NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
480221 |
2l2s   |
17151 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2l2s
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 1601
_Distance_constraint_stats_list.Viol_count 1157
_Distance_constraint_stats_list.Viol_total 547.314
_Distance_constraint_stats_list.Viol_max 0.299
_Distance_constraint_stats_list.Viol_rms 0.0066
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0009
_Distance_constraint_stats_list.Viol_average_violations_only 0.0237
_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 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 THR 0.232 0.114 8 0 "[ . 1 . 2]"
1 7 VAL 0.240 0.114 8 0 "[ . 1 . 2]"
1 8 VAL 0.012 0.003 18 0 "[ . 1 . 2]"
1 9 THR 0.157 0.031 16 0 "[ . 1 . 2]"
1 10 THR 0.017 0.013 17 0 "[ . 1 . 2]"
1 11 GLU 0.007 0.004 15 0 "[ . 1 . 2]"
1 12 SER 0.000 0.000 5 0 "[ . 1 . 2]"
1 13 GLY 0.006 0.004 15 0 "[ . 1 . 2]"
1 14 LEU 0.529 0.037 9 0 "[ . 1 . 2]"
1 15 LYS 0.143 0.020 3 0 "[ . 1 . 2]"
1 16 TYR 0.780 0.083 16 0 "[ . 1 . 2]"
1 17 GLU 0.005 0.005 16 0 "[ . 1 . 2]"
1 18 ASP 0.012 0.005 19 0 "[ . 1 . 2]"
1 19 LEU 0.007 0.007 7 0 "[ . 1 . 2]"
1 20 THR 0.012 0.005 19 0 "[ . 1 . 2]"
1 21 GLU 0.004 0.004 2 0 "[ . 1 . 2]"
1 22 GLY 0.059 0.017 18 0 "[ . 1 . 2]"
1 23 SER 0.342 0.089 8 0 "[ . 1 . 2]"
1 24 GLY 0.323 0.089 8 0 "[ . 1 . 2]"
1 25 ALA 0.071 0.019 1 0 "[ . 1 . 2]"
1 26 GLU 0.277 0.046 1 0 "[ . 1 . 2]"
1 27 ALA 1.313 0.299 14 0 "[ . 1 . 2]"
1 28 ARG 0.416 0.055 17 0 "[ . 1 . 2]"
1 29 ALA 0.238 0.079 17 0 "[ . 1 . 2]"
1 30 GLY 0.073 0.018 2 0 "[ . 1 . 2]"
1 31 GLN 0.013 0.007 8 0 "[ . 1 . 2]"
1 32 THR 0.337 0.192 19 0 "[ . 1 . 2]"
1 33 VAL 0.562 0.085 19 0 "[ . 1 . 2]"
1 34 SER 0.074 0.038 13 0 "[ . 1 . 2]"
1 35 VAL 0.888 0.072 5 0 "[ . 1 . 2]"
1 36 HIS 1.436 0.094 13 0 "[ . 1 . 2]"
1 37 TYR 2.334 0.072 5 0 "[ . 1 . 2]"
1 38 THR 1.037 0.072 17 0 "[ . 1 . 2]"
1 39 GLY 1.391 0.083 20 0 "[ . 1 . 2]"
1 40 TRP 2.521 0.084 11 0 "[ . 1 . 2]"
1 41 LEU 0.079 0.016 15 0 "[ . 1 . 2]"
1 42 THR 0.401 0.031 11 0 "[ . 1 . 2]"
1 43 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 GLN 0.015 0.008 20 0 "[ . 1 . 2]"
1 46 LYS 0.115 0.040 13 0 "[ . 1 . 2]"
1 47 PHE 0.238 0.060 11 0 "[ . 1 . 2]"
1 48 ASP 0.177 0.065 11 0 "[ . 1 . 2]"
1 49 SER 0.017 0.007 13 0 "[ . 1 . 2]"
1 50 SER 0.004 0.004 14 0 "[ . 1 . 2]"
1 51 LYS 0.654 0.094 13 0 "[ . 1 . 2]"
1 52 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 ASN 0.370 0.043 14 0 "[ . 1 . 2]"
1 55 ASP 0.068 0.052 7 0 "[ . 1 . 2]"
1 56 PRO 0.400 0.059 14 0 "[ . 1 . 2]"
1 57 PHE 0.320 0.034 16 0 "[ . 1 . 2]"
1 58 ALA 0.028 0.021 17 0 "[ . 1 . 2]"
1 59 PHE 0.584 0.038 19 0 "[ . 1 . 2]"
1 60 VAL 0.530 0.192 19 0 "[ . 1 . 2]"
1 61 LEU 1.940 0.090 5 0 "[ . 1 . 2]"
1 62 GLY 0.312 0.025 13 0 "[ . 1 . 2]"
1 63 GLY 0.189 0.145 17 0 "[ . 1 . 2]"
1 64 GLY 0.033 0.033 17 0 "[ . 1 . 2]"
1 65 MET 0.133 0.018 10 0 "[ . 1 . 2]"
1 66 VAL 0.306 0.038 19 0 "[ . 1 . 2]"
1 67 ILE 2.787 0.115 14 0 "[ . 1 . 2]"
1 68 LYS 0.108 0.045 12 0 "[ . 1 . 2]"
1 69 GLY 1.928 0.092 11 0 "[ . 1 . 2]"
1 70 TRP 2.505 0.115 14 0 "[ . 1 . 2]"
1 71 ASP 0.381 0.067 9 0 "[ . 1 . 2]"
1 72 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 GLY 0.144 0.144 14 0 "[ . 1 . 2]"
1 74 VAL 1.248 0.299 14 0 "[ . 1 . 2]"
1 75 GLN 0.366 0.025 13 0 "[ . 1 . 2]"
1 76 GLY 0.570 0.090 5 0 "[ . 1 . 2]"
1 77 MET 0.247 0.034 12 0 "[ . 1 . 2]"
1 78 LYS 0.344 0.031 2 0 "[ . 1 . 2]"
1 79 VAL 0.169 0.038 10 0 "[ . 1 . 2]"
1 80 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 ARG 0.541 0.083 16 0 "[ . 1 . 2]"
1 84 ARG 0.077 0.022 20 0 "[ . 1 . 2]"
1 85 LEU 2.232 0.087 17 0 "[ . 1 . 2]"
1 86 THR 0.009 0.005 17 0 "[ . 1 . 2]"
1 87 ILE 0.861 0.080 11 0 "[ . 1 . 2]"
1 88 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 PRO 0.071 0.038 20 0 "[ . 1 . 2]"
1 90 GLN 0.363 0.110 4 0 "[ . 1 . 2]"
1 91 LEU 2.323 0.092 11 0 "[ . 1 . 2]"
1 92 GLY 0.678 0.110 4 0 "[ . 1 . 2]"
1 93 TYR 0.354 0.077 20 0 "[ . 1 . 2]"
1 94 GLY 0.042 0.015 20 0 "[ . 1 . 2]"
1 95 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 ARG 0.029 0.011 19 0 "[ . 1 . 2]"
1 97 GLY 0.097 0.077 20 0 "[ . 1 . 2]"
1 98 ALA 0.062 0.024 20 0 "[ . 1 . 2]"
1 99 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 VAL 0.228 0.026 19 0 "[ . 1 . 2]"
1 102 ILE 0.963 0.104 10 0 "[ . 1 . 2]"
1 103 PRO 0.579 0.114 10 0 "[ . 1 . 2]"
1 104 PRO 0.071 0.038 20 0 "[ . 1 . 2]"
1 105 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 ALA 0.643 0.114 10 0 "[ . 1 . 2]"
1 107 THR 1.127 0.080 11 0 "[ . 1 . 2]"
1 108 LEU 0.358 0.104 10 0 "[ . 1 . 2]"
1 109 VAL 0.722 0.057 12 0 "[ . 1 . 2]"
1 110 PHE 5.087 0.087 17 0 "[ . 1 . 2]"
1 111 GLU 0.626 0.053 13 0 "[ . 1 . 2]"
1 112 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 GLU 0.606 0.084 15 0 "[ . 1 . 2]"
1 114 LEU 0.461 0.084 15 0 "[ . 1 . 2]"
1 115 LEU 0.184 0.037 16 0 "[ . 1 . 2]"
1 116 ASP 0.588 0.126 17 0 "[ . 1 . 2]"
1 117 VAL 0.628 0.126 17 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 5 MET HA 1 5 MET QG . . 3.580 2.509 2.182 3.417 . 0 0 "[ . 1 . 2]" 1
2 1 5 MET QB 1 6 THR HB . . 5.050 4.775 4.026 5.050 . 0 0 "[ . 1 . 2]" 1
3 1 6 THR H 1 6 THR MG . . 4.470 3.237 2.112 4.050 . 0 0 "[ . 1 . 2]" 1
4 1 6 THR H 1 7 VAL HA . . 5.040 4.774 4.553 5.154 0.114 8 0 "[ . 1 . 2]" 1
5 1 6 THR HA 1 6 THR MG . . 3.240 2.627 2.062 3.205 . 0 0 "[ . 1 . 2]" 1
6 1 6 THR HA 1 7 VAL H . . 2.900 2.244 2.146 2.492 . 0 0 "[ . 1 . 2]" 1
7 1 6 THR HA 1 7 VAL HB . . 4.820 4.602 4.394 4.855 0.035 8 0 "[ . 1 . 2]" 1
8 1 6 THR HA 1 7 VAL QG . . 4.200 3.593 3.127 3.923 . 0 0 "[ . 1 . 2]" 1
9 1 6 THR HB 1 7 VAL QG . . 5.240 5.059 4.458 5.320 0.080 8 0 "[ . 1 . 2]" 1
10 1 6 THR MG 1 7 VAL H . . 3.970 3.107 1.967 3.918 . 0 0 "[ . 1 . 2]" 1
11 1 6 THR MG 1 7 VAL HA . . 4.770 4.067 3.547 4.560 . 0 0 "[ . 1 . 2]" 1
12 1 7 VAL H 1 7 VAL HB . . 3.170 2.818 2.563 3.170 . 16 0 "[ . 1 . 2]" 1
13 1 7 VAL H 1 7 VAL QG . . 3.250 2.288 1.918 2.748 . 0 0 "[ . 1 . 2]" 1
14 1 7 VAL H 1 8 VAL H . . 4.760 4.368 4.088 4.576 . 0 0 "[ . 1 . 2]" 1
15 1 7 VAL HA 1 7 VAL QG . . 3.240 2.165 2.041 2.336 . 0 0 "[ . 1 . 2]" 1
16 1 7 VAL HA 1 8 VAL H . . 3.080 2.184 2.140 2.310 . 0 0 "[ . 1 . 2]" 1
17 1 7 VAL HA 1 16 TYR H . . 5.500 5.121 4.388 5.498 . 0 0 "[ . 1 . 2]" 1
18 1 7 VAL HA 1 17 GLU HA . . 4.080 3.583 2.512 4.076 . 0 0 "[ . 1 . 2]" 1
19 1 7 VAL HA 1 17 GLU QG . . 4.440 3.894 2.319 4.445 0.005 16 0 "[ . 1 . 2]" 1
20 1 7 VAL HA 1 18 ASP H . . 5.010 4.721 4.127 5.010 . 0 0 "[ . 1 . 2]" 1
21 1 7 VAL HB 1 8 VAL H . . 4.360 4.158 3.840 4.362 0.002 15 0 "[ . 1 . 2]" 1
22 1 7 VAL QG 1 8 VAL H . . 3.740 2.512 1.923 3.115 . 0 0 "[ . 1 . 2]" 1
23 1 7 VAL QG 1 18 ASP H . . 5.080 4.636 3.892 5.078 . 0 0 "[ . 1 . 2]" 1
24 1 8 VAL H 1 8 VAL HB . . 3.650 3.124 2.689 3.473 . 0 0 "[ . 1 . 2]" 1
25 1 8 VAL H 1 8 VAL QG . . 3.810 2.131 1.918 2.353 . 0 0 "[ . 1 . 2]" 1
26 1 8 VAL H 1 9 THR H . . 4.880 4.434 4.133 4.611 . 0 0 "[ . 1 . 2]" 1
27 1 8 VAL H 1 16 TYR H . . 4.580 4.064 3.204 4.490 . 0 0 "[ . 1 . 2]" 1
28 1 8 VAL HA 1 8 VAL MG1 . . 3.350 3.195 3.184 3.204 . 0 0 "[ . 1 . 2]" 1
29 1 8 VAL HA 1 8 VAL MG2 . . 3.350 2.344 2.220 2.400 . 0 0 "[ . 1 . 2]" 1
30 1 8 VAL HA 1 9 THR H . . 2.820 2.225 2.152 2.249 . 0 0 "[ . 1 . 2]" 1
31 1 8 VAL HB 1 16 TYR QE . . 4.830 4.694 4.533 4.831 0.001 11 0 "[ . 1 . 2]" 1
32 1 8 VAL QG 1 9 THR H . . 3.790 2.218 2.077 2.584 . 0 0 "[ . 1 . 2]" 1
33 1 8 VAL QG 1 9 THR HA . . 4.090 3.392 3.226 3.564 . 0 0 "[ . 1 . 2]" 1
34 1 8 VAL QG 1 10 THR H . . 5.110 4.255 3.949 4.527 . 0 0 "[ . 1 . 2]" 1
35 1 8 VAL QG 1 10 THR HA . . 4.950 4.001 3.741 4.216 . 0 0 "[ . 1 . 2]" 1
36 1 8 VAL QG 1 10 THR MG . . 3.860 3.478 3.107 3.802 . 0 0 "[ . 1 . 2]" 1
37 1 8 VAL QG 1 15 LYS HA . . 4.770 4.396 3.920 4.594 . 0 0 "[ . 1 . 2]" 1
38 1 8 VAL QG 1 16 TYR H . . 4.520 3.770 2.846 4.184 . 0 0 "[ . 1 . 2]" 1
39 1 8 VAL QG 1 16 TYR QD . . 4.320 3.297 2.635 3.562 . 0 0 "[ . 1 . 2]" 1
40 1 8 VAL QG 1 16 TYR QE . . 2.890 2.206 2.027 2.400 . 0 0 "[ . 1 . 2]" 1
41 1 8 VAL MG1 1 9 THR HA . . 4.650 4.019 3.791 4.198 . 0 0 "[ . 1 . 2]" 1
42 1 8 VAL MG1 1 15 LYS HA . . 5.500 4.660 4.114 4.923 . 0 0 "[ . 1 . 2]" 1
43 1 8 VAL MG1 1 16 TYR QE . . 4.430 2.219 2.033 2.444 . 0 0 "[ . 1 . 2]" 1
44 1 8 VAL MG2 1 9 THR HA . . 4.650 3.659 3.454 3.891 . 0 0 "[ . 1 . 2]" 1
45 1 8 VAL MG2 1 15 LYS HA . . 5.500 5.402 4.936 5.503 0.003 18 0 "[ . 1 . 2]" 1
46 1 8 VAL MG2 1 16 TYR QE . . 4.430 3.998 3.447 4.333 . 0 0 "[ . 1 . 2]" 1
47 1 9 THR H 1 9 THR MG . . 4.080 3.863 3.841 3.893 . 0 0 "[ . 1 . 2]" 1
48 1 9 THR H 1 10 THR H . . 4.610 4.486 4.402 4.557 . 0 0 "[ . 1 . 2]" 1
49 1 9 THR HA 1 9 THR MG . . 3.300 2.261 2.128 2.345 . 0 0 "[ . 1 . 2]" 1
50 1 9 THR HA 1 10 THR H . . 3.090 2.261 2.160 2.355 . 0 0 "[ . 1 . 2]" 1
51 1 9 THR HA 1 10 THR MG . . 4.800 3.628 3.337 4.282 . 0 0 "[ . 1 . 2]" 1
52 1 9 THR HA 1 15 LYS HA . . 3.330 2.735 2.617 2.849 . 0 0 "[ . 1 . 2]" 1
53 1 9 THR HA 1 15 LYS QB . . 4.750 3.569 2.969 3.808 . 0 0 "[ . 1 . 2]" 1
54 1 9 THR HA 1 15 LYS QD . . 4.780 3.972 3.521 4.704 . 0 0 "[ . 1 . 2]" 1
55 1 9 THR HA 1 15 LYS QG . . 3.460 2.525 1.977 3.045 . 0 0 "[ . 1 . 2]" 1
56 1 9 THR HA 1 16 TYR H . . 4.140 4.044 3.693 4.145 0.005 4 0 "[ . 1 . 2]" 1
57 1 9 THR HA 1 16 TYR QD . . 5.500 5.141 4.579 5.416 . 0 0 "[ . 1 . 2]" 1
58 1 9 THR HB 1 10 THR H . . 4.540 3.806 3.457 4.100 . 0 0 "[ . 1 . 2]" 1
59 1 9 THR HB 1 15 LYS HA . . 5.500 5.501 5.457 5.512 0.012 19 0 "[ . 1 . 2]" 1
60 1 9 THR MG 1 10 THR H . . 3.300 2.026 1.910 2.288 . 0 0 "[ . 1 . 2]" 1
61 1 9 THR MG 1 13 GLY H . . 4.110 3.565 3.364 3.879 . 0 0 "[ . 1 . 2]" 1
62 1 9 THR MG 1 13 GLY QA . . 3.690 2.933 2.466 3.574 . 0 0 "[ . 1 . 2]" 1
63 1 9 THR MG 1 15 LYS H . . 4.860 4.545 4.331 4.854 . 0 0 "[ . 1 . 2]" 1
64 1 9 THR MG 1 15 LYS HA . . 4.070 3.381 3.131 3.569 . 0 0 "[ . 1 . 2]" 1
65 1 9 THR MG 1 15 LYS QD . . 4.500 2.471 1.935 3.694 . 0 0 "[ . 1 . 2]" 1
66 1 9 THR MG 1 15 LYS HE2 . . 4.920 4.019 2.749 4.736 . 0 0 "[ . 1 . 2]" 1
67 1 9 THR MG 1 15 LYS QE . . 4.130 3.620 2.683 4.053 . 0 0 "[ . 1 . 2]" 1
68 1 9 THR MG 1 15 LYS HE3 . . 4.920 4.289 2.768 4.845 . 0 0 "[ . 1 . 2]" 1
69 1 9 THR MG 1 15 LYS HG2 . . 4.360 2.177 1.908 3.405 . 0 0 "[ . 1 . 2]" 1
70 1 9 THR MG 1 15 LYS QG . . 3.650 1.901 1.841 2.056 . 0 0 "[ . 1 . 2]" 1
71 1 9 THR MG 1 15 LYS HG3 . . 4.360 2.520 1.912 3.210 . 0 0 "[ . 1 . 2]" 1
72 1 9 THR MG 1 16 TYR H . . 5.170 5.113 4.756 5.201 0.031 16 0 "[ . 1 . 2]" 1
73 1 10 THR H 1 10 THR MG . . 3.610 2.532 2.210 3.060 . 0 0 "[ . 1 . 2]" 1
74 1 10 THR H 1 13 GLY H . . 4.780 3.835 3.360 4.079 . 0 0 "[ . 1 . 2]" 1
75 1 10 THR H 1 14 LEU H . . 5.050 4.578 3.985 5.053 0.003 3 0 "[ . 1 . 2]" 1
76 1 10 THR H 1 15 LYS HA . . 4.180 3.485 3.164 3.924 . 0 0 "[ . 1 . 2]" 1
77 1 10 THR H 1 15 LYS QG . . 4.300 3.411 3.076 3.696 . 0 0 "[ . 1 . 2]" 1
78 1 10 THR HA 1 10 THR MG . . 2.890 2.340 2.213 2.479 . 0 0 "[ . 1 . 2]" 1
79 1 10 THR HA 1 11 GLU H . . 2.870 2.590 2.369 2.675 . 0 0 "[ . 1 . 2]" 1
80 1 10 THR HA 1 11 GLU QB . . 4.720 4.545 4.388 4.721 0.001 9 0 "[ . 1 . 2]" 1
81 1 10 THR HA 1 11 GLU QG . . 5.010 4.230 3.887 4.928 . 0 0 "[ . 1 . 2]" 1
82 1 10 THR HA 1 13 GLY H . . 5.050 4.765 4.657 4.991 . 0 0 "[ . 1 . 2]" 1
83 1 10 THR HA 1 16 TYR QE . . 5.500 5.117 4.560 5.500 . 0 0 "[ . 1 . 2]" 1
84 1 10 THR MG 1 11 GLU H . . 3.980 3.536 3.129 3.751 . 0 0 "[ . 1 . 2]" 1
85 1 10 THR MG 1 12 SER H . . 4.470 4.216 3.938 4.388 . 0 0 "[ . 1 . 2]" 1
86 1 10 THR MG 1 15 LYS HA . . 4.820 3.895 3.364 4.673 . 0 0 "[ . 1 . 2]" 1
87 1 10 THR MG 1 16 TYR QD . . 3.930 3.709 3.416 3.943 0.013 17 0 "[ . 1 . 2]" 1
88 1 10 THR MG 1 16 TYR QE . . 3.020 2.342 1.901 2.669 . 0 0 "[ . 1 . 2]" 1
89 1 11 GLU H 1 11 GLU QB . . 3.230 2.314 2.176 2.608 . 0 0 "[ . 1 . 2]" 1
90 1 11 GLU H 1 11 GLU QG . . 3.970 2.632 1.930 3.537 . 0 0 "[ . 1 . 2]" 1
91 1 11 GLU H 1 12 SER H . . 4.080 2.445 2.364 2.654 . 0 0 "[ . 1 . 2]" 1
92 1 11 GLU HA 1 11 GLU QG . . 3.490 2.640 2.144 3.444 . 0 0 "[ . 1 . 2]" 1
93 1 11 GLU HA 1 12 SER H . . 3.540 3.485 3.451 3.530 . 0 0 "[ . 1 . 2]" 1
94 1 11 GLU HA 1 13 GLY H . . 4.580 4.010 3.695 4.274 . 0 0 "[ . 1 . 2]" 1
95 1 11 GLU QB 1 12 SER H . . 3.760 3.015 2.692 3.591 . 0 0 "[ . 1 . 2]" 1
96 1 11 GLU QB 1 13 GLY H . . 4.890 4.695 4.466 4.894 0.004 15 0 "[ . 1 . 2]" 1
97 1 11 GLU QG 1 12 SER H . . 4.680 3.835 2.091 4.591 . 0 0 "[ . 1 . 2]" 1
98 1 12 SER H 1 13 GLY H . . 3.480 2.519 2.310 2.705 . 0 0 "[ . 1 . 2]" 1
99 1 12 SER H 1 13 GLY QA . . 5.090 4.482 4.328 4.618 . 0 0 "[ . 1 . 2]" 1
100 1 12 SER H 1 14 LEU H . . 4.790 4.311 3.739 4.790 . 0 0 "[ . 1 . 2]" 1
101 1 12 SER QB 1 91 LEU QD . . 3.750 2.784 2.170 3.750 0.000 5 0 "[ . 1 . 2]" 1
102 1 13 GLY H 1 14 LEU H . . 3.340 2.594 2.158 2.997 . 0 0 "[ . 1 . 2]" 1
103 1 13 GLY H 1 14 LEU QD . . 5.380 4.547 2.870 5.374 . 0 0 "[ . 1 . 2]" 1
104 1 13 GLY H 1 91 LEU QD . . 5.440 4.198 3.900 4.676 . 0 0 "[ . 1 . 2]" 1
105 1 13 GLY QA 1 91 LEU QD . . 3.940 3.098 2.363 3.494 . 0 0 "[ . 1 . 2]" 1
106 1 14 LEU H 1 14 LEU HB2 . . 3.530 3.040 2.680 3.548 0.018 7 0 "[ . 1 . 2]" 1
107 1 14 LEU H 1 14 LEU QB . . 3.000 2.205 2.167 2.269 . 0 0 "[ . 1 . 2]" 1
108 1 14 LEU H 1 14 LEU HB3 . . 3.530 2.289 2.231 2.344 . 0 0 "[ . 1 . 2]" 1
109 1 14 LEU H 1 14 LEU HG . . 4.760 3.920 2.758 4.480 . 0 0 "[ . 1 . 2]" 1
110 1 14 LEU H 1 91 LEU QD . . 3.520 2.716 2.524 2.931 . 0 0 "[ . 1 . 2]" 1
111 1 14 LEU HA 1 14 LEU MD1 . . 4.410 3.015 2.091 4.118 . 0 0 "[ . 1 . 2]" 1
112 1 14 LEU HA 1 14 LEU QD . . 3.400 2.786 2.084 3.350 . 0 0 "[ . 1 . 2]" 1
113 1 14 LEU HA 1 14 LEU MD2 . . 4.410 3.869 3.460 4.090 . 0 0 "[ . 1 . 2]" 1
114 1 14 LEU HA 1 14 LEU HG . . 3.920 3.386 2.758 3.683 . 0 0 "[ . 1 . 2]" 1
115 1 14 LEU HA 1 15 LYS H . . 3.300 2.298 2.172 2.474 . 0 0 "[ . 1 . 2]" 1
116 1 14 LEU HA 1 15 LYS QG . . 5.340 3.644 3.145 5.340 0.000 7 0 "[ . 1 . 2]" 1
117 1 14 LEU HA 1 87 ILE HA . . 4.780 3.178 3.022 3.336 . 0 0 "[ . 1 . 2]" 1
118 1 14 LEU HA 1 88 PRO QD . . 4.300 2.540 2.237 2.843 . 0 0 "[ . 1 . 2]" 1
119 1 14 LEU HA 1 91 LEU QB . . 5.340 4.707 4.513 4.881 . 0 0 "[ . 1 . 2]" 1
120 1 14 LEU HA 1 91 LEU QD . . 3.830 3.411 2.953 3.658 . 0 0 "[ . 1 . 2]" 1
121 1 14 LEU HA 1 91 LEU HG . . 5.500 5.520 5.505 5.537 0.037 9 0 "[ . 1 . 2]" 1
122 1 14 LEU QB 1 91 LEU QD . . 3.810 2.627 2.381 2.881 . 0 0 "[ . 1 . 2]" 1
123 1 14 LEU QD 1 15 LYS H . . 3.540 2.568 2.002 3.560 0.020 3 0 "[ . 1 . 2]" 1
124 1 14 LEU QD 1 15 LYS QB . . 4.910 4.166 3.850 4.896 . 0 0 "[ . 1 . 2]" 1
125 1 14 LEU QD 1 16 TYR QE . . 4.310 3.377 1.968 3.943 . 0 0 "[ . 1 . 2]" 1
126 1 14 LEU MD1 1 16 TYR QD . . 4.150 3.154 1.916 4.123 . 0 0 "[ . 1 . 2]" 1
127 1 14 LEU MD1 1 16 TYR QE . . 5.000 4.364 2.928 5.006 0.006 6 0 "[ . 1 . 2]" 1
128 1 14 LEU MD2 1 16 TYR QD . . 4.150 3.527 1.903 4.164 0.014 8 0 "[ . 1 . 2]" 1
129 1 14 LEU MD2 1 16 TYR QE . . 5.000 3.831 1.974 4.731 . 0 0 "[ . 1 . 2]" 1
130 1 14 LEU HG 1 16 TYR QD . . 4.190 3.299 2.660 4.192 0.002 12 0 "[ . 1 . 2]" 1
131 1 14 LEU HG 1 16 TYR QE . . 4.910 4.201 3.800 4.914 0.004 15 0 "[ . 1 . 2]" 1
132 1 15 LYS H 1 15 LYS QB . . 3.410 2.742 2.569 2.894 . 0 0 "[ . 1 . 2]" 1
133 1 15 LYS H 1 86 THR H . . 4.410 3.374 3.179 3.568 . 0 0 "[ . 1 . 2]" 1
134 1 15 LYS HA 1 15 LYS QD . . 4.340 3.986 3.646 4.213 . 0 0 "[ . 1 . 2]" 1
135 1 15 LYS HA 1 15 LYS HG2 . . 3.750 2.674 2.319 3.581 . 0 0 "[ . 1 . 2]" 1
136 1 15 LYS HA 1 15 LYS HG3 . . 3.750 3.084 2.552 3.527 . 0 0 "[ . 1 . 2]" 1
137 1 15 LYS HA 1 16 TYR H . . 3.160 2.396 2.290 2.445 . 0 0 "[ . 1 . 2]" 1
138 1 15 LYS HA 1 16 TYR QD . . 4.010 3.415 2.865 3.800 . 0 0 "[ . 1 . 2]" 1
139 1 15 LYS HA 1 16 TYR QE . . 4.990 4.255 3.976 4.574 . 0 0 "[ . 1 . 2]" 1
140 1 15 LYS HA 1 85 LEU QD . . 5.000 4.697 4.352 4.992 . 0 0 "[ . 1 . 2]" 1
141 1 15 LYS HA 1 86 THR HB . . 4.970 4.772 4.576 4.916 . 0 0 "[ . 1 . 2]" 1
142 1 15 LYS QB 1 16 TYR H . . 3.750 2.474 2.362 3.013 . 0 0 "[ . 1 . 2]" 1
143 1 15 LYS QB 1 85 LEU QD . . 5.050 4.856 4.611 5.051 0.001 9 0 "[ . 1 . 2]" 1
144 1 15 LYS QB 1 86 THR H . . 4.120 3.268 2.966 3.611 . 0 0 "[ . 1 . 2]" 1
145 1 15 LYS QB 1 86 THR HA . . 5.500 4.609 4.351 4.805 . 0 0 "[ . 1 . 2]" 1
146 1 15 LYS QB 1 86 THR HB . . 3.240 2.028 1.980 2.214 . 0 0 "[ . 1 . 2]" 1
147 1 15 LYS QB 1 86 THR MG . . 3.780 3.439 3.093 3.579 . 0 0 "[ . 1 . 2]" 1
148 1 15 LYS QD 1 86 THR HB . . 4.280 3.695 2.314 4.283 0.003 20 0 "[ . 1 . 2]" 1
149 1 15 LYS QE 1 86 THR HB . . 4.540 2.849 2.050 4.383 . 0 0 "[ . 1 . 2]" 1
