NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
405263 |
1x5d   |
11116 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1x5d
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 2877
_Distance_constraint_stats_list.Viol_count 947
_Distance_constraint_stats_list.Viol_total 208.410
_Distance_constraint_stats_list.Viol_max 0.157
_Distance_constraint_stats_list.Viol_rms 0.0028
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0110
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 6 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 VAL 0.008 0.004 5 0 "[ . 1 . 2]"
1 10 ILE 0.015 0.004 5 0 "[ . 1 . 2]"
1 11 GLU 0.068 0.058 15 0 "[ . 1 . 2]"
1 12 LEU 0.052 0.021 10 0 "[ . 1 . 2]"
1 13 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 ASP 0.005 0.002 12 0 "[ . 1 . 2]"
1 15 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 SER 0.082 0.020 4 0 "[ . 1 . 2]"
1 17 PHE 0.230 0.046 13 0 "[ . 1 . 2]"
1 18 ASP 0.072 0.030 9 0 "[ . 1 . 2]"
1 19 LYS 0.004 0.004 19 0 "[ . 1 . 2]"
1 20 ASN 0.071 0.019 9 0 "[ . 1 . 2]"
1 21 VAL 0.048 0.015 13 0 "[ . 1 . 2]"
1 22 LEU 0.071 0.028 6 0 "[ . 1 . 2]"
1 23 ASP 0.081 0.019 15 0 "[ . 1 . 2]"
1 24 SER 0.120 0.028 6 0 "[ . 1 . 2]"
1 25 GLU 0.006 0.004 15 0 "[ . 1 . 2]"
1 26 ASP 0.088 0.058 8 0 "[ . 1 . 2]"
1 27 VAL 0.131 0.058 8 0 "[ . 1 . 2]"
1 28 TRP 0.072 0.019 8 0 "[ . 1 . 2]"
1 29 MET 0.187 0.023 13 0 "[ . 1 . 2]"
1 30 VAL 0.154 0.023 13 0 "[ . 1 . 2]"
1 31 GLU 0.132 0.023 13 0 "[ . 1 . 2]"
1 32 PHE 0.136 0.016 17 0 "[ . 1 . 2]"
1 33 TYR 0.288 0.021 17 0 "[ . 1 . 2]"
1 34 ALA 0.283 0.032 10 0 "[ . 1 . 2]"
1 35 PRO 0.086 0.021 17 0 "[ . 1 . 2]"
1 36 TRP 0.101 0.023 17 0 "[ . 1 . 2]"
1 37 CYS 0.005 0.005 17 0 "[ . 1 . 2]"
1 38 GLY 0.091 0.016 6 0 "[ . 1 . 2]"
1 39 HIS 0.022 0.014 6 0 "[ . 1 . 2]"
1 40 CYS 0.006 0.005 12 0 "[ . 1 . 2]"
1 41 LYS 0.441 0.060 6 0 "[ . 1 . 2]"
1 42 ASN 0.029 0.010 13 0 "[ . 1 . 2]"
1 43 LEU 0.202 0.025 19 0 "[ . 1 . 2]"
1 44 GLU 0.237 0.029 15 0 "[ . 1 . 2]"
1 45 PRO 0.017 0.010 13 0 "[ . 1 . 2]"
1 46 GLU 0.619 0.068 15 0 "[ . 1 . 2]"
1 47 TRP 0.312 0.030 13 0 "[ . 1 . 2]"
1 48 ALA 0.110 0.018 15 0 "[ . 1 . 2]"
1 49 ALA 0.012 0.004 10 0 "[ . 1 . 2]"
1 50 ALA 0.029 0.009 9 0 "[ . 1 . 2]"
1 51 ALA 0.004 0.002 12 0 "[ . 1 . 2]"
1 52 SER 0.006 0.005 9 0 "[ . 1 . 2]"
1 53 GLU 0.054 0.016 17 0 "[ . 1 . 2]"
1 54 VAL 0.142 0.037 19 0 "[ . 1 . 2]"
1 55 LYS 0.282 0.130 9 0 "[ . 1 . 2]"
1 56 GLU 0.193 0.038 19 0 "[ . 1 . 2]"
1 57 GLN 0.069 0.017 16 0 "[ . 1 . 2]"
1 58 THR 0.199 0.021 16 0 "[ . 1 . 2]"
1 59 LYS 0.138 0.023 3 0 "[ . 1 . 2]"
1 60 GLY 0.031 0.013 18 0 "[ . 1 . 2]"
1 61 LYS 0.350 0.088 16 0 "[ . 1 . 2]"
1 62 VAL 0.240 0.088 16 0 "[ . 1 . 2]"
1 63 LYS 0.071 0.010 8 0 "[ . 1 . 2]"
1 64 LEU 0.033 0.008 5 0 "[ . 1 . 2]"
1 65 ALA 0.020 0.004 13 0 "[ . 1 . 2]"
1 66 ALA 0.021 0.005 11 0 "[ . 1 . 2]"
1 67 VAL 0.082 0.018 17 0 "[ . 1 . 2]"
1 68 ASP 0.187 0.044 6 0 "[ . 1 . 2]"
1 69 ALA 0.117 0.040 6 0 "[ . 1 . 2]"
1 70 THR 0.173 0.157 17 0 "[ . 1 . 2]"
1 71 VAL 0.040 0.013 17 0 "[ . 1 . 2]"
1 72 ASN 0.383 0.044 6 0 "[ . 1 . 2]"
1 73 GLN 0.232 0.020 12 0 "[ . 1 . 2]"
1 74 VAL 0.114 0.020 12 0 "[ . 1 . 2]"
1 75 LEU 0.041 0.012 17 0 "[ . 1 . 2]"
1 76 ALA 0.012 0.003 19 0 "[ . 1 . 2]"
1 77 SER 0.489 0.100 19 0 "[ . 1 . 2]"
1 78 ARG 0.007 0.003 12 0 "[ . 1 . 2]"
1 79 TYR 0.079 0.029 17 0 "[ . 1 . 2]"
1 80 GLY 0.001 0.001 20 0 "[ . 1 . 2]"
1 81 ILE 0.023 0.017 18 0 "[ . 1 . 2]"
1 82 ARG 0.210 0.061 12 0 "[ . 1 . 2]"
1 83 GLY 0.125 0.061 12 0 "[ . 1 . 2]"
1 84 PHE 0.093 0.012 17 0 "[ . 1 . 2]"
1 85 PRO 0.014 0.010 10 0 "[ . 1 . 2]"
1 86 THR 0.114 0.026 17 0 "[ . 1 . 2]"
1 87 ILE 0.126 0.020 10 0 "[ . 1 . 2]"
1 88 LYS 0.205 0.026 17 0 "[ . 1 . 2]"
1 89 ILE 0.509 0.050 4 0 "[ . 1 . 2]"
1 90 PHE 0.031 0.008 13 0 "[ . 1 . 2]"
1 91 GLN 0.214 0.053 15 0 "[ . 1 . 2]"
1 92 LYS 0.553 0.073 16 0 "[ . 1 . 2]"
1 93 GLY 0.026 0.010 7 0 "[ . 1 . 2]"
1 94 GLU 0.068 0.018 2 0 "[ . 1 . 2]"
1 95 SER 0.083 0.019 5 0 "[ . 1 . 2]"
1 96 PRO 0.040 0.019 20 0 "[ . 1 . 2]"
1 97 VAL 0.471 0.050 4 0 "[ . 1 . 2]"
1 98 ASP 0.057 0.047 10 0 "[ . 1 . 2]"
1 99 TYR 0.163 0.020 10 0 "[ . 1 . 2]"
1 101 GLY 0.455 0.146 16 0 "[ . 1 . 2]"
1 102 GLY 0.466 0.146 16 0 "[ . 1 . 2]"
1 103 ARG 0.565 0.127 7 0 "[ . 1 . 2]"
1 104 THR 0.276 0.080 10 0 "[ . 1 . 2]"
1 105 ARG 0.138 0.016 7 0 "[ . 1 . 2]"
1 106 SER 0.050 0.014 17 0 "[ . 1 . 2]"
1 107 ASP 0.093 0.015 17 0 "[ . 1 . 2]"
1 108 ILE 0.122 0.033 12 0 "[ . 1 . 2]"
1 109 VAL 0.191 0.033 12 0 "[ . 1 . 2]"
1 110 SER 0.124 0.016 17 0 "[ . 1 . 2]"
1 111 ARG 0.887 0.115 13 0 "[ . 1 . 2]"
1 112 ALA 0.154 0.017 9 0 "[ . 1 . 2]"
1 113 LEU 0.070 0.017 16 0 "[ . 1 . 2]"
1 114 ASP 0.033 0.009 18 0 "[ . 1 . 2]"
1 115 LEU 0.130 0.027 5 0 "[ . 1 . 2]"
1 116 PHE 0.100 0.015 19 0 "[ . 1 . 2]"
1 117 SER 0.003 0.003 17 0 "[ . 1 . 2]"
1 118 ASP 0.001 0.001 3 0 "[ . 1 . 2]"
1 119 ASN 0.039 0.021 8 0 "[ . 1 . 2]"
1 120 ALA 0.097 0.019 17 0 "[ . 1 . 2]"
1 121 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 122 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 123 PRO 0.029 0.018 4 0 "[ . 1 . 2]"
1 124 GLU 0.114 0.057 7 0 "[ . 1 . 2]"
1 125 LEU 0.675 0.147 20 0 "[ . 1 . 2]"
1 126 LEU 0.552 0.147 20 0 "[ . 1 . 2]"
1 127 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 6 SER QB 1 9 VAL HB . . 4.480 3.221 1.911 4.470 . 0 0 "[ . 1 . 2]" 1
2 1 6 SER QB 1 9 VAL QG . . 4.310 3.056 2.022 4.153 . 0 0 "[ . 1 . 2]" 1
3 1 6 SER QB 1 48 ALA MB . . 4.350 3.515 1.929 4.334 . 0 0 "[ . 1 . 2]" 1
4 1 7 GLY H 1 9 VAL H . . 4.890 4.328 3.310 4.883 . 0 0 "[ . 1 . 2]" 1
5 1 7 GLY QA 1 8 ASP H . . 3.400 2.158 2.109 2.256 . 0 0 "[ . 1 . 2]" 1
6 1 7 GLY QA 1 8 ASP QB . . 4.510 3.876 3.635 4.199 . 0 0 "[ . 1 . 2]" 1
7 1 7 GLY QA 1 9 VAL H . . 3.760 3.330 3.057 3.655 . 0 0 "[ . 1 . 2]" 1
8 1 7 GLY QA 1 9 VAL QG . . 4.700 3.539 2.894 4.406 . 0 0 "[ . 1 . 2]" 1
9 1 7 GLY QA 1 48 ALA MB . . 4.830 3.036 1.930 4.698 . 0 0 "[ . 1 . 2]" 1
10 1 8 ASP H 1 8 ASP QB . . 3.620 2.382 2.205 2.738 . 0 0 "[ . 1 . 2]" 1
11 1 8 ASP H 1 9 VAL H . . 3.310 2.661 2.156 2.970 . 0 0 "[ . 1 . 2]" 1
12 1 8 ASP QB 1 52 SER H . . 3.910 3.434 2.838 3.834 . 0 0 "[ . 1 . 2]" 1
13 1 8 ASP QB 1 52 SER HA . . 3.750 3.234 2.805 3.639 . 0 0 "[ . 1 . 2]" 1
14 1 8 ASP QB 1 52 SER QB . . 5.100 3.742 2.829 4.239 . 0 0 "[ . 1 . 2]" 1
15 1 8 ASP QB 1 55 LYS QD . . 3.910 3.061 2.539 3.759 . 0 0 "[ . 1 . 2]" 1
16 1 8 ASP HB2 1 9 VAL H . . 4.730 4.120 2.665 4.641 . 0 0 "[ . 1 . 2]" 1
17 1 8 ASP HB2 1 51 ALA MB . . 3.920 3.213 2.180 3.912 . 0 0 "[ . 1 . 2]" 1
18 1 8 ASP HB2 1 52 SER HA . . 4.350 3.696 3.161 4.346 . 0 0 "[ . 1 . 2]" 1
19 1 8 ASP HB3 1 9 VAL H . . 4.730 3.789 2.887 4.321 . 0 0 "[ . 1 . 2]" 1
20 1 8 ASP HB3 1 51 ALA MB . . 3.920 2.230 1.785 3.070 . 0 0 "[ . 1 . 2]" 1
21 1 8 ASP HB3 1 52 SER HA . . 4.350 3.668 3.057 4.331 . 0 0 "[ . 1 . 2]" 1
22 1 9 VAL H 1 9 VAL HB . . 2.840 2.598 2.412 2.841 0.001 3 0 "[ . 1 . 2]" 1
23 1 9 VAL H 1 9 VAL MG1 . . 4.000 3.677 1.977 3.795 . 0 0 "[ . 1 . 2]" 1
24 1 9 VAL H 1 9 VAL QG . . 2.810 2.075 1.840 2.368 . 0 0 "[ . 1 . 2]" 1
25 1 9 VAL H 1 9 VAL MG2 . . 4.000 2.176 1.845 3.783 . 0 0 "[ . 1 . 2]" 1
26 1 9 VAL H 1 10 ILE H . . 4.650 4.497 4.225 4.613 . 0 0 "[ . 1 . 2]" 1
27 1 9 VAL H 1 47 TRP HD1 . . 5.500 5.402 5.213 5.499 . 0 0 "[ . 1 . 2]" 1
28 1 9 VAL H 1 48 ALA MB . . 4.730 4.231 3.672 4.666 . 0 0 "[ . 1 . 2]" 1
29 1 9 VAL H 1 51 ALA MB . . 3.880 3.609 3.346 3.868 . 0 0 "[ . 1 . 2]" 1
30 1 9 VAL HA 1 9 VAL MG1 . . 3.250 2.388 2.155 3.185 . 0 0 "[ . 1 . 2]" 1
31 1 9 VAL HA 1 9 VAL MG2 . . 3.250 2.406 2.235 2.554 . 0 0 "[ . 1 . 2]" 1
32 1 9 VAL HA 1 10 ILE H . . 3.000 2.161 2.140 2.220 . 0 0 "[ . 1 . 2]" 1
33 1 9 VAL HA 1 10 ILE HA . . 4.660 4.391 4.365 4.446 . 0 0 "[ . 1 . 2]" 1
34 1 9 VAL HA 1 10 ILE HB . . 4.740 4.624 4.550 4.704 . 0 0 "[ . 1 . 2]" 1
35 1 9 VAL HA 1 10 ILE HG12 . . 5.500 5.311 5.091 5.501 0.001 15 0 "[ . 1 . 2]" 1
36 1 9 VAL HA 1 10 ILE HG13 . . 4.470 3.749 3.487 3.941 . 0 0 "[ . 1 . 2]" 1
37 1 9 VAL HA 1 51 ALA MB . . 3.730 3.153 2.722 3.478 . 0 0 "[ . 1 . 2]" 1
38 1 9 VAL HA 1 65 ALA HA . . 4.120 3.495 3.230 3.712 . 0 0 "[ . 1 . 2]" 1
39 1 9 VAL HA 1 66 ALA H . . 5.320 5.044 4.721 5.324 0.004 5 0 "[ . 1 . 2]" 1
40 1 9 VAL HB 1 10 ILE H . . 4.580 4.170 3.904 4.401 . 0 0 "[ . 1 . 2]" 1
41 1 9 VAL HB 1 47 TRP HD1 . . 4.620 4.264 2.650 4.566 . 0 0 "[ . 1 . 2]" 1
42 1 9 VAL HB 1 48 ALA HA . . 4.840 4.348 2.488 4.805 . 0 0 "[ . 1 . 2]" 1
43 1 9 VAL HB 1 66 ALA MB . . 4.870 4.422 4.109 4.854 . 0 0 "[ . 1 . 2]" 1
44 1 9 VAL QG 1 10 ILE H . . 3.190 2.603 2.196 3.141 . 0 0 "[ . 1 . 2]" 1
45 1 9 VAL QG 1 11 GLU HA . . 4.660 4.086 3.824 4.522 . 0 0 "[ . 1 . 2]" 1
46 1 9 VAL QG 1 33 TYR QE . . 4.940 4.163 3.643 4.716 . 0 0 "[ . 1 . 2]" 1
47 1 9 VAL QG 1 47 TRP HB3 . . 4.650 3.288 3.027 3.696 . 0 0 "[ . 1 . 2]" 1
48 1 9 VAL QG 1 47 TRP HE1 . . 2.920 2.611 2.072 2.922 0.002 1 0 "[ . 1 . 2]" 1
49 1 9 VAL QG 1 48 ALA H . . 3.930 3.530 3.228 3.929 . 0 0 "[ . 1 . 2]" 1
50 1 9 VAL QG 1 48 ALA HA . . 2.980 2.015 1.778 2.593 . 0 0 "[ . 1 . 2]" 1
51 1 9 VAL QG 1 48 ALA MB . . 3.220 2.625 2.243 3.011 . 0 0 "[ . 1 . 2]" 1
52 1 9 VAL QG 1 49 ALA H . . 5.410 4.816 4.578 5.306 . 0 0 "[ . 1 . 2]" 1
53 1 9 VAL QG 1 51 ALA H . . 4.900 4.177 3.739 4.880 . 0 0 "[ . 1 . 2]" 1
54 1 9 VAL QG 1 51 ALA MB . . 3.240 2.652 2.270 3.220 . 0 0 "[ . 1 . 2]" 1
55 1 9 VAL QG 1 65 ALA H . . 4.890 4.474 3.736 4.815 . 0 0 "[ . 1 . 2]" 1
56 1 9 VAL QG 1 65 ALA HA . . 3.430 2.720 2.131 3.133 . 0 0 "[ . 1 . 2]" 1
57 1 9 VAL QG 1 66 ALA H . . 3.490 2.868 2.411 3.251 . 0 0 "[ . 1 . 2]" 1
58 1 9 VAL QG 1 66 ALA HA . . 4.870 3.988 3.595 4.325 . 0 0 "[ . 1 . 2]" 1
59 1 9 VAL QG 1 66 ALA MB . . 2.970 2.172 1.932 2.444 . 0 0 "[ . 1 . 2]" 1
60 1 9 VAL MG1 1 47 TRP HB3 . . 5.500 4.295 3.662 4.858 . 0 0 "[ . 1 . 2]" 1
61 1 9 VAL MG1 1 47 TRP HD1 . . 3.170 2.380 1.867 3.117 . 0 0 "[ . 1 . 2]" 1
62 1 9 VAL MG2 1 47 TRP HB3 . . 5.500 3.427 3.125 4.079 . 0 0 "[ . 1 . 2]" 1
63 1 9 VAL MG2 1 47 TRP HD1 . . 3.170 2.036 1.850 2.428 . 0 0 "[ . 1 . 2]" 1
64 1 10 ILE H 1 10 ILE HB . . 3.310 2.530 2.445 2.651 . 0 0 "[ . 1 . 2]" 1
65 1 10 ILE H 1 10 ILE HG12 . . 3.990 3.874 3.608 3.991 0.001 7 0 "[ . 1 . 2]" 1
66 1 10 ILE H 1 10 ILE HG13 . . 3.380 2.522 2.194 2.733 . 0 0 "[ . 1 . 2]" 1
67 1 10 ILE H 1 10 ILE MG . . 3.980 3.797 3.760 3.850 . 0 0 "[ . 1 . 2]" 1
68 1 10 ILE H 1 11 GLU H . . 4.730 4.526 4.449 4.581 . 0 0 "[ . 1 . 2]" 1
69 1 10 ILE H 1 28 TRP HZ3 . . 5.000 4.699 4.238 4.948 . 0 0 "[ . 1 . 2]" 1
70 1 10 ILE H 1 65 ALA H . . 5.190 4.666 4.489 4.881 . 0 0 "[ . 1 . 2]" 1
71 1 10 ILE H 1 65 ALA HA . . 3.250 2.168 1.917 2.536 . 0 0 "[ . 1 . 2]" 1
72 1 10 ILE H 1 65 ALA MB . . 3.960 3.274 2.962 3.679 . 0 0 "[ . 1 . 2]" 1
73 1 10 ILE H 1 66 ALA H . . 4.320 3.865 3.378 4.318 . 0 0 "[ . 1 . 2]" 1
74 1 10 ILE HA 1 10 ILE MD . . 3.960 3.878 3.840 3.925 . 0 0 "[ . 1 . 2]" 1
75 1 10 ILE HA 1 10 ILE HG12 . . 3.550 2.686 2.573 2.808 . 0 0 "[ . 1 . 2]" 1
76 1 10 ILE HA 1 10 ILE HG13 . . 3.700 2.835 2.712 2.906 . 0 0 "[ . 1 . 2]" 1
77 1 10 ILE HA 1 10 ILE MG . . 3.170 2.394 2.304 2.472 . 0 0 "[ . 1 . 2]" 1
78 1 10 ILE HA 1 11 GLU H . . 2.770 2.205 2.156 2.287 . 0 0 "[ . 1 . 2]" 1
79 1 10 ILE HB 1 10 ILE MD . . 3.100 2.258 2.158 2.379 . 0 0 "[ . 1 . 2]" 1
80 1 10 ILE HB 1 12 LEU MD1 . . 4.910 4.312 3.873 4.654 . 0 0 "[ . 1 . 2]" 1
81 1 10 ILE HB 1 12 LEU QD . . 4.170 3.568 3.246 3.871 . 0 0 "[ . 1 . 2]" 1
82 1 10 ILE HB 1 12 LEU MD2 . . 4.910 3.836 3.313 4.167 . 0 0 "[ . 1 . 2]" 1
83 1 10 ILE HB 1 28 TRP HH2 . . 4.820 3.899 3.476 4.286 . 0 0 "[ . 1 . 2]" 1
84 1 10 ILE HB 1 28 TRP HZ3 . . 3.940 2.367 2.083 2.620 . 0 0 "[ . 1 . 2]" 1
85 1 10 ILE HB 1 65 ALA HA . . 3.840 2.927 2.651 3.266 . 0 0 "[ . 1 . 2]" 1
86 1 10 ILE HB 1 65 ALA MB . . 3.380 2.162 1.956 2.454 . 0 0 "[ . 1 . 2]" 1
87 1 10 ILE HB 1 66 ALA H . . 4.950 4.341 3.888 4.743 . 0 0 "[ . 1 . 2]" 1
88 1 10 ILE MD 1 10 ILE MG . . 2.760 2.234 2.050 2.460 . 0 0 "[ . 1 . 2]" 1
89 1 10 ILE MD 1 11 GLU H . . 5.120 5.020 4.804 5.121 0.001 12 0 "[ . 1 . 2]" 1
90 1 10 ILE MD 1 28 TRP HH2 . . 3.530 2.157 1.912 2.431 . 0 0 "[ . 1 . 2]" 1
91 1 10 ILE MD 1 28 TRP HZ2 . . 4.670 3.826 3.558 4.080 . 0 0 "[ . 1 . 2]" 1
92 1 10 ILE MD 1 28 TRP HZ3 . . 3.150 2.303 1.990 2.596 . 0 0 "[ . 1 . 2]" 1
93 1 10 ILE MD 1 63 LYS HB2 . . 4.400 3.659 3.253 4.029 . 0 0 "[ . 1 . 2]" 1
94 1 10 ILE MD 1 63 LYS HB3 . . 4.380 2.523 2.106 2.998 . 0 0 "[ . 1 . 2]" 1
95 1 10 ILE MD 1 63 LYS HD2 . . 4.850 4.354 3.844 4.810 . 0 0 "[ . 1 . 2]" 1
96 1 10 ILE MD 1 63 LYS HD3 . . 3.770 3.411 2.428 3.771 0.001 4 0 "[ . 1 . 2]" 1
97 1 10 ILE MD 1 63 LYS QE . . 3.490 2.529 1.856 3.435 . 0 0 "[ . 1 . 2]" 1
98 1 10 ILE HG12 1 10 ILE MG . . 3.160 2.226 2.072 2.345 . 0 0 "[ . 1 . 2]" 1
99 1 10 ILE HG12 1 11 GLU H . . 4.620 4.312 4.160 4.486 . 0 0 "[ . 1 . 2]" 1
100 1 10 ILE HG12 1 65 ALA MB . . 5.230 4.791 4.524 5.084 . 0 0 "[ . 1 . 2]" 1
101 1 10 ILE HG13 1 10 ILE MG . . 3.420 3.175 3.144 3.192 . 0 0 "[ . 1 . 2]" 1
102 1 10 ILE HG13 1 11 GLU H . . 4.920 4.846 4.693 4.923 0.003 2 0 "[ . 1 . 2]" 1
103 1 10 ILE HG13 1 65 ALA HA . . 4.950 4.280 3.862 4.632 . 0 0 "[ . 1 . 2]" 1
104 1 10 ILE MG 1 11 GLU H . . 3.370 2.215 1.934 2.462 . 0 0 "[ . 1 . 2]" 1
105 1 10 ILE MG 1 11 GLU HA . . 4.590 3.751 3.586 3.898 . 0 0 "[ . 1 . 2]" 1
106 1 10 ILE MG 1 11 GLU QB . . 4.810 3.798 3.627 3.935 . 0 0 "[ . 1 . 2]" 1
107 1 10 ILE MG 1 12 LEU H . . 4.410 4.270 4.019 4.412 0.002 15 0 "[ . 1 . 2]" 1
108 1 10 ILE MG 1 12 LEU MD1 . . 4.160 3.748 3.180 4.101 . 0 0 "[ . 1 . 2]" 1
109 1 10 ILE MG 1 12 LEU QD . . 2.960 2.259 1.971 2.645 . 0 0 "[ . 1 . 2]" 1
110 1 10 ILE MG 1 12 LEU MD2 . . 4.160 2.281 1.981 2.688 . 0 0 "[ . 1 . 2]" 1
111 1 10 ILE MG 1 12 LEU HG . . 3.490 2.988 2.352 3.399 . 0 0 "[ . 1 . 2]" 1
112 1 10 ILE MG 1 20 ASN QB . . 5.260 4.112 3.762 4.298 . 0 0 "[ . 1 . 2]" 1
113 1 10 ILE MG 1 28 TRP HE3 . . 4.640 4.468 4.057 4.641 0.001 2 0 "[ . 1 . 2]" 1
114 1 10 ILE MG 1 28 TRP HH2 . . 3.490 2.571 2.192 3.030 . 0 0 "[ . 1 . 2]" 1
115 1 10 ILE MG 1 28 TRP HZ2 . . 5.160 4.731 4.427 5.113 . 0 0 "[ . 1 . 2]" 1
116 1 10 ILE MG 1 28 TRP HZ3 . . 3.400 2.395 2.081 2.715 . 0 0 "[ . 1 . 2]" 1
117 1 10 ILE MG 1 63 LYS QE . . 5.470 4.595 3.734 5.474 0.004 5 0 "[ . 1 . 2]" 1
118 1 10 ILE MG 1 65 ALA HA . . 4.420 4.205 4.056 4.393 . 0 0 "[ . 1 . 2]" 1
119 1 10 ILE MG 1 65 ALA MB . . 3.310 2.911 2.642 3.155 . 0 0 "[ . 1 . 2]" 1
120 1 10 ILE MG 1 66 ALA H . . 5.100 4.589 4.304 4.830 . 0 0 "[ . 1 . 2]" 1
121 1 11 GLU H 1 11 GLU HB2 . . 3.420 2.762 2.204 3.042 . 0 0 "[ . 1 . 2]" 1
122 1 11 GLU H 1 11 GLU QB . . 2.890 2.342 2.181 2.430 . 0 0 "[ . 1 . 2]" 1
123 1 11 GLU H 1 11 GLU HB3 . . 3.420 2.614 2.401 3.478 0.058 15 0 "[ . 1 . 2]" 1
124 1 11 GLU H 1 11 GLU QG . . 4.480 3.985 3.226 4.128 . 0 0 "[ . 1 . 2]" 1
125 1 11 GLU H 1 12 LEU QD . . 4.930 4.340 4.004 4.698 . 0 0 "[ . 1 . 2]" 1
126 1 11 GLU H 1 65 ALA MB . . 5.500 4.471 3.990 4.756 . 0 0 "[ . 1 . 2]" 1
127 1 11 GLU HA 1 11 GLU QG . . 3.670 2.413 2.168 2.775 . 0 0 "[ . 1 . 2]" 1
128 1 11 GLU HA 1 12 LEU H . . 3.020 2.157 2.139 2.196 . 0 0 "[ . 1 . 2]" 1
129 1 11 GLU HA 1 66 ALA MB . . 4.270 3.823 3.506 4.149 . 0 0 "[ . 1 . 2]" 1
130 1 11 GLU QB 1 12 LEU H . . 4.380 3.703 3.066 3.854 . 0 0 "[ . 1 . 2]" 1
131 1 11 GLU HB2 1 12 LEU H . . 5.090 4.258 4.000 4.432 . 0 0 "[ . 1 . 2]" 1
132 1 11 GLU HB3 1 12 LEU H . . 5.090 4.101 3.141 4.381 . 0 0 "[ . 1 . 2]" 1
133 1 11 GLU QG 1 12 LEU H . . 3.540 2.803 2.360 3.544 0.004 15 0 "[ . 1 . 2]" 1
134 1 11 GLU QG 1 66 ALA MB . . 5.130 4.349 3.486 4.908 . 0 0 "[ . 1 . 2]" 1
135 1 11 GLU HG2 1 12 LEU H . . 4.250 3.227 2.375 4.169 . 0 0 "[ . 1 . 2]" 1
136 1 11 GLU HG3 1 12 LEU H . . 4.250 3.317 2.501 4.247 . 0 0 "[ . 1 . 2]" 1
137 1 12 LEU H 1 12 LEU HB2 . . 3.530 2.638 2.537 2.727 . 0 0 "[ . 1 . 2]" 1
138 1 12 LEU H 1 12 LEU HB3 . . 3.780 3.756 3.690 3.801 0.021 10 0 "[ . 1 . 2]" 1
139 1 12 LEU H 1 12 LEU MD1 . . 3.980 3.879 3.717 3.976 . 0 0 "[ . 1 . 2]" 1
140 1 12 LEU H 1 12 LEU MD2 . . 3.980 3.795 3.579 3.973 . 0 0 "[ . 1 . 2]" 1
141 1 12 LEU H 1 12 LEU HG . . 3.540 2.802 2.593 3.015 . 0 0 "[ . 1 . 2]" 1
142 1 12 LEU H 1 13 THR H . . 4.790 4.485 4.439 4.515 . 0 0 "[ . 1 . 2]" 1
143 1 12 LEU H 1 65 ALA MB . . 4.420 3.729 3.447 4.097 . 0 0 "[ . 1 . 2]" 1
144 1 12 LEU H 1 66 ALA H . . 4.180 3.873 3.496 4.179 . 0 0 "[ . 1 . 2]" 1
145 1 12 LEU H 1 66 ALA MB . . 5.080 4.768 4.502 5.020 . 0 0 "[ . 1 . 2]" 1
146 1 12 LEU H 1 67 VAL HA . . 4.140 3.771 3.505 4.095 . 0 0 "[ . 1 . 2]" 1
147 1 12 LEU H 1 67 VAL MG2 . . 3.780 2.983 2.493 3.400 . 0 0 "[ . 1 . 2]" 1
148 1 12 LEU HA 1 13 THR H . . 3.070 2.431 2.291 2.557 . 0 0 "[ . 1 . 2]" 1
149 1 12 LEU HB2 1 13 THR H . . 3.990 3.473 3.139 3.790 . 0 0 "[ . 1 . 2]" 1
150 1 12 LEU HB2 1 17 PHE H . . 5.500 5.027 4.170 5.453 . 0 0 "[ . 1 . 2]" 1
151 1 12 LEU HB2 1 17 PHE HA . . 4.470 3.472 3.080 3.947 . 0 0 "[ . 1 . 2]" 1
152 1 12 LEU HB2 1 17 PHE QD . . 4.450 3.472 3.007 3.943 . 0 0 "[ . 1 . 2]" 1
153 1 12 LEU HB2 1 67 VAL MG2 . . 3.310 2.417 2.053 2.616 . 0 0 "[ . 1 . 2]" 1
154 1 12 LEU HB3 1 12 LEU MD1 . . 3.530 2.426 2.315 2.566 . 0 0 "[ . 1 . 2]" 1
155 1 12 LEU HB3 1 12 LEU QD . . 3.070 2.083 2.015 2.150 . 0 0 "[ . 1 . 2]" 1
156 1 12 LEU HB3 1 12 LEU MD2 . . 3.530 2.275 2.155 2.391 . 0 0 "[ . 1 . 2]" 1
157 1 12 LEU HB3 1 13 THR H . . 3.180 2.384 2.165 2.696 . 0 0 "[ . 1 . 2]" 1
158 1 12 LEU HB3 1 17 PHE H . . 4.310 3.633 2.906 4.090 . 0 0 "[ . 1 . 2]" 1
159 1 12 LEU HB3 1 17 PHE HA . . 4.050 2.189 2.011 2.557 . 0 0 "[ . 1 . 2]" 1
160 1 12 LEU HB3 1 17 PHE QD . . 4.460 3.854 3.509 4.283 . 0 0 "[ . 1 . 2]" 1
161 1 12 LEU HB3 1 65 ALA MB . . 5.500 4.599 4.406 4.768 . 0 0 "[ . 1 . 2]" 1
162 1 12 LEU HB3 1 67 VAL MG2 . . 4.110 3.764 3.424 4.000 . 0 0 "[ . 1 . 2]" 1
163 1 12 LEU QD 1 13 THR H . . 3.440 3.322 3.116 3.412 . 0 0 "[ . 1 . 2]" 1
164 1 12 LEU QD 1 16 SER H . . 5.440 5.187 4.947 5.442 0.002 9 0 "[ . 1 . 2]" 1
165 1 12 LEU QD 1 16 SER QB . . 4.310 3.158 2.597 3.756 . 0 0 "[ . 1 . 2]" 1
166 1 12 LEU QD 1 17 PHE H . . 4.870 4.097 3.666 4.496 . 0 0 "[ . 1 . 2]" 1
167 1 12 LEU QD 1 17 PHE HA . . 3.150 2.289 2.035 2.543 . 0 0 "[ . 1 . 2]" 1
168 1 12 LEU QD 1 17 PHE HB2 . . 4.290 3.277 2.971 3.540 . 0 0 "[ . 1 . 2]" 1
169 1 12 LEU QD 1 17 PHE QD . . 3.520 2.864 2.405 3.326 . 0 0 "[ . 1 . 2]" 1
170 1 12 LEU QD 1 17 PHE QE . . 4.440 3.949 3.473 4.348 . 0 0 "[ . 1 . 2]" 1
171 1 12 LEU QD 1 18 ASP H . . 5.440 4.787 4.607 5.034 . 0 0 "[ . 1 . 2]" 1
172 1 12 LEU QD 1 20 ASN H . . 4.190 3.915 3.638 4.139 . 0 0 "[ . 1 . 2]" 1
173 1 12 LEU QD 1 20 ASN QB . . 3.310 1.917 1.752 2.148 . 0 0 "[ . 1 . 2]" 1
174 1 12 LEU QD 1 20 ASN QD . . 3.520 2.845 1.970 3.287 . 0 0 "[ . 1 . 2]" 1
175 1 12 LEU QD 1 21 VAL HA . . 4.960 4.401 4.211 4.676 . 0 0 "[ . 1 . 2]" 1
176 1 12 LEU QD 1 21 VAL MG1 . . 4.660 4.354 4.078 4.647 . 0 0 "[ . 1 . 2]" 1
177 1 12 LEU QD 1 21 VAL MG2 . . 2.980 2.351 2.039 2.620 . 0 0 "[ . 1 . 2]" 1
178 1 12 LEU QD 1 28 TRP HE3 . . 4.130 2.563 2.218 2.835 . 0 0 "[ . 1 . 2]" 1
179 1 12 LEU QD 1 28 TRP HH2 . . 3.660 3.352 3.041 3.628 . 0 0 "[ . 1 . 2]" 1
180 1 12 LEU QD 1 28 TRP HZ2 . . 5.440 4.461 4.161 4.673 . 0 0 "[ . 1 . 2]" 1
181 1 12 LEU QD 1 28 TRP HZ3 . . 3.600 2.551 2.227 2.803 . 0 0 "[ . 1 . 2]" 1
182 1 12 LEU QD 1 30 VAL MG2 . . 3.560 2.589 2.114 2.863 . 0 0 "[ . 1 . 2]" 1
183 1 12 LEU QD 1 65 ALA H . . 4.990 4.454 4.273 4.691 . 0 0 "[ . 1 . 2]" 1
184 1 12 LEU QD 1 65 ALA HA . . 4.960 4.301 4.068 4.480 . 0 0 "[ . 1 . 2]" 1
185 1 12 LEU QD 1 65 ALA MB . . 2.800 2.042 1.846 2.233 . 0 0 "[ . 1 . 2]" 1
186 1 12 LEU QD 1 66 ALA H . . 4.590 4.165 3.607 4.519 . 0 0 "[ . 1 . 2]" 1
187 1 12 LEU MD1 1 13 THR H . . 4.740 4.443 4.171 4.718 . 0 0 "[ . 1 . 2]" 1
188 1 12 LEU MD1 1 17 PHE HA . . 3.620 2.427 2.091 2.681 . 0 0 "[ . 1 . 2]" 1
189 1 12 LEU MD1 1 17 PHE HB2 . . 4.970 3.380 3.045 3.690 . 0 0 "[ . 1 . 2]" 1
190 1 12 LEU MD1 1 20 ASN H . . 5.050 4.849 4.525 5.049 . 0 0 "[ . 1 . 2]" 1
191 1 12 LEU MD1 1 20 ASN QB . . 4.280 3.008 2.371 3.522 . 0 0 "[ . 1 . 2]" 1
192 1 12 LEU MD1 1 21 VAL H . . 4.720 4.384 3.901 4.721 0.001 12 0 "[ . 1 . 2]" 1
193 1 12 LEU MD1 1 21 VAL MG2 . . 3.910 2.402 2.065 2.673 . 0 0 "[ . 1 . 2]" 1
194 1 12 LEU MD1 1 28 TRP HH2 . . 5.150 4.605 3.942 5.033 . 0 0 "[ . 1 . 2]" 1
195 1 12 LEU MD1 1 28 TRP HZ3 . . 4.190 3.074 2.343 3.555 . 0 0 "[ . 1 . 2]" 1
196 1 12 LEU MD1 1 65 ALA MB . . 3.820 2.073 1.855 2.297 . 0 0 "[ . 1 . 2]" 1
197 1 12 LEU MD1 1 66 ALA H . . 5.500 4.362 3.693 4.831 . 0 0 "[ . 1 . 2]" 1
198 1 12 LEU MD2 1 13 THR H . . 4.740 3.434 3.175 3.548 . 0 0 "[ . 1 . 2]" 1
199 1 12 LEU MD2 1 17 PHE HA . . 3.620 2.883 2.453 3.358 . 0 0 "[ . 1 . 2]" 1
200 1 12 LEU MD2 1 17 PHE HB2 . . 4.970 4.451 4.060 4.828 . 0 0 "[ . 1 . 2]" 1
201 1 12 LEU MD2 1 20 ASN H . . 5.050 4.145 3.730 4.406 . 0 0 "[ . 1 . 2]" 1
202 1 12 LEU MD2 1 20 ASN QB . . 4.280 1.944 1.772 2.213 . 0 0 "[ . 1 . 2]" 1
203 1 12 LEU MD2 1 21 VAL H . . 4.720 4.393 3.886 4.720 0.000 12 0 "[ . 1 . 2]" 1
204 1 12 LEU MD2 1 21 VAL MG2 . . 3.910 3.407 2.715 3.829 . 0 0 "[ . 1 . 2]" 1
205 1 12 LEU MD2 1 28 TRP HH2 . . 5.150 3.454 3.163 3.822 . 0 0 "[ . 1 . 2]" 1
206 1 12 LEU MD2 1 28 TRP HZ3 . . 4.190 2.805 2.288 3.335 . 0 0 "[ . 1 . 2]" 1
207 1 12 LEU MD2 1 65 ALA MB . . 3.820 3.167 2.819 3.472 . 0 0 "[ . 1 . 2]" 1
208 1 12 LEU MD2 1 66 ALA H . . 5.500 5.318 4.985 5.493 . 0 0 "[ . 1 . 2]" 1
209 1 12 LEU HG 1 13 THR H . . 5.460 4.862 4.757 4.946 . 0 0 "[ . 1 . 2]" 1
210 1 12 LEU HG 1 28 TRP HZ3 . . 4.790 3.643 3.127 4.008 . 0 0 "[ . 1 . 2]" 1
211 1 12 LEU HG 1 65 ALA MB . . 3.560 2.291 2.080 2.548 . 0 0 "[ . 1 . 2]" 1
212 1 13 THR H 1 13 THR MG . . 4.160 3.325 2.266 3.965 . 0 0 "[ . 1 . 2]" 1
213 1 13 THR H 1 14 ASP H . . 4.880 4.437 4.387 4.474 . 0 0 "[ . 1 . 2]" 1
214 1 13 THR H 1 16 SER H . . 3.760 3.270 2.839 3.686 . 0 0 "[ . 1 . 2]" 1
215 1 13 THR H 1 16 SER HB2 . . 4.810 2.530 1.900 4.457 . 0 0 "[ . 1 . 2]" 1
216 1 13 THR H 1 16 SER QB . . 4.010 2.128 1.861 3.537 . 0 0 "[ . 1 . 2]" 1
217 1 13 THR H 1 16 SER HB3 . . 4.810 2.886 1.898 3.910 . 0 0 "[ . 1 . 2]" 1
218 1 13 THR H 1 17 PHE H . . 3.890 3.038 2.311 3.719 . 0 0 "[ . 1 . 2]" 1
219 1 13 THR H 1 17 PHE HA . . 4.720 3.627 3.222 4.084 . 0 0 "[ . 1 . 2]" 1
220 1 13 THR H 1 17 PHE HB2 . . 4.680 3.618 3.253 3.930 . 0 0 "[ . 1 . 2]" 1
221 1 13 THR H 1 17 PHE QD . . 5.500 5.231 4.942 5.498 . 0 0 "[ . 1 . 2]" 1
222 1 13 THR H 1 67 VAL MG2 . . 4.990 4.728 4.141 4.958 . 0 0 "[ . 1 . 2]" 1
223 1 13 THR HA 1 67 VAL MG1 . . 4.660 3.837 3.121 4.333 . 0 0 "[ . 1 . 2]" 1
224 1 13 THR HA 1 72 ASN HD21 . . 4.730 4.195 3.641 4.712 . 0 0 "[ . 1 . 2]" 1
225 1 13 THR HA 1 72 ASN HD22 . . 4.230 2.489 1.941 3.025 . 0 0 "[ . 1 . 2]" 1
226 1 13 THR MG 1 14 ASP H . . 3.950 2.806 1.804 3.752 . 0 0 "[ . 1 . 2]" 1
227 1 13 THR MG 1 16 SER H . . 4.300 3.700 3.210 4.057 . 0 0 "[ . 1 . 2]" 1
228 1 13 THR MG 1 72 ASN HD21 . . 5.210 4.730 4.197 5.170 . 0 0 "[ . 1 . 2]" 1
229 1 13 THR MG 1 72 ASN HD22 . . 3.780 3.465 3.065 3.775 . 0 0 "[ . 1 . 2]" 1
230 1 14 ASP H 1 14 ASP HB2 . . 3.940 3.356 2.423 3.613 . 0 0 "[ . 1 . 2]" 1
231 1 14 ASP H 1 14 ASP HB3 . . 3.940 2.807 2.200 3.593 . 0 0 "[ . 1 . 2]" 1
232 1 14 ASP H 1 15 ASP H . . 4.660 2.727 2.470 2.989 . 0 0 "[ . 1 . 2]" 1
233 1 14 ASP H 1 16 SER H . . 4.690 4.106 3.795 4.396 . 0 0 "[ . 1 . 2]" 1
234 1 14 ASP H 1 67 VAL MG1 . . 5.440 4.878 4.438 5.209 . 0 0 "[ . 1 . 2]" 1
235 1 14 ASP H 1 72 ASN HA . . 4.990 4.354 3.853 4.667 . 0 0 "[ . 1 . 2]" 1
236 1 14 ASP H 1 72 ASN HB3 . . 5.410 5.161 4.499 5.407 . 0 0 "[ . 1 . 2]" 1
237 1 14 ASP H 1 72 ASN HD22 . . 4.670 3.562 3.243 3.923 . 0 0 "[ . 1 . 2]" 1
238 1 14 ASP H 1 75 LEU QD . . 4.440 3.857 3.413 4.355 . 0 0 "[ . 1 . 2]" 1
239 1 14 ASP HA 1 16 SER H . . 5.140 4.793 3.763 5.141 0.001 1 0 "[ . 1 . 2]" 1
240 1 14 ASP HA 1 17 PHE H . . 4.530 4.293 3.950 4.451 . 0 0 "[ . 1 . 2]" 1
241 1 14 ASP HA 1 72 ASN HB3 . . 4.730 4.349 3.810 4.731 0.001 8 0 "[ . 1 . 2]" 1
242 1 14 ASP HA 1 73 GLN H . . 5.500 5.432 5.131 5.502 0.002 12 0 "[ . 1 . 2]" 1
243 1 14 ASP HA 1 74 VAL H . . 5.270 4.935 4.661 5.169 . 0 0 "[ . 1 . 2]" 1
244 1 14 ASP HA 1 74 VAL HB . . 4.520 3.423 3.251 3.806 . 0 0 "[ . 1 . 2]" 1
245 1 14 ASP HA 1 74 VAL MG1 . . 4.800 4.272 4.003 4.781 . 0 0 "[ . 1 . 2]" 1
246 1 14 ASP HA 1 75 LEU H . . 4.330 4.012 3.743 4.275 . 0 0 "[ . 1 . 2]" 1
247 1 14 ASP HA 1 75 LEU MD1 . . 4.010 2.227 1.980 2.732 . 0 0 "[ . 1 . 2]" 1
248 1 14 ASP HA 1 75 LEU QD . . 3.310 2.151 1.916 2.607 . 0 0 "[ . 1 . 2]" 1
249 1 14 ASP HA 1 75 LEU MD2 . . 4.010 2.912 2.551 3.297 . 0 0 "[ . 1 . 2]" 1
250 1 14 ASP HA 1 75 LEU HG . . 3.930 2.393 2.094 2.673 . 0 0 "[ . 1 . 2]" 1
251 1 14 ASP QB 1 74 VAL H . . 4.170 3.187 2.781 3.742 . 0 0 "[ . 1 . 2]" 1
252 1 14 ASP QB 1 74 VAL HB . . 3.900 2.082 1.879 2.401 . 0 0 "[ . 1 . 2]" 1
253 1 14 ASP QB 1 74 VAL MG1 . . 4.190 3.188 2.864 3.835 . 0 0 "[ . 1 . 2]" 1
254 1 14 ASP QB 1 74 VAL MG2 . . 3.700 2.121 1.939 2.665 . 0 0 "[ . 1 . 2]" 1
255 1 14 ASP QB 1 75 LEU H . . 5.290 3.612 3.078 4.179 . 0 0 "[ . 1 . 2]" 1
256 1 14 ASP QB 1 75 LEU QD . . 4.140 3.320 3.059 3.579 . 0 0 "[ . 1 . 2]" 1
257 1 14 ASP HB2 1 74 VAL H . . 4.940 3.813 3.153 4.809 . 0 0 "[ . 1 . 2]" 1
258 1 14 ASP HB2 1 74 VAL HB . . 4.630 2.467 2.000 3.880 . 0 0 "[ . 1 . 2]" 1
259 1 14 ASP HB2 1 74 VAL MG2 . . 4.410 2.345 1.977 3.116 . 0 0 "[ . 1 . 2]" 1
260 1 14 ASP HB3 1 74 VAL H . . 4.940 3.555 2.858 4.444 . 0 0 "[ . 1 . 2]" 1
261 1 14 ASP HB3 1 74 VAL HB . . 4.630 2.914 2.016 4.121 . 0 0 "[ . 1 . 2]" 1
262 1 14 ASP HB3 1 74 VAL MG2 . . 4.410 2.944 2.082 3.895 . 0 0 "[ . 1 . 2]" 1
263 1 15 ASP H 1 15 ASP QB . . 3.690 2.558 2.329 2.987 . 0 0 "[ . 1 . 2]" 1
264 1 15 ASP H 1 75 LEU QD . . 5.440 4.413 4.056 4.730 . 0 0 "[ . 1 . 2]" 1
265 1 15 ASP QB 1 16 SER H . . 3.810 2.908 2.288 3.732 . 0 0 "[ . 1 . 2]" 1
266 1 16 SER H 1 16 SER HB2 . . 3.850 2.504 2.202 3.547 . 0 0 "[ . 1 . 2]" 1
267 1 16 SER H 1 16 SER QB . . 3.250 2.319 2.173 2.661 . 0 0 "[ . 1 . 2]" 1
268 1 16 SER H 1 16 SER HB3 . . 3.850 3.300 2.240 3.815 . 0 0 "[ . 1 . 2]" 1
269 1 16 SER H 1 17 PHE H . . 3.010 2.571 1.813 2.790 . 0 0 "[ . 1 . 2]" 1
270 1 16 SER H 1 17 PHE HB2 . . 5.260 4.929 4.395 5.266 0.006 13 0 "[ . 1 . 2]" 1
271 1 16 SER H 1 17 PHE HB3 . . 5.500 4.485 3.748 4.802 . 0 0 "[ . 1 . 2]" 1
272 1 16 SER H 1 75 LEU QD . . 5.440 4.903 3.711 5.355 . 0 0 "[ . 1 . 2]" 1
273 1 16 SER HA 1 19 LYS H . . 4.350 3.293 2.805 4.023 . 0 0 "[ . 1 . 2]" 1
274 1 16 SER HA 1 19 LYS QD . . 4.340 3.413 1.990 4.326 . 0 0 "[ . 1 . 2]" 1
275 1 16 SER HA 1 19 LYS QE . . 4.790 3.592 2.135 4.775 . 0 0 "[ . 1 . 2]" 1
276 1 16 SER HA 1 19 LYS HG2 . . 4.890 2.850 1.997 4.576 . 0 0 "[ . 1 . 2]" 1
277 1 16 SER HA 1 19 LYS HG3 . . 4.890 3.037 2.170 4.247 . 0 0 "[ . 1 . 2]" 1
278 1 16 SER HA 1 20 ASN H . . 5.030 4.084 3.706 4.278 . 0 0 "[ . 1 . 2]" 1
279 1 16 SER HA 1 20 ASN HD21 . . 4.550 2.784 2.034 4.310 . 0 0 "[ . 1 . 2]" 1
280 1 16 SER HA 1 20 ASN HD22 . . 4.550 3.426 2.661 4.163 . 0 0 "[ . 1 . 2]" 1
281 1 16 SER QB 1 17 PHE H . . 3.630 3.225 2.585 3.650 0.020 4 0 "[ . 1 . 2]" 1
282 1 16 SER QB 1 20 ASN QD . . 3.300 2.328 1.773 3.257 . 0 0 "[ . 1 . 2]" 1
283 1 16 SER HB2 1 20 ASN HD21 . . 4.810 3.823 2.207 4.439 . 0 0 "[ . 1 . 2]" 1
284 1 16 SER HB2 1 20 ASN HD22 . . 4.810 3.803 1.906 4.350 . 0 0 "[ . 1 . 2]" 1
285 1 16 SER HB3 1 20 ASN HD21 . . 4.810 2.900 1.989 4.180 . 0 0 "[ . 1 . 2]" 1
286 1 16 SER HB3 1 20 ASN HD22 . . 4.810 2.859 1.897 4.084 . 0 0 "[ . 1 . 2]" 1
287 1 17 PHE H 1 17 PHE HB3 . . 3.030 2.354 2.301 2.483 . 0 0 "[ . 1 . 2]" 1
288 1 17 PHE H 1 17 PHE QD . . 4.130 4.014 3.831 4.176 0.046 13 0 "[ . 1 . 2]" 1
289 1 17 PHE H 1 18 ASP H . . 3.640 2.566 2.065 2.963 . 0 0 "[ . 1 . 2]" 1
290 1 17 PHE H 1 75 LEU MD1 . . 5.000 4.013 3.254 4.536 . 0 0 "[ . 1 . 2]" 1
291 1 17 PHE H 1 75 LEU QD . . 4.170 3.706 3.019 4.074 . 0 0 "[ . 1 . 2]" 1
292 1 17 PHE H 1 75 LEU MD2 . . 5.000 4.419 3.576 4.829 . 0 0 "[ . 1 . 2]" 1
293 1 17 PHE HA 1 17 PHE QD . . 3.760 3.277 3.204 3.315 . 0 0 "[ . 1 . 2]" 1
294 1 17 PHE HA 1 20 ASN H . . 4.190 3.956 3.735 4.158 . 0 0 "[ . 1 . 2]" 1
295 1 17 PHE HA 1 20 ASN QB . . 4.170 3.078 2.544 4.189 0.019 9 0 "[ . 1 . 2]" 1
296 1 17 PHE HA 1 20 ASN QD . . 5.120 3.827 1.888 4.338 . 0 0 "[ . 1 . 2]" 1
297 1 17 PHE HA 1 21 VAL H . . 4.570 4.222 3.766 4.538 . 0 0 "[ . 1 . 2]" 1
298 1 17 PHE HA 1 21 VAL MG2 . . 4.110 3.337 3.072 3.595 . 0 0 "[ . 1 . 2]" 1
299 1 17 PHE HA 1 30 VAL MG2 . . 5.030 4.815 4.458 5.030 . 0 0 "[ . 1 . 2]" 1
300 1 17 PHE HA 1 67 VAL MG2 . . 4.980 4.722 3.925 4.979 . 0 0 "[ . 1 . 2]" 1
301 1 17 PHE HB2 1 21 VAL MG2 . . 5.500 4.613 4.266 4.852 . 0 0 "[ . 1 . 2]" 1
302 1 17 PHE HB2 1 67 VAL MG2 . . 4.430 3.593 2.830 3.864 . 0 0 "[ . 1 . 2]" 1
303 1 17 PHE HB2 1 75 LEU QD . . 3.730 2.274 1.943 2.534 . 0 0 "[ . 1 . 2]" 1
304 1 17 PHE HB3 1 18 ASP H . . 3.630 2.898 2.586 3.275 . 0 0 "[ . 1 . 2]" 1
305 1 17 PHE HB3 1 18 ASP HA . . 4.730 4.692 4.584 4.760 0.030 9 0 "[ . 1 . 2]" 1
306 1 17 PHE HB3 1 75 LEU MD1 . . 3.950 2.440 2.150 2.769 . 0 0 "[ . 1 . 2]" 1
307 1 17 PHE HB3 1 75 LEU QD . . 3.360 2.191 1.881 2.485 . 0 0 "[ . 1 . 2]" 1
308 1 17 PHE HB3 1 75 LEU MD2 . . 3.950 2.568 2.007 3.034 . 0 0 "[ . 1 . 2]" 1
