NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
475968 |
2xk0   |
17050 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2xk0
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 1581
_Distance_constraint_stats_list.Viol_count 1272
_Distance_constraint_stats_list.Viol_total 437.458
_Distance_constraint_stats_list.Viol_max 0.193
_Distance_constraint_stats_list.Viol_rms 0.0129
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0028
_Distance_constraint_stats_list.Viol_average_violations_only 0.0344
_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 4 ALA 0.024 0.024 2 0 "[ . 1]"
1 5 PRO 0.422 0.193 1 0 "[ . 1]"
1 6 PRO 0.039 0.029 4 0 "[ . 1]"
1 7 VAL 0.029 0.029 4 0 "[ . 1]"
1 8 ALA 0.202 0.041 4 0 "[ . 1]"
1 9 ALA 0.510 0.092 4 0 "[ . 1]"
1 10 PRO 0.620 0.092 4 0 "[ . 1]"
1 11 SER 0.312 0.059 6 0 "[ . 1]"
1 12 PRO 0.388 0.193 1 0 "[ . 1]"
1 13 ALA 0.590 0.172 10 0 "[ . 1]"
1 14 VAL 1.873 0.172 10 0 "[ . 1]"
1 15 THR 1.888 0.166 9 0 "[ . 1]"
1 16 TYR 2.453 0.127 6 0 "[ . 1]"
1 17 ALA 0.301 0.076 5 0 "[ . 1]"
1 18 LEU 2.793 0.174 2 0 "[ . 1]"
1 19 GLN 0.702 0.055 3 0 "[ . 1]"
1 20 GLU 0.428 0.076 5 0 "[ . 1]"
1 21 ASP 0.213 0.040 5 0 "[ . 1]"
1 22 VAL 2.386 0.092 4 0 "[ . 1]"
1 23 PHE 2.099 0.157 7 0 "[ . 1]"
1 24 ILE 2.430 0.137 4 0 "[ . 1]"
1 25 LYS 2.433 0.119 4 0 "[ . 1]"
1 26 CYS 0.885 0.094 2 0 "[ . 1]"
1 27 ASN 0.351 0.067 3 0 "[ . 1]"
1 28 ASP 0.045 0.045 4 0 "[ . 1]"
1 29 GLY 0.174 0.051 10 0 "[ . 1]"
1 30 ARG 0.286 0.031 6 0 "[ . 1]"
1 31 PHE 2.771 0.137 4 0 "[ . 1]"
1 32 TYR 1.166 0.053 2 0 "[ . 1]"
1 33 LEU 1.947 0.157 7 0 "[ . 1]"
1 34 GLY 0.173 0.079 4 0 "[ . 1]"
1 35 THR 0.057 0.017 5 0 "[ . 1]"
1 36 ILE 2.099 0.075 1 0 "[ . 1]"
1 37 ILE 7.733 0.174 2 0 "[ . 1]"
1 38 ASP 1.952 0.107 3 0 "[ . 1]"
1 39 GLN 1.238 0.079 7 0 "[ . 1]"
1 40 THR 1.158 0.076 8 0 "[ . 1]"
1 41 SER 0.320 0.094 8 0 "[ . 1]"
1 42 ASP 0.877 0.099 8 0 "[ . 1]"
1 43 GLN 1.249 0.102 10 0 "[ . 1]"
1 44 TYR 3.022 0.125 5 0 "[ . 1]"
1 45 LEU 3.175 0.130 2 0 "[ . 1]"
1 46 ILE 3.170 0.108 8 0 "[ . 1]"
1 47 ARG 2.514 0.135 9 0 "[ . 1]"
1 48 PHE 1.329 0.053 2 0 "[ . 1]"
1 49 ASP 0.449 0.053 1 0 "[ . 1]"
1 50 ASP 0.360 0.043 8 0 "[ . 1]"
1 51 GLN 0.864 0.135 9 0 "[ . 1]"
1 52 SER 0.055 0.049 8 0 "[ . 1]"
1 53 GLU 1.366 0.106 2 0 "[ . 1]"
1 54 GLN 0.333 0.053 9 0 "[ . 1]"
1 55 TRP 3.676 0.099 10 0 "[ . 1]"
1 56 CYS 0.633 0.066 9 0 "[ . 1]"
1 57 GLU 1.387 0.167 4 0 "[ . 1]"
1 58 PRO 4.041 0.167 4 0 "[ . 1]"
1 59 ASP 0.158 0.047 3 0 "[ . 1]"
1 60 LYS 1.452 0.119 4 0 "[ . 1]"
1 61 LEU 2.892 0.078 10 0 "[ . 1]"
1 62 ARG 0.829 0.082 7 0 "[ . 1]"
1 63 LYS 1.921 0.142 6 0 "[ . 1]"
1 64 LEU 2.427 0.142 1 0 "[ . 1]"
1 65 GLY 0.029 0.021 3 0 "[ . 1]"
1 67 GLY 0.085 0.031 10 0 "[ . 1]"
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 4 ALA H 1 4 ALA MB 2.990 . 4.180 2.484 2.274 2.754 . 0 0 "[ . 1]" 1
2 1 4 ALA HA 1 5 PRO HD2 2.350 . 2.900 2.398 1.982 2.924 0.024 2 0 "[ . 1]" 1
3 1 4 ALA HA 1 5 PRO QD 2.135 . 2.470 2.018 1.882 2.132 . 0 0 "[ . 1]" 1
4 1 4 ALA HA 1 5 PRO HD3 2.350 . 2.900 2.313 1.922 2.722 . 0 0 "[ . 1]" 1
5 1 4 ALA HA 1 5 PRO QG 2.960 . 4.120 3.901 3.767 4.018 . 0 0 "[ . 1]" 1
6 1 4 ALA MB 1 5 PRO QD 2.930 . 4.060 2.766 2.253 3.525 . 0 0 "[ . 1]" 1
7 1 5 PRO HA 1 6 PRO QB 3.380 . 4.960 4.705 4.573 4.970 0.010 2 0 "[ . 1]" 1
8 1 5 PRO HA 1 6 PRO HD2 2.520 . 3.240 2.553 2.079 3.055 . 0 0 "[ . 1]" 1
9 1 5 PRO HA 1 6 PRO QD 2.300 . 2.800 1.986 1.857 2.341 . 0 0 "[ . 1]" 1
10 1 5 PRO HA 1 6 PRO HD3 2.520 . 3.240 2.133 1.891 2.489 . 0 0 "[ . 1]" 1
11 1 5 PRO QD 1 12 PRO HA 3.275 . 4.750 3.665 2.523 4.943 0.193 1 0 "[ . 1]" 1
12 1 5 PRO QD 1 12 PRO QB 2.575 . 3.350 2.615 1.957 3.394 0.044 1 0 "[ . 1]" 1
13 1 5 PRO QD 1 12 PRO QG 3.085 . 4.370 3.003 2.094 4.345 . 0 0 "[ . 1]" 1
14 1 5 PRO QG 1 12 PRO QD 2.395 . 2.990 2.717 2.061 3.010 0.020 7 0 "[ . 1]" 1
15 1 6 PRO HA 1 7 VAL QG 3.155 . 4.510 3.912 3.330 4.539 0.029 4 0 "[ . 1]" 1
16 1 7 VAL H 1 7 VAL HB 2.955 . 4.110 3.249 2.546 3.876 . 0 0 "[ . 1]" 1
17 1 7 VAL H 1 7 VAL QG 3.025 . 4.250 2.377 1.917 2.800 . 0 0 "[ . 1]" 1
18 1 7 VAL HB 1 8 ALA H 3.255 . 4.710 3.481 1.891 4.384 . 0 0 "[ . 1]" 1
19 1 7 VAL QG 1 8 ALA H 3.190 . 4.580 2.857 2.044 3.619 . 0 0 "[ . 1]" 1
20 1 8 ALA H 1 8 ALA MB 2.655 . 3.510 2.545 2.221 3.014 . 0 0 "[ . 1]" 1
21 1 8 ALA HA 1 9 ALA H 2.295 . 2.790 2.485 2.111 2.824 0.034 1 0 "[ . 1]" 1
22 1 8 ALA MB 1 9 ALA H 2.690 . 3.580 3.239 1.938 3.621 0.041 4 0 "[ . 1]" 1
23 1 9 ALA H 1 9 ALA MB 2.810 . 3.820 2.525 2.226 2.761 . 0 0 "[ . 1]" 1
24 1 9 ALA HA 1 10 PRO QD 2.670 . 3.540 2.766 2.013 3.632 0.092 4 0 "[ . 1]" 1
25 1 9 ALA MB 1 10 PRO HA 3.325 . 4.850 4.325 4.112 4.524 . 0 0 "[ . 1]" 1
26 1 10 PRO HA 1 11 SER H 2.370 . 2.940 2.658 2.323 2.999 0.059 6 0 "[ . 1]" 1
27 1 10 PRO QB 1 11 SER H 3.000 . 4.200 2.665 1.741 3.830 0.059 6 0 "[ . 1]" 1
28 1 10 PRO QG 1 11 SER H 2.975 . 4.150 3.929 2.983 4.177 0.027 8 0 "[ . 1]" 1
29 1 11 SER H 1 11 SER QB 2.615 . 3.430 2.475 2.239 2.839 . 0 0 "[ . 1]" 1
30 1 11 SER HA 1 12 PRO QD 2.915 . 4.030 2.038 1.892 2.277 . 0 0 "[ . 1]" 1
31 1 12 PRO HA 1 13 ALA H 2.390 . 2.980 2.195 2.119 2.380 . 0 0 "[ . 1]" 1
32 1 12 PRO HA 1 13 ALA MB 3.440 . 5.080 4.016 3.795 4.259 . 0 0 "[ . 1]" 1
33 1 12 PRO QB 1 13 ALA H 2.850 . 3.900 3.149 3.046 3.210 . 0 0 "[ . 1]" 1
34 1 12 PRO HB2 1 13 ALA H 3.220 . 4.640 3.486 3.318 3.767 . 0 0 "[ . 1]" 1
35 1 12 PRO HB3 1 13 ALA H 3.220 . 4.640 3.658 3.320 3.893 . 0 0 "[ . 1]" 1
36 1 13 ALA H 1 13 ALA MB 2.530 . 3.260 2.713 2.431 2.918 . 0 0 "[ . 1]" 1
37 1 13 ALA H 1 14 VAL H 2.825 . 3.850 3.634 3.117 4.022 0.172 10 0 "[ . 1]" 1
38 1 13 ALA HA 1 14 VAL H 2.190 . 2.580 2.261 2.156 2.585 0.005 10 0 "[ . 1]" 1
39 1 13 ALA HA 1 14 VAL MG1 3.650 . 5.500 4.218 3.563 5.475 . 0 0 "[ . 1]" 1
40 1 13 ALA HA 1 14 VAL QG 2.925 . 4.050 3.449 3.056 3.699 . 0 0 "[ . 1]" 1
41 1 13 ALA HA 1 14 VAL MG2 3.650 . 5.500 3.715 3.326 4.207 . 0 0 "[ . 1]" 1
42 1 13 ALA MB 1 14 VAL H 2.670 . 3.540 3.094 1.797 3.602 0.062 4 0 "[ . 1]" 1
43 1 14 VAL H 1 14 VAL HB 2.735 . 3.670 3.577 2.696 3.730 0.060 1 0 "[ . 1]" 1
44 1 14 VAL H 1 14 VAL MG1 2.850 . 3.900 2.870 2.407 3.831 . 0 0 "[ . 1]" 1
45 1 14 VAL H 1 14 VAL MG2 2.850 . 3.900 2.030 1.789 2.253 0.011 8 0 "[ . 1]" 1
46 1 14 VAL HA 1 14 VAL MG1 2.565 . 3.330 2.286 2.246 2.349 . 0 0 "[ . 1]" 1
47 1 14 VAL HA 1 14 VAL QG 2.240 . 2.680 2.232 2.125 2.295 . 0 0 "[ . 1]" 1
48 1 14 VAL HA 1 14 VAL MG2 2.565 . 3.330 3.148 2.622 3.227 . 0 0 "[ . 1]" 1
49 1 14 VAL HA 1 15 THR HA 3.240 . 4.680 4.343 4.295 4.423 . 0 0 "[ . 1]" 1
50 1 14 VAL HA 1 15 THR MG 3.340 . 4.880 3.701 3.536 3.812 . 0 0 "[ . 1]" 1
51 1 14 VAL HA 1 16 TYR QE 3.650 . 5.500 5.138 4.676 5.442 . 0 0 "[ . 1]" 1
52 1 14 VAL HB 1 15 THR H 2.610 . 3.420 2.640 2.154 3.448 0.028 6 0 "[ . 1]" 1
53 1 14 VAL HB 1 15 THR HA 3.135 . 4.470 4.257 4.085 4.390 . 0 0 "[ . 1]" 1
54 1 14 VAL HB 1 15 THR HB 3.650 . 5.500 5.530 5.383 5.666 0.166 9 0 "[ . 1]" 1
55 1 14 VAL HB 1 16 TYR QD 3.275 . 4.750 4.396 4.141 4.698 . 0 0 "[ . 1]" 1
56 1 14 VAL HB 1 16 TYR QE 2.895 . 3.990 3.286 2.626 4.023 0.033 5 0 "[ . 1]" 1
57 1 14 VAL HB 1 63 LYS QE 3.280 . 4.760 2.616 2.026 3.841 . 0 0 "[ . 1]" 1
58 1 14 VAL QG 1 15 THR H 2.790 . 3.780 3.102 2.020 3.469 . 0 0 "[ . 1]" 1
59 1 14 VAL QG 1 15 THR HA 2.890 . 3.980 3.851 3.707 4.012 0.032 8 0 "[ . 1]" 1
60 1 14 VAL QG 1 16 TYR QD 2.900 . 4.000 3.549 3.359 3.923 . 0 0 "[ . 1]" 1
61 1 14 VAL QG 1 16 TYR QE 2.545 . 3.290 2.116 1.875 3.310 0.020 6 0 "[ . 1]" 1
62 1 14 VAL QG 1 63 LYS HD2 3.055 . 4.310 3.869 3.342 4.328 0.018 4 0 "[ . 1]" 1
63 1 14 VAL QG 1 63 LYS QE 2.350 . 2.900 2.499 1.872 2.873 . 0 0 "[ . 1]" 1
64 1 14 VAL MG1 1 15 THR H 3.080 . 4.360 3.387 2.025 3.794 . 0 0 "[ . 1]" 1
65 1 14 VAL MG1 1 15 THR HA 3.620 . 5.440 5.203 3.798 5.433 . 0 0 "[ . 1]" 1
66 1 14 VAL MG1 1 16 TYR QD 3.650 . 5.500 5.303 4.012 5.557 0.057 8 0 "[ . 1]" 1
67 1 14 VAL MG1 1 16 TYR QE 3.105 . 4.410 4.137 3.448 4.512 0.102 5 0 "[ . 1]" 1
68 1 14 VAL MG1 1 63 LYS HE2 3.180 . 4.560 3.814 2.384 4.582 0.022 8 0 "[ . 1]" 1
69 1 14 VAL MG1 1 63 LYS HE3 3.180 . 4.560 2.957 2.518 3.608 . 0 0 "[ . 1]" 1
70 1 14 VAL MG2 1 15 THR H 3.080 . 4.360 3.755 3.469 4.069 . 0 0 "[ . 1]" 1
71 1 14 VAL MG2 1 15 THR HA 3.620 . 5.440 4.102 3.773 5.325 . 0 0 "[ . 1]" 1
72 1 14 VAL MG2 1 16 TYR QD 3.650 . 5.500 3.752 3.387 5.546 0.046 6 0 "[ . 1]" 1
73 1 14 VAL MG2 1 16 TYR QE 3.105 . 4.410 2.216 1.876 4.270 . 0 0 "[ . 1]" 1
74 1 14 VAL MG2 1 63 LYS HE2 3.180 . 4.560 3.876 2.750 4.607 0.047 7 0 "[ . 1]" 1
75 1 14 VAL MG2 1 63 LYS HE3 3.180 . 4.560 3.522 1.903 4.463 . 0 0 "[ . 1]" 1
76 1 15 THR H 1 15 THR MG 2.775 . 3.750 2.576 2.184 3.294 . 0 0 "[ . 1]" 1
77 1 15 THR HA 1 15 THR HB 2.320 . 2.840 2.520 2.478 2.588 . 0 0 "[ . 1]" 1
78 1 15 THR HA 1 15 THR MG 2.775 . 3.750 2.801 2.205 3.195 . 0 0 "[ . 1]" 1
79 1 15 THR HA 1 16 TYR H 2.305 . 2.810 2.333 2.246 2.431 . 0 0 "[ . 1]" 1
80 1 15 THR HA 1 16 TYR HB2 3.395 . 4.990 4.273 4.176 4.358 . 0 0 "[ . 1]" 1
81 1 15 THR HA 1 16 TYR QD 2.585 . 3.370 2.836 2.568 3.080 . 0 0 "[ . 1]" 1
82 1 15 THR HA 1 16 TYR QE 3.105 . 4.410 4.150 3.909 4.366 . 0 0 "[ . 1]" 1
83 1 15 THR HA 1 61 LEU MD1 3.650 . 5.500 5.524 5.495 5.549 0.049 6 0 "[ . 1]" 1
84 1 15 THR HA 1 63 LYS QE 3.570 . 5.340 5.172 4.713 5.482 0.142 6 0 "[ . 1]" 1
85 1 15 THR HB 1 16 TYR H 2.895 . 3.990 3.326 2.477 3.919 . 0 0 "[ . 1]" 1
86 1 15 THR HB 1 16 TYR QD 3.650 . 5.500 5.052 4.769 5.443 . 0 0 "[ . 1]" 1
87 1 15 THR HB 1 44 TYR QE 3.650 . 5.500 4.911 4.381 5.543 0.043 7 0 "[ . 1]" 1
88 1 15 THR MG 1 16 TYR H 2.865 . 3.930 3.313 3.033 3.449 . 0 0 "[ . 1]" 1
89 1 15 THR MG 1 16 TYR QD 3.255 . 4.710 4.662 4.532 4.784 0.074 10 0 "[ . 1]" 1
90 1 15 THR MG 1 16 TYR QE 3.650 . 5.500 5.556 5.519 5.627 0.127 6 0 "[ . 1]" 1
91 1 16 TYR H 1 16 TYR HB2 2.545 . 3.290 2.687 2.615 2.738 . 0 0 "[ . 1]" 1
92 1 16 TYR H 1 16 TYR HB3 2.955 . 4.110 3.788 3.750 3.818 . 0 0 "[ . 1]" 1
93 1 16 TYR H 1 16 TYR QD 2.715 . 3.630 2.924 2.732 3.029 . 0 0 "[ . 1]" 1
94 1 16 TYR H 1 16 TYR QE 3.400 . 5.000 4.990 4.852 5.029 0.029 10 0 "[ . 1]" 1
95 1 16 TYR H 1 17 ALA H 3.230 . 4.660 4.384 4.314 4.441 . 0 0 "[ . 1]" 1
96 1 16 TYR H 1 44 TYR QE 2.855 . 3.910 2.754 2.421 3.080 . 0 0 "[ . 1]" 1
97 1 16 TYR HA 1 16 TYR QD 2.495 . 3.190 3.048 2.935 3.182 . 0 0 "[ . 1]" 1
98 1 16 TYR HA 1 16 TYR QE 3.345 . 4.890 4.632 4.543 4.758 . 0 0 "[ . 1]" 1
99 1 16 TYR HA 1 17 ALA H 2.355 . 2.910 2.338 2.264 2.382 . 0 0 "[ . 1]" 1
100 1 16 TYR HA 1 36 ILE MD 3.055 . 4.310 3.865 3.696 3.994 . 0 0 "[ . 1]" 1
101 1 16 TYR HB2 1 17 ALA H 2.965 . 4.130 3.753 3.689 3.855 . 0 0 "[ . 1]" 1
102 1 16 TYR HB2 1 17 ALA HA 3.650 . 5.500 4.884 4.793 5.025 . 0 0 "[ . 1]" 1
103 1 16 TYR HB2 1 36 ILE MD 2.415 . 3.030 2.516 2.282 2.644 . 0 0 "[ . 1]" 1
104 1 16 TYR HB2 1 44 TYR QE 3.140 . 4.480 2.855 2.718 3.006 . 0 0 "[ . 1]" 1
105 1 16 TYR HB2 1 61 LEU MD1 3.320 . 4.840 3.822 3.503 4.347 . 0 0 "[ . 1]" 1
106 1 16 TYR HB3 1 17 ALA H 2.520 . 3.240 2.565 2.492 2.701 . 0 0 "[ . 1]" 1
107 1 16 TYR HB3 1 22 VAL MG1 3.100 . 4.400 3.624 3.510 3.734 . 0 0 "[ . 1]" 1
108 1 16 TYR HB3 1 36 ILE MD 2.920 . 4.040 1.936 1.855 2.026 . 0 0 "[ . 1]" 1
109 1 16 TYR HB3 1 36 ILE HG12 3.430 . 5.060 4.444 4.269 4.627 . 0 0 "[ . 1]" 1
110 1 16 TYR HB3 1 36 ILE HG13 3.415 . 5.030 4.366 4.290 4.461 . 0 0 "[ . 1]" 1
111 1 16 TYR HB3 1 44 TYR QE 3.175 . 4.550 4.186 4.038 4.455 . 0 0 "[ . 1]" 1
112 1 16 TYR QD 1 17 ALA H 3.025 . 4.250 3.772 3.574 3.978 . 0 0 "[ . 1]" 1
113 1 16 TYR QD 1 17 ALA MB 3.650 . 5.500 5.246 5.088 5.400 . 0 0 "[ . 1]" 1
114 1 16 TYR QD 1 20 GLU HB3 3.280 . 4.760 4.237 4.063 4.617 . 0 0 "[ . 1]" 1
115 1 16 TYR QD 1 20 GLU QG 2.885 . 3.970 3.325 2.486 3.846 . 0 0 "[ . 1]" 1
116 1 16 TYR QD 1 22 VAL HB 3.400 . 5.000 4.332 4.230 4.434 . 0 0 "[ . 1]" 1
117 1 16 TYR QD 1 22 VAL MG1 2.275 . 2.750 2.056 1.949 2.121 . 0 0 "[ . 1]" 1
118 1 16 TYR QD 1 36 ILE MD 2.380 . 2.960 2.696 2.588 2.867 . 0 0 "[ . 1]" 1
119 1 16 TYR QD 1 36 ILE HG12 3.510 . 5.220 5.075 4.967 5.234 0.014 10 0 "[ . 1]" 1
120 1 16 TYR QD 1 36 ILE HG13 3.570 . 5.340 4.821 4.686 4.985 . 0 0 "[ . 1]" 1
121 1 16 TYR QD 1 36 ILE MG 3.455 . 5.110 4.961 4.782 5.055 . 0 0 "[ . 1]" 1
122 1 16 TYR QD 1 46 ILE MD 3.550 . 5.300 5.040 4.979 5.122 . 0 0 "[ . 1]" 1
123 1 16 TYR QD 1 58 PRO HA 3.255 . 4.710 3.900 3.576 4.664 . 0 0 "[ . 1]" 1
124 1 16 TYR QD 1 58 PRO HB3 3.075 . 4.350 3.374 2.921 4.330 . 0 0 "[ . 1]" 1
125 1 16 TYR QD 1 61 LEU HB2 3.490 . 5.180 4.124 3.912 4.540 . 0 0 "[ . 1]" 1
126 1 16 TYR QD 1 61 LEU HB3 3.440 . 5.080 3.906 3.743 4.121 . 0 0 "[ . 1]" 1
127 1 16 TYR QD 1 61 LEU MD1 2.675 . 3.550 3.154 2.968 3.437 . 0 0 "[ . 1]" 1
128 1 16 TYR QD 1 61 LEU MD2 2.845 . 3.890 3.599 3.446 3.754 . 0 0 "[ . 1]" 1
129 1 16 TYR QD 1 63 LYS HA 3.205 . 4.610 4.405 4.170 4.573 . 0 0 "[ . 1]" 1
130 1 16 TYR QD 1 63 LYS HD2 3.050 . 4.300 4.214 3.545 4.350 0.050 6 0 "[ . 1]" 1
131 1 16 TYR QD 1 63 LYS HG2 3.450 . 5.100 4.980 4.522 5.166 0.066 3 0 "[ . 1]" 1
132 1 16 TYR QD 1 63 LYS HG3 3.030 . 4.260 3.511 3.126 3.776 . 0 0 "[ . 1]" 1
133 1 16 TYR QE 1 20 GLU QG 3.560 . 5.320 4.697 4.134 5.349 0.029 1 0 "[ . 1]" 1
134 1 16 TYR QE 1 22 VAL HA 3.545 . 5.290 5.001 4.759 5.293 0.003 4 0 "[ . 1]" 1
135 1 16 TYR QE 1 22 VAL HB 2.850 . 3.900 3.647 3.491 3.793 . 0 0 "[ . 1]" 1
136 1 16 TYR QE 1 22 VAL MG1 2.345 . 2.890 2.349 2.249 2.522 . 0 0 "[ . 1]" 1
137 1 16 TYR QE 1 22 VAL MG2 2.935 . 4.070 4.099 4.066 4.132 0.062 4 0 "[ . 1]" 1
138 1 16 TYR QE 1 36 ILE MD 3.095 . 4.390 4.177 4.060 4.295 . 0 0 "[ . 1]" 1
139 1 16 TYR QE 1 44 TYR QD 3.535 . 5.270 4.714 4.294 4.963 . 0 0 "[ . 1]" 1
140 1 16 TYR QE 1 44 TYR QE 3.280 . 4.760 4.038 3.538 4.303 . 0 0 "[ . 1]" 1
141 1 16 TYR QE 1 58 PRO HA 3.035 . 4.270 3.101 2.890 3.227 . 0 0 "[ . 1]" 1
142 1 16 TYR QE 1 58 PRO HB2 3.100 . 4.400 3.508 2.940 3.882 . 0 0 "[ . 1]" 1
143 1 16 TYR QE 1 58 PRO HB3 3.055 . 4.310 2.967 2.290 3.386 . 0 0 "[ . 1]" 1
144 1 16 TYR QE 1 61 LEU HA 3.300 . 4.800 4.816 4.774 4.878 0.078 10 0 "[ . 1]" 1
145 1 16 TYR QE 1 61 LEU HB2 2.545 . 3.290 2.993 2.747 3.213 . 0 0 "[ . 1]" 1
146 1 16 TYR QE 1 61 LEU HB3 2.730 . 3.660 3.045 2.845 3.210 . 0 0 "[ . 1]" 1
147 1 16 TYR QE 1 61 LEU MD1 2.750 . 3.700 3.245 2.887 3.462 . 0 0 "[ . 1]" 1
148 1 16 TYR QE 1 61 LEU MD2 2.915 . 4.030 3.807 3.615 3.917 . 0 0 "[ . 1]" 1
149 1 16 TYR QE 1 61 LEU HG 3.645 . 5.490 5.186 5.101 5.262 . 0 0 "[ . 1]" 1
150 1 16 TYR QE 1 62 ARG HA 2.930 . 4.060 3.814 3.526 3.969 . 0 0 "[ . 1]" 1
151 1 16 TYR QE 1 63 LYS H 2.985 . 4.170 3.444 3.069 3.771 . 0 0 "[ . 1]" 1
152 1 16 TYR QE 1 63 LYS HA 2.550 . 3.300 3.077 2.886 3.239 . 0 0 "[ . 1]" 1
153 1 16 TYR QE 1 63 LYS HB2 3.375 . 4.950 4.577 4.382 4.779 . 0 0 "[ . 1]" 1
154 1 16 TYR QE 1 63 LYS HB3 3.395 . 4.990 4.703 4.490 4.962 . 0 0 "[ . 1]" 1
155 1 16 TYR QE 1 63 LYS HD2 2.480 . 3.160 2.278 1.913 2.452 . 0 0 "[ . 1]" 1
156 1 16 TYR QE 1 63 LYS HD3 2.930 . 4.060 3.923 3.613 4.041 . 0 0 "[ . 1]" 1
157 1 16 TYR QE 1 63 LYS QE 2.500 . 3.200 2.848 2.527 3.235 0.035 3 0 "[ . 1]" 1
158 1 16 TYR QE 1 63 LYS HG2 3.110 . 4.420 4.171 3.921 4.482 0.062 5 0 "[ . 1]" 1
159 1 16 TYR QE 1 63 LYS HG3 2.600 . 3.400 2.669 2.308 3.226 . 0 0 "[ . 1]" 1
160 1 16 TYR QE 1 64 LEU H 3.550 . 5.300 5.251 5.034 5.345 0.045 4 0 "[ . 1]" 1
161 1 17 ALA H 1 17 ALA MB 2.470 . 3.140 2.362 2.291 2.423 . 0 0 "[ . 1]" 1
162 1 17 ALA H 1 20 GLU HB2 3.105 . 4.410 3.558 3.158 3.957 . 0 0 "[ . 1]" 1
163 1 17 ALA H 1 36 ILE MD 2.840 . 3.880 3.066 2.767 3.360 . 0 0 "[ . 1]" 1
164 1 17 ALA HA 1 18 LEU H 2.330 . 2.860 2.325 2.255 2.401 . 0 0 "[ . 1]" 1
165 1 17 ALA HA 1 18 LEU HA 3.320 . 4.840 4.341 4.318 4.359 . 0 0 "[ . 1]" 1
166 1 17 ALA HA 1 18 LEU QD 2.960 . 4.120 3.773 3.672 3.820 . 0 0 "[ . 1]" 1
167 1 17 ALA HA 1 18 LEU HG 3.390 . 4.980 3.995 3.853 4.095 . 0 0 "[ . 1]" 1
168 1 17 ALA HA 1 20 GLU HB2 3.650 . 5.500 5.160 4.916 5.354 . 0 0 "[ . 1]" 1
169 1 17 ALA HA 1 39 GLN QB 3.650 . 5.500 4.829 4.398 5.348 . 0 0 "[ . 1]" 1
170 1 17 ALA MB 1 18 LEU H 2.340 . 2.880 2.631 2.415 2.800 . 0 0 "[ . 1]" 1