150 1 15 LYS QE 1 86 THR MG . . 3.730 2.942 2.228 3.731 0.001 10 0 "[ . 1 . 2]" 1
151 1 15 LYS HE2 1 86 THR HB . . 5.260 3.737 2.334 5.210 . 0 0 "[ . 1 . 2]" 1
152 1 15 LYS HE2 1 86 THR MG . . 4.310 3.605 2.435 4.297 . 0 0 "[ . 1 . 2]" 1
153 1 15 LYS HE3 1 86 THR HB . . 5.260 3.178 2.072 4.715 . 0 0 "[ . 1 . 2]" 1
154 1 15 LYS HE3 1 86 THR MG . . 4.310 3.277 2.306 4.190 . 0 0 "[ . 1 . 2]" 1
155 1 16 TYR H 1 16 TYR QD . . 4.300 3.245 2.878 3.337 . 0 0 "[ . 1 . 2]" 1
156 1 16 TYR H 1 85 LEU QD . . 4.900 4.698 4.362 4.904 0.004 17 0 "[ . 1 . 2]" 1
157 1 16 TYR H 1 86 THR HB . . 5.500 5.117 4.677 5.333 . 0 0 "[ . 1 . 2]" 1
158 1 16 TYR HA 1 16 TYR QD . . 4.300 3.720 3.699 3.737 . 0 0 "[ . 1 . 2]" 1
159 1 16 TYR HA 1 17 GLU H . . 3.340 2.239 2.167 2.299 . 0 0 "[ . 1 . 2]" 1
160 1 16 TYR HA 1 85 LEU HA . . 4.150 2.215 1.993 2.436 . 0 0 "[ . 1 . 2]" 1
161 1 16 TYR HA 1 85 LEU HB2 . . 4.770 4.329 4.025 4.652 . 0 0 "[ . 1 . 2]" 1
162 1 16 TYR HA 1 85 LEU QD . . 3.910 3.502 3.233 3.706 . 0 0 "[ . 1 . 2]" 1
163 1 16 TYR HA 1 86 THR H . . 4.330 2.757 2.602 2.864 . 0 0 "[ . 1 . 2]" 1
164 1 16 TYR HA 1 86 THR HB . . 5.500 4.959 4.269 5.313 . 0 0 "[ . 1 . 2]" 1
165 1 16 TYR HB2 1 17 GLU H . . 3.590 2.899 2.710 3.194 . 0 0 "[ . 1 . 2]" 1
166 1 16 TYR HB2 1 83 ARG HA . . 5.500 5.525 5.502 5.583 0.083 16 0 "[ . 1 . 2]" 1
167 1 16 TYR HB2 1 83 ARG QB . . 5.010 3.535 3.055 4.132 . 0 0 "[ . 1 . 2]" 1
168 1 16 TYR HB2 1 85 LEU HA . . 4.440 3.691 3.581 3.827 . 0 0 "[ . 1 . 2]" 1
169 1 16 TYR HB3 1 17 GLU H . . 4.800 3.866 3.746 4.038 . 0 0 "[ . 1 . 2]" 1
170 1 16 TYR HB3 1 85 LEU HA . . 4.330 2.913 2.806 3.084 . 0 0 "[ . 1 . 2]" 1
171 1 16 TYR HB3 1 85 LEU HB2 . . 4.680 3.821 3.581 4.011 . 0 0 "[ . 1 . 2]" 1
172 1 16 TYR HB3 1 85 LEU QD . . 3.410 2.256 2.017 2.529 . 0 0 "[ . 1 . 2]" 1
173 1 16 TYR HB3 1 86 THR H . . 4.610 4.021 3.803 4.193 . 0 0 "[ . 1 . 2]" 1
174 1 16 TYR QD 1 17 GLU H . . 4.560 4.088 3.783 4.286 . 0 0 "[ . 1 . 2]" 1
175 1 16 TYR QD 1 17 GLU HA . . 4.270 3.763 3.387 4.062 . 0 0 "[ . 1 . 2]" 1
176 1 16 TYR QD 1 18 ASP H . . 4.710 4.178 3.960 4.705 . 0 0 "[ . 1 . 2]" 1
177 1 16 TYR QD 1 73 GLY QA . . 4.970 4.544 4.183 4.918 . 0 0 "[ . 1 . 2]" 1
178 1 16 TYR QD 1 83 ARG QB . . 5.340 4.578 3.782 5.348 0.008 18 0 "[ . 1 . 2]" 1
179 1 16 TYR QD 1 83 ARG QD . . 3.960 3.176 2.003 3.943 . 0 0 "[ . 1 . 2]" 1
180 1 16 TYR QD 1 85 LEU HA . . 5.500 4.644 4.554 4.783 . 0 0 "[ . 1 . 2]" 1
181 1 16 TYR QD 1 85 LEU HB2 . . 5.500 5.461 5.266 5.534 0.034 16 0 "[ . 1 . 2]" 1
182 1 16 TYR QD 1 85 LEU QD . . 3.640 2.999 2.569 3.353 . 0 0 "[ . 1 . 2]" 1
183 1 16 TYR QE 1 83 ARG QD . . 5.230 4.737 3.888 5.252 0.022 20 0 "[ . 1 . 2]" 1
184 1 17 GLU H 1 85 LEU HA . . 4.570 3.615 3.479 3.831 . 0 0 "[ . 1 . 2]" 1
185 1 17 GLU H 1 85 LEU QD . . 5.080 4.895 4.692 5.063 . 0 0 "[ . 1 . 2]" 1
186 1 17 GLU HA 1 17 GLU QG . . 3.480 2.558 2.164 3.324 . 0 0 "[ . 1 . 2]" 1
187 1 17 GLU HA 1 18 ASP H . . 2.980 2.147 2.138 2.271 . 0 0 "[ . 1 . 2]" 1
188 1 18 ASP H 1 18 ASP QB . . 3.280 2.468 2.054 2.691 . 0 0 "[ . 1 . 2]" 1
189 1 18 ASP HA 1 19 LEU H . . 3.210 2.161 2.139 2.188 . 0 0 "[ . 1 . 2]" 1
190 1 18 ASP HA 1 20 THR H . . 3.920 3.788 3.592 3.924 0.004 18 0 "[ . 1 . 2]" 1
191 1 18 ASP QB 1 20 THR HA . . 5.240 5.140 4.961 5.245 0.005 19 0 "[ . 1 . 2]" 1
192 1 19 LEU H 1 19 LEU QB . . 3.230 2.386 2.203 2.556 . 0 0 "[ . 1 . 2]" 1
193 1 19 LEU H 1 19 LEU QD . . 4.400 3.480 2.869 3.803 . 0 0 "[ . 1 . 2]" 1
194 1 19 LEU H 1 20 THR H . . 3.350 1.948 1.897 2.141 . 0 0 "[ . 1 . 2]" 1
195 1 19 LEU H 1 82 VAL HB . . 4.530 4.242 4.095 4.352 . 0 0 "[ . 1 . 2]" 1
196 1 19 LEU H 1 83 ARG QB . . 4.240 3.471 2.962 4.066 . 0 0 "[ . 1 . 2]" 1
197 1 19 LEU H 1 84 ARG H . . 4.260 4.064 3.861 4.267 0.007 7 0 "[ . 1 . 2]" 1
198 1 19 LEU HA 1 19 LEU MD1 . . 4.010 3.018 1.960 3.904 . 0 0 "[ . 1 . 2]" 1
199 1 19 LEU HA 1 19 LEU QD . . 2.940 2.283 1.954 2.765 . 0 0 "[ . 1 . 2]" 1
200 1 19 LEU HA 1 19 LEU MD2 . . 4.010 3.079 2.112 3.838 . 0 0 "[ . 1 . 2]" 1
201 1 19 LEU QB 1 19 LEU MD1 . . 3.140 2.158 2.009 2.310 . 0 0 "[ . 1 . 2]" 1
202 1 19 LEU QB 1 19 LEU QD . . 2.590 1.893 1.833 1.935 . 0 0 "[ . 1 . 2]" 1
203 1 19 LEU QB 1 19 LEU MD2 . . 3.140 2.111 2.000 2.249 . 0 0 "[ . 1 . 2]" 1
204 1 19 LEU QB 1 20 THR H . . 3.280 2.774 2.628 2.872 . 0 0 "[ . 1 . 2]" 1
205 1 19 LEU QB 1 20 THR HA . . 4.970 4.393 4.283 4.539 . 0 0 "[ . 1 . 2]" 1
206 1 19 LEU QB 1 20 THR HB . . 4.650 4.049 3.709 4.247 . 0 0 "[ . 1 . 2]" 1
207 1 19 LEU QB 1 82 VAL HB . . 4.170 2.708 2.147 3.041 . 0 0 "[ . 1 . 2]" 1
208 1 19 LEU QB 1 82 VAL QG . . 3.490 2.249 1.912 2.489 . 0 0 "[ . 1 . 2]" 1
209 1 19 LEU QB 1 83 ARG HA . . 3.960 2.437 2.184 2.795 . 0 0 "[ . 1 . 2]" 1
210 1 19 LEU QB 1 84 ARG H . . 4.100 3.461 2.846 3.990 . 0 0 "[ . 1 . 2]" 1
211 1 19 LEU QD 1 40 TRP HH2 . . 5.440 4.481 4.096 4.965 . 0 0 "[ . 1 . 2]" 1
212 1 19 LEU QD 1 40 TRP HZ3 . . 5.440 3.867 3.556 4.289 . 0 0 "[ . 1 . 2]" 1
213 1 19 LEU QD 1 82 VAL HA . . 5.440 4.740 4.367 5.082 . 0 0 "[ . 1 . 2]" 1
214 1 19 LEU QD 1 83 ARG HA . . 4.380 2.998 2.335 3.755 . 0 0 "[ . 1 . 2]" 1
215 1 19 LEU QD 1 84 ARG HA . . 4.480 3.409 2.710 4.142 . 0 0 "[ . 1 . 2]" 1
216 1 19 LEU QD 1 84 ARG QB . . 3.180 2.151 1.773 2.970 . 0 0 "[ . 1 . 2]" 1
217 1 19 LEU QD 1 84 ARG QD . . 3.920 2.743 1.975 3.573 . 0 0 "[ . 1 . 2]" 1
218 1 19 LEU QD 1 111 GLU HA . . 5.410 4.280 3.588 4.567 . 0 0 "[ . 1 . 2]" 1
219 1 19 LEU QD 1 111 GLU QG . . 4.280 2.581 2.100 3.724 . 0 0 "[ . 1 . 2]" 1
220 1 19 LEU MD1 1 84 ARG QD . . 4.580 2.889 1.986 3.737 . 0 0 "[ . 1 . 2]" 1
221 1 19 LEU MD2 1 84 ARG QD . . 4.580 3.548 2.279 4.565 . 0 0 "[ . 1 . 2]" 1
222 1 20 THR H 1 20 THR HB . . 3.760 3.109 2.982 3.203 . 0 0 "[ . 1 . 2]" 1
223 1 20 THR H 1 20 THR MG . . 4.390 4.030 3.980 4.055 . 0 0 "[ . 1 . 2]" 1
224 1 20 THR H 1 82 VAL HB . . 3.610 3.128 2.947 3.435 . 0 0 "[ . 1 . 2]" 1
225 1 20 THR H 1 82 VAL QG . . 4.170 3.748 3.628 3.951 . 0 0 "[ . 1 . 2]" 1
226 1 20 THR HA 1 20 THR MG . . 3.180 2.230 2.088 2.349 . 0 0 "[ . 1 . 2]" 1
227 1 20 THR HA 1 82 VAL HB . . 4.910 4.464 4.258 4.856 . 0 0 "[ . 1 . 2]" 1
228 1 20 THR HA 1 82 VAL QG . . 5.070 4.638 4.429 4.984 . 0 0 "[ . 1 . 2]" 1
229 1 20 THR HB 1 82 VAL H . . 3.260 2.351 1.961 2.862 . 0 0 "[ . 1 . 2]" 1
230 1 20 THR HB 1 82 VAL HB . . 3.660 2.282 2.054 2.523 . 0 0 "[ . 1 . 2]" 1
231 1 20 THR HB 1 82 VAL QG . . 3.170 2.323 2.020 2.703 . 0 0 "[ . 1 . 2]" 1
232 1 20 THR MG 1 21 GLU H . . 4.620 2.859 2.532 3.002 . 0 0 "[ . 1 . 2]" 1
233 1 20 THR MG 1 81 GLY QA . . 4.490 3.826 3.425 4.301 . 0 0 "[ . 1 . 2]" 1
234 1 20 THR MG 1 82 VAL H . . 4.570 3.719 3.437 3.920 . 0 0 "[ . 1 . 2]" 1
235 1 20 THR MG 1 82 VAL HB . . 4.330 3.803 3.562 4.004 . 0 0 "[ . 1 . 2]" 1
236 1 21 GLU HA 1 21 GLU QG . . 3.460 2.345 2.201 2.567 . 0 0 "[ . 1 . 2]" 1
237 1 21 GLU HA 1 22 GLY H . . 3.320 2.202 2.143 2.325 . 0 0 "[ . 1 . 2]" 1
238 1 21 GLU QB 1 22 GLY H . . 4.070 3.620 3.328 3.942 . 0 0 "[ . 1 . 2]" 1
239 1 21 GLU QG 1 22 GLY H . . 4.210 2.560 2.143 3.261 . 0 0 "[ . 1 . 2]" 1
240 1 21 GLU QG 1 78 LYS QE . . 4.890 4.650 3.473 4.894 0.004 2 0 "[ . 1 . 2]" 1
241 1 22 GLY H 1 23 SER H . . 4.910 3.946 2.672 4.467 . 0 0 "[ . 1 . 2]" 1
242 1 22 GLY H 1 78 LYS H . . 5.310 5.036 4.310 5.327 0.017 18 0 "[ . 1 . 2]" 1
243 1 22 GLY H 1 78 LYS HB2 . . 4.070 3.837 3.445 4.073 0.003 16 0 "[ . 1 . 2]" 1
244 1 22 GLY H 1 78 LYS HB3 . . 5.500 5.241 4.895 5.497 . 0 0 "[ . 1 . 2]" 1
245 1 22 GLY H 1 78 LYS QD . . 5.340 4.027 3.535 4.577 . 0 0 "[ . 1 . 2]" 1
246 1 22 GLY QA 1 23 SER H . . 3.120 2.201 2.112 2.529 . 0 0 "[ . 1 . 2]" 1
247 1 22 GLY QA 1 78 LYS HB3 . . 4.390 3.899 3.535 4.189 . 0 0 "[ . 1 . 2]" 1
248 1 22 GLY HA2 1 78 LYS HB2 . . 4.660 4.623 4.510 4.676 0.016 18 0 "[ . 1 . 2]" 1
249 1 22 GLY HA3 1 78 LYS HB2 . . 4.660 3.035 2.895 3.179 . 0 0 "[ . 1 . 2]" 1
250 1 23 SER H 1 23 SER QB . . 3.600 2.556 2.254 2.977 . 0 0 "[ . 1 . 2]" 1
251 1 23 SER H 1 24 GLY H . . 3.610 3.283 2.591 3.619 0.009 9 0 "[ . 1 . 2]" 1
252 1 23 SER H 1 24 GLY HA2 . . 5.150 5.042 4.753 5.239 0.089 8 0 "[ . 1 . 2]" 1
253 1 23 SER H 1 78 LYS HB2 . . 5.370 4.911 2.703 5.384 0.014 1 0 "[ . 1 . 2]" 1
254 1 23 SER HA 1 78 LYS HB3 . . 5.500 4.472 4.039 5.062 . 0 0 "[ . 1 . 2]" 1
255 1 23 SER HA 1 78 LYS QD . . 4.370 3.557 3.053 4.376 0.006 10 0 "[ . 1 . 2]" 1
256 1 23 SER HA 1 78 LYS QE . . 5.370 5.119 3.631 5.382 0.012 1 0 "[ . 1 . 2]" 1
257 1 24 GLY H 1 78 LYS HB2 . . 5.480 3.646 3.016 4.524 . 0 0 "[ . 1 . 2]" 1
258 1 24 GLY H 1 78 LYS HB3 . . 4.220 2.791 2.374 3.849 . 0 0 "[ . 1 . 2]" 1
259 1 24 GLY H 1 79 VAL HB . . 4.030 3.925 3.798 4.032 0.002 16 0 "[ . 1 . 2]" 1
260 1 24 GLY H 1 79 VAL MG2 . . 5.500 4.807 4.515 5.209 . 0 0 "[ . 1 . 2]" 1
261 1 24 GLY HA2 1 25 ALA MB . . 4.410 4.059 3.910 4.303 . 0 0 "[ . 1 . 2]" 1
262 1 24 GLY HA2 1 79 VAL HB . . 3.780 3.672 3.505 3.794 0.014 1 0 "[ . 1 . 2]" 1
263 1 24 GLY HA2 1 79 VAL MG2 . . 4.750 4.582 4.328 4.761 0.011 18 0 "[ . 1 . 2]" 1
264 1 24 GLY HA3 1 25 ALA H . . 3.090 2.373 2.155 2.555 . 0 0 "[ . 1 . 2]" 1
265 1 24 GLY HA3 1 25 ALA MB . . 4.690 3.799 3.669 4.349 . 0 0 "[ . 1 . 2]" 1
266 1 24 GLY HA3 1 78 LYS HB3 . . 5.500 4.066 3.645 4.335 . 0 0 "[ . 1 . 2]" 1
267 1 24 GLY HA3 1 79 VAL H . . 4.360 3.661 3.412 3.872 . 0 0 "[ . 1 . 2]" 1
268 1 24 GLY HA3 1 79 VAL HB . . 3.410 2.057 1.981 2.153 . 0 0 "[ . 1 . 2]" 1
269 1 24 GLY HA3 1 79 VAL MG1 . . 4.090 3.300 3.082 3.427 . 0 0 "[ . 1 . 2]" 1
270 1 24 GLY HA3 1 79 VAL MG2 . . 4.060 3.469 3.171 3.687 . 0 0 "[ . 1 . 2]" 1
271 1 25 ALA H 1 25 ALA MB . . 3.060 2.762 2.173 2.914 . 0 0 "[ . 1 . 2]" 1
272 1 25 ALA H 1 79 VAL H . . 4.340 2.088 1.894 3.714 . 0 0 "[ . 1 . 2]" 1
273 1 25 ALA H 1 79 VAL HB . . 3.280 2.383 1.971 2.927 . 0 0 "[ . 1 . 2]" 1
274 1 25 ALA HA 1 26 GLU H . . 2.770 2.174 2.144 2.275 . 0 0 "[ . 1 . 2]" 1
275 1 25 ALA HA 1 78 LYS QG . . 4.790 3.869 3.419 4.583 . 0 0 "[ . 1 . 2]" 1
276 1 25 ALA HA 1 79 VAL HB . . 5.260 4.933 4.650 5.277 0.017 10 0 "[ . 1 . 2]" 1
277 1 25 ALA HA 1 79 VAL MG2 . . 5.260 3.975 3.659 4.489 . 0 0 "[ . 1 . 2]" 1
278 1 25 ALA HA 1 117 VAL QG . . 5.290 4.834 4.159 5.170 . 0 0 "[ . 1 . 2]" 1
279 1 25 ALA MB 1 26 GLU H . . 3.220 3.056 2.663 3.225 0.005 18 0 "[ . 1 . 2]" 1
280 1 25 ALA MB 1 117 VAL HB . . 4.860 4.516 3.712 4.879 0.019 1 0 "[ . 1 . 2]" 1
281 1 25 ALA MB 1 117 VAL QG . . 3.070 2.524 1.866 2.994 . 0 0 "[ . 1 . 2]" 1
282 1 26 GLU H 1 26 GLU QB . . 2.960 2.251 2.227 2.363 . 0 0 "[ . 1 . 2]" 1
283 1 26 GLU H 1 26 GLU QG . . 4.170 3.831 2.402 4.048 . 0 0 "[ . 1 . 2]" 1
284 1 26 GLU H 1 27 ALA H . . 4.870 4.582 4.525 4.631 . 0 0 "[ . 1 . 2]" 1
285 1 26 GLU H 1 78 LYS HA . . 4.780 4.099 3.910 4.454 . 0 0 "[ . 1 . 2]" 1
286 1 26 GLU H 1 117 VAL QG . . 5.260 4.968 4.301 5.268 0.008 2 0 "[ . 1 . 2]" 1
287 1 26 GLU HA 1 26 GLU QG . . 3.510 2.658 2.467 3.450 . 0 0 "[ . 1 . 2]" 1
288 1 26 GLU HA 1 27 ALA H . . 2.850 2.186 2.144 2.278 . 0 0 "[ . 1 . 2]" 1
289 1 26 GLU HA 1 78 LYS HA . . 3.320 2.030 1.976 2.229 . 0 0 "[ . 1 . 2]" 1
290 1 26 GLU HA 1 78 LYS QE . . 4.890 4.439 3.837 4.909 0.019 5 0 "[ . 1 . 2]" 1
291 1 26 GLU HA 1 78 LYS HG2 . . 3.750 2.584 1.991 3.055 . 0 0 "[ . 1 . 2]" 1
292 1 26 GLU HA 1 78 LYS QG . . 3.270 2.333 1.938 2.633 . 0 0 "[ . 1 . 2]" 1
293 1 26 GLU HA 1 78 LYS HG3 . . 3.750 2.938 2.010 3.733 . 0 0 "[ . 1 . 2]" 1
294 1 26 GLU QB 1 27 ALA H . . 3.770 3.555 2.770 3.773 0.003 18 0 "[ . 1 . 2]" 1
295 1 26 GLU QB 1 78 LYS HA . . 4.670 3.888 3.676 4.128 . 0 0 "[ . 1 . 2]" 1
296 1 26 GLU QB 1 78 LYS QE . . 4.760 3.738 2.517 4.615 . 0 0 "[ . 1 . 2]" 1
297 1 26 GLU QB 1 78 LYS HG2 . . 3.950 2.599 2.238 3.125 . 0 0 "[ . 1 . 2]" 1
298 1 26 GLU QB 1 78 LYS QG . . 3.460 2.449 2.174 2.859 . 0 0 "[ . 1 . 2]" 1
299 1 26 GLU QB 1 78 LYS HG3 . . 3.950 3.174 2.529 3.952 0.002 7 0 "[ . 1 . 2]" 1
300 1 26 GLU QG 1 27 ALA H . . 3.450 2.726 2.252 3.496 0.046 1 0 "[ . 1 . 2]" 1
301 1 26 GLU QG 1 27 ALA HA . . 4.880 4.260 4.153 4.423 . 0 0 "[ . 1 . 2]" 1
302 1 26 GLU QG 1 27 ALA MB . . 4.240 3.604 3.392 4.263 0.023 2 0 "[ . 1 . 2]" 1
303 1 26 GLU QG 1 28 ARG HA . . 5.200 4.278 3.774 4.778 . 0 0 "[ . 1 . 2]" 1
304 1 26 GLU QG 1 28 ARG QD . . 5.020 4.548 3.584 5.024 0.004 19 0 "[ . 1 . 2]" 1
305 1 26 GLU QG 1 28 ARG QG . . 4.780 4.525 3.363 4.790 0.010 5 0 "[ . 1 . 2]" 1
306 1 26 GLU QG 1 78 LYS QE . . 4.510 4.430 4.057 4.528 0.018 2 0 "[ . 1 . 2]" 1
307 1 26 GLU QG 1 78 LYS QG . . 4.300 3.441 3.080 4.331 0.031 2 0 "[ . 1 . 2]" 1
308 1 27 ALA H 1 27 ALA HA . . 2.940 2.772 2.760 2.803 . 0 0 "[ . 1 . 2]" 1
309 1 27 ALA H 1 27 ALA MB . . 3.050 2.048 2.027 2.084 . 0 0 "[ . 1 . 2]" 1
310 1 27 ALA H 1 28 ARG QG . . 5.500 5.425 5.263 5.514 0.014 5 0 "[ . 1 . 2]" 1
311 1 27 ALA H 1 61 LEU QD . . 4.940 4.410 4.269 4.647 . 0 0 "[ . 1 . 2]" 1
312 1 27 ALA H 1 74 VAL HA . . 5.360 5.031 4.886 5.195 . 0 0 "[ . 1 . 2]" 1
313 1 27 ALA H 1 76 GLY H . . 5.500 5.376 5.133 5.508 0.008 4 0 "[ . 1 . 2]" 1
314 1 27 ALA H 1 76 GLY QA . . 5.340 4.796 4.651 5.031 . 0 0 "[ . 1 . 2]" 1
315 1 27 ALA H 1 77 MET H . . 4.870 4.673 4.505 4.852 . 0 0 "[ . 1 . 2]" 1
316 1 27 ALA H 1 78 LYS HA . . 3.820 3.052 2.730 3.215 . 0 0 "[ . 1 . 2]" 1
317 1 27 ALA H 1 78 LYS HB3 . . 5.500 5.387 4.858 5.514 0.014 5 0 "[ . 1 . 2]" 1
318 1 27 ALA H 1 79 VAL H . . 4.840 4.665 4.429 4.841 0.001 13 0 "[ . 1 . 2]" 1
319 1 27 ALA H 1 114 LEU QD . . 5.350 3.488 2.776 3.931 . 0 0 "[ . 1 . 2]" 1
320 1 27 ALA H 1 117 VAL QG . . 5.500 4.298 3.533 4.702 . 0 0 "[ . 1 . 2]" 1
321 1 27 ALA HA 1 28 ARG H . . 2.880 2.163 2.141 2.232 . 0 0 "[ . 1 . 2]" 1
322 1 27 ALA HA 1 61 LEU QD . . 4.220 3.718 3.461 4.095 . 0 0 "[ . 1 . 2]" 1
323 1 27 ALA HA 1 117 VAL QG . . 3.280 2.620 1.935 3.291 0.011 13 0 "[ . 1 . 2]" 1
324 1 27 ALA MB 1 33 VAL QG . . 3.640 2.377 2.066 2.660 . 0 0 "[ . 1 . 2]" 1
325 1 27 ALA MB 1 61 LEU QD . . 2.760 1.903 1.703 2.122 . 0 0 "[ . 1 . 2]" 1
326 1 27 ALA MB 1 74 VAL HA . . 4.010 3.355 3.194 3.456 . 0 0 "[ . 1 . 2]" 1
327 1 27 ALA MB 1 74 VAL HB . . 3.750 2.573 2.409 4.049 0.299 14 0 "[ . 1 . 2]" 1
328 1 27 ALA MB 1 74 VAL MG1 . . 3.740 3.458 2.820 3.768 0.028 1 0 "[ . 1 . 2]" 1
329 1 27 ALA MB 1 74 VAL QG . . 3.010 2.946 1.765 3.104 0.094 17 0 "[ . 1 . 2]" 1
330 1 27 ALA MB 1 74 VAL MG2 . . 3.740 3.239 1.783 3.574 . 0 0 "[ . 1 . 2]" 1
331 1 27 ALA MB 1 75 GLN HA . . 4.480 3.332 2.940 3.621 . 0 0 "[ . 1 . 2]" 1
332 1 27 ALA MB 1 76 GLY H . . 4.980 4.491 4.432 4.550 . 0 0 "[ . 1 . 2]" 1
333 1 27 ALA MB 1 77 MET H . . 4.250 4.184 3.944 4.284 0.034 12 0 "[ . 1 . 2]" 1
334 1 27 ALA MB 1 77 MET QB . . 3.940 3.309 2.923 3.645 . 0 0 "[ . 1 . 2]" 1
335 1 27 ALA MB 1 77 MET QG . . 5.120 4.719 3.929 5.129 0.009 14 0 "[ . 1 . 2]" 1
336 1 28 ARG H 1 28 ARG QB . . 3.320 2.311 2.207 2.416 . 0 0 "[ . 1 . 2]" 1
337 1 28 ARG H 1 28 ARG QD . . 4.820 4.176 3.769 4.420 . 0 0 "[ . 1 . 2]" 1
338 1 28 ARG H 1 31 GLN QB . . 4.250 3.833 2.676 4.257 0.007 8 0 "[ . 1 . 2]" 1
339 1 28 ARG H 1 31 GLN QE . . 4.720 4.239 3.506 4.723 0.003 19 0 "[ . 1 . 2]" 1
340 1 28 ARG H 1 61 LEU QD . . 3.960 3.506 3.226 3.914 . 0 0 "[ . 1 . 2]" 1
341 1 28 ARG H 1 117 VAL QG . . 4.120 2.836 1.885 4.138 0.018 17 0 "[ . 1 . 2]" 1
342 1 28 ARG HA 1 28 ARG QD . . 4.000 2.273 1.954 2.537 . 0 0 "[ . 1 . 2]" 1
343 1 28 ARG HA 1 28 ARG QG . . 3.520 2.630 2.428 2.895 . 0 0 "[ . 1 . 2]" 1
344 1 28 ARG HA 1 29 ALA H . . 2.820 2.338 2.230 2.403 . 0 0 "[ . 1 . 2]" 1
345 1 28 ARG HA 1 29 ALA HA . . 4.490 4.344 4.314 4.364 . 0 0 "[ . 1 . 2]" 1
346 1 28 ARG HA 1 29 ALA MB . . 4.920 3.948 3.907 4.045 . 0 0 "[ . 1 . 2]" 1
347 1 28 ARG HA 1 61 LEU QD . . 4.420 3.600 3.177 4.330 . 0 0 "[ . 1 . 2]" 1
348 1 28 ARG HA 1 75 GLN HA . . 5.500 5.352 4.761 5.516 0.016 2 0 "[ . 1 . 2]" 1
349 1 28 ARG QB 1 28 ARG QD . . 3.200 2.257 2.037 2.417 . 0 0 "[ . 1 . 2]" 1
350 1 28 ARG QB 1 29 ALA H . . 3.350 2.571 2.399 2.893 . 0 0 "[ . 1 . 2]" 1
351 1 28 ARG QD 1 29 ALA H . . 4.820 2.993 2.410 3.220 . 0 0 "[ . 1 . 2]" 1
352 1 28 ARG QD 1 29 ALA MB . . 4.460 4.359 3.809 4.466 0.006 9 0 "[ . 1 . 2]" 1
353 1 28 ARG QD 1 61 LEU QD . . 5.250 5.038 4.773 5.305 0.055 17 0 "[ . 1 . 2]" 1
354 1 28 ARG QG 1 29 ALA H . . 4.970 4.191 4.054 4.394 . 0 0 "[ . 1 . 2]" 1
355 1 29 ALA H 1 29 ALA MB . . 2.880 2.155 2.079 2.204 . 0 0 "[ . 1 . 2]" 1
356 1 29 ALA H 1 30 GLY H . . 4.770 4.571 4.522 4.598 . 0 0 "[ . 1 . 2]" 1
357 1 29 ALA H 1 31 GLN H . . 4.710 4.548 4.454 4.702 . 0 0 "[ . 1 . 2]" 1
358 1 29 ALA H 1 61 LEU QD . . 4.330 3.773 3.340 4.409 0.079 17 0 "[ . 1 . 2]" 1
