAL H 3.700 . 3.700 3.536 3.515 3.551 . 0 0 "[ . 1 . 2]" 1
78 1 6 TYR HA 1 9 GLU H 3.700 . 3.700 3.401 3.276 3.538 . 0 0 "[ . 1 . 2]" 1
79 1 6 TYR HA 1 9 GLU HB2 3.300 . 3.300 3.089 2.677 3.306 0.006 8 0 "[ . 1 . 2]" 1
80 1 6 TYR HA 1 9 GLU HG2 5.500 . 5.500 3.911 3.584 4.438 . 0 0 "[ . 1 . 2]" 1
81 1 6 TYR HA 1 10 ASN HD21 3.700 . 3.700 3.119 2.794 3.431 . 0 0 "[ . 1 . 2]" 1
82 1 6 TYR HA 1 10 ASN HD22 3.700 . 3.700 3.385 3.128 3.737 0.037 11 0 "[ . 1 . 2]" 1
83 1 6 TYR HA 1 37 ILE MD 4.700 . 4.700 4.505 4.145 4.736 0.036 20 0 "[ . 1 . 2]" 1
84 1 6 TYR HB2 1 37 ILE MD 3.600 . 3.600 2.581 2.163 2.842 . 0 0 "[ . 1 . 2]" 1
85 1 6 TYR HB2 1 37 ILE MG 4.200 . 4.200 4.165 3.861 4.316 0.116 8 0 "[ . 1 . 2]" 1
86 1 6 TYR HB3 1 37 ILE MD 3.500 . 3.500 2.453 2.283 2.711 . 0 0 "[ . 1 . 2]" 1
87 1 6 TYR HD1 1 7 VAL HA 4.300 . 4.300 3.334 2.878 4.451 0.151 18 0 "[ . 1 . 2]" 1
88 1 6 TYR HD1 1 7 VAL MG2 4.500 . 4.500 3.430 2.789 4.761 0.261 6 0 "[ . 1 . 2]" 1
89 1 6 TYR HE1 1 37 ILE MD 3.700 . 3.700 3.812 3.712 3.917 0.217 18 0 "[ . 1 . 2]" 1
90 1 6 TYR HE1 1 116 ILE MD 3.000 . 3.000 2.772 2.218 3.151 0.151 15 0 "[ . 1 . 2]" 1
91 1 6 TYR HE1 1 116 ILE MG 4.100 . 4.100 2.844 2.516 3.121 . 0 0 "[ . 1 . 2]" 1
92 1 6 TYR HE1 1 120 THR MG 3.500 . 3.500 3.308 3.095 3.581 0.081 20 0 "[ . 1 . 2]" 1
93 1 6 TYR HE1 1 124 LEU QD 3.300 . 3.300 2.126 1.917 2.667 . 0 0 "[ . 1 . 2]" 1
94 1 7 VAL H 1 7 VAL HB 4.300 . 4.300 2.549 2.492 2.577 . 0 0 "[ . 1 . 2]" 1
95 1 7 VAL H 1 8 ASP H 3.200 . 3.200 2.782 2.729 2.821 . 0 0 "[ . 1 . 2]" 1
96 1 7 VAL HA 1 7 VAL MG1 2.900 . 2.900 2.402 2.336 2.466 . 0 0 "[ . 1 . 2]" 1
97 1 7 VAL HA 1 7 VAL MG2 2.700 . 2.700 2.360 2.229 2.451 . 0 0 "[ . 1 . 2]" 1
98 1 7 VAL HA 1 8 ASP H 3.900 . 3.900 3.554 3.534 3.563 . 0 0 "[ . 1 . 2]" 1
99 1 7 VAL HA 1 9 GLU H 3.900 . 3.900 4.074 3.984 4.136 0.236 19 0 "[ . 1 . 2]" 1
100 1 7 VAL HA 1 10 ASN H 3.900 . 3.900 3.712 3.485 3.900 . 0 0 "[ . 1 . 2]" 1
101 1 7 VAL HA 1 112 VAL MG1 3.900 . 3.900 3.654 3.286 3.914 0.014 14 0 "[ . 1 . 2]" 1
102 1 7 VAL HA 1 116 ILE MG 3.000 . 3.000 2.826 2.611 2.941 . 0 0 "[ . 1 . 2]" 1
103 1 7 VAL HB 1 7 VAL MG2 2.600 . 2.600 2.100 2.083 2.129 . 0 0 "[ . 1 . 2]" 1
104 1 7 VAL HB 1 8 ASP H 4.300 . 4.300 2.473 2.350 2.664 . 0 0 "[ . 1 . 2]" 1
105 1 7 VAL HB 1 24 PHE HE1 4.100 . 4.100 2.037 1.939 2.224 . 0 0 "[ . 1 . 2]" 1
106 1 7 VAL MG1 1 8 ASP H 5.100 . 5.100 3.396 3.220 3.551 . 0 0 "[ . 1 . 2]" 1
107 1 7 VAL MG1 1 9 GLU H 5.100 . 5.100 4.741 4.664 4.789 . 0 0 "[ . 1 . 2]" 1
108 1 7 VAL MG1 1 20 ILE HA 3.300 . 3.300 3.390 3.311 3.504 0.204 15 0 "[ . 1 . 2]" 1
109 1 7 VAL MG1 1 23 LEU MD2 3.900 . 3.900 2.260 1.900 2.479 . 0 0 "[ . 1 . 2]" 1
110 1 7 VAL MG1 1 24 PHE HD1 4.300 . 4.300 3.898 3.666 4.219 . 0 0 "[ . 1 . 2]" 1
111 1 7 VAL MG1 1 24 PHE HE1 3.200 . 3.200 2.369 2.117 2.719 . 0 0 "[ . 1 . 2]" 1
112 1 7 VAL MG1 1 24 PHE HZ 4.000 . 4.000 3.926 3.415 4.081 0.081 6 0 "[ . 1 . 2]" 1
113 1 7 VAL MG1 1 115 ILE MD 2.600 . 2.600 2.047 1.826 2.323 . 0 0 "[ . 1 . 2]" 1
114 1 7 VAL MG2 1 8 ASP H 5.300 . 5.300 3.786 3.709 3.877 . 0 0 "[ . 1 . 2]" 1
115 1 7 VAL MG2 1 23 LEU MD2 2.900 . 2.900 2.382 1.858 2.780 . 0 0 "[ . 1 . 2]" 1
116 1 7 VAL MG2 1 24 PHE HD1 4.600 . 4.600 4.306 4.050 4.610 0.010 15 0 "[ . 1 . 2]" 1
117 1 7 VAL MG2 1 24 PHE HE1 3.300 . 3.300 3.160 2.719 3.333 0.033 15 0 "[ . 1 . 2]" 1
118 1 8 ASP H 1 8 ASP HB2 4.000 . 4.000 2.138 2.082 2.224 . 0 0 "[ . 1 . 2]" 1
119 1 8 ASP H 1 9 GLU H 3.200 . 3.200 2.541 2.478 2.598 . 0 0 "[ . 1 . 2]" 1
120 1 8 ASP H 1 20 ILE MG 4.900 . 4.900 3.987 3.743 4.245 . 0 0 "[ . 1 . 2]" 1
121 1 8 ASP HA 1 9 GLU H 3.600 . 3.600 3.448 3.441 3.458 . 0 0 "[ . 1 . 2]" 1
122 1 8 ASP HA 1 11 LYS H 3.600 . 3.600 3.639 3.546 3.759 0.159 11 0 "[ . 1 . 2]" 1
123 1 8 ASP HA 1 20 ILE MD 2.900 . 2.900 2.782 2.411 2.959 0.059 18 0 "[ . 1 . 2]" 1
124 1 8 ASP HA 1 20 ILE MG 4.200 . 4.200 3.457 3.149 3.728 . 0 0 "[ . 1 . 2]" 1
125 1 8 ASP HB2 1 9 GLU H 4.000 . 4.000 3.339 3.183 3.837 . 0 0 "[ . 1 . 2]" 1
126 1 8 ASP HB2 1 20 ILE MG 3.800 . 3.800 3.779 3.336 3.934 0.134 14 0 "[ . 1 . 2]" 1
127 1 9 GLU H 1 9 GLU HB2 4.300 . 4.300 2.644 2.581 2.741 . 0 0 "[ . 1 . 2]" 1
128 1 9 GLU H 1 10 ASN H 3.200 . 3.200 2.546 2.336 2.690 . 0 0 "[ . 1 . 2]" 1
129 1 9 GLU HA 1 10 ASN H 3.700 . 3.700 3.552 3.529 3.570 . 0 0 "[ . 1 . 2]" 1
130 1 9 GLU HG2 1 10 ASN H 4.200 . 4.200 4.049 3.416 4.301 0.101 11 0 "[ . 1 . 2]" 1
131 1 9 GLU HG3 1 10 ASN H 4.100 . 4.100 3.985 3.503 4.258 0.158 6 0 "[ . 1 . 2]" 1
132 1 10 ASN H 1 10 ASN HB2 4.300 . 4.300 2.473 2.332 2.609 . 0 0 "[ . 1 . 2]" 1
133 1 10 ASN H 1 10 ASN HB3 4.000 . 4.000 3.623 3.572 3.665 . 0 0 "[ . 1 . 2]" 1
134 1 10 ASN H 1 10 ASN HD21 3.200 . 3.200 1.961 1.853 2.168 . 0 0 "[ . 1 . 2]" 1
135 1 10 ASN H 1 10 ASN HD22 3.200 . 3.200 3.419 3.311 3.543 0.343 15 0 "[ . 1 . 2]" 1
136 1 10 ASN H 1 11 LYS H 3.200 . 3.200 2.613 2.515 2.724 . 0 0 "[ . 1 . 2]" 1
137 1 10 ASN H 1 116 ILE MG 5.200 . 5.200 3.624 3.417 3.866 . 0 0 "[ . 1 . 2]" 1
138 1 10 ASN H 1 120 THR MG 4.600 . 4.600 4.734 4.594 4.833 0.233 15 0 "[ . 1 . 2]" 1
139 1 10 ASN HA 1 10 ASN HB3 3.000 . 3.000 2.463 2.389 2.546 . 0 0 "[ . 1 . 2]" 1
140 1 10 ASN HA 1 11 LYS H 3.500 . 3.500 3.248 3.087 3.389 . 0 0 "[ . 1 . 2]" 1
141 1 10 ASN HA 1 120 THR MG 3.700 . 3.700 3.528 3.124 3.911 0.211 3 0 "[ . 1 . 2]" 1
142 1 10 ASN HB2 1 10 ASN HD22 4.300 . 4.300 3.519 3.479 3.584 . 0 0 "[ . 1 . 2]" 1
143 1 10 ASN HB3 1 10 ASN HD22 4.000 . 4.000 4.072 4.047 4.091 0.091 15 0 "[ . 1 . 2]" 1
144 1 10 ASN HB3 1 116 ILE HA 4.800 . 4.800 3.539 3.050 4.073 . 0 0 "[ . 1 . 2]" 1
145 1 10 ASN HB3 1 116 ILE MD 4.300 . 4.300 4.034 3.531 4.377 0.077 17 0 "[ . 1 . 2]" 1
146 1 10 ASN HB3 1 116 ILE MG 3.600 . 3.600 2.814 2.170 3.253 . 0 0 "[ . 1 . 2]" 1
147 1 10 ASN HB3 1 120 THR MG 3.000 . 3.000 1.817 1.705 1.923 . 0 0 "[ . 1 . 2]" 1
148 1 11 LYS H 1 11 LYS HB2 4.300 . 4.300 3.602 3.591 3.620 . 0 0 "[ . 1 . 2]" 1
149 1 11 LYS H 1 11 LYS HB3 4.300 . 4.300 2.489 2.422 2.610 . 0 0 "[ . 1 . 2]" 1
150 1 11 LYS H 1 115 ILE MG 5.400 . 5.400 3.514 3.280 3.859 . 0 0 "[ . 1 . 2]" 1
151 1 11 LYS H 1 116 ILE MG 5.200 . 5.200 3.750 3.405 4.107 . 0 0 "[ . 1 . 2]" 1
152 1 11 LYS HA 1 12 SER H 3.600 . 3.600 2.127 2.117 2.148 . 0 0 "[ . 1 . 2]" 1
153 1 11 LYS HA 1 13 SER H 3.600 . 3.600 3.794 3.713 3.872 0.272 19 0 "[ . 1 . 2]" 1
154 1 11 LYS HA 1 115 ILE MG 2.500 . 2.500 1.936 1.837 2.029 . 0 0 "[ . 1 . 2]" 1
155 1 11 LYS HA 1 116 ILE HA 3.600 . 3.600 2.713 2.357 2.903 . 0 0 "[ . 1 . 2]" 1
156 1 11 LYS HB2 1 12 SER H 4.300 . 4.300 3.409 3.246 3.588 . 0 0 "[ . 1 . 2]" 1
157 1 11 LYS HB2 1 16 PHE HE1 4.300 . 4.300 4.477 4.416 4.566 0.266 16 0 "[ . 1 . 2]" 1
158 1 11 LYS HB2 1 115 ILE MG 3.500 . 3.500 2.118 1.984 2.372 . 0 0 "[ . 1 . 2]" 1
159 1 11 LYS HB3 1 12 SER H 4.300 . 4.300 4.300 4.222 4.365 0.065 18 0 "[ . 1 . 2]" 1
160 1 12 SER H 1 12 SER HB2 3.700 . 3.700 2.822 2.651 3.015 . 0 0 "[ . 1 . 2]" 1
161 1 12 SER H 1 12 SER HB3 3.700 . 3.700 2.337 2.268 2.447 . 0 0 "[ . 1 . 2]" 1
162 1 12 SER H 1 13 SER H 3.100 . 3.100 2.470 2.275 2.585 . 0 0 "[ . 1 . 2]" 1
163 1 12 SER H 1 16 PHE QD 3.200 . 3.200 3.938 3.672 4.078 0.878 9 19 "[********+***-** ****]" 1
164 1 12 SER H 1 16 PHE HE1 3.200 . 3.200 3.276 3.074 3.358 0.158 19 0 "[ . 1 . 2]" 1
165 1 12 SER H 1 115 ILE HA 4.000 . 4.000 3.821 3.719 3.992 . 0 0 "[ . 1 . 2]" 1
166 1 12 SER H 1 115 ILE MG 5.400 . 5.400 3.043 2.823 3.291 . 0 0 "[ . 1 . 2]" 1
167 1 12 SER H 1 116 ILE HA 3.500 . 3.500 2.802 2.446 3.139 . 0 0 "[ . 1 . 2]" 1
168 1 12 SER H 1 116 ILE MG 5.200 . 5.200 4.330 4.111 4.577 . 0 0 "[ . 1 . 2]" 1
169 1 12 SER HA 1 12 SER HB2 2.800 . 2.800 2.374 2.333 2.430 . 0 0 "[ . 1 . 2]" 1
170 1 12 SER HA 1 13 SER H 3.600 . 3.600 3.513 3.485 3.532 . 0 0 "[ . 1 . 2]" 1
171 1 12 SER HB2 1 116 ILE HA 4.400 . 4.400 3.912 3.500 4.311 . 0 0 "[ . 1 . 2]" 1
172 1 12 SER HB3 1 13 SER H 3.700 . 3.700 2.828 2.683 3.028 . 0 0 "[ . 1 . 2]" 1
173 1 12 SER HB3 1 116 ILE HA 4.100 . 4.100 4.164 4.119 4.211 0.111 1 0 "[ . 1 . 2]" 1
174 1 13 SER H 1 13 SER HB2 3.900 . 3.900 2.850 2.636 3.103 . 0 0 "[ . 1 . 2]" 1
175 1 13 SER H 1 13 SER HB3 3.700 . 3.700 3.817 3.775 3.867 0.167 16 0 "[ . 1 . 2]" 1
176 1 13 SER H 1 16 PHE HE1 3.200 . 3.200 2.190 1.998 2.361 . 0 0 "[ . 1 . 2]" 1
177 1 13 SER H 1 20 ILE MD 5.100 . 5.100 5.372 4.989 5.582 0.482 12 0 "[ . 1 . 2]" 1
178 1 13 SER H 1 115 ILE HA 4.000 . 4.000 3.965 3.840 4.108 0.108 13 0 "[ . 1 . 2]" 1
179 1 13 SER H 1 115 ILE MG 5.400 . 5.400 3.561 3.387 3.926 . 0 0 "[ . 1 . 2]" 1
180 1 13 SER HA 1 13 SER HB2 3.000 . 3.000 2.999 2.950 3.025 0.025 20 0 "[ . 1 . 2]" 1
181 1 13 SER HA 1 13 SER HB3 2.700 . 2.700 2.386 2.265 2.533 . 0 0 "[ . 1 . 2]" 1
182 1 13 SER HA 1 15 ASP H 3.600 . 3.600 3.644 3.595 3.703 0.103 7 0 "[ . 1 . 2]" 1
183 1 13 SER HB2 1 15 ASP H 3.900 . 3.900 3.281 2.934 3.660 . 0 0 "[ . 1 . 2]" 1
184 1 13 SER HB2 1 15 ASP HB3 4.600 . 4.600 4.124 3.456 4.707 0.107 20 0 "[ . 1 . 2]" 1
185 1 13 SER HB2 1 16 PHE QD 4.100 . 4.100 3.411 3.262 3.567 . 0 0 "[ . 1 . 2]" 1
186 1 13 SER HB2 1 16 PHE HE1 5.500 . 5.500 2.692 2.426 2.889 . 0 0 "[ . 1 . 2]" 1
187 1 14 ASP HA 1 14 ASP HB3 2.900 . 2.900 2.650 2.442 3.020 0.120 10 0 "[ . 1 . 2]" 1
188 1 15 ASP H 1 15 ASP HB2 4.200 . 4.200 2.262 2.085 2.440 . 0 0 "[ . 1 . 2]" 1
189 1 15 ASP H 1 15 ASP HB3 4.100 . 4.100 3.077 2.613 3.550 . 0 0 "[ . 1 . 2]" 1
190 1 15 ASP H 1 16 PHE H 3.100 . 3.100 2.735 2.709 2.769 . 0 0 "[ . 1 . 2]" 1
191 1 15 ASP HA 1 15 ASP HB2 2.900 . 2.900 2.746 2.498 3.003 0.103 14 0 "[ . 1 . 2]" 1
192 1 15 ASP HA 1 15 ASP HB3 3.000 . 3.000 2.858 2.578 3.022 0.022 1 0 "[ . 1 . 2]" 1
193 1 15 ASP HA 1 16 PHE H 3.600 . 3.600 3.370 3.295 3.414 . 0 0 "[ . 1 . 2]" 1
194 1 15 ASP HA 1 17 GLU H 3.600 . 3.600 3.321 3.257 3.370 . 0 0 "[ . 1 . 2]" 1
195 1 15 ASP HB3 1 16 PHE H 4.100 . 4.100 3.628 3.248 4.045 . 0 0 "[ . 1 . 2]" 1
196 1 16 PHE H 1 16 PHE HB2 3.900 . 3.900 2.581 2.477 2.634 . 0 0 "[ . 1 . 2]" 1
197 1 16 PHE H 1 16 PHE HB3 3.800 . 3.800 3.639 3.624 3.651 . 0 0 "[ . 1 . 2]" 1
198 1 16 PHE H 1 17 GLU H 3.200 . 3.200 2.843 2.735 2.911 . 0 0 "[ . 1 . 2]" 1
199 1 16 PHE H 1 20 ILE MD 5.100 . 5.100 3.753 3.537 3.965 . 0 0 "[ . 1 . 2]" 1
200 1 16 PHE H 1 115 ILE MG 5.400 . 5.400 4.803 4.617 4.941 . 0 0 "[ . 1 . 2]" 1
201 1 16 PHE HA 1 17 GLU H 3.500 . 3.500 3.047 3.027 3.101 . 0 0 "[ . 1 . 2]" 1
202 1 16 PHE HA 1 18 PRO HD2 4.100 . 4.100 2.964 2.859 3.080 . 0 0 "[ . 1 . 2]" 1
203 1 16 PHE HA 1 19 LEU H 3.500 . 3.500 3.304 3.239 3.402 . 0 0 "[ . 1 . 2]" 1
204 1 16 PHE HA 1 19 LEU QB 4.500 . 4.500 3.305 3.176 3.546 . 0 0 "[ . 1 . 2]" 1
205 1 16 PHE HA 1 19 LEU MD1 3.500 . 3.500 3.094 2.751 3.459 . 0 0 "[ . 1 . 2]" 1
206 1 16 PHE HA 1 19 LEU HG 4.000 . 4.000 3.164 2.758 3.486 . 0 0 "[ . 1 . 2]" 1
207 1 16 PHE HA 1 20 ILE H 3.500 . 3.500 4.467 4.324 4.546 1.046 13 20 [**********-*+*******] 1
208 1 16 PHE HA 1 115 ILE MG 4.500 . 4.500 5.432 5.235 5.508 1.008 1 20 [+******-************] 1
209 1 16 PHE QB 1 19 LEU MD1 4.000 . 4.000 2.529 2.162 2.905 . 0 0 "[ . 1 . 2]" 1
210 1 16 PHE HB2 1 115 ILE MG 3.500 . 3.500 2.977 2.643 3.137 . 0 0 "[ . 1 . 2]" 1
211 1 16 PHE HB3 1 17 GLU H 5.300 . 5.300 4.495 4.444 4.513 . 0 0 "[ . 1 . 2]" 1
212 1 16 PHE HB3 1 20 ILE MD 4.100 . 4.100 3.577 3.276 3.827 . 0 0 "[ . 1 . 2]" 1
213 1 16 PHE HB3 1 115 ILE MG 3.600 . 3.600 3.640 3.398 3.760 0.160 9 0 "[ . 1 . 2]" 1
214 1 16 PHE QD 1 115 ILE HA 4.100 . 4.100 2.327 2.173 2.439 . 0 0 "[ . 1 . 2]" 1
215 1 16 PHE QD 1 115 ILE MD 4.500 . 4.500 4.038 3.763 4.259 . 0 0 "[ . 1 . 2]" 1
216 1 16 PHE HE1 1 115 ILE HA 4.000 . 4.000 2.533 2.324 2.819 . 0 0 "[ . 1 . 2]" 1
217 1 17 GLU H 1 17 GLU HB2 4.100 . 4.100 2.420 2.321 2.615 . 0 0 "[ . 1 . 2]" 1
218 1 17 GLU H 1 17 GLU HG2 4.100 . 4.100 2.462 2.317 2.580 . 0 0 "[ . 1 . 2]" 1