171 1 17 ALA MB 1 18 LEU HA 3.215 . 4.630 4.341 4.223 4.402 . 0 0 "[ . 1]" 1
172 1 17 ALA MB 1 20 GLU H 3.455 . 5.110 4.402 4.150 4.693 . 0 0 "[ . 1]" 1
173 1 17 ALA MB 1 20 GLU HA 3.500 . 5.200 5.009 4.756 5.222 0.022 9 0 "[ . 1]" 1
174 1 17 ALA MB 1 20 GLU HB2 2.550 . 3.300 2.941 2.630 3.101 . 0 0 "[ . 1]" 1
175 1 17 ALA MB 1 20 GLU HB3 2.940 . 4.080 3.841 3.615 4.084 0.004 10 0 "[ . 1]" 1
176 1 17 ALA MB 1 20 GLU QG 2.810 . 3.820 3.799 3.553 3.896 0.076 5 0 "[ . 1]" 1
177 1 18 LEU H 1 18 LEU HB2 2.305 . 2.810 2.737 2.668 2.812 0.002 3 0 "[ . 1]" 1
178 1 18 LEU H 1 18 LEU MD1 2.820 . 3.840 3.743 3.693 3.803 . 0 0 "[ . 1]" 1
179 1 18 LEU H 1 18 LEU QD 2.555 . 3.310 2.750 2.667 2.770 . 0 0 "[ . 1]" 1
180 1 18 LEU H 1 18 LEU MD2 2.820 . 3.840 2.830 2.732 2.856 . 0 0 "[ . 1]" 1
181 1 18 LEU H 1 18 LEU HG 2.405 . 3.010 2.189 2.127 2.257 . 0 0 "[ . 1]" 1
182 1 18 LEU H 1 19 GLN H 3.220 . 4.640 4.607 4.589 4.641 0.001 4 0 "[ . 1]" 1
183 1 18 LEU H 1 20 GLU HB2 3.650 . 5.500 5.173 4.954 5.360 . 0 0 "[ . 1]" 1
184 1 18 LEU H 1 36 ILE MD 3.320 . 4.840 4.761 4.614 4.849 0.009 4 0 "[ . 1]" 1
185 1 18 LEU H 1 39 GLN QB 3.650 . 5.500 5.011 4.752 5.364 . 0 0 "[ . 1]" 1
186 1 18 LEU HA 1 18 LEU MD1 2.880 . 3.960 3.840 3.815 3.868 . 0 0 "[ . 1]" 1
187 1 18 LEU HA 1 18 LEU QD 2.285 . 2.770 2.114 2.081 2.154 . 0 0 "[ . 1]" 1
188 1 18 LEU HA 1 18 LEU MD2 2.880 . 3.960 2.124 2.090 2.165 . 0 0 "[ . 1]" 1
189 1 18 LEU HA 1 18 LEU HG 2.700 . 3.600 3.328 3.282 3.360 . 0 0 "[ . 1]" 1
190 1 18 LEU HA 1 19 GLN H 2.240 . 2.680 2.287 2.222 2.343 . 0 0 "[ . 1]" 1
191 1 18 LEU HA 1 19 GLN HG3 3.290 . 4.780 4.390 4.246 4.573 . 0 0 "[ . 1]" 1
192 1 18 LEU HA 1 20 GLU HB3 3.245 . 4.690 4.347 4.179 4.482 . 0 0 "[ . 1]" 1
193 1 18 LEU HA 1 36 ILE HA 3.370 . 4.940 4.660 4.583 4.725 . 0 0 "[ . 1]" 1
194 1 18 LEU HA 1 36 ILE HB 2.585 . 3.370 2.154 2.003 2.246 . 0 0 "[ . 1]" 1
195 1 18 LEU HA 1 36 ILE MD 3.030 . 4.260 3.649 3.527 3.723 . 0 0 "[ . 1]" 1
196 1 18 LEU HA 1 36 ILE MG 2.375 . 2.950 2.643 2.559 2.749 . 0 0 "[ . 1]" 1
197 1 18 LEU HA 1 37 ILE HA 3.495 . 5.190 4.177 4.024 4.286 . 0 0 "[ . 1]" 1
198 1 18 LEU HA 1 44 TYR QD 3.650 . 5.500 5.290 5.024 5.507 0.007 1 0 "[ . 1]" 1
199 1 18 LEU HB2 1 18 LEU MD1 2.530 . 3.260 2.382 2.360 2.406 . 0 0 "[ . 1]" 1
200 1 18 LEU HB2 1 18 LEU QD 2.245 . 2.690 2.320 2.300 2.340 . 0 0 "[ . 1]" 1
201 1 18 LEU HB2 1 18 LEU MD2 2.530 . 3.260 3.192 3.178 3.207 . 0 0 "[ . 1]" 1
202 1 18 LEU HB2 1 18 LEU HG 2.390 . 2.980 2.387 2.330 2.446 . 0 0 "[ . 1]" 1
203 1 18 LEU HB2 1 19 GLN H 2.800 . 3.800 3.547 3.503 3.611 . 0 0 "[ . 1]" 1
204 1 18 LEU HB2 1 19 GLN HB2 3.320 . 4.840 4.259 4.151 4.303 . 0 0 "[ . 1]" 1
205 1 18 LEU HB2 1 19 GLN HG2 3.085 . 4.370 4.406 4.379 4.425 0.055 3 0 "[ . 1]" 1
206 1 18 LEU HB2 1 19 GLN HG3 3.050 . 4.300 2.899 2.724 3.037 . 0 0 "[ . 1]" 1
207 1 18 LEU HB2 1 20 GLU H 3.520 . 5.240 5.032 4.937 5.160 . 0 0 "[ . 1]" 1
208 1 18 LEU HB2 1 38 ASP HA 3.650 . 5.500 5.560 5.531 5.607 0.107 3 0 "[ . 1]" 1
209 1 18 LEU HB3 1 18 LEU MD1 2.605 . 3.410 2.331 2.295 2.370 . 0 0 "[ . 1]" 1
210 1 18 LEU HB3 1 18 LEU QD 2.320 . 2.840 2.123 2.106 2.142 . 0 0 "[ . 1]" 1
211 1 18 LEU HB3 1 18 LEU MD2 2.605 . 3.410 2.447 2.407 2.492 . 0 0 "[ . 1]" 1
212 1 18 LEU HB3 1 19 GLN H 2.700 . 3.600 2.515 2.441 2.627 . 0 0 "[ . 1]" 1
213 1 18 LEU HB3 1 19 GLN HB2 3.215 . 4.630 4.638 4.595 4.661 0.031 4 0 "[ . 1]" 1
214 1 18 LEU HB3 1 19 GLN HG2 2.880 . 3.960 3.942 3.839 4.000 0.040 1 0 "[ . 1]" 1
215 1 18 LEU HB3 1 19 GLN HG3 2.900 . 4.000 3.024 2.817 3.209 . 0 0 "[ . 1]" 1
216 1 18 LEU HB3 1 20 GLU H 3.640 . 5.480 4.642 4.592 4.741 . 0 0 "[ . 1]" 1
217 1 18 LEU HB3 1 37 ILE HA 3.300 . 4.800 3.156 2.969 3.287 . 0 0 "[ . 1]" 1
218 1 18 LEU HB3 1 38 ASP HA 3.355 . 4.910 4.581 4.512 4.636 . 0 0 "[ . 1]" 1
219 1 18 LEU QD 1 19 GLN H 2.650 . 3.500 3.480 3.432 3.528 0.028 6 0 "[ . 1]" 1
220 1 18 LEU QD 1 19 GLN HG2 3.440 . 5.080 4.737 4.666 4.770 . 0 0 "[ . 1]" 1
221 1 18 LEU QD 1 19 GLN HG3 3.240 . 4.680 3.987 3.853 4.089 . 0 0 "[ . 1]" 1
222 1 18 LEU QD 1 36 ILE HA 3.100 . 4.400 4.316 4.189 4.431 0.031 4 0 "[ . 1]" 1
223 1 18 LEU QD 1 36 ILE HB 2.700 . 3.600 3.186 3.027 3.341 . 0 0 "[ . 1]" 1
224 1 18 LEU QD 1 36 ILE MG 2.305 . 2.810 1.982 1.879 2.065 . 0 0 "[ . 1]" 1
225 1 18 LEU QD 1 37 ILE HA 2.495 . 3.190 3.016 2.965 3.044 . 0 0 "[ . 1]" 1
226 1 18 LEU QD 1 39 GLN H 3.055 . 4.310 2.767 2.521 2.901 . 0 0 "[ . 1]" 1
227 1 18 LEU QD 1 39 GLN HA 3.145 . 4.490 3.802 3.642 3.914 . 0 0 "[ . 1]" 1
228 1 18 LEU QD 1 39 GLN QB 2.765 . 3.730 2.527 2.333 2.691 . 0 0 "[ . 1]" 1
229 1 18 LEU QD 1 39 GLN QG 2.610 . 3.420 2.323 2.115 3.356 . 0 0 "[ . 1]" 1
230 1 18 LEU QD 1 44 TYR QD 2.845 . 3.890 3.567 3.250 3.836 . 0 0 "[ . 1]" 1
231 1 18 LEU QD 1 44 TYR QE 3.250 . 4.700 4.279 4.084 4.581 . 0 0 "[ . 1]" 1
232 1 18 LEU QD 1 55 TRP HH2 3.470 . 5.140 5.097 5.018 5.171 0.031 6 0 "[ . 1]" 1
233 1 18 LEU MD1 1 37 ILE HA 2.730 . 3.660 3.653 3.604 3.681 0.021 5 0 "[ . 1]" 1
234 1 18 LEU MD1 1 38 ASP HA 2.605 . 3.410 2.633 2.512 2.743 . 0 0 "[ . 1]" 1
235 1 18 LEU MD1 1 39 GLN QB 3.200 . 4.600 4.449 4.121 4.607 0.007 4 0 "[ . 1]" 1
236 1 18 LEU MD1 1 39 GLN QG 3.040 . 4.280 3.374 2.916 4.350 0.070 9 0 "[ . 1]" 1
237 1 18 LEU MD2 1 37 ILE HA 2.730 . 3.660 3.215 3.142 3.270 . 0 0 "[ . 1]" 1
238 1 18 LEU MD2 1 38 ASP HA 2.605 . 3.410 2.180 2.062 2.290 . 0 0 "[ . 1]" 1
239 1 18 LEU MD2 1 39 GLN QB 3.200 . 4.600 2.541 2.346 2.709 . 0 0 "[ . 1]" 1
240 1 18 LEU MD2 1 39 GLN QG 3.040 . 4.280 2.373 2.146 3.491 . 0 0 "[ . 1]" 1
241 1 18 LEU HG 1 19 GLN HG3 3.650 . 5.500 5.256 5.066 5.414 . 0 0 "[ . 1]" 1
242 1 18 LEU HG 1 37 ILE HA 3.650 . 5.500 5.627 5.578 5.674 0.174 2 0 "[ . 1]" 1
243 1 19 GLN H 1 19 GLN HA 2.200 . 2.600 2.223 2.186 2.257 . 0 0 "[ . 1]" 1
244 1 19 GLN H 1 19 GLN HG3 2.595 . 3.390 3.124 2.954 3.255 . 0 0 "[ . 1]" 1
245 1 19 GLN H 1 20 GLU H 2.585 . 3.370 2.582 2.524 2.690 . 0 0 "[ . 1]" 1
246 1 19 GLN H 1 35 THR MG 2.680 . 3.560 3.190 3.077 3.346 . 0 0 "[ . 1]" 1
247 1 19 GLN H 1 36 ILE H 2.980 . 4.160 3.757 3.640 3.855 . 0 0 "[ . 1]" 1
248 1 19 GLN H 1 36 ILE HB 2.740 . 3.680 2.914 2.850 3.009 . 0 0 "[ . 1]" 1
249 1 19 GLN H 1 36 ILE MD 3.450 . 5.100 4.761 4.721 4.802 . 0 0 "[ . 1]" 1
250 1 19 GLN H 1 37 ILE HA 3.290 . 4.780 3.367 3.246 3.467 . 0 0 "[ . 1]" 1
251 1 19 GLN HA 1 19 GLN HB3 2.280 . 2.760 2.451 2.437 2.466 . 0 0 "[ . 1]" 1
252 1 19 GLN HA 1 19 GLN HG2 2.600 . 3.400 2.551 2.471 2.621 . 0 0 "[ . 1]" 1
253 1 19 GLN HA 1 19 GLN HG3 2.725 . 3.650 3.247 3.141 3.326 . 0 0 "[ . 1]" 1
254 1 19 GLN HA 1 20 GLU H 2.575 . 3.350 3.062 2.938 3.191 . 0 0 "[ . 1]" 1
255 1 19 GLN HA 1 20 GLU HA 3.270 . 4.740 4.582 4.475 4.695 . 0 0 "[ . 1]" 1
256 1 19 GLN HA 1 35 THR MG 2.500 . 3.200 2.153 2.047 2.235 . 0 0 "[ . 1]" 1
257 1 19 GLN HA 1 36 ILE H 3.295 . 4.790 4.131 3.979 4.397 . 0 0 "[ . 1]" 1
258 1 19 GLN HA 1 36 ILE HB 3.415 . 5.030 4.581 4.429 4.792 . 0 0 "[ . 1]" 1
259 1 19 GLN HA 1 37 ILE MG 3.365 . 4.930 4.632 4.307 4.873 . 0 0 "[ . 1]" 1
260 1 19 GLN HB2 1 20 GLU HA 3.485 . 5.170 4.650 4.555 4.860 . 0 0 "[ . 1]" 1
261 1 19 GLN HB2 1 35 THR MG 3.535 . 5.270 4.521 4.452 4.615 . 0 0 "[ . 1]" 1
262 1 19 GLN HB3 1 19 GLN HG2 2.290 . 2.780 2.541 2.475 2.588 . 0 0 "[ . 1]" 1
263 1 19 GLN HB3 1 20 GLU HA 3.650 . 5.500 4.869 4.739 5.002 . 0 0 "[ . 1]" 1
264 1 19 GLN HB3 1 35 THR MG 2.815 . 3.830 3.721 3.577 3.836 0.006 1 0 "[ . 1]" 1
265 1 19 GLN HG2 1 35 THR MG 3.425 . 5.050 3.917 3.706 4.065 . 0 0 "[ . 1]" 1
266 1 19 GLN HG2 1 37 ILE HA 3.385 . 4.970 4.586 3.913 5.011 0.041 10 0 "[ . 1]" 1
267 1 19 GLN HG3 1 35 THR MG 3.475 . 5.150 4.796 4.736 4.939 . 0 0 "[ . 1]" 1
268 1 20 GLU H 1 20 GLU HB2 2.880 . 3.960 2.700 2.521 2.841 . 0 0 "[ . 1]" 1
269 1 20 GLU H 1 21 ASP H 3.220 . 4.640 4.450 4.395 4.509 . 0 0 "[ . 1]" 1
270 1 20 GLU H 1 35 THR MG 2.695 . 3.590 3.429 3.109 3.595 0.005 7 0 "[ . 1]" 1
271 1 20 GLU H 1 36 ILE H 2.880 . 3.960 3.132 2.956 3.308 . 0 0 "[ . 1]" 1
272 1 20 GLU H 1 36 ILE HB 3.025 . 4.250 2.780 2.512 2.968 . 0 0 "[ . 1]" 1
273 1 20 GLU H 1 36 ILE MD 2.940 . 4.080 3.626 3.526 3.783 . 0 0 "[ . 1]" 1
274 1 20 GLU HA 1 20 GLU QG 2.450 . 3.100 2.951 2.455 3.108 0.008 7 0 "[ . 1]" 1
275 1 20 GLU HA 1 21 ASP H 2.200 . 2.600 2.197 2.157 2.230 . 0 0 "[ . 1]" 1
276 1 20 GLU HA 1 21 ASP HA 3.225 . 4.650 4.372 4.334 4.414 . 0 0 "[ . 1]" 1
277 1 20 GLU HA 1 22 VAL MG1 3.435 . 5.070 4.686 4.468 5.017 . 0 0 "[ . 1]" 1
278 1 20 GLU HA 1 35 THR HA 3.465 . 5.130 5.052 4.852 5.147 0.017 5 0 "[ . 1]" 1
279 1 20 GLU HA 1 36 ILE MD 3.650 . 5.500 4.996 4.742 5.291 . 0 0 "[ . 1]" 1
280 1 20 GLU HB2 1 20 GLU QG 2.400 . 3.000 2.318 2.293 2.334 . 0 0 "[ . 1]" 1
281 1 20 GLU HB2 1 22 VAL MG1 3.315 . 4.830 4.507 4.364 4.802 . 0 0 "[ . 1]" 1
282 1 20 GLU HB2 1 36 ILE MD 3.075 . 4.350 3.765 3.298 4.178 . 0 0 "[ . 1]" 1
283 1 20 GLU HB3 1 20 GLU QG 2.400 . 3.000 2.174 2.140 2.343 . 0 0 "[ . 1]" 1
284 1 20 GLU HB3 1 22 VAL MG1 2.675 . 3.550 3.421 3.270 3.572 0.022 7 0 "[ . 1]" 1
285 1 20 GLU HB3 1 35 THR MG 3.650 . 5.500 4.893 4.771 4.990 . 0 0 "[ . 1]" 1
286 1 20 GLU HB3 1 36 ILE MD 2.610 . 3.420 2.411 2.068 2.769 . 0 0 "[ . 1]" 1
287 1 20 GLU HB3 1 36 ILE MG 3.565 . 5.330 4.510 4.157 4.797 . 0 0 "[ . 1]" 1
288 1 20 GLU QG 1 21 ASP HA 3.380 . 4.960 4.228 3.972 4.330 . 0 0 "[ . 1]" 1
289 1 20 GLU QG 1 22 VAL HA 3.335 . 4.870 4.420 4.259 4.650 . 0 0 "[ . 1]" 1
290 1 20 GLU QG 1 22 VAL MG1 2.420 . 3.040 2.147 1.845 2.609 . 0 0 "[ . 1]" 1
291 1 20 GLU QG 1 36 ILE MD 2.865 . 3.930 3.336 2.859 3.680 . 0 0 "[ . 1]" 1
292 1 21 ASP H 1 21 ASP HB2 2.750 . 3.700 2.531 2.464 2.611 . 0 0 "[ . 1]" 1
293 1 21 ASP H 1 22 VAL H 3.230 . 4.660 4.417 4.360 4.490 . 0 0 "[ . 1]" 1
294 1 21 ASP H 1 22 VAL MG1 3.190 . 4.580 3.960 3.780 4.313 . 0 0 "[ . 1]" 1
295 1 21 ASP H 1 35 THR HA 3.215 . 4.630 4.434 4.218 4.584 . 0 0 "[ . 1]" 1
296 1 21 ASP H 1 35 THR MG 3.330 . 4.860 4.049 3.863 4.319 . 0 0 "[ . 1]" 1
297 1 21 ASP H 1 64 LEU MD1 3.125 . 4.450 3.996 3.544 4.216 . 0 0 "[ . 1]" 1
298 1 21 ASP HA 1 22 VAL H 2.385 . 2.970 2.098 2.074 2.132 . 0 0 "[ . 1]" 1
299 1 21 ASP HA 1 22 VAL MG1 3.085 . 4.370 3.861 3.753 3.961 . 0 0 "[ . 1]" 1
300 1 21 ASP HA 1 22 VAL MG2 2.850 . 3.900 3.148 3.081 3.247 . 0 0 "[ . 1]" 1
301 1 21 ASP HA 1 33 LEU MD1 3.645 . 5.490 4.111 3.411 5.519 0.029 4 0 "[ . 1]" 1
302 1 21 ASP HA 1 33 LEU QD 2.955 . 4.110 3.412 3.253 3.565 . 0 0 "[ . 1]" 1
303 1 21 ASP HA 1 33 LEU MD2 3.645 . 5.490 4.711 3.276 5.443 . 0 0 "[ . 1]" 1
304 1 21 ASP HA 1 35 THR H 3.320 . 4.840 4.534 4.367 4.608 . 0 0 "[ . 1]" 1
305 1 21 ASP HA 1 35 THR HA 2.500 . 3.200 2.199 2.150 2.264 . 0 0 "[ . 1]" 1
306 1 21 ASP HA 1 35 THR HB 3.525 . 5.250 5.015 4.932 5.103 . 0 0 "[ . 1]" 1
307 1 21 ASP HA 1 35 THR MG 2.750 . 3.700 3.379 3.230 3.482 . 0 0 "[ . 1]" 1
308 1 21 ASP HA 1 36 ILE H 2.925 . 4.050 3.584 3.497 3.733 . 0 0 "[ . 1]" 1
309 1 21 ASP HA 1 64 LEU MD1 3.295 . 4.790 4.149 4.029 4.282 . 0 0 "[ . 1]" 1
310 1 21 ASP HA 1 64 LEU MD2 3.580 . 5.360 4.934 4.653 5.095 . 0 0 "[ . 1]" 1
311 1 21 ASP HB2 1 33 LEU MD1 3.130 . 4.460 3.615 3.126 4.500 0.040 5 0 "[ . 1]" 1
312 1 21 ASP HB2 1 33 LEU QD 2.615 . 3.430 3.132 2.945 3.279 . 0 0 "[ . 1]" 1
313 1 21 ASP HB2 1 33 LEU MD2 3.130 . 4.460 3.884 3.115 4.411 . 0 0 "[ . 1]" 1
314 1 21 ASP HB2 1 35 THR HA 3.650 . 5.500 4.983 4.884 5.084 . 0 0 "[ . 1]" 1
315 1 21 ASP HB2 1 64 LEU MD1 2.750 . 3.700 2.329 2.095 2.479 . 0 0 "[ . 1]" 1
316 1 21 ASP HB2 1 64 LEU MD2 3.055 . 4.310 4.220 4.069 4.329 0.019 10 0 "[ . 1]" 1
317 1 21 ASP HB3 1 22 VAL H 2.725 . 3.650 3.144 2.984 3.265 . 0 0 "[ . 1]" 1
318 1 21 ASP HB3 1 33 LEU MD1 3.080 . 4.360 2.543 2.006 3.682 . 0 0 "[ . 1]" 1
319 1 21 ASP HB3 1 33 LEU QD 2.650 . 3.500 2.010 1.922 2.085 . 0 0 "[ . 1]" 1
320 1 21 ASP HB3 1 33 LEU MD2 3.080 . 4.360 2.887 1.928 3.451 . 0 0 "[ . 1]" 1
321 1 21 ASP HB3 1 35 THR HA 3.380 . 4.960 4.299 4.215 4.402 . 0 0 "[ . 1]" 1
322 1 21 ASP HB3 1 64 LEU MD1 2.845 . 3.890 2.452 2.323 2.633 . 0 0 "[ . 1]" 1
323 1 21 ASP HB3 1 64 LEU MD2 2.885 . 3.970 3.852 3.686 3.999 0.029 4 0 "[ . 1]" 1
324 1 22 VAL H 1 22 VAL HB 3.005 . 4.210 3.820 3.799 3.843 . 0 0 "[ . 1]" 1
325 1 22 VAL H 1 22 VAL MG2 2.515 . 3.230 2.188 2.154 2.227 . 0 0 "[ . 1]" 1
326 1 22 VAL H 1 23 PHE H 3.170 . 4.540 4.361 4.345 4.392 . 0 0 "[ . 1]" 1
327 1 22 VAL H 1 35 THR HA 3.125 . 4.450 3.457 3.355 3.569 . 0 0 "[ . 1]" 1
328 1 22 VAL H 1 64 LEU HG 3.440 . 5.080 4.565 4.453 4.791 . 0 0 "[ . 1]" 1
329 1 22 VAL HA 1 22 VAL HB 2.305 . 2.810 2.621 2.609 2.636 . 0 0 "[ . 1]" 1
330 1 22 VAL HA 1 22 VAL MG1 2.300 . 2.800 2.271 2.252 2.299 . 0 0 "[ . 1]" 1
331 1 22 VAL HA 1 22 VAL MG2 2.515 . 3.230 3.169 3.163 3.173 . 0 0 "[ . 1]" 1
332 1 22 VAL HA 1 33 LEU MD1 3.510 . 5.220 3.725 2.996 5.231 0.011 5 0 "[ . 1]" 1
333 1 22 VAL HA 1 33 LEU QD 2.800 . 3.800 3.273 2.977 3.747 . 0 0 "[ . 1]" 1
334 1 22 VAL HA 1 33 LEU MD2 3.510 . 5.220 4.779 3.580 5.255 0.035 3 0 "[ . 1]" 1
335 1 22 VAL HA 1 36 ILE MD 3.650 . 5.500 5.392 5.211 5.482 . 0 0 "[ . 1]" 1
336 1 22 VAL HA 1 64 LEU HA 3.620 . 5.440 4.790 4.666 4.891 . 0 0 "[ . 1]" 1
337 1 22 VAL HA 1 64 LEU HB2 3.650 . 5.500 4.978 4.776 5.076 . 0 0 "[ . 1]" 1
338 1 22 VAL HA 1 64 LEU HB3 3.650 . 5.500 5.326 5.190 5.453 . 0 0 "[ . 1]" 1
339 1 22 VAL HA 1 64 LEU MD1 2.720 . 3.640 3.562 3.376 3.660 0.020 8 0 "[ . 1]" 1
340 1 22 VAL HA 1 64 LEU MD2 2.570 . 3.340 2.349 2.122 2.556 . 0 0 "[ . 1]" 1
341 1 22 VAL HA 1 64 LEU HG 2.640 . 3.480 2.687 2.469 2.824 . 0 0 "[ . 1]" 1
342 1 22 VAL HB 1 23 PHE H 2.420 . 3.040 2.663 2.461 2.797 . 0 0 "[ . 1]" 1
343 1 22 VAL HB 1 23 PHE HA 3.315 . 4.830 4.535 4.468 4.613 . 0 0 "[ . 1]" 1
344 1 22 VAL HB 1 24 ILE MD 3.035 . 4.270 3.034 2.966 3.084 . 0 0 "[ . 1]" 1
345 1 22 VAL HB 1 36 ILE HG13 3.650 . 5.500 5.122 5.036 5.228 . 0 0 "[ . 1]" 1
346 1 22 VAL HB 1 61 LEU HA 3.305 . 4.810 3.535 3.467 3.630 . 0 0 "[ . 1]" 1
347 1 22 VAL HB 1 61 LEU HB2 3.245 . 4.690 4.740 4.715 4.757 0.067 7 0 "[ . 1]" 1
348 1 22 VAL HB 1 61 LEU HB3 3.040 . 4.280 3.026 2.997 3.046 . 0 0 "[ . 1]" 1
349 1 22 VAL HB 1 61 LEU MD1 3.365 . 4.930 4.921 4.892 4.944 0.014 7 0 "[ . 1]" 1
350 1 22 VAL HB 1 61 LEU MD2 2.905 . 4.010 2.613 2.536 2.660 . 0 0 "[ . 1]" 1
351 1 22 VAL HB 1 61 LEU HG 3.385 . 4.970 4.790 4.735 4.849 . 0 0 "[ . 1]" 1
352 1 22 VAL HB 1 62 ARG H 2.775 . 3.750 2.770 2.537 2.903 . 0 0 "[ . 1]" 1
353 1 22 VAL HB 1 62 ARG HB2 3.355 . 4.910 4.834 4.643 4.923 0.013 1 0 "[ . 1]" 1
354 1 22 VAL HB 1 63 LYS HA 3.285 . 4.770 4.094 3.853 4.309 . 0 0 "[ . 1]" 1
355 1 22 VAL HB 1 64 LEU H 3.610 . 5.420 5.363 5.212 5.451 0.031 8 0 "[ . 1]" 1
356 1 22 VAL MG1 1 23 PHE H 2.975 . 4.150 3.500 3.448 3.566 . 0 0 "[ . 1]" 1
357 1 22 VAL MG1 1 35 THR HA 3.565 . 5.330 5.022 4.870 5.163 . 0 0 "[ . 1]" 1
358 1 22 VAL MG1 1 36 ILE MD 2.245 . 2.690 2.567 2.443 2.682 . 0 0 "[ . 1]" 1
359 1 22 VAL MG1 1 36 ILE HG12 3.215 . 4.630 4.183 4.081 4.298 . 0 0 "[ . 1]" 1
360 1 22 VAL MG1 1 36 ILE HG13 2.745 . 3.690 3.484 3.395 3.602 . 0 0 "[ . 1]" 1
361 1 22 VAL MG1 1 46 ILE MD 3.130 . 4.460 4.308 4.243 4.390 . 0 0 "[ . 1]" 1
362 1 22 VAL MG1 1 46 ILE MG 3.320 . 4.840 4.898 4.864 4.932 0.092 4 0 "[ . 1]" 1
363 1 22 VAL MG1 1 61 LEU HA 3.240 . 4.680 4.665 4.612 4.723 0.043 6 0 "[ . 1]" 1
364 1 22 VAL MG1 1 61 LEU HB2 3.285 . 4.770 4.661 4.579 4.739 . 0 0 "[ . 1]" 1
365 1 22 VAL MG1 1 61 LEU HB3 3.045 . 4.290 3.275 3.203 3.334 . 0 0 "[ . 1]" 1
366 1 22 VAL MG1 1 61 LEU MD1 3.140 . 4.480 4.493 4.445 4.532 0.052 1 0 "[ . 1]" 1
367 1 22 VAL MG1 1 61 LEU MD2 2.670 . 3.540 2.988 2.927 3.051 . 0 0 "[ . 1]" 1
368 1 22 VAL MG1 1 61 LEU HG 3.650 . 5.500 5.312 5.267 5.383 . 0 0 "[ . 1]" 1
369 1 22 VAL MG1 1 63 LYS H 3.370 . 4.940 4.169 3.875 4.418 . 0 0 "[ . 1]" 1
370 1 22 VAL MG1 1 63 LYS HA 2.810 . 3.820 2.187 2.005 2.428 . 0 0 "[ . 1]" 1
371 1 22 VAL MG1 1 63 LYS HB2 3.585 . 5.370 4.804 4.616 5.013 . 0 0 "[ . 1]" 1
372 1 22 VAL MG1 1 63 LYS HD2 3.475 . 5.150 3.946 3.481 4.073 . 0 0 "[ . 1]" 1