359 1 29 ALA HA 1 30 GLY H . . 3.150 2.243 2.151 2.301 . 0 0 "[ . 1 . 2]" 1
360 1 29 ALA HA 1 61 LEU HA . . 5.320 4.689 4.456 4.913 . 0 0 "[ . 1 . 2]" 1
361 1 29 ALA HA 1 61 LEU HB2 . . 4.310 3.873 3.264 4.278 . 0 0 "[ . 1 . 2]" 1
362 1 29 ALA HA 1 61 LEU QB . . 3.650 2.383 1.911 2.814 . 0 0 "[ . 1 . 2]" 1
363 1 29 ALA HA 1 61 LEU HB3 . . 4.310 2.407 1.923 2.854 . 0 0 "[ . 1 . 2]" 1
364 1 29 ALA HA 1 61 LEU MD1 . . 4.500 3.431 2.546 3.716 . 0 0 "[ . 1 . 2]" 1
365 1 29 ALA HA 1 61 LEU QD . . 3.480 2.723 2.313 2.933 . 0 0 "[ . 1 . 2]" 1
366 1 29 ALA HA 1 61 LEU MD2 . . 4.500 3.144 2.336 4.099 . 0 0 "[ . 1 . 2]" 1
367 1 29 ALA HA 1 61 LEU HG . . 3.500 2.113 1.977 2.624 . 0 0 "[ . 1 . 2]" 1
368 1 29 ALA HA 1 62 GLY QA . . 5.340 4.159 3.894 4.860 . 0 0 "[ . 1 . 2]" 1
369 1 29 ALA MB 1 30 GLY H . . 3.470 2.864 2.706 3.190 . 0 0 "[ . 1 . 2]" 1
370 1 29 ALA MB 1 30 GLY HA2 . . 5.200 4.235 4.069 4.500 . 0 0 "[ . 1 . 2]" 1
371 1 29 ALA MB 1 61 LEU QB . . 4.380 3.816 3.424 4.189 . 0 0 "[ . 1 . 2]" 1
372 1 29 ALA MB 1 62 GLY QA . . 4.290 3.470 2.944 4.309 0.019 17 0 "[ . 1 . 2]" 1
373 1 29 ALA MB 1 75 GLN QG . . 5.320 3.930 3.197 4.532 . 0 0 "[ . 1 . 2]" 1
374 1 30 GLY H 1 31 GLN H . . 3.480 2.563 2.371 2.613 . 0 0 "[ . 1 . 2]" 1
375 1 30 GLY H 1 60 VAL QG . . 4.120 3.223 2.890 3.791 . 0 0 "[ . 1 . 2]" 1
376 1 30 GLY H 1 61 LEU QB . . 3.980 3.009 1.919 3.626 . 0 0 "[ . 1 . 2]" 1
377 1 30 GLY HA2 1 60 VAL HB . . 5.500 5.379 5.215 5.518 0.018 16 0 "[ . 1 . 2]" 1
378 1 30 GLY HA2 1 60 VAL QG . . 3.890 2.700 2.500 2.954 . 0 0 "[ . 1 . 2]" 1
379 1 30 GLY HA2 1 61 LEU QB . . 5.340 4.859 3.759 5.358 0.018 2 0 "[ . 1 . 2]" 1
380 1 31 GLN H 1 31 GLN QB . . 2.920 2.447 2.356 2.503 . 0 0 "[ . 1 . 2]" 1
381 1 31 GLN H 1 32 THR H . . 4.660 4.493 4.477 4.514 . 0 0 "[ . 1 . 2]" 1
382 1 31 GLN H 1 60 VAL QG . . 3.690 3.186 2.720 3.638 . 0 0 "[ . 1 . 2]" 1
383 1 31 GLN H 1 61 LEU H . . 4.780 3.435 3.225 3.554 . 0 0 "[ . 1 . 2]" 1
384 1 31 GLN HA 1 31 GLN HG2 . . 4.080 2.708 2.177 3.264 . 0 0 "[ . 1 . 2]" 1
385 1 31 GLN HA 1 31 GLN QG . . 3.360 2.264 2.145 2.404 . 0 0 "[ . 1 . 2]" 1
386 1 31 GLN HA 1 31 GLN HG3 . . 4.080 2.663 2.219 3.480 . 0 0 "[ . 1 . 2]" 1
387 1 31 GLN HA 1 32 THR H . . 2.960 2.283 2.183 2.306 . 0 0 "[ . 1 . 2]" 1
388 1 31 GLN QG 1 32 THR H . . 3.980 2.971 1.992 3.885 . 0 0 "[ . 1 . 2]" 1
389 1 32 THR H 1 32 THR HB . . 3.320 2.734 2.486 2.981 . 0 0 "[ . 1 . 2]" 1
390 1 32 THR H 1 32 THR MG . . 3.830 3.770 3.648 3.807 . 0 0 "[ . 1 . 2]" 1
391 1 32 THR HA 1 32 THR MG . . 3.250 2.206 2.066 2.320 . 0 0 "[ . 1 . 2]" 1
392 1 32 THR HA 1 33 VAL H . . 3.130 2.195 2.142 2.430 . 0 0 "[ . 1 . 2]" 1
393 1 32 THR HA 1 33 VAL QG . . 4.310 3.468 3.319 3.659 . 0 0 "[ . 1 . 2]" 1
394 1 32 THR HA 1 60 VAL HA . . 3.300 1.993 1.896 2.183 . 0 0 "[ . 1 . 2]" 1
395 1 32 THR HA 1 60 VAL MG1 . . 3.900 3.636 3.199 4.092 0.192 19 0 "[ . 1 . 2]" 1
396 1 32 THR HA 1 60 VAL QG . . 3.350 2.804 2.581 3.119 . 0 0 "[ . 1 . 2]" 1
397 1 32 THR HA 1 60 VAL MG2 . . 3.900 2.937 2.635 3.462 . 0 0 "[ . 1 . 2]" 1
398 1 32 THR HA 1 61 LEU H . . 3.790 3.333 2.973 3.674 . 0 0 "[ . 1 . 2]" 1
399 1 32 THR MG 1 33 VAL H . . 3.510 2.604 1.966 3.096 . 0 0 "[ . 1 . 2]" 1
400 1 32 THR MG 1 33 VAL HA . . 4.260 4.005 3.540 4.232 . 0 0 "[ . 1 . 2]" 1
401 1 32 THR MG 1 58 ALA HA . . 4.410 3.407 3.004 4.431 0.021 17 0 "[ . 1 . 2]" 1
402 1 32 THR MG 1 59 PHE H . . 3.840 2.906 2.480 3.862 0.022 17 0 "[ . 1 . 2]" 1
403 1 33 VAL H 1 33 VAL QG . . 3.280 2.120 1.903 2.453 . 0 0 "[ . 1 . 2]" 1
404 1 33 VAL H 1 34 SER H . . 4.850 4.412 4.142 4.545 . 0 0 "[ . 1 . 2]" 1
405 1 33 VAL H 1 60 VAL HA . . 4.520 3.325 2.559 3.808 . 0 0 "[ . 1 . 2]" 1
406 1 33 VAL H 1 61 LEU H . . 4.690 3.870 3.231 4.699 0.009 9 0 "[ . 1 . 2]" 1
407 1 33 VAL HA 1 34 SER H . . 3.200 2.219 2.166 2.355 . 0 0 "[ . 1 . 2]" 1
408 1 33 VAL HA 1 117 VAL HA . . 3.460 2.361 2.093 3.097 . 0 0 "[ . 1 . 2]" 1
409 1 33 VAL HA 1 117 VAL HB . . 5.500 4.662 3.820 5.259 . 0 0 "[ . 1 . 2]" 1
410 1 33 VAL HA 1 117 VAL QG . . 4.100 3.313 2.967 3.657 . 0 0 "[ . 1 . 2]" 1
411 1 33 VAL HB 1 34 SER H . . 4.200 3.289 2.528 4.104 . 0 0 "[ . 1 . 2]" 1
412 1 33 VAL HB 1 117 VAL HA . . 3.660 2.799 2.240 3.378 . 0 0 "[ . 1 . 2]" 1
413 1 33 VAL QG 1 34 SER H . . 3.640 2.998 2.154 3.450 . 0 0 "[ . 1 . 2]" 1
414 1 33 VAL QG 1 34 SER HA . . 4.790 3.781 3.472 4.072 . 0 0 "[ . 1 . 2]" 1
415 1 33 VAL QG 1 35 VAL MG1 . . 3.080 2.103 1.827 2.409 . 0 0 "[ . 1 . 2]" 1
416 1 33 VAL QG 1 35 VAL MG2 . . 4.090 3.374 3.211 3.793 . 0 0 "[ . 1 . 2]" 1
417 1 33 VAL QG 1 58 ALA HA . . 4.860 4.104 3.911 4.651 . 0 0 "[ . 1 . 2]" 1
418 1 33 VAL QG 1 59 PHE H . . 3.850 3.102 2.845 3.584 . 0 0 "[ . 1 . 2]" 1
419 1 33 VAL QG 1 59 PHE HA . . 5.440 4.947 4.670 5.300 . 0 0 "[ . 1 . 2]" 1
420 1 33 VAL QG 1 59 PHE QD . . 4.010 3.407 3.120 3.736 . 0 0 "[ . 1 . 2]" 1
421 1 33 VAL QG 1 59 PHE QE . . 3.660 2.915 2.466 3.244 . 0 0 "[ . 1 . 2]" 1
422 1 33 VAL QG 1 59 PHE HZ . . 4.060 3.323 3.030 3.630 . 0 0 "[ . 1 . 2]" 1
423 1 33 VAL QG 1 60 VAL HA . . 5.080 3.879 3.299 4.281 . 0 0 "[ . 1 . 2]" 1
424 1 33 VAL QG 1 61 LEU H . . 4.380 3.305 2.863 3.976 . 0 0 "[ . 1 . 2]" 1
425 1 33 VAL QG 1 61 LEU HA . . 4.780 3.921 3.444 4.238 . 0 0 "[ . 1 . 2]" 1
426 1 33 VAL QG 1 61 LEU QB . . 3.990 2.683 2.084 3.405 . 0 0 "[ . 1 . 2]" 1
427 1 33 VAL QG 1 61 LEU QD . . 4.210 2.760 2.137 3.117 . 0 0 "[ . 1 . 2]" 1
428 1 33 VAL QG 1 61 LEU HG . . 4.620 4.619 4.299 4.705 0.085 19 0 "[ . 1 . 2]" 1
429 1 33 VAL QG 1 74 VAL HA . . 5.370 4.902 4.576 5.192 . 0 0 "[ . 1 . 2]" 1
430 1 33 VAL QG 1 74 VAL HB . . 4.860 3.399 3.164 4.374 . 0 0 "[ . 1 . 2]" 1
431 1 33 VAL QG 1 117 VAL HA . . 3.060 2.267 1.943 2.662 . 0 0 "[ . 1 . 2]" 1
432 1 33 VAL MG1 1 34 SER H . . 4.390 3.918 3.780 4.026 . 0 0 "[ . 1 . 2]" 1
433 1 33 VAL MG2 1 34 SER H . . 4.390 3.206 2.165 3.857 . 0 0 "[ . 1 . 2]" 1
434 1 34 SER H 1 34 SER QB . . 3.450 2.621 2.212 3.021 . 0 0 "[ . 1 . 2]" 1
435 1 34 SER H 1 35 VAL MG1 . . 3.960 3.664 3.507 3.719 . 0 0 "[ . 1 . 2]" 1
436 1 34 SER H 1 116 ASP QB . . 4.360 3.482 3.009 3.929 . 0 0 "[ . 1 . 2]" 1
437 1 34 SER H 1 117 VAL HA . . 4.410 3.153 2.887 3.744 . 0 0 "[ . 1 . 2]" 1
438 1 34 SER HA 1 35 VAL H . . 3.250 2.141 2.138 2.171 . 0 0 "[ . 1 . 2]" 1
439 1 34 SER HA 1 35 VAL MG1 . . 3.870 3.544 3.464 3.627 . 0 0 "[ . 1 . 2]" 1
440 1 34 SER HA 1 35 VAL MG2 . . 4.490 4.052 3.910 4.166 . 0 0 "[ . 1 . 2]" 1
441 1 34 SER HA 1 58 ALA HA . . 3.300 2.051 1.990 2.243 . 0 0 "[ . 1 . 2]" 1
442 1 34 SER HA 1 58 ALA MB . . 3.660 3.158 2.978 3.572 . 0 0 "[ . 1 . 2]" 1
443 1 34 SER HA 1 59 PHE H . . 4.100 3.507 2.996 3.622 . 0 0 "[ . 1 . 2]" 1
444 1 34 SER HA 1 115 LEU MD1 . . 4.710 4.494 4.263 4.724 0.014 12 0 "[ . 1 . 2]" 1
445 1 34 SER HA 1 116 ASP QB . . 5.500 5.238 4.816 5.538 0.038 13 0 "[ . 1 . 2]" 1
446 1 34 SER QB 1 35 VAL MG1 . . 4.740 4.186 4.093 4.390 . 0 0 "[ . 1 . 2]" 1
447 1 34 SER QB 1 58 ALA HA . . 4.560 3.363 3.002 3.864 . 0 0 "[ . 1 . 2]" 1
448 1 34 SER QB 1 58 ALA MB . . 4.250 2.926 2.432 3.364 . 0 0 "[ . 1 . 2]" 1
449 1 34 SER QB 1 115 LEU H . . 5.110 4.289 3.999 4.892 . 0 0 "[ . 1 . 2]" 1
450 1 34 SER QB 1 115 LEU QB . . 4.380 2.914 2.620 3.802 . 0 0 "[ . 1 . 2]" 1
451 1 34 SER QB 1 115 LEU MD1 . . 4.570 3.405 2.717 4.271 . 0 0 "[ . 1 . 2]" 1
452 1 34 SER QB 1 116 ASP H . . 3.840 3.323 2.823 3.737 . 0 0 "[ . 1 . 2]" 1
453 1 34 SER QB 1 116 ASP QB . . 3.610 2.913 2.472 3.392 . 0 0 "[ . 1 . 2]" 1
454 1 35 VAL H 1 35 VAL MG1 . . 4.060 2.830 2.730 2.890 . 0 0 "[ . 1 . 2]" 1
455 1 35 VAL H 1 35 VAL MG2 . . 3.590 2.424 2.371 2.475 . 0 0 "[ . 1 . 2]" 1
456 1 35 VAL H 1 57 PHE H . . 4.020 3.115 2.755 3.635 . 0 0 "[ . 1 . 2]" 1
457 1 35 VAL H 1 57 PHE QB . . 5.250 3.232 3.062 3.476 . 0 0 "[ . 1 . 2]" 1
458 1 35 VAL H 1 58 ALA HA . . 4.480 3.575 3.342 3.736 . 0 0 "[ . 1 . 2]" 1
459 1 35 VAL H 1 115 LEU MD1 . . 5.060 3.556 3.373 3.704 . 0 0 "[ . 1 . 2]" 1
460 1 35 VAL HA 1 35 VAL MG1 . . 3.430 2.448 2.408 2.516 . 0 0 "[ . 1 . 2]" 1
461 1 35 VAL HA 1 36 HIS H . . 3.320 2.393 2.321 2.497 . 0 0 "[ . 1 . 2]" 1
462 1 35 VAL HA 1 112 VAL QG . . 5.370 4.779 4.506 5.123 . 0 0 "[ . 1 . 2]" 1
463 1 35 VAL HA 1 113 GLU H . . 5.110 4.829 4.616 5.027 . 0 0 "[ . 1 . 2]" 1
464 1 35 VAL HA 1 114 LEU HA . . 3.870 2.897 2.643 3.053 . 0 0 "[ . 1 . 2]" 1
465 1 35 VAL HA 1 115 LEU H . . 3.920 2.307 2.146 2.416 . 0 0 "[ . 1 . 2]" 1
466 1 35 VAL HA 1 115 LEU QB . . 4.350 2.803 2.485 3.295 . 0 0 "[ . 1 . 2]" 1
467 1 35 VAL HA 1 115 LEU MD1 . . 3.960 2.187 1.895 2.710 . 0 0 "[ . 1 . 2]" 1
468 1 35 VAL HA 1 115 LEU HG . . 3.890 3.300 2.518 3.926 0.036 14 0 "[ . 1 . 2]" 1
469 1 35 VAL HA 1 116 ASP H . . 4.820 3.868 3.712 3.981 . 0 0 "[ . 1 . 2]" 1
470 1 35 VAL HB 1 36 HIS H . . 3.570 2.493 2.285 2.656 . 0 0 "[ . 1 . 2]" 1
471 1 35 VAL HB 1 59 PHE QE . . 5.040 4.619 4.417 4.863 . 0 0 "[ . 1 . 2]" 1
472 1 35 VAL HB 1 112 VAL QG . . 3.600 2.891 2.632 3.287 . 0 0 "[ . 1 . 2]" 1
473 1 35 VAL HB 1 113 GLU H . . 4.520 3.361 3.149 3.574 . 0 0 "[ . 1 . 2]" 1
474 1 35 VAL HB 1 115 LEU H . . 4.880 3.594 3.280 3.849 . 0 0 "[ . 1 . 2]" 1
475 1 35 VAL MG1 1 36 HIS H . . 4.360 3.886 3.799 3.959 . 0 0 "[ . 1 . 2]" 1
476 1 35 VAL MG1 1 59 PHE QD . . 4.230 4.128 3.952 4.237 0.007 7 0 "[ . 1 . 2]" 1
477 1 35 VAL MG1 1 59 PHE QE . . 3.670 2.933 2.630 3.121 . 0 0 "[ . 1 . 2]" 1
478 1 35 VAL MG1 1 115 LEU H . . 3.650 2.348 2.185 2.610 . 0 0 "[ . 1 . 2]" 1
479 1 35 VAL MG1 1 116 ASP H . . 4.050 3.286 2.940 3.703 . 0 0 "[ . 1 . 2]" 1
480 1 35 VAL MG2 1 36 HIS H . . 4.170 3.108 2.941 3.288 . 0 0 "[ . 1 . 2]" 1
481 1 35 VAL MG2 1 36 HIS HA . . 4.320 3.730 3.596 3.854 . 0 0 "[ . 1 . 2]" 1
482 1 35 VAL MG2 1 36 HIS QB . . 5.340 4.487 4.410 4.586 . 0 0 "[ . 1 . 2]" 1
483 1 35 VAL MG2 1 37 TYR HB3 . . 4.790 3.469 3.353 3.574 . 0 0 "[ . 1 . 2]" 1
484 1 35 VAL MG2 1 37 TYR QD . . 3.720 3.757 3.688 3.792 0.072 5 0 "[ . 1 . 2]" 1
485 1 35 VAL MG2 1 57 PHE QB . . 3.780 2.916 2.708 3.214 . 0 0 "[ . 1 . 2]" 1
486 1 35 VAL MG2 1 57 PHE QE . . 4.800 4.460 4.088 4.801 0.001 19 0 "[ . 1 . 2]" 1
487 1 35 VAL MG2 1 59 PHE QD . . 3.670 3.222 3.015 3.409 . 0 0 "[ . 1 . 2]" 1
488 1 35 VAL MG2 1 59 PHE QE . . 3.200 2.024 1.879 2.341 . 0 0 "[ . 1 . 2]" 1
489 1 35 VAL MG2 1 70 TRP HD1 . . 4.580 4.500 4.173 4.596 0.016 19 0 "[ . 1 . 2]" 1
490 1 35 VAL MG2 1 70 TRP HZ2 . . 5.350 4.887 4.342 5.364 0.014 19 0 "[ . 1 . 2]" 1
491 1 36 HIS H 1 113 GLU H . . 3.900 2.907 2.534 3.217 . 0 0 "[ . 1 . 2]" 1
492 1 36 HIS H 1 113 GLU QG . . 3.950 2.937 2.297 3.974 0.024 15 0 "[ . 1 . 2]" 1
493 1 36 HIS H 1 115 LEU H . . 4.730 4.165 4.008 4.374 . 0 0 "[ . 1 . 2]" 1
494 1 36 HIS H 1 115 LEU MD1 . . 4.090 2.369 1.907 3.246 . 0 0 "[ . 1 . 2]" 1
495 1 36 HIS H 1 115 LEU MD2 . . 4.700 4.540 4.016 4.737 0.037 16 0 "[ . 1 . 2]" 1
496 1 36 HIS H 1 115 LEU HG . . 4.140 3.551 2.849 4.100 . 0 0 "[ . 1 . 2]" 1
497 1 36 HIS HA 1 36 HIS HD2 . . 4.870 4.571 4.362 4.653 . 0 0 "[ . 1 . 2]" 1
498 1 36 HIS HA 1 36 HIS HE1 . . 5.500 4.380 4.346 4.523 . 0 0 "[ . 1 . 2]" 1
499 1 36 HIS HA 1 37 TYR H . . 3.550 2.165 2.164 2.167 . 0 0 "[ . 1 . 2]" 1
500 1 36 HIS HA 1 37 TYR QD . . 5.280 3.845 3.770 3.900 . 0 0 "[ . 1 . 2]" 1
501 1 36 HIS HA 1 56 PRO HA . . 4.650 3.711 3.361 4.093 . 0 0 "[ . 1 . 2]" 1
502 1 36 HIS HA 1 57 PHE H . . 4.780 3.186 2.836 3.385 . 0 0 "[ . 1 . 2]" 1
503 1 36 HIS HA 1 115 LEU MD1 . . 4.450 3.221 3.028 3.436 . 0 0 "[ . 1 . 2]" 1
504 1 36 HIS QB 1 36 HIS HD2 . . 3.370 2.644 2.626 2.659 . 0 0 "[ . 1 . 2]" 1
505 1 36 HIS QB 1 37 TYR H . . 3.920 3.227 3.183 3.265 . 0 0 "[ . 1 . 2]" 1
506 1 36 HIS QB 1 51 LYS QD . . 4.390 3.560 2.229 4.394 0.004 19 0 "[ . 1 . 2]" 1
507 1 36 HIS QB 1 51 LYS QG . . 3.870 3.623 2.589 3.962 0.092 13 0 "[ . 1 . 2]" 1
508 1 36 HIS QB 1 82 VAL QG . . 5.340 4.616 4.419 4.784 . 0 0 "[ . 1 . 2]" 1
509 1 36 HIS QB 1 113 GLU H . . 4.760 3.500 3.249 3.692 . 0 0 "[ . 1 . 2]" 1
510 1 36 HIS QB 1 113 GLU QB . . 4.750 3.069 1.965 3.819 . 0 0 "[ . 1 . 2]" 1
511 1 36 HIS QB 1 113 GLU QG . . 4.080 2.319 1.824 3.393 . 0 0 "[ . 1 . 2]" 1
512 1 36 HIS QB 1 115 LEU MD1 . . 4.480 2.362 1.952 3.107 . 0 0 "[ . 1 . 2]" 1
513 1 36 HIS HB2 1 36 HIS HD2 . . 3.870 2.743 2.690 2.777 . 0 0 "[ . 1 . 2]" 1
514 1 36 HIS HB2 1 37 TYR H . . 4.580 4.374 4.340 4.398 . 0 0 "[ . 1 . 2]" 1
515 1 36 HIS HB3 1 36 HIS HD2 . . 3.870 3.471 3.400 3.665 . 0 0 "[ . 1 . 2]" 1
516 1 36 HIS HB3 1 37 TYR H . . 4.580 3.323 3.273 3.366 . 0 0 "[ . 1 . 2]" 1
517 1 36 HIS HD2 1 51 LYS HA . . 5.500 5.416 4.302 5.531 0.031 10 0 "[ . 1 . 2]" 1
518 1 36 HIS HD2 1 51 LYS QD . . 4.190 3.133 2.435 4.188 . 0 0 "[ . 1 . 2]" 1
519 1 36 HIS HD2 1 51 LYS QE . . 4.200 3.659 2.370 4.294 0.094 13 0 "[ . 1 . 2]" 1
520 1 36 HIS HD2 1 51 LYS QG . . 4.980 4.188 3.370 4.883 . 0 0 "[ . 1 . 2]" 1
521 1 36 HIS HD2 1 113 GLU QG . . 4.610 3.935 3.435 4.649 0.039 15 0 "[ . 1 . 2]" 1
522 1 36 HIS HD2 1 115 LEU MD1 . . 3.390 2.526 2.304 2.725 . 0 0 "[ . 1 . 2]" 1
523 1 36 HIS HD2 1 115 LEU MD2 . . 3.390 2.392 2.016 2.791 . 0 0 "[ . 1 . 2]" 1
524 1 36 HIS HD2 1 115 LEU HG . . 4.870 3.731 3.032 3.953 . 0 0 "[ . 1 . 2]" 1
525 1 36 HIS HE1 1 50 SER QB . . 3.960 3.240 2.501 3.964 0.004 14 0 "[ . 1 . 2]" 1
526 1 36 HIS HE1 1 51 LYS HA . . 3.600 3.006 2.464 3.620 0.020 2 0 "[ . 1 . 2]" 1
527 1 36 HIS HE1 1 51 LYS QD . . 4.020 3.450 2.880 4.051 0.031 19 0 "[ . 1 . 2]" 1
528 1 36 HIS HE1 1 51 LYS QE . . 5.490 4.958 2.381 5.492 0.002 17 0 "[ . 1 . 2]" 1
529 1 36 HIS HE1 1 51 LYS QG . . 5.210 4.013 2.943 5.022 . 0 0 "[ . 1 . 2]" 1
530 1 36 HIS HE1 1 54 ASN HA . . 4.580 4.557 3.798 4.623 0.043 14 0 "[ . 1 . 2]" 1
531 1 36 HIS HE1 1 55 ASP H . . 3.700 3.108 2.794 3.400 . 0 0 "[ . 1 . 2]" 1
532 1 36 HIS HE1 1 55 ASP HA . . 4.810 3.998 3.766 4.471 . 0 0 "[ . 1 . 2]" 1
533 1 36 HIS HE1 1 55 ASP QB . . 5.340 4.707 4.449 4.985 . 0 0 "[ . 1 . 2]" 1
534 1 36 HIS HE1 1 56 PRO HA . . 4.050 2.716 2.482 2.948 . 0 0 "[ . 1 . 2]" 1
535 1 36 HIS HE1 1 56 PRO HB3 . . 4.600 4.321 3.590 4.593 . 0 0 "[ . 1 . 2]" 1
536 1 36 HIS HE1 1 56 PRO HD2 . . 5.060 5.034 4.767 5.119 0.059 14 0 "[ . 1 . 2]" 1
537 1 36 HIS HE1 1 56 PRO QD . . 4.290 4.005 3.450 4.124 . 0 0 "[ . 1 . 2]" 1
538 1 36 HIS HE1 1 56 PRO HD3 . . 5.060 4.208 3.539 4.350 . 0 0 "[ . 1 . 2]" 1
539 1 36 HIS HE1 1 56 PRO QG . . 5.350 5.166 4.651 5.333 . 0 0 "[ . 1 . 2]" 1
540 1 36 HIS HE1 1 115 LEU MD1 . . 4.540 3.956 3.475 4.384 . 0 0 "[ . 1 . 2]" 1
541 1 37 TYR H 1 37 TYR QD . . 4.280 2.759 2.679 2.817 . 0 0 "[ . 1 . 2]" 1
542 1 37 TYR H 1 38 THR H . . 4.920 4.455 4.424 4.477 . 0 0 "[ . 1 . 2]" 1
543 1 37 TYR H 1 50 SER H . . 4.100 3.670 3.446 3.938 . 0 0 "[ . 1 . 2]" 1
544 1 37 TYR H 1 50 SER QB . . 4.860 2.437 1.867 3.638 . 0 0 "[ . 1 . 2]" 1
545 1 37 TYR H 1 51 LYS H . . 5.140 5.052 4.893 5.206 0.066 2 0 "[ . 1 . 2]" 1
546 1 37 TYR HA 1 37 TYR QD . . 4.400 3.725 3.717 3.729 . 0 0 "[ . 1 . 2]" 1
547 1 37 TYR HA 1 38 THR H . . 3.360 2.211 2.182 2.254 . 0 0 "[ . 1 . 2]" 1
548 1 37 TYR HA 1 112 VAL HA . . 3.850 2.776 2.614 2.934 . 0 0 "[ . 1 . 2]" 1
549 1 37 TYR HA 1 112 VAL MG1 . . 4.650 3.972 3.573 4.226 . 0 0 "[ . 1 . 2]" 1
550 1 37 TYR HA 1 112 VAL MG2 . . 4.650 3.424 3.055 3.824 . 0 0 "[ . 1 . 2]" 1
551 1 37 TYR HA 1 113 GLU H . . 4.370 3.888 3.755 3.999 . 0 0 "[ . 1 . 2]" 1
552 1 37 TYR HB2 1 112 VAL QG . . 4.860 3.652 3.267 4.038 . 0 0 "[ . 1 . 2]" 1
553 1 37 TYR HB3 1 38 THR H . . 4.440 4.108 4.051 4.177 . 0 0 "[ . 1 . 2]" 1
554 1 37 TYR HB3 1 57 PHE QD . . 4.390 3.872 3.391 4.246 . 0 0 "[ . 1 . 2]" 1
555 1 37 TYR HB3 1 70 TRP HZ2 . . 3.610 2.498 2.257 2.988 . 0 0 "[ . 1 . 2]" 1
556 1 37 TYR HB3 1 112 VAL HA . . 4.870 4.260 4.099 4.416 . 0 0 "[ . 1 . 2]" 1
557 1 37 TYR HB3 1 112 VAL MG1 . . 4.640 4.031 3.510 4.382 . 0 0 "[ . 1 . 2]" 1
558 1 37 TYR HB3 1 112 VAL QG . . 4.070 3.514 3.174 3.874 . 0 0 "[ . 1 . 2]" 1
559 1 37 TYR HB3 1 112 VAL MG2 . . 4.640 3.893 3.447 4.378 . 0 0 "[ . 1 . 2]" 1
560 1 37 TYR QD 1 38 THR H . . 4.350 3.648 3.431 3.774 . 0 0 "[ . 1 . 2]" 1
561 1 37 TYR QD 1 38 THR HA . . 4.290 3.337 3.246 3.453 . 0 0 "[ . 1 . 2]" 1
562 1 37 TYR QD 1 39 GLY H . . 4.490 3.599 3.325 4.322 . 0 0 "[ . 1 . 2]" 1
563 1 37 TYR QD 1 48 ASP QB . . 4.090 3.120 2.568 4.155 0.065 11 0 "[ . 1 . 2]" 1
564 1 37 TYR QD 1 50 SER H . . 4.740 3.933 3.709 4.418 . 0 0 "[ . 1 . 2]" 1
565 1 37 TYR QD 1 57 PHE H . . 4.570 4.461 3.903 4.604 0.034 16 0 "[ . 1 . 2]" 1
566 1 37 TYR QD 1 57 PHE HA . . 5.500 5.035 4.421 5.203 . 0 0 "[ . 1 . 2]" 1
567 1 37 TYR QD 1 57 PHE QB . . 3.290 2.402 1.930 2.544 . 0 0 "[ . 1 . 2]" 1
