NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
478354 |
2kno   |
16472 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kno
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 1869
_Distance_constraint_stats_list.Viol_count 1977
_Distance_constraint_stats_list.Viol_total 1574.930
_Distance_constraint_stats_list.Viol_max 0.310
_Distance_constraint_stats_list.Viol_rms 0.0126
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0021
_Distance_constraint_stats_list.Viol_average_violations_only 0.0398
_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 15 GLY 0.722 0.108 11 0 "[ . 1 . 2]"
1 16 SER 1.736 0.194 6 0 "[ . 1 . 2]"
1 17 ASP 2.024 0.300 5 0 "[ . 1 . 2]"
1 18 THR 2.633 0.300 5 0 "[ . 1 . 2]"
1 19 SER 1.093 0.135 6 0 "[ . 1 . 2]"
1 20 LYS 1.320 0.227 4 0 "[ . 1 . 2]"
1 21 PHE 1.085 0.081 15 0 "[ . 1 . 2]"
1 22 TRP 1.971 0.122 20 0 "[ . 1 . 2]"
1 23 TYR 1.648 0.074 14 0 "[ . 1 . 2]"
1 24 LYS 1.568 0.076 2 0 "[ . 1 . 2]"
1 25 PRO 0.506 0.064 12 0 "[ . 1 . 2]"
1 26 HIS 0.251 0.043 1 0 "[ . 1 . 2]"
1 27 LEU 1.448 0.092 14 0 "[ . 1 . 2]"
1 28 SER 1.145 0.085 9 0 "[ . 1 . 2]"
1 29 ARG 0.099 0.061 2 0 "[ . 1 . 2]"
1 30 ASP 0.417 0.078 18 0 "[ . 1 . 2]"
1 31 GLN 0.802 0.085 9 0 "[ . 1 . 2]"
1 32 ALA 2.116 0.093 16 0 "[ . 1 . 2]"
1 33 ILE 2.476 0.093 16 0 "[ . 1 . 2]"
1 34 ALA 2.658 0.149 2 0 "[ . 1 . 2]"
1 35 LEU 2.620 0.305 12 0 "[ . 1 . 2]"
1 36 LEU 0.762 0.057 18 0 "[ . 1 . 2]"
1 37 LYS 1.479 0.101 15 0 "[ . 1 . 2]"
1 38 ASP 0.040 0.019 14 0 "[ . 1 . 2]"
1 39 LYS 0.598 0.118 17 0 "[ . 1 . 2]"
1 40 ASP 0.156 0.118 17 0 "[ . 1 . 2]"
1 41 PRO 0.070 0.045 16 0 "[ . 1 . 2]"
1 42 GLY 0.298 0.071 10 0 "[ . 1 . 2]"
1 43 ALA 0.383 0.081 15 0 "[ . 1 . 2]"
1 44 PHE 0.663 0.090 15 0 "[ . 1 . 2]"
1 45 LEU 0.498 0.069 17 0 "[ . 1 . 2]"
1 46 ILE 1.760 0.122 8 0 "[ . 1 . 2]"
1 47 ARG 1.352 0.089 8 0 "[ . 1 . 2]"
1 48 ASP 0.213 0.064 12 0 "[ . 1 . 2]"
1 49 SER 0.261 0.070 14 0 "[ . 1 . 2]"
1 50 HIS 2.122 0.166 6 0 "[ . 1 . 2]"
1 51 SER 2.616 0.166 6 0 "[ . 1 . 2]"
1 52 PHE 1.279 0.081 2 0 "[ . 1 . 2]"
1 53 GLN 0.667 0.081 2 0 "[ . 1 . 2]"
1 54 GLY 0.079 0.038 19 0 "[ . 1 . 2]"
1 55 ALA 1.328 0.094 16 0 "[ . 1 . 2]"
1 56 TYR 0.820 0.089 8 0 "[ . 1 . 2]"
1 57 GLY 1.868 0.123 18 0 "[ . 1 . 2]"
1 58 LEU 2.069 0.122 8 0 "[ . 1 . 2]"
1 59 ALA 0.512 0.048 20 0 "[ . 1 . 2]"
1 60 LEU 0.800 0.094 17 0 "[ . 1 . 2]"
1 61 LYS 2.410 0.101 15 0 "[ . 1 . 2]"
1 62 VAL 0.847 0.094 17 0 "[ . 1 . 2]"
1 63 ALA 0.230 0.086 20 0 "[ . 1 . 2]"
1 64 THR 1.050 0.086 20 0 "[ . 1 . 2]"
1 65 PRO 5.121 0.310 10 0 "[ . 1 . 2]"
1 66 PRO 7.945 0.310 10 0 "[ . 1 . 2]"
1 67 PRO 0.654 0.175 18 0 "[ . 1 . 2]"
1 68 SER 1.275 0.099 10 0 "[ . 1 . 2]"
1 69 ALA 3.077 0.193 13 0 "[ . 1 . 2]"
1 70 GLN 0.300 0.079 10 0 "[ . 1 . 2]"
1 71 PRO 0.802 0.171 14 0 "[ . 1 . 2]"
1 72 TRP 3.428 0.186 3 0 "[ . 1 . 2]"
1 73 LYS 3.272 0.186 3 0 "[ . 1 . 2]"
1 74 GLY 0.479 0.101 14 0 "[ . 1 . 2]"
1 75 ASP 0.118 0.032 17 0 "[ . 1 . 2]"
1 76 PRO 0.324 0.073 1 0 "[ . 1 . 2]"
1 77 VAL 1.071 0.147 8 0 "[ . 1 . 2]"
1 78 GLU 0.995 0.147 8 0 "[ . 1 . 2]"
1 79 GLN 0.536 0.115 3 0 "[ . 1 . 2]"
1 80 LEU 1.461 0.068 20 0 "[ . 1 . 2]"
1 81 VAL 1.488 0.100 6 0 "[ . 1 . 2]"
1 82 ARG 1.513 0.135 15 0 "[ . 1 . 2]"
1 83 HIS 0.891 0.071 12 0 "[ . 1 . 2]"
1 84 PHE 1.218 0.056 15 0 "[ . 1 . 2]"
1 85 LEU 4.197 0.154 18 0 "[ . 1 . 2]"
1 86 ILE 1.925 0.094 16 0 "[ . 1 . 2]"
1 87 GLU 1.940 0.185 9 0 "[ . 1 . 2]"
1 88 THR 2.781 0.099 11 0 "[ . 1 . 2]"
1 89 GLY 0.160 0.042 9 0 "[ . 1 . 2]"
1 90 PRO 0.136 0.042 9 0 "[ . 1 . 2]"
1 91 LYS 3.536 0.221 9 0 "[ . 1 . 2]"
1 92 GLY 0.913 0.093 5 0 "[ . 1 . 2]"
1 93 VAL 1.865 0.099 11 0 "[ . 1 . 2]"
1 94 LYS 1.521 0.108 8 0 "[ . 1 . 2]"
1 95 ILE 0.376 0.047 4 0 "[ . 1 . 2]"
1 96 LYS 1.746 0.185 9 0 "[ . 1 . 2]"
1 97 GLY 0.065 0.041 3 0 "[ . 1 . 2]"
1 98 CYS 0.483 0.079 6 0 "[ . 1 . 2]"
1 99 PRO 0.415 0.075 4 0 "[ . 1 . 2]"
1 100 SER 1.771 0.169 3 0 "[ . 1 . 2]"
1 101 GLU 1.706 0.169 3 0 "[ . 1 . 2]"
1 102 PRO 1.232 0.245 19 0 "[ . 1 . 2]"
1 103 TYR 3.629 0.245 19 0 "[ . 1 . 2]"
1 104 PHE 0.809 0.073 10 0 "[ . 1 . 2]"
1 105 GLY 0.084 0.048 1 0 "[ . 1 . 2]"
1 106 SER 0.251 0.059 13 0 "[ . 1 . 2]"
1 107 LEU 1.177 0.114 18 0 "[ . 1 . 2]"
1 108 SER 0.159 0.045 12 0 "[ . 1 . 2]"
1 109 ALA 0.656 0.100 9 0 "[ . 1 . 2]"
1 110 LEU 1.310 0.122 20 0 "[ . 1 . 2]"
1 111 VAL 0.822 0.090 2 0 "[ . 1 . 2]"
1 112 SER 1.116 0.100 9 0 "[ . 1 . 2]"
1 114 HIS 0.297 0.097 1 0 "[ . 1 . 2]"
1 115 SER 0.630 0.238 11 0 "[ . 1 . 2]"
1 116 ILE 0.149 0.026 11 0 "[ . 1 . 2]"
1 117 SER 0.201 0.088 1 0 "[ . 1 . 2]"
1 118 PRO 0.077 0.039 11 0 "[ . 1 . 2]"
1 119 ILE 0.886 0.085 15 0 "[ . 1 . 2]"
1 120 SER 0.140 0.079 6 0 "[ . 1 . 2]"
1 121 LEU 1.034 0.097 1 0 "[ . 1 . 2]"
1 122 PRO 0.387 0.038 8 0 "[ . 1 . 2]"
1 123 CYS 0.447 0.050 1 0 "[ . 1 . 2]"
1 124 CYS 0.320 0.054 3 0 "[ . 1 . 2]"
1 125 LEU 0.816 0.095 6 0 "[ . 1 . 2]"
1 126 ARG 0.742 0.138 10 0 "[ . 1 . 2]"
1 127 ILE 2.690 0.238 11 0 "[ . 1 . 2]"
1 128 PRO 1.529 0.161 4 0 "[ . 1 . 2]"
1 129 SER 2.689 0.210 4 0 "[ . 1 . 2]"
1 130 LYS 1.915 0.210 4 0 "[ . 1 . 2]"
1 131 ASP 1.024 0.151 16 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 15 GLY H 1 15 GLY QA 2.710 . 2.710 2.336 2.195 2.483 . 0 0 "[ . 1 . 2]" 1
2 1 15 GLY H 1 16 SER H 3.300 . 3.300 2.556 1.605 3.408 0.108 11 0 "[ . 1 . 2]" 1
3 1 15 GLY QA 1 16 SER H 2.760 . 2.760 2.567 1.976 2.841 0.081 14 0 "[ . 1 . 2]" 1
4 1 15 GLY QA 1 17 ASP H 4.190 . 4.190 3.351 2.799 4.254 0.064 7 0 "[ . 1 . 2]" 1
5 1 16 SER H 1 16 SER QB 3.180 . 3.180 2.765 2.321 3.270 0.090 10 0 "[ . 1 . 2]" 1
6 1 16 SER H 1 17 ASP H 3.160 . 3.160 2.553 1.936 3.127 . 0 0 "[ . 1 . 2]" 1
7 1 16 SER H 1 17 ASP QB 4.850 . 4.850 4.283 3.573 4.877 0.027 12 0 "[ . 1 . 2]" 1
8 1 16 SER HA 1 16 SER QB 2.500 . 2.500 2.320 2.178 2.450 . 0 0 "[ . 1 . 2]" 1
9 1 16 SER HA 1 17 ASP H 2.990 . 2.990 2.869 2.141 3.184 0.194 6 0 "[ . 1 . 2]" 1
10 1 17 ASP H 1 17 ASP QB 2.960 . 2.960 2.455 2.129 2.923 . 0 0 "[ . 1 . 2]" 1
11 1 17 ASP H 1 18 THR MG 4.610 . 4.610 4.209 3.498 4.910 0.300 5 0 "[ . 1 . 2]" 1
12 1 17 ASP HA 1 18 THR H 2.880 . 2.880 2.258 2.020 2.934 0.054 20 0 "[ . 1 . 2]" 1
13 1 17 ASP HB2 1 18 THR H 5.370 . 5.370 4.046 2.716 4.538 . 0 0 "[ . 1 . 2]" 1
14 1 17 ASP HB2 1 18 THR MG 5.500 . 5.500 5.068 3.007 5.564 0.064 3 0 "[ . 1 . 2]" 1
15 1 17 ASP HB3 1 18 THR H 5.370 . 5.370 3.963 1.813 4.483 . 0 0 "[ . 1 . 2]" 1
16 1 17 ASP HB3 1 18 THR MG 5.500 . 5.500 5.014 3.348 5.557 0.057 10 0 "[ . 1 . 2]" 1
17 1 18 THR H 1 18 THR MG 3.420 . 3.420 2.699 2.023 3.239 . 0 0 "[ . 1 . 2]" 1
18 1 18 THR H 1 19 SER H 3.360 . 3.360 2.297 1.832 2.776 . 0 0 "[ . 1 . 2]" 1
19 1 18 THR HA 1 18 THR MG 3.020 . 3.020 2.305 2.172 3.127 0.107 10 0 "[ . 1 . 2]" 1
20 1 18 THR HA 1 19 SER H 3.120 . 3.120 3.146 2.970 3.255 0.135 6 0 "[ . 1 . 2]" 1
21 1 18 THR HA 1 20 LYS H 4.510 . 4.510 3.870 3.272 4.453 . 0 0 "[ . 1 . 2]" 1
22 1 18 THR HA 1 21 PHE QD 3.760 . 3.760 2.292 1.878 3.400 . 0 0 "[ . 1 . 2]" 1
23 1 18 THR HA 1 21 PHE QE 4.560 . 4.560 2.649 1.889 3.363 . 0 0 "[ . 1 . 2]" 1
24 1 18 THR MG 1 19 SER H 4.560 . 4.560 4.142 2.947 4.437 . 0 0 "[ . 1 . 2]" 1
25 1 18 THR MG 1 20 LYS QE 5.500 . 5.500 4.745 3.207 5.549 0.049 19 0 "[ . 1 . 2]" 1
26 1 18 THR MG 1 21 PHE QD 4.010 . 4.010 3.373 2.246 4.053 0.043 5 0 "[ . 1 . 2]" 1
27 1 18 THR MG 1 21 PHE QE 4.230 . 4.230 2.891 2.037 4.266 0.036 10 0 "[ . 1 . 2]" 1
28 1 18 THR MG 1 129 SER HA 5.500 . 5.500 4.382 2.684 5.560 0.060 10 0 "[ . 1 . 2]" 1
29 1 19 SER H 1 19 SER HB2 3.960 . 3.960 2.669 2.459 3.618 . 0 0 "[ . 1 . 2]" 1
30 1 19 SER H 1 19 SER QB 3.380 . 3.380 2.490 2.160 2.651 . 0 0 "[ . 1 . 2]" 1
31 1 19 SER H 1 19 SER HB3 3.960 . 3.960 3.380 2.350 3.696 . 0 0 "[ . 1 . 2]" 1
32 1 19 SER H 1 20 LYS H 3.650 . 3.650 2.563 2.086 3.141 . 0 0 "[ . 1 . 2]" 1
33 1 19 SER HA 1 21 PHE H 4.660 . 4.660 3.711 3.439 4.090 . 0 0 "[ . 1 . 2]" 1
34 1 19 SER HA 1 22 TRP H 4.570 . 4.570 3.728 3.412 4.066 . 0 0 "[ . 1 . 2]" 1
35 1 19 SER HA 1 22 TRP HE1 4.700 . 4.700 2.976 2.265 4.292 . 0 0 "[ . 1 . 2]" 1
36 1 20 LYS H 1 20 LYS QB 3.510 . 3.510 2.576 2.420 2.778 . 0 0 "[ . 1 . 2]" 1
37 1 20 LYS H 1 20 LYS HG2 4.150 . 4.150 3.344 2.177 3.738 . 0 0 "[ . 1 . 2]" 1
38 1 20 LYS H 1 20 LYS QG 3.510 . 3.510 2.651 1.815 3.433 . 0 0 "[ . 1 . 2]" 1
39 1 20 LYS H 1 20 LYS HG3 4.150 . 4.150 3.147 1.823 4.132 . 0 0 "[ . 1 . 2]" 1
40 1 20 LYS H 1 21 PHE QB 5.340 . 5.340 4.766 4.492 5.040 . 0 0 "[ . 1 . 2]" 1
41 1 20 LYS HA 1 20 LYS QD 3.840 . 3.840 3.774 3.671 4.067 0.227 4 0 "[ . 1 . 2]" 1
42 1 20 LYS HA 1 20 LYS QG 3.560 . 3.560 3.475 3.305 3.575 0.015 8 0 "[ . 1 . 2]" 1
43 1 20 LYS QB 1 20 LYS QD 3.200 . 3.200 2.284 1.964 2.617 . 0 0 "[ . 1 . 2]" 1
44 1 20 LYS QB 1 20 LYS QE 4.550 . 4.550 3.632 2.000 3.889 . 0 0 "[ . 1 . 2]" 1
45 1 20 LYS HB2 1 20 LYS QD 3.840 . 3.840 2.779 2.152 3.346 . 0 0 "[ . 1 . 2]" 1
46 1 20 LYS HB2 1 21 PHE H 4.520 . 4.520 4.269 4.012 4.413 . 0 0 "[ . 1 . 2]" 1
47 1 20 LYS HB3 1 20 LYS QD 3.840 . 3.840 2.751 2.249 3.497 . 0 0 "[ . 1 . 2]" 1
48 1 20 LYS HB3 1 21 PHE H 4.520 . 4.520 4.339 4.118 4.536 0.016 14 0 "[ . 1 . 2]" 1
49 1 20 LYS QE 1 20 LYS HG2 3.350 . 3.350 2.571 2.360 3.024 . 0 0 "[ . 1 . 2]" 1
50 1 20 LYS QE 1 20 LYS HG3 3.350 . 3.350 2.548 2.280 3.445 0.095 19 0 "[ . 1 . 2]" 1
51 1 20 LYS QE 1 21 PHE HA 4.690 . 4.690 4.546 3.696 4.771 0.081 15 0 "[ . 1 . 2]" 1
52 1 20 LYS QE 1 21 PHE QE 4.210 . 4.210 2.720 2.135 3.360 . 0 0 "[ . 1 . 2]" 1
53 1 20 LYS QG 1 21 PHE H 4.400 . 4.400 3.273 2.528 3.906 . 0 0 "[ . 1 . 2]" 1
54 1 21 PHE H 1 21 PHE HB2 3.750 . 3.750 2.436 2.342 2.535 . 0 0 "[ . 1 . 2]" 1
55 1 21 PHE H 1 21 PHE HB3 3.750 . 3.750 3.625 3.578 3.678 . 0 0 "[ . 1 . 2]" 1
56 1 21 PHE H 1 21 PHE QD 4.120 . 4.120 2.736 2.067 3.360 . 0 0 "[ . 1 . 2]" 1
57 1 21 PHE H 1 22 TRP H 3.470 . 3.470 2.422 2.234 2.677 . 0 0 "[ . 1 . 2]" 1
58 1 21 PHE HA 1 21 PHE QD 3.560 . 3.560 2.701 2.125 3.109 . 0 0 "[ . 1 . 2]" 1
59 1 21 PHE QB 1 22 TRP H 4.370 . 4.370 2.820 2.218 3.193 . 0 0 "[ . 1 . 2]" 1
60 1 21 PHE QB 1 22 TRP HD1 3.940 . 3.940 3.025 2.335 3.530 . 0 0 "[ . 1 . 2]" 1
61 1 21 PHE QB 1 127 ILE MG 4.130 . 4.130 3.532 2.696 4.124 . 0 0 "[ . 1 . 2]" 1
62 1 21 PHE HB2 1 127 ILE MG 4.850 . 4.850 3.779 2.831 4.442 . 0 0 "[ . 1 . 2]" 1
63 1 21 PHE HB3 1 127 ILE MG 4.850 . 4.850 4.261 3.388 4.893 0.043 11 0 "[ . 1 . 2]" 1
64 1 21 PHE QD 1 127 ILE MG 4.790 . 4.790 4.242 3.072 4.842 0.052 17 0 "[ . 1 . 2]" 1
65 1 21 PHE QD 1 129 SER HA 4.470 . 4.470 3.685 2.606 4.534 0.064 19 0 "[ . 1 . 2]" 1
66 1 21 PHE QE 1 129 SER HA 4.600 . 4.600 3.999 2.958 4.658 0.058 11 0 "[ . 1 . 2]" 1
67 1 22 TRP H 1 22 TRP HD1 4.520 . 4.520 3.350 2.969 3.570 . 0 0 "[ . 1 . 2]" 1
68 1 22 TRP H 1 22 TRP HE1 4.730 . 4.730 4.557 4.306 4.746 0.016 12 0 "[ . 1 . 2]" 1
69 1 22 TRP H 1 23 TYR H 3.380 . 3.380 2.075 1.830 2.492 . 0 0 "[ . 1 . 2]" 1
70 1 22 TRP HD1 1 127 ILE MG 3.680 . 3.680 2.437 2.071 3.059 . 0 0 "[ . 1 . 2]" 1
71 1 22 TRP HE1 1 111 VAL MG1 4.240 . 4.240 2.724 2.207 3.367 . 0 0 "[ . 1 . 2]" 1
72 1 22 TRP HE1 1 127 ILE QG 4.700 . 4.700 3.981 3.134 4.685 . 0 0 "[ . 1 . 2]" 1
73 1 22 TRP HE1 1 127 ILE MG 4.110 . 4.110 3.324 2.471 3.917 . 0 0 "[ . 1 . 2]" 1
