NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
567309 |
2mbc   |
19395 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mbc
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 2140
_Distance_constraint_stats_list.Viol_count 1923
_Distance_constraint_stats_list.Viol_total 3664.634
_Distance_constraint_stats_list.Viol_max 0.873
_Distance_constraint_stats_list.Viol_rms 0.0308
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0043
_Distance_constraint_stats_list.Viol_average_violations_only 0.0953
_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 7 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 PRO 0.649 0.094 8 0 "[ . 1 . 2]"
1 10 VAL 2.323 0.142 9 0 "[ . 1 . 2]"
1 11 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 VAL 0.589 0.131 6 0 "[ . 1 . 2]"
1 13 SER 0.060 0.029 6 0 "[ . 1 . 2]"
1 14 TYR 0.860 0.544 6 1 "[ .+ 1 . 2]"
1 15 LYS 0.540 0.280 6 0 "[ . 1 . 2]"
1 16 HIS 0.302 0.124 8 0 "[ . 1 . 2]"
1 17 MET 1.609 0.644 6 1 "[ .+ 1 . 2]"
1 18 ARG 0.419 0.299 6 0 "[ . 1 . 2]"
1 19 PHE 10.533 0.776 10 8 "[ - * * +** . **2]"
1 20 LEU 7.538 0.262 3 0 "[ . 1 . 2]"
1 21 ILE 4.110 0.269 20 0 "[ . 1 . 2]"
1 26 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 THR 0.466 0.159 1 0 "[ . 1 . 2]"
1 30 LEU 2.013 0.204 14 0 "[ . 1 . 2]"
1 31 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 THR 0.201 0.059 19 0 "[ . 1 . 2]"
1 33 PHE 0.605 0.160 4 0 "[ . 1 . 2]"
1 34 ILE 0.885 0.123 4 0 "[ . 1 . 2]"
1 35 GLU 0.280 0.059 19 0 "[ . 1 . 2]"
1 36 ASP 0.288 0.050 19 0 "[ . 1 . 2]"
1 37 LEU 1.682 0.141 14 0 "[ . 1 . 2]"
1 38 LYS 0.093 0.015 14 0 "[ . 1 . 2]"
1 39 LYS 0.387 0.045 11 0 "[ . 1 . 2]"
1 40 TYR 0.202 0.050 19 0 "[ . 1 . 2]"
1 41 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 ALA 1.363 0.107 10 0 "[ . 1 . 2]"
1 43 THR 1.471 0.186 4 0 "[ . 1 . 2]"
1 44 THR 0.249 0.042 8 0 "[ . 1 . 2]"
1 45 VAL 0.240 0.048 11 0 "[ . 1 . 2]"
1 46 VAL 0.188 0.188 10 0 "[ . 1 . 2]"
1 47 ARG 1.769 0.137 14 0 "[ . 1 . 2]"
1 49 CYS 2.826 0.873 8 1 "[ . + 1 . 2]"
1 50 GLU 2.415 0.324 2 0 "[ . 1 . 2]"
1 51 VAL 8.551 0.314 7 0 "[ . 1 . 2]"
1 52 THR 3.194 0.324 2 0 "[ . 1 . 2]"
1 53 TYR 2.549 0.314 7 0 "[ . 1 . 2]"
1 54 ASP 0.760 0.125 9 0 "[ . 1 . 2]"
1 55 LYS 0.795 0.360 11 0 "[ . 1 . 2]"
1 56 THR 0.009 0.009 16 0 "[ . 1 . 2]"
1 57 PRO 2.228 0.200 18 0 "[ . 1 . 2]"
1 58 LEU 1.721 0.204 14 0 "[ . 1 . 2]"
1 59 GLU 3.935 0.284 18 0 "[ . 1 . 2]"
1 60 LYS 3.212 0.234 20 0 "[ . 1 . 2]"
1 61 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 GLY 2.842 0.234 20 0 "[ . 1 . 2]"
1 63 ILE 6.029 0.284 18 0 "[ . 1 . 2]"
1 64 THR 1.048 0.152 14 0 "[ . 1 . 2]"
1 65 VAL 0.807 0.360 11 0 "[ . 1 . 2]"
1 66 VAL 3.761 0.515 13 1 "[ . 1 + . 2]"
1 67 ASP 13.100 0.579 11 3 "[ -. * 1+ . 2]"
1 68 TRP 2.398 0.515 13 1 "[ . 1 + . 2]"
1 69 PRO 8.131 0.579 11 3 "[ -. * 1+ . 2]"
1 70 PHE 2.234 0.873 8 1 "[ . + 1 . 2]"
1 71 ASP 1.953 0.260 14 0 "[ . 1 . 2]"
1 73 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 ALA 0.191 0.138 20 0 "[ . 1 . 2]"
1 78 GLY 1.555 0.289 1 0 "[ . 1 . 2]"
1 79 LYS 0.012 0.012 17 0 "[ . 1 . 2]"
1 80 VAL 4.433 0.620 10 1 "[ . + . 2]"
1 81 VAL 11.223 0.313 19 0 "[ . 1 . 2]"
1 82 GLU 3.899 0.620 10 1 "[ . + . 2]"
1 83 ASP 0.513 0.150 10 0 "[ . 1 . 2]"
1 84 TRP 6.286 0.282 19 0 "[ . 1 . 2]"
1 85 LEU 3.246 0.313 19 0 "[ . 1 . 2]"
1 86 SER 0.148 0.112 12 0 "[ . 1 . 2]"
1 87 LEU 2.497 0.206 12 0 "[ . 1 . 2]"
1 88 VAL 1.392 0.543 10 1 "[ . + . 2]"
1 89 LYS 3.050 0.401 13 0 "[ . 1 . 2]"
1 90 ALA 0.844 0.251 4 0 "[ . 1 . 2]"
1 91 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 PHE 7.090 0.635 10 1 "[ . + . 2]"
1 93 CYS 1.621 0.534 10 1 "[ . + . 2]"
1 94 GLU 2.662 0.165 10 0 "[ . 1 . 2]"
1 95 ALA 5.680 0.400 8 0 "[ . 1 . 2]"
1 96 PRO 2.139 0.230 6 0 "[ . 1 . 2]"
1 97 GLY 0.294 0.100 18 0 "[ . 1 . 2]"
1 98 SER 2.952 0.400 8 0 "[ . 1 . 2]"
1 99 CYS 0.193 0.099 15 0 "[ . 1 . 2]"
1 100 VAL 10.483 0.776 10 8 "[ - * * +** . **2]"
1 101 ALA 0.206 0.044 8 0 "[ . 1 . 2]"
1 102 VAL 3.683 0.292 3 0 "[ . 1 . 2]"
1 103 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 105 VAL 0.103 0.081 11 0 "[ . 1 . 2]"
1 106 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 GLY 8.583 0.693 1 7 "[+ * . 1 **. **-2]"
1 108 LEU 7.923 0.266 15 0 "[ . 1 . 2]"
1 109 GLY 8.577 0.693 1 7 "[+ * . 1 **. **-2]"
1 110 ARG 0.296 0.081 11 0 "[ . 1 . 2]"
1 112 PRO 4.861 0.235 11 0 "[ . 1 . 2]"
1 113 VAL 3.003 0.169 20 0 "[ . 1 . 2]"
1 114 LEU 7.336 0.448 3 0 "[ . 1 . 2]"
1 115 VAL 15.401 0.527 4 3 "[ +. * . - 2]"
1 116 ALA 2.355 0.230 5 0 "[ . 1 . 2]"
1 117 LEU 2.134 0.193 7 0 "[ . 1 . 2]"
1 118 ALA 7.617 0.527 4 3 "[ +. * . - 2]"
1 119 LEU 1.755 0.099 18 0 "[ . 1 . 2]"
1 120 ILE 4.977 0.146 8 0 "[ . 1 . 2]"
1 121 GLU 2.451 0.327 4 0 "[ . 1 . 2]"
1 122 SER 0.126 0.048 8 0 "[ . 1 . 2]"
1 123 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 124 MET 1.113 0.087 16 0 "[ . 1 . 2]"
1 125 LYS 6.415 0.256 17 0 "[ . 1 . 2]"
1 126 TYR 2.562 0.159 13 0 "[ . 1 . 2]"
1 127 GLU 3.879 0.171 10 0 "[ . 1 . 2]"
1 128 ASP 3.987 0.200 13 0 "[ . 1 . 2]"
1 129 ALA 8.163 0.256 17 0 "[ . 1 . 2]"
1 130 ILE 6.240 0.200 13 0 "[ . 1 . 2]"
1 131 GLN 1.646 0.086 17 0 "[ . 1 . 2]"
1 132 PHE 0.799 0.092 12 0 "[ . 1 . 2]"
1 133 ILE 2.628 0.230 5 0 "[ . 1 . 2]"
1 134 ARG 0.318 0.098 13 0 "[ . 1 . 2]"
1 135 GLN 0.353 0.200 16 0 "[ . 1 . 2]"
1 136 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 139 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 140 ALA 5.307 0.266 15 0 "[ . 1 . 2]"
1 141 ILE 7.688 0.465 7 0 "[ . 1 . 2]"
1 142 ASN 3.631 0.465 7 0 "[ . 1 . 2]"
1 144 LYS 0.260 0.139 6 0 "[ . 1 . 2]"
1 145 GLN 3.401 0.312 15 0 "[ . 1 . 2]"
1 146 LEU 3.091 0.312 15 0 "[ . 1 . 2]"
1 147 THR 0.625 0.139 6 0 "[ . 1 . 2]"
1 148 TYR 4.768 0.458 19 0 "[ . 1 . 2]"
1 149 LEU 3.774 0.291 19 0 "[ . 1 . 2]"
1 150 GLU 2.789 0.159 13 0 "[ . 1 . 2]"
1 151 LYS 0.577 0.077 8 0 "[ . 1 . 2]"
1 152 TYR 3.575 0.630 14 5 "[ *.* 1 * +. - 2]"
1 153 ARG 0.123 0.123 13 0 "[ . 1 . 2]"
1 154 PRO 0.545 0.115 11 0 "[ . 1 . 2]"
1 155 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 156 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 157 ARG 0.747 0.401 13 0 "[ . 1 . 2]"
1 158 LEU 3.500 0.327 4 0 "[ . 1 . 2]"
1 161 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 162 ASP 0.110 0.034 16 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 7 PRO HA 1 8 ALA MB . . 5.010 3.969 3.915 4.047 . 0 0 "[ . 1 . 2]" 1
2 1 8 ALA HA 1 9 PRO QD . . 3.540 1.884 1.875 1.902 . 0 0 "[ . 1 . 2]" 1
3 1 8 ALA MB 1 9 PRO QD . . 3.770 3.312 3.278 3.360 . 0 0 "[ . 1 . 2]" 1
4 1 8 ALA MB 1 40 TYR QE . . 5.650 4.348 4.267 4.464 . 0 0 "[ . 1 . 2]" 1
5 1 9 PRO HA 1 10 VAL HB . . 5.130 4.495 4.458 4.534 . 0 0 "[ . 1 . 2]" 1
6 1 9 PRO HA 1 20 LEU QD . . 5.070 4.034 4.000 4.071 . 0 0 "[ . 1 . 2]" 1
7 1 9 PRO HA 1 21 ILE H . . 6.000 6.023 5.938 6.094 0.094 8 0 "[ . 1 . 2]" 1
8 1 9 PRO QB 1 10 VAL H . . 3.890 1.930 1.906 1.988 . 0 0 "[ . 1 . 2]" 1
9 1 9 PRO QB 1 10 VAL QG . . 4.080 4.076 4.048 4.091 0.011 19 0 "[ . 1 . 2]" 1
10 1 9 PRO QB 1 20 LEU QD . . 3.750 1.875 1.853 1.918 . 0 0 "[ . 1 . 2]" 1
11 1 9 PRO QB 1 20 LEU HG . . 4.350 3.702 3.646 3.753 . 0 0 "[ . 1 . 2]" 1
12 1 9 PRO HB2 1 10 VAL H . . 4.540 1.947 1.922 2.008 . 0 0 "[ . 1 . 2]" 1
13 1 9 PRO HB2 1 20 LEU HG . . 5.100 3.834 3.771 3.885 . 0 0 "[ . 1 . 2]" 1
14 1 9 PRO HB3 1 10 VAL H . . 4.540 3.162 3.153 3.184 . 0 0 "[ . 1 . 2]" 1
15 1 9 PRO HB3 1 20 LEU HG . . 5.100 4.889 4.836 4.961 . 0 0 "[ . 1 . 2]" 1
16 1 9 PRO QD 1 20 LEU QD . . 5.230 3.843 3.768 3.910 . 0 0 "[ . 1 . 2]" 1
17 1 9 PRO QD 1 40 TYR QE . . 4.860 2.179 2.010 2.303 . 0 0 "[ . 1 . 2]" 1
18 1 9 PRO QG 1 10 VAL QG . . 5.270 4.886 4.853 4.919 . 0 0 "[ . 1 . 2]" 1
19 1 9 PRO QG 1 20 LEU QD . . 4.480 2.090 1.992 2.177 . 0 0 "[ . 1 . 2]" 1
20 1 9 PRO QG 1 20 LEU HG . . 4.620 3.501 3.418 3.594 . 0 0 "[ . 1 . 2]" 1
21 1 9 PRO QG 1 36 ASP QB . . 5.620 3.207 2.677 3.755 . 0 0 "[ . 1 . 2]" 1
22 1 9 PRO QG 1 40 TYR H . . 5.810 5.104 5.064 5.156 . 0 0 "[ . 1 . 2]" 1
23 1 9 PRO QG 1 40 TYR HB3 . . 4.700 4.522 4.378 4.624 . 0 0 "[ . 1 . 2]" 1
24 1 9 PRO QG 1 40 TYR QD . . 4.550 3.160 3.121 3.213 . 0 0 "[ . 1 . 2]" 1
25 1 9 PRO QG 1 40 TYR QE . . 4.500 2.772 2.698 2.820 . 0 0 "[ . 1 . 2]" 1
26 1 9 PRO HG2 1 20 LEU HG . . 5.260 3.860 3.760 3.967 . 0 0 "[ . 1 . 2]" 1
27 1 9 PRO HG2 1 40 TYR QE . . 5.280 2.912 2.839 2.949 . 0 0 "[ . 1 . 2]" 1
28 1 9 PRO HG3 1 20 LEU HG . . 5.260 4.010 3.917 4.111 . 0 0 "[ . 1 . 2]" 1
29 1 9 PRO HG3 1 40 TYR QE . . 5.280 3.487 3.371 3.691 . 0 0 "[ . 1 . 2]" 1
30 1 10 VAL H 1 10 VAL HB . . 4.000 2.590 2.564 2.612 . 0 0 "[ . 1 . 2]" 1
31 1 10 VAL H 1 10 VAL QG . . 3.850 3.007 2.958 3.043 . 0 0 "[ . 1 . 2]" 1
32 1 10 VAL H 1 11 GLU H . . 5.170 4.181 4.140 4.221 . 0 0 "[ . 1 . 2]" 1
33 1 10 VAL H 1 11 GLU HA . . 5.440 4.728 4.708 4.763 . 0 0 "[ . 1 . 2]" 1
34 1 10 VAL H 1 20 LEU HA . . 5.690 4.218 4.167 4.278 . 0 0 "[ . 1 . 2]" 1
35 1 10 VAL H 1 20 LEU QD . . 4.960 2.438 2.405 2.489 . 0 0 "[ . 1 . 2]" 1
36 1 10 VAL H 1 20 LEU HG . . 4.990 5.104 5.071 5.132 0.142 9 0 "[ . 1 . 2]" 1
37 1 10 VAL H 1 21 ILE H . . 4.670 3.471 3.375 3.566 . 0 0 "[ . 1 . 2]" 1
38 1 10 VAL H 1 21 ILE MD . . 4.870 4.562 4.493 4.642 . 0 0 "[ . 1 . 2]" 1
39 1 10 VAL H 1 21 ILE QG . . 5.100 3.248 3.134 3.362 . 0 0 "[ . 1 . 2]" 1
40 1 10 VAL H 1 21 ILE MG . . 5.680 5.447 5.373 5.502 . 0 0 "[ . 1 . 2]" 1
41 1 10 VAL HA 1 11 GLU H . . 3.510 2.143 2.141 2.146 . 0 0 "[ . 1 . 2]" 1
42 1 10 VAL HA 1 20 LEU QD . . 5.300 3.386 3.357 3.405 . 0 0 "[ . 1 . 2]" 1
43 1 10 VAL HA 1 21 ILE QG . . 5.000 4.036 3.990 4.113 . 0 0 "[ . 1 . 2]" 1
44 1 10 VAL HB 1 11 GLU H . . 4.890 4.425 4.399 4.455 . 0 0 "[ . 1 . 2]" 1
45 1 10 VAL HB 1 11 GLU HA . . 6.000 5.163 5.139 5.200 . 0 0 "[ . 1 . 2]" 1
46 1 10 VAL HB 1 20 LEU HA . . 6.000 4.963 4.895 5.047 . 0 0 "[ . 1 . 2]" 1
47 1 10 VAL HB 1 21 ILE H . . 4.920 3.368 3.277 3.454 . 0 0 "[ . 1 . 2]" 1
48 1 10 VAL HB 1 21 ILE HA . . 6.000 4.925 4.844 4.989 . 0 0 "[ . 1 . 2]" 1
49 1 10 VAL HB 1 21 ILE MD . . 5.280 3.468 3.407 3.551 . 0 0 "[ . 1 . 2]" 1
50 1 10 VAL HB 1 21 ILE QG . . 4.430 1.867 1.837 1.956 . 0 0 "[ . 1 . 2]" 1
51 1 10 VAL QG 1 11 GLU H . . 4.550 2.825 2.755 2.900 . 0 0 "[ . 1 . 2]" 1
52 1 10 VAL QG 1 20 LEU QD . . 4.310 3.482 3.469 3.499 . 0 0 "[ . 1 . 2]" 1
53 1 10 VAL QG 1 21 ILE H . . 4.960 3.119 3.070 3.157 . 0 0 "[ . 1 . 2]" 1
54 1 11 GLU H 1 11 GLU HB2 . . 4.050 3.137 3.063 3.279 . 0 0 "[ . 1 . 2]" 1
55 1 11 GLU H 1 11 GLU QB . . 3.520 2.224 2.164 2.262 . 0 0 "[ . 1 . 2]" 1
56 1 11 GLU H 1 11 GLU HB3 . . 4.050 2.277 2.196 2.326 . 0 0 "[ . 1 . 2]" 1
57 1 11 GLU H 1 12 VAL H . . 4.890 4.446 4.406 4.531 . 0 0 "[ . 1 . 2]" 1
58 1 11 GLU H 1 20 LEU QD . . 4.930 2.799 2.734 2.840 . 0 0 "[ . 1 . 2]" 1
59 1 11 GLU HA 1 12 VAL H . . 3.500 2.147 2.139 2.182 . 0 0 "[ . 1 . 2]" 1
60 1 11 GLU HA 1 13 SER H . . 5.750 5.576 5.528 5.642 . 0 0 "[ . 1 . 2]" 1
61 1 11 GLU HA 1 20 LEU QD . . 4.020 1.812 1.768 1.855 . 0 0 "[ . 1 . 2]" 1
62 1 11 GLU HA 1 20 LEU HG . . 5.170 4.369 4.313 4.424 . 0 0 "[ . 1 . 2]" 1
63 1 11 GLU QB 1 12 VAL H . . 4.210 3.724 3.571 3.794 . 0 0 "[ . 1 . 2]" 1
64 1 11 GLU QB 1 20 LEU QD . . 4.440 1.735 1.698 1.806 . 0 0 "[ . 1 . 2]" 1
65 1 11 GLU QB 1 40 TYR QE . . 4.650 2.763 2.454 3.131 . 0 0 "[ . 1 . 2]" 1
66 1 11 GLU HB2 1 40 TYR QE . . 5.360 3.211 2.847 3.718 . 0 0 "[ . 1 . 2]" 1
67 1 11 GLU HB3 1 40 TYR QE . . 5.360 3.026 2.574 3.394 . 0 0 "[ . 1 . 2]" 1
68 1 11 GLU QG 1 12 VAL H . . 3.890 2.806 2.478 3.003 . 0 0 "[ . 1 . 2]" 1
69 1 11 GLU QG 1 13 SER H . . 5.540 3.594 3.399 3.910 . 0 0 "[ . 1 . 2]" 1
70 1 11 GLU QG 1 13 SER HB2 . . 5.080 4.421 4.129 4.514 . 0 0 "[ . 1 . 2]" 1
71 1 11 GLU QG 1 13 SER HB3 . . 4.760 3.604 3.318 4.094 . 0 0 "[ . 1 . 2]" 1
72 1 11 GLU QG 1 20 LEU QD . . 5.010 2.512 2.293 2.855 . 0 0 "[ . 1 . 2]" 1
73 1 11 GLU HG2 1 40 TYR QD . . 6.000 4.993 4.672 5.300 . 0 0 "[ . 1 . 2]" 1
74 1 11 GLU HG3 1 40 TYR QD . . 6.000 4.214 3.482 4.756 . 0 0 "[ . 1 . 2]" 1
75 1 12 VAL H 1 12 VAL MG1 . . 4.300 1.887 1.864 1.958 . 0 0 "[ . 1 . 2]" 1
76 1 12 VAL H 1 12 VAL QG . . 3.620 1.882 1.859 1.952 . 0 0 "[ . 1 . 2]" 1
77 1 12 VAL H 1 12 VAL MG2 . . 4.300 3.794 3.758 3.878 . 0 0 "[ . 1 . 2]" 1
78 1 12 VAL H 1 13 SER H . . 5.690 4.152 4.055 4.193 . 0 0 "[ . 1 . 2]" 1
79 1 12 VAL H 1 18 ARG HA . . 5.120 4.484 4.271 4.799 . 0 0 "[ . 1 . 2]" 1
80 1 12 VAL H 1 18 ARG HG3 . . 5.160 4.061 3.422 4.446 . 0 0 "[ . 1 . 2]" 1
81 1 12 VAL H 1 19 PHE QB . . 4.760 3.691 3.609 3.810 . 0 0 "[ . 1 . 2]" 1
82 1 12 VAL H 1 20 LEU QD . . 4.700 3.081 2.952 3.171 . 0 0 "[ . 1 . 2]" 1
83 1 12 VAL H 1 21 ILE MD . . 4.600 3.041 2.887 3.276 . 0 0 "[ . 1 . 2]" 1
84 1 12 VAL HA 1 21 ILE MD . . 4.720 4.023 3.905 4.181 . 0 0 "[ . 1 . 2]" 1
85 1 12 VAL HB 1 13 SER H . . 6.000 4.344 4.316 4.406 . 0 0 "[ . 1 . 2]" 1
86 1 12 VAL HB 1 19 PHE H . . 4.870 4.889 4.813 5.001 0.131 6 0 "[ . 1 . 2]" 1
87 1 12 VAL HB 1 19 PHE QB . . 4.840 4.508 4.439 4.534 . 0 0 "[ . 1 . 2]" 1
88 1 12 VAL QG 1 13 SER H . . 4.630 3.020 2.980 3.052 . 0 0 "[ . 1 . 2]" 1
89 1 12 VAL QG 1 14 TYR H . . 4.960 3.854 3.518 3.965 . 0 0 "[ . 1 . 2]" 1
90 1 12 VAL QG 1 18 ARG HG3 . . 4.390 4.136 3.825 4.282 . 0 0 "[ . 1 . 2]" 1
91 1 12 VAL QG 1 19 PHE H . . 4.320 2.200 2.094 2.581 . 0 0 "[ . 1 . 2]" 1
92 1 12 VAL QG 1 19 PHE QB . . 3.880 1.878 1.851 1.927 . 0 0 "[ . 1 . 2]" 1
93 1 12 VAL QG 1 20 LEU HA . . 5.040 3.451 3.299 3.743 . 0 0 "[ . 1 . 2]" 1
94 1 12 VAL QG 1 21 ILE H . . 4.020 3.476 3.337 3.772 . 0 0 "[ . 1 . 2]" 1
95 1 12 VAL QG 1 21 ILE MD . . 3.360 1.901 1.819 1.991 . 0 0 "[ . 1 . 2]" 1
96 1 12 VAL QG 1 21 ILE QG . . 4.470 3.573 3.466 3.716 . 0 0 "[ . 1 . 2]" 1
97 1 12 VAL MG1 1 19 PHE QB . . 4.530 1.883 1.855 1.932 . 0 0 "[ . 1 . 2]" 1
98 1 12 VAL MG2 1 19 PHE QB . . 4.530 3.778 3.690 3.909 . 0 0 "[ . 1 . 2]" 1
99 1 13 SER H 1 14 TYR H . . 5.430 4.434 4.307 4.471 . 0 0 "[ . 1 . 2]" 1
100 1 13 SER H 1 19 PHE H . . 4.990 4.864 4.527 5.012 0.022 11 0 "[ . 1 . 2]" 1
101 1 13 SER HA 1 14 TYR H . . 3.150 2.142 2.139 2.166 . 0 0 "[ . 1 . 2]" 1
102 1 13 SER HA 1 18 ARG HA . . 4.160 2.067 1.897 2.175 . 0 0 "[ . 1 . 2]" 1
103 1 13 SER HA 1 18 ARG QB . . 5.150 3.102 2.684 3.214 . 0 0 "[ . 1 . 2]" 1
104 1 13 SER HA 1 18 ARG HG2 . . 4.860 3.794 3.570 4.175 . 0 0 "[ . 1 . 2]" 1
105 1 13 SER HA 1 19 PHE H . . 4.160 3.603 3.175 3.714 . 0 0 "[ . 1 . 2]" 1
106 1 13 SER HB2 1 14 TYR H . . 4.000 3.634 3.465 4.029 0.029 6 0 "[ . 1 . 2]" 1
107 1 13 SER HB2 1 18 ARG HG2 . . 5.480 4.337 4.053 4.553 . 0 0 "[ . 1 . 2]" 1
108 1 13 SER HB2 1 18 ARG HG3 . . 5.610 2.785 2.507 3.108 . 0 0 "[ . 1 . 2]" 1
109 1 13 SER HB2 1 19 PHE H . . 5.730 5.606 5.227 5.739 0.009 7 0 "[ . 1 . 2]" 1
110 1 13 SER HB3 1 14 TYR H . . 4.680 4.510 4.447 4.631 . 0 0 "[ . 1 . 2]" 1
111 1 13 SER HB3 1 18 ARG HG2 . . 5.490 4.480 4.097 5.069 . 0 0 "[ . 1 . 2]" 1
112 1 13 SER HB3 1 18 ARG HG3 . . 5.230 2.985 2.651 3.484 . 0 0 "[ . 1 . 2]" 1
113 1 14 TYR H 1 14 TYR HB2 . . 4.040 2.333 2.145 2.405 . 0 0 "[ . 1 . 2]" 1
114 1 14 TYR H 1 14 TYR HB3 . . 4.040 3.041 2.983 3.177 . 0 0 "[ . 1 . 2]" 1
115 1 14 TYR H 1 14 TYR HD2 . . 5.350 5.216 4.586 5.312 . 0 0 "[ . 1 . 2]" 1
116 1 14 TYR H 1 17 MET H . . 4.000 3.060 2.927 3.930 . 0 0 "[ . 1 . 2]" 1
117 1 14 TYR H 1 17 MET QB . . 4.490 3.645 3.301 5.034 0.544 6 1 "[ .+ 1 . 2]" 1
118 1 14 TYR H 1 18 ARG H . . 5.000 4.311 4.195 4.481 . 0 0 "[ . 1 . 2]" 1
119 1 14 TYR H 1 18 ARG HA . . 3.900 2.861 2.064 3.000 . 0 0 "[ . 1 . 2]" 1
120 1 14 TYR H 1 18 ARG QB . . 4.890 3.976 3.832 4.078 . 0 0 "[ . 1 . 2]" 1
121 1 14 TYR H 1 18 ARG HG3 . . 4.690 4.085 3.736 4.471 . 0 0 "[ . 1 . 2]" 1
122 1 14 TYR H 1 19 PHE H . . 4.600 4.402 3.380 4.608 0.008 16 0 "[ . 1 . 2]" 1
123 1 14 TYR HA 1 14 TYR HD2 . . 4.500 4.217 4.072 4.370 . 0 0 "[ . 1 . 2]" 1
124 1 14 TYR HA 1 14 TYR HE2 . . 5.740 5.610 5.498 5.733 . 0 0 "[ . 1 . 2]" 1
125 1 14 TYR QB 1 14 TYR HE2 . . 4.700 4.326 4.309 4.340 . 0 0 "[ . 1 . 2]" 1
126 1 14 TYR QB 1 16 HIS H . . 4.350 2.726 2.059 2.880 . 0 0 "[ . 1 . 2]" 1
127 1 14 TYR QB 1 17 MET H . . 4.030 2.723 2.150 2.985 . 0 0 "[ . 1 . 2]" 1
128 1 14 TYR QB 1 17 MET QB . . 4.890 2.683 2.316 3.750 . 0 0 "[ . 1 . 2]" 1
129 1 14 TYR HB2 1 15 LYS HG2 . . 4.710 4.455 4.279 4.990 0.280 6 0 "[ . 1 . 2]" 1
130 1 14 TYR HB3 1 15 LYS HG2 . . 4.710 2.756 2.544 3.492 . 0 0 "[ . 1 . 2]" 1
131 1 15 LYS H 1 15 LYS HG2 . . 5.540 2.048 1.929 2.120 . 0 0 "[ . 1 . 2]" 1
132 1 15 LYS HA 1 15 LYS QE . . 5.670 4.522 4.035 5.103 . 0 0 "[ . 1 . 2]" 1
133 1 15 LYS QB 1 15 LYS QE . . 3.700 2.314 2.071 2.828 . 0 0 "[ . 1 . 2]" 1
134 1 15 LYS QE 1 122 SER H . . 6.000 5.756 5.157 6.048 0.048 8 0 "[ . 1 . 2]" 1
135 1 15 LYS HG3 1 16 HIS HD2 . . 5.540 4.737 3.498 5.654 0.114 8 0 "[ . 1 . 2]" 1
136 1 16 HIS H 1 16 HIS HD2 . . 5.180 4.889 4.657 5.304 0.124 8 0 "[ . 1 . 2]" 1
137 1 16 HIS QB 1 17 MET H . . 4.030 3.759 2.731 3.895 . 0 0 "[ . 1 . 2]" 1
138 1 16 HIS HB2 1 17 MET H . . 4.600 4.310 3.852 4.598 . 0 0 "[ . 1 . 2]" 1
139 1 16 HIS HB3 1 17 MET H . . 4.600 4.180 2.794 4.392 . 0 0 "[ . 1 . 2]" 1
140 1 17 MET H 1 17 MET HB2 . . 4.110 3.254 2.926 4.009 . 0 0 "[ . 1 . 2]" 1
141 1 17 MET H 1 17 MET QB . . 3.430 2.943 2.745 3.192 . 0 0 "[ . 1 . 2]" 1
142 1 17 MET H 1 17 MET HB3 . . 4.110 3.706 2.911 3.967 . 0 0 "[ . 1 . 2]" 1
143 1 17 MET H 1 17 MET QG . . 3.510 2.848 2.408 4.154 0.644 6 1 "[ .+ 1 . 2]" 1
144 1 17 MET H 1 18 ARG H . . 4.560 4.393 4.327 4.414 . 0 0 "[ . 1 . 2]" 1
145 1 17 MET H 1 18 ARG HA . . 5.120 4.829 4.673 4.887 . 0 0 "[ . 1 . 2]" 1
146 1 17 MET HA 1 18 ARG H . . 3.410 2.522 2.257 2.599 . 0 0 "[ . 1 . 2]" 1
147 1 17 MET QB 1 18 ARG H . . 3.660 2.390 2.152 3.518 . 0 0 "[ . 1 . 2]" 1
148 1 17 MET QB 1 19 PHE H . . 5.810 4.870 4.329 5.835 0.025 6 0 "[ . 1 . 2]" 1
149 1 17 MET HB2 1 18 ARG H . . 4.170 2.966 2.595 4.001 . 0 0 "[ . 1 . 2]" 1
150 1 17 MET HB3 1 18 ARG H . . 4.170 2.740 2.208 3.946 . 0 0 "[ . 1 . 2]" 1
151 1 17 MET QG 1 92 PHE HB2 . . 5.920 5.036 3.351 6.054 0.134 16 0 "[ . 1 . 2]" 1
152 1 18 ARG H 1 18 ARG QD . . 5.810 5.264 4.434 5.435 . 0 0 "[ . 1 . 2]" 1
153 1 18 ARG H 1 18 ARG HG2 . . 5.130 4.839 4.515 4.898 . 0 0 "[ . 1 . 2]" 1
154 1 18 ARG H 1 18 ARG HG3 . . 4.870 4.682 4.476 4.741 . 0 0 "[ . 1 . 2]" 1
155 1 18 ARG H 1 19 PHE H . . 4.670 3.957 3.739 4.580 . 0 0 "[ . 1 . 2]" 1
156 1 18 ARG H 1 99 CYS HA . . 4.690 3.949 3.655 4.082 . 0 0 "[ . 1 . 2]" 1
157 1 18 ARG H 1 100 VAL H . . 5.450 4.532 4.410 4.949 . 0 0 "[ . 1 . 2]" 1
158 1 18 ARG HA 1 18 ARG HD2 . . 4.760 4.521 4.059 4.720 . 0 0 "[ . 1 . 2]" 1
159 1 18 ARG HA 1 18 ARG QD . . 4.180 4.013 3.706 4.127 . 0 0 "[ . 1 . 2]" 1
160 1 18 ARG HA 1 18 ARG HD3 . . 4.760 4.523 3.959 4.842 0.082 6 0 "[ . 1 . 2]" 1
161 1 18 ARG HA 1 19 PHE H . . 3.450 2.150 2.140 2.224 . 0 0 "[ . 1 . 2]" 1
162 1 18 ARG QB 1 19 PHE H . . 4.260 3.791 3.559 3.926 . 0 0 "[ . 1 . 2]" 1
163 1 18 ARG QB 1 99 CYS HA . . 4.570 2.389 2.248 2.732 . 0 0 "[ . 1 . 2]" 1
164 1 18 ARG QB 1 99 CYS QB . . 4.780 3.410 3.169 3.766 . 0 0 "[ . 1 . 2]" 1
165 1 18 ARG QB 1 100 VAL H . . 4.730 3.867 3.750 4.162 . 0 0 "[ . 1 . 2]" 1
166 1 18 ARG QB 1 100 VAL QG . . 3.930 3.878 3.791 4.229 0.299 6 0 "[ . 1 . 2]" 1
167 1 18 ARG QD 1 19 PHE H . . 5.750 5.041 4.470 5.255 . 0 0 "[ . 1 . 2]" 1
168 1 18 ARG HG3 1 19 PHE H . . 4.470 3.377 2.602 3.637 . 0 0 "[ . 1 . 2]" 1
169 1 19 PHE H 1 19 PHE HD2 . . 5.550 5.328 5.213 5.432 . 0 0 "[ . 1 . 2]" 1
170 1 19 PHE H 1 20 LEU H . . 4.670 4.486 4.470 4.493 . 0 0 "[ . 1 . 2]" 1
171 1 19 PHE H 1 20 LEU HA . . 5.110 4.989 4.904 5.070 . 0 0 "[ . 1 . 2]" 1
172 1 19 PHE H 1 20 LEU HB2 . . 6.000 5.858 5.757 5.936 . 0 0 "[ . 1 . 2]" 1
173 1 19 PHE H 1 21 ILE MD . . 4.910 4.658 4.601 4.741 . 0 0 "[ . 1 . 2]" 1
174 1 19 PHE HA 1 19 PHE HE2 . . 5.500 5.458 5.316 5.609 0.109 11 0 "[ . 1 . 2]" 1
175 1 19 PHE HA 1 20 LEU HB2 . . 4.960 3.952 3.924 3.968 . 0 0 "[ . 1 . 2]" 1
176 1 19 PHE HA 1 21 ILE MD . . 5.280 5.111 5.022 5.178 . 0 0 "[ . 1 . 2]" 1
177 1 19 PHE HA 1 100 VAL H . . 4.030 1.940 1.798 2.089 . 0 0 "[ . 1 . 2]" 1
178 1 19 PHE HA 1 100 VAL HB . . 5.220 3.535 3.100 4.057 . 0 0 "[ . 1 . 2]" 1
179 1 19 PHE HA 1 100 VAL QG . . 4.890 1.812 1.618 2.064 . 0 0 "[ . 1 . 2]" 1
180 1 19 PHE HA 1 101 ALA HA . . 5.210 4.618 4.549 4.680 . 0 0 "[ . 1 . 2]" 1
181 1 19 PHE QB 1 19 PHE HE2 . . 4.780 4.311 4.300 4.324 . 0 0 "[ . 1 . 2]" 1
182 1 19 PHE QB 1 20 LEU H . . 4.390 2.213 2.073 2.336 . 0 0 "[ . 1 . 2]" 1
183 1 19 PHE QB 1 21 ILE MD . . 4.330 3.183 3.113 3.257 . 0 0 "[ . 1 . 2]" 1
184 1 19 PHE QB 1 100 VAL H . . 4.940 4.110 3.989 4.235 . 0 0 "[ . 1 . 2]" 1
185 1 19 PHE QB 1 100 VAL HB . . 4.240 4.224 3.634 5.016 0.776 10 8 "[ - * * +** . **2]" 1
186 1 19 PHE QB 1 102 VAL H . . 5.040 4.246 4.064 4.458 . 0 0 "[ . 1 . 2]" 1
187 1 19 PHE HD2 1 20 LEU H . . 5.060 3.888 3.710 4.053 . 0 0 "[ . 1 . 2]" 1
188 1 19 PHE HD2 1 100 VAL HB . . 4.850 3.716 2.747 5.002 0.152 10 0 "[ . 1 . 2]" 1
189 1 19 PHE HE2 1 20 LEU H . . 6.000 6.104 5.932 6.262 0.262 3 0 "[ . 1 . 2]" 1
190 1 20 LEU H 1 20 LEU QD . . 5.110 3.432 3.399 3.494 . 0 0 "[ . 1 . 2]" 1
191 1 20 LEU H 1 20 LEU HG . . 5.100 4.923 4.887 4.981 . 0 0 "[ . 1 . 2]" 1
192 1 20 LEU H 1 100 VAL H . . 4.360 3.668 3.458 3.900 . 0 0 "[ . 1 . 2]" 1
193 1 20 LEU H 1 101 ALA H . . 5.240 4.437 4.305 4.561 . 0 0 "[ . 1 . 2]" 1
194 1 20 LEU H 1 101 ALA HA . . 4.110 2.732 2.639 2.826 . 0 0 "[ . 1 . 2]" 1
195 1 20 LEU H 1 101 ALA MB . . 4.490 4.298 4.214 4.395 . 0 0 "[ . 1 . 2]" 1
196 1 20 LEU H 1 102 VAL H . . 4.500 3.111 2.954 3.258 . 0 0 "[ . 1 . 2]" 1
197 1 20 LEU HA 1 20 LEU QD . . 4.260 1.922 1.878 1.941 . 0 0 "[ . 1 . 2]" 1
198 1 20 LEU HA 1 21 ILE HB . . 5.850 5.623 5.592 5.661 . 0 0 "[ . 1 . 2]" 1
199 1 20 LEU HA 1 21 ILE MD . . 5.030 3.106 3.079 3.126 . 0 0 "[ . 1 . 2]" 1
200 1 20 LEU HA 1 21 ILE QG . . 5.470 3.677 3.615 3.771 . 0 0 "[ . 1 . 2]" 1
201 1 20 LEU HB2 1 21 ILE H . . 5.550 4.602 4.592 4.611 . 0 0 "[ . 1 . 2]" 1
202 1 20 LEU HB2 1 100 VAL H . . 4.250 3.951 3.859 4.116 . 0 0 "[ . 1 . 2]" 1
203 1 20 LEU HB2 1 101 ALA H . . 4.860 4.071 3.923 4.269 . 0 0 "[ . 1 . 2]" 1
