NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
453282 |
2yrp   |
11148 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2yrp
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 1988
_Distance_constraint_stats_list.Viol_count 473
_Distance_constraint_stats_list.Viol_total 132.194
_Distance_constraint_stats_list.Viol_max 0.173
_Distance_constraint_stats_list.Viol_rms 0.0030
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0140
_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 2 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 SER 0.010 0.010 10 0 "[ . 1 . 2]"
1 7 GLY 0.010 0.010 10 0 "[ . 1 . 2]"
1 8 LEU 0.036 0.016 17 0 "[ . 1 . 2]"
1 9 PRO 0.115 0.043 16 0 "[ . 1 . 2]"
1 10 GLN 0.036 0.014 3 0 "[ . 1 . 2]"
1 11 VAL 0.006 0.002 17 0 "[ . 1 . 2]"
1 12 GLU 0.005 0.005 9 0 "[ . 1 . 2]"
1 13 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 TYR 0.110 0.013 5 0 "[ . 1 . 2]"
1 15 SER 0.013 0.009 13 0 "[ . 1 . 2]"
1 16 PRO 0.008 0.004 19 0 "[ . 1 . 2]"
1 17 SER 0.103 0.013 5 0 "[ . 1 . 2]"
1 18 ALA 0.021 0.006 2 0 "[ . 1 . 2]"
1 19 CYS 0.040 0.038 16 0 "[ . 1 . 2]"
1 20 SER 0.027 0.012 9 0 "[ . 1 . 2]"
1 21 VAL 0.105 0.032 12 0 "[ . 1 . 2]"
1 22 ARG 0.136 0.059 9 0 "[ . 1 . 2]"
1 23 GLY 0.003 0.003 16 0 "[ . 1 . 2]"
1 24 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 GLU 0.069 0.048 19 0 "[ . 1 . 2]"
1 26 GLU 0.017 0.017 7 0 "[ . 1 . 2]"
1 27 LEU 0.043 0.017 7 0 "[ . 1 . 2]"
1 28 VAL 0.005 0.002 16 0 "[ . 1 . 2]"
1 29 LEU 0.020 0.013 13 0 "[ . 1 . 2]"
1 30 THR 0.003 0.002 16 0 "[ . 1 . 2]"
1 31 GLY 0.009 0.005 9 0 "[ . 1 . 2]"
1 32 SER 0.002 0.002 16 0 "[ . 1 . 2]"
1 33 ASN 0.006 0.004 13 0 "[ . 1 . 2]"
1 34 PHE 0.038 0.006 5 0 "[ . 1 . 2]"
1 35 LEU 0.025 0.014 20 0 "[ . 1 . 2]"
1 36 PRO 0.003 0.003 19 0 "[ . 1 . 2]"
1 37 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 SER 0.016 0.009 9 0 "[ . 1 . 2]"
1 39 LYS 0.227 0.050 11 0 "[ . 1 . 2]"
1 40 VAL 0.119 0.050 11 0 "[ . 1 . 2]"
1 41 VAL 0.044 0.013 20 0 "[ . 1 . 2]"
1 42 PHE 0.054 0.017 19 0 "[ . 1 . 2]"
1 43 ILE 0.011 0.007 12 0 "[ . 1 . 2]"
1 44 GLU 0.005 0.003 7 0 "[ . 1 . 2]"
1 45 ARG 0.011 0.005 9 0 "[ . 1 . 2]"
1 46 GLY 0.012 0.005 9 0 "[ . 1 . 2]"
1 47 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 LYS 0.025 0.009 17 0 "[ . 1 . 2]"
1 51 LEU 0.118 0.022 18 0 "[ . 1 . 2]"
1 52 GLN 0.043 0.011 13 0 "[ . 1 . 2]"
1 53 TRP 0.105 0.019 19 0 "[ . 1 . 2]"
1 54 GLU 0.068 0.019 19 0 "[ . 1 . 2]"
1 55 GLU 0.128 0.043 5 0 "[ . 1 . 2]"
1 56 GLU 0.377 0.173 10 0 "[ . 1 . 2]"
1 57 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 VAL 0.172 0.048 13 0 "[ . 1 . 2]"
1 60 ASN 0.021 0.009 2 0 "[ . 1 . 2]"
1 61 ARG 0.889 0.144 19 0 "[ . 1 . 2]"
1 62 LEU 0.277 0.149 13 0 "[ . 1 . 2]"
1 63 GLN 0.046 0.014 6 0 "[ . 1 . 2]"
1 64 SER 0.010 0.006 7 0 "[ . 1 . 2]"
1 65 ASN 0.003 0.001 5 0 "[ . 1 . 2]"
1 66 GLU 0.078 0.041 9 0 "[ . 1 . 2]"
1 67 VAL 0.001 0.001 5 0 "[ . 1 . 2]"
1 68 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 LEU 0.050 0.013 13 0 "[ . 1 . 2]"
1 70 THR 0.002 0.001 2 0 "[ . 1 . 2]"
1 71 LEU 0.019 0.007 9 0 "[ . 1 . 2]"
1 72 THR 0.012 0.007 13 0 "[ . 1 . 2]"
1 73 VAL 0.097 0.048 19 0 "[ . 1 . 2]"
1 74 PRO 0.022 0.022 19 0 "[ . 1 . 2]"
1 75 GLU 0.338 0.066 15 0 "[ . 1 . 2]"
1 76 TYR 0.107 0.038 18 0 "[ . 1 . 2]"
1 77 SER 0.007 0.004 13 0 "[ . 1 . 2]"
1 78 ASN 0.039 0.025 3 0 "[ . 1 . 2]"
1 79 LYS 0.349 0.050 9 0 "[ . 1 . 2]"
1 80 ARG 0.108 0.041 20 0 "[ . 1 . 2]"
1 81 VAL 0.031 0.014 4 0 "[ . 1 . 2]"
1 82 SER 0.015 0.014 4 0 "[ . 1 . 2]"
1 83 ARG 0.038 0.022 7 0 "[ . 1 . 2]"
1 84 PRO 0.030 0.022 7 0 "[ . 1 . 2]"
1 85 VAL 0.018 0.007 10 0 "[ . 1 . 2]"
1 86 GLN 0.012 0.007 10 0 "[ . 1 . 2]"
1 87 VAL 0.002 0.001 10 0 "[ . 1 . 2]"
1 88 TYR 0.036 0.008 18 0 "[ . 1 . 2]"
1 89 PHE 0.004 0.001 10 0 "[ . 1 . 2]"
1 90 TYR 0.038 0.012 9 0 "[ . 1 . 2]"
1 91 VAL 0.133 0.025 18 0 "[ . 1 . 2]"
1 92 SER 0.072 0.013 13 0 "[ . 1 . 2]"
1 93 ASN 0.146 0.043 16 0 "[ . 1 . 2]"
1 94 GLY 0.115 0.022 16 0 "[ . 1 . 2]"
1 95 ARG 0.099 0.022 16 0 "[ . 1 . 2]"
1 96 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 LYS 0.320 0.061 19 0 "[ . 1 . 2]"
1 98 ARG 0.409 0.106 10 0 "[ . 1 . 2]"
1 99 SER 0.062 0.025 18 0 "[ . 1 . 2]"
1 100 PRO 0.058 0.031 19 0 "[ . 1 . 2]"
1 101 THR 0.062 0.031 19 0 "[ . 1 . 2]"
1 102 GLN 0.043 0.010 18 0 "[ . 1 . 2]"
1 103 SER 0.025 0.008 18 0 "[ . 1 . 2]"
1 104 PHE 0.036 0.019 19 0 "[ . 1 . 2]"
1 105 ARG 0.236 0.101 6 0 "[ . 1 . 2]"
1 106 PHE 0.081 0.020 17 0 "[ . 1 . 2]"
1 107 LEU 0.057 0.018 17 0 "[ . 1 . 2]"
1 108 PRO 0.023 0.010 17 0 "[ . 1 . 2]"
1 109 VAL 0.278 0.048 16 0 "[ . 1 . 2]"
1 110 ILE 1.500 0.142 15 0 "[ . 1 . 2]"
1 111 CYS 1.086 0.142 15 0 "[ . 1 . 2]"
1 112 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 GLU 0.014 0.008 3 0 "[ . 1 . 2]"
1 114 GLU 0.014 0.008 3 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 2 SER HA 1 3 SER H . . 3.400 2.410 2.139 3.364 . 0 0 "[ . 1 . 2]" 1
2 1 3 SER H 1 3 SER QB . . 3.400 2.532 2.260 3.254 . 0 0 "[ . 1 . 2]" 1
3 1 3 SER H 1 4 GLY H . . 4.130 3.516 2.166 4.103 . 0 0 "[ . 1 . 2]" 1
4 1 4 GLY QA 1 5 SER H . . 3.400 2.285 2.108 2.712 . 0 0 "[ . 1 . 2]" 1
5 1 5 SER H 1 5 SER QB . . 3.540 2.618 2.185 3.311 . 0 0 "[ . 1 . 2]" 1
6 1 6 SER HA 1 7 GLY H . . 3.230 2.528 2.142 3.189 . 0 0 "[ . 1 . 2]" 1
7 1 6 SER QB 1 7 GLY H . . 3.940 3.493 2.219 3.950 0.010 10 0 "[ . 1 . 2]" 1
8 1 6 SER QB 1 8 LEU H . . 4.140 3.653 2.592 4.135 . 0 0 "[ . 1 . 2]" 1
9 1 6 SER QB 1 8 LEU MD1 . . 4.210 2.792 2.012 3.757 . 0 0 "[ . 1 . 2]" 1
10 1 6 SER QB 1 8 LEU HG . . 4.510 3.183 2.093 4.340 . 0 0 "[ . 1 . 2]" 1
11 1 7 GLY H 1 8 LEU H . . 3.610 3.073 2.549 3.496 . 0 0 "[ . 1 . 2]" 1
12 1 7 GLY QA 1 8 LEU H . . 3.120 2.627 2.217 2.862 . 0 0 "[ . 1 . 2]" 1
13 1 8 LEU H 1 8 LEU HB2 . . 3.050 2.477 2.241 2.701 . 0 0 "[ . 1 . 2]" 1
14 1 8 LEU H 1 8 LEU HB3 . . 3.800 3.632 3.533 3.725 . 0 0 "[ . 1 . 2]" 1
15 1 8 LEU H 1 8 LEU MD1 . . 4.070 3.463 3.146 3.913 . 0 0 "[ . 1 . 2]" 1
16 1 8 LEU H 1 8 LEU MD2 . . 4.580 3.876 3.514 4.200 . 0 0 "[ . 1 . 2]" 1
17 1 8 LEU H 1 8 LEU HG . . 3.120 2.641 2.103 3.064 . 0 0 "[ . 1 . 2]" 1
18 1 8 LEU H 1 33 ASN HD21 . . 4.570 3.351 2.112 4.563 . 0 0 "[ . 1 . 2]" 1
19 1 8 LEU H 1 33 ASN QD . . 3.910 3.064 2.040 3.872 . 0 0 "[ . 1 . 2]" 1
20 1 8 LEU H 1 33 ASN HD22 . . 4.570 3.880 2.692 4.570 . 1 0 "[ . 1 . 2]" 1
21 1 8 LEU HA 1 8 LEU MD1 . . 4.170 3.912 3.829 3.999 . 0 0 "[ . 1 . 2]" 1
22 1 8 LEU HA 1 8 LEU MD2 . . 3.280 2.404 2.008 2.623 . 0 0 "[ . 1 . 2]" 1
23 1 8 LEU HA 1 8 LEU HG . . 4.090 2.878 2.588 3.155 . 0 0 "[ . 1 . 2]" 1
24 1 8 LEU HA 1 9 PRO HD2 . . 3.410 2.260 2.145 2.404 . 0 0 "[ . 1 . 2]" 1
25 1 8 LEU HA 1 9 PRO HD3 . . 3.370 2.264 2.253 2.301 . 0 0 "[ . 1 . 2]" 1
26 1 8 LEU HA 1 9 PRO HG2 . . 4.860 4.400 4.308 4.515 . 0 0 "[ . 1 . 2]" 1
27 1 8 LEU HA 1 9 PRO HG3 . . 4.770 4.398 4.347 4.474 . 0 0 "[ . 1 . 2]" 1
28 1 8 LEU HA 1 97 LYS HB3 . . 4.570 3.191 2.412 3.918 . 0 0 "[ . 1 . 2]" 1
29 1 8 LEU HB2 1 8 LEU MD1 . . 3.090 2.120 1.997 2.358 . 0 0 "[ . 1 . 2]" 1
30 1 8 LEU HB2 1 9 PRO HD2 . . 4.490 3.811 3.610 3.973 . 0 0 "[ . 1 . 2]" 1
31 1 8 LEU HB2 1 9 PRO HD3 . . 4.890 4.800 4.662 4.902 0.012 19 0 "[ . 1 . 2]" 1
32 1 8 LEU HB3 1 8 LEU MD1 . . 3.460 2.570 2.298 2.691 . 0 0 "[ . 1 . 2]" 1
33 1 8 LEU HB3 1 8 LEU MD2 . . 3.520 2.150 2.025 2.340 . 0 0 "[ . 1 . 2]" 1
34 1 8 LEU HB3 1 9 PRO HD2 . . 3.970 2.318 2.020 2.558 . 0 0 "[ . 1 . 2]" 1
35 1 8 LEU HB3 1 9 PRO HD3 . . 4.280 3.715 3.464 3.915 . 0 0 "[ . 1 . 2]" 1
36 1 8 LEU MD2 1 9 PRO HD2 . . 3.840 2.540 1.978 3.143 . 0 0 "[ . 1 . 2]" 1
37 1 8 LEU MD2 1 9 PRO HD3 . . 4.060 3.461 2.870 3.947 . 0 0 "[ . 1 . 2]" 1
38 1 8 LEU MD2 1 97 LYS HA . . 3.300 2.575 1.858 3.081 . 0 0 "[ . 1 . 2]" 1
39 1 8 LEU MD2 1 97 LYS HB2 . . 4.680 3.569 3.279 4.093 . 0 0 "[ . 1 . 2]" 1
40 1 8 LEU MD2 1 97 LYS HB3 . . 3.470 2.182 1.883 3.094 . 0 0 "[ . 1 . 2]" 1
41 1 8 LEU MD2 1 97 LYS HD2 . . 4.500 3.462 1.796 4.516 0.016 17 0 "[ . 1 . 2]" 1
42 1 8 LEU MD2 1 97 LYS QD . . 3.900 2.810 1.723 3.763 . 0 0 "[ . 1 . 2]" 1
43 1 8 LEU MD2 1 97 LYS HD3 . . 4.500 3.192 1.974 4.309 . 0 0 "[ . 1 . 2]" 1
44 1 8 LEU MD2 1 97 LYS QG . . 3.730 2.347 1.768 3.506 . 0 0 "[ . 1 . 2]" 1
45 1 8 LEU MD2 1 98 ARG H . . 3.560 3.106 2.115 3.563 0.003 11 0 "[ . 1 . 2]" 1
46 1 9 PRO HA 1 10 GLN H . . 3.110 2.219 2.152 2.449 . 0 0 "[ . 1 . 2]" 1
47 1 9 PRO HA 1 33 ASN HB2 . . 3.760 3.150 2.435 3.759 . 0 0 "[ . 1 . 2]" 1
48 1 9 PRO HA 1 33 ASN QB . . 3.270 2.531 2.019 3.140 . 0 0 "[ . 1 . 2]" 1
49 1 9 PRO HA 1 33 ASN HB3 . . 3.760 2.883 2.027 3.634 . 0 0 "[ . 1 . 2]" 1
50 1 9 PRO QB 1 10 GLN H . . 3.900 3.066 2.434 3.381 . 0 0 "[ . 1 . 2]" 1
51 1 9 PRO QB 1 34 PHE QE . . 4.110 3.038 2.312 3.432 . 0 0 "[ . 1 . 2]" 1
52 1 9 PRO QB 1 91 VAL HB . . 3.600 3.116 2.801 3.432 . 0 0 "[ . 1 . 2]" 1
53 1 9 PRO QB 1 91 VAL MG1 . . 3.210 3.052 2.829 3.217 0.007 13 0 "[ . 1 . 2]" 1
54 1 9 PRO QB 1 93 ASN QB . . 5.180 3.465 2.520 4.039 . 0 0 "[ . 1 . 2]" 1
55 1 9 PRO QB 1 93 ASN QD . . 3.540 2.190 1.855 2.568 . 0 0 "[ . 1 . 2]" 1
56 1 9 PRO QB 1 99 SER QB . . 3.430 2.720 1.975 3.426 . 0 0 "[ . 1 . 2]" 1
57 1 9 PRO HB2 1 34 PHE QD . . 4.350 3.815 3.101 4.223 . 0 0 "[ . 1 . 2]" 1
58 1 9 PRO HB2 1 34 PHE QE . . 4.680 3.182 2.365 3.615 . 0 0 "[ . 1 . 2]" 1
59 1 9 PRO HB2 1 91 VAL HB . . 4.340 3.252 2.890 3.591 . 0 0 "[ . 1 . 2]" 1
60 1 9 PRO HB2 1 91 VAL MG1 . . 3.920 3.531 3.290 3.829 . 0 0 "[ . 1 . 2]" 1
61 1 9 PRO HB2 1 93 ASN HD21 . . 4.580 4.109 3.410 4.569 . 0 0 "[ . 1 . 2]" 1
62 1 9 PRO HB2 1 93 ASN HD22 . . 4.580 4.037 3.522 4.623 0.043 16 0 "[ . 1 . 2]" 1
63 1 9 PRO HB3 1 34 PHE QD . . 4.350 3.287 2.480 3.725 . 0 0 "[ . 1 . 2]" 1
64 1 9 PRO HB3 1 34 PHE QE . . 4.680 3.865 3.263 4.273 . 0 0 "[ . 1 . 2]" 1
65 1 9 PRO HB3 1 91 VAL HB . . 4.340 4.005 3.663 4.362 0.022 16 0 "[ . 1 . 2]" 1
66 1 9 PRO HB3 1 91 VAL MG1 . . 3.920 3.345 3.077 3.608 . 0 0 "[ . 1 . 2]" 1
67 1 9 PRO HB3 1 93 ASN HD21 . . 4.580 2.460 1.886 2.830 . 0 0 "[ . 1 . 2]" 1
68 1 9 PRO HB3 1 93 ASN HD22 . . 4.580 2.642 2.025 3.132 . 0 0 "[ . 1 . 2]" 1
69 1 9 PRO HD2 1 97 LYS HB2 . . 5.230 4.790 4.189 5.207 . 0 0 "[ . 1 . 2]" 1
70 1 9 PRO HD2 1 97 LYS HB3 . . 4.120 3.373 2.695 3.809 . 0 0 "[ . 1 . 2]" 1
71 1 9 PRO HD3 1 93 ASN QB . . 4.480 2.735 2.000 3.480 . 0 0 "[ . 1 . 2]" 1
72 1 9 PRO HD3 1 93 ASN QD . . 3.560 3.094 2.109 3.566 0.006 9 0 "[ . 1 . 2]" 1
73 1 9 PRO HD3 1 97 LYS HB2 . . 4.920 4.311 3.545 4.780 . 0 0 "[ . 1 . 2]" 1
74 1 9 PRO HD3 1 97 LYS HB3 . . 4.140 3.300 2.476 3.916 . 0 0 "[ . 1 . 2]" 1
75 1 9 PRO HD3 1 98 ARG HA . . 4.880 4.428 3.533 4.885 0.005 9 0 "[ . 1 . 2]" 1
76 1 9 PRO HG2 1 91 VAL HB . . 4.290 4.039 3.488 4.289 . 0 0 "[ . 1 . 2]" 1
77 1 9 PRO HG2 1 91 VAL MG1 . . 4.660 4.516 4.134 4.666 0.006 9 0 "[ . 1 . 2]" 1
78 1 9 PRO HG2 1 93 ASN QD . . 4.860 4.315 3.844 4.850 . 0 0 "[ . 1 . 2]" 1
79 1 9 PRO HG2 1 98 ARG HA . . 4.520 3.619 2.785 4.245 . 0 0 "[ . 1 . 2]" 1
80 1 9 PRO HG2 1 99 SER H . . 3.940 3.509 3.043 3.917 . 0 0 "[ . 1 . 2]" 1
81 1 9 PRO HG2 1 99 SER HB2 . . 4.470 3.296 1.997 4.172 . 0 0 "[ . 1 . 2]" 1
82 1 9 PRO HG2 1 99 SER HB3 . . 4.470 2.876 1.994 4.432 . 0 0 "[ . 1 . 2]" 1
83 1 9 PRO HG3 1 91 VAL HB . . 4.140 3.746 3.326 4.018 . 0 0 "[ . 1 . 2]" 1
84 1 9 PRO HG3 1 91 VAL MG1 . . 4.060 3.598 3.156 3.885 . 0 0 "[ . 1 . 2]" 1
85 1 9 PRO HG3 1 92 SER HA . . 5.140 4.761 4.130 5.139 . 0 0 "[ . 1 . 2]" 1
86 1 9 PRO HG3 1 93 ASN H . . 4.520 3.798 3.171 4.278 . 0 0 "[ . 1 . 2]" 1
87 1 9 PRO HG3 1 98 ARG HA . . 4.750 3.133 2.143 3.625 . 0 0 "[ . 1 . 2]" 1
88 1 9 PRO HG3 1 99 SER H . . 4.450 3.844 3.275 4.231 . 0 0 "[ . 1 . 2]" 1
89 1 9 PRO HG3 1 99 SER QB . . 4.420 3.393 2.701 4.220 . 0 0 "[ . 1 . 2]" 1
90 1 10 GLN H 1 10 GLN HB2 . . 3.960 2.955 2.543 3.789 . 0 0 "[ . 1 . 2]" 1
91 1 10 GLN H 1 10 GLN QB . . 3.290 2.575 2.435 2.990 . 0 0 "[ . 1 . 2]" 1
92 1 10 GLN H 1 10 GLN HB3 . . 3.960 3.092 2.585 3.847 . 0 0 "[ . 1 . 2]" 1
93 1 10 GLN H 1 10 GLN QG . . 4.090 3.666 2.017 4.104 0.014 3 0 "[ . 1 . 2]" 1
94 1 10 GLN H 1 11 VAL H . . 4.780 4.436 4.300 4.528 . 0 0 "[ . 1 . 2]" 1
95 1 10 GLN H 1 32 SER H . . 3.640 3.090 2.828 3.462 . 0 0 "[ . 1 . 2]" 1
96 1 10 GLN H 1 33 ASN HB2 . . 4.750 3.491 2.812 4.588 . 0 0 "[ . 1 . 2]" 1
97 1 10 GLN H 1 33 ASN QB . . 3.890 3.120 2.705 3.624 . 0 0 "[ . 1 . 2]" 1
98 1 10 GLN H 1 33 ASN HB3 . . 4.750 4.062 2.770 4.743 . 0 0 "[ . 1 . 2]" 1
99 1 10 GLN H 1 34 PHE QD . . 4.370 4.240 3.899 4.376 0.006 8 0 "[ . 1 . 2]" 1
100 1 10 GLN H 1 34 PHE QE . . 3.830 3.534 3.054 3.747 . 0 0 "[ . 1 . 2]" 1
101 1 10 GLN HA 1 10 GLN QG . . 3.700 2.533 2.220 3.339 . 0 0 "[ . 1 . 2]" 1
102 1 10 GLN HA 1 11 VAL H . . 3.000 2.260 2.194 2.328 . 0 0 "[ . 1 . 2]" 1
103 1 10 GLN HA 1 11 VAL HB . . 4.800 4.531 4.478 4.568 . 0 0 "[ . 1 . 2]" 1
104 1 10 GLN QB 1 11 VAL H . . 3.650 3.215 2.578 3.623 . 0 0 "[ . 1 . 2]" 1
105 1 10 GLN QB 1 32 SER H . . 3.710 2.621 2.300 3.710 0.000 9 0 "[ . 1 . 2]" 1
106 1 10 GLN HB2 1 11 VAL H . . 4.250 3.955 2.986 4.129 . 0 0 "[ . 1 . 2]" 1
107 1 10 GLN HB2 1 32 SER H . . 4.380 3.656 2.338 4.324 . 0 0 "[ . 1 . 2]" 1
108 1 10 GLN HB3 1 11 VAL H . . 4.250 3.507 2.625 4.089 . 0 0 "[ . 1 . 2]" 1
109 1 10 GLN HB3 1 32 SER H . . 4.380 3.059 2.316 4.339 . 0 0 "[ . 1 . 2]" 1
110 1 10 GLN QG 1 11 VAL H . . 4.280 2.943 2.066 4.128 . 0 0 "[ . 1 . 2]" 1
111 1 10 GLN QG 1 32 SER H . . 4.780 3.985 1.738 4.757 . 0 0 "[ . 1 . 2]" 1
112 1 11 VAL H 1 11 VAL HB . . 3.380 2.703 2.632 2.744 . 0 0 "[ . 1 . 2]" 1
113 1 11 VAL H 1 11 VAL MG1 . . 4.450 3.868 3.838 3.885 . 0 0 "[ . 1 . 2]" 1
114 1 11 VAL H 1 11 VAL MG2 . . 3.500 2.910 2.746 3.002 . 0 0 "[ . 1 . 2]" 1
115 1 11 VAL HA 1 11 VAL MG1 . . 3.390 2.385 2.313 2.461 . 0 0 "[ . 1 . 2]" 1
116 1 11 VAL HA 1 11 VAL MG2 . . 3.390 2.352 2.271 2.439 . 0 0 "[ . 1 . 2]" 1
117 1 11 VAL HA 1 12 GLU H . . 3.340 2.221 2.180 2.263 . 0 0 "[ . 1 . 2]" 1
118 1 11 VAL HA 1 12 GLU HB2 . . 4.550 4.445 4.402 4.493 . 0 0 "[ . 1 . 2]" 1
119 1 11 VAL HA 1 13 ALA H . . 4.520 4.092 3.737 4.337 . 0 0 "[ . 1 . 2]" 1
120 1 11 VAL HA 1 31 GLY HA2 . . 4.030 3.446 3.192 3.717 . 0 0 "[ . 1 . 2]" 1
121 1 11 VAL HA 1 31 GLY HA3 . . 4.050 2.582 2.341 2.752 . 0 0 "[ . 1 . 2]" 1
122 1 11 VAL HA 1 32 SER H . . 4.330 4.136 3.932 4.296 . 0 0 "[ . 1 . 2]" 1
123 1 11 VAL HA 1 34 PHE HZ . . 4.250 2.894 2.641 3.206 . 0 0 "[ . 1 . 2]" 1
124 1 11 VAL HB 1 102 GLN HE21 . . 4.610 3.942 2.895 4.610 . 0 0 "[ . 1 . 2]" 1
125 1 11 VAL HB 1 102 GLN QE . . 3.980 3.473 2.635 3.982 0.002 20 0 "[ . 1 . 2]" 1
126 1 11 VAL HB 1 102 GLN HE22 . . 4.610 3.892 3.031 4.610 . 14 0 "[ . 1 . 2]" 1
127 1 11 VAL HB 1 102 GLN HG2 . . 4.510 4.263 3.549 4.510 0.000 6 0 "[ . 1 . 2]" 1
128 1 11 VAL HB 1 102 GLN QG . . 3.960 3.740 3.080 3.961 0.001 1 0 "[ . 1 . 2]" 1
129 1 11 VAL HB 1 102 GLN HG3 . . 4.510 4.169 3.380 4.510 . 0 0 "[ . 1 . 2]" 1
130 1 11 VAL MG1 1 12 GLU H . . 3.820 3.245 3.039 3.431 . 0 0 "[ . 1 . 2]" 1
131 1 11 VAL MG1 1 13 ALA H . . 3.570 3.180 2.765 3.544 . 0 0 "[ . 1 . 2]" 1
132 1 11 VAL MG1 1 14 TYR HB2 . . 4.780 4.528 4.272 4.746 . 0 0 "[ . 1 . 2]" 1
133 1 11 VAL MG1 1 14 TYR HB3 . . 4.370 3.130 2.887 3.318 . 0 0 "[ . 1 . 2]" 1
134 1 11 VAL MG1 1 14 TYR QD . . 3.480 2.555 2.258 2.727 . 0 0 "[ . 1 . 2]" 1
135 1 11 VAL MG1 1 14 TYR QE . . 4.110 3.896 3.580 4.112 0.002 17 0 "[ . 1 . 2]" 1
136 1 11 VAL MG1 1 30 THR H . . 4.380 3.742 3.018 4.305 . 0 0 "[ . 1 . 2]" 1
137 1 11 VAL MG1 1 89 PHE HZ . . 4.980 4.824 4.379 4.968 . 0 0 "[ . 1 . 2]" 1
138 1 11 VAL MG1 1 102 GLN HG2 . . 3.950 3.232 2.463 3.779 . 0 0 "[ . 1 . 2]" 1
139 1 11 VAL MG1 1 102 GLN QG . . 3.470 2.501 2.064 2.746 . 0 0 "[ . 1 . 2]" 1
140 1 11 VAL MG1 1 102 GLN HG3 . . 3.950 2.825 2.095 3.885 . 0 0 "[ . 1 . 2]" 1
141 1 11 VAL MG2 1 12 GLU H . . 4.310 4.225 4.175 4.279 . 0 0 "[ . 1 . 2]" 1
142 1 11 VAL MG2 1 34 PHE QE . . 3.850 2.918 2.629 3.291 . 0 0 "[ . 1 . 2]" 1
143 1 11 VAL MG2 1 34 PHE HZ . . 4.020 2.798 2.374 3.388 . 0 0 "[ . 1 . 2]" 1
144 1 11 VAL MG2 1 99 SER HB2 . . 4.670 3.206 2.533 4.328 . 0 0 "[ . 1 . 2]" 1
145 1 11 VAL MG2 1 99 SER QB . . 3.810 2.896 2.433 3.616 . 0 0 "[ . 1 . 2]" 1
146 1 11 VAL MG2 1 99 SER HB3 . . 4.670 3.529 2.780 4.241 . 0 0 "[ . 1 . 2]" 1
147 1 11 VAL MG2 1 102 GLN QE . . 4.570 3.627 2.444 4.363 . 0 0 "[ . 1 . 2]" 1
148 1 12 GLU H 1 12 GLU HB2 . . 3.800 2.262 2.186 2.385 . 0 0 "[ . 1 . 2]" 1
149 1 12 GLU H 1 12 GLU HB3 . . 3.960 2.841 2.729 2.930 . 0 0 "[ . 1 . 2]" 1
150 1 12 GLU H 1 12 GLU QG . . 4.190 3.948 3.805 4.071 . 0 0 "[ . 1 . 2]" 1
151 1 12 GLU H 1 13 ALA H . . 3.060 2.814 2.597 3.015 . 0 0 "[ . 1 . 2]" 1
152 1 12 GLU H 1 13 ALA MB . . 5.060 4.907 4.746 5.051 . 0 0 "[ . 1 . 2]" 1
153 1 12 GLU H 1 31 GLY HA2 . . 3.900 2.153 1.930 2.569 . 0 0 "[ . 1 . 2]" 1
154 1 12 GLU H 1 31 GLY HA3 . . 4.160 2.646 2.396 2.894 . 0 0 "[ . 1 . 2]" 1
155 1 12 GLU H 1 32 SER H . . 4.690 4.335 4.033 4.682 . 0 0 "[ . 1 . 2]" 1
156 1 12 GLU HA 1 12 GLU QG . . 3.720 2.389 2.166 2.675 . 0 0 "[ . 1 . 2]" 1
157 1 12 GLU HB2 1 13 ALA H . . 3.680 3.416 3.285 3.562 . 0 0 "[ . 1 . 2]" 1
158 1 12 GLU HB2 1 30 THR HB . . 4.800 4.246 3.874 4.535 . 0 0 "[ . 1 . 2]" 1
159 1 12 GLU HB2 1 30 THR MG . . 4.140 3.185 2.861 3.986 . 0 0 "[ . 1 . 2]" 1
160 1 12 GLU HB2 1 31 GLY HA2 . . 4.060 2.377 2.036 2.758 . 0 0 "[ . 1 . 2]" 1
161 1 12 GLU HB2 1 31 GLY HA3 . . 4.220 3.932 3.613 4.225 0.005 9 0 "[ . 1 . 2]" 1
162 1 12 GLU HB3 1 13 ALA H . . 3.710 2.200 1.957 2.521 . 0 0 "[ . 1 . 2]" 1
163 1 12 GLU HB3 1 13 ALA MB . . 4.250 3.240 3.128 3.338 . 0 0 "[ . 1 . 2]" 1
164 1 12 GLU HB3 1 30 THR HB . . 5.000 2.861 2.501 3.257 . 0 0 "[ . 1 . 2]" 1
165 1 12 GLU HB3 1 30 THR MG . . 4.270 2.396 2.057 3.225 . 0 0 "[ . 1 . 2]" 1
166 1 12 GLU HB3 1 31 GLY HA2 . . 4.410 3.446 3.176 3.838 . 0 0 "[ . 1 . 2]" 1
167 1 12 GLU QG 1 13 ALA H . . 4.520 3.810 3.553 4.281 . 0 0 "[ . 1 . 2]" 1
168 1 12 GLU QG 1 13 ALA MB . . 4.150 3.433 3.144 4.089 . 0 0 "[ . 1 . 2]" 1
169 1 12 GLU QG 1 31 GLY HA2 . . 4.800 4.392 3.937 4.734 . 0 0 "[ . 1 . 2]" 1
170 1 13 ALA H 1 13 ALA MB . . 3.450 2.707 2.582 2.826 . 0 0 "[ . 1 . 2]" 1
171 1 13 ALA H 1 14 TYR H . . 4.440 4.380 4.211 4.420 . 0 0 "[ . 1 . 2]" 1
172 1 13 ALA H 1 30 THR H . . 3.800 3.421 3.166 3.671 . 0 0 "[ . 1 . 2]" 1
173 1 13 ALA H 1 30 THR HB . . 3.900 2.114 1.900 2.483 . 0 0 "[ . 1 . 2]" 1
174 1 13 ALA H 1 30 THR MG . . 4.770 3.236 2.945 3.907 . 0 0 "[ . 1 . 2]" 1
175 1 13 ALA HA 1 14 TYR H . . 2.980 2.458 2.194 2.590 . 0 0 "[ . 1 . 2]" 1
176 1 13 ALA HA 1 14 TYR HA . . 4.700 4.518 4.387 4.586 . 0 0 "[ . 1 . 2]" 1
177 1 13 ALA HA 1 14 TYR QD . . 4.420 3.704 3.129 4.004 . 0 0 "[ . 1 . 2]" 1
178 1 13 ALA MB 1 14 TYR H . . 3.120 2.381 2.087 2.904 . 0 0 "[ . 1 . 2]" 1
179 1 13 ALA MB 1 14 TYR HA . . 4.600 3.872 3.742 4.159 . 0 0 "[ . 1 . 2]" 1
180 1 13 ALA MB 1 30 THR H . . 4.420 4.115 3.789 4.322 . 0 0 "[ . 1 . 2]" 1
181 1 13 ALA MB 1 30 THR HB . . 3.460 2.753 2.213 3.011 . 0 0 "[ . 1 . 2]" 1
182 1 14 TYR H 1 14 TYR HB3 . . 3.630 3.398 3.083 3.523 . 0 0 "[ . 1 . 2]" 1
183 1 14 TYR H 1 14 TYR QD . . 3.500 3.245 2.824 3.421 . 0 0 "[ . 1 . 2]" 1
184 1 14 TYR H 1 14 TYR QE . . 4.760 4.393 3.985 4.591 . 0 0 "[ . 1 . 2]" 1
185 1 14 TYR HA 1 14 TYR QD . . 4.310 3.717 3.686 3.737 . 0 0 "[ . 1 . 2]" 1
186 1 14 TYR HA 1 15 SER H . . 2.940 2.249 2.171 2.446 . 0 0 "[ . 1 . 2]" 1
187 1 14 TYR HA 1 15 SER HA . . 4.780 4.466 4.421 4.560 . 0 0 "[ . 1 . 2]" 1
188 1 14 TYR HA 1 29 LEU HA . . 3.660 2.610 2.381 2.879 . 0 0 "[ . 1 . 2]" 1
189 1 14 TYR HA 1 29 LEU MD2 . . 4.380 3.244 3.016 3.473 . 0 0 "[ . 1 . 2]" 1
190 1 14 TYR HA 1 30 THR H . . 4.000 2.825 2.573 3.086 . 0 0 "[ . 1 . 2]" 1
191 1 14 TYR HB2 1 15 SER H . . 3.510 2.868 2.331 3.163 . 0 0 "[ . 1 . 2]" 1
192 1 14 TYR HB2 1 27 LEU MD1 . . 3.650 2.840 2.534 3.057 . 0 0 "[ . 1 . 2]" 1
193 1 14 TYR HB2 1 29 LEU HA . . 4.270 3.564 3.260 3.794 . 0 0 "[ . 1 . 2]" 1
194 1 14 TYR HB2 1 29 LEU MD2 . . 3.830 2.309 1.987 2.656 . 0 0 "[ . 1 . 2]" 1
195 1 14 TYR HB2 1 30 THR H . . 4.990 4.727 4.479 4.942 . 0 0 "[ . 1 . 2]" 1
196 1 14 TYR HB3 1 15 SER H . . 4.900 3.941 3.558 4.101 . 0 0 "[ . 1 . 2]" 1
197 1 14 TYR HB3 1 27 LEU MD1 . . 4.390 4.282 4.012 4.390 0.000 4 0 "[ . 1 . 2]" 1
198 1 14 TYR HB3 1 29 LEU HA . . 4.160 3.159 2.942 3.484 . 0 0 "[ . 1 . 2]" 1
199 1 14 TYR HB3 1 29 LEU MD2 . . 3.810 2.122 1.919 2.402 . 0 0 "[ . 1 . 2]" 1