74 1 22 TRP HE3 1 23 TYR H 4.710 . 4.710 3.436 3.269 3.652 . 0 0 "[ . 1 . 2]" 1
75 1 22 TRP HE3 1 23 TYR HA 4.250 . 4.250 2.744 2.585 3.002 . 0 0 "[ . 1 . 2]" 1
76 1 22 TRP HE3 1 23 TYR QD 4.080 . 4.080 3.131 3.041 3.177 . 0 0 "[ . 1 . 2]" 1
77 1 22 TRP HE3 1 23 TYR QE 5.320 . 5.320 5.351 5.299 5.389 0.069 8 0 "[ . 1 . 2]" 1
78 1 22 TRP HE3 1 46 ILE HB 4.030 . 4.030 2.179 2.089 2.319 . 0 0 "[ . 1 . 2]" 1
79 1 22 TRP HE3 1 46 ILE MD 3.830 . 3.830 2.864 2.426 3.173 . 0 0 "[ . 1 . 2]" 1
80 1 22 TRP HE3 1 46 ILE MG 4.520 . 4.520 3.817 3.694 3.995 . 0 0 "[ . 1 . 2]" 1
81 1 22 TRP HH2 1 23 TYR QD 4.530 . 4.530 4.480 3.956 4.557 0.027 19 0 "[ . 1 . 2]" 1
82 1 22 TRP HH2 1 46 ILE MD 3.700 . 3.700 3.474 3.203 3.717 0.017 8 0 "[ . 1 . 2]" 1
83 1 22 TRP HH2 1 46 ILE MG 4.980 . 4.980 4.784 4.539 4.991 0.011 18 0 "[ . 1 . 2]" 1
84 1 22 TRP HH2 1 107 LEU HB2 4.760 . 4.760 2.171 1.968 2.370 . 0 0 "[ . 1 . 2]" 1
85 1 22 TRP HH2 1 107 LEU HB3 4.690 . 4.690 2.519 2.140 3.161 . 0 0 "[ . 1 . 2]" 1
86 1 22 TRP HH2 1 107 LEU MD1 4.690 . 4.690 3.097 2.586 4.507 . 0 0 "[ . 1 . 2]" 1
87 1 22 TRP HH2 1 107 LEU QD 3.770 . 3.770 2.885 2.557 3.782 0.012 1 0 "[ . 1 . 2]" 1
88 1 22 TRP HH2 1 107 LEU MD2 4.690 . 4.690 4.186 2.785 4.702 0.012 14 0 "[ . 1 . 2]" 1
89 1 22 TRP HH2 1 111 VAL MG2 4.140 . 4.140 3.309 3.006 3.631 . 0 0 "[ . 1 . 2]" 1
90 1 22 TRP HZ2 1 107 LEU HB2 4.980 . 4.980 4.164 3.777 4.603 . 0 0 "[ . 1 . 2]" 1
91 1 22 TRP HZ2 1 107 LEU HB3 5.090 . 5.090 4.341 3.799 4.891 . 0 0 "[ . 1 . 2]" 1
92 1 22 TRP HZ2 1 108 SER HA 3.500 . 3.500 2.647 2.204 3.091 . 0 0 "[ . 1 . 2]" 1
93 1 22 TRP HZ2 1 108 SER QB 3.940 . 3.940 3.446 2.382 3.962 0.022 12 0 "[ . 1 . 2]" 1
94 1 22 TRP HZ2 1 110 LEU QD 5.440 . 5.440 5.479 5.251 5.562 0.122 20 0 "[ . 1 . 2]" 1
95 1 22 TRP HZ2 1 111 VAL HB 5.410 . 5.410 3.784 3.380 4.351 . 0 0 "[ . 1 . 2]" 1
96 1 22 TRP HZ2 1 111 VAL MG1 4.060 . 4.060 3.542 3.044 3.898 . 0 0 "[ . 1 . 2]" 1
97 1 22 TRP HZ2 1 111 VAL MG2 3.950 . 3.950 2.921 2.711 3.198 . 0 0 "[ . 1 . 2]" 1
98 1 22 TRP HZ3 1 46 ILE MD 4.270 . 4.270 2.329 2.168 2.570 . 0 0 "[ . 1 . 2]" 1
99 1 22 TRP HZ3 1 107 LEU HB2 4.290 . 4.290 3.627 3.121 3.949 . 0 0 "[ . 1 . 2]" 1
100 1 22 TRP HZ3 1 107 LEU HB3 4.480 . 4.480 3.244 2.808 3.572 . 0 0 "[ . 1 . 2]" 1
101 1 22 TRP HZ3 1 107 LEU MD1 5.010 . 5.010 2.629 2.159 4.535 . 0 0 "[ . 1 . 2]" 1
102 1 22 TRP HZ3 1 107 LEU QD 4.060 . 4.060 2.344 1.940 3.621 . 0 0 "[ . 1 . 2]" 1
103 1 22 TRP HZ3 1 107 LEU MD2 5.010 . 5.010 3.957 1.942 4.535 . 0 0 "[ . 1 . 2]" 1
104 1 22 TRP HZ3 1 107 LEU HG 5.500 . 5.500 4.761 2.902 5.110 . 0 0 "[ . 1 . 2]" 1
105 1 22 TRP HZ3 1 111 VAL MG2 4.250 . 4.250 3.937 3.616 4.268 0.018 3 0 "[ . 1 . 2]" 1
106 1 23 TYR H 1 23 TYR HB2 4.030 . 4.030 2.689 2.549 2.906 . 0 0 "[ . 1 . 2]" 1
107 1 23 TYR H 1 23 TYR QB 3.530 . 3.530 2.345 2.265 2.427 . 0 0 "[ . 1 . 2]" 1
108 1 23 TYR H 1 23 TYR HB3 4.030 . 4.030 2.588 2.497 2.708 . 0 0 "[ . 1 . 2]" 1
109 1 23 TYR H 1 23 TYR QD 4.560 . 4.560 4.238 4.181 4.290 . 0 0 "[ . 1 . 2]" 1
110 1 23 TYR HA 1 23 TYR QD 3.410 . 3.410 2.640 2.419 3.002 . 0 0 "[ . 1 . 2]" 1
111 1 23 TYR HA 1 23 TYR QE 4.470 . 4.470 4.478 4.401 4.529 0.059 20 0 "[ . 1 . 2]" 1
112 1 23 TYR HA 1 24 LYS H 3.540 . 3.540 2.069 2.025 2.131 . 0 0 "[ . 1 . 2]" 1
113 1 23 TYR HA 1 24 LYS QD 4.280 . 4.280 3.491 3.153 4.309 0.029 12 0 "[ . 1 . 2]" 1
114 1 23 TYR HA 1 46 ILE HB 4.490 . 4.490 2.955 2.689 3.094 . 0 0 "[ . 1 . 2]" 1
115 1 23 TYR HA 1 46 ILE MG 4.870 . 4.870 3.973 3.783 4.106 . 0 0 "[ . 1 . 2]" 1
116 1 23 TYR QD 1 24 LYS H 4.150 . 4.150 3.734 3.558 3.863 . 0 0 "[ . 1 . 2]" 1
117 1 23 TYR QD 1 46 ILE HB 4.050 . 4.050 2.272 2.002 2.613 . 0 0 "[ . 1 . 2]" 1
118 1 23 TYR QD 1 46 ILE MD 4.600 . 4.600 3.689 3.382 3.982 . 0 0 "[ . 1 . 2]" 1
119 1 23 TYR QD 1 46 ILE MG 3.670 . 3.670 2.508 2.326 2.791 . 0 0 "[ . 1 . 2]" 1
120 1 23 TYR QD 1 107 LEU QD 4.630 . 4.630 2.978 2.480 4.054 . 0 0 "[ . 1 . 2]" 1
121 1 23 TYR QE 1 24 LYS H 4.900 . 4.900 4.835 4.648 4.974 0.074 14 0 "[ . 1 . 2]" 1
122 1 23 TYR QE 1 25 PRO HA 4.690 . 4.690 4.330 3.403 4.750 0.060 20 0 "[ . 1 . 2]" 1
123 1 23 TYR QE 1 25 PRO HB2 4.830 . 4.830 4.311 3.881 4.848 0.018 18 0 "[ . 1 . 2]" 1
124 1 23 TYR QE 1 25 PRO QB 4.240 . 4.240 2.893 2.196 3.362 . 0 0 "[ . 1 . 2]" 1
125 1 23 TYR QE 1 25 PRO HB3 4.830 . 4.830 2.946 2.208 3.445 . 0 0 "[ . 1 . 2]" 1
126 1 23 TYR QE 1 25 PRO QG 4.030 . 4.030 2.612 2.213 3.094 . 0 0 "[ . 1 . 2]" 1
127 1 23 TYR QE 1 46 ILE MG 3.720 . 3.720 2.394 2.117 2.875 . 0 0 "[ . 1 . 2]" 1
128 1 23 TYR QE 1 47 ARG HA 4.750 . 4.750 4.038 3.537 4.769 0.019 6 0 "[ . 1 . 2]" 1
129 1 23 TYR QE 1 56 TYR QD 3.960 . 3.960 2.613 2.095 3.447 . 0 0 "[ . 1 . 2]" 1
130 1 23 TYR QE 1 107 LEU QD 4.130 . 4.130 2.853 2.264 3.571 . 0 0 "[ . 1 . 2]" 1
131 1 24 LYS H 1 24 LYS QD 4.570 . 4.570 2.770 2.290 3.569 . 0 0 "[ . 1 . 2]" 1
132 1 24 LYS H 1 24 LYS QG 4.340 . 4.340 3.286 2.435 4.244 . 0 0 "[ . 1 . 2]" 1
133 1 24 LYS HA 1 24 LYS HD2 4.410 . 4.410 3.834 2.935 4.315 . 0 0 "[ . 1 . 2]" 1
134 1 24 LYS HA 1 24 LYS QD 3.820 . 3.820 3.397 2.302 3.666 . 0 0 "[ . 1 . 2]" 1
135 1 24 LYS HA 1 24 LYS HD3 4.410 . 4.410 3.932 2.405 4.438 0.028 2 0 "[ . 1 . 2]" 1
136 1 24 LYS HA 1 24 LYS QG 3.940 . 3.940 3.140 2.299 3.605 . 0 0 "[ . 1 . 2]" 1
137 1 24 LYS HA 1 25 PRO HD3 3.840 . 3.840 2.410 2.090 2.813 . 0 0 "[ . 1 . 2]" 1
138 1 24 LYS HA 1 25 PRO HG2 4.750 . 4.750 4.254 4.151 4.421 . 0 0 "[ . 1 . 2]" 1
139 1 24 LYS HA 1 25 PRO QG 4.140 . 4.140 3.850 3.780 3.984 . 0 0 "[ . 1 . 2]" 1
140 1 24 LYS HA 1 25 PRO HG3 4.750 . 4.750 4.406 4.229 4.605 . 0 0 "[ . 1 . 2]" 1
141 1 24 LYS QB 1 26 HIS H 4.150 . 4.150 3.300 2.809 4.069 . 0 0 "[ . 1 . 2]" 1
142 1 24 LYS QB 1 27 LEU QD 3.700 . 3.700 2.841 1.763 3.764 0.064 4 0 "[ . 1 . 2]" 1
143 1 24 LYS QB 1 47 ARG HA 5.340 . 5.340 4.750 3.777 5.394 0.054 8 0 "[ . 1 . 2]" 1
144 1 24 LYS QD 1 27 LEU QD 3.970 . 3.970 3.529 2.892 4.009 0.039 13 0 "[ . 1 . 2]" 1
145 1 24 LYS QD 1 45 LEU QD 3.810 . 3.810 3.029 2.038 3.879 0.069 17 0 "[ . 1 . 2]" 1
146 1 24 LYS QE 1 35 LEU QD 3.940 . 3.940 3.392 2.536 3.967 0.027 3 0 "[ . 1 . 2]" 1
147 1 24 LYS QE 1 45 LEU QB 3.630 . 3.630 2.482 1.906 3.467 . 0 0 "[ . 1 . 2]" 1
148 1 24 LYS QE 1 45 LEU QD 3.580 . 3.580 2.542 1.933 3.595 0.015 6 0 "[ . 1 . 2]" 1
149 1 24 LYS HE2 1 35 LEU MD1 5.500 . 5.500 4.591 3.465 5.525 0.025 3 0 "[ . 1 . 2]" 1
150 1 24 LYS HE2 1 35 LEU MD2 5.500 . 5.500 5.375 4.829 5.576 0.076 2 0 "[ . 1 . 2]" 1
151 1 24 LYS HE2 1 45 LEU QB 4.200 . 4.200 2.787 1.917 4.228 0.028 9 0 "[ . 1 . 2]" 1
152 1 24 LYS HE3 1 35 LEU MD1 5.500 . 5.500 3.880 2.621 5.122 . 0 0 "[ . 1 . 2]" 1
153 1 24 LYS HE3 1 35 LEU MD2 5.500 . 5.500 4.439 3.611 5.112 . 0 0 "[ . 1 . 2]" 1
154 1 24 LYS HE3 1 45 LEU QB 4.200 . 4.200 3.220 1.982 4.232 0.032 17 0 "[ . 1 . 2]" 1
155 1 24 LYS QG 1 27 LEU H 5.100 . 5.100 4.482 3.478 5.151 0.051 9 0 "[ . 1 . 2]" 1
156 1 24 LYS QG 1 27 LEU MD1 4.300 . 4.300 3.322 1.967 4.354 0.054 2 0 "[ . 1 . 2]" 1
157 1 24 LYS QG 1 27 LEU QD 3.550 . 3.550 2.307 1.915 2.906 . 0 0 "[ . 1 . 2]" 1
158 1 24 LYS QG 1 27 LEU MD2 4.300 . 4.300 2.697 1.919 3.911 . 0 0 "[ . 1 . 2]" 1
159 1 24 LYS QG 1 35 LEU QD 4.950 . 4.950 4.060 2.822 4.650 . 0 0 "[ . 1 . 2]" 1
160 1 24 LYS QG 1 45 LEU QB 4.620 . 4.620 3.685 2.495 4.640 0.020 19 0 "[ . 1 . 2]" 1
161 1 25 PRO HA 1 47 ARG HA 3.670 . 3.670 2.383 1.897 3.225 . 0 0 "[ . 1 . 2]" 1
162 1 25 PRO HA 1 47 ARG HB2 4.530 . 4.530 2.775 1.939 3.703 . 0 0 "[ . 1 . 2]" 1
163 1 25 PRO HA 1 48 ASP H 3.450 . 3.450 2.178 1.809 2.549 . 0 0 "[ . 1 . 2]" 1
164 1 25 PRO QB 1 48 ASP H 3.830 . 3.830 3.214 2.024 3.894 0.064 12 0 "[ . 1 . 2]" 1
165 1 25 PRO HD2 1 26 HIS H 4.270 . 4.270 3.009 2.627 3.471 . 0 0 "[ . 1 . 2]" 1
166 1 25 PRO HD3 1 47 ARG HA 4.570 . 4.570 4.449 4.040 4.616 0.046 10 0 "[ . 1 . 2]" 1
167 1 26 HIS H 1 26 HIS QB 3.290 . 3.290 2.511 2.248 2.908 . 0 0 "[ . 1 . 2]" 1
168 1 26 HIS H 1 27 LEU H 3.160 . 3.160 2.356 1.905 2.651 . 0 0 "[ . 1 . 2]" 1
169 1 26 HIS H 1 27 LEU QB 4.160 . 4.160 3.965 3.516 4.203 0.043 1 0 "[ . 1 . 2]" 1
170 1 26 HIS QB 1 27 LEU H 3.820 . 3.820 3.512 3.040 3.861 0.041 20 0 "[ . 1 . 2]" 1
171 1 26 HIS HB2 1 27 LEU H 4.510 . 4.510 4.005 3.315 4.488 . 0 0 "[ . 1 . 2]" 1
172 1 26 HIS HB3 1 27 LEU H 4.510 . 4.510 4.061 3.136 4.415 . 0 0 "[ . 1 . 2]" 1
173 1 27 LEU H 1 27 LEU QB 3.170 . 3.170 2.304 2.166 2.432 . 0 0 "[ . 1 . 2]" 1
174 1 27 LEU H 1 27 LEU MD1 4.530 . 4.530 3.843 2.331 4.151 . 0 0 "[ . 1 . 2]" 1
175 1 27 LEU H 1 27 LEU MD2 4.530 . 4.530 3.906 2.357 4.361 . 0 0 "[ . 1 . 2]" 1
176 1 27 LEU H 1 28 SER H 4.650 . 4.650 4.484 4.354 4.643 . 0 0 "[ . 1 . 2]" 1
177 1 27 LEU H 1 47 ARG QG 5.190 . 5.190 4.793 3.743 5.251 0.061 11 0 "[ . 1 . 2]" 1
178 1 27 LEU HA 1 27 LEU MD1 3.860 . 3.860 2.393 1.980 3.818 . 0 0 "[ . 1 . 2]" 1
179 1 27 LEU HA 1 27 LEU QD 3.040 . 3.040 2.089 1.958 2.888 . 0 0 "[ . 1 . 2]" 1
180 1 27 LEU HA 1 27 LEU MD2 3.860 . 3.860 3.346 1.991 3.853 . 0 0 "[ . 1 . 2]" 1
181 1 27 LEU HA 1 28 SER H 3.270 . 3.270 2.170 2.053 2.366 . 0 0 "[ . 1 . 2]" 1
182 1 27 LEU HA 1 31 GLN HB2 4.560 . 4.560 3.562 2.727 4.196 . 0 0 "[ . 1 . 2]" 1
183 1 27 LEU HA 1 31 GLN HB3 4.860 . 4.860 4.165 3.207 4.898 0.038 10 0 "[ . 1 . 2]" 1
184 1 27 LEU QB 1 28 SER H 3.980 . 3.980 3.357 2.757 3.746 . 0 0 "[ . 1 . 2]" 1
185 1 27 LEU QB 1 31 GLN HB2 4.600 . 4.600 3.691 2.388 4.615 0.015 10 0 "[ . 1 . 2]" 1
186 1 27 LEU QB 1 47 ARG HA 5.500 . 5.500 4.762 3.980 5.532 0.032 20 0 "[ . 1 . 2]" 1
187 1 27 LEU QB 1 47 ARG QD 3.700 . 3.700 3.296 2.760 3.756 0.056 3 0 "[ . 1 . 2]" 1
188 1 27 LEU QD 1 28 SER H 3.920 . 3.920 2.988 2.356 3.914 . 0 0 "[ . 1 . 2]" 1
189 1 27 LEU QD 1 31 GLN H 4.670 . 4.670 4.407 4.070 4.683 0.013 5 0 "[ . 1 . 2]" 1
190 1 27 LEU QD 1 31 GLN HA 4.180 . 4.180 3.871 3.643 4.092 . 0 0 "[ . 1 . 2]" 1
191 1 27 LEU QD 1 31 GLN HB2 3.650 . 3.650 2.657 2.386 3.062 . 0 0 "[ . 1 . 2]" 1
192 1 27 LEU QD 1 31 GLN HB3 3.420 . 3.420 2.107 1.954 2.663 . 0 0 "[ . 1 . 2]" 1
193 1 27 LEU QD 1 31 GLN QG 3.930 . 3.930 3.392 2.853 3.964 0.034 20 0 "[ . 1 . 2]" 1
194 1 27 LEU QD 1 32 ALA H 4.130 . 4.130 3.498 3.168 4.094 . 0 0 "[ . 1 . 2]" 1
195 1 27 LEU QD 1 32 ALA HA 3.700 . 3.700 2.423 2.006 3.213 . 0 0 "[ . 1 . 2]" 1
196 1 27 LEU QD 1 32 ALA MB 4.140 . 4.140 3.063 2.501 3.758 . 0 0 "[ . 1 . 2]" 1
197 1 27 LEU QD 1 34 ALA MB 4.700 . 4.700 4.195 3.836 4.516 . 0 0 "[ . 1 . 2]" 1
198 1 27 LEU QD 1 45 LEU QD 4.020 . 4.020 2.084 1.841 3.168 . 0 0 "[ . 1 . 2]" 1
199 1 27 LEU MD1 1 31 GLN HB2 4.610 . 4.610 2.979 2.393 4.623 0.013 20 0 "[ . 1 . 2]" 1
200 1 27 LEU MD1 1 31 GLN HB3 4.230 . 4.230 2.439 1.959 4.178 . 0 0 "[ . 1 . 2]" 1
201 1 27 LEU MD1 1 32 ALA HA 4.770 . 4.770 3.838 2.626 4.862 0.092 14 0 "[ . 1 . 2]" 1
202 1 27 LEU MD2 1 31 GLN HB2 4.610 . 4.610 3.600 2.815 4.627 0.017 17 0 "[ . 1 . 2]" 1
203 1 27 LEU MD2 1 31 GLN HB3 4.230 . 4.230 3.214 2.039 4.295 0.065 17 0 "[ . 1 . 2]" 1
204 1 27 LEU MD2 1 32 ALA HA 4.770 . 4.770 2.986 2.014 4.833 0.063 2 0 "[ . 1 . 2]" 1
205 1 28 SER H 1 28 SER HB2 4.010 . 4.010 2.743 2.451 3.613 . 0 0 "[ . 1 . 2]" 1