309 1 17 PHE QD 1 18 ASP H . . 4.240 2.828 2.404 3.307 . 0 0 "[ . 1 . 2]" 1
310 1 17 PHE QD 1 18 ASP HA . . 3.670 2.709 2.542 3.003 . 0 0 "[ . 1 . 2]" 1
311 1 17 PHE QD 1 21 VAL MG2 . . 4.270 3.645 3.361 3.868 . 0 0 "[ . 1 . 2]" 1
312 1 17 PHE QD 1 22 LEU HG . . 5.060 4.147 3.743 4.457 . 0 0 "[ . 1 . 2]" 1
313 1 17 PHE QD 1 30 VAL MG1 . . 4.200 2.922 2.389 3.407 . 0 0 "[ . 1 . 2]" 1
314 1 17 PHE QD 1 30 VAL MG2 . . 4.000 2.883 2.649 3.288 . 0 0 "[ . 1 . 2]" 1
315 1 17 PHE QD 1 67 VAL MG2 . . 3.540 2.691 2.333 2.992 . 0 0 "[ . 1 . 2]" 1
316 1 17 PHE QD 1 75 LEU MD1 . . 3.650 2.364 2.066 2.556 . 0 0 "[ . 1 . 2]" 1
317 1 17 PHE QD 1 75 LEU MD2 . . 3.650 2.832 2.550 3.160 . 0 0 "[ . 1 . 2]" 1
318 1 17 PHE QE 1 21 VAL HB . . 4.630 3.944 3.544 4.347 . 0 0 "[ . 1 . 2]" 1
319 1 17 PHE QE 1 21 VAL MG1 . . 4.240 3.892 3.456 4.233 . 0 0 "[ . 1 . 2]" 1
320 1 17 PHE QE 1 21 VAL MG2 . . 4.020 3.660 3.209 3.934 . 0 0 "[ . 1 . 2]" 1
321 1 17 PHE QE 1 22 LEU MD1 . . 4.230 4.040 3.726 4.238 0.008 9 0 "[ . 1 . 2]" 1
322 1 17 PHE QE 1 22 LEU MD2 . . 3.570 3.386 3.227 3.572 0.002 16 0 "[ . 1 . 2]" 1
323 1 17 PHE QE 1 22 LEU HG . . 4.800 4.047 3.543 4.510 . 0 0 "[ . 1 . 2]" 1
324 1 17 PHE QE 1 30 VAL MG1 . . 3.480 2.235 1.936 2.696 . 0 0 "[ . 1 . 2]" 1
325 1 17 PHE QE 1 30 VAL MG2 . . 3.580 1.947 1.798 2.201 . 0 0 "[ . 1 . 2]" 1
326 1 17 PHE QE 1 67 VAL MG2 . . 4.110 3.779 3.295 4.058 . 0 0 "[ . 1 . 2]" 1
327 1 17 PHE QE 1 75 LEU MD1 . . 4.800 3.370 3.046 3.835 . 0 0 "[ . 1 . 2]" 1
328 1 17 PHE QE 1 75 LEU QD . . 3.970 3.006 2.755 3.379 . 0 0 "[ . 1 . 2]" 1
329 1 17 PHE QE 1 75 LEU MD2 . . 4.800 3.400 3.127 3.826 . 0 0 "[ . 1 . 2]" 1
330 1 17 PHE QE 1 90 PHE QE . . 4.760 3.276 2.893 3.679 . 0 0 "[ . 1 . 2]" 1
331 1 17 PHE HZ 1 21 VAL MG1 . . 4.450 4.094 3.492 4.451 0.001 17 0 "[ . 1 . 2]" 1
332 1 17 PHE HZ 1 21 VAL MG2 . . 4.940 4.096 3.512 4.427 . 0 0 "[ . 1 . 2]" 1
333 1 17 PHE HZ 1 30 VAL MG1 . . 4.730 4.313 3.918 4.648 . 0 0 "[ . 1 . 2]" 1
334 1 17 PHE HZ 1 30 VAL MG2 . . 4.400 3.185 2.480 3.571 . 0 0 "[ . 1 . 2]" 1
335 1 17 PHE HZ 1 75 LEU QD . . 5.280 3.827 3.524 4.338 . 0 0 "[ . 1 . 2]" 1
336 1 17 PHE HZ 1 90 PHE QE . . 4.630 2.932 2.403 3.297 . 0 0 "[ . 1 . 2]" 1
337 1 17 PHE HZ 1 90 PHE HZ . . 4.340 3.051 2.801 3.525 . 0 0 "[ . 1 . 2]" 1
338 1 18 ASP H 1 18 ASP QB . . 3.510 2.623 2.358 2.958 . 0 0 "[ . 1 . 2]" 1
339 1 18 ASP H 1 19 LYS H . . 3.370 2.395 2.170 2.548 . 0 0 "[ . 1 . 2]" 1
340 1 18 ASP H 1 20 ASN H . . 4.890 3.588 3.410 3.782 . 0 0 "[ . 1 . 2]" 1
341 1 18 ASP H 1 22 LEU MD1 . . 5.070 4.837 4.415 5.071 0.001 8 0 "[ . 1 . 2]" 1
342 1 18 ASP H 1 75 LEU QD . . 5.440 4.057 3.817 4.364 . 0 0 "[ . 1 . 2]" 1
343 1 18 ASP HA 1 21 VAL H . . 4.300 3.184 2.918 3.452 . 0 0 "[ . 1 . 2]" 1
344 1 18 ASP HA 1 22 LEU H . . 3.340 2.588 2.282 2.808 . 0 0 "[ . 1 . 2]" 1
345 1 18 ASP HA 1 22 LEU MD1 . . 3.510 3.077 2.542 3.419 . 0 0 "[ . 1 . 2]" 1
346 1 18 ASP HA 1 22 LEU HG . . 3.450 2.053 1.998 2.307 . 0 0 "[ . 1 . 2]" 1
347 1 18 ASP QB 1 19 LYS H . . 3.630 2.837 2.254 3.436 . 0 0 "[ . 1 . 2]" 1
348 1 18 ASP QB 1 20 ASN H . . 5.020 4.417 4.114 4.709 . 0 0 "[ . 1 . 2]" 1
349 1 18 ASP QB 1 22 LEU H . . 4.420 3.893 3.454 4.329 . 0 0 "[ . 1 . 2]" 1
350 1 18 ASP QB 1 22 LEU HB3 . . 4.540 4.269 3.733 4.547 0.007 9 0 "[ . 1 . 2]" 1
351 1 18 ASP QB 1 22 LEU MD1 . . 3.400 1.979 1.701 2.200 . 0 0 "[ . 1 . 2]" 1
352 1 18 ASP QB 1 22 LEU HG . . 4.720 2.622 2.005 3.661 . 0 0 "[ . 1 . 2]" 1
353 1 18 ASP HB2 1 19 LYS H . . 4.190 3.005 2.281 4.039 . 0 0 "[ . 1 . 2]" 1
354 1 18 ASP HB3 1 19 LYS H . . 4.190 3.767 3.329 4.128 . 0 0 "[ . 1 . 2]" 1
355 1 19 LYS H 1 19 LYS HB2 . . 3.660 3.199 2.615 3.628 . 0 0 "[ . 1 . 2]" 1
356 1 19 LYS H 1 19 LYS HB3 . . 3.660 2.817 2.201 3.623 . 0 0 "[ . 1 . 2]" 1
357 1 19 LYS H 1 19 LYS QD . . 4.670 4.002 3.396 4.400 . 0 0 "[ . 1 . 2]" 1
358 1 19 LYS H 1 19 LYS HG2 . . 4.280 2.731 1.935 3.609 . 0 0 "[ . 1 . 2]" 1
359 1 19 LYS H 1 19 LYS QG . . 3.460 2.366 1.881 2.806 . 0 0 "[ . 1 . 2]" 1
360 1 19 LYS H 1 19 LYS HG3 . . 4.280 3.093 1.941 4.069 . 0 0 "[ . 1 . 2]" 1
361 1 19 LYS H 1 20 ASN H . . 3.190 2.606 2.281 2.736 . 0 0 "[ . 1 . 2]" 1
362 1 19 LYS H 1 20 ASN QB . . 4.700 4.479 4.292 4.690 . 0 0 "[ . 1 . 2]" 1
363 1 19 LYS H 1 20 ASN QD . . 5.310 3.807 3.442 4.406 . 0 0 "[ . 1 . 2]" 1
364 1 19 LYS H 1 21 VAL H . . 4.640 4.125 3.856 4.311 . 0 0 "[ . 1 . 2]" 1
365 1 19 LYS HA 1 19 LYS QG . . 3.680 3.052 2.465 3.439 . 0 0 "[ . 1 . 2]" 1
366 1 19 LYS HA 1 20 ASN HA . . 4.960 4.575 4.564 4.592 . 0 0 "[ . 1 . 2]" 1
367 1 19 LYS HA 1 23 ASP H . . 3.950 3.176 2.743 3.537 . 0 0 "[ . 1 . 2]" 1
368 1 19 LYS HA 1 23 ASP HB2 . . 4.250 2.385 1.996 4.056 . 0 0 "[ . 1 . 2]" 1
369 1 19 LYS HA 1 23 ASP QB . . 3.640 2.217 1.800 2.578 . 0 0 "[ . 1 . 2]" 1
370 1 19 LYS HA 1 23 ASP HB3 . . 4.250 3.201 2.025 4.003 . 0 0 "[ . 1 . 2]" 1
371 1 19 LYS QB 1 20 ASN H . . 3.880 3.501 3.055 3.826 . 0 0 "[ . 1 . 2]" 1
372 1 19 LYS HB2 1 20 ASN H . . 4.470 3.919 3.146 4.438 . 0 0 "[ . 1 . 2]" 1
373 1 19 LYS HB3 1 20 ASN H . . 4.470 4.129 3.955 4.318 . 0 0 "[ . 1 . 2]" 1
374 1 19 LYS QE 1 19 LYS QG . . 3.340 2.272 2.074 2.749 . 0 0 "[ . 1 . 2]" 1
375 1 19 LYS QG 1 20 ASN H . . 4.080 3.308 2.520 4.084 0.004 19 0 "[ . 1 . 2]" 1
376 1 20 ASN H 1 20 ASN QB . . 2.990 2.363 2.287 3.004 0.014 9 0 "[ . 1 . 2]" 1
377 1 20 ASN H 1 20 ASN HD21 . . 4.400 2.786 2.396 3.614 . 0 0 "[ . 1 . 2]" 1
378 1 20 ASN H 1 20 ASN QD . . 3.650 2.735 2.379 3.217 . 0 0 "[ . 1 . 2]" 1
379 1 20 ASN H 1 20 ASN HD22 . . 4.400 4.239 3.577 4.413 0.013 16 0 "[ . 1 . 2]" 1
380 1 20 ASN H 1 21 VAL H . . 2.980 2.069 2.028 2.166 . 0 0 "[ . 1 . 2]" 1
381 1 20 ASN H 1 21 VAL HB . . 4.360 4.283 4.159 4.375 0.015 13 0 "[ . 1 . 2]" 1
382 1 20 ASN H 1 21 VAL MG2 . . 4.350 4.041 3.742 4.214 . 0 0 "[ . 1 . 2]" 1
383 1 20 ASN HA 1 28 TRP HZ2 . . 4.990 4.501 4.036 4.992 0.002 14 0 "[ . 1 . 2]" 1
384 1 20 ASN QB 1 20 ASN HD22 . . 3.680 3.308 3.224 3.356 . 0 0 "[ . 1 . 2]" 1
385 1 20 ASN QB 1 21 VAL H . . 3.480 2.865 2.585 3.374 . 0 0 "[ . 1 . 2]" 1
386 1 20 ASN QB 1 21 VAL MG2 . . 3.730 3.098 2.862 3.558 . 0 0 "[ . 1 . 2]" 1
387 1 20 ASN QB 1 28 TRP HH2 . . 4.030 3.596 3.146 4.019 . 0 0 "[ . 1 . 2]" 1
388 1 20 ASN QB 1 28 TRP HZ2 . . 4.380 3.757 3.290 4.145 . 0 0 "[ . 1 . 2]" 1
389 1 20 ASN QB 1 28 TRP HZ3 . . 4.700 4.066 3.660 4.475 . 0 0 "[ . 1 . 2]" 1
390 1 20 ASN QB 1 65 ALA MB . . 4.980 4.787 4.576 4.981 0.001 8 0 "[ . 1 . 2]" 1
391 1 20 ASN QD 1 21 VAL MG2 . . 5.340 4.990 4.034 5.315 . 0 0 "[ . 1 . 2]" 1
392 1 21 VAL H 1 21 VAL HB . . 3.230 2.458 2.382 2.553 . 0 0 "[ . 1 . 2]" 1
393 1 21 VAL H 1 21 VAL MG1 . . 3.900 3.762 3.708 3.814 . 0 0 "[ . 1 . 2]" 1
394 1 21 VAL H 1 21 VAL MG2 . . 3.200 2.706 2.374 2.955 . 0 0 "[ . 1 . 2]" 1
395 1 21 VAL H 1 22 LEU H . . 3.260 2.525 2.388 2.692 . 0 0 "[ . 1 . 2]" 1
396 1 21 VAL H 1 22 LEU HB2 . . 5.060 4.642 4.444 4.924 . 0 0 "[ . 1 . 2]" 1
397 1 21 VAL H 1 22 LEU MD1 . . 5.500 5.303 5.096 5.506 0.006 17 0 "[ . 1 . 2]" 1
398 1 21 VAL H 1 22 LEU MD2 . . 5.500 4.686 4.323 5.071 . 0 0 "[ . 1 . 2]" 1
399 1 21 VAL H 1 22 LEU HG . . 4.430 4.088 3.809 4.338 . 0 0 "[ . 1 . 2]" 1
400 1 21 VAL H 1 23 ASP H . . 5.110 3.580 3.275 3.844 . 0 0 "[ . 1 . 2]" 1
401 1 21 VAL HA 1 21 VAL MG1 . . 3.430 2.427 2.343 2.529 . 0 0 "[ . 1 . 2]" 1
402 1 21 VAL HA 1 21 VAL MG2 . . 3.280 2.260 2.139 2.441 . 0 0 "[ . 1 . 2]" 1
403 1 21 VAL HA 1 24 SER H . . 4.190 3.821 3.659 4.022 . 0 0 "[ . 1 . 2]" 1
404 1 21 VAL HA 1 24 SER HB2 . . 4.200 3.881 3.591 4.203 0.003 9 0 "[ . 1 . 2]" 1
405 1 21 VAL HA 1 24 SER HB3 . . 4.200 2.973 2.431 3.514 . 0 0 "[ . 1 . 2]" 1
406 1 21 VAL HA 1 28 TRP HD1 . . 4.270 2.784 2.495 3.031 . 0 0 "[ . 1 . 2]" 1
407 1 21 VAL HA 1 28 TRP HE1 . . 4.050 3.274 3.028 3.544 . 0 0 "[ . 1 . 2]" 1
408 1 21 VAL HA 1 28 TRP HZ2 . . 5.320 4.895 4.498 5.266 . 0 0 "[ . 1 . 2]" 1
409 1 21 VAL HB 1 22 LEU H . . 3.410 2.184 2.083 2.370 . 0 0 "[ . 1 . 2]" 1
410 1 21 VAL HB 1 22 LEU MD2 . . 4.410 3.229 2.724 3.695 . 0 0 "[ . 1 . 2]" 1
411 1 21 VAL HB 1 22 LEU HG . . 4.560 3.222 3.012 3.411 . 0 0 "[ . 1 . 2]" 1
412 1 21 VAL MG1 1 22 LEU H . . 3.940 2.827 2.584 2.973 . 0 0 "[ . 1 . 2]" 1
413 1 21 VAL MG1 1 22 LEU HA . . 4.170 3.118 2.858 3.308 . 0 0 "[ . 1 . 2]" 1
414 1 21 VAL MG1 1 22 LEU MD2 . . 3.340 2.319 1.958 2.681 . 0 0 "[ . 1 . 2]" 1
415 1 21 VAL MG1 1 22 LEU HG . . 4.520 3.607 3.267 3.938 . 0 0 "[ . 1 . 2]" 1
416 1 21 VAL MG1 1 24 SER H . . 4.800 4.385 4.232 4.539 . 0 0 "[ . 1 . 2]" 1
417 1 21 VAL MG1 1 28 TRP H . . 4.480 3.565 3.289 3.844 . 0 0 "[ . 1 . 2]" 1
418 1 21 VAL MG1 1 28 TRP HB2 . . 3.830 2.165 1.977 2.401 . 0 0 "[ . 1 . 2]" 1
419 1 21 VAL MG1 1 28 TRP HB3 . . 4.180 3.320 3.079 3.526 . 0 0 "[ . 1 . 2]" 1
420 1 21 VAL MG1 1 28 TRP HD1 . . 4.060 2.941 2.429 3.360 . 0 0 "[ . 1 . 2]" 1
421 1 21 VAL MG1 1 28 TRP HE1 . . 5.090 4.667 4.146 5.035 . 0 0 "[ . 1 . 2]" 1
422 1 21 VAL MG1 1 30 VAL MG2 . . 3.950 3.763 3.491 3.956 0.006 8 0 "[ . 1 . 2]" 1
423 1 21 VAL MG1 1 90 PHE H . . 4.700 4.453 4.028 4.696 . 0 0 "[ . 1 . 2]" 1
424 1 21 VAL MG1 1 90 PHE HB2 . . 4.180 2.321 1.974 2.660 . 0 0 "[ . 1 . 2]" 1
425 1 21 VAL MG1 1 90 PHE HB3 . . 3.660 2.633 2.266 3.044 . 0 0 "[ . 1 . 2]" 1
426 1 21 VAL MG1 1 90 PHE QD . . 3.830 3.455 3.189 3.629 . 0 0 "[ . 1 . 2]" 1
427 1 21 VAL MG1 1 90 PHE QE . . 5.280 4.762 4.417 4.985 . 0 0 "[ . 1 . 2]" 1
428 1 21 VAL MG2 1 22 LEU H . . 4.050 3.739 3.650 3.870 . 0 0 "[ . 1 . 2]" 1
429 1 21 VAL MG2 1 28 TRP HB2 . . 4.600 2.240 1.937 2.488 . 0 0 "[ . 1 . 2]" 1
430 1 21 VAL MG2 1 28 TRP HB3 . . 4.620 2.155 1.961 2.356 . 0 0 "[ . 1 . 2]" 1
431 1 21 VAL MG2 1 28 TRP HD1 . . 4.830 3.584 3.301 3.815 . 0 0 "[ . 1 . 2]" 1
432 1 21 VAL MG2 1 28 TRP HE1 . . 4.700 4.349 4.091 4.667 . 0 0 "[ . 1 . 2]" 1
433 1 21 VAL MG2 1 28 TRP HE3 . . 4.490 3.215 2.849 3.519 . 0 0 "[ . 1 . 2]" 1
434 1 21 VAL MG2 1 28 TRP HZ2 . . 5.230 4.997 4.573 5.239 0.009 5 0 "[ . 1 . 2]" 1
435 1 21 VAL MG2 1 28 TRP HZ3 . . 4.850 4.562 4.236 4.848 . 0 0 "[ . 1 . 2]" 1
436 1 21 VAL MG2 1 30 VAL MG2 . . 3.780 2.816 2.635 3.134 . 0 0 "[ . 1 . 2]" 1
437 1 21 VAL MG2 1 65 ALA MB . . 4.240 4.068 3.899 4.242 0.002 1 0 "[ . 1 . 2]" 1
438 1 21 VAL MG2 1 90 PHE HB3 . . 5.500 4.494 4.089 4.924 . 0 0 "[ . 1 . 2]" 1
439 1 22 LEU H 1 22 LEU HB2 . . 3.500 2.690 2.577 2.842 . 0 0 "[ . 1 . 2]" 1
440 1 22 LEU H 1 22 LEU HB3 . . 3.610 3.572 3.539 3.586 . 0 0 "[ . 1 . 2]" 1
441 1 22 LEU H 1 22 LEU MD1 . . 3.830 3.653 3.563 3.782 . 0 0 "[ . 1 . 2]" 1
442 1 22 LEU H 1 22 LEU MD2 . . 3.410 2.681 2.346 3.133 . 0 0 "[ . 1 . 2]" 1
443 1 22 LEU H 1 22 LEU HG . . 3.210 2.045 1.899 2.229 . 0 0 "[ . 1 . 2]" 1
444 1 22 LEU H 1 23 ASP H . . 3.480 2.775 2.601 2.915 . 0 0 "[ . 1 . 2]" 1
445 1 22 LEU H 1 23 ASP HA . . 5.440 5.360 5.223 5.451 0.011 18 0 "[ . 1 . 2]" 1
446 1 22 LEU HA 1 22 LEU MD2 . . 2.820 2.028 1.950 2.198 . 0 0 "[ . 1 . 2]" 1
447 1 22 LEU HA 1 22 LEU HG . . 3.960 3.392 3.223 3.512 . 0 0 "[ . 1 . 2]" 1
448 1 22 LEU HA 1 23 ASP HA . . 4.850 4.742 4.687 4.840 . 0 0 "[ . 1 . 2]" 1
449 1 22 LEU HA 1 24 SER H . . 4.610 3.537 3.366 3.714 . 0 0 "[ . 1 . 2]" 1
450 1 22 LEU HB2 1 22 LEU MD1 . . 3.020 2.368 2.214 2.516 . 0 0 "[ . 1 . 2]" 1
451 1 22 LEU HB2 1 22 LEU MD2 . . 3.290 3.179 3.165 3.192 . 0 0 "[ . 1 . 2]" 1
452 1 22 LEU HB2 1 23 ASP H . . 4.490 2.506 2.101 2.890 . 0 0 "[ . 1 . 2]" 1
453 1 22 LEU HB2 1 24 SER H . . 4.820 4.538 4.335 4.708 . 0 0 "[ . 1 . 2]" 1
454 1 22 LEU HB3 1 22 LEU MD1 . . 3.060 2.318 2.115 2.431 . 0 0 "[ . 1 . 2]" 1
455 1 22 LEU HB3 1 22 LEU MD2 . . 3.490 2.479 2.283 2.577 . 0 0 "[ . 1 . 2]" 1
456 1 22 LEU HB3 1 24 SER H . . 5.070 4.964 4.882 5.037 . 0 0 "[ . 1 . 2]" 1
457 1 22 LEU MD1 1 23 ASP H . . 4.910 4.453 4.142 4.779 . 0 0 "[ . 1 . 2]" 1
458 1 22 LEU MD2 1 23 ASP H . . 5.280 4.409 4.290 4.607 . 0 0 "[ . 1 . 2]" 1
459 1 22 LEU MD2 1 24 SER H . . 5.100 4.934 4.754 5.128 0.028 6 0 "[ . 1 . 2]" 1
460 1 22 LEU MD2 1 90 PHE QD . . 4.180 3.945 3.711 4.158 . 0 0 "[ . 1 . 2]" 1
461 1 23 ASP H 1 23 ASP HB2 . . 4.000 2.428 2.179 3.497 . 0 0 "[ . 1 . 2]" 1
462 1 23 ASP H 1 23 ASP QB . . 3.460 2.212 2.133 2.286 . 0 0 "[ . 1 . 2]" 1
463 1 23 ASP H 1 23 ASP HB3 . . 4.000 2.780 2.188 3.486 . 0 0 "[ . 1 . 2]" 1
464 1 23 ASP H 1 24 SER H . . 3.140 2.669 2.604 2.737 . 0 0 "[ . 1 . 2]" 1
465 1 23 ASP HA 1 24 SER H . . 3.370 3.266 3.165 3.389 0.019 15 0 "[ . 1 . 2]" 1
466 1 23 ASP HA 1 92 LYS QE . . 5.310 4.351 2.828 5.302 . 0 0 "[ . 1 . 2]" 1
467 1 23 ASP QB 1 24 SER H . . 3.860 3.396 3.131 3.667 . 0 0 "[ . 1 . 2]" 1
468 1 23 ASP HB2 1 24 SER H . . 4.490 4.178 3.757 4.398 . 0 0 "[ . 1 . 2]" 1
469 1 23 ASP HB3 1 24 SER H . . 4.490 3.626 3.253 4.129 . 0 0 "[ . 1 . 2]" 1
470 1 24 SER H 1 24 SER HB2 . . 3.200 2.919 2.607 3.190 . 0 0 "[ . 1 . 2]" 1
471 1 24 SER H 1 24 SER QB . . 2.690 2.531 2.380 2.650 . 0 0 "[ . 1 . 2]" 1
472 1 24 SER H 1 24 SER HB3 . . 3.200 2.801 2.563 3.013 . 0 0 "[ . 1 . 2]" 1
473 1 24 SER H 1 25 GLU H . . 4.560 4.322 4.142 4.499 . 0 0 "[ . 1 . 2]" 1
474 1 24 SER H 1 26 ASP H . . 5.130 4.766 4.505 5.109 . 0 0 "[ . 1 . 2]" 1
475 1 24 SER H 1 28 TRP HE1 . . 4.880 4.735 4.469 4.881 0.001 8 0 "[ . 1 . 2]" 1
476 1 24 SER H 1 92 LYS QD . . 4.480 4.206 3.476 4.490 0.010 5 0 "[ . 1 . 2]" 1
477 1 24 SER H 1 92 LYS QE . . 5.180 4.450 3.115 5.186 0.006 8 0 "[ . 1 . 2]" 1
478 1 24 SER HA 1 25 GLU H . . 3.060 2.172 2.140 2.249 . 0 0 "[ . 1 . 2]" 1
479 1 24 SER HA 1 26 ASP H . . 4.250 3.673 3.366 3.971 . 0 0 "[ . 1 . 2]" 1
480 1 24 SER HA 1 28 TRP HE1 . . 4.830 4.637 4.274 4.829 . 0 0 "[ . 1 . 2]" 1
481 1 24 SER QB 1 25 GLU H . . 4.060 3.706 3.509 3.971 . 0 0 "[ . 1 . 2]" 1
482 1 24 SER QB 1 28 TRP HD1 . . 4.030 2.993 2.722 3.286 . 0 0 "[ . 1 . 2]" 1
483 1 24 SER HB2 1 25 GLU H . . 4.650 4.320 4.007 4.543 . 0 0 "[ . 1 . 2]" 1
484 1 24 SER HB2 1 26 ASP H . . 4.510 4.315 4.163 4.510 . 0 0 "[ . 1 . 2]" 1
485 1 24 SER HB2 1 28 TRP HE1 . . 3.620 2.824 2.604 3.082 . 0 0 "[ . 1 . 2]" 1
486 1 24 SER HB3 1 25 GLU H . . 4.650 4.042 3.754 4.421 . 0 0 "[ . 1 . 2]" 1
487 1 24 SER HB3 1 26 ASP H . . 4.510 3.150 2.741 3.886 . 0 0 "[ . 1 . 2]" 1
488 1 24 SER HB3 1 28 TRP HE1 . . 3.620 2.075 1.926 2.262 . 0 0 "[ . 1 . 2]" 1
489 1 24 SER HG 1 25 GLU H . . 4.840 3.680 2.433 4.526 . 0 0 "[ . 1 . 2]" 1
490 1 24 SER HG 1 26 ASP H . . 4.760 3.000 1.916 3.987 . 0 0 "[ . 1 . 2]" 1
491 1 24 SER HG 1 28 TRP HE1 . . 4.130 2.509 1.909 3.628 . 0 0 "[ . 1 . 2]" 1
492 1 25 GLU H 1 25 GLU HB2 . . 4.010 2.897 2.241 3.661 . 0 0 "[ . 1 . 2]" 1
493 1 25 GLU H 1 25 GLU QB . . 3.300 2.481 2.217 2.733 . 0 0 "[ . 1 . 2]" 1
494 1 25 GLU H 1 25 GLU HB3 . . 4.010 3.238 2.510 3.628 . 0 0 "[ . 1 . 2]" 1
495 1 25 GLU H 1 25 GLU HG2 . . 4.260 3.012 1.901 4.103 . 0 0 "[ . 1 . 2]" 1
496 1 25 GLU H 1 25 GLU HG3 . . 4.260 3.011 2.350 3.903 . 0 0 "[ . 1 . 2]" 1
497 1 25 GLU H 1 26 ASP H . . 3.480 2.782 2.411 3.150 . 0 0 "[ . 1 . 2]" 1
498 1 25 GLU HA 1 25 GLU HG2 . . 3.940 3.223 2.305 3.883 . 0 0 "[ . 1 . 2]" 1
499 1 25 GLU HA 1 25 GLU HG3 . . 3.940 3.261 2.346 3.919 . 0 0 "[ . 1 . 2]" 1
500 1 25 GLU HA 1 92 LYS HB2 . . 4.800 2.563 1.995 4.394 . 0 0 "[ . 1 . 2]" 1
501 1 25 GLU HA 1 92 LYS QB . . 4.210 2.384 1.974 3.121 . 0 0 "[ . 1 . 2]" 1
502 1 25 GLU HA 1 92 LYS HB3 . . 4.800 3.091 2.641 3.607 . 0 0 "[ . 1 . 2]" 1
503 1 25 GLU HA 1 92 LYS QD . . 4.000 2.780 1.980 4.001 0.001 8 0 "[ . 1 . 2]" 1
504 1 25 GLU HA 1 92 LYS QE . . 4.550 4.028 2.572 4.554 0.004 15 0 "[ . 1 . 2]" 1
505 1 25 GLU QB 1 26 ASP H . . 4.330 3.650 2.956 4.032 . 0 0 "[ . 1 . 2]" 1
506 1 25 GLU HB2 1 26 ASP H . . 4.950 3.969 3.069 4.471 . 0 0 "[ . 1 . 2]" 1
507 1 25 GLU HB3 1 26 ASP H . . 4.950 4.314 3.850 4.597 . 0 0 "[ . 1 . 2]" 1
508 1 25 GLU QG 1 26 ASP H . . 5.300 4.034 2.595 4.827 . 0 0 "[ . 1 . 2]" 1
509 1 26 ASP H 1 26 ASP HB2 . . 3.960 2.608 2.211 3.504 . 0 0 "[ . 1 . 2]" 1
510 1 26 ASP H 1 26 ASP QB . . 3.370 2.508 2.188 2.676 . 0 0 "[ . 1 . 2]" 1
511 1 26 ASP H 1 26 ASP HB3 . . 3.960 3.606 2.489 3.770 . 0 0 "[ . 1 . 2]" 1
512 1 26 ASP H 1 28 TRP HD1 . . 4.760 3.950 3.522 4.571 . 0 0 "[ . 1 . 2]" 1
513 1 26 ASP H 1 28 TRP HE1 . . 4.240 3.888 3.542 4.189 . 0 0 "[ . 1 . 2]" 1
514 1 26 ASP H 1 92 LYS QB . . 5.340 4.459 3.423 5.228 . 0 0 "[ . 1 . 2]" 1
515 1 26 ASP HA 1 27 VAL H . . 3.020 2.341 2.303 2.350 . 0 0 "[ . 1 . 2]" 1
516 1 26 ASP HA 1 27 VAL MG2 . . 4.160 3.619 3.407 3.792 . 0 0 "[ . 1 . 2]" 1
517 1 26 ASP HA 1 61 LYS HA . . 5.490 5.007 4.444 5.290 . 0 0 "[ . 1 . 2]" 1
518 1 26 ASP HA 1 61 LYS HD2 . . 4.460 2.904 2.243 3.702 . 0 0 "[ . 1 . 2]" 1
519 1 26 ASP HA 1 61 LYS HD3 . . 4.460 3.765 2.876 4.453 . 0 0 "[ . 1 . 2]" 1
520 1 26 ASP HA 1 61 LYS HE2 . . 4.980 3.881 2.005 4.976 . 0 0 "[ . 1 . 2]" 1
521 1 26 ASP HA 1 61 LYS HE3 . . 4.980 3.355 2.001 4.714 . 0 0 "[ . 1 . 2]" 1
522 1 26 ASP QB 1 27 VAL H . . 3.210 2.601 2.524 3.268 0.058 8 0 "[ . 1 . 2]" 1
523 1 26 ASP QB 1 28 TRP HD1 . . 4.540 3.589 3.384 3.973 . 0 0 "[ . 1 . 2]" 1
524 1 26 ASP QB 1 28 TRP HE1 . . 3.440 3.045 2.862 3.182 . 0 0 "[ . 1 . 2]" 1
525 1 26 ASP QB 1 61 LYS HA . . 4.300 3.580 3.103 4.311 0.011 8 0 "[ . 1 . 2]" 1
526 1 26 ASP QB 1 61 LYS QE . . 5.040 3.903 2.689 4.787 . 0 0 "[ . 1 . 2]" 1
527 1 26 ASP QB 1 63 LYS H . . 4.900 3.892 3.609 4.910 0.010 8 0 "[ . 1 . 2]" 1
528 1 26 ASP QB 1 63 LYS QE . . 4.880 4.684 4.135 4.887 0.007 16 0 "[ . 1 . 2]" 1
529 1 26 ASP QB 1 63 LYS QG . . 4.810 3.594 3.085 4.034 . 0 0 "[ . 1 . 2]" 1
530 1 26 ASP HB2 1 28 TRP HD1 . . 5.410 3.805 3.453 5.404 . 0 0 "[ . 1 . 2]" 1
531 1 26 ASP HB2 1 63 LYS HD2 . . 4.860 3.556 2.935 4.099 . 0 0 "[ . 1 . 2]" 1
532 1 26 ASP HB3 1 28 TRP HD1 . . 5.410 4.639 4.089 5.184 . 0 0 "[ . 1 . 2]" 1
533 1 26 ASP HB3 1 63 LYS HD2 . . 4.860 3.914 3.470 4.483 . 0 0 "[ . 1 . 2]" 1
534 1 27 VAL H 1 27 VAL HB . . 3.070 2.514 2.409 2.593 . 0 0 "[ . 1 . 2]" 1
535 1 27 VAL H 1 27 VAL MG1 . . 3.850 3.766 3.743 3.778 . 0 0 "[ . 1 . 2]" 1
536 1 27 VAL H 1 27 VAL MG2 . . 3.250 2.244 2.084 2.476 . 0 0 "[ . 1 . 2]" 1
537 1 27 VAL H 1 28 TRP H . . 4.670 4.545 4.486 4.609 . 0 0 "[ . 1 . 2]" 1
538 1 27 VAL H 1 61 LYS HA . . 5.130 4.915 4.329 5.128 . 0 0 "[ . 1 . 2]" 1
539 1 27 VAL H 1 62 VAL H . . 5.500 5.143 4.918 5.389 . 0 0 "[ . 1 . 2]" 1
540 1 27 VAL H 1 62 VAL HA . . 3.540 3.250 3.037 3.359 . 0 0 "[ . 1 . 2]" 1
541 1 27 VAL H 1 62 VAL MG1 . . 4.710 4.413 4.150 4.700 . 0 0 "[ . 1 . 2]" 1
542 1 27 VAL H 1 62 VAL MG2 . . 4.050 3.750 3.396 4.051 0.001 8 0 "[ . 1 . 2]" 1
543 1 27 VAL H 1 63 LYS H . . 4.260 4.209 3.777 4.270 0.010 5 0 "[ . 1 . 2]" 1
544 1 27 VAL HA 1 27 VAL MG1 . . 3.350 2.368 2.240 2.464 . 0 0 "[ . 1 . 2]" 1
545 1 27 VAL HA 1 27 VAL MG2 . . 3.210 2.338 2.208 2.473 . 0 0 "[ . 1 . 2]" 1
546 1 27 VAL HA 1 28 TRP H . . 2.810 2.166 2.141 2.238 . 0 0 "[ . 1 . 2]" 1
547 1 27 VAL HA 1 28 TRP HD1 . . 4.360 3.870 3.524 4.055 . 0 0 "[ . 1 . 2]" 1
548 1 27 VAL HA 1 90 PHE H . . 5.370 4.597 4.040 4.906 . 0 0 "[ . 1 . 2]" 1
549 1 27 VAL HA 1 92 LYS H . . 4.860 4.485 4.078 4.858 . 0 0 "[ . 1 . 2]" 1
550 1 27 VAL HB 1 28 TRP H . . 4.210 4.138 3.923 4.229 0.019 8 0 "[ . 1 . 2]" 1
551 1 27 VAL HB 1 62 VAL HA . . 3.800 2.227 1.996 2.459 . 0 0 "[ . 1 . 2]" 1
552 1 27 VAL HB 1 62 VAL MG1 . . 3.210 2.425 2.075 2.711 . 0 0 "[ . 1 . 2]" 1
553 1 27 VAL HB 1 62 VAL MG2 . . 3.150 2.253 2.027 2.474 . 0 0 "[ . 1 . 2]" 1
554 1 27 VAL HB 1 63 LYS H . . 3.880 3.698 3.211 3.882 0.002 20 0 "[ . 1 . 2]" 1
555 1 27 VAL MG1 1 28 TRP H . . 3.190 2.469 2.068 2.758 . 0 0 "[ . 1 . 2]" 1
556 1 27 VAL MG1 1 28 TRP HA . . 4.230 3.636 3.381 3.867 . 0 0 "[ . 1 . 2]" 1
557 1 27 VAL MG1 1 28 TRP HB2 . . 5.150 4.522 4.306 4.677 . 0 0 "[ . 1 . 2]" 1
558 1 27 VAL MG1 1 28 TRP HD1 . . 5.320 5.063 4.730 5.276 . 0 0 "[ . 1 . 2]" 1
559 1 27 VAL MG1 1 29 MET H . . 4.080 3.771 3.504 4.024 . 0 0 "[ . 1 . 2]" 1
560 1 27 VAL MG1 1 29 MET HA . . 5.260 4.035 3.931 4.143 . 0 0 "[ . 1 . 2]" 1
561 1 27 VAL MG1 1 29 MET HB2 . . 4.730 4.463 4.331 4.618 . 0 0 "[ . 1 . 2]" 1
562 1 27 VAL MG1 1 29 MET QG . . 3.700 2.839 2.656 3.045 . 0 0 "[ . 1 . 2]" 1
563 1 27 VAL MG1 1 62 VAL MG1 . . 3.380 2.095 1.940 2.459 . 0 0 "[ . 1 . 2]" 1
564 1 27 VAL MG1 1 89 ILE HA . . 4.850 3.935 3.637 4.170 . 0 0 "[ . 1 . 2]" 1
565 1 27 VAL MG1 1 89 ILE MG . . 2.880 2.200 1.879 2.557 . 0 0 "[ . 1 . 2]" 1
566 1 27 VAL MG1 1 90 PHE H . . 3.560 3.187 2.934 3.525 . 0 0 "[ . 1 . 2]" 1
567 1 27 VAL MG1 1 90 PHE HB2 . . 5.500 4.695 4.361 5.082 . 0 0 "[ . 1 . 2]" 1
568 1 27 VAL MG1 1 91 GLN HA . . 4.280 3.916 3.670 4.177 . 0 0 "[ . 1 . 2]" 1
569 1 27 VAL MG1 1 91 GLN QB . . 5.340 4.634 4.188 4.895 . 0 0 "[ . 1 . 2]" 1
570 1 27 VAL MG1 1 91 GLN QG . . 3.990 2.889 2.367 3.469 . 0 0 "[ . 1 . 2]" 1
571 1 27 VAL MG1 1 115 LEU QB . . 4.120 3.208 2.794 3.432 . 0 0 "[ . 1 . 2]" 1
572 1 27 VAL MG2 1 28 TRP H . . 4.220 3.989 3.823 4.108 . 0 0 "[ . 1 . 2]" 1
573 1 27 VAL MG2 1 61 LYS QD . . 5.250 3.505 2.239 4.711 . 0 0 "[ . 1 . 2]" 1
574 1 27 VAL MG2 1 61 LYS QE . . 4.590 3.381 2.362 4.532 . 0 0 "[ . 1 . 2]" 1
575 1 27 VAL MG2 1 61 LYS QG . . 4.780 3.242 2.961 4.186 . 0 0 "[ . 1 . 2]" 1
576 1 27 VAL MG2 1 62 VAL MG1 . . 3.720 3.425 3.182 3.663 . 0 0 "[ . 1 . 2]" 1
577 1 27 VAL MG2 1 62 VAL MG2 . . 3.540 2.601 2.235 2.950 . 0 0 "[ . 1 . 2]" 1
578 1 27 VAL MG2 1 63 LYS H . . 5.270 5.018 4.629 5.131 . 0 0 "[ . 1 . 2]" 1
579 1 27 VAL MG2 1 91 GLN HA . . 3.930 3.320 2.667 3.694 . 0 0 "[ . 1 . 2]" 1
580 1 27 VAL MG2 1 91 GLN QB . . 4.220 3.822 3.248 4.221 0.001 2 0 "[ . 1 . 2]" 1
581 1 27 VAL MG2 1 91 GLN QE . . 4.210 3.579 1.818 4.214 0.004 7 0 "[ . 1 . 2]" 1
582 1 27 VAL MG2 1 91 GLN HG2 . . 4.150 2.482 1.957 3.925 . 0 0 "[ . 1 . 2]" 1
583 1 27 VAL MG2 1 91 GLN QG . . 3.430 2.318 1.941 3.297 . 0 0 "[ . 1 . 2]" 1
584 1 27 VAL MG2 1 91 GLN HG3 . . 4.150 3.225 2.198 4.147 . 0 0 "[ . 1 . 2]" 1
585 1 27 VAL MG2 1 92 LYS H . . 4.510 4.347 4.026 4.512 0.002 13 0 "[ . 1 . 2]" 1
586 1 27 VAL MG2 1 115 LEU HB2 . . 4.430 3.403 3.144 3.566 . 0 0 "[ . 1 . 2]" 1
587 1 27 VAL MG2 1 115 LEU QB . . 3.560 2.901 2.463 3.107 . 0 0 "[ . 1 . 2]" 1
588 1 27 VAL MG2 1 115 LEU HB3 . . 4.430 3.161 2.559 3.493 . 0 0 "[ . 1 . 2]" 1
589 1 27 VAL MG2 1 115 LEU HG . . 5.500 5.349 5.065 5.505 0.005 9 0 "[ . 1 . 2]" 1
590 1 27 VAL MG2 1 116 PHE H . . 5.460 4.708 4.491 5.022 . 0 0 "[ . 1 . 2]" 1
591 1 27 VAL MG2 1 119 ASN HB2 . . 4.380 3.333 2.723 4.003 . 0 0 "[ . 1 . 2]" 1
592 1 27 VAL MG2 1 119 ASN QB . . 3.800 3.038 2.173 3.564 . 0 0 "[ . 1 . 2]" 1
593 1 27 VAL MG2 1 119 ASN HB3 . . 4.380 3.619 2.255 4.372 . 0 0 "[ . 1 . 2]" 1
594 1 27 VAL MG2 1 119 ASN HD21 . . 4.240 2.873 1.998 4.041 . 0 0 "[ . 1 . 2]" 1
595 1 27 VAL MG2 1 119 ASN QD . . 3.720 2.395 1.772 3.277 . 0 0 "[ . 1 . 2]" 1
596 1 27 VAL MG2 1 119 ASN HD22 . . 4.240 2.654 1.804 3.907 . 0 0 "[ . 1 . 2]" 1
597 1 28 TRP H 1 28 TRP HB2 . . 3.360 2.473 2.404 2.592 . 0 0 "[ . 1 . 2]" 1
598 1 28 TRP H 1 28 TRP HB3 . . 3.960 3.647 3.597 3.720 . 0 0 "[ . 1 . 2]" 1
599 1 28 TRP H 1 28 TRP HD1 . . 3.640 3.363 3.023 3.570 . 0 0 "[ . 1 . 2]" 1
600 1 28 TRP H 1 29 MET H . . 4.480 4.207 4.096 4.283 . 0 0 "[ . 1 . 2]" 1
601 1 28 TRP H 1 30 VAL MG2 . . 5.390 5.207 4.942 5.393 0.003 11 0 "[ . 1 . 2]" 1
602 1 28 TRP H 1 89 ILE HA . . 5.250 4.943 4.707 5.212 . 0 0 "[ . 1 . 2]" 1
603 1 28 TRP H 1 89 ILE MG . . 4.210 3.952 3.596 4.212 0.002 17 0 "[ . 1 . 2]" 1
604 1 28 TRP H 1 90 PHE H . . 3.840 3.294 2.950 3.517 . 0 0 "[ . 1 . 2]" 1
605 1 28 TRP H 1 90 PHE HB2 . . 4.900 3.482 2.927 3.991 . 0 0 "[ . 1 . 2]" 1
606 1 28 TRP H 1 90 PHE HB3 . . 5.270 4.787 4.204 5.254 . 0 0 "[ . 1 . 2]" 1
607 1 28 TRP H 1 91 GLN HA . . 4.490 4.323 3.866 4.487 . 0 0 "[ . 1 . 2]" 1
608 1 28 TRP HA 1 28 TRP HD1 . . 5.040 3.799 3.638 3.902 . 0 0 "[ . 1 . 2]" 1
609 1 28 TRP HA 1 28 TRP HE3 . . 4.500 3.501 3.353 3.730 . 0 0 "[ . 1 . 2]" 1
610 1 28 TRP HA 1 29 MET H . . 2.790 2.146 2.141 2.150 . 0 0 "[ . 1 . 2]" 1
611 1 28 TRP HA 1 62 VAL MG1 . . 4.470 4.061 3.809 4.338 . 0 0 "[ . 1 . 2]" 1
612 1 28 TRP HA 1 63 LYS H . . 3.500 3.307 3.164 3.509 0.009 8 0 "[ . 1 . 2]" 1
613 1 28 TRP HA 1 63 LYS HB2 . . 4.360 3.090 2.888 3.298 . 0 0 "[ . 1 . 2]" 1
614 1 28 TRP HA 1 63 LYS HB3 . . 4.690 4.479 4.020 4.697 0.007 12 0 "[ . 1 . 2]" 1
615 1 28 TRP HB2 1 28 TRP HE3 . . 4.140 4.066 4.003 4.100 . 0 0 "[ . 1 . 2]" 1
616 1 28 TRP HB2 1 29 MET H . . 4.530 4.481 4.415 4.515 . 0 0 "[ . 1 . 2]" 1
617 1 28 TRP HB2 1 30 VAL MG2 . . 4.110 3.931 3.788 4.067 . 0 0 "[ . 1 . 2]" 1
618 1 28 TRP HB2 1 90 PHE H . . 4.870 4.400 4.204 4.785 . 0 0 "[ . 1 . 2]" 1
619 1 28 TRP HB2 1 90 PHE QD . . 4.850 4.320 3.909 4.599 . 0 0 "[ . 1 . 2]" 1
620 1 28 TRP HB3 1 28 TRP HE3 . . 3.860 2.510 2.453 2.550 . 0 0 "[ . 1 . 2]" 1
621 1 28 TRP HB3 1 29 MET H . . 4.020 3.628 3.500 3.694 . 0 0 "[ . 1 . 2]" 1
622 1 28 TRP HB3 1 30 VAL MG2 . . 3.460 3.027 2.880 3.166 . 0 0 "[ . 1 . 2]" 1
623 1 28 TRP HB3 1 65 ALA MB . . 4.510 3.899 3.393 4.135 . 0 0 "[ . 1 . 2]" 1
624 1 28 TRP HB3 1 90 PHE QD . . 4.710 4.530 4.009 4.710 0.000 9 0 "[ . 1 . 2]" 1
625 1 28 TRP HE1 1 63 LYS HD2 . . 4.910 3.896 3.120 4.760 . 0 0 "[ . 1 . 2]" 1
626 1 28 TRP HE1 1 63 LYS QE . . 4.880 4.489 3.944 4.837 . 0 0 "[ . 1 . 2]" 1
627 1 28 TRP HE3 1 29 MET H . . 4.630 4.153 3.927 4.393 . 0 0 "[ . 1 . 2]" 1
628 1 28 TRP HE3 1 30 VAL MG2 . . 4.140 3.861 3.644 4.144 0.004 8 0 "[ . 1 . 2]" 1
629 1 28 TRP HE3 1 63 LYS HB2 . . 4.880 3.981 3.640 4.283 . 0 0 "[ . 1 . 2]" 1
630 1 28 TRP HE3 1 63 LYS HB3 . . 4.810 4.449 3.861 4.668 . 0 0 "[ . 1 . 2]" 1
631 1 28 TRP HE3 1 65 ALA H . . 5.110 3.958 3.817 4.186 . 0 0 "[ . 1 . 2]" 1
632 1 28 TRP HE3 1 65 ALA MB . . 3.110 2.236 2.044 2.485 . 0 0 "[ . 1 . 2]" 1
633 1 28 TRP HH2 1 63 LYS HD2 . . 5.340 4.968 3.987 5.341 0.001 8 0 "[ . 1 . 2]" 1
634 1 28 TRP HH2 1 63 LYS HD3 . . 4.690 3.706 2.758 4.319 . 0 0 "[ . 1 . 2]" 1
635 1 28 TRP HH2 1 63 LYS QE . . 4.210 3.227 2.426 4.117 . 0 0 "[ . 1 . 2]" 1
636 1 28 TRP HH2 1 65 ALA MB . . 4.650 4.322 4.110 4.647 . 0 0 "[ . 1 . 2]" 1
637 1 28 TRP HZ2 1 63 LYS HB3 . . 5.500 4.999 4.585 5.460 . 0 0 "[ . 1 . 2]" 1
638 1 28 TRP HZ2 1 63 LYS HD2 . . 4.350 3.669 2.710 4.281 . 0 0 "[ . 1 . 2]" 1
639 1 28 TRP HZ2 1 63 LYS HD3 . . 4.580 2.876 2.558 3.391 . 0 0 "[ . 1 . 2]" 1
640 1 28 TRP HZ2 1 63 LYS QE . . 3.930 2.842 2.004 3.342 . 0 0 "[ . 1 . 2]" 1
641 1 28 TRP HZ3 1 65 ALA MB . . 3.230 2.203 1.995 2.472 . 0 0 "[ . 1 . 2]" 1
642 1 29 MET H 1 29 MET HB2 . . 3.590 2.222 2.183 2.278 . 0 0 "[ . 1 . 2]" 1
643 1 29 MET H 1 29 MET ME . . 5.500 5.386 5.306 5.446 . 0 0 "[ . 1 . 2]" 1
644 1 29 MET H 1 29 MET QG . . 3.520 3.078 2.937 3.198 . 0 0 "[ . 1 . 2]" 1
645 1 29 MET H 1 30 VAL H . . 4.400 4.252 4.170 4.372 . 0 0 "[ . 1 . 2]" 1
646 1 29 MET H 1 62 VAL MG1 . . 4.030 3.693 3.358 3.960 . 0 0 "[ . 1 . 2]" 1
647 1 29 MET H 1 63 LYS H . . 4.300 4.150 4.001 4.301 0.001 8 0 "[ . 1 . 2]" 1
648 1 29 MET H 1 63 LYS HB2 . . 4.600 4.207 3.961 4.458 . 0 0 "[ . 1 . 2]" 1
649 1 29 MET H 1 64 LEU MD1 . . 4.130 3.697 3.420 3.910 . 0 0 "[ . 1 . 2]" 1
650 1 29 MET H 1 64 LEU HG . . 4.270 4.027 3.853 4.149 . 0 0 "[ . 1 . 2]" 1
651 1 29 MET H 1 89 ILE HA . . 5.380 5.252 5.131 5.368 . 0 0 "[ . 1 . 2]" 1
652 1 29 MET HA 1 29 MET ME . . 4.380 4.057 3.849 4.395 0.015 10 0 "[ . 1 . 2]" 1
653 1 29 MET HA 1 29 MET QG . . 3.650 2.258 2.200 2.366 . 0 0 "[ . 1 . 2]" 1
654 1 29 MET HA 1 30 VAL H . . 2.830 2.175 2.145 2.195 . 0 0 "[ . 1 . 2]" 1
655 1 29 MET HA 1 30 VAL MG2 . . 4.090 3.849 3.675 4.083 . 0 0 "[ . 1 . 2]" 1
656 1 29 MET HA 1 87 ILE MG . . 4.550 4.228 3.946 4.402 . 0 0 "[ . 1 . 2]" 1
657 1 29 MET HA 1 89 ILE HA . . 3.910 2.773 2.661 2.854 . 0 0 "[ . 1 . 2]" 1
658 1 29 MET HA 1 89 ILE MD . . 4.580 4.358 4.059 4.563 . 0 0 "[ . 1 . 2]" 1
659 1 29 MET HA 1 89 ILE HG13 . . 4.630 3.266 3.045 3.449 . 0 0 "[ . 1 . 2]" 1
660 1 29 MET HA 1 89 ILE MG . . 4.280 4.024 3.761 4.291 0.011 13 0 "[ . 1 . 2]" 1
661 1 29 MET HA 1 90 PHE H . . 3.940 3.817 3.655 3.944 0.004 13 0 "[ . 1 . 2]" 1
662 1 29 MET HB2 1 29 MET ME . . 4.090 3.930 3.806 4.093 0.003 12 0 "[ . 1 . 2]" 1
663 1 29 MET HB2 1 47 TRP HH2 . . 4.120 3.973 3.771 4.113 . 0 0 "[ . 1 . 2]" 1
664 1 29 MET HB2 1 54 VAL MG1 . . 5.100 4.806 4.517 4.976 . 0 0 "[ . 1 . 2]" 1
665 1 29 MET HB2 1 64 LEU H . . 5.360 4.697 4.562 4.785 . 0 0 "[ . 1 . 2]" 1
666 1 29 MET HB2 1 64 LEU HA . . 4.290 2.192 2.035 2.410 . 0 0 "[ . 1 . 2]" 1
667 1 29 MET HB2 1 64 LEU HB2 . . 4.430 4.384 4.301 4.435 0.005 18 0 "[ . 1 . 2]" 1
668 1 29 MET HB2 1 64 LEU MD1 . . 3.730 2.606 2.330 2.790 . 0 0 "[ . 1 . 2]" 1
669 1 29 MET HB2 1 64 LEU MD2 . . 4.050 3.738 3.645 3.812 . 0 0 "[ . 1 . 2]" 1
670 1 29 MET HB2 1 64 LEU HG . . 4.100 2.049 1.998 2.136 . 0 0 "[ . 1 . 2]" 1
671 1 29 MET HB2 1 65 ALA H . . 4.750 3.580 3.376 3.839 . 0 0 "[ . 1 . 2]" 1
672 1 29 MET HB3 1 29 MET ME . . 3.440 3.153 2.856 3.446 0.006 13 0 "[ . 1 . 2]" 1
673 1 29 MET HB3 1 30 VAL H . . 3.910 3.838 3.683 3.908 . 0 0 "[ . 1 . 2]" 1
674 1 29 MET HB3 1 47 TRP HE1 . . 5.430 5.103 4.730 5.420 . 0 0 "[ . 1 . 2]" 1
675 1 29 MET HB3 1 47 TRP HH2 . . 3.800 2.376 2.211 2.507 . 0 0 "[ . 1 . 2]" 1
676 1 29 MET HB3 1 47 TRP HZ2 . . 4.540 2.438 2.017 2.788 . 0 0 "[ . 1 . 2]" 1
677 1 29 MET HB3 1 64 LEU HA . . 4.640 3.323 3.190 3.484 . 0 0 "[ . 1 . 2]" 1
678 1 29 MET HB3 1 64 LEU MD1 . . 4.420 3.670 3.449 3.833 . 0 0 "[ . 1 . 2]" 1
679 1 29 MET HB3 1 64 LEU HG . . 4.220 2.502 2.362 2.648 . 0 0 "[ . 1 . 2]" 1
