NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
531766 |
2lel   |
17716 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lel
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 1123
_Distance_constraint_stats_list.Viol_count 1809
_Distance_constraint_stats_list.Viol_total 2479.647
_Distance_constraint_stats_list.Viol_max 0.387
_Distance_constraint_stats_list.Viol_rms 0.0266
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0055
_Distance_constraint_stats_list.Viol_average_violations_only 0.0685
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 7 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 LYS 8.180 0.387 18 0 "[ . 1 . 2]"
1 9 THR 0.525 0.151 18 0 "[ . 1 . 2]"
1 10 TYR 12.555 0.346 20 0 "[ . 1 . 2]"
1 11 ASP 3.467 0.194 6 0 "[ . 1 . 2]"
1 12 LEU 15.224 0.346 20 0 "[ . 1 . 2]"
1 13 GLN 2.006 0.145 7 0 "[ . 1 . 2]"
1 14 ASP 0.728 0.070 7 0 "[ . 1 . 2]"
1 15 GLY 0.167 0.031 10 0 "[ . 1 . 2]"
1 16 SER 0.360 0.051 9 0 "[ . 1 . 2]"
1 17 LYS 1.882 0.143 9 0 "[ . 1 . 2]"
1 18 VAL 11.744 0.277 9 0 "[ . 1 . 2]"
1 19 HIS 4.288 0.234 8 0 "[ . 1 . 2]"
1 20 VAL 14.290 0.303 3 0 "[ . 1 . 2]"
1 21 PHE 0.938 0.092 7 0 "[ . 1 . 2]"
1 22 LYS 0.131 0.079 10 0 "[ . 1 . 2]"
1 23 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 GLY 1.040 0.155 17 0 "[ . 1 . 2]"
1 25 LYS 7.421 0.228 11 0 "[ . 1 . 2]"
1 26 MET 20.919 0.387 18 0 "[ . 1 . 2]"
1 27 GLY 5.974 0.274 9 0 "[ . 1 . 2]"
1 28 MET 5.917 0.191 18 0 "[ . 1 . 2]"
1 29 GLU 1.260 0.066 19 0 "[ . 1 . 2]"
1 30 ASN 1.272 0.109 18 0 "[ . 1 . 2]"
1 31 LYS 0.736 0.054 11 0 "[ . 1 . 2]"
1 32 PHE 0.675 0.054 11 0 "[ . 1 . 2]"
1 33 GLY 0.064 0.025 1 0 "[ . 1 . 2]"
1 34 LYS 0.195 0.040 11 0 "[ . 1 . 2]"
1 35 SER 0.060 0.037 15 0 "[ . 1 . 2]"
1 36 MET 2.983 0.199 11 0 "[ . 1 . 2]"
1 37 ASN 1.792 0.111 17 0 "[ . 1 . 2]"
1 38 MET 9.070 0.305 20 0 "[ . 1 . 2]"
1 39 PRO 4.578 0.259 7 0 "[ . 1 . 2]"
1 40 GLU 1.899 0.122 13 0 "[ . 1 . 2]"
1 41 GLY 1.876 0.163 17 0 "[ . 1 . 2]"
1 42 LYS 13.032 0.285 10 0 "[ . 1 . 2]"
1 43 VAL 4.465 0.218 1 0 "[ . 1 . 2]"
1 44 MET 10.908 0.312 13 0 "[ . 1 . 2]"
1 45 GLU 1.172 0.161 19 0 "[ . 1 . 2]"
1 46 THR 7.370 0.219 9 0 "[ . 1 . 2]"
1 47 ARG 0.791 0.177 15 0 "[ . 1 . 2]"
1 48 ASP 0.009 0.009 8 0 "[ . 1 . 2]"
1 49 GLY 0.022 0.014 12 0 "[ . 1 . 2]"
1 50 THR 3.451 0.154 15 0 "[ . 1 . 2]"
1 51 LYS 1.514 0.148 19 0 "[ . 1 . 2]"
1 52 ILE 20.893 0.312 13 0 "[ . 1 . 2]"
1 53 ILE 4.783 0.251 8 0 "[ . 1 . 2]"
1 54 MET 8.747 0.184 17 0 "[ . 1 . 2]"
1 55 LYS 5.516 0.183 9 0 "[ . 1 . 2]"
1 56 GLY 5.655 0.228 11 0 "[ . 1 . 2]"
1 57 ASN 1.455 0.069 9 0 "[ . 1 . 2]"
1 58 GLU 1.146 0.121 6 0 "[ . 1 . 2]"
1 59 ILE 2.178 0.159 15 0 "[ . 1 . 2]"
1 60 PHE 0.231 0.092 5 0 "[ . 1 . 2]"
1 61 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 LEU 1.417 0.208 15 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 7 VAL HA 1 7 VAL MG1 3.160 . 4.520 2.529 2.239 3.193 . 0 0 "[ . 1 . 2]" 1
2 1 7 VAL HA 1 7 VAL MG2 3.060 . 4.320 2.758 2.265 3.194 . 0 0 "[ . 1 . 2]" 1
3 1 7 VAL MG1 1 7 VAL MG2 2.780 . 3.760 2.067 2.044 2.081 . 0 0 "[ . 1 . 2]" 1
4 1 8 LYS H 1 8 LYS HB2 3.450 . 5.100 2.992 2.492 3.460 . 0 0 "[ . 1 . 2]" 1
5 1 8 LYS H 1 8 LYS HB3 3.450 . 5.100 2.900 2.474 3.200 . 0 0 "[ . 1 . 2]" 1
6 1 8 LYS H 1 8 LYS QD 3.650 . 5.500 4.629 4.042 5.316 . 0 0 "[ . 1 . 2]" 1
7 1 8 LYS H 1 20 VAL H 3.560 . 5.320 4.174 3.647 4.766 . 0 0 "[ . 1 . 2]" 1
8 1 8 LYS H 1 20 VAL MG1 3.590 . 5.380 5.009 4.501 5.397 0.017 3 0 "[ . 1 . 2]" 1
9 1 8 LYS H 1 20 VAL MG2 3.650 . 5.500 4.034 3.234 4.491 . 0 0 "[ . 1 . 2]" 1
10 1 8 LYS HA 1 8 LYS QD 3.040 . 4.280 2.819 2.280 3.999 . 0 0 "[ . 1 . 2]" 1
11 1 8 LYS HA 1 8 LYS HG2 3.450 . 5.100 3.620 3.387 3.697 . 0 0 "[ . 1 . 2]" 1
12 1 8 LYS HA 1 8 LYS HG3 3.440 . 5.080 2.490 2.321 2.732 . 0 0 "[ . 1 . 2]" 1
13 1 8 LYS HA 1 20 VAL H 3.650 . 5.500 4.956 4.719 5.570 0.070 12 0 "[ . 1 . 2]" 1
14 1 8 LYS HB2 1 8 LYS HE2 3.650 . 5.500 3.499 2.326 4.641 . 0 0 "[ . 1 . 2]" 1
15 1 8 LYS HB2 1 9 THR H 3.460 . 5.120 4.193 3.966 4.381 . 0 0 "[ . 1 . 2]" 1
16 1 8 LYS HB2 1 10 TYR QE 3.430 . 5.060 5.012 4.772 5.295 0.235 18 0 "[ . 1 . 2]" 1
17 1 8 LYS HB2 1 20 VAL H 3.650 . 5.500 3.642 3.179 4.787 . 0 0 "[ . 1 . 2]" 1
18 1 8 LYS HB2 1 20 VAL MG1 2.930 . 4.060 3.418 2.797 3.919 . 0 0 "[ . 1 . 2]" 1
19 1 8 LYS HB3 1 9 THR H 3.550 . 5.300 3.865 3.638 4.133 . 0 0 "[ . 1 . 2]" 1
20 1 8 LYS HB3 1 10 TYR QE 3.650 . 5.500 4.542 4.143 4.966 . 0 0 "[ . 1 . 2]" 1
21 1 8 LYS HB3 1 20 VAL HB 3.210 . 4.620 4.653 4.524 4.792 0.172 17 0 "[ . 1 . 2]" 1
22 1 8 LYS HB3 1 20 VAL MG1 3.150 . 4.500 2.523 2.272 2.914 . 0 0 "[ . 1 . 2]" 1
23 1 8 LYS HE2 1 8 LYS HG2 3.380 . 4.960 3.196 2.279 4.236 . 0 0 "[ . 1 . 2]" 1
24 1 8 LYS HE2 1 8 LYS HG3 3.490 . 5.180 3.239 2.342 4.242 . 0 0 "[ . 1 . 2]" 1
25 1 8 LYS HE3 1 8 LYS HG2 3.450 . 5.100 3.250 2.310 3.823 . 0 0 "[ . 1 . 2]" 1
26 1 8 LYS HE3 1 8 LYS HG3 3.490 . 5.180 3.144 2.308 4.221 . 0 0 "[ . 1 . 2]" 1
27 1 8 LYS HG2 1 9 THR H 3.440 . 5.080 3.749 3.085 4.221 . 0 0 "[ . 1 . 2]" 1
28 1 8 LYS HG2 1 10 TYR QD 3.650 . 5.500 3.859 2.933 5.091 . 0 0 "[ . 1 . 2]" 1
29 1 8 LYS HG2 1 10 TYR QE 3.650 . 5.500 2.669 2.335 3.364 . 0 0 "[ . 1 . 2]" 1
30 1 8 LYS HG2 1 19 HIS HA 3.110 . 4.420 4.396 3.257 4.654 0.234 8 0 "[ . 1 . 2]" 1
31 1 8 LYS HG2 1 26 MET HA 3.650 . 5.500 5.732 5.609 5.887 0.387 18 0 "[ . 1 . 2]" 1
32 1 8 LYS HG3 1 9 THR H 3.650 . 5.500 2.197 1.828 2.614 . 0 0 "[ . 1 . 2]" 1
33 1 8 LYS HG3 1 10 TYR QD 3.650 . 5.500 3.984 3.494 4.462 . 0 0 "[ . 1 . 2]" 1
34 1 8 LYS HG3 1 10 TYR QE 3.620 . 5.440 3.303 2.397 3.785 . 0 0 "[ . 1 . 2]" 1
35 1 9 THR HA 1 9 THR MG 2.910 . 4.020 2.380 2.200 3.184 . 0 0 "[ . 1 . 2]" 1
36 1 9 THR MG 1 10 TYR H 2.520 . 3.240 3.021 2.178 3.391 0.151 18 0 "[ . 1 . 2]" 1
37 1 10 TYR H 1 10 TYR HB2 2.870 . 3.940 2.590 2.378 2.978 . 0 0 "[ . 1 . 2]" 1
38 1 10 TYR H 1 10 TYR HB3 2.980 . 4.160 3.727 3.619 3.929 . 0 0 "[ . 1 . 2]" 1
39 1 10 TYR H 1 10 TYR QD 3.300 . 4.800 3.389 2.837 3.770 . 0 0 "[ . 1 . 2]" 1
40 1 10 TYR H 1 12 LEU MD1 3.210 . 4.620 4.525 4.279 4.700 0.080 17 0 "[ . 1 . 2]" 1
41 1 10 TYR H 1 18 VAL H 3.080 . 4.350 2.936 2.704 3.301 . 0 0 "[ . 1 . 2]" 1
42 1 10 TYR H 1 18 VAL HB 3.650 . 5.500 3.537 2.392 4.798 . 0 0 "[ . 1 . 2]" 1
43 1 10 TYR H 1 18 VAL MG2 2.820 . 3.840 3.624 3.387 3.896 0.056 14 0 "[ . 1 . 2]" 1
44 1 10 TYR H 1 52 ILE MD 3.640 . 5.480 4.822 4.397 5.536 0.056 5 0 "[ . 1 . 2]" 1
45 1 10 TYR HA 1 10 TYR HB2 2.970 . 4.140 3.021 3.005 3.031 . 0 0 "[ . 1 . 2]" 1
46 1 10 TYR HA 1 10 TYR HB3 2.690 . 3.580 2.486 2.348 2.572 . 0 0 "[ . 1 . 2]" 1
47 1 10 TYR HA 1 10 TYR QE 3.650 . 5.500 4.397 4.297 4.604 . 0 0 "[ . 1 . 2]" 1
48 1 10 TYR HA 1 18 VAL MG2 3.260 . 4.720 4.671 4.439 4.841 0.121 3 0 "[ . 1 . 2]" 1
49 1 10 TYR HA 1 52 ILE MD 3.650 . 5.500 4.113 3.842 4.379 . 0 0 "[ . 1 . 2]" 1
50 1 10 TYR HA 1 52 ILE MG 3.650 . 5.500 5.356 4.638 5.602 0.102 8 0 "[ . 1 . 2]" 1
51 1 10 TYR HB2 1 10 TYR QD 2.720 . 3.640 2.325 2.309 2.373 . 0 0 "[ . 1 . 2]" 1
52 1 10 TYR HB2 1 10 TYR QE 3.470 . 5.140 4.427 4.418 4.431 . 0 0 "[ . 1 . 2]" 1
53 1 10 TYR HB2 1 11 ASP H 3.330 . 4.860 4.414 4.213 4.548 . 0 0 "[ . 1 . 2]" 1
54 1 10 TYR HB2 1 18 VAL H 3.330 . 4.860 2.881 2.515 3.261 . 0 0 "[ . 1 . 2]" 1
55 1 10 TYR HB2 1 46 THR MG 2.640 . 3.480 3.414 3.068 3.584 0.104 9 0 "[ . 1 . 2]" 1
56 1 10 TYR HB2 1 52 ILE MD 3.090 . 4.380 2.788 2.341 3.705 . 0 0 "[ . 1 . 2]" 1
57 1 10 TYR HB2 1 52 ILE MG 3.220 . 4.640 4.385 3.658 4.687 0.047 10 0 "[ . 1 . 2]" 1
58 1 10 TYR HB3 1 10 TYR QD 2.690 . 3.580 2.650 2.533 2.789 . 0 0 "[ . 1 . 2]" 1
59 1 10 TYR HB3 1 18 VAL H 3.490 . 5.180 4.252 3.807 4.858 . 0 0 "[ . 1 . 2]" 1
60 1 10 TYR HB3 1 46 THR MG 2.580 . 3.360 2.085 2.034 2.167 . 0 0 "[ . 1 . 2]" 1
61 1 10 TYR HB3 1 52 ILE MD 3.310 . 4.820 2.197 2.043 2.547 . 0 0 "[ . 1 . 2]" 1
62 1 10 TYR HB3 1 52 ILE MG 3.230 . 4.660 3.871 3.166 4.155 . 0 0 "[ . 1 . 2]" 1
63 1 10 TYR QD 1 11 ASP H 3.170 . 4.540 4.070 3.759 4.419 . 0 0 "[ . 1 . 2]" 1
64 1 10 TYR QD 1 12 LEU MD1 3.340 . 4.880 4.137 3.822 4.342 . 0 0 "[ . 1 . 2]" 1
65 1 10 TYR QD 1 12 LEU MD2 3.650 . 5.500 5.721 5.545 5.846 0.346 20 0 "[ . 1 . 2]" 1
66 1 10 TYR QD 1 18 VAL H 3.650 . 5.500 4.238 3.448 4.643 . 0 0 "[ . 1 . 2]" 1
67 1 10 TYR QD 1 18 VAL MG1 3.200 . 4.600 3.413 2.455 3.901 . 0 0 "[ . 1 . 2]" 1
68 1 10 TYR QD 1 20 VAL MG1 2.760 . 3.720 3.429 2.793 3.628 . 0 0 "[ . 1 . 2]" 1
69 1 10 TYR QD 1 20 VAL MG2 3.650 . 5.500 5.476 4.636 5.697 0.197 12 0 "[ . 1 . 2]" 1
70 1 10 TYR QD 1 26 MET ME 3.290 . 4.780 4.436 3.647 4.864 0.084 20 0 "[ . 1 . 2]" 1
71 1 10 TYR QD 1 27 GLY H 3.570 . 5.340 5.510 5.411 5.614 0.274 9 0 "[ . 1 . 2]" 1
72 1 10 TYR QD 1 46 THR MG 2.630 . 3.460 2.652 2.055 3.525 0.065 17 0 "[ . 1 . 2]" 1
73 1 10 TYR QD 1 50 THR MG 3.430 . 5.060 4.183 3.447 5.092 0.032 17 0 "[ . 1 . 2]" 1
74 1 10 TYR QD 1 52 ILE MD 2.850 . 3.900 2.689 2.062 3.158 . 0 0 "[ . 1 . 2]" 1
75 1 10 TYR QD 1 52 ILE MG 3.570 . 5.340 3.371 2.845 3.625 . 0 0 "[ . 1 . 2]" 1
76 1 10 TYR QE 1 18 VAL MG1 3.650 . 5.500 4.550 3.182 4.994 . 0 0 "[ . 1 . 2]" 1
77 1 10 TYR QE 1 20 VAL MG1 2.630 . 3.460 2.440 2.026 2.849 . 0 0 "[ . 1 . 2]" 1
78 1 10 TYR QE 1 20 VAL MG2 3.590 . 5.380 4.165 3.179 4.586 . 0 0 "[ . 1 . 2]" 1
79 1 10 TYR QE 1 26 MET ME 3.480 . 5.160 3.437 2.335 4.196 . 0 0 "[ . 1 . 2]" 1
80 1 10 TYR QE 1 46 THR MG 3.300 . 4.800 4.272 3.724 4.884 0.084 18 0 "[ . 1 . 2]" 1
81 1 10 TYR QE 1 50 THR MG 3.480 . 5.160 3.820 2.833 5.291 0.131 17 0 "[ . 1 . 2]" 1
82 1 10 TYR QE 1 52 ILE MD 3.000 . 4.200 3.765 3.467 4.152 . 0 0 "[ . 1 . 2]" 1
83 1 10 TYR QE 1 52 ILE MG 3.650 . 5.500 3.310 2.742 3.768 . 0 0 "[ . 1 . 2]" 1
84 1 11 ASP H 1 11 ASP HA 2.530 . 3.260 2.829 2.749 2.899 . 0 0 "[ . 1 . 2]" 1
85 1 11 ASP H 1 11 ASP HB2 2.590 . 3.380 2.400 2.329 2.704 . 0 0 "[ . 1 . 2]" 1
86 1 11 ASP H 1 11 ASP HB3 2.650 . 3.500 3.571 3.563 3.584 0.084 7 0 "[ . 1 . 2]" 1
87 1 11 ASP H 1 46 THR MG 3.310 . 4.820 3.647 2.571 4.557 . 0 0 "[ . 1 . 2]" 1
88 1 11 ASP HA 1 17 LYS HA 2.990 . 4.180 3.289 2.859 3.820 . 0 0 "[ . 1 . 2]" 1
89 1 11 ASP HA 1 17 LYS HG3 3.650 . 5.500 4.314 3.096 5.541 0.041 10 0 "[ . 1 . 2]" 1
90 1 11 ASP HB2 1 12 LEU H 3.310 . 4.820 4.502 4.357 4.529 . 0 0 "[ . 1 . 2]" 1
91 1 11 ASP HB2 1 47 ARG H 3.650 . 5.500 3.240 2.634 3.496 . 0 0 "[ . 1 . 2]" 1
92 1 11 ASP HB2 1 47 ARG HB2 3.650 . 5.500 4.060 2.355 5.359 . 0 0 "[ . 1 . 2]" 1
93 1 11 ASP HB2 1 47 ARG HB3 3.580 . 5.360 4.618 2.436 5.389 0.029 6 0 "[ . 1 . 2]" 1
94 1 11 ASP HB2 1 47 ARG QD 3.250 . 4.700 3.127 2.326 3.678 . 0 0 "[ . 1 . 2]" 1
95 1 11 ASP HB2 1 47 ARG HG3 3.420 . 5.040 3.584 2.636 4.760 . 0 0 "[ . 1 . 2]" 1
96 1 11 ASP HB3 1 12 LEU H 2.830 . 3.860 3.955 3.890 4.054 0.194 6 0 "[ . 1 . 2]" 1
97 1 11 ASP HB3 1 47 ARG H 3.580 . 5.360 3.878 3.655 4.453 . 0 0 "[ . 1 . 2]" 1
98 1 11 ASP HB3 1 47 ARG HB3 3.650 . 5.500 4.682 2.947 5.522 0.022 6 0 "[ . 1 . 2]" 1
99 1 11 ASP HB3 1 47 ARG QD 3.180 . 4.560 2.877 2.192 4.037 . 0 0 "[ . 1 . 2]" 1
100 1 11 ASP HB3 1 47 ARG HG3 3.380 . 4.960 3.694 2.462 4.969 0.009 18 0 "[ . 1 . 2]" 1
101 1 12 LEU H 1 12 LEU HA 2.830 . 3.850 2.846 2.790 2.877 . 0 0 "[ . 1 . 2]" 1
102 1 12 LEU H 1 12 LEU HB2 2.490 . 3.180 2.070 2.057 2.105 . 0 0 "[ . 1 . 2]" 1
103 1 12 LEU H 1 12 LEU HB3 2.610 . 3.420 3.333 3.223 3.434 0.014 12 0 "[ . 1 . 2]" 1
104 1 12 LEU H 1 12 LEU MD1 2.820 . 3.840 2.628 2.221 2.935 . 0 0 "[ . 1 . 2]" 1
105 1 12 LEU H 1 12 LEU MD2 2.970 . 4.140 3.866 3.644 4.027 . 0 0 "[ . 1 . 2]" 1
106 1 12 LEU H 1 13 GLN H 3.430 . 5.060 4.628 4.611 4.643 . 0 0 "[ . 1 . 2]" 1
107 1 12 LEU H 1 14 ASP H 3.650 . 5.500 5.008 4.786 5.186 . 0 0 "[ . 1 . 2]" 1
108 1 12 LEU H 1 16 SER H 3.500 . 5.200 4.741 4.562 4.952 . 0 0 "[ . 1 . 2]" 1
109 1 12 LEU H 1 17 LYS H 3.650 . 5.500 4.710 4.475 4.885 . 0 0 "[ . 1 . 2]" 1
110 1 12 LEU H 1 17 LYS HA 2.870 . 3.940 2.543 2.236 2.808 . 0 0 "[ . 1 . 2]" 1
111 1 12 LEU H 1 18 VAL MG2 3.510 . 5.220 3.969 3.455 4.359 . 0 0 "[ . 1 . 2]" 1
112 1 12 LEU H 1 28 MET ME 3.650 . 5.500 5.494 5.236 5.691 0.191 18 0 "[ . 1 . 2]" 1
