NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
510847 |
2lch   |
17612 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lch
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 1434
_Distance_constraint_stats_list.Viol_count 1873
_Distance_constraint_stats_list.Viol_total 4009.470
_Distance_constraint_stats_list.Viol_max 0.580
_Distance_constraint_stats_list.Viol_rms 0.0339
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0070
_Distance_constraint_stats_list.Viol_average_violations_only 0.1070
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 5 GLN 0.088 0.056 12 0 "[ . 1 . 2]"
1 6 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 TYR 0.583 0.170 15 0 "[ . 1 . 2]"
1 8 ILE 1.026 0.128 15 0 "[ . 1 . 2]"
1 9 LYS 3.002 0.270 1 0 "[ . 1 . 2]"
1 10 LYS 0.893 0.170 15 0 "[ . 1 . 2]"
1 11 VAL 0.572 0.106 3 0 "[ . 1 . 2]"
1 12 THR 0.069 0.048 17 0 "[ . 1 . 2]"
1 13 ASP 2.173 0.192 17 0 "[ . 1 . 2]"
1 14 GLU 2.155 0.115 15 0 "[ . 1 . 2]"
1 15 LEU 3.933 0.228 18 0 "[ . 1 . 2]"
1 16 LYS 4.262 0.228 18 0 "[ . 1 . 2]"
1 17 GLU 7.824 0.458 4 0 "[ . 1 . 2]"
1 18 LEU 12.948 0.458 4 0 "[ . 1 . 2]"
1 19 ILE 4.533 0.263 12 0 "[ . 1 . 2]"
1 20 GLN 2.138 0.172 14 0 "[ . 1 . 2]"
1 21 ASN 0.987 0.152 20 0 "[ . 1 . 2]"
1 22 VAL 4.824 0.263 12 0 "[ . 1 . 2]"
1 23 ASN 2.161 0.172 14 0 "[ . 1 . 2]"
1 24 ASP 1.216 0.234 1 0 "[ . 1 . 2]"
1 25 ASP 2.170 0.234 1 0 "[ . 1 . 2]"
1 26 ILE 4.002 0.266 4 0 "[ . 1 . 2]"
1 27 LYS 0.985 0.285 4 0 "[ . 1 . 2]"
1 28 GLU 0.156 0.156 14 0 "[ . 1 . 2]"
1 29 VAL 8.201 0.325 15 0 "[ . 1 . 2]"
1 30 GLU 2.991 0.410 20 0 "[ . 1 . 2]"
1 31 LYS 4.441 0.515 3 1 "[ + . 1 . 2]"
1 32 ASN 1.861 0.515 3 1 "[ + . 1 . 2]"
1 33 PRO 0.530 0.068 2 0 "[ . 1 . 2]"
1 34 GLU 3.072 0.230 13 0 "[ . 1 . 2]"
1 35 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 MET 13.645 0.332 3 0 "[ . 1 . 2]"
1 37 GLU 3.923 0.299 17 0 "[ . 1 . 2]"
1 38 TYR 2.610 0.281 10 0 "[ . 1 . 2]"
1 39 TRP 1.459 0.189 13 0 "[ . 1 . 2]"
1 40 ASN 7.002 0.580 10 2 "[ .- + . 2]"
1 41 LYS 3.631 0.311 11 0 "[ . 1 . 2]"
1 42 ILE 1.495 0.184 8 0 "[ . 1 . 2]"
1 43 TYR 3.340 0.287 13 0 "[ . 1 . 2]"
1 44 ARG 0.677 0.254 6 0 "[ . 1 . 2]"
1 45 LEU 1.001 0.113 6 0 "[ . 1 . 2]"
1 46 VAL 1.496 0.178 9 0 "[ . 1 . 2]"
1 47 HIS 0.754 0.163 6 0 "[ . 1 . 2]"
1 48 THR 2.364 0.194 2 0 "[ . 1 . 2]"
1 49 MET 9.184 0.365 13 0 "[ . 1 . 2]"
1 50 LYS 3.249 0.310 18 0 "[ . 1 . 2]"
1 51 GLU 4.676 0.187 20 0 "[ . 1 . 2]"
1 52 ILE 1.704 0.267 1 0 "[ . 1 . 2]"
1 53 THR 8.945 0.233 3 0 "[ . 1 . 2]"
1 54 GLU 2.577 0.425 10 0 "[ . 1 . 2]"
1 55 THR 1.542 0.425 10 0 "[ . 1 . 2]"
1 56 MET 4.062 0.228 20 0 "[ . 1 . 2]"
1 57 GLY 0.083 0.053 17 0 "[ . 1 . 2]"
1 58 PHE 8.855 0.233 3 0 "[ . 1 . 2]"
1 59 SER 0.555 0.129 17 0 "[ . 1 . 2]"
1 60 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 VAL 3.342 0.228 20 0 "[ . 1 . 2]"
1 62 ALA 8.055 0.268 3 0 "[ . 1 . 2]"
1 63 LYS 0.046 0.028 9 0 "[ . 1 . 2]"
1 64 VAL 2.339 0.250 2 0 "[ . 1 . 2]"
1 65 LEU 8.757 0.322 6 0 "[ . 1 . 2]"
1 66 HIS 5.797 0.268 3 0 "[ . 1 . 2]"
1 67 THR 7.856 0.322 6 0 "[ . 1 . 2]"
1 68 ILE 6.986 0.366 10 0 "[ . 1 . 2]"
1 69 MET 7.709 0.395 11 0 "[ . 1 . 2]"
1 70 ASN 6.119 0.395 11 0 "[ . 1 . 2]"
1 71 LEU 7.333 0.302 18 0 "[ . 1 . 2]"
1 72 VAL 7.298 0.259 8 0 "[ . 1 . 2]"
1 73 ASP 0.401 0.287 13 0 "[ . 1 . 2]"
1 74 LYS 6.125 0.348 18 0 "[ . 1 . 2]"
1 75 MET 8.707 0.325 15 0 "[ . 1 . 2]"
1 76 LEU 3.855 0.244 13 0 "[ . 1 . 2]"
1 77 ASN 1.081 0.175 1 0 "[ . 1 . 2]"
1 78 SER 0.100 0.067 14 0 "[ . 1 . 2]"
1 79 GLU 4.829 0.271 5 0 "[ . 1 . 2]"
1 80 ILE 7.388 0.319 17 0 "[ . 1 . 2]"
1 81 LYS 1.191 0.219 11 0 "[ . 1 . 2]"
1 82 ILE 12.465 0.332 3 0 "[ . 1 . 2]"
1 83 THR 5.885 0.240 4 0 "[ . 1 . 2]"
1 85 ASP 3.698 0.287 17 0 "[ . 1 . 2]"
1 86 LEU 10.957 0.301 19 0 "[ . 1 . 2]"
1 87 ILE 6.345 0.257 11 0 "[ . 1 . 2]"
1 88 ASP 8.425 0.287 17 0 "[ . 1 . 2]"
1 89 LYS 6.157 0.301 19 0 "[ . 1 . 2]"
1 90 VAL 4.497 0.195 10 0 "[ . 1 . 2]"
1 91 LYS 1.818 0.202 1 0 "[ . 1 . 2]"
1 92 LYS 8.684 0.223 20 0 "[ . 1 . 2]"
1 93 LYS 3.392 0.223 20 0 "[ . 1 . 2]"
1 94 LEU 2.035 0.312 8 0 "[ . 1 . 2]"
1 95 ASP 6.050 0.219 16 0 "[ . 1 . 2]"
1 96 MET 5.530 0.219 16 0 "[ . 1 . 2]"
1 97 VAL 4.253 0.312 8 0 "[ . 1 . 2]"
1 98 THR 0.049 0.028 10 0 "[ . 1 . 2]"
1 99 ARG 0.671 0.172 12 0 "[ . 1 . 2]"
1 100 GLU 0.518 0.236 13 0 "[ . 1 . 2]"
1 101 LEU 1.002 0.132 10 0 "[ . 1 . 2]"
1 102 ASP 0.276 0.172 12 0 "[ . 1 . 2]"
1 103 LYS 0.053 0.053 18 0 "[ . 1 . 2]"
1 104 LYS 3.545 0.412 18 0 "[ . 1 . 2]"
1 105 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 VAL 0.041 0.038 9 0 "[ . 1 . 2]"
1 112 PRO 0.041 0.038 9 0 "[ . 1 . 2]"
1 113 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 5 GLN HA 1 5 GLN HG2 3.810 . 3.810 3.017 2.541 3.774 . 0 0 "[ . 1 . 2]" 1
2 1 5 GLN HA 1 6 GLU H 4.700 . 4.700 3.534 3.463 3.589 . 0 0 "[ . 1 . 2]" 1
3 1 5 GLN HA 1 7 TYR H 5.510 . 5.510 4.358 4.064 4.713 . 0 0 "[ . 1 . 2]" 1
4 1 5 GLN HA 1 8 ILE HB 4.510 . 4.510 2.823 2.299 4.254 . 0 0 "[ . 1 . 2]" 1
5 1 5 GLN HA 1 8 ILE MD 4.900 . 4.900 3.703 2.042 4.956 0.056 12 0 "[ . 1 . 2]" 1
6 1 5 GLN HA 1 8 ILE HG12 5.960 . 5.960 3.665 2.630 5.300 . 0 0 "[ . 1 . 2]" 1
7 1 5 GLN HA 1 8 ILE HG13 6.000 . 6.000 3.419 2.713 4.889 . 0 0 "[ . 1 . 2]" 1
8 1 5 GLN HA 1 8 ILE MG 5.410 . 5.410 4.123 3.746 5.288 . 0 0 "[ . 1 . 2]" 1
9 1 5 GLN HB2 1 6 GLU H 4.120 . 4.120 3.101 2.406 3.991 . 0 0 "[ . 1 . 2]" 1
10 1 6 GLU H 1 6 GLU HG2 4.690 . 4.690 3.617 2.108 4.664 . 0 0 "[ . 1 . 2]" 1
11 1 6 GLU H 1 6 GLU HG3 5.270 . 5.270 3.588 2.012 4.580 . 0 0 "[ . 1 . 2]" 1
12 1 6 GLU H 1 7 TYR H 4.870 . 4.870 2.769 2.563 2.942 . 0 0 "[ . 1 . 2]" 1
13 1 6 GLU HA 1 6 GLU HG2 4.210 . 4.210 3.282 2.487 3.909 . 0 0 "[ . 1 . 2]" 1
14 1 6 GLU HA 1 6 GLU HG3 3.890 . 3.890 3.175 2.567 3.855 . 0 0 "[ . 1 . 2]" 1
15 1 6 GLU QB 1 7 TYR H 5.070 . 5.070 2.619 2.266 2.849 . 0 0 "[ . 1 . 2]" 1
16 1 7 TYR H 1 7 TYR HB3 4.230 . 4.230 2.480 2.364 2.611 . 0 0 "[ . 1 . 2]" 1
17 1 7 TYR H 1 7 TYR QD 5.520 . 5.520 4.253 4.214 4.292 . 0 0 "[ . 1 . 2]" 1
18 1 7 TYR HA 1 7 TYR QD . . 4.240 2.776 2.454 2.988 . 0 0 "[ . 1 . 2]" 1
19 1 7 TYR HA 1 7 TYR QE 4.750 . 4.750 4.725 4.597 4.817 0.067 14 0 "[ . 1 . 2]" 1
20 1 7 TYR HA 1 10 LYS QB 4.330 . 4.330 2.898 2.316 3.392 . 0 0 "[ . 1 . 2]" 1
21 1 7 TYR HA 1 10 LYS HD3 5.070 . 5.070 3.856 1.971 5.240 0.170 15 0 "[ . 1 . 2]" 1
22 1 7 TYR HB2 1 8 ILE H 5.360 . 5.360 3.877 3.738 4.019 . 0 0 "[ . 1 . 2]" 1
23 1 7 TYR HB3 1 8 ILE H 4.800 . 4.800 2.526 2.306 2.717 . 0 0 "[ . 1 . 2]" 1
24 1 7 TYR HB3 1 8 ILE HB 5.620 . 5.620 4.889 4.616 5.062 . 0 0 "[ . 1 . 2]" 1
25 1 7 TYR QD 1 8 ILE H 5.590 . 5.590 3.424 2.985 3.821 . 0 0 "[ . 1 . 2]" 1
26 1 7 TYR QD 1 8 ILE HA 5.580 . 5.580 3.591 3.160 4.219 . 0 0 "[ . 1 . 2]" 1
27 1 7 TYR QD 1 8 ILE MD 4.530 . 4.530 3.095 2.220 4.556 0.026 4 0 "[ . 1 . 2]" 1
28 1 7 TYR QD 1 8 ILE HG12 5.470 . 5.470 3.437 2.749 5.488 0.018 5 0 "[ . 1 . 2]" 1
29 1 7 TYR QD 1 8 ILE HG13 5.340 . 5.340 4.144 2.811 4.984 . 0 0 "[ . 1 . 2]" 1
30 1 7 TYR QD 1 11 VAL QG 4.790 . 4.790 3.281 3.065 3.662 . 0 0 "[ . 1 . 2]" 1
31 1 7 TYR QE 1 11 VAL QG 4.070 . 4.070 2.898 2.688 3.239 . 0 0 "[ . 1 . 2]" 1
32 1 8 ILE H 1 8 ILE HB . . 4.170 2.511 2.271 2.585 . 0 0 "[ . 1 . 2]" 1
33 1 8 ILE H 1 8 ILE MD 5.300 . 5.300 3.290 2.334 3.655 . 0 0 "[ . 1 . 2]" 1
34 1 8 ILE H 1 8 ILE HG12 . . 4.830 2.676 2.032 3.957 . 0 0 "[ . 1 . 2]" 1
35 1 8 ILE H 1 8 ILE HG13 . . 4.650 3.124 2.042 4.034 . 0 0 "[ . 1 . 2]" 1
36 1 8 ILE H 1 8 ILE MG 4.740 . 4.740 3.806 3.715 3.829 . 0 0 "[ . 1 . 2]" 1
37 1 8 ILE HA 1 8 ILE MD 4.150 . 4.150 2.734 1.999 3.916 . 0 0 "[ . 1 . 2]" 1
38 1 8 ILE HA 1 56 MET ME 4.750 . 4.750 3.733 2.078 4.784 0.034 10 0 "[ . 1 . 2]" 1
39 1 8 ILE HB 1 9 LYS H 3.860 . 3.860 2.676 2.531 2.858 . 0 0 "[ . 1 . 2]" 1
40 1 8 ILE MD 1 56 MET ME 4.810 . 4.810 3.860 2.515 4.877 0.067 17 0 "[ . 1 . 2]" 1
41 1 8 ILE MG 1 9 LYS H 4.680 . 4.680 3.408 2.720 3.608 . 0 0 "[ . 1 . 2]" 1
42 1 8 ILE MG 1 9 LYS HA 4.340 . 4.340 3.554 2.990 3.725 . 0 0 "[ . 1 . 2]" 1
43 1 8 ILE MG 1 9 LYS HB3 5.500 . 5.500 5.389 4.217 5.628 0.128 15 0 "[ . 1 . 2]" 1
44 1 8 ILE MG 1 12 THR H 5.490 . 5.490 4.388 3.991 5.007 . 0 0 "[ . 1 . 2]" 1
45 1 8 ILE MG 1 56 MET HG3 6.000 . 6.000 4.633 3.931 5.418 . 0 0 "[ . 1 . 2]" 1
46 1 9 LYS H 1 9 LYS HB2 4.150 . 4.150 2.542 2.272 3.653 . 0 0 "[ . 1 . 2]" 1
47 1 9 LYS H 1 9 LYS HG2 4.440 . 4.440 3.690 2.237 4.508 0.068 12 0 "[ . 1 . 2]" 1
48 1 9 LYS H 1 9 LYS HG3 5.380 . 5.380 2.839 2.026 4.508 . 0 0 "[ . 1 . 2]" 1
49 1 9 LYS H 1 10 LYS H 5.180 . 5.180 2.749 2.607 2.908 . 0 0 "[ . 1 . 2]" 1
50 1 9 LYS HA 1 9 LYS HG2 4.340 . 4.340 2.892 2.602 3.858 . 0 0 "[ . 1 . 2]" 1
51 1 9 LYS HA 1 10 LYS H 5.170 . 5.170 3.565 3.539 3.602 . 0 0 "[ . 1 . 2]" 1
52 1 9 LYS HA 1 12 THR H 5.190 . 5.190 3.791 3.251 4.157 . 0 0 "[ . 1 . 2]" 1
53 1 9 LYS HB2 1 9 LYS QD . . 3.120 2.542 2.315 3.034 . 0 0 "[ . 1 . 2]" 1
54 1 9 LYS HB2 1 9 LYS QE 3.710 . 3.710 2.975 2.003 3.980 0.270 1 0 "[ . 1 . 2]" 1
55 1 9 LYS HB2 1 10 LYS H 3.740 . 3.740 2.958 2.368 3.847 0.107 2 0 "[ . 1 . 2]" 1
56 1 9 LYS HB3 1 10 LYS H 4.310 . 4.310 3.427 2.371 4.031 . 0 0 "[ . 1 . 2]" 1
57 1 9 LYS QD 1 9 LYS HG2 2.610 . 2.610 2.330 2.185 2.457 . 0 0 "[ . 1 . 2]" 1
58 1 9 LYS QE 1 9 LYS HG2 . . 3.230 2.787 2.445 3.355 0.125 12 0 "[ . 1 . 2]" 1
59 1 10 LYS H 1 10 LYS QB 3.350 . 3.350 2.364 2.163 2.522 . 0 0 "[ . 1 . 2]" 1
60 1 10 LYS H 1 11 VAL H 4.170 . 4.170 2.731 2.575 2.876 . 0 0 "[ . 1 . 2]" 1
61 1 10 LYS QB 1 11 VAL H 3.830 . 3.830 2.513 2.294 2.764 . 0 0 "[ . 1 . 2]" 1
62 1 10 LYS QB 1 14 GLU HG2 4.740 . 4.740 4.167 3.172 4.855 0.115 15 0 "[ . 1 . 2]" 1
63 1 10 LYS HE3 1 10 LYS QG 3.620 . 3.620 2.810 2.430 3.518 . 0 0 "[ . 1 . 2]" 1
64 1 11 VAL H 1 11 VAL HB . . 4.230 2.671 2.351 3.692 . 0 0 "[ . 1 . 2]" 1
65 1 11 VAL H 1 11 VAL QG 4.060 . 4.060 2.135 1.961 2.426 . 0 0 "[ . 1 . 2]" 1
66 1 11 VAL H 1 14 GLU HG3 4.830 . 4.830 4.751 4.275 4.936 0.106 3 0 "[ . 1 . 2]" 1
67 1 11 VAL HA 1 12 THR H 4.280 . 4.280 3.511 3.466 3.546 . 0 0 "[ . 1 . 2]" 1
68 1 11 VAL HA 1 13 ASP H 4.970 . 4.970 4.364 4.173 4.646 . 0 0 "[ . 1 . 2]" 1
69 1 11 VAL HA 1 14 GLU H 4.690 . 4.690 3.179 2.819 3.592 . 0 0 "[ . 1 . 2]" 1
70 1 11 VAL HA 1 14 GLU HB2 4.140 . 4.140 2.240 1.769 2.853 . 0 0 "[ . 1 . 2]" 1
71 1 11 VAL HA 1 14 GLU HB3 4.140 . 4.140 3.786 3.471 4.167 0.027 3 0 "[ . 1 . 2]" 1
72 1 11 VAL HA 1 14 GLU HG2 5.140 . 5.140 3.491 2.243 4.824 . 0 0 "[ . 1 . 2]" 1
73 1 11 VAL HA 1 14 GLU HG3 5.050 . 5.050 2.968 2.514 3.722 . 0 0 "[ . 1 . 2]" 1
74 1 11 VAL HB 1 12 THR H 4.680 . 4.680 3.336 2.667 4.167 . 0 0 "[ . 1 . 2]" 1
75 1 11 VAL QG 1 14 GLU HB2 5.600 . 5.600 3.227 2.865 3.857 . 0 0 "[ . 1 . 2]" 1
76 1 11 VAL QG 1 14 GLU HB3 4.910 . 4.910 4.186 3.638 4.887 . 0 0 "[ . 1 . 2]" 1
77 1 11 VAL QG 1 14 GLU HG2 5.510 . 5.510 4.470 3.581 5.530 0.020 16 0 "[ . 1 . 2]" 1
78 1 11 VAL QG 1 14 GLU HG3 5.150 . 5.150 3.862 3.025 4.664 . 0 0 "[ . 1 . 2]" 1
79 1 11 VAL QG 1 15 LEU HB3 5.370 . 5.370 4.749 4.224 5.197 . 0 0 "[ . 1 . 2]" 1
80 1 12 THR H 1 12 THR MG . . 4.110 3.737 2.205 3.842 . 0 0 "[ . 1 . 2]" 1
81 1 12 THR HA 1 12 THR MG . . 3.240 2.506 2.423 2.626 . 0 0 "[ . 1 . 2]" 1
82 1 12 THR HA 1 13 ASP H 4.860 . 4.860 3.591 3.543 3.614 . 0 0 "[ . 1 . 2]" 1
83 1 12 THR HA 1 15 LEU HB2 4.940 . 4.940 3.474 3.015 3.911 . 0 0 "[ . 1 . 2]" 1
84 1 12 THR HA 1 15 LEU HB3 4.140 . 4.140 3.008 2.569 3.589 . 0 0 "[ . 1 . 2]" 1
85 1 12 THR HA 1 15 LEU MD1 4.470 . 4.470 3.751 3.100 4.518 0.048 17 0 "[ . 1 . 2]" 1
86 1 12 THR HA 1 52 ILE MG 5.490 . 5.490 4.162 3.366 5.304 . 0 0 "[ . 1 . 2]" 1
87 1 12 THR HA 1 56 MET ME 5.410 . 5.410 3.380 2.083 4.652 . 0 0 "[ . 1 . 2]" 1
88 1 12 THR HB 1 13 ASP H . . 4.420 2.649 2.396 3.620 . 0 0 "[ . 1 . 2]" 1
89 1 12 THR MG 1 15 LEU HB3 5.230 . 5.230 3.979 3.537 4.885 . 0 0 "[ . 1 . 2]" 1
90 1 13 ASP H 1 13 ASP HB2 4.140 . 4.140 2.494 2.386 2.653 . 0 0 "[ . 1 . 2]" 1
91 1 13 ASP H 1 14 GLU H . . 4.190 2.583 2.492 2.642 . 0 0 "[ . 1 . 2]" 1
92 1 13 ASP H 1 14 GLU HA 5.250 . 5.250 5.251 5.163 5.293 0.043 20 0 "[ . 1 . 2]" 1
93 1 13 ASP HA 1 14 GLU H 5.320 . 5.320 3.543 3.519 3.577 . 0 0 "[ . 1 . 2]" 1
94 1 13 ASP HA 1 15 LEU MD2 4.820 . 4.820 4.885 4.647 5.010 0.190 4 0 "[ . 1 . 2]" 1
95 1 13 ASP HA 1 16 LYS H 5.600 . 5.600 3.127 2.730 3.833 . 0 0 "[ . 1 . 2]" 1
96 1 13 ASP HA 1 16 LYS QD . . 3.900 2.850 1.650 4.092 0.192 17 0 "[ . 1 . 2]" 1
97 1 13 ASP HA 1 16 LYS HG2 5.470 . 5.470 3.465 1.679 5.167 . 0 0 "[ . 1 . 2]" 1
98 1 13 ASP HA 1 17 GLU H 6.000 . 6.000 4.545 4.038 5.483 . 0 0 "[ . 1 . 2]" 1
99 1 13 ASP HB2 1 14 GLU H . . 4.630 3.138 2.642 4.069 . 0 0 "[ . 1 . 2]" 1
100 1 13 ASP HB2 1 14 GLU HG3 6.000 . 6.000 5.093 3.424 6.006 0.006 2 0 "[ . 1 . 2]" 1
101 1 13 ASP HB3 1 14 GLU H . . 4.710 3.641 2.620 3.937 . 0 0 "[ . 1 . 2]" 1
102 1 14 GLU H 1 14 GLU HB2 3.980 . 3.980 2.534 2.407 2.710 . 0 0 "[ . 1 . 2]" 1
103 1 14 GLU H 1 14 GLU HB3 4.130 . 4.130 3.629 3.605 3.652 . 0 0 "[ . 1 . 2]" 1
104 1 14 GLU H 1 14 GLU HG2 4.610 . 4.610 2.881 2.110 3.691 . 0 0 "[ . 1 . 2]" 1
105 1 14 GLU H 1 14 GLU HG3 4.880 . 4.880 3.008 2.227 3.738 . 0 0 "[ . 1 . 2]" 1
106 1 14 GLU H 1 15 LEU H 4.100 . 4.100 2.640 2.526 2.746 . 0 0 "[ . 1 . 2]" 1
107 1 14 GLU HA 1 14 GLU HG2 4.130 . 4.130 2.893 2.535 3.353 . 0 0 "[ . 1 . 2]" 1
108 1 14 GLU HA 1 14 GLU HG3 4.190 . 4.190 3.447 2.978 3.866 . 0 0 "[ . 1 . 2]" 1
109 1 14 GLU HB3 1 14 GLU HG2 2.910 . 2.910 2.741 2.433 3.022 0.112 8 0 "[ . 1 . 2]" 1
110 1 14 GLU HB3 1 15 LEU H 3.950 . 3.950 3.809 3.641 3.948 . 0 0 "[ . 1 . 2]" 1
111 1 14 GLU HB3 1 52 ILE MD 4.730 . 4.730 4.001 3.054 4.755 0.025 10 0 "[ . 1 . 2]" 1
112 1 15 LEU H 1 15 LEU HB2 4.280 . 4.280 2.575 2.460 2.675 . 0 0 "[ . 1 . 2]" 1
113 1 15 LEU H 1 16 LYS QD 5.360 . 5.360 4.358 3.793 5.382 0.022 12 0 "[ . 1 . 2]" 1
114 1 15 LEU H 1 52 ILE MD 5.540 . 5.540 3.750 3.239 4.724 . 0 0 "[ . 1 . 2]" 1
115 1 15 LEU HA 1 16 LYS H 5.440 . 5.440 3.590 3.551 3.628 . 0 0 "[ . 1 . 2]" 1
116 1 15 LEU HB2 1 16 LYS H 4.590 . 4.590 4.066 3.891 4.218 . 0 0 "[ . 1 . 2]" 1
117 1 15 LEU HB3 1 16 LYS H 5.110 . 5.110 2.785 2.525 3.044 . 0 0 "[ . 1 . 2]" 1
118 1 15 LEU HB3 1 16 LYS QE 4.240 . 4.240 4.093 3.150 4.417 0.177 18 0 "[ . 1 . 2]" 1
119 1 15 LEU MD2 1 16 LYS HA 3.700 . 3.700 3.091 2.847 3.758 0.058 18 0 "[ . 1 . 2]" 1
120 1 15 LEU MD2 1 16 LYS HB3 4.860 . 4.860 4.900 4.577 5.088 0.228 18 0 "[ . 1 . 2]" 1
121 1 15 LEU MD2 1 16 LYS QD 3.760 . 3.760 2.187 1.695 2.774 . 0 0 "[ . 1 . 2]" 1
122 1 15 LEU MD2 1 16 LYS QE 4.130 . 4.130 3.081 2.528 3.468 . 0 0 "[ . 1 . 2]" 1
123 1 15 LEU MD2 1 16 LYS HG2 5.090 . 5.090 4.403 3.314 4.894 . 0 0 "[ . 1 . 2]" 1
124 1 16 LYS H 1 16 LYS HB2 4.110 . 4.110 2.476 2.255 2.942 . 0 0 "[ . 1 . 2]" 1
125 1 16 LYS H 1 16 LYS QD 4.230 . 4.230 2.461 2.055 3.330 . 0 0 "[ . 1 . 2]" 1
126 1 16 LYS H 1 16 LYS HG2 4.710 . 4.710 3.597 1.987 4.356 . 0 0 "[ . 1 . 2]" 1
127 1 16 LYS H 1 16 LYS HG3 4.980 . 4.980 3.850 3.562 4.143 . 0 0 "[ . 1 . 2]" 1
128 1 16 LYS H 1 17 GLU H . . 4.240 2.704 2.598 2.802 . 0 0 "[ . 1 . 2]" 1
129 1 16 LYS HA 1 16 LYS QD 4.250 . 4.250 2.672 2.206 3.102 . 0 0 "[ . 1 . 2]" 1
130 1 16 LYS HA 1 16 LYS QE 5.700 . 5.700 4.396 4.130 4.742 . 0 0 "[ . 1 . 2]" 1
131 1 16 LYS HA 1 16 LYS HG2 4.190 . 4.190 3.633 3.185 3.779 . 0 0 "[ . 1 . 2]" 1
132 1 16 LYS HA 1 16 LYS HG3 . . 4.230 2.873 2.365 3.953 . 0 0 "[ . 1 . 2]" 1