219 1 17 GLU H 1 18 PRO HD2 3.700 . 3.700 2.172 2.140 2.234 . 0 0 "[ . 1 . 2]" 1
220 1 17 GLU H 1 20 ILE MD 5.100 . 5.100 3.911 3.692 4.098 . 0 0 "[ . 1 . 2]" 1
221 1 17 GLU HA 1 17 GLU HG2 3.400 . 3.400 2.559 2.390 2.817 . 0 0 "[ . 1 . 2]" 1
222 1 17 GLU HA 1 18 PRO HD2 3.700 . 3.700 3.716 3.696 3.732 0.032 19 0 "[ . 1 . 2]" 1
223 1 17 GLU HA 1 20 ILE MD 2.900 . 2.900 2.712 2.408 2.913 0.013 5 0 "[ . 1 . 2]" 1
224 1 17 GLU HB2 1 17 GLU HG2 2.900 . 2.900 2.652 2.438 2.886 . 0 0 "[ . 1 . 2]" 1
225 1 17 GLU HB2 1 18 PRO HD2 3.000 . 3.000 2.503 2.406 2.591 . 0 0 "[ . 1 . 2]" 1
226 1 17 GLU HB2 1 18 PRO HD3 3.000 . 3.000 2.060 1.965 2.153 . 0 0 "[ . 1 . 2]" 1
227 1 17 GLU HG2 1 18 PRO HD2 4.100 . 4.100 4.212 4.115 4.273 0.173 8 0 "[ . 1 . 2]" 1
228 1 17 GLU HG2 1 20 ILE MD 4.000 . 4.000 3.878 3.583 4.025 0.025 10 0 "[ . 1 . 2]" 1
229 1 18 PRO HA 1 18 PRO HB3 2.900 . 2.900 2.276 2.270 2.281 . 0 0 "[ . 1 . 2]" 1
230 1 18 PRO HA 1 18 PRO HD2 4.000 . 4.000 4.073 4.060 4.078 0.078 16 0 "[ . 1 . 2]" 1
231 1 18 PRO HA 1 18 PRO HD3 4.000 . 4.000 3.412 3.353 3.439 . 0 0 "[ . 1 . 2]" 1
232 1 18 PRO HA 1 19 LEU H 3.600 . 3.600 3.547 3.528 3.561 . 0 0 "[ . 1 . 2]" 1
233 1 18 PRO HA 1 21 HIS HB2 3.300 . 3.300 2.872 2.563 3.431 0.131 3 0 "[ . 1 . 2]" 1
234 1 18 PRO HA 1 21 HIS HD2 4.500 . 4.500 3.821 3.002 4.566 0.066 19 0 "[ . 1 . 2]" 1
235 1 18 PRO HB2 1 19 LEU H 4.300 . 4.300 3.115 3.025 3.211 . 0 0 "[ . 1 . 2]" 1
236 1 18 PRO HB3 1 18 PRO HG2 2.700 . 2.700 2.980 2.975 2.983 0.283 16 0 "[ . 1 . 2]" 1
237 1 18 PRO HB3 1 19 LEU H 4.100 . 4.100 4.097 4.066 4.133 0.033 11 0 "[ . 1 . 2]" 1
238 1 18 PRO HD2 1 18 PRO HG2 3.000 . 3.000 2.315 2.311 2.320 . 0 0 "[ . 1 . 2]" 1
239 1 18 PRO HD2 1 19 LEU H 3.700 . 3.700 3.008 2.943 3.118 . 0 0 "[ . 1 . 2]" 1
240 1 18 PRO HD3 1 18 PRO HG2 3.000 . 3.000 2.992 2.990 2.993 . 0 0 "[ . 1 . 2]" 1
241 1 19 LEU H 1 19 LEU HG 4.400 . 4.400 2.346 2.146 2.584 . 0 0 "[ . 1 . 2]" 1
242 1 19 LEU H 1 20 ILE H 3.200 . 3.200 2.558 2.536 2.572 . 0 0 "[ . 1 . 2]" 1
243 1 19 LEU H 1 20 ILE MD 5.100 . 5.100 4.952 4.672 5.058 . 0 0 "[ . 1 . 2]" 1
244 1 19 LEU H 1 111 LEU QD 5.300 . 5.300 4.443 4.253 4.592 . 0 0 "[ . 1 . 2]" 1
245 1 19 LEU H 1 115 ILE MD 5.900 . 5.900 4.813 4.545 4.990 . 0 0 "[ . 1 . 2]" 1
246 1 19 LEU HA 1 19 LEU HB2 2.800 . 2.800 3.011 3.007 3.014 0.214 7 0 "[ . 1 . 2]" 1
247 1 19 LEU HA 1 19 LEU MD2 2.500 . 2.500 1.967 1.781 2.139 . 0 0 "[ . 1 . 2]" 1
248 1 19 LEU HA 1 19 LEU HG 3.300 . 3.300 3.165 3.088 3.285 . 0 0 "[ . 1 . 2]" 1
249 1 19 LEU HA 1 20 ILE H 3.600 . 3.600 3.525 3.513 3.551 . 0 0 "[ . 1 . 2]" 1
250 1 19 LEU HA 1 22 ASP H 4.000 . 4.000 3.653 3.551 3.780 . 0 0 "[ . 1 . 2]" 1
251 1 19 LEU HA 1 22 ASP QB 3.500 . 3.500 3.011 2.779 3.181 . 0 0 "[ . 1 . 2]" 1
252 1 19 LEU HA 1 23 LEU H 4.000 . 4.000 3.832 3.654 4.035 0.035 7 0 "[ . 1 . 2]" 1
253 1 19 LEU HB2 1 19 LEU MD2 3.600 . 3.600 3.187 3.182 3.200 . 0 0 "[ . 1 . 2]" 1
254 1 19 LEU HB2 1 20 ILE H 4.500 . 4.500 2.596 2.311 2.646 . 0 0 "[ . 1 . 2]" 1
255 1 19 LEU HB2 1 115 ILE MD 3.600 . 3.600 2.834 2.425 3.105 . 0 0 "[ . 1 . 2]" 1
256 1 19 LEU HB3 1 19 LEU MD1 2.700 . 2.700 2.304 2.108 2.409 . 0 0 "[ . 1 . 2]" 1
257 1 19 LEU HB3 1 20 ILE H 4.300 . 4.300 3.635 3.525 3.694 . 0 0 "[ . 1 . 2]" 1
258 1 19 LEU HB3 1 111 LEU QD 3.700 . 3.700 1.959 1.818 2.243 . 0 0 "[ . 1 . 2]" 1
259 1 19 LEU HB3 1 115 ILE MD 4.000 . 4.000 2.659 2.394 2.834 . 0 0 "[ . 1 . 2]" 1
260 1 19 LEU MD1 1 19 LEU HG 2.500 . 2.500 2.092 2.081 2.125 . 0 0 "[ . 1 . 2]" 1
261 1 19 LEU MD1 1 111 LEU QD 2.500 . 2.500 2.163 1.882 2.724 0.224 9 0 "[ . 1 . 2]" 1
262 1 19 LEU MD1 1 115 ILE HA 6.100 2.500 6.100 4.477 4.055 4.828 . 0 0 "[ . 1 . 2]" 1
263 1 19 LEU MD1 1 115 ILE MD 3.200 . 3.200 3.279 3.163 3.336 0.136 13 0 "[ . 1 . 2]" 1
264 1 19 LEU MD2 1 19 LEU HG 2.500 . 2.500 2.094 2.083 2.127 . 0 0 "[ . 1 . 2]" 1
265 1 19 LEU MD2 1 20 ILE H 5.100 . 5.100 4.592 4.482 4.651 . 0 0 "[ . 1 . 2]" 1
266 1 19 LEU MD2 1 22 ASP QB 4.000 . 4.000 3.885 3.687 4.039 0.039 13 0 "[ . 1 . 2]" 1
267 1 19 LEU HG 1 20 ILE H 4.400 . 4.400 4.298 3.953 4.454 0.054 5 0 "[ . 1 . 2]" 1
268 1 19 LEU HG 1 111 LEU QD 3.500 . 3.500 3.558 3.429 3.758 0.258 5 0 "[ . 1 . 2]" 1
269 1 20 ILE H 1 20 ILE HB 4.200 . 4.200 2.500 2.474 2.522 . 0 0 "[ . 1 . 2]" 1
270 1 20 ILE H 1 21 HIS H 3.200 . 3.200 2.575 2.541 2.718 . 0 0 "[ . 1 . 2]" 1
271 1 20 ILE H 1 115 ILE MD 5.900 . 5.900 3.547 3.162 3.735 . 0 0 "[ . 1 . 2]" 1
272 1 20 ILE HA 1 20 ILE MG 3.300 . 3.300 2.436 2.358 2.479 . 0 0 "[ . 1 . 2]" 1
273 1 20 ILE HA 1 21 HIS H 3.800 . 3.800 3.535 3.527 3.548 . 0 0 "[ . 1 . 2]" 1
274 1 20 ILE HA 1 23 LEU H 3.800 . 3.800 3.551 3.467 3.649 . 0 0 "[ . 1 . 2]" 1
275 1 20 ILE HA 1 23 LEU MD2 4.300 . 4.300 3.222 2.838 3.507 . 0 0 "[ . 1 . 2]" 1
276 1 20 ILE HA 1 24 PHE H 3.800 . 3.800 3.678 3.556 3.806 0.006 7 0 "[ . 1 . 2]" 1
277 1 20 ILE HA 1 115 ILE MD 3.500 . 3.500 2.950 2.806 3.093 . 0 0 "[ . 1 . 2]" 1
278 1 20 ILE HB 1 21 HIS H 4.200 . 4.200 2.637 2.526 2.658 . 0 0 "[ . 1 . 2]" 1
279 1 20 ILE MD 1 115 ILE MD 3.200 . 3.200 3.186 3.052 3.305 0.105 19 0 "[ . 1 . 2]" 1
280 1 20 ILE MD 1 115 ILE HG12 4.300 . 4.300 3.742 3.288 4.012 . 0 0 "[ . 1 . 2]" 1
281 1 20 ILE MG 1 21 HIS H 4.900 . 4.900 3.510 3.442 3.552 . 0 0 "[ . 1 . 2]" 1
282 1 20 ILE MG 1 21 HIS HA 4.100 . 4.100 3.561 3.408 3.649 . 0 0 "[ . 1 . 2]" 1
283 1 20 ILE MG 1 23 LEU MD2 4.400 . 4.400 4.093 3.867 4.252 . 0 0 "[ . 1 . 2]" 1
284 1 20 ILE MG 1 24 PHE HD1 3.400 . 3.400 2.775 2.568 3.136 . 0 0 "[ . 1 . 2]" 1
285 1 20 ILE MG 1 24 PHE HE1 3.500 . 3.500 2.395 2.146 2.654 . 0 0 "[ . 1 . 2]" 1
286 1 20 ILE MG 1 115 ILE MD 3.800 . 3.800 3.582 3.437 3.699 . 0 0 "[ . 1 . 2]" 1
287 1 21 HIS H 1 21 HIS HB2 3.800 . 3.800 2.270 2.062 2.447 . 0 0 "[ . 1 . 2]" 1
288 1 21 HIS H 1 22 ASP H 3.200 . 3.200 2.682 2.605 2.785 . 0 0 "[ . 1 . 2]" 1
289 1 21 HIS HA 1 21 HIS HB2 2.700 . 2.700 2.858 2.496 3.011 0.311 16 0 "[ . 1 . 2]" 1
290 1 21 HIS HA 1 22 ASP H 3.600 . 3.600 3.541 3.527 3.559 . 0 0 "[ . 1 . 2]" 1
291 1 21 HIS HB2 1 21 HIS HD2 3.700 . 3.700 2.996 2.692 3.594 . 0 0 "[ . 1 . 2]" 1
292 1 21 HIS HB2 1 22 ASP H 3.800 . 3.800 3.053 2.688 3.854 0.054 7 0 "[ . 1 . 2]" 1
293 1 22 ASP H 1 22 ASP HB2 4.000 . 4.000 2.422 2.318 2.569 . 0 0 "[ . 1 . 2]" 1
294 1 22 ASP H 1 22 ASP HB3 4.000 . 4.000 3.233 2.557 3.590 . 0 0 "[ . 1 . 2]" 1
295 1 22 ASP H 1 23 LEU H 3.200 . 3.200 2.488 2.454 2.514 . 0 0 "[ . 1 . 2]" 1
296 1 22 ASP H 1 23 LEU HB2 4.800 . 4.800 4.853 4.812 4.888 0.088 16 0 "[ . 1 . 2]" 1
297 1 22 ASP H 1 23 LEU HB3 4.500 . 4.500 4.615 4.581 4.646 0.146 13 0 "[ . 1 . 2]" 1
298 1 22 ASP HA 1 23 LEU H 3.600 . 3.600 3.521 3.507 3.534 . 0 0 "[ . 1 . 2]" 1
299 1 22 ASP HB2 1 23 LEU H 4.000 . 4.000 3.047 2.569 3.832 . 0 0 "[ . 1 . 2]" 1
300 1 22 ASP HB3 1 23 LEU H 4.000 . 4.000 3.202 2.529 3.577 . 0 0 "[ . 1 . 2]" 1
301 1 23 LEU H 1 24 PHE H 3.200 . 3.200 2.633 2.564 2.697 . 0 0 "[ . 1 . 2]" 1
302 1 23 LEU HA 1 23 LEU MD1 3.500 . 3.500 2.117 1.899 2.270 . 0 0 "[ . 1 . 2]" 1
303 1 23 LEU HA 1 23 LEU MD2 4.000 . 4.000 3.878 3.864 3.904 . 0 0 "[ . 1 . 2]" 1
304 1 23 LEU HA 1 23 LEU HG 4.400 . 4.400 3.160 3.101 3.185 . 0 0 "[ . 1 . 2]" 1
305 1 23 LEU HA 1 24 PHE H 3.800 . 3.800 3.527 3.519 3.532 . 0 0 "[ . 1 . 2]" 1
306 1 23 LEU HA 1 111 LEU QD 4.200 . 4.200 3.561 3.185 4.169 . 0 0 "[ . 1 . 2]" 1
307 1 23 LEU HB2 1 23 LEU MD2 3.500 . 3.500 2.373 2.282 2.477 . 0 0 "[ . 1 . 2]" 1
308 1 23 LEU HB2 1 24 PHE H 4.800 . 4.800 3.897 3.886 3.912 . 0 0 "[ . 1 . 2]" 1
309 1 23 LEU HB2 1 111 LEU QD 3.500 . 3.500 2.271 2.008 3.364 . 0 0 "[ . 1 . 2]" 1
310 1 23 LEU HB3 1 24 PHE H 4.500 . 4.500 2.621 2.611 2.637 . 0 0 "[ . 1 . 2]" 1
311 1 23 LEU MD1 1 108 GLU HA 3.800 . 3.800 2.728 2.048 3.078 . 0 0 "[ . 1 . 2]" 1
312 1 23 LEU MD1 1 111 LEU HB2 3.600 . 3.600 2.946 1.943 3.276 . 0 0 "[ . 1 . 2]" 1
313 1 23 LEU MD1 1 112 VAL MG2 3.400 . 3.400 3.101 2.761 3.416 0.016 17 0 "[ . 1 . 2]" 1
314 1 23 LEU MD1 1 115 ILE MD 4.800 . 4.800 4.366 4.078 4.602 . 0 0 "[ . 1 . 2]" 1
315 1 23 LEU MD2 1 24 PHE H 6.000 . 6.000 4.349 4.279 4.391 . 0 0 "[ . 1 . 2]" 1
316 1 23 LEU MD2 1 24 PHE HE1 4.100 . 4.100 3.451 3.230 3.702 . 0 0 "[ . 1 . 2]" 1
317 1 23 LEU MD2 1 111 LEU H 6.000 . 6.000 4.379 4.061 4.543 . 0 0 "[ . 1 . 2]" 1
318 1 23 LEU MD2 1 111 LEU HB2 3.300 . 3.300 2.622 2.161 2.944 . 0 0 "[ . 1 . 2]" 1
319 1 23 LEU MD2 1 111 LEU QD 3.400 . 3.400 2.999 2.734 3.414 0.014 11 0 "[ . 1 . 2]" 1
320 1 23 LEU MD2 1 112 VAL H 6.000 . 6.000 3.324 2.957 3.556 . 0 0 "[ . 1 . 2]" 1
321 1 23 LEU MD2 1 112 VAL MG1 4.000 . 4.000 3.953 3.625 4.257 0.257 2 0 "[ . 1 . 2]" 1
322 1 23 LEU MD2 1 112 VAL MG2 2.900 . 2.900 2.161 1.856 2.482 . 0 0 "[ . 1 . 2]" 1
323 1 23 LEU MD2 1 115 ILE MD 3.400 . 3.400 2.436 2.061 2.691 . 0 0 "[ . 1 . 2]" 1
324 1 24 PHE H 1 24 PHE HB2 3.900 . 3.900 2.212 2.160 2.275 . 0 0 "[ . 1 . 2]" 1
325 1 24 PHE H 1 24 PHE HB3 3.800 . 3.800 3.510 3.474 3.543 . 0 0 "[ . 1 . 2]" 1
326 1 24 PHE H 1 24 PHE HD1 3.200 . 3.200 2.374 2.255 2.528 . 0 0 "[ . 1 . 2]" 1
327 1 24 PHE H 1 25 GLU H 3.100 . 3.100 2.632 2.520 2.690 . 0 0 "[ . 1 . 2]" 1
328 1 24 PHE HA 1 24 PHE HD1 3.600 . 3.600 2.509 2.204 2.650 . 0 0 "[ . 1 . 2]" 1
329 1 24 PHE HA 1 24 PHE HE1 5.500 . 5.500 4.511 4.401 4.631 . 0 0 "[ . 1 . 2]" 1
330 1 24 PHE HA 1 25 GLU H 3.600 . 3.600 3.466 3.435 3.543 . 0 0 "[ . 1 . 2]" 1
331 1 24 PHE HB2 1 25 GLU H 3.900 . 3.900 3.140 2.746 3.290 . 0 0 "[ . 1 . 2]" 1
332 1 24 PHE HB3 1 25 GLU H 3.800 . 3.800 3.672 3.406 3.820 0.020 11 0 "[ . 1 . 2]" 1
333 1 24 PHE HE1 1 115 ILE MD 4.600 . 4.600 4.228 3.958 4.505 . 0 0 "[ . 1 . 2]" 1
334 1 25 GLU H 1 25 GLU HB2 4.300 . 4.300 2.397 2.059 2.719 . 0 0 "[ . 1 . 2]" 1
335 1 25 GLU H 1 25 GLU HB3 4.300 . 4.300 3.031 2.476 3.597 . 0 0 "[ . 1 . 2]" 1
336 1 25 GLU H 1 26 THR H 3.000 . 3.000 2.709 2.362 2.863 . 0 0 "[ . 1 . 2]" 1
337 1 25 GLU HA 1 25 GLU HB2 3.000 . 3.000 2.712 2.444 3.017 0.017 6 0 "[ . 1 . 2]" 1
338 1 25 GLU HA 1 25 GLU HB3 3.000 . 3.000 2.833 2.532 3.022 0.022 13 0 "[ . 1 . 2]" 1
339 1 25 GLU HA 1 27 ARG H 4.000 . 4.000 3.682 3.320 4.031 0.031 19 0 "[ . 1 . 2]" 1
340 1 25 GLU HB2 1 26 THR H 4.300 . 4.300 3.557 2.674 4.024 . 0 0 "[ . 1 . 2]" 1
341 1 25 GLU HB3 1 26 THR H 4.300 . 4.300 3.201 2.414 4.102 . 0 0 "[ . 1 . 2]" 1
342 1 26 THR H 1 26 THR HB 3.600 . 3.600 2.928 2.452 3.590 . 0 0 "[ . 1 . 2]" 1
343 1 26 THR H 1 26 THR MG 4.800 . 4.800 2.333 1.942 3.752 . 0 0 "[ . 1 . 2]" 1
344 1 26 THR H 1 27 ARG H 3.200 . 3.200 2.647 2.430 2.830 . 0 0 "[ . 1 . 2]" 1
345 1 26 THR HA 1 26 THR HB 2.600 . 2.600 2.515 2.363 3.010 0.410 6 0 "[ . 1 . 2]" 1
346 1 26 THR HB 1 26 THR MG 2.500 . 2.500 2.095 2.072 2.119 . 0 0 "[ . 1 . 2]" 1
347 1 26 THR MG 1 27 ARG H 4.800 . 4.800 3.174 2.295 4.268 . 0 0 "[ . 1 . 2]" 1
348 1 26 THR MG 1 108 GLU QB 4.000 . 4.000 3.937 2.820 5.006 1.006 2 3 "[ + . *1 . -2]" 1
349 1 28 TRP H 1 28 TRP HB2 3.800 . 3.800 2.325 2.068 3.570 . 0 0 "[ . 1 . 2]" 1
350 1 28 TRP H 1 28 TRP HB3 3.800 . 3.800 3.168 2.344 3.602 . 0 0 "[ . 1 . 2]" 1
351 1 29 HIS HA 1 29 HIS HD2 3.900 . 3.900 3.133 2.024 4.052 0.152 7 0 "[ . 1 . 2]" 1
352 1 31 THR H 1 31 THR HB 3.700 . 3.700 3.559 2.873 3.952 0.252 18 0 "[ . 1 . 2]" 1
353 1 31 THR HA 1 31 THR HB 3.100 . 3.100 2.618 2.324 3.016 . 0 0 "[ . 1 . 2]" 1
354 1 31 THR HA 1 31 THR MG 2.900 . 2.900 2.423 2.025 3.222 0.322 4 0 "[ . 1 . 2]" 1
355 1 31 THR HB 1 132 MET ME 3.400 . 3.400 3.225 2.625 3.486 0.086 13 0 "[ . 1 . 2]" 1
356 1 31 THR MG 1 132 MET ME 2.800 . 2.800 2.655 1.765 3.108 0.308 15 0 "[ . 1 . 2]" 1
357 1 32 GLY HA2 1 33 ARG H 3.700 . 3.700 3.565 3.516 3.580 . 0 0 "[ . 1 . 2]" 1
358 1 32 GLY HA3 1 33 ARG H 3.700 . 3.700 2.678 2.611 2.896 . 0 0 "[ . 1 . 2]" 1
359 1 33 ARG H 1 33 ARG HB2 4.300 . 4.300 3.109 2.232 3.701 . 0 0 "[ . 1 . 2]" 1