113 1 12 LEU HA 1 12 LEU MD1 2.510 . 3.220 2.144 2.102 2.197 . 0 0 "[ . 1 . 2]" 1
114 1 12 LEU HA 1 12 LEU MD2 3.240 . 4.680 3.758 3.725 3.783 . 0 0 "[ . 1 . 2]" 1
115 1 12 LEU HA 1 12 LEU HG 3.330 . 4.860 2.567 2.437 2.665 . 0 0 "[ . 1 . 2]" 1
116 1 12 LEU HA 1 14 ASP H 3.560 . 5.320 3.923 3.671 4.105 . 0 0 "[ . 1 . 2]" 1
117 1 12 LEU HA 1 16 SER H 5.000 . 8.000 5.634 5.526 5.767 . 0 0 "[ . 1 . 2]" 1
118 1 12 LEU HA 1 45 GLU H 3.560 . 5.320 4.364 3.821 4.621 . 0 0 "[ . 1 . 2]" 1
119 1 12 LEU HB2 1 12 LEU MD1 2.430 . 3.060 2.420 2.289 2.489 . 0 0 "[ . 1 . 2]" 1
120 1 12 LEU HB2 1 12 LEU MD2 2.460 . 3.110 2.249 2.201 2.377 . 0 0 "[ . 1 . 2]" 1
121 1 12 LEU HB2 1 14 ASP H 2.820 . 3.840 3.869 3.843 3.910 0.070 7 0 "[ . 1 . 2]" 1
122 1 12 LEU HB2 1 15 GLY H 3.230 . 4.660 4.653 4.549 4.691 0.031 10 0 "[ . 1 . 2]" 1
123 1 12 LEU HB2 1 16 SER H 3.050 . 4.300 3.654 3.522 3.827 . 0 0 "[ . 1 . 2]" 1
124 1 12 LEU HB2 1 17 LYS HA 2.920 . 4.040 2.986 2.338 3.443 . 0 0 "[ . 1 . 2]" 1
125 1 12 LEU HB2 1 18 VAL MG2 3.650 . 5.500 3.573 3.357 3.810 . 0 0 "[ . 1 . 2]" 1
126 1 12 LEU HB2 1 28 MET ME 3.220 . 4.640 3.929 3.740 4.108 . 0 0 "[ . 1 . 2]" 1
127 1 12 LEU HB3 1 12 LEU MD1 2.650 . 3.500 3.226 3.213 3.234 . 0 0 "[ . 1 . 2]" 1
128 1 12 LEU HB3 1 12 LEU MD2 2.500 . 3.200 2.455 2.311 2.529 . 0 0 "[ . 1 . 2]" 1
129 1 12 LEU HB3 1 12 LEU HG 2.950 . 4.100 2.425 2.378 2.489 . 0 0 "[ . 1 . 2]" 1
130 1 12 LEU HB3 1 13 GLN H 3.250 . 4.700 2.888 2.606 3.329 . 0 0 "[ . 1 . 2]" 1
131 1 12 LEU HB3 1 14 ASP H 2.840 . 3.880 2.193 2.151 2.225 . 0 0 "[ . 1 . 2]" 1
132 1 12 LEU HB3 1 15 GLY H 3.300 . 4.800 3.690 3.419 3.856 . 0 0 "[ . 1 . 2]" 1
133 1 12 LEU HB3 1 16 SER H 2.850 . 3.900 3.200 2.925 3.479 . 0 0 "[ . 1 . 2]" 1
134 1 12 LEU HB3 1 16 SER HB3 3.420 . 5.040 4.466 3.017 4.927 . 0 0 "[ . 1 . 2]" 1
135 1 12 LEU HB3 1 17 LYS HA 3.430 . 5.060 4.707 4.078 5.111 0.051 6 0 "[ . 1 . 2]" 1
136 1 12 LEU HB3 1 18 VAL MG2 3.650 . 5.500 4.655 4.467 4.790 . 0 0 "[ . 1 . 2]" 1
137 1 12 LEU MD1 1 12 LEU MD2 2.510 . 3.220 2.011 1.955 2.084 . 0 0 "[ . 1 . 2]" 1
138 1 12 LEU MD1 1 13 GLN H 2.820 . 3.840 3.728 3.480 3.892 0.052 1 0 "[ . 1 . 2]" 1
139 1 12 LEU MD1 1 14 ASP H 3.650 . 5.500 4.726 4.475 4.883 . 0 0 "[ . 1 . 2]" 1
140 1 12 LEU MD1 1 16 SER H 3.650 . 5.500 5.504 5.398 5.551 0.051 9 0 "[ . 1 . 2]" 1
141 1 12 LEU MD1 1 17 LYS H 3.650 . 5.500 5.077 4.563 5.362 . 0 0 "[ . 1 . 2]" 1
142 1 12 LEU MD1 1 17 LYS HA 3.460 . 5.120 3.339 2.456 3.945 . 0 0 "[ . 1 . 2]" 1
143 1 12 LEU MD1 1 18 VAL H 3.500 . 5.200 3.013 2.281 3.414 . 0 0 "[ . 1 . 2]" 1
144 1 12 LEU MD1 1 18 VAL HB 3.450 . 5.100 3.979 3.786 4.109 . 0 0 "[ . 1 . 2]" 1
145 1 12 LEU MD1 1 18 VAL MG1 3.460 . 5.120 3.882 3.644 3.976 . 0 0 "[ . 1 . 2]" 1
146 1 12 LEU MD1 1 18 VAL MG2 2.460 . 3.110 1.873 1.828 1.892 . 0 0 "[ . 1 . 2]" 1
147 1 12 LEU MD1 1 28 MET ME 3.010 . 4.220 3.976 3.349 4.190 . 0 0 "[ . 1 . 2]" 1
148 1 12 LEU MD1 1 38 MET ME 3.400 . 5.000 5.211 4.964 5.305 0.305 20 0 "[ . 1 . 2]" 1
149 1 12 LEU MD1 1 44 MET HA 3.420 . 5.040 4.113 3.450 4.361 . 0 0 "[ . 1 . 2]" 1
150 1 12 LEU MD1 1 44 MET HB2 3.250 . 4.700 2.805 2.463 3.568 . 0 0 "[ . 1 . 2]" 1
151 1 12 LEU MD1 1 44 MET HB3 2.980 . 4.160 2.285 2.125 2.716 . 0 0 "[ . 1 . 2]" 1
152 1 12 LEU MD1 1 44 MET ME 2.410 . 3.020 3.080 3.026 3.142 0.122 10 0 "[ . 1 . 2]" 1
153 1 12 LEU MD1 1 44 MET HG2 3.440 . 5.080 3.915 2.300 4.415 . 0 0 "[ . 1 . 2]" 1
154 1 12 LEU MD1 1 44 MET HG3 3.560 . 5.320 4.407 3.539 4.634 . 0 0 "[ . 1 . 2]" 1
155 1 12 LEU MD1 1 45 GLU H 2.990 . 4.180 3.594 2.568 4.163 . 0 0 "[ . 1 . 2]" 1
156 1 12 LEU MD1 1 52 ILE MD 3.090 . 4.380 2.161 1.984 2.853 . 0 0 "[ . 1 . 2]" 1
157 1 12 LEU MD2 1 13 GLN H 3.210 . 4.620 4.242 3.902 4.554 . 0 0 "[ . 1 . 2]" 1
158 1 12 LEU MD2 1 14 ASP H 3.520 . 5.240 3.843 3.521 4.050 . 0 0 "[ . 1 . 2]" 1
159 1 12 LEU MD2 1 15 GLY H 3.650 . 5.500 5.389 5.095 5.507 0.007 6 0 "[ . 1 . 2]" 1
160 1 12 LEU MD2 1 16 SER H 3.390 . 4.980 4.160 3.844 4.394 . 0 0 "[ . 1 . 2]" 1
161 1 12 LEU MD2 1 16 SER HB2 3.460 . 5.120 3.191 2.165 4.309 . 0 0 "[ . 1 . 2]" 1
162 1 12 LEU MD2 1 16 SER HB3 3.190 . 4.580 3.622 2.328 4.275 . 0 0 "[ . 1 . 2]" 1
163 1 12 LEU MD2 1 17 LYS H 3.390 . 4.980 4.003 3.610 4.439 . 0 0 "[ . 1 . 2]" 1
164 1 12 LEU MD2 1 17 LYS HA 3.270 . 4.740 3.808 3.217 4.541 . 0 0 "[ . 1 . 2]" 1
165 1 12 LEU MD2 1 18 VAL H 3.390 . 4.980 3.791 3.470 4.412 . 0 0 "[ . 1 . 2]" 1
166 1 12 LEU MD2 1 18 VAL HA 3.460 . 5.120 4.486 4.253 4.872 . 0 0 "[ . 1 . 2]" 1
167 1 12 LEU MD2 1 18 VAL MG2 2.920 . 4.040 2.277 2.094 2.671 . 0 0 "[ . 1 . 2]" 1
168 1 12 LEU MD2 1 28 MET ME 2.290 . 2.780 1.981 1.877 2.087 . 0 0 "[ . 1 . 2]" 1
169 1 12 LEU MD2 1 38 MET ME 2.890 . 3.980 3.320 3.179 3.570 . 0 0 "[ . 1 . 2]" 1
170 1 12 LEU MD2 1 44 MET H 3.480 . 5.160 5.214 5.132 5.302 0.142 7 0 "[ . 1 . 2]" 1
171 1 12 LEU MD2 1 44 MET HA 3.190 . 4.580 3.797 2.900 4.066 . 0 0 "[ . 1 . 2]" 1
172 1 12 LEU MD2 1 44 MET HB2 3.420 . 5.040 3.377 2.960 4.242 . 0 0 "[ . 1 . 2]" 1
173 1 12 LEU MD2 1 44 MET HB3 2.850 . 3.900 2.274 2.171 3.188 . 0 0 "[ . 1 . 2]" 1
174 1 12 LEU MD2 1 44 MET ME 3.050 . 4.300 3.535 3.358 3.853 . 0 0 "[ . 1 . 2]" 1
175 1 12 LEU MD2 1 44 MET HG2 3.140 . 4.480 2.727 2.232 3.310 . 0 0 "[ . 1 . 2]" 1
176 1 12 LEU MD2 1 44 MET HG3 3.310 . 4.820 3.806 2.590 4.050 . 0 0 "[ . 1 . 2]" 1
177 1 12 LEU MD2 1 45 GLU H 3.060 . 4.310 4.206 3.199 4.389 0.079 4 0 "[ . 1 . 2]" 1
178 1 12 LEU HG 1 13 GLN H 3.530 . 5.260 2.950 2.512 3.277 . 0 0 "[ . 1 . 2]" 1
179 1 12 LEU HG 1 14 ASP H 3.650 . 5.500 3.673 3.247 3.942 . 0 0 "[ . 1 . 2]" 1
180 1 12 LEU HG 1 18 VAL MG2 3.480 . 5.160 3.999 3.908 4.191 . 0 0 "[ . 1 . 2]" 1
181 1 12 LEU HG 1 45 GLU H 3.300 . 4.800 3.091 2.292 3.336 . 0 0 "[ . 1 . 2]" 1
182 1 13 GLN H 1 13 GLN HA 2.550 . 3.300 2.883 2.840 2.894 . 0 0 "[ . 1 . 2]" 1
183 1 13 GLN H 1 13 GLN HG2 2.770 . 3.740 2.848 1.818 3.775 0.035 10 0 "[ . 1 . 2]" 1
184 1 13 GLN H 1 13 GLN HG3 2.780 . 3.760 2.934 1.834 3.698 . 0 0 "[ . 1 . 2]" 1
185 1 13 GLN H 1 14 ASP H 2.750 . 3.700 2.438 2.389 2.597 . 0 0 "[ . 1 . 2]" 1
186 1 13 GLN H 1 44 MET HA 3.650 . 5.500 5.561 5.502 5.625 0.125 12 0 "[ . 1 . 2]" 1
187 1 13 GLN H 1 46 THR H 3.650 . 5.500 5.339 4.997 5.504 0.004 11 0 "[ . 1 . 2]" 1
188 1 13 GLN H 1 46 THR MG 3.460 . 5.120 5.013 4.514 5.217 0.097 12 0 "[ . 1 . 2]" 1
189 1 13 GLN HA 1 13 GLN HB2 2.660 . 3.510 2.798 2.445 3.022 . 0 0 "[ . 1 . 2]" 1
190 1 13 GLN HA 1 13 GLN HB3 2.700 . 3.600 2.514 2.429 2.582 . 0 0 "[ . 1 . 2]" 1
191 1 13 GLN HA 1 13 GLN HE21 3.230 . 4.660 4.003 1.815 4.669 0.009 8 0 "[ . 1 . 2]" 1
192 1 13 GLN HA 1 13 GLN HG2 2.940 . 4.080 3.036 2.341 4.225 0.145 7 0 "[ . 1 . 2]" 1
193 1 13 GLN HA 1 13 GLN HG3 2.890 . 3.980 3.390 2.750 3.749 . 0 0 "[ . 1 . 2]" 1
194 1 13 GLN HA 1 14 ASP H 2.930 . 4.060 3.409 3.328 3.456 . 0 0 "[ . 1 . 2]" 1
195 1 13 GLN HA 1 15 GLY H 3.170 . 4.540 3.274 3.188 3.486 . 0 0 "[ . 1 . 2]" 1
196 1 13 GLN HB2 1 13 GLN HG3 2.910 . 4.020 2.498 2.354 3.023 . 0 0 "[ . 1 . 2]" 1
197 1 13 GLN HB2 1 14 ASP H 3.230 . 4.660 3.572 3.071 4.255 . 0 0 "[ . 1 . 2]" 1
198 1 13 GLN HB3 1 14 ASP H 3.150 . 4.500 4.064 3.867 4.289 . 0 0 "[ . 1 . 2]" 1
199 1 13 GLN HE21 1 13 GLN HG2 3.210 . 4.620 3.047 2.298 3.598 . 0 0 "[ . 1 . 2]" 1
200 1 13 GLN HE22 1 13 GLN HG2 3.650 . 5.500 3.851 3.532 4.110 . 0 0 "[ . 1 . 2]" 1
201 1 13 GLN HE22 1 13 GLN HG3 3.650 . 5.500 3.947 3.533 4.109 . 0 0 "[ . 1 . 2]" 1
202 1 13 GLN HG2 1 14 ASP H 3.640 . 5.480 4.252 2.752 5.244 . 0 0 "[ . 1 . 2]" 1
203 1 13 GLN HG3 1 14 ASP H 3.650 . 5.500 4.077 2.711 5.339 . 0 0 "[ . 1 . 2]" 1
204 1 14 ASP H 1 14 ASP HA 2.740 . 3.680 2.904 2.864 2.950 . 0 0 "[ . 1 . 2]" 1
205 1 14 ASP H 1 14 ASP HB2 2.730 . 3.660 2.633 2.424 3.612 . 0 0 "[ . 1 . 2]" 1
206 1 14 ASP H 1 14 ASP HB3 2.920 . 4.040 3.218 2.466 3.626 . 0 0 "[ . 1 . 2]" 1
207 1 14 ASP HA 1 14 ASP HB2 2.540 . 3.280 2.817 2.454 3.030 . 0 0 "[ . 1 . 2]" 1
208 1 14 ASP HA 1 14 ASP HB3 2.400 . 3.000 2.626 2.341 3.028 0.028 7 0 "[ . 1 . 2]" 1
209 1 14 ASP HA 1 15 GLY H 2.980 . 4.160 3.137 3.082 3.197 . 0 0 "[ . 1 . 2]" 1
210 1 14 ASP HB2 1 15 GLY H 3.510 . 5.220 4.058 3.763 4.477 . 0 0 "[ . 1 . 2]" 1
211 1 14 ASP HB2 1 16 SER H 3.600 . 5.400 3.317 2.732 4.374 . 0 0 "[ . 1 . 2]" 1
212 1 14 ASP HB3 1 15 GLY H 3.580 . 5.360 4.230 3.686 4.615 . 0 0 "[ . 1 . 2]" 1
213 1 14 ASP HB3 1 16 SER H 3.650 . 5.500 3.449 2.704 4.509 . 0 0 "[ . 1 . 2]" 1
214 1 15 GLY H 1 15 GLY HA2 2.450 . 3.100 2.325 2.315 2.349 . 0 0 "[ . 1 . 2]" 1
215 1 15 GLY H 1 15 GLY HA3 2.700 . 3.590 2.894 2.875 2.926 . 0 0 "[ . 1 . 2]" 1
216 1 15 GLY HA2 1 16 SER H 2.970 . 4.140 3.403 3.346 3.467 . 0 0 "[ . 1 . 2]" 1
217 1 15 GLY HA3 1 16 SER H 3.320 . 4.840 3.130 3.033 3.207 . 0 0 "[ . 1 . 2]" 1
218 1 16 SER H 1 16 SER HA 2.880 . 3.960 2.889 2.829 2.929 . 0 0 "[ . 1 . 2]" 1
219 1 16 SER H 1 16 SER HB2 2.850 . 3.900 3.020 2.335 3.632 . 0 0 "[ . 1 . 2]" 1
220 1 16 SER H 1 16 SER HB3 2.880 . 3.960 3.045 2.352 3.638 . 0 0 "[ . 1 . 2]" 1
221 1 16 SER H 1 17 LYS H 3.450 . 5.100 4.503 4.396 4.638 . 0 0 "[ . 1 . 2]" 1
222 1 16 SER H 1 28 MET ME 3.650 . 5.500 4.594 4.275 5.084 . 0 0 "[ . 1 . 2]" 1
223 1 16 SER HA 1 16 SER HB2 2.720 . 3.640 2.703 2.402 3.028 . 0 0 "[ . 1 . 2]" 1
224 1 16 SER HA 1 16 SER HB3 2.720 . 3.630 2.528 2.354 3.026 . 0 0 "[ . 1 . 2]" 1
225 1 16 SER HA 1 17 LYS H 2.650 . 3.500 2.629 2.431 2.736 . 0 0 "[ . 1 . 2]" 1
226 1 16 SER HA 1 28 MET ME 3.600 . 5.400 4.520 4.249 4.992 . 0 0 "[ . 1 . 2]" 1
227 1 16 SER HA 1 30 ASN HA 3.140 . 4.480 3.110 2.346 4.187 . 0 0 "[ . 1 . 2]" 1
228 1 16 SER HA 1 31 LYS H 3.430 . 5.060 3.061 2.371 3.824 . 0 0 "[ . 1 . 2]" 1
229 1 16 SER HB2 1 17 LYS H 2.940 . 4.080 2.697 1.849 3.723 . 0 0 "[ . 1 . 2]" 1
230 1 16 SER HB2 1 28 MET ME 3.010 . 4.220 2.593 2.211 3.398 . 0 0 "[ . 1 . 2]" 1
231 1 16 SER HB2 1 30 ASN HA 3.160 . 4.520 3.268 2.344 4.558 0.038 12 0 "[ . 1 . 2]" 1
232 1 16 SER HB3 1 17 LYS H 2.810 . 3.820 2.868 1.831 3.681 . 0 0 "[ . 1 . 2]" 1
233 1 16 SER HB3 1 28 MET ME 2.950 . 4.100 2.788 2.243 3.436 . 0 0 "[ . 1 . 2]" 1
234 1 16 SER HB3 1 30 ASN HA 3.200 . 4.600 2.910 2.346 4.361 . 0 0 "[ . 1 . 2]" 1
235 1 17 LYS H 1 17 LYS HB2 2.930 . 4.060 3.201 2.801 3.988 . 0 0 "[ . 1 . 2]" 1
236 1 17 LYS H 1 17 LYS HB3 3.610 . 5.420 3.718 3.046 3.955 . 0 0 "[ . 1 . 2]" 1
237 1 17 LYS H 1 17 LYS QD 3.450 . 5.100 4.656 4.191 5.141 0.041 6 0 "[ . 1 . 2]" 1
238 1 17 LYS H 1 17 LYS HG2 3.650 . 5.500 3.695 2.377 4.552 . 0 0 "[ . 1 . 2]" 1
239 1 17 LYS H 1 17 LYS HG3 3.650 . 5.500 3.418 2.857 4.897 . 0 0 "[ . 1 . 2]" 1
240 1 17 LYS H 1 28 MET HA 3.650 . 5.500 5.274 4.418 5.522 0.022 8 0 "[ . 1 . 2]" 1
241 1 17 LYS H 1 28 MET ME 3.110 . 4.420 3.465 3.115 4.088 . 0 0 "[ . 1 . 2]" 1
242 1 17 LYS H 1 29 GLU H 3.150 . 4.500 4.041 2.902 4.560 0.060 20 0 "[ . 1 . 2]" 1
243 1 17 LYS H 1 30 ASN HA 3.500 . 5.200 3.450 2.653 4.828 . 0 0 "[ . 1 . 2]" 1
244 1 17 LYS H 1 31 LYS H 3.650 . 5.500 4.688 3.635 5.521 0.021 9 0 "[ . 1 . 2]" 1
245 1 17 LYS HA 1 17 LYS QE 3.650 . 5.500 4.591 3.692 5.516 0.016 3 0 "[ . 1 . 2]" 1
246 1 17 LYS HA 1 17 LYS HG2 3.490 . 5.180 2.767 2.333 3.695 . 0 0 "[ . 1 . 2]" 1
247 1 17 LYS HA 1 17 LYS HG3 3.490 . 5.180 3.250 2.604 3.845 . 0 0 "[ . 1 . 2]" 1
248 1 17 LYS HA 1 18 VAL H 2.530 . 3.260 2.164 2.139 2.244 . 0 0 "[ . 1 . 2]" 1
249 1 17 LYS HB2 1 18 VAL H 3.380 . 4.960 3.962 2.859 4.387 . 0 0 "[ . 1 . 2]" 1
250 1 17 LYS HB3 1 17 LYS QE 3.650 . 5.500 3.218 2.153 4.145 . 0 0 "[ . 1 . 2]" 1
251 1 17 LYS HB3 1 18 VAL H 3.300 . 4.800 3.639 3.272 4.278 . 0 0 "[ . 1 . 2]" 1
252 1 17 LYS QE 1 17 LYS HG2 3.120 . 4.440 2.738 2.238 3.555 . 0 0 "[ . 1 . 2]" 1
253 1 17 LYS QE 1 17 LYS HG3 3.650 . 5.500 2.822 2.259 3.590 . 0 0 "[ . 1 . 2]" 1
254 1 17 LYS HG2 1 18 VAL H 3.350 . 4.900 4.356 2.881 4.957 0.057 18 0 "[ . 1 . 2]" 1
255 1 17 LYS HG3 1 18 VAL H 3.440 . 5.080 4.782 3.627 5.223 0.143 9 0 "[ . 1 . 2]" 1
256 1 18 VAL H 1 18 VAL HA 2.920 . 4.040 2.912 2.871 2.956 . 0 0 "[ . 1 . 2]" 1
257 1 18 VAL H 1 18 VAL HB 2.910 . 4.020 2.943 2.747 3.275 . 0 0 "[ . 1 . 2]" 1