568 1 37 TYR QD 1 57 PHE QD . . 3.230 2.718 2.147 3.101 . 0 0 "[ . 1 . 2]" 1
569 1 37 TYR QD 1 70 TRP HH2 . . 4.360 4.275 4.112 4.381 0.021 14 0 "[ . 1 . 2]" 1
570 1 37 TYR QD 1 70 TRP HZ2 . . 3.840 3.537 3.354 3.834 . 0 0 "[ . 1 . 2]" 1
571 1 37 TYR QE 1 38 THR HA . . 5.110 4.697 4.556 4.765 . 0 0 "[ . 1 . 2]" 1
572 1 37 TYR QE 1 38 THR MG . . 5.500 5.547 5.517 5.572 0.072 17 0 "[ . 1 . 2]" 1
573 1 37 TYR QE 1 39 GLY HA3 . . 5.500 5.507 5.392 5.533 0.033 15 0 "[ . 1 . 2]" 1
574 1 37 TYR QE 1 48 ASP HA . . 4.600 4.128 3.800 4.473 . 0 0 "[ . 1 . 2]" 1
575 1 37 TYR QE 1 48 ASP QB . . 3.570 2.805 2.405 3.352 . 0 0 "[ . 1 . 2]" 1
576 1 37 TYR QE 1 49 SER H . . 4.880 3.940 3.631 4.284 . 0 0 "[ . 1 . 2]" 1
577 1 37 TYR QE 1 49 SER HA . . 4.810 4.426 3.780 4.817 0.007 13 0 "[ . 1 . 2]" 1
578 1 37 TYR QE 1 50 SER H . . 4.830 3.887 3.335 4.572 . 0 0 "[ . 1 . 2]" 1
579 1 37 TYR QE 1 50 SER HA . . 4.980 3.999 3.622 4.733 . 0 0 "[ . 1 . 2]" 1
580 1 37 TYR QE 1 50 SER QB . . 4.650 3.109 2.365 4.185 . 0 0 "[ . 1 . 2]" 1
581 1 37 TYR QE 1 57 PHE H . . 5.250 4.944 4.266 5.121 . 0 0 "[ . 1 . 2]" 1
582 1 37 TYR QE 1 57 PHE HB2 . . 3.780 2.324 2.045 2.542 . 0 0 "[ . 1 . 2]" 1
583 1 37 TYR QE 1 57 PHE QB . . 3.120 2.295 2.036 2.502 . 0 0 "[ . 1 . 2]" 1
584 1 37 TYR QE 1 57 PHE HB3 . . 3.780 3.579 3.326 3.769 . 0 0 "[ . 1 . 2]" 1
585 1 37 TYR QE 1 57 PHE QD . . 3.450 3.360 3.132 3.470 0.020 15 0 "[ . 1 . 2]" 1
586 1 38 THR H 1 38 THR HB . . 4.200 3.326 3.234 3.416 . 0 0 "[ . 1 . 2]" 1
587 1 38 THR H 1 38 THR MG . . 4.780 3.862 3.780 3.927 . 0 0 "[ . 1 . 2]" 1
588 1 38 THR H 1 110 PHE HB3 . . 4.770 4.051 3.937 4.138 . 0 0 "[ . 1 . 2]" 1
589 1 38 THR H 1 110 PHE QD . . 4.840 3.774 3.646 4.033 . 0 0 "[ . 1 . 2]" 1
590 1 38 THR H 1 111 GLU H . . 4.020 2.656 2.584 2.799 . 0 0 "[ . 1 . 2]" 1
591 1 38 THR H 1 111 GLU QB . . 4.690 3.187 3.075 3.305 . 0 0 "[ . 1 . 2]" 1
592 1 38 THR H 1 112 VAL HA . . 4.630 4.078 3.962 4.186 . 0 0 "[ . 1 . 2]" 1
593 1 38 THR HA 1 38 THR MG . . 3.480 1.962 1.945 1.991 . 0 0 "[ . 1 . 2]" 1
594 1 38 THR HA 1 39 GLY H . . 3.360 2.159 2.145 2.249 . 0 0 "[ . 1 . 2]" 1
595 1 38 THR HA 1 46 LYS QD . . 5.170 4.471 3.577 5.185 0.015 17 0 "[ . 1 . 2]" 1
596 1 38 THR HA 1 49 SER HA . . 3.350 2.686 2.498 2.838 . 0 0 "[ . 1 . 2]" 1
597 1 38 THR HA 1 49 SER QB . . 4.480 4.021 3.599 4.397 . 0 0 "[ . 1 . 2]" 1
598 1 38 THR HA 1 50 SER H . . 4.380 3.678 3.256 4.113 . 0 0 "[ . 1 . 2]" 1
599 1 38 THR HB 1 39 GLY H . . 5.040 3.801 3.319 3.994 . 0 0 "[ . 1 . 2]" 1
600 1 38 THR HB 1 40 TRP HE3 . . 5.440 4.182 3.976 4.353 . 0 0 "[ . 1 . 2]" 1
601 1 38 THR HB 1 40 TRP HH2 . . 4.020 3.886 3.663 4.025 0.005 20 0 "[ . 1 . 2]" 1
602 1 38 THR HB 1 40 TRP HZ2 . . 4.120 3.936 3.600 4.123 0.003 19 0 "[ . 1 . 2]" 1
603 1 38 THR HB 1 40 TRP HZ3 . . 4.630 4.007 3.724 4.235 . 0 0 "[ . 1 . 2]" 1
604 1 38 THR HB 1 111 GLU HB2 . . 4.590 3.490 3.081 4.109 . 0 0 "[ . 1 . 2]" 1
605 1 38 THR HB 1 111 GLU HB3 . . 4.590 2.719 2.364 3.223 . 0 0 "[ . 1 . 2]" 1
606 1 38 THR MG 1 39 GLY H . . 3.570 3.214 2.603 3.392 . 0 0 "[ . 1 . 2]" 1
607 1 38 THR MG 1 40 TRP HD1 . . 5.190 4.719 4.449 5.045 . 0 0 "[ . 1 . 2]" 1
608 1 38 THR MG 1 40 TRP HE1 . . 4.060 3.402 3.136 3.741 . 0 0 "[ . 1 . 2]" 1
609 1 38 THR MG 1 40 TRP HE3 . . 5.400 5.130 4.792 5.375 . 0 0 "[ . 1 . 2]" 1
610 1 38 THR MG 1 40 TRP HH2 . . 4.000 3.819 3.476 4.007 0.007 2 0 "[ . 1 . 2]" 1
611 1 38 THR MG 1 40 TRP HZ2 . . 3.420 2.995 2.673 3.264 . 0 0 "[ . 1 . 2]" 1
612 1 38 THR MG 1 40 TRP HZ3 . . 5.030 4.843 4.549 5.032 0.002 5 0 "[ . 1 . 2]" 1
613 1 38 THR MG 1 46 LYS HB2 . . 5.320 4.600 4.285 4.903 . 0 0 "[ . 1 . 2]" 1
614 1 38 THR MG 1 46 LYS HB3 . . 5.400 5.245 4.780 5.409 0.009 4 0 "[ . 1 . 2]" 1
615 1 38 THR MG 1 46 LYS QD . . 3.570 2.657 1.916 3.455 . 0 0 "[ . 1 . 2]" 1
616 1 38 THR MG 1 46 LYS QE . . 4.020 3.016 1.950 4.027 0.007 7 0 "[ . 1 . 2]" 1
617 1 38 THR MG 1 48 ASP H . . 4.820 4.603 4.283 4.850 0.030 11 0 "[ . 1 . 2]" 1
618 1 38 THR MG 1 49 SER HA . . 4.060 2.305 1.977 2.818 . 0 0 "[ . 1 . 2]" 1
619 1 38 THR MG 1 49 SER HB2 . . 4.210 2.941 2.383 3.913 . 0 0 "[ . 1 . 2]" 1
620 1 38 THR MG 1 49 SER QB . . 3.490 2.675 2.335 3.212 . 0 0 "[ . 1 . 2]" 1
621 1 38 THR MG 1 49 SER HB3 . . 4.210 3.510 2.565 4.212 0.002 4 0 "[ . 1 . 2]" 1
622 1 39 GLY H 1 40 TRP H . . 4.610 4.486 4.370 4.537 . 0 0 "[ . 1 . 2]" 1
623 1 39 GLY H 1 46 LYS HG2 . . 5.430 4.302 3.543 4.992 . 0 0 "[ . 1 . 2]" 1
624 1 39 GLY H 1 46 LYS HG3 . . 5.500 3.935 3.727 4.342 . 0 0 "[ . 1 . 2]" 1
625 1 39 GLY H 1 48 ASP H . . 4.070 3.492 3.326 3.625 . 0 0 "[ . 1 . 2]" 1
626 1 39 GLY H 1 48 ASP QB . . 5.140 2.437 2.123 4.095 . 0 0 "[ . 1 . 2]" 1
627 1 39 GLY H 1 110 PHE QD . . 4.770 3.883 3.734 4.136 . 0 0 "[ . 1 . 2]" 1
628 1 39 GLY H 1 110 PHE QE . . 5.280 4.101 3.881 4.633 . 0 0 "[ . 1 . 2]" 1
629 1 39 GLY HA2 1 40 TRP H . . 3.470 2.144 2.139 2.152 . 0 0 "[ . 1 . 2]" 1
630 1 39 GLY HA2 1 40 TRP HE3 . . 5.500 5.391 5.257 5.519 0.019 4 0 "[ . 1 . 2]" 1
631 1 39 GLY HA2 1 47 PHE QE . . 5.090 3.811 3.531 4.121 . 0 0 "[ . 1 . 2]" 1
632 1 39 GLY HA2 1 110 PHE HA . . 3.890 2.675 2.614 2.737 . 0 0 "[ . 1 . 2]" 1
633 1 39 GLY HA2 1 110 PHE QD . . 4.580 2.484 2.225 2.666 . 0 0 "[ . 1 . 2]" 1
634 1 39 GLY HA3 1 40 TRP H . . 3.500 3.195 3.152 3.295 . 0 0 "[ . 1 . 2]" 1
635 1 39 GLY HA3 1 40 TRP HA . . 5.330 4.453 4.438 4.501 . 0 0 "[ . 1 . 2]" 1
636 1 39 GLY HA3 1 47 PHE QE . . 4.600 3.018 2.503 3.666 . 0 0 "[ . 1 . 2]" 1
637 1 39 GLY HA3 1 47 PHE HZ . . 5.100 3.509 3.170 4.096 . 0 0 "[ . 1 . 2]" 1
638 1 39 GLY HA3 1 48 ASP H . . 5.500 3.874 3.283 4.067 . 0 0 "[ . 1 . 2]" 1
639 1 39 GLY HA3 1 110 PHE HA . . 4.640 4.418 4.353 4.482 . 0 0 "[ . 1 . 2]" 1
640 1 39 GLY HA3 1 110 PHE HB3 . . 5.500 5.555 5.518 5.583 0.083 20 0 "[ . 1 . 2]" 1
641 1 39 GLY HA3 1 110 PHE QD . . 4.150 3.336 3.137 3.471 . 0 0 "[ . 1 . 2]" 1
642 1 39 GLY HA3 1 110 PHE QE . . 4.960 2.623 2.450 2.751 . 0 0 "[ . 1 . 2]" 1
643 1 40 TRP H 1 40 TRP QB . . 3.640 2.548 2.445 2.607 . 0 0 "[ . 1 . 2]" 1
644 1 40 TRP H 1 40 TRP HE3 . . 4.550 4.353 4.128 4.471 . 0 0 "[ . 1 . 2]" 1
645 1 40 TRP H 1 47 PHE QE . . 4.160 3.355 3.163 3.678 . 0 0 "[ . 1 . 2]" 1
646 1 40 TRP H 1 109 VAL H . . 4.150 3.702 3.546 3.866 . 0 0 "[ . 1 . 2]" 1
647 1 40 TRP H 1 109 VAL QG . . 4.250 3.929 3.846 4.028 . 0 0 "[ . 1 . 2]" 1
648 1 40 TRP H 1 110 PHE HA . . 4.340 3.117 2.966 3.221 . 0 0 "[ . 1 . 2]" 1
649 1 40 TRP H 1 111 GLU H . . 4.770 4.663 4.438 4.776 0.006 15 0 "[ . 1 . 2]" 1
650 1 40 TRP HA 1 40 TRP HD1 . . 3.880 2.237 2.184 2.277 . 0 0 "[ . 1 . 2]" 1
651 1 40 TRP HA 1 40 TRP HE3 . . 5.250 5.070 5.040 5.110 . 0 0 "[ . 1 . 2]" 1
652 1 40 TRP HA 1 41 LEU H . . 3.390 2.182 2.179 2.193 . 0 0 "[ . 1 . 2]" 1
653 1 40 TRP HA 1 46 LYS HA . . 3.330 2.286 2.085 2.531 . 0 0 "[ . 1 . 2]" 1
654 1 40 TRP HA 1 46 LYS HB2 . . 4.640 4.301 3.904 4.642 0.002 13 0 "[ . 1 . 2]" 1
655 1 40 TRP HA 1 46 LYS HG3 . . 4.340 3.982 3.429 4.269 . 0 0 "[ . 1 . 2]" 1
656 1 40 TRP HA 1 47 PHE H . . 3.990 3.328 3.246 3.516 . 0 0 "[ . 1 . 2]" 1
657 1 40 TRP HA 1 47 PHE QD . . 4.090 3.570 3.323 3.903 . 0 0 "[ . 1 . 2]" 1
658 1 40 TRP HA 1 48 ASP H . . 5.260 5.106 4.911 5.261 0.001 13 0 "[ . 1 . 2]" 1
659 1 40 TRP HA 1 109 VAL HB . . 5.500 4.778 4.689 4.834 . 0 0 "[ . 1 . 2]" 1
660 1 40 TRP QB 1 40 TRP HD1 . . 3.350 3.003 2.983 3.026 . 0 0 "[ . 1 . 2]" 1
661 1 40 TRP QB 1 41 LEU H . . 3.810 3.065 3.010 3.091 . 0 0 "[ . 1 . 2]" 1
662 1 40 TRP QB 1 46 LYS HA . . 4.500 4.150 4.002 4.293 . 0 0 "[ . 1 . 2]" 1
663 1 40 TRP QB 1 109 VAL HB . . 3.950 2.404 2.313 2.491 . 0 0 "[ . 1 . 2]" 1
664 1 40 TRP QB 1 109 VAL QG . . 3.910 2.468 2.402 2.514 . 0 0 "[ . 1 . 2]" 1
665 1 40 TRP HB2 1 41 LEU H . . 4.490 4.235 4.180 4.269 . 0 0 "[ . 1 . 2]" 1
666 1 40 TRP HB2 1 109 VAL QG . . 4.710 2.534 2.459 2.593 . 0 0 "[ . 1 . 2]" 1
667 1 40 TRP HB3 1 41 LEU H . . 4.490 3.146 3.086 3.173 . 0 0 "[ . 1 . 2]" 1
668 1 40 TRP HB3 1 109 VAL QG . . 4.710 3.404 3.279 3.474 . 0 0 "[ . 1 . 2]" 1
669 1 40 TRP HD1 1 44 GLY QA . . 4.470 4.119 3.823 4.369 . 0 0 "[ . 1 . 2]" 1
670 1 40 TRP HD1 1 45 GLN HA . . 4.820 4.432 4.091 4.828 0.008 20 0 "[ . 1 . 2]" 1
671 1 40 TRP HD1 1 46 LYS H . . 4.150 3.214 2.952 3.443 . 0 0 "[ . 1 . 2]" 1
672 1 40 TRP HD1 1 46 LYS HA . . 3.420 1.999 1.973 2.226 . 0 0 "[ . 1 . 2]" 1
673 1 40 TRP HD1 1 46 LYS HB2 . . 3.460 2.442 2.078 2.758 . 0 0 "[ . 1 . 2]" 1
674 1 40 TRP HD1 1 46 LYS HB3 . . 4.880 3.860 3.615 4.068 . 0 0 "[ . 1 . 2]" 1
675 1 40 TRP HD1 1 46 LYS QD . . 4.700 4.222 3.704 4.697 . 0 0 "[ . 1 . 2]" 1
676 1 40 TRP HD1 1 46 LYS HG3 . . 4.100 2.950 2.495 3.371 . 0 0 "[ . 1 . 2]" 1
677 1 40 TRP HD1 1 109 VAL QG . . 5.500 5.533 5.454 5.557 0.057 12 0 "[ . 1 . 2]" 1
678 1 40 TRP HE1 1 46 LYS H . . 5.010 4.464 4.169 4.941 . 0 0 "[ . 1 . 2]" 1
679 1 40 TRP HE1 1 46 LYS HA . . 4.400 3.833 3.559 4.198 . 0 0 "[ . 1 . 2]" 1
680 1 40 TRP HE1 1 46 LYS HB2 . . 3.580 2.382 2.192 2.723 . 0 0 "[ . 1 . 2]" 1
681 1 40 TRP HE1 1 46 LYS QE . . 4.650 2.623 1.856 4.072 . 0 0 "[ . 1 . 2]" 1
682 1 40 TRP HE1 1 46 LYS HG3 . . 4.250 2.763 2.124 3.319 . 0 0 "[ . 1 . 2]" 1
683 1 40 TRP HE3 1 84 ARG QD . . 5.040 3.584 2.637 4.464 . 0 0 "[ . 1 . 2]" 1
684 1 40 TRP HE3 1 109 VAL HB . . 4.220 3.851 3.741 3.990 . 0 0 "[ . 1 . 2]" 1
685 1 40 TRP HE3 1 109 VAL QG . . 3.710 2.144 2.037 2.243 . 0 0 "[ . 1 . 2]" 1
686 1 40 TRP HE3 1 110 PHE HA . . 4.630 4.274 4.213 4.334 . 0 0 "[ . 1 . 2]" 1
687 1 40 TRP HE3 1 111 GLU QB . . 4.650 3.131 3.028 3.321 . 0 0 "[ . 1 . 2]" 1
688 1 40 TRP HH2 1 111 GLU HB2 . . 4.190 3.620 3.407 3.701 . 0 0 "[ . 1 . 2]" 1
689 1 40 TRP HH2 1 111 GLU QB . . 3.430 3.299 3.117 3.394 . 0 0 "[ . 1 . 2]" 1
690 1 40 TRP HH2 1 111 GLU HB3 . . 4.190 3.811 3.463 3.965 . 0 0 "[ . 1 . 2]" 1
691 1 40 TRP HH2 1 111 GLU HG2 . . 4.950 4.846 3.289 4.976 0.026 2 0 "[ . 1 . 2]" 1
692 1 40 TRP HH2 1 111 GLU QG . . 4.120 3.720 3.204 4.149 0.029 2 0 "[ . 1 . 2]" 1
693 1 40 TRP HH2 1 111 GLU HG3 . . 4.950 3.983 3.248 4.967 0.017 19 0 "[ . 1 . 2]" 1
694 1 40 TRP HZ2 1 46 LYS QD . . 5.420 4.389 3.006 5.424 0.004 19 0 "[ . 1 . 2]" 1
695 1 40 TRP HZ2 1 46 LYS QE . . 4.840 3.848 2.834 4.880 0.040 13 0 "[ . 1 . 2]" 1
696 1 40 TRP HZ2 1 46 LYS HG3 . . 5.270 4.809 4.240 5.274 0.004 4 0 "[ . 1 . 2]" 1
697 1 40 TRP HZ2 1 111 GLU HB2 . . 5.500 5.386 5.262 5.517 0.017 4 0 "[ . 1 . 2]" 1
698 1 40 TRP HZ2 1 111 GLU QB . . 4.820 4.747 4.514 4.873 0.053 13 0 "[ . 1 . 2]" 1
699 1 40 TRP HZ2 1 111 GLU HB3 . . 5.500 5.298 4.851 5.514 0.014 13 0 "[ . 1 . 2]" 1
700 1 40 TRP HZ3 1 109 VAL QG . . 5.500 3.827 3.719 3.932 . 0 0 "[ . 1 . 2]" 1
701 1 40 TRP HZ3 1 110 PHE HA . . 5.500 5.556 5.539 5.584 0.084 11 0 "[ . 1 . 2]" 1
702 1 40 TRP HZ3 1 111 GLU H . . 4.590 4.373 4.333 4.415 . 0 0 "[ . 1 . 2]" 1
703 1 40 TRP HZ3 1 111 GLU HB2 . . 4.180 1.986 1.958 2.083 . 0 0 "[ . 1 . 2]" 1
704 1 40 TRP HZ3 1 111 GLU QB . . 3.530 1.968 1.932 2.067 . 0 0 "[ . 1 . 2]" 1
705 1 40 TRP HZ3 1 111 GLU HB3 . . 4.180 3.227 2.871 3.439 . 0 0 "[ . 1 . 2]" 1
706 1 40 TRP HZ3 1 111 GLU HG2 . . 4.660 4.074 3.191 4.493 . 0 0 "[ . 1 . 2]" 1
707 1 40 TRP HZ3 1 111 GLU QG . . 3.950 2.939 2.390 3.352 . 0 0 "[ . 1 . 2]" 1
708 1 40 TRP HZ3 1 111 GLU HG3 . . 4.660 3.066 2.429 4.529 . 0 0 "[ . 1 . 2]" 1
709 1 41 LEU H 1 41 LEU QB . . 3.490 2.117 2.063 2.356 . 0 0 "[ . 1 . 2]" 1
710 1 41 LEU H 1 41 LEU MD1 . . 4.230 3.827 3.510 3.978 . 0 0 "[ . 1 . 2]" 1
711 1 41 LEU H 1 41 LEU MD2 . . 4.190 4.036 3.360 4.204 0.014 15 0 "[ . 1 . 2]" 1
712 1 41 LEU H 1 41 LEU HG . . 3.340 3.193 2.562 3.353 0.013 7 0 "[ . 1 . 2]" 1
713 1 41 LEU H 1 45 GLN H . . 4.440 3.270 2.880 3.693 . 0 0 "[ . 1 . 2]" 1
714 1 41 LEU H 1 47 PHE QD . . 4.100 3.103 2.922 3.331 . 0 0 "[ . 1 . 2]" 1
715 1 41 LEU HA 1 41 LEU MD2 . . 3.200 2.101 1.945 2.473 . 0 0 "[ . 1 . 2]" 1
716 1 41 LEU HA 1 42 THR HA . . 5.420 4.300 4.296 4.310 . 0 0 "[ . 1 . 2]" 1
717 1 41 LEU HA 1 42 THR MG . . 4.380 3.711 3.637 3.915 . 0 0 "[ . 1 . 2]" 1
718 1 41 LEU HA 1 47 PHE QD . . 4.310 3.718 3.446 4.110 . 0 0 "[ . 1 . 2]" 1
719 1 41 LEU HA 1 47 PHE QE . . 4.540 2.434 2.229 2.730 . 0 0 "[ . 1 . 2]" 1
720 1 41 LEU HA 1 102 ILE MD . . 5.500 4.178 3.406 4.651 . 0 0 "[ . 1 . 2]" 1
721 1 41 LEU QB 1 42 THR H . . 3.150 2.276 2.134 2.396 . 0 0 "[ . 1 . 2]" 1
722 1 41 LEU QB 1 43 ASP H . . 3.530 2.378 2.221 2.584 . 0 0 "[ . 1 . 2]" 1
723 1 41 LEU QB 1 44 GLY H . . 4.650 2.768 2.710 2.827 . 0 0 "[ . 1 . 2]" 1
724 1 41 LEU QB 1 45 GLN H . . 3.850 2.400 2.096 2.699 . 0 0 "[ . 1 . 2]" 1
725 1 41 LEU HB2 1 41 LEU MD1 . . 3.430 2.321 2.229 2.375 . 0 0 "[ . 1 . 2]" 1
726 1 41 LEU HB2 1 42 THR H . . 3.840 3.742 3.452 3.843 0.003 17 0 "[ . 1 . 2]" 1
727 1 41 LEU HB2 1 43 ASP H . . 4.090 3.560 2.813 3.898 . 0 0 "[ . 1 . 2]" 1
728 1 41 LEU HB3 1 41 LEU MD1 . . 3.430 2.360 2.275 2.542 . 0 0 "[ . 1 . 2]" 1
729 1 41 LEU HB3 1 42 THR H . . 3.840 2.296 2.149 2.421 . 0 0 "[ . 1 . 2]" 1
730 1 41 LEU HB3 1 43 ASP H . . 4.090 2.424 2.249 2.685 . 0 0 "[ . 1 . 2]" 1
731 1 41 LEU MD1 1 43 ASP H . . 5.040 4.062 3.877 4.309 . 0 0 "[ . 1 . 2]" 1
732 1 41 LEU MD1 1 45 GLN HB2 . . 3.990 2.560 1.985 3.252 . 0 0 "[ . 1 . 2]" 1
733 1 41 LEU MD1 1 45 GLN QB . . 3.490 2.011 1.767 2.260 . 0 0 "[ . 1 . 2]" 1
734 1 41 LEU MD1 1 45 GLN HB3 . . 3.990 2.210 1.907 2.875 . 0 0 "[ . 1 . 2]" 1
735 1 41 LEU MD1 1 45 GLN HG2 . . 4.400 3.521 2.390 4.329 . 0 0 "[ . 1 . 2]" 1
736 1 41 LEU MD1 1 45 GLN HG3 . . 4.400 3.705 2.307 4.320 . 0 0 "[ . 1 . 2]" 1
737 1 41 LEU MD1 1 47 PHE QD . . 4.030 3.203 2.641 3.502 . 0 0 "[ . 1 . 2]" 1
738 1 41 LEU MD1 1 102 ILE HA . . 5.040 4.270 3.507 5.020 . 0 0 "[ . 1 . 2]" 1
739 1 41 LEU MD1 1 103 PRO HD2 . . 4.930 4.444 3.872 4.930 . 0 0 "[ . 1 . 2]" 1
740 1 41 LEU MD1 1 103 PRO QD . . 4.210 3.757 3.196 4.187 . 0 0 "[ . 1 . 2]" 1
741 1 41 LEU MD1 1 103 PRO HD3 . . 4.930 4.066 3.336 4.608 . 0 0 "[ . 1 . 2]" 1
742 1 41 LEU MD2 1 42 THR H . . 3.890 2.277 1.919 3.284 . 0 0 "[ . 1 . 2]" 1
743 1 41 LEU MD2 1 47 PHE QD . . 3.630 3.528 2.592 3.646 0.016 15 0 "[ . 1 . 2]" 1
744 1 41 LEU MD2 1 47 PHE QE . . 3.620 3.146 1.993 3.618 . 0 0 "[ . 1 . 2]" 1
745 1 41 LEU MD2 1 102 ILE HA . . 4.120 2.698 1.928 3.405 . 0 0 "[ . 1 . 2]" 1
746 1 41 LEU MD2 1 103 PRO HD2 . . 4.280 2.798 2.341 3.600 . 0 0 "[ . 1 . 2]" 1
747 1 41 LEU MD2 1 103 PRO QD . . 3.700 2.600 2.108 3.400 . 0 0 "[ . 1 . 2]" 1
748 1 41 LEU MD2 1 103 PRO HD3 . . 4.280 3.115 2.395 4.179 . 0 0 "[ . 1 . 2]" 1
749 1 41 LEU HG 1 47 PHE HB2 . . 5.500 5.035 4.785 5.306 . 0 0 "[ . 1 . 2]" 1
750 1 41 LEU HG 1 47 PHE HB3 . . 4.510 3.705 3.426 3.980 . 0 0 "[ . 1 . 2]" 1
751 1 41 LEU HG 1 47 PHE QD . . 3.450 2.081 1.995 2.229 . 0 0 "[ . 1 . 2]" 1
752 1 41 LEU HG 1 47 PHE QE . . 4.210 2.881 2.332 3.240 . 0 0 "[ . 1 . 2]" 1
753 1 42 THR H 1 42 THR MG . . 3.420 1.987 1.922 2.174 . 0 0 "[ . 1 . 2]" 1
754 1 42 THR H 1 43 ASP H . . 3.880 2.722 2.602 2.844 . 0 0 "[ . 1 . 2]" 1
755 1 42 THR H 1 44 GLY H . . 4.820 3.920 3.820 4.037 . 0 0 "[ . 1 . 2]" 1
756 1 42 THR HA 1 42 THR MG . . 2.950 2.435 2.351 2.458 . 0 0 "[ . 1 . 2]" 1
757 1 42 THR HA 1 44 GLY H . . 4.420 4.104 3.999 4.219 . 0 0 "[ . 1 . 2]" 1
758 1 42 THR HA 1 108 LEU HA . . 5.500 4.729 4.311 5.039 . 0 0 "[ . 1 . 2]" 1
759 1 42 THR HA 1 109 VAL QG . . 4.060 3.220 3.015 3.445 . 0 0 "[ . 1 . 2]" 1
760 1 42 THR HB 1 107 THR HB . . 5.440 4.576 4.209 4.700 . 0 0 "[ . 1 . 2]" 1
761 1 42 THR HB 1 107 THR MG . . 5.500 5.491 5.230 5.523 0.023 19 0 "[ . 1 . 2]" 1
762 1 42 THR HB 1 109 VAL QG . . 5.310 5.012 4.796 5.128 . 0 0 "[ . 1 . 2]" 1
763 1 42 THR MG 1 43 ASP H . . 5.100 3.895 3.781 4.048 . 0 0 "[ . 1 . 2]" 1
764 1 42 THR MG 1 107 THR H . . 4.180 2.362 2.084 2.486 . 0 0 "[ . 1 . 2]" 1
765 1 42 THR MG 1 107 THR HB . . 3.840 2.798 2.458 2.950 . 0 0 "[ . 1 . 2]" 1
766 1 42 THR MG 1 107 THR MG . . 3.790 3.780 3.611 3.821 0.031 11 0 "[ . 1 . 2]" 1
767 1 43 ASP H 1 43 ASP QB . . 3.660 2.400 2.195 2.633 . 0 0 "[ . 1 . 2]" 1
768 1 43 ASP H 1 44 GLY H . . 3.480 2.299 2.166 2.438 . 0 0 "[ . 1 . 2]" 1
769 1 43 ASP H 1 45 GLN H . . 4.430 3.505 3.332 3.675 . 0 0 "[ . 1 . 2]" 1
770 1 44 GLY H 1 45 GLN H . . 3.470 2.153 2.012 2.350 . 0 0 "[ . 1 . 2]" 1
771 1 45 GLN H 1 45 GLN QB . . 3.390 2.174 2.116 2.418 . 0 0 "[ . 1 . 2]" 1
772 1 45 GLN H 1 46 LYS H . . 4.640 4.447 4.386 4.571 . 0 0 "[ . 1 . 2]" 1
773 1 45 GLN HA 1 45 GLN HG2 . . 3.840 3.061 2.166 3.831 . 0 0 "[ . 1 . 2]" 1
774 1 45 GLN HA 1 45 GLN QG . . 3.330 2.475 2.120 3.068 . 0 0 "[ . 1 . 2]" 1
775 1 45 GLN HA 1 45 GLN HG3 . . 3.840 2.811 2.204 3.745 . 0 0 "[ . 1 . 2]" 1
