NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
401073 |
1v9w   |
10080 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1v9w
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 2993
_Distance_constraint_stats_list.Viol_count 681
_Distance_constraint_stats_list.Viol_total 218.439
_Distance_constraint_stats_list.Viol_max 0.227
_Distance_constraint_stats_list.Viol_rms 0.0033
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0160
_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 5 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 MET 0.048 0.048 3 0 "[ . 1 . 2]"
1 9 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 THR 0.037 0.012 19 0 "[ . 1 . 2]"
1 11 PHE 0.050 0.012 19 0 "[ . 1 . 2]"
1 12 GLU 0.005 0.005 15 0 "[ . 1 . 2]"
1 13 GLU 0.008 0.003 15 0 "[ . 1 . 2]"
1 14 VAL 0.009 0.003 15 0 "[ . 1 . 2]"
1 15 SER 0.013 0.010 8 0 "[ . 1 . 2]"
1 16 VAL 0.020 0.010 8 0 "[ . 1 . 2]"
1 17 LEU 0.005 0.004 5 0 "[ . 1 . 2]"
1 18 GLY 0.006 0.006 12 0 "[ . 1 . 2]"
1 19 PHE 0.000 0.000 8 0 "[ . 1 . 2]"
1 20 GLU 0.044 0.044 8 0 "[ . 1 . 2]"
1 21 GLU 0.007 0.002 4 0 "[ . 1 . 2]"
1 22 PHE 0.013 0.003 3 0 "[ . 1 . 2]"
1 23 ASP 0.031 0.028 14 0 "[ . 1 . 2]"
1 24 LYS 0.005 0.002 12 0 "[ . 1 . 2]"
1 25 ALA 0.048 0.015 8 0 "[ . 1 . 2]"
1 26 VAL 0.069 0.015 8 0 "[ . 1 . 2]"
1 27 LYS 0.278 0.107 13 0 "[ . 1 . 2]"
1 28 GLU 0.001 0.001 9 0 "[ . 1 . 2]"
1 29 HIS 0.024 0.007 15 0 "[ . 1 . 2]"
1 30 GLU 0.082 0.017 8 0 "[ . 1 . 2]"
1 31 SER 0.059 0.023 17 0 "[ . 1 . 2]"
1 32 LYS 0.501 0.097 17 0 "[ . 1 . 2]"
1 33 THR 0.007 0.007 15 0 "[ . 1 . 2]"
1 34 ILE 0.021 0.007 9 0 "[ . 1 . 2]"
1 35 PHE 0.019 0.006 16 0 "[ . 1 . 2]"
1 36 ALA 0.022 0.006 6 0 "[ . 1 . 2]"
1 37 TYR 0.026 0.006 16 0 "[ . 1 . 2]"
1 38 PHE 0.013 0.005 15 0 "[ . 1 . 2]"
1 39 SER 0.006 0.004 7 0 "[ . 1 . 2]"
1 40 GLY 0.003 0.003 1 0 "[ . 1 . 2]"
1 41 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 LYS 0.004 0.002 17 0 "[ . 1 . 2]"
1 43 ASP 0.060 0.013 6 0 "[ . 1 . 2]"
1 44 THR 0.075 0.013 6 0 "[ . 1 . 2]"
1 45 GLU 0.004 0.004 17 0 "[ . 1 . 2]"
1 46 GLY 0.013 0.008 17 0 "[ . 1 . 2]"
1 47 LYS 0.059 0.029 17 0 "[ . 1 . 2]"
1 48 SER 0.071 0.018 18 0 "[ . 1 . 2]"
1 49 TRP 0.002 0.001 9 0 "[ . 1 . 2]"
1 50 CYS 0.054 0.051 5 0 "[ . 1 . 2]"
1 51 PRO 0.007 0.003 5 0 "[ . 1 . 2]"
1 52 ASP 0.373 0.138 19 0 "[ . 1 . 2]"
1 53 CYS 0.471 0.062 8 0 "[ . 1 . 2]"
1 54 VAL 0.494 0.062 8 0 "[ . 1 . 2]"
1 55 GLU 0.390 0.138 19 0 "[ . 1 . 2]"
1 56 ALA 0.000 0.000 15 0 "[ . 1 . 2]"
1 57 GLU 0.430 0.227 3 0 "[ . 1 . 2]"
1 58 PRO 0.203 0.040 3 0 "[ . 1 . 2]"
1 59 VAL 0.180 0.040 3 0 "[ . 1 . 2]"
1 60 ILE 0.152 0.034 3 0 "[ . 1 . 2]"
1 61 ARG 0.706 0.117 20 0 "[ . 1 . 2]"
1 62 GLU 0.001 0.001 15 0 "[ . 1 . 2]"
1 63 GLY 0.001 0.001 2 0 "[ . 1 . 2]"
1 64 LEU 0.040 0.012 8 0 "[ . 1 . 2]"
1 65 LYS 0.679 0.117 1 0 "[ . 1 . 2]"
1 66 HIS 0.072 0.014 2 0 "[ . 1 . 2]"
1 67 VAL 0.028 0.006 7 0 "[ . 1 . 2]"
1 68 THR 1.109 0.104 18 0 "[ . 1 . 2]"
1 69 GLU 0.125 0.044 12 0 "[ . 1 . 2]"
1 70 ASP 0.014 0.007 5 0 "[ . 1 . 2]"
1 71 CYS 0.088 0.012 4 0 "[ . 1 . 2]"
1 72 VAL 0.084 0.012 4 0 "[ . 1 . 2]"
1 73 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 ILE 0.026 0.004 10 0 "[ . 1 . 2]"
1 75 TYR 0.026 0.009 15 0 "[ . 1 . 2]"
1 76 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 GLN 0.014 0.004 12 0 "[ . 1 . 2]"
1 78 VAL 0.013 0.006 12 0 "[ . 1 . 2]"
1 79 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 ASP 0.016 0.016 9 0 "[ . 1 . 2]"
1 81 LYS 0.037 0.023 15 0 "[ . 1 . 2]"
1 82 PRO 0.016 0.016 9 0 "[ . 1 . 2]"
1 83 TYR 0.024 0.013 15 0 "[ . 1 . 2]"
1 84 TRP 0.053 0.027 12 0 "[ . 1 . 2]"
1 85 LYS 0.053 0.023 15 0 "[ . 1 . 2]"
1 86 ASP 0.013 0.013 15 0 "[ . 1 . 2]"
1 87 PRO 0.054 0.016 11 0 "[ . 1 . 2]"
1 88 ASN 0.051 0.016 11 0 "[ . 1 . 2]"
1 89 ASN 0.057 0.011 14 0 "[ . 1 . 2]"
1 90 ASP 0.035 0.011 14 0 "[ . 1 . 2]"
1 91 PHE 0.019 0.005 15 0 "[ . 1 . 2]"
1 92 ARG 0.034 0.008 1 0 "[ . 1 . 2]"
1 93 GLN 0.042 0.008 1 0 "[ . 1 . 2]"
1 94 LYS 0.574 0.114 2 0 "[ . 1 . 2]"
1 95 LEU 0.021 0.005 15 0 "[ . 1 . 2]"
1 96 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 ILE 0.004 0.001 2 0 "[ . 1 . 2]"
1 98 THR 0.067 0.036 20 0 "[ . 1 . 2]"
1 99 ALA 0.313 0.024 2 0 "[ . 1 . 2]"
1 100 VAL 0.006 0.003 1 0 "[ . 1 . 2]"
1 101 PRO 0.361 0.042 2 0 "[ . 1 . 2]"
1 102 THR 0.109 0.033 2 0 "[ . 1 . 2]"
1 103 LEU 0.262 0.024 2 0 "[ . 1 . 2]"
1 104 LEU 0.102 0.023 2 0 "[ . 1 . 2]"
1 105 LYS 0.172 0.108 5 0 "[ . 1 . 2]"
1 106 TYR 0.109 0.034 5 0 "[ . 1 . 2]"
1 107 GLY 0.023 0.012 15 0 "[ . 1 . 2]"
1 108 THR 0.005 0.004 9 0 "[ . 1 . 2]"
1 109 PRO 0.001 0.001 8 0 "[ . 1 . 2]"
1 110 GLN 0.032 0.015 2 0 "[ . 1 . 2]"
1 111 LYS 0.108 0.033 2 0 "[ . 1 . 2]"
1 112 LEU 0.004 0.004 5 0 "[ . 1 . 2]"
1 113 VAL 0.754 0.046 18 0 "[ . 1 . 2]"
1 114 GLU 1.706 0.046 18 0 "[ . 1 . 2]"
1 115 SER 0.161 0.020 11 0 "[ . 1 . 2]"
1 116 GLU 0.007 0.006 1 0 "[ . 1 . 2]"
1 117 CYS 0.031 0.008 3 0 "[ . 1 . 2]"
1 118 CYS 0.061 0.015 10 0 "[ . 1 . 2]"
1 119 GLN 1.618 0.146 11 0 "[ . 1 . 2]"
1 120 SER 1.577 0.146 11 0 "[ . 1 . 2]"
1 121 SER 0.243 0.064 15 0 "[ . 1 . 2]"
1 122 LEU 0.048 0.011 10 0 "[ . 1 . 2]"
1 123 VAL 0.186 0.019 1 0 "[ . 1 . 2]"
1 124 GLU 0.002 0.002 18 0 "[ . 1 . 2]"
1 125 MET 0.155 0.036 20 0 "[ . 1 . 2]"
1 126 ILE 0.063 0.014 19 0 "[ . 1 . 2]"
1 127 PHE 0.008 0.005 16 0 "[ . 1 . 2]"
1 128 SER 0.103 0.043 14 0 "[ . 1 . 2]"
1 129 GLU 0.002 0.002 20 0 "[ . 1 . 2]"
1 130 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 5 ALA HA 1 6 ALA H . . 3.230 2.365 2.141 2.925 . 0 0 "[ . 1 . 2]" 1
2 1 5 ALA MB 1 6 ALA H . . 3.890 3.213 2.502 3.718 . 0 0 "[ . 1 . 2]" 1
3 1 6 ALA H 1 7 THR H . . 5.060 4.153 2.688 4.630 . 0 0 "[ . 1 . 2]" 1
4 1 6 ALA HA 1 7 THR H . . 3.090 2.272 2.141 2.837 . 0 0 "[ . 1 . 2]" 1
5 1 6 ALA MB 1 7 THR H . . 4.090 3.121 2.383 3.683 . 0 0 "[ . 1 . 2]" 1
6 1 7 THR H 1 7 THR HB . . 3.790 3.237 2.583 3.758 . 0 0 "[ . 1 . 2]" 1
7 1 7 THR H 1 7 THR MG . . 4.020 3.060 2.016 3.975 . 0 0 "[ . 1 . 2]" 1
8 1 7 THR H 1 8 MET H . . 5.310 3.865 1.995 4.597 . 0 0 "[ . 1 . 2]" 1
9 1 7 THR HA 1 7 THR MG . . 3.680 2.466 2.151 3.205 . 0 0 "[ . 1 . 2]" 1
10 1 7 THR HA 1 8 MET H . . 3.310 2.441 2.143 3.308 . 0 0 "[ . 1 . 2]" 1
11 1 7 THR HB 1 8 MET H . . 4.270 3.879 2.700 4.269 . 0 0 "[ . 1 . 2]" 1
12 1 7 THR MG 1 8 MET H . . 4.480 3.610 2.262 4.252 . 0 0 "[ . 1 . 2]" 1
13 1 8 MET H 1 8 MET HB2 . . 3.990 2.720 2.169 3.939 . 0 0 "[ . 1 . 2]" 1
14 1 8 MET H 1 8 MET QB . . 3.210 2.509 2.118 3.202 . 0 0 "[ . 1 . 2]" 1
15 1 8 MET H 1 8 MET HB3 . . 3.990 3.461 2.514 3.837 . 0 0 "[ . 1 . 2]" 1
16 1 8 MET H 1 8 MET HG2 . . 4.790 3.598 2.454 4.616 . 0 0 "[ . 1 . 2]" 1
17 1 8 MET H 1 8 MET QG . . 3.970 3.045 2.060 4.018 0.048 3 0 "[ . 1 . 2]" 1
18 1 8 MET H 1 8 MET HG3 . . 4.790 3.670 2.074 4.617 . 0 0 "[ . 1 . 2]" 1
19 1 8 MET HA 1 9 ALA H . . 2.690 2.346 2.181 2.571 . 0 0 "[ . 1 . 2]" 1
20 1 8 MET QB 1 9 ALA H . . 3.720 2.657 2.136 3.206 . 0 0 "[ . 1 . 2]" 1
21 1 8 MET QB 1 9 ALA MB . . 4.260 4.037 3.495 4.259 . 0 0 "[ . 1 . 2]" 1
22 1 8 MET HB2 1 9 ALA H . . 4.320 3.650 2.202 4.271 . 0 0 "[ . 1 . 2]" 1
23 1 8 MET HB3 1 9 ALA H . . 4.320 2.970 2.153 4.037 . 0 0 "[ . 1 . 2]" 1
24 1 8 MET QG 1 9 ALA H . . 4.980 3.617 1.902 4.412 . 0 0 "[ . 1 . 2]" 1
25 1 9 ALA H 1 9 ALA MB . . 2.880 2.135 2.025 2.398 . 0 0 "[ . 1 . 2]" 1
26 1 9 ALA H 1 67 VAL MG1 . . 5.010 4.641 4.218 4.959 . 0 0 "[ . 1 . 2]" 1
27 1 9 ALA HA 1 10 THR H . . 2.660 2.421 2.192 2.602 . 0 0 "[ . 1 . 2]" 1
28 1 9 ALA HA 1 70 ASP HA . . 4.770 3.913 3.239 4.436 . 0 0 "[ . 1 . 2]" 1
29 1 9 ALA MB 1 10 THR H . . 3.300 2.467 2.188 3.000 . 0 0 "[ . 1 . 2]" 1
30 1 9 ALA MB 1 11 PHE H . . 5.180 4.803 4.667 5.080 . 0 0 "[ . 1 . 2]" 1
31 1 9 ALA MB 1 11 PHE QB . . 5.090 4.342 4.083 4.732 . 0 0 "[ . 1 . 2]" 1
32 1 9 ALA MB 1 11 PHE QD . . 5.350 5.082 4.766 5.347 . 0 0 "[ . 1 . 2]" 1
33 1 9 ALA MB 1 67 VAL MG1 . . 3.590 2.117 1.813 2.469 . 0 0 "[ . 1 . 2]" 1
34 1 9 ALA MB 1 68 THR HA . . 4.270 2.353 1.974 2.740 . 0 0 "[ . 1 . 2]" 1
35 1 9 ALA MB 1 69 GLU H . . 4.070 2.456 2.129 2.805 . 0 0 "[ . 1 . 2]" 1
36 1 9 ALA MB 1 69 GLU HA . . 3.610 3.320 2.994 3.544 . 0 0 "[ . 1 . 2]" 1
37 1 9 ALA MB 1 70 ASP H . . 4.020 3.479 2.890 4.018 . 0 0 "[ . 1 . 2]" 1
38 1 9 ALA MB 1 70 ASP HA . . 3.900 3.339 2.935 3.709 . 0 0 "[ . 1 . 2]" 1
39 1 9 ALA MB 1 70 ASP QB . . 5.340 4.265 3.584 4.837 . 0 0 "[ . 1 . 2]" 1
40 1 10 THR H 1 10 THR HB . . 4.010 3.791 3.620 3.952 . 0 0 "[ . 1 . 2]" 1
41 1 10 THR H 1 10 THR MG . . 3.470 3.119 2.979 3.306 . 0 0 "[ . 1 . 2]" 1
42 1 10 THR H 1 11 PHE H . . 4.340 4.292 4.206 4.344 0.004 15 0 "[ . 1 . 2]" 1
43 1 10 THR H 1 70 ASP HA . . 3.470 2.145 1.907 2.540 . 0 0 "[ . 1 . 2]" 1
44 1 10 THR H 1 70 ASP QB . . 4.560 3.036 2.389 3.593 . 0 0 "[ . 1 . 2]" 1
45 1 10 THR H 1 71 CYS H . . 4.100 3.773 3.435 4.037 . 0 0 "[ . 1 . 2]" 1
46 1 10 THR HA 1 10 THR MG . . 3.180 2.241 2.133 2.368 . 0 0 "[ . 1 . 2]" 1
47 1 10 THR HA 1 11 PHE H . . 2.820 2.157 2.143 2.231 . 0 0 "[ . 1 . 2]" 1
48 1 10 THR HA 1 11 PHE QD . . 4.790 4.056 3.242 4.548 . 0 0 "[ . 1 . 2]" 1
49 1 10 THR HA 1 70 ASP QB . . 5.320 5.056 4.688 5.308 . 0 0 "[ . 1 . 2]" 1
50 1 10 THR HB 1 11 PHE H . . 3.390 3.262 2.869 3.386 . 0 0 "[ . 1 . 2]" 1
51 1 10 THR HB 1 70 ASP HA . . 4.710 4.575 4.288 4.706 . 0 0 "[ . 1 . 2]" 1
52 1 10 THR MG 1 11 PHE H . . 3.950 3.834 3.566 3.940 . 0 0 "[ . 1 . 2]" 1
53 1 10 THR MG 1 11 PHE HA . . 5.500 5.475 5.363 5.512 0.012 19 0 "[ . 1 . 2]" 1
54 1 10 THR MG 1 70 ASP QB . . 4.560 3.764 3.299 4.274 . 0 0 "[ . 1 . 2]" 1
55 1 11 PHE H 1 11 PHE QB . . 3.460 2.714 2.620 2.928 . 0 0 "[ . 1 . 2]" 1
56 1 11 PHE H 1 11 PHE QD . . 3.310 2.665 2.215 3.118 . 0 0 "[ . 1 . 2]" 1
57 1 11 PHE H 1 11 PHE QE . . 4.880 4.473 4.026 4.693 . 0 0 "[ . 1 . 2]" 1
58 1 11 PHE H 1 12 GLU H . . 4.640 4.401 4.287 4.525 . 0 0 "[ . 1 . 2]" 1
59 1 11 PHE H 1 67 VAL MG1 . . 4.870 4.489 4.112 4.761 . 0 0 "[ . 1 . 2]" 1
60 1 11 PHE H 1 71 CYS H . . 5.460 5.196 5.026 5.341 . 0 0 "[ . 1 . 2]" 1
61 1 11 PHE HA 1 11 PHE QD . . 4.270 3.630 3.507 3.719 . 0 0 "[ . 1 . 2]" 1
62 1 11 PHE HA 1 12 GLU H . . 2.910 2.198 2.142 2.327 . 0 0 "[ . 1 . 2]" 1
63 1 11 PHE HA 1 12 GLU HA . . 4.670 4.406 4.388 4.464 . 0 0 "[ . 1 . 2]" 1
64 1 11 PHE HA 1 12 GLU QB . . 4.450 4.008 3.921 4.071 . 0 0 "[ . 1 . 2]" 1
65 1 11 PHE HA 1 70 ASP HA . . 4.700 4.504 4.197 4.704 0.004 2 0 "[ . 1 . 2]" 1
66 1 11 PHE HA 1 71 CYS H . . 3.510 3.303 3.064 3.485 . 0 0 "[ . 1 . 2]" 1
67 1 11 PHE HA 1 72 VAL HA . . 4.780 3.733 3.432 4.037 . 0 0 "[ . 1 . 2]" 1
68 1 11 PHE HA 1 72 VAL MG2 . . 5.200 4.411 4.071 4.663 . 0 0 "[ . 1 . 2]" 1
69 1 11 PHE QB 1 12 GLU H . . 3.480 3.106 2.660 3.371 . 0 0 "[ . 1 . 2]" 1
70 1 11 PHE QB 1 12 GLU QB . . 5.060 4.922 4.655 5.056 . 0 0 "[ . 1 . 2]" 1
71 1 11 PHE QB 1 64 LEU QD . . 4.130 3.009 2.503 3.398 . 0 0 "[ . 1 . 2]" 1
72 1 11 PHE QB 1 65 LYS QG . . 4.880 4.802 4.585 4.882 0.002 3 0 "[ . 1 . 2]" 1
73 1 11 PHE QB 1 67 VAL MG1 . . 3.720 2.668 2.388 2.898 . 0 0 "[ . 1 . 2]" 1
74 1 11 PHE QB 1 67 VAL MG2 . . 4.670 4.441 4.123 4.654 . 0 0 "[ . 1 . 2]" 1
75 1 11 PHE QB 1 71 CYS H . . 4.820 4.157 3.934 4.307 . 0 0 "[ . 1 . 2]" 1
76 1 11 PHE QD 1 12 GLU H . . 4.320 3.399 2.601 3.859 . 0 0 "[ . 1 . 2]" 1
77 1 11 PHE QD 1 13 GLU H . . 4.850 3.998 3.496 4.457 . 0 0 "[ . 1 . 2]" 1
78 1 11 PHE QD 1 13 GLU HA . . 4.700 4.181 3.946 4.447 . 0 0 "[ . 1 . 2]" 1
79 1 11 PHE QD 1 13 GLU HB2 . . 4.810 3.861 3.609 4.124 . 0 0 "[ . 1 . 2]" 1
80 1 11 PHE QD 1 64 LEU QB . . 4.590 3.537 3.038 3.900 . 0 0 "[ . 1 . 2]" 1
81 1 11 PHE QD 1 64 LEU MD1 . . 4.400 3.745 2.634 4.243 . 0 0 "[ . 1 . 2]" 1
82 1 11 PHE QD 1 64 LEU QD . . 3.850 3.402 2.542 3.772 . 0 0 "[ . 1 . 2]" 1
83 1 11 PHE QD 1 64 LEU MD2 . . 4.400 3.954 3.351 4.359 . 0 0 "[ . 1 . 2]" 1
84 1 11 PHE QD 1 65 LYS QG . . 4.350 3.805 3.154 4.292 . 0 0 "[ . 1 . 2]" 1
85 1 11 PHE QD 1 67 VAL MG1 . . 4.330 3.973 3.638 4.197 . 0 0 "[ . 1 . 2]" 1
86 1 11 PHE QD 1 73 PHE H . . 4.510 4.021 3.697 4.302 . 0 0 "[ . 1 . 2]" 1
87 1 11 PHE QD 1 73 PHE HB2 . . 4.310 3.671 3.200 3.951 . 0 0 "[ . 1 . 2]" 1
88 1 11 PHE QD 1 73 PHE HB3 . . 4.090 3.784 3.294 4.089 . 0 0 "[ . 1 . 2]" 1
89 1 11 PHE QE 1 13 GLU HB2 . . 4.100 2.913 2.629 3.221 . 0 0 "[ . 1 . 2]" 1
90 1 11 PHE QE 1 13 GLU HB3 . . 4.810 4.527 3.766 4.805 . 0 0 "[ . 1 . 2]" 1
91 1 11 PHE QE 1 13 GLU QG . . 5.290 3.901 3.391 4.485 . 0 0 "[ . 1 . 2]" 1
92 1 11 PHE QE 1 64 LEU QB . . 4.630 4.299 3.865 4.634 0.004 3 0 "[ . 1 . 2]" 1
93 1 11 PHE QE 1 64 LEU QD . . 4.880 4.162 3.294 4.637 . 0 0 "[ . 1 . 2]" 1
94 1 12 GLU H 1 12 GLU QB . . 3.100 2.497 2.407 2.610 . 0 0 "[ . 1 . 2]" 1
95 1 12 GLU H 1 12 GLU QG . . 4.620 4.080 3.981 4.183 . 0 0 "[ . 1 . 2]" 1
96 1 12 GLU H 1 13 GLU H . . 4.860 4.354 4.084 4.441 . 0 0 "[ . 1 . 2]" 1
97 1 12 GLU H 1 71 CYS H . . 5.110 4.854 4.596 5.115 0.005 15 0 "[ . 1 . 2]" 1
98 1 12 GLU H 1 72 VAL HA . . 3.420 2.323 2.169 2.540 . 0 0 "[ . 1 . 2]" 1
99 1 12 GLU H 1 72 VAL MG1 . . 4.570 3.651 3.374 3.992 . 0 0 "[ . 1 . 2]" 1
100 1 12 GLU H 1 72 VAL MG2 . . 4.280 3.617 3.295 4.007 . 0 0 "[ . 1 . 2]" 1
101 1 12 GLU H 1 73 PHE H . . 4.020 2.683 2.237 2.976 . 0 0 "[ . 1 . 2]" 1
102 1 12 GLU HA 1 12 GLU HG2 . . 4.210 3.626 3.017 3.853 . 0 0 "[ . 1 . 2]" 1
103 1 12 GLU HA 1 12 GLU QG . . 3.620 2.798 2.366 3.032 . 0 0 "[ . 1 . 2]" 1
104 1 12 GLU HA 1 12 GLU HG3 . . 4.210 2.919 2.417 3.203 . 0 0 "[ . 1 . 2]" 1
105 1 12 GLU HA 1 13 GLU H . . 2.840 2.165 2.140 2.218 . 0 0 "[ . 1 . 2]" 1
106 1 12 GLU QB 1 13 GLU H . . 3.930 3.717 3.580 3.872 . 0 0 "[ . 1 . 2]" 1
107 1 12 GLU QB 1 14 VAL MG2 . . 3.840 3.445 3.078 3.659 . 0 0 "[ . 1 . 2]" 1
108 1 12 GLU QB 1 72 VAL HA . . 3.840 2.610 2.282 2.880 . 0 0 "[ . 1 . 2]" 1
109 1 12 GLU QB 1 72 VAL MG1 . . 3.670 2.115 1.981 2.372 . 0 0 "[ . 1 . 2]" 1
110 1 12 GLU QB 1 72 VAL MG2 . . 3.620 2.694 2.396 2.975 . 0 0 "[ . 1 . 2]" 1
111 1 12 GLU QB 1 73 PHE H . . 4.420 3.722 3.430 4.113 . 0 0 "[ . 1 . 2]" 1
112 1 12 GLU QG 1 13 GLU H . . 4.050 2.819 2.475 3.111 . 0 0 "[ . 1 . 2]" 1
113 1 12 GLU QG 1 14 VAL H . . 5.160 4.362 3.815 4.677 . 0 0 "[ . 1 . 2]" 1
114 1 12 GLU QG 1 14 VAL MG2 . . 3.650 2.419 2.184 2.695 . 0 0 "[ . 1 . 2]" 1
115 1 12 GLU QG 1 72 VAL MG1 . . 4.690 2.780 2.531 3.159 . 0 0 "[ . 1 . 2]" 1
116 1 12 GLU QG 1 72 VAL MG2 . . 4.250 3.842 3.407 4.199 . 0 0 "[ . 1 . 2]" 1
117 1 12 GLU HG2 1 13 GLU H . . 4.650 4.067 2.756 4.622 . 0 0 "[ . 1 . 2]" 1
118 1 12 GLU HG2 1 14 VAL MG2 . . 4.180 3.002 2.203 3.631 . 0 0 "[ . 1 . 2]" 1
119 1 12 GLU HG2 1 72 VAL MG2 . . 4.930 4.076 3.590 4.575 . 0 0 "[ . 1 . 2]" 1
120 1 12 GLU HG3 1 13 GLU H . . 4.650 2.937 2.493 3.481 . 0 0 "[ . 1 . 2]" 1
121 1 12 GLU HG3 1 14 VAL MG2 . . 4.180 2.832 2.291 3.805 . 0 0 "[ . 1 . 2]" 1
122 1 12 GLU HG3 1 72 VAL MG2 . . 4.930 4.726 4.242 4.913 . 0 0 "[ . 1 . 2]" 1
123 1 13 GLU H 1 13 GLU HB2 . . 3.570 2.488 2.396 2.789 . 0 0 "[ . 1 . 2]" 1
124 1 13 GLU H 1 13 GLU HB3 . . 3.380 2.784 2.404 2.842 . 0 0 "[ . 1 . 2]" 1
125 1 13 GLU H 1 13 GLU QG . . 4.460 4.015 3.944 4.116 . 0 0 "[ . 1 . 2]" 1
126 1 13 GLU H 1 14 VAL H . . 4.520 4.421 4.129 4.513 . 0 0 "[ . 1 . 2]" 1
127 1 13 GLU H 1 14 VAL MG2 . . 5.010 4.195 4.049 4.356 . 0 0 "[ . 1 . 2]" 1
128 1 13 GLU HA 1 13 GLU HG2 . . 4.240 2.541 2.206 3.741 . 0 0 "[ . 1 . 2]" 1
129 1 13 GLU HA 1 13 GLU QG . . 3.490 2.388 2.183 3.114 . 0 0 "[ . 1 . 2]" 1
130 1 13 GLU HA 1 13 GLU HG3 . . 4.240 3.286 2.597 3.696 . 0 0 "[ . 1 . 2]" 1
131 1 13 GLU HA 1 14 VAL H . . 2.910 2.149 2.139 2.184 . 0 0 "[ . 1 . 2]" 1
132 1 13 GLU HA 1 14 VAL HB . . 4.840 4.625 4.528 4.730 . 0 0 "[ . 1 . 2]" 1
133 1 13 GLU HA 1 14 VAL MG2 . . 4.560 3.733 3.575 3.978 . 0 0 "[ . 1 . 2]" 1
134 1 13 GLU HA 1 72 VAL MG1 . . 4.850 4.456 4.021 4.818 . 0 0 "[ . 1 . 2]" 1
135 1 13 GLU HA 1 73 PHE H . . 4.070 3.882 3.500 4.067 . 0 0 "[ . 1 . 2]" 1
136 1 13 GLU HA 1 73 PHE HB2 . . 4.540 3.917 3.696 4.265 . 0 0 "[ . 1 . 2]" 1
137 1 13 GLU HA 1 73 PHE HB3 . . 4.020 2.259 2.005 2.593 . 0 0 "[ . 1 . 2]" 1
138 1 13 GLU HA 1 73 PHE QD . . 4.270 2.929 2.507 3.313 . 0 0 "[ . 1 . 2]" 1
139 1 13 GLU HA 1 74 ILE HA . . 5.290 4.548 3.782 5.171 . 0 0 "[ . 1 . 2]" 1
140 1 13 GLU HA 1 75 TYR H . . 5.320 4.951 4.442 5.315 . 0 0 "[ . 1 . 2]" 1
141 1 13 GLU HB2 1 14 VAL H . . 4.780 4.436 4.265 4.600 . 0 0 "[ . 1 . 2]" 1
142 1 13 GLU HB2 1 73 PHE HB3 . . 4.940 4.141 3.092 4.595 . 0 0 "[ . 1 . 2]" 1
143 1 13 GLU HB2 1 73 PHE QD . . 4.700 4.206 2.585 4.694 . 0 0 "[ . 1 . 2]" 1
144 1 13 GLU HB3 1 14 VAL H . . 4.460 4.051 3.924 4.332 . 0 0 "[ . 1 . 2]" 1
145 1 13 GLU HB3 1 73 PHE HB3 . . 5.500 5.044 4.436 5.352 . 0 0 "[ . 1 . 2]" 1
146 1 13 GLU QG 1 14 VAL H . . 3.900 3.254 2.747 3.901 0.001 18 0 "[ . 1 . 2]" 1
147 1 13 GLU QG 1 61 ARG QD . . 3.940 3.496 2.506 3.940 . 0 0 "[ . 1 . 2]" 1
148 1 13 GLU QG 1 61 ARG QG . . 4.120 3.936 3.347 4.123 0.003 17 0 "[ . 1 . 2]" 1
149 1 13 GLU QG 1 61 ARG QH2 . . 5.200 3.792 2.028 5.187 . 0 0 "[ . 1 . 2]" 1
150 1 13 GLU QG 1 73 PHE QD . . 3.440 2.279 1.965 3.136 . 0 0 "[ . 1 . 2]" 1
151 1 13 GLU QG 1 75 TYR H . . 5.340 4.496 3.918 5.207 . 0 0 "[ . 1 . 2]" 1
152 1 13 GLU HG2 1 14 VAL H . . 4.680 3.486 2.794 4.679 . 0 0 "[ . 1 . 2]" 1
153 1 13 GLU HG2 1 61 ARG HE . . 5.400 4.290 2.085 5.398 . 0 0 "[ . 1 . 2]" 1
154 1 13 GLU HG2 1 73 PHE QD . . 4.110 2.464 2.026 4.000 . 0 0 "[ . 1 . 2]" 1
155 1 13 GLU HG3 1 14 VAL H . . 4.680 4.387 2.960 4.683 0.003 15 0 "[ . 1 . 2]" 1
156 1 13 GLU HG3 1 61 ARG HE . . 5.400 3.722 1.900 5.360 . 0 0 "[ . 1 . 2]" 1
157 1 13 GLU HG3 1 73 PHE QD . . 4.110 3.374 2.030 4.093 . 0 0 "[ . 1 . 2]" 1
158 1 14 VAL H 1 14 VAL HB . . 3.480 2.666 2.564 2.759 . 0 0 "[ . 1 . 2]" 1
159 1 14 VAL H 1 14 VAL MG1 . . 4.190 3.858 3.820 3.901 . 0 0 "[ . 1 . 2]" 1
160 1 14 VAL H 1 14 VAL MG2 . . 3.630 2.803 2.609 3.028 . 0 0 "[ . 1 . 2]" 1
161 1 14 VAL H 1 15 SER H . . 4.620 4.248 4.031 4.525 . 0 0 "[ . 1 . 2]" 1
162 1 14 VAL H 1 72 VAL MG1 . . 4.450 4.131 3.738 4.430 . 0 0 "[ . 1 . 2]" 1
163 1 14 VAL H 1 73 PHE H . . 4.960 4.693 4.188 4.946 . 0 0 "[ . 1 . 2]" 1
164 1 14 VAL H 1 73 PHE QD . . 4.620 3.472 2.816 4.246 . 0 0 "[ . 1 . 2]" 1
165 1 14 VAL H 1 74 ILE HA . . 3.700 2.764 2.098 3.303 . 0 0 "[ . 1 . 2]" 1
166 1 14 VAL H 1 74 ILE MG . . 4.980 4.489 3.941 4.980 . 0 0 "[ . 1 . 2]" 1
167 1 14 VAL H 1 75 TYR H . . 3.960 3.336 2.936 3.926 . 0 0 "[ . 1 . 2]" 1
168 1 14 VAL HA 1 14 VAL MG1 . . 3.190 2.380 2.265 2.450 . 0 0 "[ . 1 . 2]" 1
169 1 14 VAL HA 1 14 VAL MG2 . . 3.310 2.338 2.233 2.431 . 0 0 "[ . 1 . 2]" 1
170 1 14 VAL HA 1 15 SER H . . 2.700 2.179 2.141 2.325 . 0 0 "[ . 1 . 2]" 1
171 1 14 VAL HA 1 15 SER HB2 . . 4.900 4.688 4.409 4.852 . 0 0 "[ . 1 . 2]" 1
172 1 14 VAL HA 1 15 SER HB3 . . 4.630 4.496 4.370 4.607 . 0 0 "[ . 1 . 2]" 1
173 1 14 VAL HB 1 15 SER H . . 4.420 4.207 3.718 4.407 . 0 0 "[ . 1 . 2]" 1
174 1 14 VAL HB 1 16 VAL MG2 . . 4.620 4.391 4.057 4.619 . 0 0 "[ . 1 . 2]" 1
175 1 14 VAL HB 1 25 ALA MB . . 4.280 3.640 3.330 4.158 . 0 0 "[ . 1 . 2]" 1
176 1 14 VAL HB 1 29 HIS HD2 . . 5.470 4.773 4.284 5.197 . 0 0 "[ . 1 . 2]" 1
177 1 14 VAL HB 1 72 VAL MG1 . . 4.060 3.513 3.257 3.834 . 0 0 "[ . 1 . 2]" 1
178 1 14 VAL HB 1 74 ILE HA . . 3.810 2.276 2.002 2.535 . 0 0 "[ . 1 . 2]" 1
179 1 14 VAL HB 1 74 ILE MD . . 4.170 3.831 3.465 4.131 . 0 0 "[ . 1 . 2]" 1
180 1 14 VAL HB 1 74 ILE HG12 . . 3.910 2.269 2.003 2.529 . 0 0 "[ . 1 . 2]" 1
181 1 14 VAL HB 1 74 ILE HG13 . . 4.260 3.672 3.445 3.927 . 0 0 "[ . 1 . 2]" 1
182 1 14 VAL HB 1 74 ILE MG . . 3.870 2.842 2.329 3.153 . 0 0 "[ . 1 . 2]" 1
183 1 14 VAL HB 1 75 TYR H . . 4.410 3.767 3.330 4.051 . 0 0 "[ . 1 . 2]" 1
184 1 14 VAL MG1 1 15 SER H . . 3.350 2.571 1.885 2.967 . 0 0 "[ . 1 . 2]" 1
185 1 14 VAL MG1 1 15 SER HA . . 4.600 3.882 3.416 4.112 . 0 0 "[ . 1 . 2]" 1
186 1 14 VAL MG1 1 15 SER HB2 . . 5.500 4.961 4.515 5.157 . 0 0 "[ . 1 . 2]" 1
187 1 14 VAL MG1 1 15 SER HB3 . . 4.590 4.411 4.092 4.584 . 0 0 "[ . 1 . 2]" 1
188 1 14 VAL MG1 1 25 ALA HA . . 4.930 4.010 3.723 4.404 . 0 0 "[ . 1 . 2]" 1
189 1 14 VAL MG1 1 25 ALA MB . . 2.960 2.173 1.955 2.449 . 0 0 "[ . 1 . 2]" 1
190 1 14 VAL MG1 1 26 VAL MG2 . . 5.500 5.451 5.260 5.502 0.002 17 0 "[ . 1 . 2]" 1
191 1 14 VAL MG1 1 29 HIS HD2 . . 4.800 4.280 3.953 4.613 . 0 0 "[ . 1 . 2]" 1
192 1 14 VAL MG1 1 29 HIS HE1 . . 5.220 4.930 4.519 5.209 . 0 0 "[ . 1 . 2]" 1
193 1 14 VAL MG1 1 74 ILE HA . . 4.460 3.536 3.206 3.785 . 0 0 "[ . 1 . 2]" 1
194 1 14 VAL MG1 1 74 ILE MD . . 4.090 3.645 3.329 3.874 . 0 0 "[ . 1 . 2]" 1
195 1 14 VAL MG1 1 74 ILE HG12 . . 4.420 3.106 2.786 3.244 . 0 0 "[ . 1 . 2]" 1
196 1 14 VAL MG1 1 74 ILE HG13 . . 4.750 4.610 4.284 4.747 . 0 0 "[ . 1 . 2]" 1
197 1 14 VAL MG1 1 75 TYR H . . 4.720 4.214 3.797 4.406 . 0 0 "[ . 1 . 2]" 1
198 1 14 VAL MG2 1 15 SER H . . 4.350 4.061 3.788 4.179 . 0 0 "[ . 1 . 2]" 1
199 1 14 VAL MG2 1 25 ALA MB . . 4.000 3.364 3.109 3.642 . 0 0 "[ . 1 . 2]" 1
200 1 14 VAL MG2 1 29 HIS HD2 . . 4.560 3.503 3.143 3.791 . 0 0 "[ . 1 . 2]" 1
201 1 14 VAL MG2 1 29 HIS HE1 . . 4.080 3.725 3.314 4.009 . 0 0 "[ . 1 . 2]" 1
202 1 14 VAL MG2 1 73 PHE H . . 4.810 4.429 3.887 4.787 . 0 0 "[ . 1 . 2]" 1
203 1 14 VAL MG2 1 74 ILE HA . . 4.360 3.718 3.381 3.972 . 0 0 "[ . 1 . 2]" 1
204 1 14 VAL MG2 1 74 ILE HG13 . . 4.370 3.998 3.596 4.319 . 0 0 "[ . 1 . 2]" 1
205 1 14 VAL MG2 1 74 ILE MG . . 4.160 3.977 3.606 4.162 0.002 14 0 "[ . 1 . 2]" 1
206 1 15 SER H 1 15 SER HB2 . . 3.230 2.953 2.733 3.228 . 0 0 "[ . 1 . 2]" 1
207 1 15 SER H 1 15 SER HB3 . . 3.260 2.449 2.311 2.702 . 0 0 "[ . 1 . 2]" 1
208 1 15 SER H 1 16 VAL MG1 . . 4.470 3.938 3.436 4.303 . 0 0 "[ . 1 . 2]" 1
209 1 15 SER HA 1 16 VAL H . . 2.810 2.158 2.138 2.196 . 0 0 "[ . 1 . 2]" 1
210 1 15 SER HA 1 16 VAL MG1 . . 4.980 3.905 3.729 4.073 . 0 0 "[ . 1 . 2]" 1
211 1 15 SER HA 1 16 VAL MG2 . . 4.280 3.584 3.403 3.754 . 0 0 "[ . 1 . 2]" 1
212 1 15 SER HA 1 74 ILE HA . . 4.850 4.543 4.245 4.775 . 0 0 "[ . 1 . 2]" 1
213 1 15 SER HA 1 75 TYR H . . 3.760 2.985 2.719 3.182 . 0 0 "[ . 1 . 2]" 1
214 1 15 SER HA 1 75 TYR HB2 . . 3.800 3.654 3.371 3.802 0.002 4 0 "[ . 1 . 2]" 1
215 1 15 SER HA 1 75 TYR HB3 . . 4.120 2.309 2.000 2.592 . 0 0 "[ . 1 . 2]" 1
216 1 15 SER HA 1 75 TYR QD . . 4.710 4.049 3.624 4.363 . 0 0 "[ . 1 . 2]" 1
217 1 15 SER HB2 1 16 VAL H . . 4.330 4.155 3.956 4.309 . 0 0 "[ . 1 . 2]" 1
218 1 15 SER HB2 1 16 VAL MG1 . . 5.500 5.395 5.247 5.510 0.010 8 0 "[ . 1 . 2]" 1
219 1 15 SER HB2 1 75 TYR HB2 . . 4.860 4.563 4.220 4.859 . 0 0 "[ . 1 . 2]" 1
220 1 15 SER HB3 1 16 VAL H . . 4.410 4.262 4.076 4.411 0.001 18 0 "[ . 1 . 2]" 1
221 1 15 SER HB3 1 75 TYR HB3 . . 5.250 4.843 4.573 5.250 0.000 19 0 "[ . 1 . 2]" 1
222 1 16 VAL H 1 16 VAL MG1 . . 3.720 3.209 3.000 3.362 . 0 0 "[ . 1 . 2]" 1
223 1 16 VAL H 1 16 VAL MG2 . . 3.190 2.146 1.977 2.414 . 0 0 "[ . 1 . 2]" 1
224 1 16 VAL H 1 74 ILE MG . . 4.510 3.831 3.540 4.118 . 0 0 "[ . 1 . 2]" 1
225 1 16 VAL H 1 75 TYR H . . 4.450 3.940 3.650 4.314 . 0 0 "[ . 1 . 2]" 1
226 1 16 VAL H 1 75 TYR HB2 . . 5.170 4.903 4.666 5.109 . 0 0 "[ . 1 . 2]" 1
227 1 16 VAL H 1 75 TYR HB3 . . 4.770 3.338 3.062 3.526 . 0 0 "[ . 1 . 2]" 1
228 1 16 VAL H 1 76 CYS HA . . 3.760 3.237 2.881 3.637 . 0 0 "[ . 1 . 2]" 1
229 1 16 VAL H 1 77 GLN H . . 4.680 4.430 4.321 4.601 . 0 0 "[ . 1 . 2]" 1
230 1 16 VAL HA 1 16 VAL MG1 . . 3.150 2.258 2.123 2.359 . 0 0 "[ . 1 . 2]" 1
231 1 16 VAL HA 1 17 LEU H . . 2.840 2.341 2.266 2.476 . 0 0 "[ . 1 . 2]" 1
232 1 16 VAL HA 1 17 LEU HB2 . . 4.970 4.219 4.021 4.672 . 0 0 "[ . 1 . 2]" 1
233 1 16 VAL HA 1 17 LEU QB . . 4.160 3.885 3.849 3.939 . 0 0 "[ . 1 . 2]" 1
234 1 16 VAL HA 1 17 LEU HB3 . . 4.970 4.679 4.183 4.940 . 0 0 "[ . 1 . 2]" 1
235 1 16 VAL HA 1 21 GLU HB2 . . 4.790 4.228 3.884 4.629 . 0 0 "[ . 1 . 2]" 1
236 1 16 VAL HA 1 21 GLU HB3 . . 4.620 3.681 3.399 3.879 . 0 0 "[ . 1 . 2]" 1
237 1 16 VAL HA 1 77 GLN H . . 5.500 5.478 5.411 5.504 0.004 12 0 "[ . 1 . 2]" 1
238 1 16 VAL HB 1 17 LEU H . . 3.290 2.537 2.212 2.744 . 0 0 "[ . 1 . 2]" 1
239 1 16 VAL HB 1 21 GLU HA . . 5.010 4.691 4.506 4.892 . 0 0 "[ . 1 . 2]" 1
240 1 16 VAL HB 1 21 GLU HB2 . . 3.410 2.700 2.349 3.187 . 0 0 "[ . 1 . 2]" 1
241 1 16 VAL HB 1 22 PHE H . . 4.230 3.390 3.098 3.685 . 0 0 "[ . 1 . 2]" 1
242 1 16 VAL HB 1 22 PHE HA . . 4.530 3.276 2.838 3.576 . 0 0 "[ . 1 . 2]" 1
243 1 16 VAL HB 1 25 ALA MB . . 4.550 4.302 3.975 4.468 . 0 0 "[ . 1 . 2]" 1
244 1 16 VAL MG1 1 17 LEU H . . 3.790 3.596 3.436 3.748 . 0 0 "[ . 1 . 2]" 1
245 1 16 VAL MG1 1 21 GLU HA . . 4.410 4.159 3.911 4.356 . 0 0 "[ . 1 . 2]" 1
246 1 16 VAL MG1 1 21 GLU HB2 . . 4.080 3.609 3.204 4.015 . 0 0 "[ . 1 . 2]" 1
247 1 16 VAL MG1 1 21 GLU HB3 . . 3.470 2.465 2.123 2.731 . 0 0 "[ . 1 . 2]" 1
248 1 16 VAL MG1 1 21 GLU QG . . 4.880 3.978 3.424 4.427 . 0 0 "[ . 1 . 2]" 1
249 1 16 VAL MG1 1 22 PHE H . . 4.350 4.085 3.830 4.311 . 0 0 "[ . 1 . 2]" 1
250 1 16 VAL MG1 1 22 PHE HA . . 3.640 2.950 2.639 3.342 . 0 0 "[ . 1 . 2]" 1
251 1 16 VAL MG1 1 25 ALA H . . 4.400 3.770 3.591 3.967 . 0 0 "[ . 1 . 2]" 1
252 1 16 VAL MG1 1 25 ALA HA . . 5.460 4.546 4.262 4.748 . 0 0 "[ . 1 . 2]" 1
253 1 16 VAL MG1 1 25 ALA MB . . 3.040 2.292 2.066 2.522 . 0 0 "[ . 1 . 2]" 1
254 1 16 VAL MG1 1 26 VAL MG2 . . 5.500 5.185 4.708 5.464 . 0 0 "[ . 1 . 2]" 1
255 1 16 VAL MG1 1 74 ILE MD . . 4.900 4.203 3.898 4.518 . 0 0 "[ . 1 . 2]" 1
256 1 16 VAL MG1 1 74 ILE MG . . 3.000 2.730 2.296 2.938 . 0 0 "[ . 1 . 2]" 1
257 1 16 VAL MG1 1 75 TYR H . . 5.330 4.747 4.297 5.058 . 0 0 "[ . 1 . 2]" 1
258 1 16 VAL MG2 1 17 LEU H . . 3.800 3.670 3.493 3.794 . 0 0 "[ . 1 . 2]" 1
259 1 16 VAL MG2 1 21 GLU HB2 . . 4.530 4.065 3.716 4.486 . 0 0 "[ . 1 . 2]" 1
260 1 16 VAL MG2 1 21 GLU HB3 . . 4.290 3.996 3.615 4.244 . 0 0 "[ . 1 . 2]" 1
261 1 16 VAL MG2 1 22 PHE H . . 3.980 3.598 3.296 3.902 . 0 0 "[ . 1 . 2]" 1
262 1 16 VAL MG2 1 22 PHE HA . . 3.160 2.311 2.101 2.574 . 0 0 "[ . 1 . 2]" 1
263 1 16 VAL MG2 1 22 PHE HB2 . . 3.630 2.562 2.349 2.795 . 0 0 "[ . 1 . 2]" 1
264 1 16 VAL MG2 1 22 PHE HB3 . . 4.120 3.965 3.774 4.118 . 0 0 "[ . 1 . 2]" 1
265 1 16 VAL MG2 1 22 PHE QD . . 3.390 3.059 2.626 3.281 . 0 0 "[ . 1 . 2]" 1
266 1 16 VAL MG2 1 22 PHE QE . . 5.230 4.809 4.378 5.040 . 0 0 "[ . 1 . 2]" 1
267 1 16 VAL MG2 1 25 ALA MB . . 3.880 3.252 3.036 3.582 . 0 0 "[ . 1 . 2]" 1
268 1 16 VAL MG2 1 74 ILE MD . . 4.520 3.857 3.581 4.030 . 0 0 "[ . 1 . 2]" 1
269 1 16 VAL MG2 1 74 ILE MG . . 3.020 1.863 1.772 1.951 . 0 0 "[ . 1 . 2]" 1
270 1 16 VAL MG2 1 75 TYR H . . 4.890 3.738 3.411 4.005 . 0 0 "[ . 1 . 2]" 1
271 1 16 VAL MG2 1 75 TYR QD . . 4.710 4.529 4.273 4.703 . 0 0 "[ . 1 . 2]" 1
272 1 16 VAL MG2 1 76 CYS H . . 4.620 3.592 3.448 3.807 . 0 0 "[ . 1 . 2]" 1
273 1 16 VAL MG2 1 76 CYS HA . . 3.180 2.052 1.934 2.211 . 0 0 "[ . 1 . 2]" 1
274 1 16 VAL MG2 1 76 CYS HB2 . . 3.820 2.373 2.051 2.809 . 0 0 "[ . 1 . 2]" 1
275 1 16 VAL MG2 1 76 CYS HB3 . . 4.110 3.704 3.402 4.059 . 0 0 "[ . 1 . 2]" 1
276 1 16 VAL MG2 1 77 GLN H . . 3.990 3.581 3.285 3.795 . 0 0 "[ . 1 . 2]" 1
277 1 17 LEU H 1 17 LEU HB2 . . 3.520 3.028 2.800 3.504 . 0 0 "[ . 1 . 2]" 1
278 1 17 LEU H 1 17 LEU HB3 . . 3.520 2.840 2.577 3.002 . 0 0 "[ . 1 . 2]" 1
279 1 17 LEU H 1 17 LEU MD1 . . 4.970 4.491 4.218 4.633 . 0 0 "[ . 1 . 2]" 1
280 1 17 LEU H 1 17 LEU QD . . 4.320 3.903 3.801 3.961 . 0 0 "[ . 1 . 2]" 1
281 1 17 LEU H 1 17 LEU MD2 . . 4.970 4.314 4.070 4.647 . 0 0 "[ . 1 . 2]" 1
282 1 17 LEU H 1 17 LEU HG . . 4.990 4.546 4.151 4.716 . 0 0 "[ . 1 . 2]" 1
283 1 17 LEU H 1 18 GLY H . . 4.760 4.091 3.929 4.276 . 0 0 "[ . 1 . 2]" 1
284 1 17 LEU H 1 21 GLU HB2 . . 3.700 2.866 2.577 3.185 . 0 0 "[ . 1 . 2]" 1
285 1 17 LEU H 1 21 GLU HB3 . . 4.000 3.346 2.795 3.761 . 0 0 "[ . 1 . 2]" 1
286 1 17 LEU H 1 21 GLU QG . . 4.710 3.298 2.824 4.157 . 0 0 "[ . 1 . 2]" 1
287 1 17 LEU HA 1 17 LEU MD1 . . 4.060 3.326 2.129 3.797 . 0 0 "[ . 1 . 2]" 1
288 1 17 LEU HA 1 17 LEU QD . . 3.410 2.623 2.118 2.964 . 0 0 "[ . 1 . 2]" 1
289 1 17 LEU HA 1 17 LEU MD2 . . 4.060 3.128 2.686 3.948 . 0 0 "[ . 1 . 2]" 1
290 1 17 LEU HA 1 17 LEU HG . . 4.150 2.670 2.278 3.504 . 0 0 "[ . 1 . 2]" 1
291 1 17 LEU HA 1 18 GLY H . . 2.970 2.158 2.142 2.189 . 0 0 "[ . 1 . 2]" 1
292 1 17 LEU HA 1 18 GLY HA2 . . 4.670 4.368 4.342 4.419 . 0 0 "[ . 1 . 2]" 1
293 1 17 LEU HA 1 77 GLN HB2 . . 4.150 2.702 2.345 3.044 . 0 0 "[ . 1 . 2]" 1
294 1 17 LEU HA 1 77 GLN HB3 . . 4.840 4.414 4.100 4.726 . 0 0 "[ . 1 . 2]" 1
295 1 17 LEU QB 1 77 GLN HB2 . . 5.290 3.502 2.643 3.926 . 0 0 "[ . 1 . 2]" 1
296 1 17 LEU QB 1 77 GLN QE . . 4.480 2.784 1.917 3.992 . 0 0 "[ . 1 . 2]" 1
297 1 17 LEU HB2 1 18 GLY H . . 4.770 4.432 4.145 4.594 . 0 0 "[ . 1 . 2]" 1
298 1 17 LEU HB3 1 18 GLY H . . 4.770 4.234 3.931 4.540 . 0 0 "[ . 1 . 2]" 1
299 1 17 LEU QD 1 18 GLY H . . 3.820 2.692 2.071 3.136 . 0 0 "[ . 1 . 2]" 1
300 1 17 LEU QD 1 18 GLY HA2 . . 4.950 3.231 2.908 3.516 . 0 0 "[ . 1 . 2]" 1
301 1 17 LEU QD 1 41 SER QB . . 5.280 3.353 2.603 3.972 . 0 0 "[ . 1 . 2]" 1
302 1 17 LEU QD 1 42 LYS H . . 5.440 4.596 4.168 5.132 . 0 0 "[ . 1 . 2]" 1
303 1 17 LEU QD 1 77 GLN H . . 4.140 3.884 3.168 4.144 0.004 5 0 "[ . 1 . 2]" 1
304 1 17 LEU QD 1 77 GLN HB2 . . 3.510 2.674 1.781 3.049 . 0 0 "[ . 1 . 2]" 1
305 1 17 LEU QD 1 77 GLN HB3 . . 3.990 3.387 2.460 3.790 . 0 0 "[ . 1 . 2]" 1
306 1 17 LEU QD 1 77 GLN QE . . 3.750 2.678 2.037 3.228 . 0 0 "[ . 1 . 2]" 1
307 1 17 LEU QD 1 77 GLN QG . . 4.760 3.912 3.372 4.245 . 0 0 "[ . 1 . 2]" 1
308 1 17 LEU QD 1 79 GLY H . . 5.260 4.391 2.739 4.942 . 0 0 "[ . 1 . 2]" 1
309 1 17 LEU QD 1 79 GLY QA . . 4.020 3.069 2.503 3.497 . 0 0 "[ . 1 . 2]" 1
310 1 17 LEU MD1 1 18 GLY H . . 5.140 4.251 2.074 5.128 . 0 0 "[ . 1 . 2]" 1
311 1 17 LEU MD1 1 77 GLN H . . 5.500 4.590 3.196 5.405 . 0 0 "[ . 1 . 2]" 1
312 1 17 LEU MD1 1 77 GLN HB2 . . 4.100 3.026 1.785 3.749 . 0 0 "[ . 1 . 2]" 1
313 1 17 LEU MD1 1 77 GLN HB3 . . 4.540 3.751 2.479 4.523 . 0 0 "[ . 1 . 2]" 1
314 1 17 LEU MD1 1 77 GLN HE21 . . 5.240 3.342 2.541 4.287 . 0 0 "[ . 1 . 2]" 1
315 1 17 LEU MD1 1 77 GLN HE22 . . 5.240 3.114 2.100 3.930 . 0 0 "[ . 1 . 2]" 1
316 1 17 LEU MD2 1 18 GLY H . . 5.140 3.342 2.245 5.044 . 0 0 "[ . 1 . 2]" 1
317 1 17 LEU MD2 1 77 GLN H . . 5.500 4.593 4.132 5.403 . 0 0 "[ . 1 . 2]" 1
318 1 17 LEU MD2 1 77 GLN HB2 . . 4.100 3.379 2.646 3.870 . 0 0 "[ . 1 . 2]" 1
319 1 17 LEU MD2 1 77 GLN HB3 . . 4.540 4.186 3.484 4.525 . 0 0 "[ . 1 . 2]" 1
320 1 17 LEU MD2 1 77 GLN HE21 . . 5.240 4.494 2.983 5.043 . 0 0 "[ . 1 . 2]" 1
321 1 17 LEU MD2 1 77 GLN HE22 . . 5.240 4.551 3.007 5.214 . 0 0 "[ . 1 . 2]" 1