360 1 33 ARG H 1 33 ARG HD2 3.900 . 3.900 3.789 3.206 4.190 0.290 10 0 "[ . 1 . 2]" 1
361 1 33 ARG H 1 33 ARG HG2 4.500 . 4.500 3.316 1.906 4.635 0.135 11 0 "[ . 1 . 2]" 1
362 1 33 ARG H 1 33 ARG HG3 4.400 . 4.400 2.956 1.830 4.805 0.405 18 0 "[ . 1 . 2]" 1
363 1 33 ARG H 1 34 GLU H 3.200 . 3.200 2.308 2.071 2.511 . 0 0 "[ . 1 . 2]" 1
364 1 33 ARG H 1 34 GLU HB3 5.000 . 5.000 4.628 4.356 4.999 . 0 0 "[ . 1 . 2]" 1
365 1 33 ARG HA 1 33 ARG HB2 2.800 . 2.800 2.674 2.392 3.015 0.215 4 0 "[ . 1 . 2]" 1
366 1 34 GLU H 1 34 GLU HB2 4.300 . 4.300 2.642 2.186 3.679 . 0 0 "[ . 1 . 2]" 1
367 1 34 GLU H 1 34 GLU HB3 4.100 . 4.100 2.584 2.415 3.055 . 0 0 "[ . 1 . 2]" 1
368 1 34 GLU H 1 34 GLU HG2 4.200 . 4.200 4.261 2.028 4.626 0.426 10 0 "[ . 1 . 2]" 1
369 1 34 GLU H 1 35 ILE H 3.200 . 3.200 2.397 2.307 2.674 . 0 0 "[ . 1 . 2]" 1
370 1 34 GLU H 1 35 ILE HB 4.400 . 4.400 4.512 4.432 4.596 0.196 18 0 "[ . 1 . 2]" 1
371 1 34 GLU HA 1 34 GLU HB2 2.700 . 2.700 2.507 2.421 2.764 0.064 18 0 "[ . 1 . 2]" 1
372 1 35 ILE HA 1 35 ILE MD 3.700 . 3.700 3.502 1.930 3.822 0.122 3 0 "[ . 1 . 2]" 1
373 1 35 ILE HA 1 35 ILE MG 3.200 . 3.200 2.455 2.359 2.514 . 0 0 "[ . 1 . 2]" 1
374 1 35 ILE HA 1 36 TRP H 3.600 . 3.600 2.147 2.128 2.184 . 0 0 "[ . 1 . 2]" 1
375 1 35 ILE HA 1 132 MET HA 3.500 . 3.500 2.569 2.059 2.853 . 0 0 "[ . 1 . 2]" 1
376 1 35 ILE HB 1 35 ILE MD 3.000 . 3.000 2.578 2.383 3.209 0.209 9 0 "[ . 1 . 2]" 1
377 1 35 ILE MD 1 35 ILE MG 2.500 . 2.500 1.861 1.640 2.060 . 0 0 "[ . 1 . 2]" 1
378 1 35 ILE MD 1 36 TRP H 5.700 . 5.700 4.744 3.505 5.124 . 0 0 "[ . 1 . 2]" 1
379 1 35 ILE MD 1 130 ALA MB 3.400 . 3.400 3.544 3.462 3.707 0.307 16 0 "[ . 1 . 2]" 1
380 1 35 ILE MD 1 132 MET HA 3.800 . 3.800 3.598 2.055 3.914 0.114 1 0 "[ . 1 . 2]" 1
381 1 35 ILE MD 1 132 MET HB2 3.900 . 3.900 2.776 1.903 3.215 . 0 0 "[ . 1 . 2]" 1
382 1 35 ILE MD 1 132 MET ME 2.700 . 2.700 1.819 1.700 1.928 . 0 0 "[ . 1 . 2]" 1
383 1 35 ILE MD 1 132 MET HG2 4.100 . 4.100 4.078 3.328 4.456 0.356 18 0 "[ . 1 . 2]" 1
384 1 35 ILE MG 1 36 TRP H 6.000 . 6.000 2.472 2.202 2.943 . 0 0 "[ . 1 . 2]" 1
385 1 35 ILE MG 1 36 TRP HA 4.700 . 4.700 3.672 3.542 3.826 . 0 0 "[ . 1 . 2]" 1
386 1 35 ILE MG 1 37 ILE HG12 4.000 . 4.000 3.166 2.943 3.499 . 0 0 "[ . 1 . 2]" 1
387 1 35 ILE MG 1 37 ILE HG13 4.000 . 4.000 2.706 2.443 2.967 . 0 0 "[ . 1 . 2]" 1
388 1 35 ILE MG 1 38 GLU H 6.000 . 6.000 5.900 5.769 6.061 0.061 11 0 "[ . 1 . 2]" 1
389 1 35 ILE MG 1 130 ALA HA 3.900 . 3.900 3.473 3.305 3.677 . 0 0 "[ . 1 . 2]" 1
390 1 35 ILE MG 1 130 ALA MB 3.100 . 3.100 2.380 2.155 2.571 . 0 0 "[ . 1 . 2]" 1
391 1 35 ILE MG 1 131 ARG H 6.000 . 6.000 2.618 2.381 3.017 . 0 0 "[ . 1 . 2]" 1
392 1 35 ILE MG 1 132 MET HA 4.300 . 4.300 3.572 3.320 4.226 . 0 0 "[ . 1 . 2]" 1
393 1 35 ILE MG 1 132 MET ME 3.800 . 3.800 3.782 3.452 3.935 0.135 11 0 "[ . 1 . 2]" 1
394 1 35 ILE MG 1 137 LEU MD1 4.500 . 4.500 2.326 1.823 4.290 . 0 0 "[ . 1 . 2]" 1
395 1 36 TRP H 1 36 TRP HB2 3.900 . 3.900 2.818 2.600 3.073 . 0 0 "[ . 1 . 2]" 1
396 1 36 TRP H 1 36 TRP HB3 3.900 . 3.900 2.671 2.576 2.800 . 0 0 "[ . 1 . 2]" 1
397 1 36 TRP H 1 131 ARG H 3.100 . 3.100 2.908 2.702 3.075 . 0 0 "[ . 1 . 2]" 1
398 1 36 TRP HA 1 36 TRP HD1 4.700 . 4.700 4.369 4.225 4.721 0.021 16 0 "[ . 1 . 2]" 1
399 1 36 TRP HA 1 36 TRP HE3 3.700 . 3.700 2.640 1.876 2.935 . 0 0 "[ . 1 . 2]" 1
400 1 36 TRP HA 1 37 ILE H 3.500 . 3.500 2.173 2.147 2.221 . 0 0 "[ . 1 . 2]" 1
401 1 36 TRP HB2 1 36 TRP HE3 4.200 . 4.200 2.797 2.664 3.132 . 0 0 "[ . 1 . 2]" 1
402 1 36 TRP HB3 1 36 TRP HE3 4.400 . 4.400 4.189 4.159 4.221 . 0 0 "[ . 1 . 2]" 1
403 1 36 TRP HD1 1 38 GLU HB2 4.700 . 4.700 3.996 3.318 4.964 0.264 16 0 "[ . 1 . 2]" 1
404 1 37 ILE H 1 37 ILE HB 4.400 . 4.400 2.598 2.564 2.643 . 0 0 "[ . 1 . 2]" 1
405 1 37 ILE H 1 37 ILE HG12 5.000 . 5.000 3.886 3.800 4.019 . 0 0 "[ . 1 . 2]" 1
406 1 37 ILE H 1 37 ILE HG13 4.800 . 4.800 2.646 2.517 2.809 . 0 0 "[ . 1 . 2]" 1
407 1 37 ILE HA 1 37 ILE MD 3.900 . 3.900 3.854 3.825 3.874 . 0 0 "[ . 1 . 2]" 1
408 1 37 ILE HA 1 37 ILE HG13 4.400 . 4.400 2.958 2.900 3.034 . 0 0 "[ . 1 . 2]" 1
409 1 37 ILE HA 1 37 ILE MG 2.900 . 2.900 2.394 2.345 2.416 . 0 0 "[ . 1 . 2]" 1
410 1 37 ILE HA 1 38 GLU H 3.400 . 3.400 2.172 2.144 2.208 . 0 0 "[ . 1 . 2]" 1
411 1 37 ILE HA 1 130 ALA HA 3.400 . 3.400 2.265 2.133 2.384 . 0 0 "[ . 1 . 2]" 1
412 1 37 ILE HA 1 130 ALA MB 4.500 . 4.500 3.579 3.318 3.789 . 0 0 "[ . 1 . 2]" 1
413 1 37 ILE HA 1 131 ARG H 3.400 . 3.400 3.374 3.191 3.563 0.163 18 0 "[ . 1 . 2]" 1
414 1 37 ILE HB 1 37 ILE MD 3.200 . 3.200 2.403 2.254 2.467 . 0 0 "[ . 1 . 2]" 1
415 1 37 ILE HB 1 38 GLU H 4.400 . 4.400 4.045 3.922 4.164 . 0 0 "[ . 1 . 2]" 1
416 1 37 ILE MD 1 37 ILE MG 2.600 . 2.600 1.939 1.814 2.208 . 0 0 "[ . 1 . 2]" 1
417 1 37 ILE MD 1 38 GLU H 6.000 . 6.000 4.987 4.837 5.105 . 0 0 "[ . 1 . 2]" 1
418 1 37 ILE MD 1 130 ALA HA 4.200 . 4.200 4.269 4.173 4.332 0.132 20 0 "[ . 1 . 2]" 1
419 1 37 ILE MD 1 130 ALA MB 3.400 . 3.400 3.204 3.004 3.494 0.094 8 0 "[ . 1 . 2]" 1
420 1 37 ILE MD 1 131 ARG H 6.000 . 6.000 5.249 5.081 5.422 . 0 0 "[ . 1 . 2]" 1
421 1 37 ILE HG12 1 37 ILE MG 3.300 . 3.300 2.315 2.250 2.376 . 0 0 "[ . 1 . 2]" 1
422 1 37 ILE HG13 1 37 ILE MG 3.100 . 3.100 3.191 3.183 3.195 0.095 13 0 "[ . 1 . 2]" 1
423 1 37 ILE HG13 1 38 GLU H 4.800 . 4.800 4.945 4.913 4.974 0.174 13 0 "[ . 1 . 2]" 1
424 1 37 ILE MG 1 38 GLU H 5.800 . 5.800 2.423 2.245 2.614 . 0 0 "[ . 1 . 2]" 1
425 1 37 ILE MG 1 124 LEU QD 3.300 . 3.300 2.031 1.764 2.877 . 0 0 "[ . 1 . 2]" 1
426 1 37 ILE MG 1 128 TYR HB2 3.800 . 3.800 3.265 2.993 3.510 . 0 0 "[ . 1 . 2]" 1
427 1 37 ILE MG 1 128 TYR HB3 4.100 . 4.100 2.362 2.094 2.567 . 0 0 "[ . 1 . 2]" 1
428 1 37 ILE MG 1 128 TYR HD1 3.700 . 3.700 2.709 2.297 3.290 . 0 0 "[ . 1 . 2]" 1
429 1 37 ILE MG 1 130 ALA HA 3.100 . 3.100 3.212 3.121 3.315 0.215 16 0 "[ . 1 . 2]" 1
430 1 37 ILE MG 1 130 ALA MB 3.000 . 3.000 3.260 3.004 3.483 0.483 4 0 "[ . 1 . 2]" 1
431 1 37 ILE MG 1 131 ARG H 5.700 . 5.700 4.890 4.755 5.004 . 0 0 "[ . 1 . 2]" 1
432 1 38 GLU H 1 38 GLU HB2 4.300 . 4.300 2.899 2.585 3.924 . 0 0 "[ . 1 . 2]" 1
433 1 38 GLU H 1 38 GLU HB3 4.300 . 4.300 3.591 2.754 3.855 . 0 0 "[ . 1 . 2]" 1
434 1 38 GLU H 1 38 GLU HG2 4.200 . 4.200 3.736 2.739 4.396 0.196 2 0 "[ . 1 . 2]" 1
435 1 38 GLU H 1 128 TYR HB3 3.600 . 3.600 3.715 3.431 3.813 0.213 5 0 "[ . 1 . 2]" 1
436 1 38 GLU H 1 129 SER H 3.100 . 3.100 2.868 2.764 3.027 . 0 0 "[ . 1 . 2]" 1
437 1 38 GLU H 1 130 ALA HA 3.500 . 3.500 3.607 3.522 3.748 0.248 8 0 "[ . 1 . 2]" 1
438 1 38 GLU H 1 130 ALA MB 5.700 . 5.700 4.758 4.506 4.950 . 0 0 "[ . 1 . 2]" 1
439 1 38 GLU HA 1 39 ARG H 3.600 . 3.600 2.334 2.190 2.468 . 0 0 "[ . 1 . 2]" 1
440 1 38 GLU HB2 1 38 GLU HG2 2.600 . 2.600 2.659 2.498 2.998 0.398 19 0 "[ . 1 . 2]" 1
441 1 38 GLU HB3 1 39 ARG H 4.300 . 4.300 2.922 2.398 3.993 . 0 0 "[ . 1 . 2]" 1
442 1 38 GLU HG2 1 39 ARG H 4.200 . 4.200 4.065 2.558 4.304 0.104 20 0 "[ . 1 . 2]" 1
443 1 39 ARG H 1 128 TYR HD1 3.300 . 3.300 3.367 3.077 3.627 0.327 17 0 "[ . 1 . 2]" 1
444 1 39 ARG HA 1 40 VAL H 3.800 . 3.800 2.154 2.136 2.173 . 0 0 "[ . 1 . 2]" 1
445 1 39 ARG HA 1 41 LYS H 3.800 . 3.800 3.547 3.383 3.766 . 0 0 "[ . 1 . 2]" 1
446 1 39 ARG HA 1 128 TYR HA 3.500 . 3.500 2.082 1.828 2.462 . 0 0 "[ . 1 . 2]" 1
447 1 39 ARG HA 1 129 SER H 3.800 . 3.800 3.380 3.178 3.615 . 0 0 "[ . 1 . 2]" 1
448 1 40 VAL H 1 40 VAL HB 4.200 . 4.200 3.599 2.828 3.700 . 0 0 "[ . 1 . 2]" 1
449 1 40 VAL H 1 41 LYS H 3.100 . 3.100 2.224 1.990 2.361 . 0 0 "[ . 1 . 2]" 1
450 1 40 VAL H 1 128 TYR HA 3.400 . 3.400 2.137 1.954 2.459 . 0 0 "[ . 1 . 2]" 1
451 1 40 VAL H 1 129 SER H 3.100 . 3.100 3.252 3.133 3.377 0.277 8 0 "[ . 1 . 2]" 1
452 1 40 VAL HA 1 40 VAL HB 2.900 . 2.900 2.565 2.464 2.992 0.092 13 0 "[ . 1 . 2]" 1
453 1 40 VAL HA 1 40 VAL MG1 2.600 . 2.600 2.258 1.984 2.346 . 0 0 "[ . 1 . 2]" 1
454 1 40 VAL HA 1 41 LYS H 3.600 . 3.600 3.467 3.383 3.530 . 0 0 "[ . 1 . 2]" 1
455 1 40 VAL HB 1 40 VAL MG1 2.500 . 2.500 2.118 2.084 2.128 . 0 0 "[ . 1 . 2]" 1
456 1 40 VAL HB 1 41 LYS H 4.200 . 4.200 3.773 2.803 4.076 . 0 0 "[ . 1 . 2]" 1
457 1 40 VAL MG2 1 41 LYS H 5.200 . 5.200 2.281 1.916 3.548 . 0 0 "[ . 1 . 2]" 1
458 1 40 VAL MG2 1 127 ASN HA 3.900 . 3.900 3.767 3.377 4.131 0.231 13 0 "[ . 1 . 2]" 1
459 1 40 VAL MG2 1 128 TYR H 5.200 . 5.200 4.106 3.544 4.537 . 0 0 "[ . 1 . 2]" 1
460 1 40 VAL MG2 1 128 TYR HA 3.300 . 3.300 2.721 2.414 3.204 . 0 0 "[ . 1 . 2]" 1
461 1 40 VAL MG2 1 129 SER H 5.200 . 5.200 2.914 2.394 3.564 . 0 0 "[ . 1 . 2]" 1
462 1 40 VAL MG2 1 129 SER HA 3.800 . 3.800 3.386 2.975 3.653 . 0 0 "[ . 1 . 2]" 1
463 1 40 VAL MG2 1 129 SER HB2 3.400 . 3.400 2.660 1.897 3.564 0.164 5 0 "[ . 1 . 2]" 1
464 1 40 VAL MG2 1 129 SER HB3 3.300 . 3.300 2.699 1.825 3.562 0.262 19 0 "[ . 1 . 2]" 1
465 1 41 LYS H 1 41 LYS HB2 4.300 . 4.300 2.732 2.524 3.063 . 0 0 "[ . 1 . 2]" 1
466 1 41 LYS H 1 127 ASN HA 3.500 . 3.500 3.476 3.206 3.683 0.183 11 0 "[ . 1 . 2]" 1
467 1 41 LYS H 1 128 TYR HA 3.400 . 3.400 3.483 3.288 3.685 0.285 13 0 "[ . 1 . 2]" 1
468 1 41 LYS HB2 1 42 ASP H 4.300 . 4.300 3.974 3.669 4.318 0.018 8 0 "[ . 1 . 2]" 1
469 1 41 LYS HB2 1 127 ASN HA 3.900 . 3.900 2.497 1.858 3.585 . 0 0 "[ . 1 . 2]" 1
470 1 41 LYS HB3 1 42 ASP H 4.200 . 4.200 2.950 2.274 3.774 . 0 0 "[ . 1 . 2]" 1
471 1 42 ASP H 1 42 ASP HB2 4.100 . 4.100 2.882 2.372 3.821 . 0 0 "[ . 1 . 2]" 1
472 1 42 ASP H 1 42 ASP HB3 4.000 . 4.000 3.249 2.680 3.716 . 0 0 "[ . 1 . 2]" 1
473 1 42 ASP HA 1 42 ASP HB3 3.100 . 3.100 2.655 2.414 3.024 . 0 0 "[ . 1 . 2]" 1
474 1 44 LYS HB2 1 45 ILE H 4.400 . 4.400 3.847 2.538 4.421 0.021 5 0 "[ . 1 . 2]" 1
475 1 44 LYS HD2 1 45 ILE H 4.500 . 4.500 3.804 2.070 4.698 0.198 12 0 "[ . 1 . 2]" 1
476 1 45 ILE H 1 45 ILE HB 4.300 . 4.300 2.759 2.204 3.668 . 0 0 "[ . 1 . 2]" 1
477 1 45 ILE H 1 45 ILE HG12 4.600 . 4.600 3.283 1.834 4.714 0.114 12 0 "[ . 1 . 2]" 1
478 1 45 ILE HA 1 45 ILE MG 3.000 . 3.000 2.486 2.131 3.163 0.163 2 0 "[ . 1 . 2]" 1
479 1 45 ILE HA 1 46 PRO HD2 3.500 . 3.500 2.475 2.052 2.885 . 0 0 "[ . 1 . 2]" 1
480 1 45 ILE HA 1 46 PRO HD3 3.400 . 3.400 2.121 1.841 2.477 . 0 0 "[ . 1 . 2]" 1
481 1 45 ILE HA 1 126 ILE MD 3.700 . 3.700 3.781 3.606 4.046 0.346 19 0 "[ . 1 . 2]" 1
482 1 45 ILE HB 1 45 ILE MG 2.500 . 2.500 2.114 2.083 2.128 . 0 0 "[ . 1 . 2]" 1
483 1 45 ILE MD 1 45 ILE HG12 2.600 . 2.600 2.089 2.070 2.114 . 0 0 "[ . 1 . 2]" 1
484 1 45 ILE MD 1 119 GLU HA 3.000 . 3.000 2.760 1.917 3.110 0.110 19 0 "[ . 1 . 2]" 1
485 1 45 ILE MD 1 119 GLU HB2 3.200 . 3.200 2.113 1.723 3.546 0.346 12 0 "[ . 1 . 2]" 1
486 1 45 ILE MD 1 119 GLU HG2 3.500 . 3.500 3.411 1.906 3.818 0.318 1 0 "[ . 1 . 2]" 1
487 1 45 ILE MD 1 123 ASP HB2 3.500 . 3.500 2.132 1.840 2.953 . 0 0 "[ . 1 . 2]" 1
488 1 45 ILE MD 1 123 ASP HB3 3.200 . 3.200 3.247 2.965 3.449 0.249 13 0 "[ . 1 . 2]" 1
489 1 45 ILE HG12 1 45 ILE MG 3.000 . 3.000 2.386 1.961 3.196 0.196 16 0 "[ . 1 . 2]" 1
490 1 45 ILE HG12 1 119 GLU HB2 3.800 . 3.800 3.925 3.622 4.148 0.348 20 0 "[ . 1 . 2]" 1
491 1 45 ILE MG 1 46 PRO HD2 3.200 . 3.200 2.536 1.817 3.328 0.128 2 0 "[ . 1 . 2]" 1
492 1 45 ILE MG 1 46 PRO HD3 3.800 . 3.800 3.451 2.737 4.121 0.321 6 0 "[ . 1 . 2]" 1
493 1 46 PRO HA 1 46 PRO HB3 2.900 . 2.900 2.292 2.268 2.314 . 0 0 "[ . 1 . 2]" 1
494 1 46 PRO HA 1 46 PRO HG2 4.200 . 4.200 3.915 3.848 4.029 . 0 0 "[ . 1 . 2]" 1
495 1 46 PRO HA 1 46 PRO HG3 3.900 . 3.900 3.543 2.981 4.040 0.140 8 0 "[ . 1 . 2]" 1
496 1 46 PRO HA 1 47 SER H 2.500 . 2.500 2.240 2.160 2.481 . 0 0 "[ . 1 . 2]" 1
497 1 46 PRO HB3 1 66 TYR HE1 4.500 . 4.500 3.438 2.281 4.581 0.081 8 0 "[ . 1 . 2]" 1
498 1 46 PRO HD2 1 49 LEU MD1 6.600 . 6.600 3.400 2.350 4.488 . 0 0 "[ . 1 . 2]" 1
499 1 46 PRO HD2 1 126 ILE MD 3.600 . 3.600 2.963 2.547 3.330 . 0 0 "[ . 1 . 2]" 1