373 1 22 VAL MG1 1 63 LYS HD3 3.580 . 5.360 5.181 4.817 5.370 0.010 9 0 "[ . 1]" 1
374 1 22 VAL MG1 1 64 LEU H 3.095 . 4.390 3.294 3.086 3.509 . 0 0 "[ . 1]" 1
375 1 22 VAL MG1 1 64 LEU MD2 2.745 . 3.690 3.688 3.567 3.753 0.063 1 0 "[ . 1]" 1
376 1 22 VAL MG2 1 23 PHE H 2.945 . 4.090 3.797 3.639 3.880 . 0 0 "[ . 1]" 1
377 1 22 VAL MG2 1 23 PHE HA 3.160 . 4.520 4.305 4.201 4.372 . 0 0 "[ . 1]" 1
378 1 22 VAL MG2 1 24 ILE HA 3.470 . 5.140 4.897 4.851 4.997 . 0 0 "[ . 1]" 1
379 1 22 VAL MG2 1 24 ILE HB 3.490 . 5.180 4.940 4.880 5.006 . 0 0 "[ . 1]" 1
380 1 22 VAL MG2 1 24 ILE MD 2.360 . 2.920 1.945 1.914 1.994 . 0 0 "[ . 1]" 1
381 1 22 VAL MG2 1 24 ILE HG12 3.025 . 4.250 4.141 4.101 4.214 . 0 0 "[ . 1]" 1
382 1 22 VAL MG2 1 24 ILE HG13 3.050 . 4.300 4.035 3.995 4.080 . 0 0 "[ . 1]" 1
383 1 22 VAL MG2 1 34 GLY H 3.180 . 4.560 3.483 3.374 3.566 . 0 0 "[ . 1]" 1
384 1 22 VAL MG2 1 34 GLY HA2 3.260 . 4.720 4.358 4.211 4.466 . 0 0 "[ . 1]" 1
385 1 22 VAL MG2 1 34 GLY HA3 3.580 . 5.360 5.164 5.045 5.276 . 0 0 "[ . 1]" 1
386 1 22 VAL MG2 1 35 THR H 3.585 . 5.370 4.922 4.773 5.057 . 0 0 "[ . 1]" 1
387 1 22 VAL MG2 1 35 THR HA 2.910 . 4.020 3.624 3.445 3.817 . 0 0 "[ . 1]" 1
388 1 22 VAL MG2 1 36 ILE H 2.680 . 3.560 3.366 3.282 3.425 . 0 0 "[ . 1]" 1
389 1 22 VAL MG2 1 36 ILE HA 3.160 . 4.520 4.308 4.227 4.381 . 0 0 "[ . 1]" 1
390 1 22 VAL MG2 1 36 ILE HB 3.335 . 4.870 4.396 4.334 4.434 . 0 0 "[ . 1]" 1
391 1 22 VAL MG2 1 36 ILE HG12 2.365 . 2.930 2.639 2.535 2.764 . 0 0 "[ . 1]" 1
392 1 22 VAL MG2 1 36 ILE HG13 2.595 . 3.390 2.331 2.267 2.375 . 0 0 "[ . 1]" 1
393 1 22 VAL MG2 1 44 TYR QD 3.650 . 5.500 5.371 5.240 5.451 . 0 0 "[ . 1]" 1
394 1 22 VAL MG2 1 46 ILE HA 3.285 . 4.770 4.771 4.733 4.816 0.046 4 0 "[ . 1]" 1
395 1 22 VAL MG2 1 46 ILE HG13 3.430 . 5.060 3.700 3.560 3.820 . 0 0 "[ . 1]" 1
396 1 22 VAL MG2 1 46 ILE MG 2.575 . 3.350 2.761 2.732 2.792 . 0 0 "[ . 1]" 1
397 1 22 VAL MG2 1 61 LEU HA 3.120 . 4.440 4.000 3.912 4.112 . 0 0 "[ . 1]" 1
398 1 22 VAL MG2 1 61 LEU HB2 3.245 . 4.690 4.601 4.527 4.694 0.004 6 0 "[ . 1]" 1
399 1 22 VAL MG2 1 61 LEU HB3 2.880 . 3.960 3.242 3.161 3.358 . 0 0 "[ . 1]" 1
400 1 22 VAL MG2 1 61 LEU MD2 2.385 . 2.970 1.828 1.805 1.871 . 0 0 "[ . 1]" 1
401 1 22 VAL MG2 1 61 LEU HG 3.040 . 4.280 4.050 4.023 4.098 . 0 0 "[ . 1]" 1
402 1 22 VAL MG2 1 62 ARG H 3.050 . 4.300 4.122 3.950 4.199 . 0 0 "[ . 1]" 1
403 1 22 VAL MG2 1 63 LYS HA 3.615 . 5.430 4.932 4.798 5.147 . 0 0 "[ . 1]" 1
404 1 23 PHE H 1 23 PHE HB2 2.580 . 3.360 2.368 2.319 2.434 . 0 0 "[ . 1]" 1
405 1 23 PHE H 1 23 PHE HB3 2.735 . 3.670 3.609 3.573 3.655 . 0 0 "[ . 1]" 1
406 1 23 PHE H 1 24 ILE H 3.215 . 4.630 4.526 4.487 4.553 . 0 0 "[ . 1]" 1
407 1 23 PHE H 1 62 ARG H 2.540 . 3.280 2.849 2.691 2.968 . 0 0 "[ . 1]" 1
408 1 23 PHE H 1 62 ARG HB3 3.335 . 4.870 4.639 4.314 4.807 . 0 0 "[ . 1]" 1
409 1 23 PHE H 1 64 LEU MD2 2.770 . 3.740 2.700 2.424 2.861 . 0 0 "[ . 1]" 1
410 1 23 PHE H 1 64 LEU HG 3.220 . 4.640 4.373 4.099 4.642 0.002 7 0 "[ . 1]" 1
411 1 23 PHE HA 1 23 PHE QD 2.460 . 3.120 2.589 2.377 2.720 . 0 0 "[ . 1]" 1
412 1 23 PHE HA 1 23 PHE QE 3.335 . 4.870 4.435 4.330 4.493 . 0 0 "[ . 1]" 1
413 1 23 PHE HA 1 24 ILE H 2.565 . 3.330 2.213 2.178 2.244 . 0 0 "[ . 1]" 1
414 1 23 PHE HA 1 24 ILE HA 3.460 . 5.120 4.438 4.410 4.462 . 0 0 "[ . 1]" 1
415 1 23 PHE HA 1 24 ILE HB 3.355 . 4.910 4.364 4.293 4.418 . 0 0 "[ . 1]" 1
416 1 23 PHE HA 1 24 ILE MD 2.795 . 3.790 3.150 3.107 3.205 . 0 0 "[ . 1]" 1
417 1 23 PHE HA 1 24 ILE MG 3.650 . 5.500 5.437 5.390 5.474 . 0 0 "[ . 1]" 1
418 1 23 PHE HA 1 31 PHE HB3 3.325 . 4.850 4.074 3.959 4.229 . 0 0 "[ . 1]" 1
419 1 23 PHE HA 1 31 PHE QD 2.995 . 4.190 3.669 3.573 3.736 . 0 0 "[ . 1]" 1
420 1 23 PHE HA 1 33 LEU HA 2.440 . 3.080 2.148 2.032 2.223 . 0 0 "[ . 1]" 1
421 1 23 PHE HA 1 33 LEU HB2 3.180 . 4.560 3.861 3.643 4.225 . 0 0 "[ . 1]" 1
422 1 23 PHE HA 1 33 LEU HB3 3.370 . 4.940 4.936 4.869 4.981 0.041 7 0 "[ . 1]" 1
423 1 23 PHE HA 1 33 LEU MD1 3.380 . 4.960 3.473 2.675 4.833 . 0 0 "[ . 1]" 1
424 1 23 PHE HA 1 33 LEU QD 2.930 . 4.060 3.126 2.663 3.749 . 0 0 "[ . 1]" 1
425 1 23 PHE HA 1 33 LEU MD2 3.380 . 4.960 4.524 3.710 4.885 . 0 0 "[ . 1]" 1
426 1 23 PHE HA 1 33 LEU HG 3.650 . 5.500 4.645 3.234 5.301 . 0 0 "[ . 1]" 1
427 1 23 PHE HA 1 34 GLY H 2.975 . 4.150 3.359 3.243 3.425 . 0 0 "[ . 1]" 1
428 1 23 PHE HA 1 64 LEU MD1 3.650 . 5.500 5.540 5.495 5.579 0.079 1 0 "[ . 1]" 1
429 1 23 PHE HA 1 64 LEU MD2 3.365 . 4.930 3.854 3.690 4.074 . 0 0 "[ . 1]" 1
430 1 23 PHE HB2 1 24 ILE H 3.130 . 4.460 4.162 4.137 4.188 . 0 0 "[ . 1]" 1
431 1 23 PHE HB2 1 31 PHE HB2 3.650 . 5.500 5.402 5.150 5.524 0.024 7 0 "[ . 1]" 1
432 1 23 PHE HB2 1 31 PHE HB3 3.065 . 4.330 4.073 3.825 4.245 . 0 0 "[ . 1]" 1
433 1 23 PHE HB2 1 31 PHE QD 2.790 . 3.780 3.356 3.271 3.461 . 0 0 "[ . 1]" 1
434 1 23 PHE HB2 1 31 PHE QE 3.380 . 4.960 3.818 3.601 3.954 . 0 0 "[ . 1]" 1
435 1 23 PHE HB2 1 62 ARG H 2.850 . 3.900 3.484 3.340 3.659 . 0 0 "[ . 1]" 1
436 1 23 PHE HB2 1 62 ARG HB2 2.720 . 3.640 2.284 2.011 2.446 . 0 0 "[ . 1]" 1
437 1 23 PHE HB2 1 62 ARG HB3 2.970 . 4.140 3.914 3.541 4.142 0.002 8 0 "[ . 1]" 1
438 1 23 PHE HB2 1 62 ARG HG2 3.035 . 4.270 3.919 3.663 4.140 . 0 0 "[ . 1]" 1
439 1 23 PHE HB2 1 62 ARG HG3 2.980 . 4.160 3.953 3.636 4.161 0.001 7 0 "[ . 1]" 1
440 1 23 PHE HB2 1 64 LEU MD2 3.110 . 4.420 3.529 3.248 3.710 . 0 0 "[ . 1]" 1
441 1 23 PHE HB3 1 24 ILE H 2.950 . 4.100 3.036 2.993 3.072 . 0 0 "[ . 1]" 1
442 1 23 PHE HB3 1 31 PHE HA 3.320 . 4.840 4.131 3.920 4.318 . 0 0 "[ . 1]" 1
443 1 23 PHE HB3 1 31 PHE HB2 2.975 . 4.150 3.921 3.711 4.062 . 0 0 "[ . 1]" 1
444 1 23 PHE HB3 1 31 PHE HB3 2.690 . 3.580 2.436 2.196 2.604 . 0 0 "[ . 1]" 1
445 1 23 PHE HB3 1 31 PHE QD 2.440 . 3.080 1.952 1.903 2.037 . 0 0 "[ . 1]" 1
446 1 23 PHE HB3 1 31 PHE QE 2.845 . 3.890 3.392 3.171 3.549 . 0 0 "[ . 1]" 1
447 1 23 PHE HB3 1 31 PHE HZ 3.640 . 5.480 5.125 4.858 5.349 . 0 0 "[ . 1]" 1
448 1 23 PHE HB3 1 62 ARG H 3.410 . 5.020 4.447 4.317 4.634 . 0 0 "[ . 1]" 1
449 1 23 PHE HB3 1 62 ARG HB2 2.885 . 3.970 3.649 3.366 3.851 . 0 0 "[ . 1]" 1
450 1 23 PHE HB3 1 62 ARG HG2 3.255 . 4.710 4.460 4.225 4.722 0.012 7 0 "[ . 1]" 1
451 1 23 PHE HB3 1 62 ARG HG3 3.240 . 4.680 4.553 4.245 4.707 0.027 7 0 "[ . 1]" 1
452 1 23 PHE QD 1 31 PHE HA 3.160 . 4.520 4.388 4.115 4.561 0.041 7 0 "[ . 1]" 1
453 1 23 PHE QD 1 31 PHE HB2 3.020 . 4.240 3.854 3.722 4.051 . 0 0 "[ . 1]" 1
454 1 23 PHE QD 1 31 PHE HB3 2.740 . 3.680 2.362 2.155 2.538 . 0 0 "[ . 1]" 1
455 1 23 PHE QD 1 31 PHE QD 2.865 . 3.930 3.612 3.429 3.739 . 0 0 "[ . 1]" 1
456 1 23 PHE QD 1 32 TYR HA 2.915 . 4.030 3.790 3.613 4.046 0.016 7 0 "[ . 1]" 1
457 1 23 PHE QD 1 33 LEU H 3.270 . 4.740 3.420 3.312 3.539 . 0 0 "[ . 1]" 1
458 1 23 PHE QD 1 33 LEU HA 2.670 . 3.540 3.070 2.773 3.216 . 0 0 "[ . 1]" 1
459 1 23 PHE QD 1 33 LEU HB2 2.940 . 4.080 2.993 2.793 3.194 . 0 0 "[ . 1]" 1
460 1 23 PHE QD 1 33 LEU HB3 3.490 . 5.180 4.398 4.212 4.615 . 0 0 "[ . 1]" 1
461 1 23 PHE QD 1 33 LEU MD1 3.160 . 4.520 3.519 3.081 4.032 . 0 0 "[ . 1]" 1
462 1 23 PHE QD 1 33 LEU QD 2.855 . 3.910 3.340 3.004 3.711 . 0 0 "[ . 1]" 1
463 1 23 PHE QD 1 33 LEU MD2 3.160 . 4.520 4.201 4.074 4.369 . 0 0 "[ . 1]" 1
464 1 23 PHE QD 1 33 LEU HG 3.650 . 5.500 4.823 3.317 5.507 0.007 8 0 "[ . 1]" 1
465 1 23 PHE QD 1 62 ARG HB2 3.070 . 4.340 3.486 3.359 3.650 . 0 0 "[ . 1]" 1
466 1 23 PHE QD 1 62 ARG HB3 3.250 . 4.700 4.462 4.036 4.725 0.025 10 0 "[ . 1]" 1
467 1 23 PHE QD 1 62 ARG HG2 3.650 . 5.500 5.491 5.326 5.582 0.082 7 0 "[ . 1]" 1
468 1 23 PHE QD 1 62 ARG HG3 3.650 . 5.500 5.142 4.958 5.364 . 0 0 "[ . 1]" 1
469 1 23 PHE QD 1 64 LEU HA 2.950 . 4.100 3.547 3.168 3.806 . 0 0 "[ . 1]" 1
470 1 23 PHE QD 1 64 LEU QB 3.570 . 5.340 4.623 4.296 4.885 . 0 0 "[ . 1]" 1
471 1 23 PHE QD 1 64 LEU MD1 3.130 . 4.460 4.517 4.485 4.586 0.126 7 0 "[ . 1]" 1
472 1 23 PHE QD 1 64 LEU MD2 2.880 . 3.960 2.270 2.224 2.446 . 0 0 "[ . 1]" 1
473 1 23 PHE QE 1 31 PHE HB3 3.175 . 4.550 4.047 3.721 4.294 . 0 0 "[ . 1]" 1
474 1 23 PHE QE 1 33 LEU HA 3.340 . 4.880 4.156 3.898 4.306 . 0 0 "[ . 1]" 1
475 1 23 PHE QE 1 33 LEU HB2 2.890 . 3.980 2.389 2.150 2.540 . 0 0 "[ . 1]" 1
476 1 23 PHE QE 1 33 LEU HB3 2.935 . 4.070 3.770 3.592 4.072 0.002 4 0 "[ . 1]" 1
477 1 23 PHE QE 1 33 LEU MD1 2.985 . 4.170 3.301 2.559 3.668 . 0 0 "[ . 1]" 1
478 1 23 PHE QE 1 33 LEU QD 2.715 . 3.630 2.912 2.541 3.083 . 0 0 "[ . 1]" 1
479 1 23 PHE QE 1 33 LEU MD2 2.985 . 4.170 3.566 3.147 4.327 0.157 7 0 "[ . 1]" 1
480 1 23 PHE QE 1 33 LEU HG 3.645 . 5.490 4.615 3.259 5.249 . 0 0 "[ . 1]" 1
481 1 23 PHE QE 1 64 LEU HA 2.895 . 3.990 3.833 3.116 4.015 0.025 4 0 "[ . 1]" 1
482 1 23 PHE QE 1 64 LEU MD1 3.200 . 4.600 4.008 3.877 4.176 . 0 0 "[ . 1]" 1
483 1 23 PHE QE 1 64 LEU MD2 2.900 . 4.000 2.358 2.218 2.656 . 0 0 "[ . 1]" 1
484 1 23 PHE HZ 1 33 LEU HB2 3.150 . 4.500 3.735 3.487 4.027 . 0 0 "[ . 1]" 1
485 1 23 PHE HZ 1 33 LEU MD1 3.450 . 5.100 3.600 2.406 4.240 . 0 0 "[ . 1]" 1
486 1 23 PHE HZ 1 33 LEU QD 2.990 . 4.180 2.834 2.401 3.146 . 0 0 "[ . 1]" 1
487 1 23 PHE HZ 1 33 LEU MD2 3.450 . 5.100 3.629 2.943 5.000 . 0 0 "[ . 1]" 1
488 1 23 PHE HZ 1 64 LEU MD1 3.430 . 5.060 4.844 4.303 5.026 . 0 0 "[ . 1]" 1
489 1 23 PHE HZ 1 64 LEU MD2 3.105 . 4.410 3.799 3.461 3.932 . 0 0 "[ . 1]" 1
490 1 24 ILE H 1 24 ILE HB 2.870 . 3.940 2.525 2.500 2.573 . 0 0 "[ . 1]" 1
491 1 24 ILE H 1 24 ILE MD 2.990 . 4.180 2.752 2.708 2.794 . 0 0 "[ . 1]" 1
492 1 24 ILE H 1 24 ILE HG13 3.145 . 4.490 4.334 4.292 4.378 . 0 0 "[ . 1]" 1
493 1 24 ILE H 1 24 ILE MG 2.995 . 4.190 3.717 3.693 3.754 . 0 0 "[ . 1]" 1
494 1 24 ILE H 1 31 PHE HB3 3.280 . 4.760 3.727 3.570 3.871 . 0 0 "[ . 1]" 1
495 1 24 ILE H 1 32 TYR H 3.105 . 4.410 2.505 2.385 2.618 . 0 0 "[ . 1]" 1
496 1 24 ILE H 1 33 LEU HA 3.465 . 5.130 3.392 3.260 3.516 . 0 0 "[ . 1]" 1
497 1 24 ILE H 1 34 GLY H 3.185 . 4.570 4.276 4.100 4.383 . 0 0 "[ . 1]" 1
498 1 24 ILE HA 1 24 ILE MD 2.515 . 3.230 2.536 2.469 2.612 . 0 0 "[ . 1]" 1
499 1 24 ILE HA 1 24 ILE HG12 2.760 . 3.720 3.696 3.678 3.708 . 0 0 "[ . 1]" 1
500 1 24 ILE HA 1 24 ILE HG13 2.815 . 3.830 2.503 2.464 2.519 . 0 0 "[ . 1]" 1
501 1 24 ILE HA 1 24 ILE MG 2.395 . 2.990 2.650 2.620 2.671 . 0 0 "[ . 1]" 1
502 1 24 ILE HA 1 25 LYS H 2.355 . 2.910 2.011 1.954 2.059 . 0 0 "[ . 1]" 1
503 1 24 ILE HA 1 25 LYS HA 3.475 . 5.150 4.323 4.288 4.339 . 0 0 "[ . 1]" 1
504 1 24 ILE HA 1 25 LYS HB2 3.465 . 5.130 4.541 4.335 4.639 . 0 0 "[ . 1]" 1
505 1 24 ILE HA 1 25 LYS HB3 3.650 . 5.500 4.255 4.123 4.382 . 0 0 "[ . 1]" 1
506 1 24 ILE HA 1 31 PHE QD 3.020 . 4.240 3.280 3.192 3.354 . 0 0 "[ . 1]" 1
507 1 24 ILE HA 1 31 PHE QE 2.955 . 4.110 3.288 3.169 3.393 . 0 0 "[ . 1]" 1
508 1 24 ILE HA 1 46 ILE MG 3.605 . 5.410 5.213 5.159 5.291 . 0 0 "[ . 1]" 1
509 1 24 ILE HA 1 48 PHE QE 3.470 . 5.140 4.927 4.747 5.141 0.001 4 0 "[ . 1]" 1
510 1 24 ILE HA 1 48 PHE HZ 3.550 . 5.300 5.307 5.219 5.350 0.050 9 0 "[ . 1]" 1
511 1 24 ILE HA 1 60 LYS HB3 3.445 . 5.090 3.292 3.046 3.426 . 0 0 "[ . 1]" 1
512 1 24 ILE HA 1 60 LYS QD 3.650 . 5.500 4.922 4.719 5.073 . 0 0 "[ . 1]" 1
513 1 24 ILE HA 1 61 LEU MD2 3.005 . 4.210 3.967 3.870 4.035 . 0 0 "[ . 1]" 1
514 1 24 ILE HB 1 24 ILE MD 2.475 . 3.150 2.407 2.358 2.439 . 0 0 "[ . 1]" 1
515 1 24 ILE HB 1 25 LYS H 3.310 . 4.820 4.277 4.233 4.328 . 0 0 "[ . 1]" 1
516 1 24 ILE HB 1 32 TYR H 3.345 . 4.890 3.413 3.301 3.513 . 0 0 "[ . 1]" 1
517 1 24 ILE HB 1 32 TYR HB2 2.760 . 3.720 2.992 2.799 3.217 . 0 0 "[ . 1]" 1
518 1 24 ILE HB 1 32 TYR HB3 3.135 . 4.470 4.360 4.180 4.495 0.025 1 0 "[ . 1]" 1
519 1 24 ILE HB 1 46 ILE HB 3.335 . 4.870 4.761 4.684 4.822 . 0 0 "[ . 1]" 1
520 1 24 ILE HB 1 46 ILE MG 3.030 . 4.260 3.652 3.589 3.714 . 0 0 "[ . 1]" 1
521 1 24 ILE HB 1 48 PHE QD 3.180 . 4.560 4.316 4.065 4.563 0.003 4 0 "[ . 1]" 1
522 1 24 ILE HB 1 48 PHE QE 2.400 . 3.000 2.010 1.822 2.237 . 0 0 "[ . 1]" 1
523 1 24 ILE HB 1 48 PHE HZ 2.710 . 3.620 2.776 2.612 2.886 . 0 0 "[ . 1]" 1
524 1 24 ILE HB 1 61 LEU HA 3.650 . 5.500 5.259 5.198 5.294 . 0 0 "[ . 1]" 1
525 1 24 ILE HB 1 61 LEU MD2 3.335 . 4.870 4.724 4.676 4.785 . 0 0 "[ . 1]" 1
526 1 24 ILE MD 1 24 ILE MG 2.610 . 3.420 3.229 3.223 3.239 . 0 0 "[ . 1]" 1
527 1 24 ILE MD 1 31 PHE QD 3.140 . 4.480 4.384 4.314 4.441 . 0 0 "[ . 1]" 1
528 1 24 ILE MD 1 31 PHE QE 3.235 . 4.670 4.789 4.760 4.807 0.137 4 0 "[ . 1]" 1
529 1 24 ILE MD 1 32 TYR HB2 3.550 . 5.300 4.540 4.330 4.796 . 0 0 "[ . 1]" 1
530 1 24 ILE MD 1 32 TYR HB3 3.650 . 5.500 5.267 5.029 5.447 . 0 0 "[ . 1]" 1
531 1 24 ILE MD 1 33 LEU HA 3.070 . 4.340 3.752 3.646 3.883 . 0 0 "[ . 1]" 1
532 1 24 ILE MD 1 34 GLY HA2 2.900 . 4.000 3.489 3.316 3.640 . 0 0 "[ . 1]" 1
533 1 24 ILE MD 1 46 ILE HA 3.365 . 4.930 4.672 4.638 4.698 . 0 0 "[ . 1]" 1
534 1 24 ILE MD 1 46 ILE HB 2.850 . 3.900 3.639 3.587 3.687 . 0 0 "[ . 1]" 1
535 1 24 ILE MD 1 46 ILE HG12 2.945 . 4.090 3.789 3.675 3.867 . 0 0 "[ . 1]" 1
536 1 24 ILE MD 1 46 ILE HG13 2.660 . 3.520 2.254 2.128 2.344 . 0 0 "[ . 1]" 1
537 1 24 ILE MD 1 46 ILE MG 2.385 . 2.970 1.957 1.918 1.979 . 0 0 "[ . 1]" 1
538 1 24 ILE MD 1 48 PHE QE 2.870 . 3.940 3.054 2.818 3.346 . 0 0 "[ . 1]" 1
539 1 24 ILE MD 1 48 PHE HZ 2.975 . 4.150 3.735 3.679 3.831 . 0 0 "[ . 1]" 1
540 1 24 ILE MD 1 56 CYS HB2 3.320 . 4.840 4.135 4.063 4.215 . 0 0 "[ . 1]" 1
541 1 24 ILE MD 1 56 CYS HB3 3.525 . 5.250 4.658 4.531 4.792 . 0 0 "[ . 1]" 1
542 1 24 ILE MD 1 60 LYS HB3 3.375 . 4.950 4.938 4.740 4.986 0.036 7 0 "[ . 1]" 1
543 1 24 ILE MD 1 61 LEU HA 2.805 . 3.810 2.799 2.743 2.847 . 0 0 "[ . 1]" 1
544 1 24 ILE MD 1 61 LEU HB2 3.240 . 4.680 4.696 4.684 4.718 0.038 9 0 "[ . 1]" 1
545 1 24 ILE MD 1 61 LEU HB3 3.320 . 4.840 3.733 3.698 3.782 . 0 0 "[ . 1]" 1
546 1 24 ILE MD 1 61 LEU MD1 2.870 . 3.940 3.862 3.826 3.881 . 0 0 "[ . 1]" 1
547 1 24 ILE MD 1 61 LEU MD2 2.710 . 3.620 1.838 1.819 1.854 . 0 0 "[ . 1]" 1
548 1 24 ILE MD 1 61 LEU HG 2.430 . 3.060 3.091 3.075 3.118 0.058 4 0 "[ . 1]" 1
549 1 24 ILE MD 1 62 ARG HG2 3.650 . 5.500 5.431 5.290 5.555 0.055 6 0 "[ . 1]" 1
550 1 24 ILE HG12 1 24 ILE MG 2.420 . 3.040 2.264 2.221 2.281 . 0 0 "[ . 1]" 1
551 1 24 ILE HG12 1 46 ILE HB 3.245 . 4.690 3.018 2.896 3.094 . 0 0 "[ . 1]" 1
552 1 24 ILE HG12 1 46 ILE MG 2.675 . 3.550 2.559 2.429 2.736 . 0 0 "[ . 1]" 1
553 1 24 ILE HG12 1 48 PHE QE 2.965 . 4.130 3.337 3.192 3.567 . 0 0 "[ . 1]" 1
554 1 24 ILE HG12 1 48 PHE HZ 2.920 . 4.040 2.610 2.542 2.757 . 0 0 "[ . 1]" 1
555 1 24 ILE HG12 1 61 LEU MD2 2.620 . 3.440 3.308 3.217 3.386 . 0 0 "[ . 1]" 1
556 1 24 ILE HG13 1 24 ILE MG 2.545 . 3.290 2.419 2.387 2.488 . 0 0 "[ . 1]" 1
557 1 24 ILE HG13 1 46 ILE HB 3.510 . 5.220 4.603 4.460 4.731 . 0 0 "[ . 1]" 1
558 1 24 ILE HG13 1 46 ILE HG12 3.075 . 4.350 4.239 4.097 4.353 0.003 9 0 "[ . 1]" 1
559 1 24 ILE HG13 1 46 ILE HG13 2.855 . 3.910 2.766 2.624 2.895 . 0 0 "[ . 1]" 1
560 1 24 ILE HG13 1 46 ILE MG 2.970 . 4.140 3.745 3.659 3.904 . 0 0 "[ . 1]" 1
561 1 24 ILE HG13 1 48 PHE QE 3.370 . 4.940 4.533 4.383 4.759 . 0 0 "[ . 1]" 1
562 1 24 ILE HG13 1 48 PHE HZ 3.020 . 4.240 4.111 4.044 4.224 . 0 0 "[ . 1]" 1
563 1 24 ILE HG13 1 61 LEU HA 3.510 . 5.220 3.316 3.214 3.386 . 0 0 "[ . 1]" 1
564 1 24 ILE HG13 1 61 LEU MD1 3.315 . 4.830 3.863 3.769 3.946 . 0 0 "[ . 1]" 1
565 1 24 ILE HG13 1 61 LEU MD2 2.855 . 3.910 2.691 2.644 2.770 . 0 0 "[ . 1]" 1
566 1 24 ILE MG 1 25 LYS H 2.700 . 3.600 2.827 2.715 2.957 . 0 0 "[ . 1]" 1
567 1 24 ILE MG 1 25 LYS HA 3.220 . 4.640 3.726 3.630 3.821 . 0 0 "[ . 1]" 1
568 1 24 ILE MG 1 25 LYS HB3 3.370 . 4.940 4.272 4.182 4.348 . 0 0 "[ . 1]" 1
569 1 24 ILE MG 1 26 CYS QB 3.570 . 5.340 3.695 3.425 4.080 . 0 0 "[ . 1]" 1
570 1 24 ILE MG 1 31 PHE QD 3.320 . 4.840 4.525 4.494 4.561 . 0 0 "[ . 1]" 1
571 1 24 ILE MG 1 31 PHE QE 3.445 . 5.090 4.952 4.869 5.063 . 0 0 "[ . 1]" 1
572 1 24 ILE MG 1 32 TYR HB2 2.780 . 3.760 3.433 3.406 3.469 . 0 0 "[ . 1]" 1
573 1 24 ILE MG 1 32 TYR HB3 3.310 . 4.820 4.847 4.829 4.869 0.049 9 0 "[ . 1]" 1
574 1 24 ILE MG 1 32 TYR QD 2.990 . 4.180 3.488 3.240 3.899 . 0 0 "[ . 1]" 1
575 1 24 ILE MG 1 46 ILE HB 3.650 . 5.500 4.106 3.945 4.193 . 0 0 "[ . 1]" 1