322 1 17 LEU HG 1 18 GLY H . . 4.270 3.745 2.950 4.139 . 0 0 "[ . 1 . 2]" 1
323 1 17 LEU HG 1 77 GLN HB2 . . 5.500 2.649 1.997 4.673 . 0 0 "[ . 1 . 2]" 1
324 1 17 LEU HG 1 77 GLN HE21 . . 5.500 3.831 3.063 5.230 . 0 0 "[ . 1 . 2]" 1
325 1 17 LEU HG 1 77 GLN HE22 . . 5.500 4.119 3.178 5.485 . 0 0 "[ . 1 . 2]" 1
326 1 18 GLY H 1 19 PHE H . . 4.640 4.455 4.336 4.521 . 0 0 "[ . 1 . 2]" 1
327 1 18 GLY H 1 77 GLN H . . 4.260 3.040 2.810 3.341 . 0 0 "[ . 1 . 2]" 1
328 1 18 GLY H 1 77 GLN HB2 . . 4.620 3.809 3.419 4.308 . 0 0 "[ . 1 . 2]" 1
329 1 18 GLY H 1 78 VAL HA . . 4.920 4.638 4.242 4.865 . 0 0 "[ . 1 . 2]" 1
330 1 18 GLY H 1 91 PHE HZ . . 4.550 3.527 3.165 3.883 . 0 0 "[ . 1 . 2]" 1
331 1 18 GLY HA2 1 19 PHE H . . 3.270 2.538 2.390 2.684 . 0 0 "[ . 1 . 2]" 1
332 1 18 GLY HA2 1 78 VAL HA . . 4.770 4.610 4.213 4.776 0.006 12 0 "[ . 1 . 2]" 1
333 1 18 GLY HA2 1 91 PHE QE . . 4.510 3.732 3.490 3.983 . 0 0 "[ . 1 . 2]" 1
334 1 18 GLY HA2 1 91 PHE HZ . . 4.200 2.854 2.559 3.121 . 0 0 "[ . 1 . 2]" 1
335 1 18 GLY HA3 1 19 PHE H . . 3.290 2.590 2.447 2.751 . 0 0 "[ . 1 . 2]" 1
336 1 18 GLY HA3 1 20 GLU H . . 4.580 3.690 3.385 4.371 . 0 0 "[ . 1 . 2]" 1
337 1 18 GLY HA3 1 91 PHE HZ . . 4.650 4.448 4.165 4.648 . 0 0 "[ . 1 . 2]" 1
338 1 19 PHE H 1 19 PHE HB2 . . 3.320 2.568 2.448 2.729 . 0 0 "[ . 1 . 2]" 1
339 1 19 PHE H 1 19 PHE HB3 . . 3.310 2.604 2.529 2.723 . 0 0 "[ . 1 . 2]" 1
340 1 19 PHE H 1 19 PHE QD . . 4.260 4.208 4.184 4.245 . 0 0 "[ . 1 . 2]" 1
341 1 19 PHE H 1 20 GLU H . . 3.510 2.425 2.260 2.708 . 0 0 "[ . 1 . 2]" 1
342 1 19 PHE H 1 91 PHE QE . . 4.650 4.343 4.085 4.630 . 0 0 "[ . 1 . 2]" 1
343 1 19 PHE H 1 91 PHE HZ . . 4.070 3.830 3.428 4.070 0.000 8 0 "[ . 1 . 2]" 1
344 1 19 PHE HA 1 19 PHE QD . . 3.680 3.130 3.073 3.173 . 0 0 "[ . 1 . 2]" 1
345 1 19 PHE HA 1 22 PHE H . . 3.920 3.634 3.166 3.862 . 0 0 "[ . 1 . 2]" 1
346 1 19 PHE HA 1 22 PHE HA . . 5.410 5.207 4.989 5.347 . 0 0 "[ . 1 . 2]" 1
347 1 19 PHE HA 1 22 PHE HB2 . . 3.980 3.515 3.275 3.688 . 0 0 "[ . 1 . 2]" 1
348 1 19 PHE HA 1 22 PHE HB3 . . 3.550 2.280 2.078 2.414 . 0 0 "[ . 1 . 2]" 1
349 1 19 PHE HA 1 22 PHE QD . . 3.570 2.707 2.451 2.912 . 0 0 "[ . 1 . 2]" 1
350 1 19 PHE HA 1 23 ASP H . . 4.670 3.805 3.469 3.993 . 0 0 "[ . 1 . 2]" 1
351 1 19 PHE HA 1 91 PHE HZ . . 4.300 4.015 3.775 4.255 . 0 0 "[ . 1 . 2]" 1
352 1 19 PHE HB2 1 20 GLU H . . 3.930 3.801 3.516 3.921 . 0 0 "[ . 1 . 2]" 1
353 1 19 PHE HB2 1 90 ASP HB2 . . 4.720 3.362 2.806 3.658 . 0 0 "[ . 1 . 2]" 1
354 1 19 PHE HB2 1 90 ASP QB . . 4.110 3.220 2.740 3.476 . 0 0 "[ . 1 . 2]" 1
355 1 19 PHE HB2 1 90 ASP HB3 . . 4.720 4.160 3.765 4.578 . 0 0 "[ . 1 . 2]" 1
356 1 19 PHE HB2 1 91 PHE QE . . 4.690 4.011 3.784 4.153 . 0 0 "[ . 1 . 2]" 1
357 1 19 PHE HB2 1 91 PHE HZ . . 4.720 4.015 3.670 4.266 . 0 0 "[ . 1 . 2]" 1
358 1 19 PHE HB3 1 20 GLU H . . 3.540 2.605 2.048 2.868 . 0 0 "[ . 1 . 2]" 1
359 1 19 PHE HB3 1 90 ASP HB2 . . 4.870 4.146 3.804 4.564 . 0 0 "[ . 1 . 2]" 1
360 1 19 PHE HB3 1 90 ASP QB . . 4.280 3.851 3.583 4.187 . 0 0 "[ . 1 . 2]" 1
361 1 19 PHE HB3 1 90 ASP HB3 . . 4.870 4.589 4.273 4.869 . 0 0 "[ . 1 . 2]" 1
362 1 19 PHE QD 1 20 GLU H . . 4.110 3.527 2.906 3.835 . 0 0 "[ . 1 . 2]" 1
363 1 19 PHE QD 1 20 GLU HA . . 4.180 2.994 2.624 3.245 . 0 0 "[ . 1 . 2]" 1
364 1 19 PHE QD 1 20 GLU QG . . 4.500 4.111 3.676 4.498 . 0 0 "[ . 1 . 2]" 1
365 1 19 PHE QD 1 22 PHE QD . . 4.520 3.669 3.385 3.967 . 0 0 "[ . 1 . 2]" 1
366 1 19 PHE QD 1 90 ASP HB2 . . 4.550 3.056 2.590 3.697 . 0 0 "[ . 1 . 2]" 1
367 1 19 PHE QD 1 90 ASP HB3 . . 4.550 3.510 2.771 4.527 . 0 0 "[ . 1 . 2]" 1
368 1 19 PHE QD 1 91 PHE HA . . 4.500 3.745 3.451 3.981 . 0 0 "[ . 1 . 2]" 1
369 1 19 PHE QD 1 91 PHE QE . . 4.880 4.109 3.754 4.415 . 0 0 "[ . 1 . 2]" 1
370 1 19 PHE QD 1 95 LEU MD1 . . 4.120 3.003 2.701 3.259 . 0 0 "[ . 1 . 2]" 1
371 1 19 PHE QD 1 95 LEU MD2 . . 5.150 4.575 4.307 4.858 . 0 0 "[ . 1 . 2]" 1
372 1 19 PHE QE 1 20 GLU HA . . 5.120 4.803 4.336 5.108 . 0 0 "[ . 1 . 2]" 1
373 1 19 PHE QE 1 23 ASP HA . . 5.290 4.687 4.105 5.122 . 0 0 "[ . 1 . 2]" 1
374 1 19 PHE QE 1 23 ASP HB2 . . 4.500 2.787 2.280 3.763 . 0 0 "[ . 1 . 2]" 1
375 1 19 PHE QE 1 23 ASP HB3 . . 4.780 4.096 3.598 4.547 . 0 0 "[ . 1 . 2]" 1
376 1 19 PHE QE 1 91 PHE HA . . 4.370 4.114 3.238 4.370 . 12 0 "[ . 1 . 2]" 1
377 1 19 PHE QE 1 94 LYS HB2 . . 4.560 2.478 2.077 2.919 . 0 0 "[ . 1 . 2]" 1
378 1 19 PHE QE 1 94 LYS HD2 . . 5.440 3.960 2.670 5.313 . 0 0 "[ . 1 . 2]" 1
379 1 19 PHE QE 1 94 LYS QD . . 4.600 3.670 2.618 4.414 . 0 0 "[ . 1 . 2]" 1
380 1 19 PHE QE 1 94 LYS HD3 . . 5.440 4.677 3.781 5.402 . 0 0 "[ . 1 . 2]" 1
381 1 19 PHE QE 1 95 LEU HB2 . . 4.710 4.279 3.736 4.625 . 0 0 "[ . 1 . 2]" 1
382 1 19 PHE QE 1 95 LEU HB3 . . 5.500 5.115 4.825 5.411 . 0 0 "[ . 1 . 2]" 1
383 1 19 PHE QE 1 95 LEU MD1 . . 3.780 3.125 2.789 3.443 . 0 0 "[ . 1 . 2]" 1
384 1 19 PHE QE 1 95 LEU HG . . 4.140 2.165 1.996 2.446 . 0 0 "[ . 1 . 2]" 1
385 1 19 PHE HZ 1 90 ASP QB . . 5.340 5.030 4.453 5.280 . 0 0 "[ . 1 . 2]" 1
386 1 19 PHE HZ 1 94 LYS HB2 . . 4.750 3.914 2.887 4.411 . 0 0 "[ . 1 . 2]" 1
387 1 19 PHE HZ 1 94 LYS QD . . 4.340 3.581 2.642 4.326 . 0 0 "[ . 1 . 2]" 1
388 1 19 PHE HZ 1 95 LEU MD2 . . 5.200 3.976 3.243 4.361 . 0 0 "[ . 1 . 2]" 1
389 1 19 PHE HZ 1 95 LEU HG . . 5.370 4.114 3.104 4.432 . 0 0 "[ . 1 . 2]" 1
390 1 20 GLU H 1 20 GLU HB2 . . 3.710 2.472 2.305 3.620 . 0 0 "[ . 1 . 2]" 1
391 1 20 GLU H 1 20 GLU QB . . 2.960 2.388 2.277 2.637 . 0 0 "[ . 1 . 2]" 1
392 1 20 GLU H 1 20 GLU HB3 . . 3.710 3.532 2.709 3.602 . 0 0 "[ . 1 . 2]" 1
393 1 20 GLU H 1 20 GLU HG2 . . 4.060 3.091 2.000 4.043 . 0 0 "[ . 1 . 2]" 1
394 1 20 GLU H 1 20 GLU QG . . 3.490 2.529 1.977 3.329 . 0 0 "[ . 1 . 2]" 1
395 1 20 GLU H 1 20 GLU HG3 . . 4.060 3.125 2.188 3.824 . 0 0 "[ . 1 . 2]" 1
396 1 20 GLU H 1 21 GLU HB2 . . 5.310 4.995 4.844 5.184 . 0 0 "[ . 1 . 2]" 1
397 1 20 GLU H 1 22 PHE H . . 4.670 4.183 3.999 4.354 . 0 0 "[ . 1 . 2]" 1
398 1 20 GLU HA 1 20 GLU HG2 . . 3.810 2.934 2.235 3.646 . 0 0 "[ . 1 . 2]" 1
399 1 20 GLU HA 1 20 GLU QG . . 3.260 2.519 2.192 3.304 0.044 8 0 "[ . 1 . 2]" 1
400 1 20 GLU HA 1 20 GLU HG3 . . 3.810 3.128 2.219 3.789 . 0 0 "[ . 1 . 2]" 1
401 1 20 GLU HA 1 23 ASP H . . 4.140 3.948 3.694 4.076 . 0 0 "[ . 1 . 2]" 1
402 1 20 GLU HA 1 24 LYS H . . 4.830 4.467 4.130 4.826 . 0 0 "[ . 1 . 2]" 1
403 1 20 GLU QB 1 21 GLU H . . 3.300 2.201 2.068 3.195 . 0 0 "[ . 1 . 2]" 1
404 1 20 GLU QG 1 21 GLU H . . 4.640 3.921 1.910 4.273 . 0 0 "[ . 1 . 2]" 1
405 1 21 GLU H 1 21 GLU HB2 . . 3.290 2.392 2.236 2.497 . 0 0 "[ . 1 . 2]" 1
406 1 21 GLU H 1 21 GLU HB3 . . 4.010 3.574 3.523 3.590 . 0 0 "[ . 1 . 2]" 1
407 1 21 GLU H 1 21 GLU HG2 . . 3.820 2.873 2.177 3.730 . 0 0 "[ . 1 . 2]" 1
408 1 21 GLU H 1 21 GLU HG3 . . 3.820 3.364 2.499 3.688 . 0 0 "[ . 1 . 2]" 1
409 1 21 GLU H 1 22 PHE H . . 3.350 2.797 2.560 2.884 . 0 0 "[ . 1 . 2]" 1
410 1 21 GLU H 1 22 PHE HB2 . . 5.500 5.440 5.222 5.501 0.001 15 0 "[ . 1 . 2]" 1
411 1 21 GLU H 1 22 PHE HB3 . . 4.860 4.730 4.499 4.818 . 0 0 "[ . 1 . 2]" 1
412 1 21 GLU H 1 24 LYS H . . 5.170 5.030 4.844 5.145 . 0 0 "[ . 1 . 2]" 1
413 1 21 GLU HA 1 21 GLU HG2 . . 3.750 2.861 2.232 3.718 . 0 0 "[ . 1 . 2]" 1
414 1 21 GLU HA 1 21 GLU QG . . 3.120 2.560 2.191 2.891 . 0 0 "[ . 1 . 2]" 1
415 1 21 GLU HA 1 21 GLU HG3 . . 3.750 3.351 2.460 3.752 0.002 4 0 "[ . 1 . 2]" 1
416 1 21 GLU HA 1 25 ALA MB . . 5.000 4.841 4.698 4.992 . 0 0 "[ . 1 . 2]" 1
417 1 21 GLU HB2 1 22 PHE H . . 3.680 2.582 2.339 2.704 . 0 0 "[ . 1 . 2]" 1
418 1 21 GLU HB3 1 22 PHE H . . 3.940 3.416 3.237 3.639 . 0 0 "[ . 1 . 2]" 1
419 1 21 GLU HG2 1 22 PHE H . . 5.040 4.650 4.272 5.031 . 0 0 "[ . 1 . 2]" 1
420 1 21 GLU HG3 1 22 PHE H . . 5.040 4.820 4.530 5.039 . 0 0 "[ . 1 . 2]" 1
421 1 22 PHE H 1 22 PHE HB2 . . 3.250 2.747 2.683 2.814 . 0 0 "[ . 1 . 2]" 1
422 1 22 PHE H 1 22 PHE HB3 . . 3.230 2.343 2.277 2.434 . 0 0 "[ . 1 . 2]" 1
423 1 22 PHE H 1 22 PHE QD . . 4.250 4.161 4.127 4.190 . 0 0 "[ . 1 . 2]" 1
424 1 22 PHE H 1 23 ASP H . . 3.470 2.956 2.773 3.063 . 0 0 "[ . 1 . 2]" 1
425 1 22 PHE H 1 25 ALA MB . . 5.080 4.897 4.697 5.031 . 0 0 "[ . 1 . 2]" 1
426 1 22 PHE HA 1 22 PHE QD . . 3.710 2.351 2.229 2.457 . 0 0 "[ . 1 . 2]" 1
427 1 22 PHE HA 1 22 PHE QE . . 4.700 4.633 4.549 4.691 . 0 0 "[ . 1 . 2]" 1
428 1 22 PHE HA 1 25 ALA MB . . 3.490 3.032 2.769 3.231 . 0 0 "[ . 1 . 2]" 1
429 1 22 PHE HA 1 74 ILE MD . . 4.870 4.117 3.848 4.506 . 0 0 "[ . 1 . 2]" 1
430 1 22 PHE HA 1 74 ILE MG . . 4.210 3.093 2.890 3.325 . 0 0 "[ . 1 . 2]" 1
431 1 22 PHE HB2 1 74 ILE MG . . 4.600 3.855 3.644 4.136 . 0 0 "[ . 1 . 2]" 1
432 1 22 PHE HB2 1 91 PHE HZ . . 5.470 5.287 5.015 5.439 . 0 0 "[ . 1 . 2]" 1
433 1 22 PHE HB3 1 23 ASP H . . 3.990 2.463 2.258 2.715 . 0 0 "[ . 1 . 2]" 1
434 1 22 PHE HB3 1 23 ASP HA . . 4.670 4.504 4.393 4.583 . 0 0 "[ . 1 . 2]" 1
435 1 22 PHE HB3 1 91 PHE HZ . . 5.500 5.371 5.143 5.500 0.000 15 0 "[ . 1 . 2]" 1
436 1 22 PHE QD 1 23 ASP H . . 4.580 3.433 3.133 3.692 . 0 0 "[ . 1 . 2]" 1
437 1 22 PHE QD 1 23 ASP HA . . 4.130 4.044 3.884 4.132 0.002 9 0 "[ . 1 . 2]" 1
438 1 22 PHE QD 1 23 ASP HB2 . . 4.780 4.289 3.876 4.779 . 0 0 "[ . 1 . 2]" 1
439 1 22 PHE QD 1 25 ALA MB . . 4.290 3.443 3.137 3.817 . 0 0 "[ . 1 . 2]" 1
440 1 22 PHE QD 1 26 VAL MG2 . . 4.240 2.651 2.498 2.901 . 0 0 "[ . 1 . 2]" 1
441 1 22 PHE QD 1 36 ALA MB . . 4.570 3.504 3.314 3.797 . 0 0 "[ . 1 . 2]" 1
442 1 22 PHE QD 1 74 ILE HB . . 4.790 3.874 3.730 4.134 . 0 0 "[ . 1 . 2]" 1
443 1 22 PHE QD 1 74 ILE MD . . 4.580 2.941 2.662 3.294 . 0 0 "[ . 1 . 2]" 1
444 1 22 PHE QD 1 74 ILE MG . . 3.260 2.112 1.979 2.290 . 0 0 "[ . 1 . 2]" 1
445 1 22 PHE QD 1 76 CYS HB2 . . 3.900 3.450 3.203 3.616 . 0 0 "[ . 1 . 2]" 1
446 1 22 PHE QD 1 76 CYS HB3 . . 4.980 4.597 4.338 4.810 . 0 0 "[ . 1 . 2]" 1
447 1 22 PHE QE 1 23 ASP HA . . 5.500 4.473 4.298 4.661 . 0 0 "[ . 1 . 2]" 1
448 1 22 PHE QE 1 26 VAL MG1 . . 4.630 3.949 3.731 4.271 . 0 0 "[ . 1 . 2]" 1
449 1 22 PHE QE 1 26 VAL MG2 . . 3.540 2.066 1.924 2.270 . 0 0 "[ . 1 . 2]" 1
450 1 22 PHE QE 1 34 ILE MG . . 4.140 3.279 3.060 3.483 . 0 0 "[ . 1 . 2]" 1
451 1 22 PHE QE 1 36 ALA HA . . 4.810 3.885 3.672 4.078 . 0 0 "[ . 1 . 2]" 1
452 1 22 PHE QE 1 36 ALA MB . . 3.270 2.050 1.971 2.292 . 0 0 "[ . 1 . 2]" 1
453 1 22 PHE QE 1 38 PHE QE . . 4.600 3.087 2.706 3.431 . 0 0 "[ . 1 . 2]" 1
454 1 22 PHE QE 1 74 ILE HB . . 4.190 3.596 3.431 3.726 . 0 0 "[ . 1 . 2]" 1
455 1 22 PHE QE 1 74 ILE MD . . 4.010 2.689 2.489 2.858 . 0 0 "[ . 1 . 2]" 1
456 1 22 PHE QE 1 74 ILE MG . . 3.520 3.240 2.930 3.458 . 0 0 "[ . 1 . 2]" 1
457 1 22 PHE QE 1 76 CYS HB2 . . 4.920 4.703 4.379 4.918 . 0 0 "[ . 1 . 2]" 1
458 1 22 PHE QE 1 76 CYS HB3 . . 5.500 5.255 4.861 5.460 . 0 0 "[ . 1 . 2]" 1
459 1 22 PHE QE 1 95 LEU HB3 . . 5.500 5.196 4.797 5.428 . 0 0 "[ . 1 . 2]" 1
460 1 22 PHE QE 1 95 LEU MD1 . . 3.900 2.270 1.987 2.563 . 0 0 "[ . 1 . 2]" 1
461 1 22 PHE QE 1 95 LEU MD2 . . 3.390 2.103 1.976 2.320 . 0 0 "[ . 1 . 2]" 1
462 1 22 PHE HZ 1 26 VAL MG1 . . 4.610 4.123 3.829 4.499 . 0 0 "[ . 1 . 2]" 1
463 1 22 PHE HZ 1 26 VAL MG2 . . 3.520 2.803 2.465 3.063 . 0 0 "[ . 1 . 2]" 1
464 1 22 PHE HZ 1 34 ILE MG . . 4.690 4.434 4.119 4.691 0.001 14 0 "[ . 1 . 2]" 1
465 1 22 PHE HZ 1 36 ALA MB . . 3.570 2.730 2.346 3.039 . 0 0 "[ . 1 . 2]" 1
466 1 22 PHE HZ 1 38 PHE HZ . . 3.870 2.867 2.395 3.447 . 0 0 "[ . 1 . 2]" 1
467 1 22 PHE HZ 1 74 ILE MD . . 4.930 4.705 4.471 4.816 . 0 0 "[ . 1 . 2]" 1
468 1 22 PHE HZ 1 74 ILE MG . . 5.500 5.279 5.037 5.503 0.003 3 0 "[ . 1 . 2]" 1
469 1 22 PHE HZ 1 95 LEU MD1 . . 3.970 3.714 3.381 3.943 . 0 0 "[ . 1 . 2]" 1
470 1 22 PHE HZ 1 95 LEU MD2 . . 3.420 3.275 2.965 3.423 0.003 18 0 "[ . 1 . 2]" 1
471 1 22 PHE HZ 1 104 LEU MD2 . . 4.730 3.796 3.502 4.201 . 0 0 "[ . 1 . 2]" 1
472 1 22 PHE HZ 1 106 TYR HB2 . . 5.130 4.855 4.622 5.114 . 0 0 "[ . 1 . 2]" 1
473 1 23 ASP H 1 23 ASP HB2 . . 3.420 2.342 2.178 2.573 . 0 0 "[ . 1 . 2]" 1
474 1 23 ASP H 1 23 ASP HB3 . . 3.480 2.787 2.500 3.508 0.028 14 0 "[ . 1 . 2]" 1
475 1 23 ASP H 1 24 LYS H . . 3.420 2.905 2.735 3.047 . 0 0 "[ . 1 . 2]" 1
476 1 23 ASP H 1 25 ALA H . . 5.200 4.467 4.246 4.697 . 0 0 "[ . 1 . 2]" 1
477 1 23 ASP H 1 25 ALA MB . . 5.440 5.058 4.925 5.273 . 0 0 "[ . 1 . 2]" 1
478 1 23 ASP HA 1 26 VAL H . . 3.940 3.433 3.230 3.668 . 0 0 "[ . 1 . 2]" 1
479 1 23 ASP HA 1 26 VAL HB . . 3.600 2.593 2.280 2.887 . 0 0 "[ . 1 . 2]" 1
480 1 23 ASP HA 1 26 VAL MG1 . . 4.250 3.895 3.649 4.236 . 0 0 "[ . 1 . 2]" 1
481 1 23 ASP HA 1 26 VAL MG2 . . 3.440 2.773 2.525 3.134 . 0 0 "[ . 1 . 2]" 1
482 1 23 ASP HB2 1 24 LYS H . . 3.920 3.585 2.683 3.835 . 0 0 "[ . 1 . 2]" 1
483 1 23 ASP HB3 1 24 LYS H . . 3.300 2.394 2.243 3.103 . 0 0 "[ . 1 . 2]" 1
484 1 23 ASP HB3 1 24 LYS HA . . 4.700 4.032 3.847 4.280 . 0 0 "[ . 1 . 2]" 1
485 1 23 ASP HB3 1 24 LYS QB . . 4.600 4.000 3.803 4.600 0.000 14 0 "[ . 1 . 2]" 1
486 1 24 LYS H 1 24 LYS QB . . 2.790 2.173 2.117 2.233 . 0 0 "[ . 1 . 2]" 1
487 1 24 LYS H 1 24 LYS QD . . 4.390 3.950 3.604 4.392 0.002 12 0 "[ . 1 . 2]" 1
488 1 24 LYS H 1 24 LYS HG2 . . 5.060 4.547 3.908 4.637 . 0 0 "[ . 1 . 2]" 1
489 1 24 LYS H 1 24 LYS QG . . 4.220 3.876 2.687 4.059 . 0 0 "[ . 1 . 2]" 1
490 1 24 LYS H 1 24 LYS HG3 . . 5.060 4.237 2.738 4.527 . 0 0 "[ . 1 . 2]" 1
491 1 24 LYS H 1 25 ALA H . . 3.180 2.936 2.769 2.983 . 0 0 "[ . 1 . 2]" 1
492 1 24 LYS H 1 25 ALA HA . . 5.500 5.479 5.360 5.502 0.002 17 0 "[ . 1 . 2]" 1
493 1 24 LYS H 1 25 ALA MB . . 5.120 4.526 4.419 4.576 . 0 0 "[ . 1 . 2]" 1
494 1 24 LYS H 1 26 VAL H . . 4.600 4.127 3.928 4.375 . 0 0 "[ . 1 . 2]" 1
495 1 24 LYS HA 1 24 LYS QB . . 2.780 2.445 2.383 2.490 . 0 0 "[ . 1 . 2]" 1
496 1 24 LYS HA 1 24 LYS QD . . 4.110 2.916 2.000 4.087 . 0 0 "[ . 1 . 2]" 1
497 1 24 LYS HA 1 24 LYS QE . . 4.600 3.831 2.186 4.577 . 0 0 "[ . 1 . 2]" 1
498 1 24 LYS HA 1 24 LYS HG2 . . 3.800 3.458 2.476 3.766 . 0 0 "[ . 1 . 2]" 1
499 1 24 LYS HA 1 24 LYS QG . . 3.240 2.462 2.148 2.820 . 0 0 "[ . 1 . 2]" 1
500 1 24 LYS HA 1 24 LYS HG3 . . 3.800 2.547 2.187 2.912 . 0 0 "[ . 1 . 2]" 1
501 1 24 LYS HA 1 27 LYS H . . 4.140 3.870 3.270 4.125 . 0 0 "[ . 1 . 2]" 1
502 1 24 LYS HA 1 27 LYS QG . . 4.770 3.962 2.347 4.655 . 0 0 "[ . 1 . 2]" 1
503 1 24 LYS HA 1 28 GLU H . . 4.570 4.353 3.788 4.563 . 0 0 "[ . 1 . 2]" 1
504 1 24 LYS QB 1 24 LYS QD . . 3.170 2.234 2.023 2.559 . 0 0 "[ . 1 . 2]" 1
505 1 24 LYS QB 1 24 LYS QE . . 4.520 2.953 1.979 3.830 . 0 0 "[ . 1 . 2]" 1
506 1 24 LYS QB 1 25 ALA H . . 3.180 2.331 2.135 2.593 . 0 0 "[ . 1 . 2]" 1
507 1 24 LYS QB 1 25 ALA HA . . 4.750 3.892 3.701 4.067 . 0 0 "[ . 1 . 2]" 1
508 1 24 LYS QB 1 25 ALA MB . . 4.220 3.631 3.528 3.728 . 0 0 "[ . 1 . 2]" 1
509 1 24 LYS QB 1 26 VAL H . . 5.290 4.503 4.238 4.846 . 0 0 "[ . 1 . 2]" 1
510 1 24 LYS QD 1 25 ALA H . . 5.500 4.822 4.469 5.228 . 0 0 "[ . 1 . 2]" 1
511 1 24 LYS QE 1 24 LYS QG . . 3.230 2.257 2.100 2.540 . 0 0 "[ . 1 . 2]" 1
512 1 24 LYS QG 1 25 ALA H . . 4.650 3.814 3.516 4.198 . 0 0 "[ . 1 . 2]" 1
513 1 24 LYS QG 1 28 GLU H . . 5.340 4.944 4.707 5.339 . 0 0 "[ . 1 . 2]" 1
514 1 24 LYS QG 1 28 GLU QG . . 4.090 3.006 2.407 3.876 . 0 0 "[ . 1 . 2]" 1
515 1 25 ALA H 1 25 ALA MB . . 2.860 2.139 2.054 2.234 . 0 0 "[ . 1 . 2]" 1
516 1 25 ALA H 1 26 VAL H . . 3.290 2.708 2.576 2.813 . 0 0 "[ . 1 . 2]" 1
517 1 25 ALA H 1 26 VAL HB . . 5.010 4.878 4.651 5.025 0.015 8 0 "[ . 1 . 2]" 1
518 1 25 ALA H 1 26 VAL MG2 . . 4.580 4.308 4.135 4.540 . 0 0 "[ . 1 . 2]" 1
519 1 25 ALA HA 1 28 GLU H . . 3.910 3.758 3.577 3.889 . 0 0 "[ . 1 . 2]" 1
520 1 25 ALA HA 1 28 GLU HB2 . . 3.610 2.563 2.264 2.725 . 0 0 "[ . 1 . 2]" 1
521 1 25 ALA HA 1 28 GLU HB3 . . 4.180 3.963 3.582 4.155 . 0 0 "[ . 1 . 2]" 1
522 1 25 ALA HA 1 28 GLU QG . . 4.550 3.370 3.008 3.860 . 0 0 "[ . 1 . 2]" 1
523 1 25 ALA HA 1 29 HIS H . . 4.650 4.537 4.392 4.657 0.007 15 0 "[ . 1 . 2]" 1
524 1 25 ALA HA 1 29 HIS HD2 . . 4.220 3.949 3.677 4.217 . 0 0 "[ . 1 . 2]" 1
525 1 25 ALA HA 1 29 HIS HE1 . . 5.500 5.309 4.885 5.499 . 0 0 "[ . 1 . 2]" 1
526 1 25 ALA HA 1 74 ILE MD . . 5.090 4.219 3.934 4.468 . 0 0 "[ . 1 . 2]" 1
527 1 25 ALA MB 1 26 VAL H . . 3.430 2.673 2.426 2.908 . 0 0 "[ . 1 . 2]" 1
528 1 25 ALA MB 1 26 VAL HA . . 4.560 3.784 3.705 3.898 . 0 0 "[ . 1 . 2]" 1
529 1 25 ALA MB 1 26 VAL HB . . 4.670 4.637 4.518 4.682 0.012 12 0 "[ . 1 . 2]" 1
530 1 25 ALA MB 1 26 VAL MG1 . . 5.500 4.995 4.890 5.076 . 0 0 "[ . 1 . 2]" 1
531 1 25 ALA MB 1 26 VAL MG2 . . 4.180 3.129 2.935 3.405 . 0 0 "[ . 1 . 2]" 1
532 1 25 ALA MB 1 28 GLU H . . 4.820 4.660 4.524 4.821 0.001 9 0 "[ . 1 . 2]" 1
533 1 25 ALA MB 1 28 GLU HB2 . . 4.630 4.017 3.765 4.232 . 0 0 "[ . 1 . 2]" 1
534 1 25 ALA MB 1 29 HIS H . . 5.500 4.899 4.759 5.143 . 0 0 "[ . 1 . 2]" 1
535 1 25 ALA MB 1 29 HIS HD2 . . 4.210 3.182 2.929 3.527 . 0 0 "[ . 1 . 2]" 1
536 1 25 ALA MB 1 29 HIS HE1 . . 5.470 5.185 4.836 5.446 . 0 0 "[ . 1 . 2]" 1
537 1 25 ALA MB 1 72 VAL MG1 . . 4.760 4.190 4.040 4.429 . 0 0 "[ . 1 . 2]" 1
538 1 25 ALA MB 1 74 ILE HB . . 4.670 4.541 4.349 4.666 . 0 0 "[ . 1 . 2]" 1
539 1 25 ALA MB 1 74 ILE MD . . 3.190 2.105 1.970 2.293 . 0 0 "[ . 1 . 2]" 1
540 1 25 ALA MB 1 74 ILE HG12 . . 3.960 3.135 2.852 3.336 . 0 0 "[ . 1 . 2]" 1
541 1 25 ALA MB 1 74 ILE MG . . 3.510 2.507 2.255 2.809 . 0 0 "[ . 1 . 2]" 1
542 1 26 VAL H 1 26 VAL HB . . 3.190 2.442 2.363 2.568 . 0 0 "[ . 1 . 2]" 1
543 1 26 VAL H 1 26 VAL MG1 . . 3.890 3.746 3.721 3.765 . 0 0 "[ . 1 . 2]" 1
544 1 26 VAL H 1 26 VAL MG2 . . 3.140 2.349 2.062 2.591 . 0 0 "[ . 1 . 2]" 1
545 1 26 VAL H 1 27 LYS H . . 3.400 2.835 2.434 3.023 . 0 0 "[ . 1 . 2]" 1
546 1 26 VAL H 1 27 LYS QB . . 4.920 4.582 4.359 4.833 . 0 0 "[ . 1 . 2]" 1
547 1 26 VAL H 1 34 ILE MD . . 4.600 4.469 4.313 4.574 . 0 0 "[ . 1 . 2]" 1
548 1 26 VAL H 1 74 ILE MD . . 4.370 3.368 3.058 3.599 . 0 0 "[ . 1 . 2]" 1
549 1 26 VAL H 1 74 ILE MG . . 5.290 4.575 4.358 4.939 . 0 0 "[ . 1 . 2]" 1
550 1 26 VAL HA 1 26 VAL MG1 . . 3.240 2.449 2.321 2.516 . 0 0 "[ . 1 . 2]" 1
551 1 26 VAL HA 1 26 VAL MG2 . . 3.220 2.321 2.151 2.442 . 0 0 "[ . 1 . 2]" 1
552 1 26 VAL HA 1 28 GLU H . . 4.990 3.880 3.592 4.189 . 0 0 "[ . 1 . 2]" 1
553 1 26 VAL HA 1 29 HIS H . . 3.990 3.385 3.195 3.618 . 0 0 "[ . 1 . 2]" 1
554 1 26 VAL HA 1 29 HIS HB2 . . 4.160 3.630 3.284 4.051 . 0 0 "[ . 1 . 2]" 1
555 1 26 VAL HA 1 30 GLU H . . 5.090 4.874 4.477 5.095 0.005 12 0 "[ . 1 . 2]" 1
556 1 26 VAL HA 1 34 ILE MD . . 3.210 2.029 1.951 2.261 . 0 0 "[ . 1 . 2]" 1
557 1 26 VAL HA 1 34 ILE MG . . 3.690 2.682 2.408 3.030 . 0 0 "[ . 1 . 2]" 1
558 1 26 VAL HA 1 74 ILE MD . . 3.780 2.649 2.484 2.958 . 0 0 "[ . 1 . 2]" 1
559 1 26 VAL HB 1 27 LYS H . . 3.400 2.212 2.073 2.471 . 0 0 "[ . 1 . 2]" 1
560 1 26 VAL HB 1 27 LYS HA . . 4.580 4.302 4.169 4.416 . 0 0 "[ . 1 . 2]" 1
561 1 26 VAL HB 1 27 LYS QB . . 4.720 4.262 3.816 4.456 . 0 0 "[ . 1 . 2]" 1
562 1 26 VAL HB 1 34 ILE MD . . 4.380 3.950 3.683 4.124 . 0 0 "[ . 1 . 2]" 1
563 1 26 VAL HB 1 106 TYR QE . . 5.030 4.802 4.405 5.020 . 0 0 "[ . 1 . 2]" 1
564 1 26 VAL MG1 1 27 LYS H . . 4.000 2.872 2.469 3.259 . 0 0 "[ . 1 . 2]" 1
565 1 26 VAL MG1 1 27 LYS HA . . 4.100 3.155 2.857 3.490 . 0 0 "[ . 1 . 2]" 1
566 1 26 VAL MG1 1 27 LYS QB . . 4.970 4.225 3.508 4.603 . 0 0 "[ . 1 . 2]" 1
567 1 26 VAL MG1 1 27 LYS QG . . 4.840 3.446 2.807 4.753 . 0 0 "[ . 1 . 2]" 1
568 1 26 VAL MG1 1 30 GLU H . . 5.310 4.420 4.028 4.834 . 0 0 "[ . 1 . 2]" 1
569 1 26 VAL MG1 1 30 GLU HA . . 4.780 3.659 3.354 4.089 . 0 0 "[ . 1 . 2]" 1
570 1 26 VAL MG1 1 30 GLU QB . . 4.650 3.529 3.252 4.537 . 0 0 "[ . 1 . 2]" 1
571 1 26 VAL MG1 1 30 GLU QG . . 5.340 4.910 3.548 5.317 . 0 0 "[ . 1 . 2]" 1
572 1 26 VAL MG1 1 34 ILE MD . . 3.250 1.921 1.759 2.102 . 0 0 "[ . 1 . 2]" 1
573 1 26 VAL MG1 1 34 ILE HG13 . . 5.350 4.384 4.027 4.677 . 0 0 "[ . 1 . 2]" 1
574 1 26 VAL MG1 1 36 ALA MB . . 5.500 4.878 4.514 5.157 . 0 0 "[ . 1 . 2]" 1
575 1 26 VAL MG1 1 74 ILE MD . . 3.930 3.746 3.344 3.932 0.002 3 0 "[ . 1 . 2]" 1
576 1 26 VAL MG1 1 106 TYR QD . . 3.790 2.868 2.624 3.066 . 0 0 "[ . 1 . 2]" 1
577 1 26 VAL MG1 1 106 TYR QE . . 3.530 2.428 2.082 2.781 . 0 0 "[ . 1 . 2]" 1
578 1 26 VAL MG2 1 27 LYS H . . 3.820 3.747 3.649 3.833 0.013 8 0 "[ . 1 . 2]" 1
579 1 26 VAL MG2 1 27 LYS QB . . 5.500 5.338 5.075 5.453 . 0 0 "[ . 1 . 2]" 1
580 1 26 VAL MG2 1 34 ILE MD . . 3.500 2.965 2.557 3.203 . 0 0 "[ . 1 . 2]" 1
581 1 26 VAL MG2 1 34 ILE HG12 . . 4.950 4.494 4.163 4.685 . 0 0 "[ . 1 . 2]" 1
582 1 26 VAL MG2 1 34 ILE HG13 . . 5.500 5.315 5.066 5.477 . 0 0 "[ . 1 . 2]" 1
583 1 26 VAL MG2 1 34 ILE MG . . 3.840 2.402 2.045 2.641 . 0 0 "[ . 1 . 2]" 1
584 1 26 VAL MG2 1 36 ALA MB . . 4.520 3.429 3.224 3.684 . 0 0 "[ . 1 . 2]" 1
585 1 26 VAL MG2 1 74 ILE HB . . 4.410 4.213 3.941 4.407 . 0 0 "[ . 1 . 2]" 1
586 1 26 VAL MG2 1 74 ILE MD . . 3.460 2.164 1.963 2.354 . 0 0 "[ . 1 . 2]" 1
587 1 26 VAL MG2 1 74 ILE HG12 . . 5.380 4.594 4.312 4.890 . 0 0 "[ . 1 . 2]" 1
588 1 26 VAL MG2 1 74 ILE MG . . 4.010 3.390 3.086 3.595 . 0 0 "[ . 1 . 2]" 1
589 1 26 VAL MG2 1 95 LEU MD2 . . 5.170 4.843 4.606 5.062 . 0 0 "[ . 1 . 2]" 1
590 1 26 VAL MG2 1 106 TYR QD . . 4.820 4.065 3.911 4.193 . 0 0 "[ . 1 . 2]" 1
591 1 26 VAL MG2 1 106 TYR QE . . 4.290 4.160 3.964 4.291 0.001 10 0 "[ . 1 . 2]" 1
592 1 27 LYS H 1 27 LYS QB . . 2.960 2.335 2.149 2.582 . 0 0 "[ . 1 . 2]" 1
593 1 27 LYS H 1 27 LYS HG2 . . 4.080 2.888 1.935 4.081 0.001 11 0 "[ . 1 . 2]" 1
594 1 27 LYS H 1 27 LYS QG . . 3.340 2.474 1.924 3.339 . 0 0 "[ . 1 . 2]" 1
595 1 27 LYS H 1 27 LYS HG3 . . 4.080 3.246 2.093 3.965 . 0 0 "[ . 1 . 2]" 1
596 1 27 LYS H 1 28 GLU H . . 3.330 2.757 2.622 2.837 . 0 0 "[ . 1 . 2]" 1
597 1 27 LYS HA 1 27 LYS QE . . 4.530 4.030 1.962 4.478 . 0 0 "[ . 1 . 2]" 1
598 1 27 LYS HA 1 27 LYS HG2 . . 3.840 2.773 2.341 3.840 0.000 9 0 "[ . 1 . 2]" 1
599 1 27 LYS HA 1 27 LYS QG . . 3.160 2.581 2.186 3.267 0.107 13 0 "[ . 1 . 2]" 1
600 1 27 LYS HA 1 27 LYS HG3 . . 3.840 3.402 2.208 3.802 . 0 0 "[ . 1 . 2]" 1
601 1 27 LYS HA 1 30 GLU H . . 3.880 3.564 3.235 3.887 0.007 16 0 "[ . 1 . 2]" 1
602 1 27 LYS HA 1 30 GLU QB . . 4.200 2.331 2.014 3.865 . 0 0 "[ . 1 . 2]" 1
603 1 27 LYS HA 1 30 GLU QG . . 4.150 3.384 1.965 4.140 . 0 0 "[ . 1 . 2]" 1
604 1 27 LYS QB 1 27 LYS QE . . 3.760 3.097 1.980 3.761 0.001 11 0 "[ . 1 . 2]" 1
605 1 27 LYS QB 1 30 GLU H . . 5.150 4.859 4.574 5.167 0.017 8 0 "[ . 1 . 2]" 1
606 1 27 LYS QE 1 27 LYS QG . . 3.220 2.223 2.100 2.605 . 0 0 "[ . 1 . 2]" 1
607 1 27 LYS QG 1 28 GLU H . . 5.340 4.171 2.349 4.620 . 0 0 "[ . 1 . 2]" 1
608 1 28 GLU H 1 28 GLU HB2 . . 2.960 2.218 2.181 2.312 . 0 0 "[ . 1 . 2]" 1
609 1 28 GLU H 1 28 GLU HB3 . . 3.610 3.508 3.484 3.561 . 0 0 "[ . 1 . 2]" 1
610 1 28 GLU H 1 28 GLU HG2 . . 4.100 3.336 2.625 4.081 . 0 0 "[ . 1 . 2]" 1
611 1 28 GLU H 1 28 GLU QG . . 3.350 2.901 2.575 3.132 . 0 0 "[ . 1 . 2]" 1
612 1 28 GLU H 1 28 GLU HG3 . . 4.100 3.584 2.866 4.073 . 0 0 "[ . 1 . 2]" 1
613 1 28 GLU H 1 29 HIS H . . 3.050 2.480 2.119 2.733 . 0 0 "[ . 1 . 2]" 1
614 1 28 GLU H 1 30 GLU H . . 4.510 3.848 3.609 4.247 . 0 0 "[ . 1 . 2]" 1
615 1 28 GLU HA 1 28 GLU HG2 . . 3.800 2.526 2.199 2.916 . 0 0 "[ . 1 . 2]" 1
616 1 28 GLU HA 1 28 GLU QG . . 3.170 2.453 2.160 2.796 . 0 0 "[ . 1 . 2]" 1
617 1 28 GLU HA 1 28 GLU HG3 . . 3.800 3.368 2.787 3.705 . 0 0 "[ . 1 . 2]" 1
618 1 28 GLU HB2 1 29 HIS H . . 3.800 2.842 2.608 3.188 . 0 0 "[ . 1 . 2]" 1
619 1 28 GLU HB2 1 29 HIS HD2 . . 4.810 4.120 3.806 4.561 . 0 0 "[ . 1 . 2]" 1
620 1 28 GLU HB2 1 30 GLU H . . 5.500 4.943 4.797 5.287 . 0 0 "[ . 1 . 2]" 1
621 1 28 GLU HB3 1 29 HIS H . . 4.030 3.383 3.071 3.750 . 0 0 "[ . 1 . 2]" 1
622 1 28 GLU HB3 1 29 HIS HD2 . . 5.160 4.785 4.356 5.135 . 0 0 "[ . 1 . 2]" 1
623 1 28 GLU HB3 1 29 HIS HE1 . . 4.830 3.817 3.472 4.312 . 0 0 "[ . 1 . 2]" 1
624 1 28 GLU QG 1 29 HIS H . . 5.000 4.351 4.227 4.474 . 0 0 "[ . 1 . 2]" 1
625 1 29 HIS H 1 29 HIS HB2 . . 3.340 2.719 2.594 2.841 . 0 0 "[ . 1 . 2]" 1
626 1 29 HIS H 1 29 HIS HB3 . . 3.880 3.722 3.682 3.769 . 0 0 "[ . 1 . 2]" 1
627 1 29 HIS H 1 29 HIS HD2 . . 4.090 3.452 3.118 4.019 . 0 0 "[ . 1 . 2]" 1
628 1 29 HIS H 1 30 GLU H . . 3.000 2.583 2.327 2.785 . 0 0 "[ . 1 . 2]" 1
629 1 29 HIS H 1 30 GLU HA . . 4.580 4.501 4.336 4.580 . 0 0 "[ . 1 . 2]" 1
630 1 29 HIS H 1 30 GLU QG . . 5.340 4.430 3.144 5.052 . 0 0 "[ . 1 . 2]" 1
631 1 29 HIS H 1 34 ILE MD . . 4.450 2.999 2.751 3.498 . 0 0 "[ . 1 . 2]" 1
632 1 29 HIS HA 1 30 GLU H . . 3.480 3.016 2.839 3.168 . 0 0 "[ . 1 . 2]" 1
633 1 29 HIS HB2 1 30 GLU H . . 4.530 3.968 3.745 4.173 . 0 0 "[ . 1 . 2]" 1
634 1 29 HIS HB2 1 34 ILE MD . . 3.690 2.333 1.990 2.661 . 0 0 "[ . 1 . 2]" 1
635 1 29 HIS HB2 1 34 ILE HG12 . . 4.340 2.093 1.999 2.449 . 0 0 "[ . 1 . 2]" 1
636 1 29 HIS HB2 1 34 ILE HG13 . . 4.690 3.142 2.867 3.690 . 0 0 "[ . 1 . 2]" 1
637 1 29 HIS HB2 1 72 VAL HB . . 4.980 2.979 2.702 3.138 . 0 0 "[ . 1 . 2]" 1
638 1 29 HIS HB2 1 72 VAL MG1 . . 4.220 3.475 2.890 3.822 . 0 0 "[ . 1 . 2]" 1
639 1 29 HIS HB2 1 72 VAL MG2 . . 3.830 3.338 3.107 3.618 . 0 0 "[ . 1 . 2]" 1
640 1 29 HIS HB3 1 30 GLU H . . 4.600 4.520 4.444 4.584 . 0 0 "[ . 1 . 2]" 1
641 1 29 HIS HB3 1 32 LYS H . . 4.710 3.885 3.621 4.195 . 0 0 "[ . 1 . 2]" 1
642 1 29 HIS HB3 1 32 LYS QB . . 4.370 3.791 3.190 4.376 0.006 17 0 "[ . 1 . 2]" 1
643 1 29 HIS HB3 1 32 LYS QG . . 5.340 4.438 2.224 5.295 . 0 0 "[ . 1 . 2]" 1
644 1 29 HIS HB3 1 34 ILE MD . . 3.860 3.580 3.284 3.857 . 0 0 "[ . 1 . 2]" 1
645 1 29 HIS HB3 1 34 ILE HG12 . . 4.510 3.242 2.752 3.527 . 0 0 "[ . 1 . 2]" 1
646 1 29 HIS HB3 1 72 VAL HB . . 4.380 2.835 2.577 3.124 . 0 0 "[ . 1 . 2]" 1
647 1 29 HIS HB3 1 72 VAL MG1 . . 4.030 3.338 2.934 3.744 . 0 0 "[ . 1 . 2]" 1
648 1 29 HIS HB3 1 72 VAL MG2 . . 3.530 2.187 1.958 2.455 . 0 0 "[ . 1 . 2]" 1
649 1 29 HIS HD2 1 72 VAL HB . . 5.040 3.531 3.059 4.078 . 0 0 "[ . 1 . 2]" 1
650 1 29 HIS HD2 1 72 VAL MG1 . . 4.190 2.519 2.078 2.820 . 0 0 "[ . 1 . 2]" 1
651 1 29 HIS HD2 1 72 VAL MG2 . . 4.410 4.082 3.782 4.405 . 0 0 "[ . 1 . 2]" 1
652 1 29 HIS HE1 1 72 VAL MG2 . . 4.220 4.038 3.681 4.221 0.001 11 0 "[ . 1 . 2]" 1
653 1 30 GLU H 1 30 GLU HB2 . . 3.640 3.519 2.934 3.634 . 0 0 "[ . 1 . 2]" 1
654 1 30 GLU H 1 30 GLU QB . . 3.000 2.439 2.237 2.814 . 0 0 "[ . 1 . 2]" 1
655 1 30 GLU H 1 30 GLU HB3 . . 3.640 2.544 2.262 3.514 . 0 0 "[ . 1 . 2]" 1
656 1 30 GLU H 1 30 GLU HG2 . . 4.040 2.639 2.057 3.386 . 0 0 "[ . 1 . 2]" 1
657 1 30 GLU H 1 30 GLU QG . . 3.330 2.253 1.855 2.654 . 0 0 "[ . 1 . 2]" 1
658 1 30 GLU H 1 30 GLU HG3 . . 4.040 3.032 2.038 3.851 . 0 0 "[ . 1 . 2]" 1
659 1 30 GLU H 1 31 SER H . . 3.550 2.744 2.568 3.028 . 0 0 "[ . 1 . 2]" 1
660 1 30 GLU H 1 32 LYS H . . 4.750 4.426 4.204 4.759 0.009 16 0 "[ . 1 . 2]" 1
661 1 30 GLU H 1 34 ILE MD . . 4.410 3.100 2.807 3.836 . 0 0 "[ . 1 . 2]" 1
662 1 30 GLU HA 1 30 GLU HG2 . . 4.210 3.804 2.764 4.221 0.011 9 0 "[ . 1 . 2]" 1
663 1 30 GLU HA 1 30 GLU QG . . 3.700 3.292 2.692 3.432 . 0 0 "[ . 1 . 2]" 1
664 1 30 GLU HA 1 30 GLU HG3 . . 4.210 3.677 3.583 3.794 . 0 0 "[ . 1 . 2]" 1
665 1 30 GLU HA 1 31 SER HA . . 5.050 4.808 4.461 4.937 . 0 0 "[ . 1 . 2]" 1
666 1 30 GLU HA 1 32 LYS H . . 4.360 4.127 3.693 4.359 . 0 0 "[ . 1 . 2]" 1
667 1 30 GLU HA 1 34 ILE MD . . 3.530 2.099 1.938 2.343 . 0 0 "[ . 1 . 2]" 1
668 1 30 GLU HA 1 34 ILE HG13 . . 4.700 3.799 3.392 4.077 . 0 0 "[ . 1 . 2]" 1
669 1 30 GLU QB 1 31 SER H . . 4.130 3.455 2.076 4.044 . 0 0 "[ . 1 . 2]" 1
670 1 30 GLU QG 1 31 SER H . . 3.780 2.568 2.020 3.742 . 0 0 "[ . 1 . 2]" 1
671 1 30 GLU HG2 1 31 SER H . . 4.300 3.311 2.313 4.228 . 0 0 "[ . 1 . 2]" 1
672 1 30 GLU HG3 1 31 SER H . . 4.300 2.847 2.031 4.231 . 0 0 "[ . 1 . 2]" 1
673 1 31 SER H 1 31 SER HB2 . . 3.800 2.600 2.187 3.624 . 0 0 "[ . 1 . 2]" 1
674 1 31 SER H 1 31 SER QB . . 3.190 2.406 2.166 2.790 . 0 0 "[ . 1 . 2]" 1
675 1 31 SER H 1 31 SER HB3 . . 3.800 3.276 2.331 3.806 0.006 16 0 "[ . 1 . 2]" 1
676 1 31 SER H 1 32 LYS H . . 3.130 2.656 1.863 3.102 . 0 0 "[ . 1 . 2]" 1
677 1 31 SER H 1 34 ILE MD . . 4.680 4.340 3.880 4.680 0.000 8 0 "[ . 1 . 2]" 1
678 1 31 SER QB 1 32 LYS H . . 4.190 2.752 2.426 3.274 . 0 0 "[ . 1 . 2]" 1
679 1 31 SER QB 1 32 LYS QD . . 3.540 2.681 1.956 3.563 0.023 17 0 "[ . 1 . 2]" 1
680 1 31 SER QB 1 32 LYS QE . . 4.710 3.539 1.799 4.708 . 0 0 "[ . 1 . 2]" 1
681 1 31 SER QB 1 32 LYS QG . . 5.180 3.294 2.142 4.955 . 0 0 "[ . 1 . 2]" 1
682 1 31 SER HB2 1 32 LYS H . . 4.930 3.100 2.565 4.062 . 0 0 "[ . 1 . 2]" 1
683 1 31 SER HB3 1 32 LYS H . . 4.930 3.498 2.456 4.123 . 0 0 "[ . 1 . 2]" 1
684 1 32 LYS H 1 32 LYS QB . . 3.030 2.709 2.442 3.127 0.097 17 0 "[ . 1 . 2]" 1
685 1 32 LYS H 1 32 LYS QD . . 4.190 2.580 1.884 4.205 0.015 16 0 "[ . 1 . 2]" 1
686 1 32 LYS H 1 32 LYS QG . . 3.400 2.835 1.855 3.378 . 0 0 "[ . 1 . 2]" 1
687 1 32 LYS H 1 33 THR H . . 4.650 4.494 4.433 4.555 . 0 0 "[ . 1 . 2]" 1
688 1 32 LYS H 1 34 ILE MD . . 4.510 4.289 4.035 4.492 . 0 0 "[ . 1 . 2]" 1
689 1 32 LYS H 1 72 VAL MG2 . . 4.850 4.461 3.979 4.808 . 0 0 "[ . 1 . 2]" 1
690 1 32 LYS HA 1 32 LYS HG2 . . 4.150 3.448 2.925 3.679 . 0 0 "[ . 1 . 2]" 1
691 1 32 LYS HA 1 32 LYS HG3 . . 4.150 3.019 2.384 4.226 0.076 4 0 "[ . 1 . 2]" 1
692 1 32 LYS HA 1 33 THR H . . 3.040 2.456 2.365 2.548 . 0 0 "[ . 1 . 2]" 1
693 1 32 LYS QB 1 32 LYS QD . . 3.250 2.170 2.033 2.399 . 0 0 "[ . 1 . 2]" 1
694 1 32 LYS QB 1 33 THR H . . 3.100 2.322 2.141 2.480 . 0 0 "[ . 1 . 2]" 1
695 1 32 LYS QB 1 33 THR HB . . 4.530 4.053 3.952 4.224 . 0 0 "[ . 1 . 2]" 1
696 1 32 LYS QB 1 71 CYS HA . . 3.700 3.043 2.722 3.489 . 0 0 "[ . 1 . 2]" 1
697 1 32 LYS QB 1 71 CYS QB . . 5.180 4.491 4.157 5.181 0.001 1 0 "[ . 1 . 2]" 1
698 1 32 LYS QB 1 72 VAL MG2 . . 3.880 2.963 2.407 3.779 . 0 0 "[ . 1 . 2]" 1
699 1 32 LYS QD 1 33 THR H . . 5.280 4.882 4.716 5.003 . 0 0 "[ . 1 . 2]" 1
700 1 32 LYS QD 1 71 CYS HA . . 5.340 5.145 4.527 5.345 0.005 4 0 "[ . 1 . 2]" 1
701 1 32 LYS QD 1 72 VAL MG2 . . 3.890 3.229 2.598 3.587 . 0 0 "[ . 1 . 2]" 1
702 1 32 LYS QG 1 33 THR H . . 4.480 3.858 3.390 4.126 . 0 0 "[ . 1 . 2]" 1
703 1 32 LYS QG 1 72 VAL MG2 . . 4.160 3.616 2.000 4.165 0.005 3 0 "[ . 1 . 2]" 1
704 1 33 THR H 1 33 THR HB . . 3.030 2.603 2.443 2.756 . 0 0 "[ . 1 . 2]" 1
705 1 33 THR H 1 33 THR MG . . 3.960 3.762 3.741 3.769 . 0 0 "[ . 1 . 2]" 1
706 1 33 THR H 1 71 CYS HA . . 3.920 3.206 2.908 3.362 . 0 0 "[ . 1 . 2]" 1
707 1 33 THR H 1 72 VAL H . . 5.120 4.962 4.707 5.127 0.007 15 0 "[ . 1 . 2]" 1
708 1 33 THR HA 1 33 THR MG . . 3.210 2.340 2.174 2.474 . 0 0 "[ . 1 . 2]" 1
709 1 33 THR HA 1 34 ILE H . . 2.740 2.227 2.167 2.290 . 0 0 "[ . 1 . 2]" 1
710 1 33 THR HA 1 34 ILE HB . . 4.940 4.483 4.364 4.573 . 0 0 "[ . 1 . 2]" 1