500 1 46 PRO HD3 1 49 LEU MD1 6.400 2.500 6.400 3.851 2.974 4.477 . 0 0 "[ . 1 . 2]" 1
501 1 46 PRO HG2 1 49 LEU HB2 3.400 . 3.400 2.601 1.937 3.563 0.163 3 0 "[ . 1 . 2]" 1
502 1 46 PRO HG2 1 49 LEU MD1 3.200 . 3.200 2.074 1.783 2.665 . 0 0 "[ . 1 . 2]" 1
503 1 47 SER H 1 48 THR H 3.000 . 3.000 2.339 1.982 2.614 . 0 0 "[ . 1 . 2]" 1
504 1 47 SER HA 1 49 LEU H 4.000 . 4.000 3.803 3.659 3.924 . 0 0 "[ . 1 . 2]" 1
505 1 47 SER HA 1 50 VAL H 4.500 . 4.500 3.615 3.309 4.188 . 0 0 "[ . 1 . 2]" 1
506 1 48 THR H 1 48 THR HB 3.600 . 3.600 2.638 2.486 2.760 . 0 0 "[ . 1 . 2]" 1
507 1 48 THR HA 1 48 THR MG 2.500 . 2.500 2.307 2.141 2.421 . 0 0 "[ . 1 . 2]" 1
508 1 48 THR HA 1 49 LEU H 3.700 . 3.700 3.356 3.127 3.488 . 0 0 "[ . 1 . 2]" 1
509 1 48 THR HA 1 50 VAL H 5.700 . 5.700 3.878 3.655 4.120 . 0 0 "[ . 1 . 2]" 1
510 1 48 THR HA 1 51 LYS H 3.700 . 3.700 3.680 3.539 3.781 0.081 18 0 "[ . 1 . 2]" 1
511 1 48 THR HA 1 52 PRO HD2 3.900 . 3.900 3.798 3.327 3.959 0.059 6 0 "[ . 1 . 2]" 1
512 1 48 THR HA 1 52 PRO HD3 4.000 . 4.000 2.844 2.602 3.120 . 0 0 "[ . 1 . 2]" 1
513 1 48 THR HB 1 48 THR MG 2.500 . 2.500 2.090 2.072 2.118 . 0 0 "[ . 1 . 2]" 1
514 1 48 THR MG 1 52 PRO HD2 4.200 . 4.200 4.210 3.870 4.366 0.166 10 0 "[ . 1 . 2]" 1
515 1 49 LEU H 1 49 LEU MD2 5.400 . 5.400 3.756 3.278 4.388 . 0 0 "[ . 1 . 2]" 1
516 1 49 LEU H 1 50 VAL H 3.300 . 3.300 2.219 1.976 2.440 . 0 0 "[ . 1 . 2]" 1
517 1 49 LEU H 1 50 VAL HB 5.500 . 5.500 5.633 5.008 5.837 0.337 13 0 "[ . 1 . 2]" 1
518 1 49 LEU H 1 51 LYS H 4.700 . 4.700 3.816 3.396 4.110 . 0 0 "[ . 1 . 2]" 1
519 1 49 LEU HA 1 49 LEU HB2 3.100 . 3.100 3.004 2.889 3.017 . 0 0 "[ . 1 . 2]" 1
520 1 49 LEU HA 1 49 LEU MD1 3.700 . 3.700 3.820 3.729 3.884 0.184 12 0 "[ . 1 . 2]" 1
521 1 49 LEU HA 1 49 LEU MD2 2.500 . 2.500 2.152 1.912 2.523 0.023 17 0 "[ . 1 . 2]" 1
522 1 49 LEU HA 1 50 VAL H 3.600 . 3.600 3.354 3.265 3.448 . 0 0 "[ . 1 . 2]" 1
523 1 49 LEU HA 1 54 TYR HE1 3.400 . 3.400 2.499 2.042 3.146 . 0 0 "[ . 1 . 2]" 1
524 1 49 LEU HA 1 62 MET ME 5.500 . 5.500 2.922 2.270 3.402 . 0 0 "[ . 1 . 2]" 1
525 1 49 LEU HB2 1 49 LEU MD1 2.700 . 2.700 2.308 2.067 2.459 . 0 0 "[ . 1 . 2]" 1
526 1 49 LEU HB2 1 50 VAL H 4.500 . 4.500 3.382 3.075 3.596 . 0 0 "[ . 1 . 2]" 1
527 1 49 LEU MD1 1 49 LEU MD2 2.500 . 2.500 1.939 1.860 2.052 . 0 0 "[ . 1 . 2]" 1
528 1 49 LEU MD1 1 50 VAL H 5.900 . 5.900 5.115 4.835 5.350 . 0 0 "[ . 1 . 2]" 1
529 1 49 LEU MD1 1 63 LEU HA 3.000 . 3.000 3.275 2.961 3.548 0.548 13 2 "[ . 1 + . - 2]" 1
530 1 49 LEU MD1 1 63 LEU MD1 2.500 . 2.500 1.944 1.708 2.503 0.003 17 0 "[ . 1 . 2]" 1
531 1 49 LEU MD1 1 66 TYR H 5.000 . 5.000 5.004 4.706 5.143 0.143 19 0 "[ . 1 . 2]" 1
532 1 49 LEU MD1 1 66 TYR QB 4.000 . 4.000 2.820 2.351 3.044 . 0 0 "[ . 1 . 2]" 1
533 1 49 LEU MD1 1 66 TYR HD1 3.500 . 3.500 2.050 1.933 2.236 . 0 0 "[ . 1 . 2]" 1
534 1 49 LEU MD1 1 66 TYR HE1 4.000 . 4.000 2.349 2.070 2.725 . 0 0 "[ . 1 . 2]" 1
535 1 49 LEU MD1 1 122 LEU MD2 2.500 . 2.500 2.111 1.896 2.568 0.068 17 0 "[ . 1 . 2]" 1
536 1 49 LEU MD2 1 50 VAL H 5.400 . 5.400 4.731 4.452 5.015 . 0 0 "[ . 1 . 2]" 1
537 1 49 LEU MD2 1 62 MET ME 2.500 . 2.500 1.887 1.703 2.196 . 0 0 "[ . 1 . 2]" 1
538 1 49 LEU MD2 1 63 LEU HA 3.000 . 3.000 3.127 2.526 3.525 0.525 6 2 "[ .+ 1- . 2]" 1
539 1 49 LEU MD2 1 66 TYR HB2 3.500 . 3.500 2.821 2.442 3.144 . 0 0 "[ . 1 . 2]" 1
540 1 49 LEU MD2 1 66 TYR HD1 3.400 . 3.400 3.538 3.390 3.709 0.309 3 0 "[ . 1 . 2]" 1
541 1 50 VAL H 1 50 VAL HB 4.200 . 4.200 3.627 2.888 3.762 . 0 0 "[ . 1 . 2]" 1
542 1 50 VAL H 1 50 VAL MG1 4.000 . 4.000 3.027 2.777 3.892 . 0 0 "[ . 1 . 2]" 1
543 1 50 VAL H 1 50 VAL MG2 4.000 . 4.000 2.005 1.843 2.339 . 0 0 "[ . 1 . 2]" 1
544 1 50 VAL H 1 51 LYS H 3.200 . 3.200 2.044 1.968 2.180 . 0 0 "[ . 1 . 2]" 1
545 1 50 VAL H 1 52 PRO HD2 3.900 . 3.900 3.103 2.776 3.373 . 0 0 "[ . 1 . 2]" 1
546 1 50 VAL H 1 52 PRO HD3 3.800 . 3.800 3.689 3.427 3.897 0.097 13 0 "[ . 1 . 2]" 1
547 1 50 VAL HA 1 50 VAL MG1 3.000 . 3.000 2.240 2.141 2.338 . 0 0 "[ . 1 . 2]" 1
548 1 50 VAL HA 1 50 VAL MG2 3.600 . 3.600 3.139 2.653 3.205 . 0 0 "[ . 1 . 2]" 1
549 1 50 VAL HA 1 51 LYS H 3.700 . 3.700 3.523 3.504 3.548 . 0 0 "[ . 1 . 2]" 1
550 1 50 VAL HA 1 118 THR MG 2.900 . 2.900 2.188 1.870 2.720 . 0 0 "[ . 1 . 2]" 1
551 1 50 VAL HA 1 122 LEU MD2 3.900 . 3.900 3.752 3.030 4.194 0.294 15 0 "[ . 1 . 2]" 1
552 1 50 VAL HB 1 50 VAL MG1 2.500 . 2.500 2.109 2.083 2.128 . 0 0 "[ . 1 . 2]" 1
553 1 50 VAL HB 1 50 VAL MG2 2.500 . 2.500 2.107 2.084 2.130 . 0 0 "[ . 1 . 2]" 1
554 1 50 VAL HB 1 51 LYS H 4.200 . 4.200 3.610 2.695 3.855 . 0 0 "[ . 1 . 2]" 1
555 1 50 VAL MG1 1 118 THR MG 2.500 . 2.500 1.957 1.813 2.456 . 0 0 "[ . 1 . 2]" 1
556 1 50 VAL MG1 1 119 GLU H 5.000 . 5.000 3.153 2.226 3.628 . 0 0 "[ . 1 . 2]" 1
557 1 50 VAL MG1 1 119 GLU HA 3.000 . 3.000 2.346 1.829 2.760 . 0 0 "[ . 1 . 2]" 1
558 1 50 VAL MG1 1 119 GLU QB 3.500 . 3.500 2.778 2.295 3.267 . 0 0 "[ . 1 . 2]" 1
559 1 50 VAL MG1 1 122 LEU MD1 2.500 . 2.500 2.082 1.718 2.477 . 0 0 "[ . 1 . 2]" 1
560 1 50 VAL MG2 1 119 GLU H 6.700 . 6.700 5.223 3.464 6.031 . 0 0 "[ . 1 . 2]" 1
561 1 50 VAL MG2 1 119 GLU HA 6.000 . 6.000 4.186 1.918 5.015 . 0 0 "[ . 1 . 2]" 1
562 1 51 LYS H 1 51 LYS HB2 4.400 . 4.400 2.179 2.079 2.404 . 0 0 "[ . 1 . 2]" 1
563 1 51 LYS H 1 51 LYS HG2 4.600 . 4.600 3.595 2.403 4.595 . 0 0 "[ . 1 . 2]" 1
564 1 51 LYS H 1 51 LYS HG3 4.500 . 4.500 3.594 2.778 4.318 . 0 0 "[ . 1 . 2]" 1
565 1 51 LYS H 1 52 PRO HD2 3.900 2.500 3.900 2.683 2.308 2.930 0.192 13 0 "[ . 1 . 2]" 1
566 1 51 LYS H 1 52 PRO HD3 3.800 2.500 3.800 2.541 2.438 2.971 0.062 19 0 "[ . 1 . 2]" 1
567 1 51 LYS HA 1 52 PRO HD2 5.000 3.700 5.000 4.236 3.869 4.329 . 0 0 "[ . 1 . 2]" 1
568 1 52 PRO HA 1 52 PRO HD2 4.200 . 4.200 3.926 3.901 4.087 . 0 0 "[ . 1 . 2]" 1
569 1 52 PRO HA 1 53 ASN H 3.600 . 3.600 2.255 2.190 2.323 . 0 0 "[ . 1 . 2]" 1
570 1 52 PRO HB2 1 54 TYR H 4.300 . 4.300 4.337 4.214 4.454 0.154 8 0 "[ . 1 . 2]" 1
571 1 53 ASN H 1 53 ASN HA 3.600 2.700 3.600 2.928 2.910 2.935 . 0 0 "[ . 1 . 2]" 1
572 1 53 ASN H 1 53 ASN QB 2.500 . 2.500 2.399 2.225 2.789 0.289 8 0 "[ . 1 . 2]" 1
573 1 53 ASN HA 1 53 ASN HB3 2.800 . 2.800 2.534 2.417 2.719 . 0 0 "[ . 1 . 2]" 1
574 1 53 ASN HA 1 54 TYR H 3.000 . 3.000 2.190 2.144 2.213 . 0 0 "[ . 1 . 2]" 1
575 1 53 ASN HB3 1 54 TYR H 3.900 . 3.900 3.907 3.825 4.399 0.499 8 0 "[ . 1 . 2]" 1
576 1 54 TYR H 1 54 TYR QB 2.500 . 2.500 2.492 2.441 2.530 0.030 7 0 "[ . 1 . 2]" 1
577 1 54 TYR H 1 54 TYR HD1 3.300 . 3.300 3.209 2.606 3.365 0.065 12 0 "[ . 1 . 2]" 1
578 1 54 TYR HA 1 55 SER H 3.600 . 3.600 2.557 2.382 2.717 . 0 0 "[ . 1 . 2]" 1
579 1 54 TYR HB2 1 54 TYR HD1 3.700 . 3.700 2.300 2.287 2.362 . 0 0 "[ . 1 . 2]" 1
580 1 54 TYR HB2 1 55 SER H 4.000 . 4.000 3.273 2.975 3.584 . 0 0 "[ . 1 . 2]" 1
581 1 54 TYR HB2 1 59 LEU H 4.000 . 4.000 4.046 3.836 4.132 0.132 7 0 "[ . 1 . 2]" 1
582 1 54 TYR HB3 1 55 SER H 3.800 . 3.800 2.132 1.931 2.448 . 0 0 "[ . 1 . 2]" 1
583 1 54 TYR HB3 1 59 LEU H 3.800 . 3.800 3.372 3.067 3.756 . 0 0 "[ . 1 . 2]" 1
584 1 54 TYR HB3 1 59 LEU MD1 3.500 . 3.500 3.260 2.894 3.607 0.107 2 0 "[ . 1 . 2]" 1
585 1 54 TYR HD1 1 59 LEU HA 4.400 . 4.400 4.196 3.825 4.385 . 0 0 "[ . 1 . 2]" 1
586 1 54 TYR HD1 1 59 LEU MD1 2.900 . 2.900 2.099 1.914 2.289 . 0 0 "[ . 1 . 2]" 1
587 1 54 TYR HD1 1 62 MET ME 3.700 . 3.700 2.604 2.048 3.054 . 0 0 "[ . 1 . 2]" 1
588 1 54 TYR HE1 1 59 LEU MD1 3.600 . 3.600 3.657 3.500 3.744 0.144 3 0 "[ . 1 . 2]" 1
589 1 54 TYR HE1 1 62 MET ME 3.000 . 3.000 2.314 1.964 2.811 . 0 0 "[ . 1 . 2]" 1
590 1 55 SER H 1 55 SER HB2 3.600 . 3.600 2.384 2.309 2.459 . 0 0 "[ . 1 . 2]" 1
591 1 55 SER H 1 55 SER HB3 3.600 . 3.600 3.620 3.576 3.664 0.064 20 0 "[ . 1 . 2]" 1
592 1 55 SER H 1 58 GLU HB2 4.300 . 4.300 2.573 1.934 3.537 . 0 0 "[ . 1 . 2]" 1
593 1 55 SER H 1 58 GLU HB3 4.200 . 4.200 2.634 1.867 3.285 . 0 0 "[ . 1 . 2]" 1
594 1 55 SER H 1 59 LEU H 3.100 . 3.100 3.314 3.196 3.438 0.338 20 0 "[ . 1 . 2]" 1
595 1 55 SER H 1 59 LEU MD1 4.900 . 4.900 4.745 4.519 4.899 . 0 0 "[ . 1 . 2]" 1
596 1 55 SER HA 1 55 SER HB2 3.000 . 3.000 3.016 3.005 3.027 0.027 9 0 "[ . 1 . 2]" 1
597 1 55 SER HA 1 55 SER HB3 2.600 . 2.600 2.563 2.483 2.605 0.005 17 0 "[ . 1 . 2]" 1
598 1 55 SER HA 1 56 HIS H 3.600 . 3.600 2.469 2.328 2.606 . 0 0 "[ . 1 . 2]" 1
599 1 55 SER HB2 1 58 GLU H 3.600 . 3.600 2.727 2.458 2.892 . 0 0 "[ . 1 . 2]" 1
600 1 55 SER HB3 1 56 HIS H 3.600 . 3.600 2.346 2.064 2.686 . 0 0 "[ . 1 . 2]" 1
601 1 55 SER HB3 1 57 GLU H 3.600 . 3.600 3.424 3.042 3.523 . 0 0 "[ . 1 . 2]" 1
602 1 55 SER HB3 1 58 GLU H 3.600 . 3.600 3.157 2.991 3.442 . 0 0 "[ . 1 . 2]" 1
603 1 56 HIS H 1 56 HIS HB2 3.900 . 3.900 2.546 2.485 2.621 . 0 0 "[ . 1 . 2]" 1
604 1 56 HIS H 1 56 HIS HB3 3.800 . 3.800 2.527 2.444 2.583 . 0 0 "[ . 1 . 2]" 1
605 1 56 HIS HA 1 57 GLU H 3.700 . 3.700 3.569 3.562 3.572 . 0 0 "[ . 1 . 2]" 1
606 1 56 HIS HB2 1 57 GLU H 3.900 . 3.900 3.623 3.568 3.798 . 0 0 "[ . 1 . 2]" 1
607 1 56 HIS HB3 1 57 GLU H 3.800 . 3.800 2.114 2.044 2.404 . 0 0 "[ . 1 . 2]" 1
608 1 56 HIS HD2 1 57 GLU H 3.300 . 3.300 3.343 3.218 3.508 0.208 5 0 "[ . 1 . 2]" 1
609 1 56 HIS HD2 1 57 GLU HA 4.300 . 4.300 3.779 3.250 4.048 . 0 0 "[ . 1 . 2]" 1
610 1 56 HIS HD2 1 105 LYS HA 3.500 . 3.500 2.989 2.376 3.539 0.039 14 0 "[ . 1 . 2]" 1
611 1 56 HIS HE1 1 60 ILE MD 3.600 . 3.600 3.630 3.498 3.693 0.093 11 0 "[ . 1 . 2]" 1
612 1 56 HIS HE1 1 110 ARG HA 4.100 . 4.100 2.625 2.168 3.511 . 0 0 "[ . 1 . 2]" 1
613 1 56 HIS HE1 1 113 HIS HB2 5.200 . 5.200 4.048 3.107 5.014 . 0 0 "[ . 1 . 2]" 1
614 1 57 GLU H 1 57 GLU HB2 4.300 . 4.300 3.067 2.500 3.598 . 0 0 "[ . 1 . 2]" 1
615 1 57 GLU H 1 57 GLU HB3 4.200 . 4.200 3.084 2.472 3.589 . 0 0 "[ . 1 . 2]" 1
616 1 57 GLU H 1 57 GLU HG2 4.100 . 4.100 2.747 1.991 3.374 . 0 0 "[ . 1 . 2]" 1
617 1 57 GLU H 1 57 GLU HG3 4.000 . 4.000 2.672 1.981 3.760 . 0 0 "[ . 1 . 2]" 1
618 1 57 GLU H 1 58 GLU H 3.100 . 3.100 2.694 2.616 2.757 . 0 0 "[ . 1 . 2]" 1
619 1 57 GLU HA 1 58 GLU H 3.800 . 3.800 3.534 3.514 3.548 . 0 0 "[ . 1 . 2]" 1
620 1 57 GLU HA 1 60 ILE HB 4.300 . 4.300 3.023 2.685 4.167 . 0 0 "[ . 1 . 2]" 1
621 1 57 GLU HA 1 60 ILE MG 3.900 . 3.900 3.861 2.051 4.157 0.257 7 0 "[ . 1 . 2]" 1
622 1 57 GLU HA 1 105 LYS HA 4.500 . 4.500 4.036 3.479 4.486 . 0 0 "[ . 1 . 2]" 1
623 1 57 GLU HB2 1 58 GLU H 4.300 . 4.300 3.169 2.506 3.860 . 0 0 "[ . 1 . 2]" 1
624 1 57 GLU HB3 1 57 GLU HG3 3.100 . 3.100 2.972 2.637 3.010 . 0 0 "[ . 1 . 2]" 1
625 1 57 GLU HB3 1 58 GLU H 4.200 . 4.200 3.831 3.630 4.057 . 0 0 "[ . 1 . 2]" 1
626 1 57 GLU HG3 1 58 GLU H 4.000 . 4.000 3.353 1.977 4.249 0.249 19 0 "[ . 1 . 2]" 1
627 1 58 GLU H 1 58 GLU HB2 4.300 . 4.300 2.442 2.211 2.585 . 0 0 "[ . 1 . 2]" 1
628 1 58 GLU H 1 58 GLU HB3 4.200 . 4.200 3.161 2.474 3.586 . 0 0 "[ . 1 . 2]" 1
629 1 58 GLU H 1 59 LEU H 3.100 . 3.100 2.768 2.649 2.815 . 0 0 "[ . 1 . 2]" 1
630 1 58 GLU HA 1 59 LEU H 3.700 . 3.700 3.556 3.548 3.563 . 0 0 "[ . 1 . 2]" 1
631 1 58 GLU HA 1 61 ASP H 3.700 . 3.700 3.741 3.634 3.823 0.123 20 0 "[ . 1 . 2]" 1
632 1 58 GLU HB2 1 59 LEU H 4.300 . 4.300 3.032 2.458 3.826 . 0 0 "[ . 1 . 2]" 1
633 1 58 GLU HB3 1 59 LEU H 4.200 . 4.200 3.008 2.392 3.454 . 0 0 "[ . 1 . 2]" 1
634 1 59 LEU H 1 59 LEU HB2 4.400 . 4.400 2.470 2.366 2.542 . 0 0 "[ . 1 . 2]" 1
635 1 59 LEU H 1 59 LEU HB3 4.200 . 4.200 2.548 2.459 2.661 . 0 0 "[ . 1 . 2]" 1
636 1 59 LEU H 1 59 LEU MD1 4.900 . 4.900 4.024 3.887 4.170 . 0 0 "[ . 1 . 2]" 1
637 1 59 LEU H 1 59 LEU MD2 5.000 . 5.000 4.220 4.185 4.285 . 0 0 "[ . 1 . 2]" 1
638 1 59 LEU H 1 59 LEU HG 4.600 . 4.600 4.463 4.429 4.490 . 0 0 "[ . 1 . 2]" 1
639 1 59 LEU H 1 60 ILE H 3.100 . 3.100 2.713 2.656 2.825 . 0 0 "[ . 1 . 2]" 1
640 1 59 LEU HA 1 59 LEU MD1 2.700 . 2.700 2.500 2.281 2.698 . 0 0 "[ . 1 . 2]" 1
