NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
405132 |
1x4y   |
11128 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1x4y
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 2402
_Distance_constraint_stats_list.Viol_count 782
_Distance_constraint_stats_list.Viol_total 121.813
_Distance_constraint_stats_list.Viol_max 0.139
_Distance_constraint_stats_list.Viol_rms 0.0019
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0078
_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 6 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 PRO 0.059 0.011 12 0 "[ . 1 . 2]"
1 9 VAL 0.151 0.023 12 0 "[ . 1 . 2]"
1 10 ALA 0.064 0.023 12 0 "[ . 1 . 2]"
1 11 GLY 0.005 0.003 3 0 "[ . 1 . 2]"
1 12 PRO 0.006 0.003 17 0 "[ . 1 . 2]"
1 13 TYR 0.114 0.081 19 0 "[ . 1 . 2]"
1 14 ILE 0.007 0.003 19 0 "[ . 1 . 2]"
1 15 THR 0.106 0.095 4 0 "[ . 1 . 2]"
1 16 PHE 0.027 0.014 2 0 "[ . 1 . 2]"
1 17 THR 0.014 0.008 2 0 "[ . 1 . 2]"
1 18 ASP 0.009 0.006 20 0 "[ . 1 . 2]"
1 19 ALA 0.088 0.015 7 0 "[ . 1 . 2]"
1 20 VAL 0.061 0.009 14 0 "[ . 1 . 2]"
1 21 ASN 0.138 0.018 20 0 "[ . 1 . 2]"
1 22 GLU 0.028 0.012 12 0 "[ . 1 . 2]"
1 23 THR 0.022 0.008 13 0 "[ . 1 . 2]"
1 24 THR 0.060 0.007 1 0 "[ . 1 . 2]"
1 25 ILE 0.036 0.007 1 0 "[ . 1 . 2]"
1 26 MET 0.428 0.047 14 0 "[ . 1 . 2]"
1 27 LEU 0.038 0.009 10 0 "[ . 1 . 2]"
1 28 LYS 0.044 0.016 2 0 "[ . 1 . 2]"
1 29 TRP 0.158 0.032 14 0 "[ . 1 . 2]"
1 30 MET 0.067 0.019 5 0 "[ . 1 . 2]"
1 31 TYR 0.043 0.007 4 0 "[ . 1 . 2]"
1 32 ILE 0.395 0.025 16 0 "[ . 1 . 2]"
1 33 PRO 0.399 0.025 16 0 "[ . 1 . 2]"
1 34 ALA 0.133 0.050 19 0 "[ . 1 . 2]"
1 35 SER 0.018 0.007 15 0 "[ . 1 . 2]"
1 36 ASN 0.116 0.050 19 0 "[ . 1 . 2]"
1 37 ASN 0.006 0.004 19 0 "[ . 1 . 2]"
1 38 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 THR 0.022 0.004 19 0 "[ . 1 . 2]"
1 40 PRO 0.005 0.003 6 0 "[ . 1 . 2]"
1 41 ILE 0.084 0.006 19 0 "[ . 1 . 2]"
1 42 HIS 0.011 0.005 19 0 "[ . 1 . 2]"
1 43 GLY 0.044 0.014 20 0 "[ . 1 . 2]"
1 44 PHE 0.047 0.014 20 0 "[ . 1 . 2]"
1 45 TYR 0.053 0.008 19 0 "[ . 1 . 2]"
1 46 ILE 0.086 0.014 10 0 "[ . 1 . 2]"
1 47 TYR 0.095 0.009 7 0 "[ . 1 . 2]"
1 48 TYR 0.142 0.019 19 0 "[ . 1 . 2]"
1 49 ARG 0.059 0.009 19 0 "[ . 1 . 2]"
1 50 PRO 0.002 0.001 20 0 "[ . 1 . 2]"
1 51 THR 1.063 0.101 20 0 "[ . 1 . 2]"
1 52 ASP 1.063 0.101 20 0 "[ . 1 . 2]"
1 53 SER 0.019 0.016 20 0 "[ . 1 . 2]"
1 54 ASP 0.014 0.005 19 0 "[ . 1 . 2]"
1 55 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 SER 0.019 0.005 19 0 "[ . 1 . 2]"
1 58 ASP 0.005 0.005 5 0 "[ . 1 . 2]"
1 59 TYR 0.199 0.013 14 0 "[ . 1 . 2]"
1 60 LYS 0.620 0.139 15 0 "[ . 1 . 2]"
1 61 LYS 0.270 0.139 15 0 "[ . 1 . 2]"
1 62 ASP 0.018 0.014 19 0 "[ . 1 . 2]"
1 63 MET 0.094 0.014 16 0 "[ . 1 . 2]"
1 64 VAL 0.171 0.015 14 0 "[ . 1 . 2]"
1 65 GLU 0.392 0.032 20 0 "[ . 1 . 2]"
1 66 GLY 0.335 0.032 20 0 "[ . 1 . 2]"
1 67 ASP 0.053 0.053 14 0 "[ . 1 . 2]"
1 68 ARG 0.453 0.035 1 0 "[ . 1 . 2]"
1 69 TYR 0.069 0.027 20 0 "[ . 1 . 2]"
1 70 TRP 0.348 0.032 14 0 "[ . 1 . 2]"
1 71 HIS 0.307 0.047 14 0 "[ . 1 . 2]"
1 72 SER 0.086 0.015 13 0 "[ . 1 . 2]"
1 73 ILE 0.034 0.007 17 0 "[ . 1 . 2]"
1 74 SER 0.012 0.006 9 0 "[ . 1 . 2]"
1 75 HIS 0.017 0.004 1 0 "[ . 1 . 2]"
1 76 LEU 0.039 0.012 11 0 "[ . 1 . 2]"
1 77 GLN 0.034 0.012 11 0 "[ . 1 . 2]"
1 78 PRO 0.043 0.008 13 0 "[ . 1 . 2]"
1 79 GLU 0.043 0.011 11 0 "[ . 1 . 2]"
1 80 THR 0.071 0.011 11 0 "[ . 1 . 2]"
1 81 SER 0.074 0.008 11 0 "[ . 1 . 2]"
1 82 TYR 0.037 0.007 2 0 "[ . 1 . 2]"
1 83 ASP 0.038 0.016 6 0 "[ . 1 . 2]"
1 84 ILE 0.069 0.016 6 0 "[ . 1 . 2]"
1 85 LYS 0.022 0.006 9 0 "[ . 1 . 2]"
1 86 MET 0.090 0.018 12 0 "[ . 1 . 2]"
1 87 GLN 0.052 0.010 10 0 "[ . 1 . 2]"
1 88 CYS 0.028 0.016 7 0 "[ . 1 . 2]"
1 89 PHE 0.034 0.016 7 0 "[ . 1 . 2]"
1 90 ASN 0.018 0.006 5 0 "[ . 1 . 2]"
1 91 GLU 0.000 0.000 9 0 "[ . 1 . 2]"
1 92 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 GLY 0.007 0.006 13 0 "[ . 1 . 2]"
1 94 GLU 0.069 0.015 6 0 "[ . 1 . 2]"
1 95 SER 0.089 0.015 6 0 "[ . 1 . 2]"
1 96 GLU 0.047 0.021 12 0 "[ . 1 . 2]"
1 97 PHE 0.015 0.008 12 0 "[ . 1 . 2]"
1 98 SER 0.026 0.018 12 0 "[ . 1 . 2]"
1 99 ASN 0.110 0.081 19 0 "[ . 1 . 2]"
1 100 VAL 0.026 0.006 15 0 "[ . 1 . 2]"
1 101 MET 0.013 0.006 4 0 "[ . 1 . 2]"
1 102 ILE 0.131 0.013 12 0 "[ . 1 . 2]"
1 103 CYS 0.028 0.011 18 0 "[ . 1 . 2]"
1 104 GLU 0.018 0.011 18 0 "[ . 1 . 2]"
1 105 THR 0.021 0.005 5 0 "[ . 1 . 2]"
1 106 LYS 0.154 0.026 8 0 "[ . 1 . 2]"
1 107 ALA 0.051 0.014 12 0 "[ . 1 . 2]"
1 108 ARG 0.175 0.048 7 0 "[ . 1 . 2]"
1 109 SER 0.034 0.017 3 0 "[ . 1 . 2]"
1 110 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 SER 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 6 SER H 1 6 SER QB . . 3.630 2.609 2.262 3.256 . 0 0 "[ . 1 . 2]" 1
2 1 6 SER HA 1 7 GLY H . . 3.010 2.289 2.142 2.798 . 0 0 "[ . 1 . 2]" 1
3 1 6 SER HA 1 7 GLY HA2 . . 4.720 4.451 4.307 4.674 . 0 0 "[ . 1 . 2]" 1
4 1 6 SER HA 1 7 GLY QA . . 4.110 3.952 3.889 4.058 . 0 0 "[ . 1 . 2]" 1
5 1 6 SER HA 1 7 GLY HA3 . . 4.720 4.427 4.306 4.562 . 0 0 "[ . 1 . 2]" 1
6 1 6 SER QB 1 7 GLY H . . 3.920 3.213 2.287 3.890 . 0 0 "[ . 1 . 2]" 1
7 1 7 GLY H 1 8 PRO QD . . 4.820 4.095 3.100 4.360 . 0 0 "[ . 1 . 2]" 1
8 1 7 GLY H 1 92 GLY QA . . 4.620 3.688 2.485 4.456 . 0 0 "[ . 1 . 2]" 1
9 1 7 GLY QA 1 8 PRO QD . . 2.940 1.967 1.836 2.035 . 0 0 "[ . 1 . 2]" 1
10 1 7 GLY QA 1 90 ASN QD . . 4.190 2.652 1.985 3.191 . 0 0 "[ . 1 . 2]" 1
11 1 7 GLY QA 1 92 GLY H . . 4.520 3.816 3.174 4.464 . 0 0 "[ . 1 . 2]" 1
12 1 7 GLY QA 1 93 GLY H . . 4.040 3.125 2.482 3.663 . 0 0 "[ . 1 . 2]" 1
13 1 8 PRO HA 1 9 VAL H . . 3.030 2.194 2.154 2.244 . 0 0 "[ . 1 . 2]" 1
14 1 8 PRO HA 1 9 VAL MG1 . . 4.170 3.847 3.660 4.084 . 0 0 "[ . 1 . 2]" 1
15 1 8 PRO HA 1 10 ALA H . . 3.980 3.941 3.779 3.984 0.004 18 0 "[ . 1 . 2]" 1
16 1 8 PRO HA 1 39 THR MG . . 4.080 3.142 2.739 3.301 . 0 0 "[ . 1 . 2]" 1
17 1 8 PRO HB2 1 9 VAL H . . 4.090 3.354 3.066 3.968 . 0 0 "[ . 1 . 2]" 1
18 1 8 PRO HB2 1 10 ALA H . . 4.770 4.450 4.143 4.781 0.011 12 0 "[ . 1 . 2]" 1
19 1 8 PRO HB2 1 95 SER HB2 . . 4.600 3.170 2.380 3.675 . 0 0 "[ . 1 . 2]" 1
20 1 8 PRO HB2 1 95 SER QB . . 3.940 2.627 2.232 2.802 . 0 0 "[ . 1 . 2]" 1
21 1 8 PRO HB2 1 95 SER HB3 . . 4.600 3.149 2.291 4.162 . 0 0 "[ . 1 . 2]" 1
22 1 8 PRO HB3 1 11 GLY H . . 5.430 4.887 4.685 5.087 . 0 0 "[ . 1 . 2]" 1
23 1 8 PRO HB3 1 31 TYR QE . . 4.430 4.114 3.665 4.425 . 0 0 "[ . 1 . 2]" 1
24 1 8 PRO HB3 1 39 THR HB . . 5.410 5.263 4.905 5.414 0.004 13 0 "[ . 1 . 2]" 1
25 1 8 PRO HB3 1 39 THR MG . . 3.430 2.674 2.424 2.839 . 0 0 "[ . 1 . 2]" 1
26 1 8 PRO HB3 1 41 ILE MD . . 3.970 3.787 3.476 3.974 0.004 2 0 "[ . 1 . 2]" 1
27 1 8 PRO HB3 1 41 ILE MG . . 4.920 4.605 4.264 4.923 0.003 12 0 "[ . 1 . 2]" 1
28 1 8 PRO HB3 1 95 SER QB . . 4.340 4.152 3.762 4.347 0.007 12 0 "[ . 1 . 2]" 1
29 1 8 PRO QD 1 39 THR MG . . 4.430 2.184 1.922 2.824 . 0 0 "[ . 1 . 2]" 1
30 1 8 PRO QD 1 41 ILE MD . . 5.350 5.069 4.730 5.302 . 0 0 "[ . 1 . 2]" 1
31 1 8 PRO QD 1 90 ASN H . . 4.760 3.704 3.042 4.171 . 0 0 "[ . 1 . 2]" 1
32 1 8 PRO QD 1 90 ASN QD . . 3.800 2.296 1.674 2.947 . 0 0 "[ . 1 . 2]" 1
33 1 8 PRO QD 1 93 GLY H . . 4.330 2.974 2.568 3.272 . 0 0 "[ . 1 . 2]" 1
34 1 8 PRO HG2 1 11 GLY H . . 5.500 5.390 5.120 5.495 . 0 0 "[ . 1 . 2]" 1
35 1 8 PRO HG2 1 89 PHE HA . . 4.290 3.333 2.791 3.779 . 0 0 "[ . 1 . 2]" 1
36 1 8 PRO HG2 1 90 ASN H . . 4.670 4.230 3.690 4.560 . 0 0 "[ . 1 . 2]" 1
37 1 8 PRO HG2 1 95 SER H . . 4.140 3.939 3.732 4.081 . 0 0 "[ . 1 . 2]" 1
38 1 8 PRO HG2 1 95 SER HA . . 4.580 3.948 3.684 4.200 . 0 0 "[ . 1 . 2]" 1
39 1 8 PRO HG2 1 95 SER QB . . 4.310 2.472 2.062 2.951 . 0 0 "[ . 1 . 2]" 1
40 1 8 PRO HG3 1 41 ILE MD . . 4.430 3.803 3.461 4.165 . 0 0 "[ . 1 . 2]" 1
41 1 8 PRO HG3 1 41 ILE MG . . 4.570 3.161 2.827 3.476 . 0 0 "[ . 1 . 2]" 1
42 1 8 PRO HG3 1 89 PHE H . . 5.420 4.945 4.473 5.421 0.001 12 0 "[ . 1 . 2]" 1
43 1 8 PRO HG3 1 89 PHE HA . . 4.560 4.026 3.114 4.521 . 0 0 "[ . 1 . 2]" 1
44 1 8 PRO HG3 1 90 ASN H . . 4.630 4.403 3.479 4.633 0.003 3 0 "[ . 1 . 2]" 1
45 1 8 PRO HG3 1 95 SER H . . 5.500 5.436 5.223 5.509 0.009 12 0 "[ . 1 . 2]" 1
46 1 9 VAL H 1 9 VAL HB . . 3.790 3.773 3.665 3.807 0.017 19 0 "[ . 1 . 2]" 1
47 1 9 VAL H 1 9 VAL MG1 . . 3.280 2.989 2.516 3.244 . 0 0 "[ . 1 . 2]" 1
48 1 9 VAL H 1 9 VAL MG2 . . 3.720 1.966 1.876 2.097 . 0 0 "[ . 1 . 2]" 1
49 1 9 VAL H 1 10 ALA H . . 3.340 1.977 1.815 2.348 . 0 0 "[ . 1 . 2]" 1
50 1 9 VAL H 1 10 ALA MB . . 4.260 3.575 3.396 3.871 . 0 0 "[ . 1 . 2]" 1
51 1 9 VAL H 1 39 THR MG . . 5.070 4.932 4.507 5.072 0.002 12 0 "[ . 1 . 2]" 1
52 1 9 VAL HA 1 9 VAL MG1 . . 2.930 2.258 2.172 2.382 . 0 0 "[ . 1 . 2]" 1
53 1 9 VAL HA 1 9 VAL MG2 . . 3.360 3.195 3.175 3.203 . 0 0 "[ . 1 . 2]" 1
54 1 9 VAL HA 1 10 ALA H . . 3.560 3.534 3.491 3.551 . 0 0 "[ . 1 . 2]" 1
55 1 9 VAL HA 1 10 ALA MB . . 5.090 4.963 4.921 4.996 . 0 0 "[ . 1 . 2]" 1
56 1 9 VAL HA 1 95 SER HA . . 3.930 2.635 2.031 2.920 . 0 0 "[ . 1 . 2]" 1
57 1 9 VAL HA 1 96 GLU H . . 4.290 2.606 2.158 3.000 . 0 0 "[ . 1 . 2]" 1
58 1 9 VAL HB 1 10 ALA H . . 3.710 3.631 3.583 3.693 . 0 0 "[ . 1 . 2]" 1
59 1 9 VAL HB 1 10 ALA HA . . 4.440 4.407 4.280 4.463 0.023 12 0 "[ . 1 . 2]" 1
60 1 9 VAL HB 1 10 ALA MB . . 5.090 4.993 4.918 5.045 . 0 0 "[ . 1 . 2]" 1
61 1 9 VAL HB 1 11 GLY H . . 5.500 5.220 5.047 5.448 . 0 0 "[ . 1 . 2]" 1
62 1 9 VAL MG1 1 10 ALA H . . 4.230 3.943 3.845 4.162 . 0 0 "[ . 1 . 2]" 1
63 1 9 VAL MG1 1 95 SER HA . . 4.080 3.608 3.173 4.032 . 0 0 "[ . 1 . 2]" 1
64 1 9 VAL MG1 1 96 GLU QG . . 4.200 3.468 2.851 3.985 . 0 0 "[ . 1 . 2]" 1
65 1 9 VAL MG2 1 10 ALA H . . 3.470 1.992 1.884 2.145 . 0 0 "[ . 1 . 2]" 1
66 1 9 VAL MG2 1 10 ALA MB . . 3.560 3.193 3.056 3.371 . 0 0 "[ . 1 . 2]" 1
67 1 9 VAL MG2 1 11 GLY H . . 4.590 4.297 4.217 4.449 . 0 0 "[ . 1 . 2]" 1
68 1 9 VAL MG2 1 95 SER HA . . 5.500 5.290 4.851 5.504 0.004 1 0 "[ . 1 . 2]" 1
69 1 9 VAL MG2 1 96 GLU HG2 . . 4.900 4.658 4.358 4.921 0.021 12 0 "[ . 1 . 2]" 1
70 1 9 VAL MG2 1 96 GLU QG . . 4.150 3.890 3.548 4.150 0.000 5 0 "[ . 1 . 2]" 1
71 1 9 VAL MG2 1 96 GLU HG3 . . 4.900 4.273 3.642 4.852 . 0 0 "[ . 1 . 2]" 1
72 1 10 ALA H 1 10 ALA MB . . 2.950 2.184 2.050 2.257 . 0 0 "[ . 1 . 2]" 1
73 1 10 ALA H 1 11 GLY H . . 4.170 2.920 2.795 3.021 . 0 0 "[ . 1 . 2]" 1
74 1 10 ALA MB 1 11 GLY H . . 3.170 2.667 2.575 2.791 . 0 0 "[ . 1 . 2]" 1
75 1 10 ALA MB 1 31 TYR QE . . 4.570 4.368 4.113 4.571 0.001 19 0 "[ . 1 . 2]" 1
76 1 10 ALA MB 1 35 SER QB . . 3.480 3.087 1.921 3.483 0.003 10 0 "[ . 1 . 2]" 1
77 1 11 GLY H 1 12 PRO HD2 . . 4.780 4.596 4.536 4.677 . 0 0 "[ . 1 . 2]" 1
78 1 11 GLY H 1 12 PRO HD3 . . 4.500 4.338 4.231 4.487 . 0 0 "[ . 1 . 2]" 1
79 1 11 GLY H 1 96 GLU HB2 . . 4.880 4.685 4.404 4.883 0.003 3 0 "[ . 1 . 2]" 1
80 1 11 GLY H 1 96 GLU QG . . 5.340 4.834 4.405 5.261 . 0 0 "[ . 1 . 2]" 1
81 1 11 GLY QA 1 12 PRO HD3 . . 4.010 2.254 2.238 2.290 . 0 0 "[ . 1 . 2]" 1
82 1 12 PRO HA 1 13 TYR H . . 3.130 2.330 2.269 2.351 . 0 0 "[ . 1 . 2]" 1
83 1 12 PRO HA 1 31 TYR HA . . 4.130 3.248 3.015 3.504 . 0 0 "[ . 1 . 2]" 1
84 1 12 PRO HA 1 31 TYR QB . . 4.710 4.488 4.146 4.692 . 0 0 "[ . 1 . 2]" 1
85 1 12 PRO HA 1 31 TYR QD . . 4.030 3.804 3.534 4.033 0.003 17 0 "[ . 1 . 2]" 1
86 1 12 PRO HA 1 32 ILE H . . 5.040 4.482 4.008 5.008 . 0 0 "[ . 1 . 2]" 1
87 1 12 PRO HB2 1 13 TYR H . . 3.770 2.802 2.742 2.982 . 0 0 "[ . 1 . 2]" 1
88 1 12 PRO HB2 1 29 TRP HB3 . . 4.430 3.317 3.062 3.604 . 0 0 "[ . 1 . 2]" 1
89 1 12 PRO HB2 1 29 TRP HD1 . . 4.460 3.325 3.031 3.596 . 0 0 "[ . 1 . 2]" 1
90 1 12 PRO HB2 1 44 PHE QE . . 4.810 4.503 3.863 4.760 . 0 0 "[ . 1 . 2]" 1
91 1 12 PRO HB2 1 86 MET ME . . 4.480 3.401 3.012 3.993 . 0 0 "[ . 1 . 2]" 1
92 1 12 PRO HB3 1 13 TYR H . . 3.760 3.554 3.520 3.654 . 0 0 "[ . 1 . 2]" 1
93 1 12 PRO HB3 1 29 TRP HD1 . . 4.170 2.956 2.616 3.187 . 0 0 "[ . 1 . 2]" 1
94 1 12 PRO HB3 1 29 TRP HE1 . . 5.170 4.581 4.124 4.872 . 0 0 "[ . 1 . 2]" 1
95 1 12 PRO HB3 1 31 TYR QB . . 4.460 4.362 4.073 4.462 0.002 20 0 "[ . 1 . 2]" 1
96 1 12 PRO HB3 1 31 TYR QD . . 4.250 3.693 3.149 4.118 . 0 0 "[ . 1 . 2]" 1
97 1 12 PRO HB3 1 44 PHE QE . . 4.840 3.006 2.564 3.337 . 0 0 "[ . 1 . 2]" 1
98 1 12 PRO HD2 1 87 GLN HA . . 4.270 2.668 2.016 3.010 . 0 0 "[ . 1 . 2]" 1
99 1 12 PRO HD2 1 88 CYS H . . 4.380 2.452 2.144 2.812 . 0 0 "[ . 1 . 2]" 1
100 1 12 PRO HD2 1 98 SER H . . 4.720 4.453 4.168 4.696 . 0 0 "[ . 1 . 2]" 1
101 1 12 PRO HD3 1 87 GLN HA . . 4.470 3.893 3.276 4.334 . 0 0 "[ . 1 . 2]" 1
102 1 12 PRO HD3 1 88 CYS H . . 4.220 2.748 2.349 2.995 . 0 0 "[ . 1 . 2]" 1
103 1 12 PRO QG 1 13 TYR H . . 4.460 4.288 4.251 4.397 . 0 0 "[ . 1 . 2]" 1
104 1 12 PRO QG 1 31 TYR QD . . 5.500 5.038 4.503 5.350 . 0 0 "[ . 1 . 2]" 1
105 1 12 PRO QG 1 44 PHE QD . . 3.910 2.782 2.486 3.201 . 0 0 "[ . 1 . 2]" 1
106 1 12 PRO QG 1 44 PHE QE . . 3.910 3.010 2.142 3.261 . 0 0 "[ . 1 . 2]" 1
107 1 12 PRO QG 1 86 MET ME . . 3.130 2.423 2.092 3.054 . 0 0 "[ . 1 . 2]" 1
108 1 12 PRO QG 1 87 GLN H . . 4.320 4.043 3.796 4.319 . 0 0 "[ . 1 . 2]" 1
109 1 12 PRO QG 1 87 GLN HA . . 4.280 2.795 1.956 3.062 . 0 0 "[ . 1 . 2]" 1
110 1 12 PRO QG 1 88 CYS H . . 4.210 3.091 2.918 3.362 . 0 0 "[ . 1 . 2]" 1
111 1 12 PRO QG 1 88 CYS HA . . 4.830 3.951 3.682 4.165 . 0 0 "[ . 1 . 2]" 1
112 1 12 PRO QG 1 88 CYS HB2 . . 4.490 4.029 3.530 4.244 . 0 0 "[ . 1 . 2]" 1
113 1 12 PRO QG 1 88 CYS QB . . 3.910 2.434 1.982 2.644 . 0 0 "[ . 1 . 2]" 1
114 1 12 PRO QG 1 88 CYS HB3 . . 4.490 2.455 1.993 2.675 . 0 0 "[ . 1 . 2]" 1
115 1 12 PRO QG 1 98 SER H . . 4.660 4.468 3.936 4.660 . 0 0 "[ . 1 . 2]" 1
116 1 13 TYR H 1 13 TYR QB . . 3.270 2.500 2.412 2.544 . 0 0 "[ . 1 . 2]" 1
117 1 13 TYR H 1 13 TYR QD . . 4.300 4.189 4.096 4.278 . 0 0 "[ . 1 . 2]" 1
118 1 13 TYR H 1 14 ILE H . . 4.590 4.190 4.048 4.360 . 0 0 "[ . 1 . 2]" 1
119 1 13 TYR H 1 29 TRP HA . . 4.670 4.253 4.009 4.505 . 0 0 "[ . 1 . 2]" 1
120 1 13 TYR H 1 29 TRP HB2 . . 3.990 3.079 2.830 3.271 . 0 0 "[ . 1 . 2]" 1
121 1 13 TYR H 1 29 TRP HB3 . . 4.900 4.556 4.337 4.755 . 0 0 "[ . 1 . 2]" 1
122 1 13 TYR H 1 29 TRP HD1 . . 4.840 4.540 4.134 4.843 0.003 14 0 "[ . 1 . 2]" 1
123 1 13 TYR H 1 30 MET H . . 3.690 2.558 2.242 2.764 . 0 0 "[ . 1 . 2]" 1
124 1 13 TYR H 1 30 MET QB . . 4.910 4.441 4.216 4.600 . 0 0 "[ . 1 . 2]" 1
125 1 13 TYR H 1 30 MET HG2 . . 4.590 3.374 2.851 4.591 0.001 4 0 "[ . 1 . 2]" 1
126 1 13 TYR H 1 30 MET HG3 . . 4.590 3.402 2.646 3.884 . 0 0 "[ . 1 . 2]" 1
127 1 13 TYR HA 1 13 TYR QD . . 3.620 2.552 2.202 2.798 . 0 0 "[ . 1 . 2]" 1
128 1 13 TYR HA 1 14 ILE H . . 3.210 2.143 2.138 2.165 . 0 0 "[ . 1 . 2]" 1
129 1 13 TYR HA 1 14 ILE HB . . 4.910 4.697 4.650 4.786 . 0 0 "[ . 1 . 2]" 1
130 1 13 TYR HA 1 99 ASN H . . 4.000 3.561 3.135 3.800 . 0 0 "[ . 1 . 2]" 1
131 1 13 TYR QB 1 14 ILE H . . 3.980 3.805 3.642 3.888 . 0 0 "[ . 1 . 2]" 1
132 1 13 TYR QB 1 15 THR MG . . 4.110 3.529 3.304 4.072 . 0 0 "[ . 1 . 2]" 1
133 1 13 TYR QB 1 30 MET QB . . 4.970 4.302 3.904 4.714 . 0 0 "[ . 1 . 2]" 1
134 1 13 TYR QB 1 30 MET HG2 . . 3.760 2.561 2.127 3.160 . 0 0 "[ . 1 . 2]" 1
135 1 13 TYR QB 1 30 MET HG3 . . 3.760 2.911 1.992 3.624 . 0 0 "[ . 1 . 2]" 1
136 1 13 TYR QD 1 14 ILE H . . 3.940 2.871 1.919 3.640 . 0 0 "[ . 1 . 2]" 1
137 1 13 TYR QD 1 15 THR HA . . 4.820 4.728 4.534 4.818 . 0 0 "[ . 1 . 2]" 1
138 1 13 TYR QD 1 15 THR MG . . 3.150 2.443 2.050 2.811 . 0 0 "[ . 1 . 2]" 1
139 1 13 TYR QD 1 30 MET H . . 4.850 4.382 3.792 4.839 . 0 0 "[ . 1 . 2]" 1
140 1 13 TYR QD 1 30 MET QB . . 4.510 3.995 3.582 4.498 . 0 0 "[ . 1 . 2]" 1
141 1 13 TYR QD 1 30 MET ME . . 4.090 3.819 3.170 4.092 0.002 7 0 "[ . 1 . 2]" 1
142 1 13 TYR QD 1 30 MET HG2 . . 4.330 2.414 1.999 3.033 . 0 0 "[ . 1 . 2]" 1
143 1 13 TYR QD 1 30 MET QG . . 3.700 2.351 1.862 2.920 . 0 0 "[ . 1 . 2]" 1
144 1 13 TYR QD 1 30 MET HG3 . . 4.330 3.338 2.219 3.808 . 0 0 "[ . 1 . 2]" 1
145 1 13 TYR QD 1 32 ILE MD . . 4.540 3.735 3.321 4.061 . 0 0 "[ . 1 . 2]" 1
146 1 13 TYR QD 1 99 ASN H . . 4.350 3.596 2.910 4.033 . 0 0 "[ . 1 . 2]" 1
147 1 13 TYR QD 1 99 ASN HB2 . . 4.890 4.507 3.972 4.726 . 0 0 "[ . 1 . 2]" 1
148 1 13 TYR QD 1 99 ASN HB3 . . 4.460 3.373 2.499 4.541 0.081 19 0 "[ . 1 . 2]" 1
149 1 13 TYR QE 1 15 THR HA . . 3.970 3.729 3.432 3.898 . 0 0 "[ . 1 . 2]" 1
150 1 13 TYR QE 1 15 THR HB . . 4.370 3.491 2.169 4.372 0.002 19 0 "[ . 1 . 2]" 1
151 1 13 TYR QE 1 15 THR MG . . 3.530 2.313 2.005 3.391 . 0 0 "[ . 1 . 2]" 1
152 1 13 TYR QE 1 30 MET ME . . 5.100 4.852 4.292 5.102 0.002 20 0 "[ . 1 . 2]" 1
153 1 13 TYR QE 1 32 ILE MD . . 5.500 5.385 5.154 5.505 0.005 19 0 "[ . 1 . 2]" 1
154 1 13 TYR QE 1 99 ASN HB3 . . 4.360 3.866 3.303 4.373 0.013 19 0 "[ . 1 . 2]" 1
155 1 13 TYR QE 1 99 ASN HD21 . . 4.450 3.529 2.692 4.074 . 0 0 "[ . 1 . 2]" 1
156 1 13 TYR QE 1 99 ASN HD22 . . 4.850 3.180 2.263 3.743 . 0 0 "[ . 1 . 2]" 1
157 1 14 ILE H 1 14 ILE HB . . 3.450 2.593 2.554 2.647 . 0 0 "[ . 1 . 2]" 1
158 1 14 ILE H 1 14 ILE MD . . 4.040 3.201 3.031 3.479 . 0 0 "[ . 1 . 2]" 1
159 1 14 ILE H 1 14 ILE HG12 . . 4.120 3.525 3.424 3.631 . 0 0 "[ . 1 . 2]" 1
160 1 14 ILE H 1 14 ILE HG13 . . 4.510 2.031 1.913 2.151 . 0 0 "[ . 1 . 2]" 1
161 1 14 ILE H 1 14 ILE MG . . 4.100 3.771 3.763 3.790 . 0 0 "[ . 1 . 2]" 1
162 1 14 ILE H 1 98 SER QB . . 4.880 3.648 2.922 4.490 . 0 0 "[ . 1 . 2]" 1
163 1 14 ILE H 1 99 ASN H . . 4.360 3.753 3.379 4.068 . 0 0 "[ . 1 . 2]" 1
164 1 14 ILE H 1 99 ASN HD21 . . 4.300 3.454 2.271 4.303 0.003 9 0 "[ . 1 . 2]" 1
165 1 14 ILE H 1 99 ASN HD22 . . 4.210 2.773 2.121 3.234 . 0 0 "[ . 1 . 2]" 1
166 1 14 ILE H 1 101 MET QG . . 4.500 4.206 4.095 4.356 . 0 0 "[ . 1 . 2]" 1
167 1 14 ILE HA 1 14 ILE MD . . 4.070 3.913 3.897 3.935 . 0 0 "[ . 1 . 2]" 1
168 1 14 ILE HA 1 14 ILE MG . . 3.480 2.280 2.228 2.365 . 0 0 "[ . 1 . 2]" 1
169 1 14 ILE HA 1 15 THR H . . 3.410 2.144 2.139 2.163 . 0 0 "[ . 1 . 2]" 1
170 1 14 ILE HA 1 16 PHE H . . 4.640 3.441 3.309 3.518 . 0 0 "[ . 1 . 2]" 1
171 1 14 ILE HA 1 29 TRP HA . . 3.830 2.098 1.999 2.263 . 0 0 "[ . 1 . 2]" 1
172 1 14 ILE HA 1 29 TRP HB2 . . 4.500 3.693 3.510 3.939 . 0 0 "[ . 1 . 2]" 1
173 1 14 ILE HA 1 29 TRP HB3 . . 4.490 3.114 2.855 3.293 . 0 0 "[ . 1 . 2]" 1
174 1 14 ILE HA 1 30 MET H . . 4.040 3.659 3.483 3.794 . 0 0 "[ . 1 . 2]" 1
175 1 14 ILE HB 1 14 ILE MD . . 3.300 2.238 2.115 2.310 . 0 0 "[ . 1 . 2]" 1
176 1 14 ILE HB 1 15 THR H . . 4.820 4.205 4.082 4.342 . 0 0 "[ . 1 . 2]" 1
177 1 14 ILE HB 1 16 PHE H . . 5.010 4.383 4.257 4.679 . 0 0 "[ . 1 . 2]" 1
178 1 14 ILE HB 1 99 ASN H . . 5.450 5.019 4.583 5.429 . 0 0 "[ . 1 . 2]" 1
179 1 14 ILE HB 1 99 ASN HD21 . . 4.090 3.256 2.818 3.777 . 0 0 "[ . 1 . 2]" 1
180 1 14 ILE HB 1 99 ASN HD22 . . 3.970 2.062 1.897 2.418 . 0 0 "[ . 1 . 2]" 1
181 1 14 ILE HB 1 101 MET ME . . 4.050 3.149 2.757 3.582 . 0 0 "[ . 1 . 2]" 1
182 1 14 ILE HB 1 101 MET QG . . 3.210 2.063 1.951 2.241 . 0 0 "[ . 1 . 2]" 1
183 1 14 ILE MD 1 14 ILE MG . . 2.940 2.269 2.155 2.394 . 0 0 "[ . 1 . 2]" 1
184 1 14 ILE MD 1 16 PHE H . . 5.500 5.308 5.224 5.462 . 0 0 "[ . 1 . 2]" 1
185 1 14 ILE MD 1 17 THR MG . . 3.760 3.331 3.112 3.478 . 0 0 "[ . 1 . 2]" 1
186 1 14 ILE MD 1 27 LEU MD1 . . 3.110 2.441 2.154 2.820 . 0 0 "[ . 1 . 2]" 1
187 1 14 ILE MD 1 84 ILE H . . 5.300 5.174 4.985 5.297 . 0 0 "[ . 1 . 2]" 1
188 1 14 ILE MD 1 85 LYS H . . 4.610 4.373 4.143 4.579 . 0 0 "[ . 1 . 2]" 1
189 1 14 ILE MD 1 86 MET H . . 3.730 3.003 2.528 3.494 . 0 0 "[ . 1 . 2]" 1
190 1 14 ILE MD 1 86 MET HG2 . . 4.220 2.437 2.001 3.428 . 0 0 "[ . 1 . 2]" 1
191 1 14 ILE MD 1 86 MET QG . . 3.670 2.294 1.988 2.807 . 0 0 "[ . 1 . 2]" 1
192 1 14 ILE MD 1 86 MET HG3 . . 4.220 3.404 2.287 3.966 . 0 0 "[ . 1 . 2]" 1
193 1 14 ILE MD 1 98 SER H . . 5.500 5.338 4.777 5.503 0.003 19 0 "[ . 1 . 2]" 1
194 1 14 ILE MD 1 98 SER QB . . 4.690 3.101 2.505 3.537 . 0 0 "[ . 1 . 2]" 1
195 1 14 ILE MD 1 98 SER HG . . 3.680 2.478 1.981 3.350 . 0 0 "[ . 1 . 2]" 1
196 1 14 ILE MD 1 99 ASN H . . 4.310 3.875 3.526 4.268 . 0 0 "[ . 1 . 2]" 1
197 1 14 ILE MD 1 99 ASN HD22 . . 4.430 3.114 2.465 3.797 . 0 0 "[ . 1 . 2]" 1
198 1 14 ILE MD 1 100 VAL HA . . 4.290 4.032 3.811 4.286 . 0 0 "[ . 1 . 2]" 1
199 1 14 ILE MD 1 101 MET HB2 . . 4.230 2.777 2.517 3.006 . 0 0 "[ . 1 . 2]" 1
200 1 14 ILE MD 1 101 MET HB3 . . 4.190 3.953 3.769 4.158 . 0 0 "[ . 1 . 2]" 1
201 1 14 ILE MD 1 101 MET QG . . 3.350 2.109 1.917 2.392 . 0 0 "[ . 1 . 2]" 1
202 1 14 ILE HG12 1 16 PHE H . . 5.090 5.027 4.918 5.089 . 0 0 "[ . 1 . 2]" 1
203 1 14 ILE HG12 1 101 MET QG . . 4.230 3.954 3.758 4.181 . 0 0 "[ . 1 . 2]" 1
204 1 14 ILE HG13 1 98 SER QB . . 4.720 3.391 2.887 3.914 . 0 0 "[ . 1 . 2]" 1
205 1 14 ILE HG13 1 99 ASN H . . 5.500 4.499 4.029 4.983 . 0 0 "[ . 1 . 2]" 1
206 1 14 ILE MG 1 15 THR H . . 3.720 2.727 2.493 3.055 . 0 0 "[ . 1 . 2]" 1
207 1 14 ILE MG 1 16 PHE H . . 3.190 2.181 2.071 2.395 . 0 0 "[ . 1 . 2]" 1
208 1 14 ILE MG 1 16 PHE QB . . 4.690 3.905 3.750 4.068 . 0 0 "[ . 1 . 2]" 1
209 1 14 ILE MG 1 27 LEU HA . . 4.390 3.915 3.680 4.099 . 0 0 "[ . 1 . 2]" 1
210 1 14 ILE MG 1 27 LEU HB2 . . 3.890 2.656 2.418 2.873 . 0 0 "[ . 1 . 2]" 1
211 1 14 ILE MG 1 27 LEU HB3 . . 4.670 4.070 3.848 4.279 . 0 0 "[ . 1 . 2]" 1
212 1 14 ILE MG 1 27 LEU HG . . 4.950 3.823 3.557 4.012 . 0 0 "[ . 1 . 2]" 1
213 1 14 ILE MG 1 28 LYS H . . 3.800 3.165 2.978 3.379 . 0 0 "[ . 1 . 2]" 1
214 1 14 ILE MG 1 29 TRP H . . 5.150 4.843 4.688 5.062 . 0 0 "[ . 1 . 2]" 1
215 1 14 ILE MG 1 29 TRP HA . . 4.510 3.592 3.443 3.754 . 0 0 "[ . 1 . 2]" 1
216 1 14 ILE MG 1 29 TRP HB2 . . 5.390 5.063 4.920 5.231 . 0 0 "[ . 1 . 2]" 1
217 1 14 ILE MG 1 29 TRP HB3 . . 5.070 3.986 3.846 4.171 . 0 0 "[ . 1 . 2]" 1
218 1 14 ILE MG 1 30 MET H . . 5.500 5.345 5.188 5.466 . 0 0 "[ . 1 . 2]" 1
219 1 14 ILE MG 1 99 ASN HD21 . . 4.990 4.604 4.297 4.903 . 0 0 "[ . 1 . 2]" 1
220 1 14 ILE MG 1 99 ASN HD22 . . 4.450 3.642 3.446 3.969 . 0 0 "[ . 1 . 2]" 1
221 1 14 ILE MG 1 101 MET H . . 5.140 4.980 4.627 5.140 0.000 7 0 "[ . 1 . 2]" 1
222 1 14 ILE MG 1 101 MET ME . . 3.020 2.214 1.968 2.703 . 0 0 "[ . 1 . 2]" 1
223 1 14 ILE MG 1 101 MET QG . . 3.160 2.016 1.839 2.218 . 0 0 "[ . 1 . 2]" 1
224 1 15 THR H 1 15 THR MG . . 3.530 2.502 1.954 2.702 . 0 0 "[ . 1 . 2]" 1
225 1 15 THR H 1 16 PHE H . . 3.100 2.112 1.889 2.290 . 0 0 "[ . 1 . 2]" 1
226 1 15 THR H 1 16 PHE QB . . 4.880 3.811 3.730 3.957 . 0 0 "[ . 1 . 2]" 1
227 1 15 THR H 1 28 LYS H . . 4.940 4.450 4.184 4.700 . 0 0 "[ . 1 . 2]" 1
228 1 15 THR H 1 28 LYS HB2 . . 5.290 4.364 4.040 4.563 . 0 0 "[ . 1 . 2]" 1
229 1 15 THR H 1 28 LYS HB3 . . 5.310 5.193 5.055 5.310 . 1 0 "[ . 1 . 2]" 1
230 1 15 THR H 1 29 TRP H . . 5.100 4.971 4.732 5.075 . 0 0 "[ . 1 . 2]" 1
231 1 15 THR H 1 29 TRP HA . . 3.530 2.756 2.493 2.878 . 0 0 "[ . 1 . 2]" 1
232 1 15 THR H 1 29 TRP HB2 . . 5.240 5.102 4.863 5.248 0.008 2 0 "[ . 1 . 2]" 1
233 1 15 THR H 1 29 TRP HB3 . . 5.470 4.743 4.494 4.881 . 0 0 "[ . 1 . 2]" 1
234 1 15 THR H 1 30 MET H . . 4.250 4.088 3.861 4.247 . 0 0 "[ . 1 . 2]" 1
235 1 15 THR H 1 30 MET QB . . 4.900 4.505 4.252 4.814 . 0 0 "[ . 1 . 2]" 1
236 1 15 THR H 1 101 MET ME . . 5.500 4.339 4.052 4.756 . 0 0 "[ . 1 . 2]" 1
237 1 15 THR HA 1 15 THR MG . . 3.030 2.566 2.452 3.125 0.095 4 0 "[ . 1 . 2]" 1
238 1 15 THR HA 1 16 PHE H . . 3.490 3.183 3.079 3.283 . 0 0 "[ . 1 . 2]" 1
239 1 15 THR HA 1 99 ASN HD22 . . 5.500 5.090 4.230 5.500 . 0 0 "[ . 1 . 2]" 1
240 1 15 THR HA 1 101 MET ME . . 3.890 3.205 2.930 3.710 . 0 0 "[ . 1 . 2]" 1
241 1 15 THR MG 1 16 PHE H . . 4.180 3.965 2.967 4.110 . 0 0 "[ . 1 . 2]" 1
242 1 15 THR MG 1 29 TRP HA . . 4.010 3.548 3.053 3.845 . 0 0 "[ . 1 . 2]" 1
243 1 15 THR MG 1 30 MET H . . 3.940 3.161 2.812 3.538 . 0 0 "[ . 1 . 2]" 1
244 1 15 THR MG 1 30 MET HA . . 4.570 4.325 4.104 4.553 . 0 0 "[ . 1 . 2]" 1
245 1 15 THR MG 1 30 MET QB . . 3.320 2.201 2.042 2.383 . 0 0 "[ . 1 . 2]" 1
246 1 15 THR MG 1 30 MET HG2 . . 3.870 2.493 2.137 2.785 . 0 0 "[ . 1 . 2]" 1
247 1 15 THR MG 1 30 MET QG . . 3.210 2.441 2.042 2.722 . 0 0 "[ . 1 . 2]" 1
248 1 15 THR MG 1 30 MET HG3 . . 3.870 3.597 2.595 3.870 0.000 3 0 "[ . 1 . 2]" 1
249 1 16 PHE H 1 16 PHE HB2 . . 3.620 3.169 3.046 3.263 . 0 0 "[ . 1 . 2]" 1
250 1 16 PHE H 1 16 PHE HB3 . . 3.620 3.096 2.970 3.218 . 0 0 "[ . 1 . 2]" 1
251 1 16 PHE H 1 16 PHE QD . . 4.620 4.483 4.399 4.529 . 0 0 "[ . 1 . 2]" 1
252 1 16 PHE H 1 17 THR H . . 4.310 4.083 3.958 4.188 . 0 0 "[ . 1 . 2]" 1
253 1 16 PHE H 1 17 THR HA . . 5.100 4.794 4.743 4.853 . 0 0 "[ . 1 . 2]" 1