776 1 45 GLN HA 1 46 LYS H . . 2.900 2.143 2.138 2.164 . 0 0 "[ . 1 . 2]" 1
777 1 46 LYS H 1 46 LYS HB2 . . 3.160 2.456 2.307 2.688 . 0 0 "[ . 1 . 2]" 1
778 1 46 LYS H 1 46 LYS QE . . 4.960 4.471 4.082 4.965 0.005 13 0 "[ . 1 . 2]" 1
779 1 46 LYS H 1 46 LYS HG2 . . 5.100 4.495 4.368 4.607 . 0 0 "[ . 1 . 2]" 1
780 1 46 LYS H 1 46 LYS HG3 . . 5.470 4.405 4.282 4.556 . 0 0 "[ . 1 . 2]" 1
781 1 46 LYS HA 1 46 LYS QD . . 4.730 3.987 3.681 4.258 . 0 0 "[ . 1 . 2]" 1
782 1 46 LYS HA 1 46 LYS QE . . 4.560 4.353 4.084 4.579 0.019 13 0 "[ . 1 . 2]" 1
783 1 46 LYS HA 1 46 LYS HG3 . . 3.390 2.561 2.290 2.856 . 0 0 "[ . 1 . 2]" 1
784 1 46 LYS HA 1 47 PHE H . . 3.400 2.176 2.144 2.220 . 0 0 "[ . 1 . 2]" 1
785 1 46 LYS HA 1 47 PHE QD . . 5.430 3.770 3.451 4.120 . 0 0 "[ . 1 . 2]" 1
786 1 46 LYS HA 1 48 ASP H . . 4.060 3.666 3.486 3.830 . 0 0 "[ . 1 . 2]" 1
787 1 46 LYS HB2 1 46 LYS QE . . 4.620 2.491 2.014 3.330 . 0 0 "[ . 1 . 2]" 1
788 1 46 LYS HB2 1 47 PHE H . . 4.670 4.252 4.063 4.379 . 0 0 "[ . 1 . 2]" 1
789 1 46 LYS HB3 1 46 LYS QE . . 3.710 2.723 2.179 3.345 . 0 0 "[ . 1 . 2]" 1
790 1 46 LYS QD 1 49 SER HB2 . . 4.080 2.532 1.982 3.736 . 0 0 "[ . 1 . 2]" 1
791 1 46 LYS QD 1 49 SER QB . . 3.580 1.998 1.831 2.191 . 0 0 "[ . 1 . 2]" 1
792 1 46 LYS QD 1 49 SER HB3 . . 4.080 2.605 1.918 3.802 . 0 0 "[ . 1 . 2]" 1
793 1 46 LYS QE 1 49 SER HB2 . . 4.350 3.591 2.562 4.347 . 0 0 "[ . 1 . 2]" 1
794 1 46 LYS QE 1 49 SER QB . . 3.780 3.112 2.209 3.614 . 0 0 "[ . 1 . 2]" 1
795 1 46 LYS QE 1 49 SER HB3 . . 4.350 3.753 2.271 4.350 0.000 4 0 "[ . 1 . 2]" 1
796 1 46 LYS HG2 1 47 PHE H . . 4.140 2.868 2.243 3.568 . 0 0 "[ . 1 . 2]" 1
797 1 46 LYS HG2 1 48 ASP H . . 3.610 2.187 1.933 2.720 . 0 0 "[ . 1 . 2]" 1
798 1 46 LYS HG3 1 47 PHE H . . 4.620 3.243 2.868 3.645 . 0 0 "[ . 1 . 2]" 1
799 1 47 PHE H 1 47 PHE QD . . 4.020 2.989 2.817 3.121 . 0 0 "[ . 1 . 2]" 1
800 1 47 PHE H 1 48 ASP H . . 3.140 2.133 1.880 2.228 . 0 0 "[ . 1 . 2]" 1
801 1 47 PHE HA 1 47 PHE QD . . 4.150 3.719 3.650 3.729 . 0 0 "[ . 1 . 2]" 1
802 1 47 PHE HB2 1 48 ASP HA . . 5.200 5.151 4.653 5.209 0.009 9 0 "[ . 1 . 2]" 1
803 1 47 PHE HB2 1 101 VAL HB . . 5.500 5.081 4.081 5.514 0.014 3 0 "[ . 1 . 2]" 1
804 1 47 PHE HB2 1 101 VAL QG . . 4.180 3.053 2.196 3.535 . 0 0 "[ . 1 . 2]" 1
805 1 47 PHE QD 1 48 ASP HA . . 5.390 4.462 4.234 4.710 . 0 0 "[ . 1 . 2]" 1
806 1 47 PHE QD 1 48 ASP HB2 . . 4.500 2.559 2.080 4.086 . 0 0 "[ . 1 . 2]" 1
807 1 47 PHE QD 1 48 ASP QB . . 3.620 2.455 2.065 2.838 . 0 0 "[ . 1 . 2]" 1
808 1 47 PHE QD 1 48 ASP HB3 . . 4.500 4.014 2.412 4.506 0.006 5 0 "[ . 1 . 2]" 1
809 1 47 PHE QD 1 93 TYR QE . . 4.840 4.504 3.926 4.841 0.001 19 0 "[ . 1 . 2]" 1
810 1 47 PHE QD 1 101 VAL QG . . 3.680 3.430 2.631 3.695 0.015 18 0 "[ . 1 . 2]" 1
811 1 47 PHE QD 1 102 ILE MD . . 4.090 3.332 2.793 4.048 . 0 0 "[ . 1 . 2]" 1
812 1 47 PHE QD 1 110 PHE QE . . 4.640 4.147 3.956 4.537 . 0 0 "[ . 1 . 2]" 1
813 1 47 PHE QE 1 48 ASP HB2 . . 5.100 3.476 3.197 5.160 0.060 11 0 "[ . 1 . 2]" 1
814 1 47 PHE QE 1 48 ASP QB . . 4.280 3.302 3.076 3.850 . 0 0 "[ . 1 . 2]" 1
815 1 47 PHE QE 1 48 ASP HB3 . . 5.100 4.355 3.735 4.812 . 0 0 "[ . 1 . 2]" 1
816 1 47 PHE QE 1 102 ILE MD . . 4.220 3.157 2.701 3.675 . 0 0 "[ . 1 . 2]" 1
817 1 47 PHE QE 1 109 VAL H . . 4.660 3.989 3.751 4.346 . 0 0 "[ . 1 . 2]" 1
818 1 47 PHE QE 1 110 PHE QE . . 4.190 2.434 2.008 3.150 . 0 0 "[ . 1 . 2]" 1
819 1 48 ASP H 1 49 SER H . . 4.850 3.963 3.900 4.332 . 0 0 "[ . 1 . 2]" 1
820 1 48 ASP HA 1 49 SER QB . . 4.960 4.181 3.950 4.707 . 0 0 "[ . 1 . 2]" 1
821 1 48 ASP HB2 1 110 PHE QE . . 5.500 3.641 3.173 5.150 . 0 0 "[ . 1 . 2]" 1
822 1 48 ASP HB3 1 110 PHE QE . . 5.500 3.593 3.099 4.665 . 0 0 "[ . 1 . 2]" 1
823 1 49 SER H 1 49 SER QB . . 3.530 2.900 2.540 3.321 . 0 0 "[ . 1 . 2]" 1
824 1 49 SER HA 1 50 SER H . . 3.280 2.166 2.137 2.214 . 0 0 "[ . 1 . 2]" 1
825 1 51 LYS H 1 51 LYS QB . . 3.330 2.382 2.169 2.518 . 0 0 "[ . 1 . 2]" 1
826 1 51 LYS H 1 51 LYS HG2 . . 4.200 2.569 2.023 4.088 . 0 0 "[ . 1 . 2]" 1
827 1 51 LYS H 1 51 LYS QG . . 3.460 2.432 2.010 3.535 0.075 13 0 "[ . 1 . 2]" 1
828 1 51 LYS H 1 51 LYS HG3 . . 4.200 3.480 3.144 3.974 . 0 0 "[ . 1 . 2]" 1
829 1 51 LYS H 1 52 ASP H . . 3.700 2.651 2.547 2.699 . 0 0 "[ . 1 . 2]" 1
830 1 51 LYS HA 1 51 LYS QD . . 4.120 2.401 1.987 3.468 . 0 0 "[ . 1 . 2]" 1
831 1 51 LYS HA 1 51 LYS QE . . 4.680 3.961 1.940 4.603 . 0 0 "[ . 1 . 2]" 1
832 1 51 LYS HA 1 51 LYS HG2 . . 4.060 2.895 2.344 3.619 . 0 0 "[ . 1 . 2]" 1
833 1 51 LYS HA 1 51 LYS QG . . 3.540 2.643 2.200 2.917 . 0 0 "[ . 1 . 2]" 1
834 1 51 LYS HA 1 51 LYS HG3 . . 4.060 3.533 2.225 3.817 . 0 0 "[ . 1 . 2]" 1
835 1 51 LYS HA 1 53 ARG H . . 4.800 4.186 3.806 4.325 . 0 0 "[ . 1 . 2]" 1
836 1 51 LYS HA 1 54 ASN H . . 4.230 3.224 3.085 3.623 . 0 0 "[ . 1 . 2]" 1
837 1 51 LYS HA 1 54 ASN HA . . 4.110 3.443 3.176 4.049 . 0 0 "[ . 1 . 2]" 1
838 1 51 LYS QB 1 51 LYS QE . . 3.770 2.885 1.959 3.740 . 0 0 "[ . 1 . 2]" 1
839 1 51 LYS QB 1 52 ASP H . . 3.940 2.928 2.395 3.108 . 0 0 "[ . 1 . 2]" 1
840 1 51 LYS HB2 1 51 LYS QE . . 4.620 3.739 2.139 4.438 . 0 0 "[ . 1 . 2]" 1
841 1 51 LYS HB3 1 51 LYS QE . . 4.620 3.137 1.983 4.459 . 0 0 "[ . 1 . 2]" 1
842 1 51 LYS QE 1 51 LYS HG2 . . 3.690 3.005 2.356 3.521 . 0 0 "[ . 1 . 2]" 1
843 1 51 LYS QE 1 51 LYS QG . . 3.220 2.274 2.017 2.761 . 0 0 "[ . 1 . 2]" 1
844 1 51 LYS QE 1 51 LYS HG3 . . 3.690 2.472 2.037 3.531 . 0 0 "[ . 1 . 2]" 1
845 1 51 LYS QG 1 52 ASP H . . 5.340 4.294 3.935 4.733 . 0 0 "[ . 1 . 2]" 1
846 1 52 ASP H 1 52 ASP QB . . 3.250 2.218 2.122 2.280 . 0 0 "[ . 1 . 2]" 1
847 1 52 ASP H 1 53 ARG H . . 3.910 2.797 2.469 2.846 . 0 0 "[ . 1 . 2]" 1
848 1 53 ARG H 1 53 ARG QB . . 3.650 2.296 2.135 2.694 . 0 0 "[ . 1 . 2]" 1
849 1 53 ARG H 1 53 ARG QG . . 4.090 3.507 1.954 4.073 . 0 0 "[ . 1 . 2]" 1
850 1 53 ARG H 1 54 ASN H . . 3.680 2.514 2.283 2.574 . 0 0 "[ . 1 . 2]" 1
851 1 53 ARG HA 1 53 ARG QG . . 3.690 2.512 2.142 3.337 . 0 0 "[ . 1 . 2]" 1
852 1 53 ARG QB 1 53 ARG QD . . 3.120 2.217 2.056 2.412 . 0 0 "[ . 1 . 2]" 1
853 1 53 ARG QB 1 55 ASP H . . 4.450 2.993 2.486 3.938 . 0 0 "[ . 1 . 2]" 1
854 1 53 ARG QG 1 54 ASN H . . 5.020 4.322 2.928 4.827 . 0 0 "[ . 1 . 2]" 1
855 1 53 ARG QG 1 55 ASP H . . 5.210 4.203 1.933 5.104 . 0 0 "[ . 1 . 2]" 1
856 1 54 ASN H 1 54 ASN QB . . 3.650 3.223 2.861 3.439 . 0 0 "[ . 1 . 2]" 1
857 1 55 ASP H 1 55 ASP HB2 . . 3.890 3.298 2.732 3.942 0.052 7 0 "[ . 1 . 2]" 1
858 1 55 ASP H 1 55 ASP QB . . 3.390 2.759 2.527 3.002 . 0 0 "[ . 1 . 2]" 1
859 1 55 ASP H 1 55 ASP HB3 . . 3.890 3.128 2.720 3.808 . 0 0 "[ . 1 . 2]" 1
860 1 55 ASP H 1 56 PRO QD . . 4.580 4.193 3.680 4.318 . 0 0 "[ . 1 . 2]" 1
861 1 55 ASP HA 1 56 PRO HD2 . . 3.390 2.249 1.920 2.417 . 0 0 "[ . 1 . 2]" 1
862 1 55 ASP HA 1 56 PRO HD3 . . 3.390 2.281 2.252 2.567 . 0 0 "[ . 1 . 2]" 1
863 1 55 ASP HA 1 56 PRO HG2 . . 4.600 4.390 4.116 4.525 . 0 0 "[ . 1 . 2]" 1
864 1 55 ASP HA 1 56 PRO HG3 . . 4.600 4.402 4.327 4.481 . 0 0 "[ . 1 . 2]" 1
865 1 55 ASP QB 1 56 PRO QD . . 4.490 2.873 2.005 3.735 . 0 0 "[ . 1 . 2]" 1
866 1 56 PRO HA 1 57 PHE H . . 3.270 2.250 2.162 2.411 . 0 0 "[ . 1 . 2]" 1
867 1 56 PRO HB2 1 57 PHE H . . 3.660 3.078 2.585 3.453 . 0 0 "[ . 1 . 2]" 1
868 1 56 PRO HB2 1 57 PHE HA . . 5.180 4.632 4.420 4.840 . 0 0 "[ . 1 . 2]" 1
869 1 56 PRO HB2 1 115 LEU MD1 . . 3.660 2.683 2.372 2.904 . 0 0 "[ . 1 . 2]" 1
870 1 56 PRO HB3 1 57 PHE H . . 4.130 3.717 3.439 3.947 . 0 0 "[ . 1 . 2]" 1
871 1 56 PRO HB3 1 115 LEU MD1 . . 3.550 1.902 1.873 1.951 . 0 0 "[ . 1 . 2]" 1
872 1 56 PRO QG 1 115 LEU MD1 . . 4.090 3.481 3.190 3.631 . 0 0 "[ . 1 . 2]" 1
873 1 57 PHE H 1 57 PHE HB2 . . 3.680 2.800 2.517 3.009 . 0 0 "[ . 1 . 2]" 1
874 1 57 PHE H 1 57 PHE HB3 . . 3.680 2.438 2.368 2.556 . 0 0 "[ . 1 . 2]" 1
875 1 57 PHE H 1 57 PHE QD . . 4.630 4.204 4.167 4.245 . 0 0 "[ . 1 . 2]" 1
876 1 57 PHE H 1 58 ALA H . . 4.850 4.261 4.185 4.358 . 0 0 "[ . 1 . 2]" 1
877 1 57 PHE HA 1 57 PHE QD . . 3.480 2.208 2.025 2.374 . 0 0 "[ . 1 . 2]" 1
878 1 57 PHE HA 1 57 PHE QE . . 4.620 4.455 4.317 4.538 . 0 0 "[ . 1 . 2]" 1
879 1 57 PHE HA 1 58 ALA H . . 3.140 2.170 2.152 2.180 . 0 0 "[ . 1 . 2]" 1
880 1 57 PHE HA 1 59 PHE QD . . 5.420 5.182 4.810 5.428 0.008 16 0 "[ . 1 . 2]" 1
881 1 57 PHE QB 1 58 ALA H . . 4.470 3.953 3.917 3.969 . 0 0 "[ . 1 . 2]" 1
882 1 57 PHE QD 1 58 ALA H . . 4.590 3.174 2.892 3.503 . 0 0 "[ . 1 . 2]" 1
883 1 57 PHE QD 1 58 ALA HA . . 5.050 4.858 4.735 4.962 . 0 0 "[ . 1 . 2]" 1
884 1 57 PHE QD 1 59 PHE H . . 5.480 4.897 4.649 5.131 . 0 0 "[ . 1 . 2]" 1
885 1 57 PHE QD 1 59 PHE HA . . 5.500 5.493 5.286 5.518 0.018 16 0 "[ . 1 . 2]" 1
886 1 57 PHE QD 1 59 PHE HB3 . . 4.650 3.806 3.604 3.941 . 0 0 "[ . 1 . 2]" 1
887 1 57 PHE QE 1 59 PHE HB2 . . 4.270 3.806 3.537 3.983 . 0 0 "[ . 1 . 2]" 1
888 1 57 PHE QE 1 59 PHE HB3 . . 3.950 2.959 2.713 3.108 . 0 0 "[ . 1 . 2]" 1
889 1 57 PHE QE 1 59 PHE QD . . 3.290 3.261 2.963 3.296 0.006 11 0 "[ . 1 . 2]" 1
890 1 57 PHE QE 1 66 VAL MG1 . . 3.390 2.975 2.673 3.199 . 0 0 "[ . 1 . 2]" 1
891 1 57 PHE HZ 1 59 PHE HA . . 5.440 4.930 4.511 5.152 . 0 0 "[ . 1 . 2]" 1
892 1 57 PHE HZ 1 59 PHE QD . . 4.390 4.238 3.896 4.405 0.015 19 0 "[ . 1 . 2]" 1
893 1 57 PHE HZ 1 66 VAL MG1 . . 3.920 3.549 2.741 3.883 . 0 0 "[ . 1 . 2]" 1
894 1 58 ALA H 1 58 ALA MB . . 3.390 2.235 2.141 2.327 . 0 0 "[ . 1 . 2]" 1
895 1 58 ALA HA 1 59 PHE H . . 3.070 2.149 2.141 2.199 . 0 0 "[ . 1 . 2]" 1
896 1 58 ALA HA 1 59 PHE QD . . 4.400 3.664 3.406 3.974 . 0 0 "[ . 1 . 2]" 1
897 1 58 ALA MB 1 59 PHE H . . 3.490 3.319 3.161 3.498 0.008 19 0 "[ . 1 . 2]" 1
898 1 58 ALA MB 1 59 PHE QD . . 5.080 4.837 4.665 5.035 . 0 0 "[ . 1 . 2]" 1
899 1 59 PHE H 1 59 PHE QD . . 3.720 2.517 2.175 2.766 . 0 0 "[ . 1 . 2]" 1
900 1 59 PHE H 1 59 PHE QE . . 5.500 4.248 4.061 4.368 . 0 0 "[ . 1 . 2]" 1
901 1 59 PHE H 1 60 VAL H . . 4.660 4.407 4.364 4.440 . 0 0 "[ . 1 . 2]" 1
902 1 59 PHE HA 1 59 PHE QD . . 3.780 3.715 3.698 3.722 . 0 0 "[ . 1 . 2]" 1
903 1 59 PHE HA 1 60 VAL H . . 3.180 2.373 2.278 2.631 . 0 0 "[ . 1 . 2]" 1
904 1 59 PHE HA 1 66 VAL MG1 . . 5.500 5.367 4.881 5.515 0.015 8 0 "[ . 1 . 2]" 1
905 1 59 PHE HB2 1 60 VAL H . . 3.460 2.609 2.141 2.803 . 0 0 "[ . 1 . 2]" 1
906 1 59 PHE HB2 1 66 VAL MG1 . . 4.110 3.431 2.941 3.568 . 0 0 "[ . 1 . 2]" 1
907 1 59 PHE HB3 1 60 VAL H . . 4.030 3.944 3.644 4.055 0.025 10 0 "[ . 1 . 2]" 1
908 1 59 PHE HB3 1 66 VAL MG1 . . 4.140 4.043 3.591 4.178 0.038 19 0 "[ . 1 . 2]" 1
909 1 59 PHE QD 1 60 VAL H . . 4.050 3.163 2.493 3.668 . 0 0 "[ . 1 . 2]" 1
910 1 59 PHE QD 1 61 LEU HA . . 3.950 3.572 3.127 3.967 0.017 5 0 "[ . 1 . 2]" 1
911 1 59 PHE QD 1 65 MET HB2 . . 5.500 4.977 4.039 5.505 0.005 2 0 "[ . 1 . 2]" 1
912 1 59 PHE QD 1 65 MET QB . . 4.670 4.461 3.858 4.679 0.009 12 0 "[ . 1 . 2]" 1
913 1 59 PHE QD 1 65 MET HB3 . . 5.500 5.209 4.350 5.511 0.011 5 0 "[ . 1 . 2]" 1
914 1 59 PHE QD 1 66 VAL MG1 . . 3.290 2.515 2.082 2.913 . 0 0 "[ . 1 . 2]" 1
915 1 59 PHE QD 1 66 VAL MG2 . . 4.130 3.810 3.458 4.042 . 0 0 "[ . 1 . 2]" 1
916 1 59 PHE QE 1 61 LEU HA . . 3.530 2.615 2.184 3.065 . 0 0 "[ . 1 . 2]" 1
917 1 59 PHE QE 1 61 LEU QD . . 3.350 3.024 2.736 3.349 . 0 0 "[ . 1 . 2]" 1
918 1 59 PHE QE 1 62 GLY H . . 4.360 3.600 2.596 4.039 . 0 0 "[ . 1 . 2]" 1
919 1 59 PHE QE 1 66 VAL MG1 . . 3.810 2.699 2.387 3.165 . 0 0 "[ . 1 . 2]" 1
920 1 59 PHE QE 1 66 VAL MG2 . . 3.530 3.077 2.816 3.460 . 0 0 "[ . 1 . 2]" 1
921 1 59 PHE QE 1 70 TRP HD1 . . 3.530 3.335 2.933 3.558 0.028 13 0 "[ . 1 . 2]" 1
922 1 59 PHE QE 1 74 VAL MG1 . . 3.840 2.850 2.427 3.060 . 0 0 "[ . 1 . 2]" 1
923 1 59 PHE QE 1 74 VAL QG . . 3.250 2.594 2.318 2.768 . 0 0 "[ . 1 . 2]" 1
924 1 59 PHE QE 1 74 VAL MG2 . . 3.840 3.003 2.872 3.207 . 0 0 "[ . 1 . 2]" 1
925 1 59 PHE HZ 1 61 LEU HA . . 4.710 4.369 3.782 4.654 . 0 0 "[ . 1 . 2]" 1
926 1 59 PHE HZ 1 61 LEU QD . . 4.290 3.666 2.856 4.126 . 0 0 "[ . 1 . 2]" 1
927 1 59 PHE HZ 1 66 VAL MG1 . . 4.620 3.820 3.577 4.024 . 0 0 "[ . 1 . 2]" 1
928 1 59 PHE HZ 1 74 VAL H . . 4.860 4.755 4.535 4.888 0.028 14 0 "[ . 1 . 2]" 1
929 1 59 PHE HZ 1 74 VAL HB . . 5.170 3.528 2.607 4.032 . 0 0 "[ . 1 . 2]" 1
930 1 59 PHE HZ 1 74 VAL QG . . 3.480 1.920 1.842 2.163 . 0 0 "[ . 1 . 2]" 1
931 1 60 VAL H 1 60 VAL HB . . 3.330 2.615 2.500 3.328 . 0 0 "[ . 1 . 2]" 1
932 1 60 VAL H 1 60 VAL MG1 . . 4.040 3.602 1.893 3.851 . 0 0 "[ . 1 . 2]" 1
933 1 60 VAL H 1 60 VAL QG . . 3.150 2.251 1.888 2.553 . 0 0 "[ . 1 . 2]" 1
934 1 60 VAL H 1 60 VAL MG2 . . 4.040 2.454 2.131 3.762 . 0 0 "[ . 1 . 2]" 1
935 1 60 VAL H 1 61 LEU H . . 4.820 4.470 4.402 4.538 . 0 0 "[ . 1 . 2]" 1
936 1 60 VAL HA 1 60 VAL MG1 . . 3.330 2.393 2.189 3.195 . 0 0 "[ . 1 . 2]" 1
937 1 60 VAL HA 1 60 VAL MG2 . . 3.330 2.382 2.283 2.511 . 0 0 "[ . 1 . 2]" 1
938 1 60 VAL HA 1 61 LEU H . . 3.040 2.151 2.141 2.201 . 0 0 "[ . 1 . 2]" 1
939 1 60 VAL HB 1 63 GLY H . . 5.270 4.845 3.878 5.415 0.145 17 0 "[ . 1 . 2]" 1
940 1 60 VAL QG 1 61 LEU H . . 3.440 2.584 2.248 2.825 . 0 0 "[ . 1 . 2]" 1
941 1 60 VAL QG 1 61 LEU HA . . 4.460 4.054 3.703 4.242 . 0 0 "[ . 1 . 2]" 1
942 1 60 VAL QG 1 62 GLY H . . 5.100 4.540 4.116 4.802 . 0 0 "[ . 1 . 2]" 1
943 1 60 VAL QG 1 63 GLY H . . 4.540 4.079 2.539 4.545 0.005 5 0 "[ . 1 . 2]" 1
944 1 61 LEU H 1 61 LEU HB2 . . 3.340 2.635 2.066 2.912 . 0 0 "[ . 1 . 2]" 1
945 1 61 LEU H 1 61 LEU HB3 . . 3.340 2.466 2.222 3.116 . 0 0 "[ . 1 . 2]" 1
946 1 61 LEU HA 1 61 LEU MD1 . . 4.090 2.066 1.957 2.149 . 0 0 "[ . 1 . 2]" 1
947 1 61 LEU HA 1 61 LEU QD . . 3.350 2.031 1.861 2.139 . 0 0 "[ . 1 . 2]" 1
948 1 61 LEU HA 1 61 LEU MD2 . . 4.090 3.413 2.311 3.883 . 0 0 "[ . 1 . 2]" 1
949 1 61 LEU HA 1 61 LEU HG . . 3.940 3.558 3.489 3.679 . 0 0 "[ . 1 . 2]" 1
950 1 61 LEU HA 1 62 GLY H . . 3.160 2.153 2.143 2.162 . 0 0 "[ . 1 . 2]" 1
951 1 61 LEU QB 1 61 LEU QD . . 2.730 1.957 1.917 2.042 . 0 0 "[ . 1 . 2]" 1
952 1 61 LEU QD 1 62 GLY H . . 3.540 2.101 1.955 2.175 . 0 0 "[ . 1 . 2]" 1
953 1 61 LEU QD 1 62 GLY QA . . 4.260 2.724 2.625 3.011 . 0 0 "[ . 1 . 2]" 1
954 1 61 LEU QD 1 63 GLY H . . 4.740 4.204 3.782 4.767 0.027 5 0 "[ . 1 . 2]" 1
955 1 61 LEU QD 1 71 ASP HA . . 3.570 2.542 2.304 2.703 . 0 0 "[ . 1 . 2]" 1
956 1 61 LEU QD 1 71 ASP QB . . 4.230 3.289 2.860 3.559 . 0 0 "[ . 1 . 2]" 1
957 1 61 LEU QD 1 74 VAL H . . 4.590 4.084 3.999 4.318 . 0 0 "[ . 1 . 2]" 1
958 1 61 LEU QD 1 74 VAL HA . . 4.370 4.129 3.753 4.372 0.002 19 0 "[ . 1 . 2]" 1
959 1 61 LEU QD 1 74 VAL QG . . 3.110 1.748 1.625 1.812 . 0 0 "[ . 1 . 2]" 1
960 1 61 LEU QD 1 75 GLN HA . . 3.210 2.411 2.013 2.859 . 0 0 "[ . 1 . 2]" 1
961 1 61 LEU QD 1 75 GLN QG . . 3.080 2.156 1.923 2.450 . 0 0 "[ . 1 . 2]" 1
962 1 61 LEU QD 1 76 GLY H . . 4.570 4.591 4.522 4.660 0.090 5 0 "[ . 1 . 2]" 1
963 1 61 LEU MD1 1 75 GLN H . . 3.940 3.390 3.261 3.558 . 0 0 "[ . 1 . 2]" 1
964 1 61 LEU MD1 1 75 GLN HA . . 3.830 3.141 2.815 3.463 . 0 0 "[ . 1 . 2]" 1
965 1 61 LEU MD1 1 76 GLY H . . 5.500 5.445 5.295 5.507 0.007 11 0 "[ . 1 . 2]" 1
966 1 61 LEU MD2 1 75 GLN H . . 3.940 3.637 3.391 3.881 . 0 0 "[ . 1 . 2]" 1
967 1 61 LEU MD2 1 75 GLN HA . . 3.830 2.596 2.032 3.343 . 0 0 "[ . 1 . 2]" 1
968 1 61 LEU MD2 1 76 GLY H . . 5.500 4.949 4.842 5.123 . 0 0 "[ . 1 . 2]" 1
969 1 61 LEU HG 1 71 ASP HA . . 5.500 5.376 5.085 5.567 0.067 9 0 "[ . 1 . 2]" 1
970 1 61 LEU HG 1 75 GLN QG . . 5.340 3.837 3.577 4.229 . 0 0 "[ . 1 . 2]" 1
971 1 62 GLY H 1 63 GLY H . . 3.530 2.626 2.049 3.524 . 0 0 "[ . 1 . 2]" 1
972 1 62 GLY H 1 75 GLN QG . . 5.180 5.162 4.795 5.205 0.025 13 0 "[ . 1 . 2]" 1
973 1 62 GLY QA 1 71 ASP QB . . 4.390 3.905 3.300 4.399 0.009 6 0 "[ . 1 . 2]" 1
974 1 62 GLY QA 1 75 GLN QG . . 5.180 4.760 4.462 5.190 0.010 17 0 "[ . 1 . 2]" 1
975 1 63 GLY H 1 64 GLY H . . 4.310 3.264 1.894 4.291 . 0 0 "[ . 1 . 2]" 1
976 1 64 GLY H 1 66 VAL H . . 4.530 3.664 2.815 4.563 0.033 17 0 "[ . 1 . 2]" 1
977 1 64 GLY QA 1 66 VAL H . . 4.440 3.613 2.915 4.178 . 0 0 "[ . 1 . 2]" 1
978 1 65 MET H 1 65 MET QB . . 3.360 2.498 2.041 3.164 . 0 0 "[ . 1 . 2]" 1
979 1 65 MET H 1 65 MET QG . . 4.360 3.584 2.966 4.174 . 0 0 "[ . 1 . 2]" 1
980 1 65 MET H 1 66 VAL H . . 3.340 2.386 1.902 2.987 . 0 0 "[ . 1 . 2]" 1
981 1 65 MET H 1 66 VAL MG2 . . 4.790 3.597 3.113 4.257 . 0 0 "[ . 1 . 2]" 1
982 1 65 MET HA 1 65 MET HG2 . . 4.090 2.962 2.263 3.688 . 0 0 "[ . 1 . 2]" 1
983 1 65 MET HA 1 65 MET QG . . 3.410 2.347 2.108 2.628 . 0 0 "[ . 1 . 2]" 1
984 1 65 MET HA 1 65 MET HG3 . . 4.090 2.798 2.126 3.694 . 0 0 "[ . 1 . 2]" 1
985 1 65 MET HA 1 66 VAL MG1 . . 4.600 4.382 4.137 4.618 0.018 10 0 "[ . 1 . 2]" 1