204 1 20 LEU HB2 1 101 ALA HA . . 4.590 2.368 2.258 2.489 . 0 0 "[ . 1 . 2]" 1
205 1 20 LEU HB2 1 101 ALA MB . . 4.200 3.193 3.114 3.293 . 0 0 "[ . 1 . 2]" 1
206 1 20 LEU HB2 1 102 VAL H . . 5.020 4.038 3.851 4.211 . 0 0 "[ . 1 . 2]" 1
207 1 20 LEU HB3 1 21 ILE H . . 4.630 3.908 3.871 3.935 . 0 0 "[ . 1 . 2]" 1
208 1 20 LEU HB3 1 42 ALA MB . . 4.000 4.009 3.872 4.107 0.107 10 0 "[ . 1 . 2]" 1
209 1 20 LEU HB3 1 101 ALA HA . . 4.560 2.492 2.416 2.552 . 0 0 "[ . 1 . 2]" 1
210 1 20 LEU HB3 1 102 VAL H . . 4.660 3.634 3.504 3.758 . 0 0 "[ . 1 . 2]" 1
211 1 20 LEU QD 1 21 ILE H . . 4.460 2.710 2.671 2.779 . 0 0 "[ . 1 . 2]" 1
212 1 20 LEU QD 1 37 LEU HA . . 5.920 4.138 4.080 4.229 . 0 0 "[ . 1 . 2]" 1
213 1 20 LEU QD 1 40 TYR HB2 . . 5.590 3.402 3.248 3.524 . 0 0 "[ . 1 . 2]" 1
214 1 20 LEU QD 1 40 TYR HB3 . . 4.840 2.477 2.256 2.657 . 0 0 "[ . 1 . 2]" 1
215 1 20 LEU QD 1 40 TYR QD . . 4.430 2.085 1.951 2.247 . 0 0 "[ . 1 . 2]" 1
216 1 20 LEU QD 1 40 TYR QE . . 4.720 2.968 2.783 3.101 . 0 0 "[ . 1 . 2]" 1
217 1 20 LEU QD 1 42 ALA MB . . 5.230 2.696 2.648 2.744 . 0 0 "[ . 1 . 2]" 1
218 1 20 LEU QD 1 99 CYS QB . . 5.730 2.045 1.886 2.258 . 0 0 "[ . 1 . 2]" 1
219 1 20 LEU QD 1 101 ALA HA . . 5.270 3.878 3.818 3.936 . 0 0 "[ . 1 . 2]" 1
220 1 20 LEU QD 1 101 ALA MB . . 5.100 3.929 3.848 3.997 . 0 0 "[ . 1 . 2]" 1
221 1 20 LEU QD 1 102 VAL H . . 5.660 4.689 4.596 4.753 . 0 0 "[ . 1 . 2]" 1
222 1 20 LEU HG 1 21 ILE H . . 5.230 5.270 5.239 5.311 0.081 8 0 "[ . 1 . 2]" 1
223 1 20 LEU HG 1 37 LEU HA . . 3.960 3.588 3.508 3.722 . 0 0 "[ . 1 . 2]" 1
224 1 20 LEU HG 1 37 LEU HB2 . . 4.840 4.914 4.853 4.981 0.141 14 0 "[ . 1 . 2]" 1
225 1 20 LEU HG 1 40 TYR H . . 5.580 5.371 5.246 5.473 . 0 0 "[ . 1 . 2]" 1
226 1 20 LEU HG 1 40 TYR HA . . 5.910 5.594 5.443 5.690 . 0 0 "[ . 1 . 2]" 1
227 1 20 LEU HG 1 40 TYR HB2 . . 4.560 3.260 3.131 3.363 . 0 0 "[ . 1 . 2]" 1
228 1 20 LEU HG 1 40 TYR HB3 . . 4.620 3.106 2.972 3.194 . 0 0 "[ . 1 . 2]" 1
229 1 20 LEU HG 1 40 TYR QD . . 4.190 3.439 3.203 3.574 . 0 0 "[ . 1 . 2]" 1
230 1 20 LEU HG 1 40 TYR QE . . 5.030 4.760 4.639 4.923 . 0 0 "[ . 1 . 2]" 1
231 1 20 LEU HG 1 42 ALA MB . . 4.410 3.330 3.175 3.423 . 0 0 "[ . 1 . 2]" 1
232 1 20 LEU HG 1 99 CYS QB . . 5.100 4.060 3.863 4.253 . 0 0 "[ . 1 . 2]" 1
233 1 20 LEU HG 1 101 ALA HA . . 5.070 4.360 4.255 4.463 . 0 0 "[ . 1 . 2]" 1
234 1 20 LEU HG 1 101 ALA MB . . 4.080 4.010 3.882 4.095 0.015 11 0 "[ . 1 . 2]" 1
235 1 20 LEU HG 1 102 VAL H . . 6.000 5.931 5.781 6.075 0.075 17 0 "[ . 1 . 2]" 1
236 1 21 ILE H 1 21 ILE MD . . 4.300 1.989 1.932 2.071 . 0 0 "[ . 1 . 2]" 1
237 1 21 ILE H 1 21 ILE QG . . 4.530 1.790 1.729 1.870 . 0 0 "[ . 1 . 2]" 1
238 1 21 ILE H 1 21 ILE MG . . 4.680 3.124 3.062 3.225 . 0 0 "[ . 1 . 2]" 1
239 1 21 ILE H 1 101 ALA HA . . 5.290 5.189 5.053 5.283 . 0 0 "[ . 1 . 2]" 1
240 1 21 ILE HA 1 21 ILE MD . . 4.500 3.243 3.170 3.330 . 0 0 "[ . 1 . 2]" 1
241 1 21 ILE HA 1 102 VAL H . . 4.690 3.334 3.173 3.420 . 0 0 "[ . 1 . 2]" 1
242 1 21 ILE HA 1 102 VAL QG . . 4.660 2.713 2.394 3.542 . 0 0 "[ . 1 . 2]" 1
243 1 21 ILE HB 1 21 ILE MD . . 3.720 3.183 3.177 3.190 . 0 0 "[ . 1 . 2]" 1
244 1 21 ILE MD 1 21 ILE MG . . 3.310 1.869 1.838 1.897 . 0 0 "[ . 1 . 2]" 1
245 1 21 ILE MG 1 107 GLY HA2 . . 6.000 5.325 4.493 5.860 . 0 0 "[ . 1 . 2]" 1
246 1 21 ILE MG 1 107 GLY QA . . 5.130 4.994 4.309 5.337 0.207 8 0 "[ . 1 . 2]" 1
247 1 21 ILE MG 1 107 GLY HA3 . . 6.000 6.059 5.519 6.269 0.269 20 0 "[ . 1 . 2]" 1
248 1 26 THR H 1 26 THR MG . . 4.500 3.343 2.115 3.997 . 0 0 "[ . 1 . 2]" 1
249 1 28 ALA HA 1 29 THR MG . . 4.800 4.651 4.527 4.778 . 0 0 "[ . 1 . 2]" 1
250 1 28 ALA MB 1 29 THR H . . 4.240 2.956 2.229 3.266 . 0 0 "[ . 1 . 2]" 1
251 1 28 ALA MB 1 29 THR MG . . 4.050 3.125 2.580 3.489 . 0 0 "[ . 1 . 2]" 1
252 1 29 THR H 1 29 THR MG . . 3.920 2.028 1.894 2.268 . 0 0 "[ . 1 . 2]" 1
253 1 29 THR H 1 30 LEU H . . 4.210 1.894 1.656 2.662 . 0 0 "[ . 1 . 2]" 1
254 1 29 THR H 1 30 LEU HA . . 5.270 4.109 3.903 4.265 . 0 0 "[ . 1 . 2]" 1
255 1 29 THR H 1 30 LEU QD . . 5.920 4.699 3.734 5.344 . 0 0 "[ . 1 . 2]" 1
256 1 29 THR H 1 33 PHE QD . . 6.000 5.795 3.224 6.159 0.159 1 0 "[ . 1 . 2]" 1
257 1 29 THR HA 1 29 THR MG . . 3.630 3.169 3.126 3.200 . 0 0 "[ . 1 . 2]" 1
258 1 29 THR HB 1 30 LEU H . . 4.640 4.316 4.199 4.661 0.021 18 0 "[ . 1 . 2]" 1
259 1 29 THR MG 1 30 LEU H . . 4.420 2.563 2.252 3.877 . 0 0 "[ . 1 . 2]" 1
260 1 29 THR MG 1 31 SER H . . 5.280 2.681 1.795 4.607 . 0 0 "[ . 1 . 2]" 1
261 1 29 THR MG 1 32 THR H . . 4.880 2.799 1.965 4.822 . 0 0 "[ . 1 . 2]" 1
262 1 29 THR MG 1 32 THR HB . . 5.660 3.526 2.091 4.757 . 0 0 "[ . 1 . 2]" 1
263 1 29 THR MG 1 33 PHE H . . 4.910 3.498 2.917 4.121 . 0 0 "[ . 1 . 2]" 1
264 1 29 THR MG 1 33 PHE QB . . 5.710 3.968 3.151 4.812 . 0 0 "[ . 1 . 2]" 1
265 1 30 LEU H 1 30 LEU HB2 . . 4.160 3.099 2.334 3.185 . 0 0 "[ . 1 . 2]" 1
266 1 30 LEU H 1 30 LEU QB . . 3.610 2.959 2.225 3.049 . 0 0 "[ . 1 . 2]" 1
267 1 30 LEU H 1 30 LEU HB3 . . 4.160 3.757 2.805 4.034 . 0 0 "[ . 1 . 2]" 1
268 1 30 LEU H 1 30 LEU MD1 . . 5.050 3.589 2.670 4.584 . 0 0 "[ . 1 . 2]" 1
269 1 30 LEU H 1 30 LEU QD . . 4.330 3.485 2.653 4.163 . 0 0 "[ . 1 . 2]" 1
270 1 30 LEU H 1 30 LEU MD2 . . 5.050 4.902 4.309 5.025 . 0 0 "[ . 1 . 2]" 1
271 1 30 LEU H 1 30 LEU HG . . 4.940 4.734 4.540 4.884 . 0 0 "[ . 1 . 2]" 1
272 1 30 LEU H 1 31 SER H . . 5.430 2.930 2.524 3.634 . 0 0 "[ . 1 . 2]" 1
273 1 30 LEU HA 1 30 LEU MD1 . . 4.320 2.183 1.950 3.286 . 0 0 "[ . 1 . 2]" 1
274 1 30 LEU HA 1 30 LEU QD . . 3.790 2.159 1.945 3.049 . 0 0 "[ . 1 . 2]" 1
275 1 30 LEU HA 1 30 LEU MD2 . . 4.320 3.814 3.610 3.873 . 0 0 "[ . 1 . 2]" 1
276 1 30 LEU HA 1 33 PHE H . . 5.060 3.502 3.298 3.732 . 0 0 "[ . 1 . 2]" 1
277 1 30 LEU HA 1 33 PHE HB2 . . 4.970 3.327 2.253 3.613 . 0 0 "[ . 1 . 2]" 1
278 1 30 LEU HA 1 33 PHE QB . . 4.270 2.079 1.886 2.238 . 0 0 "[ . 1 . 2]" 1
279 1 30 LEU HA 1 33 PHE HB3 . . 4.970 2.179 1.925 3.840 . 0 0 "[ . 1 . 2]" 1
280 1 30 LEU HA 1 33 PHE QD . . 5.430 2.552 1.951 3.763 . 0 0 "[ . 1 . 2]" 1
281 1 30 LEU HA 1 34 ILE H . . 4.640 3.735 3.075 3.991 . 0 0 "[ . 1 . 2]" 1
282 1 30 LEU HA 1 34 ILE QG . . 5.610 3.494 2.676 3.736 . 0 0 "[ . 1 . 2]" 1
283 1 30 LEU QB 1 34 ILE QG . . 5.040 4.016 2.799 4.494 . 0 0 "[ . 1 . 2]" 1
284 1 30 LEU QD 1 31 SER H . . 5.920 4.208 3.752 4.523 . 0 0 "[ . 1 . 2]" 1
285 1 30 LEU QD 1 33 PHE QB . . 4.680 3.140 2.232 3.785 . 0 0 "[ . 1 . 2]" 1
286 1 30 LEU QD 1 33 PHE QD . . 5.920 2.236 1.926 4.029 . 0 0 "[ . 1 . 2]" 1
287 1 30 LEU QD 1 34 ILE H . . 5.170 4.223 3.664 4.540 . 0 0 "[ . 1 . 2]" 1
288 1 30 LEU QD 1 34 ILE QG . . 4.380 3.060 2.747 3.418 . 0 0 "[ . 1 . 2]" 1
289 1 30 LEU QD 1 55 LYS HA . . 4.730 4.227 3.548 4.797 0.067 11 0 "[ . 1 . 2]" 1
290 1 30 LEU QD 1 57 PRO HA . . 5.710 5.250 4.662 5.633 . 0 0 "[ . 1 . 2]" 1
291 1 30 LEU QD 1 57 PRO HG2 . . 3.920 2.461 1.925 3.096 . 0 0 "[ . 1 . 2]" 1
292 1 30 LEU QD 1 58 LEU H . . 4.800 3.696 2.992 4.283 . 0 0 "[ . 1 . 2]" 1
293 1 30 LEU QD 1 58 LEU HB3 . . 5.360 4.027 3.299 4.602 . 0 0 "[ . 1 . 2]" 1
294 1 30 LEU QD 1 58 LEU MD1 . . 3.750 2.977 2.221 3.661 . 0 0 "[ . 1 . 2]" 1
295 1 30 LEU MD1 1 55 LYS HA . . 6.000 5.422 4.562 5.854 . 0 0 "[ . 1 . 2]" 1
296 1 30 LEU MD1 1 58 LEU H . . 5.670 5.033 3.879 5.445 . 0 0 "[ . 1 . 2]" 1
297 1 30 LEU MD2 1 55 LYS HA . . 6.000 4.497 3.590 6.012 0.012 14 0 "[ . 1 . 2]" 1
298 1 30 LEU MD2 1 58 LEU H . . 5.670 3.857 3.010 4.642 . 0 0 "[ . 1 . 2]" 1
299 1 30 LEU HG 1 33 PHE QB . . 4.830 3.886 3.282 4.326 . 0 0 "[ . 1 . 2]" 1
300 1 30 LEU HG 1 33 PHE QD . . 4.560 2.954 2.074 4.720 0.160 4 0 "[ . 1 . 2]" 1
301 1 30 LEU HG 1 34 ILE HA . . 6.000 5.367 4.513 5.970 . 0 0 "[ . 1 . 2]" 1
302 1 30 LEU HG 1 57 PRO HB3 . . 5.540 5.271 4.575 5.615 0.075 19 0 "[ . 1 . 2]" 1
303 1 30 LEU HG 1 57 PRO HG2 . . 5.310 3.686 3.404 3.946 . 0 0 "[ . 1 . 2]" 1
304 1 30 LEU HG 1 57 PRO HG3 . . 3.690 3.507 2.918 3.850 0.160 19 0 "[ . 1 . 2]" 1
305 1 30 LEU HG 1 58 LEU H . . 4.900 4.857 4.343 5.104 0.204 14 0 "[ . 1 . 2]" 1
306 1 31 SER H 1 32 THR H . . 4.280 2.824 2.503 3.109 . 0 0 "[ . 1 . 2]" 1
307 1 31 SER QB 1 32 THR H . . 3.980 2.285 2.046 2.632 . 0 0 "[ . 1 . 2]" 1
308 1 32 THR H 1 35 GLU H . . 5.190 5.070 4.879 5.249 0.059 19 0 "[ . 1 . 2]" 1
309 1 32 THR HA 1 32 THR MG . . 3.240 2.359 2.272 2.462 . 0 0 "[ . 1 . 2]" 1
310 1 32 THR HA 1 35 GLU H . . 4.170 3.349 3.180 3.493 . 0 0 "[ . 1 . 2]" 1
311 1 32 THR HA 1 35 GLU QB . . 4.100 2.894 2.659 3.117 . 0 0 "[ . 1 . 2]" 1
312 1 32 THR HA 1 35 GLU HG2 . . 4.720 3.635 3.463 3.772 . 0 0 "[ . 1 . 2]" 1
313 1 32 THR HA 1 35 GLU HG3 . . 3.870 2.079 1.981 2.231 . 0 0 "[ . 1 . 2]" 1
314 1 32 THR HB 1 33 PHE H . . 4.550 2.944 2.577 3.232 . 0 0 "[ . 1 . 2]" 1
315 1 32 THR HB 1 34 ILE H . . 5.710 5.484 5.170 5.705 . 0 0 "[ . 1 . 2]" 1
316 1 32 THR MG 1 33 PHE H . . 5.120 3.756 3.311 3.967 . 0 0 "[ . 1 . 2]" 1
317 1 32 THR MG 1 35 GLU QB . . 4.860 2.985 2.332 3.393 . 0 0 "[ . 1 . 2]" 1
318 1 32 THR MG 1 35 GLU HG3 . . 3.780 3.580 3.211 3.808 0.028 7 0 "[ . 1 . 2]" 1
319 1 32 THR MG 1 36 ASP H . . 4.940 3.696 3.306 4.017 . 0 0 "[ . 1 . 2]" 1
320 1 33 PHE H 1 33 PHE QD . . 4.910 3.956 2.105 4.177 . 0 0 "[ . 1 . 2]" 1
321 1 33 PHE H 1 34 ILE H . . 4.260 2.856 2.775 2.970 . 0 0 "[ . 1 . 2]" 1
322 1 33 PHE H 1 34 ILE HB . . 5.760 5.113 5.016 5.277 . 0 0 "[ . 1 . 2]" 1
323 1 33 PHE H 1 34 ILE QG . . 5.020 4.204 4.049 4.326 . 0 0 "[ . 1 . 2]" 1
324 1 33 PHE H 1 35 GLU QB . . 5.810 5.190 4.984 5.414 . 0 0 "[ . 1 . 2]" 1
325 1 33 PHE HA 1 33 PHE QD . . 4.460 2.717 2.469 3.276 . 0 0 "[ . 1 . 2]" 1
326 1 33 PHE HA 1 34 ILE QG . . 5.300 4.992 4.887 5.122 . 0 0 "[ . 1 . 2]" 1
327 1 33 PHE HA 1 36 ASP QB . . 4.830 2.768 2.496 3.173 . 0 0 "[ . 1 . 2]" 1
328 1 33 PHE HA 1 37 LEU MD2 . . 5.690 4.751 4.629 4.870 . 0 0 "[ . 1 . 2]" 1
329 1 33 PHE QB 1 34 ILE H . . 4.170 2.540 2.125 3.037 . 0 0 "[ . 1 . 2]" 1
330 1 33 PHE QB 1 34 ILE QG . . 4.710 3.233 2.889 3.675 . 0 0 "[ . 1 . 2]" 1
331 1 33 PHE HB2 1 34 ILE H . . 5.050 3.839 2.145 4.087 . 0 0 "[ . 1 . 2]" 1
332 1 33 PHE HB3 1 34 ILE H . . 5.050 2.641 2.333 3.453 . 0 0 "[ . 1 . 2]" 1
333 1 33 PHE QD 1 34 ILE H . . 4.480 3.074 2.574 3.422 . 0 0 "[ . 1 . 2]" 1
334 1 33 PHE QD 1 34 ILE QG . . 4.400 2.648 2.117 4.000 . 0 0 "[ . 1 . 2]" 1
335 1 34 ILE H 1 34 ILE HB . . 3.550 2.654 2.621 2.696 . 0 0 "[ . 1 . 2]" 1
336 1 34 ILE H 1 34 ILE QG . . 3.460 1.862 1.776 1.920 . 0 0 "[ . 1 . 2]" 1
337 1 34 ILE H 1 34 ILE MG . . 3.990 3.760 3.754 3.763 . 0 0 "[ . 1 . 2]" 1
338 1 34 ILE H 1 35 GLU H . . 3.980 2.733 2.677 2.782 . 0 0 "[ . 1 . 2]" 1
339 1 34 ILE H 1 35 GLU HA . . 5.580 5.329 5.286 5.370 . 0 0 "[ . 1 . 2]" 1
340 1 34 ILE H 1 35 GLU HG2 . . 5.260 4.434 4.372 4.523 . 0 0 "[ . 1 . 2]" 1
341 1 34 ILE H 1 37 LEU H . . 5.210 5.103 5.022 5.154 . 0 0 "[ . 1 . 2]" 1
342 1 34 ILE H 1 37 LEU MD2 . . 5.220 4.160 4.018 4.380 . 0 0 "[ . 1 . 2]" 1
343 1 34 ILE HA 1 34 ILE QG . . 3.630 2.572 2.431 2.973 . 0 0 "[ . 1 . 2]" 1
344 1 34 ILE HA 1 36 ASP H . . 5.090 4.228 4.119 4.308 . 0 0 "[ . 1 . 2]" 1
345 1 34 ILE HA 1 37 LEU H . . 4.610 3.670 3.578 3.743 . 0 0 "[ . 1 . 2]" 1
346 1 34 ILE HA 1 37 LEU HB2 . . 5.540 5.161 5.027 5.329 . 0 0 "[ . 1 . 2]" 1
347 1 34 ILE HA 1 37 LEU HB3 . . 6.000 4.497 4.180 4.614 . 0 0 "[ . 1 . 2]" 1
348 1 34 ILE HA 1 37 LEU MD1 . . 5.040 3.258 2.981 3.624 . 0 0 "[ . 1 . 2]" 1
349 1 34 ILE HA 1 37 LEU MD2 . . 4.120 2.166 1.992 2.418 . 0 0 "[ . 1 . 2]" 1
350 1 34 ILE HA 1 38 LYS H . . 5.210 4.232 4.124 4.316 . 0 0 "[ . 1 . 2]" 1
351 1 34 ILE HA 1 38 LYS HB2 . . 5.020 4.769 4.700 4.823 . 0 0 "[ . 1 . 2]" 1
352 1 34 ILE HA 1 58 LEU HB3 . . 6.000 4.715 4.620 4.884 . 0 0 "[ . 1 . 2]" 1
353 1 34 ILE HA 1 63 ILE MD . . 4.770 3.991 3.738 4.227 . 0 0 "[ . 1 . 2]" 1
354 1 34 ILE HB 1 35 GLU H . . 3.410 2.647 2.527 2.802 . 0 0 "[ . 1 . 2]" 1
355 1 34 ILE HB 1 35 GLU HA . . 4.700 4.170 4.107 4.269 . 0 0 "[ . 1 . 2]" 1
356 1 34 ILE HB 1 37 LEU MD2 . . 5.230 4.789 4.619 4.949 . 0 0 "[ . 1 . 2]" 1
357 1 34 ILE QG 1 34 ILE MG . . 2.790 2.198 2.081 2.306 . 0 0 "[ . 1 . 2]" 1
358 1 34 ILE QG 1 35 GLU H . . 4.330 3.916 3.813 3.995 . 0 0 "[ . 1 . 2]" 1
359 1 34 ILE QG 1 35 GLU HG2 . . 5.470 4.971 4.722 5.094 . 0 0 "[ . 1 . 2]" 1
360 1 34 ILE QG 1 36 ASP H . . 6.000 5.426 5.277 5.563 . 0 0 "[ . 1 . 2]" 1
361 1 34 ILE QG 1 37 LEU H . . 6.000 5.669 5.542 5.988 . 0 0 "[ . 1 . 2]" 1
362 1 34 ILE QG 1 37 LEU MD2 . . 4.060 3.483 3.176 4.038 . 0 0 "[ . 1 . 2]" 1
363 1 34 ILE QG 1 37 LEU HG . . 5.380 4.618 4.422 5.046 . 0 0 "[ . 1 . 2]" 1
364 1 34 ILE QG 1 38 LYS QE . . 4.650 4.612 4.425 4.665 0.015 14 0 "[ . 1 . 2]" 1
365 1 34 ILE QG 1 57 PRO HB2 . . 3.820 3.520 2.789 3.943 0.123 4 0 "[ . 1 . 2]" 1
366 1 34 ILE QG 1 57 PRO HG2 . . 5.670 3.607 3.360 3.759 . 0 0 "[ . 1 . 2]" 1
367 1 34 ILE QG 1 57 PRO HG3 . . 5.890 4.186 3.788 4.426 . 0 0 "[ . 1 . 2]" 1
368 1 34 ILE QG 1 58 LEU H . . 4.070 3.653 3.522 3.843 . 0 0 "[ . 1 . 2]" 1
369 1 34 ILE QG 1 58 LEU HA . . 4.310 4.091 3.728 4.411 0.101 4 0 "[ . 1 . 2]" 1
370 1 34 ILE QG 1 58 LEU HB3 . . 4.950 2.930 2.619 3.647 . 0 0 "[ . 1 . 2]" 1
371 1 34 ILE QG 1 61 ASP QB . . 5.600 5.179 4.917 5.499 . 0 0 "[ . 1 . 2]" 1
372 1 34 ILE QG 1 63 ILE MD . . 4.370 4.162 3.783 4.427 0.057 8 0 "[ . 1 . 2]" 1
373 1 34 ILE MG 1 35 GLU H . . 4.070 3.646 3.584 3.718 . 0 0 "[ . 1 . 2]" 1
374 1 34 ILE MG 1 35 GLU HA . . 3.990 3.755 3.682 3.824 . 0 0 "[ . 1 . 2]" 1
375 1 34 ILE MG 1 36 ASP H . . 5.210 4.994 4.930 5.072 . 0 0 "[ . 1 . 2]" 1
376 1 34 ILE MG 1 37 LEU H . . 4.790 4.739 4.691 4.794 0.004 18 0 "[ . 1 . 2]" 1
377 1 34 ILE MG 1 37 LEU MD1 . . 4.210 2.741 2.488 3.128 . 0 0 "[ . 1 . 2]" 1
378 1 34 ILE MG 1 38 LYS H . . 4.640 4.120 4.001 4.196 . 0 0 "[ . 1 . 2]" 1
379 1 34 ILE MG 1 38 LYS QE . . 3.620 1.908 1.860 2.001 . 0 0 "[ . 1 . 2]" 1
380 1 34 ILE MG 1 38 LYS HG3 . . 3.520 2.193 2.064 2.262 . 0 0 "[ . 1 . 2]" 1
381 1 34 ILE MG 1 39 LYS H . . 5.790 5.767 5.656 5.815 0.025 11 0 "[ . 1 . 2]" 1
382 1 34 ILE MG 1 58 LEU HA . . 3.970 2.829 2.730 2.980 . 0 0 "[ . 1 . 2]" 1
383 1 34 ILE MG 1 58 LEU HB2 . . 4.880 3.755 3.615 3.985 . 0 0 "[ . 1 . 2]" 1
384 1 34 ILE MG 1 61 ASP QB . . 4.710 3.280 3.132 3.461 . 0 0 "[ . 1 . 2]" 1
385 1 34 ILE MG 1 63 ILE MD . . 3.010 2.377 2.157 2.553 . 0 0 "[ . 1 . 2]" 1
386 1 35 GLU H 1 35 GLU HG2 . . 3.880 2.186 2.159 2.249 . 0 0 "[ . 1 . 2]" 1
387 1 35 GLU H 1 35 GLU HG3 . . 3.380 2.633 2.547 2.765 . 0 0 "[ . 1 . 2]" 1
388 1 35 GLU H 1 36 ASP H . . 3.800 2.585 2.480 2.631 . 0 0 "[ . 1 . 2]" 1
389 1 35 GLU H 1 36 ASP HA . . 5.480 5.193 5.103 5.235 . 0 0 "[ . 1 . 2]" 1
390 1 35 GLU H 1 36 ASP QB . . 5.210 4.391 4.251 4.841 . 0 0 "[ . 1 . 2]" 1
391 1 35 GLU H 1 38 LYS H . . 5.300 4.623 4.582 4.657 . 0 0 "[ . 1 . 2]" 1
392 1 35 GLU H 1 38 LYS HB2 . . 5.250 4.393 4.351 4.500 . 0 0 "[ . 1 . 2]" 1
393 1 35 GLU HA 1 35 GLU HG2 . . 4.190 2.648 2.635 2.661 . 0 0 "[ . 1 . 2]" 1
394 1 35 GLU HA 1 35 GLU HG3 . . 3.970 3.781 3.769 3.797 . 0 0 "[ . 1 . 2]" 1
395 1 35 GLU HA 1 37 LEU H . . 4.890 4.648 4.470 4.723 . 0 0 "[ . 1 . 2]" 1
396 1 35 GLU HA 1 38 LYS H . . 4.400 3.344 3.282 3.434 . 0 0 "[ . 1 . 2]" 1
397 1 35 GLU HA 1 38 LYS HB2 . . 3.700 2.131 2.065 2.246 . 0 0 "[ . 1 . 2]" 1
398 1 35 GLU HA 1 38 LYS QE . . 5.000 2.725 2.328 3.236 . 0 0 "[ . 1 . 2]" 1
399 1 35 GLU HA 1 38 LYS HG3 . . 4.030 3.737 3.613 3.944 . 0 0 "[ . 1 . 2]" 1
400 1 35 GLU HA 1 39 LYS H . . 3.720 3.647 3.518 3.765 0.045 11 0 "[ . 1 . 2]" 1
401 1 35 GLU QB 1 36 ASP H . . 3.610 2.728 2.642 2.808 . 0 0 "[ . 1 . 2]" 1
402 1 35 GLU HB2 1 36 ASP H . . 4.120 2.780 2.689 2.866 . 0 0 "[ . 1 . 2]" 1
403 1 35 GLU HB3 1 36 ASP H . . 4.120 3.963 3.871 4.024 . 0 0 "[ . 1 . 2]" 1
404 1 35 GLU HG3 1 36 ASP H . . 4.710 4.267 4.186 4.341 . 0 0 "[ . 1 . 2]" 1
405 1 36 ASP H 1 36 ASP HB2 . . 3.890 2.292 2.103 2.731 . 0 0 "[ . 1 . 2]" 1
406 1 36 ASP H 1 36 ASP QB . . 3.390 2.221 2.071 2.650 . 0 0 "[ . 1 . 2]" 1
407 1 36 ASP H 1 36 ASP HB3 . . 3.890 3.095 2.555 3.585 . 0 0 "[ . 1 . 2]" 1
408 1 36 ASP H 1 37 LEU HB3 . . 5.340 5.250 5.026 5.370 0.030 11 0 "[ . 1 . 2]" 1
409 1 36 ASP H 1 37 LEU MD1 . . 5.770 5.263 5.057 5.580 . 0 0 "[ . 1 . 2]" 1
410 1 36 ASP H 1 37 LEU HG . . 5.690 4.122 3.977 4.346 . 0 0 "[ . 1 . 2]" 1
411 1 36 ASP H 1 38 LYS H . . 3.910 3.731 3.667 3.785 . 0 0 "[ . 1 . 2]" 1
412 1 36 ASP H 1 38 LYS HB2 . . 4.870 4.574 4.516 4.703 . 0 0 "[ . 1 . 2]" 1
413 1 36 ASP HA 1 38 LYS HB2 . . 5.520 5.368 5.296 5.531 0.011 4 0 "[ . 1 . 2]" 1
414 1 36 ASP HA 1 39 LYS H . . 4.470 3.641 3.602 3.712 . 0 0 "[ . 1 . 2]" 1
415 1 36 ASP HA 1 40 TYR QD . . 5.710 3.424 3.244 3.578 . 0 0 "[ . 1 . 2]" 1
416 1 36 ASP QB 1 37 LEU HB2 . . 5.390 5.118 5.051 5.277 . 0 0 "[ . 1 . 2]" 1
417 1 36 ASP QB 1 39 LYS H . . 5.810 4.979 4.944 5.041 . 0 0 "[ . 1 . 2]" 1
418 1 36 ASP QB 1 40 TYR H . . 5.810 5.216 4.993 5.387 . 0 0 "[ . 1 . 2]" 1
419 1 36 ASP HB2 1 37 LEU H . . 4.560 3.171 2.391 3.800 . 0 0 "[ . 1 . 2]" 1
420 1 36 ASP HB2 1 40 TYR QD . . 5.520 5.431 5.126 5.570 0.050 19 0 "[ . 1 . 2]" 1
421 1 36 ASP HB3 1 37 LEU H . . 4.560 2.682 2.336 3.751 . 0 0 "[ . 1 . 2]" 1
422 1 36 ASP HB3 1 40 TYR QD . . 5.520 4.687 4.168 5.164 . 0 0 "[ . 1 . 2]" 1
423 1 37 LEU H 1 37 LEU HB2 . . 4.000 3.597 3.586 3.608 . 0 0 "[ . 1 . 2]" 1
424 1 37 LEU H 1 37 LEU HB3 . . 4.120 2.582 2.431 2.664 . 0 0 "[ . 1 . 2]" 1
425 1 37 LEU H 1 37 LEU MD1 . . 4.420 3.582 3.421 3.822 . 0 0 "[ . 1 . 2]" 1
426 1 37 LEU H 1 37 LEU MD2 . . 4.030 3.218 3.117 3.284 . 0 0 "[ . 1 . 2]" 1
427 1 37 LEU H 1 37 LEU HG . . 3.830 2.139 1.995 2.439 . 0 0 "[ . 1 . 2]" 1
428 1 37 LEU H 1 38 LYS H . . 3.940 2.477 2.415 2.511 . 0 0 "[ . 1 . 2]" 1
429 1 37 LEU HA 1 37 LEU MD1 . . 3.650 3.568 3.489 3.627 . 0 0 "[ . 1 . 2]" 1
430 1 37 LEU HA 1 40 TYR H . . 4.670 3.582 3.518 3.692 . 0 0 "[ . 1 . 2]" 1
431 1 37 LEU HA 1 42 ALA MB . . 4.000 2.881 2.728 3.011 . 0 0 "[ . 1 . 2]" 1
432 1 37 LEU HA 1 101 ALA MB . . 5.060 3.524 3.447 3.616 . 0 0 "[ . 1 . 2]" 1
433 1 37 LEU HB2 1 38 LYS H . . 5.550 4.045 3.982 4.154 . 0 0 "[ . 1 . 2]" 1
434 1 37 LEU HB2 1 38 LYS HA . . 5.620 4.653 4.572 4.818 . 0 0 "[ . 1 . 2]" 1
435 1 37 LEU HB2 1 42 ALA H . . 5.490 4.372 4.287 4.509 . 0 0 "[ . 1 . 2]" 1
436 1 37 LEU HB2 1 42 ALA MB . . 4.570 2.373 2.227 2.563 . 0 0 "[ . 1 . 2]" 1
437 1 37 LEU HB3 1 38 LYS H . . 5.510 4.102 3.984 4.154 . 0 0 "[ . 1 . 2]" 1
438 1 37 LEU HB3 1 42 ALA MB . . 4.520 3.727 3.619 3.906 . 0 0 "[ . 1 . 2]" 1
439 1 37 LEU MD1 1 42 ALA H . . 4.650 3.945 3.706 4.116 . 0 0 "[ . 1 . 2]" 1
440 1 37 LEU MD1 1 42 ALA MB . . 3.550 2.953 2.760 3.091 . 0 0 "[ . 1 . 2]" 1
441 1 37 LEU MD1 1 45 VAL HB . . 5.870 5.477 5.266 5.738 . 0 0 "[ . 1 . 2]" 1
442 1 37 LEU MD1 1 45 VAL MG1 . . 4.250 3.777 3.574 4.184 . 0 0 "[ . 1 . 2]" 1
443 1 37 LEU MD1 1 101 ALA MB . . 3.560 3.258 2.979 3.380 . 0 0 "[ . 1 . 2]" 1
444 1 37 LEU MD2 1 38 LYS H . . 4.570 4.186 4.003 4.257 . 0 0 "[ . 1 . 2]" 1
445 1 37 LEU MD2 1 43 THR HA . . 6.000 5.882 5.590 6.012 0.012 10 0 "[ . 1 . 2]" 1
446 1 37 LEU MD2 1 63 ILE MD . . 3.630 3.192 2.658 3.483 . 0 0 "[ . 1 . 2]" 1
447 1 37 LEU MD2 1 63 ILE HG12 . . 5.220 4.828 4.343 5.109 . 0 0 "[ . 1 . 2]" 1
448 1 37 LEU MD2 1 63 ILE MG . . 3.830 2.994 2.665 3.243 . 0 0 "[ . 1 . 2]" 1
449 1 37 LEU MD2 1 101 ALA H . . 5.350 4.853 4.645 5.074 . 0 0 "[ . 1 . 2]" 1
450 1 37 LEU MD2 1 101 ALA MB . . 3.990 2.534 2.337 2.871 . 0 0 "[ . 1 . 2]" 1
451 1 37 LEU HG 1 38 LYS H . . 4.960 2.570 2.327 2.675 . 0 0 "[ . 1 . 2]" 1
452 1 37 LEU HG 1 38 LYS HB2 . . 4.140 4.009 3.777 4.139 . 0 0 "[ . 1 . 2]" 1
453 1 37 LEU HG 1 39 LYS H . . 4.990 4.936 4.721 5.012 0.022 2 0 "[ . 1 . 2]" 1
454 1 38 LYS H 1 38 LYS HB2 . . 3.490 2.201 2.184 2.231 . 0 0 "[ . 1 . 2]" 1
455 1 38 LYS H 1 38 LYS QD . . 4.930 4.703 4.649 4.738 . 0 0 "[ . 1 . 2]" 1
456 1 38 LYS H 1 38 LYS QE . . 4.860 4.212 3.899 4.578 . 0 0 "[ . 1 . 2]" 1
457 1 38 LYS H 1 38 LYS HG2 . . 4.550 3.759 3.562 3.903 . 0 0 "[ . 1 . 2]" 1
458 1 38 LYS H 1 38 LYS HG3 . . 3.610 3.170 3.006 3.247 . 0 0 "[ . 1 . 2]" 1
459 1 38 LYS H 1 39 LYS H . . 3.980 2.401 2.374 2.459 . 0 0 "[ . 1 . 2]" 1
460 1 38 LYS H 1 39 LYS QG . . 4.830 3.758 3.725 3.808 . 0 0 "[ . 1 . 2]" 1
461 1 38 LYS H 1 63 ILE MD . . 4.920 4.575 4.413 4.735 . 0 0 "[ . 1 . 2]" 1
462 1 38 LYS HA 1 38 LYS QD . . 4.210 3.651 3.447 3.842 . 0 0 "[ . 1 . 2]" 1
463 1 38 LYS HA 1 38 LYS HG2 . . 4.070 2.176 2.137 2.261 . 0 0 "[ . 1 . 2]" 1
464 1 38 LYS HA 1 38 LYS HG3 . . 3.710 3.163 3.015 3.341 . 0 0 "[ . 1 . 2]" 1
465 1 38 LYS HA 1 40 TYR H . . 4.520 4.427 4.366 4.485 . 0 0 "[ . 1 . 2]" 1
466 1 38 LYS HA 1 42 ALA H . . 4.350 3.403 3.248 3.513 . 0 0 "[ . 1 . 2]" 1
467 1 38 LYS HA 1 42 ALA MB . . 5.310 4.301 4.216 4.431 . 0 0 "[ . 1 . 2]" 1
468 1 38 LYS HB2 1 38 LYS QD . . 3.360 3.106 3.024 3.202 . 0 0 "[ . 1 . 2]" 1
469 1 38 LYS HB2 1 38 LYS QE . . 5.010 2.497 2.281 2.813 . 0 0 "[ . 1 . 2]" 1
470 1 38 LYS HB2 1 39 LYS H . . 3.240 2.862 2.751 2.931 . 0 0 "[ . 1 . 2]" 1
471 1 38 LYS HB3 1 38 LYS QD . . 3.330 2.177 1.995 2.353 . 0 0 "[ . 1 . 2]" 1
472 1 38 LYS HB3 1 38 LYS QE . . 5.010 3.026 2.534 3.182 . 0 0 "[ . 1 . 2]" 1
473 1 38 LYS QE 1 38 LYS HG3 . . 3.760 2.236 2.121 2.393 . 0 0 "[ . 1 . 2]" 1
474 1 38 LYS HG2 1 42 ALA H . . 5.690 5.344 5.131 5.493 . 0 0 "[ . 1 . 2]" 1
475 1 38 LYS HG3 1 39 LYS H . . 4.850 4.821 4.740 4.861 0.011 2 0 "[ . 1 . 2]" 1
476 1 39 LYS H 1 39 LYS QG . . 4.780 2.175 2.140 2.242 . 0 0 "[ . 1 . 2]" 1
477 1 39 LYS H 1 40 TYR H . . 3.860 2.512 2.472 2.581 . 0 0 "[ . 1 . 2]" 1
478 1 39 LYS H 1 40 TYR HA . . 5.250 5.150 5.117 5.204 . 0 0 "[ . 1 . 2]" 1
479 1 39 LYS H 1 40 TYR HB2 . . 5.170 4.384 4.342 4.467 . 0 0 "[ . 1 . 2]" 1
480 1 39 LYS H 1 40 TYR QD . . 5.350 4.258 4.210 4.395 . 0 0 "[ . 1 . 2]" 1
481 1 39 LYS HA 1 39 LYS QE . . 5.730 4.318 4.184 4.513 . 0 0 "[ . 1 . 2]" 1
482 1 39 LYS HA 1 39 LYS QG . . 3.740 3.339 3.335 3.341 . 0 0 "[ . 1 . 2]" 1
483 1 39 LYS QB 1 39 LYS QD . . 3.450 2.256 2.188 2.339 . 0 0 "[ . 1 . 2]" 1
484 1 39 LYS QB 1 39 LYS QE . . 4.070 2.123 1.959 2.419 . 0 0 "[ . 1 . 2]" 1
485 1 39 LYS QB 1 40 TYR HB2 . . 5.810 5.206 5.180 5.217 . 0 0 "[ . 1 . 2]" 1