576 1 24 ILE MG 1 46 ILE HG12 3.295 . 4.790 4.581 4.467 4.645 . 0 0 "[ . 1]" 1
577 1 24 ILE MG 1 46 ILE HG13 2.920 . 4.040 3.761 3.673 3.818 . 0 0 "[ . 1]" 1
578 1 24 ILE MG 1 46 ILE MG 3.075 . 4.350 4.034 3.940 4.102 . 0 0 "[ . 1]" 1
579 1 24 ILE MG 1 48 PHE QD 3.340 . 4.880 4.788 4.593 4.890 0.010 4 0 "[ . 1]" 1
580 1 24 ILE MG 1 48 PHE QE 2.545 . 3.290 3.033 2.815 3.148 . 0 0 "[ . 1]" 1
581 1 24 ILE MG 1 48 PHE HZ 2.445 . 3.090 2.030 1.927 2.098 . 0 0 "[ . 1]" 1
582 1 24 ILE MG 1 56 CYS HB2 3.295 . 4.790 3.568 3.479 3.655 . 0 0 "[ . 1]" 1
583 1 24 ILE MG 1 56 CYS HB3 3.260 . 4.720 2.751 2.652 2.799 . 0 0 "[ . 1]" 1
584 1 24 ILE MG 1 60 LYS HA 3.480 . 5.160 4.624 4.416 4.757 . 0 0 "[ . 1]" 1
585 1 24 ILE MG 1 60 LYS HB3 2.650 . 3.500 2.511 2.259 2.705 . 0 0 "[ . 1]" 1
586 1 24 ILE MG 1 60 LYS QD 3.290 . 4.780 3.943 3.513 4.080 . 0 0 "[ . 1]" 1
587 1 24 ILE MG 1 60 LYS QE 3.650 . 5.500 4.884 4.622 5.004 . 0 0 "[ . 1]" 1
588 1 24 ILE MG 1 60 LYS HG2 3.650 . 5.500 4.866 4.580 5.198 . 0 0 "[ . 1]" 1
589 1 24 ILE MG 1 60 LYS HG3 3.265 . 4.730 3.785 3.436 4.167 . 0 0 "[ . 1]" 1
590 1 24 ILE MG 1 61 LEU MD2 3.190 . 4.580 4.269 4.223 4.321 . 0 0 "[ . 1]" 1
591 1 25 LYS H 1 25 LYS HB2 2.570 . 3.340 2.795 2.687 2.867 . 0 0 "[ . 1]" 1
592 1 25 LYS H 1 25 LYS HB3 2.615 . 3.430 2.286 2.221 2.362 . 0 0 "[ . 1]" 1
593 1 25 LYS H 1 26 CYS H 3.325 . 4.850 4.398 4.359 4.444 . 0 0 "[ . 1]" 1
594 1 25 LYS H 1 31 PHE QD 3.405 . 5.010 3.288 3.096 3.384 . 0 0 "[ . 1]" 1
595 1 25 LYS H 1 31 PHE QE 3.365 . 4.930 2.803 2.731 2.904 . 0 0 "[ . 1]" 1
596 1 25 LYS H 1 60 LYS HB2 3.475 . 5.150 3.884 3.728 4.245 . 0 0 "[ . 1]" 1
597 1 25 LYS H 1 60 LYS HB3 2.855 . 3.910 2.384 2.192 2.693 . 0 0 "[ . 1]" 1
598 1 25 LYS HA 1 25 LYS QD 2.965 . 4.130 4.033 3.978 4.062 . 0 0 "[ . 1]" 1
599 1 25 LYS HA 1 25 LYS HG2 2.720 . 3.640 3.179 3.098 3.255 . 0 0 "[ . 1]" 1
600 1 25 LYS HA 1 25 LYS HG3 2.620 . 3.440 2.697 2.651 2.734 . 0 0 "[ . 1]" 1
601 1 25 LYS HA 1 26 CYS H 2.470 . 3.140 2.075 2.020 2.120 . 0 0 "[ . 1]" 1
602 1 25 LYS HA 1 26 CYS QB 3.315 . 4.830 4.137 3.968 4.410 . 0 0 "[ . 1]" 1
603 1 25 LYS HA 1 31 PHE HA 2.370 . 2.940 2.350 2.260 2.428 . 0 0 "[ . 1]" 1
604 1 25 LYS HA 1 31 PHE HB3 3.275 . 4.750 4.613 4.491 4.740 . 0 0 "[ . 1]" 1
605 1 25 LYS HA 1 31 PHE QD 2.640 . 3.480 3.364 3.235 3.445 . 0 0 "[ . 1]" 1
606 1 25 LYS HA 1 31 PHE QE 2.900 . 4.000 3.975 3.869 4.030 0.030 1 0 "[ . 1]" 1
607 1 25 LYS HA 1 32 TYR H 3.100 . 4.400 3.714 3.587 3.854 . 0 0 "[ . 1]" 1
608 1 25 LYS HA 1 32 TYR QD 3.260 . 4.720 4.041 3.473 4.523 . 0 0 "[ . 1]" 1
609 1 25 LYS HA 1 60 LYS QE 3.650 . 5.500 5.562 5.510 5.619 0.119 4 0 "[ . 1]" 1
610 1 25 LYS HB2 1 25 LYS QD 2.465 . 3.130 2.452 2.392 2.483 . 0 0 "[ . 1]" 1
611 1 25 LYS HB2 1 25 LYS HE2 3.285 . 4.770 4.601 4.566 4.671 . 0 0 "[ . 1]" 1
612 1 25 LYS HB2 1 25 LYS HE3 3.285 . 4.770 4.350 4.301 4.396 . 0 0 "[ . 1]" 1
613 1 25 LYS HB2 1 26 CYS H 3.175 . 4.550 4.096 4.040 4.180 . 0 0 "[ . 1]" 1
614 1 25 LYS HB2 1 31 PHE HA 3.205 . 4.610 3.952 3.790 4.070 . 0 0 "[ . 1]" 1
615 1 25 LYS HB2 1 31 PHE QD 2.795 . 3.790 3.389 3.322 3.449 . 0 0 "[ . 1]" 1
616 1 25 LYS HB2 1 31 PHE QE 2.715 . 3.630 2.737 2.555 2.836 . 0 0 "[ . 1]" 1
617 1 25 LYS HB2 1 31 PHE HZ 2.870 . 3.940 2.832 2.742 2.937 . 0 0 "[ . 1]" 1
618 1 25 LYS HB2 1 60 LYS HA 3.235 . 4.670 3.898 3.566 4.266 . 0 0 "[ . 1]" 1
619 1 25 LYS HB2 1 60 LYS HB3 3.400 . 5.000 4.474 4.251 4.874 . 0 0 "[ . 1]" 1
620 1 25 LYS HB2 1 60 LYS QD 3.060 . 4.320 3.763 3.674 3.952 . 0 0 "[ . 1]" 1
621 1 25 LYS HB3 1 25 LYS QD 2.635 . 3.470 2.321 2.273 2.368 . 0 0 "[ . 1]" 1
622 1 25 LYS HB3 1 25 LYS QE 3.115 . 4.430 3.870 3.807 3.939 . 0 0 "[ . 1]" 1
623 1 25 LYS HB3 1 26 CYS HA 3.490 . 5.180 5.052 4.972 5.139 . 0 0 "[ . 1]" 1
624 1 25 LYS HB3 1 31 PHE HA 3.420 . 5.040 5.055 5.001 5.100 0.060 7 0 "[ . 1]" 1
625 1 25 LYS HB3 1 31 PHE QD 3.095 . 4.390 4.455 4.430 4.488 0.098 1 0 "[ . 1]" 1
626 1 25 LYS HB3 1 31 PHE QE 2.825 . 3.850 3.448 3.389 3.546 . 0 0 "[ . 1]" 1
627 1 25 LYS HB3 1 31 PHE HZ 3.150 . 4.500 3.822 3.612 3.969 . 0 0 "[ . 1]" 1
628 1 25 LYS HB3 1 60 LYS HA 2.885 . 3.970 2.481 2.112 2.945 . 0 0 "[ . 1]" 1
629 1 25 LYS QD 1 29 GLY H 3.535 . 5.270 5.023 4.642 5.183 . 0 0 "[ . 1]" 1
630 1 25 LYS QD 1 29 GLY HA2 3.465 . 5.130 5.071 4.867 5.181 0.051 10 0 "[ . 1]" 1
631 1 25 LYS QD 1 29 GLY HA3 3.050 . 4.300 3.662 3.426 3.806 . 0 0 "[ . 1]" 1
632 1 25 LYS QD 1 31 PHE QD 3.410 . 5.020 4.579 4.362 4.808 . 0 0 "[ . 1]" 1
633 1 25 LYS QD 1 31 PHE QE 2.835 . 3.870 3.366 3.088 3.589 . 0 0 "[ . 1]" 1
634 1 25 LYS QD 1 31 PHE HZ 2.825 . 3.850 3.291 3.061 3.404 . 0 0 "[ . 1]" 1
635 1 25 LYS QD 1 60 LYS HA 3.165 . 4.530 3.453 2.861 4.062 . 0 0 "[ . 1]" 1
636 1 25 LYS QD 1 60 LYS QD 2.955 . 4.110 2.665 2.375 2.959 . 0 0 "[ . 1]" 1
637 1 25 LYS QE 1 25 LYS HG2 2.710 . 3.620 2.279 2.234 2.346 . 0 0 "[ . 1]" 1
638 1 25 LYS QE 1 26 CYS HA 3.570 . 5.340 5.394 5.317 5.434 0.094 2 0 "[ . 1]" 1
639 1 25 LYS QE 1 27 ASN HA 3.095 . 4.390 3.708 3.221 3.933 . 0 0 "[ . 1]" 1
640 1 25 LYS QE 1 29 GLY HA2 3.195 . 4.590 3.402 3.160 3.676 . 0 0 "[ . 1]" 1
641 1 25 LYS QE 1 29 GLY HA3 2.790 . 3.780 2.049 1.910 2.280 . 0 0 "[ . 1]" 1
642 1 25 LYS QE 1 60 LYS QD 3.310 . 4.820 3.612 3.166 4.030 . 0 0 "[ . 1]" 1
643 1 25 LYS HE2 1 60 LYS QD 3.640 . 5.480 3.732 3.244 4.200 . 0 0 "[ . 1]" 1
644 1 25 LYS HE3 1 60 LYS QD 3.640 . 5.480 4.826 4.418 5.185 . 0 0 "[ . 1]" 1
645 1 25 LYS HG2 1 27 ASN HA 3.375 . 4.950 4.148 3.798 4.353 . 0 0 "[ . 1]" 1
646 1 25 LYS HG2 1 29 GLY HA3 3.195 . 4.590 3.417 3.079 3.774 . 0 0 "[ . 1]" 1
647 1 25 LYS HG2 1 31 PHE HA 3.650 . 5.500 5.444 5.267 5.506 0.006 8 0 "[ . 1]" 1
648 1 25 LYS HG2 1 31 PHE QE 3.580 . 5.360 5.106 4.979 5.165 . 0 0 "[ . 1]" 1
649 1 25 LYS HG2 1 31 PHE HZ 3.650 . 5.500 5.466 5.322 5.521 0.021 3 0 "[ . 1]" 1
650 1 25 LYS HG2 1 60 LYS HA 3.650 . 5.500 4.566 4.130 5.125 . 0 0 "[ . 1]" 1
651 1 25 LYS HG3 1 26 CYS H 3.125 . 4.450 3.208 3.033 3.430 . 0 0 "[ . 1]" 1
652 1 25 LYS HG3 1 27 ASN HA 3.650 . 5.500 5.377 4.943 5.520 0.020 9 0 "[ . 1]" 1
653 1 25 LYS HG3 1 31 PHE QD 3.405 . 5.010 4.429 4.221 4.599 . 0 0 "[ . 1]" 1
654 1 25 LYS HG3 1 31 PHE HZ 3.650 . 5.500 4.709 4.291 4.975 . 0 0 "[ . 1]" 1
655 1 25 LYS HG3 1 60 LYS QD 3.315 . 4.830 4.068 3.853 4.291 . 0 0 "[ . 1]" 1
656 1 26 CYS H 1 26 CYS QB 2.590 . 3.380 2.425 2.276 2.715 . 0 0 "[ . 1]" 1
657 1 26 CYS H 1 31 PHE HA 3.135 . 4.470 3.490 3.359 3.718 . 0 0 "[ . 1]" 1
658 1 26 CYS H 1 32 TYR H 3.590 . 5.380 4.479 4.302 4.646 . 0 0 "[ . 1]" 1
659 1 26 CYS H 1 32 TYR QD 3.085 . 4.370 3.440 3.144 3.719 . 0 0 "[ . 1]" 1
660 1 26 CYS HA 1 27 ASN QB 3.395 . 4.990 4.410 4.193 4.743 . 0 0 "[ . 1]" 1
661 1 26 CYS QB 1 27 ASN QB 3.180 . 4.560 4.403 3.820 4.627 0.067 3 0 "[ . 1]" 1
662 1 26 CYS QB 1 28 ASP H 2.850 . 3.900 2.901 2.711 3.149 . 0 0 "[ . 1]" 1
663 1 26 CYS QB 1 30 ARG QB 3.130 . 4.460 3.377 2.156 3.962 . 0 0 "[ . 1]" 1
664 1 26 CYS QB 1 32 TYR QD 2.545 . 3.290 3.005 2.676 3.300 0.010 7 0 "[ . 1]" 1
665 1 26 CYS QB 1 32 TYR QE 2.465 . 3.130 2.475 2.064 3.159 0.029 2 0 "[ . 1]" 1
666 1 26 CYS HB2 1 32 TYR QE 2.850 . 3.900 2.989 2.318 3.801 . 0 0 "[ . 1]" 1
667 1 26 CYS HB3 1 32 TYR QE 2.850 . 3.900 2.768 2.182 3.726 . 0 0 "[ . 1]" 1
668 1 27 ASN HA 1 27 ASN QB 2.275 . 2.750 2.389 2.335 2.446 . 0 0 "[ . 1]" 1
669 1 27 ASN HA 1 29 GLY H 2.885 . 3.970 3.597 3.492 3.777 . 0 0 "[ . 1]" 1
670 1 27 ASN QB 1 28 ASP HA 3.200 . 4.600 4.177 3.917 4.360 . 0 0 "[ . 1]" 1
671 1 27 ASN QB 1 28 ASP QB 3.165 . 4.530 4.231 3.932 4.575 0.045 4 0 "[ . 1]" 1
672 1 28 ASP H 1 28 ASP QB 2.560 . 3.320 2.383 2.228 2.671 . 0 0 "[ . 1]" 1
673 1 28 ASP H 1 29 GLY H 2.700 . 3.600 2.558 2.442 2.731 . 0 0 "[ . 1]" 1
674 1 28 ASP QB 1 29 GLY H 3.120 . 4.440 3.390 3.202 3.913 . 0 0 "[ . 1]" 1
675 1 29 GLY H 1 30 ARG H 2.565 . 3.330 2.440 2.289 2.587 . 0 0 "[ . 1]" 1
676 1 29 GLY HA2 1 30 ARG QD 3.650 . 5.500 3.873 3.318 4.621 . 0 0 "[ . 1]" 1
677 1 30 ARG H 1 30 ARG HB2 2.945 . 4.090 2.463 2.301 2.643 . 0 0 "[ . 1]" 1
678 1 30 ARG H 1 30 ARG QB 2.530 . 3.260 2.423 2.275 2.581 . 0 0 "[ . 1]" 1
679 1 30 ARG H 1 30 ARG HB3 2.945 . 4.090 3.622 3.564 3.673 . 0 0 "[ . 1]" 1
680 1 30 ARG H 1 30 ARG QD 3.145 . 4.490 2.811 2.382 3.525 . 0 0 "[ . 1]" 1
681 1 30 ARG H 1 30 ARG QG 2.890 . 3.980 3.101 2.088 3.740 . 0 0 "[ . 1]" 1
682 1 30 ARG HA 1 30 ARG QD 2.755 . 3.710 2.486 1.898 2.985 . 0 0 "[ . 1]" 1
683 1 30 ARG HA 1 30 ARG QG 2.455 . 3.110 2.692 2.369 3.132 0.022 7 0 "[ . 1]" 1
684 1 30 ARG HA 1 31 PHE H 2.365 . 2.930 2.210 2.155 2.280 . 0 0 "[ . 1]" 1
685 1 30 ARG HA 1 31 PHE HA 3.200 . 4.600 4.324 4.278 4.383 . 0 0 "[ . 1]" 1
686 1 30 ARG HA 1 31 PHE QD 3.240 . 4.680 4.273 3.944 4.558 . 0 0 "[ . 1]" 1
687 1 30 ARG HA 1 32 TYR QD 3.645 . 5.490 5.501 5.475 5.521 0.031 6 0 "[ . 1]" 1
688 1 30 ARG HA 1 32 TYR QE 3.480 . 5.160 4.997 4.738 5.189 0.029 7 0 "[ . 1]" 1
689 1 30 ARG QB 1 31 PHE H 2.610 . 3.420 2.782 2.466 3.213 . 0 0 "[ . 1]" 1
690 1 30 ARG QB 1 32 TYR QD 2.875 . 3.950 3.635 3.503 3.725 . 0 0 "[ . 1]" 1
691 1 30 ARG QB 1 32 TYR QE 2.375 . 2.950 2.421 2.185 2.641 . 0 0 "[ . 1]" 1
692 1 30 ARG HB2 1 30 ARG QD 2.580 . 3.360 2.757 2.297 3.324 . 0 0 "[ . 1]" 1
693 1 30 ARG HB2 1 31 PHE H 2.980 . 4.160 3.944 3.783 4.132 . 0 0 "[ . 1]" 1
694 1 30 ARG HB2 1 32 TYR QD 3.235 . 4.670 4.071 3.714 4.456 . 0 0 "[ . 1]" 1
695 1 30 ARG HB2 1 32 TYR QE 2.655 . 3.510 2.524 2.210 2.938 . 0 0 "[ . 1]" 1
696 1 30 ARG HB3 1 30 ARG QD 2.580 . 3.360 2.970 2.393 3.344 . 0 0 "[ . 1]" 1
697 1 30 ARG HB3 1 31 PHE H 2.980 . 4.160 2.849 2.499 3.366 . 0 0 "[ . 1]" 1
698 1 30 ARG HB3 1 32 TYR QD 3.235 . 4.670 4.183 3.923 4.582 . 0 0 "[ . 1]" 1
699 1 30 ARG HB3 1 32 TYR QE 2.655 . 3.510 3.300 2.992 3.525 0.015 10 0 "[ . 1]" 1
700 1 30 ARG QD 1 31 PHE H 3.325 . 4.850 4.299 3.657 4.795 . 0 0 "[ . 1]" 1
701 1 30 ARG QD 1 32 TYR QE 3.435 . 5.070 4.682 3.910 5.084 0.014 7 0 "[ . 1]" 1
702 1 30 ARG QG 1 32 TYR QD 3.625 . 5.450 5.293 5.117 5.479 0.029 2 0 "[ . 1]" 1
703 1 30 ARG QG 1 32 TYR QE 2.995 . 4.190 3.961 3.549 4.203 0.013 1 0 "[ . 1]" 1
704 1 31 PHE H 1 31 PHE HB2 2.460 . 3.120 2.365 2.314 2.429 . 0 0 "[ . 1]" 1
705 1 31 PHE H 1 31 PHE QD 2.880 . 3.960 3.411 3.249 3.533 . 0 0 "[ . 1]" 1
706 1 31 PHE H 1 32 TYR H 3.280 . 4.760 4.331 4.306 4.378 . 0 0 "[ . 1]" 1
707 1 31 PHE HA 1 31 PHE QD 2.570 . 3.340 2.686 2.593 2.845 . 0 0 "[ . 1]" 1
708 1 31 PHE HA 1 31 PHE QE 3.135 . 4.470 4.387 4.312 4.462 . 0 0 "[ . 1]" 1
709 1 31 PHE HA 1 32 TYR H 2.450 . 3.100 2.050 2.020 2.094 . 0 0 "[ . 1]" 1
710 1 31 PHE HA 1 32 TYR HB2 3.375 . 4.950 4.334 4.229 4.387 . 0 0 "[ . 1]" 1
711 1 31 PHE HA 1 32 TYR QD 2.810 . 3.820 3.321 3.100 3.458 . 0 0 "[ . 1]" 1
712 1 31 PHE HA 1 32 TYR QE 3.440 . 5.080 4.813 4.414 5.085 0.005 2 0 "[ . 1]" 1
713 1 31 PHE HB3 1 32 TYR H 2.915 . 4.030 3.181 3.089 3.240 . 0 0 "[ . 1]" 1
714 1 31 PHE HB3 1 32 TYR QD 3.560 . 5.320 5.282 5.189 5.336 0.016 6 0 "[ . 1]" 1
715 1 31 PHE HB3 1 33 LEU H 3.410 . 5.020 5.030 4.894 5.062 0.042 5 0 "[ . 1]" 1
716 1 31 PHE QD 1 32 TYR H 3.100 . 4.400 3.234 3.100 3.354 . 0 0 "[ . 1]" 1
717 1 31 PHE QD 1 32 TYR HA 3.625 . 5.450 5.447 5.381 5.484 0.034 5 0 "[ . 1]" 1
718 1 31 PHE QD 1 62 ARG HB2 3.550 . 5.300 4.491 4.280 4.647 . 0 0 "[ . 1]" 1
719 1 31 PHE QD 1 62 ARG HG3 3.215 . 4.630 4.478 4.232 4.655 0.025 7 0 "[ . 1]" 1
720 1 31 PHE QE 1 60 LYS HA 3.045 . 4.290 4.070 3.838 4.234 . 0 0 "[ . 1]" 1
721 1 31 PHE QE 1 61 LEU HA 3.515 . 5.230 3.884 3.726 4.055 . 0 0 "[ . 1]" 1
722 1 31 PHE QE 1 62 ARG HB2 3.260 . 4.720 3.656 3.302 3.902 . 0 0 "[ . 1]" 1
723 1 31 PHE QE 1 62 ARG HB3 3.650 . 5.500 4.747 4.573 4.880 . 0 0 "[ . 1]" 1
724 1 31 PHE QE 1 62 ARG HD2 3.650 . 5.500 4.554 3.889 5.039 . 0 0 "[ . 1]" 1
725 1 31 PHE QE 1 62 ARG QD 3.260 . 4.720 3.932 3.406 4.422 . 0 0 "[ . 1]" 1
726 1 31 PHE QE 1 62 ARG HD3 3.650 . 5.500 4.363 3.676 5.004 . 0 0 "[ . 1]" 1
727 1 31 PHE QE 1 62 ARG HG2 2.970 . 4.140 2.275 2.104 2.508 . 0 0 "[ . 1]" 1
728 1 31 PHE QE 1 62 ARG HG3 3.065 . 4.330 3.029 2.825 3.221 . 0 0 "[ . 1]" 1
729 1 31 PHE HZ 1 60 LYS HA 3.295 . 4.790 4.626 4.225 4.829 0.039 7 0 "[ . 1]" 1
730 1 31 PHE HZ 1 62 ARG HB3 3.650 . 5.500 5.173 4.819 5.505 0.005 1 0 "[ . 1]" 1
731 1 31 PHE HZ 1 62 ARG HD2 3.650 . 5.500 4.275 2.971 4.771 . 0 0 "[ . 1]" 1
732 1 31 PHE HZ 1 62 ARG QD 3.310 . 4.820 3.516 2.928 4.216 . 0 0 "[ . 1]" 1
733 1 31 PHE HZ 1 62 ARG HD3 3.650 . 5.500 4.044 2.995 4.991 . 0 0 "[ . 1]" 1
734 1 31 PHE HZ 1 62 ARG HG2 3.115 . 4.430 3.037 2.940 3.125 . 0 0 "[ . 1]" 1
735 1 31 PHE HZ 1 62 ARG HG3 3.160 . 4.520 2.750 2.376 3.141 . 0 0 "[ . 1]" 1
736 1 32 TYR H 1 32 TYR HB2 2.940 . 4.080 2.475 2.415 2.500 . 0 0 "[ . 1]" 1
737 1 32 TYR H 1 32 TYR HB3 2.940 . 4.080 3.670 3.643 3.686 . 0 0 "[ . 1]" 1
738 1 32 TYR H 1 32 TYR QD 2.955 . 4.110 2.636 2.411 2.824 . 0 0 "[ . 1]" 1
739 1 32 TYR HA 1 32 TYR QD 2.550 . 3.300 3.051 2.998 3.133 . 0 0 "[ . 1]" 1
740 1 32 TYR HA 1 32 TYR QE 3.250 . 4.700 4.696 4.621 4.745 0.045 7 0 "[ . 1]" 1
741 1 32 TYR HA 1 33 LEU HB2 3.410 . 5.020 4.467 4.221 4.611 . 0 0 "[ . 1]" 1
742 1 32 TYR HB2 1 33 LEU H 3.110 . 4.420 4.196 4.156 4.237 . 0 0 "[ . 1]" 1
743 1 32 TYR HB2 1 48 PHE QD 2.745 . 3.690 3.243 3.005 3.454 . 0 0 "[ . 1]" 1
744 1 32 TYR HB2 1 48 PHE QE 2.380 . 2.960 2.195 2.140 2.244 . 0 0 "[ . 1]" 1
745 1 32 TYR HB2 1 48 PHE HZ 3.425 . 5.050 3.922 3.745 4.153 . 0 0 "[ . 1]" 1
746 1 32 TYR HB3 1 33 LEU H 2.780 . 3.760 3.320 3.225 3.441 . 0 0 "[ . 1]" 1
747 1 32 TYR HB3 1 48 PHE QD 2.850 . 3.900 2.385 2.247 2.534 . 0 0 "[ . 1]" 1
748 1 32 TYR HB3 1 48 PHE QE 2.945 . 4.090 2.888 2.587 3.082 . 0 0 "[ . 1]" 1
749 1 32 TYR QD 1 48 PHE QE 2.940 . 4.080 4.109 4.071 4.133 0.053 2 0 "[ . 1]" 1
750 1 33 LEU H 1 33 LEU HB2 2.550 . 3.300 2.623 2.340 2.807 . 0 0 "[ . 1]" 1
751 1 33 LEU H 1 33 LEU HB3 2.735 . 3.670 2.541 2.406 2.834 . 0 0 "[ . 1]" 1
752 1 33 LEU H 1 33 LEU MD1 3.650 . 5.500 4.213 4.117 4.294 . 0 0 "[ . 1]" 1
753 1 33 LEU H 1 33 LEU QD 3.260 . 4.720 3.795 3.749 3.839 . 0 0 "[ . 1]" 1
754 1 33 LEU H 1 33 LEU MD2 3.650 . 5.500 4.312 4.274 4.349 . 0 0 "[ . 1]" 1
755 1 33 LEU H 1 48 PHE QD 3.365 . 4.930 4.077 3.908 4.336 . 0 0 "[ . 1]" 1
756 1 33 LEU HA 1 33 LEU MD1 2.895 . 3.990 2.625 2.057 3.820 . 0 0 "[ . 1]" 1
757 1 33 LEU HA 1 33 LEU QD 2.440 . 3.080 2.238 2.049 2.618 . 0 0 "[ . 1]" 1
758 1 33 LEU HA 1 33 LEU MD2 2.895 . 3.990 3.448 2.538 3.836 . 0 0 "[ . 1]" 1
759 1 33 LEU HA 1 33 LEU HG 2.700 . 3.600 3.109 2.506 3.418 . 0 0 "[ . 1]" 1
760 1 33 LEU HB2 1 33 LEU MD1 2.550 . 3.300 2.393 2.317 2.435 . 0 0 "[ . 1]" 1
761 1 33 LEU HB2 1 33 LEU QD 2.280 . 2.760 2.152 2.087 2.303 . 0 0 "[ . 1]" 1
762 1 33 LEU HB2 1 33 LEU MD2 2.550 . 3.300 2.571 2.285 3.214 . 0 0 "[ . 1]" 1
763 1 33 LEU HB3 1 33 LEU MD1 2.665 . 3.530 2.946 2.395 3.184 . 0 0 "[ . 1]" 1
764 1 33 LEU HB3 1 33 LEU QD 2.325 . 2.850 2.281 2.120 2.353 . 0 0 "[ . 1]" 1
765 1 33 LEU HB3 1 33 LEU MD2 2.665 . 3.530 2.408 2.363 2.429 . 0 0 "[ . 1]" 1
766 1 33 LEU HB3 1 34 GLY H 3.525 . 5.250 4.177 3.883 4.350 . 0 0 "[ . 1]" 1
767 1 33 LEU QD 1 34 GLY H 3.025 . 4.250 2.163 2.018 2.319 . 0 0 "[ . 1]" 1
768 1 33 LEU QD 1 34 GLY HA3 3.045 . 4.290 3.724 3.156 4.127 . 0 0 "[ . 1]" 1
769 1 33 LEU QD 1 64 LEU MD1 2.120 . 2.440 1.903 1.844 1.956 . 0 0 "[ . 1]" 1
770 1 33 LEU QD 1 64 LEU MD2 2.085 . 2.370 2.028 1.863 2.399 0.029 4 0 "[ . 1]" 1
771 1 33 LEU MD1 1 64 LEU MD1 2.325 . 2.850 2.065 1.892 2.478 . 0 0 "[ . 1]" 1
772 1 33 LEU MD1 1 64 LEU MD2 2.345 . 2.890 2.159 1.883 2.842 . 0 0 "[ . 1]" 1
773 1 33 LEU MD2 1 64 LEU MD1 2.325 . 2.850 2.450 2.000 2.691 . 0 0 "[ . 1]" 1
774 1 33 LEU MD2 1 64 LEU MD2 2.345 . 2.890 2.870 2.576 3.032 0.142 1 0 "[ . 1]" 1
775 1 33 LEU HG 1 34 GLY H 3.110 . 4.420 3.603 3.142 3.742 . 0 0 "[ . 1]" 1
776 1 33 LEU HG 1 34 GLY HA3 3.650 . 5.500 4.455 3.833 5.579 0.079 4 0 "[ . 1]" 1
777 1 34 GLY H 1 35 THR H 3.215 . 4.630 4.372 4.326 4.394 . 0 0 "[ . 1]" 1
778 1 34 GLY HA2 1 35 THR H 2.475 . 3.150 2.623 2.582 2.674 . 0 0 "[ . 1]" 1
779 1 34 GLY HA2 1 35 THR HA 3.380 . 4.960 4.520 4.486 4.559 . 0 0 "[ . 1]" 1