680 1 29 MET HB3 1 87 ILE MG . . 4.280 3.461 3.209 3.662 . 0 0 "[ . 1 . 2]" 1
681 1 29 MET ME 1 29 MET QG . . 3.000 2.073 1.963 2.206 . 0 0 "[ . 1 . 2]" 1
682 1 29 MET ME 1 30 VAL H . . 5.500 5.308 5.098 5.523 0.023 13 0 "[ . 1 . 2]" 1
683 1 29 MET ME 1 47 TRP HE3 . . 5.500 5.450 5.324 5.504 0.004 9 0 "[ . 1 . 2]" 1
684 1 29 MET ME 1 47 TRP HH2 . . 3.250 2.886 2.570 3.160 . 0 0 "[ . 1 . 2]" 1
685 1 29 MET ME 1 47 TRP HZ2 . . 4.760 4.633 4.278 4.757 . 0 0 "[ . 1 . 2]" 1
686 1 29 MET ME 1 62 VAL MG1 . . 4.370 4.066 3.841 4.346 . 0 0 "[ . 1 . 2]" 1
687 1 29 MET ME 1 64 LEU MD1 . . 4.090 3.862 3.473 4.033 . 0 0 "[ . 1 . 2]" 1
688 1 29 MET ME 1 64 LEU MD2 . . 4.070 3.711 3.392 3.958 . 0 0 "[ . 1 . 2]" 1
689 1 29 MET ME 1 64 LEU HG . . 4.340 4.061 3.774 4.299 . 0 0 "[ . 1 . 2]" 1
690 1 29 MET ME 1 87 ILE MG . . 2.780 2.322 2.045 2.582 . 0 0 "[ . 1 . 2]" 1
691 1 29 MET ME 1 89 ILE H . . 5.500 5.231 4.910 5.428 . 0 0 "[ . 1 . 2]" 1
692 1 29 MET ME 1 89 ILE HA . . 5.080 4.509 4.249 4.857 . 0 0 "[ . 1 . 2]" 1
693 1 29 MET ME 1 89 ILE MD . . 3.530 2.484 2.193 2.711 . 0 0 "[ . 1 . 2]" 1
694 1 29 MET ME 1 89 ILE HG12 . . 3.420 2.989 2.488 3.426 0.006 13 0 "[ . 1 . 2]" 1
695 1 29 MET ME 1 99 TYR HA . . 5.500 5.269 4.370 5.505 0.005 5 0 "[ . 1 . 2]" 1
696 1 29 MET ME 1 99 TYR HB2 . . 4.050 3.587 3.279 3.793 . 0 0 "[ . 1 . 2]" 1
697 1 29 MET ME 1 99 TYR HB3 . . 4.570 4.295 3.717 4.574 0.004 8 0 "[ . 1 . 2]" 1
698 1 29 MET ME 1 99 TYR QD . . 3.640 3.165 2.587 3.588 . 0 0 "[ . 1 . 2]" 1
699 1 29 MET ME 1 108 ILE HA . . 3.830 3.264 3.049 3.552 . 0 0 "[ . 1 . 2]" 1
700 1 29 MET ME 1 108 ILE MG . . 3.010 2.313 2.004 2.584 . 0 0 "[ . 1 . 2]" 1
701 1 29 MET ME 1 109 VAL HA . . 5.180 4.852 4.659 5.166 . 0 0 "[ . 1 . 2]" 1
702 1 29 MET ME 1 111 ARG H . . 4.900 4.757 4.469 4.900 0.000 4 0 "[ . 1 . 2]" 1
703 1 29 MET ME 1 111 ARG HA . . 5.500 5.375 5.179 5.482 . 0 0 "[ . 1 . 2]" 1
704 1 29 MET ME 1 111 ARG QB . . 3.790 2.926 2.674 3.320 . 0 0 "[ . 1 . 2]" 1
705 1 29 MET ME 1 111 ARG QG . . 4.110 3.116 2.488 3.984 . 0 0 "[ . 1 . 2]" 1
706 1 29 MET ME 1 112 ALA H . . 3.740 3.358 3.200 3.655 . 0 0 "[ . 1 . 2]" 1
707 1 29 MET ME 1 112 ALA HA . . 3.800 3.689 3.331 3.814 0.014 5 0 "[ . 1 . 2]" 1
708 1 29 MET ME 1 112 ALA MB . . 3.410 3.234 2.958 3.414 0.004 12 0 "[ . 1 . 2]" 1
709 1 29 MET ME 1 115 LEU QD . . 3.870 3.475 3.153 3.710 . 0 0 "[ . 1 . 2]" 1
710 1 29 MET QG 1 30 VAL H . . 4.640 4.061 3.917 4.294 . 0 0 "[ . 1 . 2]" 1
711 1 29 MET QG 1 47 TRP HH2 . . 4.430 3.779 3.424 3.987 . 0 0 "[ . 1 . 2]" 1
712 1 29 MET QG 1 47 TRP HZ2 . . 5.030 4.513 4.167 4.821 . 0 0 "[ . 1 . 2]" 1
713 1 29 MET QG 1 62 VAL MG1 . . 3.540 2.721 2.511 3.000 . 0 0 "[ . 1 . 2]" 1
714 1 29 MET QG 1 64 LEU HA . . 4.600 4.175 3.964 4.402 . 0 0 "[ . 1 . 2]" 1
715 1 29 MET QG 1 64 LEU MD1 . . 4.040 3.194 2.636 3.481 . 0 0 "[ . 1 . 2]" 1
716 1 29 MET QG 1 64 LEU HG . . 4.540 3.552 2.905 3.796 . 0 0 "[ . 1 . 2]" 1
717 1 29 MET QG 1 65 ALA H . . 5.430 5.249 5.068 5.429 . 0 0 "[ . 1 . 2]" 1
718 1 29 MET QG 1 87 ILE MG . . 3.970 3.566 3.320 3.855 . 0 0 "[ . 1 . 2]" 1
719 1 29 MET QG 1 89 ILE H . . 5.500 5.167 4.960 5.508 0.008 4 0 "[ . 1 . 2]" 1
720 1 29 MET QG 1 89 ILE HA . . 4.570 3.285 3.038 3.428 . 0 0 "[ . 1 . 2]" 1
721 1 29 MET QG 1 89 ILE MD . . 3.680 3.294 2.837 3.693 0.013 10 0 "[ . 1 . 2]" 1
722 1 29 MET QG 1 89 ILE HG12 . . 4.150 3.238 2.975 3.621 . 0 0 "[ . 1 . 2]" 1
723 1 29 MET QG 1 89 ILE HG13 . . 4.140 2.107 1.981 2.528 . 0 0 "[ . 1 . 2]" 1
724 1 29 MET QG 1 89 ILE MG . . 4.010 3.347 3.036 3.670 . 0 0 "[ . 1 . 2]" 1
725 1 29 MET QG 1 90 PHE H . . 4.760 4.446 4.136 4.678 . 0 0 "[ . 1 . 2]" 1
726 1 29 MET QG 1 115 LEU QD . . 4.240 3.726 3.263 4.165 . 0 0 "[ . 1 . 2]" 1
727 1 30 VAL H 1 30 VAL HB . . 3.180 2.524 2.435 2.622 . 0 0 "[ . 1 . 2]" 1
728 1 30 VAL H 1 30 VAL MG1 . . 3.880 3.792 3.760 3.830 . 0 0 "[ . 1 . 2]" 1
729 1 30 VAL H 1 30 VAL MG2 . . 3.260 2.455 2.186 2.610 . 0 0 "[ . 1 . 2]" 1
730 1 30 VAL H 1 31 GLU H . . 4.590 4.444 4.284 4.526 . 0 0 "[ . 1 . 2]" 1
731 1 30 VAL H 1 32 PHE QE . . 5.500 5.445 5.261 5.508 0.008 17 0 "[ . 1 . 2]" 1
732 1 30 VAL H 1 47 TRP HH2 . . 5.170 5.062 4.880 5.180 0.010 15 0 "[ . 1 . 2]" 1
733 1 30 VAL H 1 47 TRP HZ2 . . 4.940 4.774 4.592 4.914 . 0 0 "[ . 1 . 2]" 1
734 1 30 VAL H 1 87 ILE MG . . 4.600 4.329 3.833 4.538 . 0 0 "[ . 1 . 2]" 1
735 1 30 VAL H 1 88 LYS H . . 3.710 3.550 3.114 3.715 0.005 9 0 "[ . 1 . 2]" 1
736 1 30 VAL H 1 88 LYS HB2 . . 4.470 4.117 3.877 4.395 . 0 0 "[ . 1 . 2]" 1
737 1 30 VAL H 1 89 ILE HA . . 3.840 3.495 3.342 3.697 . 0 0 "[ . 1 . 2]" 1
738 1 30 VAL H 1 89 ILE MD . . 5.390 5.026 4.684 5.220 . 0 0 "[ . 1 . 2]" 1
739 1 30 VAL H 1 89 ILE HG13 . . 4.970 4.694 4.419 4.972 0.002 17 0 "[ . 1 . 2]" 1
740 1 30 VAL H 1 90 PHE QD . . 4.020 3.110 2.765 3.334 . 0 0 "[ . 1 . 2]" 1
741 1 30 VAL H 1 90 PHE QE . . 4.270 3.458 2.742 3.904 . 0 0 "[ . 1 . 2]" 1
742 1 30 VAL HA 1 30 VAL MG1 . . 3.440 2.343 2.200 2.458 . 0 0 "[ . 1 . 2]" 1
743 1 30 VAL HA 1 30 VAL MG2 . . 3.510 2.385 2.217 2.490 . 0 0 "[ . 1 . 2]" 1
744 1 30 VAL HA 1 31 GLU H . . 3.070 2.149 2.141 2.165 . 0 0 "[ . 1 . 2]" 1
745 1 30 VAL HA 1 47 TRP HE1 . . 5.320 5.232 4.946 5.324 0.004 13 0 "[ . 1 . 2]" 1
746 1 30 VAL HA 1 47 TRP HZ2 . . 4.240 4.042 3.836 4.236 . 0 0 "[ . 1 . 2]" 1
747 1 30 VAL HA 1 65 ALA H . . 3.750 3.408 3.181 3.667 . 0 0 "[ . 1 . 2]" 1
748 1 30 VAL HA 1 65 ALA MB . . 3.850 3.203 2.878 3.485 . 0 0 "[ . 1 . 2]" 1
749 1 30 VAL HA 1 66 ALA HA . . 4.640 3.840 3.548 4.069 . 0 0 "[ . 1 . 2]" 1
750 1 30 VAL HA 1 87 ILE MG . . 5.500 5.367 5.102 5.504 0.004 14 0 "[ . 1 . 2]" 1
751 1 30 VAL HA 1 88 LYS H . . 5.200 4.887 4.745 5.000 . 0 0 "[ . 1 . 2]" 1
752 1 30 VAL HB 1 31 GLU H . . 4.840 4.224 4.079 4.348 . 0 0 "[ . 1 . 2]" 1
753 1 30 VAL HB 1 32 PHE QD . . 4.970 4.736 4.435 4.946 . 0 0 "[ . 1 . 2]" 1
754 1 30 VAL HB 1 32 PHE QE . . 4.200 3.345 3.153 3.568 . 0 0 "[ . 1 . 2]" 1
755 1 30 VAL HB 1 67 VAL MG2 . . 4.920 4.481 4.181 4.693 . 0 0 "[ . 1 . 2]" 1
756 1 30 VAL HB 1 88 LYS H . . 4.140 3.628 3.384 3.859 . 0 0 "[ . 1 . 2]" 1
757 1 30 VAL HB 1 88 LYS HB2 . . 3.540 3.014 2.763 3.353 . 0 0 "[ . 1 . 2]" 1
758 1 30 VAL HB 1 90 PHE QD . . 4.360 3.534 3.133 3.841 . 0 0 "[ . 1 . 2]" 1
759 1 30 VAL HB 1 90 PHE QE . . 3.830 2.184 2.000 2.480 . 0 0 "[ . 1 . 2]" 1
760 1 30 VAL MG1 1 31 GLU H . . 3.600 2.646 2.293 2.982 . 0 0 "[ . 1 . 2]" 1
761 1 30 VAL MG1 1 31 GLU HA . . 4.740 3.689 3.492 3.912 . 0 0 "[ . 1 . 2]" 1
762 1 30 VAL MG1 1 32 PHE H . . 4.830 3.554 3.045 4.384 . 0 0 "[ . 1 . 2]" 1
763 1 30 VAL MG1 1 32 PHE HA . . 4.550 4.017 3.767 4.453 . 0 0 "[ . 1 . 2]" 1
764 1 30 VAL MG1 1 32 PHE QD . . 4.250 3.257 3.106 3.658 . 0 0 "[ . 1 . 2]" 1
765 1 30 VAL MG1 1 32 PHE QE . . 4.120 2.614 2.306 2.979 . 0 0 "[ . 1 . 2]" 1
766 1 30 VAL MG1 1 32 PHE HZ . . 4.040 2.708 2.318 3.220 . 0 0 "[ . 1 . 2]" 1
767 1 30 VAL MG1 1 65 ALA MB . . 4.170 3.830 3.567 4.094 . 0 0 "[ . 1 . 2]" 1
768 1 30 VAL MG1 1 66 ALA HA . . 4.260 3.662 3.096 4.064 . 0 0 "[ . 1 . 2]" 1
769 1 30 VAL MG1 1 66 ALA MB . . 5.090 4.780 4.344 5.072 . 0 0 "[ . 1 . 2]" 1
770 1 30 VAL MG1 1 67 VAL H . . 3.950 3.763 3.463 3.957 0.007 5 0 "[ . 1 . 2]" 1
771 1 30 VAL MG1 1 67 VAL HB . . 3.990 2.975 2.706 3.148 . 0 0 "[ . 1 . 2]" 1
772 1 30 VAL MG1 1 67 VAL MG1 . . 3.930 3.688 3.522 3.926 . 0 0 "[ . 1 . 2]" 1
773 1 30 VAL MG1 1 67 VAL MG2 . . 2.960 1.930 1.770 2.134 . 0 0 "[ . 1 . 2]" 1
774 1 30 VAL MG1 1 90 PHE QD . . 4.950 4.714 4.426 4.885 . 0 0 "[ . 1 . 2]" 1
775 1 30 VAL MG1 1 90 PHE QE . . 4.000 3.472 3.187 3.691 . 0 0 "[ . 1 . 2]" 1
776 1 30 VAL MG2 1 31 GLU H . . 4.170 4.077 3.936 4.193 0.023 13 0 "[ . 1 . 2]" 1
777 1 30 VAL MG2 1 32 PHE QE . . 4.820 4.327 4.167 4.545 . 0 0 "[ . 1 . 2]" 1
778 1 30 VAL MG2 1 65 ALA H . . 4.650 4.248 4.060 4.379 . 0 0 "[ . 1 . 2]" 1
779 1 30 VAL MG2 1 65 ALA MB . . 3.530 3.165 2.614 3.531 0.001 3 0 "[ . 1 . 2]" 1
780 1 30 VAL MG2 1 67 VAL MG2 . . 4.070 3.223 2.945 3.469 . 0 0 "[ . 1 . 2]" 1
781 1 30 VAL MG2 1 90 PHE HB2 . . 5.500 3.949 3.569 4.244 . 0 0 "[ . 1 . 2]" 1
782 1 30 VAL MG2 1 90 PHE QD . . 3.350 2.655 2.187 3.076 . 0 0 "[ . 1 . 2]" 1
783 1 30 VAL MG2 1 90 PHE QE . . 3.530 2.616 2.060 3.138 . 0 0 "[ . 1 . 2]" 1
784 1 30 VAL MG2 1 90 PHE HZ . . 4.880 4.124 3.488 4.614 . 0 0 "[ . 1 . 2]" 1
785 1 31 GLU H 1 31 GLU HB2 . . 3.750 3.207 2.974 3.379 . 0 0 "[ . 1 . 2]" 1
786 1 31 GLU H 1 31 GLU HB3 . . 3.530 2.538 2.396 2.657 . 0 0 "[ . 1 . 2]" 1
787 1 31 GLU H 1 32 PHE H . . 5.240 4.069 3.815 4.347 . 0 0 "[ . 1 . 2]" 1
788 1 31 GLU H 1 47 TRP HE1 . . 4.700 4.430 4.042 4.659 . 0 0 "[ . 1 . 2]" 1
789 1 31 GLU H 1 47 TRP HH2 . . 5.190 5.033 4.680 5.185 . 0 0 "[ . 1 . 2]" 1
790 1 31 GLU H 1 47 TRP HZ2 . . 4.030 3.731 3.383 4.006 . 0 0 "[ . 1 . 2]" 1
791 1 31 GLU H 1 65 ALA H . . 4.610 4.251 3.955 4.454 . 0 0 "[ . 1 . 2]" 1
792 1 31 GLU H 1 65 ALA MB . . 4.390 4.195 3.880 4.394 0.004 13 0 "[ . 1 . 2]" 1
793 1 31 GLU H 1 66 ALA HA . . 3.560 2.375 2.211 2.628 . 0 0 "[ . 1 . 2]" 1
794 1 31 GLU H 1 66 ALA MB . . 4.230 3.881 3.677 4.023 . 0 0 "[ . 1 . 2]" 1
795 1 31 GLU H 1 67 VAL H . . 4.210 3.750 3.452 4.137 . 0 0 "[ . 1 . 2]" 1
796 1 31 GLU H 1 67 VAL MG2 . . 4.870 3.831 3.417 4.203 . 0 0 "[ . 1 . 2]" 1
797 1 31 GLU HA 1 32 PHE H . . 3.140 2.179 2.139 2.241 . 0 0 "[ . 1 . 2]" 1
798 1 31 GLU HA 1 32 PHE QD . . 4.710 3.449 3.098 3.680 . 0 0 "[ . 1 . 2]" 1
799 1 31 GLU HA 1 86 THR H . . 4.480 4.034 3.736 4.425 . 0 0 "[ . 1 . 2]" 1
800 1 31 GLU HA 1 87 ILE HA . . 3.910 2.315 2.036 2.485 . 0 0 "[ . 1 . 2]" 1
801 1 31 GLU HA 1 87 ILE MD . . 5.350 4.903 4.471 5.210 . 0 0 "[ . 1 . 2]" 1
802 1 31 GLU HA 1 87 ILE HG12 . . 4.420 3.602 3.130 4.035 . 0 0 "[ . 1 . 2]" 1
803 1 31 GLU HA 1 87 ILE HG13 . . 4.530 3.726 3.181 4.034 . 0 0 "[ . 1 . 2]" 1
804 1 31 GLU HA 1 87 ILE MG . . 4.180 3.789 3.521 3.942 . 0 0 "[ . 1 . 2]" 1
805 1 31 GLU HA 1 88 LYS H . . 4.050 3.451 3.226 3.643 . 0 0 "[ . 1 . 2]" 1
806 1 31 GLU HB2 1 32 PHE H . . 4.480 4.355 4.092 4.496 0.016 17 0 "[ . 1 . 2]" 1
807 1 31 GLU HB2 1 47 TRP HE1 . . 4.700 4.439 4.172 4.699 . 0 0 "[ . 1 . 2]" 1
808 1 31 GLU HB2 1 47 TRP HZ2 . . 4.540 3.125 2.854 3.388 . 0 0 "[ . 1 . 2]" 1
809 1 31 GLU HB2 1 66 ALA HA . . 4.780 4.581 4.395 4.779 . 0 0 "[ . 1 . 2]" 1
810 1 31 GLU HB2 1 66 ALA MB . . 5.100 4.825 4.668 4.965 . 0 0 "[ . 1 . 2]" 1
811 1 31 GLU HB2 1 87 ILE MG . . 4.780 3.307 3.112 3.536 . 0 0 "[ . 1 . 2]" 1
812 1 31 GLU HB3 1 47 TRP HE1 . . 3.920 3.529 3.115 3.844 . 0 0 "[ . 1 . 2]" 1
813 1 31 GLU HB3 1 47 TRP HZ2 . . 4.480 3.370 3.009 3.906 . 0 0 "[ . 1 . 2]" 1
814 1 31 GLU HB3 1 66 ALA HA . . 4.260 3.062 2.828 3.330 . 0 0 "[ . 1 . 2]" 1
815 1 31 GLU HB3 1 66 ALA MB . . 3.920 3.355 3.158 3.506 . 0 0 "[ . 1 . 2]" 1
816 1 31 GLU HB3 1 87 ILE MG . . 5.460 4.771 4.472 5.037 . 0 0 "[ . 1 . 2]" 1
817 1 31 GLU QG 1 32 PHE H . . 3.930 3.386 2.650 3.873 . 0 0 "[ . 1 . 2]" 1
818 1 31 GLU QG 1 33 TYR HA . . 4.910 4.689 4.493 4.923 0.013 3 0 "[ . 1 . 2]" 1
819 1 31 GLU QG 1 33 TYR HB2 . . 5.140 4.792 4.333 5.157 0.017 3 0 "[ . 1 . 2]" 1
820 1 31 GLU QG 1 33 TYR QB . . 4.320 3.336 2.826 3.895 . 0 0 "[ . 1 . 2]" 1
821 1 31 GLU QG 1 33 TYR HB3 . . 5.140 3.409 2.864 4.036 . 0 0 "[ . 1 . 2]" 1
822 1 31 GLU QG 1 43 LEU MD2 . . 3.820 2.291 1.931 2.876 . 0 0 "[ . 1 . 2]" 1
823 1 31 GLU QG 1 85 PRO HB2 . . 4.520 3.369 2.689 4.269 . 0 0 "[ . 1 . 2]" 1
824 1 31 GLU QG 1 86 THR H . . 4.460 3.342 2.759 4.287 . 0 0 "[ . 1 . 2]" 1
825 1 31 GLU QG 1 87 ILE HG12 . . 4.950 2.958 2.285 3.676 . 0 0 "[ . 1 . 2]" 1
826 1 32 PHE H 1 32 PHE HB2 . . 3.670 2.568 2.500 2.638 . 0 0 "[ . 1 . 2]" 1
827 1 32 PHE H 1 32 PHE HB3 . . 3.790 3.620 3.589 3.686 . 0 0 "[ . 1 . 2]" 1
828 1 32 PHE H 1 32 PHE QD . . 3.470 1.964 1.895 2.048 . 0 0 "[ . 1 . 2]" 1
829 1 32 PHE H 1 32 PHE QE . . 4.620 3.979 3.834 4.204 . 0 0 "[ . 1 . 2]" 1
830 1 32 PHE H 1 33 TYR H . . 4.800 4.501 4.402 4.571 . 0 0 "[ . 1 . 2]" 1
831 1 32 PHE H 1 67 VAL HB . . 5.180 4.764 4.558 4.932 . 0 0 "[ . 1 . 2]" 1
832 1 32 PHE H 1 81 ILE MG . . 4.630 4.189 3.965 4.630 . 0 0 "[ . 1 . 2]" 1
833 1 32 PHE H 1 86 THR H . . 3.700 3.094 2.756 3.426 . 0 0 "[ . 1 . 2]" 1
834 1 32 PHE H 1 86 THR HA . . 5.500 4.704 4.488 4.900 . 0 0 "[ . 1 . 2]" 1
835 1 32 PHE H 1 86 THR HB . . 4.370 2.973 2.709 3.279 . 0 0 "[ . 1 . 2]" 1
836 1 32 PHE H 1 86 THR MG . . 5.370 3.910 3.283 4.351 . 0 0 "[ . 1 . 2]" 1
837 1 32 PHE H 1 87 ILE HA . . 3.910 3.722 3.512 3.905 . 0 0 "[ . 1 . 2]" 1
838 1 32 PHE H 1 87 ILE HG12 . . 5.500 5.357 5.084 5.509 0.009 17 0 "[ . 1 . 2]" 1
839 1 32 PHE H 1 88 LYS H . . 4.950 4.625 4.344 4.877 . 0 0 "[ . 1 . 2]" 1
840 1 32 PHE HA 1 32 PHE QD . . 4.100 3.089 3.001 3.162 . 0 0 "[ . 1 . 2]" 1
841 1 32 PHE HA 1 33 TYR H . . 2.810 2.151 2.139 2.180 . 0 0 "[ . 1 . 2]" 1
842 1 32 PHE HA 1 33 TYR QD . . 4.390 4.209 3.942 4.386 . 0 0 "[ . 1 . 2]" 1
843 1 32 PHE HA 1 67 VAL H . . 4.070 2.769 2.569 3.035 . 0 0 "[ . 1 . 2]" 1
844 1 32 PHE HA 1 67 VAL HB . . 3.860 2.985 2.740 3.163 . 0 0 "[ . 1 . 2]" 1
845 1 32 PHE HA 1 67 VAL MG1 . . 4.430 4.052 3.781 4.202 . 0 0 "[ . 1 . 2]" 1
846 1 32 PHE HA 1 69 ALA H . . 4.350 4.004 3.575 4.199 . 0 0 "[ . 1 . 2]" 1
847 1 32 PHE HA 1 69 ALA MB . . 4.390 4.192 3.631 4.384 . 0 0 "[ . 1 . 2]" 1
848 1 32 PHE HB2 1 33 TYR H . . 4.380 4.166 3.994 4.331 . 0 0 "[ . 1 . 2]" 1
849 1 32 PHE HB2 1 69 ALA MB . . 4.090 3.775 2.979 4.022 . 0 0 "[ . 1 . 2]" 1
850 1 32 PHE HB2 1 81 ILE MD . . 4.260 3.721 3.284 3.930 . 0 0 "[ . 1 . 2]" 1
851 1 32 PHE HB2 1 81 ILE MG . . 3.910 2.309 2.032 2.596 . 0 0 "[ . 1 . 2]" 1
852 1 32 PHE HB2 1 86 THR H . . 3.830 3.208 2.950 3.631 . 0 0 "[ . 1 . 2]" 1
853 1 32 PHE HB2 1 86 THR HB . . 3.830 2.041 1.997 2.176 . 0 0 "[ . 1 . 2]" 1
854 1 32 PHE HB2 1 86 THR MG . . 4.330 3.607 3.251 3.802 . 0 0 "[ . 1 . 2]" 1
855 1 32 PHE HB3 1 33 TYR H . . 3.640 3.343 3.127 3.624 . 0 0 "[ . 1 . 2]" 1
856 1 32 PHE HB3 1 69 ALA MB . . 3.450 2.522 1.866 2.745 . 0 0 "[ . 1 . 2]" 1
857 1 32 PHE HB3 1 81 ILE MG . . 3.810 2.577 2.215 3.379 . 0 0 "[ . 1 . 2]" 1
858 1 32 PHE HB3 1 86 THR HB . . 4.160 3.743 3.673 3.858 . 0 0 "[ . 1 . 2]" 1
859 1 32 PHE QD 1 33 TYR H . . 4.580 4.459 4.331 4.592 0.012 3 0 "[ . 1 . 2]" 1
860 1 32 PHE QD 1 67 VAL HB . . 4.000 2.831 2.352 3.158 . 0 0 "[ . 1 . 2]" 1
861 1 32 PHE QD 1 67 VAL MG1 . . 3.710 2.777 2.378 3.062 . 0 0 "[ . 1 . 2]" 1
862 1 32 PHE QD 1 67 VAL MG2 . . 4.360 4.074 3.605 4.368 0.008 17 0 "[ . 1 . 2]" 1
863 1 32 PHE QD 1 69 ALA MB . . 3.470 3.141 2.689 3.440 . 0 0 "[ . 1 . 2]" 1
864 1 32 PHE QD 1 81 ILE MD . . 3.970 2.908 2.619 3.184 . 0 0 "[ . 1 . 2]" 1
865 1 32 PHE QD 1 86 THR H . . 4.420 4.022 3.845 4.326 . 0 0 "[ . 1 . 2]" 1
866 1 32 PHE QD 1 86 THR HB . . 4.390 2.234 1.998 2.882 . 0 0 "[ . 1 . 2]" 1
867 1 32 PHE QD 1 86 THR MG . . 4.050 2.651 2.007 3.256 . 0 0 "[ . 1 . 2]" 1
868 1 32 PHE QD 1 87 ILE HA . . 4.710 4.122 3.784 4.317 . 0 0 "[ . 1 . 2]" 1
869 1 32 PHE QD 1 88 LYS H . . 4.580 4.336 4.193 4.496 . 0 0 "[ . 1 . 2]" 1
870 1 32 PHE QD 1 88 LYS HB2 . . 4.760 4.467 4.086 4.763 0.003 7 0 "[ . 1 . 2]" 1
871 1 32 PHE QD 1 88 LYS QE . . 5.340 4.684 4.372 5.020 . 0 0 "[ . 1 . 2]" 1
872 1 32 PHE QD 1 88 LYS HG2 . . 5.050 3.853 3.659 4.123 . 0 0 "[ . 1 . 2]" 1
873 1 32 PHE QD 1 88 LYS HG3 . . 4.710 3.804 3.473 3.955 . 0 0 "[ . 1 . 2]" 1
874 1 32 PHE QE 1 67 VAL HB . . 4.730 3.438 3.049 3.699 . 0 0 "[ . 1 . 2]" 1
875 1 32 PHE QE 1 67 VAL MG1 . . 3.770 2.789 2.367 3.276 . 0 0 "[ . 1 . 2]" 1
876 1 32 PHE QE 1 67 VAL MG2 . . 4.510 3.620 3.023 4.001 . 0 0 "[ . 1 . 2]" 1
877 1 32 PHE QE 1 75 LEU HB2 . . 4.260 2.728 2.471 3.045 . 0 0 "[ . 1 . 2]" 1
878 1 32 PHE QE 1 75 LEU HB3 . . 4.260 3.307 2.980 3.497 . 0 0 "[ . 1 . 2]" 1
879 1 32 PHE QE 1 76 ALA MB . . 4.910 4.061 3.507 4.851 . 0 0 "[ . 1 . 2]" 1
880 1 32 PHE QE 1 81 ILE MD . . 4.250 2.873 2.528 3.199 . 0 0 "[ . 1 . 2]" 1
881 1 32 PHE QE 1 86 THR MG . . 4.770 3.465 2.876 4.251 . 0 0 "[ . 1 . 2]" 1
882 1 32 PHE QE 1 87 ILE HA . . 5.200 5.008 4.511 5.192 . 0 0 "[ . 1 . 2]" 1
883 1 32 PHE QE 1 88 LYS H . . 4.160 4.084 3.859 4.168 0.008 3 0 "[ . 1 . 2]" 1
884 1 32 PHE QE 1 88 LYS HB2 . . 4.030 2.792 2.567 2.904 . 0 0 "[ . 1 . 2]" 1
885 1 32 PHE QE 1 88 LYS HB3 . . 4.260 4.193 3.984 4.269 0.009 10 0 "[ . 1 . 2]" 1
886 1 32 PHE QE 1 88 LYS QD . . 5.280 4.549 4.324 4.812 . 0 0 "[ . 1 . 2]" 1
887 1 32 PHE QE 1 88 LYS HG2 . . 4.530 3.448 2.998 3.822 . 0 0 "[ . 1 . 2]" 1
888 1 32 PHE QE 1 88 LYS HG3 . . 3.910 2.489 2.205 2.827 . 0 0 "[ . 1 . 2]" 1
889 1 32 PHE HZ 1 90 PHE QE . . 4.470 4.166 3.888 4.472 0.002 5 0 "[ . 1 . 2]" 1
890 1 32 PHE HZ 1 90 PHE HZ . . 4.420 3.776 3.195 4.176 . 0 0 "[ . 1 . 2]" 1
891 1 33 TYR H 1 33 TYR QB . . 3.700 2.921 2.730 3.003 . 0 0 "[ . 1 . 2]" 1
892 1 33 TYR H 1 33 TYR QD . . 3.470 3.117 2.884 3.309 . 0 0 "[ . 1 . 2]" 1
893 1 33 TYR H 1 33 TYR QE . . 4.730 4.563 4.409 4.736 0.006 11 0 "[ . 1 . 2]" 1
894 1 33 TYR H 1 34 ALA H . . 4.590 4.440 4.410 4.491 . 0 0 "[ . 1 . 2]" 1
895 1 33 TYR H 1 34 ALA HA . . 5.010 4.804 4.725 4.957 . 0 0 "[ . 1 . 2]" 1
896 1 33 TYR H 1 66 ALA MB . . 5.040 4.355 4.025 4.779 . 0 0 "[ . 1 . 2]" 1
897 1 33 TYR H 1 67 VAL H . . 3.930 3.475 3.235 3.686 . 0 0 "[ . 1 . 2]" 1
898 1 33 TYR H 1 67 VAL HB . . 4.650 4.513 4.382 4.624 . 0 0 "[ . 1 . 2]" 1
899 1 33 TYR H 1 67 VAL MG1 . . 4.950 4.780 4.467 4.950 0.000 3 0 "[ . 1 . 2]" 1
900 1 33 TYR H 1 67 VAL MG2 . . 5.500 5.469 5.385 5.518 0.018 17 0 "[ . 1 . 2]" 1
901 1 33 TYR H 1 68 ASP HA . . 3.760 3.212 2.807 3.499 . 0 0 "[ . 1 . 2]" 1
902 1 33 TYR H 1 69 ALA H . . 3.520 3.283 2.937 3.517 . 0 0 "[ . 1 . 2]" 1
903 1 33 TYR H 1 69 ALA MB . . 4.070 4.022 3.622 4.075 0.005 9 0 "[ . 1 . 2]" 1
904 1 33 TYR H 1 84 PHE QD . . 5.330 5.265 4.893 5.342 0.012 17 0 "[ . 1 . 2]" 1
905 1 33 TYR H 1 86 THR H . . 5.250 5.111 4.810 5.254 0.004 6 0 "[ . 1 . 2]" 1
906 1 33 TYR HA 1 33 TYR QD . . 4.450 3.645 3.596 3.693 . 0 0 "[ . 1 . 2]" 1
907 1 33 TYR HA 1 34 ALA H . . 3.130 2.443 2.390 2.548 . 0 0 "[ . 1 . 2]" 1
908 1 33 TYR HA 1 34 ALA MB . . 4.690 3.881 3.845 3.918 . 0 0 "[ . 1 . 2]" 1
909 1 33 TYR HA 1 84 PHE HB2 . . 4.730 3.384 3.094 3.734 . 0 0 "[ . 1 . 2]" 1
910 1 33 TYR HA 1 84 PHE QB . . 4.010 2.352 2.126 2.594 . 0 0 "[ . 1 . 2]" 1
911 1 33 TYR HA 1 84 PHE HB3 . . 4.730 2.400 2.163 2.646 . 0 0 "[ . 1 . 2]" 1
912 1 33 TYR HA 1 84 PHE QD . . 4.110 3.918 3.539 4.122 0.012 12 0 "[ . 1 . 2]" 1
913 1 33 TYR HA 1 85 PRO HA . . 4.600 2.891 2.419 3.198 . 0 0 "[ . 1 . 2]" 1
914 1 33 TYR HA 1 86 THR H . . 4.660 4.133 3.797 4.409 . 0 0 "[ . 1 . 2]" 1
915 1 33 TYR QB 1 34 ALA H . . 3.130 2.437 2.213 2.562 . 0 0 "[ . 1 . 2]" 1
916 1 33 TYR QB 1 40 CYS QB . . 4.450 2.068 1.954 3.432 . 0 0 "[ . 1 . 2]" 1
917 1 33 TYR HB2 1 34 ALA H . . 3.940 2.464 2.230 2.595 . 0 0 "[ . 1 . 2]" 1
918 1 33 TYR HB3 1 34 ALA H . . 3.940 3.867 3.709 3.956 0.016 11 0 "[ . 1 . 2]" 1
919 1 33 TYR QD 1 34 ALA H . . 3.580 2.514 2.336 2.769 . 0 0 "[ . 1 . 2]" 1
920 1 33 TYR QD 1 34 ALA HA . . 3.980 3.121 2.958 3.355 . 0 0 "[ . 1 . 2]" 1
921 1 33 TYR QD 1 34 ALA MB . . 4.830 3.881 3.779 4.057 . 0 0 "[ . 1 . 2]" 1
922 1 33 TYR QD 1 35 PRO HA . . 3.950 3.615 3.531 3.708 . 0 0 "[ . 1 . 2]" 1
923 1 33 TYR QD 1 35 PRO HB3 . . 4.920 4.692 4.463 4.858 . 0 0 "[ . 1 . 2]" 1
924 1 33 TYR QD 1 35 PRO QD . . 4.910 3.482 3.258 3.719 . 0 0 "[ . 1 . 2]" 1
925 1 33 TYR QD 1 40 CYS QB . . 5.080 3.216 2.915 4.333 . 0 0 "[ . 1 . 2]" 1
926 1 33 TYR QD 1 66 ALA HA . . 4.530 4.069 3.887 4.204 . 0 0 "[ . 1 . 2]" 1
927 1 33 TYR QD 1 66 ALA MB . . 3.520 2.192 1.977 2.451 . 0 0 "[ . 1 . 2]" 1
928 1 33 TYR QD 1 67 VAL H . . 3.740 3.389 3.082 3.705 . 0 0 "[ . 1 . 2]" 1
929 1 33 TYR QD 1 68 ASP HA . . 4.560 4.350 4.191 4.507 . 0 0 "[ . 1 . 2]" 1
930 1 33 TYR QD 1 68 ASP QB . . 5.340 5.069 4.633 5.342 0.002 15 0 "[ . 1 . 2]" 1
931 1 33 TYR QD 1 69 ALA H . . 5.500 5.270 5.052 5.408 . 0 0 "[ . 1 . 2]" 1
932 1 33 TYR QE 1 35 PRO HA . . 3.900 3.055 2.713 3.537 . 0 0 "[ . 1 . 2]" 1
933 1 33 TYR QE 1 35 PRO HB2 . . 4.810 4.707 4.464 4.819 0.009 11 0 "[ . 1 . 2]" 1
934 1 33 TYR QE 1 35 PRO HB3 . . 4.430 3.129 2.897 3.258 . 0 0 "[ . 1 . 2]" 1
935 1 33 TYR QE 1 35 PRO QD . . 4.760 3.181 2.956 3.386 . 0 0 "[ . 1 . 2]" 1
936 1 33 TYR QE 1 35 PRO HG2 . . 5.480 5.302 5.086 5.463 . 0 0 "[ . 1 . 2]" 1
937 1 33 TYR QE 1 35 PRO HG3 . . 4.600 4.458 4.170 4.621 0.021 17 0 "[ . 1 . 2]" 1
938 1 33 TYR QE 1 66 ALA H . . 5.500 5.340 5.093 5.505 0.005 11 0 "[ . 1 . 2]" 1
939 1 33 TYR QE 1 66 ALA HA . . 4.960 4.675 4.408 4.955 . 0 0 "[ . 1 . 2]" 1
940 1 33 TYR QE 1 66 ALA MB . . 2.970 2.199 1.946 2.496 . 0 0 "[ . 1 . 2]" 1
941 1 33 TYR QE 1 67 VAL H . . 4.270 4.076 3.721 4.258 . 0 0 "[ . 1 . 2]" 1
942 1 33 TYR QE 1 68 ASP H . . 5.500 5.186 4.507 5.497 . 0 0 "[ . 1 . 2]" 1
943 1 33 TYR QE 1 68 ASP HA . . 4.610 4.424 4.113 4.611 0.001 17 0 "[ . 1 . 2]" 1
944 1 33 TYR QE 1 68 ASP QB . . 4.800 4.349 3.739 4.712 . 0 0 "[ . 1 . 2]" 1
945 1 34 ALA H 1 34 ALA MB . . 3.330 2.406 2.378 2.504 . 0 0 "[ . 1 . 2]" 1
946 1 34 ALA H 1 35 PRO QD . . 4.810 4.259 4.215 4.300 . 0 0 "[ . 1 . 2]" 1
947 1 34 ALA H 1 37 CYS H . . 4.780 4.310 4.067 4.584 . 0 0 "[ . 1 . 2]" 1
948 1 34 ALA H 1 37 CYS HB3 . . 4.560 3.069 2.809 3.357 . 0 0 "[ . 1 . 2]" 1
949 1 34 ALA H 1 40 CYS HB2 . . 4.150 2.582 1.949 3.475 . 0 0 "[ . 1 . 2]" 1
950 1 34 ALA H 1 40 CYS QB . . 3.460 2.403 1.925 2.814 . 0 0 "[ . 1 . 2]" 1
951 1 34 ALA H 1 40 CYS HB3 . . 4.150 3.022 2.605 3.342 . 0 0 "[ . 1 . 2]" 1
952 1 34 ALA H 1 41 LYS H . . 5.500 5.494 5.341 5.532 0.032 10 0 "[ . 1 . 2]" 1
953 1 34 ALA H 1 70 THR MG . . 5.500 5.222 4.837 5.486 . 0 0 "[ . 1 . 2]" 1
954 1 34 ALA H 1 84 PHE QB . . 4.300 3.387 3.155 3.580 . 0 0 "[ . 1 . 2]" 1
955 1 34 ALA H 1 84 PHE QD . . 4.380 3.696 3.112 4.234 . 0 0 "[ . 1 . 2]" 1
956 1 34 ALA H 1 85 PRO HA . . 5.280 4.724 4.375 4.988 . 0 0 "[ . 1 . 2]" 1
957 1 34 ALA HA 1 35 PRO HD2 . . 3.330 2.130 2.075 2.190 . 0 0 "[ . 1 . 2]" 1
958 1 34 ALA HA 1 35 PRO HD3 . . 3.330 2.258 2.253 2.269 . 0 0 "[ . 1 . 2]" 1
959 1 34 ALA HA 1 36 TRP H . . 4.120 3.688 3.611 3.798 . 0 0 "[ . 1 . 2]" 1
960 1 34 ALA HA 1 36 TRP HH2 . . 5.500 5.469 5.403 5.509 0.009 17 0 "[ . 1 . 2]" 1
961 1 34 ALA HA 1 68 ASP HA . . 4.710 4.127 3.795 4.374 . 0 0 "[ . 1 . 2]" 1
962 1 34 ALA HA 1 68 ASP QB . . 4.730 4.573 4.026 4.735 0.005 11 0 "[ . 1 . 2]" 1
963 1 34 ALA HA 1 69 ALA H . . 4.620 4.273 3.985 4.558 . 0 0 "[ . 1 . 2]" 1
964 1 34 ALA HA 1 70 THR MG . . 3.600 2.832 2.402 3.151 . 0 0 "[ . 1 . 2]" 1
965 1 34 ALA MB 1 35 PRO HD2 . . 3.960 2.647 2.474 2.784 . 0 0 "[ . 1 . 2]" 1
966 1 34 ALA MB 1 35 PRO QD . . 3.460 2.588 2.433 2.711 . 0 0 "[ . 1 . 2]" 1
967 1 34 ALA MB 1 35 PRO HD3 . . 3.960 3.654 3.571 3.735 . 0 0 "[ . 1 . 2]" 1
968 1 34 ALA MB 1 36 TRP H . . 3.620 2.347 2.224 2.510 . 0 0 "[ . 1 . 2]" 1
969 1 34 ALA MB 1 36 TRP HD1 . . 4.690 4.568 4.201 4.696 0.006 10 0 "[ . 1 . 2]" 1
970 1 34 ALA MB 1 36 TRP HE1 . . 4.190 3.942 3.504 4.114 . 0 0 "[ . 1 . 2]" 1
971 1 34 ALA MB 1 36 TRP HE3 . . 4.870 3.071 3.016 3.153 . 0 0 "[ . 1 . 2]" 1
972 1 34 ALA MB 1 36 TRP HH2 . . 4.770 3.020 2.875 3.158 . 0 0 "[ . 1 . 2]" 1
973 1 34 ALA MB 1 36 TRP HZ2 . . 4.120 3.170 2.763 3.379 . 0 0 "[ . 1 . 2]" 1
974 1 34 ALA MB 1 37 CYS H . . 3.690 2.788 2.284 3.171 . 0 0 "[ . 1 . 2]" 1
975 1 34 ALA MB 1 37 CYS HB2 . . 3.990 2.011 1.889 2.200 . 0 0 "[ . 1 . 2]" 1
976 1 34 ALA MB 1 37 CYS HB3 . . 3.880 2.329 2.015 3.006 . 0 0 "[ . 1 . 2]" 1
977 1 34 ALA MB 1 69 ALA MB . . 4.810 3.843 3.574 4.304 . 0 0 "[ . 1 . 2]" 1
978 1 34 ALA MB 1 70 THR H . . 5.000 4.626 4.164 4.917 . 0 0 "[ . 1 . 2]" 1
979 1 34 ALA MB 1 70 THR MG . . 3.060 2.833 2.488 3.030 . 0 0 "[ . 1 . 2]" 1
980 1 34 ALA MB 1 84 PHE QB . . 4.520 3.133 2.746 3.421 . 0 0 "[ . 1 . 2]" 1
981 1 34 ALA MB 1 84 PHE QD . . 4.030 1.994 1.818 2.325 . 0 0 "[ . 1 . 2]" 1
982 1 34 ALA MB 1 84 PHE QE . . 3.950 2.666 2.236 3.082 . 0 0 "[ . 1 . 2]" 1
983 1 34 ALA MB 1 84 PHE HZ . . 4.770 4.685 4.404 4.777 0.007 9 0 "[ . 1 . 2]" 1
984 1 35 PRO HB2 1 36 TRP H . . 4.290 3.783 3.604 3.900 . 0 0 "[ . 1 . 2]" 1
985 1 35 PRO HB3 1 36 TRP H . . 4.460 4.401 4.297 4.468 0.008 1 0 "[ . 1 . 2]" 1
986 1 35 PRO QD 1 36 TRP H . . 3.490 2.775 2.660 2.874 . 0 0 "[ . 1 . 2]" 1
987 1 35 PRO QD 1 36 TRP HE1 . . 4.620 3.351 3.101 3.457 . 0 0 "[ . 1 . 2]" 1
988 1 35 PRO HD2 1 70 THR MG . . 3.660 1.952 1.774 2.113 . 0 0 "[ . 1 . 2]" 1
989 1 35 PRO HD3 1 70 THR MG . . 3.660 2.863 2.443 3.192 . 0 0 "[ . 1 . 2]" 1
990 1 35 PRO HG2 1 36 TRP H . . 3.590 3.024 2.738 3.226 . 0 0 "[ . 1 . 2]" 1
991 1 35 PRO HG2 1 36 TRP HD1 . . 4.070 2.640 2.461 2.780 . 0 0 "[ . 1 . 2]" 1
992 1 35 PRO HG2 1 36 TRP HE1 . . 5.130 3.592 3.335 3.816 . 0 0 "[ . 1 . 2]" 1
993 1 35 PRO HG2 1 70 THR MG . . 3.940 2.910 2.410 3.290 . 0 0 "[ . 1 . 2]" 1
994 1 35 PRO HG3 1 36 TRP H . . 4.550 4.372 4.155 4.524 . 0 0 "[ . 1 . 2]" 1
995 1 35 PRO HG3 1 36 TRP HD1 . . 4.670 4.245 4.098 4.336 . 0 0 "[ . 1 . 2]" 1
996 1 35 PRO HG3 1 70 THR MG . . 4.920 3.165 2.689 3.506 . 0 0 "[ . 1 . 2]" 1
997 1 36 TRP H 1 36 TRP QB . . 3.230 3.092 2.999 3.144 . 0 0 "[ . 1 . 2]" 1
998 1 36 TRP H 1 36 TRP HD1 . . 3.730 3.625 3.465 3.753 0.023 17 0 "[ . 1 . 2]" 1
999 1 36 TRP H 1 36 TRP HE1 . . 4.800 4.442 4.318 4.545 . 0 0 "[ . 1 . 2]" 1
1000 1 36 TRP H 1 36 TRP HE3 . . 4.720 3.569 3.513 3.656 . 0 0 "[ . 1 . 2]" 1
1001 1 36 TRP H 1 37 CYS H . . 3.250 2.239 1.944 2.440 . 0 0 "[ . 1 . 2]" 1
1002 1 36 TRP H 1 37 CYS HB2 . . 4.600 3.956 3.808 4.282 . 0 0 "[ . 1 . 2]" 1
1003 1 36 TRP H 1 70 THR MG . . 4.530 3.980 3.710 4.247 . 0 0 "[ . 1 . 2]" 1
1004 1 36 TRP HA 1 36 TRP HD1 . . 4.470 4.421 4.318 4.462 . 0 0 "[ . 1 . 2]" 1
1005 1 36 TRP HA 1 36 TRP HE3 . . 4.960 4.187 4.141 4.309 . 0 0 "[ . 1 . 2]" 1
1006 1 36 TRP QB 1 36 TRP HD1 . . 3.320 2.513 2.508 2.530 . 0 0 "[ . 1 . 2]" 1
1007 1 36 TRP QB 1 36 TRP HE1 . . 4.520 4.397 4.394 4.406 . 0 0 "[ . 1 . 2]" 1
1008 1 36 TRP QB 1 36 TRP HE3 . . 3.700 2.804 2.733 2.830 . 0 0 "[ . 1 . 2]" 1
1009 1 36 TRP HD1 1 70 THR MG . . 4.430 3.471 3.193 4.211 . 0 0 "[ . 1 . 2]" 1
1010 1 36 TRP HE1 1 70 THR HB . . 4.070 3.189 2.960 3.629 . 0 0 "[ . 1 . 2]" 1
1011 1 36 TRP HE1 1 70 THR MG . . 3.370 1.889 1.729 2.650 . 0 0 "[ . 1 . 2]" 1
1012 1 36 TRP HE1 1 84 PHE QE . . 5.500 5.419 5.087 5.505 0.005 5 0 "[ . 1 . 2]" 1
1013 1 36 TRP HE3 1 37 CYS H . . 4.080 3.402 3.064 3.861 . 0 0 "[ . 1 . 2]" 1
1014 1 36 TRP HE3 1 37 CYS HA . . 3.810 2.813 2.445 3.232 . 0 0 "[ . 1 . 2]" 1
1015 1 36 TRP HE3 1 37 CYS HB2 . . 5.010 2.690 2.466 3.000 . 0 0 "[ . 1 . 2]" 1
1016 1 36 TRP HE3 1 37 CYS HB3 . . 4.540 4.170 3.962 4.472 . 0 0 "[ . 1 . 2]" 1
1017 1 36 TRP HH2 1 70 THR MG . . 4.490 4.095 3.894 4.363 . 0 0 "[ . 1 . 2]" 1
1018 1 36 TRP HH2 1 84 PHE QD . . 4.280 3.260 2.837 3.616 . 0 0 "[ . 1 . 2]" 1
1019 1 36 TRP HH2 1 84 PHE QE . . 4.120 2.269 2.000 2.633 . 0 0 "[ . 1 . 2]" 1
1020 1 36 TRP HZ2 1 70 THR HA . . 5.240 4.094 3.619 4.265 . 0 0 "[ . 1 . 2]" 1
1021 1 36 TRP HZ2 1 70 THR MG . . 3.970 2.195 1.953 3.007 . 0 0 "[ . 1 . 2]" 1
1022 1 36 TRP HZ2 1 84 PHE QE . . 3.890 2.914 2.602 3.088 . 0 0 "[ . 1 . 2]" 1
1023 1 36 TRP HZ2 1 84 PHE HZ . . 4.780 4.660 4.286 4.772 . 0 0 "[ . 1 . 2]" 1
1024 1 36 TRP HZ3 1 37 CYS HB3 . . 4.930 4.344 4.045 4.810 . 0 0 "[ . 1 . 2]" 1
1025 1 36 TRP HZ3 1 70 THR MG . . 5.500 5.323 5.150 5.512 0.012 17 0 "[ . 1 . 2]" 1
1026 1 37 CYS H 1 37 CYS HB2 . . 3.180 2.857 2.481 2.989 . 0 0 "[ . 1 . 2]" 1
1027 1 37 CYS H 1 37 CYS HB3 . . 3.300 2.670 2.351 2.900 . 0 0 "[ . 1 . 2]" 1
1028 1 37 CYS H 1 40 CYS H . . 5.040 4.881 4.606 5.037 . 0 0 "[ . 1 . 2]" 1
1029 1 37 CYS H 1 40 CYS QB . . 4.090 3.657 3.291 4.091 0.001 2 0 "[ . 1 . 2]" 1
1030 1 37 CYS H 1 41 LYS H . . 4.980 4.792 4.586 4.985 0.005 17 0 "[ . 1 . 2]" 1
1031 1 37 CYS HB2 1 40 CYS QB . . 4.650 4.048 3.523 4.318 . 0 0 "[ . 1 . 2]" 1
1032 1 37 CYS HB3 1 40 CYS H . . 4.850 3.135 2.845 3.397 . 0 0 "[ . 1 . 2]" 1
1033 1 37 CYS HB3 1 40 CYS QB . . 4.370 2.491 2.026 2.787 . 0 0 "[ . 1 . 2]" 1
1034 1 37 CYS HB3 1 41 LYS H . . 4.720 4.401 3.694 4.684 . 0 0 "[ . 1 . 2]" 1
1035 1 38 GLY HA2 1 40 CYS H . . 4.730 4.004 3.574 4.442 . 0 0 "[ . 1 . 2]" 1
1036 1 38 GLY HA2 1 41 LYS H . . 3.740 3.246 2.988 3.453 . 0 0 "[ . 1 . 2]" 1
1037 1 38 GLY HA2 1 41 LYS QB . . 3.670 2.621 2.286 2.880 . 0 0 "[ . 1 . 2]" 1
1038 1 38 GLY HA2 1 41 LYS QD . . 4.510 3.078 2.113 4.518 0.008 3 0 "[ . 1 . 2]" 1
1039 1 38 GLY HA2 1 41 LYS QE . . 4.640 4.047 1.849 4.645 0.005 4 0 "[ . 1 . 2]" 1
1040 1 38 GLY HA2 1 41 LYS HG2 . . 4.820 3.484 2.277 4.829 0.009 10 0 "[ . 1 . 2]" 1
1041 1 38 GLY HA2 1 41 LYS HG3 . . 4.820 3.630 2.459 4.827 0.007 20 0 "[ . 1 . 2]" 1
1042 1 38 GLY HA2 1 42 ASN H . . 4.680 4.302 3.959 4.582 . 0 0 "[ . 1 . 2]" 1
1043 1 38 GLY HA3 1 41 LYS H . . 4.940 4.552 4.279 4.735 . 0 0 "[ . 1 . 2]" 1
1044 1 38 GLY HA3 1 41 LYS QB . . 4.260 4.086 3.761 4.276 0.016 6 0 "[ . 1 . 2]" 1
1045 1 39 HIS H 1 39 HIS HB2 . . 3.820 2.496 2.180 2.902 . 0 0 "[ . 1 . 2]" 1
1046 1 39 HIS H 1 39 HIS QB . . 3.260 2.444 2.136 2.777 . 0 0 "[ . 1 . 2]" 1
1047 1 39 HIS H 1 39 HIS HB3 . . 3.820 3.539 3.056 3.627 . 0 0 "[ . 1 . 2]" 1
1048 1 39 HIS H 1 39 HIS HD2 . . 4.320 3.006 1.942 4.321 0.001 15 0 "[ . 1 . 2]" 1
1049 1 39 HIS H 1 40 CYS H . . 3.430 2.923 2.530 3.133 . 0 0 "[ . 1 . 2]" 1
1050 1 39 HIS H 1 41 LYS H . . 4.780 4.558 4.156 4.768 . 0 0 "[ . 1 . 2]" 1