486 1 39 LYS HB2 1 39 LYS QE . . 4.740 2.368 2.029 3.251 . 0 0 "[ . 1 . 2]" 1
487 1 39 LYS HB3 1 39 LYS QE . . 4.740 2.940 1.979 3.389 . 0 0 "[ . 1 . 2]" 1
488 1 39 LYS QG 1 40 TYR H . . 4.680 2.141 2.074 2.171 . 0 0 "[ . 1 . 2]" 1
489 1 39 LYS QG 1 40 TYR HA . . 4.840 3.154 3.123 3.208 . 0 0 "[ . 1 . 2]" 1
490 1 40 TYR H 1 40 TYR HB2 . . 3.790 2.150 2.133 2.162 . 0 0 "[ . 1 . 2]" 1
491 1 40 TYR H 1 40 TYR HB3 . . 3.960 3.460 3.444 3.470 . 0 0 "[ . 1 . 2]" 1
492 1 40 TYR H 1 40 TYR QD . . 3.770 2.588 2.543 2.649 . 0 0 "[ . 1 . 2]" 1
493 1 40 TYR H 1 40 TYR QE . . 5.150 4.901 4.863 4.947 . 0 0 "[ . 1 . 2]" 1
494 1 40 TYR H 1 41 GLY H . . 3.740 2.588 2.562 2.618 . 0 0 "[ . 1 . 2]" 1
495 1 40 TYR H 1 41 GLY QA . . 5.020 4.505 4.472 4.536 . 0 0 "[ . 1 . 2]" 1
496 1 40 TYR H 1 42 ALA H . . 4.490 3.884 3.761 3.986 . 0 0 "[ . 1 . 2]" 1
497 1 40 TYR HA 1 40 TYR QD . . 4.000 2.988 2.871 3.028 . 0 0 "[ . 1 . 2]" 1
498 1 40 TYR HA 1 40 TYR QE . . 5.210 4.480 4.432 4.499 . 0 0 "[ . 1 . 2]" 1
499 1 40 TYR HA 1 42 ALA MB . . 5.610 5.307 5.219 5.385 . 0 0 "[ . 1 . 2]" 1
500 1 40 TYR HB2 1 41 GLY H . . 4.610 3.499 3.440 3.557 . 0 0 "[ . 1 . 2]" 1
501 1 40 TYR HB3 1 41 GLY H . . 4.710 3.858 3.784 3.926 . 0 0 "[ . 1 . 2]" 1
502 1 40 TYR QD 1 41 GLY H . . 4.920 4.733 4.705 4.767 . 0 0 "[ . 1 . 2]" 1
503 1 41 GLY H 1 42 ALA H . . 3.640 2.383 2.317 2.449 . 0 0 "[ . 1 . 2]" 1
504 1 41 GLY H 1 42 ALA HA . . 5.340 5.054 5.005 5.105 . 0 0 "[ . 1 . 2]" 1
505 1 41 GLY H 1 42 ALA MB . . 4.290 4.127 4.080 4.184 . 0 0 "[ . 1 . 2]" 1
506 1 41 GLY QA 1 42 ALA MB . . 5.040 4.173 4.145 4.196 . 0 0 "[ . 1 . 2]" 1
507 1 41 GLY HA2 1 42 ALA MB . . 5.750 4.679 4.645 4.720 . 0 0 "[ . 1 . 2]" 1
508 1 41 GLY HA2 1 43 THR MG . . 6.000 4.501 4.385 4.607 . 0 0 "[ . 1 . 2]" 1
509 1 41 GLY HA3 1 42 ALA MB . . 5.750 4.688 4.650 4.737 . 0 0 "[ . 1 . 2]" 1
510 1 41 GLY HA3 1 43 THR MG . . 6.000 5.232 5.103 5.445 . 0 0 "[ . 1 . 2]" 1
511 1 42 ALA H 1 42 ALA MB . . 3.530 2.366 2.314 2.416 . 0 0 "[ . 1 . 2]" 1
512 1 42 ALA H 1 63 ILE MG . . 6.000 6.018 5.815 6.078 0.078 15 0 "[ . 1 . 2]" 1
513 1 42 ALA H 1 99 CYS HB2 . . 5.380 3.610 3.419 3.803 . 0 0 "[ . 1 . 2]" 1
514 1 42 ALA H 1 99 CYS QB . . 4.690 3.539 3.363 3.737 . 0 0 "[ . 1 . 2]" 1
515 1 42 ALA H 1 99 CYS HB3 . . 5.380 5.134 4.591 5.479 0.099 15 0 "[ . 1 . 2]" 1
516 1 42 ALA H 1 101 ALA MB . . 6.000 5.127 5.040 5.231 . 0 0 "[ . 1 . 2]" 1
517 1 42 ALA HA 1 43 THR MG . . 5.110 3.693 3.527 3.978 . 0 0 "[ . 1 . 2]" 1
518 1 42 ALA HA 1 44 THR H . . 5.160 3.796 3.649 3.942 . 0 0 "[ . 1 . 2]" 1
519 1 42 ALA HA 1 99 CYS H . . 4.340 2.057 1.782 2.652 . 0 0 "[ . 1 . 2]" 1
520 1 42 ALA HA 1 99 CYS HB2 . . 4.980 2.198 1.923 2.437 . 0 0 "[ . 1 . 2]" 1
521 1 42 ALA HA 1 99 CYS QB . . 4.290 2.179 1.895 2.416 . 0 0 "[ . 1 . 2]" 1
522 1 42 ALA HA 1 99 CYS HB3 . . 4.980 3.572 2.863 3.974 . 0 0 "[ . 1 . 2]" 1
523 1 42 ALA MB 1 43 THR H . . 4.870 3.247 3.177 3.302 . 0 0 "[ . 1 . 2]" 1
524 1 42 ALA MB 1 44 THR H . . 3.730 2.763 2.597 2.893 . 0 0 "[ . 1 . 2]" 1
525 1 42 ALA MB 1 44 THR HB . . 5.810 4.340 4.238 4.437 . 0 0 "[ . 1 . 2]" 1
526 1 42 ALA MB 1 98 SER QB . . 5.870 4.310 4.090 4.615 . 0 0 "[ . 1 . 2]" 1
527 1 42 ALA MB 1 99 CYS H . . 4.340 3.539 3.312 3.943 . 0 0 "[ . 1 . 2]" 1
528 1 42 ALA MB 1 99 CYS HB2 . . 4.570 1.981 1.908 2.319 . 0 0 "[ . 1 . 2]" 1
529 1 42 ALA MB 1 99 CYS QB . . 3.980 1.900 1.843 2.003 . 0 0 "[ . 1 . 2]" 1
530 1 42 ALA MB 1 99 CYS HB3 . . 4.570 2.637 1.960 3.013 . 0 0 "[ . 1 . 2]" 1
531 1 42 ALA MB 1 101 ALA H . . 4.450 2.727 2.580 2.915 . 0 0 "[ . 1 . 2]" 1
532 1 42 ALA MB 1 101 ALA MB . . 3.560 2.491 2.419 2.561 . 0 0 "[ . 1 . 2]" 1
533 1 42 ALA MB 1 102 VAL H . . 5.640 5.494 5.385 5.610 . 0 0 "[ . 1 . 2]" 1
534 1 43 THR H 1 44 THR H . . 3.960 3.012 2.801 3.186 . 0 0 "[ . 1 . 2]" 1
535 1 43 THR H 1 63 ILE HA . . 5.920 5.988 5.867 6.106 0.186 4 0 "[ . 1 . 2]" 1
536 1 43 THR HA 1 43 THR MG . . 3.380 2.372 2.223 2.457 . 0 0 "[ . 1 . 2]" 1
537 1 43 THR HA 1 63 ILE MD . . 4.420 4.204 4.061 4.255 . 0 0 "[ . 1 . 2]" 1
538 1 43 THR HA 1 63 ILE HG12 . . 4.970 2.744 2.630 2.791 . 0 0 "[ . 1 . 2]" 1
539 1 43 THR HA 1 63 ILE HG13 . . 4.590 4.131 4.041 4.219 . 0 0 "[ . 1 . 2]" 1
540 1 43 THR HA 1 63 ILE MG . . 4.460 2.832 2.795 2.895 . 0 0 "[ . 1 . 2]" 1
541 1 43 THR HA 1 64 THR H . . 5.790 4.125 3.970 4.226 . 0 0 "[ . 1 . 2]" 1
542 1 43 THR MG 1 44 THR H . . 4.420 4.316 4.250 4.382 . 0 0 "[ . 1 . 2]" 1
543 1 43 THR MG 1 63 ILE HA . . 4.800 4.461 4.080 4.652 . 0 0 "[ . 1 . 2]" 1
544 1 43 THR MG 1 64 THR H . . 5.440 4.960 4.832 5.100 . 0 0 "[ . 1 . 2]" 1
545 1 44 THR H 1 44 THR HB . . 3.700 3.509 3.449 3.552 . 0 0 "[ . 1 . 2]" 1
546 1 44 THR H 1 44 THR MG . . 4.030 3.842 3.741 3.908 . 0 0 "[ . 1 . 2]" 1
547 1 44 THR H 1 45 VAL H . . 4.850 4.315 4.247 4.372 . 0 0 "[ . 1 . 2]" 1
548 1 44 THR H 1 63 ILE MG . . 4.310 2.717 2.625 2.854 . 0 0 "[ . 1 . 2]" 1
549 1 44 THR H 1 64 THR H . . 4.920 4.561 4.454 4.677 . 0 0 "[ . 1 . 2]" 1
550 1 44 THR H 1 66 VAL MG2 . . 5.800 5.033 4.826 5.225 . 0 0 "[ . 1 . 2]" 1
551 1 44 THR H 1 101 ALA H . . 4.620 3.260 3.169 3.339 . 0 0 "[ . 1 . 2]" 1
552 1 44 THR H 1 101 ALA MB . . 4.460 3.548 3.454 3.636 . 0 0 "[ . 1 . 2]" 1
553 1 44 THR HA 1 44 THR MG . . 3.740 2.070 2.051 2.092 . 0 0 "[ . 1 . 2]" 1
554 1 44 THR HA 1 45 VAL H . . 3.550 2.213 2.195 2.243 . 0 0 "[ . 1 . 2]" 1
555 1 44 THR HA 1 45 VAL HB . . 5.070 4.982 4.918 5.037 . 0 0 "[ . 1 . 2]" 1
556 1 44 THR HA 1 45 VAL MG1 . . 5.530 5.353 5.314 5.392 . 0 0 "[ . 1 . 2]" 1
557 1 44 THR HA 1 63 ILE MG . . 4.440 2.212 2.030 2.262 . 0 0 "[ . 1 . 2]" 1
558 1 44 THR HA 1 64 THR H . . 3.890 2.796 2.715 2.845 . 0 0 "[ . 1 . 2]" 1
559 1 44 THR HA 1 64 THR HB . . 4.570 2.550 2.349 2.696 . 0 0 "[ . 1 . 2]" 1
560 1 44 THR HA 1 65 VAL H . . 5.280 5.102 5.051 5.174 . 0 0 "[ . 1 . 2]" 1
561 1 44 THR HA 1 66 VAL HB . . 6.000 5.565 5.477 5.737 . 0 0 "[ . 1 . 2]" 1
562 1 44 THR HB 1 45 VAL H . . 5.180 3.260 3.169 3.345 . 0 0 "[ . 1 . 2]" 1
563 1 44 THR HB 1 64 THR H . . 5.480 5.479 5.412 5.522 0.042 8 0 "[ . 1 . 2]" 1
564 1 44 THR HB 1 66 VAL HB . . 6.000 4.172 3.914 4.365 . 0 0 "[ . 1 . 2]" 1
565 1 44 THR HB 1 100 VAL HA . . 4.780 2.778 2.579 3.071 . 0 0 "[ . 1 . 2]" 1
566 1 44 THR HB 1 100 VAL QG . . 5.130 2.573 2.216 3.187 . 0 0 "[ . 1 . 2]" 1
567 1 44 THR HB 1 101 ALA H . . 5.230 2.280 2.042 2.458 . 0 0 "[ . 1 . 2]" 1
568 1 44 THR MG 1 64 THR H . . 4.510 3.438 3.373 3.527 . 0 0 "[ . 1 . 2]" 1
569 1 44 THR MG 1 64 THR HB . . 3.550 1.782 1.753 1.807 . 0 0 "[ . 1 . 2]" 1
570 1 44 THR MG 1 66 VAL H . . 4.780 3.695 3.598 3.773 . 0 0 "[ . 1 . 2]" 1
571 1 44 THR MG 1 66 VAL HB . . 4.810 3.811 3.747 3.898 . 0 0 "[ . 1 . 2]" 1
572 1 44 THR MG 1 66 VAL MG1 . . 4.460 3.487 3.383 3.609 . 0 0 "[ . 1 . 2]" 1
573 1 44 THR MG 1 66 VAL MG2 . . 3.570 1.650 1.634 1.681 . 0 0 "[ . 1 . 2]" 1
574 1 44 THR MG 1 101 ALA H . . 5.030 3.895 3.730 4.018 . 0 0 "[ . 1 . 2]" 1
575 1 45 VAL H 1 45 VAL HB . . 3.990 2.793 2.727 2.853 . 0 0 "[ . 1 . 2]" 1
576 1 45 VAL H 1 45 VAL MG1 . . 3.890 3.792 3.776 3.813 . 0 0 "[ . 1 . 2]" 1
577 1 45 VAL H 1 45 VAL MG2 . . 3.540 1.902 1.831 1.990 . 0 0 "[ . 1 . 2]" 1
578 1 45 VAL H 1 63 ILE HB . . 5.560 4.876 4.802 5.033 . 0 0 "[ . 1 . 2]" 1
579 1 45 VAL H 1 63 ILE MD . . 5.410 5.313 5.215 5.458 0.048 11 0 "[ . 1 . 2]" 1
580 1 45 VAL H 1 63 ILE MG . . 4.290 2.480 2.401 2.733 . 0 0 "[ . 1 . 2]" 1
581 1 45 VAL H 1 64 THR H . . 4.540 4.370 4.295 4.492 . 0 0 "[ . 1 . 2]" 1
582 1 45 VAL H 1 64 THR HA . . 5.150 4.971 4.902 5.029 . 0 0 "[ . 1 . 2]" 1
583 1 45 VAL H 1 64 THR HB . . 4.940 4.137 3.980 4.240 . 0 0 "[ . 1 . 2]" 1
584 1 45 VAL H 1 65 VAL H . . 5.390 4.758 4.682 4.842 . 0 0 "[ . 1 . 2]" 1
585 1 45 VAL H 1 65 VAL HA . . 4.210 3.083 2.924 3.173 . 0 0 "[ . 1 . 2]" 1
586 1 45 VAL H 1 65 VAL QG . . 5.270 4.567 4.015 4.674 . 0 0 "[ . 1 . 2]" 1
587 1 45 VAL H 1 66 VAL H . . 4.890 2.918 2.739 3.129 . 0 0 "[ . 1 . 2]" 1
588 1 45 VAL H 1 66 VAL MG2 . . 4.950 2.592 2.338 2.829 . 0 0 "[ . 1 . 2]" 1
589 1 45 VAL H 1 101 ALA H . . 5.540 4.677 4.483 4.811 . 0 0 "[ . 1 . 2]" 1
590 1 45 VAL H 1 101 ALA MB . . 5.300 4.200 4.076 4.248 . 0 0 "[ . 1 . 2]" 1
591 1 45 VAL HA 1 45 VAL MG2 . . 3.490 2.596 2.535 2.652 . 0 0 "[ . 1 . 2]" 1
592 1 45 VAL HA 1 63 ILE MG . . 5.040 3.151 2.971 3.260 . 0 0 "[ . 1 . 2]" 1
593 1 45 VAL HA 1 66 VAL H . . 5.260 4.769 4.609 4.904 . 0 0 "[ . 1 . 2]" 1
594 1 45 VAL HA 1 101 ALA H . . 4.840 4.535 4.393 4.614 . 0 0 "[ . 1 . 2]" 1
595 1 45 VAL HA 1 101 ALA MB . . 4.170 2.572 2.407 2.639 . 0 0 "[ . 1 . 2]" 1
596 1 45 VAL HB 1 63 ILE MG . . 4.490 3.923 3.835 4.098 . 0 0 "[ . 1 . 2]" 1
597 1 45 VAL HB 1 65 VAL H . . 6.000 5.519 5.350 5.689 . 0 0 "[ . 1 . 2]" 1
598 1 45 VAL HB 1 65 VAL HA . . 4.670 2.712 2.534 2.879 . 0 0 "[ . 1 . 2]" 1
599 1 45 VAL HB 1 65 VAL QG . . 4.770 3.676 2.647 3.979 . 0 0 "[ . 1 . 2]" 1
600 1 45 VAL HB 1 66 VAL H . . 4.910 2.655 2.441 2.804 . 0 0 "[ . 1 . 2]" 1
601 1 45 VAL HB 1 66 VAL MG1 . . 5.990 5.648 5.522 5.809 . 0 0 "[ . 1 . 2]" 1
602 1 45 VAL HB 1 101 ALA MB . . 4.980 4.829 4.707 4.908 . 0 0 "[ . 1 . 2]" 1
603 1 45 VAL MG1 1 46 VAL H . . 3.550 2.307 1.945 2.463 . 0 0 "[ . 1 . 2]" 1
604 1 45 VAL MG1 1 63 ILE MG . . 3.800 3.550 3.492 3.654 . 0 0 "[ . 1 . 2]" 1
605 1 45 VAL MG1 1 65 VAL HA . . 4.890 4.094 3.884 4.222 . 0 0 "[ . 1 . 2]" 1
606 1 45 VAL MG1 1 101 ALA MB . . 3.750 3.737 3.622 3.794 0.044 8 0 "[ . 1 . 2]" 1
607 1 45 VAL MG2 1 46 VAL H . . 4.310 4.153 4.095 4.191 . 0 0 "[ . 1 . 2]" 1
608 1 45 VAL MG2 1 63 ILE MG . . 3.830 1.717 1.678 1.802 . 0 0 "[ . 1 . 2]" 1
609 1 45 VAL MG2 1 65 VAL HA . . 4.960 2.299 2.070 2.445 . 0 0 "[ . 1 . 2]" 1
610 1 45 VAL MG2 1 66 VAL H . . 5.000 3.300 3.145 3.523 . 0 0 "[ . 1 . 2]" 1
611 1 46 VAL H 1 46 VAL HB . . 4.200 3.620 3.610 3.630 . 0 0 "[ . 1 . 2]" 1
612 1 46 VAL H 1 101 ALA MB . . 4.130 2.426 2.266 2.497 . 0 0 "[ . 1 . 2]" 1
613 1 46 VAL H 1 102 VAL HA . . 4.640 4.409 4.335 4.485 . 0 0 "[ . 1 . 2]" 1
614 1 46 VAL HA 1 66 VAL H . . 5.750 5.212 5.103 5.324 . 0 0 "[ . 1 . 2]" 1
615 1 46 VAL HA 1 66 VAL HB . . 4.450 3.714 3.635 3.820 . 0 0 "[ . 1 . 2]" 1
616 1 46 VAL HA 1 66 VAL MG1 . . 4.950 4.525 4.442 4.635 . 0 0 "[ . 1 . 2]" 1
617 1 46 VAL HA 1 66 VAL MG2 . . 4.890 4.472 4.366 4.566 . 0 0 "[ . 1 . 2]" 1
618 1 46 VAL HA 1 101 ALA MB . . 4.710 3.193 3.132 3.253 . 0 0 "[ . 1 . 2]" 1
619 1 46 VAL HA 1 102 VAL HB . . 5.210 4.017 3.941 4.435 . 0 0 "[ . 1 . 2]" 1
620 1 46 VAL HB 1 47 ARG H . . 5.730 4.517 4.485 4.537 . 0 0 "[ . 1 . 2]" 1
621 1 46 VAL HB 1 102 VAL H . . 5.290 3.468 3.344 3.618 . 0 0 "[ . 1 . 2]" 1
622 1 46 VAL HB 1 102 VAL HA . . 5.060 2.725 2.555 2.925 . 0 0 "[ . 1 . 2]" 1
623 1 46 VAL HB 1 102 VAL HB . . 4.680 4.518 4.400 4.868 0.188 10 0 "[ . 1 . 2]" 1
624 1 46 VAL HB 1 103 HIS H . . 4.930 2.640 2.531 2.744 . 0 0 "[ . 1 . 2]" 1
625 1 46 VAL QG 1 47 ARG H . . 4.140 3.432 3.350 3.506 . 0 0 "[ . 1 . 2]" 1
626 1 47 ARG H 1 66 VAL HA . . 5.420 5.091 4.991 5.184 . 0 0 "[ . 1 . 2]" 1
627 1 47 ARG H 1 66 VAL HB . . 4.620 3.021 2.860 3.151 . 0 0 "[ . 1 . 2]" 1
628 1 47 ARG H 1 66 VAL MG1 . . 5.270 4.385 4.243 4.545 . 0 0 "[ . 1 . 2]" 1
629 1 47 ARG H 1 66 VAL MG2 . . 4.720 4.027 3.881 4.152 . 0 0 "[ . 1 . 2]" 1
630 1 47 ARG H 1 67 ASP HA . . 5.100 4.506 4.362 4.645 . 0 0 "[ . 1 . 2]" 1
631 1 47 ARG H 1 68 TRP H . . 6.000 5.851 5.552 5.970 . 0 0 "[ . 1 . 2]" 1
632 1 47 ARG HA 1 47 ARG QD . . 4.810 3.916 3.728 4.074 . 0 0 "[ . 1 . 2]" 1
633 1 47 ARG HA 1 51 VAL H . . 6.000 5.526 5.329 6.006 0.006 2 0 "[ . 1 . 2]" 1
634 1 47 ARG HA 1 51 VAL QG . . 3.910 2.214 2.011 2.574 . 0 0 "[ . 1 . 2]" 1
635 1 47 ARG HA 1 66 VAL H . . 6.000 5.315 5.085 5.428 . 0 0 "[ . 1 . 2]" 1
636 1 47 ARG HA 1 67 ASP H . . 6.000 6.077 5.994 6.137 0.137 14 0 "[ . 1 . 2]" 1
637 1 47 ARG QB 1 66 VAL HB . . 5.320 3.466 3.250 3.897 . 0 0 "[ . 1 . 2]" 1
638 1 47 ARG QB 1 66 VAL MG1 . . 5.380 4.051 3.936 4.177 . 0 0 "[ . 1 . 2]" 1
639 1 47 ARG QB 1 68 TRP H . . 4.930 3.842 3.649 3.995 . 0 0 "[ . 1 . 2]" 1
640 1 47 ARG QD 1 51 VAL QG . . 4.020 3.044 2.718 3.664 . 0 0 "[ . 1 . 2]" 1
641 1 47 ARG QD 1 53 TYR H . . 6.000 5.751 5.087 6.070 0.070 1 0 "[ . 1 . 2]" 1
642 1 47 ARG QG 1 51 VAL QG . . 4.520 2.541 1.874 3.643 . 0 0 "[ . 1 . 2]" 1
643 1 47 ARG QG 1 66 VAL MG1 . . 5.770 5.347 4.490 5.764 . 0 0 "[ . 1 . 2]" 1
644 1 47 ARG QG 1 67 ASP HA . . 5.360 4.074 3.970 4.150 . 0 0 "[ . 1 . 2]" 1
645 1 49 CYS HA 1 71 ASP H . . 4.590 2.543 2.020 3.003 . 0 0 "[ . 1 . 2]" 1
646 1 49 CYS QB 1 70 PHE QB . . 5.610 4.889 4.217 6.483 0.873 8 1 "[ . + 1 . 2]" 1
647 1 49 CYS QB 1 71 ASP H . . 4.400 4.195 3.589 4.589 0.189 14 0 "[ . 1 . 2]" 1
648 1 49 CYS QB 1 71 ASP HA . . 4.370 3.929 2.883 4.523 0.153 4 0 "[ . 1 . 2]" 1
649 1 49 CYS HB2 1 71 ASP H . . 5.090 4.613 4.045 5.350 0.260 14 0 "[ . 1 . 2]" 1
650 1 49 CYS HB2 1 71 ASP HA . . 5.190 4.318 3.067 5.315 0.125 8 0 "[ . 1 . 2]" 1
651 1 49 CYS HB3 1 71 ASP H . . 5.090 4.848 4.012 5.196 0.106 13 0 "[ . 1 . 2]" 1
652 1 49 CYS HB3 1 71 ASP HA . . 5.190 4.580 3.504 5.365 0.175 7 0 "[ . 1 . 2]" 1
653 1 50 GLU H 1 51 VAL H . . 4.900 3.661 3.502 3.935 . 0 0 "[ . 1 . 2]" 1
654 1 50 GLU H 1 71 ASP QB . . 5.810 2.069 1.850 3.918 . 0 0 "[ . 1 . 2]" 1
655 1 50 GLU HA 1 51 VAL HA . . 5.240 4.590 4.512 4.638 . 0 0 "[ . 1 . 2]" 1
656 1 50 GLU HA 1 51 VAL QG . . 4.680 3.745 3.559 4.413 . 0 0 "[ . 1 . 2]" 1
657 1 50 GLU HA 1 52 THR H . . 6.000 6.115 6.001 6.324 0.324 2 0 "[ . 1 . 2]" 1
658 1 50 GLU QB 1 51 VAL H . . 4.210 3.997 3.946 4.047 . 0 0 "[ . 1 . 2]" 1
659 1 50 GLU HB2 1 51 VAL H . . 4.970 4.582 4.280 4.653 . 0 0 "[ . 1 . 2]" 1
660 1 50 GLU HB3 1 51 VAL H . . 4.970 4.421 4.334 4.650 . 0 0 "[ . 1 . 2]" 1
661 1 50 GLU QG 1 51 VAL H . . 4.510 4.159 3.810 4.458 . 0 0 "[ . 1 . 2]" 1
662 1 50 GLU QG 1 51 VAL QG . . 5.060 4.599 4.233 4.963 . 0 0 "[ . 1 . 2]" 1
663 1 50 GLU QG 1 52 THR H . . 5.900 5.514 4.890 5.860 . 0 0 "[ . 1 . 2]" 1
664 1 50 GLU QG 1 52 THR MG . . 3.830 3.109 2.382 3.870 0.040 10 0 "[ . 1 . 2]" 1
665 1 51 VAL H 1 51 VAL HB . . 3.900 3.482 2.230 3.648 . 0 0 "[ . 1 . 2]" 1
666 1 51 VAL H 1 51 VAL QG . . 3.530 1.968 1.841 2.721 . 0 0 "[ . 1 . 2]" 1
667 1 51 VAL H 1 52 THR HA . . 5.470 5.498 5.384 5.601 0.131 14 0 "[ . 1 . 2]" 1
668 1 51 VAL H 1 52 THR MG . . 4.890 4.152 3.995 4.845 . 0 0 "[ . 1 . 2]" 1
669 1 51 VAL H 1 53 TYR H . . 6.000 5.994 5.904 6.121 0.121 2 0 "[ . 1 . 2]" 1
670 1 51 VAL HA 1 53 TYR H . . 4.660 4.032 3.810 4.237 . 0 0 "[ . 1 . 2]" 1
671 1 51 VAL HA 1 67 ASP HB2 . . 6.000 6.174 5.995 6.312 0.312 12 0 "[ . 1 . 2]" 1
672 1 51 VAL HA 1 67 ASP HB3 . . 6.000 6.094 5.899 6.183 0.183 6 0 "[ . 1 . 2]" 1
673 1 51 VAL HB 1 67 ASP HA . . 5.740 5.083 4.045 5.487 . 0 0 "[ . 1 . 2]" 1
674 1 51 VAL QG 1 52 THR H . . 5.360 3.247 2.210 3.406 . 0 0 "[ . 1 . 2]" 1
675 1 51 VAL QG 1 53 TYR H . . 4.170 3.572 1.922 3.835 . 0 0 "[ . 1 . 2]" 1
676 1 51 VAL QG 1 53 TYR QB . . 4.820 4.767 3.518 5.134 0.314 7 0 "[ . 1 . 2]" 1
677 1 51 VAL QG 1 67 ASP H . . 5.920 4.475 4.293 4.884 . 0 0 "[ . 1 . 2]" 1
678 1 51 VAL QG 1 67 ASP HA . . 4.970 2.680 2.442 3.129 . 0 0 "[ . 1 . 2]" 1
679 1 52 THR H 1 53 TYR H . . 4.910 2.236 1.873 2.462 . 0 0 "[ . 1 . 2]" 1
680 1 52 THR HB 1 53 TYR H . . 4.620 4.495 4.438 4.638 0.018 2 0 "[ . 1 . 2]" 1
681 1 52 THR MG 1 53 TYR H . . 4.410 4.274 3.614 4.366 . 0 0 "[ . 1 . 2]" 1
682 1 53 TYR H 1 54 ASP H . . 5.550 4.326 4.128 4.456 . 0 0 "[ . 1 . 2]" 1
683 1 53 TYR QB 1 53 TYR HE1 . . 4.620 4.454 4.418 4.522 . 0 0 "[ . 1 . 2]" 1
684 1 54 ASP QB 1 56 THR H . . 5.050 4.489 4.339 4.629 . 0 0 "[ . 1 . 2]" 1
685 1 54 ASP QB 1 57 PRO HD2 . . 5.810 5.813 5.667 5.935 0.125 9 0 "[ . 1 . 2]" 1
686 1 54 ASP HB2 1 56 THR MG . . 4.040 3.870 3.853 3.902 . 0 0 "[ . 1 . 2]" 1
687 1 54 ASP HB3 1 56 THR MG . . 4.040 3.563 3.453 3.857 . 0 0 "[ . 1 . 2]" 1
688 1 55 LYS H 1 55 LYS QE . . 5.010 2.864 1.929 4.400 . 0 0 "[ . 1 . 2]" 1
689 1 55 LYS H 1 55 LYS QG . . 4.620 1.979 1.695 2.252 . 0 0 "[ . 1 . 2]" 1
690 1 55 LYS H 1 56 THR H . . 4.460 4.255 4.117 4.342 . 0 0 "[ . 1 . 2]" 1
691 1 55 LYS H 1 56 THR MG . . 5.050 4.442 4.240 4.556 . 0 0 "[ . 1 . 2]" 1
692 1 55 LYS HA 1 65 VAL HB . . 6.000 5.797 5.511 6.360 0.360 11 0 "[ . 1 . 2]" 1
693 1 55 LYS QB 1 58 LEU MD1 . . 3.390 1.845 1.823 1.879 . 0 0 "[ . 1 . 2]" 1
694 1 55 LYS QB 1 59 GLU H . . 3.540 3.158 3.066 3.247 . 0 0 "[ . 1 . 2]" 1
695 1 55 LYS QB 1 59 GLU HA . . 4.580 3.435 3.371 3.475 . 0 0 "[ . 1 . 2]" 1
696 1 55 LYS QB 1 65 VAL H . . 5.810 5.665 5.090 5.828 0.018 3 0 "[ . 1 . 2]" 1
697 1 55 LYS QB 1 65 VAL QG . . 3.540 3.080 1.763 3.512 . 0 0 "[ . 1 . 2]" 1
698 1 55 LYS HB2 1 56 THR H . . 5.260 3.827 3.756 3.953 . 0 0 "[ . 1 . 2]" 1
699 1 55 LYS HB2 1 58 LEU MD1 . . 3.910 2.032 1.914 2.461 . 0 0 "[ . 1 . 2]" 1
700 1 55 LYS HB2 1 65 VAL MG1 . . 5.820 4.424 2.745 4.845 . 0 0 "[ . 1 . 2]" 1
701 1 55 LYS HB2 1 65 VAL MG2 . . 5.820 4.375 2.665 5.005 . 0 0 "[ . 1 . 2]" 1
702 1 55 LYS HB3 1 56 THR H . . 5.260 4.288 4.096 4.395 . 0 0 "[ . 1 . 2]" 1
703 1 55 LYS HB3 1 58 LEU MD1 . . 3.910 2.184 1.879 2.406 . 0 0 "[ . 1 . 2]" 1
704 1 55 LYS HB3 1 65 VAL MG1 . . 5.820 4.306 1.859 4.854 . 0 0 "[ . 1 . 2]" 1
705 1 55 LYS HB3 1 65 VAL MG2 . . 5.820 3.418 2.521 4.443 . 0 0 "[ . 1 . 2]" 1
706 1 55 LYS QE 1 58 LEU MD1 . . 5.050 5.016 4.738 5.117 0.067 18 0 "[ . 1 . 2]" 1
707 1 56 THR H 1 56 THR HB . . 4.000 3.545 3.535 3.554 . 0 0 "[ . 1 . 2]" 1
708 1 56 THR H 1 56 THR MG . . 3.860 1.800 1.765 1.817 . 0 0 "[ . 1 . 2]" 1
709 1 56 THR H 1 57 PRO HD2 . . 4.250 1.542 1.521 1.561 . 0 0 "[ . 1 . 2]" 1
710 1 56 THR H 1 57 PRO HD3 . . 4.160 2.783 2.761 2.803 . 0 0 "[ . 1 . 2]" 1
711 1 56 THR H 1 57 PRO HG2 . . 5.570 3.743 3.726 3.760 . 0 0 "[ . 1 . 2]" 1
712 1 56 THR H 1 57 PRO HG3 . . 5.640 4.205 4.183 4.224 . 0 0 "[ . 1 . 2]" 1
713 1 56 THR H 1 59 GLU QB . . 5.760 3.929 3.888 3.965 . 0 0 "[ . 1 . 2]" 1
714 1 56 THR HA 1 59 GLU H . . 4.350 4.217 4.204 4.235 . 0 0 "[ . 1 . 2]" 1
715 1 56 THR HA 1 59 GLU HB2 . . 4.370 3.884 3.822 3.973 . 0 0 "[ . 1 . 2]" 1
716 1 56 THR HA 1 59 GLU QB . . 3.820 2.821 2.794 2.839 . 0 0 "[ . 1 . 2]" 1
717 1 56 THR HA 1 59 GLU HB3 . . 4.370 2.897 2.863 2.918 . 0 0 "[ . 1 . 2]" 1
718 1 56 THR HA 1 59 GLU QG . . 4.530 3.829 3.667 4.073 . 0 0 "[ . 1 . 2]" 1
719 1 56 THR HA 1 60 LYS QD . . 5.320 5.069 4.295 5.274 . 0 0 "[ . 1 . 2]" 1
720 1 56 THR HA 1 60 LYS QE . . 3.830 3.647 3.368 3.778 . 0 0 "[ . 1 . 2]" 1
721 1 56 THR HA 1 60 LYS QG . . 4.670 4.011 3.808 4.679 0.009 16 0 "[ . 1 . 2]" 1
722 1 56 THR HB 1 57 PRO HD2 . . 4.180 4.130 4.112 4.143 . 0 0 "[ . 1 . 2]" 1
723 1 56 THR HB 1 57 PRO HD3 . . 4.210 3.582 3.561 3.597 . 0 0 "[ . 1 . 2]" 1
724 1 56 THR MG 1 57 PRO HB3 . . 4.670 4.559 4.551 4.567 . 0 0 "[ . 1 . 2]" 1
725 1 56 THR MG 1 57 PRO HD2 . . 4.460 2.021 1.983 2.042 . 0 0 "[ . 1 . 2]" 1
726 1 56 THR MG 1 57 PRO HG3 . . 3.840 3.590 3.573 3.606 . 0 0 "[ . 1 . 2]" 1
727 1 56 THR MG 1 59 GLU H . . 5.270 5.061 5.030 5.073 . 0 0 "[ . 1 . 2]" 1
728 1 56 THR MG 1 59 GLU QG . . 5.990 5.708 5.543 5.966 . 0 0 "[ . 1 . 2]" 1
729 1 57 PRO HA 1 60 LYS H . . 4.460 3.708 3.611 3.779 . 0 0 "[ . 1 . 2]" 1
730 1 57 PRO HA 1 60 LYS QB . . 3.940 3.756 3.623 4.140 0.200 18 0 "[ . 1 . 2]" 1
731 1 57 PRO HB2 1 58 LEU H . . 3.900 2.351 2.320 2.372 . 0 0 "[ . 1 . 2]" 1
732 1 57 PRO HB3 1 58 LEU H . . 4.150 3.586 3.570 3.598 . 0 0 "[ . 1 . 2]" 1
733 1 57 PRO HB3 1 58 LEU HB3 . . 5.700 5.643 5.613 5.682 . 0 0 "[ . 1 . 2]" 1
734 1 57 PRO HD2 1 58 LEU H . . 4.840 3.126 3.109 3.152 . 0 0 "[ . 1 . 2]" 1
735 1 57 PRO HD3 1 58 LEU H . . 4.450 4.044 4.035 4.057 . 0 0 "[ . 1 . 2]" 1
736 1 57 PRO HD3 1 59 GLU H . . 6.000 4.978 4.965 4.990 . 0 0 "[ . 1 . 2]" 1
737 1 57 PRO HG2 1 58 LEU MD1 . . 3.880 1.988 1.927 2.072 . 0 0 "[ . 1 . 2]" 1
738 1 57 PRO HG2 1 59 GLU H . . 4.190 4.035 4.003 4.055 . 0 0 "[ . 1 . 2]" 1
739 1 57 PRO HG3 1 58 LEU H . . 5.090 3.301 3.294 3.307 . 0 0 "[ . 1 . 2]" 1
740 1 58 LEU H 1 58 LEU HB2 . . 3.720 3.568 3.560 3.576 . 0 0 "[ . 1 . 2]" 1
741 1 58 LEU H 1 58 LEU MD1 . . 3.870 1.716 1.687 1.742 . 0 0 "[ . 1 . 2]" 1
742 1 58 LEU H 1 58 LEU MD2 . . 4.490 3.673 3.610 3.733 . 0 0 "[ . 1 . 2]" 1
743 1 58 LEU H 1 58 LEU HG . . 3.760 3.727 3.696 3.760 . 0 0 "[ . 1 . 2]" 1
744 1 58 LEU H 1 59 GLU H . . 3.610 2.785 2.778 2.798 . 0 0 "[ . 1 . 2]" 1
745 1 58 LEU H 1 59 GLU HA . . 5.600 5.326 5.311 5.336 . 0 0 "[ . 1 . 2]" 1
746 1 58 LEU H 1 60 LYS H . . 5.300 4.812 4.652 4.937 . 0 0 "[ . 1 . 2]" 1
747 1 58 LEU H 1 63 ILE MD . . 5.590 4.624 4.460 4.708 . 0 0 "[ . 1 . 2]" 1
748 1 58 LEU HA 1 58 LEU MD1 . . 4.220 3.439 3.426 3.452 . 0 0 "[ . 1 . 2]" 1
749 1 58 LEU HA 1 61 ASP HB2 . . 4.810 2.163 1.978 2.538 . 0 0 "[ . 1 . 2]" 1
750 1 58 LEU HA 1 61 ASP QB . . 4.150 2.126 1.959 2.394 . 0 0 "[ . 1 . 2]" 1
751 1 58 LEU HA 1 61 ASP HB3 . . 4.810 3.218 2.815 3.429 . 0 0 "[ . 1 . 2]" 1
752 1 58 LEU HA 1 63 ILE MD . . 4.220 2.328 2.150 2.453 . 0 0 "[ . 1 . 2]" 1
753 1 58 LEU HA 1 63 ILE MG . . 5.270 4.377 4.257 4.569 . 0 0 "[ . 1 . 2]" 1
754 1 58 LEU HB2 1 59 GLU H . . 5.160 4.146 4.111 4.171 . 0 0 "[ . 1 . 2]" 1
755 1 58 LEU HB2 1 61 ASP H . . 6.000 5.237 5.036 5.406 . 0 0 "[ . 1 . 2]" 1
756 1 58 LEU HB2 1 63 ILE H . . 4.520 4.433 4.155 4.578 0.058 15 0 "[ . 1 . 2]" 1
757 1 58 LEU HB2 1 63 ILE HB . . 4.940 2.493 2.320 2.652 . 0 0 "[ . 1 . 2]" 1
758 1 58 LEU HB2 1 63 ILE MD . . 5.270 2.739 2.577 2.952 . 0 0 "[ . 1 . 2]" 1
759 1 58 LEU HB2 1 63 ILE MG . . 5.170 3.047 2.894 3.174 . 0 0 "[ . 1 . 2]" 1
760 1 58 LEU HB3 1 59 GLU H . . 4.460 4.082 4.043 4.103 . 0 0 "[ . 1 . 2]" 1
761 1 58 LEU HB3 1 61 ASP QB . . 5.610 4.397 4.231 4.552 . 0 0 "[ . 1 . 2]" 1
762 1 58 LEU HB3 1 63 ILE MD . . 5.040 3.482 3.310 3.624 . 0 0 "[ . 1 . 2]" 1
763 1 58 LEU HB3 1 63 ILE MG . . 5.720 4.311 4.213 4.463 . 0 0 "[ . 1 . 2]" 1
764 1 58 LEU MD1 1 59 GLU H . . 4.350 1.827 1.781 1.868 . 0 0 "[ . 1 . 2]" 1
765 1 58 LEU MD1 1 59 GLU QB . . 4.180 2.854 2.775 2.938 . 0 0 "[ . 1 . 2]" 1
766 1 58 LEU MD1 1 59 GLU QG . . 4.820 4.614 4.534 4.730 . 0 0 "[ . 1 . 2]" 1
767 1 58 LEU MD1 1 60 LYS H . . 4.780 4.260 4.202 4.346 . 0 0 "[ . 1 . 2]" 1
