NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
616560 |
2nd5   |
26047 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2nd5
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 3053
_Distance_constraint_stats_list.Viol_count 5188
_Distance_constraint_stats_list.Viol_total 2708.467
_Distance_constraint_stats_list.Viol_max 0.419
_Distance_constraint_stats_list.Viol_rms 0.0103
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0022
_Distance_constraint_stats_list.Viol_average_violations_only 0.0261
_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 3 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 MET 0.254 0.058 4 0 "[ . 1 . 2]"
1 5 GLY 0.203 0.058 4 0 "[ . 1 . 2]"
1 6 VAL 1.313 0.029 3 0 "[ . 1 . 2]"
1 7 GLN 2.265 0.284 9 0 "[ . 1 . 2]"
1 8 VAL 3.782 0.284 9 0 "[ . 1 . 2]"
1 9 GLU 0.774 0.039 13 0 "[ . 1 . 2]"
1 10 THR 3.615 0.069 8 0 "[ . 1 . 2]"
1 11 ILE 4.107 0.070 7 0 "[ . 1 . 2]"
1 12 SER 3.818 0.049 10 0 "[ . 1 . 2]"
1 13 PRO 3.143 0.046 3 0 "[ . 1 . 2]"
1 14 GLY 1.529 0.065 1 0 "[ . 1 . 2]"
1 15 ASP 2.047 0.075 7 0 "[ . 1 . 2]"
1 16 GLY 0.842 0.047 8 0 "[ . 1 . 2]"
1 17 ARG 1.406 0.085 18 0 "[ . 1 . 2]"
1 18 THR 3.768 0.144 7 0 "[ . 1 . 2]"
1 19 PHE 2.846 0.101 7 0 "[ . 1 . 2]"
1 20 PRO 2.603 0.142 7 0 "[ . 1 . 2]"
1 22 ARG 1.865 0.067 8 0 "[ . 1 . 2]"
1 23 GLY 0.577 0.032 7 0 "[ . 1 . 2]"
1 24 GLN 1.513 0.046 1 0 "[ . 1 . 2]"
1 25 THR 1.065 0.042 7 0 "[ . 1 . 2]"
1 26 CYS 1.301 0.058 8 0 "[ . 1 . 2]"
1 27 VAL 4.309 0.079 7 0 "[ . 1 . 2]"
1 28 VAL 6.466 0.150 3 0 "[ . 1 . 2]"
1 29 HIS 3.323 0.073 20 0 "[ . 1 . 2]"
1 30 TYR 3.555 0.066 6 0 "[ . 1 . 2]"
1 31 THR 1.579 0.050 16 0 "[ . 1 . 2]"
1 32 GLY 1.979 0.063 3 0 "[ . 1 . 2]"
1 33 MET 4.088 0.131 3 0 "[ . 1 . 2]"
1 34 LEU 4.285 0.113 13 0 "[ . 1 . 2]"
1 35 GLU 3.258 0.097 12 0 "[ . 1 . 2]"
1 36 ASP 2.175 0.063 20 0 "[ . 1 . 2]"
1 37 GLY 4.303 0.131 3 0 "[ . 1 . 2]"
1 40 PHE 6.765 0.113 13 0 "[ . 1 . 2]"
1 41 ASP 0.339 0.052 8 0 "[ . 1 . 2]"
1 42 SER 2.506 0.111 15 0 "[ . 1 . 2]"
1 43 SER 2.418 0.052 3 0 "[ . 1 . 2]"
1 44 ARG 0.626 0.057 16 0 "[ . 1 . 2]"
1 45 ASP 0.653 0.061 17 0 "[ . 1 . 2]"
1 46 ARG 0.610 0.051 17 0 "[ . 1 . 2]"
1 47 ASN 0.033 0.008 17 0 "[ . 1 . 2]"
1 49 PRO 1.103 0.050 17 0 "[ . 1 . 2]"
1 50 PHE 1.247 0.045 13 0 "[ . 1 . 2]"
1 52 PHE 2.742 0.056 7 0 "[ . 1 . 2]"
1 53 MET 1.558 0.072 13 0 "[ . 1 . 2]"
1 54 LEU 8.307 0.096 18 0 "[ . 1 . 2]"
1 55 GLY 1.781 0.089 17 0 "[ . 1 . 2]"
1 57 GLN 1.787 0.096 18 0 "[ . 1 . 2]"
1 58 GLU 1.142 0.078 20 0 "[ . 1 . 2]"
1 59 VAL 3.042 0.078 20 0 "[ . 1 . 2]"
1 60 ILE 3.725 0.077 4 0 "[ . 1 . 2]"
1 61 ARG 1.998 0.046 3 0 "[ . 1 . 2]"
1 62 GLY 3.009 0.051 17 0 "[ . 1 . 2]"
1 63 TRP 3.814 0.077 4 0 "[ . 1 . 2]"
1 64 GLU 6.698 0.089 17 0 "[ . 1 . 2]"
1 65 GLU 1.036 0.029 3 0 "[ . 1 . 2]"
1 66 GLY 0.453 0.033 5 0 "[ . 1 . 2]"
1 67 VAL 5.168 0.084 2 0 "[ . 1 . 2]"
1 68 ALA 3.575 0.058 3 0 "[ . 1 . 2]"
1 69 GLN 3.714 0.080 13 0 "[ . 1 . 2]"
1 70 MET 5.994 0.084 2 0 "[ . 1 . 2]"
1 71 SER 1.704 0.056 8 0 "[ . 1 . 2]"
1 72 VAL 4.386 0.419 7 0 "[ . 1 . 2]"
1 73 GLY 0.029 0.029 7 0 "[ . 1 . 2]"
1 74 GLN 2.663 0.046 1 0 "[ . 1 . 2]"
1 75 ARG 2.802 0.065 1 0 "[ . 1 . 2]"
1 76 ALA 1.622 0.070 7 0 "[ . 1 . 2]"
1 78 LEU 6.094 0.163 9 0 "[ . 1 . 2]"
1 79 THR 2.541 0.118 9 0 "[ . 1 . 2]"
1 80 ILE 2.678 0.044 3 0 "[ . 1 . 2]"
1 81 SER 3.000 0.067 3 0 "[ . 1 . 2]"
1 82 PRO 5.144 0.083 3 0 "[ . 1 . 2]"
1 83 ASP 1.581 0.052 13 0 "[ . 1 . 2]"
1 84 TYR 5.029 0.156 3 0 "[ . 1 . 2]"
1 85 ALA 2.110 0.077 3 0 "[ . 1 . 2]"
1 86 TYR 2.293 0.156 3 0 "[ . 1 . 2]"
1 87 GLY 0.201 0.046 3 0 "[ . 1 . 2]"
1 88 ALA 0.709 0.039 13 0 "[ . 1 . 2]"
1 89 THR 0.744 0.039 13 0 "[ . 1 . 2]"
1 90 GLY 0.033 0.033 3 0 "[ . 1 . 2]"
1 91 HIS 0.219 0.017 13 0 "[ . 1 . 2]"
1 92 PRO 0.408 0.018 15 0 "[ . 1 . 2]"
1 93 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 ILE 2.469 0.089 10 0 "[ . 1 . 2]"
1 95 ILE 2.790 0.065 13 0 "[ . 1 . 2]"
1 96 PRO 4.931 0.097 13 0 "[ . 1 . 2]"
1 97 PRO 2.448 0.097 13 0 "[ . 1 . 2]"
1 98 HIS 0.901 0.029 12 0 "[ . 1 . 2]"
1 99 ALA 2.936 0.072 3 0 "[ . 1 . 2]"
1 100 THR 2.902 0.072 3 0 "[ . 1 . 2]"
1 101 LEU 3.863 0.074 3 0 "[ . 1 . 2]"
1 102 VAL 1.618 0.064 10 0 "[ . 1 . 2]"
1 103 PHE 3.073 0.063 3 0 "[ . 1 . 2]"
1 104 ASP 0.403 0.026 8 0 "[ . 1 . 2]"
1 105 VAL 1.703 0.032 8 0 "[ . 1 . 2]"
1 106 GLU 2.269 0.066 6 0 "[ . 1 . 2]"
1 107 LEU 7.499 0.150 3 0 "[ . 1 . 2]"
1 108 LEU 3.230 0.079 7 0 "[ . 1 . 2]"
1 110 LEU 1.734 0.419 7 0 "[ . 1 . 2]"
1 111 GLU 1.791 0.042 7 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 3 SER HB2 1 4 MET H . . 6.000 3.587 2.609 4.354 . 0 0 "[ . 1 . 2]" 1
2 1 3 SER HB3 1 4 MET H . . 6.000 3.413 2.473 4.241 . 0 0 "[ . 1 . 2]" 1
3 1 4 MET H 1 4 MET HG2 . . 5.650 3.834 2.954 4.962 . 0 0 "[ . 1 . 2]" 1
4 1 4 MET H 1 4 MET HG3 . . 5.650 3.748 2.883 4.701 . 0 0 "[ . 1 . 2]" 1
5 1 4 MET HA 1 4 MET QG . . 3.560 2.566 2.341 3.382 . 0 0 "[ . 1 . 2]" 1
6 1 4 MET HA 1 6 VAL H . . 4.750 4.217 3.731 4.759 0.009 12 0 "[ . 1 . 2]" 1
7 1 4 MET QB 1 5 GLY QA . . 4.170 3.927 3.821 4.228 0.058 4 0 "[ . 1 . 2]" 1
8 1 4 MET QB 1 6 VAL H . . 3.870 2.715 2.510 2.887 . 0 0 "[ . 1 . 2]" 1
9 1 4 MET HB2 1 5 GLY H . . 5.270 3.647 2.576 4.289 . 0 0 "[ . 1 . 2]" 1
10 1 4 MET HB2 1 6 VAL H . . 4.550 3.749 2.919 4.551 0.001 15 0 "[ . 1 . 2]" 1
11 1 4 MET HB3 1 5 GLY H . . 5.270 3.092 2.619 4.091 . 0 0 "[ . 1 . 2]" 1
12 1 4 MET HB3 1 6 VAL H . . 4.550 2.920 2.538 4.549 . 0 0 "[ . 1 . 2]" 1
13 1 4 MET ME 1 4 MET QG . . 3.410 2.242 2.231 2.333 . 0 0 "[ . 1 . 2]" 1
14 1 4 MET HG2 1 5 GLY H . . 6.000 4.538 3.810 5.219 . 0 0 "[ . 1 . 2]" 1
15 1 4 MET HG2 1 6 VAL H . . 5.580 5.120 4.407 5.608 0.028 5 0 "[ . 1 . 2]" 1
16 1 4 MET HG3 1 5 GLY H . . 6.000 4.721 3.808 5.198 . 0 0 "[ . 1 . 2]" 1
17 1 4 MET HG3 1 6 VAL H . . 5.580 5.133 3.184 5.599 0.019 11 0 "[ . 1 . 2]" 1
18 1 5 GLY H 1 6 VAL H . . 3.760 2.615 2.015 3.109 . 0 0 "[ . 1 . 2]" 1
19 1 5 GLY H 1 6 VAL MG1 . . 6.000 3.776 3.179 4.764 . 0 0 "[ . 1 . 2]" 1
20 1 5 GLY H 1 6 VAL MG2 . . 6.000 5.674 5.371 6.018 0.018 2 0 "[ . 1 . 2]" 1
21 1 5 GLY H 1 84 TYR QD . . 5.910 4.734 3.629 5.922 0.012 2 0 "[ . 1 . 2]" 1
22 1 5 GLY H 1 84 TYR QE . . 5.670 3.932 2.737 5.487 . 0 0 "[ . 1 . 2]" 1
23 1 5 GLY QA 1 6 VAL H . . 2.870 2.793 2.652 2.897 0.027 11 0 "[ . 1 . 2]" 1
24 1 5 GLY QA 1 6 VAL MG1 . . 4.440 4.100 3.827 4.270 . 0 0 "[ . 1 . 2]" 1
25 1 5 GLY QA 1 6 VAL MG2 . . 5.810 5.147 5.061 5.221 . 0 0 "[ . 1 . 2]" 1
26 1 5 GLY QA 1 7 GLN H . . 5.810 5.313 5.086 5.452 . 0 0 "[ . 1 . 2]" 1
27 1 5 GLY QA 1 7 GLN HE22 . . 5.710 3.209 2.746 4.271 . 0 0 "[ . 1 . 2]" 1
28 1 5 GLY QA 1 81 SER H . . 4.980 4.270 4.161 4.439 . 0 0 "[ . 1 . 2]" 1
29 1 5 GLY QA 1 81 SER QB . . 4.420 3.422 3.176 3.628 . 0 0 "[ . 1 . 2]" 1
30 1 5 GLY QA 1 84 TYR QD . . 4.650 3.320 3.082 3.578 . 0 0 "[ . 1 . 2]" 1
31 1 5 GLY QA 1 84 TYR QE . . 4.210 3.406 2.907 3.866 . 0 0 "[ . 1 . 2]" 1
32 1 6 VAL H 1 6 VAL HB . . 3.590 3.179 3.058 3.304 . 0 0 "[ . 1 . 2]" 1
33 1 6 VAL H 1 6 VAL MG1 . . 2.840 2.302 2.168 2.430 . 0 0 "[ . 1 . 2]" 1
34 1 6 VAL H 1 6 VAL MG2 . . 4.090 3.959 3.917 4.002 . 0 0 "[ . 1 . 2]" 1
35 1 6 VAL H 1 7 GLN H . . 4.430 4.222 4.055 4.332 . 0 0 "[ . 1 . 2]" 1
36 1 6 VAL H 1 7 GLN HA . . 4.960 4.849 4.703 4.970 0.010 18 0 "[ . 1 . 2]" 1
37 1 6 VAL H 1 7 GLN HE22 . . 5.210 3.884 3.408 4.740 . 0 0 "[ . 1 . 2]" 1
38 1 6 VAL H 1 7 GLN QG . . 4.450 4.286 4.085 4.456 0.006 12 0 "[ . 1 . 2]" 1
39 1 6 VAL H 1 81 SER H . . 6.000 5.834 5.668 6.002 0.002 7 0 "[ . 1 . 2]" 1
40 1 6 VAL H 1 84 TYR QE . . 5.400 4.768 4.512 5.058 . 0 0 "[ . 1 . 2]" 1
41 1 6 VAL HA 1 6 VAL MG1 . . 3.370 3.256 3.252 3.258 . 0 0 "[ . 1 . 2]" 1
42 1 6 VAL HA 1 6 VAL MG2 . . 3.280 2.335 2.314 2.370 . 0 0 "[ . 1 . 2]" 1
43 1 6 VAL HA 1 7 GLN H . . 2.720 2.129 2.119 2.140 . 0 0 "[ . 1 . 2]" 1
44 1 6 VAL HA 1 7 GLN QG . . 4.810 4.346 3.149 4.595 . 0 0 "[ . 1 . 2]" 1
45 1 6 VAL HA 1 79 THR H . . 4.660 4.105 3.876 4.276 . 0 0 "[ . 1 . 2]" 1
46 1 6 VAL HA 1 79 THR MG . . 4.620 4.389 4.110 4.598 . 0 0 "[ . 1 . 2]" 1
47 1 6 VAL HA 1 80 ILE HA . . 3.740 3.247 3.085 3.397 . 0 0 "[ . 1 . 2]" 1
48 1 6 VAL HB 1 7 GLN H . . 4.360 4.312 4.242 4.364 0.004 17 0 "[ . 1 . 2]" 1
49 1 6 VAL HB 1 62 GLY HA2 . . 3.950 2.828 2.697 2.933 . 0 0 "[ . 1 . 2]" 1
50 1 6 VAL HB 1 62 GLY HA3 . . 4.230 3.308 3.134 3.412 . 0 0 "[ . 1 . 2]" 1
51 1 6 VAL HB 1 69 GLN HE22 . . 6.000 5.650 5.510 5.835 . 0 0 "[ . 1 . 2]" 1
52 1 6 VAL HB 1 80 ILE HA . . 4.340 3.706 3.647 3.830 . 0 0 "[ . 1 . 2]" 1
53 1 6 VAL HB 1 81 SER H . . 4.840 4.485 4.379 4.610 . 0 0 "[ . 1 . 2]" 1
54 1 6 VAL HB 1 84 TYR QD . . 4.590 3.431 3.353 3.492 . 0 0 "[ . 1 . 2]" 1
55 1 6 VAL HB 1 84 TYR QE . . 4.350 4.212 4.115 4.277 . 0 0 "[ . 1 . 2]" 1
56 1 6 VAL MG1 1 7 GLN H . . 4.330 4.125 4.058 4.209 . 0 0 "[ . 1 . 2]" 1
57 1 6 VAL MG1 1 7 GLN HA . . 4.320 4.138 4.075 4.230 . 0 0 "[ . 1 . 2]" 1
58 1 6 VAL MG1 1 7 GLN HE22 . . 6.000 5.321 5.096 6.015 0.015 9 0 "[ . 1 . 2]" 1
59 1 6 VAL MG1 1 61 ARG HB3 . . 6.000 5.512 5.461 5.562 . 0 0 "[ . 1 . 2]" 1
60 1 6 VAL MG1 1 62 GLY HA2 . . 3.780 2.871 2.827 2.962 . 0 0 "[ . 1 . 2]" 1
61 1 6 VAL MG1 1 65 GLU H . . 4.510 4.523 4.512 4.539 0.029 3 0 "[ . 1 . 2]" 1
62 1 6 VAL MG1 1 65 GLU HA . . 4.890 4.891 4.853 4.904 0.014 5 0 "[ . 1 . 2]" 1
63 1 6 VAL MG1 1 65 GLU HB2 . . 3.160 2.712 2.684 2.744 . 0 0 "[ . 1 . 2]" 1
64 1 6 VAL MG1 1 65 GLU HB3 . . 3.440 2.975 2.927 3.018 . 0 0 "[ . 1 . 2]" 1
65 1 6 VAL MG1 1 65 GLU QG . . 4.370 3.995 3.716 4.287 . 0 0 "[ . 1 . 2]" 1
66 1 6 VAL MG1 1 66 GLY H . . 4.150 4.021 3.957 4.108 . 0 0 "[ . 1 . 2]" 1
67 1 6 VAL MG1 1 66 GLY HA2 . . 4.310 3.843 3.754 3.942 . 0 0 "[ . 1 . 2]" 1
68 1 6 VAL MG1 1 69 GLN HE21 . . 4.010 3.399 3.300 3.492 . 0 0 "[ . 1 . 2]" 1
69 1 6 VAL MG1 1 69 GLN HE22 . . 3.930 2.803 2.651 2.926 . 0 0 "[ . 1 . 2]" 1
70 1 6 VAL MG1 1 84 TYR QD . . 3.560 3.572 3.562 3.583 0.023 6 0 "[ . 1 . 2]" 1
71 1 6 VAL MG1 1 84 TYR QE . . 3.580 3.187 3.105 3.219 . 0 0 "[ . 1 . 2]" 1
72 1 6 VAL MG2 1 7 GLN H . . 3.080 2.894 2.716 3.068 . 0 0 "[ . 1 . 2]" 1
73 1 6 VAL MG2 1 62 GLY HA2 . . 3.490 2.463 2.368 2.507 . 0 0 "[ . 1 . 2]" 1
74 1 6 VAL MG2 1 62 GLY HA3 . . 3.560 2.851 2.747 2.974 . 0 0 "[ . 1 . 2]" 1
75 1 6 VAL MG2 1 63 TRP HA . . 4.510 4.333 4.244 4.452 . 0 0 "[ . 1 . 2]" 1
76 1 6 VAL MG2 1 65 GLU H . . 4.690 4.674 4.570 4.703 0.013 12 0 "[ . 1 . 2]" 1
77 1 6 VAL MG2 1 66 GLY H . . 3.910 3.525 3.372 3.583 . 0 0 "[ . 1 . 2]" 1
78 1 6 VAL MG2 1 66 GLY HA3 . . 3.560 2.893 2.758 2.981 . 0 0 "[ . 1 . 2]" 1
79 1 6 VAL MG2 1 69 GLN HE21 . . 4.550 3.884 3.784 3.999 . 0 0 "[ . 1 . 2]" 1
80 1 6 VAL MG2 1 69 GLN HE22 . . 4.040 3.482 3.308 3.703 . 0 0 "[ . 1 . 2]" 1
81 1 6 VAL MG2 1 78 LEU HA . . 4.060 3.824 3.757 3.928 . 0 0 "[ . 1 . 2]" 1
82 1 6 VAL MG2 1 79 THR H . . 3.960 3.355 3.127 3.502 . 0 0 "[ . 1 . 2]" 1
83 1 6 VAL MG2 1 80 ILE HA . . 3.440 3.246 3.147 3.429 . 0 0 "[ . 1 . 2]" 1
84 1 6 VAL MG2 1 84 TYR QD . . 4.180 4.194 4.169 4.202 0.022 17 0 "[ . 1 . 2]" 1
85 1 7 GLN H 1 7 GLN HB2 . . 3.210 2.665 2.566 3.098 . 0 0 "[ . 1 . 2]" 1
86 1 7 GLN H 1 7 GLN HB3 . . 3.790 3.766 3.733 3.790 0.000 9 0 "[ . 1 . 2]" 1
87 1 7 GLN H 1 7 GLN HE22 . . 5.450 3.612 3.305 5.162 . 0 0 "[ . 1 . 2]" 1
88 1 7 GLN H 1 7 GLN QG . . 3.490 3.280 1.989 3.495 0.005 13 0 "[ . 1 . 2]" 1
89 1 7 GLN H 1 78 LEU HA . . 4.680 4.310 4.177 4.457 . 0 0 "[ . 1 . 2]" 1
90 1 7 GLN H 1 78 LEU HB3 . . 5.260 4.827 4.604 5.020 . 0 0 "[ . 1 . 2]" 1
91 1 7 GLN H 1 79 THR H . . 3.270 2.610 2.541 2.771 . 0 0 "[ . 1 . 2]" 1
92 1 7 GLN H 1 79 THR HB . . 3.710 2.262 2.005 2.462 . 0 0 "[ . 1 . 2]" 1
93 1 7 GLN H 1 79 THR MG . . 4.130 3.849 3.663 4.035 . 0 0 "[ . 1 . 2]" 1
94 1 7 GLN H 1 80 ILE H . . 5.500 5.162 5.008 5.221 . 0 0 "[ . 1 . 2]" 1
95 1 7 GLN HA 1 7 GLN HE21 . . 4.600 3.541 3.327 4.613 0.013 5 0 "[ . 1 . 2]" 1
96 1 7 GLN HA 1 7 GLN HE22 . . 4.980 4.961 4.867 5.001 0.021 3 0 "[ . 1 . 2]" 1
97 1 7 GLN HA 1 7 GLN HG2 . . 3.710 3.460 3.135 3.519 . 0 0 "[ . 1 . 2]" 1
98 1 7 GLN HA 1 7 GLN QG . . 3.190 2.427 2.302 3.028 . 0 0 "[ . 1 . 2]" 1
99 1 7 GLN HA 1 7 GLN HG3 . . 3.710 2.558 2.339 3.985 0.275 5 0 "[ . 1 . 2]" 1
100 1 7 GLN HA 1 8 VAL H . . 2.660 2.138 2.128 2.173 . 0 0 "[ . 1 . 2]" 1
101 1 7 GLN HA 1 8 VAL HB . . 4.860 4.653 4.457 4.813 . 0 0 "[ . 1 . 2]" 1
102 1 7 GLN HA 1 8 VAL QG . . 4.090 3.641 3.551 3.790 . 0 0 "[ . 1 . 2]" 1
103 1 7 GLN HA 1 78 LEU HB3 . . 6.000 5.898 5.698 6.018 0.018 13 0 "[ . 1 . 2]" 1
104 1 7 GLN HA 1 79 THR H . . 4.670 4.412 4.328 4.489 . 0 0 "[ . 1 . 2]" 1
105 1 7 GLN HA 1 79 THR HB . . 5.260 4.577 4.332 4.774 . 0 0 "[ . 1 . 2]" 1
106 1 7 GLN HB2 1 7 GLN HE22 . . 5.290 4.039 3.838 5.306 0.016 9 0 "[ . 1 . 2]" 1
107 1 7 GLN HB2 1 7 GLN QG . . 2.580 2.453 2.094 2.505 . 0 0 "[ . 1 . 2]" 1
108 1 7 GLN HB2 1 79 THR H . . 3.970 3.508 3.154 3.728 . 0 0 "[ . 1 . 2]" 1
109 1 7 GLN HB2 1 79 THR HB . . 3.500 2.424 2.315 2.589 . 0 0 "[ . 1 . 2]" 1
110 1 7 GLN HB2 1 79 THR MG . . 3.890 3.625 3.368 3.894 0.004 9 0 "[ . 1 . 2]" 1
111 1 7 GLN HB3 1 7 GLN HE21 . . 4.510 4.193 4.150 4.277 . 0 0 "[ . 1 . 2]" 1
112 1 7 GLN HB3 1 7 GLN HE22 . . 5.190 5.021 4.457 5.098 . 0 0 "[ . 1 . 2]" 1
113 1 7 GLN HB3 1 8 VAL H . . 3.780 3.422 3.052 3.510 . 0 0 "[ . 1 . 2]" 1
114 1 7 GLN HB3 1 78 LEU HA . . 6.000 5.615 5.411 5.729 . 0 0 "[ . 1 . 2]" 1
115 1 7 GLN HB3 1 79 THR H . . 4.630 4.620 4.520 4.660 0.030 13 0 "[ . 1 . 2]" 1
116 1 7 GLN HB3 1 79 THR HB . . 4.230 4.107 3.907 4.235 0.005 7 0 "[ . 1 . 2]" 1
117 1 7 GLN HE21 1 79 THR HB . . 4.990 3.700 3.616 3.905 . 0 0 "[ . 1 . 2]" 1
118 1 7 GLN HE21 1 79 THR MG . . 4.520 4.448 3.605 4.553 0.033 3 0 "[ . 1 . 2]" 1
119 1 7 GLN HE22 1 79 THR HB . . 5.320 3.719 3.344 5.328 0.008 5 0 "[ . 1 . 2]" 1
120 1 7 GLN HE22 1 79 THR MG . . 4.740 3.872 3.667 4.858 0.118 9 0 "[ . 1 . 2]" 1
121 1 7 GLN QG 1 8 VAL H . . 4.230 4.235 4.124 4.514 0.284 9 0 "[ . 1 . 2]" 1
122 1 7 GLN QG 1 79 THR H . . 5.570 5.071 3.574 5.320 . 0 0 "[ . 1 . 2]" 1
123 1 7 GLN QG 1 79 THR HB . . 4.810 3.924 1.936 4.202 . 0 0 "[ . 1 . 2]" 1
124 1 8 VAL H 1 8 VAL HB . . 3.190 2.801 2.693 2.949 . 0 0 "[ . 1 . 2]" 1
125 1 8 VAL H 1 8 VAL MG1 . . 3.850 3.187 2.111 3.893 0.043 18 0 "[ . 1 . 2]" 1
126 1 8 VAL H 1 8 VAL QG . . 2.840 2.375 2.102 2.880 0.040 5 0 "[ . 1 . 2]" 1
127 1 8 VAL H 1 8 VAL MG2 . . 3.850 3.102 2.483 3.891 0.041 10 0 "[ . 1 . 2]" 1
128 1 8 VAL H 1 69 GLN HE22 . . 5.400 4.171 3.851 4.552 . 0 0 "[ . 1 . 2]" 1
129 1 8 VAL H 1 78 LEU QD . . 5.780 5.323 5.147 5.619 . 0 0 "[ . 1 . 2]" 1
130 1 8 VAL HA 1 8 VAL MG1 . . 3.320 2.703 2.301 3.239 . 0 0 "[ . 1 . 2]" 1
131 1 8 VAL HA 1 8 VAL QG . . 2.820 2.190 2.117 2.296 . 0 0 "[ . 1 . 2]" 1
132 1 8 VAL HA 1 8 VAL MG2 . . 3.320 2.400 2.306 2.480 . 0 0 "[ . 1 . 2]" 1
133 1 8 VAL HA 1 9 GLU H . . 2.740 2.143 2.116 2.176 . 0 0 "[ . 1 . 2]" 1
134 1 8 VAL HA 1 9 GLU HG2 . . 5.370 3.976 3.349 4.191 . 0 0 "[ . 1 . 2]" 1
135 1 8 VAL HA 1 9 GLU QG . . 4.620 3.350 3.253 3.578 . 0 0 "[ . 1 . 2]" 1
136 1 8 VAL HA 1 9 GLU HG3 . . 5.370 3.776 3.452 5.146 . 0 0 "[ . 1 . 2]" 1
137 1 8 VAL HA 1 76 ALA MB . . 4.400 4.093 3.931 4.255 . 0 0 "[ . 1 . 2]" 1
138 1 8 VAL HA 1 78 LEU H . . 5.340 4.465 4.416 4.566 . 0 0 "[ . 1 . 2]" 1
139 1 8 VAL HA 1 78 LEU HA . . 3.700 2.209 2.154 2.334 . 0 0 "[ . 1 . 2]" 1
140 1 8 VAL HA 1 78 LEU HB2 . . 5.180 4.959 4.791 5.028 . 0 0 "[ . 1 . 2]" 1
141 1 8 VAL HA 1 78 LEU HB3 . . 4.700 3.784 3.522 3.963 . 0 0 "[ . 1 . 2]" 1
142 1 8 VAL HA 1 78 LEU QD . . 4.210 4.050 3.822 4.174 . 0 0 "[ . 1 . 2]" 1
143 1 8 VAL HA 1 78 LEU HG . . 4.270 3.954 3.680 4.138 . 0 0 "[ . 1 . 2]" 1
144 1 8 VAL HA 1 79 THR H . . 4.000 3.491 3.311 3.643 . 0 0 "[ . 1 . 2]" 1
145 1 8 VAL HB 1 78 LEU HA . . 5.130 4.136 3.101 4.910 . 0 0 "[ . 1 . 2]" 1
146 1 8 VAL HB 1 78 LEU HB3 . . 4.950 4.333 3.091 5.113 0.163 9 0 "[ . 1 . 2]" 1
147 1 8 VAL QG 1 9 GLU H . . 2.960 2.621 2.409 2.773 . 0 0 "[ . 1 . 2]" 1
148 1 8 VAL QG 1 9 GLU HA . . 3.870 3.706 3.471 3.885 0.015 8 0 "[ . 1 . 2]" 1
149 1 8 VAL QG 1 9 GLU QG . . 4.600 4.014 3.871 4.165 . 0 0 "[ . 1 . 2]" 1
150 1 8 VAL QG 1 10 THR HB . . 5.690 5.557 5.386 5.711 0.021 16 0 "[ . 1 . 2]" 1
151 1 8 VAL QG 1 66 GLY HA2 . . 3.320 2.624 2.119 3.329 0.009 13 0 "[ . 1 . 2]" 1
152 1 8 VAL QG 1 66 GLY HA3 . . 3.880 3.046 2.503 3.836 . 0 0 "[ . 1 . 2]" 1
153 1 8 VAL QG 1 69 GLN H . . 4.120 3.882 3.597 4.079 . 0 0 "[ . 1 . 2]" 1
154 1 8 VAL QG 1 69 GLN HB2 . . 3.070 2.374 2.151 2.588 . 0 0 "[ . 1 . 2]" 1
155 1 8 VAL QG 1 69 GLN HE21 . . 3.890 3.236 2.942 3.641 . 0 0 "[ . 1 . 2]" 1
156 1 8 VAL QG 1 69 GLN HE22 . . 3.680 2.662 2.290 3.071 . 0 0 "[ . 1 . 2]" 1
157 1 8 VAL QG 1 69 GLN HG2 . . 4.120 4.032 3.910 4.123 0.003 14 0 "[ . 1 . 2]" 1
158 1 8 VAL QG 1 69 GLN HG3 . . 4.030 3.339 3.131 3.510 . 0 0 "[ . 1 . 2]" 1
159 1 8 VAL QG 1 70 MET H . . 5.410 4.280 3.952 4.509 . 0 0 "[ . 1 . 2]" 1
160 1 8 VAL QG 1 70 MET HG2 . . 3.100 2.831 2.491 3.006 . 0 0 "[ . 1 . 2]" 1
161 1 8 VAL QG 1 70 MET HG3 . . 4.240 4.056 3.774 4.212 . 0 0 "[ . 1 . 2]" 1
162 1 8 VAL QG 1 74 GLN HE21 . . 4.180 4.035 3.917 4.133 . 0 0 "[ . 1 . 2]" 1
163 1 8 VAL QG 1 74 GLN HE22 . . 4.100 3.976 3.705 4.073 . 0 0 "[ . 1 . 2]" 1
164 1 8 VAL QG 1 76 ALA H . . 5.230 4.542 4.506 4.697 . 0 0 "[ . 1 . 2]" 1
165 1 8 VAL QG 1 76 ALA MB . . 2.850 1.995 1.972 2.094 . 0 0 "[ . 1 . 2]" 1
166 1 8 VAL QG 1 78 LEU HA . . 3.770 2.685 2.470 2.947 . 0 0 "[ . 1 . 2]" 1
167 1 8 VAL QG 1 78 LEU HB3 . . 3.590 2.639 2.093 3.508 . 0 0 "[ . 1 . 2]" 1
168 1 8 VAL QG 1 78 LEU HG . . 3.200 2.448 2.277 2.725 . 0 0 "[ . 1 . 2]" 1
169 1 8 VAL MG1 1 9 GLU H . . 4.290 3.198 2.597 3.946 . 0 0 "[ . 1 . 2]" 1
170 1 8 VAL MG1 1 69 GLN HB3 . . 4.310 3.465 2.747 4.073 . 0 0 "[ . 1 . 2]" 1
171 1 8 VAL MG1 1 69 GLN HG3 . . 5.350 4.094 3.535 4.517 . 0 0 "[ . 1 . 2]" 1
172 1 8 VAL MG1 1 70 MET HG2 . . 4.050 3.308 2.525 4.068 0.018 3 0 "[ . 1 . 2]" 1
173 1 8 VAL MG1 1 78 LEU HA . . 4.420 3.777 3.094 4.485 0.065 2 0 "[ . 1 . 2]" 1
174 1 8 VAL MG2 1 9 GLU H . . 4.290 3.486 2.435 4.174 . 0 0 "[ . 1 . 2]" 1
175 1 8 VAL MG2 1 69 GLN HB3 . . 4.310 4.104 3.805 4.325 0.015 10 0 "[ . 1 . 2]" 1
176 1 8 VAL MG2 1 69 GLN HG3 . . 5.350 3.903 3.203 4.786 . 0 0 "[ . 1 . 2]" 1
177 1 8 VAL MG2 1 70 MET HG2 . . 4.050 3.622 2.966 4.054 0.004 16 0 "[ . 1 . 2]" 1
178 1 8 VAL MG2 1 78 LEU HA . . 4.420 2.766 2.583 2.988 . 0 0 "[ . 1 . 2]" 1
179 1 9 GLU H 1 9 GLU QB . . 3.060 2.940 2.902 3.007 . 0 0 "[ . 1 . 2]" 1
180 1 9 GLU H 1 9 GLU HG2 . . 4.290 3.018 2.105 3.267 . 0 0 "[ . 1 . 2]" 1
181 1 9 GLU H 1 9 GLU QG . . 3.450 2.276 2.056 2.374 . 0 0 "[ . 1 . 2]" 1
182 1 9 GLU H 1 9 GLU HG3 . . 4.290 2.526 2.295 3.758 . 0 0 "[ . 1 . 2]" 1
183 1 9 GLU H 1 10 THR HA . . 5.200 4.893 4.826 4.976 . 0 0 "[ . 1 . 2]" 1
184 1 9 GLU H 1 76 ALA HA . . 4.710 4.491 4.426 4.581 . 0 0 "[ . 1 . 2]" 1
185 1 9 GLU H 1 76 ALA MB . . 3.430 3.137 3.055 3.243 . 0 0 "[ . 1 . 2]" 1
186 1 9 GLU H 1 78 LEU H . . 4.970 4.816 4.720 4.864 . 0 0 "[ . 1 . 2]" 1
187 1 9 GLU H 1 78 LEU HA . . 3.710 3.713 3.524 3.749 0.039 13 0 "[ . 1 . 2]" 1
188 1 9 GLU HA 1 9 GLU QG . . 3.600 2.907 2.817 3.360 . 0 0 "[ . 1 . 2]" 1
189 1 9 GLU HA 1 10 THR HA . . 4.780 4.384 4.378 4.392 . 0 0 "[ . 1 . 2]" 1
190 1 9 GLU HA 1 10 THR HB . . 4.790 4.811 4.802 4.819 0.029 1 0 "[ . 1 . 2]" 1
191 1 9 GLU HA 1 11 ILE H . . 6.000 5.941 5.892 6.000 0.000 7 0 "[ . 1 . 2]" 1
192 1 9 GLU HA 1 76 ALA MB . . 5.020 4.006 3.948 4.025 . 0 0 "[ . 1 . 2]" 1
193 1 9 GLU QB 1 76 ALA HA . . 5.810 4.533 4.430 5.061 . 0 0 "[ . 1 . 2]" 1
194 1 9 GLU QG 1 10 THR H . . 5.150 4.613 4.387 4.855 . 0 0 "[ . 1 . 2]" 1
195 1 9 GLU QG 1 76 ALA HA . . 5.810 5.540 3.991 5.646 . 0 0 "[ . 1 . 2]" 1
196 1 9 GLU QG 1 76 ALA MB . . 5.190 4.653 3.846 4.718 . 0 0 "[ . 1 . 2]" 1
197 1 9 GLU QG 1 78 LEU HA . . 5.810 4.358 4.086 4.486 . 0 0 "[ . 1 . 2]" 1
198 1 9 GLU HG2 1 76 ALA MB . . 6.000 5.524 4.560 5.687 . 0 0 "[ . 1 . 2]" 1
199 1 9 GLU HG3 1 76 ALA MB . . 6.000 5.067 4.143 5.947 . 0 0 "[ . 1 . 2]" 1
200 1 10 THR H 1 11 ILE HA . . 5.440 5.358 5.342 5.391 . 0 0 "[ . 1 . 2]" 1
201 1 10 THR H 1 11 ILE HG12 . . 5.570 5.580 5.571 5.598 0.028 7 0 "[ . 1 . 2]" 1
202 1 10 THR H 1 11 ILE HG13 . . 5.880 4.941 4.914 4.973 . 0 0 "[ . 1 . 2]" 1
203 1 10 THR H 1 76 ALA MB . . 3.620 3.627 3.581 3.640 0.020 9 0 "[ . 1 . 2]" 1
204 1 10 THR HA 1 10 THR MG . . 3.130 2.317 2.309 2.323 . 0 0 "[ . 1 . 2]" 1
205 1 10 THR HA 1 11 ILE H . . 2.970 2.109 2.099 2.121 . 0 0 "[ . 1 . 2]" 1
206 1 10 THR HA 1 11 ILE MD . . 5.320 4.596 4.560 4.630 . 0 0 "[ . 1 . 2]" 1
207 1 10 THR HA 1 11 ILE HG12 . . 4.590 4.652 4.638 4.659 0.069 8 0 "[ . 1 . 2]" 1
208 1 10 THR HA 1 11 ILE HG13 . . 4.850 3.266 3.243 3.287 . 0 0 "[ . 1 . 2]" 1
209 1 10 THR HA 1 11 ILE MG . . 5.470 5.376 5.367 5.382 . 0 0 "[ . 1 . 2]" 1
210 1 10 THR HA 1 12 SER H . . 4.040 3.844 3.806 3.889 . 0 0 "[ . 1 . 2]" 1
211 1 10 THR HA 1 70 MET HB3 . . 6.000 5.498 5.326 5.691 . 0 0 "[ . 1 . 2]" 1
212 1 10 THR HA 1 70 MET ME . . 6.000 5.779 5.633 5.878 . 0 0 "[ . 1 . 2]" 1
213 1 10 THR HA 1 74 GLN HE21 . . 4.210 3.471 3.434 3.503 . 0 0 "[ . 1 . 2]" 1
214 1 10 THR HA 1 74 GLN HE22 . . 4.520 4.280 4.244 4.313 . 0 0 "[ . 1 . 2]" 1
215 1 10 THR HA 1 74 GLN HG2 . . 5.360 4.010 3.965 4.061 . 0 0 "[ . 1 . 2]" 1
216 1 10 THR HA 1 74 GLN HG3 . . 6.000 5.179 5.129 5.247 . 0 0 "[ . 1 . 2]" 1
217 1 10 THR HA 1 75 ARG HB3 . . 6.000 5.763 5.709 5.795 . 0 0 "[ . 1 . 2]" 1
218 1 10 THR HA 1 76 ALA H . . 4.890 4.729 4.696 4.749 . 0 0 "[ . 1 . 2]" 1
219 1 10 THR HA 1 76 ALA HA . . 3.500 2.613 2.585 2.656 . 0 0 "[ . 1 . 2]" 1
220 1 10 THR HA 1 76 ALA MB . . 3.390 2.182 2.152 2.200 . 0 0 "[ . 1 . 2]" 1
221 1 10 THR HB 1 11 ILE H . . 4.530 4.071 4.009 4.096 . 0 0 "[ . 1 . 2]" 1
222 1 10 THR HB 1 12 SER H . . 5.500 5.170 5.125 5.205 . 0 0 "[ . 1 . 2]" 1
223 1 10 THR HB 1 74 GLN HE21 . . 5.150 5.167 5.161 5.172 0.022 13 0 "[ . 1 . 2]" 1
224 1 10 THR HB 1 74 GLN HE22 . . 5.450 5.146 5.091 5.188 . 0 0 "[ . 1 . 2]" 1
225 1 10 THR HB 1 76 ALA MB . . 4.490 4.476 4.437 4.493 0.003 8 0 "[ . 1 . 2]" 1
226 1 10 THR MG 1 11 ILE H . . 3.350 2.740 2.647 2.793 . 0 0 "[ . 1 . 2]" 1
227 1 10 THR MG 1 12 SER H . . 3.070 2.981 2.942 3.011 . 0 0 "[ . 1 . 2]" 1
228 1 10 THR MG 1 12 SER HA . . 4.070 4.075 4.071 4.078 0.008 7 0 "[ . 1 . 2]" 1
229 1 10 THR MG 1 13 PRO HA . . 3.340 2.958 2.927 2.993 . 0 0 "[ . 1 . 2]" 1
230 1 10 THR MG 1 13 PRO HB2 . . 4.950 4.819 4.790 4.843 . 0 0 "[ . 1 . 2]" 1
231 1 10 THR MG 1 13 PRO HB3 . . 4.230 3.659 3.636 3.677 . 0 0 "[ . 1 . 2]" 1
232 1 10 THR MG 1 13 PRO HD2 . . 4.930 4.817 4.811 4.824 . 0 0 "[ . 1 . 2]" 1
233 1 10 THR MG 1 13 PRO HD3 . . 3.700 3.717 3.715 3.718 0.018 16 0 "[ . 1 . 2]" 1
234 1 10 THR MG 1 13 PRO HG3 . . 4.940 4.972 4.964 4.977 0.037 10 0 "[ . 1 . 2]" 1
235 1 10 THR MG 1 14 GLY H . . 4.610 4.145 4.106 4.201 . 0 0 "[ . 1 . 2]" 1
236 1 10 THR MG 1 74 GLN HA . . 5.090 4.343 4.314 4.396 . 0 0 "[ . 1 . 2]" 1
237 1 10 THR MG 1 74 GLN HE21 . . 3.680 2.578 2.553 2.603 . 0 0 "[ . 1 . 2]" 1
238 1 10 THR MG 1 74 GLN HE22 . . 3.910 3.072 3.038 3.087 . 0 0 "[ . 1 . 2]" 1
239 1 10 THR MG 1 74 GLN HG2 . . 3.810 2.306 2.271 2.359 . 0 0 "[ . 1 . 2]" 1
240 1 10 THR MG 1 74 GLN HG3 . . 3.520 2.688 2.639 2.765 . 0 0 "[ . 1 . 2]" 1
241 1 10 THR MG 1 75 ARG H . . 4.410 3.715 3.666 3.740 . 0 0 "[ . 1 . 2]" 1
242 1 11 ILE H 1 11 ILE HB . . 3.300 2.877 2.861 2.910 . 0 0 "[ . 1 . 2]" 1
243 1 11 ILE H 1 11 ILE MD . . 4.100 3.554 3.538 3.585 . 0 0 "[ . 1 . 2]" 1
244 1 11 ILE H 1 11 ILE HG12 . . 3.600 3.546 3.504 3.601 0.001 7 0 "[ . 1 . 2]" 1
245 1 11 ILE H 1 11 ILE HG13 . . 3.470 2.149 2.116 2.202 . 0 0 "[ . 1 . 2]" 1
246 1 11 ILE H 1 11 ILE MG . . 4.070 3.901 3.891 3.917 . 0 0 "[ . 1 . 2]" 1
247 1 11 ILE H 1 12 SER H . . 2.800 2.053 2.008 2.079 . 0 0 "[ . 1 . 2]" 1
248 1 11 ILE H 1 74 GLN HA . . 6.000 5.939 5.905 5.979 . 0 0 "[ . 1 . 2]" 1
249 1 11 ILE H 1 74 GLN HE21 . . 5.040 4.577 4.550 4.610 . 0 0 "[ . 1 . 2]" 1
250 1 11 ILE H 1 74 GLN HE22 . . 5.790 5.805 5.794 5.811 0.021 6 0 "[ . 1 . 2]" 1
251 1 11 ILE H 1 74 GLN HG2 . . 4.930 4.127 4.068 4.160 . 0 0 "[ . 1 . 2]" 1
252 1 11 ILE H 1 74 GLN HG3 . . 5.570 5.273 5.213 5.331 . 0 0 "[ . 1 . 2]" 1
253 1 11 ILE H 1 75 ARG H . . 4.440 4.079 4.033 4.109 . 0 0 "[ . 1 . 2]" 1
254 1 11 ILE H 1 75 ARG HA . . 5.740 5.076 5.049 5.088 . 0 0 "[ . 1 . 2]" 1
255 1 11 ILE H 1 75 ARG HB3 . . 4.410 4.043 3.994 4.074 . 0 0 "[ . 1 . 2]" 1
256 1 11 ILE H 1 75 ARG HD2 . . 5.730 5.723 5.664 5.736 0.006 13 0 "[ . 1 . 2]" 1
257 1 11 ILE H 1 76 ALA H . . 4.820 4.562 4.529 4.597 . 0 0 "[ . 1 . 2]" 1
258 1 11 ILE H 1 76 ALA HA . . 3.210 2.533 2.501 2.614 . 0 0 "[ . 1 . 2]" 1
259 1 11 ILE H 1 76 ALA MB . . 3.680 3.279 3.260 3.296 . 0 0 "[ . 1 . 2]" 1
260 1 11 ILE HA 1 11 ILE MD . . 4.030 4.026 4.021 4.032 0.002 7 0 "[ . 1 . 2]" 1
261 1 11 ILE HA 1 11 ILE HG12 . . 3.560 2.917 2.898 2.945 . 0 0 "[ . 1 . 2]" 1
262 1 11 ILE HA 1 11 ILE HG13 . . 3.360 3.140 3.127 3.153 . 0 0 "[ . 1 . 2]" 1
263 1 11 ILE HA 1 11 ILE MG . . 3.220 2.255 2.247 2.262 . 0 0 "[ . 1 . 2]" 1
264 1 11 ILE HA 1 76 ALA HA . . 4.840 4.900 4.895 4.910 0.070 7 0 "[ . 1 . 2]" 1
265 1 11 ILE HB 1 11 ILE MD . . 3.060 2.401 2.363 2.414 . 0 0 "[ . 1 . 2]" 1
266 1 11 ILE HB 1 12 SER H . . 2.950 2.696 2.650 2.748 . 0 0 "[ . 1 . 2]" 1
267 1 11 ILE HB 1 12 SER HB2 . . 4.470 3.497 3.448 3.515 . 0 0 "[ . 1 . 2]" 1
268 1 11 ILE HB 1 12 SER HB3 . . 5.200 4.219 4.207 4.238 . 0 0 "[ . 1 . 2]" 1
269 1 11 ILE HB 1 75 ARG H . . 4.880 4.847 4.824 4.878 . 0 0 "[ . 1 . 2]" 1
270 1 11 ILE HB 1 75 ARG HA . . 5.520 5.283 5.253 5.320 . 0 0 "[ . 1 . 2]" 1
271 1 11 ILE HB 1 75 ARG HB3 . . 4.200 2.970 2.933 3.015 . 0 0 "[ . 1 . 2]" 1
272 1 11 ILE HB 1 75 ARG HD3 . . 4.720 2.531 2.466 2.615 . 0 0 "[ . 1 . 2]" 1
273 1 11 ILE HB 1 76 ALA H . . 5.630 5.418 5.397 5.454 . 0 0 "[ . 1 . 2]" 1
274 1 11 ILE HB 1 76 ALA HA . . 4.550 3.979 3.942 4.033 . 0 0 "[ . 1 . 2]" 1
275 1 11 ILE MD 1 12 SER H . . 4.700 4.223 4.177 4.247 . 0 0 "[ . 1 . 2]" 1
276 1 11 ILE MD 1 12 SER HB2 . . 5.960 5.068 4.976 5.098 . 0 0 "[ . 1 . 2]" 1
277 1 11 ILE MD 1 75 ARG HD2 . . 3.940 3.479 3.368 3.529 . 0 0 "[ . 1 . 2]" 1
278 1 11 ILE MD 1 75 ARG HD3 . . 3.760 2.145 2.081 2.166 . 0 0 "[ . 1 . 2]" 1
279 1 11 ILE MD 1 75 ARG HE . . 4.410 3.431 3.355 3.535 . 0 0 "[ . 1 . 2]" 1
280 1 11 ILE MD 1 76 ALA H . . 4.890 3.972 3.897 4.029 . 0 0 "[ . 1 . 2]" 1
281 1 11 ILE MD 1 76 ALA HA . . 3.660 2.741 2.695 2.816 . 0 0 "[ . 1 . 2]" 1
282 1 11 ILE HG12 1 11 ILE MG . . 3.240 2.294 2.286 2.303 . 0 0 "[ . 1 . 2]" 1
283 1 11 ILE HG12 1 12 SER H . . 5.020 4.838 4.819 4.858 . 0 0 "[ . 1 . 2]" 1
284 1 11 ILE HG12 1 76 ALA HA . . 3.850 3.781 3.752 3.796 . 0 0 "[ . 1 . 2]" 1
285 1 11 ILE HG13 1 11 ILE MG . . 3.290 3.194 3.190 3.197 . 0 0 "[ . 1 . 2]" 1
286 1 11 ILE HG13 1 12 SER H . . 3.860 3.684 3.654 3.698 . 0 0 "[ . 1 . 2]" 1
287 1 11 ILE HG13 1 12 SER HB2 . . 6.000 5.804 5.751 5.829 . 0 0 "[ . 1 . 2]" 1
288 1 11 ILE HG13 1 12 SER HB3 . . 6.000 6.041 6.034 6.049 0.049 10 0 "[ . 1 . 2]" 1
289 1 11 ILE HG13 1 75 ARG HA . . 5.890 5.605 5.557 5.640 . 0 0 "[ . 1 . 2]" 1
290 1 11 ILE HG13 1 75 ARG HD3 . . 5.080 3.836 3.769 3.883 . 0 0 "[ . 1 . 2]" 1
291 1 11 ILE HG13 1 76 ALA H . . 4.850 4.713 4.678 4.728 . 0 0 "[ . 1 . 2]" 1
292 1 11 ILE HG13 1 76 ALA HA . . 4.120 2.131 2.120 2.141 . 0 0 "[ . 1 . 2]" 1
293 1 11 ILE MG 1 12 SER H . . 3.930 3.898 3.872 3.930 . 0 0 "[ . 1 . 2]" 1
294 1 11 ILE MG 1 12 SER HA . . 4.850 4.382 4.360 4.404 . 0 0 "[ . 1 . 2]" 1
295 1 11 ILE MG 1 12 SER HB2 . . 3.940 3.880 3.865 3.907 . 0 0 "[ . 1 . 2]" 1
296 1 11 ILE MG 1 12 SER HB3 . . 5.080 5.035 5.011 5.083 0.003 7 0 "[ . 1 . 2]" 1
297 1 11 ILE MG 1 75 ARG HB3 . . 4.640 4.348 4.321 4.383 . 0 0 "[ . 1 . 2]" 1
298 1 11 ILE MG 1 75 ARG HD2 . . 3.960 3.975 3.973 3.978 0.018 20 0 "[ . 1 . 2]" 1
299 1 11 ILE MG 1 75 ARG HD3 . . 3.590 3.497 3.435 3.592 0.002 8 0 "[ . 1 . 2]" 1
300 1 11 ILE MG 1 75 ARG HE . . 5.470 5.276 5.190 5.373 . 0 0 "[ . 1 . 2]" 1
301 1 11 ILE MG 1 76 ALA HA . . 4.990 4.855 4.836 4.876 . 0 0 "[ . 1 . 2]" 1
302 1 12 SER H 1 12 SER HB2 . . 3.120 3.048 3.011 3.072 . 0 0 "[ . 1 . 2]" 1
303 1 12 SER H 1 12 SER HB3 . . 3.430 2.832 2.817 2.853 . 0 0 "[ . 1 . 2]" 1
304 1 12 SER H 1 13 PRO HA . . 4.920 4.832 4.810 4.851 . 0 0 "[ . 1 . 2]" 1
305 1 12 SER H 1 13 PRO HD2 . . 5.110 4.826 4.818 4.832 . 0 0 "[ . 1 . 2]" 1
306 1 12 SER H 1 13 PRO HD3 . . 5.010 4.449 4.422 4.468 . 0 0 "[ . 1 . 2]" 1
307 1 12 SER H 1 74 GLN HA . . 4.830 4.644 4.623 4.714 . 0 0 "[ . 1 . 2]" 1
308 1 12 SER H 1 74 GLN HE21 . . 5.270 5.158 5.091 5.223 . 0 0 "[ . 1 . 2]" 1
309 1 12 SER H 1 74 GLN HG2 . . 4.000 3.788 3.764 3.803 . 0 0 "[ . 1 . 2]" 1
310 1 12 SER H 1 74 GLN HG3 . . 4.560 4.578 4.573 4.583 0.023 2 0 "[ . 1 . 2]" 1
311 1 12 SER H 1 75 ARG H . . 3.390 2.837 2.817 2.854 . 0 0 "[ . 1 . 2]" 1
312 1 12 SER H 1 75 ARG HA . . 5.080 4.647 4.617 4.667 . 0 0 "[ . 1 . 2]" 1
313 1 12 SER H 1 75 ARG HB2 . . 5.000 4.182 4.139 4.215 . 0 0 "[ . 1 . 2]" 1
314 1 12 SER H 1 75 ARG HB3 . . 3.380 2.841 2.785 2.887 . 0 0 "[ . 1 . 2]" 1
315 1 12 SER H 1 75 ARG HD2 . . 5.310 4.830 4.736 4.887 . 0 0 "[ . 1 . 2]" 1
316 1 12 SER H 1 75 ARG HD3 . . 5.110 4.194 4.135 4.247 . 0 0 "[ . 1 . 2]" 1
317 1 12 SER H 1 76 ALA H . . 5.230 5.044 5.018 5.068 . 0 0 "[ . 1 . 2]" 1
318 1 12 SER H 1 76 ALA HA . . 4.270 4.082 4.064 4.112 . 0 0 "[ . 1 . 2]" 1
319 1 12 SER H 1 76 ALA MB . . 4.790 4.425 4.391 4.448 . 0 0 "[ . 1 . 2]" 1
320 1 12 SER HA 1 13 PRO HA . . 4.710 4.507 4.506 4.510 . 0 0 "[ . 1 . 2]" 1
321 1 12 SER HA 1 13 PRO HB2 . . 5.590 5.551 5.549 5.553 . 0 0 "[ . 1 . 2]" 1
322 1 12 SER HA 1 13 PRO HB3 . . 4.900 4.941 4.939 4.945 0.045 8 0 "[ . 1 . 2]" 1
323 1 12 SER HA 1 13 PRO HD2 . . 2.880 2.143 2.141 2.147 . 0 0 "[ . 1 . 2]" 1
324 1 12 SER HA 1 13 PRO HD3 . . 2.970 2.405 2.400 2.413 . 0 0 "[ . 1 . 2]" 1
325 1 12 SER HA 1 13 PRO HG2 . . 4.290 4.316 4.313 4.320 0.030 5 0 "[ . 1 . 2]" 1
326 1 12 SER HA 1 13 PRO HG3 . . 5.030 4.433 4.430 4.437 . 0 0 "[ . 1 . 2]" 1
327 1 12 SER HB2 1 75 ARG H . . 4.020 4.039 4.035 4.051 0.031 7 0 "[ . 1 . 2]" 1
328 1 12 SER HB2 1 75 ARG HA . . 5.990 5.581 5.528 5.623 . 0 0 "[ . 1 . 2]" 1
329 1 12 SER HB2 1 75 ARG HB2 . . 4.490 3.592 3.522 3.656 . 0 0 "[ . 1 . 2]" 1
330 1 12 SER HB2 1 75 ARG HB3 . . 3.970 2.750 2.697 2.790 . 0 0 "[ . 1 . 2]" 1
331 1 12 SER HB2 1 75 ARG HD2 . . 5.270 3.676 3.585 3.729 . 0 0 "[ . 1 . 2]" 1
332 1 12 SER HB2 1 75 ARG HD3 . . 4.800 4.263 4.176 4.331 . 0 0 "[ . 1 . 2]" 1
333 1 12 SER HB3 1 13 PRO HG2 . . 6.000 6.041 6.033 6.046 0.046 3 0 "[ . 1 . 2]" 1
334 1 12 SER HB3 1 75 ARG H . . 3.820 2.510 2.491 2.545 . 0 0 "[ . 1 . 2]" 1
335 1 12 SER HB3 1 75 ARG HB2 . . 4.180 2.544 2.500 2.600 . 0 0 "[ . 1 . 2]" 1
336 1 12 SER HB3 1 75 ARG HB3 . . 4.510 2.312 2.291 2.331 . 0 0 "[ . 1 . 2]" 1
337 1 13 PRO HA 1 14 GLY H . . 2.800 2.145 2.142 2.149 . 0 0 "[ . 1 . 2]" 1
338 1 13 PRO HA 1 14 GLY HA2 . . 4.600 4.404 4.401 4.410 . 0 0 "[ . 1 . 2]" 1