711 1 33 THR HA 1 34 ILE HG13 . . 4.370 3.729 3.522 3.965 . 0 0 "[ . 1 . 2]" 1
712 1 33 THR HB 1 34 ILE H . . 4.290 3.941 3.661 4.184 . 0 0 "[ . 1 . 2]" 1
713 1 33 THR HB 1 71 CYS H . . 4.900 4.422 4.120 4.625 . 0 0 "[ . 1 . 2]" 1
714 1 33 THR HB 1 71 CYS HA . . 3.810 2.498 2.074 2.857 . 0 0 "[ . 1 . 2]" 1
715 1 33 THR HB 1 71 CYS HB2 . . 4.110 2.620 2.110 4.075 . 0 0 "[ . 1 . 2]" 1
716 1 33 THR HB 1 71 CYS QB . . 3.580 2.058 1.843 3.090 . 0 0 "[ . 1 . 2]" 1
717 1 33 THR HB 1 71 CYS HB3 . . 4.110 2.159 1.999 3.200 . 0 0 "[ . 1 . 2]" 1
718 1 33 THR HB 1 72 VAL H . . 4.430 3.976 3.714 4.262 . 0 0 "[ . 1 . 2]" 1
719 1 33 THR MG 1 34 ILE H . . 3.380 2.214 1.892 2.541 . 0 0 "[ . 1 . 2]" 1
720 1 33 THR MG 1 34 ILE HB . . 4.740 4.398 4.282 4.522 . 0 0 "[ . 1 . 2]" 1
721 1 33 THR MG 1 35 PHE QD . . 4.130 3.021 2.780 3.537 . 0 0 "[ . 1 . 2]" 1
722 1 33 THR MG 1 35 PHE QE . . 3.630 2.329 2.030 2.650 . 0 0 "[ . 1 . 2]" 1
723 1 33 THR MG 1 35 PHE HZ . . 4.020 3.117 2.445 3.756 . 0 0 "[ . 1 . 2]" 1
724 1 33 THR MG 1 69 GLU HB2 . . 4.810 4.560 4.138 4.805 . 0 0 "[ . 1 . 2]" 1
725 1 33 THR MG 1 69 GLU HG2 . . 5.350 4.426 4.043 5.097 . 0 0 "[ . 1 . 2]" 1
726 1 33 THR MG 1 69 GLU QG . . 4.670 3.239 2.756 3.689 . 0 0 "[ . 1 . 2]" 1
727 1 33 THR MG 1 69 GLU HG3 . . 5.350 3.335 2.803 3.785 . 0 0 "[ . 1 . 2]" 1
728 1 33 THR MG 1 71 CYS HA . . 4.340 3.739 3.201 4.215 . 0 0 "[ . 1 . 2]" 1
729 1 33 THR MG 1 71 CYS HB2 . . 4.000 2.533 2.074 3.817 . 0 0 "[ . 1 . 2]" 1
730 1 33 THR MG 1 71 CYS HB3 . . 4.000 2.768 2.454 3.116 . 0 0 "[ . 1 . 2]" 1
731 1 33 THR MG 1 72 VAL H . . 4.880 3.915 3.470 4.519 . 0 0 "[ . 1 . 2]" 1
732 1 33 THR MG 1 105 LYS HD2 . . 4.560 4.176 3.831 4.536 . 0 0 "[ . 1 . 2]" 1
733 1 33 THR MG 1 105 LYS HD3 . . 4.800 4.535 3.587 4.769 . 0 0 "[ . 1 . 2]" 1
734 1 33 THR MG 1 105 LYS HE2 . . 3.670 2.562 2.012 3.435 . 0 0 "[ . 1 . 2]" 1
735 1 33 THR MG 1 105 LYS HE3 . . 3.670 3.129 2.175 3.659 . 0 0 "[ . 1 . 2]" 1
736 1 33 THR MG 1 105 LYS HG3 . . 3.960 2.915 2.603 3.167 . 0 0 "[ . 1 . 2]" 1
737 1 34 ILE H 1 34 ILE HB . . 3.240 2.658 2.551 2.744 . 0 0 "[ . 1 . 2]" 1
738 1 34 ILE H 1 34 ILE MD . . 4.080 3.937 3.724 4.084 0.004 11 0 "[ . 1 . 2]" 1
739 1 34 ILE H 1 34 ILE HG12 . . 4.450 4.268 4.046 4.435 . 0 0 "[ . 1 . 2]" 1
740 1 34 ILE H 1 34 ILE HG13 . . 3.680 3.050 2.835 3.280 . 0 0 "[ . 1 . 2]" 1
741 1 34 ILE H 1 34 ILE MG . . 4.020 3.832 3.760 3.888 . 0 0 "[ . 1 . 2]" 1
742 1 34 ILE H 1 35 PHE H . . 4.950 4.414 4.345 4.481 . 0 0 "[ . 1 . 2]" 1
743 1 34 ILE H 1 106 TYR HB2 . . 4.560 4.081 3.792 4.363 . 0 0 "[ . 1 . 2]" 1
744 1 34 ILE H 1 106 TYR HB3 . . 3.770 2.862 2.513 3.125 . 0 0 "[ . 1 . 2]" 1
745 1 34 ILE H 1 106 TYR QD . . 4.510 4.133 3.760 4.438 . 0 0 "[ . 1 . 2]" 1
746 1 34 ILE HA 1 34 ILE MD . . 4.010 3.848 3.809 3.881 . 0 0 "[ . 1 . 2]" 1
747 1 34 ILE HA 1 34 ILE HG12 . . 4.120 2.647 2.509 2.722 . 0 0 "[ . 1 . 2]" 1
748 1 34 ILE HA 1 34 ILE HG13 . . 4.140 2.762 2.635 2.930 . 0 0 "[ . 1 . 2]" 1
749 1 34 ILE HA 1 34 ILE MG . . 3.410 2.389 2.300 2.482 . 0 0 "[ . 1 . 2]" 1
750 1 34 ILE HA 1 35 PHE H . . 3.040 2.222 2.181 2.304 . 0 0 "[ . 1 . 2]" 1
751 1 34 ILE HA 1 71 CYS HA . . 4.900 4.358 4.102 4.547 . 0 0 "[ . 1 . 2]" 1
752 1 34 ILE HA 1 72 VAL H . . 3.630 2.470 2.273 2.636 . 0 0 "[ . 1 . 2]" 1
753 1 34 ILE HA 1 72 VAL HB . . 3.930 3.219 2.582 3.496 . 0 0 "[ . 1 . 2]" 1
754 1 34 ILE HA 1 73 PHE HA . . 5.090 4.625 4.477 4.905 . 0 0 "[ . 1 . 2]" 1
755 1 34 ILE HA 1 106 TYR HB2 . . 5.340 4.959 4.799 5.139 . 0 0 "[ . 1 . 2]" 1
756 1 34 ILE HA 1 106 TYR HB3 . . 4.770 4.590 4.421 4.767 . 0 0 "[ . 1 . 2]" 1
757 1 34 ILE HB 1 34 ILE MD . . 3.220 2.302 2.174 2.407 . 0 0 "[ . 1 . 2]" 1
758 1 34 ILE HB 1 35 PHE H . . 4.720 4.013 3.866 4.129 . 0 0 "[ . 1 . 2]" 1
759 1 34 ILE HB 1 72 VAL H . . 5.500 5.380 5.196 5.507 0.007 9 0 "[ . 1 . 2]" 1
760 1 34 ILE HB 1 106 TYR H . . 4.210 4.081 3.744 4.210 . 0 0 "[ . 1 . 2]" 1
761 1 34 ILE HB 1 106 TYR HA . . 5.390 4.832 4.743 4.990 . 0 0 "[ . 1 . 2]" 1
762 1 34 ILE HB 1 106 TYR HB2 . . 3.690 2.603 2.427 2.786 . 0 0 "[ . 1 . 2]" 1
763 1 34 ILE HB 1 106 TYR HB3 . . 3.500 2.050 1.999 2.196 . 0 0 "[ . 1 . 2]" 1
764 1 34 ILE HB 1 106 TYR QD . . 3.990 2.702 2.403 2.988 . 0 0 "[ . 1 . 2]" 1
765 1 34 ILE MD 1 35 PHE H . . 5.110 4.931 4.770 5.066 . 0 0 "[ . 1 . 2]" 1
766 1 34 ILE MD 1 74 ILE MD . . 3.610 3.174 2.952 3.413 . 0 0 "[ . 1 . 2]" 1
767 1 34 ILE MD 1 74 ILE HG13 . . 5.170 5.070 4.853 5.171 0.001 12 0 "[ . 1 . 2]" 1
768 1 34 ILE MD 1 106 TYR HB2 . . 4.470 3.984 3.751 4.199 . 0 0 "[ . 1 . 2]" 1
769 1 34 ILE MD 1 106 TYR QD . . 3.790 2.245 2.021 2.671 . 0 0 "[ . 1 . 2]" 1
770 1 34 ILE MD 1 106 TYR QE . . 4.640 3.246 3.087 3.452 . 0 0 "[ . 1 . 2]" 1
771 1 34 ILE HG12 1 35 PHE H . . 4.230 4.155 3.934 4.235 0.005 8 0 "[ . 1 . 2]" 1
772 1 34 ILE HG12 1 72 VAL H . . 5.120 4.091 3.747 4.411 . 0 0 "[ . 1 . 2]" 1
773 1 34 ILE HG13 1 34 ILE MG . . 3.340 3.177 3.153 3.197 . 0 0 "[ . 1 . 2]" 1
774 1 34 ILE HG13 1 35 PHE H . . 5.240 4.758 4.608 4.906 . 0 0 "[ . 1 . 2]" 1
775 1 34 ILE HG13 1 72 VAL MG2 . . 4.640 4.259 3.906 4.496 . 0 0 "[ . 1 . 2]" 1
776 1 34 ILE HG13 1 74 ILE MD . . 5.010 4.573 4.251 4.857 . 0 0 "[ . 1 . 2]" 1
777 1 34 ILE HG13 1 106 TYR HB3 . . 4.860 4.161 3.909 4.419 . 0 0 "[ . 1 . 2]" 1
778 1 34 ILE MG 1 35 PHE H . . 3.480 2.079 1.880 2.310 . 0 0 "[ . 1 . 2]" 1
779 1 34 ILE MG 1 35 PHE HA . . 4.170 3.468 3.212 3.583 . 0 0 "[ . 1 . 2]" 1
780 1 34 ILE MG 1 36 ALA H . . 4.310 3.530 3.322 3.724 . 0 0 "[ . 1 . 2]" 1
781 1 34 ILE MG 1 36 ALA HA . . 4.860 4.006 3.948 4.122 . 0 0 "[ . 1 . 2]" 1
782 1 34 ILE MG 1 36 ALA MB . . 3.580 3.337 3.223 3.512 . 0 0 "[ . 1 . 2]" 1
783 1 34 ILE MG 1 72 VAL H . . 4.590 4.229 3.969 4.515 . 0 0 "[ . 1 . 2]" 1
784 1 34 ILE MG 1 73 PHE HA . . 4.870 4.206 3.982 4.522 . 0 0 "[ . 1 . 2]" 1
785 1 34 ILE MG 1 74 ILE H . . 4.890 4.301 4.056 4.448 . 0 0 "[ . 1 . 2]" 1
786 1 34 ILE MG 1 74 ILE MD . . 3.130 1.800 1.696 1.922 . 0 0 "[ . 1 . 2]" 1
787 1 34 ILE MG 1 106 TYR H . . 4.250 3.866 3.420 4.143 . 0 0 "[ . 1 . 2]" 1
788 1 34 ILE MG 1 106 TYR HB2 . . 3.670 2.691 2.321 2.917 . 0 0 "[ . 1 . 2]" 1
789 1 34 ILE MG 1 106 TYR HB3 . . 3.930 3.338 3.032 3.515 . 0 0 "[ . 1 . 2]" 1
790 1 34 ILE MG 1 106 TYR QD . . 4.160 3.680 3.447 3.870 . 0 0 "[ . 1 . 2]" 1
791 1 35 PHE H 1 35 PHE HB2 . . 3.870 2.575 2.497 2.709 . 0 0 "[ . 1 . 2]" 1
792 1 35 PHE H 1 35 PHE QB . . 3.310 2.530 2.457 2.655 . 0 0 "[ . 1 . 2]" 1
793 1 35 PHE H 1 35 PHE HB3 . . 3.870 3.714 3.631 3.816 . 0 0 "[ . 1 . 2]" 1
794 1 35 PHE H 1 35 PHE QD . . 3.770 3.365 3.116 3.770 0.000 1 0 "[ . 1 . 2]" 1
795 1 35 PHE H 1 36 ALA H . . 4.860 4.086 3.976 4.143 . 0 0 "[ . 1 . 2]" 1
796 1 35 PHE H 1 72 VAL H . . 4.320 3.675 3.452 3.989 . 0 0 "[ . 1 . 2]" 1
797 1 35 PHE H 1 72 VAL HB . . 4.780 4.318 3.839 4.602 . 0 0 "[ . 1 . 2]" 1
798 1 35 PHE H 1 72 VAL MG1 . . 4.780 4.594 4.216 4.755 . 0 0 "[ . 1 . 2]" 1
799 1 35 PHE H 1 73 PHE HA . . 3.880 2.919 2.773 3.183 . 0 0 "[ . 1 . 2]" 1
800 1 35 PHE H 1 74 ILE H . . 4.370 3.841 3.601 4.003 . 0 0 "[ . 1 . 2]" 1
801 1 35 PHE H 1 106 TYR H . . 5.500 5.032 4.921 5.154 . 0 0 "[ . 1 . 2]" 1
802 1 35 PHE HA 1 35 PHE QD . . 3.740 2.750 2.564 2.899 . 0 0 "[ . 1 . 2]" 1
803 1 35 PHE HA 1 36 ALA H . . 2.940 2.150 2.144 2.157 . 0 0 "[ . 1 . 2]" 1
804 1 35 PHE HA 1 36 ALA MB . . 4.570 4.000 3.972 4.024 . 0 0 "[ . 1 . 2]" 1
805 1 35 PHE HA 1 103 LEU MD1 . . 4.890 4.047 3.927 4.196 . 0 0 "[ . 1 . 2]" 1
806 1 35 PHE HA 1 105 LYS HA . . 3.680 2.826 2.716 2.912 . 0 0 "[ . 1 . 2]" 1
807 1 35 PHE HA 1 105 LYS HG3 . . 5.500 4.335 4.099 4.625 . 0 0 "[ . 1 . 2]" 1
808 1 35 PHE HA 1 106 TYR H . . 3.860 3.034 2.856 3.196 . 0 0 "[ . 1 . 2]" 1
809 1 35 PHE QB 1 36 ALA H . . 3.840 3.534 3.456 3.586 . 0 0 "[ . 1 . 2]" 1
810 1 35 PHE QB 1 73 PHE HA . . 3.930 2.242 2.026 2.516 . 0 0 "[ . 1 . 2]" 1
811 1 35 PHE QB 1 74 ILE H . . 4.630 3.425 3.299 3.576 . 0 0 "[ . 1 . 2]" 1
812 1 35 PHE QB 1 103 LEU MD1 . . 3.480 2.558 2.232 2.685 . 0 0 "[ . 1 . 2]" 1
813 1 35 PHE QB 1 127 PHE QE . . 3.870 3.354 2.800 3.604 . 0 0 "[ . 1 . 2]" 1
814 1 35 PHE HB2 1 73 PHE HA . . 4.660 2.271 2.041 2.567 . 0 0 "[ . 1 . 2]" 1
815 1 35 PHE HB2 1 103 LEU MD1 . . 4.150 4.043 3.628 4.156 0.006 16 0 "[ . 1 . 2]" 1
816 1 35 PHE HB2 1 127 PHE QE . . 4.450 3.958 3.321 4.450 . 0 0 "[ . 1 . 2]" 1
817 1 35 PHE HB3 1 73 PHE HA . . 4.660 3.511 3.086 3.855 . 0 0 "[ . 1 . 2]" 1
818 1 35 PHE HB3 1 103 LEU MD1 . . 4.150 2.586 2.253 2.719 . 0 0 "[ . 1 . 2]" 1
819 1 35 PHE HB3 1 127 PHE QE . . 4.450 3.626 3.015 3.830 . 0 0 "[ . 1 . 2]" 1
820 1 35 PHE QD 1 36 ALA H . . 4.280 4.079 3.698 4.248 . 0 0 "[ . 1 . 2]" 1
821 1 35 PHE QD 1 71 CYS HB2 . . 4.600 2.378 2.007 3.046 . 0 0 "[ . 1 . 2]" 1
822 1 35 PHE QD 1 71 CYS QB . . 4.000 2.292 1.986 2.630 . 0 0 "[ . 1 . 2]" 1
823 1 35 PHE QD 1 71 CYS HB3 . . 4.600 3.430 2.013 3.859 . 0 0 "[ . 1 . 2]" 1
824 1 35 PHE QD 1 72 VAL H . . 4.730 3.610 3.258 3.878 . 0 0 "[ . 1 . 2]" 1
825 1 35 PHE QD 1 73 PHE HA . . 4.980 3.858 3.498 4.236 . 0 0 "[ . 1 . 2]" 1
826 1 35 PHE QD 1 103 LEU MD1 . . 4.430 2.947 2.641 3.167 . 0 0 "[ . 1 . 2]" 1
827 1 35 PHE QD 1 103 LEU MD2 . . 4.480 3.572 3.295 3.817 . 0 0 "[ . 1 . 2]" 1
828 1 35 PHE QD 1 103 LEU HG . . 5.000 3.057 2.780 3.347 . 0 0 "[ . 1 . 2]" 1
829 1 35 PHE QD 1 105 LYS HA . . 4.060 2.807 2.543 3.032 . 0 0 "[ . 1 . 2]" 1
830 1 35 PHE QD 1 105 LYS HB2 . . 4.480 3.282 2.990 3.577 . 0 0 "[ . 1 . 2]" 1
831 1 35 PHE QD 1 105 LYS HB3 . . 5.230 4.797 4.592 5.027 . 0 0 "[ . 1 . 2]" 1
832 1 35 PHE QD 1 106 TYR H . . 4.680 4.493 4.268 4.682 0.002 5 0 "[ . 1 . 2]" 1
833 1 35 PHE QD 1 126 ILE MD . . 4.220 3.870 3.560 4.210 . 0 0 "[ . 1 . 2]" 1
834 1 35 PHE QD 1 126 ILE MG . . 4.490 4.262 3.952 4.492 0.002 1 0 "[ . 1 . 2]" 1
835 1 35 PHE QD 1 127 PHE QD . . 4.920 4.224 3.757 4.417 . 0 0 "[ . 1 . 2]" 1
836 1 35 PHE QD 1 127 PHE QE . . 4.380 2.972 2.838 3.229 . 0 0 "[ . 1 . 2]" 1
837 1 35 PHE QE 1 67 VAL MG1 . . 5.060 4.944 4.639 5.061 0.001 3 0 "[ . 1 . 2]" 1
838 1 35 PHE QE 1 67 VAL MG2 . . 4.020 3.165 2.800 3.464 . 0 0 "[ . 1 . 2]" 1
839 1 35 PHE QE 1 71 CYS HB2 . . 4.360 2.799 2.222 3.638 . 0 0 "[ . 1 . 2]" 1
840 1 35 PHE QE 1 71 CYS HB3 . . 4.360 2.604 2.241 3.179 . 0 0 "[ . 1 . 2]" 1
841 1 35 PHE QE 1 105 LYS HB2 . . 3.950 2.192 1.997 2.528 . 0 0 "[ . 1 . 2]" 1
842 1 35 PHE QE 1 105 LYS HB3 . . 4.700 3.794 3.615 4.107 . 0 0 "[ . 1 . 2]" 1
843 1 35 PHE QE 1 105 LYS HD2 . . 4.170 2.246 1.995 3.928 . 0 0 "[ . 1 . 2]" 1
844 1 35 PHE QE 1 105 LYS HE2 . . 4.770 3.638 2.860 4.647 . 0 0 "[ . 1 . 2]" 1
845 1 35 PHE QE 1 105 LYS QE . . 4.090 3.045 2.616 3.433 . 0 0 "[ . 1 . 2]" 1
846 1 35 PHE QE 1 105 LYS HE3 . . 4.770 3.527 2.662 4.050 . 0 0 "[ . 1 . 2]" 1
847 1 35 PHE QE 1 126 ILE MD . . 4.400 2.890 2.396 3.223 . 0 0 "[ . 1 . 2]" 1
848 1 35 PHE QE 1 126 ILE HG12 . . 4.140 2.360 2.006 2.660 . 0 0 "[ . 1 . 2]" 1
849 1 35 PHE QE 1 126 ILE MG . . 3.830 3.208 2.729 3.629 . 0 0 "[ . 1 . 2]" 1
850 1 35 PHE QE 1 127 PHE HA . . 4.300 4.025 3.550 4.286 . 0 0 "[ . 1 . 2]" 1
851 1 35 PHE QE 1 127 PHE QD . . 4.560 3.005 2.388 3.276 . 0 0 "[ . 1 . 2]" 1
852 1 35 PHE HZ 1 105 LYS HD2 . . 4.840 2.530 2.083 4.739 . 0 0 "[ . 1 . 2]" 1
853 1 35 PHE HZ 1 105 LYS HE2 . . 4.430 2.890 2.143 4.220 . 0 0 "[ . 1 . 2]" 1
854 1 35 PHE HZ 1 105 LYS QE . . 3.870 2.178 1.982 2.588 . 0 0 "[ . 1 . 2]" 1
855 1 35 PHE HZ 1 105 LYS HE3 . . 4.430 2.484 2.001 3.156 . 0 0 "[ . 1 . 2]" 1
856 1 35 PHE HZ 1 126 ILE HG12 . . 4.110 3.521 2.719 3.940 . 0 0 "[ . 1 . 2]" 1
857 1 35 PHE HZ 1 127 PHE HA . . 4.020 3.231 2.698 3.579 . 0 0 "[ . 1 . 2]" 1
858 1 35 PHE HZ 1 127 PHE QD . . 4.960 2.609 2.332 2.850 . 0 0 "[ . 1 . 2]" 1
859 1 36 ALA H 1 36 ALA MB . . 3.290 2.188 2.171 2.216 . 0 0 "[ . 1 . 2]" 1
860 1 36 ALA H 1 37 TYR H . . 4.860 4.441 4.370 4.509 . 0 0 "[ . 1 . 2]" 1
861 1 36 ALA H 1 38 PHE QE . . 5.390 5.041 4.693 5.279 . 0 0 "[ . 1 . 2]" 1
862 1 36 ALA H 1 103 LEU MD1 . . 4.130 3.938 3.846 4.064 . 0 0 "[ . 1 . 2]" 1
863 1 36 ALA H 1 104 LEU H . . 4.050 3.853 3.667 4.036 . 0 0 "[ . 1 . 2]" 1
864 1 36 ALA H 1 104 LEU HB3 . . 4.600 4.182 3.914 4.487 . 0 0 "[ . 1 . 2]" 1
865 1 36 ALA H 1 104 LEU MD1 . . 5.500 5.395 5.276 5.484 . 0 0 "[ . 1 . 2]" 1
866 1 36 ALA H 1 104 LEU HG . . 4.520 4.167 3.999 4.313 . 0 0 "[ . 1 . 2]" 1
867 1 36 ALA H 1 105 LYS HA . . 4.230 3.861 3.736 4.055 . 0 0 "[ . 1 . 2]" 1
868 1 36 ALA H 1 106 TYR H . . 4.180 3.445 3.308 3.605 . 0 0 "[ . 1 . 2]" 1
869 1 36 ALA HA 1 37 TYR H . . 2.890 2.149 2.141 2.173 . 0 0 "[ . 1 . 2]" 1
870 1 36 ALA HA 1 37 TYR HB3 . . 5.010 4.627 4.564 4.680 . 0 0 "[ . 1 . 2]" 1
871 1 36 ALA HA 1 38 PHE QE . . 5.410 5.016 4.640 5.399 . 0 0 "[ . 1 . 2]" 1
872 1 36 ALA HA 1 74 ILE H . . 3.550 3.254 3.114 3.357 . 0 0 "[ . 1 . 2]" 1
873 1 36 ALA HA 1 74 ILE HB . . 3.670 2.273 2.140 2.380 . 0 0 "[ . 1 . 2]" 1
874 1 36 ALA HA 1 74 ILE HG13 . . 5.500 4.227 4.055 4.424 . 0 0 "[ . 1 . 2]" 1
875 1 36 ALA HA 1 74 ILE MG . . 4.680 3.550 3.414 3.757 . 0 0 "[ . 1 . 2]" 1
876 1 36 ALA HA 1 103 LEU MD1 . . 4.640 4.535 4.403 4.646 0.006 6 0 "[ . 1 . 2]" 1
877 1 36 ALA MB 1 37 TYR H . . 3.660 3.174 3.016 3.291 . 0 0 "[ . 1 . 2]" 1
878 1 36 ALA MB 1 37 TYR HA . . 5.020 4.145 4.067 4.223 . 0 0 "[ . 1 . 2]" 1
879 1 36 ALA MB 1 38 PHE QE . . 3.340 2.716 2.350 3.030 . 0 0 "[ . 1 . 2]" 1
880 1 36 ALA MB 1 38 PHE HZ . . 4.440 2.568 2.397 2.877 . 0 0 "[ . 1 . 2]" 1
881 1 36 ALA MB 1 74 ILE H . . 4.770 4.692 4.576 4.774 0.004 10 0 "[ . 1 . 2]" 1
882 1 36 ALA MB 1 74 ILE HB . . 3.560 3.079 3.004 3.162 . 0 0 "[ . 1 . 2]" 1
883 1 36 ALA MB 1 74 ILE MD . . 4.180 3.387 3.267 3.502 . 0 0 "[ . 1 . 2]" 1
884 1 36 ALA MB 1 74 ILE HG12 . . 5.500 5.471 5.395 5.503 0.003 8 0 "[ . 1 . 2]" 1
885 1 36 ALA MB 1 74 ILE HG13 . . 4.960 4.732 4.563 4.903 . 0 0 "[ . 1 . 2]" 1
886 1 36 ALA MB 1 104 LEU H . . 4.000 3.666 3.498 3.873 . 0 0 "[ . 1 . 2]" 1
887 1 36 ALA MB 1 104 LEU HB3 . . 3.950 3.277 3.075 3.560 . 0 0 "[ . 1 . 2]" 1
888 1 36 ALA MB 1 104 LEU HG . . 3.920 3.829 3.564 3.923 0.003 2 0 "[ . 1 . 2]" 1
889 1 36 ALA MB 1 106 TYR HB2 . . 4.320 4.072 3.948 4.230 . 0 0 "[ . 1 . 2]" 1
890 1 37 TYR H 1 37 TYR HB2 . . 3.720 2.911 2.827 3.014 . 0 0 "[ . 1 . 2]" 1
891 1 37 TYR H 1 37 TYR HB3 . . 3.440 2.584 2.528 2.642 . 0 0 "[ . 1 . 2]" 1
892 1 37 TYR H 1 37 TYR QD . . 4.520 4.298 4.268 4.334 . 0 0 "[ . 1 . 2]" 1
893 1 37 TYR H 1 73 PHE QE . . 4.340 4.261 4.055 4.336 . 0 0 "[ . 1 . 2]" 1
894 1 37 TYR H 1 73 PHE HZ . . 5.270 4.564 4.280 4.818 . 0 0 "[ . 1 . 2]" 1
895 1 37 TYR H 1 74 ILE H . . 4.320 3.727 3.532 3.924 . 0 0 "[ . 1 . 2]" 1
896 1 37 TYR H 1 74 ILE HB . . 4.150 3.630 3.454 3.787 . 0 0 "[ . 1 . 2]" 1
897 1 37 TYR H 1 74 ILE MG . . 4.780 4.055 3.898 4.251 . 0 0 "[ . 1 . 2]" 1
898 1 37 TYR H 1 75 TYR HA . . 4.070 3.163 3.012 3.381 . 0 0 "[ . 1 . 2]" 1
899 1 37 TYR H 1 76 CYS H . . 4.150 2.779 2.542 2.963 . 0 0 "[ . 1 . 2]" 1
900 1 37 TYR H 1 103 LEU MD1 . . 4.480 4.084 3.798 4.319 . 0 0 "[ . 1 . 2]" 1
901 1 37 TYR HA 1 37 TYR QD . . 3.430 2.289 2.191 2.480 . 0 0 "[ . 1 . 2]" 1
902 1 37 TYR HA 1 37 TYR QE . . 4.780 4.432 4.381 4.512 . 0 0 "[ . 1 . 2]" 1
903 1 37 TYR HA 1 38 PHE H . . 3.000 2.271 2.180 2.351 . 0 0 "[ . 1 . 2]" 1
904 1 37 TYR HA 1 38 PHE HB2 . . 5.460 4.840 4.773 4.946 . 0 0 "[ . 1 . 2]" 1
905 1 37 TYR HA 1 73 PHE HZ . . 5.030 4.515 4.391 4.831 . 0 0 "[ . 1 . 2]" 1
906 1 37 TYR HA 1 103 LEU HA . . 3.720 2.633 2.401 2.742 . 0 0 "[ . 1 . 2]" 1
907 1 37 TYR HA 1 103 LEU MD1 . . 3.670 2.752 2.537 2.910 . 0 0 "[ . 1 . 2]" 1
908 1 37 TYR HA 1 104 LEU H . . 4.130 3.839 3.616 4.016 . 0 0 "[ . 1 . 2]" 1
909 1 37 TYR HB2 1 38 PHE H . . 4.690 4.573 4.485 4.615 . 0 0 "[ . 1 . 2]" 1
910 1 37 TYR HB2 1 60 ILE MG . . 4.470 3.708 3.543 3.817 . 0 0 "[ . 1 . 2]" 1
911 1 37 TYR HB2 1 73 PHE QE . . 3.660 2.424 2.168 2.831 . 0 0 "[ . 1 . 2]" 1
912 1 37 TYR HB2 1 73 PHE HZ . . 4.110 2.135 2.000 2.487 . 0 0 "[ . 1 . 2]" 1
913 1 37 TYR HB2 1 75 TYR HA . . 4.480 3.855 3.675 4.175 . 0 0 "[ . 1 . 2]" 1
914 1 37 TYR HB2 1 76 CYS H . . 4.870 4.755 4.580 4.866 . 0 0 "[ . 1 . 2]" 1
915 1 37 TYR HB2 1 103 LEU HA . . 5.030 4.276 3.978 4.459 . 0 0 "[ . 1 . 2]" 1
916 1 37 TYR HB2 1 103 LEU MD1 . . 3.410 2.639 2.345 2.833 . 0 0 "[ . 1 . 2]" 1
917 1 37 TYR HB3 1 60 ILE MD . . 5.310 4.786 4.652 4.930 . 0 0 "[ . 1 . 2]" 1
918 1 37 TYR HB3 1 60 ILE MG . . 5.020 4.909 4.653 5.017 . 0 0 "[ . 1 . 2]" 1
919 1 37 TYR HB3 1 73 PHE QE . . 3.690 3.416 2.943 3.614 . 0 0 "[ . 1 . 2]" 1
920 1 37 TYR HB3 1 73 PHE HZ . . 4.050 2.704 2.309 2.973 . 0 0 "[ . 1 . 2]" 1
921 1 37 TYR HB3 1 75 TYR HA . . 3.510 2.332 2.177 2.625 . 0 0 "[ . 1 . 2]" 1
922 1 37 TYR HB3 1 103 LEU MD1 . . 4.240 4.053 3.766 4.222 . 0 0 "[ . 1 . 2]" 1
923 1 37 TYR QD 1 38 PHE H . . 3.970 3.898 3.675 3.975 0.005 15 0 "[ . 1 . 2]" 1
924 1 37 TYR QD 1 39 SER QB . . 4.250 3.517 2.967 3.911 . 0 0 "[ . 1 . 2]" 1
925 1 37 TYR QD 1 56 ALA MB . . 5.370 5.225 4.942 5.368 . 0 0 "[ . 1 . 2]" 1
926 1 37 TYR QD 1 60 ILE MD . . 3.700 2.640 2.519 2.728 . 0 0 "[ . 1 . 2]" 1
927 1 37 TYR QD 1 75 TYR HA . . 4.350 3.363 3.147 3.511 . 0 0 "[ . 1 . 2]" 1
928 1 37 TYR QD 1 75 TYR QD . . 3.800 2.910 2.394 3.602 . 0 0 "[ . 1 . 2]" 1
929 1 37 TYR QD 1 76 CYS H . . 4.650 4.528 4.224 4.644 . 0 0 "[ . 1 . 2]" 1
930 1 37 TYR QD 1 101 PRO QB . . 4.610 3.535 3.412 3.679 . 0 0 "[ . 1 . 2]" 1
931 1 37 TYR QD 1 103 LEU H . . 5.150 4.208 3.792 4.409 . 0 0 "[ . 1 . 2]" 1
932 1 37 TYR QD 1 103 LEU HA . . 4.000 2.912 2.604 3.114 . 0 0 "[ . 1 . 2]" 1
933 1 37 TYR QD 1 103 LEU HB2 . . 3.860 2.540 2.174 2.825 . 0 0 "[ . 1 . 2]" 1
934 1 37 TYR QD 1 103 LEU HB3 . . 4.530 4.231 3.850 4.512 . 0 0 "[ . 1 . 2]" 1
935 1 37 TYR QD 1 103 LEU MD1 . . 3.580 2.365 2.136 2.589 . 0 0 "[ . 1 . 2]" 1
936 1 37 TYR QD 1 103 LEU MD2 . . 4.600 4.009 3.749 4.221 . 0 0 "[ . 1 . 2]" 1
937 1 37 TYR QE 1 39 SER HB2 . . 4.070 3.543 2.799 4.016 . 0 0 "[ . 1 . 2]" 1
938 1 37 TYR QE 1 39 SER HB3 . . 4.070 3.230 2.395 3.897 . 0 0 "[ . 1 . 2]" 1
939 1 37 TYR QE 1 53 CYS HA . . 4.740 4.313 3.710 4.724 . 0 0 "[ . 1 . 2]" 1
940 1 37 TYR QE 1 56 ALA MB . . 3.830 3.488 3.239 3.634 . 0 0 "[ . 1 . 2]" 1
941 1 37 TYR QE 1 57 GLU HA . . 4.820 3.628 3.209 4.157 . 0 0 "[ . 1 . 2]" 1
942 1 37 TYR QE 1 57 GLU QB . . 5.070 3.989 3.511 4.426 . 0 0 "[ . 1 . 2]" 1
943 1 37 TYR QE 1 60 ILE MD . . 3.620 1.948 1.877 2.141 . 0 0 "[ . 1 . 2]" 1
944 1 37 TYR QE 1 60 ILE HG12 . . 5.070 4.552 4.431 4.787 . 0 0 "[ . 1 . 2]" 1
945 1 37 TYR QE 1 60 ILE HG13 . . 4.670 4.110 3.931 4.285 . 0 0 "[ . 1 . 2]" 1
946 1 37 TYR QE 1 75 TYR QD . . 4.770 4.239 3.862 4.769 . 0 0 "[ . 1 . 2]" 1
947 1 37 TYR QE 1 101 PRO HA . . 4.640 4.433 4.328 4.572 . 0 0 "[ . 1 . 2]" 1
948 1 37 TYR QE 1 101 PRO HB2 . . 3.670 2.015 1.993 2.106 . 0 0 "[ . 1 . 2]" 1
949 1 37 TYR QE 1 101 PRO QB . . 3.110 1.994 1.975 2.082 . 0 0 "[ . 1 . 2]" 1
950 1 37 TYR QE 1 101 PRO HB3 . . 3.670 3.201 3.118 3.271 . 0 0 "[ . 1 . 2]" 1
951 1 37 TYR QE 1 101 PRO HG2 . . 5.020 3.486 3.329 3.690 . 0 0 "[ . 1 . 2]" 1
952 1 37 TYR QE 1 101 PRO HG3 . . 4.580 3.696 3.507 3.867 . 0 0 "[ . 1 . 2]" 1
953 1 37 TYR QE 1 102 THR H . . 4.500 4.458 4.176 4.506 0.006 16 0 "[ . 1 . 2]" 1
954 1 37 TYR QE 1 103 LEU MD1 . . 5.360 3.974 3.743 4.151 . 0 0 "[ . 1 . 2]" 1
955 1 38 PHE H 1 38 PHE HB2 . . 3.510 2.665 2.609 2.771 . 0 0 "[ . 1 . 2]" 1
956 1 38 PHE H 1 38 PHE HB3 . . 4.000 3.605 3.581 3.640 . 0 0 "[ . 1 . 2]" 1
957 1 38 PHE H 1 38 PHE QD . . 3.180 2.684 2.324 2.876 . 0 0 "[ . 1 . 2]" 1
958 1 38 PHE H 1 39 SER H . . 4.990 4.381 4.258 4.532 . 0 0 "[ . 1 . 2]" 1
959 1 38 PHE H 1 100 VAL MG1 . . 5.360 4.988 4.605 5.330 . 0 0 "[ . 1 . 2]" 1
960 1 38 PHE H 1 102 THR H . . 3.730 3.437 3.270 3.637 . 0 0 "[ . 1 . 2]" 1
961 1 38 PHE H 1 102 THR HB . . 4.420 3.735 3.573 3.889 . 0 0 "[ . 1 . 2]" 1
962 1 38 PHE H 1 102 THR MG . . 4.850 4.442 4.203 4.734 . 0 0 "[ . 1 . 2]" 1
963 1 38 PHE H 1 103 LEU HA . . 4.200 3.666 3.490 3.763 . 0 0 "[ . 1 . 2]" 1
964 1 38 PHE H 1 103 LEU MD1 . . 4.650 4.500 4.254 4.639 . 0 0 "[ . 1 . 2]" 1
965 1 38 PHE H 1 104 LEU H . . 5.050 4.078 3.924 4.217 . 0 0 "[ . 1 . 2]" 1
966 1 38 PHE HA 1 38 PHE QD . . 4.240 2.643 2.506 2.882 . 0 0 "[ . 1 . 2]" 1
967 1 38 PHE HA 1 39 SER H . . 2.930 2.154 2.138 2.191 . 0 0 "[ . 1 . 2]" 1
968 1 38 PHE HA 1 76 CYS H . . 4.180 3.851 3.671 4.043 . 0 0 "[ . 1 . 2]" 1
969 1 38 PHE HA 1 76 CYS HB2 . . 4.870 4.680 4.375 4.870 . 0 0 "[ . 1 . 2]" 1
970 1 38 PHE HA 1 76 CYS HB3 . . 4.070 2.951 2.631 3.171 . 0 0 "[ . 1 . 2]" 1
971 1 38 PHE HA 1 78 VAL H . . 5.020 4.007 3.679 4.366 . 0 0 "[ . 1 . 2]" 1
972 1 38 PHE HA 1 78 VAL MG1 . . 4.350 3.279 2.666 3.740 . 0 0 "[ . 1 . 2]" 1
973 1 38 PHE HA 1 102 THR H . . 5.150 4.660 4.530 4.917 . 0 0 "[ . 1 . 2]" 1
974 1 38 PHE HB2 1 39 SER H . . 4.390 4.257 4.065 4.390 0.000 10 0 "[ . 1 . 2]" 1
975 1 38 PHE HB2 1 78 VAL MG1 . . 3.910 3.436 2.982 3.851 . 0 0 "[ . 1 . 2]" 1
976 1 38 PHE HB2 1 97 ILE MD . . 4.610 3.337 2.928 3.871 . 0 0 "[ . 1 . 2]" 1
977 1 38 PHE HB2 1 97 ILE MG . . 4.380 3.347 3.165 3.623 . 0 0 "[ . 1 . 2]" 1
978 1 38 PHE HB2 1 100 VAL MG1 . . 3.900 2.919 2.538 3.175 . 0 0 "[ . 1 . 2]" 1
979 1 38 PHE HB2 1 102 THR H . . 3.800 2.854 2.690 3.075 . 0 0 "[ . 1 . 2]" 1
980 1 38 PHE HB2 1 102 THR HB . . 3.710 2.415 2.137 2.612 . 0 0 "[ . 1 . 2]" 1
981 1 38 PHE HB2 1 102 THR HG1 . . 5.500 4.659 4.180 5.005 . 0 0 "[ . 1 . 2]" 1
982 1 38 PHE HB2 1 102 THR MG . . 4.360 3.961 3.743 4.186 . 0 0 "[ . 1 . 2]" 1
983 1 38 PHE HB3 1 39 SER H . . 4.180 3.661 3.328 3.881 . 0 0 "[ . 1 . 2]" 1
984 1 38 PHE HB3 1 78 VAL H . . 4.950 4.323 3.948 4.790 . 0 0 "[ . 1 . 2]" 1
985 1 38 PHE HB3 1 78 VAL MG1 . . 3.540 2.282 1.899 2.683 . 0 0 "[ . 1 . 2]" 1
986 1 38 PHE HB3 1 78 VAL MG2 . . 4.900 4.512 4.191 4.881 . 0 0 "[ . 1 . 2]" 1
987 1 38 PHE HB3 1 91 PHE QE . . 4.960 4.133 3.729 4.644 . 0 0 "[ . 1 . 2]" 1
988 1 38 PHE HB3 1 97 ILE MG . . 4.190 3.995 3.745 4.189 . 0 0 "[ . 1 . 2]" 1
989 1 38 PHE HB3 1 100 VAL MG1 . . 3.800 3.136 2.864 3.332 . 0 0 "[ . 1 . 2]" 1
990 1 38 PHE HB3 1 102 THR H . . 4.860 4.351 4.148 4.558 . 0 0 "[ . 1 . 2]" 1
991 1 38 PHE HB3 1 102 THR HB . . 4.280 4.053 3.750 4.277 . 0 0 "[ . 1 . 2]" 1
992 1 38 PHE QD 1 39 SER H . . 4.550 4.460 4.289 4.554 0.004 7 0 "[ . 1 . 2]" 1
993 1 38 PHE QD 1 76 CYS H . . 5.230 4.700 4.375 5.038 . 0 0 "[ . 1 . 2]" 1
994 1 38 PHE QD 1 76 CYS HB2 . . 4.680 3.936 3.679 4.354 . 0 0 "[ . 1 . 2]" 1
995 1 38 PHE QD 1 76 CYS HB3 . . 4.170 2.556 2.204 2.971 . 0 0 "[ . 1 . 2]" 1
996 1 38 PHE QD 1 76 CYS HG . . 4.740 2.623 2.105 3.448 . 0 0 "[ . 1 . 2]" 1
997 1 38 PHE QD 1 78 VAL MG1 . . 3.780 3.468 3.149 3.782 0.002 2 0 "[ . 1 . 2]" 1
998 1 38 PHE QD 1 91 PHE QD . . 4.260 3.411 3.060 3.763 . 0 0 "[ . 1 . 2]" 1
999 1 38 PHE QD 1 91 PHE QE . . 4.080 2.607 2.123 3.170 . 0 0 "[ . 1 . 2]" 1
1000 1 38 PHE QD 1 95 LEU MD1 . . 3.740 3.310 3.152 3.526 . 0 0 "[ . 1 . 2]" 1
1001 1 38 PHE QD 1 97 ILE MD . . 3.560 2.325 1.980 2.711 . 0 0 "[ . 1 . 2]" 1
1002 1 38 PHE QD 1 97 ILE HG12 . . 5.280 4.729 4.422 5.032 . 0 0 "[ . 1 . 2]" 1
1003 1 38 PHE QD 1 97 ILE HG13 . . 4.530 3.755 3.071 4.040 . 0 0 "[ . 1 . 2]" 1
1004 1 38 PHE QD 1 97 ILE MG . . 4.540 3.545 3.059 3.949 . 0 0 "[ . 1 . 2]" 1
1005 1 38 PHE QD 1 102 THR H . . 3.980 3.895 3.701 3.981 0.001 4 0 "[ . 1 . 2]" 1
1006 1 38 PHE QD 1 102 THR HB . . 3.470 2.154 2.005 2.510 . 0 0 "[ . 1 . 2]" 1
1007 1 38 PHE QD 1 102 THR MG . . 3.550 2.713 2.310 3.148 . 0 0 "[ . 1 . 2]" 1
1008 1 38 PHE QD 1 103 LEU H . . 5.500 5.133 4.991 5.372 . 0 0 "[ . 1 . 2]" 1
1009 1 38 PHE QD 1 104 LEU H . . 4.710 3.806 3.536 4.161 . 0 0 "[ . 1 . 2]" 1
1010 1 38 PHE QE 1 76 CYS HB2 . . 5.080 4.007 3.719 4.546 . 0 0 "[ . 1 . 2]" 1
1011 1 38 PHE QE 1 91 PHE QD . . 4.860 3.785 3.125 4.265 . 0 0 "[ . 1 . 2]" 1
1012 1 38 PHE QE 1 91 PHE QE . . 4.340 3.204 2.734 3.771 . 0 0 "[ . 1 . 2]" 1
1013 1 38 PHE QE 1 97 ILE MD . . 3.950 2.578 2.328 3.023 . 0 0 "[ . 1 . 2]" 1
1014 1 38 PHE QE 1 97 ILE HG12 . . 5.500 4.935 4.721 5.297 . 0 0 "[ . 1 . 2]" 1
1015 1 38 PHE QE 1 104 LEU H . . 4.890 3.459 3.181 3.747 . 0 0 "[ . 1 . 2]" 1
1016 1 38 PHE QE 1 104 LEU HB2 . . 4.000 3.071 2.813 3.465 . 0 0 "[ . 1 . 2]" 1
1017 1 38 PHE QE 1 104 LEU HB3 . . 3.830 2.101 1.999 2.365 . 0 0 "[ . 1 . 2]" 1
1018 1 38 PHE QE 1 104 LEU MD1 . . 4.550 4.392 4.257 4.539 . 0 0 "[ . 1 . 2]" 1
1019 1 38 PHE QE 1 104 LEU MD2 . . 3.590 2.300 2.135 2.555 . 0 0 "[ . 1 . 2]" 1
1020 1 38 PHE QE 1 104 LEU HG . . 4.510 4.198 3.957 4.394 . 0 0 "[ . 1 . 2]" 1
1021 1 38 PHE HZ 1 104 LEU MD2 . . 4.810 2.762 2.501 3.001 . 0 0 "[ . 1 . 2]" 1
1022 1 39 SER H 1 39 SER HB2 . . 4.090 3.644 2.795 4.003 . 0 0 "[ . 1 . 2]" 1
1023 1 39 SER H 1 39 SER QB . . 3.400 2.955 2.487 3.272 . 0 0 "[ . 1 . 2]" 1
1024 1 39 SER H 1 39 SER HB3 . . 4.090 3.214 2.548 3.935 . 0 0 "[ . 1 . 2]" 1
1025 1 39 SER H 1 40 GLY H . . 4.840 4.401 4.303 4.460 . 0 0 "[ . 1 . 2]" 1
1026 1 39 SER H 1 76 CYS H . . 4.970 4.610 4.320 4.951 . 0 0 "[ . 1 . 2]" 1
1027 1 39 SER H 1 77 GLN HA . . 4.060 2.800 2.276 3.159 . 0 0 "[ . 1 . 2]" 1
1028 1 39 SER H 1 78 VAL H . . 4.220 2.985 2.277 3.599 . 0 0 "[ . 1 . 2]" 1
1029 1 39 SER H 1 78 VAL MG1 . . 3.800 3.189 2.700 3.794 . 0 0 "[ . 1 . 2]" 1
1030 1 39 SER H 1 100 VAL MG1 . . 4.680 4.385 3.945 4.680 0.000 11 0 "[ . 1 . 2]" 1
1031 1 39 SER HA 1 40 GLY H . . 3.280 2.392 2.186 2.499 . 0 0 "[ . 1 . 2]" 1
1032 1 39 SER HA 1 78 VAL H . . 5.500 4.390 4.037 4.837 . 0 0 "[ . 1 . 2]" 1
1033 1 39 SER HA 1 78 VAL MG1 . . 4.690 3.533 2.831 4.199 . 0 0 "[ . 1 . 2]" 1
1034 1 39 SER HA 1 78 VAL MG2 . . 4.900 3.673 3.061 4.150 . 0 0 "[ . 1 . 2]" 1
1035 1 39 SER HA 1 100 VAL HB . . 4.000 2.284 1.999 2.864 . 0 0 "[ . 1 . 2]" 1
1036 1 39 SER HA 1 100 VAL MG1 . . 4.040 3.227 2.708 3.532 . 0 0 "[ . 1 . 2]" 1
1037 1 39 SER HA 1 100 VAL MG2 . . 4.560 3.340 2.932 3.916 . 0 0 "[ . 1 . 2]" 1
1038 1 39 SER HA 1 102 THR H . . 5.380 3.990 3.755 4.249 . 0 0 "[ . 1 . 2]" 1
1039 1 39 SER QB 1 40 GLY H . . 3.820 2.709 2.252 3.608 . 0 0 "[ . 1 . 2]" 1
1040 1 39 SER QB 1 53 CYS QB . . 3.730 3.099 2.257 3.731 0.001 19 0 "[ . 1 . 2]" 1
1041 1 39 SER QB 1 75 TYR QE . . 4.440 3.892 3.062 4.425 . 0 0 "[ . 1 . 2]" 1
1042 1 39 SER HB2 1 40 GLY H . . 4.520 2.961 2.306 3.979 . 0 0 "[ . 1 . 2]" 1
1043 1 39 SER HB3 1 40 GLY H . . 4.520 3.658 2.287 4.284 . 0 0 "[ . 1 . 2]" 1
1044 1 40 GLY H 1 41 SER H . . 5.050 4.635 4.578 4.648 . 0 0 "[ . 1 . 2]" 1
1045 1 40 GLY H 1 49 TRP HE1 . . 5.120 4.506 4.112 4.941 . 0 0 "[ . 1 . 2]" 1
1046 1 40 GLY H 1 50 CYS QB . . 4.920 4.161 3.826 4.916 . 0 0 "[ . 1 . 2]" 1
1047 1 40 GLY H 1 53 CYS QB . . 4.290 3.929 3.497 4.246 . 0 0 "[ . 1 . 2]" 1
1048 1 40 GLY H 1 78 VAL MG2 . . 4.920 3.444 2.986 3.860 . 0 0 "[ . 1 . 2]" 1
1049 1 40 GLY H 1 100 VAL HB . . 4.340 3.664 3.243 4.004 . 0 0 "[ . 1 . 2]" 1
1050 1 40 GLY H 1 100 VAL MG1 . . 4.650 4.426 3.848 4.653 0.003 1 0 "[ . 1 . 2]" 1
1051 1 40 GLY H 1 100 VAL MG2 . . 4.030 3.260 2.852 3.875 . 0 0 "[ . 1 . 2]" 1
1052 1 40 GLY QA 1 41 SER H . . 3.010 2.206 2.121 2.263 . 0 0 "[ . 1 . 2]" 1
1053 1 40 GLY QA 1 49 TRP HD1 . . 4.770 3.837 3.443 4.182 . 0 0 "[ . 1 . 2]" 1
1054 1 40 GLY QA 1 49 TRP HE1 . . 3.470 2.144 1.844 2.481 . 0 0 "[ . 1 . 2]" 1
1055 1 40 GLY QA 1 78 VAL MG2 . . 3.190 2.019 1.880 2.228 . 0 0 "[ . 1 . 2]" 1
1056 1 40 GLY QA 1 79 GLY H . . 5.060 3.069 2.661 4.448 . 0 0 "[ . 1 . 2]" 1
1057 1 40 GLY QA 1 100 VAL MG2 . . 4.120 3.780 3.535 4.012 . 0 0 "[ . 1 . 2]" 1
1058 1 40 GLY HA2 1 49 TRP HE1 . . 4.100 2.676 2.436 2.945 . 0 0 "[ . 1 . 2]" 1
1059 1 40 GLY HA2 1 49 TRP HZ2 . . 4.490 2.921 2.469 3.782 . 0 0 "[ . 1 . 2]" 1
1060 1 40 GLY HA2 1 78 VAL MG2 . . 3.900 2.035 1.894 2.247 . 0 0 "[ . 1 . 2]" 1
1061 1 40 GLY HA2 1 100 VAL MG2 . . 4.820 4.257 3.943 4.551 . 0 0 "[ . 1 . 2]" 1
1062 1 40 GLY HA3 1 49 TRP HE1 . . 4.100 2.264 1.902 2.671 . 0 0 "[ . 1 . 2]" 1
1063 1 40 GLY HA3 1 49 TRP HZ2 . . 4.490 2.758 2.331 3.234 . 0 0 "[ . 1 . 2]" 1
1064 1 40 GLY HA3 1 78 VAL MG2 . . 3.900 3.402 3.163 3.689 . 0 0 "[ . 1 . 2]" 1
1065 1 40 GLY HA3 1 100 VAL MG2 . . 4.820 4.231 3.986 4.474 . 0 0 "[ . 1 . 2]" 1
1066 1 41 SER H 1 41 SER HB2 . . 3.910 3.109 2.303 3.602 . 0 0 "[ . 1 . 2]" 1
1067 1 41 SER H 1 41 SER HB3 . . 3.910 2.688 2.406 3.604 . 0 0 "[ . 1 . 2]" 1
1068 1 41 SER H 1 49 TRP H . . 5.500 5.070 4.521 5.470 . 0 0 "[ . 1 . 2]" 1
1069 1 41 SER H 1 49 TRP HD1 . . 4.070 3.765 3.273 4.039 . 0 0 "[ . 1 . 2]" 1
1070 1 41 SER H 1 49 TRP HE1 . . 3.370 2.235 1.834 3.134 . 0 0 "[ . 1 . 2]" 1
1071 1 41 SER H 1 78 VAL H . . 5.120 4.668 3.456 5.031 . 0 0 "[ . 1 . 2]" 1
1072 1 41 SER H 1 78 VAL MG2 . . 4.170 3.312 2.962 3.563 . 0 0 "[ . 1 . 2]" 1
1073 1 41 SER H 1 79 GLY H . . 3.730 3.089 2.670 3.698 . 0 0 "[ . 1 . 2]" 1
1074 1 41 SER HA 1 42 LYS H . . 3.000 2.358 2.189 2.522 . 0 0 "[ . 1 . 2]" 1
1075 1 41 SER HA 1 42 LYS QG . . 5.340 3.624 3.366 3.857 . 0 0 "[ . 1 . 2]" 1
1076 1 41 SER HA 1 77 GLN HB3 . . 4.060 2.336 2.010 2.798 . 0 0 "[ . 1 . 2]" 1
1077 1 41 SER HA 1 77 GLN QG . . 3.830 2.437 1.989 3.304 . 0 0 "[ . 1 . 2]" 1
1078 1 41 SER QB 1 42 LYS H . . 3.540 2.769 2.222 3.536 . 0 0 "[ . 1 . 2]" 1
1079 1 41 SER QB 1 77 GLN HB3 . . 4.510 3.000 2.036 3.767 . 0 0 "[ . 1 . 2]" 1
1080 1 41 SER QB 1 79 GLY H . . 4.580 3.560 3.018 4.381 . 0 0 "[ . 1 . 2]" 1
1081 1 41 SER HB2 1 42 LYS H . . 4.100 3.128 2.242 4.015 . 0 0 "[ . 1 . 2]" 1
1082 1 41 SER HB3 1 42 LYS H . . 4.100 3.613 2.523 4.058 . 0 0 "[ . 1 . 2]" 1
1083 1 42 LYS H 1 42 LYS HB2 . . 3.370 2.482 2.338 2.722 . 0 0 "[ . 1 . 2]" 1
1084 1 42 LYS H 1 42 LYS HB3 . . 3.740 3.628 3.592 3.725 . 0 0 "[ . 1 . 2]" 1
1085 1 42 LYS H 1 42 LYS QD . . 4.930 4.080 3.322 4.572 . 0 0 "[ . 1 . 2]" 1
1086 1 42 LYS H 1 42 LYS HE2 . . 5.500 4.820 3.320 5.502 0.002 17 0 "[ . 1 . 2]" 1
1087 1 42 LYS H 1 42 LYS HE3 . . 5.500 4.694 3.646 5.452 . 0 0 "[ . 1 . 2]" 1
1088 1 42 LYS H 1 42 LYS HG2 . . 3.970 3.553 2.543 3.964 . 0 0 "[ . 1 . 2]" 1
1089 1 42 LYS H 1 42 LYS QG . . 3.260 2.443 1.885 2.800 . 0 0 "[ . 1 . 2]" 1
1090 1 42 LYS H 1 42 LYS HG3 . . 3.970 2.549 1.902 3.720 . 0 0 "[ . 1 . 2]" 1
1091 1 42 LYS H 1 77 GLN HB3 . . 4.630 4.325 3.894 4.614 . 0 0 "[ . 1 . 2]" 1
1092 1 42 LYS H 1 77 GLN QE . . 4.820 4.037 1.981 4.672 . 0 0 "[ . 1 . 2]" 1
1093 1 42 LYS H 1 77 GLN QG . . 4.260 3.584 3.109 4.043 . 0 0 "[ . 1 . 2]" 1
1094 1 42 LYS HA 1 42 LYS QD . . 4.960 3.894 2.218 4.147 . 0 0 "[ . 1 . 2]" 1
1095 1 42 LYS HA 1 42 LYS HG2 . . 4.020 2.607 2.346 2.886 . 0 0 "[ . 1 . 2]" 1
1096 1 42 LYS HA 1 42 LYS QG . . 3.510 2.463 2.298 2.799 . 0 0 "[ . 1 . 2]" 1
