NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
483413 |
1xfn   |
6321 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1xfn
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 1384
_Distance_constraint_stats_list.Viol_count 1597
_Distance_constraint_stats_list.Viol_total 3689.557
_Distance_constraint_stats_list.Viol_max 0.943
_Distance_constraint_stats_list.Viol_rms 0.0436
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0067
_Distance_constraint_stats_list.Viol_average_violations_only 0.1155
_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 14 LEU 9.255 0.799 18 3 "[ . - * . + 2]"
1 15 ALA 1.046 0.244 3 0 "[ . 1 . 2]"
1 16 PHE 0.860 0.244 3 0 "[ . 1 . 2]"
1 17 GLY 0.660 0.184 6 0 "[ . 1 . 2]"
1 18 ALA 0.586 0.126 19 0 "[ . 1 . 2]"
1 19 ILE 2.966 0.183 11 0 "[ . 1 . 2]"
1 20 GLN 6.602 0.879 19 2 "[ . 1 -. +2]"
1 21 LEU 23.624 0.943 1 9 "[+** . *1 ** .* - *]"
1 22 ASP 5.065 0.615 12 2 "[ . 1 + .- 2]"
1 23 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 ASP 1.511 0.538 2 2 "[-+ . 1 . 2]"
1 25 GLY 7.155 0.943 1 7 "[+*- . *1 * .* *]"
1 26 ASN 6.340 0.682 1 9 "[+** . *1 ** .* - *]"
1 27 ILE 3.925 0.309 20 0 "[ . 1 . 2]"
1 28 LEU 6.986 0.879 19 1 "[ . 1 . +2]"
1 29 GLN 1.308 0.184 17 0 "[ . 1 . 2]"
1 30 TYR 5.164 0.344 13 0 "[ . 1 . 2]"
1 31 ASN 3.991 0.563 5 1 "[ + 1 . 2]"
1 32 ALA 2.559 0.563 5 1 "[ + 1 . 2]"
1 33 ALA 0.846 0.114 18 0 "[ . 1 . 2]"
1 34 GLU 0.808 0.447 18 0 "[ . 1 . 2]"
1 35 GLY 2.219 0.344 13 0 "[ . 1 . 2]"
1 36 ASP 0.461 0.122 15 0 "[ . 1 . 2]"
1 37 ILE 3.169 0.286 17 0 "[ . 1 . 2]"
1 38 THR 2.413 0.216 3 0 "[ . 1 . 2]"
1 39 GLY 0.940 0.245 19 0 "[ . 1 . 2]"
1 40 ARG 0.914 0.245 19 0 "[ . 1 . 2]"
1 41 ASP 3.569 0.804 10 2 "[ . + .- 2]"
1 42 PRO 0.248 0.081 5 0 "[ . 1 . 2]"
1 43 LYS 3.443 0.555 19 1 "[ . 1 . +2]"
1 44 GLN 4.569 0.804 10 3 "[ . + .* -2]"
1 45 VAL 1.863 0.206 12 0 "[ . 1 . 2]"
1 46 ILE 4.507 0.555 19 1 "[ . 1 . +2]"
1 47 GLY 0.152 0.071 10 0 "[ . 1 . 2]"
1 48 LYS 6.390 0.457 4 0 "[ . 1 . 2]"
1 49 ASN 2.766 0.538 2 2 "[-+ . 1 . 2]"
1 50 PHE 1.637 0.140 18 0 "[ . 1 . 2]"
1 51 PHE 0.180 0.132 9 0 "[ . 1 . 2]"
1 52 LYS 4.815 0.506 4 1 "[ +. 1 . 2]"
1 53 ASP 0.872 0.113 8 0 "[ . 1 . 2]"
1 54 VAL 3.985 0.506 4 1 "[ +. 1 . 2]"
1 55 ALA 1.419 0.257 9 0 "[ . 1 . 2]"
1 56 PRO 2.438 0.264 9 0 "[ . 1 . 2]"
1 57 CYS 1.722 0.260 11 0 "[ . 1 . 2]"
1 58 THR 0.459 0.138 5 0 "[ . 1 . 2]"
1 59 ASP 11.216 0.801 9 8 "[ * * * +1 -* . * *]"
1 60 SER 5.708 0.801 9 3 "[ - * +1 . 2]"
1 61 PRO 0.945 0.796 12 1 "[ . 1 + . 2]"
1 62 GLU 2.770 0.796 12 1 "[ . 1 + . 2]"
1 63 PHE 5.892 0.749 13 5 "[ * . 1 -+ . * *]"
1 64 TYR 0.351 0.111 2 0 "[ . 1 . 2]"
1 65 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 LYS 2.431 0.248 11 0 "[ . 1 . 2]"
1 67 PHE 4.269 0.224 19 0 "[ . 1 . 2]"
1 68 LYS 6.401 0.287 11 0 "[ . 1 . 2]"
1 69 GLU 2.301 0.248 11 0 "[ . 1 . 2]"
1 70 GLY 1.114 0.243 9 0 "[ . 1 . 2]"
1 71 VAL 3.240 0.300 14 0 "[ . 1 . 2]"
1 72 ALA 0.244 0.062 19 0 "[ . 1 . 2]"
1 73 SER 4.425 0.901 16 2 "[ .- 1 .+ 2]"
1 74 GLY 0.561 0.106 6 0 "[ . 1 . 2]"
1 75 ASN 3.497 0.901 16 2 "[ .- 1 .+ 2]"
1 76 LEU 2.577 0.243 9 0 "[ . 1 . 2]"
1 77 ASN 4.024 0.257 7 0 "[ . 1 . 2]"
1 78 THR 0.735 0.118 20 0 "[ . 1 . 2]"
1 79 MET 4.004 0.257 7 0 "[ . 1 . 2]"
1 80 PHE 7.342 0.622 14 6 "[ * . * 1 +.* -*]"
1 81 GLU 6.329 0.752 14 7 "[* * . * 1 +.* -*]"
1 82 TYR 3.561 0.588 16 1 "[ . 1 .+ 2]"
1 83 THR 0.129 0.058 20 0 "[ . 1 . 2]"
1 84 PHE 0.724 0.216 9 0 "[ . 1 . 2]"
1 85 ASP 0.096 0.058 20 0 "[ . 1 . 2]"
1 86 TYR 1.028 0.410 12 0 "[ . 1 . 2]"
1 87 GLN 2.566 0.410 12 0 "[ . 1 . 2]"
1 88 MET 3.665 0.263 11 0 "[ . 1 . 2]"
1 89 THR 0.093 0.043 2 0 "[ . 1 . 2]"
1 90 PRO 1.509 0.113 11 0 "[ . 1 . 2]"
1 91 THR 3.096 0.263 11 0 "[ . 1 . 2]"
1 92 LYS 0.017 0.010 8 0 "[ . 1 . 2]"
1 93 VAL 2.559 0.607 8 1 "[ . + 1 . 2]"
1 94 LYS 6.472 0.512 11 2 "[ . 1+ - 2]"
1 95 VAL 13.800 0.752 14 6 "[* . * 1- +.* *2]"
1 96 HIS 2.298 0.507 6 1 "[ .+ 1 . 2]"
1 97 MET 7.155 0.284 17 0 "[ . 1 . 2]"
1 98 LYS 5.841 0.410 12 0 "[ . 1 . 2]"
1 99 LYS 4.070 0.177 16 0 "[ . 1 . 2]"
1 100 ALA 4.015 0.923 14 3 "[ -. 1 *+. 2]"
1 101 LEU 8.335 0.923 14 5 "[ *. * 1 *+. - 2]"
1 102 SER 2.416 0.879 19 1 "[ . 1 . +2]"
1 103 GLY 1.023 0.824 13 1 "[ . 1 + . 2]"
1 104 ASP 2.869 0.923 14 2 "[ -. 1 +. 2]"
1 105 SER 9.300 0.802 7 3 "[ . + 1 -. * 2]"
1 106 TYR 12.979 0.300 5 0 "[ . 1 . 2]"
1 107 TRP 2.110 0.300 14 0 "[ . 1 . 2]"
1 108 VAL 11.135 0.507 6 1 "[ .+ 1 . 2]"
1 109 PHE 0.793 0.410 12 0 "[ . 1 . 2]"
1 110 VAL 2.191 0.263 20 0 "[ . 1 . 2]"
1 111 LYS 3.236 0.627 8 3 "[ . +-1 * . 2]"
1 112 ARG 4.004 0.627 8 3 "[ . +-1 * . 2]"
1 113 VAL 1.497 0.508 15 1 "[ . 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 14 LEU HB2 1 14 LEU HG 1.500 . 2.200 2.359 2.172 2.695 0.495 20 0 "[ . 1 . 2]" 1
2 1 14 LEU HB2 1 15 ALA H 3.800 . 5.700 3.444 2.347 4.330 . 0 0 "[ . 1 . 2]" 1
3 1 14 LEU HB3 1 14 LEU HG 1.500 . 2.200 2.477 2.319 2.999 0.799 18 3 "[ . - * . + 2]" 1
4 1 14 LEU HB3 1 15 ALA H 2.900 . 4.000 2.587 1.750 3.903 0.050 13 0 "[ . 1 . 2]" 1
5 1 14 LEU HG 1 15 ALA H 3.400 . 4.800 4.243 2.736 4.855 0.055 19 0 "[ . 1 . 2]" 1
6 1 14 LEU HG 1 16 PHE H 4.200 . 6.000 5.502 2.681 6.130 0.130 16 0 "[ . 1 . 2]" 1
7 1 14 LEU HG 1 16 PHE H 3.200 . 6.000 5.199 2.680 6.002 0.002 16 0 "[ . 1 . 2]" 1
8 1 15 ALA H 1 15 ALA HA 2.600 . 3.400 2.867 2.262 2.952 . 0 0 "[ . 1 . 2]" 1
9 1 15 ALA H 1 15 ALA MB 2.500 . 3.300 2.543 2.232 2.967 . 0 0 "[ . 1 . 2]" 1
10 1 15 ALA H 1 16 PHE H 2.800 . 3.800 2.905 1.846 4.044 0.244 3 0 "[ . 1 . 2]" 1
11 1 15 ALA H 1 16 PHE QD 4.300 . 6.000 4.925 3.803 6.003 0.003 3 0 "[ . 1 . 2]" 1
12 1 15 ALA H 1 33 ALA H 5.100 . 6.000 5.702 4.762 6.114 0.114 18 0 "[ . 1 . 2]" 1
13 1 15 ALA HA 1 16 PHE H 2.800 . 3.800 3.173 2.060 3.587 . 0 0 "[ . 1 . 2]" 1
14 1 15 ALA MB 1 16 PHE H 2.900 . 4.000 2.564 1.765 3.716 0.035 17 0 "[ . 1 . 2]" 1
15 1 15 ALA MB 1 16 PHE QD 2.900 . 6.000 2.871 2.216 5.003 . 0 0 "[ . 1 . 2]" 1
16 1 16 PHE H 1 16 PHE HA 2.800 . 3.800 2.725 2.256 2.943 . 0 0 "[ . 1 . 2]" 1
17 1 16 PHE H 1 16 PHE QB . . 4.800 2.939 2.298 3.403 . 0 0 "[ . 1 . 2]" 1
18 1 16 PHE H 1 17 GLY H 4.900 . 6.000 4.453 4.099 4.674 . 0 0 "[ . 1 . 2]" 1
19 1 16 PHE HA 1 16 PHE QD 5.100 . 6.000 3.250 2.453 3.754 . 0 0 "[ . 1 . 2]" 1
20 1 16 PHE HA 1 17 GLY H 2.500 . 3.300 2.410 2.166 2.971 . 0 0 "[ . 1 . 2]" 1
21 1 16 PHE QB 1 16 PHE QD 2.600 . 3.300 2.125 2.120 2.131 . 0 0 "[ . 1 . 2]" 1
22 1 16 PHE QB 1 17 GLY H . . 4.700 2.513 1.792 3.346 0.108 5 0 "[ . 1 . 2]" 1
23 1 16 PHE QB 1 110 VAL H 6.000 . 6.000 4.640 3.867 5.790 . 0 0 "[ . 1 . 2]" 1
24 1 16 PHE QD 1 17 GLY H 4.100 . 6.000 3.443 2.413 4.197 . 0 0 "[ . 1 . 2]" 1
25 1 16 PHE QD 1 110 VAL QG 3.400 . 6.000 3.583 2.704 4.016 . 0 0 "[ . 1 . 2]" 1
26 1 17 GLY H 1 17 GLY HA3 3.000 . 4.100 2.395 2.376 2.405 . 0 0 "[ . 1 . 2]" 1
27 1 17 GLY H 1 18 ALA H 4.800 . 6.000 4.381 4.161 4.537 . 0 0 "[ . 1 . 2]" 1
28 1 17 GLY H 1 18 ALA MB 4.400 . 6.000 4.777 4.110 5.187 . 0 0 "[ . 1 . 2]" 1
29 1 17 GLY H 1 33 ALA MB 3.900 . 5.800 3.982 3.336 4.894 . 0 0 "[ . 1 . 2]" 1
30 1 17 GLY H 1 110 VAL H 3.300 . 4.700 3.594 3.008 4.160 . 0 0 "[ . 1 . 2]" 1
31 1 17 GLY H 1 110 VAL HB 3.600 . 5.200 4.014 2.441 5.219 0.019 3 0 "[ . 1 . 2]" 1
32 1 17 GLY HA2 1 18 ALA H 2.400 . 3.100 2.154 2.089 2.295 . 0 0 "[ . 1 . 2]" 1
33 1 17 GLY HA2 1 31 ASN HD21 5.500 . 6.000 3.804 2.602 5.895 . 0 0 "[ . 1 . 2]" 1
34 1 17 GLY HA2 1 31 ASN HD22 5.100 . 6.000 4.751 2.123 6.071 0.071 11 0 "[ . 1 . 2]" 1
35 1 17 GLY HA2 1 33 ALA H 3.800 . 5.600 4.216 3.545 5.238 . 0 0 "[ . 1 . 2]" 1
36 1 17 GLY HA2 1 111 LYS HB3 4.400 . 6.000 5.196 4.509 6.184 0.184 6 0 "[ . 1 . 2]" 1
37 1 17 GLY HA3 1 18 ALA H 3.200 . 4.500 3.175 2.783 3.376 . 0 0 "[ . 1 . 2]" 1
38 1 17 GLY HA3 1 34 GLU H 3.800 . 5.600 4.706 3.896 5.631 0.031 16 0 "[ . 1 . 2]" 1
39 1 18 ALA H 1 18 ALA MB 2.600 . 3.400 2.484 2.351 2.789 . 0 0 "[ . 1 . 2]" 1
40 1 18 ALA H 1 30 TYR QB 4.000 . 6.000 5.013 4.312 5.664 . 0 0 "[ . 1 . 2]" 1
41 1 18 ALA H 1 31 ASN H 3.500 . 5.000 3.780 2.701 5.036 0.036 14 0 "[ . 1 . 2]" 1
42 1 18 ALA H 1 31 ASN HB2 3.600 . 5.200 2.621 1.934 4.319 0.066 1 0 "[ . 1 . 2]" 1
43 1 18 ALA H 1 31 ASN HD22 3.700 . 5.400 4.393 2.308 5.288 . 0 0 "[ . 1 . 2]" 1
44 1 18 ALA H 1 33 ALA MB 5.800 . 6.000 3.633 2.508 4.633 . 0 0 "[ . 1 . 2]" 1
45 1 18 ALA H 1 34 GLU H 3.900 . 5.800 4.762 3.930 5.811 0.011 3 0 "[ . 1 . 2]" 1
46 1 18 ALA H 1 107 TRP HZ3 5.800 . 6.000 5.793 5.249 6.034 0.034 20 0 "[ . 1 . 2]" 1
47 1 18 ALA H 1 110 VAL H 3.900 . 5.800 4.825 4.285 5.247 . 0 0 "[ . 1 . 2]" 1
48 1 18 ALA HA 1 19 ILE H 2.100 . 2.700 2.150 2.116 2.174 . 0 0 "[ . 1 . 2]" 1
49 1 18 ALA HA 1 108 VAL H 3.900 . 5.800 5.210 4.881 5.579 . 0 0 "[ . 1 . 2]" 1
50 1 18 ALA HA 1 109 PHE QD 2.500 . 3.300 2.700 1.691 3.335 0.035 16 0 "[ . 1 . 2]" 1
51 1 18 ALA HA 1 110 VAL H 3.800 . 5.600 3.511 3.054 3.911 . 0 0 "[ . 1 . 2]" 1
52 1 18 ALA MB 1 19 ILE H 3.300 . 4.700 3.299 2.933 3.432 . 0 0 "[ . 1 . 2]" 1
53 1 18 ALA MB 1 31 ASN H 3.700 . 5.400 4.063 3.212 4.689 . 0 0 "[ . 1 . 2]" 1
54 1 18 ALA MB 1 31 ASN H 5.800 . 6.000 4.202 3.247 5.051 . 0 0 "[ . 1 . 2]" 1
55 1 18 ALA MB 1 31 ASN HD21 5.000 . 6.000 3.132 1.774 4.499 0.126 19 0 "[ . 1 . 2]" 1
56 1 18 ALA MB 1 31 ASN HD22 5.400 . 6.000 3.779 2.686 5.073 . 0 0 "[ . 1 . 2]" 1
57 1 18 ALA MB 1 109 PHE HA 6.000 . 6.000 3.738 3.083 4.151 . 0 0 "[ . 1 . 2]" 1
58 1 18 ALA MB 1 109 PHE QD 2.300 . 6.000 2.313 1.890 2.614 . 0 0 "[ . 1 . 2]" 1
59 1 18 ALA MB 1 110 VAL H 3.600 . 6.000 4.624 4.076 5.051 . 0 0 "[ . 1 . 2]" 1
60 1 19 ILE H 1 19 ILE HB 2.900 . 3.900 2.689 2.450 3.621 . 0 0 "[ . 1 . 2]" 1
61 1 19 ILE H 1 19 ILE MD 4.300 . 6.000 3.583 2.449 3.879 . 0 0 "[ . 1 . 2]" 1
62 1 19 ILE H 1 19 ILE HG13 3.400 . 4.900 2.676 2.211 3.690 . 0 0 "[ . 1 . 2]" 1
63 1 19 ILE H 1 19 ILE MG 3.500 . 5.100 3.681 2.999 3.818 . 0 0 "[ . 1 . 2]" 1
64 1 19 ILE H 1 20 GLN H 3.900 . 5.800 4.460 4.243 4.538 . 0 0 "[ . 1 . 2]" 1
65 1 19 ILE H 1 30 TYR QD 6.000 . 6.000 5.998 5.646 6.098 0.098 11 0 "[ . 1 . 2]" 1
66 1 19 ILE H 1 97 MET H 3.400 . 6.000 6.069 6.024 6.156 0.156 8 0 "[ . 1 . 2]" 1
67 1 19 ILE H 1 108 VAL H 2.900 . 4.000 3.672 3.372 4.012 0.012 9 0 "[ . 1 . 2]" 1
68 1 19 ILE H 1 108 VAL HB 3.800 . 5.600 5.088 3.758 5.588 . 0 0 "[ . 1 . 2]" 1
69 1 19 ILE H 1 109 PHE HA 3.200 . 4.500 3.133 2.636 3.478 . 0 0 "[ . 1 . 2]" 1
70 1 19 ILE H 1 109 PHE QD 6.000 . 6.000 4.315 3.135 4.838 . 0 0 "[ . 1 . 2]" 1
71 1 19 ILE H 1 110 VAL QG 6.000 . 6.000 4.015 3.588 4.531 . 0 0 "[ . 1 . 2]" 1
72 1 19 ILE HA 1 20 GLN H 2.200 . 2.800 2.326 2.148 2.425 . 0 0 "[ . 1 . 2]" 1
73 1 19 ILE HA 1 30 TYR QD 3.700 . 5.400 3.573 3.021 4.163 . 0 0 "[ . 1 . 2]" 1
74 1 19 ILE HA 1 31 ASN H 3.800 . 5.600 4.067 3.170 4.999 . 0 0 "[ . 1 . 2]" 1
75 1 19 ILE HB 1 30 TYR QD 5.200 . 6.000 4.719 2.974 5.548 . 0 0 "[ . 1 . 2]" 1
76 1 19 ILE HB 1 108 VAL H 3.200 . 4.500 3.859 3.504 4.683 0.183 11 0 "[ . 1 . 2]" 1
77 1 19 ILE MD 1 30 TYR QB 4.200 . 6.000 3.985 3.134 4.880 . 0 0 "[ . 1 . 2]" 1
78 1 19 ILE MD 1 30 TYR QD 3.100 . 4.300 3.535 2.592 4.319 0.019 5 0 "[ . 1 . 2]" 1
79 1 19 ILE MD 1 34 GLU QG 2.200 . 6.000 2.658 1.787 4.047 . 0 0 "[ . 1 . 2]" 1
80 1 19 ILE MD 1 50 PHE QE 2.300 . 6.000 3.332 2.079 4.851 . 0 0 "[ . 1 . 2]" 1
81 1 19 ILE HG13 1 50 PHE QE 2.800 . 6.000 4.611 3.119 5.413 . 0 0 "[ . 1 . 2]" 1
82 1 19 ILE HG13 1 50 PHE HZ 3.500 . 6.000 5.238 3.719 6.049 0.049 3 0 "[ . 1 . 2]" 1
83 1 19 ILE MG 1 20 GLN H 3.200 . 4.500 2.239 1.849 3.363 0.051 9 0 "[ . 1 . 2]" 1
84 1 19 ILE MG 1 30 TYR QD 2.200 . 6.000 2.241 1.767 2.928 . 0 0 "[ . 1 . 2]" 1
85 1 19 ILE MG 1 30 TYR QE 3.900 . 6.000 2.432 2.129 3.032 . 0 0 "[ . 1 . 2]" 1
86 1 19 ILE MG 1 50 PHE QE 2.400 . 6.000 4.211 3.063 5.782 . 0 0 "[ . 1 . 2]" 1
87 1 20 GLN H 1 20 GLN HB2 3.100 . 6.000 2.958 2.578 3.207 . 0 0 "[ . 1 . 2]" 1
88 1 20 GLN H 1 20 GLN QB 4.000 . 6.000 2.485 2.387 2.603 . 0 0 "[ . 1 . 2]" 1
89 1 20 GLN H 1 20 GLN HB3 3.200 . 4.500 2.714 2.526 3.637 . 0 0 "[ . 1 . 2]" 1
90 1 20 GLN H 1 20 GLN QG 3.200 . 4.500 4.043 3.574 4.119 . 0 0 "[ . 1 . 2]" 1
91 1 20 GLN H 1 21 LEU H 5.600 . 6.000 4.270 4.057 4.436 . 0 0 "[ . 1 . 2]" 1
92 1 20 GLN H 1 21 LEU HB3 4.900 . 6.000 5.208 4.539 6.006 0.006 20 0 "[ . 1 . 2]" 1
93 1 20 GLN H 1 21 LEU QD 3.400 . 4.800 3.956 3.128 4.678 . 0 0 "[ . 1 . 2]" 1
94 1 20 GLN H 1 28 LEU H 3.700 . 5.400 3.698 3.424 4.223 . 0 0 "[ . 1 . 2]" 1
95 1 20 GLN H 1 28 LEU HB2 5.500 . 6.000 3.966 3.127 4.542 . 0 0 "[ . 1 . 2]" 1
96 1 20 GLN H 1 29 GLN H 2.700 . 3.600 3.004 2.627 3.411 . 0 0 "[ . 1 . 2]" 1
97 1 20 GLN H 1 29 GLN HB2 4.000 . 6.000 5.047 2.996 5.841 . 0 0 "[ . 1 . 2]" 1
98 1 20 GLN H 1 29 GLN HB3 6.000 . 6.000 5.608 3.972 6.076 0.076 18 0 "[ . 1 . 2]" 1
99 1 20 GLN H 1 30 TYR HA 3.800 . 5.600 3.934 3.466 4.269 . 0 0 "[ . 1 . 2]" 1
100 1 20 GLN H 1 107 TRP HZ3 5.700 . 6.000 4.786 3.923 5.872 . 0 0 "[ . 1 . 2]" 1
101 1 20 GLN HA 1 21 LEU H 2.100 . 2.700 2.160 2.125 2.221 . 0 0 "[ . 1 . 2]" 1
102 1 20 GLN HA 1 107 TRP HA 2.300 . 3.000 2.480 2.211 2.659 . 0 0 "[ . 1 . 2]" 1
103 1 20 GLN HA 1 108 VAL H 2.900 . 4.000 2.792 2.443 3.106 . 0 0 "[ . 1 . 2]" 1
104 1 20 GLN QB 1 20 GLN HE21 3.800 . 5.600 3.716 2.831 3.804 . 0 0 "[ . 1 . 2]" 1
105 1 20 GLN QB 1 20 GLN HE22 3.900 . 5.800 4.037 3.524 4.092 . 0 0 "[ . 1 . 2]" 1
106 1 20 GLN QB 1 21 LEU H 3.600 . 5.200 3.778 2.935 3.960 . 0 0 "[ . 1 . 2]" 1
107 1 20 GLN QB 1 29 GLN H 2.800 . 3.700 2.468 1.844 3.143 0.056 14 0 "[ . 1 . 2]" 1
108 1 20 GLN QB 1 29 GLN HE21 3.300 . 4.700 3.291 2.023 4.720 0.020 10 0 "[ . 1 . 2]" 1
109 1 20 GLN QB 1 29 GLN HE22 4.100 . 6.000 4.201 2.622 5.018 . 0 0 "[ . 1 . 2]" 1
110 1 20 GLN QB 1 106 TYR H 4.200 . 6.000 5.281 4.381 5.482 . 0 0 "[ . 1 . 2]" 1
111 1 20 GLN HB2 1 20 GLN HE22 3.900 . 6.000 4.496 4.290 4.774 . 0 0 "[ . 1 . 2]" 1
112 1 20 GLN HB2 1 20 GLN QG 1.500 . 2.200 1.978 1.914 1.999 . 0 0 "[ . 1 . 2]" 1
113 1 20 GLN HB2 1 29 GLN H 5.700 . 6.000 3.851 1.863 4.583 . 0 0 "[ . 1 . 2]" 1
114 1 20 GLN HB2 1 106 TYR H 6.000 . 6.000 5.988 5.709 6.165 0.165 2 0 "[ . 1 . 2]" 1
115 1 20 GLN HB3 1 20 GLN HE21 4.700 . 6.000 4.315 2.884 4.509 . 0 0 "[ . 1 . 2]" 1
116 1 20 GLN HB3 1 20 GLN HE22 3.700 . 5.400 4.625 3.629 4.835 . 0 0 "[ . 1 . 2]" 1
117 1 20 GLN HB3 1 29 GLN HE21 4.300 . 6.000 3.800 2.413 5.404 . 0 0 "[ . 1 . 2]" 1
118 1 20 GLN HE21 1 20 GLN QG 3.000 . 4.100 2.170 2.128 2.221 . 0 0 "[ . 1 . 2]" 1
119 1 20 GLN HE21 1 105 SER H 3.500 . 5.100 4.479 3.770 5.646 0.546 14 1 "[ . 1 +. 2]" 1
120 1 20 GLN HE21 1 105 SER QB 3.200 . 4.500 2.998 2.042 4.044 . 0 0 "[ . 1 . 2]" 1
121 1 20 GLN HE21 1 107 TRP HE1 4.100 . 6.000 3.862 2.988 5.495 . 0 0 "[ . 1 . 2]" 1
122 1 20 GLN HE22 1 105 SER H 3.900 . 5.800 5.425 4.636 5.869 0.069 16 0 "[ . 1 . 2]" 1
123 1 20 GLN HE22 1 105 SER H 4.600 . 6.000 3.857 3.404 4.593 . 0 0 "[ . 1 . 2]" 1
124 1 20 GLN HE22 1 105 SER QB 4.500 . 6.000 4.101 3.453 4.759 . 0 0 "[ . 1 . 2]" 1