339 1 13 PRO HA 1 74 GLN HA . . 4.230 3.785 3.762 3.819 . 0 0 "[ . 1 . 2]" 1
340 1 13 PRO HA 1 74 GLN HE21 . . 5.540 5.391 5.363 5.414 . 0 0 "[ . 1 . 2]" 1
341 1 13 PRO HA 1 74 GLN HE22 . . 6.000 5.770 5.698 5.790 . 0 0 "[ . 1 . 2]" 1
342 1 13 PRO HA 1 74 GLN HG2 . . 4.090 3.722 3.688 3.738 . 0 0 "[ . 1 . 2]" 1
343 1 13 PRO HA 1 74 GLN HG3 . . 4.560 2.273 2.239 2.296 . 0 0 "[ . 1 . 2]" 1
344 1 13 PRO HA 1 75 ARG H . . 5.070 4.477 4.448 4.500 . 0 0 "[ . 1 . 2]" 1
345 1 13 PRO HB2 1 14 GLY H . . 3.900 3.525 3.498 3.573 . 0 0 "[ . 1 . 2]" 1
346 1 13 PRO HB2 1 14 GLY HA2 . . 4.980 4.647 4.633 4.664 . 0 0 "[ . 1 . 2]" 1
347 1 13 PRO HB3 1 14 GLY H . . 4.240 3.994 3.974 4.029 . 0 0 "[ . 1 . 2]" 1
348 1 14 GLY H 1 15 ASP H . . 3.720 3.732 3.727 3.744 0.024 5 0 "[ . 1 . 2]" 1
349 1 14 GLY H 1 71 SER H . . 4.850 4.713 4.690 4.750 . 0 0 "[ . 1 . 2]" 1
350 1 14 GLY H 1 71 SER HG . . 4.380 3.207 3.118 3.291 . 0 0 "[ . 1 . 2]" 1
351 1 14 GLY H 1 74 GLN HA . . 4.760 3.062 2.988 3.099 . 0 0 "[ . 1 . 2]" 1
352 1 14 GLY H 1 74 GLN QB . . 3.500 2.680 2.636 2.767 . 0 0 "[ . 1 . 2]" 1
353 1 14 GLY H 1 74 GLN HE21 . . 5.540 5.486 5.423 5.516 . 0 0 "[ . 1 . 2]" 1
354 1 14 GLY H 1 74 GLN HE22 . . 5.940 5.789 5.723 5.809 . 0 0 "[ . 1 . 2]" 1
355 1 14 GLY H 1 74 GLN HG2 . . 3.910 3.862 3.796 3.897 . 0 0 "[ . 1 . 2]" 1
356 1 14 GLY H 1 74 GLN HG3 . . 3.660 2.185 2.117 2.209 . 0 0 "[ . 1 . 2]" 1
357 1 14 GLY H 1 75 ARG H . . 4.720 4.691 4.604 4.721 0.001 8 0 "[ . 1 . 2]" 1
358 1 14 GLY HA2 1 15 ASP H . . 3.480 3.266 3.256 3.272 . 0 0 "[ . 1 . 2]" 1
359 1 14 GLY HA2 1 15 ASP HA . . 4.730 4.473 4.469 4.480 . 0 0 "[ . 1 . 2]" 1
360 1 14 GLY HA2 1 73 GLY H . . 5.700 5.374 5.335 5.554 . 0 0 "[ . 1 . 2]" 1
361 1 14 GLY HA2 1 73 GLY HA2 . . 5.350 4.404 4.366 4.532 . 0 0 "[ . 1 . 2]" 1
362 1 14 GLY HA2 1 73 GLY HA3 . . 4.340 3.069 3.029 3.240 . 0 0 "[ . 1 . 2]" 1
363 1 14 GLY HA2 1 74 GLN H . . 4.630 4.276 4.217 4.454 . 0 0 "[ . 1 . 2]" 1
364 1 14 GLY HA2 1 74 GLN HA . . 4.630 3.521 3.510 3.538 . 0 0 "[ . 1 . 2]" 1
365 1 14 GLY HA2 1 74 GLN QB . . 4.180 4.068 4.030 4.153 . 0 0 "[ . 1 . 2]" 1
366 1 14 GLY HA2 1 74 GLN HG2 . . 5.800 5.813 5.805 5.837 0.037 7 0 "[ . 1 . 2]" 1
367 1 14 GLY HA2 1 75 ARG H . . 5.640 5.507 5.496 5.528 . 0 0 "[ . 1 . 2]" 1
368 1 14 GLY HA3 1 15 ASP H . . 3.060 2.162 2.156 2.165 . 0 0 "[ . 1 . 2]" 1
369 1 14 GLY HA3 1 71 SER H . . 5.250 4.838 4.780 5.032 . 0 0 "[ . 1 . 2]" 1
370 1 14 GLY HA3 1 73 GLY HA2 . . 4.430 4.300 4.246 4.319 . 0 0 "[ . 1 . 2]" 1
371 1 14 GLY HA3 1 73 GLY HA3 . . 4.290 3.072 3.028 3.095 . 0 0 "[ . 1 . 2]" 1
372 1 14 GLY HA3 1 74 GLN H . . 3.250 3.038 2.988 3.126 . 0 0 "[ . 1 . 2]" 1
373 1 14 GLY HA3 1 74 GLN QB . . 4.140 2.636 2.597 2.711 . 0 0 "[ . 1 . 2]" 1
374 1 14 GLY HA3 1 75 ARG H . . 5.160 5.211 5.176 5.225 0.065 1 0 "[ . 1 . 2]" 1
375 1 15 ASP H 1 15 ASP HB2 . . 3.560 2.315 2.291 2.319 . 0 0 "[ . 1 . 2]" 1
376 1 15 ASP H 1 15 ASP QB . . 2.940 2.286 2.213 2.292 . 0 0 "[ . 1 . 2]" 1
377 1 15 ASP H 1 15 ASP HB3 . . 3.560 3.546 2.930 3.580 0.020 3 0 "[ . 1 . 2]" 1
378 1 15 ASP H 1 16 GLY H . . 3.110 2.460 2.448 2.510 . 0 0 "[ . 1 . 2]" 1
379 1 15 ASP H 1 16 GLY HA2 . . 5.770 4.644 4.632 4.703 . 0 0 "[ . 1 . 2]" 1
380 1 15 ASP H 1 17 ARG H . . 4.570 4.424 4.410 4.463 . 0 0 "[ . 1 . 2]" 1
381 1 15 ASP H 1 17 ARG HG2 . . 5.740 5.748 5.742 5.771 0.031 8 0 "[ . 1 . 2]" 1
382 1 15 ASP H 1 18 THR H . . 4.790 4.726 4.710 4.782 . 0 0 "[ . 1 . 2]" 1
383 1 15 ASP H 1 18 THR HB . . 4.950 4.830 4.815 4.841 . 0 0 "[ . 1 . 2]" 1
384 1 15 ASP H 1 18 THR MG . . 5.990 6.026 5.994 6.039 0.049 13 0 "[ . 1 . 2]" 1
385 1 15 ASP H 1 71 SER HB2 . . 3.720 3.141 3.110 3.250 . 0 0 "[ . 1 . 2]" 1
386 1 15 ASP H 1 71 SER HB3 . . 4.740 4.578 4.525 4.704 . 0 0 "[ . 1 . 2]" 1
387 1 15 ASP H 1 71 SER HG . . 4.040 2.335 2.207 2.568 . 0 0 "[ . 1 . 2]" 1
388 1 15 ASP H 1 72 VAL H . . 4.520 4.014 3.902 4.361 . 0 0 "[ . 1 . 2]" 1
389 1 15 ASP H 1 72 VAL HB . . 4.220 4.076 4.016 4.189 . 0 0 "[ . 1 . 2]" 1
390 1 15 ASP H 1 72 VAL MG1 . . 4.340 4.368 4.358 4.415 0.075 7 0 "[ . 1 . 2]" 1
391 1 15 ASP H 1 72 VAL MG2 . . 5.290 5.159 5.100 5.268 . 0 0 "[ . 1 . 2]" 1
392 1 15 ASP H 1 73 GLY H . . 5.370 4.912 4.844 4.927 . 0 0 "[ . 1 . 2]" 1
393 1 15 ASP H 1 74 GLN QB . . 3.810 3.750 3.713 3.820 0.010 2 0 "[ . 1 . 2]" 1
394 1 15 ASP HA 1 17 ARG H . . 4.800 4.225 4.163 4.255 . 0 0 "[ . 1 . 2]" 1
395 1 15 ASP QB 1 17 ARG H . . 4.280 2.463 2.270 2.476 . 0 0 "[ . 1 . 2]" 1
396 1 15 ASP QB 1 17 ARG HG2 . . 5.280 2.700 2.658 3.225 . 0 0 "[ . 1 . 2]" 1
397 1 15 ASP QB 1 18 THR H . . 4.680 2.748 2.472 2.780 . 0 0 "[ . 1 . 2]" 1
398 1 15 ASP QB 1 71 SER HB2 . . 5.740 2.667 2.629 2.757 . 0 0 "[ . 1 . 2]" 1
399 1 15 ASP QB 1 72 VAL MG1 . . 5.710 3.922 3.423 3.966 . 0 0 "[ . 1 . 2]" 1
400 1 15 ASP QB 1 72 VAL MG2 . . 5.460 4.096 4.026 4.217 . 0 0 "[ . 1 . 2]" 1
401 1 15 ASP HB2 1 16 GLY H . . 4.750 2.652 2.603 3.451 . 0 0 "[ . 1 . 2]" 1
402 1 15 ASP HB2 1 17 ARG H . . 4.980 3.040 2.976 4.019 . 0 0 "[ . 1 . 2]" 1
403 1 15 ASP HB2 1 18 THR H . . 5.340 3.026 2.965 4.042 . 0 0 "[ . 1 . 2]" 1
404 1 15 ASP HB3 1 16 GLY H . . 4.750 3.348 2.569 3.400 . 0 0 "[ . 1 . 2]" 1
405 1 15 ASP HB3 1 17 ARG H . . 4.980 2.620 2.283 2.647 . 0 0 "[ . 1 . 2]" 1
406 1 15 ASP HB3 1 18 THR H . . 5.340 3.242 2.495 3.322 . 0 0 "[ . 1 . 2]" 1
407 1 16 GLY H 1 17 ARG H . . 3.210 2.577 2.560 2.604 . 0 0 "[ . 1 . 2]" 1
408 1 16 GLY H 1 17 ARG HA . . 5.320 5.055 5.039 5.076 . 0 0 "[ . 1 . 2]" 1
409 1 16 GLY H 1 17 ARG HG2 . . 4.780 4.452 4.428 4.469 . 0 0 "[ . 1 . 2]" 1
410 1 16 GLY H 1 18 THR H . . 3.920 3.243 3.230 3.271 . 0 0 "[ . 1 . 2]" 1
411 1 16 GLY H 1 18 THR MG . . 6.000 6.009 5.990 6.015 0.015 4 0 "[ . 1 . 2]" 1
412 1 16 GLY H 1 19 PHE QE . . 5.140 5.093 5.070 5.161 0.021 7 0 "[ . 1 . 2]" 1
413 1 16 GLY H 1 19 PHE HZ . . 6.000 5.452 5.414 5.788 . 0 0 "[ . 1 . 2]" 1
414 1 16 GLY H 1 71 SER HA . . 4.730 4.401 4.391 4.440 . 0 0 "[ . 1 . 2]" 1
415 1 16 GLY H 1 71 SER HB2 . . 3.410 1.986 1.958 2.015 . 0 0 "[ . 1 . 2]" 1
416 1 16 GLY H 1 71 SER HB3 . . 3.550 2.810 2.773 2.932 . 0 0 "[ . 1 . 2]" 1
417 1 16 GLY H 1 71 SER HG . . 3.220 1.882 1.641 2.092 . 0 0 "[ . 1 . 2]" 1
418 1 16 GLY H 1 72 VAL H . . 4.630 4.193 4.092 4.576 . 0 0 "[ . 1 . 2]" 1
419 1 16 GLY H 1 72 VAL HB . . 5.380 5.125 5.084 5.216 . 0 0 "[ . 1 . 2]" 1
420 1 16 GLY H 1 72 VAL MG1 . . 5.870 5.902 5.896 5.917 0.047 8 0 "[ . 1 . 2]" 1
421 1 16 GLY H 1 74 GLN QB . . 4.660 4.301 4.158 4.385 . 0 0 "[ . 1 . 2]" 1
422 1 16 GLY HA2 1 17 ARG HA . . 5.220 4.483 4.480 4.488 . 0 0 "[ . 1 . 2]" 1
423 1 16 GLY HA2 1 18 THR H . . 4.790 4.219 4.196 4.250 . 0 0 "[ . 1 . 2]" 1
424 1 16 GLY HA2 1 19 PHE QE . . 4.410 3.984 3.953 4.051 . 0 0 "[ . 1 . 2]" 1
425 1 16 GLY HA2 1 19 PHE HZ . . 4.590 3.702 3.655 4.068 . 0 0 "[ . 1 . 2]" 1
426 1 16 GLY HA2 1 71 SER HB2 . . 4.980 3.423 3.312 3.461 . 0 0 "[ . 1 . 2]" 1
427 1 16 GLY HA2 1 71 SER HB3 . . 5.020 2.845 2.705 3.039 . 0 0 "[ . 1 . 2]" 1
428 1 16 GLY HA2 1 71 SER HG . . 4.800 3.189 2.857 3.380 . 0 0 "[ . 1 . 2]" 1
429 1 16 GLY HA3 1 17 ARG HA . . 5.530 4.601 4.592 4.612 . 0 0 "[ . 1 . 2]" 1
430 1 16 GLY HA3 1 17 ARG HG3 . . 6.000 5.853 5.835 5.897 . 0 0 "[ . 1 . 2]" 1
431 1 16 GLY HA3 1 18 THR H . . 5.090 4.800 4.785 4.806 . 0 0 "[ . 1 . 2]" 1
432 1 16 GLY HA3 1 19 PHE QE . . 5.350 4.952 4.920 5.040 . 0 0 "[ . 1 . 2]" 1
433 1 16 GLY HA3 1 19 PHE HZ . . 5.660 5.066 5.004 5.420 . 0 0 "[ . 1 . 2]" 1
434 1 16 GLY HA3 1 71 SER HB3 . . 5.350 4.415 4.303 4.580 . 0 0 "[ . 1 . 2]" 1
435 1 16 GLY HA3 1 71 SER HG . . 4.830 4.238 3.915 4.452 . 0 0 "[ . 1 . 2]" 1
436 1 17 ARG H 1 17 ARG HB2 . . 4.080 3.842 3.833 3.854 . 0 0 "[ . 1 . 2]" 1
437 1 17 ARG H 1 17 ARG QB . . 3.380 3.181 3.165 3.192 . 0 0 "[ . 1 . 2]" 1
438 1 17 ARG H 1 17 ARG HB3 . . 4.080 3.394 3.372 3.412 . 0 0 "[ . 1 . 2]" 1
439 1 17 ARG H 1 17 ARG QD . . 4.710 4.265 4.140 4.386 . 0 0 "[ . 1 . 2]" 1
440 1 17 ARG H 1 17 ARG HG2 . . 3.190 2.336 2.317 2.352 . 0 0 "[ . 1 . 2]" 1
441 1 17 ARG H 1 17 ARG HG3 . . 3.470 3.154 3.135 3.203 . 0 0 "[ . 1 . 2]" 1
442 1 17 ARG H 1 18 THR H . . 2.600 1.832 1.795 1.858 . 0 0 "[ . 1 . 2]" 1
443 1 17 ARG H 1 18 THR HA . . 4.610 4.527 4.509 4.536 . 0 0 "[ . 1 . 2]" 1
444 1 17 ARG H 1 18 THR HB . . 4.230 4.227 4.130 4.242 0.012 13 0 "[ . 1 . 2]" 1
445 1 17 ARG H 1 18 THR MG . . 5.310 5.168 5.160 5.186 . 0 0 "[ . 1 . 2]" 1
446 1 17 ARG H 1 19 PHE QE . . 4.310 4.318 4.315 4.328 0.018 7 0 "[ . 1 . 2]" 1
447 1 17 ARG H 1 71 SER HB2 . . 3.520 3.106 3.077 3.120 . 0 0 "[ . 1 . 2]" 1
448 1 17 ARG H 1 71 SER HB3 . . 4.050 3.685 3.670 3.700 . 0 0 "[ . 1 . 2]" 1
449 1 17 ARG H 1 71 SER HG . . 4.530 4.339 4.126 4.528 . 0 0 "[ . 1 . 2]" 1
450 1 17 ARG H 1 72 VAL H . . 5.310 4.928 4.821 5.317 0.007 1 0 "[ . 1 . 2]" 1
451 1 17 ARG H 1 72 VAL MG2 . . 6.000 5.844 5.756 6.004 0.004 2 0 "[ . 1 . 2]" 1
452 1 17 ARG HA 1 17 ARG QB . . 2.570 2.177 2.168 2.180 . 0 0 "[ . 1 . 2]" 1
453 1 17 ARG HA 1 17 ARG QD . . 4.330 4.286 4.251 4.415 0.085 18 0 "[ . 1 . 2]" 1
454 1 17 ARG HA 1 17 ARG HG2 . . 3.910 3.699 3.686 3.708 . 0 0 "[ . 1 . 2]" 1
455 1 17 ARG HA 1 17 ARG HG3 . . 3.930 3.871 3.862 3.888 . 0 0 "[ . 1 . 2]" 1
456 1 17 ARG HA 1 18 THR HA . . 4.570 4.511 4.483 4.526 . 0 0 "[ . 1 . 2]" 1
457 1 17 ARG HA 1 18 THR HB . . 5.920 5.929 5.848 5.939 0.019 10 0 "[ . 1 . 2]" 1
458 1 17 ARG HA 1 19 PHE H . . 4.910 4.906 4.888 4.928 0.018 7 0 "[ . 1 . 2]" 1
459 1 17 ARG HA 1 19 PHE QE . . 4.190 2.662 2.639 2.717 . 0 0 "[ . 1 . 2]" 1
460 1 17 ARG HA 1 19 PHE HZ . . 5.330 4.817 4.778 4.937 . 0 0 "[ . 1 . 2]" 1
461 1 17 ARG HA 1 71 SER HB2 . . 5.380 5.090 5.053 5.106 . 0 0 "[ . 1 . 2]" 1
462 1 17 ARG HA 1 71 SER HB3 . . 5.020 4.726 4.667 4.759 . 0 0 "[ . 1 . 2]" 1
463 1 17 ARG QB 1 17 ARG QD . . 2.880 2.141 2.123 2.207 . 0 0 "[ . 1 . 2]" 1
464 1 17 ARG QB 1 18 THR H . . 4.110 3.907 3.890 3.943 . 0 0 "[ . 1 . 2]" 1
465 1 17 ARG QB 1 19 PHE QE . . 4.520 4.431 4.406 4.487 . 0 0 "[ . 1 . 2]" 1
466 1 17 ARG HB2 1 17 ARG QD . . 3.390 2.462 2.374 2.872 . 0 0 "[ . 1 . 2]" 1
467 1 17 ARG HB2 1 18 THR H . . 4.670 4.286 4.268 4.329 . 0 0 "[ . 1 . 2]" 1
468 1 17 ARG HB2 1 19 PHE QE . . 5.170 5.113 5.079 5.172 0.002 7 0 "[ . 1 . 2]" 1
469 1 17 ARG HB3 1 17 ARG QD . . 3.390 2.370 2.280 2.621 . 0 0 "[ . 1 . 2]" 1
470 1 17 ARG HB3 1 18 THR H . . 4.670 4.505 4.478 4.542 . 0 0 "[ . 1 . 2]" 1
471 1 17 ARG HB3 1 19 PHE QE . . 5.170 4.857 4.828 4.922 . 0 0 "[ . 1 . 2]" 1
472 1 17 ARG QD 1 18 THR H . . 5.420 5.234 5.198 5.310 . 0 0 "[ . 1 . 2]" 1
473 1 17 ARG HG2 1 18 THR H . . 3.720 3.673 3.587 3.721 0.001 7 0 "[ . 1 . 2]" 1
474 1 17 ARG HG2 1 18 THR HA . . 5.940 5.484 5.398 5.515 . 0 0 "[ . 1 . 2]" 1
475 1 17 ARG HG2 1 18 THR HB . . 6.000 5.381 5.227 5.422 . 0 0 "[ . 1 . 2]" 1
476 1 17 ARG HG2 1 71 SER HB3 . . 6.000 6.017 6.007 6.022 0.022 20 0 "[ . 1 . 2]" 1
477 1 17 ARG HG3 1 18 THR H . . 4.010 3.645 3.595 3.782 . 0 0 "[ . 1 . 2]" 1
478 1 17 ARG HG3 1 18 THR HA . . 4.760 4.432 4.369 4.539 . 0 0 "[ . 1 . 2]" 1
479 1 18 THR H 1 18 THR HB . . 3.530 2.850 2.818 2.861 . 0 0 "[ . 1 . 2]" 1
480 1 18 THR H 1 18 THR MG . . 3.960 3.932 3.926 3.944 . 0 0 "[ . 1 . 2]" 1
481 1 18 THR H 1 19 PHE H . . 4.100 3.845 3.767 3.886 . 0 0 "[ . 1 . 2]" 1
482 1 18 THR H 1 19 PHE QD . . 4.940 3.901 3.667 3.949 . 0 0 "[ . 1 . 2]" 1
483 1 18 THR H 1 19 PHE QE . . 4.870 4.120 4.029 4.159 . 0 0 "[ . 1 . 2]" 1
484 1 18 THR H 1 19 PHE HZ . . 5.890 5.572 5.538 5.722 . 0 0 "[ . 1 . 2]" 1
485 1 18 THR H 1 71 SER H . . 6.000 6.008 5.998 6.024 0.024 1 0 "[ . 1 . 2]" 1
486 1 18 THR H 1 71 SER HA . . 4.580 4.121 4.100 4.189 . 0 0 "[ . 1 . 2]" 1
487 1 18 THR H 1 71 SER HB2 . . 3.580 2.509 2.495 2.538 . 0 0 "[ . 1 . 2]" 1
488 1 18 THR H 1 71 SER HB3 . . 3.920 3.183 3.112 3.233 . 0 0 "[ . 1 . 2]" 1
489 1 18 THR H 1 71 SER HG . . 4.700 4.479 4.345 4.621 . 0 0 "[ . 1 . 2]" 1
490 1 18 THR H 1 72 VAL H . . 3.980 3.657 3.549 3.994 0.014 2 0 "[ . 1 . 2]" 1
491 1 18 THR H 1 72 VAL MG2 . . 4.850 4.574 4.471 4.749 . 0 0 "[ . 1 . 2]" 1
492 1 18 THR H 1 107 LEU QD . . 5.920 5.880 5.368 6.064 0.144 7 0 "[ . 1 . 2]" 1
493 1 18 THR H 1 110 LEU QD . . 5.920 5.791 5.669 5.957 0.037 7 0 "[ . 1 . 2]" 1
494 1 18 THR HA 1 18 THR MG . . 2.910 2.292 2.278 2.364 . 0 0 "[ . 1 . 2]" 1
495 1 18 THR HA 1 19 PHE H . . 2.510 2.219 2.214 2.223 . 0 0 "[ . 1 . 2]" 1
496 1 18 THR HA 1 19 PHE HA . . 4.880 4.439 4.436 4.442 . 0 0 "[ . 1 . 2]" 1
497 1 18 THR HA 1 19 PHE QD . . 3.880 3.769 3.566 3.797 . 0 0 "[ . 1 . 2]" 1
498 1 18 THR HA 1 19 PHE QE . . 5.320 5.314 5.234 5.327 0.007 2 0 "[ . 1 . 2]" 1
499 1 18 THR HA 1 71 SER HA . . 5.480 5.305 5.278 5.369 . 0 0 "[ . 1 . 2]" 1
500 1 18 THR HA 1 71 SER HB3 . . 5.740 5.385 5.225 5.503 . 0 0 "[ . 1 . 2]" 1
501 1 18 THR HA 1 72 VAL H . . 4.950 4.673 4.626 4.811 . 0 0 "[ . 1 . 2]" 1
502 1 18 THR HA 1 72 VAL HB . . 5.170 5.184 5.062 5.200 0.030 18 0 "[ . 1 . 2]" 1
503 1 18 THR HA 1 72 VAL MG2 . . 4.470 4.223 4.101 4.373 . 0 0 "[ . 1 . 2]" 1
504 1 18 THR HA 1 110 LEU QD . . 4.930 4.531 4.401 4.937 0.007 7 0 "[ . 1 . 2]" 1
505 1 18 THR HB 1 19 PHE H . . 5.240 4.374 4.366 4.396 . 0 0 "[ . 1 . 2]" 1
506 1 18 THR HB 1 19 PHE HA . . 5.280 4.770 4.757 4.830 . 0 0 "[ . 1 . 2]" 1
507 1 18 THR HB 1 71 SER HA . . 4.780 4.446 4.385 4.785 0.005 7 0 "[ . 1 . 2]" 1
508 1 18 THR HB 1 71 SER HB2 . . 4.920 3.575 3.518 3.764 . 0 0 "[ . 1 . 2]" 1
509 1 18 THR HB 1 71 SER HB3 . . 5.150 4.925 4.788 5.161 0.011 7 0 "[ . 1 . 2]" 1
510 1 18 THR HB 1 72 VAL H . . 3.160 2.572 2.477 2.829 . 0 0 "[ . 1 . 2]" 1
511 1 18 THR HB 1 72 VAL HA . . 4.760 4.570 4.519 4.768 0.008 7 0 "[ . 1 . 2]" 1
512 1 18 THR HB 1 72 VAL HB . . 3.600 2.201 2.180 2.207 . 0 0 "[ . 1 . 2]" 1
513 1 18 THR HB 1 72 VAL MG1 . . 3.980 3.774 3.715 3.789 . 0 0 "[ . 1 . 2]" 1
514 1 18 THR HB 1 72 VAL MG2 . . 3.190 2.472 2.370 2.662 . 0 0 "[ . 1 . 2]" 1
515 1 18 THR HB 1 110 LEU QD . . 4.870 4.090 3.965 4.219 . 0 0 "[ . 1 . 2]" 1
516 1 18 THR MG 1 19 PHE H . . 3.650 3.518 3.470 3.527 . 0 0 "[ . 1 . 2]" 1
517 1 18 THR MG 1 19 PHE HB2 . . 5.480 5.434 5.313 5.448 . 0 0 "[ . 1 . 2]" 1
518 1 18 THR MG 1 19 PHE HB3 . . 6.000 6.007 5.902 6.021 0.021 4 0 "[ . 1 . 2]" 1
519 1 18 THR MG 1 71 SER HA . . 5.130 5.000 4.917 5.136 0.006 7 0 "[ . 1 . 2]" 1
520 1 18 THR MG 1 71 SER HB2 . . 5.570 4.903 4.851 4.979 . 0 0 "[ . 1 . 2]" 1
521 1 18 THR MG 1 71 SER HB3 . . 6.000 5.771 5.615 5.898 . 0 0 "[ . 1 . 2]" 1
522 1 18 THR MG 1 72 VAL H . . 3.680 3.661 3.603 3.714 0.034 7 0 "[ . 1 . 2]" 1
523 1 18 THR MG 1 72 VAL HA . . 4.850 4.854 4.843 4.877 0.027 7 0 "[ . 1 . 2]" 1
524 1 18 THR MG 1 72 VAL HB . . 3.730 3.081 2.957 3.129 . 0 0 "[ . 1 . 2]" 1
525 1 18 THR MG 1 72 VAL MG2 . . 2.660 2.022 1.969 2.077 . 0 0 "[ . 1 . 2]" 1
526 1 18 THR MG 1 110 LEU QD . . 2.940 2.401 2.304 2.510 . 0 0 "[ . 1 . 2]" 1
527 1 19 PHE H 1 19 PHE HB2 . . 3.090 2.481 2.448 2.490 . 0 0 "[ . 1 . 2]" 1
528 1 19 PHE H 1 19 PHE HB3 . . 3.780 3.673 3.651 3.678 . 0 0 "[ . 1 . 2]" 1
529 1 19 PHE H 1 19 PHE QD . . 3.170 2.379 2.195 2.405 . 0 0 "[ . 1 . 2]" 1
530 1 19 PHE H 1 19 PHE QE . . 4.520 4.545 4.460 4.559 0.039 1 0 "[ . 1 . 2]" 1
531 1 19 PHE H 1 20 PRO HD2 . . 5.120 4.952 4.888 4.970 . 0 0 "[ . 1 . 2]" 1
532 1 19 PHE H 1 20 PRO HD3 . . 5.250 5.053 5.026 5.202 . 0 0 "[ . 1 . 2]" 1
533 1 19 PHE H 1 71 SER HA . . 4.640 4.573 4.466 4.640 0.000 2 0 "[ . 1 . 2]" 1
534 1 19 PHE H 1 71 SER HB2 . . 5.410 5.124 5.060 5.157 . 0 0 "[ . 1 . 2]" 1
535 1 19 PHE H 1 71 SER HB3 . . 5.040 4.957 4.783 5.016 . 0 0 "[ . 1 . 2]" 1
536 1 19 PHE H 1 72 VAL MG2 . . 4.870 4.679 4.322 4.797 . 0 0 "[ . 1 . 2]" 1
537 1 19 PHE H 1 110 LEU QD . . 5.030 4.480 4.358 5.033 0.003 7 0 "[ . 1 . 2]" 1
538 1 19 PHE HA 1 19 PHE QD . . 3.470 3.086 3.064 3.171 . 0 0 "[ . 1 . 2]" 1
539 1 19 PHE HA 1 19 PHE QE . . 4.840 4.690 4.668 4.721 . 0 0 "[ . 1 . 2]" 1
540 1 19 PHE HA 1 20 PRO HD2 . . 3.300 2.469 2.457 2.488 . 0 0 "[ . 1 . 2]" 1
541 1 19 PHE HA 1 20 PRO HD3 . . 3.160 2.344 2.311 2.500 . 0 0 "[ . 1 . 2]" 1
542 1 19 PHE HA 1 20 PRO HG2 . . 4.580 4.583 4.573 4.593 0.013 7 0 "[ . 1 . 2]" 1
543 1 19 PHE HA 1 20 PRO HG3 . . 4.950 4.517 4.494 4.633 . 0 0 "[ . 1 . 2]" 1
544 1 19 PHE HA 1 68 ALA HA . . 5.870 5.121 5.017 5.233 . 0 0 "[ . 1 . 2]" 1
545 1 19 PHE HA 1 70 MET H . . 5.730 5.480 5.410 5.623 . 0 0 "[ . 1 . 2]" 1
546 1 19 PHE HA 1 71 SER HA . . 3.690 2.486 2.308 2.561 . 0 0 "[ . 1 . 2]" 1
547 1 19 PHE HA 1 72 VAL H . . 4.250 3.702 3.316 3.790 . 0 0 "[ . 1 . 2]" 1
548 1 19 PHE HA 1 72 VAL MG2 . . 4.130 3.888 3.357 3.950 . 0 0 "[ . 1 . 2]" 1
549 1 19 PHE HA 1 107 LEU QD . . 4.450 3.723 3.197 3.874 . 0 0 "[ . 1 . 2]" 1
550 1 19 PHE HB2 1 20 PRO HD2 . . 4.200 3.826 3.729 3.846 . 0 0 "[ . 1 . 2]" 1
551 1 19 PHE HB2 1 20 PRO HD3 . . 4.740 4.786 4.772 4.841 0.101 7 0 "[ . 1 . 2]" 1
552 1 19 PHE HB2 1 110 LEU QD . . 5.920 5.306 5.188 5.782 . 0 0 "[ . 1 . 2]" 1
553 1 19 PHE HB3 1 20 PRO HD2 . . 3.900 2.275 2.177 2.289 . 0 0 "[ . 1 . 2]" 1
554 1 19 PHE HB3 1 20 PRO HD3 . . 4.020 3.621 3.606 3.634 . 0 0 "[ . 1 . 2]" 1
555 1 19 PHE HB3 1 20 PRO HG2 . . 4.940 4.102 3.868 4.150 . 0 0 "[ . 1 . 2]" 1
556 1 19 PHE HB3 1 20 PRO HG3 . . 5.090 4.966 4.795 4.991 . 0 0 "[ . 1 . 2]" 1
557 1 19 PHE HB3 1 67 VAL QG . . 5.920 5.652 5.460 5.893 . 0 0 "[ . 1 . 2]" 1
558 1 19 PHE HB3 1 68 ALA HA . . 5.180 3.759 3.586 4.021 . 0 0 "[ . 1 . 2]" 1
559 1 19 PHE HB3 1 68 ALA MB . . 5.530 4.275 4.195 4.398 . 0 0 "[ . 1 . 2]" 1
560 1 19 PHE HB3 1 70 MET H . . 5.140 5.151 5.142 5.160 0.020 5 0 "[ . 1 . 2]" 1
561 1 19 PHE HB3 1 71 SER HB3 . . 6.000 5.409 5.275 5.473 . 0 0 "[ . 1 . 2]" 1
562 1 19 PHE HB3 1 107 LEU QD . . 5.920 5.002 4.671 5.110 . 0 0 "[ . 1 . 2]" 1
563 1 19 PHE HB3 1 110 LEU QD . . 5.920 5.139 5.035 5.508 . 0 0 "[ . 1 . 2]" 1
564 1 19 PHE QD 1 20 PRO HD2 . . 3.690 2.974 2.950 3.047 . 0 0 "[ . 1 . 2]" 1
565 1 19 PHE QD 1 20 PRO HD3 . . 4.510 4.112 4.043 4.317 . 0 0 "[ . 1 . 2]" 1
566 1 19 PHE QD 1 20 PRO HG2 . . 4.830 4.855 4.819 4.866 0.036 8 0 "[ . 1 . 2]" 1
567 1 19 PHE QD 1 69 GLN HA . . 4.000 3.644 3.578 3.703 . 0 0 "[ . 1 . 2]" 1
568 1 19 PHE QD 1 70 MET HA . . 4.570 4.208 4.160 4.363 . 0 0 "[ . 1 . 2]" 1
569 1 19 PHE QD 1 71 SER H . . 5.150 4.706 4.661 4.837 . 0 0 "[ . 1 . 2]" 1
570 1 19 PHE QD 1 71 SER HA . . 4.380 3.640 3.600 3.754 . 0 0 "[ . 1 . 2]" 1
571 1 19 PHE QD 1 71 SER HB2 . . 5.230 4.728 4.593 4.757 . 0 0 "[ . 1 . 2]" 1
572 1 19 PHE QD 1 71 SER HB3 . . 4.070 3.793 3.693 3.831 . 0 0 "[ . 1 . 2]" 1
573 1 19 PHE QD 1 72 VAL H . . 5.460 5.320 5.062 5.350 . 0 0 "[ . 1 . 2]" 1
574 1 19 PHE QE 1 20 PRO HD2 . . 5.830 5.197 5.180 5.210 . 0 0 "[ . 1 . 2]" 1
575 1 19 PHE QE 1 69 GLN HA . . 4.200 3.329 3.036 3.409 . 0 0 "[ . 1 . 2]" 1
576 1 19 PHE QE 1 69 GLN HB2 . . 6.000 5.312 5.172 5.417 . 0 0 "[ . 1 . 2]" 1
577 1 19 PHE QE 1 70 MET HA . . 4.080 3.301 3.263 3.495 . 0 0 "[ . 1 . 2]" 1
578 1 19 PHE QE 1 70 MET HB3 . . 6.000 5.454 5.418 5.612 . 0 0 "[ . 1 . 2]" 1
579 1 19 PHE QE 1 71 SER H . . 5.420 4.181 4.132 4.414 . 0 0 "[ . 1 . 2]" 1
580 1 19 PHE QE 1 71 SER HB2 . . 4.970 4.619 4.579 4.632 . 0 0 "[ . 1 . 2]" 1
581 1 19 PHE QE 1 71 SER HB3 . . 3.950 3.364 3.334 3.377 . 0 0 "[ . 1 . 2]" 1
582 1 19 PHE QE 1 74 GLN QB . . 6.000 5.705 5.665 5.891 . 0 0 "[ . 1 . 2]" 1
583 1 19 PHE HZ 1 70 MET HA . . 5.460 5.103 5.066 5.153 . 0 0 "[ . 1 . 2]" 1
584 1 19 PHE HZ 1 71 SER HB2 . . 5.640 5.196 5.171 5.334 . 0 0 "[ . 1 . 2]" 1
585 1 19 PHE HZ 1 71 SER HB3 . . 4.480 3.520 3.493 3.625 . 0 0 "[ . 1 . 2]" 1
586 1 20 PRO HA 1 24 GLN HE21 . . 5.020 3.466 3.244 4.031 . 0 0 "[ . 1 . 2]" 1
587 1 20 PRO HA 1 24 GLN HE22 . . 4.970 2.761 2.527 3.397 . 0 0 "[ . 1 . 2]" 1
588 1 20 PRO HA 1 110 LEU MD1 . . 3.350 2.531 2.376 2.599 . 0 0 "[ . 1 . 2]" 1
589 1 20 PRO HA 1 110 LEU QD . . 2.900 2.153 2.057 2.339 . 0 0 "[ . 1 . 2]" 1
590 1 20 PRO HA 1 110 LEU MD2 . . 3.350 2.376 2.198 3.492 0.142 7 0 "[ . 1 . 2]" 1
591 1 20 PRO QB 1 67 VAL QG . . 3.690 3.312 3.081 3.517 . 0 0 "[ . 1 . 2]" 1
592 1 20 PRO QB 1 107 LEU QD . . 3.820 3.208 2.865 3.292 . 0 0 "[ . 1 . 2]" 1
593 1 20 PRO QB 1 110 LEU QD . . 3.280 2.003 1.985 2.141 . 0 0 "[ . 1 . 2]" 1
594 1 20 PRO QB 1 110 LEU HG . . 4.730 4.481 3.572 4.547 . 0 0 "[ . 1 . 2]" 1
595 1 20 PRO HD2 1 67 VAL QG . . 4.660 4.156 3.943 4.365 . 0 0 "[ . 1 . 2]" 1
596 1 20 PRO HD2 1 70 MET H . . 4.880 4.170 4.116 4.317 . 0 0 "[ . 1 . 2]" 1
597 1 20 PRO HD2 1 70 MET HA . . 5.920 5.858 5.784 5.921 0.001 8 0 "[ . 1 . 2]" 1
598 1 20 PRO HD2 1 71 SER HA . . 4.660 4.042 3.839 4.137 . 0 0 "[ . 1 . 2]" 1
599 1 20 PRO HD2 1 71 SER HB3 . . 6.000 5.832 5.720 5.876 . 0 0 "[ . 1 . 2]" 1
600 1 20 PRO HD2 1 107 LEU MD1 . . 5.020 4.379 3.372 4.669 . 0 0 "[ . 1 . 2]" 1
601 1 20 PRO HD2 1 107 LEU QD . . 4.010 3.439 3.292 3.501 . 0 0 "[ . 1 . 2]" 1
602 1 20 PRO HD2 1 107 LEU MD2 . . 5.020 3.809 3.415 4.703 . 0 0 "[ . 1 . 2]" 1
603 1 20 PRO HD2 1 110 LEU QD . . 4.750 4.231 4.137 4.473 . 0 0 "[ . 1 . 2]" 1
604 1 20 PRO HD3 1 67 VAL QG . . 4.500 4.167 3.912 4.374 . 0 0 "[ . 1 . 2]" 1
605 1 20 PRO HD3 1 68 ALA HA . . 5.020 4.251 4.166 4.414 . 0 0 "[ . 1 . 2]" 1
606 1 20 PRO HD3 1 70 MET H . . 5.250 4.922 4.806 5.069 . 0 0 "[ . 1 . 2]" 1
607 1 20 PRO HD3 1 71 SER H . . 5.730 5.565 5.479 5.611 . 0 0 "[ . 1 . 2]" 1
608 1 20 PRO HD3 1 71 SER HA . . 4.280 3.466 3.401 3.515 . 0 0 "[ . 1 . 2]" 1
609 1 20 PRO HD3 1 72 VAL MG2 . . 4.660 3.975 3.526 4.054 . 0 0 "[ . 1 . 2]" 1
610 1 20 PRO HD3 1 107 LEU HB2 . . 5.620 5.608 5.333 5.631 0.011 5 0 "[ . 1 . 2]" 1
611 1 20 PRO HD3 1 107 LEU MD1 . . 3.530 2.943 2.147 3.181 . 0 0 "[ . 1 . 2]" 1
612 1 20 PRO HD3 1 107 LEU MD2 . . 3.530 2.654 2.354 3.213 . 0 0 "[ . 1 . 2]" 1
613 1 20 PRO HD3 1 107 LEU HG . . 5.210 3.590 3.113 4.262 . 0 0 "[ . 1 . 2]" 1
614 1 20 PRO HD3 1 110 LEU QD . . 4.790 3.154 3.056 3.292 . 0 0 "[ . 1 . 2]" 1
615 1 20 PRO HG2 1 67 VAL QG . . 3.500 2.872 2.599 3.102 . 0 0 "[ . 1 . 2]" 1
616 1 20 PRO HG2 1 68 ALA H . . 5.280 4.397 4.214 4.649 . 0 0 "[ . 1 . 2]" 1
617 1 20 PRO HG2 1 68 ALA HA . . 3.520 2.332 2.281 2.568 . 0 0 "[ . 1 . 2]" 1
618 1 20 PRO HG2 1 68 ALA MB . . 4.150 3.523 3.451 3.677 . 0 0 "[ . 1 . 2]" 1
619 1 20 PRO HG3 1 67 VAL QG . . 3.250 2.651 2.295 2.899 . 0 0 "[ . 1 . 2]" 1
620 1 20 PRO HG3 1 68 ALA HA . . 4.040 3.686 3.557 3.763 . 0 0 "[ . 1 . 2]" 1
621 1 20 PRO HG3 1 107 LEU MD1 . . 3.520 3.435 2.932 3.567 0.047 20 0 "[ . 1 . 2]" 1
622 1 20 PRO HG3 1 107 LEU QD . . 2.820 2.411 2.233 2.826 0.006 1 0 "[ . 1 . 2]" 1
623 1 20 PRO HG3 1 107 LEU MD2 . . 3.520 2.585 2.262 3.571 0.051 8 0 "[ . 1 . 2]" 1
624 1 20 PRO HG3 1 110 LEU QD . . 3.870 3.355 3.284 3.773 . 0 0 "[ . 1 . 2]" 1
625 1 22 ARG H 1 22 ARG HB2 . . 3.190 2.394 2.355 2.427 . 0 0 "[ . 1 . 2]" 1
626 1 22 ARG H 1 22 ARG HB3 . . 2.590 2.614 2.603 2.629 0.039 3 0 "[ . 1 . 2]" 1
627 1 22 ARG H 1 22 ARG QD . . 4.470 4.413 4.319 4.522 0.052 15 0 "[ . 1 . 2]" 1
628 1 22 ARG H 1 22 ARG HG2 . . 4.820 4.518 4.509 4.522 . 0 0 "[ . 1 . 2]" 1
629 1 22 ARG H 1 22 ARG QG . . 4.240 3.963 3.950 3.976 . 0 0 "[ . 1 . 2]" 1
630 1 22 ARG H 1 22 ARG HG3 . . 4.820 4.387 4.360 4.411 . 0 0 "[ . 1 . 2]" 1
631 1 22 ARG HA 1 22 ARG QD . . 4.340 4.036 3.989 4.164 . 0 0 "[ . 1 . 2]" 1
632 1 22 ARG HA 1 22 ARG HG2 . . 3.740 2.997 2.948 3.040 . 0 0 "[ . 1 . 2]" 1
633 1 22 ARG HA 1 22 ARG QG . . 3.230 2.392 2.379 2.413 . 0 0 "[ . 1 . 2]" 1
634 1 22 ARG HA 1 22 ARG HG3 . . 3.740 2.516 2.488 2.551 . 0 0 "[ . 1 . 2]" 1
635 1 22 ARG HA 1 23 GLY H . . 2.720 2.153 2.144 2.189 . 0 0 "[ . 1 . 2]" 1
636 1 22 ARG HA 1 23 GLY HA3 . . 4.590 4.417 4.409 4.437 . 0 0 "[ . 1 . 2]" 1
637 1 22 ARG HA 1 24 GLN H . . 3.740 3.652 3.500 3.731 . 0 0 "[ . 1 . 2]" 1
638 1 22 ARG HA 1 24 GLN QG . . 4.720 4.174 3.948 4.310 . 0 0 "[ . 1 . 2]" 1
639 1 22 ARG HA 1 54 LEU H . . 4.360 3.732 3.531 4.027 . 0 0 "[ . 1 . 2]" 1
640 1 22 ARG HA 1 54 LEU HB2 . . 3.520 2.198 2.135 2.268 . 0 0 "[ . 1 . 2]" 1
641 1 22 ARG HA 1 54 LEU HB3 . . 3.860 2.286 2.208 2.643 . 0 0 "[ . 1 . 2]" 1
642 1 22 ARG HA 1 54 LEU MD1 . . 4.960 4.225 3.275 4.444 . 0 0 "[ . 1 . 2]" 1
643 1 22 ARG HA 1 54 LEU QD . . 3.650 3.653 3.157 3.717 0.067 8 0 "[ . 1 . 2]" 1
644 1 22 ARG HA 1 54 LEU MD2 . . 4.960 4.042 3.925 4.240 . 0 0 "[ . 1 . 2]" 1
645 1 22 ARG HA 1 54 LEU HG . . 4.710 3.815 3.609 4.767 0.057 11 0 "[ . 1 . 2]" 1
646 1 22 ARG HA 1 55 GLY H . . 5.100 4.958 4.855 5.112 0.012 7 0 "[ . 1 . 2]" 1
647 1 22 ARG HB2 1 22 ARG QD . . 3.540 2.433 2.323 2.699 . 0 0 "[ . 1 . 2]" 1
648 1 22 ARG HB2 1 23 GLY H . . 4.530 4.385 4.317 4.447 . 0 0 "[ . 1 . 2]" 1
649 1 22 ARG HB3 1 22 ARG QD . . 2.890 2.456 2.335 2.808 . 0 0 "[ . 1 . 2]" 1
650 1 22 ARG HB3 1 22 ARG QG . . 2.550 2.347 2.332 2.364 . 0 0 "[ . 1 . 2]" 1
651 1 22 ARG HB3 1 23 GLY H . . 4.510 4.133 4.001 4.180 . 0 0 "[ . 1 . 2]" 1
652 1 22 ARG HB3 1 23 GLY HA3 . . 5.090 4.664 4.520 4.702 . 0 0 "[ . 1 . 2]" 1
653 1 22 ARG QD 1 23 GLY H . . 5.280 4.956 4.786 5.067 . 0 0 "[ . 1 . 2]" 1
654 1 22 ARG QD 1 55 GLY HA2 . . 5.120 3.803 2.973 4.518 . 0 0 "[ . 1 . 2]" 1
655 1 22 ARG QD 1 55 GLY HA3 . . 5.120 3.056 2.314 3.773 . 0 0 "[ . 1 . 2]" 1
656 1 22 ARG QG 1 23 GLY HA2 . . 5.020 3.844 3.796 3.933 . 0 0 "[ . 1 . 2]" 1
657 1 22 ARG QG 1 23 GLY HA3 . . 4.690 4.131 3.963 4.234 . 0 0 "[ . 1 . 2]" 1
658 1 22 ARG QG 1 55 GLY QA . . 3.340 2.265 2.034 2.515 . 0 0 "[ . 1 . 2]" 1
659 1 22 ARG HG2 1 23 GLY H . . 3.940 3.198 2.928 3.310 . 0 0 "[ . 1 . 2]" 1
660 1 22 ARG HG2 1 55 GLY HA2 . . 4.600 4.308 3.756 4.603 0.003 7 0 "[ . 1 . 2]" 1
661 1 22 ARG HG2 1 55 GLY HA3 . . 4.600 2.720 2.314 2.995 . 0 0 "[ . 1 . 2]" 1
662 1 22 ARG HG3 1 23 GLY H . . 3.940 3.504 3.342 3.690 . 0 0 "[ . 1 . 2]" 1
663 1 22 ARG HG3 1 55 GLY HA2 . . 4.600 3.549 3.188 3.891 . 0 0 "[ . 1 . 2]" 1
664 1 22 ARG HG3 1 55 GLY HA3 . . 4.600 2.496 2.326 2.802 . 0 0 "[ . 1 . 2]" 1
665 1 23 GLY H 1 24 GLN H . . 2.880 2.602 2.526 2.690 . 0 0 "[ . 1 . 2]" 1
666 1 23 GLY H 1 24 GLN HE21 . . 6.000 5.753 5.503 5.826 . 0 0 "[ . 1 . 2]" 1
667 1 23 GLY H 1 24 GLN QG . . 4.380 3.946 3.884 4.042 . 0 0 "[ . 1 . 2]" 1
668 1 23 GLY H 1 53 MET HA . . 4.820 4.415 4.211 4.581 . 0 0 "[ . 1 . 2]" 1
669 1 23 GLY H 1 53 MET QG . . 4.060 3.937 2.969 4.092 0.032 7 0 "[ . 1 . 2]" 1
670 1 23 GLY H 1 54 LEU HB2 . . 3.670 2.798 2.553 2.903 . 0 0 "[ . 1 . 2]" 1
671 1 23 GLY H 1 54 LEU HB3 . . 3.930 3.473 3.283 3.762 . 0 0 "[ . 1 . 2]" 1
672 1 23 GLY H 1 54 LEU MD1 . . 5.330 5.062 4.050 5.209 . 0 0 "[ . 1 . 2]" 1
673 1 23 GLY H 1 54 LEU QD . . 4.360 4.211 3.898 4.277 . 0 0 "[ . 1 . 2]" 1
674 1 23 GLY H 1 54 LEU MD2 . . 5.330 4.564 4.416 5.206 . 0 0 "[ . 1 . 2]" 1
675 1 23 GLY H 1 55 GLY H . . 5.270 5.179 4.943 5.264 . 0 0 "[ . 1 . 2]" 1
676 1 23 GLY H 1 55 GLY QA . . 5.810 4.435 4.065 4.538 . 0 0 "[ . 1 . 2]" 1
677 1 23 GLY HA2 1 53 MET HA . . 5.290 5.243 4.915 5.312 0.022 19 0 "[ . 1 . 2]" 1
678 1 23 GLY HA2 1 53 MET QG . . 3.860 3.521 2.721 3.672 . 0 0 "[ . 1 . 2]" 1
679 1 23 GLY HA2 1 54 LEU H . . 5.040 4.556 4.377 4.667 . 0 0 "[ . 1 . 2]" 1
680 1 23 GLY HA3 1 53 MET QG . . 4.610 4.555 4.018 4.640 0.030 14 0 "[ . 1 . 2]" 1
681 1 23 GLY HA3 1 54 LEU HB2 . . 5.700 5.663 5.458 5.728 0.028 9 0 "[ . 1 . 2]" 1
682 1 24 GLN H 1 24 GLN HB2 . . 3.920 3.617 3.596 3.697 . 0 0 "[ . 1 . 2]" 1
683 1 24 GLN H 1 24 GLN HB3 . . 3.450 3.178 3.056 3.257 . 0 0 "[ . 1 . 2]" 1
684 1 24 GLN H 1 24 GLN HE21 . . 4.660 3.975 3.694 4.026 . 0 0 "[ . 1 . 2]" 1
685 1 24 GLN H 1 24 GLN HE22 . . 5.360 5.387 5.195 5.406 0.046 1 0 "[ . 1 . 2]" 1
686 1 24 GLN H 1 24 GLN QG . . 2.580 1.909 1.815 1.997 . 0 0 "[ . 1 . 2]" 1
687 1 24 GLN H 1 25 THR H . . 4.570 4.569 4.557 4.577 0.007 11 0 "[ . 1 . 2]" 1
688 1 24 GLN H 1 53 MET QG . . 4.610 3.868 3.640 3.976 . 0 0 "[ . 1 . 2]" 1
689 1 24 GLN H 1 54 LEU H . . 4.210 3.938 3.772 4.063 . 0 0 "[ . 1 . 2]" 1
690 1 24 GLN H 1 54 LEU HB2 . . 4.080 4.069 3.999 4.094 0.014 12 0 "[ . 1 . 2]" 1
691 1 24 GLN H 1 54 LEU HB3 . . 5.540 5.368 5.269 5.567 0.027 13 0 "[ . 1 . 2]" 1
692 1 24 GLN H 1 54 LEU QD . . 4.780 4.755 4.295 4.819 0.039 7 0 "[ . 1 . 2]" 1
693 1 24 GLN HA 1 24 GLN HB2 . . 2.970 2.598 2.517 2.623 . 0 0 "[ . 1 . 2]" 1
694 1 24 GLN HA 1 24 GLN HE21 . . 5.030 4.790 4.496 4.832 . 0 0 "[ . 1 . 2]" 1
695 1 24 GLN HA 1 24 GLN HE22 . . 6.000 5.983 5.716 6.019 0.019 1 0 "[ . 1 . 2]" 1
696 1 24 GLN HA 1 24 GLN QG . . 3.420 3.331 3.324 3.383 . 0 0 "[ . 1 . 2]" 1
697 1 24 GLN HA 1 25 THR H . . 2.700 2.381 2.359 2.392 . 0 0 "[ . 1 . 2]" 1
698 1 24 GLN HA 1 53 MET HA . . 5.020 4.786 4.632 4.865 . 0 0 "[ . 1 . 2]" 1
699 1 24 GLN HB2 1 24 GLN HE21 . . 3.620 3.011 2.970 3.185 . 0 0 "[ . 1 . 2]" 1
700 1 24 GLN HB2 1 24 GLN HE22 . . 4.610 3.682 3.665 3.773 . 0 0 "[ . 1 . 2]" 1
701 1 24 GLN HB2 1 25 THR H . . 3.270 2.516 2.489 2.529 . 0 0 "[ . 1 . 2]" 1
702 1 24 GLN HB2 1 25 THR HB . . 5.380 5.005 4.960 5.069 . 0 0 "[ . 1 . 2]" 1
703 1 24 GLN HB2 1 110 LEU HB2 . . 5.670 5.286 4.493 5.428 . 0 0 "[ . 1 . 2]" 1
704 1 24 GLN HB2 1 110 LEU HB3 . . 5.000 3.979 3.591 4.184 . 0 0 "[ . 1 . 2]" 1
705 1 24 GLN HB2 1 111 GLU H . . 4.440 3.762 3.233 3.880 . 0 0 "[ . 1 . 2]" 1
706 1 24 GLN HB3 1 24 GLN HE21 . . 4.540 4.188 4.169 4.278 . 0 0 "[ . 1 . 2]" 1
707 1 24 GLN HB3 1 24 GLN HE22 . . 5.160 4.848 4.810 4.978 . 0 0 "[ . 1 . 2]" 1
708 1 24 GLN HB3 1 25 THR H . . 3.850 3.574 3.516 3.713 . 0 0 "[ . 1 . 2]" 1
709 1 24 GLN HB3 1 110 LEU HB3 . . 5.680 5.386 4.997 5.521 . 0 0 "[ . 1 . 2]" 1
710 1 24 GLN HE21 1 24 GLN QG . . 3.180 2.211 2.183 2.233 . 0 0 "[ . 1 . 2]" 1
711 1 24 GLN HE21 1 25 THR H . . 5.400 4.436 3.960 4.684 . 0 0 "[ . 1 . 2]" 1
712 1 24 GLN HE21 1 26 CYS HA . . 5.230 4.199 3.763 4.305 . 0 0 "[ . 1 . 2]" 1
713 1 24 GLN HE21 1 54 LEU H . . 5.570 5.207 4.818 5.369 . 0 0 "[ . 1 . 2]" 1
714 1 24 GLN HE21 1 110 LEU HB2 . . 5.050 4.845 4.510 5.069 0.019 14 0 "[ . 1 . 2]" 1
715 1 24 GLN HE21 1 110 LEU HB3 . . 4.490 3.193 2.929 3.351 . 0 0 "[ . 1 . 2]" 1
716 1 24 GLN HE21 1 110 LEU MD1 . . 5.170 3.815 3.606 4.308 . 0 0 "[ . 1 . 2]" 1
717 1 24 GLN HE21 1 110 LEU QD . . 4.010 2.635 2.491 3.539 . 0 0 "[ . 1 . 2]" 1
718 1 24 GLN HE21 1 110 LEU MD2 . . 5.170 2.756 2.538 5.137 . 0 0 "[ . 1 . 2]" 1
719 1 24 GLN HE21 1 111 GLU H . . 5.270 4.332 4.046 4.470 . 0 0 "[ . 1 . 2]" 1
720 1 24 GLN HE22 1 24 GLN QG . . 3.390 3.286 3.278 3.297 . 0 0 "[ . 1 . 2]" 1
721 1 24 GLN HE22 1 25 THR H . . 5.910 5.438 4.835 5.567 . 0 0 "[ . 1 . 2]" 1
722 1 24 GLN HE22 1 110 LEU HA . . 5.870 3.923 3.235 4.170 . 0 0 "[ . 1 . 2]" 1
723 1 24 GLN HE22 1 110 LEU HB2 . . 4.230 3.373 3.080 3.499 . 0 0 "[ . 1 . 2]" 1
724 1 24 GLN HE22 1 110 LEU HB3 . . 4.220 1.970 1.665 2.170 . 0 0 "[ . 1 . 2]" 1
725 1 24 GLN HE22 1 110 LEU MD1 . . 4.580 2.325 2.055 3.000 . 0 0 "[ . 1 . 2]" 1
726 1 24 GLN HE22 1 110 LEU QD . . 3.630 1.754 1.674 2.489 . 0 0 "[ . 1 . 2]" 1
727 1 24 GLN HE22 1 110 LEU MD2 . . 4.580 1.876 1.686 3.722 . 0 0 "[ . 1 . 2]" 1
728 1 24 GLN HE22 1 111 GLU H . . 5.910 4.161 3.422 4.400 . 0 0 "[ . 1 . 2]" 1
729 1 24 GLN QG 1 25 THR H . . 4.370 4.184 4.123 4.259 . 0 0 "[ . 1 . 2]" 1
730 1 24 GLN QG 1 54 LEU H . . 4.730 4.537 4.424 4.688 . 0 0 "[ . 1 . 2]" 1