1051 1 39 HIS H 1 41 LYS QB . . 5.500 5.201 4.809 5.514 0.014 6 0 "[ . 1 . 2]" 1
1052 1 39 HIS HA 1 42 ASN H . . 4.440 3.918 3.625 4.216 . 0 0 "[ . 1 . 2]" 1
1053 1 39 HIS HA 1 42 ASN QB . . 4.210 3.373 2.828 4.217 0.007 11 0 "[ . 1 . 2]" 1
1054 1 39 HIS HA 1 42 ASN QD . . 4.410 3.408 1.818 4.280 . 0 0 "[ . 1 . 2]" 1
1055 1 39 HIS QB 1 40 CYS H . . 3.480 2.713 2.340 3.068 . 0 0 "[ . 1 . 2]" 1
1056 1 39 HIS QB 1 85 PRO QD . . 3.570 2.169 1.851 3.197 . 0 0 "[ . 1 . 2]" 1
1057 1 39 HIS HB2 1 40 CYS H . . 4.150 2.890 2.393 3.764 . 0 0 "[ . 1 . 2]" 1
1058 1 39 HIS HB3 1 40 CYS H . . 4.150 3.562 2.698 4.112 . 0 0 "[ . 1 . 2]" 1
1059 1 40 CYS H 1 40 CYS HB2 . . 3.930 2.717 2.284 3.126 . 0 0 "[ . 1 . 2]" 1
1060 1 40 CYS H 1 40 CYS HB3 . . 3.930 2.680 2.202 3.644 . 0 0 "[ . 1 . 2]" 1
1061 1 40 CYS H 1 41 LYS H . . 3.590 2.611 2.235 2.927 . 0 0 "[ . 1 . 2]" 1
1062 1 40 CYS H 1 41 LYS QB . . 4.810 4.405 4.017 4.710 . 0 0 "[ . 1 . 2]" 1
1063 1 40 CYS H 1 42 ASN H . . 4.710 4.007 3.710 4.338 . 0 0 "[ . 1 . 2]" 1
1064 1 40 CYS H 1 43 LEU HB3 . . 5.440 4.985 4.637 5.445 0.005 12 0 "[ . 1 . 2]" 1
1065 1 40 CYS HA 1 43 LEU H . . 3.720 3.106 2.887 3.340 . 0 0 "[ . 1 . 2]" 1
1066 1 40 CYS HA 1 43 LEU HB2 . . 4.230 3.544 3.232 3.919 . 0 0 "[ . 1 . 2]" 1
1067 1 40 CYS HA 1 43 LEU HB3 . . 3.720 2.348 2.080 2.776 . 0 0 "[ . 1 . 2]" 1
1068 1 40 CYS HA 1 43 LEU MD2 . . 4.420 3.085 2.553 3.507 . 0 0 "[ . 1 . 2]" 1
1069 1 40 CYS HA 1 85 PRO HB3 . . 4.560 3.525 2.884 3.871 . 0 0 "[ . 1 . 2]" 1
1070 1 40 CYS HA 1 85 PRO QD . . 4.600 3.753 2.570 4.507 . 0 0 "[ . 1 . 2]" 1
1071 1 40 CYS HA 1 85 PRO QG . . 4.820 3.787 2.989 4.508 . 0 0 "[ . 1 . 2]" 1
1072 1 40 CYS QB 1 41 LYS H . . 3.430 2.500 2.380 2.628 . 0 0 "[ . 1 . 2]" 1
1073 1 40 CYS QB 1 41 LYS QB . . 5.080 4.350 3.927 4.696 . 0 0 "[ . 1 . 2]" 1
1074 1 40 CYS QB 1 43 LEU HB3 . . 5.340 4.103 3.859 4.488 . 0 0 "[ . 1 . 2]" 1
1075 1 40 CYS HB2 1 41 LYS H . . 4.010 3.479 2.433 3.987 . 0 0 "[ . 1 . 2]" 1
1076 1 40 CYS HB3 1 41 LYS H . . 4.010 2.803 2.441 3.615 . 0 0 "[ . 1 . 2]" 1
1077 1 41 LYS H 1 41 LYS QB . . 2.890 2.327 2.142 2.605 . 0 0 "[ . 1 . 2]" 1
1078 1 41 LYS H 1 41 LYS QD . . 4.510 3.714 1.892 4.570 0.060 6 0 "[ . 1 . 2]" 1
1079 1 41 LYS H 1 41 LYS QE . . 5.500 4.402 2.684 5.149 . 0 0 "[ . 1 . 2]" 1
1080 1 41 LYS H 1 41 LYS QG . . 3.310 2.567 1.899 3.329 0.019 8 0 "[ . 1 . 2]" 1
1081 1 41 LYS H 1 42 ASN H . . 3.340 2.866 2.765 2.970 . 0 0 "[ . 1 . 2]" 1
1082 1 41 LYS H 1 42 ASN QB . . 5.340 4.793 4.547 5.151 . 0 0 "[ . 1 . 2]" 1
1083 1 41 LYS H 1 43 LEU H . . 4.670 4.079 3.881 4.215 . 0 0 "[ . 1 . 2]" 1
1084 1 41 LYS HA 1 41 LYS QE . . 4.230 4.050 3.533 4.244 0.014 8 0 "[ . 1 . 2]" 1
1085 1 41 LYS HA 1 41 LYS HG2 . . 3.870 3.176 2.537 3.886 0.016 6 0 "[ . 1 . 2]" 1
1086 1 41 LYS HA 1 41 LYS QG . . 3.330 2.744 2.164 3.277 . 0 0 "[ . 1 . 2]" 1
1087 1 41 LYS HA 1 41 LYS HG3 . . 3.870 3.218 2.185 3.825 . 0 0 "[ . 1 . 2]" 1
1088 1 41 LYS HA 1 43 LEU H . . 4.840 4.187 3.807 4.414 . 0 0 "[ . 1 . 2]" 1
1089 1 41 LYS HA 1 44 GLU H . . 4.000 3.475 3.197 3.713 . 0 0 "[ . 1 . 2]" 1
1090 1 41 LYS HA 1 44 GLU HB2 . . 3.960 3.270 3.034 3.493 . 0 0 "[ . 1 . 2]" 1
1091 1 41 LYS HA 1 44 GLU HB3 . . 3.700 3.188 2.891 3.418 . 0 0 "[ . 1 . 2]" 1
1092 1 41 LYS QB 1 41 LYS QD . . 3.360 2.241 2.142 2.404 . 0 0 "[ . 1 . 2]" 1
1093 1 41 LYS QB 1 41 LYS QE . . 4.340 2.534 1.896 3.722 . 0 0 "[ . 1 . 2]" 1
1094 1 41 LYS QB 1 42 ASN H . . 3.480 2.918 2.477 3.485 0.005 5 0 "[ . 1 . 2]" 1
1095 1 41 LYS QB 1 42 ASN HA . . 4.910 4.156 3.813 4.666 . 0 0 "[ . 1 . 2]" 1
1096 1 41 LYS QD 1 41 LYS QG . . 2.350 2.035 1.998 2.082 . 0 0 "[ . 1 . 2]" 1
1097 1 41 LYS QD 1 42 ASN H . . 5.340 4.628 4.091 5.149 . 0 0 "[ . 1 . 2]" 1
1098 1 41 LYS QG 1 42 ASN H . . 4.570 3.544 2.162 4.489 . 0 0 "[ . 1 . 2]" 1
1099 1 42 ASN H 1 42 ASN HB2 . . 3.710 2.706 2.241 3.604 . 0 0 "[ . 1 . 2]" 1
1100 1 42 ASN H 1 42 ASN QB . . 2.890 2.292 2.169 2.586 . 0 0 "[ . 1 . 2]" 1
1101 1 42 ASN H 1 42 ASN HB3 . . 3.710 3.070 2.218 3.639 . 0 0 "[ . 1 . 2]" 1
1102 1 42 ASN H 1 42 ASN QD . . 4.890 3.643 2.078 4.325 . 0 0 "[ . 1 . 2]" 1
1103 1 42 ASN H 1 43 LEU H . . 3.210 2.438 2.288 2.574 . 0 0 "[ . 1 . 2]" 1
1104 1 42 ASN H 1 43 LEU HB2 . . 5.500 5.006 4.754 5.296 . 0 0 "[ . 1 . 2]" 1
1105 1 42 ASN HA 1 44 GLU H . . 4.560 4.032 3.824 4.321 . 0 0 "[ . 1 . 2]" 1
1106 1 42 ASN HA 1 45 PRO HD2 . . 3.970 3.405 3.194 3.558 . 0 0 "[ . 1 . 2]" 1
1107 1 42 ASN HA 1 45 PRO HD3 . . 4.500 4.129 3.953 4.336 . 0 0 "[ . 1 . 2]" 1
1108 1 42 ASN HA 1 45 PRO HG2 . . 4.380 4.108 3.765 4.350 . 0 0 "[ . 1 . 2]" 1
1109 1 42 ASN HA 1 45 PRO QG . . 3.760 3.589 3.322 3.770 0.010 13 0 "[ . 1 . 2]" 1
1110 1 42 ASN HA 1 45 PRO HG3 . . 4.380 3.960 3.695 4.159 . 0 0 "[ . 1 . 2]" 1
1111 1 42 ASN QB 1 42 ASN QD . . 3.080 2.165 2.064 2.373 . 0 0 "[ . 1 . 2]" 1
1112 1 42 ASN QB 1 43 LEU H . . 3.610 3.042 2.802 3.550 . 0 0 "[ . 1 . 2]" 1
1113 1 42 ASN QB 1 43 LEU HB2 . . 5.340 4.474 4.063 5.263 . 0 0 "[ . 1 . 2]" 1
1114 1 42 ASN QB 1 44 GLU H . . 5.340 4.711 4.510 4.961 . 0 0 "[ . 1 . 2]" 1
1115 1 42 ASN HB2 1 43 LEU H . . 4.350 3.481 2.861 4.268 . 0 0 "[ . 1 . 2]" 1
1116 1 42 ASN HB3 1 43 LEU H . . 4.350 3.651 2.916 4.012 . 0 0 "[ . 1 . 2]" 1
1117 1 43 LEU H 1 43 LEU HB2 . . 3.100 2.844 2.679 3.078 . 0 0 "[ . 1 . 2]" 1
1118 1 43 LEU H 1 43 LEU HB3 . . 3.160 2.322 2.195 2.445 . 0 0 "[ . 1 . 2]" 1
1119 1 43 LEU H 1 43 LEU MD1 . . 4.530 4.286 4.110 4.420 . 0 0 "[ . 1 . 2]" 1
1120 1 43 LEU H 1 43 LEU MD2 . . 4.230 4.146 3.963 4.255 0.025 19 0 "[ . 1 . 2]" 1
1121 1 43 LEU H 1 43 LEU HG . . 5.080 4.300 4.075 4.439 . 0 0 "[ . 1 . 2]" 1
1122 1 43 LEU H 1 44 GLU H . . 3.580 2.341 2.185 2.417 . 0 0 "[ . 1 . 2]" 1
1123 1 43 LEU H 1 44 GLU HB2 . . 5.080 5.024 4.881 5.098 0.018 13 0 "[ . 1 . 2]" 1
1124 1 43 LEU H 1 44 GLU HB3 . . 4.620 4.322 4.127 4.433 . 0 0 "[ . 1 . 2]" 1
1125 1 43 LEU HA 1 43 LEU MD1 . . 3.100 2.350 2.034 2.594 . 0 0 "[ . 1 . 2]" 1
1126 1 43 LEU HA 1 43 LEU MD2 . . 4.290 3.974 3.881 4.030 . 0 0 "[ . 1 . 2]" 1
1127 1 43 LEU HA 1 45 PRO HD2 . . 4.840 3.463 3.217 3.677 . 0 0 "[ . 1 . 2]" 1
1128 1 43 LEU HA 1 46 GLU H . . 4.240 3.076 2.977 3.161 . 0 0 "[ . 1 . 2]" 1
1129 1 43 LEU HA 1 46 GLU HB2 . . 4.530 2.070 1.982 2.193 . 0 0 "[ . 1 . 2]" 1
1130 1 43 LEU HA 1 46 GLU HB3 . . 4.910 3.670 3.583 3.807 . 0 0 "[ . 1 . 2]" 1
1131 1 43 LEU HA 1 46 GLU HG2 . . 4.550 3.241 2.513 4.400 . 0 0 "[ . 1 . 2]" 1
1132 1 43 LEU HA 1 46 GLU HG3 . . 4.550 3.535 2.576 4.563 0.013 18 0 "[ . 1 . 2]" 1
1133 1 43 LEU HA 1 47 TRP H . . 4.650 3.936 3.720 4.093 . 0 0 "[ . 1 . 2]" 1
1134 1 43 LEU HB2 1 43 LEU MD1 . . 3.210 2.237 2.133 2.318 . 0 0 "[ . 1 . 2]" 1
1135 1 43 LEU HB2 1 44 GLU H . . 4.550 4.219 4.117 4.332 . 0 0 "[ . 1 . 2]" 1
1136 1 43 LEU HB2 1 47 TRP HB2 . . 5.500 5.170 5.048 5.347 . 0 0 "[ . 1 . 2]" 1
1137 1 43 LEU HB3 1 43 LEU MD1 . . 3.600 3.169 3.144 3.182 . 0 0 "[ . 1 . 2]" 1
1138 1 43 LEU HB3 1 43 LEU MD2 . . 3.390 2.215 2.006 2.376 . 0 0 "[ . 1 . 2]" 1
1139 1 43 LEU HB3 1 44 GLU H . . 3.770 3.118 2.949 3.272 . 0 0 "[ . 1 . 2]" 1
1140 1 43 LEU MD1 1 44 GLU H . . 4.770 4.668 4.473 4.775 0.005 11 0 "[ . 1 . 2]" 1
1141 1 43 LEU MD1 1 46 GLU H . . 4.180 3.933 3.534 4.128 . 0 0 "[ . 1 . 2]" 1
1142 1 43 LEU MD1 1 46 GLU HA . . 4.940 4.430 4.062 4.661 . 0 0 "[ . 1 . 2]" 1
1143 1 43 LEU MD1 1 46 GLU HB2 . . 3.490 2.072 1.975 2.361 . 0 0 "[ . 1 . 2]" 1
1144 1 43 LEU MD1 1 46 GLU HB3 . . 4.130 2.718 2.465 3.018 . 0 0 "[ . 1 . 2]" 1
1145 1 43 LEU MD1 1 46 GLU HG2 . . 4.810 3.885 3.233 4.450 . 0 0 "[ . 1 . 2]" 1
1146 1 43 LEU MD1 1 46 GLU QG . . 4.150 3.385 2.939 3.847 . 0 0 "[ . 1 . 2]" 1
1147 1 43 LEU MD1 1 46 GLU HG3 . . 4.810 3.860 3.057 4.432 . 0 0 "[ . 1 . 2]" 1
1148 1 43 LEU MD1 1 47 TRP H . . 3.620 3.193 2.618 3.597 . 0 0 "[ . 1 . 2]" 1
1149 1 43 LEU MD1 1 47 TRP HA . . 3.970 3.522 3.158 3.777 . 0 0 "[ . 1 . 2]" 1
1150 1 43 LEU MD1 1 47 TRP HB2 . . 3.820 2.659 2.229 3.011 . 0 0 "[ . 1 . 2]" 1
1151 1 43 LEU MD1 1 47 TRP HB3 . . 4.470 4.091 3.567 4.413 . 0 0 "[ . 1 . 2]" 1
1152 1 43 LEU MD1 1 47 TRP HE3 . . 3.500 2.566 2.189 2.841 . 0 0 "[ . 1 . 2]" 1
1153 1 43 LEU MD1 1 47 TRP HZ3 . . 4.490 4.159 3.890 4.346 . 0 0 "[ . 1 . 2]" 1
1154 1 43 LEU MD1 1 103 ARG HA . . 4.030 3.250 2.384 3.601 . 0 0 "[ . 1 . 2]" 1
1155 1 43 LEU MD1 1 103 ARG HB2 . . 4.510 3.509 1.956 4.454 . 0 0 "[ . 1 . 2]" 1
1156 1 43 LEU MD1 1 103 ARG QB . . 3.720 2.770 1.943 3.732 0.012 11 0 "[ . 1 . 2]" 1
1157 1 43 LEU MD1 1 103 ARG HB3 . . 4.510 3.310 1.965 4.125 . 0 0 "[ . 1 . 2]" 1
1158 1 43 LEU MD1 1 103 ARG HD2 . . 4.490 3.517 2.514 4.498 0.008 12 0 "[ . 1 . 2]" 1
1159 1 43 LEU MD1 1 103 ARG QD . . 3.760 3.125 2.211 3.763 0.003 7 0 "[ . 1 . 2]" 1
1160 1 43 LEU MD1 1 103 ARG HD3 . . 4.490 3.814 2.285 4.448 . 0 0 "[ . 1 . 2]" 1
1161 1 43 LEU MD1 1 103 ARG QG . . 3.750 2.588 1.761 3.684 . 0 0 "[ . 1 . 2]" 1
1162 1 43 LEU MD1 1 104 THR H . . 5.040 4.533 3.996 4.909 . 0 0 "[ . 1 . 2]" 1
1163 1 43 LEU MD1 1 105 ARG H . . 4.830 4.434 4.026 4.791 . 0 0 "[ . 1 . 2]" 1
1164 1 43 LEU MD1 1 108 ILE MD . . 3.150 2.303 1.934 2.562 . 0 0 "[ . 1 . 2]" 1
1165 1 43 LEU MD2 1 47 TRP HB3 . . 5.500 4.359 4.072 4.658 . 0 0 "[ . 1 . 2]" 1
1166 1 43 LEU MD2 1 47 TRP HE3 . . 4.390 3.485 3.071 3.993 . 0 0 "[ . 1 . 2]" 1
1167 1 43 LEU MD2 1 85 PRO HB2 . . 4.070 2.560 2.226 3.015 . 0 0 "[ . 1 . 2]" 1
1168 1 43 LEU MD2 1 85 PRO HB3 . . 3.260 2.208 1.919 2.582 . 0 0 "[ . 1 . 2]" 1
1169 1 43 LEU MD2 1 85 PRO HD2 . . 5.000 4.795 4.440 5.010 0.010 10 0 "[ . 1 . 2]" 1
1170 1 43 LEU MD2 1 85 PRO QD . . 4.360 3.865 3.454 4.146 . 0 0 "[ . 1 . 2]" 1
1171 1 43 LEU MD2 1 85 PRO HD3 . . 5.000 4.079 3.602 4.432 . 0 0 "[ . 1 . 2]" 1
1172 1 43 LEU MD2 1 85 PRO QG . . 3.720 2.473 2.081 2.761 . 0 0 "[ . 1 . 2]" 1
1173 1 43 LEU MD2 1 103 ARG HD2 . . 4.810 3.828 2.504 4.796 . 0 0 "[ . 1 . 2]" 1
1174 1 43 LEU MD2 1 103 ARG QD . . 4.090 3.241 2.468 4.086 . 0 0 "[ . 1 . 2]" 1
1175 1 43 LEU MD2 1 103 ARG HD3 . . 4.810 3.914 2.663 4.811 0.001 15 0 "[ . 1 . 2]" 1
1176 1 43 LEU HG 1 44 GLU H . . 4.750 3.943 3.547 4.349 . 0 0 "[ . 1 . 2]" 1
1177 1 43 LEU HG 1 46 GLU H . . 4.710 4.578 4.319 4.722 0.012 9 0 "[ . 1 . 2]" 1
1178 1 43 LEU HG 1 47 TRP H . . 4.030 3.323 3.001 3.589 . 0 0 "[ . 1 . 2]" 1
1179 1 43 LEU HG 1 47 TRP HB2 . . 4.200 2.328 2.085 2.550 . 0 0 "[ . 1 . 2]" 1
1180 1 43 LEU HG 1 47 TRP HB3 . . 4.420 3.530 3.320 3.718 . 0 0 "[ . 1 . 2]" 1
1181 1 43 LEU HG 1 47 TRP HE3 . . 4.700 3.996 3.697 4.470 . 0 0 "[ . 1 . 2]" 1
1182 1 43 LEU HG 1 48 ALA H . . 5.500 5.242 5.031 5.490 . 0 0 "[ . 1 . 2]" 1
1183 1 44 GLU H 1 44 GLU HB2 . . 3.180 2.874 2.786 2.928 . 0 0 "[ . 1 . 2]" 1
1184 1 44 GLU H 1 44 GLU HB3 . . 3.020 2.270 2.189 2.352 . 0 0 "[ . 1 . 2]" 1
1185 1 44 GLU H 1 44 GLU HG2 . . 4.710 4.354 4.101 4.584 . 0 0 "[ . 1 . 2]" 1
1186 1 44 GLU H 1 44 GLU HG3 . . 4.710 4.398 4.178 4.665 . 0 0 "[ . 1 . 2]" 1
1187 1 44 GLU H 1 45 PRO HD2 . . 3.050 2.319 2.159 2.421 . 0 0 "[ . 1 . 2]" 1
1188 1 44 GLU H 1 45 PRO HD3 . . 3.720 3.321 3.186 3.424 . 0 0 "[ . 1 . 2]" 1
1189 1 44 GLU H 1 46 GLU H . . 4.470 4.166 3.874 4.412 . 0 0 "[ . 1 . 2]" 1
1190 1 44 GLU H 1 47 TRP HB2 . . 5.500 5.494 5.416 5.529 0.029 15 0 "[ . 1 . 2]" 1
1191 1 44 GLU HA 1 44 GLU QG . . 3.260 2.954 2.690 3.279 0.019 13 0 "[ . 1 . 2]" 1
1192 1 44 GLU HA 1 46 GLU H . . 5.050 4.637 4.298 4.891 . 0 0 "[ . 1 . 2]" 1
1193 1 44 GLU HA 1 47 TRP HB2 . . 4.360 4.279 4.110 4.367 0.007 17 0 "[ . 1 . 2]" 1
1194 1 44 GLU HA 1 47 TRP HB3 . . 4.060 3.602 3.455 3.768 . 0 0 "[ . 1 . 2]" 1
1195 1 44 GLU HA 1 48 ALA H . . 4.550 4.369 4.005 4.568 0.018 15 0 "[ . 1 . 2]" 1
1196 1 44 GLU HB2 1 45 PRO HD2 . . 4.330 3.951 3.932 3.978 . 0 0 "[ . 1 . 2]" 1
1197 1 44 GLU HB2 1 45 PRO HD3 . . 3.710 3.546 3.518 3.604 . 0 0 "[ . 1 . 2]" 1
1198 1 44 GLU HB3 1 45 PRO HD2 . . 3.480 2.487 2.448 2.582 . 0 0 "[ . 1 . 2]" 1
1199 1 44 GLU QG 1 45 PRO HA . . 4.720 3.023 2.909 3.709 . 0 0 "[ . 1 . 2]" 1
1200 1 44 GLU QG 1 45 PRO HD2 . . 4.600 3.328 3.208 4.160 . 0 0 "[ . 1 . 2]" 1
1201 1 44 GLU HG2 1 45 PRO HD3 . . 4.100 2.463 1.989 3.668 . 0 0 "[ . 1 . 2]" 1
1202 1 44 GLU HG3 1 45 PRO HD3 . . 4.100 2.966 2.003 3.736 . 0 0 "[ . 1 . 2]" 1
1203 1 45 PRO HA 1 47 TRP H . . 4.680 4.144 3.966 4.449 . 0 0 "[ . 1 . 2]" 1
1204 1 45 PRO HA 1 48 ALA H . . 3.820 3.337 3.143 3.599 . 0 0 "[ . 1 . 2]" 1
1205 1 45 PRO HA 1 48 ALA MB . . 3.150 2.347 2.119 2.588 . 0 0 "[ . 1 . 2]" 1
1206 1 45 PRO HA 1 49 ALA H . . 4.180 3.872 3.642 4.150 . 0 0 "[ . 1 . 2]" 1
1207 1 45 PRO HB2 1 46 GLU H . . 3.960 3.210 2.978 3.476 . 0 0 "[ . 1 . 2]" 1
1208 1 45 PRO HB2 1 46 GLU HA . . 4.700 4.031 3.950 4.143 . 0 0 "[ . 1 . 2]" 1
1209 1 45 PRO HB3 1 48 ALA MB . . 4.630 4.293 4.108 4.520 . 0 0 "[ . 1 . 2]" 1
1210 1 45 PRO HD2 1 46 GLU H . . 3.860 2.671 2.647 2.721 . 0 0 "[ . 1 . 2]" 1
1211 1 45 PRO HD3 1 46 GLU H . . 4.190 3.845 3.836 3.861 . 0 0 "[ . 1 . 2]" 1
1212 1 45 PRO QG 1 46 GLU H . . 3.690 2.217 1.978 2.528 . 0 0 "[ . 1 . 2]" 1
1213 1 45 PRO QG 1 46 GLU QG . . 3.950 3.015 2.493 3.754 . 0 0 "[ . 1 . 2]" 1
1214 1 45 PRO HG2 1 46 GLU H . . 4.200 2.233 1.987 2.555 . 0 0 "[ . 1 . 2]" 1
1215 1 45 PRO HG3 1 46 GLU H . . 4.200 3.780 3.597 4.019 . 0 0 "[ . 1 . 2]" 1
1216 1 46 GLU H 1 46 GLU HB2 . . 4.120 2.401 2.311 2.572 . 0 0 "[ . 1 . 2]" 1
1217 1 46 GLU H 1 46 GLU HG2 . . 4.030 3.032 2.044 4.063 0.033 13 0 "[ . 1 . 2]" 1
1218 1 46 GLU H 1 46 GLU QG . . 3.150 2.634 2.032 3.218 0.068 15 0 "[ . 1 . 2]" 1
1219 1 46 GLU H 1 46 GLU HG3 . . 4.030 3.491 2.212 3.992 . 0 0 "[ . 1 . 2]" 1
1220 1 46 GLU H 1 47 TRP H . . 3.180 2.636 2.431 2.828 . 0 0 "[ . 1 . 2]" 1
1221 1 46 GLU H 1 47 TRP HB2 . . 5.140 4.938 4.716 5.130 . 0 0 "[ . 1 . 2]" 1
1222 1 46 GLU H 1 47 TRP HB3 . . 5.140 5.060 4.862 5.170 0.030 13 0 "[ . 1 . 2]" 1
1223 1 46 GLU H 1 48 ALA H . . 4.240 4.127 3.985 4.253 0.013 11 0 "[ . 1 . 2]" 1
1224 1 46 GLU H 1 48 ALA MB . . 4.720 4.698 4.588 4.735 0.015 17 0 "[ . 1 . 2]" 1
1225 1 46 GLU H 1 105 ARG H . . 5.500 5.416 5.265 5.504 0.004 15 0 "[ . 1 . 2]" 1
1226 1 46 GLU HA 1 49 ALA H . . 4.560 4.088 3.739 4.300 . 0 0 "[ . 1 . 2]" 1
1227 1 46 GLU HA 1 49 ALA MB . . 4.060 3.503 3.057 3.734 . 0 0 "[ . 1 . 2]" 1
1228 1 46 GLU HA 1 50 ALA H . . 4.800 4.244 3.968 4.387 . 0 0 "[ . 1 . 2]" 1
1229 1 46 GLU HA 1 50 ALA MB . . 5.320 4.502 4.304 4.761 . 0 0 "[ . 1 . 2]" 1
1230 1 46 GLU HA 1 105 ARG H . . 4.070 3.140 2.863 3.490 . 0 0 "[ . 1 . 2]" 1
1231 1 46 GLU HA 1 105 ARG QB . . 4.820 2.731 2.435 3.022 . 0 0 "[ . 1 . 2]" 1
1232 1 46 GLU HA 1 105 ARG HD2 . . 4.990 4.587 4.108 4.995 0.005 7 0 "[ . 1 . 2]" 1
1233 1 46 GLU HA 1 105 ARG HD3 . . 4.650 3.375 3.022 3.689 . 0 0 "[ . 1 . 2]" 1
1234 1 46 GLU HB2 1 47 TRP H . . 3.710 2.861 2.595 3.015 . 0 0 "[ . 1 . 2]" 1
1235 1 46 GLU HB2 1 47 TRP HE3 . . 5.500 5.216 4.909 5.481 . 0 0 "[ . 1 . 2]" 1
1236 1 46 GLU HB2 1 105 ARG H . . 4.350 4.087 3.778 4.346 . 0 0 "[ . 1 . 2]" 1
1237 1 46 GLU HB3 1 47 TRP H . . 3.840 3.721 3.442 3.845 0.005 10 0 "[ . 1 . 2]" 1
1238 1 46 GLU HB3 1 104 THR HA . . 4.620 2.379 1.993 2.738 . 0 0 "[ . 1 . 2]" 1
1239 1 46 GLU HB3 1 104 THR HB . . 4.730 4.577 4.026 4.742 0.012 10 0 "[ . 1 . 2]" 1
1240 1 46 GLU HB3 1 105 ARG H . . 3.320 2.371 2.043 2.737 . 0 0 "[ . 1 . 2]" 1
1241 1 46 GLU QG 1 47 TRP H . . 5.340 4.326 4.001 4.617 . 0 0 "[ . 1 . 2]" 1
1242 1 46 GLU QG 1 104 THR HA . . 3.770 2.794 2.215 3.233 . 0 0 "[ . 1 . 2]" 1
1243 1 46 GLU QG 1 104 THR HB . . 5.000 4.224 3.666 4.988 . 0 0 "[ . 1 . 2]" 1
1244 1 46 GLU QG 1 104 THR MG . . 4.060 2.911 2.121 3.500 . 0 0 "[ . 1 . 2]" 1
1245 1 46 GLU QG 1 105 ARG H . . 3.830 3.367 2.795 3.817 . 0 0 "[ . 1 . 2]" 1
1246 1 46 GLU HG2 1 104 THR HA . . 4.540 3.735 2.270 4.462 . 0 0 "[ . 1 . 2]" 1
1247 1 46 GLU HG3 1 104 THR HA . . 4.540 3.202 2.592 4.538 . 0 0 "[ . 1 . 2]" 1
1248 1 47 TRP H 1 47 TRP HB2 . . 3.300 2.565 2.441 2.637 . 0 0 "[ . 1 . 2]" 1
1249 1 47 TRP H 1 47 TRP HB3 . . 3.330 2.618 2.560 2.688 . 0 0 "[ . 1 . 2]" 1
1250 1 47 TRP H 1 47 TRP HE3 . . 4.670 4.593 4.443 4.684 0.014 13 0 "[ . 1 . 2]" 1
1251 1 47 TRP H 1 48 ALA H . . 3.360 2.384 2.252 2.654 . 0 0 "[ . 1 . 2]" 1
1252 1 47 TRP H 1 48 ALA MB . . 4.370 3.981 3.820 4.191 . 0 0 "[ . 1 . 2]" 1
1253 1 47 TRP H 1 49 ALA H . . 4.420 4.221 4.039 4.423 0.003 16 0 "[ . 1 . 2]" 1
1254 1 47 TRP H 1 108 ILE MD . . 4.450 4.351 4.137 4.453 0.003 4 0 "[ . 1 . 2]" 1
1255 1 47 TRP HA 1 47 TRP HD1 . . 4.580 4.308 4.243 4.387 . 0 0 "[ . 1 . 2]" 1
1256 1 47 TRP HA 1 47 TRP HE3 . . 3.550 2.773 2.585 2.948 . 0 0 "[ . 1 . 2]" 1
1257 1 47 TRP HA 1 50 ALA H . . 4.020 3.600 3.450 3.785 . 0 0 "[ . 1 . 2]" 1
1258 1 47 TRP HA 1 50 ALA MB . . 3.410 2.539 2.347 2.752 . 0 0 "[ . 1 . 2]" 1
1259 1 47 TRP HA 1 51 ALA H . . 4.260 4.070 3.874 4.255 . 0 0 "[ . 1 . 2]" 1
1260 1 47 TRP HA 1 64 LEU MD2 . . 4.050 3.649 3.450 3.827 . 0 0 "[ . 1 . 2]" 1
1261 1 47 TRP HA 1 108 ILE MD . . 3.430 2.847 2.438 3.142 . 0 0 "[ . 1 . 2]" 1
1262 1 47 TRP HA 1 108 ILE MG . . 4.170 3.812 3.600 4.159 . 0 0 "[ . 1 . 2]" 1
1263 1 47 TRP HB2 1 47 TRP HE3 . . 4.160 2.730 2.652 2.811 . 0 0 "[ . 1 . 2]" 1
1264 1 47 TRP HB2 1 48 ALA H . . 3.920 3.810 3.709 3.917 . 0 0 "[ . 1 . 2]" 1
1265 1 47 TRP HB2 1 108 ILE MD . . 4.370 3.734 3.454 3.877 . 0 0 "[ . 1 . 2]" 1
1266 1 47 TRP HB3 1 47 TRP HD1 . . 3.880 2.589 2.566 2.618 . 0 0 "[ . 1 . 2]" 1
1267 1 47 TRP HB3 1 47 TRP HE1 . . 5.090 4.765 4.756 4.774 . 0 0 "[ . 1 . 2]" 1
1268 1 47 TRP HB3 1 48 ALA H . . 3.380 2.642 2.541 2.808 . 0 0 "[ . 1 . 2]" 1
1269 1 47 TRP HB3 1 49 ALA H . . 5.500 5.266 5.071 5.493 . 0 0 "[ . 1 . 2]" 1
1270 1 47 TRP HB3 1 108 ILE MD . . 5.330 4.946 4.615 5.130 . 0 0 "[ . 1 . 2]" 1
1271 1 47 TRP HD1 1 48 ALA H . . 4.520 4.233 3.969 4.477 . 0 0 "[ . 1 . 2]" 1
1272 1 47 TRP HD1 1 48 ALA HA . . 4.610 3.845 3.573 4.059 . 0 0 "[ . 1 . 2]" 1
1273 1 47 TRP HD1 1 51 ALA MB . . 4.340 4.038 3.685 4.284 . 0 0 "[ . 1 . 2]" 1
1274 1 47 TRP HD1 1 64 LEU MD2 . . 4.760 4.237 3.888 4.620 . 0 0 "[ . 1 . 2]" 1
1275 1 47 TRP HD1 1 66 ALA MB . . 4.050 3.353 2.811 3.785 . 0 0 "[ . 1 . 2]" 1
1276 1 47 TRP HE1 1 64 LEU HA . . 4.410 4.182 3.872 4.402 . 0 0 "[ . 1 . 2]" 1
1277 1 47 TRP HE1 1 64 LEU HB2 . . 5.010 4.258 3.875 4.528 . 0 0 "[ . 1 . 2]" 1
1278 1 47 TRP HE1 1 64 LEU HB3 . . 3.700 2.574 2.182 2.825 . 0 0 "[ . 1 . 2]" 1
1279 1 47 TRP HE1 1 64 LEU MD1 . . 5.370 5.188 4.882 5.370 . 0 0 "[ . 1 . 2]" 1
1280 1 47 TRP HE1 1 64 LEU MD2 . . 4.300 3.508 3.214 3.839 . 0 0 "[ . 1 . 2]" 1
1281 1 47 TRP HE1 1 65 ALA H . . 3.920 3.468 3.063 3.711 . 0 0 "[ . 1 . 2]" 1
1282 1 47 TRP HE1 1 65 ALA HA . . 4.540 3.530 3.308 3.821 . 0 0 "[ . 1 . 2]" 1
1283 1 47 TRP HE1 1 66 ALA H . . 5.030 4.381 3.976 4.671 . 0 0 "[ . 1 . 2]" 1
1284 1 47 TRP HE1 1 66 ALA HA . . 4.520 4.136 3.663 4.401 . 0 0 "[ . 1 . 2]" 1
1285 1 47 TRP HE1 1 66 ALA MB . . 3.580 3.307 3.033 3.493 . 0 0 "[ . 1 . 2]" 1
1286 1 47 TRP HE3 1 50 ALA MB . . 4.540 3.968 3.672 4.150 . 0 0 "[ . 1 . 2]" 1
1287 1 47 TRP HE3 1 64 LEU MD2 . . 4.550 3.855 3.713 3.953 . 0 0 "[ . 1 . 2]" 1
1288 1 47 TRP HE3 1 87 ILE MG . . 4.880 4.711 4.337 4.881 0.001 19 0 "[ . 1 . 2]" 1
1289 1 47 TRP HE3 1 108 ILE MD . . 3.110 1.992 1.873 2.114 . 0 0 "[ . 1 . 2]" 1
1290 1 47 TRP HE3 1 108 ILE HG13 . . 4.790 4.623 4.318 4.791 0.001 11 0 "[ . 1 . 2]" 1
1291 1 47 TRP HE3 1 108 ILE MG . . 3.890 3.069 2.760 3.629 . 0 0 "[ . 1 . 2]" 1
1292 1 47 TRP HH2 1 64 LEU MD2 . . 4.860 3.513 3.282 3.806 . 0 0 "[ . 1 . 2]" 1
1293 1 47 TRP HH2 1 64 LEU HG . . 4.640 3.576 3.268 3.768 . 0 0 "[ . 1 . 2]" 1
1294 1 47 TRP HH2 1 65 ALA H . . 5.500 5.302 5.117 5.499 . 0 0 "[ . 1 . 2]" 1
1295 1 47 TRP HH2 1 87 ILE MG . . 3.290 2.161 1.936 2.373 . 0 0 "[ . 1 . 2]" 1
1296 1 47 TRP HH2 1 108 ILE MG . . 4.550 3.172 2.895 3.383 . 0 0 "[ . 1 . 2]" 1
1297 1 47 TRP HZ2 1 64 LEU HA . . 4.180 3.342 3.118 3.515 . 0 0 "[ . 1 . 2]" 1
1298 1 47 TRP HZ2 1 64 LEU MD1 . . 4.500 4.400 4.183 4.505 0.005 5 0 "[ . 1 . 2]" 1
1299 1 47 TRP HZ2 1 64 LEU MD2 . . 4.270 3.241 3.021 3.467 . 0 0 "[ . 1 . 2]" 1
1300 1 47 TRP HZ2 1 64 LEU HG . . 3.910 2.821 2.559 2.951 . 0 0 "[ . 1 . 2]" 1
1301 1 47 TRP HZ2 1 65 ALA H . . 3.630 3.069 2.797 3.312 . 0 0 "[ . 1 . 2]" 1
1302 1 47 TRP HZ2 1 87 ILE MG . . 4.410 4.037 3.780 4.245 . 0 0 "[ . 1 . 2]" 1
1303 1 47 TRP HZ3 1 64 LEU MD2 . . 4.720 3.790 3.572 4.033 . 0 0 "[ . 1 . 2]" 1
1304 1 47 TRP HZ3 1 108 ILE HG12 . . 3.910 2.545 2.267 2.800 . 0 0 "[ . 1 . 2]" 1
1305 1 47 TRP HZ3 1 108 ILE HG13 . . 4.890 4.251 3.939 4.508 . 0 0 "[ . 1 . 2]" 1
1306 1 47 TRP HZ3 1 108 ILE MG . . 3.430 2.145 1.943 2.690 . 0 0 "[ . 1 . 2]" 1
1307 1 48 ALA H 1 48 ALA MB . . 2.800 2.112 2.027 2.234 . 0 0 "[ . 1 . 2]" 1
1308 1 48 ALA H 1 49 ALA H . . 3.210 2.848 2.744 2.989 . 0 0 "[ . 1 . 2]" 1
1309 1 48 ALA H 1 50 ALA H . . 4.480 4.318 4.196 4.433 . 0 0 "[ . 1 . 2]" 1
1310 1 48 ALA H 1 50 ALA MB . . 4.770 4.722 4.618 4.773 0.003 12 0 "[ . 1 . 2]" 1
1311 1 48 ALA H 1 51 ALA H . . 5.300 4.912 4.804 5.120 . 0 0 "[ . 1 . 2]" 1
1312 1 48 ALA HA 1 50 ALA H . . 5.150 4.804 4.653 4.960 . 0 0 "[ . 1 . 2]" 1
1313 1 48 ALA HA 1 51 ALA H . . 4.150 3.880 3.639 4.086 . 0 0 "[ . 1 . 2]" 1
1314 1 48 ALA HA 1 51 ALA MB . . 3.400 3.121 2.919 3.361 . 0 0 "[ . 1 . 2]" 1
1315 1 48 ALA HA 1 52 SER H . . 5.260 4.889 4.694 5.157 . 0 0 "[ . 1 . 2]" 1
1316 1 48 ALA MB 1 49 ALA H . . 2.780 2.467 2.214 2.605 . 0 0 "[ . 1 . 2]" 1
1317 1 48 ALA MB 1 51 ALA MB . . 4.520 4.202 3.995 4.402 . 0 0 "[ . 1 . 2]" 1
1318 1 49 ALA H 1 49 ALA MB . . 2.930 2.197 2.107 2.242 . 0 0 "[ . 1 . 2]" 1
1319 1 49 ALA H 1 50 ALA H . . 3.040 2.753 2.622 2.930 . 0 0 "[ . 1 . 2]" 1
1320 1 49 ALA H 1 50 ALA MB . . 4.430 4.260 4.098 4.431 0.001 7 0 "[ . 1 . 2]" 1
1321 1 49 ALA H 1 51 ALA H . . 4.640 4.274 4.089 4.554 . 0 0 "[ . 1 . 2]" 1
1322 1 49 ALA H 1 105 ARG HD2 . . 5.330 4.820 4.499 5.076 . 0 0 "[ . 1 . 2]" 1
1323 1 49 ALA H 1 105 ARG HD3 . . 5.430 4.984 4.649 5.420 . 0 0 "[ . 1 . 2]" 1
1324 1 49 ALA HA 1 50 ALA MB . . 5.410 5.008 4.993 5.017 . 0 0 "[ . 1 . 2]" 1
1325 1 49 ALA HA 1 51 ALA H . . 4.640 4.377 3.964 4.642 0.002 12 0 "[ . 1 . 2]" 1
1326 1 49 ALA HA 1 51 ALA MB . . 5.500 4.655 4.447 4.809 . 0 0 "[ . 1 . 2]" 1
1327 1 49 ALA HA 1 52 SER H . . 4.020 3.484 3.264 3.608 . 0 0 "[ . 1 . 2]" 1
1328 1 49 ALA HA 1 52 SER QB . . 3.910 2.962 2.531 3.243 . 0 0 "[ . 1 . 2]" 1
1329 1 49 ALA HA 1 105 ARG HD2 . . 5.430 4.593 4.285 4.893 . 0 0 "[ . 1 . 2]" 1
1330 1 49 ALA MB 1 50 ALA H . . 3.050 2.358 2.253 2.458 . 0 0 "[ . 1 . 2]" 1
1331 1 49 ALA MB 1 50 ALA HA . . 4.230 3.721 3.644 3.794 . 0 0 "[ . 1 . 2]" 1
1332 1 49 ALA MB 1 50 ALA MB . . 3.740 3.706 3.651 3.744 0.004 10 0 "[ . 1 . 2]" 1
1333 1 49 ALA MB 1 51 ALA H . . 4.690 4.500 4.271 4.645 . 0 0 "[ . 1 . 2]" 1
1334 1 49 ALA MB 1 52 SER H . . 4.740 4.555 4.383 4.722 . 0 0 "[ . 1 . 2]" 1
1335 1 49 ALA MB 1 105 ARG H . . 4.970 4.707 4.426 4.941 . 0 0 "[ . 1 . 2]" 1
1336 1 49 ALA MB 1 105 ARG HB2 . . 3.650 2.825 2.392 3.041 . 0 0 "[ . 1 . 2]" 1
1337 1 49 ALA MB 1 105 ARG HB3 . . 3.650 2.771 2.474 2.982 . 0 0 "[ . 1 . 2]" 1
1338 1 49 ALA MB 1 105 ARG HD2 . . 3.470 1.979 1.782 2.130 . 0 0 "[ . 1 . 2]" 1
1339 1 49 ALA MB 1 105 ARG HD3 . . 3.310 2.596 2.253 3.006 . 0 0 "[ . 1 . 2]" 1
1340 1 49 ALA MB 1 105 ARG HG2 . . 4.640 4.157 3.823 4.416 . 0 0 "[ . 1 . 2]" 1
1341 1 50 ALA H 1 50 ALA MB . . 2.840 2.052 2.025 2.161 . 0 0 "[ . 1 . 2]" 1
1342 1 50 ALA H 1 52 SER H . . 4.600 4.408 4.186 4.601 0.001 13 0 "[ . 1 . 2]" 1
1343 1 50 ALA H 1 53 GLU H . . 4.820 4.701 4.550 4.820 . 0 0 "[ . 1 . 2]" 1
1344 1 50 ALA H 1 64 LEU MD2 . . 4.940 4.527 4.362 4.697 . 0 0 "[ . 1 . 2]" 1
1345 1 50 ALA H 1 105 ARG HA . . 4.620 3.744 3.448 4.008 . 0 0 "[ . 1 . 2]" 1
1346 1 50 ALA H 1 105 ARG HB2 . . 4.670 2.551 2.283 2.764 . 0 0 "[ . 1 . 2]" 1
1347 1 50 ALA H 1 105 ARG QB . . 3.920 2.410 2.202 2.575 . 0 0 "[ . 1 . 2]" 1
1348 1 50 ALA H 1 105 ARG HB3 . . 4.670 2.990 2.793 3.222 . 0 0 "[ . 1 . 2]" 1
1349 1 50 ALA H 1 105 ARG HD2 . . 4.660 3.876 3.509 4.117 . 0 0 "[ . 1 . 2]" 1
1350 1 50 ALA H 1 105 ARG HD3 . . 4.940 4.423 4.160 4.617 . 0 0 "[ . 1 . 2]" 1
1351 1 50 ALA H 1 105 ARG HG2 . . 5.400 5.229 5.032 5.386 . 0 0 "[ . 1 . 2]" 1
1352 1 50 ALA H 1 105 ARG HG3 . . 4.800 4.730 4.464 4.806 0.006 13 0 "[ . 1 . 2]" 1
1353 1 50 ALA H 1 108 ILE MD . . 4.860 4.583 4.401 4.779 . 0 0 "[ . 1 . 2]" 1
1354 1 50 ALA H 1 108 ILE MG . . 5.310 5.079 4.880 5.288 . 0 0 "[ . 1 . 2]" 1
1355 1 50 ALA HA 1 53 GLU H . . 3.870 3.345 3.210 3.510 . 0 0 "[ . 1 . 2]" 1
1356 1 50 ALA HA 1 53 GLU HB2 . . 4.050 3.749 3.537 3.947 . 0 0 "[ . 1 . 2]" 1
1357 1 50 ALA HA 1 53 GLU HB3 . . 3.920 2.407 2.219 2.563 . 0 0 "[ . 1 . 2]" 1
1358 1 50 ALA HA 1 53 GLU QG . . 4.470 3.813 3.610 4.029 . 0 0 "[ . 1 . 2]" 1
1359 1 50 ALA HA 1 54 VAL H . . 4.340 4.013 3.863 4.271 . 0 0 "[ . 1 . 2]" 1
1360 1 50 ALA HA 1 54 VAL MG2 . . 4.230 3.414 3.222 3.660 . 0 0 "[ . 1 . 2]" 1
1361 1 50 ALA HA 1 64 LEU MD2 . . 4.650 4.234 4.066 4.521 . 0 0 "[ . 1 . 2]" 1
1362 1 50 ALA HA 1 105 ARG HA . . 4.850 3.581 3.125 3.939 . 0 0 "[ . 1 . 2]" 1
1363 1 50 ALA HA 1 105 ARG QB . . 4.010 2.394 2.258 2.674 . 0 0 "[ . 1 . 2]" 1
1364 1 50 ALA HA 1 105 ARG HD3 . . 5.500 5.384 5.110 5.509 0.009 9 0 "[ . 1 . 2]" 1
1365 1 50 ALA HA 1 105 ARG HG2 . . 5.480 5.205 5.096 5.408 . 0 0 "[ . 1 . 2]" 1
1366 1 50 ALA HA 1 105 ARG HG3 . . 4.310 3.986 3.788 4.151 . 0 0 "[ . 1 . 2]" 1
1367 1 50 ALA HA 1 109 VAL H . . 4.890 4.714 4.424 4.891 0.001 9 0 "[ . 1 . 2]" 1
1368 1 50 ALA HA 1 109 VAL HA . . 5.230 4.869 4.639 5.090 . 0 0 "[ . 1 . 2]" 1
1369 1 50 ALA HA 1 109 VAL MG2 . . 3.130 2.076 1.913 2.262 . 0 0 "[ . 1 . 2]" 1
1370 1 50 ALA MB 1 51 ALA H . . 2.990 2.566 2.306 2.780 . 0 0 "[ . 1 . 2]" 1
1371 1 50 ALA MB 1 53 GLU H . . 4.990 4.510 4.385 4.697 . 0 0 "[ . 1 . 2]" 1
1372 1 50 ALA MB 1 53 GLU HB3 . . 4.640 3.950 3.838 4.088 . 0 0 "[ . 1 . 2]" 1
1373 1 50 ALA MB 1 54 VAL H . . 4.980 4.506 4.389 4.769 . 0 0 "[ . 1 . 2]" 1
1374 1 50 ALA MB 1 54 VAL HB . . 4.990 4.512 4.313 4.742 . 0 0 "[ . 1 . 2]" 1
1375 1 50 ALA MB 1 54 VAL MG2 . . 3.500 2.832 2.641 3.031 . 0 0 "[ . 1 . 2]" 1
1376 1 50 ALA MB 1 64 LEU MD1 . . 4.260 3.828 3.628 4.066 . 0 0 "[ . 1 . 2]" 1
1377 1 50 ALA MB 1 64 LEU MD2 . . 2.900 2.200 1.980 2.380 . 0 0 "[ . 1 . 2]" 1
1378 1 50 ALA MB 1 105 ARG H . . 5.020 3.897 3.522 4.197 . 0 0 "[ . 1 . 2]" 1
1379 1 50 ALA MB 1 105 ARG HA . . 3.410 1.956 1.794 2.124 . 0 0 "[ . 1 . 2]" 1
1380 1 50 ALA MB 1 105 ARG QB . . 3.550 2.303 2.105 2.544 . 0 0 "[ . 1 . 2]" 1
1381 1 50 ALA MB 1 105 ARG HG2 . . 4.810 4.590 4.458 4.783 . 0 0 "[ . 1 . 2]" 1
1382 1 50 ALA MB 1 105 ARG HG3 . . 4.460 4.130 3.902 4.309 . 0 0 "[ . 1 . 2]" 1
1383 1 50 ALA MB 1 106 SER H . . 4.910 4.766 4.672 4.906 . 0 0 "[ . 1 . 2]" 1
1384 1 50 ALA MB 1 108 ILE H . . 4.550 4.417 4.271 4.552 0.002 19 0 "[ . 1 . 2]" 1
1385 1 50 ALA MB 1 108 ILE HA . . 5.080 4.746 4.651 4.853 . 0 0 "[ . 1 . 2]" 1
1386 1 50 ALA MB 1 108 ILE HB . . 3.780 2.373 2.219 2.546 . 0 0 "[ . 1 . 2]" 1
1387 1 50 ALA MB 1 108 ILE MD . . 2.830 2.689 2.472 2.827 . 0 0 "[ . 1 . 2]" 1
1388 1 50 ALA MB 1 108 ILE MG . . 2.980 2.294 2.130 2.487 . 0 0 "[ . 1 . 2]" 1
1389 1 50 ALA MB 1 109 VAL H . . 3.910 3.286 3.045 3.510 . 0 0 "[ . 1 . 2]" 1
1390 1 50 ALA MB 1 109 VAL HA . . 4.310 3.856 3.716 4.069 . 0 0 "[ . 1 . 2]" 1
1391 1 51 ALA H 1 51 ALA MB . . 3.110 2.181 2.087 2.244 . 0 0 "[ . 1 . 2]" 1
1392 1 51 ALA H 1 52 SER H . . 3.260 2.831 2.691 2.964 . 0 0 "[ . 1 . 2]" 1
1393 1 51 ALA H 1 53 GLU H . . 4.580 4.149 3.945 4.421 . 0 0 "[ . 1 . 2]" 1
1394 1 51 ALA H 1 54 VAL H . . 5.130 4.655 4.577 4.760 . 0 0 "[ . 1 . 2]" 1
1395 1 51 ALA H 1 54 VAL HB . . 5.220 4.939 4.648 5.110 . 0 0 "[ . 1 . 2]" 1
1396 1 51 ALA H 1 54 VAL MG2 . . 4.690 4.206 3.922 4.415 . 0 0 "[ . 1 . 2]" 1
1397 1 51 ALA H 1 64 LEU HB2 . . 5.310 4.314 4.056 4.655 . 0 0 "[ . 1 . 2]" 1
1398 1 51 ALA H 1 64 LEU MD1 . . 4.690 4.439 4.154 4.689 . 0 0 "[ . 1 . 2]" 1
1399 1 51 ALA H 1 64 LEU MD2 . . 3.410 2.798 2.548 3.058 . 0 0 "[ . 1 . 2]" 1
1400 1 51 ALA HA 1 54 VAL H . . 3.980 3.599 3.469 3.728 . 0 0 "[ . 1 . 2]" 1
1401 1 51 ALA HA 1 54 VAL HB . . 3.720 2.759 2.542 2.955 . 0 0 "[ . 1 . 2]" 1
1402 1 51 ALA HA 1 54 VAL MG1 . . 4.520 4.040 3.821 4.204 . 0 0 "[ . 1 . 2]" 1
1403 1 51 ALA HA 1 54 VAL MG2 . . 3.960 3.198 2.994 3.438 . 0 0 "[ . 1 . 2]" 1
1404 1 51 ALA HA 1 55 LYS H . . 4.620 3.998 3.848 4.312 . 0 0 "[ . 1 . 2]" 1
1405 1 51 ALA HA 1 64 LEU H . . 4.570 4.212 3.928 4.531 . 0 0 "[ . 1 . 2]" 1
1406 1 51 ALA HA 1 64 LEU HB2 . . 3.800 2.427 2.219 2.692 . 0 0 "[ . 1 . 2]" 1
1407 1 51 ALA HA 1 64 LEU HB3 . . 4.680 3.678 3.473 3.942 . 0 0 "[ . 1 . 2]" 1
1408 1 51 ALA HA 1 64 LEU MD1 . . 3.570 2.356 2.115 2.665 . 0 0 "[ . 1 . 2]" 1
1409 1 51 ALA HA 1 64 LEU MD2 . . 3.190 2.169 1.978 2.462 . 0 0 "[ . 1 . 2]" 1
1410 1 51 ALA HA 1 64 LEU HG . . 4.910 4.357 4.173 4.568 . 0 0 "[ . 1 . 2]" 1
1411 1 51 ALA MB 1 52 SER H . . 3.050 2.482 2.242 2.785 . 0 0 "[ . 1 . 2]" 1
1412 1 51 ALA MB 1 52 SER HA . . 4.540 3.795 3.724 3.862 . 0 0 "[ . 1 . 2]" 1
1413 1 51 ALA MB 1 53 GLU H . . 5.350 4.469 4.298 4.730 . 0 0 "[ . 1 . 2]" 1
1414 1 51 ALA MB 1 54 VAL H . . 5.340 4.563 4.453 4.692 . 0 0 "[ . 1 . 2]" 1
1415 1 51 ALA MB 1 54 VAL HB . . 4.430 4.277 4.136 4.432 0.002 18 0 "[ . 1 . 2]" 1
1416 1 51 ALA MB 1 55 LYS H . . 5.260 4.598 4.475 4.912 . 0 0 "[ . 1 . 2]" 1
1417 1 51 ALA MB 1 63 LYS HA . . 5.240 4.875 4.618 5.090 . 0 0 "[ . 1 . 2]" 1