206 1 28 SER H 1 28 SER QB 3.400 . 3.400 2.440 2.286 2.681 . 0 0 "[ . 1 . 2]" 1
207 1 28 SER H 1 28 SER HB3 4.010 . 4.010 3.080 2.491 3.654 . 0 0 "[ . 1 . 2]" 1
208 1 28 SER H 1 30 ASP H 5.500 . 5.500 5.293 4.875 5.536 0.036 15 0 "[ . 1 . 2]" 1
209 1 28 SER H 1 31 GLN H 4.370 . 4.370 3.876 3.320 4.299 . 0 0 "[ . 1 . 2]" 1
210 1 28 SER H 1 31 GLN HB2 3.920 . 3.920 2.363 1.877 2.813 . 0 0 "[ . 1 . 2]" 1
211 1 28 SER H 1 31 GLN HB3 4.170 . 4.170 3.708 3.263 4.165 . 0 0 "[ . 1 . 2]" 1
212 1 28 SER H 1 31 GLN QG 4.180 . 4.180 3.255 2.401 4.188 0.008 12 0 "[ . 1 . 2]" 1
213 1 28 SER H 1 32 ALA MB 4.710 . 4.710 4.721 4.511 4.767 0.057 5 0 "[ . 1 . 2]" 1
214 1 28 SER HA 1 29 ARG H 3.400 . 3.400 2.537 2.370 2.655 . 0 0 "[ . 1 . 2]" 1
215 1 28 SER HA 1 30 ASP H 4.860 . 4.860 4.807 4.435 4.938 0.078 18 0 "[ . 1 . 2]" 1
216 1 28 SER QB 1 30 ASP H 4.300 . 4.300 3.309 2.865 3.603 . 0 0 "[ . 1 . 2]" 1
217 1 28 SER QB 1 31 GLN H 4.200 . 4.200 3.114 2.501 3.719 . 0 0 "[ . 1 . 2]" 1
218 1 28 SER QB 1 31 GLN HB3 5.180 . 5.180 4.707 4.042 5.265 0.085 9 0 "[ . 1 . 2]" 1
219 1 28 SER HB2 1 29 ARG H 3.940 . 3.940 3.327 2.190 3.793 . 0 0 "[ . 1 . 2]" 1
220 1 28 SER HB3 1 29 ARG H 3.940 . 3.940 2.886 2.246 3.791 . 0 0 "[ . 1 . 2]" 1
221 1 29 ARG H 1 29 ARG QB 3.320 . 3.320 2.244 2.196 2.295 . 0 0 "[ . 1 . 2]" 1
222 1 29 ARG H 1 29 ARG QG 4.590 . 4.590 3.983 3.952 4.043 . 0 0 "[ . 1 . 2]" 1
223 1 29 ARG H 1 30 ASP H 3.540 . 3.540 2.873 2.528 3.001 . 0 0 "[ . 1 . 2]" 1
224 1 29 ARG HA 1 29 ARG HD2 4.970 . 4.970 4.556 3.791 4.973 0.003 20 0 "[ . 1 . 2]" 1
225 1 29 ARG HA 1 29 ARG HD3 4.970 . 4.970 4.361 2.211 4.924 . 0 0 "[ . 1 . 2]" 1
226 1 29 ARG HA 1 29 ARG HG2 3.840 . 3.840 3.133 2.546 3.851 0.011 2 0 "[ . 1 . 2]" 1
227 1 29 ARG HA 1 29 ARG HG3 3.840 . 3.840 2.765 2.549 3.675 . 0 0 "[ . 1 . 2]" 1
228 1 29 ARG HA 1 32 ALA H 4.260 . 4.260 3.627 3.392 3.954 . 0 0 "[ . 1 . 2]" 1
229 1 29 ARG HA 1 32 ALA MB 3.670 . 3.670 2.761 2.454 3.198 . 0 0 "[ . 1 . 2]" 1
230 1 29 ARG HA 1 33 ILE MD 4.710 . 4.710 4.361 4.145 4.677 . 0 0 "[ . 1 . 2]" 1
231 1 29 ARG HA 1 47 ARG QD 5.340 . 5.340 3.913 2.962 5.401 0.061 2 0 "[ . 1 . 2]" 1
232 1 29 ARG HA 1 59 ALA MB 5.370 . 5.370 4.858 4.479 5.364 . 0 0 "[ . 1 . 2]" 1
233 1 29 ARG QB 1 29 ARG HD2 3.670 . 3.670 2.765 2.294 3.456 . 0 0 "[ . 1 . 2]" 1
234 1 29 ARG QB 1 29 ARG QD 3.210 . 3.210 2.317 2.090 2.735 . 0 0 "[ . 1 . 2]" 1
235 1 29 ARG QB 1 29 ARG HD3 3.670 . 3.670 2.732 2.297 3.333 . 0 0 "[ . 1 . 2]" 1
236 1 29 ARG QB 1 30 ASP H 3.460 . 3.460 2.373 2.116 2.672 . 0 0 "[ . 1 . 2]" 1
237 1 29 ARG QB 1 31 GLN H 5.020 . 5.020 4.553 4.369 4.724 . 0 0 "[ . 1 . 2]" 1
238 1 29 ARG QB 1 33 ILE MD 4.600 . 4.600 4.056 3.694 4.421 . 0 0 "[ . 1 . 2]" 1
239 1 29 ARG QD 1 33 ILE MD 4.250 . 4.250 3.265 2.219 3.908 . 0 0 "[ . 1 . 2]" 1
240 1 29 ARG HD2 1 33 ILE MD 4.990 . 4.990 3.761 2.833 4.593 . 0 0 "[ . 1 . 2]" 1
241 1 29 ARG HD3 1 33 ILE MD 4.990 . 4.990 3.820 2.245 4.982 . 0 0 "[ . 1 . 2]" 1
242 1 29 ARG QG 1 30 ASP H 4.300 . 4.300 3.425 3.143 4.093 . 0 0 "[ . 1 . 2]" 1
243 1 29 ARG QG 1 30 ASP HA 4.650 . 4.650 3.484 3.107 4.548 . 0 0 "[ . 1 . 2]" 1
244 1 29 ARG QG 1 33 ILE MD 3.490 . 3.490 2.401 2.006 3.353 . 0 0 "[ . 1 . 2]" 1
245 1 29 ARG HG2 1 33 ILE MD 4.370 . 4.370 2.591 2.030 4.194 . 0 0 "[ . 1 . 2]" 1
246 1 29 ARG HG3 1 33 ILE MD 4.370 . 4.370 3.278 2.569 4.394 0.024 7 0 "[ . 1 . 2]" 1
247 1 30 ASP H 1 30 ASP HB2 3.790 . 3.790 2.802 2.447 3.668 . 0 0 "[ . 1 . 2]" 1
248 1 30 ASP H 1 30 ASP QB 3.120 . 3.120 2.408 2.229 2.584 . 0 0 "[ . 1 . 2]" 1
249 1 30 ASP H 1 30 ASP HB3 3.790 . 3.790 2.947 2.480 3.682 . 0 0 "[ . 1 . 2]" 1
250 1 30 ASP H 1 31 GLN H 3.430 . 3.430 2.587 2.446 2.722 . 0 0 "[ . 1 . 2]" 1
251 1 30 ASP H 1 31 GLN HB2 4.940 . 4.940 4.759 4.574 4.935 . 0 0 "[ . 1 . 2]" 1
252 1 30 ASP H 1 33 ILE MD 4.570 . 4.570 4.176 4.026 4.313 . 0 0 "[ . 1 . 2]" 1
253 1 30 ASP HA 1 32 ALA H 4.410 . 4.410 4.310 4.106 4.434 0.024 8 0 "[ . 1 . 2]" 1
254 1 30 ASP HA 1 33 ILE H 4.470 . 4.470 3.550 3.258 3.844 . 0 0 "[ . 1 . 2]" 1
255 1 30 ASP HA 1 33 ILE HB 4.060 . 4.060 2.952 2.624 3.411 . 0 0 "[ . 1 . 2]" 1
256 1 30 ASP HA 1 33 ILE MD 3.340 . 3.340 2.194 2.040 2.561 . 0 0 "[ . 1 . 2]" 1
257 1 30 ASP HA 1 33 ILE MG 5.130 . 5.130 4.221 3.966 4.556 . 0 0 "[ . 1 . 2]" 1
258 1 30 ASP QB 1 31 GLN H 4.030 . 4.030 2.826 2.318 3.551 . 0 0 "[ . 1 . 2]" 1
259 1 30 ASP QB 1 33 ILE MD 4.570 . 4.570 3.876 3.331 4.446 . 0 0 "[ . 1 . 2]" 1
260 1 31 GLN H 1 31 GLN HB2 3.730 . 3.730 2.443 2.291 2.607 . 0 0 "[ . 1 . 2]" 1
261 1 31 GLN H 1 31 GLN HB3 3.820 . 3.820 3.593 3.545 3.636 . 0 0 "[ . 1 . 2]" 1
262 1 31 GLN H 1 31 GLN QG 3.420 . 3.420 2.357 1.974 3.355 . 0 0 "[ . 1 . 2]" 1
263 1 31 GLN H 1 32 ALA H 3.600 . 3.600 2.491 2.361 2.595 . 0 0 "[ . 1 . 2]" 1
264 1 31 GLN H 1 32 ALA MB 4.480 . 4.480 4.133 3.978 4.224 . 0 0 "[ . 1 . 2]" 1
265 1 31 GLN H 1 33 ILE MD 4.980 . 4.980 4.987 4.927 5.059 0.079 8 0 "[ . 1 . 2]" 1
266 1 31 GLN HA 1 31 GLN QG 3.480 . 3.480 2.585 2.323 2.913 . 0 0 "[ . 1 . 2]" 1
267 1 31 GLN HA 1 34 ALA H 3.910 . 3.910 3.214 3.034 3.397 . 0 0 "[ . 1 . 2]" 1
268 1 31 GLN HA 1 34 ALA MB 3.160 . 3.160 2.362 2.129 2.713 . 0 0 "[ . 1 . 2]" 1
269 1 31 GLN HB2 1 32 ALA H 3.860 . 3.860 2.749 2.560 2.996 . 0 0 "[ . 1 . 2]" 1
270 1 31 GLN HB2 1 34 ALA MB 5.120 . 5.120 4.747 4.527 5.088 . 0 0 "[ . 1 . 2]" 1
271 1 31 GLN HB3 1 32 ALA H 4.040 . 4.040 3.723 3.486 3.883 . 0 0 "[ . 1 . 2]" 1
272 1 31 GLN QG 1 32 ALA H 4.410 . 4.410 4.101 3.837 4.465 0.055 3 0 "[ . 1 . 2]" 1
273 1 31 GLN QG 1 34 ALA MB 4.610 . 4.610 4.081 3.409 4.503 . 0 0 "[ . 1 . 2]" 1
274 1 32 ALA H 1 32 ALA MB 3.190 . 3.190 2.206 2.181 2.226 . 0 0 "[ . 1 . 2]" 1
275 1 32 ALA H 1 33 ILE H 3.960 . 3.960 2.595 2.524 2.770 . 0 0 "[ . 1 . 2]" 1
276 1 32 ALA H 1 45 LEU QD 4.620 . 4.620 4.121 3.796 4.477 . 0 0 "[ . 1 . 2]" 1
277 1 32 ALA HA 1 35 LEU H 4.240 . 4.240 3.514 3.286 3.701 . 0 0 "[ . 1 . 2]" 1
278 1 32 ALA HA 1 35 LEU QB 3.660 . 3.660 2.918 2.558 3.665 0.005 15 0 "[ . 1 . 2]" 1
279 1 32 ALA HA 1 35 LEU QD 4.250 . 4.250 3.604 2.371 4.298 0.048 16 0 "[ . 1 . 2]" 1
280 1 32 ALA HA 1 35 LEU HG 5.100 . 5.100 4.183 3.396 4.700 . 0 0 "[ . 1 . 2]" 1
281 1 32 ALA HA 1 36 LEU H 5.160 . 5.160 4.291 3.873 4.860 . 0 0 "[ . 1 . 2]" 1
282 1 32 ALA HA 1 45 LEU MD1 3.830 . 3.830 2.238 1.928 2.817 . 0 0 "[ . 1 . 2]" 1
283 1 32 ALA HA 1 45 LEU QD 3.340 . 3.340 2.178 1.892 2.636 . 0 0 "[ . 1 . 2]" 1
284 1 32 ALA HA 1 45 LEU MD2 3.830 . 3.830 3.112 2.735 3.607 . 0 0 "[ . 1 . 2]" 1
285 1 32 ALA HA 1 59 ALA MB 4.970 . 4.970 4.535 3.996 4.957 . 0 0 "[ . 1 . 2]" 1
286 1 32 ALA MB 1 33 ILE H 3.570 . 3.570 2.409 2.262 2.517 . 0 0 "[ . 1 . 2]" 1
287 1 32 ALA MB 1 33 ILE MD 4.080 . 4.080 4.131 4.101 4.173 0.093 16 0 "[ . 1 . 2]" 1
288 1 32 ALA MB 1 36 LEU QD 3.830 . 3.830 3.488 3.090 3.887 0.057 18 0 "[ . 1 . 2]" 1
289 1 32 ALA MB 1 45 LEU MD1 3.650 . 3.650 2.418 2.084 2.854 . 0 0 "[ . 1 . 2]" 1
290 1 32 ALA MB 1 45 LEU QD 3.050 . 3.050 1.987 1.834 2.341 . 0 0 "[ . 1 . 2]" 1
291 1 32 ALA MB 1 45 LEU MD2 3.650 . 3.650 2.138 1.939 2.492 . 0 0 "[ . 1 . 2]" 1
292 1 32 ALA MB 1 47 ARG HD2 4.330 . 4.330 3.469 2.615 4.340 0.010 15 0 "[ . 1 . 2]" 1
293 1 32 ALA MB 1 47 ARG QD 3.720 . 3.720 2.670 2.000 3.553 . 0 0 "[ . 1 . 2]" 1
294 1 32 ALA MB 1 47 ARG HD3 4.330 . 4.330 3.126 2.016 4.295 . 0 0 "[ . 1 . 2]" 1
295 1 32 ALA MB 1 59 ALA MB 3.200 . 3.200 2.565 2.140 2.925 . 0 0 "[ . 1 . 2]" 1
296 1 32 ALA MB 1 81 VAL QG 4.590 . 4.590 3.696 3.231 4.354 . 0 0 "[ . 1 . 2]" 1
297 1 32 ALA MB 1 83 HIS HE1 5.180 . 5.180 3.941 2.317 5.092 . 0 0 "[ . 1 . 2]" 1
298 1 33 ILE H 1 33 ILE HB 3.550 . 3.550 2.505 2.467 2.572 . 0 0 "[ . 1 . 2]" 1
299 1 33 ILE H 1 33 ILE MD 3.610 . 3.610 3.357 3.270 3.411 . 0 0 "[ . 1 . 2]" 1
300 1 33 ILE H 1 34 ALA H 3.550 . 3.550 2.573 2.495 2.675 . 0 0 "[ . 1 . 2]" 1
301 1 33 ILE HA 1 33 ILE MD 4.000 . 4.000 3.854 3.835 3.897 . 0 0 "[ . 1 . 2]" 1
302 1 33 ILE HA 1 33 ILE HG12 4.120 . 4.120 2.614 2.573 2.714 . 0 0 "[ . 1 . 2]" 1
303 1 33 ILE HA 1 33 ILE QG 3.610 . 3.610 2.438 2.407 2.491 . 0 0 "[ . 1 . 2]" 1
304 1 33 ILE HA 1 33 ILE HG13 4.120 . 4.120 2.919 2.859 2.963 . 0 0 "[ . 1 . 2]" 1
305 1 33 ILE HA 1 33 ILE MG 3.370 . 3.370 2.421 2.376 2.472 . 0 0 "[ . 1 . 2]" 1
306 1 33 ILE HA 1 36 LEU H 4.450 . 4.450 3.337 3.178 3.689 . 0 0 "[ . 1 . 2]" 1
307 1 33 ILE HA 1 36 LEU QB 4.450 . 4.450 2.648 2.331 3.108 . 0 0 "[ . 1 . 2]" 1
308 1 33 ILE HA 1 36 LEU QD 4.560 . 4.560 3.336 2.940 4.055 . 0 0 "[ . 1 . 2]" 1
309 1 33 ILE HA 1 37 LYS H 4.290 . 4.290 3.969 3.636 4.292 0.002 19 0 "[ . 1 . 2]" 1
310 1 33 ILE HA 1 81 VAL MG1 3.910 . 3.910 2.720 2.215 3.605 . 0 0 "[ . 1 . 2]" 1
311 1 33 ILE HA 1 81 VAL QG 3.380 . 3.380 2.249 1.878 3.049 . 0 0 "[ . 1 . 2]" 1
312 1 33 ILE HA 1 81 VAL MG2 3.910 . 3.910 2.451 1.911 3.289 . 0 0 "[ . 1 . 2]" 1
313 1 33 ILE HB 1 33 ILE MD 3.230 . 3.230 2.332 2.299 2.370 . 0 0 "[ . 1 . 2]" 1
314 1 33 ILE HB 1 34 ALA H 3.450 . 3.450 2.531 2.415 2.638 . 0 0 "[ . 1 . 2]" 1
315 1 33 ILE HB 1 34 ALA MB 4.660 . 4.660 3.981 3.788 4.154 . 0 0 "[ . 1 . 2]" 1
316 1 33 ILE HB 1 81 VAL QG 5.330 . 5.330 4.068 3.858 4.601 . 0 0 "[ . 1 . 2]" 1
317 1 33 ILE MD 1 34 ALA H 4.320 . 4.320 4.366 4.319 4.402 0.082 15 0 "[ . 1 . 2]" 1
318 1 33 ILE MD 1 78 GLU HA 4.940 . 4.940 3.203 2.096 4.675 . 0 0 "[ . 1 . 2]" 1
319 1 33 ILE MD 1 78 GLU HB2 5.140 . 5.140 4.236 3.691 4.764 . 0 0 "[ . 1 . 2]" 1
320 1 33 ILE MD 1 78 GLU QB 4.330 . 4.330 2.830 2.189 3.581 . 0 0 "[ . 1 . 2]" 1
321 1 33 ILE MD 1 78 GLU HB3 5.140 . 5.140 2.878 2.202 3.729 . 0 0 "[ . 1 . 2]" 1
322 1 33 ILE MD 1 78 GLU QG 4.270 . 4.270 2.732 1.961 4.297 0.027 14 0 "[ . 1 . 2]" 1
323 1 33 ILE MD 1 81 VAL HB 4.590 . 4.590 3.812 3.408 4.284 . 0 0 "[ . 1 . 2]" 1
324 1 33 ILE MD 1 81 VAL MG1 4.650 . 4.650 3.707 3.360 3.972 . 0 0 "[ . 1 . 2]" 1
325 1 33 ILE MD 1 81 VAL QG 3.850 . 3.850 3.433 3.195 3.705 . 0 0 "[ . 1 . 2]" 1
326 1 33 ILE MD 1 81 VAL MG2 4.650 . 4.650 4.071 3.787 4.432 . 0 0 "[ . 1 . 2]" 1
327 1 33 ILE MD 1 83 HIS HE1 3.580 . 3.580 2.544 2.061 3.587 0.007 4 0 "[ . 1 . 2]" 1
328 1 33 ILE QG 1 33 ILE MG 3.170 . 3.170 2.265 2.205 2.291 . 0 0 "[ . 1 . 2]" 1
329 1 33 ILE QG 1 59 ALA MB 5.000 . 5.000 3.930 3.610 4.254 . 0 0 "[ . 1 . 2]" 1
330 1 33 ILE QG 1 81 VAL QG 3.890 . 3.890 2.294 1.996 2.649 . 0 0 "[ . 1 . 2]" 1
331 1 33 ILE QG 1 83 HIS HE1 4.130 . 4.130 2.364 1.889 2.791 . 0 0 "[ . 1 . 2]" 1
332 1 33 ILE HG12 1 83 HIS HE1 4.780 . 4.780 2.641 2.120 3.344 . 0 0 "[ . 1 . 2]" 1
333 1 33 ILE HG13 1 83 HIS HE1 4.780 . 4.780 2.841 2.117 3.552 . 0 0 "[ . 1 . 2]" 1
334 1 33 ILE MG 1 34 ALA H 3.670 . 3.670 3.451 3.318 3.617 . 0 0 "[ . 1 . 2]" 1
335 1 33 ILE MG 1 34 ALA HA 4.080 . 4.080 3.582 3.340 3.722 . 0 0 "[ . 1 . 2]" 1
336 1 33 ILE MG 1 34 ALA MB 4.440 . 4.440 4.224 3.986 4.417 . 0 0 "[ . 1 . 2]" 1
337 1 33 ILE MG 1 36 LEU QB 4.440 . 4.440 3.832 3.465 4.429 . 0 0 "[ . 1 . 2]" 1
338 1 33 ILE MG 1 37 LYS H 4.360 . 4.360 3.884 3.586 4.082 . 0 0 "[ . 1 . 2]" 1
339 1 33 ILE MG 1 37 LYS QB 3.600 . 3.600 2.995 2.733 3.345 . 0 0 "[ . 1 . 2]" 1
340 1 33 ILE MG 1 37 LYS HD2 4.840 . 4.840 3.656 2.446 4.620 . 0 0 "[ . 1 . 2]" 1