1097 1 42 LYS HA 1 42 LYS HG3 . . 4.020 3.125 2.707 3.766 . 0 0 "[ . 1 . 2]" 1
1098 1 42 LYS HA 1 43 ASP H . . 3.150 2.319 2.146 2.576 . 0 0 "[ . 1 . 2]" 1
1099 1 42 LYS HA 1 48 SER QB . . 4.770 3.939 3.128 4.740 . 0 0 "[ . 1 . 2]" 1
1100 1 42 LYS HA 1 49 TRP H . . 4.430 4.109 3.703 4.429 . 0 0 "[ . 1 . 2]" 1
1101 1 42 LYS HB2 1 43 ASP H . . 4.480 3.792 3.306 4.452 . 0 0 "[ . 1 . 2]" 1
1102 1 42 LYS HB2 1 46 GLY H . . 5.300 4.989 4.071 5.292 . 0 0 "[ . 1 . 2]" 1
1103 1 42 LYS HB2 1 46 GLY QA . . 4.440 3.564 2.780 4.254 . 0 0 "[ . 1 . 2]" 1
1104 1 42 LYS HB3 1 43 ASP H . . 4.350 2.723 2.083 3.645 . 0 0 "[ . 1 . 2]" 1
1105 1 42 LYS HB3 1 46 GLY H . . 4.220 3.751 3.401 4.041 . 0 0 "[ . 1 . 2]" 1
1106 1 42 LYS HB3 1 46 GLY QA . . 3.820 2.459 2.008 3.027 . 0 0 "[ . 1 . 2]" 1
1107 1 42 LYS HB3 1 47 LYS H . . 4.210 3.190 2.350 3.833 . 0 0 "[ . 1 . 2]" 1
1108 1 42 LYS HB3 1 48 SER H . . 5.280 4.822 3.949 5.280 . 0 0 "[ . 1 . 2]" 1
1109 1 42 LYS QD 1 43 ASP H . . 5.340 4.687 3.495 5.341 0.001 19 0 "[ . 1 . 2]" 1
1110 1 42 LYS QD 1 46 GLY QA . . 3.880 3.033 2.581 3.734 . 0 0 "[ . 1 . 2]" 1
1111 1 42 LYS QD 1 47 LYS H . . 5.340 4.578 3.155 5.325 . 0 0 "[ . 1 . 2]" 1
1112 1 42 LYS QE 1 42 LYS QG . . 3.100 2.219 2.016 2.497 . 0 0 "[ . 1 . 2]" 1
1113 1 42 LYS QE 1 46 GLY QA . . 4.790 4.211 2.050 4.791 0.001 17 0 "[ . 1 . 2]" 1
1114 1 42 LYS QG 1 43 ASP H . . 4.550 3.997 3.744 4.466 . 0 0 "[ . 1 . 2]" 1
1115 1 42 LYS QG 1 47 LYS H . . 5.120 4.485 3.906 5.071 . 0 0 "[ . 1 . 2]" 1
1116 1 42 LYS QG 1 47 LYS HA . . 4.730 3.634 2.984 4.414 . 0 0 "[ . 1 . 2]" 1
1117 1 42 LYS QG 1 48 SER HA . . 4.420 3.758 3.150 4.323 . 0 0 "[ . 1 . 2]" 1
1118 1 42 LYS HG2 1 43 ASP H . . 5.220 4.225 3.936 4.867 . 0 0 "[ . 1 . 2]" 1
1119 1 42 LYS HG3 1 43 ASP H . . 5.220 4.949 4.658 5.212 . 0 0 "[ . 1 . 2]" 1
1120 1 43 ASP H 1 43 ASP QB . . 3.580 2.411 2.151 2.725 . 0 0 "[ . 1 . 2]" 1
1121 1 43 ASP H 1 48 SER HA . . 4.630 3.639 3.117 4.318 . 0 0 "[ . 1 . 2]" 1
1122 1 43 ASP H 1 49 TRP H . . 5.500 4.767 3.707 5.452 . 0 0 "[ . 1 . 2]" 1
1123 1 43 ASP QB 1 44 THR H . . 2.940 2.217 1.912 2.743 . 0 0 "[ . 1 . 2]" 1
1124 1 43 ASP QB 1 44 THR HA . . 4.860 4.429 4.263 4.611 . 0 0 "[ . 1 . 2]" 1
1125 1 43 ASP QB 1 44 THR MG . . 4.490 3.483 2.703 4.280 . 0 0 "[ . 1 . 2]" 1
1126 1 43 ASP QB 1 45 GLU H . . 3.960 2.630 2.231 3.189 . 0 0 "[ . 1 . 2]" 1
1127 1 43 ASP HB2 1 44 THR H . . 3.670 3.165 1.952 3.683 0.013 6 0 "[ . 1 . 2]" 1
1128 1 43 ASP HB2 1 45 GLU H . . 4.630 3.375 2.592 4.467 . 0 0 "[ . 1 . 2]" 1
1129 1 43 ASP HB3 1 44 THR H . . 3.670 2.556 1.923 3.634 . 0 0 "[ . 1 . 2]" 1
1130 1 43 ASP HB3 1 45 GLU H . . 4.630 3.051 2.243 4.497 . 0 0 "[ . 1 . 2]" 1
1131 1 44 THR H 1 44 THR HB . . 3.800 3.151 2.320 3.618 . 0 0 "[ . 1 . 2]" 1
1132 1 44 THR H 1 44 THR MG . . 3.430 2.130 1.933 2.499 . 0 0 "[ . 1 . 2]" 1
1133 1 44 THR H 1 45 GLU H . . 3.430 2.705 2.608 2.792 . 0 0 "[ . 1 . 2]" 1
1134 1 44 THR H 1 45 GLU HB2 . . 4.890 4.737 4.500 4.894 0.004 17 0 "[ . 1 . 2]" 1
1135 1 44 THR HA 1 44 THR MG . . 3.310 2.742 2.293 3.207 . 0 0 "[ . 1 . 2]" 1
1136 1 44 THR HA 1 46 GLY H . . 4.230 4.016 3.850 4.231 0.001 20 0 "[ . 1 . 2]" 1
1137 1 44 THR HB 1 45 GLU H . . 4.510 3.986 3.589 4.441 . 0 0 "[ . 1 . 2]" 1
1138 1 44 THR MG 1 45 GLU H . . 4.430 3.263 2.093 4.078 . 0 0 "[ . 1 . 2]" 1
1139 1 44 THR MG 1 45 GLU HB2 . . 5.500 4.355 2.785 5.491 . 0 0 "[ . 1 . 2]" 1
1140 1 44 THR MG 1 46 GLY H . . 5.200 4.784 4.064 5.208 0.008 17 0 "[ . 1 . 2]" 1
1141 1 45 GLU H 1 45 GLU HB2 . . 3.200 2.390 2.235 2.694 . 0 0 "[ . 1 . 2]" 1
1142 1 45 GLU H 1 45 GLU HB3 . . 3.190 2.819 2.515 2.875 . 0 0 "[ . 1 . 2]" 1
1143 1 45 GLU H 1 45 GLU HG2 . . 5.060 4.621 4.247 4.791 . 0 0 "[ . 1 . 2]" 1
1144 1 45 GLU H 1 45 GLU QG . . 4.280 4.042 3.884 4.172 . 0 0 "[ . 1 . 2]" 1
1145 1 45 GLU H 1 45 GLU HG3 . . 5.060 4.477 4.188 4.625 . 0 0 "[ . 1 . 2]" 1
1146 1 45 GLU H 1 46 GLY H . . 3.040 2.352 2.028 2.554 . 0 0 "[ . 1 . 2]" 1
1147 1 45 GLU H 1 46 GLY QA . . 4.850 4.327 4.063 4.490 . 0 0 "[ . 1 . 2]" 1
1148 1 45 GLU HA 1 45 GLU HG2 . . 3.870 3.418 2.363 3.789 . 0 0 "[ . 1 . 2]" 1
1149 1 45 GLU HA 1 45 GLU QG . . 3.250 2.486 2.154 2.823 . 0 0 "[ . 1 . 2]" 1
1150 1 45 GLU HA 1 45 GLU HG3 . . 3.870 2.660 2.197 3.650 . 0 0 "[ . 1 . 2]" 1
1151 1 45 GLU HB2 1 46 GLY H . . 4.190 3.884 3.816 4.097 . 0 0 "[ . 1 . 2]" 1
1152 1 45 GLU HB2 1 47 LYS H . . 5.130 4.693 4.087 4.913 . 0 0 "[ . 1 . 2]" 1
1153 1 45 GLU HB2 1 47 LYS QG . . 5.500 4.108 3.491 5.289 . 0 0 "[ . 1 . 2]" 1
1154 1 45 GLU HB3 1 45 GLU QG . . 2.590 2.187 2.142 2.374 . 0 0 "[ . 1 . 2]" 1
1155 1 45 GLU HB3 1 46 GLY H . . 3.910 3.125 3.047 3.410 . 0 0 "[ . 1 . 2]" 1
1156 1 45 GLU HB3 1 47 LYS H . . 4.390 3.371 2.540 3.625 . 0 0 "[ . 1 . 2]" 1
1157 1 45 GLU HB3 1 47 LYS QE . . 4.820 3.408 2.097 4.783 . 0 0 "[ . 1 . 2]" 1
1158 1 45 GLU HB3 1 47 LYS QG . . 4.680 2.737 2.177 3.942 . 0 0 "[ . 1 . 2]" 1
1159 1 45 GLU QG 1 47 LYS H . . 5.340 4.888 3.993 5.221 . 0 0 "[ . 1 . 2]" 1
1160 1 45 GLU QG 1 47 LYS QE . . 5.180 3.601 2.420 5.091 . 0 0 "[ . 1 . 2]" 1
1161 1 45 GLU QG 1 47 LYS QG . . 4.540 3.699 3.005 4.088 . 0 0 "[ . 1 . 2]" 1
1162 1 46 GLY H 1 47 LYS H . . 3.170 2.172 2.072 2.324 . 0 0 "[ . 1 . 2]" 1
1163 1 46 GLY H 1 47 LYS HA . . 4.970 4.884 4.791 4.954 . 0 0 "[ . 1 . 2]" 1
1164 1 46 GLY H 1 47 LYS QG . . 5.470 3.917 3.539 4.979 . 0 0 "[ . 1 . 2]" 1
1165 1 47 LYS H 1 47 LYS HB2 . . 3.920 3.454 2.539 3.949 0.029 17 0 "[ . 1 . 2]" 1
1166 1 47 LYS H 1 47 LYS QB . . 3.060 2.885 2.492 3.057 . 0 0 "[ . 1 . 2]" 1
1167 1 47 LYS H 1 47 LYS HB3 . . 3.920 3.378 3.075 3.904 . 0 0 "[ . 1 . 2]" 1
1168 1 47 LYS H 1 47 LYS QE . . 4.580 4.382 3.545 4.573 . 0 0 "[ . 1 . 2]" 1
1169 1 47 LYS H 1 47 LYS QG . . 3.590 2.645 2.064 3.394 . 0 0 "[ . 1 . 2]" 1
1170 1 47 LYS H 1 48 SER H . . 4.580 4.384 4.269 4.598 0.018 18 0 "[ . 1 . 2]" 1
1171 1 47 LYS HA 1 47 LYS QD . . 4.470 3.772 2.016 4.390 . 0 0 "[ . 1 . 2]" 1
1172 1 47 LYS HA 1 48 SER H . . 2.910 2.245 2.145 2.422 . 0 0 "[ . 1 . 2]" 1
1173 1 47 LYS HA 1 48 SER QB . . 5.340 4.240 4.055 4.493 . 0 0 "[ . 1 . 2]" 1
1174 1 47 LYS HA 1 54 VAL MG2 . . 4.130 3.298 2.360 3.863 . 0 0 "[ . 1 . 2]" 1
1175 1 47 LYS QB 1 48 SER H . . 3.660 2.852 2.421 3.281 . 0 0 "[ . 1 . 2]" 1
1176 1 47 LYS QB 1 54 VAL MG1 . . 4.700 3.179 2.370 4.165 . 0 0 "[ . 1 . 2]" 1
1177 1 47 LYS QB 1 54 VAL MG2 . . 3.680 2.273 1.970 2.916 . 0 0 "[ . 1 . 2]" 1
1178 1 47 LYS HB2 1 48 SER H . . 4.370 3.285 2.566 4.359 . 0 0 "[ . 1 . 2]" 1
1179 1 47 LYS HB3 1 48 SER H . . 4.370 3.670 2.460 4.176 . 0 0 "[ . 1 . 2]" 1
1180 1 47 LYS QD 1 48 SER H . . 4.760 4.233 3.161 4.757 . 0 0 "[ . 1 . 2]" 1
1181 1 47 LYS QD 1 54 VAL MG1 . . 4.090 3.233 1.904 4.022 . 0 0 "[ . 1 . 2]" 1
1182 1 47 LYS QD 1 54 VAL MG2 . . 4.120 2.825 1.936 3.749 . 0 0 "[ . 1 . 2]" 1
1183 1 47 LYS QE 1 47 LYS QG . . 3.390 2.193 2.032 2.469 . 0 0 "[ . 1 . 2]" 1
1184 1 47 LYS QE 1 54 VAL MG1 . . 4.900 4.311 2.863 4.870 . 0 0 "[ . 1 . 2]" 1
1185 1 47 LYS QE 1 54 VAL MG2 . . 5.040 4.209 3.360 4.880 . 0 0 "[ . 1 . 2]" 1
1186 1 47 LYS QG 1 48 SER H . . 4.420 3.998 2.935 4.428 0.008 18 0 "[ . 1 . 2]" 1
1187 1 47 LYS QG 1 54 VAL MG2 . . 4.160 3.570 1.888 4.069 . 0 0 "[ . 1 . 2]" 1
1188 1 48 SER H 1 48 SER HB2 . . 3.580 2.620 2.238 3.597 0.017 20 0 "[ . 1 . 2]" 1
1189 1 48 SER H 1 48 SER QB . . 3.040 2.283 2.200 2.472 . 0 0 "[ . 1 . 2]" 1
1190 1 48 SER H 1 48 SER HB3 . . 3.580 3.004 2.245 3.590 0.010 8 0 "[ . 1 . 2]" 1
1191 1 48 SER H 1 49 TRP H . . 4.640 4.586 4.504 4.637 . 0 0 "[ . 1 . 2]" 1
1192 1 48 SER H 1 54 VAL MG2 . . 3.460 2.427 1.823 2.973 . 0 0 "[ . 1 . 2]" 1
1193 1 48 SER HA 1 49 TRP H . . 2.950 2.214 2.143 2.350 . 0 0 "[ . 1 . 2]" 1
1194 1 48 SER HA 1 50 CYS H . . 4.380 4.040 3.641 4.334 . 0 0 "[ . 1 . 2]" 1
1195 1 48 SER HA 1 54 VAL MG2 . . 4.790 4.276 3.947 4.525 . 0 0 "[ . 1 . 2]" 1
1196 1 48 SER QB 1 49 TRP HA . . 5.340 4.819 4.517 5.179 . 0 0 "[ . 1 . 2]" 1
1197 1 48 SER QB 1 50 CYS H . . 3.680 2.886 2.334 3.673 . 0 0 "[ . 1 . 2]" 1
1198 1 48 SER QB 1 53 CYS QB . . 3.720 2.426 1.918 3.243 . 0 0 "[ . 1 . 2]" 1
1199 1 48 SER QB 1 54 VAL H . . 4.650 3.812 3.234 4.380 . 0 0 "[ . 1 . 2]" 1
1200 1 48 SER QB 1 54 VAL MG2 . . 3.300 2.657 2.279 3.146 . 0 0 "[ . 1 . 2]" 1
1201 1 48 SER HB2 1 54 VAL MG2 . . 4.060 3.195 2.304 3.891 . 0 0 "[ . 1 . 2]" 1
1202 1 48 SER HB3 1 54 VAL MG2 . . 4.060 3.286 2.487 4.020 . 0 0 "[ . 1 . 2]" 1
1203 1 49 TRP H 1 49 TRP HB2 . . 3.650 3.571 3.515 3.614 . 0 0 "[ . 1 . 2]" 1
1204 1 49 TRP H 1 49 TRP QB . . 3.140 2.674 2.566 2.825 . 0 0 "[ . 1 . 2]" 1
1205 1 49 TRP H 1 49 TRP HB3 . . 3.650 2.765 2.628 2.977 . 0 0 "[ . 1 . 2]" 1
1206 1 49 TRP H 1 49 TRP HD1 . . 3.560 2.289 1.924 2.526 . 0 0 "[ . 1 . 2]" 1
1207 1 49 TRP H 1 49 TRP HE1 . . 4.830 4.044 3.812 4.316 . 0 0 "[ . 1 . 2]" 1
1208 1 49 TRP H 1 50 CYS H . . 3.440 2.807 2.526 2.986 . 0 0 "[ . 1 . 2]" 1
1209 1 49 TRP H 1 50 CYS QB . . 5.340 4.620 4.309 5.227 . 0 0 "[ . 1 . 2]" 1
1210 1 49 TRP H 1 54 VAL MG2 . . 5.500 4.984 4.644 5.439 . 0 0 "[ . 1 . 2]" 1
1211 1 49 TRP HA 1 49 TRP HD1 . . 4.800 4.199 4.075 4.400 . 0 0 "[ . 1 . 2]" 1
1212 1 49 TRP QB 1 49 TRP HD1 . . 3.420 2.626 2.569 2.712 . 0 0 "[ . 1 . 2]" 1
1213 1 49 TRP QB 1 50 CYS H . . 4.410 3.352 3.087 3.646 . 0 0 "[ . 1 . 2]" 1
1214 1 49 TRP QB 1 81 LYS HB2 . . 4.050 3.090 2.610 3.560 . 0 0 "[ . 1 . 2]" 1
1215 1 49 TRP QB 1 81 LYS QD . . 4.130 2.988 2.019 3.842 . 0 0 "[ . 1 . 2]" 1
1216 1 49 TRP HD1 1 80 ASP HA . . 4.150 3.973 3.566 4.148 . 0 0 "[ . 1 . 2]" 1
1217 1 49 TRP HD1 1 81 LYS H . . 4.600 4.018 3.733 4.313 . 0 0 "[ . 1 . 2]" 1
1218 1 49 TRP HD1 1 81 LYS HA . . 5.090 4.704 4.211 5.065 . 0 0 "[ . 1 . 2]" 1
1219 1 49 TRP HE1 1 78 VAL MG2 . . 4.620 3.805 3.452 4.075 . 0 0 "[ . 1 . 2]" 1
1220 1 49 TRP HE1 1 80 ASP HA . . 3.500 3.335 3.026 3.497 . 0 0 "[ . 1 . 2]" 1
1221 1 49 TRP HE1 1 81 LYS H . . 4.310 3.846 3.404 4.310 0.000 18 0 "[ . 1 . 2]" 1
1222 1 49 TRP HE1 1 81 LYS HA . . 4.540 3.518 3.103 3.996 . 0 0 "[ . 1 . 2]" 1
1223 1 49 TRP HE1 1 84 TRP HB2 . . 5.500 5.073 4.762 5.443 . 0 0 "[ . 1 . 2]" 1
1224 1 49 TRP HE3 1 50 CYS H . . 4.720 3.205 2.730 4.022 . 0 0 "[ . 1 . 2]" 1
1225 1 49 TRP HE3 1 50 CYS QB . . 4.760 2.995 2.438 4.210 . 0 0 "[ . 1 . 2]" 1
1226 1 49 TRP HE3 1 81 LYS HA . . 4.810 4.456 3.434 4.807 . 0 0 "[ . 1 . 2]" 1
1227 1 49 TRP HE3 1 81 LYS QD . . 4.110 3.066 2.025 3.888 . 0 0 "[ . 1 . 2]" 1
1228 1 49 TRP HH2 1 81 LYS HA . . 4.590 3.773 3.280 4.163 . 0 0 "[ . 1 . 2]" 1
1229 1 49 TRP HH2 1 84 TRP HB2 . . 4.920 4.064 3.081 4.734 . 0 0 "[ . 1 . 2]" 1
1230 1 49 TRP HH2 1 84 TRP HB3 . . 4.640 3.491 2.333 4.052 . 0 0 "[ . 1 . 2]" 1
1231 1 49 TRP HH2 1 84 TRP HD1 . . 3.680 2.582 2.111 3.302 . 0 0 "[ . 1 . 2]" 1
1232 1 49 TRP HH2 1 100 VAL MG2 . . 3.860 2.972 2.380 3.690 . 0 0 "[ . 1 . 2]" 1
1233 1 49 TRP HZ2 1 78 VAL MG2 . . 4.260 3.073 2.619 3.395 . 0 0 "[ . 1 . 2]" 1
1234 1 49 TRP HZ2 1 81 LYS HA . . 4.150 3.023 2.567 3.441 . 0 0 "[ . 1 . 2]" 1
1235 1 49 TRP HZ2 1 84 TRP H . . 5.180 4.483 3.945 4.934 . 0 0 "[ . 1 . 2]" 1
1236 1 49 TRP HZ2 1 84 TRP HB2 . . 3.860 3.048 2.574 3.526 . 0 0 "[ . 1 . 2]" 1
1237 1 49 TRP HZ2 1 84 TRP HB3 . . 4.000 3.289 2.681 3.565 . 0 0 "[ . 1 . 2]" 1
1238 1 49 TRP HZ2 1 84 TRP HD1 . . 4.220 4.027 3.641 4.216 . 0 0 "[ . 1 . 2]" 1
1239 1 49 TRP HZ2 1 100 VAL MG1 . . 5.420 4.904 4.530 5.216 . 0 0 "[ . 1 . 2]" 1
1240 1 49 TRP HZ2 1 100 VAL MG2 . . 4.130 3.379 2.994 3.714 . 0 0 "[ . 1 . 2]" 1
1241 1 49 TRP HZ3 1 50 CYS H . . 5.500 4.625 4.195 5.487 . 0 0 "[ . 1 . 2]" 1
1242 1 49 TRP HZ3 1 50 CYS QB . . 4.880 2.903 2.195 4.503 . 0 0 "[ . 1 . 2]" 1
1243 1 49 TRP HZ3 1 81 LYS HA . . 4.790 4.411 3.392 4.791 0.001 9 0 "[ . 1 . 2]" 1
1244 1 49 TRP HZ3 1 81 LYS QD . . 4.610 4.148 3.110 4.603 . 0 0 "[ . 1 . 2]" 1
1245 1 50 CYS H 1 50 CYS HB2 . . 3.530 2.573 2.183 3.581 0.051 5 0 "[ . 1 . 2]" 1
1246 1 50 CYS H 1 50 CYS HB3 . . 3.530 2.688 2.349 3.508 . 0 0 "[ . 1 . 2]" 1
1247 1 50 CYS H 1 51 PRO QD . . 4.740 4.313 4.257 4.344 . 0 0 "[ . 1 . 2]" 1
1248 1 50 CYS H 1 53 CYS QB . . 4.350 3.884 3.630 4.181 . 0 0 "[ . 1 . 2]" 1
1249 1 50 CYS QB 1 53 CYS QB . . 3.600 2.536 1.998 3.501 . 0 0 "[ . 1 . 2]" 1
1250 1 50 CYS HB2 1 53 CYS H . . 4.830 4.279 3.164 4.679 . 0 0 "[ . 1 . 2]" 1
1251 1 50 CYS HB2 1 100 VAL MG2 . . 4.760 4.335 4.015 4.760 . 0 0 "[ . 1 . 2]" 1
1252 1 50 CYS HB3 1 53 CYS H . . 4.830 3.001 2.457 4.715 . 0 0 "[ . 1 . 2]" 1
1253 1 50 CYS HB3 1 100 VAL MG2 . . 4.760 4.596 4.302 4.763 0.003 18 0 "[ . 1 . 2]" 1
1254 1 51 PRO HA 1 54 VAL H . . 4.080 3.701 3.149 3.993 . 0 0 "[ . 1 . 2]" 1
1255 1 51 PRO HA 1 54 VAL HB . . 3.710 3.079 2.724 3.443 . 0 0 "[ . 1 . 2]" 1
1256 1 51 PRO HA 1 54 VAL MG1 . . 4.600 4.350 4.133 4.602 0.002 8 0 "[ . 1 . 2]" 1
1257 1 51 PRO HA 1 54 VAL MG2 . . 3.420 3.068 2.756 3.276 . 0 0 "[ . 1 . 2]" 1
1258 1 51 PRO QB 1 52 ASP H . . 4.050 3.020 2.796 3.527 . 0 0 "[ . 1 . 2]" 1
1259 1 51 PRO QB 1 52 ASP HA . . 4.960 3.916 3.828 4.124 . 0 0 "[ . 1 . 2]" 1
1260 1 51 PRO QB 1 54 VAL MG2 . . 4.700 4.574 4.365 4.703 0.003 5 0 "[ . 1 . 2]" 1
1261 1 51 PRO HB2 1 54 VAL MG2 . . 5.460 5.330 5.062 5.461 0.001 3 0 "[ . 1 . 2]" 1
1262 1 51 PRO HB3 1 54 VAL MG2 . . 5.460 4.981 4.734 5.148 . 0 0 "[ . 1 . 2]" 1
1263 1 51 PRO HD2 1 52 ASP H . . 4.420 2.713 2.648 2.781 . 0 0 "[ . 1 . 2]" 1
1264 1 51 PRO HD3 1 52 ASP H . . 4.420 3.861 3.834 3.913 . 0 0 "[ . 1 . 2]" 1
1265 1 51 PRO QG 1 52 ASP H . . 4.180 2.147 1.888 2.877 . 0 0 "[ . 1 . 2]" 1
1266 1 51 PRO HG2 1 52 ASP H . . 4.950 2.162 1.896 2.923 . 0 0 "[ . 1 . 2]" 1
1267 1 51 PRO HG3 1 52 ASP H . . 4.950 3.726 3.525 4.295 . 0 0 "[ . 1 . 2]" 1
1268 1 52 ASP H 1 52 ASP QB . . 3.670 2.355 2.128 2.704 . 0 0 "[ . 1 . 2]" 1
1269 1 52 ASP H 1 53 CYS H . . 3.840 2.834 2.415 3.141 . 0 0 "[ . 1 . 2]" 1
1270 1 52 ASP HA 1 55 GLU H . . 4.370 3.342 3.103 3.535 . 0 0 "[ . 1 . 2]" 1
1271 1 52 ASP HA 1 55 GLU HA . . 5.490 5.408 5.251 5.584 0.094 18 0 "[ . 1 . 2]" 1
1272 1 52 ASP HA 1 55 GLU HB2 . . 4.420 3.732 3.296 4.433 0.013 18 0 "[ . 1 . 2]" 1
1273 1 52 ASP HA 1 55 GLU QB . . 3.720 2.794 2.346 3.858 0.138 19 0 "[ . 1 . 2]" 1
1274 1 52 ASP HA 1 55 GLU HB3 . . 4.420 2.909 2.369 4.245 . 0 0 "[ . 1 . 2]" 1
1275 1 52 ASP HA 1 56 ALA H . . 5.290 4.275 3.879 4.502 . 0 0 "[ . 1 . 2]" 1
1276 1 52 ASP QB 1 53 CYS H . . 3.810 2.425 2.078 3.358 . 0 0 "[ . 1 . 2]" 1
1277 1 52 ASP QB 1 53 CYS HA . . 5.080 3.809 3.732 4.094 . 0 0 "[ . 1 . 2]" 1
1278 1 52 ASP QB 1 56 ALA MB . . 4.200 3.688 3.304 4.147 . 0 0 "[ . 1 . 2]" 1
1279 1 52 ASP QB 1 101 PRO HD2 . . 3.670 3.230 2.647 3.488 . 0 0 "[ . 1 . 2]" 1
1280 1 52 ASP QB 1 101 PRO HD3 . . 3.760 3.236 2.321 3.740 . 0 0 "[ . 1 . 2]" 1
1281 1 52 ASP QB 1 101 PRO HG3 . . 4.910 3.813 3.181 4.222 . 0 0 "[ . 1 . 2]" 1
1282 1 52 ASP HB2 1 53 CYS H . . 4.580 2.679 2.214 3.547 . 0 0 "[ . 1 . 2]" 1
1283 1 52 ASP HB2 1 101 PRO HD2 . . 4.220 3.816 2.692 4.199 . 0 0 "[ . 1 . 2]" 1
1284 1 52 ASP HB2 1 101 PRO HD3 . . 4.570 3.700 3.054 4.263 . 0 0 "[ . 1 . 2]" 1
1285 1 52 ASP HB3 1 53 CYS H . . 4.580 3.190 2.099 4.149 . 0 0 "[ . 1 . 2]" 1
1286 1 52 ASP HB3 1 101 PRO HD2 . . 4.220 3.619 2.687 4.214 . 0 0 "[ . 1 . 2]" 1
1287 1 52 ASP HB3 1 101 PRO HD3 . . 4.570 3.855 2.337 4.522 . 0 0 "[ . 1 . 2]" 1
1288 1 53 CYS H 1 53 CYS HB2 . . 4.020 2.529 2.227 2.801 . 0 0 "[ . 1 . 2]" 1
1289 1 53 CYS H 1 53 CYS QB . . 3.520 2.323 2.158 2.628 . 0 0 "[ . 1 . 2]" 1
1290 1 53 CYS H 1 53 CYS HB3 . . 4.020 3.052 2.299 3.625 . 0 0 "[ . 1 . 2]" 1
1291 1 53 CYS H 1 54 VAL H . . 3.360 2.853 2.391 3.161 . 0 0 "[ . 1 . 2]" 1
1292 1 53 CYS H 1 54 VAL HB . . 5.500 5.055 4.504 5.285 . 0 0 "[ . 1 . 2]" 1
1293 1 53 CYS H 1 54 VAL MG2 . . 4.510 4.356 4.113 4.522 0.012 14 0 "[ . 1 . 2]" 1
1294 1 53 CYS H 1 101 PRO HG3 . . 5.500 3.976 3.425 4.836 . 0 0 "[ . 1 . 2]" 1
1295 1 53 CYS HA 1 56 ALA H . . 4.370 3.308 3.112 3.748 . 0 0 "[ . 1 . 2]" 1
1296 1 53 CYS HA 1 56 ALA MB . . 3.510 2.523 2.136 3.103 . 0 0 "[ . 1 . 2]" 1
1297 1 53 CYS HA 1 101 PRO QB . . 4.010 3.389 3.007 3.631 . 0 0 "[ . 1 . 2]" 1
1298 1 53 CYS HA 1 101 PRO HD3 . . 4.690 3.349 2.991 3.753 . 0 0 "[ . 1 . 2]" 1
1299 1 53 CYS HA 1 101 PRO HG2 . . 4.810 3.983 3.654 4.334 . 0 0 "[ . 1 . 2]" 1
1300 1 53 CYS HA 1 101 PRO HG3 . . 4.210 2.257 2.003 2.586 . 0 0 "[ . 1 . 2]" 1
1301 1 53 CYS QB 1 54 VAL H . . 3.670 2.588 2.128 3.032 . 0 0 "[ . 1 . 2]" 1
1302 1 53 CYS QB 1 54 VAL MG2 . . 4.470 3.158 2.980 3.428 . 0 0 "[ . 1 . 2]" 1
1303 1 53 CYS QB 1 56 ALA MB . . 4.870 4.253 3.948 4.801 . 0 0 "[ . 1 . 2]" 1
1304 1 53 CYS QB 1 101 PRO QB . . 4.950 3.451 2.732 4.109 . 0 0 "[ . 1 . 2]" 1
1305 1 53 CYS HB2 1 54 VAL H . . 4.430 3.300 2.617 3.973 . 0 0 "[ . 1 . 2]" 1
1306 1 53 CYS HB2 1 54 VAL HA . . 5.500 4.993 4.203 5.562 0.062 8 0 "[ . 1 . 2]" 1
1307 1 53 CYS HB3 1 54 VAL H . . 4.430 3.098 2.144 3.906 . 0 0 "[ . 1 . 2]" 1
1308 1 53 CYS HB3 1 54 VAL HA . . 5.500 4.385 4.012 4.635 . 0 0 "[ . 1 . 2]" 1
1309 1 54 VAL H 1 54 VAL HB . . 3.280 2.517 2.373 2.629 . 0 0 "[ . 1 . 2]" 1
1310 1 54 VAL H 1 54 VAL MG1 . . 4.040 3.762 3.728 3.796 . 0 0 "[ . 1 . 2]" 1
1311 1 54 VAL H 1 54 VAL MG2 . . 3.120 2.237 1.900 2.598 . 0 0 "[ . 1 . 2]" 1
1312 1 54 VAL H 1 55 GLU H . . 3.580 2.583 2.352 2.831 . 0 0 "[ . 1 . 2]" 1
1313 1 54 VAL H 1 55 GLU QB . . 5.230 4.453 4.204 4.830 . 0 0 "[ . 1 . 2]" 1
1314 1 54 VAL HA 1 54 VAL MG1 . . 3.140 2.395 2.253 2.466 . 0 0 "[ . 1 . 2]" 1
1315 1 54 VAL HA 1 54 VAL MG2 . . 2.950 2.350 2.161 2.445 . 0 0 "[ . 1 . 2]" 1
1316 1 54 VAL HA 1 55 GLU HA . . 4.740 4.643 4.609 4.706 . 0 0 "[ . 1 . 2]" 1
1317 1 54 VAL HA 1 56 ALA H . . 4.680 4.081 3.725 4.674 . 0 0 "[ . 1 . 2]" 1
1318 1 54 VAL HA 1 57 GLU QB . . 4.080 2.882 2.641 3.070 . 0 0 "[ . 1 . 2]" 1
1319 1 54 VAL HB 1 55 GLU H . . 3.700 2.922 2.502 3.262 . 0 0 "[ . 1 . 2]" 1
1320 1 54 VAL HB 1 56 ALA H . . 5.500 4.936 4.566 5.473 . 0 0 "[ . 1 . 2]" 1
1321 1 54 VAL MG1 1 55 GLU H . . 4.140 3.640 3.460 3.838 . 0 0 "[ . 1 . 2]" 1
1322 1 54 VAL MG1 1 55 GLU HA . . 4.270 3.561 3.350 3.825 . 0 0 "[ . 1 . 2]" 1
1323 1 54 VAL MG1 1 55 GLU HB2 . . 5.260 4.338 4.094 5.253 . 0 0 "[ . 1 . 2]" 1
1324 1 54 VAL MG1 1 55 GLU QB . . 4.380 4.053 3.942 4.220 . 0 0 "[ . 1 . 2]" 1
1325 1 54 VAL MG1 1 55 GLU HB3 . . 5.260 5.116 4.074 5.265 0.005 7 0 "[ . 1 . 2]" 1
1326 1 54 VAL MG2 1 55 GLU H . . 4.820 3.956 3.748 4.150 . 0 0 "[ . 1 . 2]" 1
1327 1 55 GLU H 1 55 GLU HB2 . . 3.650 2.763 2.497 3.632 . 0 0 "[ . 1 . 2]" 1
1328 1 55 GLU H 1 55 GLU QB . . 3.190 2.371 2.270 2.852 . 0 0 "[ . 1 . 2]" 1
1329 1 55 GLU H 1 55 GLU HB3 . . 3.650 2.612 2.359 2.986 . 0 0 "[ . 1 . 2]" 1
1330 1 55 GLU H 1 55 GLU QG . . 4.330 3.804 1.843 4.112 . 0 0 "[ . 1 . 2]" 1
1331 1 55 GLU H 1 56 ALA H . . 3.420 2.281 2.159 2.533 . 0 0 "[ . 1 . 2]" 1
1332 1 55 GLU HA 1 55 GLU HG2 . . 4.080 3.417 3.020 3.863 . 0 0 "[ . 1 . 2]" 1
1333 1 55 GLU HA 1 55 GLU QG . . 3.440 2.596 2.250 3.327 . 0 0 "[ . 1 . 2]" 1
1334 1 55 GLU HA 1 55 GLU HG3 . . 4.080 2.716 2.302 3.788 . 0 0 "[ . 1 . 2]" 1
1335 1 55 GLU HA 1 56 ALA MB . . 5.500 4.920 4.857 5.007 . 0 0 "[ . 1 . 2]" 1
1336 1 55 GLU QB 1 56 ALA H . . 3.800 3.137 2.581 3.734 . 0 0 "[ . 1 . 2]" 1
1337 1 55 GLU QB 1 56 ALA HA . . 5.320 4.275 4.047 4.507 . 0 0 "[ . 1 . 2]" 1
1338 1 55 GLU HB2 1 56 ALA H . . 4.340 4.103 3.819 4.296 . 0 0 "[ . 1 . 2]" 1
1339 1 55 GLU HB3 1 56 ALA H . . 4.340 3.295 2.616 4.335 . 0 0 "[ . 1 . 2]" 1
1340 1 55 GLU QG 1 56 ALA HA . . 4.340 4.023 3.459 4.332 . 0 0 "[ . 1 . 2]" 1
1341 1 56 ALA H 1 56 ALA MB . . 3.070 2.223 2.043 2.376 . 0 0 "[ . 1 . 2]" 1
1342 1 56 ALA H 1 57 GLU H . . 3.420 2.220 2.057 2.525 . 0 0 "[ . 1 . 2]" 1
1343 1 56 ALA H 1 59 VAL MG2 . . 4.990 4.153 3.917 4.431 . 0 0 "[ . 1 . 2]" 1
1344 1 56 ALA H 1 101 PRO HG3 . . 5.500 4.761 4.211 5.040 . 0 0 "[ . 1 . 2]" 1
1345 1 56 ALA HA 1 58 PRO QG . . 5.350 4.114 3.915 4.307 . 0 0 "[ . 1 . 2]" 1
1346 1 56 ALA HA 1 59 VAL H . . 4.120 3.172 3.076 3.257 . 0 0 "[ . 1 . 2]" 1
1347 1 56 ALA HA 1 59 VAL HB . . 3.800 2.416 2.162 2.616 . 0 0 "[ . 1 . 2]" 1
1348 1 56 ALA HA 1 59 VAL MG1 . . 4.450 3.751 3.582 3.840 . 0 0 "[ . 1 . 2]" 1
1349 1 56 ALA HA 1 59 VAL MG2 . . 3.490 2.166 2.012 2.395 . 0 0 "[ . 1 . 2]" 1
1350 1 56 ALA HA 1 60 ILE H . . 4.790 4.179 4.039 4.395 . 0 0 "[ . 1 . 2]" 1
1351 1 56 ALA HA 1 118 CYS HA . . 3.670 2.445 2.119 2.688 . 0 0 "[ . 1 . 2]" 1
1352 1 56 ALA HA 1 118 CYS HB2 . . 4.280 3.565 3.152 3.850 . 0 0 "[ . 1 . 2]" 1
1353 1 56 ALA HA 1 118 CYS HB3 . . 5.450 4.960 4.562 5.251 . 0 0 "[ . 1 . 2]" 1
1354 1 56 ALA MB 1 57 GLU H . . 3.520 2.833 2.652 3.110 . 0 0 "[ . 1 . 2]" 1
1355 1 56 ALA MB 1 57 GLU HA . . 4.220 3.805 3.703 3.921 . 0 0 "[ . 1 . 2]" 1
1356 1 56 ALA MB 1 58 PRO QD . . 4.620 3.928 3.801 4.172 . 0 0 "[ . 1 . 2]" 1
1357 1 56 ALA MB 1 59 VAL H . . 4.960 4.209 4.129 4.383 . 0 0 "[ . 1 . 2]" 1
1358 1 56 ALA MB 1 59 VAL HB . . 4.480 3.417 3.233 3.534 . 0 0 "[ . 1 . 2]" 1
1359 1 56 ALA MB 1 59 VAL MG1 . . 5.140 4.224 3.890 4.378 . 0 0 "[ . 1 . 2]" 1
1360 1 56 ALA MB 1 60 ILE MD . . 3.430 2.747 2.377 3.003 . 0 0 "[ . 1 . 2]" 1
1361 1 56 ALA MB 1 101 PRO HB2 . . 4.510 4.004 3.812 4.136 . 0 0 "[ . 1 . 2]" 1
1362 1 56 ALA MB 1 101 PRO QB . . 3.760 3.655 3.488 3.760 0.000 15 0 "[ . 1 . 2]" 1
1363 1 56 ALA MB 1 101 PRO HB3 . . 4.510 4.222 4.040 4.363 . 0 0 "[ . 1 . 2]" 1
1364 1 56 ALA MB 1 101 PRO HD2 . . 5.180 4.423 4.300 4.710 . 0 0 "[ . 1 . 2]" 1
1365 1 56 ALA MB 1 101 PRO HD3 . . 4.770 4.423 4.282 4.679 . 0 0 "[ . 1 . 2]" 1
1366 1 56 ALA MB 1 101 PRO HG2 . . 3.810 3.310 3.120 3.525 . 0 0 "[ . 1 . 2]" 1
1367 1 56 ALA MB 1 101 PRO HG3 . . 3.810 2.720 2.587 2.954 . 0 0 "[ . 1 . 2]" 1
1368 1 56 ALA MB 1 117 CYS H . . 4.470 4.284 3.888 4.459 . 0 0 "[ . 1 . 2]" 1
1369 1 56 ALA MB 1 117 CYS HA . . 4.770 3.728 3.534 3.911 . 0 0 "[ . 1 . 2]" 1
1370 1 56 ALA MB 1 117 CYS QB . . 3.140 2.073 1.924 2.267 . 0 0 "[ . 1 . 2]" 1
1371 1 56 ALA MB 1 118 CYS H . . 4.710 3.598 3.059 3.925 . 0 0 "[ . 1 . 2]" 1
1372 1 56 ALA MB 1 118 CYS HA . . 4.430 2.761 2.284 3.146 . 0 0 "[ . 1 . 2]" 1
1373 1 56 ALA MB 1 118 CYS HB2 . . 4.930 2.812 2.296 3.096 . 0 0 "[ . 1 . 2]" 1
1374 1 57 GLU H 1 57 GLU HB2 . . 3.250 2.319 2.121 2.887 . 0 0 "[ . 1 . 2]" 1
1375 1 57 GLU H 1 57 GLU HB3 . . 3.250 2.879 2.237 3.477 0.227 3 0 "[ . 1 . 2]" 1
1376 1 57 GLU H 1 58 PRO HD2 . . 3.640 2.180 2.054 2.319 . 0 0 "[ . 1 . 2]" 1
1377 1 57 GLU H 1 58 PRO QD . . 3.160 2.142 2.021 2.278 . 0 0 "[ . 1 . 2]" 1
1378 1 57 GLU H 1 58 PRO HD3 . . 3.640 3.141 3.005 3.328 . 0 0 "[ . 1 . 2]" 1
1379 1 57 GLU H 1 58 PRO HG2 . . 4.980 4.430 4.314 4.545 . 0 0 "[ . 1 . 2]" 1
1380 1 57 GLU H 1 58 PRO QG . . 4.170 4.075 3.963 4.198 0.028 14 0 "[ . 1 . 2]" 1
1381 1 57 GLU H 1 58 PRO HG3 . . 4.980 4.759 4.618 4.934 . 0 0 "[ . 1 . 2]" 1
1382 1 57 GLU H 1 59 VAL H . . 4.940 3.935 3.787 4.304 . 0 0 "[ . 1 . 2]" 1
1383 1 57 GLU H 1 59 VAL MG2 . . 5.000 4.434 4.159 4.753 . 0 0 "[ . 1 . 2]" 1
1384 1 57 GLU HA 1 60 ILE H . . 4.150 3.656 3.552 3.918 . 0 0 "[ . 1 . 2]" 1
1385 1 57 GLU HA 1 60 ILE HB . . 3.550 3.331 3.204 3.446 . 0 0 "[ . 1 . 2]" 1
1386 1 57 GLU HA 1 60 ILE MD . . 4.210 3.852 3.592 4.108 . 0 0 "[ . 1 . 2]" 1
1387 1 57 GLU HA 1 60 ILE HG12 . . 5.500 5.460 5.245 5.534 0.034 3 0 "[ . 1 . 2]" 1
1388 1 57 GLU HA 1 60 ILE HG13 . . 4.680 3.871 3.641 3.976 . 0 0 "[ . 1 . 2]" 1
1389 1 57 GLU HA 1 60 ILE MG . . 4.730 4.659 4.552 4.745 0.015 1 0 "[ . 1 . 2]" 1
1390 1 57 GLU HA 1 61 ARG H . . 4.360 4.018 3.802 4.364 0.004 17 0 "[ . 1 . 2]" 1
1391 1 57 GLU QB 1 58 PRO QD . . 2.910 1.867 1.857 1.906 . 0 0 "[ . 1 . 2]" 1
1392 1 57 GLU QB 1 61 ARG H . . 5.340 5.152 4.975 5.355 0.015 1 0 "[ . 1 . 2]" 1
1393 1 57 GLU QB 1 75 TYR QE . . 4.330 3.900 3.314 4.226 . 0 0 "[ . 1 . 2]" 1
1394 1 57 GLU HB2 1 75 TYR QE . . 5.100 4.155 3.362 5.101 0.001 3 0 "[ . 1 . 2]" 1
1395 1 57 GLU HB3 1 75 TYR QE . . 5.100 4.951 4.295 5.109 0.009 15 0 "[ . 1 . 2]" 1
1396 1 58 PRO HA 1 61 ARG H . . 4.080 3.715 3.223 3.945 . 0 0 "[ . 1 . 2]" 1
1397 1 58 PRO HA 1 61 ARG HB2 . . 4.530 3.246 2.260 3.827 . 0 0 "[ . 1 . 2]" 1
1398 1 58 PRO HA 1 61 ARG QB . . 3.690 2.906 2.242 3.194 . 0 0 "[ . 1 . 2]" 1
1399 1 58 PRO HA 1 61 ARG HB3 . . 4.530 3.750 3.116 4.549 0.019 15 0 "[ . 1 . 2]" 1
1400 1 58 PRO HA 1 61 ARG QD . . 5.290 4.536 4.078 5.317 0.027 1 0 "[ . 1 . 2]" 1
1401 1 58 PRO HA 1 62 GLU H . . 4.530 3.919 3.584 4.224 . 0 0 "[ . 1 . 2]" 1
1402 1 58 PRO HB2 1 59 VAL H . . 3.980 3.613 3.083 3.782 . 0 0 "[ . 1 . 2]" 1
1403 1 58 PRO HB2 1 59 VAL HA . . 4.870 4.216 3.988 4.286 . 0 0 "[ . 1 . 2]" 1
1404 1 58 PRO HB2 1 59 VAL MG2 . . 4.050 3.574 3.471 3.797 . 0 0 "[ . 1 . 2]" 1
1405 1 58 PRO HB3 1 59 VAL H . . 4.360 4.303 3.995 4.400 0.040 3 0 "[ . 1 . 2]" 1
1406 1 58 PRO QD 1 59 VAL H . . 3.670 2.690 2.604 2.767 . 0 0 "[ . 1 . 2]" 1
1407 1 58 PRO QD 1 59 VAL MG2 . . 4.360 3.224 2.949 3.493 . 0 0 "[ . 1 . 2]" 1
1408 1 58 PRO HD2 1 59 VAL H . . 4.470 2.743 2.649 2.827 . 0 0 "[ . 1 . 2]" 1
1409 1 58 PRO HD2 1 59 VAL MG2 . . 4.970 3.297 3.000 3.576 . 0 0 "[ . 1 . 2]" 1
1410 1 58 PRO HD3 1 59 VAL H . . 4.470 3.892 3.836 3.938 . 0 0 "[ . 1 . 2]" 1
1411 1 58 PRO HD3 1 59 VAL MG2 . . 4.970 4.563 4.351 4.894 . 0 0 "[ . 1 . 2]" 1
1412 1 58 PRO QG 1 59 VAL H . . 3.560 2.728 2.075 2.967 . 0 0 "[ . 1 . 2]" 1
1413 1 58 PRO QG 1 59 VAL MG2 . . 3.520 2.358 2.255 2.800 . 0 0 "[ . 1 . 2]" 1
1414 1 58 PRO HG2 1 59 VAL H . . 4.390 2.766 2.086 3.018 . 0 0 "[ . 1 . 2]" 1
1415 1 58 PRO HG2 1 59 VAL MG2 . . 4.390 2.376 2.270 2.836 . 0 0 "[ . 1 . 2]" 1
1416 1 58 PRO HG3 1 59 VAL H . . 4.390 4.178 3.670 4.367 . 0 0 "[ . 1 . 2]" 1
1417 1 58 PRO HG3 1 59 VAL MG2 . . 4.390 3.962 3.872 4.325 . 0 0 "[ . 1 . 2]" 1
1418 1 59 VAL H 1 59 VAL HB . . 3.170 2.621 2.450 2.728 . 0 0 "[ . 1 . 2]" 1
1419 1 59 VAL H 1 59 VAL MG1 . . 3.970 3.797 3.761 3.822 . 0 0 "[ . 1 . 2]" 1
1420 1 59 VAL H 1 59 VAL MG2 . . 3.010 2.129 1.874 2.648 . 0 0 "[ . 1 . 2]" 1
1421 1 59 VAL H 1 60 ILE H . . 3.140 2.317 2.197 2.687 . 0 0 "[ . 1 . 2]" 1
1422 1 59 VAL H 1 60 ILE HB . . 5.060 4.593 4.410 5.060 . 0 0 "[ . 1 . 2]" 1
1423 1 59 VAL H 1 60 ILE MD . . 5.500 5.262 5.101 5.504 0.004 18 0 "[ . 1 . 2]" 1
1424 1 59 VAL H 1 60 ILE HG13 . . 5.290 4.004 3.825 4.237 . 0 0 "[ . 1 . 2]" 1
1425 1 59 VAL H 1 61 ARG H . . 4.690 3.934 3.760 4.293 . 0 0 "[ . 1 . 2]" 1
1426 1 59 VAL H 1 62 GLU H . . 5.500 4.670 4.460 4.838 . 0 0 "[ . 1 . 2]" 1
1427 1 59 VAL HA 1 59 VAL MG1 . . 3.160 2.256 2.120 2.374 . 0 0 "[ . 1 . 2]" 1
1428 1 59 VAL HA 1 59 VAL MG2 . . 2.990 2.500 2.223 2.582 . 0 0 "[ . 1 . 2]" 1
1429 1 59 VAL HA 1 62 GLU H . . 4.220 3.936 3.554 4.163 . 0 0 "[ . 1 . 2]" 1
1430 1 59 VAL HA 1 62 GLU HB2 . . 3.600 3.104 2.530 3.313 . 0 0 "[ . 1 . 2]" 1
1431 1 59 VAL HA 1 62 GLU QG . . 4.760 3.671 2.985 4.275 . 0 0 "[ . 1 . 2]" 1
1432 1 59 VAL HA 1 63 GLY H . . 5.030 4.487 4.155 4.816 . 0 0 "[ . 1 . 2]" 1
1433 1 59 VAL HB 1 60 ILE H . . 3.450 2.921 2.734 3.076 . 0 0 "[ . 1 . 2]" 1
1434 1 59 VAL HB 1 60 ILE MD . . 5.500 4.596 4.480 4.807 . 0 0 "[ . 1 . 2]" 1
1435 1 59 VAL HB 1 60 ILE HG13 . . 4.840 3.221 3.107 3.410 . 0 0 "[ . 1 . 2]" 1
1436 1 59 VAL HB 1 118 CYS HA . . 4.050 2.712 2.469 2.935 . 0 0 "[ . 1 . 2]" 1
1437 1 59 VAL HB 1 123 VAL HB . . 5.500 5.490 5.401 5.519 0.019 1 0 "[ . 1 . 2]" 1
1438 1 59 VAL HB 1 123 VAL MG2 . . 4.390 3.341 3.164 3.460 . 0 0 "[ . 1 . 2]" 1
1439 1 59 VAL MG1 1 60 ILE H . . 4.090 3.842 3.539 3.997 . 0 0 "[ . 1 . 2]" 1
1440 1 59 VAL MG1 1 60 ILE HA . . 4.220 3.869 3.561 4.108 . 0 0 "[ . 1 . 2]" 1
1441 1 59 VAL MG1 1 60 ILE HG13 . . 5.340 4.130 3.783 4.402 . 0 0 "[ . 1 . 2]" 1
1442 1 59 VAL MG1 1 62 GLU HB2 . . 4.780 4.283 3.724 4.583 . 0 0 "[ . 1 . 2]" 1
1443 1 59 VAL MG1 1 118 CYS H . . 4.660 4.306 4.193 4.533 . 0 0 "[ . 1 . 2]" 1
1444 1 59 VAL MG1 1 118 CYS HA . . 3.540 2.717 2.462 2.980 . 0 0 "[ . 1 . 2]" 1
1445 1 59 VAL MG1 1 118 CYS HB3 . . 4.990 4.754 4.598 4.930 . 0 0 "[ . 1 . 2]" 1
1446 1 59 VAL MG1 1 119 GLN H . . 3.980 3.414 3.203 3.599 . 0 0 "[ . 1 . 2]" 1
1447 1 59 VAL MG1 1 119 GLN HA . . 4.560 3.358 3.096 3.539 . 0 0 "[ . 1 . 2]" 1
1448 1 59 VAL MG1 1 119 GLN HB2 . . 4.970 4.774 4.557 4.963 . 0 0 "[ . 1 . 2]" 1
1449 1 59 VAL MG1 1 120 SER H . . 3.910 2.324 2.053 2.717 . 0 0 "[ . 1 . 2]" 1
1450 1 59 VAL MG1 1 120 SER HB2 . . 3.730 3.456 2.263 3.732 0.002 11 0 "[ . 1 . 2]" 1
1451 1 59 VAL MG1 1 120 SER QB . . 3.080 2.225 1.998 2.406 . 0 0 "[ . 1 . 2]" 1
1452 1 59 VAL MG1 1 120 SER HB3 . . 3.730 2.386 2.010 3.710 . 0 0 "[ . 1 . 2]" 1
1453 1 59 VAL MG1 1 123 VAL H . . 4.290 4.101 3.858 4.289 . 0 0 "[ . 1 . 2]" 1
1454 1 59 VAL MG1 1 123 VAL HB . . 3.600 3.325 3.085 3.541 . 0 0 "[ . 1 . 2]" 1
1455 1 59 VAL MG1 1 123 VAL MG2 . . 2.890 2.066 1.910 2.281 . 0 0 "[ . 1 . 2]" 1
1456 1 59 VAL MG2 1 60 ILE H . . 4.270 3.792 3.596 3.963 . 0 0 "[ . 1 . 2]" 1
1457 1 59 VAL MG2 1 118 CYS H . . 5.500 4.957 4.778 5.153 . 0 0 "[ . 1 . 2]" 1
1458 1 59 VAL MG2 1 118 CYS HA . . 3.560 2.358 2.103 2.746 . 0 0 "[ . 1 . 2]" 1
1459 1 59 VAL MG2 1 118 CYS HB2 . . 4.100 3.864 3.613 4.079 . 0 0 "[ . 1 . 2]" 1
1460 1 59 VAL MG2 1 118 CYS HB3 . . 4.980 4.611 4.432 4.835 . 0 0 "[ . 1 . 2]" 1
1461 1 59 VAL MG2 1 120 SER H . . 4.710 4.030 3.442 4.637 . 0 0 "[ . 1 . 2]" 1
1462 1 59 VAL MG2 1 120 SER QB . . 4.520 4.006 3.664 4.383 . 0 0 "[ . 1 . 2]" 1
1463 1 60 ILE H 1 60 ILE HB . . 3.170 2.506 2.425 2.556 . 0 0 "[ . 1 . 2]" 1
1464 1 60 ILE H 1 60 ILE MD . . 3.960 3.912 3.794 3.969 0.009 1 0 "[ . 1 . 2]" 1
1465 1 60 ILE H 1 60 ILE HG12 . . 3.800 3.465 3.270 3.615 . 0 0 "[ . 1 . 2]" 1
1466 1 60 ILE H 1 60 ILE HG13 . . 3.430 2.469 2.309 2.591 . 0 0 "[ . 1 . 2]" 1
1467 1 60 ILE H 1 60 ILE MG . . 4.160 3.784 3.749 3.802 . 0 0 "[ . 1 . 2]" 1
1468 1 60 ILE H 1 62 GLU H . . 4.940 3.750 3.540 3.941 . 0 0 "[ . 1 . 2]" 1
1469 1 60 ILE H 1 63 GLY H . . 5.190 4.859 4.597 5.120 . 0 0 "[ . 1 . 2]" 1
1470 1 60 ILE H 1 123 VAL MG1 . . 5.140 4.099 4.024 4.171 . 0 0 "[ . 1 . 2]" 1
1471 1 60 ILE H 1 123 VAL MG2 . . 5.370 3.843 3.351 4.048 . 0 0 "[ . 1 . 2]" 1
1472 1 60 ILE HA 1 60 ILE MD . . 3.990 3.740 3.677 3.801 . 0 0 "[ . 1 . 2]" 1
1473 1 60 ILE HA 1 60 ILE HG12 . . 3.610 2.426 2.378 2.511 . 0 0 "[ . 1 . 2]" 1
1474 1 60 ILE HA 1 60 ILE HG13 . . 3.850 3.177 3.048 3.272 . 0 0 "[ . 1 . 2]" 1
1475 1 60 ILE HA 1 60 ILE MG . . 3.310 2.423 2.280 2.461 . 0 0 "[ . 1 . 2]" 1
1476 1 60 ILE HA 1 63 GLY H . . 3.860 3.595 3.340 3.861 0.001 2 0 "[ . 1 . 2]" 1
1477 1 60 ILE HA 1 123 VAL MG1 . . 3.110 1.827 1.782 1.885 . 0 0 "[ . 1 . 2]" 1
1478 1 60 ILE HA 1 123 VAL MG2 . . 4.160 2.284 1.852 2.548 . 0 0 "[ . 1 . 2]" 1
1479 1 60 ILE HA 1 127 PHE QE . . 3.990 3.484 3.266 3.790 . 0 0 "[ . 1 . 2]" 1