986 1 65 MET QB 1 66 VAL H . . 4.210 3.405 2.905 3.831 . 0 0 "[ . 1 . 2]" 1
987 1 65 MET QB 1 66 VAL MG1 . . 3.990 2.995 2.771 3.215 . 0 0 "[ . 1 . 2]" 1
988 1 65 MET HB2 1 66 VAL MG1 . . 4.630 3.633 3.215 4.292 . 0 0 "[ . 1 . 2]" 1
989 1 65 MET HB3 1 66 VAL MG1 . . 4.630 3.278 2.817 3.731 . 0 0 "[ . 1 . 2]" 1
990 1 65 MET QG 1 66 VAL H . . 5.130 4.605 4.238 4.793 . 0 0 "[ . 1 . 2]" 1
991 1 65 MET HG2 1 66 VAL MG1 . . 5.460 5.099 4.233 5.412 . 0 0 "[ . 1 . 2]" 1
992 1 65 MET HG3 1 66 VAL MG1 . . 5.460 5.155 3.882 5.466 0.006 4 0 "[ . 1 . 2]" 1
993 1 66 VAL H 1 66 VAL MG1 . . 3.900 2.786 2.491 3.038 . 0 0 "[ . 1 . 2]" 1
994 1 66 VAL H 1 66 VAL MG2 . . 3.880 2.207 2.040 2.390 . 0 0 "[ . 1 . 2]" 1
995 1 66 VAL HA 1 66 VAL MG1 . . 3.190 2.364 2.318 2.413 . 0 0 "[ . 1 . 2]" 1
996 1 66 VAL HA 1 66 VAL MG2 . . 3.590 3.195 3.184 3.200 . 0 0 "[ . 1 . 2]" 1
997 1 66 VAL HA 1 67 ILE H . . 3.290 2.569 2.475 2.585 . 0 0 "[ . 1 . 2]" 1
998 1 66 VAL HB 1 67 ILE H . . 3.270 2.111 2.077 2.278 . 0 0 "[ . 1 . 2]" 1
999 1 66 VAL HB 1 70 TRP HB2 . . 4.590 2.471 2.348 2.571 . 0 0 "[ . 1 . 2]" 1
1000 1 66 VAL HB 1 70 TRP HB3 . . 4.360 2.088 1.989 2.243 . 0 0 "[ . 1 . 2]" 1
1001 1 66 VAL HB 1 70 TRP HE3 . . 5.290 4.863 4.594 5.050 . 0 0 "[ . 1 . 2]" 1
1002 1 66 VAL MG1 1 70 TRP HB2 . . 5.500 4.009 3.854 4.111 . 0 0 "[ . 1 . 2]" 1
1003 1 66 VAL MG1 1 70 TRP HB3 . . 4.890 3.134 3.060 3.197 . 0 0 "[ . 1 . 2]" 1
1004 1 66 VAL MG1 1 70 TRP HD1 . . 3.820 2.353 2.186 2.597 . 0 0 "[ . 1 . 2]" 1
1005 1 66 VAL MG1 1 71 ASP HA . . 5.070 4.925 4.863 5.039 . 0 0 "[ . 1 . 2]" 1
1006 1 66 VAL MG2 1 67 ILE H . . 3.220 2.889 2.807 3.030 . 0 0 "[ . 1 . 2]" 1
1007 1 66 VAL MG2 1 67 ILE MG . . 4.580 4.347 4.297 4.401 . 0 0 "[ . 1 . 2]" 1
1008 1 66 VAL MG2 1 70 TRP H . . 4.400 4.108 3.716 4.409 0.009 16 0 "[ . 1 . 2]" 1
1009 1 66 VAL MG2 1 70 TRP HB2 . . 3.900 3.060 2.611 3.380 . 0 0 "[ . 1 . 2]" 1
1010 1 66 VAL MG2 1 70 TRP HB3 . . 3.700 2.410 2.029 2.766 . 0 0 "[ . 1 . 2]" 1
1011 1 66 VAL MG2 1 70 TRP HD1 . . 3.860 3.662 3.306 3.888 0.028 17 0 "[ . 1 . 2]" 1
1012 1 66 VAL MG2 1 71 ASP H . . 4.120 2.702 2.369 3.000 . 0 0 "[ . 1 . 2]" 1
1013 1 66 VAL MG2 1 71 ASP HA . . 5.300 3.398 3.177 3.644 . 0 0 "[ . 1 . 2]" 1
1014 1 66 VAL MG2 1 71 ASP QB . . 4.290 2.956 2.623 3.508 . 0 0 "[ . 1 . 2]" 1
1015 1 67 ILE H 1 67 ILE MD . . 4.980 3.723 3.687 3.754 . 0 0 "[ . 1 . 2]" 1
1016 1 67 ILE H 1 67 ILE QG . . 3.590 2.196 2.164 2.213 . 0 0 "[ . 1 . 2]" 1
1017 1 67 ILE H 1 67 ILE MG . . 3.210 2.511 2.381 2.602 . 0 0 "[ . 1 . 2]" 1
1018 1 67 ILE H 1 68 LYS H . . 4.640 4.535 4.515 4.569 . 0 0 "[ . 1 . 2]" 1
1019 1 67 ILE H 1 70 TRP HB3 . . 4.690 3.087 2.986 3.385 . 0 0 "[ . 1 . 2]" 1
1020 1 67 ILE HA 1 67 ILE MD . . 4.510 4.172 4.159 4.179 . 0 0 "[ . 1 . 2]" 1
1021 1 67 ILE HA 1 67 ILE MG . . 3.260 2.423 2.409 2.432 . 0 0 "[ . 1 . 2]" 1
1022 1 67 ILE HA 1 68 LYS H . . 3.060 2.418 2.389 2.432 . 0 0 "[ . 1 . 2]" 1
1023 1 67 ILE HA 1 68 LYS QG . . 4.410 4.202 4.010 4.397 . 0 0 "[ . 1 . 2]" 1
1024 1 67 ILE HB 1 68 LYS H . . 3.650 2.421 2.384 2.486 . 0 0 "[ . 1 . 2]" 1
1025 1 67 ILE HB 1 69 GLY H . . 4.770 3.487 3.368 3.531 . 0 0 "[ . 1 . 2]" 1
1026 1 67 ILE HB 1 92 GLY HA2 . . 3.890 3.894 3.770 3.928 0.038 8 0 "[ . 1 . 2]" 1
1027 1 67 ILE MD 1 67 ILE MG . . 3.270 1.967 1.899 2.069 . 0 0 "[ . 1 . 2]" 1
1028 1 67 ILE MD 1 70 TRP HB2 . . 4.670 3.664 3.616 3.724 . 0 0 "[ . 1 . 2]" 1
1029 1 67 ILE MD 1 70 TRP HB3 . . 5.500 5.086 5.050 5.139 . 0 0 "[ . 1 . 2]" 1
1030 1 67 ILE MD 1 70 TRP HE3 . . 4.090 1.994 1.942 2.120 . 0 0 "[ . 1 . 2]" 1
1031 1 67 ILE MD 1 70 TRP HH2 . . 4.380 4.363 4.287 4.403 0.023 14 0 "[ . 1 . 2]" 1
1032 1 67 ILE MD 1 70 TRP HZ2 . . 5.500 5.503 5.375 5.598 0.098 14 0 "[ . 1 . 2]" 1
1033 1 67 ILE MD 1 70 TRP HZ3 . . 4.440 2.488 2.344 2.569 . 0 0 "[ . 1 . 2]" 1
1034 1 67 ILE MD 1 87 ILE MD . . 3.560 2.543 2.156 2.923 . 0 0 "[ . 1 . 2]" 1
1035 1 67 ILE MD 1 87 ILE MG . . 3.690 2.154 1.967 2.420 . 0 0 "[ . 1 . 2]" 1
1036 1 67 ILE MD 1 92 GLY HA2 . . 3.830 2.558 2.094 2.844 . 0 0 "[ . 1 . 2]" 1
1037 1 67 ILE MD 1 92 GLY HA3 . . 4.000 3.825 3.501 4.016 0.016 7 0 "[ . 1 . 2]" 1
1038 1 67 ILE MD 1 110 PHE QE . . 4.560 4.330 4.173 4.509 . 0 0 "[ . 1 . 2]" 1
1039 1 67 ILE QG 1 68 LYS HA . . 5.190 4.278 4.247 4.313 . 0 0 "[ . 1 . 2]" 1
1040 1 67 ILE QG 1 69 GLY QA . . 4.190 2.909 2.797 2.964 . 0 0 "[ . 1 . 2]" 1
1041 1 67 ILE QG 1 70 TRP H . . 3.560 1.875 1.859 1.922 . 0 0 "[ . 1 . 2]" 1
1042 1 67 ILE QG 1 71 ASP H . . 4.350 3.976 3.950 4.023 . 0 0 "[ . 1 . 2]" 1
1043 1 67 ILE MG 1 68 LYS H . . 4.000 3.854 3.829 3.888 . 0 0 "[ . 1 . 2]" 1
1044 1 67 ILE MG 1 70 TRP HB2 . . 5.500 3.728 3.685 3.790 . 0 0 "[ . 1 . 2]" 1
1045 1 67 ILE MG 1 70 TRP HE3 . . 3.980 3.664 3.499 3.770 . 0 0 "[ . 1 . 2]" 1
1046 1 67 ILE MG 1 70 TRP HH2 . . 5.500 5.574 5.549 5.615 0.115 14 0 "[ . 1 . 2]" 1
1047 1 67 ILE MG 1 70 TRP HZ3 . . 4.720 4.381 4.243 4.487 . 0 0 "[ . 1 . 2]" 1
1048 1 67 ILE MG 1 92 GLY HA2 . . 3.860 3.323 3.059 3.580 . 0 0 "[ . 1 . 2]" 1
1049 1 67 ILE MG 1 92 GLY HA3 . . 5.080 4.742 4.505 4.913 . 0 0 "[ . 1 . 2]" 1
1050 1 67 ILE MG 1 93 TYR HA . . 5.380 4.937 4.320 5.382 0.002 2 0 "[ . 1 . 2]" 1
1051 1 67 ILE MG 1 110 PHE QE . . 5.500 5.529 5.511 5.547 0.047 12 0 "[ . 1 . 2]" 1
1052 1 68 LYS H 1 68 LYS QB . . 3.040 2.422 2.253 2.630 . 0 0 "[ . 1 . 2]" 1
1053 1 68 LYS H 1 69 GLY H . . 3.980 2.979 2.927 3.012 . 0 0 "[ . 1 . 2]" 1
1054 1 68 LYS H 1 70 TRP H . . 4.940 4.076 4.007 4.183 . 0 0 "[ . 1 . 2]" 1
1055 1 68 LYS H 1 87 ILE MG . . 5.260 5.091 4.876 5.286 0.026 8 0 "[ . 1 . 2]" 1
1056 1 68 LYS H 1 91 LEU HA . . 5.500 5.240 4.960 5.504 0.004 15 0 "[ . 1 . 2]" 1
1057 1 68 LYS HA 1 68 LYS QE . . 4.540 4.143 3.467 4.528 . 0 0 "[ . 1 . 2]" 1
1058 1 68 LYS HA 1 69 GLY QA . . 5.250 4.492 4.485 4.498 . 0 0 "[ . 1 . 2]" 1
1059 1 68 LYS HA 1 71 ASP QB . . 3.590 3.110 2.912 3.635 0.045 12 0 "[ . 1 . 2]" 1
1060 1 68 LYS QD 1 91 LEU HA . . 4.510 3.618 2.042 4.420 . 0 0 "[ . 1 . 2]" 1
1061 1 68 LYS QD 1 91 LEU QD . . 3.610 2.234 1.774 2.696 . 0 0 "[ . 1 . 2]" 1
1062 1 68 LYS QE 1 91 LEU MD1 . . 5.090 3.901 2.577 5.013 . 0 0 "[ . 1 . 2]" 1
1063 1 68 LYS QE 1 91 LEU QD . . 4.200 2.867 1.874 3.879 . 0 0 "[ . 1 . 2]" 1
1064 1 68 LYS QE 1 91 LEU MD2 . . 5.090 3.051 1.892 4.449 . 0 0 "[ . 1 . 2]" 1
1065 1 69 GLY H 1 70 TRP H . . 4.010 2.760 2.725 2.789 . 0 0 "[ . 1 . 2]" 1
1066 1 69 GLY H 1 87 ILE MG . . 3.690 3.536 3.349 3.698 0.008 6 0 "[ . 1 . 2]" 1
1067 1 69 GLY H 1 91 LEU HA . . 5.500 5.557 5.518 5.592 0.092 11 0 "[ . 1 . 2]" 1
1068 1 69 GLY H 1 91 LEU HB2 . . 4.470 4.509 4.493 4.533 0.063 8 0 "[ . 1 . 2]" 1
1069 1 69 GLY H 1 91 LEU HB3 . . 4.470 3.682 3.500 3.977 . 0 0 "[ . 1 . 2]" 1
1070 1 69 GLY QA 1 87 ILE MD . . 4.440 3.627 3.276 3.902 . 0 0 "[ . 1 . 2]" 1
1071 1 69 GLY QA 1 87 ILE MG . . 4.010 3.302 3.122 3.484 . 0 0 "[ . 1 . 2]" 1
1072 1 69 GLY QA 1 91 LEU QB . . 5.180 4.215 4.090 4.319 . 0 0 "[ . 1 . 2]" 1
1073 1 69 GLY HA2 1 87 ILE MD . . 5.270 4.999 4.650 5.275 0.005 6 0 "[ . 1 . 2]" 1
1074 1 69 GLY HA3 1 87 ILE MD . . 5.270 3.723 3.348 4.025 . 0 0 "[ . 1 . 2]" 1
1075 1 70 TRP H 1 70 TRP HB3 . . 3.540 3.248 3.221 3.266 . 0 0 "[ . 1 . 2]" 1
1076 1 70 TRP H 1 70 TRP HE3 . . 4.910 2.944 2.877 3.070 . 0 0 "[ . 1 . 2]" 1
1077 1 70 TRP H 1 71 ASP H . . 3.340 2.746 2.688 2.799 . 0 0 "[ . 1 . 2]" 1
1078 1 70 TRP H 1 85 LEU QD . . 4.550 3.501 3.281 3.826 . 0 0 "[ . 1 . 2]" 1
1079 1 70 TRP HA 1 70 TRP HE3 . . 4.660 3.123 3.019 3.332 . 0 0 "[ . 1 . 2]" 1
1080 1 70 TRP HA 1 73 GLY H . . 4.250 3.546 3.404 3.630 . 0 0 "[ . 1 . 2]" 1
1081 1 70 TRP HA 1 74 VAL H . . 4.290 3.799 3.475 4.025 . 0 0 "[ . 1 . 2]" 1
1082 1 70 TRP HA 1 85 LEU QD . . 3.820 2.677 2.407 3.076 . 0 0 "[ . 1 . 2]" 1
1083 1 70 TRP HB2 1 70 TRP HE3 . . 3.710 2.822 2.718 2.878 . 0 0 "[ . 1 . 2]" 1
1084 1 70 TRP HB3 1 74 VAL QG . . 5.440 3.535 3.384 3.755 . 0 0 "[ . 1 . 2]" 1
1085 1 70 TRP HD1 1 71 ASP HA . . 5.500 5.198 5.090 5.288 . 0 0 "[ . 1 . 2]" 1
1086 1 70 TRP HD1 1 74 VAL MG1 . . 4.120 3.522 2.997 4.078 . 0 0 "[ . 1 . 2]" 1
1087 1 70 TRP HD1 1 74 VAL MG2 . . 4.120 3.890 3.664 4.221 0.101 14 0 "[ . 1 . 2]" 1
1088 1 70 TRP HE3 1 85 LEU QD . . 3.650 2.856 2.649 3.166 . 0 0 "[ . 1 . 2]" 1
1089 1 70 TRP HE3 1 87 ILE MD . . 4.200 3.139 2.705 3.371 . 0 0 "[ . 1 . 2]" 1
1090 1 70 TRP HH2 1 85 LEU QD . . 4.840 4.371 4.220 4.537 . 0 0 "[ . 1 . 2]" 1
1091 1 70 TRP HH2 1 87 ILE MD . . 4.050 3.916 3.704 4.073 0.023 13 0 "[ . 1 . 2]" 1
1092 1 70 TRP HH2 1 110 PHE HB3 . . 3.830 2.397 2.101 2.674 . 0 0 "[ . 1 . 2]" 1
1093 1 70 TRP HH2 1 110 PHE QD . . 3.900 2.368 2.164 2.652 . 0 0 "[ . 1 . 2]" 1
1094 1 70 TRP HH2 1 112 VAL QG . . 4.620 3.886 3.455 4.347 . 0 0 "[ . 1 . 2]" 1
1095 1 70 TRP HZ2 1 85 LEU QD . . 5.440 5.204 4.996 5.444 0.004 3 0 "[ . 1 . 2]" 1
1096 1 70 TRP HZ2 1 110 PHE QD . . 4.150 4.135 4.050 4.182 0.032 13 0 "[ . 1 . 2]" 1
1097 1 70 TRP HZ2 1 112 VAL MG1 . . 5.500 4.688 4.165 5.043 . 0 0 "[ . 1 . 2]" 1
1098 1 70 TRP HZ2 1 112 VAL QG . . 4.360 3.499 2.737 3.941 . 0 0 "[ . 1 . 2]" 1
1099 1 70 TRP HZ2 1 112 VAL MG2 . . 5.500 3.620 2.776 4.173 . 0 0 "[ . 1 . 2]" 1
1100 1 70 TRP HZ3 1 87 ILE MD . . 4.430 2.089 1.944 2.377 . 0 0 "[ . 1 . 2]" 1
1101 1 70 TRP HZ3 1 110 PHE QD . . 3.540 3.304 3.048 3.435 . 0 0 "[ . 1 . 2]" 1
1102 1 71 ASP H 1 71 ASP QB . . 3.070 2.252 2.186 2.371 . 0 0 "[ . 1 . 2]" 1
1103 1 71 ASP H 1 72 GLU H . . 3.630 2.831 2.763 2.842 . 0 0 "[ . 1 . 2]" 1
1104 1 71 ASP HA 1 74 VAL MG1 . . 4.830 4.179 2.130 4.532 . 0 0 "[ . 1 . 2]" 1
1105 1 71 ASP HA 1 74 VAL QG . . 4.130 2.276 2.127 2.433 . 0 0 "[ . 1 . 2]" 1
1106 1 71 ASP HA 1 74 VAL MG2 . . 4.830 2.409 2.180 4.618 . 0 0 "[ . 1 . 2]" 1
1107 1 71 ASP QB 1 72 GLU H . . 3.700 2.576 2.489 3.387 . 0 0 "[ . 1 . 2]" 1
1108 1 71 ASP QB 1 72 GLU HA . . 5.100 4.153 3.820 4.587 . 0 0 "[ . 1 . 2]" 1
1109 1 72 GLU H 1 72 GLU HB2 . . 3.320 2.206 2.067 2.545 . 0 0 "[ . 1 . 2]" 1
1110 1 72 GLU H 1 72 GLU HB3 . . 3.320 2.967 2.505 3.254 . 0 0 "[ . 1 . 2]" 1
1111 1 72 GLU H 1 73 GLY QA . . 4.660 4.525 4.411 4.582 . 0 0 "[ . 1 . 2]" 1
1112 1 72 GLU H 1 74 VAL QG . . 4.490 4.166 4.056 4.282 . 0 0 "[ . 1 . 2]" 1
1113 1 72 GLU HA 1 72 GLU QG . . 3.640 2.465 2.093 2.985 . 0 0 "[ . 1 . 2]" 1
1114 1 72 GLU HA 1 75 GLN H . . 4.560 3.642 3.394 3.768 . 0 0 "[ . 1 . 2]" 1
1115 1 72 GLU HA 1 75 GLN HB2 . . 3.520 2.290 2.033 2.520 . 0 0 "[ . 1 . 2]" 1
1116 1 72 GLU HA 1 75 GLN QG . . 5.270 3.369 2.750 3.824 . 0 0 "[ . 1 . 2]" 1
1117 1 72 GLU QB 1 73 GLY H . . 3.650 2.606 2.343 2.726 . 0 0 "[ . 1 . 2]" 1
1118 1 73 GLY H 1 74 VAL QG . . 4.010 3.709 3.627 3.992 . 0 0 "[ . 1 . 2]" 1
1119 1 73 GLY H 1 75 GLN H . . 4.800 3.851 3.777 3.993 . 0 0 "[ . 1 . 2]" 1
1120 1 73 GLY H 1 75 GLN HB2 . . 4.630 4.422 4.315 4.596 . 0 0 "[ . 1 . 2]" 1
1121 1 73 GLY H 1 85 LEU QD . . 4.760 3.050 2.847 3.367 . 0 0 "[ . 1 . 2]" 1
1122 1 73 GLY QA 1 74 VAL QG . . 3.900 3.533 3.447 4.044 0.144 14 0 "[ . 1 . 2]" 1
1123 1 73 GLY QA 1 85 LEU MD1 . . 4.400 2.311 2.024 2.662 . 0 0 "[ . 1 . 2]" 1
1124 1 73 GLY QA 1 85 LEU QD . . 3.400 2.253 1.999 2.563 . 0 0 "[ . 1 . 2]" 1
1125 1 73 GLY QA 1 85 LEU MD2 . . 4.400 3.172 2.892 3.631 . 0 0 "[ . 1 . 2]" 1
1126 1 74 VAL H 1 74 VAL HB . . 3.620 3.543 2.399 3.621 0.001 1 0 "[ . 1 . 2]" 1
1127 1 74 VAL H 1 74 VAL QG . . 3.290 1.995 1.893 2.293 . 0 0 "[ . 1 . 2]" 1
1128 1 74 VAL H 1 75 GLN H . . 3.330 2.623 2.378 2.712 . 0 0 "[ . 1 . 2]" 1
1129 1 74 VAL H 1 75 GLN QG . . 5.340 5.064 4.791 5.183 . 0 0 "[ . 1 . 2]" 1
1130 1 74 VAL HA 1 74 VAL MG1 . . 3.600 2.218 2.102 3.195 . 0 0 "[ . 1 . 2]" 1
1131 1 74 VAL HA 1 74 VAL QG . . 3.100 2.132 2.074 2.269 . 0 0 "[ . 1 . 2]" 1
1132 1 74 VAL HA 1 74 VAL MG2 . . 3.600 3.131 2.152 3.196 . 0 0 "[ . 1 . 2]" 1
1133 1 74 VAL HA 1 77 MET H . . 3.700 2.906 2.775 3.031 . 0 0 "[ . 1 . 2]" 1
1134 1 74 VAL HA 1 77 MET QB . . 3.840 1.994 1.887 2.325 . 0 0 "[ . 1 . 2]" 1
1135 1 74 VAL HA 1 77 MET QG . . 4.090 3.465 2.121 4.105 0.015 8 0 "[ . 1 . 2]" 1
1136 1 74 VAL QG 1 75 GLN HA . . 4.270 3.400 3.001 3.578 . 0 0 "[ . 1 . 2]" 1
1137 1 74 VAL QG 1 77 MET QG . . 4.330 3.834 2.979 4.339 0.009 11 0 "[ . 1 . 2]" 1
1138 1 75 GLN H 1 75 GLN HB2 . . 2.980 2.132 2.105 2.156 . 0 0 "[ . 1 . 2]" 1
1139 1 75 GLN H 1 75 GLN QG . . 3.470 2.993 2.913 3.100 . 0 0 "[ . 1 . 2]" 1
1140 1 75 GLN H 1 76 GLY H . . 4.660 2.732 2.652 2.779 . 0 0 "[ . 1 . 2]" 1
1141 1 75 GLN HA 1 75 GLN HG2 . . 3.900 2.445 2.369 2.531 . 0 0 "[ . 1 . 2]" 1
1142 1 75 GLN HA 1 75 GLN HG3 . . 3.900 2.938 2.506 3.593 . 0 0 "[ . 1 . 2]" 1
1143 1 75 GLN HA 1 76 GLY QA . . 5.340 4.276 4.241 4.313 . 0 0 "[ . 1 . 2]" 1
1144 1 75 GLN HB2 1 76 GLY H . . 3.550 3.253 3.168 3.376 . 0 0 "[ . 1 . 2]" 1
1145 1 76 GLY H 1 77 MET H . . 3.580 1.992 1.885 2.157 . 0 0 "[ . 1 . 2]" 1
1146 1 77 MET H 1 77 MET QB . . 2.940 2.231 2.045 2.494 . 0 0 "[ . 1 . 2]" 1
1147 1 77 MET H 1 77 MET QG . . 4.180 3.352 2.131 4.054 . 0 0 "[ . 1 . 2]" 1
1148 1 77 MET H 1 78 LYS H . . 5.500 4.635 4.623 4.645 . 0 0 "[ . 1 . 2]" 1
1149 1 77 MET HA 1 77 MET QG . . 3.930 2.429 2.073 2.955 . 0 0 "[ . 1 . 2]" 1
1150 1 77 MET HA 1 114 LEU QD . . 5.030 4.191 3.802 4.817 . 0 0 "[ . 1 . 2]" 1
1151 1 77 MET QB 1 78 LYS H . . 3.660 3.155 2.644 3.526 . 0 0 "[ . 1 . 2]" 1
1152 1 77 MET QB 1 114 LEU QD . . 3.400 2.120 1.815 3.131 . 0 0 "[ . 1 . 2]" 1
1153 1 77 MET QG 1 114 LEU MD1 . . 4.980 4.038 1.930 4.998 0.018 14 0 "[ . 1 . 2]" 1
1154 1 77 MET QG 1 114 LEU QD . . 4.070 2.519 1.845 3.398 . 0 0 "[ . 1 . 2]" 1
1155 1 77 MET QG 1 114 LEU MD2 . . 4.980 2.962 1.848 4.854 . 0 0 "[ . 1 . 2]" 1
1156 1 78 LYS H 1 78 LYS HB2 . . 3.780 2.575 2.453 2.728 . 0 0 "[ . 1 . 2]" 1
1157 1 78 LYS HA 1 78 LYS HD2 . . 4.920 4.502 4.253 4.597 . 0 0 "[ . 1 . 2]" 1
1158 1 78 LYS HA 1 78 LYS QD . . 4.280 4.046 3.620 4.193 . 0 0 "[ . 1 . 2]" 1
1159 1 78 LYS HA 1 78 LYS HD3 . . 4.920 4.616 3.873 4.913 . 0 0 "[ . 1 . 2]" 1
1160 1 78 LYS HA 1 78 LYS QE . . 4.870 4.426 4.096 4.826 . 0 0 "[ . 1 . 2]" 1
1161 1 78 LYS HA 1 78 LYS HG2 . . 3.830 2.802 2.364 3.201 . 0 0 "[ . 1 . 2]" 1
1162 1 78 LYS HA 1 78 LYS QG . . 3.260 2.430 2.315 2.518 . 0 0 "[ . 1 . 2]" 1
1163 1 78 LYS HA 1 78 LYS HG3 . . 3.830 2.805 2.389 3.425 . 0 0 "[ . 1 . 2]" 1
1164 1 78 LYS HA 1 79 VAL H . . 3.160 2.349 2.268 2.474 . 0 0 "[ . 1 . 2]" 1
1165 1 78 LYS HA 1 114 LEU QD . . 5.080 3.557 2.189 4.083 . 0 0 "[ . 1 . 2]" 1
1166 1 78 LYS HA 1 117 VAL QG . . 5.090 4.768 4.049 5.097 0.007 4 0 "[ . 1 . 2]" 1
1167 1 78 LYS HB2 1 78 LYS HD2 . . 3.900 2.394 2.005 2.986 . 0 0 "[ . 1 . 2]" 1
1168 1 78 LYS HB2 1 78 LYS QD . . 3.350 2.274 1.962 2.671 . 0 0 "[ . 1 . 2]" 1
1169 1 78 LYS HB2 1 78 LYS HD3 . . 3.900 3.355 1.989 3.651 . 0 0 "[ . 1 . 2]" 1
1170 1 78 LYS HB2 1 78 LYS QE . . 3.760 3.053 2.161 3.773 0.013 2 0 "[ . 1 . 2]" 1
1171 1 78 LYS HB3 1 78 LYS QE . . 4.850 3.857 3.554 4.268 . 0 0 "[ . 1 . 2]" 1
1172 1 78 LYS HB3 1 79 VAL H . . 3.800 2.574 2.296 2.786 . 0 0 "[ . 1 . 2]" 1
1173 1 78 LYS QE 1 78 LYS QG . . 3.310 2.097 1.971 2.247 . 0 0 "[ . 1 . 2]" 1
1174 1 79 VAL H 1 79 VAL HB . . 3.330 2.626 2.584 2.683 . 0 0 "[ . 1 . 2]" 1
1175 1 79 VAL H 1 79 VAL MG2 . . 2.960 2.106 1.936 2.234 . 0 0 "[ . 1 . 2]" 1
1176 1 79 VAL H 1 114 LEU QD . . 4.490 3.596 2.554 4.141 . 0 0 "[ . 1 . 2]" 1
1177 1 79 VAL H 1 117 VAL QG . . 4.780 3.907 3.338 4.116 . 0 0 "[ . 1 . 2]" 1
1178 1 79 VAL HA 1 79 VAL MG1 . . 3.480 2.303 2.253 2.357 . 0 0 "[ . 1 . 2]" 1
1179 1 79 VAL HA 1 79 VAL MG2 . . 3.480 2.365 2.271 2.433 . 0 0 "[ . 1 . 2]" 1
1180 1 79 VAL HA 1 80 GLY H . . 3.270 2.149 2.145 2.155 . 0 0 "[ . 1 . 2]" 1
1181 1 79 VAL HA 1 80 GLY QA . . 5.040 3.921 3.912 3.928 . 0 0 "[ . 1 . 2]" 1
1182 1 79 VAL HA 1 81 GLY H . . 3.990 3.395 3.364 3.442 . 0 0 "[ . 1 . 2]" 1
1183 1 79 VAL HA 1 114 LEU HA . . 5.500 4.493 4.277 4.653 . 0 0 "[ . 1 . 2]" 1
1184 1 79 VAL HA 1 114 LEU QB . . 3.920 1.969 1.942 2.022 . 0 0 "[ . 1 . 2]" 1
1185 1 79 VAL HA 1 114 LEU MD1 . . 4.660 2.936 1.973 4.385 . 0 0 "[ . 1 . 2]" 1
1186 1 79 VAL HA 1 114 LEU QD . . 3.840 2.506 1.851 3.288 . 0 0 "[ . 1 . 2]" 1
1187 1 79 VAL HA 1 114 LEU MD2 . . 4.660 3.748 1.900 4.698 0.038 10 0 "[ . 1 . 2]" 1
1188 1 79 VAL HA 1 114 LEU HG . . 3.990 3.342 2.175 4.020 0.030 15 0 "[ . 1 . 2]" 1
1189 1 79 VAL HA 1 116 ASP HA . . 5.500 4.205 3.917 4.485 . 0 0 "[ . 1 . 2]" 1
1190 1 79 VAL HA 1 117 VAL QG . . 5.090 3.966 3.097 4.498 . 0 0 "[ . 1 . 2]" 1
1191 1 79 VAL MG1 1 80 GLY H . . 3.700 2.614 2.441 2.815 . 0 0 "[ . 1 . 2]" 1