133 1 16 LYS HA 1 17 GLU H 5.320 . 5.320 3.559 3.509 3.584 . 0 0 "[ . 1 . 2]" 1
134 1 16 LYS HA 1 18 LEU HB2 5.680 . 5.680 5.641 5.026 5.831 0.151 2 0 "[ . 1 . 2]" 1
135 1 16 LYS HA 1 19 ILE H 4.150 . 4.150 3.487 3.131 4.023 . 0 0 "[ . 1 . 2]" 1
136 1 16 LYS HA 1 19 ILE HB 4.300 . 4.300 2.735 2.332 3.307 . 0 0 "[ . 1 . 2]" 1
137 1 16 LYS HA 1 19 ILE MD . . 4.080 2.618 2.256 3.222 . 0 0 "[ . 1 . 2]" 1
138 1 16 LYS HA 1 19 ILE MG 5.190 . 5.190 4.026 3.482 4.551 . 0 0 "[ . 1 . 2]" 1
139 1 16 LYS HB2 1 17 GLU H 4.510 . 4.510 2.694 2.425 2.963 . 0 0 "[ . 1 . 2]" 1
140 1 16 LYS QD 1 17 GLU H 5.210 . 5.210 4.402 4.024 4.865 . 0 0 "[ . 1 . 2]" 1
141 1 16 LYS QD 1 19 ILE MD 3.630 . 3.630 3.288 2.429 3.738 0.108 19 0 "[ . 1 . 2]" 1
142 1 16 LYS QE 1 19 ILE MD 5.460 . 5.460 4.523 3.761 5.176 . 0 0 "[ . 1 . 2]" 1
143 1 16 LYS QE 1 101 LEU QD 3.730 . 3.730 2.247 1.623 3.781 0.051 20 0 "[ . 1 . 2]" 1
144 1 16 LYS HG3 1 19 ILE MD 5.080 . 5.080 4.079 2.961 5.213 0.133 15 0 "[ . 1 . 2]" 1
145 1 17 GLU H 1 17 GLU QB 3.590 . 3.590 2.386 2.150 2.555 . 0 0 "[ . 1 . 2]" 1
146 1 17 GLU H 1 17 GLU HG2 . . 4.970 3.356 2.192 4.598 . 0 0 "[ . 1 . 2]" 1
147 1 17 GLU H 1 17 GLU HG3 5.000 . 5.000 3.722 2.125 4.653 . 0 0 "[ . 1 . 2]" 1
148 1 17 GLU H 1 18 LEU H 4.210 . 4.210 2.641 2.512 2.750 . 0 0 "[ . 1 . 2]" 1
149 1 17 GLU H 1 18 LEU HB2 4.640 . 4.640 4.464 4.221 4.632 . 0 0 "[ . 1 . 2]" 1
150 1 17 GLU H 1 19 ILE MD 5.570 . 5.570 5.533 5.317 5.723 0.153 7 0 "[ . 1 . 2]" 1
151 1 17 GLU HA 1 17 GLU HG2 3.530 . 3.530 2.994 2.535 3.757 0.227 8 0 "[ . 1 . 2]" 1
152 1 17 GLU HA 1 18 LEU H 4.330 . 4.330 3.472 3.434 3.507 . 0 0 "[ . 1 . 2]" 1
153 1 17 GLU HA 1 18 LEU MD1 5.360 . 5.360 5.661 5.518 5.818 0.458 4 0 "[ . 1 . 2]" 1
154 1 17 GLU HA 1 20 GLN H . . 3.760 3.662 3.398 3.852 0.092 20 0 "[ . 1 . 2]" 1
155 1 17 GLU HA 1 21 ASN H 4.480 . 4.480 4.240 3.969 4.464 . 0 0 "[ . 1 . 2]" 1
156 1 17 GLU QB 1 18 LEU H . . 3.770 2.586 2.368 2.762 . 0 0 "[ . 1 . 2]" 1
157 1 17 GLU QB 1 18 LEU MD1 4.820 . 4.820 4.050 3.740 4.411 . 0 0 "[ . 1 . 2]" 1
158 1 17 GLU QB 1 18 LEU MD2 5.020 . 5.020 5.031 4.841 5.123 0.103 10 0 "[ . 1 . 2]" 1
159 1 18 LEU H 1 18 LEU MD1 4.760 . 4.760 3.631 3.163 3.839 . 0 0 "[ . 1 . 2]" 1
160 1 18 LEU H 1 18 LEU MD2 5.060 . 5.060 4.091 3.805 4.186 . 0 0 "[ . 1 . 2]" 1
161 1 18 LEU H 1 18 LEU HG 4.690 . 4.690 4.604 4.522 4.644 . 0 0 "[ . 1 . 2]" 1
162 1 18 LEU H 1 19 ILE H 4.020 . 4.020 2.674 2.558 2.939 . 0 0 "[ . 1 . 2]" 1
163 1 18 LEU H 1 19 ILE HG13 4.910 . 4.910 4.521 4.280 4.783 . 0 0 "[ . 1 . 2]" 1
164 1 18 LEU HA 1 18 LEU MD2 4.180 . 4.180 3.820 3.792 3.850 . 0 0 "[ . 1 . 2]" 1
165 1 18 LEU HA 1 18 LEU HG 4.260 . 4.260 3.037 2.932 3.156 . 0 0 "[ . 1 . 2]" 1
166 1 18 LEU HA 1 20 GLN H 6.000 . 6.000 4.481 4.282 4.742 . 0 0 "[ . 1 . 2]" 1
167 1 18 LEU HA 1 49 MET ME 5.120 . 5.120 3.752 3.550 3.950 . 0 0 "[ . 1 . 2]" 1
168 1 18 LEU HB2 1 19 ILE H 3.740 . 3.740 3.423 3.055 3.758 0.018 2 0 "[ . 1 . 2]" 1
169 1 18 LEU HB2 1 48 THR MG 5.500 . 5.500 4.761 4.422 4.924 . 0 0 "[ . 1 . 2]" 1
170 1 18 LEU HB3 1 19 ILE HG13 4.390 . 4.390 3.376 3.039 3.721 . 0 0 "[ . 1 . 2]" 1
171 1 18 LEU HB3 1 49 MET ME 3.880 . 3.880 2.217 1.941 2.466 . 0 0 "[ . 1 . 2]" 1
172 1 18 LEU MD1 1 45 LEU HB3 4.650 . 4.650 2.553 2.161 3.217 . 0 0 "[ . 1 . 2]" 1
173 1 18 LEU MD1 1 48 THR HB 4.750 . 4.750 3.208 2.473 3.688 . 0 0 "[ . 1 . 2]" 1
174 1 18 LEU MD1 1 49 MET H 5.050 . 5.050 4.772 4.182 5.163 0.113 11 0 "[ . 1 . 2]" 1
175 1 18 LEU MD1 1 49 MET ME . . 3.210 3.460 3.356 3.575 0.365 13 0 "[ . 1 . 2]" 1
176 1 18 LEU MD2 1 48 THR HA 4.390 . 4.390 4.291 4.035 4.447 0.057 10 0 "[ . 1 . 2]" 1
177 1 18 LEU MD2 1 48 THR MG 3.030 . 3.030 2.244 2.070 2.396 . 0 0 "[ . 1 . 2]" 1
178 1 18 LEU MD2 1 49 MET H 4.670 . 4.670 2.856 2.539 3.035 . 0 0 "[ . 1 . 2]" 1
179 1 18 LEU MD2 1 49 MET HA 3.730 . 3.730 2.891 2.568 3.226 . 0 0 "[ . 1 . 2]" 1
180 1 18 LEU MD2 1 49 MET HB2 4.710 . 4.710 4.103 3.946 4.204 . 0 0 "[ . 1 . 2]" 1
181 1 18 LEU MD2 1 49 MET HB3 4.760 . 4.760 4.005 3.781 4.214 . 0 0 "[ . 1 . 2]" 1
182 1 18 LEU MD2 1 49 MET ME 3.110 . 3.110 2.987 2.737 3.169 0.059 7 0 "[ . 1 . 2]" 1
183 1 18 LEU MD2 1 49 MET HG2 4.310 . 4.310 2.096 1.978 2.314 . 0 0 "[ . 1 . 2]" 1
184 1 18 LEU MD2 1 49 MET HG3 4.230 . 4.230 2.355 2.114 2.579 . 0 0 "[ . 1 . 2]" 1
185 1 18 LEU HG 1 45 LEU HA 5.550 . 5.550 3.841 3.358 4.297 . 0 0 "[ . 1 . 2]" 1
186 1 18 LEU HG 1 49 MET ME 4.020 . 4.020 2.142 2.035 2.374 . 0 0 "[ . 1 . 2]" 1
187 1 18 LEU HG 1 49 MET HG2 4.790 . 4.790 3.330 2.937 3.864 . 0 0 "[ . 1 . 2]" 1
188 1 19 ILE H 1 19 ILE HB 3.260 . 3.260 2.441 2.245 2.626 . 0 0 "[ . 1 . 2]" 1
189 1 19 ILE H 1 19 ILE MD 4.590 . 4.590 3.590 3.411 3.712 . 0 0 "[ . 1 . 2]" 1
190 1 19 ILE H 1 19 ILE HG12 3.800 . 3.800 3.546 3.388 3.774 . 0 0 "[ . 1 . 2]" 1
191 1 19 ILE H 1 19 ILE HG13 4.250 . 4.250 2.260 2.071 2.500 . 0 0 "[ . 1 . 2]" 1
192 1 19 ILE H 1 19 ILE MG 4.370 . 4.370 3.792 3.707 3.864 . 0 0 "[ . 1 . 2]" 1
193 1 19 ILE H 1 20 GLN H . . 4.380 2.779 2.655 2.872 . 0 0 "[ . 1 . 2]" 1
194 1 19 ILE H 1 20 GLN QB 5.620 . 5.620 4.495 4.359 5.091 . 0 0 "[ . 1 . 2]" 1
195 1 19 ILE H 1 49 MET ME 4.810 . 4.810 3.042 2.887 3.284 . 0 0 "[ . 1 . 2]" 1
196 1 19 ILE HA 1 19 ILE MD 4.330 . 4.330 3.891 3.840 3.962 . 0 0 "[ . 1 . 2]" 1
197 1 19 ILE HA 1 22 VAL H 5.050 . 5.050 3.787 3.502 4.319 . 0 0 "[ . 1 . 2]" 1
198 1 19 ILE HA 1 22 VAL HB . . 4.270 2.847 2.625 3.060 . 0 0 "[ . 1 . 2]" 1
199 1 19 ILE HA 1 22 VAL MG1 3.980 . 3.980 4.113 4.026 4.243 0.263 12 0 "[ . 1 . 2]" 1
200 1 19 ILE HA 1 22 VAL MG2 . . 4.470 3.558 3.078 4.054 . 0 0 "[ . 1 . 2]" 1
201 1 19 ILE HA 1 49 MET ME 4.090 . 4.090 2.426 2.145 2.781 . 0 0 "[ . 1 . 2]" 1
202 1 19 ILE HB 1 19 ILE MD 3.200 . 3.200 2.461 2.402 2.498 . 0 0 "[ . 1 . 2]" 1
203 1 19 ILE HB 1 20 GLN H 4.540 . 4.540 2.634 2.405 2.871 . 0 0 "[ . 1 . 2]" 1
204 1 19 ILE MD 1 19 ILE MG 2.800 . 2.800 2.010 1.963 2.091 . 0 0 "[ . 1 . 2]" 1
205 1 19 ILE MD 1 97 VAL HB . . 5.020 2.864 2.135 3.786 . 0 0 "[ . 1 . 2]" 1
206 1 19 ILE MD 1 98 THR HA . . 4.130 2.868 2.161 3.441 . 0 0 "[ . 1 . 2]" 1
207 1 19 ILE HG13 1 97 VAL HB 5.560 . 5.560 4.677 4.064 5.269 . 0 0 "[ . 1 . 2]" 1
208 1 19 ILE HG13 1 97 VAL MG1 3.740 . 3.740 3.672 3.231 3.886 0.146 15 0 "[ . 1 . 2]" 1
209 1 19 ILE MG 1 20 GLN H 4.560 . 4.560 3.274 2.954 3.535 . 0 0 "[ . 1 . 2]" 1
210 1 19 ILE MG 1 20 GLN HA 4.350 . 4.350 3.367 3.073 3.606 . 0 0 "[ . 1 . 2]" 1
211 1 19 ILE MG 1 20 GLN QB 5.650 . 5.650 4.111 3.764 4.430 . 0 0 "[ . 1 . 2]" 1
212 1 19 ILE MG 1 23 ASN HD21 . . 4.210 2.625 1.947 4.094 . 0 0 "[ . 1 . 2]" 1
213 1 19 ILE MG 1 23 ASN HD22 . . 4.270 2.597 1.739 4.309 0.039 20 0 "[ . 1 . 2]" 1
214 1 19 ILE MG 1 95 ASP HA 4.930 . 4.930 4.186 2.896 4.929 . 0 0 "[ . 1 . 2]" 1
215 1 19 ILE MG 1 98 THR H 4.630 . 4.630 4.115 3.605 4.658 0.028 10 0 "[ . 1 . 2]" 1
216 1 19 ILE MG 1 98 THR HB . . 4.850 4.227 3.906 4.858 0.008 2 0 "[ . 1 . 2]" 1
217 1 20 GLN H 1 20 GLN QB 3.630 . 3.630 2.257 2.207 2.538 . 0 0 "[ . 1 . 2]" 1
218 1 20 GLN H 1 20 GLN QG . . 4.460 3.938 2.207 4.097 . 0 0 "[ . 1 . 2]" 1
219 1 20 GLN H 1 21 ASN H 4.150 . 4.150 2.831 2.652 2.960 . 0 0 "[ . 1 . 2]" 1
220 1 20 GLN HA 1 23 ASN HB2 4.120 . 4.120 3.043 2.616 3.777 . 0 0 "[ . 1 . 2]" 1
221 1 20 GLN HA 1 23 ASN HB3 4.550 . 4.550 4.312 2.979 4.660 0.110 10 0 "[ . 1 . 2]" 1
222 1 20 GLN HA 1 23 ASN HD21 . . 4.660 3.494 2.335 4.832 0.172 14 0 "[ . 1 . 2]" 1
223 1 20 GLN HA 1 24 ASP H . . 4.780 4.302 3.896 4.824 0.044 7 0 "[ . 1 . 2]" 1
224 1 20 GLN QB 1 21 ASN H 4.170 . 4.170 2.508 2.253 3.509 . 0 0 "[ . 1 . 2]" 1
225 1 20 GLN QB 1 21 ASN HA . . 4.230 4.242 4.129 4.382 0.152 20 0 "[ . 1 . 2]" 1
226 1 20 GLN QB 1 23 ASN HB2 5.480 . 5.480 5.007 4.648 5.541 0.061 7 0 "[ . 1 . 2]" 1
227 1 20 GLN QG 1 21 ASN H . . 5.030 3.471 2.278 4.220 . 0 0 "[ . 1 . 2]" 1
228 1 20 GLN QG 1 21 ASN HA 5.630 . 5.630 3.679 3.281 4.799 . 0 0 "[ . 1 . 2]" 1
229 1 20 GLN QG 1 21 ASN HD21 5.190 . 5.190 4.353 2.635 5.303 0.113 20 0 "[ . 1 . 2]" 1
230 1 20 GLN QG 1 24 ASP HB3 5.570 . 5.570 5.142 4.609 5.708 0.138 19 0 "[ . 1 . 2]" 1
231 1 21 ASN H 1 21 ASN HB2 4.090 . 4.090 2.438 2.342 2.563 . 0 0 "[ . 1 . 2]" 1
232 1 21 ASN H 1 21 ASN HB3 4.320 . 4.320 3.431 2.583 3.652 . 0 0 "[ . 1 . 2]" 1
233 1 21 ASN H 1 22 VAL H 4.210 . 4.210 2.781 2.661 2.886 . 0 0 "[ . 1 . 2]" 1
234 1 21 ASN H 1 22 VAL MG2 5.050 . 5.050 4.391 4.209 4.560 . 0 0 "[ . 1 . 2]" 1
235 1 21 ASN HA 1 22 VAL H 5.360 . 5.360 3.583 3.516 3.608 . 0 0 "[ . 1 . 2]" 1
236 1 21 ASN HA 1 45 LEU MD1 5.220 . 5.220 4.526 4.066 5.291 0.071 14 0 "[ . 1 . 2]" 1
237 1 21 ASN HB2 1 22 VAL H 4.690 . 4.690 2.868 2.510 3.894 . 0 0 "[ . 1 . 2]" 1
238 1 21 ASN HB2 1 45 LEU MD1 . . 4.480 2.881 2.242 4.353 . 0 0 "[ . 1 . 2]" 1
239 1 21 ASN HB2 1 45 LEU MD2 5.060 . 5.060 4.141 2.612 5.105 0.045 10 0 "[ . 1 . 2]" 1
240 1 21 ASN HB3 1 22 VAL H . . 4.680 3.265 2.376 3.775 . 0 0 "[ . 1 . 2]" 1
241 1 21 ASN HB3 1 22 VAL MG2 5.010 . 5.010 3.939 3.180 4.343 . 0 0 "[ . 1 . 2]" 1
242 1 21 ASN HB3 1 45 LEU MD1 . . 4.210 2.594 2.105 3.283 . 0 0 "[ . 1 . 2]" 1
243 1 21 ASN HB3 1 45 LEU MD2 4.940 . 4.940 4.106 3.047 4.959 0.019 7 0 "[ . 1 . 2]" 1
244 1 22 VAL H 1 22 VAL HB . . 3.890 2.490 2.434 2.606 . 0 0 "[ . 1 . 2]" 1
245 1 22 VAL H 1 22 VAL MG1 4.680 . 4.680 3.816 3.791 3.843 . 0 0 "[ . 1 . 2]" 1
246 1 22 VAL H 1 22 VAL MG2 . . 3.850 2.259 2.105 2.354 . 0 0 "[ . 1 . 2]" 1
247 1 22 VAL H 1 45 LEU MD1 5.080 . 5.080 3.259 2.891 3.643 . 0 0 "[ . 1 . 2]" 1
248 1 22 VAL HA 1 22 VAL MG1 3.360 . 3.360 2.559 2.480 2.620 . 0 0 "[ . 1 . 2]" 1
249 1 22 VAL HA 1 22 VAL MG2 3.530 . 3.530 2.357 2.322 2.415 . 0 0 "[ . 1 . 2]" 1
250 1 22 VAL HA 1 25 ASP H 4.690 . 4.690 3.513 3.224 3.849 . 0 0 "[ . 1 . 2]" 1
251 1 22 VAL HA 1 25 ASP HB2 4.970 . 4.970 2.546 2.206 3.182 . 0 0 "[ . 1 . 2]" 1
252 1 22 VAL HA 1 25 ASP HB3 4.540 . 4.540 4.006 3.054 4.284 . 0 0 "[ . 1 . 2]" 1
253 1 22 VAL HA 1 42 ILE HG12 5.080 . 5.080 2.861 2.297 3.437 . 0 0 "[ . 1 . 2]" 1
254 1 22 VAL HA 1 45 LEU HB2 5.150 . 5.150 4.610 3.888 5.165 0.015 14 0 "[ . 1 . 2]" 1
255 1 22 VAL HA 1 45 LEU HB3 5.400 . 5.400 5.198 4.619 5.513 0.113 6 0 "[ . 1 . 2]" 1
256 1 22 VAL HA 1 45 LEU MD1 3.920 . 3.920 2.982 2.583 3.494 . 0 0 "[ . 1 . 2]" 1
257 1 22 VAL HB 1 45 LEU MD1 5.050 . 5.050 4.290 4.031 4.466 . 0 0 "[ . 1 . 2]" 1
258 1 22 VAL HB 1 49 MET ME 4.760 . 4.760 2.812 2.624 3.169 . 0 0 "[ . 1 . 2]" 1
259 1 22 VAL HB 1 94 LEU QD 4.970 . 4.970 2.615 2.128 3.211 . 0 0 "[ . 1 . 2]" 1
260 1 22 VAL MG1 1 22 VAL MG2 2.940 . 2.940 2.107 2.099 2.120 . 0 0 "[ . 1 . 2]" 1
261 1 22 VAL MG1 1 23 ASN H 4.170 . 4.170 3.278 2.987 3.621 . 0 0 "[ . 1 . 2]" 1
262 1 22 VAL MG1 1 23 ASN HA 4.390 . 4.390 3.392 3.100 3.686 . 0 0 "[ . 1 . 2]" 1
263 1 22 VAL MG1 1 25 ASP HB2 5.000 . 5.000 3.931 3.521 4.777 . 0 0 "[ . 1 . 2]" 1
264 1 22 VAL MG1 1 25 ASP HB3 4.840 . 4.840 4.819 3.964 5.027 0.187 3 0 "[ . 1 . 2]" 1
265 1 22 VAL MG1 1 26 ILE MD 3.240 . 3.240 2.104 1.962 2.223 . 0 0 "[ . 1 . 2]" 1
266 1 22 VAL MG1 1 26 ILE HG12 6.000 . 6.000 3.553 3.324 3.715 . 0 0 "[ . 1 . 2]" 1
267 1 22 VAL MG1 1 42 ILE MD 4.080 . 4.080 3.221 2.767 3.742 . 0 0 "[ . 1 . 2]" 1
268 1 22 VAL MG1 1 94 LEU HB2 4.760 . 4.760 3.684 3.121 4.413 . 0 0 "[ . 1 . 2]" 1
269 1 22 VAL MG1 1 94 LEU QD 2.880 . 2.880 2.213 1.774 2.695 . 0 0 "[ . 1 . 2]" 1
270 1 22 VAL MG2 1 26 ILE MD 4.430 . 4.430 4.427 4.282 4.545 0.115 19 0 "[ . 1 . 2]" 1
271 1 22 VAL MG2 1 45 LEU HB2 . . 3.980 2.210 1.948 2.410 . 0 0 "[ . 1 . 2]" 1
272 1 22 VAL MG2 1 45 LEU HB3 3.990 . 3.990 2.501 2.272 2.708 . 0 0 "[ . 1 . 2]" 1
273 1 22 VAL MG2 1 45 LEU MD1 4.040 . 4.040 2.111 1.958 2.432 . 0 0 "[ . 1 . 2]" 1
274 1 22 VAL MG2 1 45 LEU HG 5.470 . 5.470 3.769 3.625 3.980 . 0 0 "[ . 1 . 2]" 1
275 1 22 VAL MG2 1 46 VAL H 4.730 . 4.730 3.643 3.333 3.971 . 0 0 "[ . 1 . 2]" 1
276 1 22 VAL MG2 1 49 MET ME 3.870 . 3.870 1.954 1.903 2.008 . 0 0 "[ . 1 . 2]" 1
277 1 22 VAL MG2 1 94 LEU QD 3.970 . 3.970 3.089 2.705 3.666 . 0 0 "[ . 1 . 2]" 1
278 1 23 ASN H 1 23 ASN HB2 4.050 . 4.050 2.394 2.176 2.498 . 0 0 "[ . 1 . 2]" 1
279 1 23 ASN H 1 23 ASN HD21 5.420 . 5.420 3.724 2.635 4.730 . 0 0 "[ . 1 . 2]" 1
280 1 23 ASN H 1 24 ASP H 3.700 . 3.700 2.807 2.559 2.962 . 0 0 "[ . 1 . 2]" 1
281 1 23 ASN HA 1 26 ILE H 5.070 . 5.070 3.587 3.299 4.004 . 0 0 "[ . 1 . 2]" 1
282 1 23 ASN HA 1 26 ILE HB 4.110 . 4.110 2.804 2.427 3.686 . 0 0 "[ . 1 . 2]" 1
283 1 23 ASN HA 1 26 ILE MD 4.470 . 4.470 2.547 2.107 3.043 . 0 0 "[ . 1 . 2]" 1
284 1 23 ASN HA 1 26 ILE HG12 5.160 . 5.160 4.844 4.275 5.226 0.066 17 0 "[ . 1 . 2]" 1
285 1 23 ASN HA 1 26 ILE HG13 5.580 . 5.580 3.560 2.904 4.183 . 0 0 "[ . 1 . 2]" 1
286 1 23 ASN HA 1 26 ILE MG 4.750 . 4.750 4.096 3.696 4.846 0.096 14 0 "[ . 1 . 2]" 1
287 1 23 ASN HB2 1 24 ASP H 3.580 . 3.580 2.883 2.420 3.664 0.084 20 0 "[ . 1 . 2]" 1
288 1 23 ASN HB3 1 24 ASP H 3.930 . 3.930 3.302 2.435 3.767 . 0 0 "[ . 1 . 2]" 1
289 1 23 ASN HD22 1 95 ASP HA 4.750 . 4.750 4.522 3.129 4.895 0.145 2 0 "[ . 1 . 2]" 1
290 1 24 ASP H 1 25 ASP H 4.040 . 4.040 2.678 2.491 2.869 . 0 0 "[ . 1 . 2]" 1
291 1 24 ASP HA 1 25 ASP H 4.170 . 4.170 3.555 3.477 3.605 . 0 0 "[ . 1 . 2]" 1
292 1 24 ASP HA 1 27 LYS H 5.020 . 5.020 3.453 3.024 3.631 . 0 0 "[ . 1 . 2]" 1
293 1 24 ASP HA 1 27 LYS HB2 4.030 . 4.030 2.874 2.216 3.273 . 0 0 "[ . 1 . 2]" 1
294 1 24 ASP HA 1 27 LYS HB3 5.160 . 5.160 4.267 2.752 4.726 . 0 0 "[ . 1 . 2]" 1
295 1 24 ASP HA 1 27 LYS HG2 5.140 . 5.140 4.427 4.018 5.004 . 0 0 "[ . 1 . 2]" 1
296 1 24 ASP HA 1 27 LYS HG3 5.350 . 5.350 3.193 2.624 4.866 . 0 0 "[ . 1 . 2]" 1
297 1 24 ASP HB2 1 25 ASP H 4.350 . 4.350 3.456 2.686 3.962 . 0 0 "[ . 1 . 2]" 1
298 1 24 ASP HB3 1 25 ASP H 4.830 . 4.830 3.023 2.529 3.779 . 0 0 "[ . 1 . 2]" 1
299 1 24 ASP HB3 1 25 ASP HB2 5.500 . 5.500 5.142 4.500 5.734 0.234 1 0 "[ . 1 . 2]" 1
300 1 25 ASP H 1 25 ASP HB3 4.120 . 4.120 3.549 2.878 3.632 . 0 0 "[ . 1 . 2]" 1
301 1 25 ASP H 1 26 ILE H 4.270 . 4.270 2.719 2.586 2.845 . 0 0 "[ . 1 . 2]" 1
302 1 25 ASP HA 1 26 ILE H 5.470 . 5.470 3.566 3.536 3.609 . 0 0 "[ . 1 . 2]" 1
303 1 25 ASP HA 1 28 GLU H 5.040 . 5.040 3.463 3.162 3.912 . 0 0 "[ . 1 . 2]" 1
304 1 25 ASP HA 1 28 GLU QB 5.110 . 5.110 2.890 2.333 3.648 . 0 0 "[ . 1 . 2]" 1
305 1 25 ASP HA 1 28 GLU HG3 5.270 . 5.270 3.646 2.638 5.163 . 0 0 "[ . 1 . 2]" 1
306 1 25 ASP HA 1 29 VAL MG2 4.850 . 4.850 4.249 3.982 4.520 . 0 0 "[ . 1 . 2]" 1
307 1 25 ASP HB2 1 26 ILE H 5.180 . 5.180 2.841 2.599 3.586 . 0 0 "[ . 1 . 2]" 1
308 1 25 ASP HB2 1 42 ILE MD . . 4.640 3.035 2.557 3.644 . 0 0 "[ . 1 . 2]" 1
309 1 25 ASP HB2 1 42 ILE HG12 4.900 . 4.900 2.761 2.368 3.899 . 0 0 "[ . 1 . 2]" 1
310 1 25 ASP HB3 1 26 ILE H 5.010 . 5.010 3.483 2.679 3.724 . 0 0 "[ . 1 . 2]" 1
311 1 25 ASP HB3 1 29 VAL MG2 5.120 . 5.120 3.736 3.434 4.141 . 0 0 "[ . 1 . 2]" 1
312 1 25 ASP HB3 1 42 ILE MD 4.740 . 4.740 2.434 1.830 2.980 . 0 0 "[ . 1 . 2]" 1
313 1 25 ASP HB3 1 42 ILE HG12 5.020 . 5.020 3.024 2.247 3.400 . 0 0 "[ . 1 . 2]" 1
314 1 25 ASP HB3 1 42 ILE HG13 5.500 . 5.500 2.572 2.168 3.207 . 0 0 "[ . 1 . 2]" 1
315 1 25 ASP HB3 1 45 LEU MD1 5.070 . 5.070 4.781 4.170 5.174 0.104 17 0 "[ . 1 . 2]" 1
316 1 26 ILE H 1 26 ILE HB 4.000 . 4.000 2.525 2.342 2.691 . 0 0 "[ . 1 . 2]" 1
317 1 26 ILE H 1 26 ILE MD 4.940 . 4.940 3.667 3.451 3.807 . 0 0 "[ . 1 . 2]" 1
318 1 26 ILE H 1 26 ILE HG12 . . 4.520 3.589 3.395 3.781 . 0 0 "[ . 1 . 2]" 1
319 1 26 ILE H 1 26 ILE HG13 4.710 . 4.710 2.322 2.043 2.585 . 0 0 "[ . 1 . 2]" 1