200 1 14 TYR HB3 1 30 THR H . . 4.630 3.775 3.486 3.984 . 0 0 "[ . 1 . 2]" 1
201 1 14 TYR QD 1 27 LEU MD1 . . 3.960 3.622 3.304 3.871 . 0 0 "[ . 1 . 2]" 1
202 1 14 TYR QD 1 27 LEU MD2 . . 5.280 4.939 4.485 5.187 . 0 0 "[ . 1 . 2]" 1
203 1 14 TYR QD 1 29 LEU MD2 . . 4.410 3.447 3.160 3.750 . 0 0 "[ . 1 . 2]" 1
204 1 14 TYR QD 1 89 PHE QE . . 4.600 4.018 3.657 4.564 . 0 0 "[ . 1 . 2]" 1
205 1 14 TYR QD 1 89 PHE HZ . . 4.420 3.573 3.309 3.910 . 0 0 "[ . 1 . 2]" 1
206 1 14 TYR QE 1 17 SER HB2 . . 4.430 3.842 2.149 4.439 0.009 20 0 "[ . 1 . 2]" 1
207 1 14 TYR QE 1 17 SER QB . . 3.720 3.419 2.093 3.724 0.004 2 0 "[ . 1 . 2]" 1
208 1 14 TYR QE 1 17 SER HB3 . . 4.430 4.089 2.884 4.443 0.013 5 0 "[ . 1 . 2]" 1
209 1 14 TYR QE 1 89 PHE QE . . 4.640 4.477 4.156 4.641 0.001 5 0 "[ . 1 . 2]" 1
210 1 14 TYR QE 1 89 PHE HZ . . 4.570 4.154 3.859 4.566 . 0 0 "[ . 1 . 2]" 1
211 1 14 TYR QE 1 102 GLN HB2 . . 4.630 3.923 3.496 4.632 0.002 16 0 "[ . 1 . 2]" 1
212 1 14 TYR QE 1 102 GLN QB . . 3.780 2.399 2.071 3.299 . 0 0 "[ . 1 . 2]" 1
213 1 14 TYR QE 1 102 GLN HB3 . . 4.630 2.423 2.086 3.377 . 0 0 "[ . 1 . 2]" 1
214 1 14 TYR QE 1 103 SER H . . 4.430 3.878 3.243 4.381 . 0 0 "[ . 1 . 2]" 1
215 1 15 SER H 1 15 SER HB2 . . 3.890 3.573 2.797 3.899 0.009 13 0 "[ . 1 . 2]" 1
216 1 15 SER H 1 15 SER QB . . 3.330 3.053 2.727 3.263 . 0 0 "[ . 1 . 2]" 1
217 1 15 SER H 1 15 SER HB3 . . 3.890 3.441 2.945 3.857 . 0 0 "[ . 1 . 2]" 1
218 1 15 SER H 1 16 PRO HA . . 4.970 4.767 4.699 4.781 . 0 0 "[ . 1 . 2]" 1
219 1 15 SER H 1 27 LEU MD1 . . 3.710 2.932 2.536 3.198 . 0 0 "[ . 1 . 2]" 1
220 1 15 SER H 1 28 VAL H . . 3.860 3.647 3.370 3.862 0.002 16 0 "[ . 1 . 2]" 1
221 1 15 SER H 1 28 VAL HB . . 4.430 4.106 3.772 4.431 0.001 3 0 "[ . 1 . 2]" 1
222 1 15 SER H 1 29 LEU HA . . 4.060 3.728 3.495 3.927 . 0 0 "[ . 1 . 2]" 1
223 1 15 SER H 1 29 LEU MD2 . . 4.910 3.944 3.459 4.402 . 0 0 "[ . 1 . 2]" 1
224 1 15 SER HA 1 16 PRO HA . . 3.260 2.293 2.118 2.378 . 0 0 "[ . 1 . 2]" 1
225 1 15 SER HA 1 16 PRO HB2 . . 4.810 4.347 4.269 4.393 . 0 0 "[ . 1 . 2]" 1
226 1 15 SER HA 1 16 PRO HB3 . . 4.640 4.416 4.279 4.485 . 0 0 "[ . 1 . 2]" 1
227 1 15 SER HA 1 17 SER H . . 4.020 2.829 2.608 3.316 . 0 0 "[ . 1 . 2]" 1
228 1 15 SER HA 1 27 LEU MD1 . . 4.670 3.697 3.471 3.927 . 0 0 "[ . 1 . 2]" 1
229 1 15 SER QB 1 16 PRO HA . . 3.580 2.360 1.970 3.385 . 0 0 "[ . 1 . 2]" 1
230 1 15 SER HB2 1 16 PRO HA . . 4.080 2.748 1.989 3.884 . 0 0 "[ . 1 . 2]" 1
231 1 15 SER HB3 1 16 PRO HA . . 4.080 3.148 2.243 3.850 . 0 0 "[ . 1 . 2]" 1
232 1 16 PRO HA 1 17 SER H . . 3.330 2.240 2.190 2.387 . 0 0 "[ . 1 . 2]" 1
233 1 16 PRO HA 1 17 SER HA . . 4.750 4.326 4.309 4.367 . 0 0 "[ . 1 . 2]" 1
234 1 16 PRO HA 1 18 ALA H . . 4.110 3.955 3.751 4.094 . 0 0 "[ . 1 . 2]" 1
235 1 16 PRO HB2 1 17 SER H . . 3.440 3.097 2.649 3.283 . 0 0 "[ . 1 . 2]" 1
236 1 16 PRO HB2 1 18 ALA H . . 3.210 2.419 2.118 2.509 . 0 0 "[ . 1 . 2]" 1
237 1 16 PRO HB3 1 17 SER H . . 3.930 3.725 3.472 3.837 . 0 0 "[ . 1 . 2]" 1
238 1 16 PRO HB3 1 18 ALA H . . 4.160 4.083 3.844 4.161 0.001 17 0 "[ . 1 . 2]" 1
239 1 16 PRO QD 1 27 LEU HA . . 3.320 2.602 2.200 3.024 . 0 0 "[ . 1 . 2]" 1
240 1 16 PRO QD 1 27 LEU MD1 . . 3.250 2.204 1.964 2.407 . 0 0 "[ . 1 . 2]" 1
241 1 16 PRO QD 1 28 VAL H . . 3.820 3.650 3.215 3.820 . 0 0 "[ . 1 . 2]" 1
242 1 16 PRO HD2 1 27 LEU HA . . 3.810 2.686 2.250 3.173 . 0 0 "[ . 1 . 2]" 1
243 1 16 PRO HD2 1 27 LEU MD1 . . 3.730 2.225 1.975 2.438 . 0 0 "[ . 1 . 2]" 1
244 1 16 PRO HD2 1 28 VAL H . . 4.480 3.985 3.314 4.188 . 0 0 "[ . 1 . 2]" 1
245 1 16 PRO HD3 1 27 LEU HA . . 3.810 3.510 3.108 3.812 0.002 17 0 "[ . 1 . 2]" 1
246 1 16 PRO HD3 1 27 LEU MD1 . . 3.730 3.581 3.355 3.734 0.004 19 0 "[ . 1 . 2]" 1
247 1 16 PRO HD3 1 28 VAL H . . 4.480 4.258 3.798 4.482 0.002 19 0 "[ . 1 . 2]" 1
248 1 16 PRO HG2 1 18 ALA H . . 4.050 3.710 3.101 3.926 . 0 0 "[ . 1 . 2]" 1
249 1 16 PRO HG2 1 19 CYS QB . . 4.410 3.225 2.710 4.116 . 0 0 "[ . 1 . 2]" 1
250 1 16 PRO HG2 1 104 PHE HZ . . 4.850 3.712 3.265 4.265 . 0 0 "[ . 1 . 2]" 1
251 1 16 PRO HG3 1 18 ALA H . . 4.960 4.808 4.300 4.934 . 0 0 "[ . 1 . 2]" 1
252 1 17 SER H 1 17 SER HB2 . . 4.040 2.989 2.260 3.645 . 0 0 "[ . 1 . 2]" 1
253 1 17 SER H 1 17 SER QB . . 3.550 2.410 2.185 2.693 . 0 0 "[ . 1 . 2]" 1
254 1 17 SER H 1 17 SER HB3 . . 4.040 2.796 2.401 3.603 . 0 0 "[ . 1 . 2]" 1
255 1 17 SER H 1 18 ALA H . . 3.060 2.785 2.405 2.910 . 0 0 "[ . 1 . 2]" 1
256 1 18 ALA H 1 18 ALA MB . . 3.370 2.623 2.542 2.830 . 0 0 "[ . 1 . 2]" 1
257 1 18 ALA H 1 19 CYS H . . 4.560 4.382 4.050 4.429 . 0 0 "[ . 1 . 2]" 1
258 1 18 ALA H 1 104 PHE HZ . . 4.680 4.445 3.467 4.684 0.004 19 0 "[ . 1 . 2]" 1
259 1 18 ALA HA 1 19 CYS H . . 3.000 2.432 2.157 2.582 . 0 0 "[ . 1 . 2]" 1
260 1 18 ALA HA 1 104 PHE HZ . . 3.590 2.988 2.563 3.546 . 0 0 "[ . 1 . 2]" 1
261 1 18 ALA HA 1 105 ARG H . . 3.660 3.379 3.032 3.629 . 0 0 "[ . 1 . 2]" 1
262 1 18 ALA HA 1 105 ARG HB3 . . 5.000 4.805 4.435 4.992 . 0 0 "[ . 1 . 2]" 1
263 1 18 ALA MB 1 19 CYS H . . 3.300 2.413 2.137 3.132 . 0 0 "[ . 1 . 2]" 1
264 1 18 ALA MB 1 105 ARG H . . 3.650 3.368 3.004 3.616 . 0 0 "[ . 1 . 2]" 1
265 1 18 ALA MB 1 105 ARG HB2 . . 4.810 4.541 2.846 4.816 0.006 2 0 "[ . 1 . 2]" 1
266 1 18 ALA MB 1 105 ARG HB3 . . 3.870 3.212 2.930 3.484 . 0 0 "[ . 1 . 2]" 1
267 1 18 ALA MB 1 105 ARG QD . . 4.980 4.380 3.140 4.985 0.005 20 0 "[ . 1 . 2]" 1
268 1 18 ALA MB 1 105 ARG QG . . 4.540 4.276 3.903 4.539 . 0 0 "[ . 1 . 2]" 1
269 1 18 ALA MB 1 107 LEU HG . . 3.210 2.922 2.578 3.211 0.001 19 0 "[ . 1 . 2]" 1
270 1 19 CYS H 1 20 SER H . . 4.810 4.384 4.356 4.432 . 0 0 "[ . 1 . 2]" 1
271 1 19 CYS H 1 104 PHE QE . . 4.150 3.069 2.097 3.972 . 0 0 "[ . 1 . 2]" 1
272 1 19 CYS H 1 104 PHE HZ . . 3.850 3.310 2.546 3.783 . 0 0 "[ . 1 . 2]" 1
273 1 19 CYS H 1 105 ARG H . . 4.350 4.225 4.050 4.388 0.038 16 0 "[ . 1 . 2]" 1
274 1 19 CYS H 1 106 PHE HA . . 3.660 3.126 2.773 3.352 . 0 0 "[ . 1 . 2]" 1
275 1 19 CYS H 1 106 PHE QD . . 4.630 3.394 2.858 3.775 . 0 0 "[ . 1 . 2]" 1
276 1 19 CYS H 1 107 LEU H . . 4.080 3.780 3.584 4.006 . 0 0 "[ . 1 . 2]" 1
277 1 19 CYS H 1 107 LEU MD1 . . 4.340 3.983 3.402 4.322 . 0 0 "[ . 1 . 2]" 1
278 1 19 CYS H 1 107 LEU HG . . 3.810 3.713 3.583 3.809 . 0 0 "[ . 1 . 2]" 1
279 1 19 CYS HA 1 20 SER H . . 3.340 2.550 2.443 2.642 . 0 0 "[ . 1 . 2]" 1
280 1 19 CYS QB 1 20 SER H . . 3.200 2.647 1.998 3.152 . 0 0 "[ . 1 . 2]" 1
281 1 19 CYS QB 1 25 GLU QB . . 5.180 3.899 3.121 4.676 . 0 0 "[ . 1 . 2]" 1
282 1 19 CYS QB 1 73 VAL MG1 . . 3.560 2.806 2.110 3.313 . 0 0 "[ . 1 . 2]" 1
283 1 19 CYS QB 1 104 PHE QE . . 4.090 2.705 1.982 3.418 . 0 0 "[ . 1 . 2]" 1
284 1 19 CYS QB 1 106 PHE QD . . 5.110 3.084 2.690 4.205 . 0 0 "[ . 1 . 2]" 1
285 1 19 CYS HB2 1 20 SER H . . 3.860 3.671 2.191 3.859 . 0 0 "[ . 1 . 2]" 1
286 1 19 CYS HB2 1 73 VAL MG1 . . 4.290 3.546 2.970 4.286 . 0 0 "[ . 1 . 2]" 1
287 1 19 CYS HB2 1 73 VAL MG2 . . 4.570 3.183 2.268 3.969 . 0 0 "[ . 1 . 2]" 1
288 1 19 CYS HB2 1 104 PHE QE . . 4.790 3.143 1.994 4.489 . 0 0 "[ . 1 . 2]" 1
289 1 19 CYS HB2 1 104 PHE HZ . . 4.060 2.434 1.998 3.970 . 0 0 "[ . 1 . 2]" 1
290 1 19 CYS HB3 1 20 SER H . . 3.860 2.799 2.010 3.678 . 0 0 "[ . 1 . 2]" 1
291 1 19 CYS HB3 1 73 VAL MG1 . . 4.290 3.011 2.143 3.851 . 0 0 "[ . 1 . 2]" 1
292 1 19 CYS HB3 1 73 VAL MG2 . . 4.570 3.372 2.444 4.207 . 0 0 "[ . 1 . 2]" 1
293 1 19 CYS HB3 1 104 PHE QE . . 4.790 3.227 2.583 4.209 . 0 0 "[ . 1 . 2]" 1
294 1 19 CYS HB3 1 104 PHE HZ . . 4.060 3.399 2.354 4.022 . 0 0 "[ . 1 . 2]" 1
295 1 19 CYS HG 1 20 SER H . . 3.950 3.063 1.969 3.826 . 0 0 "[ . 1 . 2]" 1
296 1 20 SER H 1 20 SER HB2 . . 3.690 2.661 2.212 3.660 . 0 0 "[ . 1 . 2]" 1
297 1 20 SER H 1 20 SER QB . . 3.060 2.445 2.190 2.824 . 0 0 "[ . 1 . 2]" 1
298 1 20 SER H 1 20 SER HB3 . . 3.690 3.404 2.669 3.662 . 0 0 "[ . 1 . 2]" 1
299 1 20 SER H 1 21 VAL H . . 4.880 4.589 4.536 4.625 . 0 0 "[ . 1 . 2]" 1
300 1 20 SER HA 1 21 VAL H . . 3.150 2.306 2.184 2.492 . 0 0 "[ . 1 . 2]" 1
301 1 20 SER HA 1 21 VAL MG2 . . 4.300 3.860 3.564 4.071 . 0 0 "[ . 1 . 2]" 1
302 1 20 SER HA 1 106 PHE HA . . 4.660 3.868 3.493 4.209 . 0 0 "[ . 1 . 2]" 1
303 1 20 SER HA 1 107 LEU H . . 3.690 2.379 2.000 2.677 . 0 0 "[ . 1 . 2]" 1
304 1 20 SER HA 1 107 LEU HB2 . . 4.530 2.935 2.301 3.188 . 0 0 "[ . 1 . 2]" 1
305 1 20 SER HA 1 107 LEU HB3 . . 4.640 4.493 3.947 4.652 0.012 9 0 "[ . 1 . 2]" 1
306 1 20 SER HA 1 107 LEU MD1 . . 4.490 4.192 3.668 4.479 . 0 0 "[ . 1 . 2]" 1
307 1 20 SER QB 1 21 VAL H . . 3.540 2.695 2.213 3.075 . 0 0 "[ . 1 . 2]" 1
308 1 20 SER QB 1 21 VAL MG2 . . 3.770 3.177 2.992 3.481 . 0 0 "[ . 1 . 2]" 1
309 1 20 SER QB 1 22 ARG QG . . 3.990 2.706 1.777 3.994 0.004 8 0 "[ . 1 . 2]" 1
310 1 20 SER QB 1 109 VAL MG2 . . 3.410 2.256 1.829 3.126 . 0 0 "[ . 1 . 2]" 1
311 1 20 SER HB2 1 21 VAL H . . 4.250 3.653 2.521 4.164 . 0 0 "[ . 1 . 2]" 1
312 1 20 SER HB2 1 22 ARG H . . 4.220 3.175 2.581 4.184 . 0 0 "[ . 1 . 2]" 1
313 1 20 SER HB2 1 109 VAL MG2 . . 3.960 3.184 1.899 3.961 0.001 1 0 "[ . 1 . 2]" 1
314 1 20 SER HB3 1 21 VAL H . . 4.250 2.985 2.237 4.084 . 0 0 "[ . 1 . 2]" 1
315 1 20 SER HB3 1 22 ARG H . . 4.220 2.921 2.258 4.222 0.002 14 0 "[ . 1 . 2]" 1
316 1 20 SER HB3 1 109 VAL MG2 . . 3.960 2.504 1.848 3.893 . 0 0 "[ . 1 . 2]" 1
317 1 21 VAL H 1 21 VAL HB . . 4.160 3.608 3.572 3.635 . 0 0 "[ . 1 . 2]" 1
318 1 21 VAL H 1 21 VAL MG1 . . 3.290 2.378 1.999 2.730 . 0 0 "[ . 1 . 2]" 1
319 1 21 VAL H 1 21 VAL MG2 . . 3.180 2.019 1.858 2.251 . 0 0 "[ . 1 . 2]" 1
320 1 21 VAL H 1 22 ARG H . . 3.980 2.725 2.411 2.970 . 0 0 "[ . 1 . 2]" 1
321 1 21 VAL H 1 107 LEU H . . 4.170 3.510 2.847 4.045 . 0 0 "[ . 1 . 2]" 1
322 1 21 VAL H 1 109 VAL MG2 . . 4.780 3.406 2.849 4.637 . 0 0 "[ . 1 . 2]" 1
323 1 21 VAL HA 1 21 VAL MG1 . . 3.300 2.238 2.113 2.406 . 0 0 "[ . 1 . 2]" 1
324 1 21 VAL HA 1 23 GLY H . . 4.380 4.109 3.410 4.383 0.003 16 0 "[ . 1 . 2]" 1
325 1 21 VAL HA 1 76 TYR H . . 4.160 3.830 3.274 4.162 0.002 19 0 "[ . 1 . 2]" 1
326 1 21 VAL HA 1 76 TYR HB2 . . 4.060 3.114 2.782 3.358 . 0 0 "[ . 1 . 2]" 1
327 1 21 VAL HA 1 76 TYR HB3 . . 4.060 3.692 3.262 4.044 . 0 0 "[ . 1 . 2]" 1
328 1 21 VAL HA 1 106 PHE HB2 . . 4.770 3.426 3.189 3.857 . 0 0 "[ . 1 . 2]" 1
329 1 21 VAL HA 1 106 PHE HB3 . . 4.100 2.129 1.993 2.477 . 0 0 "[ . 1 . 2]" 1
330 1 21 VAL HA 1 106 PHE QD . . 3.640 3.374 3.057 3.644 0.004 16 0 "[ . 1 . 2]" 1
331 1 21 VAL HA 1 106 PHE QE . . 4.880 4.585 4.157 4.884 0.004 6 0 "[ . 1 . 2]" 1
332 1 21 VAL HB 1 76 TYR H . . 4.190 3.823 3.349 4.164 . 0 0 "[ . 1 . 2]" 1
333 1 21 VAL HB 1 76 TYR HB2 . . 4.230 3.291 1.997 4.219 . 0 0 "[ . 1 . 2]" 1
334 1 21 VAL HB 1 76 TYR QB . . 3.590 2.444 1.802 2.916 . 0 0 "[ . 1 . 2]" 1
335 1 21 VAL HB 1 76 TYR HB3 . . 4.230 2.540 2.050 2.972 . 0 0 "[ . 1 . 2]" 1
336 1 21 VAL HB 1 76 TYR QD . . 4.650 3.327 2.831 4.091 . 0 0 "[ . 1 . 2]" 1
337 1 21 VAL HB 1 79 LYS HA . . 4.010 3.011 2.233 3.790 . 0 0 "[ . 1 . 2]" 1
338 1 21 VAL HB 1 79 LYS HG2 . . 4.740 2.779 2.127 3.776 . 0 0 "[ . 1 . 2]" 1
339 1 21 VAL HB 1 79 LYS HG3 . . 4.740 4.219 3.213 4.692 . 0 0 "[ . 1 . 2]" 1
340 1 21 VAL MG1 1 22 ARG H . . 4.840 4.118 3.951 4.264 . 0 0 "[ . 1 . 2]" 1
341 1 21 VAL MG1 1 76 TYR QB . . 4.160 2.867 2.325 3.285 . 0 0 "[ . 1 . 2]" 1
342 1 21 VAL MG1 1 76 TYR QD . . 3.880 2.799 2.182 3.354 . 0 0 "[ . 1 . 2]" 1
343 1 21 VAL MG1 1 79 LYS HA . . 4.120 3.327 2.725 3.869 . 0 0 "[ . 1 . 2]" 1
344 1 21 VAL MG1 1 106 PHE HA . . 4.420 3.857 3.589 4.145 . 0 0 "[ . 1 . 2]" 1
345 1 21 VAL MG1 1 106 PHE HB2 . . 3.900 2.158 2.020 2.340 . 0 0 "[ . 1 . 2]" 1
346 1 21 VAL MG1 1 106 PHE HB3 . . 3.440 1.917 1.820 2.048 . 0 0 "[ . 1 . 2]" 1
347 1 21 VAL MG1 1 106 PHE QD . . 4.150 3.138 2.974 3.376 . 0 0 "[ . 1 . 2]" 1
348 1 21 VAL MG1 1 107 LEU H . . 4.370 3.742 3.300 4.301 . 0 0 "[ . 1 . 2]" 1
349 1 21 VAL MG1 1 108 PRO HA . . 3.390 3.186 2.919 3.391 0.001 12 0 "[ . 1 . 2]" 1
350 1 21 VAL MG1 1 109 VAL H . . 5.040 4.458 3.847 4.928 . 0 0 "[ . 1 . 2]" 1
351 1 21 VAL MG2 1 22 ARG H . . 3.630 2.215 1.993 2.528 . 0 0 "[ . 1 . 2]" 1
352 1 21 VAL MG2 1 22 ARG HA . . 4.540 3.585 3.299 3.940 . 0 0 "[ . 1 . 2]" 1
353 1 21 VAL MG2 1 22 ARG QB . . 3.830 3.488 3.152 3.836 0.006 16 0 "[ . 1 . 2]" 1
354 1 21 VAL MG2 1 22 ARG QG . . 4.190 3.093 2.472 4.007 . 0 0 "[ . 1 . 2]" 1
355 1 21 VAL MG2 1 76 TYR QD . . 4.750 4.307 3.628 4.749 . 0 0 "[ . 1 . 2]" 1
356 1 21 VAL MG2 1 79 LYS HA . . 3.480 2.723 2.232 3.482 0.002 20 0 "[ . 1 . 2]" 1
357 1 21 VAL MG2 1 79 LYS QB . . 3.980 2.973 2.203 3.875 . 0 0 "[ . 1 . 2]" 1
358 1 21 VAL MG2 1 79 LYS QD . . 3.890 2.902 1.916 3.922 0.032 12 0 "[ . 1 . 2]" 1
359 1 21 VAL MG2 1 106 PHE HB2 . . 4.780 4.764 4.670 4.797 0.017 16 0 "[ . 1 . 2]" 1
360 1 21 VAL MG2 1 106 PHE HB3 . . 4.730 3.890 3.787 4.050 . 0 0 "[ . 1 . 2]" 1
361 1 21 VAL MG2 1 108 PRO HA . . 3.490 2.514 1.978 3.052 . 0 0 "[ . 1 . 2]" 1
362 1 21 VAL MG2 1 109 VAL H . . 3.910 2.887 2.393 3.656 . 0 0 "[ . 1 . 2]" 1
363 1 21 VAL MG2 1 109 VAL MG2 . . 3.370 2.509 1.950 3.165 . 0 0 "[ . 1 . 2]" 1
364 1 22 ARG H 1 22 ARG HB2 . . 3.750 3.062 2.193 3.679 . 0 0 "[ . 1 . 2]" 1
365 1 22 ARG H 1 22 ARG QB . . 2.950 2.491 2.172 2.851 . 0 0 "[ . 1 . 2]" 1
366 1 22 ARG H 1 22 ARG HB3 . . 3.750 3.077 2.468 3.603 . 0 0 "[ . 1 . 2]" 1
367 1 22 ARG H 1 22 ARG QD . . 4.380 3.951 3.545 4.384 0.004 17 0 "[ . 1 . 2]" 1
368 1 22 ARG H 1 22 ARG HG2 . . 3.820 2.675 1.906 3.807 . 0 0 "[ . 1 . 2]" 1
369 1 22 ARG H 1 22 ARG QG . . 3.240 2.254 1.877 2.806 . 0 0 "[ . 1 . 2]" 1
370 1 22 ARG H 1 22 ARG HG3 . . 3.820 2.877 2.400 3.592 . 0 0 "[ . 1 . 2]" 1
371 1 22 ARG H 1 23 GLY H . . 3.400 2.605 2.287 3.279 . 0 0 "[ . 1 . 2]" 1
372 1 22 ARG H 1 109 VAL MG2 . . 4.240 3.042 2.589 3.712 . 0 0 "[ . 1 . 2]" 1
373 1 22 ARG HA 1 22 ARG QD . . 4.440 4.076 2.075 4.431 . 0 0 "[ . 1 . 2]" 1
374 1 22 ARG HA 1 22 ARG HG2 . . 4.100 3.188 2.277 3.912 . 0 0 "[ . 1 . 2]" 1
375 1 22 ARG HA 1 22 ARG QG . . 3.470 2.906 2.204 3.344 . 0 0 "[ . 1 . 2]" 1
376 1 22 ARG HA 1 22 ARG HG3 . . 4.100 3.495 2.861 3.832 . 0 0 "[ . 1 . 2]" 1
377 1 22 ARG HA 1 75 GLU HA . . 4.310 3.713 2.747 4.188 . 0 0 "[ . 1 . 2]" 1
378 1 22 ARG HA 1 75 GLU QG . . 3.760 3.199 2.611 3.819 0.059 9 0 "[ . 1 . 2]" 1
379 1 22 ARG HA 1 79 LYS QD . . 3.330 2.578 1.988 3.372 0.042 9 0 "[ . 1 . 2]" 1
380 1 22 ARG HA 1 79 LYS QE . . 3.840 2.876 1.956 3.826 . 0 0 "[ . 1 . 2]" 1
381 1 22 ARG QB 1 22 ARG QD . . 3.160 2.192 2.091 2.526 . 0 0 "[ . 1 . 2]" 1
382 1 22 ARG QB 1 23 GLY H . . 4.180 3.172 2.499 4.039 . 0 0 "[ . 1 . 2]" 1
383 1 22 ARG QB 1 109 VAL MG2 . . 4.140 2.876 2.034 3.673 . 0 0 "[ . 1 . 2]" 1
384 1 22 ARG HB2 1 23 GLY H . . 4.830 3.411 2.550 4.433 . 0 0 "[ . 1 . 2]" 1
385 1 22 ARG HB3 1 23 GLY H . . 4.830 3.900 3.183 4.652 . 0 0 "[ . 1 . 2]" 1
386 1 22 ARG QD 1 109 VAL MG1 . . 4.270 3.160 1.882 4.256 . 0 0 "[ . 1 . 2]" 1
387 1 22 ARG QD 1 109 VAL MG2 . . 4.260 2.583 1.811 3.622 . 0 0 "[ . 1 . 2]" 1
388 1 22 ARG QG 1 23 GLY H . . 4.860 3.253 1.996 4.376 . 0 0 "[ . 1 . 2]" 1
389 1 22 ARG HG2 1 109 VAL MG2 . . 4.030 2.852 2.052 3.952 . 0 0 "[ . 1 . 2]" 1
390 1 22 ARG HG3 1 109 VAL MG2 . . 4.030 3.052 1.897 4.025 . 0 0 "[ . 1 . 2]" 1
391 1 23 GLY H 1 24 GLY H . . 4.770 4.523 4.315 4.644 . 0 0 "[ . 1 . 2]" 1
392 1 23 GLY QA 1 24 GLY H . . 3.070 2.146 2.113 2.269 . 0 0 "[ . 1 . 2]" 1
393 1 23 GLY QA 1 24 GLY QA . . 4.180 3.641 3.570 3.703 . 0 0 "[ . 1 . 2]" 1
394 1 23 GLY QA 1 73 VAL HB . . 3.930 2.452 2.018 2.941 . 0 0 "[ . 1 . 2]" 1
395 1 23 GLY HA2 1 25 GLU H . . 4.450 3.598 3.177 3.909 . 0 0 "[ . 1 . 2]" 1
396 1 23 GLY HA2 1 73 VAL HB . . 4.580 2.655 2.107 3.332 . 0 0 "[ . 1 . 2]" 1
397 1 23 GLY HA2 1 73 VAL MG1 . . 4.090 2.516 2.011 3.013 . 0 0 "[ . 1 . 2]" 1
398 1 23 GLY HA3 1 25 GLU H . . 4.450 3.972 3.584 4.384 . 0 0 "[ . 1 . 2]" 1
399 1 23 GLY HA3 1 73 VAL HB . . 4.580 2.989 2.102 3.656 . 0 0 "[ . 1 . 2]" 1
400 1 23 GLY HA3 1 73 VAL MG1 . . 4.090 2.656 1.973 3.442 . 0 0 "[ . 1 . 2]" 1
401 1 24 GLY H 1 25 GLU H . . 3.480 2.706 1.802 3.079 . 0 0 "[ . 1 . 2]" 1
402 1 24 GLY H 1 72 THR MG . . 3.990 3.057 2.584 3.856 . 0 0 "[ . 1 . 2]" 1
403 1 24 GLY H 1 73 VAL HB . . 3.970 3.116 2.214 3.825 . 0 0 "[ . 1 . 2]" 1
404 1 24 GLY QA 1 72 THR MG . . 3.100 2.118 1.846 2.449 . 0 0 "[ . 1 . 2]" 1
405 1 24 GLY HA2 1 72 THR MG . . 3.810 2.136 1.858 2.480 . 0 0 "[ . 1 . 2]" 1
406 1 24 GLY HA3 1 72 THR MG . . 3.810 3.516 3.223 3.794 . 0 0 "[ . 1 . 2]" 1
407 1 25 GLU H 1 25 GLU HB2 . . 3.740 2.575 2.371 3.731 . 0 0 "[ . 1 . 2]" 1
408 1 25 GLU H 1 25 GLU QB . . 3.070 2.484 2.340 2.692 . 0 0 "[ . 1 . 2]" 1
409 1 25 GLU H 1 25 GLU HB3 . . 3.740 3.632 2.762 3.750 0.010 18 0 "[ . 1 . 2]" 1
410 1 25 GLU H 1 25 GLU HG2 . . 4.220 3.651 2.626 4.217 . 0 0 "[ . 1 . 2]" 1
411 1 25 GLU H 1 25 GLU HG3 . . 4.220 3.948 2.932 4.219 . 0 0 "[ . 1 . 2]" 1
412 1 25 GLU H 1 26 GLU H . . 4.600 4.472 4.438 4.524 . 0 0 "[ . 1 . 2]" 1
413 1 25 GLU H 1 72 THR MG . . 3.990 2.737 2.354 3.477 . 0 0 "[ . 1 . 2]" 1
414 1 25 GLU H 1 73 VAL H . . 3.670 3.155 2.639 3.640 . 0 0 "[ . 1 . 2]" 1
415 1 25 GLU H 1 73 VAL HB . . 3.300 2.695 2.276 2.905 . 0 0 "[ . 1 . 2]" 1
416 1 25 GLU H 1 73 VAL MG1 . . 4.400 4.239 3.859 4.401 0.001 7 0 "[ . 1 . 2]" 1
417 1 25 GLU H 1 73 VAL MG2 . . 4.130 3.324 2.430 3.782 . 0 0 "[ . 1 . 2]" 1
418 1 25 GLU HA 1 25 GLU HG2 . . 4.040 2.730 2.194 3.983 . 0 0 "[ . 1 . 2]" 1
419 1 25 GLU HA 1 25 GLU QG . . 3.540 2.477 2.153 3.324 . 0 0 "[ . 1 . 2]" 1
420 1 25 GLU HA 1 25 GLU HG3 . . 4.040 3.361 2.515 3.722 . 0 0 "[ . 1 . 2]" 1
421 1 25 GLU HA 1 26 GLU H . . 2.880 2.478 2.427 2.505 . 0 0 "[ . 1 . 2]" 1
422 1 25 GLU HA 1 26 GLU HA . . 4.850 4.335 4.316 4.350 . 0 0 "[ . 1 . 2]" 1
423 1 25 GLU HA 1 26 GLU QB . . 4.320 4.126 4.066 4.195 . 0 0 "[ . 1 . 2]" 1
424 1 25 GLU QB 1 26 GLU H . . 3.210 2.260 2.187 2.371 . 0 0 "[ . 1 . 2]" 1
425 1 25 GLU QB 1 73 VAL H . . 5.290 4.131 3.792 5.057 . 0 0 "[ . 1 . 2]" 1
426 1 25 GLU QB 1 73 VAL HB . . 5.080 3.402 3.042 4.298 . 0 0 "[ . 1 . 2]" 1
427 1 25 GLU QB 1 73 VAL MG2 . . 3.320 2.913 2.573 3.368 0.048 19 0 "[ . 1 . 2]" 1
428 1 25 GLU HB2 1 26 GLU H . . 3.980 3.588 2.334 3.771 . 0 0 "[ . 1 . 2]" 1
429 1 25 GLU HB3 1 26 GLU H . . 3.980 2.354 2.208 3.781 . 0 0 "[ . 1 . 2]" 1
430 1 25 GLU QG 1 26 GLU H . . 4.110 3.779 3.155 4.080 . 0 0 "[ . 1 . 2]" 1
431 1 25 GLU HG2 1 26 GLU H . . 4.710 4.216 3.471 4.617 . 0 0 "[ . 1 . 2]" 1
432 1 25 GLU HG2 1 73 VAL MG2 . . 5.500 5.016 1.879 5.505 0.005 20 0 "[ . 1 . 2]" 1
433 1 25 GLU HG3 1 26 GLU H . . 4.710 4.464 3.225 4.705 . 0 0 "[ . 1 . 2]" 1
434 1 25 GLU HG3 1 73 VAL MG2 . . 5.500 4.762 1.959 5.500 0.000 8 0 "[ . 1 . 2]" 1
435 1 26 GLU H 1 26 GLU QB . . 3.020 2.295 2.215 2.337 . 0 0 "[ . 1 . 2]" 1
436 1 26 GLU H 1 26 GLU HG2 . . 4.770 4.414 2.715 4.676 . 0 0 "[ . 1 . 2]" 1
437 1 26 GLU H 1 26 GLU HG3 . . 4.770 4.483 4.033 4.710 . 0 0 "[ . 1 . 2]" 1
438 1 26 GLU H 1 27 LEU H . . 4.580 4.352 4.068 4.597 0.017 7 0 "[ . 1 . 2]" 1
439 1 26 GLU HA 1 26 GLU HG2 . . 4.190 3.023 2.603 3.694 . 0 0 "[ . 1 . 2]" 1
440 1 26 GLU HA 1 26 GLU QG . . 3.600 2.445 2.210 3.276 . 0 0 "[ . 1 . 2]" 1
441 1 26 GLU HA 1 26 GLU HG3 . . 4.190 2.689 2.261 3.725 . 0 0 "[ . 1 . 2]" 1
442 1 26 GLU HA 1 27 LEU H . . 3.090 2.166 2.139 2.246 . 0 0 "[ . 1 . 2]" 1
443 1 26 GLU QB 1 27 LEU H . . 4.230 3.823 3.002 3.994 . 0 0 "[ . 1 . 2]" 1
444 1 26 GLU QG 1 27 LEU H . . 3.780 3.151 2.392 3.648 . 0 0 "[ . 1 . 2]" 1
445 1 26 GLU QG 1 28 VAL MG2 . . 3.230 2.617 2.327 2.902 . 0 0 "[ . 1 . 2]" 1
446 1 26 GLU QG 1 70 THR MG . . 3.310 2.578 2.149 3.012 . 0 0 "[ . 1 . 2]" 1
447 1 26 GLU HG2 1 27 LEU H . . 4.340 3.539 2.596 4.195 . 0 0 "[ . 1 . 2]" 1
448 1 26 GLU HG2 1 70 THR MG . . 3.930 3.086 2.331 3.917 . 0 0 "[ . 1 . 2]" 1
449 1 26 GLU HG3 1 27 LEU H . . 4.340 3.764 2.408 4.299 . 0 0 "[ . 1 . 2]" 1
450 1 26 GLU HG3 1 70 THR MG . . 3.930 2.849 2.333 3.815 . 0 0 "[ . 1 . 2]" 1
451 1 27 LEU H 1 27 LEU HB2 . . 3.930 2.988 2.785 3.318 . 0 0 "[ . 1 . 2]" 1
452 1 27 LEU H 1 27 LEU HB3 . . 3.660 2.515 2.418 2.708 . 0 0 "[ . 1 . 2]" 1
453 1 27 LEU H 1 71 LEU H . . 3.780 3.343 2.284 3.782 0.002 19 0 "[ . 1 . 2]" 1
454 1 27 LEU H 1 71 LEU MD2 . . 4.290 3.945 3.508 4.229 . 0 0 "[ . 1 . 2]" 1
455 1 27 LEU H 1 71 LEU HG . . 4.580 4.140 3.698 4.374 . 0 0 "[ . 1 . 2]" 1
456 1 27 LEU H 1 73 VAL H . . 4.530 3.835 3.253 4.261 . 0 0 "[ . 1 . 2]" 1