768 1 58 LEU MD1 1 61 ASP QB . . 5.020 4.711 4.630 4.797 . 0 0 "[ . 1 . 2]" 1
769 1 58 LEU MD2 1 59 GLU H . . 4.430 2.497 2.420 2.574 . 0 0 "[ . 1 . 2]" 1
770 1 58 LEU MD2 1 61 ASP H . . 4.680 4.567 4.486 4.672 . 0 0 "[ . 1 . 2]" 1
771 1 58 LEU MD2 1 61 ASP QB . . 5.810 4.361 4.217 4.490 . 0 0 "[ . 1 . 2]" 1
772 1 58 LEU HG 1 59 GLU H . . 4.580 4.350 4.325 4.388 . 0 0 "[ . 1 . 2]" 1
773 1 58 LEU HG 1 63 ILE MD . . 5.000 4.858 4.653 5.013 0.013 8 0 "[ . 1 . 2]" 1
774 1 59 GLU H 1 59 GLU QB . . 3.500 2.184 2.066 2.206 . 0 0 "[ . 1 . 2]" 1
775 1 59 GLU H 1 59 GLU QG . . 3.880 3.874 3.613 3.924 0.044 12 0 "[ . 1 . 2]" 1
776 1 59 GLU H 1 60 LYS H . . 4.070 2.690 2.619 2.733 . 0 0 "[ . 1 . 2]" 1
777 1 59 GLU H 1 60 LYS QG . . 4.750 4.211 4.091 4.425 . 0 0 "[ . 1 . 2]" 1
778 1 59 GLU H 1 63 ILE MG . . 6.000 6.156 6.023 6.284 0.284 18 0 "[ . 1 . 2]" 1
779 1 59 GLU H 1 65 VAL QG . . 5.920 5.772 4.361 6.135 0.215 18 0 "[ . 1 . 2]" 1
780 1 59 GLU HA 1 59 GLU QG . . 3.790 2.972 2.591 3.166 . 0 0 "[ . 1 . 2]" 1
781 1 59 GLU HA 1 61 ASP H . . 4.260 4.047 4.007 4.174 . 0 0 "[ . 1 . 2]" 1
782 1 59 GLU HA 1 62 GLY H . . 4.510 4.099 3.938 4.256 . 0 0 "[ . 1 . 2]" 1
783 1 59 GLU HA 1 63 ILE H . . 4.170 3.923 3.749 4.170 . 0 0 "[ . 1 . 2]" 1
784 1 59 GLU QB 1 61 ASP H . . 5.810 4.340 4.234 4.594 . 0 0 "[ . 1 . 2]" 1
785 1 59 GLU HB2 1 60 LYS H . . 4.190 3.854 3.770 4.012 . 0 0 "[ . 1 . 2]" 1
786 1 59 GLU HB3 1 60 LYS H . . 4.190 2.461 2.323 2.845 . 0 0 "[ . 1 . 2]" 1
787 1 59 GLU QG 1 60 LYS H . . 3.940 2.854 2.446 3.140 . 0 0 "[ . 1 . 2]" 1
788 1 59 GLU QG 1 60 LYS HA . . 4.580 3.162 2.990 3.298 . 0 0 "[ . 1 . 2]" 1
789 1 59 GLU QG 1 60 LYS QG . . 4.750 3.011 1.886 3.284 . 0 0 "[ . 1 . 2]" 1
790 1 60 LYS H 1 60 LYS QB . . 3.280 2.570 2.530 2.685 . 0 0 "[ . 1 . 2]" 1
791 1 60 LYS H 1 60 LYS QD . . 3.860 2.897 2.144 3.116 . 0 0 "[ . 1 . 2]" 1
792 1 60 LYS H 1 60 LYS QE . . 5.120 3.772 3.658 3.874 . 0 0 "[ . 1 . 2]" 1
793 1 60 LYS H 1 60 LYS QG . . 3.770 2.073 2.008 2.192 . 0 0 "[ . 1 . 2]" 1
794 1 60 LYS H 1 61 ASP H . . 3.780 2.511 2.403 2.600 . 0 0 "[ . 1 . 2]" 1
795 1 60 LYS H 1 61 ASP HA . . 5.260 5.088 4.983 5.179 . 0 0 "[ . 1 . 2]" 1
796 1 60 LYS H 1 62 GLY H . . 4.680 4.156 4.065 4.212 . 0 0 "[ . 1 . 2]" 1
797 1 60 LYS H 1 62 GLY HA2 . . 6.000 6.142 6.017 6.234 0.234 20 0 "[ . 1 . 2]" 1
798 1 60 LYS HA 1 60 LYS QD . . 3.990 2.238 2.012 3.990 0.000 16 0 "[ . 1 . 2]" 1
799 1 60 LYS HA 1 60 LYS QE . . 5.380 4.119 3.948 4.956 . 0 0 "[ . 1 . 2]" 1
800 1 60 LYS HA 1 60 LYS HG2 . . 4.030 3.310 3.286 3.450 . 0 0 "[ . 1 . 2]" 1
801 1 60 LYS HA 1 60 LYS HG3 . . 4.030 3.672 2.694 3.825 . 0 0 "[ . 1 . 2]" 1
802 1 60 LYS HA 1 61 ASP H . . 3.550 3.412 3.381 3.452 . 0 0 "[ . 1 . 2]" 1
803 1 60 LYS HA 1 62 GLY H . . 3.710 3.369 3.318 3.427 . 0 0 "[ . 1 . 2]" 1
804 1 60 LYS QB 1 60 LYS QD . . 3.260 2.376 2.047 2.432 . 0 0 "[ . 1 . 2]" 1
805 1 60 LYS QB 1 60 LYS QE . . 3.830 3.710 3.627 3.770 . 0 0 "[ . 1 . 2]" 1
806 1 60 LYS QB 1 61 ASP H . . 3.540 3.060 2.966 3.151 . 0 0 "[ . 1 . 2]" 1
807 1 60 LYS QB 1 62 GLY H . . 4.670 4.402 4.355 4.420 . 0 0 "[ . 1 . 2]" 1
808 1 60 LYS QD 1 60 LYS QG . . 2.290 2.091 2.082 2.092 . 0 0 "[ . 1 . 2]" 1
809 1 60 LYS QD 1 61 ASP H . . 4.730 4.514 3.674 4.637 . 0 0 "[ . 1 . 2]" 1
810 1 60 LYS QE 1 60 LYS HG2 . . 3.540 2.292 2.236 2.520 . 0 0 "[ . 1 . 2]" 1
811 1 60 LYS QE 1 60 LYS QG . . 2.920 2.126 2.101 2.197 . 0 0 "[ . 1 . 2]" 1
812 1 60 LYS QE 1 60 LYS HG3 . . 3.540 2.525 2.420 2.608 . 0 0 "[ . 1 . 2]" 1
813 1 60 LYS QG 1 61 ASP H . . 4.260 4.094 4.054 4.151 . 0 0 "[ . 1 . 2]" 1
814 1 61 ASP H 1 61 ASP HB2 . . 3.410 2.109 2.094 2.162 . 0 0 "[ . 1 . 2]" 1
815 1 61 ASP H 1 61 ASP QB . . 2.920 2.086 2.073 2.120 . 0 0 "[ . 1 . 2]" 1
816 1 61 ASP H 1 61 ASP HB3 . . 3.410 3.316 3.055 3.381 . 0 0 "[ . 1 . 2]" 1
817 1 61 ASP H 1 62 GLY H . . 3.320 2.565 2.541 2.607 . 0 0 "[ . 1 . 2]" 1
818 1 61 ASP H 1 62 GLY HA2 . . 4.930 4.844 4.809 4.874 . 0 0 "[ . 1 . 2]" 1
819 1 61 ASP H 1 62 GLY HA3 . . 5.410 5.197 5.174 5.228 . 0 0 "[ . 1 . 2]" 1
820 1 61 ASP H 1 63 ILE H . . 4.090 3.765 3.734 3.815 . 0 0 "[ . 1 . 2]" 1
821 1 61 ASP H 1 63 ILE MD . . 4.590 4.236 4.111 4.407 . 0 0 "[ . 1 . 2]" 1
822 1 61 ASP H 1 63 ILE HG13 . . 5.190 4.988 4.875 5.107 . 0 0 "[ . 1 . 2]" 1
823 1 61 ASP HA 1 63 ILE H . . 5.070 4.697 4.545 4.791 . 0 0 "[ . 1 . 2]" 1
824 1 61 ASP QB 1 63 ILE H . . 4.060 3.174 3.003 3.306 . 0 0 "[ . 1 . 2]" 1
825 1 61 ASP QB 1 63 ILE HB . . 5.810 3.404 3.257 3.532 . 0 0 "[ . 1 . 2]" 1
826 1 61 ASP QB 1 63 ILE HG13 . . 5.130 2.402 2.176 2.524 . 0 0 "[ . 1 . 2]" 1
827 1 61 ASP QB 1 63 ILE MG . . 5.290 4.337 4.266 4.424 . 0 0 "[ . 1 . 2]" 1
828 1 61 ASP HB2 1 62 GLY H . . 4.350 3.747 3.644 3.964 . 0 0 "[ . 1 . 2]" 1
829 1 61 ASP HB2 1 63 ILE H . . 4.710 3.809 3.602 4.162 . 0 0 "[ . 1 . 2]" 1
830 1 61 ASP HB2 1 63 ILE MD . . 4.250 2.640 2.369 3.047 . 0 0 "[ . 1 . 2]" 1
831 1 61 ASP HB3 1 62 GLY H . . 4.350 3.814 3.584 3.874 . 0 0 "[ . 1 . 2]" 1
832 1 61 ASP HB3 1 63 ILE H . . 4.710 3.411 3.094 3.611 . 0 0 "[ . 1 . 2]" 1
833 1 61 ASP HB3 1 63 ILE MD . . 4.250 1.987 1.921 2.123 . 0 0 "[ . 1 . 2]" 1
834 1 62 GLY H 1 63 ILE H . . 3.490 2.550 2.471 2.608 . 0 0 "[ . 1 . 2]" 1
835 1 62 GLY H 1 63 ILE HB . . 4.890 4.788 4.735 4.843 . 0 0 "[ . 1 . 2]" 1
836 1 62 GLY HA2 1 63 ILE MG . . 5.960 5.889 5.864 5.911 . 0 0 "[ . 1 . 2]" 1
837 1 63 ILE H 1 63 ILE HB . . 3.320 2.483 2.435 2.537 . 0 0 "[ . 1 . 2]" 1
838 1 63 ILE H 1 63 ILE MD . . 3.920 3.481 3.360 3.610 . 0 0 "[ . 1 . 2]" 1
839 1 63 ILE H 1 63 ILE HG12 . . 4.260 4.060 3.961 4.107 . 0 0 "[ . 1 . 2]" 1
840 1 63 ILE H 1 63 ILE HG13 . . 3.910 2.706 2.585 2.773 . 0 0 "[ . 1 . 2]" 1
841 1 63 ILE H 1 63 ILE MG . . 3.930 3.776 3.754 3.805 . 0 0 "[ . 1 . 2]" 1
842 1 63 ILE H 1 64 THR H . . 4.580 4.483 4.457 4.514 . 0 0 "[ . 1 . 2]" 1
843 1 63 ILE HA 1 63 ILE MD . . 4.230 3.859 3.848 3.873 . 0 0 "[ . 1 . 2]" 1
844 1 63 ILE HA 1 64 THR H . . 3.220 2.164 2.150 2.182 . 0 0 "[ . 1 . 2]" 1
845 1 63 ILE HB 1 63 ILE MD . . 3.570 2.220 2.122 2.317 . 0 0 "[ . 1 . 2]" 1
846 1 63 ILE HB 1 64 THR H . . 4.640 4.165 4.120 4.209 . 0 0 "[ . 1 . 2]" 1
847 1 63 ILE MD 1 63 ILE MG . . 3.280 2.298 2.158 2.431 . 0 0 "[ . 1 . 2]" 1
848 1 63 ILE MD 1 64 THR H . . 5.140 5.155 5.094 5.210 0.070 15 0 "[ . 1 . 2]" 1
849 1 63 ILE HG12 1 64 THR H . . 4.500 4.355 4.274 4.425 . 0 0 "[ . 1 . 2]" 1
850 1 63 ILE HG13 1 63 ILE MG . . 3.380 3.159 3.143 3.170 . 0 0 "[ . 1 . 2]" 1
851 1 63 ILE HG13 1 64 THR H . . 5.000 4.739 4.684 4.800 . 0 0 "[ . 1 . 2]" 1
852 1 63 ILE MG 1 64 THR H . . 3.530 2.527 2.193 2.643 . 0 0 "[ . 1 . 2]" 1
853 1 63 ILE MG 1 64 THR HB . . 5.320 3.700 3.520 3.819 . 0 0 "[ . 1 . 2]" 1
854 1 63 ILE MG 1 65 VAL H . . 5.070 4.504 4.396 4.660 . 0 0 "[ . 1 . 2]" 1
855 1 63 ILE MG 1 101 ALA H . . 6.000 4.811 4.715 4.867 . 0 0 "[ . 1 . 2]" 1
856 1 63 ILE MG 1 101 ALA MB . . 5.410 4.110 3.957 4.201 . 0 0 "[ . 1 . 2]" 1
857 1 64 THR H 1 64 THR HB . . 3.510 2.358 2.315 2.383 . 0 0 "[ . 1 . 2]" 1
858 1 64 THR H 1 64 THR MG . . 3.910 3.722 3.700 3.733 . 0 0 "[ . 1 . 2]" 1
859 1 64 THR H 1 65 VAL H . . 4.700 4.530 4.487 4.568 . 0 0 "[ . 1 . 2]" 1
860 1 64 THR HA 1 64 THR MG . . 3.460 2.522 2.497 2.553 . 0 0 "[ . 1 . 2]" 1
861 1 64 THR HA 1 65 VAL H . . 3.200 2.149 2.142 2.166 . 0 0 "[ . 1 . 2]" 1
862 1 64 THR HB 1 65 VAL H . . 4.880 4.331 4.240 4.376 . 0 0 "[ . 1 . 2]" 1
863 1 64 THR HB 1 66 VAL MG1 . . 6.000 5.932 5.777 6.152 0.152 14 0 "[ . 1 . 2]" 1
864 1 64 THR HB 1 66 VAL MG2 . . 4.970 3.556 3.472 3.729 . 0 0 "[ . 1 . 2]" 1
865 1 64 THR HB 1 87 LEU MD1 . . 4.860 4.225 3.979 4.402 . 0 0 "[ . 1 . 2]" 1
866 1 64 THR MG 1 65 VAL H . . 3.500 2.696 2.519 2.837 . 0 0 "[ . 1 . 2]" 1
867 1 64 THR MG 1 66 VAL MG1 . . 5.070 3.968 3.816 4.232 . 0 0 "[ . 1 . 2]" 1
868 1 65 VAL H 1 65 VAL HB . . 3.880 3.047 2.810 3.325 . 0 0 "[ . 1 . 2]" 1
869 1 65 VAL H 1 65 VAL MG1 . . 4.280 1.926 1.737 3.692 . 0 0 "[ . 1 . 2]" 1
870 1 65 VAL H 1 65 VAL QG . . 3.460 1.830 1.732 1.966 . 0 0 "[ . 1 . 2]" 1
871 1 65 VAL H 1 65 VAL MG2 . . 4.280 3.551 1.875 3.757 . 0 0 "[ . 1 . 2]" 1
872 1 65 VAL H 1 66 VAL H . . 4.710 4.355 4.306 4.423 . 0 0 "[ . 1 . 2]" 1
873 1 65 VAL H 1 66 VAL MG2 . . 5.020 4.408 4.346 4.484 . 0 0 "[ . 1 . 2]" 1
874 1 65 VAL HA 1 66 VAL HA . . 5.410 4.408 4.396 4.419 . 0 0 "[ . 1 . 2]" 1
875 1 65 VAL HA 1 66 VAL HB . . 5.200 4.826 4.745 4.899 . 0 0 "[ . 1 . 2]" 1
876 1 65 VAL HA 1 66 VAL MG1 . . 5.680 5.484 5.467 5.503 . 0 0 "[ . 1 . 2]" 1
877 1 65 VAL HA 1 66 VAL MG2 . . 4.880 3.579 3.469 3.658 . 0 0 "[ . 1 . 2]" 1
878 1 65 VAL HA 1 67 ASP H . . 5.290 5.037 4.930 5.156 . 0 0 "[ . 1 . 2]" 1
879 1 65 VAL HB 1 66 VAL H . . 5.350 4.186 3.900 4.332 . 0 0 "[ . 1 . 2]" 1
880 1 65 VAL QG 1 66 VAL H . . 3.780 2.889 2.712 3.010 . 0 0 "[ . 1 . 2]" 1
881 1 65 VAL MG1 1 66 VAL H . . 4.550 4.260 3.049 4.423 . 0 0 "[ . 1 . 2]" 1
882 1 65 VAL MG2 1 66 VAL H . . 4.550 3.004 2.742 4.425 . 0 0 "[ . 1 . 2]" 1
883 1 66 VAL H 1 66 VAL HB . . 3.990 2.693 2.645 2.764 . 0 0 "[ . 1 . 2]" 1
884 1 66 VAL H 1 66 VAL MG2 . . 4.060 2.272 2.162 2.511 . 0 0 "[ . 1 . 2]" 1
885 1 66 VAL H 1 67 ASP H . . 4.760 3.949 3.920 3.999 . 0 0 "[ . 1 . 2]" 1
886 1 66 VAL HA 1 67 ASP H . . 3.080 2.269 2.244 2.296 . 0 0 "[ . 1 . 2]" 1
887 1 66 VAL HA 1 67 ASP HA . . 4.820 4.427 4.415 4.449 . 0 0 "[ . 1 . 2]" 1
888 1 66 VAL HB 1 67 ASP H . . 4.560 4.399 4.362 4.420 . 0 0 "[ . 1 . 2]" 1
889 1 66 VAL HB 1 68 TRP HE1 . . 5.320 4.792 4.538 5.835 0.515 13 1 "[ . 1 + . 2]" 1
890 1 66 VAL MG1 1 67 ASP H . . 3.880 3.459 3.379 3.518 . 0 0 "[ . 1 . 2]" 1
891 1 66 VAL MG1 1 67 ASP HB3 . . 5.720 5.541 5.499 5.602 . 0 0 "[ . 1 . 2]" 1
892 1 66 VAL MG1 1 68 TRP H . . 5.440 4.140 3.851 4.347 . 0 0 "[ . 1 . 2]" 1
893 1 66 VAL MG1 1 68 TRP HB2 . . 5.380 4.034 3.715 4.233 . 0 0 "[ . 1 . 2]" 1
894 1 66 VAL MG1 1 68 TRP HE1 . . 4.270 2.024 1.819 2.934 . 0 0 "[ . 1 . 2]" 1
895 1 66 VAL MG1 1 68 TRP HZ2 . . 4.440 3.785 3.301 4.400 . 0 0 "[ . 1 . 2]" 1
896 1 66 VAL MG1 1 87 LEU MD1 . . 4.500 2.012 1.848 2.467 . 0 0 "[ . 1 . 2]" 1
897 1 66 VAL MG1 1 87 LEU MD2 . . 3.920 1.730 1.670 1.752 . 0 0 "[ . 1 . 2]" 1
898 1 66 VAL MG1 1 101 ALA H . . 6.000 5.683 5.252 5.952 . 0 0 "[ . 1 . 2]" 1
899 1 66 VAL MG2 1 67 ASP H . . 4.390 4.352 4.306 4.381 . 0 0 "[ . 1 . 2]" 1
900 1 66 VAL MG2 1 68 TRP HE1 . . 4.790 4.000 3.791 4.880 0.090 13 0 "[ . 1 . 2]" 1
901 1 66 VAL MG2 1 68 TRP HZ2 . . 6.000 4.998 4.748 5.407 . 0 0 "[ . 1 . 2]" 1
902 1 66 VAL MG2 1 87 LEU H . . 6.000 6.108 5.896 6.206 0.206 12 0 "[ . 1 . 2]" 1
903 1 66 VAL MG2 1 87 LEU MD1 . . 3.750 1.690 1.665 1.705 . 0 0 "[ . 1 . 2]" 1
904 1 66 VAL MG2 1 100 VAL HA . . 5.200 4.387 4.071 4.821 . 0 0 "[ . 1 . 2]" 1
905 1 66 VAL MG2 1 101 ALA H . . 6.000 4.104 3.737 4.367 . 0 0 "[ . 1 . 2]" 1
906 1 67 ASP H 1 67 ASP HB3 . . 3.450 3.191 2.990 3.278 . 0 0 "[ . 1 . 2]" 1
907 1 67 ASP H 1 68 TRP H . . 4.550 4.276 4.206 4.352 . 0 0 "[ . 1 . 2]" 1
908 1 67 ASP H 1 68 TRP HE1 . . 5.170 4.490 4.079 4.712 . 0 0 "[ . 1 . 2]" 1
909 1 67 ASP H 1 87 LEU MD2 . . 6.000 5.608 5.359 5.698 . 0 0 "[ . 1 . 2]" 1
910 1 67 ASP HA 1 68 TRP H . . 3.360 2.145 2.138 2.158 . 0 0 "[ . 1 . 2]" 1
911 1 67 ASP HA 1 68 TRP HA . . 5.540 4.386 4.373 4.395 . 0 0 "[ . 1 . 2]" 1
912 1 67 ASP HA 1 68 TRP HB2 . . 4.960 4.704 4.508 4.811 . 0 0 "[ . 1 . 2]" 1
913 1 67 ASP HB2 1 68 TRP H . . 4.340 3.619 3.480 3.739 . 0 0 "[ . 1 . 2]" 1
914 1 67 ASP HB2 1 69 PRO HD2 . . 6.000 6.264 5.689 6.579 0.579 11 3 "[ -. * 1+ . 2]" 1
915 1 67 ASP HB2 1 69 PRO HD3 . . 6.000 5.213 4.398 5.755 . 0 0 "[ . 1 . 2]" 1
916 1 67 ASP HB3 1 68 TRP H . . 4.400 4.214 4.078 4.347 . 0 0 "[ . 1 . 2]" 1
917 1 67 ASP HB3 1 68 TRP HA . . 5.860 5.692 5.622 5.808 . 0 0 "[ . 1 . 2]" 1
918 1 68 TRP H 1 68 TRP HB3 . . 4.060 3.876 3.684 3.933 . 0 0 "[ . 1 . 2]" 1
919 1 68 TRP H 1 68 TRP HE1 . . 6.000 5.654 5.593 5.755 . 0 0 "[ . 1 . 2]" 1
920 1 68 TRP H 1 69 PRO HD2 . . 5.360 4.786 4.639 4.813 . 0 0 "[ . 1 . 2]" 1
921 1 68 TRP H 1 69 PRO QD . . 4.610 4.208 3.936 4.310 . 0 0 "[ . 1 . 2]" 1
922 1 68 TRP H 1 69 PRO HD3 . . 5.360 4.670 4.255 4.865 . 0 0 "[ . 1 . 2]" 1
923 1 68 TRP HA 1 68 TRP HE1 . . 6.000 5.617 4.612 5.830 . 0 0 "[ . 1 . 2]" 1
924 1 68 TRP HA 1 69 PRO QB . . 5.380 4.546 4.534 4.565 . 0 0 "[ . 1 . 2]" 1
925 1 68 TRP HA 1 69 PRO QG . . 4.960 3.878 3.774 3.995 . 0 0 "[ . 1 . 2]" 1
926 1 68 TRP HA 1 80 VAL QG . . 5.730 4.734 3.492 5.288 . 0 0 "[ . 1 . 2]" 1
927 1 68 TRP HB2 1 70 PHE H . . 4.020 3.274 2.689 3.903 . 0 0 "[ . 1 . 2]" 1
928 1 68 TRP HB2 1 70 PHE HE2 . . 5.310 4.437 1.947 5.543 0.233 2 0 "[ . 1 . 2]" 1
929 1 68 TRP HB2 1 114 LEU QD . . 5.920 4.837 4.187 5.610 . 0 0 "[ . 1 . 2]" 1
930 1 68 TRP HB3 1 70 PHE HE2 . . 5.670 4.416 3.150 6.021 0.351 11 0 "[ . 1 . 2]" 1
931 1 68 TRP HB3 1 80 VAL QG . . 4.390 3.447 2.336 3.906 . 0 0 "[ . 1 . 2]" 1
932 1 68 TRP HE1 1 87 LEU H . . 6.000 4.632 4.238 5.206 . 0 0 "[ . 1 . 2]" 1
933 1 69 PRO QB 1 70 PHE H . . 4.220 3.944 3.812 4.003 . 0 0 "[ . 1 . 2]" 1
934 1 69 PRO QB 1 74 ALA H . . 4.700 3.316 2.080 4.838 0.138 20 0 "[ . 1 . 2]" 1
935 1 69 PRO QB 1 74 ALA MB . . 3.820 3.128 1.981 3.860 0.040 19 0 "[ . 1 . 2]" 1
936 1 69 PRO QB 1 80 VAL QG . . 4.690 4.313 3.746 4.501 . 0 0 "[ . 1 . 2]" 1
937 1 69 PRO QG 1 70 PHE H . . 4.610 4.075 3.495 4.563 . 0 0 "[ . 1 . 2]" 1
938 1 69 PRO QG 1 74 ALA MB . . 4.150 2.668 1.932 3.560 . 0 0 "[ . 1 . 2]" 1
939 1 69 PRO QG 1 80 VAL H . . 6.000 6.022 5.460 6.226 0.226 3 0 "[ . 1 . 2]" 1
940 1 69 PRO QG 1 80 VAL HA . . 5.430 5.084 4.268 5.592 0.162 8 0 "[ . 1 . 2]" 1
941 1 69 PRO QG 1 80 VAL QG . . 4.210 2.967 2.352 3.288 . 0 0 "[ . 1 . 2]" 1
942 1 70 PHE H 1 114 LEU QD . . 5.460 4.972 4.491 5.352 . 0 0 "[ . 1 . 2]" 1
943 1 70 PHE QB 1 80 VAL QG . . 5.650 4.128 1.749 4.762 . 0 0 "[ . 1 . 2]" 1
944 1 70 PHE QB 1 114 LEU QD . . 5.100 2.689 1.868 3.503 . 0 0 "[ . 1 . 2]" 1
945 1 70 PHE QB 1 114 LEU HG . . 5.470 3.789 3.290 4.072 . 0 0 "[ . 1 . 2]" 1
946 1 70 PHE HB2 1 71 ASP H . . 5.510 3.585 2.851 4.515 . 0 0 "[ . 1 . 2]" 1
947 1 70 PHE HB3 1 71 ASP H . . 5.510 4.086 3.508 4.463 . 0 0 "[ . 1 . 2]" 1
948 1 70 PHE HE2 1 80 VAL QG . . 4.110 3.191 1.874 4.207 0.097 7 0 "[ . 1 . 2]" 1
949 1 71 ASP H 1 71 ASP QB . . 3.390 2.266 2.071 2.563 . 0 0 "[ . 1 . 2]" 1
950 1 73 GLY H 1 74 ALA H . . 5.260 2.971 1.813 4.509 . 0 0 "[ . 1 . 2]" 1
951 1 74 ALA H 1 74 ALA MB . . 3.580 2.806 2.206 2.919 . 0 0 "[ . 1 . 2]" 1
952 1 78 GLY QA 1 79 LYS H . . 3.370 2.729 2.596 2.912 . 0 0 "[ . 1 . 2]" 1
953 1 78 GLY QA 1 80 VAL H . . 4.310 3.672 3.233 4.599 0.289 1 0 "[ . 1 . 2]" 1
954 1 78 GLY QA 1 81 VAL MG1 . . 4.410 2.639 2.021 3.254 . 0 0 "[ . 1 . 2]" 1
955 1 78 GLY QA 1 82 GLU H . . 5.790 5.577 4.995 6.006 0.216 20 0 "[ . 1 . 2]" 1
956 1 79 LYS H 1 80 VAL QG . . 5.790 3.826 3.322 4.339 . 0 0 "[ . 1 . 2]" 1
957 1 79 LYS H 1 81 VAL H . . 4.550 4.020 3.615 4.353 . 0 0 "[ . 1 . 2]" 1
958 1 79 LYS HA 1 79 LYS QE . . 4.290 3.507 2.184 4.156 . 0 0 "[ . 1 . 2]" 1
959 1 79 LYS HA 1 79 LYS QG . . 3.770 2.699 2.151 3.183 . 0 0 "[ . 1 . 2]" 1
960 1 79 LYS HA 1 81 VAL H . . 4.650 3.902 3.715 4.109 . 0 0 "[ . 1 . 2]" 1
961 1 79 LYS HA 1 81 VAL MG1 . . 4.700 4.230 3.926 4.553 . 0 0 "[ . 1 . 2]" 1
962 1 79 LYS QB 1 80 VAL H . . 3.560 2.762 2.216 3.120 . 0 0 "[ . 1 . 2]" 1
963 1 79 LYS QB 1 80 VAL HA . . 4.910 4.028 3.664 4.452 . 0 0 "[ . 1 . 2]" 1
964 1 79 LYS QB 1 80 VAL QG . . 4.790 3.534 3.134 4.108 . 0 0 "[ . 1 . 2]" 1
965 1 79 LYS QB 1 82 GLU H . . 5.810 5.092 4.796 5.404 . 0 0 "[ . 1 . 2]" 1
966 1 79 LYS HB2 1 80 VAL H . . 4.400 3.799 3.037 4.309 . 0 0 "[ . 1 . 2]" 1
967 1 79 LYS HB3 1 80 VAL H . . 4.400 2.861 2.235 3.365 . 0 0 "[ . 1 . 2]" 1
968 1 79 LYS QG 1 80 VAL H . . 4.780 3.995 3.244 4.655 . 0 0 "[ . 1 . 2]" 1
969 1 79 LYS QG 1 80 VAL HA . . 5.300 4.240 3.353 5.312 0.012 17 0 "[ . 1 . 2]" 1
970 1 79 LYS QG 1 82 GLU H . . 5.610 4.598 3.725 5.267 . 0 0 "[ . 1 . 2]" 1
971 1 79 LYS QG 1 82 GLU QG . . 5.010 4.188 2.703 4.968 . 0 0 "[ . 1 . 2]" 1
972 1 80 VAL H 1 80 VAL HB . . 3.600 2.480 2.160 2.665 . 0 0 "[ . 1 . 2]" 1
973 1 80 VAL H 1 80 VAL QG . . 3.320 2.291 1.913 2.875 . 0 0 "[ . 1 . 2]" 1
974 1 80 VAL H 1 81 VAL H . . 3.710 2.740 2.454 2.834 . 0 0 "[ . 1 . 2]" 1
975 1 80 VAL H 1 81 VAL HA . . 5.410 5.281 5.039 5.375 . 0 0 "[ . 1 . 2]" 1
976 1 80 VAL H 1 81 VAL MG1 . . 4.880 3.868 3.534 4.020 . 0 0 "[ . 1 . 2]" 1
977 1 80 VAL H 1 81 VAL MG2 . . 5.620 4.203 4.077 4.307 . 0 0 "[ . 1 . 2]" 1
978 1 80 VAL H 1 82 GLU H . . 5.070 4.547 4.365 4.717 . 0 0 "[ . 1 . 2]" 1
979 1 80 VAL H 1 82 GLU QB . . 5.390 5.399 5.141 6.010 0.620 10 1 "[ . + . 2]" 1
980 1 80 VAL HA 1 81 VAL MG1 . . 5.060 4.949 4.901 5.004 . 0 0 "[ . 1 . 2]" 1
981 1 80 VAL HA 1 83 ASP H . . 4.040 3.368 3.249 3.454 . 0 0 "[ . 1 . 2]" 1
982 1 80 VAL HA 1 83 ASP HA . . 6.000 5.701 5.514 5.828 . 0 0 "[ . 1 . 2]" 1
983 1 80 VAL HA 1 83 ASP QB . . 4.730 3.277 3.066 3.481 . 0 0 "[ . 1 . 2]" 1
984 1 80 VAL HB 1 81 VAL H . . 4.060 2.873 2.633 3.110 . 0 0 "[ . 1 . 2]" 1
985 1 80 VAL HB 1 82 GLU H . . 5.480 5.273 5.131 5.466 . 0 0 "[ . 1 . 2]" 1
986 1 80 VAL QG 1 81 VAL H . . 4.000 3.248 2.847 3.439 . 0 0 "[ . 1 . 2]" 1
987 1 80 VAL QG 1 81 VAL HA . . 6.000 3.458 2.922 3.849 . 0 0 "[ . 1 . 2]" 1
988 1 80 VAL QG 1 83 ASP H . . 5.340 3.791 3.466 4.031 . 0 0 "[ . 1 . 2]" 1
989 1 80 VAL QG 1 84 TRP H . . 5.190 3.345 3.210 3.477 . 0 0 "[ . 1 . 2]" 1
990 1 80 VAL QG 1 84 TRP HE1 . . 4.770 4.349 3.780 4.863 0.093 10 0 "[ . 1 . 2]" 1
991 1 80 VAL QG 1 114 LEU MD1 . . 4.710 3.288 2.502 4.489 . 0 0 "[ . 1 . 2]" 1
992 1 80 VAL QG 1 114 LEU QD . . 3.890 2.848 2.478 3.265 . 0 0 "[ . 1 . 2]" 1
993 1 80 VAL QG 1 114 LEU MD2 . . 4.710 3.725 2.504 4.599 . 0 0 "[ . 1 . 2]" 1
994 1 81 VAL H 1 81 VAL MG1 . . 3.360 1.981 1.866 2.105 . 0 0 "[ . 1 . 2]" 1
995 1 81 VAL H 1 81 VAL MG2 . . 3.900 2.431 2.326 2.531 . 0 0 "[ . 1 . 2]" 1
996 1 81 VAL H 1 82 GLU H . . 3.930 2.898 2.854 2.981 . 0 0 "[ . 1 . 2]" 1
997 1 81 VAL H 1 82 GLU QB . . 5.000 4.666 4.546 4.989 . 0 0 "[ . 1 . 2]" 1
998 1 81 VAL H 1 82 GLU QG . . 6.000 5.110 4.289 5.506 . 0 0 "[ . 1 . 2]" 1
999 1 81 VAL H 1 83 ASP H . . 4.590 4.518 4.401 4.629 0.039 6 0 "[ . 1 . 2]" 1
1000 1 81 VAL H 1 84 TRP H . . 4.920 4.708 4.655 4.754 . 0 0 "[ . 1 . 2]" 1
1001 1 81 VAL H 1 84 TRP HB2 . . 4.580 4.489 4.372 4.554 . 0 0 "[ . 1 . 2]" 1
1002 1 81 VAL H 1 117 LEU MD2 . . 5.070 4.555 4.189 5.080 0.010 8 0 "[ . 1 . 2]" 1
1003 1 81 VAL HA 1 81 VAL MG2 . . 3.740 3.194 3.185 3.200 . 0 0 "[ . 1 . 2]" 1
1004 1 81 VAL HA 1 82 GLU QB . . 6.000 5.302 5.242 5.470 . 0 0 "[ . 1 . 2]" 1
1005 1 81 VAL HA 1 83 ASP H . . 5.000 4.511 4.339 4.686 . 0 0 "[ . 1 . 2]" 1
1006 1 81 VAL HA 1 84 TRP H . . 4.250 3.298 3.174 3.384 . 0 0 "[ . 1 . 2]" 1
1007 1 81 VAL HA 1 84 TRP HB2 . . 4.490 2.232 2.107 2.415 . 0 0 "[ . 1 . 2]" 1
1008 1 81 VAL HA 1 84 TRP HB3 . . 4.430 3.198 3.072 3.321 . 0 0 "[ . 1 . 2]" 1
1009 1 81 VAL HA 1 84 TRP HE3 . . 6.000 6.167 6.066 6.282 0.282 19 0 "[ . 1 . 2]" 1
1010 1 81 VAL HA 1 85 LEU H . . 4.580 4.059 3.849 4.362 . 0 0 "[ . 1 . 2]" 1
1011 1 81 VAL HA 1 114 LEU QD . . 5.590 5.350 4.429 5.688 0.098 17 0 "[ . 1 . 2]" 1
1012 1 81 VAL HA 1 117 LEU HB2 . . 6.000 5.142 4.889 5.495 . 0 0 "[ . 1 . 2]" 1
1013 1 81 VAL HA 1 117 LEU MD1 . . 3.880 2.235 1.956 2.672 . 0 0 "[ . 1 . 2]" 1
1014 1 81 VAL HA 1 117 LEU HG . . 5.300 2.894 2.623 3.334 . 0 0 "[ . 1 . 2]" 1
1015 1 81 VAL HB 1 82 GLU H . . 4.100 3.772 3.640 3.889 . 0 0 "[ . 1 . 2]" 1
1016 1 81 VAL HB 1 84 TRP HB2 . . 4.840 4.299 4.050 4.587 . 0 0 "[ . 1 . 2]" 1
1017 1 81 VAL HB 1 117 LEU MD2 . . 4.830 3.053 2.433 3.469 . 0 0 "[ . 1 . 2]" 1
1018 1 81 VAL HB 1 117 LEU HG . . 5.580 3.676 3.196 4.075 . 0 0 "[ . 1 . 2]" 1
1019 1 81 VAL MG1 1 82 GLU H . . 4.160 3.706 3.629 3.774 . 0 0 "[ . 1 . 2]" 1
1020 1 81 VAL MG1 1 82 GLU QG . . 5.240 5.163 4.694 5.429 0.189 4 0 "[ . 1 . 2]" 1
1021 1 81 VAL MG2 1 82 GLU H . . 4.050 1.865 1.838 1.991 . 0 0 "[ . 1 . 2]" 1
1022 1 81 VAL MG2 1 82 GLU QB . . 3.900 3.237 2.925 3.500 . 0 0 "[ . 1 . 2]" 1
1023 1 81 VAL MG2 1 82 GLU QG . . 4.840 3.007 2.534 3.958 . 0 0 "[ . 1 . 2]" 1
1024 1 81 VAL MG2 1 83 ASP H . . 4.990 4.259 4.188 4.335 . 0 0 "[ . 1 . 2]" 1
1025 1 81 VAL MG2 1 84 TRP H . . 4.930 4.706 4.643 4.768 . 0 0 "[ . 1 . 2]" 1
1026 1 81 VAL MG2 1 84 TRP HB2 . . 4.770 4.758 4.608 4.908 0.138 17 0 "[ . 1 . 2]" 1
1027 1 81 VAL MG2 1 84 TRP HB3 . . 5.160 5.223 5.092 5.364 0.204 19 0 "[ . 1 . 2]" 1
1028 1 81 VAL MG2 1 85 LEU H . . 4.780 4.924 4.791 5.093 0.313 19 0 "[ . 1 . 2]" 1
1029 1 81 VAL MG2 1 117 LEU MD1 . . 3.610 3.706 3.587 3.803 0.193 7 0 "[ . 1 . 2]" 1
1030 1 81 VAL MG2 1 117 LEU MD2 . . 4.370 3.908 3.581 4.290 . 0 0 "[ . 1 . 2]" 1
1031 1 81 VAL MG2 1 121 GLU QG . . 5.230 5.100 4.853 5.514 0.284 13 0 "[ . 1 . 2]" 1
1032 1 82 GLU H 1 82 GLU QB . . 3.260 2.193 2.100 2.376 . 0 0 "[ . 1 . 2]" 1
1033 1 82 GLU H 1 82 GLU QG . . 3.520 2.825 2.378 3.039 . 0 0 "[ . 1 . 2]" 1
1034 1 82 GLU H 1 83 ASP H . . 3.780 2.853 2.785 2.922 . 0 0 "[ . 1 . 2]" 1
1035 1 82 GLU H 1 83 ASP QB . . 5.810 4.850 4.542 5.036 . 0 0 "[ . 1 . 2]" 1
1036 1 82 GLU H 1 84 TRP H . . 4.530 4.004 3.935 4.093 . 0 0 "[ . 1 . 2]" 1
1037 1 82 GLU H 1 84 TRP HB2 . . 5.080 4.792 4.647 4.885 . 0 0 "[ . 1 . 2]" 1
1038 1 82 GLU HA 1 82 GLU QG . . 3.920 2.426 2.060 3.420 . 0 0 "[ . 1 . 2]" 1
1039 1 82 GLU HA 1 84 TRP H . . 5.100 4.340 4.229 4.468 . 0 0 "[ . 1 . 2]" 1
1040 1 82 GLU HA 1 85 LEU H . . 4.430 4.203 4.101 4.276 . 0 0 "[ . 1 . 2]" 1
1041 1 82 GLU QB 1 83 ASP H . . 3.220 2.683 2.435 3.370 0.150 10 0 "[ . 1 . 2]" 1
1042 1 82 GLU QB 1 84 TRP H . . 4.980 4.567 4.393 5.031 0.051 4 0 "[ . 1 . 2]" 1
1043 1 82 GLU QG 1 83 ASP H . . 4.510 3.802 1.766 4.371 . 0 0 "[ . 1 . 2]" 1
1044 1 83 ASP H 1 83 ASP QB . . 3.390 2.417 2.068 2.609 . 0 0 "[ . 1 . 2]" 1
1045 1 83 ASP H 1 84 TRP H . . 3.830 2.560 2.468 2.610 . 0 0 "[ . 1 . 2]" 1
1046 1 83 ASP H 1 84 TRP HB2 . . 4.660 4.384 4.301 4.430 . 0 0 "[ . 1 . 2]" 1
1047 1 83 ASP H 1 85 LEU H . . 5.170 4.863 4.794 4.936 . 0 0 "[ . 1 . 2]" 1
1048 1 83 ASP HA 1 85 LEU H . . 5.190 5.013 4.836 5.114 . 0 0 "[ . 1 . 2]" 1