320 1 26 ILE H 1 27 LYS H 4.600 . 4.600 2.704 2.630 2.809 . 0 0 "[ . 1 . 2]" 1
321 1 26 ILE H 1 29 VAL MG2 5.390 . 5.390 4.123 3.927 4.300 . 0 0 "[ . 1 . 2]" 1
322 1 26 ILE H 1 42 ILE MD 5.170 . 5.170 3.093 2.820 3.339 . 0 0 "[ . 1 . 2]" 1
323 1 26 ILE HA 1 26 ILE MD 4.080 . 4.080 3.904 3.833 3.974 . 0 0 "[ . 1 . 2]" 1
324 1 26 ILE HA 1 26 ILE HG13 . . 4.390 2.988 2.826 3.131 . 0 0 "[ . 1 . 2]" 1
325 1 26 ILE HA 1 29 VAL H 4.870 . 4.870 3.108 2.983 3.358 . 0 0 "[ . 1 . 2]" 1
326 1 26 ILE HA 1 29 VAL HB 4.790 . 4.790 2.672 2.201 3.047 . 0 0 "[ . 1 . 2]" 1
327 1 26 ILE HA 1 29 VAL MG1 4.180 . 4.180 4.040 3.673 4.250 0.070 13 0 "[ . 1 . 2]" 1
328 1 26 ILE HA 1 29 VAL MG2 . . 3.640 2.338 2.208 2.455 . 0 0 "[ . 1 . 2]" 1
329 1 26 ILE HA 1 30 GLU H 5.490 . 5.490 4.256 4.026 4.749 . 0 0 "[ . 1 . 2]" 1
330 1 26 ILE HA 1 42 ILE MD 4.330 . 4.330 2.567 2.094 2.861 . 0 0 "[ . 1 . 2]" 1
331 1 26 ILE HB 1 27 LYS H 4.770 . 4.770 2.820 2.615 2.928 . 0 0 "[ . 1 . 2]" 1
332 1 26 ILE HB 1 29 VAL MG2 4.890 . 4.890 4.922 4.818 4.982 0.092 17 0 "[ . 1 . 2]" 1
333 1 26 ILE MD 1 29 VAL MG2 5.370 . 5.370 4.930 4.767 5.101 . 0 0 "[ . 1 . 2]" 1
334 1 26 ILE MD 1 39 TRP HH2 4.530 . 4.530 4.023 3.671 4.434 . 0 0 "[ . 1 . 2]" 1
335 1 26 ILE MD 1 42 ILE MD 3.710 . 3.710 3.265 2.977 3.460 . 0 0 "[ . 1 . 2]" 1
336 1 26 ILE MD 1 90 VAL HB 5.100 . 5.100 2.883 2.329 3.074 . 0 0 "[ . 1 . 2]" 1
337 1 26 ILE MD 1 90 VAL MG1 3.830 . 3.830 2.134 1.943 2.399 . 0 0 "[ . 1 . 2]" 1
338 1 26 ILE MD 1 90 VAL MG2 4.080 . 4.080 4.030 3.731 4.153 0.073 1 0 "[ . 1 . 2]" 1
339 1 26 ILE MD 1 91 LYS H 5.230 . 5.230 3.343 2.960 3.745 . 0 0 "[ . 1 . 2]" 1
340 1 26 ILE MD 1 91 LYS HA 4.930 . 4.930 2.504 2.071 2.976 . 0 0 "[ . 1 . 2]" 1
341 1 26 ILE MD 1 91 LYS QD 4.280 . 4.280 3.704 2.292 4.482 0.202 1 0 "[ . 1 . 2]" 1
342 1 26 ILE MD 1 91 LYS QG 5.270 . 5.270 2.587 2.184 3.005 . 0 0 "[ . 1 . 2]" 1
343 1 26 ILE HG12 1 42 ILE MD 4.480 . 4.480 2.191 1.936 2.510 . 0 0 "[ . 1 . 2]" 1
344 1 26 ILE HG12 1 90 VAL MG1 5.420 . 5.420 3.166 2.742 3.544 . 0 0 "[ . 1 . 2]" 1
345 1 26 ILE HG13 1 29 VAL MG2 4.420 . 4.420 4.403 4.218 4.563 0.143 2 0 "[ . 1 . 2]" 1
346 1 26 ILE MG 1 27 LYS H . . 4.800 3.483 3.102 3.756 . 0 0 "[ . 1 . 2]" 1
347 1 26 ILE MG 1 27 LYS HA 4.770 . 4.770 3.597 2.967 3.909 . 0 0 "[ . 1 . 2]" 1
348 1 26 ILE MG 1 27 LYS HG3 4.340 . 4.340 4.257 3.632 4.606 0.266 4 0 "[ . 1 . 2]" 1
349 1 26 ILE MG 1 29 VAL MG2 4.100 . 4.100 3.787 3.518 4.090 . 0 0 "[ . 1 . 2]" 1
350 1 26 ILE MG 1 30 GLU H 5.740 . 5.740 3.919 3.587 4.500 . 0 0 "[ . 1 . 2]" 1
351 1 26 ILE MG 1 30 GLU HA 6.000 . 6.000 4.909 4.316 5.500 . 0 0 "[ . 1 . 2]" 1
352 1 26 ILE MG 1 30 GLU HG2 4.290 . 4.290 3.511 2.923 4.055 . 0 0 "[ . 1 . 2]" 1
353 1 26 ILE MG 1 30 GLU HG3 5.240 . 5.240 2.666 2.039 3.596 . 0 0 "[ . 1 . 2]" 1
354 1 26 ILE MG 1 39 TRP HZ2 5.330 . 5.330 4.334 3.601 5.094 . 0 0 "[ . 1 . 2]" 1
355 1 26 ILE MG 1 87 ILE QG 6.000 . 6.000 4.436 3.981 4.819 . 0 0 "[ . 1 . 2]" 1
356 1 26 ILE MG 1 91 LYS HA 4.970 . 4.970 3.477 2.842 3.965 . 0 0 "[ . 1 . 2]" 1
357 1 26 ILE MG 1 91 LYS QD 6.000 . 6.000 3.105 2.132 4.035 . 0 0 "[ . 1 . 2]" 1
358 1 26 ILE MG 1 91 LYS QG 4.620 . 4.620 1.911 1.653 2.297 . 0 0 "[ . 1 . 2]" 1
359 1 27 LYS H 1 27 LYS HB2 . . 3.870 2.497 2.303 2.638 . 0 0 "[ . 1 . 2]" 1
360 1 27 LYS H 1 27 LYS HG2 4.180 . 4.180 3.622 3.363 4.465 0.285 4 0 "[ . 1 . 2]" 1
361 1 27 LYS H 1 27 LYS HG3 4.870 . 4.870 2.405 2.086 4.273 . 0 0 "[ . 1 . 2]" 1
362 1 27 LYS H 1 28 GLU H 4.510 . 4.510 2.725 2.618 2.852 . 0 0 "[ . 1 . 2]" 1
363 1 27 LYS HA 1 27 LYS HG2 . . 4.400 2.676 2.397 2.839 . 0 0 "[ . 1 . 2]" 1
364 1 27 LYS HA 1 27 LYS HG3 4.290 . 4.290 2.969 2.527 3.239 . 0 0 "[ . 1 . 2]" 1
365 1 27 LYS HA 1 30 GLU HG2 5.110 . 5.110 4.324 3.574 4.679 . 0 0 "[ . 1 . 2]" 1
366 1 27 LYS HB2 1 28 GLU H 4.490 . 4.490 2.732 2.509 3.783 . 0 0 "[ . 1 . 2]" 1
367 1 27 LYS HB3 1 28 GLU H 5.330 . 5.330 3.604 2.681 3.842 . 0 0 "[ . 1 . 2]" 1
368 1 28 GLU H 1 28 GLU HG2 4.440 . 4.440 2.642 2.174 4.596 0.156 14 0 "[ . 1 . 2]" 1
369 1 28 GLU H 1 28 GLU HG3 4.720 . 4.720 3.643 2.413 4.469 . 0 0 "[ . 1 . 2]" 1
370 1 28 GLU H 1 29 VAL H . . 4.150 2.627 2.530 2.716 . 0 0 "[ . 1 . 2]" 1
371 1 28 GLU H 1 29 VAL MG2 5.160 . 5.160 4.045 3.829 4.274 . 0 0 "[ . 1 . 2]" 1
372 1 28 GLU HA 1 29 VAL H 5.180 . 5.180 3.542 3.518 3.596 . 0 0 "[ . 1 . 2]" 1
373 1 28 GLU HA 1 29 VAL MG2 5.490 . 5.490 5.037 4.874 5.165 . 0 0 "[ . 1 . 2]" 1
374 1 28 GLU QB 1 29 VAL H 4.720 . 4.720 2.875 2.640 3.042 . 0 0 "[ . 1 . 2]" 1
375 1 28 GLU QB 1 29 VAL HA 5.750 . 5.750 4.164 3.918 4.431 . 0 0 "[ . 1 . 2]" 1
376 1 28 GLU QB 1 29 VAL MG2 5.670 . 5.670 3.437 3.025 3.788 . 0 0 "[ . 1 . 2]" 1
377 1 28 GLU QB 1 30 GLU H 6.000 . 6.000 4.860 4.676 5.002 . 0 0 "[ . 1 . 2]" 1
378 1 29 VAL H 1 29 VAL HB 4.320 . 4.320 2.680 2.553 2.898 . 0 0 "[ . 1 . 2]" 1
379 1 29 VAL H 1 29 VAL MG1 4.320 . 4.320 3.837 3.815 3.874 . 0 0 "[ . 1 . 2]" 1
380 1 29 VAL H 1 29 VAL MG2 . . 3.920 2.187 2.039 2.334 . 0 0 "[ . 1 . 2]" 1
381 1 29 VAL H 1 30 GLU H 4.150 . 4.150 2.602 2.511 2.693 . 0 0 "[ . 1 . 2]" 1
382 1 29 VAL H 1 42 ILE MD 4.490 . 4.490 4.390 4.055 4.642 0.152 8 0 "[ . 1 . 2]" 1
383 1 29 VAL HA 1 29 VAL MG2 3.690 . 3.690 2.527 2.435 2.651 . 0 0 "[ . 1 . 2]" 1
384 1 29 VAL HA 1 30 GLU H 4.150 . 4.150 3.558 3.527 3.593 . 0 0 "[ . 1 . 2]" 1
385 1 29 VAL HA 1 31 LYS H 5.160 . 5.160 3.983 3.775 4.199 . 0 0 "[ . 1 . 2]" 1
386 1 29 VAL HA 1 32 ASN H . . 4.200 2.875 2.646 3.272 . 0 0 "[ . 1 . 2]" 1
387 1 29 VAL HA 1 33 PRO HA 3.860 . 3.860 3.584 3.121 3.887 0.027 14 0 "[ . 1 . 2]" 1
388 1 29 VAL HB 1 30 GLU HG2 5.400 . 5.400 4.759 4.509 5.118 . 0 0 "[ . 1 . 2]" 1
389 1 29 VAL HB 1 33 PRO HA 4.650 . 4.650 4.445 4.242 4.619 . 0 0 "[ . 1 . 2]" 1
390 1 29 VAL HB 1 39 TRP HZ2 5.290 . 5.290 3.809 3.216 4.322 . 0 0 "[ . 1 . 2]" 1
391 1 29 VAL HB 1 87 ILE MD 6.000 . 6.000 3.294 2.815 3.668 . 0 0 "[ . 1 . 2]" 1
392 1 29 VAL HB 1 87 ILE MG 4.420 . 4.420 2.690 2.256 3.024 . 0 0 "[ . 1 . 2]" 1
393 1 29 VAL MG1 1 30 GLU H 5.010 . 5.010 3.750 3.402 4.013 . 0 0 "[ . 1 . 2]" 1
394 1 29 VAL MG1 1 30 GLU HA 5.180 . 5.180 3.801 3.356 4.141 . 0 0 "[ . 1 . 2]" 1
395 1 29 VAL MG1 1 30 GLU HG3 5.610 . 5.610 4.630 4.134 5.073 . 0 0 "[ . 1 . 2]" 1
396 1 29 VAL MG1 1 33 PRO HA 4.860 . 4.860 1.956 1.782 2.120 . 0 0 "[ . 1 . 2]" 1
397 1 29 VAL MG1 1 34 GLU H 5.550 . 5.550 4.396 3.163 4.800 . 0 0 "[ . 1 . 2]" 1
398 1 29 VAL MG1 1 35 ASP H 5.100 . 5.100 3.787 3.018 4.756 . 0 0 "[ . 1 . 2]" 1
399 1 29 VAL MG1 1 35 ASP HB2 5.370 . 5.370 4.432 3.502 5.199 . 0 0 "[ . 1 . 2]" 1
400 1 29 VAL MG1 1 36 MET ME 5.410 . 5.410 4.397 3.963 4.729 . 0 0 "[ . 1 . 2]" 1
401 1 29 VAL MG1 1 38 TYR HB3 4.290 . 4.290 4.411 4.175 4.571 0.281 10 0 "[ . 1 . 2]" 1
402 1 29 VAL MG1 1 39 TRP H 5.300 . 5.300 4.901 4.532 5.252 . 0 0 "[ . 1 . 2]" 1
403 1 29 VAL MG1 1 39 TRP HE1 4.810 . 4.810 2.109 1.873 2.213 . 0 0 "[ . 1 . 2]" 1
404 1 29 VAL MG1 1 39 TRP HH2 5.530 . 5.530 3.875 3.743 4.259 . 0 0 "[ . 1 . 2]" 1
405 1 29 VAL MG1 1 39 TRP HZ2 4.540 . 4.540 2.149 1.900 2.522 . 0 0 "[ . 1 . 2]" 1
406 1 29 VAL MG1 1 75 MET ME 5.240 . 5.240 3.993 3.849 4.158 . 0 0 "[ . 1 . 2]" 1
407 1 29 VAL MG1 1 82 ILE MG 4.660 . 4.660 2.857 2.433 3.503 . 0 0 "[ . 1 . 2]" 1
408 1 29 VAL MG1 1 87 ILE MD 4.020 . 4.020 1.940 1.740 2.432 . 0 0 "[ . 1 . 2]" 1
409 1 29 VAL MG2 1 30 GLU H 4.500 . 4.500 3.937 3.798 4.035 . 0 0 "[ . 1 . 2]" 1
410 1 29 VAL MG2 1 32 ASN H 5.290 . 5.290 4.910 4.693 5.214 . 0 0 "[ . 1 . 2]" 1
411 1 29 VAL MG2 1 35 ASP HB2 5.150 . 5.150 4.456 3.405 5.056 . 0 0 "[ . 1 . 2]" 1
412 1 29 VAL MG2 1 36 MET ME 5.400 . 5.400 5.097 4.719 5.430 0.030 14 0 "[ . 1 . 2]" 1
413 1 29 VAL MG2 1 38 TYR H 5.410 . 5.410 4.562 4.269 5.119 . 0 0 "[ . 1 . 2]" 1
414 1 29 VAL MG2 1 38 TYR HB2 4.830 . 4.830 2.738 2.313 4.072 . 0 0 "[ . 1 . 2]" 1
415 1 29 VAL MG2 1 38 TYR HB3 4.450 . 4.450 2.274 2.134 2.643 . 0 0 "[ . 1 . 2]" 1
416 1 29 VAL MG2 1 38 TYR QD 4.790 . 4.790 3.177 1.890 3.817 . 0 0 "[ . 1 . 2]" 1
417 1 29 VAL MG2 1 39 TRP HA 4.290 . 4.290 3.818 3.214 4.213 . 0 0 "[ . 1 . 2]" 1
418 1 29 VAL MG2 1 39 TRP HD1 5.350 . 5.350 4.098 3.673 4.464 . 0 0 "[ . 1 . 2]" 1
419 1 29 VAL MG2 1 39 TRP HE1 . . 4.830 3.628 3.299 3.870 . 0 0 "[ . 1 . 2]" 1
420 1 29 VAL MG2 1 39 TRP HH2 4.880 . 4.880 4.215 3.895 4.663 . 0 0 "[ . 1 . 2]" 1
421 1 29 VAL MG2 1 39 TRP HZ2 4.540 . 4.540 3.650 3.303 4.085 . 0 0 "[ . 1 . 2]" 1
422 1 29 VAL MG2 1 75 MET ME 4.920 . 4.920 5.089 4.931 5.245 0.325 15 0 "[ . 1 . 2]" 1
423 1 29 VAL MG2 1 87 ILE MG 4.390 . 4.390 3.665 3.363 3.999 . 0 0 "[ . 1 . 2]" 1
424 1 30 GLU H 1 30 GLU HB2 3.890 . 3.890 2.522 2.413 2.676 . 0 0 "[ . 1 . 2]" 1
425 1 30 GLU H 1 30 GLU HG2 4.260 . 4.260 3.473 3.143 3.797 . 0 0 "[ . 1 . 2]" 1
426 1 30 GLU H 1 30 GLU HG3 4.530 . 4.530 2.299 2.098 2.557 . 0 0 "[ . 1 . 2]" 1
427 1 30 GLU H 1 31 LYS H 4.270 . 4.270 2.661 2.541 2.786 . 0 0 "[ . 1 . 2]" 1
428 1 30 GLU H 1 32 ASN H 5.440 . 5.440 4.014 3.811 4.356 . 0 0 "[ . 1 . 2]" 1
429 1 30 GLU H 1 87 ILE MG 4.890 . 4.890 3.501 2.959 4.107 . 0 0 "[ . 1 . 2]" 1
430 1 30 GLU HA 1 30 GLU HG3 4.170 . 4.170 3.084 2.917 3.298 . 0 0 "[ . 1 . 2]" 1
431 1 30 GLU HA 1 31 LYS H 4.900 . 4.900 3.490 3.435 3.531 . 0 0 "[ . 1 . 2]" 1
432 1 30 GLU HA 1 33 PRO HB3 . . 5.110 4.678 4.294 5.171 0.061 1 0 "[ . 1 . 2]" 1
433 1 30 GLU HA 1 87 ILE MD 4.110 . 4.110 2.716 2.238 3.205 . 0 0 "[ . 1 . 2]" 1
434 1 30 GLU HA 1 87 ILE MG 3.990 . 3.990 3.167 2.669 3.779 . 0 0 "[ . 1 . 2]" 1
435 1 30 GLU HB2 1 30 GLU HG2 3.040 . 3.040 3.042 3.032 3.055 0.015 20 0 "[ . 1 . 2]" 1
436 1 30 GLU HB2 1 31 LYS H 4.930 . 4.930 2.958 2.628 3.184 . 0 0 "[ . 1 . 2]" 1
437 1 30 GLU HB2 1 31 LYS QG 5.320 . 5.320 4.764 3.261 5.730 0.410 20 0 "[ . 1 . 2]" 1
438 1 30 GLU HB3 1 31 LYS H 5.200 . 5.200 3.894 3.756 3.974 . 0 0 "[ . 1 . 2]" 1
439 1 30 GLU HG2 1 87 ILE MD 5.360 . 5.360 3.559 2.950 4.104 . 0 0 "[ . 1 . 2]" 1
440 1 30 GLU HG2 1 87 ILE MG . . 4.310 2.577 2.171 3.238 . 0 0 "[ . 1 . 2]" 1
441 1 30 GLU HG3 1 87 ILE MG 3.220 . 3.220 2.736 2.402 3.230 0.010 11 0 "[ . 1 . 2]" 1
442 1 30 GLU HG3 1 91 LYS QG 5.450 . 5.450 4.690 4.082 5.529 0.079 3 0 "[ . 1 . 2]" 1
443 1 31 LYS H 1 31 LYS HB2 4.060 . 4.060 2.950 2.283 3.711 . 0 0 "[ . 1 . 2]" 1
444 1 31 LYS H 1 31 LYS QG 4.480 . 4.480 2.882 1.970 4.016 . 0 0 "[ . 1 . 2]" 1
445 1 31 LYS H 1 32 ASN H . . 4.060 2.399 2.268 2.574 . 0 0 "[ . 1 . 2]" 1
446 1 31 LYS HA 1 32 ASN H 5.280 . 5.280 3.553 3.447 3.605 . 0 0 "[ . 1 . 2]" 1
447 1 31 LYS HB2 1 32 ASN H 5.190 . 5.190 3.612 2.428 4.201 . 0 0 "[ . 1 . 2]" 1
448 1 31 LYS HB3 1 32 ASN H 4.510 . 4.510 3.412 2.333 4.324 . 0 0 "[ . 1 . 2]" 1
449 1 31 LYS QG 1 32 ASN HA 5.350 . 5.350 4.609 3.931 5.865 0.515 3 1 "[ + . 1 . 2]" 1
450 1 32 ASN H 1 32 ASN HB2 . . 4.360 2.752 2.577 3.224 . 0 0 "[ . 1 . 2]" 1
451 1 32 ASN H 1 32 ASN HB3 . . 4.400 3.730 2.898 3.904 . 0 0 "[ . 1 . 2]" 1
452 1 32 ASN H 1 33 PRO HD3 4.960 . 4.960 3.712 3.340 4.154 . 0 0 "[ . 1 . 2]" 1
453 1 32 ASN HA 1 32 ASN HD21 4.890 . 4.890 3.809 2.466 4.550 . 0 0 "[ . 1 . 2]" 1
454 1 32 ASN HA 1 33 PRO HD2 3.730 . 3.730 2.358 2.092 3.042 . 0 0 "[ . 1 . 2]" 1
455 1 32 ASN HA 1 33 PRO HD3 3.750 . 3.750 2.620 2.077 2.964 . 0 0 "[ . 1 . 2]" 1
456 1 32 ASN HA 1 33 PRO QG 5.310 . 5.310 4.023 3.911 4.180 . 0 0 "[ . 1 . 2]" 1
457 1 32 ASN HA 1 34 GLU H 5.090 . 5.090 4.050 3.482 4.338 . 0 0 "[ . 1 . 2]" 1
458 1 32 ASN HB2 1 35 ASP HB2 4.710 . 4.710 3.277 2.113 4.266 . 0 0 "[ . 1 . 2]" 1
459 1 32 ASN HB2 1 35 ASP HB3 5.990 . 5.990 4.416 3.324 5.671 . 0 0 "[ . 1 . 2]" 1
460 1 32 ASN HB3 1 35 ASP HB2 6.000 . 6.000 2.865 2.085 4.535 . 0 0 "[ . 1 . 2]" 1
461 1 33 PRO HA 1 39 TRP HE1 5.230 . 5.230 3.642 3.232 4.083 . 0 0 "[ . 1 . 2]" 1
462 1 33 PRO HA 1 82 ILE MG 4.560 . 4.560 3.090 2.759 3.431 . 0 0 "[ . 1 . 2]" 1
463 1 33 PRO HA 1 87 ILE MD 4.560 . 4.560 2.584 2.169 3.231 . 0 0 "[ . 1 . 2]" 1
464 1 33 PRO HB2 1 34 GLU H 4.700 . 4.700 3.253 2.433 4.370 . 0 0 "[ . 1 . 2]" 1
465 1 33 PRO HB2 1 82 ILE MD 5.430 . 5.430 4.175 3.237 5.166 . 0 0 "[ . 1 . 2]" 1
466 1 33 PRO HB2 1 82 ILE MG 3.510 . 3.510 2.937 2.546 3.578 0.068 1 0 "[ . 1 . 2]" 1
467 1 33 PRO HB3 1 82 ILE HB 5.880 . 5.880 3.939 3.166 4.807 . 0 0 "[ . 1 . 2]" 1
468 1 33 PRO HB3 1 82 ILE MG 4.050 . 4.050 3.009 2.453 3.569 . 0 0 "[ . 1 . 2]" 1
469 1 33 PRO HB3 1 87 ILE MD 4.160 . 4.160 2.186 1.931 2.445 . 0 0 "[ . 1 . 2]" 1
470 1 33 PRO HD2 1 34 GLU H 5.120 . 5.120 3.028 2.512 3.837 . 0 0 "[ . 1 . 2]" 1
471 1 33 PRO QG 1 34 GLU H 5.000 . 5.000 2.914 2.167 4.779 . 0 0 "[ . 1 . 2]" 1
472 1 33 PRO QG 1 82 ILE MG 4.340 . 4.340 4.221 3.973 4.408 0.068 2 0 "[ . 1 . 2]" 1
473 1 34 GLU H 1 34 GLU HB2 4.400 . 4.400 2.512 2.171 2.757 . 0 0 "[ . 1 . 2]" 1
474 1 34 GLU H 1 34 GLU HB3 . . 4.040 3.548 2.650 3.847 . 0 0 "[ . 1 . 2]" 1
475 1 34 GLU H 1 34 GLU HG2 4.400 . 4.400 3.601 2.243 4.495 0.095 18 0 "[ . 1 . 2]" 1
476 1 34 GLU H 1 82 ILE MD 6.000 . 6.000 4.415 3.817 5.196 . 0 0 "[ . 1 . 2]" 1
477 1 34 GLU HA 1 34 GLU HG2 4.230 . 4.230 2.690 2.454 3.263 . 0 0 "[ . 1 . 2]" 1
478 1 34 GLU HA 1 34 GLU HG3 4.330 . 4.330 3.258 2.666 3.857 . 0 0 "[ . 1 . 2]" 1
479 1 34 GLU HA 1 35 ASP H 4.720 . 4.720 3.265 2.629 3.502 . 0 0 "[ . 1 . 2]" 1
480 1 34 GLU HA 1 36 MET ME 4.410 . 4.410 2.711 2.223 3.613 . 0 0 "[ . 1 . 2]" 1
481 1 34 GLU HA 1 36 MET HG2 4.220 . 4.220 4.226 3.735 4.388 0.168 20 0 "[ . 1 . 2]" 1
482 1 34 GLU HA 1 39 TRP HE1 4.730 . 4.730 4.493 3.852 4.919 0.189 13 0 "[ . 1 . 2]" 1
483 1 34 GLU HA 1 82 ILE HB 4.710 . 4.710 3.569 2.823 4.445 . 0 0 "[ . 1 . 2]" 1
484 1 34 GLU HA 1 82 ILE MD 4.370 . 4.370 2.170 1.799 2.836 . 0 0 "[ . 1 . 2]" 1
485 1 34 GLU HA 1 82 ILE HG13 5.290 . 5.290 4.568 3.792 5.330 0.040 16 0 "[ . 1 . 2]" 1
486 1 34 GLU HA 1 82 ILE MG 5.260 . 5.260 4.093 3.089 4.835 . 0 0 "[ . 1 . 2]" 1
487 1 34 GLU HB3 1 35 ASP H 5.130 . 5.130 4.262 3.345 4.517 . 0 0 "[ . 1 . 2]" 1
488 1 34 GLU HG2 1 36 MET ME 4.930 . 4.930 4.539 2.861 5.160 0.230 13 0 "[ . 1 . 2]" 1
489 1 34 GLU HG2 1 82 ILE HB 4.740 . 4.740 3.729 1.964 4.921 0.181 18 0 "[ . 1 . 2]" 1
490 1 34 GLU HG2 1 82 ILE MD . . 4.340 2.839 2.023 4.163 . 0 0 "[ . 1 . 2]" 1
491 1 34 GLU HG3 1 82 ILE MD 5.390 . 5.390 3.757 2.211 4.941 . 0 0 "[ . 1 . 2]" 1
492 1 35 ASP H 1 35 ASP HB2 4.040 . 4.040 2.435 2.285 2.928 . 0 0 "[ . 1 . 2]" 1
493 1 35 ASP H 1 35 ASP HB3 3.910 . 3.910 3.235 2.719 3.630 . 0 0 "[ . 1 . 2]" 1
494 1 35 ASP H 1 36 MET ME 5.310 . 5.310 4.183 3.691 5.105 . 0 0 "[ . 1 . 2]" 1
495 1 35 ASP HA 1 36 MET H 3.660 . 3.660 2.170 2.094 2.303 . 0 0 "[ . 1 . 2]" 1
496 1 35 ASP HA 1 36 MET HG2 5.030 . 5.030 4.041 3.712 4.663 . 0 0 "[ . 1 . 2]" 1
497 1 35 ASP HA 1 37 GLU H . . 4.480 3.638 3.317 3.857 . 0 0 "[ . 1 . 2]" 1
498 1 35 ASP HA 1 38 TYR H 5.390 . 5.390 4.601 4.161 5.198 . 0 0 "[ . 1 . 2]" 1
499 1 35 ASP HB2 1 38 TYR H 5.610 . 5.610 4.436 3.615 4.883 . 0 0 "[ . 1 . 2]" 1
500 1 35 ASP HB3 1 36 MET H 5.250 . 5.250 4.139 3.841 4.462 . 0 0 "[ . 1 . 2]" 1
501 1 36 MET H 1 36 MET ME 5.100 . 5.100 3.491 3.134 4.423 . 0 0 "[ . 1 . 2]" 1
502 1 36 MET H 1 36 MET HG2 . . 4.500 2.333 2.086 2.934 . 0 0 "[ . 1 . 2]" 1
503 1 36 MET H 1 36 MET HG3 4.110 . 4.110 3.598 3.360 4.030 . 0 0 "[ . 1 . 2]" 1
504 1 36 MET H 1 39 TRP H 5.430 . 5.430 4.952 4.676 5.263 . 0 0 "[ . 1 . 2]" 1
505 1 36 MET HA 1 36 MET ME 4.390 . 4.390 2.077 1.722 3.402 . 0 0 "[ . 1 . 2]" 1