258 1 18 VAL H 1 18 VAL MG1 3.030 . 4.260 3.734 3.545 3.791 . 0 0 "[ . 1 . 2]" 1
259 1 18 VAL H 1 18 VAL MG2 2.510 . 3.220 1.789 1.703 1.997 0.097 1 0 "[ . 1 . 2]" 1
260 1 18 VAL H 1 28 MET ME 3.290 . 4.780 4.777 4.475 4.933 0.153 12 0 "[ . 1 . 2]" 1
261 1 18 VAL HA 1 18 VAL HB 2.650 . 3.500 2.983 2.903 3.008 . 0 0 "[ . 1 . 2]" 1
262 1 18 VAL HA 1 18 VAL MG1 2.630 . 3.460 2.217 2.169 2.273 . 0 0 "[ . 1 . 2]" 1
263 1 18 VAL HA 1 18 VAL MG2 2.970 . 4.140 2.725 2.589 2.960 . 0 0 "[ . 1 . 2]" 1
264 1 18 VAL HA 1 19 HIS H 2.580 . 3.360 2.290 2.153 2.332 . 0 0 "[ . 1 . 2]" 1
265 1 18 VAL HA 1 27 GLY H 3.650 . 5.500 4.013 3.588 4.229 . 0 0 "[ . 1 . 2]" 1
266 1 18 VAL HA 1 28 MET HA 2.820 . 3.840 3.012 2.536 3.607 . 0 0 "[ . 1 . 2]" 1
267 1 18 VAL HA 1 28 MET ME 3.020 . 4.240 4.259 4.181 4.322 0.082 7 0 "[ . 1 . 2]" 1
268 1 18 VAL HB 1 18 VAL MG1 2.460 . 3.120 2.139 2.135 2.145 . 0 0 "[ . 1 . 2]" 1
269 1 18 VAL HB 1 18 VAL MG2 2.490 . 3.180 2.144 2.134 2.147 . 0 0 "[ . 1 . 2]" 1
270 1 18 VAL HB 1 19 HIS H 3.420 . 5.040 3.439 3.105 3.675 . 0 0 "[ . 1 . 2]" 1
271 1 18 VAL HB 1 28 MET HA 3.650 . 5.500 5.340 4.920 5.614 0.114 17 0 "[ . 1 . 2]" 1
272 1 18 VAL HB 1 52 ILE MD 3.520 . 5.240 3.820 3.341 5.237 . 0 0 "[ . 1 . 2]" 1
273 1 18 VAL MG1 1 18 VAL MG2 2.100 . 2.400 2.067 2.045 2.088 . 0 0 "[ . 1 . 2]" 1
274 1 18 VAL MG1 1 19 HIS H 2.740 . 3.680 2.176 1.899 3.059 . 0 0 "[ . 1 . 2]" 1
275 1 18 VAL MG1 1 19 HIS HD2 3.650 . 5.500 5.016 4.189 5.540 0.040 16 0 "[ . 1 . 2]" 1
276 1 18 VAL MG1 1 20 VAL HA 3.470 . 5.140 4.507 4.201 5.107 . 0 0 "[ . 1 . 2]" 1
277 1 18 VAL MG1 1 26 MET HA 3.150 . 4.500 3.539 3.189 3.858 . 0 0 "[ . 1 . 2]" 1
278 1 18 VAL MG1 1 26 MET HB2 2.970 . 4.140 3.681 3.344 4.177 0.037 17 0 "[ . 1 . 2]" 1
279 1 18 VAL MG1 1 26 MET HB3 3.290 . 4.780 2.359 2.092 2.898 . 0 0 "[ . 1 . 2]" 1
280 1 18 VAL MG1 1 26 MET ME 3.110 . 4.420 4.160 3.748 4.437 0.017 3 0 "[ . 1 . 2]" 1
281 1 18 VAL MG1 1 26 MET HG2 2.840 . 3.880 2.479 2.117 3.343 . 0 0 "[ . 1 . 2]" 1
282 1 18 VAL MG1 1 26 MET HG3 3.080 . 4.350 3.846 3.577 4.383 0.033 18 0 "[ . 1 . 2]" 1
283 1 18 VAL MG1 1 27 GLY H 3.240 . 4.680 1.842 1.741 2.088 0.059 18 0 "[ . 1 . 2]" 1
284 1 18 VAL MG1 1 28 MET H 3.650 . 5.500 3.858 3.200 4.318 . 0 0 "[ . 1 . 2]" 1
285 1 18 VAL MG1 1 28 MET HA 3.140 . 4.480 2.712 2.261 3.343 . 0 0 "[ . 1 . 2]" 1
286 1 18 VAL MG1 1 28 MET ME 3.210 . 4.620 4.015 3.247 4.338 . 0 0 "[ . 1 . 2]" 1
287 1 18 VAL MG1 1 28 MET HG2 3.650 . 5.500 4.998 3.373 5.541 0.041 2 0 "[ . 1 . 2]" 1
288 1 18 VAL MG1 1 28 MET HG3 3.650 . 5.500 4.873 4.311 5.417 . 0 0 "[ . 1 . 2]" 1
289 1 18 VAL MG1 1 44 MET ME 2.540 . 3.280 2.417 2.073 2.634 . 0 0 "[ . 1 . 2]" 1
290 1 18 VAL MG1 1 54 MET HA 3.550 . 5.300 3.986 3.538 4.456 . 0 0 "[ . 1 . 2]" 1
291 1 18 VAL MG1 1 54 MET ME 2.880 . 3.960 2.808 2.370 3.676 . 0 0 "[ . 1 . 2]" 1
292 1 18 VAL MG2 1 19 HIS H 3.210 . 4.620 4.179 4.087 4.440 . 0 0 "[ . 1 . 2]" 1
293 1 18 VAL MG2 1 28 MET ME 3.030 . 4.260 3.316 2.973 3.469 . 0 0 "[ . 1 . 2]" 1
294 1 18 VAL MG2 1 44 MET ME 3.010 . 4.220 2.252 2.137 2.433 . 0 0 "[ . 1 . 2]" 1
295 1 18 VAL MG2 1 52 ILE MD 2.750 . 3.700 2.537 2.147 3.936 0.236 6 0 "[ . 1 . 2]" 1
296 1 18 VAL MG2 1 52 ILE HG12 3.160 . 4.520 4.701 4.524 4.797 0.277 9 0 "[ . 1 . 2]" 1
297 1 18 VAL MG2 1 52 ILE MG 3.030 . 4.260 4.406 4.315 4.470 0.210 15 0 "[ . 1 . 2]" 1
298 1 18 VAL MG2 1 54 MET ME 3.510 . 5.220 4.515 4.253 5.199 . 0 0 "[ . 1 . 2]" 1
299 1 19 HIS H 1 19 HIS HA 2.670 . 3.530 2.943 2.931 2.975 . 0 0 "[ . 1 . 2]" 1
300 1 19 HIS H 1 19 HIS QB 3.040 . 4.280 2.810 2.590 3.303 . 0 0 "[ . 1 . 2]" 1
301 1 19 HIS H 1 19 HIS HD2 3.500 . 5.200 3.602 2.270 4.371 . 0 0 "[ . 1 . 2]" 1
302 1 19 HIS H 1 20 VAL H 3.650 . 5.500 4.087 4.040 4.235 . 0 0 "[ . 1 . 2]" 1
303 1 19 HIS H 1 26 MET HA 3.650 . 5.500 4.596 4.402 4.829 . 0 0 "[ . 1 . 2]" 1
304 1 19 HIS H 1 27 GLY H 3.650 . 5.500 2.764 2.565 3.266 . 0 0 "[ . 1 . 2]" 1
305 1 19 HIS H 1 28 MET HA 3.650 . 5.500 4.169 3.856 4.792 . 0 0 "[ . 1 . 2]" 1
306 1 19 HIS HA 1 19 HIS HD2 3.650 . 5.500 4.617 4.378 4.971 . 0 0 "[ . 1 . 2]" 1
307 1 19 HIS HA 1 20 VAL H 2.850 . 3.900 2.159 2.125 2.191 . 0 0 "[ . 1 . 2]" 1
308 1 19 HIS QB 1 20 VAL H 3.650 . 5.500 3.673 3.378 3.876 . 0 0 "[ . 1 . 2]" 1
309 1 19 HIS HD2 1 29 GLU H 3.650 . 5.500 5.488 5.180 5.566 0.066 19 0 "[ . 1 . 2]" 1
310 1 19 HIS HD2 1 62 LEU H 3.650 . 5.500 5.571 5.515 5.708 0.208 15 0 "[ . 1 . 2]" 1
311 1 20 VAL H 1 20 VAL HA 2.580 . 3.360 2.922 2.893 2.952 . 0 0 "[ . 1 . 2]" 1
312 1 20 VAL H 1 20 VAL HB 3.040 . 4.280 3.674 3.611 3.721 . 0 0 "[ . 1 . 2]" 1
313 1 20 VAL H 1 20 VAL MG1 2.640 . 3.480 1.961 1.784 2.214 0.016 6 0 "[ . 1 . 2]" 1
314 1 20 VAL H 1 20 VAL MG2 3.650 . 5.500 2.548 2.485 2.616 . 0 0 "[ . 1 . 2]" 1
315 1 20 VAL H 1 26 MET HA 3.270 . 4.740 4.162 4.015 4.329 . 0 0 "[ . 1 . 2]" 1
316 1 20 VAL H 1 26 MET HG2 3.430 . 5.060 4.762 4.611 4.957 . 0 0 "[ . 1 . 2]" 1
317 1 20 VAL H 1 26 MET HG3 3.650 . 5.500 5.490 5.067 5.607 0.107 12 0 "[ . 1 . 2]" 1
318 1 20 VAL HA 1 20 VAL MG1 2.670 . 3.540 2.654 2.579 2.724 . 0 0 "[ . 1 . 2]" 1
319 1 20 VAL HA 1 20 VAL MG2 2.610 . 3.420 3.164 3.150 3.173 . 0 0 "[ . 1 . 2]" 1
320 1 20 VAL HA 1 21 PHE H 2.590 . 3.380 2.279 2.185 2.326 . 0 0 "[ . 1 . 2]" 1
321 1 20 VAL HA 1 21 PHE QD 3.260 . 4.720 3.161 2.777 3.471 . 0 0 "[ . 1 . 2]" 1
322 1 20 VAL HA 1 26 MET H 3.650 . 5.500 4.564 4.522 4.643 . 0 0 "[ . 1 . 2]" 1
323 1 20 VAL HA 1 26 MET HA 2.840 . 3.880 2.231 2.189 2.290 . 0 0 "[ . 1 . 2]" 1
324 1 20 VAL HA 1 26 MET HB2 3.530 . 5.270 5.145 5.083 5.231 . 0 0 "[ . 1 . 2]" 1
325 1 20 VAL HA 1 26 MET HG2 2.930 . 4.060 4.293 4.212 4.363 0.303 3 0 "[ . 1 . 2]" 1
326 1 20 VAL HA 1 26 MET HG3 3.320 . 4.840 4.402 4.222 4.549 . 0 0 "[ . 1 . 2]" 1
327 1 20 VAL HA 1 27 GLY H 3.240 . 4.680 3.667 3.465 4.042 . 0 0 "[ . 1 . 2]" 1
328 1 20 VAL HB 1 20 VAL MG2 2.670 . 3.530 2.138 2.131 2.147 . 0 0 "[ . 1 . 2]" 1
329 1 20 VAL HB 1 21 PHE H 3.650 . 5.500 2.848 2.685 3.207 . 0 0 "[ . 1 . 2]" 1
330 1 20 VAL HB 1 27 GLY H 3.490 . 5.180 5.047 4.671 5.285 0.105 15 0 "[ . 1 . 2]" 1
331 1 20 VAL MG1 1 20 VAL MG2 2.100 . 2.400 2.052 2.010 2.101 . 0 0 "[ . 1 . 2]" 1
332 1 20 VAL MG1 1 21 PHE QD 3.650 . 5.500 5.174 4.920 5.352 . 0 0 "[ . 1 . 2]" 1
333 1 20 VAL MG1 1 26 MET H 3.060 . 4.310 4.339 4.162 4.488 0.178 17 0 "[ . 1 . 2]" 1
334 1 20 VAL MG1 1 26 MET HA 3.270 . 4.740 2.224 2.154 2.266 . 0 0 "[ . 1 . 2]" 1
335 1 20 VAL MG1 1 26 MET ME 2.460 . 3.110 3.177 2.865 3.295 0.185 16 0 "[ . 1 . 2]" 1
336 1 20 VAL MG1 1 26 MET HG2 2.570 . 3.340 2.179 2.014 2.249 . 0 0 "[ . 1 . 2]" 1
337 1 20 VAL MG1 1 26 MET HG3 2.920 . 4.040 2.355 2.145 2.677 . 0 0 "[ . 1 . 2]" 1
338 1 20 VAL MG1 1 27 GLY H 3.340 . 4.880 3.538 2.924 3.863 . 0 0 "[ . 1 . 2]" 1
339 1 20 VAL MG2 1 21 PHE QD 3.650 . 5.500 4.776 4.511 4.893 . 0 0 "[ . 1 . 2]" 1
340 1 20 VAL MG2 1 24 GLY H 3.240 . 4.680 3.712 3.561 3.913 . 0 0 "[ . 1 . 2]" 1
341 1 20 VAL MG2 1 24 GLY HA2 3.210 . 4.620 3.065 2.961 3.150 . 0 0 "[ . 1 . 2]" 1
342 1 20 VAL MG2 1 24 GLY HA3 3.150 . 4.500 4.549 4.434 4.655 0.155 17 0 "[ . 1 . 2]" 1
343 1 20 VAL MG2 1 26 MET H 3.650 . 5.500 5.646 5.526 5.802 0.302 19 0 "[ . 1 . 2]" 1
344 1 20 VAL MG2 1 26 MET HA 3.420 . 5.040 4.115 3.917 4.320 . 0 0 "[ . 1 . 2]" 1
345 1 21 PHE H 1 21 PHE HB2 2.900 . 4.000 2.418 2.357 2.535 . 0 0 "[ . 1 . 2]" 1
346 1 21 PHE H 1 21 PHE HB3 2.820 . 3.840 3.627 3.596 3.686 . 0 0 "[ . 1 . 2]" 1
347 1 21 PHE H 1 21 PHE QD 2.900 . 4.000 2.253 1.907 2.512 . 0 0 "[ . 1 . 2]" 1
348 1 21 PHE H 1 23 ASP H 3.650 . 5.500 4.313 4.147 4.456 . 0 0 "[ . 1 . 2]" 1
349 1 21 PHE H 1 24 GLY H 3.590 . 5.380 4.000 3.752 4.412 . 0 0 "[ . 1 . 2]" 1
350 1 21 PHE H 1 25 LYS H 3.110 . 4.420 3.788 3.405 4.046 . 0 0 "[ . 1 . 2]" 1
351 1 21 PHE H 1 26 MET HA 3.270 . 4.740 3.882 3.815 3.976 . 0 0 "[ . 1 . 2]" 1
352 1 21 PHE HA 1 22 LYS H 3.650 . 5.500 2.731 2.470 2.801 . 0 0 "[ . 1 . 2]" 1
353 1 21 PHE HB2 1 22 LYS H 3.270 . 4.740 3.043 2.883 3.520 . 0 0 "[ . 1 . 2]" 1
354 1 21 PHE HB2 1 23 ASP H 3.550 . 5.300 2.717 2.550 2.917 . 0 0 "[ . 1 . 2]" 1
355 1 21 PHE HB2 1 25 LYS H 3.650 . 5.500 3.711 3.610 3.836 . 0 0 "[ . 1 . 2]" 1
356 1 21 PHE HB3 1 22 LYS H 3.300 . 4.800 1.857 1.785 2.257 0.015 1 0 "[ . 1 . 2]" 1
357 1 21 PHE HB3 1 23 ASP H 3.570 . 5.340 2.849 2.695 3.068 . 0 0 "[ . 1 . 2]" 1
358 1 21 PHE HB3 1 25 LYS H 3.490 . 5.180 5.218 5.153 5.272 0.092 7 0 "[ . 1 . 2]" 1
359 1 21 PHE QD 1 23 ASP H 3.650 . 5.500 4.612 4.547 4.770 . 0 0 "[ . 1 . 2]" 1
360 1 21 PHE QD 1 26 MET H 3.650 . 5.500 5.117 4.808 5.517 0.017 18 0 "[ . 1 . 2]" 1
361 1 21 PHE QD 1 26 MET HA 3.120 . 4.440 4.381 4.217 4.465 0.025 17 0 "[ . 1 . 2]" 1
362 1 21 PHE QD 1 27 GLY H 3.650 . 5.500 5.300 4.986 5.522 0.022 12 0 "[ . 1 . 2]" 1
363 1 22 LYS H 1 22 LYS QB 3.000 . 4.200 2.428 2.246 2.802 . 0 0 "[ . 1 . 2]" 1
364 1 22 LYS H 1 22 LYS QG 3.650 . 5.500 2.825 1.803 4.061 . 0 0 "[ . 1 . 2]" 1
365 1 22 LYS HA 1 22 LYS QB 2.670 . 3.530 2.337 2.179 2.436 . 0 0 "[ . 1 . 2]" 1
366 1 22 LYS HA 1 22 LYS QD 3.370 . 4.940 3.711 2.157 4.512 . 0 0 "[ . 1 . 2]" 1
367 1 22 LYS HA 1 22 LYS QE 3.650 . 5.500 4.566 4.000 5.579 0.079 10 0 "[ . 1 . 2]" 1
368 1 22 LYS HA 1 22 LYS QG 3.210 . 4.620 2.617 2.270 3.415 . 0 0 "[ . 1 . 2]" 1
369 1 22 LYS HA 1 23 ASP H 3.130 . 4.460 3.447 3.400 3.502 . 0 0 "[ . 1 . 2]" 1
370 1 22 LYS HA 1 24 GLY H 3.210 . 4.620 3.379 3.206 3.505 . 0 0 "[ . 1 . 2]" 1
371 1 22 LYS QB 1 22 LYS QD 2.970 . 4.140 2.199 2.115 2.331 . 0 0 "[ . 1 . 2]" 1
372 1 22 LYS QB 1 22 LYS QE 3.480 . 5.160 3.178 2.116 3.856 . 0 0 "[ . 1 . 2]" 1
373 1 22 LYS QB 1 23 ASP H 2.860 . 3.920 3.105 2.797 3.656 . 0 0 "[ . 1 . 2]" 1
374 1 22 LYS QB 1 24 GLY H 3.370 . 4.940 4.451 4.278 4.592 . 0 0 "[ . 1 . 2]" 1
375 1 22 LYS QE 1 22 LYS QG 3.180 . 4.560 2.263 2.115 2.906 . 0 0 "[ . 1 . 2]" 1
376 1 23 ASP H 1 23 ASP HA 2.790 . 3.780 2.888 2.881 2.910 . 0 0 "[ . 1 . 2]" 1
377 1 23 ASP H 1 23 ASP HB2 2.870 . 3.940 2.570 2.393 3.569 . 0 0 "[ . 1 . 2]" 1
378 1 23 ASP H 1 23 ASP HB3 3.050 . 4.300 3.201 2.487 3.625 . 0 0 "[ . 1 . 2]" 1
379 1 23 ASP H 1 24 GLY H 2.570 . 3.340 2.597 2.481 2.808 . 0 0 "[ . 1 . 2]" 1
380 1 23 ASP H 1 25 LYS H 3.320 . 4.840 3.663 3.489 3.793 . 0 0 "[ . 1 . 2]" 1
381 1 23 ASP HA 1 23 ASP HB2 2.730 . 3.660 2.817 2.463 3.029 . 0 0 "[ . 1 . 2]" 1
382 1 23 ASP HA 1 23 ASP HB3 2.550 . 3.300 2.654 2.335 3.027 . 0 0 "[ . 1 . 2]" 1
383 1 23 ASP HA 1 24 GLY H 3.020 . 4.240 3.236 3.105 3.320 . 0 0 "[ . 1 . 2]" 1
384 1 23 ASP HB2 1 24 GLY H 3.590 . 5.380 3.898 3.450 4.486 . 0 0 "[ . 1 . 2]" 1
385 1 23 ASP HB2 1 25 LYS H 3.650 . 5.500 3.260 2.613 4.348 . 0 0 "[ . 1 . 2]" 1
386 1 23 ASP HB3 1 24 GLY H 3.540 . 5.280 4.087 3.445 4.562 . 0 0 "[ . 1 . 2]" 1
387 1 23 ASP HB3 1 25 LYS H 3.460 . 5.120 3.241 2.552 4.506 . 0 0 "[ . 1 . 2]" 1
388 1 24 GLY H 1 24 GLY HA2 2.610 . 3.420 2.325 2.299 2.352 . 0 0 "[ . 1 . 2]" 1
389 1 24 GLY H 1 24 GLY HA3 2.600 . 3.400 2.889 2.811 2.929 . 0 0 "[ . 1 . 2]" 1
390 1 24 GLY H 1 25 LYS H 2.580 . 3.360 2.735 2.571 2.860 . 0 0 "[ . 1 . 2]" 1
391 1 24 GLY HA2 1 25 LYS H 3.070 . 4.340 3.392 3.251 3.440 . 0 0 "[ . 1 . 2]" 1
392 1 24 GLY HA3 1 25 LYS H 3.020 . 4.240 3.169 3.101 3.310 . 0 0 "[ . 1 . 2]" 1
393 1 25 LYS H 1 25 LYS HA 2.780 . 3.760 2.858 2.839 2.912 . 0 0 "[ . 1 . 2]" 1
394 1 25 LYS H 1 25 LYS HB2 2.700 . 3.590 2.420 2.162 3.585 . 0 0 "[ . 1 . 2]" 1
395 1 25 LYS H 1 25 LYS HB3 2.760 . 3.720 3.438 2.508 3.568 . 0 0 "[ . 1 . 2]" 1
396 1 25 LYS H 1 25 LYS HD3 3.560 . 5.320 4.696 4.164 5.166 . 0 0 "[ . 1 . 2]" 1
397 1 25 LYS H 1 25 LYS HG2 2.830 . 3.860 2.989 2.070 3.869 0.009 6 0 "[ . 1 . 2]" 1
398 1 25 LYS H 1 25 LYS HG3 2.800 . 3.800 3.051 2.482 3.481 . 0 0 "[ . 1 . 2]" 1
399 1 25 LYS H 1 26 MET H 3.440 . 5.080 4.620 4.588 4.640 . 0 0 "[ . 1 . 2]" 1
400 1 25 LYS HA 1 25 LYS HB2 2.820 . 3.840 2.963 2.430 3.035 . 0 0 "[ . 1 . 2]" 1
401 1 25 LYS HA 1 25 LYS HB3 2.990 . 4.180 2.576 2.484 2.691 . 0 0 "[ . 1 . 2]" 1
402 1 25 LYS HA 1 25 LYS HD3 3.420 . 5.040 3.573 2.321 4.637 . 0 0 "[ . 1 . 2]" 1