731 1 24 GLN QG 1 54 LEU HB3 . . 6.000 5.651 5.541 5.831 . 0 0 "[ . 1 . 2]" 1
732 1 24 GLN QG 1 110 LEU HB2 . . 6.000 5.707 4.923 5.860 . 0 0 "[ . 1 . 2]" 1
733 1 24 GLN QG 1 110 LEU HB3 . . 5.560 4.527 4.067 4.633 . 0 0 "[ . 1 . 2]" 1
734 1 24 GLN QG 1 110 LEU QD . . 4.880 3.993 3.801 4.697 . 0 0 "[ . 1 . 2]" 1
735 1 25 THR H 1 25 THR HB . . 3.330 3.014 2.969 3.124 . 0 0 "[ . 1 . 2]" 1
736 1 25 THR H 1 25 THR MG . . 3.820 3.701 3.595 3.737 . 0 0 "[ . 1 . 2]" 1
737 1 25 THR H 1 53 MET HA . . 4.730 4.596 4.510 4.670 . 0 0 "[ . 1 . 2]" 1
738 1 25 THR H 1 110 LEU HB3 . . 5.870 5.377 5.199 5.462 . 0 0 "[ . 1 . 2]" 1
739 1 25 THR H 1 111 GLU H . . 3.750 3.724 3.464 3.770 0.020 11 0 "[ . 1 . 2]" 1
740 1 25 THR H 1 111 GLU HB2 . . 3.780 3.773 3.565 3.793 0.013 11 0 "[ . 1 . 2]" 1
741 1 25 THR H 1 111 GLU HB3 . . 4.890 4.582 4.398 4.674 . 0 0 "[ . 1 . 2]" 1
742 1 25 THR H 1 111 GLU HG3 . . 6.000 5.916 5.692 5.941 . 0 0 "[ . 1 . 2]" 1
743 1 25 THR HA 1 25 THR MG . . 3.080 2.197 2.165 2.218 . 0 0 "[ . 1 . 2]" 1
744 1 25 THR HA 1 26 CYS H . . 2.800 2.222 2.171 2.235 . 0 0 "[ . 1 . 2]" 1
745 1 25 THR HA 1 26 CYS HA . . 4.570 4.408 4.393 4.416 . 0 0 "[ . 1 . 2]" 1
746 1 25 THR HA 1 26 CYS QB . . 4.950 4.158 3.959 4.423 . 0 0 "[ . 1 . 2]" 1
747 1 25 THR HA 1 52 PHE H . . 3.950 3.656 3.391 3.763 . 0 0 "[ . 1 . 2]" 1
748 1 25 THR HA 1 53 MET H . . 4.750 4.314 4.201 4.460 . 0 0 "[ . 1 . 2]" 1
749 1 25 THR HA 1 53 MET HA . . 3.170 2.567 2.437 2.733 . 0 0 "[ . 1 . 2]" 1
750 1 25 THR HA 1 53 MET QB . . 4.260 4.177 3.798 4.284 0.024 7 0 "[ . 1 . 2]" 1
751 1 25 THR HA 1 53 MET QG . . 4.100 2.899 2.603 3.460 . 0 0 "[ . 1 . 2]" 1
752 1 25 THR HA 1 54 LEU H . . 4.790 4.253 4.000 4.519 . 0 0 "[ . 1 . 2]" 1
753 1 25 THR HA 1 111 GLU H . . 4.810 4.822 4.656 4.841 0.031 3 0 "[ . 1 . 2]" 1
754 1 25 THR HB 1 26 CYS H . . 4.010 3.467 3.376 3.560 . 0 0 "[ . 1 . 2]" 1
755 1 25 THR HB 1 26 CYS HA . . 4.510 4.352 4.266 4.395 . 0 0 "[ . 1 . 2]" 1
756 1 25 THR HB 1 27 VAL MG2 . . 4.630 3.728 3.441 3.925 . 0 0 "[ . 1 . 2]" 1
757 1 25 THR HB 1 52 PHE H . . 5.400 4.528 4.291 4.675 . 0 0 "[ . 1 . 2]" 1
758 1 25 THR HB 1 110 LEU HA . . 5.050 4.963 4.847 5.052 0.002 2 0 "[ . 1 . 2]" 1
759 1 25 THR HB 1 110 LEU HB3 . . 6.000 5.956 5.826 6.011 0.011 6 0 "[ . 1 . 2]" 1
760 1 25 THR HB 1 111 GLU H . . 3.590 3.377 3.310 3.457 . 0 0 "[ . 1 . 2]" 1
761 1 25 THR HB 1 111 GLU HA . . 4.980 4.993 4.980 5.022 0.042 7 0 "[ . 1 . 2]" 1
762 1 25 THR HB 1 111 GLU HB2 . . 3.640 2.205 2.176 2.229 . 0 0 "[ . 1 . 2]" 1
763 1 25 THR HB 1 111 GLU HB3 . . 3.730 3.728 3.685 3.745 0.015 14 0 "[ . 1 . 2]" 1
764 1 25 THR HB 1 111 GLU HG3 . . 4.460 4.043 3.901 4.120 . 0 0 "[ . 1 . 2]" 1
765 1 25 THR MG 1 26 CYS H . . 2.890 2.293 2.218 2.613 . 0 0 "[ . 1 . 2]" 1
766 1 25 THR MG 1 52 PHE H . . 3.150 2.268 2.154 2.418 . 0 0 "[ . 1 . 2]" 1
767 1 25 THR MG 1 52 PHE HA . . 4.360 2.913 2.842 3.016 . 0 0 "[ . 1 . 2]" 1
768 1 25 THR MG 1 53 MET H . . 4.540 3.717 3.566 3.929 . 0 0 "[ . 1 . 2]" 1
769 1 26 CYS H 1 26 CYS QB . . 3.090 2.566 2.500 2.680 . 0 0 "[ . 1 . 2]" 1
770 1 26 CYS H 1 27 VAL H . . 4.160 4.202 4.184 4.218 0.058 8 0 "[ . 1 . 2]" 1
771 1 26 CYS H 1 52 PHE H . . 3.330 2.150 2.037 2.280 . 0 0 "[ . 1 . 2]" 1
772 1 26 CYS H 1 52 PHE HB3 . . 5.630 5.161 5.045 5.289 . 0 0 "[ . 1 . 2]" 1
773 1 26 CYS H 1 52 PHE QD . . 4.480 4.178 4.084 4.279 . 0 0 "[ . 1 . 2]" 1
774 1 26 CYS H 1 53 MET H . . 5.190 4.924 4.803 5.066 . 0 0 "[ . 1 . 2]" 1
775 1 26 CYS H 1 110 LEU HA . . 5.410 5.218 5.115 5.285 . 0 0 "[ . 1 . 2]" 1
776 1 26 CYS HA 1 27 VAL H . . 2.700 2.109 2.093 2.122 . 0 0 "[ . 1 . 2]" 1
777 1 26 CYS HA 1 27 VAL HA . . 4.530 4.403 4.389 4.417 . 0 0 "[ . 1 . 2]" 1
778 1 26 CYS HA 1 27 VAL MG2 . . 3.900 3.542 3.488 3.594 . 0 0 "[ . 1 . 2]" 1
779 1 26 CYS HA 1 28 VAL H . . 5.620 5.628 5.577 5.648 0.028 11 0 "[ . 1 . 2]" 1
780 1 26 CYS HA 1 52 PHE H . . 4.860 4.538 4.437 4.672 . 0 0 "[ . 1 . 2]" 1
781 1 26 CYS HA 1 110 LEU HA . . 3.460 2.641 2.496 2.734 . 0 0 "[ . 1 . 2]" 1
782 1 26 CYS HA 1 110 LEU HB3 . . 4.480 3.964 3.803 4.058 . 0 0 "[ . 1 . 2]" 1
783 1 26 CYS HA 1 110 LEU QD . . 2.930 2.446 2.282 2.950 0.020 7 0 "[ . 1 . 2]" 1
784 1 26 CYS HA 1 111 GLU H . . 4.780 3.442 3.317 3.555 . 0 0 "[ . 1 . 2]" 1
785 1 26 CYS QB 1 27 VAL H . . 4.110 3.623 3.291 3.856 . 0 0 "[ . 1 . 2]" 1
786 1 26 CYS QB 1 27 VAL HA . . 5.210 4.622 4.444 4.766 . 0 0 "[ . 1 . 2]" 1
787 1 26 CYS QB 1 28 VAL H . . 5.430 4.913 4.703 5.096 . 0 0 "[ . 1 . 2]" 1
788 1 26 CYS QB 1 52 PHE H . . 3.720 3.369 3.238 3.550 . 0 0 "[ . 1 . 2]" 1
789 1 26 CYS QB 1 52 PHE QD . . 3.960 3.618 3.538 3.839 . 0 0 "[ . 1 . 2]" 1
790 1 26 CYS QB 1 52 PHE QE . . 3.590 3.090 2.964 3.311 . 0 0 "[ . 1 . 2]" 1
791 1 26 CYS QB 1 52 PHE HZ . . 4.240 3.475 3.383 3.667 . 0 0 "[ . 1 . 2]" 1
792 1 26 CYS QB 1 67 VAL QG . . 3.820 3.300 3.212 3.370 . 0 0 "[ . 1 . 2]" 1
793 1 26 CYS QB 1 110 LEU HA . . 5.240 4.475 4.242 4.618 . 0 0 "[ . 1 . 2]" 1
794 1 26 CYS QB 1 110 LEU QD . . 3.930 2.896 2.613 3.261 . 0 0 "[ . 1 . 2]" 1
795 1 26 CYS HB2 1 27 VAL H . . 4.740 4.322 4.220 4.384 . 0 0 "[ . 1 . 2]" 1
796 1 26 CYS HB2 1 52 PHE QE . . 4.340 3.875 3.173 4.369 0.029 1 0 "[ . 1 . 2]" 1
797 1 26 CYS HB3 1 27 VAL H . . 4.740 3.923 3.429 4.277 . 0 0 "[ . 1 . 2]" 1
798 1 26 CYS HB3 1 52 PHE QE . . 4.340 3.573 3.016 4.342 0.002 8 0 "[ . 1 . 2]" 1
799 1 27 VAL H 1 27 VAL HB . . 3.070 2.699 2.685 2.715 . 0 0 "[ . 1 . 2]" 1
800 1 27 VAL H 1 27 VAL MG1 . . 3.990 3.842 3.825 3.849 . 0 0 "[ . 1 . 2]" 1
801 1 27 VAL H 1 27 VAL MG2 . . 3.000 2.170 2.110 2.190 . 0 0 "[ . 1 . 2]" 1
802 1 27 VAL H 1 28 VAL H . . 4.620 4.342 4.333 4.353 . 0 0 "[ . 1 . 2]" 1
803 1 27 VAL H 1 28 VAL HA . . 5.700 5.367 5.347 5.416 . 0 0 "[ . 1 . 2]" 1
804 1 27 VAL H 1 108 LEU H . . 5.360 5.089 5.042 5.139 . 0 0 "[ . 1 . 2]" 1
805 1 27 VAL H 1 108 LEU HB2 . . 5.520 4.902 4.805 4.946 . 0 0 "[ . 1 . 2]" 1
806 1 27 VAL H 1 110 LEU HA . . 3.770 2.873 2.816 2.989 . 0 0 "[ . 1 . 2]" 1
807 1 27 VAL H 1 110 LEU QD . . 3.840 3.339 3.216 3.637 . 0 0 "[ . 1 . 2]" 1
808 1 27 VAL H 1 111 GLU H . . 4.460 4.126 4.056 4.183 . 0 0 "[ . 1 . 2]" 1
809 1 27 VAL HA 1 27 VAL MG1 . . 3.140 2.297 2.285 2.307 . 0 0 "[ . 1 . 2]" 1
810 1 27 VAL HA 1 27 VAL MG2 . . 3.260 2.526 2.518 2.535 . 0 0 "[ . 1 . 2]" 1
811 1 27 VAL HA 1 28 VAL H . . 2.880 2.149 2.140 2.157 . 0 0 "[ . 1 . 2]" 1
812 1 27 VAL HA 1 49 PRO QB . . 4.250 3.687 3.602 3.738 . 0 0 "[ . 1 . 2]" 1
813 1 27 VAL HA 1 49 PRO HG2 . . 5.820 5.106 4.920 5.223 . 0 0 "[ . 1 . 2]" 1
814 1 27 VAL HA 1 50 PHE H . . 4.870 4.570 4.548 4.609 . 0 0 "[ . 1 . 2]" 1
815 1 27 VAL HA 1 52 PHE H . . 4.370 4.332 4.305 4.364 . 0 0 "[ . 1 . 2]" 1
816 1 27 VAL HB 1 28 VAL H . . 4.630 4.256 4.238 4.270 . 0 0 "[ . 1 . 2]" 1
817 1 27 VAL HB 1 28 VAL HA . . 4.960 4.635 4.603 4.662 . 0 0 "[ . 1 . 2]" 1
818 1 27 VAL HB 1 49 PRO QB . . 4.700 4.421 4.353 4.455 . 0 0 "[ . 1 . 2]" 1
819 1 27 VAL HB 1 108 LEU HB2 . . 3.700 2.903 2.794 2.974 . 0 0 "[ . 1 . 2]" 1
820 1 27 VAL HB 1 108 LEU HB3 . . 4.790 4.339 4.210 4.409 . 0 0 "[ . 1 . 2]" 1
821 1 27 VAL HB 1 110 LEU H . . 5.870 5.228 5.122 5.465 . 0 0 "[ . 1 . 2]" 1
822 1 27 VAL HB 1 110 LEU HA . . 5.120 4.594 4.519 4.791 . 0 0 "[ . 1 . 2]" 1
823 1 27 VAL MG1 1 28 VAL H . . 3.270 3.091 3.072 3.113 . 0 0 "[ . 1 . 2]" 1
824 1 27 VAL MG1 1 28 VAL HA . . 3.690 3.740 3.729 3.753 0.063 8 0 "[ . 1 . 2]" 1
825 1 27 VAL MG1 1 29 HIS HD2 . . 4.970 4.793 4.717 4.852 . 0 0 "[ . 1 . 2]" 1
826 1 27 VAL MG1 1 49 PRO QB . . 2.740 2.053 2.026 2.067 . 0 0 "[ . 1 . 2]" 1
827 1 27 VAL MG1 1 49 PRO HD2 . . 4.890 4.491 4.336 4.611 . 0 0 "[ . 1 . 2]" 1
828 1 27 VAL MG1 1 49 PRO HD3 . . 4.750 4.652 4.530 4.709 . 0 0 "[ . 1 . 2]" 1
829 1 27 VAL MG1 1 49 PRO HG2 . . 3.050 2.628 2.472 2.744 . 0 0 "[ . 1 . 2]" 1
830 1 27 VAL MG1 1 49 PRO HG3 . . 2.930 2.936 2.814 2.980 0.050 17 0 "[ . 1 . 2]" 1
831 1 27 VAL MG1 1 50 PHE H . . 4.480 4.052 4.028 4.079 . 0 0 "[ . 1 . 2]" 1
832 1 27 VAL MG1 1 50 PHE HB2 . . 6.000 6.033 6.020 6.045 0.045 13 0 "[ . 1 . 2]" 1
833 1 27 VAL MG1 1 108 LEU H . . 4.540 4.596 4.565 4.619 0.079 7 0 "[ . 1 . 2]" 1
834 1 27 VAL MG1 1 108 LEU HB2 . . 3.750 2.884 2.864 2.904 . 0 0 "[ . 1 . 2]" 1
835 1 27 VAL MG1 1 108 LEU HB3 . . 3.840 3.855 3.811 3.876 0.036 1 0 "[ . 1 . 2]" 1
836 1 27 VAL MG2 1 28 VAL H . . 4.440 4.303 4.293 4.314 . 0 0 "[ . 1 . 2]" 1
837 1 27 VAL MG2 1 52 PHE H . . 4.810 4.744 4.695 4.815 0.005 2 0 "[ . 1 . 2]" 1
838 1 27 VAL MG2 1 110 LEU HA . . 4.110 3.278 3.189 3.427 . 0 0 "[ . 1 . 2]" 1
839 1 27 VAL MG2 1 111 GLU H . . 4.490 3.662 3.583 3.784 . 0 0 "[ . 1 . 2]" 1
840 1 27 VAL MG2 1 111 GLU HG2 . . 3.830 3.706 3.620 3.788 . 0 0 "[ . 1 . 2]" 1
841 1 27 VAL MG2 1 111 GLU HG3 . . 3.230 2.352 2.268 2.430 . 0 0 "[ . 1 . 2]" 1
842 1 28 VAL H 1 28 VAL MG1 . . 3.610 3.315 3.292 3.334 . 0 0 "[ . 1 . 2]" 1
843 1 28 VAL H 1 28 VAL QG . . 2.920 2.382 2.360 2.397 . 0 0 "[ . 1 . 2]" 1
844 1 28 VAL H 1 28 VAL MG2 . . 3.610 2.441 2.418 2.459 . 0 0 "[ . 1 . 2]" 1
845 1 28 VAL H 1 29 HIS H . . 4.590 4.367 4.354 4.376 . 0 0 "[ . 1 . 2]" 1
846 1 28 VAL H 1 29 HIS HB2 . . 6.000 6.053 6.030 6.073 0.073 20 0 "[ . 1 . 2]" 1
847 1 28 VAL H 1 49 PRO HA . . 5.290 4.860 4.825 4.906 . 0 0 "[ . 1 . 2]" 1
848 1 28 VAL H 1 49 PRO QB . . 4.670 3.339 3.244 3.408 . 0 0 "[ . 1 . 2]" 1
849 1 28 VAL H 1 50 PHE H . . 3.730 3.160 3.140 3.201 . 0 0 "[ . 1 . 2]" 1
850 1 28 VAL H 1 50 PHE HB2 . . 5.540 4.967 4.912 5.051 . 0 0 "[ . 1 . 2]" 1
851 1 28 VAL H 1 50 PHE HB3 . . 4.520 3.829 3.783 3.888 . 0 0 "[ . 1 . 2]" 1
852 1 28 VAL H 1 50 PHE QD . . 5.090 4.909 4.853 5.001 . 0 0 "[ . 1 . 2]" 1
853 1 28 VAL H 1 52 PHE H . . 5.170 5.171 5.072 5.198 0.028 16 0 "[ . 1 . 2]" 1
854 1 28 VAL H 1 52 PHE QD . . 4.940 4.598 4.543 4.627 . 0 0 "[ . 1 . 2]" 1
855 1 28 VAL H 1 52 PHE QE . . 5.010 4.551 4.463 4.644 . 0 0 "[ . 1 . 2]" 1
856 1 28 VAL H 1 108 LEU H . . 5.100 5.067 5.042 5.095 . 0 0 "[ . 1 . 2]" 1
857 1 28 VAL H 1 108 LEU HG . . 5.850 5.121 5.071 5.142 . 0 0 "[ . 1 . 2]" 1
858 1 28 VAL HA 1 28 VAL QG . . 3.060 2.198 2.190 2.205 . 0 0 "[ . 1 . 2]" 1
859 1 28 VAL HA 1 29 HIS H . . 2.780 2.263 2.244 2.275 . 0 0 "[ . 1 . 2]" 1
860 1 28 VAL HA 1 29 HIS HB2 . . 4.890 4.151 4.139 4.165 . 0 0 "[ . 1 . 2]" 1
861 1 28 VAL HA 1 29 HIS HB3 . . 5.640 5.553 5.541 5.565 . 0 0 "[ . 1 . 2]" 1
862 1 28 VAL HA 1 29 HIS HD2 . . 5.140 4.845 4.754 4.998 . 0 0 "[ . 1 . 2]" 1
863 1 28 VAL HA 1 49 PRO QB . . 5.400 4.020 3.930 4.099 . 0 0 "[ . 1 . 2]" 1
864 1 28 VAL HA 1 106 GLU H . . 4.260 4.012 3.973 4.059 . 0 0 "[ . 1 . 2]" 1
865 1 28 VAL HA 1 107 LEU H . . 5.640 5.485 5.432 5.523 . 0 0 "[ . 1 . 2]" 1
866 1 28 VAL HA 1 107 LEU HA . . 4.000 3.846 3.695 3.912 . 0 0 "[ . 1 . 2]" 1
867 1 28 VAL HA 1 108 LEU H . . 3.350 2.872 2.853 2.886 . 0 0 "[ . 1 . 2]" 1
868 1 28 VAL HA 1 108 LEU HA . . 5.100 5.077 5.061 5.101 0.001 2 0 "[ . 1 . 2]" 1
869 1 28 VAL HA 1 108 LEU HB2 . . 4.200 3.479 3.445 3.522 . 0 0 "[ . 1 . 2]" 1
870 1 28 VAL HA 1 108 LEU HB3 . . 4.990 4.719 4.684 4.760 . 0 0 "[ . 1 . 2]" 1
871 1 28 VAL HA 1 108 LEU MD1 . . 3.820 2.157 2.132 2.191 . 0 0 "[ . 1 . 2]" 1
872 1 28 VAL HA 1 108 LEU HG . . 3.650 2.429 2.391 2.461 . 0 0 "[ . 1 . 2]" 1
873 1 28 VAL HB 1 29 HIS H . . 3.070 2.625 2.591 2.679 . 0 0 "[ . 1 . 2]" 1
874 1 28 VAL HB 1 29 HIS HA . . 5.460 4.599 4.576 4.635 . 0 0 "[ . 1 . 2]" 1
875 1 28 VAL HB 1 29 HIS HB2 . . 5.080 4.806 4.776 4.846 . 0 0 "[ . 1 . 2]" 1
876 1 28 VAL HB 1 30 TYR HA . . 5.880 5.287 5.244 5.326 . 0 0 "[ . 1 . 2]" 1
877 1 28 VAL HB 1 30 TYR HB3 . . 6.000 4.870 4.832 4.912 . 0 0 "[ . 1 . 2]" 1
878 1 28 VAL HB 1 49 PRO QB . . 6.000 5.748 5.669 5.812 . 0 0 "[ . 1 . 2]" 1
879 1 28 VAL HB 1 52 PHE QE . . 5.090 4.787 4.715 4.830 . 0 0 "[ . 1 . 2]" 1
880 1 28 VAL HB 1 70 MET ME . . 4.560 4.187 4.135 4.242 . 0 0 "[ . 1 . 2]" 1
881 1 28 VAL HB 1 105 VAL HA . . 4.990 3.942 3.904 3.980 . 0 0 "[ . 1 . 2]" 1
882 1 28 VAL HB 1 105 VAL MG1 . . 4.570 3.806 3.769 3.853 . 0 0 "[ . 1 . 2]" 1
883 1 28 VAL HB 1 105 VAL MG2 . . 3.750 3.759 3.668 3.774 0.024 5 0 "[ . 1 . 2]" 1
884 1 28 VAL HB 1 106 GLU H . . 4.050 2.507 2.481 2.545 . 0 0 "[ . 1 . 2]" 1
885 1 28 VAL HB 1 106 GLU HG3 . . 4.890 4.113 4.083 4.159 . 0 0 "[ . 1 . 2]" 1
886 1 28 VAL HB 1 107 LEU HA . . 4.610 3.793 3.697 3.825 . 0 0 "[ . 1 . 2]" 1
887 1 28 VAL HB 1 108 LEU H . . 4.250 4.245 4.201 4.265 0.015 8 0 "[ . 1 . 2]" 1
888 1 28 VAL QG 1 29 HIS H . . 3.450 3.291 3.275 3.316 . 0 0 "[ . 1 . 2]" 1
889 1 28 VAL QG 1 29 HIS HA . . 4.750 4.072 4.051 4.087 . 0 0 "[ . 1 . 2]" 1
890 1 28 VAL QG 1 30 TYR H . . 4.380 4.408 4.398 4.415 0.035 20 0 "[ . 1 . 2]" 1
891 1 28 VAL QG 1 30 TYR HA . . 5.110 4.722 4.694 4.752 . 0 0 "[ . 1 . 2]" 1
892 1 28 VAL QG 1 30 TYR HB3 . . 3.840 3.518 3.484 3.544 . 0 0 "[ . 1 . 2]" 1
893 1 28 VAL QG 1 30 TYR QD . . 3.860 3.653 3.568 3.746 . 0 0 "[ . 1 . 2]" 1
894 1 28 VAL QG 1 50 PHE H . . 4.110 3.894 3.856 3.936 . 0 0 "[ . 1 . 2]" 1
895 1 28 VAL QG 1 50 PHE HB2 . . 4.900 4.409 4.340 4.476 . 0 0 "[ . 1 . 2]" 1
896 1 28 VAL QG 1 50 PHE HB3 . . 3.490 3.157 3.111 3.203 . 0 0 "[ . 1 . 2]" 1
897 1 28 VAL QG 1 50 PHE QD . . 3.960 3.763 3.699 3.825 . 0 0 "[ . 1 . 2]" 1
898 1 28 VAL QG 1 52 PHE QD . . 3.720 3.265 3.173 3.306 . 0 0 "[ . 1 . 2]" 1
899 1 28 VAL QG 1 52 PHE QE . . 2.900 2.079 2.050 2.102 . 0 0 "[ . 1 . 2]" 1
900 1 28 VAL QG 1 52 PHE HZ . . 4.510 3.468 3.402 3.528 . 0 0 "[ . 1 . 2]" 1
901 1 28 VAL QG 1 67 VAL HA . . 5.880 4.786 4.717 4.875 . 0 0 "[ . 1 . 2]" 1
902 1 28 VAL QG 1 105 VAL HA . . 4.740 4.071 4.036 4.111 . 0 0 "[ . 1 . 2]" 1
903 1 28 VAL QG 1 105 VAL MG1 . . 3.550 2.798 2.743 2.845 . 0 0 "[ . 1 . 2]" 1
904 1 28 VAL QG 1 105 VAL MG2 . . 3.150 3.077 2.954 3.120 . 0 0 "[ . 1 . 2]" 1
905 1 28 VAL QG 1 106 GLU H . . 4.080 3.358 3.339 3.390 . 0 0 "[ . 1 . 2]" 1
906 1 28 VAL QG 1 107 LEU HA . . 3.020 1.887 1.835 1.908 . 0 0 "[ . 1 . 2]" 1
907 1 28 VAL QG 1 108 LEU H . . 3.380 2.130 2.066 2.196 . 0 0 "[ . 1 . 2]" 1
908 1 28 VAL MG1 1 29 HIS H . . 3.980 3.683 3.660 3.709 . 0 0 "[ . 1 . 2]" 1
909 1 28 VAL MG1 1 52 PHE QE . . 3.560 3.582 3.564 3.598 0.038 14 0 "[ . 1 . 2]" 1
910 1 28 VAL MG1 1 106 GLU H . . 4.640 3.686 3.661 3.742 . 0 0 "[ . 1 . 2]" 1
911 1 28 VAL MG1 1 107 LEU HA . . 4.270 1.889 1.836 1.910 . 0 0 "[ . 1 . 2]" 1
912 1 28 VAL MG2 1 29 HIS H . . 3.980 3.706 3.687 3.737 . 0 0 "[ . 1 . 2]" 1
913 1 28 VAL MG2 1 52 PHE QE . . 3.560 2.093 2.063 2.117 . 0 0 "[ . 1 . 2]" 1
914 1 28 VAL MG2 1 106 GLU H . . 4.640 3.867 3.844 3.903 . 0 0 "[ . 1 . 2]" 1
915 1 28 VAL MG2 1 107 LEU HA . . 4.270 4.403 4.366 4.420 0.150 3 0 "[ . 1 . 2]" 1
916 1 29 HIS H 1 29 HIS HB2 . . 3.430 2.231 2.209 2.242 . 0 0 "[ . 1 . 2]" 1
917 1 29 HIS H 1 29 HIS HB3 . . 3.680 3.442 3.421 3.459 . 0 0 "[ . 1 . 2]" 1
918 1 29 HIS H 1 29 HIS HD2 . . 4.430 4.020 3.938 4.136 . 0 0 "[ . 1 . 2]" 1
919 1 29 HIS H 1 30 TYR H . . 4.650 4.421 4.414 4.428 . 0 0 "[ . 1 . 2]" 1
920 1 29 HIS H 1 30 TYR HA . . 5.310 5.013 4.998 5.027 . 0 0 "[ . 1 . 2]" 1
921 1 29 HIS H 1 49 PRO QB . . 4.620 4.374 4.256 4.452 . 0 0 "[ . 1 . 2]" 1
922 1 29 HIS H 1 105 VAL HA . . 4.620 4.224 4.166 4.279 . 0 0 "[ . 1 . 2]" 1
923 1 29 HIS H 1 106 GLU H . . 3.510 2.609 2.559 2.660 . 0 0 "[ . 1 . 2]" 1
924 1 29 HIS H 1 106 GLU HA . . 5.230 4.862 4.817 4.901 . 0 0 "[ . 1 . 2]" 1
925 1 29 HIS H 1 106 GLU HB2 . . 4.720 4.477 4.452 4.500 . 0 0 "[ . 1 . 2]" 1
926 1 29 HIS H 1 106 GLU HB3 . . 4.920 4.669 4.617 4.709 . 0 0 "[ . 1 . 2]" 1
927 1 29 HIS H 1 106 GLU HG2 . . 3.780 2.650 2.595 2.692 . 0 0 "[ . 1 . 2]" 1
928 1 29 HIS H 1 106 GLU HG3 . . 4.270 2.276 2.247 2.303 . 0 0 "[ . 1 . 2]" 1
929 1 29 HIS H 1 107 LEU HA . . 5.420 5.056 4.929 5.119 . 0 0 "[ . 1 . 2]" 1
930 1 29 HIS H 1 108 LEU H . . 4.590 4.510 4.492 4.521 . 0 0 "[ . 1 . 2]" 1
931 1 29 HIS H 1 108 LEU HB2 . . 5.660 5.140 5.095 5.196 . 0 0 "[ . 1 . 2]" 1
932 1 29 HIS H 1 108 LEU MD1 . . 4.030 2.532 2.463 2.668 . 0 0 "[ . 1 . 2]" 1
933 1 29 HIS H 1 108 LEU HG . . 3.620 3.106 3.058 3.166 . 0 0 "[ . 1 . 2]" 1
934 1 29 HIS HA 1 29 HIS HD2 . . 5.140 4.251 4.206 4.302 . 0 0 "[ . 1 . 2]" 1
935 1 29 HIS HA 1 30 TYR H . . 3.280 2.174 2.165 2.183 . 0 0 "[ . 1 . 2]" 1
936 1 29 HIS HA 1 30 TYR HA . . 5.400 4.400 4.396 4.404 . 0 0 "[ . 1 . 2]" 1
937 1 29 HIS HA 1 30 TYR QD . . 4.260 3.771 3.701 3.844 . 0 0 "[ . 1 . 2]" 1
938 1 29 HIS HA 1 30 TYR QE . . 5.320 5.315 5.292 5.341 0.021 2 0 "[ . 1 . 2]" 1
939 1 29 HIS HA 1 43 SER H . . 5.330 5.171 4.877 5.360 0.030 20 0 "[ . 1 . 2]" 1
940 1 29 HIS HA 1 43 SER HA . . 6.000 5.843 5.726 5.894 . 0 0 "[ . 1 . 2]" 1
941 1 29 HIS HA 1 43 SER HB2 . . 5.120 3.848 3.625 4.329 . 0 0 "[ . 1 . 2]" 1
942 1 29 HIS HA 1 43 SER QB . . 4.470 3.304 2.716 3.537 . 0 0 "[ . 1 . 2]" 1
943 1 29 HIS HA 1 43 SER HB3 . . 5.120 3.859 2.765 4.329 . 0 0 "[ . 1 . 2]" 1
944 1 29 HIS HA 1 43 SER HG . . 4.590 2.963 1.975 4.088 . 0 0 "[ . 1 . 2]" 1
945 1 29 HIS HA 1 44 ARG H . . 4.920 4.829 4.605 4.929 0.009 6 0 "[ . 1 . 2]" 1
946 1 29 HIS HA 1 44 ARG HG2 . . 6.000 5.528 5.168 5.670 . 0 0 "[ . 1 . 2]" 1
947 1 29 HIS HA 1 49 PRO HA . . 4.640 3.046 2.974 3.094 . 0 0 "[ . 1 . 2]" 1
948 1 29 HIS HA 1 49 PRO QB . . 5.110 3.878 3.807 3.950 . 0 0 "[ . 1 . 2]" 1
949 1 29 HIS HA 1 50 PHE H . . 4.090 2.997 2.968 3.028 . 0 0 "[ . 1 . 2]" 1
950 1 29 HIS HA 1 50 PHE HB2 . . 5.640 4.149 4.097 4.204 . 0 0 "[ . 1 . 2]" 1
951 1 29 HIS HA 1 105 VAL HA . . 5.140 5.005 4.944 5.063 . 0 0 "[ . 1 . 2]" 1
952 1 29 HIS HA 1 108 LEU MD1 . . 4.610 3.706 3.657 3.783 . 0 0 "[ . 1 . 2]" 1
953 1 29 HIS HB2 1 29 HIS HD2 . . 3.710 2.669 2.655 2.677 . 0 0 "[ . 1 . 2]" 1
954 1 29 HIS HB2 1 30 TYR H . . 5.300 4.469 4.456 4.479 . 0 0 "[ . 1 . 2]" 1
955 1 29 HIS HB2 1 43 SER QB . . 5.810 5.622 5.010 5.836 0.026 13 0 "[ . 1 . 2]" 1
956 1 29 HIS HB2 1 44 ARG HA . . 6.000 5.954 5.403 6.018 0.018 13 0 "[ . 1 . 2]" 1
957 1 29 HIS HB2 1 44 ARG HG2 . . 6.000 5.421 5.131 5.834 . 0 0 "[ . 1 . 2]" 1
958 1 29 HIS HB2 1 49 PRO HA . . 5.150 4.727 4.666 4.771 . 0 0 "[ . 1 . 2]" 1
959 1 29 HIS HB2 1 49 PRO QB . . 5.280 4.336 4.283 4.369 . 0 0 "[ . 1 . 2]" 1
960 1 29 HIS HB2 1 50 PHE H . . 5.990 5.364 5.310 5.415 . 0 0 "[ . 1 . 2]" 1
961 1 29 HIS HB2 1 105 VAL HA . . 6.000 5.056 5.029 5.078 . 0 0 "[ . 1 . 2]" 1
962 1 29 HIS HB2 1 106 GLU H . . 4.090 3.907 3.872 3.933 . 0 0 "[ . 1 . 2]" 1
963 1 29 HIS HB2 1 106 GLU HB2 . . 5.260 4.597 4.581 4.616 . 0 0 "[ . 1 . 2]" 1
964 1 29 HIS HB2 1 106 GLU HB3 . . 5.480 4.575 4.544 4.587 . 0 0 "[ . 1 . 2]" 1
965 1 29 HIS HB2 1 106 GLU HG3 . . 4.840 2.338 2.318 2.364 . 0 0 "[ . 1 . 2]" 1
966 1 29 HIS HB2 1 108 LEU H . . 6.000 6.030 6.011 6.062 0.062 7 0 "[ . 1 . 2]" 1
967 1 29 HIS HB2 1 108 LEU MD1 . . 4.030 2.686 2.612 2.766 . 0 0 "[ . 1 . 2]" 1
968 1 29 HIS HB2 1 108 LEU MD2 . . 3.430 3.112 3.065 3.175 . 0 0 "[ . 1 . 2]" 1
969 1 29 HIS HB3 1 30 TYR H . . 4.270 3.517 3.502 3.533 . 0 0 "[ . 1 . 2]" 1
970 1 29 HIS HB3 1 43 SER H . . 6.000 5.575 5.437 5.697 . 0 0 "[ . 1 . 2]" 1
971 1 29 HIS HB3 1 43 SER QB . . 5.810 4.736 4.002 5.108 . 0 0 "[ . 1 . 2]" 1
972 1 29 HIS HB3 1 44 ARG H . . 4.850 4.426 4.130 4.560 . 0 0 "[ . 1 . 2]" 1
973 1 29 HIS HB3 1 44 ARG HB3 . . 4.530 3.076 2.578 3.183 . 0 0 "[ . 1 . 2]" 1
974 1 29 HIS HB3 1 44 ARG HG2 . . 4.870 3.745 3.425 4.115 . 0 0 "[ . 1 . 2]" 1
975 1 29 HIS HB3 1 105 VAL HA . . 6.000 4.877 4.803 4.932 . 0 0 "[ . 1 . 2]" 1
976 1 29 HIS HB3 1 106 GLU H . . 4.670 4.544 4.479 4.609 . 0 0 "[ . 1 . 2]" 1
977 1 29 HIS HB3 1 106 GLU HB3 . . 5.720 5.246 5.162 5.309 . 0 0 "[ . 1 . 2]" 1
978 1 29 HIS HB3 1 108 LEU MD1 . . 4.630 4.111 4.057 4.185 . 0 0 "[ . 1 . 2]" 1
979 1 29 HIS HB3 1 108 LEU MD2 . . 4.800 4.584 4.537 4.655 . 0 0 "[ . 1 . 2]" 1
980 1 29 HIS HD2 1 49 PRO QB . . 4.190 2.885 2.813 2.977 . 0 0 "[ . 1 . 2]" 1
981 1 29 HIS HD2 1 49 PRO HD3 . . 4.990 4.720 4.540 4.943 . 0 0 "[ . 1 . 2]" 1
982 1 29 HIS HD2 1 49 PRO HG3 . . 4.390 4.428 4.422 4.438 0.048 3 0 "[ . 1 . 2]" 1
983 1 29 HIS HD2 1 106 GLU HG2 . . 5.170 4.748 4.684 4.802 . 0 0 "[ . 1 . 2]" 1
984 1 29 HIS HD2 1 108 LEU MD1 . . 3.110 2.084 2.042 2.149 . 0 0 "[ . 1 . 2]" 1
985 1 29 HIS HD2 1 108 LEU MD2 . . 3.340 2.638 2.496 2.795 . 0 0 "[ . 1 . 2]" 1
986 1 29 HIS HD2 1 108 LEU HG . . 4.400 4.176 4.080 4.323 . 0 0 "[ . 1 . 2]" 1
987 1 29 HIS HE1 1 44 ARG HA . . 3.800 2.217 2.188 2.255 . 0 0 "[ . 1 . 2]" 1
988 1 29 HIS HE1 1 44 ARG HB2 . . 5.940 4.194 3.965 4.588 . 0 0 "[ . 1 . 2]" 1
989 1 29 HIS HE1 1 44 ARG HB3 . . 4.740 3.537 3.437 3.921 . 0 0 "[ . 1 . 2]" 1
990 1 29 HIS HE1 1 44 ARG HG3 . . 5.730 5.538 5.323 5.711 . 0 0 "[ . 1 . 2]" 1
991 1 29 HIS HE1 1 47 ASN H . . 4.810 4.412 4.192 4.568 . 0 0 "[ . 1 . 2]" 1
992 1 29 HIS HE1 1 47 ASN HA . . 4.120 3.765 3.583 3.921 . 0 0 "[ . 1 . 2]" 1
993 1 29 HIS HE1 1 49 PRO HA . . 4.340 3.040 3.003 3.085 . 0 0 "[ . 1 . 2]" 1
994 1 29 HIS HE1 1 49 PRO QB . . 5.130 3.895 3.766 4.028 . 0 0 "[ . 1 . 2]" 1
995 1 29 HIS HE1 1 49 PRO HD2 . . 5.260 4.544 4.483 4.598 . 0 0 "[ . 1 . 2]" 1
996 1 29 HIS HE1 1 49 PRO HD3 . . 4.960 3.430 3.352 3.528 . 0 0 "[ . 1 . 2]" 1
997 1 29 HIS HE1 1 49 PRO HG3 . . 5.630 5.012 4.800 5.190 . 0 0 "[ . 1 . 2]" 1
998 1 29 HIS HE1 1 50 PHE H . . 5.240 5.254 5.241 5.275 0.035 3 0 "[ . 1 . 2]" 1
999 1 29 HIS HE1 1 108 LEU MD1 . . 6.000 5.026 4.891 5.136 . 0 0 "[ . 1 . 2]" 1
1000 1 30 TYR H 1 30 TYR HB3 . . 4.130 2.952 2.931 2.973 . 0 0 "[ . 1 . 2]" 1
1001 1 30 TYR H 1 30 TYR QD . . 3.960 2.601 2.504 2.695 . 0 0 "[ . 1 . 2]" 1
1002 1 30 TYR H 1 31 THR H . . 4.550 4.506 4.503 4.509 . 0 0 "[ . 1 . 2]" 1
1003 1 30 TYR H 1 42 SER HA . . 5.850 5.356 5.011 5.633 . 0 0 "[ . 1 . 2]" 1
1004 1 30 TYR H 1 43 SER H . . 3.910 3.605 3.283 3.829 . 0 0 "[ . 1 . 2]" 1
1005 1 30 TYR H 1 43 SER HB2 . . 4.570 3.373 2.750 3.738 . 0 0 "[ . 1 . 2]" 1
1006 1 30 TYR H 1 43 SER QB . . 4.020 2.714 2.085 3.148 . 0 0 "[ . 1 . 2]" 1
1007 1 30 TYR H 1 43 SER HB3 . . 4.570 2.877 2.134 3.394 . 0 0 "[ . 1 . 2]" 1
1008 1 30 TYR H 1 44 ARG H . . 4.670 4.200 3.970 4.342 . 0 0 "[ . 1 . 2]" 1
1009 1 30 TYR H 1 44 ARG HG2 . . 5.880 5.077 4.682 5.286 . 0 0 "[ . 1 . 2]" 1
1010 1 30 TYR H 1 50 PHE H . . 4.970 4.260 4.205 4.294 . 0 0 "[ . 1 . 2]" 1
1011 1 30 TYR H 1 105 VAL HA . . 4.880 4.410 4.360 4.462 . 0 0 "[ . 1 . 2]" 1
1012 1 30 TYR H 1 105 VAL MG1 . . 4.570 4.242 4.214 4.269 . 0 0 "[ . 1 . 2]" 1
1013 1 30 TYR H 1 106 GLU H . . 5.200 5.103 5.074 5.132 . 0 0 "[ . 1 . 2]" 1
1014 1 30 TYR HA 1 30 TYR QD . . 4.240 3.751 3.748 3.753 . 0 0 "[ . 1 . 2]" 1
1015 1 30 TYR HA 1 31 THR H . . 2.860 2.395 2.377 2.418 . 0 0 "[ . 1 . 2]" 1
1016 1 30 TYR HA 1 31 THR HA . . 5.420 4.523 4.515 4.533 . 0 0 "[ . 1 . 2]" 1
1017 1 30 TYR HA 1 31 THR HB . . 5.230 4.811 4.742 4.894 . 0 0 "[ . 1 . 2]" 1
1018 1 30 TYR HA 1 63 TRP HZ2 . . 5.370 5.182 5.029 5.238 . 0 0 "[ . 1 . 2]" 1
1019 1 30 TYR HA 1 103 PHE HA . . 5.570 5.547 5.477 5.587 0.017 5 0 "[ . 1 . 2]" 1
1020 1 30 TYR HA 1 103 PHE HB3 . . 6.000 4.799 4.714 4.862 . 0 0 "[ . 1 . 2]" 1
1021 1 30 TYR HA 1 104 ASP H . . 4.610 3.948 3.876 4.011 . 0 0 "[ . 1 . 2]" 1
1022 1 30 TYR HA 1 105 VAL H . . 5.040 4.262 4.206 4.313 . 0 0 "[ . 1 . 2]" 1
1023 1 30 TYR HA 1 105 VAL HA . . 3.610 2.232 2.214 2.261 . 0 0 "[ . 1 . 2]" 1
1024 1 30 TYR HA 1 105 VAL HB . . 5.330 4.067 4.010 4.131 . 0 0 "[ . 1 . 2]" 1
1025 1 30 TYR HA 1 105 VAL MG1 . . 3.870 2.498 2.424 2.575 . 0 0 "[ . 1 . 2]" 1
1026 1 30 TYR HA 1 106 GLU H . . 4.260 4.070 4.033 4.113 . 0 0 "[ . 1 . 2]" 1
1027 1 30 TYR HB2 1 31 THR H . . 3.300 2.376 2.347 2.410 . 0 0 "[ . 1 . 2]" 1
1028 1 30 TYR HB2 1 32 GLY H . . 5.980 4.987 4.906 5.086 . 0 0 "[ . 1 . 2]" 1
1029 1 30 TYR HB2 1 43 SER H . . 5.440 5.295 5.029 5.480 0.040 12 0 "[ . 1 . 2]" 1
1030 1 30 TYR HB2 1 63 TRP HH2 . . 4.820 3.782 3.652 3.889 . 0 0 "[ . 1 . 2]" 1
1031 1 30 TYR HB2 1 63 TRP HZ2 . . 3.910 2.795 2.653 2.849 . 0 0 "[ . 1 . 2]" 1
1032 1 30 TYR HB2 1 103 PHE QD . . 4.080 3.034 2.897 3.109 . 0 0 "[ . 1 . 2]" 1
1033 1 30 TYR HB2 1 105 VAL HA . . 4.800 3.938 3.906 3.992 . 0 0 "[ . 1 . 2]" 1
1034 1 30 TYR HB2 1 105 VAL MG1 . . 3.600 2.275 2.244 2.311 . 0 0 "[ . 1 . 2]" 1
1035 1 30 TYR HB3 1 31 THR H . . 3.990 3.769 3.746 3.798 . 0 0 "[ . 1 . 2]" 1
1036 1 30 TYR HB3 1 43 SER H . . 5.700 5.514 5.161 5.740 0.040 15 0 "[ . 1 . 2]" 1
1037 1 30 TYR HB3 1 50 PHE H . . 6.000 5.717 5.625 5.795 . 0 0 "[ . 1 . 2]" 1
1038 1 30 TYR HB3 1 63 TRP HH2 . . 4.290 3.479 3.301 3.574 . 0 0 "[ . 1 . 2]" 1
1039 1 30 TYR HB3 1 63 TRP HZ2 . . 3.830 3.556 3.377 3.672 . 0 0 "[ . 1 . 2]" 1
1040 1 30 TYR HB3 1 103 PHE QD . . 4.720 4.605 4.451 4.689 . 0 0 "[ . 1 . 2]" 1
1041 1 30 TYR HB3 1 105 VAL HA . . 3.910 3.507 3.458 3.559 . 0 0 "[ . 1 . 2]" 1
1042 1 30 TYR HB3 1 105 VAL MG1 . . 4.500 2.079 2.061 2.093 . 0 0 "[ . 1 . 2]" 1
1043 1 30 TYR HB3 1 105 VAL MG2 . . 4.590 4.607 4.594 4.622 0.032 8 0 "[ . 1 . 2]" 1
1044 1 30 TYR HB3 1 106 GLU H . . 5.140 4.893 4.863 4.926 . 0 0 "[ . 1 . 2]" 1
1045 1 30 TYR QD 1 31 THR H . . 3.730 3.008 2.957 3.058 . 0 0 "[ . 1 . 2]" 1
1046 1 30 TYR QD 1 31 THR HB . . 5.520 5.336 5.309 5.365 . 0 0 "[ . 1 . 2]" 1
1047 1 30 TYR QD 1 32 GLY H . . 3.870 3.099 2.998 3.230 . 0 0 "[ . 1 . 2]" 1
1048 1 30 TYR QD 1 32 GLY HA2 . . 4.530 4.303 4.178 4.460 . 0 0 "[ . 1 . 2]" 1
1049 1 30 TYR QD 1 42 SER HA . . 4.580 3.972 3.357 4.483 . 0 0 "[ . 1 . 2]" 1
1050 1 30 TYR QD 1 43 SER H . . 4.120 3.899 3.681 4.073 . 0 0 "[ . 1 . 2]" 1
1051 1 30 TYR QD 1 43 SER QB . . 3.900 2.913 2.672 3.061 . 0 0 "[ . 1 . 2]" 1
1052 1 30 TYR QD 1 50 PHE H . . 4.430 3.980 3.856 4.078 . 0 0 "[ . 1 . 2]" 1
1053 1 30 TYR QD 1 50 PHE HB2 . . 4.210 2.526 2.393 2.651 . 0 0 "[ . 1 . 2]" 1
1054 1 30 TYR QD 1 63 TRP HH2 . . 3.920 2.833 2.720 2.883 . 0 0 "[ . 1 . 2]" 1
1055 1 30 TYR QD 1 63 TRP HZ2 . . 3.690 2.905 2.794 3.094 . 0 0 "[ . 1 . 2]" 1
1056 1 30 TYR QD 1 63 TRP HZ3 . . 5.000 4.030 3.906 4.186 . 0 0 "[ . 1 . 2]" 1
1057 1 30 TYR QD 1 105 VAL HA . . 5.260 5.132 5.102 5.170 . 0 0 "[ . 1 . 2]" 1
1058 1 30 TYR QD 1 105 VAL MG1 . . 3.880 3.661 3.622 3.691 . 0 0 "[ . 1 . 2]" 1
1059 1 30 TYR QD 1 106 GLU H . . 6.000 6.052 6.040 6.066 0.066 6 0 "[ . 1 . 2]" 1
1060 1 30 TYR QE 1 31 THR HA . . 4.500 4.539 4.530 4.550 0.050 16 0 "[ . 1 . 2]" 1
1061 1 30 TYR QE 1 32 GLY H . . 4.590 3.773 3.590 3.953 . 0 0 "[ . 1 . 2]" 1
1062 1 30 TYR QE 1 32 GLY HA2 . . 6.000 5.441 5.250 5.676 . 0 0 "[ . 1 . 2]" 1
1063 1 30 TYR QE 1 40 PHE QE . . 5.270 4.904 4.492 5.220 . 0 0 "[ . 1 . 2]" 1
1064 1 30 TYR QE 1 41 ASP HB2 . . 4.820 3.895 3.117 4.435 . 0 0 "[ . 1 . 2]" 1
1065 1 30 TYR QE 1 41 ASP HB3 . . 3.680 2.513 2.189 3.069 . 0 0 "[ . 1 . 2]" 1
1066 1 30 TYR QE 1 42 SER H . . 5.310 4.818 4.643 4.984 . 0 0 "[ . 1 . 2]" 1
1067 1 30 TYR QE 1 42 SER HA . . 4.380 3.866 3.182 4.391 0.011 19 0 "[ . 1 . 2]" 1
1068 1 30 TYR QE 1 43 SER H . . 4.230 3.964 3.765 4.104 . 0 0 "[ . 1 . 2]" 1
1069 1 30 TYR QE 1 43 SER HB2 . . 4.000 3.347 2.531 3.758 . 0 0 "[ . 1 . 2]" 1
1070 1 30 TYR QE 1 43 SER QB . . 3.500 2.480 2.306 2.690 . 0 0 "[ . 1 . 2]" 1
1071 1 30 TYR QE 1 43 SER HB3 . . 4.000 2.932 2.329 4.029 0.029 16 0 "[ . 1 . 2]" 1
1072 1 30 TYR QE 1 50 PHE H . . 4.720 4.668 4.594 4.726 0.006 13 0 "[ . 1 . 2]" 1
1073 1 30 TYR QE 1 50 PHE HA . . 4.850 4.278 4.233 4.312 . 0 0 "[ . 1 . 2]" 1
1074 1 30 TYR QE 1 50 PHE HB2 . . 3.370 2.164 2.126 2.198 . 0 0 "[ . 1 . 2]" 1
1075 1 30 TYR QE 1 50 PHE HB3 . . 3.500 3.195 3.036 3.339 . 0 0 "[ . 1 . 2]" 1
1076 1 30 TYR QE 1 50 PHE QD . . 3.660 2.319 2.302 2.332 . 0 0 "[ . 1 . 2]" 1
1077 1 30 TYR QE 1 63 TRP HH2 . . 4.030 3.053 3.008 3.119 . 0 0 "[ . 1 . 2]" 1
1078 1 30 TYR QE 1 63 TRP HZ2 . . 4.230 3.959 3.847 4.217 . 0 0 "[ . 1 . 2]" 1
1079 1 30 TYR QE 1 103 PHE QD . . 4.640 4.077 3.941 4.331 . 0 0 "[ . 1 . 2]" 1
1080 1 30 TYR QE 1 103 PHE QE . . 4.780 3.426 3.214 3.712 . 0 0 "[ . 1 . 2]" 1
1081 1 31 THR H 1 31 THR HB . . 3.390 3.101 3.063 3.148 . 0 0 "[ . 1 . 2]" 1
1082 1 31 THR H 1 31 THR MG . . 4.010 4.029 4.026 4.032 0.022 11 0 "[ . 1 . 2]" 1
1083 1 31 THR H 1 32 GLY H . . 4.240 3.901 3.846 3.960 . 0 0 "[ . 1 . 2]" 1
1084 1 31 THR H 1 32 GLY HA2 . . 4.750 4.443 4.410 4.470 . 0 0 "[ . 1 . 2]" 1
1085 1 31 THR H 1 32 GLY HA3 . . 5.250 5.175 5.144 5.215 . 0 0 "[ . 1 . 2]" 1
1086 1 31 THR H 1 33 MET ME . . 4.790 4.617 4.472 4.728 . 0 0 "[ . 1 . 2]" 1
1087 1 31 THR H 1 103 PHE HA . . 3.690 3.497 3.421 3.559 . 0 0 "[ . 1 . 2]" 1
1088 1 31 THR H 1 103 PHE QD . . 3.730 3.483 3.411 3.619 . 0 0 "[ . 1 . 2]" 1
1089 1 31 THR H 1 104 ASP HB3 . . 4.130 3.683 3.575 3.816 . 0 0 "[ . 1 . 2]" 1
1090 1 31 THR H 1 105 VAL H . . 5.050 4.845 4.808 4.882 . 0 0 "[ . 1 . 2]" 1
1091 1 31 THR H 1 105 VAL HA . . 4.400 4.172 4.119 4.237 . 0 0 "[ . 1 . 2]" 1
1092 1 31 THR H 1 105 VAL MG1 . . 3.940 3.434 3.365 3.510 . 0 0 "[ . 1 . 2]" 1
1093 1 31 THR HA 1 31 THR MG . . 3.220 2.249 2.209 2.295 . 0 0 "[ . 1 . 2]" 1
1094 1 31 THR HA 1 32 GLY H . . 2.980 2.165 2.152 2.194 . 0 0 "[ . 1 . 2]" 1
1095 1 31 THR HA 1 32 GLY HA2 . . 5.110 4.430 4.420 4.447 . 0 0 "[ . 1 . 2]" 1
1096 1 31 THR HA 1 32 GLY HA3 . . 5.140 4.428 4.414 4.455 . 0 0 "[ . 1 . 2]" 1
1097 1 31 THR HA 1 42 SER QB . . 3.950 3.257 2.361 3.916 . 0 0 "[ . 1 . 2]" 1
1098 1 31 THR HA 1 43 SER H . . 4.310 3.546 3.498 3.594 . 0 0 "[ . 1 . 2]" 1
1099 1 31 THR HA 1 44 ARG HG2 . . 5.990 5.064 4.549 5.526 . 0 0 "[ . 1 . 2]" 1
1100 1 31 THR HB 1 32 GLY H . . 5.470 4.230 4.191 4.267 . 0 0 "[ . 1 . 2]" 1
1101 1 31 THR HB 1 33 MET ME . . 3.740 2.318 2.186 2.468 . 0 0 "[ . 1 . 2]" 1
1102 1 31 THR HB 1 103 PHE HA . . 5.410 4.283 4.175 4.366 . 0 0 "[ . 1 . 2]" 1
1103 1 31 THR HB 1 104 ASP H . . 4.580 2.988 2.901 3.098 . 0 0 "[ . 1 . 2]" 1
1104 1 31 THR HB 1 104 ASP HA . . 5.760 5.093 5.009 5.214 . 0 0 "[ . 1 . 2]" 1
1105 1 31 THR HB 1 104 ASP HB2 . . 4.080 3.403 3.302 3.552 . 0 0 "[ . 1 . 2]" 1
1106 1 31 THR HB 1 104 ASP HB3 . . 4.180 2.708 2.585 2.880 . 0 0 "[ . 1 . 2]" 1
1107 1 31 THR MG 1 32 GLY H . . 3.440 3.159 3.091 3.226 . 0 0 "[ . 1 . 2]" 1
1108 1 31 THR MG 1 32 GLY HA3 . . 5.160 4.755 4.719 4.804 . 0 0 "[ . 1 . 2]" 1
1109 1 31 THR MG 1 33 MET H . . 4.960 4.724 4.601 4.840 . 0 0 "[ . 1 . 2]" 1
1110 1 31 THR MG 1 33 MET HB2 . . 4.880 4.527 4.392 4.599 . 0 0 "[ . 1 . 2]" 1
1111 1 31 THR MG 1 33 MET HB3 . . 5.300 5.258 5.157 5.329 0.029 13 0 "[ . 1 . 2]" 1
1112 1 31 THR MG 1 33 MET ME . . 3.230 2.244 2.129 2.411 . 0 0 "[ . 1 . 2]" 1
1113 1 31 THR MG 1 33 MET HG3 . . 3.670 2.697 2.568 2.840 . 0 0 "[ . 1 . 2]" 1
1114 1 31 THR MG 1 42 SER H . . 5.170 4.981 4.721 5.181 0.011 15 0 "[ . 1 . 2]" 1
1115 1 31 THR MG 1 42 SER HB2 . . 4.060 3.040 2.108 3.940 . 0 0 "[ . 1 . 2]" 1
1116 1 31 THR MG 1 42 SER QB . . 3.450 2.503 2.075 2.927 . 0 0 "[ . 1 . 2]" 1
1117 1 31 THR MG 1 42 SER HB3 . . 4.060 3.144 2.842 3.577 . 0 0 "[ . 1 . 2]" 1
1118 1 31 THR MG 1 43 SER H . . 4.510 4.465 4.380 4.558 0.048 17 0 "[ . 1 . 2]" 1
1119 1 31 THR MG 1 103 PHE HA . . 5.060 5.001 4.931 5.068 0.008 3 0 "[ . 1 . 2]" 1
1120 1 31 THR MG 1 104 ASP H . . 4.560 4.411 4.341 4.504 . 0 0 "[ . 1 . 2]" 1
1121 1 31 THR MG 1 104 ASP HB3 . . 5.000 4.144 4.070 4.242 . 0 0 "[ . 1 . 2]" 1