1049 1 83 ASP HA 1 86 SER HB2 . . 4.330 2.558 1.994 3.584 . 0 0 "[ . 1 . 2]" 1
1050 1 83 ASP HA 1 86 SER QB . . 3.520 2.194 1.977 2.386 . 0 0 "[ . 1 . 2]" 1
1051 1 83 ASP HA 1 86 SER HB3 . . 4.330 3.113 2.259 3.702 . 0 0 "[ . 1 . 2]" 1
1052 1 83 ASP QB 1 84 TRP H . . 4.390 2.790 2.675 3.302 . 0 0 "[ . 1 . 2]" 1
1053 1 83 ASP QB 1 86 SER QB . . 5.610 3.957 3.694 4.249 . 0 0 "[ . 1 . 2]" 1
1054 1 83 ASP QB 1 87 LEU H . . 4.750 4.377 3.970 4.736 . 0 0 "[ . 1 . 2]" 1
1055 1 83 ASP QB 1 87 LEU QB . . 5.260 3.992 3.608 4.292 . 0 0 "[ . 1 . 2]" 1
1056 1 84 TRP H 1 84 TRP HB2 . . 3.680 2.094 2.075 2.122 . 0 0 "[ . 1 . 2]" 1
1057 1 84 TRP H 1 84 TRP HB3 . . 3.660 3.133 3.057 3.207 . 0 0 "[ . 1 . 2]" 1
1058 1 84 TRP H 1 84 TRP HE3 . . 5.260 5.022 4.840 5.100 . 0 0 "[ . 1 . 2]" 1
1059 1 84 TRP H 1 85 LEU H . . 4.050 3.055 3.008 3.120 . 0 0 "[ . 1 . 2]" 1
1060 1 84 TRP H 1 85 LEU QD . . 4.880 3.786 3.593 4.594 . 0 0 "[ . 1 . 2]" 1
1061 1 84 TRP H 1 86 SER H . . 5.020 4.095 3.957 4.265 . 0 0 "[ . 1 . 2]" 1
1062 1 84 TRP H 1 86 SER QB . . 5.620 4.474 4.339 4.637 . 0 0 "[ . 1 . 2]" 1
1063 1 84 TRP H 1 87 LEU H . . 5.120 4.736 4.546 4.959 . 0 0 "[ . 1 . 2]" 1
1064 1 84 TRP H 1 88 VAL QG . . 5.760 5.695 5.523 5.975 0.215 13 0 "[ . 1 . 2]" 1
1065 1 84 TRP H 1 117 LEU MD1 . . 5.180 4.380 4.196 4.553 . 0 0 "[ . 1 . 2]" 1
1066 1 84 TRP HA 1 87 LEU H . . 4.390 4.045 3.877 4.204 . 0 0 "[ . 1 . 2]" 1
1067 1 84 TRP HA 1 88 VAL H . . 5.070 4.253 4.088 4.475 . 0 0 "[ . 1 . 2]" 1
1068 1 84 TRP HA 1 88 VAL QG . . 5.920 4.237 3.726 4.715 . 0 0 "[ . 1 . 2]" 1
1069 1 84 TRP HB2 1 85 LEU H . . 5.290 3.062 2.977 3.139 . 0 0 "[ . 1 . 2]" 1
1070 1 84 TRP HB2 1 117 LEU MD1 . . 5.920 2.838 2.596 3.032 . 0 0 "[ . 1 . 2]" 1
1071 1 84 TRP HB3 1 85 LEU H . . 4.180 2.089 2.040 2.158 . 0 0 "[ . 1 . 2]" 1
1072 1 84 TRP HB3 1 85 LEU QD . . 5.140 2.023 1.935 2.178 . 0 0 "[ . 1 . 2]" 1
1073 1 84 TRP HB3 1 114 LEU QD . . 5.880 5.397 5.142 6.021 0.141 4 0 "[ . 1 . 2]" 1
1074 1 84 TRP HB3 1 117 LEU MD1 . . 5.750 2.412 2.223 2.556 . 0 0 "[ . 1 . 2]" 1
1075 1 84 TRP HB3 1 117 LEU MD2 . . 5.500 5.016 4.762 5.168 . 0 0 "[ . 1 . 2]" 1
1076 1 84 TRP HB3 1 158 LEU MD2 . . 5.260 4.920 4.715 5.212 . 0 0 "[ . 1 . 2]" 1
1077 1 84 TRP HE1 1 113 VAL QG . . 4.960 4.628 4.370 5.013 0.053 8 0 "[ . 1 . 2]" 1
1078 1 84 TRP HE1 1 114 LEU HA . . 4.080 2.056 1.878 2.554 . 0 0 "[ . 1 . 2]" 1
1079 1 84 TRP HE1 1 114 LEU HB2 . . 4.430 3.677 3.501 3.986 . 0 0 "[ . 1 . 2]" 1
1080 1 84 TRP HE1 1 114 LEU QB . . 3.770 2.241 1.921 2.719 . 0 0 "[ . 1 . 2]" 1
1081 1 84 TRP HE1 1 114 LEU HB3 . . 4.430 2.262 1.930 2.768 . 0 0 "[ . 1 . 2]" 1
1082 1 84 TRP HE1 1 114 LEU MD1 . . 4.330 2.421 1.850 3.650 . 0 0 "[ . 1 . 2]" 1
1083 1 84 TRP HE1 1 114 LEU MD2 . . 4.330 3.159 1.896 4.206 . 0 0 "[ . 1 . 2]" 1
1084 1 84 TRP HE1 1 115 VAL H . . 4.860 4.278 4.166 4.399 . 0 0 "[ . 1 . 2]" 1
1085 1 84 TRP HE1 1 115 VAL HA . . 4.730 4.499 4.350 4.623 . 0 0 "[ . 1 . 2]" 1
1086 1 84 TRP HE1 1 115 VAL QG . . 5.310 4.882 4.631 5.303 . 0 0 "[ . 1 . 2]" 1
1087 1 84 TRP HE1 1 117 LEU H . . 4.550 4.286 4.053 4.562 0.012 8 0 "[ . 1 . 2]" 1
1088 1 84 TRP HE1 1 117 LEU HB2 . . 4.230 4.001 3.860 4.231 0.001 8 0 "[ . 1 . 2]" 1
1089 1 84 TRP HE1 1 117 LEU HB3 . . 4.350 3.114 2.878 3.259 . 0 0 "[ . 1 . 2]" 1
1090 1 84 TRP HE1 1 117 LEU MD1 . . 4.480 4.212 3.864 4.425 . 0 0 "[ . 1 . 2]" 1
1091 1 84 TRP HE1 1 118 ALA H . . 4.100 3.928 3.658 4.100 0.000 10 0 "[ . 1 . 2]" 1
1092 1 84 TRP HE1 1 118 ALA MB . . 4.180 3.994 3.854 4.163 . 0 0 "[ . 1 . 2]" 1
1093 1 84 TRP HE3 1 85 LEU H . . 4.360 3.871 3.662 4.136 . 0 0 "[ . 1 . 2]" 1
1094 1 84 TRP HE3 1 85 LEU QD . . 4.180 3.184 2.903 3.689 . 0 0 "[ . 1 . 2]" 1
1095 1 84 TRP HE3 1 118 ALA H . . 5.490 5.310 5.150 5.562 0.072 6 0 "[ . 1 . 2]" 1
1096 1 84 TRP HE3 1 118 ALA MB . . 4.960 2.940 2.769 3.213 . 0 0 "[ . 1 . 2]" 1
1097 1 85 LEU H 1 85 LEU QB . . 3.570 2.489 2.262 2.559 . 0 0 "[ . 1 . 2]" 1
1098 1 85 LEU H 1 85 LEU QD . . 3.790 1.945 1.803 2.287 . 0 0 "[ . 1 . 2]" 1
1099 1 85 LEU H 1 85 LEU HG . . 4.230 3.774 2.689 4.048 . 0 0 "[ . 1 . 2]" 1
1100 1 85 LEU H 1 86 SER H . . 3.810 2.745 2.671 2.817 . 0 0 "[ . 1 . 2]" 1
1101 1 85 LEU H 1 87 LEU H . . 4.930 4.520 4.218 4.718 . 0 0 "[ . 1 . 2]" 1
1102 1 85 LEU H 1 88 VAL QG . . 4.820 4.037 3.834 4.404 . 0 0 "[ . 1 . 2]" 1
1103 1 85 LEU H 1 158 LEU MD2 . . 4.690 4.184 4.047 4.557 . 0 0 "[ . 1 . 2]" 1
1104 1 85 LEU HA 1 85 LEU QD . . 3.750 1.893 1.855 1.948 . 0 0 "[ . 1 . 2]" 1
1105 1 85 LEU HA 1 87 LEU H . . 5.010 4.620 4.192 4.863 . 0 0 "[ . 1 . 2]" 1
1106 1 85 LEU HA 1 88 VAL H . . 4.620 3.837 3.694 3.971 . 0 0 "[ . 1 . 2]" 1
1107 1 85 LEU HA 1 88 VAL QG . . 4.140 2.118 1.828 2.958 . 0 0 "[ . 1 . 2]" 1
1108 1 85 LEU HA 1 89 LYS H . . 4.760 3.841 3.442 4.115 . 0 0 "[ . 1 . 2]" 1
1109 1 85 LEU HA 1 121 GLU QG . . 5.810 5.363 5.084 5.571 . 0 0 "[ . 1 . 2]" 1
1110 1 85 LEU HA 1 158 LEU MD2 . . 3.860 2.130 1.921 2.673 . 0 0 "[ . 1 . 2]" 1
1111 1 85 LEU HA 1 158 LEU HG . . 4.590 3.978 3.629 4.427 . 0 0 "[ . 1 . 2]" 1
1112 1 85 LEU QB 1 86 SER H . . 4.050 2.464 2.328 2.637 . 0 0 "[ . 1 . 2]" 1
1113 1 85 LEU QB 1 88 VAL H . . 5.810 5.272 5.077 5.374 . 0 0 "[ . 1 . 2]" 1
1114 1 85 LEU QB 1 121 GLU QB . . 5.040 4.254 4.058 4.561 . 0 0 "[ . 1 . 2]" 1
1115 1 85 LEU QB 1 158 LEU MD2 . . 5.010 2.075 1.930 2.553 . 0 0 "[ . 1 . 2]" 1
1116 1 85 LEU QD 1 86 SER H . . 4.480 3.378 3.137 3.989 . 0 0 "[ . 1 . 2]" 1
1117 1 85 LEU QD 1 88 VAL QG . . 4.140 2.793 2.414 3.227 . 0 0 "[ . 1 . 2]" 1
1118 1 85 LEU QD 1 89 LYS QG . . 4.770 4.024 3.581 4.682 . 0 0 "[ . 1 . 2]" 1
1119 1 85 LEU QD 1 118 ALA HA . . 4.360 2.517 2.283 2.693 . 0 0 "[ . 1 . 2]" 1
1120 1 85 LEU QD 1 118 ALA MB . . 4.090 3.025 2.816 3.173 . 0 0 "[ . 1 . 2]" 1
1121 1 85 LEU QD 1 121 GLU H . . 4.750 3.941 3.724 4.210 . 0 0 "[ . 1 . 2]" 1
1122 1 85 LEU QD 1 121 GLU QB . . 3.630 1.995 1.684 2.208 . 0 0 "[ . 1 . 2]" 1
1123 1 85 LEU QD 1 121 GLU QG . . 3.440 1.982 1.885 2.183 . 0 0 "[ . 1 . 2]" 1
1124 1 85 LEU QD 1 158 LEU MD2 . . 3.580 1.860 1.664 1.984 . 0 0 "[ . 1 . 2]" 1
1125 1 85 LEU QD 1 158 LEU HG . . 4.170 2.761 2.219 3.404 . 0 0 "[ . 1 . 2]" 1
1126 1 85 LEU HG 1 86 SER H . . 5.230 5.032 4.514 5.160 . 0 0 "[ . 1 . 2]" 1
1127 1 85 LEU HG 1 118 ALA HA . . 5.230 5.036 4.733 5.257 0.027 15 0 "[ . 1 . 2]" 1
1128 1 85 LEU HG 1 121 GLU HB2 . . 3.970 3.686 3.351 4.118 0.148 4 0 "[ . 1 . 2]" 1
1129 1 85 LEU HG 1 121 GLU QB . . 3.460 2.873 2.627 3.559 0.099 4 0 "[ . 1 . 2]" 1
1130 1 85 LEU HG 1 121 GLU HB3 . . 3.970 3.004 2.742 3.894 . 0 0 "[ . 1 . 2]" 1
1131 1 85 LEU HG 1 121 GLU QG . . 4.300 3.445 2.755 4.016 . 0 0 "[ . 1 . 2]" 1
1132 1 85 LEU HG 1 157 ARG H . . 5.610 4.665 4.085 5.690 0.080 4 0 "[ . 1 . 2]" 1
1133 1 85 LEU HG 1 157 ARG QD . . 4.440 3.224 1.935 4.375 . 0 0 "[ . 1 . 2]" 1
1134 1 86 SER H 1 86 SER HB2 . . 4.160 2.351 2.181 2.650 . 0 0 "[ . 1 . 2]" 1
1135 1 86 SER H 1 86 SER QB . . 3.400 2.266 2.160 2.390 . 0 0 "[ . 1 . 2]" 1
1136 1 86 SER H 1 86 SER HB3 . . 4.160 3.241 2.454 3.586 . 0 0 "[ . 1 . 2]" 1
1137 1 86 SER H 1 87 LEU H . . 3.690 2.949 2.783 3.057 . 0 0 "[ . 1 . 2]" 1
1138 1 86 SER H 1 87 LEU QB . . 4.880 4.565 4.393 4.685 . 0 0 "[ . 1 . 2]" 1
1139 1 86 SER H 1 88 VAL H . . 4.930 4.709 4.374 4.924 . 0 0 "[ . 1 . 2]" 1
1140 1 86 SER H 1 89 LYS QD . . 4.880 4.167 3.552 4.992 0.112 12 0 "[ . 1 . 2]" 1
1141 1 86 SER H 1 158 LEU MD2 . . 5.650 4.672 4.477 5.112 . 0 0 "[ . 1 . 2]" 1
1142 1 86 SER HA 1 88 VAL QG . . 5.920 4.804 4.308 5.661 . 0 0 "[ . 1 . 2]" 1
1143 1 86 SER HA 1 89 LYS H . . 4.520 3.866 3.649 4.180 . 0 0 "[ . 1 . 2]" 1
1144 1 86 SER HA 1 89 LYS HB2 . . 4.310 2.692 2.429 3.004 . 0 0 "[ . 1 . 2]" 1
1145 1 86 SER HA 1 89 LYS QD . . 4.350 3.216 2.494 4.385 0.035 12 0 "[ . 1 . 2]" 1
1146 1 86 SER HA 1 89 LYS QG . . 5.070 4.301 4.108 4.772 . 0 0 "[ . 1 . 2]" 1
1147 1 86 SER HA 1 90 ALA H . . 4.780 4.309 4.018 4.465 . 0 0 "[ . 1 . 2]" 1
1148 1 86 SER HA 1 90 ALA MB . . 5.470 4.203 3.930 4.426 . 0 0 "[ . 1 . 2]" 1
1149 1 86 SER HA 1 158 LEU MD2 . . 5.440 5.062 4.823 5.440 . 0 0 "[ . 1 . 2]" 1
1150 1 86 SER QB 1 87 LEU H . . 3.670 2.380 2.182 2.635 . 0 0 "[ . 1 . 2]" 1
1151 1 86 SER QB 1 87 LEU QB . . 5.360 3.815 3.721 3.986 . 0 0 "[ . 1 . 2]" 1
1152 1 86 SER QB 1 87 LEU MD2 . . 5.810 5.498 5.394 5.676 . 0 0 "[ . 1 . 2]" 1
1153 1 86 SER QB 1 89 LYS HB2 . . 5.810 4.642 4.328 4.972 . 0 0 "[ . 1 . 2]" 1
1154 1 86 SER QB 1 90 ALA H . . 5.810 5.076 4.854 5.376 . 0 0 "[ . 1 . 2]" 1
1155 1 86 SER HB2 1 87 LEU H . . 4.490 2.941 2.361 3.999 . 0 0 "[ . 1 . 2]" 1
1156 1 86 SER HB3 1 87 LEU H . . 4.490 2.823 2.200 3.506 . 0 0 "[ . 1 . 2]" 1
1157 1 87 LEU H 1 87 LEU HB2 . . 3.470 2.863 2.832 2.942 . 0 0 "[ . 1 . 2]" 1
1158 1 87 LEU H 1 87 LEU HB3 . . 3.470 2.201 2.163 2.225 . 0 0 "[ . 1 . 2]" 1
1159 1 87 LEU H 1 87 LEU MD1 . . 4.320 4.294 4.272 4.329 0.009 9 0 "[ . 1 . 2]" 1
1160 1 87 LEU H 1 87 LEU MD2 . . 4.240 4.118 4.081 4.154 . 0 0 "[ . 1 . 2]" 1
1161 1 87 LEU H 1 87 LEU HG . . 4.640 4.203 4.130 4.237 . 0 0 "[ . 1 . 2]" 1
1162 1 87 LEU H 1 88 VAL H . . 3.640 2.974 2.840 3.044 . 0 0 "[ . 1 . 2]" 1
1163 1 87 LEU H 1 88 VAL QG . . 4.350 4.009 3.743 4.254 . 0 0 "[ . 1 . 2]" 1
1164 1 87 LEU H 1 89 LYS H . . 4.980 4.037 3.660 4.705 . 0 0 "[ . 1 . 2]" 1
1165 1 87 LEU H 1 89 LYS HB2 . . 5.420 4.873 4.643 5.344 . 0 0 "[ . 1 . 2]" 1
1166 1 87 LEU H 1 90 ALA H . . 4.880 4.571 4.340 4.816 . 0 0 "[ . 1 . 2]" 1
1167 1 87 LEU H 1 90 ALA MB . . 5.080 4.482 4.276 4.623 . 0 0 "[ . 1 . 2]" 1
1168 1 87 LEU HA 1 87 LEU MD1 . . 3.540 2.550 2.418 2.618 . 0 0 "[ . 1 . 2]" 1
1169 1 87 LEU HA 1 87 LEU MD2 . . 4.570 4.000 3.963 4.018 . 0 0 "[ . 1 . 2]" 1
1170 1 87 LEU HA 1 88 VAL QG . . 5.920 4.779 4.610 4.878 . 0 0 "[ . 1 . 2]" 1
1171 1 87 LEU HA 1 89 LYS H . . 5.080 4.262 3.846 5.163 0.083 18 0 "[ . 1 . 2]" 1
1172 1 87 LEU HA 1 90 ALA H . . 3.810 3.335 3.023 3.771 . 0 0 "[ . 1 . 2]" 1
1173 1 87 LEU HA 1 90 ALA MB . . 3.790 2.582 2.380 2.855 . 0 0 "[ . 1 . 2]" 1
1174 1 87 LEU HA 1 91 LYS H . . 4.360 3.511 3.157 3.924 . 0 0 "[ . 1 . 2]" 1
1175 1 87 LEU QB 1 91 LYS H . . 5.330 4.866 4.598 5.186 . 0 0 "[ . 1 . 2]" 1
1176 1 87 LEU HB2 1 88 VAL H . . 4.310 3.771 3.678 3.931 . 0 0 "[ . 1 . 2]" 1
1177 1 87 LEU HB3 1 88 VAL H . . 4.310 2.406 2.249 2.636 . 0 0 "[ . 1 . 2]" 1
1178 1 87 LEU MD1 1 88 VAL H . . 4.730 3.808 3.718 3.981 . 0 0 "[ . 1 . 2]" 1
1179 1 87 LEU MD1 1 90 ALA H . . 4.890 4.291 4.089 4.540 . 0 0 "[ . 1 . 2]" 1
1180 1 87 LEU MD1 1 91 LYS QB . . 3.480 2.528 2.221 2.877 . 0 0 "[ . 1 . 2]" 1
1181 1 87 LEU MD1 1 91 LYS QE . . 4.780 4.510 4.355 4.656 . 0 0 "[ . 1 . 2]" 1
1182 1 87 LEU MD1 1 92 PHE H . . 5.230 4.972 4.727 5.188 . 0 0 "[ . 1 . 2]" 1
1183 1 87 LEU MD2 1 88 VAL H . . 4.250 3.389 3.264 3.630 . 0 0 "[ . 1 . 2]" 1
1184 1 87 LEU MD2 1 88 VAL HA . . 4.600 4.198 4.091 4.326 . 0 0 "[ . 1 . 2]" 1
1185 1 87 LEU HG 1 88 VAL H . . 4.350 2.454 2.366 2.639 . 0 0 "[ . 1 . 2]" 1
1186 1 87 LEU HG 1 88 VAL QG . . 5.050 3.474 2.535 3.919 . 0 0 "[ . 1 . 2]" 1
1187 1 88 VAL H 1 88 VAL HB . . 3.930 2.503 2.277 2.871 . 0 0 "[ . 1 . 2]" 1
1188 1 88 VAL H 1 88 VAL MG1 . . 3.870 2.759 1.905 3.767 . 0 0 "[ . 1 . 2]" 1
1189 1 88 VAL H 1 88 VAL QG . . 3.350 2.207 1.887 2.542 . 0 0 "[ . 1 . 2]" 1
1190 1 88 VAL H 1 88 VAL MG2 . . 3.870 3.196 1.893 3.763 . 0 0 "[ . 1 . 2]" 1
1191 1 88 VAL H 1 89 LYS H . . 3.910 2.837 2.736 3.076 . 0 0 "[ . 1 . 2]" 1
1192 1 88 VAL H 1 91 LYS QG . . 5.000 3.750 3.595 3.864 . 0 0 "[ . 1 . 2]" 1
1193 1 88 VAL HA 1 90 ALA H . . 4.490 4.072 3.774 4.468 . 0 0 "[ . 1 . 2]" 1
1194 1 88 VAL HA 1 91 LYS H . . 4.360 4.015 3.662 4.344 . 0 0 "[ . 1 . 2]" 1
1195 1 88 VAL HA 1 91 LYS QB . . 4.680 4.181 3.988 4.425 . 0 0 "[ . 1 . 2]" 1
1196 1 88 VAL HA 1 91 LYS QD . . 4.800 2.174 2.038 2.329 . 0 0 "[ . 1 . 2]" 1
1197 1 88 VAL QG 1 89 LYS H . . 3.490 2.544 1.771 3.415 . 0 0 "[ . 1 . 2]" 1
1198 1 88 VAL QG 1 89 LYS HA . . 4.320 3.223 2.988 3.691 . 0 0 "[ . 1 . 2]" 1
1199 1 88 VAL QG 1 89 LYS QG . . 5.360 2.671 2.079 4.339 . 0 0 "[ . 1 . 2]" 1
1200 1 88 VAL QG 1 90 ALA H . . 5.060 4.093 3.666 4.552 . 0 0 "[ . 1 . 2]" 1
1201 1 88 VAL QG 1 90 ALA MB . . 5.530 4.981 4.650 5.259 . 0 0 "[ . 1 . 2]" 1
1202 1 88 VAL QG 1 91 LYS H . . 5.810 4.866 4.561 5.081 . 0 0 "[ . 1 . 2]" 1
1203 1 88 VAL QG 1 92 PHE H . . 4.750 4.286 3.647 4.644 . 0 0 "[ . 1 . 2]" 1
1204 1 88 VAL QG 1 92 PHE HA . . 5.920 5.454 4.764 5.860 . 0 0 "[ . 1 . 2]" 1
1205 1 88 VAL QG 1 92 PHE HB3 . . 4.670 3.565 2.605 3.904 . 0 0 "[ . 1 . 2]" 1
1206 1 88 VAL QG 1 92 PHE HD2 . . 4.460 4.484 4.391 5.003 0.543 10 1 "[ . + . 2]" 1
1207 1 88 VAL QG 1 118 ALA HA . . 5.920 4.364 4.071 4.690 . 0 0 "[ . 1 . 2]" 1
1208 1 88 VAL QG 1 118 ALA MB . . 3.880 2.957 2.600 3.193 . 0 0 "[ . 1 . 2]" 1
1209 1 88 VAL QG 1 158 LEU HA . . 5.920 4.730 4.126 5.661 . 0 0 "[ . 1 . 2]" 1
1210 1 88 VAL QG 1 158 LEU MD2 . . 3.530 2.339 1.792 3.292 . 0 0 "[ . 1 . 2]" 1
1211 1 88 VAL QG 1 158 LEU HG . . 4.060 3.029 2.347 3.958 . 0 0 "[ . 1 . 2]" 1
1212 1 88 VAL MG1 1 89 LYS H . . 4.150 2.650 1.779 3.731 . 0 0 "[ . 1 . 2]" 1
1213 1 88 VAL MG1 1 89 LYS HA . . 5.560 3.341 3.145 3.775 . 0 0 "[ . 1 . 2]" 1
1214 1 88 VAL MG1 1 92 PHE H . . 5.810 5.030 3.868 5.491 . 0 0 "[ . 1 . 2]" 1
1215 1 88 VAL MG1 1 118 ALA MB . . 4.480 3.431 3.075 4.149 . 0 0 "[ . 1 . 2]" 1
1216 1 88 VAL MG1 1 158 LEU MD2 . . 4.100 2.458 1.799 3.783 . 0 0 "[ . 1 . 2]" 1
1217 1 88 VAL MG1 1 158 LEU HG . . 4.790 3.160 2.378 4.461 . 0 0 "[ . 1 . 2]" 1
1218 1 88 VAL MG2 1 89 LYS H . . 4.150 3.800 3.276 4.087 . 0 0 "[ . 1 . 2]" 1
1219 1 88 VAL MG2 1 89 LYS HA . . 5.560 4.343 3.475 5.456 . 0 0 "[ . 1 . 2]" 1
1220 1 88 VAL MG2 1 92 PHE H . . 5.810 4.949 3.729 5.947 0.137 6 0 "[ . 1 . 2]" 1
1221 1 88 VAL MG2 1 118 ALA MB . . 4.480 3.394 2.682 4.159 . 0 0 "[ . 1 . 2]" 1
1222 1 88 VAL MG2 1 158 LEU MD2 . . 4.100 3.683 3.300 4.055 . 0 0 "[ . 1 . 2]" 1
1223 1 88 VAL MG2 1 158 LEU HG . . 4.790 4.080 3.469 4.646 . 0 0 "[ . 1 . 2]" 1
1224 1 89 LYS H 1 89 LYS HB2 . . 3.030 2.315 2.105 2.482 . 0 0 "[ . 1 . 2]" 1
1225 1 89 LYS H 1 89 LYS QD . . 4.130 3.830 2.804 4.477 0.347 12 0 "[ . 1 . 2]" 1
1226 1 89 LYS H 1 89 LYS QG . . 3.590 2.745 2.186 3.526 . 0 0 "[ . 1 . 2]" 1
1227 1 89 LYS H 1 158 LEU MD2 . . 3.930 3.833 3.368 4.067 0.137 9 0 "[ . 1 . 2]" 1
1228 1 89 LYS HA 1 89 LYS QE . . 4.650 4.298 3.837 4.688 0.038 4 0 "[ . 1 . 2]" 1
1229 1 89 LYS HA 1 89 LYS QG . . 3.970 2.331 2.036 2.439 . 0 0 "[ . 1 . 2]" 1
1230 1 89 LYS HA 1 93 CYS QB . . 5.690 3.983 3.756 4.128 . 0 0 "[ . 1 . 2]" 1
1231 1 89 LYS HA 1 158 LEU MD2 . . 4.260 4.186 3.932 4.349 0.089 10 0 "[ . 1 . 2]" 1
1232 1 89 LYS HB2 1 89 LYS QD . . 3.040 2.357 2.074 3.057 0.017 12 0 "[ . 1 . 2]" 1
1233 1 89 LYS HB2 1 89 LYS QE . . 5.050 3.182 1.944 4.051 . 0 0 "[ . 1 . 2]" 1
1234 1 89 LYS HB2 1 90 ALA H . . 3.270 3.096 2.795 3.343 0.073 4 0 "[ . 1 . 2]" 1
1235 1 89 LYS HB2 1 90 ALA HA . . 4.820 4.677 4.460 5.071 0.251 4 0 "[ . 1 . 2]" 1
1236 1 89 LYS HB2 1 92 PHE H . . 6.000 5.970 5.734 6.090 0.090 4 0 "[ . 1 . 2]" 1
1237 1 89 LYS QD 1 90 ALA H . . 5.340 5.162 4.840 5.452 0.112 12 0 "[ . 1 . 2]" 1
1238 1 89 LYS QD 1 157 ARG QG . . 3.450 2.866 1.960 3.557 0.107 13 0 "[ . 1 . 2]" 1
1239 1 89 LYS QE 1 157 ARG HA . . 6.000 4.356 3.347 5.202 . 0 0 "[ . 1 . 2]" 1
1240 1 89 LYS QE 1 157 ARG QG . . 3.660 3.114 2.228 4.061 0.401 13 0 "[ . 1 . 2]" 1
1241 1 89 LYS QE 1 158 LEU MD2 . . 4.680 3.461 1.897 4.228 . 0 0 "[ . 1 . 2]" 1
1242 1 89 LYS QG 1 158 LEU HA . . 4.880 3.517 3.065 4.087 . 0 0 "[ . 1 . 2]" 1
1243 1 89 LYS QG 1 158 LEU MD2 . . 3.320 2.020 1.847 3.332 0.012 4 0 "[ . 1 . 2]" 1
1244 1 90 ALA H 1 90 ALA MB . . 2.830 2.294 2.248 2.314 . 0 0 "[ . 1 . 2]" 1
1245 1 90 ALA H 1 91 LYS H . . 3.510 2.615 2.525 2.798 . 0 0 "[ . 1 . 2]" 1
1246 1 90 ALA H 1 91 LYS QD . . 5.480 5.222 5.151 5.452 . 0 0 "[ . 1 . 2]" 1
1247 1 90 ALA H 1 91 LYS QG . . 3.980 3.200 3.119 3.425 . 0 0 "[ . 1 . 2]" 1
1248 1 90 ALA H 1 93 CYS QB . . 5.000 4.374 4.304 4.493 . 0 0 "[ . 1 . 2]" 1
1249 1 90 ALA HA 1 92 PHE H . . 4.590 4.104 3.984 4.300 . 0 0 "[ . 1 . 2]" 1
1250 1 90 ALA HA 1 93 CYS H . . 3.960 3.124 3.046 3.311 . 0 0 "[ . 1 . 2]" 1
1251 1 90 ALA HA 1 93 CYS QB . . 4.010 2.269 2.150 2.602 . 0 0 "[ . 1 . 2]" 1
1252 1 90 ALA HA 1 94 GLU HG2 . . 4.530 4.393 4.162 4.584 0.054 18 0 "[ . 1 . 2]" 1
1253 1 90 ALA MB 1 91 LYS H . . 3.140 2.103 2.044 2.159 . 0 0 "[ . 1 . 2]" 1
1254 1 90 ALA MB 1 91 LYS HA . . 3.820 3.719 3.699 3.728 . 0 0 "[ . 1 . 2]" 1
1255 1 90 ALA MB 1 92 PHE H . . 4.870 4.171 4.103 4.238 . 0 0 "[ . 1 . 2]" 1
1256 1 90 ALA MB 1 93 CYS H . . 4.500 4.254 4.169 4.430 . 0 0 "[ . 1 . 2]" 1
1257 1 90 ALA MB 1 93 CYS QB . . 4.280 3.802 3.661 4.086 . 0 0 "[ . 1 . 2]" 1
1258 1 90 ALA MB 1 94 GLU H . . 4.510 4.486 4.417 4.560 0.050 10 0 "[ . 1 . 2]" 1
1259 1 91 LYS H 1 91 LYS QB . . 3.060 2.665 2.653 2.678 . 0 0 "[ . 1 . 2]" 1
1260 1 91 LYS H 1 91 LYS QD . . 4.780 4.024 4.004 4.047 . 0 0 "[ . 1 . 2]" 1
1261 1 91 LYS H 1 91 LYS QE . . 4.920 3.543 3.455 3.610 . 0 0 "[ . 1 . 2]" 1
1262 1 91 LYS H 1 91 LYS QG . . 3.880 1.905 1.874 1.939 . 0 0 "[ . 1 . 2]" 1
1263 1 91 LYS H 1 92 PHE H . . 3.810 2.842 2.782 2.894 . 0 0 "[ . 1 . 2]" 1
1264 1 91 LYS H 1 93 CYS H . . 4.820 4.098 3.985 4.302 . 0 0 "[ . 1 . 2]" 1
1265 1 91 LYS H 1 94 GLU H . . 4.810 4.722 4.663 4.798 . 0 0 "[ . 1 . 2]" 1
1266 1 91 LYS HA 1 91 LYS QD . . 4.360 4.253 4.210 4.310 . 0 0 "[ . 1 . 2]" 1
1267 1 91 LYS HA 1 91 LYS QE . . 4.800 4.158 4.069 4.225 . 0 0 "[ . 1 . 2]" 1
1268 1 91 LYS HA 1 93 CYS H . . 4.880 4.404 4.157 4.688 . 0 0 "[ . 1 . 2]" 1
1269 1 91 LYS HA 1 94 GLU H . . 4.270 3.672 3.508 3.793 . 0 0 "[ . 1 . 2]" 1
1270 1 91 LYS HA 1 94 GLU HG2 . . 5.140 1.997 1.913 2.108 . 0 0 "[ . 1 . 2]" 1
1271 1 91 LYS HA 1 95 ALA H . . 4.590 4.137 3.959 4.392 . 0 0 "[ . 1 . 2]" 1
1272 1 91 LYS QB 1 91 LYS QE . . 4.210 2.853 2.713 2.979 . 0 0 "[ . 1 . 2]" 1
1273 1 91 LYS QB 1 92 PHE H . . 4.210 3.385 3.312 3.446 . 0 0 "[ . 1 . 2]" 1
1274 1 91 LYS QB 1 92 PHE HB3 . . 5.810 4.937 4.793 5.005 . 0 0 "[ . 1 . 2]" 1
1275 1 91 LYS QD 1 92 PHE H . . 3.980 3.611 3.491 3.696 . 0 0 "[ . 1 . 2]" 1
1276 1 91 LYS QE 1 92 PHE H . . 5.280 1.821 1.729 1.892 . 0 0 "[ . 1 . 2]" 1
1277 1 91 LYS QG 1 92 PHE H . . 4.480 2.247 2.137 2.363 . 0 0 "[ . 1 . 2]" 1
1278 1 92 PHE H 1 92 PHE HB2 . . 3.480 3.125 3.037 3.341 . 0 0 "[ . 1 . 2]" 1
1279 1 92 PHE H 1 92 PHE HB3 . . 3.890 2.198 2.134 2.224 . 0 0 "[ . 1 . 2]" 1
1280 1 92 PHE H 1 92 PHE HD2 . . 5.330 4.083 3.896 5.195 . 0 0 "[ . 1 . 2]" 1
1281 1 92 PHE H 1 93 CYS H . . 3.160 2.319 2.264 2.408 . 0 0 "[ . 1 . 2]" 1
1282 1 92 PHE H 1 93 CYS HA . . 5.040 4.999 4.958 5.075 0.035 10 0 "[ . 1 . 2]" 1
1283 1 92 PHE H 1 94 GLU H . . 4.610 3.703 3.578 3.875 . 0 0 "[ . 1 . 2]" 1
1284 1 92 PHE H 1 94 GLU HB3 . . 5.850 5.779 5.492 5.996 0.146 4 0 "[ . 1 . 2]" 1
1285 1 92 PHE H 1 95 ALA H . . 4.920 4.598 4.414 4.775 . 0 0 "[ . 1 . 2]" 1
1286 1 92 PHE HA 1 95 ALA H . . 4.430 3.412 3.327 3.529 . 0 0 "[ . 1 . 2]" 1
1287 1 92 PHE HA 1 95 ALA MB . . 4.620 3.716 3.568 3.905 . 0 0 "[ . 1 . 2]" 1
1288 1 92 PHE HB2 1 95 ALA MB . . 6.000 5.596 5.420 5.815 . 0 0 "[ . 1 . 2]" 1
1289 1 92 PHE HB3 1 92 PHE HE2 . . 4.770 4.656 4.599 5.405 0.635 10 1 "[ . + . 2]" 1
1290 1 92 PHE HB3 1 93 CYS H . . 4.580 3.064 2.946 3.214 . 0 0 "[ . 1 . 2]" 1
1291 1 92 PHE HB3 1 93 CYS HA . . 5.500 4.841 4.781 5.108 . 0 0 "[ . 1 . 2]" 1
1292 1 92 PHE HB3 1 95 ALA MB . . 6.000 6.170 5.889 6.363 0.363 15 0 "[ . 1 . 2]" 1
1293 1 92 PHE HE2 1 93 CYS H . . 5.400 5.432 5.311 5.934 0.534 10 1 "[ . + . 2]" 1
1294 1 93 CYS H 1 93 CYS QB . . 2.970 2.276 2.252 2.285 . 0 0 "[ . 1 . 2]" 1
1295 1 93 CYS H 1 94 GLU H . . 3.410 2.373 2.260 2.469 . 0 0 "[ . 1 . 2]" 1
1296 1 93 CYS H 1 94 GLU HB3 . . 4.830 4.705 4.624 4.759 . 0 0 "[ . 1 . 2]" 1
1297 1 93 CYS H 1 94 GLU HG3 . . 5.020 4.101 3.769 4.378 . 0 0 "[ . 1 . 2]" 1
1298 1 93 CYS H 1 95 ALA H . . 4.200 3.919 3.743 4.040 . 0 0 "[ . 1 . 2]" 1
1299 1 93 CYS H 1 95 ALA MB . . 5.550 5.434 5.273 5.530 . 0 0 "[ . 1 . 2]" 1
1300 1 93 CYS HA 1 94 GLU HA . . 5.060 4.607 4.582 4.658 . 0 0 "[ . 1 . 2]" 1
1301 1 93 CYS HA 1 95 ALA H . . 4.740 4.326 4.069 4.565 . 0 0 "[ . 1 . 2]" 1
1302 1 93 CYS QB 1 94 GLU H . . 3.250 3.127 3.004 3.191 . 0 0 "[ . 1 . 2]" 1
1303 1 93 CYS QB 1 94 GLU HB3 . . 5.050 4.223 4.089 4.328 . 0 0 "[ . 1 . 2]" 1
1304 1 93 CYS QB 1 94 GLU HG2 . . 4.900 4.891 4.577 5.065 0.165 10 0 "[ . 1 . 2]" 1
1305 1 93 CYS QB 1 94 GLU HG3 . . 5.850 4.963 4.735 5.132 . 0 0 "[ . 1 . 2]" 1
1306 1 93 CYS QB 1 95 ALA H . . 5.090 4.902 4.758 5.039 . 0 0 "[ . 1 . 2]" 1
1307 1 94 GLU H 1 94 GLU HB3 . . 3.120 2.839 2.756 2.890 . 0 0 "[ . 1 . 2]" 1
1308 1 94 GLU H 1 94 GLU HG2 . . 4.620 2.911 2.607 3.064 . 0 0 "[ . 1 . 2]" 1
1309 1 94 GLU H 1 94 GLU HG3 . . 3.610 2.173 1.947 2.359 . 0 0 "[ . 1 . 2]" 1
1310 1 94 GLU H 1 95 ALA H . . 3.400 2.144 2.075 2.276 . 0 0 "[ . 1 . 2]" 1
1311 1 94 GLU H 1 95 ALA MB . . 4.090 4.098 4.021 4.175 0.085 18 0 "[ . 1 . 2]" 1
1312 1 94 GLU HA 1 94 GLU HG3 . . 4.190 3.570 3.566 3.584 . 0 0 "[ . 1 . 2]" 1
1313 1 94 GLU HB2 1 95 ALA H . . 4.550 3.949 3.735 4.054 . 0 0 "[ . 1 . 2]" 1
1314 1 94 GLU HB2 1 95 ALA MB . . 4.520 4.235 4.099 4.388 . 0 0 "[ . 1 . 2]" 1
1315 1 94 GLU HB3 1 95 ALA H . . 4.050 4.057 3.985 4.159 0.109 18 0 "[ . 1 . 2]" 1
1316 1 94 GLU HG3 1 95 ALA H . . 4.190 2.072 1.914 2.255 . 0 0 "[ . 1 . 2]" 1
1317 1 94 GLU HG3 1 95 ALA MB . . 4.290 2.848 2.612 3.020 . 0 0 "[ . 1 . 2]" 1
1318 1 94 GLU HG3 1 96 PRO QD . . 5.650 5.572 5.420 5.697 0.047 6 0 "[ . 1 . 2]" 1
1319 1 95 ALA H 1 95 ALA MB . . 3.170 2.489 2.237 2.598 . 0 0 "[ . 1 . 2]" 1
1320 1 95 ALA H 1 96 PRO HD2 . . 5.020 4.808 4.751 4.833 . 0 0 "[ . 1 . 2]" 1
1321 1 95 ALA H 1 96 PRO HD3 . . 5.020 4.977 4.905 5.091 0.071 6 0 "[ . 1 . 2]" 1
1322 1 95 ALA H 1 98 SER H . . 5.130 4.903 4.624 5.530 0.400 8 0 "[ . 1 . 2]" 1
1323 1 95 ALA HA 1 96 PRO HD2 . . 3.740 2.412 2.278 2.539 . 0 0 "[ . 1 . 2]" 1
1324 1 95 ALA HA 1 96 PRO QD . . 3.260 2.097 2.023 2.174 . 0 0 "[ . 1 . 2]" 1
1325 1 95 ALA HA 1 96 PRO HD3 . . 3.740 2.306 2.263 2.364 . 0 0 "[ . 1 . 2]" 1