403 1 25 LYS HA 1 25 LYS QE 3.210 . 4.620 4.198 3.521 4.689 0.069 7 0 "[ . 1 . 2]" 1
404 1 25 LYS HA 1 25 LYS HG2 2.960 . 4.120 2.591 2.297 3.753 . 0 0 "[ . 1 . 2]" 1
405 1 25 LYS HA 1 25 LYS HG3 3.220 . 4.640 3.341 2.837 3.732 . 0 0 "[ . 1 . 2]" 1
406 1 25 LYS HA 1 26 MET H 2.470 . 3.140 2.239 2.220 2.256 . 0 0 "[ . 1 . 2]" 1
407 1 25 LYS HA 1 26 MET HA 3.650 . 5.500 4.360 4.338 4.378 . 0 0 "[ . 1 . 2]" 1
408 1 25 LYS HA 1 55 LYS HB2 3.350 . 4.900 4.481 2.819 5.064 0.164 1 0 "[ . 1 . 2]" 1
409 1 25 LYS HA 1 55 LYS HB3 3.240 . 4.680 3.381 2.861 3.833 . 0 0 "[ . 1 . 2]" 1
410 1 25 LYS HA 1 55 LYS QD 3.630 . 5.460 4.164 2.472 5.557 0.097 13 0 "[ . 1 . 2]" 1
411 1 25 LYS HA 1 55 LYS HG2 3.440 . 5.080 3.974 3.176 5.208 0.128 6 0 "[ . 1 . 2]" 1
412 1 25 LYS HA 1 55 LYS HG3 3.520 . 5.240 4.605 2.609 5.354 0.114 6 0 "[ . 1 . 2]" 1
413 1 25 LYS HA 1 56 GLY H 3.650 . 5.500 3.473 3.329 3.605 . 0 0 "[ . 1 . 2]" 1
414 1 25 LYS HA 1 56 GLY HA2 2.680 . 3.550 3.705 3.656 3.778 0.228 11 0 "[ . 1 . 2]" 1
415 1 25 LYS HA 1 56 GLY HA3 3.430 . 5.060 3.408 3.101 3.718 . 0 0 "[ . 1 . 2]" 1
416 1 25 LYS HB2 1 25 LYS QE 3.610 . 5.420 3.836 2.209 4.554 . 0 0 "[ . 1 . 2]" 1
417 1 25 LYS HB2 1 56 GLY HA2 3.340 . 4.880 4.108 2.309 4.691 . 0 0 "[ . 1 . 2]" 1
418 1 25 LYS HB2 1 56 GLY HA3 3.020 . 4.240 3.770 2.284 4.023 . 0 0 "[ . 1 . 2]" 1
419 1 25 LYS HB3 1 56 GLY HA2 3.490 . 5.180 2.716 2.331 3.780 . 0 0 "[ . 1 . 2]" 1
420 1 25 LYS HB3 1 56 GLY HA3 3.470 . 5.140 2.459 2.259 4.007 . 0 0 "[ . 1 . 2]" 1
421 1 25 LYS HD2 1 56 GLY HA2 3.650 . 5.500 3.326 2.331 5.182 . 0 0 "[ . 1 . 2]" 1
422 1 25 LYS HD2 1 56 GLY HA3 3.350 . 4.900 4.097 3.054 4.940 0.040 7 0 "[ . 1 . 2]" 1
423 1 25 LYS HD3 1 56 GLY HA2 3.530 . 5.260 2.952 2.338 3.793 . 0 0 "[ . 1 . 2]" 1
424 1 25 LYS HD3 1 56 GLY HA3 3.330 . 4.860 3.874 3.119 4.911 0.051 6 0 "[ . 1 . 2]" 1
425 1 25 LYS QE 1 25 LYS HG2 3.280 . 4.760 2.646 2.275 3.316 . 0 0 "[ . 1 . 2]" 1
426 1 25 LYS QE 1 25 LYS HG3 3.160 . 4.520 2.560 2.236 3.272 . 0 0 "[ . 1 . 2]" 1
427 1 25 LYS QE 1 56 GLY HA2 3.650 . 5.500 4.073 2.312 5.186 . 0 0 "[ . 1 . 2]" 1
428 1 25 LYS QE 1 56 GLY HA3 3.650 . 5.500 4.997 2.998 5.528 0.028 7 0 "[ . 1 . 2]" 1
429 1 25 LYS HG2 1 26 MET H 3.650 . 5.500 4.284 3.590 4.898 . 0 0 "[ . 1 . 2]" 1
430 1 25 LYS HG2 1 56 GLY HA2 3.610 . 5.420 3.957 2.651 5.323 . 0 0 "[ . 1 . 2]" 1
431 1 25 LYS HG2 1 56 GLY HA3 3.280 . 4.770 4.399 3.446 4.926 0.156 2 0 "[ . 1 . 2]" 1
432 1 25 LYS HG3 1 56 GLY HA2 3.650 . 5.500 4.418 4.078 4.678 . 0 0 "[ . 1 . 2]" 1
433 1 25 LYS HG3 1 56 GLY HA3 3.590 . 5.380 4.747 3.489 5.143 . 0 0 "[ . 1 . 2]" 1
434 1 26 MET H 1 26 MET HA 2.860 . 3.920 2.884 2.869 2.909 . 0 0 "[ . 1 . 2]" 1
435 1 26 MET H 1 26 MET HB2 2.990 . 4.180 2.185 2.108 2.288 . 0 0 "[ . 1 . 2]" 1
436 1 26 MET H 1 26 MET HB3 2.740 . 3.680 3.467 3.261 3.565 . 0 0 "[ . 1 . 2]" 1
437 1 26 MET H 1 26 MET HG2 3.090 . 4.380 4.230 4.025 4.475 0.095 8 0 "[ . 1 . 2]" 1
438 1 26 MET H 1 26 MET HG3 2.870 . 3.940 3.138 2.769 3.652 . 0 0 "[ . 1 . 2]" 1
439 1 26 MET H 1 27 GLY H 3.260 . 4.720 4.491 4.424 4.539 . 0 0 "[ . 1 . 2]" 1
440 1 26 MET H 1 54 MET ME 3.010 . 4.220 4.012 3.592 4.227 0.007 5 0 "[ . 1 . 2]" 1
441 1 26 MET H 1 56 GLY H 3.530 . 5.260 1.732 1.662 1.793 0.138 5 0 "[ . 1 . 2]" 1
442 1 26 MET H 1 56 GLY HA2 2.850 . 3.900 3.191 3.117 3.331 . 0 0 "[ . 1 . 2]" 1
443 1 26 MET H 1 56 GLY HA3 2.980 . 4.160 2.115 1.879 2.478 . 0 0 "[ . 1 . 2]" 1
444 1 26 MET HA 1 26 MET HB2 2.860 . 3.920 2.970 2.877 3.015 . 0 0 "[ . 1 . 2]" 1
445 1 26 MET HA 1 26 MET ME 3.290 . 4.780 4.220 3.937 4.354 . 0 0 "[ . 1 . 2]" 1
446 1 26 MET HA 1 26 MET HG2 2.950 . 4.100 2.527 2.443 2.615 . 0 0 "[ . 1 . 2]" 1
447 1 26 MET HA 1 26 MET HG3 3.090 . 4.380 2.462 2.298 2.611 . 0 0 "[ . 1 . 2]" 1
448 1 26 MET HA 1 27 GLY H 2.620 . 3.440 2.619 2.504 2.740 . 0 0 "[ . 1 . 2]" 1
449 1 26 MET HA 1 54 MET ME 3.450 . 5.100 4.305 4.115 4.549 . 0 0 "[ . 1 . 2]" 1
450 1 26 MET HA 1 55 LYS H 3.650 . 5.500 5.466 5.057 5.602 0.102 5 0 "[ . 1 . 2]" 1
451 1 26 MET HB2 1 27 GLY H 3.000 . 4.200 3.528 3.206 3.740 . 0 0 "[ . 1 . 2]" 1
452 1 26 MET HB2 1 54 MET ME 2.490 . 3.180 2.807 2.285 3.215 0.035 4 0 "[ . 1 . 2]" 1
453 1 26 MET HB3 1 26 MET HG3 2.980 . 4.160 3.022 3.015 3.029 . 0 0 "[ . 1 . 2]" 1
454 1 26 MET HB3 1 27 GLY H 3.350 . 4.900 2.042 1.802 2.320 . 0 0 "[ . 1 . 2]" 1
455 1 26 MET HB3 1 54 MET ME 2.600 . 3.400 2.455 2.209 2.706 . 0 0 "[ . 1 . 2]" 1
456 1 26 MET HB3 1 56 GLY H 3.650 . 5.500 3.334 2.875 3.494 . 0 0 "[ . 1 . 2]" 1
457 1 26 MET ME 1 26 MET HG2 2.630 . 3.460 2.904 2.532 3.247 . 0 0 "[ . 1 . 2]" 1
458 1 26 MET ME 1 26 MET HG3 2.460 . 3.110 2.190 2.169 2.300 . 0 0 "[ . 1 . 2]" 1
459 1 26 MET ME 1 27 GLY H 3.600 . 5.400 5.343 5.037 5.477 0.077 7 0 "[ . 1 . 2]" 1
460 1 26 MET ME 1 52 ILE HA 3.460 . 5.120 3.468 2.649 4.050 . 0 0 "[ . 1 . 2]" 1
461 1 26 MET ME 1 52 ILE HB 2.790 . 3.780 2.865 2.318 3.309 . 0 0 "[ . 1 . 2]" 1
462 1 26 MET ME 1 52 ILE MD 3.100 . 4.400 4.156 3.725 4.574 0.174 5 0 "[ . 1 . 2]" 1
463 1 26 MET ME 1 52 ILE MG 2.460 . 3.120 2.977 2.500 3.163 0.043 4 0 "[ . 1 . 2]" 1
464 1 26 MET ME 1 54 MET HA 3.030 . 4.260 4.212 3.823 4.369 0.109 16 0 "[ . 1 . 2]" 1
465 1 26 MET ME 1 55 LYS HA 3.370 . 4.940 4.600 4.367 5.037 0.097 12 0 "[ . 1 . 2]" 1
466 1 26 MET ME 1 55 LYS HB2 3.080 . 4.350 2.623 2.294 3.367 . 0 0 "[ . 1 . 2]" 1
467 1 26 MET ME 1 55 LYS HB3 3.120 . 4.440 3.071 2.459 4.464 0.024 12 0 "[ . 1 . 2]" 1
468 1 26 MET ME 1 55 LYS QD 3.410 . 5.020 3.679 2.281 5.160 0.140 15 0 "[ . 1 . 2]" 1
469 1 26 MET ME 1 55 LYS HG2 3.160 . 4.520 4.051 2.278 4.622 0.102 7 0 "[ . 1 . 2]" 1
470 1 26 MET ME 1 55 LYS HG3 3.260 . 4.720 4.123 2.464 4.889 0.169 5 0 "[ . 1 . 2]" 1
471 1 26 MET ME 1 56 GLY H 3.070 . 4.340 3.961 3.504 4.394 0.054 6 0 "[ . 1 . 2]" 1
472 1 26 MET HG2 1 27 GLY H 3.640 . 5.480 3.109 2.528 3.555 . 0 0 "[ . 1 . 2]" 1
473 1 26 MET HG3 1 27 GLY H 3.630 . 5.460 4.142 3.742 4.380 . 0 0 "[ . 1 . 2]" 1
474 1 27 GLY H 1 27 GLY HA2 2.980 . 4.160 2.899 2.826 2.951 . 0 0 "[ . 1 . 2]" 1
475 1 27 GLY H 1 54 MET ME 3.050 . 4.300 2.855 2.690 3.278 . 0 0 "[ . 1 . 2]" 1
476 1 27 GLY H 1 59 ILE MG 3.650 . 5.500 4.953 4.610 5.198 . 0 0 "[ . 1 . 2]" 1
477 1 27 GLY HA2 1 28 MET H 2.850 . 3.900 2.190 2.144 2.684 . 0 0 "[ . 1 . 2]" 1
478 1 27 GLY HA2 1 54 MET ME 3.100 . 4.400 2.563 2.271 2.677 . 0 0 "[ . 1 . 2]" 1
479 1 27 GLY HA3 1 28 MET H 2.910 . 4.020 3.245 2.519 3.361 . 0 0 "[ . 1 . 2]" 1
480 1 27 GLY HA3 1 54 MET ME 2.720 . 3.630 3.722 3.654 3.814 0.184 17 0 "[ . 1 . 2]" 1
481 1 28 MET H 1 28 MET HB2 3.150 . 4.500 2.561 2.430 3.298 . 0 0 "[ . 1 . 2]" 1
482 1 28 MET H 1 28 MET HB3 3.320 . 4.840 2.811 2.586 3.620 . 0 0 "[ . 1 . 2]" 1
483 1 28 MET H 1 28 MET ME 3.620 . 5.440 5.307 4.401 5.532 0.092 7 0 "[ . 1 . 2]" 1
484 1 28 MET H 1 36 MET H 3.530 . 5.260 5.103 4.098 5.370 0.110 14 0 "[ . 1 . 2]" 1
485 1 28 MET H 1 54 MET ME 2.740 . 3.680 2.335 2.066 3.720 0.040 17 0 "[ . 1 . 2]" 1
486 1 28 MET H 1 59 ILE HB 3.650 . 5.500 4.075 2.999 4.461 . 0 0 "[ . 1 . 2]" 1
487 1 28 MET H 1 59 ILE MD 3.140 . 4.480 4.454 3.854 4.639 0.159 15 0 "[ . 1 . 2]" 1
488 1 28 MET HA 1 28 MET HB2 2.840 . 3.880 2.626 2.526 3.027 . 0 0 "[ . 1 . 2]" 1
489 1 28 MET HA 1 28 MET ME 2.640 . 3.480 3.160 2.539 3.442 . 0 0 "[ . 1 . 2]" 1
490 1 28 MET HA 1 28 MET HG2 3.310 . 4.820 3.561 3.028 3.673 . 0 0 "[ . 1 . 2]" 1
491 1 28 MET HA 1 28 MET HG3 3.390 . 4.980 2.914 2.592 3.725 . 0 0 "[ . 1 . 2]" 1
492 1 28 MET HA 1 29 GLU H 2.630 . 3.460 2.255 2.126 2.379 . 0 0 "[ . 1 . 2]" 1
493 1 28 MET HA 1 54 MET ME 3.450 . 5.100 3.415 3.156 4.229 . 0 0 "[ . 1 . 2]" 1
494 1 28 MET HA 1 59 ILE MG 3.640 . 5.480 4.021 3.829 4.300 . 0 0 "[ . 1 . 2]" 1
495 1 28 MET HB2 1 28 MET HG3 2.950 . 4.100 2.935 2.438 3.025 . 0 0 "[ . 1 . 2]" 1
496 1 28 MET HB2 1 36 MET H 3.650 . 5.500 4.628 1.938 5.468 . 0 0 "[ . 1 . 2]" 1
497 1 28 MET HB3 1 28 MET ME 3.270 . 4.740 3.877 2.067 4.233 . 0 0 "[ . 1 . 2]" 1
498 1 28 MET HB3 1 28 MET HG2 2.830 . 3.850 2.499 2.346 3.032 . 0 0 "[ . 1 . 2]" 1
499 1 28 MET HB3 1 28 MET HG3 2.990 . 4.180 2.502 2.454 2.582 . 0 0 "[ . 1 . 2]" 1
500 1 28 MET HB3 1 29 GLU H 3.650 . 5.500 4.031 2.588 4.431 . 0 0 "[ . 1 . 2]" 1
501 1 28 MET HB3 1 36 MET H 3.400 . 5.000 3.338 2.462 3.892 . 0 0 "[ . 1 . 2]" 1
502 1 28 MET ME 1 28 MET HG2 2.980 . 4.160 2.817 2.620 3.383 . 0 0 "[ . 1 . 2]" 1
503 1 28 MET ME 1 28 MET HG3 3.120 . 4.440 2.229 2.173 2.459 . 0 0 "[ . 1 . 2]" 1
504 1 28 MET ME 1 29 GLU H 2.940 . 4.080 3.403 2.297 4.117 0.037 1 0 "[ . 1 . 2]" 1
505 1 28 MET ME 1 30 ASN HA 3.420 . 5.040 3.861 3.392 4.794 . 0 0 "[ . 1 . 2]" 1
506 1 28 MET ME 1 36 MET H 3.650 . 5.500 4.716 3.996 5.266 . 0 0 "[ . 1 . 2]" 1
507 1 28 MET ME 1 38 MET HB2 3.610 . 5.420 3.824 3.279 4.068 . 0 0 "[ . 1 . 2]" 1
508 1 28 MET ME 1 38 MET HB3 3.410 . 5.020 4.555 4.082 4.738 . 0 0 "[ . 1 . 2]" 1
509 1 28 MET ME 1 38 MET ME 2.340 . 2.880 2.889 2.346 3.033 0.153 6 0 "[ . 1 . 2]" 1
510 1 28 MET HG2 1 29 GLU H 3.650 . 5.500 4.958 3.893 5.453 . 0 0 "[ . 1 . 2]" 1
511 1 28 MET HG2 1 36 MET H 3.060 . 4.310 4.288 4.010 4.491 0.181 18 0 "[ . 1 . 2]" 1
512 1 28 MET HG2 1 38 MET H 3.650 . 5.500 3.473 2.903 4.443 . 0 0 "[ . 1 . 2]" 1
513 1 28 MET HG2 1 38 MET HB2 3.000 . 4.200 2.458 2.231 3.572 . 0 0 "[ . 1 . 2]" 1
514 1 28 MET HG2 1 38 MET HB3 2.810 . 3.810 2.724 2.348 3.027 . 0 0 "[ . 1 . 2]" 1
515 1 28 MET HG3 1 29 GLU H 3.650 . 5.500 3.678 2.210 5.147 . 0 0 "[ . 1 . 2]" 1
516 1 28 MET HG3 1 36 MET H 3.550 . 5.300 3.516 3.072 4.055 . 0 0 "[ . 1 . 2]" 1
517 1 28 MET HG3 1 38 MET HB2 3.160 . 4.520 3.740 2.286 4.039 . 0 0 "[ . 1 . 2]" 1
518 1 29 GLU H 1 29 GLU HA 3.000 . 4.200 2.939 2.890 2.972 . 0 0 "[ . 1 . 2]" 1
519 1 30 ASN H 1 30 ASN HA 2.870 . 3.940 2.854 2.797 2.907 . 0 0 "[ . 1 . 2]" 1
520 1 30 ASN H 1 30 ASN HB2 2.920 . 4.040 3.594 3.541 3.631 . 0 0 "[ . 1 . 2]" 1
521 1 30 ASN H 1 30 ASN HB3 3.280 . 4.760 2.515 2.258 2.713 . 0 0 "[ . 1 . 2]" 1
522 1 30 ASN H 1 30 ASN HD21 3.650 . 5.500 3.394 1.788 4.493 0.012 7 0 "[ . 1 . 2]" 1
523 1 30 ASN H 1 30 ASN HD22 3.650 . 5.500 3.927 3.283 4.541 . 0 0 "[ . 1 . 2]" 1
524 1 30 ASN H 1 31 LYS H 3.650 . 5.500 4.584 4.413 4.649 . 0 0 "[ . 1 . 2]" 1
525 1 30 ASN H 1 32 PHE H 3.650 . 5.500 4.641 4.369 4.902 . 0 0 "[ . 1 . 2]" 1
526 1 30 ASN H 1 33 GLY H 3.650 . 5.500 4.955 4.287 5.525 0.025 1 0 "[ . 1 . 2]" 1
527 1 30 ASN H 1 34 LYS HB2 3.650 . 5.500 5.004 4.205 5.540 0.040 11 0 "[ . 1 . 2]" 1
528 1 30 ASN H 1 35 SER HA 3.080 . 4.360 3.139 2.435 3.794 . 0 0 "[ . 1 . 2]" 1
529 1 30 ASN H 1 36 MET H 3.320 . 4.840 3.388 2.779 4.384 . 0 0 "[ . 1 . 2]" 1
530 1 30 ASN H 1 36 MET HB2 3.650 . 5.500 3.571 2.216 4.034 . 0 0 "[ . 1 . 2]" 1
531 1 30 ASN H 1 36 MET HB3 3.650 . 5.500 5.075 3.721 5.609 0.109 18 0 "[ . 1 . 2]" 1
532 1 30 ASN H 1 36 MET HG2 3.650 . 5.500 4.375 3.188 5.524 0.024 3 0 "[ . 1 . 2]" 1
533 1 30 ASN HA 1 30 ASN HB2 2.640 . 3.480 2.414 2.327 2.516 . 0 0 "[ . 1 . 2]" 1
534 1 30 ASN HA 1 30 ASN HB3 2.690 . 3.580 2.503 2.403 2.618 . 0 0 "[ . 1 . 2]" 1
535 1 30 ASN HA 1 30 ASN HD21 3.470 . 5.140 4.073 3.367 4.716 . 0 0 "[ . 1 . 2]" 1
536 1 30 ASN HA 1 30 ASN HD22 3.650 . 5.500 5.094 4.775 5.397 . 0 0 "[ . 1 . 2]" 1
537 1 30 ASN HA 1 31 LYS H 2.760 . 3.720 2.440 2.189 2.799 . 0 0 "[ . 1 . 2]" 1
538 1 30 ASN HA 1 32 PHE H 3.630 . 5.460 4.019 3.627 4.616 . 0 0 "[ . 1 . 2]" 1
539 1 30 ASN HB2 1 30 ASN HD21 2.820 . 3.840 2.952 2.526 3.525 . 0 0 "[ . 1 . 2]" 1
540 1 30 ASN HB2 1 30 ASN HD22 2.980 . 4.160 3.807 3.621 4.070 . 0 0 "[ . 1 . 2]" 1
541 1 30 ASN HB2 1 31 LYS H 2.910 . 4.020 2.495 2.004 3.058 . 0 0 "[ . 1 . 2]" 1
542 1 30 ASN HB2 1 32 PHE H 3.630 . 5.460 2.857 2.411 3.520 . 0 0 "[ . 1 . 2]" 1
543 1 30 ASN HB2 1 36 MET HB2 3.430 . 5.060 4.810 3.870 5.141 0.081 14 0 "[ . 1 . 2]" 1
544 1 30 ASN HB2 1 36 MET HG2 3.480 . 5.160 4.614 3.794 5.216 0.056 11 0 "[ . 1 . 2]" 1
545 1 30 ASN HB2 1 36 MET HG3 3.580 . 5.360 4.065 3.513 5.381 0.021 12 0 "[ . 1 . 2]" 1
546 1 30 ASN HB3 1 30 ASN HD21 3.000 . 4.200 3.003 2.243 3.619 . 0 0 "[ . 1 . 2]" 1