780 1 34 GLY HA2 1 35 THR HB 3.595 . 5.390 5.178 5.117 5.214 . 0 0 "[ . 1]" 1
781 1 34 GLY HA2 1 46 ILE MG 2.385 . 2.970 2.119 2.083 2.185 . 0 0 "[ . 1]" 1
782 1 34 GLY HA2 1 47 ARG H 3.155 . 4.510 4.291 4.120 4.464 . 0 0 "[ . 1]" 1
783 1 34 GLY HA2 1 48 PHE HA 2.805 . 3.810 2.607 2.186 2.906 . 0 0 "[ . 1]" 1
784 1 34 GLY HA3 1 35 THR H 2.440 . 3.080 2.455 2.391 2.521 . 0 0 "[ . 1]" 1
785 1 34 GLY HA3 1 35 THR HA 3.525 . 5.250 4.389 4.353 4.413 . 0 0 "[ . 1]" 1
786 1 34 GLY HA3 1 46 ILE MG 2.710 . 3.620 3.479 3.403 3.563 . 0 0 "[ . 1]" 1
787 1 34 GLY HA3 1 48 PHE HA 2.615 . 3.430 2.435 2.215 2.826 . 0 0 "[ . 1]" 1
788 1 34 GLY HA3 1 48 PHE HB3 3.525 . 5.250 4.376 4.184 4.721 . 0 0 "[ . 1]" 1
789 1 34 GLY HA3 1 48 PHE QD 3.140 . 4.480 3.665 3.232 3.993 . 0 0 "[ . 1]" 1
790 1 35 THR H 1 35 THR HB 2.590 . 3.380 2.563 2.502 2.593 . 0 0 "[ . 1]" 1
791 1 35 THR H 1 35 THR MG 3.095 . 4.390 3.791 3.762 3.819 . 0 0 "[ . 1]" 1
792 1 35 THR H 1 37 ILE MG 3.560 . 5.320 4.986 4.866 5.138 . 0 0 "[ . 1]" 1
793 1 35 THR H 1 46 ILE MG 2.680 . 3.560 2.883 2.763 2.971 . 0 0 "[ . 1]" 1
794 1 35 THR H 1 47 ARG H 2.535 . 3.270 3.106 2.957 3.243 . 0 0 "[ . 1]" 1
795 1 35 THR H 1 47 ARG HB3 3.020 . 4.240 3.593 3.276 3.838 . 0 0 "[ . 1]" 1
796 1 35 THR HA 1 35 THR MG 2.270 . 2.740 2.313 2.297 2.338 . 0 0 "[ . 1]" 1
797 1 35 THR HA 1 36 ILE H 2.350 . 2.900 2.224 2.196 2.253 . 0 0 "[ . 1]" 1
798 1 35 THR HA 1 36 ILE HA 3.175 . 4.550 4.446 4.414 4.485 . 0 0 "[ . 1]" 1
799 1 35 THR HA 1 36 ILE HB 3.595 . 5.390 4.890 4.860 4.935 . 0 0 "[ . 1]" 1
800 1 35 THR HA 1 36 ILE MD 3.580 . 5.360 5.067 4.960 5.187 . 0 0 "[ . 1]" 1
801 1 35 THR HA 1 36 ILE HG13 3.415 . 5.030 3.684 3.574 3.804 . 0 0 "[ . 1]" 1
802 1 35 THR HA 1 46 ILE MD 3.650 . 5.500 4.781 4.676 4.876 . 0 0 "[ . 1]" 1
803 1 35 THR HA 1 46 ILE MG 3.025 . 4.250 3.760 3.710 3.814 . 0 0 "[ . 1]" 1
804 1 35 THR HB 1 36 ILE H 3.065 . 4.330 4.074 4.021 4.112 . 0 0 "[ . 1]" 1
805 1 35 THR HB 1 37 ILE MD 3.320 . 4.840 4.471 4.366 4.555 . 0 0 "[ . 1]" 1
806 1 35 THR HB 1 37 ILE MG 2.835 . 3.870 3.710 3.583 3.854 . 0 0 "[ . 1]" 1
807 1 35 THR HB 1 47 ARG H 2.900 . 4.000 3.763 3.664 3.885 . 0 0 "[ . 1]" 1
808 1 35 THR HB 1 47 ARG HB2 3.375 . 4.950 4.676 4.375 4.932 . 0 0 "[ . 1]" 1
809 1 35 THR HB 1 47 ARG HB3 2.705 . 3.610 3.009 2.701 3.261 . 0 0 "[ . 1]" 1
810 1 35 THR HB 1 47 ARG HG2 3.300 . 4.800 4.433 4.008 4.660 . 0 0 "[ . 1]" 1
811 1 35 THR MG 1 36 ILE H 2.470 . 3.140 2.733 2.630 2.836 . 0 0 "[ . 1]" 1
812 1 35 THR MG 1 37 ILE HA 3.290 . 4.780 4.407 4.291 4.535 . 0 0 "[ . 1]" 1
813 1 36 ILE H 1 36 ILE HG13 2.775 . 3.750 1.993 1.927 2.047 . 0 0 "[ . 1]" 1
814 1 36 ILE HA 1 36 ILE MD 2.850 . 3.900 3.817 3.807 3.839 . 0 0 "[ . 1]" 1
815 1 36 ILE HA 1 36 ILE HG12 2.620 . 3.440 2.576 2.547 2.598 . 0 0 "[ . 1]" 1
816 1 36 ILE HA 1 36 ILE HG13 2.695 . 3.590 3.156 3.124 3.192 . 0 0 "[ . 1]" 1
817 1 36 ILE HA 1 36 ILE MG 2.290 . 2.780 2.316 2.307 2.329 . 0 0 "[ . 1]" 1
818 1 36 ILE HA 1 37 ILE H 2.580 . 3.360 2.157 2.124 2.184 . 0 0 "[ . 1]" 1
819 1 36 ILE HA 1 37 ILE MD 2.560 . 3.320 3.094 2.965 3.256 . 0 0 "[ . 1]" 1
820 1 36 ILE HA 1 37 ILE HG12 3.330 . 4.860 4.400 4.247 4.492 . 0 0 "[ . 1]" 1
821 1 36 ILE HA 1 37 ILE MG 3.110 . 4.420 4.040 3.899 4.171 . 0 0 "[ . 1]" 1
822 1 36 ILE HA 1 38 ASP H 2.840 . 3.880 3.853 3.802 3.894 0.014 6 0 "[ . 1]" 1
823 1 36 ILE HA 1 44 TYR HB3 3.430 . 5.060 4.450 4.339 4.547 . 0 0 "[ . 1]" 1
824 1 36 ILE HA 1 44 TYR QD 3.650 . 5.500 5.485 5.405 5.528 0.028 3 0 "[ . 1]" 1
825 1 36 ILE HA 1 46 ILE HA 2.430 . 3.060 2.200 2.129 2.266 . 0 0 "[ . 1]" 1
826 1 36 ILE HA 1 46 ILE HB 3.515 . 5.230 5.002 4.946 5.076 . 0 0 "[ . 1]" 1
827 1 36 ILE HA 1 46 ILE MD 2.495 . 3.190 2.259 2.219 2.348 . 0 0 "[ . 1]" 1
828 1 36 ILE HA 1 46 ILE HG12 3.325 . 4.850 4.608 4.560 4.664 . 0 0 "[ . 1]" 1
829 1 36 ILE HA 1 46 ILE MG 2.805 . 3.810 3.088 2.998 3.183 . 0 0 "[ . 1]" 1
830 1 36 ILE HA 1 47 ARG H 2.890 . 3.980 3.301 3.190 3.385 . 0 0 "[ . 1]" 1
831 1 36 ILE HA 1 61 LEU MD2 3.405 . 5.010 4.801 4.715 4.883 . 0 0 "[ . 1]" 1
832 1 36 ILE HB 1 36 ILE MD 2.520 . 3.240 2.447 2.417 2.466 . 0 0 "[ . 1]" 1
833 1 36 ILE HB 1 37 ILE H 3.395 . 4.990 4.038 3.959 4.110 . 0 0 "[ . 1]" 1
834 1 36 ILE HB 1 37 ILE HA 3.510 . 5.220 4.623 4.518 4.720 . 0 0 "[ . 1]" 1
835 1 36 ILE HB 1 38 ASP H 3.425 . 5.050 4.913 4.863 5.021 . 0 0 "[ . 1]" 1
836 1 36 ILE HB 1 46 ILE MD 3.570 . 5.340 3.976 3.956 4.007 . 0 0 "[ . 1]" 1
837 1 36 ILE MD 1 36 ILE MG 2.220 . 2.640 1.938 1.921 1.952 . 0 0 "[ . 1]" 1
838 1 36 ILE MD 1 44 TYR HB2 3.430 . 5.060 3.884 3.614 4.077 . 0 0 "[ . 1]" 1
839 1 36 ILE MD 1 44 TYR HB3 2.905 . 4.010 2.946 2.741 3.109 . 0 0 "[ . 1]" 1
840 1 36 ILE MD 1 44 TYR QD 2.525 . 3.250 2.901 2.842 2.943 . 0 0 "[ . 1]" 1
841 1 36 ILE MD 1 44 TYR QE 2.945 . 4.090 3.953 3.879 4.070 . 0 0 "[ . 1]" 1
842 1 36 ILE MD 1 46 ILE HA 3.455 . 5.110 5.103 5.042 5.127 0.017 2 0 "[ . 1]" 1
843 1 36 ILE MD 1 46 ILE MD 2.285 . 2.770 2.827 2.801 2.845 0.075 1 0 "[ . 1]" 1
844 1 36 ILE MD 1 46 ILE MG 3.070 . 4.340 4.318 4.200 4.358 0.018 2 0 "[ . 1]" 1
845 1 36 ILE MD 1 61 LEU MD1 2.780 . 3.760 3.561 3.442 3.776 0.016 1 0 "[ . 1]" 1
846 1 36 ILE MD 1 61 LEU MD2 2.450 . 3.100 2.486 2.375 2.658 . 0 0 "[ . 1]" 1
847 1 36 ILE HG12 1 36 ILE MG 2.405 . 3.010 2.372 2.324 2.397 . 0 0 "[ . 1]" 1
848 1 36 ILE HG12 1 44 TYR HB2 3.565 . 5.330 4.394 4.211 4.519 . 0 0 "[ . 1]" 1
849 1 36 ILE HG12 1 44 TYR HB3 3.155 . 4.510 3.407 3.266 3.526 . 0 0 "[ . 1]" 1
850 1 36 ILE HG12 1 44 TYR QD 3.270 . 4.740 4.491 4.412 4.584 . 0 0 "[ . 1]" 1
851 1 36 ILE HG12 1 46 ILE HA 3.285 . 4.770 3.790 3.713 3.831 . 0 0 "[ . 1]" 1
852 1 36 ILE HG12 1 46 ILE MD 2.415 . 3.030 1.775 1.767 1.784 0.033 7 0 "[ . 1]" 1
853 1 36 ILE HG12 1 46 ILE HG13 3.530 . 5.260 4.193 4.170 4.232 . 0 0 "[ . 1]" 1
854 1 36 ILE HG12 1 46 ILE MG 3.300 . 4.800 3.198 3.045 3.279 . 0 0 "[ . 1]" 1
855 1 36 ILE HG12 1 61 LEU MD1 3.185 . 4.570 4.432 4.323 4.589 0.019 1 0 "[ . 1]" 1
856 1 36 ILE HG12 1 61 LEU MD2 3.135 . 4.470 2.982 2.915 3.075 . 0 0 "[ . 1]" 1
857 1 36 ILE HG13 1 36 ILE MG 2.640 . 3.480 3.208 3.199 3.214 . 0 0 "[ . 1]" 1
858 1 36 ILE HG13 1 44 TYR HB3 3.650 . 5.500 5.005 4.854 5.136 . 0 0 "[ . 1]" 1
859 1 36 ILE HG13 1 44 TYR QD 3.650 . 5.500 5.547 5.533 5.561 0.061 2 0 "[ . 1]" 1
860 1 36 ILE HG13 1 46 ILE HA 3.650 . 5.500 4.750 4.663 4.811 . 0 0 "[ . 1]" 1
861 1 36 ILE HG13 1 46 ILE MD 2.610 . 3.420 3.000 2.910 3.054 . 0 0 "[ . 1]" 1
862 1 36 ILE HG13 1 46 ILE MG 3.355 . 4.910 3.716 3.580 3.790 . 0 0 "[ . 1]" 1
863 1 36 ILE HG13 1 61 LEU MD2 3.295 . 4.790 3.841 3.738 3.983 . 0 0 "[ . 1]" 1
864 1 36 ILE MG 1 37 ILE HA 2.825 . 3.850 3.763 3.676 3.834 . 0 0 "[ . 1]" 1
865 1 36 ILE MG 1 38 ASP HA 2.825 . 3.850 3.855 3.789 3.910 0.060 8 0 "[ . 1]" 1
866 1 36 ILE MG 1 38 ASP HB3 3.375 . 4.950 4.819 4.776 4.856 . 0 0 "[ . 1]" 1
867 1 36 ILE MG 1 39 GLN HA 3.345 . 4.890 3.888 3.706 4.038 . 0 0 "[ . 1]" 1
868 1 36 ILE MG 1 39 GLN QB 2.930 . 4.060 3.022 2.712 3.226 . 0 0 "[ . 1]" 1
869 1 36 ILE MG 1 39 GLN QG 3.650 . 5.500 4.283 3.937 4.791 . 0 0 "[ . 1]" 1
870 1 36 ILE MG 1 44 TYR H 3.650 . 5.500 5.337 5.129 5.437 . 0 0 "[ . 1]" 1
871 1 36 ILE MG 1 44 TYR HA 2.820 . 3.840 3.607 3.423 3.720 . 0 0 "[ . 1]" 1
872 1 36 ILE MG 1 44 TYR HB2 2.940 . 4.080 3.750 3.512 3.891 . 0 0 "[ . 1]" 1
873 1 36 ILE MG 1 44 TYR HB3 2.535 . 3.270 2.282 2.067 2.398 . 0 0 "[ . 1]" 1
874 1 36 ILE MG 1 44 TYR QD 2.270 . 2.740 2.317 2.230 2.420 . 0 0 "[ . 1]" 1
875 1 36 ILE MG 1 44 TYR QE 2.940 . 4.080 3.919 3.761 4.036 . 0 0 "[ . 1]" 1
876 1 36 ILE MG 1 45 LEU MD1 3.635 . 5.470 5.504 5.484 5.520 0.050 4 0 "[ . 1]" 1
877 1 36 ILE MG 1 46 ILE HA 2.955 . 4.110 3.598 3.483 3.724 . 0 0 "[ . 1]" 1
878 1 36 ILE MG 1 46 ILE MD 2.820 . 3.840 2.238 2.145 2.377 . 0 0 "[ . 1]" 1
879 1 36 ILE MG 1 61 LEU MD2 3.200 . 4.600 3.925 3.860 4.005 . 0 0 "[ . 1]" 1
880 1 37 ILE H 1 38 ASP H 2.515 . 3.230 2.087 2.040 2.149 . 0 0 "[ . 1]" 1
881 1 37 ILE H 1 45 LEU HB3 2.525 . 3.250 3.269 3.257 3.281 0.031 8 0 "[ . 1]" 1
882 1 37 ILE H 1 46 ILE H 3.565 . 5.330 4.768 4.716 4.815 . 0 0 "[ . 1]" 1
883 1 37 ILE H 1 46 ILE MD 3.220 . 4.640 3.494 3.424 3.582 . 0 0 "[ . 1]" 1
884 1 37 ILE H 1 47 ARG H 3.180 . 4.560 3.757 3.652 3.880 . 0 0 "[ . 1]" 1
885 1 37 ILE H 1 47 ARG HB2 3.465 . 5.130 4.794 4.727 4.837 . 0 0 "[ . 1]" 1
886 1 37 ILE HA 1 37 ILE HB 2.335 . 2.870 2.506 2.477 2.535 . 0 0 "[ . 1]" 1
887 1 37 ILE HA 1 37 ILE MD 2.735 . 3.670 3.598 3.545 3.655 . 0 0 "[ . 1]" 1
888 1 37 ILE HA 1 37 ILE HG13 3.010 . 4.220 4.266 4.247 4.283 0.063 4 0 "[ . 1]" 1
889 1 37 ILE HA 1 37 ILE MG 2.275 . 2.750 2.322 2.305 2.334 . 0 0 "[ . 1]" 1
890 1 37 ILE HA 1 45 LEU MD2 3.505 . 5.210 5.185 5.140 5.221 0.011 8 0 "[ . 1]" 1
891 1 37 ILE HA 1 47 ARG HB2 3.650 . 5.500 5.555 5.501 5.609 0.109 2 0 "[ . 1]" 1
892 1 37 ILE HA 1 47 ARG HB3 3.650 . 5.500 5.538 5.515 5.565 0.065 8 0 "[ . 1]" 1
893 1 37 ILE HB 1 37 ILE MD 2.510 . 3.220 3.155 3.122 3.175 . 0 0 "[ . 1]" 1
894 1 37 ILE HB 1 38 ASP H 2.975 . 4.150 3.816 3.696 3.912 . 0 0 "[ . 1]" 1
895 1 37 ILE HB 1 38 ASP HB2 3.300 . 4.800 3.721 3.646 3.808 . 0 0 "[ . 1]" 1
896 1 37 ILE HB 1 38 ASP HB3 3.425 . 5.050 4.967 4.880 5.073 0.023 7 0 "[ . 1]" 1
897 1 37 ILE HB 1 45 LEU HB3 3.320 . 4.840 4.571 4.491 4.614 . 0 0 "[ . 1]" 1
898 1 37 ILE HB 1 45 LEU MD2 3.095 . 4.390 3.612 3.528 3.694 . 0 0 "[ . 1]" 1
899 1 37 ILE HB 1 47 ARG HB2 3.400 . 5.000 4.795 4.706 4.952 . 0 0 "[ . 1]" 1
900 1 37 ILE MD 1 37 ILE MG 2.310 . 2.820 1.791 1.752 1.854 0.048 6 0 "[ . 1]" 1
901 1 37 ILE MD 1 38 ASP HB2 3.545 . 5.290 4.619 4.363 4.891 . 0 0 "[ . 1]" 1
902 1 37 ILE MD 1 38 ASP HB3 3.600 . 5.400 4.675 4.506 4.888 . 0 0 "[ . 1]" 1
903 1 37 ILE MD 1 45 LEU H 3.635 . 5.470 4.466 4.303 4.748 . 0 0 "[ . 1]" 1
904 1 37 ILE MD 1 45 LEU HB2 3.245 . 4.690 4.107 4.011 4.277 . 0 0 "[ . 1]" 1
905 1 37 ILE MD 1 45 LEU MD1 3.020 . 4.240 3.249 3.170 3.299 . 0 0 "[ . 1]" 1
906 1 37 ILE MD 1 46 ILE H 3.310 . 4.820 3.332 3.261 3.406 . 0 0 "[ . 1]" 1
907 1 37 ILE MD 1 46 ILE HA 3.105 . 4.410 2.517 2.395 2.696 . 0 0 "[ . 1]" 1
908 1 37 ILE MD 1 47 ARG H 3.240 . 4.680 2.335 2.265 2.451 . 0 0 "[ . 1]" 1
909 1 37 ILE MD 1 47 ARG HA 3.170 . 4.540 3.061 2.988 3.121 . 0 0 "[ . 1]" 1
910 1 37 ILE MD 1 47 ARG HB2 2.770 . 3.740 1.784 1.772 1.793 0.028 4 0 "[ . 1]" 1
911 1 37 ILE MD 1 47 ARG HB3 2.745 . 3.690 2.645 2.500 2.820 . 0 0 "[ . 1]" 1
912 1 37 ILE MD 1 47 ARG QD 2.855 . 3.910 3.331 3.123 3.760 . 0 0 "[ . 1]" 1
913 1 37 ILE MD 1 47 ARG HG2 3.310 . 4.820 4.305 4.247 4.379 . 0 0 "[ . 1]" 1
914 1 37 ILE MD 1 53 GLU HA 3.285 . 4.770 3.118 3.049 3.174 . 0 0 "[ . 1]" 1
915 1 37 ILE MD 1 53 GLU HG2 3.310 . 4.820 2.239 1.965 2.615 . 0 0 "[ . 1]" 1
916 1 37 ILE MD 1 53 GLU QG 2.975 . 4.150 2.222 1.954 2.588 . 0 0 "[ . 1]" 1
917 1 37 ILE MD 1 53 GLU HG3 3.310 . 4.820 3.741 3.466 4.127 . 0 0 "[ . 1]" 1
918 1 37 ILE HG12 1 38 ASP H 2.980 . 4.160 2.160 2.073 2.289 . 0 0 "[ . 1]" 1
919 1 37 ILE HG12 1 38 ASP HA 3.350 . 4.900 4.297 4.224 4.402 . 0 0 "[ . 1]" 1
920 1 37 ILE HG12 1 38 ASP HB2 3.185 . 4.570 3.212 2.916 3.514 . 0 0 "[ . 1]" 1
921 1 37 ILE HG12 1 38 ASP HB3 3.505 . 5.210 3.477 3.331 3.596 . 0 0 "[ . 1]" 1
922 1 37 ILE HG12 1 45 LEU HB2 3.255 . 4.710 3.731 3.698 3.784 . 0 0 "[ . 1]" 1
923 1 37 ILE HG12 1 45 LEU HB3 3.000 . 4.200 2.110 2.091 2.138 . 0 0 "[ . 1]" 1
924 1 37 ILE HG12 1 45 LEU MD1 3.275 . 4.750 4.118 4.041 4.187 . 0 0 "[ . 1]" 1
925 1 37 ILE HG12 1 45 LEU MD2 2.710 . 3.620 2.268 2.207 2.337 . 0 0 "[ . 1]" 1
926 1 37 ILE HG12 1 45 LEU HG 2.945 . 4.090 2.652 2.521 2.757 . 0 0 "[ . 1]" 1
927 1 37 ILE HG12 1 46 ILE HA 3.385 . 4.970 4.395 4.245 4.492 . 0 0 "[ . 1]" 1
928 1 37 ILE HG12 1 46 ILE MD 3.385 . 4.970 4.995 4.931 5.032 0.062 3 0 "[ . 1]" 1
929 1 37 ILE HG12 1 47 ARG HB2 3.305 . 4.810 4.523 4.430 4.673 . 0 0 "[ . 1]" 1
930 1 37 ILE HG12 1 47 ARG HB3 3.650 . 5.500 5.466 5.398 5.507 0.007 5 0 "[ . 1]" 1
931 1 37 ILE HG13 1 38 ASP HA 3.650 . 5.500 5.480 5.347 5.540 0.040 1 0 "[ . 1]" 1
932 1 37 ILE HG13 1 38 ASP HB2 3.090 . 4.380 3.765 3.488 3.925 . 0 0 "[ . 1]" 1
933 1 37 ILE HG13 1 38 ASP HB3 3.270 . 4.740 4.408 4.305 4.515 . 0 0 "[ . 1]" 1
934 1 37 ILE HG13 1 45 LEU HB2 3.190 . 4.580 4.652 4.626 4.677 0.097 7 0 "[ . 1]" 1
935 1 37 ILE HG13 1 45 LEU MD1 3.165 . 4.530 4.130 4.041 4.220 . 0 0 "[ . 1]" 1
936 1 37 ILE HG13 1 45 LEU MD2 2.440 . 3.080 2.035 1.988 2.078 . 0 0 "[ . 1]" 1
937 1 37 ILE HG13 1 45 LEU HG 3.070 . 4.340 2.778 2.676 2.881 . 0 0 "[ . 1]" 1
938 1 37 ILE HG13 1 46 ILE HA 3.540 . 5.280 5.379 5.371 5.388 0.108 8 0 "[ . 1]" 1
939 1 37 ILE HG13 1 47 ARG HA 3.650 . 5.500 5.530 5.507 5.554 0.054 10 0 "[ . 1]" 1
940 1 37 ILE HG13 1 47 ARG HB2 3.120 . 4.440 3.847 3.651 4.131 . 0 0 "[ . 1]" 1
941 1 37 ILE HG13 1 47 ARG HB3 3.625 . 5.450 5.147 4.961 5.391 . 0 0 "[ . 1]" 1
942 1 37 ILE HG13 1 53 GLU QG 2.970 . 4.140 3.530 3.141 3.831 . 0 0 "[ . 1]" 1
943 1 37 ILE MG 1 38 ASP HB2 3.425 . 5.050 5.018 4.917 5.081 0.031 9 0 "[ . 1]" 1
944 1 37 ILE MG 1 45 LEU MD2 2.875 . 3.950 4.056 4.021 4.080 0.130 2 0 "[ . 1]" 1
945 1 37 ILE MG 1 46 ILE HA 3.375 . 4.950 4.314 4.212 4.400 . 0 0 "[ . 1]" 1
946 1 37 ILE MG 1 47 ARG H 2.755 . 3.710 3.341 3.260 3.504 . 0 0 "[ . 1]" 1
947 1 37 ILE MG 1 47 ARG HA 3.110 . 4.420 4.417 4.354 4.467 0.047 4 0 "[ . 1]" 1
948 1 37 ILE MG 1 47 ARG HB2 2.490 . 3.180 2.459 2.405 2.504 . 0 0 "[ . 1]" 1
949 1 37 ILE MG 1 47 ARG HB3 2.575 . 3.350 2.609 2.533 2.744 . 0 0 "[ . 1]" 1
950 1 37 ILE MG 1 47 ARG HD2 2.990 . 4.180 3.292 2.648 4.191 0.011 6 0 "[ . 1]" 1
951 1 37 ILE MG 1 47 ARG QD 2.735 . 3.670 2.693 2.427 3.054 . 0 0 "[ . 1]" 1
952 1 37 ILE MG 1 47 ARG HD3 2.990 . 4.180 3.161 2.536 4.182 0.002 2 0 "[ . 1]" 1
953 1 37 ILE MG 1 47 ARG HG2 3.110 . 4.420 4.294 4.090 4.439 0.019 5 0 "[ . 1]" 1
954 1 37 ILE MG 1 47 ARG HG3 3.170 . 4.540 4.283 4.108 4.396 . 0 0 "[ . 1]" 1
955 1 37 ILE MG 1 53 GLU HA 3.515 . 5.230 5.287 5.253 5.329 0.099 6 0 "[ . 1]" 1
956 1 38 ASP H 1 38 ASP HB3 2.885 . 3.970 3.010 2.950 3.075 . 0 0 "[ . 1]" 1
957 1 38 ASP H 1 39 GLN H 3.260 . 4.720 4.314 4.287 4.344 . 0 0 "[ . 1]" 1
958 1 38 ASP H 1 45 LEU HB2 2.760 . 3.720 3.691 3.599 3.732 0.012 7 0 "[ . 1]" 1
959 1 38 ASP H 1 45 LEU HB3 2.305 . 2.810 2.155 2.025 2.234 . 0 0 "[ . 1]" 1
960 1 38 ASP H 1 45 LEU MD2 3.245 . 4.690 3.562 3.415 3.688 . 0 0 "[ . 1]" 1
961 1 38 ASP H 1 55 TRP HH2 3.395 . 4.990 4.998 4.947 5.025 0.035 7 0 "[ . 1]" 1
962 1 38 ASP HA 1 39 GLN H 2.475 . 3.150 2.396 2.346 2.494 . 0 0 "[ . 1]" 1
963 1 38 ASP HA 1 39 GLN QB 3.290 . 4.780 4.179 4.125 4.261 . 0 0 "[ . 1]" 1
964 1 38 ASP HA 1 39 GLN QG 3.445 . 5.090 3.769 3.458 5.006 . 0 0 "[ . 1]" 1
965 1 38 ASP HA 1 45 LEU HB2 3.530 . 5.260 5.110 5.053 5.159 . 0 0 "[ . 1]" 1
966 1 38 ASP HA 1 45 LEU MD2 3.235 . 4.670 4.584 4.522 4.667 . 0 0 "[ . 1]" 1
967 1 38 ASP HB2 1 39 GLN H 2.990 . 4.180 3.998 3.908 4.111 . 0 0 "[ . 1]" 1
968 1 38 ASP HB2 1 45 LEU HB2 3.120 . 4.440 3.924 3.735 4.059 . 0 0 "[ . 1]" 1
969 1 38 ASP HB2 1 45 LEU HB3 2.800 . 3.800 3.230 3.026 3.371 . 0 0 "[ . 1]" 1
970 1 38 ASP HB2 1 45 LEU MD1 3.525 . 5.250 5.023 4.856 5.132 . 0 0 "[ . 1]" 1
971 1 38 ASP HB2 1 45 LEU MD2 2.550 . 3.300 2.622 2.456 2.771 . 0 0 "[ . 1]" 1
972 1 38 ASP HB2 1 45 LEU HG 3.570 . 5.340 4.777 4.590 4.946 . 0 0 "[ . 1]" 1
973 1 38 ASP HB2 1 55 TRP HH2 2.955 . 4.110 4.017 3.976 4.047 . 0 0 "[ . 1]" 1
974 1 38 ASP HB2 1 55 TRP HZ2 3.205 . 4.610 4.498 4.428 4.594 . 0 0 "[ . 1]" 1
975 1 38 ASP HB2 1 55 TRP HZ3 3.650 . 5.500 5.577 5.548 5.599 0.099 10 0 "[ . 1]" 1
976 1 38 ASP HB3 1 39 GLN H 2.790 . 3.780 3.453 3.294 3.578 . 0 0 "[ . 1]" 1
977 1 38 ASP HB3 1 39 GLN HA 3.590 . 5.380 4.358 4.274 4.421 . 0 0 "[ . 1]" 1
978 1 38 ASP HB3 1 45 LEU H 2.885 . 3.970 3.565 3.498 3.687 . 0 0 "[ . 1]" 1
979 1 38 ASP HB3 1 45 LEU HA 3.650 . 5.500 4.864 4.818 4.936 . 0 0 "[ . 1]" 1
980 1 38 ASP HB3 1 45 LEU HB2 2.815 . 3.830 2.475 2.423 2.561 . 0 0 "[ . 1]" 1
981 1 38 ASP HB3 1 45 LEU HB3 2.670 . 3.540 2.359 2.302 2.429 . 0 0 "[ . 1]" 1