1418 1 51 ALA MB 1 64 LEU HB2 . . 3.350 2.210 2.001 2.506 . 0 0 "[ . 1 . 2]" 1
1419 1 51 ALA MB 1 64 LEU MD1 . . 4.130 3.411 3.194 3.630 . 0 0 "[ . 1 . 2]" 1
1420 1 51 ALA MB 1 64 LEU MD2 . . 3.510 2.660 2.438 2.911 . 0 0 "[ . 1 . 2]" 1
1421 1 52 SER H 1 52 SER HB2 . . 3.690 2.239 2.185 2.369 . 0 0 "[ . 1 . 2]" 1
1422 1 52 SER H 1 52 SER QB . . 2.870 2.200 2.164 2.251 . 0 0 "[ . 1 . 2]" 1
1423 1 52 SER H 1 52 SER HB3 . . 3.690 3.352 2.811 3.540 . 0 0 "[ . 1 . 2]" 1
1424 1 52 SER H 1 53 GLU HB3 . . 4.790 4.656 4.458 4.785 . 0 0 "[ . 1 . 2]" 1
1425 1 52 SER H 1 54 VAL H . . 4.300 3.842 3.661 3.985 . 0 0 "[ . 1 . 2]" 1
1426 1 52 SER H 1 64 LEU MD2 . . 4.860 4.721 4.529 4.860 . 0 0 "[ . 1 . 2]" 1
1427 1 52 SER HA 1 55 LYS H . . 3.870 3.464 3.342 3.595 . 0 0 "[ . 1 . 2]" 1
1428 1 52 SER HA 1 55 LYS QB . . 3.890 3.374 2.466 3.827 . 0 0 "[ . 1 . 2]" 1
1429 1 52 SER HA 1 55 LYS HD2 . . 5.100 4.352 3.841 5.105 0.005 9 0 "[ . 1 . 2]" 1
1430 1 52 SER HA 1 55 LYS QD . . 4.360 2.909 2.501 3.649 . 0 0 "[ . 1 . 2]" 1
1431 1 52 SER HA 1 55 LYS HD3 . . 5.100 2.958 2.525 3.737 . 0 0 "[ . 1 . 2]" 1
1432 1 52 SER HA 1 55 LYS QE . . 4.880 3.415 2.504 4.836 . 0 0 "[ . 1 . 2]" 1
1433 1 52 SER HA 1 55 LYS QG . . 4.880 2.505 1.994 4.310 . 0 0 "[ . 1 . 2]" 1
1434 1 52 SER HA 1 56 GLU H . . 4.330 4.100 3.761 4.288 . 0 0 "[ . 1 . 2]" 1
1435 1 52 SER QB 1 54 VAL H . . 4.760 4.484 4.363 4.610 . 0 0 "[ . 1 . 2]" 1
1436 1 52 SER HB2 1 53 GLU H . . 3.640 3.034 2.618 3.639 . 0 0 "[ . 1 . 2]" 1
1437 1 52 SER HB2 1 54 VAL H . . 5.470 5.041 4.794 5.374 . 0 0 "[ . 1 . 2]" 1
1438 1 52 SER HB3 1 53 GLU H . . 3.640 3.226 2.508 3.611 . 0 0 "[ . 1 . 2]" 1
1439 1 52 SER HB3 1 54 VAL H . . 5.470 5.068 4.678 5.292 . 0 0 "[ . 1 . 2]" 1
1440 1 53 GLU H 1 53 GLU HB2 . . 3.060 2.719 2.629 2.843 . 0 0 "[ . 1 . 2]" 1
1441 1 53 GLU H 1 53 GLU HB3 . . 3.540 2.379 2.303 2.459 . 0 0 "[ . 1 . 2]" 1
1442 1 53 GLU H 1 53 GLU HG2 . . 4.640 4.518 4.284 4.597 . 0 0 "[ . 1 . 2]" 1
1443 1 53 GLU H 1 53 GLU HG3 . . 4.640 4.366 4.264 4.460 . 0 0 "[ . 1 . 2]" 1
1444 1 53 GLU H 1 54 VAL H . . 3.220 2.505 2.369 2.640 . 0 0 "[ . 1 . 2]" 1
1445 1 53 GLU H 1 54 VAL HB . . 4.850 4.678 4.529 4.856 0.006 1 0 "[ . 1 . 2]" 1
1446 1 53 GLU H 1 54 VAL MG2 . . 4.340 4.167 3.973 4.328 . 0 0 "[ . 1 . 2]" 1
1447 1 53 GLU H 1 55 LYS H . . 4.460 4.196 4.036 4.338 . 0 0 "[ . 1 . 2]" 1
1448 1 53 GLU H 1 109 VAL MG2 . . 4.160 3.702 3.494 3.818 . 0 0 "[ . 1 . 2]" 1
1449 1 53 GLU HA 1 53 GLU HG2 . . 3.890 3.806 3.542 3.894 0.004 8 0 "[ . 1 . 2]" 1
1450 1 53 GLU HA 1 53 GLU HG3 . . 3.890 2.934 2.544 3.140 . 0 0 "[ . 1 . 2]" 1
1451 1 53 GLU HA 1 54 VAL MG2 . . 4.970 4.881 4.735 4.972 0.002 6 0 "[ . 1 . 2]" 1
1452 1 53 GLU HA 1 56 GLU H . . 4.060 3.696 3.528 3.866 . 0 0 "[ . 1 . 2]" 1
1453 1 53 GLU HA 1 56 GLU QB . . 4.200 3.414 3.059 3.802 . 0 0 "[ . 1 . 2]" 1
1454 1 53 GLU HA 1 56 GLU QG . . 3.760 2.237 1.992 2.524 . 0 0 "[ . 1 . 2]" 1
1455 1 53 GLU HA 1 57 GLN H . . 4.620 4.333 4.077 4.539 . 0 0 "[ . 1 . 2]" 1
1456 1 53 GLU HA 1 57 GLN HE21 . . 5.160 4.531 4.232 4.786 . 0 0 "[ . 1 . 2]" 1
1457 1 53 GLU HB2 1 54 VAL H . . 4.480 4.186 4.096 4.323 . 0 0 "[ . 1 . 2]" 1
1458 1 53 GLU HB2 1 57 GLN HE21 . . 5.500 5.253 4.902 5.487 . 0 0 "[ . 1 . 2]" 1
1459 1 53 GLU HB2 1 57 GLN QG . . 5.500 5.265 5.051 5.488 . 0 0 "[ . 1 . 2]" 1
1460 1 53 GLU HB2 1 109 VAL MG1 . . 4.590 4.145 3.991 4.316 . 0 0 "[ . 1 . 2]" 1
1461 1 53 GLU HB2 1 109 VAL MG2 . . 3.690 3.398 3.256 3.544 . 0 0 "[ . 1 . 2]" 1
1462 1 53 GLU HB3 1 54 VAL H . . 3.510 3.070 2.881 3.313 . 0 0 "[ . 1 . 2]" 1
1463 1 53 GLU HB3 1 54 VAL HB . . 5.220 5.054 4.939 5.221 0.001 17 0 "[ . 1 . 2]" 1
1464 1 53 GLU HB3 1 54 VAL MG2 . . 4.310 3.437 3.172 3.690 . 0 0 "[ . 1 . 2]" 1
1465 1 53 GLU HB3 1 109 VAL MG2 . . 3.980 2.030 1.920 2.196 . 0 0 "[ . 1 . 2]" 1
1466 1 53 GLU QG 1 54 VAL H . . 4.520 3.774 3.604 3.938 . 0 0 "[ . 1 . 2]" 1
1467 1 53 GLU QG 1 54 VAL HA . . 3.800 3.609 3.443 3.785 . 0 0 "[ . 1 . 2]" 1
1468 1 53 GLU QG 1 54 VAL MG2 . . 4.220 3.398 3.204 3.760 . 0 0 "[ . 1 . 2]" 1
1469 1 53 GLU QG 1 57 GLN HE22 . . 3.790 2.817 2.660 3.082 . 0 0 "[ . 1 . 2]" 1
1470 1 53 GLU QG 1 57 GLN QG . . 4.600 3.191 2.971 3.403 . 0 0 "[ . 1 . 2]" 1
1471 1 53 GLU QG 1 109 VAL MG1 . . 3.460 1.800 1.751 1.838 . 0 0 "[ . 1 . 2]" 1
1472 1 53 GLU QG 1 109 VAL MG2 . . 3.450 2.180 1.901 2.531 . 0 0 "[ . 1 . 2]" 1
1473 1 53 GLU QG 1 110 SER H . . 5.340 5.337 5.304 5.356 0.016 17 0 "[ . 1 . 2]" 1
1474 1 53 GLU HG2 1 54 VAL H . . 5.350 4.702 4.161 4.949 . 0 0 "[ . 1 . 2]" 1
1475 1 53 GLU HG2 1 57 GLN HE21 . . 3.920 3.649 2.998 3.917 . 0 0 "[ . 1 . 2]" 1
1476 1 53 GLU HG2 1 57 GLN HE22 . . 4.360 3.605 3.046 3.968 . 0 0 "[ . 1 . 2]" 1
1477 1 53 GLU HG2 1 109 VAL MG1 . . 4.190 2.074 1.829 2.330 . 0 0 "[ . 1 . 2]" 1
1478 1 53 GLU HG2 1 109 VAL MG2 . . 4.240 2.317 1.912 2.702 . 0 0 "[ . 1 . 2]" 1
1479 1 53 GLU HG3 1 54 VAL H . . 5.350 4.034 3.749 4.611 . 0 0 "[ . 1 . 2]" 1
1480 1 53 GLU HG3 1 57 GLN HE21 . . 3.920 2.445 1.975 3.195 . 0 0 "[ . 1 . 2]" 1
1481 1 53 GLU HG3 1 57 GLN HE22 . . 4.360 2.992 2.749 3.613 . 0 0 "[ . 1 . 2]" 1
1482 1 53 GLU HG3 1 109 VAL MG1 . . 4.190 2.127 1.838 2.953 . 0 0 "[ . 1 . 2]" 1
1483 1 53 GLU HG3 1 109 VAL MG2 . . 4.240 2.811 2.194 3.669 . 0 0 "[ . 1 . 2]" 1
1484 1 54 VAL H 1 54 VAL HB . . 3.060 2.416 2.354 2.486 . 0 0 "[ . 1 . 2]" 1
1485 1 54 VAL H 1 54 VAL MG1 . . 3.890 3.745 3.694 3.778 . 0 0 "[ . 1 . 2]" 1
1486 1 54 VAL H 1 54 VAL MG2 . . 3.040 2.631 2.447 2.877 . 0 0 "[ . 1 . 2]" 1
1487 1 54 VAL H 1 55 LYS H . . 3.300 2.370 2.289 2.446 . 0 0 "[ . 1 . 2]" 1
1488 1 54 VAL H 1 56 GLU H . . 4.550 3.666 3.478 3.870 . 0 0 "[ . 1 . 2]" 1
1489 1 54 VAL H 1 56 GLU QG . . 5.500 4.211 3.940 4.502 . 0 0 "[ . 1 . 2]" 1
1490 1 54 VAL H 1 57 GLN H . . 5.180 4.628 4.484 4.771 . 0 0 "[ . 1 . 2]" 1
1491 1 54 VAL H 1 64 LEU MD1 . . 4.470 4.186 3.931 4.379 . 0 0 "[ . 1 . 2]" 1
1492 1 54 VAL H 1 64 LEU MD2 . . 4.830 4.510 4.309 4.700 . 0 0 "[ . 1 . 2]" 1
1493 1 54 VAL H 1 109 VAL MG2 . . 4.070 3.196 2.928 3.478 . 0 0 "[ . 1 . 2]" 1
1494 1 54 VAL H 1 112 ALA MB . . 5.500 5.254 5.072 5.500 . 0 0 "[ . 1 . 2]" 1
1495 1 54 VAL HA 1 54 VAL MG1 . . 3.250 2.468 2.385 2.509 . 0 0 "[ . 1 . 2]" 1
1496 1 54 VAL HA 1 54 VAL MG2 . . 3.220 2.261 2.153 2.389 . 0 0 "[ . 1 . 2]" 1
1497 1 54 VAL HA 1 55 LYS HA . . 5.110 4.744 4.717 4.781 . 0 0 "[ . 1 . 2]" 1
1498 1 54 VAL HA 1 56 GLU H . . 4.850 4.098 3.843 4.377 . 0 0 "[ . 1 . 2]" 1
1499 1 54 VAL HA 1 57 GLN H . . 3.800 3.446 3.320 3.555 . 0 0 "[ . 1 . 2]" 1
1500 1 54 VAL HA 1 57 GLN HB2 . . 3.700 2.928 2.573 3.295 . 0 0 "[ . 1 . 2]" 1
1501 1 54 VAL HA 1 57 GLN HB3 . . 5.140 4.594 4.116 5.024 . 0 0 "[ . 1 . 2]" 1
1502 1 54 VAL HA 1 57 GLN QG . . 4.170 4.093 3.928 4.174 0.004 3 0 "[ . 1 . 2]" 1
1503 1 54 VAL HA 1 58 THR H . . 4.110 3.695 3.465 3.915 . 0 0 "[ . 1 . 2]" 1
1504 1 54 VAL HA 1 58 THR HG1 . . 4.290 4.243 3.994 4.297 0.007 19 0 "[ . 1 . 2]" 1
1505 1 54 VAL HA 1 58 THR MG . . 3.590 3.033 2.845 3.186 . 0 0 "[ . 1 . 2]" 1
1506 1 54 VAL HA 1 64 LEU MD1 . . 5.010 4.589 4.364 4.733 . 0 0 "[ . 1 . 2]" 1
1507 1 54 VAL HA 1 109 VAL MG1 . . 3.400 2.637 2.401 2.919 . 0 0 "[ . 1 . 2]" 1
1508 1 54 VAL HA 1 113 LEU QD . . 4.610 3.801 3.177 4.242 . 0 0 "[ . 1 . 2]" 1
1509 1 54 VAL HA 1 113 LEU HG . . 5.410 4.409 4.198 4.650 . 0 0 "[ . 1 . 2]" 1
1510 1 54 VAL HB 1 55 LYS H . . 3.910 2.642 2.517 2.752 . 0 0 "[ . 1 . 2]" 1
1511 1 54 VAL HB 1 64 LEU H . . 5.500 5.262 4.809 5.503 0.003 5 0 "[ . 1 . 2]" 1
1512 1 54 VAL HB 1 64 LEU MD1 . . 3.560 2.261 2.075 2.417 . 0 0 "[ . 1 . 2]" 1
1513 1 54 VAL HB 1 64 LEU MD2 . . 4.190 3.436 3.175 3.682 . 0 0 "[ . 1 . 2]" 1
1514 1 54 VAL HB 1 112 ALA MB . . 4.150 3.944 3.757 4.140 . 0 0 "[ . 1 . 2]" 1
1515 1 54 VAL MG1 1 55 LYS H . . 3.800 3.287 3.051 3.493 . 0 0 "[ . 1 . 2]" 1
1516 1 54 VAL MG1 1 55 LYS HA . . 4.030 3.270 3.089 3.520 . 0 0 "[ . 1 . 2]" 1
1517 1 54 VAL MG1 1 58 THR H . . 4.170 3.713 3.306 3.860 . 0 0 "[ . 1 . 2]" 1
1518 1 54 VAL MG1 1 58 THR HB . . 4.390 4.009 3.922 4.128 . 0 0 "[ . 1 . 2]" 1
1519 1 54 VAL MG1 1 58 THR HG1 . . 3.190 2.869 2.239 3.115 . 0 0 "[ . 1 . 2]" 1
1520 1 54 VAL MG1 1 62 VAL H . . 4.060 3.675 3.420 3.903 . 0 0 "[ . 1 . 2]" 1
1521 1 54 VAL MG1 1 62 VAL HB . . 3.140 2.108 1.914 2.309 . 0 0 "[ . 1 . 2]" 1
1522 1 54 VAL MG1 1 62 VAL MG2 . . 3.460 3.227 3.015 3.477 0.017 16 0 "[ . 1 . 2]" 1
1523 1 54 VAL MG1 1 64 LEU MD1 . . 3.010 2.076 1.878 2.192 . 0 0 "[ . 1 . 2]" 1
1524 1 54 VAL MG1 1 64 LEU MD2 . . 4.310 3.720 3.528 3.891 . 0 0 "[ . 1 . 2]" 1
1525 1 54 VAL MG1 1 64 LEU HG . . 4.540 4.428 4.239 4.548 0.008 5 0 "[ . 1 . 2]" 1
1526 1 54 VAL MG1 1 112 ALA MB . . 3.170 1.877 1.705 2.127 . 0 0 "[ . 1 . 2]" 1
1527 1 54 VAL MG2 1 55 LYS H . . 4.120 3.931 3.873 3.997 . 0 0 "[ . 1 . 2]" 1
1528 1 54 VAL MG2 1 56 GLU H . . 5.330 5.201 5.045 5.367 0.037 19 0 "[ . 1 . 2]" 1
1529 1 54 VAL MG2 1 57 GLN H . . 5.260 5.143 5.027 5.238 . 0 0 "[ . 1 . 2]" 1
1530 1 54 VAL MG2 1 58 THR H . . 5.420 5.285 5.120 5.414 . 0 0 "[ . 1 . 2]" 1
1531 1 54 VAL MG2 1 64 LEU MD1 . . 3.230 2.355 2.063 2.541 . 0 0 "[ . 1 . 2]" 1
1532 1 54 VAL MG2 1 64 LEU MD2 . . 3.590 2.513 2.082 2.817 . 0 0 "[ . 1 . 2]" 1
1533 1 54 VAL MG2 1 109 VAL H . . 4.500 3.976 3.689 4.091 . 0 0 "[ . 1 . 2]" 1
1534 1 54 VAL MG2 1 109 VAL HA . . 3.400 2.005 1.847 2.122 . 0 0 "[ . 1 . 2]" 1
1535 1 54 VAL MG2 1 109 VAL HB . . 3.930 3.755 3.525 3.927 . 0 0 "[ . 1 . 2]" 1
1536 1 54 VAL MG2 1 109 VAL MG2 . . 3.140 1.888 1.754 2.169 . 0 0 "[ . 1 . 2]" 1
1537 1 54 VAL MG2 1 112 ALA H . . 4.090 3.928 3.728 4.100 0.010 5 0 "[ . 1 . 2]" 1
1538 1 54 VAL MG2 1 112 ALA HA . . 5.060 4.541 4.249 4.869 . 0 0 "[ . 1 . 2]" 1
1539 1 54 VAL MG2 1 112 ALA MB . . 2.870 2.019 1.861 2.165 . 0 0 "[ . 1 . 2]" 1
1540 1 55 LYS H 1 55 LYS QB . . 2.760 2.261 2.113 2.378 . 0 0 "[ . 1 . 2]" 1
1541 1 55 LYS H 1 55 LYS QD . . 4.300 4.070 3.886 4.430 0.130 9 0 "[ . 1 . 2]" 1
1542 1 55 LYS H 1 55 LYS HG2 . . 4.750 2.897 2.499 4.081 . 0 0 "[ . 1 . 2]" 1
1543 1 55 LYS H 1 55 LYS QG . . 3.900 2.801 2.437 3.811 . 0 0 "[ . 1 . 2]" 1
1544 1 55 LYS H 1 55 LYS HG3 . . 4.750 3.823 3.379 4.588 . 0 0 "[ . 1 . 2]" 1
1545 1 55 LYS H 1 56 GLU H . . 3.230 2.524 2.451 2.629 . 0 0 "[ . 1 . 2]" 1
1546 1 55 LYS H 1 56 GLU QB . . 4.570 4.458 4.292 4.587 0.017 9 0 "[ . 1 . 2]" 1
1547 1 55 LYS H 1 56 GLU QG . . 4.630 4.364 4.185 4.573 . 0 0 "[ . 1 . 2]" 1
1548 1 55 LYS H 1 57 GLN H . . 4.260 4.069 3.968 4.259 . 0 0 "[ . 1 . 2]" 1
1549 1 55 LYS H 1 58 THR HG1 . . 4.980 4.154 4.036 4.304 . 0 0 "[ . 1 . 2]" 1
1550 1 55 LYS H 1 64 LEU MD1 . . 4.920 4.229 4.004 4.410 . 0 0 "[ . 1 . 2]" 1
1551 1 55 LYS HA 1 55 LYS HD2 . . 5.500 4.593 4.509 5.041 . 0 0 "[ . 1 . 2]" 1
1552 1 55 LYS HA 1 55 LYS QD . . 4.680 4.225 4.138 4.386 . 0 0 "[ . 1 . 2]" 1
1553 1 55 LYS HA 1 55 LYS HD3 . . 5.500 4.969 4.515 5.485 . 0 0 "[ . 1 . 2]" 1
1554 1 55 LYS HA 1 55 LYS QG . . 3.640 3.195 2.783 3.316 . 0 0 "[ . 1 . 2]" 1
1555 1 55 LYS HA 1 58 THR H . . 3.930 3.569 3.380 3.862 . 0 0 "[ . 1 . 2]" 1
1556 1 55 LYS HA 1 58 THR HG1 . . 3.880 2.173 1.993 2.577 . 0 0 "[ . 1 . 2]" 1
1557 1 55 LYS HA 1 60 GLY H . . 3.230 2.581 2.288 2.877 . 0 0 "[ . 1 . 2]" 1
1558 1 55 LYS HA 1 62 VAL H . . 4.790 4.299 3.847 4.616 . 0 0 "[ . 1 . 2]" 1
1559 1 55 LYS QB 1 55 LYS HD2 . . 3.410 2.345 2.171 3.204 . 0 0 "[ . 1 . 2]" 1
1560 1 55 LYS QB 1 55 LYS HD3 . . 3.410 2.553 2.196 3.227 . 0 0 "[ . 1 . 2]" 1
1561 1 55 LYS QB 1 55 LYS QE . . 3.750 3.353 2.342 3.641 . 0 0 "[ . 1 . 2]" 1
1562 1 55 LYS QB 1 56 GLU H . . 3.660 3.450 2.850 3.668 0.008 2 0 "[ . 1 . 2]" 1
1563 1 55 LYS QB 1 57 GLN H . . 5.500 5.074 4.804 5.338 . 0 0 "[ . 1 . 2]" 1
1564 1 55 LYS QB 1 60 GLY H . . 4.470 3.679 3.183 4.205 . 0 0 "[ . 1 . 2]" 1
1565 1 55 LYS QB 1 60 GLY HA2 . . 4.120 2.404 1.982 3.394 . 0 0 "[ . 1 . 2]" 1
1566 1 55 LYS QD 1 60 GLY HA2 . . 4.120 4.003 3.746 4.133 0.013 18 0 "[ . 1 . 2]" 1
1567 1 55 LYS HD2 1 56 GLU H . . 5.500 5.319 5.037 5.538 0.038 19 0 "[ . 1 . 2]" 1
1568 1 55 LYS HD3 1 56 GLU H . . 5.500 4.995 4.513 5.297 . 0 0 "[ . 1 . 2]" 1
1569 1 55 LYS QE 1 55 LYS HG2 . . 3.490 2.605 2.165 3.230 . 0 0 "[ . 1 . 2]" 1
1570 1 55 LYS QE 1 55 LYS HG3 . . 3.490 2.358 2.119 3.209 . 0 0 "[ . 1 . 2]" 1
1571 1 55 LYS QE 1 56 GLU HA . . 4.540 4.352 3.887 4.546 0.006 5 0 "[ . 1 . 2]" 1
1572 1 55 LYS QG 1 56 GLU H . . 3.980 2.648 2.324 3.073 . 0 0 "[ . 1 . 2]" 1
1573 1 55 LYS QG 1 56 GLU HA . . 3.790 3.079 2.987 3.191 . 0 0 "[ . 1 . 2]" 1
1574 1 55 LYS QG 1 60 GLY H . . 4.470 4.078 3.024 4.423 . 0 0 "[ . 1 . 2]" 1
1575 1 55 LYS QG 1 60 GLY HA2 . . 4.040 3.595 2.308 4.031 . 0 0 "[ . 1 . 2]" 1
1576 1 55 LYS HG2 1 56 GLU H . . 4.590 2.862 2.540 3.137 . 0 0 "[ . 1 . 2]" 1
1577 1 55 LYS HG2 1 56 GLU HA . . 4.570 4.062 3.051 4.576 0.006 18 0 "[ . 1 . 2]" 1
1578 1 55 LYS HG3 1 56 GLU H . . 4.590 3.242 2.648 4.417 . 0 0 "[ . 1 . 2]" 1
1579 1 55 LYS HG3 1 56 GLU HA . . 4.570 3.415 3.058 4.464 . 0 0 "[ . 1 . 2]" 1
1580 1 56 GLU H 1 56 GLU QB . . 2.740 2.367 2.278 2.508 . 0 0 "[ . 1 . 2]" 1
1581 1 56 GLU H 1 56 GLU QG . . 3.330 2.494 2.325 2.664 . 0 0 "[ . 1 . 2]" 1
1582 1 56 GLU H 1 57 GLN H . . 3.180 2.389 2.257 2.537 . 0 0 "[ . 1 . 2]" 1
1583 1 56 GLU H 1 57 GLN QG . . 4.500 4.303 4.110 4.505 0.005 19 0 "[ . 1 . 2]" 1
1584 1 56 GLU H 1 58 THR H . . 4.330 3.888 3.629 4.342 0.012 5 0 "[ . 1 . 2]" 1
1585 1 56 GLU H 1 58 THR MG . . 5.410 5.039 4.790 5.311 . 0 0 "[ . 1 . 2]" 1
1586 1 56 GLU HA 1 56 GLU QG . . 3.520 3.308 3.270 3.444 . 0 0 "[ . 1 . 2]" 1
1587 1 56 GLU HA 1 59 LYS H . . 5.120 4.025 3.517 4.361 . 0 0 "[ . 1 . 2]" 1
1588 1 56 GLU QB 1 57 GLN H . . 3.870 3.492 3.354 3.590 . 0 0 "[ . 1 . 2]" 1
1589 1 56 GLU QG 1 57 GLN H . . 3.760 2.285 1.975 2.508 . 0 0 "[ . 1 . 2]" 1
1590 1 56 GLU QG 1 57 GLN HA . . 4.340 3.182 3.003 3.694 . 0 0 "[ . 1 . 2]" 1
1591 1 56 GLU QG 1 57 GLN HE21 . . 4.540 3.919 3.689 4.326 . 0 0 "[ . 1 . 2]" 1
1592 1 57 GLN H 1 57 GLN HB2 . . 3.190 2.366 2.277 2.470 . 0 0 "[ . 1 . 2]" 1
1593 1 57 GLN H 1 57 GLN HE21 . . 4.470 3.848 3.687 3.918 . 0 0 "[ . 1 . 2]" 1
1594 1 57 GLN H 1 57 GLN HE22 . . 5.500 5.475 5.342 5.512 0.012 9 0 "[ . 1 . 2]" 1
1595 1 57 GLN H 1 57 GLN QG . . 3.040 2.674 2.503 2.765 . 0 0 "[ . 1 . 2]" 1
1596 1 57 GLN H 1 58 THR H . . 3.270 2.323 2.173 2.550 . 0 0 "[ . 1 . 2]" 1
1597 1 57 GLN H 1 58 THR HG1 . . 4.450 3.896 3.634 4.248 . 0 0 "[ . 1 . 2]" 1
1598 1 57 GLN H 1 58 THR MG . . 4.160 3.869 3.615 4.051 . 0 0 "[ . 1 . 2]" 1
1599 1 57 GLN H 1 59 LYS H . . 4.150 3.737 3.500 3.945 . 0 0 "[ . 1 . 2]" 1
1600 1 57 GLN H 1 113 LEU QD . . 4.480 4.274 3.935 4.477 . 0 0 "[ . 1 . 2]" 1
1601 1 57 GLN HA 1 57 GLN HE21 . . 5.500 4.783 4.643 4.935 . 0 0 "[ . 1 . 2]" 1
1602 1 57 GLN HA 1 57 GLN QG . . 3.050 2.339 2.278 2.406 . 0 0 "[ . 1 . 2]" 1
1603 1 57 GLN HA 1 59 LYS H . . 4.620 3.619 3.476 3.895 . 0 0 "[ . 1 . 2]" 1
1604 1 57 GLN HA 1 113 LEU QD . . 4.610 3.893 3.764 4.014 . 0 0 "[ . 1 . 2]" 1
1605 1 57 GLN HB2 1 58 THR H . . 3.760 2.721 2.397 3.009 . 0 0 "[ . 1 . 2]" 1
1606 1 57 GLN HB2 1 58 THR MG . . 3.690 3.042 2.801 3.259 . 0 0 "[ . 1 . 2]" 1
1607 1 57 GLN HB2 1 113 LEU QD . . 3.890 2.423 1.961 2.846 . 0 0 "[ . 1 . 2]" 1
1608 1 57 GLN HB3 1 57 GLN HE21 . . 4.550 3.255 2.869 3.503 . 0 0 "[ . 1 . 2]" 1
1609 1 57 GLN HB3 1 58 THR H . . 3.790 3.589 3.133 3.794 0.004 11 0 "[ . 1 . 2]" 1
1610 1 57 GLN HB3 1 113 LEU HA . . 5.500 5.070 4.702 5.505 0.005 16 0 "[ . 1 . 2]" 1
1611 1 57 GLN HB3 1 113 LEU MD1 . . 3.940 3.330 2.956 3.734 . 0 0 "[ . 1 . 2]" 1
1612 1 57 GLN HB3 1 113 LEU QD . . 3.100 1.925 1.818 2.034 . 0 0 "[ . 1 . 2]" 1
1613 1 57 GLN HB3 1 113 LEU MD2 . . 3.940 1.939 1.824 2.054 . 0 0 "[ . 1 . 2]" 1
1614 1 57 GLN HE21 1 58 THR MG . . 4.810 4.318 4.000 4.607 . 0 0 "[ . 1 . 2]" 1
1615 1 57 GLN HE21 1 109 VAL MG1 . . 3.990 2.058 1.829 2.198 . 0 0 "[ . 1 . 2]" 1
1616 1 57 GLN HE21 1 109 VAL MG2 . . 5.020 3.796 3.576 4.024 . 0 0 "[ . 1 . 2]" 1
1617 1 57 GLN HE21 1 113 LEU QD . . 4.600 2.745 2.181 3.276 . 0 0 "[ . 1 . 2]" 1
1618 1 57 GLN HE21 1 113 LEU HG . . 3.890 3.558 3.288 3.871 . 0 0 "[ . 1 . 2]" 1
1619 1 57 GLN HE22 1 57 GLN QG . . 3.740 3.383 3.338 3.431 . 0 0 "[ . 1 . 2]" 1
1620 1 57 GLN HE22 1 109 VAL MG1 . . 3.880 1.799 1.726 1.902 . 0 0 "[ . 1 . 2]" 1
1621 1 57 GLN HE22 1 109 VAL MG2 . . 5.060 4.064 3.911 4.308 . 0 0 "[ . 1 . 2]" 1
1622 1 57 GLN HE22 1 110 SER HA . . 4.690 4.527 4.171 4.691 0.001 8 0 "[ . 1 . 2]" 1
1623 1 57 GLN HE22 1 113 LEU MD1 . . 5.000 2.246 1.889 2.658 . 0 0 "[ . 1 . 2]" 1
1624 1 57 GLN HE22 1 113 LEU QD . . 4.400 2.205 1.855 2.618 . 0 0 "[ . 1 . 2]" 1
1625 1 57 GLN HE22 1 113 LEU MD2 . . 5.000 3.365 2.589 3.969 . 0 0 "[ . 1 . 2]" 1
1626 1 57 GLN HE22 1 113 LEU HG . . 4.180 3.379 3.106 3.649 . 0 0 "[ . 1 . 2]" 1
1627 1 57 GLN QG 1 58 THR H . . 4.310 4.180 4.041 4.314 0.004 4 0 "[ . 1 . 2]" 1
1628 1 57 GLN QG 1 58 THR MG . . 4.840 4.682 4.533 4.842 0.002 20 0 "[ . 1 . 2]" 1
1629 1 57 GLN QG 1 113 LEU MD1 . . 3.910 3.832 3.659 3.906 . 0 0 "[ . 1 . 2]" 1
1630 1 57 GLN QG 1 113 LEU QD . . 3.340 3.182 2.975 3.357 0.017 16 0 "[ . 1 . 2]" 1
1631 1 57 GLN QG 1 113 LEU MD2 . . 3.910 3.413 3.093 3.663 . 0 0 "[ . 1 . 2]" 1
1632 1 58 THR H 1 58 THR HB . . 3.950 3.668 3.628 3.732 . 0 0 "[ . 1 . 2]" 1
1633 1 58 THR H 1 58 THR HG1 . . 3.010 2.128 1.973 2.398 . 0 0 "[ . 1 . 2]" 1
1634 1 58 THR H 1 58 THR MG . . 3.150 2.288 2.066 2.549 . 0 0 "[ . 1 . 2]" 1
1635 1 58 THR H 1 59 LYS H . . 2.930 2.635 2.336 2.838 . 0 0 "[ . 1 . 2]" 1
1636 1 58 THR H 1 59 LYS HA . . 5.000 4.747 4.491 4.873 . 0 0 "[ . 1 . 2]" 1
1637 1 58 THR H 1 59 LYS QG . . 5.340 5.100 4.788 5.361 0.021 16 0 "[ . 1 . 2]" 1
1638 1 58 THR H 1 60 GLY H . . 4.120 3.501 3.276 3.746 . 0 0 "[ . 1 . 2]" 1
1639 1 58 THR H 1 61 LYS H . . 5.120 4.737 4.415 5.123 0.003 12 0 "[ . 1 . 2]" 1
1640 1 58 THR H 1 62 VAL H . . 5.080 4.870 4.650 5.023 . 0 0 "[ . 1 . 2]" 1
1641 1 58 THR H 1 62 VAL MG2 . . 5.500 5.046 4.837 5.448 . 0 0 "[ . 1 . 2]" 1
1642 1 58 THR H 1 112 ALA MB . . 5.500 5.388 5.096 5.505 0.005 16 0 "[ . 1 . 2]" 1
1643 1 58 THR H 1 113 LEU QD . . 4.220 3.710 3.439 4.075 . 0 0 "[ . 1 . 2]" 1
1644 1 58 THR HA 1 58 THR MG . . 3.200 2.415 2.304 2.540 . 0 0 "[ . 1 . 2]" 1
1645 1 58 THR HA 1 59 LYS HB2 . . 4.990 4.176 4.066 4.312 . 0 0 "[ . 1 . 2]" 1
1646 1 58 THR HA 1 61 LYS QB . . 4.680 3.643 3.488 3.804 . 0 0 "[ . 1 . 2]" 1
1647 1 58 THR HA 1 113 LEU QD . . 4.550 3.659 3.347 4.045 . 0 0 "[ . 1 . 2]" 1
1648 1 58 THR HA 1 116 PHE QD . . 4.170 3.031 2.812 3.285 . 0 0 "[ . 1 . 2]" 1
1649 1 58 THR HA 1 116 PHE QE . . 3.900 2.988 2.810 3.257 . 0 0 "[ . 1 . 2]" 1
1650 1 58 THR HA 1 116 PHE HZ . . 4.260 3.429 3.145 3.735 . 0 0 "[ . 1 . 2]" 1
1651 1 58 THR HB 1 59 LYS H . . 4.710 4.441 4.344 4.499 . 0 0 "[ . 1 . 2]" 1
1652 1 58 THR HB 1 61 LYS H . . 3.470 3.202 2.799 3.471 0.001 5 0 "[ . 1 . 2]" 1
1653 1 58 THR HB 1 61 LYS HB2 . . 3.870 3.729 3.346 3.868 . 0 0 "[ . 1 . 2]" 1
1654 1 58 THR HB 1 61 LYS HB3 . . 3.870 2.053 1.987 2.192 . 0 0 "[ . 1 . 2]" 1
1655 1 58 THR HB 1 61 LYS QG . . 4.250 3.298 2.907 3.695 . 0 0 "[ . 1 . 2]" 1
1656 1 58 THR HB 1 62 VAL H . . 3.340 2.211 1.950 2.480 . 0 0 "[ . 1 . 2]" 1
1657 1 58 THR HB 1 62 VAL MG2 . . 3.910 2.326 2.019 2.648 . 0 0 "[ . 1 . 2]" 1
1658 1 58 THR HB 1 113 LEU QD . . 5.000 4.574 4.245 4.929 . 0 0 "[ . 1 . 2]" 1
1659 1 58 THR HB 1 116 PHE QD . . 4.150 2.133 1.997 2.301 . 0 0 "[ . 1 . 2]" 1
1660 1 58 THR HB 1 116 PHE QE . . 4.290 3.361 3.134 3.596 . 0 0 "[ . 1 . 2]" 1
1661 1 58 THR HG1 1 58 THR MG . . 3.050 2.398 2.090 2.522 . 0 0 "[ . 1 . 2]" 1
1662 1 58 THR HG1 1 59 LYS H . . 3.870 3.488 3.190 3.787 . 0 0 "[ . 1 . 2]" 1
1663 1 58 THR HG1 1 61 LYS QB . . 5.030 3.948 3.736 4.129 . 0 0 "[ . 1 . 2]" 1
1664 1 58 THR HG1 1 62 VAL H . . 3.370 3.096 2.816 3.334 . 0 0 "[ . 1 . 2]" 1
1665 1 58 THR HG1 1 62 VAL HB . . 4.360 3.649 3.052 4.003 . 0 0 "[ . 1 . 2]" 1
1666 1 58 THR HG1 1 62 VAL MG2 . . 4.440 4.049 3.680 4.326 . 0 0 "[ . 1 . 2]" 1
1667 1 58 THR HG1 1 112 ALA MB . . 5.360 5.087 4.551 5.346 . 0 0 "[ . 1 . 2]" 1
1668 1 58 THR HG1 1 113 LEU QD . . 5.150 4.866 4.615 5.128 . 0 0 "[ . 1 . 2]" 1
1669 1 58 THR MG 1 59 LYS H . . 4.300 4.171 4.059 4.270 . 0 0 "[ . 1 . 2]" 1
1670 1 58 THR MG 1 60 GLY H . . 4.660 4.449 4.275 4.669 0.009 16 0 "[ . 1 . 2]" 1
1671 1 58 THR MG 1 61 LYS H . . 4.730 4.399 4.023 4.719 . 0 0 "[ . 1 . 2]" 1
1672 1 58 THR MG 1 61 LYS QB . . 4.470 3.654 3.502 3.758 . 0 0 "[ . 1 . 2]" 1
1673 1 58 THR MG 1 61 LYS QG . . 5.160 4.123 3.608 4.589 . 0 0 "[ . 1 . 2]" 1
1674 1 58 THR MG 1 62 VAL H . . 3.200 2.996 2.798 3.188 . 0 0 "[ . 1 . 2]" 1
1675 1 58 THR MG 1 62 VAL HB . . 3.010 2.199 1.986 2.682 . 0 0 "[ . 1 . 2]" 1
1676 1 58 THR MG 1 62 VAL MG2 . . 2.790 2.076 1.867 2.426 . 0 0 "[ . 1 . 2]" 1
1677 1 58 THR MG 1 113 LEU HA . . 3.790 2.852 2.602 3.182 . 0 0 "[ . 1 . 2]" 1
1678 1 58 THR MG 1 113 LEU HG . . 4.470 3.695 3.300 4.346 . 0 0 "[ . 1 . 2]" 1
1679 1 58 THR MG 1 115 LEU H . . 5.500 5.366 5.171 5.507 0.007 5 0 "[ . 1 . 2]" 1
1680 1 58 THR MG 1 116 PHE H . . 3.890 3.833 3.599 3.905 0.015 19 0 "[ . 1 . 2]" 1
1681 1 58 THR MG 1 116 PHE HA . . 4.410 3.864 3.267 4.134 . 0 0 "[ . 1 . 2]" 1
1682 1 58 THR MG 1 116 PHE HB2 . . 3.960 1.935 1.775 2.032 . 0 0 "[ . 1 . 2]" 1
1683 1 58 THR MG 1 116 PHE QB . . 3.170 1.891 1.762 1.988 . 0 0 "[ . 1 . 2]" 1
1684 1 58 THR MG 1 116 PHE HB3 . . 3.960 2.736 2.354 3.355 . 0 0 "[ . 1 . 2]" 1
1685 1 58 THR MG 1 116 PHE QD . . 3.840 2.991 2.790 3.226 . 0 0 "[ . 1 . 2]" 1
1686 1 58 THR MG 1 116 PHE QE . . 4.800 4.122 3.871 4.399 . 0 0 "[ . 1 . 2]" 1
1687 1 58 THR MG 1 116 PHE HZ . . 5.500 5.149 4.842 5.501 0.001 6 0 "[ . 1 . 2]" 1
1688 1 58 THR MG 1 117 SER H . . 5.250 4.942 4.549 5.227 . 0 0 "[ . 1 . 2]" 1
1689 1 59 LYS H 1 59 LYS HA . . 2.680 2.277 2.274 2.284 . 0 0 "[ . 1 . 2]" 1
1690 1 59 LYS H 1 59 LYS HB2 . . 3.780 3.471 3.389 3.592 . 0 0 "[ . 1 . 2]" 1
1691 1 59 LYS H 1 59 LYS QD . . 3.640 3.200 2.404 3.632 . 0 0 "[ . 1 . 2]" 1
1692 1 59 LYS H 1 59 LYS QE . . 5.220 4.844 4.196 5.205 . 0 0 "[ . 1 . 2]" 1
1693 1 59 LYS H 1 59 LYS QG . . 3.600 2.849 2.562 3.285 . 0 0 "[ . 1 . 2]" 1
1694 1 59 LYS HA 1 59 LYS HD2 . . 4.050 2.972 2.066 4.039 . 0 0 "[ . 1 . 2]" 1
1695 1 59 LYS HA 1 59 LYS QD . . 3.550 2.560 2.053 3.347 . 0 0 "[ . 1 . 2]" 1
1696 1 59 LYS HA 1 59 LYS HD3 . . 4.050 3.309 2.161 4.072 0.022 16 0 "[ . 1 . 2]" 1
1697 1 59 LYS HA 1 59 LYS HG2 . . 3.870 3.085 2.750 3.617 . 0 0 "[ . 1 . 2]" 1
1698 1 59 LYS HA 1 59 LYS QG . . 3.270 2.594 2.222 2.899 . 0 0 "[ . 1 . 2]" 1
1699 1 59 LYS HA 1 59 LYS HG3 . . 3.870 3.254 2.247 3.806 . 0 0 "[ . 1 . 2]" 1
1700 1 59 LYS HB2 1 59 LYS QE . . 4.870 3.727 2.511 4.509 . 0 0 "[ . 1 . 2]" 1
1701 1 59 LYS HB2 1 60 GLY H . . 4.240 4.078 4.021 4.218 . 0 0 "[ . 1 . 2]" 1
1702 1 59 LYS HB3 1 59 LYS HD2 . . 4.180 3.009 2.218 4.203 0.023 3 0 "[ . 1 . 2]" 1
1703 1 59 LYS HB3 1 59 LYS QD . . 3.480 2.707 2.166 3.378 . 0 0 "[ . 1 . 2]" 1
1704 1 59 LYS HB3 1 59 LYS HD3 . . 4.180 3.369 2.809 3.687 . 0 0 "[ . 1 . 2]" 1
1705 1 59 LYS HB3 1 59 LYS QE . . 4.890 3.355 2.034 4.167 . 0 0 "[ . 1 . 2]" 1
1706 1 59 LYS QE 1 59 LYS QG . . 3.490 2.199 2.037 2.676 . 0 0 "[ . 1 . 2]" 1
1707 1 59 LYS QG 1 60 GLY H . . 5.340 4.650 4.522 4.763 . 0 0 "[ . 1 . 2]" 1
1708 1 60 GLY H 1 61 LYS H . . 3.230 2.536 2.380 2.743 . 0 0 "[ . 1 . 2]" 1
1709 1 60 GLY H 1 62 VAL H . . 4.650 4.373 3.913 4.581 . 0 0 "[ . 1 . 2]" 1
1710 1 60 GLY HA2 1 62 VAL H . . 5.330 4.671 4.170 5.007 . 0 0 "[ . 1 . 2]" 1
1711 1 61 LYS H 1 61 LYS HB2 . . 3.520 2.761 2.319 3.041 . 0 0 "[ . 1 . 2]" 1
1712 1 61 LYS H 1 61 LYS QB . . 2.770 2.218 2.182 2.265 . 0 0 "[ . 1 . 2]" 1
1713 1 61 LYS H 1 61 LYS HB3 . . 3.520 2.365 2.247 2.751 . 0 0 "[ . 1 . 2]" 1
1714 1 61 LYS H 1 61 LYS QD . . 5.040 4.318 4.129 4.467 . 0 0 "[ . 1 . 2]" 1
1715 1 61 LYS H 1 61 LYS QG . . 4.010 3.938 3.850 4.025 0.015 19 0 "[ . 1 . 2]" 1
1716 1 61 LYS H 1 62 VAL H . . 3.120 2.875 2.315 3.133 0.013 16 0 "[ . 1 . 2]" 1
1717 1 61 LYS H 1 62 VAL HB . . 5.470 5.226 4.718 5.481 0.011 16 0 "[ . 1 . 2]" 1
1718 1 61 LYS H 1 62 VAL MG2 . . 4.710 4.411 4.029 4.778 0.068 16 0 "[ . 1 . 2]" 1
1719 1 61 LYS H 1 120 ALA MB . . 4.580 4.565 4.447 4.598 0.018 19 0 "[ . 1 . 2]" 1
1720 1 61 LYS HA 1 61 LYS HD2 . . 3.910 2.992 2.003 3.840 . 0 0 "[ . 1 . 2]" 1
1721 1 61 LYS HA 1 61 LYS QD . . 3.380 2.187 1.988 2.450 . 0 0 "[ . 1 . 2]" 1
1722 1 61 LYS HA 1 61 LYS HD3 . . 3.910 2.531 2.008 3.336 . 0 0 "[ . 1 . 2]" 1
1723 1 61 LYS HA 1 61 LYS HE2 . . 5.120 4.382 3.056 5.042 . 0 0 "[ . 1 . 2]" 1
1724 1 61 LYS HA 1 61 LYS QE . . 4.400 3.912 3.003 4.407 0.007 6 0 "[ . 1 . 2]" 1
1725 1 61 LYS HA 1 61 LYS HE3 . . 5.120 4.520 3.324 5.060 . 0 0 "[ . 1 . 2]" 1
1726 1 61 LYS HA 1 61 LYS QG . . 3.620 3.097 2.781 3.243 . 0 0 "[ . 1 . 2]" 1
1727 1 61 LYS QB 1 62 VAL H . . 3.250 2.229 1.932 2.628 . 0 0 "[ . 1 . 2]" 1
1728 1 61 LYS QB 1 116 PHE QD . . 3.700 2.043 1.963 2.255 . 0 0 "[ . 1 . 2]" 1
1729 1 61 LYS QB 1 116 PHE HZ . . 4.670 4.501 4.289 4.675 0.005 3 0 "[ . 1 . 2]" 1
1730 1 61 LYS QB 1 120 ALA MB . . 4.280 2.379 2.133 2.596 . 0 0 "[ . 1 . 2]" 1
1731 1 61 LYS HB2 1 62 VAL H . . 3.980 3.705 3.434 4.000 0.020 8 0 "[ . 1 . 2]" 1
1732 1 61 LYS HB2 1 116 PHE QD . . 4.270 3.148 2.941 3.464 . 0 0 "[ . 1 . 2]" 1
1733 1 61 LYS HB2 1 116 PHE QE . . 3.770 2.712 2.434 3.066 . 0 0 "[ . 1 . 2]" 1
1734 1 61 LYS HB2 1 120 ALA MB . . 5.100 2.506 2.198 2.746 . 0 0 "[ . 1 . 2]" 1
1735 1 61 LYS HB3 1 62 VAL H . . 3.980 2.248 1.943 2.665 . 0 0 "[ . 1 . 2]" 1
1736 1 61 LYS HB3 1 116 PHE QD . . 4.270 2.070 1.994 2.287 . 0 0 "[ . 1 . 2]" 1
1737 1 61 LYS HB3 1 116 PHE QE . . 3.770 2.713 2.426 3.126 . 0 0 "[ . 1 . 2]" 1
1738 1 61 LYS HB3 1 120 ALA MB . . 5.100 2.992 2.727 3.199 . 0 0 "[ . 1 . 2]" 1
1739 1 61 LYS QD 1 116 PHE QE . . 5.340 4.591 3.893 5.189 . 0 0 "[ . 1 . 2]" 1
1740 1 61 LYS QE 1 61 LYS QG . . 3.490 2.199 2.066 2.365 . 0 0 "[ . 1 . 2]" 1
1741 1 61 LYS QG 1 62 VAL H . . 4.060 2.743 2.405 3.620 . 0 0 "[ . 1 . 2]" 1
1742 1 61 LYS QG 1 62 VAL HB . . 5.210 4.383 4.010 5.298 0.088 16 0 "[ . 1 . 2]" 1
1743 1 61 LYS QG 1 62 VAL MG1 . . 5.500 4.338 4.165 5.385 . 0 0 "[ . 1 . 2]" 1
1744 1 61 LYS QG 1 62 VAL MG2 . . 4.150 2.314 1.908 3.112 . 0 0 "[ . 1 . 2]" 1
1745 1 61 LYS QG 1 116 PHE QD . . 3.950 2.197 1.970 2.467 . 0 0 "[ . 1 . 2]" 1
1746 1 61 LYS QG 1 116 PHE QE . . 3.420 3.334 3.075 3.426 0.006 11 0 "[ . 1 . 2]" 1
1747 1 61 LYS QG 1 116 PHE HZ . . 5.500 5.428 5.166 5.505 0.005 19 0 "[ . 1 . 2]" 1
1748 1 62 VAL H 1 62 VAL HB . . 3.210 2.604 2.538 2.743 . 0 0 "[ . 1 . 2]" 1
1749 1 62 VAL H 1 62 VAL MG2 . . 3.280 2.115 1.866 2.399 . 0 0 "[ . 1 . 2]" 1
1750 1 62 VAL H 1 63 LYS H . . 4.530 4.341 4.211 4.464 . 0 0 "[ . 1 . 2]" 1
1751 1 62 VAL H 1 120 ALA MB . . 4.810 4.685 4.477 4.818 0.008 8 0 "[ . 1 . 2]" 1
1752 1 62 VAL HA 1 62 VAL MG1 . . 3.340 2.271 2.152 2.393 . 0 0 "[ . 1 . 2]" 1
1753 1 62 VAL HA 1 62 VAL MG2 . . 3.390 2.443 2.349 2.513 . 0 0 "[ . 1 . 2]" 1
1754 1 62 VAL HA 1 63 LYS H . . 2.870 2.157 2.139 2.180 . 0 0 "[ . 1 . 2]" 1
1755 1 62 VAL HA 1 63 LYS HB2 . . 4.870 4.627 4.427 4.867 . 0 0 "[ . 1 . 2]" 1
1756 1 62 VAL HB 1 63 LYS H . . 4.510 4.312 4.225 4.385 . 0 0 "[ . 1 . 2]" 1
1757 1 62 VAL HB 1 64 LEU MD1 . . 4.380 3.788 3.592 4.009 . 0 0 "[ . 1 . 2]" 1
1758 1 62 VAL MG1 1 63 LYS H . . 3.040 2.918 2.658 3.041 0.001 9 0 "[ . 1 . 2]" 1
1759 1 62 VAL MG1 1 64 LEU MD1 . . 3.360 2.518 2.359 2.791 . 0 0 "[ . 1 . 2]" 1
1760 1 62 VAL MG1 1 112 ALA H . . 5.270 4.780 4.513 4.982 . 0 0 "[ . 1 . 2]" 1
1761 1 62 VAL MG1 1 112 ALA HA . . 3.540 2.993 2.712 3.334 . 0 0 "[ . 1 . 2]" 1
1762 1 62 VAL MG1 1 112 ALA MB . . 3.090 2.107 1.887 2.340 . 0 0 "[ . 1 . 2]" 1
1763 1 62 VAL MG1 1 115 LEU H . . 5.500 5.327 5.020 5.503 0.003 5 0 "[ . 1 . 2]" 1
1764 1 62 VAL MG1 1 115 LEU QB . . 4.340 3.696 3.204 3.915 . 0 0 "[ . 1 . 2]" 1
1765 1 62 VAL MG1 1 115 LEU QD . . 4.020 3.265 2.756 3.580 . 0 0 "[ . 1 . 2]" 1
1766 1 62 VAL MG2 1 63 LYS H . . 4.390 4.228 4.087 4.306 . 0 0 "[ . 1 . 2]" 1
1767 1 62 VAL MG2 1 112 ALA HA . . 4.130 3.524 3.267 3.792 . 0 0 "[ . 1 . 2]" 1
1768 1 62 VAL MG2 1 112 ALA MB . . 3.600 2.993 2.734 3.294 . 0 0 "[ . 1 . 2]" 1
1769 1 62 VAL MG2 1 113 LEU HA . . 4.660 4.082 3.907 4.383 . 0 0 "[ . 1 . 2]" 1
1770 1 62 VAL MG2 1 115 LEU H . . 5.500 4.495 4.328 4.662 . 0 0 "[ . 1 . 2]" 1
1771 1 62 VAL MG2 1 116 PHE H . . 3.420 3.006 2.835 3.182 . 0 0 "[ . 1 . 2]" 1
1772 1 62 VAL MG2 1 116 PHE HA . . 3.710 2.652 2.176 2.938 . 0 0 "[ . 1 . 2]" 1
1773 1 62 VAL MG2 1 116 PHE HB2 . . 3.780 2.115 1.877 2.456 . 0 0 "[ . 1 . 2]" 1
1774 1 62 VAL MG2 1 116 PHE QB . . 3.170 2.096 1.865 2.426 . 0 0 "[ . 1 . 2]" 1
1775 1 62 VAL MG2 1 116 PHE HB3 . . 3.780 3.450 3.155 3.777 . 0 0 "[ . 1 . 2]" 1
1776 1 62 VAL MG2 1 116 PHE QD . . 3.910 2.681 2.332 3.045 . 0 0 "[ . 1 . 2]" 1
1777 1 62 VAL MG2 1 117 SER H . . 5.130 4.955 4.773 5.125 . 0 0 "[ . 1 . 2]" 1
1778 1 63 LYS H 1 63 LYS HB2 . . 3.510 2.495 2.279 2.692 . 0 0 "[ . 1 . 2]" 1
1779 1 63 LYS H 1 63 LYS HD2 . . 4.810 4.242 3.607 4.737 . 0 0 "[ . 1 . 2]" 1
1780 1 63 LYS H 1 63 LYS QE . . 5.310 5.067 4.859 5.280 . 0 0 "[ . 1 . 2]" 1
1781 1 63 LYS H 1 63 LYS HG2 . . 4.940 3.866 3.353 4.080 . 0 0 "[ . 1 . 2]" 1
1782 1 63 LYS H 1 63 LYS QG . . 4.300 2.532 2.075 2.879 . 0 0 "[ . 1 . 2]" 1