506 1 36 MET HA 1 36 MET HG2 4.130 . 4.130 2.979 2.722 3.103 . 0 0 "[ . 1 . 2]" 1
507 1 36 MET HA 1 36 MET HG3 . . 4.360 3.802 3.615 3.927 . 0 0 "[ . 1 . 2]" 1
508 1 36 MET HA 1 39 TRP H 4.040 . 4.040 3.142 2.668 3.367 . 0 0 "[ . 1 . 2]" 1
509 1 36 MET HA 1 39 TRP QB 4.540 . 4.540 2.324 1.926 2.558 . 0 0 "[ . 1 . 2]" 1
510 1 36 MET HA 1 39 TRP HD1 4.050 . 4.050 2.723 2.139 3.136 . 0 0 "[ . 1 . 2]" 1
511 1 36 MET HA 1 40 ASN H 5.180 . 5.180 4.104 3.438 4.368 . 0 0 "[ . 1 . 2]" 1
512 1 36 MET HA 1 82 ILE MD 5.400 . 5.400 4.959 4.280 5.592 0.192 8 0 "[ . 1 . 2]" 1
513 1 36 MET HB2 1 76 LEU HA 4.660 . 4.660 4.803 4.726 4.904 0.244 13 0 "[ . 1 . 2]" 1
514 1 36 MET HB3 1 37 GLU H 3.730 . 3.730 3.906 3.816 4.029 0.299 17 0 "[ . 1 . 2]" 1
515 1 36 MET ME 1 39 TRP QB 4.580 . 4.580 2.775 2.202 3.572 . 0 0 "[ . 1 . 2]" 1
516 1 36 MET ME 1 39 TRP HD1 4.380 . 4.380 1.992 1.696 2.590 . 0 0 "[ . 1 . 2]" 1
517 1 36 MET ME 1 39 TRP HE1 5.400 . 5.400 3.482 3.146 3.704 . 0 0 "[ . 1 . 2]" 1
518 1 36 MET ME 1 72 VAL MG1 4.280 . 4.280 4.279 3.511 4.539 0.259 8 0 "[ . 1 . 2]" 1
519 1 36 MET ME 1 75 MET ME 4.750 . 4.750 4.246 2.583 4.883 0.133 3 0 "[ . 1 . 2]" 1
520 1 36 MET ME 1 76 LEU HA 4.110 . 4.110 3.160 2.449 3.906 . 0 0 "[ . 1 . 2]" 1
521 1 36 MET ME 1 76 LEU QD 3.700 . 3.700 3.315 2.568 3.869 0.169 8 0 "[ . 1 . 2]" 1
522 1 36 MET ME 1 82 ILE HB 4.220 . 4.220 4.296 4.046 4.552 0.332 3 0 "[ . 1 . 2]" 1
523 1 36 MET ME 1 82 ILE MD . . 3.610 2.025 1.582 2.236 . 0 0 "[ . 1 . 2]" 1
524 1 36 MET ME 1 82 ILE HG12 4.110 . 4.110 2.513 2.106 3.925 . 0 0 "[ . 1 . 2]" 1
525 1 36 MET ME 1 82 ILE MG 4.690 . 4.690 3.836 3.387 4.851 0.161 9 0 "[ . 1 . 2]" 1
526 1 36 MET HG2 1 76 LEU QD 5.660 . 5.660 4.294 3.551 5.257 . 0 0 "[ . 1 . 2]" 1
527 1 36 MET HG3 1 76 LEU HA 6.000 . 6.000 3.537 2.519 4.263 . 0 0 "[ . 1 . 2]" 1
528 1 37 GLU H 1 37 GLU HB2 3.980 . 3.980 2.533 2.283 3.618 . 0 0 "[ . 1 . 2]" 1
529 1 37 GLU H 1 37 GLU HB3 . . 4.070 2.987 2.508 3.664 . 0 0 "[ . 1 . 2]" 1
530 1 37 GLU H 1 37 GLU HG2 4.800 . 4.800 4.145 2.160 4.688 . 0 0 "[ . 1 . 2]" 1
531 1 37 GLU H 1 37 GLU HG3 4.820 . 4.820 4.069 2.450 4.542 . 0 0 "[ . 1 . 2]" 1
532 1 37 GLU H 1 38 TYR H 3.970 . 3.970 2.797 2.606 2.960 . 0 0 "[ . 1 . 2]" 1
533 1 37 GLU H 1 39 TRP H 5.490 . 5.490 4.143 3.920 4.397 . 0 0 "[ . 1 . 2]" 1
534 1 37 GLU HA 1 38 TYR H . . 4.560 3.572 3.545 3.593 . 0 0 "[ . 1 . 2]" 1
535 1 37 GLU HA 1 40 ASN H 5.120 . 5.120 3.390 3.083 3.677 . 0 0 "[ . 1 . 2]" 1
536 1 37 GLU HA 1 40 ASN HB2 4.070 . 4.070 2.988 2.500 3.616 . 0 0 "[ . 1 . 2]" 1
537 1 37 GLU HA 1 40 ASN HB3 4.760 . 4.760 3.535 2.221 4.636 . 0 0 "[ . 1 . 2]" 1
538 1 37 GLU HA 1 40 ASN HD21 . . 5.210 2.934 1.716 5.000 . 0 0 "[ . 1 . 2]" 1
539 1 37 GLU HB2 1 38 TYR H 4.690 . 4.690 3.428 2.594 4.004 . 0 0 "[ . 1 . 2]" 1
540 1 37 GLU HB3 1 38 TYR H 4.580 . 4.580 3.057 2.466 3.977 . 0 0 "[ . 1 . 2]" 1
541 1 37 GLU HG3 1 40 ASN HB3 6.000 . 6.000 5.361 3.901 6.115 0.115 4 0 "[ . 1 . 2]" 1
542 1 38 TYR H 1 38 TYR HB2 4.110 . 4.110 2.307 2.117 2.477 . 0 0 "[ . 1 . 2]" 1
543 1 38 TYR HA 1 39 TRP H . . 5.410 3.558 3.516 3.599 . 0 0 "[ . 1 . 2]" 1
544 1 38 TYR HA 1 41 LYS H 4.160 . 4.160 3.476 3.164 3.826 . 0 0 "[ . 1 . 2]" 1
545 1 38 TYR HA 1 41 LYS QG 4.530 . 4.530 2.874 1.991 3.939 . 0 0 "[ . 1 . 2]" 1
546 1 38 TYR HB3 1 39 TRP H 4.910 . 4.910 3.423 2.798 3.747 . 0 0 "[ . 1 . 2]" 1
547 1 39 TRP H 1 40 ASN H . . 4.290 2.702 2.638 2.763 . 0 0 "[ . 1 . 2]" 1
548 1 39 TRP HA 1 40 ASN H 4.910 . 4.910 3.541 3.512 3.579 . 0 0 "[ . 1 . 2]" 1
549 1 39 TRP HA 1 42 ILE H 4.960 . 4.960 3.267 3.091 3.534 . 0 0 "[ . 1 . 2]" 1
550 1 39 TRP HA 1 42 ILE HB 4.670 . 4.670 2.439 2.210 2.790 . 0 0 "[ . 1 . 2]" 1
551 1 39 TRP HA 1 42 ILE MD 4.260 . 4.260 2.459 1.957 2.763 . 0 0 "[ . 1 . 2]" 1
552 1 39 TRP HA 1 42 ILE MG 4.790 . 4.790 3.847 3.628 4.214 . 0 0 "[ . 1 . 2]" 1
553 1 39 TRP HA 1 43 TYR H 5.440 . 5.440 3.834 3.619 4.057 . 0 0 "[ . 1 . 2]" 1
554 1 39 TRP HA 1 72 VAL MG1 5.190 . 5.190 3.156 2.876 3.396 . 0 0 "[ . 1 . 2]" 1
555 1 39 TRP QB 1 40 ASN H 4.560 . 4.560 2.975 2.874 3.041 . 0 0 "[ . 1 . 2]" 1
556 1 39 TRP QB 1 40 ASN HA 4.520 . 4.520 4.165 4.077 4.266 . 0 0 "[ . 1 . 2]" 1
557 1 39 TRP QB 1 72 VAL MG1 . . 3.830 1.949 1.746 2.145 . 0 0 "[ . 1 . 2]" 1
558 1 39 TRP HD1 1 82 ILE MD . . 4.920 4.016 2.853 4.516 . 0 0 "[ . 1 . 2]" 1
559 1 39 TRP HE1 1 75 MET ME 5.260 . 5.260 3.603 3.064 3.842 . 0 0 "[ . 1 . 2]" 1
560 1 39 TRP HE1 1 82 ILE MD . . 4.410 4.052 2.106 4.523 0.113 16 0 "[ . 1 . 2]" 1
561 1 39 TRP HE1 1 82 ILE MG . . 4.370 2.230 1.625 3.718 . 0 0 "[ . 1 . 2]" 1
562 1 39 TRP HH2 1 42 ILE MD 4.740 . 4.740 3.774 3.603 3.924 . 0 0 "[ . 1 . 2]" 1
563 1 39 TRP HH2 1 42 ILE MG 4.490 . 4.490 4.239 3.982 4.497 0.007 6 0 "[ . 1 . 2]" 1
564 1 39 TRP HH2 1 75 MET ME 3.940 . 3.940 3.030 2.753 3.500 . 0 0 "[ . 1 . 2]" 1
565 1 39 TRP HH2 1 87 ILE HA 4.730 . 4.730 2.746 2.451 3.307 . 0 0 "[ . 1 . 2]" 1
566 1 39 TRP HH2 1 87 ILE MD 4.910 . 4.910 4.741 4.189 5.051 0.141 14 0 "[ . 1 . 2]" 1
567 1 39 TRP HH2 1 87 ILE QG 5.230 . 5.230 3.554 3.164 3.912 . 0 0 "[ . 1 . 2]" 1
568 1 39 TRP HH2 1 87 ILE MG . . 4.160 2.613 2.090 3.211 . 0 0 "[ . 1 . 2]" 1
569 1 39 TRP HH2 1 90 VAL MG1 4.750 . 4.750 2.836 2.419 3.320 . 0 0 "[ . 1 . 2]" 1
570 1 39 TRP HH2 1 90 VAL MG2 4.210 . 4.210 2.168 1.903 2.488 . 0 0 "[ . 1 . 2]" 1
571 1 39 TRP HZ2 1 75 MET ME . . 4.210 2.642 2.430 2.908 . 0 0 "[ . 1 . 2]" 1
572 1 39 TRP HZ2 1 82 ILE MG 4.120 . 4.120 2.948 2.544 3.838 . 0 0 "[ . 1 . 2]" 1
573 1 39 TRP HZ2 1 87 ILE MD 4.140 . 4.140 3.181 2.689 3.546 . 0 0 "[ . 1 . 2]" 1
574 1 39 TRP HZ2 1 87 ILE QG . . 4.650 1.906 1.559 2.380 . 0 0 "[ . 1 . 2]" 1
575 1 39 TRP HZ2 1 87 ILE MG 3.790 . 3.790 2.519 2.219 3.015 . 0 0 "[ . 1 . 2]" 1
576 1 40 ASN H 1 40 ASN HB2 3.840 . 3.840 2.535 2.368 2.970 . 0 0 "[ . 1 . 2]" 1
577 1 40 ASN H 1 40 ASN HB3 . . 4.250 3.065 2.134 3.693 . 0 0 "[ . 1 . 2]" 1
578 1 40 ASN H 1 40 ASN HD21 . . 5.260 3.582 2.052 4.666 . 0 0 "[ . 1 . 2]" 1
579 1 40 ASN H 1 40 ASN HD22 5.180 . 5.180 4.625 3.602 5.760 0.580 10 2 "[ .- + . 2]" 1
580 1 40 ASN H 1 41 LYS H 4.500 . 4.500 2.663 2.536 2.865 . 0 0 "[ . 1 . 2]" 1
581 1 40 ASN H 1 76 LEU QD 4.690 . 4.690 3.859 3.156 4.557 . 0 0 "[ . 1 . 2]" 1
582 1 40 ASN HA 1 41 LYS H 5.530 . 5.530 3.558 3.520 3.586 . 0 0 "[ . 1 . 2]" 1
583 1 40 ASN HA 1 41 LYS HA 5.500 . 5.500 4.934 4.870 5.011 . 0 0 "[ . 1 . 2]" 1
584 1 40 ASN HA 1 43 TYR H . . 4.120 3.613 3.163 3.983 . 0 0 "[ . 1 . 2]" 1
585 1 40 ASN HA 1 43 TYR HB2 4.940 . 4.940 3.458 2.662 3.934 . 0 0 "[ . 1 . 2]" 1
586 1 40 ASN HA 1 43 TYR HB3 5.260 . 5.260 2.763 2.398 3.369 . 0 0 "[ . 1 . 2]" 1
587 1 40 ASN HA 1 72 VAL MG1 5.070 . 5.070 4.020 3.485 4.360 . 0 0 "[ . 1 . 2]" 1
588 1 40 ASN HA 1 76 LEU QD 4.910 . 4.910 3.443 2.630 4.451 . 0 0 "[ . 1 . 2]" 1
589 1 40 ASN HB2 1 41 LYS H . . 4.010 3.154 2.345 4.054 0.044 1 0 "[ . 1 . 2]" 1
590 1 40 ASN HB2 1 41 LYS QG 5.260 . 5.260 4.420 3.265 5.372 0.112 10 0 "[ . 1 . 2]" 1
591 1 40 ASN HB3 1 41 LYS H . . 4.650 3.106 2.286 3.749 . 0 0 "[ . 1 . 2]" 1
592 1 40 ASN HD22 1 41 LYS H 5.490 . 5.490 5.429 3.836 5.801 0.311 11 0 "[ . 1 . 2]" 1
593 1 41 LYS H 1 41 LYS HB3 3.850 . 3.850 3.626 3.586 3.662 . 0 0 "[ . 1 . 2]" 1
594 1 41 LYS H 1 41 LYS QG 4.640 . 4.640 2.352 2.048 3.515 . 0 0 "[ . 1 . 2]" 1
595 1 41 LYS H 1 42 ILE H 4.400 . 4.400 2.891 2.824 2.962 . 0 0 "[ . 1 . 2]" 1
596 1 41 LYS HA 1 42 ILE H 5.150 . 5.150 3.570 3.543 3.602 . 0 0 "[ . 1 . 2]" 1
597 1 41 LYS HA 1 43 TYR H 5.500 . 5.500 4.628 4.311 4.854 . 0 0 "[ . 1 . 2]" 1
598 1 41 LYS HB3 1 42 ILE H 3.850 . 3.850 3.280 3.092 3.460 . 0 0 "[ . 1 . 2]" 1
599 1 41 LYS HB3 1 42 ILE HG13 4.070 . 4.070 3.962 3.316 4.254 0.184 8 0 "[ . 1 . 2]" 1
600 1 42 ILE H 1 42 ILE HB 4.380 . 4.380 2.458 2.394 2.554 . 0 0 "[ . 1 . 2]" 1
601 1 42 ILE H 1 42 ILE MD . . 4.710 3.449 3.234 3.573 . 0 0 "[ . 1 . 2]" 1
602 1 42 ILE H 1 42 ILE HG12 4.970 . 4.970 3.493 3.295 3.586 . 0 0 "[ . 1 . 2]" 1
603 1 42 ILE H 1 42 ILE HG13 5.280 . 5.280 2.130 1.997 2.265 . 0 0 "[ . 1 . 2]" 1
604 1 42 ILE H 1 42 ILE MG 4.660 . 4.660 3.791 3.765 3.818 . 0 0 "[ . 1 . 2]" 1
605 1 42 ILE H 1 43 TYR H 4.360 . 4.360 2.795 2.605 2.888 . 0 0 "[ . 1 . 2]" 1
606 1 42 ILE HA 1 42 ILE MD 4.650 . 4.650 3.893 3.859 3.917 . 0 0 "[ . 1 . 2]" 1
607 1 42 ILE HA 1 42 ILE HG12 4.230 . 4.230 2.612 2.531 2.723 . 0 0 "[ . 1 . 2]" 1
608 1 42 ILE HA 1 45 LEU H 5.130 . 5.130 3.672 3.269 4.033 . 0 0 "[ . 1 . 2]" 1
609 1 42 ILE HA 1 45 LEU HB3 5.360 . 5.360 4.491 4.046 4.897 . 0 0 "[ . 1 . 2]" 1
610 1 42 ILE HA 1 46 VAL H 5.670 . 5.670 4.055 3.727 4.483 . 0 0 "[ . 1 . 2]" 1
611 1 42 ILE HB 1 43 TYR H 4.420 . 4.420 2.671 2.406 2.835 . 0 0 "[ . 1 . 2]" 1
612 1 42 ILE MD 1 42 ILE MG 3.210 . 3.210 2.089 2.032 2.198 . 0 0 "[ . 1 . 2]" 1
613 1 42 ILE MD 1 72 VAL MG1 5.780 . 5.780 4.192 3.917 4.461 . 0 0 "[ . 1 . 2]" 1
614 1 42 ILE MD 1 90 VAL HB 5.150 . 5.150 5.003 4.704 5.210 0.060 9 0 "[ . 1 . 2]" 1
615 1 42 ILE MD 1 90 VAL MG1 5.000 . 5.000 3.492 3.245 3.972 . 0 0 "[ . 1 . 2]" 1
616 1 42 ILE MD 1 90 VAL MG2 4.840 . 4.840 4.669 4.410 4.876 0.036 18 0 "[ . 1 . 2]" 1
617 1 42 ILE MG 1 43 TYR H 4.670 . 4.670 3.371 3.155 3.575 . 0 0 "[ . 1 . 2]" 1
618 1 42 ILE MG 1 72 VAL MG1 4.780 . 4.780 3.433 2.779 3.989 . 0 0 "[ . 1 . 2]" 1
619 1 42 ILE MG 1 72 VAL MG2 4.230 . 4.230 2.604 2.334 3.081 . 0 0 "[ . 1 . 2]" 1
620 1 43 TYR H 1 43 TYR HB2 4.020 . 4.020 2.482 2.208 2.607 . 0 0 "[ . 1 . 2]" 1
621 1 43 TYR H 1 43 TYR HB3 3.950 . 3.950 2.566 2.456 2.791 . 0 0 "[ . 1 . 2]" 1
622 1 43 TYR H 1 43 TYR QD 5.500 . 5.500 4.233 4.176 4.282 . 0 0 "[ . 1 . 2]" 1
623 1 43 TYR H 1 44 ARG H 4.510 . 4.510 2.786 2.690 2.871 . 0 0 "[ . 1 . 2]" 1
624 1 43 TYR H 1 44 ARG QB 5.470 . 5.470 4.804 4.516 5.221 . 0 0 "[ . 1 . 2]" 1
625 1 43 TYR H 1 72 VAL MG1 . . 4.610 3.098 2.662 3.484 . 0 0 "[ . 1 . 2]" 1
626 1 43 TYR HA 1 43 TYR QD 4.520 . 4.520 2.623 2.223 2.933 . 0 0 "[ . 1 . 2]" 1
627 1 43 TYR HA 1 44 ARG H 5.070 . 5.070 3.575 3.551 3.624 . 0 0 "[ . 1 . 2]" 1
628 1 43 TYR HA 1 46 VAL H 5.290 . 5.290 3.789 3.478 4.052 . 0 0 "[ . 1 . 2]" 1
629 1 43 TYR HA 1 46 VAL HB 4.370 . 4.370 2.950 2.644 3.121 . 0 0 "[ . 1 . 2]" 1
630 1 43 TYR HA 1 46 VAL MG2 3.890 . 3.890 3.692 3.170 3.983 0.093 10 0 "[ . 1 . 2]" 1
631 1 43 TYR HA 1 72 VAL HB 5.240 . 5.240 3.768 3.275 4.254 . 0 0 "[ . 1 . 2]" 1
632 1 43 TYR HA 1 72 VAL MG1 5.170 . 5.170 3.371 3.147 3.851 . 0 0 "[ . 1 . 2]" 1
633 1 43 TYR HA 1 72 VAL MG2 . . 5.630 3.531 3.035 3.913 . 0 0 "[ . 1 . 2]" 1
634 1 43 TYR HB2 1 44 ARG H 4.470 . 4.470 3.842 3.604 3.958 . 0 0 "[ . 1 . 2]" 1
635 1 43 TYR HB2 1 72 VAL MG1 . . 4.570 2.100 1.850 2.467 . 0 0 "[ . 1 . 2]" 1
636 1 43 TYR HB3 1 44 ARG H 4.700 . 4.700 2.547 2.394 2.672 . 0 0 "[ . 1 . 2]" 1
637 1 43 TYR HB3 1 44 ARG QB 5.280 . 5.280 4.519 4.184 4.694 . 0 0 "[ . 1 . 2]" 1
638 1 43 TYR HB3 1 44 ARG HG3 4.070 . 4.070 3.316 2.955 4.125 0.055 13 0 "[ . 1 . 2]" 1
639 1 43 TYR HB3 1 72 VAL MG1 4.870 . 4.870 3.514 3.281 3.863 . 0 0 "[ . 1 . 2]" 1
640 1 43 TYR QD 1 44 ARG H . . 5.400 3.728 3.445 4.150 . 0 0 "[ . 1 . 2]" 1
641 1 43 TYR QD 1 44 ARG HA 4.940 . 4.940 3.893 3.421 4.384 . 0 0 "[ . 1 . 2]" 1
642 1 43 TYR QD 1 44 ARG QB 5.320 . 5.320 4.774 3.685 5.574 0.254 6 0 "[ . 1 . 2]" 1
643 1 43 TYR QD 1 44 ARG HG3 . . 5.280 3.506 2.481 5.268 . 0 0 "[ . 1 . 2]" 1
644 1 43 TYR QD 1 47 HIS HB3 5.490 . 5.490 5.313 4.581 5.653 0.163 6 0 "[ . 1 . 2]" 1
645 1 43 TYR QD 1 69 MET HA 4.850 . 4.850 2.739 2.252 3.925 . 0 0 "[ . 1 . 2]" 1
646 1 43 TYR QD 1 72 VAL HB . . 4.280 2.467 1.905 3.540 . 0 0 "[ . 1 . 2]" 1
647 1 43 TYR QD 1 72 VAL MG1 3.920 . 3.920 3.004 2.221 3.437 . 0 0 "[ . 1 . 2]" 1
648 1 43 TYR QD 1 72 VAL MG2 5.090 . 5.090 3.677 3.203 4.133 . 0 0 "[ . 1 . 2]" 1
649 1 43 TYR QD 1 73 ASP HB2 6.000 . 6.000 4.123 3.405 5.405 . 0 0 "[ . 1 . 2]" 1
650 1 43 TYR QE 1 69 MET HA . . 4.490 2.513 2.072 3.290 . 0 0 "[ . 1 . 2]" 1
651 1 43 TYR QE 1 69 MET HB2 5.680 . 5.680 4.144 3.796 4.591 . 0 0 "[ . 1 . 2]" 1
652 1 43 TYR QE 1 69 MET HB3 . . 3.990 2.727 2.404 3.222 . 0 0 "[ . 1 . 2]" 1
653 1 43 TYR QE 1 69 MET ME 4.250 . 4.250 2.717 2.111 3.215 . 0 0 "[ . 1 . 2]" 1
654 1 43 TYR QE 1 69 MET HG2 4.570 . 4.570 4.599 4.312 4.846 0.276 13 0 "[ . 1 . 2]" 1
655 1 43 TYR QE 1 72 VAL MG1 5.110 . 5.110 4.534 3.464 5.070 . 0 0 "[ . 1 . 2]" 1
656 1 43 TYR QE 1 73 ASP H . . 4.470 3.555 2.699 4.059 . 0 0 "[ . 1 . 2]" 1
657 1 43 TYR QE 1 73 ASP HA . . 5.030 3.974 2.157 4.625 . 0 0 "[ . 1 . 2]" 1
658 1 43 TYR QE 1 73 ASP HB2 . . 3.930 2.710 2.186 4.006 0.076 13 0 "[ . 1 . 2]" 1
659 1 43 TYR QE 1 73 ASP HB3 . . 4.510 4.106 3.569 4.797 0.287 13 0 "[ . 1 . 2]" 1
660 1 44 ARG H 1 44 ARG QB 3.890 . 3.890 2.439 2.241 2.746 . 0 0 "[ . 1 . 2]" 1
661 1 44 ARG H 1 44 ARG HG2 5.340 . 5.340 3.597 3.354 4.056 . 0 0 "[ . 1 . 2]" 1
662 1 44 ARG H 1 44 ARG HG3 5.360 . 5.360 2.354 2.048 2.924 . 0 0 "[ . 1 . 2]" 1
663 1 44 ARG H 1 45 LEU H 4.420 . 4.420 2.656 2.620 2.810 . 0 0 "[ . 1 . 2]" 1
664 1 44 ARG HA 1 44 ARG HD3 4.910 . 4.910 4.593 4.122 4.869 . 0 0 "[ . 1 . 2]" 1
665 1 44 ARG HA 1 44 ARG HG3 4.440 . 4.440 3.060 2.773 3.740 . 0 0 "[ . 1 . 2]" 1
666 1 44 ARG HA 1 45 LEU H . . 3.960 3.536 3.488 3.563 . 0 0 "[ . 1 . 2]" 1
667 1 44 ARG HA 1 46 VAL H 5.130 . 5.130 4.579 4.380 4.723 . 0 0 "[ . 1 . 2]" 1
668 1 44 ARG HA 1 47 HIS H . . 4.400 3.449 3.092 3.753 . 0 0 "[ . 1 . 2]" 1
669 1 44 ARG HA 1 47 HIS HB2 4.530 . 4.530 3.012 2.417 3.488 . 0 0 "[ . 1 . 2]" 1
670 1 44 ARG HA 1 47 HIS HB3 4.940 . 4.940 2.610 2.007 4.558 . 0 0 "[ . 1 . 2]" 1
671 1 44 ARG QB 1 45 LEU H 3.780 . 3.780 2.805 2.469 3.706 . 0 0 "[ . 1 . 2]" 1
672 1 44 ARG QB 1 47 HIS HB2 5.350 . 5.350 4.922 4.067 5.393 0.043 11 0 "[ . 1 . 2]" 1
673 1 44 ARG HG3 1 45 LEU H 5.650 . 5.650 4.430 3.107 4.886 . 0 0 "[ . 1 . 2]" 1
674 1 45 LEU H 1 45 LEU MD1 4.920 . 4.920 3.694 3.569 3.813 . 0 0 "[ . 1 . 2]" 1
675 1 45 LEU H 1 45 LEU MD2 . . 4.400 3.351 3.147 3.689 . 0 0 "[ . 1 . 2]" 1
676 1 45 LEU H 1 45 LEU HG 4.050 . 4.050 2.364 2.200 2.533 . 0 0 "[ . 1 . 2]" 1
677 1 45 LEU H 1 46 VAL H 4.110 . 4.110 2.603 2.535 2.710 . 0 0 "[ . 1 . 2]" 1
678 1 45 LEU HA 1 45 LEU MD2 . . 3.300 2.109 1.988 2.173 . 0 0 "[ . 1 . 2]" 1
679 1 45 LEU HA 1 48 THR H 5.120 . 5.120 3.388 3.153 3.590 . 0 0 "[ . 1 . 2]" 1
680 1 45 LEU HA 1 49 MET ME 4.980 . 4.980 4.511 4.139 5.028 0.048 2 0 "[ . 1 . 2]" 1
681 1 45 LEU HB2 1 46 VAL H 3.600 . 3.600 2.656 2.445 2.783 . 0 0 "[ . 1 . 2]" 1
682 1 45 LEU HB3 1 46 VAL H 4.890 . 4.890 3.701 3.401 3.882 . 0 0 "[ . 1 . 2]" 1
683 1 45 LEU MD1 1 46 VAL H 5.450 . 5.450 4.598 4.364 4.736 . 0 0 "[ . 1 . 2]" 1
684 1 45 LEU HG 1 46 VAL H 5.480 . 5.480 4.375 4.255 4.502 . 0 0 "[ . 1 . 2]" 1
685 1 46 VAL H 1 46 VAL HB 3.780 . 3.780 2.459 2.381 2.579 . 0 0 "[ . 1 . 2]" 1
686 1 46 VAL H 1 46 VAL MG1 4.580 . 4.580 3.808 3.777 3.843 . 0 0 "[ . 1 . 2]" 1
687 1 46 VAL H 1 46 VAL MG2 3.760 . 3.760 2.334 2.154 2.491 . 0 0 "[ . 1 . 2]" 1
688 1 46 VAL H 1 49 MET ME 5.330 . 5.330 4.163 3.507 4.702 . 0 0 "[ . 1 . 2]" 1
689 1 46 VAL HA 1 46 VAL MG1 3.650 . 3.650 2.543 2.471 2.632 . 0 0 "[ . 1 . 2]" 1
690 1 46 VAL HA 1 49 MET H 4.980 . 4.980 2.999 2.797 3.165 . 0 0 "[ . 1 . 2]" 1
691 1 46 VAL HA 1 49 MET HB2 4.330 . 4.330 2.480 2.319 2.822 . 0 0 "[ . 1 . 2]" 1
692 1 46 VAL HA 1 49 MET ME . . 3.820 3.256 2.791 3.516 . 0 0 "[ . 1 . 2]" 1
693 1 46 VAL HB 1 47 HIS H 4.410 . 4.410 2.904 2.745 3.011 . 0 0 "[ . 1 . 2]" 1