254 1 16 PHE H 1 28 LYS H . . 3.740 3.401 3.098 3.581 . 0 0 "[ . 1 . 2]" 1
255 1 16 PHE H 1 28 LYS HB2 . . 5.210 4.001 3.527 4.239 . 0 0 "[ . 1 . 2]" 1
256 1 16 PHE H 1 29 TRP HA . . 4.470 4.381 4.206 4.472 0.002 3 0 "[ . 1 . 2]" 1
257 1 16 PHE H 1 101 MET ME . . 3.920 3.444 2.999 3.835 . 0 0 "[ . 1 . 2]" 1
258 1 16 PHE H 1 101 MET QG . . 5.250 4.638 4.295 4.940 . 0 0 "[ . 1 . 2]" 1
259 1 16 PHE QB 1 17 THR H . . 3.940 3.755 3.700 3.792 . 0 0 "[ . 1 . 2]" 1
260 1 16 PHE QB 1 28 LYS H . . 3.880 2.334 1.883 2.601 . 0 0 "[ . 1 . 2]" 1
261 1 16 PHE QB 1 28 LYS HB2 . . 3.620 1.993 1.893 2.078 . 0 0 "[ . 1 . 2]" 1
262 1 16 PHE QB 1 28 LYS HB3 . . 3.770 3.558 3.395 3.664 . 0 0 "[ . 1 . 2]" 1
263 1 16 PHE QB 1 28 LYS QD . . 3.490 2.320 1.957 2.945 . 0 0 "[ . 1 . 2]" 1
264 1 16 PHE QB 1 28 LYS QG . . 4.300 3.109 2.515 3.616 . 0 0 "[ . 1 . 2]" 1
265 1 16 PHE HB2 1 17 THR H . . 4.570 4.406 4.309 4.478 . 0 0 "[ . 1 . 2]" 1
266 1 16 PHE HB2 1 28 LYS H . . 4.500 3.937 3.439 4.237 . 0 0 "[ . 1 . 2]" 1
267 1 16 PHE HB2 1 28 LYS HB2 . . 4.300 2.781 2.363 3.144 . 0 0 "[ . 1 . 2]" 1
268 1 16 PHE HB2 1 28 LYS HB3 . . 4.620 4.371 3.918 4.622 0.002 19 0 "[ . 1 . 2]" 1
269 1 16 PHE HB2 1 28 LYS HD2 . . 4.800 3.314 2.466 4.750 . 0 0 "[ . 1 . 2]" 1
270 1 16 PHE HB2 1 28 LYS HD3 . . 4.800 4.044 3.143 4.729 . 0 0 "[ . 1 . 2]" 1
271 1 16 PHE HB3 1 17 THR H . . 4.570 4.071 3.976 4.144 . 0 0 "[ . 1 . 2]" 1
272 1 16 PHE HB3 1 28 LYS H . . 4.500 2.351 1.892 2.625 . 0 0 "[ . 1 . 2]" 1
273 1 16 PHE HB3 1 28 LYS HB2 . . 4.300 2.047 1.992 2.139 . 0 0 "[ . 1 . 2]" 1
274 1 16 PHE HB3 1 28 LYS HB3 . . 4.620 3.772 3.660 3.863 . 0 0 "[ . 1 . 2]" 1
275 1 16 PHE HB3 1 28 LYS HD2 . . 4.800 2.556 2.118 3.315 . 0 0 "[ . 1 . 2]" 1
276 1 16 PHE HB3 1 28 LYS HD3 . . 4.800 3.614 1.994 4.362 . 0 0 "[ . 1 . 2]" 1
277 1 16 PHE QD 1 17 THR H . . 4.120 3.448 2.426 3.707 . 0 0 "[ . 1 . 2]" 1
278 1 16 PHE QD 1 17 THR HA . . 4.430 3.646 3.128 4.085 . 0 0 "[ . 1 . 2]" 1
279 1 16 PHE QD 1 18 ASP H . . 4.810 3.706 3.298 4.105 . 0 0 "[ . 1 . 2]" 1
280 1 16 PHE QD 1 26 MET QB . . 5.460 4.907 4.409 5.195 . 0 0 "[ . 1 . 2]" 1
281 1 16 PHE QD 1 26 MET QG . . 4.130 3.430 3.018 4.139 0.009 2 0 "[ . 1 . 2]" 1
282 1 16 PHE QD 1 27 LEU HA . . 4.260 3.363 2.749 3.683 . 0 0 "[ . 1 . 2]" 1
283 1 16 PHE QD 1 28 LYS H . . 4.210 3.431 2.683 3.764 . 0 0 "[ . 1 . 2]" 1
284 1 16 PHE QD 1 28 LYS HB2 . . 4.270 3.728 3.285 4.027 . 0 0 "[ . 1 . 2]" 1
285 1 16 PHE QD 1 28 LYS HB3 . . 5.500 5.060 4.633 5.370 . 0 0 "[ . 1 . 2]" 1
286 1 16 PHE QD 1 28 LYS HD2 . . 4.630 2.825 2.144 4.171 . 0 0 "[ . 1 . 2]" 1
287 1 16 PHE QD 1 28 LYS QD . . 4.020 2.711 1.899 3.221 . 0 0 "[ . 1 . 2]" 1
288 1 16 PHE QD 1 28 LYS HD3 . . 4.630 4.006 2.076 4.628 . 0 0 "[ . 1 . 2]" 1
289 1 16 PHE QD 1 28 LYS QE . . 4.040 3.294 2.144 3.969 . 0 0 "[ . 1 . 2]" 1
290 1 16 PHE QD 1 28 LYS QG . . 3.950 3.388 2.527 3.964 0.014 2 0 "[ . 1 . 2]" 1
291 1 16 PHE QE 1 18 ASP H . . 4.710 4.257 3.911 4.527 . 0 0 "[ . 1 . 2]" 1
292 1 16 PHE QE 1 18 ASP HB2 . . 4.140 2.803 2.025 4.124 . 0 0 "[ . 1 . 2]" 1
293 1 16 PHE QE 1 18 ASP QB . . 3.510 2.513 2.012 3.004 . 0 0 "[ . 1 . 2]" 1
294 1 16 PHE QE 1 18 ASP HB3 . . 4.140 3.414 2.090 4.125 . 0 0 "[ . 1 . 2]" 1
295 1 16 PHE QE 1 26 MET QB . . 5.020 4.514 3.449 5.016 . 0 0 "[ . 1 . 2]" 1
296 1 16 PHE QE 1 26 MET QG . . 4.100 3.504 2.603 4.068 . 0 0 "[ . 1 . 2]" 1
297 1 16 PHE QE 1 28 LYS QE . . 4.500 3.492 2.635 4.318 . 0 0 "[ . 1 . 2]" 1
298 1 16 PHE HZ 1 18 ASP QB . . 4.800 3.957 3.250 4.458 . 0 0 "[ . 1 . 2]" 1
299 1 17 THR H 1 17 THR HB . . 3.900 3.730 3.709 3.773 . 0 0 "[ . 1 . 2]" 1
300 1 17 THR H 1 17 THR MG . . 3.840 3.527 3.480 3.573 . 0 0 "[ . 1 . 2]" 1
301 1 17 THR H 1 18 ASP H . . 4.500 4.011 3.960 4.080 . 0 0 "[ . 1 . 2]" 1
302 1 17 THR H 1 18 ASP QB . . 4.870 4.390 4.011 4.817 . 0 0 "[ . 1 . 2]" 1
303 1 17 THR H 1 101 MET ME . . 4.050 3.834 3.638 4.001 . 0 0 "[ . 1 . 2]" 1
304 1 17 THR HA 1 17 THR MG . . 3.200 2.028 1.997 2.139 . 0 0 "[ . 1 . 2]" 1
305 1 17 THR HA 1 18 ASP H . . 2.980 2.148 2.143 2.152 . 0 0 "[ . 1 . 2]" 1
306 1 17 THR HA 1 18 ASP QB . . 4.570 4.245 4.108 4.381 . 0 0 "[ . 1 . 2]" 1
307 1 17 THR HA 1 25 ILE MG . . 4.340 4.045 3.875 4.167 . 0 0 "[ . 1 . 2]" 1
308 1 17 THR HA 1 26 MET H . . 5.500 5.287 5.167 5.404 . 0 0 "[ . 1 . 2]" 1
309 1 17 THR HA 1 27 LEU HA . . 3.570 2.572 2.480 2.733 . 0 0 "[ . 1 . 2]" 1
310 1 17 THR HA 1 27 LEU HB2 . . 4.490 3.216 3.064 3.486 . 0 0 "[ . 1 . 2]" 1
311 1 17 THR HA 1 27 LEU HB3 . . 4.610 3.556 3.328 3.816 . 0 0 "[ . 1 . 2]" 1
312 1 17 THR HA 1 28 LYS H . . 4.140 3.895 3.713 4.148 0.008 2 0 "[ . 1 . 2]" 1
313 1 17 THR HA 1 101 MET ME . . 4.880 4.578 4.342 4.843 . 0 0 "[ . 1 . 2]" 1
314 1 17 THR HB 1 18 ASP H . . 3.810 3.667 3.600 3.700 . 0 0 "[ . 1 . 2]" 1
315 1 17 THR HB 1 18 ASP HA . . 4.880 4.245 4.202 4.284 . 0 0 "[ . 1 . 2]" 1
316 1 17 THR HB 1 25 ILE MG . . 4.310 4.250 4.103 4.310 . 5 0 "[ . 1 . 2]" 1
317 1 17 THR HB 1 27 LEU HA . . 5.280 5.063 4.930 5.277 . 0 0 "[ . 1 . 2]" 1
318 1 17 THR HB 1 84 ILE MD . . 4.380 4.313 4.199 4.381 0.001 14 0 "[ . 1 . 2]" 1
319 1 17 THR HB 1 101 MET ME . . 3.980 3.841 3.684 3.978 . 0 0 "[ . 1 . 2]" 1
320 1 17 THR HB 1 103 CYS HA . . 5.050 3.789 3.526 3.936 . 0 0 "[ . 1 . 2]" 1
321 1 17 THR HB 1 103 CYS HB2 . . 4.060 2.357 2.174 2.521 . 0 0 "[ . 1 . 2]" 1
322 1 17 THR HB 1 103 CYS QB . . 3.540 2.339 2.162 2.496 . 0 0 "[ . 1 . 2]" 1
323 1 17 THR HB 1 103 CYS HB3 . . 4.060 3.927 3.802 4.049 . 0 0 "[ . 1 . 2]" 1
324 1 17 THR MG 1 18 ASP H . . 3.890 3.742 3.686 3.816 . 0 0 "[ . 1 . 2]" 1
325 1 17 THR MG 1 25 ILE MG . . 3.970 3.767 3.626 3.898 . 0 0 "[ . 1 . 2]" 1
326 1 17 THR MG 1 27 LEU HA . . 3.680 3.117 2.911 3.377 . 0 0 "[ . 1 . 2]" 1
327 1 17 THR MG 1 27 LEU HB2 . . 3.290 2.149 1.975 2.369 . 0 0 "[ . 1 . 2]" 1
328 1 17 THR MG 1 27 LEU HB3 . . 3.370 2.896 2.734 3.150 . 0 0 "[ . 1 . 2]" 1
329 1 17 THR MG 1 28 LYS H . . 4.230 3.874 3.583 4.059 . 0 0 "[ . 1 . 2]" 1
330 1 17 THR MG 1 84 ILE H . . 5.500 5.422 5.315 5.501 0.001 19 0 "[ . 1 . 2]" 1
331 1 17 THR MG 1 84 ILE HB . . 4.170 3.622 3.514 3.809 . 0 0 "[ . 1 . 2]" 1
332 1 17 THR MG 1 84 ILE MD . . 3.500 3.358 3.165 3.500 . 0 0 "[ . 1 . 2]" 1
333 1 17 THR MG 1 101 MET H . . 4.910 4.587 4.425 4.737 . 0 0 "[ . 1 . 2]" 1
334 1 17 THR MG 1 101 MET HB2 . . 3.200 2.435 2.220 2.580 . 0 0 "[ . 1 . 2]" 1
335 1 17 THR MG 1 101 MET HB3 . . 3.800 2.222 2.046 2.397 . 0 0 "[ . 1 . 2]" 1
336 1 17 THR MG 1 101 MET ME . . 3.030 2.279 1.961 2.765 . 0 0 "[ . 1 . 2]" 1
337 1 17 THR MG 1 101 MET QG . . 3.220 2.406 2.213 2.616 . 0 0 "[ . 1 . 2]" 1
338 1 17 THR MG 1 102 ILE H . . 5.080 4.823 4.658 5.025 . 0 0 "[ . 1 . 2]" 1
339 1 17 THR MG 1 103 CYS H . . 4.620 4.439 4.329 4.569 . 0 0 "[ . 1 . 2]" 1
340 1 17 THR MG 1 103 CYS HA . . 4.780 4.677 4.498 4.783 0.003 9 0 "[ . 1 . 2]" 1
341 1 17 THR MG 1 103 CYS HB2 . . 4.190 2.758 2.556 2.943 . 0 0 "[ . 1 . 2]" 1
342 1 17 THR MG 1 103 CYS QB . . 3.670 2.712 2.521 2.878 . 0 0 "[ . 1 . 2]" 1
343 1 17 THR MG 1 103 CYS HB3 . . 4.190 4.022 3.779 4.191 0.001 2 0 "[ . 1 . 2]" 1
344 1 18 ASP H 1 18 ASP HB2 . . 4.100 3.002 2.643 3.949 . 0 0 "[ . 1 . 2]" 1
345 1 18 ASP H 1 18 ASP HB3 . . 4.100 3.397 2.894 3.822 . 0 0 "[ . 1 . 2]" 1
346 1 18 ASP H 1 19 ALA H . . 4.520 4.371 4.262 4.428 . 0 0 "[ . 1 . 2]" 1
347 1 18 ASP H 1 20 VAL MG2 . . 4.980 4.873 4.801 4.981 0.001 1 0 "[ . 1 . 2]" 1
348 1 18 ASP H 1 25 ILE MG . . 3.680 3.310 3.061 3.497 . 0 0 "[ . 1 . 2]" 1
349 1 18 ASP H 1 26 MET H . . 3.750 3.605 3.461 3.724 . 0 0 "[ . 1 . 2]" 1
350 1 18 ASP H 1 26 MET QB . . 4.120 4.001 3.629 4.120 . 0 0 "[ . 1 . 2]" 1
351 1 18 ASP H 1 26 MET QG . . 4.550 4.030 3.739 4.409 . 0 0 "[ . 1 . 2]" 1
352 1 18 ASP H 1 27 LEU HA . . 3.920 3.379 3.244 3.608 . 0 0 "[ . 1 . 2]" 1
353 1 18 ASP HA 1 19 ALA H . . 2.590 2.271 2.181 2.364 . 0 0 "[ . 1 . 2]" 1
354 1 18 ASP QB 1 19 ALA H . . 3.450 3.020 2.571 3.411 . 0 0 "[ . 1 . 2]" 1
355 1 18 ASP QB 1 19 ALA MB . . 4.750 4.484 4.182 4.756 0.006 20 0 "[ . 1 . 2]" 1
356 1 18 ASP QB 1 26 MET H . . 5.340 4.143 3.765 4.949 . 0 0 "[ . 1 . 2]" 1
357 1 18 ASP QB 1 26 MET QB . . 5.000 3.581 3.169 4.547 . 0 0 "[ . 1 . 2]" 1
358 1 19 ALA H 1 19 ALA MB . . 2.810 2.259 2.180 2.331 . 0 0 "[ . 1 . 2]" 1
359 1 19 ALA H 1 20 VAL H . . 4.440 4.367 4.230 4.449 0.009 14 0 "[ . 1 . 2]" 1
360 1 19 ALA H 1 20 VAL HA . . 5.330 5.168 5.018 5.311 . 0 0 "[ . 1 . 2]" 1
361 1 19 ALA H 1 20 VAL MG2 . . 5.080 4.940 4.856 5.041 . 0 0 "[ . 1 . 2]" 1
362 1 19 ALA H 1 25 ILE HG12 . . 4.690 4.520 4.293 4.690 . 0 0 "[ . 1 . 2]" 1
363 1 19 ALA H 1 25 ILE MG . . 4.700 4.505 4.416 4.654 . 0 0 "[ . 1 . 2]" 1
364 1 19 ALA H 1 26 MET H . . 4.910 4.711 4.626 4.809 . 0 0 "[ . 1 . 2]" 1
365 1 19 ALA H 1 105 THR HA . . 5.440 5.144 4.819 5.404 . 0 0 "[ . 1 . 2]" 1
366 1 19 ALA H 1 106 LYS QE . . 4.760 4.024 3.428 4.761 0.001 8 0 "[ . 1 . 2]" 1
367 1 19 ALA H 1 106 LYS QG . . 4.950 4.754 4.516 4.951 0.001 12 0 "[ . 1 . 2]" 1
368 1 19 ALA HA 1 20 VAL H . . 3.140 2.148 2.141 2.166 . 0 0 "[ . 1 . 2]" 1
369 1 19 ALA HA 1 20 VAL MG2 . . 3.800 3.494 3.413 3.596 . 0 0 "[ . 1 . 2]" 1
370 1 19 ALA HA 1 21 ASN H . . 3.590 3.572 3.476 3.605 0.015 7 0 "[ . 1 . 2]" 1
371 1 19 ALA HA 1 25 ILE MD . . 4.040 3.749 3.592 3.913 . 0 0 "[ . 1 . 2]" 1
372 1 19 ALA HA 1 25 ILE HG12 . . 4.460 2.156 2.046 2.250 . 0 0 "[ . 1 . 2]" 1
373 1 19 ALA HA 1 25 ILE HG13 . . 4.480 3.533 3.236 3.754 . 0 0 "[ . 1 . 2]" 1
374 1 19 ALA HA 1 25 ILE MG . . 3.600 2.983 2.871 3.106 . 0 0 "[ . 1 . 2]" 1
375 1 19 ALA HA 1 26 MET H . . 3.590 2.983 2.834 3.074 . 0 0 "[ . 1 . 2]" 1
376 1 19 ALA MB 1 20 VAL H . . 3.500 3.308 3.209 3.421 . 0 0 "[ . 1 . 2]" 1
377 1 19 ALA MB 1 20 VAL HA . . 4.640 4.446 4.381 4.517 . 0 0 "[ . 1 . 2]" 1
378 1 19 ALA MB 1 20 VAL MG2 . . 4.560 4.473 4.404 4.560 0.000 19 0 "[ . 1 . 2]" 1
379 1 19 ALA MB 1 21 ASN H . . 3.860 3.070 2.948 3.290 . 0 0 "[ . 1 . 2]" 1
380 1 19 ALA MB 1 24 THR H . . 5.030 4.596 4.329 4.953 . 0 0 "[ . 1 . 2]" 1
381 1 19 ALA MB 1 25 ILE HA . . 3.760 3.564 3.479 3.645 . 0 0 "[ . 1 . 2]" 1
382 1 19 ALA MB 1 25 ILE MD . . 3.830 3.265 3.031 3.449 . 0 0 "[ . 1 . 2]" 1
383 1 19 ALA MB 1 25 ILE HG12 . . 3.750 2.507 2.319 2.656 . 0 0 "[ . 1 . 2]" 1
384 1 19 ALA MB 1 25 ILE MG . . 3.810 3.781 3.716 3.816 0.006 14 0 "[ . 1 . 2]" 1
385 1 19 ALA MB 1 26 MET H . . 4.620 4.544 4.428 4.609 . 0 0 "[ . 1 . 2]" 1
386 1 19 ALA MB 1 105 THR H . . 4.420 4.124 3.940 4.273 . 0 0 "[ . 1 . 2]" 1
387 1 19 ALA MB 1 105 THR HA . . 3.090 2.053 1.919 2.173 . 0 0 "[ . 1 . 2]" 1
388 1 19 ALA MB 1 105 THR MG . . 3.500 3.068 2.900 3.276 . 0 0 "[ . 1 . 2]" 1
389 1 19 ALA MB 1 106 LYS H . . 3.370 2.900 2.774 3.091 . 0 0 "[ . 1 . 2]" 1
390 1 19 ALA MB 1 106 LYS HA . . 4.020 3.923 3.831 4.005 . 0 0 "[ . 1 . 2]" 1
391 1 19 ALA MB 1 106 LYS HB3 . . 4.920 4.709 4.532 4.846 . 0 0 "[ . 1 . 2]" 1
392 1 19 ALA MB 1 106 LYS QE . . 3.220 2.581 1.965 3.220 0.000 8 0 "[ . 1 . 2]" 1
393 1 19 ALA MB 1 106 LYS QG . . 2.960 2.261 2.032 2.441 . 0 0 "[ . 1 . 2]" 1
394 1 20 VAL H 1 20 VAL HB . . 3.600 2.625 2.603 2.642 . 0 0 "[ . 1 . 2]" 1
395 1 20 VAL H 1 20 VAL MG1 . . 4.470 3.775 3.764 3.788 . 0 0 "[ . 1 . 2]" 1
396 1 20 VAL H 1 20 VAL MG2 . . 3.010 1.934 1.879 2.020 . 0 0 "[ . 1 . 2]" 1
397 1 20 VAL H 1 21 ASN H . . 2.910 2.486 2.378 2.617 . 0 0 "[ . 1 . 2]" 1
398 1 20 VAL H 1 24 THR H . . 5.200 4.883 4.731 5.077 . 0 0 "[ . 1 . 2]" 1
399 1 20 VAL H 1 24 THR HB . . 4.200 3.815 3.622 4.089 . 0 0 "[ . 1 . 2]" 1
400 1 20 VAL H 1 24 THR MG . . 4.210 3.973 3.720 4.140 . 0 0 "[ . 1 . 2]" 1
401 1 20 VAL H 1 25 ILE H . . 4.720 4.119 4.008 4.269 . 0 0 "[ . 1 . 2]" 1
402 1 20 VAL H 1 25 ILE HA . . 3.460 1.915 1.896 1.953 . 0 0 "[ . 1 . 2]" 1
403 1 20 VAL H 1 25 ILE HB . . 4.990 4.894 4.857 4.934 . 0 0 "[ . 1 . 2]" 1
404 1 20 VAL H 1 25 ILE HG12 . . 4.260 3.626 3.465 3.812 . 0 0 "[ . 1 . 2]" 1
405 1 20 VAL H 1 25 ILE HG13 . . 4.310 4.253 4.093 4.315 0.005 7 0 "[ . 1 . 2]" 1
406 1 20 VAL H 1 25 ILE MG . . 4.280 3.835 3.751 3.912 . 0 0 "[ . 1 . 2]" 1
407 1 20 VAL H 1 26 MET H . . 3.930 2.699 2.563 2.848 . 0 0 "[ . 1 . 2]" 1
408 1 20 VAL H 1 26 MET QB . . 4.240 3.719 3.523 3.854 . 0 0 "[ . 1 . 2]" 1
409 1 20 VAL HA 1 20 VAL MG1 . . 2.830 2.237 2.198 2.326 . 0 0 "[ . 1 . 2]" 1
410 1 20 VAL HA 1 20 VAL MG2 . . 2.930 2.512 2.488 2.531 . 0 0 "[ . 1 . 2]" 1
411 1 20 VAL HA 1 106 LYS QE . . 4.460 4.067 3.514 4.286 . 0 0 "[ . 1 . 2]" 1
412 1 20 VAL HB 1 21 ASN H . . 3.030 2.952 2.845 3.029 . 0 0 "[ . 1 . 2]" 1
413 1 20 VAL HB 1 24 THR H . . 5.450 4.726 4.617 4.857 . 0 0 "[ . 1 . 2]" 1
414 1 20 VAL HB 1 24 THR HB . . 3.370 2.190 2.009 2.392 . 0 0 "[ . 1 . 2]" 1
415 1 20 VAL HB 1 24 THR MG . . 3.380 2.536 2.273 2.733 . 0 0 "[ . 1 . 2]" 1
416 1 20 VAL HB 1 25 ILE H . . 4.860 4.113 3.997 4.271 . 0 0 "[ . 1 . 2]" 1
417 1 20 VAL HB 1 25 ILE HA . . 5.230 3.748 3.616 3.862 . 0 0 "[ . 1 . 2]" 1
418 1 20 VAL MG1 1 21 ASN H . . 4.160 3.862 3.774 3.921 . 0 0 "[ . 1 . 2]" 1
419 1 20 VAL MG1 1 21 ASN HB2 . . 3.640 3.598 3.449 3.643 0.003 14 0 "[ . 1 . 2]" 1
420 1 20 VAL MG1 1 21 ASN HB3 . . 5.500 4.889 4.789 4.953 . 0 0 "[ . 1 . 2]" 1
421 1 20 VAL MG1 1 21 ASN HD21 . . 4.030 3.708 3.492 3.936 . 0 0 "[ . 1 . 2]" 1
422 1 20 VAL MG1 1 21 ASN HD22 . . 4.040 3.720 3.607 3.885 . 0 0 "[ . 1 . 2]" 1
423 1 20 VAL MG1 1 24 THR HB . . 3.730 3.258 3.041 3.408 . 0 0 "[ . 1 . 2]" 1
424 1 20 VAL MG1 1 106 LYS QE . . 5.500 5.161 4.488 5.504 0.004 7 0 "[ . 1 . 2]" 1
425 1 20 VAL MG2 1 21 ASN H . . 3.840 3.802 3.769 3.838 . 0 0 "[ . 1 . 2]" 1
426 1 20 VAL MG2 1 24 THR HB . . 4.100 3.741 3.578 3.892 . 0 0 "[ . 1 . 2]" 1
427 1 20 VAL MG2 1 25 ILE HA . . 3.670 2.773 2.706 2.860 . 0 0 "[ . 1 . 2]" 1
428 1 20 VAL MG2 1 25 ILE MG . . 3.850 3.828 3.761 3.849 . 0 0 "[ . 1 . 2]" 1
429 1 20 VAL MG2 1 26 MET H . . 3.340 2.128 1.950 2.299 . 0 0 "[ . 1 . 2]" 1
430 1 20 VAL MG2 1 26 MET HA . . 4.110 3.206 3.093 3.264 . 0 0 "[ . 1 . 2]" 1
431 1 20 VAL MG2 1 26 MET QB . . 2.850 1.768 1.700 1.825 . 0 0 "[ . 1 . 2]" 1
432 1 20 VAL MG2 1 26 MET QG . . 3.490 3.408 3.307 3.497 0.007 20 0 "[ . 1 . 2]" 1
433 1 20 VAL MG2 1 27 LEU H . . 5.080 4.889 4.797 4.952 . 0 0 "[ . 1 . 2]" 1
434 1 20 VAL MG2 1 72 SER HA . . 4.620 3.852 3.668 3.998 . 0 0 "[ . 1 . 2]" 1
435 1 20 VAL MG2 1 72 SER HB2 . . 3.810 3.021 2.724 3.217 . 0 0 "[ . 1 . 2]" 1
436 1 20 VAL MG2 1 72 SER QB . . 3.270 2.852 2.637 3.001 . 0 0 "[ . 1 . 2]" 1
437 1 20 VAL MG2 1 72 SER HB3 . . 3.810 3.545 3.224 3.814 0.004 2 0 "[ . 1 . 2]" 1
438 1 20 VAL MG2 1 106 LYS QE . . 5.500 5.376 5.075 5.502 0.002 4 0 "[ . 1 . 2]" 1
439 1 21 ASN H 1 21 ASN HB2 . . 4.110 2.916 2.871 2.950 . 0 0 "[ . 1 . 2]" 1
440 1 21 ASN H 1 21 ASN HB3 . . 4.050 3.833 3.799 3.861 . 0 0 "[ . 1 . 2]" 1
441 1 21 ASN H 1 22 GLU H . . 4.380 4.361 4.353 4.370 . 0 0 "[ . 1 . 2]" 1
442 1 21 ASN H 1 23 THR H . . 4.740 4.395 4.198 4.631 . 0 0 "[ . 1 . 2]" 1
443 1 21 ASN H 1 24 THR H . . 3.540 3.115 2.994 3.209 . 0 0 "[ . 1 . 2]" 1
444 1 21 ASN H 1 24 THR HB . . 3.550 2.860 2.637 3.027 . 0 0 "[ . 1 . 2]" 1
445 1 21 ASN H 1 24 THR HG1 . . 4.690 4.483 4.282 4.691 0.001 20 0 "[ . 1 . 2]" 1
446 1 21 ASN H 1 24 THR MG . . 4.200 4.163 4.000 4.204 0.004 20 0 "[ . 1 . 2]" 1
447 1 21 ASN H 1 105 THR MG . . 4.870 4.588 4.417 4.778 . 0 0 "[ . 1 . 2]" 1
448 1 21 ASN H 1 106 LYS H . . 4.590 4.420 4.236 4.568 . 0 0 "[ . 1 . 2]" 1
449 1 21 ASN H 1 106 LYS QG . . 4.000 3.426 3.023 3.952 . 0 0 "[ . 1 . 2]" 1
450 1 21 ASN HA 1 21 ASN HD21 . . 4.730 4.360 4.336 4.373 . 0 0 "[ . 1 . 2]" 1
451 1 21 ASN HA 1 21 ASN HD22 . . 4.560 4.485 4.468 4.504 . 0 0 "[ . 1 . 2]" 1
452 1 21 ASN HA 1 22 GLU H . . 3.340 2.619 2.541 2.650 . 0 0 "[ . 1 . 2]" 1
453 1 21 ASN HA 1 23 THR H . . 4.420 4.229 4.100 4.374 . 0 0 "[ . 1 . 2]" 1
454 1 21 ASN HA 1 24 THR H . . 4.770 4.364 4.300 4.423 . 0 0 "[ . 1 . 2]" 1
455 1 21 ASN HA 1 106 LYS HB2 . . 4.420 3.199 2.941 3.375 . 0 0 "[ . 1 . 2]" 1
456 1 21 ASN HA 1 106 LYS HB3 . . 4.510 4.196 3.938 4.508 . 0 0 "[ . 1 . 2]" 1
457 1 21 ASN HA 1 106 LYS HD2 . . 3.880 3.560 2.695 3.898 0.018 20 0 "[ . 1 . 2]" 1
458 1 21 ASN HA 1 106 LYS QE . . 4.340 3.772 2.729 4.299 . 0 0 "[ . 1 . 2]" 1
459 1 21 ASN HA 1 106 LYS QG . . 3.870 2.523 1.980 3.485 . 0 0 "[ . 1 . 2]" 1
460 1 21 ASN HB2 1 21 ASN HD22 . . 3.680 3.511 3.485 3.541 . 0 0 "[ . 1 . 2]" 1
461 1 21 ASN HB2 1 22 GLU H . . 3.640 3.524 3.459 3.640 . 0 0 "[ . 1 . 2]" 1
462 1 21 ASN HB2 1 24 THR H . . 4.630 2.940 2.684 3.076 . 0 0 "[ . 1 . 2]" 1
463 1 21 ASN HB2 1 24 THR MG . . 5.110 3.646 3.536 3.773 . 0 0 "[ . 1 . 2]" 1
464 1 21 ASN HB3 1 22 GLU H . . 3.130 2.022 1.953 2.176 . 0 0 "[ . 1 . 2]" 1
465 1 21 ASN HB3 1 23 THR H . . 4.230 2.382 2.300 2.485 . 0 0 "[ . 1 . 2]" 1
466 1 21 ASN HB3 1 24 THR MG . . 5.500 4.992 4.870 5.121 . 0 0 "[ . 1 . 2]" 1
467 1 21 ASN HD21 1 23 THR H . . 4.810 4.696 4.618 4.810 0.000 3 0 "[ . 1 . 2]" 1
468 1 21 ASN HD21 1 24 THR HB . . 4.530 3.623 3.333 3.902 . 0 0 "[ . 1 . 2]" 1
469 1 21 ASN HD21 1 24 THR HG1 . . 4.660 2.593 2.300 2.985 . 0 0 "[ . 1 . 2]" 1
470 1 21 ASN HD22 1 22 GLU H . . 5.410 5.311 5.229 5.400 . 0 0 "[ . 1 . 2]" 1
471 1 21 ASN HD22 1 24 THR HB . . 5.290 4.911 4.710 5.040 . 0 0 "[ . 1 . 2]" 1
472 1 21 ASN HD22 1 24 THR HG1 . . 4.690 4.263 3.942 4.673 . 0 0 "[ . 1 . 2]" 1
473 1 22 GLU H 1 22 GLU HB2 . . 3.750 3.588 3.570 3.602 . 0 0 "[ . 1 . 2]" 1
474 1 22 GLU H 1 22 GLU HB3 . . 3.750 2.518 2.335 2.801 . 0 0 "[ . 1 . 2]" 1
475 1 22 GLU H 1 22 GLU HG2 . . 3.920 2.775 2.228 3.468 . 0 0 "[ . 1 . 2]" 1
476 1 22 GLU H 1 22 GLU HG3 . . 3.970 3.793 3.544 3.974 0.004 12 0 "[ . 1 . 2]" 1
477 1 22 GLU H 1 23 THR H . . 3.630 2.545 2.505 2.612 . 0 0 "[ . 1 . 2]" 1
478 1 22 GLU H 1 23 THR MG . . 4.780 4.592 4.445 4.706 . 0 0 "[ . 1 . 2]" 1
479 1 22 GLU H 1 24 THR H . . 4.400 3.870 3.708 3.985 . 0 0 "[ . 1 . 2]" 1
480 1 22 GLU H 1 106 LYS H . . 4.560 4.203 4.009 4.387 . 0 0 "[ . 1 . 2]" 1
481 1 22 GLU H 1 106 LYS HB2 . . 4.630 2.771 2.535 3.116 . 0 0 "[ . 1 . 2]" 1
482 1 22 GLU HA 1 22 GLU HG2 . . 3.860 3.629 3.582 3.670 . 0 0 "[ . 1 . 2]" 1
483 1 22 GLU HA 1 78 PRO HA . . 4.510 3.201 2.981 3.373 . 0 0 "[ . 1 . 2]" 1
484 1 22 GLU HA 1 78 PRO HB2 . . 5.110 4.918 4.747 5.064 . 0 0 "[ . 1 . 2]" 1
485 1 22 GLU HA 1 106 LYS H . . 3.250 1.997 1.899 2.146 . 0 0 "[ . 1 . 2]" 1
486 1 22 GLU HA 1 106 LYS HB2 . . 3.910 2.131 1.998 2.474 . 0 0 "[ . 1 . 2]" 1
487 1 22 GLU HA 1 106 LYS HB3 . . 4.700 3.603 3.204 3.906 . 0 0 "[ . 1 . 2]" 1
488 1 22 GLU HA 1 106 LYS QG . . 4.380 3.576 3.239 3.941 . 0 0 "[ . 1 . 2]" 1
489 1 22 GLU HA 1 107 ALA H . . 5.050 4.724 4.584 4.952 . 0 0 "[ . 1 . 2]" 1
490 1 22 GLU HA 1 108 ARG H . . 5.500 5.357 5.133 5.500 0.000 3 0 "[ . 1 . 2]" 1
491 1 22 GLU QB 1 23 THR MG . . 4.120 3.531 3.222 3.738 . 0 0 "[ . 1 . 2]" 1
492 1 22 GLU QB 1 78 PRO HA . . 3.780 2.726 2.362 2.931 . 0 0 "[ . 1 . 2]" 1
493 1 22 GLU QB 1 78 PRO HB3 . . 3.210 2.177 1.991 2.385 . 0 0 "[ . 1 . 2]" 1
494 1 22 GLU QB 1 79 GLU H . . 4.480 3.534 3.245 3.849 . 0 0 "[ . 1 . 2]" 1
495 1 22 GLU QB 1 106 LYS H . . 4.230 3.784 3.653 3.953 . 0 0 "[ . 1 . 2]" 1
496 1 22 GLU QB 1 106 LYS HB2 . . 4.550 2.697 2.388 3.153 . 0 0 "[ . 1 . 2]" 1
497 1 22 GLU QB 1 107 ALA HA . . 4.820 3.936 3.720 4.210 . 0 0 "[ . 1 . 2]" 1
498 1 22 GLU QB 1 108 ARG H . . 4.020 3.493 3.263 3.796 . 0 0 "[ . 1 . 2]" 1
499 1 22 GLU QB 1 108 ARG HA . . 4.320 2.780 2.527 2.958 . 0 0 "[ . 1 . 2]" 1
500 1 22 GLU HB2 1 23 THR H . . 4.350 4.099 3.846 4.343 . 0 0 "[ . 1 . 2]" 1
501 1 22 GLU HB2 1 23 THR MG . . 4.690 3.680 3.303 3.965 . 0 0 "[ . 1 . 2]" 1
502 1 22 GLU HB2 1 78 PRO HA . . 4.490 2.758 2.380 2.975 . 0 0 "[ . 1 . 2]" 1
503 1 22 GLU HB3 1 23 THR H . . 4.350 4.090 3.935 4.264 . 0 0 "[ . 1 . 2]" 1
504 1 22 GLU HB3 1 23 THR MG . . 4.690 4.580 4.438 4.682 . 0 0 "[ . 1 . 2]" 1
505 1 22 GLU HB3 1 78 PRO HA . . 4.490 4.292 3.980 4.497 0.007 12 0 "[ . 1 . 2]" 1
506 1 22 GLU HG2 1 23 THR H . . 4.000 2.469 2.089 2.853 . 0 0 "[ . 1 . 2]" 1
507 1 22 GLU HG2 1 23 THR MG . . 3.110 2.492 2.022 2.949 . 0 0 "[ . 1 . 2]" 1
508 1 22 GLU HG2 1 108 ARG HA . . 5.040 4.595 4.271 4.968 . 0 0 "[ . 1 . 2]" 1
509 1 22 GLU HG2 1 108 ARG QB . . 4.750 4.316 3.702 4.753 0.003 20 0 "[ . 1 . 2]" 1
510 1 22 GLU HG3 1 23 THR H . . 4.400 3.953 3.215 4.384 . 0 0 "[ . 1 . 2]" 1
511 1 22 GLU HG3 1 23 THR MG . . 3.400 2.874 2.102 3.329 . 0 0 "[ . 1 . 2]" 1
512 1 22 GLU HG3 1 78 PRO HA . . 5.050 4.390 3.548 4.987 . 0 0 "[ . 1 . 2]" 1
513 1 22 GLU HG3 1 78 PRO HB3 . . 3.980 3.029 2.366 3.593 . 0 0 "[ . 1 . 2]" 1
514 1 22 GLU HG3 1 78 PRO HG3 . . 5.360 4.551 3.953 5.149 . 0 0 "[ . 1 . 2]" 1
515 1 22 GLU HG3 1 108 ARG HA . . 3.850 3.302 2.719 3.862 0.012 12 0 "[ . 1 . 2]" 1
516 1 22 GLU HG3 1 108 ARG QB . . 3.970 2.960 2.400 3.493 . 0 0 "[ . 1 . 2]" 1
517 1 23 THR H 1 23 THR MG . . 3.400 3.142 2.971 3.277 . 0 0 "[ . 1 . 2]" 1
518 1 23 THR H 1 24 THR H . . 2.860 2.114 1.932 2.313 . 0 0 "[ . 1 . 2]" 1
519 1 23 THR H 1 24 THR HA . . 4.980 4.650 4.565 4.756 . 0 0 "[ . 1 . 2]" 1
520 1 23 THR H 1 24 THR HB . . 4.550 4.316 4.178 4.531 . 0 0 "[ . 1 . 2]" 1
521 1 23 THR H 1 24 THR HG1 . . 4.220 3.692 2.994 4.220 . 0 0 "[ . 1 . 2]" 1
522 1 23 THR H 1 24 THR MG . . 5.420 5.196 5.155 5.244 . 0 0 "[ . 1 . 2]" 1
523 1 23 THR HA 1 23 THR MG . . 2.920 2.218 2.122 2.335 . 0 0 "[ . 1 . 2]" 1
524 1 23 THR HA 1 76 LEU H . . 3.550 2.984 2.807 3.141 . 0 0 "[ . 1 . 2]" 1
525 1 23 THR HA 1 76 LEU HB2 . . 4.640 2.558 2.386 2.733 . 0 0 "[ . 1 . 2]" 1
526 1 23 THR HA 1 76 LEU HB3 . . 4.640 4.190 3.952 4.395 . 0 0 "[ . 1 . 2]" 1
527 1 23 THR HA 1 76 LEU MD1 . . 4.100 3.589 3.363 3.843 . 0 0 "[ . 1 . 2]" 1
528 1 23 THR HB 1 24 THR H . . 5.140 4.331 4.235 4.416 . 0 0 "[ . 1 . 2]" 1
529 1 23 THR HB 1 75 HIS H . . 3.620 3.064 2.902 3.158 . 0 0 "[ . 1 . 2]" 1
530 1 23 THR HB 1 75 HIS HA . . 3.810 3.361 3.110 3.556 . 0 0 "[ . 1 . 2]" 1
531 1 23 THR HB 1 76 LEU H . . 3.140 2.396 2.094 2.681 . 0 0 "[ . 1 . 2]" 1
532 1 23 THR MG 1 24 THR H . . 4.540 4.325 4.276 4.363 . 0 0 "[ . 1 . 2]" 1
533 1 23 THR MG 1 75 HIS H . . 4.570 4.471 4.314 4.544 . 0 0 "[ . 1 . 2]" 1
534 1 23 THR MG 1 75 HIS HA . . 4.120 3.965 3.779 4.123 0.003 3 0 "[ . 1 . 2]" 1
535 1 23 THR MG 1 76 LEU H . . 3.870 3.302 3.103 3.506 . 0 0 "[ . 1 . 2]" 1
536 1 23 THR MG 1 77 GLN QG . . 5.500 5.084 4.848 5.328 . 0 0 "[ . 1 . 2]" 1
537 1 23 THR MG 1 78 PRO HA . . 4.620 3.788 3.581 3.923 . 0 0 "[ . 1 . 2]" 1
538 1 23 THR MG 1 78 PRO HB3 . . 3.560 3.506 3.392 3.568 0.008 13 0 "[ . 1 . 2]" 1
539 1 23 THR MG 1 78 PRO HD2 . . 4.610 4.335 4.049 4.479 . 0 0 "[ . 1 . 2]" 1
540 1 23 THR MG 1 78 PRO HD3 . . 3.770 2.911 2.610 3.058 . 0 0 "[ . 1 . 2]" 1
541 1 23 THR MG 1 78 PRO HG2 . . 5.500 5.129 4.890 5.234 . 0 0 "[ . 1 . 2]" 1
542 1 23 THR MG 1 78 PRO HG3 . . 4.230 4.159 3.933 4.235 0.005 7 0 "[ . 1 . 2]" 1
543 1 24 THR H 1 24 THR HB . . 3.480 2.978 2.907 3.073 . 0 0 "[ . 1 . 2]" 1
544 1 24 THR H 1 24 THR HG1 . . 3.900 3.328 2.520 3.816 . 0 0 "[ . 1 . 2]" 1
545 1 24 THR H 1 24 THR MG . . 4.040 3.975 3.946 3.985 . 0 0 "[ . 1 . 2]" 1
546 1 24 THR H 1 25 ILE H . . 4.480 4.398 4.374 4.435 . 0 0 "[ . 1 . 2]" 1
547 1 24 THR H 1 25 ILE HG13 . . 4.760 4.024 3.897 4.183 . 0 0 "[ . 1 . 2]" 1
548 1 24 THR H 1 76 LEU H . . 5.220 5.099 4.913 5.222 0.002 15 0 "[ . 1 . 2]" 1
549 1 24 THR H 1 76 LEU QB . . 5.170 4.284 4.032 4.425 . 0 0 "[ . 1 . 2]" 1
550 1 24 THR H 1 76 LEU MD1 . . 4.440 3.637 3.412 3.969 . 0 0 "[ . 1 . 2]" 1
551 1 24 THR H 1 106 LYS H . . 4.750 4.538 4.414 4.674 . 0 0 "[ . 1 . 2]" 1
552 1 24 THR HA 1 24 THR MG . . 3.170 2.283 2.238 2.336 . 0 0 "[ . 1 . 2]" 1
553 1 24 THR HA 1 25 ILE H . . 3.000 2.252 2.229 2.284 . 0 0 "[ . 1 . 2]" 1
554 1 24 THR HA 1 25 ILE HB . . 4.330 4.321 4.293 4.337 0.007 1 0 "[ . 1 . 2]" 1
555 1 24 THR HA 1 73 ILE H . . 5.130 5.017 4.829 5.129 . 0 0 "[ . 1 . 2]" 1
556 1 24 THR HA 1 74 SER H . . 4.800 4.681 4.471 4.802 0.002 12 0 "[ . 1 . 2]" 1
557 1 24 THR HA 1 74 SER HA . . 3.630 2.383 2.225 2.541 . 0 0 "[ . 1 . 2]" 1
558 1 24 THR HA 1 74 SER HB3 . . 4.520 4.272 4.071 4.434 . 0 0 "[ . 1 . 2]" 1
559 1 24 THR HA 1 75 HIS H . . 4.490 4.462 4.318 4.494 0.004 1 0 "[ . 1 . 2]" 1
560 1 24 THR HA 1 76 LEU H . . 4.890 4.568 4.436 4.685 . 0 0 "[ . 1 . 2]" 1
561 1 24 THR HA 1 76 LEU MD1 . . 4.120 2.393 2.065 2.774 . 0 0 "[ . 1 . 2]" 1
562 1 24 THR HB 1 25 ILE H . . 4.160 3.659 3.489 3.764 . 0 0 "[ . 1 . 2]" 1
563 1 24 THR MG 1 25 ILE H . . 3.220 2.043 1.897 2.226 . 0 0 "[ . 1 . 2]" 1
564 1 24 THR MG 1 25 ILE HA . . 4.460 3.783 3.631 3.985 . 0 0 "[ . 1 . 2]" 1