1326 1 95 ALA HA 1 96 PRO QG . . 5.140 4.010 3.928 4.093 . 0 0 "[ . 1 . 2]" 1
1327 1 95 ALA MB 1 96 PRO HA . . 4.580 4.422 4.342 4.474 . 0 0 "[ . 1 . 2]" 1
1328 1 95 ALA MB 1 96 PRO HD2 . . 4.450 1.994 1.937 2.227 . 0 0 "[ . 1 . 2]" 1
1329 1 95 ALA MB 1 96 PRO QD . . 3.720 1.976 1.921 2.199 . 0 0 "[ . 1 . 2]" 1
1330 1 95 ALA MB 1 96 PRO HD3 . . 4.450 3.222 3.105 3.395 . 0 0 "[ . 1 . 2]" 1
1331 1 95 ALA MB 1 96 PRO QG . . 4.680 3.508 3.369 3.734 . 0 0 "[ . 1 . 2]" 1
1332 1 95 ALA MB 1 98 SER H . . 3.650 2.633 2.049 2.803 . 0 0 "[ . 1 . 2]" 1
1333 1 95 ALA MB 1 98 SER HA . . 4.600 4.090 3.962 4.345 . 0 0 "[ . 1 . 2]" 1
1334 1 95 ALA MB 1 98 SER QB . . 3.950 2.003 1.818 3.029 . 0 0 "[ . 1 . 2]" 1
1335 1 95 ALA MB 1 99 CYS H . . 5.060 4.385 3.861 4.775 . 0 0 "[ . 1 . 2]" 1
1336 1 96 PRO HA 1 97 GLY H . . 3.360 2.635 2.332 3.460 0.100 18 0 "[ . 1 . 2]" 1
1337 1 96 PRO HB2 1 98 SER H . . 4.560 4.600 4.232 4.790 0.230 6 0 "[ . 1 . 2]" 1
1338 1 96 PRO QG 1 97 GLY H . . 5.000 4.114 1.846 4.716 . 0 0 "[ . 1 . 2]" 1
1339 1 97 GLY H 1 98 SER H . . 4.300 2.696 1.910 2.848 . 0 0 "[ . 1 . 2]" 1
1340 1 98 SER H 1 98 SER QB . . 3.720 2.419 2.177 2.882 . 0 0 "[ . 1 . 2]" 1
1341 1 98 SER H 1 99 CYS H . . 5.200 4.384 3.525 4.526 . 0 0 "[ . 1 . 2]" 1
1342 1 98 SER QB 1 99 CYS H . . 4.830 1.848 1.808 1.926 . 0 0 "[ . 1 . 2]" 1
1343 1 99 CYS H 1 100 VAL H . . 5.240 4.494 4.353 4.545 . 0 0 "[ . 1 . 2]" 1
1344 1 99 CYS QB 1 100 VAL QG . . 4.440 3.711 3.565 3.847 . 0 0 "[ . 1 . 2]" 1
1345 1 99 CYS HB2 1 100 VAL H . . 4.580 3.635 3.425 3.930 . 0 0 "[ . 1 . 2]" 1
1346 1 99 CYS HB3 1 100 VAL H . . 4.580 2.446 2.301 2.579 . 0 0 "[ . 1 . 2]" 1
1347 1 100 VAL H 1 100 VAL HB . . 3.940 3.472 3.228 3.717 . 0 0 "[ . 1 . 2]" 1
1348 1 100 VAL H 1 101 ALA H . . 5.030 4.252 4.074 4.410 . 0 0 "[ . 1 . 2]" 1
1349 1 100 VAL H 1 102 VAL H . . 6.000 6.164 6.032 6.292 0.292 3 0 "[ . 1 . 2]" 1
1350 1 100 VAL HB 1 101 ALA H . . 5.310 3.729 3.471 3.936 . 0 0 "[ . 1 . 2]" 1
1351 1 100 VAL HB 1 101 ALA MB . . 5.300 5.199 5.123 5.297 . 0 0 "[ . 1 . 2]" 1
1352 1 100 VAL QG 1 101 ALA H . . 4.560 3.050 2.641 3.314 . 0 0 "[ . 1 . 2]" 1
1353 1 101 ALA H 1 102 VAL H . . 5.050 4.424 4.333 4.493 . 0 0 "[ . 1 . 2]" 1
1354 1 101 ALA HA 1 102 VAL QG . . 4.700 3.421 3.327 4.211 . 0 0 "[ . 1 . 2]" 1
1355 1 101 ALA MB 1 102 VAL H . . 3.890 3.246 3.188 3.273 . 0 0 "[ . 1 . 2]" 1
1356 1 102 VAL H 1 102 VAL QG . . 3.540 2.223 2.101 3.138 . 0 0 "[ . 1 . 2]" 1
1357 1 102 VAL H 1 103 HIS H . . 4.670 4.411 4.376 4.460 . 0 0 "[ . 1 . 2]" 1
1358 1 102 VAL HB 1 103 HIS H . . 4.760 2.875 2.742 4.188 . 0 0 "[ . 1 . 2]" 1
1359 1 102 VAL QG 1 103 HIS H . . 3.740 3.267 2.137 3.390 . 0 0 "[ . 1 . 2]" 1
1360 1 102 VAL QG 1 103 HIS HA . . 4.250 3.999 3.520 4.182 . 0 0 "[ . 1 . 2]" 1
1361 1 104 CYS HB2 1 105 VAL H . . 5.340 3.834 2.696 4.409 . 0 0 "[ . 1 . 2]" 1
1362 1 104 CYS HB3 1 105 VAL H . . 5.340 3.606 2.619 4.236 . 0 0 "[ . 1 . 2]" 1
1363 1 105 VAL H 1 105 VAL QG . . 4.210 1.946 1.751 2.416 . 0 0 "[ . 1 . 2]" 1
1364 1 105 VAL H 1 106 ALA H . . 4.750 3.695 3.029 4.391 . 0 0 "[ . 1 . 2]" 1
1365 1 105 VAL H 1 106 ALA MB . . 5.720 5.293 4.924 5.625 . 0 0 "[ . 1 . 2]" 1
1366 1 105 VAL H 1 107 GLY H . . 4.810 3.919 3.722 4.116 . 0 0 "[ . 1 . 2]" 1
1367 1 105 VAL H 1 110 ARG QD . . 5.740 4.125 2.216 5.821 0.081 11 0 "[ . 1 . 2]" 1
1368 1 105 VAL H 1 110 ARG QG . . 5.420 4.284 2.481 5.433 0.013 14 0 "[ . 1 . 2]" 1
1369 1 105 VAL HA 1 107 GLY H . . 5.290 4.789 4.283 5.150 . 0 0 "[ . 1 . 2]" 1
1370 1 105 VAL HB 1 106 ALA H . . 4.110 2.513 1.754 3.508 . 0 0 "[ . 1 . 2]" 1
1371 1 105 VAL QG 1 106 ALA H . . 4.230 1.854 1.580 2.369 . 0 0 "[ . 1 . 2]" 1
1372 1 105 VAL QG 1 106 ALA MB . . 4.200 2.834 2.007 3.315 . 0 0 "[ . 1 . 2]" 1
1373 1 105 VAL QG 1 107 GLY H . . 4.860 2.123 1.636 2.473 . 0 0 "[ . 1 . 2]" 1
1374 1 105 VAL QG 1 107 GLY QA . . 4.980 3.467 2.884 3.927 . 0 0 "[ . 1 . 2]" 1
1375 1 106 ALA H 1 107 GLY H . . 4.360 2.299 1.963 2.783 . 0 0 "[ . 1 . 2]" 1
1376 1 106 ALA MB 1 107 GLY H . . 4.430 2.888 2.815 2.983 . 0 0 "[ . 1 . 2]" 1
1377 1 106 ALA MB 1 107 GLY HA2 . . 5.320 4.588 4.552 4.641 . 0 0 "[ . 1 . 2]" 1
1378 1 106 ALA MB 1 107 GLY HA3 . . 5.320 3.999 3.935 4.104 . 0 0 "[ . 1 . 2]" 1
1379 1 106 ALA MB 1 108 LEU H . . 4.420 4.059 3.879 4.206 . 0 0 "[ . 1 . 2]" 1
1380 1 106 ALA MB 1 108 LEU QB . . 4.270 3.995 3.661 4.252 . 0 0 "[ . 1 . 2]" 1
1381 1 106 ALA MB 1 108 LEU HG . . 3.860 3.472 3.173 3.598 . 0 0 "[ . 1 . 2]" 1
1382 1 107 GLY H 1 108 LEU H . . 4.560 3.985 3.924 4.075 . 0 0 "[ . 1 . 2]" 1
1383 1 107 GLY H 1 109 GLY H . . 6.000 5.737 4.540 6.693 0.693 1 7 "[+ * . 1 **. **-2]" 1
1384 1 108 LEU H 1 108 LEU QB . . 3.770 3.085 3.031 3.156 . 0 0 "[ . 1 . 2]" 1
1385 1 108 LEU H 1 108 LEU QD . . 4.850 3.058 2.652 3.375 . 0 0 "[ . 1 . 2]" 1
1386 1 108 LEU H 1 108 LEU HG . . 4.660 2.666 2.265 3.044 . 0 0 "[ . 1 . 2]" 1
1387 1 108 LEU H 1 109 GLY H . . 4.410 4.374 3.978 4.652 0.242 13 0 "[ . 1 . 2]" 1
1388 1 108 LEU HA 1 108 LEU QD . . 3.760 2.079 1.940 2.355 . 0 0 "[ . 1 . 2]" 1
1389 1 108 LEU HA 1 108 LEU HG . . 4.270 3.013 2.861 3.249 . 0 0 "[ . 1 . 2]" 1
1390 1 108 LEU HA 1 140 ALA MB . . 4.390 4.383 4.034 4.627 0.237 16 0 "[ . 1 . 2]" 1
1391 1 108 LEU QB 1 109 GLY H . . 4.640 1.815 1.631 2.044 . 0 0 "[ . 1 . 2]" 1
1392 1 108 LEU QB 1 140 ALA HA . . 4.950 4.946 4.702 5.109 0.159 9 0 "[ . 1 . 2]" 1
1393 1 108 LEU QD 1 109 GLY H . . 5.390 3.307 2.954 3.630 . 0 0 "[ . 1 . 2]" 1
1394 1 108 LEU QD 1 112 PRO QD . . 5.200 4.386 4.058 4.685 . 0 0 "[ . 1 . 2]" 1
1395 1 108 LEU QD 1 140 ALA HA . . 4.160 4.265 3.781 4.426 0.266 15 0 "[ . 1 . 2]" 1
1396 1 108 LEU QD 1 140 ALA MB . . 4.330 4.348 4.161 4.506 0.176 5 0 "[ . 1 . 2]" 1
1397 1 108 LEU HG 1 109 GLY H . . 5.070 4.461 4.331 4.570 . 0 0 "[ . 1 . 2]" 1
1398 1 108 LEU HG 1 112 PRO QD . . 5.810 5.646 5.380 5.859 0.049 5 0 "[ . 1 . 2]" 1
1399 1 109 GLY H 1 110 ARG H . . 5.200 3.636 3.014 4.092 . 0 0 "[ . 1 . 2]" 1
1400 1 109 GLY H 1 140 ALA HA . . 6.000 5.030 4.116 6.128 0.128 6 0 "[ . 1 . 2]" 1
1401 1 110 ARG H 1 110 ARG QG . . 4.820 2.417 1.887 3.993 . 0 0 "[ . 1 . 2]" 1
1402 1 110 ARG H 1 114 LEU QD . . 5.240 4.388 3.938 4.936 . 0 0 "[ . 1 . 2]" 1
1403 1 110 ARG HA 1 110 ARG HE . . 4.760 4.234 2.133 4.824 0.064 12 0 "[ . 1 . 2]" 1
1404 1 110 ARG HA 1 113 VAL HB . . 4.950 2.494 1.946 4.465 . 0 0 "[ . 1 . 2]" 1
1405 1 110 ARG HA 1 113 VAL QG . . 3.920 2.714 1.743 3.101 . 0 0 "[ . 1 . 2]" 1
1406 1 110 ARG HA 1 114 LEU H . . 4.700 2.929 2.714 3.358 . 0 0 "[ . 1 . 2]" 1
1407 1 110 ARG HA 1 114 LEU QD . . 5.240 2.382 1.824 3.175 . 0 0 "[ . 1 . 2]" 1
1408 1 112 PRO HA 1 114 LEU H . . 5.070 4.738 4.163 4.956 . 0 0 "[ . 1 . 2]" 1
1409 1 112 PRO HA 1 115 VAL H . . 4.600 3.923 3.637 4.024 . 0 0 "[ . 1 . 2]" 1
1410 1 112 PRO HA 1 115 VAL QG . . 3.630 1.869 1.762 2.230 . 0 0 "[ . 1 . 2]" 1
1411 1 112 PRO HA 1 116 ALA H . . 5.450 3.711 3.564 3.801 . 0 0 "[ . 1 . 2]" 1
1412 1 112 PRO HA 1 116 ALA MB . . 5.370 3.950 3.742 4.084 . 0 0 "[ . 1 . 2]" 1
1413 1 112 PRO HA 1 140 ALA MB . . 6.000 4.307 3.988 4.543 . 0 0 "[ . 1 . 2]" 1
1414 1 112 PRO HA 1 141 ILE MG . . 5.780 5.731 5.246 5.995 0.215 20 0 "[ . 1 . 2]" 1
1415 1 112 PRO QB 1 113 VAL H . . 3.860 3.013 2.431 3.228 . 0 0 "[ . 1 . 2]" 1
1416 1 112 PRO QB 1 116 ALA H . . 5.340 4.619 4.473 4.672 . 0 0 "[ . 1 . 2]" 1
1417 1 112 PRO QB 1 133 ILE MD . . 3.660 1.893 1.812 2.126 . 0 0 "[ . 1 . 2]" 1
1418 1 112 PRO QB 1 140 ALA MB . . 3.550 2.097 1.933 2.302 . 0 0 "[ . 1 . 2]" 1
1419 1 112 PRO QB 1 141 ILE H . . 5.500 3.579 3.222 3.770 . 0 0 "[ . 1 . 2]" 1
1420 1 112 PRO HB2 1 113 VAL H . . 4.450 3.116 2.469 3.364 . 0 0 "[ . 1 . 2]" 1
1421 1 112 PRO HB2 1 140 ALA MB . . 4.090 2.277 2.002 2.496 . 0 0 "[ . 1 . 2]" 1
1422 1 112 PRO HB3 1 113 VAL H . . 4.450 4.016 3.650 4.159 . 0 0 "[ . 1 . 2]" 1
1423 1 112 PRO HB3 1 140 ALA MB . . 4.090 2.508 2.115 2.792 . 0 0 "[ . 1 . 2]" 1
1424 1 112 PRO QD 1 113 VAL H . . 4.340 2.649 2.602 2.943 . 0 0 "[ . 1 . 2]" 1
1425 1 112 PRO QD 1 113 VAL QG . . 4.480 3.590 3.021 3.861 . 0 0 "[ . 1 . 2]" 1
1426 1 112 PRO QD 1 115 VAL QG . . 5.810 4.045 3.824 4.663 . 0 0 "[ . 1 . 2]" 1
1427 1 112 PRO QD 1 140 ALA MB . . 4.340 3.432 3.273 3.495 . 0 0 "[ . 1 . 2]" 1
1428 1 112 PRO HD2 1 113 VAL H . . 4.950 2.699 2.647 3.030 . 0 0 "[ . 1 . 2]" 1
1429 1 112 PRO HD2 1 115 VAL H . . 6.000 5.802 5.687 5.901 . 0 0 "[ . 1 . 2]" 1
1430 1 112 PRO HD2 1 140 ALA MB . . 5.210 4.140 4.000 4.328 . 0 0 "[ . 1 . 2]" 1
1431 1 112 PRO HD3 1 113 VAL H . . 4.950 3.855 3.836 3.997 . 0 0 "[ . 1 . 2]" 1
1432 1 112 PRO HD3 1 115 VAL H . . 6.000 6.161 6.018 6.235 0.235 11 0 "[ . 1 . 2]" 1
1433 1 112 PRO HD3 1 140 ALA MB . . 5.210 3.672 3.437 3.770 . 0 0 "[ . 1 . 2]" 1
1434 1 112 PRO QG 1 113 VAL H . . 4.200 2.133 1.680 2.385 . 0 0 "[ . 1 . 2]" 1
1435 1 112 PRO QG 1 140 ALA HA . . 5.350 2.963 2.514 3.453 . 0 0 "[ . 1 . 2]" 1
1436 1 112 PRO QG 1 140 ALA MB . . 4.310 1.867 1.783 2.034 . 0 0 "[ . 1 . 2]" 1
1437 1 113 VAL H 1 113 VAL HB . . 3.710 2.561 2.317 3.615 . 0 0 "[ . 1 . 2]" 1
1438 1 113 VAL H 1 113 VAL MG1 . . 3.590 3.443 1.819 3.756 0.166 19 0 "[ . 1 . 2]" 1
1439 1 113 VAL H 1 113 VAL QG . . 3.110 2.317 1.781 2.578 . 0 0 "[ . 1 . 2]" 1
1440 1 113 VAL H 1 113 VAL MG2 . . 3.590 2.453 2.256 2.630 . 0 0 "[ . 1 . 2]" 1
1441 1 113 VAL H 1 114 LEU H . . 4.010 2.938 2.792 3.039 . 0 0 "[ . 1 . 2]" 1
1442 1 113 VAL H 1 114 LEU QD . . 5.160 4.416 3.860 5.209 0.049 17 0 "[ . 1 . 2]" 1
1443 1 113 VAL H 1 115 VAL H . . 5.060 4.566 4.368 4.916 . 0 0 "[ . 1 . 2]" 1
1444 1 113 VAL H 1 115 VAL QG . . 4.660 4.001 3.693 4.706 0.046 20 0 "[ . 1 . 2]" 1
1445 1 113 VAL H 1 116 ALA MB . . 5.130 4.276 4.006 4.394 . 0 0 "[ . 1 . 2]" 1
1446 1 113 VAL H 1 133 ILE MD . . 4.110 4.071 3.853 4.164 0.054 11 0 "[ . 1 . 2]" 1
1447 1 113 VAL H 1 140 ALA MB . . 4.730 4.374 3.906 4.742 0.012 12 0 "[ . 1 . 2]" 1
1448 1 113 VAL H 1 141 ILE HA . . 5.290 4.043 2.977 4.670 . 0 0 "[ . 1 . 2]" 1
1449 1 113 VAL H 1 141 ILE MD . . 4.810 4.283 3.477 4.637 . 0 0 "[ . 1 . 2]" 1
1450 1 113 VAL HA 1 116 ALA H . . 4.390 3.847 3.687 4.041 . 0 0 "[ . 1 . 2]" 1
1451 1 113 VAL HA 1 116 ALA MB . . 4.070 2.633 2.457 2.878 . 0 0 "[ . 1 . 2]" 1
1452 1 113 VAL HA 1 117 LEU H . . 5.560 4.449 4.207 4.572 . 0 0 "[ . 1 . 2]" 1
1453 1 113 VAL HA 1 141 ILE MD . . 4.050 2.084 1.839 2.345 . 0 0 "[ . 1 . 2]" 1
1454 1 113 VAL HA 1 141 ILE QG . . 4.380 3.191 2.530 4.019 . 0 0 "[ . 1 . 2]" 1
1455 1 113 VAL HB 1 114 LEU H . . 4.230 2.591 2.261 3.848 . 0 0 "[ . 1 . 2]" 1
1456 1 113 VAL QG 1 114 LEU H . . 3.540 2.525 1.759 2.819 . 0 0 "[ . 1 . 2]" 1
1457 1 113 VAL QG 1 114 LEU HA . . 4.520 2.985 2.865 3.202 . 0 0 "[ . 1 . 2]" 1
1458 1 113 VAL QG 1 114 LEU QB . . 4.660 3.761 3.021 4.055 . 0 0 "[ . 1 . 2]" 1
1459 1 113 VAL QG 1 114 LEU QD . . 4.180 2.122 1.726 2.845 . 0 0 "[ . 1 . 2]" 1
1460 1 113 VAL QG 1 117 LEU H . . 5.220 4.330 4.089 4.931 . 0 0 "[ . 1 . 2]" 1
1461 1 113 VAL QG 1 141 ILE HA . . 4.610 2.159 1.931 2.555 . 0 0 "[ . 1 . 2]" 1
1462 1 113 VAL QG 1 141 ILE HB . . 4.190 3.357 3.181 3.748 . 0 0 "[ . 1 . 2]" 1
1463 1 113 VAL QG 1 145 GLN H . . 4.520 4.312 3.709 4.689 0.169 20 0 "[ . 1 . 2]" 1
1464 1 113 VAL QG 1 145 GLN HA . . 5.710 4.159 3.654 5.381 . 0 0 "[ . 1 . 2]" 1
1465 1 113 VAL QG 1 145 GLN QG . . 4.280 1.861 1.705 2.357 . 0 0 "[ . 1 . 2]" 1
1466 1 113 VAL MG1 1 114 LEU H . . 4.180 2.860 2.495 3.728 . 0 0 "[ . 1 . 2]" 1
1467 1 113 VAL MG2 1 114 LEU H . . 4.180 3.560 1.762 3.962 . 0 0 "[ . 1 . 2]" 1
1468 1 114 LEU H 1 114 LEU HB2 . . 4.070 2.253 2.057 2.428 . 0 0 "[ . 1 . 2]" 1
1469 1 114 LEU H 1 114 LEU QB . . 3.500 2.228 2.039 2.391 . 0 0 "[ . 1 . 2]" 1
1470 1 114 LEU H 1 114 LEU HB3 . . 4.070 3.519 3.340 3.578 . 0 0 "[ . 1 . 2]" 1
1471 1 114 LEU H 1 114 LEU MD1 . . 4.160 3.727 2.384 4.245 0.085 20 0 "[ . 1 . 2]" 1
1472 1 114 LEU H 1 114 LEU MD2 . . 4.160 2.496 1.852 3.759 . 0 0 "[ . 1 . 2]" 1
1473 1 114 LEU H 1 114 LEU HG . . 4.600 3.534 2.465 4.417 . 0 0 "[ . 1 . 2]" 1
1474 1 114 LEU H 1 115 VAL H . . 3.860 2.864 2.752 2.934 . 0 0 "[ . 1 . 2]" 1
1475 1 114 LEU H 1 115 VAL HB . . 6.000 5.885 4.737 6.448 0.448 3 0 "[ . 1 . 2]" 1
1476 1 114 LEU H 1 115 VAL QG . . 4.290 3.843 3.542 4.474 0.184 19 0 "[ . 1 . 2]" 1
1477 1 114 LEU H 1 116 ALA H . . 4.900 3.902 3.635 4.017 . 0 0 "[ . 1 . 2]" 1
1478 1 114 LEU H 1 117 LEU H . . 5.080 4.861 4.708 4.927 . 0 0 "[ . 1 . 2]" 1
1479 1 114 LEU H 1 117 LEU HB2 . . 6.000 5.632 5.412 5.827 . 0 0 "[ . 1 . 2]" 1
1480 1 114 LEU H 1 141 ILE MD . . 5.070 5.041 4.706 5.239 0.169 14 0 "[ . 1 . 2]" 1
1481 1 114 LEU HA 1 114 LEU MD1 . . 4.690 2.619 1.832 3.816 . 0 0 "[ . 1 . 2]" 1
1482 1 114 LEU HA 1 114 LEU QD . . 3.700 1.923 1.827 2.012 . 0 0 "[ . 1 . 2]" 1
1483 1 114 LEU HA 1 114 LEU MD2 . . 4.690 2.413 1.857 3.759 . 0 0 "[ . 1 . 2]" 1
1484 1 114 LEU HA 1 117 LEU H . . 5.020 3.496 3.308 3.616 . 0 0 "[ . 1 . 2]" 1
1485 1 114 LEU HA 1 117 LEU HB2 . . 4.890 3.456 3.089 3.642 . 0 0 "[ . 1 . 2]" 1
1486 1 114 LEU HA 1 117 LEU HG . . 5.090 4.863 4.533 5.020 . 0 0 "[ . 1 . 2]" 1
1487 1 114 LEU HA 1 118 ALA H . . 5.590 4.551 4.438 4.675 . 0 0 "[ . 1 . 2]" 1
1488 1 114 LEU QB 1 115 VAL H . . 4.000 2.270 2.133 2.367 . 0 0 "[ . 1 . 2]" 1
1489 1 114 LEU QB 1 115 VAL HA . . 5.350 3.726 3.633 3.761 . 0 0 "[ . 1 . 2]" 1
1490 1 114 LEU QB 1 115 VAL QG . . 4.050 3.232 2.830 4.034 . 0 0 "[ . 1 . 2]" 1
1491 1 114 LEU HB2 1 115 VAL H . . 4.630 2.385 2.172 2.760 . 0 0 "[ . 1 . 2]" 1
1492 1 114 LEU HB2 1 115 VAL QG . . 4.730 3.532 2.974 4.736 0.006 6 0 "[ . 1 . 2]" 1
1493 1 114 LEU HB3 1 115 VAL H . . 4.630 2.933 2.548 3.128 . 0 0 "[ . 1 . 2]" 1
1494 1 114 LEU HB3 1 115 VAL QG . . 4.730 3.796 3.380 4.735 0.005 13 0 "[ . 1 . 2]" 1
1495 1 114 LEU QD 1 115 VAL H . . 4.440 3.789 3.588 3.865 . 0 0 "[ . 1 . 2]" 1
1496 1 114 LEU QD 1 116 ALA H . . 5.920 4.865 4.654 5.179 . 0 0 "[ . 1 . 2]" 1
1497 1 114 LEU MD1 1 115 VAL H . . 5.230 4.394 4.169 4.556 . 0 0 "[ . 1 . 2]" 1
1498 1 114 LEU MD2 1 115 VAL H . . 5.230 4.175 3.783 4.513 . 0 0 "[ . 1 . 2]" 1
1499 1 115 VAL H 1 115 VAL HB . . 3.920 3.176 2.156 3.611 . 0 0 "[ . 1 . 2]" 1
1500 1 115 VAL H 1 115 VAL QG . . 3.390 2.128 1.793 2.776 . 0 0 "[ . 1 . 2]" 1
1501 1 115 VAL H 1 116 ALA H . . 3.910 2.776 2.716 2.817 . 0 0 "[ . 1 . 2]" 1
1502 1 115 VAL H 1 116 ALA MB . . 4.520 4.408 4.337 4.489 . 0 0 "[ . 1 . 2]" 1
1503 1 115 VAL H 1 117 LEU H . . 5.280 4.474 4.322 4.611 . 0 0 "[ . 1 . 2]" 1
1504 1 115 VAL H 1 118 ALA H . . 5.480 5.181 5.090 5.314 . 0 0 "[ . 1 . 2]" 1
1505 1 115 VAL HA 1 117 LEU H . . 5.050 4.494 4.267 4.639 . 0 0 "[ . 1 . 2]" 1
1506 1 115 VAL HA 1 118 ALA H . . 4.220 3.688 3.526 3.894 . 0 0 "[ . 1 . 2]" 1
1507 1 115 VAL HA 1 118 ALA MB . . 4.230 3.180 3.044 3.445 . 0 0 "[ . 1 . 2]" 1
1508 1 115 VAL QG 1 116 ALA H . . 4.300 2.125 2.044 2.233 . 0 0 "[ . 1 . 2]" 1
1509 1 115 VAL QG 1 116 ALA HA . . 4.070 3.014 2.861 3.215 . 0 0 "[ . 1 . 2]" 1
1510 1 115 VAL QG 1 118 ALA H . . 4.950 4.661 4.455 4.775 . 0 0 "[ . 1 . 2]" 1
1511 1 115 VAL QG 1 118 ALA HA . . 6.000 6.314 5.869 6.527 0.527 4 3 "[ +. * . - 2]" 1
1512 1 115 VAL QG 1 118 ALA MB . . 4.920 4.094 3.630 4.356 . 0 0 "[ . 1 . 2]" 1
1513 1 115 VAL QG 1 119 LEU H . . 4.510 4.257 3.650 4.494 . 0 0 "[ . 1 . 2]" 1
1514 1 116 ALA H 1 116 ALA MB . . 3.280 2.170 2.129 2.239 . 0 0 "[ . 1 . 2]" 1
1515 1 116 ALA H 1 117 LEU H . . 4.020 2.683 2.576 2.729 . 0 0 "[ . 1 . 2]" 1
1516 1 116 ALA H 1 118 ALA H . . 4.920 4.365 4.188 4.487 . 0 0 "[ . 1 . 2]" 1
1517 1 116 ALA H 1 133 ILE MD . . 4.320 3.745 3.594 3.984 . 0 0 "[ . 1 . 2]" 1
1518 1 116 ALA H 1 141 ILE MD . . 4.430 4.022 3.876 4.393 . 0 0 "[ . 1 . 2]" 1
1519 1 116 ALA HA 1 119 LEU H . . 4.680 3.464 3.385 3.576 . 0 0 "[ . 1 . 2]" 1
1520 1 116 ALA HA 1 119 LEU QB . . 4.280 2.211 2.086 2.307 . 0 0 "[ . 1 . 2]" 1
1521 1 116 ALA HA 1 119 LEU HG . . 4.140 4.072 3.872 4.188 0.048 18 0 "[ . 1 . 2]" 1
1522 1 116 ALA HA 1 120 ILE MD . . 4.180 3.232 3.085 3.367 . 0 0 "[ . 1 . 2]" 1
1523 1 116 ALA HA 1 129 ALA MB . . 4.270 3.521 3.336 3.662 . 0 0 "[ . 1 . 2]" 1
1524 1 116 ALA HA 1 133 ILE MD . . 4.480 3.670 3.515 3.814 . 0 0 "[ . 1 . 2]" 1
1525 1 116 ALA HA 1 133 ILE HG12 . . 5.160 4.615 4.482 4.693 . 0 0 "[ . 1 . 2]" 1
1526 1 116 ALA HA 1 133 ILE HG13 . . 6.000 6.110 6.039 6.230 0.230 5 0 "[ . 1 . 2]" 1
1527 1 116 ALA MB 1 117 LEU H . . 3.440 2.533 2.379 2.679 . 0 0 "[ . 1 . 2]" 1
1528 1 116 ALA MB 1 117 LEU HB2 . . 4.160 4.057 3.923 4.106 . 0 0 "[ . 1 . 2]" 1
1529 1 116 ALA MB 1 118 ALA MB . . 5.610 5.512 5.420 5.579 . 0 0 "[ . 1 . 2]" 1
1530 1 116 ALA MB 1 119 LEU H . . 4.630 4.562 4.475 4.651 0.021 12 0 "[ . 1 . 2]" 1
1531 1 116 ALA MB 1 120 ILE MD . . 3.370 3.045 2.754 3.351 . 0 0 "[ . 1 . 2]" 1
1532 1 116 ALA MB 1 130 ILE MD . . 3.860 2.620 2.376 2.836 . 0 0 "[ . 1 . 2]" 1
1533 1 116 ALA MB 1 133 ILE MD . . 3.650 1.974 1.883 2.117 . 0 0 "[ . 1 . 2]" 1
1534 1 116 ALA MB 1 133 ILE HG12 . . 4.030 3.443 3.238 3.624 . 0 0 "[ . 1 . 2]" 1
1535 1 116 ALA MB 1 133 ILE HG13 . . 5.230 4.316 4.199 4.464 . 0 0 "[ . 1 . 2]" 1
1536 1 116 ALA MB 1 141 ILE MD . . 3.910 1.899 1.761 2.287 . 0 0 "[ . 1 . 2]" 1
1537 1 117 LEU H 1 117 LEU HB2 . . 3.590 2.325 2.280 2.397 . 0 0 "[ . 1 . 2]" 1
1538 1 117 LEU H 1 117 LEU HB3 . . 3.750 2.699 2.614 2.752 . 0 0 "[ . 1 . 2]" 1
1539 1 117 LEU H 1 117 LEU MD1 . . 4.770 4.240 4.189 4.265 . 0 0 "[ . 1 . 2]" 1
1540 1 117 LEU H 1 117 LEU MD2 . . 4.350 3.835 3.725 3.967 . 0 0 "[ . 1 . 2]" 1
1541 1 117 LEU H 1 118 ALA H . . 3.810 2.853 2.731 2.988 . 0 0 "[ . 1 . 2]" 1
1542 1 117 LEU H 1 120 ILE MD . . 5.560 4.737 4.516 4.929 . 0 0 "[ . 1 . 2]" 1
1543 1 117 LEU H 1 149 LEU QD . . 5.110 4.902 4.025 5.176 0.066 13 0 "[ . 1 . 2]" 1
1544 1 117 LEU HA 1 117 LEU MD2 . . 3.760 1.955 1.901 2.033 . 0 0 "[ . 1 . 2]" 1
1545 1 117 LEU HA 1 120 ILE H . . 4.220 3.869 3.773 4.015 . 0 0 "[ . 1 . 2]" 1
1546 1 117 LEU HA 1 120 ILE HB . . 4.510 3.273 3.034 3.441 . 0 0 "[ . 1 . 2]" 1
1547 1 117 LEU HA 1 120 ILE MD . . 4.760 4.001 3.826 4.235 . 0 0 "[ . 1 . 2]" 1
1548 1 117 LEU HA 1 121 GLU H . . 5.040 4.382 4.249 4.672 . 0 0 "[ . 1 . 2]" 1
1549 1 117 LEU HA 1 121 GLU QG . . 5.810 4.030 3.756 4.535 . 0 0 "[ . 1 . 2]" 1
1550 1 117 LEU HA 1 149 LEU QD . . 3.780 2.967 2.339 3.209 . 0 0 "[ . 1 . 2]" 1
1551 1 117 LEU HB2 1 118 ALA H . . 3.830 3.623 3.548 3.721 . 0 0 "[ . 1 . 2]" 1
1552 1 117 LEU HB3 1 118 ALA H . . 3.940 2.318 2.183 2.415 . 0 0 "[ . 1 . 2]" 1
1553 1 117 LEU HB3 1 118 ALA HA . . 6.000 4.106 4.046 4.173 . 0 0 "[ . 1 . 2]" 1
1554 1 117 LEU HB3 1 118 ALA MB . . 4.820 3.615 3.531 3.720 . 0 0 "[ . 1 . 2]" 1
1555 1 117 LEU MD1 1 118 ALA H . . 3.780 3.122 2.921 3.221 . 0 0 "[ . 1 . 2]" 1
1556 1 117 LEU MD1 1 118 ALA HA . . 5.020 2.889 2.730 2.981 . 0 0 "[ . 1 . 2]" 1
1557 1 117 LEU MD1 1 118 ALA MB . . 4.710 3.402 3.173 3.541 . 0 0 "[ . 1 . 2]" 1
1558 1 117 LEU MD1 1 121 GLU H . . 5.350 3.866 3.772 4.011 . 0 0 "[ . 1 . 2]" 1
1559 1 117 LEU MD1 1 121 GLU QG . . 4.970 2.071 1.905 2.330 . 0 0 "[ . 1 . 2]" 1
1560 1 117 LEU MD2 1 118 ALA H . . 4.720 4.379 4.219 4.454 . 0 0 "[ . 1 . 2]" 1
1561 1 117 LEU MD2 1 118 ALA MB . . 5.550 5.152 4.983 5.257 . 0 0 "[ . 1 . 2]" 1
1562 1 117 LEU MD2 1 120 ILE H . . 5.550 4.888 4.590 5.150 . 0 0 "[ . 1 . 2]" 1
1563 1 117 LEU MD2 1 120 ILE MD . . 4.940 4.796 4.625 4.953 0.013 20 0 "[ . 1 . 2]" 1
1564 1 117 LEU MD2 1 120 ILE MG . . 4.580 3.808 3.563 4.086 . 0 0 "[ . 1 . 2]" 1
1565 1 117 LEU MD2 1 121 GLU H . . 5.120 4.404 4.120 4.722 . 0 0 "[ . 1 . 2]" 1
1566 1 117 LEU MD2 1 121 GLU QG . . 4.840 3.068 2.700 3.424 . 0 0 "[ . 1 . 2]" 1
1567 1 117 LEU MD2 1 149 LEU QD . . 3.600 2.389 2.032 2.582 . 0 0 "[ . 1 . 2]" 1
1568 1 117 LEU MD2 1 149 LEU HG . . 5.500 4.473 4.080 4.754 . 0 0 "[ . 1 . 2]" 1
1569 1 117 LEU MD2 1 152 TYR QB . . 5.330 4.786 3.918 5.148 . 0 0 "[ . 1 . 2]" 1
1570 1 118 ALA H 1 118 ALA MB . . 3.120 2.124 2.040 2.199 . 0 0 "[ . 1 . 2]" 1
1571 1 118 ALA H 1 119 LEU H . . 3.780 2.585 2.550 2.643 . 0 0 "[ . 1 . 2]" 1
1572 1 118 ALA H 1 120 ILE H . . 5.010 4.328 4.136 4.452 . 0 0 "[ . 1 . 2]" 1
1573 1 118 ALA H 1 120 ILE MD . . 5.680 5.401 5.268 5.499 . 0 0 "[ . 1 . 2]" 1
1574 1 118 ALA H 1 121 GLU QG . . 5.630 4.734 4.312 5.278 . 0 0 "[ . 1 . 2]" 1
1575 1 118 ALA HA 1 120 ILE H . . 4.840 4.451 4.233 4.646 . 0 0 "[ . 1 . 2]" 1
1576 1 118 ALA HA 1 121 GLU QB . . 4.060 2.684 2.503 3.008 . 0 0 "[ . 1 . 2]" 1
1577 1 118 ALA HA 1 121 GLU QG . . 4.880 3.100 2.379 3.554 . 0 0 "[ . 1 . 2]" 1
1578 1 118 ALA HA 1 158 LEU MD2 . . 5.520 4.415 4.093 4.733 . 0 0 "[ . 1 . 2]" 1
1579 1 118 ALA HA 1 158 LEU HG . . 4.400 4.180 3.885 4.504 0.104 13 0 "[ . 1 . 2]" 1
1580 1 118 ALA MB 1 119 LEU H . . 3.620 2.678 2.545 2.780 . 0 0 "[ . 1 . 2]" 1
1581 1 118 ALA MB 1 119 LEU QB . . 4.440 3.945 3.889 4.019 . 0 0 "[ . 1 . 2]" 1
1582 1 118 ALA MB 1 120 ILE H . . 5.720 4.666 4.498 4.799 . 0 0 "[ . 1 . 2]" 1
1583 1 118 ALA MB 1 121 GLU H . . 4.800 4.690 4.536 4.808 0.008 12 0 "[ . 1 . 2]" 1
1584 1 118 ALA MB 1 121 GLU QG . . 5.180 4.418 3.950 4.803 . 0 0 "[ . 1 . 2]" 1
1585 1 118 ALA MB 1 122 SER H . . 4.930 4.708 4.506 4.934 0.004 7 0 "[ . 1 . 2]" 1
1586 1 118 ALA MB 1 158 LEU MD2 . . 4.560 4.165 3.809 4.394 . 0 0 "[ . 1 . 2]" 1
1587 1 118 ALA MB 1 158 LEU HG . . 3.830 3.838 3.663 3.969 0.139 10 0 "[ . 1 . 2]" 1
1588 1 119 LEU H 1 119 LEU HB2 . . 3.970 2.727 2.656 2.816 . 0 0 "[ . 1 . 2]" 1
1589 1 119 LEU H 1 119 LEU QB . . 3.120 2.183 2.148 2.209 . 0 0 "[ . 1 . 2]" 1
1590 1 119 LEU H 1 119 LEU HB3 . . 3.970 2.299 2.228 2.362 . 0 0 "[ . 1 . 2]" 1
1591 1 119 LEU H 1 119 LEU MD1 . . 4.840 4.167 4.123 4.208 . 0 0 "[ . 1 . 2]" 1
1592 1 119 LEU H 1 119 LEU HG . . 4.540 4.325 4.239 4.391 . 0 0 "[ . 1 . 2]" 1
1593 1 119 LEU H 1 120 ILE H . . 3.910 2.782 2.670 2.885 . 0 0 "[ . 1 . 2]" 1
1594 1 119 LEU H 1 120 ILE HA . . 5.690 5.367 5.284 5.443 . 0 0 "[ . 1 . 2]" 1
1595 1 119 LEU H 1 120 ILE MD . . 5.020 4.170 4.047 4.267 . 0 0 "[ . 1 . 2]" 1
1596 1 119 LEU H 1 122 SER H . . 5.330 4.739 4.625 4.850 . 0 0 "[ . 1 . 2]" 1
1597 1 119 LEU HA 1 119 LEU MD1 . . 3.860 2.227 2.121 2.360 . 0 0 "[ . 1 . 2]" 1