982 1 38 ASP HB3 1 45 LEU MD1 3.090 . 4.380 4.185 4.136 4.223 . 0 0 "[ . 1]" 1
983 1 38 ASP HB3 1 45 LEU MD2 2.535 . 3.270 2.548 2.476 2.639 . 0 0 "[ . 1]" 1
984 1 38 ASP HB3 1 45 LEU HG 3.345 . 4.890 4.325 4.251 4.388 . 0 0 "[ . 1]" 1
985 1 38 ASP HB3 1 55 TRP HH2 2.785 . 3.770 2.513 2.458 2.612 . 0 0 "[ . 1]" 1
986 1 38 ASP HB3 1 55 TRP HZ2 3.045 . 4.290 3.333 3.279 3.422 . 0 0 "[ . 1]" 1
987 1 38 ASP HB3 1 55 TRP HZ3 3.125 . 4.450 3.902 3.846 3.953 . 0 0 "[ . 1]" 1
988 1 39 GLN H 1 39 GLN QB 2.590 . 3.380 3.120 3.081 3.157 . 0 0 "[ . 1]" 1
989 1 39 GLN H 1 39 GLN QG 2.765 . 3.730 2.476 2.277 3.372 . 0 0 "[ . 1]" 1
990 1 39 GLN H 1 40 THR H 3.150 . 4.500 4.304 4.237 4.360 . 0 0 "[ . 1]" 1
991 1 39 GLN H 1 55 TRP HH2 3.105 . 4.410 3.414 3.204 3.564 . 0 0 "[ . 1]" 1
992 1 39 GLN HA 1 39 GLN QG 2.885 . 3.970 3.393 3.345 3.545 . 0 0 "[ . 1]" 1
993 1 39 GLN HA 1 40 THR H 2.435 . 3.070 2.207 2.131 2.357 . 0 0 "[ . 1]" 1
994 1 39 GLN HA 1 40 THR MG 3.185 . 4.570 3.818 3.761 3.980 . 0 0 "[ . 1]" 1
995 1 39 GLN HA 1 43 GLN H 3.550 . 5.300 5.214 5.077 5.305 0.005 9 0 "[ . 1]" 1
996 1 39 GLN HA 1 44 TYR HA 2.295 . 2.790 2.191 2.094 2.262 . 0 0 "[ . 1]" 1
997 1 39 GLN HA 1 44 TYR HB2 3.505 . 5.210 5.009 4.906 5.069 . 0 0 "[ . 1]" 1
998 1 39 GLN HA 1 44 TYR HB3 3.030 . 4.260 4.047 3.986 4.091 . 0 0 "[ . 1]" 1
999 1 39 GLN HA 1 44 TYR QD 2.710 . 3.620 3.149 3.062 3.259 . 0 0 "[ . 1]" 1
1000 1 39 GLN HA 1 44 TYR QE 3.060 . 4.320 4.362 4.297 4.399 0.079 7 0 "[ . 1]" 1
1001 1 39 GLN HA 1 45 LEU H 2.865 . 3.930 2.939 2.855 3.028 . 0 0 "[ . 1]" 1
1002 1 39 GLN HA 1 45 LEU HB2 3.515 . 5.230 4.674 4.560 4.780 . 0 0 "[ . 1]" 1
1003 1 39 GLN HA 1 55 TRP HE3 3.160 . 4.520 4.337 4.283 4.444 . 0 0 "[ . 1]" 1
1004 1 39 GLN HA 1 55 TRP HH2 2.815 . 3.830 3.648 3.576 3.694 . 0 0 "[ . 1]" 1
1005 1 39 GLN HA 1 55 TRP HZ3 2.360 . 2.920 2.295 2.250 2.370 . 0 0 "[ . 1]" 1
1006 1 39 GLN QB 1 39 GLN QG 2.325 . 2.850 2.067 2.005 2.094 . 0 0 "[ . 1]" 1
1007 1 39 GLN QB 1 40 THR H 3.300 . 4.800 2.749 2.397 2.892 . 0 0 "[ . 1]" 1
1008 1 39 GLN QB 1 40 THR HA 2.990 . 4.180 4.195 4.100 4.231 0.051 9 0 "[ . 1]" 1
1009 1 39 GLN QB 1 44 TYR HA 2.870 . 3.940 3.372 3.273 3.447 . 0 0 "[ . 1]" 1
1010 1 39 GLN QB 1 44 TYR HB3 3.265 . 4.730 4.006 3.881 4.138 . 0 0 "[ . 1]" 1
1011 1 39 GLN QB 1 44 TYR QD 2.390 . 2.980 2.175 2.056 2.383 . 0 0 "[ . 1]" 1
1012 1 39 GLN QB 1 44 TYR QE 2.345 . 2.890 2.429 2.316 2.501 . 0 0 "[ . 1]" 1
1013 1 39 GLN QB 1 55 TRP HH2 3.425 . 5.050 5.058 5.011 5.083 0.033 9 0 "[ . 1]" 1
1014 1 39 GLN QB 1 55 TRP HZ3 2.925 . 4.050 4.078 4.049 4.117 0.067 9 0 "[ . 1]" 1
1015 1 39 GLN QG 1 40 THR H 3.035 . 4.270 3.995 3.832 4.315 0.045 6 0 "[ . 1]" 1
1016 1 39 GLN QG 1 40 THR HA 3.210 . 4.620 3.978 3.679 4.639 0.019 10 0 "[ . 1]" 1
1017 1 39 GLN QG 1 44 TYR HA 3.585 . 5.370 5.149 5.047 5.283 . 0 0 "[ . 1]" 1
1018 1 39 GLN QG 1 44 TYR QD 3.300 . 4.800 4.180 3.876 4.351 . 0 0 "[ . 1]" 1
1019 1 40 THR H 1 40 THR MG 2.900 . 4.000 2.975 2.852 3.299 . 0 0 "[ . 1]" 1
1020 1 40 THR H 1 42 ASP H 3.315 . 4.830 4.222 3.962 4.415 . 0 0 "[ . 1]" 1
1021 1 40 THR H 1 43 GLN H 2.645 . 3.490 3.309 3.185 3.449 . 0 0 "[ . 1]" 1
1022 1 40 THR H 1 44 TYR HA 2.805 . 3.810 3.125 2.985 3.262 . 0 0 "[ . 1]" 1
1023 1 40 THR H 1 45 LEU H 3.515 . 5.230 4.572 4.440 4.791 . 0 0 "[ . 1]" 1
1024 1 40 THR H 1 55 TRP HZ3 2.715 . 3.630 2.582 2.454 3.029 . 0 0 "[ . 1]" 1
1025 1 40 THR HA 1 40 THR HB 2.355 . 2.910 2.530 2.502 2.565 . 0 0 "[ . 1]" 1
1026 1 40 THR HA 1 40 THR MG 2.410 . 3.020 2.389 2.329 2.452 . 0 0 "[ . 1]" 1
1027 1 40 THR HA 1 41 SER H 2.540 . 3.280 2.751 2.667 2.874 . 0 0 "[ . 1]" 1
1028 1 40 THR HA 1 43 GLN H 3.280 . 4.760 4.690 4.595 4.769 0.009 8 0 "[ . 1]" 1
1029 1 40 THR HB 1 42 ASP QB 3.340 . 4.880 4.407 4.105 4.683 . 0 0 "[ . 1]" 1
1030 1 40 THR HB 1 43 GLN HB2 3.435 . 5.070 4.664 4.381 4.820 . 0 0 "[ . 1]" 1
1031 1 40 THR HB 1 55 TRP HZ3 3.325 . 4.850 4.869 4.845 4.891 0.041 6 0 "[ . 1]" 1
1032 1 40 THR MG 1 41 SER H 2.925 . 4.050 3.605 3.499 3.741 . 0 0 "[ . 1]" 1
1033 1 40 THR MG 1 42 ASP H 2.995 . 4.190 4.180 4.077 4.266 0.076 8 0 "[ . 1]" 1
1034 1 40 THR MG 1 43 GLN H 3.140 . 4.480 3.881 3.781 3.964 . 0 0 "[ . 1]" 1
1035 1 40 THR MG 1 43 GLN HB2 2.785 . 3.770 3.770 3.610 3.834 0.064 7 0 "[ . 1]" 1
1036 1 40 THR MG 1 44 TYR HA 3.315 . 4.830 4.645 4.532 4.808 . 0 0 "[ . 1]" 1
1037 1 40 THR MG 1 45 LEU HB2 3.475 . 5.150 4.776 4.672 4.856 . 0 0 "[ . 1]" 1
1038 1 40 THR MG 1 55 TRP HE3 2.890 . 3.980 3.815 3.660 3.996 0.016 10 0 "[ . 1]" 1
1039 1 40 THR MG 1 55 TRP HH2 2.490 . 3.180 2.452 2.399 2.546 . 0 0 "[ . 1]" 1
1040 1 40 THR MG 1 55 TRP HZ2 2.745 . 3.690 3.700 3.589 3.745 0.055 3 0 "[ . 1]" 1
1041 1 40 THR MG 1 55 TRP HZ3 2.495 . 3.190 2.529 2.426 2.647 . 0 0 "[ . 1]" 1
1042 1 41 SER H 1 41 SER QB 2.610 . 3.420 2.421 2.282 2.610 . 0 0 "[ . 1]" 1
1043 1 41 SER H 1 42 ASP H 2.690 . 3.580 2.478 2.395 2.588 . 0 0 "[ . 1]" 1
1044 1 41 SER HA 1 41 SER QB 2.295 . 2.790 2.337 2.168 2.412 . 0 0 "[ . 1]" 1
1045 1 41 SER HA 1 42 ASP QB 3.650 . 5.500 5.387 4.928 5.509 0.009 9 0 "[ . 1]" 1
1046 1 41 SER HA 1 43 GLN H 3.295 . 4.790 4.762 4.582 4.884 0.094 8 0 "[ . 1]" 1
1047 1 41 SER QB 1 42 ASP H 2.735 . 3.670 3.094 2.818 3.680 0.010 10 0 "[ . 1]" 1
1048 1 41 SER QB 1 42 ASP QB 3.205 . 4.610 4.266 3.578 4.681 0.071 10 0 "[ . 1]" 1
1049 1 41 SER QB 1 43 GLN H 3.600 . 5.400 4.945 4.775 5.272 . 0 0 "[ . 1]" 1
1050 1 42 ASP H 1 42 ASP QB 2.685 . 3.570 2.602 2.520 2.837 . 0 0 "[ . 1]" 1
1051 1 42 ASP H 1 43 GLN H 2.295 . 2.790 2.089 1.847 2.237 . 0 0 "[ . 1]" 1
1052 1 42 ASP H 1 43 GLN HA 3.350 . 4.900 4.779 4.576 4.914 0.014 7 0 "[ . 1]" 1
1053 1 42 ASP H 1 43 GLN HB2 3.295 . 4.790 4.435 4.237 4.586 . 0 0 "[ . 1]" 1
1054 1 42 ASP H 1 43 GLN QG 3.365 . 4.930 4.431 4.287 4.936 0.006 10 0 "[ . 1]" 1
1055 1 42 ASP HA 1 42 ASP QB 2.285 . 2.770 2.330 2.163 2.394 . 0 0 "[ . 1]" 1
1056 1 42 ASP HA 1 43 GLN QG 3.570 . 5.340 4.338 4.136 4.918 . 0 0 "[ . 1]" 1
1057 1 42 ASP HA 1 58 PRO HG2 3.650 . 5.500 4.734 4.030 5.498 . 0 0 "[ . 1]" 1
1058 1 42 ASP HA 1 58 PRO HG3 3.430 . 5.060 4.149 3.766 4.720 . 0 0 "[ . 1]" 1
1059 1 42 ASP QB 1 43 GLN H 2.895 . 3.990 2.937 2.628 3.643 . 0 0 "[ . 1]" 1
1060 1 42 ASP QB 1 43 GLN HB2 3.265 . 4.730 3.932 3.426 4.606 . 0 0 "[ . 1]" 1
1061 1 42 ASP QB 1 43 GLN HG2 3.070 . 4.340 3.994 3.701 4.414 0.074 10 0 "[ . 1]" 1
1062 1 42 ASP QB 1 43 GLN QG 2.705 . 3.610 2.659 2.376 3.438 . 0 0 "[ . 1]" 1
1063 1 42 ASP QB 1 43 GLN HG3 3.070 . 4.340 2.705 2.404 3.586 . 0 0 "[ . 1]" 1
1064 1 42 ASP QB 1 58 PRO HD2 3.360 . 4.920 4.928 4.521 5.019 0.099 8 0 "[ . 1]" 1
1065 1 42 ASP QB 1 58 PRO HD3 3.250 . 4.700 4.499 4.134 4.706 0.006 1 0 "[ . 1]" 1
1066 1 43 GLN H 1 43 GLN HB2 2.630 . 3.460 2.656 2.506 2.761 . 0 0 "[ . 1]" 1
1067 1 43 GLN H 1 43 GLN HB3 2.890 . 3.980 3.774 3.683 3.824 . 0 0 "[ . 1]" 1
1068 1 43 GLN H 1 43 GLN QG 3.010 . 4.220 3.187 3.022 3.680 . 0 0 "[ . 1]" 1
1069 1 43 GLN H 1 44 TYR H 3.100 . 4.400 4.388 4.314 4.428 0.028 8 0 "[ . 1]" 1
1070 1 43 GLN HA 1 43 GLN HG2 2.660 . 3.520 2.627 2.427 3.622 0.102 10 0 "[ . 1]" 1
1071 1 43 GLN HA 1 43 GLN QG 2.405 . 3.010 2.379 2.253 2.444 . 0 0 "[ . 1]" 1
1072 1 43 GLN HA 1 43 GLN HG3 2.660 . 3.520 2.878 2.443 3.091 . 0 0 "[ . 1]" 1
1073 1 43 GLN HA 1 44 TYR H 2.475 . 3.150 2.336 2.276 2.417 . 0 0 "[ . 1]" 1
1074 1 43 GLN HA 1 44 TYR QD 2.795 . 3.790 3.307 3.101 3.500 . 0 0 "[ . 1]" 1
1075 1 43 GLN HA 1 44 TYR QE 3.265 . 4.730 4.571 4.208 4.757 0.027 5 0 "[ . 1]" 1
1076 1 43 GLN HA 1 55 TRP HE3 3.185 . 4.570 4.128 4.004 4.261 . 0 0 "[ . 1]" 1
1077 1 43 GLN HA 1 55 TRP HZ3 3.650 . 5.500 5.290 5.210 5.419 . 0 0 "[ . 1]" 1
1078 1 43 GLN HA 1 58 PRO HD2 3.070 . 4.340 4.206 3.889 4.375 0.035 4 0 "[ . 1]" 1
1079 1 43 GLN HA 1 58 PRO HD3 2.715 . 3.630 2.661 2.335 2.951 . 0 0 "[ . 1]" 1
1080 1 43 GLN HA 1 58 PRO HG3 3.610 . 5.420 4.298 3.809 4.993 . 0 0 "[ . 1]" 1
1081 1 43 GLN HB2 1 44 TYR H 2.765 . 3.730 3.605 3.512 3.723 . 0 0 "[ . 1]" 1
1082 1 43 GLN HB2 1 55 TRP HA 3.650 . 5.500 4.680 4.537 4.933 . 0 0 "[ . 1]" 1
1083 1 43 GLN HB2 1 55 TRP HB2 3.585 . 5.370 4.675 4.518 4.960 . 0 0 "[ . 1]" 1
1084 1 43 GLN HB2 1 55 TRP HB3 3.300 . 4.800 3.010 2.852 3.287 . 0 0 "[ . 1]" 1
1085 1 43 GLN HB2 1 55 TRP HE3 2.545 . 3.290 2.596 2.437 2.876 . 0 0 "[ . 1]" 1
1086 1 43 GLN HB2 1 55 TRP HZ3 3.145 . 4.490 4.003 3.758 4.280 . 0 0 "[ . 1]" 1
1087 1 43 GLN HB2 1 56 CYS H 3.600 . 5.400 4.911 4.774 5.097 . 0 0 "[ . 1]" 1
1088 1 43 GLN HB3 1 44 TYR H 2.650 . 3.500 2.332 2.167 2.466 . 0 0 "[ . 1]" 1
1089 1 43 GLN HB3 1 55 TRP HA 3.395 . 4.990 3.435 3.305 3.601 . 0 0 "[ . 1]" 1
1090 1 43 GLN HB3 1 55 TRP HB2 3.070 . 4.340 4.046 3.831 4.270 . 0 0 "[ . 1]" 1
1091 1 43 GLN HB3 1 55 TRP HB3 2.160 . 2.520 2.337 2.121 2.551 0.031 2 0 "[ . 1]" 1
1092 1 43 GLN HB3 1 55 TRP HE3 2.465 . 3.130 2.274 2.097 2.365 . 0 0 "[ . 1]" 1
1093 1 43 GLN HB3 1 55 TRP HZ3 3.080 . 4.360 4.355 4.094 4.433 0.073 9 0 "[ . 1]" 1
1094 1 43 GLN HB3 1 56 CYS H 3.245 . 4.690 3.238 3.113 3.394 . 0 0 "[ . 1]" 1
1095 1 43 GLN QG 1 44 TYR H 3.450 . 5.100 3.624 3.311 3.800 . 0 0 "[ . 1]" 1
1096 1 43 GLN QG 1 55 TRP HB2 3.570 . 5.340 4.765 3.768 5.195 . 0 0 "[ . 1]" 1
1097 1 43 GLN QG 1 55 TRP HB3 3.365 . 4.930 3.542 2.613 3.917 . 0 0 "[ . 1]" 1
1098 1 43 GLN QG 1 56 CYS H 3.190 . 4.580 4.483 4.241 4.597 0.017 3 0 "[ . 1]" 1
1099 1 43 GLN QG 1 57 GLU HA 3.235 . 4.670 2.681 2.045 3.327 . 0 0 "[ . 1]" 1
1100 1 43 GLN QG 1 57 GLU HG2 3.165 . 4.530 3.461 2.570 4.044 . 0 0 "[ . 1]" 1
1101 1 43 GLN QG 1 57 GLU HG3 3.050 . 4.300 3.013 2.103 4.043 . 0 0 "[ . 1]" 1
1102 1 43 GLN QG 1 58 PRO HD2 3.305 . 4.810 4.427 3.629 4.835 0.025 10 0 "[ . 1]" 1
1103 1 43 GLN QG 1 58 PRO HD3 3.060 . 4.320 3.677 3.060 3.915 . 0 0 "[ . 1]" 1
1104 1 43 GLN HG2 1 55 TRP HE3 3.405 . 5.010 4.630 4.140 4.845 . 0 0 "[ . 1]" 1
1105 1 43 GLN HG3 1 55 TRP HE3 3.405 . 5.010 4.863 4.731 5.046 0.036 2 0 "[ . 1]" 1
1106 1 44 TYR H 1 44 TYR HB2 2.670 . 3.540 2.593 2.549 2.653 . 0 0 "[ . 1]" 1
1107 1 44 TYR H 1 44 TYR HB3 2.930 . 4.060 3.739 3.717 3.768 . 0 0 "[ . 1]" 1
1108 1 44 TYR H 1 44 TYR QD 2.755 . 3.710 3.076 2.956 3.200 . 0 0 "[ . 1]" 1
1109 1 44 TYR H 1 45 LEU H 3.265 . 4.730 4.298 4.259 4.371 . 0 0 "[ . 1]" 1
1110 1 44 TYR H 1 56 CYS H 2.670 . 3.540 2.703 2.617 2.875 . 0 0 "[ . 1]" 1
1111 1 44 TYR H 1 58 PRO HD3 3.545 . 5.290 4.337 4.056 4.682 . 0 0 "[ . 1]" 1
1112 1 44 TYR HA 1 44 TYR QD 2.425 . 3.050 2.910 2.834 3.028 . 0 0 "[ . 1]" 1
1113 1 44 TYR HA 1 44 TYR QE 3.255 . 4.710 4.576 4.552 4.600 . 0 0 "[ . 1]" 1
1114 1 44 TYR HA 1 45 LEU H 2.550 . 3.300 2.161 2.126 2.200 . 0 0 "[ . 1]" 1
1115 1 44 TYR HA 1 45 LEU HB3 3.340 . 4.880 4.692 4.661 4.754 . 0 0 "[ . 1]" 1
1116 1 44 TYR HA 1 46 ILE MD 3.100 . 4.400 4.047 3.994 4.121 . 0 0 "[ . 1]" 1
1117 1 44 TYR HA 1 55 TRP HE3 2.880 . 3.960 3.160 3.061 3.245 . 0 0 "[ . 1]" 1
1118 1 44 TYR HA 1 55 TRP HH2 3.220 . 4.640 4.667 4.635 4.697 0.057 3 0 "[ . 1]" 1
1119 1 44 TYR HA 1 55 TRP HZ3 2.595 . 3.390 2.543 2.485 2.588 . 0 0 "[ . 1]" 1
1120 1 44 TYR HA 1 61 LEU MD1 3.225 . 4.650 4.538 4.471 4.603 . 0 0 "[ . 1]" 1
1121 1 44 TYR HB2 1 45 LEU HA 3.650 . 5.500 5.130 5.071 5.177 . 0 0 "[ . 1]" 1
1122 1 44 TYR HB2 1 46 ILE MD 2.580 . 3.360 2.373 2.292 2.430 . 0 0 "[ . 1]" 1
1123 1 44 TYR HB2 1 46 ILE HG12 3.445 . 5.090 3.756 3.664 3.825 . 0 0 "[ . 1]" 1
1124 1 44 TYR HB2 1 46 ILE HG13 3.505 . 5.210 4.271 4.193 4.353 . 0 0 "[ . 1]" 1
1125 1 44 TYR HB2 1 56 CYS HB2 3.320 . 4.840 3.691 3.567 3.827 . 0 0 "[ . 1]" 1
1126 1 44 TYR HB2 1 61 LEU MD1 2.830 . 3.860 1.909 1.840 1.997 . 0 0 "[ . 1]" 1
1127 1 44 TYR HB2 1 61 LEU MD2 3.040 . 4.280 2.981 2.841 3.163 . 0 0 "[ . 1]" 1
1128 1 44 TYR HB2 1 61 LEU HG 3.635 . 5.470 4.239 4.131 4.372 . 0 0 "[ . 1]" 1
1129 1 44 TYR HB3 1 45 LEU H 2.850 . 3.900 3.169 3.035 3.212 . 0 0 "[ . 1]" 1
1130 1 44 TYR HB3 1 46 ILE MD 2.590 . 3.380 2.241 2.155 2.314 . 0 0 "[ . 1]" 1
1131 1 44 TYR HB3 1 46 ILE HG12 3.545 . 5.290 4.015 3.929 4.131 . 0 0 "[ . 1]" 1
1132 1 44 TYR HB3 1 55 TRP HE3 3.515 . 5.230 5.149 5.067 5.227 . 0 0 "[ . 1]" 1
1133 1 44 TYR HB3 1 55 TRP HZ3 3.390 . 4.980 4.957 4.893 4.996 0.016 6 0 "[ . 1]" 1
1134 1 44 TYR HB3 1 61 LEU MD1 2.745 . 3.690 3.234 3.148 3.377 . 0 0 "[ . 1]" 1
1135 1 44 TYR HB3 1 61 LEU MD2 2.970 . 4.140 3.460 3.352 3.574 . 0 0 "[ . 1]" 1
1136 1 44 TYR QD 1 45 LEU H 3.390 . 4.980 3.988 3.925 4.082 . 0 0 "[ . 1]" 1
1137 1 44 TYR QD 1 46 ILE MD 2.820 . 3.840 3.804 3.733 3.853 0.013 8 0 "[ . 1]" 1
1138 1 44 TYR QD 1 56 CYS H 3.595 . 5.390 5.156 5.076 5.216 . 0 0 "[ . 1]" 1
1139 1 44 TYR QD 1 58 PRO HA 2.545 . 3.290 2.979 2.849 3.128 . 0 0 "[ . 1]" 1
1140 1 44 TYR QD 1 58 PRO HB2 3.250 . 4.700 4.795 4.776 4.825 0.125 5 0 "[ . 1]" 1
1141 1 44 TYR QD 1 58 PRO HB3 2.730 . 3.660 3.412 3.189 3.578 . 0 0 "[ . 1]" 1
1142 1 44 TYR QD 1 58 PRO HD3 3.085 . 4.370 3.348 3.119 3.599 . 0 0 "[ . 1]" 1
1143 1 44 TYR QD 1 58 PRO HG2 3.650 . 5.500 4.928 4.495 5.501 0.001 8 0 "[ . 1]" 1
1144 1 44 TYR QD 1 58 PRO HG3 3.200 . 4.600 3.615 2.891 4.609 0.009 1 0 "[ . 1]" 1
1145 1 44 TYR QD 1 61 LEU MD1 2.475 . 3.150 2.270 2.201 2.446 . 0 0 "[ . 1]" 1
1146 1 44 TYR QD 1 61 LEU MD2 3.035 . 4.270 3.926 3.866 4.092 . 0 0 "[ . 1]" 1
1147 1 44 TYR QD 1 61 LEU HG 3.475 . 5.150 4.813 4.737 4.973 . 0 0 "[ . 1]" 1
1148 1 44 TYR QE 1 58 PRO HA 2.755 . 3.710 3.454 3.213 3.632 . 0 0 "[ . 1]" 1
1149 1 44 TYR QE 1 58 PRO HB2 2.830 . 3.860 3.828 3.712 3.890 0.030 7 0 "[ . 1]" 1
1150 1 44 TYR QE 1 58 PRO HB3 2.460 . 3.120 2.225 2.051 2.326 . 0 0 "[ . 1]" 1
1151 1 44 TYR QE 1 58 PRO HD2 3.550 . 5.300 4.923 4.661 5.238 . 0 0 "[ . 1]" 1
1152 1 44 TYR QE 1 58 PRO HD3 2.780 . 3.760 3.793 3.572 3.858 0.098 4 0 "[ . 1]" 1
1153 1 44 TYR QE 1 58 PRO HG3 2.675 . 3.550 2.588 1.906 3.541 . 0 0 "[ . 1]" 1
1154 1 44 TYR QE 1 61 LEU MD1 3.125 . 4.450 3.484 3.401 3.587 . 0 0 "[ . 1]" 1
1155 1 44 TYR QE 1 61 LEU MD2 3.650 . 5.500 5.076 4.983 5.181 . 0 0 "[ . 1]" 1
1156 1 45 LEU H 1 45 LEU HB2 2.795 . 3.790 2.631 2.609 2.663 . 0 0 "[ . 1]" 1
1157 1 45 LEU H 1 45 LEU HB3 2.640 . 3.480 2.552 2.518 2.583 . 0 0 "[ . 1]" 1
1158 1 45 LEU H 1 45 LEU MD1 3.300 . 4.800 4.146 4.119 4.178 . 0 0 "[ . 1]" 1
1159 1 45 LEU H 1 45 LEU MD2 3.125 . 4.450 4.320 4.286 4.366 . 0 0 "[ . 1]" 1
1160 1 45 LEU H 1 45 LEU HG 3.650 . 5.500 4.505 4.492 4.522 . 0 0 "[ . 1]" 1
1161 1 45 LEU H 1 55 TRP HH2 3.495 . 5.190 3.980 3.932 4.044 . 0 0 "[ . 1]" 1
1162 1 45 LEU H 1 55 TRP HZ3 3.140 . 4.480 2.796 2.750 2.878 . 0 0 "[ . 1]" 1
1163 1 45 LEU HA 1 45 LEU MD1 2.235 . 2.670 2.058 2.032 2.095 . 0 0 "[ . 1]" 1
1164 1 45 LEU HA 1 45 LEU MD2 2.840 . 3.880 3.883 3.872 3.896 0.016 8 0 "[ . 1]" 1
1165 1 45 LEU HA 1 45 LEU HG 2.920 . 4.040 3.074 3.053 3.095 . 0 0 "[ . 1]" 1
1166 1 45 LEU HA 1 46 ILE H 2.470 . 3.140 2.113 2.095 2.134 . 0 0 "[ . 1]" 1
1167 1 45 LEU HA 1 46 ILE HA 3.515 . 5.230 4.358 4.343 4.378 . 0 0 "[ . 1]" 1
1168 1 45 LEU HA 1 46 ILE HB 3.520 . 5.240 4.762 4.728 4.803 . 0 0 "[ . 1]" 1
1169 1 45 LEU HA 1 46 ILE MD 3.485 . 5.170 3.929 3.875 3.971 . 0 0 "[ . 1]" 1
1170 1 45 LEU HA 1 46 ILE HG12 3.210 . 4.620 3.503 3.457 3.547 . 0 0 "[ . 1]" 1
1171 1 45 LEU HA 1 54 GLN H 3.075 . 4.350 3.893 3.706 3.960 . 0 0 "[ . 1]" 1
1172 1 45 LEU HA 1 55 TRP HA 2.335 . 2.870 2.301 2.266 2.347 . 0 0 "[ . 1]" 1
1173 1 45 LEU HA 1 55 TRP HB2 3.565 . 5.330 4.965 4.934 4.990 . 0 0 "[ . 1]" 1
1174 1 45 LEU HA 1 55 TRP HB3 3.425 . 5.050 4.573 4.550 4.623 . 0 0 "[ . 1]" 1
1175 1 45 LEU HA 1 55 TRP HD1 3.650 . 5.500 5.208 5.182 5.254 . 0 0 "[ . 1]" 1
1176 1 45 LEU HA 1 55 TRP HE3 2.850 . 3.900 3.592 3.573 3.617 . 0 0 "[ . 1]" 1
1177 1 45 LEU HA 1 55 TRP HZ2 3.650 . 5.500 5.515 5.495 5.550 0.050 10 0 "[ . 1]" 1
1178 1 45 LEU HA 1 55 TRP HZ3 3.260 . 4.720 4.560 4.531 4.589 . 0 0 "[ . 1]" 1
1179 1 45 LEU HA 1 56 CYS H 2.910 . 4.020 3.491 3.406 3.553 . 0 0 "[ . 1]" 1
1180 1 45 LEU HB2 1 45 LEU MD1 2.430 . 3.060 2.394 2.374 2.425 . 0 0 "[ . 1]" 1
1181 1 45 LEU HB2 1 45 LEU MD2 2.425 . 3.050 2.365 2.332 2.430 . 0 0 "[ . 1]" 1