565 1 24 THR MG 1 72 SER H . . 5.500 5.350 5.279 5.444 . 0 0 "[ . 1 . 2]" 1
566 1 24 THR MG 1 72 SER HA . . 3.900 3.828 3.719 3.902 0.002 8 0 "[ . 1 . 2]" 1
567 1 24 THR MG 1 72 SER QB . . 3.050 2.552 2.432 2.695 . 0 0 "[ . 1 . 2]" 1
568 1 24 THR MG 1 73 ILE H . . 3.940 3.781 3.552 3.921 . 0 0 "[ . 1 . 2]" 1
569 1 24 THR MG 1 73 ILE HB . . 4.630 4.410 4.174 4.557 . 0 0 "[ . 1 . 2]" 1
570 1 24 THR MG 1 74 SER H . . 4.700 4.407 4.300 4.501 . 0 0 "[ . 1 . 2]" 1
571 1 24 THR MG 1 74 SER HA . . 3.500 2.937 2.772 3.098 . 0 0 "[ . 1 . 2]" 1
572 1 24 THR MG 1 74 SER HB2 . . 4.490 4.372 4.154 4.496 0.006 9 0 "[ . 1 . 2]" 1
573 1 24 THR MG 1 74 SER HB3 . . 3.840 3.519 3.241 3.692 . 0 0 "[ . 1 . 2]" 1
574 1 24 THR MG 1 75 HIS H . . 4.920 4.752 4.552 4.880 . 0 0 "[ . 1 . 2]" 1
575 1 24 THR MG 1 76 LEU MD1 . . 4.070 3.756 3.589 3.950 . 0 0 "[ . 1 . 2]" 1
576 1 25 ILE H 1 25 ILE HB . . 3.240 2.746 2.694 2.806 . 0 0 "[ . 1 . 2]" 1
577 1 25 ILE H 1 25 ILE MD . . 4.500 4.435 4.300 4.503 0.003 20 0 "[ . 1 . 2]" 1
578 1 25 ILE H 1 25 ILE HG12 . . 4.630 4.342 4.281 4.458 . 0 0 "[ . 1 . 2]" 1
579 1 25 ILE H 1 25 ILE HG13 . . 4.040 3.444 3.400 3.501 . 0 0 "[ . 1 . 2]" 1
580 1 25 ILE H 1 25 ILE MG . . 3.930 3.803 3.781 3.824 . 0 0 "[ . 1 . 2]" 1
581 1 25 ILE H 1 26 MET H . . 4.630 4.284 4.201 4.366 . 0 0 "[ . 1 . 2]" 1
582 1 25 ILE H 1 72 SER QB . . 4.480 4.012 3.857 4.273 . 0 0 "[ . 1 . 2]" 1
583 1 25 ILE H 1 73 ILE H . . 3.820 3.199 3.044 3.321 . 0 0 "[ . 1 . 2]" 1
584 1 25 ILE H 1 73 ILE HB . . 4.140 3.150 2.909 3.302 . 0 0 "[ . 1 . 2]" 1
585 1 25 ILE H 1 73 ILE MD . . 4.620 4.515 4.356 4.602 . 0 0 "[ . 1 . 2]" 1
586 1 25 ILE H 1 73 ILE MG . . 4.490 4.281 4.026 4.404 . 0 0 "[ . 1 . 2]" 1
587 1 25 ILE H 1 74 SER HA . . 4.160 3.900 3.729 4.061 . 0 0 "[ . 1 . 2]" 1
588 1 25 ILE H 1 76 LEU MD1 . . 3.710 2.818 2.643 2.985 . 0 0 "[ . 1 . 2]" 1
589 1 25 ILE HA 1 25 ILE MD . . 3.820 3.755 3.726 3.800 . 0 0 "[ . 1 . 2]" 1
590 1 25 ILE HA 1 25 ILE MG . . 3.380 2.478 2.462 2.489 . 0 0 "[ . 1 . 2]" 1
591 1 25 ILE HA 1 26 MET H . . 3.090 2.180 2.159 2.220 . 0 0 "[ . 1 . 2]" 1
592 1 25 ILE HB 1 25 ILE MD . . 3.570 2.384 2.334 2.428 . 0 0 "[ . 1 . 2]" 1
593 1 25 ILE HB 1 26 MET H . . 4.440 4.205 4.105 4.273 . 0 0 "[ . 1 . 2]" 1
594 1 25 ILE HB 1 73 ILE MD . . 2.930 2.887 2.735 2.928 . 0 0 "[ . 1 . 2]" 1
595 1 25 ILE HB 1 73 ILE HG13 . . 4.560 4.182 3.991 4.413 . 0 0 "[ . 1 . 2]" 1
596 1 25 ILE HB 1 76 LEU MD1 . . 3.050 2.523 2.359 2.716 . 0 0 "[ . 1 . 2]" 1
597 1 25 ILE MD 1 76 LEU MD1 . . 3.090 2.449 2.114 2.767 . 0 0 "[ . 1 . 2]" 1
598 1 25 ILE MD 1 76 LEU MD2 . . 4.060 3.522 3.221 3.909 . 0 0 "[ . 1 . 2]" 1
599 1 25 ILE MD 1 82 TYR H . . 5.090 4.711 4.559 4.835 . 0 0 "[ . 1 . 2]" 1
600 1 25 ILE MD 1 82 TYR QE . . 4.000 2.466 2.171 2.828 . 0 0 "[ . 1 . 2]" 1
601 1 25 ILE MD 1 84 ILE MD . . 3.200 2.142 1.989 2.285 . 0 0 "[ . 1 . 2]" 1
602 1 25 ILE MD 1 84 ILE HG13 . . 4.600 4.317 4.143 4.433 . 0 0 "[ . 1 . 2]" 1
603 1 25 ILE MD 1 84 ILE MG . . 4.390 4.230 3.997 4.391 0.001 19 0 "[ . 1 . 2]" 1
604 1 25 ILE MD 1 103 CYS H . . 4.470 4.172 3.920 4.308 . 0 0 "[ . 1 . 2]" 1
605 1 25 ILE MD 1 103 CYS HB2 . . 3.780 3.687 3.511 3.779 . 0 0 "[ . 1 . 2]" 1
606 1 25 ILE MD 1 103 CYS QB . . 3.190 2.154 1.971 2.296 . 0 0 "[ . 1 . 2]" 1
607 1 25 ILE MD 1 103 CYS HB3 . . 3.780 2.169 1.982 2.318 . 0 0 "[ . 1 . 2]" 1
608 1 25 ILE MD 1 104 GLU H . . 5.190 4.731 4.373 4.994 . 0 0 "[ . 1 . 2]" 1
609 1 25 ILE MD 1 104 GLU HA . . 4.510 4.171 3.919 4.340 . 0 0 "[ . 1 . 2]" 1
610 1 25 ILE MD 1 105 THR H . . 4.130 3.534 3.378 3.684 . 0 0 "[ . 1 . 2]" 1
611 1 25 ILE MD 1 105 THR HA . . 4.270 3.211 2.891 3.404 . 0 0 "[ . 1 . 2]" 1
612 1 25 ILE MD 1 105 THR MG . . 2.880 1.825 1.770 1.908 . 0 0 "[ . 1 . 2]" 1
613 1 25 ILE MD 1 106 LYS H . . 5.430 5.103 4.844 5.266 . 0 0 "[ . 1 . 2]" 1
614 1 25 ILE HG12 1 76 LEU MD1 . . 4.210 3.763 3.597 4.026 . 0 0 "[ . 1 . 2]" 1
615 1 25 ILE HG12 1 105 THR H . . 5.500 5.170 5.011 5.313 . 0 0 "[ . 1 . 2]" 1
616 1 25 ILE HG12 1 105 THR MG . . 3.610 2.764 2.625 2.911 . 0 0 "[ . 1 . 2]" 1
617 1 25 ILE HG13 1 25 ILE MG . . 3.440 3.190 3.184 3.193 . 0 0 "[ . 1 . 2]" 1
618 1 25 ILE HG13 1 26 MET H . . 4.960 4.865 4.752 4.939 . 0 0 "[ . 1 . 2]" 1
619 1 25 ILE HG13 1 76 LEU MD1 . . 3.750 2.349 2.194 2.624 . 0 0 "[ . 1 . 2]" 1
620 1 25 ILE HG13 1 105 THR H . . 5.500 5.389 5.220 5.497 . 0 0 "[ . 1 . 2]" 1
621 1 25 ILE HG13 1 105 THR HA . . 4.400 3.785 3.591 3.928 . 0 0 "[ . 1 . 2]" 1
622 1 25 ILE HG13 1 105 THR MG . . 3.190 2.146 2.030 2.245 . 0 0 "[ . 1 . 2]" 1
623 1 25 ILE MG 1 26 MET H . . 3.330 2.222 2.020 2.370 . 0 0 "[ . 1 . 2]" 1
624 1 25 ILE MG 1 26 MET HA . . 4.420 3.553 3.486 3.638 . 0 0 "[ . 1 . 2]" 1
625 1 25 ILE MG 1 26 MET QB . . 4.210 3.955 3.829 4.050 . 0 0 "[ . 1 . 2]" 1
626 1 25 ILE MG 1 27 LEU H . . 4.590 3.908 3.708 4.122 . 0 0 "[ . 1 . 2]" 1
627 1 25 ILE MG 1 27 LEU HB2 . . 4.410 4.299 4.200 4.398 . 0 0 "[ . 1 . 2]" 1
628 1 25 ILE MG 1 27 LEU MD2 . . 3.660 3.245 2.895 3.416 . 0 0 "[ . 1 . 2]" 1
629 1 25 ILE MG 1 73 ILE MD . . 3.670 2.717 2.541 2.920 . 0 0 "[ . 1 . 2]" 1
630 1 25 ILE MG 1 76 LEU MD1 . . 3.990 3.716 3.580 3.875 . 0 0 "[ . 1 . 2]" 1
631 1 25 ILE MG 1 103 CYS HB2 . . 4.010 3.398 3.165 3.580 . 0 0 "[ . 1 . 2]" 1
632 1 25 ILE MG 1 103 CYS QB . . 3.480 2.493 2.316 2.613 . 0 0 "[ . 1 . 2]" 1
633 1 25 ILE MG 1 103 CYS HB3 . . 4.010 2.565 2.371 2.696 . 0 0 "[ . 1 . 2]" 1
634 1 26 MET H 1 26 MET QB . . 3.230 2.335 2.275 2.398 . 0 0 "[ . 1 . 2]" 1
635 1 26 MET H 1 26 MET QG . . 3.940 3.835 3.700 3.951 0.011 1 0 "[ . 1 . 2]" 1
636 1 26 MET HA 1 26 MET ME . . 3.980 3.315 1.957 3.980 . 0 0 "[ . 1 . 2]" 1
637 1 26 MET HA 1 26 MET QG . . 3.540 2.722 2.582 2.863 . 0 0 "[ . 1 . 2]" 1
638 1 26 MET HA 1 27 LEU H . . 2.980 2.149 2.141 2.168 . 0 0 "[ . 1 . 2]" 1
639 1 26 MET HA 1 27 LEU MD2 . . 3.880 3.306 3.195 3.440 . 0 0 "[ . 1 . 2]" 1
640 1 26 MET HA 1 71 HIS H . . 4.750 4.549 4.459 4.661 . 0 0 "[ . 1 . 2]" 1
641 1 26 MET HA 1 72 SER H . . 5.250 4.847 4.695 4.964 . 0 0 "[ . 1 . 2]" 1
642 1 26 MET HA 1 72 SER HA . . 3.500 2.308 2.149 2.400 . 0 0 "[ . 1 . 2]" 1
643 1 26 MET HA 1 72 SER HB2 . . 4.340 3.851 3.571 4.056 . 0 0 "[ . 1 . 2]" 1
644 1 26 MET HA 1 72 SER HB3 . . 4.340 3.661 3.342 4.058 . 0 0 "[ . 1 . 2]" 1
645 1 26 MET HA 1 73 ILE H . . 3.790 3.560 3.420 3.725 . 0 0 "[ . 1 . 2]" 1
646 1 26 MET QB 1 27 LEU H . . 3.870 3.751 3.638 3.830 . 0 0 "[ . 1 . 2]" 1
647 1 26 MET QB 1 28 LYS QE . . 5.340 4.455 3.646 5.253 . 0 0 "[ . 1 . 2]" 1
648 1 26 MET QB 1 70 TRP HE3 . . 5.500 4.609 4.056 4.917 . 0 0 "[ . 1 . 2]" 1
649 1 26 MET QB 1 71 HIS H . . 5.500 5.472 5.364 5.547 0.047 14 0 "[ . 1 . 2]" 1
650 1 26 MET QB 1 72 SER HA . . 4.370 3.556 3.387 3.769 . 0 0 "[ . 1 . 2]" 1
651 1 26 MET QB 1 72 SER HB2 . . 4.700 3.646 3.500 3.818 . 0 0 "[ . 1 . 2]" 1
652 1 26 MET QB 1 72 SER HB3 . . 4.700 3.350 2.990 3.828 . 0 0 "[ . 1 . 2]" 1
653 1 26 MET QB 1 73 ILE H . . 5.390 5.022 4.852 5.181 . 0 0 "[ . 1 . 2]" 1
654 1 26 MET ME 1 26 MET QG . . 3.150 2.055 1.963 2.249 . 0 0 "[ . 1 . 2]" 1
655 1 26 MET ME 1 27 LEU H . . 4.080 3.193 1.876 4.080 . 0 0 "[ . 1 . 2]" 1
656 1 26 MET ME 1 28 LYS HA . . 5.120 4.480 3.583 4.926 . 0 0 "[ . 1 . 2]" 1
657 1 26 MET ME 1 28 LYS HE2 . . 4.300 2.960 2.114 4.241 . 0 0 "[ . 1 . 2]" 1
658 1 26 MET ME 1 28 LYS QE . . 3.730 2.701 2.078 3.704 . 0 0 "[ . 1 . 2]" 1
659 1 26 MET ME 1 28 LYS HE3 . . 4.300 3.554 2.464 4.302 0.002 10 0 "[ . 1 . 2]" 1
660 1 26 MET ME 1 28 LYS QG . . 4.420 2.865 2.216 3.178 . 0 0 "[ . 1 . 2]" 1
661 1 26 MET ME 1 70 TRP HA . . 4.630 3.660 2.687 4.363 . 0 0 "[ . 1 . 2]" 1
662 1 26 MET ME 1 70 TRP HB2 . . 3.830 2.202 1.960 2.506 . 0 0 "[ . 1 . 2]" 1
663 1 26 MET ME 1 70 TRP QB . . 3.330 2.180 1.950 2.470 . 0 0 "[ . 1 . 2]" 1
664 1 26 MET ME 1 70 TRP HB3 . . 3.830 3.536 3.400 3.790 . 0 0 "[ . 1 . 2]" 1
665 1 26 MET ME 1 70 TRP HE3 . . 3.140 2.004 1.898 2.274 . 0 0 "[ . 1 . 2]" 1
666 1 26 MET ME 1 70 TRP HZ3 . . 3.480 3.102 2.664 3.510 0.030 7 0 "[ . 1 . 2]" 1
667 1 26 MET ME 1 71 HIS H . . 4.150 2.936 1.777 3.793 . 0 0 "[ . 1 . 2]" 1
668 1 26 MET ME 1 72 SER QB . . 3.800 3.286 2.191 3.659 . 0 0 "[ . 1 . 2]" 1
669 1 26 MET QG 1 27 LEU H . . 3.490 2.772 2.509 2.961 . 0 0 "[ . 1 . 2]" 1
670 1 26 MET QG 1 27 LEU HA . . 4.550 3.443 3.336 3.560 . 0 0 "[ . 1 . 2]" 1
671 1 26 MET QG 1 27 LEU MD2 . . 4.440 4.320 4.149 4.449 0.009 10 0 "[ . 1 . 2]" 1
672 1 26 MET QG 1 28 LYS H . . 4.700 4.394 4.235 4.512 . 0 0 "[ . 1 . 2]" 1
673 1 26 MET QG 1 28 LYS QG . . 4.530 3.043 2.836 3.873 . 0 0 "[ . 1 . 2]" 1
674 1 26 MET QG 1 70 TRP HE3 . . 4.250 3.824 3.297 4.266 0.016 13 0 "[ . 1 . 2]" 1
675 1 26 MET QG 1 71 HIS H . . 4.320 4.113 3.804 4.330 0.010 14 0 "[ . 1 . 2]" 1
676 1 26 MET QG 1 72 SER HA . . 4.610 4.410 4.121 4.625 0.015 13 0 "[ . 1 . 2]" 1
677 1 26 MET QG 1 72 SER HB2 . . 5.500 5.323 5.198 5.500 0.000 3 0 "[ . 1 . 2]" 1
678 1 26 MET QG 1 72 SER QB . . 4.640 4.281 3.955 4.486 . 0 0 "[ . 1 . 2]" 1
679 1 26 MET QG 1 72 SER HB3 . . 5.500 4.525 4.097 4.878 . 0 0 "[ . 1 . 2]" 1
680 1 27 LEU H 1 27 LEU HB3 . . 3.890 2.927 2.838 3.014 . 0 0 "[ . 1 . 2]" 1
681 1 27 LEU H 1 27 LEU MD2 . . 3.320 1.953 1.880 2.244 . 0 0 "[ . 1 . 2]" 1
682 1 27 LEU H 1 27 LEU HG . . 4.370 3.420 3.296 3.519 . 0 0 "[ . 1 . 2]" 1
683 1 27 LEU H 1 28 LYS H . . 4.670 4.364 4.299 4.428 . 0 0 "[ . 1 . 2]" 1
684 1 27 LEU H 1 70 TRP HA . . 5.200 4.893 4.720 5.180 . 0 0 "[ . 1 . 2]" 1
685 1 27 LEU H 1 71 HIS H . . 3.570 3.278 3.113 3.492 . 0 0 "[ . 1 . 2]" 1
686 1 27 LEU H 1 72 SER HA . . 3.890 3.533 3.299 3.658 . 0 0 "[ . 1 . 2]" 1
687 1 27 LEU H 1 73 ILE H . . 4.560 4.407 4.160 4.534 . 0 0 "[ . 1 . 2]" 1
688 1 27 LEU HA 1 27 LEU MD1 . . 4.070 4.001 3.978 4.034 . 0 0 "[ . 1 . 2]" 1
689 1 27 LEU HA 1 27 LEU MD2 . . 4.110 3.636 3.606 3.687 . 0 0 "[ . 1 . 2]" 1
690 1 27 LEU HA 1 28 LYS H . . 3.110 2.201 2.166 2.256 . 0 0 "[ . 1 . 2]" 1
691 1 27 LEU HB2 1 27 LEU MD1 . . 3.300 2.108 2.029 2.242 . 0 0 "[ . 1 . 2]" 1
692 1 27 LEU HB2 1 27 LEU MD2 . . 3.340 3.160 3.142 3.175 . 0 0 "[ . 1 . 2]" 1
693 1 27 LEU HB2 1 28 LYS H . . 3.680 3.100 2.908 3.265 . 0 0 "[ . 1 . 2]" 1
694 1 27 LEU HB3 1 27 LEU MD1 . . 3.560 2.559 2.490 2.632 . 0 0 "[ . 1 . 2]" 1
695 1 27 LEU HB3 1 27 LEU MD2 . . 2.960 2.232 2.079 2.289 . 0 0 "[ . 1 . 2]" 1
696 1 27 LEU HB3 1 28 LYS H . . 4.460 4.248 4.144 4.337 . 0 0 "[ . 1 . 2]" 1
697 1 27 LEU HB3 1 84 ILE MD . . 4.590 4.415 4.310 4.586 . 0 0 "[ . 1 . 2]" 1
698 1 27 LEU HB3 1 84 ILE MG . . 4.270 3.843 3.564 4.127 . 0 0 "[ . 1 . 2]" 1
699 1 27 LEU MD1 1 28 LYS H . . 4.580 4.314 4.010 4.503 . 0 0 "[ . 1 . 2]" 1
700 1 27 LEU MD1 1 29 TRP H . . 5.340 5.217 5.066 5.341 0.001 20 0 "[ . 1 . 2]" 1
701 1 27 LEU MD1 1 29 TRP HB3 . . 4.560 4.004 3.836 4.265 . 0 0 "[ . 1 . 2]" 1
702 1 27 LEU MD1 1 29 TRP HE3 . . 3.580 2.922 2.769 3.182 . 0 0 "[ . 1 . 2]" 1
703 1 27 LEU MD1 1 29 TRP HZ3 . . 3.860 3.550 3.178 3.825 . 0 0 "[ . 1 . 2]" 1
704 1 27 LEU MD1 1 71 HIS H . . 5.500 5.253 5.025 5.467 . 0 0 "[ . 1 . 2]" 1
705 1 27 LEU MD1 1 71 HIS HB3 . . 5.140 4.522 4.345 4.767 . 0 0 "[ . 1 . 2]" 1
706 1 27 LEU MD1 1 71 HIS HD2 . . 5.500 4.980 4.513 5.429 . 0 0 "[ . 1 . 2]" 1
707 1 27 LEU MD1 1 86 MET H . . 5.030 4.884 4.596 5.038 0.008 3 0 "[ . 1 . 2]" 1
708 1 27 LEU MD1 1 86 MET HG2 . . 4.600 3.143 2.375 3.393 . 0 0 "[ . 1 . 2]" 1
709 1 27 LEU MD1 1 86 MET QG . . 3.950 3.076 2.333 3.303 . 0 0 "[ . 1 . 2]" 1
710 1 27 LEU MD1 1 86 MET HG3 . . 4.600 4.396 3.426 4.604 0.004 10 0 "[ . 1 . 2]" 1
711 1 27 LEU MD1 1 101 MET QG . . 4.620 4.197 3.817 4.475 . 0 0 "[ . 1 . 2]" 1
712 1 27 LEU MD2 1 28 LYS H . . 4.780 4.618 4.567 4.684 . 0 0 "[ . 1 . 2]" 1
713 1 27 LEU MD2 1 29 TRP HE3 . . 3.860 3.676 3.385 3.857 . 0 0 "[ . 1 . 2]" 1
714 1 27 LEU MD2 1 29 TRP HH2 . . 4.920 4.375 4.059 4.743 . 0 0 "[ . 1 . 2]" 1
715 1 27 LEU MD2 1 29 TRP HZ3 . . 3.620 2.500 2.096 2.871 . 0 0 "[ . 1 . 2]" 1
716 1 27 LEU MD2 1 46 ILE MD . . 3.320 2.489 2.161 2.911 . 0 0 "[ . 1 . 2]" 1
717 1 27 LEU MD2 1 46 ILE MG . . 2.880 2.608 2.475 2.816 . 0 0 "[ . 1 . 2]" 1
718 1 27 LEU MD2 1 71 HIS H . . 3.880 3.243 3.054 3.490 . 0 0 "[ . 1 . 2]" 1
719 1 27 LEU MD2 1 71 HIS HB2 . . 4.080 3.909 3.779 4.063 . 0 0 "[ . 1 . 2]" 1
720 1 27 LEU MD2 1 71 HIS HB3 . . 3.680 2.391 2.253 2.596 . 0 0 "[ . 1 . 2]" 1
721 1 27 LEU MD2 1 71 HIS HD2 . . 3.700 3.142 2.659 3.390 . 0 0 "[ . 1 . 2]" 1
722 1 27 LEU MD2 1 72 SER HA . . 4.250 3.656 3.373 3.838 . 0 0 "[ . 1 . 2]" 1
723 1 27 LEU MD2 1 73 ILE H . . 4.280 3.486 3.286 3.621 . 0 0 "[ . 1 . 2]" 1
724 1 27 LEU MD2 1 73 ILE MD . . 3.100 2.184 1.966 2.412 . 0 0 "[ . 1 . 2]" 1
725 1 27 LEU MD2 1 73 ILE HG13 . . 3.680 2.728 2.375 2.917 . 0 0 "[ . 1 . 2]" 1
726 1 27 LEU MD2 1 73 ILE MG . . 4.900 4.667 4.452 4.827 . 0 0 "[ . 1 . 2]" 1
727 1 27 LEU MD2 1 84 ILE MG . . 3.400 3.313 3.124 3.407 0.007 13 0 "[ . 1 . 2]" 1
728 1 27 LEU HG 1 29 TRP HE3 . . 4.070 2.617 2.412 2.736 . 0 0 "[ . 1 . 2]" 1
729 1 27 LEU HG 1 29 TRP HZ3 . . 4.040 2.928 2.635 3.179 . 0 0 "[ . 1 . 2]" 1
730 1 27 LEU HG 1 46 ILE MD . . 4.530 4.120 3.803 4.387 . 0 0 "[ . 1 . 2]" 1
731 1 27 LEU HG 1 71 HIS H . . 4.360 4.021 3.723 4.302 . 0 0 "[ . 1 . 2]" 1
732 1 28 LYS H 1 28 LYS HG2 . . 4.420 4.155 3.938 4.421 0.001 2 0 "[ . 1 . 2]" 1
733 1 28 LYS H 1 28 LYS HG3 . . 4.420 2.895 2.561 3.954 . 0 0 "[ . 1 . 2]" 1
734 1 28 LYS H 1 29 TRP H . . 4.640 4.432 4.393 4.460 . 0 0 "[ . 1 . 2]" 1
735 1 28 LYS H 1 71 HIS H . . 5.500 5.411 5.250 5.498 . 0 0 "[ . 1 . 2]" 1
736 1 28 LYS HA 1 29 TRP H . . 2.980 2.199 2.179 2.237 . 0 0 "[ . 1 . 2]" 1
737 1 28 LYS HA 1 70 TRP H . . 5.500 5.047 4.901 5.240 . 0 0 "[ . 1 . 2]" 1
738 1 28 LYS HA 1 70 TRP HA . . 4.060 2.517 2.374 2.640 . 0 0 "[ . 1 . 2]" 1
739 1 28 LYS HA 1 70 TRP QB . . 4.530 3.533 3.124 3.902 . 0 0 "[ . 1 . 2]" 1
740 1 28 LYS HA 1 71 HIS H . . 4.140 3.798 3.611 3.908 . 0 0 "[ . 1 . 2]" 1
741 1 28 LYS HB2 1 28 LYS HD2 . . 3.900 2.459 2.093 3.229 . 0 0 "[ . 1 . 2]" 1
742 1 28 LYS HB2 1 28 LYS HD3 . . 3.900 2.673 2.205 3.041 . 0 0 "[ . 1 . 2]" 1
743 1 28 LYS HB2 1 28 LYS HE2 . . 4.680 4.418 3.961 4.672 . 0 0 "[ . 1 . 2]" 1
744 1 28 LYS HB2 1 28 LYS QE . . 4.120 3.910 3.642 4.065 . 0 0 "[ . 1 . 2]" 1
745 1 28 LYS HB2 1 28 LYS HE3 . . 4.680 4.387 3.860 4.629 . 0 0 "[ . 1 . 2]" 1
746 1 28 LYS HB2 1 29 TRP H . . 4.340 4.004 3.789 4.136 . 0 0 "[ . 1 . 2]" 1
747 1 28 LYS HB3 1 28 LYS HD2 . . 3.920 3.417 3.116 3.936 0.016 2 0 "[ . 1 . 2]" 1
748 1 28 LYS HB3 1 28 LYS HD3 . . 3.920 2.824 2.533 3.514 . 0 0 "[ . 1 . 2]" 1
749 1 28 LYS HB3 1 28 LYS QE . . 4.400 4.116 3.736 4.390 . 0 0 "[ . 1 . 2]" 1
750 1 28 LYS HB3 1 29 TRP H . . 3.560 3.040 2.918 3.128 . 0 0 "[ . 1 . 2]" 1
751 1 28 LYS QE 1 28 LYS QG . . 3.060 2.184 2.049 2.443 . 0 0 "[ . 1 . 2]" 1
752 1 28 LYS QE 1 70 TRP QB . . 4.380 3.331 2.708 4.322 . 0 0 "[ . 1 . 2]" 1
753 1 28 LYS QG 1 29 TRP H . . 4.290 4.123 3.887 4.236 . 0 0 "[ . 1 . 2]" 1
754 1 28 LYS QG 1 70 TRP QB . . 3.570 2.273 2.042 2.616 . 0 0 "[ . 1 . 2]" 1
755 1 28 LYS QG 1 71 HIS H . . 5.020 3.912 3.437 4.246 . 0 0 "[ . 1 . 2]" 1
756 1 28 LYS HG2 1 29 TRP H . . 4.970 4.521 4.302 4.952 . 0 0 "[ . 1 . 2]" 1
757 1 28 LYS HG3 1 29 TRP H . . 4.970 4.809 4.074 4.970 0.000 1 0 "[ . 1 . 2]" 1
758 1 29 TRP H 1 29 TRP HB2 . . 4.130 3.726 3.681 3.776 . 0 0 "[ . 1 . 2]" 1
759 1 29 TRP H 1 29 TRP HB3 . . 3.910 3.142 3.083 3.209 . 0 0 "[ . 1 . 2]" 1
760 1 29 TRP H 1 29 TRP HE3 . . 3.740 3.104 2.929 3.356 . 0 0 "[ . 1 . 2]" 1
761 1 29 TRP H 1 30 MET H . . 4.710 4.501 4.466 4.517 . 0 0 "[ . 1 . 2]" 1
762 1 29 TRP H 1 69 TYR HB2 . . 5.300 5.104 4.882 5.262 . 0 0 "[ . 1 . 2]" 1
763 1 29 TRP H 1 69 TYR HB3 . . 4.360 3.499 3.253 3.682 . 0 0 "[ . 1 . 2]" 1
764 1 29 TRP H 1 70 TRP HA . . 3.760 3.669 3.474 3.792 0.032 14 0 "[ . 1 . 2]" 1
765 1 29 TRP HA 1 30 MET H . . 3.450 2.351 2.276 2.457 . 0 0 "[ . 1 . 2]" 1
766 1 29 TRP HB2 1 30 MET H . . 3.580 2.571 2.317 2.770 . 0 0 "[ . 1 . 2]" 1
767 1 29 TRP HB3 1 30 MET H . . 3.950 3.778 3.659 3.904 . 0 0 "[ . 1 . 2]" 1
768 1 29 TRP HB3 1 86 MET ME . . 4.350 3.538 3.209 3.837 . 0 0 "[ . 1 . 2]" 1
769 1 29 TRP HD1 1 30 MET H . . 4.610 3.944 3.628 4.132 . 0 0 "[ . 1 . 2]" 1
770 1 29 TRP HD1 1 31 TYR QB . . 4.530 3.967 3.816 4.216 . 0 0 "[ . 1 . 2]" 1
771 1 29 TRP HD1 1 44 PHE QE . . 4.370 3.983 3.763 4.168 . 0 0 "[ . 1 . 2]" 1
772 1 29 TRP HD1 1 69 TYR QD . . 3.920 3.799 3.466 3.927 0.007 13 0 "[ . 1 . 2]" 1
773 1 29 TRP HD1 1 69 TYR QE . . 4.250 4.136 3.922 4.251 0.001 3 0 "[ . 1 . 2]" 1
774 1 29 TRP HD1 1 86 MET ME . . 4.150 3.856 3.619 4.138 . 0 0 "[ . 1 . 2]" 1
775 1 29 TRP HE1 1 44 PHE QE . . 3.650 2.793 2.628 2.978 . 0 0 "[ . 1 . 2]" 1
776 1 29 TRP HE1 1 44 PHE HZ . . 3.770 3.533 3.369 3.774 0.004 20 0 "[ . 1 . 2]" 1
777 1 29 TRP HE1 1 64 VAL MG1 . . 5.340 5.159 4.740 5.327 . 0 0 "[ . 1 . 2]" 1
778 1 29 TRP HE1 1 69 TYR HA . . 3.510 2.301 2.094 2.473 . 0 0 "[ . 1 . 2]" 1
779 1 29 TRP HE1 1 69 TYR HB2 . . 5.500 4.957 4.750 5.167 . 0 0 "[ . 1 . 2]" 1
780 1 29 TRP HE1 1 69 TYR HB3 . . 4.540 4.348 4.059 4.541 0.001 14 0 "[ . 1 . 2]" 1
781 1 29 TRP HE1 1 69 TYR QD . . 3.870 3.301 2.698 3.803 . 0 0 "[ . 1 . 2]" 1
782 1 29 TRP HE1 1 69 TYR QE . . 4.440 4.045 3.522 4.443 0.003 3 0 "[ . 1 . 2]" 1
783 1 29 TRP HE1 1 70 TRP H . . 5.500 5.035 4.782 5.342 . 0 0 "[ . 1 . 2]" 1
784 1 29 TRP HE1 1 86 MET ME . . 3.920 3.644 3.430 3.807 . 0 0 "[ . 1 . 2]" 1
785 1 29 TRP HE3 1 46 ILE MD . . 4.310 4.024 3.777 4.157 . 0 0 "[ . 1 . 2]" 1
786 1 29 TRP HH2 1 46 ILE MD . . 3.570 2.254 2.000 2.483 . 0 0 "[ . 1 . 2]" 1
787 1 29 TRP HH2 1 64 VAL MG1 . . 3.380 2.430 1.967 2.819 . 0 0 "[ . 1 . 2]" 1
788 1 29 TRP HH2 1 64 VAL MG2 . . 3.490 2.569 2.148 2.821 . 0 0 "[ . 1 . 2]" 1
789 1 29 TRP HH2 1 71 HIS H . . 4.270 4.099 3.735 4.278 0.008 2 0 "[ . 1 . 2]" 1
790 1 29 TRP HH2 1 71 HIS HB2 . . 3.840 2.028 1.991 2.155 . 0 0 "[ . 1 . 2]" 1
791 1 29 TRP HH2 1 71 HIS HB3 . . 3.970 2.936 2.601 3.237 . 0 0 "[ . 1 . 2]" 1
792 1 29 TRP HZ2 1 44 PHE QD . . 3.970 2.656 2.397 2.868 . 0 0 "[ . 1 . 2]" 1
793 1 29 TRP HZ2 1 64 VAL MG1 . . 3.370 2.806 2.242 3.032 . 0 0 "[ . 1 . 2]" 1
794 1 29 TRP HZ2 1 64 VAL MG2 . . 4.000 3.878 3.604 4.005 0.005 9 0 "[ . 1 . 2]" 1
795 1 29 TRP HZ2 1 68 ARG HB2 . . 5.500 5.214 4.711 5.506 0.006 20 0 "[ . 1 . 2]" 1
796 1 29 TRP HZ2 1 68 ARG HB3 . . 4.920 3.507 2.967 3.846 . 0 0 "[ . 1 . 2]" 1
797 1 29 TRP HZ2 1 68 ARG HG2 . . 5.070 4.559 3.887 4.979 . 0 0 "[ . 1 . 2]" 1
798 1 29 TRP HZ2 1 69 TYR HA . . 4.100 2.972 2.641 3.265 . 0 0 "[ . 1 . 2]" 1
799 1 29 TRP HZ2 1 70 TRP H . . 4.140 3.692 3.404 3.888 . 0 0 "[ . 1 . 2]" 1
800 1 29 TRP HZ2 1 86 MET ME . . 3.950 3.773 3.570 3.955 0.005 9 0 "[ . 1 . 2]" 1
801 1 29 TRP HZ3 1 46 ILE MD . . 3.530 2.287 2.095 2.463 . 0 0 "[ . 1 . 2]" 1
802 1 29 TRP HZ3 1 70 TRP HA . . 4.520 3.788 3.530 4.320 . 0 0 "[ . 1 . 2]" 1
803 1 29 TRP HZ3 1 71 HIS H . . 3.840 3.355 3.077 3.764 . 0 0 "[ . 1 . 2]" 1
804 1 29 TRP HZ3 1 71 HIS HB2 . . 4.160 3.029 2.758 3.374 . 0 0 "[ . 1 . 2]" 1
805 1 29 TRP HZ3 1 71 HIS HB3 . . 4.100 2.320 2.133 2.608 . 0 0 "[ . 1 . 2]" 1
806 1 30 MET H 1 30 MET QB . . 3.680 2.751 2.602 2.848 . 0 0 "[ . 1 . 2]" 1
807 1 30 MET H 1 30 MET HG2 . . 4.170 2.691 2.332 3.709 . 0 0 "[ . 1 . 2]" 1
808 1 30 MET H 1 30 MET QG . . 3.600 2.382 2.050 2.569 . 0 0 "[ . 1 . 2]" 1
809 1 30 MET H 1 30 MET HG3 . . 4.170 3.190 2.065 3.646 . 0 0 "[ . 1 . 2]" 1
810 1 30 MET H 1 31 TYR H . . 4.810 4.496 4.476 4.535 . 0 0 "[ . 1 . 2]" 1
811 1 30 MET HA 1 30 MET ME . . 4.460 4.211 3.894 4.461 0.001 5 0 "[ . 1 . 2]" 1
812 1 30 MET HA 1 30 MET HG2 . . 4.220 3.910 3.757 4.239 0.019 5 0 "[ . 1 . 2]" 1
813 1 30 MET HA 1 30 MET QG . . 3.660 3.333 3.270 3.454 . 0 0 "[ . 1 . 2]" 1
814 1 30 MET HA 1 30 MET HG3 . . 4.220 3.621 3.542 3.662 . 0 0 "[ . 1 . 2]" 1
815 1 30 MET HA 1 31 TYR H . . 3.010 2.406 2.267 2.479 . 0 0 "[ . 1 . 2]" 1
816 1 30 MET HA 1 69 TYR QD . . 4.080 2.624 2.307 2.912 . 0 0 "[ . 1 . 2]" 1
817 1 30 MET HA 1 69 TYR QE . . 4.180 3.039 2.606 3.391 . 0 0 "[ . 1 . 2]" 1
818 1 30 MET QB 1 31 TYR H . . 3.490 2.519 2.295 2.889 . 0 0 "[ . 1 . 2]" 1
819 1 30 MET QB 1 32 ILE MD . . 4.460 3.996 3.567 4.426 . 0 0 "[ . 1 . 2]" 1
820 1 30 MET ME 1 30 MET HG2 . . 3.420 3.140 2.191 3.394 . 0 0 "[ . 1 . 2]" 1
821 1 30 MET ME 1 30 MET HG3 . . 3.420 2.517 2.114 3.379 . 0 0 "[ . 1 . 2]" 1
822 1 30 MET ME 1 31 TYR H . . 4.290 3.327 3.071 3.720 . 0 0 "[ . 1 . 2]" 1
823 1 30 MET ME 1 31 TYR QB . . 5.500 4.823 4.633 5.175 . 0 0 "[ . 1 . 2]" 1
824 1 30 MET ME 1 32 ILE HA . . 4.600 3.684 3.254 4.384 . 0 0 "[ . 1 . 2]" 1
825 1 30 MET ME 1 32 ILE MD . . 2.910 2.410 1.828 2.906 . 0 0 "[ . 1 . 2]" 1
826 1 30 MET ME 1 32 ILE QG . . 3.830 2.542 1.936 3.803 . 0 0 "[ . 1 . 2]" 1
827 1 30 MET QG 1 31 TYR H . . 3.960 3.263 2.933 3.879 . 0 0 "[ . 1 . 2]" 1
828 1 30 MET QG 1 32 ILE MD . . 3.790 2.583 2.009 3.564 . 0 0 "[ . 1 . 2]" 1
829 1 30 MET QG 1 32 ILE QG . . 5.080 3.500 3.032 4.508 . 0 0 "[ . 1 . 2]" 1
830 1 30 MET HG2 1 31 TYR H . . 4.550 4.444 4.159 4.557 0.007 4 0 "[ . 1 . 2]" 1
831 1 30 MET HG2 1 32 ILE MD . . 4.330 3.583 2.950 4.265 . 0 0 "[ . 1 . 2]" 1
832 1 30 MET HG3 1 31 TYR H . . 4.550 3.376 2.997 4.201 . 0 0 "[ . 1 . 2]" 1
833 1 30 MET HG3 1 32 ILE MD . . 4.330 2.699 2.029 4.126 . 0 0 "[ . 1 . 2]" 1
834 1 31 TYR H 1 31 TYR QB . . 3.700 2.561 2.468 2.635 . 0 0 "[ . 1 . 2]" 1
835 1 31 TYR H 1 31 TYR QD . . 4.590 4.349 4.264 4.407 . 0 0 "[ . 1 . 2]" 1
836 1 31 TYR H 1 32 ILE H . . 4.590 4.368 4.304 4.460 . 0 0 "[ . 1 . 2]" 1
837 1 31 TYR H 1 32 ILE MD . . 4.790 4.050 3.552 4.790 . 2 0 "[ . 1 . 2]" 1
838 1 31 TYR H 1 69 TYR QD . . 4.010 3.883 3.665 4.011 0.001 19 0 "[ . 1 . 2]" 1
839 1 31 TYR H 1 69 TYR QE . . 4.250 2.467 2.113 2.756 . 0 0 "[ . 1 . 2]" 1
840 1 31 TYR HA 1 31 TYR QD . . 3.630 2.845 2.423 3.127 . 0 0 "[ . 1 . 2]" 1
841 1 31 TYR HA 1 32 ILE H . . 3.120 2.182 2.152 2.254 . 0 0 "[ . 1 . 2]" 1
842 1 31 TYR HA 1 32 ILE HB . . 4.930 4.670 4.577 4.916 . 0 0 "[ . 1 . 2]" 1
843 1 31 TYR HA 1 32 ILE MG . . 5.500 5.438 5.332 5.458 . 0 0 "[ . 1 . 2]" 1
844 1 31 TYR QB 1 32 ILE H . . 4.070 3.651 3.497 3.731 . 0 0 "[ . 1 . 2]" 1
845 1 31 TYR QB 1 41 ILE MD . . 4.310 4.177 3.955 4.303 . 0 0 "[ . 1 . 2]" 1
846 1 31 TYR QB 1 44 PHE HZ . . 4.300 3.597 3.309 3.825 . 0 0 "[ . 1 . 2]" 1
847 1 31 TYR QB 1 69 TYR QE . . 3.530 2.249 1.861 2.641 . 0 0 "[ . 1 . 2]" 1
848 1 31 TYR QD 1 32 ILE H . . 3.850 3.354 2.873 3.601 . 0 0 "[ . 1 . 2]" 1
849 1 31 TYR QD 1 32 ILE HB . . 5.500 5.222 4.804 5.501 0.001 3 0 "[ . 1 . 2]" 1
850 1 31 TYR QD 1 41 ILE MD . . 4.140 3.068 2.922 3.238 . 0 0 "[ . 1 . 2]" 1
851 1 31 TYR QD 1 41 ILE QG . . 5.340 4.937 4.831 5.086 . 0 0 "[ . 1 . 2]" 1
852 1 31 TYR QE 1 33 PRO HA . . 3.760 2.581 2.053 3.354 . 0 0 "[ . 1 . 2]" 1
853 1 31 TYR QE 1 33 PRO HB2 . . 5.070 4.658 3.767 5.075 0.005 17 0 "[ . 1 . 2]" 1
854 1 31 TYR QE 1 33 PRO QB . . 4.210 3.310 2.106 4.042 . 0 0 "[ . 1 . 2]" 1
855 1 31 TYR QE 1 33 PRO HB3 . . 5.070 3.402 2.117 4.250 . 0 0 "[ . 1 . 2]" 1
856 1 31 TYR QE 1 41 ILE MD . . 4.040 2.033 1.935 2.395 . 0 0 "[ . 1 . 2]" 1
857 1 31 TYR QE 1 41 ILE HG12 . . 4.290 3.971 3.819 4.164 . 0 0 "[ . 1 . 2]" 1
858 1 31 TYR QE 1 41 ILE HG13 . . 4.290 4.237 4.045 4.296 0.006 19 0 "[ . 1 . 2]" 1
859 1 31 TYR QE 1 41 ILE MG . . 4.860 4.510 4.321 4.760 . 0 0 "[ . 1 . 2]" 1
860 1 31 TYR QE 1 88 CYS QB . . 5.340 4.470 3.946 4.974 . 0 0 "[ . 1 . 2]" 1
861 1 32 ILE H 1 32 ILE HB . . 3.410 2.630 2.495 2.886 . 0 0 "[ . 1 . 2]" 1
862 1 32 ILE H 1 32 ILE MD . . 3.740 2.506 1.887 3.733 . 0 0 "[ . 1 . 2]" 1
863 1 32 ILE H 1 32 ILE HG12 . . 4.220 3.661 2.100 4.218 . 0 0 "[ . 1 . 2]" 1
864 1 32 ILE H 1 32 ILE QG . . 3.530 3.016 2.083 3.446 . 0 0 "[ . 1 . 2]" 1
865 1 32 ILE H 1 32 ILE HG13 . . 4.220 3.541 3.160 4.095 . 0 0 "[ . 1 . 2]" 1
866 1 32 ILE H 1 32 ILE MG . . 3.960 3.840 3.784 3.903 . 0 0 "[ . 1 . 2]" 1
867 1 32 ILE H 1 33 PRO QD . . 4.700 3.912 3.694 4.272 . 0 0 "[ . 1 . 2]" 1
868 1 32 ILE HA 1 32 ILE MD . . 3.580 2.952 1.991 3.503 . 0 0 "[ . 1 . 2]" 1
869 1 32 ILE HA 1 32 ILE HG12 . . 4.070 3.436 2.943 3.681 . 0 0 "[ . 1 . 2]" 1
870 1 32 ILE HA 1 32 ILE QG . . 3.570 2.545 2.303 3.103 . 0 0 "[ . 1 . 2]" 1
871 1 32 ILE HA 1 32 ILE HG13 . . 4.070 2.813 2.333 3.916 . 0 0 "[ . 1 . 2]" 1
872 1 32 ILE HA 1 32 ILE MG . . 3.240 2.314 2.185 2.420 . 0 0 "[ . 1 . 2]" 1
873 1 32 ILE HA 1 33 PRO HB2 . . 5.450 5.457 5.441 5.467 0.017 1 0 "[ . 1 . 2]" 1