1122 1 32 GLY H 1 40 PHE H . . 4.770 4.394 4.279 4.530 . 0 0 "[ . 1 . 2]" 1
1123 1 32 GLY H 1 41 ASP H . . 3.990 3.572 3.442 3.780 . 0 0 "[ . 1 . 2]" 1
1124 1 32 GLY H 1 41 ASP HB2 . . 5.140 4.697 3.698 5.192 0.052 8 0 "[ . 1 . 2]" 1
1125 1 32 GLY H 1 42 SER HA . . 3.480 3.174 2.749 3.497 0.017 15 0 "[ . 1 . 2]" 1
1126 1 32 GLY H 1 42 SER QB . . 4.520 3.938 3.058 4.537 0.017 5 0 "[ . 1 . 2]" 1
1127 1 32 GLY H 1 43 SER H . . 4.720 4.733 4.618 4.757 0.037 6 0 "[ . 1 . 2]" 1
1128 1 32 GLY H 1 103 PHE HA . . 4.860 4.548 4.494 4.585 . 0 0 "[ . 1 . 2]" 1
1129 1 32 GLY H 1 103 PHE HB3 . . 5.920 5.675 5.580 5.752 . 0 0 "[ . 1 . 2]" 1
1130 1 32 GLY H 1 103 PHE QE . . 4.980 4.134 4.037 4.282 . 0 0 "[ . 1 . 2]" 1
1131 1 32 GLY HA2 1 33 MET H . . 3.000 2.106 2.101 2.112 . 0 0 "[ . 1 . 2]" 1
1132 1 32 GLY HA2 1 33 MET HB2 . . 5.480 4.405 4.383 4.439 . 0 0 "[ . 1 . 2]" 1
1133 1 32 GLY HA2 1 33 MET HB3 . . 5.740 5.658 5.647 5.673 . 0 0 "[ . 1 . 2]" 1
1134 1 32 GLY HA2 1 33 MET ME . . 4.730 4.116 3.959 4.206 . 0 0 "[ . 1 . 2]" 1
1135 1 32 GLY HA2 1 40 PHE H . . 5.340 5.070 4.998 5.148 . 0 0 "[ . 1 . 2]" 1
1136 1 32 GLY HA2 1 40 PHE QE . . 4.510 3.897 3.666 3.984 . 0 0 "[ . 1 . 2]" 1
1137 1 32 GLY HA2 1 40 PHE HZ . . 4.670 3.550 3.202 3.725 . 0 0 "[ . 1 . 2]" 1
1138 1 32 GLY HA2 1 41 ASP H . . 5.430 5.137 5.059 5.335 . 0 0 "[ . 1 . 2]" 1
1139 1 32 GLY HA2 1 101 LEU QD . . 5.920 5.006 4.949 5.053 . 0 0 "[ . 1 . 2]" 1
1140 1 32 GLY HA2 1 102 VAL H . . 5.130 4.354 4.289 4.413 . 0 0 "[ . 1 . 2]" 1
1141 1 32 GLY HA2 1 102 VAL HA . . 6.000 5.417 5.350 5.489 . 0 0 "[ . 1 . 2]" 1
1142 1 32 GLY HA2 1 103 PHE H . . 5.060 4.807 4.766 4.854 . 0 0 "[ . 1 . 2]" 1
1143 1 32 GLY HA2 1 103 PHE HA . . 3.790 2.578 2.537 2.648 . 0 0 "[ . 1 . 2]" 1
1144 1 32 GLY HA2 1 103 PHE HB2 . . 5.520 4.845 4.806 4.872 . 0 0 "[ . 1 . 2]" 1
1145 1 32 GLY HA2 1 103 PHE HB3 . . 5.440 4.289 4.243 4.328 . 0 0 "[ . 1 . 2]" 1
1146 1 32 GLY HA2 1 103 PHE QD . . 4.560 2.987 2.903 3.128 . 0 0 "[ . 1 . 2]" 1
1147 1 32 GLY HA2 1 103 PHE HZ . . 6.000 4.644 4.508 4.798 . 0 0 "[ . 1 . 2]" 1
1148 1 32 GLY HA3 1 33 MET H . . 3.270 3.246 3.207 3.273 0.003 14 0 "[ . 1 . 2]" 1
1149 1 32 GLY HA3 1 33 MET HA . . 5.560 4.530 4.519 4.541 . 0 0 "[ . 1 . 2]" 1
1150 1 32 GLY HA3 1 33 MET ME . . 5.580 5.156 4.966 5.289 . 0 0 "[ . 1 . 2]" 1
1151 1 32 GLY HA3 1 40 PHE H . . 5.480 4.026 3.939 4.095 . 0 0 "[ . 1 . 2]" 1
1152 1 32 GLY HA3 1 40 PHE HB2 . . 6.000 5.905 5.728 6.013 0.013 2 0 "[ . 1 . 2]" 1
1153 1 32 GLY HA3 1 40 PHE QD . . 4.420 3.921 3.682 4.037 . 0 0 "[ . 1 . 2]" 1
1154 1 32 GLY HA3 1 40 PHE QE . . 3.970 3.031 2.634 3.227 . 0 0 "[ . 1 . 2]" 1
1155 1 32 GLY HA3 1 40 PHE HZ . . 4.300 3.181 2.960 3.303 . 0 0 "[ . 1 . 2]" 1
1156 1 32 GLY HA3 1 41 ASP H . . 4.390 3.774 3.684 3.964 . 0 0 "[ . 1 . 2]" 1
1157 1 32 GLY HA3 1 41 ASP HA . . 5.940 5.599 5.463 5.816 . 0 0 "[ . 1 . 2]" 1
1158 1 32 GLY HA3 1 101 LEU HB3 . . 6.000 5.152 5.069 5.229 . 0 0 "[ . 1 . 2]" 1
1159 1 32 GLY HA3 1 101 LEU MD1 . . 5.920 5.912 5.799 5.929 0.009 6 0 "[ . 1 . 2]" 1
1160 1 32 GLY HA3 1 101 LEU MD2 . . 5.920 5.027 4.941 5.080 . 0 0 "[ . 1 . 2]" 1
1161 1 32 GLY HA3 1 103 PHE HA . . 4.460 4.176 4.117 4.252 . 0 0 "[ . 1 . 2]" 1
1162 1 32 GLY HA3 1 103 PHE HB2 . . 6.000 6.053 6.042 6.063 0.063 3 0 "[ . 1 . 2]" 1
1163 1 32 GLY HA3 1 103 PHE HB3 . . 5.770 5.331 5.308 5.354 . 0 0 "[ . 1 . 2]" 1
1164 1 32 GLY HA3 1 103 PHE QD . . 4.610 3.315 3.240 3.448 . 0 0 "[ . 1 . 2]" 1
1165 1 32 GLY HA3 1 103 PHE HZ . . 5.050 4.058 3.936 4.231 . 0 0 "[ . 1 . 2]" 1
1166 1 33 MET H 1 33 MET HB2 . . 3.450 2.599 2.556 2.660 . 0 0 "[ . 1 . 2]" 1
1167 1 33 MET H 1 33 MET ME . . 3.970 3.503 3.455 3.577 . 0 0 "[ . 1 . 2]" 1
1168 1 33 MET H 1 33 MET HG2 . . 4.630 4.450 4.379 4.521 . 0 0 "[ . 1 . 2]" 1
1169 1 33 MET H 1 33 MET HG3 . . 4.940 3.330 3.243 3.392 . 0 0 "[ . 1 . 2]" 1
1170 1 33 MET H 1 34 LEU HA . . 5.510 4.987 4.910 5.022 . 0 0 "[ . 1 . 2]" 1
1171 1 33 MET H 1 37 GLY HA2 . . 6.000 5.914 5.777 6.011 0.011 15 0 "[ . 1 . 2]" 1
1172 1 33 MET H 1 40 PHE H . . 5.030 4.962 4.910 5.014 . 0 0 "[ . 1 . 2]" 1
1173 1 33 MET H 1 40 PHE QD . . 4.920 4.689 4.602 4.757 . 0 0 "[ . 1 . 2]" 1
1174 1 33 MET H 1 40 PHE QE . . 3.950 3.381 3.182 3.476 . 0 0 "[ . 1 . 2]" 1
1175 1 33 MET H 1 40 PHE HZ . . 4.370 3.889 3.424 4.151 . 0 0 "[ . 1 . 2]" 1
1176 1 33 MET H 1 101 LEU HB3 . . 4.880 4.510 4.345 4.644 . 0 0 "[ . 1 . 2]" 1
1177 1 33 MET H 1 101 LEU QD . . 5.070 4.751 4.668 4.861 . 0 0 "[ . 1 . 2]" 1
1178 1 33 MET H 1 102 VAL H . . 3.760 3.050 2.950 3.124 . 0 0 "[ . 1 . 2]" 1
1179 1 33 MET H 1 102 VAL HB . . 3.550 3.155 2.999 3.360 . 0 0 "[ . 1 . 2]" 1
1180 1 33 MET H 1 102 VAL QG . . 5.300 3.714 3.620 3.824 . 0 0 "[ . 1 . 2]" 1
1181 1 33 MET H 1 103 PHE H . . 5.110 4.810 4.763 4.849 . 0 0 "[ . 1 . 2]" 1
1182 1 33 MET H 1 103 PHE HA . . 3.850 3.523 3.454 3.577 . 0 0 "[ . 1 . 2]" 1
1183 1 33 MET H 1 103 PHE HB2 . . 6.000 5.862 5.797 5.894 . 0 0 "[ . 1 . 2]" 1
1184 1 33 MET H 1 103 PHE HB3 . . 6.000 5.772 5.698 5.826 . 0 0 "[ . 1 . 2]" 1
1185 1 33 MET H 1 104 ASP H . . 5.710 5.097 5.004 5.208 . 0 0 "[ . 1 . 2]" 1
1186 1 33 MET HA 1 33 MET ME . . 4.380 4.332 4.285 4.369 . 0 0 "[ . 1 . 2]" 1
1187 1 33 MET HA 1 33 MET HG2 . . 3.530 2.686 2.665 2.729 . 0 0 "[ . 1 . 2]" 1
1188 1 33 MET HA 1 33 MET HG3 . . 3.890 2.745 2.707 2.778 . 0 0 "[ . 1 . 2]" 1
1189 1 33 MET HA 1 34 LEU H . . 2.870 2.129 2.119 2.145 . 0 0 "[ . 1 . 2]" 1
1190 1 33 MET HA 1 34 LEU HA . . 4.390 4.349 4.334 4.365 . 0 0 "[ . 1 . 2]" 1
1191 1 33 MET HA 1 34 LEU HB2 . . 4.980 4.302 4.294 4.319 . 0 0 "[ . 1 . 2]" 1
1192 1 33 MET HA 1 34 LEU HB3 . . 5.790 5.613 5.607 5.624 . 0 0 "[ . 1 . 2]" 1
1193 1 33 MET HA 1 34 LEU HG . . 5.240 4.500 4.449 4.558 . 0 0 "[ . 1 . 2]" 1
1194 1 33 MET HA 1 37 GLY H . . 5.030 5.138 5.114 5.161 0.131 3 0 "[ . 1 . 2]" 1
1195 1 33 MET HA 1 40 PHE H . . 3.330 3.311 3.231 3.347 0.017 13 0 "[ . 1 . 2]" 1
1196 1 33 MET HA 1 40 PHE QD . . 3.600 3.224 3.118 3.348 . 0 0 "[ . 1 . 2]" 1
1197 1 33 MET HA 1 40 PHE QE . . 4.310 3.503 3.329 3.636 . 0 0 "[ . 1 . 2]" 1
1198 1 33 MET HA 1 41 ASP H . . 4.910 4.774 4.685 4.902 . 0 0 "[ . 1 . 2]" 1
1199 1 33 MET HB2 1 33 MET HG3 . . 2.920 2.543 2.533 2.569 . 0 0 "[ . 1 . 2]" 1
1200 1 33 MET HB2 1 34 LEU H . . 4.450 4.249 4.189 4.289 . 0 0 "[ . 1 . 2]" 1
1201 1 33 MET HB2 1 37 GLY H . . 5.670 5.230 5.129 5.332 . 0 0 "[ . 1 . 2]" 1
1202 1 33 MET HB2 1 37 GLY HA2 . . 4.050 3.755 3.612 3.900 . 0 0 "[ . 1 . 2]" 1
1203 1 33 MET HB2 1 37 GLY HA3 . . 5.580 5.405 5.252 5.560 . 0 0 "[ . 1 . 2]" 1
1204 1 33 MET HB2 1 40 PHE QD . . 6.000 5.846 5.749 5.969 . 0 0 "[ . 1 . 2]" 1
1205 1 33 MET HB2 1 102 VAL H . . 5.240 4.355 4.271 4.436 . 0 0 "[ . 1 . 2]" 1
1206 1 33 MET HB3 1 34 LEU H . . 3.580 3.229 3.127 3.293 . 0 0 "[ . 1 . 2]" 1
1207 1 33 MET HB3 1 37 GLY H . . 5.540 3.812 3.741 3.891 . 0 0 "[ . 1 . 2]" 1
1208 1 33 MET HB3 1 37 GLY HA2 . . 4.950 2.366 2.305 2.449 . 0 0 "[ . 1 . 2]" 1
1209 1 33 MET HB3 1 37 GLY HA3 . . 4.880 3.970 3.868 4.077 . 0 0 "[ . 1 . 2]" 1
1210 1 33 MET HB3 1 102 VAL H . . 5.130 5.092 5.019 5.138 0.008 3 0 "[ . 1 . 2]" 1
1211 1 33 MET HB3 1 102 VAL QG . . 4.940 4.055 3.959 4.147 . 0 0 "[ . 1 . 2]" 1
1212 1 33 MET ME 1 33 MET HG3 . . 3.150 2.375 2.368 2.382 . 0 0 "[ . 1 . 2]" 1
1213 1 33 MET ME 1 102 VAL QG . . 2.800 2.834 2.823 2.848 0.048 17 0 "[ . 1 . 2]" 1
1214 1 33 MET ME 1 103 PHE HA . . 4.180 3.953 3.894 3.989 . 0 0 "[ . 1 . 2]" 1
1215 1 33 MET ME 1 104 ASP H . . 3.710 3.730 3.723 3.736 0.026 8 0 "[ . 1 . 2]" 1
1216 1 33 MET ME 1 104 ASP HB2 . . 3.470 3.123 3.012 3.243 . 0 0 "[ . 1 . 2]" 1
1217 1 33 MET ME 1 104 ASP HB3 . . 3.960 3.608 3.530 3.698 . 0 0 "[ . 1 . 2]" 1
1218 1 33 MET HG2 1 37 GLY HA2 . . 4.010 4.039 4.035 4.042 0.032 13 0 "[ . 1 . 2]" 1
1219 1 33 MET HG2 1 40 PHE H . . 4.940 4.623 4.447 4.758 . 0 0 "[ . 1 . 2]" 1
1220 1 33 MET HG3 1 40 PHE H . . 4.700 4.331 4.120 4.544 . 0 0 "[ . 1 . 2]" 1
1221 1 34 LEU H 1 34 LEU HB2 . . 3.160 2.223 2.209 2.240 . 0 0 "[ . 1 . 2]" 1
1222 1 34 LEU H 1 34 LEU HB3 . . 3.930 3.514 3.506 3.522 . 0 0 "[ . 1 . 2]" 1
1223 1 34 LEU H 1 34 LEU MD1 . . 4.290 3.419 3.373 3.598 . 0 0 "[ . 1 . 2]" 1
1224 1 34 LEU H 1 34 LEU QD . . 3.590 3.230 3.197 3.340 . 0 0 "[ . 1 . 2]" 1
1225 1 34 LEU H 1 34 LEU MD2 . . 4.290 3.973 3.950 4.005 . 0 0 "[ . 1 . 2]" 1
1226 1 34 LEU H 1 34 LEU HG . . 3.290 2.798 2.756 2.853 . 0 0 "[ . 1 . 2]" 1
1227 1 34 LEU H 1 35 GLU H . . 4.690 4.650 4.641 4.660 . 0 0 "[ . 1 . 2]" 1
1228 1 34 LEU H 1 37 GLY HA2 . . 5.570 4.344 4.285 4.393 . 0 0 "[ . 1 . 2]" 1
1229 1 34 LEU H 1 40 PHE HB2 . . 6.000 6.088 6.067 6.113 0.113 13 0 "[ . 1 . 2]" 1
1230 1 34 LEU H 1 40 PHE HB3 . . 5.110 4.585 4.550 4.619 . 0 0 "[ . 1 . 2]" 1
1231 1 34 LEU H 1 40 PHE QD . . 3.570 2.677 2.653 2.733 . 0 0 "[ . 1 . 2]" 1
1232 1 34 LEU H 1 40 PHE QE . . 4.540 3.267 3.099 3.380 . 0 0 "[ . 1 . 2]" 1
1233 1 34 LEU H 1 101 LEU QD . . 4.830 4.508 4.395 4.604 . 0 0 "[ . 1 . 2]" 1
1234 1 34 LEU HA 1 34 LEU MD1 . . 3.860 3.824 3.817 3.829 . 0 0 "[ . 1 . 2]" 1
1235 1 34 LEU HA 1 34 LEU QD . . 2.890 2.238 2.202 2.260 . 0 0 "[ . 1 . 2]" 1
1236 1 34 LEU HA 1 34 LEU MD2 . . 3.860 2.253 2.216 2.276 . 0 0 "[ . 1 . 2]" 1
1237 1 34 LEU HA 1 34 LEU HG . . 3.580 2.616 2.579 2.665 . 0 0 "[ . 1 . 2]" 1
1238 1 34 LEU HA 1 35 GLU H . . 3.140 2.491 2.482 2.502 . 0 0 "[ . 1 . 2]" 1
1239 1 34 LEU HA 1 35 GLU HA . . 4.600 4.346 4.343 4.348 . 0 0 "[ . 1 . 2]" 1
1240 1 34 LEU HA 1 36 ASP H . . 4.250 4.229 4.188 4.251 0.001 18 0 "[ . 1 . 2]" 1
1241 1 34 LEU HA 1 37 GLY H . . 5.170 4.361 4.339 4.377 . 0 0 "[ . 1 . 2]" 1
1242 1 34 LEU HA 1 101 LEU HA . . 4.330 3.032 2.851 3.107 . 0 0 "[ . 1 . 2]" 1
1243 1 34 LEU HA 1 101 LEU HB2 . . 6.000 5.682 5.577 5.767 . 0 0 "[ . 1 . 2]" 1
1244 1 34 LEU HA 1 101 LEU QD . . 3.420 2.793 2.732 2.907 . 0 0 "[ . 1 . 2]" 1
1245 1 34 LEU HA 1 102 VAL H . . 4.260 3.704 3.561 3.795 . 0 0 "[ . 1 . 2]" 1
1246 1 34 LEU HB2 1 34 LEU MD1 . . 3.420 2.225 2.214 2.241 . 0 0 "[ . 1 . 2]" 1
1247 1 34 LEU HB2 1 34 LEU QD . . 2.830 2.184 2.174 2.197 . 0 0 "[ . 1 . 2]" 1
1248 1 34 LEU HB2 1 34 LEU MD2 . . 3.420 3.172 3.166 3.187 . 0 0 "[ . 1 . 2]" 1
1249 1 34 LEU HB2 1 35 GLU H . . 3.980 3.749 3.729 3.773 . 0 0 "[ . 1 . 2]" 1
1250 1 34 LEU HB2 1 35 GLU HA . . 5.760 5.579 5.558 5.600 . 0 0 "[ . 1 . 2]" 1
1251 1 34 LEU HB2 1 36 ASP H . . 3.400 3.358 3.328 3.388 . 0 0 "[ . 1 . 2]" 1
1252 1 34 LEU HB2 1 36 ASP QB . . 5.090 3.754 3.703 3.886 . 0 0 "[ . 1 . 2]" 1
1253 1 34 LEU HB2 1 37 GLY H . . 3.950 3.152 3.103 3.184 . 0 0 "[ . 1 . 2]" 1
1254 1 34 LEU HB2 1 40 PHE QD . . 5.110 3.902 3.851 3.961 . 0 0 "[ . 1 . 2]" 1
1255 1 34 LEU HB3 1 34 LEU MD1 . . 3.400 2.524 2.428 2.542 . 0 0 "[ . 1 . 2]" 1
1256 1 34 LEU HB3 1 34 LEU QD . . 2.600 2.086 2.066 2.090 . 0 0 "[ . 1 . 2]" 1
1257 1 34 LEU HB3 1 34 LEU MD2 . . 3.400 2.224 2.220 2.236 . 0 0 "[ . 1 . 2]" 1
1258 1 34 LEU HB3 1 35 GLU H . . 2.990 2.317 2.292 2.349 . 0 0 "[ . 1 . 2]" 1
1259 1 34 LEU HB3 1 35 GLU HA . . 5.080 4.582 4.561 4.601 . 0 0 "[ . 1 . 2]" 1
1260 1 34 LEU HB3 1 36 ASP H . . 3.270 2.425 2.350 2.470 . 0 0 "[ . 1 . 2]" 1
1261 1 34 LEU HB3 1 36 ASP QB . . 5.130 3.471 3.413 3.602 . 0 0 "[ . 1 . 2]" 1
1262 1 34 LEU HB3 1 37 GLY H . . 3.420 3.429 3.409 3.439 0.019 11 0 "[ . 1 . 2]" 1
1263 1 34 LEU HB3 1 40 PHE QD . . 5.520 4.859 4.807 4.900 . 0 0 "[ . 1 . 2]" 1
1264 1 34 LEU QD 1 35 GLU H . . 3.420 2.668 2.605 2.710 . 0 0 "[ . 1 . 2]" 1
1265 1 34 LEU QD 1 35 GLU QB . . 4.390 3.609 3.554 3.651 . 0 0 "[ . 1 . 2]" 1
1266 1 34 LEU QD 1 36 ASP H . . 3.980 3.675 3.584 3.712 . 0 0 "[ . 1 . 2]" 1
1267 1 34 LEU QD 1 37 GLY H . . 4.350 4.348 4.310 4.361 0.011 7 0 "[ . 1 . 2]" 1
1268 1 34 LEU QD 1 40 PHE HA . . 5.670 4.992 4.799 5.081 . 0 0 "[ . 1 . 2]" 1
1269 1 34 LEU QD 1 40 PHE HB2 . . 5.160 4.605 4.383 4.698 . 0 0 "[ . 1 . 2]" 1
1270 1 34 LEU QD 1 40 PHE HB3 . . 3.720 3.497 3.224 3.588 . 0 0 "[ . 1 . 2]" 1
1271 1 34 LEU QD 1 40 PHE QD . . 3.170 3.141 3.023 3.175 0.005 14 0 "[ . 1 . 2]" 1
1272 1 34 LEU QD 1 40 PHE QE . . 3.550 3.568 3.556 3.578 0.028 7 0 "[ . 1 . 2]" 1
1273 1 34 LEU QD 1 95 ILE HA . . 3.980 3.638 3.541 3.837 . 0 0 "[ . 1 . 2]" 1
1274 1 34 LEU QD 1 96 PRO HD2 . . 3.390 2.693 2.636 2.850 . 0 0 "[ . 1 . 2]" 1
1275 1 34 LEU QD 1 96 PRO HD3 . . 3.500 3.103 3.024 3.361 . 0 0 "[ . 1 . 2]" 1
1276 1 34 LEU QD 1 99 ALA MB . . 3.100 3.088 2.926 3.120 0.020 16 0 "[ . 1 . 2]" 1
1277 1 34 LEU QD 1 100 THR H . . 5.740 5.002 4.694 5.082 . 0 0 "[ . 1 . 2]" 1
1278 1 34 LEU MD1 1 35 GLU H . . 4.370 4.317 4.253 4.352 . 0 0 "[ . 1 . 2]" 1
1279 1 34 LEU MD1 1 36 ASP H . . 4.900 4.247 4.086 4.289 . 0 0 "[ . 1 . 2]" 1
1280 1 34 LEU MD1 1 37 GLY H . . 5.000 4.735 4.673 4.763 . 0 0 "[ . 1 . 2]" 1
1281 1 34 LEU MD1 1 40 PHE HB3 . . 4.730 3.610 3.294 3.719 . 0 0 "[ . 1 . 2]" 1
1282 1 34 LEU MD1 1 40 PHE QD . . 3.690 3.398 3.208 3.454 . 0 0 "[ . 1 . 2]" 1
1283 1 34 LEU MD1 1 96 PRO HD2 . . 4.360 4.366 4.318 4.377 0.017 13 0 "[ . 1 . 2]" 1
1284 1 34 LEU MD1 1 96 PRO HD3 . . 4.700 4.077 4.012 4.203 . 0 0 "[ . 1 . 2]" 1
1285 1 34 LEU MD2 1 35 GLU H . . 4.370 2.694 2.628 2.738 . 0 0 "[ . 1 . 2]" 1
1286 1 34 LEU MD2 1 36 ASP H . . 4.900 4.024 3.965 4.066 . 0 0 "[ . 1 . 2]" 1
1287 1 34 LEU MD2 1 37 GLY H . . 5.000 5.064 5.056 5.070 0.070 11 0 "[ . 1 . 2]" 1
1288 1 34 LEU MD2 1 40 PHE HB3 . . 4.730 4.688 4.579 4.735 0.005 13 0 "[ . 1 . 2]" 1
1289 1 34 LEU MD2 1 40 PHE QD . . 3.690 3.700 3.654 3.709 0.019 3 0 "[ . 1 . 2]" 1
1290 1 34 LEU MD2 1 96 PRO HD2 . . 4.360 2.719 2.658 2.888 . 0 0 "[ . 1 . 2]" 1
1291 1 34 LEU MD2 1 96 PRO HD3 . . 4.700 3.218 3.122 3.535 . 0 0 "[ . 1 . 2]" 1
1292 1 34 LEU HG 1 35 GLU H . . 4.910 4.338 4.307 4.357 . 0 0 "[ . 1 . 2]" 1
1293 1 34 LEU HG 1 40 PHE HA . . 6.000 5.816 5.711 5.850 . 0 0 "[ . 1 . 2]" 1
1294 1 34 LEU HG 1 40 PHE HB2 . . 5.780 5.013 4.890 5.108 . 0 0 "[ . 1 . 2]" 1
1295 1 34 LEU HG 1 40 PHE HB3 . . 4.520 3.612 3.479 3.693 . 0 0 "[ . 1 . 2]" 1
1296 1 34 LEU HG 1 40 PHE QD . . 3.930 2.227 2.170 2.252 . 0 0 "[ . 1 . 2]" 1
1297 1 34 LEU HG 1 40 PHE QE . . 5.540 3.325 3.246 3.464 . 0 0 "[ . 1 . 2]" 1
1298 1 35 GLU H 1 35 GLU HB2 . . 3.670 2.090 2.084 2.095 . 0 0 "[ . 1 . 2]" 1
1299 1 35 GLU H 1 35 GLU QB . . 2.900 2.053 2.049 2.056 . 0 0 "[ . 1 . 2]" 1
1300 1 35 GLU H 1 35 GLU HB3 . . 3.670 3.005 2.987 3.025 . 0 0 "[ . 1 . 2]" 1
1301 1 35 GLU H 1 35 GLU QG . . 3.600 3.686 3.673 3.697 0.097 12 0 "[ . 1 . 2]" 1
1302 1 35 GLU H 1 36 ASP H . . 3.220 2.739 2.712 2.753 . 0 0 "[ . 1 . 2]" 1
1303 1 35 GLU H 1 36 ASP QB . . 5.810 4.636 4.473 4.683 . 0 0 "[ . 1 . 2]" 1
1304 1 35 GLU H 1 37 GLY H . . 4.310 4.062 4.044 4.077 . 0 0 "[ . 1 . 2]" 1
1305 1 35 GLU H 1 100 THR H . . 5.520 5.050 4.916 5.137 . 0 0 "[ . 1 . 2]" 1
1306 1 35 GLU H 1 101 LEU HA . . 4.490 3.902 3.782 4.003 . 0 0 "[ . 1 . 2]" 1
1307 1 35 GLU H 1 102 VAL H . . 5.560 5.139 5.046 5.212 . 0 0 "[ . 1 . 2]" 1
1308 1 35 GLU HA 1 35 GLU QG . . 3.220 2.229 2.226 2.243 . 0 0 "[ . 1 . 2]" 1
1309 1 35 GLU HA 1 36 ASP H . . 3.450 3.467 3.459 3.472 0.022 3 0 "[ . 1 . 2]" 1
1310 1 35 GLU HA 1 37 GLY H . . 4.180 4.107 4.092 4.146 . 0 0 "[ . 1 . 2]" 1
1311 1 35 GLU HA 1 102 VAL QG . . 3.280 2.925 2.786 3.079 . 0 0 "[ . 1 . 2]" 1
1312 1 35 GLU QB 1 36 ASP H . . 3.330 2.888 2.855 2.918 . 0 0 "[ . 1 . 2]" 1
1313 1 35 GLU QB 1 100 THR H . . 4.970 3.632 3.546 3.711 . 0 0 "[ . 1 . 2]" 1
1314 1 35 GLU QB 1 100 THR HB . . 4.280 3.368 2.943 3.425 . 0 0 "[ . 1 . 2]" 1
1315 1 35 GLU QB 1 100 THR MG . . 4.550 4.527 4.134 4.564 0.014 9 0 "[ . 1 . 2]" 1
1316 1 35 GLU HB2 1 100 THR H . . 5.690 3.713 3.624 3.795 . 0 0 "[ . 1 . 2]" 1
1317 1 35 GLU HB3 1 100 THR H . . 5.690 5.139 5.033 5.238 . 0 0 "[ . 1 . 2]" 1
1318 1 35 GLU QG 1 36 ASP H . . 4.310 4.363 4.353 4.373 0.063 20 0 "[ . 1 . 2]" 1
1319 1 35 GLU QG 1 100 THR H . . 4.390 4.042 3.952 4.394 0.004 3 0 "[ . 1 . 2]" 1
1320 1 35 GLU QG 1 100 THR HB . . 3.720 2.298 2.272 2.309 . 0 0 "[ . 1 . 2]" 1
1321 1 35 GLU QG 1 100 THR MG . . 3.520 3.344 2.986 3.418 . 0 0 "[ . 1 . 2]" 1
1322 1 36 ASP H 1 36 ASP HB2 . . 3.520 2.338 2.310 2.444 . 0 0 "[ . 1 . 2]" 1
1323 1 36 ASP H 1 36 ASP QB . . 2.980 2.287 2.283 2.296 . 0 0 "[ . 1 . 2]" 1
1324 1 36 ASP H 1 36 ASP HB3 . . 3.520 3.412 2.785 3.571 0.051 15 0 "[ . 1 . 2]" 1
1325 1 36 ASP H 1 37 GLY H . . 2.920 2.354 2.335 2.361 . 0 0 "[ . 1 . 2]" 1
1326 1 36 ASP QB 1 37 GLY H . . 3.960 3.102 3.078 3.115 . 0 0 "[ . 1 . 2]" 1
1327 1 36 ASP HB2 1 37 GLY H . . 4.520 3.393 3.214 4.005 . 0 0 "[ . 1 . 2]" 1
1328 1 36 ASP HB3 1 37 GLY H . . 4.520 3.814 3.218 3.969 . 0 0 "[ . 1 . 2]" 1
1329 1 37 GLY H 1 37 GLY HA2 . . 2.850 2.422 2.413 2.426 . 0 0 "[ . 1 . 2]" 1
1330 1 37 GLY H 1 102 VAL QG . . 5.920 4.612 4.490 4.770 . 0 0 "[ . 1 . 2]" 1
1331 1 40 PHE H 1 40 PHE HB2 . . 3.880 3.824 3.804 3.837 . 0 0 "[ . 1 . 2]" 1
1332 1 40 PHE H 1 40 PHE HB3 . . 3.850 3.319 3.264 3.374 . 0 0 "[ . 1 . 2]" 1
1333 1 40 PHE H 1 40 PHE QD . . 3.420 3.185 3.105 3.246 . 0 0 "[ . 1 . 2]" 1
1334 1 40 PHE H 1 40 PHE QE . . 4.700 4.405 4.374 4.451 . 0 0 "[ . 1 . 2]" 1
1335 1 40 PHE H 1 41 ASP H . . 2.780 1.770 1.739 1.828 . 0 0 "[ . 1 . 2]" 1
1336 1 40 PHE H 1 41 ASP HB2 . . 5.670 4.452 4.243 4.581 . 0 0 "[ . 1 . 2]" 1
1337 1 40 PHE HA 1 40 PHE QD . . 3.860 3.755 3.752 3.760 . 0 0 "[ . 1 . 2]" 1
1338 1 40 PHE HA 1 94 ILE MG . . 4.090 3.553 3.399 3.660 . 0 0 "[ . 1 . 2]" 1
1339 1 40 PHE HB2 1 41 ASP H . . 4.350 4.207 4.124 4.296 . 0 0 "[ . 1 . 2]" 1
1340 1 40 PHE HB2 1 41 ASP HB3 . . 6.000 5.618 5.219 6.010 0.010 20 0 "[ . 1 . 2]" 1
1341 1 40 PHE HB2 1 94 ILE MG . . 3.670 1.987 1.965 2.017 . 0 0 "[ . 1 . 2]" 1
1342 1 40 PHE HB3 1 41 ASP H . . 4.580 4.407 4.371 4.466 . 0 0 "[ . 1 . 2]" 1
1343 1 40 PHE HB3 1 94 ILE MG . . 3.840 2.897 2.789 3.142 . 0 0 "[ . 1 . 2]" 1
1344 1 40 PHE QD 1 41 ASP HB2 . . 3.260 2.292 2.173 2.531 . 0 0 "[ . 1 . 2]" 1
1345 1 40 PHE QD 1 41 ASP HB3 . . 4.170 3.587 3.142 4.029 . 0 0 "[ . 1 . 2]" 1
1346 1 40 PHE QD 1 42 SER H . . 6.000 6.068 6.040 6.111 0.111 15 0 "[ . 1 . 2]" 1
1347 1 40 PHE QD 1 94 ILE MD . . 5.020 5.038 5.031 5.051 0.031 3 0 "[ . 1 . 2]" 1
1348 1 40 PHE QD 1 94 ILE MG . . 3.660 3.006 2.810 3.153 . 0 0 "[ . 1 . 2]" 1
1349 1 40 PHE QD 1 95 ILE MD . . 4.010 3.060 2.974 3.126 . 0 0 "[ . 1 . 2]" 1
1350 1 40 PHE QD 1 101 LEU QD . . 3.710 3.426 3.311 3.470 . 0 0 "[ . 1 . 2]" 1
1351 1 40 PHE QE 1 41 ASP H . . 4.900 4.691 4.603 4.805 . 0 0 "[ . 1 . 2]" 1
1352 1 40 PHE QE 1 41 ASP HB2 . . 4.040 3.490 2.957 4.048 0.008 3 0 "[ . 1 . 2]" 1
1353 1 40 PHE QE 1 41 ASP HB3 . . 4.430 4.047 3.558 4.441 0.011 17 0 "[ . 1 . 2]" 1
1354 1 40 PHE QE 1 86 TYR QE . . 5.470 4.775 4.578 4.978 . 0 0 "[ . 1 . 2]" 1
1355 1 40 PHE QE 1 95 ILE MD . . 3.790 3.072 2.868 3.310 . 0 0 "[ . 1 . 2]" 1
1356 1 40 PHE QE 1 101 LEU HA . . 4.450 3.475 3.358 3.518 . 0 0 "[ . 1 . 2]" 1
1357 1 40 PHE QE 1 101 LEU HB3 . . 4.070 2.948 2.849 2.994 . 0 0 "[ . 1 . 2]" 1
1358 1 40 PHE QE 1 101 LEU MD1 . . 4.010 3.837 3.769 3.932 . 0 0 "[ . 1 . 2]" 1
1359 1 40 PHE QE 1 101 LEU QD . . 2.910 2.292 2.259 2.332 . 0 0 "[ . 1 . 2]" 1
1360 1 40 PHE QE 1 101 LEU MD2 . . 4.010 2.310 2.275 2.352 . 0 0 "[ . 1 . 2]" 1
1361 1 40 PHE QE 1 101 LEU HG . . 4.600 4.643 4.613 4.660 0.060 15 0 "[ . 1 . 2]" 1
1362 1 40 PHE QE 1 102 VAL H . . 4.340 3.185 2.965 3.308 . 0 0 "[ . 1 . 2]" 1
1363 1 40 PHE QE 1 103 PHE HZ . . 3.990 2.306 2.255 2.404 . 0 0 "[ . 1 . 2]" 1
1364 1 40 PHE HZ 1 86 TYR QE . . 5.210 5.237 5.224 5.260 0.050 13 0 "[ . 1 . 2]" 1
1365 1 40 PHE HZ 1 95 ILE MD . . 4.270 3.663 3.417 3.946 . 0 0 "[ . 1 . 2]" 1
1366 1 40 PHE HZ 1 101 LEU H . . 6.000 6.052 6.042 6.060 0.060 13 0 "[ . 1 . 2]" 1
1367 1 40 PHE HZ 1 101 LEU HA . . 4.800 4.351 4.222 4.452 . 0 0 "[ . 1 . 2]" 1
1368 1 40 PHE HZ 1 101 LEU HB2 . . 4.350 3.773 3.753 3.829 . 0 0 "[ . 1 . 2]" 1
1369 1 40 PHE HZ 1 101 LEU HB3 . . 4.160 2.315 2.285 2.386 . 0 0 "[ . 1 . 2]" 1
1370 1 40 PHE HZ 1 101 LEU MD1 . . 3.580 3.264 3.141 3.544 . 0 0 "[ . 1 . 2]" 1
1371 1 40 PHE HZ 1 101 LEU MD2 . . 3.580 2.363 2.297 2.570 . 0 0 "[ . 1 . 2]" 1
1372 1 40 PHE HZ 1 103 PHE HZ . . 3.740 2.470 2.389 2.735 . 0 0 "[ . 1 . 2]" 1
1373 1 41 ASP H 1 41 ASP HB2 . . 3.650 3.229 2.984 3.383 . 0 0 "[ . 1 . 2]" 1
1374 1 41 ASP H 1 42 SER H . . 4.480 3.707 3.617 3.837 . 0 0 "[ . 1 . 2]" 1
1375 1 41 ASP H 1 42 SER QB . . 5.000 4.359 4.070 4.682 . 0 0 "[ . 1 . 2]" 1
1376 1 41 ASP H 1 94 ILE MG . . 5.490 5.232 5.092 5.318 . 0 0 "[ . 1 . 2]" 1
1377 1 41 ASP HA 1 42 SER H . . 3.030 2.107 2.083 2.124 . 0 0 "[ . 1 . 2]" 1
1378 1 41 ASP HB2 1 42 SER H . . 4.660 4.522 4.476 4.576 . 0 0 "[ . 1 . 2]" 1
1379 1 41 ASP HB2 1 94 ILE MG . . 5.350 4.319 3.818 5.033 . 0 0 "[ . 1 . 2]" 1
1380 1 41 ASP HB3 1 42 SER H . . 4.560 3.928 3.629 4.184 . 0 0 "[ . 1 . 2]" 1
1381 1 42 SER H 1 42 SER HB2 . . 4.110 3.397 2.876 3.683 . 0 0 "[ . 1 . 2]" 1
1382 1 42 SER H 1 42 SER QB . . 3.540 2.783 2.480 3.074 . 0 0 "[ . 1 . 2]" 1
1383 1 42 SER H 1 42 SER HB3 . . 4.110 2.964 2.581 3.315 . 0 0 "[ . 1 . 2]" 1
1384 1 42 SER H 1 43 SER H . . 4.410 4.365 4.276 4.446 0.036 13 0 "[ . 1 . 2]" 1
1385 1 42 SER H 1 45 ASP H . . 5.550 5.050 4.607 5.306 . 0 0 "[ . 1 . 2]" 1
1386 1 42 SER HA 1 43 SER H . . 2.820 2.166 2.123 2.219 . 0 0 "[ . 1 . 2]" 1
1387 1 42 SER HA 1 43 SER HA . . 4.410 4.376 4.334 4.410 0.000 9 0 "[ . 1 . 2]" 1
1388 1 42 SER HA 1 43 SER QB . . 5.060 4.312 4.021 4.474 . 0 0 "[ . 1 . 2]" 1
1389 1 42 SER HA 1 44 ARG H . . 4.300 3.940 3.757 4.178 . 0 0 "[ . 1 . 2]" 1
1390 1 42 SER HA 1 45 ASP H . . 4.650 4.478 4.270 4.711 0.061 17 0 "[ . 1 . 2]" 1
1391 1 42 SER QB 1 43 SER H . . 3.570 3.452 3.321 3.622 0.052 3 0 "[ . 1 . 2]" 1
1392 1 42 SER QB 1 44 ARG H . . 4.330 3.632 3.307 4.072 . 0 0 "[ . 1 . 2]" 1
1393 1 42 SER QB 1 44 ARG QD . . 4.720 4.255 3.453 4.740 0.020 9 0 "[ . 1 . 2]" 1
1394 1 42 SER QB 1 44 ARG HG2 . . 5.080 4.276 3.583 4.826 . 0 0 "[ . 1 . 2]" 1
1395 1 42 SER QB 1 44 ARG HG3 . . 4.720 3.261 2.933 3.623 . 0 0 "[ . 1 . 2]" 1
1396 1 42 SER QB 1 45 ASP H . . 4.030 2.685 2.325 3.178 . 0 0 "[ . 1 . 2]" 1
1397 1 42 SER QB 1 45 ASP QB . . 4.050 2.279 2.160 2.801 . 0 0 "[ . 1 . 2]" 1
1398 1 42 SER HB2 1 43 SER H . . 4.130 3.764 3.506 4.155 0.025 3 0 "[ . 1 . 2]" 1
1399 1 42 SER HB2 1 45 ASP H . . 4.590 3.393 2.338 4.489 . 0 0 "[ . 1 . 2]" 1
1400 1 42 SER HB3 1 43 SER H . . 4.130 4.079 3.653 4.171 0.041 15 0 "[ . 1 . 2]" 1
1401 1 42 SER HB3 1 45 ASP H . . 4.590 3.597 2.562 4.158 . 0 0 "[ . 1 . 2]" 1
1402 1 43 SER H 1 43 SER HB2 . . 3.760 3.290 2.478 3.617 . 0 0 "[ . 1 . 2]" 1
1403 1 43 SER H 1 43 SER QB . . 3.210 2.551 2.276 2.692 . 0 0 "[ . 1 . 2]" 1
1404 1 43 SER H 1 43 SER HB3 . . 3.760 2.700 2.572 2.777 . 0 0 "[ . 1 . 2]" 1
1405 1 43 SER H 1 43 SER HG . . 4.540 3.184 1.777 4.490 . 0 0 "[ . 1 . 2]" 1
1406 1 43 SER H 1 44 ARG H . . 3.090 2.479 2.443 2.502 . 0 0 "[ . 1 . 2]" 1
1407 1 43 SER H 1 44 ARG HB3 . . 5.260 5.063 4.926 5.153 . 0 0 "[ . 1 . 2]" 1
1408 1 43 SER H 1 44 ARG HG2 . . 4.710 4.340 3.916 4.720 0.010 10 0 "[ . 1 . 2]" 1
1409 1 43 SER H 1 44 ARG HG3 . . 4.820 4.042 3.506 4.632 . 0 0 "[ . 1 . 2]" 1
1410 1 43 SER H 1 45 ASP H . . 4.360 4.003 3.959 4.215 . 0 0 "[ . 1 . 2]" 1
1411 1 43 SER H 1 46 ARG HG3 . . 5.940 5.929 5.616 5.960 0.020 13 0 "[ . 1 . 2]" 1
1412 1 43 SER HA 1 46 ARG H . . 4.510 4.009 3.781 4.121 . 0 0 "[ . 1 . 2]" 1
1413 1 43 SER HA 1 46 ARG QB . . 4.580 3.874 2.964 4.063 . 0 0 "[ . 1 . 2]" 1
1414 1 43 SER QB 1 44 ARG H . . 4.020 3.240 2.663 3.629 . 0 0 "[ . 1 . 2]" 1
1415 1 43 SER HB2 1 44 ARG H . . 4.570 3.807 3.689 3.971 . 0 0 "[ . 1 . 2]" 1
1416 1 43 SER HB3 1 44 ARG H . . 4.570 3.668 2.716 4.199 . 0 0 "[ . 1 . 2]" 1
1417 1 43 SER HG 1 44 ARG H . . 4.750 3.065 1.976 4.666 . 0 0 "[ . 1 . 2]" 1
1418 1 44 ARG H 1 44 ARG HB2 . . 3.670 3.608 3.591 3.629 . 0 0 "[ . 1 . 2]" 1
1419 1 44 ARG H 1 44 ARG HB3 . . 3.320 2.799 2.721 2.914 . 0 0 "[ . 1 . 2]" 1
1420 1 44 ARG H 1 44 ARG HG2 . . 3.310 2.638 2.268 3.040 . 0 0 "[ . 1 . 2]" 1
1421 1 44 ARG H 1 44 ARG HG3 . . 3.650 2.174 1.749 2.689 . 0 0 "[ . 1 . 2]" 1
1422 1 44 ARG H 1 45 ASP H . . 3.460 2.558 2.429 2.654 . 0 0 "[ . 1 . 2]" 1
1423 1 44 ARG H 1 45 ASP QB . . 4.640 4.367 4.241 4.689 0.049 17 0 "[ . 1 . 2]" 1
1424 1 44 ARG H 1 46 ARG QB . . 6.000 5.559 4.947 5.750 . 0 0 "[ . 1 . 2]" 1
1425 1 44 ARG H 1 46 ARG HG3 . . 6.000 5.838 5.747 6.021 0.021 17 0 "[ . 1 . 2]" 1
1426 1 44 ARG HA 1 44 ARG QD . . 4.340 4.199 3.951 4.397 0.057 16 0 "[ . 1 . 2]" 1
1427 1 44 ARG HA 1 44 ARG HG3 . . 4.120 3.576 3.533 3.631 . 0 0 "[ . 1 . 2]" 1
1428 1 44 ARG HA 1 45 ASP QB . . 5.810 5.243 5.137 5.518 . 0 0 "[ . 1 . 2]" 1
1429 1 44 ARG HA 1 46 ARG H . . 5.200 3.790 3.688 3.908 . 0 0 "[ . 1 . 2]" 1
1430 1 44 ARG HA 1 47 ASN H . . 4.030 3.191 3.038 3.355 . 0 0 "[ . 1 . 2]" 1
1431 1 44 ARG HA 1 47 ASN HA . . 3.650 3.339 3.066 3.589 . 0 0 "[ . 1 . 2]" 1
1432 1 44 ARG HB2 1 44 ARG HD2 . . 3.940 2.705 2.248 3.568 . 0 0 "[ . 1 . 2]" 1
1433 1 44 ARG HB2 1 44 ARG HD3 . . 3.940 2.777 2.352 3.504 . 0 0 "[ . 1 . 2]" 1
1434 1 44 ARG HB2 1 45 ASP H . . 4.280 3.943 3.617 4.023 . 0 0 "[ . 1 . 2]" 1
1435 1 44 ARG HB2 1 45 ASP QB . . 5.810 5.481 4.939 5.685 . 0 0 "[ . 1 . 2]" 1
1436 1 44 ARG HB2 1 47 ASN H . . 4.990 4.554 4.488 4.836 . 0 0 "[ . 1 . 2]" 1
1437 1 44 ARG HB3 1 44 ARG QD . . 3.640 3.011 2.647 3.447 . 0 0 "[ . 1 . 2]" 1
1438 1 44 ARG HB3 1 45 ASP H . . 4.400 4.272 4.118 4.319 . 0 0 "[ . 1 . 2]" 1
1439 1 44 ARG HB3 1 47 ASN H . . 6.000 5.325 5.201 5.494 . 0 0 "[ . 1 . 2]" 1
1440 1 44 ARG QD 1 45 ASP H . . 4.520 3.830 2.356 4.390 . 0 0 "[ . 1 . 2]" 1
1441 1 44 ARG HG2 1 45 ASP H . . 5.070 3.946 3.541 4.307 . 0 0 "[ . 1 . 2]" 1
1442 1 44 ARG HG3 1 45 ASP H . . 5.510 2.438 2.297 2.635 . 0 0 "[ . 1 . 2]" 1
1443 1 45 ASP H 1 45 ASP QB . . 3.430 2.197 2.112 2.634 . 0 0 "[ . 1 . 2]" 1
1444 1 45 ASP H 1 46 ARG H . . 4.000 2.594 2.487 2.646 . 0 0 "[ . 1 . 2]" 1
1445 1 45 ASP H 1 46 ARG QB . . 5.380 4.703 4.488 4.824 . 0 0 "[ . 1 . 2]" 1
1446 1 45 ASP H 1 46 ARG HG2 . . 5.550 5.407 4.481 5.573 0.023 16 0 "[ . 1 . 2]" 1
1447 1 45 ASP H 1 47 ASN H . . 4.860 3.830 3.755 3.878 . 0 0 "[ . 1 . 2]" 1
1448 1 45 ASP QB 1 46 ARG H . . 4.140 2.954 2.797 3.703 . 0 0 "[ . 1 . 2]" 1
1449 1 45 ASP HB2 1 46 ARG H . . 5.000 3.392 3.110 4.105 . 0 0 "[ . 1 . 2]" 1
1450 1 45 ASP HB2 1 46 ARG HG2 . . 5.190 4.819 4.376 5.219 0.029 18 0 "[ . 1 . 2]" 1
1451 1 45 ASP HB3 1 46 ARG H . . 5.000 3.412 2.906 4.214 . 0 0 "[ . 1 . 2]" 1
1452 1 45 ASP HB3 1 46 ARG HG2 . . 5.190 4.079 3.324 5.157 . 0 0 "[ . 1 . 2]" 1
1453 1 46 ARG H 1 46 ARG QB . . 3.810 2.464 2.347 2.529 . 0 0 "[ . 1 . 2]" 1
1454 1 46 ARG H 1 46 ARG HD2 . . 5.550 4.817 4.484 5.143 . 0 0 "[ . 1 . 2]" 1
1455 1 46 ARG H 1 46 ARG HD3 . . 5.550 4.910 4.542 5.085 . 0 0 "[ . 1 . 2]" 1
1456 1 46 ARG H 1 46 ARG HG2 . . 4.100 3.374 2.787 3.530 . 0 0 "[ . 1 . 2]" 1
1457 1 46 ARG H 1 46 ARG HG3 . . 4.330 2.706 2.531 3.560 . 0 0 "[ . 1 . 2]" 1
1458 1 46 ARG H 1 47 ASN H . . 3.570 2.307 2.167 2.360 . 0 0 "[ . 1 . 2]" 1
1459 1 46 ARG H 1 47 ASN QB . . 5.810 5.111 4.805 5.169 . 0 0 "[ . 1 . 2]" 1
1460 1 46 ARG HA 1 46 ARG HG2 . . 3.370 2.511 2.466 2.627 . 0 0 "[ . 1 . 2]" 1
1461 1 46 ARG HA 1 46 ARG HG3 . . 3.710 3.392 3.292 3.761 0.051 17 0 "[ . 1 . 2]" 1
1462 1 46 ARG QB 1 46 ARG HD2 . . 3.840 2.542 2.242 3.287 . 0 0 "[ . 1 . 2]" 1
1463 1 46 ARG QB 1 46 ARG HD3 . . 3.840 2.643 2.299 3.296 . 0 0 "[ . 1 . 2]" 1
1464 1 46 ARG QB 1 47 ASN H . . 3.750 3.393 3.251 3.457 . 0 0 "[ . 1 . 2]" 1
1465 1 46 ARG QD 1 46 ARG HG2 . . 2.560 2.309 2.169 2.412 . 0 0 "[ . 1 . 2]" 1
1466 1 47 ASN H 1 47 ASN HA . . 2.920 2.258 2.252 2.262 . 0 0 "[ . 1 . 2]" 1
1467 1 47 ASN H 1 47 ASN HB2 . . 4.110 3.491 3.106 3.552 . 0 0 "[ . 1 . 2]" 1
1468 1 47 ASN H 1 47 ASN QB . . 3.530 3.303 2.975 3.353 . 0 0 "[ . 1 . 2]" 1
1469 1 47 ASN H 1 47 ASN HB3 . . 4.110 4.081 3.806 4.118 0.008 17 0 "[ . 1 . 2]" 1
1470 1 47 ASN HA 1 47 ASN HD21 . . 4.700 3.226 2.853 3.795 . 0 0 "[ . 1 . 2]" 1
1471 1 47 ASN HA 1 47 ASN HD22 . . 4.700 3.971 3.754 4.269 . 0 0 "[ . 1 . 2]" 1
1472 1 49 PRO HA 1 50 PHE H . . 2.970 2.301 2.292 2.308 . 0 0 "[ . 1 . 2]" 1
1473 1 49 PRO HA 1 50 PHE HA . . 4.410 4.370 4.364 4.376 . 0 0 "[ . 1 . 2]" 1
1474 1 49 PRO HA 1 50 PHE HB2 . . 5.090 4.158 4.146 4.170 . 0 0 "[ . 1 . 2]" 1
1475 1 49 PRO HA 1 50 PHE HB3 . . 5.020 4.893 4.846 4.927 . 0 0 "[ . 1 . 2]" 1
1476 1 49 PRO HA 1 108 LEU MD1 . . 3.990 3.773 3.715 3.854 . 0 0 "[ . 1 . 2]" 1
1477 1 49 PRO QB 1 50 PHE H . . 3.220 2.742 2.737 2.749 . 0 0 "[ . 1 . 2]" 1
1478 1 49 PRO QB 1 50 PHE HA . . 4.490 4.341 4.320 4.366 . 0 0 "[ . 1 . 2]" 1
1479 1 49 PRO QB 1 50 PHE HB3 . . 5.220 5.031 5.006 5.065 . 0 0 "[ . 1 . 2]" 1
1480 1 49 PRO QB 1 108 LEU MD1 . . 2.900 2.245 2.188 2.337 . 0 0 "[ . 1 . 2]" 1
1481 1 49 PRO HD3 1 108 LEU MD1 . . 5.410 4.553 4.456 4.701 . 0 0 "[ . 1 . 2]" 1
1482 1 49 PRO HG2 1 50 PHE H . . 4.840 4.666 4.648 4.702 . 0 0 "[ . 1 . 2]" 1
1483 1 49 PRO HG3 1 50 PHE H . . 5.540 5.269 5.261 5.283 . 0 0 "[ . 1 . 2]" 1
1484 1 49 PRO HG3 1 108 LEU MD1 . . 3.460 3.299 3.173 3.445 . 0 0 "[ . 1 . 2]" 1
1485 1 50 PHE H 1 50 PHE HB2 . . 3.300 2.599 2.567 2.636 . 0 0 "[ . 1 . 2]" 1
1486 1 50 PHE H 1 50 PHE HB3 . . 3.210 2.731 2.706 2.767 . 0 0 "[ . 1 . 2]" 1
1487 1 50 PHE H 1 50 PHE QD . . 4.560 4.264 4.249 4.275 . 0 0 "[ . 1 . 2]" 1
1488 1 50 PHE H 1 108 LEU MD1 . . 4.790 4.066 4.003 4.124 . 0 0 "[ . 1 . 2]" 1
1489 1 50 PHE HA 1 50 PHE QD . . 3.090 2.857 2.816 2.905 . 0 0 "[ . 1 . 2]" 1
1490 1 50 PHE HA 1 50 PHE QE . . 4.850 4.527 4.494 4.554 . 0 0 "[ . 1 . 2]" 1
1491 1 50 PHE HB2 1 63 TRP HH2 . . 4.770 4.532 4.291 4.747 . 0 0 "[ . 1 . 2]" 1
1492 1 50 PHE HB2 1 63 TRP HZ3 . . 5.510 4.877 4.631 5.094 . 0 0 "[ . 1 . 2]" 1
1493 1 50 PHE HB2 1 105 VAL MG1 . . 6.000 5.864 5.734 5.952 . 0 0 "[ . 1 . 2]" 1
1494 1 50 PHE QD 1 52 PHE HB2 . . 5.250 4.699 4.633 4.755 . 0 0 "[ . 1 . 2]" 1
1495 1 50 PHE QD 1 52 PHE HB3 . . 5.200 3.106 3.018 3.167 . 0 0 "[ . 1 . 2]" 1
1496 1 50 PHE QD 1 52 PHE QD . . 3.490 2.298 2.237 2.334 . 0 0 "[ . 1 . 2]" 1
1497 1 50 PHE QD 1 59 VAL MG1 . . 3.980 3.445 3.323 3.563 . 0 0 "[ . 1 . 2]" 1
1498 1 50 PHE QD 1 63 TRP HH2 . . 4.230 4.120 3.774 4.230 . 0 0 "[ . 1 . 2]" 1
1499 1 50 PHE QD 1 63 TRP HZ3 . . 3.710 2.722 2.484 2.923 . 0 0 "[ . 1 . 2]" 1
1500 1 50 PHE QE 1 52 PHE HB2 . . 4.230 3.658 3.573 3.719 . 0 0 "[ . 1 . 2]" 1
1501 1 50 PHE QE 1 52 PHE HB3 . . 4.120 2.444 2.339 2.513 . 0 0 "[ . 1 . 2]" 1
1502 1 50 PHE QE 1 53 MET H . . 6.000 5.930 5.787 6.012 0.012 7 0 "[ . 1 . 2]" 1
1503 1 50 PHE QE 1 59 VAL HB . . 5.200 4.635 4.572 4.733 . 0 0 "[ . 1 . 2]" 1
1504 1 50 PHE QE 1 59 VAL MG1 . . 3.150 2.202 2.126 2.293 . 0 0 "[ . 1 . 2]" 1
1505 1 50 PHE QE 1 63 TRP HE3 . . 4.460 4.151 4.025 4.241 . 0 0 "[ . 1 . 2]" 1
1506 1 50 PHE QE 1 63 TRP HZ3 . . 3.800 2.876 2.638 2.991 . 0 0 "[ . 1 . 2]" 1
1507 1 50 PHE HZ 1 52 PHE HB3 . . 4.520 4.494 4.320 4.536 0.016 3 0 "[ . 1 . 2]" 1
1508 1 50 PHE HZ 1 59 VAL MG1 . . 3.560 3.569 3.524 3.578 0.018 2 0 "[ . 1 . 2]" 1