1480 1 60 ILE HB 1 60 ILE MD . . 3.480 2.475 2.400 2.539 . 0 0 "[ . 1 . 2]" 1
1481 1 60 ILE HB 1 61 ARG H . . 3.160 2.584 2.333 2.800 . 0 0 "[ . 1 . 2]" 1
1482 1 60 ILE HB 1 103 LEU MD2 . . 4.840 4.558 4.441 4.841 0.001 1 0 "[ . 1 . 2]" 1
1483 1 60 ILE MD 1 101 PRO QB . . 4.700 3.406 3.204 3.786 . 0 0 "[ . 1 . 2]" 1
1484 1 60 ILE MD 1 103 LEU HB2 . . 4.480 2.466 2.299 2.612 . 0 0 "[ . 1 . 2]" 1
1485 1 60 ILE MD 1 103 LEU HB3 . . 4.200 3.569 3.403 3.734 . 0 0 "[ . 1 . 2]" 1
1486 1 60 ILE MD 1 103 LEU MD2 . . 3.250 2.303 1.978 2.648 . 0 0 "[ . 1 . 2]" 1
1487 1 60 ILE MD 1 117 CYS H . . 5.000 4.935 4.775 5.008 0.008 3 0 "[ . 1 . 2]" 1
1488 1 60 ILE MD 1 117 CYS HA . . 3.790 2.943 2.814 3.083 . 0 0 "[ . 1 . 2]" 1
1489 1 60 ILE MD 1 117 CYS QB . . 3.370 2.185 2.026 2.352 . 0 0 "[ . 1 . 2]" 1
1490 1 60 ILE MD 1 118 CYS H . . 5.350 5.301 5.170 5.351 0.001 5 0 "[ . 1 . 2]" 1
1491 1 60 ILE MD 1 123 VAL HA . . 5.500 5.376 5.184 5.507 0.007 2 0 "[ . 1 . 2]" 1
1492 1 60 ILE MD 1 123 VAL MG2 . . 3.590 3.468 3.289 3.595 0.005 15 0 "[ . 1 . 2]" 1
1493 1 60 ILE HG12 1 60 ILE MG . . 3.410 2.445 2.397 2.503 . 0 0 "[ . 1 . 2]" 1
1494 1 60 ILE HG12 1 61 ARG H . . 5.050 4.862 4.774 4.973 . 0 0 "[ . 1 . 2]" 1
1495 1 60 ILE HG12 1 103 LEU MD2 . . 4.010 3.176 2.806 3.457 . 0 0 "[ . 1 . 2]" 1
1496 1 60 ILE HG12 1 123 VAL MG1 . . 3.810 3.164 2.862 3.454 . 0 0 "[ . 1 . 2]" 1
1497 1 60 ILE HG12 1 123 VAL MG2 . . 3.740 2.214 1.952 2.366 . 0 0 "[ . 1 . 2]" 1
1498 1 60 ILE HG13 1 60 ILE MG . . 3.450 3.186 3.175 3.198 . 0 0 "[ . 1 . 2]" 1
1499 1 60 ILE HG13 1 61 ARG H . . 4.810 4.201 4.106 4.360 . 0 0 "[ . 1 . 2]" 1
1500 1 60 ILE HG13 1 117 CYS HA . . 5.070 3.857 3.701 4.139 . 0 0 "[ . 1 . 2]" 1
1501 1 60 ILE HG13 1 123 VAL MG1 . . 4.520 4.290 4.126 4.405 . 0 0 "[ . 1 . 2]" 1
1502 1 60 ILE HG13 1 123 VAL MG2 . . 4.100 3.356 2.997 3.567 . 0 0 "[ . 1 . 2]" 1
1503 1 60 ILE MG 1 61 ARG H . . 3.900 3.445 3.186 3.718 . 0 0 "[ . 1 . 2]" 1
1504 1 60 ILE MG 1 61 ARG HA . . 4.120 3.488 3.228 3.786 . 0 0 "[ . 1 . 2]" 1
1505 1 60 ILE MG 1 63 GLY H . . 5.150 4.683 4.467 5.030 . 0 0 "[ . 1 . 2]" 1
1506 1 60 ILE MG 1 64 LEU QD . . 3.620 2.325 1.935 2.717 . 0 0 "[ . 1 . 2]" 1
1507 1 60 ILE MG 1 64 LEU HG . . 4.000 2.745 2.521 2.965 . 0 0 "[ . 1 . 2]" 1
1508 1 60 ILE MG 1 73 PHE QD . . 4.540 4.028 3.643 4.411 . 0 0 "[ . 1 . 2]" 1
1509 1 60 ILE MG 1 73 PHE QE . . 3.680 2.658 2.128 2.986 . 0 0 "[ . 1 . 2]" 1
1510 1 60 ILE MG 1 73 PHE HZ . . 3.610 2.912 2.527 3.310 . 0 0 "[ . 1 . 2]" 1
1511 1 60 ILE MG 1 103 LEU MD1 . . 3.290 2.364 2.157 2.581 . 0 0 "[ . 1 . 2]" 1
1512 1 60 ILE MG 1 103 LEU MD2 . . 3.240 2.095 1.910 2.426 . 0 0 "[ . 1 . 2]" 1
1513 1 60 ILE MG 1 123 VAL MG1 . . 3.580 2.610 2.470 2.749 . 0 0 "[ . 1 . 2]" 1
1514 1 60 ILE MG 1 123 VAL MG2 . . 4.560 3.261 2.996 3.519 . 0 0 "[ . 1 . 2]" 1
1515 1 60 ILE MG 1 127 PHE QE . . 3.940 2.960 2.789 3.221 . 0 0 "[ . 1 . 2]" 1
1516 1 60 ILE MG 1 127 PHE HZ . . 3.350 2.651 2.414 2.999 . 0 0 "[ . 1 . 2]" 1
1517 1 61 ARG H 1 61 ARG HB2 . . 4.040 2.227 2.172 2.432 . 0 0 "[ . 1 . 2]" 1
1518 1 61 ARG H 1 61 ARG QB . . 3.190 2.180 2.131 2.394 . 0 0 "[ . 1 . 2]" 1
1519 1 61 ARG H 1 61 ARG HB3 . . 4.040 3.199 2.815 3.581 . 0 0 "[ . 1 . 2]" 1
1520 1 61 ARG H 1 61 ARG QD . . 4.300 4.263 4.155 4.343 0.043 15 0 "[ . 1 . 2]" 1
1521 1 61 ARG H 1 61 ARG QG . . 4.250 3.333 2.408 3.937 . 0 0 "[ . 1 . 2]" 1
1522 1 61 ARG H 1 62 GLU H . . 3.380 2.629 2.442 2.786 . 0 0 "[ . 1 . 2]" 1
1523 1 61 ARG H 1 62 GLU HB2 . . 4.950 4.652 4.353 4.848 . 0 0 "[ . 1 . 2]" 1
1524 1 61 ARG H 1 62 GLU QG . . 4.660 4.560 4.336 4.661 0.001 15 0 "[ . 1 . 2]" 1
1525 1 61 ARG H 1 63 GLY H . . 4.800 4.410 4.091 4.792 . 0 0 "[ . 1 . 2]" 1
1526 1 61 ARG H 1 64 LEU QD . . 4.980 3.980 3.743 4.252 . 0 0 "[ . 1 . 2]" 1
1527 1 61 ARG HA 1 61 ARG QD . . 3.940 3.540 2.181 4.057 0.117 20 0 "[ . 1 . 2]" 1
1528 1 61 ARG HA 1 61 ARG HG2 . . 4.030 2.696 2.181 3.226 . 0 0 "[ . 1 . 2]" 1
1529 1 61 ARG HA 1 61 ARG QG . . 3.280 2.227 2.137 2.489 . 0 0 "[ . 1 . 2]" 1
1530 1 61 ARG HA 1 61 ARG HG3 . . 4.030 2.821 2.172 3.644 . 0 0 "[ . 1 . 2]" 1
1531 1 61 ARG HA 1 64 LEU H . . 3.790 3.548 3.147 3.786 . 0 0 "[ . 1 . 2]" 1
1532 1 61 ARG HA 1 64 LEU QB . . 3.700 2.632 2.076 3.068 . 0 0 "[ . 1 . 2]" 1
1533 1 61 ARG HA 1 64 LEU MD1 . . 4.660 2.041 1.907 2.219 . 0 0 "[ . 1 . 2]" 1
1534 1 61 ARG HA 1 64 LEU QD . . 3.300 2.038 1.904 2.213 . 0 0 "[ . 1 . 2]" 1
1535 1 61 ARG HA 1 64 LEU MD2 . . 4.660 4.557 4.354 4.672 0.012 8 0 "[ . 1 . 2]" 1
1536 1 61 ARG HA 1 64 LEU HG . . 4.520 3.653 3.249 4.032 . 0 0 "[ . 1 . 2]" 1
1537 1 61 ARG QB 1 61 ARG QD . . 3.110 2.159 2.032 2.409 . 0 0 "[ . 1 . 2]" 1
1538 1 61 ARG QB 1 61 ARG HE . . 4.950 3.597 2.702 4.410 . 0 0 "[ . 1 . 2]" 1
1539 1 61 ARG QB 1 62 GLU H . . 4.390 2.784 2.559 3.057 . 0 0 "[ . 1 . 2]" 1
1540 1 61 ARG QB 1 62 GLU HA . . 4.690 3.903 3.793 4.007 . 0 0 "[ . 1 . 2]" 1
1541 1 61 ARG QB 1 62 GLU QG . . 4.290 3.525 3.239 3.978 . 0 0 "[ . 1 . 2]" 1
1542 1 61 ARG QB 1 64 LEU H . . 5.340 4.974 4.743 5.216 . 0 0 "[ . 1 . 2]" 1
1543 1 61 ARG QB 1 64 LEU QD . . 4.620 3.750 3.549 3.901 . 0 0 "[ . 1 . 2]" 1
1544 1 61 ARG QD 1 64 LEU QD . . 4.290 3.944 2.525 4.292 0.002 2 0 "[ . 1 . 2]" 1
1545 1 61 ARG QG 1 64 LEU QD . . 4.010 2.837 2.190 3.461 . 0 0 "[ . 1 . 2]" 1
1546 1 62 GLU H 1 62 GLU HB2 . . 2.920 2.299 2.180 2.391 . 0 0 "[ . 1 . 2]" 1
1547 1 62 GLU H 1 62 GLU HG2 . . 4.320 2.989 2.449 3.832 . 0 0 "[ . 1 . 2]" 1
1548 1 62 GLU H 1 62 GLU QG . . 3.650 2.613 2.403 2.893 . 0 0 "[ . 1 . 2]" 1
1549 1 62 GLU H 1 62 GLU HG3 . . 4.320 3.343 2.546 3.807 . 0 0 "[ . 1 . 2]" 1
1550 1 62 GLU H 1 63 GLY H . . 3.280 2.680 2.471 3.040 . 0 0 "[ . 1 . 2]" 1
1551 1 62 GLU H 1 64 LEU H . . 4.630 3.951 3.740 4.152 . 0 0 "[ . 1 . 2]" 1
1552 1 62 GLU H 1 123 VAL MG1 . . 4.880 4.109 3.641 4.520 . 0 0 "[ . 1 . 2]" 1
1553 1 62 GLU HA 1 62 GLU QG . . 3.570 2.482 2.202 2.763 . 0 0 "[ . 1 . 2]" 1
1554 1 62 GLU HA 1 64 LEU H . . 4.910 4.285 3.984 4.542 . 0 0 "[ . 1 . 2]" 1
1555 1 62 GLU HB2 1 63 GLY H . . 3.590 2.574 2.312 3.082 . 0 0 "[ . 1 . 2]" 1
1556 1 62 GLU QG 1 63 GLY H . . 4.890 4.174 4.037 4.447 . 0 0 "[ . 1 . 2]" 1
1557 1 63 GLY H 1 64 LEU H . . 3.430 2.647 2.272 2.815 . 0 0 "[ . 1 . 2]" 1
1558 1 63 GLY H 1 64 LEU HG . . 5.500 4.961 4.557 5.216 . 0 0 "[ . 1 . 2]" 1
1559 1 63 GLY H 1 65 LYS H . . 4.930 4.181 4.034 4.292 . 0 0 "[ . 1 . 2]" 1
1560 1 63 GLY H 1 66 HIS HD2 . . 5.090 4.596 4.212 5.034 . 0 0 "[ . 1 . 2]" 1
1561 1 63 GLY H 1 123 VAL MG1 . . 3.590 2.425 2.192 2.699 . 0 0 "[ . 1 . 2]" 1
1562 1 63 GLY H 1 127 PHE QD . . 5.500 4.779 4.375 5.122 . 0 0 "[ . 1 . 2]" 1
1563 1 63 GLY H 1 127 PHE QE . . 4.790 4.041 3.565 4.414 . 0 0 "[ . 1 . 2]" 1
1564 1 63 GLY QA 1 65 LYS H . . 4.280 3.439 3.243 3.740 . 0 0 "[ . 1 . 2]" 1
1565 1 63 GLY QA 1 66 HIS H . . 4.550 3.125 2.987 3.255 . 0 0 "[ . 1 . 2]" 1
1566 1 63 GLY QA 1 66 HIS HD2 . . 3.450 2.493 2.186 2.905 . 0 0 "[ . 1 . 2]" 1
1567 1 63 GLY QA 1 123 VAL MG1 . . 3.090 1.885 1.793 1.996 . 0 0 "[ . 1 . 2]" 1
1568 1 63 GLY QA 1 124 GLU HA . . 4.780 2.925 2.617 3.201 . 0 0 "[ . 1 . 2]" 1
1569 1 63 GLY QA 1 127 PHE QD . . 3.900 2.747 2.306 3.060 . 0 0 "[ . 1 . 2]" 1
1570 1 63 GLY QA 1 127 PHE QE . . 4.100 3.066 2.886 3.246 . 0 0 "[ . 1 . 2]" 1
1571 1 63 GLY HA2 1 65 LYS H . . 4.940 3.624 3.391 3.955 . 0 0 "[ . 1 . 2]" 1
1572 1 63 GLY HA2 1 123 VAL MG1 . . 3.560 3.365 3.245 3.496 . 0 0 "[ . 1 . 2]" 1
1573 1 63 GLY HA2 1 127 PHE QD . . 4.430 3.781 3.505 4.051 . 0 0 "[ . 1 . 2]" 1
1574 1 63 GLY HA2 1 127 PHE QE . . 4.790 4.600 4.381 4.788 . 0 0 "[ . 1 . 2]" 1
1575 1 63 GLY HA3 1 65 LYS H . . 4.940 4.283 4.127 4.609 . 0 0 "[ . 1 . 2]" 1
1576 1 63 GLY HA3 1 123 VAL MG1 . . 3.560 1.894 1.802 2.008 . 0 0 "[ . 1 . 2]" 1
1577 1 63 GLY HA3 1 127 PHE QD . . 4.430 2.824 2.339 3.180 . 0 0 "[ . 1 . 2]" 1
1578 1 63 GLY HA3 1 127 PHE QE . . 4.790 3.114 2.928 3.301 . 0 0 "[ . 1 . 2]" 1
1579 1 64 LEU H 1 64 LEU HB2 . . 3.700 2.239 2.167 2.306 . 0 0 "[ . 1 . 2]" 1
1580 1 64 LEU H 1 64 LEU QB . . 3.020 2.215 2.147 2.278 . 0 0 "[ . 1 . 2]" 1
1581 1 64 LEU H 1 64 LEU HB3 . . 3.700 3.524 3.483 3.550 . 0 0 "[ . 1 . 2]" 1
1582 1 64 LEU H 1 64 LEU MD1 . . 4.050 3.530 3.390 3.664 . 0 0 "[ . 1 . 2]" 1
1583 1 64 LEU H 1 64 LEU QD . . 3.530 3.283 3.196 3.356 . 0 0 "[ . 1 . 2]" 1
1584 1 64 LEU H 1 64 LEU MD2 . . 4.050 3.918 3.824 4.050 . 0 0 "[ . 1 . 2]" 1
1585 1 64 LEU H 1 64 LEU HG . . 3.250 2.784 2.633 2.983 . 0 0 "[ . 1 . 2]" 1
1586 1 64 LEU H 1 65 LYS H . . 3.460 2.712 2.583 2.803 . 0 0 "[ . 1 . 2]" 1
1587 1 64 LEU H 1 66 HIS HD2 . . 5.070 4.862 4.551 5.069 . 0 0 "[ . 1 . 2]" 1
1588 1 64 LEU H 1 123 VAL MG1 . . 4.500 3.149 2.868 3.375 . 0 0 "[ . 1 . 2]" 1
1589 1 64 LEU H 1 127 PHE QD . . 5.040 3.756 3.495 4.010 . 0 0 "[ . 1 . 2]" 1
1590 1 64 LEU H 1 127 PHE QE . . 4.250 2.866 2.430 3.194 . 0 0 "[ . 1 . 2]" 1
1591 1 64 LEU HA 1 64 LEU MD1 . . 4.020 3.828 3.805 3.851 . 0 0 "[ . 1 . 2]" 1
1592 1 64 LEU HA 1 64 LEU QD . . 3.070 2.111 1.957 2.334 . 0 0 "[ . 1 . 2]" 1
1593 1 64 LEU HA 1 64 LEU MD2 . . 4.020 2.122 1.963 2.356 . 0 0 "[ . 1 . 2]" 1
1594 1 64 LEU HA 1 64 LEU HG . . 3.640 2.669 2.543 2.739 . 0 0 "[ . 1 . 2]" 1
1595 1 64 LEU HA 1 66 HIS H . . 4.290 4.150 3.732 4.293 0.003 16 0 "[ . 1 . 2]" 1
1596 1 64 LEU HA 1 67 VAL H . . 4.000 3.663 3.441 3.935 . 0 0 "[ . 1 . 2]" 1
1597 1 64 LEU HA 1 67 VAL HB . . 4.580 2.819 2.658 2.955 . 0 0 "[ . 1 . 2]" 1
1598 1 64 LEU HA 1 67 VAL MG1 . . 3.890 3.818 3.546 3.893 0.003 3 0 "[ . 1 . 2]" 1
1599 1 64 LEU HA 1 67 VAL MG2 . . 4.080 3.960 3.730 4.084 0.004 1 0 "[ . 1 . 2]" 1
1600 1 64 LEU HA 1 123 VAL MG1 . . 5.140 4.191 3.995 4.474 . 0 0 "[ . 1 . 2]" 1
1601 1 64 LEU HA 1 127 PHE QE . . 4.800 3.124 2.706 3.460 . 0 0 "[ . 1 . 2]" 1
1602 1 64 LEU QB 1 64 LEU QD . . 2.790 1.880 1.829 1.928 . 0 0 "[ . 1 . 2]" 1
1603 1 64 LEU QB 1 65 LYS H . . 3.690 2.999 2.719 3.193 . 0 0 "[ . 1 . 2]" 1
1604 1 64 LEU HB2 1 65 LYS H . . 4.290 3.166 2.874 3.384 . 0 0 "[ . 1 . 2]" 1
1605 1 64 LEU HB3 1 65 LYS H . . 4.290 3.716 3.355 3.947 . 0 0 "[ . 1 . 2]" 1
1606 1 64 LEU QD 1 67 VAL H . . 4.930 4.763 4.500 4.931 0.001 11 0 "[ . 1 . 2]" 1
1607 1 64 LEU QD 1 67 VAL MG1 . . 3.700 3.576 3.408 3.701 0.001 19 0 "[ . 1 . 2]" 1
1608 1 64 LEU QD 1 67 VAL MG2 . . 3.530 3.435 3.273 3.532 0.002 1 0 "[ . 1 . 2]" 1
1609 1 64 LEU QD 1 73 PHE HA . . 5.130 3.500 3.383 3.658 . 0 0 "[ . 1 . 2]" 1
1610 1 64 LEU QD 1 73 PHE HB2 . . 3.770 2.126 1.940 2.334 . 0 0 "[ . 1 . 2]" 1
1611 1 64 LEU QD 1 73 PHE QD . . 3.230 2.303 1.887 2.650 . 0 0 "[ . 1 . 2]" 1
1612 1 64 LEU QD 1 73 PHE QE . . 3.990 2.870 2.505 3.269 . 0 0 "[ . 1 . 2]" 1
1613 1 64 LEU QD 1 73 PHE HZ . . 4.740 3.658 3.257 4.160 . 0 0 "[ . 1 . 2]" 1
1614 1 64 LEU QD 1 127 PHE QD . . 4.730 3.326 3.096 3.596 . 0 0 "[ . 1 . 2]" 1
1615 1 64 LEU QD 1 127 PHE QE . . 3.670 2.379 2.238 2.702 . 0 0 "[ . 1 . 2]" 1
1616 1 64 LEU QD 1 127 PHE HZ . . 3.970 2.229 1.970 2.581 . 0 0 "[ . 1 . 2]" 1
1617 1 64 LEU MD1 1 65 LYS H . . 4.980 4.861 4.645 4.982 0.002 19 0 "[ . 1 . 2]" 1
1618 1 64 LEU MD1 1 73 PHE HB2 . . 4.720 2.354 1.963 2.675 . 0 0 "[ . 1 . 2]" 1
1619 1 64 LEU MD1 1 73 PHE HB3 . . 4.580 3.280 2.808 3.539 . 0 0 "[ . 1 . 2]" 1
1620 1 64 LEU MD1 1 73 PHE QD . . 3.710 2.522 2.009 2.797 . 0 0 "[ . 1 . 2]" 1
1621 1 64 LEU MD1 1 73 PHE QE . . 4.860 2.963 2.535 3.366 . 0 0 "[ . 1 . 2]" 1
1622 1 64 LEU MD1 1 127 PHE HZ . . 4.740 3.217 2.913 3.444 . 0 0 "[ . 1 . 2]" 1
1623 1 64 LEU MD2 1 65 LYS H . . 4.980 4.825 4.677 4.944 . 0 0 "[ . 1 . 2]" 1
1624 1 64 LEU MD2 1 73 PHE HB2 . . 4.720 2.518 2.243 3.045 . 0 0 "[ . 1 . 2]" 1
1625 1 64 LEU MD2 1 73 PHE HB3 . . 4.580 4.021 3.754 4.557 . 0 0 "[ . 1 . 2]" 1
1626 1 64 LEU MD2 1 73 PHE QD . . 3.710 2.691 2.289 3.326 . 0 0 "[ . 1 . 2]" 1
1627 1 64 LEU MD2 1 73 PHE QE . . 4.860 3.877 3.565 4.434 . 0 0 "[ . 1 . 2]" 1
1628 1 64 LEU MD2 1 127 PHE HZ . . 4.740 2.279 1.988 2.669 . 0 0 "[ . 1 . 2]" 1
1629 1 64 LEU HG 1 127 PHE HZ . . 4.440 2.291 2.005 2.526 . 0 0 "[ . 1 . 2]" 1
1630 1 65 LYS H 1 65 LYS HB2 . . 3.840 2.312 2.167 2.518 . 0 0 "[ . 1 . 2]" 1
1631 1 65 LYS H 1 65 LYS QB . . 3.000 2.284 2.147 2.474 . 0 0 "[ . 1 . 2]" 1
1632 1 65 LYS H 1 65 LYS HB3 . . 3.840 3.556 3.477 3.634 . 0 0 "[ . 1 . 2]" 1
1633 1 65 LYS H 1 65 LYS HG2 . . 3.670 3.362 2.998 3.701 0.031 3 0 "[ . 1 . 2]" 1
1634 1 65 LYS H 1 65 LYS QG . . 3.060 2.688 2.269 2.977 . 0 0 "[ . 1 . 2]" 1
1635 1 65 LYS H 1 65 LYS HG3 . . 3.670 3.038 2.289 3.688 0.018 16 0 "[ . 1 . 2]" 1
1636 1 65 LYS H 1 66 HIS H . . 3.260 2.436 2.259 2.590 . 0 0 "[ . 1 . 2]" 1
1637 1 65 LYS H 1 66 HIS HB2 . . 5.030 4.682 4.502 5.023 . 0 0 "[ . 1 . 2]" 1
1638 1 65 LYS H 1 66 HIS HD2 . . 4.330 3.352 3.072 3.653 . 0 0 "[ . 1 . 2]" 1
1639 1 65 LYS H 1 123 VAL MG1 . . 5.020 5.012 4.952 5.031 0.011 3 0 "[ . 1 . 2]" 1
1640 1 65 LYS HA 1 65 LYS QE . . 4.180 3.658 1.928 4.230 0.050 3 0 "[ . 1 . 2]" 1
1641 1 65 LYS HA 1 65 LYS HG2 . . 3.580 2.422 2.302 2.748 . 0 0 "[ . 1 . 2]" 1
1642 1 65 LYS HA 1 65 LYS QG . . 3.090 2.354 2.250 2.511 . 0 0 "[ . 1 . 2]" 1
1643 1 65 LYS HA 1 65 LYS HG3 . . 3.580 3.332 2.798 3.649 0.069 7 0 "[ . 1 . 2]" 1
1644 1 65 LYS HA 1 67 VAL H . . 4.380 3.694 3.469 3.918 . 0 0 "[ . 1 . 2]" 1
1645 1 65 LYS QB 1 65 LYS QE . . 3.210 2.288 1.972 3.327 0.117 1 0 "[ . 1 . 2]" 1
1646 1 65 LYS QB 1 66 HIS H . . 4.010 2.806 2.651 3.128 . 0 0 "[ . 1 . 2]" 1
1647 1 65 LYS QB 1 66 HIS HD2 . . 3.800 2.756 2.207 3.045 . 0 0 "[ . 1 . 2]" 1
1648 1 65 LYS HB2 1 66 HIS HD2 . . 4.370 2.815 2.225 3.161 . 0 0 "[ . 1 . 2]" 1
1649 1 65 LYS HB3 1 66 HIS HD2 . . 4.370 4.002 3.534 4.352 . 0 0 "[ . 1 . 2]" 1
1650 1 65 LYS QE 1 65 LYS QG . . 3.070 2.288 2.066 2.557 . 0 0 "[ . 1 . 2]" 1
1651 1 66 HIS H 1 66 HIS HB2 . . 3.320 2.497 2.394 2.616 . 0 0 "[ . 1 . 2]" 1
1652 1 66 HIS H 1 66 HIS HB3 . . 3.660 3.629 3.585 3.674 0.014 2 0 "[ . 1 . 2]" 1
1653 1 66 HIS H 1 66 HIS HD2 . . 3.860 2.283 1.920 2.758 . 0 0 "[ . 1 . 2]" 1
1654 1 66 HIS H 1 67 VAL H . . 3.090 2.574 2.288 2.744 . 0 0 "[ . 1 . 2]" 1
1655 1 66 HIS H 1 67 VAL HB . . 5.050 4.464 4.134 4.616 . 0 0 "[ . 1 . 2]" 1
1656 1 66 HIS H 1 67 VAL MG1 . . 4.660 4.438 4.325 4.568 . 0 0 "[ . 1 . 2]" 1
1657 1 66 HIS HA 1 66 HIS HD2 . . 4.860 3.895 3.554 4.171 . 0 0 "[ . 1 . 2]" 1
1658 1 66 HIS HB2 1 67 VAL H . . 4.310 3.519 3.051 3.996 . 0 0 "[ . 1 . 2]" 1
1659 1 66 HIS HB3 1 67 VAL H . . 4.630 4.236 3.942 4.489 . 0 0 "[ . 1 . 2]" 1
1660 1 67 VAL H 1 67 VAL HB . . 3.290 2.363 2.256 2.557 . 0 0 "[ . 1 . 2]" 1
1661 1 67 VAL H 1 67 VAL MG1 . . 3.070 2.465 2.035 2.719 . 0 0 "[ . 1 . 2]" 1
1662 1 67 VAL H 1 67 VAL MG2 . . 3.790 3.708 3.654 3.772 . 0 0 "[ . 1 . 2]" 1
1663 1 67 VAL H 1 68 THR H . . 4.690 4.618 4.591 4.636 . 0 0 "[ . 1 . 2]" 1
1664 1 67 VAL H 1 127 PHE HB3 . . 4.700 3.622 2.901 4.343 . 0 0 "[ . 1 . 2]" 1
1665 1 67 VAL HA 1 67 VAL MG1 . . 3.600 3.182 3.170 3.202 . 0 0 "[ . 1 . 2]" 1
1666 1 67 VAL HA 1 67 VAL MG2 . . 2.990 2.143 2.059 2.361 . 0 0 "[ . 1 . 2]" 1
1667 1 67 VAL HA 1 68 THR H . . 2.840 2.235 2.189 2.349 . 0 0 "[ . 1 . 2]" 1
1668 1 67 VAL HA 1 68 THR HA . . 4.510 4.398 4.376 4.433 . 0 0 "[ . 1 . 2]" 1
1669 1 67 VAL HA 1 68 THR MG . . 4.250 3.723 3.139 4.209 . 0 0 "[ . 1 . 2]" 1
1670 1 67 VAL HA 1 69 GLU H . . 4.430 4.017 3.701 4.304 . 0 0 "[ . 1 . 2]" 1
1671 1 67 VAL HA 1 127 PHE H . . 5.480 5.140 4.888 5.446 . 0 0 "[ . 1 . 2]" 1
1672 1 67 VAL HA 1 127 PHE HB2 . . 4.550 3.122 2.877 3.422 . 0 0 "[ . 1 . 2]" 1
1673 1 67 VAL HA 1 127 PHE HB3 . . 4.150 2.033 1.999 2.118 . 0 0 "[ . 1 . 2]" 1
1674 1 67 VAL HA 1 128 SER H . . 4.980 4.228 3.518 4.866 . 0 0 "[ . 1 . 2]" 1
1675 1 67 VAL HB 1 68 THR H . . 4.220 4.129 3.918 4.224 0.004 1 0 "[ . 1 . 2]" 1
1676 1 67 VAL HB 1 69 GLU H . . 4.580 4.466 4.316 4.581 0.001 6 0 "[ . 1 . 2]" 1
1677 1 67 VAL HB 1 127 PHE HB3 . . 4.330 2.456 2.040 3.002 . 0 0 "[ . 1 . 2]" 1
1678 1 67 VAL MG1 1 68 THR H . . 3.930 3.497 3.296 3.781 . 0 0 "[ . 1 . 2]" 1
1679 1 67 VAL MG1 1 68 THR HA . . 4.040 3.692 3.479 3.983 . 0 0 "[ . 1 . 2]" 1
1680 1 67 VAL MG1 1 68 THR MG . . 4.780 4.534 4.152 4.786 0.006 7 0 "[ . 1 . 2]" 1
1681 1 67 VAL MG1 1 69 GLU H . . 4.060 2.389 2.243 2.628 . 0 0 "[ . 1 . 2]" 1
1682 1 67 VAL MG1 1 69 GLU QG . . 4.320 3.523 3.280 3.657 . 0 0 "[ . 1 . 2]" 1
1683 1 67 VAL MG1 1 127 PHE QD . . 4.900 4.598 4.401 4.759 . 0 0 "[ . 1 . 2]" 1
1684 1 67 VAL MG1 1 127 PHE QE . . 5.500 5.410 5.243 5.494 . 0 0 "[ . 1 . 2]" 1
1685 1 67 VAL MG2 1 68 THR H . . 3.830 2.120 1.920 2.275 . 0 0 "[ . 1 . 2]" 1
1686 1 67 VAL MG2 1 68 THR HA . . 4.330 4.072 3.824 4.299 . 0 0 "[ . 1 . 2]" 1
1687 1 67 VAL MG2 1 69 GLU H . . 3.770 2.135 1.870 2.416 . 0 0 "[ . 1 . 2]" 1
1688 1 67 VAL MG2 1 69 GLU HG2 . . 5.100 2.003 1.890 2.320 . 0 0 "[ . 1 . 2]" 1
1689 1 67 VAL MG2 1 69 GLU QG . . 4.320 1.943 1.850 2.056 . 0 0 "[ . 1 . 2]" 1
1690 1 67 VAL MG2 1 69 GLU HG3 . . 5.100 2.793 2.089 3.197 . 0 0 "[ . 1 . 2]" 1
1691 1 67 VAL MG2 1 127 PHE HB2 . . 4.360 3.578 3.358 3.946 . 0 0 "[ . 1 . 2]" 1
1692 1 67 VAL MG2 1 127 PHE HB3 . . 3.510 2.107 1.927 2.505 . 0 0 "[ . 1 . 2]" 1
1693 1 67 VAL MG2 1 127 PHE QD . . 3.760 2.557 2.309 2.862 . 0 0 "[ . 1 . 2]" 1
1694 1 67 VAL MG2 1 127 PHE QE . . 4.840 4.083 3.840 4.237 . 0 0 "[ . 1 . 2]" 1
1695 1 68 THR H 1 68 THR MG . . 3.360 2.479 2.332 2.656 . 0 0 "[ . 1 . 2]" 1
1696 1 68 THR H 1 69 GLU H . . 3.100 2.649 2.396 2.884 . 0 0 "[ . 1 . 2]" 1
1697 1 68 THR H 1 69 GLU QG . . 4.680 3.174 2.859 3.598 . 0 0 "[ . 1 . 2]" 1
1698 1 68 THR HA 1 68 THR MG . . 3.080 2.833 2.415 3.184 0.104 18 0 "[ . 1 . 2]" 1
1699 1 68 THR HA 1 69 GLU H . . 3.310 2.911 2.785 3.143 . 0 0 "[ . 1 . 2]" 1
1700 1 68 THR HB 1 69 GLU H . . 4.720 4.531 4.416 4.608 . 0 0 "[ . 1 . 2]" 1
1701 1 68 THR MG 1 69 GLU H . . 4.230 3.838 3.049 4.274 0.044 12 0 "[ . 1 . 2]" 1
1702 1 68 THR MG 1 128 SER HB2 . . 5.100 4.429 3.756 5.081 . 0 0 "[ . 1 . 2]" 1
1703 1 68 THR MG 1 128 SER QB . . 4.320 3.897 3.236 4.322 0.002 15 0 "[ . 1 . 2]" 1
1704 1 68 THR MG 1 128 SER HB3 . . 5.100 4.518 3.337 5.095 . 0 0 "[ . 1 . 2]" 1
1705 1 69 GLU H 1 69 GLU HB2 . . 4.060 3.949 3.765 4.037 . 0 0 "[ . 1 . 2]" 1
1706 1 69 GLU H 1 69 GLU HB3 . . 3.460 3.383 3.138 3.460 . 0 0 "[ . 1 . 2]" 1
1707 1 69 GLU H 1 69 GLU HG2 . . 4.380 2.494 2.102 2.762 . 0 0 "[ . 1 . 2]" 1
1708 1 69 GLU H 1 69 GLU QG . . 3.660 2.434 2.067 2.692 . 0 0 "[ . 1 . 2]" 1
1709 1 69 GLU H 1 69 GLU HG3 . . 4.380 3.508 2.757 3.909 . 0 0 "[ . 1 . 2]" 1
1710 1 69 GLU H 1 70 ASP H . . 5.500 4.057 3.912 4.418 . 0 0 "[ . 1 . 2]" 1
1711 1 69 GLU HA 1 70 ASP H . . 3.330 2.153 2.138 2.295 . 0 0 "[ . 1 . 2]" 1
1712 1 69 GLU HA 1 71 CYS H . . 5.500 5.354 5.235 5.459 . 0 0 "[ . 1 . 2]" 1
1713 1 69 GLU HB2 1 70 ASP H . . 3.840 3.396 2.717 3.631 . 0 0 "[ . 1 . 2]" 1
1714 1 69 GLU HB2 1 71 CYS H . . 5.500 5.382 5.011 5.499 . 0 0 "[ . 1 . 2]" 1
1715 1 69 GLU HB3 1 70 ASP H . . 4.380 4.267 3.727 4.370 . 0 0 "[ . 1 . 2]" 1
1716 1 69 GLU QG 1 70 ASP H . . 4.560 4.142 3.690 4.316 . 0 0 "[ . 1 . 2]" 1
1717 1 69 GLU QG 1 71 CYS H . . 4.340 4.078 3.499 4.346 0.006 1 0 "[ . 1 . 2]" 1
1718 1 69 GLU QG 1 71 CYS HA . . 5.270 4.449 4.069 4.999 . 0 0 "[ . 1 . 2]" 1
1719 1 69 GLU QG 1 71 CYS QB . . 4.120 2.616 2.310 4.053 . 0 0 "[ . 1 . 2]" 1
1720 1 70 ASP H 1 70 ASP HB2 . . 3.610 3.392 2.723 3.602 . 0 0 "[ . 1 . 2]" 1
1721 1 70 ASP H 1 70 ASP QB . . 3.100 2.679 2.522 2.813 . 0 0 "[ . 1 . 2]" 1
1722 1 70 ASP H 1 70 ASP HB3 . . 3.610 2.947 2.576 3.579 . 0 0 "[ . 1 . 2]" 1
1723 1 70 ASP H 1 71 CYS H . . 4.540 4.261 4.199 4.319 . 0 0 "[ . 1 . 2]" 1
1724 1 70 ASP HA 1 71 CYS H . . 2.740 2.197 2.173 2.225 . 0 0 "[ . 1 . 2]" 1
1725 1 70 ASP QB 1 71 CYS H . . 3.700 3.644 3.585 3.707 0.007 5 0 "[ . 1 . 2]" 1
1726 1 70 ASP HB2 1 71 CYS H . . 4.500 4.002 3.819 4.405 . 0 0 "[ . 1 . 2]" 1
1727 1 70 ASP HB3 1 71 CYS H . . 4.500 4.271 3.864 4.461 . 0 0 "[ . 1 . 2]" 1
1728 1 71 CYS H 1 71 CYS HB2 . . 4.100 3.736 2.519 3.836 . 0 0 "[ . 1 . 2]" 1
1729 1 71 CYS H 1 71 CYS HB3 . . 4.100 3.012 2.897 3.698 . 0 0 "[ . 1 . 2]" 1
1730 1 71 CYS H 1 72 VAL H . . 4.670 4.466 4.447 4.496 . 0 0 "[ . 1 . 2]" 1
1731 1 71 CYS H 1 72 VAL MG2 . . 4.580 4.539 4.474 4.582 0.002 1 0 "[ . 1 . 2]" 1
1732 1 71 CYS HA 1 72 VAL H . . 3.060 2.502 2.442 2.511 . 0 0 "[ . 1 . 2]" 1
1733 1 71 CYS HA 1 72 VAL HA . . 5.270 4.461 4.439 4.477 . 0 0 "[ . 1 . 2]" 1
1734 1 71 CYS HA 1 72 VAL MG2 . . 4.310 3.417 3.180 3.555 . 0 0 "[ . 1 . 2]" 1
1735 1 71 CYS QB 1 72 VAL H . . 3.050 2.280 2.184 2.343 . 0 0 "[ . 1 . 2]" 1
1736 1 71 CYS QB 1 72 VAL HB . . 4.940 4.847 4.745 4.894 . 0 0 "[ . 1 . 2]" 1
1737 1 71 CYS QB 1 72 VAL MG2 . . 4.570 4.332 4.233 4.426 . 0 0 "[ . 1 . 2]" 1
1738 1 71 CYS HB2 1 72 VAL H . . 3.760 2.361 2.245 3.434 . 0 0 "[ . 1 . 2]" 1
1739 1 71 CYS HB3 1 72 VAL H . . 3.760 3.674 2.209 3.772 0.012 4 0 "[ . 1 . 2]" 1
1740 1 72 VAL H 1 72 VAL HB . . 3.260 2.732 2.683 2.797 . 0 0 "[ . 1 . 2]" 1
1741 1 72 VAL H 1 72 VAL MG1 . . 3.970 3.887 3.856 3.915 . 0 0 "[ . 1 . 2]" 1
1742 1 72 VAL H 1 72 VAL MG2 . . 3.610 2.921 2.765 3.069 . 0 0 "[ . 1 . 2]" 1
1743 1 72 VAL H 1 73 PHE H . . 4.190 3.964 3.827 4.077 . 0 0 "[ . 1 . 2]" 1
1744 1 72 VAL H 1 74 ILE HG13 . . 5.500 5.354 5.169 5.470 . 0 0 "[ . 1 . 2]" 1
1745 1 72 VAL HA 1 72 VAL MG1 . . 3.250 2.340 2.266 2.444 . 0 0 "[ . 1 . 2]" 1
1746 1 72 VAL HA 1 72 VAL MG2 . . 3.220 2.311 2.228 2.450 . 0 0 "[ . 1 . 2]" 1
1747 1 72 VAL HA 1 73 PHE H . . 3.040 2.183 2.155 2.214 . 0 0 "[ . 1 . 2]" 1
1748 1 72 VAL HA 1 73 PHE HA . . 5.390 4.451 4.423 4.483 . 0 0 "[ . 1 . 2]" 1
1749 1 72 VAL HB 1 73 PHE H . . 4.760 4.407 4.337 4.478 . 0 0 "[ . 1 . 2]" 1
1750 1 72 VAL HB 1 74 ILE MD . . 5.200 3.908 3.680 4.104 . 0 0 "[ . 1 . 2]" 1
1751 1 72 VAL MG1 1 73 PHE H . . 3.540 3.128 2.935 3.299 . 0 0 "[ . 1 . 2]" 1
1752 1 72 VAL MG1 1 73 PHE HA . . 4.480 4.305 4.197 4.395 . 0 0 "[ . 1 . 2]" 1
1753 1 72 VAL MG1 1 73 PHE HB3 . . 4.870 4.522 4.384 4.625 . 0 0 "[ . 1 . 2]" 1
1754 1 72 VAL MG1 1 74 ILE HA . . 4.800 4.426 4.318 4.529 . 0 0 "[ . 1 . 2]" 1
1755 1 72 VAL MG1 1 74 ILE HG13 . . 3.310 3.172 2.859 3.310 0.000 8 0 "[ . 1 . 2]" 1
1756 1 72 VAL MG2 1 73 PHE H . . 4.340 4.192 4.119 4.245 . 0 0 "[ . 1 . 2]" 1
1757 1 73 PHE H 1 73 PHE HB2 . . 3.780 2.435 2.338 2.555 . 0 0 "[ . 1 . 2]" 1
1758 1 73 PHE H 1 73 PHE HB3 . . 3.560 2.641 2.538 2.738 . 0 0 "[ . 1 . 2]" 1
1759 1 73 PHE H 1 73 PHE QD . . 4.460 4.144 4.076 4.193 . 0 0 "[ . 1 . 2]" 1
1760 1 73 PHE H 1 74 ILE H . . 4.900 4.626 4.601 4.641 . 0 0 "[ . 1 . 2]" 1
1761 1 73 PHE HA 1 73 PHE QD . . 3.520 2.383 2.002 2.916 . 0 0 "[ . 1 . 2]" 1
1762 1 73 PHE HA 1 74 ILE H . . 2.940 2.256 2.204 2.304 . 0 0 "[ . 1 . 2]" 1
1763 1 73 PHE HA 1 74 ILE HG13 . . 4.400 3.478 3.421 3.582 . 0 0 "[ . 1 . 2]" 1
1764 1 73 PHE HB2 1 74 ILE H . . 4.300 4.073 3.959 4.224 . 0 0 "[ . 1 . 2]" 1
1765 1 73 PHE HB3 1 74 ILE H . . 4.670 3.799 3.688 3.963 . 0 0 "[ . 1 . 2]" 1
1766 1 73 PHE QD 1 74 ILE H . . 3.830 2.995 2.533 3.235 . 0 0 "[ . 1 . 2]" 1
1767 1 73 PHE QD 1 75 TYR H . . 4.820 4.012 2.956 4.799 . 0 0 "[ . 1 . 2]" 1
1768 1 73 PHE QD 1 127 PHE QE . . 4.840 4.349 3.818 4.683 . 0 0 "[ . 1 . 2]" 1
1769 1 73 PHE QE 1 75 TYR HA . . 4.910 3.684 2.615 4.263 . 0 0 "[ . 1 . 2]" 1
1770 1 73 PHE QE 1 103 LEU MD1 . . 3.490 2.171 1.842 2.492 . 0 0 "[ . 1 . 2]" 1
1771 1 73 PHE QE 1 103 LEU MD2 . . 5.310 3.872 3.462 4.225 . 0 0 "[ . 1 . 2]" 1
1772 1 73 PHE QE 1 127 PHE HZ . . 4.340 4.039 3.689 4.294 . 0 0 "[ . 1 . 2]" 1
1773 1 73 PHE HZ 1 75 TYR HB2 . . 5.220 4.610 3.994 5.097 . 0 0 "[ . 1 . 2]" 1
1774 1 73 PHE HZ 1 103 LEU MD1 . . 4.720 3.499 3.148 3.950 . 0 0 "[ . 1 . 2]" 1
1775 1 74 ILE H 1 74 ILE HB . . 3.430 2.843 2.783 2.891 . 0 0 "[ . 1 . 2]" 1
1776 1 74 ILE H 1 74 ILE MD . . 4.280 4.210 4.059 4.282 0.002 15 0 "[ . 1 . 2]" 1
1777 1 74 ILE H 1 74 ILE HG12 . . 4.420 4.029 3.828 4.187 . 0 0 "[ . 1 . 2]" 1
1778 1 74 ILE H 1 74 ILE HG13 . . 3.770 2.980 2.759 3.102 . 0 0 "[ . 1 . 2]" 1
1779 1 74 ILE H 1 74 ILE MG . . 4.180 3.925 3.900 3.949 . 0 0 "[ . 1 . 2]" 1
1780 1 74 ILE H 1 75 TYR H . . 4.790 3.981 3.819 4.231 . 0 0 "[ . 1 . 2]" 1
1781 1 74 ILE HA 1 74 ILE MD . . 4.190 3.839 3.788 3.874 . 0 0 "[ . 1 . 2]" 1
1782 1 74 ILE HA 1 74 ILE HG12 . . 4.110 2.569 2.501 2.631 . 0 0 "[ . 1 . 2]" 1
1783 1 74 ILE HA 1 74 ILE HG13 . . 4.190 3.079 2.933 3.214 . 0 0 "[ . 1 . 2]" 1
1784 1 74 ILE HA 1 74 ILE MG . . 3.350 2.399 2.304 2.430 . 0 0 "[ . 1 . 2]" 1
1785 1 74 ILE HA 1 75 TYR H . . 2.920 2.161 2.140 2.215 . 0 0 "[ . 1 . 2]" 1
1786 1 74 ILE HB 1 74 ILE MD . . 3.340 2.417 2.286 2.517 . 0 0 "[ . 1 . 2]" 1
1787 1 74 ILE HB 1 75 TYR H . . 4.530 4.335 4.170 4.414 . 0 0 "[ . 1 . 2]" 1
1788 1 74 ILE MD 1 74 ILE MG . . 2.960 2.057 1.933 2.235 . 0 0 "[ . 1 . 2]" 1
1789 1 74 ILE MD 1 75 TYR H . . 5.470 5.361 5.115 5.473 0.003 4 0 "[ . 1 . 2]" 1
1790 1 74 ILE HG12 1 74 ILE MG . . 3.340 2.306 2.212 2.403 . 0 0 "[ . 1 . 2]" 1
1791 1 74 ILE HG12 1 75 TYR H . . 4.790 4.639 4.481 4.747 . 0 0 "[ . 1 . 2]" 1
1792 1 74 ILE MG 1 75 TYR H . . 3.650 2.965 2.583 3.307 . 0 0 "[ . 1 . 2]" 1
1793 1 74 ILE MG 1 76 CYS H . . 4.440 3.475 3.273 3.678 . 0 0 "[ . 1 . 2]" 1
1794 1 74 ILE MG 1 76 CYS HB2 . . 3.630 2.896 2.686 3.055 . 0 0 "[ . 1 . 2]" 1
1795 1 74 ILE MG 1 76 CYS HB3 . . 4.250 4.070 3.846 4.227 . 0 0 "[ . 1 . 2]" 1
1796 1 75 TYR H 1 75 TYR HB2 . . 3.430 2.528 2.434 2.683 . 0 0 "[ . 1 . 2]" 1
1797 1 75 TYR H 1 75 TYR HB3 . . 3.530 2.661 2.576 2.735 . 0 0 "[ . 1 . 2]" 1
1798 1 75 TYR H 1 75 TYR QD . . 4.790 4.229 4.202 4.286 . 0 0 "[ . 1 . 2]" 1
1799 1 75 TYR H 1 76 CYS H . . 4.920 4.086 3.994 4.141 . 0 0 "[ . 1 . 2]" 1
1800 1 75 TYR HA 1 75 TYR QD . . 4.100 3.094 2.989 3.135 . 0 0 "[ . 1 . 2]" 1
1801 1 75 TYR HA 1 76 CYS H . . 2.910 2.249 2.223 2.260 . 0 0 "[ . 1 . 2]" 1
1802 1 75 TYR HA 1 76 CYS HB3 . . 4.770 4.708 4.644 4.769 . 0 0 "[ . 1 . 2]" 1
1803 1 75 TYR HB2 1 76 CYS H . . 4.790 4.605 4.567 4.629 . 0 0 "[ . 1 . 2]" 1
1804 1 75 TYR HB3 1 76 CYS H . . 4.550 4.397 4.370 4.434 . 0 0 "[ . 1 . 2]" 1
1805 1 75 TYR QD 1 76 CYS H . . 4.450 3.931 3.582 4.258 . 0 0 "[ . 1 . 2]" 1
1806 1 75 TYR QD 1 77 GLN H . . 4.640 4.184 3.719 4.573 . 0 0 "[ . 1 . 2]" 1
1807 1 75 TYR QD 1 77 GLN HG2 . . 4.610 3.600 3.107 4.293 . 0 0 "[ . 1 . 2]" 1
1808 1 75 TYR QD 1 77 GLN QG . . 3.890 2.463 2.169 3.034 . 0 0 "[ . 1 . 2]" 1
1809 1 75 TYR QD 1 77 GLN HG3 . . 4.610 2.512 2.208 3.103 . 0 0 "[ . 1 . 2]" 1
1810 1 75 TYR QE 1 77 GLN HB3 . . 5.150 4.496 4.017 4.755 . 0 0 "[ . 1 . 2]" 1
1811 1 75 TYR QE 1 77 GLN QE . . 4.240 4.171 3.879 4.239 . 0 0 "[ . 1 . 2]" 1
1812 1 75 TYR QE 1 77 GLN HG2 . . 3.950 2.364 2.003 3.295 . 0 0 "[ . 1 . 2]" 1
1813 1 75 TYR QE 1 77 GLN QG . . 3.470 2.136 1.909 2.428 . 0 0 "[ . 1 . 2]" 1
1814 1 75 TYR QE 1 77 GLN HG3 . . 3.950 2.619 2.158 3.370 . 0 0 "[ . 1 . 2]" 1
1815 1 76 CYS H 1 76 CYS HB2 . . 3.640 2.830 2.706 2.932 . 0 0 "[ . 1 . 2]" 1
1816 1 76 CYS H 1 76 CYS HB3 . . 3.360 2.469 2.397 2.530 . 0 0 "[ . 1 . 2]" 1
1817 1 76 CYS H 1 77 GLN H . . 4.850 4.501 4.419 4.568 . 0 0 "[ . 1 . 2]" 1
1818 1 76 CYS HA 1 77 GLN H . . 2.900 2.174 2.142 2.252 . 0 0 "[ . 1 . 2]" 1
1819 1 76 CYS HB3 1 77 GLN H . . 5.030 4.149 3.941 4.316 . 0 0 "[ . 1 . 2]" 1
1820 1 76 CYS HG 1 78 VAL HA . . 4.400 3.601 3.347 4.335 . 0 0 "[ . 1 . 2]" 1
1821 1 76 CYS HG 1 78 VAL MG1 . . 4.250 3.700 3.246 4.187 . 0 0 "[ . 1 . 2]" 1
1822 1 76 CYS HG 1 91 PHE HZ . . 4.430 2.959 2.472 3.835 . 0 0 "[ . 1 . 2]" 1
1823 1 77 GLN H 1 77 GLN HB2 . . 3.530 2.498 2.361 2.610 . 0 0 "[ . 1 . 2]" 1
1824 1 77 GLN H 1 77 GLN HB3 . . 3.890 3.674 3.606 3.732 . 0 0 "[ . 1 . 2]" 1
1825 1 77 GLN H 1 77 GLN QE . . 4.920 3.545 2.849 4.824 . 0 0 "[ . 1 . 2]" 1
1826 1 77 GLN H 1 77 GLN HG2 . . 4.430 4.057 3.803 4.291 . 0 0 "[ . 1 . 2]" 1
1827 1 77 GLN H 1 77 GLN QG . . 3.670 2.748 2.479 3.348 . 0 0 "[ . 1 . 2]" 1
1828 1 77 GLN H 1 77 GLN HG3 . . 4.430 2.800 2.506 3.493 . 0 0 "[ . 1 . 2]" 1
1829 1 77 GLN H 1 78 VAL H . . 5.380 4.339 4.246 4.539 . 0 0 "[ . 1 . 2]" 1
1830 1 77 GLN HA 1 77 GLN QG . . 3.660 2.462 2.308 2.572 . 0 0 "[ . 1 . 2]" 1
1831 1 77 GLN HA 1 78 VAL H . . 3.090 2.144 2.139 2.172 . 0 0 "[ . 1 . 2]" 1
1832 1 77 GLN HA 1 78 VAL HA . . 4.860 4.395 4.360 4.412 . 0 0 "[ . 1 . 2]" 1
1833 1 77 GLN HA 1 78 VAL MG1 . . 4.490 3.884 3.515 4.152 . 0 0 "[ . 1 . 2]" 1
1834 1 77 GLN HA 1 78 VAL MG2 . . 4.480 3.639 3.429 4.061 . 0 0 "[ . 1 . 2]" 1
1835 1 77 GLN HB2 1 78 VAL H . . 5.370 4.327 4.168 4.434 . 0 0 "[ . 1 . 2]" 1
1836 1 77 GLN HB2 1 79 GLY H . . 5.470 4.477 3.375 4.928 . 0 0 "[ . 1 . 2]" 1
1837 1 77 GLN HB3 1 78 VAL H . . 4.500 3.524 3.156 3.629 . 0 0 "[ . 1 . 2]" 1
1838 1 77 GLN HB3 1 79 GLY H . . 4.710 3.357 2.820 3.697 . 0 0 "[ . 1 . 2]" 1
1839 1 77 GLN QG 1 78 VAL H . . 5.080 4.222 4.014 4.336 . 0 0 "[ . 1 . 2]" 1
1840 1 78 VAL H 1 78 VAL HB . . 4.100 3.617 3.593 3.673 . 0 0 "[ . 1 . 2]" 1
1841 1 78 VAL H 1 78 VAL MG1 . . 3.380 2.277 2.002 2.497 . 0 0 "[ . 1 . 2]" 1
1842 1 78 VAL H 1 78 VAL MG2 . . 3.210 2.051 1.907 2.328 . 0 0 "[ . 1 . 2]" 1
1843 1 78 VAL H 1 79 GLY H . . 3.600 2.859 2.643 3.081 . 0 0 "[ . 1 . 2]" 1
1844 1 78 VAL HA 1 78 VAL MG1 . . 3.270 2.274 2.096 2.431 . 0 0 "[ . 1 . 2]" 1
1845 1 78 VAL HA 1 83 TYR QD . . 5.500 4.905 4.328 5.471 . 0 0 "[ . 1 . 2]" 1
1846 1 78 VAL HA 1 83 TYR QE . . 4.880 3.750 3.149 4.062 . 0 0 "[ . 1 . 2]" 1
1847 1 78 VAL HA 1 91 PHE QE . . 3.810 2.818 2.261 3.182 . 0 0 "[ . 1 . 2]" 1
1848 1 78 VAL HA 1 91 PHE HZ . . 3.940 2.700 2.342 2.983 . 0 0 "[ . 1 . 2]" 1
1849 1 78 VAL HB 1 79 GLY H . . 4.800 3.562 3.176 4.488 . 0 0 "[ . 1 . 2]" 1
1850 1 78 VAL HB 1 83 TYR QD . . 4.440 3.414 2.563 4.023 . 0 0 "[ . 1 . 2]" 1
1851 1 78 VAL HB 1 83 TYR QE . . 4.290 3.120 2.216 3.791 . 0 0 "[ . 1 . 2]" 1
1852 1 78 VAL HB 1 84 TRP HE3 . . 4.450 2.924 2.623 3.250 . 0 0 "[ . 1 . 2]" 1
1853 1 78 VAL HB 1 84 TRP HZ3 . . 5.110 4.371 3.838 4.966 . 0 0 "[ . 1 . 2]" 1
1854 1 78 VAL HB 1 91 PHE QE . . 4.560 3.843 3.176 4.342 . 0 0 "[ . 1 . 2]" 1
1855 1 78 VAL MG1 1 79 GLY H . . 4.630 3.901 3.719 4.279 . 0 0 "[ . 1 . 2]" 1
1856 1 78 VAL MG1 1 84 TRP HE3 . . 4.450 3.029 2.397 3.900 . 0 0 "[ . 1 . 2]" 1
1857 1 78 VAL MG1 1 84 TRP HZ3 . . 4.600 3.294 2.906 4.247 . 0 0 "[ . 1 . 2]" 1
1858 1 78 VAL MG1 1 91 PHE HB3 . . 5.000 3.635 3.176 3.994 . 0 0 "[ . 1 . 2]" 1
1859 1 78 VAL MG1 1 91 PHE QD . . 4.520 3.311 2.834 3.622 . 0 0 "[ . 1 . 2]" 1
1860 1 78 VAL MG1 1 91 PHE QE . . 4.220 3.396 3.001 3.697 . 0 0 "[ . 1 . 2]" 1
1861 1 78 VAL MG1 1 91 PHE HZ . . 4.720 3.927 3.538 4.312 . 0 0 "[ . 1 . 2]" 1
1862 1 78 VAL MG1 1 100 VAL MG1 . . 3.620 2.164 1.885 2.423 . 0 0 "[ . 1 . 2]" 1