641 1 59 LEU HA 1 59 LEU HG 3.700 . 3.700 2.826 2.714 3.013 . 0 0 "[ . 1 . 2]" 1
642 1 59 LEU HA 1 62 MET ME 3.400 . 3.400 2.599 2.012 3.443 0.043 12 0 "[ . 1 . 2]" 1
643 1 59 LEU HA 1 63 LEU H 3.700 . 3.700 3.702 3.561 3.824 0.124 3 0 "[ . 1 . 2]" 1
644 1 59 LEU HB2 1 59 LEU MD1 2.800 . 2.800 2.107 1.988 2.230 . 0 0 "[ . 1 . 2]" 1
645 1 59 LEU HB3 1 59 LEU MD2 3.100 . 3.100 2.117 1.961 2.277 . 0 0 "[ . 1 . 2]" 1
646 1 59 LEU MD1 1 59 LEU MD2 2.500 . 2.500 1.990 1.903 2.087 . 0 0 "[ . 1 . 2]" 1
647 1 59 LEU MD1 1 62 MET ME 3.500 . 3.500 2.093 1.778 2.554 . 0 0 "[ . 1 . 2]" 1
648 1 59 LEU MD1 1 63 LEU H 4.900 . 4.900 4.480 4.004 4.851 . 0 0 "[ . 1 . 2]" 1
649 1 59 LEU MD1 1 118 THR MG 2.800 . 2.800 2.824 2.716 2.924 0.124 3 0 "[ . 1 . 2]" 1
650 1 59 LEU MD1 1 122 LEU QD 2.500 . 2.500 2.236 1.986 2.502 0.002 4 0 "[ . 1 . 2]" 1
651 1 59 LEU MD2 1 60 ILE MD 4.000 . 4.000 3.299 2.627 4.065 0.065 5 0 "[ . 1 . 2]" 1
652 1 59 LEU MD2 1 121 PHE HB2 4.500 . 4.500 4.574 4.383 4.685 0.185 12 0 "[ . 1 . 2]" 1
653 1 59 LEU MD2 1 122 LEU H 5.000 . 5.000 4.565 4.130 4.950 . 0 0 "[ . 1 . 2]" 1
654 1 59 LEU HG 1 62 MET ME 3.600 . 3.600 3.447 2.646 3.613 0.013 5 0 "[ . 1 . 2]" 1
655 1 60 ILE H 1 60 ILE HG13 4.500 . 4.500 3.687 3.515 4.396 . 0 0 "[ . 1 . 2]" 1
656 1 60 ILE HA 1 60 ILE MD 2.800 . 2.800 2.186 1.936 2.813 0.013 5 0 "[ . 1 . 2]" 1
657 1 60 ILE HA 1 60 ILE HG13 3.900 . 3.900 3.562 2.314 3.753 . 0 0 "[ . 1 . 2]" 1
658 1 60 ILE HA 1 60 ILE MG 3.000 . 3.000 2.483 2.302 3.200 0.200 9 0 "[ . 1 . 2]" 1
659 1 60 ILE HA 1 61 ASP H 3.800 . 3.800 3.571 3.538 3.580 . 0 0 "[ . 1 . 2]" 1
660 1 60 ILE HA 1 63 LEU H 3.800 . 3.800 3.788 3.602 3.933 0.133 6 0 "[ . 1 . 2]" 1
661 1 60 ILE HA 1 63 LEU HB2 3.700 . 3.700 3.671 3.209 3.866 0.166 10 0 "[ . 1 . 2]" 1
662 1 60 ILE HA 1 63 LEU MD2 4.000 . 4.000 3.718 3.228 3.974 . 0 0 "[ . 1 . 2]" 1
663 1 60 ILE HA 1 104 LEU QD 4.300 . 4.300 3.477 3.116 4.226 . 0 0 "[ . 1 . 2]" 1
664 1 60 ILE HB 1 60 ILE MD 3.200 . 3.200 3.117 2.140 3.227 0.027 7 0 "[ . 1 . 2]" 1
665 1 60 ILE MD 1 60 ILE MG 2.700 . 2.700 2.052 1.791 2.913 0.213 9 0 "[ . 1 . 2]" 1
666 1 60 ILE MD 1 104 LEU QB 2.500 . 2.500 1.925 1.832 2.097 . 0 0 "[ . 1 . 2]" 1
667 1 60 ILE MD 1 104 LEU QD . . 2.500 2.024 1.659 2.329 . 0 0 "[ . 1 . 2]" 1
668 1 60 ILE MD 1 105 LYS H 6.000 . 6.000 4.731 4.335 5.226 . 0 0 "[ . 1 . 2]" 1
669 1 60 ILE MD 1 105 LYS HA 3.900 . 3.900 4.353 3.714 5.053 1.153 3 8 "[ +-* *1*** .* 2]" 1
670 1 60 ILE MD 1 121 PHE QE 3.500 . 3.500 2.421 2.204 2.631 . 0 0 "[ . 1 . 2]" 1
671 1 60 ILE MD 1 125 LEU QD 3.500 . 3.500 2.671 1.780 3.108 . 0 0 "[ . 1 . 2]" 1
672 1 60 ILE MG 1 61 ASP H 5.300 . 5.300 2.981 1.917 3.265 . 0 0 "[ . 1 . 2]" 1
673 1 60 ILE MG 1 101 THR HA 3.500 . 3.500 2.214 1.822 3.239 . 0 0 "[ . 1 . 2]" 1
674 1 60 ILE MG 1 104 LEU QD 4.700 . 4.700 1.960 1.754 3.229 . 0 0 "[ . 1 . 2]" 1
675 1 60 ILE MG 1 105 LYS H 5.300 . 5.300 3.921 3.339 4.400 . 0 0 "[ . 1 . 2]" 1
676 1 61 ASP H 1 61 ASP HB2 4.000 . 4.000 2.659 2.357 3.601 . 0 0 "[ . 1 . 2]" 1
677 1 61 ASP H 1 61 ASP HB3 4.000 . 4.000 2.579 2.517 2.719 . 0 0 "[ . 1 . 2]" 1
678 1 61 ASP H 1 62 MET H 3.100 . 3.100 2.663 2.541 2.842 . 0 0 "[ . 1 . 2]" 1
679 1 61 ASP HA 1 64 ILE H 3.600 . 3.600 3.587 3.419 3.774 0.174 12 0 "[ . 1 . 2]" 1
680 1 61 ASP HA 1 64 ILE HB 3.600 . 3.600 3.128 2.803 3.622 0.022 9 0 "[ . 1 . 2]" 1
681 1 61 ASP HA 1 64 ILE MD 3.100 . 3.100 2.419 1.982 3.078 . 0 0 "[ . 1 . 2]" 1
682 1 61 ASP HB2 1 101 THR MG 3.200 . 3.200 3.148 2.595 3.318 0.118 10 0 "[ . 1 . 2]" 1
683 1 62 MET H 1 63 LEU H 3.100 . 3.100 2.681 2.551 2.774 . 0 0 "[ . 1 . 2]" 1
684 1 62 MET HA 1 63 LEU H 3.600 . 3.600 3.536 3.498 3.558 . 0 0 "[ . 1 . 2]" 1
685 1 62 MET HA 1 65 GLY H 3.600 . 3.600 3.552 3.359 3.729 0.129 16 0 "[ . 1 . 2]" 1
686 1 62 MET ME 1 62 MET HG2 2.900 . 2.900 2.760 2.220 3.385 0.485 9 0 "[ . 1 . 2]" 1
687 1 62 MET ME 1 63 LEU H 4.300 . 4.300 3.461 3.272 3.874 . 0 0 "[ . 1 . 2]" 1
688 1 63 LEU H 1 63 LEU HB2 4.200 . 4.200 2.370 2.230 2.558 . 0 0 "[ . 1 . 2]" 1
689 1 63 LEU H 1 63 LEU HG 4.600 . 4.600 4.493 4.433 4.533 . 0 0 "[ . 1 . 2]" 1
690 1 63 LEU H 1 64 ILE H 3.100 . 3.100 2.688 2.590 2.752 . 0 0 "[ . 1 . 2]" 1
691 1 63 LEU HA 1 63 LEU MD1 3.000 . 3.000 2.326 1.957 2.674 . 0 0 "[ . 1 . 2]" 1
692 1 63 LEU HA 1 63 LEU MD2 4.300 . 4.300 3.848 3.754 3.888 . 0 0 "[ . 1 . 2]" 1
693 1 63 LEU HA 1 66 TYR H 3.700 . 3.700 3.363 3.246 3.459 . 0 0 "[ . 1 . 2]" 1
694 1 63 LEU HA 1 66 TYR HB3 4.000 . 4.000 2.836 2.549 3.106 . 0 0 "[ . 1 . 2]" 1
695 1 63 LEU HB2 1 64 ILE H 4.200 . 4.200 3.761 3.648 3.894 . 0 0 "[ . 1 . 2]" 1
696 1 63 LEU HB3 1 64 ILE H 4.700 . 4.700 2.606 2.508 2.705 . 0 0 "[ . 1 . 2]" 1
697 1 63 LEU MD1 1 64 ILE H 5.300 . 5.300 4.747 4.473 4.901 . 0 0 "[ . 1 . 2]" 1
698 1 63 LEU MD1 1 66 TYR H 5.300 . 5.300 4.890 4.419 5.326 0.026 4 0 "[ . 1 . 2]" 1
699 1 63 LEU MD1 1 122 LEU HA 3.000 . 3.000 2.812 2.379 3.102 0.102 14 0 "[ . 1 . 2]" 1
700 1 63 LEU MD2 1 66 TYR HD1 4.600 . 4.600 4.765 4.688 4.905 0.305 14 0 "[ . 1 . 2]" 1
701 1 63 LEU MD2 1 122 LEU HA 2.500 . 2.500 2.362 1.958 2.526 0.026 15 0 "[ . 1 . 2]" 1
702 1 63 LEU MD2 1 125 LEU QB 2.500 . 2.500 1.904 1.717 2.133 . 0 0 "[ . 1 . 2]" 1
703 1 63 LEU MD2 1 125 LEU QD . . 2.500 1.805 1.661 1.922 . 0 0 "[ . 1 . 2]" 1
704 1 63 LEU HG 1 125 LEU QD 4.200 . 4.200 4.036 3.724 4.198 . 0 0 "[ . 1 . 2]" 1
705 1 64 ILE H 1 64 ILE HB 4.300 . 4.300 2.529 2.483 2.556 . 0 0 "[ . 1 . 2]" 1
706 1 64 ILE H 1 65 GLY H 3.200 . 3.200 2.704 2.626 2.787 . 0 0 "[ . 1 . 2]" 1
707 1 64 ILE HA 1 64 ILE MD 4.300 . 4.300 3.856 3.803 3.880 . 0 0 "[ . 1 . 2]" 1
708 1 64 ILE HA 1 64 ILE MG 2.900 . 2.900 2.395 2.319 2.470 . 0 0 "[ . 1 . 2]" 1
709 1 64 ILE HA 1 65 GLY H 3.800 . 3.800 3.541 3.529 3.566 . 0 0 "[ . 1 . 2]" 1
710 1 64 ILE HA 1 66 TYR H 5.800 . 5.800 4.127 3.957 4.266 . 0 0 "[ . 1 . 2]" 1
711 1 64 ILE HA 1 67 LEU MD2 3.800 . 3.800 3.131 2.521 3.802 0.002 14 0 "[ . 1 . 2]" 1
712 1 64 ILE HB 1 64 ILE MD 2.500 . 2.500 2.323 2.250 2.501 0.001 12 0 "[ . 1 . 2]" 1
713 1 64 ILE HB 1 64 ILE MG 2.500 . 2.500 2.108 2.086 2.129 . 0 0 "[ . 1 . 2]" 1
714 1 64 ILE HB 1 65 GLY H 4.300 . 4.300 2.618 2.439 2.685 . 0 0 "[ . 1 . 2]" 1
715 1 64 ILE MD 1 65 GLY H 5.300 . 5.300 4.485 4.351 4.689 . 0 0 "[ . 1 . 2]" 1
716 1 64 ILE MD 1 100 VAL QG 3.000 . 3.000 1.981 1.753 2.499 . 0 0 "[ . 1 . 2]" 1
717 1 64 ILE MD 1 101 THR HB 3.500 . 3.500 4.332 3.759 5.302 1.802 6 14 "[ ** *+*-******. **]" 1
718 1 64 ILE MD 1 101 THR MG 2.500 . 2.500 3.136 1.972 4.266 1.766 6 13 "[* **.+***1* * ** -*2]" 1
719 1 64 ILE MD 1 104 LEU QD 2.900 . 2.900 2.821 2.392 3.015 0.115 15 0 "[ . 1 . 2]" 1
720 1 64 ILE MG 1 65 GLY H 5.100 . 5.100 3.445 3.237 3.539 . 0 0 "[ . 1 . 2]" 1
721 1 64 ILE MG 1 68 ALA MB 3.500 . 3.500 2.901 2.073 3.483 . 0 0 "[ . 1 . 2]" 1
722 1 64 ILE MG 1 100 VAL QG 3.000 . 3.000 3.173 2.208 3.573 0.573 10 2 "[ . + . -2]" 1
723 1 65 GLY H 1 66 TYR H 3.200 . 3.200 2.591 2.503 2.721 . 0 0 "[ . 1 . 2]" 1
724 1 65 GLY H 1 68 ALA MB 4.600 . 4.600 4.261 4.008 4.601 0.001 15 0 "[ . 1 . 2]" 1
725 1 65 GLY HA2 1 66 TYR H 3.700 . 3.700 3.482 3.453 3.513 . 0 0 "[ . 1 . 2]" 1
726 1 65 GLY HA2 1 68 ALA MB 2.900 . 2.900 2.180 1.932 2.882 . 0 0 "[ . 1 . 2]" 1
727 1 66 TYR H 1 66 TYR HB2 3.900 . 3.900 2.630 2.531 2.747 . 0 0 "[ . 1 . 2]" 1
728 1 66 TYR H 1 66 TYR HB3 3.800 . 3.800 2.413 2.315 2.499 . 0 0 "[ . 1 . 2]" 1
729 1 66 TYR H 1 67 LEU H 3.100 . 3.100 2.718 2.599 2.794 . 0 0 "[ . 1 . 2]" 1
730 1 66 TYR H 1 67 LEU MD1 4.900 . 4.900 4.762 3.540 5.022 0.122 4 0 "[ . 1 . 2]" 1
731 1 66 TYR H 1 68 ALA MB 4.600 . 4.600 4.482 4.195 4.749 0.149 9 0 "[ . 1 . 2]" 1
732 1 66 TYR HB2 1 66 TYR HD1 3.600 . 3.600 3.232 3.029 3.403 . 0 0 "[ . 1 . 2]" 1
733 1 66 TYR HD1 1 67 LEU MD2 4.000 . 4.000 3.547 2.040 4.180 0.180 7 0 "[ . 1 . 2]" 1
734 1 66 TYR HD1 1 126 ILE MD 3.700 . 3.700 2.733 2.330 3.141 . 0 0 "[ . 1 . 2]" 1
735 1 66 TYR HD1 1 126 ILE MG 4.100 . 4.100 4.008 3.555 4.169 0.069 9 0 "[ . 1 . 2]" 1
736 1 66 TYR HE1 1 126 ILE MD 3.500 . 3.500 2.642 2.056 3.058 . 0 0 "[ . 1 . 2]" 1
737 1 66 TYR HE1 1 126 ILE MG 4.000 . 4.000 3.495 2.923 3.939 . 0 0 "[ . 1 . 2]" 1
738 1 67 LEU H 1 67 LEU MD2 5.200 . 5.200 2.994 1.876 3.824 . 0 0 "[ . 1 . 2]" 1
739 1 67 LEU H 1 68 ALA H 3.100 . 3.100 2.465 2.154 2.828 . 0 0 "[ . 1 . 2]" 1
740 1 67 LEU HA 1 67 LEU MD2 4.000 . 4.000 3.779 3.216 4.050 0.050 1 0 "[ . 1 . 2]" 1
741 1 67 LEU HA 1 68 ALA H 3.700 . 3.700 3.262 2.955 3.518 . 0 0 "[ . 1 . 2]" 1
742 1 67 LEU MD1 1 68 ALA H 4.900 . 4.900 3.740 2.422 4.513 . 0 0 "[ . 1 . 2]" 1
743 1 68 ALA HA 1 68 ALA MB 2.500 . 2.500 2.110 2.082 2.127 . 0 0 "[ . 1 . 2]" 1
744 1 75 ALA HA 1 75 ALA MB 2.500 . 2.500 2.105 2.082 2.128 . 0 0 "[ . 1 . 2]" 1
745 1 76 LEU HA 1 76 LEU QD 4.000 . 4.000 2.407 1.937 3.048 . 0 0 "[ . 1 . 2]" 1
746 1 77 ILE HA 1 77 ILE MD 3.200 . 3.200 2.579 1.971 3.546 0.346 15 0 "[ . 1 . 2]" 1
747 1 77 ILE HB 1 77 ILE MD 2.800 . 2.800 2.315 2.151 3.205 0.405 5 0 "[ . 1 . 2]" 1
748 1 77 ILE HB 1 77 ILE MG 2.600 . 2.600 2.111 2.080 2.129 . 0 0 "[ . 1 . 2]" 1
749 1 77 ILE MD 1 77 ILE HG13 2.500 . 2.500 2.097 2.071 2.120 . 0 0 "[ . 1 . 2]" 1
750 1 77 ILE HG12 1 77 ILE MG 2.900 . 2.900 2.271 2.016 3.182 0.282 5 0 "[ . 1 . 2]" 1
751 1 77 ILE HG13 1 77 ILE MG 2.700 . 2.700 2.528 2.248 2.729 0.029 7 0 "[ . 1 . 2]" 1
752 1 78 ASN HB2 1 79 GLY H 4.000 . 4.000 3.456 2.631 3.909 . 0 0 "[ . 1 . 2]" 1
753 1 80 LEU H 1 81 VAL QG 5.000 . 5.000 4.280 3.331 5.298 0.298 4 0 "[ . 1 . 2]" 1
754 1 80 LEU HA 1 80 LEU MD1 3.100 . 3.100 2.549 1.955 3.093 . 0 0 "[ . 1 . 2]" 1
755 1 80 LEU HA 1 81 VAL H 3.600 . 3.600 2.656 2.136 3.562 . 0 0 "[ . 1 . 2]" 1
756 1 81 VAL HA 1 81 VAL QG 2.500 . 2.500 2.164 2.064 2.322 . 0 0 "[ . 1 . 2]" 1
757 1 81 VAL HB 1 82 THR H 4.200 . 4.200 4.041 2.536 4.290 0.090 2 0 "[ . 1 . 2]" 1
758 1 81 VAL QG 1 82 THR H 5.000 . 5.000 2.452 1.931 3.216 . 0 0 "[ . 1 . 2]" 1
759 1 82 THR H 1 82 THR HB 2.500 . 2.500 2.505 2.466 2.558 0.058 1 0 "[ . 1 . 2]" 1
760 1 82 THR H 1 82 THR MG 4.700 . 4.700 3.313 2.143 3.826 . 0 0 "[ . 1 . 2]" 1
761 1 82 THR HB 1 82 THR MG 2.500 . 2.500 2.094 2.072 2.119 . 0 0 "[ . 1 . 2]" 1
762 1 84 ASP H 1 84 ASP HB2 4.000 . 4.000 2.641 2.113 3.599 . 0 0 "[ . 1 . 2]" 1
763 1 84 ASP H 1 85 ASP H 3.100 . 3.100 2.644 2.531 2.809 . 0 0 "[ . 1 . 2]" 1
764 1 84 ASP HA 1 84 ASP HB2 2.700 . 2.700 2.597 2.462 3.011 0.311 18 0 "[ . 1 . 2]" 1
765 1 84 ASP HA 1 85 ASP H 3.600 . 3.600 3.511 3.415 3.564 . 0 0 "[ . 1 . 2]" 1
766 1 85 ASP H 1 85 ASP HB2 4.000 . 4.000 2.636 2.275 3.601 . 0 0 "[ . 1 . 2]" 1
767 1 85 ASP H 1 86 LEU H 3.200 . 3.200 2.668 2.277 2.849 . 0 0 "[ . 1 . 2]" 1
768 1 85 ASP HA 1 88 ILE H 3.600 . 3.600 3.436 3.177 3.755 0.155 12 0 "[ . 1 . 2]" 1
769 1 85 ASP HA 1 88 ILE HB 5.000 . 5.000 3.398 2.813 5.134 0.134 12 0 "[ . 1 . 2]" 1
770 1 85 ASP HA 1 88 ILE MD 3.700 . 3.700 3.129 1.862 3.990 0.290 6 0 "[ . 1 . 2]" 1
771 1 85 ASP HA 1 88 ILE MG 4.100 . 4.100 3.912 1.833 4.263 0.163 7 0 "[ . 1 . 2]" 1
772 1 86 LEU HA 1 86 LEU HB3 3.100 . 3.100 2.580 2.497 2.756 . 0 0 "[ . 1 . 2]" 1
773 1 86 LEU HA 1 86 LEU MD2 2.500 . 2.500 1.909 1.858 1.944 . 0 0 "[ . 1 . 2]" 1
774 1 86 LEU HA 1 87 GLU H 3.600 . 3.600 3.529 3.491 3.549 . 0 0 "[ . 1 . 2]" 1
775 1 86 LEU HB2 1 87 GLU H 4.400 . 4.400 2.756 2.606 3.008 . 0 0 "[ . 1 . 2]" 1
776 1 86 LEU HB2 1 90 ASN HD21 4.500 . 4.500 4.490 4.296 4.579 0.079 16 0 "[ . 1 . 2]" 1
777 1 86 LEU HB2 1 90 ASN HD22 4.400 . 4.400 4.163 3.855 4.497 0.097 16 0 "[ . 1 . 2]" 1
778 1 86 LEU MD1 1 90 ASN HD22 5.000 . 5.000 4.427 3.664 5.101 0.101 18 0 "[ . 1 . 2]" 1
779 1 86 LEU MD2 1 89 ALA MB 2.600 . 2.600 2.851 2.724 2.940 0.340 2 0 "[ . 1 . 2]" 1
780 1 86 LEU MD2 1 90 ASN HD21 5.100 . 5.100 4.403 3.025 4.907 . 0 0 "[ . 1 . 2]" 1
781 1 87 GLU H 1 88 ILE H 3.200 . 3.200 2.651 2.587 2.787 . 0 0 "[ . 1 . 2]" 1