341 1 33 ILE MG 1 37 LYS QD 4.200 . 4.200 3.421 2.422 4.141 . 0 0 "[ . 1 . 2]" 1
342 1 33 ILE MG 1 37 LYS HD3 4.840 . 4.840 4.449 3.904 4.698 . 0 0 "[ . 1 . 2]" 1
343 1 33 ILE MG 1 37 LYS HE2 5.500 . 5.500 3.887 2.320 5.537 0.037 10 0 "[ . 1 . 2]" 1
344 1 33 ILE MG 1 37 LYS HE3 5.500 . 5.500 3.560 2.209 5.466 . 0 0 "[ . 1 . 2]" 1
345 1 33 ILE MG 1 37 LYS HG2 4.060 . 4.060 3.888 3.563 4.082 0.022 16 0 "[ . 1 . 2]" 1
346 1 33 ILE MG 1 78 GLU H 4.320 . 4.320 3.983 3.495 4.363 0.043 14 0 "[ . 1 . 2]" 1
347 1 33 ILE MG 1 78 GLU HA 3.870 . 3.870 2.419 2.009 3.235 . 0 0 "[ . 1 . 2]" 1
348 1 33 ILE MG 1 78 GLU HB2 4.830 . 4.830 4.180 3.490 4.690 . 0 0 "[ . 1 . 2]" 1
349 1 33 ILE MG 1 78 GLU QB 4.070 . 4.070 3.157 2.047 4.040 . 0 0 "[ . 1 . 2]" 1
350 1 33 ILE MG 1 78 GLU HB3 4.830 . 4.830 3.304 2.061 4.409 . 0 0 "[ . 1 . 2]" 1
351 1 33 ILE MG 1 78 GLU HG2 4.070 . 4.070 2.598 1.983 3.568 . 0 0 "[ . 1 . 2]" 1
352 1 33 ILE MG 1 78 GLU HG3 4.070 . 4.070 2.916 1.951 3.719 . 0 0 "[ . 1 . 2]" 1
353 1 33 ILE MG 1 81 VAL QG 3.660 . 3.660 2.124 1.884 2.446 . 0 0 "[ . 1 . 2]" 1
354 1 33 ILE MG 1 83 HIS HE1 5.500 . 5.500 4.413 3.709 5.122 . 0 0 "[ . 1 . 2]" 1
355 1 34 ALA H 1 34 ALA MB 2.930 . 2.930 2.252 2.208 2.284 . 0 0 "[ . 1 . 2]" 1
356 1 34 ALA H 1 36 LEU H 4.460 . 4.460 4.215 4.046 4.328 . 0 0 "[ . 1 . 2]" 1
357 1 34 ALA H 1 37 LYS HG2 4.660 . 4.660 4.485 4.236 4.628 . 0 0 "[ . 1 . 2]" 1
358 1 34 ALA HA 1 36 LEU H 5.500 . 5.500 4.561 4.201 4.873 . 0 0 "[ . 1 . 2]" 1
359 1 34 ALA HA 1 37 LYS QB 4.060 . 4.060 3.772 3.554 4.055 . 0 0 "[ . 1 . 2]" 1
360 1 34 ALA HA 1 37 LYS HD2 4.150 . 4.150 2.493 2.099 2.866 . 0 0 "[ . 1 . 2]" 1
361 1 34 ALA HA 1 37 LYS QD 3.500 . 3.500 2.267 1.920 2.791 . 0 0 "[ . 1 . 2]" 1
362 1 34 ALA HA 1 37 LYS HD3 4.150 . 4.150 3.013 1.989 4.152 0.002 9 0 "[ . 1 . 2]" 1
363 1 34 ALA HA 1 37 LYS HE2 4.790 . 4.790 4.198 3.510 4.706 . 0 0 "[ . 1 . 2]" 1
364 1 34 ALA HA 1 37 LYS QE 4.200 . 4.200 3.154 1.951 4.055 . 0 0 "[ . 1 . 2]" 1
365 1 34 ALA HA 1 37 LYS HE3 4.790 . 4.790 3.384 1.960 4.626 . 0 0 "[ . 1 . 2]" 1
366 1 34 ALA HA 1 37 LYS HG2 4.260 . 4.260 2.252 1.987 2.550 . 0 0 "[ . 1 . 2]" 1
367 1 34 ALA HA 1 37 LYS HG3 4.670 . 4.670 3.586 3.164 3.898 . 0 0 "[ . 1 . 2]" 1
368 1 34 ALA MB 1 35 LEU H 3.310 . 3.310 2.651 2.412 2.840 . 0 0 "[ . 1 . 2]" 1
369 1 34 ALA MB 1 35 LEU HA 4.130 . 4.130 3.871 3.752 4.035 . 0 0 "[ . 1 . 2]" 1
370 1 34 ALA MB 1 35 LEU QD 3.810 . 3.810 3.508 2.570 3.959 0.149 2 0 "[ . 1 . 2]" 1
371 1 34 ALA MB 1 37 LYS HE2 5.500 . 5.500 5.241 4.760 5.596 0.096 17 0 "[ . 1 . 2]" 1
372 1 34 ALA MB 1 37 LYS HE3 5.500 . 5.500 4.464 3.291 5.563 0.063 11 0 "[ . 1 . 2]" 1
373 1 35 LEU H 1 35 LEU HB2 3.770 . 3.770 2.260 2.094 2.418 . 0 0 "[ . 1 . 2]" 1
374 1 35 LEU H 1 35 LEU QB 3.010 . 3.010 2.202 2.040 2.384 . 0 0 "[ . 1 . 2]" 1
375 1 35 LEU H 1 35 LEU HB3 3.770 . 3.770 3.127 2.691 3.631 . 0 0 "[ . 1 . 2]" 1
376 1 35 LEU H 1 35 LEU QD 3.570 . 3.570 3.100 2.187 3.573 0.003 14 0 "[ . 1 . 2]" 1
377 1 35 LEU H 1 36 LEU H 3.580 . 3.580 2.491 2.351 2.658 . 0 0 "[ . 1 . 2]" 1
378 1 35 LEU H 1 37 LYS H 4.690 . 4.690 3.953 3.762 4.214 . 0 0 "[ . 1 . 2]" 1
379 1 35 LEU HA 1 35 LEU MD1 3.320 . 3.320 2.579 2.039 3.625 0.305 12 0 "[ . 1 . 2]" 1
380 1 35 LEU HA 1 35 LEU QD 2.710 . 2.710 1.964 1.908 2.024 . 0 0 "[ . 1 . 2]" 1
381 1 35 LEU HA 1 35 LEU MD2 3.320 . 3.320 2.247 1.915 2.958 . 0 0 "[ . 1 . 2]" 1
382 1 35 LEU HA 1 35 LEU HG 3.830 . 3.830 3.644 2.981 3.772 . 0 0 "[ . 1 . 2]" 1
383 1 35 LEU QB 1 35 LEU QD 2.690 . 2.690 2.027 1.840 2.091 . 0 0 "[ . 1 . 2]" 1
384 1 35 LEU QB 1 36 LEU H 3.800 . 3.800 2.445 2.243 2.782 . 0 0 "[ . 1 . 2]" 1
385 1 35 LEU QB 1 45 LEU QD 3.930 . 3.930 2.655 2.297 3.166 . 0 0 "[ . 1 . 2]" 1
386 1 35 LEU QD 1 36 LEU H 5.100 . 5.100 3.739 3.518 4.035 . 0 0 "[ . 1 . 2]" 1
387 1 36 LEU H 1 36 LEU QB 3.190 . 3.190 2.267 2.101 2.424 . 0 0 "[ . 1 . 2]" 1
388 1 36 LEU H 1 36 LEU QD 3.860 . 3.860 3.077 2.375 3.634 . 0 0 "[ . 1 . 2]" 1
389 1 36 LEU H 1 37 LYS H 3.520 . 3.520 2.634 2.434 2.813 . 0 0 "[ . 1 . 2]" 1
390 1 36 LEU H 1 81 VAL QG 5.440 . 5.440 3.989 3.649 4.770 . 0 0 "[ . 1 . 2]" 1
391 1 36 LEU HA 1 36 LEU MD1 4.510 . 4.510 3.099 2.034 3.785 . 0 0 "[ . 1 . 2]" 1
392 1 36 LEU HA 1 36 LEU QD 3.190 . 3.190 2.025 1.937 2.256 . 0 0 "[ . 1 . 2]" 1
393 1 36 LEU HA 1 36 LEU MD2 4.510 . 4.510 2.703 1.944 3.818 . 0 0 "[ . 1 . 2]" 1
394 1 36 LEU HA 1 39 LYS QB 4.440 . 4.440 2.362 1.923 3.063 . 0 0 "[ . 1 . 2]" 1
395 1 36 LEU HA 1 39 LYS QG 4.530 . 4.530 2.958 2.042 4.211 . 0 0 "[ . 1 . 2]" 1
396 1 36 LEU HA 1 43 ALA MB 4.380 . 4.380 3.931 3.311 4.436 0.056 16 0 "[ . 1 . 2]" 1
397 1 36 LEU QB 1 37 LYS H 3.900 . 3.900 2.985 2.600 3.231 . 0 0 "[ . 1 . 2]" 1
398 1 36 LEU QB 1 81 VAL QG 3.240 . 3.240 2.223 1.976 2.891 . 0 0 "[ . 1 . 2]" 1
399 1 36 LEU HB2 1 81 VAL MG1 4.420 . 4.420 3.343 2.913 4.422 0.002 18 0 "[ . 1 . 2]" 1
400 1 36 LEU HB2 1 81 VAL MG2 4.420 . 4.420 2.751 2.128 4.437 0.017 17 0 "[ . 1 . 2]" 1
401 1 36 LEU HB3 1 81 VAL MG1 4.420 . 4.420 3.567 2.963 3.859 . 0 0 "[ . 1 . 2]" 1
402 1 36 LEU HB3 1 81 VAL MG2 4.420 . 4.420 2.556 2.276 3.109 . 0 0 "[ . 1 . 2]" 1
403 1 36 LEU QD 1 37 LYS H 4.650 . 4.650 4.235 3.909 4.344 . 0 0 "[ . 1 . 2]" 1
404 1 36 LEU QD 1 39 LYS H 5.440 . 5.440 4.216 3.856 4.837 . 0 0 "[ . 1 . 2]" 1
405 1 36 LEU QD 1 39 LYS QB 4.630 . 4.630 2.732 2.043 3.437 . 0 0 "[ . 1 . 2]" 1
406 1 36 LEU QD 1 39 LYS QG 4.380 . 4.380 3.122 2.100 4.329 . 0 0 "[ . 1 . 2]" 1
407 1 36 LEU QD 1 43 ALA HA 4.780 . 4.780 4.283 3.898 4.626 . 0 0 "[ . 1 . 2]" 1
408 1 36 LEU QD 1 43 ALA MB 2.960 . 2.960 2.626 2.127 3.006 0.046 6 0 "[ . 1 . 2]" 1
409 1 36 LEU QD 1 44 PHE H 4.070 . 4.070 3.431 3.023 3.698 . 0 0 "[ . 1 . 2]" 1
410 1 36 LEU QD 1 44 PHE QB 4.290 . 4.290 3.571 3.371 3.775 . 0 0 "[ . 1 . 2]" 1
411 1 36 LEU QD 1 45 LEU QB 5.260 . 5.260 3.276 2.778 3.555 . 0 0 "[ . 1 . 2]" 1
412 1 36 LEU QD 1 45 LEU QD 3.600 . 3.600 1.881 1.709 1.992 . 0 0 "[ . 1 . 2]" 1
413 1 36 LEU QD 1 45 LEU HG 4.420 . 4.420 4.012 3.883 4.122 . 0 0 "[ . 1 . 2]" 1
414 1 36 LEU QD 1 59 ALA HA 4.690 . 4.690 3.759 3.587 4.165 . 0 0 "[ . 1 . 2]" 1
415 1 36 LEU QD 1 59 ALA MB 2.880 . 2.880 2.133 1.942 2.489 . 0 0 "[ . 1 . 2]" 1
416 1 36 LEU QD 1 60 LEU HA 4.060 . 4.060 2.857 2.505 3.140 . 0 0 "[ . 1 . 2]" 1
417 1 36 LEU QD 1 61 LYS H 3.990 . 3.990 2.484 2.109 2.678 . 0 0 "[ . 1 . 2]" 1
418 1 36 LEU QD 1 81 VAL H 5.440 . 5.440 5.351 5.158 5.477 0.037 13 0 "[ . 1 . 2]" 1
419 1 36 LEU QD 1 81 VAL QG 3.120 . 3.120 1.863 1.777 2.021 . 0 0 "[ . 1 . 2]" 1
420 1 36 LEU MD1 1 44 PHE HA 4.130 . 4.130 2.849 2.102 3.265 . 0 0 "[ . 1 . 2]" 1
421 1 36 LEU MD1 1 59 ALA MB 3.700 . 3.700 2.686 1.949 3.722 0.022 18 0 "[ . 1 . 2]" 1
422 1 36 LEU MD1 1 61 LYS H 4.730 . 4.730 3.178 2.531 4.690 . 0 0 "[ . 1 . 2]" 1
423 1 36 LEU MD2 1 44 PHE HA 4.130 . 4.130 2.440 2.129 3.207 . 0 0 "[ . 1 . 2]" 1
424 1 36 LEU MD2 1 59 ALA MB 3.700 . 3.700 3.165 2.088 3.744 0.044 14 0 "[ . 1 . 2]" 1
425 1 36 LEU MD2 1 61 LYS H 4.730 . 4.730 2.808 2.171 3.490 . 0 0 "[ . 1 . 2]" 1
426 1 37 LYS H 1 37 LYS QB 3.470 . 3.470 2.613 2.518 2.733 . 0 0 "[ . 1 . 2]" 1
427 1 37 LYS H 1 37 LYS HG2 4.180 . 4.180 2.146 1.965 2.249 . 0 0 "[ . 1 . 2]" 1
428 1 37 LYS H 1 37 LYS HG3 3.790 . 3.790 3.337 3.141 3.498 . 0 0 "[ . 1 . 2]" 1
429 1 37 LYS H 1 38 ASP H 4.240 . 4.240 2.565 2.372 2.826 . 0 0 "[ . 1 . 2]" 1
430 1 37 LYS H 1 77 VAL MG1 5.500 . 5.500 5.132 4.273 5.524 0.024 3 0 "[ . 1 . 2]" 1
431 1 37 LYS H 1 77 VAL QG 4.580 . 4.580 4.030 3.428 4.472 . 0 0 "[ . 1 . 2]" 1
432 1 37 LYS H 1 77 VAL MG2 5.500 . 5.500 4.236 3.520 4.882 . 0 0 "[ . 1 . 2]" 1
433 1 37 LYS H 1 81 VAL QG 4.310 . 4.310 3.829 3.350 4.332 0.022 18 0 "[ . 1 . 2]" 1
434 1 37 LYS HA 1 37 LYS QE 4.810 . 4.810 4.314 4.144 4.555 . 0 0 "[ . 1 . 2]" 1
435 1 37 LYS HA 1 37 LYS HG3 3.820 . 3.820 3.801 3.750 3.836 0.016 20 0 "[ . 1 . 2]" 1
436 1 37 LYS HA 1 61 LYS QE 5.270 . 5.270 3.343 2.253 4.258 . 0 0 "[ . 1 . 2]" 1
437 1 37 LYS HA 1 61 LYS QG 4.080 . 4.080 3.904 3.184 4.181 0.101 15 0 "[ . 1 . 2]" 1
438 1 37 LYS HA 1 77 VAL MG1 5.310 . 5.310 4.292 3.526 5.313 0.003 11 0 "[ . 1 . 2]" 1
439 1 37 LYS HA 1 77 VAL QG 3.950 . 3.950 2.612 1.981 3.338 . 0 0 "[ . 1 . 2]" 1
440 1 37 LYS HA 1 77 VAL MG2 5.310 . 5.310 2.637 1.990 3.374 . 0 0 "[ . 1 . 2]" 1
441 1 37 LYS HA 1 81 VAL QG 4.520 . 4.520 3.846 2.945 4.405 . 0 0 "[ . 1 . 2]" 1
442 1 37 LYS QB 1 37 LYS HE2 3.980 . 3.980 2.252 1.948 2.917 . 0 0 "[ . 1 . 2]" 1
443 1 37 LYS QB 1 37 LYS QE 3.480 . 3.480 2.028 1.914 2.119 . 0 0 "[ . 1 . 2]" 1
444 1 37 LYS QB 1 37 LYS HE3 3.980 . 3.980 2.847 2.016 3.515 . 0 0 "[ . 1 . 2]" 1
445 1 37 LYS QB 1 38 ASP H 4.080 . 4.080 3.693 3.504 3.862 . 0 0 "[ . 1 . 2]" 1
446 1 37 LYS QB 1 61 LYS QE 5.180 . 5.180 4.371 3.464 5.223 0.043 10 0 "[ . 1 . 2]" 1
447 1 37 LYS QB 1 77 VAL MG1 3.740 . 3.740 2.594 1.984 3.273 . 0 0 "[ . 1 . 2]" 1
448 1 37 LYS QB 1 77 VAL MG2 3.740 . 3.740 2.093 1.842 2.669 . 0 0 "[ . 1 . 2]" 1
449 1 37 LYS QB 1 81 VAL QG 4.110 . 4.110 3.678 2.843 4.114 0.004 12 0 "[ . 1 . 2]" 1
450 1 37 LYS QD 1 77 VAL QG 3.740 . 3.740 2.942 2.003 3.453 . 0 0 "[ . 1 . 2]" 1
451 1 37 LYS QE 1 37 LYS HG2 3.590 . 3.590 2.969 2.376 3.526 . 0 0 "[ . 1 . 2]" 1
452 1 37 LYS QE 1 37 LYS HG3 3.340 . 3.340 2.955 2.372 3.352 0.012 15 0 "[ . 1 . 2]" 1
453 1 37 LYS QE 1 77 VAL QG 3.820 . 3.820 2.296 1.843 3.020 . 0 0 "[ . 1 . 2]" 1
454 1 37 LYS HE2 1 37 LYS HG3 3.910 . 3.910 3.202 2.479 3.802 . 0 0 "[ . 1 . 2]" 1
455 1 37 LYS HE3 1 37 LYS HG3 3.910 . 3.910 3.576 3.026 3.775 . 0 0 "[ . 1 . 2]" 1
456 1 37 LYS HG2 1 38 ASP H 4.280 . 4.280 3.131 2.743 3.554 . 0 0 "[ . 1 . 2]" 1
457 1 37 LYS HG2 1 77 VAL QG 4.390 . 4.390 3.968 3.535 4.382 . 0 0 "[ . 1 . 2]" 1
458 1 37 LYS HG3 1 38 ASP H 3.940 . 3.940 3.067 2.498 3.665 . 0 0 "[ . 1 . 2]" 1
459 1 37 LYS HG3 1 77 VAL QG 5.150 . 5.150 3.940 3.730 4.176 . 0 0 "[ . 1 . 2]" 1
460 1 38 ASP H 1 38 ASP QB 3.540 . 3.540 2.333 2.168 2.787 . 0 0 "[ . 1 . 2]" 1
461 1 38 ASP H 1 39 LYS H 3.460 . 3.460 2.220 1.944 2.475 . 0 0 "[ . 1 . 2]" 1
462 1 38 ASP H 1 39 LYS QG 4.400 . 4.400 3.788 3.171 4.419 0.019 14 0 "[ . 1 . 2]" 1
463 1 39 LYS H 1 39 LYS HB2 4.040 . 4.040 2.519 2.281 2.713 . 0 0 "[ . 1 . 2]" 1
464 1 39 LYS H 1 39 LYS QB 3.500 . 3.500 2.477 2.255 2.656 . 0 0 "[ . 1 . 2]" 1
465 1 39 LYS H 1 39 LYS HB3 4.040 . 4.040 3.668 3.553 3.781 . 0 0 "[ . 1 . 2]" 1
466 1 39 LYS H 1 39 LYS QG 3.480 . 3.480 2.719 2.168 3.393 . 0 0 "[ . 1 . 2]" 1
467 1 39 LYS H 1 40 ASP H 4.670 . 4.670 4.303 2.539 4.590 . 0 0 "[ . 1 . 2]" 1
468 1 39 LYS HA 1 39 LYS QE 4.390 . 4.390 3.408 1.733 4.464 0.074 10 0 "[ . 1 . 2]" 1
469 1 39 LYS HA 1 39 LYS HG2 4.020 . 4.020 2.742 2.298 3.340 . 0 0 "[ . 1 . 2]" 1
470 1 39 LYS HA 1 39 LYS QG 3.220 . 3.220 2.640 2.195 3.123 . 0 0 "[ . 1 . 2]" 1
471 1 39 LYS HA 1 39 LYS HG3 4.020 . 4.020 3.474 2.696 3.850 . 0 0 "[ . 1 . 2]" 1
472 1 39 LYS HA 1 40 ASP H 3.320 . 3.320 2.478 2.139 3.438 0.118 17 0 "[ . 1 . 2]" 1
473 1 39 LYS HA 1 43 ALA MB 4.530 . 4.530 4.218 3.956 4.561 0.031 6 0 "[ . 1 . 2]" 1
474 1 39 LYS QB 1 39 LYS QE 4.230 . 4.230 2.718 1.924 3.850 . 0 0 "[ . 1 . 2]" 1