1182 1 45 LEU HB2 1 46 ILE H 3.400 . 5.000 4.405 4.392 4.424 . 0 0 "[ . 1]" 1
1183 1 45 LEU HB2 1 55 TRP HA 3.145 . 4.490 4.103 4.048 4.164 . 0 0 "[ . 1]" 1
1184 1 45 LEU HB2 1 55 TRP HD1 3.650 . 5.500 5.267 5.231 5.304 . 0 0 "[ . 1]" 1
1185 1 45 LEU HB2 1 55 TRP HE3 3.110 . 4.420 3.719 3.652 3.772 . 0 0 "[ . 1]" 1
1186 1 45 LEU HB2 1 55 TRP HH2 2.915 . 4.030 3.167 3.125 3.198 . 0 0 "[ . 1]" 1
1187 1 45 LEU HB2 1 55 TRP HZ2 2.935 . 4.070 3.261 3.231 3.285 . 0 0 "[ . 1]" 1
1188 1 45 LEU HB2 1 55 TRP HZ3 2.975 . 4.150 3.398 3.348 3.447 . 0 0 "[ . 1]" 1
1189 1 45 LEU HB3 1 45 LEU MD1 2.595 . 3.390 3.191 3.181 3.200 . 0 0 "[ . 1]" 1
1190 1 45 LEU HB3 1 45 LEU MD2 2.625 . 3.450 2.326 2.306 2.351 . 0 0 "[ . 1]" 1
1191 1 45 LEU HB3 1 55 TRP HA 3.610 . 5.420 5.118 5.078 5.134 . 0 0 "[ . 1]" 1
1192 1 45 LEU HB3 1 55 TRP HH2 3.030 . 4.260 4.135 4.093 4.170 . 0 0 "[ . 1]" 1
1193 1 45 LEU HB3 1 55 TRP HZ2 3.190 . 4.580 4.587 4.561 4.609 0.029 2 0 "[ . 1]" 1
1194 1 45 LEU HB3 1 55 TRP HZ3 3.120 . 4.440 4.372 4.299 4.420 . 0 0 "[ . 1]" 1
1195 1 45 LEU MD1 1 46 ILE H 2.760 . 3.720 2.780 2.713 2.890 . 0 0 "[ . 1]" 1
1196 1 45 LEU MD1 1 46 ILE HA 3.425 . 5.050 4.884 4.821 4.988 . 0 0 "[ . 1]" 1
1197 1 45 LEU MD1 1 53 GLU HA 3.315 . 4.830 3.609 3.554 3.696 . 0 0 "[ . 1]" 1
1198 1 45 LEU MD1 1 53 GLU HB2 3.095 . 4.390 2.942 2.818 3.335 . 0 0 "[ . 1]" 1
1199 1 45 LEU MD1 1 53 GLU HB3 2.795 . 3.790 2.156 2.029 2.345 . 0 0 "[ . 1]" 1
1200 1 45 LEU MD1 1 53 GLU HG2 3.270 . 4.740 4.215 3.941 4.442 . 0 0 "[ . 1]" 1
1201 1 45 LEU MD1 1 53 GLU QG 2.960 . 4.120 3.929 3.761 4.095 . 0 0 "[ . 1]" 1
1202 1 45 LEU MD1 1 53 GLU HG3 3.270 . 4.740 4.704 4.608 4.800 0.060 9 0 "[ . 1]" 1
1203 1 45 LEU MD1 1 54 GLN H 2.690 . 3.580 2.794 2.701 2.914 . 0 0 "[ . 1]" 1
1204 1 45 LEU MD1 1 54 GLN HA 2.780 . 3.760 3.035 2.870 3.136 . 0 0 "[ . 1]" 1
1205 1 45 LEU MD1 1 55 TRP H 3.100 . 4.400 3.259 3.189 3.311 . 0 0 "[ . 1]" 1
1206 1 45 LEU MD1 1 55 TRP HA 2.470 . 3.140 3.009 2.945 3.054 . 0 0 "[ . 1]" 1
1207 1 45 LEU MD1 1 55 TRP HB2 3.280 . 4.760 4.078 4.045 4.111 . 0 0 "[ . 1]" 1
1208 1 45 LEU MD1 1 55 TRP HB3 3.355 . 4.910 4.362 4.329 4.391 . 0 0 "[ . 1]" 1
1209 1 45 LEU MD1 1 55 TRP HD1 2.560 . 3.320 3.095 3.058 3.135 . 0 0 "[ . 1]" 1
1210 1 45 LEU MD1 1 55 TRP HE1 2.675 . 3.550 2.732 2.682 2.788 . 0 0 "[ . 1]" 1
1211 1 45 LEU MD1 1 55 TRP HE3 2.965 . 4.130 4.138 4.115 4.163 0.033 9 0 "[ . 1]" 1
1212 1 45 LEU MD1 1 55 TRP HH2 3.285 . 4.770 4.654 4.594 4.711 . 0 0 "[ . 1]" 1
1213 1 45 LEU MD1 1 55 TRP HZ2 2.790 . 3.780 3.585 3.532 3.633 . 0 0 "[ . 1]" 1
1214 1 45 LEU MD1 1 55 TRP HZ3 3.360 . 4.920 4.847 4.801 4.893 . 0 0 "[ . 1]" 1
1215 1 45 LEU MD1 1 56 CYS H 3.445 . 5.090 4.551 4.452 4.596 . 0 0 "[ . 1]" 1
1216 1 45 LEU MD2 1 46 ILE HA 3.650 . 5.500 5.467 5.423 5.513 0.013 5 0 "[ . 1]" 1
1217 1 45 LEU MD2 1 53 GLU HB3 2.855 . 3.910 2.683 2.531 2.878 . 0 0 "[ . 1]" 1
1218 1 45 LEU MD2 1 53 GLU QG 2.830 . 3.860 3.750 3.541 3.951 0.091 9 0 "[ . 1]" 1
1219 1 45 LEU MD2 1 55 TRP HA 3.605 . 5.410 5.255 5.220 5.287 . 0 0 "[ . 1]" 1
1220 1 45 LEU MD2 1 55 TRP HD1 3.350 . 4.900 4.916 4.897 4.936 0.036 2 0 "[ . 1]" 1
1221 1 45 LEU MD2 1 55 TRP HE1 2.880 . 3.960 3.458 3.409 3.499 . 0 0 "[ . 1]" 1
1222 1 45 LEU MD2 1 55 TRP HE3 3.650 . 5.500 5.355 5.309 5.412 . 0 0 "[ . 1]" 1
1223 1 45 LEU MD2 1 55 TRP HH2 2.915 . 4.030 3.884 3.793 4.010 . 0 0 "[ . 1]" 1
1224 1 45 LEU MD2 1 55 TRP HZ2 2.450 . 3.100 2.804 2.704 2.900 . 0 0 "[ . 1]" 1
1225 1 45 LEU MD2 1 55 TRP HZ3 3.435 . 5.070 4.979 4.921 5.078 0.008 9 0 "[ . 1]" 1
1226 1 45 LEU HG 1 46 ILE H 3.560 . 5.320 3.387 3.325 3.440 . 0 0 "[ . 1]" 1
1227 1 45 LEU HG 1 47 ARG HA 3.650 . 5.500 4.980 4.909 5.090 . 0 0 "[ . 1]" 1
1228 1 45 LEU HG 1 53 GLU HB3 3.070 . 4.340 2.324 2.202 2.649 . 0 0 "[ . 1]" 1
1229 1 45 LEU HG 1 53 GLU QG 3.025 . 4.250 3.618 3.298 3.852 . 0 0 "[ . 1]" 1
1230 1 45 LEU HG 1 55 TRP HA 3.650 . 5.500 5.115 5.060 5.151 . 0 0 "[ . 1]" 1
1231 1 45 LEU HG 1 55 TRP HZ2 3.650 . 5.500 5.492 5.435 5.519 0.019 3 0 "[ . 1]" 1
1232 1 46 ILE H 1 46 ILE HB 2.670 . 3.540 2.726 2.703 2.743 . 0 0 "[ . 1]" 1
1233 1 46 ILE H 1 46 ILE HG12 2.850 . 3.900 2.358 2.315 2.393 . 0 0 "[ . 1]" 1
1234 1 46 ILE H 1 46 ILE HG13 3.050 . 4.300 3.851 3.808 3.884 . 0 0 "[ . 1]" 1
1235 1 46 ILE H 1 46 ILE MG 3.130 . 4.460 3.868 3.859 3.878 . 0 0 "[ . 1]" 1
1236 1 46 ILE H 1 54 GLN H 2.695 . 3.590 2.577 2.486 2.643 . 0 0 "[ . 1]" 1
1237 1 46 ILE H 1 55 TRP HA 2.935 . 4.070 3.496 3.456 3.597 . 0 0 "[ . 1]" 1
1238 1 46 ILE H 1 56 CYS H 3.335 . 4.870 3.926 3.806 4.019 . 0 0 "[ . 1]" 1
1239 1 46 ILE HA 1 46 ILE MD 2.305 . 2.810 2.132 2.088 2.185 . 0 0 "[ . 1]" 1
1240 1 46 ILE HA 1 46 ILE HG12 2.915 . 4.030 3.273 3.257 3.297 . 0 0 "[ . 1]" 1
1241 1 46 ILE HA 1 46 ILE HG13 2.920 . 4.040 3.834 3.816 3.855 . 0 0 "[ . 1]" 1
1242 1 46 ILE HA 1 46 ILE MG 2.375 . 2.950 2.309 2.288 2.325 . 0 0 "[ . 1]" 1
1243 1 46 ILE HA 1 47 ARG H 2.265 . 2.730 2.156 2.139 2.183 . 0 0 "[ . 1]" 1
1244 1 46 ILE HA 1 47 ARG HA 3.355 . 4.910 4.351 4.324 4.376 . 0 0 "[ . 1]" 1
1245 1 46 ILE HA 1 47 ARG HB2 3.510 . 5.220 4.586 4.523 4.652 . 0 0 "[ . 1]" 1
1246 1 46 ILE HA 1 47 ARG HB3 3.650 . 5.500 4.582 4.452 4.630 . 0 0 "[ . 1]" 1
1247 1 46 ILE HB 1 46 ILE MD 2.660 . 3.520 3.218 3.209 3.225 . 0 0 "[ . 1]" 1
1248 1 46 ILE HB 1 47 ARG HA 3.280 . 4.760 4.615 4.547 4.695 . 0 0 "[ . 1]" 1
1249 1 46 ILE HB 1 48 PHE QE 2.660 . 3.520 2.990 2.805 3.109 . 0 0 "[ . 1]" 1
1250 1 46 ILE HB 1 48 PHE HZ 3.000 . 4.200 3.088 2.939 3.288 . 0 0 "[ . 1]" 1
1251 1 46 ILE HB 1 54 GLN QB 3.240 . 4.680 3.669 3.466 3.857 . 0 0 "[ . 1]" 1
1252 1 46 ILE HB 1 56 CYS HB2 3.515 . 5.230 4.562 4.386 4.705 . 0 0 "[ . 1]" 1
1253 1 46 ILE MD 1 46 ILE MG 2.275 . 2.750 1.990 1.972 2.023 . 0 0 "[ . 1]" 1
1254 1 46 ILE MD 1 47 ARG H 2.960 . 4.120 3.906 3.860 3.971 . 0 0 "[ . 1]" 1
1255 1 46 ILE MD 1 48 PHE QE 3.650 . 5.500 5.112 5.036 5.186 . 0 0 "[ . 1]" 1
1256 1 46 ILE MD 1 48 PHE HZ 3.650 . 5.500 5.208 5.071 5.353 . 0 0 "[ . 1]" 1
1257 1 46 ILE MD 1 55 TRP HA 3.650 . 5.500 4.898 4.841 4.978 . 0 0 "[ . 1]" 1
1258 1 46 ILE MD 1 56 CYS HB2 3.135 . 4.470 3.519 3.409 3.659 . 0 0 "[ . 1]" 1
1259 1 46 ILE MD 1 61 LEU HA 3.650 . 5.500 5.194 5.139 5.277 . 0 0 "[ . 1]" 1
1260 1 46 ILE MD 1 61 LEU MD1 2.400 . 3.000 2.775 2.545 2.921 . 0 0 "[ . 1]" 1
1261 1 46 ILE MD 1 61 LEU MD2 2.535 . 3.270 1.837 1.809 1.866 . 0 0 "[ . 1]" 1
1262 1 46 ILE MD 1 61 LEU HG 3.220 . 4.640 3.782 3.667 3.880 . 0 0 "[ . 1]" 1
1263 1 46 ILE HG12 1 46 ILE MG 2.545 . 3.290 3.204 3.197 3.211 . 0 0 "[ . 1]" 1
1264 1 46 ILE HG12 1 48 PHE QE 3.295 . 4.790 4.789 4.646 4.835 0.045 7 0 "[ . 1]" 1
1265 1 46 ILE HG12 1 55 TRP HA 3.275 . 4.750 4.059 4.004 4.123 . 0 0 "[ . 1]" 1
1266 1 46 ILE HG12 1 56 CYS H 3.400 . 5.000 3.192 3.111 3.279 . 0 0 "[ . 1]" 1
1267 1 46 ILE HG12 1 56 CYS HB2 2.960 . 4.120 2.921 2.773 3.091 . 0 0 "[ . 1]" 1
1268 1 46 ILE HG12 1 56 CYS HB3 3.355 . 4.910 4.438 4.302 4.591 . 0 0 "[ . 1]" 1
1269 1 46 ILE HG13 1 46 ILE MG 2.445 . 3.090 2.370 2.345 2.390 . 0 0 "[ . 1]" 1
1270 1 46 ILE HG13 1 48 PHE QE 3.275 . 4.750 4.491 4.381 4.606 . 0 0 "[ . 1]" 1
1271 1 46 ILE HG13 1 56 CYS HB2 2.950 . 4.100 2.945 2.809 3.059 . 0 0 "[ . 1]" 1
1272 1 46 ILE HG13 1 56 CYS HB3 3.435 . 5.070 4.166 4.004 4.287 . 0 0 "[ . 1]" 1
1273 1 46 ILE HG13 1 61 LEU HA 3.650 . 5.500 5.403 5.267 5.490 . 0 0 "[ . 1]" 1
1274 1 46 ILE HG13 1 61 LEU MD1 3.100 . 4.400 3.856 3.704 3.988 . 0 0 "[ . 1]" 1
1275 1 46 ILE HG13 1 61 LEU MD2 3.110 . 4.420 2.383 2.307 2.472 . 0 0 "[ . 1]" 1
1276 1 46 ILE MG 1 47 ARG HA 3.080 . 4.360 3.914 3.833 3.969 . 0 0 "[ . 1]" 1
1277 1 46 ILE MG 1 48 PHE H 3.320 . 4.840 4.061 3.860 4.243 . 0 0 "[ . 1]" 1
1278 1 46 ILE MG 1 48 PHE HA 3.080 . 4.360 3.582 3.198 3.836 . 0 0 "[ . 1]" 1
1279 1 46 ILE MG 1 48 PHE HB3 3.650 . 5.500 5.046 4.837 5.206 . 0 0 "[ . 1]" 1
1280 1 46 ILE MG 1 48 PHE QD 2.990 . 4.180 3.654 3.544 3.743 . 0 0 "[ . 1]" 1
1281 1 46 ILE MG 1 48 PHE QE 2.805 . 3.810 3.227 3.101 3.364 . 0 0 "[ . 1]" 1
1282 1 46 ILE MG 1 48 PHE HZ 2.920 . 4.040 3.462 3.315 3.641 . 0 0 "[ . 1]" 1
1283 1 46 ILE MG 1 53 GLU HA 3.650 . 5.500 4.942 4.859 5.024 . 0 0 "[ . 1]" 1
1284 1 46 ILE MG 1 56 CYS HB2 3.650 . 5.500 4.828 4.706 4.936 . 0 0 "[ . 1]" 1
1285 1 47 ARG HA 1 47 ARG QD 2.950 . 4.100 3.953 3.746 4.158 0.058 7 0 "[ . 1]" 1
1286 1 47 ARG HA 1 47 ARG HG2 2.725 . 3.650 3.267 3.097 3.447 . 0 0 "[ . 1]" 1
1287 1 47 ARG HA 1 47 ARG HG3 2.590 . 3.380 2.541 2.413 2.632 . 0 0 "[ . 1]" 1
1288 1 47 ARG HA 1 48 PHE H 2.395 . 2.990 2.044 2.019 2.071 . 0 0 "[ . 1]" 1
1289 1 47 ARG HA 1 48 PHE QD 3.095 . 4.390 3.478 3.329 3.601 . 0 0 "[ . 1]" 1
1290 1 47 ARG HA 1 48 PHE QE 3.255 . 4.710 4.701 4.587 4.750 0.040 9 0 "[ . 1]" 1
1291 1 47 ARG HA 1 51 GLN HA 3.505 . 5.210 4.512 4.253 4.761 . 0 0 "[ . 1]" 1
1292 1 47 ARG HA 1 53 GLU HA 2.405 . 3.010 2.343 2.279 2.491 . 0 0 "[ . 1]" 1
1293 1 47 ARG HA 1 53 GLU HB3 3.275 . 4.750 4.185 3.896 4.344 . 0 0 "[ . 1]" 1
1294 1 47 ARG HA 1 53 GLU QG 2.840 . 3.880 2.775 2.384 3.147 . 0 0 "[ . 1]" 1
1295 1 47 ARG HA 1 54 GLN H 3.095 . 4.390 3.895 3.801 4.107 . 0 0 "[ . 1]" 1
1296 1 47 ARG HB2 1 47 ARG HD2 2.915 . 4.030 2.823 2.329 3.661 . 0 0 "[ . 1]" 1
1297 1 47 ARG HB2 1 47 ARG QD 2.485 . 3.170 2.363 2.185 2.791 . 0 0 "[ . 1]" 1
1298 1 47 ARG HB2 1 47 ARG HD3 2.915 . 4.030 2.840 2.333 3.664 . 0 0 "[ . 1]" 1
1299 1 47 ARG HB2 1 51 GLN HA 3.625 . 5.450 4.900 4.637 5.057 . 0 0 "[ . 1]" 1
1300 1 47 ARG HB2 1 53 GLU HA 3.365 . 4.930 3.795 3.665 3.993 . 0 0 "[ . 1]" 1
1301 1 47 ARG HB2 1 53 GLU QG 2.650 . 3.500 2.285 1.971 2.690 . 0 0 "[ . 1]" 1
1302 1 47 ARG HB3 1 47 ARG HD2 2.825 . 3.850 3.206 2.431 3.860 0.010 6 0 "[ . 1]" 1
1303 1 47 ARG HB3 1 47 ARG HD3 2.825 . 3.850 2.918 2.480 3.699 . 0 0 "[ . 1]" 1
1304 1 47 ARG HB3 1 51 GLN HA 3.650 . 5.500 4.896 4.524 5.153 . 0 0 "[ . 1]" 1
1305 1 47 ARG HB3 1 53 GLU QG 3.570 . 5.340 3.878 3.587 4.308 . 0 0 "[ . 1]" 1
1306 1 47 ARG QD 1 51 GLN HA 2.720 . 3.640 3.303 2.688 3.775 0.135 9 0 "[ . 1]" 1
1307 1 47 ARG QD 1 53 GLU HA 3.570 . 5.340 5.127 4.541 5.446 0.106 2 0 "[ . 1]" 1
1308 1 47 ARG HG2 1 48 PHE H 2.970 . 4.140 3.492 3.277 3.729 . 0 0 "[ . 1]" 1
1309 1 47 ARG HG2 1 51 GLN H 3.165 . 4.530 3.944 3.707 4.243 . 0 0 "[ . 1]" 1
1310 1 47 ARG HG2 1 51 GLN HA 2.675 . 3.550 2.614 2.347 3.036 . 0 0 "[ . 1]" 1
1311 1 47 ARG HG2 1 51 GLN QB 3.570 . 5.340 4.373 3.912 4.780 . 0 0 "[ . 1]" 1
1312 1 47 ARG HG2 1 53 GLU QG 3.500 . 5.200 4.107 3.720 4.684 . 0 0 "[ . 1]" 1
1313 1 47 ARG HG3 1 48 PHE H 2.750 . 3.700 3.209 2.949 3.461 . 0 0 "[ . 1]" 1
1314 1 47 ARG HG3 1 51 GLN H 3.150 . 4.500 4.223 3.952 4.463 . 0 0 "[ . 1]" 1
1315 1 47 ARG HG3 1 51 GLN HA 2.625 . 3.450 2.499 2.161 2.722 . 0 0 "[ . 1]" 1
1316 1 47 ARG HG3 1 51 GLN QB 3.570 . 5.340 3.857 3.530 4.090 . 0 0 "[ . 1]" 1
1317 1 47 ARG HG3 1 53 GLU HA 3.265 . 4.730 4.048 3.764 4.478 . 0 0 "[ . 1]" 1
1318 1 47 ARG HG3 1 53 GLU HG2 3.280 . 4.760 3.000 2.425 3.513 . 0 0 "[ . 1]" 1
1319 1 47 ARG HG3 1 53 GLU QG 2.895 . 3.990 2.727 2.308 3.334 . 0 0 "[ . 1]" 1
1320 1 47 ARG HG3 1 53 GLU HG3 3.280 . 4.760 3.249 2.613 4.148 . 0 0 "[ . 1]" 1
1321 1 48 PHE H 1 48 PHE HB2 2.575 . 3.350 2.460 2.415 2.492 . 0 0 "[ . 1]" 1
1322 1 48 PHE H 1 48 PHE HB3 2.845 . 3.890 3.616 3.590 3.640 . 0 0 "[ . 1]" 1
1323 1 48 PHE H 1 48 PHE QD 2.810 . 3.820 2.326 2.240 2.422 . 0 0 "[ . 1]" 1
1324 1 48 PHE H 1 50 ASP H 3.240 . 4.680 4.643 4.512 4.718 0.038 6 0 "[ . 1]" 1
1325 1 48 PHE H 1 51 GLN H 3.245 . 4.690 4.015 3.916 4.188 . 0 0 "[ . 1]" 1
1326 1 48 PHE H 1 51 GLN HA 3.290 . 4.780 4.005 3.775 4.252 . 0 0 "[ . 1]" 1
1327 1 48 PHE H 1 53 GLU HA 3.050 . 4.300 3.624 3.536 3.735 . 0 0 "[ . 1]" 1
1328 1 48 PHE HA 1 48 PHE QD 2.600 . 3.400 2.863 2.776 2.992 . 0 0 "[ . 1]" 1
1329 1 48 PHE HA 1 49 ASP HA 3.185 . 4.570 4.249 4.210 4.278 . 0 0 "[ . 1]" 1
1330 1 48 PHE HB2 1 49 ASP H 2.670 . 3.540 3.280 3.211 3.335 . 0 0 "[ . 1]" 1
1331 1 48 PHE HB2 1 49 ASP HA 3.460 . 5.120 5.153 5.127 5.165 0.045 4 0 "[ . 1]" 1
1332 1 48 PHE HB2 1 50 ASP H 2.560 . 3.320 2.964 2.844 3.125 . 0 0 "[ . 1]" 1
1333 1 48 PHE HB2 1 51 GLN H 3.505 . 5.210 3.741 3.422 3.930 . 0 0 "[ . 1]" 1
1334 1 48 PHE HB2 1 52 SER H 2.880 . 3.960 3.088 2.834 3.289 . 0 0 "[ . 1]" 1
1335 1 48 PHE HB2 1 52 SER QB 3.480 . 5.160 3.072 2.340 4.057 . 0 0 "[ . 1]" 1
1336 1 48 PHE HB3 1 49 ASP H 2.530 . 3.260 2.119 2.059 2.172 . 0 0 "[ . 1]" 1
1337 1 48 PHE HB3 1 49 ASP HA 3.410 . 5.020 4.690 4.556 4.740 . 0 0 "[ . 1]" 1
1338 1 48 PHE HB3 1 49 ASP HB2 3.395 . 4.990 4.608 4.385 4.787 . 0 0 "[ . 1]" 1
1339 1 48 PHE HB3 1 49 ASP QB 3.030 . 4.260 3.842 3.553 4.028 . 0 0 "[ . 1]" 1
1340 1 48 PHE HB3 1 49 ASP HB3 3.395 . 4.990 4.118 3.755 4.379 . 0 0 "[ . 1]" 1
1341 1 48 PHE HB3 1 50 ASP H 2.905 . 4.010 2.981 2.594 3.310 . 0 0 "[ . 1]" 1
1342 1 48 PHE HB3 1 51 GLN H 3.510 . 5.220 4.508 4.110 4.681 . 0 0 "[ . 1]" 1
1343 1 48 PHE HB3 1 52 SER H 3.555 . 5.310 4.659 4.415 4.876 . 0 0 "[ . 1]" 1
1344 1 48 PHE HB3 1 52 SER QB 3.650 . 5.500 4.631 3.953 5.506 0.006 7 0 "[ . 1]" 1
1345 1 48 PHE QD 1 49 ASP H 3.055 . 4.310 3.626 3.342 3.738 . 0 0 "[ . 1]" 1
1346 1 48 PHE QD 1 52 SER QB 3.105 . 4.410 2.784 2.163 3.370 . 0 0 "[ . 1]" 1
1347 1 48 PHE QD 1 53 GLU HA 3.035 . 4.270 3.696 3.591 3.828 . 0 0 "[ . 1]" 1
1348 1 48 PHE QD 1 54 GLN H 3.350 . 4.900 4.038 3.825 4.243 . 0 0 "[ . 1]" 1
1349 1 48 PHE QD 1 54 GLN QB 3.120 . 4.440 3.855 3.634 4.235 . 0 0 "[ . 1]" 1
1350 1 48 PHE QE 1 53 GLU HA 3.205 . 4.610 4.202 4.118 4.373 . 0 0 "[ . 1]" 1
1351 1 48 PHE QE 1 54 GLN H 2.905 . 4.010 3.193 2.979 3.283 . 0 0 "[ . 1]" 1
1352 1 48 PHE QE 1 54 GLN HB2 2.955 . 4.110 2.668 2.092 3.106 . 0 0 "[ . 1]" 1
1353 1 48 PHE QE 1 54 GLN QB 2.615 . 3.430 2.054 1.885 2.268 . 0 0 "[ . 1]" 1
1354 1 48 PHE QE 1 54 GLN HB3 2.955 . 4.110 2.593 1.910 3.960 . 0 0 "[ . 1]" 1
1355 1 48 PHE QE 1 54 GLN QG 3.185 . 4.570 3.536 2.353 4.084 . 0 0 "[ . 1]" 1
1356 1 48 PHE HZ 1 54 GLN QB 3.070 . 4.340 3.490 3.196 3.743 . 0 0 "[ . 1]" 1
1357 1 48 PHE HZ 1 54 GLN QG 3.570 . 5.340 4.687 4.197 5.217 . 0 0 "[ . 1]" 1
1358 1 48 PHE HZ 1 61 LEU MD2 3.650 . 5.500 5.487 5.387 5.524 0.024 1 0 "[ . 1]" 1
1359 1 49 ASP H 1 50 ASP H 2.675 . 3.550 2.598 2.478 2.781 . 0 0 "[ . 1]" 1
1360 1 49 ASP H 1 51 GLN H 3.105 . 4.410 4.004 3.916 4.118 . 0 0 "[ . 1]" 1
1361 1 49 ASP HA 1 51 GLN H 3.055 . 4.310 3.375 3.213 3.458 . 0 0 "[ . 1]" 1
1362 1 49 ASP HA 1 51 GLN HA 3.305 . 4.810 4.765 4.595 4.863 0.053 1 0 "[ . 1]" 1
1363 1 50 ASP H 1 50 ASP QB 2.525 . 3.250 2.475 2.222 2.809 . 0 0 "[ . 1]" 1
1364 1 50 ASP H 1 51 GLN H 2.505 . 3.210 2.543 2.501 2.572 . 0 0 "[ . 1]" 1
1365 1 50 ASP H 1 51 GLN HA 3.365 . 4.930 4.704 4.634 4.770 . 0 0 "[ . 1]" 1
1366 1 50 ASP H 1 51 GLN QB 3.570 . 5.340 5.343 5.305 5.368 0.028 10 0 "[ . 1]" 1
1367 1 50 ASP H 1 52 SER H 2.875 . 3.950 3.648 3.363 3.851 . 0 0 "[ . 1]" 1
1368 1 50 ASP HA 1 51 GLN HG2 3.440 . 5.080 4.152 3.458 5.108 0.028 7 0 "[ . 1]" 1
1369 1 50 ASP HA 1 51 GLN QG 3.060 . 4.320 3.473 3.402 3.574 . 0 0 "[ . 1]" 1
1370 1 50 ASP HA 1 51 GLN HG3 3.440 . 5.080 4.478 3.456 5.123 0.043 8 0 "[ . 1]" 1
1371 1 50 ASP QB 1 52 SER H 3.005 . 4.210 3.360 2.784 4.087 . 0 0 "[ . 1]" 1
1372 1 51 GLN H 1 51 GLN HA 2.255 . 2.710 2.230 2.198 2.266 . 0 0 "[ . 1]" 1
1373 1 51 GLN H 1 51 GLN HB2 2.975 . 4.150 3.616 3.590 3.634 . 0 0 "[ . 1]" 1
1374 1 51 GLN H 1 51 GLN QB 2.595 . 3.390 3.384 3.358 3.398 0.008 2 0 "[ . 1]" 1
1375 1 51 GLN H 1 51 GLN HB3 2.975 . 4.150 4.076 4.039 4.091 . 0 0 "[ . 1]" 1
1376 1 51 GLN H 1 51 GLN QE 3.530 . 5.260 3.902 2.251 5.238 . 0 0 "[ . 1]" 1
1377 1 51 GLN HA 1 51 GLN HG2 2.880 . 3.960 2.874 2.442 3.204 . 0 0 "[ . 1]" 1
1378 1 51 GLN HA 1 51 GLN HG3 2.880 . 3.960 3.501 3.024 3.791 . 0 0 "[ . 1]" 1
1379 1 51 GLN QB 1 51 GLN QG 2.050 . 2.300 2.032 1.988 2.086 . 0 0 "[ . 1]" 1
1380 1 52 SER H 1 52 SER QB 2.405 . 3.010 2.457 2.294 2.664 . 0 0 "[ . 1]" 1
1381 1 52 SER HA 1 53 GLU H 2.450 . 3.100 2.237 2.172 2.271 . 0 0 "[ . 1]" 1
1382 1 52 SER HA 1 53 GLU QG 3.230 . 4.660 3.539 3.347 3.757 . 0 0 "[ . 1]" 1