547 1 30 ASN HB3 1 36 MET HB2 3.650 . 5.500 3.154 2.326 3.664 . 0 0 "[ . 1 . 2]" 1
548 1 30 ASN HB3 1 36 MET HB3 3.650 . 5.500 4.353 3.673 4.958 . 0 0 "[ . 1 . 2]" 1
549 1 30 ASN HB3 1 36 MET HG2 3.650 . 5.500 3.222 2.360 4.050 . 0 0 "[ . 1 . 2]" 1
550 1 30 ASN HB3 1 36 MET HG3 3.650 . 5.500 2.703 2.336 4.267 . 0 0 "[ . 1 . 2]" 1
551 1 30 ASN HD21 1 34 LYS HB2 3.220 . 4.640 3.613 3.141 4.286 . 0 0 "[ . 1 . 2]" 1
552 1 30 ASN HD21 1 34 LYS HB3 3.430 . 5.060 4.507 2.916 5.070 0.010 16 0 "[ . 1 . 2]" 1
553 1 30 ASN HD22 1 34 LYS HB2 2.890 . 3.980 2.138 1.805 3.027 . 0 0 "[ . 1 . 2]" 1
554 1 30 ASN HD22 1 34 LYS HB3 3.180 . 4.560 3.208 1.834 4.302 . 0 0 "[ . 1 . 2]" 1
555 1 30 ASN HD22 1 34 LYS QD 3.650 . 5.500 4.177 2.406 5.026 . 0 0 "[ . 1 . 2]" 1
556 1 30 ASN HD22 1 34 LYS HG2 3.650 . 5.500 4.180 2.605 5.073 . 0 0 "[ . 1 . 2]" 1
557 1 30 ASN HD22 1 34 LYS HG3 3.650 . 5.500 3.839 3.117 5.182 . 0 0 "[ . 1 . 2]" 1
558 1 31 LYS H 1 31 LYS HA 2.930 . 4.060 2.842 2.739 2.910 . 0 0 "[ . 1 . 2]" 1
559 1 31 LYS H 1 31 LYS HB2 2.850 . 3.900 3.397 2.395 3.641 . 0 0 "[ . 1 . 2]" 1
560 1 31 LYS H 1 31 LYS HB3 2.980 . 4.160 2.506 2.348 2.738 . 0 0 "[ . 1 . 2]" 1
561 1 31 LYS H 1 31 LYS HG2 3.260 . 4.720 3.621 3.019 4.454 . 0 0 "[ . 1 . 2]" 1
562 1 31 LYS H 1 32 PHE H 2.920 . 4.040 2.616 2.396 2.849 . 0 0 "[ . 1 . 2]" 1
563 1 31 LYS HA 1 31 LYS HB2 2.580 . 3.360 2.420 2.328 2.580 . 0 0 "[ . 1 . 2]" 1
564 1 31 LYS HA 1 31 LYS HB3 2.730 . 3.660 2.610 2.346 3.029 . 0 0 "[ . 1 . 2]" 1
565 1 31 LYS HA 1 31 LYS QD 3.650 . 5.500 3.613 3.435 3.842 . 0 0 "[ . 1 . 2]" 1
566 1 31 LYS HA 1 31 LYS QE 3.650 . 5.500 4.913 3.947 5.551 0.051 7 0 "[ . 1 . 2]" 1
567 1 31 LYS HA 1 31 LYS HG2 3.410 . 5.020 3.614 2.315 4.235 . 0 0 "[ . 1 . 2]" 1
568 1 31 LYS HA 1 31 LYS HG3 3.460 . 5.120 3.866 3.444 4.264 . 0 0 "[ . 1 . 2]" 1
569 1 31 LYS HA 1 32 PHE H 3.000 . 4.200 3.375 3.259 3.520 . 0 0 "[ . 1 . 2]" 1
570 1 31 LYS HA 1 33 GLY H 3.290 . 4.780 3.254 3.089 3.411 . 0 0 "[ . 1 . 2]" 1
571 1 31 LYS HB2 1 31 LYS QE 3.410 . 5.020 3.862 2.302 4.558 . 0 0 "[ . 1 . 2]" 1
572 1 31 LYS HB2 1 32 PHE H 3.360 . 4.920 4.241 3.928 4.457 . 0 0 "[ . 1 . 2]" 1
573 1 31 LYS HB3 1 31 LYS QE 3.650 . 5.500 3.697 2.197 4.527 . 0 0 "[ . 1 . 2]" 1
574 1 31 LYS HB3 1 31 LYS HG2 2.950 . 4.100 2.779 2.297 3.048 . 0 0 "[ . 1 . 2]" 1
575 1 31 LYS HB3 1 32 PHE H 3.650 . 5.500 3.974 2.773 4.457 . 0 0 "[ . 1 . 2]" 1
576 1 31 LYS QD 1 32 PHE HB3 3.330 . 4.860 4.365 3.629 4.889 0.029 13 0 "[ . 1 . 2]" 1
577 1 31 LYS QE 1 31 LYS HG2 3.140 . 4.480 2.679 2.237 3.608 . 0 0 "[ . 1 . 2]" 1
578 1 31 LYS QE 1 31 LYS HG3 3.200 . 4.600 2.687 2.278 3.535 . 0 0 "[ . 1 . 2]" 1
579 1 31 LYS HG2 1 32 PHE H 3.210 . 4.620 3.991 2.896 4.674 0.054 11 0 "[ . 1 . 2]" 1
580 1 31 LYS HG2 1 32 PHE QD 3.650 . 5.500 4.790 4.076 5.538 0.038 14 0 "[ . 1 . 2]" 1
581 1 31 LYS HG3 1 32 PHE QD 3.650 . 5.500 5.093 2.892 5.549 0.049 2 0 "[ . 1 . 2]" 1
582 1 32 PHE H 1 32 PHE HB2 2.750 . 3.700 2.405 2.312 2.549 . 0 0 "[ . 1 . 2]" 1
583 1 32 PHE H 1 32 PHE HB3 2.770 . 3.740 3.023 2.646 3.621 . 0 0 "[ . 1 . 2]" 1
584 1 32 PHE H 1 32 PHE QD 3.100 . 4.400 3.585 1.801 4.203 . 0 0 "[ . 1 . 2]" 1
585 1 32 PHE H 1 33 GLY H 2.500 . 3.200 2.668 2.475 2.804 . 0 0 "[ . 1 . 2]" 1
586 1 32 PHE HA 1 32 PHE HB3 2.610 . 3.420 2.857 2.423 3.021 . 0 0 "[ . 1 . 2]" 1
587 1 32 PHE HA 1 33 GLY H 3.390 . 4.980 3.171 3.083 3.317 . 0 0 "[ . 1 . 2]" 1
588 1 32 PHE HB2 1 32 PHE QD 2.930 . 4.060 2.468 2.322 2.603 . 0 0 "[ . 1 . 2]" 1
589 1 32 PHE HB2 1 33 GLY H 3.530 . 5.260 4.145 3.634 4.451 . 0 0 "[ . 1 . 2]" 1
590 1 32 PHE HB2 1 34 LYS H 3.250 . 4.700 3.908 2.738 4.716 0.016 13 0 "[ . 1 . 2]" 1
591 1 32 PHE HB3 1 33 GLY H 3.650 . 5.500 3.939 3.483 4.462 . 0 0 "[ . 1 . 2]" 1
592 1 32 PHE HB3 1 34 LYS H 3.550 . 5.300 3.195 2.606 4.169 . 0 0 "[ . 1 . 2]" 1
593 1 33 GLY H 1 33 GLY HA2 2.840 . 3.880 2.310 2.302 2.331 . 0 0 "[ . 1 . 2]" 1
594 1 33 GLY H 1 33 GLY HA3 2.750 . 3.700 2.859 2.838 2.905 . 0 0 "[ . 1 . 2]" 1
595 1 33 GLY H 1 34 LYS H 2.670 . 3.530 2.570 2.355 2.692 . 0 0 "[ . 1 . 2]" 1
596 1 33 GLY HA2 1 34 LYS H 3.280 . 4.770 3.153 2.922 3.261 . 0 0 "[ . 1 . 2]" 1
597 1 33 GLY HA3 1 34 LYS H 3.330 . 4.860 3.374 3.288 3.511 . 0 0 "[ . 1 . 2]" 1
598 1 34 LYS H 1 34 LYS HB2 2.860 . 3.920 2.624 2.375 2.782 . 0 0 "[ . 1 . 2]" 1
599 1 34 LYS H 1 34 LYS HB3 3.210 . 4.620 3.533 2.561 3.866 . 0 0 "[ . 1 . 2]" 1
600 1 34 LYS H 1 34 LYS QD 3.560 . 5.320 4.265 3.292 4.894 . 0 0 "[ . 1 . 2]" 1
601 1 34 LYS H 1 34 LYS HG2 3.170 . 4.540 3.692 2.041 4.523 . 0 0 "[ . 1 . 2]" 1
602 1 34 LYS H 1 34 LYS HG3 3.360 . 4.920 3.575 2.505 4.497 . 0 0 "[ . 1 . 2]" 1
603 1 34 LYS H 1 35 SER H 3.490 . 5.180 4.439 4.172 4.597 . 0 0 "[ . 1 . 2]" 1
604 1 34 LYS HA 1 34 LYS HB2 2.990 . 4.180 2.930 2.510 3.031 . 0 0 "[ . 1 . 2]" 1
605 1 34 LYS HA 1 34 LYS HB3 2.990 . 4.180 2.590 2.403 3.026 . 0 0 "[ . 1 . 2]" 1
606 1 34 LYS HA 1 34 LYS QD 3.140 . 4.480 3.445 2.196 4.151 . 0 0 "[ . 1 . 2]" 1
607 1 34 LYS HA 1 34 LYS HG2 3.300 . 4.800 2.684 2.345 3.180 . 0 0 "[ . 1 . 2]" 1
608 1 34 LYS HA 1 34 LYS HG3 3.420 . 5.040 3.097 2.321 3.796 . 0 0 "[ . 1 . 2]" 1
609 1 34 LYS HA 1 35 SER H 2.600 . 3.400 2.323 2.141 2.596 . 0 0 "[ . 1 . 2]" 1
610 1 34 LYS HB2 1 34 LYS QE 3.650 . 5.500 3.686 2.145 4.562 . 0 0 "[ . 1 . 2]" 1
611 1 34 LYS HB2 1 34 LYS HG2 2.900 . 4.000 2.892 2.504 3.037 . 0 0 "[ . 1 . 2]" 1
612 1 34 LYS HB2 1 34 LYS HG3 2.820 . 3.840 2.445 2.334 2.588 . 0 0 "[ . 1 . 2]" 1
613 1 34 LYS HB2 1 35 SER H 3.380 . 4.960 3.872 3.176 4.373 . 0 0 "[ . 1 . 2]" 1
614 1 34 LYS HB3 1 34 LYS QD 3.120 . 4.440 2.490 2.239 3.127 . 0 0 "[ . 1 . 2]" 1
615 1 34 LYS HB3 1 34 LYS QE 3.650 . 5.500 3.440 2.208 4.219 . 0 0 "[ . 1 . 2]" 1
616 1 34 LYS HB3 1 35 SER H 2.910 . 4.020 2.948 2.051 4.057 0.037 15 0 "[ . 1 . 2]" 1
617 1 34 LYS QD 1 35 SER H 3.650 . 5.500 4.347 3.491 5.443 . 0 0 "[ . 1 . 2]" 1
618 1 34 LYS QE 1 34 LYS HG2 3.330 . 4.860 2.699 2.276 3.551 . 0 0 "[ . 1 . 2]" 1
619 1 34 LYS QE 1 34 LYS HG3 3.060 . 4.320 2.699 2.234 3.552 . 0 0 "[ . 1 . 2]" 1
620 1 34 LYS HG2 1 35 SER H 3.650 . 5.500 3.952 2.076 5.138 . 0 0 "[ . 1 . 2]" 1
621 1 35 SER H 1 35 SER HA 2.850 . 3.900 2.888 2.788 2.973 . 0 0 "[ . 1 . 2]" 1
622 1 35 SER H 1 35 SER QB 2.750 . 3.700 2.470 2.188 2.755 . 0 0 "[ . 1 . 2]" 1
623 1 35 SER H 1 36 MET H 3.550 . 5.300 4.508 4.304 4.631 . 0 0 "[ . 1 . 2]" 1
624 1 35 SER HA 1 36 MET H 2.480 . 3.160 2.236 2.146 2.541 . 0 0 "[ . 1 . 2]" 1
625 1 35 SER QB 1 36 MET H 2.830 . 3.860 3.147 2.277 3.883 0.023 5 0 "[ . 1 . 2]" 1
626 1 35 SER QB 1 59 ILE MD 3.360 . 4.920 2.379 2.041 3.198 . 0 0 "[ . 1 . 2]" 1
627 1 35 SER QB 1 59 ILE MG 3.050 . 4.300 3.482 2.836 4.290 . 0 0 "[ . 1 . 2]" 1
628 1 36 MET H 1 36 MET HB2 3.010 . 4.220 2.498 2.331 2.808 . 0 0 "[ . 1 . 2]" 1
629 1 36 MET H 1 36 MET HB3 3.210 . 4.620 3.421 2.714 3.790 . 0 0 "[ . 1 . 2]" 1
630 1 36 MET H 1 36 MET HG2 3.090 . 4.380 3.780 2.771 4.579 0.199 11 0 "[ . 1 . 2]" 1
631 1 36 MET H 1 36 MET HG3 3.240 . 4.680 4.179 2.765 4.745 0.065 19 0 "[ . 1 . 2]" 1
632 1 36 MET H 1 59 ILE MD 3.010 . 4.220 3.420 2.755 4.063 . 0 0 "[ . 1 . 2]" 1
633 1 36 MET HA 1 36 MET HB3 2.800 . 3.800 2.724 2.547 3.017 . 0 0 "[ . 1 . 2]" 1
634 1 36 MET HA 1 36 MET HG2 3.460 . 5.120 2.526 2.320 2.735 . 0 0 "[ . 1 . 2]" 1
635 1 36 MET HA 1 36 MET HG3 3.570 . 5.340 3.432 2.672 3.652 . 0 0 "[ . 1 . 2]" 1
636 1 36 MET HB2 1 37 ASN H 3.580 . 5.360 4.479 4.248 4.591 . 0 0 "[ . 1 . 2]" 1
637 1 36 MET HB3 1 36 MET HG2 2.910 . 4.020 2.904 2.479 3.037 . 0 0 "[ . 1 . 2]" 1
638 1 36 MET HB3 1 37 ASN H 3.440 . 5.080 3.761 3.154 4.227 . 0 0 "[ . 1 . 2]" 1
639 1 36 MET HG2 1 37 ASN H 3.650 . 5.500 4.353 3.094 4.864 . 0 0 "[ . 1 . 2]" 1
640 1 36 MET HG3 1 37 ASN H 3.650 . 5.500 5.141 4.248 5.546 0.046 1 0 "[ . 1 . 2]" 1
641 1 37 ASN H 1 37 ASN HA 2.870 . 3.940 2.838 2.767 2.898 . 0 0 "[ . 1 . 2]" 1
642 1 37 ASN H 1 37 ASN QB 2.720 . 3.630 2.251 2.195 2.277 . 0 0 "[ . 1 . 2]" 1
643 1 37 ASN H 1 59 ILE MD 3.500 . 5.200 3.155 2.800 3.325 . 0 0 "[ . 1 . 2]" 1
644 1 37 ASN H 1 59 ILE MG 3.650 . 5.500 4.792 4.484 5.567 0.067 17 0 "[ . 1 . 2]" 1
645 1 37 ASN HA 1 37 ASN QB 2.590 . 3.380 2.343 2.298 2.431 . 0 0 "[ . 1 . 2]" 1
646 1 37 ASN HA 1 37 ASN HD21 3.060 . 4.310 2.428 1.932 3.231 . 0 0 "[ . 1 . 2]" 1
647 1 37 ASN HA 1 37 ASN HD22 3.150 . 4.500 3.703 3.518 3.971 . 0 0 "[ . 1 . 2]" 1
648 1 37 ASN HA 1 38 MET H 2.460 . 3.120 2.238 2.131 2.294 . 0 0 "[ . 1 . 2]" 1
649 1 37 ASN HA 1 57 ASN HD21 3.410 . 5.020 4.023 3.818 4.202 . 0 0 "[ . 1 . 2]" 1
650 1 37 ASN HA 1 57 ASN HD22 3.120 . 4.440 3.625 3.260 3.871 . 0 0 "[ . 1 . 2]" 1
651 1 37 ASN HA 1 59 ILE MD 2.700 . 3.600 2.098 2.073 2.173 . 0 0 "[ . 1 . 2]" 1
652 1 37 ASN HA 1 59 ILE HG12 3.650 . 5.500 3.445 3.193 3.668 . 0 0 "[ . 1 . 2]" 1
653 1 37 ASN HA 1 59 ILE MG 3.550 . 5.300 3.130 2.672 3.729 . 0 0 "[ . 1 . 2]" 1
654 1 37 ASN QB 1 37 ASN HD21 2.970 . 4.140 2.845 2.614 2.963 . 0 0 "[ . 1 . 2]" 1
655 1 37 ASN QB 1 37 ASN HD22 3.170 . 4.540 3.509 3.440 3.546 . 0 0 "[ . 1 . 2]" 1
656 1 37 ASN QB 1 38 MET H 2.950 . 4.100 3.985 3.621 4.046 . 0 0 "[ . 1 . 2]" 1
657 1 37 ASN QB 1 57 ASN HD21 3.650 . 5.500 5.439 5.256 5.527 0.027 19 0 "[ . 1 . 2]" 1
658 1 37 ASN QB 1 57 ASN HD22 3.200 . 4.600 4.543 4.239 4.663 0.063 12 0 "[ . 1 . 2]" 1
659 1 37 ASN QB 1 59 ILE MD 2.710 . 3.610 2.456 2.257 3.273 . 0 0 "[ . 1 . 2]" 1
660 1 37 ASN QB 1 59 ILE MG 3.430 . 5.060 4.608 4.259 5.130 0.070 17 0 "[ . 1 . 2]" 1
661 1 37 ASN HD22 1 39 PRO HD2 3.650 . 5.500 5.515 5.238 5.611 0.111 17 0 "[ . 1 . 2]" 1
662 1 37 ASN HD22 1 39 PRO HD3 3.490 . 5.180 4.134 3.757 4.297 . 0 0 "[ . 1 . 2]" 1
663 1 37 ASN HD22 1 59 ILE MD 3.650 . 5.500 4.611 4.399 4.954 . 0 0 "[ . 1 . 2]" 1
664 1 37 ASN HD22 1 59 ILE MG 3.620 . 5.440 5.436 5.268 5.514 0.074 1 0 "[ . 1 . 2]" 1
665 1 38 MET H 1 38 MET HA 2.490 . 3.180 2.938 2.910 2.959 . 0 0 "[ . 1 . 2]" 1
666 1 38 MET H 1 38 MET HB2 2.870 . 3.940 2.984 2.819 3.344 . 0 0 "[ . 1 . 2]" 1
667 1 38 MET H 1 38 MET HB3 2.990 . 4.180 2.455 2.242 2.837 . 0 0 "[ . 1 . 2]" 1
668 1 38 MET H 1 39 PRO HD3 3.440 . 5.080 4.620 4.086 4.844 . 0 0 "[ . 1 . 2]" 1
669 1 38 MET H 1 54 MET ME 3.000 . 4.200 4.183 3.955 4.256 0.056 1 0 "[ . 1 . 2]" 1
670 1 38 MET H 1 57 ASN HD21 3.320 . 4.840 3.331 2.740 3.861 . 0 0 "[ . 1 . 2]" 1
671 1 38 MET H 1 57 ASN HD22 2.930 . 4.060 3.467 2.715 4.045 . 0 0 "[ . 1 . 2]" 1
672 1 38 MET H 1 59 ILE MD 3.110 . 4.420 3.467 2.666 3.663 . 0 0 "[ . 1 . 2]" 1
673 1 38 MET H 1 59 ILE MG 3.510 . 5.220 3.277 3.014 3.621 . 0 0 "[ . 1 . 2]" 1
674 1 38 MET HA 1 38 MET HB3 2.820 . 3.840 3.025 3.007 3.034 . 0 0 "[ . 1 . 2]" 1
675 1 38 MET HA 1 38 MET ME 3.120 . 4.440 3.599 3.455 3.722 . 0 0 "[ . 1 . 2]" 1
676 1 38 MET HA 1 38 MET QG 2.700 . 3.590 2.408 2.290 2.618 . 0 0 "[ . 1 . 2]" 1
677 1 38 MET HA 1 39 PRO HD2 2.690 . 3.570 2.328 2.260 2.413 . 0 0 "[ . 1 . 2]" 1
678 1 38 MET HA 1 39 PRO HD3 2.630 . 3.460 2.347 2.259 2.452 . 0 0 "[ . 1 . 2]" 1
679 1 38 MET HA 1 42 LYS QD 3.530 . 5.260 5.142 3.719 5.363 0.103 19 0 "[ . 1 . 2]" 1
680 1 38 MET HA 1 42 LYS QG 3.460 . 5.120 4.280 4.059 5.154 0.034 17 0 "[ . 1 . 2]" 1
681 1 38 MET HB2 1 39 PRO HD2 3.340 . 4.880 4.133 3.810 4.429 . 0 0 "[ . 1 . 2]" 1
682 1 38 MET HB2 1 39 PRO HD3 3.650 . 5.500 4.707 4.574 4.821 . 0 0 "[ . 1 . 2]" 1
683 1 38 MET HB3 1 38 MET QG 2.630 . 3.460 2.320 2.296 2.348 . 0 0 "[ . 1 . 2]" 1
684 1 38 MET HB3 1 39 PRO HD2 3.550 . 5.300 4.570 4.436 4.794 . 0 0 "[ . 1 . 2]" 1
685 1 38 MET HB3 1 39 PRO HD3 3.560 . 5.320 5.061 4.962 5.159 . 0 0 "[ . 1 . 2]" 1
686 1 38 MET ME 1 38 MET QG 2.880 . 3.960 2.218 2.148 2.277 . 0 0 "[ . 1 . 2]" 1
687 1 38 MET ME 1 42 LYS H 3.430 . 5.060 5.054 4.700 5.128 0.068 6 0 "[ . 1 . 2]" 1
688 1 38 MET ME 1 42 LYS HB2 2.510 . 3.220 3.287 3.246 3.378 0.158 6 0 "[ . 1 . 2]" 1
689 1 38 MET ME 1 42 LYS HB3 3.100 . 4.400 2.398 2.239 2.774 . 0 0 "[ . 1 . 2]" 1
690 1 38 MET ME 1 42 LYS QD 2.570 . 3.340 2.903 2.022 3.625 0.285 10 0 "[ . 1 . 2]" 1