782 1 87 GLU HA 1 88 ILE H 3.600 . 3.600 3.517 3.492 3.555 . 0 0 "[ . 1 . 2]" 1
783 1 87 GLU HA 1 90 ASN HD21 3.600 . 3.600 2.686 1.982 3.583 . 0 0 "[ . 1 . 2]" 1
784 1 87 GLU HA 1 90 ASN HD22 3.600 . 3.600 2.968 1.871 3.751 0.151 2 0 "[ . 1 . 2]" 1
785 1 87 GLU HB2 1 88 ILE H 4.200 . 4.200 3.259 2.615 3.888 . 0 0 "[ . 1 . 2]" 1
786 1 88 ILE H 1 88 ILE HB 4.300 . 4.300 2.716 2.416 3.645 . 0 0 "[ . 1 . 2]" 1
787 1 88 ILE H 1 88 ILE MD 5.200 . 5.200 3.339 2.710 4.373 . 0 0 "[ . 1 . 2]" 1
788 1 88 ILE H 1 88 ILE HG13 4.800 . 4.800 2.921 1.891 4.518 . 0 0 "[ . 1 . 2]" 1
789 1 88 ILE H 1 89 ALA H 3.200 . 3.200 2.528 2.341 2.743 . 0 0 "[ . 1 . 2]" 1
790 1 88 ILE HA 1 88 ILE HB 3.100 . 3.100 2.890 2.457 3.025 . 0 0 "[ . 1 . 2]" 1
791 1 88 ILE HA 1 88 ILE HG13 3.900 . 3.900 3.234 2.401 3.774 . 0 0 "[ . 1 . 2]" 1
792 1 88 ILE HA 1 88 ILE MG 2.900 . 2.900 2.444 2.190 3.197 0.297 18 0 "[ . 1 . 2]" 1
793 1 88 ILE HA 1 89 ALA H 3.700 . 3.700 3.520 3.474 3.553 . 0 0 "[ . 1 . 2]" 1
794 1 88 ILE HB 1 88 ILE MG 2.600 . 2.600 2.105 2.082 2.122 . 0 0 "[ . 1 . 2]" 1
795 1 88 ILE HB 1 89 ALA H 4.300 . 4.300 2.906 2.364 4.007 . 0 0 "[ . 1 . 2]" 1
796 1 88 ILE MD 1 88 ILE HG13 2.600 . 2.600 2.095 2.072 2.117 . 0 0 "[ . 1 . 2]" 1
797 1 88 ILE MD 1 92 TYR HD1 3.800 . 3.800 3.544 2.609 4.034 0.234 16 0 "[ . 1 . 2]" 1
798 1 88 ILE MG 1 89 ALA H 5.000 . 5.000 3.481 2.197 4.084 . 0 0 "[ . 1 . 2]" 1
799 1 88 ILE MG 1 92 TYR HD1 3.400 . 3.400 2.512 1.852 3.682 0.282 6 0 "[ . 1 . 2]" 1
800 1 89 ALA HA 1 89 ALA MB 2.500 . 2.500 2.118 2.093 2.130 . 0 0 "[ . 1 . 2]" 1
801 1 89 ALA MB 1 90 ASN H 4.600 . 4.600 2.608 2.227 3.045 . 0 0 "[ . 1 . 2]" 1
802 1 89 ALA MB 1 94 PHE HB3 4.000 . 4.000 3.301 2.083 4.011 0.011 16 0 "[ . 1 . 2]" 1
803 1 89 ALA MB 1 94 PHE HD1 3.900 . 3.900 2.859 1.945 3.974 0.074 18 0 "[ . 1 . 2]" 1
804 1 90 ASN H 1 90 ASN HB2 3.900 . 3.900 2.882 2.282 3.619 . 0 0 "[ . 1 . 2]" 1
805 1 90 ASN HB2 1 90 ASN HD22 3.900 . 3.900 3.606 3.432 3.870 . 0 0 "[ . 1 . 2]" 1
806 1 91 SER HA 1 91 SER HB3 3.000 . 3.000 2.702 2.286 3.028 0.028 1 0 "[ . 1 . 2]" 1
807 1 92 TYR H 1 92 TYR HB2 4.000 . 4.000 2.366 2.161 2.510 . 0 0 "[ . 1 . 2]" 1
808 1 92 TYR H 1 92 TYR HB3 3.900 . 3.900 3.581 3.470 3.667 . 0 0 "[ . 1 . 2]" 1
809 1 94 PHE HA 1 94 PHE HD1 3.400 . 3.400 3.042 2.261 3.828 0.428 17 0 "[ . 1 . 2]" 1
810 1 95 LYS HA 1 96 GLY H 3.700 . 3.700 2.839 2.158 3.567 . 0 0 "[ . 1 . 2]" 1
811 1 95 LYS HG2 1 96 GLY H 4.600 . 4.600 3.986 2.537 4.819 0.219 11 0 "[ . 1 . 2]" 1
812 1 99 ALA HA 1 99 ALA MB 2.500 . 2.500 2.103 2.084 2.126 . 0 0 "[ . 1 . 2]" 1
813 1 100 VAL HA 1 100 VAL QG . . 2.900 2.198 2.031 2.329 . 0 0 "[ . 1 . 2]" 1
814 1 100 VAL HA 1 103 LEU H 3.700 . 3.700 3.625 3.300 3.806 0.106 16 0 "[ . 1 . 2]" 1
815 1 100 VAL HA 1 103 LEU QD 4.200 . 4.200 2.201 1.794 3.449 . 0 0 "[ . 1 . 2]" 1
816 1 100 VAL HA 1 104 LEU QD 4.000 . 4.000 3.779 3.438 3.965 . 0 0 "[ . 1 . 2]" 1
817 1 100 VAL HB 1 103 LEU QD 3.800 . 3.800 3.461 2.826 3.913 0.113 3 0 "[ . 1 . 2]" 1
818 1 100 VAL QG 1 104 LEU QD . . 3.000 2.712 1.775 3.259 0.259 2 0 "[ . 1 . 2]" 1
819 1 100 VAL QG 1 125 LEU QD 4.100 . 4.100 4.257 2.980 4.876 0.776 2 4 "[ + . * -1 * . 2]" 1
820 1 101 THR H 1 101 THR HB 3.700 . 3.700 2.804 2.469 3.593 . 0 0 "[ . 1 . 2]" 1
821 1 101 THR H 1 101 THR MG 4.800 . 4.800 3.422 2.307 3.758 . 0 0 "[ . 1 . 2]" 1
822 1 101 THR HA 1 101 THR HB 3.100 . 3.100 2.896 2.433 3.027 . 0 0 "[ . 1 . 2]" 1
823 1 101 THR HA 1 101 THR MG 2.800 . 2.800 2.360 2.230 2.486 . 0 0 "[ . 1 . 2]" 1
824 1 101 THR HA 1 102 ASN H 3.800 . 3.800 3.529 3.482 3.571 . 0 0 "[ . 1 . 2]" 1
825 1 101 THR HA 1 104 LEU H 3.800 . 3.800 3.549 3.361 3.846 0.046 14 0 "[ . 1 . 2]" 1
826 1 101 THR HA 1 104 LEU QD 3.800 . 3.800 2.657 2.048 3.013 . 0 0 "[ . 1 . 2]" 1
827 1 101 THR HB 1 101 THR MG 2.500 . 2.500 2.086 2.069 2.119 . 0 0 "[ . 1 . 2]" 1
828 1 101 THR HB 1 102 ASN H 3.700 . 3.700 2.899 2.389 3.750 0.050 12 0 "[ . 1 . 2]" 1
829 1 101 THR MG 1 102 ASN H 4.800 . 4.800 3.718 3.456 4.141 . 0 0 "[ . 1 . 2]" 1
830 1 102 ASN H 1 102 ASN HB2 4.100 . 4.100 2.522 2.070 3.608 . 0 0 "[ . 1 . 2]" 1
831 1 102 ASN H 1 102 ASN HB3 4.000 . 4.000 3.022 2.467 3.581 . 0 0 "[ . 1 . 2]" 1
832 1 102 ASN H 1 103 LEU H 3.200 . 3.200 2.761 2.564 2.858 . 0 0 "[ . 1 . 2]" 1
833 1 102 ASN HA 1 103 LEU H 3.600 . 3.600 3.559 3.520 3.575 . 0 0 "[ . 1 . 2]" 1
834 1 102 ASN HA 1 105 LYS H 3.600 . 3.600 3.577 3.441 3.687 0.087 20 0 "[ . 1 . 2]" 1
835 1 102 ASN HB2 1 103 LEU H 4.100 . 4.100 3.223 2.423 3.843 . 0 0 "[ . 1 . 2]" 1
836 1 102 ASN HB3 1 103 LEU H 4.000 . 4.000 2.975 2.302 3.921 . 0 0 "[ . 1 . 2]" 1
837 1 103 LEU H 1 103 LEU HB2 4.200 . 4.200 3.265 2.503 3.611 . 0 0 "[ . 1 . 2]" 1
838 1 103 LEU H 1 103 LEU QD . . 4.900 2.802 1.829 3.563 . 0 0 "[ . 1 . 2]" 1
839 1 103 LEU H 1 103 LEU HG 4.500 . 4.500 2.669 1.702 4.612 0.112 19 0 "[ . 1 . 2]" 1
840 1 103 LEU H 1 104 LEU H 3.100 . 3.100 2.606 2.520 2.774 . 0 0 "[ . 1 . 2]" 1
841 1 103 LEU HA 1 104 LEU H 3.700 . 3.700 3.520 3.489 3.556 . 0 0 "[ . 1 . 2]" 1
842 1 103 LEU HA 1 106 SER H 3.700 . 3.700 3.646 3.446 3.805 0.105 17 0 "[ . 1 . 2]" 1
843 1 103 LEU QD 1 104 LEU H . . 4.900 2.652 2.306 3.425 . 0 0 "[ . 1 . 2]" 1
844 1 103 LEU QD 1 106 SER H 4.900 . 4.900 4.634 3.646 5.369 0.469 1 0 "[ . 1 . 2]" 1
845 1 104 LEU H 1 104 LEU HB3 4.300 . 4.300 3.562 3.505 3.575 . 0 0 "[ . 1 . 2]" 1
846 1 104 LEU H 1 104 LEU HG 4.500 . 4.500 2.542 2.232 3.018 . 0 0 "[ . 1 . 2]" 1
847 1 104 LEU H 1 105 LYS H 3.100 . 3.100 2.554 2.526 2.625 . 0 0 "[ . 1 . 2]" 1
848 1 104 LEU HA 1 104 LEU QD 3.000 . 3.000 2.129 1.901 2.473 . 0 0 "[ . 1 . 2]" 1
849 1 104 LEU HA 1 104 LEU HG 3.800 . 3.800 2.832 2.426 3.005 . 0 0 "[ . 1 . 2]" 1
850 1 104 LEU HA 1 105 LYS H 3.700 . 3.700 3.490 3.457 3.528 . 0 0 "[ . 1 . 2]" 1
851 1 104 LEU HA 1 106 SER H 3.700 . 3.700 3.690 3.520 3.840 0.140 9 0 "[ . 1 . 2]" 1
852 1 104 LEU HB3 1 105 LYS H 4.300 . 4.300 3.721 3.492 3.836 . 0 0 "[ . 1 . 2]" 1
853 1 104 LEU MD1 1 104 LEU MD2 2.800 . 2.800 2.039 1.918 2.089 . 0 0 "[ . 1 . 2]" 1
854 1 104 LEU QD 1 109 PHE HD1 3.900 . 3.900 3.295 2.146 3.825 . 0 0 "[ . 1 . 2]" 1
855 1 104 LEU QD 1 109 PHE HE1 4.300 . 4.300 2.772 1.868 3.273 . 0 0 "[ . 1 . 2]" 1
856 1 104 LEU QD 1 109 PHE HZ 3.900 . 3.900 2.801 2.282 3.853 . 0 0 "[ . 1 . 2]" 1
857 1 104 LEU QD 1 125 LEU QD 2.500 . 2.500 1.821 1.595 2.147 . 0 0 "[ . 1 . 2]" 1
858 1 104 LEU QD 1 138 TRP HZ3 4.200 . 4.200 2.608 1.789 4.279 0.079 15 0 "[ . 1 . 2]" 1
859 1 105 LYS H 1 105 LYS HB3 4.200 . 4.200 3.059 2.401 3.602 . 0 0 "[ . 1 . 2]" 1
860 1 105 LYS H 1 106 SER H 3.200 . 3.200 2.578 2.462 2.643 . 0 0 "[ . 1 . 2]" 1
861 1 105 LYS HA 1 106 SER H 3.700 . 3.700 3.344 3.171 3.430 . 0 0 "[ . 1 . 2]" 1
862 1 105 LYS HB2 1 106 SER H 4.300 . 4.300 3.877 3.247 4.422 0.122 18 0 "[ . 1 . 2]" 1
863 1 106 SER H 1 106 SER HB2 3.600 . 3.600 3.232 2.566 3.597 . 0 0 "[ . 1 . 2]" 1
864 1 106 SER H 1 109 PHE HB2 3.800 . 3.800 3.631 2.821 3.907 0.107 13 0 "[ . 1 . 2]" 1
865 1 106 SER HA 1 107 PRO HD2 2.900 . 2.900 2.719 2.603 2.853 . 0 0 "[ . 1 . 2]" 1
866 1 106 SER HB2 1 107 PRO HD2 3.600 . 3.600 3.083 2.306 3.825 0.225 15 0 "[ . 1 . 2]" 1
867 1 106 SER HB3 1 107 PRO HD2 4.000 . 4.000 3.539 2.486 4.061 0.061 17 0 "[ . 1 . 2]" 1
868 1 107 PRO HA 1 107 PRO HG2 3.900 . 3.900 3.928 3.895 3.958 0.058 15 0 "[ . 1 . 2]" 1
869 1 107 PRO HA 1 110 ARG H 3.700 . 3.700 3.453 3.295 3.622 . 0 0 "[ . 1 . 2]" 1
870 1 107 PRO HB2 1 107 PRO HD2 3.500 . 3.500 2.963 2.947 2.982 . 0 0 "[ . 1 . 2]" 1
871 1 108 GLU H 1 108 GLU HB2 4.300 . 4.300 2.573 2.229 3.599 . 0 0 "[ . 1 . 2]" 1
872 1 108 GLU H 1 109 PHE H 3.100 . 3.100 2.692 2.542 2.759 . 0 0 "[ . 1 . 2]" 1
873 1 108 GLU HA 1 111 LEU H 3.800 . 3.800 3.751 3.524 3.894 0.094 1 0 "[ . 1 . 2]" 1
874 1 108 GLU HA 1 111 LEU QD 3.500 . 3.500 3.108 2.812 3.470 . 0 0 "[ . 1 . 2]" 1
875 1 108 GLU HB2 1 109 PHE H 4.300 . 4.300 2.984 2.657 3.949 . 0 0 "[ . 1 . 2]" 1
876 1 109 PHE H 1 109 PHE HB2 3.800 . 3.800 2.204 2.129 2.345 . 0 0 "[ . 1 . 2]" 1
877 1 109 PHE H 1 110 ARG H 3.200 . 3.200 2.582 2.488 2.669 . 0 0 "[ . 1 . 2]" 1
878 1 109 PHE H 1 112 VAL MG2 5.200 . 5.200 4.281 4.105 4.434 . 0 0 "[ . 1 . 2]" 1
879 1 109 PHE HA 1 109 PHE HD1 3.600 . 3.600 3.241 2.577 3.673 0.073 14 0 "[ . 1 . 2]" 1
880 1 109 PHE HA 1 110 ARG H 3.600 . 3.600 3.473 3.460 3.495 . 0 0 "[ . 1 . 2]" 1
881 1 109 PHE HA 1 112 VAL H 3.600 . 3.600 3.261 3.174 3.375 . 0 0 "[ . 1 . 2]" 1
882 1 109 PHE HB2 1 109 PHE HD1 3.700 . 3.700 3.135 2.290 3.733 0.033 18 0 "[ . 1 . 2]" 1
883 1 109 PHE HB2 1 110 ARG H 3.800 . 3.800 3.514 3.060 3.890 0.090 3 0 "[ . 1 . 2]" 1
884 1 109 PHE HE1 1 112 VAL MG1 5.400 2.500 5.400 4.571 3.240 5.485 0.085 1 0 "[ . 1 . 2]" 1
885 1 110 ARG H 1 110 ARG HB3 4.400 . 4.400 3.037 2.300 3.591 . 0 0 "[ . 1 . 2]" 1
886 1 110 ARG H 1 111 LEU H 3.200 . 3.200 2.721 2.689 2.778 . 0 0 "[ . 1 . 2]" 1
887 1 110 ARG H 1 112 VAL MG2 5.200 . 5.200 4.507 4.274 4.680 . 0 0 "[ . 1 . 2]" 1
888 1 110 ARG HA 1 111 LEU H 4.000 . 4.000 3.536 3.527 3.558 . 0 0 "[ . 1 . 2]" 1
889 1 110 ARG HA 1 113 HIS H 4.000 . 4.000 3.814 3.553 3.957 . 0 0 "[ . 1 . 2]" 1
890 1 110 ARG HB2 1 111 LEU H 4.500 . 4.500 3.305 2.555 3.962 . 0 0 "[ . 1 . 2]" 1
891 1 110 ARG HB3 1 111 LEU H 4.400 . 4.400 3.083 2.470 3.737 . 0 0 "[ . 1 . 2]" 1
892 1 111 LEU H 1 111 LEU HG 4.600 . 4.600 2.809 2.217 3.966 . 0 0 "[ . 1 . 2]" 1
893 1 111 LEU HA 1 111 LEU QD 2.700 . 2.700 2.167 1.896 2.754 0.054 19 0 "[ . 1 . 2]" 1
894 1 111 LEU HA 1 114 THR H 3.700 . 3.700 3.426 3.292 3.583 . 0 0 "[ . 1 . 2]" 1
895 1 111 LEU HA 1 114 THR HB 3.000 . 3.000 2.517 2.387 2.636 . 0 0 "[ . 1 . 2]" 1
896 1 111 LEU HA 1 114 THR MG 3.500 . 3.500 3.736 3.639 3.836 0.336 16 0 "[ . 1 . 2]" 1
897 1 111 LEU HB3 1 111 LEU QD 2.500 . 2.500 2.120 2.043 2.296 . 0 0 "[ . 1 . 2]" 1
898 1 111 LEU HB3 1 112 VAL H 4.500 . 4.500 3.535 3.259 3.734 . 0 0 "[ . 1 . 2]" 1
899 1 111 LEU QD 1 114 THR H 5.300 . 5.300 4.824 4.479 5.157 . 0 0 "[ . 1 . 2]" 1
900 1 111 LEU QD 1 115 ILE H 5.300 . 5.300 4.897 4.323 5.311 0.011 9 0 "[ . 1 . 2]" 1
901 1 112 VAL H 1 112 VAL HB 4.100 . 4.100 2.621 2.551 2.678 . 0 0 "[ . 1 . 2]" 1
902 1 112 VAL H 1 113 HIS H 3.200 . 3.200 2.914 2.749 3.023 . 0 0 "[ . 1 . 2]" 1
903 1 112 VAL HA 1 112 VAL MG1 2.900 . 2.900 2.352 2.235 2.427 . 0 0 "[ . 1 . 2]" 1
904 1 112 VAL HA 1 112 VAL MG2 2.900 . 2.900 2.367 2.285 2.449 . 0 0 "[ . 1 . 2]" 1
905 1 112 VAL HA 1 113 HIS H 3.900 . 3.900 3.566 3.552 3.575 . 0 0 "[ . 1 . 2]" 1
906 1 112 VAL HA 1 115 ILE H 3.900 . 3.900 3.412 3.291 3.525 . 0 0 "[ . 1 . 2]" 1
907 1 112 VAL HA 1 115 ILE HB 3.600 . 3.600 2.770 2.546 2.955 . 0 0 "[ . 1 . 2]" 1
908 1 112 VAL HA 1 115 ILE MD 3.100 . 3.100 2.718 2.488 3.001 . 0 0 "[ . 1 . 2]" 1
909 1 112 VAL HA 1 115 ILE HG13 4.100 . 4.100 3.830 3.609 4.018 . 0 0 "[ . 1 . 2]" 1
910 1 112 VAL HA 1 116 ILE H 3.900 . 3.900 3.631 3.509 3.808 . 0 0 "[ . 1 . 2]" 1
911 1 112 VAL HB 1 113 HIS H 4.100 . 4.100 2.278 2.117 2.468 . 0 0 "[ . 1 . 2]" 1
912 1 112 VAL MG1 1 112 VAL MG2 2.500 . 2.500 2.018 1.890 2.094 . 0 0 "[ . 1 . 2]" 1
913 1 112 VAL MG1 1 113 HIS H 4.900 . 4.900 3.255 3.107 3.471 . 0 0 "[ . 1 . 2]" 1
914 1 112 VAL MG1 1 121 PHE HD1 3.400 . 3.400 3.123 2.563 3.427 0.027 5 0 "[ . 1 . 2]" 1
915 1 112 VAL MG2 1 113 HIS H 5.200 . 5.200 3.669 3.582 3.772 . 0 0 "[ . 1 . 2]" 1
916 1 113 HIS H 1 113 HIS HB2 3.900 . 3.900 2.453 2.303 2.540 . 0 0 "[ . 1 . 2]" 1
917 1 113 HIS H 1 114 THR H 3.200 . 3.200 2.753 2.671 2.845 . 0 0 "[ . 1 . 2]" 1
918 1 113 HIS H 1 121 PHE HD1 3.300 . 3.300 3.371 3.217 3.459 0.159 5 0 "[ . 1 . 2]" 1
919 1 113 HIS HA 1 114 THR H 3.700 . 3.700 3.525 3.509 3.543 . 0 0 "[ . 1 . 2]" 1
920 1 113 HIS HA 1 116 ILE H 3.700 . 3.700 3.788 3.724 3.823 0.123 15 0 "[ . 1 . 2]" 1
921 1 113 HIS HA 1 116 ILE MD 3.900 . 3.900 2.930 2.786 3.115 . 0 0 "[ . 1 . 2]" 1