874 1 32 ILE HA 1 33 PRO QB . . 4.770 4.612 4.537 4.652 . 0 0 "[ . 1 . 2]" 1
875 1 32 ILE HA 1 33 PRO HB3 . . 5.450 4.975 4.849 5.037 . 0 0 "[ . 1 . 2]" 1
876 1 32 ILE HA 1 33 PRO QD . . 3.340 1.867 1.850 1.912 . 0 0 "[ . 1 . 2]" 1
877 1 32 ILE HA 1 33 PRO QG . . 4.340 3.781 3.765 3.812 . 0 0 "[ . 1 . 2]" 1
878 1 32 ILE HB 1 32 ILE MD . . 3.320 2.522 2.162 3.229 . 0 0 "[ . 1 . 2]" 1
879 1 32 ILE HB 1 35 SER QB . . 4.260 4.119 3.698 4.267 0.007 15 0 "[ . 1 . 2]" 1
880 1 32 ILE MD 1 33 PRO QD . . 4.750 4.042 3.043 4.557 . 0 0 "[ . 1 . 2]" 1
881 1 32 ILE MD 1 35 SER QB . . 5.350 5.224 4.940 5.353 0.003 1 0 "[ . 1 . 2]" 1
882 1 32 ILE QG 1 32 ILE MG . . 3.070 2.102 1.954 2.437 . 0 0 "[ . 1 . 2]" 1
883 1 32 ILE MG 1 33 PRO HA . . 4.730 4.363 4.034 4.603 . 0 0 "[ . 1 . 2]" 1
884 1 32 ILE MG 1 33 PRO QD . . 3.550 2.618 1.964 2.927 . 0 0 "[ . 1 . 2]" 1
885 1 32 ILE MG 1 33 PRO QG . . 3.950 3.740 3.038 3.975 0.025 16 0 "[ . 1 . 2]" 1
886 1 32 ILE MG 1 34 ALA H . . 4.330 2.116 1.757 2.523 . 0 0 "[ . 1 . 2]" 1
887 1 32 ILE MG 1 34 ALA HA . . 4.970 4.073 3.805 4.342 . 0 0 "[ . 1 . 2]" 1
888 1 32 ILE MG 1 34 ALA MB . . 3.010 2.084 1.898 2.399 . 0 0 "[ . 1 . 2]" 1
889 1 32 ILE MG 1 35 SER H . . 4.880 2.423 1.953 4.175 . 0 0 "[ . 1 . 2]" 1
890 1 32 ILE MG 1 35 SER QB . . 4.050 3.169 2.398 3.967 . 0 0 "[ . 1 . 2]" 1
891 1 33 PRO HA 1 34 ALA MB . . 5.000 4.942 4.863 5.016 0.016 17 0 "[ . 1 . 2]" 1
892 1 33 PRO QG 1 34 ALA H . . 4.530 2.625 2.051 3.086 . 0 0 "[ . 1 . 2]" 1
893 1 34 ALA H 1 34 ALA MB . . 3.640 2.221 2.123 2.340 . 0 0 "[ . 1 . 2]" 1
894 1 34 ALA MB 1 35 SER H . . 4.160 2.062 1.870 2.220 . 0 0 "[ . 1 . 2]" 1
895 1 34 ALA MB 1 35 SER HA . . 4.260 3.847 3.719 4.017 . 0 0 "[ . 1 . 2]" 1
896 1 34 ALA MB 1 36 ASN HB2 . . 5.500 5.483 5.410 5.515 0.015 9 0 "[ . 1 . 2]" 1
897 1 34 ALA MB 1 36 ASN HB3 . . 5.500 5.453 5.200 5.550 0.050 19 0 "[ . 1 . 2]" 1
898 1 36 ASN HA 1 36 ASN HD21 . . 4.830 3.758 1.972 4.513 . 0 0 "[ . 1 . 2]" 1
899 1 36 ASN HA 1 36 ASN QD . . 4.160 3.489 1.962 4.128 . 0 0 "[ . 1 . 2]" 1
900 1 36 ASN HA 1 36 ASN HD22 . . 4.830 4.392 3.534 4.781 . 0 0 "[ . 1 . 2]" 1
901 1 36 ASN HA 1 38 ASN H . . 4.160 4.028 3.773 4.134 . 0 0 "[ . 1 . 2]" 1
902 1 36 ASN QB 1 36 ASN QD . . 3.030 2.236 2.069 2.577 . 0 0 "[ . 1 . 2]" 1
903 1 36 ASN QB 1 38 ASN H . . 3.750 2.918 2.729 3.120 . 0 0 "[ . 1 . 2]" 1
904 1 36 ASN HB2 1 38 ASN H . . 4.400 4.201 4.040 4.307 . 0 0 "[ . 1 . 2]" 1
905 1 36 ASN HB3 1 38 ASN H . . 4.400 2.978 2.766 3.216 . 0 0 "[ . 1 . 2]" 1
906 1 37 ASN QB 1 39 THR H . . 4.580 3.499 3.201 3.970 . 0 0 "[ . 1 . 2]" 1
907 1 37 ASN QB 1 39 THR MG . . 3.570 3.117 2.685 3.457 . 0 0 "[ . 1 . 2]" 1
908 1 37 ASN HB2 1 38 ASN H . . 4.550 4.221 3.888 4.496 . 0 0 "[ . 1 . 2]" 1
909 1 37 ASN HB2 1 39 THR HB . . 4.630 3.665 2.689 4.492 . 0 0 "[ . 1 . 2]" 1
910 1 37 ASN HB2 1 39 THR MG . . 4.450 3.619 2.745 4.454 0.004 19 0 "[ . 1 . 2]" 1
911 1 37 ASN HB3 1 38 ASN H . . 4.550 4.226 3.892 4.545 . 0 0 "[ . 1 . 2]" 1
912 1 37 ASN HB3 1 39 THR HB . . 4.630 3.096 2.494 3.846 . 0 0 "[ . 1 . 2]" 1
913 1 37 ASN HB3 1 39 THR MG . . 4.450 3.772 2.936 4.363 . 0 0 "[ . 1 . 2]" 1
914 1 38 ASN H 1 39 THR MG . . 5.360 4.426 4.210 4.602 . 0 0 "[ . 1 . 2]" 1
915 1 38 ASN QB 1 38 ASN QD . . 3.020 2.178 2.073 2.416 . 0 0 "[ . 1 . 2]" 1
916 1 38 ASN QB 1 39 THR H . . 4.400 3.909 3.789 4.020 . 0 0 "[ . 1 . 2]" 1
917 1 39 THR H 1 39 THR HB . . 3.260 2.742 2.492 2.918 . 0 0 "[ . 1 . 2]" 1
918 1 39 THR H 1 39 THR MG . . 3.590 2.232 2.029 2.434 . 0 0 "[ . 1 . 2]" 1
919 1 39 THR H 1 40 PRO HD2 . . 5.060 4.839 4.824 4.844 . 0 0 "[ . 1 . 2]" 1
920 1 39 THR H 1 40 PRO HD3 . . 5.130 4.878 4.793 4.935 . 0 0 "[ . 1 . 2]" 1
921 1 39 THR HA 1 40 PRO HD2 . . 3.230 2.185 2.065 2.211 . 0 0 "[ . 1 . 2]" 1
922 1 39 THR HA 1 40 PRO HD3 . . 3.160 2.256 2.254 2.272 . 0 0 "[ . 1 . 2]" 1
923 1 39 THR HA 1 40 PRO HG2 . . 4.590 4.341 4.245 4.361 . 0 0 "[ . 1 . 2]" 1
924 1 39 THR HA 1 40 PRO HG3 . . 4.470 4.364 4.325 4.375 . 0 0 "[ . 1 . 2]" 1
925 1 39 THR HB 1 40 PRO HD2 . . 4.020 3.772 3.657 3.994 . 0 0 "[ . 1 . 2]" 1
926 1 39 THR HB 1 40 PRO HD3 . . 4.860 4.674 4.585 4.822 . 0 0 "[ . 1 . 2]" 1
927 1 39 THR MG 1 40 PRO HD2 . . 3.810 3.602 3.431 3.775 . 0 0 "[ . 1 . 2]" 1
928 1 39 THR MG 1 40 PRO HD3 . . 4.640 4.463 4.353 4.570 . 0 0 "[ . 1 . 2]" 1
929 1 39 THR MG 1 40 PRO HG2 . . 5.500 4.622 4.395 4.843 . 0 0 "[ . 1 . 2]" 1
930 1 39 THR MG 1 41 ILE HA . . 4.560 4.060 3.929 4.179 . 0 0 "[ . 1 . 2]" 1
931 1 39 THR MG 1 41 ILE MD . . 4.570 4.183 3.995 4.431 . 0 0 "[ . 1 . 2]" 1
932 1 39 THR MG 1 41 ILE MG . . 4.780 4.557 4.422 4.701 . 0 0 "[ . 1 . 2]" 1
933 1 39 THR MG 1 90 ASN HD21 . . 3.840 2.803 2.250 3.844 0.004 12 0 "[ . 1 . 2]" 1
934 1 39 THR MG 1 90 ASN QD . . 3.330 2.530 2.081 3.002 . 0 0 "[ . 1 . 2]" 1
935 1 39 THR MG 1 90 ASN HD22 . . 3.840 2.979 2.410 3.731 . 0 0 "[ . 1 . 2]" 1
936 1 40 PRO HA 1 41 ILE H . . 2.750 2.182 2.156 2.234 . 0 0 "[ . 1 . 2]" 1
937 1 40 PRO HA 1 41 ILE HG12 . . 4.850 4.539 4.120 4.696 . 0 0 "[ . 1 . 2]" 1
938 1 40 PRO HA 1 41 ILE QG . . 4.250 3.392 3.278 3.500 . 0 0 "[ . 1 . 2]" 1
939 1 40 PRO HA 1 41 ILE HG13 . . 4.850 3.505 3.377 3.625 . 0 0 "[ . 1 . 2]" 1
940 1 40 PRO HA 1 41 ILE MG . . 5.450 5.425 5.358 5.453 0.003 6 0 "[ . 1 . 2]" 1
941 1 40 PRO QB 1 41 ILE H . . 3.340 3.159 2.954 3.302 . 0 0 "[ . 1 . 2]" 1
942 1 40 PRO HB2 1 41 ILE H . . 4.010 3.346 3.099 3.521 . 0 0 "[ . 1 . 2]" 1
943 1 40 PRO HB3 1 41 ILE H . . 4.010 3.879 3.724 3.992 . 0 0 "[ . 1 . 2]" 1
944 1 40 PRO HG2 1 41 ILE H . . 4.970 4.876 4.749 4.954 . 0 0 "[ . 1 . 2]" 1
945 1 41 ILE H 1 41 ILE HB . . 3.440 2.709 2.649 2.824 . 0 0 "[ . 1 . 2]" 1
946 1 41 ILE H 1 41 ILE MD . . 3.970 3.785 3.681 3.901 . 0 0 "[ . 1 . 2]" 1
947 1 41 ILE H 1 41 ILE HG12 . . 3.580 3.368 3.182 3.574 . 0 0 "[ . 1 . 2]" 1
948 1 41 ILE H 1 41 ILE HG13 . . 3.580 2.264 2.169 2.351 . 0 0 "[ . 1 . 2]" 1
949 1 41 ILE H 1 41 ILE MG . . 4.060 3.844 3.813 3.876 . 0 0 "[ . 1 . 2]" 1
950 1 41 ILE HA 1 41 ILE MD . . 3.960 3.857 3.813 3.908 . 0 0 "[ . 1 . 2]" 1
951 1 41 ILE HA 1 41 ILE MG . . 3.490 2.318 2.199 2.364 . 0 0 "[ . 1 . 2]" 1
952 1 41 ILE HA 1 42 HIS H . . 3.300 2.203 2.180 2.232 . 0 0 "[ . 1 . 2]" 1
953 1 41 ILE HA 1 43 GLY H . . 4.500 4.125 3.924 4.246 . 0 0 "[ . 1 . 2]" 1
954 1 41 ILE HA 1 90 ASN QB . . 3.810 2.009 1.840 2.168 . 0 0 "[ . 1 . 2]" 1
955 1 41 ILE HB 1 41 ILE MD . . 3.360 2.450 2.367 2.533 . 0 0 "[ . 1 . 2]" 1
956 1 41 ILE HB 1 42 HIS H . . 3.950 3.852 3.733 3.949 . 0 0 "[ . 1 . 2]" 1
957 1 41 ILE HB 1 43 GLY H . . 3.990 3.963 3.789 3.995 0.005 15 0 "[ . 1 . 2]" 1
958 1 41 ILE HB 1 89 PHE H . . 5.500 5.427 5.242 5.504 0.004 9 0 "[ . 1 . 2]" 1
959 1 41 ILE HB 1 90 ASN QB . . 4.870 4.530 4.247 4.809 . 0 0 "[ . 1 . 2]" 1
960 1 41 ILE MD 1 41 ILE MG . . 2.940 1.929 1.889 1.984 . 0 0 "[ . 1 . 2]" 1
961 1 41 ILE MD 1 42 HIS H . . 4.970 4.936 4.835 4.975 0.005 19 0 "[ . 1 . 2]" 1
962 1 41 ILE MD 1 43 GLY H . . 5.010 4.886 4.816 4.951 . 0 0 "[ . 1 . 2]" 1
963 1 41 ILE MD 1 44 PHE QD . . 4.280 4.218 4.119 4.285 0.005 13 0 "[ . 1 . 2]" 1
964 1 41 ILE MD 1 44 PHE QE . . 4.330 2.824 2.653 3.020 . 0 0 "[ . 1 . 2]" 1
965 1 41 ILE MD 1 44 PHE HZ . . 4.020 2.664 2.340 2.919 . 0 0 "[ . 1 . 2]" 1
966 1 41 ILE MD 1 66 GLY HA2 . . 5.500 4.697 4.250 4.997 . 0 0 "[ . 1 . 2]" 1
967 1 41 ILE MD 1 66 GLY QA . . 4.670 4.356 3.927 4.636 . 0 0 "[ . 1 . 2]" 1
968 1 41 ILE MD 1 66 GLY HA3 . . 5.500 5.158 4.618 5.499 . 0 0 "[ . 1 . 2]" 1
969 1 41 ILE MD 1 88 CYS HB2 . . 4.120 2.932 2.539 3.198 . 0 0 "[ . 1 . 2]" 1
970 1 41 ILE MD 1 88 CYS QB . . 3.520 2.825 2.463 3.054 . 0 0 "[ . 1 . 2]" 1
971 1 41 ILE MD 1 88 CYS HB3 . . 4.120 3.703 3.316 3.876 . 0 0 "[ . 1 . 2]" 1
972 1 41 ILE MD 1 89 PHE H . . 4.830 4.552 4.286 4.829 . 0 0 "[ . 1 . 2]" 1
973 1 41 ILE MD 1 90 ASN QB . . 4.640 4.454 4.238 4.633 . 0 0 "[ . 1 . 2]" 1
974 1 41 ILE QG 1 44 PHE QE . . 5.340 4.791 4.652 4.899 . 0 0 "[ . 1 . 2]" 1
975 1 41 ILE HG12 1 41 ILE MG . . 3.550 2.372 2.288 2.496 . 0 0 "[ . 1 . 2]" 1
976 1 41 ILE HG13 1 41 ILE MG . . 3.550 3.199 3.193 3.203 . 0 0 "[ . 1 . 2]" 1
977 1 41 ILE MG 1 42 HIS H . . 3.870 2.222 1.998 2.428 . 0 0 "[ . 1 . 2]" 1
978 1 41 ILE MG 1 43 GLY H . . 3.610 1.955 1.892 2.082 . 0 0 "[ . 1 . 2]" 1
979 1 41 ILE MG 1 43 GLY HA2 . . 4.510 3.697 3.569 3.812 . 0 0 "[ . 1 . 2]" 1
980 1 41 ILE MG 1 44 PHE QD . . 4.610 3.808 3.712 3.929 . 0 0 "[ . 1 . 2]" 1
981 1 41 ILE MG 1 44 PHE QE . . 4.260 3.390 3.260 3.552 . 0 0 "[ . 1 . 2]" 1
982 1 41 ILE MG 1 66 GLY HA2 . . 4.480 3.764 3.281 3.969 . 0 0 "[ . 1 . 2]" 1
983 1 41 ILE MG 1 66 GLY HA3 . . 4.480 4.167 3.528 4.472 . 0 0 "[ . 1 . 2]" 1
984 1 41 ILE MG 1 88 CYS HB2 . . 4.010 2.300 2.020 2.521 . 0 0 "[ . 1 . 2]" 1
985 1 41 ILE MG 1 88 CYS QB . . 3.420 2.278 2.007 2.492 . 0 0 "[ . 1 . 2]" 1
986 1 41 ILE MG 1 88 CYS HB3 . . 4.010 3.704 3.469 3.904 . 0 0 "[ . 1 . 2]" 1
987 1 41 ILE MG 1 89 PHE H . . 3.930 2.656 2.514 2.747 . 0 0 "[ . 1 . 2]" 1
988 1 41 ILE MG 1 90 ASN QB . . 4.290 2.694 2.257 3.025 . 0 0 "[ . 1 . 2]" 1
989 1 42 HIS H 1 42 HIS HB2 . . 3.950 2.219 2.183 2.275 . 0 0 "[ . 1 . 2]" 1
990 1 42 HIS H 1 42 HIS QB . . 3.460 2.197 2.162 2.250 . 0 0 "[ . 1 . 2]" 1
991 1 42 HIS H 1 42 HIS HB3 . . 3.950 3.516 3.490 3.548 . 0 0 "[ . 1 . 2]" 1
992 1 42 HIS H 1 42 HIS HD2 . . 4.540 3.428 2.925 4.109 . 0 0 "[ . 1 . 2]" 1
993 1 42 HIS H 1 43 GLY H . . 3.350 2.533 2.362 2.639 . 0 0 "[ . 1 . 2]" 1
994 1 42 HIS H 1 89 PHE H . . 4.710 4.446 4.203 4.610 . 0 0 "[ . 1 . 2]" 1
995 1 42 HIS H 1 90 ASN HA . . 4.150 2.258 2.004 2.900 . 0 0 "[ . 1 . 2]" 1
996 1 42 HIS H 1 90 ASN QB . . 4.100 2.469 1.726 2.945 . 0 0 "[ . 1 . 2]" 1
997 1 42 HIS HA 1 42 HIS HD2 . . 3.500 2.350 2.126 2.683 . 0 0 "[ . 1 . 2]" 1
998 1 42 HIS QB 1 89 PHE QD . . 4.260 3.469 2.787 4.157 . 0 0 "[ . 1 . 2]" 1
999 1 42 HIS QB 1 89 PHE QE . . 3.910 3.040 2.350 3.888 . 0 0 "[ . 1 . 2]" 1
1000 1 42 HIS QB 1 90 ASN HA . . 3.730 2.194 2.004 2.525 . 0 0 "[ . 1 . 2]" 1
1001 1 42 HIS QB 1 91 GLU H . . 4.950 3.867 3.552 4.096 . 0 0 "[ . 1 . 2]" 1
1002 1 42 HIS HB2 1 43 GLY H . . 4.040 2.782 2.696 2.966 . 0 0 "[ . 1 . 2]" 1
1003 1 42 HIS HB2 1 89 PHE QE . . 4.450 3.498 2.864 4.324 . 0 0 "[ . 1 . 2]" 1
1004 1 42 HIS HB2 1 90 ASN HA . . 4.460 2.208 2.014 2.545 . 0 0 "[ . 1 . 2]" 1
1005 1 42 HIS HB3 1 43 GLY H . . 4.040 3.360 3.258 3.537 . 0 0 "[ . 1 . 2]" 1
1006 1 42 HIS HB3 1 89 PHE QE . . 4.450 3.359 2.497 4.408 . 0 0 "[ . 1 . 2]" 1
1007 1 42 HIS HB3 1 90 ASN HA . . 4.460 3.840 3.584 4.224 . 0 0 "[ . 1 . 2]" 1
1008 1 42 HIS HD2 1 90 ASN HA . . 4.570 3.783 3.169 4.471 . 0 0 "[ . 1 . 2]" 1
1009 1 42 HIS HD2 1 90 ASN QB . . 4.840 3.808 2.673 4.772 . 0 0 "[ . 1 . 2]" 1
1010 1 42 HIS HE1 1 91 GLU HA . . 4.300 2.919 2.003 3.938 . 0 0 "[ . 1 . 2]" 1
1011 1 42 HIS HE1 1 91 GLU QB . . 3.500 2.837 2.329 3.473 . 0 0 "[ . 1 . 2]" 1
1012 1 42 HIS HE1 1 91 GLU QG . . 5.340 4.180 2.893 5.197 . 0 0 "[ . 1 . 2]" 1
1013 1 43 GLY H 1 44 PHE H . . 4.310 4.209 4.102 4.324 0.014 20 0 "[ . 1 . 2]" 1
1014 1 43 GLY H 1 89 PHE H . . 3.850 3.523 3.174 3.792 . 0 0 "[ . 1 . 2]" 1
1015 1 43 GLY HA2 1 44 PHE H . . 3.310 2.948 2.793 3.061 . 0 0 "[ . 1 . 2]" 1
1016 1 43 GLY HA2 1 63 MET ME . . 4.840 4.363 3.885 4.769 . 0 0 "[ . 1 . 2]" 1
1017 1 43 GLY HA2 1 65 GLU HA . . 4.240 3.702 3.352 3.951 . 0 0 "[ . 1 . 2]" 1
1018 1 43 GLY HA2 1 66 GLY H . . 3.950 2.869 2.498 3.226 . 0 0 "[ . 1 . 2]" 1
1019 1 43 GLY HA3 1 44 PHE H . . 3.280 2.248 2.184 2.356 . 0 0 "[ . 1 . 2]" 1
1020 1 43 GLY HA3 1 63 MET ME . . 4.000 3.325 2.761 3.748 . 0 0 "[ . 1 . 2]" 1
1021 1 43 GLY HA3 1 65 GLU HA . . 4.270 4.123 3.804 4.274 0.004 13 0 "[ . 1 . 2]" 1
1022 1 43 GLY HA3 1 66 GLY H . . 4.490 4.078 3.859 4.383 . 0 0 "[ . 1 . 2]" 1
1023 1 43 GLY HA3 1 89 PHE QE . . 4.530 3.040 2.623 3.532 . 0 0 "[ . 1 . 2]" 1
1024 1 43 GLY HA3 1 89 PHE HZ . . 4.470 3.652 2.649 4.342 . 0 0 "[ . 1 . 2]" 1
1025 1 44 PHE H 1 44 PHE HB2 . . 3.830 2.756 2.670 2.851 . 0 0 "[ . 1 . 2]" 1
1026 1 44 PHE H 1 44 PHE HB3 . . 4.170 3.804 3.759 3.862 . 0 0 "[ . 1 . 2]" 1
1027 1 44 PHE H 1 44 PHE QD . . 4.130 3.924 3.649 4.090 . 0 0 "[ . 1 . 2]" 1
1028 1 44 PHE H 1 63 MET HA . . 4.220 3.882 3.694 4.216 . 0 0 "[ . 1 . 2]" 1
1029 1 44 PHE H 1 63 MET QG . . 4.140 3.212 2.835 3.552 . 0 0 "[ . 1 . 2]" 1
1030 1 44 PHE H 1 64 VAL H . . 3.630 2.180 1.962 2.411 . 0 0 "[ . 1 . 2]" 1
1031 1 44 PHE H 1 64 VAL HB . . 4.200 3.295 2.803 3.536 . 0 0 "[ . 1 . 2]" 1
1032 1 44 PHE H 1 64 VAL MG1 . . 4.610 4.437 4.037 4.609 . 0 0 "[ . 1 . 2]" 1
1033 1 44 PHE H 1 64 VAL MG2 . . 4.320 4.084 3.735 4.306 . 0 0 "[ . 1 . 2]" 1
1034 1 44 PHE H 1 65 GLU HA . . 4.870 4.715 4.532 4.861 . 0 0 "[ . 1 . 2]" 1
1035 1 44 PHE H 1 66 GLY H . . 5.320 5.160 4.991 5.323 0.003 13 0 "[ . 1 . 2]" 1
1036 1 44 PHE H 1 86 MET ME . . 5.500 5.340 4.990 5.491 . 0 0 "[ . 1 . 2]" 1
1037 1 44 PHE H 1 89 PHE H . . 5.500 5.261 4.984 5.499 . 0 0 "[ . 1 . 2]" 1
1038 1 44 PHE H 1 89 PHE QE . . 3.930 2.956 2.605 3.355 . 0 0 "[ . 1 . 2]" 1
1039 1 44 PHE HA 1 44 PHE QD . . 4.390 2.281 2.176 2.509 . 0 0 "[ . 1 . 2]" 1
1040 1 44 PHE HA 1 45 TYR H . . 3.290 2.143 2.138 2.155 . 0 0 "[ . 1 . 2]" 1
1041 1 44 PHE HA 1 86 MET ME . . 4.100 3.678 3.120 3.953 . 0 0 "[ . 1 . 2]" 1
1042 1 44 PHE HA 1 88 CYS HA . . 3.810 2.400 2.174 2.572 . 0 0 "[ . 1 . 2]" 1
1043 1 44 PHE HA 1 88 CYS HB2 . . 4.690 3.529 3.190 3.854 . 0 0 "[ . 1 . 2]" 1
1044 1 44 PHE HA 1 88 CYS QB . . 4.110 3.304 3.026 3.573 . 0 0 "[ . 1 . 2]" 1
1045 1 44 PHE HA 1 88 CYS HB3 . . 4.690 3.998 3.714 4.228 . 0 0 "[ . 1 . 2]" 1
1046 1 44 PHE HA 1 89 PHE H . . 3.960 3.537 3.246 3.777 . 0 0 "[ . 1 . 2]" 1
1047 1 44 PHE HB2 1 45 TYR H . . 4.540 4.386 4.285 4.455 . 0 0 "[ . 1 . 2]" 1
1048 1 44 PHE HB2 1 46 ILE MD . . 4.940 4.295 4.115 4.570 . 0 0 "[ . 1 . 2]" 1
1049 1 44 PHE HB2 1 64 VAL HB . . 3.900 2.028 1.997 2.129 . 0 0 "[ . 1 . 2]" 1
1050 1 44 PHE HB2 1 64 VAL MG2 . . 3.580 3.387 3.111 3.585 0.005 13 0 "[ . 1 . 2]" 1
1051 1 44 PHE HB2 1 86 MET ME . . 4.190 3.685 3.310 3.856 . 0 0 "[ . 1 . 2]" 1
1052 1 44 PHE HB3 1 45 TYR H . . 3.770 3.436 3.273 3.542 . 0 0 "[ . 1 . 2]" 1
1053 1 44 PHE HB3 1 46 ILE MD . . 3.940 3.841 3.715 3.935 . 0 0 "[ . 1 . 2]" 1
1054 1 44 PHE HB3 1 46 ILE HG12 . . 4.910 4.706 4.492 4.900 . 0 0 "[ . 1 . 2]" 1
1055 1 44 PHE HB3 1 64 VAL HB . . 3.990 3.195 2.882 3.470 . 0 0 "[ . 1 . 2]" 1
1056 1 44 PHE HB3 1 64 VAL MG2 . . 3.950 3.633 3.402 3.791 . 0 0 "[ . 1 . 2]" 1
1057 1 44 PHE HB3 1 86 MET ME . . 3.150 2.311 1.975 2.467 . 0 0 "[ . 1 . 2]" 1
1058 1 44 PHE QD 1 45 TYR H . . 4.080 3.483 3.316 3.609 . 0 0 "[ . 1 . 2]" 1
1059 1 44 PHE QD 1 64 VAL HB . . 4.190 3.561 3.257 3.799 . 0 0 "[ . 1 . 2]" 1
1060 1 44 PHE QD 1 64 VAL MG1 . . 3.740 3.714 3.631 3.744 0.004 20 0 "[ . 1 . 2]" 1
1061 1 44 PHE QD 1 64 VAL MG2 . . 5.060 4.714 4.492 4.861 . 0 0 "[ . 1 . 2]" 1
1062 1 44 PHE QD 1 86 MET ME . . 3.250 2.725 2.473 2.889 . 0 0 "[ . 1 . 2]" 1
1063 1 44 PHE QD 1 87 GLN H . . 5.130 4.969 4.754 5.135 0.005 12 0 "[ . 1 . 2]" 1
1064 1 44 PHE QD 1 88 CYS HA . . 4.070 2.578 2.403 2.733 . 0 0 "[ . 1 . 2]" 1
1065 1 44 PHE QD 1 88 CYS HB2 . . 4.140 2.737 2.446 3.021 . 0 0 "[ . 1 . 2]" 1
1066 1 44 PHE QD 1 88 CYS QB . . 3.560 2.215 1.995 2.387 . 0 0 "[ . 1 . 2]" 1
1067 1 44 PHE QD 1 88 CYS HB3 . . 4.140 2.353 2.103 2.583 . 0 0 "[ . 1 . 2]" 1
1068 1 44 PHE QD 1 89 PHE H . . 4.460 4.273 4.124 4.413 . 0 0 "[ . 1 . 2]" 1
1069 1 44 PHE QE 1 86 MET ME . . 4.040 3.960 3.775 4.038 . 0 0 "[ . 1 . 2]" 1
1070 1 44 PHE QE 1 88 CYS HB2 . . 4.310 2.601 2.379 2.779 . 0 0 "[ . 1 . 2]" 1
1071 1 44 PHE QE 1 88 CYS QB . . 3.710 2.037 1.903 2.209 . 0 0 "[ . 1 . 2]" 1
1072 1 44 PHE QE 1 88 CYS HB3 . . 4.310 2.133 2.002 2.365 . 0 0 "[ . 1 . 2]" 1
1073 1 44 PHE HZ 1 69 TYR QD . . 4.960 4.553 3.934 4.868 . 0 0 "[ . 1 . 2]" 1
1074 1 44 PHE HZ 1 69 TYR QE . . 3.990 3.268 2.362 3.928 . 0 0 "[ . 1 . 2]" 1
1075 1 45 TYR H 1 45 TYR HB2 . . 3.960 2.289 2.247 2.324 . 0 0 "[ . 1 . 2]" 1
1076 1 45 TYR H 1 45 TYR HB3 . . 3.890 3.546 3.501 3.583 . 0 0 "[ . 1 . 2]" 1
1077 1 45 TYR H 1 45 TYR QD . . 4.390 3.629 3.476 3.788 . 0 0 "[ . 1 . 2]" 1
1078 1 45 TYR H 1 46 ILE H . . 4.780 4.539 4.481 4.571 . 0 0 "[ . 1 . 2]" 1
1079 1 45 TYR H 1 46 ILE MD . . 5.500 5.403 5.312 5.500 . 0 0 "[ . 1 . 2]" 1
1080 1 45 TYR H 1 46 ILE HG13 . . 5.240 4.432 4.343 4.548 . 0 0 "[ . 1 . 2]" 1
1081 1 45 TYR H 1 47 TYR QE . . 5.230 4.838 4.566 5.131 . 0 0 "[ . 1 . 2]" 1
1082 1 45 TYR H 1 86 MET ME . . 4.310 3.500 2.877 3.791 . 0 0 "[ . 1 . 2]" 1
1083 1 45 TYR H 1 87 GLN H . . 3.810 3.554 3.291 3.749 . 0 0 "[ . 1 . 2]" 1
1084 1 45 TYR H 1 87 GLN QB . . 4.970 4.706 4.509 4.926 . 0 0 "[ . 1 . 2]" 1
1085 1 45 TYR H 1 88 CYS HA . . 3.810 2.593 2.408 2.919 . 0 0 "[ . 1 . 2]" 1
1086 1 45 TYR H 1 89 PHE H . . 4.850 4.203 3.999 4.397 . 0 0 "[ . 1 . 2]" 1
1087 1 45 TYR H 1 89 PHE QD . . 4.450 3.130 2.762 3.363 . 0 0 "[ . 1 . 2]" 1
1088 1 45 TYR HA 1 45 TYR QD . . 3.460 2.048 1.995 2.188 . 0 0 "[ . 1 . 2]" 1
1089 1 45 TYR HA 1 45 TYR QE . . 4.390 4.188 4.138 4.255 . 0 0 "[ . 1 . 2]" 1
1090 1 45 TYR HA 1 46 ILE H . . 3.090 2.219 2.172 2.286 . 0 0 "[ . 1 . 2]" 1
1091 1 45 TYR HA 1 46 ILE MD . . 4.520 4.375 4.244 4.509 . 0 0 "[ . 1 . 2]" 1
1092 1 45 TYR HA 1 47 TYR QE . . 5.090 4.566 4.403 4.773 . 0 0 "[ . 1 . 2]" 1
1093 1 45 TYR HA 1 63 MET HA . . 4.100 2.563 2.215 2.817 . 0 0 "[ . 1 . 2]" 1
1094 1 45 TYR HA 1 64 VAL H . . 4.230 3.779 3.467 3.983 . 0 0 "[ . 1 . 2]" 1
1095 1 45 TYR HB2 1 46 ILE H . . 5.090 4.188 4.017 4.328 . 0 0 "[ . 1 . 2]" 1
1096 1 45 TYR HB2 1 47 TYR QE . . 3.700 2.891 2.646 3.115 . 0 0 "[ . 1 . 2]" 1
1097 1 45 TYR HB2 1 61 LYS HD2 . . 4.460 4.046 3.808 4.245 . 0 0 "[ . 1 . 2]" 1
1098 1 45 TYR HB2 1 61 LYS HD3 . . 5.500 5.444 5.228 5.502 0.002 15 0 "[ . 1 . 2]" 1
1099 1 45 TYR HB2 1 61 LYS QG . . 4.210 3.886 3.692 4.030 . 0 0 "[ . 1 . 2]" 1
1100 1 45 TYR HB2 1 87 GLN H . . 4.610 3.541 3.409 3.655 . 0 0 "[ . 1 . 2]" 1
1101 1 45 TYR HB3 1 46 ILE H . . 4.290 3.017 2.763 3.243 . 0 0 "[ . 1 . 2]" 1
1102 1 45 TYR HB3 1 47 TYR QE . . 3.680 2.063 1.998 2.352 . 0 0 "[ . 1 . 2]" 1
1103 1 45 TYR HB3 1 61 LYS HD2 . . 4.820 3.192 2.942 3.372 . 0 0 "[ . 1 . 2]" 1
1104 1 45 TYR HB3 1 61 LYS QE . . 4.940 4.684 4.167 4.936 . 0 0 "[ . 1 . 2]" 1
1105 1 45 TYR HB3 1 61 LYS HG2 . . 4.890 3.477 2.713 3.977 . 0 0 "[ . 1 . 2]" 1
1106 1 45 TYR HB3 1 61 LYS HG3 . . 4.890 2.482 2.288 2.619 . 0 0 "[ . 1 . 2]" 1
1107 1 45 TYR HB3 1 87 GLN H . . 4.640 3.923 3.694 4.091 . 0 0 "[ . 1 . 2]" 1
1108 1 45 TYR HB3 1 89 PHE QD . . 5.500 4.958 4.408 5.315 . 0 0 "[ . 1 . 2]" 1
1109 1 45 TYR QD 1 46 ILE H . . 3.740 3.043 2.833 3.227 . 0 0 "[ . 1 . 2]" 1
1110 1 45 TYR QD 1 47 TYR QE . . 4.060 3.919 3.838 4.064 0.004 7 0 "[ . 1 . 2]" 1
1111 1 45 TYR QD 1 61 LYS HD2 . . 4.550 3.153 2.954 3.308 . 0 0 "[ . 1 . 2]" 1
1112 1 45 TYR QD 1 61 LYS HD3 . . 5.060 4.406 4.134 4.597 . 0 0 "[ . 1 . 2]" 1
1113 1 45 TYR QD 1 61 LYS QE . . 3.770 3.526 2.858 3.773 0.003 15 0 "[ . 1 . 2]" 1
1114 1 45 TYR QD 1 61 LYS HG2 . . 4.670 2.295 2.071 2.466 . 0 0 "[ . 1 . 2]" 1
1115 1 45 TYR QD 1 61 LYS HG3 . . 4.670 2.938 2.372 3.653 . 0 0 "[ . 1 . 2]" 1
1116 1 45 TYR QD 1 63 MET H . . 4.360 3.414 3.232 3.587 . 0 0 "[ . 1 . 2]" 1
1117 1 45 TYR QD 1 63 MET HA . . 3.820 2.450 2.176 2.720 . 0 0 "[ . 1 . 2]" 1
1118 1 45 TYR QD 1 63 MET QB . . 4.130 3.316 3.093 3.566 . 0 0 "[ . 1 . 2]" 1
1119 1 45 TYR QD 1 64 VAL H . . 4.650 4.431 4.089 4.645 . 0 0 "[ . 1 . 2]" 1
1120 1 45 TYR QD 1 89 PHE QD . . 4.050 2.706 2.299 3.151 . 0 0 "[ . 1 . 2]" 1
1121 1 45 TYR QD 1 94 GLU HG2 . . 4.240 3.325 2.781 4.081 . 0 0 "[ . 1 . 2]" 1
1122 1 45 TYR QD 1 94 GLU HG3 . . 4.830 4.487 4.003 4.814 . 0 0 "[ . 1 . 2]" 1
1123 1 45 TYR QE 1 46 ILE H . . 5.500 5.314 5.108 5.500 . 9 0 "[ . 1 . 2]" 1
1124 1 45 TYR QE 1 47 TYR QE . . 5.500 5.496 5.477 5.508 0.008 19 0 "[ . 1 . 2]" 1
1125 1 45 TYR QE 1 61 LYS HD2 . . 5.340 3.537 3.183 3.865 . 0 0 "[ . 1 . 2]" 1
1126 1 45 TYR QE 1 61 LYS QE . . 3.380 2.675 2.328 2.904 . 0 0 "[ . 1 . 2]" 1
1127 1 45 TYR QE 1 61 LYS HG2 . . 5.330 2.927 2.357 3.732 . 0 0 "[ . 1 . 2]" 1
1128 1 45 TYR QE 1 61 LYS HG3 . . 5.330 4.288 3.664 4.962 . 0 0 "[ . 1 . 2]" 1
1129 1 45 TYR QE 1 63 MET HA . . 4.400 3.217 2.793 3.521 . 0 0 "[ . 1 . 2]" 1
1130 1 45 TYR QE 1 63 MET HB2 . . 4.050 2.065 1.993 2.275 . 0 0 "[ . 1 . 2]" 1
1131 1 45 TYR QE 1 63 MET QB . . 3.410 2.056 1.985 2.262 . 0 0 "[ . 1 . 2]" 1
1132 1 45 TYR QE 1 63 MET HB3 . . 4.050 3.765 3.665 3.958 . 0 0 "[ . 1 . 2]" 1
1133 1 45 TYR QE 1 63 MET HG2 . . 4.020 3.682 3.128 4.024 0.004 13 0 "[ . 1 . 2]" 1
1134 1 45 TYR QE 1 63 MET QG . . 3.370 2.540 2.102 3.016 . 0 0 "[ . 1 . 2]" 1
1135 1 45 TYR QE 1 63 MET HG3 . . 4.020 2.648 2.119 3.438 . 0 0 "[ . 1 . 2]" 1
1136 1 45 TYR QE 1 64 VAL H . . 5.270 5.062 4.595 5.276 0.006 3 0 "[ . 1 . 2]" 1
1137 1 45 TYR QE 1 89 PHE HB2 . . 4.490 3.935 3.302 4.340 . 0 0 "[ . 1 . 2]" 1
1138 1 45 TYR QE 1 89 PHE QE . . 4.330 3.300 2.924 3.627 . 0 0 "[ . 1 . 2]" 1
1139 1 45 TYR QE 1 94 GLU HG2 . . 4.270 4.006 3.400 4.270 . 0 0 "[ . 1 . 2]" 1
1140 1 45 TYR QE 1 94 GLU HG3 . . 4.850 4.354 4.001 4.690 . 0 0 "[ . 1 . 2]" 1
1141 1 46 ILE H 1 46 ILE HB . . 3.470 2.727 2.611 2.824 . 0 0 "[ . 1 . 2]" 1
1142 1 46 ILE H 1 46 ILE MD . . 3.750 3.702 3.631 3.753 0.003 19 0 "[ . 1 . 2]" 1
1143 1 46 ILE H 1 46 ILE HG12 . . 4.380 4.313 4.226 4.370 . 0 0 "[ . 1 . 2]" 1
1144 1 46 ILE H 1 46 ILE HG13 . . 3.830 2.985 2.876 3.074 . 0 0 "[ . 1 . 2]" 1
1145 1 46 ILE H 1 46 ILE MG . . 3.970 3.875 3.812 3.918 . 0 0 "[ . 1 . 2]" 1
1146 1 46 ILE H 1 47 TYR QE . . 4.850 4.333 4.148 4.781 . 0 0 "[ . 1 . 2]" 1
1147 1 46 ILE H 1 61 LYS HA . . 5.040 3.564 3.384 3.653 . 0 0 "[ . 1 . 2]" 1
1148 1 46 ILE H 1 62 ASP H . . 3.760 2.110 1.947 2.301 . 0 0 "[ . 1 . 2]" 1
1149 1 46 ILE H 1 62 ASP HB2 . . 3.840 3.330 3.045 3.664 . 0 0 "[ . 1 . 2]" 1
1150 1 46 ILE H 1 62 ASP HB3 . . 4.380 4.178 3.883 4.383 0.003 3 0 "[ . 1 . 2]" 1
1151 1 46 ILE H 1 63 MET HA . . 4.640 4.053 3.726 4.379 . 0 0 "[ . 1 . 2]" 1
1152 1 46 ILE H 1 64 VAL H . . 5.500 5.410 5.031 5.502 0.002 3 0 "[ . 1 . 2]" 1
1153 1 46 ILE HA 1 46 ILE MD . . 3.890 3.882 3.847 3.904 0.014 10 0 "[ . 1 . 2]" 1
1154 1 46 ILE HA 1 46 ILE HG12 . . 4.150 2.817 2.781 2.850 . 0 0 "[ . 1 . 2]" 1
1155 1 46 ILE HA 1 46 ILE HG13 . . 3.990 2.700 2.609 2.772 . 0 0 "[ . 1 . 2]" 1
1156 1 46 ILE HA 1 46 ILE MG . . 3.350 2.412 2.349 2.475 . 0 0 "[ . 1 . 2]" 1
1157 1 46 ILE HA 1 47 TYR H . . 3.260 2.144 2.139 2.150 . 0 0 "[ . 1 . 2]" 1
1158 1 46 ILE HA 1 47 TYR QD . . 4.580 2.919 2.805 3.191 . 0 0 "[ . 1 . 2]" 1
1159 1 46 ILE HA 1 86 MET HA . . 3.990 2.235 2.016 2.377 . 0 0 "[ . 1 . 2]" 1
1160 1 46 ILE HA 1 86 MET HB2 . . 4.390 2.478 2.050 2.823 . 0 0 "[ . 1 . 2]" 1
1161 1 46 ILE HA 1 86 MET HB3 . . 4.390 2.560 2.326 2.874 . 0 0 "[ . 1 . 2]" 1
1162 1 46 ILE HA 1 86 MET ME . . 4.300 3.697 3.346 3.904 . 0 0 "[ . 1 . 2]" 1
1163 1 46 ILE HA 1 86 MET QG . . 4.570 4.249 4.038 4.368 . 0 0 "[ . 1 . 2]" 1
1164 1 46 ILE HA 1 87 GLN H . . 4.290 3.254 3.060 3.517 . 0 0 "[ . 1 . 2]" 1
1165 1 46 ILE HB 1 46 ILE MD . . 3.340 2.228 2.133 2.285 . 0 0 "[ . 1 . 2]" 1
1166 1 46 ILE HB 1 47 TYR H . . 4.430 4.228 4.157 4.337 . 0 0 "[ . 1 . 2]" 1
1167 1 46 ILE HB 1 62 ASP H . . 4.160 3.255 3.089 3.458 . 0 0 "[ . 1 . 2]" 1
1168 1 46 ILE HB 1 62 ASP HB2 . . 3.860 2.286 1.999 2.588 . 0 0 "[ . 1 . 2]" 1
1169 1 46 ILE HB 1 62 ASP HB3 . . 4.180 3.379 3.110 3.701 . 0 0 "[ . 1 . 2]" 1
1170 1 46 ILE HB 1 64 VAL MG2 . . 3.930 3.801 3.547 3.891 . 0 0 "[ . 1 . 2]" 1
1171 1 46 ILE HB 1 73 ILE MD . . 4.440 4.333 4.170 4.437 . 0 0 "[ . 1 . 2]" 1
1172 1 46 ILE MD 1 46 ILE MG . . 2.910 2.348 2.257 2.455 . 0 0 "[ . 1 . 2]" 1
1173 1 46 ILE MD 1 47 TYR H . . 5.500 5.296 5.230 5.371 . 0 0 "[ . 1 . 2]" 1
1174 1 46 ILE MD 1 62 ASP HB2 . . 4.980 3.329 3.075 3.502 . 0 0 "[ . 1 . 2]" 1
1175 1 46 ILE MD 1 62 ASP HB3 . . 4.170 3.245 2.894 3.467 . 0 0 "[ . 1 . 2]" 1
1176 1 46 ILE MD 1 63 MET HA . . 5.500 4.956 4.606 5.259 . 0 0 "[ . 1 . 2]" 1
1177 1 46 ILE MD 1 64 VAL H . . 5.170 4.817 4.607 5.147 . 0 0 "[ . 1 . 2]" 1
1178 1 46 ILE MD 1 64 VAL HB . . 3.850 3.567 3.306 3.827 . 0 0 "[ . 1 . 2]" 1
1179 1 46 ILE MD 1 64 VAL MG1 . . 3.670 3.432 3.219 3.645 . 0 0 "[ . 1 . 2]" 1
1180 1 46 ILE MD 1 64 VAL MG2 . . 2.990 1.912 1.787 2.104 . 0 0 "[ . 1 . 2]" 1
1181 1 46 ILE MD 1 71 HIS HB2 . . 3.790 2.536 2.323 2.855 . 0 0 "[ . 1 . 2]" 1
1182 1 46 ILE MD 1 71 HIS HB3 . . 3.630 2.049 1.882 2.289 . 0 0 "[ . 1 . 2]" 1