691 1 38 MET ME 1 42 LYS QE 3.650 . 5.500 4.430 3.483 4.971 . 0 0 "[ . 1 . 2]" 1
692 1 38 MET ME 1 42 LYS QG 3.240 . 4.680 3.199 1.995 3.732 . 0 0 "[ . 1 . 2]" 1
693 1 38 MET ME 1 44 MET HA 3.100 . 4.400 4.348 4.088 4.476 0.076 17 0 "[ . 1 . 2]" 1
694 1 38 MET QG 1 39 PRO HD2 2.790 . 3.780 2.366 2.242 2.647 . 0 0 "[ . 1 . 2]" 1
695 1 38 MET QG 1 39 PRO HD3 2.940 . 4.080 3.617 3.522 3.735 . 0 0 "[ . 1 . 2]" 1
696 1 38 MET QG 1 40 GLU H 3.530 . 5.260 4.998 4.572 5.225 . 0 0 "[ . 1 . 2]" 1
697 1 38 MET QG 1 42 LYS H 2.950 . 4.100 3.469 3.277 3.715 . 0 0 "[ . 1 . 2]" 1
698 1 38 MET QG 1 42 LYS QG 3.010 . 4.220 2.762 2.527 3.421 . 0 0 "[ . 1 . 2]" 1
699 1 39 PRO HA 1 39 PRO HB3 2.940 . 4.080 2.324 2.310 2.335 . 0 0 "[ . 1 . 2]" 1
700 1 39 PRO HA 1 39 PRO HD2 3.090 . 4.380 4.028 3.922 4.097 . 0 0 "[ . 1 . 2]" 1
701 1 39 PRO HA 1 39 PRO HD3 3.360 . 4.920 3.605 3.473 3.734 . 0 0 "[ . 1 . 2]" 1
702 1 39 PRO HA 1 39 PRO QG 3.550 . 5.300 3.257 2.831 3.521 . 0 0 "[ . 1 . 2]" 1
703 1 39 PRO HA 1 40 GLU H 2.250 . 2.700 2.251 2.155 2.377 . 0 0 "[ . 1 . 2]" 1
704 1 39 PRO HA 1 57 ASN HB2 3.490 . 5.180 4.132 3.138 4.650 . 0 0 "[ . 1 . 2]" 1
705 1 39 PRO HA 1 57 ASN HB3 3.630 . 5.460 5.043 4.087 5.481 0.021 13 0 "[ . 1 . 2]" 1
706 1 39 PRO HA 1 57 ASN HD21 3.210 . 4.620 4.240 3.555 4.641 0.021 10 0 "[ . 1 . 2]" 1
707 1 39 PRO HA 1 57 ASN HD22 3.450 . 5.100 3.464 3.020 3.945 . 0 0 "[ . 1 . 2]" 1
708 1 39 PRO HB2 1 39 PRO HD2 2.990 . 4.180 3.657 3.057 4.055 . 0 0 "[ . 1 . 2]" 1
709 1 39 PRO HB2 1 39 PRO HD3 3.170 . 4.540 3.940 3.886 3.988 . 0 0 "[ . 1 . 2]" 1
710 1 39 PRO HB2 1 40 GLU H 2.780 . 3.760 3.403 2.750 3.810 0.050 7 0 "[ . 1 . 2]" 1
711 1 39 PRO HB3 1 39 PRO HD2 3.210 . 4.620 3.920 3.872 3.982 . 0 0 "[ . 1 . 2]" 1
712 1 39 PRO HB3 1 39 PRO HD3 3.380 . 4.960 3.432 3.006 4.029 . 0 0 "[ . 1 . 2]" 1
713 1 39 PRO HD2 1 39 PRO QG 2.660 . 3.520 2.221 2.199 2.253 . 0 0 "[ . 1 . 2]" 1
714 1 39 PRO HD2 1 42 LYS H 3.650 . 5.500 4.797 4.474 5.228 . 0 0 "[ . 1 . 2]" 1
715 1 39 PRO HD2 1 42 LYS HB2 3.060 . 4.310 3.353 3.159 3.612 . 0 0 "[ . 1 . 2]" 1
716 1 39 PRO HD2 1 42 LYS QD 3.370 . 4.940 3.756 2.304 4.143 . 0 0 "[ . 1 . 2]" 1
717 1 39 PRO HD2 1 42 LYS QE 3.380 . 4.960 4.261 3.903 4.905 . 0 0 "[ . 1 . 2]" 1
718 1 39 PRO HD2 1 42 LYS QG 2.990 . 4.180 2.521 2.268 3.534 . 0 0 "[ . 1 . 2]" 1
719 1 39 PRO HD3 1 39 PRO QG 2.650 . 3.500 2.228 2.194 2.253 . 0 0 "[ . 1 . 2]" 1
720 1 39 PRO HD3 1 42 LYS HB2 3.340 . 4.880 5.002 4.739 5.139 0.259 7 0 "[ . 1 . 2]" 1
721 1 39 PRO HD3 1 42 LYS QD 3.650 . 5.500 5.215 3.798 5.557 0.057 14 0 "[ . 1 . 2]" 1
722 1 39 PRO HD3 1 42 LYS QG 3.370 . 4.940 4.101 3.793 5.124 0.184 13 0 "[ . 1 . 2]" 1
723 1 39 PRO QG 1 42 LYS H 3.650 . 5.500 4.393 3.653 5.469 . 0 0 "[ . 1 . 2]" 1
724 1 39 PRO QG 1 42 LYS QG 3.650 . 5.500 2.849 2.337 4.276 . 0 0 "[ . 1 . 2]" 1
725 1 40 GLU H 1 40 GLU HA 2.550 . 3.300 2.814 2.718 2.888 . 0 0 "[ . 1 . 2]" 1
726 1 40 GLU H 1 40 GLU HB3 2.880 . 3.960 2.516 2.419 2.693 . 0 0 "[ . 1 . 2]" 1
727 1 40 GLU H 1 40 GLU HG2 3.060 . 4.320 3.596 1.899 4.442 0.122 13 0 "[ . 1 . 2]" 1
728 1 40 GLU H 1 40 GLU HG3 3.180 . 4.560 4.151 3.345 4.606 0.046 7 0 "[ . 1 . 2]" 1
729 1 40 GLU H 1 41 GLY H 3.180 . 4.560 4.350 3.928 4.589 0.029 1 0 "[ . 1 . 2]" 1
730 1 40 GLU H 1 42 LYS H 3.650 . 5.500 4.883 4.735 5.182 . 0 0 "[ . 1 . 2]" 1
731 1 40 GLU H 1 57 ASN HB2 2.660 . 3.520 3.183 2.530 3.552 0.032 4 0 "[ . 1 . 2]" 1
732 1 40 GLU H 1 57 ASN HB3 3.040 . 4.280 4.151 3.675 4.346 0.066 9 0 "[ . 1 . 2]" 1
733 1 40 GLU H 1 57 ASN HD21 3.470 . 5.140 4.862 4.398 5.150 0.010 20 0 "[ . 1 . 2]" 1
734 1 40 GLU HA 1 40 GLU HB2 2.790 . 3.780 2.461 2.380 2.536 . 0 0 "[ . 1 . 2]" 1
735 1 40 GLU HA 1 40 GLU HB3 2.810 . 3.810 2.831 2.437 3.029 . 0 0 "[ . 1 . 2]" 1
736 1 40 GLU HA 1 40 GLU HG2 3.100 . 4.400 3.182 2.322 3.643 . 0 0 "[ . 1 . 2]" 1
737 1 40 GLU HA 1 40 GLU HG3 3.110 . 4.420 3.094 2.411 3.812 . 0 0 "[ . 1 . 2]" 1
738 1 40 GLU HA 1 41 GLY H 2.380 . 2.960 2.204 2.138 2.381 . 0 0 "[ . 1 . 2]" 1
739 1 40 GLU HA 1 42 LYS H 2.910 . 4.020 3.624 3.373 3.976 . 0 0 "[ . 1 . 2]" 1
740 1 40 GLU HA 1 53 ILE MG 3.400 . 5.000 4.139 3.542 4.586 . 0 0 "[ . 1 . 2]" 1
741 1 40 GLU HA 1 54 MET H 3.530 . 5.270 4.536 4.127 5.050 . 0 0 "[ . 1 . 2]" 1
742 1 40 GLU HA 1 54 MET HB2 3.200 . 4.600 4.318 4.088 4.638 0.038 13 0 "[ . 1 . 2]" 1
743 1 40 GLU HA 1 54 MET HB3 3.140 . 4.480 2.576 2.328 2.912 . 0 0 "[ . 1 . 2]" 1
744 1 40 GLU HA 1 54 MET ME 3.530 . 5.260 5.078 4.619 5.259 . 0 0 "[ . 1 . 2]" 1
745 1 40 GLU HA 1 54 MET HG2 3.080 . 4.360 3.665 3.130 3.980 . 0 0 "[ . 1 . 2]" 1
746 1 40 GLU HA 1 54 MET HG3 2.960 . 4.120 3.501 2.991 3.710 . 0 0 "[ . 1 . 2]" 1
747 1 40 GLU HB2 1 40 GLU HG2 2.710 . 3.620 2.961 2.594 3.030 . 0 0 "[ . 1 . 2]" 1
748 1 40 GLU HB3 1 40 GLU HG2 2.470 . 3.130 2.568 2.379 3.022 . 0 0 "[ . 1 . 2]" 1
749 1 40 GLU HB3 1 40 GLU HG3 2.860 . 3.920 2.959 2.589 3.032 . 0 0 "[ . 1 . 2]" 1
750 1 40 GLU HB3 1 41 GLY H 3.120 . 4.440 4.340 4.030 4.498 0.058 17 0 "[ . 1 . 2]" 1
751 1 40 GLU HG2 1 41 GLY H 3.370 . 4.940 4.092 2.587 4.931 . 0 0 "[ . 1 . 2]" 1
752 1 40 GLU HG3 1 41 GLY H 3.090 . 4.380 4.094 3.248 4.441 0.061 7 0 "[ . 1 . 2]" 1
753 1 41 GLY H 1 41 GLY HA2 2.580 . 3.360 2.561 2.379 2.735 . 0 0 "[ . 1 . 2]" 1
754 1 41 GLY H 1 41 GLY HA3 2.680 . 3.550 2.946 2.876 2.974 . 0 0 "[ . 1 . 2]" 1
755 1 41 GLY H 1 42 LYS H 2.550 . 3.300 2.148 1.740 2.577 0.060 11 0 "[ . 1 . 2]" 1
756 1 41 GLY H 1 53 ILE HA 3.650 . 5.500 4.984 4.648 5.521 0.021 10 0 "[ . 1 . 2]" 1
757 1 41 GLY H 1 53 ILE MG 2.960 . 4.120 2.892 2.525 3.425 . 0 0 "[ . 1 . 2]" 1
758 1 41 GLY H 1 54 MET H 3.300 . 4.800 3.316 3.052 3.694 . 0 0 "[ . 1 . 2]" 1
759 1 41 GLY H 1 54 MET HA 3.650 . 5.500 4.963 4.554 5.175 . 0 0 "[ . 1 . 2]" 1
760 1 41 GLY H 1 54 MET HB2 3.180 . 4.560 3.923 3.655 4.250 . 0 0 "[ . 1 . 2]" 1
761 1 41 GLY H 1 54 MET HB3 2.730 . 3.660 2.451 2.108 2.686 . 0 0 "[ . 1 . 2]" 1
762 1 41 GLY H 1 54 MET HG2 3.510 . 5.220 4.512 3.909 4.907 . 0 0 "[ . 1 . 2]" 1
763 1 41 GLY H 1 54 MET HG3 3.610 . 5.420 4.612 4.047 4.887 . 0 0 "[ . 1 . 2]" 1
764 1 41 GLY HA2 1 42 LYS H 2.870 . 3.940 3.441 3.379 3.502 . 0 0 "[ . 1 . 2]" 1
765 1 41 GLY HA2 1 53 ILE MD 3.570 . 5.340 4.272 3.819 5.387 0.047 8 0 "[ . 1 . 2]" 1
766 1 41 GLY HA2 1 53 ILE MG 2.650 . 3.500 2.435 2.071 2.698 . 0 0 "[ . 1 . 2]" 1
767 1 41 GLY HA2 1 54 MET H 3.590 . 5.380 4.363 3.870 4.589 . 0 0 "[ . 1 . 2]" 1
768 1 41 GLY HA3 1 42 LYS H 2.790 . 3.780 3.117 3.039 3.197 . 0 0 "[ . 1 . 2]" 1
769 1 41 GLY HA3 1 53 ILE MG 2.910 . 4.020 3.811 3.468 4.057 0.037 12 0 "[ . 1 . 2]" 1
770 1 41 GLY HA3 1 54 MET H 3.650 . 5.500 5.537 5.221 5.663 0.163 17 0 "[ . 1 . 2]" 1
771 1 42 LYS H 1 42 LYS HA 2.570 . 3.340 2.854 2.794 2.876 . 0 0 "[ . 1 . 2]" 1
772 1 42 LYS H 1 42 LYS HB2 2.400 . 3.000 2.157 2.106 2.270 . 0 0 "[ . 1 . 2]" 1
773 1 42 LYS H 1 42 LYS HB3 2.730 . 3.660 3.418 2.896 3.512 . 0 0 "[ . 1 . 2]" 1
774 1 42 LYS H 1 42 LYS QD 3.530 . 5.260 4.237 3.025 4.434 . 0 0 "[ . 1 . 2]" 1
775 1 42 LYS H 1 53 ILE HA 3.650 . 5.500 5.530 5.326 5.615 0.115 17 0 "[ . 1 . 2]" 1
776 1 42 LYS H 1 53 ILE MG 3.150 . 4.500 3.989 3.694 4.211 . 0 0 "[ . 1 . 2]" 1
777 1 42 LYS H 1 54 MET H 3.010 . 4.220 3.972 3.798 4.104 . 0 0 "[ . 1 . 2]" 1
778 1 42 LYS H 1 54 MET HB2 3.290 . 4.780 3.935 3.727 4.091 . 0 0 "[ . 1 . 2]" 1
779 1 42 LYS H 1 54 MET HB3 2.510 . 3.220 3.089 2.714 3.180 . 0 0 "[ . 1 . 2]" 1
780 1 42 LYS H 1 54 MET HG2 3.610 . 5.420 4.693 4.273 4.827 . 0 0 "[ . 1 . 2]" 1
781 1 42 LYS H 1 54 MET HG3 3.650 . 5.500 5.491 4.981 5.586 0.086 1 0 "[ . 1 . 2]" 1
782 1 42 LYS HA 1 42 LYS HB2 2.660 . 3.510 2.942 2.662 2.995 . 0 0 "[ . 1 . 2]" 1
783 1 42 LYS HA 1 42 LYS QD 2.780 . 3.760 2.458 2.309 3.881 0.121 17 0 "[ . 1 . 2]" 1
784 1 42 LYS HA 1 42 LYS QE 3.630 . 5.460 3.674 3.331 4.577 . 0 0 "[ . 1 . 2]" 1
785 1 42 LYS HA 1 42 LYS QG 2.990 . 4.180 2.312 2.153 2.397 . 0 0 "[ . 1 . 2]" 1
786 1 42 LYS HA 1 43 VAL H 2.230 . 2.650 2.240 2.129 2.376 . 0 0 "[ . 1 . 2]" 1
787 1 42 LYS HA 1 54 MET H 3.550 . 5.300 5.314 4.916 5.399 0.099 14 0 "[ . 1 . 2]" 1
788 1 42 LYS HB2 1 42 LYS QE 3.490 . 5.180 4.341 4.002 4.549 . 0 0 "[ . 1 . 2]" 1
789 1 42 LYS HB2 1 42 LYS QG 2.630 . 3.460 2.234 2.186 2.478 . 0 0 "[ . 1 . 2]" 1
790 1 42 LYS HB2 1 43 VAL H 3.100 . 4.400 4.559 4.384 4.618 0.218 1 0 "[ . 1 . 2]" 1
791 1 42 LYS HB2 1 54 MET H 3.650 . 5.500 4.767 4.568 5.412 . 0 0 "[ . 1 . 2]" 1
792 1 42 LYS QD 1 43 VAL H 3.110 . 4.420 4.034 3.540 4.458 0.038 17 0 "[ . 1 . 2]" 1
793 1 42 LYS QE 1 43 VAL H 3.650 . 5.500 5.290 4.245 5.550 0.050 17 0 "[ . 1 . 2]" 1
794 1 43 VAL H 1 43 VAL HA 2.740 . 3.680 2.750 2.644 2.910 . 0 0 "[ . 1 . 2]" 1
795 1 43 VAL H 1 43 VAL HB 2.440 . 3.080 2.740 2.522 2.863 . 0 0 "[ . 1 . 2]" 1
796 1 43 VAL H 1 43 VAL MG2 2.400 . 3.000 1.869 1.790 2.194 0.010 5 0 "[ . 1 . 2]" 1
797 1 43 VAL HA 1 43 VAL HB 2.970 . 4.140 3.019 3.014 3.027 . 0 0 "[ . 1 . 2]" 1
798 1 43 VAL HA 1 43 VAL MG1 2.680 . 3.550 2.284 2.240 2.343 . 0 0 "[ . 1 . 2]" 1
799 1 43 VAL HA 1 43 VAL MG2 2.470 . 3.140 2.397 2.260 2.451 . 0 0 "[ . 1 . 2]" 1
800 1 43 VAL HA 1 44 MET H 2.300 . 2.800 2.146 2.103 2.166 . 0 0 "[ . 1 . 2]" 1
801 1 43 VAL HA 1 51 LYS HG3 3.390 . 4.980 4.785 4.365 5.017 0.037 9 0 "[ . 1 . 2]" 1
802 1 43 VAL HA 1 53 ILE HA 2.650 . 3.500 2.460 2.279 2.892 . 0 0 "[ . 1 . 2]" 1
803 1 43 VAL HA 1 53 ILE MD 3.340 . 4.880 3.458 2.178 4.896 0.016 6 0 "[ . 1 . 2]" 1
804 1 43 VAL HB 1 51 LYS HG3 3.590 . 5.380 4.935 4.607 5.279 . 0 0 "[ . 1 . 2]" 1
805 1 43 VAL MG1 1 43 VAL MG2 2.370 . 2.940 2.073 2.050 2.091 . 0 0 "[ . 1 . 2]" 1
806 1 43 VAL MG1 1 44 MET H 2.600 . 3.400 2.712 2.512 3.002 . 0 0 "[ . 1 . 2]" 1
807 1 43 VAL MG1 1 51 LYS HA 3.120 . 4.440 3.527 3.360 3.758 . 0 0 "[ . 1 . 2]" 1
808 1 43 VAL MG1 1 51 LYS HB2 2.970 . 4.140 4.151 3.965 4.288 0.148 19 0 "[ . 1 . 2]" 1
809 1 43 VAL MG1 1 51 LYS HB3 3.380 . 4.960 4.604 4.051 4.847 . 0 0 "[ . 1 . 2]" 1
810 1 43 VAL MG1 1 51 LYS QE 2.990 . 4.180 3.207 2.061 4.185 0.005 1 0 "[ . 1 . 2]" 1
811 1 43 VAL MG1 1 51 LYS HG2 2.850 . 3.900 2.965 2.420 3.461 . 0 0 "[ . 1 . 2]" 1
812 1 43 VAL MG1 1 51 LYS HG3 2.490 . 3.180 2.235 2.042 2.376 . 0 0 "[ . 1 . 2]" 1
813 1 43 VAL MG1 1 52 ILE H 3.190 . 4.580 3.430 3.169 3.843 . 0 0 "[ . 1 . 2]" 1
814 1 43 VAL MG2 1 44 MET H 2.980 . 4.160 4.129 3.933 4.246 0.086 13 0 "[ . 1 . 2]" 1
815 1 43 VAL MG2 1 53 ILE HA 2.950 . 4.100 3.747 3.353 4.128 0.028 16 0 "[ . 1 . 2]" 1
816 1 43 VAL MG2 1 53 ILE MD 2.780 . 3.760 2.785 2.198 3.556 . 0 0 "[ . 1 . 2]" 1
817 1 43 VAL MG2 1 53 ILE HG12 3.400 . 5.000 3.751 2.314 4.978 . 0 0 "[ . 1 . 2]" 1
818 1 44 MET H 1 44 MET HA 2.810 . 3.820 2.967 2.953 2.976 . 0 0 "[ . 1 . 2]" 1
819 1 44 MET H 1 44 MET HG2 3.300 . 4.800 3.734 3.283 4.529 . 0 0 "[ . 1 . 2]" 1
820 1 44 MET H 1 44 MET HG3 3.140 . 4.480 2.471 2.040 3.599 . 0 0 "[ . 1 . 2]" 1
821 1 44 MET H 1 51 LYS HA 3.360 . 4.920 4.941 4.789 4.992 0.072 17 0 "[ . 1 . 2]" 1
822 1 44 MET H 1 52 ILE MD 3.650 . 5.500 4.689 4.388 4.940 . 0 0 "[ . 1 . 2]" 1
823 1 44 MET H 1 52 ILE MG 3.530 . 5.270 5.470 5.343 5.582 0.312 13 0 "[ . 1 . 2]" 1
824 1 44 MET H 1 53 ILE HA 3.150 . 4.500 2.925 2.641 3.366 . 0 0 "[ . 1 . 2]" 1
825 1 44 MET HA 1 44 MET HB2 3.000 . 4.200 3.016 2.996 3.030 . 0 0 "[ . 1 . 2]" 1
826 1 44 MET HA 1 44 MET HB3 2.680 . 3.560 2.407 2.317 2.678 . 0 0 "[ . 1 . 2]" 1
827 1 44 MET HA 1 44 MET ME 3.180 . 4.560 4.377 4.266 4.502 . 0 0 "[ . 1 . 2]" 1
828 1 44 MET HA 1 44 MET HG2 3.060 . 4.310 2.770 2.355 3.184 . 0 0 "[ . 1 . 2]" 1
829 1 44 MET HA 1 44 MET HG3 3.380 . 4.960 3.080 2.240 3.367 . 0 0 "[ . 1 . 2]" 1
830 1 44 MET HA 1 45 GLU H 2.360 . 2.920 2.253 2.205 2.358 . 0 0 "[ . 1 . 2]" 1
831 1 44 MET HA 1 52 ILE H 3.650 . 5.500 5.088 4.938 5.308 . 0 0 "[ . 1 . 2]" 1
832 1 44 MET HB2 1 44 MET HG2 2.830 . 3.850 3.006 2.884 3.026 . 0 0 "[ . 1 . 2]" 1
833 1 44 MET HB2 1 45 GLU H 3.650 . 5.500 3.906 3.473 4.267 . 0 0 "[ . 1 . 2]" 1
834 1 44 MET HB2 1 52 ILE HB 3.190 . 4.580 3.807 3.156 4.020 . 0 0 "[ . 1 . 2]" 1