475 1 39 LYS QB 1 40 ASP H 4.070 . 4.070 2.249 1.919 3.262 . 0 0 "[ . 1 . 2]" 1
476 1 39 LYS QB 1 43 ALA MB 3.290 . 3.290 2.150 1.906 2.415 . 0 0 "[ . 1 . 2]" 1
477 1 39 LYS HB2 1 39 LYS HE2 5.500 . 5.500 4.465 2.873 5.510 0.010 19 0 "[ . 1 . 2]" 1
478 1 39 LYS HB2 1 39 LYS HE3 5.500 . 5.500 4.046 2.459 5.061 . 0 0 "[ . 1 . 2]" 1
479 1 39 LYS HB3 1 39 LYS HE2 5.500 . 5.500 3.789 2.134 4.841 . 0 0 "[ . 1 . 2]" 1
480 1 39 LYS HB3 1 39 LYS HE3 5.500 . 5.500 3.163 1.952 4.624 . 0 0 "[ . 1 . 2]" 1
481 1 39 LYS QE 1 39 LYS QG 3.230 . 3.230 2.458 2.055 2.895 . 0 0 "[ . 1 . 2]" 1
482 1 39 LYS QE 1 43 ALA MB 4.550 . 4.550 3.314 1.873 4.557 0.007 6 0 "[ . 1 . 2]" 1
483 1 39 LYS HE2 1 43 ALA MB 5.240 . 5.240 3.984 2.630 5.321 0.081 15 0 "[ . 1 . 2]" 1
484 1 39 LYS HE3 1 43 ALA MB 5.240 . 5.240 3.722 1.890 5.271 0.031 4 0 "[ . 1 . 2]" 1
485 1 40 ASP H 1 40 ASP HB2 4.000 . 4.000 2.767 2.399 3.605 . 0 0 "[ . 1 . 2]" 1
486 1 40 ASP H 1 40 ASP HB3 4.000 . 4.000 3.171 2.294 3.652 . 0 0 "[ . 1 . 2]" 1
487 1 40 ASP H 1 43 ALA H 5.500 . 5.500 4.665 3.943 5.412 . 0 0 "[ . 1 . 2]" 1
488 1 40 ASP H 1 43 ALA MB 4.730 . 4.730 3.103 2.624 4.144 . 0 0 "[ . 1 . 2]" 1
489 1 40 ASP QB 1 43 ALA MB 4.610 . 4.610 3.453 2.229 4.582 . 0 0 "[ . 1 . 2]" 1
490 1 41 PRO HA 1 42 GLY H 3.500 . 3.500 2.116 2.056 2.159 . 0 0 "[ . 1 . 2]" 1
491 1 41 PRO HA 1 43 ALA H 4.280 . 4.280 3.392 3.180 3.600 . 0 0 "[ . 1 . 2]" 1
492 1 41 PRO HA 1 61 LYS QB 3.840 . 3.840 2.912 2.123 3.403 . 0 0 "[ . 1 . 2]" 1
493 1 41 PRO HA 1 61 LYS QD 5.240 . 5.240 3.778 2.130 4.556 . 0 0 "[ . 1 . 2]" 1
494 1 41 PRO HA 1 61 LYS QG 4.160 . 4.160 2.712 2.003 4.168 0.008 10 0 "[ . 1 . 2]" 1
495 1 41 PRO HA 1 63 ALA HA 5.150 . 5.150 4.505 4.133 4.819 . 0 0 "[ . 1 . 2]" 1
496 1 41 PRO HB2 1 42 GLY QA 4.660 . 4.660 4.164 3.980 4.315 . 0 0 "[ . 1 . 2]" 1
497 1 41 PRO HB2 1 62 VAL HA 4.790 . 4.790 4.173 3.403 4.764 . 0 0 "[ . 1 . 2]" 1
498 1 41 PRO HB2 1 63 ALA H 4.660 . 4.660 3.967 3.053 4.565 . 0 0 "[ . 1 . 2]" 1
499 1 41 PRO HB2 1 63 ALA HA 4.470 . 4.470 4.060 3.015 4.515 0.045 16 0 "[ . 1 . 2]" 1
500 1 41 PRO HB2 1 63 ALA MB 3.670 . 3.670 3.205 2.748 3.663 . 0 0 "[ . 1 . 2]" 1
501 1 41 PRO HB3 1 42 GLY H 4.670 . 4.670 3.791 3.585 3.984 . 0 0 "[ . 1 . 2]" 1
502 1 41 PRO HB3 1 62 VAL HA 4.810 . 4.810 3.124 2.529 3.790 . 0 0 "[ . 1 . 2]" 1
503 1 41 PRO HB3 1 63 ALA H 4.540 . 4.540 2.928 2.203 3.696 . 0 0 "[ . 1 . 2]" 1
504 1 41 PRO HB3 1 63 ALA HA 4.320 . 4.320 2.765 2.312 3.344 . 0 0 "[ . 1 . 2]" 1
505 1 41 PRO HB3 1 63 ALA MB 3.690 . 3.690 2.840 2.269 3.399 . 0 0 "[ . 1 . 2]" 1
506 1 42 GLY H 1 43 ALA H 3.640 . 3.640 2.258 2.075 2.418 . 0 0 "[ . 1 . 2]" 1
507 1 42 GLY H 1 43 ALA MB 4.390 . 4.390 3.968 3.716 4.107 . 0 0 "[ . 1 . 2]" 1
508 1 42 GLY H 1 60 LEU QD 4.440 . 4.440 3.202 2.866 3.572 . 0 0 "[ . 1 . 2]" 1
509 1 42 GLY H 1 61 LYS HB2 4.910 . 4.910 4.500 3.113 4.917 0.007 7 0 "[ . 1 . 2]" 1
510 1 42 GLY H 1 61 LYS QB 4.090 . 4.090 2.917 2.603 3.282 . 0 0 "[ . 1 . 2]" 1
511 1 42 GLY H 1 61 LYS HB3 4.910 . 4.910 2.965 2.632 3.333 . 0 0 "[ . 1 . 2]" 1
512 1 42 GLY H 1 61 LYS QG 4.570 . 4.570 3.864 3.307 4.641 0.071 10 0 "[ . 1 . 2]" 1
513 1 42 GLY H 1 62 VAL HA 5.170 . 5.170 3.430 3.141 3.839 . 0 0 "[ . 1 . 2]" 1
514 1 42 GLY QA 1 60 LEU QD 3.530 . 3.530 2.620 2.391 2.940 . 0 0 "[ . 1 . 2]" 1
515 1 42 GLY QA 1 125 LEU HA 4.880 . 4.880 3.725 3.075 4.472 . 0 0 "[ . 1 . 2]" 1
516 1 42 GLY QA 1 126 ARG H 5.340 . 5.340 3.265 3.000 3.550 . 0 0 "[ . 1 . 2]" 1
517 1 42 GLY QA 1 126 ARG QB 4.270 . 4.270 2.821 2.506 3.553 . 0 0 "[ . 1 . 2]" 1
518 1 42 GLY QA 1 126 ARG QG 4.750 . 4.750 3.463 2.078 4.794 0.044 13 0 "[ . 1 . 2]" 1
519 1 43 ALA H 1 43 ALA MB 3.030 . 3.030 2.258 2.226 2.301 . 0 0 "[ . 1 . 2]" 1
520 1 43 ALA H 1 60 LEU QD 4.730 . 4.730 3.881 3.689 4.249 . 0 0 "[ . 1 . 2]" 1
521 1 43 ALA H 1 61 LYS QB 4.310 . 4.310 3.058 2.658 3.580 . 0 0 "[ . 1 . 2]" 1
522 1 43 ALA HA 1 44 PHE H 3.280 . 3.280 2.289 2.197 2.371 . 0 0 "[ . 1 . 2]" 1
523 1 43 ALA MB 1 44 PHE H 3.420 . 3.420 2.614 2.419 2.915 . 0 0 "[ . 1 . 2]" 1
524 1 43 ALA MB 1 44 PHE QB 5.340 . 5.340 4.515 4.446 4.573 . 0 0 "[ . 1 . 2]" 1
525 1 43 ALA MB 1 61 LYS QB 4.030 . 4.030 2.886 2.450 3.438 . 0 0 "[ . 1 . 2]" 1
526 1 44 PHE H 1 45 LEU H 4.730 . 4.730 4.282 4.247 4.325 . 0 0 "[ . 1 . 2]" 1
527 1 44 PHE HA 1 58 LEU MD1 5.500 . 5.500 4.309 3.735 5.076 . 0 0 "[ . 1 . 2]" 1
528 1 44 PHE HA 1 58 LEU QD 4.420 . 4.420 3.860 3.680 4.112 . 0 0 "[ . 1 . 2]" 1
529 1 44 PHE HA 1 58 LEU MD2 5.500 . 5.500 4.902 3.913 5.590 0.090 15 0 "[ . 1 . 2]" 1
530 1 44 PHE HA 1 59 ALA MB 4.670 . 4.670 4.092 3.892 4.285 . 0 0 "[ . 1 . 2]" 1
531 1 44 PHE HA 1 60 LEU HA 3.880 . 3.880 2.530 2.349 2.736 . 0 0 "[ . 1 . 2]" 1
532 1 44 PHE HA 1 60 LEU QD 3.960 . 3.960 3.417 3.173 3.969 0.009 17 0 "[ . 1 . 2]" 1
533 1 44 PHE HA 1 61 LYS H 4.650 . 4.650 3.244 3.062 3.410 . 0 0 "[ . 1 . 2]" 1
534 1 44 PHE HA 1 81 VAL QG 5.440 . 5.440 4.950 4.701 5.230 . 0 0 "[ . 1 . 2]" 1
535 1 44 PHE HA 1 125 LEU QD 4.730 . 4.730 4.380 4.160 4.632 . 0 0 "[ . 1 . 2]" 1
536 1 44 PHE QB 1 45 LEU H 3.650 . 3.650 2.383 2.212 2.548 . 0 0 "[ . 1 . 2]" 1
537 1 44 PHE QB 1 45 LEU QD 4.760 . 4.760 3.938 3.745 4.083 . 0 0 "[ . 1 . 2]" 1
538 1 44 PHE QB 1 58 LEU QD 3.420 . 3.420 2.106 1.874 2.451 . 0 0 "[ . 1 . 2]" 1
539 1 44 PHE QB 1 60 LEU QD 3.430 . 3.430 2.196 1.905 3.122 . 0 0 "[ . 1 . 2]" 1
540 1 44 PHE QB 1 125 LEU QD 3.760 . 3.760 2.296 2.071 2.521 . 0 0 "[ . 1 . 2]" 1
541 1 44 PHE HB2 1 45 LEU H 4.280 . 4.280 2.409 2.230 2.583 . 0 0 "[ . 1 . 2]" 1
542 1 44 PHE HB2 1 60 LEU HA 4.670 . 4.670 3.138 2.794 3.395 . 0 0 "[ . 1 . 2]" 1
543 1 44 PHE HB3 1 45 LEU H 4.280 . 4.280 3.788 3.680 3.896 . 0 0 "[ . 1 . 2]" 1
544 1 44 PHE HB3 1 60 LEU HA 4.670 . 4.670 2.826 2.459 3.185 . 0 0 "[ . 1 . 2]" 1
545 1 45 LEU H 1 45 LEU HG 4.350 . 4.350 3.489 3.198 3.841 . 0 0 "[ . 1 . 2]" 1
546 1 45 LEU H 1 58 LEU HA 4.640 . 4.640 4.269 4.111 4.499 . 0 0 "[ . 1 . 2]" 1
547 1 45 LEU H 1 59 ALA H 3.970 . 3.970 2.870 2.753 3.041 . 0 0 "[ . 1 . 2]" 1
548 1 45 LEU H 1 59 ALA MB 4.130 . 4.130 3.228 2.957 3.443 . 0 0 "[ . 1 . 2]" 1
549 1 45 LEU HA 1 45 LEU MD1 4.440 . 4.440 4.103 4.067 4.143 . 0 0 "[ . 1 . 2]" 1
550 1 45 LEU HA 1 45 LEU QD 3.830 . 3.830 3.385 3.360 3.417 . 0 0 "[ . 1 . 2]" 1
551 1 45 LEU HA 1 45 LEU MD2 4.440 . 4.440 3.607 3.554 3.666 . 0 0 "[ . 1 . 2]" 1
552 1 45 LEU QB 1 45 LEU MD1 3.220 . 3.220 2.062 2.029 2.075 . 0 0 "[ . 1 . 2]" 1
553 1 45 LEU QB 1 45 LEU MD2 3.220 . 3.220 2.258 2.181 2.355 . 0 0 "[ . 1 . 2]" 1
554 1 45 LEU QB 1 46 ILE H 3.990 . 3.990 2.619 2.476 2.699 . 0 0 "[ . 1 . 2]" 1
555 1 45 LEU QB 1 46 ILE HA 4.710 . 4.710 4.444 4.273 4.566 . 0 0 "[ . 1 . 2]" 1
556 1 45 LEU QB 1 58 LEU QD 5.440 . 5.440 4.823 4.645 5.136 . 0 0 "[ . 1 . 2]" 1
557 1 45 LEU QB 1 59 ALA MB 4.790 . 4.790 4.295 4.023 4.498 . 0 0 "[ . 1 . 2]" 1
558 1 45 LEU QD 1 46 ILE H 4.520 . 4.520 3.846 3.657 3.971 . 0 0 "[ . 1 . 2]" 1
559 1 45 LEU QD 1 47 ARG HB3 4.220 . 4.220 3.554 2.885 4.154 . 0 0 "[ . 1 . 2]" 1
560 1 45 LEU QD 1 47 ARG QD 4.180 . 4.180 3.538 3.147 4.152 . 0 0 "[ . 1 . 2]" 1
561 1 45 LEU QD 1 59 ALA H 4.170 . 4.170 3.213 2.773 3.542 . 0 0 "[ . 1 . 2]" 1
562 1 45 LEU QD 1 59 ALA HA 4.740 . 4.740 4.285 4.122 4.407 . 0 0 "[ . 1 . 2]" 1
563 1 45 LEU QD 1 59 ALA MB 3.520 . 3.520 1.906 1.808 2.013 . 0 0 "[ . 1 . 2]" 1
564 1 45 LEU QD 1 61 LYS H 5.440 . 5.440 4.973 4.661 5.240 . 0 0 "[ . 1 . 2]" 1
565 1 45 LEU MD1 1 47 ARG HB3 5.500 . 5.500 3.637 2.909 4.391 . 0 0 "[ . 1 . 2]" 1
566 1 45 LEU MD2 1 47 ARG HB3 5.500 . 5.500 5.153 4.033 5.543 0.043 4 0 "[ . 1 . 2]" 1
567 1 45 LEU HG 1 47 ARG H 4.640 . 4.640 4.460 3.692 4.667 0.027 10 0 "[ . 1 . 2]" 1
568 1 45 LEU HG 1 47 ARG HB3 4.760 . 4.760 3.966 3.003 4.543 . 0 0 "[ . 1 . 2]" 1
569 1 45 LEU HG 1 59 ALA MB 3.600 . 3.600 3.051 2.474 3.612 0.012 10 0 "[ . 1 . 2]" 1
570 1 46 ILE H 1 46 ILE HB 4.020 . 4.020 2.669 2.609 2.735 . 0 0 "[ . 1 . 2]" 1
571 1 46 ILE H 1 46 ILE MD 4.530 . 4.530 4.176 4.044 4.289 . 0 0 "[ . 1 . 2]" 1
572 1 46 ILE H 1 46 ILE QG 4.610 . 4.610 2.872 2.710 2.986 . 0 0 "[ . 1 . 2]" 1
573 1 46 ILE H 1 46 ILE MG 4.480 . 4.480 3.847 3.811 3.885 . 0 0 "[ . 1 . 2]" 1
574 1 46 ILE HA 1 46 ILE MD 4.100 . 4.100 3.838 3.801 3.892 . 0 0 "[ . 1 . 2]" 1
575 1 46 ILE HA 1 46 ILE QG 3.630 . 3.630 2.388 2.328 2.464 . 0 0 "[ . 1 . 2]" 1
576 1 46 ILE HA 1 46 ILE MG 3.530 . 3.530 2.440 2.400 2.476 . 0 0 "[ . 1 . 2]" 1
577 1 46 ILE HA 1 58 LEU HA 4.000 . 4.000 2.515 2.254 2.818 . 0 0 "[ . 1 . 2]" 1
578 1 46 ILE HA 1 58 LEU HB2 4.770 . 4.770 4.249 3.925 4.611 . 0 0 "[ . 1 . 2]" 1
579 1 46 ILE HA 1 58 LEU QD 4.180 . 4.180 3.394 3.244 3.592 . 0 0 "[ . 1 . 2]" 1
580 1 46 ILE HA 1 59 ALA H 4.400 . 4.400 3.469 3.251 3.701 . 0 0 "[ . 1 . 2]" 1
581 1 46 ILE HB 1 46 ILE MD 3.710 . 3.710 2.504 2.455 2.540 . 0 0 "[ . 1 . 2]" 1
582 1 46 ILE HB 1 47 ARG H 4.400 . 4.400 4.137 3.968 4.323 . 0 0 "[ . 1 . 2]" 1
583 1 46 ILE HB 1 58 LEU QD 4.560 . 4.560 4.286 4.156 4.458 . 0 0 "[ . 1 . 2]" 1
584 1 46 ILE MD 1 46 ILE MG 3.080 . 3.080 1.926 1.893 1.963 . 0 0 "[ . 1 . 2]" 1
585 1 46 ILE MD 1 56 TYR HB3 5.160 . 5.160 4.085 3.638 4.671 . 0 0 "[ . 1 . 2]" 1
586 1 46 ILE MD 1 58 LEU HA 5.200 . 5.200 4.112 3.834 4.580 . 0 0 "[ . 1 . 2]" 1
587 1 46 ILE MD 1 58 LEU HG 4.640 . 4.640 4.388 3.586 4.762 0.122 8 0 "[ . 1 . 2]" 1
588 1 46 ILE MD 1 86 ILE QG 4.880 . 4.880 3.868 3.374 4.118 . 0 0 "[ . 1 . 2]" 1
589 1 46 ILE MD 1 107 LEU HB2 4.320 . 4.320 3.978 3.507 4.254 . 0 0 "[ . 1 . 2]" 1
590 1 46 ILE MD 1 107 LEU HB3 4.450 . 4.450 2.767 2.421 3.002 . 0 0 "[ . 1 . 2]" 1
591 1 46 ILE MD 1 107 LEU MD1 3.740 . 3.740 2.651 2.048 3.854 0.114 18 0 "[ . 1 . 2]" 1
592 1 46 ILE MD 1 107 LEU QD 3.100 . 3.100 2.219 1.953 2.422 . 0 0 "[ . 1 . 2]" 1
593 1 46 ILE MD 1 107 LEU MD2 3.740 . 3.740 2.563 1.958 3.808 0.068 1 0 "[ . 1 . 2]" 1
594 1 46 ILE MD 1 107 LEU HG 4.590 . 4.590 4.321 2.555 4.675 0.085 7 0 "[ . 1 . 2]" 1
595 1 46 ILE MD 1 110 LEU QD 3.530 . 3.530 2.680 2.177 3.147 . 0 0 "[ . 1 . 2]" 1
596 1 46 ILE MD 1 111 VAL HA 5.010 . 5.010 4.690 4.287 5.015 0.005 8 0 "[ . 1 . 2]" 1
597 1 46 ILE MD 1 111 VAL MG1 4.580 . 4.580 4.217 3.982 4.450 . 0 0 "[ . 1 . 2]" 1
598 1 46 ILE MD 1 111 VAL MG2 3.190 . 3.190 2.522 2.305 2.748 . 0 0 "[ . 1 . 2]" 1
599 1 46 ILE QG 1 58 LEU HA 3.850 . 3.850 2.518 2.209 3.033 . 0 0 "[ . 1 . 2]" 1
600 1 46 ILE QG 1 58 LEU QD 3.020 . 3.020 1.928 1.859 1.988 . 0 0 "[ . 1 . 2]" 1
601 1 46 ILE QG 1 86 ILE MD 4.020 . 4.020 2.973 2.398 3.381 . 0 0 "[ . 1 . 2]" 1
602 1 46 ILE QG 1 107 LEU HB3 5.340 . 5.340 4.952 4.583 5.199 . 0 0 "[ . 1 . 2]" 1
603 1 46 ILE QG 1 107 LEU QD 4.340 . 4.340 3.784 3.544 3.873 . 0 0 "[ . 1 . 2]" 1
604 1 46 ILE QG 1 111 VAL MG2 4.600 . 4.600 3.834 3.583 4.104 . 0 0 "[ . 1 . 2]" 1
605 1 46 ILE HG12 1 58 LEU HA 4.390 . 4.390 2.556 2.231 3.099 . 0 0 "[ . 1 . 2]" 1
606 1 46 ILE HG13 1 58 LEU HA 4.390 . 4.390 3.816 3.537 4.306 . 0 0 "[ . 1 . 2]" 1
607 1 46 ILE MG 1 47 ARG H 3.710 . 3.710 2.615 2.411 2.960 . 0 0 "[ . 1 . 2]" 1
608 1 46 ILE MG 1 47 ARG HA 4.210 . 4.210 3.532 3.223 3.768 . 0 0 "[ . 1 . 2]" 1
609 1 46 ILE MG 1 56 TYR HA 4.210 . 4.210 3.730 3.430 4.234 0.024 20 0 "[ . 1 . 2]" 1