1509 1 52 PHE H 1 52 PHE HB3 . . 3.690 3.344 3.328 3.366 . 0 0 "[ . 1 . 2]" 1
1510 1 52 PHE H 1 52 PHE QD . . 3.290 2.770 2.654 2.824 . 0 0 "[ . 1 . 2]" 1
1511 1 52 PHE H 1 52 PHE QE . . 4.580 4.343 4.277 4.387 . 0 0 "[ . 1 . 2]" 1
1512 1 52 PHE H 1 53 MET H . . 4.450 4.424 4.415 4.432 . 0 0 "[ . 1 . 2]" 1
1513 1 52 PHE H 1 59 VAL MG1 . . 5.090 5.047 4.971 5.098 0.008 3 0 "[ . 1 . 2]" 1
1514 1 52 PHE HA 1 53 MET H . . 2.900 2.406 2.366 2.439 . 0 0 "[ . 1 . 2]" 1
1515 1 52 PHE HA 1 59 VAL MG1 . . 4.790 4.307 4.180 4.405 . 0 0 "[ . 1 . 2]" 1
1516 1 52 PHE HA 1 59 VAL MG2 . . 5.780 5.478 5.392 5.573 . 0 0 "[ . 1 . 2]" 1
1517 1 52 PHE HB2 1 53 MET H . . 3.170 2.497 2.405 2.574 . 0 0 "[ . 1 . 2]" 1
1518 1 52 PHE HB2 1 54 LEU HA . . 6.000 5.586 5.394 5.648 . 0 0 "[ . 1 . 2]" 1
1519 1 52 PHE HB2 1 58 GLU HA . . 6.000 5.724 5.496 5.963 . 0 0 "[ . 1 . 2]" 1
1520 1 52 PHE HB2 1 58 GLU QB . . 4.040 2.840 2.696 3.057 . 0 0 "[ . 1 . 2]" 1
1521 1 52 PHE HB2 1 59 VAL H . . 5.160 4.564 4.283 4.766 . 0 0 "[ . 1 . 2]" 1
1522 1 52 PHE HB2 1 59 VAL MG1 . . 3.730 2.429 2.298 2.569 . 0 0 "[ . 1 . 2]" 1
1523 1 52 PHE HB2 1 63 TRP HE3 . . 6.000 5.327 5.172 5.450 . 0 0 "[ . 1 . 2]" 1
1524 1 52 PHE HB2 1 63 TRP HZ3 . . 6.000 5.603 5.256 5.758 . 0 0 "[ . 1 . 2]" 1
1525 1 52 PHE HB3 1 53 MET H . . 4.290 3.845 3.778 3.889 . 0 0 "[ . 1 . 2]" 1
1526 1 52 PHE HB3 1 58 GLU HB2 . . 4.900 4.373 4.225 4.657 . 0 0 "[ . 1 . 2]" 1
1527 1 52 PHE HB3 1 58 GLU QB . . 4.210 3.984 3.838 4.214 0.004 13 0 "[ . 1 . 2]" 1
1528 1 52 PHE HB3 1 58 GLU HB3 . . 4.900 4.593 4.318 4.877 . 0 0 "[ . 1 . 2]" 1
1529 1 52 PHE HB3 1 59 VAL H . . 6.000 5.782 5.519 6.002 0.002 2 0 "[ . 1 . 2]" 1
1530 1 52 PHE HB3 1 59 VAL MG1 . . 3.600 2.633 2.536 2.705 . 0 0 "[ . 1 . 2]" 1
1531 1 52 PHE HB3 1 63 TRP HZ3 . . 4.880 4.540 4.190 4.699 . 0 0 "[ . 1 . 2]" 1
1532 1 52 PHE QD 1 53 MET H . . 4.040 3.333 3.254 3.405 . 0 0 "[ . 1 . 2]" 1
1533 1 52 PHE QD 1 53 MET HA . . 5.480 4.177 4.131 4.269 . 0 0 "[ . 1 . 2]" 1
1534 1 52 PHE QD 1 54 LEU H . . 4.420 4.370 4.252 4.400 . 0 0 "[ . 1 . 2]" 1
1535 1 52 PHE QD 1 54 LEU HA . . 3.760 3.585 3.470 3.627 . 0 0 "[ . 1 . 2]" 1
1536 1 52 PHE QD 1 54 LEU QD . . 3.560 2.972 2.875 3.534 . 0 0 "[ . 1 . 2]" 1
1537 1 52 PHE QD 1 54 LEU HG . . 6.000 5.561 3.158 5.899 . 0 0 "[ . 1 . 2]" 1
1538 1 52 PHE QD 1 55 GLY H . . 5.650 5.353 5.296 5.414 . 0 0 "[ . 1 . 2]" 1
1539 1 52 PHE QD 1 58 GLU QB . . 4.080 3.807 3.644 3.953 . 0 0 "[ . 1 . 2]" 1
1540 1 52 PHE QD 1 59 VAL MG1 . . 3.490 2.757 2.595 2.826 . 0 0 "[ . 1 . 2]" 1
1541 1 52 PHE QD 1 59 VAL MG2 . . 3.650 2.407 2.339 2.447 . 0 0 "[ . 1 . 2]" 1
1542 1 52 PHE QD 1 63 TRP HE3 . . 4.350 4.236 4.102 4.299 . 0 0 "[ . 1 . 2]" 1
1543 1 52 PHE QD 1 63 TRP HZ3 . . 4.970 4.062 3.755 4.179 . 0 0 "[ . 1 . 2]" 1
1544 1 52 PHE QE 1 54 LEU H . . 4.850 4.884 4.804 4.906 0.056 7 0 "[ . 1 . 2]" 1
1545 1 52 PHE QE 1 54 LEU HA . . 3.850 3.651 3.632 3.691 . 0 0 "[ . 1 . 2]" 1
1546 1 52 PHE QE 1 54 LEU HB2 . . 4.970 4.978 4.893 5.000 0.030 16 0 "[ . 1 . 2]" 1
1547 1 52 PHE QE 1 54 LEU HB3 . . 5.590 5.283 4.695 5.415 . 0 0 "[ . 1 . 2]" 1
1548 1 52 PHE QE 1 54 LEU MD1 . . 3.600 2.352 2.233 3.261 . 0 0 "[ . 1 . 2]" 1
1549 1 52 PHE QE 1 54 LEU QD . . 2.840 1.972 1.943 2.129 . 0 0 "[ . 1 . 2]" 1
1550 1 52 PHE QE 1 54 LEU MD2 . . 3.600 2.146 2.130 2.174 . 0 0 "[ . 1 . 2]" 1
1551 1 52 PHE QE 1 55 GLY H . . 5.700 5.347 5.319 5.377 . 0 0 "[ . 1 . 2]" 1
1552 1 52 PHE QE 1 59 VAL MG2 . . 3.480 2.494 2.362 2.565 . 0 0 "[ . 1 . 2]" 1
1553 1 52 PHE QE 1 63 TRP QB . . 3.850 3.875 3.799 3.893 0.043 12 0 "[ . 1 . 2]" 1
1554 1 52 PHE QE 1 63 TRP HE3 . . 4.250 3.972 3.800 4.057 . 0 0 "[ . 1 . 2]" 1
1555 1 52 PHE QE 1 63 TRP HZ3 . . 5.220 4.481 4.181 4.637 . 0 0 "[ . 1 . 2]" 1
1556 1 52 PHE QE 1 64 GLU HA . . 3.750 3.364 3.282 3.429 . 0 0 "[ . 1 . 2]" 1
1557 1 52 PHE QE 1 64 GLU HB2 . . 5.850 5.739 5.680 5.798 . 0 0 "[ . 1 . 2]" 1
1558 1 52 PHE QE 1 64 GLU HG2 . . 3.760 3.213 3.143 3.262 . 0 0 "[ . 1 . 2]" 1
1559 1 52 PHE QE 1 64 GLU HG3 . . 5.140 4.700 4.672 4.731 . 0 0 "[ . 1 . 2]" 1
1560 1 52 PHE QE 1 67 VAL HB . . 4.450 4.264 4.215 4.366 . 0 0 "[ . 1 . 2]" 1
1561 1 52 PHE QE 1 67 VAL QG . . 3.500 2.600 2.519 2.743 . 0 0 "[ . 1 . 2]" 1
1562 1 52 PHE QE 1 105 VAL MG2 . . 5.420 5.093 4.933 5.186 . 0 0 "[ . 1 . 2]" 1
1563 1 52 PHE HZ 1 54 LEU HA . . 6.000 6.007 5.988 6.034 0.034 11 0 "[ . 1 . 2]" 1
1564 1 52 PHE HZ 1 54 LEU QD . . 4.260 3.002 2.955 3.059 . 0 0 "[ . 1 . 2]" 1
1565 1 52 PHE HZ 1 54 LEU HG . . 5.810 5.505 4.020 5.768 . 0 0 "[ . 1 . 2]" 1
1566 1 52 PHE HZ 1 59 VAL MG1 . . 5.000 4.362 4.215 4.460 . 0 0 "[ . 1 . 2]" 1
1567 1 52 PHE HZ 1 59 VAL MG2 . . 4.150 3.764 3.672 3.835 . 0 0 "[ . 1 . 2]" 1
1568 1 52 PHE HZ 1 63 TRP HA . . 6.000 5.571 5.483 5.701 . 0 0 "[ . 1 . 2]" 1
1569 1 52 PHE HZ 1 63 TRP QB . . 4.570 3.867 3.809 3.937 . 0 0 "[ . 1 . 2]" 1
1570 1 52 PHE HZ 1 63 TRP HE3 . . 5.040 4.340 4.087 4.486 . 0 0 "[ . 1 . 2]" 1
1571 1 52 PHE HZ 1 64 GLU HA . . 4.600 4.439 4.377 4.512 . 0 0 "[ . 1 . 2]" 1
1572 1 52 PHE HZ 1 67 VAL H . . 5.410 5.082 5.013 5.200 . 0 0 "[ . 1 . 2]" 1
1573 1 52 PHE HZ 1 67 VAL HA . . 5.430 5.304 5.235 5.444 0.014 11 0 "[ . 1 . 2]" 1
1574 1 52 PHE HZ 1 67 VAL HB . . 3.500 3.132 3.072 3.257 . 0 0 "[ . 1 . 2]" 1
1575 1 52 PHE HZ 1 67 VAL MG1 . . 3.050 2.136 2.066 2.191 . 0 0 "[ . 1 . 2]" 1
1576 1 52 PHE HZ 1 67 VAL MG2 . . 3.050 2.302 2.269 2.419 . 0 0 "[ . 1 . 2]" 1
1577 1 53 MET H 1 53 MET HB2 . . 3.570 2.342 2.269 2.668 . 0 0 "[ . 1 . 2]" 1
1578 1 53 MET H 1 53 MET QB . . 2.740 2.290 2.237 2.434 . 0 0 "[ . 1 . 2]" 1
1579 1 53 MET H 1 53 MET HB3 . . 3.570 3.390 2.796 3.553 . 0 0 "[ . 1 . 2]" 1
1580 1 53 MET H 1 53 MET QG . . 4.560 3.713 3.509 4.071 . 0 0 "[ . 1 . 2]" 1
1581 1 53 MET H 1 54 LEU H . . 4.670 4.445 4.335 4.465 . 0 0 "[ . 1 . 2]" 1
1582 1 53 MET H 1 54 LEU HA . . 5.400 5.114 4.934 5.162 . 0 0 "[ . 1 . 2]" 1
1583 1 53 MET H 1 54 LEU MD1 . . 6.000 5.985 5.930 6.039 0.039 11 0 "[ . 1 . 2]" 1
1584 1 53 MET H 1 54 LEU MD2 . . 6.000 5.060 4.893 6.044 0.044 13 0 "[ . 1 . 2]" 1
1585 1 53 MET H 1 58 GLU QB . . 4.690 3.077 2.839 3.335 . 0 0 "[ . 1 . 2]" 1
1586 1 53 MET H 1 58 GLU QG . . 3.940 3.740 3.275 3.946 0.006 11 0 "[ . 1 . 2]" 1
1587 1 53 MET H 1 59 VAL MG1 . . 4.700 4.401 4.218 4.549 . 0 0 "[ . 1 . 2]" 1
1588 1 53 MET H 1 59 VAL MG2 . . 5.700 4.730 4.623 4.832 . 0 0 "[ . 1 . 2]" 1
1589 1 53 MET HA 1 53 MET QG . . 3.480 2.268 2.234 2.316 . 0 0 "[ . 1 . 2]" 1
1590 1 53 MET HA 1 54 LEU H . . 2.870 2.159 2.132 2.169 . 0 0 "[ . 1 . 2]" 1
1591 1 53 MET HA 1 54 LEU HA . . 4.820 4.377 4.361 4.389 . 0 0 "[ . 1 . 2]" 1
1592 1 53 MET HA 1 54 LEU HB2 . . 4.510 4.227 4.172 4.363 . 0 0 "[ . 1 . 2]" 1
1593 1 53 MET QB 1 53 MET ME . . 3.500 3.171 2.262 3.572 0.072 13 0 "[ . 1 . 2]" 1
1594 1 53 MET QB 1 54 LEU H . . 4.210 3.255 3.093 3.732 . 0 0 "[ . 1 . 2]" 1
1595 1 53 MET QB 1 58 GLU QG . . 4.350 3.569 3.201 3.799 . 0 0 "[ . 1 . 2]" 1
1596 1 53 MET QG 1 54 LEU H . . 3.860 3.394 2.816 3.596 . 0 0 "[ . 1 . 2]" 1
1597 1 54 LEU H 1 54 LEU HB2 . . 3.050 2.135 2.094 2.265 . 0 0 "[ . 1 . 2]" 1
1598 1 54 LEU H 1 54 LEU HB3 . . 3.630 3.422 3.373 3.539 . 0 0 "[ . 1 . 2]" 1
1599 1 54 LEU H 1 54 LEU MD1 . . 4.050 3.918 3.079 4.020 . 0 0 "[ . 1 . 2]" 1
1600 1 54 LEU H 1 54 LEU QD . . 3.390 2.708 2.649 3.025 . 0 0 "[ . 1 . 2]" 1
1601 1 54 LEU H 1 54 LEU MD2 . . 4.050 2.854 2.688 4.104 0.054 13 0 "[ . 1 . 2]" 1
1602 1 54 LEU H 1 54 LEU HG . . 4.350 4.146 2.826 4.345 . 0 0 "[ . 1 . 2]" 1
1603 1 54 LEU H 1 55 GLY H . . 4.850 4.585 4.556 4.597 . 0 0 "[ . 1 . 2]" 1
1604 1 54 LEU HA 1 54 LEU MD1 . . 3.750 2.297 2.094 3.786 0.036 11 0 "[ . 1 . 2]" 1
1605 1 54 LEU HA 1 54 LEU QD . . 2.990 2.088 2.026 2.437 . 0 0 "[ . 1 . 2]" 1
1606 1 54 LEU HA 1 54 LEU MD2 . . 3.750 2.640 2.447 2.699 . 0 0 "[ . 1 . 2]" 1
1607 1 54 LEU HA 1 54 LEU HG . . 3.630 3.550 2.500 3.671 0.041 17 0 "[ . 1 . 2]" 1
1608 1 54 LEU HA 1 55 GLY H . . 2.890 2.180 2.154 2.202 . 0 0 "[ . 1 . 2]" 1
1609 1 54 LEU HA 1 57 GLN H . . 4.210 4.298 4.261 4.306 0.096 18 0 "[ . 1 . 2]" 1
1610 1 54 LEU HA 1 59 VAL MG2 . . 5.010 3.924 3.667 4.000 . 0 0 "[ . 1 . 2]" 1
1611 1 54 LEU HA 1 64 GLU HG2 . . 4.760 3.505 3.465 3.548 . 0 0 "[ . 1 . 2]" 1
1612 1 54 LEU HB2 1 54 LEU MD1 . . 3.250 3.101 2.158 3.209 . 0 0 "[ . 1 . 2]" 1
1613 1 54 LEU HB2 1 54 LEU QD . . 2.740 2.235 2.120 2.266 . 0 0 "[ . 1 . 2]" 1
1614 1 54 LEU HB2 1 54 LEU MD2 . . 3.250 2.377 2.254 3.113 . 0 0 "[ . 1 . 2]" 1
1615 1 54 LEU HB2 1 55 GLY H . . 4.340 4.248 4.153 4.273 . 0 0 "[ . 1 . 2]" 1
1616 1 54 LEU HB2 1 55 GLY QA . . 5.280 4.832 4.630 4.881 . 0 0 "[ . 1 . 2]" 1
1617 1 54 LEU HB3 1 54 LEU MD1 . . 3.350 2.447 2.397 2.679 . 0 0 "[ . 1 . 2]" 1
1618 1 54 LEU HB3 1 54 LEU MD2 . . 3.350 3.091 2.179 3.198 . 0 0 "[ . 1 . 2]" 1
1619 1 54 LEU HB3 1 55 GLY H . . 4.230 3.118 3.039 3.154 . 0 0 "[ . 1 . 2]" 1
1620 1 54 LEU HB3 1 55 GLY QA . . 5.130 3.739 3.705 3.874 . 0 0 "[ . 1 . 2]" 1
1621 1 54 LEU QD 1 55 GLY H . . 3.490 2.560 2.321 3.239 . 0 0 "[ . 1 . 2]" 1
1622 1 54 LEU QD 1 55 GLY QA . . 5.070 3.868 3.728 4.350 . 0 0 "[ . 1 . 2]" 1
1623 1 54 LEU QD 1 57 GLN H . . 5.580 4.833 4.676 5.346 . 0 0 "[ . 1 . 2]" 1
1624 1 54 LEU QD 1 59 VAL MG2 . . 4.080 3.100 3.072 3.126 . 0 0 "[ . 1 . 2]" 1
1625 1 54 LEU QD 1 64 GLU H . . 4.340 4.046 3.983 4.070 . 0 0 "[ . 1 . 2]" 1
1626 1 54 LEU QD 1 64 GLU HA . . 3.140 1.997 1.963 2.018 . 0 0 "[ . 1 . 2]" 1
1627 1 54 LEU QD 1 64 GLU HB2 . . 3.480 3.486 3.470 3.555 0.075 13 0 "[ . 1 . 2]" 1
1628 1 54 LEU QD 1 64 GLU HB3 . . 3.130 2.198 2.173 2.308 . 0 0 "[ . 1 . 2]" 1
1629 1 54 LEU QD 1 64 GLU HG2 . . 3.320 2.205 2.128 2.222 . 0 0 "[ . 1 . 2]" 1
1630 1 54 LEU QD 1 64 GLU HG3 . . 3.670 3.565 3.560 3.579 . 0 0 "[ . 1 . 2]" 1
1631 1 54 LEU QD 1 65 GLU H . . 5.170 4.497 4.465 4.618 . 0 0 "[ . 1 . 2]" 1
1632 1 54 LEU QD 1 65 GLU HA . . 5.790 4.687 4.625 4.923 . 0 0 "[ . 1 . 2]" 1
1633 1 54 LEU QD 1 68 ALA HA . . 4.450 4.286 4.017 4.341 . 0 0 "[ . 1 . 2]" 1
1634 1 54 LEU MD1 1 55 GLY H . . 4.980 2.750 2.329 5.010 0.030 13 0 "[ . 1 . 2]" 1
1635 1 54 LEU MD1 1 59 VAL MG2 . . 4.730 3.414 3.230 4.778 0.048 13 0 "[ . 1 . 2]" 1
1636 1 54 LEU MD1 1 64 GLU HA . . 4.320 2.216 1.995 4.074 . 0 0 "[ . 1 . 2]" 1
1637 1 54 LEU MD1 1 64 GLU HG2 . . 4.840 2.489 2.214 4.879 0.039 11 0 "[ . 1 . 2]" 1
1638 1 54 LEU MD1 1 68 ALA MB . . 4.100 3.312 3.165 3.994 . 0 0 "[ . 1 . 2]" 1
1639 1 54 LEU MD2 1 55 GLY H . . 4.980 4.294 3.257 4.424 . 0 0 "[ . 1 . 2]" 1
1640 1 54 LEU MD2 1 59 VAL MG2 . . 4.730 3.794 3.135 3.886 . 0 0 "[ . 1 . 2]" 1
1641 1 54 LEU MD2 1 64 GLU HA . . 4.320 3.446 1.967 3.649 . 0 0 "[ . 1 . 2]" 1
1642 1 54 LEU MD2 1 64 GLU HG2 . . 4.840 3.825 2.131 4.029 . 0 0 "[ . 1 . 2]" 1
1643 1 54 LEU MD2 1 68 ALA MB . . 4.100 4.079 3.395 4.154 0.054 7 0 "[ . 1 . 2]" 1
1644 1 54 LEU HG 1 55 GLY H . . 4.690 4.665 4.453 4.706 0.016 2 0 "[ . 1 . 2]" 1
1645 1 54 LEU HG 1 64 GLU HA . . 4.610 4.340 4.303 4.378 . 0 0 "[ . 1 . 2]" 1
1646 1 54 LEU HG 1 64 GLU HG2 . . 5.070 5.041 4.120 5.154 0.084 3 0 "[ . 1 . 2]" 1
1647 1 55 GLY H 1 57 GLN H . . 3.940 3.289 3.153 3.351 . 0 0 "[ . 1 . 2]" 1
1648 1 55 GLY H 1 57 GLN HA . . 5.300 4.719 4.626 4.786 . 0 0 "[ . 1 . 2]" 1
1649 1 55 GLY H 1 58 GLU H . . 5.350 5.165 4.890 5.289 . 0 0 "[ . 1 . 2]" 1
1650 1 55 GLY H 1 59 VAL MG2 . . 5.370 4.606 4.425 4.710 . 0 0 "[ . 1 . 2]" 1
1651 1 55 GLY H 1 64 GLU HB3 . . 4.930 3.753 3.703 3.879 . 0 0 "[ . 1 . 2]" 1
1652 1 55 GLY H 1 64 GLU HG2 . . 5.210 3.779 3.745 3.891 . 0 0 "[ . 1 . 2]" 1
1653 1 55 GLY H 1 64 GLU HG3 . . 5.930 4.852 4.831 4.901 . 0 0 "[ . 1 . 2]" 1
1654 1 55 GLY QA 1 57 GLN H . . 4.520 3.544 3.520 3.592 . 0 0 "[ . 1 . 2]" 1
1655 1 55 GLY HA2 1 57 GLN H . . 5.150 3.709 3.683 3.759 . 0 0 "[ . 1 . 2]" 1
1656 1 55 GLY HA2 1 64 GLU HB3 . . 6.000 4.979 4.923 5.070 . 0 0 "[ . 1 . 2]" 1
1657 1 55 GLY HA3 1 57 GLN H . . 5.150 4.500 4.468 4.560 . 0 0 "[ . 1 . 2]" 1
1658 1 55 GLY HA3 1 64 GLU HB3 . . 6.000 6.079 6.066 6.089 0.089 17 0 "[ . 1 . 2]" 1
1659 1 57 GLN H 1 57 GLN HA . . 2.710 2.265 2.262 2.268 . 0 0 "[ . 1 . 2]" 1
1660 1 57 GLN H 1 57 GLN QB . . 3.440 3.409 3.402 3.418 . 0 0 "[ . 1 . 2]" 1
1661 1 57 GLN H 1 57 GLN HG2 . . 4.130 3.435 3.407 3.489 . 0 0 "[ . 1 . 2]" 1
1662 1 57 GLN H 1 57 GLN HG3 . . 4.130 3.256 3.227 3.278 . 0 0 "[ . 1 . 2]" 1
1663 1 57 GLN H 1 58 GLU H . . 3.390 2.575 2.565 2.593 . 0 0 "[ . 1 . 2]" 1
1664 1 57 GLN H 1 59 VAL H . . 4.540 4.096 4.019 4.207 . 0 0 "[ . 1 . 2]" 1
1665 1 57 GLN H 1 59 VAL MG2 . . 5.190 4.361 4.296 4.490 . 0 0 "[ . 1 . 2]" 1
1666 1 57 GLN H 1 64 GLU HG3 . . 5.700 5.358 5.211 5.629 . 0 0 "[ . 1 . 2]" 1
1667 1 57 GLN HA 1 57 GLN HG2 . . 3.570 2.429 2.423 2.438 . 0 0 "[ . 1 . 2]" 1
1668 1 57 GLN HA 1 57 GLN QG . . 2.940 2.363 2.359 2.369 . 0 0 "[ . 1 . 2]" 1
1669 1 57 GLN HA 1 57 GLN HG3 . . 3.570 3.229 3.191 3.251 . 0 0 "[ . 1 . 2]" 1
1670 1 57 GLN HA 1 58 GLU H . . 3.400 2.923 2.883 2.949 . 0 0 "[ . 1 . 2]" 1
1671 1 57 GLN HA 1 58 GLU HA . . 4.750 4.703 4.679 4.721 . 0 0 "[ . 1 . 2]" 1
1672 1 57 GLN HA 1 59 VAL H . . 3.890 3.267 3.065 3.546 . 0 0 "[ . 1 . 2]" 1
1673 1 57 GLN HA 1 59 VAL MG2 . . 4.680 4.023 3.952 4.221 . 0 0 "[ . 1 . 2]" 1
1674 1 57 GLN QB 1 57 GLN HE22 . . 4.300 3.632 3.630 3.634 . 0 0 "[ . 1 . 2]" 1
1675 1 57 GLN QB 1 58 GLU H . . 3.970 3.824 3.811 3.846 . 0 0 "[ . 1 . 2]" 1
1676 1 57 GLN QB 1 59 VAL H . . 4.890 4.607 4.387 4.902 0.012 13 0 "[ . 1 . 2]" 1
1677 1 58 GLU H 1 58 GLU QG . . 3.210 2.488 2.424 2.575 . 0 0 "[ . 1 . 2]" 1
1678 1 58 GLU H 1 59 VAL H . . 3.010 2.420 2.374 2.442 . 0 0 "[ . 1 . 2]" 1
1679 1 58 GLU H 1 59 VAL MG1 . . 4.880 4.328 4.228 4.496 . 0 0 "[ . 1 . 2]" 1
1680 1 58 GLU H 1 59 VAL MG2 . . 3.890 3.520 3.468 3.600 . 0 0 "[ . 1 . 2]" 1
1681 1 58 GLU HA 1 58 GLU QG . . 3.060 2.496 2.366 2.789 . 0 0 "[ . 1 . 2]" 1
1682 1 58 GLU HA 1 59 VAL MG1 . . 4.810 4.518 4.368 4.737 . 0 0 "[ . 1 . 2]" 1
1683 1 58 GLU QB 1 59 VAL H . . 3.460 2.963 2.699 3.170 . 0 0 "[ . 1 . 2]" 1
1684 1 58 GLU QB 1 59 VAL MG1 . . 3.510 2.886 2.822 2.975 . 0 0 "[ . 1 . 2]" 1
1685 1 58 GLU HB2 1 59 VAL MG1 . . 4.220 3.120 3.044 3.206 . 0 0 "[ . 1 . 2]" 1
1686 1 58 GLU HB3 1 59 VAL MG1 . . 4.220 3.403 3.286 3.567 . 0 0 "[ . 1 . 2]" 1
1687 1 58 GLU QG 1 59 VAL H . . 4.420 4.248 4.125 4.356 . 0 0 "[ . 1 . 2]" 1
1688 1 58 GLU QG 1 59 VAL MG1 . . 4.640 4.696 4.655 4.718 0.078 20 0 "[ . 1 . 2]" 1
1689 1 59 VAL H 1 59 VAL MG1 . . 3.780 2.953 2.798 3.067 . 0 0 "[ . 1 . 2]" 1
1690 1 59 VAL H 1 59 VAL MG2 . . 2.990 2.078 1.923 2.201 . 0 0 "[ . 1 . 2]" 1
1691 1 59 VAL H 1 60 ILE H . . 4.680 4.427 4.407 4.462 . 0 0 "[ . 1 . 2]" 1
1692 1 59 VAL H 1 64 GLU HG2 . . 4.910 4.453 4.365 4.515 . 0 0 "[ . 1 . 2]" 1
1693 1 59 VAL HA 1 59 VAL MG1 . . 2.990 2.334 2.328 2.354 . 0 0 "[ . 1 . 2]" 1
1694 1 59 VAL HA 1 60 ILE H . . 3.140 2.671 2.633 2.706 . 0 0 "[ . 1 . 2]" 1
1695 1 59 VAL HA 1 60 ILE HA . . 4.400 4.342 4.333 4.356 . 0 0 "[ . 1 . 2]" 1
1696 1 59 VAL HA 1 60 ILE HG12 . . 4.320 4.353 4.325 4.365 0.045 10 0 "[ . 1 . 2]" 1
1697 1 59 VAL HA 1 60 ILE HG13 . . 5.480 5.155 5.111 5.238 . 0 0 "[ . 1 . 2]" 1
1698 1 59 VAL HA 1 60 ILE MG . . 4.100 3.974 3.930 4.066 . 0 0 "[ . 1 . 2]" 1
1699 1 59 VAL HA 1 63 TRP HE3 . . 4.410 4.413 4.383 4.436 0.026 11 0 "[ . 1 . 2]" 1
1700 1 59 VAL HB 1 60 ILE H . . 3.180 2.000 1.932 2.056 . 0 0 "[ . 1 . 2]" 1
1701 1 59 VAL HB 1 60 ILE HA . . 4.890 4.609 4.560 4.641 . 0 0 "[ . 1 . 2]" 1
1702 1 59 VAL HB 1 60 ILE HG12 . . 4.220 3.525 3.452 3.564 . 0 0 "[ . 1 . 2]" 1
1703 1 59 VAL HB 1 63 TRP H . . 4.970 4.883 4.794 4.938 . 0 0 "[ . 1 . 2]" 1
1704 1 59 VAL HB 1 63 TRP QB . . 3.930 2.653 2.578 2.712 . 0 0 "[ . 1 . 2]" 1
1705 1 59 VAL HB 1 63 TRP HE3 . . 3.710 2.280 2.247 2.322 . 0 0 "[ . 1 . 2]" 1
1706 1 59 VAL HB 1 64 GLU H . . 5.000 4.797 4.746 4.821 . 0 0 "[ . 1 . 2]" 1
1707 1 59 VAL HB 1 64 GLU HG2 . . 4.700 4.711 4.580 4.727 0.027 9 0 "[ . 1 . 2]" 1
1708 1 59 VAL MG1 1 60 ILE H . . 3.900 3.486 3.436 3.522 . 0 0 "[ . 1 . 2]" 1
1709 1 59 VAL MG1 1 63 TRP HE3 . . 3.290 2.190 2.134 2.224 . 0 0 "[ . 1 . 2]" 1
1710 1 59 VAL MG1 1 63 TRP HH2 . . 4.710 4.562 4.439 4.666 . 0 0 "[ . 1 . 2]" 1
1711 1 59 VAL MG1 1 63 TRP HZ3 . . 3.720 2.659 2.592 2.735 . 0 0 "[ . 1 . 2]" 1
1712 1 59 VAL MG2 1 60 ILE H . . 4.070 3.143 3.084 3.187 . 0 0 "[ . 1 . 2]" 1
1713 1 59 VAL MG2 1 60 ILE HA . . 4.650 4.407 4.339 4.443 . 0 0 "[ . 1 . 2]" 1
1714 1 59 VAL MG2 1 60 ILE HG12 . . 4.670 4.653 4.601 4.682 0.012 3 0 "[ . 1 . 2]" 1
1715 1 59 VAL MG2 1 60 ILE HG13 . . 4.670 4.222 4.171 4.274 . 0 0 "[ . 1 . 2]" 1
1716 1 59 VAL MG2 1 61 ARG HA . . 4.940 4.762 4.724 4.787 . 0 0 "[ . 1 . 2]" 1
1717 1 59 VAL MG2 1 63 TRP H . . 4.370 4.289 4.265 4.343 . 0 0 "[ . 1 . 2]" 1
1718 1 59 VAL MG2 1 63 TRP HA . . 5.000 4.875 4.815 4.938 . 0 0 "[ . 1 . 2]" 1
1719 1 59 VAL MG2 1 63 TRP QB . . 3.300 2.542 2.479 2.584 . 0 0 "[ . 1 . 2]" 1
1720 1 59 VAL MG2 1 63 TRP HE3 . . 3.870 2.865 2.735 2.934 . 0 0 "[ . 1 . 2]" 1
1721 1 59 VAL MG2 1 64 GLU H . . 3.550 3.219 3.199 3.231 . 0 0 "[ . 1 . 2]" 1
1722 1 59 VAL MG2 1 64 GLU HA . . 4.090 3.604 3.581 3.657 . 0 0 "[ . 1 . 2]" 1
1723 1 59 VAL MG2 1 64 GLU HB2 . . 4.240 4.172 4.154 4.222 . 0 0 "[ . 1 . 2]" 1
1724 1 59 VAL MG2 1 64 GLU HB3 . . 4.540 4.265 4.196 4.284 . 0 0 "[ . 1 . 2]" 1
1725 1 59 VAL MG2 1 64 GLU HG2 . . 3.540 2.223 2.132 2.241 . 0 0 "[ . 1 . 2]" 1
1726 1 59 VAL MG2 1 64 GLU HG3 . . 3.720 2.198 2.175 2.259 . 0 0 "[ . 1 . 2]" 1
1727 1 59 VAL MG2 1 65 GLU H . . 5.360 5.378 5.363 5.384 0.024 2 0 "[ . 1 . 2]" 1
1728 1 60 ILE H 1 60 ILE HB . . 4.120 3.626 3.616 3.635 . 0 0 "[ . 1 . 2]" 1
1729 1 60 ILE H 1 60 ILE MD . . 3.710 3.690 3.659 3.703 . 0 0 "[ . 1 . 2]" 1
1730 1 60 ILE H 1 60 ILE HG12 . . 3.210 2.075 2.047 2.096 . 0 0 "[ . 1 . 2]" 1
1731 1 60 ILE H 1 60 ILE HG13 . . 3.580 2.502 2.445 2.547 . 0 0 "[ . 1 . 2]" 1
1732 1 60 ILE H 1 60 ILE MG . . 3.320 2.741 2.700 2.810 . 0 0 "[ . 1 . 2]" 1
1733 1 60 ILE H 1 61 ARG H . . 4.790 4.629 4.623 4.634 . 0 0 "[ . 1 . 2]" 1
1734 1 60 ILE H 1 63 TRP QB . . 4.100 2.805 2.703 2.892 . 0 0 "[ . 1 . 2]" 1
1735 1 60 ILE H 1 63 TRP HE3 . . 4.380 3.826 3.742 3.899 . 0 0 "[ . 1 . 2]" 1
1736 1 60 ILE HA 1 60 ILE MD . . 4.280 4.210 4.208 4.213 . 0 0 "[ . 1 . 2]" 1
1737 1 60 ILE HA 1 60 ILE HG13 . . 4.050 3.711 3.700 3.719 . 0 0 "[ . 1 . 2]" 1
1738 1 60 ILE HA 1 60 ILE MG . . 2.990 2.196 2.186 2.200 . 0 0 "[ . 1 . 2]" 1
1739 1 60 ILE HA 1 61 ARG H . . 2.710 2.361 2.350 2.379 . 0 0 "[ . 1 . 2]" 1
1740 1 60 ILE HA 1 61 ARG HA . . 4.530 4.301 4.298 4.305 . 0 0 "[ . 1 . 2]" 1
1741 1 60 ILE HA 1 61 ARG HB2 . . 4.610 4.358 4.344 4.375 . 0 0 "[ . 1 . 2]" 1
1742 1 60 ILE HA 1 61 ARG HB3 . . 5.390 5.245 5.203 5.276 . 0 0 "[ . 1 . 2]" 1
1743 1 60 ILE HA 1 62 GLY H . . 4.890 4.505 4.469 4.540 . 0 0 "[ . 1 . 2]" 1
1744 1 60 ILE HA 1 63 TRP H . . 4.820 4.654 4.636 4.682 . 0 0 "[ . 1 . 2]" 1
1745 1 60 ILE HA 1 63 TRP QB . . 4.740 4.497 4.410 4.546 . 0 0 "[ . 1 . 2]" 1
1746 1 60 ILE HA 1 85 ALA HA . . 4.830 4.762 4.580 4.837 0.007 7 0 "[ . 1 . 2]" 1
1747 1 60 ILE HB 1 60 ILE MD . . 3.300 2.395 2.385 2.415 . 0 0 "[ . 1 . 2]" 1
1748 1 60 ILE HB 1 61 ARG H . . 3.110 2.475 2.432 2.500 . 0 0 "[ . 1 . 2]" 1
1749 1 60 ILE HB 1 61 ARG HA . . 5.380 4.729 4.706 4.755 . 0 0 "[ . 1 . 2]" 1
1750 1 60 ILE HB 1 61 ARG HB2 . . 4.810 4.493 4.445 4.547 . 0 0 "[ . 1 . 2]" 1
1751 1 60 ILE HB 1 62 GLY H . . 4.450 2.834 2.759 2.875 . 0 0 "[ . 1 . 2]" 1
1752 1 60 ILE HB 1 62 GLY HA3 . . 4.890 4.362 4.278 4.434 . 0 0 "[ . 1 . 2]" 1
1753 1 60 ILE HB 1 63 TRP H . . 3.760 3.564 3.504 3.602 . 0 0 "[ . 1 . 2]" 1
1754 1 60 ILE HB 1 63 TRP HA . . 6.000 6.066 6.045 6.077 0.077 4 0 "[ . 1 . 2]" 1
1755 1 60 ILE HB 1 63 TRP QB . . 4.520 4.202 4.159 4.227 . 0 0 "[ . 1 . 2]" 1
1756 1 60 ILE HB 1 80 ILE MD . . 5.030 4.628 4.333 4.915 . 0 0 "[ . 1 . 2]" 1
1757 1 60 ILE HB 1 80 ILE MG . . 4.460 3.450 3.234 3.551 . 0 0 "[ . 1 . 2]" 1
1758 1 60 ILE HB 1 84 TYR HB2 . . 6.000 5.925 5.794 5.984 . 0 0 "[ . 1 . 2]" 1
1759 1 60 ILE HB 1 84 TYR HB3 . . 5.430 4.521 4.411 4.583 . 0 0 "[ . 1 . 2]" 1
1760 1 60 ILE HB 1 85 ALA H . . 5.300 5.152 5.037 5.201 . 0 0 "[ . 1 . 2]" 1
1761 1 60 ILE HB 1 85 ALA HA . . 3.540 2.708 2.564 2.761 . 0 0 "[ . 1 . 2]" 1
1762 1 60 ILE HB 1 85 ALA MB . . 4.430 4.193 3.850 4.262 . 0 0 "[ . 1 . 2]" 1
1763 1 60 ILE MD 1 60 ILE MG . . 2.990 2.065 2.029 2.086 . 0 0 "[ . 1 . 2]" 1
1764 1 60 ILE MD 1 61 ARG H . . 4.550 4.366 4.328 4.415 . 0 0 "[ . 1 . 2]" 1
1765 1 60 ILE MD 1 61 ARG HA . . 5.840 5.790 5.743 5.844 0.004 3 0 "[ . 1 . 2]" 1
1766 1 60 ILE MD 1 61 ARG HB3 . . 6.000 5.490 5.415 5.577 . 0 0 "[ . 1 . 2]" 1
1767 1 60 ILE MD 1 62 GLY H . . 4.280 3.384 3.330 3.472 . 0 0 "[ . 1 . 2]" 1
1768 1 60 ILE MD 1 63 TRP H . . 3.470 3.254 3.168 3.323 . 0 0 "[ . 1 . 2]" 1
1769 1 60 ILE MD 1 63 TRP HA . . 4.300 4.262 4.199 4.302 0.002 7 0 "[ . 1 . 2]" 1
1770 1 60 ILE MD 1 63 TRP QB . . 3.640 3.493 3.446 3.522 . 0 0 "[ . 1 . 2]" 1
1771 1 60 ILE MD 1 63 TRP HD1 . . 2.820 2.599 2.490 2.629 . 0 0 "[ . 1 . 2]" 1
1772 1 60 ILE MD 1 63 TRP HE1 . . 3.430 2.770 2.724 2.854 . 0 0 "[ . 1 . 2]" 1
1773 1 60 ILE MD 1 80 ILE HB . . 3.650 3.529 3.376 3.606 . 0 0 "[ . 1 . 2]" 1
1774 1 60 ILE MD 1 84 TYR HB3 . . 4.890 4.421 4.365 4.508 . 0 0 "[ . 1 . 2]" 1
1775 1 60 ILE MD 1 85 ALA H . . 4.850 4.848 4.710 4.863 0.013 10 0 "[ . 1 . 2]" 1
1776 1 60 ILE MD 1 85 ALA HA . . 3.220 2.703 2.634 2.736 . 0 0 "[ . 1 . 2]" 1
1777 1 60 ILE MD 1 85 ALA MB . . 3.080 3.008 2.477 3.073 . 0 0 "[ . 1 . 2]" 1
1778 1 60 ILE MD 1 86 TYR QE . . 4.860 4.468 4.099 4.615 . 0 0 "[ . 1 . 2]" 1
1779 1 60 ILE MD 1 103 PHE QD . . 4.040 3.588 3.554 3.632 . 0 0 "[ . 1 . 2]" 1
1780 1 60 ILE MD 1 103 PHE QE . . 3.650 3.208 3.138 3.334 . 0 0 "[ . 1 . 2]" 1
1781 1 60 ILE MD 1 103 PHE HZ . . 4.140 3.813 3.619 4.018 . 0 0 "[ . 1 . 2]" 1
1782 1 60 ILE HG12 1 60 ILE MG . . 3.240 2.321 2.310 2.341 . 0 0 "[ . 1 . 2]" 1
1783 1 60 ILE HG12 1 63 TRP H . . 4.130 4.148 4.145 4.161 0.031 3 0 "[ . 1 . 2]" 1
1784 1 60 ILE HG12 1 63 TRP QB . . 4.460 3.208 3.124 3.264 . 0 0 "[ . 1 . 2]" 1
1785 1 60 ILE HG13 1 60 ILE MG . . 3.580 3.198 3.193 3.205 . 0 0 "[ . 1 . 2]" 1
1786 1 60 ILE HG13 1 61 ARG H . . 5.090 4.232 4.206 4.276 . 0 0 "[ . 1 . 2]" 1
1787 1 60 ILE HG13 1 62 GLY H . . 4.890 3.811 3.756 3.829 . 0 0 "[ . 1 . 2]" 1
1788 1 60 ILE HG13 1 63 TRP H . . 3.120 2.400 2.394 2.419 . 0 0 "[ . 1 . 2]" 1
1789 1 60 ILE HG13 1 63 TRP HA . . 4.520 4.002 3.941 4.046 . 0 0 "[ . 1 . 2]" 1
1790 1 60 ILE HG13 1 63 TRP QB . . 3.630 2.054 2.014 2.080 . 0 0 "[ . 1 . 2]" 1
1791 1 60 ILE HG13 1 63 TRP HD1 . . 3.710 3.148 2.992 3.261 . 0 0 "[ . 1 . 2]" 1
1792 1 60 ILE HG13 1 63 TRP HE3 . . 4.670 4.475 4.387 4.642 . 0 0 "[ . 1 . 2]" 1
1793 1 60 ILE HG13 1 64 GLU H . . 4.310 4.194 4.152 4.247 . 0 0 "[ . 1 . 2]" 1
1794 1 60 ILE HG13 1 85 ALA HA . . 5.410 4.751 4.648 4.787 . 0 0 "[ . 1 . 2]" 1
1795 1 60 ILE MG 1 61 ARG H . . 3.490 3.312 3.243 3.350 . 0 0 "[ . 1 . 2]" 1
1796 1 60 ILE MG 1 61 ARG HA . . 5.740 5.478 5.436 5.500 . 0 0 "[ . 1 . 2]" 1
1797 1 60 ILE MG 1 62 GLY H . . 4.830 4.410 4.334 4.450 . 0 0 "[ . 1 . 2]" 1
1798 1 60 ILE MG 1 63 TRP H . . 4.780 4.754 4.730 4.778 . 0 0 "[ . 1 . 2]" 1
1799 1 60 ILE MG 1 63 TRP QB . . 4.480 4.454 4.394 4.491 0.011 3 0 "[ . 1 . 2]" 1
1800 1 60 ILE MG 1 64 GLU H . . 6.000 6.034 6.022 6.056 0.056 11 0 "[ . 1 . 2]" 1
1801 1 60 ILE MG 1 85 ALA H . . 4.950 4.856 4.709 4.919 . 0 0 "[ . 1 . 2]" 1
1802 1 60 ILE MG 1 85 ALA HA . . 3.430 2.479 2.239 2.554 . 0 0 "[ . 1 . 2]" 1
1803 1 60 ILE MG 1 85 ALA MB . . 3.660 3.161 3.005 3.238 . 0 0 "[ . 1 . 2]" 1
1804 1 60 ILE MG 1 86 TYR HA . . 4.740 3.881 3.135 3.968 . 0 0 "[ . 1 . 2]" 1
1805 1 60 ILE MG 1 86 TYR QD . . 4.080 4.070 3.404 4.126 0.046 13 0 "[ . 1 . 2]" 1
1806 1 60 ILE MG 1 86 TYR QE . . 3.890 3.818 3.433 3.897 0.007 13 0 "[ . 1 . 2]" 1
1807 1 60 ILE MG 1 101 LEU QD . . 5.210 4.376 4.226 4.451 . 0 0 "[ . 1 . 2]" 1
1808 1 61 ARG H 1 61 ARG HB2 . . 3.050 2.199 2.171 2.220 . 0 0 "[ . 1 . 2]" 1
1809 1 61 ARG H 1 61 ARG HB3 . . 3.150 2.891 2.856 2.921 . 0 0 "[ . 1 . 2]" 1
1810 1 61 ARG H 1 61 ARG HD2 . . 4.720 4.524 4.490 4.547 . 0 0 "[ . 1 . 2]" 1
1811 1 61 ARG H 1 61 ARG HD3 . . 5.330 5.103 5.093 5.121 . 0 0 "[ . 1 . 2]" 1
1812 1 61 ARG H 1 61 ARG HG2 . . 4.640 4.577 4.570 4.580 . 0 0 "[ . 1 . 2]" 1
1813 1 61 ARG H 1 61 ARG HG3 . . 4.330 4.141 4.096 4.181 . 0 0 "[ . 1 . 2]" 1
1814 1 61 ARG H 1 62 GLY H . . 3.640 2.776 2.739 2.793 . 0 0 "[ . 1 . 2]" 1
1815 1 61 ARG H 1 62 GLY HA3 . . 5.910 5.037 5.006 5.063 . 0 0 "[ . 1 . 2]" 1
1816 1 61 ARG H 1 63 TRP H . . 4.530 4.062 4.042 4.080 . 0 0 "[ . 1 . 2]" 1
1817 1 61 ARG H 1 63 TRP QB . . 6.000 4.969 4.890 5.000 . 0 0 "[ . 1 . 2]" 1
1818 1 61 ARG H 1 64 GLU H . . 5.520 4.971 4.942 5.032 . 0 0 "[ . 1 . 2]" 1
1819 1 61 ARG H 1 84 TYR HA . . 5.010 4.591 4.369 4.644 . 0 0 "[ . 1 . 2]" 1
1820 1 61 ARG H 1 84 TYR HB3 . . 4.620 4.595 4.512 4.629 0.009 14 0 "[ . 1 . 2]" 1
1821 1 61 ARG H 1 84 TYR QD . . 4.950 4.785 4.741 4.831 . 0 0 "[ . 1 . 2]" 1
1822 1 61 ARG H 1 85 ALA HA . . 4.660 4.361 4.198 4.447 . 0 0 "[ . 1 . 2]" 1
1823 1 61 ARG HA 1 61 ARG HD2 . . 4.800 4.234 4.222 4.248 . 0 0 "[ . 1 . 2]" 1
1824 1 61 ARG HA 1 61 ARG HD3 . . 4.690 4.614 4.602 4.629 . 0 0 "[ . 1 . 2]" 1
1825 1 61 ARG HA 1 61 ARG HG2 . . 3.920 2.918 2.889 2.953 . 0 0 "[ . 1 . 2]" 1
1826 1 61 ARG HA 1 61 ARG HG3 . . 3.600 2.338 2.329 2.355 . 0 0 "[ . 1 . 2]" 1
1827 1 61 ARG HA 1 63 TRP H . . 5.020 3.929 3.897 3.974 . 0 0 "[ . 1 . 2]" 1
1828 1 61 ARG HA 1 64 GLU H . . 3.910 3.463 3.433 3.534 . 0 0 "[ . 1 . 2]" 1
1829 1 61 ARG HA 1 64 GLU HB2 . . 3.670 3.127 3.053 3.349 . 0 0 "[ . 1 . 2]" 1
1830 1 61 ARG HA 1 64 GLU HG2 . . 4.980 4.977 4.959 4.996 0.016 7 0 "[ . 1 . 2]" 1
1831 1 61 ARG HA 1 64 GLU HG3 . . 4.130 3.303 3.247 3.324 . 0 0 "[ . 1 . 2]" 1
1832 1 61 ARG HA 1 65 GLU H . . 4.370 4.118 4.064 4.161 . 0 0 "[ . 1 . 2]" 1
1833 1 61 ARG HA 1 65 GLU QG . . 4.640 4.155 4.097 4.188 . 0 0 "[ . 1 . 2]" 1
1834 1 61 ARG HA 1 84 TYR QD . . 5.290 4.584 4.520 4.648 . 0 0 "[ . 1 . 2]" 1
1835 1 61 ARG HB2 1 61 ARG HD2 . . 3.940 2.342 2.334 2.351 . 0 0 "[ . 1 . 2]" 1
1836 1 61 ARG HB2 1 61 ARG HD3 . . 3.480 3.053 3.038 3.076 . 0 0 "[ . 1 . 2]" 1
1837 1 61 ARG HB2 1 62 GLY H . . 4.440 3.568 3.541 3.611 . 0 0 "[ . 1 . 2]" 1
1838 1 61 ARG HB2 1 63 TRP H . . 5.400 5.394 5.372 5.405 0.005 3 0 "[ . 1 . 2]" 1
1839 1 61 ARG HB2 1 84 TYR HA . . 4.230 3.810 3.583 3.860 . 0 0 "[ . 1 . 2]" 1
1840 1 61 ARG HB2 1 84 TYR HB2 . . 6.000 5.990 5.878 6.008 0.008 15 0 "[ . 1 . 2]" 1
1841 1 61 ARG HB2 1 84 TYR HB3 . . 4.790 4.592 4.534 4.643 . 0 0 "[ . 1 . 2]" 1
1842 1 61 ARG HB2 1 84 TYR QD . . 4.470 4.127 4.054 4.182 . 0 0 "[ . 1 . 2]" 1
1843 1 61 ARG HB3 1 61 ARG HD2 . . 3.830 3.040 3.017 3.055 . 0 0 "[ . 1 . 2]" 1
1844 1 61 ARG HB3 1 61 ARG HD3 . . 4.190 2.641 2.631 2.649 . 0 0 "[ . 1 . 2]" 1
1845 1 61 ARG HB3 1 62 GLY H . . 4.130 2.560 2.545 2.591 . 0 0 "[ . 1 . 2]" 1
1846 1 61 ARG HB3 1 62 GLY HA3 . . 5.200 4.360 4.350 4.374 . 0 0 "[ . 1 . 2]" 1
1847 1 61 ARG HB3 1 63 TRP H . . 5.880 4.803 4.773 4.833 . 0 0 "[ . 1 . 2]" 1
1848 1 61 ARG HB3 1 80 ILE MD . . 6.000 5.627 5.597 5.681 . 0 0 "[ . 1 . 2]" 1
1849 1 61 ARG HB3 1 84 TYR H . . 6.000 5.721 5.599 5.776 . 0 0 "[ . 1 . 2]" 1
1850 1 61 ARG HB3 1 84 TYR HA . . 3.750 3.088 2.953 3.161 . 0 0 "[ . 1 . 2]" 1
1851 1 61 ARG HB3 1 84 TYR HB3 . . 5.010 3.161 3.128 3.190 . 0 0 "[ . 1 . 2]" 1
1852 1 61 ARG HB3 1 84 TYR QD . . 4.060 2.415 2.336 2.478 . 0 0 "[ . 1 . 2]" 1
1853 1 61 ARG HB3 1 84 TYR QE . . 4.450 3.845 3.775 3.905 . 0 0 "[ . 1 . 2]" 1
1854 1 61 ARG HB3 1 85 ALA H . . 6.000 5.743 5.582 5.817 . 0 0 "[ . 1 . 2]" 1
1855 1 61 ARG HD2 1 62 GLY H . . 5.490 5.517 5.511 5.523 0.033 13 0 "[ . 1 . 2]" 1
1856 1 61 ARG HD2 1 84 TYR HA . . 4.840 4.276 4.146 4.336 . 0 0 "[ . 1 . 2]" 1
1857 1 61 ARG HD2 1 84 TYR QD . . 5.120 4.770 4.718 4.814 . 0 0 "[ . 1 . 2]" 1
1858 1 61 ARG HD2 1 84 TYR QE . . 4.970 4.962 4.891 4.978 0.008 2 0 "[ . 1 . 2]" 1
1859 1 61 ARG HD3 1 84 TYR HA . . 5.060 3.726 3.575 3.819 . 0 0 "[ . 1 . 2]" 1
1860 1 61 ARG HD3 1 84 TYR QD . . 4.730 3.610 3.543 3.656 . 0 0 "[ . 1 . 2]" 1
1861 1 61 ARG HD3 1 84 TYR QE . . 3.830 3.468 3.415 3.502 . 0 0 "[ . 1 . 2]" 1
1862 1 61 ARG HG2 1 62 GLY H . . 5.150 4.312 4.264 4.374 . 0 0 "[ . 1 . 2]" 1
1863 1 61 ARG HG2 1 65 GLU H . . 4.920 4.682 4.630 4.751 . 0 0 "[ . 1 . 2]" 1
1864 1 61 ARG HG2 1 65 GLU QG . . 3.640 3.087 2.893 3.295 . 0 0 "[ . 1 . 2]" 1
1865 1 61 ARG HG2 1 84 TYR QD . . 3.730 3.259 3.133 3.348 . 0 0 "[ . 1 . 2]" 1
1866 1 61 ARG HG2 1 84 TYR QE . . 4.030 3.074 2.946 3.177 . 0 0 "[ . 1 . 2]" 1
1867 1 61 ARG HG3 1 62 GLY H . . 4.900 4.929 4.918 4.946 0.046 3 0 "[ . 1 . 2]" 1
1868 1 61 ARG HG3 1 64 GLU HG3 . . 5.210 5.236 5.227 5.242 0.032 2 0 "[ . 1 . 2]" 1
1869 1 61 ARG HG3 1 65 GLU H . . 5.330 5.338 5.330 5.347 0.017 13 0 "[ . 1 . 2]" 1
1870 1 61 ARG HG3 1 65 GLU QG . . 4.140 3.949 3.845 4.035 . 0 0 "[ . 1 . 2]" 1
1871 1 61 ARG HG3 1 84 TYR QD . . 5.220 4.689 4.591 4.770 . 0 0 "[ . 1 . 2]" 1
1872 1 61 ARG HG3 1 84 TYR QE . . 4.920 4.780 4.651 4.877 . 0 0 "[ . 1 . 2]" 1
1873 1 62 GLY H 1 63 TRP H . . 3.590 2.734 2.712 2.749 . 0 0 "[ . 1 . 2]" 1
1874 1 62 GLY H 1 63 TRP QB . . 5.380 4.584 4.518 4.609 . 0 0 "[ . 1 . 2]" 1
1875 1 62 GLY H 1 64 GLU H . . 5.100 4.477 4.413 4.546 . 0 0 "[ . 1 . 2]" 1
1876 1 62 GLY H 1 65 GLU H . . 5.040 4.997 4.944 5.029 . 0 0 "[ . 1 . 2]" 1
1877 1 62 GLY H 1 66 GLY H . . 6.000 5.864 5.844 5.887 . 0 0 "[ . 1 . 2]" 1
1878 1 62 GLY H 1 80 ILE MD . . 4.100 3.701 3.571 3.858 . 0 0 "[ . 1 . 2]" 1
1879 1 62 GLY H 1 80 ILE MG . . 4.060 3.130 2.998 3.199 . 0 0 "[ . 1 . 2]" 1
1880 1 62 GLY H 1 84 TYR H . . 5.910 5.840 5.751 5.878 . 0 0 "[ . 1 . 2]" 1
1881 1 62 GLY H 1 84 TYR HA . . 4.750 4.201 4.075 4.244 . 0 0 "[ . 1 . 2]" 1
1882 1 62 GLY H 1 84 TYR HB2 . . 4.330 4.364 4.345 4.376 0.046 4 0 "[ . 1 . 2]" 1
1883 1 62 GLY H 1 84 TYR HB3 . . 3.850 2.626 2.603 2.637 . 0 0 "[ . 1 . 2]" 1
1884 1 62 GLY H 1 84 TYR QD . . 4.180 2.872 2.840 2.896 . 0 0 "[ . 1 . 2]" 1
1885 1 62 GLY H 1 84 TYR QE . . 5.040 5.042 5.022 5.048 0.008 1 0 "[ . 1 . 2]" 1
1886 1 62 GLY H 1 85 ALA H . . 5.460 5.298 5.187 5.355 . 0 0 "[ . 1 . 2]" 1
1887 1 62 GLY H 1 85 ALA HA . . 5.450 4.192 4.094 4.267 . 0 0 "[ . 1 . 2]" 1
1888 1 62 GLY HA2 1 63 TRP HA . . 5.010 4.705 4.700 4.714 . 0 0 "[ . 1 . 2]" 1
1889 1 62 GLY HA2 1 63 TRP HD1 . . 5.370 5.143 5.104 5.207 . 0 0 "[ . 1 . 2]" 1
1890 1 62 GLY HA2 1 64 GLU H . . 5.440 4.685 4.658 4.743 . 0 0 "[ . 1 . 2]" 1
1891 1 62 GLY HA2 1 65 GLU H . . 4.110 3.806 3.772 3.841 . 0 0 "[ . 1 . 2]" 1
1892 1 62 GLY HA2 1 65 GLU HB2 . . 4.210 3.111 3.065 3.160 . 0 0 "[ . 1 . 2]" 1
1893 1 62 GLY HA2 1 65 GLU QG . . 4.660 4.468 4.250 4.669 0.009 7 0 "[ . 1 . 2]" 1
1894 1 62 GLY HA2 1 66 GLY H . . 4.450 3.928 3.891 3.960 . 0 0 "[ . 1 . 2]" 1
1895 1 62 GLY HA2 1 69 GLN HE21 . . 6.000 6.036 6.015 6.051 0.051 17 0 "[ . 1 . 2]" 1
1896 1 62 GLY HA2 1 78 LEU HB3 . . 6.000 5.939 5.838 6.018 0.018 7 0 "[ . 1 . 2]" 1