835 1 44 MET HB3 1 44 MET ME 2.540 . 3.280 3.219 2.617 3.452 0.172 6 0 "[ . 1 . 2]" 1
836 1 44 MET HB3 1 45 GLU H 3.620 . 5.440 3.071 2.802 3.306 . 0 0 "[ . 1 . 2]" 1
837 1 44 MET HB3 1 52 ILE H 3.650 . 5.500 5.099 4.263 5.509 0.009 6 0 "[ . 1 . 2]" 1
838 1 44 MET HB3 1 52 ILE HB 3.650 . 5.500 5.346 3.863 5.691 0.191 6 0 "[ . 1 . 2]" 1
839 1 44 MET ME 1 45 GLU H 3.650 . 5.500 5.404 5.216 5.538 0.038 1 0 "[ . 1 . 2]" 1
840 1 44 MET ME 1 52 ILE MD 3.260 . 4.720 2.510 2.149 3.757 . 0 0 "[ . 1 . 2]" 1
841 1 44 MET ME 1 52 ILE HG12 3.510 . 5.220 3.831 2.466 4.357 . 0 0 "[ . 1 . 2]" 1
842 1 44 MET ME 1 52 ILE HG13 3.650 . 5.500 2.669 2.170 3.317 . 0 0 "[ . 1 . 2]" 1
843 1 44 MET ME 1 53 ILE H 3.170 . 4.540 3.944 3.810 4.039 . 0 0 "[ . 1 . 2]" 1
844 1 44 MET ME 1 53 ILE HA 3.100 . 4.400 3.198 2.934 3.868 . 0 0 "[ . 1 . 2]" 1
845 1 44 MET ME 1 53 ILE MG 3.650 . 5.500 4.267 4.040 4.808 . 0 0 "[ . 1 . 2]" 1
846 1 44 MET ME 1 54 MET H 2.720 . 3.640 3.018 2.613 3.774 0.134 17 0 "[ . 1 . 2]" 1
847 1 44 MET ME 1 54 MET HA 2.540 . 3.280 2.240 2.114 2.622 . 0 0 "[ . 1 . 2]" 1
848 1 44 MET ME 1 54 MET HB3 3.610 . 5.420 4.249 4.012 4.816 . 0 0 "[ . 1 . 2]" 1
849 1 44 MET ME 1 54 MET ME 3.220 . 4.640 3.714 3.509 4.029 . 0 0 "[ . 1 . 2]" 1
850 1 44 MET ME 1 54 MET HG2 3.480 . 5.160 4.776 4.618 5.234 0.074 17 0 "[ . 1 . 2]" 1
851 1 44 MET ME 1 54 MET HG3 3.570 . 5.340 4.410 4.251 4.700 . 0 0 "[ . 1 . 2]" 1
852 1 44 MET ME 1 55 LYS H 2.830 . 3.860 3.550 3.398 3.731 . 0 0 "[ . 1 . 2]" 1
853 1 44 MET HG2 1 45 GLU H 3.540 . 5.280 4.585 4.235 4.861 . 0 0 "[ . 1 . 2]" 1
854 1 44 MET HG3 1 45 GLU H 3.650 . 5.500 5.042 4.148 5.143 . 0 0 "[ . 1 . 2]" 1
855 1 45 GLU H 1 45 GLU HA 2.700 . 3.600 2.972 2.964 2.979 . 0 0 "[ . 1 . 2]" 1
856 1 45 GLU H 1 45 GLU HB2 2.660 . 3.510 3.009 2.823 3.185 . 0 0 "[ . 1 . 2]" 1
857 1 45 GLU H 1 45 GLU HB3 2.570 . 3.340 2.691 2.527 2.822 . 0 0 "[ . 1 . 2]" 1
858 1 45 GLU H 1 45 GLU HG2 3.240 . 4.680 4.535 4.437 4.841 0.161 19 0 "[ . 1 . 2]" 1
859 1 45 GLU H 1 45 GLU HG3 3.360 . 4.920 4.610 4.301 4.718 . 0 0 "[ . 1 . 2]" 1
860 1 45 GLU H 1 46 THR H 3.620 . 5.440 4.318 4.225 4.397 . 0 0 "[ . 1 . 2]" 1
861 1 45 GLU HA 1 45 GLU HB2 2.690 . 3.580 2.498 2.408 2.545 . 0 0 "[ . 1 . 2]" 1
862 1 45 GLU HA 1 45 GLU HB3 2.700 . 3.600 3.025 3.017 3.028 . 0 0 "[ . 1 . 2]" 1
863 1 45 GLU HA 1 45 GLU HG2 3.170 . 4.540 3.138 2.971 3.727 . 0 0 "[ . 1 . 2]" 1
864 1 45 GLU HA 1 45 GLU HG3 3.200 . 4.600 2.451 2.351 3.286 . 0 0 "[ . 1 . 2]" 1
865 1 45 GLU HA 1 46 THR H 2.300 . 2.800 2.140 2.123 2.147 . 0 0 "[ . 1 . 2]" 1
866 1 45 GLU HA 1 46 THR MG 2.880 . 3.960 3.525 3.284 4.030 0.070 5 0 "[ . 1 . 2]" 1
867 1 45 GLU HA 1 50 THR H 3.390 . 4.980 4.333 4.092 4.517 . 0 0 "[ . 1 . 2]" 1
868 1 45 GLU HA 1 52 ILE H 3.280 . 4.770 3.455 3.120 3.948 . 0 0 "[ . 1 . 2]" 1
869 1 45 GLU HB2 1 45 GLU HG2 2.620 . 3.440 2.957 2.406 3.036 . 0 0 "[ . 1 . 2]" 1
870 1 45 GLU HB2 1 46 THR H 3.470 . 5.140 4.333 4.250 4.392 . 0 0 "[ . 1 . 2]" 1
871 1 45 GLU HB3 1 45 GLU HG2 2.400 . 3.000 2.427 2.360 2.508 . 0 0 "[ . 1 . 2]" 1
872 1 45 GLU HB3 1 45 GLU HG3 2.720 . 3.640 2.956 2.419 3.034 . 0 0 "[ . 1 . 2]" 1
873 1 45 GLU HB3 1 46 THR H 3.430 . 5.060 4.211 4.090 4.350 . 0 0 "[ . 1 . 2]" 1
874 1 45 GLU HG2 1 46 THR H 3.550 . 5.300 3.368 2.917 4.590 . 0 0 "[ . 1 . 2]" 1
875 1 45 GLU HG2 1 49 GLY HA2 3.270 . 4.740 2.821 2.352 3.836 . 0 0 "[ . 1 . 2]" 1
876 1 45 GLU HG2 1 49 GLY HA3 3.650 . 5.500 4.547 4.105 5.507 0.007 19 0 "[ . 1 . 2]" 1
877 1 45 GLU HG2 1 50 THR H 3.440 . 5.080 4.190 3.672 5.134 0.054 4 0 "[ . 1 . 2]" 1
878 1 45 GLU HG3 1 46 THR H 3.460 . 5.120 3.116 2.828 3.464 . 0 0 "[ . 1 . 2]" 1
879 1 45 GLU HG3 1 49 GLY HA2 3.280 . 4.770 2.877 2.401 3.573 . 0 0 "[ . 1 . 2]" 1
880 1 45 GLU HG3 1 49 GLY HA3 3.610 . 5.420 4.439 3.922 5.331 . 0 0 "[ . 1 . 2]" 1
881 1 45 GLU HG3 1 50 THR H 3.650 . 5.500 3.837 3.500 4.265 . 0 0 "[ . 1 . 2]" 1
882 1 46 THR H 1 46 THR HA 2.960 . 4.120 2.885 2.834 2.906 . 0 0 "[ . 1 . 2]" 1
883 1 46 THR H 1 46 THR HB 3.590 . 5.380 3.611 3.572 3.626 . 0 0 "[ . 1 . 2]" 1
884 1 46 THR H 1 46 THR HG1 3.650 . 5.500 3.254 1.768 3.829 0.032 5 0 "[ . 1 . 2]" 1
885 1 46 THR H 1 46 THR MG 2.450 . 3.100 2.075 1.890 2.676 . 0 0 "[ . 1 . 2]" 1
886 1 46 THR H 1 47 ARG H 3.650 . 5.500 4.595 4.557 4.624 . 0 0 "[ . 1 . 2]" 1
887 1 46 THR H 1 49 GLY H 3.250 . 4.700 3.980 3.617 4.227 . 0 0 "[ . 1 . 2]" 1
888 1 46 THR H 1 50 THR H 2.850 . 3.900 2.752 2.616 2.857 . 0 0 "[ . 1 . 2]" 1
889 1 46 THR H 1 50 THR HA 3.650 . 5.500 4.676 4.565 4.818 . 0 0 "[ . 1 . 2]" 1
890 1 46 THR H 1 50 THR HB 3.440 . 5.080 3.336 3.019 3.635 . 0 0 "[ . 1 . 2]" 1
891 1 46 THR H 1 50 THR MG 3.480 . 5.160 4.491 4.260 4.625 . 0 0 "[ . 1 . 2]" 1
892 1 46 THR H 1 51 LYS HA 3.310 . 4.820 4.216 3.883 4.665 . 0 0 "[ . 1 . 2]" 1
893 1 46 THR H 1 52 ILE MD 3.600 . 5.400 3.572 2.347 3.950 . 0 0 "[ . 1 . 2]" 1
894 1 46 THR H 1 52 ILE MG 3.210 . 4.620 4.804 4.752 4.839 0.219 9 0 "[ . 1 . 2]" 1
895 1 46 THR HA 1 46 THR MG 2.830 . 3.860 2.396 2.224 2.519 . 0 0 "[ . 1 . 2]" 1
896 1 46 THR HA 1 47 ARG H 2.670 . 3.540 2.438 2.338 2.566 . 0 0 "[ . 1 . 2]" 1
897 1 46 THR HA 1 50 THR H 3.130 . 4.460 4.531 4.475 4.614 0.154 15 0 "[ . 1 . 2]" 1
898 1 46 THR HB 1 47 ARG H 2.580 . 3.360 2.425 2.071 2.684 . 0 0 "[ . 1 . 2]" 1
899 1 46 THR HB 1 49 GLY H 3.390 . 4.980 4.127 3.443 4.501 . 0 0 "[ . 1 . 2]" 1
900 1 46 THR HG1 1 46 THR MG 3.070 . 4.340 2.640 2.035 3.046 . 0 0 "[ . 1 . 2]" 1
901 1 46 THR HG1 1 47 ARG H 3.650 . 5.500 3.714 3.021 4.675 . 0 0 "[ . 1 . 2]" 1
902 1 46 THR HG1 1 48 ASP H 3.150 . 4.500 2.696 1.843 4.382 . 0 0 "[ . 1 . 2]" 1
903 1 46 THR HG1 1 49 GLY H 3.370 . 4.940 2.935 2.184 3.507 . 0 0 "[ . 1 . 2]" 1
904 1 46 THR HG1 1 50 THR H 2.870 . 3.940 2.208 1.724 3.003 0.076 19 0 "[ . 1 . 2]" 1
905 1 46 THR HG1 1 50 THR HB 3.650 . 5.500 2.576 1.787 3.205 0.013 5 0 "[ . 1 . 2]" 1
906 1 46 THR HG1 1 50 THR MG 3.610 . 5.420 4.067 3.499 4.605 . 0 0 "[ . 1 . 2]" 1
907 1 46 THR MG 1 47 ARG H 2.850 . 3.900 3.809 3.431 3.963 0.063 17 0 "[ . 1 . 2]" 1
908 1 46 THR MG 1 48 ASP H 3.340 . 4.880 4.357 4.228 4.423 . 0 0 "[ . 1 . 2]" 1
909 1 46 THR MG 1 49 GLY H 3.380 . 4.960 4.509 4.241 4.775 . 0 0 "[ . 1 . 2]" 1
910 1 46 THR MG 1 50 THR HB 2.860 . 3.920 2.208 2.072 2.554 . 0 0 "[ . 1 . 2]" 1
911 1 46 THR MG 1 52 ILE MD 2.520 . 3.240 1.985 1.794 2.116 0.006 6 0 "[ . 1 . 2]" 1
912 1 46 THR MG 1 52 ILE MG 2.520 . 3.240 3.176 2.870 3.438 0.198 12 0 "[ . 1 . 2]" 1
913 1 47 ARG H 1 47 ARG HA 2.730 . 3.660 2.811 2.780 2.868 . 0 0 "[ . 1 . 2]" 1
914 1 47 ARG H 1 47 ARG HB2 2.940 . 4.080 2.888 2.348 3.602 . 0 0 "[ . 1 . 2]" 1
915 1 47 ARG H 1 47 ARG HB3 2.960 . 4.120 3.189 2.497 3.595 . 0 0 "[ . 1 . 2]" 1
916 1 47 ARG H 1 47 ARG QD 3.470 . 5.140 3.759 3.407 4.421 . 0 0 "[ . 1 . 2]" 1
917 1 47 ARG H 1 48 ASP H 3.030 . 4.260 2.670 2.491 2.773 . 0 0 "[ . 1 . 2]" 1
918 1 47 ARG H 1 49 GLY H 3.530 . 5.260 3.951 3.756 4.283 . 0 0 "[ . 1 . 2]" 1
919 1 47 ARG HA 1 47 ARG HB2 2.790 . 3.780 2.813 2.464 3.031 . 0 0 "[ . 1 . 2]" 1
920 1 47 ARG HA 1 47 ARG HB3 2.670 . 3.540 2.485 2.391 3.029 . 0 0 "[ . 1 . 2]" 1
921 1 47 ARG HA 1 47 ARG QD 3.020 . 4.240 4.131 3.899 4.417 0.177 15 0 "[ . 1 . 2]" 1
922 1 47 ARG HA 1 47 ARG HG2 2.820 . 3.840 2.944 2.344 3.825 . 0 0 "[ . 1 . 2]" 1
923 1 47 ARG HA 1 47 ARG HG3 3.150 . 4.500 3.219 2.422 3.779 . 0 0 "[ . 1 . 2]" 1
924 1 47 ARG HA 1 48 ASP H 3.300 . 4.800 3.524 3.475 3.535 . 0 0 "[ . 1 . 2]" 1
925 1 47 ARG HA 1 49 GLY H 3.190 . 4.580 3.668 3.352 4.594 0.014 12 0 "[ . 1 . 2]" 1
926 1 47 ARG HB2 1 47 ARG QD 2.960 . 4.120 2.394 2.286 2.539 . 0 0 "[ . 1 . 2]" 1
927 1 47 ARG HB3 1 47 ARG QD 2.850 . 3.900 2.573 2.288 3.119 . 0 0 "[ . 1 . 2]" 1
928 1 47 ARG HB3 1 48 ASP H 3.650 . 5.500 3.772 2.664 4.141 . 0 0 "[ . 1 . 2]" 1
929 1 48 ASP H 1 48 ASP HB2 3.080 . 4.350 2.703 2.416 3.604 . 0 0 "[ . 1 . 2]" 1
930 1 48 ASP H 1 48 ASP HB3 3.130 . 4.460 2.901 2.476 3.602 . 0 0 "[ . 1 . 2]" 1
931 1 48 ASP HA 1 48 ASP HB2 2.540 . 3.280 2.660 2.414 3.029 . 0 0 "[ . 1 . 2]" 1
932 1 48 ASP HA 1 48 ASP HB3 2.590 . 3.380 2.748 2.444 3.030 . 0 0 "[ . 1 . 2]" 1
933 1 48 ASP HA 1 49 GLY H 3.040 . 4.280 3.349 3.261 3.552 . 0 0 "[ . 1 . 2]" 1
934 1 48 ASP HB2 1 49 GLY H 3.480 . 5.160 3.889 2.493 4.351 . 0 0 "[ . 1 . 2]" 1
935 1 48 ASP HB2 1 50 THR H 3.640 . 5.480 4.457 3.312 5.334 . 0 0 "[ . 1 . 2]" 1
936 1 48 ASP HB3 1 49 GLY H 3.480 . 5.160 3.768 3.305 4.318 . 0 0 "[ . 1 . 2]" 1
937 1 48 ASP HB3 1 50 THR H 3.530 . 5.260 4.131 3.276 5.269 0.009 8 0 "[ . 1 . 2]" 1
938 1 49 GLY H 1 49 GLY HA2 2.370 . 2.940 2.357 2.307 2.536 . 0 0 "[ . 1 . 2]" 1
939 1 49 GLY H 1 49 GLY HA3 2.530 . 3.260 2.908 2.860 2.973 . 0 0 "[ . 1 . 2]" 1
940 1 49 GLY HA2 1 50 THR H 2.860 . 3.920 2.885 2.762 2.965 . 0 0 "[ . 1 . 2]" 1
941 1 50 THR H 1 50 THR HA 2.710 . 3.610 2.939 2.913 2.972 . 0 0 "[ . 1 . 2]" 1
942 1 50 THR H 1 50 THR HB 2.520 . 3.240 2.611 2.453 2.711 . 0 0 "[ . 1 . 2]" 1
943 1 50 THR H 1 50 THR MG 2.790 . 3.780 3.794 3.764 3.851 0.071 19 0 "[ . 1 . 2]" 1
944 1 50 THR H 1 51 LYS H 3.240 . 4.680 4.433 4.289 4.561 . 0 0 "[ . 1 . 2]" 1
945 1 50 THR H 1 52 ILE MD 3.650 . 5.500 5.161 3.851 5.537 0.037 19 0 "[ . 1 . 2]" 1
946 1 50 THR H 1 52 ILE MG 3.650 . 5.500 5.467 5.306 5.570 0.070 17 0 "[ . 1 . 2]" 1
947 1 50 THR HA 1 50 THR MG 2.510 . 3.220 2.281 2.227 2.420 . 0 0 "[ . 1 . 2]" 1
948 1 50 THR HA 1 51 LYS H 2.390 . 2.980 2.160 2.142 2.241 . 0 0 "[ . 1 . 2]" 1
949 1 50 THR HB 1 51 LYS H 3.030 . 4.260 4.174 3.928 4.332 0.072 17 0 "[ . 1 . 2]" 1
950 1 50 THR HB 1 52 ILE MD 3.570 . 5.340 3.707 2.364 4.585 . 0 0 "[ . 1 . 2]" 1
951 1 50 THR HB 1 52 ILE MG 3.650 . 5.500 3.530 3.299 4.049 . 0 0 "[ . 1 . 2]" 1
952 1 50 THR MG 1 51 LYS H 2.540 . 3.280 2.788 2.207 2.979 . 0 0 "[ . 1 . 2]" 1
953 1 50 THR MG 1 52 ILE H 3.650 . 5.500 4.374 4.171 4.562 . 0 0 "[ . 1 . 2]" 1
954 1 50 THR MG 1 52 ILE MD 2.830 . 3.850 3.665 2.537 3.954 0.104 8 0 "[ . 1 . 2]" 1
955 1 51 LYS H 1 51 LYS HA 2.700 . 3.600 2.897 2.874 2.939 . 0 0 "[ . 1 . 2]" 1
956 1 51 LYS H 1 51 LYS HB2 3.090 . 4.380 2.648 2.359 2.829 . 0 0 "[ . 1 . 2]" 1
957 1 51 LYS H 1 51 LYS HB3 2.800 . 3.800 2.519 2.415 2.814 . 0 0 "[ . 1 . 2]" 1
958 1 51 LYS H 1 51 LYS QD 3.380 . 4.960 4.590 3.950 4.784 . 0 0 "[ . 1 . 2]" 1
959 1 51 LYS H 1 52 ILE H 3.600 . 5.400 4.392 4.320 4.507 . 0 0 "[ . 1 . 2]" 1
960 1 51 LYS HA 1 51 LYS HB2 2.730 . 3.660 2.478 2.422 2.643 . 0 0 "[ . 1 . 2]" 1
961 1 51 LYS HA 1 51 LYS HB3 2.960 . 4.120 3.026 3.010 3.030 . 0 0 "[ . 1 . 2]" 1
962 1 51 LYS HA 1 51 LYS QD 3.030 . 4.260 3.865 2.287 4.176 . 0 0 "[ . 1 . 2]" 1
963 1 51 LYS HA 1 51 LYS QE 3.530 . 5.270 4.406 3.854 4.974 . 0 0 "[ . 1 . 2]" 1
964 1 51 LYS HA 1 51 LYS HG2 2.910 . 4.020 3.129 2.748 3.618 . 0 0 "[ . 1 . 2]" 1
965 1 51 LYS HA 1 51 LYS HG3 3.550 . 5.300 2.441 2.358 2.566 . 0 0 "[ . 1 . 2]" 1
966 1 51 LYS HB2 1 51 LYS QE 3.630 . 5.460 3.081 2.175 4.131 . 0 0 "[ . 1 . 2]" 1
967 1 51 LYS HB2 1 52 ILE H 3.490 . 5.180 4.385 4.201 4.508 . 0 0 "[ . 1 . 2]" 1
968 1 51 LYS HB3 1 52 ILE H 3.380 . 4.960 4.313 4.093 4.428 . 0 0 "[ . 1 . 2]" 1
969 1 51 LYS QD 1 52 ILE H 3.650 . 5.500 4.902 3.810 5.144 . 0 0 "[ . 1 . 2]" 1
970 1 51 LYS QE 1 51 LYS HG2 2.950 . 4.100 2.776 2.285 3.427 . 0 0 "[ . 1 . 2]" 1
971 1 51 LYS QE 1 51 LYS HG3 3.150 . 4.500 2.773 2.290 3.546 . 0 0 "[ . 1 . 2]" 1
972 1 51 LYS QE 1 52 ILE H 3.650 . 5.500 5.352 4.798 5.566 0.066 19 0 "[ . 1 . 2]" 1
973 1 51 LYS HG2 1 52 ILE H 3.650 . 5.500 3.516 2.687 4.667 . 0 0 "[ . 1 . 2]" 1
974 1 51 LYS HG3 1 52 ILE H 3.650 . 5.500 3.320 2.818 3.640 . 0 0 "[ . 1 . 2]" 1
975 1 52 ILE H 1 52 ILE HA 2.720 . 3.640 2.964 2.952 2.973 . 0 0 "[ . 1 . 2]" 1
976 1 52 ILE H 1 52 ILE MD 3.330 . 4.860 3.542 2.491 3.874 . 0 0 "[ . 1 . 2]" 1
977 1 52 ILE H 1 52 ILE HG12 3.360 . 4.920 2.297 1.857 2.569 . 0 0 "[ . 1 . 2]" 1
978 1 52 ILE H 1 52 ILE HG13 2.890 . 3.980 2.537 2.152 3.714 . 0 0 "[ . 1 . 2]" 1
979 1 52 ILE H 1 52 ILE MG 2.810 . 3.810 3.270 3.174 3.423 . 0 0 "[ . 1 . 2]" 1
980 1 52 ILE H 1 53 ILE H 3.290 . 4.780 4.241 4.103 4.476 . 0 0 "[ . 1 . 2]" 1