125 1 20 GLN HE22 1 107 TRP HE1 3.800 . 5.600 3.688 2.660 5.245 . 0 0 "[ . 1 . 2]" 1
126 1 20 GLN QG 1 105 SER H 4.700 . 6.000 4.155 3.938 4.359 . 0 0 "[ . 1 . 2]" 1
127 1 20 GLN QG 1 106 TYR QD 3.100 . 4.300 4.133 3.514 4.600 0.300 14 0 "[ . 1 . 2]" 1
128 1 20 GLN QG 1 21 LEU H 2.800 . 3.800 3.014 2.567 3.515 . 0 0 "[ . 1 . 2]" 1
129 1 20 GLN QG 1 22 ASP H 3.700 . 5.400 3.132 2.521 4.151 . 0 0 "[ . 1 . 2]" 1
130 1 20 GLN QG 1 22 ASP HB2 3.300 . 6.000 3.896 3.200 4.531 . 0 0 "[ . 1 . 2]" 1
131 1 20 GLN QG 1 105 SER QB 2.000 . 2.500 2.074 1.836 2.387 . 0 0 "[ . 1 . 2]" 1
132 1 20 GLN QG 1 102 SER HB2 2.500 . 6.000 5.372 4.224 6.879 0.879 19 1 "[ . 1 . +2]" 1
133 1 20 GLN QG 1 106 TYR H 3.400 . 4.800 3.478 3.206 4.673 . 0 0 "[ . 1 . 2]" 1
134 1 20 GLN HG2 1 22 ASP H 3.500 . 5.100 3.101 2.515 3.972 . 0 0 "[ . 1 . 2]" 1
135 1 20 GLN HG2 1 28 LEU HB3 1.800 . 6.000 2.218 2.107 2.470 . 0 0 "[ . 1 . 2]" 1
136 1 20 GLN HG2 1 29 GLN H 3.600 . 5.200 3.436 3.207 3.693 . 0 0 "[ . 1 . 2]" 1
137 1 20 GLN HG3 1 67 PHE QE 4.000 . 6.000 4.809 3.642 5.672 . 0 0 "[ . 1 . 2]" 1
138 1 21 LEU H 1 21 LEU HA 2.900 . 4.000 2.924 2.887 2.952 . 0 0 "[ . 1 . 2]" 1
139 1 21 LEU H 1 21 LEU HB2 3.700 . 5.400 3.325 2.518 3.993 . 0 0 "[ . 1 . 2]" 1
140 1 21 LEU H 1 21 LEU HB3 3.200 . 4.500 3.488 3.133 3.820 . 0 0 "[ . 1 . 2]" 1
141 1 21 LEU H 1 21 LEU QD 3.400 . 4.800 2.363 1.911 3.190 0.089 5 0 "[ . 1 . 2]" 1
142 1 21 LEU H 1 21 LEU HG 3.000 . 4.100 3.327 2.645 4.220 0.120 16 0 "[ . 1 . 2]" 1
143 1 21 LEU H 1 22 ASP H 4.300 . 6.000 4.461 4.374 4.536 . 0 0 "[ . 1 . 2]" 1
144 1 21 LEU H 1 22 ASP HB3 5.900 . 6.000 5.858 5.670 6.077 0.077 20 0 "[ . 1 . 2]" 1
145 1 21 LEU H 1 22 ASP HB3 3.500 . 5.000 3.789 3.054 4.738 . 0 0 "[ . 1 . 2]" 1
146 1 21 LEU H 1 105 SER HA 4.200 . 6.000 5.356 4.634 6.020 0.020 9 0 "[ . 1 . 2]" 1
147 1 21 LEU H 1 106 TYR H 3.000 . 4.100 3.099 2.785 3.497 . 0 0 "[ . 1 . 2]" 1
148 1 21 LEU H 1 106 TYR HB2 3.400 . 4.800 3.633 3.262 3.894 . 0 0 "[ . 1 . 2]" 1
149 1 21 LEU H 1 106 TYR HB3 4.500 . 6.000 5.045 4.492 5.324 . 0 0 "[ . 1 . 2]" 1
150 1 21 LEU H 1 106 TYR QD 3.600 . 5.200 4.340 4.100 4.959 . 0 0 "[ . 1 . 2]" 1
151 1 21 LEU H 1 107 TRP HA 3.400 . 4.900 3.700 3.502 3.952 . 0 0 "[ . 1 . 2]" 1
152 1 21 LEU H 1 108 VAL H 4.000 . 6.000 3.565 3.322 3.803 . 0 0 "[ . 1 . 2]" 1
153 1 21 LEU HA 1 22 ASP H 2.200 . 2.800 2.352 2.276 2.492 . 0 0 "[ . 1 . 2]" 1
154 1 21 LEU HA 1 26 ASN H 4.400 . 6.000 4.985 4.761 5.309 . 0 0 "[ . 1 . 2]" 1
155 1 21 LEU HA 1 27 ILE H 4.100 . 6.000 4.910 4.752 5.118 . 0 0 "[ . 1 . 2]" 1
156 1 21 LEU HA 1 27 ILE HA 2.300 . 2.900 2.590 2.309 2.851 . 0 0 "[ . 1 . 2]" 1
157 1 21 LEU HA 1 28 LEU H 2.800 . 3.800 3.404 3.072 3.723 . 0 0 "[ . 1 . 2]" 1
158 1 21 LEU HA 1 29 GLN H 4.300 . 6.000 5.287 4.902 5.889 . 0 0 "[ . 1 . 2]" 1
159 1 21 LEU HA 1 108 VAL H 4.400 . 6.000 6.197 6.088 6.285 0.285 4 0 "[ . 1 . 2]" 1
160 1 21 LEU HB2 1 22 ASP H 2.500 . 3.300 3.154 2.387 3.915 0.615 12 2 "[ . 1 + .- 2]" 1
161 1 21 LEU HB2 1 25 GLY H 3.500 . 5.000 4.990 4.204 5.943 0.943 1 7 "[+*- . *1 * .* *]" 1
162 1 21 LEU HB2 1 25 GLY HA2 2.400 . 6.000 4.157 3.062 5.156 . 0 0 "[ . 1 . 2]" 1
163 1 21 LEU HB2 1 26 ASN H 3.700 . 5.400 5.129 4.036 6.082 0.682 1 9 "[+** . *1 ** .* - *]" 1
164 1 21 LEU HB2 1 26 ASN QB 2.500 . 6.000 4.603 3.748 5.806 . 0 0 "[ . 1 . 2]" 1
165 1 21 LEU HB2 1 27 ILE H 5.100 . 6.000 4.999 4.235 5.695 . 0 0 "[ . 1 . 2]" 1
166 1 21 LEU HB2 1 27 ILE MG 3.000 . 6.000 4.418 3.907 5.052 . 0 0 "[ . 1 . 2]" 1
167 1 21 LEU HB2 1 67 PHE QE 3.700 . 5.500 3.418 1.916 4.902 . 0 0 "[ . 1 . 2]" 1
168 1 21 LEU HB2 1 106 TYR QD 3.500 . 5.000 4.127 2.938 5.081 0.081 7 0 "[ . 1 . 2]" 1
169 1 21 LEU HB3 1 22 ASP H 3.700 . 5.500 3.354 2.486 4.062 . 0 0 "[ . 1 . 2]" 1
170 1 21 LEU HB3 1 25 GLY H 4.300 . 6.000 5.281 4.117 6.124 0.124 11 0 "[ . 1 . 2]" 1
171 1 21 LEU HB3 1 26 ASN H 5.300 . 6.000 5.224 4.378 6.028 0.028 14 0 "[ . 1 . 2]" 1
172 1 21 LEU HB3 1 26 ASN H 4.300 . 6.000 4.705 4.198 5.254 . 0 0 "[ . 1 . 2]" 1
173 1 21 LEU HB3 1 27 ILE MG 2.900 . 6.000 4.212 3.142 5.109 . 0 0 "[ . 1 . 2]" 1
174 1 21 LEU HB3 1 51 PHE QD 2.800 . 3.800 3.182 2.655 3.730 . 0 0 "[ . 1 . 2]" 1
175 1 21 LEU HB3 1 67 PHE QE 4.300 . 6.000 4.198 2.902 5.277 . 0 0 "[ . 1 . 2]" 1
176 1 21 LEU HB3 1 106 TYR H 4.600 . 6.000 5.148 4.654 5.602 . 0 0 "[ . 1 . 2]" 1
177 1 21 LEU QD 1 22 ASP H 3.900 . 5.800 3.750 3.477 3.938 . 0 0 "[ . 1 . 2]" 1
178 1 21 LEU QD 1 67 PHE QD 3.100 . 4.300 3.250 2.772 4.207 . 0 0 "[ . 1 . 2]" 1
179 1 21 LEU QD 1 67 PHE QE 2.900 . 3.900 2.457 2.058 3.239 . 0 0 "[ . 1 . 2]" 1
180 1 21 LEU QD 1 67 PHE HZ 2.700 . 6.000 3.363 2.751 4.316 . 0 0 "[ . 1 . 2]" 1
181 1 21 LEU QD 1 106 TYR QD 4.400 . 6.000 3.779 2.673 5.043 . 0 0 "[ . 1 . 2]" 1
182 1 21 LEU QD 1 108 VAL MG2 3.600 . 6.000 2.910 1.849 3.293 . 0 0 "[ . 1 . 2]" 1
183 1 21 LEU HG 1 67 PHE QD 3.300 . 4.700 4.722 4.248 4.924 0.224 19 0 "[ . 1 . 2]" 1
184 1 21 LEU HG 1 67 PHE HZ 4.500 . 6.000 3.602 1.998 5.346 0.002 4 0 "[ . 1 . 2]" 1
185 1 22 ASP H 1 22 ASP HA 2.600 . 3.500 2.941 2.934 2.953 . 0 0 "[ . 1 . 2]" 1
186 1 22 ASP H 1 22 ASP HB2 3.400 . 4.900 3.758 3.702 3.828 . 0 0 "[ . 1 . 2]" 1
187 1 22 ASP H 1 22 ASP HB3 3.000 . 4.200 2.842 2.517 3.156 . 0 0 "[ . 1 . 2]" 1
188 1 22 ASP H 1 23 GLY H 4.200 . 6.000 4.513 4.484 4.528 . 0 0 "[ . 1 . 2]" 1
189 1 22 ASP H 1 23 GLY H 4.100 . 6.000 4.074 3.992 4.126 . 0 0 "[ . 1 . 2]" 1
190 1 22 ASP H 1 24 ASP H 4.000 . 6.000 4.439 4.096 4.734 . 0 0 "[ . 1 . 2]" 1
191 1 22 ASP H 1 25 GLY H 3.500 . 5.000 3.541 3.340 3.831 . 0 0 "[ . 1 . 2]" 1
192 1 22 ASP H 1 26 ASN H 2.700 . 3.600 3.155 2.919 3.413 . 0 0 "[ . 1 . 2]" 1
193 1 22 ASP H 1 26 ASN QB 3.700 . 5.500 3.442 3.105 3.799 . 0 0 "[ . 1 . 2]" 1
194 1 22 ASP H 1 27 ILE HA 3.000 . 4.100 4.016 3.741 4.239 0.139 6 0 "[ . 1 . 2]" 1
195 1 22 ASP H 1 28 LEU H 4.800 . 6.000 5.181 4.888 5.583 . 0 0 "[ . 1 . 2]" 1
196 1 22 ASP H 1 28 LEU QD 4.600 . 6.000 3.187 2.521 4.453 . 0 0 "[ . 1 . 2]" 1
197 1 22 ASP HA 1 23 GLY H 2.400 . 3.100 2.497 2.475 2.517 . 0 0 "[ . 1 . 2]" 1
198 1 22 ASP HA 1 105 SER H 5.000 . 6.000 4.842 4.320 5.265 . 0 0 "[ . 1 . 2]" 1
199 1 22 ASP HA 1 105 SER HA 2.000 . 2.500 2.096 1.695 2.526 0.026 9 0 "[ . 1 . 2]" 1
200 1 22 ASP HA 1 106 TYR H 3.600 . 5.200 2.944 2.612 3.176 . 0 0 "[ . 1 . 2]" 1
201 1 22 ASP HA 1 106 TYR QD 3.400 . 4.800 3.146 2.455 3.758 . 0 0 "[ . 1 . 2]" 1
202 1 22 ASP HA 1 106 TYR QE 4.500 . 6.000 3.552 3.056 4.935 . 0 0 "[ . 1 . 2]" 1
203 1 22 ASP HB2 1 23 GLY H 2.500 . 3.300 2.341 2.169 2.622 . 0 0 "[ . 1 . 2]" 1
204 1 22 ASP HB2 1 24 ASP H 4.600 . 6.000 3.077 2.720 3.487 . 0 0 "[ . 1 . 2]" 1
205 1 22 ASP HB3 1 23 GLY H 3.600 . 5.200 3.744 3.592 3.916 . 0 0 "[ . 1 . 2]" 1
206 1 22 ASP HB3 1 24 ASP H 3.900 . 5.800 4.064 3.864 4.211 . 0 0 "[ . 1 . 2]" 1
207 1 22 ASP HB3 1 28 LEU QD 3.300 . 4.700 2.264 1.895 2.731 0.005 13 0 "[ . 1 . 2]" 1
208 1 22 ASP HB3 1 105 SER QB 2.000 . 2.500 2.454 1.865 2.695 0.195 9 0 "[ . 1 . 2]" 1
209 1 22 ASP HB3 1 106 TYR QD 6.000 . 6.000 4.152 3.714 4.831 . 0 0 "[ . 1 . 2]" 1
210 1 23 GLY H 1 23 GLY QA 2.300 . 3.000 2.185 2.175 2.197 . 0 0 "[ . 1 . 2]" 1
211 1 23 GLY H 1 24 ASP H 2.800 . 3.800 2.863 2.755 2.944 . 0 0 "[ . 1 . 2]" 1
212 1 23 GLY H 1 28 LEU QD 3.900 . 5.800 4.542 4.048 5.213 . 0 0 "[ . 1 . 2]" 1
213 1 23 GLY H 1 71 VAL MG2 6.000 . 6.000 4.875 4.097 5.458 . 0 0 "[ . 1 . 2]" 1
214 1 23 GLY H 1 105 SER H 3.600 . 5.200 4.214 3.940 4.346 . 0 0 "[ . 1 . 2]" 1
215 1 23 GLY H 1 105 SER HA 3.900 . 5.800 3.391 2.274 3.945 . 0 0 "[ . 1 . 2]" 1
216 1 23 GLY H 1 106 TYR QD 4.000 . 6.000 4.153 3.365 4.839 . 0 0 "[ . 1 . 2]" 1
217 1 23 GLY H 1 106 TYR QE 3.000 . 4.100 2.905 2.408 3.874 . 0 0 "[ . 1 . 2]" 1
218 1 23 GLY QA 1 24 ASP H 2.800 . 3.800 2.889 2.806 2.949 . 0 0 "[ . 1 . 2]" 1
219 1 23 GLY QA 1 25 GLY H 3.400 . 4.900 3.827 3.446 4.379 . 0 0 "[ . 1 . 2]" 1
220 1 23 GLY QA 1 67 PHE QE 2.800 . 3.800 2.607 2.221 3.558 . 0 0 "[ . 1 . 2]" 1
221 1 23 GLY QA 1 106 TYR QD 4.100 . 6.000 3.698 2.715 4.180 . 0 0 "[ . 1 . 2]" 1
222 1 23 GLY QA 1 106 TYR QE 2.100 . 2.700 1.884 1.567 2.158 . 0 0 "[ . 1 . 2]" 1
223 1 24 ASP H 1 68 LYS HD2 6.000 . 6.000 5.021 4.762 5.500 . 0 0 "[ . 1 . 2]" 1
224 1 24 ASP H 1 24 ASP HA 2.600 . 3.400 2.900 2.859 2.941 . 0 0 "[ . 1 . 2]" 1
225 1 24 ASP H 1 24 ASP HB2 2.900 . 3.900 2.462 2.195 2.760 . 0 0 "[ . 1 . 2]" 1
226 1 24 ASP H 1 24 ASP HB3 3.700 . 5.400 3.112 2.499 3.644 . 0 0 "[ . 1 . 2]" 1
227 1 24 ASP H 1 25 GLY H 2.300 . 3.000 2.318 2.030 2.484 . 0 0 "[ . 1 . 2]" 1
228 1 24 ASP H 1 25 GLY HA3 4.400 . 6.000 5.012 4.773 5.155 . 0 0 "[ . 1 . 2]" 1
229 1 24 ASP H 1 26 ASN H 3.400 . 4.900 3.487 3.123 3.836 . 0 0 "[ . 1 . 2]" 1
230 1 24 ASP H 1 67 PHE QE 5.900 . 6.000 4.541 3.824 5.204 . 0 0 "[ . 1 . 2]" 1
231 1 24 ASP H 1 71 VAL MG1 5.700 . 6.000 5.039 4.473 5.578 . 0 0 "[ . 1 . 2]" 1
232 1 24 ASP HA 1 25 GLY H 3.200 . 4.500 3.437 3.323 3.542 . 0 0 "[ . 1 . 2]" 1
233 1 24 ASP HA 1 26 ASN H 4.100 . 6.000 4.759 4.330 5.125 . 0 0 "[ . 1 . 2]" 1
234 1 24 ASP HB2 1 25 GLY H 3.300 . 4.700 3.565 2.910 4.151 . 0 0 "[ . 1 . 2]" 1
235 1 24 ASP HB2 1 26 ASN H 3.200 . 4.500 3.826 2.838 4.546 0.046 1 0 "[ . 1 . 2]" 1
236 1 24 ASP HB2 1 26 ASN QD 3.700 . 5.000 3.633 2.489 4.899 . 0 0 "[ . 1 . 2]" 1
237 1 24 ASP HB3 1 25 GLY H 3.800 . 5.600 3.384 2.432 4.159 . 0 0 "[ . 1 . 2]" 1
238 1 24 ASP HB3 1 49 ASN HD21 3.500 . 5.000 4.079 3.077 5.251 0.251 2 0 "[ . 1 . 2]" 1
239 1 24 ASP HB3 1 49 ASN HD22 3.100 . 6.000 4.911 3.589 6.538 0.538 2 2 "[-+ . 1 . 2]" 1
240 1 24 ASP HB3 1 49 ASN HD22 3.600 . 5.200 4.070 2.745 5.221 0.021 15 0 "[ . 1 . 2]" 1
241 1 25 GLY H 1 25 GLY HA2 2.500 . 3.300 2.449 2.357 2.612 . 0 0 "[ . 1 . 2]" 1
242 1 25 GLY H 1 25 GLY HA3 3.000 . 4.100 2.947 2.927 2.959 . 0 0 "[ . 1 . 2]" 1
243 1 25 GLY H 1 26 ASN H 2.500 . 3.300 2.028 1.688 2.173 0.012 20 0 "[ . 1 . 2]" 1
244 1 25 GLY H 1 49 ASN HD22 4.000 . 6.000 4.959 4.273 5.925 . 0 0 "[ . 1 . 2]" 1
245 1 25 GLY H 1 67 PHE HZ 5.100 . 6.000 4.163 3.347 5.007 . 0 0 "[ . 1 . 2]" 1
246 1 25 GLY HA2 1 26 ASN H 3.300 . 4.700 3.190 3.078 3.274 . 0 0 "[ . 1 . 2]" 1
247 1 25 GLY HA2 1 49 ASN HD22 6.000 . 6.000 4.254 3.676 5.065 . 0 0 "[ . 1 . 2]" 1
248 1 25 GLY HA2 1 67 PHE QE 3.900 . 5.800 3.661 2.449 4.333 . 0 0 "[ . 1 . 2]" 1
249 1 25 GLY HA2 1 68 LYS QD 2.200 . 6.000 5.188 4.127 6.025 0.025 10 0 "[ . 1 . 2]" 1
250 1 25 GLY HA3 1 26 ASN H 3.400 . 4.800 3.350 3.274 3.445 . 0 0 "[ . 1 . 2]" 1
251 1 25 GLY HA3 1 27 ILE H 4.300 . 6.000 4.560 4.347 4.775 . 0 0 "[ . 1 . 2]" 1
252 1 25 GLY HA3 1 49 ASN HD21 4.200 . 6.000 3.359 2.667 4.307 . 0 0 "[ . 1 . 2]" 1
253 1 25 GLY HA3 1 49 ASN HD22 3.500 . 5.000 2.554 2.017 3.346 . 0 0 "[ . 1 . 2]" 1
254 1 26 ASN H 1 26 ASN HA 2.900 . 4.000 2.880 2.850 2.923 . 0 0 "[ . 1 . 2]" 1
255 1 26 ASN H 1 26 ASN QB 3.200 . 3.600 2.374 2.225 2.500 . 0 0 "[ . 1 . 2]" 1
256 1 26 ASN H 1 26 ASN QD 3.900 . 5.800 3.194 2.265 4.421 . 0 0 "[ . 1 . 2]" 1
257 1 26 ASN H 1 26 ASN QD 4.100 . 6.000 3.011 2.263 3.715 . 0 0 "[ . 1 . 2]" 1
258 1 26 ASN H 1 27 ILE H 3.600 . 5.200 3.696 3.443 4.151 . 0 0 "[ . 1 . 2]" 1
259 1 26 ASN H 1 49 ASN HA 3.900 . 5.800 4.327 3.940 4.637 . 0 0 "[ . 1 . 2]" 1
260 1 26 ASN H 1 49 ASN HD21 3.900 . 5.800 4.579 3.755 5.860 0.060 12 0 "[ . 1 . 2]" 1
261 1 26 ASN HA 1 27 ILE H 2.200 . 2.800 2.192 2.124 2.267 . 0 0 "[ . 1 . 2]" 1
262 1 26 ASN HA 1 49 ASN H 4.000 . 6.000 4.389 3.868 4.830 . 0 0 "[ . 1 . 2]" 1
263 1 26 ASN HA 1 49 ASN HA 2.100 . 2.700 2.428 1.837 2.738 0.038 8 0 "[ . 1 . 2]" 1
264 1 26 ASN HA 1 50 PHE H 3.000 . 4.100 3.384 2.847 3.747 . 0 0 "[ . 1 . 2]" 1
265 1 26 ASN QB 1 26 ASN QD 4.100 . 5.300 2.200 2.063 2.676 . 0 0 "[ . 1 . 2]" 1
266 1 26 ASN QB 1 27 ILE H 3.900 . 4.200 2.942 2.591 3.638 . 0 0 "[ . 1 . 2]" 1
267 1 26 ASN QB 1 105 SER QB 3.400 . 6.000 5.452 5.203 5.696 . 0 0 "[ . 1 . 2]" 1
268 1 26 ASN QD 1 47 GLY H 4.600 . 6.000 4.954 2.971 5.421 . 0 0 "[ . 1 . 2]" 1
269 1 27 ILE H 1 27 ILE HA 2.900 . 3.900 2.909 2.882 2.931 . 0 0 "[ . 1 . 2]" 1
270 1 27 ILE H 1 27 ILE HB 2.400 . 3.100 2.536 2.482 2.663 . 0 0 "[ . 1 . 2]" 1
271 1 27 ILE H 1 27 ILE MD 4.400 . 6.000 3.417 3.180 3.597 . 0 0 "[ . 1 . 2]" 1
272 1 27 ILE H 1 27 ILE QG 3.100 . 3.100 1.918 1.793 2.007 0.107 6 0 "[ . 1 . 2]" 1
273 1 27 ILE H 1 28 LEU H 6.000 . 6.000 4.547 4.510 4.583 . 0 0 "[ . 1 . 2]" 1
274 1 27 ILE H 1 28 LEU QD 5.800 . 6.000 4.144 3.795 4.784 . 0 0 "[ . 1 . 2]" 1
275 1 27 ILE H 1 46 ILE HA 3.600 . 5.200 4.386 3.841 5.121 . 0 0 "[ . 1 . 2]" 1
276 1 27 ILE H 1 48 LYS H 3.200 . 4.500 2.972 2.560 3.717 . 0 0 "[ . 1 . 2]" 1
277 1 27 ILE H 1 49 ASN HA 3.200 . 4.500 3.659 3.132 3.978 . 0 0 "[ . 1 . 2]" 1
278 1 27 ILE H 1 50 PHE H 3.600 . 5.200 3.749 3.375 4.035 . 0 0 "[ . 1 . 2]" 1
279 1 27 ILE H 1 50 PHE QB 5.000 . 6.000 4.346 3.950 4.796 . 0 0 "[ . 1 . 2]" 1
280 1 27 ILE HA 1 28 LEU H 2.100 . 2.700 2.249 2.179 2.348 . 0 0 "[ . 1 . 2]" 1
281 1 27 ILE HA 1 29 GLN H 3.800 . 5.600 4.588 4.081 5.074 . 0 0 "[ . 1 . 2]" 1
282 1 27 ILE HB 1 28 LEU H 4.100 . 6.000 3.583 3.422 3.731 . 0 0 "[ . 1 . 2]" 1
283 1 27 ILE HB 1 48 LYS H 2.700 . 3.600 3.694 3.590 3.778 0.178 6 0 "[ . 1 . 2]" 1
284 1 27 ILE HB 1 50 PHE H 4.600 . 6.000 4.581 4.445 4.967 . 0 0 "[ . 1 . 2]" 1
285 1 27 ILE MD 1 27 ILE MG 1.800 . 6.000 1.916 1.863 1.968 . 0 0 "[ . 1 . 2]" 1
286 1 27 ILE MD 1 46 ILE H 3.200 . 6.000 5.003 4.399 5.993 . 0 0 "[ . 1 . 2]" 1
287 1 27 ILE MD 1 50 PHE H 3.400 . 4.900 3.143 2.358 3.481 . 0 0 "[ . 1 . 2]" 1
288 1 27 ILE MD 1 54 VAL H 3.200 . 6.000 4.285 3.566 6.026 0.026 17 0 "[ . 1 . 2]" 1
289 1 27 ILE QG 1 30 TYR H 2.600 . 6.000 5.999 5.806 6.309 0.309 20 0 "[ . 1 . 2]" 1
290 1 27 ILE QG 1 45 VAL MG2 3.500 . 6.000 3.924 3.464 4.227 . 0 0 "[ . 1 . 2]" 1
291 1 27 ILE QG 1 48 LYS H . . 4.100 4.009 3.736 4.074 . 0 0 "[ . 1 . 2]" 1
292 1 27 ILE QG 1 50 PHE H 3.200 . 4.500 2.569 2.303 2.894 . 0 0 "[ . 1 . 2]" 1
293 1 27 ILE QG 1 50 PHE QB 2.900 . 4.000 2.022 1.749 3.298 0.051 1 0 "[ . 1 . 2]" 1
294 1 27 ILE MG 1 28 LEU H 4.900 . 6.000 2.003 1.869 2.170 0.031 2 0 "[ . 1 . 2]" 1
295 1 27 ILE MG 1 50 PHE H 6.000 . 6.000 5.038 4.603 5.266 . 0 0 "[ . 1 . 2]" 1
296 1 28 LEU H 1 28 LEU HB2 2.600 . 3.400 2.434 2.115 2.690 . 0 0 "[ . 1 . 2]" 1
297 1 28 LEU H 1 28 LEU HB3 3.500 . 5.000 3.636 3.396 3.804 . 0 0 "[ . 1 . 2]" 1
298 1 28 LEU H 1 28 LEU QD 3.600 . 4.800 2.584 1.972 3.393 0.028 11 0 "[ . 1 . 2]" 1
299 1 28 LEU H 1 28 LEU HG 2.900 . 4.000 3.812 2.828 4.135 0.135 11 0 "[ . 1 . 2]" 1
300 1 28 LEU H 1 29 GLN H 2.400 . 3.100 2.437 2.113 2.804 . 0 0 "[ . 1 . 2]" 1
301 1 28 LEU H 1 29 GLN HB2 4.100 . 6.000 5.007 4.208 6.032 0.032 10 0 "[ . 1 . 2]" 1
302 1 28 LEU HA 1 29 GLN H 3.300 . 4.700 3.540 3.507 3.567 . 0 0 "[ . 1 . 2]" 1
303 1 28 LEU QB 1 29 GLN H 5.800 . 6.000 2.041 1.719 2.341 . 0 0 "[ . 1 . 2]" 1
304 1 28 LEU HB2 1 29 GLN H 2.200 . 2.800 2.094 1.737 2.392 . 0 0 "[ . 1 . 2]" 1
305 1 28 LEU HB2 1 30 TYR QD 2.600 . 6.000 5.988 5.670 6.130 0.130 6 0 "[ . 1 . 2]" 1