1383 1 52 SER QB 1 53 GLU H 2.630 . 3.460 3.001 2.760 3.509 0.049 8 0 "[ . 1]" 1
1384 1 52 SER QB 1 53 GLU QG 3.340 . 4.880 4.654 4.497 4.819 . 0 0 "[ . 1]" 1
1385 1 53 GLU H 1 53 GLU HB3 2.800 . 3.800 3.690 3.627 3.748 . 0 0 "[ . 1]" 1
1386 1 53 GLU HA 1 53 GLU HG2 2.780 . 3.760 2.588 2.485 2.664 . 0 0 "[ . 1]" 1
1387 1 53 GLU HA 1 53 GLU QG 2.515 . 3.230 2.456 2.368 2.541 . 0 0 "[ . 1]" 1
1388 1 53 GLU HA 1 53 GLU HG3 2.780 . 3.760 3.074 2.767 3.249 . 0 0 "[ . 1]" 1
1389 1 53 GLU HA 1 54 GLN H 2.305 . 2.810 2.161 2.072 2.232 . 0 0 "[ . 1]" 1
1390 1 53 GLU HB2 1 54 GLN H 3.070 . 4.340 4.120 3.978 4.228 . 0 0 "[ . 1]" 1
1391 1 53 GLU HB3 1 54 GLN H 2.515 . 3.230 3.250 3.132 3.283 0.053 9 0 "[ . 1]" 1
1392 1 53 GLU HB3 1 54 GLN HA 3.225 . 4.650 4.555 4.463 4.668 0.018 9 0 "[ . 1]" 1
1393 1 54 GLN H 1 54 GLN QB 2.530 . 3.260 2.642 2.574 2.742 . 0 0 "[ . 1]" 1
1394 1 54 GLN H 1 55 TRP H 3.160 . 4.520 4.379 4.333 4.419 . 0 0 "[ . 1]" 1
1395 1 54 GLN HA 1 54 GLN QG 2.725 . 3.650 2.637 2.458 3.100 . 0 0 "[ . 1]" 1
1396 1 54 GLN HA 1 55 TRP H 2.480 . 3.160 2.261 2.242 2.289 . 0 0 "[ . 1]" 1
1397 1 54 GLN HA 1 55 TRP HD1 3.110 . 4.420 4.327 4.139 4.435 0.015 3 0 "[ . 1]" 1
1398 1 54 GLN QB 1 55 TRP H 3.005 . 4.210 3.350 2.696 3.632 . 0 0 "[ . 1]" 1
1399 1 54 GLN QB 1 55 TRP HA 3.570 . 5.340 4.568 4.203 4.780 . 0 0 "[ . 1]" 1
1400 1 54 GLN QG 1 55 TRP H 3.135 . 4.470 3.008 2.439 4.125 . 0 0 "[ . 1]" 1
1401 1 55 TRP H 1 55 TRP HB3 2.765 . 3.730 3.610 3.589 3.641 . 0 0 "[ . 1]" 1
1402 1 55 TRP H 1 55 TRP HD1 2.850 . 3.900 3.130 3.051 3.210 . 0 0 "[ . 1]" 1
1403 1 55 TRP H 1 56 CYS H 3.190 . 4.580 4.289 4.220 4.348 . 0 0 "[ . 1]" 1
1404 1 55 TRP HA 1 55 TRP HD1 3.070 . 4.340 4.282 4.250 4.329 . 0 0 "[ . 1]" 1
1405 1 55 TRP HA 1 55 TRP HE3 2.580 . 3.360 2.823 2.798 2.867 . 0 0 "[ . 1]" 1
1406 1 55 TRP HA 1 55 TRP HZ3 3.335 . 4.870 4.898 4.879 4.914 0.044 4 0 "[ . 1]" 1
1407 1 55 TRP HA 1 56 CYS HB3 3.650 . 5.500 5.517 5.507 5.537 0.037 9 0 "[ . 1]" 1
1408 1 55 TRP HB2 1 55 TRP HD1 2.640 . 3.480 2.590 2.571 2.604 . 0 0 "[ . 1]" 1
1409 1 55 TRP HB3 1 55 TRP HD1 2.760 . 3.720 3.738 3.729 3.748 0.028 2 0 "[ . 1]" 1
1410 1 55 TRP HB3 1 55 TRP HE1 3.520 . 5.240 5.201 5.189 5.212 . 0 0 "[ . 1]" 1
1411 1 55 TRP HB3 1 55 TRP HE3 2.755 . 3.710 2.665 2.631 2.710 . 0 0 "[ . 1]" 1
1412 1 55 TRP HB3 1 55 TRP HZ3 3.520 . 5.240 5.029 4.983 5.076 . 0 0 "[ . 1]" 1
1413 1 55 TRP HE3 1 56 CYS H 3.180 . 4.560 3.626 3.556 3.674 . 0 0 "[ . 1]" 1
1414 1 56 CYS H 1 56 CYS HB3 2.725 . 3.650 3.671 3.656 3.688 0.038 8 0 "[ . 1]" 1
1415 1 56 CYS HA 1 60 LYS HG2 3.650 . 5.500 5.059 4.782 5.285 . 0 0 "[ . 1]" 1
1416 1 56 CYS HA 1 60 LYS HG3 3.320 . 4.840 4.199 3.508 4.611 . 0 0 "[ . 1]" 1
1417 1 56 CYS HB2 1 60 LYS HB2 3.030 . 4.260 3.831 3.644 3.937 . 0 0 "[ . 1]" 1
1418 1 56 CYS HB2 1 60 LYS HB3 3.390 . 4.980 4.821 4.304 4.985 0.005 5 0 "[ . 1]" 1
1419 1 56 CYS HB2 1 60 LYS HG3 3.540 . 5.280 5.169 4.659 5.346 0.066 9 0 "[ . 1]" 1
1420 1 56 CYS HB2 1 61 LEU MD2 3.155 . 4.510 3.311 3.201 3.463 . 0 0 "[ . 1]" 1
1421 1 56 CYS HB2 1 61 LEU HG 3.255 . 4.710 3.256 3.095 3.347 . 0 0 "[ . 1]" 1
1422 1 56 CYS HB3 1 57 GLU H 2.775 . 3.750 2.904 2.719 3.078 . 0 0 "[ . 1]" 1
1423 1 56 CYS HB3 1 60 LYS HB2 2.830 . 3.860 2.667 2.485 2.750 . 0 0 "[ . 1]" 1
1424 1 56 CYS HB3 1 60 LYS HB3 3.030 . 4.260 3.433 2.903 3.644 . 0 0 "[ . 1]" 1
1425 1 56 CYS HB3 1 60 LYS HG2 3.325 . 4.850 4.381 3.998 4.569 . 0 0 "[ . 1]" 1
1426 1 56 CYS HB3 1 60 LYS HG3 3.065 . 4.330 3.511 3.083 3.707 . 0 0 "[ . 1]" 1
1427 1 56 CYS HB3 1 61 LEU H 3.650 . 5.500 5.298 5.044 5.509 0.009 5 0 "[ . 1]" 1
1428 1 56 CYS HB3 1 61 LEU MD1 2.875 . 3.950 3.896 3.786 3.995 0.045 9 0 "[ . 1]" 1
1429 1 56 CYS HB3 1 61 LEU MD2 3.155 . 4.510 4.368 4.212 4.526 0.016 9 0 "[ . 1]" 1
1430 1 56 CYS HB3 1 61 LEU HG 3.400 . 5.000 3.701 3.563 3.851 . 0 0 "[ . 1]" 1
1431 1 57 GLU H 1 57 GLU HB2 2.620 . 3.440 2.416 2.245 2.664 . 0 0 "[ . 1]" 1
1432 1 57 GLU H 1 57 GLU HG3 2.685 . 3.570 2.414 2.117 3.364 . 0 0 "[ . 1]" 1
1433 1 57 GLU H 1 58 PRO HD2 3.645 . 5.490 4.943 4.791 5.188 . 0 0 "[ . 1]" 1
1434 1 57 GLU H 1 60 LYS HG3 2.995 . 4.190 3.154 2.371 3.461 . 0 0 "[ . 1]" 1
1435 1 57 GLU HA 1 57 GLU HG2 2.870 . 3.940 2.870 2.627 3.510 . 0 0 "[ . 1]" 1
1436 1 57 GLU HA 1 57 GLU HG3 2.760 . 3.720 2.640 2.220 2.823 . 0 0 "[ . 1]" 1
1437 1 57 GLU HA 1 58 PRO HD2 2.455 . 3.110 2.584 2.387 3.039 . 0 0 "[ . 1]" 1
1438 1 57 GLU HA 1 58 PRO HD3 2.385 . 2.970 2.128 1.975 2.400 . 0 0 "[ . 1]" 1
1439 1 57 GLU HB2 1 58 PRO HD2 2.820 . 3.840 3.738 3.487 3.894 0.054 3 0 "[ . 1]" 1
1440 1 57 GLU HB2 1 58 PRO HD3 3.340 . 4.880 4.492 3.983 4.704 . 0 0 "[ . 1]" 1
1441 1 57 GLU HB2 1 60 LYS QD 3.310 . 4.820 4.267 4.020 4.744 . 0 0 "[ . 1]" 1
1442 1 57 GLU HB2 1 60 LYS QE 3.410 . 5.020 4.486 4.191 4.694 . 0 0 "[ . 1]" 1
1443 1 57 GLU HB2 1 60 LYS HG2 3.140 . 4.480 2.292 2.025 2.882 . 0 0 "[ . 1]" 1
1444 1 57 GLU HB2 1 60 LYS HG3 3.065 . 4.330 3.393 3.129 3.827 . 0 0 "[ . 1]" 1
1445 1 57 GLU HB3 1 57 GLU HG2 2.400 . 3.000 2.241 2.154 2.291 . 0 0 "[ . 1]" 1
1446 1 57 GLU HB3 1 58 PRO HD2 2.590 . 3.380 2.199 1.916 2.378 . 0 0 "[ . 1]" 1
1447 1 57 GLU HB3 1 58 PRO HD3 2.675 . 3.550 3.325 2.693 3.532 . 0 0 "[ . 1]" 1
1448 1 57 GLU HB3 1 59 ASP H 2.620 . 3.440 2.633 2.205 2.971 . 0 0 "[ . 1]" 1
1449 1 57 GLU HG2 1 58 PRO HD2 2.960 . 4.120 3.500 3.090 4.101 . 0 0 "[ . 1]" 1
1450 1 57 GLU HG2 1 58 PRO HD3 3.015 . 4.230 4.170 3.874 4.397 0.167 4 0 "[ . 1]" 1
1451 1 57 GLU HG3 1 58 PRO HD2 3.185 . 4.570 4.325 3.360 4.617 0.047 5 0 "[ . 1]" 1
1452 1 57 GLU HG3 1 58 PRO HD3 3.195 . 4.590 4.522 3.608 4.734 0.144 2 0 "[ . 1]" 1
1453 1 58 PRO HA 1 61 LEU HA 3.650 . 5.500 5.322 5.225 5.486 . 0 0 "[ . 1]" 1
1454 1 58 PRO HA 1 61 LEU HB2 2.945 . 4.090 2.697 2.559 2.919 . 0 0 "[ . 1]" 1
1455 1 58 PRO HA 1 61 LEU HB3 3.210 . 4.620 4.256 4.125 4.466 . 0 0 "[ . 1]" 1
1456 1 58 PRO HA 1 61 LEU MD1 2.425 . 3.050 1.778 1.760 1.792 0.040 1 0 "[ . 1]" 1
1457 1 58 PRO HA 1 61 LEU MD2 3.175 . 4.550 4.214 4.155 4.332 . 0 0 "[ . 1]" 1
1458 1 58 PRO HA 1 61 LEU HG 2.880 . 3.960 3.981 3.951 4.021 0.061 4 0 "[ . 1]" 1
1459 1 58 PRO HB2 1 59 ASP HA 3.500 . 5.200 4.208 4.095 4.449 . 0 0 "[ . 1]" 1
1460 1 58 PRO HB2 1 61 LEU MD1 3.325 . 4.850 4.173 4.042 4.267 . 0 0 "[ . 1]" 1
1461 1 58 PRO HB3 1 61 LEU MD1 2.615 . 3.430 3.414 3.342 3.448 0.018 10 0 "[ . 1]" 1
1462 1 58 PRO HD2 1 59 ASP H 2.960 . 4.120 2.741 2.498 3.052 . 0 0 "[ . 1]" 1
1463 1 58 PRO HD3 1 59 ASP H 3.175 . 4.550 3.900 3.695 4.122 . 0 0 "[ . 1]" 1
1464 1 58 PRO HG2 1 61 LEU MD1 3.575 . 5.350 4.942 4.897 5.001 . 0 0 "[ . 1]" 1
1465 1 58 PRO HG3 1 61 LEU MD1 3.650 . 5.500 4.362 3.980 4.975 . 0 0 "[ . 1]" 1
1466 1 59 ASP H 1 59 ASP HB2 2.725 . 3.650 3.079 2.587 3.697 0.047 3 0 "[ . 1]" 1
1467 1 59 ASP H 1 59 ASP QB 2.420 . 3.040 2.349 2.150 2.619 . 0 0 "[ . 1]" 1
1468 1 59 ASP H 1 59 ASP HB3 2.725 . 3.650 2.458 2.248 2.683 . 0 0 "[ . 1]" 1
1469 1 59 ASP H 1 60 LYS H 2.645 . 3.490 2.570 2.444 2.696 . 0 0 "[ . 1]" 1
1470 1 59 ASP H 1 61 LEU H 3.520 . 5.240 3.993 3.862 4.117 . 0 0 "[ . 1]" 1
1471 1 59 ASP HA 1 59 ASP QB 2.225 . 2.650 2.254 2.180 2.372 . 0 0 "[ . 1]" 1
1472 1 59 ASP HA 1 61 LEU H 3.125 . 4.450 3.863 3.695 4.037 . 0 0 "[ . 1]" 1
1473 1 59 ASP HA 1 61 LEU MD1 3.605 . 5.410 5.333 5.223 5.442 0.032 5 0 "[ . 1]" 1
1474 1 59 ASP QB 1 60 LYS H 2.955 . 4.110 3.238 2.861 3.802 . 0 0 "[ . 1]" 1
1475 1 59 ASP QB 1 60 LYS QD 3.570 . 5.340 4.094 3.759 4.488 . 0 0 "[ . 1]" 1
1476 1 59 ASP QB 1 60 LYS HG2 3.500 . 5.200 3.782 3.097 4.550 . 0 0 "[ . 1]" 1
1477 1 59 ASP QB 1 61 LEU H 3.570 . 5.340 4.716 4.516 4.948 . 0 0 "[ . 1]" 1
1478 1 60 LYS H 1 60 LYS HB2 2.550 . 3.300 2.429 2.293 2.485 . 0 0 "[ . 1]" 1
1479 1 60 LYS H 1 60 LYS HB3 2.770 . 3.740 3.623 3.548 3.646 . 0 0 "[ . 1]" 1
1480 1 60 LYS H 1 61 LEU H 2.580 . 3.360 2.249 2.123 2.340 . 0 0 "[ . 1]" 1
1481 1 60 LYS H 1 61 LEU MD1 3.245 . 4.690 3.502 3.399 3.677 . 0 0 "[ . 1]" 1
1482 1 60 LYS H 1 61 LEU HG 3.135 . 4.470 4.163 4.069 4.345 . 0 0 "[ . 1]" 1
1483 1 60 LYS HA 1 60 LYS QD 2.380 . 2.960 2.059 1.925 2.241 . 0 0 "[ . 1]" 1
1484 1 60 LYS HA 1 60 LYS QE 2.990 . 4.180 4.049 3.944 4.209 0.029 7 0 "[ . 1]" 1
1485 1 60 LYS HA 1 60 LYS HG2 2.650 . 3.500 3.102 2.849 3.160 . 0 0 "[ . 1]" 1
1486 1 60 LYS HA 1 60 LYS HG3 2.870 . 3.940 3.741 3.686 3.805 . 0 0 "[ . 1]" 1
1487 1 60 LYS HA 1 61 LEU MD1 3.650 . 5.500 5.378 5.315 5.474 . 0 0 "[ . 1]" 1
1488 1 60 LYS HB2 1 60 LYS QD 2.620 . 3.440 3.281 3.215 3.310 . 0 0 "[ . 1]" 1
1489 1 60 LYS HB2 1 60 LYS QE 3.090 . 4.380 4.424 4.397 4.467 0.087 4 0 "[ . 1]" 1
1490 1 60 LYS HB2 1 61 LEU H 3.060 . 4.320 3.251 3.079 3.450 . 0 0 "[ . 1]" 1
1491 1 60 LYS HB2 1 61 LEU MD1 3.100 . 4.400 3.708 3.433 3.939 . 0 0 "[ . 1]" 1
1492 1 60 LYS HB3 1 60 LYS QD 2.595 . 3.390 2.384 2.200 2.459 . 0 0 "[ . 1]" 1
1493 1 60 LYS HB3 1 60 LYS QE 3.185 . 4.570 3.898 3.785 4.006 . 0 0 "[ . 1]" 1
1494 1 60 LYS HB3 1 61 LEU H 3.160 . 4.520 4.055 3.888 4.189 . 0 0 "[ . 1]" 1
1495 1 60 LYS HB3 1 61 LEU MD1 3.590 . 5.380 4.960 4.633 5.120 . 0 0 "[ . 1]" 1
1496 1 60 LYS HB3 1 61 LEU MD2 3.595 . 5.390 5.327 5.092 5.414 0.024 10 0 "[ . 1]" 1
1497 1 60 LYS QD 1 60 LYS QE 2.265 . 2.730 1.969 1.922 1.999 . 0 0 "[ . 1]" 1
1498 1 60 LYS QD 1 60 LYS HG2 2.185 . 2.570 2.302 2.248 2.340 . 0 0 "[ . 1]" 1
1499 1 60 LYS QE 1 60 LYS HG2 2.610 . 3.420 2.943 2.579 3.114 . 0 0 "[ . 1]" 1
1500 1 60 LYS QE 1 60 LYS HG3 2.575 . 3.350 2.433 2.336 2.895 . 0 0 "[ . 1]" 1
1501 1 61 LEU H 1 61 LEU HB3 2.745 . 3.690 3.566 3.542 3.612 . 0 0 "[ . 1]" 1
1502 1 61 LEU H 1 61 LEU MD1 2.845 . 3.890 2.952 2.843 3.039 . 0 0 "[ . 1]" 1
1503 1 61 LEU H 1 61 LEU MD2 3.285 . 4.770 4.139 4.084 4.222 . 0 0 "[ . 1]" 1
1504 1 61 LEU H 1 62 ARG H 3.185 . 4.570 4.428 4.374 4.485 . 0 0 "[ . 1]" 1
1505 1 61 LEU H 1 62 ARG HG2 3.220 . 4.640 4.622 4.434 4.705 0.065 1 0 "[ . 1]" 1
1506 1 61 LEU HA 1 61 LEU MD1 2.920 . 4.040 3.772 3.759 3.787 . 0 0 "[ . 1]" 1
1507 1 61 LEU HA 1 61 LEU MD2 2.360 . 2.920 2.658 2.604 2.717 . 0 0 "[ . 1]" 1
1508 1 61 LEU HA 1 61 LEU HG 2.560 . 3.320 2.547 2.529 2.586 . 0 0 "[ . 1]" 1
1509 1 61 LEU HA 1 62 ARG HG2 3.265 . 4.730 3.754 3.593 3.880 . 0 0 "[ . 1]" 1
1510 1 61 LEU HB2 1 61 LEU MD1 2.520 . 3.240 2.136 2.113 2.151 . 0 0 "[ . 1]" 1
1511 1 61 LEU HB2 1 61 LEU MD2 2.610 . 3.420 2.956 2.940 2.966 . 0 0 "[ . 1]" 1
1512 1 61 LEU HB2 1 62 ARG HA 3.395 . 4.990 4.681 4.613 4.749 . 0 0 "[ . 1]" 1
1513 1 61 LEU HB3 1 61 LEU MD1 2.570 . 3.340 2.759 2.718 2.790 . 0 0 "[ . 1]" 1
1514 1 61 LEU HB3 1 61 LEU MD2 2.475 . 3.150 2.067 2.054 2.082 . 0 0 "[ . 1]" 1
1515 1 61 LEU HB3 1 62 ARG H 2.565 . 3.330 3.025 2.820 3.145 . 0 0 "[ . 1]" 1
1516 1 61 LEU HB3 1 62 ARG HA 3.260 . 4.720 4.319 4.226 4.404 . 0 0 "[ . 1]" 1
1517 1 62 ARG H 1 62 ARG HB3 2.920 . 4.040 3.817 3.744 3.848 . 0 0 "[ . 1]" 1
1518 1 62 ARG H 1 62 ARG QD 3.490 . 5.180 3.955 3.556 4.565 . 0 0 "[ . 1]" 1
1519 1 62 ARG H 1 63 LYS H 3.210 . 4.620 4.311 4.240 4.358 . 0 0 "[ . 1]" 1
1520 1 62 ARG HA 1 62 ARG HD2 2.850 . 3.900 2.885 2.152 3.952 0.052 4 0 "[ . 1]" 1
1521 1 62 ARG HA 1 62 ARG QD 2.575 . 3.350 2.214 1.948 2.977 . 0 0 "[ . 1]" 1
1522 1 62 ARG HA 1 62 ARG HD3 2.850 . 3.900 2.870 1.962 3.900 0.000 8 0 "[ . 1]" 1
1523 1 62 ARG HA 1 62 ARG HG2 2.640 . 3.480 3.142 2.976 3.314 . 0 0 "[ . 1]" 1
1524 1 62 ARG HA 1 62 ARG HG3 2.855 . 3.910 3.826 3.746 3.870 . 0 0 "[ . 1]" 1
1525 1 62 ARG HA 1 63 LYS HD2 2.765 . 3.730 3.293 2.986 3.767 0.037 5 0 "[ . 1]" 1
1526 1 62 ARG HA 1 63 LYS HD3 3.235 . 4.670 4.195 3.714 4.673 0.003 2 0 "[ . 1]" 1
1527 1 62 ARG HA 1 63 LYS QE 3.570 . 5.340 4.712 4.299 5.330 . 0 0 "[ . 1]" 1
1528 1 62 ARG HB2 1 62 ARG QD 2.660 . 3.520 3.402 3.289 3.520 0.000 8 0 "[ . 1]" 1
1529 1 62 ARG HB3 1 62 ARG HD2 2.845 . 3.890 2.913 2.431 3.647 . 0 0 "[ . 1]" 1
1530 1 62 ARG HB3 1 62 ARG QD 2.530 . 3.260 2.642 2.343 3.117 . 0 0 "[ . 1]" 1
1531 1 62 ARG HB3 1 62 ARG HD3 2.845 . 3.890 3.214 2.444 3.796 . 0 0 "[ . 1]" 1
1532 1 63 LYS H 1 63 LYS HB2 2.375 . 2.950 2.456 2.371 2.519 . 0 0 "[ . 1]" 1
1533 1 63 LYS H 1 63 LYS HD2 2.480 . 3.160 2.151 1.963 2.379 . 0 0 "[ . 1]" 1
1534 1 63 LYS H 1 63 LYS QE 3.295 . 4.790 3.960 3.856 4.230 . 0 0 "[ . 1]" 1
1535 1 63 LYS H 1 63 LYS HG3 2.705 . 3.610 3.530 3.426 3.652 0.042 5 0 "[ . 1]" 1
1536 1 63 LYS HA 1 63 LYS HD2 2.650 . 3.500 3.264 3.174 3.423 . 0 0 "[ . 1]" 1
1537 1 63 LYS HA 1 63 LYS HD3 3.010 . 4.220 4.140 3.976 4.276 0.056 7 0 "[ . 1]" 1
1538 1 63 LYS HA 1 63 LYS HE2 3.650 . 5.500 4.937 4.645 5.516 0.016 6 0 "[ . 1]" 1
1539 1 63 LYS HA 1 63 LYS HE3 3.650 . 5.500 5.452 4.929 5.589 0.089 2 0 "[ . 1]" 1
1540 1 63 LYS HA 1 63 LYS HG2 2.735 . 3.670 3.695 3.605 3.765 0.095 6 0 "[ . 1]" 1
1541 1 63 LYS HA 1 63 LYS HG3 2.625 . 3.450 2.486 2.389 2.610 . 0 0 "[ . 1]" 1
1542 1 63 LYS HA 1 64 LEU HG 3.030 . 4.260 3.952 3.792 4.074 . 0 0 "[ . 1]" 1
1543 1 63 LYS HB2 1 63 LYS HD3 2.745 . 3.690 2.338 2.265 2.376 . 0 0 "[ . 1]" 1
1544 1 63 LYS HB2 1 63 LYS HE2 3.290 . 4.780 4.565 4.200 4.742 . 0 0 "[ . 1]" 1
1545 1 63 LYS HB2 1 63 LYS QE 2.935 . 4.070 4.039 3.875 4.123 0.053 1 0 "[ . 1]" 1
1546 1 63 LYS HB2 1 63 LYS HE3 3.290 . 4.780 4.538 4.110 4.675 . 0 0 "[ . 1]" 1
1547 1 63 LYS HB2 1 67 GLY QA 3.260 . 4.720 2.926 2.024 3.950 . 0 0 "[ . 1]" 1
1548 1 63 LYS HB3 1 63 LYS QE 3.280 . 4.760 4.514 4.307 4.602 . 0 0 "[ . 1]" 1
1549 1 63 LYS HB3 1 63 LYS HG2 2.320 . 2.840 2.334 2.284 2.379 . 0 0 "[ . 1]" 1
1550 1 63 LYS HB3 1 63 LYS HG3 2.355 . 2.910 2.555 2.509 2.616 . 0 0 "[ . 1]" 1
1551 1 63 LYS HB3 1 64 LEU H 2.720 . 3.640 2.876 2.548 3.081 . 0 0 "[ . 1]" 1
1552 1 63 LYS HB3 1 64 LEU HA 3.445 . 5.090 4.769 4.632 5.050 . 0 0 "[ . 1]" 1
1553 1 63 LYS HB3 1 64 LEU HG 3.595 . 5.390 5.176 4.789 5.402 0.012 6 0 "[ . 1]" 1
1554 1 63 LYS HB3 1 65 GLY H 2.890 . 3.980 2.716 2.497 3.101 . 0 0 "[ . 1]" 1
1555 1 63 LYS HB3 1 65 GLY QA 3.570 . 5.340 4.187 3.778 4.633 . 0 0 "[ . 1]" 1
1556 1 63 LYS HB3 1 67 GLY H 3.080 . 4.360 3.999 2.878 4.391 0.031 10 0 "[ . 1]" 1
1557 1 63 LYS HB3 1 67 GLY QA 3.570 . 5.340 3.664 3.008 4.627 . 0 0 "[ . 1]" 1
1558 1 63 LYS HD2 1 63 LYS HG3 2.385 . 2.970 2.371 2.322 2.407 . 0 0 "[ . 1]" 1
1559 1 63 LYS QE 1 63 LYS HG2 2.470 . 3.140 2.757 2.417 3.023 . 0 0 "[ . 1]" 1
1560 1 63 LYS QE 1 63 LYS HG3 2.540 . 3.280 2.675 2.496 3.204 . 0 0 "[ . 1]" 1
1561 1 63 LYS HE2 1 63 LYS HG2 2.790 . 3.780 3.078 2.549 3.652 . 0 0 "[ . 1]" 1
1562 1 63 LYS HE2 1 63 LYS HG3 2.790 . 3.780 2.881 2.536 3.715 . 0 0 "[ . 1]" 1
1563 1 63 LYS HE3 1 63 LYS HG2 2.790 . 3.780 3.402 2.583 3.758 . 0 0 "[ . 1]" 1
1564 1 63 LYS HE3 1 63 LYS HG3 2.790 . 3.780 3.578 2.693 3.780 0.000 10 0 "[ . 1]" 1
1565 1 63 LYS HG2 1 67 GLY QA 3.345 . 4.890 3.097 2.014 4.620 . 0 0 "[ . 1]" 1
1566 1 64 LEU H 1 64 LEU MD1 2.825 . 3.850 3.814 3.693 3.886 0.036 1 0 "[ . 1]" 1
1567 1 64 LEU H 1 64 LEU MD2 2.825 . 3.850 2.965 2.731 3.194 . 0 0 "[ . 1]" 1
1568 1 64 LEU H 1 64 LEU HG 2.280 . 2.760 2.340 2.126 2.541 . 0 0 "[ . 1]" 1
1569 1 64 LEU HA 1 64 LEU MD1 2.865 . 3.930 3.817 3.762 3.861 . 0 0 "[ . 1]" 1
1570 1 64 LEU HA 1 64 LEU MD2 2.470 . 3.140 2.185 2.113 2.264 . 0 0 "[ . 1]" 1
1571 1 64 LEU HA 1 64 LEU HG 2.685 . 3.570 3.404 3.288 3.479 . 0 0 "[ . 1]" 1
1572 1 64 LEU QB 1 64 LEU MD2 2.260 . 2.720 2.401 2.361 2.427 . 0 0 "[ . 1]" 1
1573 1 64 LEU QB 1 65 GLY H 3.095 . 4.390 2.717 2.594 2.902 . 0 0 "[ . 1]" 1
1574 1 64 LEU QB 1 65 GLY QA 3.360 . 4.920 3.543 3.424 3.605 . 0 0 "[ . 1]" 1
1575 1 64 LEU HB2 1 64 LEU MD1 2.580 . 3.360 2.393 2.313 2.429 . 0 0 "[ . 1]" 1
1576 1 64 LEU HB2 1 64 LEU MD2 2.570 . 3.340 3.189 3.179 3.198 . 0 0 "[ . 1]" 1
1577 1 64 LEU HB3 1 64 LEU MD1 2.580 . 3.360 2.286 2.243 2.316 . 0 0 "[ . 1]" 1
1578 1 64 LEU HB3 1 64 LEU MD2 2.570 . 3.340 2.483 2.433 2.516 . 0 0 "[ . 1]" 1
1579 1 64 LEU MD1 1 65 GLY H 3.315 . 4.830 4.678 4.492 4.851 0.021 3 0 "[ . 1]" 1
1580 1 64 LEU HG 1 65 GLY H 3.275 . 4.750 4.144 3.893 4.454 . 0 0 "[ . 1]" 1
1581 1 65 GLY H 1 65 GLY QA 2.190 . 2.580 2.343 2.201 2.487 . 0 0 "[ . 1]" 1
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