1863 1 78 VAL MG1 1 100 VAL MG2 . . 3.880 3.549 3.247 3.799 . 0 0 "[ . 1 . 2]" 1
1864 1 78 VAL MG2 1 79 GLY H . . 3.570 1.937 1.758 3.563 . 0 0 "[ . 1 . 2]" 1
1865 1 78 VAL MG2 1 79 GLY QA . . 4.660 3.308 3.089 3.904 . 0 0 "[ . 1 . 2]" 1
1866 1 78 VAL MG2 1 83 TYR QD . . 3.700 3.240 2.742 3.705 0.005 11 0 "[ . 1 . 2]" 1
1867 1 78 VAL MG2 1 84 TRP HA . . 4.910 3.400 3.053 3.641 . 0 0 "[ . 1 . 2]" 1
1868 1 78 VAL MG2 1 84 TRP HB2 . . 3.950 2.249 1.908 2.634 . 0 0 "[ . 1 . 2]" 1
1869 1 78 VAL MG2 1 84 TRP HB3 . . 4.380 3.681 3.109 4.051 . 0 0 "[ . 1 . 2]" 1
1870 1 78 VAL MG2 1 84 TRP HE3 . . 4.000 3.361 2.933 3.885 . 0 0 "[ . 1 . 2]" 1
1871 1 78 VAL MG2 1 100 VAL MG1 . . 3.330 2.895 2.392 3.324 . 0 0 "[ . 1 . 2]" 1
1872 1 78 VAL MG2 1 100 VAL MG2 . . 3.890 3.034 2.702 3.404 . 0 0 "[ . 1 . 2]" 1
1873 1 79 GLY H 1 80 ASP H . . 4.680 4.104 2.833 4.617 . 0 0 "[ . 1 . 2]" 1
1874 1 79 GLY H 1 83 TYR QE . . 5.070 4.751 4.202 5.047 . 0 0 "[ . 1 . 2]" 1
1875 1 79 GLY QA 1 83 TYR QD . . 5.340 2.758 2.236 3.180 . 0 0 "[ . 1 . 2]" 1
1876 1 80 ASP H 1 80 ASP HB2 . . 4.170 2.774 2.584 3.177 . 0 0 "[ . 1 . 2]" 1
1877 1 80 ASP H 1 80 ASP QB . . 3.620 2.697 2.535 3.065 . 0 0 "[ . 1 . 2]" 1
1878 1 80 ASP H 1 80 ASP HB3 . . 4.170 3.691 3.541 4.027 . 0 0 "[ . 1 . 2]" 1
1879 1 80 ASP H 1 81 LYS H . . 5.060 4.532 4.374 4.629 . 0 0 "[ . 1 . 2]" 1
1880 1 80 ASP H 1 83 TYR HB2 . . 3.960 3.009 2.122 3.899 . 0 0 "[ . 1 . 2]" 1
1881 1 80 ASP H 1 83 TYR HB3 . . 3.960 2.095 1.890 2.483 . 0 0 "[ . 1 . 2]" 1
1882 1 80 ASP H 1 83 TYR QD . . 4.550 3.160 2.285 3.670 . 0 0 "[ . 1 . 2]" 1
1883 1 80 ASP HA 1 81 LYS H . . 3.420 2.501 2.403 2.632 . 0 0 "[ . 1 . 2]" 1
1884 1 80 ASP QB 1 81 LYS HA . . 4.910 4.407 4.320 4.482 . 0 0 "[ . 1 . 2]" 1
1885 1 80 ASP QB 1 82 PRO QD . . 3.300 2.157 1.955 2.245 . 0 0 "[ . 1 . 2]" 1
1886 1 80 ASP QB 1 82 PRO QG . . 4.480 2.694 2.349 2.835 . 0 0 "[ . 1 . 2]" 1
1887 1 80 ASP HB2 1 81 LYS H . . 3.390 3.191 3.006 3.346 . 0 0 "[ . 1 . 2]" 1
1888 1 80 ASP HB2 1 82 PRO HD2 . . 4.490 2.537 2.150 2.755 . 0 0 "[ . 1 . 2]" 1
1889 1 80 ASP HB2 1 82 PRO HD3 . . 4.490 4.276 3.852 4.506 0.016 9 0 "[ . 1 . 2]" 1
1890 1 80 ASP HB3 1 81 LYS H . . 3.390 2.350 2.065 2.563 . 0 0 "[ . 1 . 2]" 1
1891 1 80 ASP HB3 1 82 PRO HD2 . . 4.490 2.377 2.121 2.497 . 0 0 "[ . 1 . 2]" 1
1892 1 80 ASP HB3 1 82 PRO HD3 . . 4.490 3.970 3.604 4.119 . 0 0 "[ . 1 . 2]" 1
1893 1 81 LYS H 1 81 LYS HB2 . . 3.360 2.820 2.124 2.987 . 0 0 "[ . 1 . 2]" 1
1894 1 81 LYS H 1 81 LYS HB3 . . 3.420 2.302 2.157 3.035 . 0 0 "[ . 1 . 2]" 1
1895 1 81 LYS H 1 81 LYS QD . . 4.870 4.458 3.991 4.694 . 0 0 "[ . 1 . 2]" 1
1896 1 81 LYS H 1 81 LYS QG . . 4.670 3.785 3.750 3.807 . 0 0 "[ . 1 . 2]" 1
1897 1 81 LYS H 1 82 PRO HD2 . . 3.560 2.059 1.944 2.121 . 0 0 "[ . 1 . 2]" 1
1898 1 81 LYS H 1 82 PRO HD3 . . 3.560 3.089 2.955 3.156 . 0 0 "[ . 1 . 2]" 1
1899 1 81 LYS H 1 82 PRO QG . . 4.740 3.967 3.864 4.021 . 0 0 "[ . 1 . 2]" 1
1900 1 81 LYS H 1 84 TRP H . . 5.500 4.916 4.718 5.151 . 0 0 "[ . 1 . 2]" 1
1901 1 81 LYS HA 1 81 LYS QD . . 4.040 3.874 3.680 4.038 . 0 0 "[ . 1 . 2]" 1
1902 1 81 LYS HA 1 81 LYS HG2 . . 4.060 3.582 3.058 3.744 . 0 0 "[ . 1 . 2]" 1
1903 1 81 LYS HA 1 81 LYS QG . . 3.560 2.665 2.105 2.774 . 0 0 "[ . 1 . 2]" 1
1904 1 81 LYS HA 1 81 LYS HG3 . . 4.060 2.752 2.142 2.889 . 0 0 "[ . 1 . 2]" 1
1905 1 81 LYS HA 1 83 TYR H . . 4.340 3.974 3.774 4.316 . 0 0 "[ . 1 . 2]" 1
1906 1 81 LYS HA 1 84 TRP H . . 4.160 3.833 3.654 3.960 . 0 0 "[ . 1 . 2]" 1
1907 1 81 LYS HA 1 84 TRP HB2 . . 4.640 4.408 4.020 4.642 0.002 15 0 "[ . 1 . 2]" 1
1908 1 81 LYS HA 1 84 TRP HB3 . . 3.900 3.571 3.139 3.878 . 0 0 "[ . 1 . 2]" 1
1909 1 81 LYS HA 1 84 TRP HD1 . . 5.460 4.864 4.136 5.309 . 0 0 "[ . 1 . 2]" 1
1910 1 81 LYS HA 1 85 LYS H . . 5.330 5.069 4.405 5.330 0.000 9 0 "[ . 1 . 2]" 1
1911 1 81 LYS HB2 1 81 LYS QD . . 3.580 2.158 2.080 2.255 . 0 0 "[ . 1 . 2]" 1
1912 1 81 LYS HB2 1 82 PRO HD2 . . 4.170 3.842 3.200 3.968 . 0 0 "[ . 1 . 2]" 1
1913 1 81 LYS HB2 1 82 PRO QD . . 3.540 3.216 2.678 3.322 . 0 0 "[ . 1 . 2]" 1
1914 1 81 LYS HB2 1 82 PRO HD3 . . 4.170 3.451 2.872 3.564 . 0 0 "[ . 1 . 2]" 1
1915 1 81 LYS HB3 1 81 LYS QD . . 3.370 2.771 2.534 3.081 . 0 0 "[ . 1 . 2]" 1
1916 1 81 LYS HB3 1 82 PRO HD2 . . 3.640 2.559 2.470 2.973 . 0 0 "[ . 1 . 2]" 1
1917 1 81 LYS HB3 1 82 PRO QD . . 3.070 1.894 1.885 1.911 . 0 0 "[ . 1 . 2]" 1
1918 1 81 LYS HB3 1 82 PRO HD3 . . 3.640 1.957 1.915 1.982 . 0 0 "[ . 1 . 2]" 1
1919 1 81 LYS HB3 1 82 PRO QG . . 5.110 3.870 3.853 3.912 . 0 0 "[ . 1 . 2]" 1
1920 1 81 LYS QD 1 82 PRO QD . . 4.810 3.541 2.954 4.246 . 0 0 "[ . 1 . 2]" 1
1921 1 81 LYS QG 1 82 PRO HA . . 4.840 3.289 2.993 4.603 . 0 0 "[ . 1 . 2]" 1
1922 1 81 LYS QG 1 82 PRO QD . . 4.300 2.223 1.961 3.690 . 0 0 "[ . 1 . 2]" 1
1923 1 81 LYS QG 1 85 LYS QE . . 3.300 2.939 2.123 3.323 0.023 15 0 "[ . 1 . 2]" 1
1924 1 82 PRO HA 1 85 LYS H . . 4.200 3.795 3.582 4.147 . 0 0 "[ . 1 . 2]" 1
1925 1 82 PRO HA 1 85 LYS HB2 . . 3.830 3.501 3.090 3.805 . 0 0 "[ . 1 . 2]" 1
1926 1 82 PRO HA 1 85 LYS QE . . 4.510 3.071 1.960 4.489 . 0 0 "[ . 1 . 2]" 1
1927 1 82 PRO HA 1 85 LYS QG . . 5.340 3.268 2.198 4.287 . 0 0 "[ . 1 . 2]" 1
1928 1 82 PRO HB2 1 83 TYR H . . 4.070 3.718 3.454 3.853 . 0 0 "[ . 1 . 2]" 1
1929 1 82 PRO HB2 1 83 TYR HA . . 4.820 4.236 4.123 4.301 . 0 0 "[ . 1 . 2]" 1
1930 1 82 PRO HB3 1 83 TYR H . . 4.660 4.363 4.210 4.440 . 0 0 "[ . 1 . 2]" 1
1931 1 82 PRO QD 1 83 TYR H . . 3.680 2.739 2.615 2.827 . 0 0 "[ . 1 . 2]" 1
1932 1 82 PRO QG 1 83 TYR H . . 3.750 2.876 2.499 3.080 . 0 0 "[ . 1 . 2]" 1
1933 1 83 TYR H 1 83 TYR HB2 . . 3.210 2.847 2.750 3.009 . 0 0 "[ . 1 . 2]" 1
1934 1 83 TYR H 1 83 TYR HB3 . . 3.210 2.351 2.233 2.454 . 0 0 "[ . 1 . 2]" 1
1935 1 83 TYR H 1 83 TYR QD . . 4.260 4.085 3.958 4.196 . 0 0 "[ . 1 . 2]" 1
1936 1 83 TYR H 1 84 TRP H . . 3.260 2.413 2.273 2.615 . 0 0 "[ . 1 . 2]" 1
1937 1 83 TYR H 1 85 LYS H . . 4.600 4.083 3.819 4.330 . 0 0 "[ . 1 . 2]" 1
1938 1 83 TYR HA 1 83 TYR QD . . 3.640 3.142 2.908 3.256 . 0 0 "[ . 1 . 2]" 1
1939 1 83 TYR HA 1 86 ASP H . . 4.710 3.591 3.419 4.321 . 0 0 "[ . 1 . 2]" 1
1940 1 83 TYR HA 1 86 ASP HB2 . . 4.480 4.135 3.789 4.405 . 0 0 "[ . 1 . 2]" 1
1941 1 83 TYR HA 1 86 ASP HB3 . . 4.910 4.854 4.788 4.923 0.013 15 0 "[ . 1 . 2]" 1
1942 1 83 TYR QB 1 84 TRP H . . 3.520 2.657 2.304 2.825 . 0 0 "[ . 1 . 2]" 1
1943 1 83 TYR QD 1 84 TRP H . . 3.770 2.992 2.437 3.278 . 0 0 "[ . 1 . 2]" 1
1944 1 83 TYR QD 1 84 TRP HB2 . . 4.630 3.679 3.117 3.947 . 0 0 "[ . 1 . 2]" 1
1945 1 83 TYR QE 1 84 TRP HA . . 4.640 3.903 3.308 4.228 . 0 0 "[ . 1 . 2]" 1
1946 1 83 TYR QE 1 89 ASN QB . . 4.270 3.821 3.316 4.135 . 0 0 "[ . 1 . 2]" 1
1947 1 83 TYR QE 1 90 ASP H . . 5.500 5.276 5.022 5.499 . 0 0 "[ . 1 . 2]" 1
1948 1 83 TYR QE 1 91 PHE H . . 5.500 5.321 4.917 5.503 0.003 12 0 "[ . 1 . 2]" 1
1949 1 83 TYR QE 1 91 PHE QD . . 3.450 3.103 2.328 3.442 . 0 0 "[ . 1 . 2]" 1
1950 1 83 TYR QE 1 91 PHE QE . . 3.750 2.669 2.097 3.200 . 0 0 "[ . 1 . 2]" 1
1951 1 84 TRP H 1 84 TRP HB2 . . 3.260 2.768 2.609 2.878 . 0 0 "[ . 1 . 2]" 1
1952 1 84 TRP H 1 84 TRP HB3 . . 3.720 2.317 2.248 2.467 . 0 0 "[ . 1 . 2]" 1
1953 1 84 TRP H 1 85 LYS H . . 3.520 2.769 2.534 2.897 . 0 0 "[ . 1 . 2]" 1
1954 1 84 TRP H 1 89 ASN QD . . 4.990 4.389 3.805 4.993 0.003 5 0 "[ . 1 . 2]" 1
1955 1 84 TRP HA 1 84 TRP HE3 . . 3.460 2.139 2.001 2.384 . 0 0 "[ . 1 . 2]" 1
1956 1 84 TRP HA 1 84 TRP HZ3 . . 4.710 4.514 4.373 4.737 0.027 12 0 "[ . 1 . 2]" 1
1957 1 84 TRP HA 1 86 ASP HB2 . . 4.720 4.480 4.352 4.716 . 0 0 "[ . 1 . 2]" 1
1958 1 84 TRP HA 1 89 ASN QD . . 3.890 2.655 2.011 2.890 . 0 0 "[ . 1 . 2]" 1
1959 1 84 TRP HB2 1 85 LYS H . . 4.490 4.003 3.896 4.223 . 0 0 "[ . 1 . 2]" 1
1960 1 84 TRP HB3 1 84 TRP HD1 . . 3.880 2.558 2.547 2.574 . 0 0 "[ . 1 . 2]" 1
1961 1 84 TRP HB3 1 85 LYS H . . 3.650 2.675 2.503 3.040 . 0 0 "[ . 1 . 2]" 1
1962 1 84 TRP HD1 1 85 LYS H . . 4.390 4.000 3.454 4.391 0.001 1 0 "[ . 1 . 2]" 1
1963 1 84 TRP HD1 1 85 LYS HA . . 4.800 4.357 3.949 4.556 . 0 0 "[ . 1 . 2]" 1
1964 1 84 TRP HD1 1 85 LYS QE . . 5.110 4.584 3.478 5.027 . 0 0 "[ . 1 . 2]" 1
1965 1 84 TRP HD1 1 85 LYS HG2 . . 4.930 4.388 3.236 4.898 . 0 0 "[ . 1 . 2]" 1
1966 1 84 TRP HD1 1 85 LYS QG . . 4.210 3.665 3.195 3.917 . 0 0 "[ . 1 . 2]" 1
1967 1 84 TRP HD1 1 85 LYS HG3 . . 4.930 4.203 3.594 4.939 0.009 12 0 "[ . 1 . 2]" 1
1968 1 84 TRP HD1 1 100 VAL MG2 . . 4.100 3.122 2.853 3.379 . 0 0 "[ . 1 . 2]" 1
1969 1 84 TRP HE1 1 99 ALA HA . . 3.790 3.555 3.296 3.757 . 0 0 "[ . 1 . 2]" 1
1970 1 84 TRP HE1 1 99 ALA MB . . 4.480 4.132 3.952 4.415 . 0 0 "[ . 1 . 2]" 1
1971 1 84 TRP HE1 1 100 VAL H . . 3.810 2.967 2.742 3.253 . 0 0 "[ . 1 . 2]" 1
1972 1 84 TRP HE1 1 100 VAL MG1 . . 4.670 3.706 3.360 4.102 . 0 0 "[ . 1 . 2]" 1
1973 1 84 TRP HE1 1 100 VAL MG2 . . 3.750 2.608 2.225 3.287 . 0 0 "[ . 1 . 2]" 1
1974 1 84 TRP HE3 1 89 ASN QD . . 4.640 2.920 2.537 3.195 . 0 0 "[ . 1 . 2]" 1
1975 1 84 TRP HE3 1 92 ARG HG3 . . 5.500 4.398 4.097 4.734 . 0 0 "[ . 1 . 2]" 1
1976 1 84 TRP HH2 1 91 PHE HB2 . . 5.030 4.706 4.374 5.017 . 0 0 "[ . 1 . 2]" 1
1977 1 84 TRP HH2 1 91 PHE HB3 . . 4.680 4.316 4.006 4.571 . 0 0 "[ . 1 . 2]" 1
1978 1 84 TRP HH2 1 92 ARG HE . . 4.940 3.825 3.009 4.470 . 0 0 "[ . 1 . 2]" 1
1979 1 84 TRP HH2 1 92 ARG HG2 . . 4.780 2.905 2.544 3.543 . 0 0 "[ . 1 . 2]" 1
1980 1 84 TRP HH2 1 92 ARG HG3 . . 4.750 3.570 3.283 3.941 . 0 0 "[ . 1 . 2]" 1
1981 1 84 TRP HH2 1 97 ILE HB . . 4.120 2.105 2.008 2.269 . 0 0 "[ . 1 . 2]" 1
1982 1 84 TRP HH2 1 97 ILE MD . . 4.920 4.547 4.240 4.769 . 0 0 "[ . 1 . 2]" 1
1983 1 84 TRP HH2 1 97 ILE HG12 . . 4.830 4.462 4.272 4.730 . 0 0 "[ . 1 . 2]" 1
1984 1 84 TRP HH2 1 97 ILE MG . . 3.340 2.079 1.898 2.295 . 0 0 "[ . 1 . 2]" 1
1985 1 84 TRP HH2 1 98 THR HA . . 5.080 4.854 4.305 5.065 . 0 0 "[ . 1 . 2]" 1
1986 1 84 TRP HH2 1 99 ALA H . . 5.160 4.753 4.363 4.988 . 0 0 "[ . 1 . 2]" 1
1987 1 84 TRP HH2 1 100 VAL MG1 . . 4.720 3.135 2.754 3.568 . 0 0 "[ . 1 . 2]" 1
1988 1 84 TRP HZ2 1 97 ILE MG . . 4.190 3.080 2.882 3.238 . 0 0 "[ . 1 . 2]" 1
1989 1 84 TRP HZ2 1 98 THR HA . . 5.370 5.040 4.488 5.226 . 0 0 "[ . 1 . 2]" 1
1990 1 84 TRP HZ2 1 99 ALA H . . 4.310 4.225 4.096 4.311 0.001 18 0 "[ . 1 . 2]" 1
1991 1 84 TRP HZ2 1 99 ALA HA . . 3.490 2.081 1.998 2.191 . 0 0 "[ . 1 . 2]" 1
1992 1 84 TRP HZ2 1 99 ALA MB . . 4.340 3.740 3.636 3.868 . 0 0 "[ . 1 . 2]" 1
1993 1 84 TRP HZ2 1 100 VAL H . . 4.050 2.507 2.193 3.088 . 0 0 "[ . 1 . 2]" 1
1994 1 84 TRP HZ2 1 100 VAL MG1 . . 3.950 2.951 2.457 3.390 . 0 0 "[ . 1 . 2]" 1
1995 1 84 TRP HZ2 1 100 VAL MG2 . . 4.840 3.607 3.236 4.388 . 0 0 "[ . 1 . 2]" 1
1996 1 84 TRP HZ3 1 91 PHE H . . 5.210 4.964 4.514 5.110 . 0 0 "[ . 1 . 2]" 1
1997 1 84 TRP HZ3 1 91 PHE HB2 . . 4.080 2.660 2.279 2.848 . 0 0 "[ . 1 . 2]" 1
1998 1 84 TRP HZ3 1 91 PHE HB3 . . 4.120 2.862 2.172 3.373 . 0 0 "[ . 1 . 2]" 1
1999 1 84 TRP HZ3 1 97 ILE MG . . 4.400 3.466 3.046 3.695 . 0 0 "[ . 1 . 2]" 1
2000 1 85 LYS H 1 85 LYS HB2 . . 3.070 2.535 2.278 3.000 . 0 0 "[ . 1 . 2]" 1
2001 1 85 LYS H 1 85 LYS QE . . 4.360 3.946 3.305 4.314 . 0 0 "[ . 1 . 2]" 1
2002 1 85 LYS H 1 85 LYS HG2 . . 4.220 3.216 1.884 4.117 . 0 0 "[ . 1 . 2]" 1
2003 1 85 LYS H 1 85 LYS QG . . 3.510 2.196 1.799 3.303 . 0 0 "[ . 1 . 2]" 1
2004 1 85 LYS H 1 85 LYS HG3 . . 4.220 2.423 1.904 3.479 . 0 0 "[ . 1 . 2]" 1
2005 1 85 LYS H 1 86 ASP H . . 3.550 2.815 2.648 2.941 . 0 0 "[ . 1 . 2]" 1
2006 1 85 LYS HA 1 85 LYS HG2 . . 4.100 2.690 2.441 3.536 . 0 0 "[ . 1 . 2]" 1
2007 1 85 LYS HA 1 85 LYS QG . . 3.500 2.477 2.276 2.780 . 0 0 "[ . 1 . 2]" 1
2008 1 85 LYS HA 1 85 LYS HG3 . . 4.100 3.067 2.304 3.851 . 0 0 "[ . 1 . 2]" 1
2009 1 85 LYS HB2 1 85 LYS QE . . 4.600 3.714 2.362 4.178 . 0 0 "[ . 1 . 2]" 1
2010 1 85 LYS HB2 1 86 ASP H . . 4.590 2.768 2.518 4.026 . 0 0 "[ . 1 . 2]" 1
2011 1 85 LYS HB3 1 85 LYS QE . . 5.130 3.933 3.093 4.271 . 0 0 "[ . 1 . 2]" 1
2012 1 85 LYS HB3 1 86 ASP H . . 4.690 3.712 3.418 4.384 . 0 0 "[ . 1 . 2]" 1
2013 1 85 LYS QE 1 85 LYS QG . . 3.240 2.119 2.047 2.172 . 0 0 "[ . 1 . 2]" 1
2014 1 86 ASP H 1 86 ASP HB2 . . 3.720 2.783 2.412 2.951 . 0 0 "[ . 1 . 2]" 1
2015 1 86 ASP H 1 86 ASP HB3 . . 3.680 3.585 3.538 3.641 . 0 0 "[ . 1 . 2]" 1
2016 1 86 ASP HA 1 87 PRO HD2 . . 3.180 1.918 1.912 1.954 . 0 0 "[ . 1 . 2]" 1
2017 1 86 ASP HA 1 87 PRO HD3 . . 3.180 2.480 2.350 2.567 . 0 0 "[ . 1 . 2]" 1
2018 1 86 ASP HA 1 87 PRO HG2 . . 4.580 4.121 4.115 4.155 . 0 0 "[ . 1 . 2]" 1
2019 1 86 ASP HA 1 87 PRO HG3 . . 4.580 4.374 4.322 4.419 . 0 0 "[ . 1 . 2]" 1
2020 1 86 ASP HA 1 88 ASN H . . 4.180 3.349 3.259 3.524 . 0 0 "[ . 1 . 2]" 1
2021 1 86 ASP HB2 1 87 PRO QD . . 5.060 4.249 4.149 4.309 . 0 0 "[ . 1 . 2]" 1
2022 1 86 ASP HB2 1 88 ASN H . . 4.670 3.925 3.683 4.098 . 0 0 "[ . 1 . 2]" 1
2023 1 86 ASP HB2 1 89 ASN H . . 4.170 4.028 3.806 4.155 . 0 0 "[ . 1 . 2]" 1
2024 1 86 ASP HB2 1 89 ASN QB . . 4.000 3.293 2.318 3.698 . 0 0 "[ . 1 . 2]" 1
2025 1 86 ASP HB2 1 89 ASN QD . . 4.120 2.181 1.951 2.632 . 0 0 "[ . 1 . 2]" 1
2026 1 86 ASP HB3 1 87 PRO QD . . 4.690 3.453 3.205 3.599 . 0 0 "[ . 1 . 2]" 1
2027 1 86 ASP HB3 1 88 ASN H . . 3.540 3.050 2.661 3.205 . 0 0 "[ . 1 . 2]" 1
2028 1 86 ASP HB3 1 89 ASN H . . 5.170 4.157 3.775 4.487 . 0 0 "[ . 1 . 2]" 1
2029 1 86 ASP HB3 1 89 ASN QB . . 4.920 4.213 3.020 4.739 . 0 0 "[ . 1 . 2]" 1
2030 1 86 ASP HB3 1 89 ASN QD . . 4.870 3.695 3.398 4.137 . 0 0 "[ . 1 . 2]" 1
2031 1 87 PRO HA 1 89 ASN H . . 4.230 3.567 3.465 3.781 . 0 0 "[ . 1 . 2]" 1
2032 1 87 PRO HA 1 92 ARG HB2 . . 4.680 3.560 3.012 3.821 . 0 0 "[ . 1 . 2]" 1
2033 1 87 PRO HA 1 92 ARG HD2 . . 3.530 2.555 1.997 2.867 . 0 0 "[ . 1 . 2]" 1
2034 1 87 PRO HA 1 92 ARG HD3 . . 3.760 2.155 1.999 2.709 . 0 0 "[ . 1 . 2]" 1
2035 1 87 PRO HA 1 92 ARG HE . . 4.520 3.958 3.709 4.491 . 0 0 "[ . 1 . 2]" 1
2036 1 87 PRO QB 1 88 ASN H . . 3.980 3.571 3.389 3.629 . 0 0 "[ . 1 . 2]" 1
2037 1 87 PRO QB 1 88 ASN QD . . 5.180 4.118 3.220 4.894 . 0 0 "[ . 1 . 2]" 1
2038 1 87 PRO QB 1 89 ASN H . . 5.340 4.696 4.536 4.891 . 0 0 "[ . 1 . 2]" 1
2039 1 87 PRO HB2 1 92 ARG HD2 . . 5.500 5.171 4.488 5.473 . 0 0 "[ . 1 . 2]" 1
2040 1 87 PRO HB2 1 92 ARG HD3 . . 5.500 4.470 4.244 4.947 . 0 0 "[ . 1 . 2]" 1
2041 1 87 PRO HB3 1 92 ARG HD2 . . 5.500 4.760 4.177 5.101 . 0 0 "[ . 1 . 2]" 1
2042 1 87 PRO HB3 1 92 ARG HD3 . . 5.500 3.903 3.420 4.196 . 0 0 "[ . 1 . 2]" 1
2043 1 87 PRO QD 1 88 ASN H . . 3.630 2.770 2.642 2.825 . 0 0 "[ . 1 . 2]" 1
2044 1 87 PRO QD 1 88 ASN QD . . 4.400 3.252 2.409 4.215 . 0 0 "[ . 1 . 2]" 1
2045 1 87 PRO HD2 1 88 ASN H . . 4.130 2.830 2.690 2.891 . 0 0 "[ . 1 . 2]" 1
2046 1 87 PRO HD3 1 88 ASN H . . 4.130 3.940 3.865 3.971 . 0 0 "[ . 1 . 2]" 1
2047 1 87 PRO HG2 1 88 ASN H . . 3.540 3.015 2.667 3.135 . 0 0 "[ . 1 . 2]" 1
2048 1 87 PRO HG2 1 88 ASN HD21 . . 4.760 3.231 1.939 4.719 . 0 0 "[ . 1 . 2]" 1
2049 1 87 PRO HG2 1 88 ASN HD22 . . 4.760 3.360 2.278 4.736 . 0 0 "[ . 1 . 2]" 1
2050 1 87 PRO HG2 1 89 ASN H . . 5.500 5.366 5.194 5.507 0.007 15 0 "[ . 1 . 2]" 1
2051 1 87 PRO HG3 1 88 ASN H . . 4.440 4.365 4.103 4.456 0.016 11 0 "[ . 1 . 2]" 1
2052 1 88 ASN H 1 88 ASN HB2 . . 3.770 2.962 2.351 3.694 . 0 0 "[ . 1 . 2]" 1
2053 1 88 ASN H 1 88 ASN QB . . 3.180 2.666 2.322 3.007 . 0 0 "[ . 1 . 2]" 1
2054 1 88 ASN H 1 88 ASN HB3 . . 3.770 3.464 2.871 3.754 . 0 0 "[ . 1 . 2]" 1
2055 1 88 ASN H 1 88 ASN HD21 . . 4.710 3.037 1.980 4.260 . 0 0 "[ . 1 . 2]" 1
2056 1 88 ASN H 1 88 ASN QD . . 3.910 2.881 1.955 3.869 . 0 0 "[ . 1 . 2]" 1
2057 1 88 ASN H 1 88 ASN HD22 . . 4.710 3.737 2.843 4.439 . 0 0 "[ . 1 . 2]" 1
2058 1 88 ASN H 1 89 ASN H . . 3.040 2.713 2.558 2.905 . 0 0 "[ . 1 . 2]" 1
2059 1 88 ASN H 1 89 ASN HA . . 4.930 4.682 4.565 4.816 . 0 0 "[ . 1 . 2]" 1
2060 1 88 ASN HA 1 93 GLN HB2 . . 5.500 5.397 5.269 5.469 . 0 0 "[ . 1 . 2]" 1
2061 1 88 ASN HA 1 93 GLN HB3 . . 5.500 5.464 5.317 5.506 0.006 3 0 "[ . 1 . 2]" 1
2062 1 88 ASN HA 1 93 GLN HE21 . . 3.830 2.938 2.142 3.607 . 0 0 "[ . 1 . 2]" 1
2063 1 88 ASN HA 1 93 GLN HE22 . . 4.340 3.512 2.920 3.906 . 0 0 "[ . 1 . 2]" 1
2064 1 88 ASN HA 1 93 GLN HG2 . . 3.690 3.309 3.032 3.614 . 0 0 "[ . 1 . 2]" 1
2065 1 88 ASN HA 1 93 GLN HG3 . . 3.590 3.248 3.117 3.412 . 0 0 "[ . 1 . 2]" 1
2066 1 88 ASN QB 1 88 ASN QD . . 2.930 2.169 2.062 2.496 . 0 0 "[ . 1 . 2]" 1
2067 1 88 ASN QB 1 93 GLN HE22 . . 5.210 4.850 4.016 5.178 . 0 0 "[ . 1 . 2]" 1
2068 1 88 ASN QB 1 93 GLN HG2 . . 5.340 4.903 4.499 5.245 . 0 0 "[ . 1 . 2]" 1
2069 1 88 ASN QB 1 93 GLN HG3 . . 4.700 4.219 3.950 4.483 . 0 0 "[ . 1 . 2]" 1
2070 1 89 ASN H 1 89 ASN HB2 . . 3.750 2.501 2.198 3.621 . 0 0 "[ . 1 . 2]" 1
2071 1 89 ASN H 1 89 ASN QB . . 3.100 2.329 2.176 2.866 . 0 0 "[ . 1 . 2]" 1
2072 1 89 ASN H 1 89 ASN HB3 . . 3.750 3.404 2.905 3.552 . 0 0 "[ . 1 . 2]" 1
2073 1 89 ASN H 1 89 ASN QD . . 4.060 3.910 3.507 4.071 0.011 8 0 "[ . 1 . 2]" 1
2074 1 89 ASN H 1 90 ASP H . . 4.620 4.590 4.564 4.602 . 0 0 "[ . 1 . 2]" 1
2075 1 89 ASN H 1 90 ASP HA . . 5.500 5.493 5.469 5.511 0.011 14 0 "[ . 1 . 2]" 1
2076 1 89 ASN H 1 92 ARG HB2 . . 4.570 3.377 3.046 3.690 . 0 0 "[ . 1 . 2]" 1
2077 1 89 ASN H 1 92 ARG HD2 . . 5.080 3.124 2.866 3.417 . 0 0 "[ . 1 . 2]" 1
2078 1 89 ASN H 1 92 ARG HE . . 5.500 5.220 4.941 5.498 . 0 0 "[ . 1 . 2]" 1
2079 1 89 ASN H 1 92 ARG HG3 . . 5.120 4.408 4.192 4.782 . 0 0 "[ . 1 . 2]" 1
2080 1 89 ASN HA 1 90 ASP H . . 3.170 2.307 2.204 2.427 . 0 0 "[ . 1 . 2]" 1
2081 1 89 ASN HA 1 90 ASP HA . . 4.430 4.309 4.302 4.318 . 0 0 "[ . 1 . 2]" 1
2082 1 89 ASN HA 1 90 ASP QB . . 4.870 4.572 4.355 4.682 . 0 0 "[ . 1 . 2]" 1
2083 1 89 ASN QB 1 91 PHE H . . 3.900 2.220 2.130 2.409 . 0 0 "[ . 1 . 2]" 1
2084 1 89 ASN QD 1 92 ARG HE . . 4.490 3.391 2.181 4.211 . 0 0 "[ . 1 . 2]" 1
2085 1 89 ASN QD 1 92 ARG HG3 . . 5.020 3.874 2.419 4.634 . 0 0 "[ . 1 . 2]" 1
2086 1 90 ASP H 1 90 ASP HB2 . . 4.200 2.772 2.271 3.532 . 0 0 "[ . 1 . 2]" 1
2087 1 90 ASP H 1 90 ASP QB . . 3.540 2.524 2.246 2.837 . 0 0 "[ . 1 . 2]" 1
2088 1 90 ASP H 1 90 ASP HB3 . . 4.200 3.385 2.881 3.598 . 0 0 "[ . 1 . 2]" 1
2089 1 90 ASP H 1 93 GLN HB2 . . 4.840 4.623 4.388 4.752 . 0 0 "[ . 1 . 2]" 1
2090 1 90 ASP HA 1 93 GLN HB2 . . 3.540 2.217 2.030 2.330 . 0 0 "[ . 1 . 2]" 1
2091 1 90 ASP HA 1 93 GLN HG3 . . 4.340 3.418 3.274 3.653 . 0 0 "[ . 1 . 2]" 1
2092 1 90 ASP HA 1 94 LYS H . . 3.810 3.009 2.567 3.410 . 0 0 "[ . 1 . 2]" 1
2093 1 90 ASP HA 1 94 LYS QE . . 4.630 3.839 3.119 4.556 . 0 0 "[ . 1 . 2]" 1
2094 1 90 ASP HA 1 94 LYS HG2 . . 4.500 3.570 2.586 4.407 . 0 0 "[ . 1 . 2]" 1
2095 1 90 ASP HA 1 94 LYS QG . . 3.720 2.651 2.363 2.990 . 0 0 "[ . 1 . 2]" 1
2096 1 90 ASP HA 1 94 LYS HG3 . . 4.500 2.952 2.382 3.688 . 0 0 "[ . 1 . 2]" 1
2097 1 90 ASP QB 1 91 PHE H . . 4.030 3.239 2.980 3.638 . 0 0 "[ . 1 . 2]" 1
2098 1 90 ASP QB 1 94 LYS H . . 4.290 3.942 3.581 4.258 . 0 0 "[ . 1 . 2]" 1
2099 1 90 ASP QB 1 94 LYS HB2 . . 4.270 3.332 2.922 3.751 . 0 0 "[ . 1 . 2]" 1
2100 1 90 ASP QB 1 94 LYS QG . . 3.120 2.564 2.098 2.895 . 0 0 "[ . 1 . 2]" 1
2101 1 90 ASP HB2 1 91 PHE H . . 4.670 3.392 3.065 3.878 . 0 0 "[ . 1 . 2]" 1
2102 1 90 ASP HB3 1 91 PHE H . . 4.670 4.133 3.846 4.412 . 0 0 "[ . 1 . 2]" 1
2103 1 91 PHE H 1 91 PHE HB2 . . 3.410 2.403 2.334 2.508 . 0 0 "[ . 1 . 2]" 1
2104 1 91 PHE H 1 91 PHE HB3 . . 3.700 3.591 3.569 3.607 . 0 0 "[ . 1 . 2]" 1
2105 1 91 PHE H 1 91 PHE QD . . 3.380 2.545 2.345 2.877 . 0 0 "[ . 1 . 2]" 1
2106 1 91 PHE H 1 92 ARG H . . 3.180 2.516 2.431 2.632 . 0 0 "[ . 1 . 2]" 1
2107 1 91 PHE H 1 92 ARG HB2 . . 5.200 4.918 4.775 5.036 . 0 0 "[ . 1 . 2]" 1
2108 1 91 PHE H 1 95 LEU MD1 . . 4.930 4.879 4.774 4.934 0.004 15 0 "[ . 1 . 2]" 1
2109 1 91 PHE HA 1 91 PHE QD . . 3.700 2.733 2.470 2.911 . 0 0 "[ . 1 . 2]" 1
2110 1 91 PHE HA 1 92 ARG HA . . 4.700 4.629 4.610 4.678 . 0 0 "[ . 1 . 2]" 1
2111 1 91 PHE HA 1 95 LEU H . . 3.670 2.856 2.714 3.012 . 0 0 "[ . 1 . 2]" 1
2112 1 91 PHE HA 1 95 LEU HB2 . . 3.850 2.204 2.003 2.626 . 0 0 "[ . 1 . 2]" 1
2113 1 91 PHE HA 1 95 LEU HB3 . . 4.400 3.876 3.645 4.291 . 0 0 "[ . 1 . 2]" 1
2114 1 91 PHE HA 1 95 LEU MD1 . . 3.760 2.705 2.586 2.774 . 0 0 "[ . 1 . 2]" 1
2115 1 91 PHE HA 1 95 LEU MD2 . . 4.760 4.513 4.427 4.604 . 0 0 "[ . 1 . 2]" 1
2116 1 91 PHE HA 1 95 LEU HG . . 4.590 3.254 2.962 3.461 . 0 0 "[ . 1 . 2]" 1
2117 1 91 PHE HA 1 97 ILE HG12 . . 4.940 3.394 3.138 3.723 . 0 0 "[ . 1 . 2]" 1
2118 1 91 PHE HA 1 97 ILE HG13 . . 5.360 4.097 3.819 4.491 . 0 0 "[ . 1 . 2]" 1
2119 1 91 PHE HB2 1 92 ARG H . . 3.710 2.639 2.398 2.810 . 0 0 "[ . 1 . 2]" 1
2120 1 91 PHE HB2 1 97 ILE HB . . 4.430 4.101 3.824 4.400 . 0 0 "[ . 1 . 2]" 1
2121 1 91 PHE HB2 1 97 ILE MG . . 5.270 4.938 4.681 5.205 . 0 0 "[ . 1 . 2]" 1
2122 1 91 PHE HB3 1 92 ARG H . . 4.020 3.592 3.366 3.756 . 0 0 "[ . 1 . 2]" 1
2123 1 91 PHE HB3 1 97 ILE HB . . 4.050 3.177 3.009 3.461 . 0 0 "[ . 1 . 2]" 1
2124 1 91 PHE HB3 1 97 ILE MD . . 4.130 3.796 3.496 4.123 . 0 0 "[ . 1 . 2]" 1
2125 1 91 PHE HB3 1 97 ILE HG12 . . 4.220 2.636 2.064 3.225 . 0 0 "[ . 1 . 2]" 1
2126 1 91 PHE HB3 1 97 ILE HG13 . . 4.800 2.384 2.049 2.716 . 0 0 "[ . 1 . 2]" 1
2127 1 91 PHE HB3 1 97 ILE MG . . 4.440 3.926 3.800 4.077 . 0 0 "[ . 1 . 2]" 1
2128 1 91 PHE QD 1 95 LEU MD1 . . 3.720 1.997 1.838 2.212 . 0 0 "[ . 1 . 2]" 1
2129 1 91 PHE QD 1 95 LEU MD2 . . 4.710 4.541 4.381 4.715 0.005 15 0 "[ . 1 . 2]" 1
2130 1 91 PHE QD 1 97 ILE MD . . 4.410 3.678 3.360 4.085 . 0 0 "[ . 1 . 2]" 1
2131 1 91 PHE QE 1 95 LEU MD1 . . 4.270 2.987 2.727 3.239 . 0 0 "[ . 1 . 2]" 1
2132 1 92 ARG H 1 92 ARG HB2 . . 3.450 2.597 2.448 2.655 . 0 0 "[ . 1 . 2]" 1
2133 1 92 ARG H 1 92 ARG HB3 . . 3.720 3.655 3.611 3.676 . 0 0 "[ . 1 . 2]" 1
2134 1 92 ARG H 1 92 ARG HD2 . . 4.120 3.658 3.443 4.043 . 0 0 "[ . 1 . 2]" 1
2135 1 92 ARG H 1 92 ARG HG2 . . 3.930 3.669 3.460 3.886 . 0 0 "[ . 1 . 2]" 1
2136 1 92 ARG H 1 92 ARG HG3 . . 3.430 2.266 1.978 2.649 . 0 0 "[ . 1 . 2]" 1
2137 1 92 ARG H 1 93 GLN H . . 3.440 2.291 2.204 2.450 . 0 0 "[ . 1 . 2]" 1
2138 1 92 ARG H 1 93 GLN HG2 . . 4.770 3.782 3.585 3.993 . 0 0 "[ . 1 . 2]" 1
2139 1 92 ARG H 1 94 LYS H . . 4.630 4.132 3.971 4.494 . 0 0 "[ . 1 . 2]" 1
2140 1 92 ARG H 1 95 LEU H . . 4.900 4.704 4.608 4.857 . 0 0 "[ . 1 . 2]" 1
2141 1 92 ARG HA 1 92 ARG HD2 . . 5.330 4.765 4.601 4.836 . 0 0 "[ . 1 . 2]" 1
2142 1 92 ARG HA 1 92 ARG HD3 . . 5.500 4.527 4.464 4.588 . 0 0 "[ . 1 . 2]" 1
2143 1 92 ARG HA 1 92 ARG HG2 . . 3.750 2.827 2.616 2.906 . 0 0 "[ . 1 . 2]" 1
2144 1 92 ARG HA 1 92 ARG HG3 . . 3.750 2.995 2.866 3.132 . 0 0 "[ . 1 . 2]" 1
2145 1 92 ARG HA 1 96 LYS H . . 4.270 3.097 2.905 3.293 . 0 0 "[ . 1 . 2]" 1
2146 1 92 ARG HA 1 96 LYS HA . . 4.020 2.310 2.088 2.609 . 0 0 "[ . 1 . 2]" 1
2147 1 92 ARG HA 1 97 ILE H . . 3.110 2.097 1.938 2.244 . 0 0 "[ . 1 . 2]" 1
2148 1 92 ARG HB2 1 92 ARG HD2 . . 4.190 2.623 2.317 2.732 . 0 0 "[ . 1 . 2]" 1
2149 1 92 ARG HB2 1 93 GLN H . . 3.520 3.337 3.263 3.426 . 0 0 "[ . 1 . 2]" 1
2150 1 92 ARG HB2 1 93 GLN HE21 . . 5.150 3.602 3.245 3.910 . 0 0 "[ . 1 . 2]" 1
2151 1 92 ARG HB2 1 93 GLN HG2 . . 4.880 3.185 3.099 3.304 . 0 0 "[ . 1 . 2]" 1
2152 1 92 ARG HB3 1 93 GLN H . . 4.270 4.252 4.104 4.278 0.008 1 0 "[ . 1 . 2]" 1
2153 1 92 ARG HB3 1 93 GLN HE21 . . 5.030 4.448 3.979 4.740 . 0 0 "[ . 1 . 2]" 1
2154 1 92 ARG HB3 1 97 ILE H . . 4.540 4.310 4.132 4.494 . 0 0 "[ . 1 . 2]" 1
2155 1 92 ARG HD2 1 93 GLN H . . 5.500 5.385 5.217 5.490 . 0 0 "[ . 1 . 2]" 1
2156 1 92 ARG HD2 1 93 GLN HG2 . . 5.500 5.181 4.989 5.383 . 0 0 "[ . 1 . 2]" 1
2157 1 92 ARG HG3 1 93 GLN H . . 4.560 4.314 4.196 4.543 . 0 0 "[ . 1 . 2]" 1
2158 1 93 GLN H 1 93 GLN HB2 . . 3.250 2.510 2.457 2.622 . 0 0 "[ . 1 . 2]" 1
2159 1 93 GLN H 1 93 GLN HB3 . . 3.830 3.670 3.641 3.718 . 0 0 "[ . 1 . 2]" 1
2160 1 93 GLN H 1 93 GLN HE21 . . 5.200 4.385 4.143 4.603 . 0 0 "[ . 1 . 2]" 1
2161 1 93 GLN H 1 93 GLN HG2 . . 3.390 2.618 2.480 2.768 . 0 0 "[ . 1 . 2]" 1
2162 1 93 GLN H 1 93 GLN HG3 . . 3.830 3.615 3.557 3.714 . 0 0 "[ . 1 . 2]" 1
2163 1 93 GLN H 1 94 LYS H . . 3.360 2.253 2.157 2.410 . 0 0 "[ . 1 . 2]" 1
2164 1 93 GLN H 1 94 LYS QG . . 4.590 4.117 3.882 4.334 . 0 0 "[ . 1 . 2]" 1
2165 1 93 GLN H 1 95 LEU H . . 4.460 3.758 3.615 3.860 . 0 0 "[ . 1 . 2]" 1
2166 1 93 GLN HA 1 93 GLN HE21 . . 4.770 3.327 2.642 3.896 . 0 0 "[ . 1 . 2]" 1
2167 1 93 GLN HA 1 93 GLN HE22 . . 4.850 4.021 3.701 4.321 . 0 0 "[ . 1 . 2]" 1
2168 1 93 GLN HA 1 93 GLN HG2 . . 3.760 2.786 2.714 2.916 . 0 0 "[ . 1 . 2]" 1
2169 1 93 GLN HA 1 93 GLN HG3 . . 4.000 3.801 3.771 3.851 . 0 0 "[ . 1 . 2]" 1
2170 1 93 GLN HA 1 94 LYS HA . . 4.790 4.602 4.574 4.678 . 0 0 "[ . 1 . 2]" 1
2171 1 93 GLN HB2 1 94 LYS H . . 3.140 2.525 2.128 2.751 . 0 0 "[ . 1 . 2]" 1
2172 1 93 GLN HB2 1 94 LYS QG . . 4.440 2.842 2.566 2.992 . 0 0 "[ . 1 . 2]" 1
2173 1 93 GLN HB3 1 94 LYS H . . 3.770 3.607 3.350 3.771 0.001 2 0 "[ . 1 . 2]" 1
2174 1 93 GLN HB3 1 94 LYS QG . . 4.490 3.539 3.308 3.681 . 0 0 "[ . 1 . 2]" 1
2175 1 93 GLN HE22 1 93 GLN HG2 . . 4.020 3.447 3.437 3.464 . 0 0 "[ . 1 . 2]" 1
2176 1 93 GLN HG2 1 94 LYS H . . 4.900 4.280 4.051 4.400 . 0 0 "[ . 1 . 2]" 1
2177 1 93 GLN HG3 1 94 LYS H . . 4.820 4.641 4.299 4.819 . 0 0 "[ . 1 . 2]" 1
2178 1 94 LYS H 1 94 LYS HB2 . . 3.510 2.576 2.500 2.709 . 0 0 "[ . 1 . 2]" 1
2179 1 94 LYS H 1 94 LYS QD . . 4.860 4.278 4.061 4.503 . 0 0 "[ . 1 . 2]" 1
2180 1 94 LYS H 1 94 LYS HG2 . . 3.970 2.893 2.144 3.511 . 0 0 "[ . 1 . 2]" 1
2181 1 94 LYS H 1 94 LYS QG . . 3.240 2.449 2.115 2.649 . 0 0 "[ . 1 . 2]" 1
2182 1 94 LYS H 1 94 LYS HG3 . . 3.970 3.011 2.478 3.775 . 0 0 "[ . 1 . 2]" 1
2183 1 94 LYS H 1 95 LEU H . . 3.120 2.392 2.298 2.657 . 0 0 "[ . 1 . 2]" 1
2184 1 94 LYS H 1 96 LYS H . . 4.120 3.186 3.044 3.509 . 0 0 "[ . 1 . 2]" 1
2185 1 94 LYS HA 1 94 LYS HD2 . . 4.560 4.216 3.558 4.558 . 0 0 "[ . 1 . 2]" 1
2186 1 94 LYS HA 1 94 LYS HD3 . . 4.560 3.550 2.278 4.526 . 0 0 "[ . 1 . 2]" 1
2187 1 94 LYS HA 1 94 LYS HG2 . . 4.020 2.657 2.424 2.960 . 0 0 "[ . 1 . 2]" 1
2188 1 94 LYS HA 1 94 LYS QG . . 3.440 2.593 2.375 2.877 . 0 0 "[ . 1 . 2]" 1
2189 1 94 LYS HA 1 94 LYS HG3 . . 4.020 3.620 3.353 3.914 . 0 0 "[ . 1 . 2]" 1
2190 1 94 LYS HA 1 96 LYS H . . 4.950 4.118 3.916 4.318 . 0 0 "[ . 1 . 2]" 1
2191 1 94 LYS HB2 1 94 LYS HD2 . . 3.940 3.232 2.557 4.054 0.114 2 0 "[ . 1 . 2]" 1
2192 1 94 LYS HB2 1 94 LYS QD . . 3.440 2.909 2.503 3.260 . 0 0 "[ . 1 . 2]" 1
2193 1 94 LYS HB2 1 94 LYS HD3 . . 3.940 3.561 3.392 3.946 0.006 19 0 "[ . 1 . 2]" 1
2194 1 94 LYS HB2 1 95 LEU H . . 3.150 2.283 2.254 2.321 . 0 0 "[ . 1 . 2]" 1
2195 1 94 LYS HB2 1 95 LEU HB2 . . 4.390 4.257 4.171 4.390 0.000 14 0 "[ . 1 . 2]" 1
2196 1 94 LYS QE 1 94 LYS QG . . 3.290 2.148 2.081 2.285 . 0 0 "[ . 1 . 2]" 1
2197 1 95 LEU H 1 95 LEU HB2 . . 3.370 2.336 2.241 2.478 . 0 0 "[ . 1 . 2]" 1
2198 1 95 LEU H 1 95 LEU HB3 . . 3.960 3.573 3.531 3.625 . 0 0 "[ . 1 . 2]" 1
2199 1 95 LEU H 1 95 LEU MD1 . . 4.010 3.740 3.599 3.842 . 0 0 "[ . 1 . 2]" 1
2200 1 95 LEU H 1 95 LEU MD2 . . 3.720 3.670 3.511 3.723 0.003 12 0 "[ . 1 . 2]" 1
2201 1 95 LEU H 1 95 LEU HG . . 4.120 2.665 2.414 2.827 . 0 0 "[ . 1 . 2]" 1
2202 1 95 LEU H 1 96 LYS H . . 3.050 2.428 2.378 2.483 . 0 0 "[ . 1 . 2]" 1
2203 1 95 LEU H 1 96 LYS HA . . 4.820 4.662 4.588 4.726 . 0 0 "[ . 1 . 2]" 1
2204 1 95 LEU H 1 97 ILE H . . 4.770 4.372 4.167 4.560 . 0 0 "[ . 1 . 2]" 1
2205 1 95 LEU H 1 97 ILE HG12 . . 5.500 4.399 4.112 4.601 . 0 0 "[ . 1 . 2]" 1
2206 1 95 LEU HA 1 95 LEU MD1 . . 4.190 3.853 3.816 3.913 . 0 0 "[ . 1 . 2]" 1
2207 1 95 LEU HA 1 95 LEU MD2 . . 3.020 2.088 1.956 2.320 . 0 0 "[ . 1 . 2]" 1
2208 1 95 LEU HA 1 97 ILE HG12 . . 5.500 4.735 4.455 5.036 . 0 0 "[ . 1 . 2]" 1
2209 1 95 LEU HB2 1 95 LEU MD1 . . 3.390 2.318 2.214 2.397 . 0 0 "[ . 1 . 2]" 1
2210 1 95 LEU HB2 1 96 LYS H . . 3.750 3.229 3.009 3.507 . 0 0 "[ . 1 . 2]" 1
2211 1 95 LEU HB2 1 97 ILE H . . 4.270 3.371 3.145 3.560 . 0 0 "[ . 1 . 2]" 1
2212 1 95 LEU HB2 1 97 ILE MD . . 4.120 3.087 2.343 3.520 . 0 0 "[ . 1 . 2]" 1
2213 1 95 LEU HB2 1 97 ILE HG12 . . 3.920 2.425 2.115 2.591 . 0 0 "[ . 1 . 2]" 1
2214 1 95 LEU HB2 1 97 ILE HG13 . . 4.410 3.676 3.278 3.927 . 0 0 "[ . 1 . 2]" 1
2215 1 95 LEU HB3 1 95 LEU MD1 . . 3.090 2.324 2.261 2.415 . 0 0 "[ . 1 . 2]" 1
2216 1 95 LEU HB3 1 95 LEU MD2 . . 3.210 2.298 2.172 2.357 . 0 0 "[ . 1 . 2]" 1
2217 1 95 LEU HB3 1 96 LYS H . . 4.700 3.976 3.754 4.271 . 0 0 "[ . 1 . 2]" 1
2218 1 95 LEU HB3 1 97 ILE H . . 4.460 3.803 3.535 4.157 . 0 0 "[ . 1 . 2]" 1
2219 1 95 LEU HB3 1 97 ILE MD . . 3.560 2.208 1.813 2.524 . 0 0 "[ . 1 . 2]" 1
2220 1 95 LEU HB3 1 97 ILE HG13 . . 4.670 3.836 3.426 4.160 . 0 0 "[ . 1 . 2]" 1
2221 1 95 LEU MD1 1 97 ILE MD . . 4.150 2.492 2.343 2.764 . 0 0 "[ . 1 . 2]" 1
2222 1 95 LEU MD1 1 97 ILE HG13 . . 4.940 3.280 3.048 3.472 . 0 0 "[ . 1 . 2]" 1
2223 1 95 LEU MD2 1 97 ILE MD . . 4.220 3.392 3.190 3.540 . 0 0 "[ . 1 . 2]" 1
2224 1 95 LEU HG 1 96 LYS H . . 4.870 4.708 4.552 4.859 . 0 0 "[ . 1 . 2]" 1
2225 1 96 LYS H 1 96 LYS HA . . 2.820 2.285 2.275 2.309 . 0 0 "[ . 1 . 2]" 1
2226 1 96 LYS H 1 96 LYS HD2 . . 4.490 3.745 2.089 4.490 . 0 0 "[ . 1 . 2]" 1
2227 1 96 LYS H 1 96 LYS HD3 . . 4.490 3.424 2.096 4.469 . 0 0 "[ . 1 . 2]" 1
2228 1 96 LYS H 1 96 LYS QG . . 3.860 2.881 2.363 3.530 . 0 0 "[ . 1 . 2]" 1
2229 1 96 LYS H 1 97 ILE H . . 3.330 2.926 2.743 3.060 . 0 0 "[ . 1 . 2]" 1
2230 1 96 LYS H 1 97 ILE HG12 . . 4.150 4.080 3.917 4.148 . 0 0 "[ . 1 . 2]" 1
2231 1 96 LYS HA 1 96 LYS HD2 . . 3.850 2.954 2.196 3.849 . 0 0 "[ . 1 . 2]" 1
2232 1 96 LYS HA 1 96 LYS QD . . 3.380 2.613 2.179 3.077 . 0 0 "[ . 1 . 2]" 1
2233 1 96 LYS HA 1 96 LYS HD3 . . 3.850 3.294 2.433 3.841 . 0 0 "[ . 1 . 2]" 1
2234 1 96 LYS HA 1 96 LYS HG2 . . 4.140 3.119 2.649 3.664 . 0 0 "[ . 1 . 2]" 1
2235 1 96 LYS HA 1 96 LYS QG . . 3.530 2.549 2.166 2.962 . 0 0 "[ . 1 . 2]" 1
2236 1 96 LYS HA 1 96 LYS HG3 . . 4.140 3.185 2.188 3.907 . 0 0 "[ . 1 . 2]" 1
2237 1 96 LYS HA 1 97 ILE H . . 3.330 2.692 2.629 2.755 . 0 0 "[ . 1 . 2]" 1
2238 1 96 LYS QB 1 96 LYS QE . . 4.510 2.892 2.154 3.768 . 0 0 "[ . 1 . 2]" 1
2239 1 96 LYS QE 1 96 LYS QG . . 3.310 2.271 2.075 2.536 . 0 0 "[ . 1 . 2]" 1
2240 1 96 LYS QG 1 97 ILE H . . 5.340 4.668 4.569 4.804 . 0 0 "[ . 1 . 2]" 1
2241 1 97 ILE H 1 97 ILE HB . . 3.310 2.537 2.468 2.614 . 0 0 "[ . 1 . 2]" 1
2242 1 97 ILE H 1 97 ILE MD . . 4.020 3.180 2.464 3.511 . 0 0 "[ . 1 . 2]" 1
2243 1 97 ILE H 1 97 ILE HG12 . . 3.360 2.138 1.978 2.280 . 0 0 "[ . 1 . 2]" 1
2244 1 97 ILE H 1 97 ILE HG13 . . 3.750 3.594 3.449 3.717 . 0 0 "[ . 1 . 2]" 1
2245 1 97 ILE H 1 97 ILE MG . . 3.890 3.763 3.758 3.768 . 0 0 "[ . 1 . 2]" 1