306 1 28 LEU HB3 1 29 GLN HE22 3.200 . 6.000 5.345 2.940 6.023 0.023 17 0 "[ . 1 . 2]" 1
307 1 28 LEU HB3 1 29 GLN HG2 3.900 . 5.800 3.384 2.625 4.374 . 0 0 "[ . 1 . 2]" 1
308 1 28 LEU QD 1 28 LEU HG 1.700 . 6.000 1.892 1.889 1.897 . 0 0 "[ . 1 . 2]" 1
309 1 28 LEU QD 1 29 GLN H 6.000 . 6.000 3.576 3.269 3.828 . 0 0 "[ . 1 . 2]" 1
310 1 28 LEU QD 1 45 VAL HB 1.600 . 6.000 5.873 5.607 5.993 . 0 0 "[ . 1 . 2]" 1
311 1 28 LEU HG 1 29 GLN H 4.100 . 6.000 4.509 3.974 4.853 . 0 0 "[ . 1 . 2]" 1
312 1 29 GLN H 1 29 GLN HA 2.600 . 3.400 2.893 2.814 2.938 . 0 0 "[ . 1 . 2]" 1
313 1 29 GLN H 1 29 GLN HB2 2.900 . 3.900 3.554 2.261 3.992 0.092 13 0 "[ . 1 . 2]" 1
314 1 29 GLN H 1 29 GLN HB3 3.300 . 4.700 3.521 3.140 3.853 . 0 0 "[ . 1 . 2]" 1
315 1 29 GLN H 1 29 GLN HG2 3.300 . 4.700 3.236 2.026 4.233 . 0 0 "[ . 1 . 2]" 1
316 1 29 GLN H 1 29 GLN HG3 3.200 . 4.500 3.008 2.191 4.231 . 0 0 "[ . 1 . 2]" 1
317 1 29 GLN H 1 30 TYR H 4.100 . 6.000 4.291 4.167 4.531 . 0 0 "[ . 1 . 2]" 1
318 1 29 GLN H 1 30 TYR HA 3.800 . 5.700 4.801 4.571 5.228 . 0 0 "[ . 1 . 2]" 1
319 1 29 GLN HA 1 30 TYR H 2.300 . 3.000 2.193 2.081 2.395 . 0 0 "[ . 1 . 2]" 1
320 1 29 GLN HB2 1 29 GLN HE21 3.700 . 5.400 3.939 2.418 4.480 . 0 0 "[ . 1 . 2]" 1
321 1 29 GLN HB2 1 29 GLN HE22 4.700 . 6.000 4.427 3.611 5.170 . 0 0 "[ . 1 . 2]" 1
322 1 29 GLN HB2 1 30 TYR H 3.600 . 5.300 3.116 2.158 4.195 . 0 0 "[ . 1 . 2]" 1
323 1 29 GLN HB3 1 29 GLN HE21 4.400 . 6.000 4.066 1.979 4.605 0.021 17 0 "[ . 1 . 2]" 1
324 1 29 GLN HB3 1 29 GLN HE22 4.500 . 6.000 4.652 3.629 5.360 . 0 0 "[ . 1 . 2]" 1
325 1 29 GLN HB3 1 30 TYR H 3.500 . 5.000 3.649 3.032 4.096 . 0 0 "[ . 1 . 2]" 1
326 1 29 GLN HE21 1 29 GLN HG2 3.000 . 4.100 2.627 2.206 3.481 . 0 0 "[ . 1 . 2]" 1
327 1 29 GLN HE21 1 29 GLN HG3 2.500 . 3.300 2.704 2.212 3.484 0.184 17 0 "[ . 1 . 2]" 1
328 1 29 GLN HE21 1 107 TRP HH2 2.900 . 4.000 3.145 1.857 4.033 0.033 14 0 "[ . 1 . 2]" 1
329 1 29 GLN HE22 1 29 GLN HG2 4.100 . 6.000 3.654 3.464 4.057 . 0 0 "[ . 1 . 2]" 1
330 1 29 GLN HE22 1 29 GLN HG3 3.600 . 5.200 3.692 3.473 4.062 . 0 0 "[ . 1 . 2]" 1
331 1 29 GLN HG2 1 30 TYR H 4.200 . 6.000 4.822 4.178 5.188 . 0 0 "[ . 1 . 2]" 1
332 1 30 TYR H 1 30 TYR QB 4.900 . 6.000 2.332 2.163 2.583 . 0 0 "[ . 1 . 2]" 1
333 1 30 TYR H 1 30 TYR QD 3.900 . 5.800 3.170 2.343 4.010 . 0 0 "[ . 1 . 2]" 1
334 1 30 TYR H 1 31 ASN H 3.900 . 5.800 4.218 1.960 4.578 0.040 14 0 "[ . 1 . 2]" 1
335 1 30 TYR H 1 43 LYS H 6.000 . 6.000 4.727 2.686 5.928 . 0 0 "[ . 1 . 2]" 1
336 1 30 TYR HA 1 30 TYR QD 4.200 . 6.000 2.262 1.855 2.887 0.145 3 0 "[ . 1 . 2]" 1
337 1 30 TYR HA 1 31 ASN H 2.500 . 3.300 2.530 2.163 3.266 . 0 0 "[ . 1 . 2]" 1
338 1 30 TYR QB 1 30 TYR QD 2.400 . 3.100 2.263 2.157 2.355 . 0 0 "[ . 1 . 2]" 1
339 1 30 TYR QB 1 31 ASN H 4.600 . 5.000 2.453 1.905 3.505 0.095 3 0 "[ . 1 . 2]" 1
340 1 30 TYR QB 1 33 ALA MB 4.400 . 6.000 5.393 4.486 5.838 . 0 0 "[ . 1 . 2]" 1
341 1 30 TYR QB 1 34 GLU H 4.300 . 6.000 4.047 3.532 4.301 . 0 0 "[ . 1 . 2]" 1
342 1 30 TYR QB 1 45 VAL MG2 3.500 . 5.000 3.365 2.641 3.986 . 0 0 "[ . 1 . 2]" 1
343 1 30 TYR QB 1 43 LYS H 3.400 . 6.000 4.537 2.320 5.877 . 0 0 "[ . 1 . 2]" 1
344 1 30 TYR QD 1 31 ASN H 4.100 . 6.000 3.994 3.285 4.902 . 0 0 "[ . 1 . 2]" 1
345 1 30 TYR QD 1 34 GLU QG 3.200 . 4.400 2.957 1.918 4.415 0.082 8 0 "[ . 1 . 2]" 1
346 1 30 TYR QD 1 40 ARG QB 2.200 . 2.800 2.595 2.166 2.881 0.081 10 0 "[ . 1 . 2]" 1
347 1 30 TYR QD 1 45 VAL MG2 2.600 . 6.000 2.771 2.288 3.225 . 0 0 "[ . 1 . 2]" 1
348 1 30 TYR QE 1 35 GLY H 4.100 . 6.000 5.988 4.932 6.344 0.344 13 0 "[ . 1 . 2]" 1
349 1 30 TYR QE 1 45 VAL MG1 3.000 . 6.000 3.047 2.684 3.809 . 0 0 "[ . 1 . 2]" 1
350 1 31 ASN H 1 31 ASN HA 2.800 . 3.800 2.848 2.260 2.949 . 0 0 "[ . 1 . 2]" 1
351 1 31 ASN H 1 31 ASN HB2 2.900 . 4.000 2.870 2.289 3.761 . 0 0 "[ . 1 . 2]" 1
352 1 31 ASN H 1 31 ASN HB3 3.300 . 4.700 2.900 2.525 3.735 . 0 0 "[ . 1 . 2]" 1
353 1 31 ASN H 1 34 GLU QG 4.300 . 6.000 4.322 2.621 6.070 0.070 10 0 "[ . 1 . 2]" 1
354 1 31 ASN HA 1 32 ALA H 2.300 . 3.000 2.610 2.324 3.140 0.140 17 0 "[ . 1 . 2]" 1
355 1 31 ASN HA 1 33 ALA H 3.900 . 5.800 4.128 3.887 4.584 . 0 0 "[ . 1 . 2]" 1
356 1 31 ASN QB 1 33 ALA H 6.000 . 6.000 2.680 2.159 3.483 . 0 0 "[ . 1 . 2]" 1
357 1 31 ASN HB2 1 32 ALA H 3.100 . 4.300 3.654 1.900 4.281 . 0 0 "[ . 1 . 2]" 1
358 1 31 ASN HB2 1 33 ALA H 4.200 . 6.000 3.995 3.051 4.701 . 0 0 "[ . 1 . 2]" 1
359 1 31 ASN HB2 1 34 GLU QB 2.600 . 6.000 5.514 3.316 6.447 0.447 18 0 "[ . 1 . 2]" 1
360 1 31 ASN HB3 1 32 ALA H 2.600 . 3.500 3.326 2.513 3.858 0.358 2 0 "[ . 1 . 2]" 1
361 1 31 ASN HD21 1 33 ALA MB 5.100 . 6.000 3.436 2.024 5.269 . 0 0 "[ . 1 . 2]" 1
362 1 31 ASN HD22 1 32 ALA H 3.400 . 6.000 4.427 3.150 6.563 0.563 5 1 "[ + 1 . 2]" 1
363 1 31 ASN HD22 1 33 ALA H 5.300 . 6.000 4.359 2.780 5.800 . 0 0 "[ . 1 . 2]" 1
364 1 31 ASN HD22 1 33 ALA MB 4.600 . 6.000 3.861 1.808 5.334 0.092 2 0 "[ . 1 . 2]" 1
365 1 32 ALA H 1 32 ALA HA 2.800 . 3.700 2.753 2.267 2.933 . 0 0 "[ . 1 . 2]" 1
366 1 32 ALA H 1 33 ALA H 2.900 . 3.900 2.725 2.285 3.307 . 0 0 "[ . 1 . 2]" 1
367 1 32 ALA H 1 33 ALA MB 6.000 . 6.000 4.269 3.753 4.764 . 0 0 "[ . 1 . 2]" 1
368 1 32 ALA H 1 34 GLU H 4.400 . 6.000 4.561 3.599 5.272 . 0 0 "[ . 1 . 2]" 1
369 1 32 ALA HA 1 42 PRO QG 4.200 . 6.000 3.712 1.919 5.599 0.081 5 0 "[ . 1 . 2]" 1
370 1 32 ALA MB 1 33 ALA H 5.100 . 6.000 3.065 2.587 3.534 . 0 0 "[ . 1 . 2]" 1
371 1 33 ALA H 1 33 ALA HA 2.600 . 3.500 2.828 2.692 2.922 . 0 0 "[ . 1 . 2]" 1
372 1 33 ALA H 1 33 ALA MB 2.400 . 3.100 2.243 2.181 2.325 . 0 0 "[ . 1 . 2]" 1
373 1 33 ALA H 1 34 GLU H 2.900 . 3.900 2.660 2.198 3.194 . 0 0 "[ . 1 . 2]" 1
374 1 33 ALA HA 1 34 GLU H 3.500 . 5.100 3.541 3.446 3.583 . 0 0 "[ . 1 . 2]" 1
375 1 33 ALA HA 1 35 GLY H 3.500 . 5.100 4.322 3.671 4.988 . 0 0 "[ . 1 . 2]" 1
376 1 33 ALA HA 1 36 ASP H 2.800 . 3.800 3.573 3.282 3.888 0.088 18 0 "[ . 1 . 2]" 1
377 1 33 ALA HA 1 37 ILE H 6.000 . 6.000 4.441 3.043 5.701 . 0 0 "[ . 1 . 2]" 1
378 1 33 ALA MB 1 34 GLU H 3.000 . 4.100 2.473 2.070 2.988 . 0 0 "[ . 1 . 2]" 1
379 1 33 ALA MB 1 36 ASP H 3.300 . 4.700 4.496 4.202 4.778 0.078 7 0 "[ . 1 . 2]" 1
380 1 34 GLU H 1 34 GLU HA 2.900 . 4.000 2.834 2.778 2.874 . 0 0 "[ . 1 . 2]" 1
381 1 34 GLU H 1 34 GLU QB 2.900 . 3.900 2.349 2.144 2.739 . 0 0 "[ . 1 . 2]" 1
382 1 34 GLU H 1 34 GLU QG 3.500 . 5.100 3.243 2.030 4.069 . 0 0 "[ . 1 . 2]" 1
383 1 34 GLU H 1 35 GLY H 2.500 . 3.300 2.585 2.385 2.837 . 0 0 "[ . 1 . 2]" 1
384 1 34 GLU H 1 36 ASP H 3.900 . 5.800 3.980 3.689 4.399 . 0 0 "[ . 1 . 2]" 1
385 1 34 GLU HA 1 37 ILE H 3.400 . 4.800 3.583 2.789 4.597 . 0 0 "[ . 1 . 2]" 1
386 1 34 GLU QB 1 35 GLY H 3.200 . 4.500 2.772 2.230 3.271 . 0 0 "[ . 1 . 2]" 1
387 1 34 GLU QB 1 36 ASP H 4.000 . 6.000 4.584 4.290 5.283 . 0 0 "[ . 1 . 2]" 1
388 1 34 GLU QG 1 35 GLY H 4.100 . 6.000 4.198 3.652 4.701 . 0 0 "[ . 1 . 2]" 1
389 1 35 GLY H 1 35 GLY HA3 2.700 . 3.600 2.319 2.291 2.415 . 0 0 "[ . 1 . 2]" 1
390 1 35 GLY H 1 36 ASP H 2.900 . 3.900 2.540 2.270 2.749 . 0 0 "[ . 1 . 2]" 1
391 1 35 GLY H 1 36 ASP HA 4.400 . 6.000 5.114 4.731 5.355 . 0 0 "[ . 1 . 2]" 1
392 1 35 GLY HA2 1 36 ASP H 3.100 . 4.300 3.418 3.135 3.572 . 0 0 "[ . 1 . 2]" 1
393 1 35 GLY HA2 1 38 THR HA 2.400 . 6.000 5.573 3.107 6.101 0.101 12 0 "[ . 1 . 2]" 1
394 1 35 GLY HA3 1 36 ASP H 3.200 . 4.500 3.040 2.672 3.377 . 0 0 "[ . 1 . 2]" 1
395 1 36 ASP H 1 36 ASP HA 2.800 . 3.800 2.875 2.811 2.933 . 0 0 "[ . 1 . 2]" 1
396 1 36 ASP H 1 36 ASP HB2 2.800 . 3.800 2.641 2.202 2.957 . 0 0 "[ . 1 . 2]" 1
397 1 36 ASP H 1 36 ASP HB3 2.600 . 3.500 2.634 2.313 3.622 0.122 15 0 "[ . 1 . 2]" 1
398 1 36 ASP H 1 37 ILE H 2.900 . 3.900 2.459 2.169 2.820 . 0 0 "[ . 1 . 2]" 1
399 1 36 ASP H 1 37 ILE HB 4.500 . 6.000 4.805 4.268 6.007 0.007 1 0 "[ . 1 . 2]" 1
400 1 36 ASP HA 1 37 ILE H 3.500 . 5.000 3.519 3.390 3.576 . 0 0 "[ . 1 . 2]" 1
401 1 36 ASP HB2 1 37 ILE H 4.000 . 6.000 3.723 2.533 4.213 . 0 0 "[ . 1 . 2]" 1
402 1 36 ASP HB3 1 37 ILE H 3.300 . 4.600 2.751 2.170 3.761 . 0 0 "[ . 1 . 2]" 1
403 1 37 ILE H 1 37 ILE HB 2.500 . 3.300 2.559 2.330 3.478 0.178 6 0 "[ . 1 . 2]" 1
404 1 37 ILE H 1 37 ILE MD 3.800 . 5.600 3.374 3.016 3.645 . 0 0 "[ . 1 . 2]" 1
405 1 37 ILE H 1 37 ILE QG 2.800 . 3.800 1.958 1.514 2.501 0.286 17 0 "[ . 1 . 2]" 1
406 1 37 ILE H 1 38 THR H 2.700 . 3.600 2.793 2.377 3.689 0.089 3 0 "[ . 1 . 2]" 1
407 1 37 ILE H 1 39 GLY H 4.200 . 6.000 4.384 3.828 6.041 0.041 19 0 "[ . 1 . 2]" 1
408 1 37 ILE HA 1 37 ILE HB 2.700 . 3.600 2.792 2.338 2.874 . 0 0 "[ . 1 . 2]" 1
409 1 37 ILE HA 1 38 THR H 4.000 . 6.000 3.447 2.205 3.597 . 0 0 "[ . 1 . 2]" 1
410 1 37 ILE HB 1 37 ILE MD 2.100 . 6.000 2.810 2.442 3.227 . 0 0 "[ . 1 . 2]" 1
411 1 37 ILE HB 1 37 ILE QG 1.700 . 2.200 2.227 2.147 2.302 0.102 19 0 "[ . 1 . 2]" 1
412 1 37 ILE HB 1 38 THR H 2.900 . 3.900 2.415 1.867 4.116 0.216 3 0 "[ . 1 . 2]" 1
413 1 37 ILE QG 1 38 THR H 4.100 . 6.000 3.491 1.884 4.272 0.116 1 0 "[ . 1 . 2]" 1
414 1 38 THR H 1 38 THR HB 3.200 . 4.500 2.855 2.368 3.556 . 0 0 "[ . 1 . 2]" 1
415 1 38 THR H 1 38 THR MG 3.000 . 4.100 3.135 1.871 3.901 0.029 15 0 "[ . 1 . 2]" 1
416 1 38 THR H 1 39 GLY H 2.900 . 3.900 2.713 1.865 4.115 0.215 3 0 "[ . 1 . 2]" 1
417 1 38 THR HA 1 38 THR MG 2.800 . 3.800 2.496 2.005 3.135 . 0 0 "[ . 1 . 2]" 1
418 1 38 THR HA 1 39 GLY H 3.300 . 4.700 3.200 2.075 3.584 . 0 0 "[ . 1 . 2]" 1
419 1 38 THR HB 1 39 GLY H 3.600 . 5.200 3.124 1.961 4.460 0.039 17 0 "[ . 1 . 2]" 1
420 1 38 THR MG 1 39 GLY H 4.300 . 6.000 3.304 1.977 4.118 0.023 20 0 "[ . 1 . 2]" 1
421 1 39 GLY H 1 39 GLY HA2 2.800 . 3.800 2.546 2.268 2.947 . 0 0 "[ . 1 . 2]" 1
422 1 39 GLY H 1 40 ARG H 3.100 . 4.300 2.769 1.857 4.545 0.245 19 0 "[ . 1 . 2]" 1
423 1 39 GLY HA2 1 40 ARG H 3.400 . 4.800 2.819 2.147 3.560 . 0 0 "[ . 1 . 2]" 1
424 1 39 GLY HA3 1 40 ARG H 3.700 . 5.400 3.189 2.128 3.561 . 0 0 "[ . 1 . 2]" 1
425 1 40 ARG H 1 40 ARG QB 3.500 . 4.400 2.663 2.308 3.377 . 0 0 "[ . 1 . 2]" 1
426 1 40 ARG H 1 40 ARG QD 3.200 . 4.500 3.482 2.148 4.554 0.054 9 0 "[ . 1 . 2]" 1
427 1 40 ARG H 1 40 ARG HG2 3.700 . 5.400 3.697 2.423 4.857 . 0 0 "[ . 1 . 2]" 1
428 1 40 ARG H 1 40 ARG HG3 4.000 . 6.000 4.192 2.672 4.584 . 0 0 "[ . 1 . 2]" 1
429 1 40 ARG H 1 41 ASP H 4.400 . 6.000 4.137 3.255 4.518 . 0 0 "[ . 1 . 2]" 1
430 1 40 ARG HA 1 40 ARG QB 4.300 . 6.000 2.405 2.309 2.504 . 0 0 "[ . 1 . 2]" 1
431 1 40 ARG HA 1 41 ASP H 2.200 . 2.800 2.251 2.119 2.520 . 0 0 "[ . 1 . 2]" 1
432 1 40 ARG QB 1 41 ASP H 4.900 . 6.000 3.212 1.961 3.918 . 0 0 "[ . 1 . 2]" 1
433 1 40 ARG QD 1 40 ARG HE 4.000 . 6.000 2.391 2.190 2.494 . 0 0 "[ . 1 . 2]" 1
434 1 40 ARG QD 1 41 ASP H 4.000 . 6.000 4.054 3.240 5.514 . 0 0 "[ . 1 . 2]" 1
435 1 40 ARG HE 1 40 ARG HG3 4.000 . 6.000 2.944 2.228 4.011 . 0 0 "[ . 1 . 2]" 1
436 1 40 ARG QG 1 41 ASP H 6.000 . 6.000 4.262 3.113 4.850 . 0 0 "[ . 1 . 2]" 1
437 1 40 ARG HG2 1 41 ASP H 4.500 . 6.000 5.127 4.180 5.668 . 0 0 "[ . 1 . 2]" 1
438 1 40 ARG HG3 1 41 ASP H 4.200 . 6.000 4.692 3.211 5.815 . 0 0 "[ . 1 . 2]" 1
439 1 41 ASP H 1 41 ASP HA 2.900 . 3.900 2.859 2.771 2.943 . 0 0 "[ . 1 . 2]" 1
440 1 41 ASP H 1 41 ASP HB2 2.400 . 3.100 2.492 2.299 2.980 . 0 0 "[ . 1 . 2]" 1
441 1 41 ASP H 1 41 ASP HB3 3.000 . 4.100 3.281 2.451 3.641 . 0 0 "[ . 1 . 2]" 1
442 1 41 ASP H 1 42 PRO QD 6.000 . 6.000 4.314 4.112 4.431 . 0 0 "[ . 1 . 2]" 1
443 1 41 ASP H 1 44 GLN H 3.900 . 5.800 4.503 3.788 5.235 . 0 0 "[ . 1 . 2]" 1
444 1 41 ASP H 1 44 GLN QB 3.500 . 5.000 3.251 2.687 4.364 . 0 0 "[ . 1 . 2]" 1
445 1 41 ASP H 1 45 VAL MG1 4.500 . 6.000 4.618 3.792 5.860 . 0 0 "[ . 1 . 2]" 1
446 1 41 ASP HA 1 42 PRO QD 2.500 . 3.300 1.881 1.684 2.144 0.016 5 0 "[ . 1 . 2]" 1
447 1 41 ASP HA 1 43 LYS H 3.900 . 5.800 4.365 3.679 5.773 . 0 0 "[ . 1 . 2]" 1
448 1 41 ASP HA 1 44 GLN H 4.100 . 6.000 4.749 4.484 5.210 . 0 0 "[ . 1 . 2]" 1
449 1 41 ASP HB2 1 43 LYS H 4.300 . 6.000 4.224 2.830 5.847 . 0 0 "[ . 1 . 2]" 1
450 1 41 ASP HB2 1 44 GLN H 4.700 . 6.000 3.767 2.765 4.970 . 0 0 "[ . 1 . 2]" 1
451 1 41 ASP HB2 1 44 GLN HE21 3.500 . 5.000 3.619 2.168 4.998 . 0 0 "[ . 1 . 2]" 1
452 1 41 ASP HB2 1 44 GLN HE22 4.500 . 6.000 4.722 3.024 6.069 0.069 15 0 "[ . 1 . 2]" 1
453 1 41 ASP HB3 1 42 PRO HA 4.200 . 6.000 5.120 4.792 5.573 . 0 0 "[ . 1 . 2]" 1
454 1 41 ASP HB3 1 42 PRO HB2 2.700 . 6.000 3.221 2.055 4.476 . 0 0 "[ . 1 . 2]" 1
455 1 41 ASP HB3 1 43 LYS H 3.600 . 5.300 3.487 2.117 5.422 0.122 8 0 "[ . 1 . 2]" 1
456 1 41 ASP HB3 1 44 GLN H 3.200 . 4.500 3.536 2.778 4.165 . 0 0 "[ . 1 . 2]" 1
457 1 41 ASP HB3 1 44 GLN HE21 3.700 . 5.400 3.968 2.937 5.011 . 0 0 "[ . 1 . 2]" 1
458 1 41 ASP HB3 1 44 GLN HG2 3.000 . 4.100 3.152 1.437 4.904 0.804 10 2 "[ . + .- 2]" 1
459 1 42 PRO HA 1 42 PRO QD 2.600 . 3.400 3.354 3.158 3.465 0.065 5 0 "[ . 1 . 2]" 1
460 1 42 PRO HA 1 42 PRO QG 3.300 . 4.700 3.029 2.811 3.506 . 0 0 "[ . 1 . 2]" 1
461 1 42 PRO HA 1 43 LYS H 3.700 . 5.400 3.219 2.101 3.557 . 0 0 "[ . 1 . 2]" 1
462 1 42 PRO QB 1 42 PRO QG 2.000 . 2.500 1.971 1.960 1.978 . 0 0 "[ . 1 . 2]" 1
463 1 42 PRO QB 1 43 LYS H 4.100 . 6.000 3.076 2.654 3.539 . 0 0 "[ . 1 . 2]" 1
464 1 42 PRO QB 1 43 LYS QG 3.000 . 4.100 2.928 2.296 3.727 . 0 0 "[ . 1 . 2]" 1
465 1 42 PRO QG 1 43 LYS H 5.700 . 6.000 3.909 2.629 4.840 . 0 0 "[ . 1 . 2]" 1
466 1 43 LYS H 1 43 LYS HA 2.900 . 4.000 2.790 2.263 2.952 . 0 0 "[ . 1 . 2]" 1
467 1 43 LYS H 1 43 LYS HB2 4.200 . 6.000 2.744 2.392 3.664 . 0 0 "[ . 1 . 2]" 1
468 1 43 LYS H 1 43 LYS QB 2.600 . 3.400 2.668 2.361 3.433 0.033 11 0 "[ . 1 . 2]" 1
469 1 43 LYS H 1 43 LYS QG 2.700 . 3.600 2.793 2.173 3.245 . 0 0 "[ . 1 . 2]" 1
470 1 43 LYS H 1 44 GLN H 2.400 . 3.100 2.397 1.954 2.562 . 0 0 "[ . 1 . 2]" 1
471 1 43 LYS H 1 44 GLN HA 4.400 . 6.000 4.862 4.558 5.151 . 0 0 "[ . 1 . 2]" 1
472 1 43 LYS H 1 44 GLN QB 3.500 . 5.000 4.356 3.703 4.920 . 0 0 "[ . 1 . 2]" 1
473 1 43 LYS H 1 45 VAL H 4.400 . 6.000 4.071 3.166 4.680 . 0 0 "[ . 1 . 2]" 1
474 1 43 LYS H 1 46 ILE HB 6.000 . 6.000 5.762 5.067 6.555 0.555 19 1 "[ . 1 . +2]" 1
475 1 43 LYS HA 1 43 LYS QG 2.300 . 2.900 2.451 2.292 2.897 . 0 0 "[ . 1 . 2]" 1
476 1 43 LYS HA 1 44 GLN H 3.100 . 4.300 3.245 2.974 3.442 . 0 0 "[ . 1 . 2]" 1
477 1 43 LYS HA 1 46 ILE H 4.000 . 6.000 4.538 3.834 5.513 . 0 0 "[ . 1 . 2]" 1
478 1 43 LYS HA 1 46 ILE HB 2.800 . 3.800 3.563 3.049 4.203 0.403 19 0 "[ . 1 . 2]" 1
479 1 43 LYS HA 1 46 ILE MD 3.400 . 4.800 2.730 1.995 3.377 0.005 4 0 "[ . 1 . 2]" 1
480 1 43 LYS QB 1 44 GLN H 3.200 . 4.500 3.438 3.032 3.772 . 0 0 "[ . 1 . 2]" 1
481 1 43 LYS HB2 1 43 LYS QG 2.200 . 2.800 2.326 2.160 2.456 . 0 0 "[ . 1 . 2]" 1
482 1 43 LYS HB2 1 44 GLN H 4.800 . 6.000 3.632 3.144 4.093 . 0 0 "[ . 1 . 2]" 1
483 1 43 LYS HB3 1 43 LYS QG 2.500 . 3.300 2.341 2.148 2.418 . 0 0 "[ . 1 . 2]" 1
484 1 43 LYS HB3 1 44 GLN H 4.500 . 6.000 4.274 3.975 4.417 . 0 0 "[ . 1 . 2]" 1
485 1 43 LYS HG3 1 44 GLN H 3.700 . 5.400 4.859 4.449 5.771 0.371 13 0 "[ . 1 . 2]" 1
486 1 44 GLN H 1 44 GLN HA 2.500 . 3.300 2.916 2.870 2.942 . 0 0 "[ . 1 . 2]" 1