922 1 113 HIS HA 1 117 GLY H 3.700 . 3.700 3.361 3.233 3.440 . 0 0 "[ . 1 . 2]" 1
923 1 113 HIS HB2 1 114 THR H 3.900 . 3.900 3.850 3.732 3.928 0.028 12 0 "[ . 1 . 2]" 1
924 1 113 HIS HD2 1 117 GLY H 3.300 . 3.300 3.354 3.251 3.442 0.142 19 0 "[ . 1 . 2]" 1
925 1 113 HIS HD2 1 118 THR H 3.300 . 3.300 3.329 3.127 3.431 0.131 18 0 "[ . 1 . 2]" 1
926 1 114 THR H 1 114 THR HB 3.600 . 3.600 2.400 2.354 2.460 . 0 0 "[ . 1 . 2]" 1
927 1 114 THR H 1 115 ILE HG13 4.600 . 4.600 4.289 4.207 4.378 . 0 0 "[ . 1 . 2]" 1
928 1 114 THR HA 1 114 THR MG 2.600 . 2.600 2.550 2.526 2.579 . 0 0 "[ . 1 . 2]" 1
929 1 114 THR HA 1 115 ILE H 3.800 . 3.800 3.533 3.527 3.543 . 0 0 "[ . 1 . 2]" 1
930 1 114 THR HB 1 114 THR MG 2.600 . 2.600 2.109 2.084 2.116 . 0 0 "[ . 1 . 2]" 1
931 1 114 THR MG 1 115 ILE H 5.000 . 5.000 3.392 3.324 3.470 . 0 0 "[ . 1 . 2]" 1
932 1 115 ILE H 1 115 ILE HG13 4.600 . 4.600 2.219 2.154 2.264 . 0 0 "[ . 1 . 2]" 1
933 1 115 ILE HA 1 115 ILE MD 4.000 . 4.000 3.851 3.834 3.878 . 0 0 "[ . 1 . 2]" 1
934 1 115 ILE HA 1 115 ILE HG12 3.900 . 3.900 2.602 2.555 2.692 . 0 0 "[ . 1 . 2]" 1
935 1 115 ILE HA 1 115 ILE HG13 3.800 . 3.800 2.869 2.774 2.914 . 0 0 "[ . 1 . 2]" 1
936 1 115 ILE HA 1 115 ILE MG 3.100 . 3.100 2.356 2.307 2.468 . 0 0 "[ . 1 . 2]" 1
937 1 115 ILE HA 1 116 ILE H 4.000 . 4.000 3.574 3.565 3.577 . 0 0 "[ . 1 . 2]" 1
938 1 115 ILE HB 1 115 ILE MD 2.600 . 2.600 2.343 2.205 2.426 . 0 0 "[ . 1 . 2]" 1
939 1 115 ILE HB 1 116 ILE H 4.500 . 4.500 2.424 2.372 2.476 . 0 0 "[ . 1 . 2]" 1
940 1 115 ILE HB 1 117 GLY H 4.500 . 4.500 4.627 4.589 4.663 0.163 19 0 "[ . 1 . 2]" 1
941 1 115 ILE MD 1 115 ILE HG13 2.600 . 2.600 2.115 2.101 2.119 . 0 0 "[ . 1 . 2]" 1
942 1 115 ILE MD 1 115 ILE MG 2.600 . 2.600 2.041 1.854 2.237 . 0 0 "[ . 1 . 2]" 1
943 1 115 ILE HG12 1 115 ILE MG 3.300 . 3.300 2.290 2.155 2.373 . 0 0 "[ . 1 . 2]" 1
944 1 115 ILE HG13 1 115 ILE MG 3.200 . 3.200 3.182 3.166 3.195 . 0 0 "[ . 1 . 2]" 1
945 1 115 ILE HG13 1 116 ILE H 4.600 . 4.600 4.241 4.198 4.288 . 0 0 "[ . 1 . 2]" 1
946 1 115 ILE MG 1 116 ILE H 5.400 . 5.400 3.268 3.194 3.347 . 0 0 "[ . 1 . 2]" 1
947 1 115 ILE MG 1 116 ILE HA 3.600 . 3.600 3.455 3.329 3.532 . 0 0 "[ . 1 . 2]" 1
948 1 116 ILE H 1 116 ILE HB 4.200 . 4.200 3.649 3.643 3.655 . 0 0 "[ . 1 . 2]" 1
949 1 116 ILE H 1 116 ILE MD 4.900 . 4.900 3.714 3.548 3.800 . 0 0 "[ . 1 . 2]" 1
950 1 116 ILE H 1 116 ILE HG13 4.300 . 4.300 3.377 3.108 3.556 . 0 0 "[ . 1 . 2]" 1
951 1 116 ILE H 1 117 GLY H 3.200 . 3.200 2.431 2.417 2.461 . 0 0 "[ . 1 . 2]" 1
952 1 116 ILE HA 1 116 ILE HG12 4.200 . 4.200 3.771 3.704 3.819 . 0 0 "[ . 1 . 2]" 1
953 1 116 ILE HA 1 116 ILE HG13 4.200 . 4.200 3.668 3.640 3.716 . 0 0 "[ . 1 . 2]" 1
954 1 116 ILE HA 1 116 ILE MG 2.900 . 2.900 2.391 2.296 2.509 . 0 0 "[ . 1 . 2]" 1
955 1 116 ILE HA 1 117 GLY H 3.500 . 3.500 3.449 3.420 3.456 . 0 0 "[ . 1 . 2]" 1
956 1 116 ILE HA 1 120 THR MG 3.700 . 3.700 3.623 3.359 3.745 0.045 12 0 "[ . 1 . 2]" 1
957 1 116 ILE HB 1 116 ILE MD 3.100 . 3.100 2.481 2.409 2.573 . 0 0 "[ . 1 . 2]" 1
958 1 116 ILE HB 1 117 GLY H 4.200 . 4.200 4.128 4.064 4.187 . 0 0 "[ . 1 . 2]" 1
959 1 116 ILE HB 1 120 THR MG 2.900 . 2.900 1.891 1.837 1.978 . 0 0 "[ . 1 . 2]" 1
960 1 116 ILE MD 1 116 ILE MG 2.500 . 2.500 1.905 1.662 2.042 . 0 0 "[ . 1 . 2]" 1
961 1 116 ILE MD 1 117 GLY H 4.900 . 4.900 4.171 4.131 4.277 . 0 0 "[ . 1 . 2]" 1
962 1 116 ILE MD 1 120 THR MG 2.600 . 2.600 2.406 2.094 2.652 0.052 16 0 "[ . 1 . 2]" 1
963 1 116 ILE MD 1 121 PHE H 4.900 . 4.900 2.932 2.716 3.220 . 0 0 "[ . 1 . 2]" 1
964 1 116 ILE MD 1 121 PHE HA 3.000 . 3.000 1.803 1.764 1.877 . 0 0 "[ . 1 . 2]" 1
965 1 116 ILE MD 1 121 PHE HB2 3.900 . 3.900 2.636 2.388 2.821 . 0 0 "[ . 1 . 2]" 1
966 1 116 ILE MD 1 121 PHE HB3 3.700 . 3.700 3.795 3.648 3.920 0.220 15 0 "[ . 1 . 2]" 1
967 1 116 ILE MD 1 121 PHE HD1 3.200 . 3.200 2.360 2.136 2.678 . 0 0 "[ . 1 . 2]" 1
968 1 116 ILE MD 1 124 LEU QD 4.300 . 4.300 2.387 2.007 2.665 . 0 0 "[ . 1 . 2]" 1
969 1 116 ILE HG12 1 117 GLY H 4.300 . 4.300 2.799 2.574 3.026 . 0 0 "[ . 1 . 2]" 1
970 1 116 ILE HG13 1 117 GLY H 4.300 . 4.300 2.828 2.613 3.037 . 0 0 "[ . 1 . 2]" 1
971 1 116 ILE HG13 1 121 PHE H 4.200 . 4.200 2.654 2.402 2.977 . 0 0 "[ . 1 . 2]" 1
972 1 116 ILE MG 1 117 GLY H 5.200 . 5.200 3.914 3.830 4.021 . 0 0 "[ . 1 . 2]" 1
973 1 116 ILE MG 1 121 PHE H 5.200 . 5.200 5.156 5.016 5.267 0.067 12 0 "[ . 1 . 2]" 1
974 1 117 GLY HA2 1 118 THR H 3.700 . 3.700 2.447 2.382 2.510 . 0 0 "[ . 1 . 2]" 1
975 1 118 THR H 1 118 THR MG 4.600 . 4.600 3.748 3.744 3.754 . 0 0 "[ . 1 . 2]" 1
976 1 118 THR H 1 119 GLU H 3.100 . 3.100 2.758 2.683 2.865 . 0 0 "[ . 1 . 2]" 1
977 1 118 THR HA 1 118 THR MG 3.100 . 3.100 2.428 2.366 2.499 . 0 0 "[ . 1 . 2]" 1
978 1 118 THR HA 1 119 GLU H 3.600 . 3.600 3.565 3.552 3.575 . 0 0 "[ . 1 . 2]" 1
979 1 118 THR HA 1 121 PHE H 3.600 . 3.600 3.357 3.201 3.476 . 0 0 "[ . 1 . 2]" 1
980 1 118 THR HA 1 121 PHE HB2 3.800 . 3.800 3.123 2.771 3.409 . 0 0 "[ . 1 . 2]" 1
981 1 118 THR HA 1 122 LEU H 3.600 . 3.600 3.709 3.624 3.828 0.228 7 0 "[ . 1 . 2]" 1
982 1 118 THR HB 1 118 THR MG 2.500 . 2.500 2.112 2.088 2.119 . 0 0 "[ . 1 . 2]" 1
983 1 118 THR HB 1 119 GLU H 3.700 . 3.700 2.436 2.305 2.597 . 0 0 "[ . 1 . 2]" 1
984 1 118 THR MG 1 119 GLU H 4.600 . 4.600 3.316 3.191 3.432 . 0 0 "[ . 1 . 2]" 1
985 1 118 THR MG 1 119 GLU HA 3.400 . 3.400 3.433 3.392 3.476 0.076 6 0 "[ . 1 . 2]" 1
986 1 118 THR MG 1 122 LEU H 4.600 . 4.600 3.792 3.572 3.958 . 0 0 "[ . 1 . 2]" 1
987 1 118 THR MG 1 122 LEU QD 2.500 . 2.500 1.777 1.682 2.154 . 0 0 "[ . 1 . 2]" 1
988 1 119 GLU H 1 119 GLU HB2 4.200 . 4.200 3.541 2.596 3.606 . 0 0 "[ . 1 . 2]" 1
989 1 119 GLU H 1 119 GLU HG2 4.100 . 4.100 3.323 2.280 4.398 0.298 12 0 "[ . 1 . 2]" 1
990 1 119 GLU H 1 120 THR H 3.100 . 3.100 2.868 2.743 3.070 . 0 0 "[ . 1 . 2]" 1
991 1 119 GLU H 1 122 LEU MD2 5.400 . 5.400 5.582 5.424 5.718 0.318 4 0 "[ . 1 . 2]" 1
992 1 119 GLU HA 1 119 GLU HB2 2.600 . 2.600 2.404 2.367 2.465 . 0 0 "[ . 1 . 2]" 1
993 1 119 GLU HA 1 119 GLU HG2 4.100 . 4.100 3.728 3.158 4.217 0.117 20 0 "[ . 1 . 2]" 1
994 1 119 GLU HA 1 120 THR H 3.700 . 3.700 3.555 3.536 3.580 . 0 0 "[ . 1 . 2]" 1
995 1 119 GLU HA 1 121 PHE H 5.700 . 5.700 4.502 4.344 4.600 . 0 0 "[ . 1 . 2]" 1
996 1 119 GLU HA 1 122 LEU QD 3.400 . 3.400 2.560 1.937 3.401 0.001 10 0 "[ . 1 . 2]" 1
997 1 119 GLU HB2 1 120 THR H 4.200 . 4.200 3.751 3.577 3.863 . 0 0 "[ . 1 . 2]" 1
998 1 119 GLU HG2 1 120 THR H 4.100 . 4.100 2.313 1.859 3.613 . 0 0 "[ . 1 . 2]" 1
999 1 120 THR H 1 120 THR MG 4.600 . 4.600 3.763 3.736 3.785 . 0 0 "[ . 1 . 2]" 1
1000 1 120 THR H 1 121 PHE H 3.100 . 3.100 2.453 2.315 2.574 . 0 0 "[ . 1 . 2]" 1
1001 1 120 THR HA 1 120 THR MG 2.500 . 2.500 2.234 2.169 2.411 . 0 0 "[ . 1 . 2]" 1
1002 1 120 THR HA 1 121 PHE H 3.700 . 3.700 3.511 3.492 3.530 . 0 0 "[ . 1 . 2]" 1
1003 1 120 THR HA 1 123 ASP H 3.700 . 3.700 3.329 3.122 3.446 . 0 0 "[ . 1 . 2]" 1
1004 1 120 THR HA 1 123 ASP HB2 3.600 . 3.600 3.200 2.706 3.673 0.073 4 0 "[ . 1 . 2]" 1
1005 1 120 THR HA 1 123 ASP HB3 3.600 . 3.600 2.372 2.004 2.663 . 0 0 "[ . 1 . 2]" 1
1006 1 120 THR HA 1 124 LEU H 3.700 . 3.700 3.721 3.625 3.813 0.113 20 0 "[ . 1 . 2]" 1
1007 1 120 THR MG 1 121 PHE H 4.600 . 4.600 3.852 3.654 3.962 . 0 0 "[ . 1 . 2]" 1
1008 1 120 THR MG 1 123 ASP HB3 3.700 . 3.700 3.283 2.855 3.461 . 0 0 "[ . 1 . 2]" 1
1009 1 120 THR MG 1 124 LEU H 4.600 . 4.600 3.797 3.642 3.904 . 0 0 "[ . 1 . 2]" 1
1010 1 121 PHE H 1 121 PHE HB2 3.900 . 3.900 2.515 2.470 2.562 . 0 0 "[ . 1 . 2]" 1
1011 1 121 PHE H 1 121 PHE HB3 3.800 . 3.800 2.538 2.501 2.569 . 0 0 "[ . 1 . 2]" 1
1012 1 121 PHE H 1 122 LEU H 3.100 . 3.100 2.730 2.642 2.787 . 0 0 "[ . 1 . 2]" 1
1013 1 121 PHE HA 1 122 LEU H 3.600 . 3.600 3.547 3.522 3.567 . 0 0 "[ . 1 . 2]" 1
1014 1 121 PHE HA 1 124 LEU H 3.600 . 3.600 3.596 3.438 3.712 0.112 9 0 "[ . 1 . 2]" 1
1015 1 121 PHE HB2 1 122 LEU H 3.900 . 3.900 3.810 3.759 3.880 . 0 0 "[ . 1 . 2]" 1
1016 1 121 PHE HB3 1 122 LEU H 3.800 . 3.800 2.479 2.386 2.585 . 0 0 "[ . 1 . 2]" 1
1017 1 121 PHE HE1 1 125 LEU QD 3.600 . 3.600 3.584 3.355 3.695 0.095 19 0 "[ . 1 . 2]" 1
1018 1 122 LEU H 1 122 LEU HB2 4.300 . 4.300 2.524 2.040 2.827 . 0 0 "[ . 1 . 2]" 1
1019 1 122 LEU H 1 122 LEU HB3 4.200 . 4.200 3.541 3.187 3.596 . 0 0 "[ . 1 . 2]" 1
1020 1 122 LEU H 1 122 LEU MD1 5.200 . 5.200 2.671 1.974 3.137 . 0 0 "[ . 1 . 2]" 1
1021 1 122 LEU H 1 122 LEU MD2 5.400 . 5.400 3.679 3.301 4.209 . 0 0 "[ . 1 . 2]" 1
1022 1 122 LEU H 1 122 LEU HG 4.900 . 4.900 2.707 1.817 4.334 . 0 0 "[ . 1 . 2]" 1
1023 1 122 LEU H 1 123 ASP H 3.100 . 3.100 2.573 2.487 2.664 . 0 0 "[ . 1 . 2]" 1
1024 1 122 LEU HA 1 122 LEU QD 2.800 . 2.800 2.661 2.303 2.811 0.011 19 0 "[ . 1 . 2]" 1
1025 1 122 LEU HA 1 123 ASP H 3.700 . 3.700 3.529 3.507 3.555 . 0 0 "[ . 1 . 2]" 1
1026 1 122 LEU HA 1 125 LEU H 3.700 . 3.700 3.573 3.337 3.729 0.029 10 0 "[ . 1 . 2]" 1
1027 1 122 LEU HA 1 125 LEU QD 4.200 . 4.200 2.870 2.066 3.384 . 0 0 "[ . 1 . 2]" 1
1028 1 122 LEU QB 1 126 ILE MD 4.000 . 4.000 2.060 1.798 2.696 . 0 0 "[ . 1 . 2]" 1
1029 1 122 LEU HB2 1 122 LEU QD 3.200 . 3.200 2.084 1.995 2.154 . 0 0 "[ . 1 . 2]" 1
1030 1 122 LEU HB2 1 123 ASP H 4.300 . 4.300 2.624 2.354 3.088 . 0 0 "[ . 1 . 2]" 1
1031 1 122 LEU HB3 1 122 LEU MD2 3.000 . 3.000 2.134 1.991 2.337 . 0 0 "[ . 1 . 2]" 1
1032 1 122 LEU HB3 1 123 ASP H 4.200 . 4.200 3.589 2.745 3.869 . 0 0 "[ . 1 . 2]" 1
1033 1 122 LEU MD1 1 123 ASP H 5.200 . 5.200 3.956 3.713 4.592 . 0 0 "[ . 1 . 2]" 1
1034 1 122 LEU MD2 1 123 ASP H 5.400 . 5.400 4.727 4.441 4.833 . 0 0 "[ . 1 . 2]" 1
1035 1 123 ASP H 1 123 ASP HB2 3.900 . 3.900 2.475 2.293 2.590 . 0 0 "[ . 1 . 2]" 1
1036 1 123 ASP H 1 123 ASP HB3 3.800 . 3.800 2.573 2.458 2.772 . 0 0 "[ . 1 . 2]" 1
1037 1 123 ASP H 1 124 LEU H 3.200 . 3.200 2.668 2.559 2.770 . 0 0 "[ . 1 . 2]" 1
1038 1 123 ASP HA 1 126 ILE H 3.600 . 3.600 3.451 3.235 3.619 0.019 5 0 "[ . 1 . 2]" 1
1039 1 123 ASP HA 1 127 ASN H 3.600 . 3.600 2.665 2.313 3.079 . 0 0 "[ . 1 . 2]" 1
1040 1 123 ASP HB2 1 124 LEU H 3.900 . 3.900 3.824 3.600 3.940 0.040 8 0 "[ . 1 . 2]" 1
1041 1 123 ASP HB3 1 124 LEU H 3.800 . 3.800 2.583 2.377 2.681 . 0 0 "[ . 1 . 2]" 1
1042 1 124 LEU H 1 124 LEU HB2 4.400 . 4.400 2.623 2.511 3.040 . 0 0 "[ . 1 . 2]" 1
1043 1 124 LEU H 1 124 LEU HB3 4.200 . 4.200 2.393 2.076 2.497 . 0 0 "[ . 1 . 2]" 1
1044 1 124 LEU H 1 124 LEU QD . . 5.000 3.689 3.647 3.725 . 0 0 "[ . 1 . 2]" 1
1045 1 124 LEU H 1 124 LEU HG 4.700 . 4.700 4.385 3.939 4.474 . 0 0 "[ . 1 . 2]" 1
1046 1 124 LEU H 1 125 LEU H 3.300 . 3.300 2.732 2.598 2.810 . 0 0 "[ . 1 . 2]" 1
1047 1 124 LEU HA 1 124 LEU QD 3.300 . 3.300 2.188 1.949 2.701 . 0 0 "[ . 1 . 2]" 1
1048 1 124 LEU HA 1 128 TYR H 4.500 . 4.500 2.983 2.807 3.240 . 0 0 "[ . 1 . 2]" 1
1049 1 124 LEU HB2 1 125 LEU H 4.400 . 4.400 3.926 3.825 4.148 . 0 0 "[ . 1 . 2]" 1
1050 1 124 LEU HB3 1 125 LEU H 4.200 . 4.200 2.604 2.430 2.998 . 0 0 "[ . 1 . 2]" 1
1051 1 124 LEU MD1 1 124 LEU MD2 2.800 . 2.800 1.958 1.874 2.056 . 0 0 "[ . 1 . 2]" 1
1052 1 124 LEU QD 1 125 LEU H 5.000 . 5.000 3.750 3.490 3.977 . 0 0 "[ . 1 . 2]" 1
1053 1 124 LEU QD 1 125 LEU QD 4.000 . 4.000 3.342 2.644 3.589 . 0 0 "[ . 1 . 2]" 1
1054 1 124 LEU QD 1 128 TYR H 6.000 . 6.000 4.156 3.794 4.705 . 0 0 "[ . 1 . 2]" 1
1055 1 124 LEU QD 1 128 TYR HB2 3.900 . 3.900 2.337 1.882 2.908 . 0 0 "[ . 1 . 2]" 1
1056 1 124 LEU QD 1 128 TYR HB3 3.800 . 3.800 2.904 2.221 3.445 . 0 0 "[ . 1 . 2]" 1
1057 1 124 LEU QD 1 138 TRP HH2 3.400 . 3.400 3.388 2.312 4.058 0.658 10 6 "[ * -* + * . *2]" 1
1058 1 124 LEU QD 1 138 TRP HZ2 . . 3.300 2.322 1.835 3.713 0.413 17 0 "[ . 1 . 2]" 1
1059 1 125 LEU H 1 125 LEU HG 5.200 . 5.200 2.599 2.397 2.933 . 0 0 "[ . 1 . 2]" 1