2246 1 97 ILE H 1 98 THR H . . 4.890 4.614 4.490 4.641 . 0 0 "[ . 1 . 2]" 1
2247 1 97 ILE HA 1 97 ILE MD . . 3.340 2.056 1.971 2.179 . 0 0 "[ . 1 . 2]" 1
2248 1 97 ILE HA 1 97 ILE HG12 . . 4.160 3.057 2.863 3.410 . 0 0 "[ . 1 . 2]" 1
2249 1 97 ILE HA 1 97 ILE MG . . 3.340 2.370 2.320 2.435 . 0 0 "[ . 1 . 2]" 1
2250 1 97 ILE HA 1 98 THR H . . 2.920 2.271 2.139 2.383 . 0 0 "[ . 1 . 2]" 1
2251 1 97 ILE HA 1 99 ALA H . . 5.030 4.694 4.114 4.964 . 0 0 "[ . 1 . 2]" 1
2252 1 97 ILE HA 1 102 THR MG . . 4.010 3.139 2.759 3.366 . 0 0 "[ . 1 . 2]" 1
2253 1 97 ILE HB 1 98 THR H . . 4.230 3.859 3.611 4.216 . 0 0 "[ . 1 . 2]" 1
2254 1 97 ILE HB 1 99 ALA H . . 5.420 5.246 4.880 5.421 0.001 8 0 "[ . 1 . 2]" 1
2255 1 97 ILE MD 1 97 ILE MG . . 3.070 2.010 1.901 2.290 . 0 0 "[ . 1 . 2]" 1
2256 1 97 ILE MD 1 98 THR H . . 4.330 3.436 3.168 3.652 . 0 0 "[ . 1 . 2]" 1
2257 1 97 ILE MD 1 99 ALA H . . 5.100 4.956 4.408 5.100 . 19 0 "[ . 1 . 2]" 1
2258 1 97 ILE MD 1 102 THR HB . . 4.030 2.576 2.177 3.016 . 0 0 "[ . 1 . 2]" 1
2259 1 97 ILE MD 1 102 THR HG1 . . 4.900 4.243 3.889 4.557 . 0 0 "[ . 1 . 2]" 1
2260 1 97 ILE MD 1 102 THR MG . . 3.330 2.099 1.875 2.680 . 0 0 "[ . 1 . 2]" 1
2261 1 97 ILE MD 1 104 LEU MD1 . . 4.710 4.662 4.479 4.711 0.001 2 0 "[ . 1 . 2]" 1
2262 1 97 ILE MD 1 104 LEU MD2 . . 3.600 3.416 3.241 3.583 . 0 0 "[ . 1 . 2]" 1
2263 1 97 ILE HG12 1 97 ILE MG . . 3.460 3.192 3.149 3.201 . 0 0 "[ . 1 . 2]" 1
2264 1 97 ILE HG13 1 102 THR HB . . 5.500 4.050 3.473 4.542 . 0 0 "[ . 1 . 2]" 1
2265 1 97 ILE MG 1 98 THR H . . 3.660 2.066 1.801 2.598 . 0 0 "[ . 1 . 2]" 1
2266 1 97 ILE MG 1 98 THR HA . . 4.890 3.770 3.589 4.079 . 0 0 "[ . 1 . 2]" 1
2267 1 97 ILE MG 1 99 ALA H . . 3.350 2.739 2.380 2.904 . 0 0 "[ . 1 . 2]" 1
2268 1 97 ILE MG 1 100 VAL MG1 . . 3.340 2.294 2.008 2.572 . 0 0 "[ . 1 . 2]" 1
2269 1 97 ILE MG 1 102 THR H . . 4.900 4.167 3.868 4.343 . 0 0 "[ . 1 . 2]" 1
2270 1 97 ILE MG 1 102 THR HA . . 5.320 4.277 4.114 4.458 . 0 0 "[ . 1 . 2]" 1
2271 1 97 ILE MG 1 102 THR HB . . 3.610 2.490 2.044 2.877 . 0 0 "[ . 1 . 2]" 1
2272 1 97 ILE MG 1 102 THR HG1 . . 4.440 2.810 2.492 3.084 . 0 0 "[ . 1 . 2]" 1
2273 1 97 ILE MG 1 102 THR MG . . 3.560 2.217 2.005 2.454 . 0 0 "[ . 1 . 2]" 1
2274 1 98 THR H 1 98 THR MG . . 3.970 3.628 1.894 3.867 . 0 0 "[ . 1 . 2]" 1
2275 1 98 THR H 1 99 ALA H . . 2.950 2.592 2.264 2.784 . 0 0 "[ . 1 . 2]" 1
2276 1 98 THR H 1 99 ALA MB . . 5.350 4.776 4.576 4.920 . 0 0 "[ . 1 . 2]" 1
2277 1 98 THR H 1 102 THR HG1 . . 4.900 4.012 3.411 4.441 . 0 0 "[ . 1 . 2]" 1
2278 1 98 THR H 1 102 THR MG . . 4.330 2.905 2.617 3.298 . 0 0 "[ . 1 . 2]" 1
2279 1 98 THR HA 1 98 THR MG . . 3.170 2.403 2.164 3.206 0.036 20 0 "[ . 1 . 2]" 1
2280 1 98 THR HA 1 99 ALA MB . . 5.230 4.300 4.234 4.364 . 0 0 "[ . 1 . 2]" 1
2281 1 98 THR HB 1 99 ALA H . . 3.880 2.223 1.899 3.793 . 0 0 "[ . 1 . 2]" 1
2282 1 98 THR HB 1 99 ALA MB . . 5.450 3.670 3.406 4.745 . 0 0 "[ . 1 . 2]" 1
2283 1 98 THR MG 1 99 ALA H . . 4.380 2.948 1.798 3.447 . 0 0 "[ . 1 . 2]" 1
2284 1 98 THR MG 1 99 ALA MB . . 3.890 2.630 2.069 2.943 . 0 0 "[ . 1 . 2]" 1
2285 1 99 ALA H 1 99 ALA MB . . 3.430 2.752 2.679 2.850 . 0 0 "[ . 1 . 2]" 1
2286 1 99 ALA H 1 100 VAL H . . 4.660 4.109 4.009 4.219 . 0 0 "[ . 1 . 2]" 1
2287 1 99 ALA H 1 102 THR HG1 . . 3.850 2.850 2.378 3.327 . 0 0 "[ . 1 . 2]" 1
2288 1 99 ALA H 1 113 VAL MG1 . . 4.660 2.809 2.679 3.024 . 0 0 "[ . 1 . 2]" 1
2289 1 99 ALA HA 1 100 VAL H . . 2.910 2.149 2.142 2.164 . 0 0 "[ . 1 . 2]" 1
2290 1 99 ALA HA 1 100 VAL MG1 . . 4.440 3.626 3.451 3.910 . 0 0 "[ . 1 . 2]" 1
2291 1 99 ALA HA 1 100 VAL MG2 . . 4.490 3.880 3.711 4.045 . 0 0 "[ . 1 . 2]" 1
2292 1 99 ALA HA 1 113 VAL MG1 . . 4.340 4.198 4.122 4.268 . 0 0 "[ . 1 . 2]" 1
2293 1 99 ALA MB 1 100 VAL H . . 3.220 3.139 3.047 3.215 . 0 0 "[ . 1 . 2]" 1
2294 1 99 ALA MB 1 100 VAL HA . . 4.510 4.380 4.325 4.426 . 0 0 "[ . 1 . 2]" 1
2295 1 99 ALA MB 1 100 VAL MG2 . . 4.580 4.137 4.033 4.237 . 0 0 "[ . 1 . 2]" 1
2296 1 99 ALA MB 1 101 PRO HD2 . . 5.330 5.209 5.165 5.248 . 0 0 "[ . 1 . 2]" 1
2297 1 99 ALA MB 1 102 THR HG1 . . 4.210 4.053 3.845 4.217 0.007 6 0 "[ . 1 . 2]" 1
2298 1 99 ALA MB 1 113 VAL HB . . 4.350 4.338 4.289 4.358 0.008 18 0 "[ . 1 . 2]" 1
2299 1 99 ALA MB 1 113 VAL MG1 . . 2.850 2.125 2.056 2.171 . 0 0 "[ . 1 . 2]" 1
2300 1 99 ALA MB 1 113 VAL MG2 . . 4.480 4.167 4.080 4.232 . 0 0 "[ . 1 . 2]" 1
2301 1 99 ALA MB 1 114 GLU H . . 4.110 3.424 3.367 3.459 . 0 0 "[ . 1 . 2]" 1
2302 1 99 ALA MB 1 114 GLU HA . . 5.310 5.324 5.300 5.334 0.024 2 0 "[ . 1 . 2]" 1
2303 1 99 ALA MB 1 114 GLU HB2 . . 4.420 4.263 4.210 4.339 . 0 0 "[ . 1 . 2]" 1
2304 1 99 ALA MB 1 114 GLU HB3 . . 5.010 4.941 4.875 4.991 . 0 0 "[ . 1 . 2]" 1
2305 1 99 ALA MB 1 114 GLU QG . . 2.900 2.399 2.342 2.455 . 0 0 "[ . 1 . 2]" 1
2306 1 99 ALA MB 1 115 SER H . . 5.500 5.151 5.105 5.221 . 0 0 "[ . 1 . 2]" 1
2307 1 100 VAL H 1 100 VAL MG1 . . 3.930 2.298 2.017 2.581 . 0 0 "[ . 1 . 2]" 1
2308 1 100 VAL H 1 100 VAL MG2 . . 3.190 2.098 1.922 2.287 . 0 0 "[ . 1 . 2]" 1
2309 1 100 VAL H 1 114 GLU QG . . 4.580 4.040 3.953 4.094 . 0 0 "[ . 1 . 2]" 1
2310 1 100 VAL HA 1 100 VAL MG1 . . 3.350 2.397 2.258 2.499 . 0 0 "[ . 1 . 2]" 1
2311 1 100 VAL HA 1 101 PRO HA . . 3.350 2.303 2.262 2.331 . 0 0 "[ . 1 . 2]" 1
2312 1 100 VAL HA 1 101 PRO QB . . 4.720 3.909 3.885 3.925 . 0 0 "[ . 1 . 2]" 1
2313 1 100 VAL HA 1 102 THR H . . 3.600 2.623 2.402 2.793 . 0 0 "[ . 1 . 2]" 1
2314 1 100 VAL HA 1 102 THR HG1 . . 4.120 2.521 1.998 3.075 . 0 0 "[ . 1 . 2]" 1
2315 1 100 VAL HA 1 102 THR MG . . 5.350 4.428 4.301 4.541 . 0 0 "[ . 1 . 2]" 1
2316 1 100 VAL HB 1 101 PRO HA . . 3.660 2.031 1.995 2.140 . 0 0 "[ . 1 . 2]" 1
2317 1 100 VAL HB 1 102 THR H . . 4.020 3.423 3.203 3.591 . 0 0 "[ . 1 . 2]" 1
2318 1 100 VAL MG1 1 101 PRO HA . . 4.640 3.253 3.000 3.411 . 0 0 "[ . 1 . 2]" 1
2319 1 100 VAL MG1 1 102 THR H . . 4.130 3.255 2.853 3.587 . 0 0 "[ . 1 . 2]" 1
2320 1 100 VAL MG1 1 102 THR HB . . 4.740 3.452 3.143 3.742 . 0 0 "[ . 1 . 2]" 1
2321 1 100 VAL MG1 1 102 THR HG1 . . 4.910 3.441 3.111 3.814 . 0 0 "[ . 1 . 2]" 1
2322 1 100 VAL MG2 1 101 PRO HA . . 4.720 3.490 3.339 3.690 . 0 0 "[ . 1 . 2]" 1
2323 1 101 PRO HA 1 102 THR H . . 3.010 2.191 2.161 2.221 . 0 0 "[ . 1 . 2]" 1
2324 1 101 PRO HA 1 102 THR HA . . 4.860 4.409 4.401 4.419 . 0 0 "[ . 1 . 2]" 1
2325 1 101 PRO QB 1 117 CYS QB . . 4.180 3.291 3.101 3.460 . 0 0 "[ . 1 . 2]" 1
2326 1 101 PRO HB2 1 102 THR H . . 4.030 3.282 3.147 3.458 . 0 0 "[ . 1 . 2]" 1
2327 1 101 PRO HB3 1 102 THR H . . 4.030 3.837 3.753 3.949 . 0 0 "[ . 1 . 2]" 1
2328 1 101 PRO HD2 1 114 GLU H . . 4.250 3.894 3.880 3.944 . 0 0 "[ . 1 . 2]" 1
2329 1 101 PRO HD2 1 114 GLU HA . . 3.570 2.320 2.283 2.391 . 0 0 "[ . 1 . 2]" 1
2330 1 101 PRO HD2 1 114 GLU HB2 . . 4.450 3.823 3.750 3.914 . 0 0 "[ . 1 . 2]" 1
2331 1 101 PRO HD2 1 114 GLU QG . . 4.480 2.029 1.990 2.119 . 0 0 "[ . 1 . 2]" 1
2332 1 101 PRO HD3 1 114 GLU H . . 5.500 5.518 5.507 5.542 0.042 2 0 "[ . 1 . 2]" 1
2333 1 101 PRO HD3 1 114 GLU HA . . 3.980 3.927 3.879 3.978 . 0 0 "[ . 1 . 2]" 1
2334 1 101 PRO HG2 1 114 GLU H . . 4.780 4.165 4.116 4.217 . 0 0 "[ . 1 . 2]" 1
2335 1 101 PRO HG2 1 114 GLU HA . . 4.190 2.121 2.001 2.264 . 0 0 "[ . 1 . 2]" 1
2336 1 101 PRO HG2 1 117 CYS H . . 4.960 4.595 4.506 4.791 . 0 0 "[ . 1 . 2]" 1
2337 1 101 PRO HG2 1 117 CYS HA . . 5.270 5.087 4.911 5.269 . 0 0 "[ . 1 . 2]" 1
2338 1 101 PRO HG2 1 117 CYS QB . . 3.970 2.333 2.176 2.476 . 0 0 "[ . 1 . 2]" 1
2339 1 101 PRO HG3 1 114 GLU HA . . 4.350 3.552 3.460 3.661 . 0 0 "[ . 1 . 2]" 1
2340 1 101 PRO HG3 1 117 CYS QB . . 4.110 3.236 3.077 3.395 . 0 0 "[ . 1 . 2]" 1
2341 1 102 THR H 1 102 THR HB . . 3.640 2.683 2.610 2.842 . 0 0 "[ . 1 . 2]" 1
2342 1 102 THR H 1 102 THR HG1 . . 3.870 3.368 2.934 3.853 . 0 0 "[ . 1 . 2]" 1
2343 1 102 THR H 1 102 THR MG . . 4.310 3.872 3.815 3.936 . 0 0 "[ . 1 . 2]" 1
2344 1 102 THR H 1 103 LEU H . . 4.840 4.177 4.090 4.264 . 0 0 "[ . 1 . 2]" 1
2345 1 102 THR HA 1 102 THR MG . . 3.360 2.350 2.198 2.463 . 0 0 "[ . 1 . 2]" 1
2346 1 102 THR HA 1 103 LEU H . . 2.990 2.150 2.143 2.163 . 0 0 "[ . 1 . 2]" 1
2347 1 102 THR HA 1 103 LEU HB3 . . 4.640 4.627 4.568 4.653 0.013 20 0 "[ . 1 . 2]" 1
2348 1 102 THR HA 1 113 VAL HA . . 3.570 2.740 2.557 2.820 . 0 0 "[ . 1 . 2]" 1
2349 1 102 THR HA 1 113 VAL MG1 . . 4.110 3.553 3.455 3.641 . 0 0 "[ . 1 . 2]" 1
2350 1 102 THR HA 1 113 VAL MG2 . . 4.830 4.525 4.391 4.621 . 0 0 "[ . 1 . 2]" 1
2351 1 102 THR HA 1 114 GLU H . . 4.430 4.237 4.101 4.314 . 0 0 "[ . 1 . 2]" 1
2352 1 102 THR HA 1 117 CYS HG . . 4.330 3.492 3.171 3.855 . 0 0 "[ . 1 . 2]" 1
2353 1 102 THR HB 1 103 LEU H . . 4.730 4.329 4.261 4.421 . 0 0 "[ . 1 . 2]" 1
2354 1 102 THR HG1 1 103 LEU H . . 4.600 4.483 4.305 4.601 0.001 6 0 "[ . 1 . 2]" 1
2355 1 102 THR HG1 1 113 VAL MG1 . . 4.160 2.990 2.622 3.437 . 0 0 "[ . 1 . 2]" 1
2356 1 102 THR HG1 1 113 VAL MG2 . . 5.410 4.776 4.388 5.311 . 0 0 "[ . 1 . 2]" 1
2357 1 102 THR MG 1 103 LEU H . . 3.210 2.941 2.743 3.097 . 0 0 "[ . 1 . 2]" 1
2358 1 102 THR MG 1 103 LEU HA . . 4.410 3.990 3.813 4.253 . 0 0 "[ . 1 . 2]" 1
2359 1 102 THR MG 1 104 LEU H . . 4.420 3.550 3.203 3.813 . 0 0 "[ . 1 . 2]" 1
2360 1 102 THR MG 1 104 LEU HB2 . . 3.550 3.159 2.965 3.302 . 0 0 "[ . 1 . 2]" 1
2361 1 102 THR MG 1 104 LEU HB3 . . 4.130 3.718 3.428 4.141 0.011 2 0 "[ . 1 . 2]" 1
2362 1 102 THR MG 1 111 LYS HB3 . . 4.430 4.180 4.034 4.334 . 0 0 "[ . 1 . 2]" 1
2363 1 102 THR MG 1 111 LYS QE . . 4.200 2.625 1.821 4.233 0.033 2 0 "[ . 1 . 2]" 1
2364 1 102 THR MG 1 113 VAL MG1 . . 3.880 3.610 3.173 3.872 . 0 0 "[ . 1 . 2]" 1
2365 1 102 THR MG 1 113 VAL MG2 . . 4.730 3.833 3.310 4.040 . 0 0 "[ . 1 . 2]" 1
2366 1 103 LEU H 1 103 LEU HB2 . . 3.730 2.766 2.718 2.841 . 0 0 "[ . 1 . 2]" 1
2367 1 103 LEU H 1 103 LEU HB3 . . 3.580 2.498 2.455 2.538 . 0 0 "[ . 1 . 2]" 1
2368 1 103 LEU H 1 103 LEU MD1 . . 4.570 4.238 4.177 4.269 . 0 0 "[ . 1 . 2]" 1
2369 1 103 LEU H 1 103 LEU MD2 . . 4.380 4.296 4.237 4.347 . 0 0 "[ . 1 . 2]" 1
2370 1 103 LEU H 1 104 LEU H . . 4.910 4.135 4.080 4.211 . 0 0 "[ . 1 . 2]" 1
2371 1 103 LEU H 1 112 LEU HB2 . . 4.150 3.530 3.296 3.680 . 0 0 "[ . 1 . 2]" 1
2372 1 103 LEU H 1 113 VAL HA . . 4.310 3.548 3.477 3.637 . 0 0 "[ . 1 . 2]" 1
2373 1 103 LEU H 1 113 VAL MG1 . . 5.100 4.888 4.763 4.980 . 0 0 "[ . 1 . 2]" 1
2374 1 103 LEU H 1 113 VAL MG2 . . 5.360 4.897 4.772 5.025 . 0 0 "[ . 1 . 2]" 1
2375 1 103 LEU H 1 114 GLU H . . 5.500 5.507 5.455 5.524 0.024 2 0 "[ . 1 . 2]" 1
2376 1 103 LEU H 1 117 CYS HG . . 4.320 3.161 2.913 3.481 . 0 0 "[ . 1 . 2]" 1
2377 1 103 LEU HA 1 103 LEU MD1 . . 3.140 2.159 2.003 2.378 . 0 0 "[ . 1 . 2]" 1
2378 1 103 LEU HA 1 103 LEU MD2 . . 4.460 3.909 3.876 3.925 . 0 0 "[ . 1 . 2]" 1
2379 1 103 LEU HA 1 103 LEU HG . . 4.260 3.041 2.971 3.153 . 0 0 "[ . 1 . 2]" 1
2380 1 103 LEU HA 1 104 LEU H . . 3.000 2.203 2.178 2.219 . 0 0 "[ . 1 . 2]" 1
2381 1 103 LEU HA 1 104 LEU HB2 . . 5.500 5.066 4.959 5.150 . 0 0 "[ . 1 . 2]" 1
2382 1 103 LEU HA 1 112 LEU HB2 . . 5.500 4.977 4.909 5.064 . 0 0 "[ . 1 . 2]" 1
2383 1 103 LEU HB2 1 103 LEU MD1 . . 3.200 2.284 2.152 2.364 . 0 0 "[ . 1 . 2]" 1
2384 1 103 LEU HB2 1 103 LEU MD2 . . 3.540 2.444 2.380 2.521 . 0 0 "[ . 1 . 2]" 1
2385 1 103 LEU HB2 1 117 CYS HA . . 4.610 4.567 4.430 4.615 0.005 6 0 "[ . 1 . 2]" 1
2386 1 103 LEU HB3 1 103 LEU MD1 . . 3.660 3.185 3.169 3.196 . 0 0 "[ . 1 . 2]" 1
2387 1 103 LEU HB3 1 103 LEU MD2 . . 3.460 2.242 2.142 2.332 . 0 0 "[ . 1 . 2]" 1
2388 1 103 LEU HB3 1 104 LEU H . . 4.770 4.426 4.397 4.448 . 0 0 "[ . 1 . 2]" 1
2389 1 103 LEU HB3 1 104 LEU HA . . 5.500 4.890 4.857 4.947 . 0 0 "[ . 1 . 2]" 1
2390 1 103 LEU HB3 1 112 LEU H . . 4.380 2.528 2.312 2.905 . 0 0 "[ . 1 . 2]" 1
2391 1 103 LEU HB3 1 112 LEU HB3 . . 4.220 3.751 3.729 3.814 . 0 0 "[ . 1 . 2]" 1
2392 1 103 LEU HB3 1 112 LEU MD1 . . 3.950 3.415 3.134 3.648 . 0 0 "[ . 1 . 2]" 1
2393 1 103 LEU HB3 1 123 VAL MG2 . . 5.500 5.335 5.129 5.466 . 0 0 "[ . 1 . 2]" 1
2394 1 103 LEU HB3 1 126 ILE MG . . 5.470 4.896 4.693 5.073 . 0 0 "[ . 1 . 2]" 1
2395 1 103 LEU MD1 1 104 LEU H . . 3.440 3.332 3.095 3.440 . 9 0 "[ . 1 . 2]" 1
2396 1 103 LEU MD1 1 126 ILE MD . . 4.990 4.410 4.166 4.801 . 0 0 "[ . 1 . 2]" 1
2397 1 103 LEU MD1 1 127 PHE QE . . 4.420 3.798 3.457 4.057 . 0 0 "[ . 1 . 2]" 1
2398 1 103 LEU MD1 1 127 PHE HZ . . 3.570 3.268 3.058 3.563 . 0 0 "[ . 1 . 2]" 1
2399 1 103 LEU MD2 1 104 LEU H . . 5.220 5.081 4.995 5.130 . 0 0 "[ . 1 . 2]" 1
2400 1 103 LEU MD2 1 112 LEU H . . 4.190 3.765 3.443 4.101 . 0 0 "[ . 1 . 2]" 1
2401 1 103 LEU MD2 1 112 LEU HB2 . . 4.260 2.552 2.317 2.850 . 0 0 "[ . 1 . 2]" 1
2402 1 103 LEU MD2 1 123 VAL HA . . 4.210 3.595 3.374 3.736 . 0 0 "[ . 1 . 2]" 1
2403 1 103 LEU MD2 1 123 VAL MG2 . . 3.450 3.274 3.008 3.444 . 0 0 "[ . 1 . 2]" 1
2404 1 103 LEU MD2 1 126 ILE HB . . 5.080 4.274 4.095 4.544 . 0 0 "[ . 1 . 2]" 1
2405 1 103 LEU MD2 1 126 ILE MG . . 2.990 2.511 2.221 2.759 . 0 0 "[ . 1 . 2]" 1
2406 1 103 LEU MD2 1 127 PHE QE . . 4.370 3.336 2.939 3.524 . 0 0 "[ . 1 . 2]" 1
2407 1 103 LEU MD2 1 127 PHE HZ . . 4.200 2.760 2.353 3.016 . 0 0 "[ . 1 . 2]" 1
2408 1 103 LEU HG 1 104 LEU H . . 3.880 3.802 3.663 3.885 0.005 6 0 "[ . 1 . 2]" 1
2409 1 103 LEU HG 1 104 LEU HA . . 5.190 4.325 4.259 4.387 . 0 0 "[ . 1 . 2]" 1
2410 1 103 LEU HG 1 112 LEU HB2 . . 4.850 4.080 3.986 4.215 . 0 0 "[ . 1 . 2]" 1
2411 1 104 LEU H 1 104 LEU HB2 . . 3.540 3.139 3.017 3.198 . 0 0 "[ . 1 . 2]" 1
2412 1 104 LEU H 1 104 LEU HB3 . . 3.560 2.266 2.224 2.299 . 0 0 "[ . 1 . 2]" 1
2413 1 104 LEU H 1 104 LEU MD1 . . 4.440 4.359 4.279 4.401 . 0 0 "[ . 1 . 2]" 1
2414 1 104 LEU H 1 104 LEU MD2 . . 5.060 4.112 4.035 4.240 . 0 0 "[ . 1 . 2]" 1
2415 1 104 LEU H 1 104 LEU HG . . 4.450 4.095 4.013 4.210 . 0 0 "[ . 1 . 2]" 1
2416 1 104 LEU H 1 105 LYS H . . 4.820 4.477 4.423 4.507 . 0 0 "[ . 1 . 2]" 1
2417 1 104 LEU H 1 112 LEU H . . 5.500 4.820 4.619 4.907 . 0 0 "[ . 1 . 2]" 1
2418 1 104 LEU HA 1 104 LEU MD1 . . 3.400 2.331 2.121 2.452 . 0 0 "[ . 1 . 2]" 1
2419 1 104 LEU HA 1 104 LEU MD2 . . 4.440 4.008 3.953 4.036 . 0 0 "[ . 1 . 2]" 1
2420 1 104 LEU HA 1 105 LYS H . . 2.940 2.161 2.142 2.177 . 0 0 "[ . 1 . 2]" 1
2421 1 104 LEU HA 1 111 LYS HA . . 3.460 2.793 2.497 2.963 . 0 0 "[ . 1 . 2]" 1
2422 1 104 LEU HA 1 111 LYS HB2 . . 4.200 2.804 2.619 3.041 . 0 0 "[ . 1 . 2]" 1
2423 1 104 LEU HA 1 111 LYS HB3 . . 4.090 2.381 1.983 2.630 . 0 0 "[ . 1 . 2]" 1
2424 1 104 LEU HA 1 112 LEU H . . 4.010 3.810 3.589 3.953 . 0 0 "[ . 1 . 2]" 1
2425 1 104 LEU HA 1 126 ILE MD . . 4.590 4.314 4.148 4.527 . 0 0 "[ . 1 . 2]" 1
2426 1 104 LEU HB2 1 104 LEU MD1 . . 3.350 2.308 2.208 2.397 . 0 0 "[ . 1 . 2]" 1
2427 1 104 LEU HB2 1 105 LYS H . . 4.270 3.949 3.848 4.069 . 0 0 "[ . 1 . 2]" 1
2428 1 104 LEU HB2 1 111 LYS HA . . 5.180 4.788 4.468 5.063 . 0 0 "[ . 1 . 2]" 1
2429 1 104 LEU HB2 1 111 LYS HG2 . . 5.170 4.480 3.946 4.853 . 0 0 "[ . 1 . 2]" 1
2430 1 104 LEU HB3 1 104 LEU MD2 . . 3.360 2.143 2.086 2.292 . 0 0 "[ . 1 . 2]" 1
2431 1 104 LEU HB3 1 105 LYS H . . 4.470 4.331 4.293 4.418 . 0 0 "[ . 1 . 2]" 1
2432 1 104 LEU MD1 1 105 LYS H . . 3.440 2.301 2.019 2.611 . 0 0 "[ . 1 . 2]" 1
2433 1 104 LEU MD1 1 105 LYS HG2 . . 5.500 5.159 4.703 5.419 . 0 0 "[ . 1 . 2]" 1
2434 1 104 LEU MD1 1 106 TYR H . . 4.460 4.031 3.815 4.172 . 0 0 "[ . 1 . 2]" 1
2435 1 104 LEU MD1 1 106 TYR HA . . 3.610 3.339 3.195 3.538 . 0 0 "[ . 1 . 2]" 1
2436 1 104 LEU MD1 1 106 TYR HB2 . . 5.270 5.009 4.850 5.161 . 0 0 "[ . 1 . 2]" 1
2437 1 104 LEU MD1 1 106 TYR QD . . 4.430 4.051 3.862 4.210 . 0 0 "[ . 1 . 2]" 1
2438 1 104 LEU MD1 1 106 TYR QE . . 5.500 5.466 5.343 5.518 0.018 2 0 "[ . 1 . 2]" 1
2439 1 104 LEU MD1 1 107 GLY H . . 4.250 3.871 3.709 4.129 . 0 0 "[ . 1 . 2]" 1
2440 1 104 LEU MD1 1 108 THR H . . 4.580 4.088 3.887 4.264 . 0 0 "[ . 1 . 2]" 1
2441 1 104 LEU MD1 1 110 GLN H . . 4.780 4.612 4.326 4.723 . 0 0 "[ . 1 . 2]" 1
2442 1 104 LEU MD1 1 111 LYS HA . . 4.340 3.982 3.685 4.141 . 0 0 "[ . 1 . 2]" 1
2443 1 104 LEU MD1 1 111 LYS HB2 . . 3.980 3.827 3.519 3.990 0.010 15 0 "[ . 1 . 2]" 1
2444 1 104 LEU MD1 1 111 LYS HB3 . . 4.020 2.590 2.038 2.855 . 0 0 "[ . 1 . 2]" 1
2445 1 104 LEU MD1 1 111 LYS QE . . 5.170 4.776 4.352 5.193 0.023 2 0 "[ . 1 . 2]" 1
2446 1 104 LEU MD1 1 126 ILE MD . . 5.500 4.912 4.731 5.110 . 0 0 "[ . 1 . 2]" 1
2447 1 104 LEU MD2 1 106 TYR HA . . 4.050 3.556 3.430 3.685 . 0 0 "[ . 1 . 2]" 1
2448 1 104 LEU MD2 1 106 TYR QD . . 3.410 2.809 2.670 3.004 . 0 0 "[ . 1 . 2]" 1
2449 1 104 LEU MD2 1 106 TYR QE . . 4.080 4.001 3.872 4.084 0.004 5 0 "[ . 1 . 2]" 1
2450 1 104 LEU MD2 1 107 GLY H . . 5.290 4.827 4.709 4.962 . 0 0 "[ . 1 . 2]" 1
2451 1 104 LEU HG 1 105 LYS H . . 3.570 3.266 3.119 3.496 . 0 0 "[ . 1 . 2]" 1
2452 1 104 LEU HG 1 106 TYR H . . 4.260 3.142 2.989 3.366 . 0 0 "[ . 1 . 2]" 1
2453 1 104 LEU HG 1 106 TYR HA . . 3.700 3.327 3.216 3.468 . 0 0 "[ . 1 . 2]" 1
2454 1 104 LEU HG 1 106 TYR QD . . 4.420 3.703 3.506 3.833 . 0 0 "[ . 1 . 2]" 1
2455 1 104 LEU HG 1 107 GLY H . . 5.390 4.934 4.784 5.189 . 0 0 "[ . 1 . 2]" 1
2456 1 105 LYS H 1 105 LYS HB2 . . 3.530 2.784 2.657 3.040 . 0 0 "[ . 1 . 2]" 1
2457 1 105 LYS H 1 105 LYS HB3 . . 3.290 2.477 2.311 2.613 . 0 0 "[ . 1 . 2]" 1
2458 1 105 LYS H 1 106 TYR H . . 4.810 4.077 4.001 4.195 . 0 0 "[ . 1 . 2]" 1
2459 1 105 LYS H 1 110 GLN HB3 . . 5.500 5.200 4.844 5.474 . 0 0 "[ . 1 . 2]" 1
2460 1 105 LYS H 1 111 LYS HA . . 3.990 3.189 2.941 3.376 . 0 0 "[ . 1 . 2]" 1
2461 1 105 LYS H 1 111 LYS HB2 . . 4.910 4.411 4.231 4.566 . 0 0 "[ . 1 . 2]" 1
2462 1 105 LYS H 1 111 LYS HB3 . . 4.370 3.344 2.979 3.546 . 0 0 "[ . 1 . 2]" 1
2463 1 105 LYS H 1 126 ILE MD . . 3.770 3.589 3.399 3.772 0.002 5 0 "[ . 1 . 2]" 1
2464 1 105 LYS HA 1 105 LYS HG2 . . 4.010 3.240 3.087 3.329 . 0 0 "[ . 1 . 2]" 1
2465 1 105 LYS HA 1 106 TYR H . . 3.020 2.238 2.184 2.268 . 0 0 "[ . 1 . 2]" 1
2466 1 105 LYS HA 1 106 TYR HB2 . . 5.500 4.373 4.326 4.395 . 0 0 "[ . 1 . 2]" 1
2467 1 105 LYS HB2 1 105 LYS HD2 . . 3.950 2.460 2.318 2.833 . 0 0 "[ . 1 . 2]" 1
2468 1 105 LYS HB2 1 106 TYR H . . 4.690 4.536 4.366 4.574 . 0 0 "[ . 1 . 2]" 1
2469 1 105 LYS HB2 1 110 GLN H . . 5.500 5.337 5.189 5.515 0.015 2 0 "[ . 1 . 2]" 1
2470 1 105 LYS HB2 1 126 ILE MD . . 4.540 2.432 2.068 2.915 . 0 0 "[ . 1 . 2]" 1
2471 1 105 LYS HB3 1 106 TYR H . . 4.500 4.471 4.400 4.534 0.034 5 0 "[ . 1 . 2]" 1
2472 1 105 LYS HB3 1 108 THR H . . 4.670 3.572 3.411 4.121 . 0 0 "[ . 1 . 2]" 1
2473 1 105 LYS HB3 1 110 GLN H . . 5.280 3.862 3.748 4.032 . 0 0 "[ . 1 . 2]" 1
2474 1 105 LYS HB3 1 111 LYS HA . . 4.730 4.506 4.210 4.725 . 0 0 "[ . 1 . 2]" 1
2475 1 105 LYS HB3 1 126 ILE MD . . 3.890 3.220 3.020 3.462 . 0 0 "[ . 1 . 2]" 1
2476 1 105 LYS HD2 1 110 GLN QE . . 5.340 4.202 2.723 4.879 . 0 0 "[ . 1 . 2]" 1
2477 1 105 LYS HD3 1 108 THR H . . 4.970 4.537 4.136 4.807 . 0 0 "[ . 1 . 2]" 1
2478 1 105 LYS HD3 1 108 THR MG . . 3.570 3.381 2.625 3.566 . 0 0 "[ . 1 . 2]" 1
2479 1 105 LYS HD3 1 110 GLN H . . 4.880 4.650 4.344 4.882 0.002 5 0 "[ . 1 . 2]" 1
2480 1 105 LYS HD3 1 110 GLN HB2 . . 4.690 3.272 2.874 3.682 . 0 0 "[ . 1 . 2]" 1
2481 1 105 LYS HD3 1 110 GLN HE21 . . 5.500 3.538 2.840 4.036 . 0 0 "[ . 1 . 2]" 1
2482 1 105 LYS HD3 1 110 GLN QE . . 4.650 3.424 2.798 3.922 . 0 0 "[ . 1 . 2]" 1
2483 1 105 LYS HD3 1 110 GLN HE22 . . 5.500 4.664 4.047 5.334 . 0 0 "[ . 1 . 2]" 1
2484 1 105 LYS HD3 1 110 GLN QG . . 5.310 4.909 4.458 5.313 0.003 2 0 "[ . 1 . 2]" 1
2485 1 105 LYS QE 1 105 LYS HG3 . . 3.240 2.380 2.058 2.574 . 0 0 "[ . 1 . 2]" 1
2486 1 105 LYS QE 1 108 THR MG . . 4.150 3.569 2.681 4.033 . 0 0 "[ . 1 . 2]" 1
2487 1 105 LYS QE 1 126 ILE HG12 . . 4.650 4.000 3.598 4.495 . 0 0 "[ . 1 . 2]" 1
2488 1 105 LYS HE2 1 105 LYS HG2 . . 3.950 2.763 2.247 4.058 0.108 5 0 "[ . 1 . 2]" 1
2489 1 105 LYS HE3 1 105 LYS HG2 . . 3.950 3.513 2.879 3.816 . 0 0 "[ . 1 . 2]" 1
2490 1 105 LYS HG2 1 106 TYR H . . 4.600 4.115 3.751 4.250 . 0 0 "[ . 1 . 2]" 1
2491 1 105 LYS HG2 1 108 THR MG . . 4.300 3.554 3.231 3.804 . 0 0 "[ . 1 . 2]" 1
2492 1 105 LYS HG3 1 106 TYR H . . 4.050 3.933 3.797 4.057 0.007 2 0 "[ . 1 . 2]" 1
2493 1 105 LYS HG3 1 126 ILE MD . . 5.460 4.429 4.138 4.823 . 0 0 "[ . 1 . 2]" 1
2494 1 106 TYR H 1 106 TYR HB2 . . 3.210 2.180 2.160 2.193 . 0 0 "[ . 1 . 2]" 1
2495 1 106 TYR H 1 106 TYR HB3 . . 3.320 2.996 2.969 3.033 . 0 0 "[ . 1 . 2]" 1
2496 1 106 TYR H 1 106 TYR QD . . 4.190 3.826 3.778 3.860 . 0 0 "[ . 1 . 2]" 1
2497 1 106 TYR H 1 107 GLY H . . 4.680 4.407 4.347 4.520 . 0 0 "[ . 1 . 2]" 1
2498 1 106 TYR HA 1 106 TYR QD . . 3.570 2.174 1.996 2.498 . 0 0 "[ . 1 . 2]" 1
2499 1 106 TYR HA 1 106 TYR QE . . 4.910 4.227 4.147 4.344 . 0 0 "[ . 1 . 2]" 1
2500 1 106 TYR HA 1 107 GLY H . . 2.950 2.151 2.142 2.165 . 0 0 "[ . 1 . 2]" 1
2501 1 106 TYR HA 1 107 GLY QA . . 4.490 3.901 3.896 3.920 . 0 0 "[ . 1 . 2]" 1
2502 1 106 TYR HA 1 108 THR H . . 3.980 3.843 3.604 3.978 . 0 0 "[ . 1 . 2]" 1
2503 1 106 TYR HB2 1 107 GLY H . . 4.560 4.536 4.447 4.572 0.012 15 0 "[ . 1 . 2]" 1
2504 1 106 TYR HB3 1 107 GLY H . . 4.780 4.144 3.979 4.223 . 0 0 "[ . 1 . 2]" 1
2505 1 106 TYR QD 1 107 GLY H . . 4.160 3.701 3.380 3.991 . 0 0 "[ . 1 . 2]" 1
2506 1 107 GLY H 1 108 THR H . . 3.100 2.582 2.331 2.785 . 0 0 "[ . 1 . 2]" 1
2507 1 107 GLY H 1 108 THR MG . . 5.140 4.781 4.540 4.926 . 0 0 "[ . 1 . 2]" 1
2508 1 107 GLY HA2 1 108 THR MG . . 4.810 4.182 3.943 4.374 . 0 0 "[ . 1 . 2]" 1
2509 1 107 GLY HA3 1 108 THR MG . . 4.810 3.329 3.146 3.542 . 0 0 "[ . 1 . 2]" 1
2510 1 108 THR H 1 108 THR HG1 . . 3.720 2.797 2.037 3.683 . 0 0 "[ . 1 . 2]" 1
2511 1 108 THR H 1 108 THR MG . . 3.170 2.949 2.853 3.107 . 0 0 "[ . 1 . 2]" 1
2512 1 108 THR H 1 109 PRO HD3 . . 5.200 4.910 4.834 4.953 . 0 0 "[ . 1 . 2]" 1
2513 1 108 THR H 1 110 GLN H . . 4.730 4.381 4.314 4.467 . 0 0 "[ . 1 . 2]" 1
2514 1 108 THR HA 1 108 THR MG . . 3.300 2.363 2.207 2.456 . 0 0 "[ . 1 . 2]" 1
2515 1 108 THR HA 1 109 PRO HD2 . . 3.400 2.338 2.311 2.376 . 0 0 "[ . 1 . 2]" 1
2516 1 108 THR HA 1 109 PRO HD3 . . 3.130 2.280 2.272 2.292 . 0 0 "[ . 1 . 2]" 1
2517 1 108 THR HA 1 109 PRO QG . . 4.300 3.964 3.948 3.987 . 0 0 "[ . 1 . 2]" 1
2518 1 108 THR HA 1 110 GLN H . . 4.410 3.806 3.787 3.838 . 0 0 "[ . 1 . 2]" 1
2519 1 108 THR HB 1 109 PRO HD2 . . 3.220 2.083 1.997 2.123 . 0 0 "[ . 1 . 2]" 1
2520 1 108 THR HB 1 109 PRO HD3 . . 3.560 3.524 3.445 3.557 . 0 0 "[ . 1 . 2]" 1
2521 1 108 THR HB 1 109 PRO QG . . 4.190 3.688 3.623 3.739 . 0 0 "[ . 1 . 2]" 1
2522 1 108 THR HB 1 110 GLN H . . 3.600 2.539 2.435 2.648 . 0 0 "[ . 1 . 2]" 1
2523 1 108 THR HB 1 110 GLN QG . . 4.230 3.424 3.171 3.812 . 0 0 "[ . 1 . 2]" 1
2524 1 108 THR HG1 1 110 GLN H . . 3.970 2.921 2.175 3.734 . 0 0 "[ . 1 . 2]" 1
2525 1 108 THR MG 1 109 PRO HD2 . . 4.070 3.127 2.948 3.290 . 0 0 "[ . 1 . 2]" 1
2526 1 108 THR MG 1 109 PRO HD3 . . 4.060 3.904 3.729 4.061 0.001 8 0 "[ . 1 . 2]" 1
2527 1 108 THR MG 1 109 PRO QG . . 4.890 4.576 4.434 4.696 . 0 0 "[ . 1 . 2]" 1
2528 1 108 THR MG 1 110 GLN H . . 4.320 4.092 4.062 4.112 . 0 0 "[ . 1 . 2]" 1
2529 1 108 THR MG 1 110 GLN HB2 . . 4.460 4.072 4.033 4.101 . 0 0 "[ . 1 . 2]" 1
2530 1 108 THR MG 1 110 GLN HB3 . . 5.500 5.457 5.400 5.504 0.004 9 0 "[ . 1 . 2]" 1
2531 1 108 THR MG 1 110 GLN QE . . 4.340 3.973 3.395 4.259 . 0 0 "[ . 1 . 2]" 1
2532 1 108 THR MG 1 110 GLN QG . . 4.850 4.423 4.182 4.811 . 0 0 "[ . 1 . 2]" 1
2533 1 109 PRO HB2 1 110 GLN HA . . 4.540 4.332 4.312 4.352 . 0 0 "[ . 1 . 2]" 1
2534 1 109 PRO HD2 1 110 GLN H . . 3.900 3.009 2.935 3.049 . 0 0 "[ . 1 . 2]" 1
2535 1 109 PRO HD2 1 110 GLN QG . . 4.380 3.952 3.722 4.162 . 0 0 "[ . 1 . 2]" 1
2536 1 109 PRO HD3 1 110 GLN H . . 4.430 4.033 3.995 4.054 . 0 0 "[ . 1 . 2]" 1
2537 1 109 PRO QG 1 110 GLN H . . 3.680 3.245 3.143 3.299 . 0 0 "[ . 1 . 2]" 1
2538 1 110 GLN H 1 110 GLN HB2 . . 3.170 2.213 2.179 2.265 . 0 0 "[ . 1 . 2]" 1
2539 1 110 GLN H 1 110 GLN HB3 . . 3.980 3.509 3.483 3.544 . 0 0 "[ . 1 . 2]" 1
2540 1 110 GLN H 1 110 GLN QG . . 3.140 2.915 2.754 3.059 . 0 0 "[ . 1 . 2]" 1
2541 1 110 GLN H 1 111 LYS H . . 4.490 4.442 4.353 4.495 0.005 15 0 "[ . 1 . 2]" 1
2542 1 110 GLN H 1 126 ILE MD . . 5.050 4.747 4.536 4.977 . 0 0 "[ . 1 . 2]" 1
2543 1 110 GLN HA 1 110 GLN QG . . 3.260 2.175 2.122 2.325 . 0 0 "[ . 1 . 2]" 1
2544 1 110 GLN HA 1 111 LYS H . . 2.630 2.141 2.138 2.156 . 0 0 "[ . 1 . 2]" 1
2545 1 110 GLN HA 1 111 LYS HG3 . . 4.490 3.771 3.464 4.021 . 0 0 "[ . 1 . 2]" 1
2546 1 110 GLN HA 1 126 ILE MD . . 4.450 4.104 3.769 4.309 . 0 0 "[ . 1 . 2]" 1
2547 1 110 GLN HB2 1 110 GLN QG . . 2.630 2.252 2.206 2.455 . 0 0 "[ . 1 . 2]" 1
2548 1 110 GLN HB2 1 111 LYS H . . 4.670 4.466 4.384 4.535 . 0 0 "[ . 1 . 2]" 1
2549 1 110 GLN HB2 1 126 ILE MD . . 4.160 3.442 3.148 3.706 . 0 0 "[ . 1 . 2]" 1
2550 1 110 GLN HB2 1 126 ILE HG13 . . 4.150 3.780 3.399 4.048 . 0 0 "[ . 1 . 2]" 1
2551 1 110 GLN HB3 1 110 GLN HE21 . . 4.750 2.752 2.152 3.207 . 0 0 "[ . 1 . 2]" 1
2552 1 110 GLN HB3 1 110 GLN QE . . 4.060 2.671 2.139 3.068 . 0 0 "[ . 1 . 2]" 1
2553 1 110 GLN HB3 1 110 GLN HE22 . . 4.750 3.691 3.566 3.910 . 0 0 "[ . 1 . 2]" 1
2554 1 110 GLN HB3 1 111 LYS H . . 3.970 3.570 3.424 3.762 . 0 0 "[ . 1 . 2]" 1
2555 1 110 GLN HB3 1 126 ILE MD . . 3.310 2.445 1.983 2.720 . 0 0 "[ . 1 . 2]" 1
2556 1 110 GLN HB3 1 126 ILE HG13 . . 3.950 2.874 2.276 3.201 . 0 0 "[ . 1 . 2]" 1
2557 1 110 GLN HB3 1 126 ILE MG . . 5.500 5.211 4.774 5.460 . 0 0 "[ . 1 . 2]" 1
2558 1 110 GLN QE 1 126 ILE HA . . 4.090 3.084 2.400 3.522 . 0 0 "[ . 1 . 2]" 1
2559 1 110 GLN QE 1 126 ILE HG13 . . 4.660 2.997 2.262 3.454 . 0 0 "[ . 1 . 2]" 1
2560 1 110 GLN HE21 1 126 ILE HA . . 4.910 3.997 2.949 4.632 . 0 0 "[ . 1 . 2]" 1
2561 1 110 GLN HE21 1 126 ILE MD . . 5.060 4.129 3.338 4.646 . 0 0 "[ . 1 . 2]" 1
2562 1 110 GLN HE21 1 126 ILE HG13 . . 5.310 3.291 2.288 3.859 . 0 0 "[ . 1 . 2]" 1
2563 1 110 GLN HE22 1 126 ILE HA . . 4.910 3.296 2.436 4.198 . 0 0 "[ . 1 . 2]" 1
2564 1 110 GLN HE22 1 126 ILE MD . . 5.060 4.659 4.283 4.948 . 0 0 "[ . 1 . 2]" 1
2565 1 110 GLN HE22 1 126 ILE HG13 . . 5.310 3.553 2.776 4.079 . 0 0 "[ . 1 . 2]" 1
2566 1 110 GLN QG 1 111 LYS H . . 4.960 3.873 3.759 3.988 . 0 0 "[ . 1 . 2]" 1
2567 1 110 GLN QG 1 126 ILE MD . . 4.840 4.204 3.913 4.457 . 0 0 "[ . 1 . 2]" 1
2568 1 110 GLN QG 1 126 ILE HG13 . . 5.310 4.567 3.942 4.964 . 0 0 "[ . 1 . 2]" 1
2569 1 111 LYS H 1 111 LYS HB3 . . 4.140 3.328 3.190 3.467 . 0 0 "[ . 1 . 2]" 1
2570 1 111 LYS H 1 111 LYS QD . . 3.980 3.419 3.009 3.764 . 0 0 "[ . 1 . 2]" 1
2571 1 111 LYS H 1 111 LYS HG2 . . 3.910 3.712 3.575 3.801 . 0 0 "[ . 1 . 2]" 1
2572 1 111 LYS H 1 111 LYS HG3 . . 3.510 2.130 1.917 2.280 . 0 0 "[ . 1 . 2]" 1
2573 1 111 LYS H 1 112 LEU H . . 4.560 4.406 4.346 4.450 . 0 0 "[ . 1 . 2]" 1
2574 1 111 LYS H 1 112 LEU MD2 . . 4.820 4.015 3.740 4.479 . 0 0 "[ . 1 . 2]" 1
2575 1 111 LYS H 1 126 ILE MD . . 4.010 3.763 3.391 3.991 . 0 0 "[ . 1 . 2]" 1
2576 1 111 LYS HA 1 111 LYS QD . . 4.770 3.751 3.646 4.093 . 0 0 "[ . 1 . 2]" 1
2577 1 111 LYS HA 1 111 LYS HG3 . . 4.250 3.600 3.517 3.633 . 0 0 "[ . 1 . 2]" 1
2578 1 111 LYS HA 1 112 LEU H . . 2.960 2.340 2.243 2.533 . 0 0 "[ . 1 . 2]" 1
2579 1 111 LYS HA 1 112 LEU HA . . 4.890 4.416 4.386 4.476 . 0 0 "[ . 1 . 2]" 1
2580 1 111 LYS HA 1 126 ILE MD . . 3.440 2.741 2.576 2.972 . 0 0 "[ . 1 . 2]" 1
2581 1 111 LYS HB2 1 111 LYS QE . . 4.690 2.744 2.180 3.953 . 0 0 "[ . 1 . 2]" 1
2582 1 111 LYS HB2 1 112 LEU H . . 3.520 2.609 2.160 2.871 . 0 0 "[ . 1 . 2]" 1
2583 1 111 LYS HB2 1 113 VAL MG2 . . 4.800 4.432 4.265 4.591 . 0 0 "[ . 1 . 2]" 1
2584 1 111 LYS HB3 1 111 LYS QD . . 3.640 3.356 3.205 3.493 . 0 0 "[ . 1 . 2]" 1
2585 1 111 LYS HB3 1 111 LYS QE . . 4.490 3.607 3.298 4.311 . 0 0 "[ . 1 . 2]" 1
2586 1 111 LYS HB3 1 112 LEU H . . 4.150 3.811 3.412 4.012 . 0 0 "[ . 1 . 2]" 1
2587 1 111 LYS QD 1 111 LYS HG3 . . 2.680 2.196 2.156 2.504 . 0 0 "[ . 1 . 2]" 1
2588 1 111 LYS QD 1 112 LEU H . . 4.930 3.289 2.799 3.604 . 0 0 "[ . 1 . 2]" 1
2589 1 111 LYS QD 1 113 VAL MG1 . . 4.870 4.176 3.896 4.768 . 0 0 "[ . 1 . 2]" 1
2590 1 111 LYS QD 1 113 VAL MG2 . . 3.690 2.427 2.134 2.907 . 0 0 "[ . 1 . 2]" 1
2591 1 111 LYS QD 1 126 ILE MD . . 5.500 5.164 4.974 5.506 0.006 2 0 "[ . 1 . 2]" 1
2592 1 111 LYS QE 1 111 LYS HG2 . . 3.620 2.410 2.094 3.340 . 0 0 "[ . 1 . 2]" 1
2593 1 111 LYS QE 1 111 LYS HG3 . . 3.670 3.134 2.178 3.545 . 0 0 "[ . 1 . 2]" 1
2594 1 111 LYS QE 1 113 VAL MG1 . . 4.880 3.786 3.066 4.690 . 0 0 "[ . 1 . 2]" 1
2595 1 111 LYS QE 1 113 VAL MG2 . . 3.940 2.675 2.013 3.358 . 0 0 "[ . 1 . 2]" 1
2596 1 111 LYS HG2 1 112 LEU H . . 5.200 5.004 4.730 5.192 . 0 0 "[ . 1 . 2]" 1
2597 1 111 LYS HG2 1 113 VAL MG2 . . 5.000 4.772 4.480 5.022 0.022 2 0 "[ . 1 . 2]" 1
2598 1 112 LEU H 1 112 LEU HB2 . . 3.580 2.684 2.607 2.821 . 0 0 "[ . 1 . 2]" 1
2599 1 112 LEU H 1 112 LEU HB3 . . 3.870 3.776 3.731 3.857 . 0 0 "[ . 1 . 2]" 1
2600 1 112 LEU H 1 112 LEU MD1 . . 4.210 4.051 3.928 4.214 0.004 5 0 "[ . 1 . 2]" 1
2601 1 112 LEU H 1 112 LEU MD2 . . 4.160 3.535 3.309 3.827 . 0 0 "[ . 1 . 2]" 1
2602 1 112 LEU H 1 112 LEU HG . . 3.640 2.795 2.629 2.993 . 0 0 "[ . 1 . 2]" 1
2603 1 112 LEU H 1 113 VAL H . . 4.510 4.306 4.227 4.410 . 0 0 "[ . 1 . 2]" 1
2604 1 112 LEU H 1 113 VAL MG2 . . 5.500 4.611 4.400 4.719 . 0 0 "[ . 1 . 2]" 1
2605 1 112 LEU H 1 126 ILE MD . . 3.890 3.533 3.227 3.831 . 0 0 "[ . 1 . 2]" 1
2606 1 112 LEU HA 1 112 LEU MD1 . . 4.190 3.871 3.819 3.913 . 0 0 "[ . 1 . 2]" 1
2607 1 112 LEU HA 1 112 LEU MD2 . . 2.990 2.030 1.965 2.217 . 0 0 "[ . 1 . 2]" 1
2608 1 112 LEU HA 1 113 VAL H . . 2.970 2.143 2.139 2.155 . 0 0 "[ . 1 . 2]" 1
2609 1 112 LEU HA 1 113 VAL HB . . 5.230 5.038 5.001 5.054 . 0 0 "[ . 1 . 2]" 1
2610 1 112 LEU HA 1 113 VAL MG2 . . 4.150 3.323 3.264 3.362 . 0 0 "[ . 1 . 2]" 1
2611 1 112 LEU HA 1 116 GLU QB . . 4.610 2.203 2.104 2.330 . 0 0 "[ . 1 . 2]" 1
2612 1 112 LEU HA 1 126 ILE MD . . 4.880 4.466 4.261 4.739 . 0 0 "[ . 1 . 2]" 1
2613 1 112 LEU HB2 1 112 LEU MD1 . . 3.540 2.346 2.223 2.476 . 0 0 "[ . 1 . 2]" 1
2614 1 112 LEU HB2 1 112 LEU MD2 . . 3.570 3.186 3.174 3.194 . 0 0 "[ . 1 . 2]" 1
2615 1 112 LEU HB2 1 113 VAL H . . 4.310 4.172 4.088 4.227 . 0 0 "[ . 1 . 2]" 1
2616 1 112 LEU HB2 1 116 GLU HB2 . . 4.590 3.527 3.408 3.736 . 0 0 "[ . 1 . 2]" 1
2617 1 112 LEU HB2 1 116 GLU QB . . 3.990 3.305 3.220 3.537 . 0 0 "[ . 1 . 2]" 1
2618 1 112 LEU HB2 1 116 GLU HB3 . . 4.590 3.998 3.773 4.371 . 0 0 "[ . 1 . 2]" 1
2619 1 112 LEU HB2 1 117 CYS HA . . 4.470 3.613 3.480 3.775 . 0 0 "[ . 1 . 2]" 1