487 1 44 GLN H 1 44 GLN QB 2.500 . 3.300 2.414 2.161 2.636 . 0 0 "[ . 1 . 2]" 1
488 1 44 GLN H 1 44 GLN HG2 4.900 . 6.000 2.997 2.322 4.150 . 0 0 "[ . 1 . 2]" 1
489 1 44 GLN H 1 44 GLN HG3 2.900 . 4.000 3.626 2.540 4.553 0.553 19 1 "[ . 1 . +2]" 1
490 1 44 GLN H 1 45 VAL H 2.300 . 2.900 2.382 2.275 2.671 . 0 0 "[ . 1 . 2]" 1
491 1 44 GLN H 1 45 VAL MG1 3.500 . 5.000 3.878 3.584 4.520 . 0 0 "[ . 1 . 2]" 1
492 1 44 GLN H 1 45 VAL MG2 3.700 . 5.400 3.016 2.838 3.373 . 0 0 "[ . 1 . 2]" 1
493 1 44 GLN H 1 46 ILE H 4.100 . 6.000 4.636 4.233 5.376 . 0 0 "[ . 1 . 2]" 1
494 1 44 GLN HA 1 45 VAL H 3.300 . 4.600 3.282 2.971 3.563 . 0 0 "[ . 1 . 2]" 1
495 1 44 GLN HA 1 46 ILE H 3.900 . 5.800 3.871 3.359 5.873 0.073 12 0 "[ . 1 . 2]" 1
496 1 44 GLN QB 1 44 GLN HE21 4.700 . 6.000 3.521 1.831 4.016 0.169 11 0 "[ . 1 . 2]" 1
497 1 44 GLN QB 1 45 VAL H 3.600 . 5.200 3.298 2.282 3.717 . 0 0 "[ . 1 . 2]" 1
498 1 44 GLN HE21 1 44 GLN HG2 2.900 . 4.000 2.503 2.156 3.445 . 0 0 "[ . 1 . 2]" 1
499 1 44 GLN HE21 1 44 GLN HG3 2.800 . 3.800 2.940 2.211 3.507 . 0 0 "[ . 1 . 2]" 1
500 1 44 GLN HE22 1 44 GLN HG3 4.000 . 6.000 3.801 3.477 4.066 . 0 0 "[ . 1 . 2]" 1
501 1 44 GLN HG2 1 45 VAL H 3.800 . 5.600 4.674 3.377 5.222 . 0 0 "[ . 1 . 2]" 1
502 1 44 GLN HG3 1 45 VAL H 4.400 . 6.000 5.149 2.760 5.752 . 0 0 "[ . 1 . 2]" 1
503 1 45 VAL H 1 45 VAL HA 2.600 . 3.400 2.930 2.891 2.946 . 0 0 "[ . 1 . 2]" 1
504 1 45 VAL H 1 45 VAL HB 3.900 . 5.800 3.545 3.464 3.607 . 0 0 "[ . 1 . 2]" 1
505 1 45 VAL H 1 45 VAL MG1 3.000 . 4.100 2.861 2.611 3.102 . 0 0 "[ . 1 . 2]" 1
506 1 45 VAL H 1 45 VAL MG2 2.500 . 3.300 1.743 1.650 1.875 0.050 9 0 "[ . 1 . 2]" 1
507 1 45 VAL H 1 46 ILE HB 3.900 . 5.800 3.818 2.905 4.332 . 0 0 "[ . 1 . 2]" 1
508 1 45 VAL H 1 46 ILE MD 4.400 . 6.000 4.359 3.430 4.909 . 0 0 "[ . 1 . 2]" 1
509 1 45 VAL H 1 48 LYS QB 5.300 . 6.000 4.782 4.457 5.390 . 0 0 "[ . 1 . 2]" 1
510 1 45 VAL H 1 48 LYS QD 4.400 . 6.000 4.657 3.985 6.206 0.206 12 0 "[ . 1 . 2]" 1
511 1 45 VAL HA 1 46 ILE H 3.200 . 4.500 2.985 2.577 3.516 . 0 0 "[ . 1 . 2]" 1
512 1 45 VAL HA 1 48 LYS H 3.700 . 5.500 4.317 3.810 4.747 . 0 0 "[ . 1 . 2]" 1
513 1 45 VAL HB 1 45 VAL MG2 3.000 . 4.100 2.123 2.117 2.128 . 0 0 "[ . 1 . 2]" 1
514 1 45 VAL HB 1 46 ILE H 3.600 . 5.200 4.031 2.107 4.192 . 0 0 "[ . 1 . 2]" 1
515 1 45 VAL HB 1 50 PHE H 3.000 . 6.000 6.062 5.931 6.140 0.140 18 0 "[ . 1 . 2]" 1
516 1 45 VAL MG1 1 46 ILE H 4.700 . 6.000 4.229 3.643 4.287 . 0 0 "[ . 1 . 2]" 1
517 1 45 VAL MG2 1 46 ILE H 5.200 . 6.000 3.358 1.794 3.979 0.106 12 0 "[ . 1 . 2]" 1
518 1 46 ILE H 1 46 ILE HA 2.900 . 4.000 2.870 2.250 2.942 . 0 0 "[ . 1 . 2]" 1
519 1 46 ILE H 1 46 ILE HB 3.100 . 4.300 2.617 2.375 3.619 . 0 0 "[ . 1 . 2]" 1
520 1 46 ILE H 1 46 ILE MD 3.400 . 4.900 3.522 2.904 3.901 . 0 0 "[ . 1 . 2]" 1
521 1 46 ILE H 1 46 ILE HG12 2.700 . 3.600 3.069 1.756 3.568 0.044 6 0 "[ . 1 . 2]" 1
522 1 46 ILE H 1 46 ILE HG13 3.400 . 4.800 2.418 1.967 4.030 0.033 3 0 "[ . 1 . 2]" 1
523 1 46 ILE H 1 46 ILE MG 3.400 . 4.800 3.670 2.763 3.894 . 0 0 "[ . 1 . 2]" 1
524 1 46 ILE H 1 47 GLY H 4.500 . 6.000 4.457 3.632 4.576 . 0 0 "[ . 1 . 2]" 1
525 1 46 ILE H 1 48 LYS QB 2.800 . 3.800 3.704 3.105 3.878 0.078 6 0 "[ . 1 . 2]" 1
526 1 46 ILE HA 1 46 ILE HB 2.700 . 3.600 2.359 2.227 2.619 . 0 0 "[ . 1 . 2]" 1
527 1 46 ILE HA 1 47 GLY H 2.300 . 3.000 2.173 2.103 2.233 . 0 0 "[ . 1 . 2]" 1
528 1 46 ILE HA 1 48 LYS H 3.000 . 4.100 3.196 2.960 3.715 . 0 0 "[ . 1 . 2]" 1
529 1 46 ILE HA 1 48 LYS QB 2.900 . 4.000 4.053 3.954 4.166 0.166 12 0 "[ . 1 . 2]" 1
530 1 46 ILE HB 1 47 GLY H 4.800 . 6.000 3.844 2.706 4.252 . 0 0 "[ . 1 . 2]" 1
531 1 46 ILE MD 1 47 GLY H 5.600 . 6.000 4.725 3.541 5.088 . 0 0 "[ . 1 . 2]" 1
532 1 46 ILE HG13 1 47 GLY H 3.800 . 5.600 5.012 4.346 5.627 0.027 12 0 "[ . 1 . 2]" 1
533 1 46 ILE MG 1 47 GLY H 2.500 . 3.300 2.550 2.110 3.371 0.071 10 0 "[ . 1 . 2]" 1
534 1 46 ILE MG 1 47 GLY HA2 4.200 . 6.000 3.835 3.474 5.264 . 0 0 "[ . 1 . 2]" 1
535 1 47 GLY H 1 47 GLY HA2 2.600 . 3.400 2.317 2.289 2.384 . 0 0 "[ . 1 . 2]" 1
536 1 47 GLY H 1 47 GLY HA3 3.000 . 4.100 2.869 2.821 2.935 . 0 0 "[ . 1 . 2]" 1
537 1 47 GLY H 1 48 LYS H 2.700 . 3.600 2.456 2.350 2.567 . 0 0 "[ . 1 . 2]" 1
538 1 47 GLY HA2 1 48 LYS H 3.000 . 4.100 3.102 2.841 3.312 . 0 0 "[ . 1 . 2]" 1
539 1 47 GLY HA3 1 48 LYS H 3.100 . 4.300 3.336 3.105 3.465 . 0 0 "[ . 1 . 2]" 1
540 1 47 GLY HA3 1 48 LYS QB 2.600 . 6.000 4.789 4.573 4.937 . 0 0 "[ . 1 . 2]" 1
541 1 48 LYS H 1 48 LYS HA 2.500 . 3.300 2.922 2.868 2.942 . 0 0 "[ . 1 . 2]" 1
542 1 48 LYS H 1 48 LYS QB 3.800 . 5.000 2.244 2.014 2.431 . 0 0 "[ . 1 . 2]" 1
543 1 48 LYS H 1 48 LYS QD 3.900 . 5.800 4.138 2.795 4.765 . 0 0 "[ . 1 . 2]" 1
544 1 48 LYS H 1 48 LYS QE 4.400 . 6.000 5.318 3.791 5.869 . 0 0 "[ . 1 . 2]" 1
545 1 48 LYS H 1 48 LYS HG2 3.400 . 4.800 4.252 3.709 4.715 . 0 0 "[ . 1 . 2]" 1
546 1 48 LYS H 1 48 LYS HG3 3.000 . 4.100 3.738 3.030 4.557 0.457 4 0 "[ . 1 . 2]" 1
547 1 48 LYS H 1 49 ASN H 4.000 . 6.000 4.436 4.281 4.577 . 0 0 "[ . 1 . 2]" 1
548 1 48 LYS H 1 53 ASP QB 4.600 . 6.000 5.808 5.238 6.070 0.070 13 0 "[ . 1 . 2]" 1
549 1 48 LYS HA 1 49 ASN H 2.300 . 2.900 2.200 2.114 2.281 . 0 0 "[ . 1 . 2]" 1
550 1 48 LYS QB 1 49 ASN H 3.600 . 3.800 3.173 2.733 3.642 . 0 0 "[ . 1 . 2]" 1
551 1 48 LYS QB 1 54 VAL H 3.500 . 5.000 4.574 3.496 4.941 . 0 0 "[ . 1 . 2]" 1
552 1 48 LYS HD3 1 49 ASN H 3.800 . 5.600 5.025 3.168 5.957 0.357 3 0 "[ . 1 . 2]" 1
553 1 48 LYS QE 1 49 ASN H 4.300 . 6.000 5.660 4.432 6.096 0.096 2 0 "[ . 1 . 2]" 1
554 1 48 LYS HG2 1 49 ASN H 3.800 . 5.600 3.932 3.394 5.084 . 0 0 "[ . 1 . 2]" 1
555 1 48 LYS HG3 1 49 ASN H 5.200 . 6.000 4.400 2.617 5.279 . 0 0 "[ . 1 . 2]" 1
556 1 49 ASN H 1 49 ASN HA 2.900 . 4.000 2.900 2.844 2.944 . 0 0 "[ . 1 . 2]" 1
557 1 49 ASN H 1 49 ASN HB2 2.800 . 3.800 2.612 2.429 2.844 . 0 0 "[ . 1 . 2]" 1
558 1 49 ASN H 1 49 ASN HB3 2.600 . 3.400 2.629 2.530 2.742 . 0 0 "[ . 1 . 2]" 1
559 1 49 ASN H 1 49 ASN HD21 4.400 . 6.000 4.617 4.362 4.936 . 0 0 "[ . 1 . 2]" 1
560 1 49 ASN H 1 49 ASN HD22 5.000 . 6.000 5.804 5.651 5.987 . 0 0 "[ . 1 . 2]" 1
561 1 49 ASN H 1 50 PHE H 4.400 . 6.000 4.347 4.221 4.418 . 0 0 "[ . 1 . 2]" 1
562 1 49 ASN H 1 52 LYS HB2 4.100 . 6.000 4.995 3.736 6.016 0.016 8 0 "[ . 1 . 2]" 1
563 1 49 ASN H 1 53 ASP H 3.700 . 5.400 3.904 3.411 4.638 . 0 0 "[ . 1 . 2]" 1
564 1 49 ASN H 1 53 ASP QB 2.800 . 3.800 2.890 2.315 3.724 . 0 0 "[ . 1 . 2]" 1
565 1 49 ASN H 1 54 VAL QG 4.600 . 6.000 4.675 3.398 5.911 . 0 0 "[ . 1 . 2]" 1
566 1 49 ASN HA 1 50 PHE H 2.500 . 3.300 2.118 2.089 2.157 . 0 0 "[ . 1 . 2]" 1
567 1 49 ASN HB2 1 49 ASN HD21 3.000 . 4.100 2.207 2.148 2.238 . 0 0 "[ . 1 . 2]" 1
568 1 49 ASN HB2 1 50 PHE H 4.900 . 6.000 4.417 4.329 4.518 . 0 0 "[ . 1 . 2]" 1
569 1 49 ASN HB2 1 52 LYS H 4.100 . 6.000 4.919 4.223 5.594 . 0 0 "[ . 1 . 2]" 1
570 1 49 ASN HB2 1 53 ASP H 4.100 . 6.000 4.612 3.905 5.144 . 0 0 "[ . 1 . 2]" 1
571 1 49 ASN HB3 1 49 ASN HD21 3.600 . 5.200 3.356 2.937 3.465 . 0 0 "[ . 1 . 2]" 1
572 1 49 ASN HB3 1 50 PHE H 3.900 . 5.800 4.255 4.089 4.351 . 0 0 "[ . 1 . 2]" 1
573 1 49 ASN HB3 1 52 LYS H 3.500 . 5.000 3.357 2.558 4.109 . 0 0 "[ . 1 . 2]" 1
574 1 49 ASN HB3 1 53 ASP H 3.000 . 4.100 2.952 2.251 3.513 . 0 0 "[ . 1 . 2]" 1
575 1 50 PHE H 1 50 PHE HA 3.000 . 4.100 2.773 2.723 2.848 . 0 0 "[ . 1 . 2]" 1
576 1 50 PHE H 1 50 PHE QB . . 4.200 2.229 2.199 2.249 . 0 0 "[ . 1 . 2]" 1
577 1 50 PHE H 1 51 PHE H 3.100 . 4.300 2.805 2.703 3.109 . 0 0 "[ . 1 . 2]" 1
578 1 50 PHE HA 1 50 PHE QE 5.400 . 6.000 4.580 4.473 4.678 . 0 0 "[ . 1 . 2]" 1
579 1 50 PHE HA 1 51 PHE H 3.800 . 5.600 3.494 3.288 3.582 . 0 0 "[ . 1 . 2]" 1
580 1 50 PHE HA 1 53 ASP H 3.900 . 5.800 4.137 3.683 4.484 . 0 0 "[ . 1 . 2]" 1
581 1 50 PHE HA 1 54 VAL H 3.000 . 4.100 3.393 2.839 3.828 . 0 0 "[ . 1 . 2]" 1
582 1 50 PHE HA 1 55 ALA H 3.400 . 4.900 4.441 4.019 4.871 . 0 0 "[ . 1 . 2]" 1
583 1 50 PHE HA 1 55 ALA MB 4.200 . 6.000 3.636 2.664 4.168 . 0 0 "[ . 1 . 2]" 1
584 1 50 PHE QB 1 50 PHE QD 2.500 . 6.000 2.128 2.124 2.140 . 0 0 "[ . 1 . 2]" 1
585 1 50 PHE QB 1 50 PHE QE 4.200 . 6.000 3.927 3.920 3.935 . 0 0 "[ . 1 . 2]" 1
586 1 50 PHE QB 1 51 PHE H 3.300 . 4.700 2.701 2.161 3.416 . 0 0 "[ . 1 . 2]" 1
587 1 50 PHE QB 1 54 VAL QG 5.000 . 6.000 4.125 3.543 5.129 . 0 0 "[ . 1 . 2]" 1
588 1 50 PHE QE 1 51 PHE HA 3.900 . 5.800 4.837 4.263 5.774 . 0 0 "[ . 1 . 2]" 1
589 1 50 PHE QE 1 55 ALA MB 2.600 . 6.000 3.124 2.817 3.590 . 0 0 "[ . 1 . 2]" 1
590 1 50 PHE QE 1 58 THR MG 2.600 . 6.000 2.216 1.606 2.953 . 0 0 "[ . 1 . 2]" 1
591 1 50 PHE HZ 1 55 ALA MB 2.900 . 6.000 3.519 3.032 4.036 . 0 0 "[ . 1 . 2]" 1
592 1 50 PHE HZ 1 58 THR MG 2.900 . 6.000 3.628 2.841 4.171 . 0 0 "[ . 1 . 2]" 1
593 1 50 PHE HZ 1 110 VAL QG 5.800 . 6.000 4.380 3.313 5.420 . 0 0 "[ . 1 . 2]" 1
594 1 51 PHE H 1 51 PHE QB 3.000 . 4.200 2.508 2.415 2.792 . 0 0 "[ . 1 . 2]" 1
595 1 51 PHE H 1 52 LYS H 2.800 . 3.700 2.639 2.011 2.984 . 0 0 "[ . 1 . 2]" 1
596 1 51 PHE H 1 53 ASP H 4.300 . 6.000 4.228 3.482 4.556 . 0 0 "[ . 1 . 2]" 1
597 1 51 PHE HA 1 51 PHE QB 2.000 . 2.500 2.330 2.172 2.361 . 0 0 "[ . 1 . 2]" 1
598 1 51 PHE HA 1 51 PHE QD 3.000 . 4.100 2.949 2.674 3.719 . 0 0 "[ . 1 . 2]" 1
599 1 51 PHE HA 1 52 LYS H 3.800 . 5.600 3.173 2.923 3.427 . 0 0 "[ . 1 . 2]" 1
600 1 51 PHE HA 1 53 ASP H 4.800 . 6.000 5.090 4.679 5.613 . 0 0 "[ . 1 . 2]" 1
601 1 51 PHE HA 1 55 ALA H 5.500 . 6.000 4.775 4.253 5.536 . 0 0 "[ . 1 . 2]" 1
602 1 51 PHE HA 1 58 THR H 3.500 . 5.000 3.975 3.419 4.989 . 0 0 "[ . 1 . 2]" 1
603 1 51 PHE HA 1 58 THR HA 3.000 . 6.000 5.214 4.554 6.132 0.132 9 0 "[ . 1 . 2]" 1
604 1 51 PHE HA 1 59 ASP H 3.300 . 4.600 3.564 2.865 4.378 . 0 0 "[ . 1 . 2]" 1
605 1 51 PHE QB 1 51 PHE QD 3.400 . 4.800 2.125 2.119 2.130 . 0 0 "[ . 1 . 2]" 1
606 1 51 PHE QB 1 52 LYS H 3.100 . 4.300 3.542 3.058 4.010 . 0 0 "[ . 1 . 2]" 1
607 1 51 PHE QB 1 53 ASP H 3.800 . 5.600 5.263 4.818 5.648 0.048 8 0 "[ . 1 . 2]" 1
608 1 51 PHE QB 1 64 TYR QE 3.700 . 5.400 4.133 3.385 4.926 . 0 0 "[ . 1 . 2]" 1
609 1 51 PHE QD 1 60 SER H 6.000 . 6.000 4.131 3.596 5.369 . 0 0 "[ . 1 . 2]" 1
610 1 52 LYS H 1 52 LYS HB2 2.700 . 3.600 2.912 2.463 3.369 . 0 0 "[ . 1 . 2]" 1
611 1 52 LYS H 1 52 LYS HB3 3.000 . 4.100 3.353 2.704 3.866 . 0 0 "[ . 1 . 2]" 1
612 1 52 LYS H 1 52 LYS QD 3.700 . 5.500 4.521 3.935 5.295 . 0 0 "[ . 1 . 2]" 1
613 1 52 LYS H 1 52 LYS QE 4.200 . 6.000 4.907 4.144 6.055 0.055 15 0 "[ . 1 . 2]" 1
614 1 52 LYS H 1 52 LYS QG 3.700 . 5.400 3.696 2.922 4.400 . 0 0 "[ . 1 . 2]" 1
615 1 52 LYS H 1 53 ASP H 2.400 . 3.100 2.054 1.861 2.312 . 0 0 "[ . 1 . 2]" 1
616 1 52 LYS H 1 53 ASP HA 4.700 . 6.000 4.653 4.470 4.825 . 0 0 "[ . 1 . 2]" 1
617 1 52 LYS H 1 54 VAL H 3.600 . 5.200 3.671 2.920 4.462 . 0 0 "[ . 1 . 2]" 1
618 1 52 LYS H 1 56 PRO HD3 6.000 . 6.000 5.957 5.530 6.058 0.058 9 0 "[ . 1 . 2]" 1
619 1 52 LYS HA 1 52 LYS HB3 2.300 . 2.900 2.758 2.461 3.023 0.123 6 0 "[ . 1 . 2]" 1
620 1 52 LYS HA 1 52 LYS QD 2.800 . 3.800 3.081 1.863 4.096 0.296 10 0 "[ . 1 . 2]" 1
621 1 52 LYS HA 1 53 ASP H 3.300 . 4.600 3.555 3.475 3.593 . 0 0 "[ . 1 . 2]" 1
622 1 52 LYS HB2 1 53 ASP H 3.300 . 4.700 3.146 2.300 3.837 . 0 0 "[ . 1 . 2]" 1
623 1 52 LYS HB3 1 53 ASP H 2.800 . 3.800 2.971 2.163 3.809 0.009 17 0 "[ . 1 . 2]" 1
624 1 52 LYS HB3 1 54 VAL H 3.200 . 6.000 5.480 4.239 6.506 0.506 4 1 "[ +. 1 . 2]" 1
625 1 52 LYS QD 1 53 ASP H 3.500 . 5.000 4.568 3.175 5.113 0.113 8 0 "[ . 1 . 2]" 1
626 1 52 LYS QG 1 53 ASP H 4.300 . 6.000 4.017 3.339 4.430 . 0 0 "[ . 1 . 2]" 1
627 1 53 ASP H 1 53 ASP HA 2.500 . 3.300 2.895 2.831 2.943 . 0 0 "[ . 1 . 2]" 1
628 1 53 ASP H 1 53 ASP QB 2.600 . 3.400 2.325 2.099 2.492 . 0 0 "[ . 1 . 2]" 1
629 1 53 ASP H 1 54 VAL H 2.300 . 3.000 2.688 2.162 3.029 0.029 4 0 "[ . 1 . 2]" 1
630 1 53 ASP H 1 54 VAL HA 4.300 . 6.000 5.171 4.831 5.368 . 0 0 "[ . 1 . 2]" 1
631 1 53 ASP H 1 54 VAL HB 4.100 . 6.000 5.360 4.656 6.110 0.110 8 0 "[ . 1 . 2]" 1
632 1 53 ASP H 1 54 VAL QG 4.300 . 5.600 3.773 2.924 4.434 . 0 0 "[ . 1 . 2]" 1
633 1 53 ASP H 1 55 ALA H 3.700 . 5.400 3.663 3.320 4.082 . 0 0 "[ . 1 . 2]" 1
634 1 53 ASP HA 1 54 VAL H 3.300 . 4.700 3.527 3.461 3.577 . 0 0 "[ . 1 . 2]" 1
635 1 53 ASP HA 1 55 ALA H 4.200 . 6.000 4.197 3.851 4.656 . 0 0 "[ . 1 . 2]" 1
636 1 53 ASP QB 1 54 VAL H 2.600 . 3.500 2.377 1.864 3.070 . 0 0 "[ . 1 . 2]" 1
637 1 53 ASP QB 1 54 VAL QG 2.700 . 6.000 2.594 1.989 3.393 . 0 0 "[ . 1 . 2]" 1
638 1 53 ASP QB 1 55 ALA H 3.300 . 4.700 4.304 3.830 4.718 0.018 7 0 "[ . 1 . 2]" 1
639 1 54 VAL H 1 54 VAL HA 2.700 . 3.600 2.922 2.856 2.955 . 0 0 "[ . 1 . 2]" 1
640 1 54 VAL H 1 54 VAL HB 2.500 . 3.300 2.852 2.311 3.551 0.251 2 0 "[ . 1 . 2]" 1
641 1 54 VAL H 1 54 VAL QG . . 3.400 1.967 1.706 2.315 0.094 18 0 "[ . 1 . 2]" 1
642 1 54 VAL H 1 55 ALA H 2.600 . 3.400 2.443 1.888 2.798 . 0 0 "[ . 1 . 2]" 1
643 1 54 VAL H 1 55 ALA MB 6.000 . 6.000 4.037 3.755 4.313 . 0 0 "[ . 1 . 2]" 1
644 1 54 VAL HA 1 54 VAL QG 1.900 . 6.000 2.042 1.979 2.135 . 0 0 "[ . 1 . 2]" 1
645 1 54 VAL HA 1 55 ALA H 3.100 . 4.300 3.082 2.774 3.133 . 0 0 "[ . 1 . 2]" 1
646 1 54 VAL HB 1 55 ALA H 2.900 . 4.000 3.903 3.628 4.257 0.257 9 0 "[ . 1 . 2]" 1
647 1 54 VAL QG 1 55 ALA H . . 4.500 3.338 3.045 3.613 . 0 0 "[ . 1 . 2]" 1
648 1 55 ALA H 1 55 ALA HA 2.900 . 4.000 2.812 2.732 2.880 . 0 0 "[ . 1 . 2]" 1
649 1 55 ALA H 1 55 ALA MB 4.100 . 6.000 2.898 2.768 3.013 . 0 0 "[ . 1 . 2]" 1
650 1 55 ALA H 1 56 PRO HD3 4.000 . 6.000 2.766 2.419 3.113 . 0 0 "[ . 1 . 2]" 1
651 1 55 ALA HA 1 55 ALA MB 2.300 . 3.000 2.131 2.123 2.136 . 0 0 "[ . 1 . 2]" 1
652 1 55 ALA HA 1 56 PRO HD2 2.700 . 3.600 2.533 1.988 2.802 . 0 0 "[ . 1 . 2]" 1
653 1 55 ALA HA 1 56 PRO HD3 2.700 . 3.600 2.359 2.063 3.028 . 0 0 "[ . 1 . 2]" 1
654 1 55 ALA HA 1 57 CYS H 3.800 . 5.600 3.310 3.007 3.592 . 0 0 "[ . 1 . 2]" 1
655 1 55 ALA HA 1 86 TYR QD 3.900 . 5.800 3.759 2.746 4.459 . 0 0 "[ . 1 . 2]" 1
656 1 55 ALA MB 1 56 PRO HA 6.000 . 6.000 4.445 4.358 4.565 . 0 0 "[ . 1 . 2]" 1
657 1 55 ALA MB 1 56 PRO HD3 6.000 . 6.000 3.867 3.729 4.272 . 0 0 "[ . 1 . 2]" 1
658 1 55 ALA MB 1 57 CYS H 6.000 . 6.000 3.358 3.018 3.700 . 0 0 "[ . 1 . 2]" 1
659 1 55 ALA MB 1 58 THR H 4.400 . 6.000 3.613 2.809 4.516 . 0 0 "[ . 1 . 2]" 1
660 1 55 ALA MB 1 58 THR HB 4.400 . 6.000 3.594 2.695 4.565 . 0 0 "[ . 1 . 2]" 1
661 1 55 ALA MB 1 58 THR MG 2.800 . 6.000 2.593 1.962 3.535 . 0 0 "[ . 1 . 2]" 1
662 1 55 ALA MB 1 84 PHE QE 3.400 . 6.000 4.230 3.151 4.948 . 0 0 "[ . 1 . 2]" 1
663 1 56 PRO HA 1 57 CYS H 3.400 . 4.900 3.334 3.019 3.523 . 0 0 "[ . 1 . 2]" 1
664 1 56 PRO HA 1 59 ASP H 2.800 . 3.800 3.871 3.678 4.064 0.264 9 0 "[ . 1 . 2]" 1
665 1 56 PRO QB 1 56 PRO HD2 3.200 . 4.500 3.210 2.847 3.530 . 0 0 "[ . 1 . 2]" 1
666 1 56 PRO HD2 1 56 PRO QG 3.100 . 4.300 2.213 2.178 2.256 . 0 0 "[ . 1 . 2]" 1
667 1 56 PRO HD3 1 56 PRO QG 3.500 . 5.000 2.192 2.173 2.242 . 0 0 "[ . 1 . 2]" 1
668 1 56 PRO HD3 1 57 CYS H 3.200 . 4.400 3.855 3.459 4.244 . 0 0 "[ . 1 . 2]" 1