694 1 46 VAL MG1 1 47 HIS H 4.100 . 4.100 3.516 3.318 3.689 . 0 0 "[ . 1 . 2]" 1
695 1 46 VAL MG1 1 47 HIS HA 5.620 . 5.620 3.743 3.531 3.993 . 0 0 "[ . 1 . 2]" 1
696 1 46 VAL MG1 1 49 MET HG2 5.320 . 5.320 5.338 5.084 5.498 0.178 9 0 "[ . 1 . 2]" 1
697 1 46 VAL MG1 1 68 ILE HB 4.230 . 4.230 1.798 1.614 2.011 . 0 0 "[ . 1 . 2]" 1
698 1 46 VAL MG1 1 69 MET H 4.440 . 4.440 3.199 2.975 3.607 . 0 0 "[ . 1 . 2]" 1
699 1 46 VAL MG1 1 69 MET HA 4.400 . 4.400 3.782 3.466 4.205 . 0 0 "[ . 1 . 2]" 1
700 1 46 VAL MG1 1 69 MET HB2 5.340 . 5.340 4.620 4.385 5.224 . 0 0 "[ . 1 . 2]" 1
701 1 46 VAL MG1 1 69 MET ME 5.830 . 5.830 4.116 3.614 4.538 . 0 0 "[ . 1 . 2]" 1
702 1 46 VAL MG1 1 69 MET HG3 3.880 . 3.880 3.532 2.743 3.885 0.005 19 0 "[ . 1 . 2]" 1
703 1 46 VAL MG2 1 47 HIS H 4.940 . 4.940 4.068 3.963 4.174 . 0 0 "[ . 1 . 2]" 1
704 1 47 HIS H 1 47 HIS HB2 4.070 . 4.070 2.597 2.262 3.098 . 0 0 "[ . 1 . 2]" 1
705 1 47 HIS H 1 47 HIS HB3 4.170 . 4.170 2.595 2.171 3.647 . 0 0 "[ . 1 . 2]" 1
706 1 47 HIS H 1 48 THR H . . 4.280 2.743 2.636 2.864 . 0 0 "[ . 1 . 2]" 1
707 1 47 HIS H 1 69 MET ME 5.220 . 5.220 4.074 3.240 4.704 . 0 0 "[ . 1 . 2]" 1
708 1 47 HIS HA 1 47 HIS HD2 4.450 . 4.450 3.470 2.982 4.158 . 0 0 "[ . 1 . 2]" 1
709 1 47 HIS HA 1 48 THR H 5.360 . 5.360 3.552 3.529 3.578 . 0 0 "[ . 1 . 2]" 1
710 1 47 HIS HA 1 50 LYS H . . 5.110 3.710 3.388 4.193 . 0 0 "[ . 1 . 2]" 1
711 1 47 HIS HA 1 50 LYS HB2 4.770 . 4.770 3.471 2.975 4.015 . 0 0 "[ . 1 . 2]" 1
712 1 47 HIS HA 1 50 LYS HB3 4.910 . 4.910 2.918 2.228 3.431 . 0 0 "[ . 1 . 2]" 1
713 1 47 HIS HA 1 51 GLU H 5.160 . 5.160 4.285 4.058 4.535 . 0 0 "[ . 1 . 2]" 1
714 1 47 HIS HA 1 69 MET ME 4.010 . 4.010 2.864 2.384 3.191 . 0 0 "[ . 1 . 2]" 1
715 1 47 HIS HB2 1 48 THR H 4.360 . 4.360 3.828 2.489 4.096 . 0 0 "[ . 1 . 2]" 1
716 1 47 HIS HB2 1 69 MET ME 5.120 . 5.120 2.635 2.057 4.347 . 0 0 "[ . 1 . 2]" 1
717 1 47 HIS HB3 1 48 THR H 5.020 . 5.020 2.747 2.508 3.217 . 0 0 "[ . 1 . 2]" 1
718 1 47 HIS HB3 1 69 MET ME 4.190 . 4.190 3.921 3.248 4.270 0.080 18 0 "[ . 1 . 2]" 1
719 1 47 HIS HD2 1 69 MET ME 3.900 . 3.900 2.538 1.688 3.982 0.082 14 0 "[ . 1 . 2]" 1
720 1 48 THR H 1 48 THR HB . . 4.010 2.566 2.499 2.624 . 0 0 "[ . 1 . 2]" 1
721 1 48 THR H 1 49 MET H 4.250 . 4.250 2.683 2.602 2.776 . 0 0 "[ . 1 . 2]" 1
722 1 48 THR H 1 49 MET ME 5.610 . 5.610 5.573 5.315 5.804 0.194 2 0 "[ . 1 . 2]" 1
723 1 48 THR HA 1 51 GLU H 5.060 . 5.060 3.503 3.193 3.920 . 0 0 "[ . 1 . 2]" 1
724 1 48 THR HA 1 51 GLU HG3 5.740 . 5.740 4.367 2.933 5.651 . 0 0 "[ . 1 . 2]" 1
725 1 48 THR HB 1 49 MET H . . 4.210 2.699 2.523 2.846 . 0 0 "[ . 1 . 2]" 1
726 1 48 THR MG 1 49 MET H 4.960 . 4.960 3.581 3.451 3.735 . 0 0 "[ . 1 . 2]" 1
727 1 48 THR MG 1 49 MET HA 4.550 . 4.550 3.761 3.662 3.867 . 0 0 "[ . 1 . 2]" 1
728 1 48 THR MG 1 49 MET HG2 4.690 . 4.690 4.761 4.708 4.818 0.128 17 0 "[ . 1 . 2]" 1
729 1 48 THR MG 1 51 GLU HG2 5.320 . 5.320 4.332 3.008 5.433 0.113 7 0 "[ . 1 . 2]" 1
730 1 48 THR MG 1 52 ILE MD 3.980 . 3.980 2.350 2.003 2.548 . 0 0 "[ . 1 . 2]" 1
731 1 48 THR MG 1 52 ILE HG12 4.190 . 4.190 3.705 3.546 4.039 . 0 0 "[ . 1 . 2]" 1
732 1 48 THR MG 1 52 ILE HG13 5.630 . 5.630 2.695 2.527 3.018 . 0 0 "[ . 1 . 2]" 1
733 1 49 MET H 1 49 MET HB2 4.380 . 4.380 2.601 2.532 2.736 . 0 0 "[ . 1 . 2]" 1
734 1 49 MET H 1 49 MET HG2 4.610 . 4.610 3.392 3.231 3.486 . 0 0 "[ . 1 . 2]" 1
735 1 49 MET H 1 49 MET HG3 4.670 . 4.670 2.175 2.084 2.250 . 0 0 "[ . 1 . 2]" 1
736 1 49 MET H 1 50 LYS H 4.450 . 4.450 2.744 2.598 2.872 . 0 0 "[ . 1 . 2]" 1
737 1 49 MET HA 1 49 MET HG3 4.040 . 4.040 3.122 3.027 3.278 . 0 0 "[ . 1 . 2]" 1
738 1 49 MET HA 1 50 LYS H 4.490 . 4.490 3.533 3.502 3.570 . 0 0 "[ . 1 . 2]" 1
739 1 49 MET HA 1 51 GLU H 5.260 . 5.260 4.708 4.463 4.882 . 0 0 "[ . 1 . 2]" 1
740 1 49 MET HA 1 52 ILE H 4.240 . 4.240 3.559 3.342 3.757 . 0 0 "[ . 1 . 2]" 1
741 1 49 MET HA 1 52 ILE HB 4.490 . 4.490 2.611 2.132 2.903 . 0 0 "[ . 1 . 2]" 1
742 1 49 MET HA 1 52 ILE MD 3.930 . 3.930 2.349 1.935 2.726 . 0 0 "[ . 1 . 2]" 1
743 1 49 MET HA 1 52 ILE HG12 4.820 . 4.820 4.680 4.285 4.914 0.094 6 0 "[ . 1 . 2]" 1
744 1 49 MET HA 1 52 ILE HG13 4.860 . 4.860 3.471 2.967 3.875 . 0 0 "[ . 1 . 2]" 1
745 1 49 MET HB2 1 49 MET ME 4.420 . 4.420 3.975 3.888 4.034 . 0 0 "[ . 1 . 2]" 1
746 1 49 MET HB2 1 50 LYS H 5.000 . 5.000 2.522 2.192 2.773 . 0 0 "[ . 1 . 2]" 1
747 1 49 MET HB2 1 65 LEU MD2 5.370 . 5.370 4.220 3.321 4.757 . 0 0 "[ . 1 . 2]" 1
748 1 49 MET HB2 1 65 LEU HG 4.530 . 4.530 2.934 2.464 4.767 0.237 18 0 "[ . 1 . 2]" 1
749 1 49 MET HB3 1 50 LYS H 5.240 . 5.240 3.602 3.374 3.817 . 0 0 "[ . 1 . 2]" 1
750 1 50 LYS H 1 50 LYS HB2 4.180 . 4.180 2.462 2.306 2.614 . 0 0 "[ . 1 . 2]" 1
751 1 50 LYS H 1 50 LYS HB3 4.270 . 4.270 2.543 2.250 2.657 . 0 0 "[ . 1 . 2]" 1
752 1 50 LYS H 1 50 LYS HG3 5.410 . 5.410 4.458 4.344 4.539 . 0 0 "[ . 1 . 2]" 1
753 1 50 LYS H 1 51 GLU H . . 4.340 2.807 2.685 2.999 . 0 0 "[ . 1 . 2]" 1
754 1 50 LYS H 1 65 LEU HG 4.830 . 4.830 3.739 3.247 5.140 0.310 18 0 "[ . 1 . 2]" 1
755 1 50 LYS HA 1 50 LYS HG3 4.140 . 4.140 2.651 2.533 2.913 . 0 0 "[ . 1 . 2]" 1
756 1 50 LYS HA 1 51 GLU H 5.730 . 5.730 3.577 3.542 3.614 . 0 0 "[ . 1 . 2]" 1
757 1 50 LYS HA 1 53 THR HB 6.000 . 6.000 4.745 4.497 5.033 . 0 0 "[ . 1 . 2]" 1
758 1 50 LYS HA 1 54 GLU H 5.060 . 5.060 4.255 4.125 4.404 . 0 0 "[ . 1 . 2]" 1
759 1 50 LYS HA 1 62 ALA MB . . 4.760 3.715 3.095 4.224 . 0 0 "[ . 1 . 2]" 1
760 1 50 LYS HA 1 65 LEU HG 4.050 . 4.050 3.227 2.796 4.217 0.167 18 0 "[ . 1 . 2]" 1
761 1 50 LYS HB2 1 51 GLU H 3.640 . 3.640 3.745 3.697 3.827 0.187 20 0 "[ . 1 . 2]" 1
762 1 50 LYS HB3 1 51 GLU H 4.740 . 4.740 2.383 2.290 2.517 . 0 0 "[ . 1 . 2]" 1
763 1 50 LYS HB3 1 65 LEU HB3 5.330 . 5.330 4.326 3.934 4.998 . 0 0 "[ . 1 . 2]" 1
764 1 50 LYS HG2 1 51 GLU HA 3.990 . 3.990 3.808 3.210 4.032 0.042 18 0 "[ . 1 . 2]" 1
765 1 50 LYS HG3 1 51 GLU HA 5.380 . 5.380 5.329 4.685 5.481 0.101 7 0 "[ . 1 . 2]" 1
766 1 51 GLU H 1 51 GLU HB3 3.910 . 3.910 2.633 2.446 3.630 . 0 0 "[ . 1 . 2]" 1
767 1 51 GLU H 1 51 GLU HG2 4.330 . 4.330 3.512 2.135 4.493 0.163 12 0 "[ . 1 . 2]" 1
768 1 51 GLU H 1 51 GLU HG3 4.380 . 4.380 3.950 2.276 4.473 0.093 16 0 "[ . 1 . 2]" 1
769 1 51 GLU HA 1 51 GLU HG2 4.210 . 4.210 3.408 2.599 3.850 . 0 0 "[ . 1 . 2]" 1
770 1 51 GLU HA 1 52 ILE H 5.260 . 5.260 3.557 3.540 3.586 . 0 0 "[ . 1 . 2]" 1
771 1 51 GLU HB2 1 52 ILE H 4.250 . 4.250 3.868 2.684 4.044 . 0 0 "[ . 1 . 2]" 1
772 1 51 GLU HB3 1 51 GLU HG2 2.800 . 2.800 2.479 2.423 2.533 . 0 0 "[ . 1 . 2]" 1
773 1 51 GLU HG3 1 52 ILE H 5.370 . 5.370 3.990 2.558 5.010 . 0 0 "[ . 1 . 2]" 1
774 1 52 ILE H 1 52 ILE HB 4.000 . 4.000 2.419 2.270 2.524 . 0 0 "[ . 1 . 2]" 1
775 1 52 ILE H 1 52 ILE MD 4.730 . 4.730 3.716 3.598 3.877 . 0 0 "[ . 1 . 2]" 1
776 1 52 ILE H 1 52 ILE HG12 4.000 . 4.000 3.689 3.461 3.955 . 0 0 "[ . 1 . 2]" 1
777 1 52 ILE H 1 52 ILE HG13 4.290 . 4.290 2.450 2.172 2.787 . 0 0 "[ . 1 . 2]" 1
778 1 52 ILE H 1 52 ILE MG 4.520 . 4.520 3.800 3.714 3.838 . 0 0 "[ . 1 . 2]" 1
779 1 52 ILE H 1 53 THR H 4.340 . 4.340 2.880 2.743 2.976 . 0 0 "[ . 1 . 2]" 1
780 1 52 ILE HA 1 52 ILE HG13 3.320 . 3.320 2.909 2.756 2.991 . 0 0 "[ . 1 . 2]" 1
781 1 52 ILE HA 1 53 THR H 4.380 . 4.380 3.608 3.587 3.629 . 0 0 "[ . 1 . 2]" 1
782 1 52 ILE HA 1 55 THR H 5.300 . 5.300 3.803 3.511 3.981 . 0 0 "[ . 1 . 2]" 1
783 1 52 ILE HA 1 55 THR HB 4.500 . 4.500 4.447 3.181 4.767 0.267 1 0 "[ . 1 . 2]" 1
784 1 52 ILE HB 1 53 THR H 4.400 . 4.400 2.524 2.406 2.705 . 0 0 "[ . 1 . 2]" 1
785 1 52 ILE HB 1 53 THR MG 5.400 . 5.400 3.917 3.694 4.127 . 0 0 "[ . 1 . 2]" 1
786 1 52 ILE MG 1 53 THR H 4.660 . 4.660 2.958 2.621 3.227 . 0 0 "[ . 1 . 2]" 1
787 1 52 ILE MG 1 53 THR HA 4.530 . 4.530 3.114 2.924 3.323 . 0 0 "[ . 1 . 2]" 1
788 1 52 ILE MG 1 53 THR MG 5.150 . 5.150 4.134 3.752 4.398 . 0 0 "[ . 1 . 2]" 1
789 1 52 ILE MG 1 56 MET QB 4.450 . 4.450 4.060 3.669 4.394 . 0 0 "[ . 1 . 2]" 1
790 1 52 ILE MG 1 56 MET ME 3.470 . 3.470 2.366 2.002 3.611 0.141 9 0 "[ . 1 . 2]" 1
791 1 52 ILE MG 1 56 MET HG2 4.730 . 4.730 3.977 2.824 4.649 . 0 0 "[ . 1 . 2]" 1
792 1 52 ILE MG 1 56 MET HG3 . . 4.400 3.100 2.463 3.575 . 0 0 "[ . 1 . 2]" 1
793 1 53 THR H 1 53 THR MG . . 3.740 2.021 1.954 2.101 . 0 0 "[ . 1 . 2]" 1
794 1 53 THR H 1 56 MET H 5.220 . 5.220 4.776 4.660 4.957 . 0 0 "[ . 1 . 2]" 1
795 1 53 THR H 1 61 VAL MG1 5.360 . 5.360 4.976 4.657 5.309 . 0 0 "[ . 1 . 2]" 1
796 1 53 THR H 1 62 ALA HA 5.560 . 5.560 5.402 5.211 5.640 0.080 18 0 "[ . 1 . 2]" 1
797 1 53 THR HA 1 53 THR MG 3.560 . 3.560 3.253 3.243 3.265 . 0 0 "[ . 1 . 2]" 1
798 1 53 THR HA 1 55 THR H 5.700 . 5.700 4.442 4.328 4.536 . 0 0 "[ . 1 . 2]" 1
799 1 53 THR HA 1 56 MET H . . 4.810 3.304 3.069 3.557 . 0 0 "[ . 1 . 2]" 1
800 1 53 THR HA 1 56 MET ME 5.790 . 5.790 4.092 1.971 4.735 . 0 0 "[ . 1 . 2]" 1
801 1 53 THR HA 1 58 PHE H 5.240 . 5.240 3.976 3.744 4.222 . 0 0 "[ . 1 . 2]" 1
802 1 53 THR HA 1 58 PHE HB3 5.520 . 5.520 5.010 4.382 5.251 . 0 0 "[ . 1 . 2]" 1
803 1 53 THR HB 1 54 GLU H 4.900 . 4.900 4.245 4.151 4.323 . 0 0 "[ . 1 . 2]" 1
804 1 53 THR HB 1 58 PHE H 5.230 . 5.230 5.341 5.266 5.435 0.205 5 0 "[ . 1 . 2]" 1
805 1 53 THR HB 1 58 PHE HB2 . . 4.620 3.784 3.666 3.913 . 0 0 "[ . 1 . 2]" 1
806 1 53 THR HB 1 58 PHE HB3 . . 4.670 4.787 4.361 4.903 0.233 3 0 "[ . 1 . 2]" 1
807 1 53 THR HB 1 61 VAL HB 4.790 . 4.790 3.290 2.899 3.651 . 0 0 "[ . 1 . 2]" 1
808 1 53 THR HB 1 61 VAL MG1 4.770 . 4.770 2.849 2.536 3.196 . 0 0 "[ . 1 . 2]" 1
809 1 53 THR HB 1 62 ALA H 5.220 . 5.220 4.796 4.600 5.037 . 0 0 "[ . 1 . 2]" 1
810 1 53 THR HB 1 62 ALA MB 4.650 . 4.650 4.648 4.476 4.751 0.101 2 0 "[ . 1 . 2]" 1
811 1 53 THR MG 1 54 GLU H 4.930 . 4.930 2.475 2.310 2.548 . 0 0 "[ . 1 . 2]" 1
812 1 53 THR MG 1 54 GLU HA . . 3.740 3.719 3.595 3.818 0.078 19 0 "[ . 1 . 2]" 1
813 1 53 THR MG 1 54 GLU HB2 4.410 . 4.410 4.184 3.841 4.455 0.045 10 0 "[ . 1 . 2]" 1
814 1 53 THR MG 1 58 PHE H 4.990 . 4.990 4.764 4.431 5.025 0.035 15 0 "[ . 1 . 2]" 1
815 1 53 THR MG 1 58 PHE HB2 5.570 . 5.570 3.938 3.846 4.162 . 0 0 "[ . 1 . 2]" 1
816 1 53 THR MG 1 58 PHE HB3 4.440 . 4.440 4.578 4.407 4.641 0.201 16 0 "[ . 1 . 2]" 1
817 1 53 THR MG 1 61 VAL MG1 3.440 . 3.440 2.567 2.311 2.850 . 0 0 "[ . 1 . 2]" 1
818 1 53 THR MG 1 62 ALA H 5.280 . 5.280 2.924 2.533 3.218 . 0 0 "[ . 1 . 2]" 1
819 1 53 THR MG 1 62 ALA MB 3.360 . 3.360 2.123 1.981 2.325 . 0 0 "[ . 1 . 2]" 1
820 1 54 GLU H 1 54 GLU HB2 3.780 . 3.780 2.442 2.374 2.523 . 0 0 "[ . 1 . 2]" 1
821 1 54 GLU H 1 54 GLU HB3 . . 4.360 3.637 3.618 3.655 . 0 0 "[ . 1 . 2]" 1
822 1 54 GLU H 1 54 GLU HG2 . . 4.320 3.685 3.467 3.783 . 0 0 "[ . 1 . 2]" 1
823 1 54 GLU H 1 54 GLU HG3 4.230 . 4.230 2.510 2.371 2.636 . 0 0 "[ . 1 . 2]" 1
824 1 54 GLU H 1 55 THR H . . 4.130 2.703 2.605 2.800 . 0 0 "[ . 1 . 2]" 1
825 1 54 GLU H 1 62 ALA MB . . 4.550 3.695 3.360 3.873 . 0 0 "[ . 1 . 2]" 1
826 1 54 GLU HA 1 54 GLU HG3 3.930 . 3.930 3.007 2.935 3.129 . 0 0 "[ . 1 . 2]" 1
827 1 54 GLU HA 1 55 THR H 3.960 . 3.960 3.590 3.530 3.620 . 0 0 "[ . 1 . 2]" 1
828 1 54 GLU HA 1 56 MET H 5.140 . 5.140 4.227 4.075 4.367 . 0 0 "[ . 1 . 2]" 1
829 1 54 GLU HA 1 56 MET QB 5.520 . 5.520 4.986 4.709 5.161 . 0 0 "[ . 1 . 2]" 1
830 1 54 GLU HA 1 57 GLY H 4.620 . 4.620 3.288 2.933 3.714 . 0 0 "[ . 1 . 2]" 1
831 1 54 GLU HA 1 62 ALA MB 3.910 . 3.910 3.445 3.145 3.911 0.001 3 0 "[ . 1 . 2]" 1
832 1 54 GLU HB2 1 54 GLU HG2 2.950 . 2.950 3.025 3.020 3.036 0.086 10 0 "[ . 1 . 2]" 1
833 1 54 GLU HB2 1 55 THR H 4.280 . 4.280 2.795 2.470 2.989 . 0 0 "[ . 1 . 2]" 1
834 1 54 GLU HB2 1 55 THR HA 5.230 . 5.230 4.648 4.344 4.834 . 0 0 "[ . 1 . 2]" 1
835 1 54 GLU HB2 1 55 THR MG 4.940 . 4.940 4.403 3.368 5.365 0.425 10 0 "[ . 1 . 2]" 1
836 1 54 GLU HB2 1 62 ALA MB 4.410 . 4.410 4.378 4.223 4.509 0.099 17 0 "[ . 1 . 2]" 1
837 1 54 GLU HB3 1 55 THR H 4.480 . 4.480 3.661 3.487 3.853 . 0 0 "[ . 1 . 2]" 1
838 1 54 GLU HB3 1 62 ALA MB 4.970 . 4.970 4.431 4.288 4.568 . 0 0 "[ . 1 . 2]" 1
839 1 54 GLU HG2 1 55 THR H 5.700 . 5.700 5.156 4.915 5.230 . 0 0 "[ . 1 . 2]" 1
840 1 54 GLU HG2 1 62 ALA MB 4.080 . 4.080 2.541 2.363 2.703 . 0 0 "[ . 1 . 2]" 1
841 1 54 GLU HG3 1 62 ALA HA . . 5.450 4.087 3.805 4.287 . 0 0 "[ . 1 . 2]" 1
842 1 54 GLU HG3 1 62 ALA MB . . 3.920 2.388 2.096 2.590 . 0 0 "[ . 1 . 2]" 1
843 1 55 THR H 1 55 THR HB . . 3.770 2.879 2.576 3.695 . 0 0 "[ . 1 . 2]" 1
844 1 55 THR H 1 55 THR MG 4.440 . 4.440 2.404 2.192 3.767 . 0 0 "[ . 1 . 2]" 1
845 1 55 THR H 1 56 MET H . . 4.210 2.544 2.449 2.635 . 0 0 "[ . 1 . 2]" 1
846 1 55 THR HA 1 55 THR MG 3.690 . 3.690 3.050 2.357 3.280 . 0 0 "[ . 1 . 2]" 1
847 1 55 THR HA 1 56 MET H 4.660 . 4.660 3.499 3.459 3.542 . 0 0 "[ . 1 . 2]" 1
848 1 55 THR HB 1 56 MET H 4.650 . 4.650 4.061 2.792 4.222 . 0 0 "[ . 1 . 2]" 1
849 1 55 THR MG 1 56 MET H 5.010 . 5.010 2.974 2.499 4.218 . 0 0 "[ . 1 . 2]" 1
850 1 56 MET H 1 56 MET HG2 4.910 . 4.910 3.465 2.377 3.850 . 0 0 "[ . 1 . 2]" 1
851 1 56 MET H 1 56 MET HG3 . . 4.300 2.829 2.496 3.811 . 0 0 "[ . 1 . 2]" 1
852 1 56 MET H 1 58 PHE H 5.420 . 5.420 4.021 3.836 4.193 . 0 0 "[ . 1 . 2]" 1
853 1 56 MET HA 1 56 MET ME 5.170 . 5.170 4.462 3.661 4.679 . 0 0 "[ . 1 . 2]" 1
854 1 56 MET HA 1 56 MET HG2 4.510 . 4.510 2.658 2.451 3.158 . 0 0 "[ . 1 . 2]" 1
855 1 56 MET HA 1 57 GLY H 5.050 . 5.050 3.462 3.374 3.547 . 0 0 "[ . 1 . 2]" 1
856 1 56 MET QB 1 56 MET ME 3.740 . 3.740 3.320 2.070 3.718 . 0 0 "[ . 1 . 2]" 1
857 1 56 MET QB 1 57 GLY H 5.390 . 5.390 3.057 2.652 3.291 . 0 0 "[ . 1 . 2]" 1
858 1 56 MET QB 1 57 GLY HA3 4.620 . 4.620 4.511 4.304 4.673 0.053 17 0 "[ . 1 . 2]" 1
859 1 56 MET QB 1 58 PHE H 4.790 . 4.790 2.986 2.735 3.570 . 0 0 "[ . 1 . 2]" 1
860 1 56 MET QB 1 58 PHE QD 4.060 . 4.060 2.065 1.849 2.436 . 0 0 "[ . 1 . 2]" 1
861 1 56 MET QB 1 58 PHE QE 4.900 . 4.900 2.534 2.139 2.856 . 0 0 "[ . 1 . 2]" 1
862 1 56 MET QB 1 61 VAL MG2 5.140 . 5.140 5.262 5.139 5.368 0.228 20 0 "[ . 1 . 2]" 1
863 1 56 MET ME 1 58 PHE QE 4.790 . 4.790 4.454 2.147 4.952 0.162 16 0 "[ . 1 . 2]" 1
864 1 57 GLY H 1 58 PHE H . . 4.180 2.423 2.209 2.602 . 0 0 "[ . 1 . 2]" 1
865 1 57 GLY HA3 1 58 PHE H 5.020 . 5.020 3.384 3.259 3.573 . 0 0 "[ . 1 . 2]" 1
866 1 58 PHE H 1 58 PHE HB3 4.260 . 4.260 3.605 3.562 3.747 . 0 0 "[ . 1 . 2]" 1
867 1 58 PHE H 1 58 PHE QD 5.260 . 5.260 2.761 2.055 3.375 . 0 0 "[ . 1 . 2]" 1
868 1 58 PHE HA 1 58 PHE QD . . 3.910 2.761 2.280 3.198 . 0 0 "[ . 1 . 2]" 1
869 1 58 PHE HA 1 59 SER H 4.640 . 4.640 2.321 2.213 2.613 . 0 0 "[ . 1 . 2]" 1
870 1 58 PHE HA 1 61 VAL MG2 5.380 . 5.380 4.029 3.617 4.266 . 0 0 "[ . 1 . 2]" 1
871 1 58 PHE HB2 1 61 VAL H 5.220 . 5.220 4.076 3.881 4.476 . 0 0 "[ . 1 . 2]" 1
872 1 58 PHE HB2 1 61 VAL HB 4.340 . 4.340 3.038 2.784 3.420 . 0 0 "[ . 1 . 2]" 1
873 1 58 PHE HB2 1 61 VAL MG2 4.090 . 4.090 3.160 2.907 3.363 . 0 0 "[ . 1 . 2]" 1
874 1 58 PHE HB3 1 61 VAL HB 4.850 . 4.850 2.651 2.174 3.124 . 0 0 "[ . 1 . 2]" 1
875 1 58 PHE HB3 1 61 VAL MG2 4.630 . 4.630 2.040 1.811 2.163 . 0 0 "[ . 1 . 2]" 1
876 1 58 PHE QD 1 61 VAL MG2 . . 4.530 2.938 1.965 3.558 . 0 0 "[ . 1 . 2]" 1
877 1 58 PHE QE 1 61 VAL MG2 4.850 . 4.850 4.313 3.832 4.828 . 0 0 "[ . 1 . 2]" 1
878 1 59 SER HA 1 62 ALA MB 3.960 . 3.960 2.329 2.075 2.624 . 0 0 "[ . 1 . 2]" 1
879 1 59 SER HB3 1 62 ALA MB 4.090 . 4.090 3.990 3.661 4.219 0.129 17 0 "[ . 1 . 2]" 1
880 1 60 SER HA 1 61 VAL H . . 5.170 3.573 3.531 3.592 . 0 0 "[ . 1 . 2]" 1