457 1 27 LEU H 1 73 VAL MG2 . . 4.240 3.770 3.186 4.224 . 0 0 "[ . 1 . 2]" 1
458 1 27 LEU HA 1 27 LEU MD1 . . 3.480 2.140 1.981 2.345 . 0 0 "[ . 1 . 2]" 1
459 1 27 LEU HA 1 27 LEU MD2 . . 4.740 3.924 3.883 4.011 . 0 0 "[ . 1 . 2]" 1
460 1 27 LEU HA 1 28 VAL H . . 3.000 2.155 2.139 2.189 . 0 0 "[ . 1 . 2]" 1
461 1 27 LEU HA 1 73 VAL MG2 . . 4.690 3.973 3.646 4.366 . 0 0 "[ . 1 . 2]" 1
462 1 27 LEU HB2 1 27 LEU MD1 . . 3.650 2.308 2.215 2.432 . 0 0 "[ . 1 . 2]" 1
463 1 27 LEU HB2 1 71 LEU MD2 . . 4.210 3.849 3.485 4.217 0.007 9 0 "[ . 1 . 2]" 1
464 1 27 LEU HB2 1 71 LEU HG . . 4.340 4.125 3.797 4.341 0.001 15 0 "[ . 1 . 2]" 1
465 1 27 LEU HB2 1 73 VAL H . . 4.970 3.547 3.193 4.140 . 0 0 "[ . 1 . 2]" 1
466 1 27 LEU HB2 1 73 VAL MG2 . . 3.480 2.126 1.867 2.508 . 0 0 "[ . 1 . 2]" 1
467 1 27 LEU HB3 1 27 LEU MD2 . . 3.590 2.237 2.060 2.393 . 0 0 "[ . 1 . 2]" 1
468 1 27 LEU HB3 1 71 LEU H . . 4.400 3.391 3.026 3.722 . 0 0 "[ . 1 . 2]" 1
469 1 27 LEU HB3 1 71 LEU MD2 . . 3.160 2.404 1.982 2.797 . 0 0 "[ . 1 . 2]" 1
470 1 27 LEU HB3 1 71 LEU HG . . 3.690 2.632 2.277 2.939 . 0 0 "[ . 1 . 2]" 1
471 1 27 LEU HB3 1 73 VAL MG2 . . 3.640 2.903 2.450 3.363 . 0 0 "[ . 1 . 2]" 1
472 1 27 LEU MD1 1 28 VAL H . . 3.340 2.904 2.154 3.296 . 0 0 "[ . 1 . 2]" 1
473 1 27 LEU MD2 1 29 LEU MD1 . . 4.530 3.065 2.601 3.738 . 0 0 "[ . 1 . 2]" 1
474 1 27 LEU MD2 1 29 LEU MD2 . . 3.680 2.657 2.117 3.115 . 0 0 "[ . 1 . 2]" 1
475 1 27 LEU MD2 1 42 PHE QE . . 3.970 3.808 3.479 3.976 0.006 19 0 "[ . 1 . 2]" 1
476 1 27 LEU MD2 1 42 PHE HZ . . 3.470 2.984 2.590 3.269 . 0 0 "[ . 1 . 2]" 1
477 1 27 LEU MD2 1 71 LEU MD2 . . 3.270 2.085 1.917 2.447 . 0 0 "[ . 1 . 2]" 1
478 1 27 LEU MD2 1 71 LEU HG . . 4.070 2.773 2.146 3.253 . 0 0 "[ . 1 . 2]" 1
479 1 27 LEU MD2 1 73 VAL MG2 . . 3.580 2.266 1.977 3.014 . 0 0 "[ . 1 . 2]" 1
480 1 27 LEU MD2 1 89 PHE QD . . 5.250 4.355 4.099 4.869 . 0 0 "[ . 1 . 2]" 1
481 1 27 LEU MD2 1 89 PHE QE . . 4.600 3.650 3.294 3.890 . 0 0 "[ . 1 . 2]" 1
482 1 27 LEU MD2 1 104 PHE QE . . 4.510 3.902 3.081 4.372 . 0 0 "[ . 1 . 2]" 1
483 1 27 LEU MD2 1 104 PHE HZ . . 4.780 4.224 3.347 4.639 . 0 0 "[ . 1 . 2]" 1
484 1 27 LEU HG 1 28 VAL H . . 4.190 3.418 2.891 3.785 . 0 0 "[ . 1 . 2]" 1
485 1 27 LEU HG 1 29 LEU H . . 5.230 4.213 3.794 4.784 . 0 0 "[ . 1 . 2]" 1
486 1 27 LEU HG 1 29 LEU MD2 . . 3.820 3.062 2.459 3.782 . 0 0 "[ . 1 . 2]" 1
487 1 27 LEU HG 1 71 LEU MD2 . . 3.730 2.597 1.938 3.168 . 0 0 "[ . 1 . 2]" 1
488 1 28 VAL H 1 28 VAL HB . . 3.400 2.549 2.486 2.710 . 0 0 "[ . 1 . 2]" 1
489 1 28 VAL H 1 28 VAL MG1 . . 4.260 3.811 3.780 3.881 . 0 0 "[ . 1 . 2]" 1
490 1 28 VAL H 1 28 VAL MG2 . . 3.450 2.650 2.481 2.815 . 0 0 "[ . 1 . 2]" 1
491 1 28 VAL H 1 29 LEU H . . 4.680 4.341 4.197 4.495 . 0 0 "[ . 1 . 2]" 1
492 1 28 VAL H 1 71 LEU MD2 . . 5.280 4.747 4.045 5.180 . 0 0 "[ . 1 . 2]" 1
493 1 28 VAL HA 1 28 VAL MG1 . . 3.380 2.381 2.297 2.467 . 0 0 "[ . 1 . 2]" 1
494 1 28 VAL HA 1 28 VAL MG2 . . 3.390 2.339 2.268 2.433 . 0 0 "[ . 1 . 2]" 1
495 1 28 VAL HA 1 29 LEU H . . 3.100 2.154 2.141 2.212 . 0 0 "[ . 1 . 2]" 1
496 1 28 VAL HA 1 68 THR MG . . 4.480 3.925 3.387 4.419 . 0 0 "[ . 1 . 2]" 1
497 1 28 VAL HA 1 69 LEU H . . 4.910 4.393 3.855 4.700 . 0 0 "[ . 1 . 2]" 1
498 1 28 VAL HA 1 70 THR HA . . 4.310 2.685 2.313 3.223 . 0 0 "[ . 1 . 2]" 1
499 1 28 VAL HB 1 29 LEU H . . 4.900 4.280 3.985 4.441 . 0 0 "[ . 1 . 2]" 1
500 1 28 VAL MG1 1 29 LEU H . . 3.680 2.737 2.071 3.166 . 0 0 "[ . 1 . 2]" 1
501 1 28 VAL MG1 1 30 THR HA . . 4.690 3.987 3.728 4.310 . 0 0 "[ . 1 . 2]" 1
502 1 28 VAL MG1 1 68 THR HA . . 4.750 4.093 3.775 4.489 . 0 0 "[ . 1 . 2]" 1
503 1 28 VAL MG1 1 68 THR MG . . 2.890 2.262 1.841 2.712 . 0 0 "[ . 1 . 2]" 1
504 1 28 VAL MG1 1 69 LEU H . . 4.390 3.469 2.923 3.992 . 0 0 "[ . 1 . 2]" 1
505 1 28 VAL MG2 1 70 THR HA . . 3.820 3.451 2.872 3.821 0.001 15 0 "[ . 1 . 2]" 1
506 1 28 VAL MG2 1 71 LEU H . . 4.710 4.424 4.094 4.708 . 0 0 "[ . 1 . 2]" 1
507 1 29 LEU H 1 29 LEU QB . . 3.590 2.438 2.266 2.546 . 0 0 "[ . 1 . 2]" 1
508 1 29 LEU H 1 29 LEU MD1 . . 4.300 3.561 3.325 3.829 . 0 0 "[ . 1 . 2]" 1
509 1 29 LEU H 1 29 LEU HG . . 3.860 2.710 2.293 3.094 . 0 0 "[ . 1 . 2]" 1
510 1 29 LEU H 1 30 THR H . . 4.700 4.405 4.240 4.561 . 0 0 "[ . 1 . 2]" 1
511 1 29 LEU H 1 68 THR MG . . 4.580 3.675 3.252 4.180 . 0 0 "[ . 1 . 2]" 1
512 1 29 LEU H 1 69 LEU H . . 3.770 3.016 2.705 3.416 . 0 0 "[ . 1 . 2]" 1
513 1 29 LEU H 1 69 LEU HB2 . . 3.940 3.598 3.257 3.864 . 0 0 "[ . 1 . 2]" 1
514 1 29 LEU H 1 70 THR HA . . 4.470 3.563 2.936 4.077 . 0 0 "[ . 1 . 2]" 1
515 1 29 LEU H 1 71 LEU MD2 . . 4.740 3.718 3.262 3.939 . 0 0 "[ . 1 . 2]" 1
516 1 29 LEU HA 1 29 LEU MD2 . . 3.840 2.325 2.123 2.619 . 0 0 "[ . 1 . 2]" 1
517 1 29 LEU HA 1 30 THR H . . 3.080 2.156 2.138 2.208 . 0 0 "[ . 1 . 2]" 1
518 1 29 LEU HA 1 30 THR HB . . 5.010 4.731 4.651 4.959 . 0 0 "[ . 1 . 2]" 1
519 1 29 LEU QB 1 30 THR H . . 3.840 3.243 2.894 3.512 . 0 0 "[ . 1 . 2]" 1
520 1 29 LEU QB 1 34 PHE QE . . 4.350 3.932 3.752 4.117 . 0 0 "[ . 1 . 2]" 1
521 1 29 LEU QB 1 34 PHE HZ . . 4.230 3.587 3.305 3.851 . 0 0 "[ . 1 . 2]" 1
522 1 29 LEU QB 1 69 LEU H . . 3.920 3.113 2.800 3.500 . 0 0 "[ . 1 . 2]" 1
523 1 29 LEU QB 1 69 LEU HB2 . . 3.510 2.022 1.970 2.088 . 0 0 "[ . 1 . 2]" 1
524 1 29 LEU QB 1 69 LEU HB3 . . 4.060 2.964 2.688 3.128 . 0 0 "[ . 1 . 2]" 1
525 1 29 LEU HB2 1 30 THR H . . 4.550 4.236 4.012 4.445 . 0 0 "[ . 1 . 2]" 1
526 1 29 LEU HB2 1 34 PHE QE . . 4.940 4.464 4.176 4.676 . 0 0 "[ . 1 . 2]" 1
527 1 29 LEU HB2 1 34 PHE HZ . . 4.850 4.431 4.055 4.742 . 0 0 "[ . 1 . 2]" 1
528 1 29 LEU HB2 1 69 LEU HB2 . . 4.150 2.038 1.995 2.102 . 0 0 "[ . 1 . 2]" 1
529 1 29 LEU HB2 1 69 LEU HB3 . . 4.700 3.005 2.724 3.180 . 0 0 "[ . 1 . 2]" 1
530 1 29 LEU HB3 1 30 THR H . . 4.550 3.369 2.967 3.679 . 0 0 "[ . 1 . 2]" 1
531 1 29 LEU HB3 1 34 PHE QE . . 4.940 4.384 3.961 4.586 . 0 0 "[ . 1 . 2]" 1
532 1 29 LEU HB3 1 34 PHE HZ . . 4.850 3.803 3.384 4.100 . 0 0 "[ . 1 . 2]" 1
533 1 29 LEU HB3 1 69 LEU HB2 . . 4.150 3.431 2.900 3.691 . 0 0 "[ . 1 . 2]" 1
534 1 29 LEU HB3 1 69 LEU HB3 . . 4.700 4.527 4.076 4.713 0.013 13 0 "[ . 1 . 2]" 1
535 1 29 LEU MD1 1 34 PHE QE . . 5.250 4.570 4.338 4.965 . 0 0 "[ . 1 . 2]" 1
536 1 29 LEU MD1 1 34 PHE HZ . . 5.500 4.702 4.418 5.157 . 0 0 "[ . 1 . 2]" 1
537 1 29 LEU MD1 1 69 LEU H . . 4.620 4.482 4.273 4.616 . 0 0 "[ . 1 . 2]" 1
538 1 29 LEU MD1 1 69 LEU HB2 . . 3.580 2.686 2.432 3.014 . 0 0 "[ . 1 . 2]" 1
539 1 29 LEU MD1 1 69 LEU HB3 . . 3.780 2.419 2.108 2.886 . 0 0 "[ . 1 . 2]" 1
540 1 29 LEU MD1 1 69 LEU MD1 . . 3.200 2.597 2.123 2.957 . 0 0 "[ . 1 . 2]" 1
541 1 29 LEU MD1 1 89 PHE QD . . 4.780 4.000 3.492 4.557 . 0 0 "[ . 1 . 2]" 1
542 1 29 LEU MD1 1 89 PHE QE . . 4.000 3.439 2.502 3.913 . 0 0 "[ . 1 . 2]" 1
543 1 29 LEU MD1 1 91 VAL MG2 . . 3.170 2.876 2.579 3.157 . 0 0 "[ . 1 . 2]" 1
544 1 29 LEU MD2 1 30 THR H . . 4.440 3.704 3.286 4.092 . 0 0 "[ . 1 . 2]" 1
545 1 29 LEU MD2 1 34 PHE QE . . 5.500 5.367 4.742 5.496 . 0 0 "[ . 1 . 2]" 1
546 1 29 LEU MD2 1 34 PHE HZ . . 5.500 5.084 4.223 5.282 . 0 0 "[ . 1 . 2]" 1
547 1 29 LEU MD2 1 89 PHE QD . . 4.830 3.869 3.269 4.466 . 0 0 "[ . 1 . 2]" 1
548 1 29 LEU MD2 1 89 PHE QE . . 3.830 2.301 1.885 3.092 . 0 0 "[ . 1 . 2]" 1
549 1 29 LEU MD2 1 89 PHE HZ . . 4.010 3.095 2.719 3.376 . 0 0 "[ . 1 . 2]" 1
550 1 29 LEU HG 1 69 LEU HB2 . . 4.460 4.234 3.894 4.460 . 0 0 "[ . 1 . 2]" 1
551 1 29 LEU HG 1 69 LEU HB3 . . 4.800 4.273 3.884 4.741 . 0 0 "[ . 1 . 2]" 1
552 1 29 LEU HG 1 71 LEU MD2 . . 3.690 2.622 2.230 2.985 . 0 0 "[ . 1 . 2]" 1
553 1 30 THR H 1 30 THR HB . . 3.560 2.626 2.532 2.827 . 0 0 "[ . 1 . 2]" 1
554 1 30 THR H 1 30 THR MG . . 4.170 3.817 3.760 3.863 . 0 0 "[ . 1 . 2]" 1
555 1 30 THR H 1 31 GLY H . . 4.790 4.532 4.470 4.572 . 0 0 "[ . 1 . 2]" 1
556 1 30 THR HA 1 30 THR MG . . 3.430 2.290 2.128 2.439 . 0 0 "[ . 1 . 2]" 1
557 1 30 THR HA 1 31 GLY H . . 2.920 2.194 2.155 2.235 . 0 0 "[ . 1 . 2]" 1
558 1 30 THR HA 1 31 GLY HA2 . . 4.850 4.470 4.423 4.508 . 0 0 "[ . 1 . 2]" 1
559 1 30 THR HA 1 34 PHE QE . . 4.060 3.633 3.400 3.962 . 0 0 "[ . 1 . 2]" 1
560 1 30 THR HA 1 68 THR HA . . 3.640 3.410 3.061 3.610 . 0 0 "[ . 1 . 2]" 1
561 1 30 THR HA 1 69 LEU H . . 4.470 4.318 3.888 4.459 . 0 0 "[ . 1 . 2]" 1
562 1 30 THR HB 1 31 GLY H . . 4.010 3.976 3.883 4.012 0.002 16 0 "[ . 1 . 2]" 1
563 1 30 THR MG 1 31 GLY H . . 3.660 2.264 1.976 2.512 . 0 0 "[ . 1 . 2]" 1
564 1 31 GLY H 1 32 SER H . . 4.950 4.231 4.032 4.358 . 0 0 "[ . 1 . 2]" 1
565 1 31 GLY H 1 32 SER HA . . 5.280 4.614 4.519 4.689 . 0 0 "[ . 1 . 2]" 1
566 1 31 GLY H 1 34 PHE QE . . 3.590 2.726 2.397 3.146 . 0 0 "[ . 1 . 2]" 1
567 1 31 GLY H 1 67 VAL HA . . 5.500 4.348 3.499 4.738 . 0 0 "[ . 1 . 2]" 1
568 1 31 GLY H 1 67 VAL HB . . 4.030 3.762 3.103 4.005 . 0 0 "[ . 1 . 2]" 1
569 1 31 GLY H 1 67 VAL MG2 . . 4.880 4.602 4.297 4.857 . 0 0 "[ . 1 . 2]" 1
570 1 31 GLY H 1 68 THR HA . . 4.180 3.873 3.295 4.179 . 0 0 "[ . 1 . 2]" 1
571 1 31 GLY HA2 1 32 SER H . . 3.490 2.989 2.819 3.162 . 0 0 "[ . 1 . 2]" 1
572 1 31 GLY HA2 1 32 SER HA . . 4.860 4.677 4.595 4.783 . 0 0 "[ . 1 . 2]" 1
573 1 31 GLY HA2 1 34 PHE QE . . 4.720 4.024 3.729 4.348 . 0 0 "[ . 1 . 2]" 1
574 1 31 GLY HA2 1 34 PHE HZ . . 4.800 4.234 3.777 4.602 . 0 0 "[ . 1 . 2]" 1
575 1 31 GLY HA3 1 32 SER H . . 3.270 2.226 2.148 2.334 . 0 0 "[ . 1 . 2]" 1
576 1 31 GLY HA3 1 34 PHE HZ . . 4.280 2.517 2.090 2.896 . 0 0 "[ . 1 . 2]" 1
577 1 32 SER H 1 32 SER QB . . 3.550 2.960 2.758 3.308 . 0 0 "[ . 1 . 2]" 1
578 1 32 SER H 1 33 ASN H . . 4.740 4.373 4.336 4.399 . 0 0 "[ . 1 . 2]" 1
579 1 32 SER H 1 34 PHE QE . . 3.960 3.469 3.228 3.879 . 0 0 "[ . 1 . 2]" 1
580 1 32 SER H 1 34 PHE HZ . . 4.280 3.566 2.956 3.948 . 0 0 "[ . 1 . 2]" 1
581 1 32 SER HA 1 33 ASN H . . 3.030 2.478 2.366 2.625 . 0 0 "[ . 1 . 2]" 1
582 1 32 SER HA 1 33 ASN HA . . 4.790 4.566 4.526 4.622 . 0 0 "[ . 1 . 2]" 1
583 1 32 SER HA 1 34 PHE H . . 3.990 3.657 3.412 3.811 . 0 0 "[ . 1 . 2]" 1
584 1 32 SER HA 1 67 VAL MG1 . . 3.410 2.321 1.871 2.758 . 0 0 "[ . 1 . 2]" 1
585 1 32 SER QB 1 33 ASN H . . 3.270 2.528 1.996 3.097 . 0 0 "[ . 1 . 2]" 1
586 1 32 SER QB 1 33 ASN HA . . 4.690 4.289 3.972 4.690 0.000 14 0 "[ . 1 . 2]" 1
587 1 32 SER QB 1 67 VAL MG1 . . 3.880 2.868 2.279 3.442 . 0 0 "[ . 1 . 2]" 1
588 1 32 SER HB2 1 33 ASN H . . 3.860 3.353 2.008 3.862 0.002 16 0 "[ . 1 . 2]" 1
589 1 32 SER HB2 1 67 VAL MG1 . . 4.490 3.440 2.559 4.361 . 0 0 "[ . 1 . 2]" 1
590 1 32 SER HB3 1 33 ASN H . . 3.860 2.938 2.107 3.860 0.000 5 0 "[ . 1 . 2]" 1
591 1 32 SER HB3 1 67 VAL MG1 . . 4.490 3.317 2.540 4.328 . 0 0 "[ . 1 . 2]" 1
592 1 33 ASN H 1 33 ASN QD . . 4.830 4.658 4.335 4.806 . 0 0 "[ . 1 . 2]" 1
593 1 33 ASN H 1 34 PHE H . . 3.410 2.756 2.547 2.945 . 0 0 "[ . 1 . 2]" 1
594 1 33 ASN H 1 66 GLU QB . . 5.240 5.018 4.502 5.244 0.004 13 0 "[ . 1 . 2]" 1
595 1 33 ASN H 1 67 VAL MG1 . . 4.460 3.029 2.533 3.518 . 0 0 "[ . 1 . 2]" 1
596 1 33 ASN HA 1 34 PHE H . . 3.370 2.721 2.647 2.847 . 0 0 "[ . 1 . 2]" 1
597 1 33 ASN QB 1 33 ASN QD . . 3.080 2.138 2.069 2.415 . 0 0 "[ . 1 . 2]" 1
598 1 34 PHE H 1 34 PHE HB2 . . 3.650 2.382 2.324 2.460 . 0 0 "[ . 1 . 2]" 1
599 1 34 PHE H 1 34 PHE QB . . 3.190 2.351 2.296 2.423 . 0 0 "[ . 1 . 2]" 1
600 1 34 PHE H 1 34 PHE HB3 . . 3.650 3.619 3.583 3.656 0.006 5 0 "[ . 1 . 2]" 1
601 1 34 PHE H 1 34 PHE QD . . 3.800 3.512 3.367 3.577 . 0 0 "[ . 1 . 2]" 1
602 1 34 PHE H 1 34 PHE QE . . 5.280 5.095 4.854 5.227 . 0 0 "[ . 1 . 2]" 1
603 1 34 PHE H 1 35 LEU H . . 4.770 4.541 4.505 4.572 . 0 0 "[ . 1 . 2]" 1
604 1 34 PHE H 1 66 GLU HA . . 3.980 3.611 3.057 3.898 . 0 0 "[ . 1 . 2]" 1
605 1 34 PHE H 1 66 GLU QG . . 4.520 3.553 2.738 4.517 . 0 0 "[ . 1 . 2]" 1
606 1 34 PHE H 1 67 VAL HA . . 4.330 3.739 3.262 4.287 . 0 0 "[ . 1 . 2]" 1
607 1 34 PHE HA 1 34 PHE QD . . 3.720 2.017 1.996 2.094 . 0 0 "[ . 1 . 2]" 1
608 1 34 PHE HA 1 35 LEU H . . 3.340 2.390 2.189 2.533 . 0 0 "[ . 1 . 2]" 1
609 1 34 PHE HA 1 35 LEU HG . . 4.330 4.026 3.694 4.329 . 0 0 "[ . 1 . 2]" 1
610 1 34 PHE QB 1 35 LEU H . . 3.680 2.461 2.133 3.026 . 0 0 "[ . 1 . 2]" 1
611 1 34 PHE QB 1 66 GLU HA . . 3.670 3.004 2.608 3.301 . 0 0 "[ . 1 . 2]" 1
612 1 34 PHE QB 1 69 LEU MD1 . . 3.980 2.982 2.539 3.403 . 0 0 "[ . 1 . 2]" 1
613 1 34 PHE QB 1 69 LEU MD2 . . 3.760 2.980 2.625 3.173 . 0 0 "[ . 1 . 2]" 1
614 1 34 PHE QB 1 69 LEU HG . . 4.600 2.723 2.399 3.018 . 0 0 "[ . 1 . 2]" 1
615 1 34 PHE HB2 1 35 LEU H . . 4.400 3.768 3.483 4.203 . 0 0 "[ . 1 . 2]" 1
616 1 34 PHE HB2 1 66 GLU HA . . 4.370 3.072 2.639 3.416 . 0 0 "[ . 1 . 2]" 1
617 1 34 PHE HB2 1 69 LEU MD1 . . 4.750 4.202 3.766 4.607 . 0 0 "[ . 1 . 2]" 1
618 1 34 PHE HB2 1 69 LEU MD2 . . 4.460 4.255 3.774 4.458 . 0 0 "[ . 1 . 2]" 1
619 1 34 PHE HB3 1 35 LEU H . . 4.400 2.498 2.151 3.103 . 0 0 "[ . 1 . 2]" 1
620 1 34 PHE HB3 1 66 GLU HA . . 4.370 4.268 4.032 4.374 0.004 20 0 "[ . 1 . 2]" 1
621 1 34 PHE HB3 1 69 LEU MD1 . . 4.750 3.052 2.575 3.505 . 0 0 "[ . 1 . 2]" 1
622 1 34 PHE HB3 1 69 LEU MD2 . . 4.460 3.044 2.679 3.248 . 0 0 "[ . 1 . 2]" 1
623 1 34 PHE QD 1 35 LEU H . . 4.330 3.407 3.196 3.704 . 0 0 "[ . 1 . 2]" 1
624 1 34 PHE QD 1 67 VAL H . . 4.470 3.912 3.459 4.138 . 0 0 "[ . 1 . 2]" 1
625 1 34 PHE QD 1 67 VAL HA . . 4.510 2.391 2.011 2.854 . 0 0 "[ . 1 . 2]" 1
626 1 34 PHE QD 1 68 THR H . . 3.730 2.524 1.901 3.309 . 0 0 "[ . 1 . 2]" 1
627 1 34 PHE QD 1 69 LEU HB2 . . 5.240 4.383 4.166 4.562 . 0 0 "[ . 1 . 2]" 1
628 1 34 PHE QD 1 69 LEU MD1 . . 4.020 2.441 2.206 2.683 . 0 0 "[ . 1 . 2]" 1
629 1 34 PHE QD 1 69 LEU MD2 . . 4.330 3.924 3.659 4.145 . 0 0 "[ . 1 . 2]" 1
630 1 34 PHE QD 1 69 LEU HG . . 4.100 3.147 2.921 3.302 . 0 0 "[ . 1 . 2]" 1
631 1 34 PHE QD 1 91 VAL MG1 . . 3.570 3.278 2.963 3.497 . 0 0 "[ . 1 . 2]" 1
632 1 34 PHE QD 1 91 VAL MG2 . . 5.200 4.138 3.825 4.711 . 0 0 "[ . 1 . 2]" 1
633 1 34 PHE QE 1 67 VAL HA . . 4.670 3.536 2.899 3.964 . 0 0 "[ . 1 . 2]" 1
634 1 34 PHE QE 1 68 THR HA . . 3.820 3.236 2.763 3.692 . 0 0 "[ . 1 . 2]" 1
635 1 34 PHE QE 1 68 THR MG . . 5.500 4.954 4.503 5.374 . 0 0 "[ . 1 . 2]" 1
636 1 34 PHE QE 1 69 LEU H . . 4.360 4.097 3.370 4.365 0.005 9 0 "[ . 1 . 2]" 1
637 1 34 PHE QE 1 69 LEU HB2 . . 4.160 3.973 3.782 4.139 . 0 0 "[ . 1 . 2]" 1
638 1 34 PHE QE 1 69 LEU MD1 . . 4.840 2.744 2.426 3.032 . 0 0 "[ . 1 . 2]" 1
639 1 34 PHE QE 1 69 LEU HG . . 4.170 3.918 3.632 4.173 0.003 8 0 "[ . 1 . 2]" 1
640 1 34 PHE QE 1 91 VAL MG1 . . 4.200 3.574 2.919 3.948 . 0 0 "[ . 1 . 2]" 1
641 1 34 PHE QE 1 91 VAL MG2 . . 3.720 3.095 2.505 3.707 . 0 0 "[ . 1 . 2]" 1
642 1 34 PHE HZ 1 91 VAL MG2 . . 4.790 4.425 4.020 4.794 0.004 9 0 "[ . 1 . 2]" 1
643 1 35 LEU H 1 35 LEU QB . . 3.650 2.457 2.266 2.712 . 0 0 "[ . 1 . 2]" 1
644 1 35 LEU H 1 35 LEU MD1 . . 4.150 3.744 3.478 3.978 . 0 0 "[ . 1 . 2]" 1
645 1 35 LEU H 1 35 LEU MD2 . . 4.670 4.336 4.097 4.519 . 0 0 "[ . 1 . 2]" 1
646 1 35 LEU H 1 35 LEU HG . . 3.910 3.348 2.933 3.736 . 0 0 "[ . 1 . 2]" 1
647 1 35 LEU H 1 38 SER H . . 4.420 3.963 3.578 4.338 . 0 0 "[ . 1 . 2]" 1
648 1 35 LEU H 1 38 SER HB2 . . 4.340 3.264 2.334 4.000 . 0 0 "[ . 1 . 2]" 1
649 1 35 LEU H 1 38 SER QB . . 3.790 3.119 2.312 3.551 . 0 0 "[ . 1 . 2]" 1
650 1 35 LEU H 1 38 SER HB3 . . 4.340 4.062 3.702 4.296 . 0 0 "[ . 1 . 2]" 1
651 1 35 LEU H 1 38 SER HG . . 3.520 3.012 1.906 3.519 . 0 0 "[ . 1 . 2]" 1
652 1 35 LEU H 1 91 VAL MG1 . . 4.490 4.420 4.241 4.504 0.014 20 0 "[ . 1 . 2]" 1
653 1 35 LEU H 1 93 ASN QD . . 4.620 3.076 2.261 3.623 . 0 0 "[ . 1 . 2]" 1
654 1 35 LEU HA 1 35 LEU MD1 . . 4.150 3.852 3.787 3.900 . 0 0 "[ . 1 . 2]" 1
655 1 35 LEU HA 1 35 LEU MD2 . . 3.110 2.451 2.285 2.595 . 0 0 "[ . 1 . 2]" 1
656 1 35 LEU HA 1 35 LEU HG . . 4.230 2.651 2.486 2.760 . 0 0 "[ . 1 . 2]" 1
657 1 35 LEU HA 1 36 PRO HD2 . . 3.520 2.368 2.328 2.427 . 0 0 "[ . 1 . 2]" 1
658 1 35 LEU HA 1 36 PRO QD . . 3.030 2.072 2.050 2.106 . 0 0 "[ . 1 . 2]" 1
659 1 35 LEU HA 1 36 PRO HD3 . . 3.520 2.289 2.276 2.310 . 0 0 "[ . 1 . 2]" 1
660 1 35 LEU HA 1 36 PRO QG . . 4.610 3.982 3.958 4.019 . 0 0 "[ . 1 . 2]" 1
661 1 35 LEU HA 1 37 ASP H . . 4.570 3.948 3.809 4.429 . 0 0 "[ . 1 . 2]" 1
662 1 35 LEU QB 1 35 LEU MD1 . . 3.100 2.026 1.931 2.092 . 0 0 "[ . 1 . 2]" 1
663 1 35 LEU QB 1 35 LEU MD2 . . 3.190 2.087 1.993 2.199 . 0 0 "[ . 1 . 2]" 1
664 1 35 LEU QB 1 36 PRO HD2 . . 3.730 2.162 1.996 2.344 . 0 0 "[ . 1 . 2]" 1
665 1 35 LEU QB 1 36 PRO QD . . 3.150 2.142 1.982 2.317 . 0 0 "[ . 1 . 2]" 1
666 1 35 LEU QB 1 36 PRO HD3 . . 3.730 3.493 3.367 3.626 . 0 0 "[ . 1 . 2]" 1
667 1 35 LEU QB 1 37 ASP H . . 3.440 2.351 2.173 2.931 . 0 0 "[ . 1 . 2]" 1
668 1 35 LEU QB 1 38 SER H . . 3.670 2.742 2.397 3.056 . 0 0 "[ . 1 . 2]" 1
669 1 35 LEU QB 1 38 SER HG . . 4.830 2.346 1.986 2.970 . 0 0 "[ . 1 . 2]" 1
670 1 35 LEU MD1 1 93 ASN HA . . 4.020 3.229 1.937 3.838 . 0 0 "[ . 1 . 2]" 1
671 1 35 LEU MD1 1 93 ASN HB2 . . 4.150 3.558 2.839 4.130 . 0 0 "[ . 1 . 2]" 1
672 1 35 LEU MD1 1 93 ASN QB . . 3.460 2.288 1.882 3.122 . 0 0 "[ . 1 . 2]" 1
673 1 35 LEU MD1 1 93 ASN HB3 . . 4.150 2.335 1.910 3.574 . 0 0 "[ . 1 . 2]" 1
674 1 35 LEU MD1 1 93 ASN HD21 . . 4.190 2.778 2.290 3.889 . 0 0 "[ . 1 . 2]" 1
675 1 35 LEU MD1 1 93 ASN HD22 . . 4.190 3.313 2.744 3.993 . 0 0 "[ . 1 . 2]" 1
676 1 35 LEU MD2 1 36 PRO HD2 . . 3.660 2.119 1.879 2.473 . 0 0 "[ . 1 . 2]" 1
677 1 35 LEU MD2 1 36 PRO HD3 . . 3.660 3.059 2.811 3.339 . 0 0 "[ . 1 . 2]" 1
678 1 35 LEU MD2 1 36 PRO QG . . 4.680 3.525 3.162 3.821 . 0 0 "[ . 1 . 2]" 1
679 1 35 LEU MD2 1 37 ASP H . . 4.390 3.797 3.366 4.160 . 0 0 "[ . 1 . 2]" 1
680 1 35 LEU MD2 1 38 SER H . . 4.930 4.856 4.597 4.932 0.002 13 0 "[ . 1 . 2]" 1
681 1 35 LEU HG 1 36 PRO HD2 . . 4.830 3.967 3.624 4.178 . 0 0 "[ . 1 . 2]" 1
682 1 35 LEU HG 1 36 PRO QD . . 4.120 3.753 3.444 3.942 . 0 0 "[ . 1 . 2]" 1
683 1 35 LEU HG 1 36 PRO HD3 . . 4.830 4.634 4.303 4.833 0.003 19 0 "[ . 1 . 2]" 1
684 1 35 LEU HG 1 38 SER HG . . 4.860 4.363 3.978 4.684 . 0 0 "[ . 1 . 2]" 1
685 1 35 LEU HG 1 93 ASN HD21 . . 4.830 3.977 3.375 4.738 . 0 0 "[ . 1 . 2]" 1
686 1 35 LEU HG 1 93 ASN QD . . 4.190 3.590 2.442 4.156 . 0 0 "[ . 1 . 2]" 1
687 1 35 LEU HG 1 93 ASN HD22 . . 4.830 4.253 2.467 4.831 0.001 12 0 "[ . 1 . 2]" 1
688 1 36 PRO HA 1 37 ASP HA . . 4.870 4.555 4.490 4.770 . 0 0 "[ . 1 . 2]" 1
689 1 36 PRO QB 1 37 ASP H . . 3.860 3.477 2.925 3.715 . 0 0 "[ . 1 . 2]" 1
690 1 36 PRO HB2 1 37 ASP H . . 4.610 3.666 3.013 3.959 . 0 0 "[ . 1 . 2]" 1
691 1 36 PRO HB3 1 37 ASP H . . 4.610 4.333 3.955 4.501 . 0 0 "[ . 1 . 2]" 1
692 1 36 PRO QD 1 37 ASP H . . 3.680 2.739 2.608 2.939 . 0 0 "[ . 1 . 2]" 1
693 1 36 PRO HD2 1 37 ASP H . . 4.380 2.797 2.654 3.019 . 0 0 "[ . 1 . 2]" 1
694 1 36 PRO HD3 1 37 ASP H . . 4.380 3.920 3.836 4.039 . 0 0 "[ . 1 . 2]" 1
695 1 36 PRO QG 1 37 ASP H . . 4.450 2.815 2.009 3.262 . 0 0 "[ . 1 . 2]" 1
696 1 37 ASP H 1 38 SER H . . 3.190 2.255 1.846 2.625 . 0 0 "[ . 1 . 2]" 1
697 1 38 SER H 1 38 SER HB2 . . 3.700 2.408 2.191 2.735 . 0 0 "[ . 1 . 2]" 1
698 1 38 SER H 1 38 SER QB . . 3.120 2.366 2.141 2.658 . 0 0 "[ . 1 . 2]" 1
699 1 38 SER H 1 38 SER HB3 . . 3.700 3.511 2.964 3.618 . 0 0 "[ . 1 . 2]" 1
700 1 38 SER H 1 38 SER HG . . 3.970 3.403 2.661 3.944 . 0 0 "[ . 1 . 2]" 1
701 1 38 SER H 1 39 LYS H . . 4.870 4.633 4.597 4.648 . 0 0 "[ . 1 . 2]" 1
702 1 38 SER H 1 69 LEU MD2 . . 4.910 4.215 3.400 4.909 . 0 0 "[ . 1 . 2]" 1
703 1 38 SER HA 1 39 LYS H . . 3.010 2.379 2.219 2.539 . 0 0 "[ . 1 . 2]" 1
704 1 38 SER HA 1 93 ASN HA . . 4.150 3.766 3.163 4.153 0.003 17 0 "[ . 1 . 2]" 1
705 1 38 SER QB 1 39 LYS H . . 3.600 2.562 2.171 3.126 . 0 0 "[ . 1 . 2]" 1
706 1 38 SER QB 1 69 LEU MD2 . . 3.590 2.529 1.935 2.950 . 0 0 "[ . 1 . 2]" 1
707 1 38 SER QB 1 91 VAL MG1 . . 3.280 2.348 1.867 3.053 . 0 0 "[ . 1 . 2]" 1
708 1 38 SER HB2 1 39 LYS H . . 4.300 3.822 3.571 4.045 . 0 0 "[ . 1 . 2]" 1
709 1 38 SER HB2 1 69 LEU MD1 . . 4.170 3.268 2.789 3.801 . 0 0 "[ . 1 . 2]" 1
710 1 38 SER HB2 1 69 LEU MD2 . . 4.220 2.654 1.971 3.087 . 0 0 "[ . 1 . 2]" 1
711 1 38 SER HB2 1 91 VAL MG1 . . 3.870 3.542 3.028 3.879 0.009 9 0 "[ . 1 . 2]" 1
712 1 38 SER HB3 1 39 LYS H . . 4.300 2.609 2.187 3.267 . 0 0 "[ . 1 . 2]" 1
713 1 38 SER HB3 1 69 LEU MD1 . . 4.170 3.213 2.491 3.670 . 0 0 "[ . 1 . 2]" 1
714 1 38 SER HB3 1 69 LEU MD2 . . 4.220 3.447 2.224 4.115 . 0 0 "[ . 1 . 2]" 1
715 1 38 SER HB3 1 91 VAL MG1 . . 3.870 2.391 1.881 3.233 . 0 0 "[ . 1 . 2]" 1