669 1 56 PRO QG 1 57 CYS H 3.100 . 4.300 3.781 2.812 4.342 0.042 16 0 "[ . 1 . 2]" 1
670 1 57 CYS H 1 57 CYS HA 3.000 . 4.100 2.893 2.753 2.950 . 0 0 "[ . 1 . 2]" 1
671 1 57 CYS H 1 57 CYS QB 2.800 . 3.800 2.556 2.364 2.940 . 0 0 "[ . 1 . 2]" 1
672 1 57 CYS H 1 58 THR H 3.000 . 4.100 2.462 2.184 2.929 . 0 0 "[ . 1 . 2]" 1
673 1 57 CYS H 1 58 THR MG 4.200 . 6.000 4.031 2.744 5.464 . 0 0 "[ . 1 . 2]" 1
674 1 57 CYS H 1 59 ASP H 4.200 . 6.000 4.493 4.170 4.953 . 0 0 "[ . 1 . 2]" 1
675 1 57 CYS H 1 87 GLN QG 6.000 . 6.000 5.825 5.303 6.260 0.260 11 0 "[ . 1 . 2]" 1
676 1 57 CYS HA 1 59 ASP H 3.300 . 4.700 4.538 3.869 4.850 0.150 2 0 "[ . 1 . 2]" 1
677 1 57 CYS QB 1 58 THR H 4.200 . 6.000 3.696 2.889 4.054 . 0 0 "[ . 1 . 2]" 1
678 1 57 CYS HB2 1 58 THR H 6.000 . 6.000 4.175 2.969 4.639 . 0 0 "[ . 1 . 2]" 1
679 1 57 CYS HB2 1 85 ASP QB 5.300 . 6.000 4.995 2.426 5.870 . 0 0 "[ . 1 . 2]" 1
680 1 58 THR H 1 58 THR HA 3.000 . 4.200 2.881 2.791 2.941 . 0 0 "[ . 1 . 2]" 1
681 1 58 THR H 1 58 THR HB 2.700 . 3.600 2.969 2.383 3.595 . 0 0 "[ . 1 . 2]" 1
682 1 58 THR H 1 58 THR MG 2.700 . 3.600 3.012 1.899 3.738 0.138 5 0 "[ . 1 . 2]" 1
683 1 58 THR H 1 59 ASP H 2.500 . 3.300 2.314 1.995 2.671 . 0 0 "[ . 1 . 2]" 1
684 1 58 THR HA 1 59 ASP H 3.300 . 4.700 3.510 3.328 3.568 . 0 0 "[ . 1 . 2]" 1
685 1 58 THR HA 1 63 PHE QD 3.300 . 4.700 3.649 2.044 4.624 . 0 0 "[ . 1 . 2]" 1
686 1 58 THR MG 1 59 ASP H 3.700 . 5.400 3.706 2.195 4.183 . 0 0 "[ . 1 . 2]" 1
687 1 58 THR MG 1 63 PHE QD 3.000 . 6.000 3.196 2.180 4.639 . 0 0 "[ . 1 . 2]" 1
688 1 58 THR MG 1 84 PHE QE 2.700 . 6.000 2.515 1.572 4.163 . 0 0 "[ . 1 . 2]" 1
689 1 59 ASP H 1 59 ASP HA 2.800 . 3.800 2.843 2.762 2.891 . 0 0 "[ . 1 . 2]" 1
690 1 59 ASP H 1 59 ASP HB2 3.900 . 5.800 2.883 2.372 3.671 . 0 0 "[ . 1 . 2]" 1
691 1 59 ASP H 1 59 ASP HB3 4.300 . 6.000 2.600 2.431 3.607 . 0 0 "[ . 1 . 2]" 1
692 1 59 ASP H 1 60 SER H 3.500 . 5.000 3.613 3.321 3.879 . 0 0 "[ . 1 . 2]" 1
693 1 59 ASP H 1 60 SER HB2 4.100 . 6.000 5.512 4.590 6.801 0.801 9 3 "[ - * +1 . 2]" 1
694 1 59 ASP HA 1 60 SER H 2.300 . 2.900 2.164 2.084 2.247 . 0 0 "[ . 1 . 2]" 1
695 1 59 ASP HA 1 64 TYR H 3.800 . 5.600 3.586 3.279 3.860 . 0 0 "[ . 1 . 2]" 1
696 1 59 ASP HA 1 64 TYR QD 3.900 . 5.800 3.672 3.033 4.120 . 0 0 "[ . 1 . 2]" 1
697 1 59 ASP HA 1 65 GLY H 3.200 . 6.000 5.199 4.695 5.596 . 0 0 "[ . 1 . 2]" 1
698 1 59 ASP HB2 1 60 SER H 4.200 . 6.000 4.232 3.383 4.598 . 0 0 "[ . 1 . 2]" 1
699 1 59 ASP HB2 1 61 PRO HG3 1.700 . 6.000 5.020 3.669 6.796 0.796 12 1 "[ . 1 + . 2]" 1
700 1 59 ASP HB2 1 63 PHE QD 4.200 . 6.000 6.217 5.695 6.749 0.749 13 5 "[ * . 1 -+ . * *]" 1
701 1 59 ASP HB3 1 60 SER H 3.400 . 4.800 4.353 3.154 4.556 . 0 0 "[ . 1 . 2]" 1
702 1 60 SER H 1 60 SER HA 2.600 . 3.400 2.855 2.771 2.916 . 0 0 "[ . 1 . 2]" 1
703 1 60 SER H 1 60 SER HB2 3.200 . 4.500 3.358 2.839 4.062 . 0 0 "[ . 1 . 2]" 1
704 1 60 SER H 1 60 SER HB3 3.300 . 4.600 3.642 2.817 4.015 . 0 0 "[ . 1 . 2]" 1
705 1 60 SER H 1 61 PRO QD 5.300 . 6.000 4.253 4.081 4.366 . 0 0 "[ . 1 . 2]" 1
706 1 60 SER H 1 63 PHE H 3.600 . 5.200 3.894 3.595 4.398 . 0 0 "[ . 1 . 2]" 1
707 1 60 SER H 1 64 TYR H 2.700 . 3.600 2.332 2.059 2.567 . 0 0 "[ . 1 . 2]" 1
708 1 60 SER H 1 64 TYR HA 4.300 . 6.000 4.241 3.893 4.637 . 0 0 "[ . 1 . 2]" 1
709 1 60 SER H 1 64 TYR HB3 2.700 . 3.600 1.999 1.689 2.394 0.111 2 0 "[ . 1 . 2]" 1
710 1 60 SER H 1 65 GLY H 4.000 . 6.000 3.561 3.260 3.996 . 0 0 "[ . 1 . 2]" 1
711 1 60 SER H 1 66 LYS H 4.700 . 6.000 5.971 5.701 6.202 0.202 13 0 "[ . 1 . 2]" 1
712 1 60 SER H 1 68 LYS HD3 6.000 . 6.000 6.104 5.986 6.287 0.287 11 0 "[ . 1 . 2]" 1
713 1 60 SER HA 1 60 SER HB2 2.600 . 3.400 2.769 2.422 3.040 . 0 0 "[ . 1 . 2]" 1
714 1 60 SER HA 1 60 SER HB3 2.400 . 3.100 2.611 2.419 3.041 . 0 0 "[ . 1 . 2]" 1
715 1 60 SER HA 1 61 PRO QD 2.100 . 2.600 2.055 1.931 2.423 . 0 0 "[ . 1 . 2]" 1
716 1 60 SER HA 1 62 GLU H 3.600 . 5.300 4.211 3.896 4.526 . 0 0 "[ . 1 . 2]" 1
717 1 60 SER HA 1 63 PHE H 4.200 . 6.000 4.758 4.416 5.680 . 0 0 "[ . 1 . 2]" 1
718 1 60 SER HB3 1 63 PHE H 3.500 . 5.000 3.683 2.249 4.570 . 0 0 "[ . 1 . 2]" 1
719 1 60 SER HB3 1 64 TYR H 3.500 . 5.100 4.177 2.708 4.788 . 0 0 "[ . 1 . 2]" 1
720 1 61 PRO QB 1 61 PRO QG 2.000 . 2.500 1.971 1.948 1.978 . 0 0 "[ . 1 . 2]" 1
721 1 61 PRO HB2 1 66 LYS HB3 2.600 . 6.000 5.209 3.513 6.132 0.132 12 0 "[ . 1 . 2]" 1
722 1 61 PRO QD 1 61 PRO QG 2.300 . 3.000 1.969 1.952 1.978 . 0 0 "[ . 1 . 2]" 1
723 1 62 GLU H 1 62 GLU HA 2.900 . 4.000 2.893 2.785 2.924 . 0 0 "[ . 1 . 2]" 1
724 1 62 GLU H 1 62 GLU HB2 3.300 . 4.700 3.526 2.378 3.716 . 0 0 "[ . 1 . 2]" 1
725 1 62 GLU H 1 62 GLU HB3 2.900 . 3.900 2.940 2.693 3.601 . 0 0 "[ . 1 . 2]" 1
726 1 62 GLU H 1 62 GLU HG2 2.700 . 3.600 2.352 1.778 3.965 0.365 16 0 "[ . 1 . 2]" 1
727 1 62 GLU H 1 62 GLU HG3 2.900 . 3.900 3.255 2.838 3.812 . 0 0 "[ . 1 . 2]" 1
728 1 62 GLU H 1 63 PHE H 2.500 . 3.300 2.503 2.271 3.236 . 0 0 "[ . 1 . 2]" 1
729 1 62 GLU H 1 63 PHE HA 3.900 . 5.800 5.112 4.966 5.571 . 0 0 "[ . 1 . 2]" 1
730 1 62 GLU H 1 63 PHE QD 6.000 . 6.000 4.459 3.860 4.892 . 0 0 "[ . 1 . 2]" 1
731 1 62 GLU H 1 65 GLY H 4.000 . 6.000 4.175 3.799 4.418 . 0 0 "[ . 1 . 2]" 1
732 1 62 GLU H 1 66 LYS QE 4.100 . 6.000 5.398 4.467 6.052 0.052 7 0 "[ . 1 . 2]" 1
733 1 62 GLU HA 1 63 PHE H 3.200 . 4.500 3.411 3.149 3.605 . 0 0 "[ . 1 . 2]" 1
734 1 62 GLU HB2 1 63 PHE H 5.000 . 6.000 3.852 1.913 4.331 . 0 0 "[ . 1 . 2]" 1
735 1 62 GLU HB2 1 66 LYS H 3.900 . 5.800 5.352 4.031 6.048 0.248 11 0 "[ . 1 . 2]" 1
736 1 62 GLU HB3 1 63 PHE H 3.700 . 5.400 4.141 2.384 4.585 . 0 0 "[ . 1 . 2]" 1
737 1 62 GLU HG2 1 63 PHE H 3.700 . 5.400 3.181 1.962 4.781 0.038 13 0 "[ . 1 . 2]" 1
738 1 62 GLU HG2 1 82 TYR QE 2.500 . 3.300 3.070 2.455 3.345 0.045 3 0 "[ . 1 . 2]" 1
739 1 62 GLU HG3 1 63 PHE H 3.300 . 4.700 3.571 1.841 4.677 0.059 17 0 "[ . 1 . 2]" 1
740 1 62 GLU HG3 1 82 TYR QE 2.400 . 3.100 2.323 1.669 3.327 0.227 16 0 "[ . 1 . 2]" 1
741 1 63 PHE H 1 63 PHE QB 2.600 . 3.400 2.527 2.221 2.711 . 0 0 "[ . 1 . 2]" 1
742 1 63 PHE H 1 64 TYR H 2.700 . 3.600 2.648 2.469 2.947 . 0 0 "[ . 1 . 2]" 1
743 1 63 PHE H 1 64 TYR HB2 4.700 . 6.000 5.082 4.830 5.421 . 0 0 "[ . 1 . 2]" 1
744 1 63 PHE H 1 64 TYR HB3 4.100 . 6.000 4.530 4.071 5.188 . 0 0 "[ . 1 . 2]" 1
745 1 63 PHE H 1 65 GLY H 3.000 . 4.100 3.118 2.583 4.003 . 0 0 "[ . 1 . 2]" 1
746 1 63 PHE H 1 66 LYS H 3.300 . 4.700 3.947 3.226 4.712 0.012 16 0 "[ . 1 . 2]" 1
747 1 63 PHE H 1 66 LYS QG 3.700 . 5.400 4.307 3.407 4.944 . 0 0 "[ . 1 . 2]" 1
748 1 63 PHE H 1 69 GLU HB2 5.600 . 6.000 5.200 5.002 5.571 . 0 0 "[ . 1 . 2]" 1
749 1 63 PHE HA 1 65 GLY H 5.300 . 6.000 4.519 4.263 4.651 . 0 0 "[ . 1 . 2]" 1
750 1 63 PHE QB 1 63 PHE QD 3.100 . 4.300 2.130 2.118 2.159 . 0 0 "[ . 1 . 2]" 1
751 1 63 PHE QB 1 64 TYR H 2.800 . 3.800 1.963 1.756 2.358 0.044 20 0 "[ . 1 . 2]" 1
752 1 63 PHE QB 1 80 PHE QE 4.300 . 6.000 4.119 2.855 6.174 0.174 20 0 "[ . 1 . 2]" 1
753 1 64 TYR H 1 64 TYR HA 2.600 . 3.500 2.807 2.766 2.841 . 0 0 "[ . 1 . 2]" 1
754 1 64 TYR H 1 64 TYR HB2 2.700 . 3.600 2.524 2.435 2.598 . 0 0 "[ . 1 . 2]" 1
755 1 64 TYR H 1 64 TYR HB3 2.800 . 3.800 2.520 2.437 2.635 . 0 0 "[ . 1 . 2]" 1
756 1 64 TYR H 1 65 GLY H 3.100 . 4.300 2.644 2.512 2.775 . 0 0 "[ . 1 . 2]" 1
757 1 64 TYR H 1 66 LYS H 3.500 . 5.100 4.213 4.053 4.420 . 0 0 "[ . 1 . 2]" 1
758 1 64 TYR HA 1 66 LYS H 3.400 . 4.800 4.245 3.978 4.583 . 0 0 "[ . 1 . 2]" 1
759 1 64 TYR HA 1 68 LYS H 3.900 . 5.800 4.129 3.799 4.736 . 0 0 "[ . 1 . 2]" 1
760 1 64 TYR HB2 1 64 TYR QD 2.600 . 3.400 2.579 2.492 2.708 . 0 0 "[ . 1 . 2]" 1
761 1 64 TYR HB2 1 65 GLY H 3.700 . 5.400 3.927 3.845 3.999 . 0 0 "[ . 1 . 2]" 1
762 1 64 TYR HB3 1 64 TYR QD 2.600 . 3.400 2.294 2.267 2.329 . 0 0 "[ . 1 . 2]" 1
763 1 64 TYR QD 1 65 GLY H 5.400 . 6.000 3.874 3.568 4.260 . 0 0 "[ . 1 . 2]" 1
764 1 64 TYR QD 1 67 PHE HB2 3.700 . 5.400 4.393 3.599 4.816 . 0 0 "[ . 1 . 2]" 1
765 1 64 TYR QD 1 67 PHE HB3 3.000 . 4.100 3.418 2.693 3.787 . 0 0 "[ . 1 . 2]" 1
766 1 64 TYR QD 1 67 PHE QD 2.900 . 4.000 3.416 2.678 3.910 . 0 0 "[ . 1 . 2]" 1
767 1 64 TYR QD 1 68 LYS H 5.400 . 6.000 4.878 4.555 5.265 . 0 0 "[ . 1 . 2]" 1
768 1 64 TYR QD 1 68 LYS HD3 4.000 . 6.000 3.149 3.011 3.366 . 0 0 "[ . 1 . 2]" 1
769 1 64 TYR QE 1 65 GLY HA2 4.600 . 6.000 5.180 4.769 5.606 . 0 0 "[ . 1 . 2]" 1
770 1 64 TYR QE 1 67 PHE HZ 2.500 . 6.000 5.684 4.816 6.048 0.048 1 0 "[ . 1 . 2]" 1
771 1 64 TYR QE 1 68 LYS QB 4.000 . 6.000 4.514 4.172 4.917 . 0 0 "[ . 1 . 2]" 1
772 1 64 TYR QE 1 68 LYS HD3 3.000 . 4.100 2.541 2.098 3.078 . 0 0 "[ . 1 . 2]" 1
773 1 65 GLY H 1 65 GLY HA2 2.300 . 3.000 2.806 2.781 2.833 . 0 0 "[ . 1 . 2]" 1
774 1 65 GLY H 1 65 GLY HA3 2.800 . 3.800 2.293 2.287 2.299 . 0 0 "[ . 1 . 2]" 1
775 1 65 GLY H 1 66 LYS H 2.900 . 3.900 2.736 2.644 2.855 . 0 0 "[ . 1 . 2]" 1
776 1 65 GLY H 1 66 LYS QD 4.600 . 6.000 4.878 4.363 5.141 . 0 0 "[ . 1 . 2]" 1
777 1 65 GLY H 1 66 LYS QG 4.700 . 6.000 4.477 4.112 4.834 . 0 0 "[ . 1 . 2]" 1
778 1 65 GLY HA2 1 66 LYS H 4.300 . 6.000 3.533 3.489 3.573 . 0 0 "[ . 1 . 2]" 1
779 1 65 GLY HA3 1 67 PHE H 3.900 . 5.800 4.657 4.479 4.799 . 0 0 "[ . 1 . 2]" 1
780 1 66 LYS H 1 66 LYS HA 2.500 . 3.300 2.874 2.833 2.904 . 0 0 "[ . 1 . 2]" 1
781 1 66 LYS H 1 66 LYS HB2 2.800 . 3.800 2.456 2.303 2.656 . 0 0 "[ . 1 . 2]" 1
782 1 66 LYS H 1 66 LYS HB3 2.900 . 4.000 3.613 3.565 3.678 . 0 0 "[ . 1 . 2]" 1
783 1 66 LYS H 1 66 LYS QD 6.000 . 6.000 3.617 3.127 4.213 . 0 0 "[ . 1 . 2]" 1
784 1 66 LYS H 1 66 LYS QE 4.300 . 6.000 4.192 3.038 5.048 . 0 0 "[ . 1 . 2]" 1
785 1 66 LYS H 1 66 LYS QG 2.400 . 3.100 2.422 2.109 2.724 . 0 0 "[ . 1 . 2]" 1
786 1 66 LYS H 1 67 PHE H 2.500 . 3.300 2.415 2.258 2.579 . 0 0 "[ . 1 . 2]" 1
787 1 66 LYS H 1 67 PHE HB2 6.000 . 6.000 4.801 4.560 5.008 . 0 0 "[ . 1 . 2]" 1
788 1 66 LYS H 1 67 PHE QB 4.800 . 6.000 4.115 3.919 4.254 . 0 0 "[ . 1 . 2]" 1
789 1 66 LYS H 1 67 PHE HB3 6.000 . 6.000 4.479 4.265 4.630 . 0 0 "[ . 1 . 2]" 1
790 1 66 LYS H 1 68 LYS H 3.700 . 5.400 3.897 3.605 4.065 . 0 0 "[ . 1 . 2]" 1
791 1 66 LYS H 1 69 GLU H 4.200 . 6.000 4.588 4.306 5.046 . 0 0 "[ . 1 . 2]" 1
792 1 66 LYS H 1 69 GLU QB 4.100 . 6.000 4.622 4.055 5.786 . 0 0 "[ . 1 . 2]" 1
793 1 66 LYS HA 1 68 LYS H 3.000 . 4.100 4.047 3.701 4.179 0.079 8 0 "[ . 1 . 2]" 1
794 1 66 LYS HA 1 69 GLU HB2 1.700 . 2.200 1.948 1.568 2.162 . 0 0 "[ . 1 . 2]" 1
795 1 66 LYS HB2 1 67 PHE H 3.000 . 4.200 2.792 2.633 3.055 . 0 0 "[ . 1 . 2]" 1
796 1 66 LYS HB3 1 67 PHE H 3.500 . 5.000 3.750 3.497 3.954 . 0 0 "[ . 1 . 2]" 1
797 1 66 LYS HB3 1 68 LYS H 4.100 . 6.000 5.474 5.155 5.667 . 0 0 "[ . 1 . 2]" 1
798 1 66 LYS QD 1 67 PHE H 4.300 . 6.000 4.805 4.528 5.346 . 0 0 "[ . 1 . 2]" 1
799 1 66 LYS QE 1 66 LYS QG 2.200 . 2.800 2.187 2.112 2.343 . 0 0 "[ . 1 . 2]" 1
800 1 66 LYS QG 1 67 PHE H 4.300 . 6.000 4.114 3.869 4.319 . 0 0 "[ . 1 . 2]" 1
801 1 66 LYS QG 1 80 PHE QD 2.900 . 4.000 3.817 3.074 4.119 0.119 10 0 "[ . 1 . 2]" 1
802 1 67 PHE H 1 67 PHE HA 2.700 . 3.600 2.804 2.784 2.844 . 0 0 "[ . 1 . 2]" 1
803 1 67 PHE H 1 67 PHE QB 2.700 . 3.600 2.225 2.180 2.268 . 0 0 "[ . 1 . 2]" 1
804 1 67 PHE H 1 67 PHE HB3 4.500 . 6.000 2.448 2.377 2.516 . 0 0 "[ . 1 . 2]" 1
805 1 67 PHE H 1 68 LYS H 2.700 . 3.600 2.641 2.492 2.716 . 0 0 "[ . 1 . 2]" 1
806 1 67 PHE H 1 68 LYS QD 4.200 . 6.000 5.390 4.290 5.871 . 0 0 "[ . 1 . 2]" 1
807 1 67 PHE H 1 68 LYS HD2 6.000 . 6.000 4.224 3.848 4.836 . 0 0 "[ . 1 . 2]" 1
808 1 67 PHE HA 1 67 PHE HB2 2.700 . 3.600 2.435 2.406 2.476 . 0 0 "[ . 1 . 2]" 1
809 1 67 PHE HA 1 67 PHE HZ 4.100 . 6.000 6.094 6.042 6.150 0.150 14 0 "[ . 1 . 2]" 1
810 1 67 PHE HA 1 69 GLU H 2.900 . 4.000 4.013 3.694 4.110 0.110 12 0 "[ . 1 . 2]" 1
811 1 67 PHE HA 1 70 GLY H 3.700 . 5.500 4.310 3.841 4.963 . 0 0 "[ . 1 . 2]" 1
812 1 67 PHE QB 1 68 LYS H 2.800 . 3.800 2.612 2.327 2.954 . 0 0 "[ . 1 . 2]" 1
813 1 67 PHE HB2 1 67 PHE QD 2.300 . 2.900 2.448 2.327 2.553 . 0 0 "[ . 1 . 2]" 1
814 1 67 PHE HB2 1 68 LYS H 6.000 . 6.000 3.920 3.702 4.133 . 0 0 "[ . 1 . 2]" 1
815 1 67 PHE HB3 1 67 PHE QD 2.200 . 2.800 2.337 2.262 2.459 . 0 0 "[ . 1 . 2]" 1
816 1 67 PHE HB3 1 68 LYS H 4.700 . 6.000 2.653 2.352 3.025 . 0 0 "[ . 1 . 2]" 1
817 1 67 PHE QD 1 68 LYS HA 3.100 . 4.300 3.507 2.907 4.081 . 0 0 "[ . 1 . 2]" 1
818 1 67 PHE QD 1 68 LYS QD 2.500 . 3.300 2.119 1.840 2.471 . 0 0 "[ . 1 . 2]" 1
819 1 67 PHE QD 1 71 VAL MG2 3.000 . 6.000 3.702 3.013 4.481 . 0 0 "[ . 1 . 2]" 1
820 1 67 PHE QE 1 71 VAL MG2 2.800 . 6.000 3.561 2.663 4.545 . 0 0 "[ . 1 . 2]" 1
821 1 67 PHE QE 1 106 TYR HB2 3.900 . 5.800 2.935 2.232 3.572 . 0 0 "[ . 1 . 2]" 1
822 1 67 PHE QE 1 106 TYR HB3 5.800 . 6.000 4.150 3.035 4.931 . 0 0 "[ . 1 . 2]" 1
823 1 67 PHE HZ 1 68 LYS QD 3.900 . 5.800 4.995 4.533 5.406 . 0 0 "[ . 1 . 2]" 1
824 1 67 PHE HZ 1 71 VAL MG2 2.800 . 6.000 4.387 3.481 5.399 . 0 0 "[ . 1 . 2]" 1
825 1 68 LYS H 1 68 LYS HA 2.500 . 3.300 2.891 2.846 2.923 . 0 0 "[ . 1 . 2]" 1
826 1 68 LYS H 1 68 LYS QB 2.300 . 2.900 2.427 2.155 2.504 . 0 0 "[ . 1 . 2]" 1
827 1 68 LYS H 1 68 LYS QD 3.000 . 4.100 3.500 2.713 3.812 . 0 0 "[ . 1 . 2]" 1
828 1 68 LYS H 1 68 LYS QG 3.400 . 4.800 2.453 2.163 3.663 . 0 0 "[ . 1 . 2]" 1
829 1 68 LYS H 1 69 GLU H 2.500 . 3.300 2.386 2.241 2.580 . 0 0 "[ . 1 . 2]" 1
830 1 68 LYS H 1 69 GLU QB 4.300 . 6.000 4.161 3.909 4.687 . 0 0 "[ . 1 . 2]" 1
831 1 68 LYS H 1 97 MET QG 6.000 . 6.000 6.122 5.883 6.284 0.284 17 0 "[ . 1 . 2]" 1
832 1 68 LYS HA 1 68 LYS QD 2.500 . 3.300 1.933 1.830 2.112 . 0 0 "[ . 1 . 2]" 1
833 1 68 LYS HA 1 69 GLU H 3.000 . 4.100 3.370 3.281 3.451 . 0 0 "[ . 1 . 2]" 1
834 1 68 LYS HA 1 71 VAL H 2.900 . 3.900 3.229 2.806 3.489 . 0 0 "[ . 1 . 2]" 1
835 1 68 LYS HA 1 71 VAL MG1 3.000 . 6.000 3.849 3.377 4.262 . 0 0 "[ . 1 . 2]" 1
836 1 68 LYS HA 1 71 VAL MG2 2.400 . 6.000 2.345 2.065 2.686 . 0 0 "[ . 1 . 2]" 1
837 1 68 LYS HA 1 72 ALA H 3.700 . 5.400 3.818 3.184 4.046 . 0 0 "[ . 1 . 2]" 1
838 1 68 LYS QB 1 68 LYS QG 1.700 . 2.200 1.965 1.938 1.974 . 0 0 "[ . 1 . 2]" 1
839 1 68 LYS QB 1 69 GLU H 2.600 . 3.500 3.151 2.980 3.372 . 0 0 "[ . 1 . 2]" 1
840 1 68 LYS QB 1 69 GLU HA 4.700 . 6.000 3.972 3.885 4.073 . 0 0 "[ . 1 . 2]" 1
841 1 68 LYS QB 1 70 GLY H 5.200 . 6.000 4.982 4.767 5.233 . 0 0 "[ . 1 . 2]" 1
842 1 68 LYS QB 1 71 VAL H 4.200 . 6.000 4.382 3.023 4.855 . 0 0 "[ . 1 . 2]" 1
843 1 68 LYS HB2 1 70 GLY H 3.900 . 5.800 4.427 4.189 4.646 . 0 0 "[ . 1 . 2]" 1
844 1 68 LYS HD2 1 69 GLU H 4.000 . 6.000 5.034 4.676 5.208 . 0 0 "[ . 1 . 2]" 1
845 1 68 LYS HD2 1 70 GLY H 3.200 . 6.000 6.021 5.778 6.093 0.093 18 0 "[ . 1 . 2]" 1
846 1 68 LYS HD2 1 71 VAL H 3.400 . 4.900 4.877 4.729 5.009 0.109 12 0 "[ . 1 . 2]" 1
847 1 68 LYS QG 1 71 VAL H 3.100 . 6.000 5.764 5.367 6.009 0.009 12 0 "[ . 1 . 2]" 1
848 1 68 LYS QG 1 72 ALA H 3.000 . 6.000 5.766 5.163 6.060 0.060 7 0 "[ . 1 . 2]" 1
849 1 68 LYS HG2 1 69 GLU H 3.900 . 5.800 4.550 4.277 5.449 . 0 0 "[ . 1 . 2]" 1