1897 1 62 GLY HA2 1 80 ILE MD . . 3.810 3.111 2.985 3.284 . 0 0 "[ . 1 . 2]" 1
1898 1 62 GLY HA2 1 80 ILE MG . . 3.840 3.750 3.425 3.849 0.009 13 0 "[ . 1 . 2]" 1
1899 1 62 GLY HA2 1 84 TYR HB2 . . 4.770 4.786 4.771 4.808 0.038 6 0 "[ . 1 . 2]" 1
1900 1 62 GLY HA2 1 84 TYR HB3 . . 4.240 3.484 3.447 3.524 . 0 0 "[ . 1 . 2]" 1
1901 1 62 GLY HA2 1 84 TYR QD . . 3.470 2.443 2.387 2.509 . 0 0 "[ . 1 . 2]" 1
1902 1 62 GLY HA2 1 84 TYR QE . . 4.430 3.908 3.823 3.972 . 0 0 "[ . 1 . 2]" 1
1903 1 62 GLY HA3 1 64 GLU H . . 5.580 5.087 5.032 5.168 . 0 0 "[ . 1 . 2]" 1
1904 1 62 GLY HA3 1 65 GLU H . . 5.270 5.037 5.005 5.069 . 0 0 "[ . 1 . 2]" 1
1905 1 62 GLY HA3 1 78 LEU HB2 . . 5.940 5.569 5.476 5.672 . 0 0 "[ . 1 . 2]" 1
1906 1 62 GLY HA3 1 80 ILE MD . . 3.630 2.014 1.987 2.071 . 0 0 "[ . 1 . 2]" 1
1907 1 62 GLY HA3 1 80 ILE MG . . 3.480 2.272 2.159 2.305 . 0 0 "[ . 1 . 2]" 1
1908 1 62 GLY HA3 1 81 SER H . . 6.000 4.794 4.627 4.918 . 0 0 "[ . 1 . 2]" 1
1909 1 62 GLY HA3 1 84 TYR HA . . 6.000 5.447 5.388 5.500 . 0 0 "[ . 1 . 2]" 1
1910 1 62 GLY HA3 1 84 TYR HB2 . . 4.450 4.203 4.176 4.231 . 0 0 "[ . 1 . 2]" 1
1911 1 62 GLY HA3 1 84 TYR HB3 . . 4.270 2.920 2.861 2.961 . 0 0 "[ . 1 . 2]" 1
1912 1 62 GLY HA3 1 84 TYR QD . . 4.510 3.186 3.118 3.250 . 0 0 "[ . 1 . 2]" 1
1913 1 62 GLY HA3 1 85 ALA HA . . 6.000 5.138 5.080 5.288 . 0 0 "[ . 1 . 2]" 1
1914 1 62 GLY HA3 1 85 ALA MB . . 5.910 5.343 4.791 5.424 . 0 0 "[ . 1 . 2]" 1
1915 1 63 TRP H 1 63 TRP QB . . 2.850 2.217 2.183 2.228 . 0 0 "[ . 1 . 2]" 1
1916 1 63 TRP H 1 63 TRP HD1 . . 3.950 3.324 3.252 3.385 . 0 0 "[ . 1 . 2]" 1
1917 1 63 TRP H 1 64 GLU H . . 3.030 2.443 2.429 2.469 . 0 0 "[ . 1 . 2]" 1
1918 1 63 TRP H 1 64 GLU HA . . 5.520 5.094 5.084 5.115 . 0 0 "[ . 1 . 2]" 1
1919 1 63 TRP H 1 64 GLU HB2 . . 5.210 4.681 4.651 4.792 . 0 0 "[ . 1 . 2]" 1
1920 1 63 TRP H 1 64 GLU HG2 . . 5.390 5.354 5.228 5.383 . 0 0 "[ . 1 . 2]" 1
1921 1 63 TRP H 1 64 GLU HG3 . . 4.560 4.166 4.031 4.235 . 0 0 "[ . 1 . 2]" 1
1922 1 63 TRP H 1 65 GLU H . . 4.210 3.877 3.834 3.916 . 0 0 "[ . 1 . 2]" 1
1923 1 63 TRP H 1 66 GLY H . . 4.840 4.358 4.324 4.396 . 0 0 "[ . 1 . 2]" 1
1924 1 63 TRP H 1 80 ILE MD . . 3.850 3.398 3.231 3.554 . 0 0 "[ . 1 . 2]" 1
1925 1 63 TRP H 1 80 ILE MG . . 4.840 4.250 4.034 4.332 . 0 0 "[ . 1 . 2]" 1
1926 1 63 TRP H 1 84 TYR HB3 . . 5.690 5.143 5.084 5.165 . 0 0 "[ . 1 . 2]" 1
1927 1 63 TRP HA 1 63 TRP HD1 . . 3.430 2.400 2.371 2.456 . 0 0 "[ . 1 . 2]" 1
1928 1 63 TRP HA 1 63 TRP HE1 . . 5.100 4.626 4.606 4.638 . 0 0 "[ . 1 . 2]" 1
1929 1 63 TRP HA 1 63 TRP HE3 . . 5.250 4.949 4.887 4.976 . 0 0 "[ . 1 . 2]" 1
1930 1 63 TRP HA 1 64 GLU HA . . 5.780 4.781 4.769 4.785 . 0 0 "[ . 1 . 2]" 1
1931 1 63 TRP HA 1 64 GLU HB2 . . 6.000 5.922 5.905 5.999 . 0 0 "[ . 1 . 2]" 1
1932 1 63 TRP HA 1 65 GLU H . . 4.730 4.431 4.410 4.465 . 0 0 "[ . 1 . 2]" 1
1933 1 63 TRP HA 1 65 GLU HB2 . . 6.000 5.765 5.729 5.829 . 0 0 "[ . 1 . 2]" 1
1934 1 63 TRP HA 1 66 GLY H . . 3.760 3.417 3.386 3.454 . 0 0 "[ . 1 . 2]" 1
1935 1 63 TRP HA 1 66 GLY HA3 . . 5.160 3.747 3.692 3.787 . 0 0 "[ . 1 . 2]" 1
1936 1 63 TRP HA 1 67 VAL H . . 3.810 3.219 3.155 3.359 . 0 0 "[ . 1 . 2]" 1
1937 1 63 TRP HA 1 67 VAL HB . . 4.600 3.644 3.562 3.830 . 0 0 "[ . 1 . 2]" 1
1938 1 63 TRP HA 1 67 VAL QG . . 3.960 4.000 3.988 4.022 0.062 11 0 "[ . 1 . 2]" 1
1939 1 63 TRP HA 1 78 LEU QD . . 3.620 2.794 2.723 2.853 . 0 0 "[ . 1 . 2]" 1
1940 1 63 TRP HA 1 80 ILE MD . . 3.570 3.353 3.229 3.390 . 0 0 "[ . 1 . 2]" 1
1941 1 63 TRP QB 1 63 TRP HE3 . . 3.240 2.530 2.495 2.547 . 0 0 "[ . 1 . 2]" 1
1942 1 63 TRP QB 1 63 TRP HZ3 . . 5.520 4.665 4.658 4.672 . 0 0 "[ . 1 . 2]" 1
1943 1 63 TRP QB 1 64 GLU H . . 3.250 2.633 2.592 2.658 . 0 0 "[ . 1 . 2]" 1
1944 1 63 TRP QB 1 64 GLU HA . . 4.650 3.803 3.776 3.827 . 0 0 "[ . 1 . 2]" 1
1945 1 63 TRP QB 1 64 GLU HB2 . . 4.760 4.782 4.771 4.817 0.057 11 0 "[ . 1 . 2]" 1
1946 1 63 TRP QB 1 64 GLU HG3 . . 4.690 3.587 3.496 3.612 . 0 0 "[ . 1 . 2]" 1
1947 1 63 TRP QB 1 65 GLU H . . 4.680 4.650 4.595 4.681 0.001 3 0 "[ . 1 . 2]" 1
1948 1 63 TRP QB 1 66 GLY H . . 4.780 4.750 4.693 4.773 . 0 0 "[ . 1 . 2]" 1
1949 1 63 TRP QB 1 67 VAL H . . 4.840 4.338 4.299 4.451 . 0 0 "[ . 1 . 2]" 1
1950 1 63 TRP QB 1 67 VAL QG . . 3.730 3.467 3.406 3.604 . 0 0 "[ . 1 . 2]" 1
1951 1 63 TRP QB 1 80 ILE MD . . 4.500 4.287 4.067 4.470 . 0 0 "[ . 1 . 2]" 1
1952 1 63 TRP HD1 1 64 GLU H . . 5.360 5.129 5.111 5.160 . 0 0 "[ . 1 . 2]" 1
1953 1 63 TRP HD1 1 78 LEU QD . . 4.070 3.157 3.055 3.280 . 0 0 "[ . 1 . 2]" 1
1954 1 63 TRP HD1 1 80 ILE MD . . 3.310 2.242 2.080 2.415 . 0 0 "[ . 1 . 2]" 1
1955 1 63 TRP HD1 1 80 ILE HG13 . . 3.170 2.984 2.836 3.077 . 0 0 "[ . 1 . 2]" 1
1956 1 63 TRP HD1 1 103 PHE HB3 . . 6.000 4.660 4.602 4.719 . 0 0 "[ . 1 . 2]" 1
1957 1 63 TRP HD1 1 103 PHE QD . . 4.680 4.374 4.323 4.475 . 0 0 "[ . 1 . 2]" 1
1958 1 63 TRP HE1 1 80 ILE MD . . 4.040 3.794 3.456 4.044 0.004 3 0 "[ . 1 . 2]" 1
1959 1 63 TRP HE1 1 103 PHE HB2 . . 4.660 2.593 2.423 2.816 . 0 0 "[ . 1 . 2]" 1
1960 1 63 TRP HE1 1 103 PHE HB3 . . 4.920 2.558 2.469 2.644 . 0 0 "[ . 1 . 2]" 1
1961 1 63 TRP HE1 1 103 PHE QD . . 3.940 2.980 2.913 3.012 . 0 0 "[ . 1 . 2]" 1
1962 1 63 TRP HE1 1 103 PHE QE . . 4.290 3.998 3.891 4.107 . 0 0 "[ . 1 . 2]" 1
1963 1 63 TRP HE1 1 103 PHE HZ . . 5.360 4.962 4.829 5.117 . 0 0 "[ . 1 . 2]" 1
1964 1 63 TRP HE3 1 64 GLU H . . 5.820 5.518 5.421 5.570 . 0 0 "[ . 1 . 2]" 1
1965 1 63 TRP HE3 1 67 VAL QG . . 4.690 4.684 4.586 4.708 0.018 5 0 "[ . 1 . 2]" 1
1966 1 63 TRP HH2 1 103 PHE QD . . 5.030 4.573 4.396 4.879 . 0 0 "[ . 1 . 2]" 1
1967 1 63 TRP HH2 1 105 VAL MG1 . . 4.460 4.210 4.019 4.272 . 0 0 "[ . 1 . 2]" 1
1968 1 63 TRP HZ2 1 103 PHE QD . . 3.870 2.424 2.310 2.668 . 0 0 "[ . 1 . 2]" 1
1969 1 63 TRP HZ2 1 103 PHE QE . . 3.630 3.319 3.196 3.527 . 0 0 "[ . 1 . 2]" 1
1970 1 63 TRP HZ2 1 103 PHE HZ . . 5.580 5.046 4.922 5.299 . 0 0 "[ . 1 . 2]" 1
1971 1 63 TRP HZ2 1 105 VAL MG1 . . 3.660 3.627 3.447 3.669 0.009 2 0 "[ . 1 . 2]" 1
1972 1 64 GLU H 1 64 GLU HB2 . . 3.220 2.563 2.542 2.654 . 0 0 "[ . 1 . 2]" 1
1973 1 64 GLU H 1 64 GLU HB3 . . 3.820 3.629 3.625 3.636 . 0 0 "[ . 1 . 2]" 1
1974 1 64 GLU H 1 64 GLU HG2 . . 3.160 3.163 3.052 3.183 0.023 3 0 "[ . 1 . 2]" 1
1975 1 64 GLU H 1 64 GLU HG3 . . 3.540 2.288 2.159 2.342 . 0 0 "[ . 1 . 2]" 1
1976 1 64 GLU H 1 65 GLU H . . 3.230 2.633 2.621 2.649 . 0 0 "[ . 1 . 2]" 1
1977 1 64 GLU H 1 65 GLU HB2 . . 5.200 4.746 4.726 4.776 . 0 0 "[ . 1 . 2]" 1
1978 1 64 GLU H 1 65 GLU QG . . 5.110 4.626 4.584 4.646 . 0 0 "[ . 1 . 2]" 1
1979 1 64 GLU H 1 66 GLY H . . 4.510 3.882 3.855 3.901 . 0 0 "[ . 1 . 2]" 1
1980 1 64 GLU H 1 67 VAL QG . . 5.140 4.191 4.081 4.239 . 0 0 "[ . 1 . 2]" 1
1981 1 64 GLU HA 1 64 GLU HG2 . . 3.590 2.492 2.459 2.601 . 0 0 "[ . 1 . 2]" 1
1982 1 64 GLU HA 1 64 GLU HG3 . . 3.720 3.313 3.302 3.368 . 0 0 "[ . 1 . 2]" 1
1983 1 64 GLU HA 1 65 GLU H . . 3.530 3.518 3.511 3.524 . 0 0 "[ . 1 . 2]" 1
1984 1 64 GLU HA 1 65 GLU HA . . 4.880 4.704 4.700 4.707 . 0 0 "[ . 1 . 2]" 1
1985 1 64 GLU HA 1 66 GLY H . . 4.930 4.318 4.261 4.353 . 0 0 "[ . 1 . 2]" 1
1986 1 64 GLU HA 1 67 VAL H . . 4.390 4.045 3.945 4.065 . 0 0 "[ . 1 . 2]" 1
1987 1 64 GLU HA 1 67 VAL HB . . 4.290 4.351 4.326 4.360 0.070 19 0 "[ . 1 . 2]" 1
1988 1 64 GLU HA 1 67 VAL QG . . 3.510 2.419 2.237 2.523 . 0 0 "[ . 1 . 2]" 1
1989 1 64 GLU HA 1 68 ALA MB . . 5.350 4.213 4.122 4.329 . 0 0 "[ . 1 . 2]" 1
1990 1 64 GLU HB2 1 65 GLU H . . 3.170 2.720 2.701 2.753 . 0 0 "[ . 1 . 2]" 1
1991 1 64 GLU HB2 1 65 GLU QG . . 3.300 3.262 3.230 3.295 . 0 0 "[ . 1 . 2]" 1
1992 1 64 GLU HB3 1 65 GLU H . . 4.250 3.784 3.760 3.894 . 0 0 "[ . 1 . 2]" 1
1993 1 64 GLU HG2 1 65 GLU H . . 4.970 4.894 4.864 4.903 . 0 0 "[ . 1 . 2]" 1
1994 1 64 GLU HG3 1 65 GLU H . . 4.700 4.274 4.145 4.313 . 0 0 "[ . 1 . 2]" 1
1995 1 65 GLU H 1 65 GLU HB2 . . 3.000 2.345 2.333 2.363 . 0 0 "[ . 1 . 2]" 1
1996 1 65 GLU H 1 65 GLU HB3 . . 3.680 3.591 3.586 3.599 . 0 0 "[ . 1 . 2]" 1
1997 1 65 GLU H 1 65 GLU QG . . 3.130 2.678 2.628 2.697 . 0 0 "[ . 1 . 2]" 1
1998 1 65 GLU H 1 66 GLY H . . 3.130 2.369 2.361 2.374 . 0 0 "[ . 1 . 2]" 1
1999 1 65 GLU H 1 66 GLY HA2 . . 5.300 5.044 5.033 5.050 . 0 0 "[ . 1 . 2]" 1
2000 1 65 GLU H 1 66 GLY HA3 . . 4.860 4.673 4.660 4.679 . 0 0 "[ . 1 . 2]" 1
2001 1 65 GLU H 1 67 VAL QG . . 5.520 4.577 4.393 4.650 . 0 0 "[ . 1 . 2]" 1
2002 1 65 GLU H 1 68 ALA H . . 5.170 4.943 4.915 4.955 . 0 0 "[ . 1 . 2]" 1
2003 1 65 GLU H 1 68 ALA MB . . 4.840 4.834 4.792 4.853 0.013 11 0 "[ . 1 . 2]" 1
2004 1 65 GLU H 1 84 TYR QD . . 5.640 5.191 5.119 5.236 . 0 0 "[ . 1 . 2]" 1
2005 1 65 GLU H 1 84 TYR QE . . 5.740 5.449 5.403 5.505 . 0 0 "[ . 1 . 2]" 1
2006 1 65 GLU HA 1 65 GLU HG2 . . 3.840 2.615 2.464 2.736 . 0 0 "[ . 1 . 2]" 1
2007 1 65 GLU HA 1 65 GLU QG . . 3.370 2.527 2.346 2.672 . 0 0 "[ . 1 . 2]" 1
2008 1 65 GLU HA 1 65 GLU HG3 . . 3.840 3.389 2.943 3.741 . 0 0 "[ . 1 . 2]" 1
2009 1 65 GLU HA 1 67 VAL QG . . 5.920 4.905 4.775 4.955 . 0 0 "[ . 1 . 2]" 1
2010 1 65 GLU HA 1 68 ALA H . . 4.110 4.086 4.004 4.113 0.003 6 0 "[ . 1 . 2]" 1
2011 1 65 GLU HA 1 68 ALA MB . . 3.390 3.088 3.040 3.120 . 0 0 "[ . 1 . 2]" 1
2012 1 65 GLU HA 1 69 GLN HE21 . . 5.360 4.221 4.198 4.284 . 0 0 "[ . 1 . 2]" 1
2013 1 65 GLU HA 1 69 GLN HE22 . . 5.830 5.754 5.723 5.843 0.013 11 0 "[ . 1 . 2]" 1
2014 1 65 GLU HB2 1 66 GLY H . . 3.440 3.051 3.019 3.108 . 0 0 "[ . 1 . 2]" 1
2015 1 65 GLU HB2 1 66 GLY HA2 . . 4.680 4.608 4.579 4.628 . 0 0 "[ . 1 . 2]" 1
2016 1 65 GLU HB2 1 66 GLY HA3 . . 4.940 4.719 4.688 4.743 . 0 0 "[ . 1 . 2]" 1
2017 1 65 GLU HB2 1 69 GLN HE21 . . 5.070 4.319 4.285 4.386 . 0 0 "[ . 1 . 2]" 1
2018 1 65 GLU HB2 1 69 GLN HE22 . . 5.330 5.209 5.166 5.326 . 0 0 "[ . 1 . 2]" 1
2019 1 65 GLU HB2 1 84 TYR QE . . 4.620 3.674 3.605 3.726 . 0 0 "[ . 1 . 2]" 1
2020 1 65 GLU HB3 1 66 GLY H . . 4.220 3.834 3.796 3.873 . 0 0 "[ . 1 . 2]" 1
2021 1 65 GLU HB3 1 66 GLY HA3 . . 5.680 5.149 5.123 5.181 . 0 0 "[ . 1 . 2]" 1
2022 1 65 GLU HB3 1 68 ALA MB . . 5.540 4.935 4.849 4.975 . 0 0 "[ . 1 . 2]" 1
2023 1 65 GLU HB3 1 69 GLN HE21 . . 4.500 3.422 3.390 3.480 . 0 0 "[ . 1 . 2]" 1
2024 1 65 GLU HB3 1 69 GLN HE22 . . 5.080 4.341 4.300 4.443 . 0 0 "[ . 1 . 2]" 1
2025 1 65 GLU HB3 1 84 TYR QE . . 4.670 4.339 4.264 4.398 . 0 0 "[ . 1 . 2]" 1
2026 1 65 GLU QG 1 66 GLY H . . 4.760 4.345 4.319 4.374 . 0 0 "[ . 1 . 2]" 1
2027 1 65 GLU QG 1 84 TYR QD . . 5.460 4.491 4.115 4.883 . 0 0 "[ . 1 . 2]" 1
2028 1 65 GLU QG 1 84 TYR QE . . 4.530 3.393 2.800 4.054 . 0 0 "[ . 1 . 2]" 1
2029 1 66 GLY H 1 66 GLY HA3 . . 2.830 2.339 2.334 2.347 . 0 0 "[ . 1 . 2]" 1
2030 1 66 GLY H 1 67 VAL H . . 3.180 2.491 2.454 2.523 . 0 0 "[ . 1 . 2]" 1
2031 1 66 GLY H 1 67 VAL QG . . 4.200 4.088 3.905 4.141 . 0 0 "[ . 1 . 2]" 1
2032 1 66 GLY H 1 68 ALA H . . 3.960 3.772 3.725 3.807 . 0 0 "[ . 1 . 2]" 1
2033 1 66 GLY H 1 68 ALA MB . . 4.780 4.543 4.502 4.575 . 0 0 "[ . 1 . 2]" 1
2034 1 66 GLY H 1 69 GLN HE21 . . 5.470 3.895 3.826 4.008 . 0 0 "[ . 1 . 2]" 1
2035 1 66 GLY H 1 69 GLN HE22 . . 5.770 5.143 5.042 5.310 . 0 0 "[ . 1 . 2]" 1
2036 1 66 GLY H 1 69 GLN HG3 . . 5.380 4.558 4.523 4.636 . 0 0 "[ . 1 . 2]" 1
2037 1 66 GLY H 1 78 LEU QD . . 4.260 3.658 3.616 3.694 . 0 0 "[ . 1 . 2]" 1
2038 1 66 GLY H 1 84 TYR QD . . 6.000 6.021 6.004 6.033 0.033 5 0 "[ . 1 . 2]" 1
2039 1 66 GLY HA2 1 67 VAL QG . . 5.150 5.043 5.004 5.053 . 0 0 "[ . 1 . 2]" 1
2040 1 66 GLY HA2 1 68 ALA H . . 4.520 4.078 4.015 4.108 . 0 0 "[ . 1 . 2]" 1
2041 1 66 GLY HA2 1 69 GLN H . . 4.060 3.789 3.759 3.833 . 0 0 "[ . 1 . 2]" 1
2042 1 66 GLY HA2 1 69 GLN HB2 . . 4.140 3.626 3.553 3.676 . 0 0 "[ . 1 . 2]" 1
2043 1 66 GLY HA2 1 69 GLN HE21 . . 4.080 1.916 1.808 2.024 . 0 0 "[ . 1 . 2]" 1
2044 1 66 GLY HA2 1 69 GLN HE22 . . 4.390 2.888 2.763 3.071 . 0 0 "[ . 1 . 2]" 1
2045 1 66 GLY HA2 1 69 GLN HG2 . . 4.780 4.063 4.008 4.131 . 0 0 "[ . 1 . 2]" 1
2046 1 66 GLY HA2 1 69 GLN HG3 . . 4.660 2.523 2.476 2.581 . 0 0 "[ . 1 . 2]" 1
2047 1 66 GLY HA2 1 78 LEU HG . . 5.710 5.620 5.548 5.655 . 0 0 "[ . 1 . 2]" 1
2048 1 66 GLY HA3 1 67 VAL H . . 3.440 2.774 2.766 2.790 . 0 0 "[ . 1 . 2]" 1
2049 1 66 GLY HA3 1 67 VAL HA . . 4.410 4.361 4.354 4.368 . 0 0 "[ . 1 . 2]" 1
2050 1 66 GLY HA3 1 67 VAL HB . . 5.240 4.727 4.711 4.750 . 0 0 "[ . 1 . 2]" 1
2051 1 66 GLY HA3 1 67 VAL QG . . 4.930 4.634 4.574 4.649 . 0 0 "[ . 1 . 2]" 1
2052 1 66 GLY HA3 1 68 ALA H . . 4.600 4.405 4.375 4.426 . 0 0 "[ . 1 . 2]" 1
2053 1 66 GLY HA3 1 69 GLN H . . 4.880 4.725 4.707 4.749 . 0 0 "[ . 1 . 2]" 1
2054 1 66 GLY HA3 1 69 GLN HB2 . . 5.990 4.851 4.798 4.889 . 0 0 "[ . 1 . 2]" 1
2055 1 66 GLY HA3 1 69 GLN HE21 . . 4.480 3.541 3.435 3.652 . 0 0 "[ . 1 . 2]" 1
2056 1 66 GLY HA3 1 69 GLN HE22 . . 5.140 4.288 4.135 4.495 . 0 0 "[ . 1 . 2]" 1
2057 1 66 GLY HA3 1 69 GLN HG2 . . 6.000 5.759 5.708 5.825 . 0 0 "[ . 1 . 2]" 1
2058 1 66 GLY HA3 1 78 LEU HB3 . . 5.430 3.238 3.179 3.329 . 0 0 "[ . 1 . 2]" 1
2059 1 66 GLY HA3 1 78 LEU QD . . 3.400 2.130 2.116 2.143 . 0 0 "[ . 1 . 2]" 1
2060 1 66 GLY HA3 1 78 LEU HG . . 5.170 4.628 4.570 4.662 . 0 0 "[ . 1 . 2]" 1
2061 1 67 VAL H 1 67 VAL HB . . 2.960 2.318 2.297 2.382 . 0 0 "[ . 1 . 2]" 1
2062 1 67 VAL H 1 67 VAL MG1 . . 3.930 2.668 2.472 2.724 . 0 0 "[ . 1 . 2]" 1
2063 1 67 VAL H 1 67 VAL QG . . 2.810 2.610 2.440 2.657 . 0 0 "[ . 1 . 2]" 1
2064 1 67 VAL H 1 67 VAL MG2 . . 3.930 3.704 3.689 3.742 . 0 0 "[ . 1 . 2]" 1
2065 1 67 VAL H 1 68 ALA H . . 3.080 2.615 2.592 2.629 . 0 0 "[ . 1 . 2]" 1
2066 1 67 VAL H 1 68 ALA MB . . 4.640 4.265 4.249 4.280 . 0 0 "[ . 1 . 2]" 1
2067 1 67 VAL H 1 69 GLN H . . 4.430 4.122 4.112 4.133 . 0 0 "[ . 1 . 2]" 1
2068 1 67 VAL H 1 70 MET H . . 5.990 5.544 5.486 5.658 . 0 0 "[ . 1 . 2]" 1
2069 1 67 VAL H 1 70 MET HG3 . . 5.330 4.953 4.923 4.981 . 0 0 "[ . 1 . 2]" 1
2070 1 67 VAL H 1 78 LEU QD . . 3.250 2.891 2.849 2.958 . 0 0 "[ . 1 . 2]" 1
2071 1 67 VAL HA 1 67 VAL MG1 . . 3.350 3.211 3.208 3.224 . 0 0 "[ . 1 . 2]" 1
2072 1 67 VAL HA 1 67 VAL QG . . 2.770 2.194 2.179 2.231 . 0 0 "[ . 1 . 2]" 1
2073 1 67 VAL HA 1 67 VAL MG2 . . 3.350 2.233 2.217 2.274 . 0 0 "[ . 1 . 2]" 1
2074 1 67 VAL HA 1 68 ALA MB . . 5.070 4.978 4.975 4.982 . 0 0 "[ . 1 . 2]" 1
2075 1 67 VAL HA 1 69 GLN H . . 3.780 3.579 3.525 3.618 . 0 0 "[ . 1 . 2]" 1
2076 1 67 VAL HA 1 70 MET H . . 3.980 3.695 3.616 3.824 . 0 0 "[ . 1 . 2]" 1
2077 1 67 VAL HA 1 70 MET HB2 . . 4.460 4.508 4.475 4.525 0.065 11 0 "[ . 1 . 2]" 1
2078 1 67 VAL HA 1 70 MET HB3 . . 5.030 5.080 5.060 5.114 0.084 2 0 "[ . 1 . 2]" 1
2079 1 67 VAL HA 1 70 MET ME . . 4.090 3.607 3.538 3.661 . 0 0 "[ . 1 . 2]" 1
2080 1 67 VAL HA 1 70 MET HG2 . . 3.720 3.078 3.000 3.212 . 0 0 "[ . 1 . 2]" 1
2081 1 67 VAL HA 1 70 MET HG3 . . 3.660 2.239 2.228 2.246 . 0 0 "[ . 1 . 2]" 1
2082 1 67 VAL HA 1 76 ALA MB . . 6.000 5.264 5.216 5.305 . 0 0 "[ . 1 . 2]" 1
2083 1 67 VAL HA 1 78 LEU HB3 . . 6.000 6.012 5.999 6.028 0.028 13 0 "[ . 1 . 2]" 1
2084 1 67 VAL HA 1 78 LEU QD . . 3.810 2.742 2.695 2.797 . 0 0 "[ . 1 . 2]" 1
2085 1 67 VAL HA 1 105 VAL MG2 . . 4.420 3.235 3.184 3.306 . 0 0 "[ . 1 . 2]" 1
2086 1 67 VAL HB 1 68 ALA H . . 4.150 3.917 3.881 4.012 . 0 0 "[ . 1 . 2]" 1
2087 1 67 VAL HB 1 105 VAL MG2 . . 4.570 3.515 3.451 3.576 . 0 0 "[ . 1 . 2]" 1
2088 1 67 VAL QG 1 68 ALA HA . . 3.800 3.059 3.001 3.108 . 0 0 "[ . 1 . 2]" 1
2089 1 67 VAL QG 1 68 ALA MB . . 4.450 2.906 2.886 3.007 . 0 0 "[ . 1 . 2]" 1
2090 1 67 VAL QG 1 69 GLN H . . 4.810 3.943 3.911 4.005 . 0 0 "[ . 1 . 2]" 1
2091 1 67 VAL QG 1 70 MET H . . 4.470 4.090 4.068 4.113 . 0 0 "[ . 1 . 2]" 1
2092 1 67 VAL QG 1 70 MET HB2 . . 4.390 4.154 4.081 4.191 . 0 0 "[ . 1 . 2]" 1
2093 1 67 VAL QG 1 70 MET HB3 . . 5.250 5.092 5.054 5.123 . 0 0 "[ . 1 . 2]" 1
2094 1 67 VAL QG 1 70 MET ME . . 3.380 2.818 2.733 2.866 . 0 0 "[ . 1 . 2]" 1
2095 1 67 VAL QG 1 70 MET HG3 . . 4.240 2.931 2.907 2.981 . 0 0 "[ . 1 . 2]" 1
2096 1 67 VAL QG 1 107 LEU QD . . 3.120 2.537 2.320 3.080 . 0 0 "[ . 1 . 2]" 1
2097 1 67 VAL MG1 1 68 ALA H . . 4.080 2.304 2.223 2.506 . 0 0 "[ . 1 . 2]" 1
2098 1 67 VAL MG1 1 68 ALA HA . . 4.620 3.124 3.057 3.178 . 0 0 "[ . 1 . 2]" 1
2099 1 67 VAL MG1 1 69 GLN H . . 5.620 4.195 4.163 4.293 . 0 0 "[ . 1 . 2]" 1
2100 1 67 VAL MG2 1 68 ALA H . . 4.080 4.119 4.103 4.128 0.048 10 0 "[ . 1 . 2]" 1
2101 1 67 VAL MG2 1 68 ALA HA . . 4.620 4.372 4.277 4.420 . 0 0 "[ . 1 . 2]" 1
2102 1 67 VAL MG2 1 69 GLN H . . 5.620 4.795 4.746 4.827 . 0 0 "[ . 1 . 2]" 1
2103 1 68 ALA H 1 68 ALA MB . . 2.730 2.236 2.232 2.251 . 0 0 "[ . 1 . 2]" 1
2104 1 68 ALA H 1 78 LEU QD . . 4.480 4.528 4.517 4.538 0.058 11 0 "[ . 1 . 2]" 1
2105 1 68 ALA HA 1 69 GLN H . . 3.530 3.340 3.313 3.354 . 0 0 "[ . 1 . 2]" 1
2106 1 68 ALA HA 1 70 MET H . . 3.790 3.703 3.600 3.781 . 0 0 "[ . 1 . 2]" 1
2107 1 68 ALA MB 1 69 GLN H . . 3.280 3.162 3.132 3.202 . 0 0 "[ . 1 . 2]" 1
2108 1 68 ALA MB 1 69 GLN HA . . 4.360 4.060 4.047 4.080 . 0 0 "[ . 1 . 2]" 1
2109 1 68 ALA MB 1 69 GLN HB2 . . 6.000 5.050 5.007 5.077 . 0 0 "[ . 1 . 2]" 1
2110 1 68 ALA MB 1 69 GLN HE21 . . 5.200 4.588 4.538 4.615 . 0 0 "[ . 1 . 2]" 1
2111 1 68 ALA MB 1 69 GLN HE22 . . 6.000 6.046 6.012 6.058 0.058 3 0 "[ . 1 . 2]" 1
2112 1 68 ALA MB 1 69 GLN HG2 . . 3.970 3.948 3.865 3.982 0.012 7 0 "[ . 1 . 2]" 1
2113 1 68 ALA MB 1 69 GLN HG3 . . 4.060 3.493 3.460 3.513 . 0 0 "[ . 1 . 2]" 1
2114 1 68 ALA MB 1 70 MET H . . 4.660 4.491 4.440 4.541 . 0 0 "[ . 1 . 2]" 1
2115 1 69 GLN H 1 69 GLN HB2 . . 2.950 2.595 2.570 2.616 . 0 0 "[ . 1 . 2]" 1
2116 1 69 GLN H 1 69 GLN HB3 . . 3.830 3.659 3.650 3.666 . 0 0 "[ . 1 . 2]" 1
2117 1 69 GLN H 1 69 GLN HG2 . . 3.360 3.394 3.385 3.403 0.043 11 0 "[ . 1 . 2]" 1
2118 1 69 GLN H 1 69 GLN HG3 . . 3.190 2.307 2.266 2.365 . 0 0 "[ . 1 . 2]" 1
2119 1 69 GLN H 1 70 MET H . . 2.880 2.318 2.263 2.366 . 0 0 "[ . 1 . 2]" 1
2120 1 69 GLN H 1 70 MET HA . . 5.160 4.952 4.916 4.974 . 0 0 "[ . 1 . 2]" 1
2121 1 69 GLN H 1 70 MET HB2 . . 5.480 5.367 5.267 5.449 . 0 0 "[ . 1 . 2]" 1
2122 1 69 GLN H 1 70 MET HB3 . . 5.720 5.564 5.550 5.589 . 0 0 "[ . 1 . 2]" 1
2123 1 69 GLN H 1 70 MET HG2 . . 4.930 3.337 3.313 3.382 . 0 0 "[ . 1 . 2]" 1
2124 1 69 GLN H 1 70 MET HG3 . . 3.980 3.743 3.598 3.841 . 0 0 "[ . 1 . 2]" 1
2125 1 69 GLN H 1 78 LEU QD . . 4.440 4.498 4.484 4.520 0.080 13 0 "[ . 1 . 2]" 1
2126 1 69 GLN HA 1 69 GLN HE21 . . 5.500 5.290 5.266 5.306 . 0 0 "[ . 1 . 2]" 1
2127 1 69 GLN HA 1 69 GLN HG2 . . 3.460 2.636 2.593 2.669 . 0 0 "[ . 1 . 2]" 1
2128 1 69 GLN HA 1 69 GLN HG3 . . 3.690 3.274 3.243 3.299 . 0 0 "[ . 1 . 2]" 1
2129 1 69 GLN HA 1 70 MET HA . . 4.680 4.591 4.574 4.603 . 0 0 "[ . 1 . 2]" 1
2130 1 69 GLN HA 1 70 MET HG2 . . 4.980 4.819 4.749 4.860 . 0 0 "[ . 1 . 2]" 1
2131 1 69 GLN HA 1 70 MET HG3 . . 5.770 5.670 5.539 5.738 . 0 0 "[ . 1 . 2]" 1
2132 1 69 GLN HA 1 74 GLN HE22 . . 6.000 5.941 5.821 6.010 0.010 6 0 "[ . 1 . 2]" 1
2133 1 69 GLN HB2 1 70 MET H . . 4.080 3.381 3.314 3.514 . 0 0 "[ . 1 . 2]" 1
2134 1 69 GLN HB2 1 70 MET HA . . 4.800 4.534 4.493 4.591 . 0 0 "[ . 1 . 2]" 1
2135 1 69 GLN HB2 1 70 MET HG3 . . 4.610 4.569 4.459 4.613 0.003 11 0 "[ . 1 . 2]" 1
2136 1 69 GLN HB2 1 76 ALA MB . . 4.980 4.887 4.777 4.983 0.003 6 0 "[ . 1 . 2]" 1
2137 1 69 GLN HB3 1 70 MET H . . 4.660 4.290 4.252 4.356 . 0 0 "[ . 1 . 2]" 1
2138 1 69 GLN HE21 1 69 GLN HG3 . . 3.390 2.183 2.167 2.197 . 0 0 "[ . 1 . 2]" 1
2139 1 69 GLN HE22 1 69 GLN HG2 . . 4.030 3.815 3.800 3.830 . 0 0 "[ . 1 . 2]" 1
2140 1 69 GLN HE22 1 69 GLN HG3 . . 3.890 3.459 3.452 3.465 . 0 0 "[ . 1 . 2]" 1
2141 1 69 GLN HG2 1 70 MET H . . 5.130 5.072 5.033 5.108 . 0 0 "[ . 1 . 2]" 1
2142 1 69 GLN HG3 1 70 MET H . . 4.620 4.392 4.340 4.486 . 0 0 "[ . 1 . 2]" 1
2143 1 69 GLN HG3 1 70 MET HG2 . . 4.910 4.825 4.775 4.889 . 0 0 "[ . 1 . 2]" 1
2144 1 70 MET H 1 70 MET HB2 . . 3.300 3.261 3.204 3.308 0.008 11 0 "[ . 1 . 2]" 1
2145 1 70 MET H 1 70 MET HB3 . . 4.000 3.648 3.609 3.711 . 0 0 "[ . 1 . 2]" 1
2146 1 70 MET H 1 70 MET ME . . 4.450 4.475 4.466 4.485 0.035 8 0 "[ . 1 . 2]" 1
2147 1 70 MET H 1 70 MET HG2 . . 3.330 2.308 2.208 2.495 . 0 0 "[ . 1 . 2]" 1
2148 1 70 MET H 1 70 MET HG3 . . 3.400 2.451 2.432 2.478 . 0 0 "[ . 1 . 2]" 1
2149 1 70 MET H 1 71 SER H . . 4.540 4.534 4.522 4.542 0.002 6 0 "[ . 1 . 2]" 1
2150 1 70 MET H 1 76 ALA MB . . 5.950 5.309 5.183 5.490 . 0 0 "[ . 1 . 2]" 1
2151 1 70 MET H 1 107 LEU QD . . 3.950 3.919 3.676 3.989 0.039 6 0 "[ . 1 . 2]" 1
2152 1 70 MET H 1 107 LEU HG . . 6.000 5.735 5.635 6.042 0.042 5 0 "[ . 1 . 2]" 1
2153 1 70 MET HA 1 70 MET ME . . 4.260 4.330 4.325 4.340 0.080 11 0 "[ . 1 . 2]" 1
2154 1 70 MET HA 1 70 MET HG2 . . 3.560 3.202 3.125 3.259 . 0 0 "[ . 1 . 2]" 1
2155 1 70 MET HA 1 70 MET HG3 . . 3.940 3.889 3.856 3.905 . 0 0 "[ . 1 . 2]" 1
2156 1 70 MET HA 1 71 SER H . . 2.920 2.334 2.325 2.355 . 0 0 "[ . 1 . 2]" 1
2157 1 70 MET HA 1 71 SER HB3 . . 4.730 4.550 4.526 4.626 . 0 0 "[ . 1 . 2]" 1
2158 1 70 MET HA 1 74 GLN HE21 . . 4.840 3.271 3.134 3.398 . 0 0 "[ . 1 . 2]" 1
2159 1 70 MET HA 1 74 GLN HE22 . . 4.740 2.289 2.167 2.400 . 0 0 "[ . 1 . 2]" 1
2160 1 70 MET HA 1 74 GLN HG2 . . 5.740 4.737 4.676 4.781 . 0 0 "[ . 1 . 2]" 1
2161 1 70 MET HA 1 76 ALA MB . . 5.520 4.379 4.286 4.503 . 0 0 "[ . 1 . 2]" 1
2162 1 70 MET HA 1 107 LEU QD . . 4.920 4.412 3.930 4.551 . 0 0 "[ . 1 . 2]" 1
2163 1 70 MET HB2 1 71 SER H . . 3.290 2.944 2.887 3.008 . 0 0 "[ . 1 . 2]" 1
2164 1 70 MET HB2 1 75 ARG HA . . 6.000 5.737 5.662 5.862 . 0 0 "[ . 1 . 2]" 1
2165 1 70 MET HB2 1 107 LEU QD . . 3.150 2.195 2.106 2.230 . 0 0 "[ . 1 . 2]" 1
2166 1 70 MET HB3 1 70 MET ME . . 2.840 2.484 2.453 2.526 . 0 0 "[ . 1 . 2]" 1
2167 1 70 MET HB3 1 71 SER H . . 4.610 3.037 2.955 3.099 . 0 0 "[ . 1 . 2]" 1
2168 1 70 MET HB3 1 74 GLN H . . 5.710 5.158 4.975 5.260 . 0 0 "[ . 1 . 2]" 1
2169 1 70 MET HB3 1 74 GLN HE21 . . 3.930 2.217 2.087 2.365 . 0 0 "[ . 1 . 2]" 1
2170 1 70 MET HB3 1 74 GLN HE22 . . 4.050 2.630 2.542 2.720 . 0 0 "[ . 1 . 2]" 1
2171 1 70 MET HB3 1 75 ARG HA . . 5.230 5.250 5.241 5.262 0.032 1 0 "[ . 1 . 2]" 1
2172 1 70 MET HB3 1 76 ALA H . . 4.650 4.464 4.384 4.601 . 0 0 "[ . 1 . 2]" 1
2173 1 70 MET HB3 1 76 ALA HA . . 6.000 5.771 5.633 5.967 . 0 0 "[ . 1 . 2]" 1
2174 1 70 MET HB3 1 76 ALA MB . . 3.670 3.092 2.952 3.289 . 0 0 "[ . 1 . 2]" 1
2175 1 70 MET HB3 1 107 LEU H . . 6.000 5.123 5.034 5.199 . 0 0 "[ . 1 . 2]" 1
2176 1 70 MET HB3 1 107 LEU QD . . 3.680 3.654 3.455 3.705 0.025 3 0 "[ . 1 . 2]" 1
2177 1 70 MET ME 1 70 MET HG3 . . 3.590 2.605 2.593 2.617 . 0 0 "[ . 1 . 2]" 1
2178 1 70 MET ME 1 71 SER H . . 4.320 4.337 4.327 4.343 0.023 16 0 "[ . 1 . 2]" 1
2179 1 70 MET ME 1 74 GLN HA . . 5.130 4.854 4.807 4.875 . 0 0 "[ . 1 . 2]" 1
2180 1 70 MET ME 1 74 GLN HE21 . . 4.720 3.674 3.609 3.741 . 0 0 "[ . 1 . 2]" 1
2181 1 70 MET ME 1 74 GLN HE22 . . 4.770 4.657 4.622 4.680 . 0 0 "[ . 1 . 2]" 1
2182 1 70 MET ME 1 74 GLN HG2 . . 4.150 4.148 4.081 4.173 0.023 8 0 "[ . 1 . 2]" 1
2183 1 70 MET ME 1 75 ARG HA . . 3.650 3.006 2.965 3.058 . 0 0 "[ . 1 . 2]" 1
2184 1 70 MET ME 1 76 ALA H . . 3.290 2.520 2.411 2.645 . 0 0 "[ . 1 . 2]" 1
2185 1 70 MET ME 1 76 ALA HA . . 5.100 4.868 4.745 4.988 . 0 0 "[ . 1 . 2]" 1
2186 1 70 MET ME 1 76 ALA MB . . 3.280 3.189 3.065 3.284 0.004 2 0 "[ . 1 . 2]" 1
2187 1 70 MET ME 1 105 VAL H . . 4.830 4.067 3.994 4.129 . 0 0 "[ . 1 . 2]" 1
2188 1 70 MET ME 1 105 VAL MG2 . . 2.950 2.039 2.027 2.049 . 0 0 "[ . 1 . 2]" 1
2189 1 70 MET ME 1 106 GLU H . . 4.650 3.773 3.736 3.847 . 0 0 "[ . 1 . 2]" 1
2190 1 70 MET ME 1 106 GLU HA . . 3.510 2.500 2.466 2.563 . 0 0 "[ . 1 . 2]" 1
2191 1 70 MET ME 1 107 LEU H . . 3.130 2.513 2.476 2.584 . 0 0 "[ . 1 . 2]" 1
2192 1 70 MET ME 1 107 LEU HB2 . . 3.650 2.524 2.492 2.566 . 0 0 "[ . 1 . 2]" 1
2193 1 70 MET ME 1 107 LEU HB3 . . 4.460 3.997 3.964 4.044 . 0 0 "[ . 1 . 2]" 1
2194 1 70 MET HG2 1 71 SER H . . 5.000 4.966 4.932 4.985 . 0 0 "[ . 1 . 2]" 1
2195 1 70 MET HG2 1 74 GLN HE21 . . 4.470 4.153 4.038 4.208 . 0 0 "[ . 1 . 2]" 1
2196 1 70 MET HG2 1 74 GLN HE22 . . 4.440 3.993 3.829 4.161 . 0 0 "[ . 1 . 2]" 1
2197 1 70 MET HG2 1 76 ALA MB . . 3.670 3.486 3.440 3.511 . 0 0 "[ . 1 . 2]" 1
2198 1 70 MET HG3 1 71 SER H . . 5.170 4.962 4.910 5.012 . 0 0 "[ . 1 . 2]" 1
2199 1 70 MET HG3 1 74 GLN HE21 . . 5.400 5.033 4.979 5.075 . 0 0 "[ . 1 . 2]" 1
2200 1 70 MET HG3 1 74 GLN HE22 . . 5.420 5.156 5.105 5.234 . 0 0 "[ . 1 . 2]" 1
2201 1 70 MET HG3 1 76 ALA MB . . 4.390 4.370 4.281 4.397 0.007 1 0 "[ . 1 . 2]" 1
2202 1 70 MET HG3 1 78 LEU HG . . 6.000 5.843 5.684 5.913 . 0 0 "[ . 1 . 2]" 1
2203 1 70 MET HG3 1 105 VAL MG2 . . 4.170 3.673 3.633 3.732 . 0 0 "[ . 1 . 2]" 1
2204 1 70 MET HG3 1 107 LEU H . . 6.000 5.712 5.661 5.802 . 0 0 "[ . 1 . 2]" 1
2205 1 70 MET HG3 1 107 LEU QD . . 4.070 2.847 2.679 3.172 . 0 0 "[ . 1 . 2]" 1
2206 1 71 SER H 1 71 SER HB2 . . 3.990 3.685 3.670 3.690 . 0 0 "[ . 1 . 2]" 1
2207 1 71 SER H 1 71 SER HB3 . . 3.660 3.141 3.103 3.235 . 0 0 "[ . 1 . 2]" 1
2208 1 71 SER H 1 71 SER HG . . 3.260 2.956 2.718 3.159 . 0 0 "[ . 1 . 2]" 1
2209 1 71 SER H 1 72 VAL H . . 4.620 4.519 4.484 4.530 . 0 0 "[ . 1 . 2]" 1
2210 1 71 SER H 1 74 GLN H . . 4.240 4.198 4.159 4.250 0.010 7 0 "[ . 1 . 2]" 1
2211 1 71 SER H 1 74 GLN HA . . 5.000 5.030 5.011 5.044 0.044 7 0 "[ . 1 . 2]" 1
2212 1 71 SER H 1 74 GLN QB . . 3.070 2.282 2.271 2.292 . 0 0 "[ . 1 . 2]" 1
2213 1 71 SER H 1 74 GLN HE21 . . 5.180 3.941 3.719 4.091 . 0 0 "[ . 1 . 2]" 1
2214 1 71 SER H 1 74 GLN HE22 . . 4.210 3.604 3.394 3.734 . 0 0 "[ . 1 . 2]" 1
2215 1 71 SER H 1 74 GLN HG2 . . 4.560 4.275 4.212 4.340 . 0 0 "[ . 1 . 2]" 1
2216 1 71 SER H 1 74 GLN HG3 . . 5.280 4.084 4.069 4.098 . 0 0 "[ . 1 . 2]" 1
2217 1 71 SER H 1 76 ALA MB . . 5.500 5.325 5.219 5.455 . 0 0 "[ . 1 . 2]" 1
2218 1 71 SER H 1 107 LEU HB2 . . 5.600 4.476 4.439 4.562 . 0 0 "[ . 1 . 2]" 1
2219 1 71 SER H 1 107 LEU HB3 . . 5.670 5.089 5.046 5.190 . 0 0 "[ . 1 . 2]" 1
2220 1 71 SER H 1 107 LEU MD1 . . 5.700 4.908 3.016 5.426 . 0 0 "[ . 1 . 2]" 1
2221 1 71 SER H 1 107 LEU QD . . 4.210 3.885 2.999 4.137 . 0 0 "[ . 1 . 2]" 1
2222 1 71 SER H 1 107 LEU MD2 . . 5.700 4.472 4.220 5.342 . 0 0 "[ . 1 . 2]" 1
2223 1 71 SER HA 1 72 VAL H . . 2.970 2.424 2.262 2.475 . 0 0 "[ . 1 . 2]" 1
2224 1 71 SER HA 1 72 VAL HA . . 5.050 4.333 4.309 4.342 . 0 0 "[ . 1 . 2]" 1
2225 1 71 SER HA 1 72 VAL HB . . 5.130 4.906 4.779 4.948 . 0 0 "[ . 1 . 2]" 1
2226 1 71 SER HA 1 72 VAL MG2 . . 4.190 3.831 3.728 3.859 . 0 0 "[ . 1 . 2]" 1
2227 1 71 SER HA 1 107 LEU QD . . 5.070 3.386 2.502 3.696 . 0 0 "[ . 1 . 2]" 1
2228 1 71 SER HB2 1 72 VAL H . . 3.230 2.469 2.381 2.788 . 0 0 "[ . 1 . 2]" 1
2229 1 71 SER HB2 1 72 VAL HA . . 6.000 4.803 4.764 4.911 . 0 0 "[ . 1 . 2]" 1
2230 1 71 SER HB2 1 72 VAL HB . . 5.270 4.119 4.111 4.148 . 0 0 "[ . 1 . 2]" 1
2231 1 71 SER HB2 1 72 VAL MG1 . . 5.860 5.257 5.251 5.268 . 0 0 "[ . 1 . 2]" 1
2232 1 71 SER HB2 1 72 VAL MG2 . . 5.110 4.291 4.225 4.412 . 0 0 "[ . 1 . 2]" 1
2233 1 71 SER HB2 1 107 LEU QD . . 5.920 4.758 4.085 4.979 . 0 0 "[ . 1 . 2]" 1
2234 1 71 SER HB2 1 110 LEU QD . . 5.920 5.845 5.739 5.925 0.005 2 0 "[ . 1 . 2]" 1
2235 1 71 SER HB3 1 72 VAL H . . 3.940 3.702 3.671 3.800 . 0 0 "[ . 1 . 2]" 1
2236 1 71 SER HB3 1 72 VAL HA . . 6.000 6.009 5.981 6.056 0.056 8 0 "[ . 1 . 2]" 1
2237 1 71 SER HB3 1 72 VAL HB . . 5.830 5.751 5.676 5.776 . 0 0 "[ . 1 . 2]" 1
2238 1 71 SER HB3 1 72 VAL MG2 . . 5.590 5.298 5.228 5.324 . 0 0 "[ . 1 . 2]" 1
2239 1 71 SER HB3 1 107 LEU QD . . 5.920 5.077 4.262 5.348 . 0 0 "[ . 1 . 2]" 1
2240 1 71 SER HG 1 72 VAL H . . 4.370 3.874 3.749 4.283 . 0 0 "[ . 1 . 2]" 1
2241 1 71 SER HG 1 74 GLN H . . 4.640 4.115 3.893 4.492 . 0 0 "[ . 1 . 2]" 1
2242 1 71 SER HG 1 74 GLN HE22 . . 6.000 5.781 5.456 5.934 . 0 0 "[ . 1 . 2]" 1
2243 1 71 SER HG 1 74 GLN HG2 . . 6.000 5.284 4.979 5.492 . 0 0 "[ . 1 . 2]" 1
2244 1 72 VAL H 1 72 VAL HB . . 2.930 2.496 2.463 2.596 . 0 0 "[ . 1 . 2]" 1
2245 1 72 VAL H 1 72 VAL MG1 . . 3.920 3.782 3.766 3.800 . 0 0 "[ . 1 . 2]" 1
2246 1 72 VAL H 1 72 VAL MG2 . . 2.790 2.160 2.029 2.213 . 0 0 "[ . 1 . 2]" 1
2247 1 72 VAL H 1 73 GLY H . . 4.580 4.514 4.454 4.532 . 0 0 "[ . 1 . 2]" 1
2248 1 72 VAL H 1 74 GLN H . . 4.770 4.710 4.686 4.753 . 0 0 "[ . 1 . 2]" 1
2249 1 72 VAL H 1 74 GLN QB . . 4.880 4.743 4.682 4.832 . 0 0 "[ . 1 . 2]" 1
2250 1 72 VAL H 1 107 LEU HB2 . . 5.520 5.262 5.011 5.362 . 0 0 "[ . 1 . 2]" 1
2251 1 72 VAL H 1 107 LEU HB3 . . 5.900 4.400 4.151 4.519 . 0 0 "[ . 1 . 2]" 1
2252 1 72 VAL H 1 107 LEU MD1 . . 4.720 3.299 2.797 3.484 . 0 0 "[ . 1 . 2]" 1
2253 1 72 VAL H 1 107 LEU QD . . 3.800 3.188 2.547 3.398 . 0 0 "[ . 1 . 2]" 1
2254 1 72 VAL H 1 107 LEU MD2 . . 4.720 4.364 2.925 4.726 0.006 4 0 "[ . 1 . 2]" 1
2255 1 72 VAL H 1 107 LEU HG . . 5.150 3.765 3.373 5.281 0.131 5 0 "[ . 1 . 2]" 1
2256 1 72 VAL H 1 110 LEU QD . . 4.980 4.137 3.933 4.289 . 0 0 "[ . 1 . 2]" 1
2257 1 72 VAL HA 1 72 VAL MG1 . . 3.130 2.528 2.490 2.536 . 0 0 "[ . 1 . 2]" 1
2258 1 72 VAL HA 1 72 VAL MG2 . . 3.190 2.361 2.351 2.408 . 0 0 "[ . 1 . 2]" 1
2259 1 72 VAL HA 1 73 GLY H . . 2.740 2.129 2.121 2.134 . 0 0 "[ . 1 . 2]" 1
2260 1 72 VAL HA 1 73 GLY HA2 . . 4.510 4.385 4.370 4.390 . 0 0 "[ . 1 . 2]" 1
2261 1 72 VAL HA 1 73 GLY HA3 . . 4.560 4.418 4.408 4.423 . 0 0 "[ . 1 . 2]" 1
2262 1 72 VAL HA 1 74 GLN H . . 3.560 3.447 3.425 3.485 . 0 0 "[ . 1 . 2]" 1
2263 1 72 VAL HA 1 107 LEU H . . 5.390 5.245 5.153 5.291 . 0 0 "[ . 1 . 2]" 1
2264 1 72 VAL HA 1 107 LEU HA . . 5.470 4.405 4.383 4.437 . 0 0 "[ . 1 . 2]" 1
2265 1 72 VAL HA 1 107 LEU HB2 . . 4.170 3.664 3.535 3.710 . 0 0 "[ . 1 . 2]" 1
2266 1 72 VAL HA 1 107 LEU HB3 . . 4.210 2.187 1.999 2.263 . 0 0 "[ . 1 . 2]" 1
2267 1 72 VAL HA 1 107 LEU MD1 . . 3.910 2.219 1.998 2.882 . 0 0 "[ . 1 . 2]" 1
2268 1 72 VAL HA 1 107 LEU QD . . 3.080 2.029 1.948 2.059 . 0 0 "[ . 1 . 2]" 1
2269 1 72 VAL HA 1 107 LEU MD2 . . 3.910 3.546 1.981 3.947 0.037 14 0 "[ . 1 . 2]" 1
2270 1 72 VAL HA 1 107 LEU HG . . 3.930 2.808 2.401 4.039 0.109 8 0 "[ . 1 . 2]" 1
2271 1 72 VAL HA 1 110 LEU QD . . 5.080 4.149 3.621 4.252 . 0 0 "[ . 1 . 2]" 1
2272 1 72 VAL HB 1 73 GLY H . . 4.450 4.335 4.304 4.375 . 0 0 "[ . 1 . 2]" 1
2273 1 72 VAL HB 1 110 LEU QD . . 4.760 4.305 3.764 4.459 . 0 0 "[ . 1 . 2]" 1
2274 1 72 VAL MG1 1 73 GLY H . . 3.020 2.848 2.817 2.938 . 0 0 "[ . 1 . 2]" 1
2275 1 72 VAL MG1 1 73 GLY HA2 . . 3.810 3.730 3.719 3.755 . 0 0 "[ . 1 . 2]" 1
2276 1 72 VAL MG1 1 73 GLY HA3 . . 4.330 3.360 3.346 3.417 . 0 0 "[ . 1 . 2]" 1
2277 1 72 VAL MG1 1 110 LEU H . . 4.520 4.396 4.006 4.492 . 0 0 "[ . 1 . 2]" 1
2278 1 72 VAL MG2 1 73 GLY H . . 3.980 3.945 3.921 4.009 0.029 7 0 "[ . 1 . 2]" 1
2279 1 72 VAL MG2 1 110 LEU H . . 3.920 3.937 3.784 3.957 0.037 2 0 "[ . 1 . 2]" 1
2280 1 72 VAL MG2 1 110 LEU QD . . 2.560 2.154 1.703 2.276 . 0 0 "[ . 1 . 2]" 1
2281 1 72 VAL MG2 1 110 LEU HG . . 2.960 2.486 2.361 3.379 0.419 7 0 "[ . 1 . 2]" 1
2282 1 73 GLY H 1 74 GLN H . . 3.020 2.426 2.351 2.452 . 0 0 "[ . 1 . 2]" 1
2283 1 73 GLY H 1 107 LEU H . . 4.560 4.212 4.091 4.268 . 0 0 "[ . 1 . 2]" 1