716 1 38 SER HG 1 39 LYS H . . 4.190 3.656 2.936 4.172 . 0 0 "[ . 1 . 2]" 1
717 1 38 SER HG 1 91 VAL MG1 . . 4.140 3.112 2.511 3.782 . 0 0 "[ . 1 . 2]" 1
718 1 38 SER HG 1 93 ASN HA . . 4.470 3.710 2.004 4.461 . 0 0 "[ . 1 . 2]" 1
719 1 39 LYS H 1 39 LYS QB . . 3.430 2.577 2.420 2.764 . 0 0 "[ . 1 . 2]" 1
720 1 39 LYS H 1 39 LYS HG2 . . 4.720 4.334 3.462 4.686 . 0 0 "[ . 1 . 2]" 1
721 1 39 LYS H 1 39 LYS QG . . 4.090 3.633 2.805 4.128 0.038 10 0 "[ . 1 . 2]" 1
722 1 39 LYS H 1 39 LYS HG3 . . 4.720 3.968 2.901 4.662 . 0 0 "[ . 1 . 2]" 1
723 1 39 LYS H 1 91 VAL MG1 . . 3.980 2.856 2.367 3.442 . 0 0 "[ . 1 . 2]" 1
724 1 39 LYS H 1 92 SER H . . 3.910 3.179 2.462 3.689 . 0 0 "[ . 1 . 2]" 1
725 1 39 LYS H 1 93 ASN HA . . 4.900 4.384 3.656 4.806 . 0 0 "[ . 1 . 2]" 1
726 1 39 LYS HA 1 39 LYS QD . . 4.350 3.763 2.843 4.160 . 0 0 "[ . 1 . 2]" 1
727 1 39 LYS HA 1 39 LYS QG . . 3.680 2.333 2.235 2.467 . 0 0 "[ . 1 . 2]" 1
728 1 39 LYS HA 1 40 VAL H . . 3.210 2.279 2.146 2.525 . 0 0 "[ . 1 . 2]" 1
729 1 39 LYS HA 1 40 VAL HB . . 4.860 4.567 4.505 4.639 . 0 0 "[ . 1 . 2]" 1
730 1 39 LYS HA 1 59 VAL MG2 . . 3.560 3.189 2.292 3.557 . 0 0 "[ . 1 . 2]" 1
731 1 39 LYS QB 1 39 LYS QE . . 3.380 2.646 1.993 3.389 0.009 17 0 "[ . 1 . 2]" 1
732 1 39 LYS QB 1 40 VAL H . . 3.490 3.056 2.171 3.502 0.012 13 0 "[ . 1 . 2]" 1
733 1 39 LYS QB 1 41 VAL MG1 . . 3.770 3.287 2.889 3.753 . 0 0 "[ . 1 . 2]" 1
734 1 39 LYS QB 1 92 SER H . . 4.250 3.378 2.913 3.935 . 0 0 "[ . 1 . 2]" 1
735 1 39 LYS QB 1 92 SER HB2 . . 4.130 3.737 2.450 4.138 0.008 13 0 "[ . 1 . 2]" 1
736 1 39 LYS QB 1 92 SER QB . . 3.550 2.689 2.061 3.560 0.010 14 0 "[ . 1 . 2]" 1
737 1 39 LYS QB 1 92 SER HB3 . . 4.130 2.944 2.075 4.128 . 0 0 "[ . 1 . 2]" 1
738 1 39 LYS QD 1 40 VAL H . . 5.080 4.475 3.537 5.078 . 0 0 "[ . 1 . 2]" 1
739 1 39 LYS QE 1 39 LYS HG2 . . 3.650 2.649 2.071 3.486 . 0 0 "[ . 1 . 2]" 1
740 1 39 LYS QE 1 39 LYS QG . . 3.130 2.245 2.049 2.620 . 0 0 "[ . 1 . 2]" 1
741 1 39 LYS QE 1 39 LYS HG3 . . 3.650 2.852 2.137 3.455 . 0 0 "[ . 1 . 2]" 1
742 1 39 LYS QG 1 40 VAL H . . 4.130 3.229 1.953 4.180 0.050 11 0 "[ . 1 . 2]" 1
743 1 39 LYS QG 1 92 SER QB . . 4.730 4.175 3.309 4.678 . 0 0 "[ . 1 . 2]" 1
744 1 40 VAL H 1 40 VAL HB . . 3.460 2.712 2.567 2.801 . 0 0 "[ . 1 . 2]" 1
745 1 40 VAL H 1 40 VAL MG1 . . 4.340 3.874 3.818 3.913 . 0 0 "[ . 1 . 2]" 1
746 1 40 VAL H 1 40 VAL MG2 . . 3.770 2.904 2.796 3.016 . 0 0 "[ . 1 . 2]" 1
747 1 40 VAL H 1 41 VAL H . . 4.640 4.148 3.965 4.369 . 0 0 "[ . 1 . 2]" 1
748 1 40 VAL H 1 59 VAL MG2 . . 3.710 3.204 2.681 3.724 0.014 13 0 "[ . 1 . 2]" 1
749 1 40 VAL HA 1 40 VAL MG1 . . 3.510 2.391 2.295 2.462 . 0 0 "[ . 1 . 2]" 1
750 1 40 VAL HA 1 40 VAL MG2 . . 3.580 2.332 2.248 2.434 . 0 0 "[ . 1 . 2]" 1
751 1 40 VAL HA 1 41 VAL H . . 3.170 2.149 2.140 2.186 . 0 0 "[ . 1 . 2]" 1
752 1 40 VAL HA 1 91 VAL MG1 . . 4.340 3.916 3.648 4.126 . 0 0 "[ . 1 . 2]" 1
753 1 40 VAL HA 1 91 VAL MG2 . . 3.960 3.599 3.240 3.962 0.002 7 0 "[ . 1 . 2]" 1
754 1 40 VAL HA 1 92 SER H . . 4.280 3.568 3.153 4.119 . 0 0 "[ . 1 . 2]" 1
755 1 40 VAL HB 1 41 VAL H . . 4.400 4.321 4.240 4.413 0.013 20 0 "[ . 1 . 2]" 1
756 1 40 VAL HB 1 57 ALA MB . . 3.580 3.046 2.656 3.380 . 0 0 "[ . 1 . 2]" 1
757 1 40 VAL HB 1 59 VAL MG2 . . 3.570 3.234 2.744 3.522 . 0 0 "[ . 1 . 2]" 1
758 1 40 VAL HB 1 71 LEU MD1 . . 3.320 2.325 1.955 2.726 . 0 0 "[ . 1 . 2]" 1
759 1 40 VAL MG1 1 41 VAL H . . 3.600 2.813 2.486 3.117 . 0 0 "[ . 1 . 2]" 1
760 1 40 VAL MG1 1 42 PHE QD . . 4.210 3.340 2.999 3.735 . 0 0 "[ . 1 . 2]" 1
761 1 40 VAL MG1 1 42 PHE QE . . 3.400 2.499 2.019 3.009 . 0 0 "[ . 1 . 2]" 1
762 1 40 VAL MG1 1 42 PHE HZ . . 4.490 3.868 3.585 4.138 . 0 0 "[ . 1 . 2]" 1
763 1 40 VAL MG1 1 57 ALA MB . . 3.760 3.168 2.729 3.494 . 0 0 "[ . 1 . 2]" 1
764 1 40 VAL MG1 1 89 PHE HA . . 5.080 4.617 4.263 5.077 . 0 0 "[ . 1 . 2]" 1
765 1 40 VAL MG1 1 89 PHE HB2 . . 4.330 2.814 2.443 3.096 . 0 0 "[ . 1 . 2]" 1
766 1 40 VAL MG1 1 89 PHE QB . . 3.650 2.760 2.407 3.018 . 0 0 "[ . 1 . 2]" 1
767 1 40 VAL MG1 1 89 PHE HB3 . . 4.330 3.993 3.623 4.277 . 0 0 "[ . 1 . 2]" 1
768 1 40 VAL MG1 1 89 PHE QD . . 3.880 3.085 2.131 3.491 . 0 0 "[ . 1 . 2]" 1
769 1 40 VAL MG1 1 89 PHE QE . . 4.590 4.302 3.313 4.582 . 0 0 "[ . 1 . 2]" 1
770 1 40 VAL MG1 1 90 TYR H . . 4.160 3.556 3.188 4.056 . 0 0 "[ . 1 . 2]" 1
771 1 40 VAL MG1 1 91 VAL HA . . 4.430 3.863 3.533 4.172 . 0 0 "[ . 1 . 2]" 1
772 1 40 VAL MG1 1 91 VAL MG2 . . 3.800 3.169 2.555 3.520 . 0 0 "[ . 1 . 2]" 1
773 1 40 VAL MG2 1 41 VAL H . . 4.460 4.114 3.990 4.204 . 0 0 "[ . 1 . 2]" 1
774 1 40 VAL MG2 1 59 VAL MG2 . . 3.180 2.782 2.345 3.070 . 0 0 "[ . 1 . 2]" 1
775 1 40 VAL MG2 1 69 LEU MD1 . . 3.380 2.971 2.528 3.380 . 14 0 "[ . 1 . 2]" 1
776 1 40 VAL MG2 1 91 VAL HA . . 3.880 3.003 2.625 3.249 . 0 0 "[ . 1 . 2]" 1
777 1 40 VAL MG2 1 91 VAL MG1 . . 3.350 2.752 2.397 3.067 . 0 0 "[ . 1 . 2]" 1
778 1 40 VAL MG2 1 91 VAL MG2 . . 3.020 2.303 1.972 2.741 . 0 0 "[ . 1 . 2]" 1
779 1 40 VAL MG2 1 92 SER H . . 4.290 4.085 3.804 4.292 0.002 13 0 "[ . 1 . 2]" 1
780 1 41 VAL H 1 41 VAL HB . . 3.990 3.811 3.747 3.899 . 0 0 "[ . 1 . 2]" 1
781 1 41 VAL H 1 41 VAL MG1 . . 3.300 2.640 2.401 2.842 . 0 0 "[ . 1 . 2]" 1
782 1 41 VAL H 1 41 VAL MG2 . . 3.310 2.224 2.064 2.477 . 0 0 "[ . 1 . 2]" 1
783 1 41 VAL H 1 90 TYR H . . 3.780 3.399 3.020 3.617 . 0 0 "[ . 1 . 2]" 1
784 1 41 VAL H 1 91 VAL HA . . 4.410 3.909 3.643 4.098 . 0 0 "[ . 1 . 2]" 1
785 1 41 VAL HA 1 41 VAL MG1 . . 3.510 2.423 2.306 2.547 . 0 0 "[ . 1 . 2]" 1
786 1 41 VAL HA 1 41 VAL MG2 . . 3.440 3.189 3.167 3.200 . 0 0 "[ . 1 . 2]" 1
787 1 41 VAL HA 1 42 PHE H . . 3.130 2.276 2.242 2.302 . 0 0 "[ . 1 . 2]" 1
788 1 41 VAL HA 1 42 PHE HB2 . . 4.650 4.409 4.336 4.581 . 0 0 "[ . 1 . 2]" 1
789 1 41 VAL HA 1 42 PHE QD . . 4.770 2.981 2.674 3.222 . 0 0 "[ . 1 . 2]" 1
790 1 41 VAL HA 1 56 GLU HA . . 3.800 3.546 3.231 3.805 0.005 19 0 "[ . 1 . 2]" 1
791 1 41 VAL HA 1 57 ALA H . . 4.230 4.088 3.831 4.229 . 0 0 "[ . 1 . 2]" 1
792 1 41 VAL HB 1 42 PHE H . . 3.530 2.756 2.666 2.858 . 0 0 "[ . 1 . 2]" 1
793 1 41 VAL HB 1 55 GLU H . . 3.950 3.854 3.550 3.953 0.003 19 0 "[ . 1 . 2]" 1
794 1 41 VAL HB 1 90 TYR QE . . 5.100 4.855 4.465 5.100 . 0 0 "[ . 1 . 2]" 1
795 1 41 VAL MG1 1 42 PHE H . . 4.150 3.956 3.880 4.068 . 0 0 "[ . 1 . 2]" 1
796 1 41 VAL MG1 1 56 GLU HA . . 3.810 3.509 3.178 3.800 . 0 0 "[ . 1 . 2]" 1
797 1 41 VAL MG1 1 56 GLU QB . . 4.660 4.322 3.786 4.660 0.000 10 0 "[ . 1 . 2]" 1
798 1 41 VAL MG1 1 57 ALA H . . 4.680 4.313 3.760 4.623 . 0 0 "[ . 1 . 2]" 1
799 1 41 VAL MG1 1 90 TYR QE . . 4.490 4.159 3.470 4.452 . 0 0 "[ . 1 . 2]" 1
800 1 41 VAL MG1 1 92 SER HB2 . . 4.610 4.226 3.309 4.610 0.000 13 0 "[ . 1 . 2]" 1
801 1 41 VAL MG1 1 92 SER HB3 . . 4.610 4.188 3.514 4.611 0.001 15 0 "[ . 1 . 2]" 1
802 1 41 VAL MG2 1 42 PHE H . . 3.580 3.397 3.182 3.557 . 0 0 "[ . 1 . 2]" 1
803 1 41 VAL MG2 1 43 ILE MG . . 3.230 2.933 2.710 3.110 . 0 0 "[ . 1 . 2]" 1
804 1 41 VAL MG2 1 55 GLU H . . 5.130 5.024 4.822 5.132 0.002 13 0 "[ . 1 . 2]" 1
805 1 41 VAL MG2 1 90 TYR H . . 4.110 3.411 3.181 3.674 . 0 0 "[ . 1 . 2]" 1
806 1 41 VAL MG2 1 90 TYR QD . . 4.190 3.333 3.130 3.487 . 0 0 "[ . 1 . 2]" 1
807 1 41 VAL MG2 1 90 TYR QE . . 3.580 2.455 2.132 2.713 . 0 0 "[ . 1 . 2]" 1
808 1 42 PHE H 1 42 PHE HB2 . . 3.530 2.400 2.334 2.492 . 0 0 "[ . 1 . 2]" 1
809 1 42 PHE H 1 42 PHE HB3 . . 3.750 3.629 3.586 3.679 . 0 0 "[ . 1 . 2]" 1
810 1 42 PHE H 1 42 PHE QD . . 3.800 2.507 2.072 2.761 . 0 0 "[ . 1 . 2]" 1
811 1 42 PHE H 1 55 GLU H . . 3.900 3.722 3.449 3.908 0.008 19 0 "[ . 1 . 2]" 1
812 1 42 PHE H 1 56 GLU HA . . 4.950 4.683 4.376 4.933 . 0 0 "[ . 1 . 2]" 1
813 1 42 PHE HA 1 42 PHE QD . . 4.380 3.051 2.907 3.150 . 0 0 "[ . 1 . 2]" 1
814 1 42 PHE HA 1 43 ILE H . . 3.150 2.391 2.215 2.490 . 0 0 "[ . 1 . 2]" 1
815 1 42 PHE HA 1 43 ILE HG12 . . 5.220 3.824 3.679 4.047 . 0 0 "[ . 1 . 2]" 1
816 1 42 PHE HA 1 43 ILE MG . . 4.130 3.491 3.188 3.683 . 0 0 "[ . 1 . 2]" 1
817 1 42 PHE HA 1 89 PHE HA . . 3.570 2.442 2.189 2.678 . 0 0 "[ . 1 . 2]" 1
818 1 42 PHE HA 1 89 PHE HB2 . . 4.350 3.276 2.516 3.616 . 0 0 "[ . 1 . 2]" 1
819 1 42 PHE HA 1 89 PHE HB3 . . 4.350 2.663 2.229 3.011 . 0 0 "[ . 1 . 2]" 1
820 1 42 PHE HA 1 90 TYR H . . 4.040 3.907 3.615 4.049 0.009 20 0 "[ . 1 . 2]" 1
821 1 42 PHE HB2 1 43 ILE H . . 4.500 3.791 3.562 4.147 . 0 0 "[ . 1 . 2]" 1
822 1 42 PHE HB2 1 53 TRP HH2 . . 4.210 4.038 3.697 4.220 0.010 13 0 "[ . 1 . 2]" 1
823 1 42 PHE HB2 1 53 TRP HZ3 . . 4.300 3.124 2.585 3.500 . 0 0 "[ . 1 . 2]" 1
824 1 42 PHE HB2 1 55 GLU H . . 4.840 4.624 4.222 4.805 . 0 0 "[ . 1 . 2]" 1
825 1 42 PHE HB2 1 55 GLU QB . . 4.100 3.192 2.658 4.117 0.017 19 0 "[ . 1 . 2]" 1
826 1 42 PHE HB2 1 74 PRO QG . . 4.170 3.260 2.747 3.697 . 0 0 "[ . 1 . 2]" 1
827 1 42 PHE HB3 1 43 ILE H . . 4.280 2.485 2.238 2.994 . 0 0 "[ . 1 . 2]" 1
828 1 42 PHE HB3 1 53 TRP HH2 . . 4.090 3.908 3.484 4.091 0.001 4 0 "[ . 1 . 2]" 1
829 1 42 PHE HB3 1 53 TRP HZ3 . . 4.180 2.063 1.996 2.220 . 0 0 "[ . 1 . 2]" 1
830 1 42 PHE HB3 1 87 VAL MG2 . . 4.220 3.786 3.238 4.150 . 0 0 "[ . 1 . 2]" 1
831 1 42 PHE QD 1 43 ILE H . . 4.560 3.729 3.533 3.925 . 0 0 "[ . 1 . 2]" 1
832 1 42 PHE QD 1 53 TRP HZ3 . . 4.330 2.800 2.340 3.230 . 0 0 "[ . 1 . 2]" 1
833 1 42 PHE QD 1 57 ALA H . . 5.140 4.924 4.590 5.140 . 0 0 "[ . 1 . 2]" 1
834 1 42 PHE QD 1 57 ALA MB . . 3.820 3.478 3.014 3.806 . 0 0 "[ . 1 . 2]" 1
835 1 42 PHE QD 1 71 LEU MD1 . . 4.850 4.522 4.155 4.849 . 0 0 "[ . 1 . 2]" 1
836 1 42 PHE QD 1 74 PRO HD2 . . 4.690 4.173 3.713 4.349 . 0 0 "[ . 1 . 2]" 1
837 1 42 PHE QD 1 74 PRO HD3 . . 4.690 4.036 3.517 4.359 . 0 0 "[ . 1 . 2]" 1
838 1 42 PHE QD 1 74 PRO QG . . 3.720 2.607 1.999 2.919 . 0 0 "[ . 1 . 2]" 1
839 1 42 PHE QD 1 87 VAL HB . . 4.920 3.471 3.124 3.927 . 0 0 "[ . 1 . 2]" 1
840 1 42 PHE QD 1 87 VAL MG2 . . 3.930 2.379 2.045 2.843 . 0 0 "[ . 1 . 2]" 1
841 1 42 PHE QD 1 89 PHE QB . . 4.490 2.893 2.612 3.260 . 0 0 "[ . 1 . 2]" 1
842 1 42 PHE QE 1 57 ALA MB . . 3.590 2.804 1.974 3.141 . 0 0 "[ . 1 . 2]" 1
843 1 42 PHE QE 1 71 LEU MD1 . . 3.590 2.763 2.338 3.091 . 0 0 "[ . 1 . 2]" 1
844 1 42 PHE QE 1 73 VAL MG1 . . 4.280 3.483 2.927 3.967 . 0 0 "[ . 1 . 2]" 1
845 1 42 PHE QE 1 73 VAL MG2 . . 4.630 4.326 3.925 4.625 . 0 0 "[ . 1 . 2]" 1
846 1 42 PHE QE 1 74 PRO HD2 . . 4.810 3.085 2.528 3.351 . 0 0 "[ . 1 . 2]" 1
847 1 42 PHE QE 1 74 PRO HD3 . . 4.810 2.781 2.222 3.153 . 0 0 "[ . 1 . 2]" 1
848 1 42 PHE QE 1 87 VAL MG2 . . 4.320 3.205 2.935 3.501 . 0 0 "[ . 1 . 2]" 1
849 1 42 PHE QE 1 104 PHE QD . . 4.830 3.502 2.700 4.336 . 0 0 "[ . 1 . 2]" 1
850 1 42 PHE HZ 1 57 ALA MB . . 4.860 4.414 3.551 4.658 . 0 0 "[ . 1 . 2]" 1
851 1 42 PHE HZ 1 71 LEU MD1 . . 4.120 3.485 2.670 4.111 . 0 0 "[ . 1 . 2]" 1
852 1 42 PHE HZ 1 73 VAL MG1 . . 4.440 3.371 2.596 4.078 . 0 0 "[ . 1 . 2]" 1
853 1 42 PHE HZ 1 73 VAL MG2 . . 4.080 3.685 3.092 4.017 . 0 0 "[ . 1 . 2]" 1
854 1 42 PHE HZ 1 89 PHE QB . . 5.070 3.786 3.315 4.104 . 0 0 "[ . 1 . 2]" 1
855 1 42 PHE HZ 1 106 PHE QE . . 4.860 4.655 4.239 4.861 0.001 17 0 "[ . 1 . 2]" 1
856 1 43 ILE H 1 43 ILE MD . . 4.170 4.026 3.899 4.138 . 0 0 "[ . 1 . 2]" 1
857 1 43 ILE H 1 43 ILE HG12 . . 3.990 2.530 2.275 2.795 . 0 0 "[ . 1 . 2]" 1
858 1 43 ILE H 1 43 ILE HG13 . . 3.770 2.833 2.687 3.006 . 0 0 "[ . 1 . 2]" 1
859 1 43 ILE H 1 43 ILE MG . . 3.860 3.026 2.849 3.158 . 0 0 "[ . 1 . 2]" 1
860 1 43 ILE H 1 44 GLU H . . 4.850 4.429 4.383 4.490 . 0 0 "[ . 1 . 2]" 1
861 1 43 ILE H 1 53 TRP HZ3 . . 4.930 3.687 3.330 4.140 . 0 0 "[ . 1 . 2]" 1
862 1 43 ILE H 1 87 VAL HB . . 4.650 3.676 3.393 4.162 . 0 0 "[ . 1 . 2]" 1
863 1 43 ILE H 1 88 TYR H . . 3.940 3.174 2.841 3.497 . 0 0 "[ . 1 . 2]" 1
864 1 43 ILE H 1 89 PHE HA . . 4.070 3.532 3.044 3.814 . 0 0 "[ . 1 . 2]" 1
865 1 43 ILE HA 1 43 ILE MD . . 4.340 4.151 4.119 4.171 . 0 0 "[ . 1 . 2]" 1
866 1 43 ILE HA 1 43 ILE MG . . 3.380 2.329 2.181 2.444 . 0 0 "[ . 1 . 2]" 1
867 1 43 ILE HA 1 44 GLU H . . 3.280 2.344 2.233 2.464 . 0 0 "[ . 1 . 2]" 1
868 1 43 ILE HA 1 51 LEU MD1 . . 5.140 4.583 4.047 4.953 . 0 0 "[ . 1 . 2]" 1
869 1 43 ILE HA 1 53 TRP HE3 . . 4.850 2.741 2.491 3.027 . 0 0 "[ . 1 . 2]" 1
870 1 43 ILE HB 1 43 ILE MD . . 3.370 2.303 2.163 2.409 . 0 0 "[ . 1 . 2]" 1
871 1 43 ILE HB 1 44 GLU H . . 3.590 2.536 2.246 2.851 . 0 0 "[ . 1 . 2]" 1
872 1 43 ILE HB 1 51 LEU HB2 . . 4.070 3.046 2.770 3.230 . 0 0 "[ . 1 . 2]" 1
873 1 43 ILE HB 1 51 LEU MD1 . . 3.640 3.163 2.797 3.416 . 0 0 "[ . 1 . 2]" 1
874 1 43 ILE HB 1 51 LEU MD2 . . 3.370 2.618 2.102 2.963 . 0 0 "[ . 1 . 2]" 1
875 1 43 ILE MD 1 43 ILE MG . . 3.070 2.172 2.019 2.316 . 0 0 "[ . 1 . 2]" 1
876 1 43 ILE MD 1 44 GLU H . . 4.730 4.198 3.938 4.541 . 0 0 "[ . 1 . 2]" 1
877 1 43 ILE MD 1 44 GLU HA . . 4.910 4.649 4.368 4.902 . 0 0 "[ . 1 . 2]" 1
878 1 43 ILE MD 1 45 ARG H . . 5.370 5.079 4.470 5.370 0.000 6 0 "[ . 1 . 2]" 1
879 1 43 ILE MD 1 45 ARG QD . . 4.410 3.943 2.566 4.407 . 0 0 "[ . 1 . 2]" 1
880 1 43 ILE MD 1 45 ARG HE . . 4.990 4.057 2.088 4.988 . 0 0 "[ . 1 . 2]" 1
881 1 43 ILE MD 1 45 ARG QG . . 3.860 3.583 2.962 3.861 0.001 14 0 "[ . 1 . 2]" 1
882 1 43 ILE MD 1 88 TYR HB2 . . 4.390 2.230 1.976 2.882 . 0 0 "[ . 1 . 2]" 1
883 1 43 ILE MD 1 88 TYR QB . . 3.670 2.175 1.935 2.666 . 0 0 "[ . 1 . 2]" 1
884 1 43 ILE MD 1 88 TYR HB3 . . 4.390 3.148 2.622 3.570 . 0 0 "[ . 1 . 2]" 1
885 1 43 ILE MD 1 88 TYR QD . . 4.240 3.328 2.428 4.243 0.003 6 0 "[ . 1 . 2]" 1
886 1 43 ILE MD 1 90 TYR QD . . 4.070 3.743 3.211 4.070 0.000 8 0 "[ . 1 . 2]" 1
887 1 43 ILE MD 1 90 TYR QE . . 4.280 3.826 3.173 4.242 . 0 0 "[ . 1 . 2]" 1
888 1 43 ILE MD 1 101 THR MG . . 3.380 2.319 1.955 2.920 . 0 0 "[ . 1 . 2]" 1
889 1 43 ILE HG12 1 88 TYR H . . 3.940 3.497 3.220 3.875 . 0 0 "[ . 1 . 2]" 1
890 1 43 ILE HG12 1 88 TYR HB2 . . 4.470 2.762 2.245 3.219 . 0 0 "[ . 1 . 2]" 1
891 1 43 ILE HG12 1 88 TYR QB . . 3.870 2.669 2.219 3.130 . 0 0 "[ . 1 . 2]" 1
892 1 43 ILE HG12 1 88 TYR HB3 . . 4.470 3.709 3.146 4.398 . 0 0 "[ . 1 . 2]" 1
893 1 43 ILE HG12 1 88 TYR QD . . 5.030 4.461 3.657 5.007 . 0 0 "[ . 1 . 2]" 1
894 1 43 ILE HG12 1 89 PHE H . . 4.760 4.425 3.931 4.730 . 0 0 "[ . 1 . 2]" 1
895 1 43 ILE HG12 1 89 PHE HA . . 5.500 3.337 2.645 3.683 . 0 0 "[ . 1 . 2]" 1
896 1 43 ILE HG12 1 90 TYR QD . . 4.850 3.880 3.589 4.277 . 0 0 "[ . 1 . 2]" 1
897 1 43 ILE HG12 1 90 TYR QE . . 5.400 4.205 3.637 4.862 . 0 0 "[ . 1 . 2]" 1
898 1 43 ILE HG13 1 44 GLU HA . . 4.890 3.804 3.617 3.945 . 0 0 "[ . 1 . 2]" 1
899 1 43 ILE HG13 1 88 TYR H . . 4.500 2.732 2.362 3.216 . 0 0 "[ . 1 . 2]" 1
900 1 43 ILE HG13 1 88 TYR HB2 . . 4.740 2.585 2.158 3.072 . 0 0 "[ . 1 . 2]" 1
901 1 43 ILE HG13 1 88 TYR QB . . 3.870 2.557 2.141 3.034 . 0 0 "[ . 1 . 2]" 1
902 1 43 ILE HG13 1 88 TYR HB3 . . 4.740 4.112 3.575 4.708 . 0 0 "[ . 1 . 2]" 1
903 1 43 ILE HG13 1 88 TYR QD . . 4.470 3.498 2.366 4.397 . 0 0 "[ . 1 . 2]" 1
904 1 43 ILE MG 1 44 GLU H . . 4.000 3.720 3.596 3.856 . 0 0 "[ . 1 . 2]" 1
905 1 43 ILE MG 1 89 PHE HA . . 5.200 3.775 3.377 4.101 . 0 0 "[ . 1 . 2]" 1
906 1 43 ILE MG 1 90 TYR QD . . 3.500 3.220 2.801 3.507 0.007 12 0 "[ . 1 . 2]" 1
907 1 43 ILE MG 1 90 TYR QE . . 3.320 2.236 1.905 2.636 . 0 0 "[ . 1 . 2]" 1
908 1 44 GLU H 1 44 GLU HB3 . . 4.100 2.732 2.616 2.845 . 0 0 "[ . 1 . 2]" 1
909 1 44 GLU H 1 45 ARG H . . 4.360 4.262 4.155 4.363 0.003 7 0 "[ . 1 . 2]" 1
910 1 44 GLU H 1 51 LEU HB3 . . 4.570 4.234 3.975 4.513 . 0 0 "[ . 1 . 2]" 1
911 1 44 GLU H 1 51 LEU MD1 . . 4.330 3.970 3.598 4.323 . 0 0 "[ . 1 . 2]" 1
912 1 44 GLU H 1 51 LEU MD2 . . 4.400 3.951 3.513 4.156 . 0 0 "[ . 1 . 2]" 1
913 1 44 GLU H 1 53 TRP H . . 3.970 3.887 3.761 3.965 . 0 0 "[ . 1 . 2]" 1
914 1 44 GLU H 1 53 TRP HB2 . . 4.790 2.775 2.493 3.086 . 0 0 "[ . 1 . 2]" 1
915 1 44 GLU H 1 53 TRP QB . . 4.100 2.456 2.247 2.653 . 0 0 "[ . 1 . 2]" 1
916 1 44 GLU H 1 53 TRP HB3 . . 4.790 2.748 2.536 2.993 . 0 0 "[ . 1 . 2]" 1
917 1 44 GLU H 1 53 TRP HE3 . . 4.190 3.467 3.062 3.864 . 0 0 "[ . 1 . 2]" 1
918 1 44 GLU HA 1 44 GLU HG2 . . 4.030 2.982 2.700 3.100 . 0 0 "[ . 1 . 2]" 1
919 1 44 GLU HA 1 44 GLU HG3 . . 3.870 2.906 2.778 3.678 . 0 0 "[ . 1 . 2]" 1
920 1 44 GLU HA 1 45 ARG H . . 3.030 2.171 2.139 2.218 . 0 0 "[ . 1 . 2]" 1
921 1 44 GLU HA 1 45 ARG QB . . 5.030 4.306 4.154 4.423 . 0 0 "[ . 1 . 2]" 1
922 1 44 GLU HA 1 51 LEU HB3 . . 5.500 4.855 4.638 5.059 . 0 0 "[ . 1 . 2]" 1
923 1 44 GLU HA 1 87 VAL MG1 . . 4.570 3.282 2.473 3.707 . 0 0 "[ . 1 . 2]" 1
924 1 44 GLU HB2 1 45 ARG H . . 4.490 4.080 3.838 4.259 . 0 0 "[ . 1 . 2]" 1
925 1 44 GLU HB2 1 53 TRP HB2 . . 4.650 3.286 3.011 3.505 . 0 0 "[ . 1 . 2]" 1
926 1 44 GLU HB2 1 53 TRP QB . . 4.060 3.123 2.903 3.321 . 0 0 "[ . 1 . 2]" 1
927 1 44 GLU HB2 1 53 TRP HB3 . . 4.650 3.910 3.686 4.117 . 0 0 "[ . 1 . 2]" 1
928 1 44 GLU HB2 1 53 TRP HE3 . . 4.390 2.907 2.582 3.126 . 0 0 "[ . 1 . 2]" 1
929 1 44 GLU HB2 1 76 TYR QE . . 4.190 2.853 2.325 3.231 . 0 0 "[ . 1 . 2]" 1
930 1 44 GLU HB2 1 87 VAL MG1 . . 3.850 3.044 2.800 3.208 . 0 0 "[ . 1 . 2]" 1
931 1 44 GLU HB3 1 53 TRP H . . 5.120 4.986 4.884 5.096 . 0 0 "[ . 1 . 2]" 1
932 1 44 GLU HB3 1 53 TRP HB2 . . 4.290 2.069 1.996 2.172 . 0 0 "[ . 1 . 2]" 1
933 1 44 GLU HB3 1 53 TRP HB3 . . 4.290 3.320 3.027 3.459 . 0 0 "[ . 1 . 2]" 1
934 1 44 GLU HB3 1 53 TRP HE3 . . 4.490 3.607 3.224 3.837 . 0 0 "[ . 1 . 2]" 1
935 1 44 GLU HB3 1 87 VAL MG1 . . 4.660 4.562 4.373 4.659 . 0 0 "[ . 1 . 2]" 1
936 1 44 GLU HG2 1 45 ARG H . . 3.820 2.740 2.207 3.148 . 0 0 "[ . 1 . 2]" 1
937 1 44 GLU HG2 1 46 GLY H . . 4.730 4.592 4.320 4.732 0.002 9 0 "[ . 1 . 2]" 1
938 1 44 GLU HG2 1 46 GLY QA . . 4.630 3.989 3.849 4.230 . 0 0 "[ . 1 . 2]" 1
939 1 44 GLU HG2 1 87 VAL MG1 . . 4.790 4.555 3.985 4.779 . 0 0 "[ . 1 . 2]" 1
940 1 44 GLU HG3 1 45 ARG H . . 3.930 3.322 3.016 3.918 . 0 0 "[ . 1 . 2]" 1
941 1 44 GLU HG3 1 87 VAL MG1 . . 4.550 3.307 2.913 3.942 . 0 0 "[ . 1 . 2]" 1
942 1 45 ARG H 1 45 ARG QB . . 3.480 2.342 2.192 2.463 . 0 0 "[ . 1 . 2]" 1
943 1 45 ARG H 1 45 ARG QG . . 3.810 2.921 2.403 3.486 . 0 0 "[ . 1 . 2]" 1
944 1 45 ARG H 1 46 GLY H . . 4.920 4.523 4.399 4.565 . 0 0 "[ . 1 . 2]" 1
945 1 45 ARG HA 1 45 ARG QG . . 3.660 2.376 2.288 2.483 . 0 0 "[ . 1 . 2]" 1
946 1 45 ARG HA 1 46 GLY H . . 3.100 2.181 2.146 2.212 . 0 0 "[ . 1 . 2]" 1
947 1 45 ARG HA 1 46 GLY QA . . 4.680 3.891 3.889 3.901 . 0 0 "[ . 1 . 2]" 1
948 1 45 ARG HA 1 51 LEU HA . . 3.910 2.432 2.282 2.560 . 0 0 "[ . 1 . 2]" 1
949 1 45 ARG HA 1 51 LEU HB3 . . 4.530 2.025 1.995 2.100 . 0 0 "[ . 1 . 2]" 1
950 1 45 ARG HA 1 51 LEU MD1 . . 4.760 4.701 4.650 4.757 . 0 0 "[ . 1 . 2]" 1
951 1 45 ARG HA 1 51 LEU HG . . 4.640 4.349 4.253 4.466 . 0 0 "[ . 1 . 2]" 1
952 1 45 ARG HA 1 52 GLN H . . 4.200 4.038 3.899 4.184 . 0 0 "[ . 1 . 2]" 1
953 1 45 ARG QB 1 45 ARG HD2 . . 3.650 2.677 2.190 3.416 . 0 0 "[ . 1 . 2]" 1
954 1 45 ARG QB 1 45 ARG QD . . 3.170 2.195 2.066 2.523 . 0 0 "[ . 1 . 2]" 1
955 1 45 ARG QB 1 45 ARG HD3 . . 3.650 2.503 2.114 3.294 . 0 0 "[ . 1 . 2]" 1
956 1 45 ARG QB 1 46 GLY H . . 3.910 3.078 2.916 3.292 . 0 0 "[ . 1 . 2]" 1
957 1 45 ARG QG 1 46 GLY H . . 4.070 3.933 3.636 4.075 0.005 9 0 "[ . 1 . 2]" 1
958 1 45 ARG QG 1 51 LEU HA . . 4.160 3.942 3.790 4.096 . 0 0 "[ . 1 . 2]" 1
959 1 45 ARG QG 1 51 LEU HB3 . . 3.370 2.149 1.993 2.361 . 0 0 "[ . 1 . 2]" 1
960 1 46 GLY H 1 47 PRO QD . . 4.540 4.349 4.276 4.370 . 0 0 "[ . 1 . 2]" 1
961 1 46 GLY H 1 49 GLY H . . 4.750 3.863 3.712 4.072 . 0 0 "[ . 1 . 2]" 1
962 1 46 GLY H 1 50 LYS H . . 4.570 4.409 4.223 4.568 . 0 0 "[ . 1 . 2]" 1
963 1 46 GLY H 1 51 LEU HA . . 4.070 2.795 2.629 2.880 . 0 0 "[ . 1 . 2]" 1
964 1 46 GLY H 1 51 LEU HB3 . . 4.450 3.739 3.600 3.853 . 0 0 "[ . 1 . 2]" 1
965 1 46 GLY H 1 52 GLN H . . 4.470 4.398 4.188 4.471 0.001 17 0 "[ . 1 . 2]" 1
966 1 46 GLY QA 1 47 PRO QG . . 4.070 3.699 3.695 3.700 . 0 0 "[ . 1 . 2]" 1
967 1 46 GLY HA2 1 47 PRO QD . . 3.370 2.204 2.145 2.348 . 0 0 "[ . 1 . 2]" 1
968 1 46 GLY HA2 1 47 PRO QG . . 4.690 4.123 4.060 4.268 . 0 0 "[ . 1 . 2]" 1
969 1 46 GLY HA3 1 47 PRO QD . . 3.370 2.384 2.209 2.469 . 0 0 "[ . 1 . 2]" 1
970 1 46 GLY HA3 1 47 PRO QG . . 4.690 4.185 4.047 4.252 . 0 0 "[ . 1 . 2]" 1
971 1 47 PRO HA 1 49 GLY H . . 4.440 4.302 3.944 4.432 . 0 0 "[ . 1 . 2]" 1
972 1 47 PRO QB 1 48 ASP H . . 3.970 3.636 3.053 3.729 . 0 0 "[ . 1 . 2]" 1
973 1 47 PRO QD 1 48 ASP H . . 4.110 2.865 2.617 2.960 . 0 0 "[ . 1 . 2]" 1