850 1 69 GLU H 1 69 GLU HA 2.800 . 3.800 2.816 2.769 2.858 . 0 0 "[ . 1 . 2]" 1
851 1 69 GLU H 1 69 GLU QB 3.400 . 4.900 2.252 2.048 2.466 . 0 0 "[ . 1 . 2]" 1
852 1 69 GLU H 1 69 GLU HG2 4.500 . 6.000 4.023 2.328 4.601 . 0 0 "[ . 1 . 2]" 1
853 1 69 GLU H 1 69 GLU HG3 4.700 . 6.000 4.121 2.419 4.546 . 0 0 "[ . 1 . 2]" 1
854 1 69 GLU H 1 70 GLY H 2.700 . 3.600 2.671 2.503 2.887 . 0 0 "[ . 1 . 2]" 1
855 1 69 GLU HA 1 70 GLY H 3.500 . 5.000 3.534 3.504 3.574 . 0 0 "[ . 1 . 2]" 1
856 1 69 GLU HA 1 71 VAL H 3.700 . 5.400 4.596 4.246 4.938 . 0 0 "[ . 1 . 2]" 1
857 1 69 GLU HA 1 72 ALA MB 2.100 . 6.000 3.226 2.741 4.007 . 0 0 "[ . 1 . 2]" 1
858 1 69 GLU QB 1 69 GLU HG3 1.900 . 2.300 2.275 2.123 2.407 0.107 9 0 "[ . 1 . 2]" 1
859 1 69 GLU QB 1 70 GLY H 2.600 . 3.500 2.553 2.292 2.773 . 0 0 "[ . 1 . 2]" 1
860 1 69 GLU QB 1 72 ALA H 3.300 . 6.000 5.252 5.016 5.664 . 0 0 "[ . 1 . 2]" 1
861 1 69 GLU HB3 1 71 VAL H 3.800 . 5.600 5.107 4.610 5.783 0.183 14 0 "[ . 1 . 2]" 1
862 1 69 GLU HG2 1 70 GLY H 4.000 . 6.000 4.374 3.644 5.029 . 0 0 "[ . 1 . 2]" 1
863 1 69 GLU HG3 1 70 GLY H 4.700 . 6.000 4.691 3.455 5.201 . 0 0 "[ . 1 . 2]" 1
864 1 70 GLY H 1 70 GLY HA2 2.800 . 3.800 2.866 2.809 2.916 . 0 0 "[ . 1 . 2]" 1
865 1 70 GLY H 1 70 GLY HA3 2.500 . 3.300 2.313 2.294 2.349 . 0 0 "[ . 1 . 2]" 1
866 1 70 GLY H 1 71 VAL H 2.600 . 3.400 2.507 2.278 2.747 . 0 0 "[ . 1 . 2]" 1
867 1 70 GLY H 1 71 VAL MG2 4.300 . 6.000 3.490 3.189 3.748 . 0 0 "[ . 1 . 2]" 1
868 1 70 GLY H 1 76 LEU HA 4.500 . 6.000 4.757 3.857 6.243 0.243 9 0 "[ . 1 . 2]" 1
869 1 70 GLY HA2 1 71 VAL H 3.100 . 4.300 3.514 3.471 3.551 . 0 0 "[ . 1 . 2]" 1
870 1 70 GLY HA2 1 72 ALA H 4.100 . 6.000 4.584 4.319 4.902 . 0 0 "[ . 1 . 2]" 1
871 1 70 GLY HA2 1 73 SER H 3.900 . 5.800 3.606 3.341 4.109 . 0 0 "[ . 1 . 2]" 1
872 1 70 GLY HA2 1 75 ASN H 3.500 . 5.000 4.459 3.166 4.970 . 0 0 "[ . 1 . 2]" 1
873 1 70 GLY HA2 1 76 LEU H 4.700 . 6.000 5.070 3.475 5.840 . 0 0 "[ . 1 . 2]" 1
874 1 70 GLY HA3 1 71 VAL H 2.800 . 3.800 2.787 2.670 2.957 . 0 0 "[ . 1 . 2]" 1
875 1 70 GLY HA3 1 72 ALA H 4.400 . 6.000 4.903 4.673 5.120 . 0 0 "[ . 1 . 2]" 1
876 1 70 GLY HA3 1 76 LEU H 4.500 . 6.000 4.100 2.070 4.996 . 0 0 "[ . 1 . 2]" 1
877 1 71 VAL H 1 71 VAL HA 2.600 . 3.400 2.780 2.709 2.825 . 0 0 "[ . 1 . 2]" 1
878 1 71 VAL H 1 71 VAL HB 2.100 . 2.700 2.531 2.385 2.651 . 0 0 "[ . 1 . 2]" 1
879 1 71 VAL H 1 71 VAL MG1 3.500 . 5.100 3.677 3.664 3.695 . 0 0 "[ . 1 . 2]" 1
880 1 71 VAL H 1 71 VAL MG2 2.300 . 3.000 1.680 1.582 1.889 0.018 18 0 "[ . 1 . 2]" 1
881 1 71 VAL H 1 72 ALA H 2.500 . 3.300 2.839 2.681 3.146 . 0 0 "[ . 1 . 2]" 1
882 1 71 VAL H 1 73 SER H 3.500 . 5.100 4.129 3.843 4.736 . 0 0 "[ . 1 . 2]" 1
883 1 71 VAL H 1 76 LEU H 6.000 . 6.000 5.644 3.341 6.175 0.175 2 0 "[ . 1 . 2]" 1
884 1 71 VAL H 1 76 LEU HA 4.200 . 6.000 5.117 4.229 6.214 0.214 3 0 "[ . 1 . 2]" 1
885 1 71 VAL H 1 76 LEU HA 6.000 . 6.000 4.899 3.983 5.990 . 0 0 "[ . 1 . 2]" 1
886 1 71 VAL H 1 106 TYR QE 4.800 . 6.000 4.970 4.338 5.501 . 0 0 "[ . 1 . 2]" 1
887 1 71 VAL HA 1 72 ALA H 3.400 . 4.900 3.562 3.544 3.592 . 0 0 "[ . 1 . 2]" 1
888 1 71 VAL HA 1 74 GLY H 3.200 . 4.500 4.384 3.747 4.606 0.106 6 0 "[ . 1 . 2]" 1
889 1 71 VAL HB 1 71 VAL MG2 1.900 . 6.000 2.116 2.113 2.118 . 0 0 "[ . 1 . 2]" 1
890 1 71 VAL HB 1 72 ALA H 2.300 . 3.000 2.178 2.073 2.287 . 0 0 "[ . 1 . 2]" 1
891 1 71 VAL MG1 1 72 ALA H 3.400 . 4.900 3.318 3.064 3.462 . 0 0 "[ . 1 . 2]" 1
892 1 71 VAL MG1 1 106 TYR QE 3.200 . 4.500 3.681 3.236 4.351 . 0 0 "[ . 1 . 2]" 1
893 1 71 VAL MG2 1 72 ALA H 4.000 . 6.000 3.516 3.438 3.682 . 0 0 "[ . 1 . 2]" 1
894 1 71 VAL MG2 1 106 TYR QD 3.300 . 4.600 4.068 3.724 4.611 0.011 7 0 "[ . 1 . 2]" 1
895 1 71 VAL MG2 1 106 TYR QE 2.500 . 3.300 2.709 2.141 3.203 . 0 0 "[ . 1 . 2]" 1
896 1 72 ALA H 1 72 ALA MB 3.000 . 4.100 2.229 2.212 2.251 . 0 0 "[ . 1 . 2]" 1
897 1 72 ALA H 1 73 SER H 2.600 . 3.400 2.706 2.556 3.022 . 0 0 "[ . 1 . 2]" 1
898 1 72 ALA H 1 74 GLY H 3.500 . 5.100 4.944 4.016 5.162 0.062 19 0 "[ . 1 . 2]" 1
899 1 72 ALA HA 1 74 GLY H 4.700 . 6.000 5.561 5.135 5.921 . 0 0 "[ . 1 . 2]" 1
900 1 72 ALA MB 1 73 SER H 5.400 . 6.000 2.785 2.197 3.244 . 0 0 "[ . 1 . 2]" 1
901 1 73 SER H 1 73 SER HA 2.600 . 3.400 2.886 2.818 2.936 . 0 0 "[ . 1 . 2]" 1
902 1 73 SER H 1 73 SER HB2 2.600 . 3.500 2.747 2.070 3.932 0.432 6 0 "[ . 1 . 2]" 1
903 1 73 SER H 1 73 SER HB3 2.900 . 3.900 3.344 2.531 3.699 . 0 0 "[ . 1 . 2]" 1
904 1 73 SER H 1 74 GLY H 2.400 . 3.100 2.789 2.037 3.123 0.023 4 0 "[ . 1 . 2]" 1
905 1 73 SER HA 1 73 SER HB2 2.400 . 3.100 2.842 2.484 3.034 . 0 0 "[ . 1 . 2]" 1
906 1 73 SER HA 1 73 SER HB3 2.200 . 2.800 2.542 2.348 3.004 0.204 7 0 "[ . 1 . 2]" 1
907 1 73 SER HA 1 74 GLY H 3.400 . 4.800 3.520 2.941 3.577 . 0 0 "[ . 1 . 2]" 1
908 1 73 SER HA 1 75 ASN H 6.000 . 6.000 5.524 3.658 5.960 . 0 0 "[ . 1 . 2]" 1
909 1 73 SER HB3 1 75 ASN H 3.600 . 5.300 4.448 3.441 5.885 0.585 6 1 "[ .+ 1 . 2]" 1
910 1 73 SER HB3 1 75 ASN QD 4.800 . 6.000 5.617 4.833 6.901 0.901 16 1 "[ . 1 .+ 2]" 1
911 1 74 GLY H 1 74 GLY HA2 2.700 . 3.600 2.860 2.831 2.960 . 0 0 "[ . 1 . 2]" 1
912 1 74 GLY H 1 74 GLY HA3 2.700 . 3.600 2.737 2.448 2.770 . 0 0 "[ . 1 . 2]" 1
913 1 74 GLY H 1 75 ASN H 2.400 . 3.100 2.455 1.889 2.915 . 0 0 "[ . 1 . 2]" 1
914 1 74 GLY H 1 75 ASN HA 4.300 . 6.000 4.312 3.631 4.615 . 0 0 "[ . 1 . 2]" 1
915 1 74 GLY HA2 1 75 ASN H 3.100 . 4.300 3.457 2.855 3.576 . 0 0 "[ . 1 . 2]" 1
916 1 74 GLY HA3 1 75 ASN H 2.800 . 3.800 2.617 2.324 3.499 . 0 0 "[ . 1 . 2]" 1
917 1 75 ASN H 1 75 ASN HA 2.300 . 3.000 2.825 2.256 2.954 . 0 0 "[ . 1 . 2]" 1
918 1 75 ASN H 1 75 ASN QB 2.600 . 3.400 2.920 2.487 3.428 0.028 9 0 "[ . 1 . 2]" 1
919 1 75 ASN H 1 75 ASN QD 3.600 . 5.200 2.627 2.027 4.090 . 0 0 "[ . 1 . 2]" 1
920 1 75 ASN H 1 76 LEU QB 4.400 . 6.000 5.112 3.840 5.963 . 0 0 "[ . 1 . 2]" 1
921 1 75 ASN H 1 76 LEU QD 4.000 . 6.000 5.388 3.814 6.071 0.071 14 0 "[ . 1 . 2]" 1
922 1 75 ASN HA 1 75 ASN QD 3.200 . 4.500 3.532 1.663 4.014 0.337 7 0 "[ . 1 . 2]" 1
923 1 75 ASN HA 1 76 LEU H 2.300 . 3.000 2.271 2.163 2.621 . 0 0 "[ . 1 . 2]" 1
924 1 75 ASN QB 1 75 ASN QD 2.500 . 3.300 2.331 2.162 2.761 . 0 0 "[ . 1 . 2]" 1
925 1 75 ASN QB 1 76 LEU H 3.500 . 5.000 2.849 2.192 3.479 . 0 0 "[ . 1 . 2]" 1
926 1 76 LEU H 1 76 LEU HA 2.700 . 3.600 2.914 2.828 2.938 . 0 0 "[ . 1 . 2]" 1
927 1 76 LEU H 1 76 LEU QB 2.800 . 3.800 2.575 2.236 3.209 . 0 0 "[ . 1 . 2]" 1
928 1 76 LEU H 1 76 LEU QD 3.100 . 4.300 3.611 1.828 4.100 0.072 7 0 "[ . 1 . 2]" 1
929 1 76 LEU H 1 76 LEU HG 4.000 . 6.000 4.444 2.927 5.031 . 0 0 "[ . 1 . 2]" 1
930 1 76 LEU H 1 77 ASN H 4.400 . 6.000 4.128 3.868 4.369 . 0 0 "[ . 1 . 2]" 1
931 1 76 LEU H 1 77 ASN QB 6.000 . 6.000 4.722 4.297 5.640 . 0 0 "[ . 1 . 2]" 1
932 1 76 LEU H 1 77 ASN QB 4.300 . 6.000 4.021 2.209 5.182 . 0 0 "[ . 1 . 2]" 1
933 1 76 LEU H 1 99 LYS H 3.400 . 4.800 3.948 3.324 4.882 0.082 9 0 "[ . 1 . 2]" 1
934 1 76 LEU H 1 99 LYS HB2 3.100 . 4.300 2.553 1.808 3.932 0.092 17 0 "[ . 1 . 2]" 1
935 1 76 LEU H 1 99 LYS HB3 3.600 . 5.200 3.567 2.301 5.089 . 0 0 "[ . 1 . 2]" 1
936 1 76 LEU H 1 99 LYS QE 6.000 . 6.000 4.511 2.215 6.041 0.041 9 0 "[ . 1 . 2]" 1
937 1 76 LEU H 1 106 TYR QE 3.800 . 5.600 3.812 2.165 5.594 . 0 0 "[ . 1 . 2]" 1
938 1 76 LEU HA 1 77 ASN H 2.600 . 3.400 2.170 2.121 2.330 . 0 0 "[ . 1 . 2]" 1
939 1 76 LEU HA 1 99 LYS QG 4.200 . 6.000 5.717 5.038 5.887 . 0 0 "[ . 1 . 2]" 1
940 1 76 LEU QD 1 77 ASN H 3.300 . 4.600 2.696 2.051 4.239 . 0 0 "[ . 1 . 2]" 1
941 1 76 LEU HG 1 77 ASN H 4.100 . 6.000 4.133 1.988 5.679 0.012 18 0 "[ . 1 . 2]" 1
942 1 77 ASN H 1 77 ASN HA 2.300 . 3.000 2.862 2.782 2.947 . 0 0 "[ . 1 . 2]" 1
943 1 77 ASN H 1 77 ASN QB 4.800 . 5.600 3.047 2.184 3.386 . 0 0 "[ . 1 . 2]" 1
944 1 77 ASN HA 1 77 ASN HD21 4.300 . 6.000 4.130 3.539 4.554 . 0 0 "[ . 1 . 2]" 1
945 1 77 ASN HA 1 78 THR H 2.200 . 2.800 2.196 2.019 2.550 . 0 0 "[ . 1 . 2]" 1
946 1 77 ASN HA 1 79 MET H 4.900 . 6.000 6.160 6.014 6.257 0.257 7 0 "[ . 1 . 2]" 1
947 1 77 ASN HA 1 96 HIS HD2 6.000 . 6.000 4.501 3.531 5.654 . 0 0 "[ . 1 . 2]" 1
948 1 77 ASN HA 1 98 LYS HA 1.800 . 2.200 2.188 1.876 2.319 0.119 5 0 "[ . 1 . 2]" 1
949 1 77 ASN HA 1 99 LYS H 3.500 . 5.100 3.831 3.501 4.307 . 0 0 "[ . 1 . 2]" 1
950 1 77 ASN QB 1 77 ASN HD21 2.900 . 3.900 2.292 2.114 2.824 . 0 0 "[ . 1 . 2]" 1
951 1 77 ASN QB 1 77 ASN HD22 3.400 . 4.800 3.290 3.202 3.492 . 0 0 "[ . 1 . 2]" 1
952 1 77 ASN QB 1 78 THR H 4.300 . 6.000 3.608 2.831 3.983 . 0 0 "[ . 1 . 2]" 1
953 1 77 ASN QB 1 97 MET H 4.100 . 6.000 5.599 4.681 5.820 . 0 0 "[ . 1 . 2]" 1
954 1 77 ASN QB 1 99 LYS H 3.500 . 5.100 3.387 2.566 4.394 . 0 0 "[ . 1 . 2]" 1
955 1 78 THR H 1 78 THR HB 3.100 . 4.300 3.088 2.553 3.675 . 0 0 "[ . 1 . 2]" 1
956 1 78 THR H 1 78 THR MG 3.500 . 5.000 3.045 1.989 3.900 0.011 4 0 "[ . 1 . 2]" 1
957 1 78 THR H 1 79 MET H 6.000 . 6.000 4.373 4.260 4.498 . 0 0 "[ . 1 . 2]" 1
958 1 78 THR H 1 79 MET H 4.600 . 6.000 4.248 4.152 4.390 . 0 0 "[ . 1 . 2]" 1
959 1 78 THR H 1 96 HIS HA 4.000 . 6.000 4.654 4.035 5.110 . 0 0 "[ . 1 . 2]" 1
960 1 78 THR H 1 96 HIS HD2 4.700 . 6.000 3.623 2.962 4.263 . 0 0 "[ . 1 . 2]" 1
961 1 78 THR H 1 97 MET QB . . 4.700 3.495 2.198 4.753 0.053 7 0 "[ . 1 . 2]" 1
962 1 78 THR H 1 98 LYS HA 3.300 . 4.700 3.939 3.484 4.355 . 0 0 "[ . 1 . 2]" 1
963 1 78 THR H 1 98 LYS QB 4.600 . 6.000 4.842 3.826 5.831 . 0 0 "[ . 1 . 2]" 1
964 1 78 THR H 1 98 LYS QD 4.200 . 6.000 5.880 4.017 6.118 0.118 20 0 "[ . 1 . 2]" 1
965 1 78 THR HA 1 79 MET H 2.200 . 2.800 2.306 2.214 2.441 . 0 0 "[ . 1 . 2]" 1
966 1 78 THR HB 1 79 MET H 3.500 . 5.000 3.359 2.206 3.843 . 0 0 "[ . 1 . 2]" 1
967 1 78 THR MG 1 79 MET H 3.500 . 5.000 2.880 1.981 3.437 0.019 11 0 "[ . 1 . 2]" 1
968 1 78 THR MG 1 80 PHE H 4.300 . 6.000 4.420 3.667 5.999 . 0 0 "[ . 1 . 2]" 1
969 1 78 THR MG 1 80 PHE QD 2.000 . 6.000 3.451 1.880 5.974 . 0 0 "[ . 1 . 2]" 1
970 1 79 MET H 1 79 MET HB2 4.800 . 6.000 3.655 3.084 3.867 . 0 0 "[ . 1 . 2]" 1
971 1 79 MET H 1 79 MET HB3 2.900 . 4.000 3.096 2.613 3.396 . 0 0 "[ . 1 . 2]" 1
972 1 79 MET H 1 79 MET QG 4.600 . 6.000 2.816 2.103 4.112 . 0 0 "[ . 1 . 2]" 1
973 1 79 MET H 1 80 PHE H 4.100 . 6.000 4.161 3.956 4.371 . 0 0 "[ . 1 . 2]" 1
974 1 79 MET H 1 96 HIS HA 4.700 . 6.000 4.621 4.381 4.945 . 0 0 "[ . 1 . 2]" 1
975 1 79 MET HA 1 79 MET HB2 2.400 . 3.100 2.471 2.426 2.523 . 0 0 "[ . 1 . 2]" 1
976 1 79 MET HA 1 80 PHE H 2.100 . 2.700 2.136 2.076 2.168 . 0 0 "[ . 1 . 2]" 1
977 1 79 MET HA 1 95 VAL H 6.000 . 6.000 4.410 4.058 4.673 . 0 0 "[ . 1 . 2]" 1
978 1 79 MET HA 1 96 HIS H 4.400 . 6.000 4.569 4.314 4.825 . 0 0 "[ . 1 . 2]" 1
979 1 79 MET HA 1 96 HIS HA 1.800 . 2.200 2.209 2.079 2.335 0.135 17 0 "[ . 1 . 2]" 1
980 1 79 MET HA 1 96 HIS HD2 3.000 . 4.100 3.325 2.621 4.115 0.015 19 0 "[ . 1 . 2]" 1
981 1 79 MET HA 1 97 MET H 2.900 . 4.000 3.246 2.989 3.493 . 0 0 "[ . 1 . 2]" 1
982 1 79 MET HB2 1 80 PHE H 5.100 . 6.000 3.698 3.258 4.418 . 0 0 "[ . 1 . 2]" 1
983 1 79 MET HB2 1 96 HIS HD2 6.000 . 6.000 3.792 2.200 5.196 . 0 0 "[ . 1 . 2]" 1
984 1 79 MET HB3 1 80 PHE H 3.800 . 5.600 4.284 4.202 4.388 . 0 0 "[ . 1 . 2]" 1
985 1 79 MET QG 1 80 PHE H 5.800 . 6.000 3.970 2.975 4.405 . 0 0 "[ . 1 . 2]" 1
986 1 79 MET QG 1 96 HIS HD2 4.000 . 6.000 4.080 2.891 5.433 . 0 0 "[ . 1 . 2]" 1
987 1 80 PHE H 1 80 PHE HB3 3.400 . 4.900 3.132 2.668 3.508 . 0 0 "[ . 1 . 2]" 1
988 1 80 PHE H 1 80 PHE QD 5.200 . 6.000 3.431 2.375 4.388 . 0 0 "[ . 1 . 2]" 1
989 1 80 PHE H 1 94 LYS HA 5.700 . 6.000 4.701 4.304 4.976 . 0 0 "[ . 1 . 2]" 1
990 1 80 PHE H 1 94 LYS QD 6.000 . 6.000 5.406 4.689 6.051 0.051 18 0 "[ . 1 . 2]" 1
991 1 80 PHE H 1 95 VAL H 2.800 . 3.800 3.068 2.877 3.386 . 0 0 "[ . 1 . 2]" 1
992 1 80 PHE H 1 95 VAL MG1 3.900 . 5.800 3.322 2.272 4.449 . 0 0 "[ . 1 . 2]" 1
993 1 80 PHE H 1 95 VAL MG2 6.000 . 6.000 4.447 4.066 4.857 . 0 0 "[ . 1 . 2]" 1
994 1 80 PHE H 1 96 HIS HA 3.600 . 5.200 3.743 3.492 3.919 . 0 0 "[ . 1 . 2]" 1
995 1 80 PHE H 1 97 MET QB 5.900 . 6.000 5.582 4.793 5.974 . 0 0 "[ . 1 . 2]" 1
996 1 80 PHE HA 1 81 GLU H 2.300 . 2.900 2.402 2.246 2.483 . 0 0 "[ . 1 . 2]" 1
997 1 80 PHE HA 1 95 VAL H 5.200 . 6.000 4.658 4.562 4.771 . 0 0 "[ . 1 . 2]" 1
998 1 80 PHE HB2 1 80 PHE QD 2.400 . 3.100 2.447 2.306 2.673 . 0 0 "[ . 1 . 2]" 1
999 1 80 PHE HB2 1 81 GLU H 2.600 . 3.500 2.979 2.254 4.122 0.622 14 6 "[ * . * 1 +.* -*]" 1
1000 1 80 PHE HB3 1 80 PHE QD 2.400 . 3.100 2.352 2.270 2.498 . 0 0 "[ . 1 . 2]" 1
1001 1 80 PHE HB3 1 81 GLU H 3.000 . 4.100 3.646 3.539 3.747 . 0 0 "[ . 1 . 2]" 1
1002 1 80 PHE QD 1 81 GLU H 5.500 . 6.000 3.324 2.844 4.112 . 0 0 "[ . 1 . 2]" 1
1003 1 80 PHE QD 1 82 TYR H 4.800 . 6.000 4.146 3.681 4.830 . 0 0 "[ . 1 . 2]" 1
1004 1 80 PHE QD 1 82 TYR HB2 3.400 . 4.800 2.654 1.998 4.313 0.002 7 0 "[ . 1 . 2]" 1
1005 1 80 PHE QD 1 82 TYR HB3 3.100 . 4.300 4.085 3.321 4.888 0.588 16 1 "[ . 1 .+ 2]" 1
1006 1 80 PHE QD 1 94 LYS QG 5.100 . 6.000 5.545 5.157 5.986 . 0 0 "[ . 1 . 2]" 1
1007 1 80 PHE QD 1 95 VAL MG2 3.200 . 6.000 4.625 3.389 6.043 0.043 14 0 "[ . 1 . 2]" 1
1008 1 80 PHE QE 1 82 TYR QD 2.800 . 3.800 3.148 1.706 3.871 0.094 3 0 "[ . 1 . 2]" 1
1009 1 81 GLU H 1 81 GLU HG2 4.800 . 6.000 3.902 1.943 4.525 . 0 0 "[ . 1 . 2]" 1
1010 1 81 GLU H 1 81 GLU HG3 4.500 . 6.000 3.738 2.074 4.759 . 0 0 "[ . 1 . 2]" 1
1011 1 81 GLU H 1 82 TYR H 4.400 . 6.000 4.360 4.172 4.483 . 0 0 "[ . 1 . 2]" 1
1012 1 81 GLU HA 1 82 TYR H 2.100 . 2.600 2.140 2.084 2.189 . 0 0 "[ . 1 . 2]" 1
1013 1 81 GLU HA 1 93 VAL H 3.900 . 5.800 4.713 4.446 4.998 . 0 0 "[ . 1 . 2]" 1
1014 1 81 GLU HA 1 94 LYS H 5.800 . 6.000 4.701 4.272 5.041 . 0 0 "[ . 1 . 2]" 1
1015 1 81 GLU HA 1 94 LYS HA 2.000 . 2.500 2.145 1.763 2.500 . 0 0 "[ . 1 . 2]" 1
1016 1 81 GLU HA 1 95 VAL H 2.900 . 3.900 3.150 2.812 3.496 . 0 0 "[ . 1 . 2]" 1
1017 1 81 GLU HB2 1 82 TYR H 4.500 . 6.000 4.099 3.060 4.428 . 0 0 "[ . 1 . 2]" 1
1018 1 81 GLU HB3 1 82 TYR H 4.100 . 6.000 3.876 3.152 4.332 . 0 0 "[ . 1 . 2]" 1
1019 1 81 GLU HG2 1 82 TYR H 4.400 . 6.000 4.129 2.594 5.421 . 0 0 "[ . 1 . 2]" 1
1020 1 81 GLU HG2 1 94 LYS H 4.100 . 6.000 5.022 3.910 5.869 . 0 0 "[ . 1 . 2]" 1
1021 1 81 GLU HG3 1 82 TYR H 6.000 . 6.000 4.160 2.995 5.253 . 0 0 "[ . 1 . 2]" 1
1022 1 81 GLU HG3 1 95 VAL H 5.300 . 6.000 5.378 4.149 6.752 0.752 14 4 "[- . 1 +.* *2]" 1
1023 1 82 TYR H 1 82 TYR HB2 3.700 . 5.400 3.038 2.580 3.302 . 0 0 "[ . 1 . 2]" 1
1024 1 82 TYR H 1 82 TYR HB3 3.700 . 5.400 3.056 2.571 3.814 . 0 0 "[ . 1 . 2]" 1
1025 1 82 TYR H 1 83 THR H 6.000 . 6.000 4.410 4.346 4.489 . 0 0 "[ . 1 . 2]" 1
1026 1 82 TYR H 1 93 VAL H 2.800 . 3.800 3.301 3.020 3.745 . 0 0 "[ . 1 . 2]" 1
1027 1 82 TYR H 1 93 VAL QG 5.700 . 6.000 3.052 2.580 3.675 . 0 0 "[ . 1 . 2]" 1
1028 1 82 TYR H 1 93 VAL QG 5.700 . 6.000 2.946 2.577 3.317 . 0 0 "[ . 1 . 2]" 1
1029 1 82 TYR H 1 94 LYS HA 3.000 . 4.200 3.356 2.957 3.687 . 0 0 "[ . 1 . 2]" 1
1030 1 82 TYR H 1 95 VAL H 4.700 . 6.000 4.038 3.587 4.388 . 0 0 "[ . 1 . 2]" 1