610 1 46 ILE MG 1 56 TYR HB2 3.820 . 3.820 2.828 2.613 3.090 . 0 0 "[ . 1 . 2]" 1
611 1 46 ILE MG 1 56 TYR HB3 3.640 . 3.640 2.023 1.912 2.329 . 0 0 "[ . 1 . 2]" 1
612 1 46 ILE MG 1 56 TYR QD 3.660 . 3.660 3.194 2.746 3.467 . 0 0 "[ . 1 . 2]" 1
613 1 46 ILE MG 1 56 TYR QE 5.370 . 5.370 4.640 4.262 5.036 . 0 0 "[ . 1 . 2]" 1
614 1 46 ILE MG 1 57 GLY H 4.550 . 4.550 3.335 2.678 3.827 . 0 0 "[ . 1 . 2]" 1
615 1 46 ILE MG 1 57 GLY HA3 5.350 . 5.350 4.680 4.275 5.138 . 0 0 "[ . 1 . 2]" 1
616 1 46 ILE MG 1 58 LEU HA 4.160 . 4.160 3.408 3.091 3.705 . 0 0 "[ . 1 . 2]" 1
617 1 46 ILE MG 1 86 ILE MD 3.510 . 3.510 2.622 2.048 2.924 . 0 0 "[ . 1 . 2]" 1
618 1 46 ILE MG 1 86 ILE QG 4.540 . 4.540 4.066 3.542 4.360 . 0 0 "[ . 1 . 2]" 1
619 1 46 ILE MG 1 107 LEU HB3 4.260 . 4.260 4.004 3.462 4.261 0.001 10 0 "[ . 1 . 2]" 1
620 1 46 ILE MG 1 107 LEU MD1 3.740 . 3.740 2.366 1.998 3.771 0.031 8 0 "[ . 1 . 2]" 1
621 1 46 ILE MG 1 107 LEU QD 3.140 . 3.140 2.126 1.835 2.698 . 0 0 "[ . 1 . 2]" 1
622 1 46 ILE MG 1 107 LEU MD2 3.740 . 3.740 2.908 1.840 3.564 . 0 0 "[ . 1 . 2]" 1
623 1 46 ILE MG 1 111 VAL MG2 4.950 . 4.950 4.745 4.584 4.958 0.008 7 0 "[ . 1 . 2]" 1
624 1 47 ARG H 1 47 ARG QG 4.200 . 4.200 2.486 2.069 3.297 . 0 0 "[ . 1 . 2]" 1
625 1 47 ARG H 1 57 GLY H 4.120 . 4.120 3.036 2.691 3.379 . 0 0 "[ . 1 . 2]" 1
626 1 47 ARG HB2 1 48 ASP H 4.110 . 4.110 2.306 2.136 2.773 . 0 0 "[ . 1 . 2]" 1
627 1 47 ARG QG 1 49 SER H 5.080 . 5.080 4.470 3.984 4.971 . 0 0 "[ . 1 . 2]" 1
628 1 47 ARG QG 1 56 TYR HA 4.710 . 4.710 4.598 4.413 4.799 0.089 8 0 "[ . 1 . 2]" 1
629 1 47 ARG QG 1 57 GLY HA3 4.560 . 4.560 3.238 2.607 4.123 . 0 0 "[ . 1 . 2]" 1
630 1 48 ASP H 1 48 ASP HB2 3.950 . 3.950 2.629 2.312 2.871 . 0 0 "[ . 1 . 2]" 1
631 1 48 ASP H 1 48 ASP QB 3.410 . 3.410 2.304 2.157 2.417 . 0 0 "[ . 1 . 2]" 1
632 1 48 ASP H 1 48 ASP HB3 3.950 . 3.950 2.717 2.303 3.610 . 0 0 "[ . 1 . 2]" 1
633 1 48 ASP H 1 49 SER H 5.090 . 5.090 4.530 4.409 4.653 . 0 0 "[ . 1 . 2]" 1
634 1 48 ASP HA 1 49 SER H 3.300 . 3.300 2.259 2.165 2.439 . 0 0 "[ . 1 . 2]" 1
635 1 48 ASP HA 1 56 TYR HA 3.910 . 3.910 2.395 2.072 2.799 . 0 0 "[ . 1 . 2]" 1
636 1 48 ASP HA 1 56 TYR QD 3.580 . 3.580 2.690 2.088 3.093 . 0 0 "[ . 1 . 2]" 1
637 1 48 ASP HA 1 56 TYR QE 4.680 . 4.680 4.363 3.517 4.719 0.039 9 0 "[ . 1 . 2]" 1
638 1 48 ASP HB2 1 49 SER H 4.580 . 4.580 4.198 3.944 4.404 . 0 0 "[ . 1 . 2]" 1
639 1 48 ASP HB3 1 49 SER H 4.580 . 4.580 3.834 2.656 4.274 . 0 0 "[ . 1 . 2]" 1
640 1 49 SER H 1 49 SER QB 3.440 . 3.440 2.395 2.297 2.522 . 0 0 "[ . 1 . 2]" 1
641 1 49 SER H 1 50 HIS H 5.500 . 5.500 4.148 2.594 4.508 . 0 0 "[ . 1 . 2]" 1
642 1 49 SER H 1 55 ALA MB 4.580 . 4.580 3.736 3.286 3.955 . 0 0 "[ . 1 . 2]" 1
643 1 49 SER H 1 56 TYR H 5.500 . 5.500 4.484 4.031 5.081 . 0 0 "[ . 1 . 2]" 1
644 1 49 SER H 1 56 TYR HA 3.630 . 3.630 2.508 2.101 3.087 . 0 0 "[ . 1 . 2]" 1
645 1 49 SER H 1 56 TYR QD 4.590 . 4.590 4.257 3.755 4.617 0.027 17 0 "[ . 1 . 2]" 1
646 1 49 SER H 1 57 GLY H 4.370 . 4.370 3.394 2.903 4.097 . 0 0 "[ . 1 . 2]" 1
647 1 49 SER QB 1 50 HIS H 4.640 . 4.640 3.506 2.754 3.947 . 0 0 "[ . 1 . 2]" 1
648 1 49 SER QB 1 55 ALA H 4.530 . 4.530 3.871 3.402 4.551 0.021 5 0 "[ . 1 . 2]" 1
649 1 49 SER QB 1 55 ALA MB 3.430 . 3.430 2.269 1.908 2.772 . 0 0 "[ . 1 . 2]" 1
650 1 49 SER QB 1 56 TYR HA 4.320 . 4.320 3.466 2.865 4.271 . 0 0 "[ . 1 . 2]" 1
651 1 49 SER QB 1 57 GLY H 4.480 . 4.480 3.465 2.409 4.487 0.007 19 0 "[ . 1 . 2]" 1
652 1 49 SER QB 1 85 LEU MD1 4.640 . 4.640 3.392 2.761 4.634 . 0 0 "[ . 1 . 2]" 1
653 1 49 SER QB 1 85 LEU QD 3.910 . 3.910 3.144 2.418 3.752 . 0 0 "[ . 1 . 2]" 1
654 1 49 SER QB 1 85 LEU MD2 4.640 . 4.640 4.174 2.439 4.710 0.070 14 0 "[ . 1 . 2]" 1
655 1 50 HIS H 1 50 HIS HB2 4.160 . 4.160 2.521 2.266 3.518 . 0 0 "[ . 1 . 2]" 1
656 1 50 HIS H 1 50 HIS QB 3.620 . 3.620 2.451 2.164 3.340 . 0 0 "[ . 1 . 2]" 1
657 1 50 HIS H 1 50 HIS HB3 4.160 . 4.160 3.533 2.506 4.162 0.002 12 0 "[ . 1 . 2]" 1
658 1 50 HIS H 1 51 SER H 3.560 . 3.560 2.873 2.030 3.646 0.086 10 0 "[ . 1 . 2]" 1
659 1 50 HIS HB2 1 51 SER H 4.240 . 4.240 3.629 2.530 4.298 0.058 15 0 "[ . 1 . 2]" 1
660 1 50 HIS HB2 1 51 SER QB 5.390 . 5.390 4.973 4.330 5.531 0.141 4 0 "[ . 1 . 2]" 1
661 1 50 HIS HB3 1 51 SER H 4.240 . 4.240 3.782 2.588 4.252 0.012 13 0 "[ . 1 . 2]" 1
662 1 50 HIS HB3 1 51 SER QB 5.390 . 5.390 5.246 3.935 5.556 0.166 6 0 "[ . 1 . 2]" 1
663 1 51 SER H 1 51 SER QB 3.260 . 3.260 2.483 2.216 2.852 . 0 0 "[ . 1 . 2]" 1
664 1 51 SER H 1 52 PHE H 3.290 . 3.290 2.353 1.723 2.807 . 0 0 "[ . 1 . 2]" 1
665 1 51 SER QB 1 52 PHE H 3.530 . 3.530 2.522 2.124 3.545 0.015 9 0 "[ . 1 . 2]" 1
666 1 51 SER QB 1 52 PHE QD 3.740 . 3.740 2.701 2.454 3.258 . 0 0 "[ . 1 . 2]" 1
667 1 51 SER QB 1 52 PHE QE 4.430 . 4.430 3.343 2.922 4.032 . 0 0 "[ . 1 . 2]" 1
668 1 51 SER QB 1 85 LEU MD1 4.640 . 4.640 3.819 2.278 4.713 0.073 18 0 "[ . 1 . 2]" 1
669 1 51 SER QB 1 85 LEU QD 3.820 . 3.820 3.323 2.255 3.877 0.057 19 0 "[ . 1 . 2]" 1
670 1 51 SER QB 1 85 LEU MD2 4.640 . 4.640 4.133 3.045 4.677 0.037 15 0 "[ . 1 . 2]" 1
671 1 52 PHE H 1 52 PHE HB2 4.100 . 4.100 2.698 2.604 2.825 . 0 0 "[ . 1 . 2]" 1
672 1 52 PHE H 1 52 PHE QB 3.480 . 3.480 2.644 2.556 2.759 . 0 0 "[ . 1 . 2]" 1
673 1 52 PHE H 1 52 PHE HB3 4.100 . 4.100 3.794 3.727 3.868 . 0 0 "[ . 1 . 2]" 1
674 1 52 PHE H 1 52 PHE QD 4.380 . 4.380 3.088 2.960 3.368 . 0 0 "[ . 1 . 2]" 1
675 1 52 PHE H 1 52 PHE QE 4.940 . 4.940 4.968 4.936 5.005 0.065 13 0 "[ . 1 . 2]" 1
676 1 52 PHE H 1 53 GLN H 4.500 . 4.500 4.324 4.213 4.419 . 0 0 "[ . 1 . 2]" 1
677 1 52 PHE H 1 53 GLN HA 5.230 . 5.230 4.652 4.369 4.858 . 0 0 "[ . 1 . 2]" 1
678 1 52 PHE H 1 55 ALA MB 4.070 . 4.070 3.306 2.610 3.841 . 0 0 "[ . 1 . 2]" 1
679 1 52 PHE HA 1 52 PHE QD 3.710 . 3.710 2.818 2.403 3.038 . 0 0 "[ . 1 . 2]" 1
680 1 52 PHE HA 1 53 GLN H 3.000 . 3.000 2.304 2.038 2.696 . 0 0 "[ . 1 . 2]" 1
681 1 52 PHE HA 1 53 GLN QG 4.410 . 4.410 3.795 3.432 4.230 . 0 0 "[ . 1 . 2]" 1
682 1 52 PHE QB 1 53 GLN H 3.420 . 3.420 2.665 2.028 2.988 . 0 0 "[ . 1 . 2]" 1
683 1 52 PHE QB 1 53 GLN QG 4.930 . 4.930 4.306 3.735 4.798 . 0 0 "[ . 1 . 2]" 1
684 1 52 PHE QB 1 85 LEU QD 3.990 . 3.990 3.073 2.470 3.821 . 0 0 "[ . 1 . 2]" 1
685 1 52 PHE HB2 1 53 GLN H 3.940 . 3.940 3.761 3.057 4.010 0.070 2 0 "[ . 1 . 2]" 1
686 1 52 PHE HB2 1 55 ALA MB 3.820 . 3.820 2.214 2.041 2.438 . 0 0 "[ . 1 . 2]" 1
687 1 52 PHE HB3 1 53 GLN H 3.940 . 3.940 2.728 2.058 3.083 . 0 0 "[ . 1 . 2]" 1
688 1 52 PHE HB3 1 55 ALA MB 3.820 . 3.820 3.203 2.785 3.755 . 0 0 "[ . 1 . 2]" 1
689 1 52 PHE QD 1 53 GLN H 4.410 . 4.410 3.896 3.668 4.112 . 0 0 "[ . 1 . 2]" 1
690 1 52 PHE QD 1 53 GLN QG 5.340 . 5.340 5.136 4.639 5.421 0.081 2 0 "[ . 1 . 2]" 1
691 1 52 PHE QD 1 55 ALA MB 4.070 . 4.070 3.326 2.828 3.675 . 0 0 "[ . 1 . 2]" 1
692 1 52 PHE QD 1 85 LEU MD1 4.640 . 4.640 2.482 2.007 4.028 . 0 0 "[ . 1 . 2]" 1
693 1 52 PHE QD 1 85 LEU QD 3.660 . 3.660 2.265 2.002 2.612 . 0 0 "[ . 1 . 2]" 1
694 1 52 PHE QD 1 85 LEU MD2 4.640 . 4.640 3.476 2.174 4.417 . 0 0 "[ . 1 . 2]" 1
695 1 52 PHE QE 1 55 ALA MB 5.210 . 5.210 5.009 4.334 5.270 0.060 2 0 "[ . 1 . 2]" 1
696 1 52 PHE QE 1 85 LEU MD1 4.840 . 4.840 3.155 2.497 4.077 . 0 0 "[ . 1 . 2]" 1
697 1 52 PHE QE 1 85 LEU QD 3.700 . 3.700 2.727 2.023 3.015 . 0 0 "[ . 1 . 2]" 1
698 1 52 PHE QE 1 85 LEU MD2 4.840 . 4.840 3.286 2.138 4.183 . 0 0 "[ . 1 . 2]" 1
699 1 53 GLN H 1 53 GLN QB 2.980 . 2.980 2.623 2.396 3.038 0.058 9 0 "[ . 1 . 2]" 1
700 1 53 GLN H 1 53 GLN QG 3.400 . 3.400 2.257 2.040 2.606 . 0 0 "[ . 1 . 2]" 1
701 1 53 GLN HA 1 53 GLN QG 3.460 . 3.460 2.995 2.369 3.383 . 0 0 "[ . 1 . 2]" 1
702 1 53 GLN HA 1 54 GLY H 3.100 . 3.100 2.144 2.066 2.337 . 0 0 "[ . 1 . 2]" 1
703 1 53 GLN HA 1 54 GLY QA 4.660 . 4.660 3.914 3.843 4.015 . 0 0 "[ . 1 . 2]" 1
704 1 53 GLN HA 1 55 ALA H 3.890 . 3.890 3.417 2.792 3.895 0.005 5 0 "[ . 1 . 2]" 1
705 1 53 GLN QB 1 54 GLY H 4.080 . 4.080 3.074 2.602 3.322 . 0 0 "[ . 1 . 2]" 1
706 1 53 GLN QG 1 54 GLY H 4.540 . 4.540 4.190 3.682 4.578 0.038 19 0 "[ . 1 . 2]" 1
707 1 54 GLY H 1 55 ALA H 3.320 . 3.320 2.278 1.969 2.524 . 0 0 "[ . 1 . 2]" 1
708 1 54 GLY QA 1 88 THR MG 4.790 . 4.790 2.914 2.075 3.889 . 0 0 "[ . 1 . 2]" 1
709 1 55 ALA H 1 55 ALA MB 2.990 . 2.990 2.536 2.416 2.585 . 0 0 "[ . 1 . 2]" 1
710 1 55 ALA H 1 56 TYR H 4.440 . 4.440 4.228 4.072 4.334 . 0 0 "[ . 1 . 2]" 1
711 1 55 ALA H 1 56 TYR QD 5.180 . 5.180 5.098 4.957 5.234 0.054 2 0 "[ . 1 . 2]" 1
712 1 55 ALA HA 1 56 TYR H 3.350 . 3.350 2.165 2.036 2.455 . 0 0 "[ . 1 . 2]" 1
713 1 55 ALA HA 1 88 THR MG 4.000 . 4.000 3.479 2.531 3.936 . 0 0 "[ . 1 . 2]" 1
714 1 55 ALA MB 1 56 TYR HA 4.780 . 4.780 4.138 4.015 4.292 . 0 0 "[ . 1 . 2]" 1
715 1 55 ALA MB 1 56 TYR QD 5.050 . 5.050 4.815 4.622 5.074 0.024 5 0 "[ . 1 . 2]" 1
716 1 55 ALA MB 1 85 LEU MD1 4.140 . 4.140 2.226 1.925 4.185 0.045 18 0 "[ . 1 . 2]" 1
717 1 55 ALA MB 1 85 LEU QD 3.320 . 3.320 2.102 1.918 2.882 . 0 0 "[ . 1 . 2]" 1
718 1 55 ALA MB 1 85 LEU MD2 4.140 . 4.140 3.950 1.921 4.234 0.094 16 0 "[ . 1 . 2]" 1
719 1 55 ALA MB 1 87 GLU HA 3.740 . 3.740 3.031 2.605 3.481 . 0 0 "[ . 1 . 2]" 1
720 1 55 ALA MB 1 87 GLU QB 4.400 . 4.400 3.894 3.278 4.428 0.028 15 0 "[ . 1 . 2]" 1
721 1 55 ALA MB 1 87 GLU HG2 4.750 . 4.750 2.895 2.024 4.018 . 0 0 "[ . 1 . 2]" 1
722 1 55 ALA MB 1 87 GLU HG3 4.750 . 4.750 3.985 3.326 4.782 0.032 9 0 "[ . 1 . 2]" 1
723 1 56 TYR H 1 56 TYR QD 4.330 . 4.330 2.904 2.610 3.185 . 0 0 "[ . 1 . 2]" 1
724 1 56 TYR H 1 86 ILE H 4.120 . 4.120 2.912 2.704 3.244 . 0 0 "[ . 1 . 2]" 1
725 1 56 TYR H 1 86 ILE HB 4.240 . 4.240 2.967 2.663 3.166 . 0 0 "[ . 1 . 2]" 1
726 1 56 TYR H 1 86 ILE MD 4.960 . 4.960 4.661 3.969 4.930 . 0 0 "[ . 1 . 2]" 1
727 1 56 TYR H 1 86 ILE MG 4.420 . 4.420 3.842 3.663 3.994 . 0 0 "[ . 1 . 2]" 1
728 1 56 TYR H 1 88 THR MG 4.700 . 4.700 4.417 3.840 4.727 0.027 17 0 "[ . 1 . 2]" 1
729 1 56 TYR HA 1 56 TYR QD 3.750 . 3.750 2.726 2.518 2.941 . 0 0 "[ . 1 . 2]" 1
730 1 56 TYR HA 1 56 TYR QE 4.720 . 4.720 4.658 4.570 4.734 0.014 4 0 "[ . 1 . 2]" 1
731 1 56 TYR HA 1 57 GLY H 3.560 . 3.560 2.213 2.091 2.481 . 0 0 "[ . 1 . 2]" 1
732 1 56 TYR HA 1 86 ILE MD 5.500 . 5.500 5.265 4.555 5.529 0.029 18 0 "[ . 1 . 2]" 1
733 1 56 TYR HB2 1 57 GLY H 4.510 . 4.510 3.910 3.274 4.178 . 0 0 "[ . 1 . 2]" 1
734 1 56 TYR HB2 1 86 ILE H 4.620 . 4.620 3.316 2.978 3.531 . 0 0 "[ . 1 . 2]" 1
735 1 56 TYR HB2 1 86 ILE HB 4.270 . 4.270 2.022 1.811 2.268 . 0 0 "[ . 1 . 2]" 1
736 1 56 TYR HB2 1 86 ILE MD 4.000 . 4.000 2.863 2.344 3.153 . 0 0 "[ . 1 . 2]" 1
737 1 56 TYR HB2 1 86 ILE MG 4.080 . 4.080 3.377 3.107 3.705 . 0 0 "[ . 1 . 2]" 1
738 1 56 TYR HB2 1 107 LEU QD 4.630 . 4.630 2.979 2.676 3.304 . 0 0 "[ . 1 . 2]" 1
739 1 56 TYR HB3 1 57 GLY H 3.930 . 3.930 3.030 2.338 3.448 . 0 0 "[ . 1 . 2]" 1
740 1 56 TYR HB3 1 86 ILE HB 4.710 . 4.710 3.708 3.458 4.004 . 0 0 "[ . 1 . 2]" 1
741 1 56 TYR HB3 1 86 ILE MD 4.370 . 4.370 3.635 3.183 3.950 . 0 0 "[ . 1 . 2]" 1
742 1 56 TYR HB3 1 86 ILE MG 5.500 . 5.500 4.728 4.440 5.093 . 0 0 "[ . 1 . 2]" 1
743 1 56 TYR QD 1 86 ILE HB 3.990 . 3.990 2.709 2.090 3.214 . 0 0 "[ . 1 . 2]" 1