974 1 47 PRO QG 1 48 ASP H . . 4.180 3.109 2.153 3.292 . 0 0 "[ . 1 . 2]" 1
975 1 48 ASP H 1 48 ASP QB . . 3.700 2.387 2.195 2.848 . 0 0 "[ . 1 . 2]" 1
976 1 48 ASP H 1 49 GLY H . . 3.270 2.413 2.240 2.821 . 0 0 "[ . 1 . 2]" 1
977 1 48 ASP H 1 50 LYS H . . 4.460 4.171 3.991 4.432 . 0 0 "[ . 1 . 2]" 1
978 1 48 ASP QB 1 50 LYS H . . 4.880 2.917 2.586 3.868 . 0 0 "[ . 1 . 2]" 1
979 1 49 GLY H 1 50 LYS H . . 3.360 2.313 2.159 2.593 . 0 0 "[ . 1 . 2]" 1
980 1 50 LYS H 1 50 LYS HB2 . . 3.730 3.178 2.464 3.732 0.002 16 0 "[ . 1 . 2]" 1
981 1 50 LYS H 1 50 LYS QB . . 3.000 2.740 2.427 3.008 0.008 1 0 "[ . 1 . 2]" 1
982 1 50 LYS H 1 50 LYS HB3 . . 3.730 3.361 2.975 3.739 0.009 17 0 "[ . 1 . 2]" 1
983 1 50 LYS H 1 50 LYS QE . . 5.500 4.550 3.654 5.368 . 0 0 "[ . 1 . 2]" 1
984 1 50 LYS H 1 50 LYS HG2 . . 3.690 2.713 1.900 3.670 . 0 0 "[ . 1 . 2]" 1
985 1 50 LYS H 1 50 LYS QG . . 3.220 2.338 1.879 2.876 . 0 0 "[ . 1 . 2]" 1
986 1 50 LYS H 1 50 LYS HG3 . . 3.690 2.891 2.614 3.360 . 0 0 "[ . 1 . 2]" 1
987 1 50 LYS H 1 51 LEU H . . 4.790 4.515 4.466 4.558 . 0 0 "[ . 1 . 2]" 1
988 1 50 LYS HA 1 50 LYS HG2 . . 3.940 3.130 2.378 3.823 . 0 0 "[ . 1 . 2]" 1
989 1 50 LYS HA 1 50 LYS QG . . 3.460 2.901 2.335 3.342 . 0 0 "[ . 1 . 2]" 1
990 1 50 LYS HA 1 50 LYS HG3 . . 3.940 3.609 3.310 3.932 . 0 0 "[ . 1 . 2]" 1
991 1 50 LYS HA 1 51 LEU H . . 2.960 2.265 2.204 2.336 . 0 0 "[ . 1 . 2]" 1
992 1 50 LYS HA 1 51 LEU MD1 . . 4.440 4.383 4.118 4.444 0.004 7 0 "[ . 1 . 2]" 1
993 1 50 LYS QB 1 50 LYS QE . . 4.380 2.963 2.025 3.676 . 0 0 "[ . 1 . 2]" 1
994 1 50 LYS QB 1 51 LEU H . . 3.440 2.742 2.555 2.937 . 0 0 "[ . 1 . 2]" 1
995 1 50 LYS HB2 1 51 LEU H . . 4.080 3.285 2.595 4.054 . 0 0 "[ . 1 . 2]" 1
996 1 50 LYS HB3 1 51 LEU H . . 4.080 3.410 2.701 3.988 . 0 0 "[ . 1 . 2]" 1
997 1 50 LYS QG 1 51 LEU H . . 4.390 4.011 3.805 4.161 . 0 0 "[ . 1 . 2]" 1
998 1 51 LEU H 1 51 LEU HB2 . . 3.760 3.613 3.576 3.624 . 0 0 "[ . 1 . 2]" 1
999 1 51 LEU H 1 51 LEU HB3 . . 3.090 3.065 2.933 3.112 0.022 18 0 "[ . 1 . 2]" 1
1000 1 51 LEU H 1 51 LEU MD1 . . 4.440 2.549 2.277 2.672 . 0 0 "[ . 1 . 2]" 1
1001 1 51 LEU H 1 51 LEU MD2 . . 4.380 3.604 3.568 3.627 . 0 0 "[ . 1 . 2]" 1
1002 1 51 LEU H 1 51 LEU HG . . 3.250 1.901 1.883 1.926 . 0 0 "[ . 1 . 2]" 1
1003 1 51 LEU H 1 52 GLN H . . 4.660 4.514 4.480 4.564 . 0 0 "[ . 1 . 2]" 1
1004 1 51 LEU HA 1 51 LEU MD1 . . 3.670 3.548 3.511 3.575 . 0 0 "[ . 1 . 2]" 1
1005 1 51 LEU HA 1 51 LEU MD2 . . 4.220 4.090 4.059 4.111 . 0 0 "[ . 1 . 2]" 1
1006 1 51 LEU HA 1 52 GLN H . . 3.050 2.194 2.173 2.219 . 0 0 "[ . 1 . 2]" 1
1007 1 51 LEU HB2 1 51 LEU MD1 . . 3.330 2.215 2.184 2.268 . 0 0 "[ . 1 . 2]" 1
1008 1 51 LEU HB2 1 52 GLN H . . 4.200 3.053 2.941 3.151 . 0 0 "[ . 1 . 2]" 1
1009 1 51 LEU HB2 1 53 TRP H . . 4.800 4.706 4.669 4.760 . 0 0 "[ . 1 . 2]" 1
1010 1 51 LEU HB3 1 51 LEU MD2 . . 3.100 2.290 2.155 2.349 . 0 0 "[ . 1 . 2]" 1
1011 1 51 LEU HB3 1 52 GLN H . . 4.380 3.932 3.885 3.975 . 0 0 "[ . 1 . 2]" 1
1012 1 51 LEU MD1 1 52 GLN H . . 4.210 3.723 3.552 3.849 . 0 0 "[ . 1 . 2]" 1
1013 1 51 LEU MD2 1 52 GLN H . . 5.060 4.971 4.854 5.071 0.011 13 0 "[ . 1 . 2]" 1
1014 1 52 GLN H 1 52 GLN HB2 . . 4.110 3.413 2.832 3.931 . 0 0 "[ . 1 . 2]" 1
1015 1 52 GLN H 1 52 GLN HB3 . . 4.110 3.709 3.412 3.931 . 0 0 "[ . 1 . 2]" 1
1016 1 52 GLN H 1 52 GLN HG2 . . 4.210 3.138 2.341 4.112 . 0 0 "[ . 1 . 2]" 1
1017 1 52 GLN H 1 52 GLN HG3 . . 4.210 3.315 2.449 4.220 0.010 13 0 "[ . 1 . 2]" 1
1018 1 52 GLN H 1 53 TRP H . . 3.900 3.825 3.808 3.872 . 0 0 "[ . 1 . 2]" 1
1019 1 52 GLN HA 1 52 GLN HG2 . . 3.930 3.114 2.266 3.705 . 0 0 "[ . 1 . 2]" 1
1020 1 52 GLN HA 1 52 GLN HG3 . . 3.930 3.618 3.210 3.895 . 0 0 "[ . 1 . 2]" 1
1021 1 52 GLN QB 1 53 TRP H . . 3.660 3.554 3.526 3.583 . 0 0 "[ . 1 . 2]" 1
1022 1 52 GLN QG 1 53 TRP H . . 4.700 4.403 4.160 4.709 0.009 7 0 "[ . 1 . 2]" 1
1023 1 53 TRP H 1 53 TRP HB2 . . 4.040 3.252 3.199 3.304 . 0 0 "[ . 1 . 2]" 1
1024 1 53 TRP H 1 53 TRP QB . . 3.480 2.772 2.740 2.781 . 0 0 "[ . 1 . 2]" 1
1025 1 53 TRP H 1 53 TRP HB3 . . 4.040 3.007 2.927 3.050 . 0 0 "[ . 1 . 2]" 1
1026 1 53 TRP H 1 54 GLU H . . 4.660 3.958 3.860 4.095 . 0 0 "[ . 1 . 2]" 1
1027 1 53 TRP HA 1 53 TRP HD1 . . 3.870 2.132 2.055 2.253 . 0 0 "[ . 1 . 2]" 1
1028 1 53 TRP HA 1 54 GLU H . . 2.980 2.147 2.141 2.158 . 0 0 "[ . 1 . 2]" 1
1029 1 53 TRP QB 1 54 GLU H . . 3.920 3.869 3.780 3.928 0.008 5 0 "[ . 1 . 2]" 1
1030 1 53 TRP QB 1 76 TYR QE . . 5.270 5.023 4.635 5.272 0.002 10 0 "[ . 1 . 2]" 1
1031 1 53 TRP HB2 1 54 GLU H . . 4.460 4.444 4.366 4.479 0.019 19 0 "[ . 1 . 2]" 1
1032 1 53 TRP HB3 1 54 GLU H . . 4.460 4.256 4.141 4.363 . 0 0 "[ . 1 . 2]" 1
1033 1 53 TRP HD1 1 54 GLU H . . 4.070 2.743 2.370 3.137 . 0 0 "[ . 1 . 2]" 1
1034 1 53 TRP HD1 1 77 SER QB . . 4.070 3.962 3.303 4.074 0.004 13 0 "[ . 1 . 2]" 1
1035 1 53 TRP HE1 1 55 GLU QB . . 4.380 3.832 2.439 4.356 . 0 0 "[ . 1 . 2]" 1
1036 1 53 TRP HE1 1 55 GLU HG2 . . 4.250 2.959 2.344 4.032 . 0 0 "[ . 1 . 2]" 1
1037 1 53 TRP HE1 1 55 GLU HG3 . . 4.250 2.862 1.995 4.229 . 0 0 "[ . 1 . 2]" 1
1038 1 53 TRP HE1 1 76 TYR HA . . 4.730 4.501 4.317 4.647 . 0 0 "[ . 1 . 2]" 1
1039 1 53 TRP HE1 1 77 SER HA . . 4.610 4.151 3.341 4.552 . 0 0 "[ . 1 . 2]" 1
1040 1 53 TRP HE1 1 77 SER HB2 . . 4.370 3.083 2.268 4.331 . 0 0 "[ . 1 . 2]" 1
1041 1 53 TRP HE1 1 77 SER QB . . 3.710 2.657 2.090 3.197 . 0 0 "[ . 1 . 2]" 1
1042 1 53 TRP HE1 1 77 SER HB3 . . 4.370 3.701 2.100 4.370 . 0 0 "[ . 1 . 2]" 1
1043 1 53 TRP HE3 1 76 TYR QE . . 4.660 4.537 3.986 4.661 0.001 12 0 "[ . 1 . 2]" 1
1044 1 53 TRP HE3 1 87 VAL MG1 . . 4.410 3.942 3.624 4.211 . 0 0 "[ . 1 . 2]" 1
1045 1 53 TRP HH2 1 74 PRO HB2 . . 4.710 4.229 3.858 4.656 . 0 0 "[ . 1 . 2]" 1
1046 1 53 TRP HH2 1 74 PRO QG . . 4.140 3.507 3.223 3.856 . 0 0 "[ . 1 . 2]" 1
1047 1 53 TRP HH2 1 76 TYR HA . . 4.840 2.651 2.275 3.116 . 0 0 "[ . 1 . 2]" 1
1048 1 53 TRP HH2 1 106 PHE QD . . 4.840 4.624 4.137 4.843 0.003 13 0 "[ . 1 . 2]" 1
1049 1 53 TRP HH2 1 106 PHE QE . . 4.180 2.797 2.234 3.185 . 0 0 "[ . 1 . 2]" 1
1050 1 53 TRP HZ2 1 55 GLU HB2 . . 4.710 4.126 3.819 4.484 . 0 0 "[ . 1 . 2]" 1
1051 1 53 TRP HZ2 1 55 GLU QB . . 4.050 3.728 3.398 3.984 . 0 0 "[ . 1 . 2]" 1
1052 1 53 TRP HZ2 1 55 GLU HB3 . . 4.710 4.273 3.681 4.655 . 0 0 "[ . 1 . 2]" 1
1053 1 53 TRP HZ2 1 55 GLU HG2 . . 4.530 3.821 2.823 4.467 . 0 0 "[ . 1 . 2]" 1
1054 1 53 TRP HZ2 1 55 GLU QG . . 3.860 2.612 2.131 3.533 . 0 0 "[ . 1 . 2]" 1
1055 1 53 TRP HZ2 1 55 GLU HG3 . . 4.530 2.858 2.156 4.528 . 0 0 "[ . 1 . 2]" 1
1056 1 53 TRP HZ2 1 74 PRO HB2 . . 4.940 4.360 3.854 4.784 . 0 0 "[ . 1 . 2]" 1
1057 1 53 TRP HZ2 1 74 PRO QG . . 5.150 4.736 4.076 5.115 . 0 0 "[ . 1 . 2]" 1
1058 1 53 TRP HZ2 1 76 TYR HA . . 3.780 2.067 1.996 2.278 . 0 0 "[ . 1 . 2]" 1
1059 1 53 TRP HZ3 1 87 VAL HB . . 4.640 3.098 2.561 3.496 . 0 0 "[ . 1 . 2]" 1
1060 1 53 TRP HZ3 1 87 VAL MG1 . . 3.790 3.091 2.612 3.360 . 0 0 "[ . 1 . 2]" 1
1061 1 54 GLU H 1 54 GLU HB2 . . 3.800 2.818 2.435 3.023 . 0 0 "[ . 1 . 2]" 1
1062 1 54 GLU H 1 54 GLU QB . . 3.300 2.390 2.295 2.470 . 0 0 "[ . 1 . 2]" 1
1063 1 54 GLU H 1 54 GLU HB3 . . 3.800 2.603 2.463 2.807 . 0 0 "[ . 1 . 2]" 1
1064 1 54 GLU H 1 54 GLU QG . . 4.680 4.032 3.973 4.083 . 0 0 "[ . 1 . 2]" 1
1065 1 54 GLU H 1 55 GLU H . . 4.500 4.135 3.986 4.273 . 0 0 "[ . 1 . 2]" 1
1066 1 54 GLU HA 1 54 GLU QG . . 3.690 2.400 2.242 2.558 . 0 0 "[ . 1 . 2]" 1
1067 1 54 GLU HA 1 55 GLU H . . 3.150 2.184 2.154 2.218 . 0 0 "[ . 1 . 2]" 1
1068 1 54 GLU QB 1 55 GLU H . . 4.390 3.961 3.894 4.000 . 0 0 "[ . 1 . 2]" 1
1069 1 54 GLU QG 1 55 GLU H . . 3.680 3.400 3.227 3.537 . 0 0 "[ . 1 . 2]" 1
1070 1 54 GLU HG2 1 55 GLU H . . 4.250 3.811 3.520 4.026 . 0 0 "[ . 1 . 2]" 1
1071 1 54 GLU HG3 1 55 GLU H . . 4.250 3.853 3.452 4.132 . 0 0 "[ . 1 . 2]" 1
1072 1 55 GLU H 1 55 GLU HB2 . . 4.090 2.862 2.544 3.905 . 0 0 "[ . 1 . 2]" 1
1073 1 55 GLU H 1 55 GLU HB3 . . 4.090 3.659 3.166 3.806 . 0 0 "[ . 1 . 2]" 1
1074 1 55 GLU H 1 55 GLU QG . . 3.940 3.415 2.112 3.740 . 0 0 "[ . 1 . 2]" 1
1075 1 55 GLU HA 1 55 GLU HG2 . . 4.210 2.915 2.214 4.253 0.043 5 0 "[ . 1 . 2]" 1
1076 1 55 GLU HA 1 55 GLU QG . . 3.600 2.737 2.161 3.526 . 0 0 "[ . 1 . 2]" 1
1077 1 55 GLU HA 1 55 GLU HG3 . . 4.210 3.591 3.021 3.768 . 0 0 "[ . 1 . 2]" 1
1078 1 55 GLU HA 1 56 GLU H . . 2.860 2.171 2.139 2.319 . 0 0 "[ . 1 . 2]" 1
1079 1 55 GLU QB 1 56 GLU H . . 3.770 3.305 2.599 3.581 . 0 0 "[ . 1 . 2]" 1
1080 1 55 GLU QB 1 74 PRO HB2 . . 3.880 2.983 2.513 3.468 . 0 0 "[ . 1 . 2]" 1
1081 1 55 GLU QB 1 74 PRO HB3 . . 4.090 3.407 2.779 3.878 . 0 0 "[ . 1 . 2]" 1
1082 1 55 GLU HB2 1 56 GLU H . . 4.560 4.198 2.641 4.543 . 0 0 "[ . 1 . 2]" 1
1083 1 55 GLU HB3 1 56 GLU H . . 4.560 3.599 2.925 4.102 . 0 0 "[ . 1 . 2]" 1
1084 1 55 GLU QG 1 56 GLU H . . 4.980 4.384 3.709 4.624 . 0 0 "[ . 1 . 2]" 1
1085 1 56 GLU H 1 56 GLU HB2 . . 3.280 2.748 2.161 3.261 . 0 0 "[ . 1 . 2]" 1
1086 1 56 GLU H 1 56 GLU HB3 . . 3.280 2.653 2.334 3.453 0.173 10 0 "[ . 1 . 2]" 1
1087 1 56 GLU H 1 56 GLU HG2 . . 4.760 4.545 4.318 4.762 0.002 7 0 "[ . 1 . 2]" 1
1088 1 56 GLU H 1 56 GLU HG3 . . 4.760 4.377 3.260 4.785 0.025 19 0 "[ . 1 . 2]" 1
1089 1 56 GLU H 1 74 PRO HB3 . . 5.500 4.978 4.523 5.409 . 0 0 "[ . 1 . 2]" 1
1090 1 56 GLU HA 1 56 GLU HG2 . . 4.250 3.205 2.579 3.873 . 0 0 "[ . 1 . 2]" 1
1091 1 56 GLU HA 1 56 GLU HG3 . . 4.250 2.784 2.329 3.764 . 0 0 "[ . 1 . 2]" 1
1092 1 56 GLU HA 1 57 ALA H . . 3.020 2.221 2.175 2.310 . 0 0 "[ . 1 . 2]" 1
1093 1 56 GLU QB 1 57 ALA H . . 3.700 3.497 2.739 3.676 . 0 0 "[ . 1 . 2]" 1
1094 1 56 GLU HB2 1 57 ALA H . . 4.300 4.088 3.844 4.285 . 0 0 "[ . 1 . 2]" 1
1095 1 56 GLU HB3 1 57 ALA H . . 4.300 3.855 2.784 4.169 . 0 0 "[ . 1 . 2]" 1
1096 1 56 GLU QG 1 57 ALA H . . 3.790 2.517 2.215 3.474 . 0 0 "[ . 1 . 2]" 1
1097 1 56 GLU HG2 1 57 ALA H . . 4.310 3.182 2.229 4.231 . 0 0 "[ . 1 . 2]" 1
1098 1 56 GLU HG3 1 57 ALA H . . 4.310 3.053 2.342 4.233 . 0 0 "[ . 1 . 2]" 1
1099 1 57 ALA H 1 57 ALA MB . . 3.210 2.368 2.215 2.518 . 0 0 "[ . 1 . 2]" 1
1100 1 57 ALA HA 1 58 THR H . . 3.020 2.196 2.146 2.257 . 0 0 "[ . 1 . 2]" 1
1101 1 57 ALA HA 1 74 PRO HB3 . . 4.730 3.143 2.570 3.725 . 0 0 "[ . 1 . 2]" 1
1102 1 57 ALA HA 1 74 PRO QG . . 5.030 4.347 3.723 4.806 . 0 0 "[ . 1 . 2]" 1
1103 1 57 ALA MB 1 58 THR H . . 3.490 2.943 2.707 3.161 . 0 0 "[ . 1 . 2]" 1
1104 1 57 ALA MB 1 71 LEU MD1 . . 3.080 2.018 1.844 2.560 . 0 0 "[ . 1 . 2]" 1
1105 1 57 ALA MB 1 71 LEU HG . . 4.290 3.710 3.337 3.951 . 0 0 "[ . 1 . 2]" 1
1106 1 57 ALA MB 1 72 THR H . . 4.520 3.426 2.826 3.863 . 0 0 "[ . 1 . 2]" 1
1107 1 57 ALA MB 1 73 VAL HA . . 4.250 3.577 3.084 4.057 . 0 0 "[ . 1 . 2]" 1
1108 1 57 ALA MB 1 74 PRO HD2 . . 3.990 3.628 3.386 3.900 . 0 0 "[ . 1 . 2]" 1
1109 1 57 ALA MB 1 74 PRO QD . . 3.360 2.117 1.913 2.339 . 0 0 "[ . 1 . 2]" 1
1110 1 57 ALA MB 1 74 PRO HD3 . . 3.990 2.132 1.923 2.360 . 0 0 "[ . 1 . 2]" 1
1111 1 57 ALA MB 1 74 PRO QG . . 3.910 2.815 2.438 3.229 . 0 0 "[ . 1 . 2]" 1
1112 1 58 THR H 1 58 THR HB . . 3.240 2.593 2.499 2.697 . 0 0 "[ . 1 . 2]" 1
1113 1 58 THR H 1 58 THR MG . . 3.910 3.767 3.754 3.791 . 0 0 "[ . 1 . 2]" 1
1114 1 58 THR H 1 72 THR H . . 4.390 3.722 3.292 4.084 . 0 0 "[ . 1 . 2]" 1
1115 1 58 THR H 1 72 THR HB . . 4.360 3.250 2.772 3.755 . 0 0 "[ . 1 . 2]" 1
1116 1 58 THR HA 1 58 THR MG . . 3.270 2.348 2.210 2.452 . 0 0 "[ . 1 . 2]" 1
1117 1 58 THR HA 1 59 VAL H . . 2.880 2.188 2.142 2.257 . 0 0 "[ . 1 . 2]" 1
1118 1 58 THR HA 1 59 VAL HB . . 4.730 4.573 4.351 4.684 . 0 0 "[ . 1 . 2]" 1
1119 1 58 THR HA 1 59 VAL MG2 . . 4.290 3.795 3.398 4.205 . 0 0 "[ . 1 . 2]" 1
1120 1 58 THR HB 1 59 VAL H . . 4.910 4.202 3.845 4.447 . 0 0 "[ . 1 . 2]" 1
1121 1 58 THR HB 1 72 THR H . . 4.380 3.310 2.660 3.682 . 0 0 "[ . 1 . 2]" 1
1122 1 58 THR HB 1 72 THR HB . . 3.670 2.440 2.001 3.096 . 0 0 "[ . 1 . 2]" 1
1123 1 58 THR MG 1 59 VAL H . . 3.520 2.686 2.070 3.404 . 0 0 "[ . 1 . 2]" 1
1124 1 58 THR MG 1 60 ASN H . . 5.070 4.393 3.839 4.859 . 0 0 "[ . 1 . 2]" 1
1125 1 59 VAL H 1 59 VAL HB . . 3.270 2.540 2.369 2.703 . 0 0 "[ . 1 . 2]" 1
1126 1 59 VAL H 1 59 VAL MG1 . . 4.240 3.794 3.678 3.871 . 0 0 "[ . 1 . 2]" 1
1127 1 59 VAL H 1 59 VAL MG2 . . 3.450 2.679 2.333 3.136 . 0 0 "[ . 1 . 2]" 1
1128 1 59 VAL HA 1 59 VAL MG1 . . 3.320 2.401 2.265 2.555 . 0 0 "[ . 1 . 2]" 1
1129 1 59 VAL HA 1 59 VAL MG2 . . 3.380 2.349 2.213 2.470 . 0 0 "[ . 1 . 2]" 1
1130 1 59 VAL HA 1 60 ASN H . . 3.150 2.174 2.141 2.250 . 0 0 "[ . 1 . 2]" 1
1131 1 59 VAL HA 1 71 LEU HA . . 3.460 2.429 2.004 2.883 . 0 0 "[ . 1 . 2]" 1
1132 1 59 VAL HA 1 71 LEU HB2 . . 3.980 2.845 2.236 3.213 . 0 0 "[ . 1 . 2]" 1
1133 1 59 VAL HA 1 71 LEU HB3 . . 3.860 2.947 2.307 3.369 . 0 0 "[ . 1 . 2]" 1
1134 1 59 VAL HA 1 71 LEU MD1 . . 5.010 4.300 3.639 4.773 . 0 0 "[ . 1 . 2]" 1
1135 1 59 VAL HA 1 71 LEU MD2 . . 5.500 4.625 4.159 4.985 . 0 0 "[ . 1 . 2]" 1
1136 1 59 VAL HA 1 72 THR H . . 4.030 3.744 3.257 4.004 . 0 0 "[ . 1 . 2]" 1
1137 1 59 VAL HB 1 60 ASN H . . 4.670 4.168 3.895 4.405 . 0 0 "[ . 1 . 2]" 1
1138 1 59 VAL MG1 1 60 ASN H . . 3.450 2.458 2.069 2.827 . 0 0 "[ . 1 . 2]" 1
1139 1 59 VAL MG1 1 60 ASN HA . . 4.590 3.783 3.443 4.094 . 0 0 "[ . 1 . 2]" 1
1140 1 59 VAL MG1 1 61 ARG HA . . 3.950 3.510 3.257 3.770 . 0 0 "[ . 1 . 2]" 1
1141 1 59 VAL MG1 1 61 ARG HD2 . . 4.210 3.287 2.350 4.162 . 0 0 "[ . 1 . 2]" 1
1142 1 59 VAL MG1 1 61 ARG QD . . 3.550 2.921 2.332 3.551 0.001 19 0 "[ . 1 . 2]" 1
1143 1 59 VAL MG1 1 61 ARG HD3 . . 4.210 3.524 2.535 4.258 0.048 13 0 "[ . 1 . 2]" 1
1144 1 59 VAL MG1 1 61 ARG QH1 . . 4.820 3.927 2.310 4.820 . 0 0 "[ . 1 . 2]" 1
1145 1 59 VAL MG1 1 64 SER HB2 . . 4.610 3.744 2.953 4.351 . 0 0 "[ . 1 . 2]" 1
1146 1 59 VAL MG1 1 64 SER QB . . 3.990 3.203 2.763 3.702 . 0 0 "[ . 1 . 2]" 1
1147 1 59 VAL MG1 1 64 SER HB3 . . 4.610 3.650 2.894 4.510 . 0 0 "[ . 1 . 2]" 1
1148 1 59 VAL MG1 1 69 LEU HA . . 5.020 4.421 3.930 5.031 0.011 13 0 "[ . 1 . 2]" 1
1149 1 59 VAL MG1 1 69 LEU MD1 . . 4.700 4.444 3.985 4.703 0.003 13 0 "[ . 1 . 2]" 1
1150 1 59 VAL MG1 1 69 LEU MD2 . . 3.310 2.834 2.265 3.314 0.004 2 0 "[ . 1 . 2]" 1
1151 1 59 VAL MG1 1 70 THR H . . 4.570 4.004 3.622 4.403 . 0 0 "[ . 1 . 2]" 1
1152 1 59 VAL MG1 1 71 LEU HB2 . . 4.530 4.130 3.610 4.534 0.004 13 0 "[ . 1 . 2]" 1
1153 1 59 VAL MG1 1 71 LEU HB3 . . 4.510 3.317 2.601 3.949 . 0 0 "[ . 1 . 2]" 1
1154 1 59 VAL MG2 1 60 ASN H . . 4.270 3.939 3.743 4.091 . 0 0 "[ . 1 . 2]" 1
1155 1 59 VAL MG2 1 69 LEU MD2 . . 4.370 3.793 3.417 4.077 . 0 0 "[ . 1 . 2]" 1
1156 1 59 VAL MG2 1 71 LEU HB2 . . 4.710 2.760 2.323 3.394 . 0 0 "[ . 1 . 2]" 1
1157 1 59 VAL MG2 1 71 LEU HB3 . . 3.630 2.701 1.989 3.503 . 0 0 "[ . 1 . 2]" 1
1158 1 60 ASN H 1 60 ASN HB2 . . 3.630 2.580 2.241 2.899 . 0 0 "[ . 1 . 2]" 1
1159 1 60 ASN H 1 60 ASN HB3 . . 3.630 2.844 2.557 3.540 . 0 0 "[ . 1 . 2]" 1
1160 1 60 ASN H 1 61 ARG H . . 4.450 4.140 3.700 4.452 0.002 14 0 "[ . 1 . 2]" 1
1161 1 60 ASN H 1 70 THR HB . . 4.630 3.907 3.294 4.442 . 0 0 "[ . 1 . 2]" 1
1162 1 60 ASN H 1 70 THR MG . . 5.310 3.957 3.428 4.566 . 0 0 "[ . 1 . 2]" 1
1163 1 60 ASN H 1 71 LEU HA . . 3.570 2.814 2.347 3.283 . 0 0 "[ . 1 . 2]" 1
1164 1 60 ASN H 1 71 LEU HB2 . . 4.850 4.443 3.762 4.848 . 0 0 "[ . 1 . 2]" 1
1165 1 60 ASN H 1 71 LEU HB3 . . 4.710 4.020 3.143 4.550 . 0 0 "[ . 1 . 2]" 1
1166 1 60 ASN H 1 72 THR H . . 5.300 4.872 4.260 5.307 0.007 13 0 "[ . 1 . 2]" 1
1167 1 60 ASN HA 1 61 ARG H . . 3.170 2.204 2.140 2.295 . 0 0 "[ . 1 . 2]" 1
1168 1 60 ASN HA 1 61 ARG HA . . 4.680 4.459 4.381 4.541 . 0 0 "[ . 1 . 2]" 1
1169 1 60 ASN HA 1 62 LEU H . . 4.310 3.619 3.203 3.989 . 0 0 "[ . 1 . 2]" 1
1170 1 60 ASN HA 1 63 GLN H . . 4.870 4.452 4.224 4.859 . 0 0 "[ . 1 . 2]" 1
1171 1 60 ASN QB 1 60 ASN QD . . 3.010 2.140 2.065 2.221 . 0 0 "[ . 1 . 2]" 1
1172 1 60 ASN QB 1 61 ARG H . . 4.210 3.890 3.389 4.014 . 0 0 "[ . 1 . 2]" 1
1173 1 60 ASN QB 1 63 GLN H . . 4.300 3.081 2.320 3.512 . 0 0 "[ . 1 . 2]" 1
1174 1 60 ASN QB 1 63 GLN QB . . 4.510 2.566 1.904 3.772 . 0 0 "[ . 1 . 2]" 1
1175 1 60 ASN QB 1 70 THR HB . . 3.800 2.683 2.132 3.307 . 0 0 "[ . 1 . 2]" 1
1176 1 60 ASN HB2 1 60 ASN HD22 . . 4.060 3.730 3.442 4.010 . 0 0 "[ . 1 . 2]" 1
1177 1 60 ASN HB2 1 61 ARG H . . 4.810 4.559 4.385 4.658 . 0 0 "[ . 1 . 2]" 1
1178 1 60 ASN HB2 1 70 THR HB . . 4.580 3.924 2.235 4.577 . 0 0 "[ . 1 . 2]" 1
1179 1 60 ASN HB2 1 70 THR MG . . 3.890 3.307 2.505 3.891 0.001 2 0 "[ . 1 . 2]" 1
1180 1 60 ASN HB3 1 60 ASN HD22 . . 4.060 3.548 3.435 3.871 . 0 0 "[ . 1 . 2]" 1
1181 1 60 ASN HB3 1 61 ARG H . . 4.810 4.231 3.517 4.408 . 0 0 "[ . 1 . 2]" 1
1182 1 60 ASN HB3 1 70 THR HB . . 4.580 2.844 2.149 4.197 . 0 0 "[ . 1 . 2]" 1
1183 1 60 ASN HB3 1 70 THR MG . . 3.890 3.041 2.455 3.886 . 0 0 "[ . 1 . 2]" 1
1184 1 60 ASN QD 1 63 GLN H . . 4.260 3.101 1.799 4.190 . 0 0 "[ . 1 . 2]" 1
1185 1 60 ASN QD 1 63 GLN QB . . 4.720 2.718 1.847 3.760 . 0 0 "[ . 1 . 2]" 1
1186 1 60 ASN QD 1 63 GLN QG . . 3.430 2.216 1.840 2.761 . 0 0 "[ . 1 . 2]" 1
1187 1 60 ASN QD 1 70 THR MG . . 4.210 3.321 2.059 4.090 . 0 0 "[ . 1 . 2]" 1
1188 1 60 ASN HD21 1 63 GLN HG2 . . 4.490 3.292 2.134 4.293 . 0 0 "[ . 1 . 2]" 1
1189 1 60 ASN HD21 1 63 GLN HG3 . . 4.490 2.614 1.900 3.883 . 0 0 "[ . 1 . 2]" 1
1190 1 60 ASN HD22 1 63 GLN HG2 . . 4.490 3.472 2.091 4.499 0.009 2 0 "[ . 1 . 2]" 1
1191 1 60 ASN HD22 1 63 GLN HG3 . . 4.490 3.184 2.360 3.997 . 0 0 "[ . 1 . 2]" 1
1192 1 61 ARG H 1 61 ARG HB2 . . 3.660 2.603 2.170 3.591 . 0 0 "[ . 1 . 2]" 1
1193 1 61 ARG H 1 61 ARG QB . . 3.070 2.318 2.149 2.819 . 0 0 "[ . 1 . 2]" 1
1194 1 61 ARG H 1 61 ARG HB3 . . 3.660 3.297 2.453 3.664 0.004 18 0 "[ . 1 . 2]" 1
1195 1 61 ARG H 1 61 ARG HD2 . . 4.770 3.313 1.973 4.766 . 0 0 "[ . 1 . 2]" 1
1196 1 61 ARG H 1 61 ARG HD3 . . 4.770 2.613 1.853 4.712 . 0 0 "[ . 1 . 2]" 1
1197 1 61 ARG H 1 61 ARG HG2 . . 4.310 3.523 1.887 4.292 . 0 0 "[ . 1 . 2]" 1
1198 1 61 ARG H 1 61 ARG QG . . 3.600 3.082 1.877 3.589 . 0 0 "[ . 1 . 2]" 1
1199 1 61 ARG H 1 61 ARG HG3 . . 4.310 3.661 3.336 3.876 . 0 0 "[ . 1 . 2]" 1
1200 1 61 ARG H 1 62 LEU H . . 3.520 2.633 2.380 2.940 . 0 0 "[ . 1 . 2]" 1
1201 1 61 ARG H 1 63 GLN H . . 4.740 4.358 3.927 4.730 . 0 0 "[ . 1 . 2]" 1
1202 1 61 ARG HA 1 61 ARG HD2 . . 4.000 3.497 2.043 4.038 0.038 2 0 "[ . 1 . 2]" 1
1203 1 61 ARG HA 1 61 ARG QD . . 3.510 2.998 2.029 3.600 0.090 20 0 "[ . 1 . 2]" 1
1204 1 61 ARG HA 1 61 ARG HD3 . . 4.000 3.531 2.255 4.087 0.087 20 0 "[ . 1 . 2]" 1
1205 1 61 ARG HA 1 61 ARG QG . . 3.710 2.626 2.146 3.473 . 0 0 "[ . 1 . 2]" 1
1206 1 61 ARG HA 1 63 GLN H . . 4.550 4.196 3.432 4.553 0.003 13 0 "[ . 1 . 2]" 1
1207 1 61 ARG HA 1 64 SER H . . 4.090 3.347 2.939 4.026 . 0 0 "[ . 1 . 2]" 1
1208 1 61 ARG HA 1 64 SER HB2 . . 4.210 3.522 2.003 4.212 0.002 14 0 "[ . 1 . 2]" 1
1209 1 61 ARG HA 1 64 SER QB . . 3.590 2.565 1.964 3.450 . 0 0 "[ . 1 . 2]" 1
1210 1 61 ARG HA 1 64 SER HB3 . . 4.210 2.733 1.997 3.663 . 0 0 "[ . 1 . 2]" 1
1211 1 61 ARG QB 1 61 ARG QD . . 3.190 2.290 1.995 2.586 . 0 0 "[ . 1 . 2]" 1
1212 1 61 ARG QB 1 62 LEU H . . 3.860 2.957 2.422 3.827 . 0 0 "[ . 1 . 2]" 1
1213 1 61 ARG QB 1 62 LEU HA . . 4.610 4.004 3.760 4.522 . 0 0 "[ . 1 . 2]" 1
1214 1 61 ARG HD2 1 61 ARG QH1 . . 4.430 2.416 1.808 3.363 . 0 0 "[ . 1 . 2]" 1
1215 1 61 ARG HD3 1 61 ARG QH1 . . 4.430 2.376 1.769 3.433 . 0 0 "[ . 1 . 2]" 1
1216 1 61 ARG HE 1 61 ARG HG2 . . 3.830 2.850 2.194 3.974 0.144 19 0 "[ . 1 . 2]" 1
1217 1 61 ARG HE 1 61 ARG QG . . 3.360 2.471 2.155 3.019 . 0 0 "[ . 1 . 2]" 1
1218 1 61 ARG HE 1 61 ARG HG3 . . 3.830 3.093 2.216 3.735 . 0 0 "[ . 1 . 2]" 1
1219 1 62 LEU H 1 62 LEU QB . . 2.960 2.314 2.145 2.605 . 0 0 "[ . 1 . 2]" 1
1220 1 62 LEU H 1 62 LEU MD1 . . 4.290 3.237 1.864 3.961 . 0 0 "[ . 1 . 2]" 1
1221 1 62 LEU H 1 62 LEU QD . . 3.680 2.689 1.728 3.506 . 0 0 "[ . 1 . 2]" 1
1222 1 62 LEU H 1 62 LEU MD2 . . 4.290 3.447 1.740 4.133 . 0 0 "[ . 1 . 2]" 1
1223 1 62 LEU H 1 62 LEU HG . . 3.620 3.028 2.236 3.769 0.149 13 0 "[ . 1 . 2]" 1
1224 1 62 LEU H 1 63 GLN H . . 3.220 2.763 1.859 3.036 . 0 0 "[ . 1 . 2]" 1
1225 1 62 LEU H 1 64 SER H . . 4.250 4.142 3.432 4.245 . 0 0 "[ . 1 . 2]" 1
1226 1 62 LEU HA 1 62 LEU QD . . 3.380 2.368 1.975 3.334 . 0 0 "[ . 1 . 2]" 1
1227 1 62 LEU HA 1 62 LEU HG . . 4.000 2.912 2.266 3.765 . 0 0 "[ . 1 . 2]" 1
1228 1 62 LEU HA 1 64 SER H . . 5.120 4.804 3.996 5.111 . 0 0 "[ . 1 . 2]" 1