1183 1 46 ILE MD 1 71 HIS HD2 . . 3.350 2.250 1.992 2.541 . 0 0 "[ . 1 . 2]" 1
1184 1 46 ILE MD 1 86 MET QB . . 4.300 3.722 3.487 3.820 . 0 0 "[ . 1 . 2]" 1
1185 1 46 ILE MD 1 86 MET ME . . 3.220 3.149 2.896 3.223 0.003 6 0 "[ . 1 . 2]" 1
1186 1 46 ILE HG12 1 64 VAL MG2 . . 4.450 4.015 3.746 4.321 . 0 0 "[ . 1 . 2]" 1
1187 1 46 ILE HG12 1 86 MET HB2 . . 4.530 2.751 2.533 2.984 . 0 0 "[ . 1 . 2]" 1
1188 1 46 ILE HG12 1 86 MET QB . . 3.930 2.346 2.128 2.468 . 0 0 "[ . 1 . 2]" 1
1189 1 46 ILE HG12 1 86 MET HB3 . . 4.530 2.567 2.271 2.838 . 0 0 "[ . 1 . 2]" 1
1190 1 46 ILE HG12 1 86 MET ME . . 3.490 2.628 2.422 2.821 . 0 0 "[ . 1 . 2]" 1
1191 1 46 ILE HG12 1 86 MET QG . . 4.500 3.903 2.954 4.150 . 0 0 "[ . 1 . 2]" 1
1192 1 46 ILE HG12 1 87 GLN H . . 5.030 4.732 4.547 5.021 . 0 0 "[ . 1 . 2]" 1
1193 1 46 ILE HG13 1 64 VAL MG2 . . 4.050 3.034 2.698 3.366 . 0 0 "[ . 1 . 2]" 1
1194 1 46 ILE HG13 1 71 HIS HB3 . . 5.500 4.811 4.512 5.103 . 0 0 "[ . 1 . 2]" 1
1195 1 46 ILE HG13 1 71 HIS HD2 . . 5.500 5.006 4.653 5.451 . 0 0 "[ . 1 . 2]" 1
1196 1 46 ILE HG13 1 86 MET ME . . 3.290 2.615 2.312 2.821 . 0 0 "[ . 1 . 2]" 1
1197 1 46 ILE HG13 1 87 GLN H . . 4.340 4.262 4.098 4.346 0.006 7 0 "[ . 1 . 2]" 1
1198 1 46 ILE MG 1 47 TYR H . . 3.490 2.710 2.432 2.887 . 0 0 "[ . 1 . 2]" 1
1199 1 46 ILE MG 1 48 TYR H . . 4.840 4.539 4.363 4.663 . 0 0 "[ . 1 . 2]" 1
1200 1 46 ILE MG 1 48 TYR QB . . 4.390 3.493 3.348 3.613 . 0 0 "[ . 1 . 2]" 1
1201 1 46 ILE MG 1 48 TYR QD . . 3.360 2.348 2.044 2.677 . 0 0 "[ . 1 . 2]" 1
1202 1 46 ILE MG 1 48 TYR QE . . 4.260 3.521 3.078 4.112 . 0 0 "[ . 1 . 2]" 1
1203 1 46 ILE MG 1 62 ASP H . . 4.410 4.207 3.989 4.383 . 0 0 "[ . 1 . 2]" 1
1204 1 46 ILE MG 1 62 ASP HB2 . . 3.900 3.526 3.298 3.843 . 0 0 "[ . 1 . 2]" 1
1205 1 46 ILE MG 1 62 ASP HB3 . . 5.500 4.596 4.356 4.918 . 0 0 "[ . 1 . 2]" 1
1206 1 46 ILE MG 1 71 HIS HD2 . . 3.730 3.117 2.828 3.613 . 0 0 "[ . 1 . 2]" 1
1207 1 46 ILE MG 1 73 ILE MD . . 2.930 2.335 2.129 2.435 . 0 0 "[ . 1 . 2]" 1
1208 1 46 ILE MG 1 73 ILE HG13 . . 4.200 3.571 3.342 3.854 . 0 0 "[ . 1 . 2]" 1
1209 1 46 ILE MG 1 73 ILE MG . . 4.210 4.050 3.871 4.210 0.000 6 0 "[ . 1 . 2]" 1
1210 1 46 ILE MG 1 86 MET H . . 5.500 4.874 4.757 5.059 . 0 0 "[ . 1 . 2]" 1
1211 1 46 ILE MG 1 86 MET HA . . 4.370 3.560 3.355 3.858 . 0 0 "[ . 1 . 2]" 1
1212 1 46 ILE MG 1 86 MET HB2 . . 4.500 3.466 3.182 3.755 . 0 0 "[ . 1 . 2]" 1
1213 1 46 ILE MG 1 86 MET HB3 . . 4.500 2.388 2.218 2.591 . 0 0 "[ . 1 . 2]" 1
1214 1 46 ILE MG 1 86 MET ME . . 4.420 4.021 3.868 4.159 . 0 0 "[ . 1 . 2]" 1
1215 1 46 ILE MG 1 86 MET QG . . 4.040 3.999 3.720 4.042 0.002 2 0 "[ . 1 . 2]" 1
1216 1 47 TYR H 1 47 TYR HB2 . . 3.750 2.536 2.460 2.608 . 0 0 "[ . 1 . 2]" 1
1217 1 47 TYR H 1 47 TYR HB3 . . 3.920 3.700 3.671 3.742 . 0 0 "[ . 1 . 2]" 1
1218 1 47 TYR H 1 47 TYR QD . . 3.670 2.117 1.984 2.308 . 0 0 "[ . 1 . 2]" 1
1219 1 47 TYR H 1 47 TYR QE . . 4.660 4.417 4.266 4.647 . 0 0 "[ . 1 . 2]" 1
1220 1 47 TYR H 1 48 TYR H . . 4.630 4.519 4.493 4.552 . 0 0 "[ . 1 . 2]" 1
1221 1 47 TYR H 1 73 ILE MD . . 5.500 5.388 5.223 5.503 0.003 13 0 "[ . 1 . 2]" 1
1222 1 47 TYR H 1 84 ILE MG . . 4.650 4.459 4.223 4.611 . 0 0 "[ . 1 . 2]" 1
1223 1 47 TYR H 1 85 LYS H . . 4.080 3.976 3.674 4.086 0.006 9 0 "[ . 1 . 2]" 1
1224 1 47 TYR H 1 85 LYS QG . . 4.360 3.347 2.781 3.609 . 0 0 "[ . 1 . 2]" 1
1225 1 47 TYR H 1 86 MET HA . . 3.940 2.286 2.011 2.531 . 0 0 "[ . 1 . 2]" 1
1226 1 47 TYR H 1 86 MET HB2 . . 4.750 4.033 3.583 4.377 . 0 0 "[ . 1 . 2]" 1
1227 1 47 TYR H 1 86 MET QB . . 4.170 3.292 3.091 3.480 . 0 0 "[ . 1 . 2]" 1
1228 1 47 TYR H 1 86 MET HB3 . . 4.750 3.496 3.261 3.726 . 0 0 "[ . 1 . 2]" 1
1229 1 47 TYR H 1 87 GLN H . . 4.770 4.363 4.060 4.599 . 0 0 "[ . 1 . 2]" 1
1230 1 47 TYR HA 1 47 TYR QD . . 4.310 3.168 3.045 3.219 . 0 0 "[ . 1 . 2]" 1
1231 1 47 TYR HA 1 48 TYR H . . 2.990 2.247 2.189 2.283 . 0 0 "[ . 1 . 2]" 1
1232 1 47 TYR HA 1 48 TYR QD . . 4.070 3.095 2.636 3.489 . 0 0 "[ . 1 . 2]" 1
1233 1 47 TYR HA 1 59 TYR QD . . 4.580 4.279 4.151 4.357 . 0 0 "[ . 1 . 2]" 1
1234 1 47 TYR HA 1 60 LYS H . . 4.580 3.672 3.526 3.773 . 0 0 "[ . 1 . 2]" 1
1235 1 47 TYR HA 1 61 LYS H . . 4.730 4.506 4.367 4.633 . 0 0 "[ . 1 . 2]" 1
1236 1 47 TYR HA 1 61 LYS HA . . 3.820 2.930 2.861 3.022 . 0 0 "[ . 1 . 2]" 1
1237 1 47 TYR HA 1 61 LYS HB2 . . 5.140 4.717 4.649 4.789 . 0 0 "[ . 1 . 2]" 1
1238 1 47 TYR HA 1 62 ASP H . . 4.340 3.954 3.735 4.139 . 0 0 "[ . 1 . 2]" 1
1239 1 47 TYR HB2 1 48 TYR H . . 4.110 3.924 3.805 4.064 . 0 0 "[ . 1 . 2]" 1
1240 1 47 TYR HB2 1 59 TYR QD . . 4.200 4.005 3.774 4.209 0.009 19 0 "[ . 1 . 2]" 1
1241 1 47 TYR HB2 1 60 LYS H . . 5.500 5.389 5.226 5.501 0.001 9 0 "[ . 1 . 2]" 1
1242 1 47 TYR HB2 1 85 LYS H . . 3.990 3.903 3.660 3.983 . 0 0 "[ . 1 . 2]" 1
1243 1 47 TYR HB2 1 85 LYS HB3 . . 5.430 4.967 4.368 5.269 . 0 0 "[ . 1 . 2]" 1
1244 1 47 TYR HB2 1 85 LYS HG2 . . 4.780 2.791 2.177 3.272 . 0 0 "[ . 1 . 2]" 1
1245 1 47 TYR HB2 1 85 LYS QG . . 4.100 2.284 1.851 2.478 . 0 0 "[ . 1 . 2]" 1
1246 1 47 TYR HB2 1 85 LYS HG3 . . 4.780 2.504 2.003 2.958 . 0 0 "[ . 1 . 2]" 1
1247 1 47 TYR HB3 1 48 TYR H . . 3.970 2.851 2.740 3.068 . 0 0 "[ . 1 . 2]" 1
1248 1 47 TYR HB3 1 59 TYR HB2 . . 4.670 4.297 3.721 4.564 . 0 0 "[ . 1 . 2]" 1
1249 1 47 TYR HB3 1 59 TYR HB3 . . 4.510 2.611 1.999 2.906 . 0 0 "[ . 1 . 2]" 1
1250 1 47 TYR HB3 1 59 TYR QD . . 3.820 2.857 2.743 2.968 . 0 0 "[ . 1 . 2]" 1
1251 1 47 TYR HB3 1 60 LYS H . . 4.680 3.791 3.641 3.910 . 0 0 "[ . 1 . 2]" 1
1252 1 47 TYR HB3 1 61 LYS HA . . 5.320 4.684 4.483 4.982 . 0 0 "[ . 1 . 2]" 1
1253 1 47 TYR HB3 1 85 LYS H . . 5.170 4.943 4.730 5.107 . 0 0 "[ . 1 . 2]" 1
1254 1 47 TYR HB3 1 85 LYS HG2 . . 4.770 3.932 3.219 4.421 . 0 0 "[ . 1 . 2]" 1
1255 1 47 TYR HB3 1 85 LYS HG3 . . 4.770 4.133 3.672 4.672 . 0 0 "[ . 1 . 2]" 1
1256 1 47 TYR QD 1 48 TYR H . . 5.030 4.262 4.177 4.436 . 0 0 "[ . 1 . 2]" 1
1257 1 47 TYR QD 1 59 TYR HB2 . . 4.350 3.689 3.399 4.038 . 0 0 "[ . 1 . 2]" 1
1258 1 47 TYR QD 1 59 TYR HB3 . . 4.300 2.208 2.005 2.520 . 0 0 "[ . 1 . 2]" 1
1259 1 47 TYR QD 1 59 TYR QD . . 4.260 4.057 3.732 4.263 0.003 7 0 "[ . 1 . 2]" 1
1260 1 47 TYR QD 1 60 LYS H . . 4.820 4.310 4.171 4.419 . 0 0 "[ . 1 . 2]" 1
1261 1 47 TYR QD 1 61 LYS HB2 . . 5.140 3.898 3.449 4.282 . 0 0 "[ . 1 . 2]" 1
1262 1 47 TYR QD 1 85 LYS QE . . 4.900 4.533 3.800 4.905 0.005 3 0 "[ . 1 . 2]" 1
1263 1 47 TYR QD 1 85 LYS HG2 . . 5.060 4.663 3.714 5.060 0.000 16 0 "[ . 1 . 2]" 1
1264 1 47 TYR QD 1 85 LYS HG3 . . 5.060 3.713 3.057 4.168 . 0 0 "[ . 1 . 2]" 1
1265 1 47 TYR QD 1 86 MET HA . . 4.030 2.533 2.297 2.795 . 0 0 "[ . 1 . 2]" 1
1266 1 47 TYR QD 1 87 GLN H . . 4.870 3.625 3.293 3.892 . 0 0 "[ . 1 . 2]" 1
1267 1 47 TYR QD 1 87 GLN QB . . 4.800 3.889 3.620 4.717 . 0 0 "[ . 1 . 2]" 1
1268 1 47 TYR QE 1 59 TYR HB3 . . 4.780 4.279 3.876 4.573 . 0 0 "[ . 1 . 2]" 1
1269 1 47 TYR QE 1 61 LYS HB2 . . 4.650 3.223 2.837 3.601 . 0 0 "[ . 1 . 2]" 1
1270 1 47 TYR QE 1 61 LYS HB3 . . 4.800 4.694 4.456 4.798 . 0 0 "[ . 1 . 2]" 1
1271 1 47 TYR QE 1 61 LYS HD2 . . 4.010 3.468 3.065 3.781 . 0 0 "[ . 1 . 2]" 1
1272 1 47 TYR QE 1 61 LYS HD3 . . 3.830 2.964 2.422 3.717 . 0 0 "[ . 1 . 2]" 1
1273 1 47 TYR QE 1 61 LYS HE2 . . 5.500 4.871 4.513 5.417 . 0 0 "[ . 1 . 2]" 1
1274 1 47 TYR QE 1 61 LYS QE . . 4.740 4.490 4.259 4.748 0.008 9 0 "[ . 1 . 2]" 1
1275 1 47 TYR QE 1 61 LYS HE3 . . 5.500 5.291 5.081 5.480 . 0 0 "[ . 1 . 2]" 1
1276 1 47 TYR QE 1 61 LYS HG2 . . 4.780 4.365 3.680 4.731 . 0 0 "[ . 1 . 2]" 1
1277 1 47 TYR QE 1 61 LYS QG . . 4.050 2.948 2.299 3.489 . 0 0 "[ . 1 . 2]" 1
1278 1 47 TYR QE 1 61 LYS HG3 . . 4.780 2.999 2.317 3.592 . 0 0 "[ . 1 . 2]" 1
1279 1 47 TYR QE 1 62 ASP H . . 5.400 5.034 4.823 5.238 . 0 0 "[ . 1 . 2]" 1
1280 1 47 TYR QE 1 86 MET HA . . 4.870 4.195 3.776 4.632 . 0 0 "[ . 1 . 2]" 1
1281 1 47 TYR QE 1 87 GLN H . . 4.260 3.738 3.317 4.261 0.001 19 0 "[ . 1 . 2]" 1
1282 1 47 TYR QE 1 87 GLN QB . . 3.960 2.998 2.682 3.969 0.009 7 0 "[ . 1 . 2]" 1
1283 1 48 TYR H 1 48 TYR QD . . 3.480 3.008 2.672 3.191 . 0 0 "[ . 1 . 2]" 1
1284 1 48 TYR H 1 49 ARG H . . 4.580 4.317 4.237 4.358 . 0 0 "[ . 1 . 2]" 1
1285 1 48 TYR H 1 49 ARG HB3 . . 4.730 4.253 4.135 4.364 . 0 0 "[ . 1 . 2]" 1
1286 1 48 TYR H 1 59 TYR HA . . 4.220 3.357 3.267 3.463 . 0 0 "[ . 1 . 2]" 1
1287 1 48 TYR H 1 59 TYR HB2 . . 5.500 5.499 5.483 5.509 0.009 10 0 "[ . 1 . 2]" 1
1288 1 48 TYR H 1 59 TYR HB3 . . 4.410 4.097 4.036 4.160 . 0 0 "[ . 1 . 2]" 1
1289 1 48 TYR H 1 59 TYR QD . . 3.720 2.770 2.661 2.947 . 0 0 "[ . 1 . 2]" 1
1290 1 48 TYR H 1 60 LYS H . . 3.650 2.246 2.119 2.338 . 0 0 "[ . 1 . 2]" 1
1291 1 48 TYR H 1 60 LYS HB2 . . 4.390 3.090 2.666 3.239 . 0 0 "[ . 1 . 2]" 1
1292 1 48 TYR H 1 60 LYS HB3 . . 5.130 4.373 4.093 4.618 . 0 0 "[ . 1 . 2]" 1
1293 1 48 TYR H 1 61 LYS HA . . 4.760 4.760 4.700 4.779 0.019 19 0 "[ . 1 . 2]" 1
1294 1 48 TYR HA 1 49 ARG H . . 3.090 2.271 2.203 2.325 . 0 0 "[ . 1 . 2]" 1
1295 1 48 TYR HA 1 49 ARG HB3 . . 4.970 4.325 4.246 4.390 . 0 0 "[ . 1 . 2]" 1
1296 1 48 TYR HA 1 59 TYR HA . . 5.500 4.607 4.483 4.706 . 0 0 "[ . 1 . 2]" 1
1297 1 48 TYR HA 1 59 TYR QD . . 4.170 3.072 2.874 3.157 . 0 0 "[ . 1 . 2]" 1
1298 1 48 TYR HA 1 59 TYR QE . . 4.070 2.905 2.755 3.020 . 0 0 "[ . 1 . 2]" 1
1299 1 48 TYR HA 1 84 ILE HA . . 3.950 2.959 2.771 3.139 . 0 0 "[ . 1 . 2]" 1
1300 1 48 TYR HA 1 84 ILE MD . . 5.440 5.176 5.022 5.320 . 0 0 "[ . 1 . 2]" 1
1301 1 48 TYR HA 1 84 ILE HG12 . . 4.720 3.761 3.566 3.933 . 0 0 "[ . 1 . 2]" 1
1302 1 48 TYR HA 1 84 ILE HG13 . . 5.050 4.560 4.323 4.734 . 0 0 "[ . 1 . 2]" 1
1303 1 48 TYR HA 1 84 ILE MG . . 4.160 3.563 3.370 3.867 . 0 0 "[ . 1 . 2]" 1
1304 1 48 TYR HA 1 85 LYS H . . 4.180 3.528 3.222 3.762 . 0 0 "[ . 1 . 2]" 1
1305 1 48 TYR QB 1 49 ARG H . . 3.340 2.726 2.578 2.938 . 0 0 "[ . 1 . 2]" 1
1306 1 48 TYR QB 1 60 LYS H . . 5.340 4.750 4.646 4.848 . 0 0 "[ . 1 . 2]" 1
1307 1 48 TYR QB 1 73 ILE MG . . 4.350 3.343 2.915 3.870 . 0 0 "[ . 1 . 2]" 1
1308 1 48 TYR QB 1 84 ILE HA . . 4.200 3.580 3.117 3.917 . 0 0 "[ . 1 . 2]" 1
1309 1 48 TYR QB 1 84 ILE MD . . 4.550 3.925 3.773 4.177 . 0 0 "[ . 1 . 2]" 1
1310 1 48 TYR QB 1 84 ILE HG13 . . 4.810 4.128 3.879 4.429 . 0 0 "[ . 1 . 2]" 1
1311 1 48 TYR HB2 1 49 ARG H . . 4.130 2.794 2.623 3.042 . 0 0 "[ . 1 . 2]" 1
1312 1 48 TYR HB2 1 73 ILE MD . . 4.060 3.555 3.216 3.919 . 0 0 "[ . 1 . 2]" 1
1313 1 48 TYR HB2 1 84 ILE HG12 . . 4.430 3.365 3.071 3.707 . 0 0 "[ . 1 . 2]" 1
1314 1 48 TYR HB2 1 84 ILE MG . . 4.210 3.940 3.730 4.101 . 0 0 "[ . 1 . 2]" 1
1315 1 48 TYR HB3 1 49 ARG H . . 4.130 3.803 3.691 3.885 . 0 0 "[ . 1 . 2]" 1
1316 1 48 TYR HB3 1 73 ILE MD . . 4.060 2.674 2.352 3.122 . 0 0 "[ . 1 . 2]" 1
1317 1 48 TYR HB3 1 84 ILE HG12 . . 4.430 3.077 2.789 3.346 . 0 0 "[ . 1 . 2]" 1
1318 1 48 TYR HB3 1 84 ILE MG . . 4.210 2.754 2.430 2.928 . 0 0 "[ . 1 . 2]" 1
1319 1 48 TYR QD 1 60 LYS HB2 . . 4.780 3.603 3.428 3.688 . 0 0 "[ . 1 . 2]" 1
1320 1 48 TYR QD 1 62 ASP H . . 5.500 4.693 4.416 4.904 . 0 0 "[ . 1 . 2]" 1
1321 1 48 TYR QD 1 73 ILE MD . . 3.720 3.011 2.754 3.414 . 0 0 "[ . 1 . 2]" 1
1322 1 48 TYR QD 1 73 ILE MG . . 3.770 3.143 2.784 3.383 . 0 0 "[ . 1 . 2]" 1
1323 1 48 TYR QD 1 76 LEU MD2 . . 3.390 2.689 2.386 2.965 . 0 0 "[ . 1 . 2]" 1
1324 1 48 TYR QD 1 84 ILE MG . . 4.270 3.995 3.749 4.132 . 0 0 "[ . 1 . 2]" 1
1325 1 48 TYR QE 1 60 LYS HB2 . . 4.200 3.269 3.173 3.401 . 0 0 "[ . 1 . 2]" 1
1326 1 48 TYR QE 1 60 LYS HB3 . . 4.060 3.577 3.332 3.772 . 0 0 "[ . 1 . 2]" 1
1327 1 48 TYR QE 1 60 LYS QD . . 3.770 2.158 2.001 2.381 . 0 0 "[ . 1 . 2]" 1
1328 1 48 TYR QE 1 60 LYS QE . . 4.210 3.356 2.237 4.164 . 0 0 "[ . 1 . 2]" 1
1329 1 48 TYR QE 1 60 LYS HG3 . . 4.710 4.577 4.305 4.708 . 0 0 "[ . 1 . 2]" 1
1330 1 48 TYR QE 1 61 LYS H . . 4.690 4.435 4.011 4.598 . 0 0 "[ . 1 . 2]" 1
1331 1 48 TYR QE 1 62 ASP H . . 4.000 3.629 3.239 3.851 . 0 0 "[ . 1 . 2]" 1
1332 1 48 TYR QE 1 62 ASP HB2 . . 4.440 2.563 2.336 2.737 . 0 0 "[ . 1 . 2]" 1
1333 1 48 TYR QE 1 62 ASP HB3 . . 5.020 3.985 3.642 4.272 . 0 0 "[ . 1 . 2]" 1
1334 1 48 TYR QE 1 73 ILE MD . . 4.170 4.023 3.779 4.171 0.001 4 0 "[ . 1 . 2]" 1
1335 1 48 TYR QE 1 73 ILE MG . . 3.540 3.015 2.699 3.219 . 0 0 "[ . 1 . 2]" 1
1336 1 48 TYR QE 1 76 LEU MD1 . . 5.480 5.269 4.944 5.472 . 0 0 "[ . 1 . 2]" 1
1337 1 48 TYR QE 1 76 LEU MD2 . . 3.410 3.176 2.911 3.365 . 0 0 "[ . 1 . 2]" 1
1338 1 49 ARG H 1 49 ARG HB3 . . 3.830 3.396 3.295 3.468 . 0 0 "[ . 1 . 2]" 1
1339 1 49 ARG H 1 49 ARG HD2 . . 4.430 4.201 4.059 4.309 . 0 0 "[ . 1 . 2]" 1
1340 1 49 ARG H 1 49 ARG HG2 . . 4.840 4.106 3.925 4.212 . 0 0 "[ . 1 . 2]" 1
1341 1 49 ARG H 1 49 ARG HG3 . . 3.950 2.655 2.475 2.817 . 0 0 "[ . 1 . 2]" 1
1342 1 49 ARG H 1 50 PRO HA . . 5.140 4.741 4.675 4.829 . 0 0 "[ . 1 . 2]" 1
1343 1 49 ARG H 1 50 PRO HD3 . . 4.850 4.552 4.445 4.671 . 0 0 "[ . 1 . 2]" 1
1344 1 49 ARG H 1 59 TYR HA . . 5.480 4.635 4.428 4.773 . 0 0 "[ . 1 . 2]" 1
1345 1 49 ARG H 1 59 TYR QD . . 4.010 3.629 3.361 3.777 . 0 0 "[ . 1 . 2]" 1
1346 1 49 ARG H 1 59 TYR QE . . 3.860 3.076 2.784 3.342 . 0 0 "[ . 1 . 2]" 1
1347 1 49 ARG H 1 84 ILE MD . . 5.500 5.344 5.160 5.505 0.005 6 0 "[ . 1 . 2]" 1
1348 1 49 ARG H 1 84 ILE HG12 . . 4.470 4.234 4.045 4.403 . 0 0 "[ . 1 . 2]" 1
1349 1 49 ARG HA 1 50 PRO HD2 . . 3.670 2.228 2.180 2.257 . 0 0 "[ . 1 . 2]" 1
1350 1 49 ARG HA 1 50 PRO HD3 . . 3.540 2.255 2.252 2.258 . 0 0 "[ . 1 . 2]" 1
1351 1 49 ARG HA 1 50 PRO HG2 . . 4.500 4.374 4.336 4.397 . 0 0 "[ . 1 . 2]" 1
1352 1 49 ARG HA 1 50 PRO HG3 . . 4.500 4.380 4.359 4.393 . 0 0 "[ . 1 . 2]" 1
1353 1 49 ARG HA 1 53 SER HG . . 4.700 4.175 3.528 4.702 0.002 6 0 "[ . 1 . 2]" 1
1354 1 49 ARG HA 1 59 TYR HA . . 5.130 4.072 3.745 4.247 . 0 0 "[ . 1 . 2]" 1
1355 1 49 ARG HA 1 60 LYS H . . 4.950 4.555 4.380 4.705 . 0 0 "[ . 1 . 2]" 1
1356 1 49 ARG HB2 1 49 ARG HE . . 5.270 4.462 4.335 4.613 . 0 0 "[ . 1 . 2]" 1
1357 1 49 ARG HB2 1 50 PRO HD2 . . 4.530 2.342 2.272 2.454 . 0 0 "[ . 1 . 2]" 1
1358 1 49 ARG HB2 1 50 PRO HD3 . . 4.710 3.734 3.675 3.828 . 0 0 "[ . 1 . 2]" 1
1359 1 49 ARG HB2 1 59 TYR HA . . 3.920 3.576 3.536 3.634 . 0 0 "[ . 1 . 2]" 1
1360 1 49 ARG HB2 1 59 TYR QD . . 4.870 4.184 4.111 4.258 . 0 0 "[ . 1 . 2]" 1
1361 1 49 ARG HB2 1 60 LYS H . . 5.370 5.035 4.872 5.246 . 0 0 "[ . 1 . 2]" 1
1362 1 49 ARG HB3 1 49 ARG HE . . 5.430 4.941 4.635 5.222 . 0 0 "[ . 1 . 2]" 1
1363 1 49 ARG HB3 1 50 PRO HD2 . . 4.010 3.653 3.583 3.745 . 0 0 "[ . 1 . 2]" 1
1364 1 49 ARG HB3 1 50 PRO HD3 . . 4.860 4.570 4.515 4.639 . 0 0 "[ . 1 . 2]" 1
1365 1 49 ARG HB3 1 53 SER QB . . 4.830 4.452 4.126 4.760 . 0 0 "[ . 1 . 2]" 1
1366 1 49 ARG HB3 1 58 ASP HB2 . . 5.090 3.900 3.203 5.062 . 0 0 "[ . 1 . 2]" 1
1367 1 49 ARG HB3 1 58 ASP QB . . 4.340 3.194 3.010 3.355 . 0 0 "[ . 1 . 2]" 1
1368 1 49 ARG HB3 1 58 ASP HB3 . . 5.090 3.552 3.146 3.987 . 0 0 "[ . 1 . 2]" 1
1369 1 49 ARG HB3 1 59 TYR H . . 5.050 3.303 3.056 3.499 . 0 0 "[ . 1 . 2]" 1
1370 1 49 ARG HB3 1 59 TYR HA . . 3.750 1.998 1.985 2.003 . 0 0 "[ . 1 . 2]" 1
1371 1 49 ARG HB3 1 59 TYR HB2 . . 5.500 4.397 4.128 4.558 . 0 0 "[ . 1 . 2]" 1
1372 1 49 ARG HB3 1 59 TYR QD . . 4.160 2.591 2.511 2.657 . 0 0 "[ . 1 . 2]" 1
1373 1 49 ARG HB3 1 59 TYR QE . . 3.780 3.713 3.549 3.789 0.009 19 0 "[ . 1 . 2]" 1
1374 1 49 ARG HB3 1 60 LYS H . . 3.920 3.516 3.330 3.761 . 0 0 "[ . 1 . 2]" 1
1375 1 49 ARG HD2 1 50 PRO HA . . 4.790 3.926 3.791 4.026 . 0 0 "[ . 1 . 2]" 1
1376 1 49 ARG HD2 1 53 SER QB . . 4.180 2.393 2.036 2.758 . 0 0 "[ . 1 . 2]" 1
1377 1 49 ARG HD2 1 59 TYR QE . . 5.160 4.652 4.436 4.849 . 0 0 "[ . 1 . 2]" 1
1378 1 49 ARG HD3 1 53 SER H . . 4.750 4.256 4.013 4.446 . 0 0 "[ . 1 . 2]" 1
1379 1 49 ARG HD3 1 53 SER HA . . 5.500 4.963 4.747 5.160 . 0 0 "[ . 1 . 2]" 1
1380 1 49 ARG HD3 1 53 SER QB . . 3.800 2.071 1.941 2.275 . 0 0 "[ . 1 . 2]" 1
1381 1 49 ARG HD3 1 58 ASP HB2 . . 5.110 3.656 3.061 4.542 . 0 0 "[ . 1 . 2]" 1
1382 1 49 ARG HD3 1 58 ASP HB3 . . 5.110 4.200 2.937 4.892 . 0 0 "[ . 1 . 2]" 1
1383 1 49 ARG HD3 1 59 TYR HA . . 5.500 5.142 4.970 5.439 . 0 0 "[ . 1 . 2]" 1
1384 1 49 ARG HD3 1 59 TYR QD . . 5.090 4.817 4.673 5.018 . 0 0 "[ . 1 . 2]" 1
1385 1 49 ARG HE 1 49 ARG HG2 . . 3.650 3.340 2.967 3.655 0.005 15 0 "[ . 1 . 2]" 1
1386 1 49 ARG HE 1 50 PRO HA . . 5.500 5.159 4.788 5.498 . 0 0 "[ . 1 . 2]" 1
1387 1 49 ARG HE 1 53 SER QB . . 4.480 4.030 3.634 4.464 . 0 0 "[ . 1 . 2]" 1
1388 1 49 ARG HE 1 59 TYR QE . . 4.750 3.954 3.223 4.523 . 0 0 "[ . 1 . 2]" 1
1389 1 49 ARG HE 1 83 ASP H . . 5.330 3.727 3.309 4.531 . 0 0 "[ . 1 . 2]" 1
1390 1 49 ARG HE 1 83 ASP QB . . 4.500 3.503 2.829 4.160 . 0 0 "[ . 1 . 2]" 1
1391 1 49 ARG HG2 1 50 PRO HD2 . . 5.200 4.893 4.833 4.980 . 0 0 "[ . 1 . 2]" 1
1392 1 49 ARG HG2 1 53 SER QB . . 5.020 3.994 3.689 4.212 . 0 0 "[ . 1 . 2]" 1
1393 1 49 ARG HG2 1 58 ASP QB . . 4.650 3.716 3.450 3.891 . 0 0 "[ . 1 . 2]" 1
1394 1 49 ARG HG2 1 59 TYR H . . 5.500 3.522 3.245 3.942 . 0 0 "[ . 1 . 2]" 1
1395 1 49 ARG HG2 1 59 TYR HA . . 4.990 3.340 3.074 3.686 . 0 0 "[ . 1 . 2]" 1
1396 1 49 ARG HG2 1 59 TYR HB2 . . 5.500 4.300 4.102 4.500 . 0 0 "[ . 1 . 2]" 1
1397 1 49 ARG HG2 1 59 TYR QD . . 4.720 2.967 2.825 3.137 . 0 0 "[ . 1 . 2]" 1
1398 1 49 ARG HG2 1 59 TYR QE . . 4.960 2.919 2.762 3.071 . 0 0 "[ . 1 . 2]" 1
1399 1 49 ARG HG3 1 50 PRO HD2 . . 4.910 4.689 4.604 4.763 . 0 0 "[ . 1 . 2]" 1
1400 1 49 ARG HG3 1 53 SER QB . . 5.160 4.480 4.214 4.643 . 0 0 "[ . 1 . 2]" 1
1401 1 49 ARG HG3 1 59 TYR HA . . 5.230 4.103 3.935 4.286 . 0 0 "[ . 1 . 2]" 1
1402 1 49 ARG HG3 1 59 TYR QD . . 4.170 3.217 3.034 3.430 . 0 0 "[ . 1 . 2]" 1
1403 1 49 ARG HG3 1 59 TYR QE . . 3.770 2.248 2.118 2.487 . 0 0 "[ . 1 . 2]" 1
1404 1 49 ARG HG3 1 83 ASP QB . . 4.670 4.379 4.073 4.673 0.003 13 0 "[ . 1 . 2]" 1
1405 1 50 PRO HA 1 51 THR H . . 3.100 2.208 2.183 2.232 . 0 0 "[ . 1 . 2]" 1
1406 1 50 PRO HA 1 51 THR HA . . 4.590 4.335 4.327 4.347 . 0 0 "[ . 1 . 2]" 1
1407 1 50 PRO HA 1 51 THR HB . . 4.710 4.375 4.348 4.466 . 0 0 "[ . 1 . 2]" 1
1408 1 50 PRO HA 1 51 THR MG . . 4.510 4.425 4.225 4.509 . 0 0 "[ . 1 . 2]" 1
1409 1 50 PRO HA 1 52 ASP H . . 4.580 3.818 3.718 3.957 . 0 0 "[ . 1 . 2]" 1
1410 1 50 PRO HA 1 53 SER HG . . 5.500 5.169 4.461 5.499 . 0 0 "[ . 1 . 2]" 1
1411 1 50 PRO HA 1 80 THR MG . . 3.880 3.315 3.058 3.601 . 0 0 "[ . 1 . 2]" 1
1412 1 50 PRO HA 1 82 TYR QB . . 4.640 1.941 1.844 2.064 . 0 0 "[ . 1 . 2]" 1
1413 1 50 PRO HA 1 82 TYR QE . . 5.500 4.718 4.337 5.188 . 0 0 "[ . 1 . 2]" 1
1414 1 50 PRO HA 1 83 ASP H . . 5.020 4.827 4.271 5.021 0.001 17 0 "[ . 1 . 2]" 1
1415 1 50 PRO HB2 1 51 THR H . . 4.120 3.201 3.103 3.316 . 0 0 "[ . 1 . 2]" 1
1416 1 50 PRO HB2 1 52 ASP H . . 4.620 2.365 2.287 2.551 . 0 0 "[ . 1 . 2]" 1
1417 1 50 PRO HB2 1 52 ASP QB . . 5.050 2.777 2.522 3.276 . 0 0 "[ . 1 . 2]" 1
1418 1 50 PRO HB2 1 53 SER H . . 3.930 3.200 2.965 3.565 . 0 0 "[ . 1 . 2]" 1
1419 1 50 PRO HB2 1 53 SER QB . . 4.770 4.650 4.485 4.771 0.001 20 0 "[ . 1 . 2]" 1
1420 1 50 PRO HB2 1 80 THR MG . . 3.730 3.447 3.072 3.723 . 0 0 "[ . 1 . 2]" 1
1421 1 50 PRO HB3 1 51 THR H . . 3.990 3.785 3.725 3.858 . 0 0 "[ . 1 . 2]" 1
1422 1 50 PRO HB3 1 51 THR MG . . 5.200 5.036 4.793 5.133 . 0 0 "[ . 1 . 2]" 1
1423 1 50 PRO HB3 1 52 ASP H . . 4.740 3.991 3.932 4.146 . 0 0 "[ . 1 . 2]" 1
1424 1 50 PRO HB3 1 53 SER H . . 5.070 4.715 4.490 5.069 . 0 0 "[ . 1 . 2]" 1
1425 1 50 PRO HB3 1 53 SER HG . . 5.500 4.971 4.564 5.410 . 0 0 "[ . 1 . 2]" 1
1426 1 50 PRO HB3 1 80 THR MG . . 3.400 2.913 2.583 3.185 . 0 0 "[ . 1 . 2]" 1
1427 1 50 PRO HB3 1 82 TYR QE . . 5.500 4.813 4.157 5.453 . 0 0 "[ . 1 . 2]" 1
1428 1 50 PRO HD2 1 53 SER H . . 4.750 4.295 3.924 4.686 . 0 0 "[ . 1 . 2]" 1
1429 1 50 PRO HD2 1 53 SER HG . . 4.790 2.256 1.997 2.596 . 0 0 "[ . 1 . 2]" 1
1430 1 50 PRO HD3 1 53 SER HG . . 4.490 3.860 3.593 4.108 . 0 0 "[ . 1 . 2]" 1
1431 1 50 PRO QG 1 51 THR H . . 4.820 4.513 4.463 4.569 . 0 0 "[ . 1 . 2]" 1
1432 1 50 PRO QG 1 53 SER HA . . 4.780 3.458 3.263 3.744 . 0 0 "[ . 1 . 2]" 1
1433 1 50 PRO QG 1 53 SER QB . . 5.070 3.367 3.121 3.583 . 0 0 "[ . 1 . 2]" 1
1434 1 50 PRO QG 1 53 SER HG . . 4.340 2.211 1.984 2.826 . 0 0 "[ . 1 . 2]" 1
1435 1 50 PRO QG 1 80 THR MG . . 5.270 4.463 4.189 4.705 . 0 0 "[ . 1 . 2]" 1
1436 1 51 THR H 1 51 THR HB . . 3.410 2.265 2.233 2.371 . 0 0 "[ . 1 . 2]" 1
1437 1 51 THR H 1 51 THR MG . . 3.570 2.696 2.464 2.765 . 0 0 "[ . 1 . 2]" 1
1438 1 51 THR H 1 52 ASP H . . 3.780 2.717 2.676 2.777 . 0 0 "[ . 1 . 2]" 1
1439 1 51 THR H 1 52 ASP QB . . 4.510 4.483 4.396 4.548 0.038 20 0 "[ . 1 . 2]" 1
1440 1 51 THR H 1 53 SER H . . 4.930 4.216 4.098 4.349 . 0 0 "[ . 1 . 2]" 1
1441 1 51 THR H 1 80 THR MG . . 4.270 3.362 3.057 3.695 . 0 0 "[ . 1 . 2]" 1
1442 1 51 THR HA 1 51 THR MG . . 3.250 3.163 3.155 3.189 . 0 0 "[ . 1 . 2]" 1
1443 1 51 THR HA 1 52 ASP HA . . 5.070 4.751 4.697 4.787 . 0 0 "[ . 1 . 2]" 1
1444 1 51 THR HA 1 83 ASP H . . 4.970 4.340 3.874 4.521 . 0 0 "[ . 1 . 2]" 1
1445 1 51 THR HA 1 83 ASP QB . . 5.340 5.311 5.197 5.344 0.004 14 0 "[ . 1 . 2]" 1
1446 1 51 THR HB 1 52 ASP H . . 4.050 3.890 3.793 3.972 . 0 0 "[ . 1 . 2]" 1
1447 1 51 THR HB 1 52 ASP HA . . 5.500 5.548 5.522 5.601 0.101 20 0 "[ . 1 . 2]" 1
1448 1 51 THR MG 1 52 ASP H . . 3.540 2.200 1.949 2.521 . 0 0 "[ . 1 . 2]" 1
1449 1 51 THR MG 1 52 ASP HA . . 4.070 3.072 2.957 3.191 . 0 0 "[ . 1 . 2]" 1
1450 1 51 THR MG 1 52 ASP HB2 . . 4.580 3.407 2.948 4.203 . 0 0 "[ . 1 . 2]" 1
1451 1 51 THR MG 1 52 ASP QB . . 3.860 3.161 2.888 3.490 . 0 0 "[ . 1 . 2]" 1
1452 1 51 THR MG 1 52 ASP HB3 . . 4.580 4.025 3.052 4.543 . 0 0 "[ . 1 . 2]" 1
1453 1 51 THR MG 1 53 SER H . . 5.020 4.199 3.993 4.412 . 0 0 "[ . 1 . 2]" 1
1454 1 51 THR MG 1 81 SER H . . 5.090 4.728 4.506 5.004 . 0 0 "[ . 1 . 2]" 1
1455 1 51 THR MG 1 81 SER HB3 . . 4.630 4.550 4.313 4.634 0.004 10 0 "[ . 1 . 2]" 1
1456 1 52 ASP H 1 52 ASP HB2 . . 3.650 2.593 2.178 3.572 . 0 0 "[ . 1 . 2]" 1
1457 1 52 ASP H 1 52 ASP HB3 . . 3.650 2.775 2.182 3.502 . 0 0 "[ . 1 . 2]" 1
1458 1 52 ASP H 1 53 SER H . . 3.290 2.506 2.401 2.655 . 0 0 "[ . 1 . 2]" 1
1459 1 52 ASP H 1 80 THR MG . . 5.220 4.138 3.827 4.440 . 0 0 "[ . 1 . 2]" 1
1460 1 52 ASP HA 1 53 SER H . . 3.560 3.416 3.225 3.497 . 0 0 "[ . 1 . 2]" 1
1461 1 52 ASP QB 1 53 SER H . . 3.580 3.126 2.880 3.596 0.016 20 0 "[ . 1 . 2]" 1
1462 1 52 ASP HB2 1 53 SER H . . 4.340 3.905 3.103 4.330 . 0 0 "[ . 1 . 2]" 1
1463 1 52 ASP HB3 1 53 SER H . . 4.340 3.410 2.937 4.098 . 0 0 "[ . 1 . 2]" 1
1464 1 53 SER H 1 53 SER QB . . 2.890 2.291 2.197 2.476 . 0 0 "[ . 1 . 2]" 1
1465 1 53 SER H 1 54 ASP H . . 4.760 4.610 4.538 4.647 . 0 0 "[ . 1 . 2]" 1
1466 1 53 SER HA 1 54 ASP H . . 2.910 2.479 2.280 2.649 . 0 0 "[ . 1 . 2]" 1
1467 1 53 SER HA 1 54 ASP HA . . 4.600 4.365 4.307 4.439 . 0 0 "[ . 1 . 2]" 1
1468 1 53 SER HA 1 54 ASP HB2 . . 4.430 4.234 4.120 4.341 . 0 0 "[ . 1 . 2]" 1
1469 1 53 SER HA 1 54 ASP HB3 . . 5.380 5.142 4.979 5.243 . 0 0 "[ . 1 . 2]" 1
1470 1 53 SER HA 1 55 ASN H . . 5.170 4.783 4.561 5.101 . 0 0 "[ . 1 . 2]" 1
1471 1 53 SER QB 1 54 ASP H . . 3.670 2.291 1.922 2.755 . 0 0 "[ . 1 . 2]" 1
1472 1 53 SER QB 1 55 ASN H . . 4.880 3.265 2.759 3.799 . 0 0 "[ . 1 . 2]" 1
1473 1 53 SER QB 1 58 ASP HB2 . . 4.830 2.571 2.289 2.865 . 0 0 "[ . 1 . 2]" 1
1474 1 53 SER QB 1 58 ASP QB . . 3.980 2.458 2.212 2.778 . 0 0 "[ . 1 . 2]" 1
1475 1 53 SER QB 1 58 ASP HB3 . . 4.830 3.230 2.503 3.730 . 0 0 "[ . 1 . 2]" 1
1476 1 54 ASP H 1 54 ASP HB2 . . 3.340 2.520 2.218 2.796 . 0 0 "[ . 1 . 2]" 1
1477 1 54 ASP HB2 1 57 SER QB . . 5.500 5.462 5.324 5.505 0.005 19 0 "[ . 1 . 2]" 1
1478 1 54 ASP HB3 1 55 ASN H . . 3.440 2.241 1.955 2.634 . 0 0 "[ . 1 . 2]" 1
1479 1 54 ASP HB3 1 55 ASN QD . . 4.070 2.854 1.924 3.956 . 0 0 "[ . 1 . 2]" 1
1480 1 54 ASP HB3 1 57 SER QB . . 4.620 4.201 3.932 4.338 . 0 0 "[ . 1 . 2]" 1
1481 1 55 ASN H 1 55 ASN HB2 . . 4.140 3.593 2.804 3.982 . 0 0 "[ . 1 . 2]" 1
1482 1 55 ASN H 1 55 ASN QB . . 3.510 3.142 2.742 3.408 . 0 0 "[ . 1 . 2]" 1
1483 1 55 ASN H 1 55 ASN HB3 . . 4.140 3.644 3.099 3.987 . 0 0 "[ . 1 . 2]" 1
1484 1 55 ASN H 1 55 ASN HD21 . . 5.160 3.459 1.939 4.845 . 0 0 "[ . 1 . 2]" 1
1485 1 55 ASN H 1 55 ASN QD . . 4.380 3.215 1.924 4.239 . 0 0 "[ . 1 . 2]" 1
1486 1 55 ASN H 1 55 ASN HD22 . . 5.160 4.010 3.200 4.682 . 0 0 "[ . 1 . 2]" 1
1487 1 55 ASN HA 1 55 ASN QD . . 4.630 3.938 3.556 4.323 . 0 0 "[ . 1 . 2]" 1
1488 1 55 ASN QB 1 55 ASN QD . . 3.010 2.164 2.073 2.371 . 0 0 "[ . 1 . 2]" 1