1783 1 63 LYS H 1 63 LYS HG3 . . 4.940 2.568 2.096 2.950 . 0 0 "[ . 1 . 2]" 1
1784 1 63 LYS H 1 64 LEU H . . 4.820 4.566 4.528 4.593 . 0 0 "[ . 1 . 2]" 1
1785 1 63 LYS HA 1 63 LYS HD2 . . 5.140 4.834 4.644 5.043 . 0 0 "[ . 1 . 2]" 1
1786 1 63 LYS HA 1 63 LYS HD3 . . 4.740 4.526 4.332 4.625 . 0 0 "[ . 1 . 2]" 1
1787 1 63 LYS HA 1 63 LYS QE . . 4.730 4.470 4.157 4.730 . 0 0 "[ . 1 . 2]" 1
1788 1 63 LYS HA 1 63 LYS QG . . 3.470 2.494 2.313 2.627 . 0 0 "[ . 1 . 2]" 1
1789 1 63 LYS HA 1 64 LEU H . . 2.800 2.294 2.193 2.366 . 0 0 "[ . 1 . 2]" 1
1790 1 63 LYS HA 1 64 LEU MD1 . . 4.060 3.170 3.031 3.372 . 0 0 "[ . 1 . 2]" 1
1791 1 63 LYS HB2 1 63 LYS HD2 . . 4.050 3.205 2.664 3.573 . 0 0 "[ . 1 . 2]" 1
1792 1 63 LYS HB2 1 63 LYS HD3 . . 4.080 2.315 2.115 2.861 . 0 0 "[ . 1 . 2]" 1
1793 1 63 LYS HB2 1 63 LYS QE . . 4.300 3.504 2.924 4.109 . 0 0 "[ . 1 . 2]" 1
1794 1 63 LYS HB2 1 64 LEU H . . 4.160 3.821 3.530 4.069 . 0 0 "[ . 1 . 2]" 1
1795 1 63 LYS HB3 1 64 LEU H . . 3.500 2.728 2.519 3.059 . 0 0 "[ . 1 . 2]" 1
1796 1 63 LYS QG 1 64 LEU H . . 4.790 3.951 3.576 4.198 . 0 0 "[ . 1 . 2]" 1
1797 1 64 LEU H 1 64 LEU HB2 . . 3.310 2.410 2.299 2.508 . 0 0 "[ . 1 . 2]" 1
1798 1 64 LEU H 1 64 LEU HB3 . . 3.680 3.568 3.518 3.611 . 0 0 "[ . 1 . 2]" 1
1799 1 64 LEU H 1 64 LEU MD1 . . 3.580 2.835 2.605 3.063 . 0 0 "[ . 1 . 2]" 1
1800 1 64 LEU H 1 64 LEU MD2 . . 4.540 4.422 4.291 4.513 . 0 0 "[ . 1 . 2]" 1
1801 1 64 LEU H 1 64 LEU HG . . 5.010 4.338 4.259 4.432 . 0 0 "[ . 1 . 2]" 1
1802 1 64 LEU H 1 65 ALA H . . 4.580 4.325 4.230 4.419 . 0 0 "[ . 1 . 2]" 1
1803 1 64 LEU HA 1 64 LEU MD1 . . 3.600 2.712 2.576 2.825 . 0 0 "[ . 1 . 2]" 1
1804 1 64 LEU HA 1 64 LEU MD2 . . 4.110 3.715 3.688 3.756 . 0 0 "[ . 1 . 2]" 1
1805 1 64 LEU HA 1 64 LEU HG . . 3.540 2.366 2.335 2.421 . 0 0 "[ . 1 . 2]" 1
1806 1 64 LEU HA 1 65 ALA H . . 2.960 2.146 2.139 2.166 . 0 0 "[ . 1 . 2]" 1
1807 1 64 LEU HA 1 65 ALA MB . . 4.220 3.956 3.905 4.002 . 0 0 "[ . 1 . 2]" 1
1808 1 64 LEU HB2 1 64 LEU MD1 . . 3.330 2.280 2.156 2.367 . 0 0 "[ . 1 . 2]" 1
1809 1 64 LEU HB2 1 64 LEU MD2 . . 3.180 2.502 2.396 2.569 . 0 0 "[ . 1 . 2]" 1
1810 1 64 LEU HB2 1 65 ALA H . . 5.300 4.414 4.331 4.467 . 0 0 "[ . 1 . 2]" 1
1811 1 64 LEU HB3 1 65 ALA H . . 3.910 3.431 3.258 3.549 . 0 0 "[ . 1 . 2]" 1
1812 1 64 LEU MD1 1 65 ALA H . . 4.590 4.540 4.430 4.593 0.003 13 0 "[ . 1 . 2]" 1
1813 1 64 LEU MD1 1 109 VAL HA . . 5.350 4.516 4.235 4.823 . 0 0 "[ . 1 . 2]" 1
1814 1 64 LEU MD1 1 112 ALA MB . . 3.650 2.935 2.628 3.151 . 0 0 "[ . 1 . 2]" 1
1815 1 64 LEU MD2 1 65 ALA H . . 4.770 4.721 4.560 4.773 0.003 17 0 "[ . 1 . 2]" 1
1816 1 64 LEU MD2 1 108 ILE MD . . 4.380 3.819 3.267 4.167 . 0 0 "[ . 1 . 2]" 1
1817 1 64 LEU MD2 1 108 ILE MG . . 3.130 2.113 1.904 2.376 . 0 0 "[ . 1 . 2]" 1
1818 1 64 LEU MD2 1 112 ALA MB . . 4.520 4.029 3.732 4.206 . 0 0 "[ . 1 . 2]" 1
1819 1 64 LEU HG 1 65 ALA H . . 4.350 3.899 3.806 3.971 . 0 0 "[ . 1 . 2]" 1
1820 1 65 ALA H 1 65 ALA MB . . 3.410 2.495 2.359 2.583 . 0 0 "[ . 1 . 2]" 1
1821 1 65 ALA H 1 66 ALA H . . 4.580 4.463 4.440 4.498 . 0 0 "[ . 1 . 2]" 1
1822 1 65 ALA HA 1 66 ALA H . . 3.040 2.418 2.300 2.532 . 0 0 "[ . 1 . 2]" 1
1823 1 65 ALA HA 1 66 ALA MB . . 4.310 3.871 3.834 3.916 . 0 0 "[ . 1 . 2]" 1
1824 1 65 ALA MB 1 66 ALA H . . 3.050 2.419 2.179 2.606 . 0 0 "[ . 1 . 2]" 1
1825 1 65 ALA MB 1 66 ALA MB . . 4.330 4.125 4.019 4.215 . 0 0 "[ . 1 . 2]" 1
1826 1 65 ALA MB 1 67 VAL MG2 . . 4.150 3.570 3.458 3.676 . 0 0 "[ . 1 . 2]" 1
1827 1 66 ALA H 1 66 ALA MB . . 3.220 2.520 2.371 2.618 . 0 0 "[ . 1 . 2]" 1
1828 1 66 ALA H 1 67 VAL H . . 4.990 4.455 4.377 4.508 . 0 0 "[ . 1 . 2]" 1
1829 1 66 ALA H 1 67 VAL MG2 . . 4.430 3.952 3.727 4.108 . 0 0 "[ . 1 . 2]" 1
1830 1 66 ALA HA 1 67 VAL H . . 2.880 2.326 2.218 2.462 . 0 0 "[ . 1 . 2]" 1
1831 1 66 ALA HA 1 67 VAL HB . . 4.760 4.519 4.396 4.594 . 0 0 "[ . 1 . 2]" 1
1832 1 66 ALA HA 1 67 VAL MG2 . . 4.220 3.448 3.282 3.640 . 0 0 "[ . 1 . 2]" 1
1833 1 66 ALA MB 1 67 VAL H . . 3.370 2.568 2.354 2.823 . 0 0 "[ . 1 . 2]" 1
1834 1 66 ALA MB 1 67 VAL HA . . 4.690 3.940 3.848 4.041 . 0 0 "[ . 1 . 2]" 1
1835 1 67 VAL H 1 67 VAL HB . . 3.430 2.838 2.725 2.954 . 0 0 "[ . 1 . 2]" 1
1836 1 67 VAL H 1 67 VAL MG1 . . 4.140 3.918 3.884 3.948 . 0 0 "[ . 1 . 2]" 1
1837 1 67 VAL H 1 67 VAL MG2 . . 3.700 2.997 2.855 3.212 . 0 0 "[ . 1 . 2]" 1
1838 1 67 VAL H 1 68 ASP H . . 5.300 4.337 4.116 4.447 . 0 0 "[ . 1 . 2]" 1
1839 1 67 VAL HA 1 67 VAL MG1 . . 3.590 2.389 2.294 2.453 . 0 0 "[ . 1 . 2]" 1
1840 1 67 VAL HA 1 67 VAL MG2 . . 3.420 2.347 2.265 2.452 . 0 0 "[ . 1 . 2]" 1
1841 1 67 VAL HA 1 68 ASP H . . 3.420 2.227 2.142 2.303 . 0 0 "[ . 1 . 2]" 1
1842 1 67 VAL HA 1 68 ASP HA . . 5.130 4.364 4.342 4.380 . 0 0 "[ . 1 . 2]" 1
1843 1 67 VAL HA 1 68 ASP QB . . 4.720 4.378 3.959 4.641 . 0 0 "[ . 1 . 2]" 1
1844 1 67 VAL HB 1 68 ASP H . . 5.010 3.946 3.734 4.258 . 0 0 "[ . 1 . 2]" 1
1845 1 67 VAL MG1 1 68 ASP H . . 3.890 2.147 1.900 2.507 . 0 0 "[ . 1 . 2]" 1
1846 1 67 VAL MG1 1 69 ALA H . . 4.290 3.821 3.617 4.020 . 0 0 "[ . 1 . 2]" 1
1847 1 67 VAL MG1 1 69 ALA HA . . 3.680 3.546 3.435 3.670 . 0 0 "[ . 1 . 2]" 1
1848 1 67 VAL MG1 1 69 ALA MB . . 4.830 4.229 4.099 4.424 . 0 0 "[ . 1 . 2]" 1
1849 1 67 VAL MG1 1 71 VAL H . . 4.910 4.687 4.510 4.815 . 0 0 "[ . 1 . 2]" 1
1850 1 67 VAL MG1 1 72 ASN HA . . 4.960 4.283 4.113 4.520 . 0 0 "[ . 1 . 2]" 1
1851 1 67 VAL MG1 1 72 ASN HB2 . . 3.550 2.225 2.027 2.485 . 0 0 "[ . 1 . 2]" 1
1852 1 67 VAL MG1 1 72 ASN HB3 . . 3.860 2.795 2.476 3.234 . 0 0 "[ . 1 . 2]" 1
1853 1 67 VAL MG1 1 72 ASN HD21 . . 3.940 2.588 2.294 2.904 . 0 0 "[ . 1 . 2]" 1
1854 1 67 VAL MG1 1 72 ASN HD22 . . 3.520 2.610 2.317 3.053 . 0 0 "[ . 1 . 2]" 1
1855 1 67 VAL MG1 1 75 LEU QB . . 4.270 3.592 3.275 3.856 . 0 0 "[ . 1 . 2]" 1
1856 1 67 VAL MG1 1 76 ALA MB . . 5.250 4.521 4.141 4.833 . 0 0 "[ . 1 . 2]" 1
1857 1 67 VAL MG2 1 68 ASP H . . 4.690 3.906 3.780 4.028 . 0 0 "[ . 1 . 2]" 1
1858 1 67 VAL MG2 1 75 LEU QD . . 4.160 2.926 2.796 3.016 . 0 0 "[ . 1 . 2]" 1
1859 1 67 VAL MG2 1 75 LEU HG . . 5.500 5.482 5.382 5.512 0.012 17 0 "[ . 1 . 2]" 1
1860 1 68 ASP H 1 68 ASP HB2 . . 4.040 2.731 2.422 3.604 . 0 0 "[ . 1 . 2]" 1
1861 1 68 ASP H 1 68 ASP HB3 . . 4.040 3.324 2.607 3.715 . 0 0 "[ . 1 . 2]" 1
1862 1 68 ASP H 1 71 VAL H . . 5.130 4.693 4.411 4.841 . 0 0 "[ . 1 . 2]" 1
1863 1 68 ASP H 1 71 VAL QG . . 4.710 4.231 3.007 4.721 0.011 6 0 "[ . 1 . 2]" 1
1864 1 68 ASP H 1 72 ASN HD21 . . 4.370 3.053 2.640 3.332 . 0 0 "[ . 1 . 2]" 1
1865 1 68 ASP H 1 72 ASN HD22 . . 3.900 3.645 2.799 3.873 . 0 0 "[ . 1 . 2]" 1
1866 1 68 ASP HA 1 69 ALA H . . 2.880 2.182 2.147 2.219 . 0 0 "[ . 1 . 2]" 1
1867 1 68 ASP HA 1 69 ALA MB . . 4.180 3.974 3.932 4.036 . 0 0 "[ . 1 . 2]" 1
1868 1 68 ASP HA 1 70 THR H . . 4.000 3.307 3.251 3.375 . 0 0 "[ . 1 . 2]" 1
1869 1 68 ASP HA 1 71 VAL H . . 4.830 4.416 4.099 4.520 . 0 0 "[ . 1 . 2]" 1
1870 1 68 ASP QB 1 69 ALA H . . 3.960 3.696 3.493 3.930 . 0 0 "[ . 1 . 2]" 1
1871 1 68 ASP QB 1 70 THR H . . 4.830 2.919 2.606 3.393 . 0 0 "[ . 1 . 2]" 1
1872 1 68 ASP QB 1 71 VAL H . . 4.710 2.726 2.296 3.048 . 0 0 "[ . 1 . 2]" 1
1873 1 68 ASP QB 1 71 VAL HB . . 4.170 2.896 2.393 3.728 . 0 0 "[ . 1 . 2]" 1
1874 1 68 ASP QB 1 71 VAL QG . . 3.220 2.472 1.846 2.935 . 0 0 "[ . 1 . 2]" 1
1875 1 68 ASP QB 1 72 ASN H . . 4.390 3.611 3.455 4.181 . 0 0 "[ . 1 . 2]" 1
1876 1 68 ASP QB 1 72 ASN HD21 . . 4.330 3.419 2.861 4.242 . 0 0 "[ . 1 . 2]" 1
1877 1 68 ASP QB 1 72 ASN HD22 . . 5.250 4.523 3.671 5.252 0.002 6 0 "[ . 1 . 2]" 1
1878 1 68 ASP HB2 1 72 ASN H . . 5.210 4.133 3.537 5.234 0.024 4 0 "[ . 1 . 2]" 1
1879 1 68 ASP HB2 1 72 ASN HD21 . . 5.010 3.794 2.899 4.854 . 0 0 "[ . 1 . 2]" 1
1880 1 68 ASP HB3 1 72 ASN H . . 5.210 4.447 3.618 5.254 0.044 6 0 "[ . 1 . 2]" 1
1881 1 68 ASP HB3 1 72 ASN HD21 . . 5.010 4.524 3.438 5.001 . 0 0 "[ . 1 . 2]" 1
1882 1 69 ALA H 1 69 ALA MB . . 3.080 2.088 2.024 2.233 . 0 0 "[ . 1 . 2]" 1
1883 1 69 ALA H 1 70 THR H . . 3.360 2.721 2.656 2.777 . 0 0 "[ . 1 . 2]" 1
1884 1 69 ALA H 1 70 THR MG . . 4.230 3.851 3.598 4.204 . 0 0 "[ . 1 . 2]" 1
1885 1 69 ALA H 1 71 VAL H . . 4.600 4.363 4.132 4.490 . 0 0 "[ . 1 . 2]" 1
1886 1 69 ALA H 1 72 ASN H . . 4.770 4.688 4.611 4.761 . 0 0 "[ . 1 . 2]" 1
1887 1 69 ALA H 1 72 ASN HB2 . . 5.290 4.553 4.299 4.767 . 0 0 "[ . 1 . 2]" 1
1888 1 69 ALA H 1 84 PHE QE . . 5.500 4.714 4.453 4.944 . 0 0 "[ . 1 . 2]" 1
1889 1 69 ALA H 1 84 PHE HZ . . 5.500 5.236 4.972 5.431 . 0 0 "[ . 1 . 2]" 1
1890 1 69 ALA HA 1 71 VAL H . . 4.360 3.905 3.676 4.034 . 0 0 "[ . 1 . 2]" 1
1891 1 69 ALA HA 1 72 ASN H . . 3.680 3.292 3.139 3.404 . 0 0 "[ . 1 . 2]" 1
1892 1 69 ALA HA 1 72 ASN HB2 . . 4.180 2.914 2.554 3.151 . 0 0 "[ . 1 . 2]" 1
1893 1 69 ALA HA 1 72 ASN HB3 . . 4.640 3.986 3.726 4.350 . 0 0 "[ . 1 . 2]" 1
1894 1 69 ALA MB 1 70 THR H . . 3.850 3.114 3.002 3.300 . 0 0 "[ . 1 . 2]" 1
1895 1 69 ALA MB 1 70 THR HA . . 4.100 3.894 3.849 3.955 . 0 0 "[ . 1 . 2]" 1
1896 1 69 ALA MB 1 70 THR MG . . 4.040 3.437 3.211 3.923 . 0 0 "[ . 1 . 2]" 1
1897 1 69 ALA MB 1 71 VAL H . . 4.740 4.574 4.455 4.699 . 0 0 "[ . 1 . 2]" 1
1898 1 69 ALA MB 1 72 ASN H . . 4.700 4.644 4.504 4.740 0.040 6 0 "[ . 1 . 2]" 1
1899 1 69 ALA MB 1 72 ASN HB2 . . 4.660 4.441 4.137 4.632 . 0 0 "[ . 1 . 2]" 1
1900 1 69 ALA MB 1 76 ALA HA . . 4.680 4.436 4.269 4.643 . 0 0 "[ . 1 . 2]" 1
1901 1 69 ALA MB 1 81 ILE HB . . 4.190 3.151 2.662 3.505 . 0 0 "[ . 1 . 2]" 1
1902 1 69 ALA MB 1 81 ILE MD . . 5.070 4.857 3.933 5.057 . 0 0 "[ . 1 . 2]" 1
1903 1 69 ALA MB 1 81 ILE MG . . 3.140 2.642 1.845 3.137 . 0 0 "[ . 1 . 2]" 1
1904 1 69 ALA MB 1 84 PHE QD . . 4.750 3.430 3.024 3.690 . 0 0 "[ . 1 . 2]" 1
1905 1 69 ALA MB 1 84 PHE QE . . 3.290 2.471 1.998 2.629 . 0 0 "[ . 1 . 2]" 1
1906 1 69 ALA MB 1 84 PHE HZ . . 3.490 2.207 2.054 2.583 . 0 0 "[ . 1 . 2]" 1
1907 1 70 THR H 1 70 THR MG . . 3.220 2.189 1.822 2.478 . 0 0 "[ . 1 . 2]" 1
1908 1 70 THR H 1 71 VAL H . . 3.150 2.418 2.264 2.569 . 0 0 "[ . 1 . 2]" 1
1909 1 70 THR H 1 71 VAL HB . . 5.250 4.781 4.515 5.005 . 0 0 "[ . 1 . 2]" 1
1910 1 70 THR H 1 71 VAL QG . . 4.130 3.886 3.568 4.088 . 0 0 "[ . 1 . 2]" 1
1911 1 70 THR H 1 72 ASN H . . 3.880 3.750 3.498 3.845 . 0 0 "[ . 1 . 2]" 1
1912 1 70 THR HA 1 70 THR MG . . 3.010 2.441 2.285 3.167 0.157 17 0 "[ . 1 . 2]" 1
1913 1 70 THR HA 1 72 ASN H . . 5.100 4.758 4.446 4.927 . 0 0 "[ . 1 . 2]" 1
1914 1 70 THR HA 1 73 GLN HE21 . . 4.560 3.840 3.673 4.094 . 0 0 "[ . 1 . 2]" 1
1915 1 70 THR HA 1 73 GLN QE . . 3.850 3.607 3.459 3.786 . 0 0 "[ . 1 . 2]" 1
1916 1 70 THR HA 1 73 GLN HE22 . . 4.560 4.381 4.187 4.540 . 0 0 "[ . 1 . 2]" 1
1917 1 70 THR HB 1 71 VAL H . . 4.730 4.015 3.855 4.321 . 0 0 "[ . 1 . 2]" 1
1918 1 70 THR HB 1 71 VAL QG . . 5.440 3.980 3.382 4.915 . 0 0 "[ . 1 . 2]" 1
1919 1 70 THR MG 1 71 VAL H . . 4.110 3.850 2.362 4.102 . 0 0 "[ . 1 . 2]" 1
1920 1 70 THR MG 1 84 PHE QE . . 3.890 3.537 3.231 3.893 0.003 14 0 "[ . 1 . 2]" 1
1921 1 70 THR MG 1 84 PHE HZ . . 4.970 4.729 4.445 4.946 . 0 0 "[ . 1 . 2]" 1
1922 1 71 VAL H 1 71 VAL HB . . 3.310 2.659 2.546 2.961 . 0 0 "[ . 1 . 2]" 1
1923 1 71 VAL H 1 71 VAL MG1 . . 3.920 3.402 1.987 3.868 . 0 0 "[ . 1 . 2]" 1
1924 1 71 VAL H 1 71 VAL QG . . 3.000 2.439 1.981 2.864 . 0 0 "[ . 1 . 2]" 1
1925 1 71 VAL H 1 71 VAL MG2 . . 3.920 2.910 2.430 3.886 . 0 0 "[ . 1 . 2]" 1
1926 1 71 VAL H 1 72 ASN H . . 2.900 2.010 1.859 2.080 . 0 0 "[ . 1 . 2]" 1
1927 1 71 VAL H 1 72 ASN HB2 . . 4.080 3.983 3.871 4.029 . 0 0 "[ . 1 . 2]" 1
1928 1 71 VAL H 1 72 ASN HB3 . . 5.500 5.463 5.345 5.506 0.006 11 0 "[ . 1 . 2]" 1
1929 1 71 VAL H 1 72 ASN HD21 . . 4.270 3.738 3.331 3.948 . 0 0 "[ . 1 . 2]" 1
1930 1 71 VAL HA 1 71 VAL MG1 . . 3.250 2.566 2.277 3.191 . 0 0 "[ . 1 . 2]" 1
1931 1 71 VAL HA 1 71 VAL MG2 . . 3.250 2.346 2.125 2.472 . 0 0 "[ . 1 . 2]" 1
1932 1 71 VAL HA 1 73 GLN H . . 5.500 5.322 5.209 5.436 . 0 0 "[ . 1 . 2]" 1
1933 1 71 VAL HA 1 73 GLN HG2 . . 4.620 4.220 3.947 4.354 . 0 0 "[ . 1 . 2]" 1
1934 1 71 VAL HA 1 73 GLN HG3 . . 5.410 5.178 4.911 5.423 0.013 17 0 "[ . 1 . 2]" 1
1935 1 71 VAL HB 1 72 ASN H . . 4.080 3.088 2.687 4.057 . 0 0 "[ . 1 . 2]" 1
1936 1 71 VAL HB 1 72 ASN HD21 . . 4.480 3.176 2.582 4.477 . 0 0 "[ . 1 . 2]" 1
1937 1 71 VAL QG 1 72 ASN H . . 3.570 3.005 1.884 3.430 . 0 0 "[ . 1 . 2]" 1
1938 1 71 VAL QG 1 72 ASN HA . . 4.600 3.500 3.048 3.797 . 0 0 "[ . 1 . 2]" 1
1939 1 71 VAL QG 1 72 ASN HD21 . . 3.600 2.907 1.733 3.530 . 0 0 "[ . 1 . 2]" 1
1940 1 71 VAL QG 1 72 ASN HD22 . . 4.690 3.445 2.509 3.959 . 0 0 "[ . 1 . 2]" 1
1941 1 71 VAL QG 1 73 GLN H . . 5.000 4.607 4.279 4.805 . 0 0 "[ . 1 . 2]" 1
1942 1 71 VAL MG1 1 72 ASN H . . 4.270 3.241 1.888 3.824 . 0 0 "[ . 1 . 2]" 1
1943 1 71 VAL MG1 1 72 ASN HD21 . . 4.460 3.002 1.736 3.776 . 0 0 "[ . 1 . 2]" 1
1944 1 71 VAL MG2 1 72 ASN H . . 4.270 3.880 3.763 4.021 . 0 0 "[ . 1 . 2]" 1
1945 1 71 VAL MG2 1 72 ASN HD21 . . 4.460 4.216 3.546 4.449 . 0 0 "[ . 1 . 2]" 1
1946 1 72 ASN H 1 72 ASN HB2 . . 3.040 2.242 2.189 2.311 . 0 0 "[ . 1 . 2]" 1
1947 1 72 ASN H 1 72 ASN HB3 . . 3.610 3.520 3.486 3.576 . 0 0 "[ . 1 . 2]" 1
1948 1 72 ASN H 1 73 GLN H . . 4.330 4.330 4.279 4.349 0.019 12 0 "[ . 1 . 2]" 1
1949 1 72 ASN H 1 76 ALA MB . . 5.500 4.763 4.383 4.915 . 0 0 "[ . 1 . 2]" 1
1950 1 72 ASN HA 1 73 GLN H . . 2.800 2.153 2.145 2.163 . 0 0 "[ . 1 . 2]" 1
1951 1 72 ASN HA 1 73 GLN HB2 . . 4.860 4.632 4.576 4.719 . 0 0 "[ . 1 . 2]" 1
1952 1 72 ASN HA 1 73 GLN HG2 . . 4.920 4.011 3.877 4.108 . 0 0 "[ . 1 . 2]" 1
1953 1 72 ASN HA 1 73 GLN HG3 . . 5.500 5.349 5.209 5.438 . 0 0 "[ . 1 . 2]" 1
1954 1 72 ASN HA 1 74 VAL H . . 3.970 3.698 3.510 3.809 . 0 0 "[ . 1 . 2]" 1
1955 1 72 ASN HA 1 75 LEU H . . 4.810 4.362 4.270 4.480 . 0 0 "[ . 1 . 2]" 1
1956 1 72 ASN HB2 1 73 GLN H . . 4.600 4.528 4.482 4.555 . 0 0 "[ . 1 . 2]" 1
1957 1 72 ASN HB2 1 75 LEU QD . . 4.800 3.819 3.438 4.066 . 0 0 "[ . 1 . 2]" 1
1958 1 72 ASN HB3 1 73 GLN H . . 4.100 3.733 3.670 3.788 . 0 0 "[ . 1 . 2]" 1
1959 1 72 ASN HB3 1 74 VAL H . . 4.870 4.484 3.960 4.729 . 0 0 "[ . 1 . 2]" 1
1960 1 72 ASN HB3 1 75 LEU QD . . 3.760 2.823 2.411 3.048 . 0 0 "[ . 1 . 2]" 1
1961 1 72 ASN HB3 1 76 ALA H . . 4.940 3.175 2.988 3.366 . 0 0 "[ . 1 . 2]" 1
1962 1 73 GLN H 1 73 GLN HB2 . . 3.130 2.537 2.489 2.589 . 0 0 "[ . 1 . 2]" 1
1963 1 73 GLN H 1 73 GLN HB3 . . 3.840 3.703 3.682 3.727 . 0 0 "[ . 1 . 2]" 1
1964 1 73 GLN H 1 73 GLN HG2 . . 3.200 2.783 2.615 2.879 . 0 0 "[ . 1 . 2]" 1
1965 1 73 GLN H 1 74 VAL H . . 3.230 2.054 1.976 2.102 . 0 0 "[ . 1 . 2]" 1
1966 1 73 GLN H 1 74 VAL HB . . 4.310 4.292 4.230 4.322 0.012 6 0 "[ . 1 . 2]" 1
1967 1 73 GLN H 1 74 VAL MG2 . . 4.210 3.401 3.323 3.461 . 0 0 "[ . 1 . 2]" 1
1968 1 73 GLN H 1 75 LEU H . . 4.430 3.793 3.648 3.936 . 0 0 "[ . 1 . 2]" 1
1969 1 73 GLN H 1 75 LEU QD . . 5.440 5.087 4.829 5.267 . 0 0 "[ . 1 . 2]" 1
1970 1 73 GLN H 1 76 ALA H . . 4.840 4.588 4.409 4.743 . 0 0 "[ . 1 . 2]" 1
1971 1 73 GLN H 1 76 ALA MB . . 4.690 4.368 4.285 4.452 . 0 0 "[ . 1 . 2]" 1
1972 1 73 GLN HA 1 73 GLN QE . . 4.840 3.279 2.847 3.707 . 0 0 "[ . 1 . 2]" 1
1973 1 73 GLN HA 1 73 GLN HG2 . . 3.350 2.773 2.726 2.826 . 0 0 "[ . 1 . 2]" 1
1974 1 73 GLN HA 1 73 GLN HG3 . . 4.010 3.791 3.765 3.830 . 0 0 "[ . 1 . 2]" 1
1975 1 73 GLN HA 1 74 VAL MG2 . . 4.900 4.900 4.881 4.920 0.020 12 0 "[ . 1 . 2]" 1
1976 1 73 GLN HA 1 76 ALA H . . 3.760 3.554 3.340 3.718 . 0 0 "[ . 1 . 2]" 1
1977 1 73 GLN HA 1 76 ALA MB . . 3.170 2.279 2.059 2.463 . 0 0 "[ . 1 . 2]" 1
1978 1 73 GLN HB2 1 74 VAL H . . 3.850 2.742 2.626 2.992 . 0 0 "[ . 1 . 2]" 1
1979 1 73 GLN HB2 1 74 VAL HA . . 5.470 4.253 4.193 4.303 . 0 0 "[ . 1 . 2]" 1
1980 1 73 GLN HB2 1 74 VAL MG2 . . 4.570 3.288 3.206 3.384 . 0 0 "[ . 1 . 2]" 1
1981 1 73 GLN HB3 1 74 VAL H . . 4.080 3.765 3.654 4.003 . 0 0 "[ . 1 . 2]" 1
1982 1 73 GLN HB3 1 74 VAL MG2 . . 4.780 4.400 4.281 4.546 . 0 0 "[ . 1 . 2]" 1
1983 1 73 GLN QE 1 73 GLN HG2 . . 3.410 2.122 2.098 2.214 . 0 0 "[ . 1 . 2]" 1
1984 1 73 GLN QE 1 76 ALA MB . . 4.410 3.852 3.378 4.206 . 0 0 "[ . 1 . 2]" 1
1985 1 73 GLN HE21 1 76 ALA MB . . 5.060 4.251 3.671 4.758 . 0 0 "[ . 1 . 2]" 1
1986 1 73 GLN HE22 1 76 ALA MB . . 5.060 4.420 3.927 4.733 . 0 0 "[ . 1 . 2]" 1
1987 1 73 GLN HG2 1 74 VAL H . . 4.800 4.353 4.272 4.416 . 0 0 "[ . 1 . 2]" 1
1988 1 73 GLN HG2 1 76 ALA MB . . 4.570 4.439 4.293 4.564 . 0 0 "[ . 1 . 2]" 1
1989 1 73 GLN HG3 1 74 VAL H . . 5.260 4.823 4.689 4.926 . 0 0 "[ . 1 . 2]" 1
1990 1 74 VAL H 1 74 VAL HB . . 3.020 2.615 2.510 2.663 . 0 0 "[ . 1 . 2]" 1
1991 1 74 VAL H 1 74 VAL MG1 . . 3.910 3.763 3.761 3.764 . 0 0 "[ . 1 . 2]" 1
1992 1 74 VAL H 1 74 VAL MG2 . . 3.030 1.931 1.870 2.129 . 0 0 "[ . 1 . 2]" 1
1993 1 74 VAL H 1 75 LEU H . . 3.210 2.767 2.598 2.876 . 0 0 "[ . 1 . 2]" 1
1994 1 74 VAL H 1 75 LEU MD1 . . 5.500 5.287 5.106 5.485 . 0 0 "[ . 1 . 2]" 1
1995 1 74 VAL H 1 75 LEU QD . . 4.780 4.623 4.446 4.755 . 0 0 "[ . 1 . 2]" 1
1996 1 74 VAL H 1 75 LEU MD2 . . 5.500 5.110 4.872 5.314 . 0 0 "[ . 1 . 2]" 1
1997 1 74 VAL H 1 75 LEU HG . . 5.500 4.247 3.996 4.413 . 0 0 "[ . 1 . 2]" 1
1998 1 74 VAL H 1 76 ALA H . . 4.550 4.399 4.222 4.513 . 0 0 "[ . 1 . 2]" 1
1999 1 74 VAL H 1 76 ALA MB . . 4.770 4.722 4.627 4.773 0.003 11 0 "[ . 1 . 2]" 1
2000 1 74 VAL HA 1 74 VAL MG1 . . 3.000 2.313 2.262 2.417 . 0 0 "[ . 1 . 2]" 1
2001 1 74 VAL HA 1 74 VAL MG2 . . 2.900 2.460 2.426 2.469 . 0 0 "[ . 1 . 2]" 1
2002 1 74 VAL HA 1 77 SER H . . 4.450 4.206 3.954 4.381 . 0 0 "[ . 1 . 2]" 1
2003 1 74 VAL HA 1 77 SER QB . . 3.850 3.458 3.095 3.707 . 0 0 "[ . 1 . 2]" 1
2004 1 74 VAL HB 1 75 LEU H . . 3.200 2.610 2.388 2.744 . 0 0 "[ . 1 . 2]" 1
2005 1 74 VAL MG1 1 75 LEU H . . 3.760 3.561 3.343 3.657 . 0 0 "[ . 1 . 2]" 1
2006 1 74 VAL MG1 1 75 LEU HA . . 4.180 3.694 3.516 3.776 . 0 0 "[ . 1 . 2]" 1
2007 1 74 VAL MG1 1 75 LEU QD . . 3.990 2.813 2.549 3.076 . 0 0 "[ . 1 . 2]" 1
2008 1 74 VAL MG1 1 77 SER QB . . 4.940 4.583 4.290 4.818 . 0 0 "[ . 1 . 2]" 1
2009 1 74 VAL MG2 1 75 LEU H . . 4.020 3.790 3.711 3.888 . 0 0 "[ . 1 . 2]" 1
2010 1 74 VAL MG2 1 77 SER QB . . 5.340 4.987 4.691 5.170 . 0 0 "[ . 1 . 2]" 1
2011 1 75 LEU H 1 75 LEU HB2 . . 4.150 2.652 2.551 2.749 . 0 0 "[ . 1 . 2]" 1
2012 1 75 LEU H 1 75 LEU HB3 . . 4.150 3.627 3.588 3.655 . 0 0 "[ . 1 . 2]" 1
2013 1 75 LEU H 1 75 LEU MD1 . . 3.680 3.538 3.408 3.669 . 0 0 "[ . 1 . 2]" 1
2014 1 75 LEU H 1 75 LEU MD2 . . 3.680 3.267 3.028 3.435 . 0 0 "[ . 1 . 2]" 1
2015 1 75 LEU H 1 75 LEU HG . . 3.870 2.122 1.928 2.294 . 0 0 "[ . 1 . 2]" 1
2016 1 75 LEU H 1 76 ALA H . . 3.470 2.518 2.387 2.662 . 0 0 "[ . 1 . 2]" 1
2017 1 75 LEU H 1 76 ALA MB . . 4.420 4.030 3.946 4.154 . 0 0 "[ . 1 . 2]" 1
2018 1 75 LEU H 1 77 SER H . . 4.690 3.869 3.642 4.024 . 0 0 "[ . 1 . 2]" 1
2019 1 75 LEU HA 1 75 LEU MD1 . . 4.000 3.954 3.901 4.004 0.004 18 0 "[ . 1 . 2]" 1
2020 1 75 LEU HA 1 75 LEU QD . . 3.000 2.250 2.023 2.483 . 0 0 "[ . 1 . 2]" 1
2021 1 75 LEU HA 1 75 LEU MD2 . . 4.000 2.264 2.030 2.508 . 0 0 "[ . 1 . 2]" 1
2022 1 75 LEU HA 1 75 LEU HG . . 4.140 3.236 3.153 3.322 . 0 0 "[ . 1 . 2]" 1
2023 1 75 LEU HA 1 78 ARG H . . 4.270 3.167 2.942 3.296 . 0 0 "[ . 1 . 2]" 1
2024 1 75 LEU HA 1 78 ARG HB2 . . 4.210 2.753 2.498 3.057 . 0 0 "[ . 1 . 2]" 1
2025 1 75 LEU HA 1 78 ARG HB3 . . 3.970 2.602 2.358 2.888 . 0 0 "[ . 1 . 2]" 1
2026 1 75 LEU HA 1 79 TYR H . . 4.680 4.109 3.637 4.372 . 0 0 "[ . 1 . 2]" 1
2027 1 75 LEU HA 1 79 TYR QD . . 4.490 3.590 2.915 3.868 . 0 0 "[ . 1 . 2]" 1
2028 1 75 LEU HA 1 79 TYR QE . . 4.710 3.187 2.762 3.659 . 0 0 "[ . 1 . 2]" 1
2029 1 75 LEU QB 1 76 ALA H . . 3.210 2.252 2.146 2.384 . 0 0 "[ . 1 . 2]" 1
2030 1 75 LEU QB 1 77 SER H . . 5.340 4.480 4.260 4.648 . 0 0 "[ . 1 . 2]" 1
2031 1 75 LEU QB 1 79 TYR H . . 5.180 4.641 4.287 4.789 . 0 0 "[ . 1 . 2]" 1
2032 1 75 LEU QB 1 79 TYR QD . . 4.300 3.203 2.608 3.522 . 0 0 "[ . 1 . 2]" 1
2033 1 75 LEU HB2 1 75 LEU MD1 . . 3.670 2.210 2.079 2.347 . 0 0 "[ . 1 . 2]" 1
2034 1 75 LEU HB2 1 75 LEU MD2 . . 3.670 3.181 3.160 3.193 . 0 0 "[ . 1 . 2]" 1
2035 1 75 LEU HB2 1 76 ALA H . . 3.770 2.276 2.168 2.412 . 0 0 "[ . 1 . 2]" 1
2036 1 75 LEU HB3 1 75 LEU MD1 . . 3.670 2.480 2.357 2.562 . 0 0 "[ . 1 . 2]" 1
2037 1 75 LEU HB3 1 75 LEU MD2 . . 3.670 2.283 2.132 2.405 . 0 0 "[ . 1 . 2]" 1
2038 1 75 LEU HB3 1 76 ALA H . . 3.770 3.583 3.413 3.755 . 0 0 "[ . 1 . 2]" 1
2039 1 75 LEU QD 1 76 ALA H . . 3.790 3.762 3.661 3.793 0.003 19 0 "[ . 1 . 2]" 1
2040 1 75 LEU QD 1 78 ARG H . . 5.330 4.790 4.636 4.967 . 0 0 "[ . 1 . 2]" 1
2041 1 75 LEU QD 1 78 ARG HB3 . . 4.600 3.904 3.644 4.191 . 0 0 "[ . 1 . 2]" 1
2042 1 75 LEU QD 1 78 ARG QD . . 4.170 3.188 2.755 3.934 . 0 0 "[ . 1 . 2]" 1
2043 1 75 LEU QD 1 79 TYR QD . . 4.430 4.153 3.636 4.410 . 0 0 "[ . 1 . 2]" 1
2044 1 75 LEU QD 1 79 TYR QE . . 3.330 2.809 2.236 3.263 . 0 0 "[ . 1 . 2]" 1
2045 1 75 LEU MD1 1 76 ALA H . . 4.740 4.009 3.846 4.074 . 0 0 "[ . 1 . 2]" 1
2046 1 75 LEU MD1 1 79 TYR QD . . 5.500 5.091 4.521 5.385 . 0 0 "[ . 1 . 2]" 1
2047 1 75 LEU MD2 1 76 ALA H . . 4.740 4.560 4.483 4.627 . 0 0 "[ . 1 . 2]" 1
2048 1 75 LEU MD2 1 79 TYR QD . . 5.500 4.410 3.797 4.724 . 0 0 "[ . 1 . 2]" 1
2049 1 75 LEU HG 1 76 ALA H . . 4.950 3.887 3.751 4.049 . 0 0 "[ . 1 . 2]" 1
2050 1 76 ALA H 1 76 ALA MB . . 2.900 2.187 2.108 2.229 . 0 0 "[ . 1 . 2]" 1
2051 1 76 ALA H 1 77 SER H . . 3.340 2.867 2.703 2.979 . 0 0 "[ . 1 . 2]" 1
2052 1 76 ALA H 1 78 ARG H . . 4.540 4.193 3.959 4.354 . 0 0 "[ . 1 . 2]" 1
2053 1 76 ALA HA 1 79 TYR H . . 5.010 4.006 3.681 4.211 . 0 0 "[ . 1 . 2]" 1
2054 1 76 ALA HA 1 79 TYR QD . . 5.010 3.887 3.488 4.304 . 0 0 "[ . 1 . 2]" 1
2055 1 76 ALA HA 1 81 ILE H . . 3.790 2.715 2.230 3.155 . 0 0 "[ . 1 . 2]" 1
2056 1 76 ALA HA 1 81 ILE HB . . 3.710 2.560 2.103 2.996 . 0 0 "[ . 1 . 2]" 1
2057 1 76 ALA HA 1 81 ILE MD . . 4.210 3.865 3.549 4.035 . 0 0 "[ . 1 . 2]" 1
2058 1 76 ALA HA 1 81 ILE HG12 . . 3.640 2.321 1.998 2.708 . 0 0 "[ . 1 . 2]" 1
2059 1 76 ALA HA 1 81 ILE HG13 . . 3.580 2.674 2.284 2.942 . 0 0 "[ . 1 . 2]" 1
2060 1 76 ALA MB 1 77 SER H . . 3.190 2.689 2.549 2.935 . 0 0 "[ . 1 . 2]" 1
2061 1 76 ALA MB 1 77 SER HB2 . . 5.420 4.037 3.864 4.261 . 0 0 "[ . 1 . 2]" 1
2062 1 76 ALA MB 1 77 SER QB . . 4.690 3.845 3.711 4.101 . 0 0 "[ . 1 . 2]" 1
2063 1 76 ALA MB 1 77 SER HB3 . . 5.420 4.862 4.494 5.342 . 0 0 "[ . 1 . 2]" 1
2064 1 76 ALA MB 1 78 ARG H . . 4.760 4.519 4.285 4.694 . 0 0 "[ . 1 . 2]" 1
2065 1 76 ALA MB 1 79 TYR H . . 5.150 5.014 4.809 5.126 . 0 0 "[ . 1 . 2]" 1
2066 1 76 ALA MB 1 80 GLY H . . 4.930 4.444 4.308 4.562 . 0 0 "[ . 1 . 2]" 1
2067 1 76 ALA MB 1 81 ILE H . . 3.840 3.058 2.618 3.448 . 0 0 "[ . 1 . 2]" 1
2068 1 76 ALA MB 1 81 ILE HA . . 5.280 4.763 4.461 5.207 . 0 0 "[ . 1 . 2]" 1
2069 1 76 ALA MB 1 81 ILE HB . . 3.630 2.523 2.117 2.976 . 0 0 "[ . 1 . 2]" 1
2070 1 76 ALA MB 1 81 ILE MD . . 4.650 4.527 4.295 4.649 . 0 0 "[ . 1 . 2]" 1
2071 1 76 ALA MB 1 81 ILE HG13 . . 4.290 3.650 3.292 3.917 . 0 0 "[ . 1 . 2]" 1
2072 1 76 ALA MB 1 81 ILE MG . . 4.180 3.623 3.198 3.991 . 0 0 "[ . 1 . 2]" 1
2073 1 76 ALA MB 1 84 PHE QE . . 4.800 4.226 3.592 4.708 . 0 0 "[ . 1 . 2]" 1
2074 1 77 SER H 1 77 SER HB2 . . 3.380 2.461 2.169 2.823 . 0 0 "[ . 1 . 2]" 1
2075 1 77 SER H 1 77 SER QB . . 2.830 2.245 2.148 2.332 . 0 0 "[ . 1 . 2]" 1
2076 1 77 SER H 1 77 SER HB3 . . 3.380 2.826 2.378 3.480 0.100 19 0 "[ . 1 . 2]" 1
2077 1 77 SER H 1 78 ARG H . . 3.100 2.431 2.254 2.538 . 0 0 "[ . 1 . 2]" 1
2078 1 77 SER H 1 78 ARG HA . . 5.260 5.047 4.908 5.129 . 0 0 "[ . 1 . 2]" 1
2079 1 77 SER H 1 78 ARG HB2 . . 5.500 4.612 4.375 4.757 . 0 0 "[ . 1 . 2]" 1
2080 1 77 SER H 1 78 ARG HB3 . . 4.840 4.752 4.511 4.843 0.003 12 0 "[ . 1 . 2]" 1
2081 1 77 SER H 1 79 TYR H . . 4.410 4.270 4.009 4.403 . 0 0 "[ . 1 . 2]" 1
2082 1 77 SER H 1 80 GLY H . . 5.030 4.227 4.087 4.412 . 0 0 "[ . 1 . 2]" 1
2083 1 77 SER HA 1 79 TYR H . . 4.620 4.416 4.279 4.622 0.002 11 0 "[ . 1 . 2]" 1
2084 1 77 SER HA 1 80 GLY H . . 3.730 3.260 3.070 3.358 . 0 0 "[ . 1 . 2]" 1
2085 1 77 SER HA 1 80 GLY QA . . 4.660 2.881 2.657 3.146 . 0 0 "[ . 1 . 2]" 1
2086 1 77 SER HA 1 81 ILE H . . 4.480 4.059 3.713 4.387 . 0 0 "[ . 1 . 2]" 1
2087 1 77 SER QB 1 78 ARG H . . 3.170 2.712 2.478 3.014 . 0 0 "[ . 1 . 2]" 1
2088 1 77 SER QB 1 78 ARG HB2 . . 4.750 4.317 4.195 4.436 . 0 0 "[ . 1 . 2]" 1
2089 1 77 SER QB 1 78 ARG HB3 . . 5.340 5.067 4.928 5.264 . 0 0 "[ . 1 . 2]" 1
2090 1 77 SER QB 1 79 TYR H . . 5.250 4.921 4.813 5.093 . 0 0 "[ . 1 . 2]" 1
2091 1 78 ARG H 1 78 ARG HB2 . . 3.020 2.410 2.327 2.535 . 0 0 "[ . 1 . 2]" 1
2092 1 78 ARG H 1 78 ARG HB3 . . 3.100 2.660 2.524 2.766 . 0 0 "[ . 1 . 2]" 1
2093 1 78 ARG H 1 78 ARG HD2 . . 5.350 4.844 4.589 5.253 . 0 0 "[ . 1 . 2]" 1
2094 1 78 ARG H 1 78 ARG QD . . 4.590 4.368 4.237 4.440 . 0 0 "[ . 1 . 2]" 1
2095 1 78 ARG H 1 78 ARG HD3 . . 5.350 5.039 4.471 5.319 . 0 0 "[ . 1 . 2]" 1
2096 1 78 ARG H 1 78 ARG HG2 . . 4.690 4.500 4.396 4.565 . 0 0 "[ . 1 . 2]" 1
2097 1 78 ARG H 1 78 ARG HG3 . . 4.690 4.383 4.303 4.570 . 0 0 "[ . 1 . 2]" 1
2098 1 78 ARG H 1 79 TYR H . . 3.360 2.820 2.469 3.008 . 0 0 "[ . 1 . 2]" 1
2099 1 78 ARG H 1 79 TYR QD . . 4.710 4.216 3.784 4.622 . 0 0 "[ . 1 . 2]" 1
2100 1 78 ARG H 1 80 GLY H . . 4.440 3.688 3.479 3.849 . 0 0 "[ . 1 . 2]" 1
2101 1 78 ARG HA 1 78 ARG HD2 . . 4.840 4.401 4.101 4.641 . 0 0 "[ . 1 . 2]" 1
2102 1 78 ARG HA 1 78 ARG HD3 . . 4.840 4.613 3.598 4.802 . 0 0 "[ . 1 . 2]" 1
2103 1 78 ARG HA 1 78 ARG HG2 . . 3.650 2.953 2.399 3.280 . 0 0 "[ . 1 . 2]" 1
2104 1 78 ARG HA 1 78 ARG HG3 . . 3.650 2.623 2.444 3.564 . 0 0 "[ . 1 . 2]" 1
2105 1 78 ARG HA 1 80 GLY H . . 4.750 4.560 4.402 4.693 . 0 0 "[ . 1 . 2]" 1
2106 1 78 ARG HB2 1 79 TYR H . . 4.100 3.736 3.626 3.865 . 0 0 "[ . 1 . 2]" 1
2107 1 78 ARG HB3 1 78 ARG HD2 . . 3.900 2.909 2.624 3.246 . 0 0 "[ . 1 . 2]" 1
2108 1 78 ARG HB3 1 78 ARG HD3 . . 3.900 2.534 2.136 2.860 . 0 0 "[ . 1 . 2]" 1
2109 1 78 ARG HB3 1 79 TYR H . . 3.390 2.446 2.281 2.733 . 0 0 "[ . 1 . 2]" 1
2110 1 78 ARG HB3 1 79 TYR QD . . 4.890 2.839 2.386 3.231 . 0 0 "[ . 1 . 2]" 1
2111 1 78 ARG HB3 1 79 TYR QE . . 4.310 3.126 2.822 3.488 . 0 0 "[ . 1 . 2]" 1
2112 1 78 ARG QD 1 79 TYR H . . 5.140 4.284 2.763 4.705 . 0 0 "[ . 1 . 2]" 1
2113 1 78 ARG HD2 1 79 TYR QE . . 4.290 3.821 2.845 4.224 . 0 0 "[ . 1 . 2]" 1
2114 1 78 ARG HD3 1 79 TYR QE . . 4.290 2.798 2.413 3.457 . 0 0 "[ . 1 . 2]" 1
2115 1 78 ARG QG 1 79 TYR H . . 4.210 3.698 3.471 4.045 . 0 0 "[ . 1 . 2]" 1
2116 1 78 ARG QG 1 79 TYR QE . . 4.570 3.768 3.216 4.229 . 0 0 "[ . 1 . 2]" 1
2117 1 79 TYR H 1 79 TYR HB2 . . 3.550 2.687 2.595 2.819 . 0 0 "[ . 1 . 2]" 1
2118 1 79 TYR H 1 79 TYR HB3 . . 3.720 3.706 3.666 3.749 0.029 17 0 "[ . 1 . 2]" 1
2119 1 79 TYR H 1 79 TYR QD . . 3.510 2.374 2.033 2.737 . 0 0 "[ . 1 . 2]" 1
2120 1 79 TYR H 1 79 TYR QE . . 4.610 4.217 3.954 4.514 . 0 0 "[ . 1 . 2]" 1
2121 1 79 TYR H 1 80 GLY H . . 3.180 2.084 1.961 2.209 . 0 0 "[ . 1 . 2]" 1
2122 1 79 TYR H 1 81 ILE H . . 5.020 4.283 3.659 4.818 . 0 0 "[ . 1 . 2]" 1
2123 1 79 TYR H 1 81 ILE MD . . 4.750 4.565 4.172 4.734 . 0 0 "[ . 1 . 2]" 1
2124 1 79 TYR H 1 81 ILE HG12 . . 4.200 3.931 3.685 4.159 . 0 0 "[ . 1 . 2]" 1
2125 1 79 TYR HA 1 79 TYR QD . . 3.280 2.998 2.779 3.185 . 0 0 "[ . 1 . 2]" 1
2126 1 79 TYR HA 1 79 TYR QE . . 5.380 4.813 4.710 4.964 . 0 0 "[ . 1 . 2]" 1
2127 1 79 TYR HB2 1 80 GLY H . . 4.460 3.118 3.053 3.221 . 0 0 "[ . 1 . 2]" 1
2128 1 79 TYR HB2 1 81 ILE H . . 4.890 4.116 3.294 4.882 . 0 0 "[ . 1 . 2]" 1
2129 1 79 TYR HB2 1 81 ILE MD . . 4.030 2.493 2.184 3.011 . 0 0 "[ . 1 . 2]" 1
2130 1 79 TYR HB2 1 81 ILE HG12 . . 4.970 2.788 2.336 3.327 . 0 0 "[ . 1 . 2]" 1
2131 1 79 TYR HB2 1 88 LYS QE . . 4.550 3.744 2.979 4.298 . 0 0 "[ . 1 . 2]" 1
2132 1 79 TYR HB3 1 80 GLY H . . 4.230 4.173 4.091 4.231 0.001 20 0 "[ . 1 . 2]" 1
2133 1 79 TYR HB3 1 81 ILE MD . . 4.410 3.296 2.796 3.928 . 0 0 "[ . 1 . 2]" 1
2134 1 79 TYR HB3 1 81 ILE HG12 . . 5.070 4.378 3.861 5.047 . 0 0 "[ . 1 . 2]" 1
2135 1 79 TYR HB3 1 88 LYS QD . . 5.280 4.558 4.218 5.100 . 0 0 "[ . 1 . 2]" 1
2136 1 79 TYR HB3 1 88 LYS QE . . 4.330 3.331 2.895 3.852 . 0 0 "[ . 1 . 2]" 1
2137 1 79 TYR QD 1 80 GLY H . . 4.270 3.888 3.498 4.202 . 0 0 "[ . 1 . 2]" 1
2138 1 79 TYR QD 1 81 ILE MD . . 4.280 3.764 3.311 4.100 . 0 0 "[ . 1 . 2]" 1
2139 1 79 TYR QD 1 81 ILE HG12 . . 5.080 3.655 3.237 4.175 . 0 0 "[ . 1 . 2]" 1
2140 1 79 TYR QD 1 81 ILE HG13 . . 5.500 4.135 3.578 4.785 . 0 0 "[ . 1 . 2]" 1
2141 1 79 TYR QD 1 88 LYS QE . . 4.550 4.353 3.927 4.552 0.002 10 0 "[ . 1 . 2]" 1
2142 1 79 TYR QD 1 96 PRO QG . . 4.670 3.715 2.962 4.335 . 0 0 "[ . 1 . 2]" 1
2143 1 79 TYR QE 1 90 PHE QD . . 4.690 4.242 3.955 4.691 0.001 14 0 "[ . 1 . 2]" 1
2144 1 79 TYR QE 1 90 PHE QE . . 3.760 2.387 1.997 2.971 . 0 0 "[ . 1 . 2]" 1
2145 1 79 TYR QE 1 90 PHE HZ . . 4.490 3.404 2.740 3.812 . 0 0 "[ . 1 . 2]" 1
2146 1 79 TYR QE 1 96 PRO HG2 . . 4.120 3.604 2.621 4.103 . 0 0 "[ . 1 . 2]" 1
2147 1 79 TYR QE 1 96 PRO QG . . 3.610 2.604 2.041 3.116 . 0 0 "[ . 1 . 2]" 1
2148 1 79 TYR QE 1 96 PRO HG3 . . 4.120 2.687 2.129 3.266 . 0 0 "[ . 1 . 2]" 1
2149 1 80 GLY H 1 81 ILE H . . 3.290 2.750 2.350 3.144 . 0 0 "[ . 1 . 2]" 1
2150 1 80 GLY H 1 81 ILE MD . . 4.540 4.256 3.827 4.460 . 0 0 "[ . 1 . 2]" 1
2151 1 80 GLY H 1 81 ILE HG12 . . 4.470 3.371 3.161 3.580 . 0 0 "[ . 1 . 2]" 1
2152 1 80 GLY H 1 81 ILE HG13 . . 5.450 5.014 4.746 5.281 . 0 0 "[ . 1 . 2]" 1