2620 1 112 LEU HB2 1 117 CYS HG . . 4.750 3.519 3.046 4.331 . 0 0 "[ . 1 . 2]" 1
2621 1 112 LEU HB3 1 112 LEU MD1 . . 3.340 2.294 2.172 2.416 . 0 0 "[ . 1 . 2]" 1
2622 1 112 LEU HB3 1 112 LEU MD2 . . 3.360 2.397 2.318 2.478 . 0 0 "[ . 1 . 2]" 1
2623 1 112 LEU HB3 1 113 VAL H . . 3.840 3.380 3.240 3.492 . 0 0 "[ . 1 . 2]" 1
2624 1 112 LEU HB3 1 116 GLU H . . 4.820 4.357 4.274 4.426 . 0 0 "[ . 1 . 2]" 1
2625 1 112 LEU HB3 1 116 GLU HB2 . . 4.170 2.081 2.019 2.222 . 0 0 "[ . 1 . 2]" 1
2626 1 112 LEU HB3 1 116 GLU QB . . 3.660 1.924 1.855 2.122 . 0 0 "[ . 1 . 2]" 1
2627 1 112 LEU HB3 1 116 GLU HB3 . . 4.170 2.280 2.039 2.690 . 0 0 "[ . 1 . 2]" 1
2628 1 112 LEU HB3 1 117 CYS H . . 4.730 3.913 3.814 4.010 . 0 0 "[ . 1 . 2]" 1
2629 1 112 LEU HB3 1 117 CYS HA . . 4.320 3.378 3.170 3.521 . 0 0 "[ . 1 . 2]" 1
2630 1 112 LEU HB3 1 123 VAL MG2 . . 4.840 4.334 4.108 4.667 . 0 0 "[ . 1 . 2]" 1
2631 1 112 LEU HB3 1 126 ILE MD . . 4.910 4.605 4.354 4.882 . 0 0 "[ . 1 . 2]" 1
2632 1 112 LEU MD1 1 113 VAL H . . 5.500 5.135 5.031 5.195 . 0 0 "[ . 1 . 2]" 1
2633 1 112 LEU MD1 1 116 GLU HA . . 4.970 4.497 4.275 4.800 . 0 0 "[ . 1 . 2]" 1
2634 1 112 LEU MD1 1 116 GLU QB . . 4.140 3.181 2.917 3.478 . 0 0 "[ . 1 . 2]" 1
2635 1 112 LEU MD1 1 117 CYS H . . 5.210 4.912 4.821 5.100 . 0 0 "[ . 1 . 2]" 1
2636 1 112 LEU MD1 1 117 CYS HA . . 3.820 3.253 3.079 3.452 . 0 0 "[ . 1 . 2]" 1
2637 1 112 LEU MD1 1 122 LEU HA . . 4.760 4.141 3.867 4.441 . 0 0 "[ . 1 . 2]" 1
2638 1 112 LEU MD1 1 122 LEU HB2 . . 4.040 3.161 2.797 3.469 . 0 0 "[ . 1 . 2]" 1
2639 1 112 LEU MD1 1 122 LEU QB . . 3.420 2.461 2.029 2.800 . 0 0 "[ . 1 . 2]" 1
2640 1 112 LEU MD1 1 122 LEU HB3 . . 4.040 2.577 2.083 2.955 . 0 0 "[ . 1 . 2]" 1
2641 1 112 LEU MD1 1 122 LEU MD1 . . 4.170 3.757 3.336 4.050 . 0 0 "[ . 1 . 2]" 1
2642 1 112 LEU MD1 1 123 VAL H . . 4.380 3.378 3.118 3.698 . 0 0 "[ . 1 . 2]" 1
2643 1 112 LEU MD1 1 123 VAL HA . . 3.270 2.290 2.071 2.488 . 0 0 "[ . 1 . 2]" 1
2644 1 112 LEU MD1 1 125 MET H . . 5.120 4.637 4.314 4.908 . 0 0 "[ . 1 . 2]" 1
2645 1 112 LEU MD1 1 126 ILE H . . 4.460 3.596 3.321 3.786 . 0 0 "[ . 1 . 2]" 1
2646 1 112 LEU MD1 1 126 ILE HA . . 5.480 4.798 4.546 5.053 . 0 0 "[ . 1 . 2]" 1
2647 1 112 LEU MD1 1 126 ILE HB . . 3.830 2.701 2.215 3.012 . 0 0 "[ . 1 . 2]" 1
2648 1 112 LEU MD1 1 126 ILE MG . . 3.530 2.016 1.872 2.180 . 0 0 "[ . 1 . 2]" 1
2649 1 112 LEU MD2 1 113 VAL H . . 3.810 3.718 3.548 3.809 . 0 0 "[ . 1 . 2]" 1
2650 1 112 LEU MD2 1 116 GLU H . . 5.210 5.054 4.842 5.199 . 0 0 "[ . 1 . 2]" 1
2651 1 112 LEU MD2 1 116 GLU HA . . 4.650 4.038 3.798 4.294 . 0 0 "[ . 1 . 2]" 1
2652 1 112 LEU MD2 1 116 GLU HB2 . . 3.570 2.963 2.757 3.175 . 0 0 "[ . 1 . 2]" 1
2653 1 112 LEU MD2 1 116 GLU QB . . 2.950 2.017 1.932 2.180 . 0 0 "[ . 1 . 2]" 1
2654 1 112 LEU MD2 1 116 GLU HB3 . . 3.570 2.054 1.968 2.221 . 0 0 "[ . 1 . 2]" 1
2655 1 112 LEU MD2 1 116 GLU HG2 . . 4.770 3.953 3.657 4.228 . 0 0 "[ . 1 . 2]" 1
2656 1 112 LEU MD2 1 116 GLU HG3 . . 4.550 4.168 3.941 4.376 . 0 0 "[ . 1 . 2]" 1
2657 1 112 LEU MD2 1 122 LEU H . . 5.500 5.303 5.026 5.492 . 0 0 "[ . 1 . 2]" 1
2658 1 112 LEU MD2 1 122 LEU HA . . 4.300 4.164 4.054 4.293 . 0 0 "[ . 1 . 2]" 1
2659 1 112 LEU MD2 1 122 LEU HB2 . . 3.890 3.424 2.955 3.755 . 0 0 "[ . 1 . 2]" 1
2660 1 112 LEU MD2 1 122 LEU QB . . 3.070 2.221 1.971 2.492 . 0 0 "[ . 1 . 2]" 1
2661 1 112 LEU MD2 1 122 LEU HB3 . . 3.890 2.250 1.989 2.536 . 0 0 "[ . 1 . 2]" 1
2662 1 112 LEU MD2 1 126 ILE HB . . 3.750 2.784 2.456 3.108 . 0 0 "[ . 1 . 2]" 1
2663 1 112 LEU MD2 1 126 ILE MD . . 3.630 2.470 2.181 2.689 . 0 0 "[ . 1 . 2]" 1
2664 1 112 LEU MD2 1 126 ILE HG13 . . 4.790 4.316 4.028 4.611 . 0 0 "[ . 1 . 2]" 1
2665 1 112 LEU MD2 1 126 ILE MG . . 4.360 3.502 3.223 3.895 . 0 0 "[ . 1 . 2]" 1
2666 1 112 LEU HG 1 123 VAL HA . . 5.310 4.814 4.531 5.079 . 0 0 "[ . 1 . 2]" 1
2667 1 112 LEU HG 1 126 ILE MD . . 3.260 2.058 1.895 2.326 . 0 0 "[ . 1 . 2]" 1
2668 1 112 LEU HG 1 126 ILE MG . . 3.740 3.310 2.818 3.723 . 0 0 "[ . 1 . 2]" 1
2669 1 113 VAL H 1 113 VAL HB . . 3.560 2.898 2.862 2.913 . 0 0 "[ . 1 . 2]" 1
2670 1 113 VAL H 1 113 VAL MG1 . . 3.940 3.752 3.726 3.780 . 0 0 "[ . 1 . 2]" 1
2671 1 113 VAL H 1 113 VAL MG2 . . 3.420 1.935 1.843 2.058 . 0 0 "[ . 1 . 2]" 1
2672 1 113 VAL H 1 115 SER QB . . 5.500 4.992 4.830 5.137 . 0 0 "[ . 1 . 2]" 1
2673 1 113 VAL H 1 116 GLU H . . 4.230 3.287 3.168 3.402 . 0 0 "[ . 1 . 2]" 1
2674 1 113 VAL H 1 116 GLU HA . . 5.500 4.753 4.711 4.846 . 0 0 "[ . 1 . 2]" 1
2675 1 113 VAL H 1 116 GLU HB2 . . 3.700 1.932 1.898 1.999 . 0 0 "[ . 1 . 2]" 1
2676 1 113 VAL H 1 116 GLU QB . . 3.140 1.922 1.890 1.987 . 0 0 "[ . 1 . 2]" 1
2677 1 113 VAL H 1 116 GLU HB3 . . 3.700 3.420 3.344 3.509 . 0 0 "[ . 1 . 2]" 1
2678 1 113 VAL H 1 116 GLU HG2 . . 4.800 3.924 3.785 4.216 . 0 0 "[ . 1 . 2]" 1
2679 1 113 VAL H 1 116 GLU HG3 . . 4.430 2.486 2.256 2.870 . 0 0 "[ . 1 . 2]" 1
2680 1 113 VAL H 1 117 CYS H . . 4.910 4.482 4.367 4.587 . 0 0 "[ . 1 . 2]" 1
2681 1 113 VAL H 1 117 CYS HG . . 4.650 3.913 3.310 4.567 . 0 0 "[ . 1 . 2]" 1
2682 1 113 VAL HA 1 113 VAL MG1 . . 3.340 2.021 2.008 2.044 . 0 0 "[ . 1 . 2]" 1
2683 1 113 VAL HA 1 113 VAL MG2 . . 3.540 2.643 2.623 2.662 . 0 0 "[ . 1 . 2]" 1
2684 1 113 VAL HA 1 114 GLU H . . 3.050 2.534 2.531 2.538 . 0 0 "[ . 1 . 2]" 1
2685 1 113 VAL HA 1 114 GLU HA . . 4.330 4.316 4.315 4.317 . 0 0 "[ . 1 . 2]" 1
2686 1 113 VAL HA 1 114 GLU QG . . 4.700 3.981 3.967 3.990 . 0 0 "[ . 1 . 2]" 1
2687 1 113 VAL HB 1 114 GLU H . . 4.000 2.869 2.842 2.910 . 0 0 "[ . 1 . 2]" 1
2688 1 113 VAL HB 1 114 GLU HB2 . . 4.490 4.237 4.223 4.276 . 0 0 "[ . 1 . 2]" 1
2689 1 113 VAL HB 1 114 GLU QG . . 4.030 3.923 3.842 3.980 . 0 0 "[ . 1 . 2]" 1
2690 1 113 VAL MG1 1 114 GLU H . . 3.780 1.900 1.846 1.932 . 0 0 "[ . 1 . 2]" 1
2691 1 113 VAL MG1 1 114 GLU HA . . 4.790 4.129 4.074 4.152 . 0 0 "[ . 1 . 2]" 1
2692 1 113 VAL MG1 1 114 GLU HB2 . . 4.480 3.499 3.399 3.605 . 0 0 "[ . 1 . 2]" 1
2693 1 113 VAL MG1 1 114 GLU QG . . 3.160 2.246 2.183 2.359 . 0 0 "[ . 1 . 2]" 1
2694 1 113 VAL MG1 1 115 SER H . . 4.720 3.566 3.486 3.610 . 0 0 "[ . 1 . 2]" 1
2695 1 113 VAL MG1 1 116 GLU H . . 4.900 4.462 4.371 4.556 . 0 0 "[ . 1 . 2]" 1
2696 1 113 VAL MG2 1 114 GLU H . . 4.360 3.915 3.902 3.920 . 0 0 "[ . 1 . 2]" 1
2697 1 113 VAL MG2 1 114 GLU HB2 . . 5.500 5.536 5.529 5.546 0.046 18 0 "[ . 1 . 2]" 1
2698 1 114 GLU H 1 114 GLU HB2 . . 4.140 2.943 2.932 2.969 . 0 0 "[ . 1 . 2]" 1
2699 1 114 GLU H 1 114 GLU QG . . 3.410 1.905 1.886 1.931 . 0 0 "[ . 1 . 2]" 1
2700 1 114 GLU H 1 115 SER H . . 4.900 3.253 3.185 3.297 . 0 0 "[ . 1 . 2]" 1
2701 1 114 GLU H 1 117 CYS H . . 5.060 4.609 4.564 4.732 . 0 0 "[ . 1 . 2]" 1
2702 1 114 GLU H 1 117 CYS HG . . 3.980 3.681 3.193 3.978 . 0 0 "[ . 1 . 2]" 1
2703 1 114 GLU HA 1 114 GLU QG . . 3.390 2.556 2.544 2.578 . 0 0 "[ . 1 . 2]" 1
2704 1 114 GLU HB2 1 115 SER H . . 2.930 2.092 2.011 2.233 . 0 0 "[ . 1 . 2]" 1
2705 1 114 GLU HB2 1 115 SER HA . . 4.550 3.992 3.980 4.004 . 0 0 "[ . 1 . 2]" 1
2706 1 114 GLU HB2 1 115 SER QB . . 4.460 3.872 3.609 4.310 . 0 0 "[ . 1 . 2]" 1
2707 1 114 GLU HB3 1 115 SER H . . 3.590 3.439 3.362 3.584 . 0 0 "[ . 1 . 2]" 1
2708 1 114 GLU HB3 1 115 SER HA . . 4.800 4.535 4.504 4.610 . 0 0 "[ . 1 . 2]" 1
2709 1 114 GLU HB3 1 115 SER QB . . 5.500 5.106 4.876 5.467 . 0 0 "[ . 1 . 2]" 1
2710 1 114 GLU QG 1 115 SER H . . 3.550 3.558 3.547 3.570 0.020 11 0 "[ . 1 . 2]" 1
2711 1 114 GLU QG 1 115 SER QB . . 5.500 5.112 4.943 5.444 . 0 0 "[ . 1 . 2]" 1
2712 1 114 GLU QG 1 116 GLU H . . 5.500 5.370 5.303 5.485 . 0 0 "[ . 1 . 2]" 1
2713 1 115 SER H 1 115 SER QB . . 3.330 2.263 2.140 2.542 . 0 0 "[ . 1 . 2]" 1
2714 1 115 SER H 1 116 GLU H . . 3.500 2.806 2.757 2.861 . 0 0 "[ . 1 . 2]" 1
2715 1 115 SER H 1 116 GLU HG3 . . 5.040 4.473 4.314 4.663 . 0 0 "[ . 1 . 2]" 1
2716 1 115 SER H 1 117 CYS H . . 4.900 3.824 3.746 3.870 . 0 0 "[ . 1 . 2]" 1
2717 1 115 SER HA 1 117 CYS H . . 4.180 3.782 3.643 3.852 . 0 0 "[ . 1 . 2]" 1
2718 1 115 SER HA 1 118 CYS H . . 3.860 3.621 3.501 3.803 . 0 0 "[ . 1 . 2]" 1
2719 1 115 SER HA 1 118 CYS HB2 . . 5.090 4.370 4.030 4.641 . 0 0 "[ . 1 . 2]" 1
2720 1 115 SER HA 1 118 CYS HB3 . . 4.480 3.265 3.043 3.551 . 0 0 "[ . 1 . 2]" 1
2721 1 115 SER HA 1 119 GLN HE22 . . 4.690 3.181 2.885 3.664 . 0 0 "[ . 1 . 2]" 1
2722 1 115 SER QB 1 116 GLU H . . 3.490 2.483 2.341 2.615 . 0 0 "[ . 1 . 2]" 1
2723 1 115 SER QB 1 116 GLU HG3 . . 4.180 3.296 3.063 3.527 . 0 0 "[ . 1 . 2]" 1
2724 1 115 SER QB 1 118 CYS HB3 . . 5.500 5.093 4.649 5.500 0.000 2 0 "[ . 1 . 2]" 1
2725 1 115 SER QB 1 119 GLN HE21 . . 4.450 3.373 2.600 4.188 . 0 0 "[ . 1 . 2]" 1
2726 1 116 GLU H 1 116 GLU QB . . 3.180 2.535 2.433 2.595 . 0 0 "[ . 1 . 2]" 1
2727 1 116 GLU H 1 116 GLU HG2 . . 3.320 3.005 2.817 3.269 . 0 0 "[ . 1 . 2]" 1
2728 1 116 GLU H 1 116 GLU HG3 . . 3.180 2.240 2.110 2.474 . 0 0 "[ . 1 . 2]" 1
2729 1 116 GLU H 1 117 CYS H . . 3.270 2.540 2.474 2.615 . 0 0 "[ . 1 . 2]" 1
2730 1 116 GLU H 1 117 CYS HA . . 5.320 5.095 5.017 5.157 . 0 0 "[ . 1 . 2]" 1
2731 1 116 GLU H 1 117 CYS QB . . 4.770 4.432 4.281 4.532 . 0 0 "[ . 1 . 2]" 1
2732 1 116 GLU H 1 118 CYS H . . 4.600 4.149 4.103 4.306 . 0 0 "[ . 1 . 2]" 1
2733 1 116 GLU H 1 122 LEU MD1 . . 5.140 4.125 3.959 4.289 . 0 0 "[ . 1 . 2]" 1
2734 1 116 GLU HA 1 116 GLU HG2 . . 3.360 2.525 2.425 2.587 . 0 0 "[ . 1 . 2]" 1
2735 1 116 GLU HA 1 116 GLU HG3 . . 3.690 3.401 3.272 3.506 . 0 0 "[ . 1 . 2]" 1
2736 1 116 GLU HA 1 118 CYS H . . 3.900 3.766 3.587 3.895 . 0 0 "[ . 1 . 2]" 1
2737 1 116 GLU HA 1 119 GLN H . . 4.220 3.335 3.256 3.395 . 0 0 "[ . 1 . 2]" 1
2738 1 116 GLU HA 1 119 GLN HB2 . . 3.650 2.565 2.464 2.780 . 0 0 "[ . 1 . 2]" 1
2739 1 116 GLU HA 1 119 GLN HB3 . . 4.450 4.143 4.029 4.402 . 0 0 "[ . 1 . 2]" 1
2740 1 116 GLU HA 1 119 GLN HE21 . . 3.930 3.818 3.666 3.930 . 18 0 "[ . 1 . 2]" 1
2741 1 116 GLU HA 1 119 GLN QG . . 3.850 3.683 3.488 3.851 0.001 10 0 "[ . 1 . 2]" 1
2742 1 116 GLU HA 1 122 LEU MD1 . . 3.340 1.932 1.876 2.027 . 0 0 "[ . 1 . 2]" 1
2743 1 116 GLU HA 1 122 LEU MD2 . . 5.250 4.430 4.235 4.646 . 0 0 "[ . 1 . 2]" 1
2744 1 116 GLU QB 1 117 CYS H . . 3.820 3.219 3.102 3.409 . 0 0 "[ . 1 . 2]" 1
2745 1 116 GLU QB 1 122 LEU MD1 . . 3.610 2.186 1.958 2.575 . 0 0 "[ . 1 . 2]" 1
2746 1 116 GLU HB2 1 122 LEU MD1 . . 4.250 3.566 3.337 3.868 . 0 0 "[ . 1 . 2]" 1
2747 1 116 GLU HB3 1 122 LEU MD1 . . 4.250 2.208 1.970 2.615 . 0 0 "[ . 1 . 2]" 1
2748 1 116 GLU HG2 1 122 LEU MD1 . . 3.120 2.384 1.963 2.615 . 0 0 "[ . 1 . 2]" 1
2749 1 116 GLU HG2 1 122 LEU MD2 . . 5.180 4.087 3.633 4.420 . 0 0 "[ . 1 . 2]" 1
2750 1 116 GLU HG3 1 117 CYS H . . 4.830 4.459 4.325 4.651 . 0 0 "[ . 1 . 2]" 1
2751 1 116 GLU HG3 1 122 LEU MD1 . . 3.890 3.701 3.299 3.896 0.006 1 0 "[ . 1 . 2]" 1
2752 1 117 CYS H 1 117 CYS QB . . 3.150 2.307 2.251 2.358 . 0 0 "[ . 1 . 2]" 1
2753 1 117 CYS H 1 117 CYS HG . . 3.410 3.183 2.915 3.410 . 0 0 "[ . 1 . 2]" 1
2754 1 117 CYS H 1 118 CYS H . . 3.240 2.275 2.164 2.379 . 0 0 "[ . 1 . 2]" 1
2755 1 117 CYS H 1 119 GLN H . . 4.500 3.741 3.590 3.922 . 0 0 "[ . 1 . 2]" 1
2756 1 117 CYS HA 1 117 CYS HG . . 4.140 3.484 3.033 3.982 . 0 0 "[ . 1 . 2]" 1
2757 1 117 CYS HA 1 119 GLN H . . 4.150 3.965 3.888 4.053 . 0 0 "[ . 1 . 2]" 1
2758 1 117 CYS HA 1 123 VAL HA . . 5.500 5.374 5.109 5.485 . 0 0 "[ . 1 . 2]" 1
2759 1 117 CYS HA 1 123 VAL MG2 . . 3.410 3.098 2.902 3.242 . 0 0 "[ . 1 . 2]" 1
2760 1 117 CYS QB 1 118 CYS H . . 3.900 3.147 3.013 3.304 . 0 0 "[ . 1 . 2]" 1
2761 1 117 CYS QB 1 118 CYS HB2 . . 4.430 4.154 4.059 4.262 . 0 0 "[ . 1 . 2]" 1
2762 1 117 CYS QB 1 123 VAL MG2 . . 4.760 4.440 4.308 4.602 . 0 0 "[ . 1 . 2]" 1
2763 1 117 CYS HG 1 118 CYS H . . 5.450 5.147 4.886 5.333 . 0 0 "[ . 1 . 2]" 1
2764 1 118 CYS H 1 118 CYS HB2 . . 3.680 3.025 2.905 3.126 . 0 0 "[ . 1 . 2]" 1
2765 1 118 CYS H 1 118 CYS HB3 . . 3.280 2.461 2.384 2.552 . 0 0 "[ . 1 . 2]" 1
2766 1 118 CYS H 1 119 GLN H . . 2.950 2.094 2.002 2.186 . 0 0 "[ . 1 . 2]" 1
2767 1 118 CYS H 1 119 GLN HA . . 4.890 4.722 4.655 4.769 . 0 0 "[ . 1 . 2]" 1
2768 1 118 CYS H 1 119 GLN HB2 . . 4.290 3.940 3.846 3.981 . 0 0 "[ . 1 . 2]" 1
2769 1 118 CYS H 1 119 GLN HB3 . . 5.500 5.474 5.382 5.515 0.015 10 0 "[ . 1 . 2]" 1
2770 1 118 CYS H 1 119 GLN QG . . 5.120 4.870 4.756 4.984 . 0 0 "[ . 1 . 2]" 1
2771 1 118 CYS H 1 122 LEU MD1 . . 5.500 4.786 4.306 4.950 . 0 0 "[ . 1 . 2]" 1
2772 1 118 CYS H 1 123 VAL MG2 . . 4.700 4.590 4.497 4.671 . 0 0 "[ . 1 . 2]" 1
2773 1 118 CYS HB2 1 119 GLN H . . 4.560 4.340 4.255 4.380 . 0 0 "[ . 1 . 2]" 1
2774 1 118 CYS HB3 1 119 GLN H . . 4.300 3.397 3.288 3.501 . 0 0 "[ . 1 . 2]" 1
2775 1 118 CYS HB3 1 119 GLN HE21 . . 4.710 3.701 3.211 4.210 . 0 0 "[ . 1 . 2]" 1
2776 1 118 CYS HB3 1 119 GLN HE22 . . 5.090 2.564 2.281 2.893 . 0 0 "[ . 1 . 2]" 1
2777 1 118 CYS HB3 1 119 GLN QG . . 4.940 4.849 4.724 4.943 0.003 1 0 "[ . 1 . 2]" 1
2778 1 119 GLN H 1 119 GLN HB2 . . 3.230 2.274 2.235 2.339 . 0 0 "[ . 1 . 2]" 1
2779 1 119 GLN H 1 119 GLN HB3 . . 3.830 3.535 3.498 3.589 . 0 0 "[ . 1 . 2]" 1
2780 1 119 GLN H 1 119 GLN QG . . 3.710 3.685 3.611 3.715 0.005 4 0 "[ . 1 . 2]" 1
2781 1 119 GLN H 1 120 SER H . . 4.490 4.096 3.980 4.436 . 0 0 "[ . 1 . 2]" 1
2782 1 119 GLN H 1 122 LEU H . . 5.410 4.929 4.757 5.076 . 0 0 "[ . 1 . 2]" 1
2783 1 119 GLN H 1 122 LEU MD1 . . 4.180 3.747 3.338 3.977 . 0 0 "[ . 1 . 2]" 1
2784 1 119 GLN H 1 123 VAL MG2 . . 3.870 3.702 3.454 3.845 . 0 0 "[ . 1 . 2]" 1
2785 1 119 GLN HA 1 119 GLN QG . . 3.520 2.673 2.588 2.727 . 0 0 "[ . 1 . 2]" 1
2786 1 119 GLN HA 1 120 SER H . . 2.760 2.221 2.141 2.260 . 0 0 "[ . 1 . 2]" 1
2787 1 119 GLN HA 1 120 SER HB2 . . 5.500 5.470 4.402 5.646 0.146 11 0 "[ . 1 . 2]" 1
2788 1 119 GLN HA 1 120 SER HB3 . . 5.500 5.050 4.259 5.158 . 0 0 "[ . 1 . 2]" 1
2789 1 119 GLN HA 1 121 SER H . . 4.390 3.780 3.499 3.987 . 0 0 "[ . 1 . 2]" 1
2790 1 119 GLN HA 1 121 SER QB . . 5.340 4.612 4.452 5.135 . 0 0 "[ . 1 . 2]" 1
2791 1 119 GLN HB2 1 120 SER H . . 4.960 4.573 4.401 4.595 . 0 0 "[ . 1 . 2]" 1
2792 1 119 GLN HB2 1 122 LEU H . . 4.190 3.774 3.581 3.922 . 0 0 "[ . 1 . 2]" 1
2793 1 119 GLN HB2 1 122 LEU QB . . 4.870 3.066 2.731 3.397 . 0 0 "[ . 1 . 2]" 1
2794 1 119 GLN HB2 1 122 LEU MD1 . . 3.260 2.103 1.917 2.416 . 0 0 "[ . 1 . 2]" 1
2795 1 119 GLN HB2 1 122 LEU HG . . 4.140 3.627 3.368 3.827 . 0 0 "[ . 1 . 2]" 1
2796 1 119 GLN HB2 1 123 VAL MG2 . . 4.680 4.501 4.209 4.680 0.000 6 0 "[ . 1 . 2]" 1
2797 1 119 GLN HB3 1 119 GLN HE21 . . 4.790 4.315 4.191 4.422 . 0 0 "[ . 1 . 2]" 1
2798 1 119 GLN HB3 1 120 SER H . . 4.090 3.952 3.438 4.053 . 0 0 "[ . 1 . 2]" 1
2799 1 119 GLN HB3 1 121 SER H . . 4.040 3.600 3.159 3.891 . 0 0 "[ . 1 . 2]" 1
2800 1 119 GLN HB3 1 121 SER QB . . 4.700 3.228 2.923 4.013 . 0 0 "[ . 1 . 2]" 1
2801 1 119 GLN HB3 1 122 LEU H . . 4.110 2.790 2.502 2.992 . 0 0 "[ . 1 . 2]" 1
2802 1 119 GLN HB3 1 122 LEU QB . . 4.880 3.246 2.804 3.641 . 0 0 "[ . 1 . 2]" 1
2803 1 119 GLN HB3 1 122 LEU MD1 . . 3.780 2.659 2.400 3.115 . 0 0 "[ . 1 . 2]" 1
2804 1 119 GLN HB3 1 122 LEU HG . . 4.030 2.979 2.657 3.272 . 0 0 "[ . 1 . 2]" 1
2805 1 119 GLN HE21 1 122 LEU MD1 . . 4.790 4.019 3.793 4.225 . 0 0 "[ . 1 . 2]" 1
2806 1 119 GLN QG 1 120 SER H . . 4.610 4.488 4.116 4.597 . 0 0 "[ . 1 . 2]" 1
2807 1 119 GLN QG 1 121 SER H . . 5.000 4.596 4.302 4.856 . 0 0 "[ . 1 . 2]" 1
2808 1 119 GLN QG 1 122 LEU H . . 4.840 4.552 4.248 4.743 . 0 0 "[ . 1 . 2]" 1
2809 1 119 GLN QG 1 122 LEU MD1 . . 3.560 2.800 2.315 3.107 . 0 0 "[ . 1 . 2]" 1
2810 1 119 GLN QG 1 122 LEU MD2 . . 5.110 4.874 4.604 5.064 . 0 0 "[ . 1 . 2]" 1
2811 1 119 GLN QG 1 122 LEU HG . . 4.300 4.088 3.848 4.286 . 0 0 "[ . 1 . 2]" 1
2812 1 120 SER H 1 120 SER HB2 . . 3.820 3.406 2.206 3.588 . 0 0 "[ . 1 . 2]" 1
2813 1 120 SER H 1 120 SER QB . . 3.000 2.687 2.150 2.808 . 0 0 "[ . 1 . 2]" 1
2814 1 120 SER H 1 120 SER HB3 . . 3.820 2.874 2.270 2.975 . 0 0 "[ . 1 . 2]" 1
2815 1 120 SER H 1 121 SER H . . 3.650 2.911 2.492 3.092 . 0 0 "[ . 1 . 2]" 1
2816 1 120 SER H 1 122 LEU H . . 4.960 4.326 4.116 4.451 . 0 0 "[ . 1 . 2]" 1
2817 1 120 SER QB 1 123 VAL H . . 4.680 4.600 4.494 4.684 0.004 1 0 "[ . 1 . 2]" 1
2818 1 120 SER QB 1 123 VAL HB . . 4.010 3.727 3.548 4.017 0.007 10 0 "[ . 1 . 2]" 1
2819 1 120 SER QB 1 123 VAL MG1 . . 5.040 4.477 4.291 4.817 . 0 0 "[ . 1 . 2]" 1
2820 1 120 SER QB 1 123 VAL MG2 . . 5.260 3.949 3.744 4.158 . 0 0 "[ . 1 . 2]" 1
2821 1 120 SER QB 1 124 GLU H . . 4.480 4.221 4.058 4.472 . 0 0 "[ . 1 . 2]" 1
2822 1 120 SER QB 1 124 GLU QB . . 4.810 4.087 3.849 4.626 . 0 0 "[ . 1 . 2]" 1
2823 1 120 SER HB2 1 123 VAL H . . 5.500 5.071 4.922 5.318 . 0 0 "[ . 1 . 2]" 1
2824 1 120 SER HB2 1 123 VAL HB . . 4.660 4.194 3.677 4.462 . 0 0 "[ . 1 . 2]" 1
2825 1 120 SER HB3 1 123 VAL H . . 5.500 5.281 5.005 5.412 . 0 0 "[ . 1 . 2]" 1
2826 1 120 SER HB3 1 123 VAL HB . . 4.660 4.196 3.964 4.668 0.008 13 0 "[ . 1 . 2]" 1
2827 1 121 SER H 1 121 SER HB2 . . 3.470 2.411 2.187 3.485 0.015 2 0 "[ . 1 . 2]" 1
2828 1 121 SER H 1 121 SER QB . . 2.980 2.246 2.143 2.861 . 0 0 "[ . 1 . 2]" 1
2829 1 121 SER H 1 121 SER HB3 . . 3.470 2.960 2.184 3.534 0.064 15 0 "[ . 1 . 2]" 1
2830 1 121 SER H 1 122 LEU H . . 3.420 2.888 2.731 2.991 . 0 0 "[ . 1 . 2]" 1
2831 1 121 SER H 1 123 VAL H . . 4.670 4.328 4.105 4.512 . 0 0 "[ . 1 . 2]" 1
2832 1 121 SER HA 1 123 VAL H . . 4.940 4.789 4.612 4.940 . 0 0 "[ . 1 . 2]" 1
2833 1 121 SER HA 1 124 GLU H . . 4.350 4.112 3.968 4.288 . 0 0 "[ . 1 . 2]" 1
2834 1 121 SER HA 1 124 GLU QB . . 4.640 4.362 4.196 4.631 . 0 0 "[ . 1 . 2]" 1
2835 1 121 SER HA 1 124 GLU HG2 . . 3.960 2.530 2.376 2.726 . 0 0 "[ . 1 . 2]" 1
2836 1 121 SER HA 1 124 GLU HG3 . . 4.830 3.655 3.321 3.922 . 0 0 "[ . 1 . 2]" 1
2837 1 121 SER QB 1 122 LEU H . . 3.780 2.733 2.530 3.372 . 0 0 "[ . 1 . 2]" 1
2838 1 121 SER QB 1 122 LEU MD1 . . 5.050 4.300 4.037 5.047 . 0 0 "[ . 1 . 2]" 1
2839 1 121 SER QB 1 122 LEU MD2 . . 4.440 4.144 3.820 4.412 . 0 0 "[ . 1 . 2]" 1
2840 1 121 SER QB 1 123 VAL H . . 5.340 4.825 4.674 5.291 . 0 0 "[ . 1 . 2]" 1
2841 1 122 LEU H 1 122 LEU HB2 . . 3.610 2.366 2.279 2.453 . 0 0 "[ . 1 . 2]" 1
2842 1 122 LEU H 1 122 LEU QB . . 2.980 2.335 2.253 2.415 . 0 0 "[ . 1 . 2]" 1
2843 1 122 LEU H 1 122 LEU HB3 . . 3.610 3.591 3.553 3.621 0.011 10 0 "[ . 1 . 2]" 1
2844 1 122 LEU H 1 122 LEU MD1 . . 3.900 3.537 3.347 3.742 . 0 0 "[ . 1 . 2]" 1
2845 1 122 LEU H 1 122 LEU MD2 . . 3.910 3.853 3.660 3.913 0.003 8 0 "[ . 1 . 2]" 1
2846 1 122 LEU H 1 122 LEU HG . . 3.150 2.674 2.452 2.815 . 0 0 "[ . 1 . 2]" 1
2847 1 122 LEU H 1 123 VAL H . . 3.110 2.416 2.227 2.543 . 0 0 "[ . 1 . 2]" 1
2848 1 122 LEU H 1 123 VAL HB . . 4.610 4.547 4.379 4.620 0.010 17 0 "[ . 1 . 2]" 1
2849 1 122 LEU H 1 123 VAL MG2 . . 4.570 3.888 3.730 4.231 . 0 0 "[ . 1 . 2]" 1
2850 1 122 LEU H 1 124 GLU H . . 4.580 4.101 3.909 4.279 . 0 0 "[ . 1 . 2]" 1
2851 1 122 LEU HA 1 122 LEU MD1 . . 4.130 3.890 3.849 3.914 . 0 0 "[ . 1 . 2]" 1
2852 1 122 LEU HA 1 122 LEU MD2 . . 3.050 2.230 1.977 2.406 . 0 0 "[ . 1 . 2]" 1
2853 1 122 LEU HA 1 122 LEU HG . . 3.890 2.869 2.811 3.002 . 0 0 "[ . 1 . 2]" 1
2854 1 122 LEU HA 1 125 MET H . . 4.120 3.286 3.164 3.465 . 0 0 "[ . 1 . 2]" 1
2855 1 122 LEU HA 1 125 MET HB3 . . 3.640 2.520 2.329 2.828 . 0 0 "[ . 1 . 2]" 1
2856 1 122 LEU HA 1 125 MET ME . . 4.100 3.272 2.650 3.902 . 0 0 "[ . 1 . 2]" 1
2857 1 122 LEU HA 1 125 MET QG . . 4.850 4.218 3.753 4.401 . 0 0 "[ . 1 . 2]" 1
2858 1 122 LEU QB 1 122 LEU MD1 . . 2.940 2.032 1.956 2.099 . 0 0 "[ . 1 . 2]" 1
2859 1 122 LEU QB 1 123 VAL H . . 3.290 2.518 2.366 2.693 . 0 0 "[ . 1 . 2]" 1
2860 1 122 LEU QB 1 123 VAL MG2 . . 3.860 3.268 3.095 3.450 . 0 0 "[ . 1 . 2]" 1
2861 1 122 LEU HB2 1 122 LEU MD1 . . 3.370 2.159 2.016 2.339 . 0 0 "[ . 1 . 2]" 1
2862 1 122 LEU HB2 1 122 LEU MD2 . . 3.280 3.168 3.144 3.193 . 0 0 "[ . 1 . 2]" 1
2863 1 122 LEU HB2 1 123 VAL H . . 3.980 2.581 2.412 2.768 . 0 0 "[ . 1 . 2]" 1
2864 1 122 LEU HB2 1 123 VAL MG2 . . 4.600 3.400 3.194 3.636 . 0 0 "[ . 1 . 2]" 1
2865 1 122 LEU HB3 1 122 LEU MD1 . . 3.370 2.515 2.369 2.647 . 0 0 "[ . 1 . 2]" 1
2866 1 122 LEU HB3 1 122 LEU MD2 . . 3.280 2.226 2.114 2.339 . 0 0 "[ . 1 . 2]" 1
2867 1 122 LEU HB3 1 123 VAL H . . 3.980 3.507 3.259 3.729 . 0 0 "[ . 1 . 2]" 1
2868 1 122 LEU HB3 1 123 VAL MG2 . . 4.600 4.245 4.032 4.450 . 0 0 "[ . 1 . 2]" 1
2869 1 122 LEU MD1 1 123 VAL H . . 4.550 4.339 4.086 4.516 . 0 0 "[ . 1 . 2]" 1
2870 1 122 LEU MD2 1 123 VAL H . . 4.980 4.749 4.664 4.841 . 0 0 "[ . 1 . 2]" 1
2871 1 122 LEU MD2 1 125 MET ME . . 3.350 2.525 1.937 3.095 . 0 0 "[ . 1 . 2]" 1
2872 1 122 LEU HG 1 123 VAL H . . 4.560 4.467 4.290 4.559 . 0 0 "[ . 1 . 2]" 1
2873 1 123 VAL H 1 123 VAL HB . . 3.050 2.543 2.420 2.626 . 0 0 "[ . 1 . 2]" 1
2874 1 123 VAL H 1 123 VAL MG2 . . 3.020 2.123 1.951 2.362 . 0 0 "[ . 1 . 2]" 1
2875 1 123 VAL H 1 124 GLU H . . 3.340 2.840 2.716 2.939 . 0 0 "[ . 1 . 2]" 1
2876 1 123 VAL H 1 124 GLU HG2 . . 4.630 4.279 4.085 4.497 . 0 0 "[ . 1 . 2]" 1
2877 1 123 VAL H 1 125 MET H . . 4.610 3.873 3.765 3.988 . 0 0 "[ . 1 . 2]" 1
2878 1 123 VAL HA 1 123 VAL MG1 . . 3.330 2.480 2.445 2.558 . 0 0 "[ . 1 . 2]" 1
2879 1 123 VAL HA 1 123 VAL MG2 . . 2.950 2.338 2.245 2.433 . 0 0 "[ . 1 . 2]" 1
2880 1 123 VAL HA 1 124 GLU HA . . 4.950 4.726 4.692 4.763 . 0 0 "[ . 1 . 2]" 1
2881 1 123 VAL HA 1 125 MET H . . 4.740 3.986 3.781 4.279 . 0 0 "[ . 1 . 2]" 1
2882 1 123 VAL HA 1 126 ILE H . . 4.170 3.876 3.702 4.101 . 0 0 "[ . 1 . 2]" 1
2883 1 123 VAL HA 1 126 ILE HB . . 4.390 4.155 3.937 4.340 . 0 0 "[ . 1 . 2]" 1
2884 1 123 VAL HA 1 126 ILE MG . . 3.380 2.330 2.051 2.731 . 0 0 "[ . 1 . 2]" 1
2885 1 123 VAL HA 1 127 PHE H . . 4.860 4.621 4.282 4.836 . 0 0 "[ . 1 . 2]" 1
2886 1 123 VAL HA 1 127 PHE QE . . 5.170 4.025 3.905 4.267 . 0 0 "[ . 1 . 2]" 1
2887 1 123 VAL HB 1 124 GLU H . . 3.270 2.494 2.306 2.664 . 0 0 "[ . 1 . 2]" 1
2888 1 123 VAL MG1 1 124 GLU H . . 3.660 3.275 2.936 3.445 . 0 0 "[ . 1 . 2]" 1
2889 1 123 VAL MG1 1 124 GLU HA . . 4.130 3.301 3.002 3.484 . 0 0 "[ . 1 . 2]" 1
2890 1 123 VAL MG1 1 125 MET H . . 4.810 4.590 4.380 4.761 . 0 0 "[ . 1 . 2]" 1
2891 1 123 VAL MG1 1 126 ILE MG . . 3.760 3.330 3.172 3.539 . 0 0 "[ . 1 . 2]" 1
2892 1 123 VAL MG1 1 127 PHE H . . 4.770 4.649 4.453 4.772 0.002 2 0 "[ . 1 . 2]" 1
2893 1 123 VAL MG1 1 127 PHE HB2 . . 5.500 4.329 4.195 4.641 . 0 0 "[ . 1 . 2]" 1
2894 1 123 VAL MG1 1 127 PHE QD . . 3.410 2.451 2.247 2.868 . 0 0 "[ . 1 . 2]" 1
2895 1 123 VAL MG1 1 127 PHE QE . . 3.310 1.865 1.800 1.980 . 0 0 "[ . 1 . 2]" 1
2896 1 123 VAL MG1 1 127 PHE HZ . . 4.600 3.412 2.958 3.700 . 0 0 "[ . 1 . 2]" 1
2897 1 123 VAL MG2 1 124 GLU H . . 4.110 3.825 3.755 3.950 . 0 0 "[ . 1 . 2]" 1
2898 1 123 VAL MG2 1 124 GLU HG2 . . 5.500 5.365 5.239 5.488 . 0 0 "[ . 1 . 2]" 1
2899 1 124 GLU H 1 124 GLU QB . . 3.340 2.489 2.427 2.551 . 0 0 "[ . 1 . 2]" 1
2900 1 124 GLU H 1 124 GLU HG2 . . 3.040 2.204 2.056 2.357 . 0 0 "[ . 1 . 2]" 1
2901 1 124 GLU H 1 124 GLU HG3 . . 3.510 3.272 3.081 3.448 . 0 0 "[ . 1 . 2]" 1
2902 1 124 GLU H 1 125 MET H . . 3.290 2.520 2.410 2.627 . 0 0 "[ . 1 . 2]" 1
2903 1 124 GLU H 1 126 ILE H . . 4.780 4.652 4.409 4.773 . 0 0 "[ . 1 . 2]" 1
2904 1 124 GLU HA 1 124 GLU HG2 . . 3.970 3.803 3.696 3.882 . 0 0 "[ . 1 . 2]" 1
2905 1 124 GLU HA 1 124 GLU HG3 . . 3.890 3.696 3.627 3.805 . 0 0 "[ . 1 . 2]" 1
2906 1 124 GLU HA 1 126 ILE H . . 5.430 4.977 4.707 5.174 . 0 0 "[ . 1 . 2]" 1
2907 1 124 GLU HA 1 127 PHE H . . 4.140 3.786 3.587 4.045 . 0 0 "[ . 1 . 2]" 1
2908 1 124 GLU HA 1 127 PHE HB2 . . 4.040 2.938 2.727 3.166 . 0 0 "[ . 1 . 2]" 1
2909 1 124 GLU HA 1 127 PHE HB3 . . 4.930 4.549 4.342 4.810 . 0 0 "[ . 1 . 2]" 1
2910 1 124 GLU HA 1 127 PHE QD . . 4.160 2.690 2.208 2.924 . 0 0 "[ . 1 . 2]" 1
2911 1 124 GLU HA 1 128 SER H . . 4.810 4.066 3.838 4.469 . 0 0 "[ . 1 . 2]" 1
2912 1 124 GLU QB 1 125 MET HA . . 4.720 4.506 4.435 4.556 . 0 0 "[ . 1 . 2]" 1
2913 1 124 GLU HB2 1 125 MET H . . 4.230 4.133 3.985 4.219 . 0 0 "[ . 1 . 2]" 1
2914 1 124 GLU HB3 1 125 MET H . . 4.230 4.124 3.986 4.232 0.002 18 0 "[ . 1 . 2]" 1
2915 1 124 GLU HG2 1 125 MET H . . 3.550 3.035 2.619 3.372 . 0 0 "[ . 1 . 2]" 1
2916 1 124 GLU HG3 1 125 MET H . . 4.940 2.848 2.460 3.268 . 0 0 "[ . 1 . 2]" 1
2917 1 125 MET H 1 125 MET HB2 . . 3.480 2.545 2.446 2.666 . 0 0 "[ . 1 . 2]" 1
2918 1 125 MET H 1 125 MET HB3 . . 2.920 2.594 2.481 2.721 . 0 0 "[ . 1 . 2]" 1
2919 1 125 MET H 1 125 MET HG2 . . 4.570 4.447 4.404 4.496 . 0 0 "[ . 1 . 2]" 1
2920 1 125 MET H 1 125 MET QG . . 4.000 3.992 3.963 4.018 0.018 20 0 "[ . 1 . 2]" 1
2921 1 125 MET H 1 125 MET HG3 . . 4.570 4.519 4.422 4.606 0.036 20 0 "[ . 1 . 2]" 1
2922 1 125 MET H 1 126 ILE H . . 3.230 2.638 2.413 2.864 . 0 0 "[ . 1 . 2]" 1
2923 1 125 MET H 1 126 ILE HB . . 5.130 4.871 4.645 5.099 . 0 0 "[ . 1 . 2]" 1
2924 1 125 MET H 1 126 ILE MG . . 5.050 3.791 3.517 4.061 . 0 0 "[ . 1 . 2]" 1
2925 1 125 MET HA 1 125 MET HG2 . . 3.980 2.661 2.360 2.993 . 0 0 "[ . 1 . 2]" 1
2926 1 125 MET HA 1 125 MET HG3 . . 3.980 2.895 2.662 3.539 . 0 0 "[ . 1 . 2]" 1
2927 1 125 MET HA 1 127 PHE H . . 4.910 3.944 3.768 4.328 . 0 0 "[ . 1 . 2]" 1
2928 1 125 MET HA 1 128 SER H . . 3.970 3.209 2.985 3.388 . 0 0 "[ . 1 . 2]" 1
2929 1 125 MET HA 1 128 SER HB2 . . 4.080 3.257 2.084 4.077 . 0 0 "[ . 1 . 2]" 1
2930 1 125 MET HA 1 128 SER QB . . 3.490 2.554 2.072 3.132 . 0 0 "[ . 1 . 2]" 1
2931 1 125 MET HA 1 128 SER HB3 . . 4.080 3.104 2.391 3.981 . 0 0 "[ . 1 . 2]" 1
2932 1 125 MET HB2 1 126 ILE H . . 4.130 3.586 3.482 3.772 . 0 0 "[ . 1 . 2]" 1
2933 1 125 MET HB3 1 126 ILE H . . 3.430 2.190 2.047 2.423 . 0 0 "[ . 1 . 2]" 1
2934 1 125 MET HB3 1 126 ILE HA . . 4.640 4.063 3.926 4.223 . 0 0 "[ . 1 . 2]" 1
2935 1 125 MET HB3 1 126 ILE HB . . 4.450 4.045 3.990 4.121 . 0 0 "[ . 1 . 2]" 1
2936 1 125 MET HB3 1 126 ILE MG . . 4.670 4.247 4.058 4.494 . 0 0 "[ . 1 . 2]" 1
2937 1 125 MET HB3 1 127 PHE H . . 4.710 4.564 4.445 4.715 0.005 16 0 "[ . 1 . 2]" 1
2938 1 125 MET HB3 1 128 SER H . . 5.500 5.278 5.010 5.466 . 0 0 "[ . 1 . 2]" 1
2939 1 125 MET ME 1 126 ILE H . . 4.530 3.022 2.568 3.494 . 0 0 "[ . 1 . 2]" 1
2940 1 125 MET ME 1 126 ILE MD . . 4.420 4.222 4.029 4.419 . 0 0 "[ . 1 . 2]" 1
2941 1 125 MET ME 1 126 ILE HG13 . . 5.500 4.370 4.034 4.684 . 0 0 "[ . 1 . 2]" 1
2942 1 125 MET QG 1 126 ILE H . . 4.230 3.642 3.353 3.910 . 0 0 "[ . 1 . 2]" 1
2943 1 125 MET QG 1 126 ILE HA . . 4.450 3.972 3.520 4.456 0.006 9 0 "[ . 1 . 2]" 1
2944 1 126 ILE H 1 126 ILE HB . . 3.020 2.402 2.289 2.444 . 0 0 "[ . 1 . 2]" 1
2945 1 126 ILE H 1 126 ILE MD . . 4.500 4.278 4.186 4.323 . 0 0 "[ . 1 . 2]" 1
2946 1 126 ILE H 1 126 ILE HG13 . . 4.330 4.312 4.180 4.344 0.014 19 0 "[ . 1 . 2]" 1
2947 1 126 ILE H 1 126 ILE MG . . 3.300 2.437 2.309 2.684 . 0 0 "[ . 1 . 2]" 1
2948 1 126 ILE H 1 127 PHE H . . 3.190 2.785 2.649 2.923 . 0 0 "[ . 1 . 2]" 1
2949 1 126 ILE HA 1 126 ILE MD . . 3.650 3.575 3.496 3.652 0.002 15 0 "[ . 1 . 2]" 1
2950 1 126 ILE HA 1 126 ILE HG13 . . 3.170 2.256 2.183 2.302 . 0 0 "[ . 1 . 2]" 1
2951 1 126 ILE HA 1 126 ILE MG . . 3.650 3.188 3.175 3.199 . 0 0 "[ . 1 . 2]" 1
2952 1 126 ILE HB 1 126 ILE MD . . 3.320 2.235 2.127 2.338 . 0 0 "[ . 1 . 2]" 1
2953 1 126 ILE HB 1 127 PHE H . . 4.100 3.986 3.820 4.064 . 0 0 "[ . 1 . 2]" 1
2954 1 126 ILE MD 1 126 ILE MG . . 3.160 2.286 2.134 2.459 . 0 0 "[ . 1 . 2]" 1
2955 1 126 ILE MD 1 127 PHE H . . 5.320 5.023 4.703 5.171 . 0 0 "[ . 1 . 2]" 1
2956 1 126 ILE HG12 1 126 ILE MG . . 3.230 2.194 2.054 2.326 . 0 0 "[ . 1 . 2]" 1
2957 1 126 ILE HG12 1 127 PHE H . . 4.890 4.307 3.932 4.536 . 0 0 "[ . 1 . 2]" 1
2958 1 126 ILE HG13 1 127 PHE H . . 5.430 4.777 4.633 4.887 . 0 0 "[ . 1 . 2]" 1
2959 1 126 ILE MG 1 127 PHE H . . 3.230 2.100 1.884 2.287 . 0 0 "[ . 1 . 2]" 1
2960 1 126 ILE MG 1 127 PHE HA . . 4.180 3.270 3.122 3.413 . 0 0 "[ . 1 . 2]" 1
2961 1 126 ILE MG 1 127 PHE HB2 . . 4.590 3.534 3.428 3.659 . 0 0 "[ . 1 . 2]" 1
2962 1 126 ILE MG 1 127 PHE HB3 . . 4.850 4.275 4.175 4.352 . 0 0 "[ . 1 . 2]" 1
2963 1 126 ILE MG 1 127 PHE QD . . 4.110 2.952 2.611 3.134 . 0 0 "[ . 1 . 2]" 1
2964 1 126 ILE MG 1 128 SER H . . 4.960 4.176 4.049 4.342 . 0 0 "[ . 1 . 2]" 1
2965 1 127 PHE H 1 127 PHE HB2 . . 3.120 2.419 2.330 2.503 . 0 0 "[ . 1 . 2]" 1
2966 1 127 PHE H 1 127 PHE HB3 . . 3.690 3.620 3.565 3.657 . 0 0 "[ . 1 . 2]" 1
2967 1 127 PHE H 1 127 PHE QD . . 3.760 3.374 3.251 3.454 . 0 0 "[ . 1 . 2]" 1
2968 1 127 PHE H 1 128 SER H . . 3.180 2.347 2.203 2.672 . 0 0 "[ . 1 . 2]" 1
2969 1 127 PHE HA 1 127 PHE QD . . 3.350 2.022 1.990 2.111 . 0 0 "[ . 1 . 2]" 1
2970 1 127 PHE HB2 1 128 SER H . . 3.880 2.673 2.435 3.082 . 0 0 "[ . 1 . 2]" 1
2971 1 127 PHE HB3 1 128 SER H . . 4.260 3.631 3.370 3.938 . 0 0 "[ . 1 . 2]" 1
2972 1 127 PHE QD 1 128 SER H . . 4.930 4.404 4.237 4.617 . 0 0 "[ . 1 . 2]" 1
2973 1 128 SER H 1 128 SER HB2 . . 3.580 2.698 2.228 3.623 0.043 14 0 "[ . 1 . 2]" 1
2974 1 128 SER H 1 128 SER QB . . 3.110 2.293 2.205 2.631 . 0 0 "[ . 1 . 2]" 1
2975 1 128 SER H 1 128 SER HB3 . . 3.580 2.854 2.278 3.563 . 0 0 "[ . 1 . 2]" 1
2976 1 128 SER H 1 129 GLU H . . 3.280 2.813 2.592 3.194 . 0 0 "[ . 1 . 2]" 1
2977 1 128 SER QB 1 129 GLU H . . 3.560 2.522 1.969 3.405 . 0 0 "[ . 1 . 2]" 1
2978 1 128 SER HB2 1 129 GLU H . . 4.230 3.285 2.352 3.918 . 0 0 "[ . 1 . 2]" 1
2979 1 128 SER HB3 1 129 GLU H . . 4.230 2.845 1.979 3.792 . 0 0 "[ . 1 . 2]" 1
2980 1 129 GLU H 1 129 GLU HB2 . . 3.740 2.614 2.171 3.742 0.002 20 0 "[ . 1 . 2]" 1
2981 1 129 GLU H 1 129 GLU QB . . 3.090 2.379 2.127 2.937 . 0 0 "[ . 1 . 2]" 1
2982 1 129 GLU H 1 129 GLU HB3 . . 3.740 2.981 2.540 3.606 . 0 0 "[ . 1 . 2]" 1
2983 1 129 GLU H 1 129 GLU HG2 . . 5.340 4.060 2.304 4.892 . 0 0 "[ . 1 . 2]" 1
2984 1 129 GLU H 1 129 GLU QG . . 4.530 3.643 2.264 4.254 . 0 0 "[ . 1 . 2]" 1
2985 1 129 GLU H 1 129 GLU HG3 . . 5.340 4.282 2.589 4.940 . 0 0 "[ . 1 . 2]" 1
2986 1 129 GLU HA 1 130 ASP H . . 3.290 2.273 2.138 2.900 . 0 0 "[ . 1 . 2]" 1
2987 1 129 GLU QB 1 130 ASP H . . 4.380 3.390 2.225 4.037 . 0 0 "[ . 1 . 2]" 1
2988 1 129 GLU QG 1 130 ASP H . . 4.840 3.162 1.853 4.329 . 0 0 "[ . 1 . 2]" 1
2989 1 129 GLU HG2 1 130 ASP H . . 5.500 3.881 1.903 5.112 . 0 0 "[ . 1 . 2]" 1
2990 1 129 GLU HG3 1 130 ASP H . . 5.500 3.772 2.242 5.141 . 0 0 "[ . 1 . 2]" 1
2991 1 130 ASP H 1 130 ASP HB2 . . 4.040 3.104 2.216 3.699 . 0 0 "[ . 1 . 2]" 1
2992 1 130 ASP H 1 130 ASP QB . . 3.420 2.439 2.131 2.927 . 0 0 "[ . 1 . 2]" 1
2993 1 130 ASP H 1 130 ASP HB3 . . 4.040 2.792 2.178 3.614 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Friday, June 14, 2024 2:25:58 PM GMT (wattos1)