881 1 60 SER HA 1 63 LYS H 5.190 . 5.190 3.709 3.500 4.050 . 0 0 "[ . 1 . 2]" 1
882 1 60 SER HA 1 63 LYS QB 4.180 . 4.180 3.076 2.606 3.606 . 0 0 "[ . 1 . 2]" 1
883 1 60 SER HA 1 63 LYS QD 4.460 . 4.460 3.267 2.250 4.442 . 0 0 "[ . 1 . 2]" 1
884 1 60 SER HB2 1 61 VAL H 5.810 . 5.810 3.132 2.507 3.988 . 0 0 "[ . 1 . 2]" 1
885 1 60 SER HB3 1 61 VAL H 5.360 . 5.360 3.372 2.444 3.954 . 0 0 "[ . 1 . 2]" 1
886 1 61 VAL H 1 61 VAL HB . . 3.780 2.645 2.520 2.734 . 0 0 "[ . 1 . 2]" 1
887 1 61 VAL H 1 61 VAL MG2 . . 3.810 2.034 1.941 2.136 . 0 0 "[ . 1 . 2]" 1
888 1 61 VAL H 1 62 ALA H 4.100 . 4.100 2.600 2.523 2.709 . 0 0 "[ . 1 . 2]" 1
889 1 61 VAL H 1 62 ALA MB 5.170 . 5.170 4.272 4.196 4.353 . 0 0 "[ . 1 . 2]" 1
890 1 61 VAL HA 1 61 VAL MG1 3.610 . 3.610 2.425 2.388 2.484 . 0 0 "[ . 1 . 2]" 1
891 1 61 VAL HA 1 62 ALA H 4.860 . 4.860 3.570 3.543 3.595 . 0 0 "[ . 1 . 2]" 1
892 1 61 VAL HB 1 62 ALA H . . 3.960 2.615 2.417 2.833 . 0 0 "[ . 1 . 2]" 1
893 1 61 VAL HB 1 62 ALA HA 6.000 . 6.000 4.246 3.974 4.402 . 0 0 "[ . 1 . 2]" 1
894 1 61 VAL MG1 1 62 ALA H . . 4.420 3.634 3.524 3.734 . 0 0 "[ . 1 . 2]" 1
895 1 61 VAL MG1 1 62 ALA HA 5.160 . 5.160 3.809 3.665 3.911 . 0 0 "[ . 1 . 2]" 1
896 1 61 VAL MG1 1 62 ALA MB 4.480 . 4.480 4.448 4.356 4.534 0.054 15 0 "[ . 1 . 2]" 1
897 1 61 VAL MG1 1 65 LEU HG 3.940 . 3.940 3.863 2.881 4.057 0.117 2 0 "[ . 1 . 2]" 1
898 1 61 VAL MG2 1 62 ALA H . . 4.530 3.747 3.610 3.908 . 0 0 "[ . 1 . 2]" 1
899 1 62 ALA H 1 62 ALA MB . . 3.560 2.277 2.259 2.299 . 0 0 "[ . 1 . 2]" 1
900 1 62 ALA H 1 63 LYS H . . 4.260 2.800 2.725 2.892 . 0 0 "[ . 1 . 2]" 1
901 1 62 ALA HA 1 63 LYS H 5.110 . 5.110 3.547 3.523 3.574 . 0 0 "[ . 1 . 2]" 1
902 1 62 ALA HA 1 65 LEU H 5.240 . 5.240 3.465 3.310 3.630 . 0 0 "[ . 1 . 2]" 1
903 1 62 ALA HA 1 65 LEU HB2 . . 4.700 2.766 2.560 2.982 . 0 0 "[ . 1 . 2]" 1
904 1 62 ALA HA 1 65 LEU HB3 5.460 . 5.460 4.410 4.128 4.644 . 0 0 "[ . 1 . 2]" 1
905 1 62 ALA HA 1 65 LEU HG . . 4.150 4.196 3.401 4.340 0.190 14 0 "[ . 1 . 2]" 1
906 1 62 ALA MB 1 63 LYS H 4.120 . 4.120 2.714 2.593 2.832 . 0 0 "[ . 1 . 2]" 1
907 1 62 ALA MB 1 63 LYS QB 4.910 . 4.910 4.211 3.921 4.660 . 0 0 "[ . 1 . 2]" 1
908 1 62 ALA MB 1 64 VAL H 5.240 . 5.240 4.683 4.568 4.783 . 0 0 "[ . 1 . 2]" 1
909 1 62 ALA MB 1 65 LEU HB2 5.370 . 5.370 4.153 4.015 4.340 . 0 0 "[ . 1 . 2]" 1
910 1 62 ALA MB 1 66 HIS HB3 4.910 . 4.910 5.006 4.856 5.076 0.166 18 0 "[ . 1 . 2]" 1
911 1 62 ALA MB 1 66 HIS HD2 4.940 . 4.940 5.065 4.982 5.208 0.268 3 0 "[ . 1 . 2]" 1
912 1 63 LYS H 1 63 LYS QB 3.620 . 3.620 2.302 2.208 2.541 . 0 0 "[ . 1 . 2]" 1
913 1 63 LYS H 1 63 LYS HG2 4.880 . 4.880 4.169 3.369 4.540 . 0 0 "[ . 1 . 2]" 1
914 1 63 LYS H 1 63 LYS HG3 5.100 . 5.100 3.872 2.250 4.552 . 0 0 "[ . 1 . 2]" 1
915 1 63 LYS H 1 64 VAL H . . 4.150 2.765 2.696 2.901 . 0 0 "[ . 1 . 2]" 1
916 1 63 LYS HA 1 64 VAL H 5.370 . 5.370 3.565 3.538 3.601 . 0 0 "[ . 1 . 2]" 1
917 1 63 LYS HA 1 64 VAL MG2 6.000 . 6.000 5.017 4.932 5.101 . 0 0 "[ . 1 . 2]" 1
918 1 63 LYS HA 1 66 HIS H 4.800 . 4.800 3.455 3.158 3.920 . 0 0 "[ . 1 . 2]" 1
919 1 63 LYS HA 1 66 HIS HB2 4.270 . 4.270 2.996 2.668 3.637 . 0 0 "[ . 1 . 2]" 1
920 1 63 LYS HA 1 66 HIS HB3 4.440 . 4.440 2.477 2.147 3.002 . 0 0 "[ . 1 . 2]" 1
921 1 63 LYS QB 1 64 VAL H 4.160 . 4.160 2.627 2.408 2.843 . 0 0 "[ . 1 . 2]" 1
922 1 63 LYS QB 1 64 VAL HA 5.870 . 5.870 4.130 3.818 4.346 . 0 0 "[ . 1 . 2]" 1
923 1 63 LYS QD 1 64 VAL H 5.130 . 5.130 4.666 4.210 5.158 0.028 9 0 "[ . 1 . 2]" 1
924 1 64 VAL H 1 64 VAL HB 4.000 . 4.000 2.616 2.552 2.723 . 0 0 "[ . 1 . 2]" 1
925 1 64 VAL H 1 65 LEU H 4.040 . 4.040 2.759 2.687 2.892 . 0 0 "[ . 1 . 2]" 1
926 1 64 VAL HA 1 67 THR H . . 5.030 3.694 3.477 3.842 . 0 0 "[ . 1 . 2]" 1
927 1 64 VAL HA 1 67 THR MG 4.360 . 4.360 2.758 2.428 3.015 . 0 0 "[ . 1 . 2]" 1
928 1 64 VAL HA 1 68 ILE MD 5.260 . 5.260 4.431 3.998 4.722 . 0 0 "[ . 1 . 2]" 1
929 1 64 VAL HA 1 93 LYS QD 5.200 . 5.200 4.286 3.410 5.030 . 0 0 "[ . 1 . 2]" 1
930 1 64 VAL HB 1 65 LEU H 4.480 . 4.480 2.511 2.351 2.669 . 0 0 "[ . 1 . 2]" 1
931 1 64 VAL MG1 1 65 LEU H 4.550 . 4.550 3.440 3.199 3.594 . 0 0 "[ . 1 . 2]" 1
932 1 64 VAL MG1 1 67 THR MG 5.180 . 5.180 4.058 3.622 4.322 . 0 0 "[ . 1 . 2]" 1
933 1 64 VAL MG1 1 68 ILE H 5.320 . 5.320 4.932 4.658 5.246 . 0 0 "[ . 1 . 2]" 1
934 1 64 VAL MG1 1 68 ILE MD 3.050 . 3.050 3.102 2.630 3.300 0.250 2 0 "[ . 1 . 2]" 1
935 1 64 VAL MG1 1 93 LYS HA 4.910 . 4.910 3.534 2.882 4.316 . 0 0 "[ . 1 . 2]" 1
936 1 64 VAL MG1 1 93 LYS HB3 4.790 . 4.790 2.771 2.046 3.688 . 0 0 "[ . 1 . 2]" 1
937 1 64 VAL MG1 1 93 LYS QD 3.840 . 3.840 2.658 1.998 3.941 0.101 14 0 "[ . 1 . 2]" 1
938 1 64 VAL MG1 1 96 MET HB3 4.550 . 4.550 3.454 2.829 4.168 . 0 0 "[ . 1 . 2]" 1
939 1 64 VAL MG1 1 96 MET HG3 5.170 . 5.170 3.892 2.595 4.854 . 0 0 "[ . 1 . 2]" 1
940 1 64 VAL MG1 1 97 VAL H 4.970 . 4.970 4.336 3.424 4.799 . 0 0 "[ . 1 . 2]" 1
941 1 64 VAL MG1 1 97 VAL HA 6.000 . 6.000 4.496 3.780 5.105 . 0 0 "[ . 1 . 2]" 1
942 1 65 LEU H 1 65 LEU MD1 4.830 . 4.830 3.698 3.544 3.901 . 0 0 "[ . 1 . 2]" 1
943 1 65 LEU H 1 65 LEU HG . . 4.480 3.887 2.303 4.050 . 0 0 "[ . 1 . 2]" 1
944 1 65 LEU H 1 66 HIS H . . 4.710 2.568 2.495 2.682 . 0 0 "[ . 1 . 2]" 1
945 1 65 LEU H 1 67 THR H 5.280 . 5.280 4.141 4.043 4.243 . 0 0 "[ . 1 . 2]" 1
946 1 65 LEU HA 1 65 LEU MD2 3.710 . 3.710 2.745 2.011 2.956 . 0 0 "[ . 1 . 2]" 1
947 1 65 LEU HA 1 65 LEU HG 4.290 . 4.290 3.753 3.267 3.800 . 0 0 "[ . 1 . 2]" 1
948 1 65 LEU HA 1 66 HIS HA 5.510 . 5.510 4.855 4.810 4.896 . 0 0 "[ . 1 . 2]" 1
949 1 65 LEU HA 1 67 THR H 4.710 . 4.710 4.024 3.840 4.143 . 0 0 "[ . 1 . 2]" 1
950 1 65 LEU HA 1 68 ILE H 5.030 . 5.030 3.406 3.220 3.692 . 0 0 "[ . 1 . 2]" 1
951 1 65 LEU HA 1 68 ILE HB 4.470 . 4.470 3.345 2.974 3.921 . 0 0 "[ . 1 . 2]" 1
952 1 65 LEU HA 1 68 ILE MD 3.950 . 3.950 3.186 1.827 4.033 0.083 14 0 "[ . 1 . 2]" 1
953 1 65 LEU HA 1 68 ILE MG 5.680 . 5.680 4.528 4.179 5.159 . 0 0 "[ . 1 . 2]" 1
954 1 65 LEU HB3 1 66 HIS H 5.250 . 5.250 3.763 3.654 3.979 . 0 0 "[ . 1 . 2]" 1
955 1 65 LEU HB3 1 66 HIS HA 5.410 . 5.410 4.472 4.360 4.725 . 0 0 "[ . 1 . 2]" 1
956 1 65 LEU MD2 1 67 THR H 5.030 . 5.030 5.306 5.253 5.352 0.322 6 0 "[ . 1 . 2]" 1
957 1 66 HIS H 1 66 HIS HB2 . . 4.070 2.453 2.379 2.569 . 0 0 "[ . 1 . 2]" 1
958 1 66 HIS H 1 66 HIS HB3 4.020 . 4.020 2.617 2.567 2.717 . 0 0 "[ . 1 . 2]" 1
959 1 66 HIS H 1 66 HIS HD2 5.240 . 5.240 5.000 4.849 5.143 . 0 0 "[ . 1 . 2]" 1
960 1 66 HIS H 1 67 THR H 4.390 . 4.390 2.628 2.541 2.690 . 0 0 "[ . 1 . 2]" 1
961 1 66 HIS HA 1 66 HIS HD2 4.190 . 4.190 3.275 3.021 3.419 . 0 0 "[ . 1 . 2]" 1
962 1 66 HIS HA 1 67 THR H 5.210 . 5.210 3.542 3.528 3.556 . 0 0 "[ . 1 . 2]" 1
963 1 66 HIS HA 1 68 ILE H 5.250 . 5.250 4.225 3.891 4.559 . 0 0 "[ . 1 . 2]" 1
964 1 66 HIS HA 1 69 MET H . . 4.970 3.373 3.165 3.599 . 0 0 "[ . 1 . 2]" 1
965 1 66 HIS HA 1 69 MET HB2 4.270 . 4.270 2.767 2.450 3.254 . 0 0 "[ . 1 . 2]" 1
966 1 66 HIS HA 1 69 MET HB3 5.560 . 5.560 4.144 3.910 4.432 . 0 0 "[ . 1 . 2]" 1
967 1 66 HIS HA 1 69 MET ME 5.200 . 5.200 4.464 4.286 4.612 . 0 0 "[ . 1 . 2]" 1
968 1 66 HIS HB2 1 67 THR H 4.400 . 4.400 4.052 3.993 4.122 . 0 0 "[ . 1 . 2]" 1
969 1 66 HIS HB2 1 67 THR MG 5.390 . 5.390 4.989 4.861 5.196 . 0 0 "[ . 1 . 2]" 1
970 1 66 HIS HB3 1 67 THR H . . 4.960 3.003 2.938 3.105 . 0 0 "[ . 1 . 2]" 1
971 1 66 HIS HD2 1 69 MET HB2 4.710 . 4.710 4.598 4.313 4.799 0.089 18 0 "[ . 1 . 2]" 1
972 1 66 HIS HD2 1 69 MET ME 4.700 . 4.700 4.713 4.229 4.826 0.126 3 0 "[ . 1 . 2]" 1
973 1 67 THR H 1 67 THR HB . . 3.920 3.750 3.732 3.776 . 0 0 "[ . 1 . 2]" 1
974 1 67 THR H 1 67 THR MG . . 3.880 2.210 2.108 2.294 . 0 0 "[ . 1 . 2]" 1
975 1 67 THR H 1 68 ILE MD 4.630 . 4.630 3.907 3.233 4.387 . 0 0 "[ . 1 . 2]" 1
976 1 67 THR HA 1 67 THR MG . . 3.730 2.503 2.459 2.548 . 0 0 "[ . 1 . 2]" 1
977 1 67 THR HA 1 70 ASN H 4.970 . 4.970 3.566 3.346 3.834 . 0 0 "[ . 1 . 2]" 1
978 1 67 THR HA 1 70 ASN QB . . 3.970 2.835 2.604 3.136 . 0 0 "[ . 1 . 2]" 1
979 1 67 THR HA 1 71 LEU H 5.470 . 5.470 4.202 3.979 4.346 . 0 0 "[ . 1 . 2]" 1
980 1 67 THR HB 1 68 ILE H 4.970 . 4.970 3.973 3.745 4.184 . 0 0 "[ . 1 . 2]" 1
981 1 67 THR MG 1 68 ILE HA 5.710 . 5.710 5.466 5.397 5.543 . 0 0 "[ . 1 . 2]" 1
982 1 67 THR MG 1 68 ILE MD 3.900 . 3.900 3.990 3.717 4.135 0.235 10 0 "[ . 1 . 2]" 1
983 1 67 THR MG 1 70 ASN QB 5.140 . 5.140 4.505 4.287 4.805 . 0 0 "[ . 1 . 2]" 1
984 1 67 THR MG 1 93 LYS QD 4.940 . 4.940 4.304 3.331 4.965 0.025 12 0 "[ . 1 . 2]" 1
985 1 68 ILE H 1 68 ILE HB 4.110 . 4.110 2.703 2.554 2.838 . 0 0 "[ . 1 . 2]" 1
986 1 68 ILE H 1 68 ILE MD 4.470 . 4.470 2.398 1.689 2.890 . 0 0 "[ . 1 . 2]" 1
987 1 68 ILE H 1 69 MET H 4.420 . 4.420 2.526 2.276 2.698 . 0 0 "[ . 1 . 2]" 1
988 1 68 ILE H 1 69 MET HG2 4.310 . 4.310 4.370 4.140 4.676 0.366 10 0 "[ . 1 . 2]" 1
989 1 68 ILE HA 1 68 ILE MD 3.690 . 3.690 2.619 2.174 3.430 . 0 0 "[ . 1 . 2]" 1
990 1 68 ILE HA 1 68 ILE HG13 4.190 . 4.190 3.391 2.484 3.937 . 0 0 "[ . 1 . 2]" 1
991 1 68 ILE HA 1 68 ILE MG . . 3.550 2.417 2.343 2.540 . 0 0 "[ . 1 . 2]" 1
992 1 68 ILE HA 1 71 LEU H 5.120 . 5.120 3.331 3.123 3.628 . 0 0 "[ . 1 . 2]" 1
993 1 68 ILE HA 1 71 LEU HB2 4.720 . 4.720 2.764 2.423 2.981 . 0 0 "[ . 1 . 2]" 1
994 1 68 ILE HA 1 71 LEU HG 5.440 . 5.440 4.860 4.575 5.089 . 0 0 "[ . 1 . 2]" 1
995 1 68 ILE HB 1 69 MET H 3.880 . 3.880 2.703 2.546 2.890 . 0 0 "[ . 1 . 2]" 1
996 1 68 ILE HB 1 69 MET HG2 3.910 . 3.910 3.662 3.316 3.868 . 0 0 "[ . 1 . 2]" 1
997 1 68 ILE MD 1 90 VAL HA 4.350 . 4.350 3.175 2.094 4.465 0.115 8 0 "[ . 1 . 2]" 1
998 1 68 ILE MD 1 93 LYS HA 5.150 . 5.150 4.280 3.966 4.561 . 0 0 "[ . 1 . 2]" 1
999 1 68 ILE MD 1 93 LYS HB2 . . 3.430 2.441 2.126 2.978 . 0 0 "[ . 1 . 2]" 1
1000 1 68 ILE MD 1 93 LYS HB3 4.030 . 4.030 2.101 1.745 2.473 . 0 0 "[ . 1 . 2]" 1
1001 1 68 ILE MD 1 93 LYS QG 6.000 . 6.000 2.493 1.874 3.436 . 0 0 "[ . 1 . 2]" 1
1002 1 68 ILE MD 1 94 LEU H 5.710 . 5.710 4.354 3.799 4.947 . 0 0 "[ . 1 . 2]" 1
1003 1 68 ILE HG12 1 93 LYS HB3 5.310 . 5.310 3.840 3.013 4.294 . 0 0 "[ . 1 . 2]" 1
1004 1 68 ILE MG 1 69 MET H 5.070 . 5.070 3.701 3.432 3.968 . 0 0 "[ . 1 . 2]" 1
1005 1 68 ILE MG 1 71 LEU HB2 4.690 . 4.690 4.415 4.063 4.692 0.002 20 0 "[ . 1 . 2]" 1
1006 1 68 ILE MG 1 71 LEU HB3 5.230 . 5.230 3.431 3.257 3.628 . 0 0 "[ . 1 . 2]" 1
1007 1 68 ILE MG 1 72 VAL H . . 4.990 3.735 3.505 3.982 . 0 0 "[ . 1 . 2]" 1
1008 1 68 ILE MG 1 72 VAL MG2 3.900 . 3.900 2.217 2.058 2.484 . 0 0 "[ . 1 . 2]" 1
1009 1 68 ILE MG 1 90 VAL HA 5.220 . 5.220 3.484 2.966 4.007 . 0 0 "[ . 1 . 2]" 1
1010 1 68 ILE MG 1 93 LYS HB2 4.790 . 4.790 4.467 3.801 4.886 0.096 13 0 "[ . 1 . 2]" 1
1011 1 69 MET H 1 69 MET ME 5.570 . 5.570 4.678 4.534 4.769 . 0 0 "[ . 1 . 2]" 1
1012 1 69 MET H 1 69 MET HG3 4.260 . 4.260 3.140 2.153 3.542 . 0 0 "[ . 1 . 2]" 1
1013 1 69 MET H 1 70 ASN H 4.350 . 4.350 2.829 2.677 2.925 . 0 0 "[ . 1 . 2]" 1
1014 1 69 MET HA 1 69 MET ME 4.820 . 4.820 3.449 3.155 3.815 . 0 0 "[ . 1 . 2]" 1
1015 1 69 MET HA 1 69 MET HG2 . . 3.970 2.850 2.609 3.006 . 0 0 "[ . 1 . 2]" 1
1016 1 69 MET HA 1 70 ASN H . . 5.690 3.563 3.522 3.591 . 0 0 "[ . 1 . 2]" 1
1017 1 69 MET HA 1 70 ASN HA 6.000 . 6.000 4.883 4.834 4.942 . 0 0 "[ . 1 . 2]" 1
1018 1 69 MET HA 1 71 LEU H 5.820 . 5.820 4.490 4.323 4.644 . 0 0 "[ . 1 . 2]" 1
1019 1 69 MET HA 1 72 VAL H . . 4.710 4.131 3.790 4.324 . 0 0 "[ . 1 . 2]" 1
1020 1 69 MET HA 1 72 VAL HB 4.290 . 4.290 3.645 3.341 3.995 . 0 0 "[ . 1 . 2]" 1
1021 1 69 MET HB2 1 69 MET ME . . 4.050 3.342 3.143 3.436 . 0 0 "[ . 1 . 2]" 1
1022 1 69 MET HB2 1 70 ASN H 4.540 . 4.540 2.376 2.140 2.636 . 0 0 "[ . 1 . 2]" 1
1023 1 69 MET HB3 1 69 MET ME . . 3.650 2.014 1.871 2.262 . 0 0 "[ . 1 . 2]" 1
1024 1 69 MET HB3 1 70 ASN H 4.570 . 4.570 3.477 3.301 3.757 . 0 0 "[ . 1 . 2]" 1
1025 1 69 MET HB3 1 70 ASN QB 5.770 . 5.770 4.833 4.551 5.222 . 0 0 "[ . 1 . 2]" 1
1026 1 69 MET HG2 1 70 ASN H 5.190 . 5.190 4.362 4.060 4.702 . 0 0 "[ . 1 . 2]" 1
1027 1 69 MET HG3 1 70 ASN QB 5.670 . 5.670 5.759 5.454 6.065 0.395 11 0 "[ . 1 . 2]" 1
1028 1 70 ASN H 1 70 ASN QB . . 3.660 2.222 2.169 2.276 . 0 0 "[ . 1 . 2]" 1
1029 1 70 ASN H 1 71 LEU H . . 4.320 2.646 2.461 2.760 . 0 0 "[ . 1 . 2]" 1
1030 1 70 ASN HA 1 70 ASN HD21 4.430 . 4.430 2.766 1.937 4.505 0.075 14 0 "[ . 1 . 2]" 1
1031 1 70 ASN HA 1 71 LEU H 5.260 . 5.260 3.516 3.466 3.552 . 0 0 "[ . 1 . 2]" 1
1032 1 70 ASN HA 1 73 ASP H 4.900 . 4.900 3.959 3.609 4.194 . 0 0 "[ . 1 . 2]" 1
1033 1 70 ASN HA 1 73 ASP HB2 4.180 . 4.180 3.610 2.436 4.104 . 0 0 "[ . 1 . 2]" 1
1034 1 70 ASN HA 1 73 ASP HB3 4.280 . 4.280 2.913 2.403 3.884 . 0 0 "[ . 1 . 2]" 1
1035 1 70 ASN QB 1 71 LEU H 4.220 . 4.220 2.557 2.339 2.729 . 0 0 "[ . 1 . 2]" 1
1036 1 70 ASN QB 1 71 LEU HB2 5.570 . 5.570 3.835 3.685 3.959 . 0 0 "[ . 1 . 2]" 1
1037 1 70 ASN QB 1 71 LEU HG 5.390 . 5.390 5.559 5.446 5.692 0.302 18 0 "[ . 1 . 2]" 1
1038 1 71 LEU H 1 71 LEU HB2 4.260 . 4.260 2.235 2.138 2.320 . 0 0 "[ . 1 . 2]" 1
1039 1 71 LEU H 1 71 LEU HB3 4.070 . 4.070 2.662 2.533 2.801 . 0 0 "[ . 1 . 2]" 1
1040 1 71 LEU H 1 71 LEU MD2 4.990 . 4.990 4.315 4.255 4.365 . 0 0 "[ . 1 . 2]" 1
1041 1 71 LEU H 1 71 LEU HG 4.490 . 4.490 4.329 4.225 4.403 . 0 0 "[ . 1 . 2]" 1
1042 1 71 LEU H 1 72 VAL H 4.040 . 4.040 2.813 2.694 2.962 . 0 0 "[ . 1 . 2]" 1
1043 1 71 LEU H 1 72 VAL HB 5.930 . 5.930 5.004 4.771 5.119 . 0 0 "[ . 1 . 2]" 1
1044 1 71 LEU H 1 72 VAL MG2 4.270 . 4.270 4.218 4.080 4.313 0.043 8 0 "[ . 1 . 2]" 1
1045 1 71 LEU HA 1 71 LEU MD2 3.710 . 3.710 2.962 2.763 3.149 . 0 0 "[ . 1 . 2]" 1
1046 1 71 LEU HA 1 72 VAL H 5.000 . 5.000 3.563 3.544 3.588 . 0 0 "[ . 1 . 2]" 1
1047 1 71 LEU HA 1 75 MET ME 5.210 . 5.210 5.063 4.633 5.311 0.101 8 0 "[ . 1 . 2]" 1
1048 1 71 LEU HB2 1 72 VAL H 4.530 . 4.530 3.528 3.413 3.614 . 0 0 "[ . 1 . 2]" 1
1049 1 71 LEU HB2 1 90 VAL MG2 4.730 . 4.730 4.469 4.212 4.776 0.046 18 0 "[ . 1 . 2]" 1
1050 1 71 LEU HB3 1 72 VAL H . . 4.350 2.240 2.145 2.361 . 0 0 "[ . 1 . 2]" 1
1051 1 71 LEU HB3 1 72 VAL MG1 6.000 . 6.000 5.204 5.033 5.298 . 0 0 "[ . 1 . 2]" 1
1052 1 71 LEU HB3 1 72 VAL MG2 4.860 . 4.860 2.737 2.508 2.905 . 0 0 "[ . 1 . 2]" 1
1053 1 71 LEU MD2 1 72 VAL H 5.180 . 5.180 3.303 3.140 3.498 . 0 0 "[ . 1 . 2]" 1
1054 1 71 LEU MD2 1 72 VAL HA 4.500 . 4.500 3.170 2.946 3.310 . 0 0 "[ . 1 . 2]" 1
1055 1 71 LEU MD2 1 72 VAL MG1 4.290 . 4.290 4.447 4.321 4.516 0.226 8 0 "[ . 1 . 2]" 1
1056 1 71 LEU MD2 1 75 MET ME 3.330 . 3.330 1.991 1.913 2.151 . 0 0 "[ . 1 . 2]" 1
1057 1 71 LEU MD2 1 87 ILE QG 5.120 . 5.120 4.904 4.244 5.254 0.134 3 0 "[ . 1 . 2]" 1
1058 1 71 LEU HG 1 90 VAL MG2 . . 4.760 4.178 3.943 4.607 . 0 0 "[ . 1 . 2]" 1
1059 1 72 VAL H 1 72 VAL HB 3.890 . 3.890 2.556 2.492 2.628 . 0 0 "[ . 1 . 2]" 1
1060 1 72 VAL H 1 72 VAL MG2 . . 3.600 2.075 2.008 2.190 . 0 0 "[ . 1 . 2]" 1
1061 1 72 VAL H 1 73 ASP H 4.170 . 4.170 2.683 2.603 2.772 . 0 0 "[ . 1 . 2]" 1
1062 1 72 VAL H 1 75 MET ME 4.920 . 4.920 4.778 3.968 5.129 0.209 7 0 "[ . 1 . 2]" 1
1063 1 72 VAL HA 1 72 VAL MG2 . . 3.710 2.455 2.422 2.512 . 0 0 "[ . 1 . 2]" 1
1064 1 72 VAL HA 1 73 ASP H 4.970 . 4.970 3.560 3.530 3.590 . 0 0 "[ . 1 . 2]" 1
1065 1 72 VAL HA 1 75 MET H . . 4.520 3.238 2.926 3.693 . 0 0 "[ . 1 . 2]" 1
1066 1 72 VAL HA 1 75 MET ME 3.930 . 3.930 3.318 2.062 3.953 0.023 15 0 "[ . 1 . 2]" 1
1067 1 72 VAL HA 1 75 MET HG3 5.000 . 5.000 2.906 2.289 3.933 . 0 0 "[ . 1 . 2]" 1
1068 1 72 VAL HB 1 73 ASP H 4.500 . 4.500 2.780 2.582 2.990 . 0 0 "[ . 1 . 2]" 1