2284 1 73 GLY H 1 107 LEU HA . . 5.260 4.167 4.096 4.184 . 0 0 "[ . 1 . 2]" 1
2285 1 73 GLY H 1 107 LEU HB2 . . 3.730 3.378 3.263 3.429 . 0 0 "[ . 1 . 2]" 1
2286 1 73 GLY H 1 107 LEU HB3 . . 4.100 1.759 1.673 1.801 . 0 0 "[ . 1 . 2]" 1
2287 1 73 GLY H 1 107 LEU MD1 . . 4.890 3.184 2.897 3.830 . 0 0 "[ . 1 . 2]" 1
2288 1 73 GLY H 1 107 LEU QD . . 3.750 2.987 2.864 3.013 . 0 0 "[ . 1 . 2]" 1
2289 1 73 GLY H 1 107 LEU MD2 . . 4.890 4.296 3.108 4.604 . 0 0 "[ . 1 . 2]" 1
2290 1 73 GLY H 1 107 LEU HG . . 4.900 3.926 3.601 4.739 . 0 0 "[ . 1 . 2]" 1
2291 1 73 GLY H 1 108 LEU HA . . 4.340 4.021 3.963 4.100 . 0 0 "[ . 1 . 2]" 1
2292 1 73 GLY HA2 1 74 GLN H . . 3.330 3.256 3.236 3.271 . 0 0 "[ . 1 . 2]" 1
2293 1 73 GLY HA2 1 74 GLN QB . . 5.140 5.039 5.015 5.053 . 0 0 "[ . 1 . 2]" 1
2294 1 73 GLY HA2 1 108 LEU HA . . 4.200 3.965 3.819 4.034 . 0 0 "[ . 1 . 2]" 1
2295 1 73 GLY HA3 1 74 GLN H . . 3.460 3.335 3.326 3.350 . 0 0 "[ . 1 . 2]" 1
2296 1 73 GLY HA3 1 74 GLN QB . . 4.790 4.700 4.684 4.710 . 0 0 "[ . 1 . 2]" 1
2297 1 73 GLY HA3 1 107 LEU HB2 . . 5.730 5.659 5.619 5.685 . 0 0 "[ . 1 . 2]" 1
2298 1 74 GLN H 1 74 GLN QB . . 2.690 2.355 2.349 2.360 . 0 0 "[ . 1 . 2]" 1
2299 1 74 GLN H 1 74 GLN HE21 . . 6.000 5.708 5.632 5.752 . 0 0 "[ . 1 . 2]" 1
2300 1 74 GLN H 1 74 GLN HG2 . . 4.610 4.555 4.549 4.567 . 0 0 "[ . 1 . 2]" 1
2301 1 74 GLN H 1 74 GLN HG3 . . 4.690 4.481 4.465 4.493 . 0 0 "[ . 1 . 2]" 1
2302 1 74 GLN H 1 75 ARG HA . . 5.490 5.242 5.225 5.262 . 0 0 "[ . 1 . 2]" 1
2303 1 74 GLN H 1 106 GLU HA . . 5.640 5.426 5.323 5.470 . 0 0 "[ . 1 . 2]" 1
2304 1 74 GLN H 1 107 LEU HB3 . . 4.100 2.300 2.158 2.575 . 0 0 "[ . 1 . 2]" 1
2305 1 74 GLN H 1 107 LEU QD . . 4.840 3.724 3.243 3.860 . 0 0 "[ . 1 . 2]" 1
2306 1 74 GLN H 1 107 LEU HG . . 5.110 3.963 3.604 5.107 . 0 0 "[ . 1 . 2]" 1
2307 1 74 GLN HA 1 74 GLN HE21 . . 5.180 4.761 4.750 4.777 . 0 0 "[ . 1 . 2]" 1
2308 1 74 GLN HA 1 74 GLN HE22 . . 6.000 5.893 5.887 5.898 . 0 0 "[ . 1 . 2]" 1
2309 1 74 GLN HA 1 74 GLN HG2 . . 3.820 2.754 2.739 2.778 . 0 0 "[ . 1 . 2]" 1
2310 1 74 GLN HA 1 74 GLN HG3 . . 3.940 2.554 2.536 2.565 . 0 0 "[ . 1 . 2]" 1
2311 1 74 GLN HA 1 75 ARG H . . 2.840 2.179 2.170 2.214 . 0 0 "[ . 1 . 2]" 1
2312 1 74 GLN HA 1 75 ARG HA . . 4.990 4.410 4.407 4.422 . 0 0 "[ . 1 . 2]" 1
2313 1 74 GLN HA 1 75 ARG HB2 . . 4.650 4.201 4.180 4.216 . 0 0 "[ . 1 . 2]" 1
2314 1 74 GLN HA 1 75 ARG HB3 . . 5.740 4.789 4.771 4.806 . 0 0 "[ . 1 . 2]" 1
2315 1 74 GLN HA 1 76 ALA H . . 5.870 5.705 5.671 5.771 . 0 0 "[ . 1 . 2]" 1
2316 1 74 GLN HA 1 76 ALA MB . . 5.820 5.446 5.421 5.496 . 0 0 "[ . 1 . 2]" 1
2317 1 74 GLN QB 1 74 GLN HE22 . . 4.970 3.664 3.631 3.682 . 0 0 "[ . 1 . 2]" 1
2318 1 74 GLN QB 1 75 ARG H . . 3.980 3.491 3.438 3.519 . 0 0 "[ . 1 . 2]" 1
2319 1 74 GLN QB 1 75 ARG HA . . 5.500 4.366 4.308 4.391 . 0 0 "[ . 1 . 2]" 1
2320 1 74 GLN QB 1 76 ALA MB . . 4.800 4.097 4.073 4.121 . 0 0 "[ . 1 . 2]" 1
2321 1 74 GLN QB 1 107 LEU HG . . 5.190 4.200 3.911 5.236 0.046 1 0 "[ . 1 . 2]" 1
2322 1 74 GLN HE21 1 75 ARG H . . 5.100 4.248 4.166 4.297 . 0 0 "[ . 1 . 2]" 1
2323 1 74 GLN HE21 1 76 ALA H . . 5.910 4.127 4.039 4.249 . 0 0 "[ . 1 . 2]" 1
2324 1 74 GLN HE21 1 76 ALA HA . . 5.080 4.384 4.317 4.476 . 0 0 "[ . 1 . 2]" 1
2325 1 74 GLN HE21 1 76 ALA MB . . 3.910 1.984 1.953 2.090 . 0 0 "[ . 1 . 2]" 1
2326 1 74 GLN HE22 1 75 ARG H . . 6.000 5.769 5.690 5.814 . 0 0 "[ . 1 . 2]" 1
2327 1 74 GLN HE22 1 76 ALA H . . 6.000 5.730 5.643 5.869 . 0 0 "[ . 1 . 2]" 1
2328 1 74 GLN HE22 1 76 ALA HA . . 6.000 5.718 5.646 5.796 . 0 0 "[ . 1 . 2]" 1
2329 1 74 GLN HE22 1 76 ALA MB . . 4.080 3.092 3.033 3.184 . 0 0 "[ . 1 . 2]" 1
2330 1 74 GLN HG2 1 75 ARG H . . 3.590 2.386 2.316 2.427 . 0 0 "[ . 1 . 2]" 1
2331 1 74 GLN HG2 1 75 ARG HA . . 4.680 4.224 4.195 4.235 . 0 0 "[ . 1 . 2]" 1
2332 1 74 GLN HG2 1 76 ALA H . . 4.770 4.391 4.317 4.468 . 0 0 "[ . 1 . 2]" 1
2333 1 74 GLN HG2 1 76 ALA HA . . 6.000 4.822 4.779 4.858 . 0 0 "[ . 1 . 2]" 1
2334 1 74 GLN HG2 1 76 ALA MB . . 4.140 3.242 3.204 3.291 . 0 0 "[ . 1 . 2]" 1
2335 1 74 GLN HG2 1 106 GLU HA . . 6.000 6.025 6.002 6.037 0.037 6 0 "[ . 1 . 2]" 1
2336 1 74 GLN HG2 1 107 LEU H . . 5.950 5.558 5.525 5.623 . 0 0 "[ . 1 . 2]" 1
2337 1 74 GLN HG3 1 75 ARG H . . 4.220 3.282 3.226 3.310 . 0 0 "[ . 1 . 2]" 1
2338 1 74 GLN HG3 1 76 ALA MB . . 5.000 4.670 4.628 4.728 . 0 0 "[ . 1 . 2]" 1
2339 1 75 ARG H 1 75 ARG HB2 . . 3.540 2.829 2.812 2.858 . 0 0 "[ . 1 . 2]" 1
2340 1 75 ARG H 1 75 ARG HB3 . . 3.350 2.829 2.808 2.860 . 0 0 "[ . 1 . 2]" 1
2341 1 75 ARG H 1 75 ARG HG3 . . 5.120 4.816 4.804 4.839 . 0 0 "[ . 1 . 2]" 1
2342 1 75 ARG H 1 76 ALA H . . 4.460 4.129 4.079 4.160 . 0 0 "[ . 1 . 2]" 1
2343 1 75 ARG H 1 76 ALA MB . . 4.770 4.314 4.266 4.347 . 0 0 "[ . 1 . 2]" 1
2344 1 75 ARG H 1 106 GLU HA . . 5.260 4.996 4.976 5.011 . 0 0 "[ . 1 . 2]" 1
2345 1 75 ARG HA 1 75 ARG HD2 . . 5.190 4.617 4.593 4.630 . 0 0 "[ . 1 . 2]" 1
2346 1 75 ARG HA 1 75 ARG HD3 . . 5.400 4.017 3.956 4.058 . 0 0 "[ . 1 . 2]" 1
2347 1 75 ARG HA 1 75 ARG HE . . 5.760 4.736 4.714 4.759 . 0 0 "[ . 1 . 2]" 1
2348 1 75 ARG HA 1 75 ARG HG2 . . 4.010 2.311 2.289 2.328 . 0 0 "[ . 1 . 2]" 1
2349 1 75 ARG HA 1 76 ALA H . . 2.920 2.155 2.147 2.162 . 0 0 "[ . 1 . 2]" 1
2350 1 75 ARG HA 1 76 ALA HA . . 4.840 4.406 4.400 4.412 . 0 0 "[ . 1 . 2]" 1
2351 1 75 ARG HA 1 76 ALA MB . . 4.500 4.057 4.048 4.080 . 0 0 "[ . 1 . 2]" 1
2352 1 75 ARG HA 1 105 VAL H . . 5.770 5.671 5.569 5.720 . 0 0 "[ . 1 . 2]" 1
2353 1 75 ARG HA 1 105 VAL HA . . 6.000 6.003 5.944 6.020 0.020 14 0 "[ . 1 . 2]" 1
2354 1 75 ARG HA 1 105 VAL MG2 . . 4.930 4.771 4.695 4.799 . 0 0 "[ . 1 . 2]" 1
2355 1 75 ARG HA 1 106 GLU H . . 5.140 5.105 5.080 5.128 . 0 0 "[ . 1 . 2]" 1
2356 1 75 ARG HA 1 106 GLU HA . . 3.390 2.366 2.337 2.393 . 0 0 "[ . 1 . 2]" 1
2357 1 75 ARG HA 1 106 GLU HB2 . . 4.870 3.761 3.697 3.828 . 0 0 "[ . 1 . 2]" 1
2358 1 75 ARG HA 1 106 GLU HB3 . . 4.490 3.337 3.275 3.389 . 0 0 "[ . 1 . 2]" 1
2359 1 75 ARG HA 1 106 GLU HG2 . . 6.000 5.517 5.471 5.558 . 0 0 "[ . 1 . 2]" 1
2360 1 75 ARG HA 1 106 GLU HG3 . . 5.820 5.784 5.734 5.831 0.011 6 0 "[ . 1 . 2]" 1
2361 1 75 ARG HA 1 107 LEU H . . 3.660 3.370 3.311 3.494 . 0 0 "[ . 1 . 2]" 1
2362 1 75 ARG HB2 1 75 ARG HD2 . . 3.710 3.184 3.160 3.213 . 0 0 "[ . 1 . 2]" 1
2363 1 75 ARG HB2 1 76 ALA H . . 5.060 4.544 4.536 4.551 . 0 0 "[ . 1 . 2]" 1
2364 1 75 ARG HB2 1 106 GLU HA . . 4.650 4.094 4.066 4.114 . 0 0 "[ . 1 . 2]" 1
2365 1 75 ARG HB3 1 75 ARG HD2 . . 3.840 2.467 2.439 2.487 . 0 0 "[ . 1 . 2]" 1
2366 1 75 ARG HB3 1 75 ARG HD3 . . 3.680 2.357 2.342 2.382 . 0 0 "[ . 1 . 2]" 1
2367 1 75 ARG HB3 1 75 ARG HE . . 5.090 4.353 4.347 4.362 . 0 0 "[ . 1 . 2]" 1
2368 1 75 ARG HB3 1 76 ALA H . . 4.970 4.257 4.242 4.276 . 0 0 "[ . 1 . 2]" 1
2369 1 75 ARG HB3 1 76 ALA HA . . 5.710 4.636 4.624 4.655 . 0 0 "[ . 1 . 2]" 1
2370 1 75 ARG HB3 1 106 GLU HA . . 5.250 5.059 5.042 5.078 . 0 0 "[ . 1 . 2]" 1
2371 1 75 ARG HD2 1 106 GLU HA . . 6.000 6.013 6.005 6.023 0.023 8 0 "[ . 1 . 2]" 1
2372 1 75 ARG HD3 1 76 ALA H . . 4.560 4.462 4.341 4.562 0.002 5 0 "[ . 1 . 2]" 1
2373 1 75 ARG HD3 1 106 GLU HA . . 5.770 5.672 5.614 5.729 . 0 0 "[ . 1 . 2]" 1
2374 1 75 ARG HE 1 75 ARG HG2 . . 4.060 2.430 2.419 2.447 . 0 0 "[ . 1 . 2]" 1
2375 1 75 ARG HE 1 76 ALA H . . 5.550 5.197 5.148 5.248 . 0 0 "[ . 1 . 2]" 1
2376 1 75 ARG HE 1 76 ALA HA . . 5.950 5.958 5.957 5.959 0.009 12 0 "[ . 1 . 2]" 1
2377 1 75 ARG HE 1 105 VAL H . . 5.980 5.615 5.548 5.736 . 0 0 "[ . 1 . 2]" 1
2378 1 75 ARG HG2 1 76 ALA H . . 3.400 3.224 3.185 3.259 . 0 0 "[ . 1 . 2]" 1
2379 1 75 ARG HG2 1 106 GLU HA . . 4.710 3.285 3.244 3.337 . 0 0 "[ . 1 . 2]" 1
2380 1 75 ARG HG3 1 76 ALA H . . 4.780 4.778 4.748 4.790 0.010 8 0 "[ . 1 . 2]" 1
2381 1 76 ALA H 1 76 ALA MB . . 3.240 2.579 2.560 2.589 . 0 0 "[ . 1 . 2]" 1
2382 1 76 ALA H 1 105 VAL H . . 4.550 4.372 4.278 4.436 . 0 0 "[ . 1 . 2]" 1
2383 1 76 ALA H 1 105 VAL MG2 . . 4.240 3.702 3.651 3.730 . 0 0 "[ . 1 . 2]" 1
2384 1 76 ALA H 1 106 GLU HA . . 3.710 3.435 3.374 3.527 . 0 0 "[ . 1 . 2]" 1
2385 1 76 ALA H 1 106 GLU HB2 . . 5.830 5.534 5.465 5.617 . 0 0 "[ . 1 . 2]" 1
2386 1 76 ALA H 1 106 GLU HB3 . . 5.580 4.739 4.656 4.808 . 0 0 "[ . 1 . 2]" 1
2387 1 76 ALA H 1 107 LEU H . . 4.690 4.512 4.447 4.656 . 0 0 "[ . 1 . 2]" 1
2388 1 76 ALA MB 1 78 LEU HA . . 5.090 5.016 4.974 5.055 . 0 0 "[ . 1 . 2]" 1
2389 1 76 ALA MB 1 105 VAL H . . 5.150 4.833 4.782 4.886 . 0 0 "[ . 1 . 2]" 1
2390 1 76 ALA MB 1 107 LEU H . . 5.810 5.609 5.545 5.713 . 0 0 "[ . 1 . 2]" 1
2391 1 78 LEU H 1 78 LEU HB2 . . 3.300 3.072 2.957 3.132 . 0 0 "[ . 1 . 2]" 1
2392 1 78 LEU H 1 78 LEU HB3 . . 4.150 3.739 3.716 3.758 . 0 0 "[ . 1 . 2]" 1
2393 1 78 LEU H 1 78 LEU QD . . 3.390 2.079 1.968 2.131 . 0 0 "[ . 1 . 2]" 1
2394 1 78 LEU H 1 78 LEU HG . . 3.380 2.521 2.440 2.639 . 0 0 "[ . 1 . 2]" 1
2395 1 78 LEU H 1 79 THR H . . 4.600 4.406 4.362 4.478 . 0 0 "[ . 1 . 2]" 1
2396 1 78 LEU H 1 103 PHE H . . 4.100 3.677 3.624 3.815 . 0 0 "[ . 1 . 2]" 1
2397 1 78 LEU H 1 103 PHE HA . . 5.400 5.065 5.028 5.104 . 0 0 "[ . 1 . 2]" 1
2398 1 78 LEU H 1 103 PHE HB2 . . 4.370 4.043 3.994 4.095 . 0 0 "[ . 1 . 2]" 1
2399 1 78 LEU H 1 103 PHE HB3 . . 4.880 4.717 4.649 4.760 . 0 0 "[ . 1 . 2]" 1
2400 1 78 LEU H 1 103 PHE QD . . 6.000 5.602 5.574 5.651 . 0 0 "[ . 1 . 2]" 1
2401 1 78 LEU H 1 104 ASP HA . . 3.170 3.000 2.959 3.046 . 0 0 "[ . 1 . 2]" 1
2402 1 78 LEU H 1 104 ASP HB3 . . 6.000 5.880 5.830 5.929 . 0 0 "[ . 1 . 2]" 1
2403 1 78 LEU H 1 105 VAL H . . 3.720 3.716 3.664 3.730 0.010 4 0 "[ . 1 . 2]" 1
2404 1 78 LEU H 1 105 VAL MG1 . . 5.020 4.730 4.683 4.803 . 0 0 "[ . 1 . 2]" 1
2405 1 78 LEU HA 1 78 LEU MD1 . . 4.130 3.745 3.697 3.767 . 0 0 "[ . 1 . 2]" 1
2406 1 78 LEU HA 1 78 LEU MD2 . . 4.130 3.627 3.576 3.697 . 0 0 "[ . 1 . 2]" 1
2407 1 78 LEU HA 1 78 LEU HG . . 3.780 3.017 2.910 3.056 . 0 0 "[ . 1 . 2]" 1
2408 1 78 LEU HA 1 79 THR H . . 2.720 2.123 2.090 2.162 . 0 0 "[ . 1 . 2]" 1
2409 1 78 LEU HA 1 79 THR HA . . 4.720 4.386 4.379 4.402 . 0 0 "[ . 1 . 2]" 1
2410 1 78 LEU HA 1 79 THR HB . . 4.810 4.757 4.517 4.807 . 0 0 "[ . 1 . 2]" 1
2411 1 78 LEU HA 1 79 THR MG . . 5.670 5.424 5.415 5.444 . 0 0 "[ . 1 . 2]" 1
2412 1 78 LEU HA 1 103 PHE H . . 5.230 5.134 5.090 5.190 . 0 0 "[ . 1 . 2]" 1
2413 1 78 LEU HA 1 103 PHE HB2 . . 5.640 5.606 5.541 5.662 0.022 13 0 "[ . 1 . 2]" 1
2414 1 78 LEU HB2 1 78 LEU QD . . 2.920 2.077 2.064 2.091 . 0 0 "[ . 1 . 2]" 1
2415 1 78 LEU HB2 1 79 THR H . . 4.120 3.748 3.660 3.800 . 0 0 "[ . 1 . 2]" 1
2416 1 78 LEU HB2 1 79 THR HA . . 4.880 4.597 4.525 4.646 . 0 0 "[ . 1 . 2]" 1
2417 1 78 LEU HB2 1 80 ILE MD . . 2.980 2.251 2.206 2.282 . 0 0 "[ . 1 . 2]" 1
2418 1 78 LEU HB2 1 103 PHE H . . 4.440 4.084 3.903 4.186 . 0 0 "[ . 1 . 2]" 1
2419 1 78 LEU HB2 1 103 PHE HA . . 5.930 5.841 5.709 5.897 . 0 0 "[ . 1 . 2]" 1
2420 1 78 LEU HB2 1 103 PHE HB2 . . 3.910 3.237 3.164 3.270 . 0 0 "[ . 1 . 2]" 1
2421 1 78 LEU HB2 1 103 PHE HB3 . . 4.570 4.544 4.447 4.575 0.005 16 0 "[ . 1 . 2]" 1
2422 1 78 LEU HB2 1 103 PHE QD . . 4.950 4.492 4.469 4.548 . 0 0 "[ . 1 . 2]" 1
2423 1 78 LEU HB3 1 78 LEU QD . . 2.770 2.136 2.123 2.158 . 0 0 "[ . 1 . 2]" 1
2424 1 78 LEU HB3 1 79 THR H . . 3.720 3.374 3.205 3.488 . 0 0 "[ . 1 . 2]" 1
2425 1 78 LEU HB3 1 80 ILE HA . . 6.000 5.870 5.749 5.938 . 0 0 "[ . 1 . 2]" 1
2426 1 78 LEU HB3 1 80 ILE MD . . 3.570 2.886 2.774 2.935 . 0 0 "[ . 1 . 2]" 1
2427 1 78 LEU HB3 1 80 ILE HG13 . . 5.510 5.518 5.414 5.535 0.025 5 0 "[ . 1 . 2]" 1
2428 1 78 LEU HB3 1 103 PHE H . . 5.710 5.566 5.435 5.648 . 0 0 "[ . 1 . 2]" 1
2429 1 78 LEU HB3 1 103 PHE HB2 . . 4.990 4.978 4.906 5.012 0.022 7 0 "[ . 1 . 2]" 1
2430 1 78 LEU HB3 1 103 PHE QD . . 6.000 6.042 6.021 6.062 0.062 9 0 "[ . 1 . 2]" 1
2431 1 78 LEU QD 1 103 PHE H . . 4.430 3.594 3.556 3.697 . 0 0 "[ . 1 . 2]" 1
2432 1 78 LEU QD 1 103 PHE HB2 . . 3.410 2.498 2.430 2.728 . 0 0 "[ . 1 . 2]" 1
2433 1 78 LEU QD 1 103 PHE HB3 . . 3.640 2.820 2.758 2.989 . 0 0 "[ . 1 . 2]" 1
2434 1 78 LEU QD 1 103 PHE QD . . 4.560 4.011 3.961 4.193 . 0 0 "[ . 1 . 2]" 1
2435 1 78 LEU QD 1 104 ASP H . . 4.570 3.985 3.964 4.030 . 0 0 "[ . 1 . 2]" 1
2436 1 78 LEU QD 1 104 ASP HA . . 3.800 3.025 2.899 3.070 . 0 0 "[ . 1 . 2]" 1
2437 1 78 LEU QD 1 104 ASP HB3 . . 5.920 5.208 5.156 5.243 . 0 0 "[ . 1 . 2]" 1
2438 1 78 LEU QD 1 105 VAL H . . 3.330 2.158 2.049 2.222 . 0 0 "[ . 1 . 2]" 1
2439 1 78 LEU MD1 1 79 THR H . . 6.000 4.928 4.894 4.952 . 0 0 "[ . 1 . 2]" 1
2440 1 78 LEU MD2 1 79 THR H . . 6.000 4.950 4.805 5.028 . 0 0 "[ . 1 . 2]" 1
2441 1 78 LEU HG 1 79 THR H . . 5.350 5.007 4.912 5.049 . 0 0 "[ . 1 . 2]" 1
2442 1 78 LEU HG 1 103 PHE H . . 6.000 5.749 5.695 5.857 . 0 0 "[ . 1 . 2]" 1
2443 1 78 LEU HG 1 103 PHE HB2 . . 6.000 5.124 5.054 5.325 . 0 0 "[ . 1 . 2]" 1
2444 1 78 LEU HG 1 105 VAL H . . 4.450 3.802 3.705 4.009 . 0 0 "[ . 1 . 2]" 1
2445 1 79 THR H 1 79 THR HB . . 3.180 2.671 2.472 2.714 . 0 0 "[ . 1 . 2]" 1
2446 1 79 THR H 1 79 THR MG . . 3.970 3.833 3.792 3.855 . 0 0 "[ . 1 . 2]" 1
2447 1 79 THR H 1 80 ILE H . . 4.440 4.321 4.268 4.344 . 0 0 "[ . 1 . 2]" 1
2448 1 79 THR H 1 80 ILE MD . . 3.910 3.900 3.674 3.940 0.030 10 0 "[ . 1 . 2]" 1
2449 1 79 THR H 1 102 VAL HA . . 5.320 5.364 5.338 5.384 0.064 10 0 "[ . 1 . 2]" 1
2450 1 79 THR HA 1 79 THR MG . . 3.070 2.347 2.324 2.500 . 0 0 "[ . 1 . 2]" 1
2451 1 79 THR HA 1 80 ILE H . . 2.830 2.148 2.142 2.165 . 0 0 "[ . 1 . 2]" 1
2452 1 79 THR HA 1 80 ILE HB . . 5.040 4.879 4.844 4.991 . 0 0 "[ . 1 . 2]" 1
2453 1 79 THR HA 1 80 ILE MD . . 4.430 4.150 3.946 4.204 . 0 0 "[ . 1 . 2]" 1
2454 1 79 THR HA 1 80 ILE HG12 . . 4.490 3.670 3.637 3.701 . 0 0 "[ . 1 . 2]" 1
2455 1 79 THR HA 1 101 LEU H . . 5.940 5.429 5.362 5.492 . 0 0 "[ . 1 . 2]" 1
2456 1 79 THR HA 1 102 VAL H . . 6.000 5.449 5.419 5.472 . 0 0 "[ . 1 . 2]" 1
2457 1 79 THR HA 1 102 VAL HA . . 3.490 2.741 2.689 2.776 . 0 0 "[ . 1 . 2]" 1
2458 1 79 THR HA 1 102 VAL MG1 . . 4.500 3.477 3.321 3.652 . 0 0 "[ . 1 . 2]" 1
2459 1 79 THR HA 1 102 VAL QG . . 3.530 3.110 3.049 3.173 . 0 0 "[ . 1 . 2]" 1
2460 1 79 THR HA 1 102 VAL MG2 . . 4.500 3.515 3.429 3.602 . 0 0 "[ . 1 . 2]" 1
2461 1 79 THR HA 1 103 PHE H . . 3.730 3.466 3.386 3.525 . 0 0 "[ . 1 . 2]" 1
2462 1 79 THR HA 1 103 PHE QD . . 4.810 4.720 4.584 4.764 . 0 0 "[ . 1 . 2]" 1
2463 1 79 THR HB 1 80 ILE H . . 4.700 4.253 4.224 4.366 . 0 0 "[ . 1 . 2]" 1
2464 1 79 THR HB 1 80 ILE HA . . 5.760 4.775 4.739 4.926 . 0 0 "[ . 1 . 2]" 1
2465 1 79 THR HB 1 80 ILE MD . . 5.050 5.012 4.871 5.049 . 0 0 "[ . 1 . 2]" 1
2466 1 79 THR HB 1 102 VAL HA . . 6.000 5.681 5.597 5.719 . 0 0 "[ . 1 . 2]" 1
2467 1 79 THR MG 1 80 ILE H . . 3.350 3.065 3.041 3.102 . 0 0 "[ . 1 . 2]" 1
2468 1 79 THR MG 1 80 ILE HA . . 4.130 4.140 3.955 4.173 0.043 13 0 "[ . 1 . 2]" 1
2469 1 79 THR MG 1 102 VAL HA . . 3.930 3.666 3.499 3.949 0.019 9 0 "[ . 1 . 2]" 1
2470 1 79 THR MG 1 103 PHE H . . 5.170 4.987 4.851 5.199 0.029 5 0 "[ . 1 . 2]" 1
2471 1 80 ILE H 1 80 ILE HB . . 3.130 2.764 2.733 2.858 . 0 0 "[ . 1 . 2]" 1
2472 1 80 ILE H 1 80 ILE MD . . 3.700 3.382 3.269 3.422 . 0 0 "[ . 1 . 2]" 1
2473 1 80 ILE H 1 80 ILE HG12 . . 3.420 2.331 2.267 2.355 . 0 0 "[ . 1 . 2]" 1
2474 1 80 ILE H 1 80 ILE HG13 . . 3.820 3.823 3.773 3.840 0.020 4 0 "[ . 1 . 2]" 1
2475 1 80 ILE H 1 80 ILE MG . . 3.890 3.893 3.885 3.905 0.015 3 0 "[ . 1 . 2]" 1
2476 1 80 ILE H 1 81 SER H . . 4.440 4.466 4.439 4.479 0.039 4 0 "[ . 1 . 2]" 1
2477 1 80 ILE H 1 101 LEU H . . 4.660 3.867 3.814 3.915 . 0 0 "[ . 1 . 2]" 1
2478 1 80 ILE H 1 101 LEU HB2 . . 5.360 3.959 3.760 4.043 . 0 0 "[ . 1 . 2]" 1
2479 1 80 ILE H 1 101 LEU HB3 . . 5.580 5.020 4.967 5.062 . 0 0 "[ . 1 . 2]" 1
2480 1 80 ILE H 1 102 VAL HA . . 3.790 3.050 2.991 3.136 . 0 0 "[ . 1 . 2]" 1
2481 1 80 ILE HA 1 80 ILE MD . . 3.480 2.253 2.229 2.342 . 0 0 "[ . 1 . 2]" 1
2482 1 80 ILE HA 1 80 ILE HG12 . . 3.580 3.286 3.267 3.359 . 0 0 "[ . 1 . 2]" 1
2483 1 80 ILE HA 1 80 ILE MG . . 3.320 2.367 2.236 2.389 . 0 0 "[ . 1 . 2]" 1
2484 1 80 ILE HA 1 81 SER H . . 2.660 2.157 2.126 2.181 . 0 0 "[ . 1 . 2]" 1
2485 1 80 ILE HB 1 80 ILE MD . . 3.440 3.275 3.271 3.281 . 0 0 "[ . 1 . 2]" 1
2486 1 80 ILE HB 1 84 TYR HB2 . . 6.000 5.380 5.018 5.522 . 0 0 "[ . 1 . 2]" 1
2487 1 80 ILE HB 1 85 ALA H . . 5.280 5.274 4.860 5.303 0.023 10 0 "[ . 1 . 2]" 1
2488 1 80 ILE HB 1 85 ALA HA . . 4.770 4.773 4.677 4.795 0.025 3 0 "[ . 1 . 2]" 1
2489 1 80 ILE HB 1 85 ALA MB . . 3.610 3.144 2.585 3.208 . 0 0 "[ . 1 . 2]" 1
2490 1 80 ILE HB 1 101 LEU H . . 4.460 3.631 3.566 3.842 . 0 0 "[ . 1 . 2]" 1
2491 1 80 ILE HB 1 103 PHE QE . . 5.450 2.885 2.834 2.969 . 0 0 "[ . 1 . 2]" 1
2492 1 80 ILE HB 1 103 PHE HZ . . 5.290 5.301 5.267 5.334 0.044 3 0 "[ . 1 . 2]" 1
2493 1 80 ILE MD 1 80 ILE MG . . 2.800 2.103 2.064 2.134 . 0 0 "[ . 1 . 2]" 1
2494 1 80 ILE MD 1 81 SER H . . 4.150 3.892 3.818 4.054 . 0 0 "[ . 1 . 2]" 1
2495 1 80 ILE MD 1 84 TYR HB2 . . 4.850 4.451 4.330 4.716 . 0 0 "[ . 1 . 2]" 1
2496 1 80 ILE MD 1 84 TYR HB3 . . 5.140 3.904 3.802 4.037 . 0 0 "[ . 1 . 2]" 1
2497 1 80 ILE MD 1 103 PHE H . . 4.900 4.559 4.333 4.669 . 0 0 "[ . 1 . 2]" 1
2498 1 80 ILE MD 1 103 PHE HB2 . . 3.710 3.646 3.413 3.729 0.019 3 0 "[ . 1 . 2]" 1
2499 1 80 ILE MD 1 103 PHE QD . . 3.810 3.586 3.531 3.666 . 0 0 "[ . 1 . 2]" 1
2500 1 80 ILE HG12 1 80 ILE MG . . 3.590 3.230 3.227 3.232 . 0 0 "[ . 1 . 2]" 1
2501 1 80 ILE HG13 1 80 ILE MG . . 2.900 2.456 2.372 2.494 . 0 0 "[ . 1 . 2]" 1
2502 1 80 ILE MG 1 81 SER H . . 3.110 2.257 2.160 2.450 . 0 0 "[ . 1 . 2]" 1
2503 1 80 ILE MG 1 83 ASP H . . 5.390 4.968 4.894 5.110 . 0 0 "[ . 1 . 2]" 1
2504 1 80 ILE MG 1 84 TYR H . . 3.810 3.605 3.454 3.735 . 0 0 "[ . 1 . 2]" 1
2505 1 80 ILE MG 1 84 TYR HA . . 4.640 4.329 4.096 4.389 . 0 0 "[ . 1 . 2]" 1
2506 1 80 ILE MG 1 84 TYR HB2 . . 3.560 2.766 2.453 2.947 . 0 0 "[ . 1 . 2]" 1
2507 1 80 ILE MG 1 84 TYR HB3 . . 3.500 2.542 2.211 2.672 . 0 0 "[ . 1 . 2]" 1
2508 1 80 ILE MG 1 84 TYR QD . . 4.050 3.923 3.564 4.056 0.006 13 0 "[ . 1 . 2]" 1
2509 1 80 ILE MG 1 85 ALA H . . 3.820 2.926 2.726 2.971 . 0 0 "[ . 1 . 2]" 1
2510 1 80 ILE MG 1 85 ALA HA . . 4.020 2.533 2.382 2.939 . 0 0 "[ . 1 . 2]" 1
2511 1 80 ILE MG 1 85 ALA MB . . 3.130 2.046 1.975 2.096 . 0 0 "[ . 1 . 2]" 1
2512 1 81 SER H 1 81 SER HA . . 2.940 2.932 2.921 2.937 . 0 0 "[ . 1 . 2]" 1
2513 1 81 SER H 1 81 SER HB2 . . 3.950 3.487 3.468 3.500 . 0 0 "[ . 1 . 2]" 1
2514 1 81 SER H 1 81 SER QB . . 3.310 3.031 2.987 3.054 . 0 0 "[ . 1 . 2]" 1
2515 1 81 SER H 1 81 SER HB3 . . 3.950 3.331 3.246 3.380 . 0 0 "[ . 1 . 2]" 1
2516 1 81 SER H 1 82 PRO HD2 . . 4.860 4.830 4.815 4.856 . 0 0 "[ . 1 . 2]" 1
2517 1 81 SER H 1 82 PRO HD3 . . 5.380 5.272 5.265 5.284 . 0 0 "[ . 1 . 2]" 1
2518 1 81 SER H 1 83 ASP H . . 4.860 4.567 4.520 4.633 . 0 0 "[ . 1 . 2]" 1
2519 1 81 SER H 1 84 TYR H . . 4.330 3.556 3.489 3.864 . 0 0 "[ . 1 . 2]" 1
2520 1 81 SER H 1 84 TYR HB2 . . 3.440 2.487 2.418 2.550 . 0 0 "[ . 1 . 2]" 1
2521 1 81 SER H 1 84 TYR HB3 . . 4.520 3.668 3.536 3.747 . 0 0 "[ . 1 . 2]" 1
2522 1 81 SER H 1 84 TYR QD . . 5.090 4.333 4.224 4.411 . 0 0 "[ . 1 . 2]" 1
2523 1 81 SER HA 1 82 PRO HA . . 4.440 4.440 4.437 4.443 0.003 7 0 "[ . 1 . 2]" 1
2524 1 81 SER HA 1 82 PRO HD2 . . 3.320 2.582 2.555 2.665 . 0 0 "[ . 1 . 2]" 1
2525 1 81 SER HA 1 82 PRO HD3 . . 3.230 2.595 2.578 2.611 . 0 0 "[ . 1 . 2]" 1
2526 1 81 SER HA 1 82 PRO HG2 . . 5.150 4.701 4.677 4.772 . 0 0 "[ . 1 . 2]" 1
2527 1 81 SER HA 1 82 PRO HG3 . . 4.890 4.730 4.714 4.764 . 0 0 "[ . 1 . 2]" 1
2528 1 81 SER HA 1 83 ASP H . . 4.100 4.115 4.093 4.141 0.041 3 0 "[ . 1 . 2]" 1
2529 1 81 SER HA 1 84 TYR H . . 4.840 4.607 4.543 4.762 . 0 0 "[ . 1 . 2]" 1
2530 1 81 SER HA 1 85 ALA H . . 5.150 5.059 4.902 5.080 . 0 0 "[ . 1 . 2]" 1
2531 1 81 SER HA 1 85 ALA MB . . 4.750 4.406 4.199 4.441 . 0 0 "[ . 1 . 2]" 1
2532 1 81 SER HA 1 100 THR HA . . 3.140 2.428 2.383 2.519 . 0 0 "[ . 1 . 2]" 1
2533 1 81 SER HA 1 101 LEU H . . 3.390 3.158 3.093 3.265 . 0 0 "[ . 1 . 2]" 1
2534 1 81 SER HA 1 101 LEU HB2 . . 6.000 5.151 5.073 5.301 . 0 0 "[ . 1 . 2]" 1
2535 1 81 SER HA 1 101 LEU QD . . 4.560 4.607 4.601 4.627 0.067 3 0 "[ . 1 . 2]" 1
2536 1 81 SER QB 1 82 PRO HD3 . . 3.340 3.349 3.324 3.361 0.021 14 0 "[ . 1 . 2]" 1
2537 1 81 SER QB 1 83 ASP H . . 3.790 2.347 2.338 2.372 . 0 0 "[ . 1 . 2]" 1
2538 1 81 SER QB 1 83 ASP HB2 . . 4.480 3.143 3.017 3.494 . 0 0 "[ . 1 . 2]" 1
2539 1 81 SER QB 1 84 TYR H . . 4.440 3.311 3.194 3.713 . 0 0 "[ . 1 . 2]" 1
2540 1 81 SER QB 1 100 THR HA . . 4.210 4.015 3.953 4.123 . 0 0 "[ . 1 . 2]" 1
2541 1 81 SER HB2 1 82 PRO HD2 . . 3.650 2.166 2.135 2.193 . 0 0 "[ . 1 . 2]" 1
2542 1 81 SER HB2 1 82 PRO HD3 . . 3.880 3.630 3.580 3.655 . 0 0 "[ . 1 . 2]" 1
2543 1 81 SER HB2 1 83 ASP H . . 4.350 2.361 2.352 2.387 . 0 0 "[ . 1 . 2]" 1
2544 1 81 SER HB3 1 82 PRO HD2 . . 3.650 2.776 2.732 2.844 . 0 0 "[ . 1 . 2]" 1
2545 1 81 SER HB3 1 82 PRO HD3 . . 3.880 3.930 3.911 3.942 0.062 2 0 "[ . 1 . 2]" 1
2546 1 81 SER HB3 1 83 ASP H . . 4.350 4.086 4.075 4.112 . 0 0 "[ . 1 . 2]" 1
2547 1 82 PRO HA 1 85 ALA H . . 3.580 3.365 3.071 3.452 . 0 0 "[ . 1 . 2]" 1
2548 1 82 PRO HA 1 85 ALA MB . . 3.380 2.501 2.401 2.650 . 0 0 "[ . 1 . 2]" 1
2549 1 82 PRO HA 1 87 GLY H . . 3.900 3.640 3.566 3.791 . 0 0 "[ . 1 . 2]" 1
2550 1 82 PRO HA 1 98 HIS H . . 5.960 5.232 5.059 5.315 . 0 0 "[ . 1 . 2]" 1
2551 1 82 PRO HA 1 100 THR HA . . 4.940 4.713 4.685 4.773 . 0 0 "[ . 1 . 2]" 1
2552 1 82 PRO HA 1 101 LEU QD . . 4.280 3.617 3.564 3.739 . 0 0 "[ . 1 . 2]" 1
2553 1 82 PRO HB2 1 83 ASP HB2 . . 5.090 5.026 4.753 5.121 0.031 4 0 "[ . 1 . 2]" 1
2554 1 82 PRO HB2 1 87 GLY H . . 4.510 4.094 3.992 4.532 0.022 3 0 "[ . 1 . 2]" 1
2555 1 82 PRO HB2 1 87 GLY HA2 . . 4.990 4.791 4.707 5.006 0.016 13 0 "[ . 1 . 2]" 1
2556 1 82 PRO HB2 1 88 ALA HA . . 4.730 3.907 2.608 4.008 . 0 0 "[ . 1 . 2]" 1
2557 1 82 PRO HB2 1 88 ALA MB . . 5.170 5.096 3.821 5.191 0.021 18 0 "[ . 1 . 2]" 1
2558 1 82 PRO HB2 1 98 HIS H . . 3.980 3.121 3.036 3.161 . 0 0 "[ . 1 . 2]" 1
2559 1 82 PRO HB2 1 98 HIS HA . . 3.390 2.926 2.846 2.986 . 0 0 "[ . 1 . 2]" 1
2560 1 82 PRO HB2 1 98 HIS HB2 . . 6.000 5.829 5.733 5.873 . 0 0 "[ . 1 . 2]" 1
2561 1 82 PRO HB3 1 85 ALA MB . . 5.150 4.399 4.303 4.473 . 0 0 "[ . 1 . 2]" 1
2562 1 82 PRO HB3 1 98 HIS H . . 3.960 3.254 3.108 3.356 . 0 0 "[ . 1 . 2]" 1
2563 1 82 PRO HB3 1 98 HIS HA . . 4.110 3.169 3.013 3.266 . 0 0 "[ . 1 . 2]" 1
2564 1 82 PRO HB3 1 99 ALA H . . 3.580 2.096 2.034 2.153 . 0 0 "[ . 1 . 2]" 1
2565 1 82 PRO HB3 1 100 THR H . . 6.000 5.244 5.183 5.312 . 0 0 "[ . 1 . 2]" 1
2566 1 82 PRO HD2 1 83 ASP H . . 3.870 3.016 2.947 3.044 . 0 0 "[ . 1 . 2]" 1
2567 1 82 PRO HD2 1 84 TYR H . . 4.740 4.737 4.671 4.823 0.083 3 0 "[ . 1 . 2]" 1
2568 1 82 PRO HD2 1 85 ALA H . . 5.570 5.609 5.461 5.627 0.057 14 0 "[ . 1 . 2]" 1
2569 1 82 PRO HD2 1 100 THR H . . 5.220 4.885 4.828 4.972 . 0 0 "[ . 1 . 2]" 1
2570 1 82 PRO HD2 1 100 THR MG . . 4.810 3.873 3.802 3.966 . 0 0 "[ . 1 . 2]" 1
2571 1 82 PRO HD3 1 83 ASP H . . 4.740 4.058 4.028 4.071 . 0 0 "[ . 1 . 2]" 1
2572 1 82 PRO HD3 1 85 ALA MB . . 5.500 4.804 4.636 4.880 . 0 0 "[ . 1 . 2]" 1
2573 1 82 PRO HD3 1 100 THR H . . 5.100 3.536 3.513 3.577 . 0 0 "[ . 1 . 2]" 1
2574 1 82 PRO HD3 1 100 THR HA . . 3.840 2.163 2.145 2.207 . 0 0 "[ . 1 . 2]" 1
2575 1 82 PRO HD3 1 100 THR MG . . 4.470 3.604 3.514 3.638 . 0 0 "[ . 1 . 2]" 1
2576 1 82 PRO HD3 1 101 LEU H . . 4.090 4.067 4.012 4.108 0.018 3 0 "[ . 1 . 2]" 1
2577 1 82 PRO HG2 1 83 ASP H . . 3.500 2.994 2.973 3.037 . 0 0 "[ . 1 . 2]" 1
2578 1 82 PRO HG2 1 84 TYR H . . 5.180 5.230 5.190 5.241 0.061 1 0 "[ . 1 . 2]" 1
2579 1 82 PRO HG2 1 98 HIS H . . 4.450 4.469 4.452 4.479 0.029 12 0 "[ . 1 . 2]" 1
2580 1 82 PRO HG2 1 98 HIS HA . . 3.310 2.900 2.791 2.932 . 0 0 "[ . 1 . 2]" 1
2581 1 82 PRO HG2 1 98 HIS HB2 . . 6.000 5.814 5.664 5.862 . 0 0 "[ . 1 . 2]" 1
2582 1 82 PRO HG2 1 98 HIS HB3 . . 4.930 4.719 4.526 4.788 . 0 0 "[ . 1 . 2]" 1
2583 1 82 PRO HG2 1 99 ALA H . . 4.300 4.037 3.864 4.234 . 0 0 "[ . 1 . 2]" 1
2584 1 82 PRO HG3 1 83 ASP H . . 4.630 4.380 4.364 4.405 . 0 0 "[ . 1 . 2]" 1
2585 1 82 PRO HG3 1 98 HIS H . . 5.300 3.842 3.813 3.876 . 0 0 "[ . 1 . 2]" 1
2586 1 82 PRO HG3 1 98 HIS HA . . 3.900 2.234 2.204 2.249 . 0 0 "[ . 1 . 2]" 1
2587 1 82 PRO HG3 1 98 HIS HB2 . . 5.430 4.838 4.809 4.872 . 0 0 "[ . 1 . 2]" 1
2588 1 82 PRO HG3 1 99 ALA H . . 4.340 2.539 2.346 2.766 . 0 0 "[ . 1 . 2]" 1
2589 1 82 PRO HG3 1 99 ALA HA . . 4.750 3.694 3.556 3.819 . 0 0 "[ . 1 . 2]" 1
2590 1 82 PRO HG3 1 100 THR H . . 4.280 4.318 4.300 4.323 0.043 1 0 "[ . 1 . 2]" 1
2591 1 82 PRO HG3 1 100 THR HA . . 4.370 4.275 4.248 4.298 . 0 0 "[ . 1 . 2]" 1
2592 1 83 ASP H 1 83 ASP HB2 . . 3.470 2.202 2.117 2.354 . 0 0 "[ . 1 . 2]" 1
2593 1 83 ASP H 1 83 ASP HB3 . . 3.410 3.289 2.849 3.462 0.052 13 0 "[ . 1 . 2]" 1
2594 1 83 ASP H 1 84 TYR H . . 3.220 2.303 2.250 2.412 . 0 0 "[ . 1 . 2]" 1
2595 1 83 ASP H 1 84 TYR HB2 . . 4.760 4.276 4.219 4.305 . 0 0 "[ . 1 . 2]" 1
2596 1 83 ASP H 1 84 TYR QD . . 4.740 4.215 4.083 4.255 . 0 0 "[ . 1 . 2]" 1
2597 1 83 ASP H 1 85 ALA H . . 4.120 3.599 3.553 3.626 . 0 0 "[ . 1 . 2]" 1
2598 1 83 ASP H 1 85 ALA MB . . 5.190 4.521 4.460 4.658 . 0 0 "[ . 1 . 2]" 1
2599 1 83 ASP HA 1 85 ALA H . . 4.750 4.308 4.259 4.441 . 0 0 "[ . 1 . 2]" 1
2600 1 83 ASP HA 1 87 GLY HA2 . . 4.330 2.778 2.426 3.054 . 0 0 "[ . 1 . 2]" 1
2601 1 83 ASP HA 1 87 GLY HA3 . . 4.710 4.531 4.172 4.751 0.041 3 0 "[ . 1 . 2]" 1
2602 1 83 ASP HB2 1 84 TYR H . . 3.670 3.324 3.105 3.703 0.033 1 0 "[ . 1 . 2]" 1
2603 1 83 ASP HB2 1 84 TYR QD . . 4.240 3.518 3.278 4.112 . 0 0 "[ . 1 . 2]" 1
2604 1 83 ASP HB2 1 85 ALA H . . 5.420 5.163 5.025 5.428 0.008 18 0 "[ . 1 . 2]" 1
2605 1 83 ASP HB3 1 84 TYR H . . 3.690 3.428 2.936 3.721 0.031 3 0 "[ . 1 . 2]" 1
2606 1 83 ASP HB3 1 84 TYR QD . . 3.810 2.865 2.433 3.179 . 0 0 "[ . 1 . 2]" 1
2607 1 83 ASP HB3 1 85 ALA H . . 5.350 5.257 4.933 5.370 0.020 3 0 "[ . 1 . 2]" 1
2608 1 84 TYR H 1 84 TYR HB2 . . 3.000 2.309 2.271 2.517 . 0 0 "[ . 1 . 2]" 1
2609 1 84 TYR H 1 84 TYR HB3 . . 3.640 3.521 3.493 3.604 . 0 0 "[ . 1 . 2]" 1
2610 1 84 TYR H 1 84 TYR QD . . 3.450 2.997 2.927 3.293 . 0 0 "[ . 1 . 2]" 1
2611 1 84 TYR H 1 85 ALA H . . 2.740 2.106 1.673 2.167 . 0 0 "[ . 1 . 2]" 1
2612 1 84 TYR H 1 85 ALA MB . . 3.830 3.829 3.575 3.863 0.033 2 0 "[ . 1 . 2]" 1
2613 1 84 TYR H 1 86 TYR H . . 5.100 4.475 4.379 5.256 0.156 3 0 "[ . 1 . 2]" 1
2614 1 84 TYR HA 1 84 TYR QD . . 3.780 2.995 2.951 3.033 . 0 0 "[ . 1 . 2]" 1
2615 1 84 TYR HA 1 84 TYR QE . . 4.450 4.504 4.497 4.516 0.066 3 0 "[ . 1 . 2]" 1
2616 1 84 TYR HA 1 85 ALA H . . 3.520 3.434 3.427 3.440 . 0 0 "[ . 1 . 2]" 1
2617 1 84 TYR HB2 1 85 ALA H . . 3.860 3.296 3.081 3.330 . 0 0 "[ . 1 . 2]" 1
2618 1 84 TYR HB2 1 85 ALA MB . . 4.970 4.347 4.142 4.377 . 0 0 "[ . 1 . 2]" 1
2619 1 84 TYR HB3 1 85 ALA H . . 4.100 3.721 3.587 3.751 . 0 0 "[ . 1 . 2]" 1
2620 1 84 TYR QD 1 85 ALA H . . 4.830 4.667 4.538 4.698 . 0 0 "[ . 1 . 2]" 1
2621 1 85 ALA H 1 85 ALA MB . . 3.080 2.280 2.270 2.291 . 0 0 "[ . 1 . 2]" 1
2622 1 85 ALA H 1 86 TYR H . . 4.260 2.801 2.673 3.986 . 0 0 "[ . 1 . 2]" 1
2623 1 85 ALA H 1 87 GLY H . . 4.740 4.344 3.888 4.413 . 0 0 "[ . 1 . 2]" 1
2624 1 85 ALA HA 1 101 LEU QD . . 4.870 4.046 4.004 4.147 . 0 0 "[ . 1 . 2]" 1
2625 1 85 ALA MB 1 86 TYR H . . 3.700 2.251 2.138 3.493 . 0 0 "[ . 1 . 2]" 1
2626 1 85 ALA MB 1 86 TYR HB2 . . 4.630 3.709 3.636 3.954 . 0 0 "[ . 1 . 2]" 1
2627 1 85 ALA MB 1 86 TYR HB3 . . 5.060 4.816 4.776 5.137 0.077 3 0 "[ . 1 . 2]" 1
2628 1 85 ALA MB 1 86 TYR QD . . 3.380 2.225 2.151 2.445 . 0 0 "[ . 1 . 2]" 1
2629 1 85 ALA MB 1 86 TYR QE . . 3.690 2.785 2.725 3.109 . 0 0 "[ . 1 . 2]" 1
2630 1 85 ALA MB 1 87 GLY H . . 3.880 3.806 3.765 3.926 0.046 3 0 "[ . 1 . 2]" 1
2631 1 85 ALA MB 1 90 GLY HA3 . . 6.000 5.859 5.529 6.033 0.033 3 0 "[ . 1 . 2]" 1
2632 1 85 ALA MB 1 101 LEU QD . . 3.090 1.978 1.907 1.995 . 0 0 "[ . 1 . 2]" 1
2633 1 86 TYR H 1 86 TYR QD . . 4.190 2.948 2.819 3.748 . 0 0 "[ . 1 . 2]" 1
2634 1 86 TYR H 1 87 GLY H . . 3.480 2.199 2.104 3.488 0.008 3 0 "[ . 1 . 2]" 1
2635 1 86 TYR H 1 87 GLY HA2 . . 5.990 4.156 4.097 5.052 . 0 0 "[ . 1 . 2]" 1
2636 1 86 TYR H 1 87 GLY HA3 . . 5.780 4.712 4.635 5.333 . 0 0 "[ . 1 . 2]" 1
2637 1 86 TYR H 1 90 GLY HA2 . . 6.000 5.111 4.944 5.955 . 0 0 "[ . 1 . 2]" 1
2638 1 86 TYR H 1 95 ILE MG . . 6.000 4.647 4.532 5.889 . 0 0 "[ . 1 . 2]" 1
2639 1 86 TYR H 1 101 LEU QD . . 5.920 4.400 4.326 5.216 . 0 0 "[ . 1 . 2]" 1
2640 1 86 TYR HA 1 86 TYR QD . . 3.890 3.029 2.796 3.073 . 0 0 "[ . 1 . 2]" 1
2641 1 86 TYR HA 1 87 GLY HA2 . . 5.230 4.960 4.941 5.071 . 0 0 "[ . 1 . 2]" 1
2642 1 86 TYR HA 1 87 GLY HA3 . . 4.790 4.639 4.554 4.654 . 0 0 "[ . 1 . 2]" 1
2643 1 86 TYR HA 1 90 GLY H . . 5.710 5.457 4.876 5.519 . 0 0 "[ . 1 . 2]" 1
2644 1 86 TYR HB2 1 87 GLY H . . 4.290 2.413 2.355 2.515 . 0 0 "[ . 1 . 2]" 1
2645 1 86 TYR HB2 1 90 GLY H . . 4.740 3.588 2.766 3.650 . 0 0 "[ . 1 . 2]" 1
2646 1 86 TYR HB2 1 90 GLY HA2 . . 4.680 2.329 2.308 2.374 . 0 0 "[ . 1 . 2]" 1
2647 1 86 TYR HB2 1 90 GLY HA3 . . 4.560 3.359 3.305 3.437 . 0 0 "[ . 1 . 2]" 1
2648 1 86 TYR HB2 1 91 HIS H . . 5.410 4.360 4.309 4.660 . 0 0 "[ . 1 . 2]" 1
2649 1 86 TYR HB2 1 95 ILE MG . . 4.130 3.492 3.447 3.569 . 0 0 "[ . 1 . 2]" 1
2650 1 86 TYR HB2 1 101 LEU QD . . 5.180 4.716 4.514 4.844 . 0 0 "[ . 1 . 2]" 1
2651 1 86 TYR HB3 1 87 GLY H . . 4.460 3.468 3.410 3.657 . 0 0 "[ . 1 . 2]" 1
2652 1 86 TYR HB3 1 89 THR HB . . 5.720 5.067 4.148 5.146 . 0 0 "[ . 1 . 2]" 1
2653 1 86 TYR HB3 1 89 THR MG . . 6.000 5.991 5.357 6.032 0.032 18 0 "[ . 1 . 2]" 1
2654 1 86 TYR HB3 1 90 GLY H . . 4.330 3.303 2.565 3.374 . 0 0 "[ . 1 . 2]" 1
2655 1 86 TYR HB3 1 90 GLY HA2 . . 4.510 2.303 2.223 2.313 . 0 0 "[ . 1 . 2]" 1
2656 1 86 TYR HB3 1 90 GLY HA3 . . 4.350 3.953 3.888 3.967 . 0 0 "[ . 1 . 2]" 1
2657 1 86 TYR HB3 1 91 HIS H . . 5.100 4.542 4.469 4.686 . 0 0 "[ . 1 . 2]" 1
2658 1 86 TYR HB3 1 91 HIS HA . . 6.000 5.949 5.832 6.000 0.000 19 0 "[ . 1 . 2]" 1
2659 1 86 TYR HB3 1 91 HIS HB2 . . 5.680 5.358 5.281 5.696 0.016 13 0 "[ . 1 . 2]" 1
2660 1 86 TYR HB3 1 95 ILE MG . . 4.870 4.552 4.513 4.595 . 0 0 "[ . 1 . 2]" 1
2661 1 86 TYR HB3 1 101 LEU QD . . 5.920 5.794 5.628 5.891 . 0 0 "[ . 1 . 2]" 1
2662 1 86 TYR QD 1 87 GLY H . . 4.520 3.924 3.861 4.061 . 0 0 "[ . 1 . 2]" 1
2663 1 86 TYR QD 1 90 GLY HA2 . . 4.630 3.478 3.003 3.540 . 0 0 "[ . 1 . 2]" 1
2664 1 86 TYR QD 1 90 GLY HA3 . . 4.520 4.376 3.994 4.427 . 0 0 "[ . 1 . 2]" 1
2665 1 86 TYR QD 1 95 ILE HB . . 5.700 4.249 4.198 4.295 . 0 0 "[ . 1 . 2]" 1
2666 1 86 TYR QD 1 95 ILE MD . . 4.370 4.343 4.216 4.381 0.011 13 0 "[ . 1 . 2]" 1
2667 1 86 TYR QD 1 95 ILE HG13 . . 6.000 3.749 3.514 3.966 . 0 0 "[ . 1 . 2]" 1
2668 1 86 TYR QD 1 95 ILE MG . . 3.250 2.270 2.255 2.307 . 0 0 "[ . 1 . 2]" 1
2669 1 86 TYR QD 1 101 LEU QD . . 3.280 2.883 2.807 2.952 . 0 0 "[ . 1 . 2]" 1
2670 1 86 TYR QD 1 101 LEU HG . . 5.330 5.353 5.337 5.404 0.074 3 0 "[ . 1 . 2]" 1