1489 1 55 ASN QB 1 57 SER QB . . 5.020 3.521 2.848 4.011 . 0 0 "[ . 1 . 2]" 1
1490 1 55 ASN QD 1 57 SER QB . . 4.290 2.747 1.708 3.902 . 0 0 "[ . 1 . 2]" 1
1491 1 56 ASP HA 1 59 TYR QD . . 4.150 2.066 1.996 2.333 . 0 0 "[ . 1 . 2]" 1
1492 1 56 ASP HA 1 59 TYR QE . . 4.360 3.530 3.169 4.101 . 0 0 "[ . 1 . 2]" 1
1493 1 56 ASP QB 1 57 SER HA . . 4.870 4.198 3.823 4.608 . 0 0 "[ . 1 . 2]" 1
1494 1 56 ASP HB2 1 57 SER H . . 4.400 3.578 2.699 4.293 . 0 0 "[ . 1 . 2]" 1
1495 1 56 ASP HB2 1 59 TYR QD . . 5.140 3.208 2.029 4.559 . 0 0 "[ . 1 . 2]" 1
1496 1 56 ASP HB3 1 57 SER H . . 4.400 3.924 2.864 4.239 . 0 0 "[ . 1 . 2]" 1
1497 1 56 ASP HB3 1 59 TYR QD . . 5.140 2.859 1.997 3.769 . 0 0 "[ . 1 . 2]" 1
1498 1 57 SER H 1 57 SER QB . . 3.650 2.276 2.186 2.479 . 0 0 "[ . 1 . 2]" 1
1499 1 57 SER HA 1 58 ASP H . . 3.470 3.420 3.373 3.475 0.005 5 0 "[ . 1 . 2]" 1
1500 1 57 SER QB 1 58 ASP H . . 3.740 3.038 2.869 3.157 . 0 0 "[ . 1 . 2]" 1
1501 1 58 ASP H 1 58 ASP HB2 . . 3.800 2.406 2.241 2.622 . 0 0 "[ . 1 . 2]" 1
1502 1 58 ASP H 1 58 ASP QB . . 3.230 2.349 2.218 2.568 . 0 0 "[ . 1 . 2]" 1
1503 1 58 ASP H 1 58 ASP HB3 . . 3.800 3.439 2.765 3.667 . 0 0 "[ . 1 . 2]" 1
1504 1 58 ASP QB 1 59 TYR H . . 4.180 2.582 2.372 2.784 . 0 0 "[ . 1 . 2]" 1
1505 1 59 TYR H 1 59 TYR HB2 . . 3.740 2.321 2.251 2.372 . 0 0 "[ . 1 . 2]" 1
1506 1 59 TYR H 1 59 TYR HB3 . . 4.010 3.573 3.534 3.594 . 0 0 "[ . 1 . 2]" 1
1507 1 59 TYR H 1 59 TYR QD . . 3.800 3.372 3.313 3.399 . 0 0 "[ . 1 . 2]" 1
1508 1 59 TYR H 1 59 TYR QE . . 5.370 4.926 4.845 4.974 . 0 0 "[ . 1 . 2]" 1
1509 1 59 TYR H 1 60 LYS H . . 4.670 4.485 4.450 4.531 . 0 0 "[ . 1 . 2]" 1
1510 1 59 TYR HA 1 59 TYR QD . . 3.750 2.033 1.995 2.094 . 0 0 "[ . 1 . 2]" 1
1511 1 59 TYR HA 1 60 LYS H . . 3.000 2.141 2.137 2.155 . 0 0 "[ . 1 . 2]" 1
1512 1 59 TYR HA 1 60 LYS HB2 . . 4.740 4.336 4.249 4.449 . 0 0 "[ . 1 . 2]" 1
1513 1 59 TYR HB2 1 60 LYS H . . 4.490 4.445 4.365 4.483 . 0 0 "[ . 1 . 2]" 1
1514 1 59 TYR HB3 1 60 LYS H . . 3.730 3.489 3.326 3.571 . 0 0 "[ . 1 . 2]" 1
1515 1 59 TYR QD 1 60 LYS H . . 3.790 3.111 3.027 3.143 . 0 0 "[ . 1 . 2]" 1
1516 1 59 TYR QE 1 60 LYS H . . 5.340 5.337 5.268 5.353 0.013 14 0 "[ . 1 . 2]" 1
1517 1 59 TYR QE 1 83 ASP QB . . 4.440 3.975 3.612 4.441 0.001 6 0 "[ . 1 . 2]" 1
1518 1 59 TYR QE 1 85 LYS HE2 . . 4.680 3.709 3.006 4.342 . 0 0 "[ . 1 . 2]" 1
1519 1 59 TYR QE 1 85 LYS QE . . 4.060 3.211 2.754 3.827 . 0 0 "[ . 1 . 2]" 1
1520 1 59 TYR QE 1 85 LYS HE3 . . 4.680 3.690 2.873 4.681 0.001 2 0 "[ . 1 . 2]" 1
1521 1 60 LYS H 1 60 LYS HB2 . . 3.410 2.275 2.201 2.354 . 0 0 "[ . 1 . 2]" 1
1522 1 60 LYS H 1 60 LYS HB3 . . 4.020 3.542 3.485 3.600 . 0 0 "[ . 1 . 2]" 1
1523 1 60 LYS H 1 60 LYS QD . . 4.310 3.911 2.073 4.302 . 0 0 "[ . 1 . 2]" 1
1524 1 60 LYS H 1 60 LYS QE . . 5.200 4.394 2.844 5.181 . 0 0 "[ . 1 . 2]" 1
1525 1 60 LYS H 1 60 LYS HG2 . . 4.640 4.218 4.092 4.433 . 0 0 "[ . 1 . 2]" 1
1526 1 60 LYS H 1 60 LYS HG3 . . 3.510 3.122 2.871 3.532 0.022 15 0 "[ . 1 . 2]" 1
1527 1 60 LYS H 1 61 LYS H . . 4.700 4.461 4.438 4.486 . 0 0 "[ . 1 . 2]" 1
1528 1 60 LYS HA 1 60 LYS QD . . 4.160 4.006 3.302 4.135 . 0 0 "[ . 1 . 2]" 1
1529 1 60 LYS HA 1 60 LYS QE . . 4.600 4.334 3.889 4.547 . 0 0 "[ . 1 . 2]" 1
1530 1 60 LYS HA 1 60 LYS HG2 . . 3.530 2.638 2.440 3.478 . 0 0 "[ . 1 . 2]" 1
1531 1 60 LYS HA 1 60 LYS HG3 . . 3.690 2.638 2.225 2.821 . 0 0 "[ . 1 . 2]" 1
1532 1 60 LYS HA 1 61 LYS H . . 2.740 2.652 2.643 2.669 . 0 0 "[ . 1 . 2]" 1
1533 1 60 LYS HA 1 61 LYS HB2 . . 4.680 4.143 4.064 4.221 . 0 0 "[ . 1 . 2]" 1
1534 1 60 LYS HA 1 61 LYS HB3 . . 4.820 4.683 4.573 4.796 . 0 0 "[ . 1 . 2]" 1
1535 1 60 LYS HB2 1 60 LYS QD . . 3.520 2.255 2.109 2.461 . 0 0 "[ . 1 . 2]" 1
1536 1 60 LYS HB2 1 60 LYS QE . . 3.850 3.360 2.144 3.935 0.085 15 0 "[ . 1 . 2]" 1
1537 1 60 LYS HB2 1 61 LYS H . . 3.710 3.404 3.283 3.487 . 0 0 "[ . 1 . 2]" 1
1538 1 60 LYS HB3 1 60 LYS QD . . 3.690 2.641 2.454 3.219 . 0 0 "[ . 1 . 2]" 1
1539 1 60 LYS HB3 1 60 LYS QE . . 4.440 3.661 2.284 4.263 . 0 0 "[ . 1 . 2]" 1
1540 1 60 LYS HB3 1 61 LYS H . . 3.070 1.931 1.888 1.967 . 0 0 "[ . 1 . 2]" 1
1541 1 60 LYS QD 1 61 LYS H . . 4.540 4.246 3.948 4.679 0.139 15 0 "[ . 1 . 2]" 1
1542 1 60 LYS QD 1 76 LEU MD2 . . 4.870 4.642 4.093 4.869 . 0 0 "[ . 1 . 2]" 1
1543 1 60 LYS QE 1 60 LYS HG2 . . 3.560 2.677 2.173 3.477 . 0 0 "[ . 1 . 2]" 1
1544 1 60 LYS QE 1 60 LYS HG3 . . 3.330 2.486 2.087 3.391 0.061 2 0 "[ . 1 . 2]" 1
1545 1 60 LYS QE 1 61 LYS H . . 5.500 5.033 3.468 5.508 0.008 19 0 "[ . 1 . 2]" 1
1546 1 60 LYS QE 1 76 LEU MD2 . . 5.500 5.182 3.827 5.504 0.004 15 0 "[ . 1 . 2]" 1
1547 1 60 LYS HG2 1 61 LYS H . . 4.040 3.432 3.208 3.877 . 0 0 "[ . 1 . 2]" 1
1548 1 60 LYS HG3 1 61 LYS H . . 4.440 4.317 3.745 4.441 0.001 9 0 "[ . 1 . 2]" 1
1549 1 61 LYS H 1 61 LYS HB2 . . 3.450 3.208 3.129 3.288 . 0 0 "[ . 1 . 2]" 1
1550 1 61 LYS H 1 61 LYS HB3 . . 3.420 2.934 2.876 3.001 . 0 0 "[ . 1 . 2]" 1
1551 1 61 LYS H 1 61 LYS HD3 . . 5.500 5.421 5.307 5.502 0.002 13 0 "[ . 1 . 2]" 1
1552 1 61 LYS H 1 61 LYS QE . . 5.150 4.904 4.652 5.131 . 0 0 "[ . 1 . 2]" 1
1553 1 61 LYS H 1 61 LYS HG2 . . 4.820 4.651 4.595 4.694 . 0 0 "[ . 1 . 2]" 1
1554 1 61 LYS H 1 61 LYS QG . . 4.230 4.174 4.143 4.204 . 0 0 "[ . 1 . 2]" 1
1555 1 61 LYS H 1 61 LYS HG3 . . 4.820 4.723 4.669 4.819 . 0 0 "[ . 1 . 2]" 1
1556 1 61 LYS H 1 62 ASP H . . 4.270 4.103 3.853 4.205 . 0 0 "[ . 1 . 2]" 1
1557 1 61 LYS HA 1 61 LYS QG . . 3.740 2.338 2.304 2.386 . 0 0 "[ . 1 . 2]" 1
1558 1 61 LYS HA 1 62 ASP H . . 3.120 2.147 2.140 2.166 . 0 0 "[ . 1 . 2]" 1
1559 1 61 LYS HA 1 62 ASP HB2 . . 5.500 4.300 4.230 4.416 . 0 0 "[ . 1 . 2]" 1
1560 1 61 LYS HB2 1 61 LYS HD2 . . 4.010 3.557 3.443 3.703 . 0 0 "[ . 1 . 2]" 1
1561 1 61 LYS HB2 1 61 LYS HD3 . . 3.760 2.289 2.127 2.534 . 0 0 "[ . 1 . 2]" 1
1562 1 61 LYS HB2 1 61 LYS HE2 . . 4.200 3.046 2.806 3.317 . 0 0 "[ . 1 . 2]" 1
1563 1 61 LYS HB2 1 61 LYS QE . . 3.400 2.954 2.743 3.196 . 0 0 "[ . 1 . 2]" 1
1564 1 61 LYS HB2 1 61 LYS HE3 . . 4.200 3.991 3.748 4.188 . 0 0 "[ . 1 . 2]" 1
1565 1 61 LYS HB2 1 62 ASP H . . 4.580 4.363 4.277 4.503 . 0 0 "[ . 1 . 2]" 1
1566 1 61 LYS HB3 1 61 LYS HD2 . . 4.010 3.823 3.670 3.925 . 0 0 "[ . 1 . 2]" 1
1567 1 61 LYS HB3 1 61 LYS HD3 . . 3.590 3.037 2.771 3.137 . 0 0 "[ . 1 . 2]" 1
1568 1 61 LYS HB3 1 61 LYS HE2 . . 4.340 2.361 2.072 2.626 . 0 0 "[ . 1 . 2]" 1
1569 1 61 LYS HB3 1 61 LYS QE . . 3.670 2.289 2.038 2.530 . 0 0 "[ . 1 . 2]" 1
1570 1 61 LYS HB3 1 61 LYS HE3 . . 4.340 3.141 2.774 3.591 . 0 0 "[ . 1 . 2]" 1
1571 1 61 LYS HB3 1 62 ASP H . . 4.410 4.182 4.060 4.356 . 0 0 "[ . 1 . 2]" 1
1572 1 61 LYS HB3 1 63 MET H . . 5.500 5.377 5.227 5.490 . 0 0 "[ . 1 . 2]" 1
1573 1 61 LYS QE 1 61 LYS QG . . 3.030 2.222 2.122 2.309 . 0 0 "[ . 1 . 2]" 1
1574 1 61 LYS HE2 1 61 LYS HG2 . . 3.940 2.972 2.699 3.187 . 0 0 "[ . 1 . 2]" 1
1575 1 61 LYS HE2 1 61 LYS HG3 . . 3.940 3.797 3.697 3.925 . 0 0 "[ . 1 . 2]" 1
1576 1 61 LYS HE3 1 61 LYS HG2 . . 3.940 2.351 2.200 2.505 . 0 0 "[ . 1 . 2]" 1
1577 1 61 LYS HE3 1 61 LYS HG3 . . 3.940 3.590 3.490 3.675 . 0 0 "[ . 1 . 2]" 1
1578 1 61 LYS QG 1 62 ASP H . . 3.900 2.934 2.739 3.284 . 0 0 "[ . 1 . 2]" 1
1579 1 61 LYS HG2 1 62 ASP H . . 4.440 3.419 2.909 4.021 . 0 0 "[ . 1 . 2]" 1
1580 1 61 LYS HG3 1 62 ASP H . . 4.440 3.243 2.881 3.723 . 0 0 "[ . 1 . 2]" 1
1581 1 62 ASP H 1 62 ASP HB2 . . 3.750 2.450 2.311 2.570 . 0 0 "[ . 1 . 2]" 1
1582 1 62 ASP H 1 62 ASP HB3 . . 3.930 3.604 3.539 3.646 . 0 0 "[ . 1 . 2]" 1
1583 1 62 ASP H 1 63 MET H . . 4.320 4.179 4.062 4.334 0.014 19 0 "[ . 1 . 2]" 1
1584 1 62 ASP HA 1 63 MET H . . 2.730 2.148 2.140 2.161 . 0 0 "[ . 1 . 2]" 1
1585 1 62 ASP HA 1 63 MET QB . . 4.910 4.072 4.059 4.088 . 0 0 "[ . 1 . 2]" 1
1586 1 62 ASP HB2 1 63 MET H . . 4.580 4.523 4.475 4.556 . 0 0 "[ . 1 . 2]" 1
1587 1 62 ASP HB3 1 63 MET H . . 3.880 3.694 3.580 3.787 . 0 0 "[ . 1 . 2]" 1
1588 1 62 ASP HB3 1 64 VAL MG2 . . 4.180 3.283 3.085 3.460 . 0 0 "[ . 1 . 2]" 1
1589 1 63 MET H 1 63 MET HB2 . . 3.260 2.318 2.275 2.448 . 0 0 "[ . 1 . 2]" 1
1590 1 63 MET H 1 63 MET QB . . 2.840 2.212 2.190 2.263 . 0 0 "[ . 1 . 2]" 1
1591 1 63 MET H 1 63 MET HB3 . . 3.260 2.804 2.665 2.854 . 0 0 "[ . 1 . 2]" 1
1592 1 63 MET H 1 63 MET ME . . 5.020 4.903 4.598 5.027 0.007 19 0 "[ . 1 . 2]" 1
1593 1 63 MET H 1 63 MET HG2 . . 4.700 4.406 4.236 4.478 . 0 0 "[ . 1 . 2]" 1
1594 1 63 MET H 1 63 MET QG . . 4.010 3.899 3.867 3.964 . 0 0 "[ . 1 . 2]" 1
1595 1 63 MET H 1 63 MET HG3 . . 4.700 4.361 4.242 4.519 . 0 0 "[ . 1 . 2]" 1
1596 1 63 MET H 1 64 VAL H . . 4.620 4.600 4.532 4.626 0.006 16 0 "[ . 1 . 2]" 1
1597 1 63 MET H 1 64 VAL MG2 . . 4.760 4.264 4.090 4.390 . 0 0 "[ . 1 . 2]" 1
1598 1 63 MET HA 1 63 MET ME . . 4.320 4.135 4.017 4.319 . 0 0 "[ . 1 . 2]" 1
1599 1 63 MET HA 1 63 MET HG2 . . 3.720 2.428 2.234 2.563 . 0 0 "[ . 1 . 2]" 1
1600 1 63 MET HA 1 63 MET QG . . 3.260 2.295 2.211 2.383 . 0 0 "[ . 1 . 2]" 1
1601 1 63 MET HA 1 63 MET HG3 . . 3.720 2.963 2.684 3.562 . 0 0 "[ . 1 . 2]" 1
1602 1 63 MET HA 1 64 VAL H . . 3.000 2.234 2.152 2.317 . 0 0 "[ . 1 . 2]" 1
1603 1 63 MET HA 1 64 VAL MG2 . . 4.220 3.392 3.234 3.567 . 0 0 "[ . 1 . 2]" 1
1604 1 63 MET QB 1 64 VAL H . . 3.770 3.468 3.271 3.704 . 0 0 "[ . 1 . 2]" 1
1605 1 63 MET HB2 1 64 VAL H . . 4.480 4.219 4.103 4.383 . 0 0 "[ . 1 . 2]" 1
1606 1 63 MET HB3 1 64 VAL H . . 4.480 3.691 3.437 3.995 . 0 0 "[ . 1 . 2]" 1
1607 1 63 MET ME 1 64 VAL H . . 3.860 3.487 3.184 3.746 . 0 0 "[ . 1 . 2]" 1
1608 1 63 MET ME 1 65 GLU H . . 4.470 4.121 3.879 4.375 . 0 0 "[ . 1 . 2]" 1
1609 1 63 MET ME 1 65 GLU HA . . 3.640 3.502 3.298 3.639 . 0 0 "[ . 1 . 2]" 1
1610 1 63 MET ME 1 66 GLY H . . 4.820 4.730 4.595 4.824 0.004 19 0 "[ . 1 . 2]" 1
1611 1 63 MET ME 1 89 PHE QE . . 4.590 4.143 3.653 4.424 . 0 0 "[ . 1 . 2]" 1
1612 1 63 MET ME 1 89 PHE HZ . . 3.760 3.587 3.085 3.761 0.001 14 0 "[ . 1 . 2]" 1
1613 1 63 MET QG 1 64 VAL H . . 3.300 2.426 2.172 2.750 . 0 0 "[ . 1 . 2]" 1
1614 1 63 MET QG 1 89 PHE HZ . . 3.150 2.426 2.018 3.023 . 0 0 "[ . 1 . 2]" 1
1615 1 63 MET HG2 1 64 VAL H . . 3.970 2.457 2.189 2.803 . 0 0 "[ . 1 . 2]" 1
1616 1 63 MET HG2 1 89 PHE QE . . 3.730 2.799 1.997 3.486 . 0 0 "[ . 1 . 2]" 1
1617 1 63 MET HG2 1 89 PHE HZ . . 3.610 3.100 2.498 3.600 . 0 0 "[ . 1 . 2]" 1
1618 1 63 MET HG3 1 64 VAL H . . 3.970 3.786 3.593 3.984 0.014 16 0 "[ . 1 . 2]" 1
1619 1 63 MET HG3 1 89 PHE QE . . 3.730 3.006 2.568 3.429 . 0 0 "[ . 1 . 2]" 1
1620 1 63 MET HG3 1 89 PHE HZ . . 3.610 2.545 2.071 3.249 . 0 0 "[ . 1 . 2]" 1
1621 1 64 VAL H 1 64 VAL HB . . 3.650 2.912 2.775 3.021 . 0 0 "[ . 1 . 2]" 1
1622 1 64 VAL H 1 64 VAL MG1 . . 4.020 3.962 3.910 3.998 . 0 0 "[ . 1 . 2]" 1
1623 1 64 VAL H 1 64 VAL MG2 . . 3.540 2.831 2.700 2.959 . 0 0 "[ . 1 . 2]" 1
1624 1 64 VAL H 1 65 GLU H . . 4.580 4.384 4.315 4.483 . 0 0 "[ . 1 . 2]" 1
1625 1 64 VAL H 1 89 PHE QE . . 4.650 3.706 2.979 4.026 . 0 0 "[ . 1 . 2]" 1
1626 1 64 VAL H 1 89 PHE HZ . . 5.500 5.050 3.988 5.431 . 0 0 "[ . 1 . 2]" 1
1627 1 64 VAL HA 1 64 VAL MG1 . . 3.200 2.316 2.211 2.384 . 0 0 "[ . 1 . 2]" 1
1628 1 64 VAL HA 1 64 VAL MG2 . . 3.340 2.434 2.364 2.519 . 0 0 "[ . 1 . 2]" 1
1629 1 64 VAL HA 1 65 GLU H . . 3.050 2.264 2.213 2.383 . 0 0 "[ . 1 . 2]" 1
1630 1 64 VAL HA 1 65 GLU QG . . 4.310 3.796 3.528 4.258 . 0 0 "[ . 1 . 2]" 1
1631 1 64 VAL HB 1 65 GLU H . . 3.860 3.734 3.442 3.862 0.002 12 0 "[ . 1 . 2]" 1
1632 1 64 VAL HB 1 68 ARG HG2 . . 5.400 5.076 4.664 5.400 0.000 19 0 "[ . 1 . 2]" 1
1633 1 64 VAL MG1 1 65 GLU H . . 3.440 2.042 1.884 2.191 . 0 0 "[ . 1 . 2]" 1
1634 1 64 VAL MG1 1 65 GLU QG . . 3.790 2.930 2.642 3.746 . 0 0 "[ . 1 . 2]" 1
1635 1 64 VAL MG1 1 68 ARG H . . 4.170 3.938 3.857 4.137 . 0 0 "[ . 1 . 2]" 1
1636 1 64 VAL MG1 1 68 ARG HB2 . . 3.980 3.078 2.769 3.637 . 0 0 "[ . 1 . 2]" 1
1637 1 64 VAL MG1 1 68 ARG HB3 . . 3.500 2.028 1.873 2.281 . 0 0 "[ . 1 . 2]" 1
1638 1 64 VAL MG1 1 68 ARG HD2 . . 4.550 4.346 3.819 4.545 . 0 0 "[ . 1 . 2]" 1
1639 1 64 VAL MG1 1 68 ARG QD . . 3.960 3.681 2.861 3.970 0.010 14 0 "[ . 1 . 2]" 1
1640 1 64 VAL MG1 1 68 ARG HD3 . . 4.550 4.083 2.910 4.552 0.002 17 0 "[ . 1 . 2]" 1
1641 1 64 VAL MG1 1 68 ARG HG2 . . 3.880 2.536 2.224 2.788 . 0 0 "[ . 1 . 2]" 1
1642 1 64 VAL MG1 1 68 ARG HG3 . . 4.070 3.529 3.035 4.084 0.014 13 0 "[ . 1 . 2]" 1
1643 1 64 VAL MG1 1 70 TRP H . . 4.410 3.810 3.536 4.177 . 0 0 "[ . 1 . 2]" 1
1644 1 64 VAL MG1 1 71 HIS H . . 5.500 5.087 4.823 5.515 0.015 14 0 "[ . 1 . 2]" 1
1645 1 64 VAL MG1 1 71 HIS HB2 . . 3.910 2.692 2.372 2.959 . 0 0 "[ . 1 . 2]" 1
1646 1 64 VAL MG1 1 71 HIS HB3 . . 5.010 4.177 3.851 4.417 . 0 0 "[ . 1 . 2]" 1
1647 1 64 VAL MG1 1 71 HIS HE1 . . 4.510 4.441 4.290 4.514 0.004 20 0 "[ . 1 . 2]" 1
1648 1 64 VAL MG2 1 65 GLU H . . 4.060 4.002 3.918 4.070 0.010 14 0 "[ . 1 . 2]" 1
1649 1 64 VAL MG2 1 71 HIS HB2 . . 3.770 2.338 1.988 2.786 . 0 0 "[ . 1 . 2]" 1
1650 1 64 VAL MG2 1 71 HIS HB3 . . 3.850 3.337 3.011 3.675 . 0 0 "[ . 1 . 2]" 1
1651 1 64 VAL MG2 1 71 HIS HD2 . . 4.210 3.886 3.453 4.201 . 0 0 "[ . 1 . 2]" 1
1652 1 64 VAL MG2 1 71 HIS HE1 . . 4.240 3.538 3.208 3.826 . 0 0 "[ . 1 . 2]" 1
1653 1 64 VAL MG2 1 86 MET ME . . 4.310 4.044 3.822 4.306 . 0 0 "[ . 1 . 2]" 1
1654 1 65 GLU H 1 65 GLU HB2 . . 3.490 2.889 2.620 3.026 . 0 0 "[ . 1 . 2]" 1
1655 1 65 GLU H 1 65 GLU HB3 . . 3.750 3.539 3.506 3.608 . 0 0 "[ . 1 . 2]" 1
1656 1 65 GLU H 1 65 GLU QG . . 3.450 1.962 1.817 2.493 . 0 0 "[ . 1 . 2]" 1
1657 1 65 GLU H 1 66 GLY H . . 4.620 4.635 4.615 4.652 0.032 20 0 "[ . 1 . 2]" 1
1658 1 65 GLU HA 1 65 GLU QG . . 3.410 3.048 2.473 3.297 . 0 0 "[ . 1 . 2]" 1
1659 1 65 GLU HA 1 66 GLY H . . 3.140 2.264 2.219 2.335 . 0 0 "[ . 1 . 2]" 1
1660 1 65 GLU HA 1 66 GLY HA2 . . 4.470 4.323 4.319 4.328 . 0 0 "[ . 1 . 2]" 1
1661 1 65 GLU HA 1 66 GLY HA3 . . 4.470 4.425 4.410 4.438 . 0 0 "[ . 1 . 2]" 1
1662 1 65 GLU HA 1 67 ASP H . . 4.160 3.953 3.760 4.131 . 0 0 "[ . 1 . 2]" 1
1663 1 65 GLU HB2 1 66 GLY H . . 4.240 3.665 3.482 3.783 . 0 0 "[ . 1 . 2]" 1
1664 1 65 GLU HB2 1 67 ASP H . . 4.090 3.045 2.711 3.268 . 0 0 "[ . 1 . 2]" 1
1665 1 65 GLU HB2 1 68 ARG H . . 4.710 2.405 2.151 2.620 . 0 0 "[ . 1 . 2]" 1
1666 1 65 GLU HB2 1 68 ARG HG2 . . 5.080 4.316 4.135 4.505 . 0 0 "[ . 1 . 2]" 1
1667 1 65 GLU HB2 1 68 ARG HG3 . . 5.260 4.885 4.541 5.133 . 0 0 "[ . 1 . 2]" 1
1668 1 65 GLU HB3 1 66 GLY H . . 3.760 2.894 2.619 3.058 . 0 0 "[ . 1 . 2]" 1
1669 1 65 GLU HB3 1 67 ASP H . . 4.010 2.928 2.502 3.276 . 0 0 "[ . 1 . 2]" 1
1670 1 65 GLU QG 1 66 GLY H . . 4.690 4.527 4.088 4.701 0.011 12 0 "[ . 1 . 2]" 1
1671 1 65 GLU QG 1 67 ASP H . . 4.880 4.600 4.371 4.828 . 0 0 "[ . 1 . 2]" 1
1672 1 65 GLU QG 1 68 ARG H . . 4.440 4.182 3.940 4.416 . 0 0 "[ . 1 . 2]" 1
1673 1 65 GLU QG 1 68 ARG HB2 . . 4.450 2.873 2.605 3.286 . 0 0 "[ . 1 . 2]" 1
1674 1 65 GLU QG 1 68 ARG HB3 . . 4.450 3.580 3.248 4.180 . 0 0 "[ . 1 . 2]" 1
1675 1 65 GLU QG 1 68 ARG QD . . 4.340 3.415 2.863 4.220 . 0 0 "[ . 1 . 2]" 1
1676 1 65 GLU QG 1 68 ARG HG2 . . 5.220 4.020 3.528 5.245 0.025 13 0 "[ . 1 . 2]" 1
1677 1 65 GLU QG 1 68 ARG HG3 . . 5.500 5.043 4.816 5.516 0.016 14 0 "[ . 1 . 2]" 1
1678 1 66 GLY H 1 67 ASP H . . 3.770 2.566 2.444 2.675 . 0 0 "[ . 1 . 2]" 1
1679 1 66 GLY H 1 68 ARG H . . 4.520 3.963 3.866 4.094 . 0 0 "[ . 1 . 2]" 1
1680 1 66 GLY QA 1 68 ARG H . . 4.150 3.705 3.506 4.154 0.004 13 0 "[ . 1 . 2]" 1
1681 1 66 GLY HA2 1 68 ARG H . . 4.890 3.945 3.708 4.523 . 0 0 "[ . 1 . 2]" 1
1682 1 66 GLY HA3 1 68 ARG H . . 4.890 4.501 4.312 4.839 . 0 0 "[ . 1 . 2]" 1
1683 1 67 ASP H 1 67 ASP HB2 . . 3.720 2.690 2.275 3.686 . 0 0 "[ . 1 . 2]" 1
1684 1 67 ASP H 1 67 ASP HB3 . . 3.720 3.209 2.350 3.773 0.053 14 0 "[ . 1 . 2]" 1
1685 1 67 ASP H 1 68 ARG H . . 3.080 2.250 1.906 2.463 . 0 0 "[ . 1 . 2]" 1
1686 1 67 ASP H 1 68 ARG HB2 . . 4.630 4.217 3.907 4.429 . 0 0 "[ . 1 . 2]" 1
1687 1 67 ASP QB 1 68 ARG H . . 3.700 3.282 3.058 3.685 . 0 0 "[ . 1 . 2]" 1
1688 1 67 ASP QB 1 68 ARG HA . . 4.660 4.190 3.994 4.580 . 0 0 "[ . 1 . 2]" 1
1689 1 67 ASP HB2 1 68 ARG H . . 4.320 3.698 3.193 4.278 . 0 0 "[ . 1 . 2]" 1
1690 1 67 ASP HB3 1 68 ARG H . . 4.320 3.904 3.194 4.247 . 0 0 "[ . 1 . 2]" 1
1691 1 68 ARG H 1 68 ARG HB2 . . 3.290 2.494 2.378 2.624 . 0 0 "[ . 1 . 2]" 1
1692 1 68 ARG H 1 68 ARG HB3 . . 3.320 2.704 2.555 2.769 . 0 0 "[ . 1 . 2]" 1
1693 1 68 ARG H 1 68 ARG QD . . 4.680 4.245 3.988 4.582 . 0 0 "[ . 1 . 2]" 1
1694 1 68 ARG H 1 68 ARG HG2 . . 4.700 4.663 4.531 4.735 0.035 1 0 "[ . 1 . 2]" 1
1695 1 68 ARG H 1 68 ARG HG3 . . 4.510 4.487 4.409 4.540 0.030 12 0 "[ . 1 . 2]" 1
1696 1 68 ARG H 1 69 TYR QD . . 4.340 4.056 3.880 4.308 . 0 0 "[ . 1 . 2]" 1
1697 1 68 ARG H 1 70 TRP H . . 5.500 5.438 5.317 5.531 0.031 14 0 "[ . 1 . 2]" 1
1698 1 68 ARG HA 1 68 ARG HD2 . . 4.300 3.358 2.643 3.918 . 0 0 "[ . 1 . 2]" 1
1699 1 68 ARG HA 1 68 ARG QD . . 3.760 2.902 2.020 3.635 . 0 0 "[ . 1 . 2]" 1
1700 1 68 ARG HA 1 68 ARG HD3 . . 4.300 3.473 2.036 4.308 0.008 5 0 "[ . 1 . 2]" 1
1701 1 68 ARG HA 1 68 ARG HG2 . . 3.990 3.626 3.333 3.698 . 0 0 "[ . 1 . 2]" 1
1702 1 68 ARG HA 1 68 ARG HG3 . . 4.000 2.530 2.292 2.705 . 0 0 "[ . 1 . 2]" 1
1703 1 68 ARG HA 1 69 TYR H . . 3.230 2.161 2.142 2.176 . 0 0 "[ . 1 . 2]" 1
1704 1 68 ARG HA 1 69 TYR HA . . 5.010 4.390 4.386 4.395 . 0 0 "[ . 1 . 2]" 1
1705 1 68 ARG HA 1 69 TYR HB2 . . 4.970 4.273 4.227 4.341 . 0 0 "[ . 1 . 2]" 1
1706 1 68 ARG HA 1 69 TYR QD . . 4.270 3.571 3.302 3.810 . 0 0 "[ . 1 . 2]" 1
1707 1 68 ARG HA 1 70 TRP H . . 3.760 3.615 3.545 3.735 . 0 0 "[ . 1 . 2]" 1
1708 1 68 ARG HA 1 70 TRP HD1 . . 4.910 3.943 3.323 4.387 . 0 0 "[ . 1 . 2]" 1
1709 1 68 ARG HB2 1 68 ARG QD . . 3.560 2.225 2.053 2.558 . 0 0 "[ . 1 . 2]" 1
1710 1 68 ARG HB2 1 70 TRP H . . 4.630 4.580 4.464 4.638 0.008 10 0 "[ . 1 . 2]" 1
1711 1 68 ARG HB3 1 68 ARG QD . . 3.650 3.181 2.655 3.417 . 0 0 "[ . 1 . 2]" 1
1712 1 68 ARG HB3 1 69 TYR H . . 4.180 3.989 3.884 4.207 0.027 20 0 "[ . 1 . 2]" 1
1713 1 68 ARG HB3 1 70 TRP H . . 3.750 3.657 3.480 3.760 0.010 13 0 "[ . 1 . 2]" 1
1714 1 68 ARG QD 1 69 TYR H . . 5.340 4.001 3.200 4.802 . 0 0 "[ . 1 . 2]" 1
1715 1 68 ARG QD 1 70 TRP H . . 4.290 3.913 3.464 4.274 . 0 0 "[ . 1 . 2]" 1
1716 1 68 ARG QD 1 70 TRP HE1 . . 3.750 2.341 1.877 2.867 . 0 0 "[ . 1 . 2]" 1
1717 1 68 ARG QD 1 70 TRP HZ2 . . 4.300 3.695 2.997 4.302 0.002 10 0 "[ . 1 . 2]" 1
1718 1 68 ARG HD2 1 70 TRP H . . 5.080 4.438 3.714 5.020 . 0 0 "[ . 1 . 2]" 1
1719 1 68 ARG HD2 1 70 TRP HE1 . . 4.330 2.917 1.886 4.172 . 0 0 "[ . 1 . 2]" 1
1720 1 68 ARG HD3 1 70 TRP H . . 5.080 4.473 4.044 4.956 . 0 0 "[ . 1 . 2]" 1
1721 1 68 ARG HD3 1 70 TRP HE1 . . 4.330 3.268 1.904 4.341 0.011 20 0 "[ . 1 . 2]" 1
1722 1 68 ARG HE 1 70 TRP HE1 . . 4.040 3.064 1.799 4.062 0.022 14 0 "[ . 1 . 2]" 1
1723 1 68 ARG HG2 1 69 TYR H . . 4.330 4.150 3.487 4.343 0.013 3 0 "[ . 1 . 2]" 1
1724 1 68 ARG HG2 1 70 TRP H . . 3.670 3.049 2.065 3.481 . 0 0 "[ . 1 . 2]" 1
1725 1 68 ARG HG2 1 70 TRP HD1 . . 4.830 4.227 2.989 4.831 0.001 16 0 "[ . 1 . 2]" 1
1726 1 68 ARG HG2 1 70 TRP HE1 . . 4.760 4.329 3.715 4.713 . 0 0 "[ . 1 . 2]" 1
1727 1 68 ARG HG3 1 69 TYR H . . 4.130 2.648 2.494 2.978 . 0 0 "[ . 1 . 2]" 1
1728 1 68 ARG HG3 1 70 TRP H . . 3.480 2.068 1.890 2.762 . 0 0 "[ . 1 . 2]" 1
1729 1 68 ARG HG3 1 70 TRP HD1 . . 5.100 2.830 2.001 3.454 . 0 0 "[ . 1 . 2]" 1
1730 1 68 ARG HG3 1 70 TRP HE1 . . 4.780 3.574 2.501 4.164 . 0 0 "[ . 1 . 2]" 1
1731 1 69 TYR H 1 69 TYR HB2 . . 3.960 2.394 2.354 2.456 . 0 0 "[ . 1 . 2]" 1
1732 1 69 TYR H 1 69 TYR HB3 . . 4.190 3.586 3.556 3.636 . 0 0 "[ . 1 . 2]" 1
1733 1 69 TYR H 1 69 TYR QD . . 3.920 2.993 2.832 3.186 . 0 0 "[ . 1 . 2]" 1
1734 1 69 TYR H 1 70 TRP H . . 3.180 2.347 2.195 2.742 . 0 0 "[ . 1 . 2]" 1
1735 1 69 TYR H 1 70 TRP HD1 . . 4.330 2.950 2.466 3.299 . 0 0 "[ . 1 . 2]" 1
1736 1 69 TYR HA 1 69 TYR QD . . 3.720 2.532 2.162 2.856 . 0 0 "[ . 1 . 2]" 1
1737 1 69 TYR HB2 1 70 TRP H . . 4.300 3.933 3.822 4.165 . 0 0 "[ . 1 . 2]" 1
1738 1 70 TRP H 1 70 TRP QB . . 3.590 3.026 2.948 3.145 . 0 0 "[ . 1 . 2]" 1
1739 1 70 TRP H 1 70 TRP HD1 . . 3.700 2.933 2.455 3.317 . 0 0 "[ . 1 . 2]" 1
1740 1 70 TRP H 1 71 HIS H . . 4.660 4.362 4.222 4.402 . 0 0 "[ . 1 . 2]" 1
1741 1 70 TRP HA 1 71 HIS H . . 3.140 2.256 2.188 2.321 . 0 0 "[ . 1 . 2]" 1
1742 1 70 TRP QB 1 70 TRP HE3 . . 3.640 2.531 2.410 2.653 . 0 0 "[ . 1 . 2]" 1
1743 1 70 TRP QB 1 71 HIS H . . 3.380 2.834 2.662 3.035 . 0 0 "[ . 1 . 2]" 1
1744 1 70 TRP HB2 1 71 HIS H . . 4.200 2.889 2.702 3.112 . 0 0 "[ . 1 . 2]" 1
1745 1 70 TRP HB3 1 71 HIS H . . 4.200 4.108 4.004 4.211 0.011 14 0 "[ . 1 . 2]" 1
1746 1 70 TRP HE3 1 71 HIS H . . 3.960 3.088 2.616 3.616 . 0 0 "[ . 1 . 2]" 1
1747 1 70 TRP HE3 1 71 HIS HA . . 4.440 3.239 2.672 3.877 . 0 0 "[ . 1 . 2]" 1
1748 1 70 TRP HE3 1 72 SER H . . 4.400 3.971 3.494 4.407 0.007 20 0 "[ . 1 . 2]" 1
1749 1 70 TRP HZ3 1 72 SER HB2 . . 4.640 4.261 3.689 4.652 0.012 13 0 "[ . 1 . 2]" 1
1750 1 70 TRP HZ3 1 72 SER QB . . 4.000 2.619 1.990 3.115 . 0 0 "[ . 1 . 2]" 1
1751 1 70 TRP HZ3 1 72 SER HB3 . . 4.640 2.646 1.999 3.165 . 0 0 "[ . 1 . 2]" 1
1752 1 71 HIS H 1 71 HIS HB2 . . 4.000 3.362 3.244 3.437 . 0 0 "[ . 1 . 2]" 1
1753 1 71 HIS H 1 71 HIS HB3 . . 3.870 2.955 2.870 3.023 . 0 0 "[ . 1 . 2]" 1
1754 1 71 HIS H 1 72 SER H . . 4.410 4.259 4.120 4.378 . 0 0 "[ . 1 . 2]" 1
1755 1 71 HIS HA 1 72 SER H . . 2.830 2.221 2.155 2.343 . 0 0 "[ . 1 . 2]" 1
1756 1 71 HIS HA 1 72 SER QB . . 4.580 4.248 4.168 4.370 . 0 0 "[ . 1 . 2]" 1
1757 1 71 HIS HB3 1 72 SER H . . 4.190 3.972 3.710 4.157 . 0 0 "[ . 1 . 2]" 1
1758 1 71 HIS HD2 1 73 ILE H . . 4.710 3.879 3.434 4.499 . 0 0 "[ . 1 . 2]" 1
1759 1 71 HIS HD2 1 73 ILE MD . . 3.870 3.622 3.326 3.819 . 0 0 "[ . 1 . 2]" 1
1760 1 71 HIS HD2 1 73 ILE HG12 . . 3.720 2.632 2.473 2.813 . 0 0 "[ . 1 . 2]" 1
1761 1 71 HIS HD2 1 73 ILE HG13 . . 3.590 2.749 2.337 3.153 . 0 0 "[ . 1 . 2]" 1
1762 1 71 HIS HD2 1 73 ILE MG . . 4.360 4.245 4.118 4.363 0.003 13 0 "[ . 1 . 2]" 1
1763 1 71 HIS HE1 1 72 SER H . . 4.600 4.351 3.953 4.603 0.003 1 0 "[ . 1 . 2]" 1
1764 1 72 SER H 1 72 SER HB2 . . 3.790 3.746 3.697 3.801 0.011 15 0 "[ . 1 . 2]" 1
1765 1 72 SER H 1 72 SER QB . . 3.040 2.838 2.593 3.022 . 0 0 "[ . 1 . 2]" 1
1766 1 72 SER H 1 72 SER HB3 . . 3.790 2.943 2.647 3.172 . 0 0 "[ . 1 . 2]" 1
1767 1 72 SER H 1 73 ILE H . . 4.580 4.154 4.040 4.320 . 0 0 "[ . 1 . 2]" 1
1768 1 72 SER HA 1 73 ILE H . . 2.980 2.160 2.139 2.179 . 0 0 "[ . 1 . 2]" 1
1769 1 72 SER HA 1 73 ILE HG12 . . 5.500 5.199 5.046 5.321 . 0 0 "[ . 1 . 2]" 1
1770 1 72 SER QB 1 73 ILE H . . 3.710 3.561 3.459 3.669 . 0 0 "[ . 1 . 2]" 1
1771 1 72 SER HB2 1 73 ILE H . . 4.570 3.745 3.601 3.866 . 0 0 "[ . 1 . 2]" 1
1772 1 72 SER HB3 1 73 ILE H . . 4.570 4.460 4.370 4.567 . 0 0 "[ . 1 . 2]" 1
1773 1 73 ILE H 1 73 ILE HB . . 3.310 2.644 2.610 2.684 . 0 0 "[ . 1 . 2]" 1
1774 1 73 ILE H 1 73 ILE MD . . 3.900 3.296 3.156 3.420 . 0 0 "[ . 1 . 2]" 1
1775 1 73 ILE H 1 73 ILE HG12 . . 3.590 3.393 3.261 3.486 . 0 0 "[ . 1 . 2]" 1
1776 1 73 ILE H 1 73 ILE HG13 . . 3.750 1.936 1.900 2.003 . 0 0 "[ . 1 . 2]" 1
1777 1 73 ILE H 1 73 ILE MG . . 3.980 3.774 3.768 3.789 . 0 0 "[ . 1 . 2]" 1
1778 1 73 ILE H 1 74 SER H . . 4.760 4.621 4.606 4.630 . 0 0 "[ . 1 . 2]" 1
1779 1 73 ILE H 1 76 LEU MD1 . . 4.610 4.311 4.046 4.477 . 0 0 "[ . 1 . 2]" 1
1780 1 73 ILE HA 1 73 ILE MD . . 4.240 3.930 3.903 3.958 . 0 0 "[ . 1 . 2]" 1
1781 1 73 ILE HA 1 73 ILE HG12 . . 4.070 2.777 2.691 2.867 . 0 0 "[ . 1 . 2]" 1
1782 1 73 ILE HA 1 73 ILE HG13 . . 3.930 2.964 2.902 3.073 . 0 0 "[ . 1 . 2]" 1
1783 1 73 ILE HA 1 73 ILE MG . . 3.230 2.296 2.185 2.359 . 0 0 "[ . 1 . 2]" 1
1784 1 73 ILE HA 1 74 SER H . . 2.710 2.288 2.241 2.340 . 0 0 "[ . 1 . 2]" 1
1785 1 73 ILE HB 1 73 ILE MD . . 3.490 2.287 2.218 2.388 . 0 0 "[ . 1 . 2]" 1
1786 1 73 ILE HB 1 74 SER H . . 4.020 3.688 3.561 3.800 . 0 0 "[ . 1 . 2]" 1
1787 1 73 ILE HB 1 76 LEU MD1 . . 3.790 2.381 2.086 2.566 . 0 0 "[ . 1 . 2]" 1
1788 1 73 ILE MD 1 73 ILE MG . . 2.920 2.150 1.970 2.260 . 0 0 "[ . 1 . 2]" 1
1789 1 73 ILE MD 1 74 SER H . . 5.200 4.874 4.702 4.997 . 0 0 "[ . 1 . 2]" 1
1790 1 73 ILE MD 1 76 LEU MD1 . . 3.720 3.305 3.124 3.476 . 0 0 "[ . 1 . 2]" 1
1791 1 73 ILE MD 1 84 ILE MD . . 3.480 3.110 2.887 3.337 . 0 0 "[ . 1 . 2]" 1
1792 1 73 ILE MD 1 84 ILE HG12 . . 4.430 3.524 3.129 3.770 . 0 0 "[ . 1 . 2]" 1
1793 1 73 ILE MD 1 84 ILE MG . . 3.350 2.522 2.294 2.758 . 0 0 "[ . 1 . 2]" 1
1794 1 73 ILE HG12 1 73 ILE MG . . 3.500 2.279 2.214 2.366 . 0 0 "[ . 1 . 2]" 1