981 1 52 ILE HA 1 52 ILE MD 2.980 . 4.160 4.039 3.510 4.149 . 0 0 "[ . 1 . 2]" 1
982 1 52 ILE HA 1 52 ILE HG12 2.960 . 4.120 3.626 3.558 3.686 . 0 0 "[ . 1 . 2]" 1
983 1 52 ILE HA 1 52 ILE HG13 3.200 . 4.600 3.786 3.654 4.247 . 0 0 "[ . 1 . 2]" 1
984 1 52 ILE HA 1 52 ILE MG 2.510 . 3.220 2.222 2.201 2.282 . 0 0 "[ . 1 . 2]" 1
985 1 52 ILE HA 1 53 ILE H 2.520 . 3.240 2.144 2.120 2.272 . 0 0 "[ . 1 . 2]" 1
986 1 52 ILE HB 1 52 ILE MD 2.760 . 3.720 2.397 2.192 3.143 . 0 0 "[ . 1 . 2]" 1
987 1 52 ILE HB 1 52 ILE HG13 2.910 . 4.020 2.501 2.282 2.586 . 0 0 "[ . 1 . 2]" 1
988 1 52 ILE HB 1 53 ILE H 3.590 . 5.380 3.434 2.907 3.577 . 0 0 "[ . 1 . 2]" 1
989 1 52 ILE MD 1 52 ILE MG 2.380 . 2.960 1.971 1.757 2.087 0.043 15 0 "[ . 1 . 2]" 1
990 1 52 ILE MD 1 53 ILE H 3.420 . 5.040 5.102 4.711 5.241 0.201 15 0 "[ . 1 . 2]" 1
991 1 52 ILE HG12 1 53 ILE H 3.640 . 5.480 5.195 4.621 5.384 . 0 0 "[ . 1 . 2]" 1
992 1 52 ILE HG13 1 53 ILE H 3.650 . 5.500 4.824 4.554 5.354 . 0 0 "[ . 1 . 2]" 1
993 1 52 ILE MG 1 53 ILE H 2.790 . 3.780 3.717 3.426 3.822 0.043 5 0 "[ . 1 . 2]" 1
994 1 53 ILE H 1 53 ILE HA 2.420 . 3.040 2.924 2.893 2.969 . 0 0 "[ . 1 . 2]" 1
995 1 53 ILE H 1 53 ILE HB 2.340 . 2.880 2.604 2.324 2.739 . 0 0 "[ . 1 . 2]" 1
996 1 53 ILE H 1 53 ILE MD 2.790 . 3.780 3.095 1.773 3.718 0.027 8 0 "[ . 1 . 2]" 1
997 1 53 ILE H 1 53 ILE HG12 2.670 . 3.530 2.799 1.890 3.781 0.251 8 0 "[ . 1 . 2]" 1
998 1 53 ILE H 1 53 ILE MG 2.790 . 3.780 3.784 3.710 3.838 0.058 17 0 "[ . 1 . 2]" 1
999 1 53 ILE HA 1 53 ILE MD 2.870 . 3.940 2.926 2.093 3.844 . 0 0 "[ . 1 . 2]" 1
1000 1 53 ILE HA 1 53 ILE HG12 2.940 . 4.080 3.017 2.558 3.653 . 0 0 "[ . 1 . 2]" 1
1001 1 53 ILE HA 1 53 ILE HG13 3.100 . 4.400 3.380 2.457 3.807 . 0 0 "[ . 1 . 2]" 1
1002 1 53 ILE HA 1 53 ILE MG 2.640 . 3.480 2.273 2.223 2.428 . 0 0 "[ . 1 . 2]" 1
1003 1 53 ILE HA 1 54 MET H 2.310 . 2.820 2.215 2.171 2.249 . 0 0 "[ . 1 . 2]" 1
1004 1 53 ILE HB 1 53 ILE MD 2.740 . 3.680 2.756 2.279 3.212 . 0 0 "[ . 1 . 2]" 1
1005 1 53 ILE HB 1 53 ILE HG12 3.000 . 4.200 2.694 2.406 3.037 . 0 0 "[ . 1 . 2]" 1
1006 1 53 ILE HB 1 53 ILE HG13 2.850 . 3.900 2.541 2.438 3.036 . 0 0 "[ . 1 . 2]" 1
1007 1 53 ILE HB 1 53 ILE MG 2.470 . 3.140 2.149 2.146 2.151 . 0 0 "[ . 1 . 2]" 1
1008 1 53 ILE HB 1 54 MET H 3.160 . 4.520 3.885 3.715 4.071 . 0 0 "[ . 1 . 2]" 1
1009 1 53 ILE MD 1 54 MET H 3.650 . 5.500 4.327 3.625 5.056 . 0 0 "[ . 1 . 2]" 1
1010 1 53 ILE HG12 1 53 ILE MG 2.640 . 3.480 2.759 2.310 3.195 . 0 0 "[ . 1 . 2]" 1
1011 1 53 ILE HG12 1 54 MET H 3.410 . 5.020 4.806 4.315 5.192 0.172 18 0 "[ . 1 . 2]" 1
1012 1 53 ILE HG13 1 53 ILE MG 2.600 . 3.400 2.704 2.284 3.196 . 0 0 "[ . 1 . 2]" 1
1013 1 53 ILE MG 1 54 MET H 2.690 . 3.580 2.319 2.179 2.538 . 0 0 "[ . 1 . 2]" 1
1014 1 53 ILE MG 1 54 MET HA 3.450 . 5.100 4.149 3.922 4.341 . 0 0 "[ . 1 . 2]" 1
1015 1 54 MET H 1 54 MET HA 2.690 . 3.570 2.850 2.811 2.871 . 0 0 "[ . 1 . 2]" 1
1016 1 54 MET H 1 54 MET HB2 2.440 . 3.080 2.502 2.437 2.568 . 0 0 "[ . 1 . 2]" 1
1017 1 54 MET H 1 54 MET HB3 2.580 . 3.360 2.602 2.529 2.666 . 0 0 "[ . 1 . 2]" 1
1018 1 54 MET H 1 54 MET HG2 3.470 . 5.140 4.662 4.615 4.688 . 0 0 "[ . 1 . 2]" 1
1019 1 54 MET H 1 54 MET HG3 3.320 . 4.840 4.448 4.427 4.465 . 0 0 "[ . 1 . 2]" 1
1020 1 54 MET H 1 55 LYS H 3.160 . 4.520 4.015 3.881 4.343 . 0 0 "[ . 1 . 2]" 1
1021 1 54 MET HA 1 54 MET HB2 2.820 . 3.840 2.511 2.488 2.536 . 0 0 "[ . 1 . 2]" 1
1022 1 54 MET HA 1 54 MET ME 3.130 . 4.460 3.111 2.947 3.334 . 0 0 "[ . 1 . 2]" 1
1023 1 54 MET HA 1 54 MET HG2 3.300 . 4.800 3.708 3.667 3.772 . 0 0 "[ . 1 . 2]" 1
1024 1 54 MET HA 1 54 MET HG3 3.260 . 4.720 2.800 2.732 2.880 . 0 0 "[ . 1 . 2]" 1
1025 1 54 MET HA 1 55 LYS H 2.530 . 3.260 2.312 2.164 2.365 . 0 0 "[ . 1 . 2]" 1
1026 1 54 MET HB2 1 54 MET ME 2.990 . 4.180 3.985 3.913 4.042 . 0 0 "[ . 1 . 2]" 1
1027 1 54 MET HB2 1 54 MET HG2 2.800 . 3.800 2.569 2.535 2.615 . 0 0 "[ . 1 . 2]" 1
1028 1 54 MET HB3 1 54 MET HG2 2.780 . 3.760 2.385 2.341 2.422 . 0 0 "[ . 1 . 2]" 1
1029 1 54 MET HB3 1 55 LYS H 3.650 . 5.500 4.453 4.381 4.484 . 0 0 "[ . 1 . 2]" 1
1030 1 54 MET ME 1 54 MET HG2 2.620 . 3.440 2.881 2.753 2.954 . 0 0 "[ . 1 . 2]" 1
1031 1 54 MET ME 1 54 MET HG3 2.540 . 3.280 2.195 2.180 2.240 . 0 0 "[ . 1 . 2]" 1
1032 1 54 MET ME 1 55 LYS H 2.930 . 4.060 3.750 3.359 4.011 . 0 0 "[ . 1 . 2]" 1
1033 1 54 MET ME 1 56 GLY HA3 3.430 . 5.060 3.415 3.025 3.597 . 0 0 "[ . 1 . 2]" 1
1034 1 54 MET ME 1 57 ASN HA 2.610 . 3.420 2.444 2.244 2.783 . 0 0 "[ . 1 . 2]" 1
1035 1 54 MET ME 1 58 GLU H 3.030 . 4.260 4.306 4.224 4.381 0.121 6 0 "[ . 1 . 2]" 1
1036 1 54 MET ME 1 59 ILE MG 3.370 . 4.940 2.642 2.130 2.815 . 0 0 "[ . 1 . 2]" 1
1037 1 54 MET HG2 1 55 LYS H 3.570 . 5.340 5.352 4.934 5.456 0.116 5 0 "[ . 1 . 2]" 1
1038 1 54 MET HG3 1 55 LYS H 3.350 . 4.900 3.879 3.375 4.038 . 0 0 "[ . 1 . 2]" 1
1039 1 55 LYS H 1 55 LYS HB2 2.800 . 3.800 2.465 2.328 2.744 . 0 0 "[ . 1 . 2]" 1
1040 1 55 LYS H 1 55 LYS HB3 2.810 . 3.820 2.852 2.290 3.627 . 0 0 "[ . 1 . 2]" 1
1041 1 55 LYS H 1 55 LYS QD 3.290 . 4.780 4.225 3.039 4.766 . 0 0 "[ . 1 . 2]" 1
1042 1 55 LYS H 1 55 LYS QE 3.150 . 4.500 4.384 4.103 4.683 0.183 9 0 "[ . 1 . 2]" 1
1043 1 55 LYS H 1 55 LYS HG2 3.410 . 5.020 4.187 1.998 4.682 . 0 0 "[ . 1 . 2]" 1
1044 1 55 LYS H 1 55 LYS HG3 3.650 . 5.500 4.041 2.465 4.455 . 0 0 "[ . 1 . 2]" 1
1045 1 55 LYS H 1 56 GLY H 3.420 . 5.040 2.762 2.246 3.050 . 0 0 "[ . 1 . 2]" 1
1046 1 55 LYS HA 1 55 LYS HB2 2.970 . 4.140 2.652 2.384 3.025 . 0 0 "[ . 1 . 2]" 1
1047 1 55 LYS HA 1 55 LYS QD 3.650 . 5.500 3.229 2.138 4.146 . 0 0 "[ . 1 . 2]" 1
1048 1 55 LYS HA 1 55 LYS QE 3.650 . 5.500 3.917 2.215 4.603 . 0 0 "[ . 1 . 2]" 1
1049 1 55 LYS HA 1 55 LYS HG2 3.360 . 4.920 3.144 2.386 3.835 . 0 0 "[ . 1 . 2]" 1
1050 1 55 LYS HA 1 55 LYS HG3 3.030 . 4.260 2.766 2.303 3.783 . 0 0 "[ . 1 . 2]" 1
1051 1 55 LYS HB2 1 55 LYS QE 3.340 . 4.880 2.872 2.205 4.249 . 0 0 "[ . 1 . 2]" 1
1052 1 55 LYS HB2 1 55 LYS HG3 2.980 . 4.160 2.666 2.394 3.037 . 0 0 "[ . 1 . 2]" 1
1053 1 55 LYS HB2 1 56 GLY H 3.460 . 5.120 3.154 2.201 3.538 . 0 0 "[ . 1 . 2]" 1
1054 1 55 LYS HB3 1 55 LYS QE 3.310 . 4.820 3.351 2.177 4.072 . 0 0 "[ . 1 . 2]" 1
1055 1 55 LYS HB3 1 56 GLY H 2.750 . 3.700 2.295 1.787 3.639 0.013 5 0 "[ . 1 . 2]" 1
1056 1 55 LYS QD 1 56 GLY H 3.510 . 5.220 4.305 3.624 4.826 . 0 0 "[ . 1 . 2]" 1
1057 1 55 LYS HG2 1 56 GLY H 3.410 . 5.020 3.808 3.168 4.964 . 0 0 "[ . 1 . 2]" 1
1058 1 55 LYS HG3 1 56 GLY H 3.310 . 4.820 4.005 2.410 4.698 . 0 0 "[ . 1 . 2]" 1
1059 1 56 GLY H 1 56 GLY HA2 2.510 . 3.220 2.848 2.794 2.918 . 0 0 "[ . 1 . 2]" 1
1060 1 56 GLY H 1 56 GLY HA3 2.750 . 3.700 2.295 2.280 2.332 . 0 0 "[ . 1 . 2]" 1
1061 1 56 GLY H 1 57 ASN H 3.250 . 4.700 3.865 3.467 4.120 . 0 0 "[ . 1 . 2]" 1
1062 1 56 GLY HA2 1 57 ASN H 2.570 . 3.340 2.488 2.320 2.756 . 0 0 "[ . 1 . 2]" 1
1063 1 56 GLY HA3 1 58 GLU H 3.650 . 5.500 3.610 3.466 3.845 . 0 0 "[ . 1 . 2]" 1
1064 1 57 ASN H 1 57 ASN HA 2.970 . 4.140 2.855 2.784 2.895 . 0 0 "[ . 1 . 2]" 1
1065 1 57 ASN H 1 57 ASN HB2 3.030 . 4.260 2.660 2.561 2.732 . 0 0 "[ . 1 . 2]" 1
1066 1 57 ASN H 1 57 ASN HB3 3.080 . 4.360 2.471 2.424 2.543 . 0 0 "[ . 1 . 2]" 1
1067 1 57 ASN H 1 58 GLU H 2.900 . 4.000 2.553 2.429 2.724 . 0 0 "[ . 1 . 2]" 1
1068 1 57 ASN HA 1 57 ASN HD21 3.580 . 5.360 1.897 1.810 2.004 . 0 0 "[ . 1 . 2]" 1
1069 1 57 ASN HA 1 57 ASN HD22 3.260 . 4.720 3.509 3.409 3.581 . 0 0 "[ . 1 . 2]" 1
1070 1 57 ASN HA 1 58 GLU H 2.700 . 3.600 3.326 3.286 3.389 . 0 0 "[ . 1 . 2]" 1
1071 1 57 ASN HB2 1 57 ASN HD21 2.780 . 3.760 3.056 2.907 3.203 . 0 0 "[ . 1 . 2]" 1
1072 1 57 ASN HB2 1 57 ASN HD22 3.010 . 4.220 3.851 3.784 3.919 . 0 0 "[ . 1 . 2]" 1
1073 1 57 ASN HB2 1 58 GLU H 3.390 . 4.980 4.306 4.179 4.354 . 0 0 "[ . 1 . 2]" 1
1074 1 57 ASN HB3 1 57 ASN HD21 2.970 . 4.140 3.526 3.442 3.587 . 0 0 "[ . 1 . 2]" 1
1075 1 57 ASN HB3 1 58 GLU H 3.650 . 5.500 3.391 3.213 3.468 . 0 0 "[ . 1 . 2]" 1
1076 1 57 ASN HD21 1 59 ILE MD 3.280 . 4.760 4.342 3.931 4.541 . 0 0 "[ . 1 . 2]" 1
1077 1 57 ASN HD21 1 59 ILE MG 3.530 . 5.260 3.151 2.815 3.325 . 0 0 "[ . 1 . 2]" 1
1078 1 57 ASN HD22 1 59 ILE MD 3.030 . 4.260 4.297 4.239 4.329 0.069 9 0 "[ . 1 . 2]" 1
1079 1 57 ASN HD22 1 59 ILE MG 3.490 . 5.180 4.095 3.670 4.344 . 0 0 "[ . 1 . 2]" 1
1080 1 58 GLU H 1 58 GLU HA 2.890 . 3.980 2.902 2.885 2.919 . 0 0 "[ . 1 . 2]" 1
1081 1 58 GLU H 1 58 GLU HB2 2.780 . 3.760 2.582 2.320 3.600 . 0 0 "[ . 1 . 2]" 1
1082 1 58 GLU H 1 58 GLU HB3 2.780 . 3.760 3.537 2.852 3.623 . 0 0 "[ . 1 . 2]" 1
1083 1 58 GLU H 1 58 GLU HG2 3.340 . 4.880 3.169 1.811 3.824 . 0 0 "[ . 1 . 2]" 1
1084 1 58 GLU H 1 58 GLU HG3 2.600 . 3.400 2.617 2.095 3.465 0.065 14 0 "[ . 1 . 2]" 1
1085 1 58 GLU H 1 59 ILE H 3.290 . 4.780 3.636 3.300 3.896 . 0 0 "[ . 1 . 2]" 1
1086 1 58 GLU HA 1 58 GLU HB3 2.830 . 3.860 2.458 2.398 2.557 . 0 0 "[ . 1 . 2]" 1
1087 1 58 GLU HA 1 58 GLU HG2 3.470 . 5.140 2.781 2.363 3.715 . 0 0 "[ . 1 . 2]" 1
1088 1 58 GLU HA 1 58 GLU HG3 3.280 . 4.760 3.145 2.382 3.766 . 0 0 "[ . 1 . 2]" 1
1089 1 58 GLU HA 1 59 ILE H 2.510 . 3.220 2.522 2.360 2.717 . 0 0 "[ . 1 . 2]" 1
1090 1 58 GLU HB3 1 59 ILE H 3.320 . 4.840 4.354 4.199 4.658 . 0 0 "[ . 1 . 2]" 1
1091 1 59 ILE H 1 59 ILE HA 2.740 . 3.680 2.804 2.734 2.865 . 0 0 "[ . 1 . 2]" 1
1092 1 59 ILE H 1 59 ILE HB 2.850 . 3.900 3.576 3.561 3.594 . 0 0 "[ . 1 . 2]" 1
1093 1 59 ILE H 1 59 ILE MD 2.710 . 3.620 3.582 3.501 3.638 0.018 19 0 "[ . 1 . 2]" 1
1094 1 59 ILE H 1 59 ILE HG12 2.960 . 4.120 1.900 1.794 2.202 0.006 8 0 "[ . 1 . 2]" 1
1095 1 59 ILE H 1 59 ILE HG13 2.910 . 4.020 2.844 2.582 3.518 . 0 0 "[ . 1 . 2]" 1
1096 1 59 ILE H 1 59 ILE MG 2.920 . 4.040 2.232 1.949 2.430 . 0 0 "[ . 1 . 2]" 1
1097 1 59 ILE H 1 60 PHE H 3.000 . 4.200 2.669 2.517 2.852 . 0 0 "[ . 1 . 2]" 1
1098 1 59 ILE HA 1 59 ILE MD 3.130 . 4.460 4.131 4.126 4.136 . 0 0 "[ . 1 . 2]" 1
1099 1 59 ILE HA 1 59 ILE HG12 3.230 . 4.660 3.703 3.660 3.738 . 0 0 "[ . 1 . 2]" 1
1100 1 59 ILE HA 1 59 ILE HG13 3.250 . 4.700 3.680 3.656 3.716 . 0 0 "[ . 1 . 2]" 1
1101 1 59 ILE HA 1 59 ILE MG 2.750 . 3.700 2.292 2.237 2.407 . 0 0 "[ . 1 . 2]" 1
1102 1 59 ILE HA 1 60 PHE H 3.280 . 4.760 3.418 3.372 3.519 . 0 0 "[ . 1 . 2]" 1
1103 1 59 ILE HA 1 62 LEU H 3.650 . 5.500 3.491 3.266 3.696 . 0 0 "[ . 1 . 2]" 1
1104 1 59 ILE HB 1 59 ILE MD 2.930 . 4.060 2.345 2.324 2.392 . 0 0 "[ . 1 . 2]" 1
1105 1 59 ILE HB 1 59 ILE HG13 2.970 . 4.140 2.538 2.443 2.569 . 0 0 "[ . 1 . 2]" 1
1106 1 59 ILE MD 1 60 PHE HA 3.240 . 4.680 4.582 4.328 4.733 0.053 17 0 "[ . 1 . 2]" 1
1107 1 59 ILE HG13 1 59 ILE MG 2.990 . 4.180 3.190 3.178 3.199 . 0 0 "[ . 1 . 2]" 1
1108 1 59 ILE HG13 1 60 PHE H 3.600 . 5.400 2.547 2.035 3.244 . 0 0 "[ . 1 . 2]" 1
1109 1 59 ILE MG 1 60 PHE H 3.570 . 5.340 4.114 3.882 4.232 . 0 0 "[ . 1 . 2]" 1
1110 1 60 PHE H 1 60 PHE HA 2.860 . 3.920 2.762 2.743 2.803 . 0 0 "[ . 1 . 2]" 1
1111 1 60 PHE H 1 60 PHE HB2 2.650 . 3.500 2.598 2.333 3.592 0.092 5 0 "[ . 1 . 2]" 1
1112 1 60 PHE H 1 60 PHE QD 3.510 . 5.220 2.953 1.972 4.176 . 0 0 "[ . 1 . 2]" 1
1113 1 60 PHE H 1 61 ARG H 2.960 . 4.120 2.778 2.675 2.858 . 0 0 "[ . 1 . 2]" 1
1114 1 60 PHE H 1 62 LEU H 3.650 . 5.500 4.614 4.390 4.778 . 0 0 "[ . 1 . 2]" 1
1115 1 60 PHE HA 1 60 PHE HB2 2.770 . 3.740 2.756 2.439 3.028 . 0 0 "[ . 1 . 2]" 1
1116 1 60 PHE HA 1 60 PHE QD 3.270 . 4.740 2.914 2.699 3.692 . 0 0 "[ . 1 . 2]" 1
1117 1 60 PHE HA 1 61 ARG H 3.490 . 5.180 3.493 3.485 3.510 . 0 0 "[ . 1 . 2]" 1
1118 1 60 PHE HB2 1 60 PHE QD 3.080 . 4.360 2.420 2.367 2.499 . 0 0 "[ . 1 . 2]" 1
1119 1 60 PHE HB3 1 60 PHE QD 3.280 . 4.760 2.409 2.350 2.469 . 0 0 "[ . 1 . 2]" 1
1120 1 61 ARG H 1 62 LEU H 3.400 . 5.000 2.823 2.646 2.938 . 0 0 "[ . 1 . 2]" 1
1121 1 61 ARG HA 1 61 ARG HB3 2.750 . 3.700 2.766 2.431 3.028 . 0 0 "[ . 1 . 2]" 1
1122 1 61 ARG HA 1 61 ARG QD 3.500 . 5.200 2.798 2.099 4.256 . 0 0 "[ . 1 . 2]" 1
1123 1 61 ARG HA 1 62 LEU H 3.650 . 5.500 3.561 3.512 3.589 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Thursday, May 23, 2024 8:00:20 PM GMT (wattos1)