1598 1 119 LEU HA 1 122 SER H . . 4.800 3.600 3.453 3.682 . 0 0 "[ . 1 . 2]" 1
1599 1 119 LEU QB 1 120 ILE H . . 4.200 2.554 2.416 2.728 . 0 0 "[ . 1 . 2]" 1
1600 1 119 LEU QB 1 129 ALA MB . . 4.150 3.264 3.180 3.357 . 0 0 "[ . 1 . 2]" 1
1601 1 119 LEU MD1 1 120 ILE H . . 4.810 4.011 3.929 4.106 . 0 0 "[ . 1 . 2]" 1
1602 1 119 LEU MD1 1 120 ILE HA . . 4.140 3.843 3.671 3.918 . 0 0 "[ . 1 . 2]" 1
1603 1 119 LEU MD1 1 122 SER H . . 4.820 4.245 4.082 4.369 . 0 0 "[ . 1 . 2]" 1
1604 1 119 LEU MD1 1 122 SER QB . . 4.520 3.305 2.865 3.545 . 0 0 "[ . 1 . 2]" 1
1605 1 119 LEU MD1 1 124 MET H . . 5.090 3.722 3.538 3.960 . 0 0 "[ . 1 . 2]" 1
1606 1 119 LEU MD1 1 128 ASP QB . . 5.890 5.372 5.217 5.470 . 0 0 "[ . 1 . 2]" 1
1607 1 119 LEU HG 1 120 ILE H . . 4.400 3.219 3.094 3.377 . 0 0 "[ . 1 . 2]" 1
1608 1 119 LEU HG 1 124 MET H . . 5.310 4.632 4.428 4.871 . 0 0 "[ . 1 . 2]" 1
1609 1 119 LEU HG 1 128 ASP QB . . 6.000 5.916 5.793 6.009 0.009 13 0 "[ . 1 . 2]" 1
1610 1 119 LEU HG 1 129 ALA H . . 4.890 4.941 4.835 4.987 0.097 17 0 "[ . 1 . 2]" 1
1611 1 119 LEU HG 1 129 ALA HA . . 4.180 4.182 4.011 4.279 0.099 18 0 "[ . 1 . 2]" 1
1612 1 119 LEU HG 1 129 ALA MB . . 3.620 2.122 1.931 2.318 . 0 0 "[ . 1 . 2]" 1
1613 1 120 ILE H 1 120 ILE HB . . 3.650 2.195 2.167 2.227 . 0 0 "[ . 1 . 2]" 1
1614 1 120 ILE H 1 120 ILE MD . . 3.770 2.302 2.011 2.502 . 0 0 "[ . 1 . 2]" 1
1615 1 120 ILE H 1 120 ILE HG13 . . 4.030 4.035 3.955 4.089 0.059 8 0 "[ . 1 . 2]" 1
1616 1 120 ILE H 1 120 ILE MG . . 4.100 3.582 3.532 3.625 . 0 0 "[ . 1 . 2]" 1
1617 1 120 ILE H 1 124 MET H . . 5.830 4.975 4.824 5.111 . 0 0 "[ . 1 . 2]" 1
1618 1 120 ILE H 1 129 ALA MB . . 4.070 4.095 3.960 4.216 0.146 8 0 "[ . 1 . 2]" 1
1619 1 120 ILE HA 1 120 ILE MD . . 4.260 2.294 2.187 2.372 . 0 0 "[ . 1 . 2]" 1
1620 1 120 ILE HA 1 120 ILE MG . . 3.510 2.686 2.654 2.726 . 0 0 "[ . 1 . 2]" 1
1621 1 120 ILE HA 1 124 MET H . . 3.720 2.767 2.648 2.871 . 0 0 "[ . 1 . 2]" 1
1622 1 120 ILE HA 1 126 TYR HA . . 4.940 4.446 4.312 4.542 . 0 0 "[ . 1 . 2]" 1
1623 1 120 ILE HB 1 121 GLU H . . 3.840 2.735 2.642 2.939 . 0 0 "[ . 1 . 2]" 1
1624 1 120 ILE HB 1 122 SER H . . 5.120 4.821 4.754 5.011 . 0 0 "[ . 1 . 2]" 1
1625 1 120 ILE MD 1 120 ILE MG . . 3.380 3.254 3.244 3.256 . 0 0 "[ . 1 . 2]" 1
1626 1 120 ILE MD 1 121 GLU H . . 4.320 4.216 4.125 4.301 . 0 0 "[ . 1 . 2]" 1
1627 1 120 ILE MD 1 124 MET H . . 4.810 4.458 4.224 4.567 . 0 0 "[ . 1 . 2]" 1
1628 1 120 ILE MD 1 124 MET HA . . 5.280 5.215 4.846 5.360 0.080 19 0 "[ . 1 . 2]" 1
1629 1 120 ILE MD 1 124 MET HB2 . . 4.680 4.041 3.793 4.192 . 0 0 "[ . 1 . 2]" 1
1630 1 120 ILE MD 1 124 MET HB3 . . 4.640 2.843 2.524 3.104 . 0 0 "[ . 1 . 2]" 1
1631 1 120 ILE MD 1 124 MET QG . . 4.380 4.067 3.824 4.366 . 0 0 "[ . 1 . 2]" 1
1632 1 120 ILE MD 1 125 LYS H . . 5.650 4.841 4.400 4.986 . 0 0 "[ . 1 . 2]" 1
1633 1 120 ILE MD 1 126 TYR HA . . 3.920 2.081 1.969 2.196 . 0 0 "[ . 1 . 2]" 1
1634 1 120 ILE MD 1 126 TYR HB2 . . 4.280 3.705 3.576 3.842 . 0 0 "[ . 1 . 2]" 1
1635 1 120 ILE MD 1 126 TYR HB3 . . 4.900 4.623 4.514 4.749 . 0 0 "[ . 1 . 2]" 1
1636 1 120 ILE MD 1 126 TYR HD1 . . 4.330 3.654 3.523 3.789 . 0 0 "[ . 1 . 2]" 1
1637 1 120 ILE MD 1 127 GLU H . . 5.020 5.007 4.913 5.061 0.041 20 0 "[ . 1 . 2]" 1
1638 1 120 ILE MD 1 128 ASP H . . 5.510 5.439 5.302 5.508 . 0 0 "[ . 1 . 2]" 1
1639 1 120 ILE MD 1 128 ASP QB . . 4.960 4.938 4.806 5.006 0.046 1 0 "[ . 1 . 2]" 1
1640 1 120 ILE MD 1 129 ALA H . . 4.170 3.584 3.488 3.651 . 0 0 "[ . 1 . 2]" 1
1641 1 120 ILE MD 1 129 ALA HA . . 4.610 4.096 4.038 4.141 . 0 0 "[ . 1 . 2]" 1
1642 1 120 ILE MD 1 129 ALA MB . . 3.610 1.738 1.716 1.759 . 0 0 "[ . 1 . 2]" 1
1643 1 120 ILE HG13 1 121 GLU H . . 5.650 4.976 4.917 5.099 . 0 0 "[ . 1 . 2]" 1
1644 1 120 ILE HG13 1 124 MET H . . 5.690 4.705 4.544 4.870 . 0 0 "[ . 1 . 2]" 1
1645 1 120 ILE HG13 1 125 LYS H . . 4.960 5.052 4.976 5.102 0.142 10 0 "[ . 1 . 2]" 1
1646 1 120 ILE HG13 1 126 TYR HA . . 4.580 2.250 2.047 2.348 . 0 0 "[ . 1 . 2]" 1
1647 1 120 ILE HG13 1 126 TYR HD1 . . 5.540 4.816 4.489 5.040 . 0 0 "[ . 1 . 2]" 1
1648 1 120 ILE HG13 1 129 ALA MB . . 4.070 3.373 3.207 3.559 . 0 0 "[ . 1 . 2]" 1
1649 1 120 ILE MG 1 121 GLU H . . 4.090 2.579 2.455 2.871 . 0 0 "[ . 1 . 2]" 1
1650 1 120 ILE MG 1 121 GLU HA . . 4.650 2.853 2.790 2.968 . 0 0 "[ . 1 . 2]" 1
1651 1 120 ILE MG 1 121 GLU QG . . 4.520 2.506 2.282 2.630 . 0 0 "[ . 1 . 2]" 1
1652 1 120 ILE MG 1 123 GLY H . . 4.920 4.191 4.111 4.299 . 0 0 "[ . 1 . 2]" 1
1653 1 120 ILE MG 1 124 MET H . . 4.620 4.110 3.929 4.224 . 0 0 "[ . 1 . 2]" 1
1654 1 120 ILE MG 1 124 MET HB2 . . 5.420 5.443 5.377 5.507 0.087 16 0 "[ . 1 . 2]" 1
1655 1 120 ILE MG 1 124 MET HB3 . . 5.100 4.887 4.799 5.016 . 0 0 "[ . 1 . 2]" 1
1656 1 120 ILE MG 1 149 LEU HG . . 3.660 3.049 2.549 3.248 . 0 0 "[ . 1 . 2]" 1
1657 1 120 ILE MG 1 154 PRO QB . . 3.670 2.835 2.525 3.196 . 0 0 "[ . 1 . 2]" 1
1658 1 120 ILE MG 1 154 PRO HD3 . . 4.080 4.055 3.728 4.195 0.115 11 0 "[ . 1 . 2]" 1
1659 1 120 ILE MG 1 154 PRO QG . . 4.010 3.759 3.409 3.957 . 0 0 "[ . 1 . 2]" 1
1660 1 121 GLU H 1 121 GLU QB . . 3.580 2.481 2.247 2.732 . 0 0 "[ . 1 . 2]" 1
1661 1 121 GLU H 1 121 GLU HG2 . . 3.810 2.249 1.917 2.897 . 0 0 "[ . 1 . 2]" 1
1662 1 121 GLU H 1 121 GLU HG3 . . 3.810 3.164 2.308 3.346 . 0 0 "[ . 1 . 2]" 1
1663 1 121 GLU H 1 122 SER H . . 3.960 2.616 2.514 2.720 . 0 0 "[ . 1 . 2]" 1
1664 1 121 GLU H 1 123 GLY H . . 5.030 4.208 4.113 4.250 . 0 0 "[ . 1 . 2]" 1
1665 1 121 GLU H 1 124 MET H . . 6.000 4.875 4.763 4.938 . 0 0 "[ . 1 . 2]" 1
1666 1 121 GLU H 1 149 LEU QD . . 5.440 4.561 4.026 5.037 . 0 0 "[ . 1 . 2]" 1
1667 1 121 GLU H 1 158 LEU H . . 6.000 5.961 5.794 6.327 0.327 4 0 "[ . 1 . 2]" 1
1668 1 121 GLU H 1 158 LEU HG . . 5.840 5.645 5.188 5.877 0.037 9 0 "[ . 1 . 2]" 1
1669 1 121 GLU QB 1 122 SER H . . 4.280 3.003 2.743 3.150 . 0 0 "[ . 1 . 2]" 1
1670 1 121 GLU QB 1 123 GLY H . . 5.250 4.590 4.378 4.697 . 0 0 "[ . 1 . 2]" 1
1671 1 121 GLU QB 1 157 ARG H . . 4.600 3.617 3.197 4.324 . 0 0 "[ . 1 . 2]" 1
1672 1 121 GLU QB 1 158 LEU H . . 4.540 2.629 2.332 3.070 . 0 0 "[ . 1 . 2]" 1
1673 1 121 GLU QB 1 158 LEU MD2 . . 5.810 3.016 2.610 3.389 . 0 0 "[ . 1 . 2]" 1
1674 1 121 GLU QG 1 122 SER H . . 5.190 4.143 3.785 4.430 . 0 0 "[ . 1 . 2]" 1
1675 1 121 GLU QG 1 158 LEU HB2 . . 4.880 4.410 3.847 4.547 . 0 0 "[ . 1 . 2]" 1
1676 1 121 GLU QG 1 158 LEU HB3 . . 5.810 5.767 4.812 5.946 0.136 1 0 "[ . 1 . 2]" 1
1677 1 121 GLU QG 1 158 LEU HG . . 5.550 5.044 4.599 5.444 . 0 0 "[ . 1 . 2]" 1
1678 1 122 SER H 1 122 SER QB . . 3.770 2.136 2.058 2.270 . 0 0 "[ . 1 . 2]" 1
1679 1 122 SER H 1 123 GLY H . . 3.310 2.516 2.394 2.668 . 0 0 "[ . 1 . 2]" 1
1680 1 122 SER H 1 158 LEU HB2 . . 5.590 3.920 3.645 4.148 . 0 0 "[ . 1 . 2]" 1
1681 1 122 SER H 1 158 LEU HB3 . . 4.750 4.151 3.317 4.313 . 0 0 "[ . 1 . 2]" 1
1682 1 122 SER H 1 158 LEU MD2 . . 5.690 5.306 5.045 5.599 . 0 0 "[ . 1 . 2]" 1
1683 1 122 SER H 1 158 LEU HG . . 4.840 4.534 3.973 4.858 0.018 20 0 "[ . 1 . 2]" 1
1684 1 122 SER HA 1 123 GLY H . . 3.550 3.425 3.343 3.445 . 0 0 "[ . 1 . 2]" 1
1685 1 122 SER QB 1 123 GLY H . . 4.510 3.445 3.008 3.636 . 0 0 "[ . 1 . 2]" 1
1686 1 122 SER QB 1 158 LEU MD2 . . 5.830 4.958 4.776 5.071 . 0 0 "[ . 1 . 2]" 1
1687 1 123 GLY H 1 124 MET H . . 3.290 1.863 1.806 2.022 . 0 0 "[ . 1 . 2]" 1
1688 1 123 GLY H 1 124 MET HB3 . . 5.250 4.776 4.713 4.905 . 0 0 "[ . 1 . 2]" 1
1689 1 123 GLY H 1 158 LEU HB3 . . 5.650 5.045 4.410 5.284 . 0 0 "[ . 1 . 2]" 1
1690 1 124 MET H 1 124 MET HB3 . . 3.430 3.073 3.010 3.170 . 0 0 "[ . 1 . 2]" 1
1691 1 124 MET H 1 124 MET HG2 . . 5.070 4.788 4.725 4.875 . 0 0 "[ . 1 . 2]" 1
1692 1 124 MET H 1 124 MET QG . . 4.310 4.133 4.086 4.194 . 0 0 "[ . 1 . 2]" 1
1693 1 124 MET H 1 124 MET HG3 . . 5.070 4.517 4.466 4.598 . 0 0 "[ . 1 . 2]" 1
1694 1 124 MET H 1 125 LYS H . . 4.710 4.538 4.493 4.567 . 0 0 "[ . 1 . 2]" 1
1695 1 124 MET HA 1 124 MET QG . . 3.690 2.273 2.203 2.370 . 0 0 "[ . 1 . 2]" 1
1696 1 124 MET HA 1 125 LYS H . . 3.240 2.299 2.279 2.310 . 0 0 "[ . 1 . 2]" 1
1697 1 124 MET HA 1 125 LYS QE . . 5.540 4.895 4.644 5.143 . 0 0 "[ . 1 . 2]" 1
1698 1 124 MET HA 1 125 LYS QG . . 3.600 3.281 3.259 3.309 . 0 0 "[ . 1 . 2]" 1
1699 1 124 MET HA 1 129 ALA MB . . 5.130 4.969 4.834 5.083 . 0 0 "[ . 1 . 2]" 1
1700 1 124 MET HB2 1 125 LYS H . . 4.430 4.177 4.151 4.213 . 0 0 "[ . 1 . 2]" 1
1701 1 124 MET HB3 1 125 LYS H . . 4.130 3.253 3.193 3.351 . 0 0 "[ . 1 . 2]" 1
1702 1 124 MET HB3 1 129 ALA H . . 4.180 4.147 4.002 4.200 0.020 3 0 "[ . 1 . 2]" 1
1703 1 124 MET QG 1 125 LYS H . . 3.670 2.353 2.230 2.486 . 0 0 "[ . 1 . 2]" 1
1704 1 124 MET QG 1 128 ASP QB . . 4.620 3.176 2.996 3.322 . 0 0 "[ . 1 . 2]" 1
1705 1 124 MET QG 1 129 ALA HA . . 5.000 3.608 3.440 3.746 . 0 0 "[ . 1 . 2]" 1
1706 1 124 MET QG 1 129 ALA MB . . 4.030 2.851 2.711 3.029 . 0 0 "[ . 1 . 2]" 1
1707 1 124 MET HG2 1 125 LYS H . . 4.190 3.798 3.665 3.928 . 0 0 "[ . 1 . 2]" 1
1708 1 124 MET HG2 1 129 ALA H . . 4.380 4.193 3.935 4.366 . 0 0 "[ . 1 . 2]" 1
1709 1 124 MET HG2 1 129 ALA MB . . 4.700 2.934 2.773 3.134 . 0 0 "[ . 1 . 2]" 1
1710 1 124 MET HG3 1 125 LYS H . . 4.190 2.376 2.248 2.514 . 0 0 "[ . 1 . 2]" 1
1711 1 124 MET HG3 1 129 ALA H . . 4.380 4.316 4.070 4.402 0.022 3 0 "[ . 1 . 2]" 1
1712 1 124 MET HG3 1 129 ALA MB . . 4.700 3.891 3.565 4.026 . 0 0 "[ . 1 . 2]" 1
1713 1 125 LYS H 1 125 LYS HB2 . . 3.620 3.139 3.047 3.259 . 0 0 "[ . 1 . 2]" 1
1714 1 125 LYS H 1 125 LYS HB3 . . 3.950 3.427 3.345 3.470 . 0 0 "[ . 1 . 2]" 1
1715 1 125 LYS H 1 125 LYS QE . . 5.490 3.834 3.646 3.952 . 0 0 "[ . 1 . 2]" 1
1716 1 125 LYS H 1 125 LYS QG . . 3.540 1.766 1.730 1.802 . 0 0 "[ . 1 . 2]" 1
1717 1 125 LYS H 1 127 GLU H . . 5.990 5.865 5.774 6.011 0.021 13 0 "[ . 1 . 2]" 1
1718 1 125 LYS H 1 128 ASP H . . 4.690 4.740 4.650 4.829 0.139 12 0 "[ . 1 . 2]" 1
1719 1 125 LYS H 1 128 ASP QB . . 4.180 3.122 3.033 3.225 . 0 0 "[ . 1 . 2]" 1
1720 1 125 LYS H 1 129 ALA H . . 5.260 4.072 3.937 4.132 . 0 0 "[ . 1 . 2]" 1
1721 1 125 LYS HA 1 126 TYR HB3 . . 6.000 4.282 4.250 4.356 . 0 0 "[ . 1 . 2]" 1
1722 1 125 LYS HA 1 127 GLU H . . 4.850 4.320 4.230 4.488 . 0 0 "[ . 1 . 2]" 1
1723 1 125 LYS HA 1 128 ASP H . . 4.750 4.703 4.633 4.780 0.030 6 0 "[ . 1 . 2]" 1
1724 1 125 LYS HB2 1 126 TYR H . . 4.950 3.530 3.346 3.636 . 0 0 "[ . 1 . 2]" 1
1725 1 125 LYS HB2 1 128 ASP H . . 3.440 2.145 2.081 2.210 . 0 0 "[ . 1 . 2]" 1
1726 1 125 LYS HB2 1 128 ASP QB . . 4.540 2.180 2.002 2.411 . 0 0 "[ . 1 . 2]" 1
1727 1 125 LYS HB2 1 129 ALA H . . 3.980 3.623 3.484 3.733 . 0 0 "[ . 1 . 2]" 1
1728 1 125 LYS HB3 1 125 LYS QE . . 4.790 3.006 2.195 4.100 . 0 0 "[ . 1 . 2]" 1
1729 1 125 LYS HB3 1 126 TYR H . . 5.400 3.386 3.033 3.596 . 0 0 "[ . 1 . 2]" 1
1730 1 125 LYS HB3 1 127 GLU H . . 4.360 4.013 3.859 4.220 . 0 0 "[ . 1 . 2]" 1
1731 1 125 LYS HB3 1 128 ASP H . . 3.890 3.755 3.641 3.904 0.014 18 0 "[ . 1 . 2]" 1
1732 1 125 LYS HB3 1 128 ASP QB . . 4.890 3.586 3.430 3.705 . 0 0 "[ . 1 . 2]" 1
1733 1 125 LYS HB3 1 129 ALA H . . 5.030 5.195 5.070 5.286 0.256 17 0 "[ . 1 . 2]" 1
1734 1 125 LYS QE 1 128 ASP H . . 5.790 5.448 4.993 5.790 0.000 4 0 "[ . 1 . 2]" 1
1735 1 125 LYS QG 1 126 TYR H . . 5.150 4.582 4.479 4.614 . 0 0 "[ . 1 . 2]" 1
1736 1 125 LYS QG 1 128 ASP H . . 5.110 3.653 3.510 3.752 . 0 0 "[ . 1 . 2]" 1
1737 1 125 LYS QG 1 162 ASP H . . 4.780 4.617 4.177 4.814 0.034 16 0 "[ . 1 . 2]" 1
1738 1 126 TYR H 1 126 TYR HD1 . . 5.250 5.017 4.968 5.052 . 0 0 "[ . 1 . 2]" 1
1739 1 126 TYR H 1 128 ASP H . . 5.690 4.495 4.275 4.583 . 0 0 "[ . 1 . 2]" 1
1740 1 126 TYR HA 1 126 TYR HE1 . . 5.830 5.294 5.180 5.388 . 0 0 "[ . 1 . 2]" 1
1741 1 126 TYR HA 1 128 ASP H . . 5.240 4.925 4.856 4.971 . 0 0 "[ . 1 . 2]" 1
1742 1 126 TYR HA 1 129 ALA H . . 4.550 4.001 3.967 4.037 . 0 0 "[ . 1 . 2]" 1
1743 1 126 TYR HA 1 129 ALA MB . . 4.110 2.896 2.804 3.053 . 0 0 "[ . 1 . 2]" 1
1744 1 126 TYR HA 1 149 LEU QB . . 4.660 4.277 4.179 4.339 . 0 0 "[ . 1 . 2]" 1
1745 1 126 TYR HB2 1 126 TYR HE1 . . 4.980 4.785 4.766 4.811 . 0 0 "[ . 1 . 2]" 1
1746 1 126 TYR HB2 1 127 GLU H . . 4.460 3.977 3.913 4.020 . 0 0 "[ . 1 . 2]" 1
1747 1 126 TYR HB2 1 130 ILE MD . . 4.890 4.439 4.297 4.610 . 0 0 "[ . 1 . 2]" 1
1748 1 126 TYR HB2 1 149 LEU QB . . 4.830 2.750 2.664 2.808 . 0 0 "[ . 1 . 2]" 1
1749 1 126 TYR HB2 1 149 LEU QD . . 5.710 1.999 1.961 2.112 . 0 0 "[ . 1 . 2]" 1
1750 1 126 TYR HB2 1 149 LEU HG . . 4.190 2.486 1.939 2.580 . 0 0 "[ . 1 . 2]" 1
1751 1 126 TYR HB2 1 150 GLU H . . 5.710 5.527 5.027 5.823 0.113 13 0 "[ . 1 . 2]" 1
1752 1 126 TYR HB3 1 127 GLU H . . 3.960 2.799 2.656 2.903 . 0 0 "[ . 1 . 2]" 1
1753 1 126 TYR HB3 1 128 ASP H . . 6.000 5.392 5.190 5.504 . 0 0 "[ . 1 . 2]" 1
1754 1 126 TYR HB3 1 130 ILE MD . . 5.870 5.366 5.257 5.449 . 0 0 "[ . 1 . 2]" 1
1755 1 126 TYR HB3 1 149 LEU QB . . 4.770 3.963 3.852 4.070 . 0 0 "[ . 1 . 2]" 1
1756 1 126 TYR HB3 1 149 LEU QD . . 5.920 2.910 2.836 2.980 . 0 0 "[ . 1 . 2]" 1
1757 1 126 TYR HB3 1 149 LEU HG . . 4.310 4.237 3.692 4.336 0.026 9 0 "[ . 1 . 2]" 1
1758 1 126 TYR HD1 1 127 GLU H . . 4.540 4.563 4.534 4.622 0.082 13 0 "[ . 1 . 2]" 1
1759 1 126 TYR HD1 1 127 GLU HA . . 4.830 4.472 4.393 4.646 . 0 0 "[ . 1 . 2]" 1
1760 1 126 TYR HD1 1 127 GLU QG . . 4.950 4.970 4.932 5.020 0.070 13 0 "[ . 1 . 2]" 1
1761 1 126 TYR HD1 1 129 ALA H . . 6.000 6.056 5.978 6.115 0.115 13 0 "[ . 1 . 2]" 1
1762 1 126 TYR HD1 1 130 ILE H . . 5.060 4.469 4.400 4.578 . 0 0 "[ . 1 . 2]" 1
1763 1 126 TYR HD1 1 130 ILE MD . . 3.820 2.609 2.467 2.764 . 0 0 "[ . 1 . 2]" 1
1764 1 126 TYR HD1 1 146 LEU QD . . 4.710 4.366 4.040 4.571 . 0 0 "[ . 1 . 2]" 1
1765 1 126 TYR HD1 1 149 LEU H . . 5.160 4.940 4.776 5.028 . 0 0 "[ . 1 . 2]" 1
1766 1 126 TYR HD1 1 149 LEU HA . . 5.660 5.304 5.203 5.458 . 0 0 "[ . 1 . 2]" 1
1767 1 126 TYR HD1 1 149 LEU QB . . 5.340 2.407 2.287 2.497 . 0 0 "[ . 1 . 2]" 1
1768 1 126 TYR HD1 1 149 LEU QD . . 4.280 3.449 3.380 3.556 . 0 0 "[ . 1 . 2]" 1
1769 1 126 TYR HD1 1 149 LEU HG . . 4.540 2.925 2.717 3.160 . 0 0 "[ . 1 . 2]" 1
1770 1 126 TYR HD1 1 150 GLU HB2 . . 6.000 5.838 5.474 6.159 0.159 13 0 "[ . 1 . 2]" 1
1771 1 126 TYR HE1 1 127 GLU QG . . 5.320 4.957 4.776 5.244 . 0 0 "[ . 1 . 2]" 1
1772 1 126 TYR HE1 1 130 ILE MD . . 4.050 3.313 3.099 3.399 . 0 0 "[ . 1 . 2]" 1
1773 1 126 TYR HE1 1 130 ILE MG . . 5.130 3.585 3.498 3.703 . 0 0 "[ . 1 . 2]" 1
1774 1 126 TYR HE1 1 149 LEU H . . 5.170 4.779 4.547 4.932 . 0 0 "[ . 1 . 2]" 1
1775 1 126 TYR HE1 1 149 LEU QB . . 5.320 3.313 3.258 3.423 . 0 0 "[ . 1 . 2]" 1
1776 1 126 TYR HE1 1 149 LEU HG . . 5.670 4.975 4.883 5.169 . 0 0 "[ . 1 . 2]" 1
1777 1 126 TYR HE1 1 150 GLU H . . 5.130 4.438 4.173 4.853 . 0 0 "[ . 1 . 2]" 1
1778 1 126 TYR HE1 1 150 GLU HA . . 5.470 5.091 4.775 5.446 . 0 0 "[ . 1 . 2]" 1
1779 1 126 TYR HE1 1 150 GLU QG . . 5.810 4.996 4.383 5.499 . 0 0 "[ . 1 . 2]" 1
1780 1 127 GLU H 1 127 GLU QB . . 3.250 2.449 2.357 2.558 . 0 0 "[ . 1 . 2]" 1
1781 1 127 GLU H 1 127 GLU HG2 . . 4.340 2.911 2.439 3.573 . 0 0 "[ . 1 . 2]" 1
1782 1 127 GLU H 1 127 GLU QG . . 3.760 2.357 2.031 2.543 . 0 0 "[ . 1 . 2]" 1
1783 1 127 GLU H 1 127 GLU HG3 . . 4.340 2.528 2.045 2.751 . 0 0 "[ . 1 . 2]" 1
1784 1 127 GLU H 1 128 ASP H . . 3.670 2.850 2.774 2.906 . 0 0 "[ . 1 . 2]" 1
1785 1 127 GLU H 1 128 ASP QB . . 4.940 4.476 4.397 4.555 . 0 0 "[ . 1 . 2]" 1
1786 1 127 GLU H 1 129 ALA H . . 4.860 4.442 4.404 4.476 . 0 0 "[ . 1 . 2]" 1
1787 1 127 GLU H 1 129 ALA MB . . 5.490 4.871 4.826 4.966 . 0 0 "[ . 1 . 2]" 1
1788 1 127 GLU H 1 130 ILE H . . 5.410 4.735 4.708 4.771 . 0 0 "[ . 1 . 2]" 1
1789 1 127 GLU H 1 130 ILE MD . . 5.200 5.228 5.139 5.280 0.080 14 0 "[ . 1 . 2]" 1
1790 1 127 GLU H 1 149 LEU QB . . 6.000 5.750 5.691 5.859 . 0 0 "[ . 1 . 2]" 1
1791 1 127 GLU HA 1 127 GLU QG . . 3.730 2.344 2.247 2.518 . 0 0 "[ . 1 . 2]" 1
1792 1 127 GLU HA 1 129 ALA H . . 5.680 4.824 4.778 4.865 . 0 0 "[ . 1 . 2]" 1
1793 1 127 GLU HA 1 130 ILE H . . 4.900 3.688 3.647 3.723 . 0 0 "[ . 1 . 2]" 1
1794 1 127 GLU HA 1 130 ILE HB . . 4.200 2.682 2.568 2.778 . 0 0 "[ . 1 . 2]" 1
1795 1 127 GLU HA 1 130 ILE MD . . 4.330 4.433 4.365 4.501 0.171 10 0 "[ . 1 . 2]" 1
1796 1 127 GLU HA 1 130 ILE HG12 . . 5.100 3.143 3.064 3.246 . 0 0 "[ . 1 . 2]" 1
1797 1 127 GLU HA 1 130 ILE HG13 . . 5.100 4.449 4.381 4.523 . 0 0 "[ . 1 . 2]" 1
1798 1 127 GLU HA 1 130 ILE MG . . 4.360 3.941 3.821 4.033 . 0 0 "[ . 1 . 2]" 1
1799 1 127 GLU HA 1 131 GLN H . . 4.360 3.909 3.721 4.064 . 0 0 "[ . 1 . 2]" 1
1800 1 127 GLU QB 1 128 ASP H . . 3.460 2.255 2.182 2.348 . 0 0 "[ . 1 . 2]" 1
1801 1 127 GLU QB 1 128 ASP QB . . 4.670 3.758 3.699 3.836 . 0 0 "[ . 1 . 2]" 1
1802 1 127 GLU QG 1 128 ASP H . . 4.610 3.924 3.765 4.021 . 0 0 "[ . 1 . 2]" 1
1803 1 128 ASP H 1 128 ASP QB . . 3.130 2.101 2.051 2.158 . 0 0 "[ . 1 . 2]" 1
1804 1 128 ASP H 1 129 ALA H . . 3.240 2.975 2.963 2.991 . 0 0 "[ . 1 . 2]" 1
1805 1 128 ASP H 1 129 ALA MB . . 4.680 4.488 4.468 4.539 . 0 0 "[ . 1 . 2]" 1
1806 1 128 ASP H 1 130 ILE H . . 4.490 4.338 4.292 4.381 . 0 0 "[ . 1 . 2]" 1
1807 1 128 ASP H 1 131 GLN HG2 . . 5.150 5.197 5.163 5.236 0.086 17 0 "[ . 1 . 2]" 1
1808 1 128 ASP HA 1 130 ILE MG . . 5.960 6.036 5.931 6.160 0.200 13 0 "[ . 1 . 2]" 1
1809 1 128 ASP HA 1 131 GLN H . . 4.060 3.828 3.754 3.922 . 0 0 "[ . 1 . 2]" 1
1810 1 128 ASP HA 1 131 GLN QB . . 3.960 2.898 2.822 2.964 . 0 0 "[ . 1 . 2]" 1
1811 1 128 ASP HA 1 131 GLN HG3 . . 5.320 5.151 5.074 5.299 . 0 0 "[ . 1 . 2]" 1
1812 1 128 ASP QB 1 129 ALA H . . 3.470 2.257 2.199 2.365 . 0 0 "[ . 1 . 2]" 1
1813 1 128 ASP QB 1 129 ALA MB . . 4.900 3.670 3.638 3.694 . 0 0 "[ . 1 . 2]" 1
1814 1 128 ASP QB 1 130 ILE H . . 4.650 4.633 4.592 4.674 0.024 12 0 "[ . 1 . 2]" 1
1815 1 128 ASP QB 1 131 GLN H . . 5.290 5.221 5.176 5.265 . 0 0 "[ . 1 . 2]" 1
1816 1 129 ALA H 1 129 ALA MB . . 3.130 2.142 2.095 2.231 . 0 0 "[ . 1 . 2]" 1
1817 1 129 ALA H 1 130 ILE H . . 3.610 2.860 2.838 2.890 . 0 0 "[ . 1 . 2]" 1
1818 1 129 ALA H 1 130 ILE MD . . 4.200 4.258 4.211 4.304 0.104 10 0 "[ . 1 . 2]" 1
1819 1 129 ALA H 1 131 GLN H . . 4.980 4.576 4.539 4.627 . 0 0 "[ . 1 . 2]" 1
1820 1 129 ALA HA 1 131 GLN H . . 4.900 4.851 4.798 4.897 . 0 0 "[ . 1 . 2]" 1
1821 1 129 ALA HA 1 132 PHE HB2 . . 4.490 3.146 2.957 3.224 . 0 0 "[ . 1 . 2]" 1
1822 1 129 ALA HA 1 132 PHE HB3 . . 4.470 3.103 2.999 3.202 . 0 0 "[ . 1 . 2]" 1
1823 1 129 ALA HA 1 133 ILE H . . 4.780 4.193 4.128 4.248 . 0 0 "[ . 1 . 2]" 1
1824 1 129 ALA MB 1 130 ILE H . . 3.870 2.517 2.402 2.573 . 0 0 "[ . 1 . 2]" 1
1825 1 129 ALA MB 1 130 ILE HA . . 4.740 3.738 3.697 3.791 . 0 0 "[ . 1 . 2]" 1
1826 1 129 ALA MB 1 132 PHE H . . 4.640 4.552 4.510 4.590 . 0 0 "[ . 1 . 2]" 1
1827 1 129 ALA MB 1 132 PHE HB2 . . 5.000 4.638 4.491 4.705 . 0 0 "[ . 1 . 2]" 1
1828 1 129 ALA MB 1 132 PHE HB3 . . 4.500 4.209 4.110 4.295 . 0 0 "[ . 1 . 2]" 1
1829 1 130 ILE H 1 130 ILE HB . . 3.380 2.446 2.407 2.480 . 0 0 "[ . 1 . 2]" 1
1830 1 130 ILE H 1 130 ILE MD . . 3.400 2.129 2.075 2.194 . 0 0 "[ . 1 . 2]" 1
1831 1 130 ILE H 1 130 ILE HG12 . . 4.070 2.805 2.700 2.920 . 0 0 "[ . 1 . 2]" 1
1832 1 130 ILE H 1 130 ILE QG . . 3.420 2.748 2.653 2.851 . 0 0 "[ . 1 . 2]" 1
1833 1 130 ILE H 1 130 ILE HG13 . . 4.070 3.945 3.900 3.997 . 0 0 "[ . 1 . 2]" 1
1834 1 130 ILE H 1 130 ILE MG . . 4.340 3.748 3.737 3.756 . 0 0 "[ . 1 . 2]" 1
1835 1 130 ILE H 1 131 GLN H . . 3.670 2.928 2.899 2.956 . 0 0 "[ . 1 . 2]" 1
1836 1 130 ILE H 1 131 GLN QB . . 4.890 4.665 4.612 4.710 . 0 0 "[ . 1 . 2]" 1
1837 1 130 ILE H 1 131 GLN HG2 . . 5.740 5.732 5.646 5.797 0.057 16 0 "[ . 1 . 2]" 1
1838 1 130 ILE H 1 132 PHE HB3 . . 5.640 5.292 5.199 5.366 . 0 0 "[ . 1 . 2]" 1
1839 1 130 ILE H 1 146 LEU QD . . 5.270 5.050 4.928 5.176 . 0 0 "[ . 1 . 2]" 1
1840 1 130 ILE HA 1 130 ILE MD . . 3.330 1.754 1.737 1.775 . 0 0 "[ . 1 . 2]" 1
1841 1 130 ILE HA 1 130 ILE MG . . 3.680 2.467 2.446 2.502 . 0 0 "[ . 1 . 2]" 1
1842 1 130 ILE HA 1 132 PHE H . . 4.410 4.093 4.022 4.191 . 0 0 "[ . 1 . 2]" 1
1843 1 130 ILE HA 1 133 ILE MD . . 3.930 2.640 2.418 2.811 . 0 0 "[ . 1 . 2]" 1
1844 1 130 ILE HA 1 133 ILE HG12 . . 4.260 2.604 2.383 2.765 . 0 0 "[ . 1 . 2]" 1
1845 1 130 ILE HA 1 133 ILE HG13 . . 4.220 2.634 2.477 2.907 . 0 0 "[ . 1 . 2]" 1
1846 1 130 ILE HA 1 134 ARG H . . 5.070 3.995 3.930 4.085 . 0 0 "[ . 1 . 2]" 1
1847 1 130 ILE HB 1 130 ILE MD . . 3.750 3.034 2.995 3.071 . 0 0 "[ . 1 . 2]" 1
1848 1 130 ILE HB 1 131 GLN H . . 3.560 2.335 2.289 2.373 . 0 0 "[ . 1 . 2]" 1
1849 1 130 ILE HB 1 131 GLN QB . . 4.580 4.418 4.373 4.458 . 0 0 "[ . 1 . 2]" 1
1850 1 130 ILE HB 1 146 LEU QD . . 5.090 3.671 3.503 3.785 . 0 0 "[ . 1 . 2]" 1
1851 1 130 ILE MD 1 131 GLN H . . 4.770 4.180 4.167 4.198 . 0 0 "[ . 1 . 2]" 1
1852 1 130 ILE MD 1 146 LEU HA . . 4.560 4.010 3.625 4.141 . 0 0 "[ . 1 . 2]" 1
1853 1 130 ILE QG 1 130 ILE MG . . 3.240 2.068 1.983 2.086 . 0 0 "[ . 1 . 2]" 1
1854 1 130 ILE QG 1 131 GLN HE22 . . 4.770 3.940 3.828 4.032 . 0 0 "[ . 1 . 2]" 1
1855 1 130 ILE QG 1 146 LEU H . . 5.810 5.352 4.883 5.719 . 0 0 "[ . 1 . 2]" 1
1856 1 130 ILE QG 1 146 LEU HG . . 5.060 2.765 1.981 3.380 . 0 0 "[ . 1 . 2]" 1
1857 1 130 ILE MG 1 131 GLN H . . 3.580 2.856 2.753 2.935 . 0 0 "[ . 1 . 2]" 1
1858 1 130 ILE MG 1 131 GLN HA . . 4.410 3.013 2.931 3.087 . 0 0 "[ . 1 . 2]" 1
1859 1 130 ILE MG 1 131 GLN QB . . 4.470 4.266 4.179 4.336 . 0 0 "[ . 1 . 2]" 1
1860 1 130 ILE MG 1 131 GLN HE22 . . 5.230 2.322 2.083 2.474 . 0 0 "[ . 1 . 2]" 1
1861 1 130 ILE MG 1 131 GLN HG2 . . 5.060 4.639 4.456 4.767 . 0 0 "[ . 1 . 2]" 1
1862 1 130 ILE MG 1 131 GLN HG3 . . 5.030 4.784 4.649 4.891 . 0 0 "[ . 1 . 2]" 1
1863 1 130 ILE MG 1 132 PHE H . . 4.510 4.513 4.413 4.602 0.092 12 0 "[ . 1 . 2]" 1
1864 1 130 ILE MG 1 133 ILE H . . 5.310 4.988 4.904 5.038 . 0 0 "[ . 1 . 2]" 1
1865 1 130 ILE MG 1 133 ILE HG12 . . 4.830 4.391 4.155 4.586 . 0 0 "[ . 1 . 2]" 1
1866 1 130 ILE MG 1 133 ILE HG13 . . 3.970 3.597 3.499 3.716 . 0 0 "[ . 1 . 2]" 1
1867 1 130 ILE MG 1 134 ARG H . . 4.230 3.985 3.922 4.060 . 0 0 "[ . 1 . 2]" 1
1868 1 130 ILE MG 1 134 ARG HA . . 4.840 4.485 4.376 4.665 . 0 0 "[ . 1 . 2]" 1