1795 1 73 ILE HG12 1 74 SER H . . 4.760 4.399 4.303 4.474 . 0 0 "[ . 1 . 2]" 1
1796 1 73 ILE HG12 1 84 ILE MG . . 5.040 4.791 4.483 5.041 0.001 10 0 "[ . 1 . 2]" 1
1797 1 73 ILE HG13 1 73 ILE MG . . 3.190 3.181 3.162 3.197 0.007 17 0 "[ . 1 . 2]" 1
1798 1 73 ILE HG13 1 74 SER H . . 5.010 4.881 4.825 4.961 . 0 0 "[ . 1 . 2]" 1
1799 1 73 ILE MG 1 74 SER H . . 3.270 2.041 1.884 2.176 . 0 0 "[ . 1 . 2]" 1
1800 1 73 ILE MG 1 74 SER HA . . 4.600 3.545 3.451 3.722 . 0 0 "[ . 1 . 2]" 1
1801 1 73 ILE MG 1 75 HIS QB . . 4.530 4.357 4.298 4.445 . 0 0 "[ . 1 . 2]" 1
1802 1 73 ILE MG 1 76 LEU H . . 5.020 4.878 4.715 5.022 0.002 10 0 "[ . 1 . 2]" 1
1803 1 73 ILE MG 1 76 LEU HA . . 5.010 4.919 4.799 5.011 0.001 15 0 "[ . 1 . 2]" 1
1804 1 73 ILE MG 1 76 LEU MD1 . . 3.130 2.504 2.284 2.727 . 0 0 "[ . 1 . 2]" 1
1805 1 74 SER H 1 74 SER HB2 . . 3.520 2.946 2.838 3.023 . 0 0 "[ . 1 . 2]" 1
1806 1 74 SER H 1 74 SER HB3 . . 3.980 3.909 3.877 3.958 . 0 0 "[ . 1 . 2]" 1
1807 1 74 SER H 1 75 HIS H . . 4.550 4.400 4.377 4.427 . 0 0 "[ . 1 . 2]" 1
1808 1 74 SER H 1 76 LEU MD1 . . 4.150 3.863 3.658 4.038 . 0 0 "[ . 1 . 2]" 1
1809 1 74 SER HA 1 75 HIS H . . 3.200 2.575 2.498 2.634 . 0 0 "[ . 1 . 2]" 1
1810 1 74 SER HA 1 76 LEU H . . 3.960 3.684 3.574 3.779 . 0 0 "[ . 1 . 2]" 1
1811 1 74 SER HB2 1 75 HIS H . . 3.240 3.032 2.845 3.147 . 0 0 "[ . 1 . 2]" 1
1812 1 74 SER HB2 1 75 HIS HA . . 4.910 4.736 4.593 4.862 . 0 0 "[ . 1 . 2]" 1
1813 1 74 SER HB2 1 75 HIS HD2 . . 4.250 2.708 2.019 4.000 . 0 0 "[ . 1 . 2]" 1
1814 1 74 SER HB2 1 76 LEU H . . 5.500 5.431 5.316 5.500 . 1 0 "[ . 1 . 2]" 1
1815 1 74 SER HB3 1 75 HIS H . . 3.070 2.247 2.049 2.418 . 0 0 "[ . 1 . 2]" 1
1816 1 74 SER HB3 1 75 HIS HA . . 4.500 4.375 4.184 4.493 . 0 0 "[ . 1 . 2]" 1
1817 1 74 SER HB3 1 75 HIS HD2 . . 4.090 3.091 2.299 4.073 . 0 0 "[ . 1 . 2]" 1
1818 1 75 HIS H 1 75 HIS HA . . 2.910 2.275 2.274 2.277 . 0 0 "[ . 1 . 2]" 1
1819 1 75 HIS H 1 76 LEU H . . 3.450 2.756 2.641 2.857 . 0 0 "[ . 1 . 2]" 1
1820 1 75 HIS HA 1 75 HIS HD2 . . 4.550 3.379 2.460 4.431 . 0 0 "[ . 1 . 2]" 1
1821 1 75 HIS HA 1 76 LEU H . . 3.470 2.710 2.658 2.762 . 0 0 "[ . 1 . 2]" 1
1822 1 75 HIS QB 1 76 LEU H . . 4.050 3.892 3.871 3.904 . 0 0 "[ . 1 . 2]" 1
1823 1 76 LEU H 1 76 LEU QB . . 3.480 2.631 2.562 2.683 . 0 0 "[ . 1 . 2]" 1
1824 1 76 LEU H 1 76 LEU MD1 . . 3.680 3.511 3.360 3.668 . 0 0 "[ . 1 . 2]" 1
1825 1 76 LEU H 1 76 LEU MD2 . . 3.940 3.872 3.741 3.941 0.001 15 0 "[ . 1 . 2]" 1
1826 1 76 LEU H 1 76 LEU HG . . 2.950 2.568 2.401 2.708 . 0 0 "[ . 1 . 2]" 1
1827 1 76 LEU H 1 77 GLN H . . 4.570 4.437 4.408 4.480 . 0 0 "[ . 1 . 2]" 1
1828 1 76 LEU HA 1 76 LEU MD1 . . 4.210 3.980 3.949 4.000 . 0 0 "[ . 1 . 2]" 1
1829 1 76 LEU HA 1 76 LEU MD2 . . 2.910 2.493 2.371 2.629 . 0 0 "[ . 1 . 2]" 1
1830 1 76 LEU HA 1 77 GLN QE . . 4.860 4.098 3.273 4.851 . 0 0 "[ . 1 . 2]" 1
1831 1 76 LEU HA 1 77 GLN QG . . 4.120 3.826 3.433 4.132 0.012 11 0 "[ . 1 . 2]" 1
1832 1 76 LEU QB 1 76 LEU MD2 . . 3.220 2.101 2.009 2.200 . 0 0 "[ . 1 . 2]" 1
1833 1 76 LEU QB 1 77 GLN QG . . 5.340 4.372 3.960 4.633 . 0 0 "[ . 1 . 2]" 1
1834 1 76 LEU QB 1 105 THR MG . . 3.630 2.518 2.388 2.636 . 0 0 "[ . 1 . 2]" 1
1835 1 76 LEU HB2 1 77 GLN H . . 3.460 3.016 2.887 3.245 . 0 0 "[ . 1 . 2]" 1
1836 1 76 LEU HB3 1 77 GLN H . . 3.460 2.116 2.015 2.270 . 0 0 "[ . 1 . 2]" 1
1837 1 76 LEU MD1 1 77 GLN H . . 4.570 4.274 4.185 4.427 . 0 0 "[ . 1 . 2]" 1
1838 1 76 LEU MD1 1 82 TYR QE . . 4.640 3.393 3.166 3.636 . 0 0 "[ . 1 . 2]" 1
1839 1 76 LEU MD1 1 84 ILE MD . . 4.550 3.992 3.723 4.133 . 0 0 "[ . 1 . 2]" 1
1840 1 76 LEU MD1 1 105 THR MG . . 3.160 2.510 2.420 2.649 . 0 0 "[ . 1 . 2]" 1
1841 1 76 LEU MD2 1 77 GLN H . . 3.640 3.588 3.382 3.641 0.001 6 0 "[ . 1 . 2]" 1
1842 1 76 LEU MD2 1 82 TYR QE . . 3.570 3.151 2.969 3.359 . 0 0 "[ . 1 . 2]" 1
1843 1 76 LEU MD2 1 84 ILE MD . . 4.550 4.275 4.035 4.536 . 0 0 "[ . 1 . 2]" 1
1844 1 76 LEU MD2 1 105 THR MG . . 4.070 3.967 3.807 4.060 . 0 0 "[ . 1 . 2]" 1
1845 1 77 GLN H 1 77 GLN HB2 . . 3.400 2.562 2.433 2.665 . 0 0 "[ . 1 . 2]" 1
1846 1 77 GLN H 1 77 GLN HB3 . . 3.910 3.673 3.634 3.701 . 0 0 "[ . 1 . 2]" 1
1847 1 77 GLN H 1 77 GLN QG . . 3.600 2.860 2.417 3.191 . 0 0 "[ . 1 . 2]" 1
1848 1 77 GLN H 1 78 PRO HD2 . . 4.870 4.840 4.834 4.844 . 0 0 "[ . 1 . 2]" 1
1849 1 77 GLN H 1 80 THR H . . 5.500 5.453 5.403 5.494 . 0 0 "[ . 1 . 2]" 1
1850 1 77 GLN H 1 80 THR MG . . 4.600 4.087 3.930 4.311 . 0 0 "[ . 1 . 2]" 1
1851 1 77 GLN H 1 82 TYR QE . . 3.800 2.831 2.510 3.054 . 0 0 "[ . 1 . 2]" 1
1852 1 77 GLN H 1 105 THR MG . . 4.280 3.726 3.559 3.870 . 0 0 "[ . 1 . 2]" 1
1853 1 77 GLN HB2 1 77 GLN QE . . 4.550 3.555 1.890 3.999 . 0 0 "[ . 1 . 2]" 1
1854 1 77 GLN HB2 1 78 PRO HD2 . . 4.210 3.814 3.706 3.903 . 0 0 "[ . 1 . 2]" 1
1855 1 77 GLN HB2 1 78 PRO HD3 . . 5.030 4.803 4.731 4.853 . 0 0 "[ . 1 . 2]" 1
1856 1 77 GLN HB2 1 80 THR HB . . 4.230 2.253 2.092 2.563 . 0 0 "[ . 1 . 2]" 1
1857 1 77 GLN HB2 1 80 THR MG . . 4.170 2.389 2.290 2.585 . 0 0 "[ . 1 . 2]" 1
1858 1 77 GLN HB2 1 105 THR HG1 . . 4.490 4.208 3.961 4.495 0.005 5 0 "[ . 1 . 2]" 1
1859 1 77 GLN HB2 1 105 THR MG . . 5.140 4.690 4.524 4.813 . 0 0 "[ . 1 . 2]" 1
1860 1 77 GLN HB3 1 78 PRO HD2 . . 4.090 2.372 2.296 2.484 . 0 0 "[ . 1 . 2]" 1
1861 1 77 GLN HB3 1 78 PRO HD3 . . 4.250 3.764 3.702 3.858 . 0 0 "[ . 1 . 2]" 1
1862 1 77 GLN HB3 1 80 THR HB . . 4.300 3.527 3.263 3.677 . 0 0 "[ . 1 . 2]" 1
1863 1 77 GLN HB3 1 80 THR MG . . 4.200 3.377 3.241 3.558 . 0 0 "[ . 1 . 2]" 1
1864 1 77 GLN QE 1 77 GLN QG . . 2.940 2.221 2.089 2.548 . 0 0 "[ . 1 . 2]" 1
1865 1 77 GLN QE 1 80 THR MG . . 4.600 3.640 1.866 4.379 . 0 0 "[ . 1 . 2]" 1
1866 1 77 GLN HE22 1 77 GLN QG . . 3.540 3.247 3.216 3.431 . 0 0 "[ . 1 . 2]" 1
1867 1 77 GLN QG 1 78 PRO HD2 . . 4.030 3.503 3.228 3.687 . 0 0 "[ . 1 . 2]" 1
1868 1 77 GLN QG 1 78 PRO HD3 . . 4.440 4.282 4.097 4.425 . 0 0 "[ . 1 . 2]" 1
1869 1 77 GLN QG 1 80 THR MG . . 4.190 3.499 3.076 3.907 . 0 0 "[ . 1 . 2]" 1
1870 1 78 PRO HA 1 79 GLU H . . 3.140 2.248 2.205 2.286 . 0 0 "[ . 1 . 2]" 1
1871 1 78 PRO HA 1 79 GLU HA . . 4.580 4.384 4.376 4.398 . 0 0 "[ . 1 . 2]" 1
1872 1 78 PRO HA 1 79 GLU HG2 . . 5.460 4.037 3.906 4.135 . 0 0 "[ . 1 . 2]" 1
1873 1 78 PRO HA 1 79 GLU HG3 . . 5.500 4.474 4.329 4.742 . 0 0 "[ . 1 . 2]" 1
1874 1 78 PRO HA 1 80 THR H . . 3.910 3.657 3.466 3.765 . 0 0 "[ . 1 . 2]" 1
1875 1 78 PRO HA 1 80 THR HG1 . . 4.740 4.019 3.731 4.729 . 0 0 "[ . 1 . 2]" 1
1876 1 78 PRO HA 1 105 THR HB . . 3.980 2.951 2.708 3.178 . 0 0 "[ . 1 . 2]" 1
1877 1 78 PRO HA 1 105 THR MG . . 4.110 3.810 3.612 3.916 . 0 0 "[ . 1 . 2]" 1
1878 1 78 PRO HA 1 106 LYS H . . 4.730 4.161 4.055 4.315 . 0 0 "[ . 1 . 2]" 1
1879 1 78 PRO HB2 1 79 GLU H . . 3.760 3.059 2.932 3.219 . 0 0 "[ . 1 . 2]" 1
1880 1 78 PRO HB2 1 80 THR HG1 . . 5.120 4.724 4.636 5.046 . 0 0 "[ . 1 . 2]" 1
1881 1 78 PRO HB2 1 107 ALA HA . . 4.400 3.393 3.203 3.521 . 0 0 "[ . 1 . 2]" 1
1882 1 78 PRO HB2 1 108 ARG H . . 4.430 2.383 2.089 2.581 . 0 0 "[ . 1 . 2]" 1
1883 1 78 PRO HB2 1 108 ARG HA . . 5.300 4.142 3.696 4.633 . 0 0 "[ . 1 . 2]" 1
1884 1 78 PRO HB2 1 108 ARG QB . . 4.330 2.603 2.245 3.024 . 0 0 "[ . 1 . 2]" 1
1885 1 78 PRO HB2 1 108 ARG QG . . 3.760 2.078 1.987 2.450 . 0 0 "[ . 1 . 2]" 1
1886 1 78 PRO HB3 1 79 GLU H . . 4.170 3.701 3.626 3.798 . 0 0 "[ . 1 . 2]" 1
1887 1 78 PRO HB3 1 108 ARG H . . 4.570 3.381 3.152 3.666 . 0 0 "[ . 1 . 2]" 1
1888 1 78 PRO HB3 1 108 ARG QB . . 3.970 2.138 1.989 2.673 . 0 0 "[ . 1 . 2]" 1
1889 1 78 PRO HG2 1 108 ARG QG . . 3.750 2.783 2.429 3.133 . 0 0 "[ . 1 . 2]" 1
1890 1 78 PRO HG3 1 79 GLU HG2 . . 5.500 4.711 4.513 4.823 . 0 0 "[ . 1 . 2]" 1
1891 1 78 PRO HG3 1 79 GLU HG3 . . 5.500 4.899 4.783 5.249 . 0 0 "[ . 1 . 2]" 1
1892 1 78 PRO HG3 1 108 ARG QD . . 3.700 2.670 2.028 3.706 0.006 18 0 "[ . 1 . 2]" 1
1893 1 78 PRO HG3 1 108 ARG QG . . 2.880 2.742 1.988 2.887 0.007 12 0 "[ . 1 . 2]" 1
1894 1 79 GLU H 1 79 GLU HB2 . . 3.990 3.973 3.968 3.992 0.002 20 0 "[ . 1 . 2]" 1
1895 1 79 GLU H 1 79 GLU HB3 . . 3.430 3.131 3.076 3.170 . 0 0 "[ . 1 . 2]" 1
1896 1 79 GLU H 1 79 GLU HG2 . . 3.600 2.888 2.785 2.995 . 0 0 "[ . 1 . 2]" 1
1897 1 79 GLU H 1 79 GLU HG3 . . 4.140 3.549 3.427 3.841 . 0 0 "[ . 1 . 2]" 1
1898 1 79 GLU H 1 80 THR H . . 3.450 3.021 2.974 3.055 . 0 0 "[ . 1 . 2]" 1
1899 1 79 GLU H 1 105 THR H . . 4.850 4.733 4.635 4.840 . 0 0 "[ . 1 . 2]" 1
1900 1 79 GLU H 1 105 THR HA . . 5.070 4.966 4.862 5.056 . 0 0 "[ . 1 . 2]" 1
1901 1 79 GLU H 1 105 THR HB . . 3.950 3.162 2.982 3.326 . 0 0 "[ . 1 . 2]" 1
1902 1 79 GLU H 1 105 THR MG . . 4.450 4.420 4.324 4.455 0.005 9 0 "[ . 1 . 2]" 1
1903 1 79 GLU H 1 106 LYS H . . 3.990 3.747 3.525 3.866 . 0 0 "[ . 1 . 2]" 1
1904 1 79 GLU H 1 107 ALA HA . . 3.970 2.963 2.865 3.091 . 0 0 "[ . 1 . 2]" 1
1905 1 79 GLU H 1 107 ALA MB . . 4.530 4.380 4.236 4.469 . 0 0 "[ . 1 . 2]" 1
1906 1 79 GLU H 1 108 ARG H . . 4.430 3.940 3.608 4.067 . 0 0 "[ . 1 . 2]" 1
1907 1 79 GLU HA 1 79 GLU HG2 . . 3.700 3.620 3.564 3.678 . 0 0 "[ . 1 . 2]" 1
1908 1 79 GLU HA 1 79 GLU HG3 . . 3.870 3.728 3.691 3.801 . 0 0 "[ . 1 . 2]" 1
1909 1 79 GLU HA 1 80 THR H . . 3.180 2.787 2.737 2.878 . 0 0 "[ . 1 . 2]" 1
1910 1 79 GLU HA 1 80 THR HG1 . . 5.500 4.910 4.564 5.182 . 0 0 "[ . 1 . 2]" 1
1911 1 79 GLU HA 1 104 GLU HG2 . . 4.390 3.190 2.991 3.368 . 0 0 "[ . 1 . 2]" 1
1912 1 79 GLU HA 1 105 THR H . . 4.400 4.027 3.913 4.167 . 0 0 "[ . 1 . 2]" 1
1913 1 79 GLU HA 1 105 THR HB . . 4.570 4.384 4.216 4.518 . 0 0 "[ . 1 . 2]" 1
1914 1 79 GLU HA 1 106 LYS H . . 5.500 4.806 4.609 4.957 . 0 0 "[ . 1 . 2]" 1
1915 1 79 GLU HA 1 107 ALA H . . 4.870 4.640 4.446 4.806 . 0 0 "[ . 1 . 2]" 1
1916 1 79 GLU HA 1 107 ALA HA . . 4.180 3.714 3.448 3.873 . 0 0 "[ . 1 . 2]" 1
1917 1 79 GLU HA 1 107 ALA MB . . 4.480 4.344 4.141 4.480 0.000 15 0 "[ . 1 . 2]" 1
1918 1 79 GLU HA 1 108 ARG H . . 5.500 5.368 4.994 5.502 0.002 15 0 "[ . 1 . 2]" 1
1919 1 79 GLU HB2 1 80 THR H . . 4.540 4.349 4.329 4.381 . 0 0 "[ . 1 . 2]" 1
1920 1 79 GLU HB2 1 107 ALA HA . . 4.260 3.918 3.608 4.123 . 0 0 "[ . 1 . 2]" 1
1921 1 79 GLU HB2 1 107 ALA MB . . 4.230 3.989 3.723 4.214 . 0 0 "[ . 1 . 2]" 1
1922 1 79 GLU HB3 1 80 THR H . . 4.730 4.662 4.658 4.665 . 0 0 "[ . 1 . 2]" 1
1923 1 79 GLU HB3 1 107 ALA H . . 4.220 4.029 3.743 4.211 . 0 0 "[ . 1 . 2]" 1
1924 1 79 GLU HB3 1 107 ALA HA . . 3.480 2.331 2.029 2.571 . 0 0 "[ . 1 . 2]" 1
1925 1 79 GLU HB3 1 107 ALA MB . . 3.360 2.684 2.372 2.911 . 0 0 "[ . 1 . 2]" 1
1926 1 79 GLU HB3 1 108 ARG H . . 4.440 4.057 3.735 4.284 . 0 0 "[ . 1 . 2]" 1
1927 1 79 GLU HG2 1 80 THR H . . 5.350 4.808 4.600 4.948 . 0 0 "[ . 1 . 2]" 1
1928 1 79 GLU HG2 1 107 ALA H . . 5.080 4.937 4.784 5.081 0.001 20 0 "[ . 1 . 2]" 1
1929 1 79 GLU HG2 1 107 ALA HA . . 3.400 2.164 2.005 2.334 . 0 0 "[ . 1 . 2]" 1
1930 1 79 GLU HG2 1 107 ALA MB . . 3.520 3.348 3.175 3.504 . 0 0 "[ . 1 . 2]" 1
1931 1 79 GLU HG2 1 108 ARG H . . 3.530 2.386 1.929 2.598 . 0 0 "[ . 1 . 2]" 1
1932 1 79 GLU HG3 1 80 THR H . . 4.280 4.230 4.078 4.291 0.011 11 0 "[ . 1 . 2]" 1
1933 1 79 GLU HG3 1 107 ALA HA . . 3.910 3.810 3.598 3.911 0.001 8 0 "[ . 1 . 2]" 1
1934 1 79 GLU HG3 1 108 ARG H . . 4.460 4.007 3.553 4.227 . 0 0 "[ . 1 . 2]" 1
1935 1 79 GLU HG3 1 108 ARG QG . . 3.930 3.696 3.164 3.934 0.004 4 0 "[ . 1 . 2]" 1
1936 1 80 THR H 1 80 THR HB . . 3.280 2.636 2.543 2.773 . 0 0 "[ . 1 . 2]" 1
1937 1 80 THR H 1 80 THR MG . . 3.970 3.851 3.810 3.898 . 0 0 "[ . 1 . 2]" 1
1938 1 80 THR H 1 81 SER H . . 4.260 4.157 4.099 4.249 . 0 0 "[ . 1 . 2]" 1
1939 1 80 THR H 1 82 TYR QE . . 4.240 4.134 3.980 4.230 . 0 0 "[ . 1 . 2]" 1
1940 1 80 THR H 1 104 GLU HA . . 4.960 4.680 4.543 4.857 . 0 0 "[ . 1 . 2]" 1
1941 1 80 THR H 1 104 GLU HG2 . . 4.060 3.797 3.637 4.057 . 0 0 "[ . 1 . 2]" 1
1942 1 80 THR H 1 105 THR H . . 3.530 3.134 2.969 3.284 . 0 0 "[ . 1 . 2]" 1
1943 1 80 THR H 1 105 THR HG1 . . 3.350 1.934 1.898 2.019 . 0 0 "[ . 1 . 2]" 1
1944 1 80 THR H 1 105 THR MG . . 3.730 3.598 3.449 3.693 . 0 0 "[ . 1 . 2]" 1
1945 1 80 THR HA 1 80 THR MG . . 3.100 2.403 2.162 2.482 . 0 0 "[ . 1 . 2]" 1
1946 1 80 THR HA 1 81 SER H . . 2.720 2.167 2.147 2.184 . 0 0 "[ . 1 . 2]" 1
1947 1 80 THR HA 1 81 SER HB2 . . 4.430 4.386 4.334 4.426 . 0 0 "[ . 1 . 2]" 1
1948 1 80 THR HB 1 81 SER H . . 4.490 4.371 4.269 4.443 . 0 0 "[ . 1 . 2]" 1
1949 1 80 THR HB 1 82 TYR QE . . 3.460 2.489 2.207 2.717 . 0 0 "[ . 1 . 2]" 1
1950 1 80 THR HB 1 105 THR HG1 . . 3.220 2.745 2.528 3.202 . 0 0 "[ . 1 . 2]" 1
1951 1 80 THR HB 1 105 THR MG . . 4.540 3.760 3.548 3.874 . 0 0 "[ . 1 . 2]" 1
1952 1 80 THR MG 1 81 SER H . . 3.150 3.066 2.936 3.153 0.003 7 0 "[ . 1 . 2]" 1
1953 1 80 THR MG 1 81 SER HB2 . . 4.960 4.937 4.839 4.968 0.008 11 0 "[ . 1 . 2]" 1
1954 1 80 THR MG 1 81 SER HB3 . . 4.890 4.757 4.662 4.815 . 0 0 "[ . 1 . 2]" 1
1955 1 80 THR MG 1 82 TYR H . . 4.640 3.992 3.797 4.450 . 0 0 "[ . 1 . 2]" 1
1956 1 80 THR MG 1 82 TYR QB . . 4.500 2.899 2.735 3.129 . 0 0 "[ . 1 . 2]" 1
1957 1 80 THR MG 1 82 TYR QE . . 3.440 3.293 3.074 3.444 0.004 15 0 "[ . 1 . 2]" 1
1958 1 80 THR MG 1 105 THR H . . 5.500 5.125 4.972 5.337 . 0 0 "[ . 1 . 2]" 1
1959 1 80 THR MG 1 105 THR MG . . 4.890 4.682 4.504 4.835 . 0 0 "[ . 1 . 2]" 1
1960 1 81 SER H 1 81 SER HB2 . . 3.250 2.333 2.299 2.385 . 0 0 "[ . 1 . 2]" 1
1961 1 81 SER H 1 81 SER HB3 . . 3.180 2.842 2.808 2.861 . 0 0 "[ . 1 . 2]" 1
1962 1 81 SER H 1 82 TYR H . . 4.620 4.313 4.270 4.367 . 0 0 "[ . 1 . 2]" 1
1963 1 81 SER H 1 104 GLU HA . . 4.630 4.524 4.354 4.618 . 0 0 "[ . 1 . 2]" 1
1964 1 81 SER H 1 104 GLU HG2 . . 4.170 3.900 3.776 4.138 . 0 0 "[ . 1 . 2]" 1
1965 1 81 SER H 1 104 GLU HG3 . . 4.580 3.350 3.216 3.499 . 0 0 "[ . 1 . 2]" 1
1966 1 81 SER HA 1 82 TYR H . . 3.070 2.164 2.147 2.179 . 0 0 "[ . 1 . 2]" 1
1967 1 81 SER HA 1 102 ILE MG . . 4.090 3.640 3.476 3.837 . 0 0 "[ . 1 . 2]" 1
1968 1 81 SER HA 1 104 GLU HA . . 3.340 2.293 2.179 2.344 . 0 0 "[ . 1 . 2]" 1
1969 1 81 SER HA 1 104 GLU HB2 . . 3.680 3.596 3.472 3.679 . 0 0 "[ . 1 . 2]" 1
1970 1 81 SER HA 1 104 GLU HB3 . . 5.080 4.662 4.586 4.716 . 0 0 "[ . 1 . 2]" 1
1971 1 81 SER HA 1 104 GLU HG2 . . 3.970 3.383 3.284 3.494 . 0 0 "[ . 1 . 2]" 1
1972 1 81 SER HA 1 104 GLU HG3 . . 3.960 2.717 2.572 2.847 . 0 0 "[ . 1 . 2]" 1
1973 1 81 SER HB2 1 82 TYR H . . 4.590 4.577 4.545 4.597 0.007 2 0 "[ . 1 . 2]" 1
1974 1 81 SER HB2 1 102 ILE MG . . 4.590 4.363 4.254 4.532 . 0 0 "[ . 1 . 2]" 1
1975 1 81 SER HB2 1 104 GLU HA . . 4.670 4.082 3.937 4.171 . 0 0 "[ . 1 . 2]" 1
1976 1 81 SER HB2 1 104 GLU HB2 . . 4.630 3.807 3.607 3.956 . 0 0 "[ . 1 . 2]" 1
1977 1 81 SER HB2 1 104 GLU HG2 . . 4.410 3.548 3.489 3.643 . 0 0 "[ . 1 . 2]" 1
1978 1 81 SER HB2 1 104 GLU HG3 . . 3.950 2.046 1.998 2.132 . 0 0 "[ . 1 . 2]" 1
1979 1 81 SER HB3 1 82 TYR H . . 4.420 4.216 4.166 4.262 . 0 0 "[ . 1 . 2]" 1
1980 1 81 SER HB3 1 102 ILE MG . . 4.280 3.864 3.711 4.048 . 0 0 "[ . 1 . 2]" 1
1981 1 81 SER HB3 1 104 GLU HA . . 5.090 5.013 4.856 5.089 . 0 0 "[ . 1 . 2]" 1
1982 1 81 SER HB3 1 104 GLU HG2 . . 5.210 5.119 5.053 5.210 0.000 15 0 "[ . 1 . 2]" 1
1983 1 81 SER HB3 1 104 GLU HG3 . . 4.110 3.655 3.569 3.724 . 0 0 "[ . 1 . 2]" 1
1984 1 82 TYR H 1 82 TYR QB . . 3.530 3.128 3.086 3.169 . 0 0 "[ . 1 . 2]" 1
1985 1 82 TYR H 1 82 TYR QE . . 4.460 4.186 4.129 4.241 . 0 0 "[ . 1 . 2]" 1
1986 1 82 TYR H 1 83 ASP H . . 4.550 4.445 4.430 4.459 . 0 0 "[ . 1 . 2]" 1
1987 1 82 TYR H 1 84 ILE MD . . 4.990 4.176 3.974 4.274 . 0 0 "[ . 1 . 2]" 1
1988 1 82 TYR H 1 104 GLU HA . . 3.530 3.493 3.380 3.532 0.002 12 0 "[ . 1 . 2]" 1
1989 1 82 TYR H 1 104 GLU HB2 . . 5.420 5.256 5.112 5.379 . 0 0 "[ . 1 . 2]" 1
1990 1 82 TYR H 1 104 GLU HG2 . . 5.500 5.286 5.177 5.412 . 0 0 "[ . 1 . 2]" 1
1991 1 82 TYR H 1 104 GLU HG3 . . 5.250 4.857 4.690 4.998 . 0 0 "[ . 1 . 2]" 1
1992 1 82 TYR H 1 105 THR H . . 4.660 4.483 4.355 4.558 . 0 0 "[ . 1 . 2]" 1
1993 1 82 TYR QB 1 83 ASP H . . 3.820 2.566 2.519 2.661 . 0 0 "[ . 1 . 2]" 1
1994 1 82 TYR HB2 1 83 ASP H . . 4.430 2.614 2.560 2.714 . 0 0 "[ . 1 . 2]" 1
1995 1 82 TYR HB3 1 83 ASP H . . 4.430 3.739 3.690 3.842 . 0 0 "[ . 1 . 2]" 1
1996 1 82 TYR QE 1 84 ILE MD . . 4.480 2.102 1.914 2.322 . 0 0 "[ . 1 . 2]" 1
1997 1 82 TYR QE 1 105 THR H . . 4.520 4.244 4.011 4.497 . 0 0 "[ . 1 . 2]" 1
1998 1 82 TYR QE 1 105 THR HG1 . . 4.610 2.994 2.666 3.778 . 0 0 "[ . 1 . 2]" 1
1999 1 82 TYR QE 1 105 THR MG . . 3.380 2.553 2.147 2.914 . 0 0 "[ . 1 . 2]" 1
2000 1 83 ASP H 1 83 ASP HB2 . . 3.840 2.649 2.189 3.608 . 0 0 "[ . 1 . 2]" 1
2001 1 83 ASP H 1 83 ASP QB . . 3.270 2.377 2.168 2.826 . 0 0 "[ . 1 . 2]" 1
2002 1 83 ASP H 1 83 ASP HB3 . . 3.840 3.339 2.297 3.602 . 0 0 "[ . 1 . 2]" 1
2003 1 83 ASP H 1 84 ILE H . . 4.780 4.622 4.614 4.628 . 0 0 "[ . 1 . 2]" 1
2004 1 83 ASP H 1 84 ILE MD . . 5.500 5.461 5.352 5.500 . 0 0 "[ . 1 . 2]" 1
2005 1 83 ASP H 1 102 ILE HG12 . . 4.690 4.369 3.915 4.591 . 0 0 "[ . 1 . 2]" 1
2006 1 83 ASP HA 1 84 ILE H . . 2.970 2.293 2.261 2.310 . 0 0 "[ . 1 . 2]" 1
2007 1 83 ASP HA 1 84 ILE HB . . 4.530 4.495 4.462 4.526 . 0 0 "[ . 1 . 2]" 1
2008 1 83 ASP HA 1 84 ILE MD . . 4.550 4.389 4.267 4.511 . 0 0 "[ . 1 . 2]" 1
2009 1 83 ASP HA 1 100 VAL MG1 . . 3.770 3.167 3.028 3.335 . 0 0 "[ . 1 . 2]" 1
2010 1 83 ASP HA 1 101 MET H . . 4.930 4.788 4.590 4.934 0.004 3 0 "[ . 1 . 2]" 1
2011 1 83 ASP HA 1 102 ILE HA . . 3.830 2.538 2.379 2.705 . 0 0 "[ . 1 . 2]" 1
2012 1 83 ASP HA 1 102 ILE MD . . 4.460 4.288 3.916 4.450 . 0 0 "[ . 1 . 2]" 1
2013 1 83 ASP HA 1 102 ILE HG12 . . 4.380 2.730 2.271 2.934 . 0 0 "[ . 1 . 2]" 1
2014 1 83 ASP HA 1 102 ILE HG13 . . 4.610 3.501 3.095 3.705 . 0 0 "[ . 1 . 2]" 1
2015 1 83 ASP HA 1 102 ILE MG . . 4.120 3.695 3.371 3.968 . 0 0 "[ . 1 . 2]" 1
2016 1 83 ASP HA 1 103 CYS H . . 4.060 4.002 3.916 4.060 . 20 0 "[ . 1 . 2]" 1
2017 1 83 ASP QB 1 84 ILE H . . 3.600 2.690 2.641 2.804 . 0 0 "[ . 1 . 2]" 1
2018 1 83 ASP QB 1 84 ILE HA . . 5.340 4.061 3.947 4.549 . 0 0 "[ . 1 . 2]" 1
2019 1 83 ASP QB 1 100 VAL MG1 . . 3.240 1.949 1.794 2.203 . 0 0 "[ . 1 . 2]" 1
2020 1 83 ASP QB 1 102 ILE HG12 . . 5.260 3.822 2.904 4.282 . 0 0 "[ . 1 . 2]" 1
2021 1 83 ASP HB2 1 84 ILE H . . 4.100 3.649 2.693 4.043 . 0 0 "[ . 1 . 2]" 1
2022 1 83 ASP HB2 1 100 VAL MG1 . . 3.750 2.975 1.820 3.442 . 0 0 "[ . 1 . 2]" 1
2023 1 83 ASP HB3 1 84 ILE H . . 4.100 3.026 2.687 4.116 0.016 6 0 "[ . 1 . 2]" 1
2024 1 83 ASP HB3 1 100 VAL MG1 . . 3.750 2.187 1.862 3.108 . 0 0 "[ . 1 . 2]" 1
2025 1 84 ILE H 1 84 ILE HB . . 3.390 2.829 2.777 2.868 . 0 0 "[ . 1 . 2]" 1
2026 1 84 ILE H 1 84 ILE MD . . 4.090 3.974 3.893 4.099 0.009 6 0 "[ . 1 . 2]" 1
2027 1 84 ILE H 1 84 ILE HG12 . . 4.580 4.375 4.320 4.439 . 0 0 "[ . 1 . 2]" 1
2028 1 84 ILE H 1 84 ILE HG13 . . 3.660 3.104 3.047 3.163 . 0 0 "[ . 1 . 2]" 1
2029 1 84 ILE H 1 100 VAL HB . . 5.500 5.417 5.056 5.503 0.003 9 0 "[ . 1 . 2]" 1
2030 1 84 ILE H 1 100 VAL MG1 . . 3.360 2.651 2.357 2.840 . 0 0 "[ . 1 . 2]" 1
2031 1 84 ILE H 1 101 MET H . . 3.770 2.926 2.763 3.040 . 0 0 "[ . 1 . 2]" 1
2032 1 84 ILE H 1 102 ILE HG12 . . 4.710 4.517 4.148 4.710 . 0 0 "[ . 1 . 2]" 1
2033 1 84 ILE HA 1 84 ILE MD . . 4.000 3.880 3.863 3.890 . 0 0 "[ . 1 . 2]" 1
2034 1 84 ILE HA 1 84 ILE HG12 . . 3.930 2.758 2.694 2.813 . 0 0 "[ . 1 . 2]" 1
2035 1 84 ILE HA 1 84 ILE HG13 . . 3.940 2.747 2.660 2.832 . 0 0 "[ . 1 . 2]" 1
2036 1 84 ILE HA 1 84 ILE MG . . 3.310 2.380 2.293 2.457 . 0 0 "[ . 1 . 2]" 1
2037 1 84 ILE HA 1 85 LYS H . . 3.010 2.182 2.140 2.281 . 0 0 "[ . 1 . 2]" 1
2038 1 84 ILE HB 1 84 ILE MD . . 3.050 2.146 2.098 2.181 . 0 0 "[ . 1 . 2]" 1
2039 1 84 ILE HB 1 101 MET H . . 4.550 3.733 3.393 3.900 . 0 0 "[ . 1 . 2]" 1
2040 1 84 ILE HB 1 101 MET HB3 . . 4.700 4.358 4.244 4.515 . 0 0 "[ . 1 . 2]" 1
2041 1 84 ILE HB 1 103 CYS H . . 3.940 3.831 3.725 3.931 . 0 0 "[ . 1 . 2]" 1
2042 1 84 ILE MD 1 84 ILE MG . . 2.610 2.380 2.283 2.512 . 0 0 "[ . 1 . 2]" 1
2043 1 84 ILE MD 1 101 MET HB3 . . 4.820 4.712 4.603 4.821 0.001 20 0 "[ . 1 . 2]" 1
2044 1 84 ILE MD 1 103 CYS H . . 4.080 2.406 2.117 2.626 . 0 0 "[ . 1 . 2]" 1
2045 1 84 ILE MD 1 103 CYS HA . . 4.370 4.108 3.899 4.320 . 0 0 "[ . 1 . 2]" 1
2046 1 84 ILE MD 1 103 CYS HB2 . . 3.510 2.604 2.385 2.912 . 0 0 "[ . 1 . 2]" 1
2047 1 84 ILE MD 1 103 CYS QB . . 3.040 1.999 1.881 2.184 . 0 0 "[ . 1 . 2]" 1
2048 1 84 ILE MD 1 103 CYS HB3 . . 3.510 2.081 1.948 2.297 . 0 0 "[ . 1 . 2]" 1
2049 1 84 ILE MD 1 105 THR H . . 5.500 5.427 5.281 5.504 0.004 3 0 "[ . 1 . 2]" 1
2050 1 84 ILE HG13 1 84 ILE MG . . 3.300 3.158 3.127 3.181 . 0 0 "[ . 1 . 2]" 1
2051 1 84 ILE HG13 1 103 CYS QB . . 4.500 4.168 4.044 4.289 . 0 0 "[ . 1 . 2]" 1
2052 1 84 ILE MG 1 85 LYS H . . 3.150 2.350 1.987 2.860 . 0 0 "[ . 1 . 2]" 1
2053 1 84 ILE MG 1 86 MET H . . 5.500 4.890 4.750 5.099 . 0 0 "[ . 1 . 2]" 1
2054 1 84 ILE MG 1 101 MET H . . 4.540 4.314 4.009 4.440 . 0 0 "[ . 1 . 2]" 1
2055 1 84 ILE MG 1 101 MET HB3 . . 5.190 5.082 4.982 5.196 0.006 4 0 "[ . 1 . 2]" 1
2056 1 84 ILE MG 1 101 MET QG . . 5.050 4.688 4.453 4.905 . 0 0 "[ . 1 . 2]" 1
2057 1 85 LYS H 1 85 LYS HB3 . . 3.900 3.164 3.049 3.394 . 0 0 "[ . 1 . 2]" 1
2058 1 85 LYS H 1 85 LYS HG2 . . 3.970 2.726 2.357 2.971 . 0 0 "[ . 1 . 2]" 1
2059 1 85 LYS H 1 85 LYS QG . . 3.440 2.608 2.294 2.810 . 0 0 "[ . 1 . 2]" 1
2060 1 85 LYS H 1 85 LYS HG3 . . 3.970 3.393 2.999 3.776 . 0 0 "[ . 1 . 2]" 1
2061 1 85 LYS H 1 86 MET H . . 4.620 4.407 4.379 4.441 . 0 0 "[ . 1 . 2]" 1
2062 1 85 LYS HB2 1 86 MET H . . 3.950 2.387 2.180 2.634 . 0 0 "[ . 1 . 2]" 1
2063 1 85 LYS HB2 1 100 VAL HA . . 4.890 3.730 3.525 3.977 . 0 0 "[ . 1 . 2]" 1
2064 1 85 LYS HB2 1 100 VAL MG2 . . 4.190 3.727 3.375 4.160 . 0 0 "[ . 1 . 2]" 1
2065 1 85 LYS HB3 1 86 MET H . . 3.980 3.807 3.662 3.974 . 0 0 "[ . 1 . 2]" 1
2066 1 85 LYS HB3 1 100 VAL H . . 5.380 5.248 4.943 5.383 0.003 19 0 "[ . 1 . 2]" 1
2067 1 85 LYS HB3 1 100 VAL MG1 . . 3.790 3.529 3.251 3.786 . 0 0 "[ . 1 . 2]" 1
2068 1 85 LYS HB3 1 100 VAL MG2 . . 3.500 2.965 2.634 3.296 . 0 0 "[ . 1 . 2]" 1
2069 1 85 LYS HD2 1 97 PHE HB2 . . 5.320 4.807 3.630 5.312 . 0 0 "[ . 1 . 2]" 1
2070 1 85 LYS HD2 1 97 PHE HB3 . . 5.100 3.200 2.299 3.827 . 0 0 "[ . 1 . 2]" 1
2071 1 85 LYS HD2 1 97 PHE QD . . 5.190 2.280 2.004 2.738 . 0 0 "[ . 1 . 2]" 1
2072 1 85 LYS HD2 1 97 PHE QE . . 4.970 3.737 2.933 4.561 . 0 0 "[ . 1 . 2]" 1
2073 1 85 LYS HD3 1 86 MET H . . 5.500 4.535 3.584 5.270 . 0 0 "[ . 1 . 2]" 1
2074 1 85 LYS HD3 1 97 PHE QD . . 5.260 3.098 2.395 4.285 . 0 0 "[ . 1 . 2]" 1
2075 1 85 LYS HD3 1 100 VAL MG2 . . 3.870 3.360 2.889 3.868 . 0 0 "[ . 1 . 2]" 1
2076 1 85 LYS QE 1 97 PHE QD . . 4.520 2.782 2.003 4.020 . 0 0 "[ . 1 . 2]" 1
2077 1 85 LYS QE 1 97 PHE QE . . 4.800 3.361 2.182 4.700 . 0 0 "[ . 1 . 2]" 1
2078 1 85 LYS HE2 1 97 PHE QD . . 5.260 3.531 2.118 4.931 . 0 0 "[ . 1 . 2]" 1
2079 1 85 LYS HE3 1 97 PHE QD . . 5.260 3.427 2.014 4.277 . 0 0 "[ . 1 . 2]" 1
2080 1 85 LYS QG 1 86 MET H . . 4.490 3.053 2.624 3.418 . 0 0 "[ . 1 . 2]" 1
2081 1 85 LYS QG 1 97 PHE QD . . 4.370 3.896 2.550 4.365 . 0 0 "[ . 1 . 2]" 1
2082 1 86 MET H 1 86 MET ME . . 5.010 4.818 4.685 5.024 0.014 1 0 "[ . 1 . 2]" 1
2083 1 86 MET H 1 86 MET HG2 . . 4.470 3.050 2.662 3.992 . 0 0 "[ . 1 . 2]" 1
2084 1 86 MET H 1 86 MET QG . . 3.760 2.574 2.416 2.807 . 0 0 "[ . 1 . 2]" 1
2085 1 86 MET H 1 86 MET HG3 . . 4.470 2.927 2.440 3.322 . 0 0 "[ . 1 . 2]" 1
2086 1 86 MET H 1 87 GLN HA . . 4.850 4.823 4.763 4.860 0.010 10 0 "[ . 1 . 2]" 1
2087 1 86 MET H 1 98 SER H . . 3.760 3.657 3.227 3.761 0.001 17 0 "[ . 1 . 2]" 1
2088 1 86 MET H 1 98 SER QB . . 4.390 2.620 1.892 3.505 . 0 0 "[ . 1 . 2]" 1
2089 1 86 MET H 1 98 SER HG . . 3.650 2.730 1.900 3.653 0.003 19 0 "[ . 1 . 2]" 1
2090 1 86 MET H 1 99 ASN H . . 5.180 5.089 4.831 5.185 0.005 3 0 "[ . 1 . 2]" 1
2091 1 86 MET HA 1 86 MET ME . . 4.340 3.938 3.749 4.115 . 0 0 "[ . 1 . 2]" 1
2092 1 86 MET HA 1 87 GLN H . . 3.210 2.492 2.340 2.560 . 0 0 "[ . 1 . 2]" 1
2093 1 86 MET QB 1 86 MET ME . . 2.980 1.943 1.895 2.121 . 0 0 "[ . 1 . 2]" 1
2094 1 86 MET QB 1 98 SER QB . . 4.540 4.157 3.762 4.558 0.018 12 0 "[ . 1 . 2]" 1
2095 1 86 MET HB2 1 86 MET ME . . 3.460 1.964 1.911 2.147 . 0 0 "[ . 1 . 2]" 1
2096 1 86 MET HB2 1 87 GLN H . . 4.410 2.290 2.115 2.620 . 0 0 "[ . 1 . 2]" 1
2097 1 86 MET HB3 1 86 MET ME . . 3.460 3.081 2.933 3.300 . 0 0 "[ . 1 . 2]" 1
2098 1 86 MET HB3 1 87 GLN H . . 4.410 3.712 3.570 3.927 . 0 0 "[ . 1 . 2]" 1
2099 1 86 MET ME 1 87 GLN H . . 3.930 2.798 2.448 3.055 . 0 0 "[ . 1 . 2]" 1