1192 1 79 VAL MG1 1 80 GLY HA2 . . 4.920 3.741 3.633 3.843 . 0 0 "[ . 1 . 2]" 1
1193 1 79 VAL MG1 1 80 GLY QA . . 4.170 3.178 3.110 3.242 . 0 0 "[ . 1 . 2]" 1
1194 1 79 VAL MG1 1 80 GLY HA3 . . 4.920 3.439 3.329 3.525 . 0 0 "[ . 1 . 2]" 1
1195 1 79 VAL MG1 1 81 GLY H . . 5.160 4.419 4.341 4.486 . 0 0 "[ . 1 . 2]" 1
1196 1 79 VAL MG1 1 116 ASP HA . . 3.590 2.258 1.949 2.619 . 0 0 "[ . 1 . 2]" 1
1197 1 79 VAL MG1 1 116 ASP QB . . 4.440 3.854 3.504 4.235 . 0 0 "[ . 1 . 2]" 1
1198 1 79 VAL MG2 1 81 GLY H . . 5.160 5.053 5.041 5.073 . 0 0 "[ . 1 . 2]" 1
1199 1 79 VAL MG2 1 116 ASP HA . . 3.490 2.903 2.116 3.286 . 0 0 "[ . 1 . 2]" 1
1200 1 79 VAL MG2 1 116 ASP QB . . 5.190 4.635 4.055 4.962 . 0 0 "[ . 1 . 2]" 1
1201 1 79 VAL MG2 1 117 VAL H . . 3.630 2.964 2.262 3.422 . 0 0 "[ . 1 . 2]" 1
1202 1 79 VAL MG2 1 117 VAL HA . . 5.160 4.093 3.659 4.538 . 0 0 "[ . 1 . 2]" 1
1203 1 79 VAL MG2 1 117 VAL HB . . 4.040 3.368 2.494 3.995 . 0 0 "[ . 1 . 2]" 1
1204 1 79 VAL MG2 1 117 VAL QG . . 2.870 1.805 1.627 1.978 . 0 0 "[ . 1 . 2]" 1
1205 1 80 GLY H 1 81 GLY H . . 3.500 2.525 2.490 2.535 . 0 0 "[ . 1 . 2]" 1
1206 1 80 GLY H 1 114 LEU H . . 4.810 4.222 4.021 4.375 . 0 0 "[ . 1 . 2]" 1
1207 1 80 GLY H 1 114 LEU QB . . 4.070 2.124 1.928 2.516 . 0 0 "[ . 1 . 2]" 1
1208 1 80 GLY H 1 114 LEU QD . . 4.770 3.413 2.665 4.125 . 0 0 "[ . 1 . 2]" 1
1209 1 81 GLY H 1 82 VAL H . . 4.620 4.539 4.490 4.586 . 0 0 "[ . 1 . 2]" 1
1210 1 81 GLY H 1 82 VAL QG . . 5.500 4.390 4.212 4.502 . 0 0 "[ . 1 . 2]" 1
1211 1 81 GLY H 1 114 LEU H . . 4.360 3.663 3.518 3.827 . 0 0 "[ . 1 . 2]" 1
1212 1 81 GLY H 1 114 LEU MD1 . . 5.500 4.555 3.677 5.100 . 0 0 "[ . 1 . 2]" 1
1213 1 81 GLY H 1 114 LEU QD . . 4.660 3.973 3.482 4.274 . 0 0 "[ . 1 . 2]" 1
1214 1 81 GLY H 1 114 LEU MD2 . . 5.500 4.452 3.894 4.959 . 0 0 "[ . 1 . 2]" 1
1215 1 81 GLY QA 1 82 VAL HB . . 5.340 4.468 4.360 4.519 . 0 0 "[ . 1 . 2]" 1
1216 1 81 GLY QA 1 82 VAL QG . . 4.960 3.375 3.189 3.469 . 0 0 "[ . 1 . 2]" 1
1217 1 81 GLY QA 1 114 LEU QB . . 4.320 3.607 3.296 3.963 . 0 0 "[ . 1 . 2]" 1
1218 1 82 VAL H 1 82 VAL HB . . 3.790 2.699 2.608 2.838 . 0 0 "[ . 1 . 2]" 1
1219 1 82 VAL H 1 82 VAL QG . . 3.680 2.672 2.541 2.805 . 0 0 "[ . 1 . 2]" 1
1220 1 82 VAL HA 1 82 VAL QG . . 3.170 2.063 2.038 2.121 . 0 0 "[ . 1 . 2]" 1
1221 1 82 VAL HA 1 83 ARG H . . 3.300 2.157 2.141 2.186 . 0 0 "[ . 1 . 2]" 1
1222 1 82 VAL HA 1 113 GLU HA . . 3.830 2.159 1.992 2.447 . 0 0 "[ . 1 . 2]" 1
1223 1 82 VAL HA 1 113 GLU QB . . 4.260 3.017 2.484 3.787 . 0 0 "[ . 1 . 2]" 1
1224 1 82 VAL HA 1 114 LEU H . . 4.240 3.474 3.214 3.700 . 0 0 "[ . 1 . 2]" 1
1225 1 82 VAL HB 1 83 ARG H . . 4.310 4.106 3.974 4.207 . 0 0 "[ . 1 . 2]" 1
1226 1 82 VAL QG 1 83 ARG H . . 3.610 2.461 2.111 2.702 . 0 0 "[ . 1 . 2]" 1
1227 1 82 VAL QG 1 83 ARG HA . . 4.760 3.520 3.304 3.617 . 0 0 "[ . 1 . 2]" 1
1228 1 82 VAL QG 1 111 GLU HA . . 5.500 4.674 4.490 4.861 . 0 0 "[ . 1 . 2]" 1
1229 1 82 VAL QG 1 112 VAL H . . 4.450 3.948 3.735 4.106 . 0 0 "[ . 1 . 2]" 1
1230 1 82 VAL QG 1 113 GLU H . . 4.630 4.063 3.949 4.232 . 0 0 "[ . 1 . 2]" 1
1231 1 82 VAL QG 1 113 GLU HA . . 3.820 2.574 2.256 2.822 . 0 0 "[ . 1 . 2]" 1
1232 1 82 VAL QG 1 113 GLU QB . . 3.070 1.869 1.661 2.269 . 0 0 "[ . 1 . 2]" 1
1233 1 82 VAL QG 1 113 GLU QG . . 3.710 2.711 1.874 3.423 . 0 0 "[ . 1 . 2]" 1
1234 1 82 VAL QG 1 114 LEU H . . 4.120 3.582 3.361 3.747 . 0 0 "[ . 1 . 2]" 1
1235 1 83 ARG H 1 114 LEU H . . 5.200 4.828 4.600 5.104 . 0 0 "[ . 1 . 2]" 1
1236 1 83 ARG HA 1 84 ARG H . . 3.270 2.212 2.203 2.222 . 0 0 "[ . 1 . 2]" 1
1237 1 84 ARG H 1 84 ARG QB . . 3.170 2.249 2.147 2.311 . 0 0 "[ . 1 . 2]" 1
1238 1 84 ARG H 1 84 ARG QG . . 4.540 3.932 3.698 4.012 . 0 0 "[ . 1 . 2]" 1
1239 1 84 ARG H 1 85 LEU H . . 4.290 4.269 4.254 4.312 0.022 20 0 "[ . 1 . 2]" 1
1240 1 84 ARG HA 1 84 ARG QD . . 4.750 3.874 3.495 4.070 . 0 0 "[ . 1 . 2]" 1
1241 1 84 ARG HA 1 84 ARG QG . . 3.530 2.242 2.076 2.526 . 0 0 "[ . 1 . 2]" 1
1242 1 84 ARG HA 1 85 LEU H . . 3.260 2.171 2.159 2.175 . 0 0 "[ . 1 . 2]" 1
1243 1 84 ARG HA 1 109 VAL QG . . 5.170 4.329 4.179 4.436 . 0 0 "[ . 1 . 2]" 1
1244 1 84 ARG HA 1 111 GLU HA . . 3.770 2.164 2.067 2.263 . 0 0 "[ . 1 . 2]" 1
1245 1 84 ARG HA 1 112 VAL H . . 4.200 3.098 2.920 3.299 . 0 0 "[ . 1 . 2]" 1
1246 1 84 ARG QB 1 84 ARG QD . . 3.380 2.150 1.997 2.351 . 0 0 "[ . 1 . 2]" 1
1247 1 84 ARG QD 1 109 VAL QG . . 3.740 2.396 1.904 3.325 . 0 0 "[ . 1 . 2]" 1
1248 1 84 ARG QD 1 111 GLU QG . . 4.830 4.105 2.876 4.837 0.007 17 0 "[ . 1 . 2]" 1
1249 1 84 ARG QG 1 85 LEU H . . 3.650 3.429 3.314 3.646 . 0 0 "[ . 1 . 2]" 1
1250 1 84 ARG QG 1 86 THR HA . . 5.500 4.759 4.222 5.458 . 0 0 "[ . 1 . 2]" 1
1251 1 84 ARG QG 1 109 VAL QG . . 3.870 2.213 2.077 2.456 . 0 0 "[ . 1 . 2]" 1
1252 1 84 ARG QG 1 110 PHE H . . 4.330 3.991 3.768 4.326 . 0 0 "[ . 1 . 2]" 1
1253 1 84 ARG QG 1 111 GLU HA . . 4.150 2.943 2.744 3.347 . 0 0 "[ . 1 . 2]" 1
1254 1 84 ARG QG 1 111 GLU HG2 . . 4.330 4.037 2.895 4.336 0.006 1 0 "[ . 1 . 2]" 1
1255 1 84 ARG QG 1 111 GLU HG3 . . 4.330 3.383 2.561 4.345 0.015 19 0 "[ . 1 . 2]" 1
1256 1 85 LEU H 1 85 LEU HB2 . . 3.640 2.679 2.618 2.775 . 0 0 "[ . 1 . 2]" 1
1257 1 85 LEU H 1 85 LEU QD . . 4.460 3.754 3.721 3.777 . 0 0 "[ . 1 . 2]" 1
1258 1 85 LEU H 1 86 THR H . . 4.870 4.428 4.384 4.473 . 0 0 "[ . 1 . 2]" 1
1259 1 85 LEU H 1 110 PHE HB2 . . 4.650 4.513 4.410 4.614 . 0 0 "[ . 1 . 2]" 1
1260 1 85 LEU H 1 111 GLU HA . . 4.430 2.670 2.520 2.864 . 0 0 "[ . 1 . 2]" 1
1261 1 85 LEU HA 1 85 LEU MD1 . . 4.610 2.615 2.403 2.849 . 0 0 "[ . 1 . 2]" 1
1262 1 85 LEU HA 1 85 LEU QD . . 3.530 2.576 2.383 2.777 . 0 0 "[ . 1 . 2]" 1
1263 1 85 LEU HA 1 85 LEU MD2 . . 4.610 3.908 3.844 3.963 . 0 0 "[ . 1 . 2]" 1
1264 1 85 LEU HA 1 85 LEU HG . . 4.080 2.771 2.628 2.956 . 0 0 "[ . 1 . 2]" 1
1265 1 85 LEU HA 1 86 THR H . . 3.210 2.139 2.138 2.142 . 0 0 "[ . 1 . 2]" 1
1266 1 85 LEU HA 1 87 ILE MD . . 4.700 4.159 3.922 4.708 0.008 7 0 "[ . 1 . 2]" 1
1267 1 85 LEU HB2 1 87 ILE MD . . 5.030 4.057 3.876 4.410 . 0 0 "[ . 1 . 2]" 1
1268 1 85 LEU HB2 1 110 PHE HB3 . . 5.500 5.551 5.533 5.587 0.087 17 0 "[ . 1 . 2]" 1
1269 1 85 LEU HB2 1 112 VAL MG1 . . 5.410 4.846 4.494 5.016 . 0 0 "[ . 1 . 2]" 1
1270 1 85 LEU HB2 1 112 VAL QG . . 4.220 2.760 2.293 3.029 . 0 0 "[ . 1 . 2]" 1
1271 1 85 LEU HB2 1 112 VAL MG2 . . 5.410 2.777 2.300 3.055 . 0 0 "[ . 1 . 2]" 1
1272 1 85 LEU HB3 1 86 THR H . . 4.490 4.269 4.213 4.339 . 0 0 "[ . 1 . 2]" 1
1273 1 85 LEU HB3 1 87 ILE MD . . 3.840 2.837 2.572 3.051 . 0 0 "[ . 1 . 2]" 1
1274 1 85 LEU HB3 1 110 PHE HB2 . . 5.200 3.319 3.179 3.415 . 0 0 "[ . 1 . 2]" 1
1275 1 85 LEU HB3 1 110 PHE HB3 . . 5.390 3.907 3.832 3.985 . 0 0 "[ . 1 . 2]" 1
1276 1 85 LEU QD 1 86 THR H . . 4.070 3.383 3.069 3.545 . 0 0 "[ . 1 . 2]" 1
1277 1 85 LEU QD 1 87 ILE MD . . 3.630 1.886 1.845 1.974 . 0 0 "[ . 1 . 2]" 1
1278 1 85 LEU QD 1 110 PHE HA . . 5.440 5.493 5.448 5.516 0.076 20 0 "[ . 1 . 2]" 1
1279 1 85 LEU QD 1 110 PHE HB2 . . 4.170 3.133 3.068 3.180 . 0 0 "[ . 1 . 2]" 1
1280 1 85 LEU QD 1 110 PHE QD . . 4.800 4.239 4.149 4.329 . 0 0 "[ . 1 . 2]" 1
1281 1 85 LEU HG 1 86 THR H . . 4.470 2.986 2.803 3.144 . 0 0 "[ . 1 . 2]" 1
1282 1 85 LEU HG 1 86 THR HA . . 5.500 4.247 4.078 4.435 . 0 0 "[ . 1 . 2]" 1
1283 1 85 LEU HG 1 87 ILE MD . . 5.500 2.321 1.979 3.205 . 0 0 "[ . 1 . 2]" 1
1284 1 86 THR H 1 86 THR HB . . 3.790 2.900 2.573 3.113 . 0 0 "[ . 1 . 2]" 1
1285 1 86 THR H 1 86 THR MG . . 4.270 3.807 3.729 3.848 . 0 0 "[ . 1 . 2]" 1
1286 1 86 THR H 1 87 ILE H . . 5.210 4.377 4.357 4.403 . 0 0 "[ . 1 . 2]" 1
1287 1 86 THR H 1 87 ILE MD . . 4.770 3.920 3.742 4.412 . 0 0 "[ . 1 . 2]" 1
1288 1 86 THR HA 1 86 THR MG . . 3.450 2.141 2.003 2.317 . 0 0 "[ . 1 . 2]" 1
1289 1 86 THR HA 1 87 ILE H . . 3.190 2.142 2.141 2.143 . 0 0 "[ . 1 . 2]" 1
1290 1 86 THR HA 1 87 ILE HB . . 4.800 4.734 4.655 4.805 0.005 17 0 "[ . 1 . 2]" 1
1291 1 86 THR HA 1 87 ILE QG . . 5.040 4.233 3.927 4.373 . 0 0 "[ . 1 . 2]" 1
1292 1 86 THR HA 1 109 VAL HA . . 3.870 2.593 2.512 2.734 . 0 0 "[ . 1 . 2]" 1
1293 1 86 THR HA 1 109 VAL QG . . 3.650 3.413 3.235 3.590 . 0 0 "[ . 1 . 2]" 1
1294 1 86 THR HA 1 110 PHE H . . 4.430 2.822 2.679 2.941 . 0 0 "[ . 1 . 2]" 1
1295 1 86 THR HB 1 87 ILE H . . 4.760 4.022 3.867 4.263 . 0 0 "[ . 1 . 2]" 1
1296 1 86 THR HB 1 87 ILE HA . . 4.810 4.502 4.398 4.762 . 0 0 "[ . 1 . 2]" 1
1297 1 86 THR MG 1 87 ILE H . . 4.110 2.823 2.673 2.962 . 0 0 "[ . 1 . 2]" 1
1298 1 86 THR MG 1 109 VAL HA . . 3.730 2.688 2.388 3.052 . 0 0 "[ . 1 . 2]" 1
1299 1 87 ILE H 1 87 ILE HB . . 3.730 2.693 2.615 2.746 . 0 0 "[ . 1 . 2]" 1
1300 1 87 ILE H 1 87 ILE MD . . 4.980 2.172 1.939 2.630 . 0 0 "[ . 1 . 2]" 1
1301 1 87 ILE H 1 87 ILE QG . . 3.660 3.176 2.883 3.331 . 0 0 "[ . 1 . 2]" 1
1302 1 87 ILE H 1 87 ILE MG . . 4.310 3.871 3.840 3.896 . 0 0 "[ . 1 . 2]" 1
1303 1 87 ILE H 1 107 THR HA . . 5.500 5.536 5.523 5.580 0.080 11 0 "[ . 1 . 2]" 1
1304 1 87 ILE H 1 107 THR MG . . 4.750 3.712 3.518 3.846 . 0 0 "[ . 1 . 2]" 1
1305 1 87 ILE H 1 108 LEU H . . 4.310 3.949 3.848 4.048 . 0 0 "[ . 1 . 2]" 1
1306 1 87 ILE H 1 109 VAL HA . . 4.420 3.512 3.341 3.673 . 0 0 "[ . 1 . 2]" 1
1307 1 87 ILE H 1 109 VAL QG . . 4.820 4.346 4.164 4.465 . 0 0 "[ . 1 . 2]" 1
1308 1 87 ILE H 1 110 PHE H . . 3.980 3.594 3.434 3.715 . 0 0 "[ . 1 . 2]" 1
1309 1 87 ILE HA 1 87 ILE MG . . 3.640 2.360 2.282 2.396 . 0 0 "[ . 1 . 2]" 1
1310 1 87 ILE HA 1 88 PRO HG2 . . 5.100 4.270 4.263 4.278 . 0 0 "[ . 1 . 2]" 1
1311 1 87 ILE HA 1 88 PRO HG3 . . 4.440 4.331 4.329 4.334 . 0 0 "[ . 1 . 2]" 1
1312 1 87 ILE HA 1 91 LEU QB . . 5.340 3.915 3.742 4.176 . 0 0 "[ . 1 . 2]" 1
1313 1 87 ILE HA 1 91 LEU QD . . 4.460 4.167 3.667 4.460 0.000 16 0 "[ . 1 . 2]" 1
1314 1 87 ILE HB 1 92 GLY HA2 . . 4.610 4.188 3.896 4.472 . 0 0 "[ . 1 . 2]" 1
1315 1 87 ILE HB 1 108 LEU H . . 4.690 4.400 4.243 4.473 . 0 0 "[ . 1 . 2]" 1
1316 1 87 ILE HB 1 108 LEU QB . . 4.070 3.064 2.656 3.341 . 0 0 "[ . 1 . 2]" 1
1317 1 87 ILE HB 1 110 PHE QD . . 5.180 3.111 2.861 3.368 . 0 0 "[ . 1 . 2]" 1
1318 1 87 ILE HB 1 110 PHE QE . . 5.500 3.715 3.501 3.985 . 0 0 "[ . 1 . 2]" 1
1319 1 87 ILE MD 1 108 LEU QB . . 4.860 3.555 3.075 3.767 . 0 0 "[ . 1 . 2]" 1
1320 1 87 ILE MD 1 110 PHE HA . . 5.470 4.477 4.335 4.701 . 0 0 "[ . 1 . 2]" 1
1321 1 87 ILE MD 1 110 PHE HB2 . . 5.040 2.172 2.031 2.389 . 0 0 "[ . 1 . 2]" 1
1322 1 87 ILE MD 1 110 PHE HB3 . . 5.290 3.365 3.186 3.581 . 0 0 "[ . 1 . 2]" 1
1323 1 87 ILE MD 1 110 PHE QD . . 3.560 1.930 1.875 2.027 . 0 0 "[ . 1 . 2]" 1
1324 1 87 ILE QG 1 92 GLY HA2 . . 5.000 4.574 4.301 4.885 . 0 0 "[ . 1 . 2]" 1
1325 1 87 ILE QG 1 110 PHE QD . . 5.330 3.991 3.741 4.171 . 0 0 "[ . 1 . 2]" 1
1326 1 87 ILE MG 1 88 PRO HA . . 4.400 4.154 4.075 4.261 . 0 0 "[ . 1 . 2]" 1
1327 1 87 ILE MG 1 88 PRO QD . . 4.150 1.918 1.894 1.959 . 0 0 "[ . 1 . 2]" 1
1328 1 87 ILE MG 1 89 PRO HA . . 5.270 4.855 4.706 4.990 . 0 0 "[ . 1 . 2]" 1
1329 1 87 ILE MG 1 91 LEU HB2 . . 3.620 2.042 1.956 2.138 . 0 0 "[ . 1 . 2]" 1
1330 1 87 ILE MG 1 91 LEU HB3 . . 3.620 3.010 2.748 3.304 . 0 0 "[ . 1 . 2]" 1
1331 1 87 ILE MG 1 92 GLY H . . 4.140 3.297 2.852 3.574 . 0 0 "[ . 1 . 2]" 1
1332 1 87 ILE MG 1 92 GLY HA2 . . 4.260 2.560 2.293 2.927 . 0 0 "[ . 1 . 2]" 1
1333 1 87 ILE MG 1 92 GLY HA3 . . 4.160 2.875 2.656 3.366 . 0 0 "[ . 1 . 2]" 1
1334 1 87 ILE MG 1 110 PHE QD . . 5.500 4.510 4.233 4.748 . 0 0 "[ . 1 . 2]" 1
1335 1 87 ILE MG 1 110 PHE QE . . 5.500 4.622 4.404 4.949 . 0 0 "[ . 1 . 2]" 1
1336 1 88 PRO HA 1 89 PRO QD . . 3.460 2.207 2.201 2.211 . 0 0 "[ . 1 . 2]" 1
1337 1 88 PRO QB 1 89 PRO QD . . 3.830 1.904 1.894 1.921 . 0 0 "[ . 1 . 2]" 1
1338 1 88 PRO QD 1 91 LEU H . . 4.860 3.534 3.498 3.596 . 0 0 "[ . 1 . 2]" 1
1339 1 88 PRO QD 1 91 LEU QB . . 4.780 2.241 1.985 2.588 . 0 0 "[ . 1 . 2]" 1
1340 1 88 PRO QD 1 91 LEU QD . . 3.810 2.658 2.147 2.962 . 0 0 "[ . 1 . 2]" 1
1341 1 88 PRO HG2 1 91 LEU HA . . 5.240 4.373 4.190 4.601 . 0 0 "[ . 1 . 2]" 1
1342 1 88 PRO HG3 1 91 LEU QB . . 5.340 3.672 3.386 4.024 . 0 0 "[ . 1 . 2]" 1
1343 1 88 PRO HG3 1 91 LEU HG . . 5.500 2.834 2.719 3.016 . 0 0 "[ . 1 . 2]" 1
1344 1 89 PRO HA 1 92 GLY HA3 . . 4.970 3.972 3.821 4.112 . 0 0 "[ . 1 . 2]" 1
1345 1 89 PRO QB 1 104 PRO HA . . 4.520 3.907 3.369 4.558 0.038 20 0 "[ . 1 . 2]" 1
1346 1 89 PRO QB 1 105 ASN H . . 5.350 3.275 2.362 4.656 . 0 0 "[ . 1 . 2]" 1
1347 1 89 PRO QB 1 106 ALA H . . 4.370 2.034 1.917 2.485 . 0 0 "[ . 1 . 2]" 1
1348 1 89 PRO QG 1 105 ASN HA . . 3.430 2.171 1.930 2.639 . 0 0 "[ . 1 . 2]" 1
1349 1 89 PRO QG 1 105 ASN QB . . 4.720 3.714 3.445 4.166 . 0 0 "[ . 1 . 2]" 1
1350 1 89 PRO QG 1 106 ALA H . . 4.740 2.301 1.928 3.060 . 0 0 "[ . 1 . 2]" 1
1351 1 89 PRO HG2 1 105 ASN HA . . 4.190 3.012 2.649 3.632 . 0 0 "[ . 1 . 2]" 1
1352 1 89 PRO HG3 1 105 ASN HA . . 4.190 2.227 1.982 2.718 . 0 0 "[ . 1 . 2]" 1
1353 1 90 GLN H 1 90 GLN QB . . 3.680 2.462 2.293 2.911 . 0 0 "[ . 1 . 2]" 1
1354 1 90 GLN H 1 90 GLN QE . . 4.820 4.411 2.724 4.820 0.000 19 0 "[ . 1 . 2]" 1
1355 1 90 GLN H 1 90 GLN QG . . 4.570 3.230 1.911 4.132 . 0 0 "[ . 1 . 2]" 1
1356 1 90 GLN H 1 91 LEU H . . 3.830 2.258 2.177 2.413 . 0 0 "[ . 1 . 2]" 1
1357 1 90 GLN H 1 92 GLY H . . 4.820 3.553 3.259 3.747 . 0 0 "[ . 1 . 2]" 1
1358 1 90 GLN HA 1 94 GLY H . . 5.080 4.120 3.203 5.095 0.015 20 0 "[ . 1 . 2]" 1
1359 1 90 GLN QB 1 91 LEU H . . 4.390 2.661 2.336 3.396 . 0 0 "[ . 1 . 2]" 1
1360 1 90 GLN QB 1 91 LEU MD1 . . 5.500 4.330 4.007 5.089 . 0 0 "[ . 1 . 2]" 1
1361 1 90 GLN QB 1 91 LEU QD . . 4.440 2.800 2.301 3.266 . 0 0 "[ . 1 . 2]" 1
1362 1 90 GLN QB 1 91 LEU MD2 . . 5.500 2.844 2.313 3.360 . 0 0 "[ . 1 . 2]" 1
1363 1 90 GLN QB 1 91 LEU HG . . 4.880 3.044 2.636 3.992 . 0 0 "[ . 1 . 2]" 1
1364 1 90 GLN QB 1 92 GLY H . . 4.520 4.402 4.183 4.630 0.110 4 0 "[ . 1 . 2]" 1
1365 1 90 GLN QG 1 91 LEU QD . . 4.660 3.129 2.132 4.506 . 0 0 "[ . 1 . 2]" 1
1366 1 90 GLN QG 1 91 LEU HG . . 5.090 3.825 1.969 5.066 . 0 0 "[ . 1 . 2]" 1
1367 1 91 LEU H 1 91 LEU HB2 . . 4.140 2.638 2.524 2.756 . 0 0 "[ . 1 . 2]" 1
1368 1 91 LEU H 1 91 LEU QB . . 3.520 2.580 2.481 2.681 . 0 0 "[ . 1 . 2]" 1
1369 1 91 LEU H 1 91 LEU HB3 . . 4.140 3.655 3.611 3.666 . 0 0 "[ . 1 . 2]" 1
1370 1 91 LEU H 1 91 LEU MD1 . . 4.520 3.773 3.584 3.870 . 0 0 "[ . 1 . 2]" 1
1371 1 91 LEU H 1 91 LEU QD . . 3.770 2.968 2.701 3.150 . 0 0 "[ . 1 . 2]" 1
1372 1 91 LEU H 1 91 LEU MD2 . . 4.520 3.119 2.764 3.484 . 0 0 "[ . 1 . 2]" 1
1373 1 91 LEU H 1 91 LEU HG . . 4.290 2.305 2.100 2.474 . 0 0 "[ . 1 . 2]" 1
1374 1 91 LEU H 1 92 GLY H . . 3.320 2.654 2.463 2.767 . 0 0 "[ . 1 . 2]" 1
1375 1 91 LEU HA 1 91 LEU QD . . 2.900 2.139 1.971 2.375 . 0 0 "[ . 1 . 2]" 1
1376 1 91 LEU HA 1 91 LEU HG . . 4.060 3.362 3.171 3.504 . 0 0 "[ . 1 . 2]" 1
1377 1 91 LEU QB 1 92 GLY H . . 4.210 3.637 3.199 3.754 . 0 0 "[ . 1 . 2]" 1
1378 1 91 LEU HB2 1 92 GLY H . . 4.890 3.853 3.307 4.001 . 0 0 "[ . 1 . 2]" 1
1379 1 91 LEU HB3 1 92 GLY H . . 4.890 4.473 4.260 4.545 . 0 0 "[ . 1 . 2]" 1
1380 1 91 LEU HG 1 92 GLY H . . 5.500 4.701 4.357 4.860 . 0 0 "[ . 1 . 2]" 1
1381 1 92 GLY H 1 93 TYR H . . 4.640 3.340 2.511 4.353 . 0 0 "[ . 1 . 2]" 1
1382 1 92 GLY H 1 94 GLY H . . 4.310 3.363 2.859 4.140 . 0 0 "[ . 1 . 2]" 1
1383 1 92 GLY HA2 1 94 GLY H . . 5.500 4.800 3.511 5.417 . 0 0 "[ . 1 . 2]" 1
1384 1 92 GLY HA3 1 93 TYR QD . . 5.280 3.997 3.085 4.575 . 0 0 "[ . 1 . 2]" 1
1385 1 92 GLY HA3 1 94 GLY H . . 4.480 4.010 3.566 4.484 0.004 14 0 "[ . 1 . 2]" 1
1386 1 93 TYR H 1 93 TYR QD . . 4.180 2.765 1.959 3.648 . 0 0 "[ . 1 . 2]" 1
1387 1 93 TYR H 1 94 GLY H . . 3.700 2.509 1.925 3.060 . 0 0 "[ . 1 . 2]" 1
1388 1 93 TYR H 1 108 LEU QD . . 5.070 3.239 2.205 4.393 . 0 0 "[ . 1 . 2]" 1
1389 1 93 TYR HA 1 93 TYR QD . . 3.460 2.675 2.023 3.096 . 0 0 "[ . 1 . 2]" 1
1390 1 93 TYR HA 1 93 TYR QE . . 4.780 4.458 4.214 4.612 . 0 0 "[ . 1 . 2]" 1
1391 1 93 TYR QB 1 97 GLY H . . 4.330 2.999 1.924 3.543 . 0 0 "[ . 1 . 2]" 1
1392 1 93 TYR QB 1 97 GLY QA . . 3.810 2.070 1.905 2.566 . 0 0 "[ . 1 . 2]" 1
1393 1 93 TYR QB 1 98 ALA MB . . 4.730 4.037 2.727 4.593 . 0 0 "[ . 1 . 2]" 1
1394 1 93 TYR QB 1 102 ILE MD . . 5.250 4.680 3.884 5.299 0.049 20 0 "[ . 1 . 2]" 1
1395 1 93 TYR QB 1 102 ILE MG . . 3.900 2.812 2.012 3.513 . 0 0 "[ . 1 . 2]" 1
1396 1 93 TYR QB 1 108 LEU QD . . 5.280 3.413 2.440 4.269 . 0 0 "[ . 1 . 2]" 1
1397 1 93 TYR HB2 1 98 ALA MB . . 5.500 4.832 3.513 5.502 0.002 6 0 "[ . 1 . 2]" 1
1398 1 93 TYR HB2 1 102 ILE MG . . 4.600 2.918 2.037 3.665 . 0 0 "[ . 1 . 2]" 1
1399 1 93 TYR HB3 1 98 ALA MB . . 5.500 4.350 2.841 5.110 . 0 0 "[ . 1 . 2]" 1