1031 1 82 TYR H 1 95 VAL MG2 5.600 . 6.000 4.257 2.971 5.351 . 0 0 "[ . 1 . 2]" 1
1032 1 82 TYR HA 1 83 THR H 2.400 . 3.100 2.404 2.260 2.506 . 0 0 "[ . 1 . 2]" 1
1033 1 82 TYR HB2 1 82 TYR QD 2.800 . 3.800 2.525 2.267 2.678 . 0 0 "[ . 1 . 2]" 1
1034 1 82 TYR HB2 1 83 THR H 3.500 . 5.100 3.908 3.634 4.229 . 0 0 "[ . 1 . 2]" 1
1035 1 82 TYR HB3 1 82 TYR QD 2.900 . 3.900 2.385 2.273 2.742 . 0 0 "[ . 1 . 2]" 1
1036 1 82 TYR HB3 1 82 TYR QE 4.200 . 6.000 4.413 4.376 4.510 . 0 0 "[ . 1 . 2]" 1
1037 1 82 TYR HB3 1 83 THR H 4.100 . 6.000 3.293 2.260 3.867 . 0 0 "[ . 1 . 2]" 1
1038 1 82 TYR HB3 1 84 PHE QD 3.400 . 6.000 5.017 3.406 5.899 . 0 0 "[ . 1 . 2]" 1
1039 1 82 TYR HB3 1 95 VAL MG2 3.300 . 6.000 4.387 2.440 6.275 0.275 13 0 "[ . 1 . 2]" 1
1040 1 82 TYR QE 1 83 THR H 3.900 . 5.800 4.074 3.427 5.438 . 0 0 "[ . 1 . 2]" 1
1041 1 83 THR H 1 83 THR HA 2.800 . 3.800 2.931 2.923 2.937 . 0 0 "[ . 1 . 2]" 1
1042 1 83 THR H 1 83 THR HB 2.900 . 4.000 2.871 2.347 3.576 . 0 0 "[ . 1 . 2]" 1
1043 1 83 THR H 1 83 THR MG 3.200 . 4.500 3.210 1.875 3.767 0.025 20 0 "[ . 1 . 2]" 1
1044 1 83 THR H 1 84 PHE H 4.300 . 6.000 4.496 4.320 4.563 . 0 0 "[ . 1 . 2]" 1
1045 1 83 THR H 1 93 VAL QG 4.300 . 6.000 4.701 4.172 5.204 . 0 0 "[ . 1 . 2]" 1
1046 1 83 THR HA 1 84 PHE H 2.300 . 3.000 2.239 2.147 2.368 . 0 0 "[ . 1 . 2]" 1
1047 1 83 THR HA 1 91 THR H 6.000 . 6.000 4.829 4.285 5.590 . 0 0 "[ . 1 . 2]" 1
1048 1 83 THR HA 1 93 VAL H 3.000 . 4.100 3.115 2.831 3.441 . 0 0 "[ . 1 . 2]" 1
1049 1 83 THR HB 1 84 PHE H 3.600 . 5.200 3.359 2.414 4.027 . 0 0 "[ . 1 . 2]" 1
1050 1 83 THR HB 1 85 ASP H 6.000 . 6.000 4.977 4.380 6.058 0.058 20 0 "[ . 1 . 2]" 1
1051 1 83 THR MG 1 84 PHE H 3.300 . 4.700 2.861 2.137 3.558 . 0 0 "[ . 1 . 2]" 1
1052 1 83 THR MG 1 91 THR H 4.800 . 6.000 3.831 2.922 5.076 . 0 0 "[ . 1 . 2]" 1
1053 1 83 THR MG 1 93 VAL H 4.600 . 6.000 4.338 3.195 5.631 . 0 0 "[ . 1 . 2]" 1
1054 1 84 PHE H 1 84 PHE HB2 3.800 . 5.600 2.521 2.424 2.702 . 0 0 "[ . 1 . 2]" 1
1055 1 84 PHE H 1 85 ASP H 4.400 . 6.000 4.152 3.787 4.426 . 0 0 "[ . 1 . 2]" 1
1056 1 84 PHE H 1 88 MET QB 4.000 . 6.000 5.334 4.810 6.216 0.216 9 0 "[ . 1 . 2]" 1
1057 1 84 PHE H 1 91 THR HB 3.600 . 5.200 4.029 3.001 5.240 0.040 3 0 "[ . 1 . 2]" 1
1058 1 84 PHE H 1 91 THR MG 4.000 . 6.000 4.654 3.053 5.472 . 0 0 "[ . 1 . 2]" 1
1059 1 84 PHE H 1 92 LYS HA 3.200 . 4.500 3.620 3.144 4.303 . 0 0 "[ . 1 . 2]" 1
1060 1 84 PHE H 1 93 VAL H 4.300 . 6.000 4.369 3.646 4.761 . 0 0 "[ . 1 . 2]" 1
1061 1 84 PHE H 1 93 VAL QG 5.300 . 5.800 3.688 3.119 4.254 . 0 0 "[ . 1 . 2]" 1
1062 1 84 PHE HA 1 84 PHE QD 2.200 . 2.800 2.222 1.593 2.841 0.041 11 0 "[ . 1 . 2]" 1
1063 1 84 PHE HA 1 85 ASP H 2.400 . 3.100 2.139 2.096 2.171 . 0 0 "[ . 1 . 2]" 1
1064 1 84 PHE HB2 1 85 ASP H 4.600 . 6.000 4.411 4.182 4.609 . 0 0 "[ . 1 . 2]" 1
1065 1 84 PHE HB3 1 85 ASP H 4.000 . 6.000 3.631 3.114 4.006 . 0 0 "[ . 1 . 2]" 1
1066 1 84 PHE QD 1 93 VAL QG 3.300 . 4.700 2.415 1.853 3.083 0.047 9 0 "[ . 1 . 2]" 1
1067 1 84 PHE QE 1 93 VAL QG 3.400 . 4.900 2.181 1.882 3.216 0.018 10 0 "[ . 1 . 2]" 1
1068 1 84 PHE QE 1 93 VAL QG 3.200 . 6.000 2.153 1.881 2.978 . 0 0 "[ . 1 . 2]" 1
1069 1 84 PHE QE 1 110 VAL QG 2.900 . 6.000 2.409 1.803 3.666 . 0 0 "[ . 1 . 2]" 1
1070 1 84 PHE HZ 1 93 VAL QG 4.400 . 6.000 3.614 2.671 4.726 . 0 0 "[ . 1 . 2]" 1
1071 1 84 PHE HZ 1 93 VAL QG 3.900 . 5.800 3.284 2.648 3.874 . 0 0 "[ . 1 . 2]" 1
1072 1 84 PHE HZ 1 95 VAL MG2 2.800 . 6.000 3.507 2.409 4.866 . 0 0 "[ . 1 . 2]" 1
1073 1 84 PHE HZ 1 110 VAL QG 3.200 . 4.500 3.299 2.324 4.272 . 0 0 "[ . 1 . 2]" 1
1074 1 85 ASP H 1 85 ASP HA 3.000 . 4.200 2.923 2.720 2.949 . 0 0 "[ . 1 . 2]" 1
1075 1 85 ASP H 1 85 ASP QB 3.700 . 5.000 2.827 2.423 3.162 . 0 0 "[ . 1 . 2]" 1
1076 1 85 ASP H 1 86 TYR H 3.200 . 4.500 3.540 2.075 4.240 . 0 0 "[ . 1 . 2]" 1
1077 1 85 ASP H 1 86 TYR HA 4.300 . 6.000 5.154 4.251 5.733 . 0 0 "[ . 1 . 2]" 1
1078 1 85 ASP HA 1 86 TYR H 2.800 . 3.800 2.790 2.066 3.588 . 0 0 "[ . 1 . 2]" 1
1079 1 85 ASP QB 1 91 THR H 3.300 . 4.700 4.326 2.899 4.663 . 0 0 "[ . 1 . 2]" 1
1080 1 86 TYR H 1 86 TYR HB2 3.400 . 4.900 3.221 2.387 3.671 . 0 0 "[ . 1 . 2]" 1
1081 1 86 TYR H 1 86 TYR HB3 3.400 . 4.800 3.197 2.514 3.665 . 0 0 "[ . 1 . 2]" 1
1082 1 86 TYR H 1 88 MET QB 3.800 . 5.600 4.601 2.823 5.644 0.044 2 0 "[ . 1 . 2]" 1
1083 1 86 TYR HA 1 86 TYR QD 3.200 . 4.500 2.754 2.395 3.643 . 0 0 "[ . 1 . 2]" 1
1084 1 86 TYR HA 1 87 GLN H 2.900 . 4.000 3.301 2.151 3.577 . 0 0 "[ . 1 . 2]" 1
1085 1 86 TYR HA 1 88 MET H 3.800 . 5.600 4.641 3.098 5.437 . 0 0 "[ . 1 . 2]" 1
1086 1 86 TYR HB2 1 86 TYR QD 2.500 . 3.300 2.501 2.290 2.638 . 0 0 "[ . 1 . 2]" 1
1087 1 86 TYR QD 1 87 GLN QE 2.400 . 3.100 2.635 1.532 3.138 0.168 8 0 "[ . 1 . 2]" 1
1088 1 86 TYR QE 1 87 GLN HB2 3.100 . 4.300 3.482 2.274 4.710 0.410 12 0 "[ . 1 . 2]" 1
1089 1 86 TYR QE 1 87 GLN QG 3.500 . 5.100 3.651 2.529 4.704 . 0 0 "[ . 1 . 2]" 1
1090 1 87 GLN H 1 87 GLN HB2 3.700 . 5.400 3.338 2.311 3.955 . 0 0 "[ . 1 . 2]" 1
1091 1 87 GLN H 1 87 GLN QG 3.900 . 5.800 2.462 1.917 3.257 0.083 12 0 "[ . 1 . 2]" 1
1092 1 87 GLN H 1 88 MET H 3.100 . 4.300 2.287 1.829 3.305 0.071 8 0 "[ . 1 . 2]" 1
1093 1 87 GLN HA 1 88 MET H 2.800 . 3.800 3.341 2.461 3.539 . 0 0 "[ . 1 . 2]" 1
1094 1 87 GLN HB2 1 87 GLN QE 3.100 . 4.300 3.539 1.818 4.056 0.182 11 0 "[ . 1 . 2]" 1
1095 1 87 GLN HB2 1 87 GLN QG 1.900 . 2.400 2.315 2.159 2.486 0.086 11 0 "[ . 1 . 2]" 1
1096 1 87 GLN HB2 1 88 MET H 3.900 . 5.800 3.547 2.364 4.404 . 0 0 "[ . 1 . 2]" 1
1097 1 87 GLN HB3 1 87 GLN QE 4.000 . 6.000 3.460 2.718 4.300 . 0 0 "[ . 1 . 2]" 1
1098 1 87 GLN QE 1 87 GLN QG 3.200 . 4.500 2.187 2.084 2.625 . 0 0 "[ . 1 . 2]" 1
1099 1 87 GLN QE 1 88 MET H 2.800 . 6.000 4.664 3.540 5.655 . 0 0 "[ . 1 . 2]" 1
1100 1 88 MET H 1 88 MET HA 2.900 . 3.900 2.897 2.821 2.947 . 0 0 "[ . 1 . 2]" 1
1101 1 88 MET H 1 88 MET QB 2.700 . 3.600 2.452 2.232 3.384 . 0 0 "[ . 1 . 2]" 1
1102 1 88 MET H 1 88 MET QG 3.800 . 5.600 3.996 2.663 4.232 . 0 0 "[ . 1 . 2]" 1
1103 1 88 MET H 1 89 THR H 4.200 . 6.000 4.472 4.133 4.649 . 0 0 "[ . 1 . 2]" 1
1104 1 88 MET HA 1 89 THR H 2.600 . 3.400 2.256 2.162 2.373 . 0 0 "[ . 1 . 2]" 1
1105 1 88 MET HA 1 91 THR H 3.400 . 6.000 6.151 6.034 6.263 0.263 11 0 "[ . 1 . 2]" 1
1106 1 88 MET QB 1 89 THR H 3.500 . 5.000 3.558 2.694 3.800 . 0 0 "[ . 1 . 2]" 1
1107 1 88 MET QB 1 91 THR H 3.100 . 4.300 4.149 3.554 4.274 . 0 0 "[ . 1 . 2]" 1
1108 1 88 MET QG 1 89 THR H 3.100 . 4.300 2.667 2.041 4.004 . 0 0 "[ . 1 . 2]" 1
1109 1 88 MET QG 1 91 THR H 3.200 . 4.500 3.411 2.983 4.091 . 0 0 "[ . 1 . 2]" 1
1110 1 89 THR H 1 89 THR HA 3.000 . 4.100 2.806 2.769 2.852 . 0 0 "[ . 1 . 2]" 1
1111 1 89 THR H 1 89 THR HB 2.800 . 3.800 2.989 2.279 3.482 . 0 0 "[ . 1 . 2]" 1
1112 1 89 THR H 1 89 THR MG 3.200 . 4.500 2.638 1.889 3.662 0.011 13 0 "[ . 1 . 2]" 1
1113 1 89 THR H 1 90 PRO HD3 4.900 . 6.000 4.879 4.539 5.186 . 0 0 "[ . 1 . 2]" 1
1114 1 89 THR HA 1 89 THR MG 2.700 . 3.600 2.360 2.022 3.132 . 0 0 "[ . 1 . 2]" 1
1115 1 89 THR HA 1 90 PRO HD2 2.600 . 3.400 2.492 1.907 3.158 . 0 0 "[ . 1 . 2]" 1
1116 1 89 THR HA 1 90 PRO HD3 2.000 . 2.500 2.256 2.022 2.543 0.043 2 0 "[ . 1 . 2]" 1
1117 1 89 THR HB 1 89 THR MG 2.100 . 6.000 2.122 2.114 2.128 . 0 0 "[ . 1 . 2]" 1
1118 1 90 PRO QB 1 90 PRO HD2 2.600 . 3.500 3.164 2.840 3.541 0.041 8 0 "[ . 1 . 2]" 1
1119 1 90 PRO QB 1 90 PRO HD3 2.600 . 3.400 3.312 2.841 3.513 0.113 11 0 "[ . 1 . 2]" 1
1120 1 90 PRO HD2 1 90 PRO QG 1.900 . 2.300 2.204 2.174 2.239 . 0 0 "[ . 1 . 2]" 1
1121 1 90 PRO HD3 1 90 PRO QG 2.000 . 2.500 2.198 2.173 2.255 . 0 0 "[ . 1 . 2]" 1
1122 1 91 THR H 1 91 THR HA 2.500 . 3.300 2.921 2.773 2.964 . 0 0 "[ . 1 . 2]" 1
1123 1 91 THR H 1 91 THR HB 3.100 . 4.300 2.913 2.339 3.555 . 0 0 "[ . 1 . 2]" 1
1124 1 91 THR H 1 91 THR MG 3.600 . 5.200 3.283 1.984 3.839 0.016 3 0 "[ . 1 . 2]" 1
1125 1 91 THR H 1 92 LYS H 5.500 . 6.000 4.539 4.324 4.680 . 0 0 "[ . 1 . 2]" 1
1126 1 91 THR HA 1 92 LYS H 4.800 . 6.000 2.276 2.153 2.439 . 0 0 "[ . 1 . 2]" 1
1127 1 91 THR HB 1 91 THR MG 2.300 . 3.000 2.123 2.119 2.129 . 0 0 "[ . 1 . 2]" 1
1128 1 91 THR HB 1 92 LYS H 4.500 . 6.000 3.279 2.407 4.119 . 0 0 "[ . 1 . 2]" 1
1129 1 91 THR MG 1 92 LYS H 3.200 . 4.500 2.710 1.890 3.573 0.010 8 0 "[ . 1 . 2]" 1
1130 1 92 LYS H 1 92 LYS HB2 3.800 . 5.600 2.920 2.305 3.764 . 0 0 "[ . 1 . 2]" 1
1131 1 92 LYS H 1 92 LYS HB3 3.900 . 5.800 3.143 2.399 3.734 . 0 0 "[ . 1 . 2]" 1
1132 1 92 LYS H 1 92 LYS HG2 4.400 . 6.000 3.665 2.064 4.525 . 0 0 "[ . 1 . 2]" 1
1133 1 92 LYS H 1 92 LYS QG 4.300 . 6.000 3.161 2.033 4.088 . 0 0 "[ . 1 . 2]" 1
1134 1 92 LYS H 1 92 LYS HG3 4.900 . 6.000 3.677 2.629 4.682 . 0 0 "[ . 1 . 2]" 1
1135 1 92 LYS H 1 93 VAL H 4.400 . 6.000 4.369 4.163 4.517 . 0 0 "[ . 1 . 2]" 1
1136 1 92 LYS H 1 93 VAL HA 6.000 . 6.000 4.386 4.035 4.634 . 0 0 "[ . 1 . 2]" 1
1137 1 92 LYS H 1 93 VAL QG 3.100 . 4.300 3.294 3.073 3.611 . 0 0 "[ . 1 . 2]" 1
1138 1 92 LYS HA 1 93 VAL H 2.200 . 2.800 2.147 2.105 2.215 . 0 0 "[ . 1 . 2]" 1
1139 1 92 LYS HB2 1 93 VAL H 3.900 . 5.800 4.000 2.756 4.518 . 0 0 "[ . 1 . 2]" 1
1140 1 92 LYS HB3 1 93 VAL H 4.700 . 6.000 3.827 2.829 4.379 . 0 0 "[ . 1 . 2]" 1
1141 1 92 LYS QG 1 93 VAL H 3.600 . 5.200 3.739 2.602 4.731 . 0 0 "[ . 1 . 2]" 1
1142 1 92 LYS HG3 1 93 VAL H 5.100 . 6.000 4.245 2.991 5.614 . 0 0 "[ . 1 . 2]" 1
1143 1 93 VAL H 1 93 VAL HA 2.700 . 3.600 2.939 2.911 2.950 . 0 0 "[ . 1 . 2]" 1
1144 1 93 VAL H 1 93 VAL HB 3.200 . 4.500 3.529 2.822 3.702 . 0 0 "[ . 1 . 2]" 1
1145 1 93 VAL H 1 93 VAL QG 2.900 . 3.900 1.974 1.867 2.218 0.133 19 0 "[ . 1 . 2]" 1
1146 1 93 VAL HA 1 94 LYS H 2.200 . 2.800 2.363 2.277 2.444 . 0 0 "[ . 1 . 2]" 1
1147 1 93 VAL HA 1 111 LYS H 4.400 . 6.000 4.854 4.099 5.568 . 0 0 "[ . 1 . 2]" 1
1148 1 93 VAL HA 1 112 ARG H 4.700 . 6.000 4.858 4.251 5.302 . 0 0 "[ . 1 . 2]" 1
1149 1 93 VAL HA 1 112 ARG HA 2.100 . 2.600 2.342 1.690 2.634 0.034 19 0 "[ . 1 . 2]" 1
1150 1 93 VAL HA 1 113 VAL H 2.600 . 3.400 2.663 2.082 3.436 0.036 15 0 "[ . 1 . 2]" 1
1151 1 93 VAL HB 1 93 VAL QG 3.000 . 3.600 1.889 1.879 1.892 0.021 9 0 "[ . 1 . 2]" 1
1152 1 93 VAL HB 1 94 LYS H 2.800 . 3.800 2.531 2.132 3.892 0.092 9 0 "[ . 1 . 2]" 1
1153 1 93 VAL HB 1 95 VAL H 6.000 . 6.000 5.198 4.518 6.607 0.607 8 1 "[ . + 1 . 2]" 1
1154 1 93 VAL QG 1 94 LYS H 3.500 . 5.000 2.830 1.939 3.102 0.061 9 0 "[ . 1 . 2]" 1
1155 1 93 VAL QG 1 95 VAL H 4.300 . 6.000 3.913 3.464 4.292 . 0 0 "[ . 1 . 2]" 1
1156 1 93 VAL QG 1 111 LYS H 4.100 . 6.000 3.459 2.099 4.177 . 0 0 "[ . 1 . 2]" 1
1157 1 93 VAL QG 1 112 ARG HA 2.700 . 6.000 1.919 1.396 2.742 . 0 0 "[ . 1 . 2]" 1
1158 1 93 VAL QG 1 113 VAL H 3.700 . 5.400 3.316 2.728 4.074 . 0 0 "[ . 1 . 2]" 1
1159 1 94 LYS H 1 94 LYS HA 2.800 . 3.800 2.939 2.930 2.949 . 0 0 "[ . 1 . 2]" 1
1160 1 94 LYS H 1 94 LYS QB 2.600 . 3.400 2.425 2.339 2.552 . 0 0 "[ . 1 . 2]" 1
1161 1 94 LYS H 1 94 LYS QD 3.800 . 5.600 4.778 4.316 5.046 . 0 0 "[ . 1 . 2]" 1
1162 1 94 LYS H 1 94 LYS QG 3.200 . 4.500 3.979 2.759 4.096 . 0 0 "[ . 1 . 2]" 1
1163 1 94 LYS H 1 95 VAL HB 4.800 . 6.000 5.609 4.896 6.112 0.112 1 0 "[ . 1 . 2]" 1
1164 1 94 LYS H 1 95 VAL MG2 3.800 . 5.600 4.965 3.851 6.112 0.512 11 1 "[ . 1+ . 2]" 1
1165 1 94 LYS H 1 110 VAL HA 4.000 . 6.000 4.620 4.178 4.911 . 0 0 "[ . 1 . 2]" 1
1166 1 94 LYS H 1 111 LYS H 3.000 . 4.100 3.109 2.511 3.535 . 0 0 "[ . 1 . 2]" 1
1167 1 94 LYS H 1 112 ARG HA 2.800 . 3.700 3.399 3.043 3.740 0.040 8 0 "[ . 1 . 2]" 1
1168 1 94 LYS H 1 113 VAL H 3.700 . 5.400 3.844 2.312 5.205 . 0 0 "[ . 1 . 2]" 1
1169 1 94 LYS H 1 113 VAL MG2 3.700 . 5.400 3.764 2.437 5.908 0.508 15 1 "[ . 1 + 2]" 1
1170 1 94 LYS HA 1 95 VAL H 2.200 . 2.800 2.169 2.116 2.229 . 0 0 "[ . 1 . 2]" 1
1171 1 94 LYS QB 1 95 VAL H 4.700 . 6.000 3.746 3.063 3.897 . 0 0 "[ . 1 . 2]" 1
1172 1 94 LYS QD 1 95 VAL H 4.000 . 6.000 4.852 4.474 5.117 . 0 0 "[ . 1 . 2]" 1
1173 1 94 LYS QG 1 95 VAL H 3.000 . 4.100 2.940 2.569 4.107 0.007 1 0 "[ . 1 . 2]" 1
1174 1 95 VAL H 1 95 VAL HA 2.600 . 3.500 2.928 2.920 2.936 . 0 0 "[ . 1 . 2]" 1
1175 1 95 VAL H 1 95 VAL HB 3.500 . 6.000 2.620 2.262 2.968 . 0 0 "[ . 1 . 2]" 1
1176 1 95 VAL H 1 95 VAL MG1 3.300 . 4.700 2.802 1.855 3.750 0.045 20 0 "[ . 1 . 2]" 1
1177 1 95 VAL H 1 95 VAL MG2 2.900 . 3.900 3.087 2.320 3.795 . 0 0 "[ . 1 . 2]" 1
1178 1 95 VAL H 1 97 MET H 3.800 . 6.000 6.155 6.107 6.240 0.240 8 0 "[ . 1 . 2]" 1
1179 1 95 VAL HA 1 96 HIS H 2.200 . 2.800 2.127 2.063 2.186 . 0 0 "[ . 1 . 2]" 1
1180 1 95 VAL HA 1 109 PHE H 4.200 . 6.000 4.478 4.066 4.855 . 0 0 "[ . 1 . 2]" 1
1181 1 95 VAL MG1 1 96 HIS H 2.800 . 3.800 3.351 2.504 4.065 0.265 7 0 "[ . 1 . 2]" 1
1182 1 95 VAL MG1 1 97 MET H 3.800 . 5.600 3.890 3.344 4.373 . 0 0 "[ . 1 . 2]" 1
1183 1 95 VAL MG1 1 109 PHE H 4.000 . 6.000 4.559 3.151 5.704 . 0 0 "[ . 1 . 2]" 1
1184 1 95 VAL MG2 1 96 HIS H 3.800 . 5.600 3.237 2.205 4.095 . 0 0 "[ . 1 . 2]" 1
1185 1 96 HIS H 1 96 HIS HA 2.900 . 3.900 2.941 2.933 2.949 . 0 0 "[ . 1 . 2]" 1
1186 1 96 HIS H 1 96 HIS HB2 3.300 . 4.700 2.800 2.635 2.993 . 0 0 "[ . 1 . 2]" 1
1187 1 96 HIS H 1 96 HIS HB3 3.600 . 5.200 2.663 2.502 2.843 . 0 0 "[ . 1 . 2]" 1
1188 1 96 HIS H 1 96 HIS HD2 6.000 . 6.000 5.050 4.922 5.343 . 0 0 "[ . 1 . 2]" 1
1189 1 96 HIS H 1 108 VAL MG2 3.500 . 5.100 3.777 3.177 5.607 0.507 6 1 "[ .+ 1 . 2]" 1
1190 1 96 HIS H 1 109 PHE H 2.800 . 3.800 2.945 2.587 3.279 . 0 0 "[ . 1 . 2]" 1
1191 1 96 HIS H 1 109 PHE HA 4.700 . 6.000 4.666 4.515 4.837 . 0 0 "[ . 1 . 2]" 1
1192 1 96 HIS H 1 109 PHE HB2 3.600 . 5.300 3.156 2.655 3.683 . 0 0 "[ . 1 . 2]" 1
1193 1 96 HIS H 1 109 PHE QB 3.200 . 4.500 3.091 2.621 3.562 . 0 0 "[ . 1 . 2]" 1
1194 1 96 HIS H 1 109 PHE HB3 5.200 . 6.000 4.442 4.050 4.804 . 0 0 "[ . 1 . 2]" 1
1195 1 96 HIS H 1 110 VAL QG 3.800 . 5.600 4.141 3.525 4.910 . 0 0 "[ . 1 . 2]" 1
1196 1 96 HIS HA 1 96 HIS HD2 2.600 . 3.400 2.480 2.172 3.128 . 0 0 "[ . 1 . 2]" 1
1197 1 96 HIS HA 1 97 MET H 2.200 . 2.800 2.122 2.051 2.189 . 0 0 "[ . 1 . 2]" 1
1198 1 96 HIS HB2 1 97 MET H 4.500 . 6.000 4.454 4.272 4.555 . 0 0 "[ . 1 . 2]" 1
1199 1 96 HIS HB2 1 109 PHE H 4.700 . 6.000 4.607 3.924 5.163 . 0 0 "[ . 1 . 2]" 1
1200 1 96 HIS HB3 1 97 MET H 4.200 . 6.000 4.278 4.086 4.388 . 0 0 "[ . 1 . 2]" 1
1201 1 96 HIS HB3 1 109 PHE H 3.300 . 4.700 3.225 2.733 3.996 . 0 0 "[ . 1 . 2]" 1
1202 1 96 HIS HB3 1 109 PHE QD 2.700 . 3.600 2.634 1.778 3.372 0.022 17 0 "[ . 1 . 2]" 1
1203 1 96 HIS HD2 1 97 MET H 4.500 . 6.000 2.927 2.423 4.096 . 0 0 "[ . 1 . 2]" 1
1204 1 96 HIS HD2 1 98 LYS QB 5.900 . 6.000 4.755 2.848 5.902 . 0 0 "[ . 1 . 2]" 1
1205 1 97 MET H 1 97 MET HA 2.700 . 3.600 2.946 2.940 2.954 . 0 0 "[ . 1 . 2]" 1
1206 1 97 MET H 1 97 MET QB 4.100 . 5.500 2.547 2.241 2.870 . 0 0 "[ . 1 . 2]" 1
1207 1 97 MET H 1 97 MET QG 4.700 . 6.000 3.199 1.972 4.139 0.028 18 0 "[ . 1 . 2]" 1
1208 1 97 MET H 1 98 LYS QG 5.300 . 6.000 4.606 3.776 5.719 . 0 0 "[ . 1 . 2]" 1
1209 1 97 MET HA 1 97 MET QB 2.200 . 2.800 2.295 2.169 2.473 . 0 0 "[ . 1 . 2]" 1