2100 1 86 MET ME 1 88 CYS HA . . 4.520 4.058 3.663 4.249 . 0 0 "[ . 1 . 2]" 1
2101 1 86 MET ME 1 88 CYS QB . . 4.390 3.806 3.662 4.092 . 0 0 "[ . 1 . 2]" 1
2102 1 86 MET QG 1 87 GLN H . . 4.330 3.472 3.221 4.069 . 0 0 "[ . 1 . 2]" 1
2103 1 86 MET QG 1 98 SER QB . . 4.380 2.511 2.227 2.953 . 0 0 "[ . 1 . 2]" 1
2104 1 86 MET HG2 1 87 GLN H . . 4.980 4.599 4.330 4.883 . 0 0 "[ . 1 . 2]" 1
2105 1 86 MET HG2 1 98 SER QB . . 4.990 3.452 2.924 4.444 . 0 0 "[ . 1 . 2]" 1
2106 1 86 MET HG3 1 87 GLN H . . 4.980 3.605 3.303 4.354 . 0 0 "[ . 1 . 2]" 1
2107 1 86 MET HG3 1 98 SER QB . . 4.990 2.590 2.309 2.997 . 0 0 "[ . 1 . 2]" 1
2108 1 87 GLN H 1 87 GLN QB . . 3.340 2.819 2.646 3.156 . 0 0 "[ . 1 . 2]" 1
2109 1 87 GLN H 1 88 CYS HA . . 4.840 4.587 4.531 4.707 . 0 0 "[ . 1 . 2]" 1
2110 1 87 GLN HA 1 88 CYS H . . 3.360 2.258 2.209 2.526 . 0 0 "[ . 1 . 2]" 1
2111 1 87 GLN HA 1 95 SER H . . 5.500 5.478 5.409 5.502 0.002 5 0 "[ . 1 . 2]" 1
2112 1 87 GLN HA 1 98 SER H . . 3.860 3.346 3.179 3.642 . 0 0 "[ . 1 . 2]" 1
2113 1 87 GLN HA 1 98 SER QB . . 4.050 3.280 3.029 3.797 . 0 0 "[ . 1 . 2]" 1
2114 1 87 GLN QB 1 87 GLN HE22 . . 4.690 3.628 3.432 4.287 . 0 0 "[ . 1 . 2]" 1
2115 1 87 GLN QB 1 88 CYS H . . 3.700 3.446 2.180 3.598 . 0 0 "[ . 1 . 2]" 1
2116 1 87 GLN QB 1 95 SER H . . 5.500 4.691 3.178 4.906 . 0 0 "[ . 1 . 2]" 1
2117 1 87 GLN QB 1 95 SER QB . . 5.340 4.985 3.916 5.341 0.001 20 0 "[ . 1 . 2]" 1
2118 1 87 GLN QE 1 94 GLU QB . . 3.720 2.276 1.787 3.036 . 0 0 "[ . 1 . 2]" 1
2119 1 87 GLN HE21 1 94 GLU QB . . 4.240 2.915 1.916 4.067 . 0 0 "[ . 1 . 2]" 1
2120 1 87 GLN HE21 1 95 SER H . . 5.040 3.906 1.802 4.877 . 0 0 "[ . 1 . 2]" 1
2121 1 87 GLN HE22 1 94 GLU QB . . 4.240 2.429 1.888 3.229 . 0 0 "[ . 1 . 2]" 1
2122 1 87 GLN HE22 1 95 SER H . . 5.040 4.201 2.379 4.945 . 0 0 "[ . 1 . 2]" 1
2123 1 87 GLN QG 1 88 CYS H . . 4.490 2.292 2.055 3.877 . 0 0 "[ . 1 . 2]" 1
2124 1 87 GLN QG 1 95 SER H . . 3.650 2.757 2.579 3.655 0.005 7 0 "[ . 1 . 2]" 1
2125 1 87 GLN QG 1 95 SER HG . . 4.970 3.018 1.839 4.205 . 0 0 "[ . 1 . 2]" 1
2126 1 87 GLN QG 1 97 PHE H . . 5.110 4.722 4.370 5.111 0.001 7 0 "[ . 1 . 2]" 1
2127 1 87 GLN QG 1 97 PHE QD . . 4.330 4.100 3.182 4.332 0.002 19 0 "[ . 1 . 2]" 1
2128 1 87 GLN QG 1 97 PHE QE . . 5.100 4.631 3.168 5.029 . 0 0 "[ . 1 . 2]" 1
2129 1 87 GLN QG 1 98 SER H . . 4.370 4.158 3.822 4.371 0.001 7 0 "[ . 1 . 2]" 1
2130 1 88 CYS H 1 95 SER H . . 4.050 3.954 3.771 4.057 0.007 5 0 "[ . 1 . 2]" 1
2131 1 88 CYS H 1 95 SER HB2 . . 4.640 4.329 4.009 4.609 . 0 0 "[ . 1 . 2]" 1
2132 1 88 CYS H 1 95 SER QB . . 3.890 3.383 2.643 3.811 . 0 0 "[ . 1 . 2]" 1
2133 1 88 CYS H 1 95 SER HB3 . . 4.640 3.591 2.681 4.277 . 0 0 "[ . 1 . 2]" 1
2134 1 88 CYS H 1 95 SER HG . . 4.270 2.835 1.900 4.190 . 0 0 "[ . 1 . 2]" 1
2135 1 88 CYS H 1 96 GLU H . . 5.500 5.461 5.298 5.503 0.003 7 0 "[ . 1 . 2]" 1
2136 1 88 CYS HA 1 89 PHE H . . 3.340 2.378 2.222 2.462 . 0 0 "[ . 1 . 2]" 1
2137 1 88 CYS QB 1 89 PHE H . . 3.400 2.589 2.477 2.932 . 0 0 "[ . 1 . 2]" 1
2138 1 88 CYS HB2 1 89 PHE H . . 4.160 2.625 2.506 2.995 . 0 0 "[ . 1 . 2]" 1
2139 1 88 CYS HB3 1 89 PHE H . . 4.160 3.965 3.891 4.176 0.016 7 0 "[ . 1 . 2]" 1
2140 1 89 PHE H 1 89 PHE HB3 . . 3.670 3.251 3.016 3.379 . 0 0 "[ . 1 . 2]" 1
2141 1 89 PHE H 1 89 PHE QD . . 3.700 2.303 2.105 2.809 . 0 0 "[ . 1 . 2]" 1
2142 1 89 PHE H 1 89 PHE QE . . 4.720 4.132 3.976 4.295 . 0 0 "[ . 1 . 2]" 1
2143 1 89 PHE H 1 90 ASN H . . 4.460 4.392 4.352 4.451 . 0 0 "[ . 1 . 2]" 1
2144 1 89 PHE H 1 95 SER H . . 5.500 4.801 4.656 5.108 . 0 0 "[ . 1 . 2]" 1
2145 1 89 PHE HA 1 89 PHE QD . . 4.340 3.698 3.669 3.728 . 0 0 "[ . 1 . 2]" 1
2146 1 89 PHE HA 1 90 ASN H . . 3.130 2.401 2.297 2.568 . 0 0 "[ . 1 . 2]" 1
2147 1 89 PHE HA 1 93 GLY H . . 5.140 4.621 4.272 4.811 . 0 0 "[ . 1 . 2]" 1
2148 1 89 PHE HA 1 94 GLU H . . 4.980 4.609 4.355 4.861 . 0 0 "[ . 1 . 2]" 1
2149 1 89 PHE HA 1 94 GLU HA . . 3.910 2.174 1.994 2.397 . 0 0 "[ . 1 . 2]" 1
2150 1 89 PHE HA 1 94 GLU HG3 . . 4.580 4.139 3.445 4.582 0.002 7 0 "[ . 1 . 2]" 1
2151 1 89 PHE HA 1 95 SER H . . 4.060 3.012 2.811 3.587 . 0 0 "[ . 1 . 2]" 1
2152 1 89 PHE HB2 1 90 ASN H . . 3.380 2.505 2.188 2.771 . 0 0 "[ . 1 . 2]" 1
2153 1 89 PHE HB2 1 94 GLU H . . 4.980 4.079 3.451 4.674 . 0 0 "[ . 1 . 2]" 1
2154 1 89 PHE HB2 1 94 GLU HA . . 4.530 2.596 2.128 2.949 . 0 0 "[ . 1 . 2]" 1
2155 1 89 PHE HB2 1 94 GLU HG2 . . 4.430 3.131 2.892 3.666 . 0 0 "[ . 1 . 2]" 1
2156 1 89 PHE HB2 1 94 GLU HG3 . . 4.240 2.639 2.034 3.286 . 0 0 "[ . 1 . 2]" 1
2157 1 89 PHE HB2 1 95 SER H . . 4.830 4.470 4.220 4.703 . 0 0 "[ . 1 . 2]" 1
2158 1 89 PHE HB3 1 90 ASN H . . 4.130 3.872 3.680 4.051 . 0 0 "[ . 1 . 2]" 1
2159 1 89 PHE HB3 1 94 GLU HA . . 4.430 2.652 2.071 2.957 . 0 0 "[ . 1 . 2]" 1
2160 1 89 PHE HB3 1 94 GLU HG2 . . 4.180 2.444 2.102 3.382 . 0 0 "[ . 1 . 2]" 1
2161 1 89 PHE HB3 1 94 GLU HG3 . . 3.960 2.996 2.159 3.473 . 0 0 "[ . 1 . 2]" 1
2162 1 89 PHE HB3 1 95 SER H . . 4.460 3.758 3.338 3.955 . 0 0 "[ . 1 . 2]" 1
2163 1 89 PHE QD 1 90 ASN H . . 3.770 3.391 2.886 3.659 . 0 0 "[ . 1 . 2]" 1
2164 1 89 PHE QD 1 90 ASN HA . . 4.360 3.823 3.248 4.112 . 0 0 "[ . 1 . 2]" 1
2165 1 89 PHE QD 1 95 SER H . . 5.500 5.316 4.922 5.501 0.001 3 0 "[ . 1 . 2]" 1
2166 1 90 ASN H 1 92 GLY H . . 4.450 4.286 4.121 4.438 . 0 0 "[ . 1 . 2]" 1
2167 1 90 ASN H 1 93 GLY H . . 3.450 2.870 2.662 3.155 . 0 0 "[ . 1 . 2]" 1
2168 1 90 ASN H 1 94 GLU H . . 4.890 4.508 4.128 4.845 . 0 0 "[ . 1 . 2]" 1
2169 1 90 ASN H 1 94 GLU HA . . 3.980 3.454 3.191 3.663 . 0 0 "[ . 1 . 2]" 1
2170 1 90 ASN H 1 94 GLU QB . . 5.500 5.311 5.014 5.501 0.001 20 0 "[ . 1 . 2]" 1
2171 1 90 ASN H 1 94 GLU HG2 . . 5.500 5.306 5.068 5.506 0.006 5 0 "[ . 1 . 2]" 1
2172 1 90 ASN H 1 94 GLU HG3 . . 5.070 4.510 3.750 4.949 . 0 0 "[ . 1 . 2]" 1
2173 1 90 ASN QB 1 91 GLU H . . 3.770 2.616 2.299 3.315 . 0 0 "[ . 1 . 2]" 1
2174 1 90 ASN QB 1 91 GLU QB . . 4.990 4.173 3.822 4.828 . 0 0 "[ . 1 . 2]" 1
2175 1 90 ASN QB 1 92 GLY H . . 4.440 3.360 3.041 3.529 . 0 0 "[ . 1 . 2]" 1
2176 1 90 ASN QB 1 93 GLY H . . 4.840 3.894 2.993 4.314 . 0 0 "[ . 1 . 2]" 1
2177 1 90 ASN QD 1 91 GLU H . . 5.090 3.628 3.273 4.248 . 0 0 "[ . 1 . 2]" 1
2178 1 90 ASN QD 1 92 GLY H . . 3.330 2.563 2.061 2.845 . 0 0 "[ . 1 . 2]" 1
2179 1 91 GLU H 1 91 GLU QB . . 3.760 2.322 2.160 2.534 . 0 0 "[ . 1 . 2]" 1
2180 1 91 GLU H 1 91 GLU QG . . 4.360 3.414 2.113 4.066 . 0 0 "[ . 1 . 2]" 1
2181 1 91 GLU H 1 92 GLY H . . 3.910 2.925 2.807 3.011 . 0 0 "[ . 1 . 2]" 1
2182 1 91 GLU H 1 93 GLY H . . 5.500 4.665 4.333 5.051 . 0 0 "[ . 1 . 2]" 1
2183 1 91 GLU HA 1 91 GLU HG2 . . 3.950 3.551 2.797 3.886 . 0 0 "[ . 1 . 2]" 1
2184 1 91 GLU HA 1 91 GLU QG . . 3.460 2.894 2.347 3.339 . 0 0 "[ . 1 . 2]" 1
2185 1 91 GLU HA 1 91 GLU HG3 . . 3.950 3.123 2.410 3.862 . 0 0 "[ . 1 . 2]" 1
2186 1 91 GLU QB 1 92 GLY H . . 3.910 2.981 2.633 3.509 . 0 0 "[ . 1 . 2]" 1
2187 1 91 GLU QB 1 93 GLY H . . 5.360 5.189 4.947 5.360 0.000 9 0 "[ . 1 . 2]" 1
2188 1 91 GLU QG 1 92 GLY H . . 4.030 3.099 1.991 4.009 . 0 0 "[ . 1 . 2]" 1
2189 1 92 GLY H 1 93 GLY H . . 2.990 2.737 2.567 2.901 . 0 0 "[ . 1 . 2]" 1
2190 1 92 GLY H 1 93 GLY HA2 . . 5.500 4.993 4.949 5.057 . 0 0 "[ . 1 . 2]" 1
2191 1 92 GLY H 1 93 GLY QA . . 4.760 4.579 4.518 4.644 . 0 0 "[ . 1 . 2]" 1
2192 1 92 GLY H 1 93 GLY HA3 . . 5.500 5.323 5.210 5.415 . 0 0 "[ . 1 . 2]" 1
2193 1 92 GLY QA 1 93 GLY QA . . 5.180 3.660 3.627 3.690 . 0 0 "[ . 1 . 2]" 1
2194 1 93 GLY H 1 94 GLU H . . 4.410 4.331 4.077 4.416 0.006 13 0 "[ . 1 . 2]" 1
2195 1 93 GLY HA2 1 94 GLU H . . 3.040 2.462 2.212 2.706 . 0 0 "[ . 1 . 2]" 1
2196 1 93 GLY HA3 1 94 GLU H . . 3.040 2.684 2.429 3.011 . 0 0 "[ . 1 . 2]" 1
2197 1 94 GLU H 1 94 GLU QB . . 3.170 2.317 2.192 2.539 . 0 0 "[ . 1 . 2]" 1
2198 1 94 GLU H 1 94 GLU HG2 . . 4.170 3.959 3.538 4.169 . 0 0 "[ . 1 . 2]" 1
2199 1 94 GLU H 1 94 GLU HG3 . . 3.780 2.705 2.032 3.261 . 0 0 "[ . 1 . 2]" 1
2200 1 94 GLU H 1 95 SER H . . 4.630 4.608 4.565 4.645 0.015 6 0 "[ . 1 . 2]" 1
2201 1 94 GLU HA 1 94 GLU HG2 . . 3.980 2.790 2.499 3.540 . 0 0 "[ . 1 . 2]" 1
2202 1 94 GLU HA 1 94 GLU HG3 . . 3.840 2.612 2.374 2.856 . 0 0 "[ . 1 . 2]" 1
2203 1 94 GLU HA 1 95 SER H . . 3.190 2.281 2.194 2.559 . 0 0 "[ . 1 . 2]" 1
2204 1 94 GLU QB 1 95 SER H . . 3.700 2.742 2.126 2.995 . 0 0 "[ . 1 . 2]" 1
2205 1 94 GLU HG2 1 95 SER H . . 4.470 3.958 3.554 4.477 0.007 5 0 "[ . 1 . 2]" 1
2206 1 94 GLU HG3 1 95 SER H . . 4.770 4.522 4.132 4.745 . 0 0 "[ . 1 . 2]" 1
2207 1 95 SER H 1 95 SER HB2 . . 3.960 3.409 2.678 3.853 . 0 0 "[ . 1 . 2]" 1
2208 1 95 SER H 1 95 SER QB . . 3.300 2.512 2.295 2.946 . 0 0 "[ . 1 . 2]" 1
2209 1 95 SER H 1 95 SER HB3 . . 3.960 2.606 2.382 3.058 . 0 0 "[ . 1 . 2]" 1
2210 1 95 SER H 1 95 SER HG . . 4.610 3.449 2.141 4.516 . 0 0 "[ . 1 . 2]" 1
2211 1 95 SER HA 1 96 GLU H . . 3.360 2.621 2.490 2.653 . 0 0 "[ . 1 . 2]" 1
2212 1 95 SER QB 1 96 GLU H . . 3.200 2.387 1.975 2.993 . 0 0 "[ . 1 . 2]" 1
2213 1 95 SER HB2 1 96 GLU H . . 3.820 2.580 1.985 3.685 . 0 0 "[ . 1 . 2]" 1
2214 1 95 SER HB3 1 96 GLU H . . 3.820 3.497 3.105 3.777 . 0 0 "[ . 1 . 2]" 1
2215 1 95 SER HG 1 96 GLU H . . 4.190 3.088 1.902 4.098 . 0 0 "[ . 1 . 2]" 1
2216 1 96 GLU H 1 96 GLU HB2 . . 3.740 2.477 2.370 2.619 . 0 0 "[ . 1 . 2]" 1
2217 1 96 GLU H 1 96 GLU HB3 . . 3.600 3.589 3.578 3.600 0.000 7 0 "[ . 1 . 2]" 1
2218 1 96 GLU H 1 96 GLU HG2 . . 3.660 2.622 1.999 3.401 . 0 0 "[ . 1 . 2]" 1
2219 1 96 GLU H 1 96 GLU HG3 . . 3.660 3.047 2.002 3.568 . 0 0 "[ . 1 . 2]" 1
2220 1 96 GLU H 1 97 PHE H . . 4.830 4.622 4.605 4.649 . 0 0 "[ . 1 . 2]" 1
2221 1 96 GLU HA 1 96 GLU HG2 . . 3.920 2.701 2.323 3.013 . 0 0 "[ . 1 . 2]" 1
2222 1 96 GLU HA 1 96 GLU QG . . 3.410 2.621 2.281 2.899 . 0 0 "[ . 1 . 2]" 1
2223 1 96 GLU HA 1 96 GLU HG3 . . 3.920 3.570 3.098 3.814 . 0 0 "[ . 1 . 2]" 1
2224 1 96 GLU HA 1 97 PHE H . . 2.950 2.418 2.355 2.501 . 0 0 "[ . 1 . 2]" 1
2225 1 96 GLU HA 1 97 PHE HB2 . . 4.720 4.580 4.481 4.662 . 0 0 "[ . 1 . 2]" 1
2226 1 96 GLU HB2 1 97 PHE H . . 3.710 3.601 3.406 3.704 . 0 0 "[ . 1 . 2]" 1
2227 1 96 GLU HB3 1 97 PHE H . . 3.670 2.395 2.224 2.542 . 0 0 "[ . 1 . 2]" 1
2228 1 96 GLU HG2 1 97 PHE H . . 4.890 4.464 3.900 4.854 . 0 0 "[ . 1 . 2]" 1
2229 1 96 GLU HG3 1 97 PHE H . . 4.890 4.858 4.785 4.898 0.008 12 0 "[ . 1 . 2]" 1
2230 1 97 PHE H 1 97 PHE HB2 . . 3.310 2.272 2.198 2.353 . 0 0 "[ . 1 . 2]" 1
2231 1 97 PHE H 1 97 PHE HB3 . . 3.720 3.549 3.500 3.599 . 0 0 "[ . 1 . 2]" 1
2232 1 97 PHE H 1 97 PHE QD . . 3.570 2.361 2.078 2.717 . 0 0 "[ . 1 . 2]" 1
2233 1 97 PHE H 1 97 PHE QE . . 4.890 4.653 4.426 4.873 . 0 0 "[ . 1 . 2]" 1
2234 1 97 PHE H 1 98 SER H . . 4.550 4.439 4.368 4.529 . 0 0 "[ . 1 . 2]" 1
2235 1 97 PHE HB2 1 98 SER H . . 4.590 4.429 4.361 4.506 . 0 0 "[ . 1 . 2]" 1
2236 1 97 PHE HB3 1 98 SER H . . 3.900 3.529 3.321 3.690 . 0 0 "[ . 1 . 2]" 1
2237 1 97 PHE QD 1 98 SER H . . 4.530 4.404 3.983 4.531 0.001 3 0 "[ . 1 . 2]" 1
2238 1 98 SER H 1 98 SER QB . . 3.780 2.287 2.231 2.493 . 0 0 "[ . 1 . 2]" 1
2239 1 98 SER H 1 98 SER HG . . 4.490 3.798 2.557 4.472 . 0 0 "[ . 1 . 2]" 1
2240 1 98 SER QB 1 99 ASN H . . 3.580 2.662 2.009 3.306 . 0 0 "[ . 1 . 2]" 1
2241 1 98 SER HG 1 99 ASN H . . 3.680 3.050 2.318 3.680 . 0 0 "[ . 1 . 2]" 1
2242 1 99 ASN H 1 99 ASN HB2 . . 3.710 3.554 3.507 3.602 . 0 0 "[ . 1 . 2]" 1
2243 1 99 ASN H 1 99 ASN HB3 . . 3.950 2.576 2.222 2.943 . 0 0 "[ . 1 . 2]" 1
2244 1 99 ASN H 1 99 ASN HD21 . . 5.160 3.217 1.871 4.460 . 0 0 "[ . 1 . 2]" 1
2245 1 99 ASN H 1 99 ASN HD22 . . 4.960 3.887 3.568 4.344 . 0 0 "[ . 1 . 2]" 1
2246 1 99 ASN H 1 100 VAL H . . 4.830 4.601 4.567 4.636 . 0 0 "[ . 1 . 2]" 1
2247 1 99 ASN HA 1 99 ASN HD21 . . 4.770 4.162 3.690 4.597 . 0 0 "[ . 1 . 2]" 1
2248 1 99 ASN HA 1 100 VAL H . . 2.840 2.467 2.282 2.579 . 0 0 "[ . 1 . 2]" 1
2249 1 99 ASN HA 1 100 VAL HB . . 4.840 4.809 4.734 4.842 0.002 14 0 "[ . 1 . 2]" 1
2250 1 99 ASN HA 1 100 VAL MG2 . . 4.480 3.419 3.260 3.563 . 0 0 "[ . 1 . 2]" 1
2251 1 99 ASN HB2 1 100 VAL H . . 3.540 2.399 2.107 2.904 . 0 0 "[ . 1 . 2]" 1
2252 1 99 ASN HB2 1 100 VAL MG2 . . 4.700 4.474 4.293 4.683 . 0 0 "[ . 1 . 2]" 1
2253 1 99 ASN HB3 1 100 VAL H . . 4.160 3.692 3.225 4.147 . 0 0 "[ . 1 . 2]" 1
2254 1 99 ASN HD21 1 100 VAL H . . 4.660 4.186 3.612 4.660 0.000 14 0 "[ . 1 . 2]" 1
2255 1 99 ASN HD21 1 101 MET ME . . 5.430 4.404 3.713 5.268 . 0 0 "[ . 1 . 2]" 1
2256 1 99 ASN HD21 1 101 MET QG . . 4.280 2.959 2.091 3.660 . 0 0 "[ . 1 . 2]" 1
2257 1 99 ASN HD22 1 100 VAL H . . 5.230 5.105 4.872 5.227 . 0 0 "[ . 1 . 2]" 1
2258 1 99 ASN HD22 1 101 MET ME . . 4.070 3.592 3.282 3.970 . 0 0 "[ . 1 . 2]" 1
2259 1 99 ASN HD22 1 101 MET QG . . 4.400 2.525 1.961 3.161 . 0 0 "[ . 1 . 2]" 1
2260 1 100 VAL H 1 100 VAL HB . . 3.060 2.570 2.506 2.624 . 0 0 "[ . 1 . 2]" 1
2261 1 100 VAL H 1 100 VAL MG1 . . 3.840 3.817 3.777 3.846 0.006 15 0 "[ . 1 . 2]" 1
2262 1 100 VAL H 1 100 VAL MG2 . . 3.160 2.513 2.150 2.748 . 0 0 "[ . 1 . 2]" 1
2263 1 100 VAL H 1 101 MET H . . 4.420 4.335 4.225 4.421 0.001 14 0 "[ . 1 . 2]" 1
2264 1 100 VAL HA 1 100 VAL MG2 . . 3.190 2.377 2.286 2.481 . 0 0 "[ . 1 . 2]" 1
2265 1 100 VAL HB 1 101 MET H . . 4.390 4.296 4.219 4.369 . 0 0 "[ . 1 . 2]" 1
2266 1 100 VAL HB 1 102 ILE MD . . 5.280 5.115 4.948 5.271 . 0 0 "[ . 1 . 2]" 1
2267 1 100 VAL MG1 1 101 MET H . . 3.340 2.845 2.652 3.079 . 0 0 "[ . 1 . 2]" 1
2268 1 100 VAL MG1 1 101 MET HA . . 4.190 3.810 3.725 3.988 . 0 0 "[ . 1 . 2]" 1
2269 1 100 VAL MG1 1 102 ILE H . . 4.600 4.174 4.007 4.446 . 0 0 "[ . 1 . 2]" 1
2270 1 100 VAL MG1 1 102 ILE HA . . 4.390 4.212 4.101 4.337 . 0 0 "[ . 1 . 2]" 1
2271 1 100 VAL MG1 1 102 ILE HG12 . . 3.730 3.617 3.499 3.711 . 0 0 "[ . 1 . 2]" 1
2272 1 100 VAL MG1 1 102 ILE HG13 . . 3.710 3.011 2.864 3.234 . 0 0 "[ . 1 . 2]" 1
2273 1 100 VAL MG2 1 101 MET H . . 4.380 4.130 4.064 4.204 . 0 0 "[ . 1 . 2]" 1
2274 1 101 MET H 1 101 MET HB2 . . 3.530 2.549 2.477 2.638 . 0 0 "[ . 1 . 2]" 1
2275 1 101 MET H 1 101 MET QG . . 3.810 2.708 2.540 2.890 . 0 0 "[ . 1 . 2]" 1
2276 1 101 MET H 1 102 ILE H . . 4.580 4.385 4.294 4.482 . 0 0 "[ . 1 . 2]" 1
2277 1 101 MET HA 1 101 MET QG . . 3.890 2.883 2.801 2.941 . 0 0 "[ . 1 . 2]" 1
2278 1 101 MET HA 1 102 ILE H . . 2.790 2.150 2.141 2.179 . 0 0 "[ . 1 . 2]" 1
2279 1 101 MET HA 1 102 ILE HB . . 4.640 4.590 4.545 4.632 . 0 0 "[ . 1 . 2]" 1
2280 1 101 MET HA 1 102 ILE HG13 . . 4.590 3.788 3.604 3.902 . 0 0 "[ . 1 . 2]" 1
2281 1 101 MET HA 1 102 ILE MG . . 5.500 5.462 5.454 5.468 . 0 0 "[ . 1 . 2]" 1
2282 1 101 MET HB2 1 101 MET ME . . 4.390 3.593 3.409 3.789 . 0 0 "[ . 1 . 2]" 1
2283 1 101 MET HB2 1 102 ILE H . . 4.400 4.225 4.119 4.304 . 0 0 "[ . 1 . 2]" 1
2284 1 101 MET HB3 1 102 ILE H . . 3.450 3.339 3.126 3.440 . 0 0 "[ . 1 . 2]" 1
2285 1 101 MET HB3 1 103 CYS H . . 5.040 4.793 4.661 4.980 . 0 0 "[ . 1 . 2]" 1
2286 1 101 MET ME 1 101 MET QG . . 2.870 2.231 2.080 2.363 . 0 0 "[ . 1 . 2]" 1
2287 1 101 MET ME 1 102 ILE H . . 4.760 4.572 4.289 4.755 . 0 0 "[ . 1 . 2]" 1
2288 1 101 MET QG 1 102 ILE H . . 4.720 4.649 4.528 4.702 . 0 0 "[ . 1 . 2]" 1
2289 1 102 ILE H 1 102 ILE HB . . 3.030 2.488 2.446 2.559 . 0 0 "[ . 1 . 2]" 1
2290 1 102 ILE H 1 102 ILE MD . . 3.920 3.645 3.500 3.800 . 0 0 "[ . 1 . 2]" 1
2291 1 102 ILE H 1 102 ILE HG12 . . 4.090 3.852 3.752 3.952 . 0 0 "[ . 1 . 2]" 1
2292 1 102 ILE H 1 102 ILE HG13 . . 3.570 2.536 2.436 2.702 . 0 0 "[ . 1 . 2]" 1
2293 1 102 ILE H 1 102 ILE MG . . 3.820 3.781 3.763 3.815 . 0 0 "[ . 1 . 2]" 1
2294 1 102 ILE H 1 103 CYS H . . 4.290 4.181 4.122 4.235 . 0 0 "[ . 1 . 2]" 1
2295 1 102 ILE HA 1 102 ILE MD . . 3.880 3.858 3.836 3.880 . 0 0 "[ . 1 . 2]" 1
2296 1 102 ILE HA 1 102 ILE HG12 . . 3.770 2.618 2.548 2.690 . 0 0 "[ . 1 . 2]" 1
2297 1 102 ILE HA 1 102 ILE HG13 . . 3.890 2.855 2.741 2.902 . 0 0 "[ . 1 . 2]" 1
2298 1 102 ILE HA 1 102 ILE MG . . 3.110 2.418 2.352 2.440 . 0 0 "[ . 1 . 2]" 1
2299 1 102 ILE HA 1 103 CYS H . . 2.810 2.191 2.177 2.205 . 0 0 "[ . 1 . 2]" 1
2300 1 102 ILE HA 1 103 CYS HB2 . . 5.360 4.575 4.498 4.694 . 0 0 "[ . 1 . 2]" 1
2301 1 102 ILE HA 1 103 CYS HB3 . . 5.360 4.915 4.757 5.065 . 0 0 "[ . 1 . 2]" 1
2302 1 102 ILE HB 1 102 ILE MD . . 3.100 2.274 2.200 2.402 . 0 0 "[ . 1 . 2]" 1
2303 1 102 ILE HB 1 103 CYS H . . 4.560 4.445 4.419 4.471 . 0 0 "[ . 1 . 2]" 1
2304 1 102 ILE MD 1 103 CYS H . . 5.500 5.486 5.451 5.503 0.003 6 0 "[ . 1 . 2]" 1
2305 1 102 ILE HG12 1 102 ILE MG . . 2.830 2.189 2.119 2.266 . 0 0 "[ . 1 . 2]" 1
2306 1 102 ILE HG12 1 103 CYS H . . 4.790 4.721 4.640 4.772 . 0 0 "[ . 1 . 2]" 1
2307 1 102 ILE HG13 1 102 ILE MG . . 3.170 3.175 3.158 3.183 0.013 12 0 "[ . 1 . 2]" 1
2308 1 102 ILE HG13 1 103 CYS H . . 5.210 4.976 4.881 5.025 . 0 0 "[ . 1 . 2]" 1
2309 1 102 ILE MG 1 103 CYS H . . 3.140 3.081 3.012 3.134 . 0 0 "[ . 1 . 2]" 1
2310 1 102 ILE MG 1 103 CYS HA . . 4.430 3.772 3.663 3.885 . 0 0 "[ . 1 . 2]" 1
2311 1 102 ILE MG 1 103 CYS QB . . 5.010 4.542 4.502 4.577 . 0 0 "[ . 1 . 2]" 1
2312 1 102 ILE MG 1 104 GLU H . . 4.390 3.738 3.597 3.884 . 0 0 "[ . 1 . 2]" 1
2313 1 103 CYS H 1 103 CYS HB2 . . 3.720 2.733 2.610 2.849 . 0 0 "[ . 1 . 2]" 1
2314 1 103 CYS H 1 103 CYS QB . . 3.260 2.432 2.395 2.490 . 0 0 "[ . 1 . 2]" 1
2315 1 103 CYS H 1 103 CYS HB3 . . 3.720 2.737 2.587 2.866 . 0 0 "[ . 1 . 2]" 1
2316 1 103 CYS H 1 104 GLU H . . 4.280 4.222 4.153 4.281 0.001 4 0 "[ . 1 . 2]" 1
2317 1 103 CYS H 1 104 GLU HA . . 5.100 4.905 4.803 4.983 . 0 0 "[ . 1 . 2]" 1
2318 1 103 CYS HA 1 104 GLU H . . 2.760 2.153 2.141 2.170 . 0 0 "[ . 1 . 2]" 1
2319 1 103 CYS HA 1 104 GLU HB3 . . 5.500 4.891 4.836 4.945 . 0 0 "[ . 1 . 2]" 1
2320 1 103 CYS HB2 1 104 GLU H . . 4.550 4.508 4.444 4.561 0.011 18 0 "[ . 1 . 2]" 1
2321 1 103 CYS HB3 1 104 GLU H . . 4.550 4.259 4.166 4.365 . 0 0 "[ . 1 . 2]" 1
2322 1 104 GLU H 1 104 GLU HB2 . . 3.350 2.374 2.320 2.433 . 0 0 "[ . 1 . 2]" 1
2323 1 104 GLU H 1 104 GLU HB3 . . 3.240 2.763 2.715 2.818 . 0 0 "[ . 1 . 2]" 1
2324 1 104 GLU H 1 104 GLU HG2 . . 4.510 4.468 4.461 4.475 . 0 0 "[ . 1 . 2]" 1
2325 1 104 GLU H 1 104 GLU HG3 . . 4.440 4.365 4.305 4.424 . 0 0 "[ . 1 . 2]" 1
2326 1 104 GLU H 1 105 THR H . . 4.700 4.508 4.468 4.558 . 0 0 "[ . 1 . 2]" 1
2327 1 104 GLU HA 1 104 GLU HG2 . . 3.880 2.504 2.458 2.559 . 0 0 "[ . 1 . 2]" 1
2328 1 104 GLU HA 1 104 GLU HG3 . . 3.930 2.779 2.741 2.804 . 0 0 "[ . 1 . 2]" 1
2329 1 104 GLU HA 1 105 THR H . . 2.930 2.147 2.138 2.168 . 0 0 "[ . 1 . 2]" 1
2330 1 104 GLU HA 1 105 THR MG . . 4.210 4.082 3.907 4.184 . 0 0 "[ . 1 . 2]" 1
2331 1 104 GLU HB2 1 105 THR H . . 4.570 4.393 4.340 4.439 . 0 0 "[ . 1 . 2]" 1
2332 1 104 GLU HG2 1 105 THR H . . 3.510 2.737 2.557 2.858 . 0 0 "[ . 1 . 2]" 1
2333 1 104 GLU HG2 1 105 THR HA . . 4.930 4.825 4.714 4.926 . 0 0 "[ . 1 . 2]" 1
2334 1 104 GLU HG2 1 105 THR MG . . 5.500 4.902 4.738 5.000 . 0 0 "[ . 1 . 2]" 1
2335 1 104 GLU HG3 1 105 THR H . . 4.100 3.983 3.858 4.096 . 0 0 "[ . 1 . 2]" 1
2336 1 105 THR H 1 105 THR HB . . 3.760 3.580 3.552 3.603 . 0 0 "[ . 1 . 2]" 1
2337 1 105 THR H 1 105 THR MG . . 3.280 2.583 2.347 2.764 . 0 0 "[ . 1 . 2]" 1
2338 1 105 THR H 1 106 LYS H . . 4.620 4.571 4.526 4.610 . 0 0 "[ . 1 . 2]" 1
2339 1 105 THR HA 1 105 THR MG . . 3.160 2.158 2.094 2.261 . 0 0 "[ . 1 . 2]" 1
2340 1 105 THR HA 1 106 LYS H . . 3.170 2.561 2.485 2.625 . 0 0 "[ . 1 . 2]" 1
2341 1 105 THR HA 1 106 LYS QG . . 4.580 3.732 3.464 4.177 . 0 0 "[ . 1 . 2]" 1
2342 1 105 THR HB 1 106 LYS H . . 3.270 2.049 1.921 2.213 . 0 0 "[ . 1 . 2]" 1
2343 1 105 THR MG 1 106 LYS H . . 3.410 3.311 3.185 3.399 . 0 0 "[ . 1 . 2]" 1
2344 1 106 LYS H 1 106 LYS HB2 . . 3.410 2.429 2.252 2.551 . 0 0 "[ . 1 . 2]" 1
2345 1 106 LYS H 1 106 LYS HB3 . . 3.780 3.609 3.526 3.656 . 0 0 "[ . 1 . 2]" 1
2346 1 106 LYS H 1 106 LYS HD2 . . 5.130 4.931 4.752 5.132 0.002 14 0 "[ . 1 . 2]" 1
2347 1 106 LYS H 1 106 LYS HD3 . . 5.420 4.739 4.198 5.339 . 0 0 "[ . 1 . 2]" 1
2348 1 106 LYS H 1 106 LYS QG . . 3.330 2.565 2.213 3.075 . 0 0 "[ . 1 . 2]" 1
2349 1 106 LYS H 1 107 ALA H . . 4.650 4.594 4.579 4.616 . 0 0 "[ . 1 . 2]" 1
2350 1 106 LYS HA 1 106 LYS HD2 . . 4.620 4.092 3.707 4.463 . 0 0 "[ . 1 . 2]" 1
2351 1 106 LYS HA 1 106 LYS HD3 . . 3.900 3.058 2.478 3.906 0.006 3 0 "[ . 1 . 2]" 1
2352 1 106 LYS HA 1 106 LYS QE . . 4.670 4.162 3.471 4.696 0.026 8 0 "[ . 1 . 2]" 1
2353 1 106 LYS HA 1 106 LYS QG . . 3.200 2.513 2.150 2.752 . 0 0 "[ . 1 . 2]" 1
2354 1 106 LYS HA 1 107 ALA H . . 2.670 2.312 2.260 2.357 . 0 0 "[ . 1 . 2]" 1
2355 1 106 LYS HA 1 107 ALA MB . . 4.160 3.991 3.945 4.046 . 0 0 "[ . 1 . 2]" 1
2356 1 106 LYS HB2 1 106 LYS HD2 . . 4.050 3.276 2.724 3.685 . 0 0 "[ . 1 . 2]" 1
2357 1 106 LYS HB2 1 107 ALA H . . 3.960 3.828 3.670 3.969 0.009 8 0 "[ . 1 . 2]" 1
2358 1 106 LYS HB3 1 106 LYS HD2 . . 3.780 2.552 2.347 2.737 . 0 0 "[ . 1 . 2]" 1
2359 1 106 LYS HB3 1 106 LYS HD3 . . 3.690 2.487 2.314 2.680 . 0 0 "[ . 1 . 2]" 1
2360 1 106 LYS HB3 1 106 LYS QE . . 4.150 3.966 3.903 4.030 . 0 0 "[ . 1 . 2]" 1
2361 1 106 LYS HB3 1 107 ALA H . . 3.040 2.669 2.548 2.808 . 0 0 "[ . 1 . 2]" 1
2362 1 106 LYS HB3 1 107 ALA HA . . 5.500 4.806 4.636 4.910 . 0 0 "[ . 1 . 2]" 1
2363 1 106 LYS HB3 1 107 ALA MB . . 4.560 4.228 4.166 4.351 . 0 0 "[ . 1 . 2]" 1
2364 1 106 LYS HD2 1 107 ALA H . . 4.980 4.810 4.460 4.966 . 0 0 "[ . 1 . 2]" 1
2365 1 106 LYS HD3 1 107 ALA H . . 4.500 3.917 3.488 4.495 . 0 0 "[ . 1 . 2]" 1
2366 1 106 LYS QE 1 106 LYS QG . . 3.070 2.135 2.029 2.237 . 0 0 "[ . 1 . 2]" 1
2367 1 106 LYS QG 1 107 ALA H . . 4.390 4.126 3.529 4.404 0.014 12 0 "[ . 1 . 2]" 1
2368 1 107 ALA H 1 107 ALA MB . . 2.630 2.094 2.039 2.248 . 0 0 "[ . 1 . 2]" 1
2369 1 107 ALA H 1 108 ARG H . . 4.620 4.552 4.498 4.592 . 0 0 "[ . 1 . 2]" 1
2370 1 107 ALA HA 1 108 ARG H . . 2.660 2.166 2.145 2.191 . 0 0 "[ . 1 . 2]" 1
2371 1 107 ALA HA 1 108 ARG QG . . 4.080 3.765 3.577 3.922 . 0 0 "[ . 1 . 2]" 1
2372 1 107 ALA MB 1 108 ARG H . . 3.330 3.087 2.912 3.197 . 0 0 "[ . 1 . 2]" 1
2373 1 107 ALA MB 1 108 ARG QG . . 4.270 4.024 3.791 4.183 . 0 0 "[ . 1 . 2]" 1
2374 1 107 ALA MB 1 109 SER HA . . 4.930 4.679 3.967 4.941 0.011 5 0 "[ . 1 . 2]" 1
2375 1 108 ARG H 1 108 ARG HB2 . . 3.720 3.589 3.532 3.643 . 0 0 "[ . 1 . 2]" 1
2376 1 108 ARG H 1 108 ARG QB . . 3.150 2.682 2.595 2.765 . 0 0 "[ . 1 . 2]" 1
2377 1 108 ARG H 1 108 ARG HB3 . . 3.720 2.770 2.662 2.888 . 0 0 "[ . 1 . 2]" 1
2378 1 108 ARG H 1 108 ARG QD . . 4.100 3.946 3.641 4.110 0.010 7 0 "[ . 1 . 2]" 1
2379 1 108 ARG H 1 108 ARG QG . . 2.780 2.038 1.881 2.177 . 0 0 "[ . 1 . 2]" 1
2380 1 108 ARG H 1 109 SER HA . . 5.500 5.230 4.695 5.490 . 0 0 "[ . 1 . 2]" 1
2381 1 108 ARG HA 1 108 ARG QD . . 4.410 4.249 3.703 4.458 0.048 7 0 "[ . 1 . 2]" 1
2382 1 108 ARG HA 1 108 ARG QG . . 3.600 3.336 3.289 3.415 . 0 0 "[ . 1 . 2]" 1
2383 1 108 ARG HA 1 109 SER H . . 3.180 2.490 2.146 3.197 0.017 3 0 "[ . 1 . 2]" 1
2384 1 108 ARG QB 1 109 SER H . . 4.200 3.522 2.529 4.042 . 0 0 "[ . 1 . 2]" 1
2385 1 108 ARG HB2 1 108 ARG QD . . 3.470 2.247 2.080 2.453 . 0 0 "[ . 1 . 2]" 1
2386 1 108 ARG HB2 1 109 SER H . . 5.060 3.779 2.572 4.454 . 0 0 "[ . 1 . 2]" 1
2387 1 108 ARG HB3 1 108 ARG QD . . 3.470 2.770 2.478 3.262 . 0 0 "[ . 1 . 2]" 1
2388 1 108 ARG HB3 1 109 SER H . . 5.060 4.315 3.743 4.653 . 0 0 "[ . 1 . 2]" 1
2389 1 108 ARG QG 1 109 SER H . . 5.230 4.031 3.120 4.509 . 0 0 "[ . 1 . 2]" 1
2390 1 108 ARG QG 1 109 SER HA . . 4.720 4.337 3.650 4.717 . 0 0 "[ . 1 . 2]" 1
2391 1 108 ARG QG 1 109 SER QB . . 5.500 5.058 3.653 5.500 . 1 0 "[ . 1 . 2]" 1
2392 1 109 SER H 1 109 SER QB . . 3.520 2.434 2.191 2.954 . 0 0 "[ . 1 . 2]" 1
2393 1 109 SER HA 1 110 GLY H . . 3.240 2.271 2.143 2.618 . 0 0 "[ . 1 . 2]" 1
2394 1 109 SER HA 1 110 GLY QA . . 5.340 3.926 3.892 4.036 . 0 0 "[ . 1 . 2]" 1
2395 1 109 SER QB 1 110 GLY H . . 4.020 3.199 2.179 3.835 . 0 0 "[ . 1 . 2]" 1
2396 1 109 SER QB 1 110 GLY QA . . 4.250 3.990 3.544 4.219 . 0 0 "[ . 1 . 2]" 1
2397 1 110 GLY QA 1 111 PRO QG . . 3.980 3.688 3.662 3.700 . 0 0 "[ . 1 . 2]" 1
2398 1 110 GLY HA2 1 111 PRO QD . . 2.780 2.279 2.052 2.626 . 0 0 "[ . 1 . 2]" 1
2399 1 110 GLY HA2 1 111 PRO QG . . 4.570 4.194 3.959 4.533 . 0 0 "[ . 1 . 2]" 1
2400 1 110 GLY HA3 1 111 PRO QD . . 2.780 2.318 1.970 2.624 . 0 0 "[ . 1 . 2]" 1
2401 1 110 GLY HA3 1 111 PRO QG . . 4.570 4.136 3.866 4.381 . 0 0 "[ . 1 . 2]" 1
2402 1 112 SER QB 1 113 SER H . . 4.790 3.023 2.128 3.915 . 0 0 "[ . 1 . 2]" 1
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