1060 1 125 LEU H 1 126 ILE H 3.100 . 3.100 2.523 2.343 2.668 . 0 0 "[ . 1 . 2]" 1
1061 1 125 LEU HA 1 125 LEU QD . . 3.600 2.339 1.901 2.998 . 0 0 "[ . 1 . 2]" 1
1062 1 125 LEU HA 1 126 ILE H 3.800 . 3.800 3.527 3.473 3.557 . 0 0 "[ . 1 . 2]" 1
1063 1 125 LEU HA 1 138 TRP HD1 4.200 . 4.200 3.132 2.309 4.206 0.006 13 0 "[ . 1 . 2]" 1
1064 1 125 LEU HB2 1 125 LEU QD 3.000 . 3.000 2.113 1.923 2.322 . 0 0 "[ . 1 . 2]" 1
1065 1 126 ILE H 1 126 ILE HB 4.400 . 4.400 2.601 2.546 2.699 . 0 0 "[ . 1 . 2]" 1
1066 1 126 ILE H 1 126 ILE MD 3.500 . 3.500 3.353 3.142 3.498 . 0 0 "[ . 1 . 2]" 1
1067 1 126 ILE H 1 126 ILE MG 3.900 . 3.900 3.803 3.789 3.823 . 0 0 "[ . 1 . 2]" 1
1068 1 126 ILE H 1 127 ASN H 3.100 . 3.100 2.621 2.407 2.711 . 0 0 "[ . 1 . 2]" 1
1069 1 126 ILE H 1 128 TYR H 5.100 . 5.100 3.926 3.656 4.288 . 0 0 "[ . 1 . 2]" 1
1070 1 126 ILE HA 1 126 ILE MG 3.200 . 3.200 2.304 2.169 2.402 . 0 0 "[ . 1 . 2]" 1
1071 1 126 ILE HA 1 127 ASN H 3.700 . 3.700 3.574 3.557 3.585 . 0 0 "[ . 1 . 2]" 1
1072 1 126 ILE HB 1 126 ILE MD 2.900 . 2.900 2.238 2.082 2.353 . 0 0 "[ . 1 . 2]" 1
1073 1 126 ILE HB 1 127 ASN H 4.400 . 4.400 2.183 2.079 2.736 . 0 0 "[ . 1 . 2]" 1
1074 1 126 ILE MD 1 127 ASN H 5.300 . 5.300 3.973 3.728 4.479 . 0 0 "[ . 1 . 2]" 1
1075 1 126 ILE MG 1 127 ASN H 5.200 . 5.200 3.245 3.113 3.595 . 0 0 "[ . 1 . 2]" 1
1076 1 126 ILE MG 1 127 ASN HA 4.100 . 4.100 3.484 3.300 3.638 . 0 0 "[ . 1 . 2]" 1
1077 1 127 ASN H 1 127 ASN HB2 3.900 . 3.900 2.417 2.225 2.655 . 0 0 "[ . 1 . 2]" 1
1078 1 127 ASN H 1 127 ASN HB3 3.900 . 3.900 3.360 2.578 3.708 . 0 0 "[ . 1 . 2]" 1
1079 1 127 ASN H 1 128 TYR H 3.100 . 3.100 2.680 2.357 2.813 . 0 0 "[ . 1 . 2]" 1
1080 1 127 ASN HA 1 128 TYR H 3.500 . 3.500 3.554 3.507 3.583 0.083 17 0 "[ . 1 . 2]" 1
1081 1 128 TYR H 1 128 TYR HB2 4.000 . 4.000 2.468 2.387 2.629 . 0 0 "[ . 1 . 2]" 1
1082 1 128 TYR H 1 128 TYR HB3 3.600 . 3.600 3.655 3.597 3.730 0.130 14 0 "[ . 1 . 2]" 1
1083 1 128 TYR HA 1 129 SER H 3.400 . 3.400 2.383 2.301 2.495 . 0 0 "[ . 1 . 2]" 1
1084 1 128 TYR HB2 1 129 SER H 4.000 . 4.000 3.636 3.323 3.801 . 0 0 "[ . 1 . 2]" 1
1085 1 128 TYR HB3 1 129 SER H 3.600 . 3.600 2.387 2.102 2.614 . 0 0 "[ . 1 . 2]" 1
1086 1 129 SER H 1 129 SER HB2 3.700 . 3.700 3.294 2.541 3.784 0.084 17 0 "[ . 1 . 2]" 1
1087 1 129 SER H 1 129 SER HB3 3.700 . 3.700 3.123 2.604 3.760 0.060 15 0 "[ . 1 . 2]" 1
1088 1 129 SER HB2 1 130 ALA H 3.700 . 3.700 3.432 2.538 3.997 0.297 6 0 "[ . 1 . 2]" 1
1089 1 129 SER HB3 1 130 ALA H 3.700 . 3.700 3.580 2.535 3.915 0.215 3 0 "[ . 1 . 2]" 1
1090 1 130 ALA H 1 138 TRP H 4.000 . 4.000 2.552 2.473 2.608 . 0 0 "[ . 1 . 2]" 1
1091 1 130 ALA HA 1 131 ARG H 3.500 . 3.500 2.218 2.156 2.281 . 0 0 "[ . 1 . 2]" 1
1092 1 130 ALA MB 1 131 ARG H 5.600 . 5.600 2.871 2.678 3.103 . 0 0 "[ . 1 . 2]" 1
1093 1 130 ALA MB 1 137 LEU QB 4.700 . 4.700 1.971 1.765 2.650 . 0 0 "[ . 1 . 2]" 1
1094 1 130 ALA MB 1 137 LEU MD1 3.400 . 3.400 2.185 1.797 3.378 . 0 0 "[ . 1 . 2]" 1
1095 1 130 ALA MB 1 138 TRP HH2 4.400 . 4.400 3.546 2.857 4.429 0.029 3 0 "[ . 1 . 2]" 1
1096 1 130 ALA MB 1 138 TRP HZ2 4.800 . 4.800 3.211 2.453 4.910 0.110 17 0 "[ . 1 . 2]" 1
1097 1 131 ARG HA 1 132 MET H 3.500 . 3.500 2.164 2.140 2.226 . 0 0 "[ . 1 . 2]" 1
1098 1 131 ARG HA 1 136 TYR HA 2.500 . 2.500 2.097 1.765 2.480 . 0 0 "[ . 1 . 2]" 1
1099 1 131 ARG HA 1 136 TYR HD1 4.200 . 4.200 3.664 2.527 4.210 0.010 11 0 "[ . 1 . 2]" 1
1100 1 131 ARG HA 1 137 LEU H 3.500 . 3.500 2.685 2.104 3.347 . 0 0 "[ . 1 . 2]" 1
1101 1 131 ARG HB2 1 132 MET H 4.900 . 4.900 3.945 2.986 4.498 . 0 0 "[ . 1 . 2]" 1
1102 1 131 ARG HB3 1 132 MET H 4.800 . 4.800 3.953 3.017 4.362 . 0 0 "[ . 1 . 2]" 1
1103 1 132 MET H 1 132 MET HB3 4.300 . 4.300 2.670 2.550 2.984 . 0 0 "[ . 1 . 2]" 1
1104 1 132 MET H 1 132 MET HG2 4.100 . 4.100 4.370 2.520 4.549 0.449 5 0 "[ . 1 . 2]" 1
1105 1 132 MET H 1 135 VAL H 3.500 . 3.500 3.512 3.319 3.556 0.056 17 0 "[ . 1 . 2]" 1
1106 1 132 MET H 1 136 TYR HA 3.500 . 3.500 2.832 2.554 3.367 . 0 0 "[ . 1 . 2]" 1
1107 1 132 MET H 1 136 TYR HD1 5.500 3.000 5.500 4.282 3.384 5.069 . 0 0 "[ . 1 . 2]" 1
1108 1 132 MET H 1 137 LEU H 4.000 . 4.000 3.484 3.037 4.020 0.020 17 0 "[ . 1 . 2]" 1
1109 1 132 MET H 1 137 LEU MD1 5.600 . 5.600 3.457 2.371 5.251 . 0 0 "[ . 1 . 2]" 1
1110 1 132 MET H 1 137 LEU HG 5.000 . 5.000 4.059 2.981 5.053 0.053 15 0 "[ . 1 . 2]" 1
1111 1 132 MET HA 1 132 MET ME 4.000 . 4.000 4.024 3.912 4.206 0.206 1 0 "[ . 1 . 2]" 1
1112 1 132 MET HA 1 132 MET HG2 4.000 . 4.000 2.953 2.808 3.564 . 0 0 "[ . 1 . 2]" 1
1113 1 132 MET HA 1 133 GLY H 3.500 . 3.500 2.197 2.151 2.339 . 0 0 "[ . 1 . 2]" 1
1114 1 132 MET HB2 1 132 MET ME 4.000 . 4.000 2.209 1.980 2.828 . 0 0 "[ . 1 . 2]" 1
1115 1 132 MET HB2 1 132 MET HG2 3.100 . 3.100 2.992 2.797 3.010 . 0 0 "[ . 1 . 2]" 1
1116 1 132 MET ME 1 132 MET HG2 3.000 . 3.000 3.370 3.315 3.395 0.395 4 0 "[ . 1 . 2]" 1
1117 1 132 MET HG2 1 133 GLY H 4.100 . 4.100 3.592 3.189 4.260 0.160 18 0 "[ . 1 . 2]" 1
1118 1 134 ASN HA 1 135 VAL H 3.600 . 3.600 3.078 3.004 3.209 . 0 0 "[ . 1 . 2]" 1
1119 1 135 VAL H 1 135 VAL HB 4.200 . 4.200 3.677 3.196 3.893 . 0 0 "[ . 1 . 2]" 1
1120 1 135 VAL H 1 136 TYR H 5.200 . 5.200 4.385 4.332 4.466 . 0 0 "[ . 1 . 2]" 1
1121 1 135 VAL HA 1 135 VAL MG1 3.500 . 3.500 2.560 2.193 3.202 . 0 0 "[ . 1 . 2]" 1
1122 1 135 VAL HA 1 135 VAL MG2 3.500 . 3.500 2.936 2.263 3.204 . 0 0 "[ . 1 . 2]" 1
1123 1 135 VAL HA 1 136 TYR H 2.500 . 2.500 2.270 2.172 2.397 . 0 0 "[ . 1 . 2]" 1
1124 1 135 VAL HB 1 136 TYR H 4.200 . 4.200 3.095 2.357 4.140 . 0 0 "[ . 1 . 2]" 1
1125 1 135 VAL MG1 1 136 TYR H 5.000 . 5.000 3.747 3.601 3.954 . 0 0 "[ . 1 . 2]" 1
1126 1 135 VAL MG2 1 136 TYR H 5.100 . 5.100 3.239 1.990 3.972 . 0 0 "[ . 1 . 2]" 1
1127 1 136 TYR H 1 136 TYR HD1 3.300 . 3.300 2.887 2.193 3.340 0.040 13 0 "[ . 1 . 2]" 1
1128 1 136 TYR HA 1 137 LEU H 2.500 . 2.500 2.187 2.139 2.263 . 0 0 "[ . 1 . 2]" 1
1129 1 136 TYR HB2 1 137 LEU H 4.100 . 4.100 4.107 3.662 4.272 0.172 11 0 "[ . 1 . 2]" 1
1130 1 136 TYR HB3 1 137 LEU H 4.000 . 4.000 3.161 2.874 3.496 . 0 0 "[ . 1 . 2]" 1
1131 1 137 LEU H 1 137 LEU MD1 5.400 . 5.400 3.044 1.946 4.163 . 0 0 "[ . 1 . 2]" 1
1132 1 137 LEU H 1 138 TRP H 3.300 . 3.300 2.698 2.066 2.871 . 0 0 "[ . 1 . 2]" 1
1133 1 137 LEU HA 1 137 LEU MD1 3.500 . 3.500 3.437 2.063 3.834 0.334 8 0 "[ . 1 . 2]" 1
1134 1 137 LEU QB 1 137 LEU MD2 2.800 . 2.800 2.108 1.893 2.310 . 0 0 "[ . 1 . 2]" 1
1135 1 137 LEU QB 1 138 TRP HE3 4.700 . 4.700 2.353 1.829 2.987 . 0 0 "[ . 1 . 2]" 1
1136 1 137 LEU MD1 1 138 TRP HH2 5.000 . 5.000 4.298 2.959 5.544 0.544 13 1 "[ . 1 + . 2]" 1
1137 1 137 LEU MD2 1 137 LEU HG 2.500 . 2.500 2.101 2.086 2.128 . 0 0 "[ . 1 . 2]" 1
1138 1 140 GLU HA 1 141 LEU H 3.600 . 3.600 2.413 2.139 3.538 . 0 0 "[ . 1 . 2]" 1
1139 1 141 LEU H 1 141 LEU QB 2.500 . 2.500 2.332 2.074 2.520 0.020 5 0 "[ . 1 . 2]" 1
1140 1 141 LEU H 1 141 LEU MD1 5.800 . 5.800 3.861 3.072 4.452 . 0 0 "[ . 1 . 2]" 1
1141 1 141 LEU H 1 142 ASN H 3.200 . 3.200 2.587 2.021 3.407 0.207 5 0 "[ . 1 . 2]" 1
1142 1 141 LEU HA 1 141 LEU MD1 3.600 . 3.600 3.124 1.961 3.856 0.256 6 0 "[ . 1 . 2]" 1
1143 1 141 LEU HA 1 141 LEU MD2 2.900 . 2.900 2.447 1.928 3.066 0.166 9 0 "[ . 1 . 2]" 1
1144 1 141 LEU HA 1 142 ASN H 3.600 . 3.600 3.263 2.428 3.567 . 0 0 "[ . 1 . 2]" 1
1145 1 141 LEU HB2 1 142 ASN H 4.700 . 4.700 3.465 2.243 4.642 . 0 0 "[ . 1 . 2]" 1
1146 1 141 LEU HB3 1 142 ASN H 4.600 . 4.600 3.652 2.538 4.373 . 0 0 "[ . 1 . 2]" 1
1147 1 142 ASN H 1 142 ASN QB 2.500 . 2.500 2.393 2.158 2.534 0.034 19 0 "[ . 1 . 2]" 1
1148 1 142 ASN HA 1 143 GLU H 3.600 . 3.600 2.587 2.155 3.554 . 0 0 "[ . 1 . 2]" 1
1149 1 142 ASN HB2 1 143 GLU H 4.000 . 4.000 3.541 2.647 4.357 0.357 1 0 "[ . 1 . 2]" 1
1150 1 143 GLU H 1 143 GLU QB 2.500 . 2.500 2.406 2.120 2.600 0.100 15 0 "[ . 1 . 2]" 1
1151 1 143 GLU HA 1 144 SER H 3.600 . 3.600 2.665 2.147 3.564 . 0 0 "[ . 1 . 2]" 1
1152 1 144 SER HA 1 144 SER HB2 2.500 . 2.500 2.447 2.356 2.597 0.097 3 0 "[ . 1 . 2]" 1
1153 1 145 ASN HA 1 145 ASN HB2 2.500 . 2.500 2.502 2.451 2.636 0.136 9 0 "[ . 1 . 2]" 1
1154 1 145 ASN HA 1 146 TYR H 3.600 . 3.600 2.508 2.140 3.562 . 0 0 "[ . 1 . 2]" 1
1155 1 146 TYR H 1 146 TYR QB 2.500 . 2.500 2.413 2.242 2.675 0.175 9 0 "[ . 1 . 2]" 1
1156 1 146 TYR HA 1 146 TYR HB2 2.700 . 2.700 2.522 2.414 2.715 0.015 8 0 "[ . 1 . 2]" 1
1157 1 146 TYR HA 1 146 TYR HB3 2.900 . 2.900 2.844 2.438 3.024 0.124 11 0 "[ . 1 . 2]" 1
1158 1 146 TYR HA 1 147 LYS H 3.600 . 3.600 2.746 2.147 3.564 . 0 0 "[ . 1 . 2]" 1
1159 1 146 TYR HD1 1 147 LYS HA 4.000 . 4.000 3.781 3.303 4.158 0.158 8 0 "[ . 1 . 2]" 1
1160 1 147 LYS H 1 147 LYS QB 2.500 . 2.500 2.409 2.203 2.654 0.154 11 0 "[ . 1 . 2]" 1
1161 1 147 LYS HA 1 147 LYS HB3 2.900 . 2.900 2.669 2.492 3.019 0.119 8 0 "[ . 1 . 2]" 1
1162 1 148 THR HA 1 148 THR MG 3.500 . 3.500 2.778 2.338 3.227 . 0 0 "[ . 1 . 2]" 1
1163 1 148 THR HB 1 148 THR MG 2.500 . 2.500 2.100 2.078 2.118 . 0 0 "[ . 1 . 2]" 1
1164 1 150 CYS HA 1 150 CYS HB2 2.500 . 2.500 2.485 2.435 2.588 0.088 1 0 "[ . 1 . 2]" 1
1165 1 152 SER HA 1 152 SER HB2 2.600 . 2.600 2.451 2.356 2.623 0.023 18 0 "[ . 1 . 2]" 1
1166 1 153 SER HA 1 153 SER HB3 2.500 . 2.500 2.521 2.477 2.590 0.090 10 0 "[ . 1 . 2]" 1
1167 1 154 GLU H 1 154 GLU QB 2.500 . 2.500 2.397 2.144 2.646 0.146 14 0 "[ . 1 . 2]" 1
1168 1 155 ASN HA 1 156 LEU H 3.600 . 3.600 2.901 2.146 3.551 . 0 0 "[ . 1 . 2]" 1
1169 1 155 ASN HB2 1 156 LEU H 4.000 . 4.000 3.626 2.053 4.469 0.469 2 0 "[ . 1 . 2]" 1
1170 1 156 LEU H 1 156 LEU QB 2.500 . 2.500 2.415 2.263 2.600 0.100 18 0 "[ . 1 . 2]" 1
1171 1 156 LEU HA 1 156 LEU MD2 2.500 . 2.500 2.087 1.949 2.366 . 0 0 "[ . 1 . 2]" 1
1172 1 156 LEU HA 1 157 TYR H 3.600 . 3.600 2.545 2.145 3.565 . 0 0 "[ . 1 . 2]" 1
1173 1 156 LEU HB2 1 156 LEU MD2 3.500 . 3.500 3.023 2.351 3.196 . 0 0 "[ . 1 . 2]" 1
1174 1 156 LEU HB2 1 157 TYR H 4.700 . 4.700 4.092 2.356 4.619 . 0 0 "[ . 1 . 2]" 1
1175 1 157 TYR H 1 157 TYR HB2 4.000 . 4.000 3.013 2.130 3.597 . 0 0 "[ . 1 . 2]" 1
1176 1 157 TYR H 1 157 TYR HB3 3.900 . 3.900 3.068 2.444 3.635 . 0 0 "[ . 1 . 2]" 1
1177 1 157 TYR H 1 157 TYR HD1 3.300 . 3.300 2.645 1.618 3.565 0.265 13 0 "[ . 1 . 2]" 1
1178 1 157 TYR HA 1 157 TYR HB2 2.900 . 2.900 2.736 2.406 3.016 0.116 16 0 "[ . 1 . 2]" 1
1179 1 157 TYR HA 1 157 TYR HB3 2.600 . 2.600 2.467 2.350 2.734 0.134 3 0 "[ . 1 . 2]" 1
1180 1 157 TYR HA 1 158 PHE H 3.600 . 3.600 3.080 2.180 3.586 . 0 0 "[ . 1 . 2]" 1
1181 1 157 TYR HB2 1 158 PHE H 4.000 . 4.000 3.158 1.913 4.207 0.207 3 0 "[ . 1 . 2]" 1
1182 1 157 TYR HD1 1 158 PHE H 3.300 . 3.300 3.340 2.323 3.595 0.295 3 0 "[ . 1 . 2]" 1
1183 1 158 PHE H 1 158 PHE QB 2.500 . 2.500 2.432 2.270 2.550 0.050 18 0 "[ . 1 . 2]" 1
1184 1 158 PHE H 1 158 PHE HD1 3.300 . 3.300 2.896 2.137 3.672 0.372 4 0 "[ . 1 . 2]" 1
1185 1 158 PHE HA 1 158 PHE HB2 3.100 . 3.100 2.837 2.402 3.025 . 0 0 "[ . 1 . 2]" 1
1186 1 158 PHE HA 1 158 PHE HB3 3.000 . 3.000 2.531 2.428 2.667 . 0 0 "[ . 1 . 2]" 1
1187 1 158 PHE HA 1 159 GLN H 3.600 . 3.600 2.789 2.196 3.575 . 0 0 "[ . 1 . 2]" 1
1188 1 158 PHE HB2 1 159 GLN H 3.900 . 3.900 3.303 2.359 4.066 0.166 20 0 "[ . 1 . 2]" 1
1189 1 158 PHE HB3 1 158 PHE HD1 3.300 . 3.300 3.148 2.413 3.706 0.406 3 0 "[ . 1 . 2]" 1
1190 1 158 PHE HB3 1 159 GLN H 3.900 . 3.900 3.324 2.601 4.003 0.103 16 0 "[ . 1 . 2]" 1
1191 1 159 GLN H 1 159 GLN HB2 4.300 . 4.300 2.654 2.082 3.523 . 0 0 "[ . 1 . 2]" 1
1192 1 159 GLN H 1 159 GLN HB3 4.200 . 4.200 3.579 2.496 4.104 . 0 0 "[ . 1 . 2]" 1
1193 1 159 GLN H 1 159 GLN HG3 4.200 . 4.200 3.373 2.536 4.408 0.208 17 0 "[ . 1 . 2]" 1
1194 1 159 GLN HA 1 159 GLN HB3 3.100 . 3.100 2.675 2.468 3.024 . 0 0 "[ . 1 . 2]" 1
1195 1 159 GLN HA 1 159 GLN HG3 3.200 . 3.200 2.743 2.029 3.097 . 0 0 "[ . 1 . 2]" 1
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