2153 1 81 ILE H 1 81 ILE HB . . 3.090 2.640 2.565 2.737 . 0 0 "[ . 1 . 2]" 1
2154 1 81 ILE H 1 81 ILE MD . . 3.740 3.456 3.146 3.737 . 0 0 "[ . 1 . 2]" 1
2155 1 81 ILE H 1 81 ILE HG12 . . 3.110 2.225 1.916 2.598 . 0 0 "[ . 1 . 2]" 1
2156 1 81 ILE H 1 81 ILE HG13 . . 4.030 3.643 3.416 3.958 . 0 0 "[ . 1 . 2]" 1
2157 1 81 ILE H 1 81 ILE MG . . 4.150 3.815 3.763 3.877 . 0 0 "[ . 1 . 2]" 1
2158 1 81 ILE HA 1 81 ILE MD . . 3.330 2.106 1.979 2.479 . 0 0 "[ . 1 . 2]" 1
2159 1 81 ILE HA 1 81 ILE HG12 . . 4.160 3.056 2.936 3.139 . 0 0 "[ . 1 . 2]" 1
2160 1 81 ILE HA 1 81 ILE MG . . 3.450 2.276 2.178 2.379 . 0 0 "[ . 1 . 2]" 1
2161 1 81 ILE HA 1 82 ARG QB . . 5.340 4.443 4.224 4.597 . 0 0 "[ . 1 . 2]" 1
2162 1 81 ILE HA 1 83 GLY H . . 3.770 3.535 3.348 3.702 . 0 0 "[ . 1 . 2]" 1
2163 1 81 ILE HA 1 86 THR MG . . 4.380 3.498 3.189 3.915 . 0 0 "[ . 1 . 2]" 1
2164 1 81 ILE MD 1 81 ILE MG . . 3.080 1.976 1.812 2.067 . 0 0 "[ . 1 . 2]" 1
2165 1 81 ILE MD 1 82 ARG H . . 4.660 3.932 3.748 4.476 . 0 0 "[ . 1 . 2]" 1
2166 1 81 ILE MD 1 83 GLY H . . 4.890 4.641 4.473 4.893 0.003 9 0 "[ . 1 . 2]" 1
2167 1 81 ILE MD 1 86 THR H . . 5.500 5.423 5.212 5.498 . 0 0 "[ . 1 . 2]" 1
2168 1 81 ILE MD 1 86 THR HB . . 3.690 2.952 2.735 3.285 . 0 0 "[ . 1 . 2]" 1
2169 1 81 ILE MD 1 86 THR MG . . 3.130 1.891 1.704 2.093 . 0 0 "[ . 1 . 2]" 1
2170 1 81 ILE MD 1 88 LYS HD2 . . 4.940 4.347 3.997 4.716 . 0 0 "[ . 1 . 2]" 1
2171 1 81 ILE MD 1 88 LYS QD . . 4.340 3.959 3.760 4.268 . 0 0 "[ . 1 . 2]" 1
2172 1 81 ILE MD 1 88 LYS HD3 . . 4.940 4.566 4.329 4.881 . 0 0 "[ . 1 . 2]" 1
2173 1 81 ILE MD 1 88 LYS HE2 . . 3.710 2.812 2.136 3.543 . 0 0 "[ . 1 . 2]" 1
2174 1 81 ILE MD 1 88 LYS HE3 . . 3.710 2.789 2.141 3.654 . 0 0 "[ . 1 . 2]" 1
2175 1 81 ILE MD 1 88 LYS HG2 . . 4.830 3.646 3.420 4.024 . 0 0 "[ . 1 . 2]" 1
2176 1 81 ILE HG13 1 88 LYS QE . . 5.340 4.772 4.452 5.128 . 0 0 "[ . 1 . 2]" 1
2177 1 81 ILE MG 1 82 ARG H . . 4.340 2.957 2.726 3.172 . 0 0 "[ . 1 . 2]" 1
2178 1 81 ILE MG 1 82 ARG HA . . 4.600 3.827 3.663 3.955 . 0 0 "[ . 1 . 2]" 1
2179 1 81 ILE MG 1 82 ARG QG . . 5.060 4.697 4.467 4.975 . 0 0 "[ . 1 . 2]" 1
2180 1 81 ILE MG 1 83 GLY H . . 3.580 3.196 1.854 3.583 0.003 7 0 "[ . 1 . 2]" 1
2181 1 81 ILE MG 1 84 PHE QD . . 4.620 2.315 2.065 2.505 . 0 0 "[ . 1 . 2]" 1
2182 1 81 ILE MG 1 84 PHE QE . . 3.340 1.995 1.798 2.271 . 0 0 "[ . 1 . 2]" 1
2183 1 81 ILE MG 1 84 PHE HZ . . 4.640 3.822 3.141 4.107 . 0 0 "[ . 1 . 2]" 1
2184 1 81 ILE MG 1 86 THR H . . 4.640 4.405 4.139 4.657 0.017 18 0 "[ . 1 . 2]" 1
2185 1 81 ILE MG 1 86 THR HB . . 3.700 2.356 2.078 2.815 . 0 0 "[ . 1 . 2]" 1
2186 1 81 ILE MG 1 86 THR HG1 . . 4.420 2.599 1.862 3.345 . 0 0 "[ . 1 . 2]" 1
2187 1 81 ILE MG 1 86 THR MG . . 3.620 2.503 1.934 3.165 . 0 0 "[ . 1 . 2]" 1
2188 1 81 ILE MG 1 88 LYS QE . . 5.340 4.373 4.048 4.782 . 0 0 "[ . 1 . 2]" 1
2189 1 82 ARG H 1 82 ARG QG . . 4.840 2.815 1.939 3.525 . 0 0 "[ . 1 . 2]" 1
2190 1 82 ARG H 1 83 GLY H . . 3.560 1.927 1.783 2.902 . 0 0 "[ . 1 . 2]" 1
2191 1 82 ARG H 1 84 PHE QD . . 5.200 4.434 3.839 5.201 0.001 12 0 "[ . 1 . 2]" 1
2192 1 82 ARG HA 1 82 ARG QD . . 4.180 3.773 2.252 4.227 0.047 5 0 "[ . 1 . 2]" 1
2193 1 82 ARG HA 1 82 ARG QG . . 3.500 2.780 2.202 3.440 . 0 0 "[ . 1 . 2]" 1
2194 1 82 ARG QB 1 82 ARG QD . . 3.290 2.145 2.020 2.386 . 0 0 "[ . 1 . 2]" 1
2195 1 82 ARG HB2 1 83 GLY H . . 4.260 3.572 2.805 4.245 . 0 0 "[ . 1 . 2]" 1
2196 1 82 ARG HB3 1 83 GLY H . . 4.260 4.004 3.564 4.321 0.061 12 0 "[ . 1 . 2]" 1
2197 1 83 GLY H 1 84 PHE H . . 4.360 4.026 3.373 4.332 . 0 0 "[ . 1 . 2]" 1
2198 1 83 GLY H 1 86 THR HG1 . . 4.320 3.749 3.252 4.146 . 0 0 "[ . 1 . 2]" 1
2199 1 83 GLY QA 1 84 PHE H . . 2.760 2.189 2.112 2.255 . 0 0 "[ . 1 . 2]" 1
2200 1 83 GLY QA 1 84 PHE QD . . 4.530 3.805 3.469 4.231 . 0 0 "[ . 1 . 2]" 1
2201 1 84 PHE H 1 84 PHE HB2 . . 3.850 2.888 2.866 2.968 . 0 0 "[ . 1 . 2]" 1
2202 1 84 PHE H 1 84 PHE QB . . 3.270 2.787 2.767 2.862 . 0 0 "[ . 1 . 2]" 1
2203 1 84 PHE H 1 84 PHE HB3 . . 3.850 3.668 3.632 3.753 . 0 0 "[ . 1 . 2]" 1
2204 1 84 PHE H 1 84 PHE QD . . 3.510 2.885 2.654 3.049 . 0 0 "[ . 1 . 2]" 1
2205 1 84 PHE H 1 85 PRO HA . . 4.770 4.762 4.754 4.767 . 0 0 "[ . 1 . 2]" 1
2206 1 84 PHE HA 1 84 PHE QD . . 3.910 2.479 2.398 2.707 . 0 0 "[ . 1 . 2]" 1
2207 1 84 PHE HA 1 86 THR H . . 3.470 3.215 3.017 3.348 . 0 0 "[ . 1 . 2]" 1
2208 1 84 PHE QB 1 85 PRO HA . . 3.680 1.956 1.937 1.964 . 0 0 "[ . 1 . 2]" 1
2209 1 84 PHE QB 1 86 THR H . . 4.640 3.451 3.249 3.586 . 0 0 "[ . 1 . 2]" 1
2210 1 84 PHE HB2 1 85 PRO HA . . 4.470 3.088 3.004 3.124 . 0 0 "[ . 1 . 2]" 1
2211 1 84 PHE HB3 1 85 PRO HA . . 4.470 1.978 1.961 1.984 . 0 0 "[ . 1 . 2]" 1
2212 1 84 PHE QD 1 85 PRO HA . . 4.400 3.985 3.850 4.072 . 0 0 "[ . 1 . 2]" 1
2213 1 84 PHE QD 1 86 THR H . . 4.630 4.354 3.836 4.641 0.011 18 0 "[ . 1 . 2]" 1
2214 1 85 PRO HA 1 86 THR H . . 3.020 2.337 2.268 2.383 . 0 0 "[ . 1 . 2]" 1
2215 1 85 PRO HB2 1 86 THR H . . 3.660 2.783 2.654 2.984 . 0 0 "[ . 1 . 2]" 1
2216 1 85 PRO HB2 1 87 ILE MD . . 4.040 3.800 3.596 4.023 . 0 0 "[ . 1 . 2]" 1
2217 1 85 PRO HB3 1 86 THR H . . 3.830 3.543 3.474 3.656 . 0 0 "[ . 1 . 2]" 1
2218 1 85 PRO HB3 1 87 ILE MD . . 5.380 5.093 4.919 5.308 . 0 0 "[ . 1 . 2]" 1
2219 1 85 PRO QG 1 86 THR H . . 4.490 4.276 4.194 4.398 . 0 0 "[ . 1 . 2]" 1
2220 1 85 PRO QG 1 103 ARG QD . . 3.720 2.208 1.789 3.724 0.004 7 0 "[ . 1 . 2]" 1
2221 1 86 THR H 1 86 THR HB . . 3.440 2.885 2.661 3.066 . 0 0 "[ . 1 . 2]" 1
2222 1 86 THR H 1 86 THR HG1 . . 4.970 4.109 3.571 4.619 . 0 0 "[ . 1 . 2]" 1
2223 1 86 THR H 1 86 THR MG . . 3.990 3.934 3.778 3.999 0.009 17 0 "[ . 1 . 2]" 1
2224 1 86 THR H 1 87 ILE H . . 4.540 4.014 3.912 4.344 . 0 0 "[ . 1 . 2]" 1
2225 1 86 THR H 1 87 ILE HG13 . . 4.640 3.960 3.818 4.137 . 0 0 "[ . 1 . 2]" 1
2226 1 86 THR HA 1 86 THR MG . . 3.330 2.253 2.056 2.528 . 0 0 "[ . 1 . 2]" 1
2227 1 86 THR HA 1 87 ILE H . . 2.910 2.162 2.141 2.219 . 0 0 "[ . 1 . 2]" 1
2228 1 86 THR HA 1 87 ILE HB . . 4.940 4.660 4.553 4.755 . 0 0 "[ . 1 . 2]" 1
2229 1 86 THR HA 1 87 ILE MG . . 5.500 5.492 5.436 5.507 0.007 1 0 "[ . 1 . 2]" 1
2230 1 86 THR HB 1 87 ILE H . . 4.870 4.288 4.005 4.513 . 0 0 "[ . 1 . 2]" 1
2231 1 86 THR MG 1 87 ILE H . . 3.450 2.980 2.096 3.216 . 0 0 "[ . 1 . 2]" 1
2232 1 86 THR MG 1 87 ILE HA . . 4.730 4.095 3.515 4.442 . 0 0 "[ . 1 . 2]" 1
2233 1 86 THR MG 1 88 LYS HE2 . . 3.880 2.490 1.993 3.491 . 0 0 "[ . 1 . 2]" 1
2234 1 86 THR MG 1 88 LYS QE . . 3.180 2.362 1.976 2.783 . 0 0 "[ . 1 . 2]" 1
2235 1 86 THR MG 1 88 LYS HE3 . . 3.880 3.345 2.245 3.906 0.026 17 0 "[ . 1 . 2]" 1
2236 1 86 THR MG 1 88 LYS HG2 . . 3.580 2.448 2.191 2.777 . 0 0 "[ . 1 . 2]" 1
2237 1 87 ILE H 1 87 ILE HB . . 3.500 2.551 2.440 2.765 . 0 0 "[ . 1 . 2]" 1
2238 1 87 ILE H 1 87 ILE HG12 . . 4.570 3.994 3.789 4.283 . 0 0 "[ . 1 . 2]" 1
2239 1 87 ILE H 1 87 ILE HG13 . . 3.960 2.604 2.357 2.983 . 0 0 "[ . 1 . 2]" 1
2240 1 87 ILE H 1 87 ILE MG . . 4.470 3.809 3.757 3.897 . 0 0 "[ . 1 . 2]" 1
2241 1 87 ILE H 1 88 LYS H . . 4.570 4.403 4.216 4.466 . 0 0 "[ . 1 . 2]" 1
2242 1 87 ILE H 1 99 TYR H . . 4.960 4.857 4.626 4.969 0.009 12 0 "[ . 1 . 2]" 1
2243 1 87 ILE H 1 99 TYR HB3 . . 4.670 3.906 3.526 4.316 . 0 0 "[ . 1 . 2]" 1
2244 1 87 ILE H 1 99 TYR QD . . 4.690 4.271 3.933 4.649 . 0 0 "[ . 1 . 2]" 1
2245 1 87 ILE HA 1 87 ILE MD . . 4.470 3.885 3.847 3.923 . 0 0 "[ . 1 . 2]" 1
2246 1 87 ILE HA 1 87 ILE MG . . 3.410 2.362 2.269 2.451 . 0 0 "[ . 1 . 2]" 1
2247 1 87 ILE HA 1 88 LYS H . . 2.840 2.145 2.138 2.174 . 0 0 "[ . 1 . 2]" 1
2248 1 87 ILE HB 1 87 ILE MD . . 3.040 2.193 2.106 2.296 . 0 0 "[ . 1 . 2]" 1
2249 1 87 ILE HB 1 88 LYS H . . 4.390 4.227 4.066 4.317 . 0 0 "[ . 1 . 2]" 1
2250 1 87 ILE HB 1 99 TYR H . . 4.200 4.043 3.544 4.220 0.020 10 0 "[ . 1 . 2]" 1
2251 1 87 ILE HB 1 99 TYR HB2 . . 4.080 3.478 2.678 3.821 . 0 0 "[ . 1 . 2]" 1
2252 1 87 ILE HB 1 99 TYR HB3 . . 3.820 2.018 1.989 2.210 . 0 0 "[ . 1 . 2]" 1
2253 1 87 ILE HB 1 99 TYR QD . . 3.540 2.425 2.011 2.959 . 0 0 "[ . 1 . 2]" 1
2254 1 87 ILE MD 1 99 TYR HB3 . . 4.610 3.465 3.157 3.660 . 0 0 "[ . 1 . 2]" 1
2255 1 87 ILE MD 1 99 TYR QD . . 3.280 2.209 1.862 2.735 . 0 0 "[ . 1 . 2]" 1
2256 1 87 ILE MD 1 99 TYR QE . . 3.550 2.749 2.331 3.309 . 0 0 "[ . 1 . 2]" 1
2257 1 87 ILE MD 1 103 ARG HA . . 4.020 3.090 2.524 3.722 . 0 0 "[ . 1 . 2]" 1
2258 1 87 ILE MD 1 103 ARG HD2 . . 5.500 5.185 4.042 5.504 0.004 10 0 "[ . 1 . 2]" 1
2259 1 87 ILE MD 1 103 ARG QD . . 4.640 4.385 3.482 4.648 0.008 9 0 "[ . 1 . 2]" 1
2260 1 87 ILE MD 1 103 ARG HD3 . . 5.500 4.802 3.608 5.316 . 0 0 "[ . 1 . 2]" 1
2261 1 87 ILE MD 1 103 ARG HG2 . . 5.500 4.087 2.161 5.248 . 0 0 "[ . 1 . 2]" 1
2262 1 87 ILE MD 1 103 ARG HG3 . . 5.500 3.996 2.907 5.272 . 0 0 "[ . 1 . 2]" 1
2263 1 87 ILE HG12 1 87 ILE MG . . 3.370 2.212 2.033 2.285 . 0 0 "[ . 1 . 2]" 1
2264 1 87 ILE HG12 1 88 LYS H . . 4.740 4.572 4.426 4.717 . 0 0 "[ . 1 . 2]" 1
2265 1 87 ILE HG12 1 99 TYR QD . . 5.250 4.556 3.829 5.164 . 0 0 "[ . 1 . 2]" 1
2266 1 87 ILE HG13 1 87 ILE MG . . 3.720 3.155 3.124 3.172 . 0 0 "[ . 1 . 2]" 1
2267 1 87 ILE HG13 1 99 TYR QD . . 5.020 4.295 3.862 4.924 . 0 0 "[ . 1 . 2]" 1
2268 1 87 ILE MG 1 88 LYS H . . 3.300 2.671 2.337 2.982 . 0 0 "[ . 1 . 2]" 1
2269 1 87 ILE MG 1 88 LYS HA . . 4.490 3.526 3.340 3.742 . 0 0 "[ . 1 . 2]" 1
2270 1 87 ILE MG 1 88 LYS HB2 . . 5.150 4.873 4.709 5.013 . 0 0 "[ . 1 . 2]" 1
2271 1 87 ILE MG 1 89 ILE HA . . 4.780 4.624 4.471 4.785 0.005 14 0 "[ . 1 . 2]" 1
2272 1 87 ILE MG 1 89 ILE MD . . 2.650 2.407 2.143 2.620 . 0 0 "[ . 1 . 2]" 1
2273 1 87 ILE MG 1 99 TYR H . . 4.080 3.660 3.139 3.966 . 0 0 "[ . 1 . 2]" 1
2274 1 87 ILE MG 1 99 TYR HB2 . . 3.620 2.403 1.972 2.841 . 0 0 "[ . 1 . 2]" 1
2275 1 87 ILE MG 1 99 TYR HB3 . . 3.610 2.214 1.932 2.859 . 0 0 "[ . 1 . 2]" 1
2276 1 87 ILE MG 1 99 TYR QD . . 3.720 2.949 2.116 3.263 . 0 0 "[ . 1 . 2]" 1
2277 1 88 LYS H 1 88 LYS HB2 . . 3.590 2.743 2.623 2.892 . 0 0 "[ . 1 . 2]" 1
2278 1 88 LYS H 1 88 LYS HB3 . . 4.070 3.833 3.768 3.907 . 0 0 "[ . 1 . 2]" 1
2279 1 88 LYS H 1 88 LYS HG2 . . 4.050 3.012 2.910 3.153 . 0 0 "[ . 1 . 2]" 1
2280 1 88 LYS H 1 88 LYS HG3 . . 4.030 3.995 3.914 4.047 0.017 9 0 "[ . 1 . 2]" 1
2281 1 88 LYS H 1 89 ILE H . . 4.560 4.355 4.251 4.439 . 0 0 "[ . 1 . 2]" 1
2282 1 88 LYS H 1 89 ILE HA . . 5.020 4.769 4.681 4.868 . 0 0 "[ . 1 . 2]" 1
2283 1 88 LYS H 1 90 PHE QE . . 4.570 4.207 3.743 4.567 . 0 0 "[ . 1 . 2]" 1
2284 1 88 LYS HA 1 88 LYS HD2 . . 4.430 3.296 3.181 3.575 . 0 0 "[ . 1 . 2]" 1
2285 1 88 LYS HA 1 88 LYS QD . . 3.820 2.578 2.475 2.679 . 0 0 "[ . 1 . 2]" 1
2286 1 88 LYS HA 1 88 LYS HD3 . . 4.430 2.701 2.524 2.876 . 0 0 "[ . 1 . 2]" 1
2287 1 88 LYS HA 1 88 LYS HG2 . . 3.970 2.786 2.696 2.873 . 0 0 "[ . 1 . 2]" 1
2288 1 88 LYS HA 1 89 ILE H . . 3.000 2.196 2.149 2.264 . 0 0 "[ . 1 . 2]" 1
2289 1 88 LYS HA 1 89 ILE HB . . 4.580 4.535 4.433 4.601 0.021 2 0 "[ . 1 . 2]" 1
2290 1 88 LYS HA 1 97 VAL H . . 5.180 4.887 4.371 5.183 0.003 3 0 "[ . 1 . 2]" 1
2291 1 88 LYS HA 1 97 VAL QG . . 4.980 4.228 3.603 4.594 . 0 0 "[ . 1 . 2]" 1
2292 1 88 LYS HA 1 98 ASP HA . . 3.710 2.887 2.148 3.173 . 0 0 "[ . 1 . 2]" 1
2293 1 88 LYS HA 1 99 TYR H . . 3.670 2.583 2.456 2.670 . 0 0 "[ . 1 . 2]" 1
2294 1 88 LYS HB2 1 89 ILE H . . 4.670 4.032 3.835 4.178 . 0 0 "[ . 1 . 2]" 1
2295 1 88 LYS HB2 1 90 PHE QD . . 4.680 4.131 3.951 4.330 . 0 0 "[ . 1 . 2]" 1
2296 1 88 LYS HB2 1 90 PHE QE . . 4.010 2.272 2.000 2.596 . 0 0 "[ . 1 . 2]" 1
2297 1 88 LYS HB2 1 96 PRO QB . . 5.340 4.906 4.466 5.348 0.008 15 0 "[ . 1 . 2]" 1
2298 1 88 LYS HB2 1 99 TYR H . . 5.500 5.484 5.414 5.518 0.018 20 0 "[ . 1 . 2]" 1
2299 1 88 LYS HB3 1 89 ILE H . . 3.650 3.063 2.807 3.325 . 0 0 "[ . 1 . 2]" 1
2300 1 88 LYS HB3 1 90 PHE QD . . 5.500 4.390 4.143 4.643 . 0 0 "[ . 1 . 2]" 1
2301 1 88 LYS HB3 1 90 PHE QE . . 4.160 3.122 2.892 3.486 . 0 0 "[ . 1 . 2]" 1
2302 1 88 LYS HB3 1 90 PHE HZ . . 4.920 3.545 3.226 3.980 . 0 0 "[ . 1 . 2]" 1
2303 1 88 LYS QD 1 98 ASP HA . . 4.650 2.011 1.965 2.103 . 0 0 "[ . 1 . 2]" 1
2304 1 88 LYS QD 1 99 TYR H . . 4.520 3.173 2.933 3.538 . 0 0 "[ . 1 . 2]" 1
2305 1 88 LYS HD2 1 89 ILE H . . 4.660 4.303 3.991 4.551 . 0 0 "[ . 1 . 2]" 1
2306 1 88 LYS HD3 1 89 ILE H . . 4.660 4.318 4.011 4.662 0.002 10 0 "[ . 1 . 2]" 1
2307 1 88 LYS QE 1 88 LYS HG2 . . 3.690 2.675 2.451 2.900 . 0 0 "[ . 1 . 2]" 1
2308 1 88 LYS QE 1 88 LYS HG3 . . 3.220 2.226 2.052 2.516 . 0 0 "[ . 1 . 2]" 1
2309 1 88 LYS HE2 1 88 LYS HG3 . . 3.940 2.690 2.137 3.640 . 0 0 "[ . 1 . 2]" 1
2310 1 88 LYS HE3 1 88 LYS HG3 . . 3.940 2.625 2.083 3.524 . 0 0 "[ . 1 . 2]" 1
2311 1 88 LYS HG2 1 89 ILE H . . 5.030 4.818 4.727 4.907 . 0 0 "[ . 1 . 2]" 1
2312 1 88 LYS HG2 1 98 ASP HA . . 4.360 4.026 3.730 4.219 . 0 0 "[ . 1 . 2]" 1
2313 1 88 LYS HG2 1 99 TYR H . . 4.340 4.192 3.972 4.319 . 0 0 "[ . 1 . 2]" 1
2314 1 88 LYS HG3 1 90 PHE QE . . 4.530 4.080 3.847 4.372 . 0 0 "[ . 1 . 2]" 1
2315 1 88 LYS HG3 1 90 PHE HZ . . 4.800 4.027 3.592 4.614 . 0 0 "[ . 1 . 2]" 1
2316 1 89 ILE H 1 89 ILE HB . . 3.120 2.482 2.336 2.595 . 0 0 "[ . 1 . 2]" 1
2317 1 89 ILE H 1 89 ILE MD . . 3.970 2.206 1.882 2.496 . 0 0 "[ . 1 . 2]" 1
2318 1 89 ILE H 1 89 ILE HG12 . . 4.830 4.225 4.088 4.364 . 0 0 "[ . 1 . 2]" 1
2319 1 89 ILE H 1 89 ILE HG13 . . 3.720 3.581 3.425 3.719 . 0 0 "[ . 1 . 2]" 1
2320 1 89 ILE H 1 89 ILE MG . . 3.980 3.772 3.686 3.827 . 0 0 "[ . 1 . 2]" 1
2321 1 89 ILE H 1 90 PHE H . . 4.610 4.512 4.454 4.586 . 0 0 "[ . 1 . 2]" 1
2322 1 89 ILE H 1 90 PHE QE . . 5.230 4.789 4.318 5.198 . 0 0 "[ . 1 . 2]" 1
2323 1 89 ILE H 1 96 PRO HA . . 5.130 4.912 4.564 5.134 0.004 17 0 "[ . 1 . 2]" 1
2324 1 89 ILE H 1 97 VAL H . . 3.470 3.154 2.618 3.449 . 0 0 "[ . 1 . 2]" 1
2325 1 89 ILE H 1 97 VAL HB . . 4.910 4.580 2.601 4.911 0.001 8 0 "[ . 1 . 2]" 1
2326 1 89 ILE H 1 97 VAL QG . . 3.390 2.818 2.158 3.431 0.041 10 0 "[ . 1 . 2]" 1
2327 1 89 ILE H 1 99 TYR H . . 4.540 3.720 3.477 3.961 . 0 0 "[ . 1 . 2]" 1
2328 1 89 ILE HA 1 89 ILE MD . . 3.920 3.211 3.017 3.347 . 0 0 "[ . 1 . 2]" 1
2329 1 89 ILE HA 1 89 ILE HG13 . . 4.220 2.291 2.193 2.432 . 0 0 "[ . 1 . 2]" 1
2330 1 89 ILE HA 1 89 ILE MG . . 3.460 2.430 2.340 2.534 . 0 0 "[ . 1 . 2]" 1
2331 1 89 ILE HA 1 90 PHE H . . 2.960 2.206 2.172 2.265 . 0 0 "[ . 1 . 2]" 1
2332 1 89 ILE HA 1 90 PHE QD . . 4.320 3.194 2.719 3.567 . 0 0 "[ . 1 . 2]" 1
2333 1 89 ILE HA 1 97 VAL H . . 5.410 4.799 4.316 5.062 . 0 0 "[ . 1 . 2]" 1
2334 1 89 ILE HB 1 89 ILE MD . . 3.080 2.162 2.097 2.269 . 0 0 "[ . 1 . 2]" 1
2335 1 89 ILE HB 1 90 PHE H . . 4.120 4.061 3.947 4.124 0.004 9 0 "[ . 1 . 2]" 1
2336 1 89 ILE HB 1 96 PRO QB . . 5.340 5.144 4.664 5.359 0.019 20 0 "[ . 1 . 2]" 1
2337 1 89 ILE HB 1 97 VAL H . . 3.640 3.152 2.631 3.577 . 0 0 "[ . 1 . 2]" 1
2338 1 89 ILE HB 1 97 VAL HB . . 4.320 4.068 1.995 4.370 0.050 4 0 "[ . 1 . 2]" 1
2339 1 89 ILE HB 1 97 VAL QG . . 3.220 1.918 1.783 2.996 . 0 0 "[ . 1 . 2]" 1
2340 1 89 ILE HB 1 99 TYR H . . 5.500 5.235 4.924 5.456 . 0 0 "[ . 1 . 2]" 1
2341 1 89 ILE MD 1 90 PHE H . . 5.500 4.860 4.726 4.953 . 0 0 "[ . 1 . 2]" 1
2342 1 89 ILE MD 1 97 VAL HB . . 4.480 3.933 2.032 4.421 . 0 0 "[ . 1 . 2]" 1
2343 1 89 ILE MD 1 99 TYR H . . 3.950 3.016 2.554 3.215 . 0 0 "[ . 1 . 2]" 1
2344 1 89 ILE MD 1 99 TYR HA . . 3.920 3.255 2.241 3.924 0.004 10 0 "[ . 1 . 2]" 1
2345 1 89 ILE MD 1 99 TYR HB2 . . 3.540 1.950 1.820 2.337 . 0 0 "[ . 1 . 2]" 1
2346 1 89 ILE MD 1 99 TYR HB3 . . 3.930 3.136 2.847 3.822 . 0 0 "[ . 1 . 2]" 1
2347 1 89 ILE MD 1 99 TYR QD . . 3.530 2.507 2.091 3.002 . 0 0 "[ . 1 . 2]" 1
2348 1 89 ILE MD 1 99 TYR QE . . 4.570 4.327 3.971 4.571 0.001 7 0 "[ . 1 . 2]" 1
2349 1 89 ILE MD 1 111 ARG HD2 . . 5.500 4.600 3.526 5.372 . 0 0 "[ . 1 . 2]" 1
2350 1 89 ILE MD 1 111 ARG HD3 . . 5.500 5.199 4.535 5.507 0.007 9 0 "[ . 1 . 2]" 1
2351 1 89 ILE MD 1 111 ARG QG . . 4.490 3.140 2.813 4.005 . 0 0 "[ . 1 . 2]" 1
2352 1 89 ILE HG12 1 89 ILE MG . . 3.110 2.128 1.998 2.255 . 0 0 "[ . 1 . 2]" 1
2353 1 89 ILE HG12 1 111 ARG QD . . 5.340 4.949 3.479 5.342 0.002 17 0 "[ . 1 . 2]" 1
2354 1 89 ILE HG13 1 89 ILE MG . . 3.640 2.623 2.424 2.725 . 0 0 "[ . 1 . 2]" 1
2355 1 89 ILE HG13 1 99 TYR HB2 . . 4.810 4.275 4.079 4.577 . 0 0 "[ . 1 . 2]" 1
2356 1 89 ILE MG 1 90 PHE H . . 3.320 2.142 2.000 2.335 . 0 0 "[ . 1 . 2]" 1
2357 1 89 ILE MG 1 90 PHE HA . . 4.400 3.428 3.153 3.646 . 0 0 "[ . 1 . 2]" 1
2358 1 89 ILE MG 1 91 GLN H . . 4.200 3.844 3.287 4.198 . 0 0 "[ . 1 . 2]" 1
2359 1 89 ILE MG 1 91 GLN QE . . 4.560 2.269 1.803 2.814 . 0 0 "[ . 1 . 2]" 1
2360 1 89 ILE MG 1 91 GLN HG2 . . 4.210 3.611 2.228 4.193 . 0 0 "[ . 1 . 2]" 1
2361 1 89 ILE MG 1 91 GLN QG . . 3.700 2.543 2.002 3.011 . 0 0 "[ . 1 . 2]" 1
2362 1 89 ILE MG 1 91 GLN HG3 . . 4.210 2.658 2.024 3.403 . 0 0 "[ . 1 . 2]" 1
2363 1 89 ILE MG 1 97 VAL H . . 4.770 3.795 3.422 4.384 . 0 0 "[ . 1 . 2]" 1
2364 1 90 PHE H 1 90 PHE HB2 . . 3.490 2.664 2.509 2.774 . 0 0 "[ . 1 . 2]" 1
2365 1 90 PHE H 1 90 PHE QD . . 3.350 2.733 2.234 2.981 . 0 0 "[ . 1 . 2]" 1
2366 1 90 PHE H 1 91 GLN H . . 4.420 4.243 4.036 4.377 . 0 0 "[ . 1 . 2]" 1
2367 1 90 PHE H 1 91 GLN QG . . 4.930 4.180 3.798 4.870 . 0 0 "[ . 1 . 2]" 1
2368 1 90 PHE HA 1 90 PHE QD . . 4.030 3.058 2.880 3.222 . 0 0 "[ . 1 . 2]" 1
2369 1 90 PHE HA 1 91 GLN H . . 2.620 2.152 2.140 2.177 . 0 0 "[ . 1 . 2]" 1
2370 1 90 PHE HA 1 97 VAL H . . 4.370 3.901 3.560 4.090 . 0 0 "[ . 1 . 2]" 1
2371 1 90 PHE HB2 1 91 GLN H . . 4.920 4.270 4.046 4.469 . 0 0 "[ . 1 . 2]" 1
2372 1 90 PHE HB3 1 91 GLN H . . 3.740 3.406 3.148 3.748 0.008 13 0 "[ . 1 . 2]" 1
2373 1 90 PHE QD 1 91 GLN H . . 4.500 4.367 4.091 4.505 0.005 14 0 "[ . 1 . 2]" 1
2374 1 90 PHE QD 1 96 PRO QB . . 4.440 2.405 2.021 2.756 . 0 0 "[ . 1 . 2]" 1
2375 1 90 PHE QD 1 96 PRO QG . . 3.950 3.228 2.610 3.788 . 0 0 "[ . 1 . 2]" 1
2376 1 90 PHE QE 1 96 PRO HB2 . . 4.490 3.612 3.237 3.975 . 0 0 "[ . 1 . 2]" 1
2377 1 90 PHE QE 1 96 PRO QB . . 3.930 2.932 2.616 3.199 . 0 0 "[ . 1 . 2]" 1
2378 1 90 PHE QE 1 96 PRO HB3 . . 4.490 3.111 2.700 3.453 . 0 0 "[ . 1 . 2]" 1
2379 1 90 PHE QE 1 96 PRO QD . . 5.350 4.361 3.685 5.056 . 0 0 "[ . 1 . 2]" 1
2380 1 90 PHE QE 1 96 PRO QG . . 3.660 2.816 2.279 3.569 . 0 0 "[ . 1 . 2]" 1
2381 1 90 PHE HZ 1 96 PRO QB . . 4.780 3.930 3.470 4.179 . 0 0 "[ . 1 . 2]" 1
2382 1 90 PHE HZ 1 96 PRO QG . . 5.170 4.523 3.733 5.170 . 0 0 "[ . 1 . 2]" 1
2383 1 91 GLN H 1 91 GLN HB2 . . 3.820 2.519 2.332 2.725 . 0 0 "[ . 1 . 2]" 1
2384 1 91 GLN H 1 91 GLN QB . . 3.180 2.479 2.302 2.669 . 0 0 "[ . 1 . 2]" 1
2385 1 91 GLN H 1 91 GLN HB3 . . 3.820 3.688 3.560 3.824 0.004 16 0 "[ . 1 . 2]" 1
2386 1 91 GLN H 1 91 GLN QE . . 5.160 4.708 4.075 5.134 . 0 0 "[ . 1 . 2]" 1
2387 1 91 GLN H 1 91 GLN HG2 . . 4.540 4.172 2.623 4.493 . 0 0 "[ . 1 . 2]" 1
2388 1 91 GLN H 1 91 GLN HG3 . . 4.540 3.264 2.689 3.663 . 0 0 "[ . 1 . 2]" 1
2389 1 91 GLN H 1 92 LYS H . . 4.520 4.362 3.582 4.566 0.046 4 0 "[ . 1 . 2]" 1
2390 1 91 GLN H 1 92 LYS HA . . 5.500 5.043 4.645 5.286 . 0 0 "[ . 1 . 2]" 1
2391 1 91 GLN H 1 94 GLU H . . 5.200 4.835 4.522 5.129 . 0 0 "[ . 1 . 2]" 1
2392 1 91 GLN H 1 94 GLU QB . . 5.340 4.424 3.431 5.353 0.013 14 0 "[ . 1 . 2]" 1
2393 1 91 GLN H 1 96 PRO QB . . 4.530 4.078 3.650 4.505 . 0 0 "[ . 1 . 2]" 1
2394 1 91 GLN HA 1 91 GLN QG . . 3.650 2.384 2.242 2.722 . 0 0 "[ . 1 . 2]" 1
2395 1 91 GLN HA 1 92 LYS H . . 2.710 2.234 2.139 2.407 . 0 0 "[ . 1 . 2]" 1
2396 1 91 GLN QB 1 97 VAL QG . . 5.280 4.628 4.334 5.279 . 0 0 "[ . 1 . 2]" 1
2397 1 91 GLN HB2 1 92 LYS H . . 4.400 4.140 3.627 4.453 0.053 15 0 "[ . 1 . 2]" 1
2398 1 91 GLN HB3 1 92 LYS H . . 4.400 3.119 2.422 4.247 . 0 0 "[ . 1 . 2]" 1
2399 1 91 GLN QE 1 91 GLN QG . . 2.890 2.121 2.066 2.213 . 0 0 "[ . 1 . 2]" 1
2400 1 91 GLN QE 1 97 VAL QG . . 3.990 3.230 2.377 3.983 . 0 0 "[ . 1 . 2]" 1
2401 1 91 GLN QE 1 115 LEU QD . . 3.250 1.989 1.793 2.254 . 0 0 "[ . 1 . 2]" 1
2402 1 91 GLN QE 1 115 LEU HG . . 4.670 4.429 3.984 4.673 0.003 9 0 "[ . 1 . 2]" 1
2403 1 91 GLN HE21 1 115 LEU HG . . 5.460 4.957 4.630 5.311 . 0 0 "[ . 1 . 2]" 1
2404 1 91 GLN HE22 1 115 LEU HG . . 5.460 5.021 4.345 5.400 . 0 0 "[ . 1 . 2]" 1
2405 1 91 GLN QG 1 97 VAL QG . . 5.220 4.211 3.485 4.964 . 0 0 "[ . 1 . 2]" 1
2406 1 91 GLN QG 1 119 ASN QD . . 4.860 3.003 2.150 4.540 . 0 0 "[ . 1 . 2]" 1
2407 1 91 GLN HG2 1 92 LYS H . . 5.050 4.254 3.569 5.063 0.013 15 0 "[ . 1 . 2]" 1
2408 1 91 GLN HG3 1 92 LYS H . . 5.050 4.726 4.085 5.065 0.015 15 0 "[ . 1 . 2]" 1
2409 1 92 LYS H 1 92 LYS HB2 . . 2.930 2.465 2.180 2.823 . 0 0 "[ . 1 . 2]" 1
2410 1 92 LYS H 1 92 LYS HB3 . . 2.930 2.633 2.343 2.932 0.002 8 0 "[ . 1 . 2]" 1
2411 1 92 LYS H 1 92 LYS QD . . 4.660 4.179 3.686 4.656 . 0 0 "[ . 1 . 2]" 1
2412 1 92 LYS H 1 92 LYS QE . . 5.500 5.262 4.523 5.573 0.073 16 0 "[ . 1 . 2]" 1
2413 1 92 LYS H 1 92 LYS QG . . 4.950 3.992 3.798 4.095 . 0 0 "[ . 1 . 2]" 1
2414 1 92 LYS HA 1 92 LYS QE . . 4.360 3.532 1.977 4.384 0.024 8 0 "[ . 1 . 2]" 1
2415 1 92 LYS HA 1 92 LYS HG2 . . 3.950 3.591 2.372 3.874 . 0 0 "[ . 1 . 2]" 1
2416 1 92 LYS HA 1 92 LYS QG . . 3.440 2.636 2.180 2.872 . 0 0 "[ . 1 . 2]" 1
2417 1 92 LYS HA 1 92 LYS HG3 . . 3.950 2.768 2.220 3.611 . 0 0 "[ . 1 . 2]" 1
2418 1 92 LYS HA 1 93 GLY H . . 2.940 2.167 2.144 2.243 . 0 0 "[ . 1 . 2]" 1
2419 1 92 LYS HA 1 94 GLU H . . 4.310 3.938 3.246 4.231 . 0 0 "[ . 1 . 2]" 1
2420 1 92 LYS QB 1 92 LYS QD . . 3.220 2.195 2.002 2.609 . 0 0 "[ . 1 . 2]" 1
2421 1 92 LYS QB 1 92 LYS QE . . 3.700 3.221 2.112 3.694 . 0 0 "[ . 1 . 2]" 1
2422 1 92 LYS QB 1 93 GLY QA . . 5.180 4.198 4.029 4.439 . 0 0 "[ . 1 . 2]" 1
2423 1 92 LYS HB2 1 92 LYS QE . . 4.400 3.461 2.135 4.041 . 0 0 "[ . 1 . 2]" 1
2424 1 92 LYS HB2 1 93 GLY H . . 4.520 4.347 4.067 4.530 0.010 7 0 "[ . 1 . 2]" 1
2425 1 92 LYS HB3 1 92 LYS QE . . 4.400 3.997 2.805 4.320 . 0 0 "[ . 1 . 2]" 1
2426 1 92 LYS HB3 1 93 GLY H . . 4.520 4.197 3.777 4.529 0.009 15 0 "[ . 1 . 2]" 1
2427 1 92 LYS QD 1 93 GLY H . . 5.180 3.826 2.355 5.172 . 0 0 "[ . 1 . 2]" 1
2428 1 92 LYS QE 1 92 LYS QG . . 3.440 2.142 2.023 2.472 . 0 0 "[ . 1 . 2]" 1
2429 1 92 LYS QE 1 93 GLY H . . 5.500 4.014 1.975 5.220 . 0 0 "[ . 1 . 2]" 1
2430 1 92 LYS QG 1 93 GLY H . . 3.900 2.997 2.238 3.687 . 0 0 "[ . 1 . 2]" 1
2431 1 93 GLY H 1 94 GLU H . . 3.280 3.012 2.326 3.283 0.003 20 0 "[ . 1 . 2]" 1
2432 1 93 GLY QA 1 94 GLU QG . . 5.180 3.727 3.088 4.713 . 0 0 "[ . 1 . 2]" 1
2433 1 94 GLU H 1 94 GLU QB . . 2.950 2.542 2.209 2.905 . 0 0 "[ . 1 . 2]" 1
2434 1 94 GLU H 1 94 GLU QG . . 3.100 2.713 2.011 3.100 . 0 0 "[ . 1 . 2]" 1
2435 1 94 GLU H 1 95 SER H . . 4.600 4.438 2.640 4.618 0.018 2 0 "[ . 1 . 2]" 1
2436 1 94 GLU QB 1 95 SER H . . 3.070 2.329 1.917 2.557 . 0 0 "[ . 1 . 2]" 1
2437 1 94 GLU HB2 1 95 SER H . . 3.700 3.330 1.950 3.709 0.009 10 0 "[ . 1 . 2]" 1
2438 1 94 GLU HB3 1 95 SER H . . 3.700 2.611 2.112 3.682 . 0 0 "[ . 1 . 2]" 1
2439 1 95 SER H 1 95 SER HB2 . . 3.620 3.085 2.196 3.639 0.019 5 0 "[ . 1 . 2]" 1
2440 1 95 SER H 1 95 SER QB . . 2.970 2.416 2.175 2.972 0.002 15 0 "[ . 1 . 2]" 1
2441 1 95 SER H 1 95 SER HB3 . . 3.620 2.853 2.215 3.592 . 0 0 "[ . 1 . 2]" 1
2442 1 96 PRO HA 1 97 VAL H . . 2.740 2.286 2.172 2.485 . 0 0 "[ . 1 . 2]" 1
2443 1 96 PRO HA 1 97 VAL QG . . 4.220 3.255 3.079 3.837 . 0 0 "[ . 1 . 2]" 1
2444 1 96 PRO QB 1 97 VAL H . . 3.370 2.835 2.357 3.191 . 0 0 "[ . 1 . 2]" 1
2445 1 96 PRO HB2 1 97 VAL H . . 4.130 2.960 2.408 3.386 . 0 0 "[ . 1 . 2]" 1
2446 1 96 PRO HB3 1 97 VAL H . . 4.130 3.649 3.354 3.903 . 0 0 "[ . 1 . 2]" 1
2447 1 97 VAL H 1 97 VAL HB . . 3.740 3.568 2.644 3.771 0.031 15 0 "[ . 1 . 2]" 1
2448 1 97 VAL H 1 97 VAL MG1 . . 4.130 3.126 2.359 3.862 . 0 0 "[ . 1 . 2]" 1
2449 1 97 VAL H 1 97 VAL QG . . 2.920 1.980 1.838 2.948 0.028 7 0 "[ . 1 . 2]" 1
2450 1 97 VAL H 1 97 VAL MG2 . . 4.130 2.085 1.855 3.986 . 0 0 "[ . 1 . 2]" 1
2451 1 97 VAL H 1 98 ASP H . . 4.670 4.471 4.397 4.558 . 0 0 "[ . 1 . 2]" 1
2452 1 97 VAL H 1 98 ASP HA . . 5.500 4.955 4.732 5.180 . 0 0 "[ . 1 . 2]" 1
2453 1 97 VAL HA 1 98 ASP H . . 3.070 2.471 2.231 2.630 . 0 0 "[ . 1 . 2]" 1
2454 1 97 VAL HA 1 98 ASP QB . . 4.550 4.190 3.995 4.549 . 0 0 "[ . 1 . 2]" 1
2455 1 97 VAL HB 1 98 ASP H . . 3.820 2.437 1.907 3.786 . 0 0 "[ . 1 . 2]" 1
2456 1 97 VAL QG 1 98 ASP H . . 3.640 2.865 1.747 3.365 . 0 0 "[ . 1 . 2]" 1
2457 1 97 VAL QG 1 98 ASP QB . . 4.600 4.408 3.552 4.605 0.005 5 0 "[ . 1 . 2]" 1
2458 1 97 VAL MG1 1 98 ASP H . . 4.150 3.199 1.749 3.721 . 0 0 "[ . 1 . 2]" 1
2459 1 97 VAL MG1 1 98 ASP QB . . 5.500 4.980 3.594 5.298 . 0 0 "[ . 1 . 2]" 1
2460 1 97 VAL MG2 1 98 ASP H . . 4.150 3.455 1.772 3.839 . 0 0 "[ . 1 . 2]" 1
2461 1 97 VAL MG2 1 98 ASP QB . . 5.500 5.035 4.002 5.547 0.047 10 0 "[ . 1 . 2]" 1
2462 1 98 ASP H 1 98 ASP QB . . 3.290 2.659 2.224 2.987 . 0 0 "[ . 1 . 2]" 1
2463 1 98 ASP HA 1 99 TYR H . . 2.880 2.158 2.139 2.316 . 0 0 "[ . 1 . 2]" 1
2464 1 98 ASP HA 1 99 TYR HB2 . . 4.940 4.619 4.501 4.736 . 0 0 "[ . 1 . 2]" 1
2465 1 98 ASP QB 1 99 TYR H . . 3.920 3.545 3.186 3.892 . 0 0 "[ . 1 . 2]" 1
2466 1 99 TYR H 1 99 TYR HB2 . . 3.420 2.596 2.420 2.722 . 0 0 "[ . 1 . 2]" 1
2467 1 99 TYR H 1 99 TYR HB3 . . 3.350 2.511 2.432 2.645 . 0 0 "[ . 1 . 2]" 1
2468 1 99 TYR H 1 99 TYR QD . . 4.290 4.196 4.156 4.220 . 0 0 "[ . 1 . 2]" 1
2469 1 99 TYR HA 1 99 TYR QD . . 3.720 2.881 2.209 3.169 . 0 0 "[ . 1 . 2]" 1
2470 1 99 TYR HA 1 99 TYR QE . . 5.500 4.664 4.419 4.780 . 0 0 "[ . 1 . 2]" 1
2471 1 99 TYR QD 1 101 GLY H . . 4.320 3.086 2.136 4.272 . 0 0 "[ . 1 . 2]" 1
2472 1 99 TYR QD 1 108 ILE MG . . 5.500 4.767 4.043 5.023 . 0 0 "[ . 1 . 2]" 1
2473 1 99 TYR QD 1 111 ARG HD2 . . 5.060 4.364 3.458 4.901 . 0 0 "[ . 1 . 2]" 1
2474 1 99 TYR QD 1 111 ARG QD . . 4.290 3.836 3.271 4.224 . 0 0 "[ . 1 . 2]" 1
2475 1 99 TYR QD 1 111 ARG HD3 . . 5.060 4.515 3.374 5.070 0.010 12 0 "[ . 1 . 2]" 1
2476 1 99 TYR QD 1 111 ARG QG . . 3.710 2.175 1.992 2.665 . 0 0 "[ . 1 . 2]" 1
2477 1 99 TYR QE 1 101 GLY H . . 4.480 3.031 2.250 4.055 . 0 0 "[ . 1 . 2]" 1
2478 1 99 TYR QE 1 101 GLY QA . . 4.140 3.282 2.075 4.115 . 0 0 "[ . 1 . 2]" 1
2479 1 99 TYR QE 1 102 GLY H . . 4.480 3.654 2.189 4.453 . 0 0 "[ . 1 . 2]" 1
2480 1 99 TYR QE 1 102 GLY QA . . 5.340 4.252 2.954 5.214 . 0 0 "[ . 1 . 2]" 1
2481 1 99 TYR QE 1 103 ARG HA . . 4.310 3.802 2.716 4.265 . 0 0 "[ . 1 . 2]" 1
2482 1 99 TYR QE 1 104 THR H . . 5.470 4.792 3.966 5.433 . 0 0 "[ . 1 . 2]" 1
2483 1 99 TYR QE 1 107 ASP HB2 . . 5.500 4.312 3.881 4.752 . 0 0 "[ . 1 . 2]" 1
2484 1 99 TYR QE 1 107 ASP HB3 . . 5.490 4.069 3.753 4.386 . 0 0 "[ . 1 . 2]" 1
2485 1 99 TYR QE 1 108 ILE H . . 4.760 4.494 3.738 4.773 0.013 15 0 "[ . 1 . 2]" 1
2486 1 99 TYR QE 1 108 ILE HA . . 3.920 3.107 2.716 3.648 . 0 0 "[ . 1 . 2]" 1
2487 1 99 TYR QE 1 108 ILE HG13 . . 5.110 3.754 2.679 4.274 . 0 0 "[ . 1 . 2]" 1
2488 1 99 TYR QE 1 108 ILE MG . . 4.880 4.199 3.523 4.792 . 0 0 "[ . 1 . 2]" 1
2489 1 99 TYR QE 1 111 ARG H . . 4.340 3.906 3.667 4.325 . 0 0 "[ . 1 . 2]" 1
2490 1 99 TYR QE 1 111 ARG HA . . 4.740 4.404 4.312 4.510 . 0 0 "[ . 1 . 2]" 1
2491 1 99 TYR QE 1 111 ARG HB2 . . 3.710 2.044 1.991 2.237 . 0 0 "[ . 1 . 2]" 1
2492 1 99 TYR QE 1 111 ARG HB3 . . 3.710 2.445 2.001 3.167 . 0 0 "[ . 1 . 2]" 1
2493 1 99 TYR QE 1 111 ARG HD2 . . 4.730 4.408 3.602 4.740 0.010 13 0 "[ . 1 . 2]" 1
2494 1 99 TYR QE 1 111 ARG QD . . 4.050 3.611 2.679 4.046 . 0 0 "[ . 1 . 2]" 1
2495 1 99 TYR QE 1 111 ARG HD3 . . 4.730 3.978 2.713 4.721 . 0 0 "[ . 1 . 2]" 1
2496 1 99 TYR QE 1 111 ARG HG2 . . 3.900 2.567 2.169 3.759 . 0 0 "[ . 1 . 2]" 1
2497 1 99 TYR QE 1 111 ARG HG3 . . 3.900 3.561 2.044 3.911 0.011 9 0 "[ . 1 . 2]" 1
2498 1 99 TYR QE 1 112 ALA H . . 5.050 4.576 4.247 5.054 0.004 17 0 "[ . 1 . 2]" 1
2499 1 99 TYR HH 1 102 GLY H . . 4.220 3.388 2.660 4.088 . 0 0 "[ . 1 . 2]" 1
2500 1 99 TYR HH 1 104 THR H . . 4.770 4.178 3.500 4.623 . 0 0 "[ . 1 . 2]" 1
2501 1 101 GLY H 1 102 GLY H . . 4.620 3.855 1.786 4.631 0.011 12 0 "[ . 1 . 2]" 1
2502 1 101 GLY QA 1 102 GLY H . . 2.860 2.284 2.118 2.917 0.057 6 0 "[ . 1 . 2]" 1
2503 1 101 GLY HA2 1 102 GLY H . . 3.270 3.025 2.481 3.416 0.146 16 0 "[ . 1 . 2]" 1
2504 1 101 GLY HA3 1 102 GLY H . . 3.270 2.400 2.150 3.359 0.089 13 0 "[ . 1 . 2]" 1
2505 1 102 GLY H 1 107 ASP HB3 . . 3.630 3.278 2.706 3.637 0.007 10 0 "[ . 1 . 2]" 1
2506 1 102 GLY QA 1 104 THR H . . 3.930 3.273 2.986 3.718 . 0 0 "[ . 1 . 2]" 1
2507 1 102 GLY QA 1 107 ASP HB2 . . 4.530 3.035 2.143 3.863 . 0 0 "[ . 1 . 2]" 1
2508 1 102 GLY QA 1 107 ASP HB3 . . 4.410 3.459 2.217 4.387 . 0 0 "[ . 1 . 2]" 1
2509 1 102 GLY HA2 1 104 THR H . . 4.620 4.155 3.613 4.621 0.001 20 0 "[ . 1 . 2]" 1
2510 1 102 GLY HA2 1 107 ASP HB2 . . 5.260 4.530 3.552 5.225 . 0 0 "[ . 1 . 2]" 1
2511 1 102 GLY HA3 1 104 THR H . . 4.620 3.433 3.135 3.920 . 0 0 "[ . 1 . 2]" 1
2512 1 102 GLY HA3 1 107 ASP HB2 . . 5.260 3.088 2.160 4.000 . 0 0 "[ . 1 . 2]" 1
2513 1 103 ARG H 1 103 ARG QG . . 4.970 3.273 1.888 4.095 . 0 0 "[ . 1 . 2]" 1
2514 1 103 ARG H 1 104 THR H . . 4.190 2.947 2.622 3.382 . 0 0 "[ . 1 . 2]" 1
2515 1 103 ARG HA 1 103 ARG HD2 . . 4.850 4.548 3.813 4.889 0.039 15 0 "[ . 1 . 2]" 1
2516 1 103 ARG HA 1 103 ARG QD . . 4.230 3.972 3.695 4.261 0.031 16 0 "[ . 1 . 2]" 1
2517 1 103 ARG HA 1 103 ARG HD3 . . 4.850 4.441 3.991 4.954 0.104 7 0 "[ . 1 . 2]" 1
2518 1 103 ARG HA 1 103 ARG HG2 . . 4.140 2.979 2.284 4.209 0.069 14 0 "[ . 1 . 2]" 1