1229 1 62 LEU QB 1 62 LEU QD . . 2.650 1.889 1.751 2.004 . 0 0 "[ . 1 . 2]" 1
1230 1 62 LEU QB 1 63 GLN H . . 3.570 2.641 2.250 3.578 0.008 17 0 "[ . 1 . 2]" 1
1231 1 62 LEU HB2 1 63 GLN H . . 4.100 2.762 2.291 4.084 . 0 0 "[ . 1 . 2]" 1
1232 1 62 LEU HB2 1 63 GLN HG2 . . 5.500 3.946 3.211 4.948 . 0 0 "[ . 1 . 2]" 1
1233 1 62 LEU HB2 1 63 GLN HG3 . . 5.500 4.633 3.270 5.321 . 0 0 "[ . 1 . 2]" 1
1234 1 62 LEU HB3 1 63 GLN H . . 4.100 3.438 3.085 3.956 . 0 0 "[ . 1 . 2]" 1
1235 1 62 LEU HB3 1 63 GLN HG2 . . 5.500 3.982 3.120 5.310 . 0 0 "[ . 1 . 2]" 1
1236 1 62 LEU HB3 1 63 GLN HG3 . . 5.500 4.950 3.789 5.500 . 0 0 "[ . 1 . 2]" 1
1237 1 63 GLN H 1 63 GLN HB2 . . 3.760 2.384 2.191 2.603 . 0 0 "[ . 1 . 2]" 1
1238 1 63 GLN H 1 63 GLN QB . . 3.190 2.352 2.170 2.558 . 0 0 "[ . 1 . 2]" 1
1239 1 63 GLN H 1 63 GLN HB3 . . 3.760 3.599 3.491 3.757 . 0 0 "[ . 1 . 2]" 1
1240 1 63 GLN H 1 63 GLN HG2 . . 4.150 3.065 2.353 4.088 . 0 0 "[ . 1 . 2]" 1
1241 1 63 GLN H 1 63 GLN QG . . 3.630 2.735 2.330 3.238 . 0 0 "[ . 1 . 2]" 1
1242 1 63 GLN H 1 63 GLN HG3 . . 4.150 3.546 2.452 4.146 . 0 0 "[ . 1 . 2]" 1
1243 1 63 GLN H 1 64 SER H . . 3.080 2.410 1.911 2.742 . 0 0 "[ . 1 . 2]" 1
1244 1 63 GLN H 1 64 SER QB . . 4.950 4.191 3.708 4.728 . 0 0 "[ . 1 . 2]" 1
1245 1 63 GLN H 1 70 THR HB . . 5.500 4.261 3.720 4.790 . 0 0 "[ . 1 . 2]" 1
1246 1 63 GLN H 1 70 THR MG . . 5.290 4.842 4.300 5.271 . 0 0 "[ . 1 . 2]" 1
1247 1 63 GLN HA 1 63 GLN HG2 . . 3.750 2.654 2.252 3.171 . 0 0 "[ . 1 . 2]" 1
1248 1 63 GLN HA 1 63 GLN HG3 . . 3.750 3.544 2.937 3.764 0.014 6 0 "[ . 1 . 2]" 1
1249 1 63 GLN QB 1 64 SER H . . 3.960 2.677 2.386 3.833 . 0 0 "[ . 1 . 2]" 1
1250 1 63 GLN QB 1 70 THR HB . . 3.630 2.397 1.894 3.055 . 0 0 "[ . 1 . 2]" 1
1251 1 63 GLN QB 1 70 THR MG . . 3.540 2.771 2.329 3.070 . 0 0 "[ . 1 . 2]" 1
1252 1 63 GLN HB2 1 64 SER H . . 4.530 2.786 2.425 4.234 . 0 0 "[ . 1 . 2]" 1
1253 1 63 GLN HB2 1 70 THR HB . . 4.150 2.510 2.000 3.186 . 0 0 "[ . 1 . 2]" 1
1254 1 63 GLN HB2 1 70 THR MG . . 4.130 3.023 2.576 3.375 . 0 0 "[ . 1 . 2]" 1
1255 1 63 GLN HB3 1 64 SER H . . 4.530 3.570 3.243 4.389 . 0 0 "[ . 1 . 2]" 1
1256 1 63 GLN HB3 1 70 THR HB . . 4.150 3.132 2.341 3.923 . 0 0 "[ . 1 . 2]" 1
1257 1 63 GLN HB3 1 70 THR MG . . 4.130 3.269 2.533 3.825 . 0 0 "[ . 1 . 2]" 1
1258 1 63 GLN QE 1 70 THR MG . . 5.340 3.796 2.199 5.063 . 0 0 "[ . 1 . 2]" 1
1259 1 64 SER H 1 64 SER HB2 . . 3.590 3.073 2.263 3.589 . 0 0 "[ . 1 . 2]" 1
1260 1 64 SER H 1 64 SER QB . . 3.130 2.293 2.156 2.511 . 0 0 "[ . 1 . 2]" 1
1261 1 64 SER H 1 64 SER HB3 . . 3.590 2.501 2.177 3.596 0.006 7 0 "[ . 1 . 2]" 1
1262 1 64 SER H 1 65 ASN H . . 4.690 4.577 4.355 4.647 . 0 0 "[ . 1 . 2]" 1
1263 1 64 SER HA 1 65 ASN H . . 3.090 2.202 2.143 2.348 . 0 0 "[ . 1 . 2]" 1
1264 1 64 SER HA 1 68 THR HB . . 4.120 3.471 2.595 4.119 . 0 0 "[ . 1 . 2]" 1
1265 1 64 SER HA 1 68 THR MG . . 4.640 2.997 1.979 3.609 . 0 0 "[ . 1 . 2]" 1
1266 1 64 SER HA 1 69 LEU H . . 5.430 4.507 4.084 5.167 . 0 0 "[ . 1 . 2]" 1
1267 1 64 SER HA 1 69 LEU MD2 . . 4.610 3.979 3.443 4.471 . 0 0 "[ . 1 . 2]" 1
1268 1 64 SER HA 1 70 THR H . . 4.190 2.719 2.244 3.758 . 0 0 "[ . 1 . 2]" 1
1269 1 64 SER QB 1 65 ASN H . . 3.790 3.288 2.693 3.789 . 0 0 "[ . 1 . 2]" 1
1270 1 64 SER QB 1 69 LEU HA . . 3.870 2.525 1.959 3.508 . 0 0 "[ . 1 . 2]" 1
1271 1 64 SER QB 1 69 LEU MD2 . . 3.350 2.487 1.942 3.274 . 0 0 "[ . 1 . 2]" 1
1272 1 64 SER QB 1 70 THR H . . 3.890 2.426 1.946 3.675 . 0 0 "[ . 1 . 2]" 1
1273 1 64 SER HB2 1 65 ASN H . . 4.330 3.597 2.734 4.265 . 0 0 "[ . 1 . 2]" 1
1274 1 64 SER HB2 1 69 LEU HA . . 4.440 2.650 1.992 4.295 . 0 0 "[ . 1 . 2]" 1
1275 1 64 SER HB2 1 69 LEU MD2 . . 3.930 2.647 1.977 3.505 . 0 0 "[ . 1 . 2]" 1
1276 1 64 SER HB2 1 70 THR H . . 4.740 2.713 2.077 4.428 . 0 0 "[ . 1 . 2]" 1
1277 1 64 SER HB3 1 65 ASN H . . 4.330 4.095 3.284 4.331 0.001 8 0 "[ . 1 . 2]" 1
1278 1 64 SER HB3 1 69 LEU HA . . 4.440 3.641 2.685 4.438 . 0 0 "[ . 1 . 2]" 1
1279 1 64 SER HB3 1 69 LEU MD2 . . 3.930 3.355 2.026 3.927 . 0 0 "[ . 1 . 2]" 1
1280 1 64 SER HB3 1 70 THR H . . 4.740 3.253 2.107 4.411 . 0 0 "[ . 1 . 2]" 1
1281 1 65 ASN H 1 67 VAL H . . 4.470 4.232 4.031 4.458 . 0 0 "[ . 1 . 2]" 1
1282 1 65 ASN H 1 68 THR H . . 3.720 2.934 2.741 3.215 . 0 0 "[ . 1 . 2]" 1
1283 1 65 ASN H 1 68 THR HB . . 3.890 2.310 1.917 3.071 . 0 0 "[ . 1 . 2]" 1
1284 1 65 ASN H 1 68 THR MG . . 4.520 3.241 2.858 4.134 . 0 0 "[ . 1 . 2]" 1
1285 1 65 ASN H 1 69 LEU HA . . 4.490 3.664 3.135 4.390 . 0 0 "[ . 1 . 2]" 1
1286 1 65 ASN H 1 69 LEU MD2 . . 4.730 4.253 4.005 4.587 . 0 0 "[ . 1 . 2]" 1
1287 1 65 ASN HA 1 65 ASN QD . . 4.580 4.001 3.807 4.214 . 0 0 "[ . 1 . 2]" 1
1288 1 65 ASN QB 1 66 GLU H . . 3.230 2.688 1.962 3.137 . 0 0 "[ . 1 . 2]" 1
1289 1 65 ASN HB2 1 66 GLU H . . 3.920 3.432 1.972 3.827 . 0 0 "[ . 1 . 2]" 1
1290 1 65 ASN HB3 1 66 GLU H . . 3.920 2.930 2.068 3.603 . 0 0 "[ . 1 . 2]" 1
1291 1 65 ASN QD 1 66 GLU H . . 4.820 3.391 2.128 4.750 . 0 0 "[ . 1 . 2]" 1
1292 1 65 ASN QD 1 67 VAL MG2 . . 4.090 2.661 1.786 3.287 . 0 0 "[ . 1 . 2]" 1
1293 1 65 ASN QD 1 68 THR HB . . 4.170 3.603 2.130 4.144 . 0 0 "[ . 1 . 2]" 1
1294 1 65 ASN QD 1 68 THR MG . . 5.340 4.564 2.941 5.249 . 0 0 "[ . 1 . 2]" 1
1295 1 65 ASN HD21 1 67 VAL MG2 . . 4.680 2.813 1.808 4.075 . 0 0 "[ . 1 . 2]" 1
1296 1 65 ASN HD22 1 67 VAL MG2 . . 4.680 3.720 2.776 4.681 0.001 5 0 "[ . 1 . 2]" 1
1297 1 66 GLU H 1 66 GLU QB . . 3.430 2.253 2.127 2.566 . 0 0 "[ . 1 . 2]" 1
1298 1 66 GLU H 1 66 GLU QG . . 4.000 3.551 2.215 4.041 0.041 9 0 "[ . 1 . 2]" 1
1299 1 66 GLU H 1 67 VAL H . . 3.730 2.663 2.202 2.867 . 0 0 "[ . 1 . 2]" 1
1300 1 66 GLU H 1 68 THR H . . 4.550 4.026 3.005 4.342 . 0 0 "[ . 1 . 2]" 1
1301 1 66 GLU HA 1 66 GLU QG . . 3.790 2.747 2.172 3.402 . 0 0 "[ . 1 . 2]" 1
1302 1 66 GLU QB 1 67 VAL H . . 4.110 3.083 2.303 3.741 . 0 0 "[ . 1 . 2]" 1
1303 1 66 GLU QB 1 67 VAL MG1 . . 4.040 3.109 2.463 3.784 . 0 0 "[ . 1 . 2]" 1
1304 1 66 GLU QG 1 67 VAL H . . 4.420 3.558 2.333 4.320 . 0 0 "[ . 1 . 2]" 1
1305 1 66 GLU QG 1 67 VAL MG1 . . 3.600 2.682 1.886 3.554 . 0 0 "[ . 1 . 2]" 1
1306 1 67 VAL H 1 67 VAL MG1 . . 3.710 2.973 2.707 3.249 . 0 0 "[ . 1 . 2]" 1
1307 1 67 VAL H 1 67 VAL MG2 . . 3.170 2.159 1.895 2.333 . 0 0 "[ . 1 . 2]" 1
1308 1 67 VAL H 1 68 THR HB . . 4.430 4.071 3.913 4.379 . 0 0 "[ . 1 . 2]" 1
1309 1 67 VAL HA 1 67 VAL MG1 . . 3.560 2.271 2.126 2.490 . 0 0 "[ . 1 . 2]" 1
1310 1 67 VAL HB 1 68 THR H . . 4.870 4.358 4.024 4.494 . 0 0 "[ . 1 . 2]" 1
1311 1 67 VAL MG2 1 68 THR H . . 3.630 3.216 2.298 3.558 . 0 0 "[ . 1 . 2]" 1
1312 1 67 VAL MG2 1 68 THR HA . . 5.120 4.147 3.710 4.475 . 0 0 "[ . 1 . 2]" 1
1313 1 67 VAL MG2 1 68 THR HB . . 4.130 3.820 3.373 4.079 . 0 0 "[ . 1 . 2]" 1
1314 1 68 THR H 1 68 THR HB . . 3.450 2.893 2.589 3.117 . 0 0 "[ . 1 . 2]" 1
1315 1 68 THR H 1 68 THR MG . . 4.240 3.939 3.816 4.030 . 0 0 "[ . 1 . 2]" 1
1316 1 68 THR H 1 69 LEU H . . 4.840 4.297 4.043 4.506 . 0 0 "[ . 1 . 2]" 1
1317 1 68 THR HA 1 68 THR MG . . 3.400 2.356 2.257 2.444 . 0 0 "[ . 1 . 2]" 1
1318 1 68 THR HA 1 69 LEU H . . 3.040 2.217 2.142 2.329 . 0 0 "[ . 1 . 2]" 1
1319 1 68 THR HA 1 69 LEU HB2 . . 4.930 4.175 4.099 4.285 . 0 0 "[ . 1 . 2]" 1
1320 1 68 THR HA 1 69 LEU HG . . 5.440 4.498 4.356 4.689 . 0 0 "[ . 1 . 2]" 1
1321 1 68 THR HB 1 69 LEU H . . 4.630 3.980 3.781 4.335 . 0 0 "[ . 1 . 2]" 1
1322 1 68 THR MG 1 69 LEU H . . 3.600 2.192 1.897 2.610 . 0 0 "[ . 1 . 2]" 1
1323 1 69 LEU H 1 69 LEU HB2 . . 3.800 2.549 2.370 2.688 . 0 0 "[ . 1 . 2]" 1
1324 1 69 LEU H 1 69 LEU HB3 . . 4.180 3.637 3.553 3.697 . 0 0 "[ . 1 . 2]" 1
1325 1 69 LEU H 1 69 LEU HG . . 4.870 3.725 3.520 3.873 . 0 0 "[ . 1 . 2]" 1
1326 1 69 LEU H 1 70 THR H . . 4.840 4.020 3.901 4.334 . 0 0 "[ . 1 . 2]" 1
1327 1 69 LEU HA 1 69 LEU MD1 . . 4.550 3.807 3.751 3.837 . 0 0 "[ . 1 . 2]" 1
1328 1 69 LEU HA 1 69 LEU MD2 . . 3.540 2.049 1.952 2.269 . 0 0 "[ . 1 . 2]" 1
1329 1 69 LEU HA 1 70 THR H . . 3.170 2.165 2.151 2.179 . 0 0 "[ . 1 . 2]" 1
1330 1 69 LEU HA 1 70 THR HB . . 4.840 4.709 4.589 4.793 . 0 0 "[ . 1 . 2]" 1
1331 1 69 LEU HB2 1 69 LEU MD1 . . 3.590 2.265 2.134 2.450 . 0 0 "[ . 1 . 2]" 1
1332 1 69 LEU HB2 1 70 THR H . . 4.740 4.525 4.312 4.562 . 0 0 "[ . 1 . 2]" 1
1333 1 69 LEU HB3 1 69 LEU MD1 . . 3.550 2.395 2.167 2.531 . 0 0 "[ . 1 . 2]" 1
1334 1 69 LEU HB3 1 70 THR H . . 3.920 3.743 3.211 3.854 . 0 0 "[ . 1 . 2]" 1
1335 1 69 LEU MD1 1 91 VAL MG1 . . 3.340 2.476 2.094 2.944 . 0 0 "[ . 1 . 2]" 1
1336 1 69 LEU MD1 1 91 VAL MG2 . . 3.620 2.481 2.092 3.079 . 0 0 "[ . 1 . 2]" 1
1337 1 69 LEU MD2 1 70 THR H . . 4.110 3.283 2.763 3.458 . 0 0 "[ . 1 . 2]" 1
1338 1 69 LEU MD2 1 91 VAL MG1 . . 4.740 3.814 3.374 4.196 . 0 0 "[ . 1 . 2]" 1
1339 1 70 THR H 1 70 THR HB . . 3.470 2.583 2.483 2.691 . 0 0 "[ . 1 . 2]" 1
1340 1 70 THR H 1 70 THR MG . . 4.200 3.826 3.783 3.882 . 0 0 "[ . 1 . 2]" 1
1341 1 70 THR H 1 71 LEU H . . 4.600 4.393 4.254 4.516 . 0 0 "[ . 1 . 2]" 1
1342 1 70 THR H 1 71 LEU MD2 . . 5.500 4.438 4.091 4.816 . 0 0 "[ . 1 . 2]" 1
1343 1 70 THR HA 1 70 THR MG . . 3.490 2.336 2.226 2.430 . 0 0 "[ . 1 . 2]" 1
1344 1 70 THR HA 1 71 LEU H . . 3.090 2.148 2.141 2.181 . 0 0 "[ . 1 . 2]" 1
1345 1 70 THR HA 1 71 LEU MD2 . . 4.250 3.179 2.880 3.486 . 0 0 "[ . 1 . 2]" 1
1346 1 70 THR HB 1 71 LEU H . . 4.790 4.224 4.036 4.361 . 0 0 "[ . 1 . 2]" 1
1347 1 70 THR MG 1 71 LEU H . . 3.610 2.618 2.155 2.938 . 0 0 "[ . 1 . 2]" 1
1348 1 71 LEU H 1 71 LEU MD2 . . 3.550 2.157 1.878 2.412 . 0 0 "[ . 1 . 2]" 1
1349 1 71 LEU H 1 71 LEU HG . . 3.470 3.194 2.943 3.444 . 0 0 "[ . 1 . 2]" 1
1350 1 71 LEU H 1 72 THR H . . 4.950 4.414 4.404 4.437 . 0 0 "[ . 1 . 2]" 1
1351 1 71 LEU HA 1 71 LEU MD1 . . 4.590 4.038 3.971 4.084 . 0 0 "[ . 1 . 2]" 1
1352 1 71 LEU HA 1 71 LEU MD2 . . 4.770 3.618 3.537 3.744 . 0 0 "[ . 1 . 2]" 1
1353 1 71 LEU HA 1 72 THR H . . 3.160 2.470 2.351 2.520 . 0 0 "[ . 1 . 2]" 1
1354 1 71 LEU HA 1 72 THR HB . . 5.100 4.825 4.726 4.898 . 0 0 "[ . 1 . 2]" 1
1355 1 71 LEU HB2 1 71 LEU MD1 . . 3.090 2.119 1.985 2.272 . 0 0 "[ . 1 . 2]" 1
1356 1 71 LEU HB2 1 72 THR H . . 3.290 2.372 2.254 2.546 . 0 0 "[ . 1 . 2]" 1
1357 1 71 LEU HB3 1 71 LEU MD1 . . 3.600 2.583 2.473 2.685 . 0 0 "[ . 1 . 2]" 1
1358 1 71 LEU HB3 1 72 THR H . . 3.840 3.798 3.718 3.842 0.002 3 0 "[ . 1 . 2]" 1
1359 1 71 LEU MD1 1 72 THR H . . 3.990 3.573 3.264 3.960 . 0 0 "[ . 1 . 2]" 1
1360 1 71 LEU MD1 1 73 VAL HA . . 4.300 3.637 3.342 4.047 . 0 0 "[ . 1 . 2]" 1
1361 1 72 THR H 1 72 THR HB . . 3.250 2.622 2.544 2.701 . 0 0 "[ . 1 . 2]" 1
1362 1 72 THR H 1 72 THR MG . . 4.080 3.842 3.800 3.876 . 0 0 "[ . 1 . 2]" 1
1363 1 72 THR H 1 73 VAL H . . 4.770 4.281 4.161 4.456 . 0 0 "[ . 1 . 2]" 1
1364 1 72 THR HA 1 72 THR MG . . 3.370 2.342 2.222 2.440 . 0 0 "[ . 1 . 2]" 1
1365 1 72 THR HA 1 73 VAL H . . 3.160 2.157 2.141 2.178 . 0 0 "[ . 1 . 2]" 1
1366 1 72 THR HB 1 73 VAL H . . 4.600 4.288 4.033 4.419 . 0 0 "[ . 1 . 2]" 1
1367 1 72 THR MG 1 73 VAL H . . 3.600 2.880 2.336 3.197 . 0 0 "[ . 1 . 2]" 1
1368 1 73 VAL H 1 73 VAL HB . . 3.340 2.681 2.561 2.814 . 0 0 "[ . 1 . 2]" 1
1369 1 73 VAL H 1 73 VAL MG1 . . 4.100 3.766 3.740 3.780 . 0 0 "[ . 1 . 2]" 1
1370 1 73 VAL H 1 73 VAL MG2 . . 3.210 1.999 1.871 2.216 . 0 0 "[ . 1 . 2]" 1
1371 1 73 VAL H 1 74 PRO QD . . 5.350 4.184 4.078 4.273 . 0 0 "[ . 1 . 2]" 1
1372 1 73 VAL HA 1 73 VAL MG1 . . 3.610 2.361 2.195 2.464 . 0 0 "[ . 1 . 2]" 1
1373 1 73 VAL HA 1 73 VAL MG2 . . 3.480 2.374 2.254 2.471 . 0 0 "[ . 1 . 2]" 1
1374 1 73 VAL HA 1 74 PRO HD2 . . 3.440 2.048 1.964 2.167 . 0 0 "[ . 1 . 2]" 1
1375 1 73 VAL HA 1 74 PRO HD3 . . 3.440 2.285 2.253 2.339 . 0 0 "[ . 1 . 2]" 1
1376 1 73 VAL HA 1 74 PRO QG . . 3.990 3.810 3.774 3.867 . 0 0 "[ . 1 . 2]" 1
1377 1 73 VAL HB 1 74 PRO QD . . 5.340 3.965 3.773 4.107 . 0 0 "[ . 1 . 2]" 1
1378 1 73 VAL MG1 1 74 PRO HD2 . . 3.910 1.989 1.818 2.237 . 0 0 "[ . 1 . 2]" 1
1379 1 73 VAL MG1 1 74 PRO QD . . 3.250 1.975 1.807 2.217 . 0 0 "[ . 1 . 2]" 1
1380 1 73 VAL MG1 1 74 PRO HD3 . . 3.910 3.369 3.149 3.631 . 0 0 "[ . 1 . 2]" 1
1381 1 73 VAL MG1 1 104 PHE QE . . 3.940 3.215 2.612 3.788 . 0 0 "[ . 1 . 2]" 1
1382 1 73 VAL MG1 1 104 PHE HZ . . 4.030 3.920 3.500 4.042 0.012 19 0 "[ . 1 . 2]" 1
1383 1 73 VAL MG1 1 106 PHE QD . . 4.080 3.668 3.186 4.085 0.005 18 0 "[ . 1 . 2]" 1
1384 1 73 VAL MG1 1 106 PHE QE . . 3.540 2.347 1.929 2.808 . 0 0 "[ . 1 . 2]" 1
1385 1 73 VAL MG1 1 106 PHE HZ . . 3.860 3.377 2.666 3.827 . 0 0 "[ . 1 . 2]" 1
1386 1 73 VAL MG2 1 74 PRO HD2 . . 4.560 3.554 3.367 3.800 . 0 0 "[ . 1 . 2]" 1
1387 1 73 VAL MG2 1 74 PRO HD3 . . 4.560 4.244 4.124 4.382 . 0 0 "[ . 1 . 2]" 1
1388 1 73 VAL MG2 1 104 PHE QE . . 4.230 3.779 3.098 4.249 0.019 19 0 "[ . 1 . 2]" 1
1389 1 73 VAL MG2 1 104 PHE HZ . . 3.740 3.457 2.771 3.737 . 0 0 "[ . 1 . 2]" 1
1390 1 74 PRO HA 1 75 GLU H . . 2.930 2.436 2.306 2.631 . 0 0 "[ . 1 . 2]" 1
1391 1 74 PRO HB2 1 75 GLU H . . 3.130 2.535 2.090 2.870 . 0 0 "[ . 1 . 2]" 1
1392 1 74 PRO HB3 1 75 GLU H . . 3.570 3.419 3.216 3.592 0.022 19 0 "[ . 1 . 2]" 1
1393 1 75 GLU H 1 75 GLU HB2 . . 3.830 2.642 2.184 3.830 0.000 9 0 "[ . 1 . 2]" 1
1394 1 75 GLU H 1 75 GLU QB . . 3.250 2.327 2.163 2.810 . 0 0 "[ . 1 . 2]" 1
1395 1 75 GLU H 1 75 GLU HB3 . . 3.830 3.238 2.261 3.625 . 0 0 "[ . 1 . 2]" 1
1396 1 75 GLU H 1 75 GLU QG . . 3.760 3.221 2.407 3.826 0.066 15 0 "[ . 1 . 2]" 1
1397 1 75 GLU HA 1 75 GLU HG2 . . 4.080 3.241 2.555 3.686 . 0 0 "[ . 1 . 2]" 1
1398 1 75 GLU HA 1 75 GLU QG . . 3.480 2.481 2.140 3.307 . 0 0 "[ . 1 . 2]" 1
1399 1 75 GLU HA 1 75 GLU HG3 . . 4.080 2.645 2.161 3.767 . 0 0 "[ . 1 . 2]" 1
1400 1 75 GLU HA 1 76 TYR H . . 2.990 2.167 2.138 2.300 . 0 0 "[ . 1 . 2]" 1
1401 1 75 GLU HA 1 76 TYR HB2 . . 4.950 4.434 4.335 4.563 . 0 0 "[ . 1 . 2]" 1
1402 1 75 GLU HA 1 76 TYR QB . . 4.230 4.075 4.054 4.089 . 0 0 "[ . 1 . 2]" 1
1403 1 75 GLU HA 1 76 TYR HB3 . . 4.950 4.761 4.614 4.903 . 0 0 "[ . 1 . 2]" 1
1404 1 75 GLU QB 1 76 TYR H . . 3.870 3.302 2.647 3.794 . 0 0 "[ . 1 . 2]" 1
1405 1 75 GLU HB2 1 76 TYR H . . 4.440 4.159 3.581 4.452 0.012 16 0 "[ . 1 . 2]" 1
1406 1 75 GLU HB3 1 76 TYR H . . 4.440 3.609 2.692 4.478 0.038 18 0 "[ . 1 . 2]" 1
1407 1 75 GLU QG 1 76 TYR H . . 4.140 3.653 2.611 4.131 . 0 0 "[ . 1 . 2]" 1
1408 1 75 GLU QG 1 79 LYS QE . . 4.140 2.967 1.975 4.121 . 0 0 "[ . 1 . 2]" 1
1409 1 75 GLU HG2 1 76 TYR H . . 4.770 4.389 3.878 4.772 0.002 5 0 "[ . 1 . 2]" 1
1410 1 75 GLU HG2 1 79 LYS QE . . 4.820 3.452 1.989 4.870 0.050 9 0 "[ . 1 . 2]" 1
1411 1 75 GLU HG3 1 76 TYR H . . 4.770 4.036 2.654 4.760 . 0 0 "[ . 1 . 2]" 1
1412 1 75 GLU HG3 1 79 LYS QE . . 4.820 3.741 2.649 4.800 . 0 0 "[ . 1 . 2]" 1
1413 1 76 TYR H 1 76 TYR HB2 . . 3.560 2.446 2.241 2.628 . 0 0 "[ . 1 . 2]" 1
1414 1 76 TYR H 1 76 TYR HB3 . . 3.560 2.654 2.526 2.883 . 0 0 "[ . 1 . 2]" 1
1415 1 76 TYR HA 1 76 TYR QD . . 3.680 2.085 1.996 2.424 . 0 0 "[ . 1 . 2]" 1
1416 1 76 TYR QB 1 106 PHE QD . . 4.240 3.092 2.401 3.946 . 0 0 "[ . 1 . 2]" 1
1417 1 76 TYR QD 1 81 VAL MG1 . . 4.590 4.037 3.368 4.592 0.002 19 0 "[ . 1 . 2]" 1
1418 1 76 TYR QD 1 85 VAL MG2 . . 4.800 3.459 2.862 4.081 . 0 0 "[ . 1 . 2]" 1
1419 1 76 TYR QE 1 78 ASN H . . 4.560 3.375 2.733 4.457 . 0 0 "[ . 1 . 2]" 1
1420 1 76 TYR QE 1 78 ASN HB2 . . 4.260 3.319 2.099 4.190 . 0 0 "[ . 1 . 2]" 1
1421 1 76 TYR QE 1 78 ASN QB . . 3.550 2.482 1.998 3.069 . 0 0 "[ . 1 . 2]" 1
1422 1 76 TYR QE 1 78 ASN HB3 . . 4.260 2.809 2.022 3.672 . 0 0 "[ . 1 . 2]" 1
1423 1 76 TYR QE 1 81 VAL MG1 . . 3.530 3.129 2.343 3.524 . 0 0 "[ . 1 . 2]" 1
1424 1 76 TYR QE 1 81 VAL MG2 . . 4.150 3.355 2.647 4.070 . 0 0 "[ . 1 . 2]" 1
1425 1 76 TYR QE 1 85 VAL MG1 . . 4.080 2.950 2.507 3.591 . 0 0 "[ . 1 . 2]" 1
1426 1 76 TYR QE 1 85 VAL MG2 . . 3.900 2.264 1.908 3.015 . 0 0 "[ . 1 . 2]" 1
1427 1 76 TYR QE 1 87 VAL MG1 . . 4.290 2.733 2.064 3.317 . 0 0 "[ . 1 . 2]" 1
1428 1 77 SER QB 1 78 ASN H . . 4.200 2.611 1.926 3.838 . 0 0 "[ . 1 . 2]" 1
1429 1 77 SER HB2 1 78 ASN H . . 4.820 3.653 2.404 4.550 . 0 0 "[ . 1 . 2]" 1
1430 1 77 SER HB3 1 78 ASN H . . 4.820 2.795 1.938 4.135 . 0 0 "[ . 1 . 2]" 1
1431 1 78 ASN H 1 78 ASN HB2 . . 4.110 2.505 2.186 3.251 . 0 0 "[ . 1 . 2]" 1
1432 1 78 ASN H 1 78 ASN HB3 . . 4.110 3.045 2.524 3.615 . 0 0 "[ . 1 . 2]" 1
1433 1 78 ASN H 1 79 LYS H . . 4.430 4.039 3.231 4.455 0.025 3 0 "[ . 1 . 2]" 1
1434 1 78 ASN HA 1 79 LYS H . . 3.230 2.257 2.139 2.760 . 0 0 "[ . 1 . 2]" 1
1435 1 78 ASN HA 1 80 ARG H . . 4.280 3.622 3.026 3.935 . 0 0 "[ . 1 . 2]" 1
1436 1 78 ASN QB 1 78 ASN QD . . 3.070 2.191 2.064 2.539 . 0 0 "[ . 1 . 2]" 1
1437 1 78 ASN QB 1 79 LYS H . . 4.060 3.854 3.318 3.997 . 0 0 "[ . 1 . 2]" 1
1438 1 78 ASN QB 1 81 VAL MG1 . . 3.600 2.246 1.859 2.968 . 0 0 "[ . 1 . 2]" 1
1439 1 78 ASN HB2 1 79 LYS H . . 4.650 4.566 4.314 4.662 0.012 20 0 "[ . 1 . 2]" 1
1440 1 78 ASN HB2 1 81 VAL MG1 . . 4.300 3.484 2.492 4.274 . 0 0 "[ . 1 . 2]" 1
1441 1 78 ASN HB3 1 79 LYS H . . 4.650 4.162 3.449 4.411 . 0 0 "[ . 1 . 2]" 1
1442 1 78 ASN HB3 1 81 VAL MG1 . . 4.300 2.278 1.876 3.044 . 0 0 "[ . 1 . 2]" 1
1443 1 78 ASN HD21 1 81 VAL MG1 . . 4.170 2.982 2.289 4.169 . 0 0 "[ . 1 . 2]" 1
1444 1 78 ASN HD22 1 81 VAL MG1 . . 4.170 3.287 2.333 4.171 0.001 18 0 "[ . 1 . 2]" 1
1445 1 79 LYS H 1 79 LYS HB2 . . 4.000 2.389 2.199 2.742 . 0 0 "[ . 1 . 2]" 1
1446 1 79 LYS H 1 79 LYS QB . . 3.280 2.356 2.177 2.685 . 0 0 "[ . 1 . 2]" 1
1447 1 79 LYS H 1 79 LYS HB3 . . 4.000 3.608 3.489 3.829 . 0 0 "[ . 1 . 2]" 1
1448 1 79 LYS H 1 79 LYS QE . . 5.500 4.759 4.167 5.270 . 0 0 "[ . 1 . 2]" 1
1449 1 79 LYS H 1 79 LYS HG2 . . 4.010 3.576 2.794 4.060 0.050 12 0 "[ . 1 . 2]" 1
1450 1 79 LYS H 1 79 LYS HG3 . . 4.010 2.995 2.444 4.011 0.001 3 0 "[ . 1 . 2]" 1
1451 1 79 LYS H 1 80 ARG H . . 3.380 2.362 2.010 2.946 . 0 0 "[ . 1 . 2]" 1
1452 1 79 LYS HA 1 79 LYS HD2 . . 4.560 4.089 2.441 4.605 0.045 12 0 "[ . 1 . 2]" 1
1453 1 79 LYS HA 1 79 LYS QD . . 4.010 3.608 2.405 4.021 0.011 15 0 "[ . 1 . 2]" 1
1454 1 79 LYS HA 1 79 LYS HD3 . . 4.560 4.154 3.592 4.543 . 0 0 "[ . 1 . 2]" 1
1455 1 79 LYS HA 1 79 LYS HG2 . . 4.080 2.405 2.168 2.772 . 0 0 "[ . 1 . 2]" 1
1456 1 79 LYS HA 1 79 LYS QG . . 3.570 2.327 2.131 2.556 . 0 0 "[ . 1 . 2]" 1
1457 1 79 LYS HA 1 79 LYS HG3 . . 4.080 3.250 2.435 3.720 . 0 0 "[ . 1 . 2]" 1
1458 1 79 LYS HA 1 81 VAL MG2 . . 4.100 2.921 2.578 3.632 . 0 0 "[ . 1 . 2]" 1
1459 1 79 LYS QB 1 79 LYS QD . . 2.860 2.162 2.051 2.443 . 0 0 "[ . 1 . 2]" 1
1460 1 79 LYS QB 1 79 LYS QE . . 3.770 3.044 1.990 3.657 . 0 0 "[ . 1 . 2]" 1
1461 1 79 LYS QB 1 80 ARG H . . 4.060 2.792 2.439 3.794 . 0 0 "[ . 1 . 2]" 1
1462 1 79 LYS HB2 1 79 LYS QE . . 4.550 3.522 2.414 4.168 . 0 0 "[ . 1 . 2]" 1
1463 1 79 LYS HB2 1 80 ARG H . . 4.830 2.911 2.488 4.120 . 0 0 "[ . 1 . 2]" 1
1464 1 79 LYS HB3 1 79 LYS QE . . 4.550 3.480 2.015 4.149 . 0 0 "[ . 1 . 2]" 1
1465 1 79 LYS HB3 1 80 ARG H . . 4.830 3.677 3.203 4.483 . 0 0 "[ . 1 . 2]" 1
1466 1 79 LYS QE 1 79 LYS HG2 . . 3.780 2.921 2.167 3.456 . 0 0 "[ . 1 . 2]" 1
1467 1 79 LYS QE 1 79 LYS QG . . 3.320 2.203 2.004 2.524 . 0 0 "[ . 1 . 2]" 1
1468 1 79 LYS QE 1 79 LYS HG3 . . 3.780 2.390 2.059 3.330 . 0 0 "[ . 1 . 2]" 1
1469 1 80 ARG H 1 80 ARG HB2 . . 3.660 2.878 2.249 3.620 . 0 0 "[ . 1 . 2]" 1
1470 1 80 ARG H 1 80 ARG QB . . 3.080 2.485 2.225 2.672 . 0 0 "[ . 1 . 2]" 1
1471 1 80 ARG H 1 80 ARG HB3 . . 3.660 3.273 2.469 3.701 0.041 20 0 "[ . 1 . 2]" 1
1472 1 80 ARG H 1 80 ARG QD . . 4.440 3.986 3.527 4.446 0.006 20 0 "[ . 1 . 2]" 1
1473 1 80 ARG H 1 80 ARG HG2 . . 3.930 2.723 1.903 3.943 0.013 20 0 "[ . 1 . 2]" 1
1474 1 80 ARG H 1 80 ARG QG . . 3.340 2.332 1.889 3.011 . 0 0 "[ . 1 . 2]" 1
1475 1 80 ARG H 1 80 ARG HG3 . . 3.930 3.097 2.010 3.632 . 0 0 "[ . 1 . 2]" 1
1476 1 80 ARG H 1 81 VAL H . . 3.470 3.111 1.996 3.472 0.002 13 0 "[ . 1 . 2]" 1
1477 1 80 ARG H 1 81 VAL MG1 . . 4.520 4.001 3.376 4.488 . 0 0 "[ . 1 . 2]" 1
1478 1 80 ARG H 1 81 VAL MG2 . . 4.500 4.004 3.286 4.424 . 0 0 "[ . 1 . 2]" 1
1479 1 80 ARG HA 1 80 ARG QD . . 4.430 3.712 2.050 4.422 . 0 0 "[ . 1 . 2]" 1
1480 1 80 ARG HA 1 80 ARG HG2 . . 3.920 2.959 2.232 3.839 . 0 0 "[ . 1 . 2]" 1
1481 1 80 ARG HA 1 80 ARG QG . . 3.420 2.772 2.190 3.344 . 0 0 "[ . 1 . 2]" 1
1482 1 80 ARG HA 1 80 ARG HG3 . . 3.920 3.524 2.795 3.839 . 0 0 "[ . 1 . 2]" 1
1483 1 80 ARG QB 1 80 ARG QD . . 3.150 2.202 2.087 2.652 . 0 0 "[ . 1 . 2]" 1
1484 1 80 ARG QB 1 81 VAL H . . 4.280 3.409 2.521 4.029 . 0 0 "[ . 1 . 2]" 1