1069 1 72 VAL HB 1 75 MET ME 6.000 . 6.000 5.566 4.476 6.027 0.027 7 0 "[ . 1 . 2]" 1
1070 1 72 VAL MG1 1 72 VAL MG2 3.110 . 3.110 2.130 2.121 2.139 . 0 0 "[ . 1 . 2]" 1
1071 1 72 VAL MG1 1 73 ASP H 4.990 . 4.990 3.611 3.418 3.758 . 0 0 "[ . 1 . 2]" 1
1072 1 72 VAL MG1 1 73 ASP HA 5.080 . 5.080 3.751 3.492 3.941 . 0 0 "[ . 1 . 2]" 1
1073 1 72 VAL MG1 1 75 MET H 4.880 . 4.880 4.463 4.212 4.905 0.025 2 0 "[ . 1 . 2]" 1
1074 1 72 VAL MG1 1 76 LEU H 4.320 . 4.320 4.107 3.841 4.396 0.076 18 0 "[ . 1 . 2]" 1
1075 1 72 VAL MG2 1 73 ASP H 5.050 . 5.050 3.920 3.783 4.003 . 0 0 "[ . 1 . 2]" 1
1076 1 73 ASP H 1 73 ASP HB2 . . 3.870 2.458 2.372 2.587 . 0 0 "[ . 1 . 2]" 1
1077 1 73 ASP H 1 73 ASP HB3 4.000 . 4.000 2.644 2.454 3.603 . 0 0 "[ . 1 . 2]" 1
1078 1 73 ASP H 1 74 LYS H 4.290 . 4.290 2.764 2.680 2.851 . 0 0 "[ . 1 . 2]" 1
1079 1 73 ASP HA 1 76 LEU H 5.090 . 5.090 3.741 3.528 4.066 . 0 0 "[ . 1 . 2]" 1
1080 1 73 ASP HA 1 76 LEU HB2 . . 4.110 3.070 2.444 3.470 . 0 0 "[ . 1 . 2]" 1
1081 1 73 ASP HA 1 76 LEU HB3 5.040 . 5.040 4.170 2.984 5.029 . 0 0 "[ . 1 . 2]" 1
1082 1 73 ASP HB2 1 74 LYS H . . 4.580 3.869 2.789 4.143 . 0 0 "[ . 1 . 2]" 1
1083 1 73 ASP HB3 1 74 LYS H . . 4.300 2.753 2.558 3.468 . 0 0 "[ . 1 . 2]" 1
1084 1 74 LYS H 1 74 LYS HB2 4.120 . 4.120 2.321 2.154 2.424 . 0 0 "[ . 1 . 2]" 1
1085 1 74 LYS H 1 74 LYS HB3 4.210 . 4.210 3.513 2.633 3.634 . 0 0 "[ . 1 . 2]" 1
1086 1 74 LYS H 1 75 MET H 4.320 . 4.320 2.616 2.517 2.735 . 0 0 "[ . 1 . 2]" 1
1087 1 74 LYS H 1 75 MET HG3 4.360 . 4.360 4.412 4.337 4.472 0.112 11 0 "[ . 1 . 2]" 1
1088 1 74 LYS HA 1 74 LYS QD . . 3.860 3.593 1.975 4.208 0.348 18 0 "[ . 1 . 2]" 1
1089 1 74 LYS HA 1 74 LYS QE 4.580 . 4.580 4.186 2.163 4.761 0.181 20 0 "[ . 1 . 2]" 1
1090 1 74 LYS HA 1 75 MET H 5.040 . 5.040 3.549 3.516 3.595 . 0 0 "[ . 1 . 2]" 1
1091 1 74 LYS HA 1 80 ILE MD 4.630 . 4.630 4.306 2.660 4.795 0.165 6 0 "[ . 1 . 2]" 1
1092 1 74 LYS HA 1 80 ILE MG 5.220 . 5.220 4.394 3.860 5.316 0.096 6 0 "[ . 1 . 2]" 1
1093 1 74 LYS HB2 1 75 MET H 4.820 . 4.820 2.980 2.627 3.933 . 0 0 "[ . 1 . 2]" 1
1094 1 74 LYS HB2 1 80 ILE MG 4.590 . 4.590 3.403 2.815 4.386 . 0 0 "[ . 1 . 2]" 1
1095 1 74 LYS HB3 1 75 MET H 5.000 . 5.000 3.533 2.849 3.822 . 0 0 "[ . 1 . 2]" 1
1096 1 74 LYS HB3 1 80 ILE MG 5.440 . 5.440 2.420 1.650 3.601 . 0 0 "[ . 1 . 2]" 1
1097 1 74 LYS QG 1 80 ILE MD 5.240 . 5.240 3.262 2.221 4.184 . 0 0 "[ . 1 . 2]" 1
1098 1 74 LYS QG 1 80 ILE HG12 4.420 . 4.420 4.296 3.310 4.739 0.319 17 0 "[ . 1 . 2]" 1
1099 1 74 LYS QG 1 80 ILE HG13 4.720 . 4.720 3.178 2.089 4.744 0.024 1 0 "[ . 1 . 2]" 1
1100 1 74 LYS QG 1 80 ILE MG 5.870 . 5.870 3.884 1.926 5.160 . 0 0 "[ . 1 . 2]" 1
1101 1 75 MET H 1 75 MET HG2 4.400 . 4.400 3.513 3.172 3.683 . 0 0 "[ . 1 . 2]" 1
1102 1 75 MET H 1 75 MET HG3 4.740 . 4.740 2.376 2.292 2.493 . 0 0 "[ . 1 . 2]" 1
1103 1 75 MET H 1 76 LEU H . . 4.050 2.689 2.518 2.807 . 0 0 "[ . 1 . 2]" 1
1104 1 75 MET H 1 80 ILE MG 5.370 . 5.370 4.053 3.358 4.482 . 0 0 "[ . 1 . 2]" 1
1105 1 75 MET HA 1 75 MET ME 5.170 . 5.170 4.520 4.369 4.649 . 0 0 "[ . 1 . 2]" 1
1106 1 75 MET HA 1 76 LEU H 5.550 . 5.550 3.531 3.486 3.570 . 0 0 "[ . 1 . 2]" 1
1107 1 75 MET HA 1 80 ILE H 5.450 . 5.450 4.867 3.516 5.369 . 0 0 "[ . 1 . 2]" 1
1108 1 75 MET HA 1 80 ILE HG12 5.700 . 5.700 5.354 4.162 5.825 0.125 9 0 "[ . 1 . 2]" 1
1109 1 75 MET HA 1 80 ILE MG . . 4.540 3.198 2.450 3.866 . 0 0 "[ . 1 . 2]" 1
1110 1 75 MET HB2 1 75 MET ME 4.750 . 4.750 3.520 2.074 4.102 . 0 0 "[ . 1 . 2]" 1
1111 1 75 MET HB2 1 80 ILE MG 6.000 . 6.000 5.219 4.456 5.874 . 0 0 "[ . 1 . 2]" 1
1112 1 75 MET HB3 1 75 MET ME 4.140 . 4.140 3.454 2.482 3.937 . 0 0 "[ . 1 . 2]" 1
1113 1 75 MET HB3 1 76 LEU H 4.020 . 4.020 3.718 3.563 3.936 . 0 0 "[ . 1 . 2]" 1
1114 1 75 MET ME 1 75 MET HG3 3.720 . 3.720 2.713 2.493 2.866 . 0 0 "[ . 1 . 2]" 1
1115 1 75 MET ME 1 82 ILE HG12 3.970 . 3.970 3.619 2.336 4.074 0.104 12 0 "[ . 1 . 2]" 1
1116 1 75 MET ME 1 82 ILE HG13 3.800 . 3.800 3.144 1.910 3.893 0.093 14 0 "[ . 1 . 2]" 1
1117 1 75 MET ME 1 82 ILE MG 3.080 . 3.080 2.132 1.690 2.966 . 0 0 "[ . 1 . 2]" 1
1118 1 75 MET ME 1 83 THR H 4.990 . 4.990 4.198 3.542 4.943 . 0 0 "[ . 1 . 2]" 1
1119 1 75 MET ME 1 86 LEU HB3 5.010 . 5.010 3.681 2.960 4.964 . 0 0 "[ . 1 . 2]" 1
1120 1 75 MET ME 1 86 LEU HG 4.610 . 4.610 3.102 2.151 4.379 . 0 0 "[ . 1 . 2]" 1
1121 1 75 MET ME 1 87 ILE H 4.610 . 4.610 4.167 3.566 4.864 0.254 6 0 "[ . 1 . 2]" 1
1122 1 75 MET ME 1 87 ILE QG 3.720 . 3.720 2.979 2.603 3.536 . 0 0 "[ . 1 . 2]" 1
1123 1 75 MET HG3 1 80 ILE MG 4.450 . 4.450 3.930 3.037 4.483 0.033 20 0 "[ . 1 . 2]" 1
1124 1 76 LEU H 1 77 ASN H 4.170 . 4.170 2.879 2.740 3.033 . 0 0 "[ . 1 . 2]" 1
1125 1 76 LEU HA 1 77 ASN H 4.410 . 4.410 3.523 3.414 3.603 . 0 0 "[ . 1 . 2]" 1
1126 1 76 LEU HB2 1 77 ASN H 4.500 . 4.500 3.431 2.912 3.996 . 0 0 "[ . 1 . 2]" 1
1127 1 76 LEU HB2 1 77 ASN HA 6.000 . 6.000 5.365 4.897 5.901 . 0 0 "[ . 1 . 2]" 1
1128 1 76 LEU HB3 1 77 ASN H 4.880 . 4.880 3.117 2.369 3.808 . 0 0 "[ . 1 . 2]" 1
1129 1 76 LEU HB3 1 77 ASN QB 4.530 . 4.530 4.432 3.663 4.705 0.175 1 0 "[ . 1 . 2]" 1
1130 1 76 LEU QD 1 77 ASN HA 6.000 . 6.000 4.761 3.272 5.448 . 0 0 "[ . 1 . 2]" 1
1131 1 77 ASN H 1 77 ASN HD21 4.490 . 4.490 2.922 2.096 4.117 . 0 0 "[ . 1 . 2]" 1
1132 1 77 ASN H 1 77 ASN HD22 . . 5.290 3.435 2.840 5.450 0.160 7 0 "[ . 1 . 2]" 1
1133 1 77 ASN HA 1 78 SER H 4.520 . 4.520 2.213 2.062 2.482 . 0 0 "[ . 1 . 2]" 1
1134 1 77 ASN HA 1 78 SER HA 6.000 . 6.000 4.372 4.285 4.472 . 0 0 "[ . 1 . 2]" 1
1135 1 77 ASN HA 1 78 SER QB . . 4.520 4.271 3.951 4.587 0.067 14 0 "[ . 1 . 2]" 1
1136 1 77 ASN QB 1 78 SER QB 5.490 . 5.490 4.486 3.919 4.897 . 0 0 "[ . 1 . 2]" 1
1137 1 77 ASN QB 1 79 GLU H 5.410 . 5.410 2.699 2.036 3.900 . 0 0 "[ . 1 . 2]" 1
1138 1 77 ASN QB 1 79 GLU HB3 4.930 . 4.930 3.719 2.451 4.309 . 0 0 "[ . 1 . 2]" 1
1139 1 77 ASN QB 1 79 GLU HG2 4.300 . 4.300 2.387 1.872 4.468 0.168 1 0 "[ . 1 . 2]" 1
1140 1 77 ASN QB 1 80 ILE HG13 5.140 . 5.140 4.755 3.766 5.189 0.049 6 0 "[ . 1 . 2]" 1
1141 1 78 SER H 1 79 GLU H 4.480 . 4.480 2.839 2.534 3.838 . 0 0 "[ . 1 . 2]" 1
1142 1 78 SER HA 1 79 GLU H . . 4.400 3.271 2.336 3.462 . 0 0 "[ . 1 . 2]" 1
1143 1 78 SER HA 1 80 ILE H 4.290 . 4.290 3.760 3.412 4.110 . 0 0 "[ . 1 . 2]" 1
1144 1 78 SER QB 1 79 GLU H 4.980 . 4.980 3.396 3.118 4.072 . 0 0 "[ . 1 . 2]" 1
1145 1 79 GLU H 1 79 GLU HB3 4.260 . 4.260 2.776 2.209 3.561 . 0 0 "[ . 1 . 2]" 1
1146 1 79 GLU H 1 79 GLU HG2 4.460 . 4.460 2.429 1.951 4.219 . 0 0 "[ . 1 . 2]" 1
1147 1 79 GLU H 1 80 ILE H 4.130 . 4.130 2.461 1.788 2.722 . 0 0 "[ . 1 . 2]" 1
1148 1 79 GLU H 1 80 ILE HG13 5.260 . 5.260 5.355 4.381 5.525 0.265 1 0 "[ . 1 . 2]" 1
1149 1 79 GLU HA 1 80 ILE H 4.770 . 4.770 3.466 3.385 3.551 . 0 0 "[ . 1 . 2]" 1
1150 1 79 GLU HB2 1 80 ILE H 5.180 . 5.180 3.903 2.793 4.448 . 0 0 "[ . 1 . 2]" 1
1151 1 79 GLU HB3 1 80 ILE H 5.190 . 5.190 3.990 2.696 4.259 . 0 0 "[ . 1 . 2]" 1
1152 1 79 GLU HB3 1 80 ILE HG13 6.000 . 6.000 5.703 4.086 6.271 0.271 5 0 "[ . 1 . 2]" 1
1153 1 80 ILE H 1 80 ILE MD 5.160 . 5.160 3.722 1.916 4.138 . 0 0 "[ . 1 . 2]" 1
1154 1 80 ILE H 1 80 ILE HG12 4.950 . 4.950 2.727 2.367 4.054 . 0 0 "[ . 1 . 2]" 1
1155 1 80 ILE H 1 80 ILE HG13 4.580 . 4.580 3.732 2.673 4.041 . 0 0 "[ . 1 . 2]" 1
1156 1 80 ILE H 1 80 ILE MG 4.540 . 4.540 3.865 3.766 3.972 . 0 0 "[ . 1 . 2]" 1
1157 1 80 ILE HA 1 80 ILE MD 4.620 . 4.620 2.447 2.157 3.911 . 0 0 "[ . 1 . 2]" 1
1158 1 80 ILE HA 1 81 LYS H 3.880 . 3.880 2.884 2.153 3.589 . 0 0 "[ . 1 . 2]" 1
1159 1 80 ILE HA 1 81 LYS QB 5.560 . 5.560 4.360 3.991 4.701 . 0 0 "[ . 1 . 2]" 1
1160 1 80 ILE HB 1 80 ILE MD 3.660 . 3.660 3.191 2.335 3.286 . 0 0 "[ . 1 . 2]" 1
1161 1 80 ILE HB 1 81 LYS H 4.680 . 4.680 3.328 1.991 4.403 . 0 0 "[ . 1 . 2]" 1
1162 1 80 ILE MD 1 81 LYS H 5.350 . 5.350 4.383 3.705 5.464 0.114 17 0 "[ . 1 . 2]" 1
1163 1 80 ILE HG12 1 81 LYS H 5.410 . 5.410 4.639 3.871 5.200 . 0 0 "[ . 1 . 2]" 1
1164 1 80 ILE HG13 1 81 LYS H 5.580 . 5.580 5.118 4.267 5.660 0.080 6 0 "[ . 1 . 2]" 1
1165 1 80 ILE MG 1 81 LYS H 5.180 . 5.180 3.090 2.386 3.765 . 0 0 "[ . 1 . 2]" 1
1166 1 81 LYS H 1 81 LYS QB 3.860 . 3.860 2.770 2.288 3.397 . 0 0 "[ . 1 . 2]" 1
1167 1 81 LYS H 1 81 LYS HG2 5.200 . 5.200 4.216 2.967 4.946 . 0 0 "[ . 1 . 2]" 1
1168 1 81 LYS HA 1 81 LYS HG2 4.500 . 4.500 2.978 2.395 3.724 . 0 0 "[ . 1 . 2]" 1
1169 1 81 LYS HA 1 82 ILE H . . 3.660 2.383 2.150 3.104 . 0 0 "[ . 1 . 2]" 1
1170 1 81 LYS HA 1 82 ILE HB 4.830 . 4.830 4.764 4.442 5.049 0.219 11 0 "[ . 1 . 2]" 1
1171 1 81 LYS HA 1 82 ILE HG13 4.810 . 4.810 4.489 3.438 4.960 0.150 3 0 "[ . 1 . 2]" 1
1172 1 81 LYS QB 1 82 ILE H 4.070 . 4.070 3.023 1.851 3.700 . 0 0 "[ . 1 . 2]" 1
1173 1 81 LYS QB 1 83 THR HA 5.590 . 5.590 5.011 4.132 5.527 . 0 0 "[ . 1 . 2]" 1
1174 1 82 ILE H 1 82 ILE HB . . 4.280 2.647 2.475 3.631 . 0 0 "[ . 1 . 2]" 1
1175 1 82 ILE H 1 82 ILE MD 4.680 . 4.680 2.077 1.645 3.947 . 0 0 "[ . 1 . 2]" 1
1176 1 82 ILE H 1 82 ILE HG12 4.520 . 4.520 4.083 3.844 4.526 0.006 3 0 "[ . 1 . 2]" 1
1177 1 82 ILE H 1 82 ILE HG13 4.630 . 4.630 3.395 2.768 3.893 . 0 0 "[ . 1 . 2]" 1
1178 1 82 ILE H 1 83 THR HA 4.990 . 4.990 5.062 4.890 5.213 0.223 2 0 "[ . 1 . 2]" 1
1179 1 82 ILE HA 1 82 ILE HG13 4.330 . 4.330 2.574 2.423 3.025 . 0 0 "[ . 1 . 2]" 1
1180 1 82 ILE HA 1 83 THR H 4.040 . 4.040 2.178 2.133 2.232 . 0 0 "[ . 1 . 2]" 1
1181 1 82 ILE HA 1 83 THR HA 4.280 . 4.280 4.457 4.385 4.511 0.231 8 0 "[ . 1 . 2]" 1
1182 1 82 ILE HB 1 82 ILE MD 3.670 . 3.670 2.377 2.291 2.439 . 0 0 "[ . 1 . 2]" 1
1183 1 82 ILE MD 1 82 ILE MG . . 3.090 3.181 1.998 3.276 0.186 15 0 "[ . 1 . 2]" 1
1184 1 82 ILE MG 1 83 THR H . . 4.700 3.297 2.667 3.632 . 0 0 "[ . 1 . 2]" 1
1185 1 82 ILE MG 1 87 ILE QG 3.940 . 3.940 2.282 2.015 2.705 . 0 0 "[ . 1 . 2]" 1
1186 1 83 THR H 1 86 LEU H 5.410 . 5.410 4.429 3.776 4.940 . 0 0 "[ . 1 . 2]" 1
1187 1 83 THR H 1 86 LEU HB2 4.940 . 4.940 3.647 2.587 4.514 . 0 0 "[ . 1 . 2]" 1
1188 1 83 THR H 1 86 LEU HB3 4.760 . 4.760 2.955 2.385 3.370 . 0 0 "[ . 1 . 2]" 1
1189 1 83 THR H 1 86 LEU MD2 5.340 . 5.340 2.777 2.120 3.224 . 0 0 "[ . 1 . 2]" 1
1190 1 83 THR HA 1 86 LEU H 4.580 . 4.580 4.530 4.423 4.778 0.198 3 0 "[ . 1 . 2]" 1
1191 1 83 THR HA 1 86 LEU HB2 5.540 . 5.540 4.976 4.430 5.591 0.051 6 0 "[ . 1 . 2]" 1
1192 1 83 THR HB 1 86 LEU MD1 5.030 . 5.030 4.023 3.099 5.270 0.240 4 0 "[ . 1 . 2]" 1
1193 1 83 THR MG 1 86 LEU HA 5.950 . 5.950 4.678 4.093 5.937 . 0 0 "[ . 1 . 2]" 1
1194 1 85 ASP HA 1 86 LEU H 5.590 . 5.590 3.490 3.425 3.545 . 0 0 "[ . 1 . 2]" 1
1195 1 85 ASP HA 1 88 ASP H 4.420 . 4.420 3.232 2.901 3.568 . 0 0 "[ . 1 . 2]" 1
1196 1 85 ASP QB 1 86 LEU H . . 4.390 2.961 2.614 3.757 . 0 0 "[ . 1 . 2]" 1
1197 1 85 ASP QB 1 88 ASP H 4.390 . 4.390 4.575 4.433 4.677 0.287 17 0 "[ . 1 . 2]" 1
1198 1 86 LEU H 1 86 LEU HB2 4.100 . 4.100 2.544 2.356 2.826 . 0 0 "[ . 1 . 2]" 1
1199 1 86 LEU H 1 86 LEU MD1 5.110 . 5.110 4.174 3.974 4.430 . 0 0 "[ . 1 . 2]" 1
1200 1 86 LEU H 1 86 LEU HG 5.180 . 5.180 4.510 4.461 4.566 . 0 0 "[ . 1 . 2]" 1
1201 1 86 LEU H 1 87 ILE H 4.270 . 4.270 2.620 2.517 2.880 . 0 0 "[ . 1 . 2]" 1
1202 1 86 LEU H 1 87 ILE HB 5.360 . 5.360 4.829 4.661 5.259 . 0 0 "[ . 1 . 2]" 1
1203 1 86 LEU H 1 88 ASP H 4.780 . 4.780 3.922 3.676 4.310 . 0 0 "[ . 1 . 2]" 1
1204 1 86 LEU HA 1 86 LEU MD2 4.250 . 4.250 3.944 3.758 4.010 . 0 0 "[ . 1 . 2]" 1
1205 1 86 LEU HA 1 86 LEU HG 4.320 . 4.320 2.946 2.691 3.057 . 0 0 "[ . 1 . 2]" 1
1206 1 86 LEU HA 1 87 ILE H 5.230 . 5.230 3.549 3.521 3.591 . 0 0 "[ . 1 . 2]" 1
1207 1 86 LEU HA 1 88 ASP H 5.070 . 5.070 3.992 3.814 4.205 . 0 0 "[ . 1 . 2]" 1
1208 1 86 LEU HA 1 88 ASP HB2 5.560 . 5.560 5.317 4.650 5.801 0.241 15 0 "[ . 1 . 2]" 1
1209 1 86 LEU HA 1 89 LYS H . . 4.540 3.040 2.792 3.292 . 0 0 "[ . 1 . 2]" 1
1210 1 86 LEU HA 1 89 LYS HB2 . . 4.840 2.777 2.327 3.215 . 0 0 "[ . 1 . 2]" 1
1211 1 86 LEU HA 1 89 LYS QD 6.000 . 6.000 3.499 1.995 4.399 . 0 0 "[ . 1 . 2]" 1
1212 1 86 LEU HA 1 89 LYS QG 4.960 . 4.960 4.172 2.682 4.960 . 4 0 "[ . 1 . 2]" 1
1213 1 86 LEU HA 1 90 VAL MG2 5.530 . 5.530 4.544 4.254 4.746 . 0 0 "[ . 1 . 2]" 1
1214 1 86 LEU HB2 1 87 ILE H 5.030 . 5.030 3.942 3.719 4.087 . 0 0 "[ . 1 . 2]" 1
1215 1 86 LEU HB3 1 87 ILE H 5.010 . 5.010 2.739 2.659 2.852 . 0 0 "[ . 1 . 2]" 1
1216 1 86 LEU HB3 1 87 ILE HA 6.000 . 6.000 4.482 4.258 4.951 . 0 0 "[ . 1 . 2]" 1
1217 1 86 LEU MD2 1 87 ILE HA 4.760 . 4.760 4.781 2.930 5.017 0.257 11 0 "[ . 1 . 2]" 1
1218 1 86 LEU MD2 1 90 VAL MG2 4.940 . 4.940 4.061 2.944 4.382 . 0 0 "[ . 1 . 2]" 1
1219 1 86 LEU HG 1 88 ASP H 5.440 . 5.440 5.520 5.444 5.601 0.161 3 0 "[ . 1 . 2]" 1
1220 1 86 LEU HG 1 89 LYS H 4.510 . 4.510 4.673 4.507 4.811 0.301 19 0 "[ . 1 . 2]" 1
1221 1 86 LEU HG 1 89 LYS HB2 4.430 . 4.430 4.297 3.542 4.584 0.154 3 0 "[ . 1 . 2]" 1
1222 1 87 ILE H 1 87 ILE HB 3.810 . 3.810 2.649 2.545 2.743 . 0 0 "[ . 1 . 2]" 1
1223 1 87 ILE H 1 87 ILE MD 4.780 . 4.780 3.519 3.401 3.657 . 0 0 "[ . 1 . 2]" 1
1224 1 87 ILE H 1 87 ILE QG 4.630 . 4.630 1.956 1.823 2.078 . 0 0 "[ . 1 . 2]" 1
1225 1 87 ILE H 1 87 ILE MG 4.290 . 4.290 3.824 3.807 3.842 . 0 0 "[ . 1 . 2]" 1
1226 1 87 ILE H 1 88 ASP H . . 3.980 2.682 2.507 2.891 . 0 0 "[ . 1 . 2]" 1
1227 1 87 ILE H 1 90 VAL MG2 5.980 . 5.980 4.326 4.125 4.442 . 0 0 "[ . 1 . 2]" 1
1228 1 87 ILE HA 1 87 ILE MD 4.460 . 4.460 3.963 3.911 4.011 . 0 0 "[ . 1 . 2]" 1
1229 1 87 ILE HA 1 88 ASP H 5.170 . 5.170 3.542 3.501 3.589 . 0 0 "[ . 1 . 2]" 1
1230 1 87 ILE HA 1 88 ASP HA 5.590 . 5.590 4.882 4.829 4.929 . 0 0 "[ . 1 . 2]" 1
1231 1 87 ILE HA 1 90 VAL H . . 4.900 3.485 3.386 3.582 . 0 0 "[ . 1 . 2]" 1
1232 1 87 ILE HA 1 90 VAL HB . . 4.410 3.263 3.034 3.537 . 0 0 "[ . 1 . 2]" 1
1233 1 87 ILE HA 1 90 VAL MG2 4.010 . 4.010 2.467 2.323 2.562 . 0 0 "[ . 1 . 2]" 1
1234 1 87 ILE HB 1 88 ASP H 4.020 . 4.020 2.738 2.540 2.865 . 0 0 "[ . 1 . 2]" 1
1235 1 87 ILE HB 1 90 VAL MG2 4.890 . 4.890 5.014 4.873 5.085 0.195 10 0 "[ . 1 . 2]" 1
1236 1 87 ILE MG 1 88 ASP H 4.640 . 4.640 3.709 3.540 3.834 . 0 0 "[ . 1 . 2]" 1
1237 1 87 ILE MG 1 88 ASP HA 5.090 . 5.090 3.819 3.704 4.025 . 0 0 "[ . 1 . 2]" 1
1238 1 87 ILE MG 1 91 LYS H 4.980 . 4.980 4.194 3.958 4.646 . 0 0 "[ . 1 . 2]" 1
1239 1 88 ASP H 1 88 ASP HB2 3.810 . 3.810 2.481 2.335 2.596 . 0 0 "[ . 1 . 2]" 1
1240 1 88 ASP H 1 88 ASP HB3 . . 3.940 3.038 2.446 3.650 . 0 0 "[ . 1 . 2]" 1
1241 1 88 ASP H 1 89 LYS H 4.290 . 4.290 2.581 2.527 2.681 . 0 0 "[ . 1 . 2]" 1
1242 1 88 ASP H 1 89 LYS HB3 6.000 . 6.000 5.244 4.777 6.135 0.135 19 0 "[ . 1 . 2]" 1
1243 1 88 ASP HA 1 91 LYS H 5.140 . 5.140 3.285 3.110 3.575 . 0 0 "[ . 1 . 2]" 1
1244 1 88 ASP HA 1 91 LYS HB2 3.780 . 3.780 2.541 2.084 3.038 . 0 0 "[ . 1 . 2]" 1
1245 1 88 ASP HB2 1 89 LYS H . . 4.420 3.537 2.878 4.061 . 0 0 "[ . 1 . 2]" 1
1246 1 88 ASP HB3 1 89 LYS H . . 4.380 3.336 2.791 4.037 . 0 0 "[ . 1 . 2]" 1
1247 1 88 ASP HB3 1 91 LYS HB2 5.120 . 5.120 4.929 4.012 5.308 0.188 18 0 "[ . 1 . 2]" 1
1248 1 89 LYS H 1 89 LYS HB2 4.000 . 4.000 2.447 2.316 2.592 . 0 0 "[ . 1 . 2]" 1
1249 1 89 LYS H 1 89 LYS HB3 4.300 . 4.300 2.878 2.540 3.613 . 0 0 "[ . 1 . 2]" 1
1250 1 89 LYS H 1 90 VAL H . . 4.200 2.630 2.551 2.726 . 0 0 "[ . 1 . 2]" 1
1251 1 89 LYS HA 1 89 LYS QD 4.720 . 4.720 3.935 2.009 4.316 . 0 0 "[ . 1 . 2]" 1
1252 1 89 LYS HA 1 89 LYS QE 4.670 . 4.670 4.485 3.517 4.904 0.234 19 0 "[ . 1 . 2]" 1