1869 1 130 ILE MG 1 135 GLN H . . 5.340 5.163 5.051 5.352 0.012 16 0 "[ . 1 . 2]" 1
1870 1 130 ILE MG 1 146 LEU HG . . 4.670 2.894 2.428 3.327 . 0 0 "[ . 1 . 2]" 1
1871 1 131 GLN H 1 131 GLN QB . . 3.080 2.324 2.307 2.350 . 0 0 "[ . 1 . 2]" 1
1872 1 131 GLN H 1 131 GLN HG2 . . 3.810 3.221 3.138 3.282 . 0 0 "[ . 1 . 2]" 1
1873 1 131 GLN H 1 131 GLN HG3 . . 4.500 4.023 3.990 4.046 . 0 0 "[ . 1 . 2]" 1
1874 1 131 GLN H 1 132 PHE H . . 3.600 2.795 2.764 2.817 . 0 0 "[ . 1 . 2]" 1
1875 1 131 GLN H 1 132 PHE HB3 . . 5.510 5.270 5.189 5.319 . 0 0 "[ . 1 . 2]" 1
1876 1 131 GLN H 1 133 ILE H . . 4.980 4.937 4.839 4.983 0.003 16 0 "[ . 1 . 2]" 1
1877 1 131 GLN H 1 133 ILE HG12 . . 5.600 5.327 5.189 5.470 . 0 0 "[ . 1 . 2]" 1
1878 1 131 GLN H 1 135 GLN H . . 5.830 5.656 5.586 5.872 0.042 16 0 "[ . 1 . 2]" 1
1879 1 131 GLN HA 1 131 GLN HG2 . . 4.250 3.614 3.609 3.629 . 0 0 "[ . 1 . 2]" 1
1880 1 131 GLN HA 1 133 ILE H . . 5.360 5.202 5.109 5.249 . 0 0 "[ . 1 . 2]" 1
1881 1 131 GLN HA 1 134 ARG H . . 4.480 3.662 3.618 3.714 . 0 0 "[ . 1 . 2]" 1
1882 1 131 GLN QB 1 132 PHE H . . 3.470 2.776 2.714 2.833 . 0 0 "[ . 1 . 2]" 1
1883 1 131 GLN QB 1 132 PHE HA . . 4.570 3.903 3.877 3.929 . 0 0 "[ . 1 . 2]" 1
1884 1 131 GLN QB 1 132 PHE HB2 . . 4.820 4.185 4.140 4.236 . 0 0 "[ . 1 . 2]" 1
1885 1 131 GLN QB 1 133 ILE H . . 5.480 5.257 5.199 5.310 . 0 0 "[ . 1 . 2]" 1
1886 1 131 GLN HG2 1 132 PHE H . . 4.930 4.949 4.921 4.979 0.049 4 0 "[ . 1 . 2]" 1
1887 1 131 GLN HG3 1 132 PHE H . . 5.450 5.312 5.264 5.361 . 0 0 "[ . 1 . 2]" 1
1888 1 132 PHE H 1 132 PHE HB2 . . 3.320 2.390 2.349 2.441 . 0 0 "[ . 1 . 2]" 1
1889 1 132 PHE H 1 132 PHE HB3 . . 3.370 2.697 2.636 2.732 . 0 0 "[ . 1 . 2]" 1
1890 1 132 PHE H 1 132 PHE HD2 . . 5.280 4.974 4.930 4.998 . 0 0 "[ . 1 . 2]" 1
1891 1 132 PHE H 1 133 ILE H . . 3.750 2.895 2.829 2.976 . 0 0 "[ . 1 . 2]" 1
1892 1 132 PHE HA 1 132 PHE HD2 . . 4.590 4.523 4.483 4.581 . 0 0 "[ . 1 . 2]" 1
1893 1 132 PHE HA 1 133 ILE HA . . 5.630 4.718 4.704 4.737 . 0 0 "[ . 1 . 2]" 1
1894 1 132 PHE HA 1 135 GLN H . . 4.260 3.611 3.540 3.675 . 0 0 "[ . 1 . 2]" 1
1895 1 132 PHE HA 1 135 GLN HG2 . . 5.360 2.376 1.990 4.242 . 0 0 "[ . 1 . 2]" 1
1896 1 132 PHE HA 1 135 GLN QG . . 4.560 2.319 1.971 3.888 . 0 0 "[ . 1 . 2]" 1
1897 1 132 PHE HA 1 135 GLN HG3 . . 5.360 3.648 2.837 4.614 . 0 0 "[ . 1 . 2]" 1
1898 1 132 PHE HB2 1 133 ILE H . . 4.120 3.441 3.405 3.494 . 0 0 "[ . 1 . 2]" 1
1899 1 132 PHE HB3 1 133 ILE H . . 3.970 1.991 1.949 2.071 . 0 0 "[ . 1 . 2]" 1
1900 1 132 PHE HB3 1 133 ILE MD . . 5.250 5.110 5.030 5.270 0.020 5 0 "[ . 1 . 2]" 1
1901 1 132 PHE HB3 1 134 ARG H . . 4.440 4.255 4.237 4.289 . 0 0 "[ . 1 . 2]" 1
1902 1 132 PHE HD2 1 133 ILE H . . 5.170 3.712 3.646 3.812 . 0 0 "[ . 1 . 2]" 1
1903 1 133 ILE H 1 133 ILE HB . . 3.750 3.606 3.595 3.615 . 0 0 "[ . 1 . 2]" 1
1904 1 133 ILE H 1 133 ILE MD . . 3.900 3.773 3.717 3.876 . 0 0 "[ . 1 . 2]" 1
1905 1 133 ILE H 1 133 ILE HG12 . . 3.860 2.231 2.177 2.379 . 0 0 "[ . 1 . 2]" 1
1906 1 133 ILE H 1 133 ILE HG13 . . 4.110 2.614 2.483 2.886 . 0 0 "[ . 1 . 2]" 1
1907 1 133 ILE H 1 134 ARG H . . 4.020 2.625 2.599 2.652 . 0 0 "[ . 1 . 2]" 1
1908 1 133 ILE H 1 135 GLN H . . 4.640 4.393 4.106 4.482 . 0 0 "[ . 1 . 2]" 1
1909 1 133 ILE HA 1 134 ARG HA . . 6.000 4.667 4.636 4.686 . 0 0 "[ . 1 . 2]" 1
1910 1 133 ILE HA 1 135 GLN H . . 4.960 4.534 4.014 4.653 . 0 0 "[ . 1 . 2]" 1
1911 1 133 ILE HA 1 136 LYS H . . 4.600 3.629 3.423 3.765 . 0 0 "[ . 1 . 2]" 1
1912 1 133 ILE HA 1 136 LYS QB . . 4.730 3.515 2.906 4.065 . 0 0 "[ . 1 . 2]" 1
1913 1 133 ILE HA 1 136 LYS QD . . 4.960 3.041 1.962 3.741 . 0 0 "[ . 1 . 2]" 1
1914 1 133 ILE HA 1 136 LYS QE . . 5.750 3.289 2.669 3.684 . 0 0 "[ . 1 . 2]" 1
1915 1 133 ILE HA 1 136 LYS QG . . 4.520 1.923 1.870 2.041 . 0 0 "[ . 1 . 2]" 1
1916 1 133 ILE HA 1 140 ALA MB . . 5.130 4.266 4.023 4.380 . 0 0 "[ . 1 . 2]" 1
1917 1 133 ILE HB 1 133 ILE MD . . 3.610 2.288 2.262 2.304 . 0 0 "[ . 1 . 2]" 1
1918 1 133 ILE HB 1 134 ARG H . . 4.300 4.041 3.963 4.139 . 0 0 "[ . 1 . 2]" 1
1919 1 133 ILE HB 1 136 LYS QG . . 4.490 3.615 3.319 3.922 . 0 0 "[ . 1 . 2]" 1
1920 1 133 ILE HB 1 140 ALA MB . . 4.730 2.980 2.806 3.147 . 0 0 "[ . 1 . 2]" 1
1921 1 133 ILE MD 1 134 ARG HA . . 5.490 4.287 4.183 4.348 . 0 0 "[ . 1 . 2]" 1
1922 1 133 ILE MD 1 140 ALA MB . . 3.580 2.613 2.305 2.877 . 0 0 "[ . 1 . 2]" 1
1923 1 133 ILE HG12 1 134 ARG H . . 4.700 3.641 3.358 3.769 . 0 0 "[ . 1 . 2]" 1
1924 1 133 ILE HG13 1 134 ARG H . . 5.070 2.460 2.354 2.582 . 0 0 "[ . 1 . 2]" 1
1925 1 133 ILE HG13 1 134 ARG QG . . 5.110 4.942 2.880 5.144 0.034 10 0 "[ . 1 . 2]" 1
1926 1 133 ILE HG13 1 140 ALA MB . . 5.460 3.614 3.233 3.899 . 0 0 "[ . 1 . 2]" 1
1927 1 134 ARG H 1 134 ARG QG . . 4.120 3.935 2.946 4.023 . 0 0 "[ . 1 . 2]" 1
1928 1 134 ARG H 1 135 GLN H . . 3.850 2.358 2.296 2.418 . 0 0 "[ . 1 . 2]" 1
1929 1 134 ARG H 1 136 LYS HG2 . . 5.190 4.260 3.602 4.826 . 0 0 "[ . 1 . 2]" 1
1930 1 134 ARG H 1 136 LYS QG . . 4.400 3.924 3.470 4.218 . 0 0 "[ . 1 . 2]" 1
1931 1 134 ARG H 1 136 LYS HG3 . . 5.190 4.681 4.305 5.103 . 0 0 "[ . 1 . 2]" 1
1932 1 134 ARG H 1 140 ALA H . . 5.940 5.436 4.868 5.904 . 0 0 "[ . 1 . 2]" 1
1933 1 134 ARG HA 1 140 ALA H . . 4.310 2.747 2.246 3.171 . 0 0 "[ . 1 . 2]" 1
1934 1 134 ARG HA 1 140 ALA MB . . 4.290 2.381 2.197 2.614 . 0 0 "[ . 1 . 2]" 1
1935 1 134 ARG QB 1 135 GLN H . . 4.290 2.578 2.489 2.972 . 0 0 "[ . 1 . 2]" 1
1936 1 134 ARG QB 1 141 ILE H . . 5.320 3.871 3.614 4.764 . 0 0 "[ . 1 . 2]" 1
1937 1 134 ARG QB 1 142 ASN H . . 5.280 4.676 4.146 5.084 . 0 0 "[ . 1 . 2]" 1
1938 1 134 ARG HE 1 141 ILE H . . 6.000 5.846 5.450 6.066 0.066 13 0 "[ . 1 . 2]" 1
1939 1 134 ARG QG 1 135 GLN H . . 4.130 3.662 3.407 4.228 0.098 13 0 "[ . 1 . 2]" 1
1940 1 134 ARG QG 1 140 ALA H . . 4.260 3.038 2.531 3.725 . 0 0 "[ . 1 . 2]" 1
1941 1 134 ARG QG 1 141 ILE H . . 5.900 4.301 2.589 5.028 . 0 0 "[ . 1 . 2]" 1
1942 1 135 GLN H 1 135 GLN HB2 . . 3.790 3.566 3.171 3.631 . 0 0 "[ . 1 . 2]" 1
1943 1 135 GLN H 1 135 GLN QB . . 3.190 2.383 2.106 2.526 . 0 0 "[ . 1 . 2]" 1
1944 1 135 GLN H 1 135 GLN HB3 . . 3.790 2.421 2.138 2.577 . 0 0 "[ . 1 . 2]" 1
1945 1 135 GLN H 1 135 GLN HG2 . . 4.230 2.655 2.334 4.430 0.200 16 0 "[ . 1 . 2]" 1
1946 1 135 GLN H 1 135 GLN QG . . 3.620 2.449 2.295 3.615 . 0 0 "[ . 1 . 2]" 1
1947 1 135 GLN H 1 135 GLN HG3 . . 4.230 3.242 2.534 4.060 . 0 0 "[ . 1 . 2]" 1
1948 1 135 GLN H 1 136 LYS H . . 3.740 2.526 2.343 2.647 . 0 0 "[ . 1 . 2]" 1
1949 1 135 GLN H 1 136 LYS HA . . 5.420 5.143 5.028 5.273 . 0 0 "[ . 1 . 2]" 1
1950 1 135 GLN H 1 136 LYS HG2 . . 5.060 4.487 3.898 4.930 . 0 0 "[ . 1 . 2]" 1
1951 1 135 GLN H 1 136 LYS QG . . 4.450 4.039 3.683 4.309 . 0 0 "[ . 1 . 2]" 1
1952 1 135 GLN H 1 136 LYS HG3 . . 5.060 4.627 4.363 4.911 . 0 0 "[ . 1 . 2]" 1
1953 1 135 GLN QB 1 136 LYS H . . 3.830 3.538 2.892 3.662 . 0 0 "[ . 1 . 2]" 1
1954 1 135 GLN HB2 1 136 LYS H . . 4.360 4.077 3.939 4.210 . 0 0 "[ . 1 . 2]" 1
1955 1 135 GLN HB3 1 136 LYS H . . 4.360 3.905 2.952 4.069 . 0 0 "[ . 1 . 2]" 1
1956 1 135 GLN QG 1 136 LYS H . . 5.400 2.322 1.967 2.747 . 0 0 "[ . 1 . 2]" 1
1957 1 135 GLN QG 1 136 LYS HA . . 5.470 3.229 2.933 3.632 . 0 0 "[ . 1 . 2]" 1
1958 1 136 LYS H 1 136 LYS QB . . 3.630 2.547 2.340 2.800 . 0 0 "[ . 1 . 2]" 1
1959 1 136 LYS H 1 136 LYS QE . . 5.530 4.346 3.952 4.458 . 0 0 "[ . 1 . 2]" 1
1960 1 136 LYS H 1 136 LYS HG2 . . 4.450 2.707 2.120 3.130 . 0 0 "[ . 1 . 2]" 1
1961 1 136 LYS H 1 136 LYS QG . . 3.660 2.333 2.033 2.578 . 0 0 "[ . 1 . 2]" 1
1962 1 136 LYS H 1 136 LYS HG3 . . 4.450 2.610 2.291 2.853 . 0 0 "[ . 1 . 2]" 1
1963 1 136 LYS HA 1 136 LYS QE . . 4.670 4.400 4.095 4.642 . 0 0 "[ . 1 . 2]" 1
1964 1 136 LYS HA 1 136 LYS QG . . 3.630 3.351 3.327 3.384 . 0 0 "[ . 1 . 2]" 1
1965 1 136 LYS QB 1 136 LYS QE . . 3.350 2.447 2.053 3.312 . 0 0 "[ . 1 . 2]" 1
1966 1 139 GLY QA 1 142 ASN H . . 4.820 3.344 3.095 4.314 . 0 0 "[ . 1 . 2]" 1
1967 1 140 ALA H 1 140 ALA MB . . 3.300 2.094 2.027 2.218 . 0 0 "[ . 1 . 2]" 1
1968 1 140 ALA H 1 141 ILE H . . 5.080 2.672 2.338 2.960 . 0 0 "[ . 1 . 2]" 1
1969 1 140 ALA HA 1 141 ILE HB . . 5.940 5.636 5.534 5.876 . 0 0 "[ . 1 . 2]" 1
1970 1 140 ALA MB 1 141 ILE H . . 3.820 2.333 2.227 2.662 . 0 0 "[ . 1 . 2]" 1
1971 1 140 ALA MB 1 141 ILE HA . . 5.490 3.792 3.708 3.820 . 0 0 "[ . 1 . 2]" 1
1972 1 140 ALA MB 1 141 ILE HB . . 5.080 3.589 3.419 3.966 . 0 0 "[ . 1 . 2]" 1
1973 1 140 ALA MB 1 141 ILE QG . . 5.810 5.014 4.919 5.239 . 0 0 "[ . 1 . 2]" 1
1974 1 140 ALA MB 1 142 ASN H . . 5.160 4.074 3.900 4.754 . 0 0 "[ . 1 . 2]" 1
1975 1 140 ALA MB 1 146 LEU QD . . 5.920 4.940 4.715 5.299 . 0 0 "[ . 1 . 2]" 1
1976 1 141 ILE H 1 141 ILE MD . . 4.650 4.472 4.320 4.565 . 0 0 "[ . 1 . 2]" 1
1977 1 141 ILE H 1 141 ILE MG . . 4.210 2.020 1.707 2.174 . 0 0 "[ . 1 . 2]" 1
1978 1 141 ILE H 1 142 ASN H . . 4.240 2.341 2.168 2.776 . 0 0 "[ . 1 . 2]" 1
1979 1 141 ILE H 1 146 LEU QD . . 5.300 3.787 3.475 4.312 . 0 0 "[ . 1 . 2]" 1
1980 1 141 ILE HA 1 141 ILE MD . . 4.440 3.242 2.335 3.700 . 0 0 "[ . 1 . 2]" 1
1981 1 141 ILE HB 1 142 ASN H . . 5.020 4.183 3.612 4.408 . 0 0 "[ . 1 . 2]" 1
1982 1 141 ILE HB 1 146 LEU QD . . 4.560 3.908 3.682 4.174 . 0 0 "[ . 1 . 2]" 1
1983 1 141 ILE MD 1 141 ILE MG . . 3.050 2.566 2.021 3.153 0.103 17 0 "[ . 1 . 2]" 1
1984 1 141 ILE MD 1 142 ASN H . . 4.880 4.934 3.882 5.345 0.465 7 0 "[ . 1 . 2]" 1
1985 1 141 ILE MD 1 145 GLN H . . 5.610 5.083 4.487 5.688 0.078 8 0 "[ . 1 . 2]" 1
1986 1 141 ILE MD 1 145 GLN QG . . 3.860 3.178 1.823 4.006 0.146 7 0 "[ . 1 . 2]" 1
1987 1 141 ILE QG 1 142 ASN H . . 5.130 3.778 2.351 4.189 . 0 0 "[ . 1 . 2]" 1
1988 1 141 ILE QG 1 145 GLN H . . 4.510 4.308 3.545 4.688 0.178 8 0 "[ . 1 . 2]" 1
1989 1 141 ILE QG 1 145 GLN QB . . 4.100 1.834 1.683 2.265 . 0 0 "[ . 1 . 2]" 1
1990 1 141 ILE QG 1 145 GLN QG . . 4.320 2.743 1.803 3.678 . 0 0 "[ . 1 . 2]" 1
1991 1 141 ILE QG 1 146 LEU QD . . 3.790 2.327 1.836 2.818 . 0 0 "[ . 1 . 2]" 1
1992 1 141 ILE MG 1 142 ASN H . . 4.390 2.331 1.609 2.785 . 0 0 "[ . 1 . 2]" 1
1993 1 141 ILE MG 1 146 LEU QD . . 3.240 1.787 1.747 1.909 . 0 0 "[ . 1 . 2]" 1
1994 1 142 ASN H 1 142 ASN QB . . 3.540 2.295 2.047 3.128 . 0 0 "[ . 1 . 2]" 1
1995 1 142 ASN H 1 145 GLN QB . . 5.310 4.655 4.228 5.076 . 0 0 "[ . 1 . 2]" 1
1996 1 142 ASN H 1 146 LEU H . . 5.500 5.074 4.449 5.393 . 0 0 "[ . 1 . 2]" 1
1997 1 142 ASN H 1 146 LEU QD . . 4.010 2.846 1.939 3.277 . 0 0 "[ . 1 . 2]" 1
1998 1 144 LYS HA 1 146 LEU H . . 4.940 4.626 4.378 4.820 . 0 0 "[ . 1 . 2]" 1
1999 1 144 LYS HA 1 146 LEU QB . . 5.810 5.080 4.750 5.262 . 0 0 "[ . 1 . 2]" 1
2000 1 144 LYS HA 1 147 THR H . . 4.060 3.688 3.535 4.199 0.139 6 0 "[ . 1 . 2]" 1
2001 1 144 LYS QB 1 145 GLN H . . 3.950 2.516 2.121 2.953 . 0 0 "[ . 1 . 2]" 1
2002 1 145 GLN H 1 145 GLN QG . . 4.190 2.151 1.815 4.051 . 0 0 "[ . 1 . 2]" 1
2003 1 145 GLN H 1 146 LEU H . . 3.840 2.903 2.585 3.030 . 0 0 "[ . 1 . 2]" 1
2004 1 145 GLN H 1 146 LEU QD . . 4.980 4.986 4.405 5.292 0.312 15 0 "[ . 1 . 2]" 1
2005 1 145 GLN H 1 147 THR H . . 4.930 4.483 4.228 4.776 . 0 0 "[ . 1 . 2]" 1
2006 1 145 GLN H 1 148 TYR H . . 5.460 4.629 4.476 4.793 . 0 0 "[ . 1 . 2]" 1
2007 1 145 GLN HA 1 146 LEU QD . . 5.920 5.358 4.768 5.747 . 0 0 "[ . 1 . 2]" 1
2008 1 145 GLN HA 1 147 THR H . . 5.390 4.803 4.549 4.935 . 0 0 "[ . 1 . 2]" 1
2009 1 145 GLN HA 1 148 TYR H . . 4.220 3.537 3.317 3.635 . 0 0 "[ . 1 . 2]" 1
2010 1 145 GLN HA 1 148 TYR HB2 . . 5.010 3.061 2.336 3.480 . 0 0 "[ . 1 . 2]" 1
2011 1 145 GLN HA 1 148 TYR QB . . 4.270 2.492 2.166 2.962 . 0 0 "[ . 1 . 2]" 1
2012 1 145 GLN HA 1 148 TYR HB3 . . 5.010 2.781 2.222 4.420 . 0 0 "[ . 1 . 2]" 1
2013 1 145 GLN QB 1 147 THR H . . 5.050 4.808 4.623 5.067 0.017 5 0 "[ . 1 . 2]" 1
2014 1 145 GLN QB 1 148 TYR H . . 5.260 4.766 4.675 4.929 . 0 0 "[ . 1 . 2]" 1
2015 1 145 GLN HB2 1 146 LEU H . . 4.580 2.463 2.191 3.652 . 0 0 "[ . 1 . 2]" 1
2016 1 145 GLN HB3 1 146 LEU H . . 4.580 3.515 2.199 3.971 . 0 0 "[ . 1 . 2]" 1
2017 1 145 GLN QG 1 146 LEU H . . 4.200 3.577 3.283 3.750 . 0 0 "[ . 1 . 2]" 1
2018 1 145 GLN QG 1 147 THR H . . 6.000 5.743 5.443 6.021 0.021 5 0 "[ . 1 . 2]" 1
2019 1 146 LEU H 1 146 LEU HB2 . . 3.850 2.061 2.040 2.118 . 0 0 "[ . 1 . 2]" 1
2020 1 146 LEU H 1 146 LEU HB3 . . 3.850 3.218 3.092 3.441 . 0 0 "[ . 1 . 2]" 1
2021 1 146 LEU H 1 146 LEU QD . . 3.740 2.867 2.348 3.140 . 0 0 "[ . 1 . 2]" 1
2022 1 146 LEU H 1 146 LEU HG . . 4.300 4.274 4.087 4.465 0.165 17 0 "[ . 1 . 2]" 1
2023 1 146 LEU H 1 147 THR H . . 4.130 2.909 2.836 3.014 . 0 0 "[ . 1 . 2]" 1
2024 1 146 LEU H 1 148 TYR H . . 4.960 4.027 3.929 4.326 . 0 0 "[ . 1 . 2]" 1
2025 1 146 LEU HA 1 146 LEU QD . . 3.670 2.481 2.044 2.890 . 0 0 "[ . 1 . 2]" 1
2026 1 146 LEU HA 1 149 LEU H . . 4.400 3.929 3.834 4.047 . 0 0 "[ . 1 . 2]" 1
2027 1 146 LEU QB 1 147 THR H . . 3.810 2.362 2.223 2.565 . 0 0 "[ . 1 . 2]" 1
2028 1 146 LEU QB 1 147 THR HB . . 5.810 5.167 5.093 5.257 . 0 0 "[ . 1 . 2]" 1
2029 1 146 LEU QB 1 148 TYR H . . 5.190 4.405 4.286 4.652 . 0 0 "[ . 1 . 2]" 1
2030 1 146 LEU QD 1 147 THR H . . 4.540 3.878 3.725 3.964 . 0 0 "[ . 1 . 2]" 1
2031 1 146 LEU QD 1 148 TYR H . . 5.920 5.315 5.167 5.415 . 0 0 "[ . 1 . 2]" 1
2032 1 146 LEU HG 1 147 THR H . . 5.220 4.637 4.413 4.975 . 0 0 "[ . 1 . 2]" 1
2033 1 147 THR H 1 147 THR HB . . 4.060 3.614 3.597 3.619 . 0 0 "[ . 1 . 2]" 1
2034 1 147 THR H 1 147 THR MG . . 4.160 2.076 1.918 2.267 . 0 0 "[ . 1 . 2]" 1
2035 1 147 THR H 1 148 TYR H . . 3.780 2.693 2.622 2.785 . 0 0 "[ . 1 . 2]" 1
2036 1 147 THR H 1 148 TYR QB . . 5.200 4.431 4.323 4.798 . 0 0 "[ . 1 . 2]" 1
2037 1 147 THR H 1 150 GLU HB2 . . 4.610 4.453 4.299 4.605 . 0 0 "[ . 1 . 2]" 1
2038 1 147 THR H 1 150 GLU QG . . 5.810 5.648 5.426 5.906 0.096 8 0 "[ . 1 . 2]" 1
2039 1 147 THR HA 1 150 GLU H . . 3.950 3.350 3.216 3.473 . 0 0 "[ . 1 . 2]" 1
2040 1 147 THR HA 1 150 GLU HA . . 5.630 4.823 4.750 4.902 . 0 0 "[ . 1 . 2]" 1
2041 1 147 THR HA 1 150 GLU HB2 . . 4.290 2.267 2.080 2.380 . 0 0 "[ . 1 . 2]" 1
2042 1 147 THR HA 1 150 GLU HB3 . . 4.040 2.666 2.454 2.828 . 0 0 "[ . 1 . 2]" 1
2043 1 147 THR HA 1 150 GLU HG2 . . 5.150 4.542 4.152 4.692 . 0 0 "[ . 1 . 2]" 1
2044 1 147 THR HA 1 150 GLU QG . . 4.350 3.514 3.338 3.912 . 0 0 "[ . 1 . 2]" 1
2045 1 147 THR HA 1 150 GLU HG3 . . 5.150 3.679 3.460 4.270 . 0 0 "[ . 1 . 2]" 1
2046 1 147 THR HB 1 148 TYR H . . 3.970 3.857 3.778 3.954 . 0 0 "[ . 1 . 2]" 1
2047 1 147 THR HB 1 150 GLU H . . 5.460 5.135 5.071 5.196 . 0 0 "[ . 1 . 2]" 1
2048 1 147 THR HB 1 151 LYS H . . 5.750 4.960 4.436 5.573 . 0 0 "[ . 1 . 2]" 1
2049 1 147 THR MG 1 148 TYR H . . 4.130 3.854 3.642 3.976 . 0 0 "[ . 1 . 2]" 1
2050 1 148 TYR H 1 148 TYR HB2 . . 3.710 2.560 2.192 2.868 . 0 0 "[ . 1 . 2]" 1
2051 1 148 TYR H 1 148 TYR HB3 . . 3.710 2.571 2.234 3.591 . 0 0 "[ . 1 . 2]" 1
2052 1 148 TYR H 1 149 LEU H . . 4.190 2.959 2.828 3.046 . 0 0 "[ . 1 . 2]" 1
2053 1 148 TYR H 1 149 LEU QD . . 5.920 5.361 5.228 5.529 . 0 0 "[ . 1 . 2]" 1
2054 1 148 TYR H 1 150 GLU H . . 4.810 3.831 3.729 4.000 . 0 0 "[ . 1 . 2]" 1
2055 1 148 TYR H 1 150 GLU HB2 . . 4.910 4.714 4.541 4.913 0.003 6 0 "[ . 1 . 2]" 1
2056 1 148 TYR HA 1 148 TYR HE1 . . 4.520 4.651 4.416 4.978 0.458 19 0 "[ . 1 . 2]" 1
2057 1 148 TYR HA 1 151 LYS H . . 5.010 3.928 3.808 4.045 . 0 0 "[ . 1 . 2]" 1
2058 1 148 TYR QB 1 149 LEU HG . . 5.810 5.871 5.628 6.101 0.291 19 0 "[ . 1 . 2]" 1
2059 1 148 TYR HB2 1 149 LEU H . . 4.470 3.602 2.098 3.898 . 0 0 "[ . 1 . 2]" 1
2060 1 148 TYR HB3 1 149 LEU H . . 4.470 2.304 2.097 3.177 . 0 0 "[ . 1 . 2]" 1
2061 1 149 LEU H 1 149 LEU QD . . 4.080 3.149 2.982 3.427 . 0 0 "[ . 1 . 2]" 1
2062 1 149 LEU H 1 149 LEU HG . . 4.650 4.484 4.440 4.546 . 0 0 "[ . 1 . 2]" 1
2063 1 149 LEU H 1 150 GLU H . . 3.830 2.582 2.501 2.653 . 0 0 "[ . 1 . 2]" 1
2064 1 149 LEU H 1 150 GLU HB2 . . 4.650 4.525 4.416 4.650 0.000 13 0 "[ . 1 . 2]" 1
2065 1 149 LEU H 1 150 GLU HB3 . . 5.410 5.281 5.134 5.454 0.044 20 0 "[ . 1 . 2]" 1
2066 1 149 LEU H 1 151 LYS H . . 5.120 4.491 4.356 4.607 . 0 0 "[ . 1 . 2]" 1
2067 1 149 LEU HA 1 149 LEU QD . . 3.630 1.994 1.905 2.069 . 0 0 "[ . 1 . 2]" 1
2068 1 149 LEU HA 1 149 LEU HG . . 4.150 3.652 3.640 3.672 . 0 0 "[ . 1 . 2]" 1
2069 1 149 LEU HA 1 151 LYS H . . 5.050 4.297 3.979 4.458 . 0 0 "[ . 1 . 2]" 1
2070 1 149 LEU HA 1 152 TYR H . . 4.600 3.122 3.033 3.199 . 0 0 "[ . 1 . 2]" 1
2071 1 149 LEU HA 1 152 TYR HB2 . . 4.830 3.044 2.785 3.317 . 0 0 "[ . 1 . 2]" 1
2072 1 149 LEU HA 1 152 TYR QB . . 4.220 1.887 1.810 1.926 . 0 0 "[ . 1 . 2]" 1
2073 1 149 LEU HA 1 152 TYR HB3 . . 4.830 1.907 1.820 1.950 . 0 0 "[ . 1 . 2]" 1
2074 1 149 LEU QB 1 150 GLU H . . 4.080 2.904 2.719 3.025 . 0 0 "[ . 1 . 2]" 1
2075 1 149 LEU QB 1 152 TYR H . . 5.010 4.739 4.619 4.809 . 0 0 "[ . 1 . 2]" 1
2076 1 149 LEU QD 1 151 LYS H . . 5.920 4.810 4.600 4.945 . 0 0 "[ . 1 . 2]" 1
2077 1 149 LEU QD 1 152 TYR H . . 5.450 3.922 3.756 4.024 . 0 0 "[ . 1 . 2]" 1
2078 1 149 LEU QD 1 152 TYR QB . . 4.490 2.501 2.313 2.663 . 0 0 "[ . 1 . 2]" 1
2079 1 149 LEU HG 1 150 GLU H . . 5.780 5.344 5.155 5.455 . 0 0 "[ . 1 . 2]" 1
2080 1 149 LEU HG 1 150 GLU HA . . 6.000 6.065 5.883 6.155 0.155 3 0 "[ . 1 . 2]" 1
2081 1 150 GLU H 1 150 GLU HB2 . . 3.380 2.207 2.107 2.294 . 0 0 "[ . 1 . 2]" 1
2082 1 150 GLU H 1 150 GLU HB3 . . 3.290 2.902 2.779 3.077 . 0 0 "[ . 1 . 2]" 1
2083 1 150 GLU H 1 150 GLU HG2 . . 4.660 4.248 4.129 4.524 . 0 0 "[ . 1 . 2]" 1
2084 1 150 GLU H 1 150 GLU HG3 . . 4.660 4.374 3.902 4.599 . 0 0 "[ . 1 . 2]" 1
2085 1 150 GLU H 1 151 LYS H . . 3.740 2.772 2.678 2.873 . 0 0 "[ . 1 . 2]" 1
2086 1 150 GLU H 1 152 TYR H . . 4.730 3.771 3.560 3.871 . 0 0 "[ . 1 . 2]" 1
2087 1 150 GLU HA 1 150 GLU HG2 . . 4.030 2.390 2.194 2.738 . 0 0 "[ . 1 . 2]" 1
2088 1 150 GLU HA 1 150 GLU QG . . 3.500 2.278 2.172 2.596 . 0 0 "[ . 1 . 2]" 1
2089 1 150 GLU HA 1 150 GLU HG3 . . 4.030 3.327 2.350 3.662 . 0 0 "[ . 1 . 2]" 1
2090 1 150 GLU HB2 1 151 LYS H . . 3.750 3.534 3.415 3.761 0.011 12 0 "[ . 1 . 2]" 1
2091 1 150 GLU HB3 1 151 LYS H . . 3.460 2.525 2.408 2.732 . 0 0 "[ . 1 . 2]" 1
2092 1 150 GLU QG 1 151 LYS H . . 4.570 4.314 4.128 4.459 . 0 0 "[ . 1 . 2]" 1
2093 1 150 GLU HG2 1 151 LYS H . . 5.210 4.764 4.384 5.023 . 0 0 "[ . 1 . 2]" 1
2094 1 150 GLU HG2 1 151 LYS HA . . 6.000 5.429 4.640 6.033 0.033 10 0 "[ . 1 . 2]" 1
2095 1 150 GLU HG3 1 151 LYS H . . 5.210 4.956 4.675 5.128 . 0 0 "[ . 1 . 2]" 1
2096 1 150 GLU HG3 1 151 LYS HA . . 6.000 5.959 5.552 6.077 0.077 8 0 "[ . 1 . 2]" 1
2097 1 151 LYS H 1 151 LYS QB . . 3.390 2.202 2.132 2.308 . 0 0 "[ . 1 . 2]" 1
2098 1 151 LYS H 1 151 LYS HG2 . . 4.600 4.176 3.650 4.407 . 0 0 "[ . 1 . 2]" 1
2099 1 151 LYS H 1 151 LYS QG . . 4.020 3.186 3.031 3.362 . 0 0 "[ . 1 . 2]" 1
2100 1 151 LYS H 1 151 LYS HG3 . . 4.600 3.315 3.146 3.487 . 0 0 "[ . 1 . 2]" 1
2101 1 151 LYS H 1 152 TYR H . . 3.190 2.219 1.986 2.382 . 0 0 "[ . 1 . 2]" 1
2102 1 151 LYS H 1 152 TYR HA . . 5.640 4.862 4.658 5.025 . 0 0 "[ . 1 . 2]" 1
2103 1 151 LYS H 1 152 TYR QB . . 4.680 3.993 3.780 4.162 . 0 0 "[ . 1 . 2]" 1
2104 1 151 LYS HA 1 151 LYS QD . . 4.800 3.984 3.917 4.082 . 0 0 "[ . 1 . 2]" 1
2105 1 151 LYS HA 1 151 LYS QE . . 4.990 4.082 2.908 4.680 . 0 0 "[ . 1 . 2]" 1
2106 1 151 LYS HA 1 151 LYS HG2 . . 4.140 2.407 2.090 2.634 . 0 0 "[ . 1 . 2]" 1
2107 1 151 LYS HA 1 151 LYS QG . . 3.610 2.242 2.066 2.293 . 0 0 "[ . 1 . 2]" 1
2108 1 151 LYS HA 1 151 LYS HG3 . . 4.140 2.791 2.516 3.308 . 0 0 "[ . 1 . 2]" 1
2109 1 151 LYS QB 1 151 LYS QD . . 3.430 2.185 2.088 2.312 . 0 0 "[ . 1 . 2]" 1
2110 1 151 LYS HB2 1 152 TYR H . . 4.140 3.154 3.026 3.554 . 0 0 "[ . 1 . 2]" 1
2111 1 151 LYS HB3 1 152 TYR H . . 4.140 3.600 3.512 4.071 . 0 0 "[ . 1 . 2]" 1
2112 1 151 LYS QG 1 152 TYR H . . 4.530 4.483 4.384 4.533 0.003 10 0 "[ . 1 . 2]" 1
2113 1 151 LYS HG2 1 152 TYR H . . 5.260 5.173 4.957 5.276 0.016 13 0 "[ . 1 . 2]" 1
2114 1 151 LYS HG3 1 152 TYR H . . 5.260 4.920 4.855 5.086 . 0 0 "[ . 1 . 2]" 1
2115 1 152 TYR H 1 152 TYR HB2 . . 3.410 2.523 2.428 2.722 . 0 0 "[ . 1 . 2]" 1
2116 1 152 TYR H 1 152 TYR HB3 . . 3.410 2.572 2.416 2.634 . 0 0 "[ . 1 . 2]" 1
2117 1 152 TYR H 1 153 ARG H . . 5.110 4.621 4.548 4.639 . 0 0 "[ . 1 . 2]" 1
2118 1 152 TYR HA 1 152 TYR HE2 . . 5.450 5.349 4.952 6.080 0.630 14 5 "[ *.* 1 * +. - 2]" 1
2119 1 152 TYR QB 1 152 TYR HE2 . . 4.490 4.381 4.332 4.416 . 0 0 "[ . 1 . 2]" 1
2120 1 152 TYR HE2 1 153 ARG H . . 5.260 4.883 4.202 5.383 0.123 13 0 "[ . 1 . 2]" 1
2121 1 153 ARG H 1 153 ARG QG . . 4.820 3.484 2.449 4.162 . 0 0 "[ . 1 . 2]" 1
2122 1 153 ARG H 1 154 PRO HD2 . . 6.000 4.820 4.805 4.828 . 0 0 "[ . 1 . 2]" 1
2123 1 153 ARG HA 1 153 ARG QG . . 3.500 2.927 2.512 3.440 . 0 0 "[ . 1 . 2]" 1
2124 1 153 ARG QB 1 154 PRO HD2 . . 4.550 3.033 2.527 3.439 . 0 0 "[ . 1 . 2]" 1
2125 1 154 PRO HA 1 155 LYS QG . . 5.170 4.081 3.813 4.348 . 0 0 "[ . 1 . 2]" 1
2126 1 154 PRO QB 1 155 LYS H . . 4.660 3.525 3.407 3.595 . 0 0 "[ . 1 . 2]" 1
2127 1 155 LYS H 1 155 LYS QG . . 4.790 2.245 1.985 2.464 . 0 0 "[ . 1 . 2]" 1
2128 1 156 GLN HA 1 157 ARG HA . . 5.430 4.557 4.452 4.760 . 0 0 "[ . 1 . 2]" 1
2129 1 156 GLN HB2 1 157 ARG H . . 5.340 4.371 4.117 4.644 . 0 0 "[ . 1 . 2]" 1
2130 1 156 GLN HB3 1 157 ARG H . . 5.340 4.353 4.093 4.530 . 0 0 "[ . 1 . 2]" 1
2131 1 157 ARG HA 1 157 ARG QD . . 4.590 3.528 2.153 4.494 . 0 0 "[ . 1 . 2]" 1
2132 1 157 ARG HA 1 157 ARG QG . . 4.000 2.332 2.039 3.425 . 0 0 "[ . 1 . 2]" 1
2133 1 158 LEU H 1 158 LEU HG . . 5.350 4.200 3.941 4.486 . 0 0 "[ . 1 . 2]" 1
2134 1 158 LEU HA 1 158 LEU MD2 . . 3.540 2.121 1.953 2.528 . 0 0 "[ . 1 . 2]" 1
2135 1 158 LEU HB2 1 158 LEU MD2 . . 3.480 2.425 2.318 2.511 . 0 0 "[ . 1 . 2]" 1
2136 1 161 LYS HA 1 161 LYS QE . . 5.380 4.687 4.513 4.757 . 0 0 "[ . 1 . 2]" 1
2137 1 161 LYS HA 1 162 ASP H . . 3.410 2.388 2.296 2.462 . 0 0 "[ . 1 . 2]" 1
2138 1 161 LYS QB 1 162 ASP H . . 3.750 3.191 3.050 3.368 . 0 0 "[ . 1 . 2]" 1
2139 1 161 LYS QG 1 162 ASP H . . 4.430 2.200 1.924 2.951 . 0 0 "[ . 1 . 2]" 1
2140 1 162 ASP H 1 162 ASP QB . . 3.450 2.629 2.202 2.904 . 0 0 "[ . 1 . 2]" 1
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