2519 1 103 ARG HA 1 103 ARG QG . . 3.630 2.610 2.211 3.417 . 0 0 "[ . 1 . 2]" 1
2520 1 103 ARG HA 1 103 ARG HG3 . . 4.140 3.038 2.416 4.205 0.065 7 0 "[ . 1 . 2]" 1
2521 1 103 ARG HA 1 104 THR H . . 3.190 2.834 2.670 3.019 . 0 0 "[ . 1 . 2]" 1
2522 1 103 ARG HA 1 108 ILE MD . . 4.320 2.873 2.354 3.277 . 0 0 "[ . 1 . 2]" 1
2523 1 103 ARG QB 1 103 ARG QD . . 3.150 2.214 2.058 2.571 . 0 0 "[ . 1 . 2]" 1
2524 1 103 ARG QB 1 104 THR H . . 4.190 3.909 3.736 4.044 . 0 0 "[ . 1 . 2]" 1
2525 1 103 ARG HB2 1 103 ARG HD2 . . 4.070 3.117 2.306 3.829 . 0 0 "[ . 1 . 2]" 1
2526 1 103 ARG HB2 1 103 ARG HD3 . . 4.070 3.056 2.126 4.197 0.127 7 0 "[ . 1 . 2]" 1
2527 1 103 ARG HB2 1 104 THR H . . 4.770 4.418 4.022 4.636 . 0 0 "[ . 1 . 2]" 1
2528 1 103 ARG HB3 1 103 ARG HD2 . . 4.070 3.098 2.202 3.910 . 0 0 "[ . 1 . 2]" 1
2529 1 103 ARG HB3 1 103 ARG HD3 . . 4.070 2.995 2.346 3.650 . 0 0 "[ . 1 . 2]" 1
2530 1 103 ARG HB3 1 104 THR H . . 4.770 4.387 4.186 4.612 . 0 0 "[ . 1 . 2]" 1
2531 1 103 ARG QD 1 108 ILE MD . . 5.340 5.090 3.780 5.333 . 0 0 "[ . 1 . 2]" 1
2532 1 103 ARG HG2 1 104 THR H . . 5.220 4.731 3.609 5.225 0.005 12 0 "[ . 1 . 2]" 1
2533 1 103 ARG HG2 1 108 ILE MD . . 5.500 4.372 3.458 5.501 0.001 14 0 "[ . 1 . 2]" 1
2534 1 103 ARG HG3 1 104 THR H . . 5.220 4.874 3.663 5.238 0.018 7 0 "[ . 1 . 2]" 1
2535 1 103 ARG HG3 1 108 ILE MD . . 5.500 4.661 3.863 5.515 0.015 12 0 "[ . 1 . 2]" 1
2536 1 104 THR H 1 104 THR HB . . 3.850 3.689 2.940 3.876 0.026 6 0 "[ . 1 . 2]" 1
2537 1 104 THR H 1 104 THR MG . . 3.870 3.110 2.590 3.950 0.080 10 0 "[ . 1 . 2]" 1
2538 1 104 THR H 1 105 ARG H . . 4.700 4.385 4.189 4.518 . 0 0 "[ . 1 . 2]" 1
2539 1 104 THR H 1 106 SER H . . 5.120 4.847 4.639 5.062 . 0 0 "[ . 1 . 2]" 1
2540 1 104 THR H 1 107 ASP H . . 4.050 3.700 3.513 3.858 . 0 0 "[ . 1 . 2]" 1
2541 1 104 THR H 1 107 ASP HB2 . . 3.260 2.848 2.481 3.108 . 0 0 "[ . 1 . 2]" 1
2542 1 104 THR H 1 107 ASP HB3 . . 4.870 4.479 4.120 4.782 . 0 0 "[ . 1 . 2]" 1
2543 1 104 THR H 1 108 ILE H . . 4.110 3.421 2.984 3.706 . 0 0 "[ . 1 . 2]" 1
2544 1 104 THR H 1 108 ILE HB . . 5.500 5.039 4.213 5.402 . 0 0 "[ . 1 . 2]" 1
2545 1 104 THR H 1 108 ILE MD . . 3.620 3.094 2.450 3.456 . 0 0 "[ . 1 . 2]" 1
2546 1 104 THR H 1 108 ILE HG13 . . 3.950 3.024 2.250 3.411 . 0 0 "[ . 1 . 2]" 1
2547 1 104 THR HA 1 105 ARG H . . 3.180 2.190 2.153 2.324 . 0 0 "[ . 1 . 2]" 1
2548 1 104 THR HB 1 105 ARG H . . 3.480 3.148 3.017 3.492 0.012 12 0 "[ . 1 . 2]" 1
2549 1 104 THR HB 1 106 SER H . . 3.480 2.697 2.487 2.892 . 0 0 "[ . 1 . 2]" 1
2550 1 104 THR HB 1 106 SER QB . . 4.560 3.107 2.665 3.866 . 0 0 "[ . 1 . 2]" 1
2551 1 104 THR HB 1 107 ASP H . . 4.290 3.615 2.711 4.072 . 0 0 "[ . 1 . 2]" 1
2552 1 104 THR HB 1 107 ASP HB2 . . 5.500 4.935 3.962 5.447 . 0 0 "[ . 1 . 2]" 1
2553 1 104 THR HB 1 108 ILE MD . . 5.500 4.677 4.359 4.944 . 0 0 "[ . 1 . 2]" 1
2554 1 104 THR MG 1 105 ARG H . . 3.900 3.606 1.915 3.916 0.016 7 0 "[ . 1 . 2]" 1
2555 1 104 THR MG 1 106 SER H . . 4.470 4.118 2.636 4.447 . 0 0 "[ . 1 . 2]" 1
2556 1 105 ARG H 1 105 ARG HB2 . . 3.670 3.527 3.489 3.563 . 0 0 "[ . 1 . 2]" 1
2557 1 105 ARG H 1 105 ARG HB3 . . 3.670 2.240 2.189 2.306 . 0 0 "[ . 1 . 2]" 1
2558 1 105 ARG H 1 105 ARG HD2 . . 4.940 4.762 4.550 4.932 . 0 0 "[ . 1 . 2]" 1
2559 1 105 ARG H 1 105 ARG HD3 . . 4.580 3.744 3.439 3.996 . 0 0 "[ . 1 . 2]" 1
2560 1 105 ARG H 1 105 ARG HG2 . . 3.620 2.907 2.716 3.067 . 0 0 "[ . 1 . 2]" 1
2561 1 105 ARG H 1 105 ARG HG3 . . 4.190 4.117 3.974 4.191 0.001 16 0 "[ . 1 . 2]" 1
2562 1 105 ARG H 1 106 SER H . . 3.550 2.941 2.766 2.999 . 0 0 "[ . 1 . 2]" 1
2563 1 105 ARG H 1 107 ASP H . . 4.900 4.767 4.505 4.901 0.001 2 0 "[ . 1 . 2]" 1
2564 1 105 ARG H 1 108 ILE MD . . 4.440 3.007 2.683 3.335 . 0 0 "[ . 1 . 2]" 1
2565 1 105 ARG HA 1 105 ARG HD2 . . 4.830 4.814 4.754 4.845 0.015 2 0 "[ . 1 . 2]" 1
2566 1 105 ARG HA 1 105 ARG HD3 . . 4.880 4.762 4.701 4.820 . 0 0 "[ . 1 . 2]" 1
2567 1 105 ARG HA 1 105 ARG HG2 . . 4.080 3.696 3.648 3.768 . 0 0 "[ . 1 . 2]" 1
2568 1 105 ARG HA 1 108 ILE H . . 4.190 3.766 3.573 4.028 . 0 0 "[ . 1 . 2]" 1
2569 1 105 ARG HA 1 108 ILE HB . . 3.670 2.357 2.227 2.609 . 0 0 "[ . 1 . 2]" 1
2570 1 105 ARG HA 1 108 ILE MD . . 3.540 2.424 1.980 2.822 . 0 0 "[ . 1 . 2]" 1
2571 1 105 ARG HA 1 108 ILE MG . . 4.590 3.651 3.535 3.907 . 0 0 "[ . 1 . 2]" 1
2572 1 105 ARG HA 1 109 VAL H . . 4.210 3.561 3.357 3.775 . 0 0 "[ . 1 . 2]" 1
2573 1 105 ARG HA 1 109 VAL MG2 . . 4.260 3.187 2.984 3.352 . 0 0 "[ . 1 . 2]" 1
2574 1 105 ARG QB 1 105 ARG HD2 . . 3.530 2.452 2.400 2.491 . 0 0 "[ . 1 . 2]" 1
2575 1 105 ARG QB 1 106 SER H . . 3.570 3.434 3.355 3.487 . 0 0 "[ . 1 . 2]" 1
2576 1 105 ARG QB 1 108 ILE MD . . 4.710 3.645 3.418 3.885 . 0 0 "[ . 1 . 2]" 1
2577 1 105 ARG HB2 1 105 ARG HD2 . . 4.060 2.692 2.569 2.783 . 0 0 "[ . 1 . 2]" 1
2578 1 105 ARG HB2 1 105 ARG HD3 . . 3.860 3.248 3.090 3.383 . 0 0 "[ . 1 . 2]" 1
2579 1 105 ARG HB2 1 106 SER H . . 4.100 3.997 3.877 4.093 . 0 0 "[ . 1 . 2]" 1
2580 1 105 ARG HB3 1 105 ARG HD2 . . 4.060 2.844 2.692 3.011 . 0 0 "[ . 1 . 2]" 1
2581 1 105 ARG HB3 1 105 ARG HD3 . . 3.860 2.360 2.327 2.417 . 0 0 "[ . 1 . 2]" 1
2582 1 105 ARG HB3 1 106 SER H . . 4.100 3.743 3.633 3.818 . 0 0 "[ . 1 . 2]" 1
2583 1 105 ARG HD2 1 106 SER H . . 5.120 4.915 4.784 5.058 . 0 0 "[ . 1 . 2]" 1
2584 1 105 ARG HD2 1 109 VAL MG2 . . 4.690 4.573 4.328 4.693 0.003 11 0 "[ . 1 . 2]" 1
2585 1 105 ARG HG2 1 106 SER H . . 3.480 2.026 1.910 2.290 . 0 0 "[ . 1 . 2]" 1
2586 1 105 ARG HG2 1 106 SER HA . . 4.740 3.673 3.533 3.837 . 0 0 "[ . 1 . 2]" 1
2587 1 105 ARG HG2 1 109 VAL MG2 . . 4.670 4.510 4.343 4.658 . 0 0 "[ . 1 . 2]" 1
2588 1 105 ARG HG3 1 106 SER H . . 3.570 2.998 2.806 3.143 . 0 0 "[ . 1 . 2]" 1
2589 1 105 ARG HG3 1 106 SER HA . . 4.380 3.247 3.093 3.379 . 0 0 "[ . 1 . 2]" 1
2590 1 105 ARG HG3 1 109 VAL MG1 . . 5.500 5.241 5.037 5.446 . 0 0 "[ . 1 . 2]" 1
2591 1 105 ARG HG3 1 109 VAL MG2 . . 4.210 3.307 3.154 3.427 . 0 0 "[ . 1 . 2]" 1
2592 1 106 SER H 1 106 SER QB . . 3.020 2.335 2.153 2.585 . 0 0 "[ . 1 . 2]" 1
2593 1 106 SER H 1 107 ASP H . . 3.280 2.895 2.618 3.036 . 0 0 "[ . 1 . 2]" 1
2594 1 106 SER H 1 107 ASP HB2 . . 5.160 5.057 4.855 5.166 0.006 17 0 "[ . 1 . 2]" 1
2595 1 106 SER H 1 108 ILE H . . 4.650 4.324 4.181 4.434 . 0 0 "[ . 1 . 2]" 1
2596 1 106 SER HA 1 108 ILE H . . 5.080 5.071 5.030 5.094 0.014 17 0 "[ . 1 . 2]" 1
2597 1 106 SER HA 1 109 VAL H . . 4.340 4.124 3.997 4.239 . 0 0 "[ . 1 . 2]" 1
2598 1 106 SER HA 1 109 VAL HB . . 3.600 3.440 3.205 3.605 0.005 17 0 "[ . 1 . 2]" 1
2599 1 106 SER HA 1 109 VAL MG2 . . 4.050 3.781 3.553 4.045 . 0 0 "[ . 1 . 2]" 1
2600 1 106 SER QB 1 107 ASP H . . 3.930 2.359 2.115 3.200 . 0 0 "[ . 1 . 2]" 1
2601 1 106 SER QB 1 110 SER H . . 5.340 5.086 4.828 5.343 0.003 18 0 "[ . 1 . 2]" 1
2602 1 107 ASP H 1 107 ASP HB2 . . 3.550 2.454 2.265 2.682 . 0 0 "[ . 1 . 2]" 1
2603 1 107 ASP H 1 107 ASP HB3 . . 3.970 3.592 3.545 3.626 . 0 0 "[ . 1 . 2]" 1
2604 1 107 ASP H 1 108 ILE H . . 3.250 2.671 2.513 2.837 . 0 0 "[ . 1 . 2]" 1
2605 1 107 ASP H 1 108 ILE HB . . 4.920 4.755 4.606 4.909 . 0 0 "[ . 1 . 2]" 1
2606 1 107 ASP H 1 108 ILE HG13 . . 5.500 4.281 4.055 4.457 . 0 0 "[ . 1 . 2]" 1
2607 1 107 ASP H 1 109 VAL H . . 4.420 4.103 3.969 4.213 . 0 0 "[ . 1 . 2]" 1
2608 1 107 ASP H 1 110 SER H . . 4.800 4.670 4.546 4.808 0.008 12 0 "[ . 1 . 2]" 1
2609 1 107 ASP HA 1 110 SER H . . 3.720 3.316 3.214 3.422 . 0 0 "[ . 1 . 2]" 1
2610 1 107 ASP HA 1 110 SER HB2 . . 4.270 3.096 2.664 3.384 . 0 0 "[ . 1 . 2]" 1
2611 1 107 ASP HA 1 110 SER QB . . 3.700 2.411 2.200 2.661 . 0 0 "[ . 1 . 2]" 1
2612 1 107 ASP HA 1 110 SER HB3 . . 4.270 2.576 2.229 3.020 . 0 0 "[ . 1 . 2]" 1
2613 1 107 ASP HB2 1 108 ILE H . . 3.490 2.368 2.228 2.512 . 0 0 "[ . 1 . 2]" 1
2614 1 107 ASP HB2 1 109 VAL H . . 5.330 4.933 4.833 5.038 . 0 0 "[ . 1 . 2]" 1
2615 1 107 ASP HB2 1 110 SER H . . 5.500 5.499 5.477 5.515 0.015 17 0 "[ . 1 . 2]" 1
2616 1 107 ASP HB3 1 108 ILE H . . 4.250 3.385 3.106 3.555 . 0 0 "[ . 1 . 2]" 1
2617 1 107 ASP HB3 1 108 ILE HA . . 4.810 4.318 4.060 4.529 . 0 0 "[ . 1 . 2]" 1
2618 1 107 ASP HB3 1 111 ARG H . . 5.500 5.005 4.777 5.427 . 0 0 "[ . 1 . 2]" 1
2619 1 108 ILE H 1 108 ILE HB . . 3.140 2.628 2.573 2.660 . 0 0 "[ . 1 . 2]" 1
2620 1 108 ILE H 1 108 ILE MD . . 3.320 3.174 3.073 3.316 . 0 0 "[ . 1 . 2]" 1
2621 1 108 ILE H 1 108 ILE HG12 . . 4.070 3.477 3.358 3.560 . 0 0 "[ . 1 . 2]" 1
2622 1 108 ILE H 1 108 ILE HG13 . . 3.210 1.967 1.912 2.058 . 0 0 "[ . 1 . 2]" 1
2623 1 108 ILE H 1 108 ILE MG . . 3.980 3.771 3.767 3.777 . 0 0 "[ . 1 . 2]" 1
2624 1 108 ILE H 1 109 VAL H . . 3.280 2.913 2.839 2.995 . 0 0 "[ . 1 . 2]" 1
2625 1 108 ILE H 1 109 VAL HA . . 5.500 5.477 5.425 5.533 0.033 12 0 "[ . 1 . 2]" 1
2626 1 108 ILE H 1 109 VAL MG2 . . 4.780 4.622 4.455 4.751 . 0 0 "[ . 1 . 2]" 1
2627 1 108 ILE H 1 110 SER H . . 4.630 4.403 4.306 4.501 . 0 0 "[ . 1 . 2]" 1
2628 1 108 ILE H 1 111 ARG QB . . 5.340 5.183 4.921 5.344 0.004 19 0 "[ . 1 . 2]" 1
2629 1 108 ILE HA 1 108 ILE MD . . 4.060 3.875 3.862 3.887 . 0 0 "[ . 1 . 2]" 1
2630 1 108 ILE HA 1 108 ILE HG12 . . 3.260 2.759 2.669 2.824 . 0 0 "[ . 1 . 2]" 1
2631 1 108 ILE HA 1 108 ILE HG13 . . 3.570 2.728 2.657 2.839 . 0 0 "[ . 1 . 2]" 1
2632 1 108 ILE HA 1 108 ILE MG . . 3.310 2.426 2.334 2.479 . 0 0 "[ . 1 . 2]" 1
2633 1 108 ILE HA 1 110 SER H . . 5.190 4.799 4.667 4.879 . 0 0 "[ . 1 . 2]" 1
2634 1 108 ILE HA 1 111 ARG H . . 4.090 3.965 3.684 4.032 . 0 0 "[ . 1 . 2]" 1
2635 1 108 ILE HA 1 111 ARG QB . . 4.460 3.352 2.904 3.534 . 0 0 "[ . 1 . 2]" 1
2636 1 108 ILE HA 1 112 ALA H . . 5.070 4.451 4.040 4.622 . 0 0 "[ . 1 . 2]" 1
2637 1 108 ILE HB 1 108 ILE MD . . 3.420 2.234 2.103 2.335 . 0 0 "[ . 1 . 2]" 1
2638 1 108 ILE HB 1 109 VAL H . . 3.300 2.592 2.448 2.744 . 0 0 "[ . 1 . 2]" 1
2639 1 108 ILE HB 1 109 VAL MG2 . . 4.330 3.226 3.034 3.390 . 0 0 "[ . 1 . 2]" 1
2640 1 108 ILE HB 1 110 SER H . . 5.290 5.090 4.937 5.161 . 0 0 "[ . 1 . 2]" 1
2641 1 108 ILE MD 1 108 ILE MG . . 2.770 2.352 2.163 2.461 . 0 0 "[ . 1 . 2]" 1
2642 1 108 ILE MD 1 109 VAL H . . 5.110 4.320 4.233 4.484 . 0 0 "[ . 1 . 2]" 1
2643 1 108 ILE HG12 1 108 ILE MG . . 2.900 2.132 2.041 2.250 . 0 0 "[ . 1 . 2]" 1
2644 1 108 ILE HG13 1 108 ILE MG . . 3.560 3.150 3.128 3.180 . 0 0 "[ . 1 . 2]" 1
2645 1 108 ILE HG13 1 109 VAL H . . 4.360 4.281 4.219 4.361 0.001 13 0 "[ . 1 . 2]" 1
2646 1 108 ILE MG 1 109 VAL H . . 3.690 3.426 3.240 3.544 . 0 0 "[ . 1 . 2]" 1
2647 1 108 ILE MG 1 109 VAL HA . . 4.170 3.462 3.255 3.577 . 0 0 "[ . 1 . 2]" 1
2648 1 108 ILE MG 1 109 VAL MG2 . . 3.730 3.281 2.968 3.417 . 0 0 "[ . 1 . 2]" 1
2649 1 108 ILE MG 1 111 ARG H . . 5.010 4.886 4.509 5.013 0.003 5 0 "[ . 1 . 2]" 1
2650 1 108 ILE MG 1 112 ALA H . . 4.510 4.163 3.681 4.354 . 0 0 "[ . 1 . 2]" 1
2651 1 108 ILE MG 1 112 ALA MB . . 3.880 3.591 3.204 3.802 . 0 0 "[ . 1 . 2]" 1
2652 1 109 VAL H 1 109 VAL HB . . 2.990 2.430 2.352 2.508 . 0 0 "[ . 1 . 2]" 1
2653 1 109 VAL H 1 109 VAL MG1 . . 3.870 3.745 3.714 3.763 . 0 0 "[ . 1 . 2]" 1
2654 1 109 VAL H 1 109 VAL MG2 . . 3.020 2.455 2.221 2.654 . 0 0 "[ . 1 . 2]" 1
2655 1 109 VAL H 1 110 SER H . . 3.090 2.599 2.501 2.728 . 0 0 "[ . 1 . 2]" 1
2656 1 109 VAL H 1 110 SER HB2 . . 5.500 4.902 4.601 5.159 . 0 0 "[ . 1 . 2]" 1
2657 1 109 VAL H 1 110 SER HB3 . . 5.500 4.769 4.508 5.268 . 0 0 "[ . 1 . 2]" 1
2658 1 109 VAL HA 1 109 VAL MG1 . . 3.620 2.487 2.441 2.529 . 0 0 "[ . 1 . 2]" 1
2659 1 109 VAL HA 1 109 VAL MG2 . . 3.100 2.292 2.195 2.404 . 0 0 "[ . 1 . 2]" 1
2660 1 109 VAL HA 1 110 SER HA . . 5.500 4.884 4.828 4.916 . 0 0 "[ . 1 . 2]" 1
2661 1 109 VAL HA 1 111 ARG H . . 4.790 4.193 3.645 4.381 . 0 0 "[ . 1 . 2]" 1
2662 1 109 VAL HA 1 112 ALA H . . 3.810 3.454 3.197 3.626 . 0 0 "[ . 1 . 2]" 1
2663 1 109 VAL HA 1 112 ALA MB . . 3.210 2.546 2.395 2.777 . 0 0 "[ . 1 . 2]" 1
2664 1 109 VAL HA 1 113 LEU H . . 4.480 4.338 4.109 4.490 0.010 9 0 "[ . 1 . 2]" 1
2665 1 109 VAL HA 1 113 LEU HG . . 5.500 4.540 4.111 4.972 . 0 0 "[ . 1 . 2]" 1
2666 1 109 VAL HB 1 110 SER H . . 3.070 2.501 2.437 2.580 . 0 0 "[ . 1 . 2]" 1
2667 1 109 VAL HB 1 110 SER QB . . 4.420 4.172 4.032 4.256 . 0 0 "[ . 1 . 2]" 1
2668 1 109 VAL HB 1 112 ALA MB . . 5.460 5.030 4.895 5.205 . 0 0 "[ . 1 . 2]" 1
2669 1 109 VAL MG1 1 110 SER H . . 3.440 3.190 2.977 3.351 . 0 0 "[ . 1 . 2]" 1
2670 1 109 VAL MG1 1 110 SER HA . . 3.650 3.239 3.039 3.482 . 0 0 "[ . 1 . 2]" 1
2671 1 109 VAL MG1 1 112 ALA MB . . 3.980 3.407 3.179 3.638 . 0 0 "[ . 1 . 2]" 1
2672 1 109 VAL MG1 1 113 LEU H . . 4.330 3.938 3.756 4.085 . 0 0 "[ . 1 . 2]" 1
2673 1 109 VAL MG2 1 110 SER H . . 3.950 3.870 3.798 3.952 0.002 13 0 "[ . 1 . 2]" 1
2674 1 109 VAL MG2 1 111 ARG H . . 5.460 5.362 5.004 5.481 0.021 13 0 "[ . 1 . 2]" 1
2675 1 109 VAL MG2 1 112 ALA MB . . 4.030 3.944 3.734 4.047 0.017 9 0 "[ . 1 . 2]" 1
2676 1 110 SER H 1 110 SER HB2 . . 3.080 2.477 2.213 2.698 . 0 0 "[ . 1 . 2]" 1
2677 1 110 SER H 1 110 SER QB . . 2.550 2.238 2.150 2.274 . 0 0 "[ . 1 . 2]" 1
2678 1 110 SER H 1 110 SER HB3 . . 3.080 2.633 2.398 2.959 . 0 0 "[ . 1 . 2]" 1
2679 1 110 SER H 1 112 ALA MB . . 5.390 4.933 4.797 5.062 . 0 0 "[ . 1 . 2]" 1
2680 1 110 SER HA 1 113 LEU H . . 4.680 3.932 3.769 4.180 . 0 0 "[ . 1 . 2]" 1
2681 1 110 SER HA 1 113 LEU HB2 . . 4.120 3.329 3.084 3.641 . 0 0 "[ . 1 . 2]" 1
2682 1 110 SER HA 1 113 LEU QD . . 3.300 2.454 1.980 2.900 . 0 0 "[ . 1 . 2]" 1
2683 1 110 SER HA 1 113 LEU HG . . 4.240 3.850 3.248 4.242 0.002 3 0 "[ . 1 . 2]" 1
2684 1 111 ARG H 1 111 ARG QB . . 3.000 2.216 2.164 2.265 . 0 0 "[ . 1 . 2]" 1
2685 1 111 ARG H 1 111 ARG HD2 . . 5.500 5.257 4.629 5.615 0.115 13 0 "[ . 1 . 2]" 1
2686 1 111 ARG H 1 111 ARG QD . . 4.700 4.248 3.996 4.429 . 0 0 "[ . 1 . 2]" 1
2687 1 111 ARG H 1 111 ARG HD3 . . 5.500 4.558 4.099 5.099 . 0 0 "[ . 1 . 2]" 1
2688 1 111 ARG H 1 111 ARG HG2 . . 4.740 4.533 4.188 4.613 . 0 0 "[ . 1 . 2]" 1
2689 1 111 ARG H 1 111 ARG QG . . 4.040 3.977 3.760 4.059 0.019 12 0 "[ . 1 . 2]" 1
2690 1 111 ARG H 1 111 ARG HG3 . . 4.740 4.420 3.992 4.608 . 0 0 "[ . 1 . 2]" 1
2691 1 111 ARG H 1 112 ALA H . . 3.100 2.735 2.422 2.918 . 0 0 "[ . 1 . 2]" 1
2692 1 111 ARG H 1 112 ALA MB . . 4.440 4.211 3.880 4.394 . 0 0 "[ . 1 . 2]" 1
2693 1 111 ARG H 1 113 LEU H . . 4.280 4.035 3.664 4.196 . 0 0 "[ . 1 . 2]" 1
2694 1 111 ARG H 1 113 LEU QD . . 5.290 5.000 4.645 5.292 0.002 3 0 "[ . 1 . 2]" 1
2695 1 111 ARG HA 1 111 ARG HD2 . . 3.760 3.174 2.485 3.774 0.014 20 0 "[ . 1 . 2]" 1
2696 1 111 ARG HA 1 111 ARG QD . . 3.260 2.246 1.947 2.978 . 0 0 "[ . 1 . 2]" 1
2697 1 111 ARG HA 1 111 ARG HD3 . . 3.760 2.451 1.956 3.243 . 0 0 "[ . 1 . 2]" 1
2698 1 111 ARG HA 1 114 ASP H . . 4.290 3.251 3.013 3.411 . 0 0 "[ . 1 . 2]" 1
2699 1 111 ARG HA 1 114 ASP HB2 . . 4.150 2.989 2.309 3.629 . 0 0 "[ . 1 . 2]" 1
2700 1 111 ARG HA 1 114 ASP QB . . 3.580 2.733 2.294 3.124 . 0 0 "[ . 1 . 2]" 1
2701 1 111 ARG HA 1 114 ASP HB3 . . 4.150 3.578 2.668 4.158 0.008 17 0 "[ . 1 . 2]" 1
2702 1 111 ARG HA 1 115 LEU H . . 5.500 4.699 4.346 5.048 . 0 0 "[ . 1 . 2]" 1
2703 1 111 ARG QB 1 111 ARG QD . . 3.320 2.394 2.102 2.934 . 0 0 "[ . 1 . 2]" 1
2704 1 111 ARG QB 1 112 ALA H . . 3.920 2.264 2.036 2.529 . 0 0 "[ . 1 . 2]" 1
2705 1 111 ARG QB 1 114 ASP H . . 5.340 4.876 4.644 5.068 . 0 0 "[ . 1 . 2]" 1
2706 1 111 ARG QD 1 112 ALA H . . 5.300 4.368 3.320 4.778 . 0 0 "[ . 1 . 2]" 1
2707 1 111 ARG QD 1 114 ASP QB . . 3.780 2.704 2.142 3.182 . 0 0 "[ . 1 . 2]" 1
2708 1 111 ARG QD 1 115 LEU H . . 4.830 4.354 3.170 4.857 0.027 5 0 "[ . 1 . 2]" 1
2709 1 111 ARG QD 1 115 LEU QD . . 4.040 3.011 1.919 3.738 . 0 0 "[ . 1 . 2]" 1
2710 1 111 ARG QG 1 112 ALA H . . 5.340 3.410 2.605 4.284 . 0 0 "[ . 1 . 2]" 1
2711 1 111 ARG QG 1 115 LEU H . . 5.340 4.529 4.212 5.314 . 0 0 "[ . 1 . 2]" 1
2712 1 111 ARG QG 1 115 LEU QD . . 4.170 2.741 2.116 3.777 . 0 0 "[ . 1 . 2]" 1
2713 1 112 ALA H 1 112 ALA MB . . 2.860 2.132 2.037 2.250 . 0 0 "[ . 1 . 2]" 1
2714 1 112 ALA H 1 113 LEU H . . 3.340 2.923 2.850 3.018 . 0 0 "[ . 1 . 2]" 1
2715 1 112 ALA HA 1 115 LEU H . . 3.820 3.703 3.474 3.792 . 0 0 "[ . 1 . 2]" 1
2716 1 112 ALA HA 1 115 LEU QB . . 3.850 3.425 3.119 3.662 . 0 0 "[ . 1 . 2]" 1
2717 1 112 ALA HA 1 115 LEU QD . . 3.260 2.594 2.079 2.954 . 0 0 "[ . 1 . 2]" 1
2718 1 112 ALA HA 1 115 LEU HG . . 4.630 3.703 3.393 4.164 . 0 0 "[ . 1 . 2]" 1
2719 1 112 ALA HA 1 116 PHE H . . 4.420 4.142 3.935 4.364 . 0 0 "[ . 1 . 2]" 1
2720 1 112 ALA MB 1 113 LEU H . . 3.230 2.703 2.566 2.884 . 0 0 "[ . 1 . 2]" 1
2721 1 112 ALA MB 1 113 LEU HA . . 4.140 3.778 3.696 3.874 . 0 0 "[ . 1 . 2]" 1
2722 1 112 ALA MB 1 113 LEU HB2 . . 5.500 4.583 4.438 4.815 . 0 0 "[ . 1 . 2]" 1
2723 1 112 ALA MB 1 113 LEU MD1 . . 4.930 4.597 4.335 4.868 . 0 0 "[ . 1 . 2]" 1
2724 1 112 ALA MB 1 113 LEU QD . . 4.110 3.719 3.175 4.034 . 0 0 "[ . 1 . 2]" 1
2725 1 112 ALA MB 1 113 LEU MD2 . . 4.930 3.944 3.248 4.358 . 0 0 "[ . 1 . 2]" 1
2726 1 112 ALA MB 1 113 LEU HG . . 3.990 3.520 3.115 3.879 . 0 0 "[ . 1 . 2]" 1
2727 1 112 ALA MB 1 114 ASP H . . 4.980 4.677 4.532 4.865 . 0 0 "[ . 1 . 2]" 1
2728 1 112 ALA MB 1 115 LEU H . . 4.760 4.708 4.558 4.771 0.011 8 0 "[ . 1 . 2]" 1
2729 1 112 ALA MB 1 115 LEU QB . . 4.720 4.444 4.155 4.638 . 0 0 "[ . 1 . 2]" 1
2730 1 112 ALA MB 1 115 LEU QD . . 4.050 3.775 3.298 4.053 0.003 10 0 "[ . 1 . 2]" 1
2731 1 113 LEU H 1 113 LEU HB2 . . 3.040 2.351 2.241 2.568 . 0 0 "[ . 1 . 2]" 1
2732 1 113 LEU H 1 113 LEU HB3 . . 3.730 3.561 3.527 3.602 . 0 0 "[ . 1 . 2]" 1
2733 1 113 LEU H 1 113 LEU MD1 . . 3.850 3.578 3.362 3.683 . 0 0 "[ . 1 . 2]" 1
2734 1 113 LEU H 1 113 LEU MD2 . . 3.850 3.665 3.257 3.858 0.008 3 0 "[ . 1 . 2]" 1
2735 1 113 LEU H 1 113 LEU HG . . 3.020 2.535 2.118 2.757 . 0 0 "[ . 1 . 2]" 1
2736 1 113 LEU H 1 114 ASP H . . 3.280 2.659 2.457 2.799 . 0 0 "[ . 1 . 2]" 1
2737 1 113 LEU H 1 114 ASP QB . . 4.820 4.357 4.213 4.462 . 0 0 "[ . 1 . 2]" 1
2738 1 113 LEU H 1 115 LEU H . . 4.500 4.126 3.974 4.386 . 0 0 "[ . 1 . 2]" 1
2739 1 113 LEU HA 1 113 LEU MD1 . . 4.110 3.866 3.834 3.949 . 0 0 "[ . 1 . 2]" 1
2740 1 113 LEU HA 1 113 LEU QD . . 2.780 2.151 1.960 2.392 . 0 0 "[ . 1 . 2]" 1
2741 1 113 LEU HA 1 113 LEU MD2 . . 4.110 2.162 1.966 2.412 . 0 0 "[ . 1 . 2]" 1
2742 1 113 LEU HA 1 115 LEU QB . . 5.340 5.169 4.969 5.333 . 0 0 "[ . 1 . 2]" 1
2743 1 113 LEU HA 1 116 PHE H . . 3.460 3.188 3.010 3.363 . 0 0 "[ . 1 . 2]" 1
2744 1 113 LEU HA 1 116 PHE HA . . 5.290 4.870 4.731 5.140 . 0 0 "[ . 1 . 2]" 1
2745 1 113 LEU HA 1 116 PHE HB2 . . 3.860 3.120 2.765 3.413 . 0 0 "[ . 1 . 2]" 1
2746 1 113 LEU HA 1 116 PHE QB . . 3.330 2.124 1.976 2.436 . 0 0 "[ . 1 . 2]" 1
2747 1 113 LEU HA 1 116 PHE HB3 . . 3.860 2.178 2.000 2.596 . 0 0 "[ . 1 . 2]" 1
2748 1 113 LEU HA 1 116 PHE QD . . 4.350 3.434 3.070 3.948 . 0 0 "[ . 1 . 2]" 1
2749 1 113 LEU HB2 1 113 LEU QD . . 2.960 2.249 2.165 2.326 . 0 0 "[ . 1 . 2]" 1
2750 1 113 LEU HB2 1 114 ASP H . . 4.130 2.562 2.299 2.748 . 0 0 "[ . 1 . 2]" 1
2751 1 113 LEU HB3 1 113 LEU MD1 . . 3.150 2.394 2.281 2.470 . 0 0 "[ . 1 . 2]" 1
2752 1 113 LEU HB3 1 113 LEU MD2 . . 3.150 2.254 2.154 2.411 . 0 0 "[ . 1 . 2]" 1
2753 1 113 LEU HB3 1 114 ASP H . . 4.350 3.415 3.050 3.770 . 0 0 "[ . 1 . 2]" 1
2754 1 113 LEU HB3 1 115 LEU H . . 5.500 5.272 5.014 5.492 . 0 0 "[ . 1 . 2]" 1
2755 1 113 LEU QD 1 114 ASP H . . 4.130 4.036 3.893 4.139 0.009 18 0 "[ . 1 . 2]" 1
2756 1 113 LEU QD 1 116 PHE H . . 5.160 4.633 4.343 4.777 . 0 0 "[ . 1 . 2]" 1
2757 1 113 LEU QD 1 116 PHE QB . . 3.820 3.017 2.658 3.290 . 0 0 "[ . 1 . 2]" 1
2758 1 113 LEU QD 1 116 PHE QD . . 3.720 2.994 2.371 3.363 . 0 0 "[ . 1 . 2]" 1
2759 1 113 LEU QD 1 116 PHE QE . . 4.540 4.099 3.634 4.458 . 0 0 "[ . 1 . 2]" 1
2760 1 113 LEU MD1 1 114 ASP H . . 4.840 4.425 4.206 4.591 . 0 0 "[ . 1 . 2]" 1
2761 1 113 LEU MD2 1 114 ASP H . . 4.840 4.662 4.564 4.747 . 0 0 "[ . 1 . 2]" 1
2762 1 114 ASP H 1 114 ASP HB2 . . 3.690 2.337 2.180 2.683 . 0 0 "[ . 1 . 2]" 1
2763 1 114 ASP H 1 114 ASP QB . . 3.190 2.211 2.130 2.264 . 0 0 "[ . 1 . 2]" 1
2764 1 114 ASP H 1 114 ASP HB3 . . 3.690 2.960 2.428 3.542 . 0 0 "[ . 1 . 2]" 1
2765 1 114 ASP H 1 115 LEU H . . 3.250 2.808 2.684 2.964 . 0 0 "[ . 1 . 2]" 1
2766 1 114 ASP H 1 115 LEU QB . . 5.340 5.033 4.902 5.200 . 0 0 "[ . 1 . 2]" 1
2767 1 114 ASP H 1 115 LEU MD1 . . 5.500 5.115 4.812 5.355 . 0 0 "[ . 1 . 2]" 1
2768 1 114 ASP H 1 115 LEU MD2 . . 5.500 5.306 4.959 5.502 0.002 6 0 "[ . 1 . 2]" 1
2769 1 114 ASP H 1 116 PHE H . . 4.370 4.221 4.032 4.368 . 0 0 "[ . 1 . 2]" 1
2770 1 114 ASP HA 1 116 PHE H . . 4.930 4.741 4.400 4.901 . 0 0 "[ . 1 . 2]" 1
2771 1 114 ASP HA 1 117 SER H . . 4.490 4.258 3.850 4.493 0.003 17 0 "[ . 1 . 2]" 1
2772 1 114 ASP HA 1 117 SER QB . . 4.250 3.918 3.382 4.248 . 0 0 "[ . 1 . 2]" 1
2773 1 114 ASP QB 1 115 LEU H . . 3.390 2.692 2.453 2.923 . 0 0 "[ . 1 . 2]" 1
2774 1 114 ASP HB2 1 115 LEU H . . 4.160 3.569 2.863 4.118 . 0 0 "[ . 1 . 2]" 1
2775 1 114 ASP HB3 1 115 LEU H . . 4.160 2.926 2.503 3.624 . 0 0 "[ . 1 . 2]" 1
2776 1 115 LEU H 1 115 LEU HB2 . . 3.670 2.638 2.546 2.722 . 0 0 "[ . 1 . 2]" 1
2777 1 115 LEU H 1 115 LEU QB . . 3.020 2.577 2.497 2.650 . 0 0 "[ . 1 . 2]" 1
2778 1 115 LEU H 1 115 LEU HB3 . . 3.670 3.629 3.594 3.672 0.002 19 0 "[ . 1 . 2]" 1
2779 1 115 LEU H 1 115 LEU MD1 . . 4.720 3.412 3.169 3.711 . 0 0 "[ . 1 . 2]" 1
2780 1 115 LEU H 1 115 LEU QD . . 3.640 3.046 2.958 3.156 . 0 0 "[ . 1 . 2]" 1
2781 1 115 LEU H 1 115 LEU MD2 . . 4.720 3.443 3.245 3.738 . 0 0 "[ . 1 . 2]" 1
2782 1 115 LEU H 1 115 LEU HG . . 3.060 2.144 1.942 2.375 . 0 0 "[ . 1 . 2]" 1
2783 1 115 LEU H 1 116 PHE H . . 3.120 2.397 2.224 2.585 . 0 0 "[ . 1 . 2]" 1
2784 1 115 LEU H 1 116 PHE HA . . 5.500 5.009 4.853 5.160 . 0 0 "[ . 1 . 2]" 1
2785 1 115 LEU H 1 116 PHE HB2 . . 5.210 4.948 4.679 5.107 . 0 0 "[ . 1 . 2]" 1
2786 1 115 LEU H 1 116 PHE QB . . 4.440 4.076 3.912 4.263 . 0 0 "[ . 1 . 2]" 1
2787 1 115 LEU H 1 116 PHE HB3 . . 5.210 4.346 4.108 4.654 . 0 0 "[ . 1 . 2]" 1
2788 1 115 LEU HA 1 115 LEU MD1 . . 4.030 3.973 3.916 4.003 . 0 0 "[ . 1 . 2]" 1
2789 1 115 LEU HA 1 115 LEU QD . . 2.790 2.400 2.076 2.594 . 0 0 "[ . 1 . 2]" 1
2790 1 115 LEU HA 1 115 LEU MD2 . . 4.030 2.421 2.083 2.629 . 0 0 "[ . 1 . 2]" 1
2791 1 115 LEU HA 1 115 LEU HG . . 3.690 3.129 2.996 3.267 . 0 0 "[ . 1 . 2]" 1
2792 1 115 LEU HA 1 118 ASP H . . 4.790 3.452 3.077 3.815 . 0 0 "[ . 1 . 2]" 1
2793 1 115 LEU HA 1 118 ASP HB2 . . 4.330 2.995 2.424 4.331 0.001 3 0 "[ . 1 . 2]" 1
2794 1 115 LEU HA 1 118 ASP HB3 . . 4.330 3.856 2.680 4.328 . 0 0 "[ . 1 . 2]" 1
2795 1 115 LEU HA 1 119 ASN QD . . 4.790 3.750 2.985 4.418 . 0 0 "[ . 1 . 2]" 1
2796 1 115 LEU QB 1 115 LEU QD . . 2.680 1.850 1.797 1.932 . 0 0 "[ . 1 . 2]" 1
2797 1 115 LEU QB 1 116 PHE H . . 3.260 2.529 2.379 2.706 . 0 0 "[ . 1 . 2]" 1
2798 1 115 LEU QB 1 119 ASN QD . . 4.620 2.717 1.740 3.312 . 0 0 "[ . 1 . 2]" 1
2799 1 115 LEU HB2 1 116 PHE H . . 3.920 2.568 2.414 2.758 . 0 0 "[ . 1 . 2]" 1
2800 1 115 LEU HB3 1 116 PHE H . . 3.920 3.800 3.603 3.928 0.008 11 0 "[ . 1 . 2]" 1
2801 1 115 LEU QD 1 116 PHE H . . 3.930 3.887 3.821 3.932 0.002 17 0 "[ . 1 . 2]" 1
2802 1 115 LEU QD 1 118 ASP QB . . 4.640 3.884 3.565 4.595 . 0 0 "[ . 1 . 2]" 1
2803 1 115 LEU QD 1 119 ASN QD . . 4.120 3.599 2.800 4.096 . 0 0 "[ . 1 . 2]" 1
2804 1 115 LEU HG 1 116 PHE H . . 5.170 4.024 3.808 4.159 . 0 0 "[ . 1 . 2]" 1
2805 1 116 PHE H 1 116 PHE HB2 . . 3.110 2.705 2.553 2.819 . 0 0 "[ . 1 . 2]" 1
2806 1 116 PHE H 1 116 PHE HB3 . . 3.110 2.395 2.288 2.566 . 0 0 "[ . 1 . 2]" 1
2807 1 116 PHE H 1 116 PHE QD . . 4.220 4.150 4.090 4.207 . 0 0 "[ . 1 . 2]" 1
2808 1 116 PHE H 1 117 SER H . . 3.290 2.959 2.714 3.212 . 0 0 "[ . 1 . 2]" 1
2809 1 116 PHE HA 1 116 PHE QD . . 3.390 2.676 2.281 2.933 . 0 0 "[ . 1 . 2]" 1
2810 1 116 PHE QB 1 117 SER H . . 3.300 2.537 2.085 2.887 . 0 0 "[ . 1 . 2]" 1
2811 1 116 PHE HB2 1 117 SER H . . 4.170 3.926 3.617 4.170 . 9 0 "[ . 1 . 2]" 1
2812 1 116 PHE HB3 1 117 SER H . . 4.170 2.571 2.098 2.944 . 0 0 "[ . 1 . 2]" 1
2813 1 116 PHE QD 1 117 SER H . . 3.870 3.104 2.497 3.802 . 0 0 "[ . 1 . 2]" 1
2814 1 116 PHE QD 1 117 SER QB . . 4.750 3.745 3.244 4.464 . 0 0 "[ . 1 . 2]" 1
2815 1 117 SER H 1 117 SER QB . . 2.950 2.317 2.153 2.616 . 0 0 "[ . 1 . 2]" 1
2816 1 117 SER H 1 118 ASP H . . 4.080 2.791 2.539 3.060 . 0 0 "[ . 1 . 2]" 1
2817 1 117 SER QB 1 118 ASP H . . 3.970 2.890 2.202 3.965 . 0 0 "[ . 1 . 2]" 1
2818 1 118 ASP H 1 118 ASP HB2 . . 3.750 2.486 2.196 2.954 . 0 0 "[ . 1 . 2]" 1
2819 1 118 ASP H 1 118 ASP QB . . 3.250 2.367 2.175 2.620 . 0 0 "[ . 1 . 2]" 1
2820 1 118 ASP H 1 118 ASP HB3 . . 3.750 3.238 2.523 3.613 . 0 0 "[ . 1 . 2]" 1
2821 1 118 ASP QB 1 119 ASN H . . 3.330 2.384 1.966 2.857 . 0 0 "[ . 1 . 2]" 1
2822 1 118 ASP QB 1 119 ASN QD . . 4.330 3.019 2.344 4.211 . 0 0 "[ . 1 . 2]" 1
2823 1 119 ASN H 1 119 ASN HB2 . . 3.650 2.778 2.253 3.638 . 0 0 "[ . 1 . 2]" 1
2824 1 119 ASN H 1 119 ASN HB3 . . 3.650 3.514 3.086 3.671 0.021 8 0 "[ . 1 . 2]" 1
2825 1 119 ASN H 1 119 ASN QD . . 4.670 2.519 1.847 3.431 . 0 0 "[ . 1 . 2]" 1
2826 1 119 ASN H 1 120 ALA MB . . 4.890 4.278 3.617 4.876 . 0 0 "[ . 1 . 2]" 1
2827 1 119 ASN HA 1 120 ALA MB . . 5.130 4.966 4.017 5.035 . 0 0 "[ . 1 . 2]" 1
2828 1 119 ASN QB 1 119 ASN QD . . 2.890 2.170 2.064 2.399 . 0 0 "[ . 1 . 2]" 1
2829 1 119 ASN QB 1 120 ALA H . . 3.640 2.267 1.884 3.494 . 0 0 "[ . 1 . 2]" 1
2830 1 119 ASN HB2 1 120 ALA H . . 4.160 2.340 1.896 3.749 . 0 0 "[ . 1 . 2]" 1
2831 1 119 ASN HB3 1 120 ALA H . . 4.160 3.182 2.470 4.172 0.012 17 0 "[ . 1 . 2]" 1
2832 1 120 ALA H 1 120 ALA MB . . 2.830 2.134 2.028 2.849 0.019 17 0 "[ . 1 . 2]" 1
2833 1 120 ALA HA 1 121 PRO HD2 . . 2.910 2.401 2.167 2.635 . 0 0 "[ . 1 . 2]" 1
2834 1 120 ALA HA 1 121 PRO HD3 . . 2.910 2.312 2.253 2.420 . 0 0 "[ . 1 . 2]" 1
2835 1 120 ALA HA 1 121 PRO QG . . 4.240 4.006 3.867 4.159 . 0 0 "[ . 1 . 2]" 1
2836 1 120 ALA MB 1 121 PRO HA . . 5.400 4.400 4.303 4.473 . 0 0 "[ . 1 . 2]" 1
2837 1 120 ALA MB 1 121 PRO HD2 . . 3.820 2.185 1.887 2.615 . 0 0 "[ . 1 . 2]" 1
2838 1 120 ALA MB 1 121 PRO QD . . 3.170 2.153 1.868 2.556 . 0 0 "[ . 1 . 2]" 1
2839 1 120 ALA MB 1 121 PRO HD3 . . 3.820 3.283 2.991 3.602 . 0 0 "[ . 1 . 2]" 1
2840 1 121 PRO HA 1 122 PRO HD2 . . 2.960 2.148 1.923 2.570 . 0 0 "[ . 1 . 2]" 1
2841 1 121 PRO HA 1 122 PRO HD3 . . 2.960 2.357 2.263 2.470 . 0 0 "[ . 1 . 2]" 1
2842 1 121 PRO QB 1 122 PRO QD . . 3.770 2.761 1.933 3.304 . 0 0 "[ . 1 . 2]" 1
2843 1 122 PRO HA 1 123 PRO HD2 . . 3.250 2.409 1.982 2.551 . 0 0 "[ . 1 . 2]" 1
2844 1 122 PRO HA 1 123 PRO QD . . 2.820 2.103 1.880 2.185 . 0 0 "[ . 1 . 2]" 1
2845 1 122 PRO HA 1 123 PRO HD3 . . 3.250 2.333 2.263 2.376 . 0 0 "[ . 1 . 2]" 1
2846 1 122 PRO HA 1 123 PRO QG . . 4.350 4.017 3.787 4.104 . 0 0 "[ . 1 . 2]" 1
2847 1 122 PRO QB 1 123 PRO QD . . 3.370 2.230 1.969 3.051 . 0 0 "[ . 1 . 2]" 1
2848 1 122 PRO HB2 1 123 PRO HD2 . . 4.630 2.377 2.044 3.493 . 0 0 "[ . 1 . 2]" 1
2849 1 122 PRO HB2 1 123 PRO HD3 . . 4.630 3.753 3.487 4.582 . 0 0 "[ . 1 . 2]" 1
2850 1 122 PRO HB3 1 123 PRO HD2 . . 4.630 2.892 2.709 3.584 . 0 0 "[ . 1 . 2]" 1
2851 1 122 PRO HB3 1 123 PRO HD3 . . 4.630 3.943 3.754 4.572 . 0 0 "[ . 1 . 2]" 1
2852 1 123 PRO HA 1 124 GLU H . . 2.850 2.443 2.153 2.725 . 0 0 "[ . 1 . 2]" 1
2853 1 123 PRO QB 1 124 GLU H . . 4.030 2.682 1.886 3.861 . 0 0 "[ . 1 . 2]" 1
2854 1 123 PRO QD 1 124 GLU H . . 4.960 4.834 4.560 4.978 0.018 4 0 "[ . 1 . 2]" 1
2855 1 123 PRO QG 1 124 GLU H . . 4.790 4.174 3.597 4.754 . 0 0 "[ . 1 . 2]" 1
2856 1 124 GLU H 1 124 GLU QB . . 3.100 2.456 2.128 3.057 . 0 0 "[ . 1 . 2]" 1
2857 1 124 GLU H 1 125 LEU H . . 4.640 4.161 2.849 4.645 0.005 20 0 "[ . 1 . 2]" 1
2858 1 124 GLU HA 1 124 GLU QG . . 3.740 2.715 2.221 3.339 . 0 0 "[ . 1 . 2]" 1
2859 1 124 GLU HA 1 125 LEU H . . 2.850 2.289 2.139 2.859 0.009 10 0 "[ . 1 . 2]" 1
2860 1 124 GLU QB 1 125 LEU H . . 3.960 3.598 2.191 4.017 0.057 7 0 "[ . 1 . 2]" 1
2861 1 124 GLU QG 1 125 LEU H . . 4.650 3.609 1.973 4.508 . 0 0 "[ . 1 . 2]" 1
2862 1 125 LEU H 1 125 LEU QB . . 3.110 2.621 2.160 3.141 0.031 10 0 "[ . 1 . 2]" 1
2863 1 125 LEU H 1 125 LEU MD1 . . 5.370 3.596 1.828 4.493 . 0 0 "[ . 1 . 2]" 1
2864 1 125 LEU H 1 125 LEU QD . . 4.630 2.960 1.731 4.082 . 0 0 "[ . 1 . 2]" 1
2865 1 125 LEU H 1 125 LEU MD2 . . 5.370 3.677 1.866 4.871 . 0 0 "[ . 1 . 2]" 1
2866 1 125 LEU H 1 125 LEU HG . . 4.990 3.799 1.940 4.987 . 0 0 "[ . 1 . 2]" 1
2867 1 125 LEU HA 1 125 LEU QD . . 4.190 2.629 1.942 3.400 . 0 0 "[ . 1 . 2]" 1
2868 1 125 LEU HA 1 126 LEU H . . 2.930 2.405 2.142 3.077 0.147 20 0 "[ . 1 . 2]" 1
2869 1 125 LEU QB 1 126 LEU H . . 3.490 2.881 1.916 3.622 0.132 19 0 "[ . 1 . 2]" 1
2870 1 126 LEU H 1 126 LEU QB . . 3.650 2.499 2.208 3.091 . 0 0 "[ . 1 . 2]" 1
2871 1 126 LEU H 1 126 LEU MD1 . . 5.010 3.902 2.025 4.836 . 0 0 "[ . 1 . 2]" 1
2872 1 126 LEU H 1 126 LEU QD . . 4.360 3.211 1.866 4.088 . 0 0 "[ . 1 . 2]" 1
2873 1 126 LEU H 1 126 LEU MD2 . . 5.010 3.751 1.871 4.779 . 0 0 "[ . 1 . 2]" 1
2874 1 126 LEU H 1 126 LEU HG . . 5.260 3.928 2.174 5.173 . 0 0 "[ . 1 . 2]" 1
2875 1 126 LEU HA 1 127 GLU H . . 3.270 2.259 2.141 2.766 . 0 0 "[ . 1 . 2]" 1
2876 1 126 LEU QB 1 127 GLU H . . 4.260 3.580 2.705 4.026 . 0 0 "[ . 1 . 2]" 1
2877 1 127 GLU QB 1 127 GLU QG . . 2.330 2.043 1.986 2.086 . 0 0 "[ . 1 . 2]" 1
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