1253 1 89 LYS HB2 1 90 VAL H 5.090 . 5.090 3.542 2.630 3.948 . 0 0 "[ . 1 . 2]" 1
1254 1 89 LYS QG 1 90 VAL H 6.000 . 6.000 3.964 3.542 4.580 . 0 0 "[ . 1 . 2]" 1
1255 1 90 VAL H 1 90 VAL HB 3.930 . 3.930 2.705 2.621 2.785 . 0 0 "[ . 1 . 2]" 1
1256 1 90 VAL H 1 90 VAL MG1 4.500 . 4.500 3.829 3.804 3.847 . 0 0 "[ . 1 . 2]" 1
1257 1 90 VAL H 1 90 VAL MG2 . . 3.650 1.940 1.885 2.035 . 0 0 "[ . 1 . 2]" 1
1258 1 90 VAL H 1 91 LYS H 4.240 . 4.240 2.691 2.514 2.811 . 0 0 "[ . 1 . 2]" 1
1259 1 90 VAL HA 1 90 VAL MG2 . . 3.550 2.548 2.488 2.613 . 0 0 "[ . 1 . 2]" 1
1260 1 90 VAL HA 1 92 LYS H 5.120 . 5.120 4.613 4.384 4.896 . 0 0 "[ . 1 . 2]" 1
1261 1 90 VAL HA 1 93 LYS H 5.200 . 5.200 3.853 3.434 4.197 . 0 0 "[ . 1 . 2]" 1
1262 1 90 VAL HA 1 93 LYS HB2 4.450 . 4.450 3.081 2.797 3.360 . 0 0 "[ . 1 . 2]" 1
1263 1 90 VAL HA 1 93 LYS HB3 4.690 . 4.690 4.626 4.284 4.834 0.144 12 0 "[ . 1 . 2]" 1
1264 1 90 VAL HB 1 91 LYS H . . 4.340 2.512 2.324 2.725 . 0 0 "[ . 1 . 2]" 1
1265 1 90 VAL MG1 1 91 LYS HA 4.720 . 4.720 3.775 3.449 4.042 . 0 0 "[ . 1 . 2]" 1
1266 1 90 VAL MG1 1 91 LYS QG 4.890 . 4.890 4.539 3.960 4.993 0.103 20 0 "[ . 1 . 2]" 1
1267 1 90 VAL MG1 1 94 LEU H 5.160 . 5.160 4.425 4.210 4.635 . 0 0 "[ . 1 . 2]" 1
1268 1 90 VAL MG2 1 91 LYS H 4.870 . 4.870 3.654 3.536 3.792 . 0 0 "[ . 1 . 2]" 1
1269 1 91 LYS H 1 91 LYS HB3 4.040 . 4.040 3.326 2.753 3.671 . 0 0 "[ . 1 . 2]" 1
1270 1 91 LYS H 1 91 LYS QG 4.340 . 4.340 3.047 2.099 3.946 . 0 0 "[ . 1 . 2]" 1
1271 1 91 LYS HA 1 92 LYS H 4.870 . 4.870 3.569 3.535 3.612 . 0 0 "[ . 1 . 2]" 1
1272 1 91 LYS HA 1 95 ASP H 6.000 . 6.000 4.300 4.024 4.671 . 0 0 "[ . 1 . 2]" 1
1273 1 91 LYS HB2 1 91 LYS QE 4.680 . 4.680 3.673 2.127 4.617 . 0 0 "[ . 1 . 2]" 1
1274 1 91 LYS HB2 1 92 LYS H 3.620 . 3.620 3.009 2.409 3.693 0.073 3 0 "[ . 1 . 2]" 1
1275 1 92 LYS H 1 92 LYS HB3 4.040 . 4.040 2.514 2.252 2.637 . 0 0 "[ . 1 . 2]" 1
1276 1 92 LYS H 1 92 LYS HG2 4.920 . 4.920 4.617 4.271 4.683 . 0 0 "[ . 1 . 2]" 1
1277 1 92 LYS H 1 92 LYS HG3 4.380 . 4.380 4.469 4.444 4.492 0.112 13 0 "[ . 1 . 2]" 1
1278 1 92 LYS H 1 93 LYS H 3.850 . 3.850 2.662 2.592 2.719 . 0 0 "[ . 1 . 2]" 1
1279 1 92 LYS H 1 95 ASP HB2 5.530 . 5.530 4.796 4.466 5.069 . 0 0 "[ . 1 . 2]" 1
1280 1 92 LYS HA 1 92 LYS HB3 2.910 . 2.910 3.029 3.011 3.035 0.125 17 0 "[ . 1 . 2]" 1
1281 1 92 LYS HA 1 92 LYS HG2 3.810 . 3.810 3.807 3.720 3.854 0.044 3 0 "[ . 1 . 2]" 1
1282 1 92 LYS HA 1 92 LYS HG3 3.620 . 3.620 3.050 2.758 3.191 . 0 0 "[ . 1 . 2]" 1
1283 1 92 LYS HA 1 93 LYS H 4.060 . 4.060 3.533 3.491 3.562 . 0 0 "[ . 1 . 2]" 1
1284 1 92 LYS HA 1 95 ASP H . . 4.190 3.370 3.085 3.605 . 0 0 "[ . 1 . 2]" 1
1285 1 92 LYS HA 1 95 ASP HB2 4.210 . 4.210 2.320 2.057 2.520 . 0 0 "[ . 1 . 2]" 1
1286 1 92 LYS HA 1 95 ASP HB3 3.980 . 3.980 3.662 2.657 3.994 0.014 4 0 "[ . 1 . 2]" 1
1287 1 92 LYS HB2 1 95 ASP HB2 . . 4.850 4.702 4.257 4.944 0.094 11 0 "[ . 1 . 2]" 1
1288 1 92 LYS HB3 1 93 LYS H 3.670 . 3.670 2.716 2.350 2.907 . 0 0 "[ . 1 . 2]" 1
1289 1 92 LYS QD 1 93 LYS H 5.150 . 5.150 4.809 4.685 5.011 . 0 0 "[ . 1 . 2]" 1
1290 1 92 LYS QD 1 95 ASP HB2 4.950 . 4.950 3.040 2.240 5.035 0.085 20 0 "[ . 1 . 2]" 1
1291 1 92 LYS HG3 1 93 LYS H 3.820 . 3.820 3.916 3.776 4.043 0.223 20 0 "[ . 1 . 2]" 1
1292 1 92 LYS HG3 1 93 LYS HA 4.210 . 4.210 4.019 3.793 4.295 0.085 20 0 "[ . 1 . 2]" 1
1293 1 92 LYS HG3 1 95 ASP HB2 4.760 . 4.760 4.168 3.725 4.878 0.118 6 0 "[ . 1 . 2]" 1
1294 1 92 LYS HG3 1 95 ASP HB3 5.120 . 5.120 5.037 4.081 5.312 0.192 11 0 "[ . 1 . 2]" 1
1295 1 93 LYS H 1 94 LEU H 4.340 . 4.340 2.719 2.507 2.878 . 0 0 "[ . 1 . 2]" 1
1296 1 93 LYS H 1 96 MET H 4.670 . 4.670 4.627 4.478 4.779 0.109 13 0 "[ . 1 . 2]" 1
1297 1 93 LYS HA 1 96 MET H 4.920 . 4.920 3.368 3.001 3.580 . 0 0 "[ . 1 . 2]" 1
1298 1 93 LYS HA 1 96 MET HB3 4.620 . 4.620 2.451 2.087 2.805 . 0 0 "[ . 1 . 2]" 1
1299 1 93 LYS HB2 1 94 LEU HA 5.240 . 5.240 4.565 4.386 4.998 . 0 0 "[ . 1 . 2]" 1
1300 1 94 LEU H 1 94 LEU HB2 . . 3.920 2.538 2.233 3.663 . 0 0 "[ . 1 . 2]" 1
1301 1 94 LEU H 1 94 LEU HB3 4.190 . 4.190 2.762 2.383 3.590 . 0 0 "[ . 1 . 2]" 1
1302 1 94 LEU H 1 94 LEU QD 4.530 . 4.530 3.435 2.296 3.804 . 0 0 "[ . 1 . 2]" 1
1303 1 94 LEU HA 1 94 LEU QD 4.020 . 4.020 2.211 1.917 3.513 . 0 0 "[ . 1 . 2]" 1
1304 1 94 LEU HA 1 97 VAL H 5.520 . 5.520 3.129 2.792 3.424 . 0 0 "[ . 1 . 2]" 1
1305 1 94 LEU HA 1 97 VAL HB . . 4.160 3.005 2.369 3.685 . 0 0 "[ . 1 . 2]" 1
1306 1 94 LEU HA 1 97 VAL MG2 3.860 . 3.860 2.170 1.851 2.423 . 0 0 "[ . 1 . 2]" 1
1307 1 94 LEU HB2 1 95 ASP H 4.550 . 4.550 3.740 2.940 3.997 . 0 0 "[ . 1 . 2]" 1
1308 1 94 LEU HB2 1 97 VAL MG2 4.160 . 4.160 4.243 3.800 4.472 0.312 8 0 "[ . 1 . 2]" 1
1309 1 94 LEU HB3 1 95 ASP H 4.760 . 4.760 3.025 2.541 4.257 . 0 0 "[ . 1 . 2]" 1
1310 1 95 ASP H 1 95 ASP HB2 4.010 . 4.010 2.306 2.142 2.415 . 0 0 "[ . 1 . 2]" 1
1311 1 95 ASP H 1 95 ASP HB3 4.080 . 4.080 3.481 2.854 3.616 . 0 0 "[ . 1 . 2]" 1
1312 1 95 ASP H 1 96 MET H 4.200 . 4.200 2.673 2.586 2.766 . 0 0 "[ . 1 . 2]" 1
1313 1 95 ASP HA 1 96 MET H 5.520 . 5.520 3.523 3.500 3.542 . 0 0 "[ . 1 . 2]" 1
1314 1 95 ASP HB2 1 96 MET H 4.560 . 4.560 2.777 2.529 3.431 . 0 0 "[ . 1 . 2]" 1
1315 1 95 ASP HB2 1 96 MET HB2 5.530 . 5.530 4.658 4.244 5.571 0.041 13 0 "[ . 1 . 2]" 1
1316 1 95 ASP HB2 1 96 MET HB3 5.490 . 5.490 4.906 4.567 5.677 0.187 6 0 "[ . 1 . 2]" 1
1317 1 95 ASP HB3 1 96 MET HB2 5.520 . 5.520 4.895 4.103 5.263 . 0 0 "[ . 1 . 2]" 1
1318 1 95 ASP HB3 1 96 MET HB3 5.400 . 5.400 5.428 4.605 5.619 0.219 16 0 "[ . 1 . 2]" 1
1319 1 96 MET H 1 96 MET HB3 3.920 . 3.920 2.325 2.214 2.459 . 0 0 "[ . 1 . 2]" 1
1320 1 96 MET H 1 96 MET HG2 4.500 . 4.500 4.431 4.261 4.583 0.083 10 0 "[ . 1 . 2]" 1
1321 1 96 MET H 1 96 MET HG3 4.640 . 4.640 4.495 4.304 4.595 . 0 0 "[ . 1 . 2]" 1
1322 1 96 MET H 1 97 VAL H 4.140 . 4.140 2.742 2.656 2.864 . 0 0 "[ . 1 . 2]" 1
1323 1 96 MET HA 1 96 MET HG2 4.430 . 4.430 3.500 2.639 3.955 . 0 0 "[ . 1 . 2]" 1
1324 1 96 MET HA 1 96 MET HG3 4.040 . 4.040 3.086 2.739 3.824 . 0 0 "[ . 1 . 2]" 1
1325 1 96 MET HA 1 97 VAL H 5.190 . 5.190 3.571 3.501 3.617 . 0 0 "[ . 1 . 2]" 1
1326 1 96 MET HA 1 99 ARG H 3.640 . 3.640 3.258 2.953 3.654 0.014 17 0 "[ . 1 . 2]" 1
1327 1 96 MET HA 1 99 ARG HB2 4.240 . 4.240 2.611 2.079 3.452 . 0 0 "[ . 1 . 2]" 1
1328 1 96 MET HA 1 99 ARG HG3 4.490 . 4.490 3.839 2.332 4.652 0.162 13 0 "[ . 1 . 2]" 1
1329 1 96 MET HB2 1 97 VAL H 5.090 . 5.090 4.142 3.994 4.297 . 0 0 "[ . 1 . 2]" 1
1330 1 96 MET HB3 1 97 VAL H 5.440 . 5.440 2.890 2.643 3.128 . 0 0 "[ . 1 . 2]" 1
1331 1 96 MET HB3 1 97 VAL MG2 5.690 . 5.690 3.625 3.377 3.801 . 0 0 "[ . 1 . 2]" 1
1332 1 96 MET HG2 1 97 VAL H 5.490 . 5.490 4.165 3.360 5.170 . 0 0 "[ . 1 . 2]" 1
1333 1 96 MET HG2 1 97 VAL MG2 5.360 . 5.360 4.427 3.664 5.429 0.069 11 0 "[ . 1 . 2]" 1
1334 1 96 MET HG3 1 97 VAL H 5.230 . 5.230 4.367 3.556 4.888 . 0 0 "[ . 1 . 2]" 1
1335 1 96 MET HG3 1 97 VAL MG2 5.060 . 5.060 4.813 3.829 5.278 0.218 15 0 "[ . 1 . 2]" 1
1336 1 97 VAL H 1 97 VAL HB 3.830 . 3.830 2.631 2.508 2.747 . 0 0 "[ . 1 . 2]" 1
1337 1 97 VAL H 1 97 VAL MG1 4.660 . 4.660 3.844 3.796 3.865 . 0 0 "[ . 1 . 2]" 1
1338 1 97 VAL H 1 97 VAL MG2 3.840 . 3.840 2.048 1.983 2.158 . 0 0 "[ . 1 . 2]" 1
1339 1 97 VAL HA 1 97 VAL MG2 3.620 . 3.620 2.469 2.364 2.551 . 0 0 "[ . 1 . 2]" 1
1340 1 97 VAL HA 1 100 GLU HB2 4.730 . 4.730 3.437 2.662 4.816 0.086 11 0 "[ . 1 . 2]" 1
1341 1 97 VAL HA 1 100 GLU HB3 4.920 . 4.920 3.287 2.547 4.475 . 0 0 "[ . 1 . 2]" 1
1342 1 97 VAL HA 1 101 LEU H 5.240 . 5.240 4.388 3.927 4.826 . 0 0 "[ . 1 . 2]" 1
1343 1 97 VAL HB 1 98 THR H 4.240 . 4.240 2.595 2.380 2.738 . 0 0 "[ . 1 . 2]" 1
1344 1 97 VAL HB 1 98 THR HA 6.000 . 6.000 4.408 4.268 4.658 . 0 0 "[ . 1 . 2]" 1
1345 1 97 VAL MG1 1 98 THR H 4.900 . 4.900 3.516 3.359 3.709 . 0 0 "[ . 1 . 2]" 1
1346 1 97 VAL MG1 1 98 THR HA 5.130 . 5.130 3.738 3.546 4.021 . 0 0 "[ . 1 . 2]" 1
1347 1 97 VAL MG1 1 101 LEU H 5.560 . 5.560 4.510 4.096 4.883 . 0 0 "[ . 1 . 2]" 1
1348 1 97 VAL MG2 1 100 GLU HB3 5.510 . 5.510 5.089 4.504 5.746 0.236 13 0 "[ . 1 . 2]" 1
1349 1 98 THR H 1 98 THR HB 4.080 . 4.080 2.607 2.526 2.779 . 0 0 "[ . 1 . 2]" 1
1350 1 98 THR H 1 98 THR MG . . 4.470 3.814 3.793 3.827 . 0 0 "[ . 1 . 2]" 1
1351 1 98 THR H 1 99 ARG H 4.040 . 4.040 2.706 2.575 2.870 . 0 0 "[ . 1 . 2]" 1
1352 1 98 THR HA 1 99 ARG H 5.710 . 5.710 3.561 3.519 3.589 . 0 0 "[ . 1 . 2]" 1
1353 1 98 THR HA 1 101 LEU H 5.010 . 5.010 3.764 3.409 4.075 . 0 0 "[ . 1 . 2]" 1
1354 1 98 THR HA 1 101 LEU HB3 5.190 . 5.190 3.411 2.747 4.439 . 0 0 "[ . 1 . 2]" 1
1355 1 98 THR HB 1 99 ARG H 4.410 . 4.410 2.576 2.248 2.760 . 0 0 "[ . 1 . 2]" 1
1356 1 98 THR MG 1 99 ARG HA 4.640 . 4.640 3.647 3.324 3.812 . 0 0 "[ . 1 . 2]" 1
1357 1 98 THR MG 1 101 LEU HB3 4.940 . 4.940 4.239 3.769 4.954 0.014 20 0 "[ . 1 . 2]" 1
1358 1 99 ARG H 1 99 ARG HG2 4.680 . 4.680 3.454 2.184 4.568 . 0 0 "[ . 1 . 2]" 1
1359 1 99 ARG H 1 99 ARG HG3 5.530 . 5.530 3.603 2.327 4.599 . 0 0 "[ . 1 . 2]" 1
1360 1 99 ARG H 1 100 GLU H 4.370 . 4.370 2.639 2.540 2.797 . 0 0 "[ . 1 . 2]" 1
1361 1 99 ARG HA 1 102 ASP H 5.010 . 5.010 3.326 2.927 3.723 . 0 0 "[ . 1 . 2]" 1
1362 1 99 ARG HA 1 102 ASP HB2 3.820 . 3.820 2.887 2.140 3.541 . 0 0 "[ . 1 . 2]" 1
1363 1 99 ARG HA 1 102 ASP HB3 4.270 . 4.270 2.784 1.980 4.235 . 0 0 "[ . 1 . 2]" 1
1364 1 99 ARG HB2 1 100 GLU H 4.010 . 4.010 3.266 2.724 4.008 . 0 0 "[ . 1 . 2]" 1
1365 1 99 ARG HB3 1 100 GLU H 5.790 . 5.790 3.513 2.801 4.002 . 0 0 "[ . 1 . 2]" 1
1366 1 99 ARG HB3 1 102 ASP HB2 6.000 . 6.000 5.302 3.809 6.172 0.172 12 0 "[ . 1 . 2]" 1
1367 1 100 GLU H 1 100 GLU HB2 4.080 . 4.080 2.526 2.182 3.679 . 0 0 "[ . 1 . 2]" 1
1368 1 100 GLU H 1 100 GLU QG 4.400 . 4.400 3.764 2.237 4.153 . 0 0 "[ . 1 . 2]" 1
1369 1 100 GLU H 1 101 LEU H . . 4.150 2.595 2.431 2.807 . 0 0 "[ . 1 . 2]" 1
1370 1 100 GLU HB2 1 101 LEU H 5.000 . 5.000 3.697 2.633 4.079 . 0 0 "[ . 1 . 2]" 1
1371 1 100 GLU HB3 1 101 LEU H 5.540 . 5.540 2.832 2.250 4.128 . 0 0 "[ . 1 . 2]" 1
1372 1 101 LEU H 1 102 ASP H . . 4.210 2.628 2.534 2.781 . 0 0 "[ . 1 . 2]" 1
1373 1 101 LEU H 1 102 ASP HB2 5.410 . 5.410 4.920 4.681 5.175 . 0 0 "[ . 1 . 2]" 1
1374 1 101 LEU HA 1 101 LEU HG 3.720 . 3.720 3.361 2.599 3.799 0.079 3 0 "[ . 1 . 2]" 1
1375 1 101 LEU HA 1 102 ASP H 5.040 . 5.040 3.541 3.495 3.574 . 0 0 "[ . 1 . 2]" 1
1376 1 101 LEU HA 1 104 LYS H 5.110 . 5.110 3.292 2.923 3.708 . 0 0 "[ . 1 . 2]" 1
1377 1 101 LEU HA 1 104 LYS HB2 4.840 . 4.840 3.008 1.816 4.910 0.070 7 0 "[ . 1 . 2]" 1
1378 1 101 LEU HA 1 104 LYS HB3 5.140 . 5.140 3.684 2.116 5.100 . 0 0 "[ . 1 . 2]" 1
1379 1 101 LEU HA 1 104 LYS HG2 5.010 . 5.010 3.978 2.199 5.126 0.116 1 0 "[ . 1 . 2]" 1
1380 1 101 LEU HA 1 105 VAL H 5.640 . 5.640 4.552 3.899 5.640 . 0 0 "[ . 1 . 2]" 1
1381 1 101 LEU HB2 1 102 ASP H 4.430 . 4.430 3.760 2.718 4.148 . 0 0 "[ . 1 . 2]" 1
1382 1 101 LEU HB3 1 102 ASP H 5.030 . 5.030 2.876 2.372 3.812 . 0 0 "[ . 1 . 2]" 1
1383 1 101 LEU QD 1 102 ASP HA 5.540 . 5.540 4.180 2.869 5.403 . 0 0 "[ . 1 . 2]" 1
1384 1 101 LEU QD 1 104 LYS HB2 5.050 . 5.050 3.232 2.229 5.020 . 0 0 "[ . 1 . 2]" 1
1385 1 101 LEU QD 1 104 LYS HB3 5.210 . 5.210 3.366 1.845 4.979 . 0 0 "[ . 1 . 2]" 1
1386 1 101 LEU QD 1 104 LYS HD2 4.590 . 4.590 3.691 2.005 4.650 0.060 4 0 "[ . 1 . 2]" 1
1387 1 101 LEU QD 1 104 LYS HE2 5.070 . 5.070 3.912 2.254 5.140 0.070 6 0 "[ . 1 . 2]" 1
1388 1 101 LEU QD 1 104 LYS HE3 5.050 . 5.050 3.896 2.224 5.182 0.132 10 0 "[ . 1 . 2]" 1
1389 1 102 ASP H 1 102 ASP HB2 3.920 . 3.920 2.501 2.415 2.614 . 0 0 "[ . 1 . 2]" 1
1390 1 102 ASP H 1 102 ASP HB3 4.100 . 4.100 2.682 2.422 3.636 . 0 0 "[ . 1 . 2]" 1
1391 1 102 ASP H 1 103 LYS H 4.360 . 4.360 2.754 2.621 2.914 . 0 0 "[ . 1 . 2]" 1
1392 1 102 ASP HA 1 103 LYS H 5.090 . 5.090 3.547 3.488 3.604 . 0 0 "[ . 1 . 2]" 1
1393 1 102 ASP HB2 1 103 LYS H 4.890 . 4.890 3.772 2.532 4.098 . 0 0 "[ . 1 . 2]" 1
1394 1 102 ASP HB3 1 103 LYS H . . 4.780 2.841 2.322 3.938 . 0 0 "[ . 1 . 2]" 1
1395 1 103 LYS H 1 103 LYS QB 3.740 . 3.740 2.358 2.184 2.597 . 0 0 "[ . 1 . 2]" 1
1396 1 103 LYS H 1 103 LYS QG 4.410 . 4.410 3.191 1.938 4.071 . 0 0 "[ . 1 . 2]" 1
1397 1 103 LYS H 1 104 LYS H 4.310 . 4.310 2.631 2.405 2.800 . 0 0 "[ . 1 . 2]" 1
1398 1 103 LYS HA 1 104 LYS H 4.220 . 4.220 3.527 3.398 3.611 . 0 0 "[ . 1 . 2]" 1
1399 1 103 LYS QB 1 103 LYS QE 3.940 . 3.940 3.094 1.880 3.929 . 0 0 "[ . 1 . 2]" 1
1400 1 103 LYS QB 1 104 LYS H 4.450 . 4.450 2.868 2.495 3.735 . 0 0 "[ . 1 . 2]" 1
1401 1 103 LYS QG 1 104 LYS H 4.580 . 4.580 3.846 2.491 4.633 0.053 18 0 "[ . 1 . 2]" 1
1402 1 104 LYS H 1 104 LYS HB2 4.270 . 4.270 2.541 2.154 3.648 . 0 0 "[ . 1 . 2]" 1
1403 1 104 LYS H 1 104 LYS HG2 4.710 . 4.710 3.666 2.151 4.668 . 0 0 "[ . 1 . 2]" 1
1404 1 104 LYS HA 1 104 LYS HD2 4.300 . 4.300 3.940 2.630 4.712 0.412 18 0 "[ . 1 . 2]" 1
1405 1 104 LYS HA 1 104 LYS HG2 4.000 . 4.000 3.067 2.437 3.794 . 0 0 "[ . 1 . 2]" 1
1406 1 104 LYS HB2 1 104 LYS HD2 3.890 . 3.890 3.252 2.476 3.881 . 0 0 "[ . 1 . 2]" 1
1407 1 104 LYS HB2 1 105 VAL H 5.160 . 5.160 3.324 2.424 4.200 . 0 0 "[ . 1 . 2]" 1
1408 1 104 LYS HB3 1 105 VAL H 5.020 . 5.020 3.276 2.496 4.180 . 0 0 "[ . 1 . 2]" 1
1409 1 104 LYS HE3 1 104 LYS HG2 4.080 . 4.080 3.333 2.527 3.818 . 0 0 "[ . 1 . 2]" 1
1410 1 104 LYS HE3 1 104 LYS HG3 4.370 . 4.370 3.147 2.486 3.824 . 0 0 "[ . 1 . 2]" 1
1411 1 105 VAL H 1 105 VAL HB . . 4.220 2.855 2.530 3.722 . 0 0 "[ . 1 . 2]" 1
1412 1 105 VAL H 1 105 VAL QG 3.960 . 3.960 2.100 1.880 2.373 . 0 0 "[ . 1 . 2]" 1
1413 1 105 VAL HA 1 106 SER H . . 4.600 3.535 3.442 3.596 . 0 0 "[ . 1 . 2]" 1
1414 1 105 VAL HB 1 106 SER H 5.030 . 5.030 3.113 2.022 4.211 . 0 0 "[ . 1 . 2]" 1
1415 1 105 VAL QG 1 106 SER H 5.240 . 5.240 2.886 2.131 3.508 . 0 0 "[ . 1 . 2]" 1
1416 1 105 VAL QG 1 106 SER QB 5.490 . 5.490 3.726 2.688 4.728 . 0 0 "[ . 1 . 2]" 1
1417 1 106 SER QB 1 107 GLY H 5.210 . 5.210 3.069 2.065 4.042 . 0 0 "[ . 1 . 2]" 1
1418 1 108 SER HA 1 109 TYR H 5.300 . 5.300 2.470 2.159 3.570 . 0 0 "[ . 1 . 2]" 1
1419 1 109 TYR H 1 109 TYR QD . . 4.700 3.391 1.914 4.544 . 0 0 "[ . 1 . 2]" 1
1420 1 109 TYR HA 1 109 TYR QD . . 4.280 2.984 2.388 3.810 . 0 0 "[ . 1 . 2]" 1
1421 1 109 TYR HA 1 110 LEU H 4.320 . 4.320 2.819 2.167 3.614 . 0 0 "[ . 1 . 2]" 1
1422 1 110 LEU H 1 110 LEU HB2 4.270 . 4.270 2.951 2.381 3.951 . 0 0 "[ . 1 . 2]" 1
1423 1 110 LEU HA 1 110 LEU HG 3.990 . 3.990 3.139 2.502 3.826 . 0 0 "[ . 1 . 2]" 1
1424 1 110 LEU HA 1 111 VAL H 3.770 . 3.770 2.507 2.139 3.600 . 0 0 "[ . 1 . 2]" 1
1425 1 110 LEU HB3 1 111 VAL H 5.130 . 5.130 3.850 2.007 4.441 . 0 0 "[ . 1 . 2]" 1
1426 1 111 VAL H 1 111 VAL HB 4.020 . 4.020 3.723 3.635 3.866 . 0 0 "[ . 1 . 2]" 1
1427 1 111 VAL HA 1 112 PRO HD2 3.530 . 3.530 2.684 2.251 3.048 . 0 0 "[ . 1 . 2]" 1
1428 1 111 VAL HA 1 112 PRO HD3 3.700 . 3.700 2.200 1.839 2.666 . 0 0 "[ . 1 . 2]" 1
1429 1 111 VAL HA 1 112 PRO HG3 5.530 . 5.530 4.348 3.934 4.808 . 0 0 "[ . 1 . 2]" 1
1430 1 111 VAL HB 1 112 PRO HD2 4.460 . 4.460 2.810 2.041 3.935 . 0 0 "[ . 1 . 2]" 1
1431 1 111 VAL HB 1 112 PRO HD3 4.160 . 4.160 3.699 3.187 4.198 0.038 9 0 "[ . 1 . 2]" 1
1432 1 111 VAL QG 1 112 PRO HD2 6.000 . 6.000 3.429 2.960 4.005 . 0 0 "[ . 1 . 2]" 1
1433 1 111 VAL QG 1 112 PRO HD3 5.020 . 5.020 3.695 3.415 4.034 . 0 0 "[ . 1 . 2]" 1
1434 1 112 PRO HA 1 113 ARG H . . 3.720 2.930 2.169 3.588 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Thursday, May 23, 2024 6:28:17 AM GMT (wattos1)