1485 1 80 ARG HB2 1 80 ARG QD . . 3.840 2.735 2.178 3.498 . 0 0 "[ . 1 . 2]" 1
1486 1 80 ARG HB2 1 81 VAL H . . 4.920 3.692 2.592 4.416 . 0 0 "[ . 1 . 2]" 1
1487 1 80 ARG HB3 1 80 ARG QD . . 3.840 2.434 2.118 2.934 . 0 0 "[ . 1 . 2]" 1
1488 1 80 ARG HB3 1 81 VAL H . . 4.920 4.100 3.422 4.652 . 0 0 "[ . 1 . 2]" 1
1489 1 81 VAL H 1 81 VAL HB . . 4.020 3.666 3.610 3.767 . 0 0 "[ . 1 . 2]" 1
1490 1 81 VAL H 1 81 VAL MG1 . . 3.430 2.485 1.929 3.020 . 0 0 "[ . 1 . 2]" 1
1491 1 81 VAL H 1 81 VAL MG2 . . 3.330 2.114 1.861 2.395 . 0 0 "[ . 1 . 2]" 1
1492 1 81 VAL H 1 82 SER H . . 4.850 4.522 4.381 4.629 . 0 0 "[ . 1 . 2]" 1
1493 1 81 VAL HA 1 81 VAL MG1 . . 3.270 2.329 2.225 2.404 . 0 0 "[ . 1 . 2]" 1
1494 1 81 VAL HA 1 81 VAL MG2 . . 3.680 3.198 3.177 3.203 . 0 0 "[ . 1 . 2]" 1
1495 1 81 VAL HA 1 82 SER H . . 2.970 2.190 2.150 2.250 . 0 0 "[ . 1 . 2]" 1
1496 1 81 VAL HA 1 82 SER HA . . 4.690 4.362 4.346 4.387 . 0 0 "[ . 1 . 2]" 1
1497 1 81 VAL HA 1 83 ARG H . . 3.790 3.705 3.536 3.801 0.011 4 0 "[ . 1 . 2]" 1
1498 1 81 VAL HB 1 82 SER H . . 3.550 3.044 2.792 3.270 . 0 0 "[ . 1 . 2]" 1
1499 1 81 VAL HB 1 83 ARG H . . 3.420 2.555 2.216 2.767 . 0 0 "[ . 1 . 2]" 1
1500 1 81 VAL HB 1 85 VAL MG2 . . 4.130 3.661 3.312 3.997 . 0 0 "[ . 1 . 2]" 1
1501 1 81 VAL MG1 1 82 SER H . . 4.050 3.832 3.531 4.009 . 0 0 "[ . 1 . 2]" 1
1502 1 81 VAL MG1 1 83 ARG H . . 4.280 4.117 3.811 4.272 . 0 0 "[ . 1 . 2]" 1
1503 1 81 VAL MG1 1 85 VAL MG2 . . 3.490 3.048 2.588 3.445 . 0 0 "[ . 1 . 2]" 1
1504 1 81 VAL MG2 1 82 SER H . . 3.990 3.912 3.652 4.004 0.014 4 0 "[ . 1 . 2]" 1
1505 1 81 VAL MG2 1 83 ARG H . . 3.630 3.321 2.879 3.616 . 0 0 "[ . 1 . 2]" 1
1506 1 81 VAL MG2 1 85 VAL MG2 . . 3.310 2.446 1.967 2.989 . 0 0 "[ . 1 . 2]" 1
1507 1 82 SER H 1 82 SER HB2 . . 3.780 2.636 2.237 3.613 . 0 0 "[ . 1 . 2]" 1
1508 1 82 SER H 1 82 SER HB3 . . 3.780 3.020 2.354 3.654 . 0 0 "[ . 1 . 2]" 1
1509 1 82 SER H 1 83 ARG H . . 3.020 2.413 2.121 2.750 . 0 0 "[ . 1 . 2]" 1
1510 1 82 SER HA 1 108 PRO HB2 . . 4.220 3.713 3.412 4.112 . 0 0 "[ . 1 . 2]" 1
1511 1 82 SER HA 1 108 PRO HB3 . . 4.280 3.501 3.055 3.984 . 0 0 "[ . 1 . 2]" 1
1512 1 82 SER HB2 1 83 ARG H . . 4.350 3.931 3.010 4.316 . 0 0 "[ . 1 . 2]" 1
1513 1 82 SER HB3 1 83 ARG H . . 4.350 3.765 3.060 4.321 . 0 0 "[ . 1 . 2]" 1
1514 1 83 ARG H 1 83 ARG HB2 . . 4.130 2.857 2.292 3.997 . 0 0 "[ . 1 . 2]" 1
1515 1 83 ARG H 1 83 ARG QB . . 3.420 2.613 2.265 3.157 . 0 0 "[ . 1 . 2]" 1
1516 1 83 ARG H 1 83 ARG HB3 . . 4.130 3.548 2.650 3.866 . 0 0 "[ . 1 . 2]" 1
1517 1 83 ARG H 1 83 ARG QD . . 4.580 3.950 2.102 4.581 0.001 11 0 "[ . 1 . 2]" 1
1518 1 83 ARG H 1 83 ARG QG . . 3.550 2.972 1.920 3.554 0.004 4 0 "[ . 1 . 2]" 1
1519 1 83 ARG H 1 108 PRO HB3 . . 4.450 4.116 3.559 4.446 . 0 0 "[ . 1 . 2]" 1
1520 1 83 ARG H 1 108 PRO HG3 . . 4.670 4.417 3.701 4.668 . 0 0 "[ . 1 . 2]" 1
1521 1 83 ARG HA 1 83 ARG QG . . 3.820 2.650 2.279 3.458 . 0 0 "[ . 1 . 2]" 1
1522 1 83 ARG HA 1 84 PRO HD2 . . 3.490 2.404 2.313 2.481 . 0 0 "[ . 1 . 2]" 1
1523 1 83 ARG HA 1 84 PRO HD3 . . 3.370 2.301 2.271 2.333 . 0 0 "[ . 1 . 2]" 1
1524 1 83 ARG HA 1 84 PRO HG2 . . 4.820 4.516 4.442 4.579 . 0 0 "[ . 1 . 2]" 1
1525 1 83 ARG HA 1 108 PRO HG2 . . 4.690 4.520 4.056 4.684 . 0 0 "[ . 1 . 2]" 1
1526 1 83 ARG HA 1 108 PRO HG3 . . 4.090 2.827 2.303 2.987 . 0 0 "[ . 1 . 2]" 1
1527 1 83 ARG QB 1 83 ARG QD . . 2.960 2.195 2.080 2.630 . 0 0 "[ . 1 . 2]" 1
1528 1 83 ARG QB 1 84 PRO HD2 . . 3.350 2.046 1.964 2.288 . 0 0 "[ . 1 . 2]" 1
1529 1 83 ARG QB 1 84 PRO HD3 . . 3.810 3.392 3.238 3.595 . 0 0 "[ . 1 . 2]" 1
1530 1 83 ARG HB2 1 83 ARG QD . . 3.670 2.579 2.119 3.498 . 0 0 "[ . 1 . 2]" 1
1531 1 83 ARG HB2 1 84 PRO HD2 . . 3.840 3.245 1.997 3.839 . 0 0 "[ . 1 . 2]" 1
1532 1 83 ARG HB3 1 83 ARG QD . . 3.670 2.660 2.164 3.410 . 0 0 "[ . 1 . 2]" 1
1533 1 83 ARG HB3 1 84 PRO HD2 . . 3.840 2.391 1.999 3.604 . 0 0 "[ . 1 . 2]" 1
1534 1 83 ARG QD 1 84 PRO HD2 . . 4.780 3.829 2.256 4.802 0.022 7 0 "[ . 1 . 2]" 1
1535 1 84 PRO HA 1 85 VAL H . . 3.250 2.257 2.153 2.417 . 0 0 "[ . 1 . 2]" 1
1536 1 84 PRO HA 1 108 PRO HD2 . . 4.040 3.908 3.713 4.044 0.004 17 0 "[ . 1 . 2]" 1
1537 1 84 PRO HA 1 108 PRO HD3 . . 3.720 2.356 2.163 2.459 . 0 0 "[ . 1 . 2]" 1
1538 1 84 PRO QB 1 85 VAL H . . 3.630 2.936 2.506 3.329 . 0 0 "[ . 1 . 2]" 1
1539 1 84 PRO QB 1 105 ARG QD . . 3.760 2.172 1.870 2.715 . 0 0 "[ . 1 . 2]" 1
1540 1 84 PRO QB 1 105 ARG QG . . 4.410 2.429 2.020 3.976 . 0 0 "[ . 1 . 2]" 1
1541 1 84 PRO QB 1 107 LEU MD2 . . 3.270 2.368 1.951 2.767 . 0 0 "[ . 1 . 2]" 1
1542 1 84 PRO QB 1 108 PRO HD2 . . 4.120 2.976 2.716 3.259 . 0 0 "[ . 1 . 2]" 1
1543 1 84 PRO QB 1 108 PRO HD3 . . 3.880 2.451 2.073 2.996 . 0 0 "[ . 1 . 2]" 1
1544 1 84 PRO HB2 1 85 VAL H . . 4.140 3.082 2.575 3.555 . 0 0 "[ . 1 . 2]" 1
1545 1 84 PRO HB2 1 105 ARG HD2 . . 5.500 3.066 2.007 4.286 . 0 0 "[ . 1 . 2]" 1
1546 1 84 PRO HB2 1 105 ARG HD3 . . 5.500 2.844 1.999 4.041 . 0 0 "[ . 1 . 2]" 1
1547 1 84 PRO HB2 1 108 PRO HD3 . . 4.430 3.998 3.638 4.430 . 6 0 "[ . 1 . 2]" 1
1548 1 84 PRO HB3 1 85 VAL H . . 4.140 3.723 3.435 4.016 . 0 0 "[ . 1 . 2]" 1
1549 1 84 PRO HB3 1 105 ARG HD2 . . 5.500 4.145 3.180 5.357 . 0 0 "[ . 1 . 2]" 1
1550 1 84 PRO HB3 1 105 ARG HD3 . . 5.500 4.096 2.298 5.343 . 0 0 "[ . 1 . 2]" 1
1551 1 84 PRO HB3 1 108 PRO HD3 . . 4.430 2.475 2.085 3.046 . 0 0 "[ . 1 . 2]" 1
1552 1 84 PRO HD2 1 108 PRO HD3 . . 5.220 4.286 3.964 4.583 . 0 0 "[ . 1 . 2]" 1
1553 1 84 PRO HD3 1 108 PRO HD2 . . 4.100 3.467 3.101 3.724 . 0 0 "[ . 1 . 2]" 1
1554 1 84 PRO HD3 1 108 PRO HD3 . . 4.680 2.894 2.600 3.312 . 0 0 "[ . 1 . 2]" 1
1555 1 84 PRO HG2 1 105 ARG HD2 . . 5.500 4.185 2.563 5.502 0.002 6 0 "[ . 1 . 2]" 1
1556 1 84 PRO HG2 1 105 ARG QD . . 4.690 3.182 2.393 3.947 . 0 0 "[ . 1 . 2]" 1
1557 1 84 PRO HG2 1 105 ARG HD3 . . 5.500 3.817 2.415 5.239 . 0 0 "[ . 1 . 2]" 1
1558 1 84 PRO HG2 1 107 LEU MD2 . . 4.860 4.431 4.169 4.740 . 0 0 "[ . 1 . 2]" 1
1559 1 84 PRO HG3 1 107 LEU MD2 . . 3.580 3.359 3.110 3.583 0.003 17 0 "[ . 1 . 2]" 1
1560 1 84 PRO HG3 1 108 PRO HD3 . . 4.750 3.958 3.678 4.572 . 0 0 "[ . 1 . 2]" 1
1561 1 85 VAL H 1 85 VAL HB . . 3.630 2.664 2.515 2.854 . 0 0 "[ . 1 . 2]" 1
1562 1 85 VAL H 1 85 VAL MG1 . . 4.420 3.857 3.796 3.943 . 0 0 "[ . 1 . 2]" 1
1563 1 85 VAL H 1 85 VAL MG2 . . 3.670 2.743 2.380 3.098 . 0 0 "[ . 1 . 2]" 1
1564 1 85 VAL H 1 86 GLN H . . 4.640 4.456 4.333 4.578 . 0 0 "[ . 1 . 2]" 1
1565 1 85 VAL H 1 106 PHE H . . 3.860 2.987 2.605 3.601 . 0 0 "[ . 1 . 2]" 1
1566 1 85 VAL H 1 106 PHE HB2 . . 4.500 3.029 2.792 3.345 . 0 0 "[ . 1 . 2]" 1
1567 1 85 VAL H 1 108 PRO HD3 . . 4.600 4.483 4.228 4.606 0.006 18 0 "[ . 1 . 2]" 1
1568 1 85 VAL HA 1 85 VAL MG1 . . 3.190 2.318 2.215 2.483 . 0 0 "[ . 1 . 2]" 1
1569 1 85 VAL HA 1 85 VAL MG2 . . 3.440 2.343 2.274 2.462 . 0 0 "[ . 1 . 2]" 1
1570 1 85 VAL HA 1 86 GLN H . . 2.860 2.222 2.152 2.286 . 0 0 "[ . 1 . 2]" 1
1571 1 85 VAL HA 1 86 GLN HA . . 4.800 4.369 4.354 4.394 . 0 0 "[ . 1 . 2]" 1
1572 1 85 VAL HA 1 86 GLN HB2 . . 4.690 4.539 4.391 4.654 . 0 0 "[ . 1 . 2]" 1
1573 1 85 VAL HA 1 86 GLN HB3 . . 4.690 4.524 4.392 4.697 0.007 10 0 "[ . 1 . 2]" 1
1574 1 85 VAL HB 1 86 GLN H . . 4.610 3.938 3.764 4.170 . 0 0 "[ . 1 . 2]" 1
1575 1 85 VAL HB 1 87 VAL MG1 . . 4.260 3.291 3.044 3.452 . 0 0 "[ . 1 . 2]" 1
1576 1 85 VAL HB 1 106 PHE H . . 4.030 3.673 3.400 3.912 . 0 0 "[ . 1 . 2]" 1
1577 1 85 VAL HB 1 106 PHE HB2 . . 3.690 3.076 2.667 3.231 . 0 0 "[ . 1 . 2]" 1
1578 1 85 VAL HB 1 106 PHE HB3 . . 4.880 4.758 4.365 4.881 0.001 10 0 "[ . 1 . 2]" 1
1579 1 85 VAL HB 1 106 PHE QD . . 4.450 3.104 2.477 3.528 . 0 0 "[ . 1 . 2]" 1
1580 1 85 VAL MG1 1 86 GLN H . . 3.610 2.087 1.916 2.412 . 0 0 "[ . 1 . 2]" 1
1581 1 85 VAL MG1 1 87 VAL MG1 . . 3.080 2.183 1.913 2.490 . 0 0 "[ . 1 . 2]" 1
1582 1 85 VAL MG1 1 106 PHE QD . . 4.370 3.774 3.119 4.108 . 0 0 "[ . 1 . 2]" 1
1583 1 85 VAL MG2 1 86 GLN H . . 4.160 3.941 3.843 4.052 . 0 0 "[ . 1 . 2]" 1
1584 1 85 VAL MG2 1 106 PHE HB2 . . 4.560 3.921 3.485 4.121 . 0 0 "[ . 1 . 2]" 1
1585 1 85 VAL MG2 1 106 PHE HB3 . . 5.260 5.091 4.685 5.210 . 0 0 "[ . 1 . 2]" 1
1586 1 85 VAL MG2 1 106 PHE QD . . 4.770 4.279 3.677 4.613 . 0 0 "[ . 1 . 2]" 1
1587 1 86 GLN H 1 86 GLN HB2 . . 3.350 2.919 2.693 3.170 . 0 0 "[ . 1 . 2]" 1
1588 1 86 GLN H 1 86 GLN HB3 . . 3.350 2.441 2.349 2.556 . 0 0 "[ . 1 . 2]" 1
1589 1 86 GLN H 1 86 GLN QG . . 4.360 3.982 3.902 4.146 . 0 0 "[ . 1 . 2]" 1
1590 1 86 GLN H 1 87 VAL H . . 4.580 4.324 4.188 4.487 . 0 0 "[ . 1 . 2]" 1
1591 1 86 GLN HA 1 86 GLN HE21 . . 4.960 3.906 3.316 4.449 . 0 0 "[ . 1 . 2]" 1
1592 1 86 GLN HA 1 86 GLN QE . . 4.280 3.593 3.157 4.012 . 0 0 "[ . 1 . 2]" 1
1593 1 86 GLN HA 1 86 GLN HE22 . . 4.960 4.247 3.963 4.563 . 0 0 "[ . 1 . 2]" 1
1594 1 86 GLN HA 1 87 VAL H . . 2.940 2.150 2.139 2.177 . 0 0 "[ . 1 . 2]" 1
1595 1 86 GLN HA 1 87 VAL MG2 . . 4.330 3.891 3.728 4.026 . 0 0 "[ . 1 . 2]" 1
1596 1 86 GLN HA 1 105 ARG HA . . 4.020 2.236 2.047 2.405 . 0 0 "[ . 1 . 2]" 1
1597 1 86 GLN HA 1 105 ARG HB2 . . 4.570 3.038 2.560 4.573 0.003 6 0 "[ . 1 . 2]" 1
1598 1 86 GLN HA 1 105 ARG HG2 . . 4.800 4.015 2.214 4.508 . 0 0 "[ . 1 . 2]" 1
1599 1 86 GLN HA 1 105 ARG QG . . 4.040 2.730 2.084 3.352 . 0 0 "[ . 1 . 2]" 1
1600 1 86 GLN HA 1 105 ARG HG3 . . 4.800 2.864 2.099 4.161 . 0 0 "[ . 1 . 2]" 1
1601 1 86 GLN QB 1 87 VAL H . . 4.230 3.873 3.740 3.960 . 0 0 "[ . 1 . 2]" 1
1602 1 86 GLN QB 1 105 ARG HA . . 5.000 4.114 3.911 4.405 . 0 0 "[ . 1 . 2]" 1
1603 1 86 GLN HB2 1 87 VAL H . . 5.040 4.318 4.183 4.497 . 0 0 "[ . 1 . 2]" 1
1604 1 86 GLN HB3 1 87 VAL H . . 5.040 4.380 4.175 4.493 . 0 0 "[ . 1 . 2]" 1
1605 1 86 GLN QE 1 87 VAL H . . 3.760 3.402 2.939 3.759 . 0 0 "[ . 1 . 2]" 1
1606 1 86 GLN QE 1 88 TYR QE . . 4.270 2.822 2.100 3.569 . 0 0 "[ . 1 . 2]" 1
1607 1 86 GLN QE 1 103 SER QB . . 3.770 2.744 2.134 3.647 . 0 0 "[ . 1 . 2]" 1
1608 1 86 GLN HE21 1 87 VAL H . . 4.440 3.634 3.105 4.092 . 0 0 "[ . 1 . 2]" 1
1609 1 86 GLN HE21 1 88 TYR QE . . 4.860 3.042 2.115 3.781 . 0 0 "[ . 1 . 2]" 1
1610 1 86 GLN HE21 1 103 SER HA . . 4.390 2.866 2.591 3.223 . 0 0 "[ . 1 . 2]" 1
1611 1 86 GLN HE21 1 104 PHE H . . 4.030 2.368 1.819 2.835 . 0 0 "[ . 1 . 2]" 1
1612 1 86 GLN HE22 1 87 VAL H . . 4.440 4.169 3.464 4.441 0.001 13 0 "[ . 1 . 2]" 1
1613 1 86 GLN HE22 1 88 TYR QE . . 4.860 3.750 2.676 4.623 . 0 0 "[ . 1 . 2]" 1
1614 1 86 GLN HE22 1 103 SER HA . . 4.390 2.899 2.344 3.866 . 0 0 "[ . 1 . 2]" 1
1615 1 86 GLN HE22 1 104 PHE H . . 4.030 2.385 1.879 3.197 . 0 0 "[ . 1 . 2]" 1
1616 1 86 GLN QG 1 87 VAL H . . 4.430 3.306 2.638 3.772 . 0 0 "[ . 1 . 2]" 1
1617 1 86 GLN QG 1 88 TYR QE . . 3.780 2.842 2.113 3.654 . 0 0 "[ . 1 . 2]" 1
1618 1 86 GLN HG2 1 87 VAL H . . 5.120 4.634 3.448 5.084 . 0 0 "[ . 1 . 2]" 1
1619 1 86 GLN HG2 1 88 TYR QE . . 4.520 3.611 2.863 4.521 0.001 5 0 "[ . 1 . 2]" 1
1620 1 86 GLN HG3 1 87 VAL H . . 5.120 3.555 2.660 5.108 . 0 0 "[ . 1 . 2]" 1
1621 1 86 GLN HG3 1 88 TYR QE . . 4.520 2.994 2.149 3.863 . 0 0 "[ . 1 . 2]" 1
1622 1 87 VAL H 1 87 VAL MG1 . . 3.890 2.820 2.670 3.019 . 0 0 "[ . 1 . 2]" 1
1623 1 87 VAL H 1 87 VAL MG2 . . 3.450 2.247 1.980 2.426 . 0 0 "[ . 1 . 2]" 1
1624 1 87 VAL H 1 88 TYR H . . 4.910 4.457 4.419 4.523 . 0 0 "[ . 1 . 2]" 1
1625 1 87 VAL H 1 104 PHE H . . 4.110 3.861 3.545 4.108 . 0 0 "[ . 1 . 2]" 1
1626 1 87 VAL H 1 105 ARG HA . . 3.870 2.619 2.416 2.999 . 0 0 "[ . 1 . 2]" 1
1627 1 87 VAL H 1 106 PHE H . . 4.210 4.019 3.697 4.207 . 0 0 "[ . 1 . 2]" 1
1628 1 87 VAL HA 1 87 VAL MG1 . . 3.350 2.370 2.262 2.444 . 0 0 "[ . 1 . 2]" 1
1629 1 87 VAL HA 1 88 TYR H . . 3.370 2.511 2.387 2.574 . 0 0 "[ . 1 . 2]" 1
1630 1 87 VAL HA 1 88 TYR QD . . 4.190 3.070 2.346 3.812 . 0 0 "[ . 1 . 2]" 1
1631 1 87 VAL HB 1 88 TYR H . . 3.120 2.185 2.054 2.439 . 0 0 "[ . 1 . 2]" 1
1632 1 87 VAL MG1 1 88 TYR H . . 3.770 3.650 3.482 3.770 . 0 0 "[ . 1 . 2]" 1
1633 1 87 VAL MG1 1 106 PHE H . . 4.700 4.066 3.778 4.437 . 0 0 "[ . 1 . 2]" 1
1634 1 87 VAL MG1 1 106 PHE QD . . 3.630 2.574 2.217 3.261 . 0 0 "[ . 1 . 2]" 1
1635 1 87 VAL MG2 1 88 TYR H . . 3.810 3.140 2.919 3.373 . 0 0 "[ . 1 . 2]" 1
1636 1 87 VAL MG2 1 88 TYR HA . . 4.320 3.537 3.337 3.771 . 0 0 "[ . 1 . 2]" 1
1637 1 87 VAL MG2 1 89 PHE QD . . 4.740 3.473 3.321 3.673 . 0 0 "[ . 1 . 2]" 1
1638 1 87 VAL MG2 1 89 PHE QE . . 4.530 4.503 4.403 4.531 0.001 10 0 "[ . 1 . 2]" 1
1639 1 87 VAL MG2 1 104 PHE H . . 4.220 3.926 3.490 4.188 . 0 0 "[ . 1 . 2]" 1
1640 1 87 VAL MG2 1 104 PHE HB2 . . 4.000 3.582 3.347 3.888 . 0 0 "[ . 1 . 2]" 1
1641 1 87 VAL MG2 1 104 PHE QB . . 3.240 2.156 1.959 2.519 . 0 0 "[ . 1 . 2]" 1
1642 1 87 VAL MG2 1 104 PHE HB3 . . 4.000 2.174 1.970 2.552 . 0 0 "[ . 1 . 2]" 1
1643 1 87 VAL MG2 1 104 PHE QD . . 4.560 2.577 2.257 3.114 . 0 0 "[ . 1 . 2]" 1
1644 1 87 VAL MG2 1 105 ARG HA . . 4.280 3.312 2.814 3.856 . 0 0 "[ . 1 . 2]" 1
1645 1 87 VAL MG2 1 106 PHE H . . 4.370 3.690 3.090 4.227 . 0 0 "[ . 1 . 2]" 1
1646 1 87 VAL MG2 1 106 PHE QD . . 3.680 3.033 2.300 3.358 . 0 0 "[ . 1 . 2]" 1
1647 1 87 VAL MG2 1 106 PHE QE . . 3.580 2.139 1.926 2.477 . 0 0 "[ . 1 . 2]" 1
1648 1 88 TYR H 1 88 TYR QB . . 3.670 2.704 2.454 2.885 . 0 0 "[ . 1 . 2]" 1
1649 1 88 TYR H 1 88 TYR QD . . 4.040 2.961 2.274 3.441 . 0 0 "[ . 1 . 2]" 1
1650 1 88 TYR H 1 89 PHE H . . 4.860 4.419 4.339 4.477 . 0 0 "[ . 1 . 2]" 1
1651 1 88 TYR HA 1 88 TYR QD . . 3.920 3.019 2.563 3.284 . 0 0 "[ . 1 . 2]" 1
1652 1 88 TYR HA 1 89 PHE H . . 3.090 2.339 2.237 2.459 . 0 0 "[ . 1 . 2]" 1
1653 1 88 TYR HA 1 101 THR HB . . 4.740 4.225 4.023 4.467 . 0 0 "[ . 1 . 2]" 1
1654 1 88 TYR HA 1 102 GLN H . . 4.600 4.023 3.723 4.529 . 0 0 "[ . 1 . 2]" 1
1655 1 88 TYR HA 1 103 SER HA . . 3.930 3.832 3.298 3.938 0.008 18 0 "[ . 1 . 2]" 1
1656 1 88 TYR HA 1 104 PHE H . . 3.860 3.188 2.831 3.433 . 0 0 "[ . 1 . 2]" 1
1657 1 88 TYR QB 1 89 PHE H . . 3.380 2.565 2.311 2.826 . 0 0 "[ . 1 . 2]" 1
1658 1 88 TYR QB 1 101 THR HB . . 3.270 2.041 1.931 2.317 . 0 0 "[ . 1 . 2]" 1
1659 1 88 TYR QB 1 101 THR MG . . 3.770 2.822 2.634 3.151 . 0 0 "[ . 1 . 2]" 1
1660 1 88 TYR QB 1 102 GLN H . . 4.310 3.335 2.460 4.080 . 0 0 "[ . 1 . 2]" 1
1661 1 88 TYR HB2 1 89 PHE H . . 3.920 3.746 3.296 3.921 0.001 6 0 "[ . 1 . 2]" 1
1662 1 88 TYR HB2 1 101 THR HB . . 3.850 3.379 2.549 3.845 . 0 0 "[ . 1 . 2]" 1
1663 1 88 TYR HB3 1 89 PHE H . . 3.920 2.615 2.337 2.915 . 0 0 "[ . 1 . 2]" 1
1664 1 88 TYR HB3 1 101 THR HB . . 3.850 2.061 1.995 2.338 . 0 0 "[ . 1 . 2]" 1
1665 1 88 TYR QD 1 89 PHE H . . 4.270 3.810 3.034 4.237 . 0 0 "[ . 1 . 2]" 1
1666 1 88 TYR QD 1 101 THR HB . . 3.790 2.865 2.000 3.659 . 0 0 "[ . 1 . 2]" 1
1667 1 88 TYR QD 1 101 THR MG . . 4.350 4.116 3.668 4.354 0.004 17 0 "[ . 1 . 2]" 1
1668 1 88 TYR QD 1 102 GLN H . . 4.790 3.592 2.632 4.607 . 0 0 "[ . 1 . 2]" 1
1669 1 88 TYR QD 1 103 SER HA . . 3.800 2.663 2.003 3.457 . 0 0 "[ . 1 . 2]" 1
1670 1 88 TYR QD 1 104 PHE H . . 4.450 3.708 2.888 4.313 . 0 0 "[ . 1 . 2]" 1
1671 1 88 TYR QE 1 103 SER HA . . 4.260 2.567 2.058 3.213 . 0 0 "[ . 1 . 2]" 1
1672 1 88 TYR QE 1 103 SER HB2 . . 4.190 3.461 2.349 4.153 . 0 0 "[ . 1 . 2]" 1
1673 1 88 TYR QE 1 103 SER HB3 . . 4.190 3.286 2.136 4.177 . 0 0 "[ . 1 . 2]" 1
1674 1 89 PHE H 1 89 PHE QD . . 3.900 3.093 2.207 3.367 . 0 0 "[ . 1 . 2]" 1
1675 1 89 PHE H 1 89 PHE QE . . 5.130 4.335 3.981 4.502 . 0 0 "[ . 1 . 2]" 1
1676 1 89 PHE H 1 90 TYR H . . 4.660 4.391 4.351 4.432 . 0 0 "[ . 1 . 2]" 1
1677 1 89 PHE H 1 90 TYR QD . . 5.500 4.775 4.526 5.210 . 0 0 "[ . 1 . 2]" 1
1678 1 89 PHE H 1 101 THR HA . . 4.260 3.731 3.433 4.032 . 0 0 "[ . 1 . 2]" 1
1679 1 89 PHE H 1 101 THR HB . . 4.350 3.430 3.018 3.995 . 0 0 "[ . 1 . 2]" 1
1680 1 89 PHE H 1 101 THR MG . . 4.990 3.947 3.206 4.460 . 0 0 "[ . 1 . 2]" 1
1681 1 89 PHE H 1 102 GLN H . . 3.510 2.460 2.135 2.812 . 0 0 "[ . 1 . 2]" 1
1682 1 89 PHE H 1 102 GLN QB . . 4.380 3.504 3.145 3.926 . 0 0 "[ . 1 . 2]" 1
1683 1 89 PHE HA 1 89 PHE QD . . 4.340 3.714 3.650 3.729 . 0 0 "[ . 1 . 2]" 1
1684 1 89 PHE HA 1 90 TYR H . . 3.110 2.363 2.275 2.531 . 0 0 "[ . 1 . 2]" 1
1685 1 89 PHE HA 1 90 TYR QD . . 4.720 3.177 2.629 3.987 . 0 0 "[ . 1 . 2]" 1
1686 1 89 PHE QB 1 90 TYR H . . 3.270 2.505 2.154 2.715 . 0 0 "[ . 1 . 2]" 1
1687 1 89 PHE HB2 1 90 TYR H . . 3.970 2.542 2.171 2.767 . 0 0 "[ . 1 . 2]" 1
1688 1 89 PHE HB3 1 90 TYR H . . 3.970 3.798 3.607 3.943 . 0 0 "[ . 1 . 2]" 1
1689 1 89 PHE QD 1 90 TYR H . . 4.000 3.452 2.953 3.838 . 0 0 "[ . 1 . 2]" 1
1690 1 89 PHE QD 1 90 TYR HA . . 4.730 3.253 2.659 4.083 . 0 0 "[ . 1 . 2]" 1
1691 1 89 PHE QD 1 91 VAL MG2 . . 4.590 3.898 3.322 4.148 . 0 0 "[ . 1 . 2]" 1
1692 1 89 PHE QD 1 102 GLN H . . 5.030 4.156 3.797 4.507 . 0 0 "[ . 1 . 2]" 1
1693 1 89 PHE QD 1 104 PHE HB2 . . 4.140 2.986 2.695 3.253 . 0 0 "[ . 1 . 2]" 1
1694 1 89 PHE QD 1 104 PHE QB . . 3.520 2.773 2.520 3.038 . 0 0 "[ . 1 . 2]" 1
1695 1 89 PHE QD 1 104 PHE HB3 . . 4.140 3.311 3.009 3.761 . 0 0 "[ . 1 . 2]" 1
1696 1 89 PHE QD 1 104 PHE QD . . 5.420 3.900 3.522 4.534 . 0 0 "[ . 1 . 2]" 1
1697 1 89 PHE QE 1 91 VAL MG2 . . 5.240 4.487 3.767 4.882 . 0 0 "[ . 1 . 2]" 1
1698 1 89 PHE QE 1 102 GLN QB . . 4.680 2.899 2.470 3.366 . 0 0 "[ . 1 . 2]" 1
1699 1 89 PHE QE 1 102 GLN QG . . 4.660 3.198 2.201 4.033 . 0 0 "[ . 1 . 2]" 1
1700 1 89 PHE QE 1 104 PHE HB2 . . 4.200 2.075 1.997 2.334 . 0 0 "[ . 1 . 2]" 1
1701 1 89 PHE QE 1 104 PHE QB . . 3.660 2.053 1.980 2.296 . 0 0 "[ . 1 . 2]" 1
1702 1 89 PHE QE 1 104 PHE HB3 . . 4.200 3.294 3.033 3.554 . 0 0 "[ . 1 . 2]" 1
1703 1 89 PHE HZ 1 102 GLN QB . . 4.680 3.003 2.565 3.431 . 0 0 "[ . 1 . 2]" 1
1704 1 90 TYR H 1 90 TYR QD . . 3.790 2.834 2.263 3.358 . 0 0 "[ . 1 . 2]" 1
1705 1 90 TYR HA 1 90 TYR QD . . 4.210 3.725 3.687 3.742 . 0 0 "[ . 1 . 2]" 1
1706 1 90 TYR HA 1 91 VAL H . . 3.090 2.462 2.351 2.535 . 0 0 "[ . 1 . 2]" 1
1707 1 90 TYR HA 1 91 VAL MG2 . . 4.090 3.352 3.194 3.521 . 0 0 "[ . 1 . 2]" 1
1708 1 90 TYR HA 1 101 THR HA . . 4.030 3.362 2.864 3.907 . 0 0 "[ . 1 . 2]" 1
1709 1 90 TYR HA 1 102 GLN H . . 4.620 4.241 3.712 4.568 . 0 0 "[ . 1 . 2]" 1
1710 1 90 TYR QB 1 91 VAL H . . 3.410 2.301 2.126 2.533 . 0 0 "[ . 1 . 2]" 1
1711 1 90 TYR QB 1 99 SER H . . 4.410 3.326 3.009 3.791 . 0 0 "[ . 1 . 2]" 1
1712 1 90 TYR QB 1 101 THR H . . 4.730 3.725 3.307 4.225 . 0 0 "[ . 1 . 2]" 1
1713 1 90 TYR QB 1 101 THR HA . . 3.640 2.456 2.024 3.045 . 0 0 "[ . 1 . 2]" 1
1714 1 90 TYR QB 1 101 THR MG . . 3.340 2.255 1.860 2.799 . 0 0 "[ . 1 . 2]" 1
1715 1 90 TYR HB2 1 91 VAL H . . 3.990 2.324 2.143 2.569 . 0 0 "[ . 1 . 2]" 1
1716 1 90 TYR HB2 1 101 THR HA . . 4.370 3.848 3.528 4.266 . 0 0 "[ . 1 . 2]" 1
1717 1 90 TYR HB2 1 101 THR MG . . 4.110 3.665 3.246 4.111 0.001 14 0 "[ . 1 . 2]" 1
1718 1 90 TYR HB3 1 91 VAL H . . 3.990 3.716 3.527 3.862 . 0 0 "[ . 1 . 2]" 1
1719 1 90 TYR HB3 1 101 THR HA . . 4.370 2.489 2.037 3.126 . 0 0 "[ . 1 . 2]" 1
1720 1 90 TYR HB3 1 101 THR MG . . 4.110 2.278 1.871 2.848 . 0 0 "[ . 1 . 2]" 1
1721 1 90 TYR QD 1 91 VAL H . . 4.180 3.187 2.881 3.529 . 0 0 "[ . 1 . 2]" 1
1722 1 90 TYR QD 1 91 VAL MG2 . . 5.500 4.828 4.615 5.041 . 0 0 "[ . 1 . 2]" 1
1723 1 90 TYR QD 1 92 SER H . . 4.700 4.065 3.318 4.526 . 0 0 "[ . 1 . 2]" 1
1724 1 90 TYR QD 1 92 SER HA . . 4.750 3.665 3.174 4.128 . 0 0 "[ . 1 . 2]" 1
1725 1 90 TYR QD 1 92 SER QB . . 3.960 3.670 3.356 3.965 0.005 3 0 "[ . 1 . 2]" 1
1726 1 90 TYR QD 1 98 ARG HA . . 5.280 4.714 4.098 5.239 . 0 0 "[ . 1 . 2]" 1
1727 1 90 TYR QD 1 98 ARG QB . . 4.260 3.439 2.380 4.272 0.012 9 0 "[ . 1 . 2]" 1
1728 1 90 TYR QD 1 98 ARG QD . . 5.000 3.678 2.319 4.956 . 0 0 "[ . 1 . 2]" 1
1729 1 90 TYR QD 1 98 ARG QG . . 4.210 3.422 2.163 4.213 0.003 13 0 "[ . 1 . 2]" 1
1730 1 90 TYR QD 1 99 SER H . . 4.220 3.437 2.674 4.086 . 0 0 "[ . 1 . 2]" 1
1731 1 90 TYR QD 1 101 THR HA . . 4.680 3.983 3.247 4.681 0.001 9 0 "[ . 1 . 2]" 1
1732 1 90 TYR QD 1 101 THR MG . . 3.420 2.498 1.871 3.305 . 0 0 "[ . 1 . 2]" 1
1733 1 90 TYR QE 1 92 SER H . . 5.320 4.653 3.985 5.168 . 0 0 "[ . 1 . 2]" 1
1734 1 90 TYR QE 1 92 SER HA . . 5.210 3.949 2.721 4.672 . 0 0 "[ . 1 . 2]" 1
1735 1 90 TYR QE 1 92 SER QB . . 3.560 2.797 2.078 3.527 . 0 0 "[ . 1 . 2]" 1
1736 1 90 TYR QE 1 98 ARG QB . . 5.200 4.267 2.737 5.193 . 0 0 "[ . 1 . 2]" 1
1737 1 90 TYR QE 1 98 ARG QD . . 4.530 3.603 1.974 4.485 . 0 0 "[ . 1 . 2]" 1
1738 1 90 TYR QE 1 98 ARG QG . . 4.080 3.538 2.758 4.079 . 0 0 "[ . 1 . 2]" 1