1400 1 93 TYR HB3 1 102 ILE MG . . 4.600 3.749 2.614 4.596 . 0 0 "[ . 1 . 2]" 1
1401 1 93 TYR QD 1 94 GLY H . . 5.170 4.473 4.125 4.794 . 0 0 "[ . 1 . 2]" 1
1402 1 93 TYR QD 1 98 ALA MB . . 3.930 3.340 1.976 3.934 0.004 19 0 "[ . 1 . 2]" 1
1403 1 93 TYR QD 1 102 ILE HB . . 4.560 3.829 2.621 4.478 . 0 0 "[ . 1 . 2]" 1
1404 1 93 TYR QD 1 102 ILE MD . . 3.950 3.498 2.970 3.952 0.002 10 0 "[ . 1 . 2]" 1
1405 1 93 TYR QD 1 102 ILE MG . . 3.390 2.342 1.901 3.411 0.021 15 0 "[ . 1 . 2]" 1
1406 1 93 TYR QD 1 108 LEU QD . . 3.260 2.399 1.873 3.268 0.008 3 0 "[ . 1 . 2]" 1
1407 1 93 TYR QE 1 97 GLY QA . . 5.340 5.035 4.518 5.417 0.077 20 0 "[ . 1 . 2]" 1
1408 1 93 TYR QE 1 98 ALA HA . . 5.500 4.967 3.682 5.505 0.005 12 0 "[ . 1 . 2]" 1
1409 1 93 TYR QE 1 98 ALA MB . . 3.600 3.107 1.913 3.603 0.003 19 0 "[ . 1 . 2]" 1
1410 1 93 TYR QE 1 102 ILE HA . . 5.500 5.479 5.291 5.529 0.029 18 0 "[ . 1 . 2]" 1
1411 1 93 TYR QE 1 102 ILE HB . . 4.740 4.278 3.179 4.742 0.002 3 0 "[ . 1 . 2]" 1
1412 1 93 TYR QE 1 102 ILE MD . . 3.260 2.516 2.036 2.896 . 0 0 "[ . 1 . 2]" 1
1413 1 93 TYR QE 1 102 ILE QG . . 3.950 2.567 1.985 3.956 0.006 15 0 "[ . 1 . 2]" 1
1414 1 93 TYR QE 1 102 ILE MG . . 4.690 3.244 2.438 4.442 . 0 0 "[ . 1 . 2]" 1
1415 1 93 TYR QE 1 108 LEU QB . . 5.340 4.245 3.465 5.294 . 0 0 "[ . 1 . 2]" 1
1416 1 93 TYR QE 1 108 LEU MD1 . . 4.290 3.086 2.139 4.287 . 0 0 "[ . 1 . 2]" 1
1417 1 93 TYR QE 1 108 LEU QD . . 3.350 2.459 2.060 3.163 . 0 0 "[ . 1 . 2]" 1
1418 1 93 TYR QE 1 108 LEU MD2 . . 4.290 3.222 2.065 4.295 0.005 10 0 "[ . 1 . 2]" 1
1419 1 93 TYR QE 1 108 LEU HG . . 5.500 4.202 1.999 5.503 0.003 19 0 "[ . 1 . 2]" 1
1420 1 93 TYR QE 1 110 PHE QE . . 4.880 3.750 3.142 4.728 . 0 0 "[ . 1 . 2]" 1
1421 1 94 GLY H 1 97 GLY H . . 5.500 4.489 3.906 4.990 . 0 0 "[ . 1 . 2]" 1
1422 1 94 GLY HA3 1 95 ALA MB . . 4.850 4.220 4.042 4.399 . 0 0 "[ . 1 . 2]" 1
1423 1 94 GLY HA3 1 96 ARG QB . . 4.280 4.191 3.898 4.291 0.011 19 0 "[ . 1 . 2]" 1
1424 1 95 ALA MB 1 96 ARG H . . 4.100 2.840 2.654 2.990 . 0 0 "[ . 1 . 2]" 1
1425 1 96 ARG H 1 96 ARG QB . . 3.300 2.228 2.080 2.550 . 0 0 "[ . 1 . 2]" 1
1426 1 96 ARG H 1 96 ARG HD2 . . 5.500 4.568 2.413 5.179 . 0 0 "[ . 1 . 2]" 1
1427 1 96 ARG H 1 96 ARG HD3 . . 5.500 4.768 4.033 5.295 . 0 0 "[ . 1 . 2]" 1
1428 1 96 ARG H 1 96 ARG HG2 . . 5.360 3.923 2.810 4.634 . 0 0 "[ . 1 . 2]" 1
1429 1 96 ARG H 1 96 ARG QG . . 4.620 3.248 2.147 4.051 . 0 0 "[ . 1 . 2]" 1
1430 1 96 ARG H 1 96 ARG HG3 . . 5.360 3.624 2.217 4.591 . 0 0 "[ . 1 . 2]" 1
1431 1 96 ARG H 1 97 GLY H . . 3.700 2.770 2.339 3.061 . 0 0 "[ . 1 . 2]" 1
1432 1 96 ARG H 1 97 GLY QA . . 5.160 4.434 4.245 4.627 . 0 0 "[ . 1 . 2]" 1
1433 1 96 ARG HA 1 96 ARG HG2 . . 3.760 2.728 2.206 3.709 . 0 0 "[ . 1 . 2]" 1
1434 1 96 ARG HA 1 96 ARG HG3 . . 3.760 2.948 2.241 3.673 . 0 0 "[ . 1 . 2]" 1
1435 1 96 ARG QB 1 97 GLY H . . 3.710 2.299 1.989 2.920 . 0 0 "[ . 1 . 2]" 1
1436 1 96 ARG QG 1 97 GLY H . . 4.610 3.951 3.229 4.617 0.007 18 0 "[ . 1 . 2]" 1
1437 1 96 ARG HG2 1 97 GLY H . . 5.430 4.454 3.312 5.365 . 0 0 "[ . 1 . 2]" 1
1438 1 96 ARG HG3 1 97 GLY H . . 5.430 4.534 3.742 5.036 . 0 0 "[ . 1 . 2]" 1
1439 1 97 GLY H 1 98 ALA H . . 4.810 4.353 4.183 4.542 . 0 0 "[ . 1 . 2]" 1
1440 1 97 GLY QA 1 98 ALA HA . . 4.840 3.984 3.947 4.028 . 0 0 "[ . 1 . 2]" 1
1441 1 97 GLY QA 1 98 ALA MB . . 4.390 3.759 3.728 3.796 . 0 0 "[ . 1 . 2]" 1
1442 1 97 GLY QA 1 102 ILE HB . . 4.620 3.534 2.893 4.507 . 0 0 "[ . 1 . 2]" 1
1443 1 97 GLY QA 1 102 ILE MG . . 3.700 2.817 2.100 3.491 . 0 0 "[ . 1 . 2]" 1
1444 1 97 GLY HA2 1 102 ILE HB . . 5.260 3.944 3.335 4.958 . 0 0 "[ . 1 . 2]" 1
1445 1 97 GLY HA2 1 102 ILE MG . . 4.240 3.143 2.618 3.969 . 0 0 "[ . 1 . 2]" 1
1446 1 97 GLY HA3 1 102 ILE HB . . 5.260 4.062 3.173 5.176 . 0 0 "[ . 1 . 2]" 1
1447 1 97 GLY HA3 1 102 ILE MG . . 4.240 3.337 2.169 4.236 . 0 0 "[ . 1 . 2]" 1
1448 1 98 ALA H 1 98 ALA MB . . 3.660 2.143 2.051 2.370 . 0 0 "[ . 1 . 2]" 1
1449 1 98 ALA HA 1 102 ILE HB . . 4.990 4.427 3.839 5.014 0.024 20 0 "[ . 1 . 2]" 1
1450 1 98 ALA MB 1 99 GLY HA2 . . 5.090 4.401 4.164 4.681 . 0 0 "[ . 1 . 2]" 1
1451 1 98 ALA MB 1 99 GLY HA3 . . 5.090 4.313 3.921 4.726 . 0 0 "[ . 1 . 2]" 1
1452 1 98 ALA MB 1 102 ILE H . . 4.600 3.291 1.843 4.576 . 0 0 "[ . 1 . 2]" 1
1453 1 98 ALA MB 1 102 ILE HB . . 3.720 2.345 1.930 3.287 . 0 0 "[ . 1 . 2]" 1
1454 1 98 ALA MB 1 102 ILE MD . . 3.820 3.319 2.148 3.829 0.009 16 0 "[ . 1 . 2]" 1
1455 1 98 ALA MB 1 102 ILE QG . . 5.110 2.564 1.821 3.986 . 0 0 "[ . 1 . 2]" 1
1456 1 98 ALA MB 1 102 ILE MG . . 4.260 3.434 2.859 3.846 . 0 0 "[ . 1 . 2]" 1
1457 1 101 VAL H 1 101 VAL HB . . 3.720 2.952 2.448 3.734 0.014 18 0 "[ . 1 . 2]" 1
1458 1 101 VAL H 1 101 VAL QG . . 3.420 2.262 1.943 2.706 . 0 0 "[ . 1 . 2]" 1
1459 1 101 VAL HA 1 101 VAL QG . . 3.100 2.130 2.065 2.287 . 0 0 "[ . 1 . 2]" 1
1460 1 101 VAL HB 1 102 ILE H . . 3.990 2.750 1.943 3.995 0.005 5 0 "[ . 1 . 2]" 1
1461 1 101 VAL HB 1 102 ILE MD . . 4.820 3.212 1.933 4.629 . 0 0 "[ . 1 . 2]" 1
1462 1 101 VAL HB 1 102 ILE QG . . 5.000 3.209 2.499 4.408 . 0 0 "[ . 1 . 2]" 1
1463 1 101 VAL QG 1 102 ILE H . . 3.330 2.956 1.892 3.356 0.026 19 0 "[ . 1 . 2]" 1
1464 1 102 ILE H 1 102 ILE HB . . 3.710 3.029 2.430 3.718 0.008 20 0 "[ . 1 . 2]" 1
1465 1 102 ILE H 1 102 ILE QG . . 4.230 2.810 2.382 3.730 . 0 0 "[ . 1 . 2]" 1
1466 1 102 ILE HA 1 102 ILE MD . . 4.050 2.362 1.971 3.486 . 0 0 "[ . 1 . 2]" 1
1467 1 102 ILE HA 1 102 ILE QG . . 3.590 2.788 2.037 3.068 . 0 0 "[ . 1 . 2]" 1
1468 1 102 ILE HA 1 102 ILE MG . . 3.560 2.325 2.197 2.623 . 0 0 "[ . 1 . 2]" 1
1469 1 102 ILE HA 1 103 PRO HB3 . . 5.300 5.108 4.834 5.261 . 0 0 "[ . 1 . 2]" 1
1470 1 102 ILE HA 1 103 PRO HD2 . . 3.760 2.059 1.977 2.134 . 0 0 "[ . 1 . 2]" 1
1471 1 102 ILE HA 1 103 PRO QD . . 3.290 1.981 1.905 2.040 . 0 0 "[ . 1 . 2]" 1
1472 1 102 ILE HA 1 103 PRO HD3 . . 3.760 2.683 2.254 2.922 . 0 0 "[ . 1 . 2]" 1
1473 1 102 ILE HB 1 102 ILE MD . . 3.750 2.956 2.010 3.230 . 0 0 "[ . 1 . 2]" 1
1474 1 102 ILE HB 1 103 PRO QD . . 5.350 4.225 3.836 4.386 . 0 0 "[ . 1 . 2]" 1
1475 1 102 ILE MD 1 102 ILE MG . . 3.310 2.286 1.935 3.193 . 0 0 "[ . 1 . 2]" 1
1476 1 102 ILE MD 1 103 PRO HD2 . . 5.120 3.723 2.668 5.091 . 0 0 "[ . 1 . 2]" 1
1477 1 102 ILE MD 1 103 PRO HD3 . . 5.120 4.327 3.415 5.154 0.034 1 0 "[ . 1 . 2]" 1
1478 1 102 ILE MD 1 108 LEU HA . . 5.500 4.904 4.212 5.604 0.104 10 0 "[ . 1 . 2]" 1
1479 1 102 ILE MD 1 108 LEU QD . . 3.990 2.185 1.678 3.488 . 0 0 "[ . 1 . 2]" 1
1480 1 102 ILE MD 1 110 PHE QE . . 5.500 4.633 4.289 5.077 . 0 0 "[ . 1 . 2]" 1
1481 1 102 ILE QG 1 103 PRO QD . . 5.070 4.038 2.808 4.348 . 0 0 "[ . 1 . 2]" 1
1482 1 102 ILE QG 1 108 LEU HG . . 5.340 4.696 2.801 5.350 0.010 19 0 "[ . 1 . 2]" 1
1483 1 102 ILE MG 1 103 PRO HD2 . . 4.700 3.035 1.903 3.658 . 0 0 "[ . 1 . 2]" 1
1484 1 102 ILE MG 1 103 PRO QD . . 3.820 2.946 1.891 3.514 . 0 0 "[ . 1 . 2]" 1
1485 1 102 ILE MG 1 103 PRO HD3 . . 4.700 4.118 3.281 4.540 . 0 0 "[ . 1 . 2]" 1
1486 1 102 ILE MG 1 106 ALA MB . . 3.570 3.374 2.188 3.652 0.082 20 0 "[ . 1 . 2]" 1
1487 1 103 PRO HA 1 104 PRO HD2 . . 3.820 2.536 2.519 2.572 . 0 0 "[ . 1 . 2]" 1
1488 1 103 PRO HA 1 104 PRO QD . . 3.270 2.176 2.165 2.199 . 0 0 "[ . 1 . 2]" 1
1489 1 103 PRO HA 1 104 PRO HD3 . . 3.820 2.368 2.359 2.388 . 0 0 "[ . 1 . 2]" 1
1490 1 103 PRO HA 1 104 PRO HG2 . . 4.740 4.628 4.614 4.657 . 0 0 "[ . 1 . 2]" 1
1491 1 103 PRO HA 1 104 PRO QG . . 4.160 4.094 4.083 4.118 . 0 0 "[ . 1 . 2]" 1
1492 1 103 PRO HA 1 104 PRO HG3 . . 4.740 4.564 4.553 4.589 . 0 0 "[ . 1 . 2]" 1
1493 1 103 PRO HB2 1 104 PRO QD . . 3.660 2.061 1.983 2.097 . 0 0 "[ . 1 . 2]" 1
1494 1 103 PRO HB2 1 106 ALA HA . . 5.500 5.516 5.415 5.614 0.114 10 0 "[ . 1 . 2]" 1
1495 1 103 PRO HB2 1 106 ALA MB . . 3.990 3.092 2.856 3.328 . 0 0 "[ . 1 . 2]" 1
1496 1 103 PRO HB3 1 104 PRO HD2 . . 4.050 2.723 2.687 2.741 . 0 0 "[ . 1 . 2]" 1
1497 1 103 PRO HB3 1 104 PRO QD . . 3.350 2.664 2.628 2.681 . 0 0 "[ . 1 . 2]" 1
1498 1 103 PRO HB3 1 104 PRO HD3 . . 4.050 3.771 3.726 3.793 . 0 0 "[ . 1 . 2]" 1
1499 1 103 PRO HB3 1 106 ALA MB . . 4.610 4.126 3.805 4.277 . 0 0 "[ . 1 . 2]" 1
1500 1 103 PRO QD 1 106 ALA MB . . 3.880 2.846 2.544 3.239 . 0 0 "[ . 1 . 2]" 1
1501 1 103 PRO HD2 1 106 ALA MB . . 4.560 2.919 2.582 3.384 . 0 0 "[ . 1 . 2]" 1
1502 1 103 PRO HD3 1 106 ALA MB . . 4.560 4.016 3.832 4.147 . 0 0 "[ . 1 . 2]" 1
1503 1 104 PRO HB2 1 105 ASN QB . . 4.600 3.747 3.252 4.119 . 0 0 "[ . 1 . 2]" 1
1504 1 104 PRO HB2 1 105 ASN QD . . 5.340 3.831 2.068 5.337 . 0 0 "[ . 1 . 2]" 1
1505 1 104 PRO HB3 1 105 ASN H . . 4.460 3.789 3.561 3.989 . 0 0 "[ . 1 . 2]" 1
1506 1 104 PRO QD 1 106 ALA MB . . 5.020 4.327 4.241 4.468 . 0 0 "[ . 1 . 2]" 1
1507 1 104 PRO QG 1 105 ASN H . . 5.030 3.844 1.931 4.653 . 0 0 "[ . 1 . 2]" 1
1508 1 104 PRO QG 1 105 ASN QB . . 5.180 3.960 3.155 4.600 . 0 0 "[ . 1 . 2]" 1
1509 1 105 ASN H 1 106 ALA H . . 4.160 3.103 2.606 4.148 . 0 0 "[ . 1 . 2]" 1
1510 1 106 ALA H 1 106 ALA MB . . 3.320 2.541 2.330 2.916 . 0 0 "[ . 1 . 2]" 1
1511 1 106 ALA HA 1 107 THR H . . 2.960 2.235 2.147 2.386 . 0 0 "[ . 1 . 2]" 1
1512 1 106 ALA HA 1 107 THR HB . . 5.500 4.655 4.586 4.744 . 0 0 "[ . 1 . 2]" 1
1513 1 107 THR H 1 107 THR HB . . 3.290 2.476 2.451 2.530 . 0 0 "[ . 1 . 2]" 1
1514 1 107 THR H 1 107 THR MG . . 4.090 3.779 3.768 3.807 . 0 0 "[ . 1 . 2]" 1
1515 1 107 THR HA 1 108 LEU H . . 3.460 2.150 2.146 2.156 . 0 0 "[ . 1 . 2]" 1
1516 1 107 THR MG 1 108 LEU H . . 3.790 2.506 2.391 2.642 . 0 0 "[ . 1 . 2]" 1
1517 1 108 LEU H 1 108 LEU QD . . 4.290 2.621 1.941 3.613 . 0 0 "[ . 1 . 2]" 1
1518 1 108 LEU H 1 108 LEU HG . . 4.510 3.360 2.126 4.325 . 0 0 "[ . 1 . 2]" 1
1519 1 108 LEU HA 1 108 LEU MD1 . . 3.990 3.129 1.952 3.929 . 0 0 "[ . 1 . 2]" 1
1520 1 108 LEU HA 1 108 LEU QD . . 3.320 2.371 1.903 3.164 . 0 0 "[ . 1 . 2]" 1
1521 1 108 LEU HA 1 108 LEU MD2 . . 3.990 2.741 2.032 3.566 . 0 0 "[ . 1 . 2]" 1
1522 1 108 LEU HA 1 108 LEU HG . . 4.250 3.156 2.467 3.699 . 0 0 "[ . 1 . 2]" 1
1523 1 108 LEU HA 1 109 VAL H . . 3.180 2.153 2.142 2.168 . 0 0 "[ . 1 . 2]" 1
1524 1 108 LEU HA 1 109 VAL QG . . 4.370 3.644 3.534 3.710 . 0 0 "[ . 1 . 2]" 1
1525 1 108 LEU QB 1 109 VAL H . . 4.400 3.184 3.097 3.264 . 0 0 "[ . 1 . 2]" 1
1526 1 108 LEU QB 1 110 PHE QD . . 3.700 2.794 2.564 3.031 . 0 0 "[ . 1 . 2]" 1
1527 1 108 LEU HB2 1 110 PHE QD . . 4.250 3.346 2.668 3.826 . 0 0 "[ . 1 . 2]" 1
1528 1 108 LEU HB2 1 110 PHE QE . . 4.430 2.609 2.299 3.042 . 0 0 "[ . 1 . 2]" 1
1529 1 108 LEU HB3 1 110 PHE QD . . 4.250 3.086 2.672 3.445 . 0 0 "[ . 1 . 2]" 1
1530 1 108 LEU HB3 1 110 PHE QE . . 4.430 2.048 1.989 2.254 . 0 0 "[ . 1 . 2]" 1
1531 1 108 LEU HG 1 110 PHE QE . . 5.500 3.689 2.615 4.322 . 0 0 "[ . 1 . 2]" 1
1532 1 109 VAL H 1 109 VAL HB . . 3.760 2.510 2.479 2.537 . 0 0 "[ . 1 . 2]" 1
1533 1 109 VAL H 1 109 VAL QG . . 3.450 2.583 2.482 2.691 . 0 0 "[ . 1 . 2]" 1
1534 1 109 VAL H 1 110 PHE QD . . 4.840 4.557 4.323 4.856 0.016 8 0 "[ . 1 . 2]" 1
1535 1 109 VAL HA 1 109 VAL QG . . 3.100 2.087 2.043 2.115 . 0 0 "[ . 1 . 2]" 1
1536 1 109 VAL HA 1 110 PHE H . . 3.200 2.147 2.144 2.155 . 0 0 "[ . 1 . 2]" 1
1537 1 109 VAL HA 1 110 PHE HA . . 5.500 4.394 4.393 4.395 . 0 0 "[ . 1 . 2]" 1
1538 1 109 VAL HB 1 110 PHE H . . 4.480 4.367 4.347 4.383 . 0 0 "[ . 1 . 2]" 1
1539 1 109 VAL HB 1 110 PHE HA . . 5.240 4.856 4.822 4.877 . 0 0 "[ . 1 . 2]" 1
1540 1 109 VAL QG 1 110 PHE H . . 3.670 2.756 2.718 2.834 . 0 0 "[ . 1 . 2]" 1
1541 1 109 VAL QG 1 110 PHE HA . . 4.640 3.701 3.675 3.754 . 0 0 "[ . 1 . 2]" 1
1542 1 109 VAL QG 1 110 PHE QD . . 4.750 4.631 4.555 4.729 . 0 0 "[ . 1 . 2]" 1
1543 1 110 PHE H 1 110 PHE HB2 . . 4.060 2.478 2.455 2.514 . 0 0 "[ . 1 . 2]" 1
1544 1 110 PHE H 1 110 PHE QD . . 4.230 3.092 3.002 3.233 . 0 0 "[ . 1 . 2]" 1
1545 1 110 PHE HA 1 110 PHE QD . . 4.030 2.836 2.649 2.957 . 0 0 "[ . 1 . 2]" 1
1546 1 110 PHE HA 1 111 GLU H . . 3.330 2.170 2.168 2.171 . 0 0 "[ . 1 . 2]" 1
1547 1 110 PHE HA 1 112 VAL QG . . 5.440 4.912 4.746 5.075 . 0 0 "[ . 1 . 2]" 1
1548 1 110 PHE HB2 1 112 VAL QG . . 4.460 4.040 3.914 4.174 . 0 0 "[ . 1 . 2]" 1
1549 1 110 PHE HB3 1 111 GLU H . . 4.240 3.199 3.184 3.214 . 0 0 "[ . 1 . 2]" 1
1550 1 110 PHE HB3 1 112 VAL QG . . 4.090 3.361 3.153 3.530 . 0 0 "[ . 1 . 2]" 1
1551 1 110 PHE QD 1 111 GLU H . . 4.220 3.730 3.635 3.800 . 0 0 "[ . 1 . 2]" 1
1552 1 111 GLU HA 1 112 VAL H . . 3.090 2.152 2.140 2.189 . 0 0 "[ . 1 . 2]" 1
1553 1 111 GLU HA 1 112 VAL HB . . 5.120 4.697 4.605 4.847 . 0 0 "[ . 1 . 2]" 1
1554 1 111 GLU HA 1 112 VAL QG . . 4.440 3.550 3.435 3.669 . 0 0 "[ . 1 . 2]" 1
1555 1 111 GLU QB 1 112 VAL H . . 4.260 3.731 3.643 3.813 . 0 0 "[ . 1 . 2]" 1
1556 1 111 GLU HB2 1 112 VAL H . . 4.920 4.287 4.049 4.447 . 0 0 "[ . 1 . 2]" 1
1557 1 111 GLU HB3 1 112 VAL H . . 4.920 4.121 3.944 4.350 . 0 0 "[ . 1 . 2]" 1
1558 1 111 GLU QG 1 112 VAL H . . 3.810 2.783 2.364 3.464 . 0 0 "[ . 1 . 2]" 1
1559 1 112 VAL H 1 112 VAL HB . . 3.590 2.706 2.589 2.820 . 0 0 "[ . 1 . 2]" 1
1560 1 112 VAL H 1 112 VAL QG . . 3.730 2.632 2.455 2.790 . 0 0 "[ . 1 . 2]" 1
1561 1 112 VAL HB 1 113 GLU H . . 4.890 4.129 3.974 4.263 . 0 0 "[ . 1 . 2]" 1
1562 1 112 VAL QG 1 113 GLU H . . 3.630 2.574 2.341 2.802 . 0 0 "[ . 1 . 2]" 1
1563 1 112 VAL QG 1 113 GLU HA . . 5.200 3.619 3.505 3.798 . 0 0 "[ . 1 . 2]" 1
1564 1 112 VAL QG 1 113 GLU QB . . 5.280 4.347 4.119 4.530 . 0 0 "[ . 1 . 2]" 1
1565 1 112 VAL QG 1 114 LEU H . . 4.900 3.742 3.344 4.224 . 0 0 "[ . 1 . 2]" 1
1566 1 112 VAL QG 1 114 LEU HA . . 5.140 4.065 3.831 4.309 . 0 0 "[ . 1 . 2]" 1
1567 1 112 VAL MG1 1 113 GLU H . . 4.590 2.602 2.353 2.853 . 0 0 "[ . 1 . 2]" 1
1568 1 112 VAL MG2 1 113 GLU H . . 4.590 4.110 4.003 4.193 . 0 0 "[ . 1 . 2]" 1
1569 1 113 GLU H 1 113 GLU QB . . 3.640 2.897 2.466 3.169 . 0 0 "[ . 1 . 2]" 1
1570 1 113 GLU H 1 113 GLU QG . . 3.900 2.745 1.953 3.953 0.053 8 0 "[ . 1 . 2]" 1
1571 1 113 GLU HA 1 114 LEU H . . 3.140 2.153 2.139 2.177 . 0 0 "[ . 1 . 2]" 1
1572 1 113 GLU HA 1 114 LEU QB . . 4.980 4.069 3.994 4.154 . 0 0 "[ . 1 . 2]" 1
1573 1 113 GLU QG 1 114 LEU H . . 4.480 4.034 2.967 4.564 0.084 15 0 "[ . 1 . 2]" 1
1574 1 114 LEU H 1 114 LEU QB . . 3.400 2.104 2.029 2.165 . 0 0 "[ . 1 . 2]" 1
1575 1 114 LEU H 1 114 LEU MD1 . . 5.110 3.964 2.825 4.206 . 0 0 "[ . 1 . 2]" 1
1576 1 114 LEU H 1 114 LEU QD . . 4.240 2.842 2.171 3.717 . 0 0 "[ . 1 . 2]" 1
1577 1 114 LEU H 1 114 LEU MD2 . . 5.110 3.154 2.179 4.439 . 0 0 "[ . 1 . 2]" 1
1578 1 114 LEU HA 1 115 LEU H . . 3.380 2.153 2.141 2.178 . 0 0 "[ . 1 . 2]" 1
1579 1 114 LEU HA 1 115 LEU HG . . 5.470 4.302 3.900 4.833 . 0 0 "[ . 1 . 2]" 1
1580 1 114 LEU QD 1 115 LEU H . . 3.790 2.693 1.902 3.806 0.016 20 0 "[ . 1 . 2]" 1
1581 1 114 LEU QD 1 116 ASP H . . 4.240 2.947 1.935 4.243 0.003 20 0 "[ . 1 . 2]" 1
1582 1 114 LEU MD1 1 115 LEU H . . 4.770 3.056 1.908 4.782 0.012 15 0 "[ . 1 . 2]" 1
1583 1 114 LEU MD2 1 115 LEU H . . 4.770 3.712 2.366 4.265 . 0 0 "[ . 1 . 2]" 1
1584 1 115 LEU H 1 115 LEU QB . . 3.650 2.391 2.316 2.514 . 0 0 "[ . 1 . 2]" 1
1585 1 115 LEU H 1 115 LEU MD1 . . 4.910 3.236 2.631 3.552 . 0 0 "[ . 1 . 2]" 1
1586 1 115 LEU H 1 115 LEU HG . . 3.760 3.204 2.810 3.619 . 0 0 "[ . 1 . 2]" 1
1587 1 115 LEU H 1 116 ASP H . . 3.430 2.135 2.013 2.404 . 0 0 "[ . 1 . 2]" 1
1588 1 115 LEU HA 1 115 LEU MD1 . . 4.100 3.784 3.496 3.920 . 0 0 "[ . 1 . 2]" 1
1589 1 115 LEU HA 1 115 LEU MD2 . . 3.400 2.758 2.301 3.272 . 0 0 "[ . 1 . 2]" 1
1590 1 115 LEU QB 1 116 ASP H . . 3.460 2.570 2.280 2.765 . 0 0 "[ . 1 . 2]" 1
1591 1 115 LEU QB 1 116 ASP QB . . 4.460 3.215 3.147 3.374 . 0 0 "[ . 1 . 2]" 1
1592 1 115 LEU MD1 1 116 ASP H . . 4.310 4.098 3.765 4.306 . 0 0 "[ . 1 . 2]" 1
1593 1 116 ASP H 1 116 ASP QB . . 3.620 2.892 2.791 2.971 . 0 0 "[ . 1 . 2]" 1
1594 1 116 ASP H 1 117 VAL QG . . 4.810 4.474 3.436 4.871 0.061 5 0 "[ . 1 . 2]" 1
1595 1 116 ASP HA 1 117 VAL H . . 2.860 2.381 2.211 2.476 . 0 0 "[ . 1 . 2]" 1
1596 1 116 ASP HA 1 117 VAL HB . . 5.500 4.790 4.373 5.626 0.126 17 0 "[ . 1 . 2]" 1
1597 1 116 ASP HA 1 117 VAL QG . . 3.890 3.407 3.043 3.684 . 0 0 "[ . 1 . 2]" 1
1598 1 116 ASP QB 1 117 VAL H . . 3.640 3.110 2.330 3.569 . 0 0 "[ . 1 . 2]" 1
1599 1 117 VAL H 1 117 VAL HB . . 4.160 2.971 2.497 3.947 . 0 0 "[ . 1 . 2]" 1
1600 1 117 VAL H 1 117 VAL QG . . 3.210 2.357 2.013 2.701 . 0 0 "[ . 1 . 2]" 1
1601 1 117 VAL HA 1 117 VAL QG . . 3.210 2.176 2.056 2.352 . 0 0 "[ . 1 . 2]" 1
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