744 1 56 TYR QD 1 86 ILE MD 4.280 . 4.280 3.895 3.241 4.295 0.015 13 0 "[ . 1 . 2]" 1
745 1 56 TYR QD 1 86 ILE MG 3.510 . 3.510 2.662 2.371 2.972 . 0 0 "[ . 1 . 2]" 1
746 1 56 TYR QD 1 88 THR MG 4.200 . 4.200 3.433 3.030 3.766 . 0 0 "[ . 1 . 2]" 1
747 1 56 TYR QD 1 93 VAL QG 4.180 . 4.180 3.356 2.786 4.180 0.000 8 0 "[ . 1 . 2]" 1
748 1 56 TYR QD 1 107 LEU MD1 4.060 . 4.060 3.104 2.362 3.578 . 0 0 "[ . 1 . 2]" 1
749 1 56 TYR QD 1 107 LEU MD2 4.060 . 4.060 2.583 2.141 3.328 . 0 0 "[ . 1 . 2]" 1
750 1 56 TYR QE 1 86 ILE MG 4.530 . 4.530 3.983 3.410 4.367 . 0 0 "[ . 1 . 2]" 1
751 1 56 TYR QE 1 88 THR HB 4.650 . 4.650 2.946 2.182 3.638 . 0 0 "[ . 1 . 2]" 1
752 1 56 TYR QE 1 88 THR MG 3.250 . 3.250 2.238 1.928 2.820 . 0 0 "[ . 1 . 2]" 1
753 1 56 TYR QE 1 93 VAL QG 3.970 . 3.970 2.983 2.219 3.882 . 0 0 "[ . 1 . 2]" 1
754 1 56 TYR QE 1 107 LEU MD1 3.950 . 3.950 3.399 2.820 3.949 . 0 0 "[ . 1 . 2]" 1
755 1 56 TYR QE 1 107 LEU QD 3.440 . 3.440 2.954 2.696 3.380 . 0 0 "[ . 1 . 2]" 1
756 1 56 TYR QE 1 107 LEU MD2 3.950 . 3.950 3.317 2.914 3.788 . 0 0 "[ . 1 . 2]" 1
757 1 57 GLY H 1 85 LEU QB 5.030 . 5.030 4.597 4.396 5.153 0.123 18 0 "[ . 1 . 2]" 1
758 1 57 GLY HA2 1 58 LEU H 3.550 . 3.550 2.086 2.045 2.160 . 0 0 "[ . 1 . 2]" 1
759 1 57 GLY HA2 1 85 LEU HA 4.200 . 4.200 2.246 1.971 2.432 . 0 0 "[ . 1 . 2]" 1
760 1 57 GLY HA2 1 85 LEU QB 4.270 . 4.270 2.752 2.526 3.493 . 0 0 "[ . 1 . 2]" 1
761 1 57 GLY HA2 1 85 LEU MD1 4.850 . 4.850 4.605 4.190 4.861 0.011 19 0 "[ . 1 . 2]" 1
762 1 57 GLY HA2 1 85 LEU QD 4.100 . 4.100 4.039 3.795 4.136 0.036 13 0 "[ . 1 . 2]" 1
763 1 57 GLY HA2 1 85 LEU MD2 4.850 . 4.850 4.484 4.218 4.617 . 0 0 "[ . 1 . 2]" 1
764 1 57 GLY HA3 1 58 LEU HA 5.130 . 5.130 4.623 4.568 4.685 . 0 0 "[ . 1 . 2]" 1
765 1 57 GLY HA3 1 85 LEU HA 4.140 . 4.140 3.948 3.623 4.171 0.031 14 0 "[ . 1 . 2]" 1
766 1 57 GLY HA3 1 85 LEU QB 4.690 . 4.690 3.763 3.474 4.728 0.038 18 0 "[ . 1 . 2]" 1
767 1 57 GLY HA3 1 85 LEU MD1 5.500 . 5.500 5.374 4.906 5.595 0.095 5 0 "[ . 1 . 2]" 1
768 1 57 GLY HA3 1 85 LEU QD 4.650 . 4.650 4.692 4.347 4.765 0.115 17 0 "[ . 1 . 2]" 1
769 1 57 GLY HA3 1 85 LEU MD2 5.500 . 5.500 5.201 4.854 5.510 0.010 8 0 "[ . 1 . 2]" 1
770 1 58 LEU H 1 58 LEU HB2 4.110 . 4.110 2.826 2.699 2.893 . 0 0 "[ . 1 . 2]" 1
771 1 58 LEU H 1 58 LEU HB3 3.920 . 3.920 2.335 2.266 2.510 . 0 0 "[ . 1 . 2]" 1
772 1 58 LEU H 1 58 LEU QD 4.580 . 4.580 3.735 3.626 3.831 . 0 0 "[ . 1 . 2]" 1
773 1 58 LEU H 1 58 LEU HG 5.290 . 5.290 4.471 4.234 4.757 . 0 0 "[ . 1 . 2]" 1
774 1 58 LEU H 1 84 PHE H 4.150 . 4.150 3.304 3.069 3.414 . 0 0 "[ . 1 . 2]" 1
775 1 58 LEU H 1 84 PHE HB2 4.550 . 4.550 4.063 3.892 4.283 . 0 0 "[ . 1 . 2]" 1
776 1 58 LEU H 1 85 LEU H 4.690 . 4.690 4.573 4.267 4.708 0.018 18 0 "[ . 1 . 2]" 1
777 1 58 LEU H 1 85 LEU HA 3.920 . 3.920 2.477 2.161 2.791 . 0 0 "[ . 1 . 2]" 1
778 1 58 LEU H 1 85 LEU QB 5.340 . 5.340 3.883 3.515 4.602 . 0 0 "[ . 1 . 2]" 1
779 1 58 LEU H 1 85 LEU QD 5.200 . 5.200 4.810 4.463 5.103 . 0 0 "[ . 1 . 2]" 1
780 1 58 LEU H 1 86 ILE H 4.510 . 4.510 3.714 3.448 4.068 . 0 0 "[ . 1 . 2]" 1
781 1 58 LEU H 1 86 ILE MD 4.410 . 4.410 4.107 2.800 4.438 0.028 2 0 "[ . 1 . 2]" 1
782 1 58 LEU H 1 86 ILE QG 5.500 . 5.500 3.710 3.224 5.186 . 0 0 "[ . 1 . 2]" 1
783 1 58 LEU HA 1 58 LEU MD1 4.520 . 4.520 2.804 2.229 3.434 . 0 0 "[ . 1 . 2]" 1
784 1 58 LEU HA 1 58 LEU QD 3.410 . 3.410 2.239 2.113 2.318 . 0 0 "[ . 1 . 2]" 1
785 1 58 LEU HA 1 58 LEU MD2 4.520 . 4.520 3.095 2.147 3.969 . 0 0 "[ . 1 . 2]" 1
786 1 58 LEU HA 1 58 LEU HG 4.150 . 4.150 3.520 3.094 3.898 . 0 0 "[ . 1 . 2]" 1
787 1 58 LEU HA 1 59 ALA MB 4.720 . 4.720 3.996 3.954 4.035 . 0 0 "[ . 1 . 2]" 1
788 1 58 LEU HA 1 86 ILE MD 4.690 . 4.690 4.079 3.540 4.422 . 0 0 "[ . 1 . 2]" 1
789 1 58 LEU HB2 1 58 LEU MD1 3.640 . 3.640 2.786 2.332 3.235 . 0 0 "[ . 1 . 2]" 1
790 1 58 LEU HB2 1 58 LEU MD2 3.640 . 3.640 2.490 2.437 2.549 . 0 0 "[ . 1 . 2]" 1
791 1 58 LEU HB2 1 84 PHE HB2 5.100 . 5.100 4.237 3.780 4.506 . 0 0 "[ . 1 . 2]" 1
792 1 58 LEU HB2 1 86 ILE MD 3.770 . 3.770 2.389 1.988 2.661 . 0 0 "[ . 1 . 2]" 1
793 1 58 LEU HB3 1 84 PHE HB2 4.760 . 4.760 2.599 2.154 2.872 . 0 0 "[ . 1 . 2]" 1
794 1 58 LEU HB3 1 84 PHE QD 4.990 . 4.990 4.022 3.501 4.403 . 0 0 "[ . 1 . 2]" 1
795 1 58 LEU HB3 1 85 LEU HA 5.140 . 5.140 3.805 3.431 4.229 . 0 0 "[ . 1 . 2]" 1
796 1 58 LEU HB3 1 86 ILE MD 4.050 . 4.050 3.471 2.576 3.857 . 0 0 "[ . 1 . 2]" 1
797 1 58 LEU QD 1 59 ALA H 3.610 . 3.610 2.432 2.113 2.635 . 0 0 "[ . 1 . 2]" 1
798 1 58 LEU QD 1 59 ALA HA 4.460 . 4.460 3.594 2.886 4.251 . 0 0 "[ . 1 . 2]" 1
799 1 58 LEU QD 1 60 LEU HA 4.930 . 4.930 3.626 3.219 4.018 . 0 0 "[ . 1 . 2]" 1
800 1 58 LEU QD 1 60 LEU QB 3.460 . 3.460 2.510 2.030 3.074 . 0 0 "[ . 1 . 2]" 1
801 1 58 LEU QD 1 60 LEU QD 4.000 . 4.000 2.949 2.570 3.193 . 0 0 "[ . 1 . 2]" 1
802 1 58 LEU QD 1 84 PHE H 4.420 . 4.420 3.627 3.020 4.197 . 0 0 "[ . 1 . 2]" 1
803 1 58 LEU QD 1 84 PHE HA 5.280 . 5.280 5.000 4.613 5.292 0.012 11 0 "[ . 1 . 2]" 1
804 1 58 LEU QD 1 84 PHE HB2 3.710 . 3.710 2.496 2.131 2.724 . 0 0 "[ . 1 . 2]" 1
805 1 58 LEU QD 1 84 PHE HB3 3.870 . 3.870 3.833 3.637 3.897 0.027 18 0 "[ . 1 . 2]" 1
806 1 58 LEU QD 1 84 PHE QD 3.210 . 3.210 2.678 1.991 3.251 0.041 5 0 "[ . 1 . 2]" 1
807 1 58 LEU QD 1 95 ILE MD 3.820 . 3.820 3.107 2.329 3.844 0.024 12 0 "[ . 1 . 2]" 1
808 1 58 LEU QD 1 95 ILE MG 4.090 . 4.090 3.633 2.839 4.103 0.013 6 0 "[ . 1 . 2]" 1
809 1 58 LEU QD 1 110 LEU QD 4.280 . 4.280 3.347 2.732 3.972 . 0 0 "[ . 1 . 2]" 1
810 1 58 LEU QD 1 111 VAL MG2 4.350 . 4.350 3.747 3.400 4.256 . 0 0 "[ . 1 . 2]" 1
811 1 58 LEU QD 1 121 LEU QD 2.950 . 2.950 2.043 1.752 2.284 . 0 0 "[ . 1 . 2]" 1
812 1 58 LEU QD 1 125 LEU QD 2.930 . 2.930 2.323 1.825 2.958 0.028 8 0 "[ . 1 . 2]" 1
813 1 58 LEU MD1 1 59 ALA H 4.690 . 4.690 2.812 2.195 3.385 . 0 0 "[ . 1 . 2]" 1
814 1 58 LEU MD1 1 59 ALA HA 5.230 . 5.230 3.763 2.940 4.535 . 0 0 "[ . 1 . 2]" 1
815 1 58 LEU MD1 1 84 PHE HB2 5.070 . 5.070 3.656 2.133 5.078 0.008 5 0 "[ . 1 . 2]" 1
816 1 58 LEU MD1 1 121 LEU MD1 4.500 . 4.500 3.241 1.970 4.525 0.025 15 0 "[ . 1 . 2]" 1
817 1 58 LEU MD1 1 121 LEU MD2 4.500 . 4.500 3.411 2.067 4.388 . 0 0 "[ . 1 . 2]" 1
818 1 58 LEU MD1 1 125 LEU MD1 4.420 . 4.420 3.238 2.024 4.321 . 0 0 "[ . 1 . 2]" 1
819 1 58 LEU MD1 1 125 LEU MD2 4.420 . 4.420 3.345 2.432 4.453 0.033 20 0 "[ . 1 . 2]" 1
820 1 58 LEU MD2 1 59 ALA H 4.690 . 4.690 3.532 2.153 4.686 . 0 0 "[ . 1 . 2]" 1
821 1 58 LEU MD2 1 59 ALA HA 5.230 . 5.230 4.674 4.057 5.240 0.010 8 0 "[ . 1 . 2]" 1
822 1 58 LEU MD2 1 84 PHE HB2 5.070 . 5.070 3.711 2.577 4.944 . 0 0 "[ . 1 . 2]" 1
823 1 58 LEU MD2 1 121 LEU MD1 4.500 . 4.500 2.972 1.960 3.859 . 0 0 "[ . 1 . 2]" 1
824 1 58 LEU MD2 1 121 LEU MD2 4.500 . 4.500 3.091 1.931 4.502 0.002 6 0 "[ . 1 . 2]" 1
825 1 58 LEU MD2 1 125 LEU MD1 4.420 . 4.420 2.905 2.136 3.666 . 0 0 "[ . 1 . 2]" 1
826 1 58 LEU MD2 1 125 LEU MD2 4.420 . 4.420 2.949 2.144 4.050 . 0 0 "[ . 1 . 2]" 1
827 1 58 LEU HG 1 59 ALA H 4.990 . 4.990 4.071 2.963 5.038 0.048 20 0 "[ . 1 . 2]" 1
828 1 58 LEU HG 1 84 PHE HB2 4.770 . 4.770 3.889 3.583 4.133 . 0 0 "[ . 1 . 2]" 1
829 1 59 ALA H 1 59 ALA MB 3.550 . 3.550 2.395 2.345 2.460 . 0 0 "[ . 1 . 2]" 1
830 1 59 ALA HA 1 60 LEU H 3.280 . 3.280 2.109 2.058 2.152 . 0 0 "[ . 1 . 2]" 1
831 1 59 ALA HA 1 81 VAL QG 4.450 . 4.450 3.357 3.103 3.680 . 0 0 "[ . 1 . 2]" 1
832 1 59 ALA HA 1 83 HIS HA 3.670 . 3.670 2.556 2.390 2.816 . 0 0 "[ . 1 . 2]" 1
833 1 59 ALA HA 1 84 PHE H 4.210 . 4.210 3.588 3.421 3.878 . 0 0 "[ . 1 . 2]" 1
834 1 59 ALA MB 1 60 LEU H 3.810 . 3.810 3.135 3.025 3.293 . 0 0 "[ . 1 . 2]" 1
835 1 59 ALA MB 1 60 LEU HA 4.640 . 4.640 4.177 4.084 4.256 . 0 0 "[ . 1 . 2]" 1
836 1 59 ALA MB 1 81 VAL HB 5.500 . 5.500 4.740 4.447 5.327 . 0 0 "[ . 1 . 2]" 1
837 1 59 ALA MB 1 81 VAL QG 3.100 . 3.100 2.270 2.083 2.739 . 0 0 "[ . 1 . 2]" 1
838 1 59 ALA MB 1 83 HIS HA 4.510 . 4.510 3.743 3.420 4.044 . 0 0 "[ . 1 . 2]" 1
839 1 59 ALA MB 1 83 HIS HE1 4.220 . 4.220 3.727 2.534 4.255 0.035 12 0 "[ . 1 . 2]" 1
840 1 60 LEU H 1 60 LEU HB2 3.660 . 3.660 3.045 2.748 3.218 . 0 0 "[ . 1 . 2]" 1
841 1 60 LEU H 1 60 LEU HB3 3.660 . 3.660 2.533 2.416 2.756 . 0 0 "[ . 1 . 2]" 1
842 1 60 LEU H 1 60 LEU MD1 5.100 . 5.100 4.350 4.071 4.463 . 0 0 "[ . 1 . 2]" 1
843 1 60 LEU H 1 60 LEU QD 4.400 . 4.400 3.885 3.731 3.971 . 0 0 "[ . 1 . 2]" 1
844 1 60 LEU H 1 60 LEU MD2 5.100 . 5.100 4.377 4.291 4.501 . 0 0 "[ . 1 . 2]" 1
845 1 60 LEU H 1 61 LYS H 4.440 . 4.440 4.313 4.220 4.401 . 0 0 "[ . 1 . 2]" 1
846 1 60 LEU H 1 81 VAL QG 3.920 . 3.920 3.092 2.824 3.255 . 0 0 "[ . 1 . 2]" 1
847 1 60 LEU H 1 82 ARG H 3.910 . 3.910 3.015 2.808 3.164 . 0 0 "[ . 1 . 2]" 1
848 1 60 LEU H 1 82 ARG QB 5.340 . 5.340 3.276 2.963 3.702 . 0 0 "[ . 1 . 2]" 1
849 1 60 LEU H 1 82 ARG QG 5.340 . 5.340 4.721 4.241 5.276 . 0 0 "[ . 1 . 2]" 1
850 1 60 LEU H 1 83 HIS HA 4.500 . 4.500 3.587 3.350 3.767 . 0 0 "[ . 1 . 2]" 1
851 1 60 LEU H 1 84 PHE QD 4.710 . 4.710 4.210 3.868 4.611 . 0 0 "[ . 1 . 2]" 1
852 1 60 LEU HA 1 60 LEU MD1 4.730 . 4.730 2.458 2.181 3.899 . 0 0 "[ . 1 . 2]" 1
853 1 60 LEU HA 1 60 LEU QD 3.400 . 3.400 2.216 2.086 2.524 . 0 0 "[ . 1 . 2]" 1
854 1 60 LEU HA 1 60 LEU MD2 4.730 . 4.730 3.591 2.115 3.944 . 0 0 "[ . 1 . 2]" 1
855 1 60 LEU QB 1 61 LYS H 4.450 . 4.450 3.757 3.705 3.818 . 0 0 "[ . 1 . 2]" 1
856 1 60 LEU QB 1 62 VAL MG1 4.470 . 4.470 3.334 2.947 3.763 . 0 0 "[ . 1 . 2]" 1
857 1 60 LEU QB 1 81 VAL QG 5.280 . 5.280 4.377 4.137 4.516 . 0 0 "[ . 1 . 2]" 1
858 1 60 LEU QB 1 84 PHE QD 3.790 . 3.790 3.334 2.838 3.607 . 0 0 "[ . 1 . 2]" 1
859 1 60 LEU QB 1 121 LEU QD 3.910 . 3.910 2.854 2.512 3.179 . 0 0 "[ . 1 . 2]" 1
860 1 60 LEU HB2 1 84 PHE QD 4.340 . 4.340 3.915 3.209 4.352 0.012 10 0 "[ . 1 . 2]" 1
861 1 60 LEU HB3 1 84 PHE QD 4.340 . 4.340 3.628 3.164 4.192 . 0 0 "[ . 1 . 2]" 1
862 1 60 LEU QD 1 61 LYS H 3.740 . 3.740 2.356 2.165 2.538 . 0 0 "[ . 1 . 2]" 1
863 1 60 LEU QD 1 62 VAL MG1 3.480 . 3.480 2.236 1.835 2.589 . 0 0 "[ . 1 . 2]" 1
864 1 60 LEU QD 1 82 ARG QD 4.880 . 4.880 4.764 3.965 4.947 0.067 13 0 "[ . 1 . 2]" 1
865 1 60 LEU QD 1 84 PHE QE 4.040 . 4.040 3.197 2.250 4.044 0.004 16 0 "[ . 1 . 2]" 1
866 1 60 LEU QD 1 121 LEU HA 4.890 . 4.890 3.519 2.978 4.718 . 0 0 "[ . 1 . 2]" 1
867 1 60 LEU QD 1 121 LEU QB 3.360 . 3.360 2.336 2.011 3.326 . 0 0 "[ . 1 . 2]" 1
868 1 60 LEU QD 1 121 LEU QD 3.170 . 3.170 2.022 1.749 2.896 . 0 0 "[ . 1 . 2]" 1
869 1 60 LEU QD 1 122 PRO QB 4.570 . 4.570 4.364 3.857 4.600 0.030 15 0 "[ . 1 . 2]" 1
870 1 60 LEU QD 1 122 PRO QD 4.150 . 4.150 2.364 2.088 3.005 . 0 0 "[ . 1 . 2]" 1
871 1 60 LEU QD 1 122 PRO QG 3.850 . 3.850 2.933 2.350 3.264 . 0 0 "[ . 1 . 2]" 1
872 1 60 LEU QD 1 123 CYS H 3.300 . 3.300 2.773 2.414 3.185 . 0 0 "[ . 1 . 2]" 1
873 1 60 LEU QD 1 123 CYS QB 4.660 . 4.660 2.418 1.840 3.767 . 0 0 "[ . 1 . 2]" 1
874 1 60 LEU QD 1 125 LEU HA 3.950 . 3.950 2.952 2.592 3.340 . 0 0 "[ . 1 . 2]" 1
875 1 60 LEU QD 1 125 LEU QD 2.830 . 2.830 1.973 1.860 2.299 . 0 0 "[ . 1 . 2]" 1
876 1 60 LEU QD 1 126 ARG H 4.720 . 4.720 3.754 3.434 4.206 . 0 0 "[ . 1 . 2]" 1
877 1 60 LEU MD1 1 125 LEU HA 5.470 . 5.470 3.301 2.633 4.839 . 0 0 "[ . 1 . 2]" 1