1210 1 97 MET HA 1 97 MET QG 2.700 . 3.600 3.102 2.403 3.514 . 0 0 "[ . 1 . 2]" 1
1211 1 97 MET HA 1 98 LYS H 2.200 . 2.800 2.231 2.186 2.319 . 0 0 "[ . 1 . 2]" 1
1212 1 97 MET HA 1 107 TRP H 4.600 . 6.000 4.766 4.424 5.079 . 0 0 "[ . 1 . 2]" 1
1213 1 97 MET HA 1 108 VAL H 4.200 . 6.000 4.621 4.276 5.008 . 0 0 "[ . 1 . 2]" 1
1214 1 97 MET HA 1 108 VAL HA 2.200 . 2.800 2.237 1.660 2.684 . 0 0 "[ . 1 . 2]" 1
1215 1 97 MET HA 1 108 VAL MG2 3.900 . 5.800 2.787 1.990 3.575 0.010 12 0 "[ . 1 . 2]" 1
1216 1 97 MET QB 1 98 LYS H 3.900 . 4.200 3.284 2.738 3.859 . 0 0 "[ . 1 . 2]" 1
1217 1 97 MET QG 1 98 LYS H 3.500 . 5.000 3.735 2.759 4.696 . 0 0 "[ . 1 . 2]" 1
1218 1 98 LYS H 1 98 LYS HA 2.900 . 4.000 2.917 2.862 2.955 . 0 0 "[ . 1 . 2]" 1
1219 1 98 LYS H 1 98 LYS QB 3.400 . 4.800 2.977 2.661 3.302 . 0 0 "[ . 1 . 2]" 1
1220 1 98 LYS H 1 98 LYS QD 3.700 . 5.400 4.463 4.043 4.879 . 0 0 "[ . 1 . 2]" 1
1221 1 98 LYS H 1 98 LYS QG 3.100 . 4.300 2.850 2.228 3.572 . 0 0 "[ . 1 . 2]" 1
1222 1 98 LYS H 1 99 LYS H 4.200 . 6.000 4.294 4.099 4.426 . 0 0 "[ . 1 . 2]" 1
1223 1 98 LYS H 1 99 LYS H 3.700 . 5.400 3.968 3.823 4.035 . 0 0 "[ . 1 . 2]" 1
1224 1 98 LYS H 1 106 TYR H 4.700 . 6.000 6.173 6.051 6.300 0.300 5 0 "[ . 1 . 2]" 1
1225 1 98 LYS H 1 107 TRP HB2 3.700 . 5.400 3.992 3.305 4.333 . 0 0 "[ . 1 . 2]" 1
1226 1 98 LYS H 1 108 VAL HA 3.100 . 4.300 3.472 3.185 3.824 . 0 0 "[ . 1 . 2]" 1
1227 1 98 LYS HA 1 99 LYS H 2.100 . 2.600 2.242 2.057 2.440 . 0 0 "[ . 1 . 2]" 1
1228 1 98 LYS QB 1 99 LYS H 3.200 . 4.500 2.840 2.336 3.308 . 0 0 "[ . 1 . 2]" 1
1229 1 98 LYS QD 1 108 VAL HA 4.300 . 6.000 5.705 5.310 6.077 0.077 13 0 "[ . 1 . 2]" 1
1230 1 98 LYS QG 1 99 LYS H 4.500 . 6.000 3.953 3.442 4.368 . 0 0 "[ . 1 . 2]" 1
1231 1 98 LYS QG 1 109 PHE QD 3.600 . 5.200 3.415 2.880 3.923 . 0 0 "[ . 1 . 2]" 1
1232 1 99 LYS H 1 99 LYS HA 2.600 . 3.400 2.885 2.785 2.937 . 0 0 "[ . 1 . 2]" 1
1233 1 99 LYS H 1 99 LYS HB2 2.400 . 3.100 2.464 2.071 2.862 . 0 0 "[ . 1 . 2]" 1
1234 1 99 LYS H 1 99 LYS HB3 3.400 . 4.900 2.668 2.305 3.146 . 0 0 "[ . 1 . 2]" 1
1235 1 99 LYS H 1 99 LYS QE 4.600 . 6.000 5.543 3.802 6.093 0.093 9 0 "[ . 1 . 2]" 1
1236 1 99 LYS H 1 99 LYS QG 3.300 . 4.600 3.932 3.585 4.095 . 0 0 "[ . 1 . 2]" 1
1237 1 99 LYS H 1 106 TYR HB3 3.600 . 5.200 4.370 3.323 5.104 . 0 0 "[ . 1 . 2]" 1
1238 1 99 LYS H 1 106 TYR QD 3.600 . 5.200 3.591 2.934 4.267 . 0 0 "[ . 1 . 2]" 1
1239 1 99 LYS H 1 107 TRP HB2 3.900 . 5.800 5.803 4.792 5.958 0.158 11 0 "[ . 1 . 2]" 1
1240 1 99 LYS HA 1 105 SER H 3.900 . 5.800 5.333 4.886 5.740 . 0 0 "[ . 1 . 2]" 1
1241 1 99 LYS HA 1 106 TYR HA 1.700 . 2.200 2.283 1.956 2.377 0.177 16 0 "[ . 1 . 2]" 1
1242 1 99 LYS HA 1 106 TYR QD 1.800 . 2.200 1.820 1.373 2.229 0.029 9 0 "[ . 1 . 2]" 1
1243 1 99 LYS HA 1 106 TYR QE 4.400 . 6.000 3.712 3.284 4.016 . 0 0 "[ . 1 . 2]" 1
1244 1 99 LYS HA 1 107 TRP H 3.500 . 5.000 3.613 3.386 3.804 . 0 0 "[ . 1 . 2]" 1
1245 1 99 LYS HB2 1 100 ALA H 3.800 . 5.600 4.288 4.071 4.537 . 0 0 "[ . 1 . 2]" 1
1246 1 99 LYS HB3 1 100 ALA H 3.500 . 5.000 3.970 3.332 4.359 . 0 0 "[ . 1 . 2]" 1
1247 1 99 LYS HB3 1 106 TYR QD 4.500 . 6.000 3.878 3.445 4.519 . 0 0 "[ . 1 . 2]" 1
1248 1 99 LYS QE 1 100 ALA H 4.300 . 6.000 4.774 3.296 5.458 . 0 0 "[ . 1 . 2]" 1
1249 1 99 LYS QG 1 100 ALA H 3.100 . 4.100 2.787 2.210 3.496 . 0 0 "[ . 1 . 2]" 1
1250 1 99 LYS QG 1 105 SER H 3.700 . 5.400 4.446 3.896 5.105 . 0 0 "[ . 1 . 2]" 1
1251 1 99 LYS QG 1 106 TYR QD 2.900 . 3.900 2.443 1.825 3.718 0.075 16 0 "[ . 1 . 2]" 1
1252 1 99 LYS QG 1 106 TYR QE 2.800 . 3.700 2.173 1.857 3.116 0.043 6 0 "[ . 1 . 2]" 1
1253 1 100 ALA H 1 100 ALA MB 3.600 . 5.200 2.604 2.351 2.931 . 0 0 "[ . 1 . 2]" 1
1254 1 100 ALA H 1 101 LEU H 4.000 . 6.000 3.849 3.229 4.102 . 0 0 "[ . 1 . 2]" 1
1255 1 100 ALA H 1 105 SER H 3.100 . 4.300 3.905 3.202 4.413 0.113 19 0 "[ . 1 . 2]" 1
1256 1 100 ALA H 1 105 SER HA 3.600 . 5.200 4.965 4.640 5.282 0.082 14 0 "[ . 1 . 2]" 1
1257 1 100 ALA H 1 106 TYR HA 2.500 . 3.300 2.391 1.807 2.927 . 0 0 "[ . 1 . 2]" 1
1258 1 100 ALA H 1 106 TYR HB2 5.500 . 6.000 5.289 4.749 5.806 . 0 0 "[ . 1 . 2]" 1
1259 1 100 ALA H 1 106 TYR HB3 4.700 . 6.000 4.404 3.855 5.126 . 0 0 "[ . 1 . 2]" 1
1260 1 100 ALA H 1 106 TYR QD 3.500 . 5.100 3.594 2.797 4.255 . 0 0 "[ . 1 . 2]" 1
1261 1 100 ALA H 1 106 TYR QE 4.800 . 6.000 5.010 4.668 5.582 . 0 0 "[ . 1 . 2]" 1
1262 1 100 ALA H 1 107 TRP H 3.900 . 5.800 3.918 3.444 4.440 . 0 0 "[ . 1 . 2]" 1
1263 1 100 ALA H 1 107 TRP HE1 4.400 . 6.000 5.767 4.869 6.057 0.057 7 0 "[ . 1 . 2]" 1
1264 1 100 ALA HA 1 101 LEU H 3.200 . 4.500 2.440 2.143 2.839 . 0 0 "[ . 1 . 2]" 1
1265 1 100 ALA HA 1 107 TRP HE1 4.500 . 6.000 5.393 4.364 6.032 0.032 10 0 "[ . 1 . 2]" 1
1266 1 100 ALA MB 1 103 GLY H 3.600 . 5.200 4.691 3.042 6.024 0.824 13 1 "[ . 1 + . 2]" 1
1267 1 100 ALA MB 1 104 ASP H 3.700 . 5.500 5.088 4.018 6.423 0.923 14 2 "[ -. 1 +. 2]" 1
1268 1 100 ALA MB 1 105 SER H 2.500 . 6.000 4.014 3.168 5.178 . 0 0 "[ . 1 . 2]" 1
1269 1 100 ALA MB 1 105 SER H 3.300 . 6.000 4.002 3.137 5.408 . 0 0 "[ . 1 . 2]" 1
1270 1 100 ALA MB 1 107 TRP H 3.900 . 5.800 3.647 3.152 4.240 . 0 0 "[ . 1 . 2]" 1
1271 1 100 ALA MB 1 107 TRP HD1 2.200 . 2.800 1.787 1.576 2.150 0.024 7 0 "[ . 1 . 2]" 1
1272 1 100 ALA MB 1 107 TRP HE1 6.000 . 6.000 2.826 2.463 3.600 . 0 0 "[ . 1 . 2]" 1
1273 1 101 LEU H 1 101 LEU HA 2.500 . 3.300 2.855 2.285 2.947 . 0 0 "[ . 1 . 2]" 1
1274 1 101 LEU H 1 101 LEU HB2 3.500 . 5.100 3.026 2.334 4.056 . 0 0 "[ . 1 . 2]" 1
1275 1 101 LEU H 1 101 LEU HB3 3.200 . 4.500 3.068 2.420 3.804 . 0 0 "[ . 1 . 2]" 1
1276 1 101 LEU H 1 101 LEU QD 4.600 . 6.000 3.228 1.918 4.136 0.082 12 0 "[ . 1 . 2]" 1
1277 1 101 LEU H 1 101 LEU HG 4.200 . 6.000 3.999 2.412 4.811 . 0 0 "[ . 1 . 2]" 1
1278 1 101 LEU HA 1 102 SER H 3.400 . 4.900 2.973 2.012 3.510 . 0 0 "[ . 1 . 2]" 1
1279 1 101 LEU HA 1 103 GLY QA 2.400 . 6.000 5.312 4.431 5.924 . 0 0 "[ . 1 . 2]" 1
1280 1 101 LEU HB2 1 102 SER H 3.100 . 4.300 3.533 1.866 4.547 0.247 4 0 "[ . 1 . 2]" 1
1281 1 101 LEU HB3 1 102 SER H 3.200 . 4.500 3.268 1.800 4.560 0.100 3 0 "[ . 1 . 2]" 1
1282 1 101 LEU HB3 1 105 SER H 3.400 . 6.000 5.767 3.406 6.802 0.802 7 2 "[ . + 1 . - 2]" 1
1283 1 101 LEU MD1 1 102 SER H 4.100 . 6.000 3.823 2.549 5.154 . 0 0 "[ . 1 . 2]" 1
1284 1 101 LEU HG 1 102 SER H 3.600 . 5.200 3.822 1.989 4.898 0.011 14 0 "[ . 1 . 2]" 1
1285 1 102 SER H 1 102 SER HA 2.800 . 3.800 2.610 2.260 2.953 . 0 0 "[ . 1 . 2]" 1
1286 1 102 SER H 1 102 SER HB2 3.700 . 5.500 3.194 2.428 3.993 . 0 0 "[ . 1 . 2]" 1
1287 1 102 SER H 1 102 SER HB3 3.300 . 4.600 3.401 2.640 4.104 . 0 0 "[ . 1 . 2]" 1
1288 1 102 SER H 1 103 GLY H 3.700 . 5.400 3.168 2.191 4.415 . 0 0 "[ . 1 . 2]" 1
1289 1 102 SER HA 1 103 GLY H 2.900 . 3.900 2.739 2.157 3.558 . 0 0 "[ . 1 . 2]" 1
1290 1 102 SER HB2 1 103 GLY H 3.700 . 5.400 4.118 2.486 4.654 . 0 0 "[ . 1 . 2]" 1
1291 1 102 SER HB3 1 103 GLY H 5.900 . 6.000 4.109 1.842 4.698 . 0 0 "[ . 1 . 2]" 1
1292 1 103 GLY QA 1 104 ASP H 3.000 . 4.200 2.599 2.088 2.908 . 0 0 "[ . 1 . 2]" 1
1293 1 103 GLY QA 1 105 SER H 4.300 . 6.000 4.361 3.017 5.205 . 0 0 "[ . 1 . 2]" 1
1294 1 104 ASP H 1 104 ASP HA 2.700 . 3.600 2.495 2.248 2.928 . 0 0 "[ . 1 . 2]" 1
1295 1 104 ASP H 1 104 ASP QB 3.300 . 4.700 2.997 2.275 3.335 . 0 0 "[ . 1 . 2]" 1
1296 1 104 ASP H 1 105 SER H 3.000 . 4.200 3.086 2.164 4.245 0.045 6 0 "[ . 1 . 2]" 1
1297 1 104 ASP HA 1 105 SER H 2.200 . 2.800 2.467 2.111 2.936 0.136 19 0 "[ . 1 . 2]" 1
1298 1 104 ASP QB 1 105 SER H 3.600 . 5.200 3.915 3.700 4.034 . 0 0 "[ . 1 . 2]" 1
1299 1 104 ASP HB2 1 105 SER H 6.000 . 6.000 4.470 4.007 4.613 . 0 0 "[ . 1 . 2]" 1
1300 1 104 ASP HB3 1 105 SER H 6.000 . 6.000 4.340 4.079 4.536 . 0 0 "[ . 1 . 2]" 1
1301 1 105 SER H 1 105 SER HA 2.100 . 2.700 2.859 2.793 2.906 0.206 11 0 "[ . 1 . 2]" 1
1302 1 105 SER H 1 105 SER QB 3.300 . 4.600 3.106 2.643 3.422 . 0 0 "[ . 1 . 2]" 1
1303 1 105 SER HA 1 106 TYR H 2.600 . 3.500 2.588 2.230 2.820 . 0 0 "[ . 1 . 2]" 1
1304 1 105 SER HA 1 106 TYR QD 3.000 . 4.100 3.594 2.959 4.115 0.015 18 0 "[ . 1 . 2]" 1
1305 1 105 SER HA 1 106 TYR QE 4.800 . 6.000 3.983 3.473 4.520 . 0 0 "[ . 1 . 2]" 1
1306 1 105 SER QB 1 106 TYR H 3.600 . 4.100 2.373 1.860 3.495 0.140 5 0 "[ . 1 . 2]" 1
1307 1 106 TYR H 1 106 TYR HB2 3.000 . 4.100 2.745 2.497 2.931 . 0 0 "[ . 1 . 2]" 1
1308 1 106 TYR H 1 106 TYR HB3 3.900 . 5.800 3.747 3.660 3.831 . 0 0 "[ . 1 . 2]" 1
1309 1 106 TYR H 1 106 TYR QD 2.700 . 3.600 2.756 2.400 3.106 . 0 0 "[ . 1 . 2]" 1
1310 1 106 TYR H 1 106 TYR QE 4.300 . 6.000 4.466 4.100 5.029 . 0 0 "[ . 1 . 2]" 1
1311 1 106 TYR H 1 107 TRP H 4.100 . 6.000 4.402 4.308 4.482 . 0 0 "[ . 1 . 2]" 1
1312 1 106 TYR H 1 108 VAL HB 6.000 . 6.000 6.131 6.032 6.267 0.267 16 0 "[ . 1 . 2]" 1
1313 1 106 TYR HA 1 106 TYR QD 3.500 . 5.100 2.874 2.594 3.032 . 0 0 "[ . 1 . 2]" 1
1314 1 106 TYR HA 1 107 TRP H 2.200 . 2.800 2.281 2.191 2.373 . 0 0 "[ . 1 . 2]" 1
1315 1 106 TYR HB2 1 106 TYR QD 2.200 . 2.800 2.342 2.270 2.412 . 0 0 "[ . 1 . 2]" 1
1316 1 106 TYR HB2 1 106 TYR QE 4.400 . 6.000 4.397 4.378 4.430 . 0 0 "[ . 1 . 2]" 1
1317 1 106 TYR HB2 1 107 TRP H 3.500 . 5.000 3.606 3.330 4.019 . 0 0 "[ . 1 . 2]" 1
1318 1 106 TYR HB3 1 106 TYR QD 2.200 . 2.800 2.447 2.342 2.582 . 0 0 "[ . 1 . 2]" 1
1319 1 106 TYR HB3 1 107 TRP H 2.800 . 3.800 2.817 2.600 2.954 . 0 0 "[ . 1 . 2]" 1
1320 1 106 TYR QD 1 107 TRP H 3.600 . 5.200 4.230 3.854 4.429 . 0 0 "[ . 1 . 2]" 1
1321 1 106 TYR QD 1 108 VAL H 6.000 . 6.000 6.117 6.022 6.240 0.240 3 0 "[ . 1 . 2]" 1
1322 1 106 TYR QD 1 108 VAL HB 2.900 . 6.000 5.601 5.182 6.144 0.144 6 0 "[ . 1 . 2]" 1
1323 1 107 TRP H 1 107 TRP HA 2.900 . 4.000 2.929 2.922 2.937 . 0 0 "[ . 1 . 2]" 1
1324 1 107 TRP H 1 107 TRP HB2 2.700 . 3.600 2.335 2.247 2.397 . 0 0 "[ . 1 . 2]" 1
1325 1 107 TRP H 1 107 TRP HB3 3.400 . 4.900 3.573 3.485 3.615 . 0 0 "[ . 1 . 2]" 1
1326 1 107 TRP HA 1 107 TRP HD1 3.700 . 5.400 4.077 3.769 4.315 . 0 0 "[ . 1 . 2]" 1
1327 1 107 TRP HA 1 108 VAL H 2.200 . 2.800 2.126 2.072 2.192 . 0 0 "[ . 1 . 2]" 1
1328 1 107 TRP HB2 1 107 TRP HD1 3.000 . 4.100 2.624 2.554 2.738 . 0 0 "[ . 1 . 2]" 1
1329 1 107 TRP HB2 1 108 VAL H 3.800 . 5.600 4.491 4.416 4.564 . 0 0 "[ . 1 . 2]" 1
1330 1 107 TRP HB2 1 109 PHE HZ 5.400 . 6.000 3.829 3.106 4.625 . 0 0 "[ . 1 . 2]" 1
1331 1 107 TRP HB3 1 107 TRP HD1 3.400 . 4.800 3.771 3.682 3.854 . 0 0 "[ . 1 . 2]" 1
1332 1 107 TRP HB3 1 108 VAL H 3.700 . 5.400 3.738 3.631 3.865 . 0 0 "[ . 1 . 2]" 1
1333 1 107 TRP HH2 1 107 TRP HZ3 2.000 . 2.500 2.441 2.437 2.446 . 0 0 "[ . 1 . 2]" 1
1334 1 108 VAL H 1 108 VAL HB 2.600 . 3.500 2.658 2.114 2.904 . 0 0 "[ . 1 . 2]" 1
1335 1 108 VAL H 1 108 VAL MG2 3.900 . 5.800 3.580 2.555 3.780 . 0 0 "[ . 1 . 2]" 1
1336 1 108 VAL HA 1 108 VAL MG2 2.800 . 3.800 2.218 2.065 2.366 . 0 0 "[ . 1 . 2]" 1
1337 1 108 VAL HA 1 109 PHE H 2.200 . 2.800 2.117 2.075 2.195 . 0 0 "[ . 1 . 2]" 1
1338 1 108 VAL HA 1 110 VAL H 3.500 . 6.000 5.978 5.586 6.100 0.100 16 0 "[ . 1 . 2]" 1
1339 1 108 VAL HB 1 108 VAL MG2 2.000 . 6.000 2.110 2.100 2.115 . 0 0 "[ . 1 . 2]" 1
1340 1 108 VAL HB 1 109 PHE H 6.000 . 6.000 4.097 3.964 4.341 . 0 0 "[ . 1 . 2]" 1
1341 1 108 VAL MG2 1 109 PHE H 3.100 . 4.300 2.781 2.121 3.915 . 0 0 "[ . 1 . 2]" 1
1342 1 109 PHE H 1 109 PHE HA 3.000 . 4.200 2.940 2.929 2.953 . 0 0 "[ . 1 . 2]" 1
1343 1 109 PHE H 1 109 PHE HB2 2.800 . 3.800 2.573 2.442 2.757 . 0 0 "[ . 1 . 2]" 1
1344 1 109 PHE H 1 109 PHE QB 3.600 . 6.000 2.528 2.408 2.698 . 0 0 "[ . 1 . 2]" 1
1345 1 109 PHE H 1 109 PHE HB3 4.000 . 6.000 3.713 3.654 3.832 . 0 0 "[ . 1 . 2]" 1
1346 1 109 PHE H 1 109 PHE QD 3.300 . 4.700 2.805 2.562 3.403 . 0 0 "[ . 1 . 2]" 1
1347 1 109 PHE H 1 110 VAL HA 5.000 . 6.000 4.955 4.671 5.111 . 0 0 "[ . 1 . 2]" 1
1348 1 109 PHE H 1 110 VAL QG 4.000 . 6.000 4.221 3.871 4.538 . 0 0 "[ . 1 . 2]" 1
1349 1 109 PHE HA 1 109 PHE HB3 2.700 . 3.600 2.460 2.361 2.522 . 0 0 "[ . 1 . 2]" 1
1350 1 109 PHE HA 1 109 PHE QD 2.700 . 3.600 2.802 2.266 3.006 . 0 0 "[ . 1 . 2]" 1
1351 1 109 PHE HA 1 110 VAL H 2.200 . 2.800 2.156 2.087 2.234 . 0 0 "[ . 1 . 2]" 1
1352 1 109 PHE HB2 1 109 PHE QD 2.500 . 3.300 2.335 2.253 2.411 . 0 0 "[ . 1 . 2]" 1
1353 1 109 PHE HB2 1 110 VAL H 6.000 . 6.000 4.118 3.850 4.347 . 0 0 "[ . 1 . 2]" 1
1354 1 109 PHE HB3 1 109 PHE QD 2.300 . 3.000 2.451 2.356 2.673 . 0 0 "[ . 1 . 2]" 1
1355 1 109 PHE HB3 1 110 VAL H 5.000 . 6.000 3.222 2.933 3.618 . 0 0 "[ . 1 . 2]" 1
1356 1 109 PHE QD 1 110 VAL QG 3.400 . 6.000 4.940 4.594 5.216 . 0 0 "[ . 1 . 2]" 1
1357 1 110 VAL H 1 110 VAL HB 3.900 . 5.800 2.899 2.334 3.660 . 0 0 "[ . 1 . 2]" 1
1358 1 110 VAL H 1 110 VAL QG 4.200 . 6.000 2.098 1.737 2.389 0.263 20 0 "[ . 1 . 2]" 1
1359 1 110 VAL HA 1 111 LYS H 2.300 . 2.900 2.175 2.108 2.276 . 0 0 "[ . 1 . 2]" 1
1360 1 110 VAL QG 1 111 LYS H 3.700 . 5.400 3.051 2.181 3.529 . 0 0 "[ . 1 . 2]" 1
1361 1 111 LYS H 1 111 LYS HA 3.000 . 4.100 2.931 2.853 2.950 . 0 0 "[ . 1 . 2]" 1
1362 1 111 LYS H 1 111 LYS HB2 4.400 . 6.000 3.132 2.462 3.985 . 0 0 "[ . 1 . 2]" 1
1363 1 111 LYS H 1 111 LYS HB3 4.200 . 6.000 3.132 2.454 3.871 . 0 0 "[ . 1 . 2]" 1
1364 1 111 LYS H 1 111 LYS HD2 4.200 . 6.000 4.929 2.589 6.065 0.065 20 0 "[ . 1 . 2]" 1
1365 1 111 LYS H 1 111 LYS HD3 5.000 . 6.000 4.864 2.213 5.889 . 0 0 "[ . 1 . 2]" 1
1366 1 111 LYS H 1 111 LYS QG 3.700 . 5.400 3.377 2.343 4.211 . 0 0 "[ . 1 . 2]" 1
1367 1 111 LYS H 1 112 ARG H 4.500 . 6.000 4.278 3.957 4.414 . 0 0 "[ . 1 . 2]" 1
1368 1 111 LYS HA 1 112 ARG H 2.300 . 3.000 2.198 2.101 2.419 . 0 0 "[ . 1 . 2]" 1
1369 1 111 LYS HD2 1 112 ARG H 3.700 . 5.400 4.600 2.314 6.027 0.627 8 3 "[ . +-1 * . 2]" 1
1370 1 111 LYS HD3 1 112 ARG H 4.200 . 6.000 4.952 3.915 5.934 . 0 0 "[ . 1 . 2]" 1
1371 1 112 ARG H 1 112 ARG HA 2.900 . 3.900 2.865 2.791 2.932 . 0 0 "[ . 1 . 2]" 1
1372 1 112 ARG H 1 112 ARG HB2 2.600 . 3.400 2.853 2.120 3.687 0.287 13 0 "[ . 1 . 2]" 1
1373 1 112 ARG H 1 112 ARG HB3 2.900 . 4.000 2.890 2.325 3.632 . 0 0 "[ . 1 . 2]" 1
1374 1 112 ARG H 1 112 ARG QD 4.200 . 6.000 4.137 2.071 4.720 . 0 0 "[ . 1 . 2]" 1
1375 1 112 ARG H 1 112 ARG QG 3.100 . 4.300 3.018 1.880 4.000 0.020 5 0 "[ . 1 . 2]" 1
1376 1 112 ARG H 1 113 VAL H 4.300 . 6.000 4.500 4.165 4.619 . 0 0 "[ . 1 . 2]" 1
1377 1 112 ARG HA 1 113 VAL H 2.200 . 2.800 2.199 2.083 2.421 . 0 0 "[ . 1 . 2]" 1
1378 1 112 ARG HB2 1 113 VAL H 3.400 . 4.900 3.812 2.406 4.569 . 0 0 "[ . 1 . 2]" 1
1379 1 112 ARG HB3 1 113 VAL H 3.100 . 4.300 3.876 2.881 4.341 0.041 9 0 "[ . 1 . 2]" 1
1380 1 112 ARG QG 1 113 VAL H 3.500 . 5.100 3.520 2.304 4.304 . 0 0 "[ . 1 . 2]" 1
1381 1 113 VAL H 1 113 VAL HA 2.400 . 3.100 2.822 2.256 2.947 . 0 0 "[ . 1 . 2]" 1
1382 1 113 VAL H 1 113 VAL HB 3.200 . 4.500 3.236 2.408 3.810 . 0 0 "[ . 1 . 2]" 1
1383 1 113 VAL HA 1 113 VAL MG2 2.400 . 6.000 2.755 2.255 3.120 . 0 0 "[ . 1 . 2]" 1
1384 1 113 VAL HB 1 113 VAL MG2 2.300 . 3.000 2.119 2.109 2.125 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Sunday, July 7, 2024 9:30:54 AM GMT (wattos1)