1739 1 91 VAL H 1 91 VAL HB . . 3.700 2.619 2.476 2.760 . 0 0 "[ . 1 . 2]" 1
1740 1 91 VAL H 1 91 VAL MG1 . . 4.430 3.835 3.774 3.865 . 0 0 "[ . 1 . 2]" 1
1741 1 91 VAL H 1 91 VAL MG2 . . 3.660 2.578 2.269 2.832 . 0 0 "[ . 1 . 2]" 1
1742 1 91 VAL H 1 92 SER H . . 5.150 4.387 4.211 4.552 . 0 0 "[ . 1 . 2]" 1
1743 1 91 VAL H 1 99 SER H . . 4.000 3.215 2.861 3.700 . 0 0 "[ . 1 . 2]" 1
1744 1 91 VAL H 1 99 SER QB . . 4.230 2.776 1.869 3.590 . 0 0 "[ . 1 . 2]" 1
1745 1 91 VAL HA 1 91 VAL MG1 . . 3.420 2.357 2.221 2.480 . 0 0 "[ . 1 . 2]" 1
1746 1 91 VAL HA 1 91 VAL MG2 . . 3.670 2.404 2.280 2.514 . 0 0 "[ . 1 . 2]" 1
1747 1 91 VAL HA 1 92 SER H . . 3.340 2.171 2.141 2.317 . 0 0 "[ . 1 . 2]" 1
1748 1 91 VAL HB 1 92 SER H . . 4.860 4.136 3.811 4.355 . 0 0 "[ . 1 . 2]" 1
1749 1 91 VAL HB 1 93 ASN H . . 5.500 5.388 5.098 5.502 0.002 13 0 "[ . 1 . 2]" 1
1750 1 91 VAL HB 1 99 SER H . . 4.200 3.871 3.366 4.222 0.022 18 0 "[ . 1 . 2]" 1
1751 1 91 VAL HB 1 99 SER HB2 . . 4.340 3.469 2.198 4.365 0.025 18 0 "[ . 1 . 2]" 1
1752 1 91 VAL HB 1 99 SER QB . . 3.800 2.698 2.013 3.669 . 0 0 "[ . 1 . 2]" 1
1753 1 91 VAL HB 1 99 SER HB3 . . 4.340 3.116 2.077 4.274 . 0 0 "[ . 1 . 2]" 1
1754 1 91 VAL MG1 1 92 SER H . . 3.560 2.495 1.845 3.032 . 0 0 "[ . 1 . 2]" 1
1755 1 91 VAL MG2 1 92 SER H . . 4.340 4.061 3.700 4.295 . 0 0 "[ . 1 . 2]" 1
1756 1 92 SER H 1 92 SER HB2 . . 3.920 3.002 2.220 3.714 . 0 0 "[ . 1 . 2]" 1
1757 1 92 SER H 1 92 SER QB . . 3.380 2.445 2.197 2.962 . 0 0 "[ . 1 . 2]" 1
1758 1 92 SER H 1 92 SER HB3 . . 3.920 2.706 2.358 3.514 . 0 0 "[ . 1 . 2]" 1
1759 1 92 SER H 1 93 ASN H . . 4.900 4.349 4.216 4.440 . 0 0 "[ . 1 . 2]" 1
1760 1 92 SER HA 1 93 ASN H . . 3.120 2.140 2.138 2.144 . 0 0 "[ . 1 . 2]" 1
1761 1 92 SER HA 1 94 GLY H . . 5.500 5.409 5.362 5.502 0.002 17 0 "[ . 1 . 2]" 1
1762 1 92 SER HA 1 98 ARG HA . . 3.660 3.144 2.415 3.660 0.000 16 0 "[ . 1 . 2]" 1
1763 1 92 SER HA 1 98 ARG QB . . 5.340 3.569 1.892 4.773 . 0 0 "[ . 1 . 2]" 1
1764 1 92 SER HA 1 98 ARG QG . . 4.600 2.950 1.990 3.948 . 0 0 "[ . 1 . 2]" 1
1765 1 92 SER HA 1 99 SER H . . 4.410 3.983 3.324 4.420 0.010 16 0 "[ . 1 . 2]" 1
1766 1 92 SER QB 1 98 ARG QG . . 4.170 3.828 3.061 4.183 0.013 13 0 "[ . 1 . 2]" 1
1767 1 92 SER HB2 1 93 ASN H . . 4.510 4.177 3.519 4.515 0.005 18 0 "[ . 1 . 2]" 1
1768 1 92 SER HB3 1 93 ASN H . . 4.510 4.258 3.666 4.435 . 0 0 "[ . 1 . 2]" 1
1769 1 93 ASN H 1 93 ASN HB2 . . 3.950 2.654 2.514 2.776 . 0 0 "[ . 1 . 2]" 1
1770 1 93 ASN H 1 93 ASN QB . . 3.420 2.597 2.473 2.715 . 0 0 "[ . 1 . 2]" 1
1771 1 93 ASN H 1 93 ASN HB3 . . 3.950 3.732 3.004 3.841 . 0 0 "[ . 1 . 2]" 1
1772 1 93 ASN H 1 94 GLY H . . 4.000 3.976 3.932 4.008 0.008 16 0 "[ . 1 . 2]" 1
1773 1 93 ASN H 1 97 LYS HB2 . . 4.890 4.418 3.974 4.665 . 0 0 "[ . 1 . 2]" 1
1774 1 93 ASN H 1 97 LYS HB3 . . 5.500 5.001 4.424 5.351 . 0 0 "[ . 1 . 2]" 1
1775 1 93 ASN H 1 98 ARG HA . . 4.240 2.814 2.279 3.120 . 0 0 "[ . 1 . 2]" 1
1776 1 93 ASN HA 1 94 GLY QA . . 4.680 3.890 3.889 3.892 . 0 0 "[ . 1 . 2]" 1
1777 1 93 ASN QB 1 94 GLY H . . 4.150 3.637 3.551 3.908 . 0 0 "[ . 1 . 2]" 1
1778 1 93 ASN QB 1 97 LYS HB2 . . 4.020 3.538 2.998 4.032 0.012 9 0 "[ . 1 . 2]" 1
1779 1 93 ASN QB 1 97 LYS HB3 . . 4.110 3.757 3.083 4.129 0.019 9 0 "[ . 1 . 2]" 1
1780 1 93 ASN HB2 1 94 GLY H . . 4.840 4.481 4.375 4.620 . 0 0 "[ . 1 . 2]" 1
1781 1 93 ASN HB2 1 97 LYS HB2 . . 4.750 3.867 3.347 4.730 . 0 0 "[ . 1 . 2]" 1
1782 1 93 ASN HB3 1 94 GLY H . . 4.840 3.848 3.742 4.217 . 0 0 "[ . 1 . 2]" 1
1783 1 93 ASN HB3 1 97 LYS HB2 . . 4.750 4.278 3.032 4.758 0.008 19 0 "[ . 1 . 2]" 1
1784 1 94 GLY H 1 95 ARG H . . 4.690 4.486 4.406 4.585 . 0 0 "[ . 1 . 2]" 1
1785 1 94 GLY H 1 97 LYS HB2 . . 5.300 5.183 4.853 5.307 0.007 20 0 "[ . 1 . 2]" 1
1786 1 94 GLY QA 1 95 ARG HA . . 4.450 3.955 3.934 3.974 . 0 0 "[ . 1 . 2]" 1
1787 1 94 GLY HA2 1 95 ARG H . . 3.200 3.140 2.811 3.222 0.022 16 0 "[ . 1 . 2]" 1
1788 1 94 GLY HA3 1 95 ARG H . . 3.200 2.165 2.138 2.344 . 0 0 "[ . 1 . 2]" 1
1789 1 95 ARG H 1 95 ARG QB . . 3.070 2.787 2.319 3.056 . 0 0 "[ . 1 . 2]" 1
1790 1 95 ARG H 1 95 ARG HG2 . . 4.040 2.822 1.974 4.044 0.004 9 0 "[ . 1 . 2]" 1
1791 1 95 ARG H 1 95 ARG QG . . 3.490 2.517 1.954 3.259 . 0 0 "[ . 1 . 2]" 1
1792 1 95 ARG H 1 95 ARG HG3 . . 4.040 3.213 2.694 4.053 0.013 15 0 "[ . 1 . 2]" 1
1793 1 95 ARG H 1 96 ARG H . . 3.860 2.167 1.898 2.656 . 0 0 "[ . 1 . 2]" 1
1794 1 95 ARG H 1 97 LYS H . . 4.940 3.051 2.654 3.753 . 0 0 "[ . 1 . 2]" 1
1795 1 95 ARG HA 1 95 ARG HG2 . . 3.840 3.305 2.226 3.841 0.001 1 0 "[ . 1 . 2]" 1
1796 1 95 ARG HA 1 95 ARG HG3 . . 3.840 3.556 2.567 3.845 0.005 14 0 "[ . 1 . 2]" 1
1797 1 95 ARG HA 1 96 ARG HA . . 4.840 4.563 4.540 4.602 . 0 0 "[ . 1 . 2]" 1
1798 1 95 ARG HA 1 97 LYS H . . 5.150 4.749 4.164 5.121 . 0 0 "[ . 1 . 2]" 1
1799 1 95 ARG QB 1 95 ARG QD . . 3.180 2.195 2.073 2.361 . 0 0 "[ . 1 . 2]" 1
1800 1 95 ARG QB 1 96 ARG H . . 3.860 2.860 1.938 3.427 . 0 0 "[ . 1 . 2]" 1
1801 1 95 ARG QG 1 96 ARG H . . 4.250 2.751 1.788 4.109 . 0 0 "[ . 1 . 2]" 1
1802 1 95 ARG HG2 1 96 ARG H . . 4.860 3.323 2.052 4.824 . 0 0 "[ . 1 . 2]" 1
1803 1 95 ARG HG3 1 96 ARG H . . 4.860 2.978 1.915 4.604 . 0 0 "[ . 1 . 2]" 1
1804 1 96 ARG H 1 96 ARG QB . . 3.590 2.509 2.286 3.012 . 0 0 "[ . 1 . 2]" 1
1805 1 96 ARG H 1 96 ARG QG . . 4.090 3.212 1.946 4.077 . 0 0 "[ . 1 . 2]" 1
1806 1 96 ARG H 1 97 LYS H . . 3.440 2.274 1.915 2.857 . 0 0 "[ . 1 . 2]" 1
1807 1 96 ARG HA 1 96 ARG QG . . 3.690 2.681 2.153 3.442 . 0 0 "[ . 1 . 2]" 1
1808 1 97 LYS H 1 97 LYS HB2 . . 3.550 2.573 2.309 2.819 . 0 0 "[ . 1 . 2]" 1
1809 1 97 LYS H 1 97 LYS HB3 . . 3.810 3.660 3.558 3.871 0.061 19 0 "[ . 1 . 2]" 1
1810 1 97 LYS H 1 97 LYS HG2 . . 4.130 3.462 1.925 4.138 0.008 5 0 "[ . 1 . 2]" 1
1811 1 97 LYS H 1 97 LYS QG . . 3.430 2.528 1.912 3.287 . 0 0 "[ . 1 . 2]" 1
1812 1 97 LYS H 1 97 LYS HG3 . . 4.130 2.870 1.962 4.146 0.016 9 0 "[ . 1 . 2]" 1
1813 1 97 LYS H 1 98 ARG H . . 4.590 4.305 3.772 4.549 . 0 0 "[ . 1 . 2]" 1
1814 1 97 LYS HA 1 97 LYS QD . . 4.390 3.523 1.990 4.265 . 0 0 "[ . 1 . 2]" 1
1815 1 97 LYS HA 1 97 LYS HG2 . . 4.120 2.869 2.338 3.523 . 0 0 "[ . 1 . 2]" 1
1816 1 97 LYS HA 1 97 LYS QG . . 3.550 2.531 2.227 2.865 . 0 0 "[ . 1 . 2]" 1
1817 1 97 LYS HA 1 97 LYS HG3 . . 4.120 3.084 2.253 3.871 . 0 0 "[ . 1 . 2]" 1
1818 1 97 LYS HA 1 98 ARG H . . 3.030 2.169 2.141 2.257 . 0 0 "[ . 1 . 2]" 1
1819 1 97 LYS HA 1 98 ARG QG . . 5.500 4.455 3.642 5.521 0.021 3 0 "[ . 1 . 2]" 1
1820 1 97 LYS QE 1 97 LYS QG . . 3.320 2.214 2.056 2.508 . 0 0 "[ . 1 . 2]" 1
1821 1 98 ARG H 1 98 ARG HB2 . . 3.920 3.035 2.380 3.933 0.013 2 0 "[ . 1 . 2]" 1
1822 1 98 ARG H 1 98 ARG QB . . 3.290 2.783 2.346 3.281 . 0 0 "[ . 1 . 2]" 1
1823 1 98 ARG H 1 98 ARG HB3 . . 3.920 3.564 2.988 3.780 . 0 0 "[ . 1 . 2]" 1
1824 1 98 ARG H 1 98 ARG QG . . 4.060 3.274 2.170 4.146 0.086 9 0 "[ . 1 . 2]" 1
1825 1 98 ARG H 1 99 SER H . . 4.890 4.415 4.378 4.507 . 0 0 "[ . 1 . 2]" 1
1826 1 98 ARG HA 1 98 ARG QG . . 3.910 2.608 2.139 3.439 . 0 0 "[ . 1 . 2]" 1
1827 1 98 ARG HA 1 99 SER H . . 3.210 2.503 2.387 2.600 . 0 0 "[ . 1 . 2]" 1
1828 1 98 ARG QB 1 98 ARG QD . . 3.140 2.175 2.023 2.660 . 0 0 "[ . 1 . 2]" 1
1829 1 98 ARG QB 1 99 SER H . . 3.550 2.289 2.040 3.069 . 0 0 "[ . 1 . 2]" 1
1830 1 98 ARG HB2 1 98 ARG HD2 . . 4.060 2.854 2.131 3.544 . 0 0 "[ . 1 . 2]" 1
1831 1 98 ARG HB2 1 98 ARG HD3 . . 4.060 3.020 2.082 3.951 . 0 0 "[ . 1 . 2]" 1
1832 1 98 ARG HB2 1 99 SER H . . 4.080 3.244 2.068 4.000 . 0 0 "[ . 1 . 2]" 1
1833 1 98 ARG HB3 1 98 ARG HD2 . . 4.060 3.162 2.083 4.166 0.106 10 0 "[ . 1 . 2]" 1
1834 1 98 ARG HB3 1 98 ARG HD3 . . 4.060 3.184 2.393 3.847 . 0 0 "[ . 1 . 2]" 1
1835 1 98 ARG HB3 1 99 SER H . . 4.080 2.745 2.054 3.573 . 0 0 "[ . 1 . 2]" 1
1836 1 98 ARG QD 1 98 ARG QH1 . . 3.620 1.921 1.818 1.997 . 0 0 "[ . 1 . 2]" 1
1837 1 98 ARG HD2 1 98 ARG QH1 . . 4.160 2.251 1.826 3.377 . 0 0 "[ . 1 . 2]" 1
1838 1 98 ARG HD3 1 98 ARG QH1 . . 4.160 2.395 1.895 3.397 . 0 0 "[ . 1 . 2]" 1
1839 1 98 ARG QG 1 99 SER H . . 4.400 3.310 1.886 4.045 . 0 0 "[ . 1 . 2]" 1
1840 1 99 SER H 1 99 SER HB2 . . 3.830 3.291 2.314 3.762 . 0 0 "[ . 1 . 2]" 1
1841 1 99 SER H 1 99 SER HB3 . . 3.830 2.977 2.311 3.552 . 0 0 "[ . 1 . 2]" 1
1842 1 99 SER HA 1 100 PRO HD2 . . 3.600 2.450 2.255 2.534 . 0 0 "[ . 1 . 2]" 1
1843 1 99 SER HA 1 100 PRO HD3 . . 3.600 2.321 2.258 2.359 . 0 0 "[ . 1 . 2]" 1
1844 1 99 SER QB 1 100 PRO QD . . 3.460 2.130 1.927 3.115 . 0 0 "[ . 1 . 2]" 1
1845 1 99 SER HB2 1 100 PRO HD2 . . 4.930 2.533 1.977 3.833 . 0 0 "[ . 1 . 2]" 1
1846 1 99 SER HB2 1 100 PRO HD3 . . 4.930 3.803 3.331 4.733 . 0 0 "[ . 1 . 2]" 1
1847 1 99 SER HB3 1 100 PRO HD2 . . 4.930 3.072 1.998 3.781 . 0 0 "[ . 1 . 2]" 1
1848 1 99 SER HB3 1 100 PRO HD3 . . 4.930 4.169 3.445 4.803 . 0 0 "[ . 1 . 2]" 1
1849 1 100 PRO HA 1 101 THR H . . 2.870 2.228 2.150 2.491 . 0 0 "[ . 1 . 2]" 1
1850 1 100 PRO HA 1 101 THR HA . . 4.780 4.362 4.321 4.412 . 0 0 "[ . 1 . 2]" 1
1851 1 100 PRO QB 1 101 THR H . . 3.560 3.076 2.342 3.465 . 0 0 "[ . 1 . 2]" 1
1852 1 100 PRO QB 1 102 GLN QE . . 3.610 2.934 2.699 3.177 . 0 0 "[ . 1 . 2]" 1
1853 1 100 PRO HB2 1 101 THR H . . 4.100 3.251 2.391 3.721 . 0 0 "[ . 1 . 2]" 1
1854 1 100 PRO HB2 1 102 GLN HE21 . . 5.160 3.473 3.211 3.683 . 0 0 "[ . 1 . 2]" 1
1855 1 100 PRO HB2 1 102 GLN HE22 . . 5.160 3.282 2.892 3.690 . 0 0 "[ . 1 . 2]" 1
1856 1 100 PRO HB3 1 101 THR H . . 4.100 3.831 3.344 4.131 0.031 19 0 "[ . 1 . 2]" 1
1857 1 100 PRO HB3 1 102 GLN HE21 . . 5.160 5.015 4.844 5.165 0.005 16 0 "[ . 1 . 2]" 1
1858 1 100 PRO HB3 1 102 GLN HE22 . . 5.160 4.780 4.329 5.168 0.008 19 0 "[ . 1 . 2]" 1
1859 1 101 THR H 1 101 THR HB . . 4.010 3.610 3.571 3.640 . 0 0 "[ . 1 . 2]" 1
1860 1 101 THR H 1 101 THR MG . . 3.380 2.404 1.982 2.666 . 0 0 "[ . 1 . 2]" 1
1861 1 101 THR H 1 102 GLN H . . 5.010 4.608 4.514 4.648 . 0 0 "[ . 1 . 2]" 1
1862 1 101 THR HA 1 101 THR MG . . 3.370 2.238 2.098 2.435 . 0 0 "[ . 1 . 2]" 1
1863 1 101 THR HA 1 102 GLN H . . 3.150 2.269 2.145 2.476 . 0 0 "[ . 1 . 2]" 1
1864 1 101 THR HA 1 102 GLN HA . . 4.460 4.401 4.372 4.465 0.005 15 0 "[ . 1 . 2]" 1
1865 1 101 THR HB 1 102 GLN H . . 3.960 2.814 2.233 3.383 . 0 0 "[ . 1 . 2]" 1
1866 1 101 THR MG 1 102 GLN H . . 3.890 3.716 3.525 3.900 0.010 18 0 "[ . 1 . 2]" 1
1867 1 102 GLN H 1 102 GLN HB2 . . 3.970 2.489 2.236 2.713 . 0 0 "[ . 1 . 2]" 1
1868 1 102 GLN H 1 102 GLN HB3 . . 3.970 3.676 3.505 3.819 . 0 0 "[ . 1 . 2]" 1
1869 1 102 GLN H 1 102 GLN HG2 . . 4.390 3.402 2.660 4.390 0.000 5 0 "[ . 1 . 2]" 1
1870 1 102 GLN H 1 102 GLN QG . . 3.860 3.187 2.625 3.828 . 0 0 "[ . 1 . 2]" 1
1871 1 102 GLN H 1 102 GLN HG3 . . 4.390 4.229 4.024 4.393 0.003 12 0 "[ . 1 . 2]" 1
1872 1 102 GLN H 1 103 SER H . . 5.330 4.456 4.221 4.561 . 0 0 "[ . 1 . 2]" 1
1873 1 102 GLN HA 1 102 GLN HE21 . . 4.400 3.130 2.384 3.976 . 0 0 "[ . 1 . 2]" 1
1874 1 102 GLN HA 1 102 GLN HE22 . . 4.400 3.650 3.048 4.149 . 0 0 "[ . 1 . 2]" 1
1875 1 102 GLN HA 1 103 SER H . . 2.930 2.229 2.139 2.488 . 0 0 "[ . 1 . 2]" 1
1876 1 102 GLN QB 1 103 SER H . . 3.640 2.912 2.286 3.320 . 0 0 "[ . 1 . 2]" 1
1877 1 102 GLN HB2 1 103 SER H . . 4.310 4.079 3.614 4.309 . 0 0 "[ . 1 . 2]" 1
1878 1 102 GLN HB3 1 103 SER H . . 4.310 2.986 2.306 3.453 . 0 0 "[ . 1 . 2]" 1
1879 1 103 SER H 1 103 SER HB2 . . 3.800 3.171 2.212 3.664 . 0 0 "[ . 1 . 2]" 1
1880 1 103 SER H 1 103 SER QB . . 2.950 2.451 2.168 2.831 . 0 0 "[ . 1 . 2]" 1
1881 1 103 SER H 1 103 SER HB3 . . 3.800 2.749 2.231 3.568 . 0 0 "[ . 1 . 2]" 1
1882 1 103 SER HA 1 104 PHE H . . 2.970 2.145 2.137 2.172 . 0 0 "[ . 1 . 2]" 1
1883 1 103 SER HA 1 104 PHE HA . . 4.620 4.392 4.387 4.402 . 0 0 "[ . 1 . 2]" 1
1884 1 103 SER QB 1 104 PHE H . . 4.400 3.526 3.241 3.940 . 0 0 "[ . 1 . 2]" 1
1885 1 104 PHE H 1 104 PHE QB . . 3.600 2.606 2.504 2.671 . 0 0 "[ . 1 . 2]" 1
1886 1 104 PHE H 1 105 ARG H . . 4.510 4.448 4.336 4.495 . 0 0 "[ . 1 . 2]" 1
1887 1 104 PHE HA 1 104 PHE QE . . 4.750 4.406 4.189 4.561 . 0 0 "[ . 1 . 2]" 1
1888 1 104 PHE HA 1 105 ARG H . . 3.110 2.374 2.195 2.451 . 0 0 "[ . 1 . 2]" 1
1889 1 104 PHE QB 1 105 ARG H . . 3.970 3.184 3.052 3.562 . 0 0 "[ . 1 . 2]" 1
1890 1 104 PHE HB2 1 105 ARG H . . 4.580 4.008 3.880 4.269 . 0 0 "[ . 1 . 2]" 1
1891 1 104 PHE HB3 1 105 ARG H . . 4.580 3.344 3.180 3.814 . 0 0 "[ . 1 . 2]" 1
1892 1 104 PHE QE 1 105 ARG H . . 4.620 3.875 3.526 4.263 . 0 0 "[ . 1 . 2]" 1
1893 1 104 PHE QE 1 106 PHE QE . . 3.610 2.083 1.996 2.438 . 0 0 "[ . 1 . 2]" 1
1894 1 104 PHE QE 1 106 PHE HZ . . 4.770 4.116 3.501 4.769 . 0 0 "[ . 1 . 2]" 1
1895 1 105 ARG H 1 105 ARG HB2 . . 3.720 3.318 2.401 3.486 . 0 0 "[ . 1 . 2]" 1
1896 1 105 ARG H 1 105 ARG HB3 . . 3.440 2.941 2.717 3.541 0.101 6 0 "[ . 1 . 2]" 1
1897 1 105 ARG H 1 105 ARG HG2 . . 5.000 4.487 4.247 4.623 . 0 0 "[ . 1 . 2]" 1
1898 1 105 ARG H 1 105 ARG QG . . 4.350 4.115 3.461 4.252 . 0 0 "[ . 1 . 2]" 1
1899 1 105 ARG H 1 105 ARG HG3 . . 5.000 4.809 3.666 5.032 0.032 17 0 "[ . 1 . 2]" 1
1900 1 105 ARG H 1 106 PHE H . . 4.750 4.232 4.089 4.443 . 0 0 "[ . 1 . 2]" 1
1901 1 105 ARG HA 1 105 ARG HG2 . . 3.850 2.967 2.204 3.278 . 0 0 "[ . 1 . 2]" 1
1902 1 105 ARG HA 1 105 ARG QG . . 3.370 2.475 2.152 2.623 . 0 0 "[ . 1 . 2]" 1
1903 1 105 ARG HA 1 105 ARG HG3 . . 3.850 2.723 2.500 3.595 . 0 0 "[ . 1 . 2]" 1
1904 1 105 ARG HA 1 106 PHE H . . 2.990 2.183 2.144 2.247 . 0 0 "[ . 1 . 2]" 1
1905 1 105 ARG HA 1 106 PHE HB2 . . 5.500 4.569 4.471 4.670 . 0 0 "[ . 1 . 2]" 1
1906 1 105 ARG HB2 1 106 PHE H . . 4.510 4.147 4.002 4.300 . 0 0 "[ . 1 . 2]" 1
1907 1 105 ARG HB2 1 107 LEU MD2 . . 5.220 5.014 3.861 5.238 0.018 17 0 "[ . 1 . 2]" 1
1908 1 105 ARG HB3 1 105 ARG QD . . 3.430 2.516 2.161 2.979 . 0 0 "[ . 1 . 2]" 1
1909 1 105 ARG HB3 1 105 ARG HE . . 4.970 3.216 2.112 4.654 . 0 0 "[ . 1 . 2]" 1
1910 1 105 ARG HB3 1 106 PHE H . . 4.240 4.047 3.164 4.260 0.020 17 0 "[ . 1 . 2]" 1
1911 1 105 ARG HB3 1 107 LEU MD2 . . 4.430 3.814 2.822 4.130 . 0 0 "[ . 1 . 2]" 1
1912 1 105 ARG HD2 1 107 LEU MD2 . . 4.440 3.266 2.260 4.122 . 0 0 "[ . 1 . 2]" 1
1913 1 105 ARG HD3 1 107 LEU MD2 . . 4.440 3.659 2.233 4.438 . 0 0 "[ . 1 . 2]" 1
1914 1 105 ARG QG 1 107 LEU MD2 . . 4.550 3.163 2.535 4.554 0.004 6 0 "[ . 1 . 2]" 1
1915 1 105 ARG HG2 1 106 PHE H . . 4.840 2.800 2.439 3.566 . 0 0 "[ . 1 . 2]" 1
1916 1 105 ARG HG3 1 106 PHE H . . 4.840 3.247 2.717 4.841 0.001 6 0 "[ . 1 . 2]" 1
1917 1 106 PHE H 1 106 PHE HB2 . . 3.700 2.489 2.399 2.582 . 0 0 "[ . 1 . 2]" 1
1918 1 106 PHE H 1 106 PHE HB3 . . 3.960 3.664 3.621 3.713 . 0 0 "[ . 1 . 2]" 1
1919 1 106 PHE H 1 106 PHE QD . . 4.360 3.355 3.181 3.554 . 0 0 "[ . 1 . 2]" 1
1920 1 106 PHE H 1 107 LEU H . . 4.660 4.478 4.351 4.581 . 0 0 "[ . 1 . 2]" 1
1921 1 106 PHE HA 1 106 PHE QD . . 3.670 2.154 1.995 2.314 . 0 0 "[ . 1 . 2]" 1
1922 1 106 PHE HA 1 107 LEU H . . 3.080 2.172 2.140 2.258 . 0 0 "[ . 1 . 2]" 1
1923 1 106 PHE HA 1 107 LEU HA . . 4.720 4.377 4.366 4.401 . 0 0 "[ . 1 . 2]" 1
1924 1 106 PHE HA 1 107 LEU HB2 . . 4.900 4.745 4.669 4.890 . 0 0 "[ . 1 . 2]" 1
1925 1 106 PHE HA 1 107 LEU MD1 . . 5.060 4.814 4.598 4.972 . 0 0 "[ . 1 . 2]" 1
1926 1 106 PHE HA 1 107 LEU HG . . 4.040 3.559 3.377 3.702 . 0 0 "[ . 1 . 2]" 1
1927 1 106 PHE HB2 1 107 LEU H . . 4.630 4.152 3.893 4.324 . 0 0 "[ . 1 . 2]" 1
1928 1 106 PHE HB3 1 107 LEU H . . 4.290 3.196 2.823 3.450 . 0 0 "[ . 1 . 2]" 1
1929 1 106 PHE QD 1 107 LEU H . . 4.200 3.769 3.589 3.970 . 0 0 "[ . 1 . 2]" 1
1930 1 107 LEU H 1 107 LEU HB2 . . 4.000 2.634 2.552 2.756 . 0 0 "[ . 1 . 2]" 1
1931 1 107 LEU H 1 107 LEU MD1 . . 4.250 3.580 3.320 3.867 . 0 0 "[ . 1 . 2]" 1
1932 1 107 LEU H 1 107 LEU MD2 . . 4.180 3.550 3.219 3.768 . 0 0 "[ . 1 . 2]" 1
1933 1 107 LEU H 1 107 LEU HG . . 3.300 2.346 2.063 2.721 . 0 0 "[ . 1 . 2]" 1
1934 1 107 LEU HA 1 107 LEU MD2 . . 3.300 2.269 2.108 2.465 . 0 0 "[ . 1 . 2]" 1
1935 1 107 LEU HA 1 108 PRO HD2 . . 3.420 2.225 2.175 2.321 . 0 0 "[ . 1 . 2]" 1
1936 1 107 LEU HA 1 108 PRO HD3 . . 3.470 2.257 2.253 2.274 . 0 0 "[ . 1 . 2]" 1
1937 1 107 LEU HA 1 108 PRO HG2 . . 4.460 4.372 4.332 4.449 . 0 0 "[ . 1 . 2]" 1
1938 1 107 LEU HA 1 108 PRO HG3 . . 4.640 4.380 4.358 4.427 . 0 0 "[ . 1 . 2]" 1
1939 1 107 LEU HB2 1 107 LEU MD1 . . 3.360 2.196 2.080 2.278 . 0 0 "[ . 1 . 2]" 1
1940 1 107 LEU HB2 1 107 LEU MD2 . . 3.460 3.168 3.139 3.189 . 0 0 "[ . 1 . 2]" 1
1941 1 107 LEU HB2 1 108 PRO HD2 . . 3.950 3.734 3.514 3.878 . 0 0 "[ . 1 . 2]" 1
1942 1 107 LEU HB2 1 108 PRO HD3 . . 4.820 4.742 4.602 4.830 0.010 17 0 "[ . 1 . 2]" 1
1943 1 107 LEU HB3 1 108 PRO HD2 . . 4.790 2.330 2.110 2.462 . 0 0 "[ . 1 . 2]" 1
1944 1 107 LEU MD1 1 108 PRO HD2 . . 4.780 4.392 4.257 4.593 . 0 0 "[ . 1 . 2]" 1
1945 1 107 LEU MD2 1 108 PRO HD2 . . 3.870 2.917 2.717 3.215 . 0 0 "[ . 1 . 2]" 1
1946 1 107 LEU MD2 1 108 PRO HD3 . . 4.000 3.652 3.468 3.858 . 0 0 "[ . 1 . 2]" 1
1947 1 108 PRO HA 1 109 VAL H . . 3.070 2.187 2.152 2.259 . 0 0 "[ . 1 . 2]" 1
1948 1 108 PRO HA 1 109 VAL MG2 . . 4.270 3.580 3.164 3.780 . 0 0 "[ . 1 . 2]" 1
1949 1 108 PRO HA 1 110 ILE H . . 4.770 3.788 3.546 4.061 . 0 0 "[ . 1 . 2]" 1
1950 1 108 PRO HB2 1 109 VAL H . . 4.200 3.403 3.014 4.011 . 0 0 "[ . 1 . 2]" 1
1951 1 108 PRO HB2 1 110 ILE H . . 3.890 3.178 2.239 3.878 . 0 0 "[ . 1 . 2]" 1
1952 1 109 VAL H 1 109 VAL HB . . 3.890 2.786 2.488 3.780 . 0 0 "[ . 1 . 2]" 1
1953 1 109 VAL H 1 109 VAL MG1 . . 4.060 3.593 2.461 3.838 . 0 0 "[ . 1 . 2]" 1
1954 1 109 VAL H 1 109 VAL MG2 . . 3.290 2.191 1.878 2.663 . 0 0 "[ . 1 . 2]" 1
1955 1 109 VAL H 1 110 ILE H . . 3.510 2.385 1.835 2.875 . 0 0 "[ . 1 . 2]" 1
1956 1 109 VAL HA 1 109 VAL MG1 . . 3.300 2.337 2.237 2.454 . 0 0 "[ . 1 . 2]" 1
1957 1 109 VAL HA 1 109 VAL MG2 . . 3.430 2.569 2.291 3.186 . 0 0 "[ . 1 . 2]" 1
1958 1 109 VAL HA 1 110 ILE H . . 3.530 3.423 2.983 3.546 0.016 15 0 "[ . 1 . 2]" 1
1959 1 109 VAL HA 1 110 ILE HB . . 5.500 5.463 4.766 5.524 0.024 7 0 "[ . 1 . 2]" 1
1960 1 109 VAL HB 1 110 ILE H . . 4.000 3.200 2.544 4.021 0.021 16 0 "[ . 1 . 2]" 1
1961 1 109 VAL MG1 1 110 ILE H . . 4.190 3.821 3.442 4.238 0.048 16 0 "[ . 1 . 2]" 1
1962 1 109 VAL MG2 1 110 ILE H . . 4.080 3.566 2.026 4.113 0.033 16 0 "[ . 1 . 2]" 1
1963 1 110 ILE H 1 110 ILE HB . . 3.370 2.697 2.509 3.404 0.034 15 0 "[ . 1 . 2]" 1
1964 1 110 ILE H 1 110 ILE HG12 . . 3.970 3.474 3.188 3.918 . 0 0 "[ . 1 . 2]" 1
1965 1 110 ILE H 1 110 ILE HG13 . . 3.970 2.041 1.889 2.553 . 0 0 "[ . 1 . 2]" 1
1966 1 110 ILE H 1 110 ILE MG . . 3.830 3.794 3.773 3.934 0.104 15 0 "[ . 1 . 2]" 1
1967 1 110 ILE H 1 111 CYS H . . 4.440 3.755 2.888 4.514 0.074 2 0 "[ . 1 . 2]" 1
1968 1 110 ILE HA 1 110 ILE MD . . 4.030 3.866 3.805 3.889 . 0 0 "[ . 1 . 2]" 1
1969 1 110 ILE HA 1 110 ILE QG . . 3.720 2.431 2.338 2.469 . 0 0 "[ . 1 . 2]" 1
1970 1 110 ILE HA 1 110 ILE MG . . 3.390 2.413 2.323 2.473 . 0 0 "[ . 1 . 2]" 1
1971 1 110 ILE HA 1 111 CYS H . . 3.550 2.800 2.145 3.550 0.000 9 0 "[ . 1 . 2]" 1
1972 1 110 ILE HB 1 110 ILE MD . . 3.690 2.263 2.098 2.381 . 0 0 "[ . 1 . 2]" 1
1973 1 110 ILE HB 1 111 CYS H . . 4.180 3.494 2.534 4.322 0.142 15 0 "[ . 1 . 2]" 1
1974 1 110 ILE HG12 1 110 ILE MG . . 3.530 2.196 2.057 2.398 . 0 0 "[ . 1 . 2]" 1
1975 1 110 ILE HG13 1 110 ILE MG . . 3.530 3.164 3.136 3.198 . 0 0 "[ . 1 . 2]" 1
1976 1 110 ILE MG 1 111 CYS H . . 3.790 2.987 2.383 3.911 0.121 15 0 "[ . 1 . 2]" 1
1977 1 111 CYS H 1 111 CYS QB . . 3.540 2.584 2.210 3.205 . 0 0 "[ . 1 . 2]" 1
1978 1 111 CYS QB 1 112 LYS H . . 4.010 3.193 1.927 3.964 . 0 0 "[ . 1 . 2]" 1
1979 1 112 LYS H 1 112 LYS HB2 . . 3.790 2.814 2.184 3.729 . 0 0 "[ . 1 . 2]" 1
1980 1 112 LYS H 1 112 LYS QB . . 3.310 2.438 2.163 3.008 . 0 0 "[ . 1 . 2]" 1
1981 1 112 LYS H 1 112 LYS HB3 . . 3.790 3.065 2.394 3.659 . 0 0 "[ . 1 . 2]" 1
1982 1 112 LYS H 1 112 LYS QG . . 4.170 3.166 1.904 4.102 . 0 0 "[ . 1 . 2]" 1
1983 1 112 LYS HA 1 113 GLU H . . 3.330 2.227 2.141 2.472 . 0 0 "[ . 1 . 2]" 1
1984 1 112 LYS QG 1 113 GLU H . . 5.490 3.636 1.896 4.388 . 0 0 "[ . 1 . 2]" 1
1985 1 113 GLU H 1 113 GLU QB . . 3.600 2.587 2.248 3.358 . 0 0 "[ . 1 . 2]" 1
1986 1 113 GLU H 1 113 GLU QG . . 4.770 3.544 2.101 4.314 . 0 0 "[ . 1 . 2]" 1
1987 1 113 GLU HA 1 114 GLU H . . 3.530 2.651 2.141 3.538 0.008 3 0 "[ . 1 . 2]" 1
1988 1 113 GLU QB 1 114 GLU H . . 4.410 3.220 2.136 3.927 . 0 0 "[ . 1 . 2]" 1
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