2671 1 86 TYR QE 1 91 HIS HB2 . . 5.510 3.870 3.406 4.398 . 0 0 "[ . 1 . 2]" 1
2672 1 86 TYR QE 1 95 ILE HB . . 6.000 4.250 3.965 4.504 . 0 0 "[ . 1 . 2]" 1
2673 1 86 TYR QE 1 95 ILE MD . . 3.510 3.003 2.877 3.055 . 0 0 "[ . 1 . 2]" 1
2674 1 86 TYR QE 1 95 ILE HG12 . . 4.220 4.081 3.986 4.170 . 0 0 "[ . 1 . 2]" 1
2675 1 86 TYR QE 1 95 ILE HG13 . . 6.000 2.480 2.383 2.554 . 0 0 "[ . 1 . 2]" 1
2676 1 86 TYR QE 1 95 ILE MG . . 3.390 2.569 2.293 2.847 . 0 0 "[ . 1 . 2]" 1
2677 1 86 TYR QE 1 101 LEU MD1 . . 3.970 2.477 2.431 2.532 . 0 0 "[ . 1 . 2]" 1
2678 1 86 TYR QE 1 101 LEU QD . . 2.960 2.451 2.406 2.505 . 0 0 "[ . 1 . 2]" 1
2679 1 86 TYR QE 1 101 LEU MD2 . . 3.970 3.888 3.825 3.972 0.002 6 0 "[ . 1 . 2]" 1
2680 1 86 TYR QE 1 101 LEU HG . . 5.700 5.196 5.100 5.334 . 0 0 "[ . 1 . 2]" 1
2681 1 86 TYR QE 1 103 PHE HZ . . 4.250 4.051 3.369 4.256 0.006 13 0 "[ . 1 . 2]" 1
2682 1 87 GLY H 1 87 GLY HA3 . . 2.930 2.921 2.911 2.954 0.024 3 0 "[ . 1 . 2]" 1
2683 1 87 GLY HA2 1 89 THR H . . 4.530 4.499 4.125 4.536 0.006 15 0 "[ . 1 . 2]" 1
2684 1 87 GLY HA3 1 88 ALA MB . . 4.890 4.123 4.095 4.271 . 0 0 "[ . 1 . 2]" 1
2685 1 87 GLY HA3 1 89 THR H . . 3.720 3.272 3.225 3.619 . 0 0 "[ . 1 . 2]" 1
2686 1 88 ALA HA 1 89 THR HA . . 5.960 4.623 4.609 4.628 . 0 0 "[ . 1 . 2]" 1
2687 1 88 ALA HA 1 89 THR HB . . 6.000 6.009 6.002 6.039 0.039 13 0 "[ . 1 . 2]" 1
2688 1 88 ALA HA 1 97 PRO HA . . 4.820 4.168 3.673 4.244 . 0 0 "[ . 1 . 2]" 1
2689 1 88 ALA HA 1 97 PRO HB3 . . 4.640 4.642 4.620 4.655 0.015 13 0 "[ . 1 . 2]" 1
2690 1 88 ALA HA 1 98 HIS H . . 3.470 3.409 2.506 3.475 0.005 10 0 "[ . 1 . 2]" 1
2691 1 88 ALA HA 1 98 HIS HA . . 5.160 4.601 3.595 4.681 . 0 0 "[ . 1 . 2]" 1
2692 1 88 ALA HA 1 98 HIS HD2 . . 6.000 5.053 4.983 5.307 . 0 0 "[ . 1 . 2]" 1
2693 1 88 ALA HA 1 98 HIS HE1 . . 4.840 4.590 4.527 4.852 0.012 13 0 "[ . 1 . 2]" 1
2694 1 88 ALA MB 1 89 THR H . . 3.810 3.148 3.133 3.181 . 0 0 "[ . 1 . 2]" 1
2695 1 88 ALA MB 1 89 THR HA . . 4.220 4.071 4.057 4.083 . 0 0 "[ . 1 . 2]" 1
2696 1 88 ALA MB 1 90 GLY H . . 5.490 5.204 5.194 5.236 . 0 0 "[ . 1 . 2]" 1
2697 1 88 ALA MB 1 98 HIS HA . . 5.670 5.416 4.295 5.507 . 0 0 "[ . 1 . 2]" 1
2698 1 88 ALA MB 1 98 HIS HE1 . . 3.550 3.532 3.067 3.559 0.009 5 0 "[ . 1 . 2]" 1
2699 1 89 THR H 1 89 THR HB . . 3.570 2.759 2.748 2.806 . 0 0 "[ . 1 . 2]" 1
2700 1 89 THR H 1 89 THR MG . . 4.090 3.856 3.844 3.866 . 0 0 "[ . 1 . 2]" 1
2701 1 89 THR H 1 90 GLY H . . 3.550 2.456 2.438 2.480 . 0 0 "[ . 1 . 2]" 1
2702 1 89 THR H 1 90 GLY HA3 . . 4.960 4.656 4.637 4.670 . 0 0 "[ . 1 . 2]" 1
2703 1 89 THR HA 1 89 THR MG . . 3.020 2.285 2.265 2.290 . 0 0 "[ . 1 . 2]" 1
2704 1 89 THR HA 1 97 PRO HA . . 4.610 4.539 4.029 4.613 0.003 1 0 "[ . 1 . 2]" 1
2705 1 89 THR HA 1 97 PRO HB3 . . 4.920 3.390 3.076 3.695 . 0 0 "[ . 1 . 2]" 1
2706 1 89 THR HB 1 90 GLY H . . 4.060 2.186 2.183 2.196 . 0 0 "[ . 1 . 2]" 1
2707 1 89 THR HB 1 90 GLY HA3 . . 4.800 4.634 4.623 4.641 . 0 0 "[ . 1 . 2]" 1
2708 1 89 THR MG 1 90 GLY H . . 5.110 3.491 3.477 3.563 . 0 0 "[ . 1 . 2]" 1
2709 1 90 GLY H 1 91 HIS H . . 4.880 4.612 4.580 4.622 . 0 0 "[ . 1 . 2]" 1
2710 1 90 GLY H 1 95 ILE MG . . 5.720 5.255 4.692 5.300 . 0 0 "[ . 1 . 2]" 1
2711 1 90 GLY H 1 97 PRO HA . . 6.000 5.425 5.136 5.639 . 0 0 "[ . 1 . 2]" 1
2712 1 90 GLY HA2 1 91 HIS H . . 3.480 2.699 2.596 2.729 . 0 0 "[ . 1 . 2]" 1
2713 1 90 GLY HA2 1 95 ILE HB . . 4.670 3.937 3.600 3.997 . 0 0 "[ . 1 . 2]" 1
2714 1 90 GLY HA2 1 95 ILE MG . . 3.870 3.654 3.195 3.717 . 0 0 "[ . 1 . 2]" 1
2715 1 90 GLY HA3 1 95 ILE HB . . 5.020 3.375 3.069 3.450 . 0 0 "[ . 1 . 2]" 1
2716 1 90 GLY HA3 1 95 ILE MG . . 4.680 3.061 2.588 3.117 . 0 0 "[ . 1 . 2]" 1
2717 1 90 GLY HA3 1 96 PRO HA . . 5.480 5.142 4.965 5.331 . 0 0 "[ . 1 . 2]" 1
2718 1 91 HIS H 1 91 HIS HB3 . . 4.040 2.767 2.723 2.773 . 0 0 "[ . 1 . 2]" 1
2719 1 91 HIS H 1 92 PRO HA . . 5.780 5.260 5.240 5.333 . 0 0 "[ . 1 . 2]" 1
2720 1 91 HIS H 1 92 PRO QD . . 5.290 4.357 4.348 4.397 . 0 0 "[ . 1 . 2]" 1
2721 1 91 HIS H 1 95 ILE H . . 4.120 3.678 3.546 3.710 . 0 0 "[ . 1 . 2]" 1
2722 1 91 HIS H 1 95 ILE HA . . 5.020 4.663 4.590 4.686 . 0 0 "[ . 1 . 2]" 1
2723 1 91 HIS H 1 95 ILE HB . . 3.480 1.767 1.658 1.800 . 0 0 "[ . 1 . 2]" 1
2724 1 91 HIS H 1 95 ILE MD . . 5.030 4.651 4.467 4.693 . 0 0 "[ . 1 . 2]" 1
2725 1 91 HIS H 1 95 ILE HG12 . . 5.140 3.691 3.368 3.768 . 0 0 "[ . 1 . 2]" 1
2726 1 91 HIS H 1 95 ILE HG13 . . 5.380 3.676 3.377 3.743 . 0 0 "[ . 1 . 2]" 1
2727 1 91 HIS H 1 95 ILE MG . . 4.130 3.036 2.954 3.090 . 0 0 "[ . 1 . 2]" 1
2728 1 91 HIS H 1 96 PRO HA . . 6.000 5.519 5.440 5.770 . 0 0 "[ . 1 . 2]" 1
2729 1 91 HIS HA 1 92 PRO HB3 . . 5.050 4.998 4.973 5.013 . 0 0 "[ . 1 . 2]" 1
2730 1 91 HIS HA 1 92 PRO HD2 . . 3.840 2.253 2.235 2.283 . 0 0 "[ . 1 . 2]" 1
2731 1 91 HIS HA 1 92 PRO QD . . 3.080 2.063 2.060 2.073 . 0 0 "[ . 1 . 2]" 1
2732 1 91 HIS HA 1 92 PRO HD3 . . 3.840 2.392 2.371 2.412 . 0 0 "[ . 1 . 2]" 1
2733 1 91 HIS HA 1 94 ILE H . . 5.430 5.407 5.332 5.436 0.006 13 0 "[ . 1 . 2]" 1
2734 1 91 HIS HA 1 95 ILE H . . 4.920 4.764 4.698 4.798 . 0 0 "[ . 1 . 2]" 1
2735 1 91 HIS HA 1 95 ILE HB . . 5.280 4.348 4.328 4.367 . 0 0 "[ . 1 . 2]" 1
2736 1 91 HIS HB2 1 95 ILE H . . 4.210 4.119 4.070 4.214 0.004 13 0 "[ . 1 . 2]" 1
2737 1 91 HIS HB2 1 95 ILE HB . . 4.280 3.255 3.199 3.406 . 0 0 "[ . 1 . 2]" 1
2738 1 91 HIS HB2 1 95 ILE MD . . 5.340 4.779 4.594 5.044 . 0 0 "[ . 1 . 2]" 1
2739 1 91 HIS HB2 1 95 ILE HG13 . . 5.200 3.669 3.541 3.912 . 0 0 "[ . 1 . 2]" 1
2740 1 91 HIS HB3 1 92 PRO QD . . 5.810 3.978 3.893 4.004 . 0 0 "[ . 1 . 2]" 1
2741 1 91 HIS HB3 1 94 ILE H . . 4.060 3.627 3.527 3.664 . 0 0 "[ . 1 . 2]" 1
2742 1 91 HIS HB3 1 94 ILE HB . . 4.070 3.024 2.744 3.097 . 0 0 "[ . 1 . 2]" 1
2743 1 91 HIS HB3 1 94 ILE MD . . 4.400 3.312 3.202 3.404 . 0 0 "[ . 1 . 2]" 1
2744 1 91 HIS HB3 1 94 ILE HG13 . . 5.740 4.643 4.415 4.723 . 0 0 "[ . 1 . 2]" 1
2745 1 91 HIS HB3 1 94 ILE MG . . 4.660 4.469 4.205 4.539 . 0 0 "[ . 1 . 2]" 1
2746 1 91 HIS HB3 1 95 ILE H . . 3.520 2.502 2.474 2.652 . 0 0 "[ . 1 . 2]" 1
2747 1 91 HIS HB3 1 95 ILE HB . . 3.820 2.799 2.730 3.016 . 0 0 "[ . 1 . 2]" 1
2748 1 91 HIS HB3 1 95 ILE MD . . 4.510 4.156 4.049 4.464 . 0 0 "[ . 1 . 2]" 1
2749 1 91 HIS HB3 1 95 ILE HG12 . . 4.570 2.526 2.407 2.888 . 0 0 "[ . 1 . 2]" 1
2750 1 91 HIS HB3 1 95 ILE HG13 . . 4.900 3.601 3.574 3.825 . 0 0 "[ . 1 . 2]" 1
2751 1 91 HIS HB3 1 95 ILE MG . . 4.480 4.332 4.280 4.497 0.017 13 0 "[ . 1 . 2]" 1
2752 1 91 HIS HD2 1 92 PRO HB2 . . 4.900 4.909 4.902 4.910 0.010 1 0 "[ . 1 . 2]" 1
2753 1 91 HIS HD2 1 92 PRO QD . . 3.960 2.923 2.876 2.982 . 0 0 "[ . 1 . 2]" 1
2754 1 91 HIS HD2 1 94 ILE H . . 5.120 3.135 3.082 3.249 . 0 0 "[ . 1 . 2]" 1
2755 1 91 HIS HD2 1 94 ILE HB . . 5.290 3.912 3.693 4.096 . 0 0 "[ . 1 . 2]" 1
2756 1 91 HIS HD2 1 94 ILE MD . . 3.740 2.560 2.424 2.699 . 0 0 "[ . 1 . 2]" 1
2757 1 91 HIS HD2 1 94 ILE HG13 . . 5.250 3.552 3.308 3.638 . 0 0 "[ . 1 . 2]" 1
2758 1 91 HIS HD2 1 95 ILE H . . 5.420 4.043 4.009 4.209 . 0 0 "[ . 1 . 2]" 1
2759 1 92 PRO HA 1 94 ILE H . . 4.950 4.113 4.029 4.159 . 0 0 "[ . 1 . 2]" 1
2760 1 92 PRO HA 1 95 ILE HB . . 5.740 5.751 5.726 5.758 0.018 15 0 "[ . 1 . 2]" 1
2761 1 93 GLY H 1 94 ILE H . . 3.890 3.129 3.084 3.155 . 0 0 "[ . 1 . 2]" 1
2762 1 93 GLY HA3 1 94 ILE H . . 3.090 2.764 2.739 2.807 . 0 0 "[ . 1 . 2]" 1
2763 1 93 GLY HA3 1 94 ILE HB . . 5.340 5.279 5.263 5.320 . 0 0 "[ . 1 . 2]" 1
2764 1 93 GLY HA3 1 94 ILE HG13 . . 4.290 3.310 3.279 3.408 . 0 0 "[ . 1 . 2]" 1
2765 1 94 ILE H 1 94 ILE HB . . 3.080 2.767 2.727 2.795 . 0 0 "[ . 1 . 2]" 1
2766 1 94 ILE H 1 94 ILE MD . . 3.990 3.236 3.159 3.346 . 0 0 "[ . 1 . 2]" 1
2767 1 94 ILE H 1 94 ILE HG12 . . 3.740 3.762 3.751 3.766 0.026 9 0 "[ . 1 . 2]" 1
2768 1 94 ILE H 1 94 ILE HG13 . . 3.510 2.250 2.237 2.272 . 0 0 "[ . 1 . 2]" 1
2769 1 94 ILE H 1 94 ILE MG . . 4.040 3.877 3.872 3.886 . 0 0 "[ . 1 . 2]" 1
2770 1 94 ILE H 1 95 ILE MD . . 5.430 4.881 4.843 5.061 . 0 0 "[ . 1 . 2]" 1
2771 1 94 ILE H 1 95 ILE HG12 . . 4.690 4.434 4.406 4.478 . 0 0 "[ . 1 . 2]" 1
2772 1 94 ILE HA 1 94 ILE MD . . 3.900 3.982 3.973 3.989 0.089 10 0 "[ . 1 . 2]" 1
2773 1 94 ILE HA 1 94 ILE HG12 . . 3.800 2.993 2.913 3.035 . 0 0 "[ . 1 . 2]" 1
2774 1 94 ILE HA 1 94 ILE HG13 . . 3.480 2.906 2.884 2.934 . 0 0 "[ . 1 . 2]" 1
2775 1 94 ILE HA 1 94 ILE MG . . 3.280 2.287 2.278 2.304 . 0 0 "[ . 1 . 2]" 1
2776 1 94 ILE HB 1 94 ILE MD . . 3.480 2.273 2.257 2.302 . 0 0 "[ . 1 . 2]" 1
2777 1 94 ILE HB 1 95 ILE H . . 3.170 2.438 2.424 2.459 . 0 0 "[ . 1 . 2]" 1
2778 1 94 ILE HB 1 95 ILE MD . . 5.270 3.163 3.111 3.379 . 0 0 "[ . 1 . 2]" 1
2779 1 94 ILE HB 1 95 ILE HG13 . . 4.950 4.232 4.197 4.247 . 0 0 "[ . 1 . 2]" 1
2780 1 94 ILE MD 1 95 ILE H . . 4.550 3.897 3.836 4.017 . 0 0 "[ . 1 . 2]" 1
2781 1 94 ILE HG13 1 95 ILE H . . 3.990 3.983 3.944 4.005 0.015 3 0 "[ . 1 . 2]" 1
2782 1 94 ILE MG 1 95 ILE H . . 3.660 3.611 3.549 3.646 . 0 0 "[ . 1 . 2]" 1
2783 1 94 ILE MG 1 95 ILE MD . . 3.470 2.232 2.124 2.413 . 0 0 "[ . 1 . 2]" 1
2784 1 94 ILE MG 1 95 ILE HG13 . . 4.380 4.258 4.149 4.310 . 0 0 "[ . 1 . 2]" 1
2785 1 95 ILE H 1 95 ILE HB . . 3.390 2.736 2.684 2.762 . 0 0 "[ . 1 . 2]" 1
2786 1 95 ILE H 1 95 ILE MD . . 4.310 3.337 3.308 3.481 . 0 0 "[ . 1 . 2]" 1
2787 1 95 ILE H 1 95 ILE HG12 . . 3.770 2.557 2.540 2.594 . 0 0 "[ . 1 . 2]" 1
2788 1 95 ILE H 1 95 ILE HG13 . . 4.000 4.011 4.004 4.019 0.019 2 0 "[ . 1 . 2]" 1
2789 1 95 ILE H 1 96 PRO HA . . 4.960 4.968 4.961 4.970 0.010 14 0 "[ . 1 . 2]" 1
2790 1 95 ILE H 1 96 PRO HD2 . . 4.600 4.657 4.647 4.665 0.065 13 0 "[ . 1 . 2]" 1
2791 1 95 ILE H 1 96 PRO HD3 . . 4.870 4.149 4.136 4.172 . 0 0 "[ . 1 . 2]" 1
2792 1 95 ILE HA 1 95 ILE MD . . 3.890 2.260 2.250 2.265 . 0 0 "[ . 1 . 2]" 1
2793 1 95 ILE HA 1 95 ILE HG12 . . 3.970 3.328 3.246 3.348 . 0 0 "[ . 1 . 2]" 1
2794 1 95 ILE HA 1 95 ILE HG13 . . 4.150 3.836 3.828 3.851 . 0 0 "[ . 1 . 2]" 1
2795 1 95 ILE HA 1 95 ILE MG . . 3.250 2.343 2.305 2.394 . 0 0 "[ . 1 . 2]" 1
2796 1 95 ILE HA 1 96 PRO HD2 . . 3.350 2.090 2.085 2.099 . 0 0 "[ . 1 . 2]" 1
2797 1 95 ILE HA 1 96 PRO HD3 . . 3.420 2.648 2.621 2.666 . 0 0 "[ . 1 . 2]" 1
2798 1 95 ILE HA 1 96 PRO QG . . 4.380 3.928 3.921 3.934 . 0 0 "[ . 1 . 2]" 1
2799 1 95 ILE HB 1 96 PRO HD2 . . 5.770 4.737 4.710 4.767 . 0 0 "[ . 1 . 2]" 1
2800 1 95 ILE MD 1 95 ILE MG . . 3.150 2.200 2.141 2.248 . 0 0 "[ . 1 . 2]" 1
2801 1 95 ILE MD 1 96 PRO HD2 . . 4.670 3.726 3.671 3.744 . 0 0 "[ . 1 . 2]" 1
2802 1 95 ILE MD 1 96 PRO HD3 . . 4.630 4.235 4.225 4.255 . 0 0 "[ . 1 . 2]" 1
2803 1 95 ILE MD 1 101 LEU MD1 . . 3.430 2.619 2.578 2.652 . 0 0 "[ . 1 . 2]" 1
2804 1 95 ILE MD 1 101 LEU QD . . 2.930 1.940 1.930 1.944 . 0 0 "[ . 1 . 2]" 1
2805 1 95 ILE MD 1 101 LEU MD2 . . 3.430 2.000 1.986 2.011 . 0 0 "[ . 1 . 2]" 1
2806 1 95 ILE MD 1 101 LEU HG . . 4.090 4.101 4.095 4.105 0.015 17 0 "[ . 1 . 2]" 1
2807 1 95 ILE MD 1 103 PHE HZ . . 4.920 3.940 3.696 4.070 . 0 0 "[ . 1 . 2]" 1
2808 1 95 ILE HG13 1 95 ILE MG . . 3.670 2.298 2.282 2.341 . 0 0 "[ . 1 . 2]" 1
2809 1 95 ILE HG13 1 96 PRO HD2 . . 5.710 5.746 5.739 5.753 0.043 12 0 "[ . 1 . 2]" 1
2810 1 95 ILE HG13 1 101 LEU QD . . 4.920 3.352 3.287 3.456 . 0 0 "[ . 1 . 2]" 1
2811 1 95 ILE MG 1 96 PRO HA . . 4.760 4.528 4.455 4.547 . 0 0 "[ . 1 . 2]" 1
2812 1 95 ILE MG 1 96 PRO HD2 . . 3.660 3.152 3.085 3.193 . 0 0 "[ . 1 . 2]" 1
2813 1 95 ILE MG 1 96 PRO HD3 . . 4.350 4.247 4.202 4.270 . 0 0 "[ . 1 . 2]" 1
2814 1 95 ILE MG 1 99 ALA H . . 4.660 4.593 4.563 4.635 . 0 0 "[ . 1 . 2]" 1
2815 1 95 ILE MG 1 99 ALA MB . . 3.540 3.530 3.418 3.555 0.015 13 0 "[ . 1 . 2]" 1
2816 1 95 ILE MG 1 101 LEU HG . . 3.840 3.527 3.473 3.676 . 0 0 "[ . 1 . 2]" 1
2817 1 96 PRO HA 1 97 PRO HD2 . . 3.170 2.740 2.733 2.751 . 0 0 "[ . 1 . 2]" 1
2818 1 96 PRO HA 1 97 PRO HD3 . . 3.400 2.399 2.384 2.409 . 0 0 "[ . 1 . 2]" 1
2819 1 96 PRO HA 1 97 PRO HG3 . . 5.490 4.633 4.620 4.642 . 0 0 "[ . 1 . 2]" 1
2820 1 96 PRO HA 1 99 ALA MB . . 4.560 4.586 4.576 4.610 0.050 3 0 "[ . 1 . 2]" 1
2821 1 96 PRO QB 1 97 PRO HD2 . . 3.100 2.204 2.200 2.209 . 0 0 "[ . 1 . 2]" 1
2822 1 96 PRO HB2 1 97 PRO HD2 . . 3.730 2.265 2.263 2.268 . 0 0 "[ . 1 . 2]" 1
2823 1 96 PRO HB2 1 97 PRO HD3 . . 3.830 3.558 3.547 3.565 . 0 0 "[ . 1 . 2]" 1
2824 1 96 PRO HB3 1 97 PRO HD2 . . 3.730 3.016 3.000 3.040 . 0 0 "[ . 1 . 2]" 1
2825 1 96 PRO HB3 1 97 PRO HD3 . . 3.830 3.838 3.836 3.843 0.013 3 0 "[ . 1 . 2]" 1
2826 1 96 PRO HD2 1 99 ALA MB . . 3.980 3.016 2.988 3.034 . 0 0 "[ . 1 . 2]" 1
2827 1 96 PRO HD3 1 99 ALA MB . . 4.180 4.189 4.183 4.199 0.019 13 0 "[ . 1 . 2]" 1
2828 1 96 PRO QG 1 97 PRO HD2 . . 4.020 4.114 4.112 4.117 0.097 13 0 "[ . 1 . 2]" 1
2829 1 96 PRO QG 1 99 ALA HA . . 4.850 4.469 4.463 4.485 . 0 0 "[ . 1 . 2]" 1
2830 1 96 PRO QG 1 99 ALA MB . . 3.340 2.021 2.004 2.052 . 0 0 "[ . 1 . 2]" 1
2831 1 97 PRO HA 1 98 HIS H . . 3.050 2.201 2.191 2.216 . 0 0 "[ . 1 . 2]" 1
2832 1 97 PRO HA 1 98 HIS HA . . 4.660 4.400 4.392 4.405 . 0 0 "[ . 1 . 2]" 1
2833 1 97 PRO HA 1 99 ALA H . . 4.340 3.830 3.699 3.920 . 0 0 "[ . 1 . 2]" 1
2834 1 97 PRO HA 1 99 ALA MB . . 4.550 4.417 4.368 4.436 . 0 0 "[ . 1 . 2]" 1
2835 1 97 PRO HB2 1 98 HIS H . . 4.220 3.222 3.139 3.253 . 0 0 "[ . 1 . 2]" 1
2836 1 97 PRO HB2 1 98 HIS HB2 . . 4.640 3.894 3.840 3.917 . 0 0 "[ . 1 . 2]" 1
2837 1 97 PRO HB2 1 98 HIS HD2 . . 3.530 2.321 2.308 2.344 . 0 0 "[ . 1 . 2]" 1
2838 1 97 PRO HB3 1 98 HIS H . . 4.100 3.829 3.769 3.846 . 0 0 "[ . 1 . 2]" 1
2839 1 97 PRO HB3 1 98 HIS HD2 . . 4.220 4.029 4.015 4.049 . 0 0 "[ . 1 . 2]" 1
2840 1 97 PRO HD2 1 99 ALA MB . . 4.930 4.651 4.614 4.718 . 0 0 "[ . 1 . 2]" 1
2841 1 97 PRO HG2 1 98 HIS H . . 5.040 4.831 4.797 4.847 . 0 0 "[ . 1 . 2]" 1
2842 1 97 PRO HG2 1 98 HIS HB2 . . 5.750 4.444 4.396 4.493 . 0 0 "[ . 1 . 2]" 1
2843 1 97 PRO HG2 1 98 HIS HD2 . . 4.410 3.654 3.643 3.666 . 0 0 "[ . 1 . 2]" 1
2844 1 97 PRO HG3 1 98 HIS HB2 . . 6.000 5.939 5.893 5.983 . 0 0 "[ . 1 . 2]" 1
2845 1 97 PRO HG3 1 98 HIS HD2 . . 4.540 4.556 4.551 4.560 0.020 18 0 "[ . 1 . 2]" 1
2846 1 98 HIS H 1 98 HIS HB2 . . 3.830 3.576 3.548 3.589 . 0 0 "[ . 1 . 2]" 1
2847 1 98 HIS H 1 99 ALA H . . 3.370 2.805 2.788 2.828 . 0 0 "[ . 1 . 2]" 1
2848 1 98 HIS H 1 99 ALA HA . . 6.000 5.386 5.380 5.391 . 0 0 "[ . 1 . 2]" 1
2849 1 98 HIS H 1 99 ALA MB . . 4.470 4.397 4.369 4.423 . 0 0 "[ . 1 . 2]" 1
2850 1 98 HIS HA 1 98 HIS HD2 . . 4.900 4.384 4.371 4.404 . 0 0 "[ . 1 . 2]" 1
2851 1 98 HIS HA 1 99 ALA H . . 3.360 2.740 2.673 2.805 . 0 0 "[ . 1 . 2]" 1
2852 1 98 HIS HA 1 99 ALA HA . . 4.560 4.464 4.446 4.492 . 0 0 "[ . 1 . 2]" 1
2853 1 98 HIS HA 1 99 ALA MB . . 5.380 4.564 4.521 4.605 . 0 0 "[ . 1 . 2]" 1
2854 1 98 HIS HB2 1 98 HIS HD2 . . 3.200 2.728 2.725 2.731 . 0 0 "[ . 1 . 2]" 1
2855 1 98 HIS HB2 1 99 ALA H . . 5.710 4.322 4.267 4.364 . 0 0 "[ . 1 . 2]" 1
2856 1 98 HIS HB2 1 99 ALA HA . . 5.700 4.947 4.937 4.969 . 0 0 "[ . 1 . 2]" 1
2857 1 98 HIS HB2 1 99 ALA MB . . 5.860 4.711 4.698 4.729 . 0 0 "[ . 1 . 2]" 1
2858 1 98 HIS HB3 1 99 ALA H . . 4.550 4.470 4.455 4.476 . 0 0 "[ . 1 . 2]" 1
2859 1 98 HIS HB3 1 99 ALA HA . . 5.570 4.875 4.862 4.896 . 0 0 "[ . 1 . 2]" 1
2860 1 98 HIS HB3 1 99 ALA MB . . 5.960 5.242 5.230 5.250 . 0 0 "[ . 1 . 2]" 1
2861 1 99 ALA H 1 99 ALA MB . . 2.880 2.471 2.440 2.493 . 0 0 "[ . 1 . 2]" 1
2862 1 99 ALA H 1 100 THR H . . 4.300 4.339 4.333 4.346 0.046 3 0 "[ . 1 . 2]" 1
2863 1 99 ALA HA 1 100 THR H . . 2.550 2.095 2.087 2.113 . 0 0 "[ . 1 . 2]" 1
2864 1 99 ALA HA 1 100 THR HA . . 4.510 4.361 4.353 4.369 . 0 0 "[ . 1 . 2]" 1
2865 1 99 ALA HA 1 100 THR HB . . 4.650 4.711 4.706 4.722 0.072 3 0 "[ . 1 . 2]" 1
2866 1 99 ALA HA 1 100 THR MG . . 5.490 5.392 5.388 5.399 . 0 0 "[ . 1 . 2]" 1
2867 1 99 ALA MB 1 100 THR H . . 3.460 2.975 2.910 3.044 . 0 0 "[ . 1 . 2]" 1
2868 1 99 ALA MB 1 100 THR HA . . 4.590 4.384 4.373 4.400 . 0 0 "[ . 1 . 2]" 1
2869 1 100 THR H 1 100 THR HB . . 2.930 2.632 2.626 2.639 . 0 0 "[ . 1 . 2]" 1
2870 1 100 THR H 1 100 THR MG . . 3.810 3.789 3.784 3.792 . 0 0 "[ . 1 . 2]" 1
2871 1 100 THR H 1 101 LEU H . . 4.670 4.575 4.552 4.589 . 0 0 "[ . 1 . 2]" 1
2872 1 100 THR H 1 101 LEU QD . . 5.330 5.008 4.930 5.030 . 0 0 "[ . 1 . 2]" 1
2873 1 100 THR HA 1 100 THR MG . . 3.150 2.339 2.331 2.352 . 0 0 "[ . 1 . 2]" 1
2874 1 100 THR HA 1 101 LEU H . . 2.870 2.196 2.171 2.225 . 0 0 "[ . 1 . 2]" 1
2875 1 100 THR HA 1 101 LEU HA . . 4.980 4.416 4.406 4.432 . 0 0 "[ . 1 . 2]" 1
2876 1 100 THR HA 1 101 LEU HB2 . . 5.060 4.607 4.539 4.672 . 0 0 "[ . 1 . 2]" 1
2877 1 100 THR HA 1 101 LEU HB3 . . 5.780 5.632 5.618 5.638 . 0 0 "[ . 1 . 2]" 1
2878 1 100 THR HA 1 101 LEU QD . . 4.910 4.054 4.025 4.081 . 0 0 "[ . 1 . 2]" 1
2879 1 100 THR HB 1 101 LEU H . . 4.500 3.902 3.826 3.970 . 0 0 "[ . 1 . 2]" 1
2880 1 100 THR MG 1 101 LEU H . . 3.060 2.436 2.326 2.546 . 0 0 "[ . 1 . 2]" 1
2881 1 101 LEU H 1 101 LEU HB2 . . 2.970 2.645 2.627 2.672 . 0 0 "[ . 1 . 2]" 1
2882 1 101 LEU H 1 101 LEU HB3 . . 3.890 3.752 3.725 3.784 . 0 0 "[ . 1 . 2]" 1
2883 1 101 LEU H 1 101 LEU MD1 . . 4.210 3.420 3.306 3.535 . 0 0 "[ . 1 . 2]" 1
2884 1 101 LEU H 1 101 LEU QD . . 3.640 3.253 3.145 3.353 . 0 0 "[ . 1 . 2]" 1
2885 1 101 LEU H 1 101 LEU MD2 . . 4.210 4.073 3.939 4.167 . 0 0 "[ . 1 . 2]" 1
2886 1 101 LEU H 1 101 LEU HG . . 2.970 2.803 2.588 2.970 0.000 3 0 "[ . 1 . 2]" 1
2887 1 101 LEU H 1 103 PHE QD . . 6.000 5.425 5.365 5.457 . 0 0 "[ . 1 . 2]" 1
2888 1 101 LEU H 1 103 PHE QE . . 5.080 4.861 4.809 4.897 . 0 0 "[ . 1 . 2]" 1
2889 1 101 LEU HA 1 101 LEU MD1 . . 4.040 3.954 3.937 3.976 . 0 0 "[ . 1 . 2]" 1
2890 1 101 LEU HA 1 101 LEU QD . . 2.930 2.460 2.434 2.491 . 0 0 "[ . 1 . 2]" 1
2891 1 101 LEU HA 1 101 LEU MD2 . . 4.040 2.485 2.457 2.517 . 0 0 "[ . 1 . 2]" 1
2892 1 101 LEU HA 1 102 VAL H . . 2.850 2.302 2.277 2.345 . 0 0 "[ . 1 . 2]" 1
2893 1 101 LEU HA 1 102 VAL QG . . 4.330 3.333 3.298 3.378 . 0 0 "[ . 1 . 2]" 1
2894 1 101 LEU HB2 1 101 LEU MD1 . . 3.280 2.178 2.170 2.183 . 0 0 "[ . 1 . 2]" 1
2895 1 101 LEU HB2 1 101 LEU QD . . 2.820 2.140 2.132 2.145 . 0 0 "[ . 1 . 2]" 1
2896 1 101 LEU HB2 1 101 LEU MD2 . . 3.280 3.137 3.130 3.144 . 0 0 "[ . 1 . 2]" 1
2897 1 101 LEU HB2 1 103 PHE QD . . 4.010 3.541 3.288 3.629 . 0 0 "[ . 1 . 2]" 1
2898 1 101 LEU HB2 1 103 PHE QE . . 3.930 2.305 2.255 2.327 . 0 0 "[ . 1 . 2]" 1
2899 1 101 LEU HB2 1 103 PHE HZ . . 5.480 4.301 4.188 4.413 . 0 0 "[ . 1 . 2]" 1
2900 1 101 LEU HB3 1 101 LEU MD1 . . 3.200 2.648 2.631 2.663 . 0 0 "[ . 1 . 2]" 1
2901 1 101 LEU HB3 1 101 LEU MD2 . . 3.200 2.228 2.221 2.236 . 0 0 "[ . 1 . 2]" 1
2902 1 101 LEU HB3 1 102 VAL H . . 3.600 2.672 2.608 2.734 . 0 0 "[ . 1 . 2]" 1
2903 1 101 LEU HB3 1 103 PHE HB2 . . 6.000 6.008 5.948 6.024 0.024 15 0 "[ . 1 . 2]" 1
2904 1 101 LEU HB3 1 103 PHE QD . . 4.450 3.828 3.709 3.890 . 0 0 "[ . 1 . 2]" 1
2905 1 101 LEU HB3 1 103 PHE QE . . 4.150 2.610 2.493 2.680 . 0 0 "[ . 1 . 2]" 1
2906 1 101 LEU HB3 1 103 PHE HZ . . 4.700 3.748 3.637 3.887 . 0 0 "[ . 1 . 2]" 1
2907 1 101 LEU QD 1 102 VAL H . . 3.800 3.567 3.516 3.636 . 0 0 "[ . 1 . 2]" 1
2908 1 101 LEU QD 1 103 PHE QD . . 4.700 4.170 3.974 4.221 . 0 0 "[ . 1 . 2]" 1
2909 1 101 LEU QD 1 103 PHE QE . . 3.580 2.453 2.225 2.519 . 0 0 "[ . 1 . 2]" 1
2910 1 101 LEU QD 1 103 PHE HZ . . 3.790 2.888 2.776 2.946 . 0 0 "[ . 1 . 2]" 1
2911 1 102 VAL H 1 102 VAL HB . . 3.670 2.728 2.684 2.758 . 0 0 "[ . 1 . 2]" 1
2912 1 102 VAL H 1 102 VAL MG1 . . 4.310 3.916 3.898 3.927 . 0 0 "[ . 1 . 2]" 1
2913 1 102 VAL H 1 102 VAL QG . . 3.020 2.650 2.567 2.752 . 0 0 "[ . 1 . 2]" 1
2914 1 102 VAL H 1 102 VAL MG2 . . 4.310 2.696 2.602 2.811 . 0 0 "[ . 1 . 2]" 1
2915 1 102 VAL H 1 103 PHE H . . 4.520 4.342 4.153 4.388 . 0 0 "[ . 1 . 2]" 1
2916 1 102 VAL H 1 103 PHE HA . . 5.460 4.943 4.796 4.986 . 0 0 "[ . 1 . 2]" 1
2917 1 102 VAL H 1 103 PHE QE . . 5.790 4.523 4.387 4.625 . 0 0 "[ . 1 . 2]" 1
2918 1 102 VAL HA 1 102 VAL MG1 . . 3.120 2.367 2.340 2.391 . 0 0 "[ . 1 . 2]" 1
2919 1 102 VAL HA 1 102 VAL MG2 . . 3.120 2.462 2.427 2.496 . 0 0 "[ . 1 . 2]" 1
2920 1 102 VAL HA 1 103 PHE H . . 2.770 2.165 2.146 2.184 . 0 0 "[ . 1 . 2]" 1
2921 1 102 VAL HA 1 103 PHE HA . . 4.770 4.429 4.420 4.440 . 0 0 "[ . 1 . 2]" 1
2922 1 102 VAL HA 1 103 PHE HB2 . . 4.590 4.453 4.433 4.518 . 0 0 "[ . 1 . 2]" 1
2923 1 102 VAL HA 1 103 PHE HB3 . . 6.000 5.681 5.671 5.723 . 0 0 "[ . 1 . 2]" 1
2924 1 102 VAL HA 1 103 PHE QD . . 4.750 3.698 3.583 3.765 . 0 0 "[ . 1 . 2]" 1
2925 1 102 VAL HB 1 103 PHE HA . . 5.130 4.727 4.649 4.873 . 0 0 "[ . 1 . 2]" 1
2926 1 102 VAL QG 1 103 PHE H . . 3.120 2.660 2.559 2.957 . 0 0 "[ . 1 . 2]" 1
2927 1 102 VAL MG1 1 103 PHE H . . 4.330 2.695 2.587 3.024 . 0 0 "[ . 1 . 2]" 1
2928 1 102 VAL MG2 1 103 PHE H . . 4.330 4.108 4.061 4.182 . 0 0 "[ . 1 . 2]" 1
2929 1 103 PHE H 1 103 PHE HB2 . . 3.500 2.635 2.515 2.677 . 0 0 "[ . 1 . 2]" 1
2930 1 103 PHE H 1 103 PHE HB3 . . 3.770 3.773 3.706 3.796 0.026 3 0 "[ . 1 . 2]" 1
2931 1 103 PHE H 1 103 PHE QD . . 3.890 3.082 2.822 3.187 . 0 0 "[ . 1 . 2]" 1
2932 1 103 PHE H 1 104 ASP H . . 4.530 4.338 4.311 4.432 . 0 0 "[ . 1 . 2]" 1
2933 1 103 PHE HA 1 103 PHE QD . . 4.130 2.940 2.882 3.011 . 0 0 "[ . 1 . 2]" 1
2934 1 103 PHE HA 1 104 ASP H . . 2.840 2.165 2.157 2.175 . 0 0 "[ . 1 . 2]" 1
2935 1 103 PHE HA 1 104 ASP HA . . 5.110 4.398 4.394 4.404 . 0 0 "[ . 1 . 2]" 1
2936 1 103 PHE HA 1 104 ASP HB3 . . 5.020 4.816 4.771 4.875 . 0 0 "[ . 1 . 2]" 1
2937 1 103 PHE HA 1 105 VAL MG1 . . 5.110 4.758 4.712 4.811 . 0 0 "[ . 1 . 2]" 1
2938 1 103 PHE HB2 1 104 ASP H . . 4.440 4.194 4.157 4.215 . 0 0 "[ . 1 . 2]" 1
2939 1 103 PHE HB3 1 104 ASP H . . 3.650 3.162 3.096 3.195 . 0 0 "[ . 1 . 2]" 1
2940 1 103 PHE HB3 1 105 VAL MG1 . . 3.230 3.089 3.046 3.129 . 0 0 "[ . 1 . 2]" 1
2941 1 103 PHE QD 1 104 ASP H . . 4.430 3.940 3.871 4.006 . 0 0 "[ . 1 . 2]" 1
2942 1 103 PHE QD 1 105 VAL MG1 . . 4.280 4.143 4.073 4.191 . 0 0 "[ . 1 . 2]" 1
2943 1 104 ASP H 1 104 ASP HB2 . . 3.100 2.809 2.770 2.849 . 0 0 "[ . 1 . 2]" 1
2944 1 104 ASP H 1 104 ASP HB3 . . 3.360 2.799 2.767 2.849 . 0 0 "[ . 1 . 2]" 1
2945 1 104 ASP H 1 105 VAL H . . 4.360 4.102 4.075 4.125 . 0 0 "[ . 1 . 2]" 1
2946 1 104 ASP H 1 105 VAL MG1 . . 4.240 3.950 3.925 3.977 . 0 0 "[ . 1 . 2]" 1
2947 1 104 ASP HA 1 105 VAL H . . 2.740 2.174 2.168 2.182 . 0 0 "[ . 1 . 2]" 1
2948 1 104 ASP HA 1 105 VAL MG2 . . 4.300 4.021 4.001 4.072 . 0 0 "[ . 1 . 2]" 1
2949 1 104 ASP HB2 1 105 VAL H . . 4.730 4.570 4.555 4.594 . 0 0 "[ . 1 . 2]" 1
2950 1 104 ASP HB3 1 105 VAL H . . 4.390 4.323 4.297 4.344 . 0 0 "[ . 1 . 2]" 1
2951 1 104 ASP HB3 1 105 VAL MG1 . . 6.000 5.095 5.058 5.122 . 0 0 "[ . 1 . 2]" 1
2952 1 105 VAL H 1 105 VAL HB . . 3.760 3.784 3.778 3.790 0.030 5 0 "[ . 1 . 2]" 1
2953 1 105 VAL H 1 105 VAL MG1 . . 3.450 2.803 2.780 2.829 . 0 0 "[ . 1 . 2]" 1
2954 1 105 VAL H 1 105 VAL MG2 . . 3.830 2.157 2.136 2.226 . 0 0 "[ . 1 . 2]" 1
2955 1 105 VAL H 1 106 GLU H . . 4.680 4.533 4.526 4.540 . 0 0 "[ . 1 . 2]" 1
2956 1 105 VAL HA 1 105 VAL MG1 . . 3.450 2.330 2.315 2.344 . 0 0 "[ . 1 . 2]" 1
2957 1 105 VAL HA 1 105 VAL MG2 . . 3.320 3.232 3.231 3.233 . 0 0 "[ . 1 . 2]" 1
2958 1 105 VAL HA 1 106 GLU H . . 2.880 2.276 2.269 2.285 . 0 0 "[ . 1 . 2]" 1
2959 1 105 VAL HA 1 106 GLU HA . . 4.680 4.421 4.415 4.431 . 0 0 "[ . 1 . 2]" 1
2960 1 105 VAL HA 1 106 GLU HB3 . . 4.610 4.546 4.538 4.558 . 0 0 "[ . 1 . 2]" 1
2961 1 105 VAL HA 1 106 GLU HG2 . . 4.440 3.638 3.605 3.661 . 0 0 "[ . 1 . 2]" 1
2962 1 105 VAL MG1 1 106 GLU H . . 4.100 3.787 3.778 3.798 . 0 0 "[ . 1 . 2]" 1
2963 1 105 VAL MG2 1 106 GLU H . . 3.560 3.576 3.568 3.582 0.022 17 0 "[ . 1 . 2]" 1
2964 1 105 VAL MG2 1 106 GLU HA . . 4.120 3.887 3.872 3.900 . 0 0 "[ . 1 . 2]" 1
2965 1 105 VAL MG2 1 107 LEU H . . 4.700 4.476 4.426 4.502 . 0 0 "[ . 1 . 2]" 1
2966 1 106 GLU H 1 106 GLU HB2 . . 3.920 3.822 3.810 3.833 . 0 0 "[ . 1 . 2]" 1
2967 1 106 GLU H 1 106 GLU HB3 . . 3.650 3.351 3.334 3.363 . 0 0 "[ . 1 . 2]" 1
2968 1 106 GLU H 1 106 GLU HG2 . . 3.660 2.390 2.361 2.412 . 0 0 "[ . 1 . 2]" 1
2969 1 106 GLU H 1 106 GLU HG3 . . 3.930 3.002 2.974 3.025 . 0 0 "[ . 1 . 2]" 1
2970 1 106 GLU H 1 107 LEU H . . 4.450 4.261 4.243 4.279 . 0 0 "[ . 1 . 2]" 1
2971 1 106 GLU H 1 107 LEU HA . . 4.970 4.807 4.747 4.837 . 0 0 "[ . 1 . 2]" 1
2972 1 106 GLU HA 1 106 GLU HG2 . . 3.890 3.743 3.732 3.751 . 0 0 "[ . 1 . 2]" 1
2973 1 106 GLU HA 1 106 GLU HG3 . . 4.150 3.826 3.822 3.835 . 0 0 "[ . 1 . 2]" 1
2974 1 106 GLU HA 1 107 LEU H . . 2.850 2.128 2.114 2.149 . 0 0 "[ . 1 . 2]" 1
2975 1 106 GLU HA 1 107 LEU HA . . 5.600 4.369 4.364 4.374 . 0 0 "[ . 1 . 2]" 1
2976 1 106 GLU HA 1 107 LEU HB2 . . 4.560 4.078 4.039 4.149 . 0 0 "[ . 1 . 2]" 1
2977 1 106 GLU HA 1 107 LEU HB3 . . 5.480 5.189 5.146 5.305 . 0 0 "[ . 1 . 2]" 1
2978 1 106 GLU HB2 1 107 LEU H . . 3.620 3.323 3.296 3.381 . 0 0 "[ . 1 . 2]" 1
2979 1 106 GLU HB3 1 107 LEU H . . 4.440 4.128 4.109 4.173 . 0 0 "[ . 1 . 2]" 1
2980 1 106 GLU HG2 1 108 LEU MD2 . . 3.770 3.776 3.770 3.787 0.017 7 0 "[ . 1 . 2]" 1
2981 1 106 GLU HG3 1 107 LEU HA . . 5.160 5.018 4.938 5.051 . 0 0 "[ . 1 . 2]" 1
2982 1 106 GLU HG3 1 108 LEU MD2 . . 2.930 2.412 2.404 2.423 . 0 0 "[ . 1 . 2]" 1
2983 1 107 LEU H 1 107 LEU HB2 . . 3.220 2.072 2.051 2.106 . 0 0 "[ . 1 . 2]" 1
2984 1 107 LEU H 1 107 LEU HB3 . . 3.380 3.067 3.036 3.164 . 0 0 "[ . 1 . 2]" 1
2985 1 107 LEU H 1 107 LEU MD1 . . 5.080 4.221 3.903 4.303 . 0 0 "[ . 1 . 2]" 1
2986 1 107 LEU H 1 107 LEU QD . . 3.800 3.371 3.288 3.664 . 0 0 "[ . 1 . 2]" 1
2987 1 107 LEU H 1 107 LEU MD2 . . 5.080 3.623 3.414 4.406 . 0 0 "[ . 1 . 2]" 1
2988 1 107 LEU H 1 107 LEU HG . . 4.490 4.350 3.877 4.475 . 0 0 "[ . 1 . 2]" 1
2989 1 107 LEU H 1 108 LEU H . . 4.510 4.303 4.284 4.313 . 0 0 "[ . 1 . 2]" 1
2990 1 107 LEU HA 1 107 LEU MD1 . . 3.930 2.713 2.458 3.691 . 0 0 "[ . 1 . 2]" 1
2991 1 107 LEU HA 1 107 LEU QD . . 2.880 2.219 2.106 2.641 . 0 0 "[ . 1 . 2]" 1
2992 1 107 LEU HA 1 107 LEU MD2 . . 3.930 2.380 2.288 2.705 . 0 0 "[ . 1 . 2]" 1
2993 1 107 LEU HA 1 108 LEU H . . 3.080 2.204 2.145 2.237 . 0 0 "[ . 1 . 2]" 1
2994 1 107 LEU HA 1 108 LEU HA . . 5.190 4.452 4.419 4.465 . 0 0 "[ . 1 . 2]" 1
2995 1 107 LEU HA 1 108 LEU HB2 . . 4.930 4.787 4.710 4.831 . 0 0 "[ . 1 . 2]" 1
2996 1 107 LEU HA 1 108 LEU HB3 . . 5.910 5.774 5.713 5.806 . 0 0 "[ . 1 . 2]" 1
2997 1 107 LEU HA 1 108 LEU HG . . 3.930 3.876 3.783 3.928 . 0 0 "[ . 1 . 2]" 1
2998 1 107 LEU HB2 1 107 LEU MD1 . . 3.430 3.006 2.147 3.221 . 0 0 "[ . 1 . 2]" 1
2999 1 107 LEU HB2 1 107 LEU QD . . 2.850 2.224 2.115 2.264 . 0 0 "[ . 1 . 2]" 1
3000 1 107 LEU HB2 1 107 LEU MD2 . . 3.430 2.476 2.281 3.189 . 0 0 "[ . 1 . 2]" 1
3001 1 107 LEU HB2 1 108 LEU H . . 4.700 4.656 4.621 4.678 . 0 0 "[ . 1 . 2]" 1
3002 1 107 LEU HB3 1 107 LEU MD1 . . 3.600 2.460 2.427 2.560 . 0 0 "[ . 1 . 2]" 1
3003 1 107 LEU HB3 1 107 LEU QD . . 2.720 2.317 2.115 2.371 . 0 0 "[ . 1 . 2]" 1
3004 1 107 LEU HB3 1 107 LEU MD2 . . 3.600 3.018 2.257 3.209 . 0 0 "[ . 1 . 2]" 1
3005 1 107 LEU HB3 1 108 LEU H . . 4.230 4.126 4.043 4.156 . 0 0 "[ . 1 . 2]" 1
3006 1 107 LEU QD 1 108 LEU H . . 3.390 3.071 3.003 3.283 . 0 0 "[ . 1 . 2]" 1
3007 1 107 LEU HG 1 108 LEU H . . 5.590 5.184 4.173 5.457 . 0 0 "[ . 1 . 2]" 1
3008 1 108 LEU H 1 108 LEU HB2 . . 3.220 2.593 2.578 2.605 . 0 0 "[ . 1 . 2]" 1
3009 1 108 LEU H 1 108 LEU HB3 . . 3.810 3.645 3.634 3.651 . 0 0 "[ . 1 . 2]" 1
3010 1 108 LEU H 1 108 LEU MD1 . . 3.530 3.321 3.277 3.360 . 0 0 "[ . 1 . 2]" 1
3011 1 108 LEU H 1 108 LEU MD2 . . 3.610 3.659 3.647 3.670 0.060 3 0 "[ . 1 . 2]" 1
3012 1 108 LEU H 1 108 LEU HG . . 3.090 2.296 2.270 2.325 . 0 0 "[ . 1 . 2]" 1
3013 1 108 LEU HA 1 108 LEU MD2 . . 2.880 2.394 2.359 2.415 . 0 0 "[ . 1 . 2]" 1
3014 1 108 LEU HA 1 108 LEU HG . . 3.470 3.012 3.000 3.022 . 0 0 "[ . 1 . 2]" 1
3015 1 108 LEU HB2 1 108 LEU MD1 . . 2.920 2.168 2.154 2.197 . 0 0 "[ . 1 . 2]" 1
3016 1 108 LEU HB2 1 108 LEU MD2 . . 3.420 3.168 3.163 3.175 . 0 0 "[ . 1 . 2]" 1
3017 1 108 LEU HB3 1 108 LEU MD1 . . 3.300 2.618 2.585 2.633 . 0 0 "[ . 1 . 2]" 1
3018 1 108 LEU HB3 1 108 LEU MD2 . . 2.760 2.243 2.235 2.263 . 0 0 "[ . 1 . 2]" 1
3019 1 110 LEU H 1 110 LEU HB2 . . 3.060 2.766 2.735 2.894 . 0 0 "[ . 1 . 2]" 1
3020 1 110 LEU H 1 110 LEU HB3 . . 4.030 3.816 3.758 3.836 . 0 0 "[ . 1 . 2]" 1
3021 1 110 LEU H 1 110 LEU MD1 . . 4.030 3.714 2.735 3.795 . 0 0 "[ . 1 . 2]" 1
3022 1 110 LEU H 1 110 LEU MD2 . . 4.030 3.832 2.019 3.966 . 0 0 "[ . 1 . 2]" 1
3023 1 110 LEU H 1 110 LEU HG . . 3.970 2.874 2.712 4.015 0.045 7 0 "[ . 1 . 2]" 1
3024 1 110 LEU H 1 111 GLU H . . 4.710 4.463 4.436 4.539 . 0 0 "[ . 1 . 2]" 1
3025 1 110 LEU H 1 111 GLU HG2 . . 6.000 5.276 5.168 5.502 . 0 0 "[ . 1 . 2]" 1
3026 1 110 LEU H 1 111 GLU HG3 . . 5.910 4.799 4.693 4.979 . 0 0 "[ . 1 . 2]" 1
3027 1 110 LEU HA 1 110 LEU QD . . 2.940 2.351 2.313 2.462 . 0 0 "[ . 1 . 2]" 1
3028 1 110 LEU HA 1 110 LEU HG . . 3.870 3.125 3.071 3.892 0.022 7 0 "[ . 1 . 2]" 1
3029 1 110 LEU HA 1 111 GLU H . . 2.740 2.249 2.233 2.286 . 0 0 "[ . 1 . 2]" 1
3030 1 110 LEU HA 1 111 GLU HA . . 4.460 4.424 4.417 4.437 . 0 0 "[ . 1 . 2]" 1
3031 1 110 LEU HA 1 111 GLU HB2 . . 5.820 4.456 4.435 4.484 . 0 0 "[ . 1 . 2]" 1
3032 1 110 LEU HA 1 111 GLU HG2 . . 5.020 5.033 5.026 5.036 0.016 16 0 "[ . 1 . 2]" 1
3033 1 110 LEU HA 1 111 GLU HG3 . . 4.070 3.884 3.860 3.906 . 0 0 "[ . 1 . 2]" 1
3034 1 110 LEU HB2 1 110 LEU MD1 . . 3.270 2.266 2.207 3.226 . 0 0 "[ . 1 . 2]" 1
3035 1 110 LEU HB2 1 110 LEU QD . . 2.760 2.172 2.086 2.185 . 0 0 "[ . 1 . 2]" 1
3036 1 110 LEU HB2 1 110 LEU MD2 . . 3.270 3.130 2.113 3.190 . 0 0 "[ . 1 . 2]" 1
3037 1 110 LEU HB2 1 111 GLU H . . 3.840 3.792 3.473 3.841 0.001 18 0 "[ . 1 . 2]" 1
3038 1 110 LEU HB2 1 111 GLU HA . . 4.580 4.574 4.311 4.596 0.016 8 0 "[ . 1 . 2]" 1
3039 1 110 LEU HB3 1 110 LEU MD1 . . 3.490 2.540 2.521 2.572 . 0 0 "[ . 1 . 2]" 1
3040 1 110 LEU HB3 1 110 LEU QD . . 2.800 2.139 2.111 2.463 . 0 0 "[ . 1 . 2]" 1
3041 1 110 LEU HB3 1 110 LEU MD2 . . 3.490 2.319 2.256 3.147 . 0 0 "[ . 1 . 2]" 1
3042 1 110 LEU HB3 1 111 GLU H . . 3.490 2.850 2.780 2.931 . 0 0 "[ . 1 . 2]" 1
3043 1 110 LEU HB3 1 111 GLU HA . . 4.730 4.628 4.590 4.764 0.034 7 0 "[ . 1 . 2]" 1
3044 1 110 LEU HB3 1 111 GLU HG3 . . 6.000 5.564 5.531 5.611 . 0 0 "[ . 1 . 2]" 1
3045 1 110 LEU QD 1 111 GLU H . . 3.960 3.681 3.623 3.954 . 0 0 "[ . 1 . 2]" 1
3046 1 110 LEU HG 1 111 GLU H . . 5.390 5.011 4.988 5.081 . 0 0 "[ . 1 . 2]" 1
3047 1 111 GLU H 1 111 GLU HB2 . . 3.350 2.638 2.613 2.677 . 0 0 "[ . 1 . 2]" 1
3048 1 111 GLU H 1 111 GLU HB3 . . 3.890 3.777 3.762 3.797 . 0 0 "[ . 1 . 2]" 1
3049 1 111 GLU H 1 111 GLU HG2 . . 4.310 4.062 4.024 4.108 . 0 0 "[ . 1 . 2]" 1
3050 1 111 GLU H 1 111 GLU HG3 . . 3.460 3.206 3.150 3.282 . 0 0 "[ . 1 . 2]" 1
3051 1 111 GLU HA 1 111 GLU HG2 . . 3.130 2.449 2.435 2.464 . 0 0 "[ . 1 . 2]" 1
3052 1 111 GLU HA 1 111 GLU HG3 . . 3.640 3.146 3.134 3.162 . 0 0 "[ . 1 . 2]" 1
3053 1 111 GLU HB3 1 111 GLU HG3 . . 2.980 3.001 3.000 3.003 0.023 8 0 "[ . 1 . 2]" 1
stop_
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