878 1 60 LEU MD2 1 125 LEU HA 5.470 . 5.470 4.027 2.856 4.991 . 0 0 "[ . 1 . 2]" 1
879 1 60 LEU HG 1 61 LYS H 4.760 . 4.760 3.465 3.032 4.801 0.041 16 0 "[ . 1 . 2]" 1
880 1 60 LEU HG 1 62 VAL MG1 4.170 . 4.170 2.679 2.142 4.264 0.094 17 0 "[ . 1 . 2]" 1
881 1 60 LEU HG 1 121 LEU QB 5.230 . 5.230 4.513 2.398 5.259 0.029 11 0 "[ . 1 . 2]" 1
882 1 60 LEU HG 1 123 CYS H 5.500 . 5.500 4.949 3.790 5.515 0.015 7 0 "[ . 1 . 2]" 1
883 1 60 LEU HG 1 125 LEU QD 4.700 . 4.700 4.127 2.173 4.706 0.006 20 0 "[ . 1 . 2]" 1
884 1 61 LYS H 1 61 LYS HB2 4.120 . 4.120 2.636 2.175 2.952 . 0 0 "[ . 1 . 2]" 1
885 1 61 LYS H 1 61 LYS QB 3.520 . 3.520 2.249 2.152 2.306 . 0 0 "[ . 1 . 2]" 1
886 1 61 LYS H 1 61 LYS HB3 4.120 . 4.120 2.544 2.310 3.414 . 0 0 "[ . 1 . 2]" 1
887 1 61 LYS H 1 81 VAL MG1 4.660 . 4.660 4.335 4.185 4.464 . 0 0 "[ . 1 . 2]" 1
888 1 61 LYS H 1 81 VAL QG 3.960 . 3.960 3.972 3.852 4.031 0.071 4 0 "[ . 1 . 2]" 1
889 1 61 LYS H 1 81 VAL MG2 4.660 . 4.660 4.619 4.378 4.682 0.022 20 0 "[ . 1 . 2]" 1
890 1 61 LYS HA 1 61 LYS HD2 4.600 . 4.600 2.567 2.031 3.795 . 0 0 "[ . 1 . 2]" 1
891 1 61 LYS HA 1 61 LYS HD3 4.600 . 4.600 2.911 2.410 3.452 . 0 0 "[ . 1 . 2]" 1
892 1 61 LYS HA 1 62 VAL MG2 4.700 . 4.700 3.918 3.745 4.071 . 0 0 "[ . 1 . 2]" 1
893 1 61 LYS HA 1 80 LEU HB2 5.500 . 5.500 5.000 4.550 5.320 . 0 0 "[ . 1 . 2]" 1
894 1 61 LYS HA 1 81 VAL MG1 4.670 . 4.670 3.474 3.234 3.690 . 0 0 "[ . 1 . 2]" 1
895 1 61 LYS HA 1 81 VAL QG 3.910 . 3.910 2.691 2.475 2.943 . 0 0 "[ . 1 . 2]" 1
896 1 61 LYS HA 1 81 VAL MG2 4.670 . 4.670 2.805 2.556 3.098 . 0 0 "[ . 1 . 2]" 1
897 1 61 LYS HA 1 82 ARG H 4.630 . 4.630 3.480 3.231 3.691 . 0 0 "[ . 1 . 2]" 1
898 1 61 LYS QB 1 62 VAL H 4.280 . 4.280 3.835 3.475 3.914 . 0 0 "[ . 1 . 2]" 1
899 1 61 LYS QB 1 62 VAL MG1 5.220 . 5.220 4.806 4.629 4.963 . 0 0 "[ . 1 . 2]" 1
900 1 61 LYS QB 1 81 VAL QG 3.610 . 3.610 3.023 2.405 3.690 0.080 10 0 "[ . 1 . 2]" 1
901 1 61 LYS QD 1 62 VAL H 4.210 . 4.210 2.590 2.269 2.905 . 0 0 "[ . 1 . 2]" 1
902 1 61 LYS QD 1 62 VAL MG1 4.730 . 4.730 4.658 4.386 4.821 0.091 10 0 "[ . 1 . 2]" 1
903 1 61 LYS QD 1 77 VAL QG 5.250 . 5.250 3.507 2.565 4.729 . 0 0 "[ . 1 . 2]" 1
904 1 61 LYS QD 1 80 LEU QD 5.040 . 5.040 3.862 3.339 4.241 . 0 0 "[ . 1 . 2]" 1
905 1 61 LYS QD 1 81 VAL QG 3.250 . 3.250 2.488 1.973 3.350 0.100 6 0 "[ . 1 . 2]" 1
906 1 61 LYS QE 1 77 VAL QG 3.680 . 3.680 2.517 2.107 3.431 . 0 0 "[ . 1 . 2]" 1
907 1 61 LYS QE 1 80 LEU HB2 3.870 . 3.870 2.685 2.177 3.306 . 0 0 "[ . 1 . 2]" 1
908 1 61 LYS QE 1 80 LEU HB3 3.580 . 3.580 2.854 2.429 3.324 . 0 0 "[ . 1 . 2]" 1
909 1 61 LYS QE 1 80 LEU QD 3.740 . 3.740 2.883 2.208 3.760 0.020 2 0 "[ . 1 . 2]" 1
910 1 61 LYS QE 1 81 VAL QG 3.800 . 3.800 3.322 2.944 3.696 . 0 0 "[ . 1 . 2]" 1
911 1 61 LYS HE2 1 80 LEU HB3 4.190 . 4.190 3.215 2.600 3.900 . 0 0 "[ . 1 . 2]" 1
912 1 61 LYS HE3 1 80 LEU HB3 4.190 . 4.190 3.429 2.589 4.235 0.045 18 0 "[ . 1 . 2]" 1
913 1 61 LYS QG 1 62 VAL H 4.520 . 4.520 3.655 3.405 4.215 . 0 0 "[ . 1 . 2]" 1
914 1 62 VAL H 1 62 VAL HB 4.010 . 4.010 3.749 3.710 3.782 . 0 0 "[ . 1 . 2]" 1
915 1 62 VAL H 1 62 VAL MG1 3.930 . 3.930 2.612 2.437 2.760 . 0 0 "[ . 1 . 2]" 1
916 1 62 VAL H 1 62 VAL MG2 3.500 . 3.500 2.146 2.084 2.232 . 0 0 "[ . 1 . 2]" 1
917 1 62 VAL H 1 80 LEU QD 4.960 . 4.960 4.515 4.201 4.764 . 0 0 "[ . 1 . 2]" 1
918 1 62 VAL H 1 81 VAL HA 4.540 . 4.540 3.162 2.766 3.319 . 0 0 "[ . 1 . 2]" 1
919 1 62 VAL H 1 82 ARG H 4.830 . 4.830 3.779 3.604 3.966 . 0 0 "[ . 1 . 2]" 1
920 1 62 VAL HA 1 62 VAL MG1 3.330 . 3.330 2.420 2.371 2.461 . 0 0 "[ . 1 . 2]" 1
921 1 62 VAL HA 1 63 ALA H 3.490 . 3.490 2.466 2.331 2.549 . 0 0 "[ . 1 . 2]" 1
922 1 62 VAL HA 1 63 ALA MB 4.230 . 4.230 4.152 4.073 4.228 . 0 0 "[ . 1 . 2]" 1
923 1 62 VAL HA 1 64 THR H 4.740 . 4.740 4.630 4.135 4.781 0.041 3 0 "[ . 1 . 2]" 1
924 1 62 VAL HB 1 63 ALA H 3.410 . 3.410 2.318 2.171 2.546 . 0 0 "[ . 1 . 2]" 1
925 1 62 VAL HB 1 63 ALA MB 4.360 . 4.360 3.954 3.767 4.091 . 0 0 "[ . 1 . 2]" 1
926 1 62 VAL HB 1 64 THR H 4.030 . 4.030 3.160 2.688 3.398 . 0 0 "[ . 1 . 2]" 1
927 1 62 VAL HB 1 80 LEU QD 5.300 . 5.300 5.043 4.382 5.324 0.024 20 0 "[ . 1 . 2]" 1
928 1 62 VAL MG1 1 63 ALA H 3.960 . 3.960 3.710 3.574 3.817 . 0 0 "[ . 1 . 2]" 1
929 1 62 VAL MG1 1 82 ARG H 4.500 . 4.500 3.542 3.157 3.924 . 0 0 "[ . 1 . 2]" 1
930 1 62 VAL MG1 1 82 ARG QB 4.440 . 4.440 3.162 2.560 3.675 . 0 0 "[ . 1 . 2]" 1
931 1 62 VAL MG1 1 82 ARG QD 4.080 . 4.080 3.418 2.582 4.018 . 0 0 "[ . 1 . 2]" 1
932 1 62 VAL MG1 1 82 ARG QG 3.610 . 3.610 2.232 1.955 3.145 . 0 0 "[ . 1 . 2]" 1
933 1 62 VAL MG1 1 122 PRO HA 5.500 . 5.500 5.242 4.934 5.457 . 0 0 "[ . 1 . 2]" 1
934 1 62 VAL MG1 1 122 PRO QB 3.590 . 3.590 3.392 2.722 3.618 0.028 1 0 "[ . 1 . 2]" 1
935 1 62 VAL MG1 1 122 PRO QD 3.750 . 3.750 3.196 2.684 3.760 0.010 16 0 "[ . 1 . 2]" 1
936 1 62 VAL MG1 1 122 PRO HG2 3.780 . 3.780 2.082 1.934 2.379 . 0 0 "[ . 1 . 2]" 1
937 1 62 VAL MG1 1 122 PRO HG3 3.780 . 3.780 2.884 2.571 3.448 . 0 0 "[ . 1 . 2]" 1
938 1 62 VAL MG1 1 123 CYS H 3.720 . 3.720 3.572 3.296 3.747 0.027 2 0 "[ . 1 . 2]" 1
939 1 62 VAL MG1 1 123 CYS QB 3.900 . 3.900 2.606 1.892 3.661 . 0 0 "[ . 1 . 2]" 1
940 1 62 VAL MG2 1 63 ALA H 3.940 . 3.940 3.193 3.028 3.466 . 0 0 "[ . 1 . 2]" 1
941 1 62 VAL MG2 1 63 ALA HA 4.720 . 4.720 4.145 4.012 4.350 . 0 0 "[ . 1 . 2]" 1
942 1 62 VAL MG2 1 64 THR H 3.820 . 3.820 2.852 2.606 3.124 . 0 0 "[ . 1 . 2]" 1
943 1 62 VAL MG2 1 64 THR HA 4.510 . 4.510 2.961 2.675 3.178 . 0 0 "[ . 1 . 2]" 1
944 1 62 VAL MG2 1 64 THR HB 5.350 . 5.350 4.815 4.621 5.129 . 0 0 "[ . 1 . 2]" 1
945 1 62 VAL MG2 1 64 THR MG 5.500 . 5.500 4.385 4.182 4.525 . 0 0 "[ . 1 . 2]" 1
946 1 62 VAL MG2 1 65 PRO HD3 4.370 . 4.370 2.677 2.125 3.044 . 0 0 "[ . 1 . 2]" 1
947 1 62 VAL MG2 1 65 PRO QG 4.710 . 4.710 2.799 2.111 3.534 . 0 0 "[ . 1 . 2]" 1
948 1 62 VAL MG2 1 80 LEU HA 3.800 . 3.800 2.717 2.292 3.278 . 0 0 "[ . 1 . 2]" 1
949 1 62 VAL MG2 1 81 VAL HA 4.610 . 4.610 3.850 3.193 4.115 . 0 0 "[ . 1 . 2]" 1
950 1 62 VAL MG2 1 82 ARG QB 4.940 . 4.940 4.062 3.645 4.407 . 0 0 "[ . 1 . 2]" 1
951 1 62 VAL MG2 1 82 ARG QD 3.820 . 3.820 2.947 2.117 3.844 0.024 8 0 "[ . 1 . 2]" 1
952 1 62 VAL MG2 1 82 ARG QG 3.680 . 3.680 2.417 2.111 3.135 . 0 0 "[ . 1 . 2]" 1
953 1 62 VAL MG2 1 122 PRO QB 4.660 . 4.660 4.387 3.760 4.674 0.014 4 0 "[ . 1 . 2]" 1
954 1 62 VAL MG2 1 122 PRO QG 4.020 . 4.020 3.518 3.078 4.029 0.009 20 0 "[ . 1 . 2]" 1
955 1 63 ALA H 1 63 ALA MB 3.210 . 3.210 2.247 2.211 2.271 . 0 0 "[ . 1 . 2]" 1
956 1 63 ALA H 1 64 THR H 3.490 . 3.490 2.554 2.331 2.732 . 0 0 "[ . 1 . 2]" 1
957 1 63 ALA H 1 64 THR MG 5.500 . 5.500 5.277 5.018 5.507 0.007 20 0 "[ . 1 . 2]" 1
958 1 63 ALA HA 1 80 LEU HB3 5.080 . 5.080 4.565 4.142 4.850 . 0 0 "[ . 1 . 2]" 1
959 1 63 ALA MB 1 64 THR H 3.290 . 3.290 2.207 2.046 2.499 . 0 0 "[ . 1 . 2]" 1
960 1 63 ALA MB 1 64 THR HA 4.480 . 4.480 4.239 4.132 4.346 . 0 0 "[ . 1 . 2]" 1
961 1 63 ALA MB 1 64 THR HB 5.030 . 5.030 4.711 4.352 4.865 . 0 0 "[ . 1 . 2]" 1
962 1 63 ALA MB 1 64 THR MG 3.660 . 3.660 3.458 3.051 3.746 0.086 20 0 "[ . 1 . 2]" 1
963 1 64 THR H 1 64 THR HB 3.960 . 3.960 3.769 3.592 3.840 . 0 0 "[ . 1 . 2]" 1
964 1 64 THR H 1 64 THR MG 3.850 . 3.850 3.571 3.373 3.760 . 0 0 "[ . 1 . 2]" 1
965 1 64 THR H 1 65 PRO HD3 4.570 . 4.570 4.209 3.839 4.383 . 0 0 "[ . 1 . 2]" 1
966 1 64 THR H 1 80 LEU HB3 5.500 . 5.500 5.409 4.910 5.551 0.051 15 0 "[ . 1 . 2]" 1
967 1 64 THR H 1 80 LEU QD 4.020 . 4.020 3.936 3.559 4.065 0.045 19 0 "[ . 1 . 2]" 1
968 1 64 THR HA 1 64 THR MG 3.130 . 3.130 2.281 2.135 2.361 . 0 0 "[ . 1 . 2]" 1
969 1 64 THR HA 1 65 PRO HG2 4.560 . 4.560 4.536 4.473 4.571 0.011 19 0 "[ . 1 . 2]" 1
970 1 64 THR HA 1 65 PRO QG 3.980 . 3.980 3.896 3.839 3.956 . 0 0 "[ . 1 . 2]" 1
971 1 64 THR HA 1 65 PRO HG3 4.560 . 4.560 4.246 4.129 4.356 . 0 0 "[ . 1 . 2]" 1
972 1 64 THR HA 1 80 LEU MD1 4.680 . 4.680 3.637 1.901 4.337 . 0 0 "[ . 1 . 2]" 1
973 1 64 THR HA 1 80 LEU QD 3.430 . 3.430 2.011 1.899 2.239 . 0 0 "[ . 1 . 2]" 1
974 1 64 THR HA 1 80 LEU MD2 4.680 . 4.680 2.512 1.962 4.601 . 0 0 "[ . 1 . 2]" 1
975 1 64 THR HB 1 65 PRO QG 5.350 . 5.350 4.950 4.713 5.273 . 0 0 "[ . 1 . 2]" 1
976 1 64 THR HB 1 66 PRO QD 3.480 . 3.480 2.376 2.062 3.273 . 0 0 "[ . 1 . 2]" 1
977 1 64 THR HB 1 69 ALA MB 4.460 . 4.460 2.806 2.266 3.501 . 0 0 "[ . 1 . 2]" 1
978 1 64 THR HB 1 80 LEU QD 4.370 . 4.370 3.828 3.582 4.151 . 0 0 "[ . 1 . 2]" 1
979 1 64 THR MG 1 65 PRO HD3 4.370 . 4.370 3.657 3.131 3.972 . 0 0 "[ . 1 . 2]" 1
980 1 64 THR MG 1 65 PRO QG 5.180 . 5.180 4.825 4.126 5.078 . 0 0 "[ . 1 . 2]" 1
981 1 64 THR MG 1 66 PRO HB2 5.500 . 5.500 4.924 4.051 5.428 . 0 0 "[ . 1 . 2]" 1
982 1 64 THR MG 1 66 PRO QD 3.440 . 3.440 3.299 2.790 3.463 0.023 19 0 "[ . 1 . 2]" 1
983 1 64 THR MG 1 80 LEU HB3 5.340 . 5.340 4.851 4.388 5.355 0.015 6 0 "[ . 1 . 2]" 1
984 1 64 THR MG 1 80 LEU MD1 4.300 . 4.300 3.284 2.324 3.832 . 0 0 "[ . 1 . 2]" 1
985 1 64 THR MG 1 80 LEU QD 3.590 . 3.590 2.357 2.000 2.585 . 0 0 "[ . 1 . 2]" 1
986 1 64 THR MG 1 80 LEU MD2 4.300 . 4.300 2.701 2.020 4.121 . 0 0 "[ . 1 . 2]" 1
987 1 64 THR MG 1 80 LEU HG 5.030 . 5.030 4.624 3.868 5.076 0.046 14 0 "[ . 1 . 2]" 1
988 1 65 PRO QB 1 80 LEU QD 4.550 . 4.550 4.468 4.251 4.608 0.058 4 0 "[ . 1 . 2]" 1
989 1 65 PRO HD2 1 66 PRO HB3 5.010 . 5.010 5.129 4.900 5.320 0.310 10 0 "[ . 1 . 2]" 1
990 1 65 PRO HD2 1 66 PRO QG 3.240 . 3.240 3.284 2.671 3.389 0.149 2 0 "[ . 1 . 2]" 1
991 1 65 PRO HD2 1 69 ALA MB 4.570 . 4.570 4.437 3.262 4.625 0.055 3 0 "[ . 1 . 2]" 1
992 1 65 PRO HD2 1 80 LEU QD 4.690 . 4.690 2.678 2.329 2.949 . 0 0 "[ . 1 . 2]" 1
993 1 65 PRO HD3 1 80 LEU MD1 4.740 . 4.740 4.000 1.868 4.754 0.014 18 0 "[ . 1 . 2]" 1
994 1 65 PRO HD3 1 80 LEU QD 3.470 . 3.470 1.994 1.843 2.315 . 0 0 "[ . 1 . 2]" 1
995 1 65 PRO HD3 1 80 LEU MD2 4.740 . 4.740 2.447 1.845 4.442 . 0 0 "[ . 1 . 2]" 1
996 1 65 PRO QG 1 80 LEU QD 3.450 . 3.450 3.134 2.938 3.431 . 0 0 "[ . 1 . 2]" 1
997 1 66 PRO HB2 1 67 PRO HD2 3.970 . 3.970 2.862 2.187 3.350 . 0 0 "[ . 1 . 2]" 1
998 1 66 PRO HB2 1 68 SER H 3.520 . 3.520 3.011 2.387 3.408 . 0 0 "[ . 1 . 2]" 1
999 1 66 PRO HB2 1 69 ALA H 4.260 . 4.260 2.189 1.880 3.366 . 0 0 "[ . 1 . 2]" 1
1000 1 66 PRO HB2 1 69 ALA MB 4.050 . 4.050 3.058 2.716 3.452 . 0 0 "[ . 1 . 2]" 1
1001 1 66 PRO HB3 1 67 PRO HD2 4.290 . 4.290 3.501 2.672 3.909 . 0 0 "[ . 1 . 2]" 1
1002 1 66 PRO HB3 1 67 PRO HD3 4.530 . 4.530 3.997 3.086 4.551 0.021 19 0 "[ . 1 . 2]" 1
1003 1 66 PRO HB3 1 69 ALA MB 3.800 . 3.800 3.915 3.815 3.993 0.193 13 0 "[ . 1 . 2]" 1
1004 1 66 PRO QD 1 80 LEU QD 3.780 . 3.780 3.701 3.380 3.848 0.068 20 0 "[ . 1 . 2]" 1
1005 1 66 PRO QG 1 68 SER H 4.260 . 4.260 4.245 3.553 4.359 0.099 10 0 "[ . 1 . 2]" 1
1006 1 66 PRO QG 1 69 ALA HA 3.640 . 3.640 2.427 2.061 2.954 . 0 0 "[ . 1 . 2]" 1
1007 1 66 PRO QG 1 69 ALA MB 3.890 . 3.890 1.887 1.743 2.209 . 0 0 "[ . 1 . 2]" 1
1008 1 67 PRO QB 1 68 SER H 3.580 . 3.580 2.697 2.071 3.506 . 0 0 "[ . 1 . 2]" 1
1009 1 67 PRO HD2 1 68 SER H 3.530 . 3.530 2.673 1.848 3.061 . 0 0 "[ . 1 . 2]" 1
1010 1 67 PRO HD2 1 69 ALA H 4.240 . 4.240 3.552 2.948 4.415 0.175 18 0 "[ . 1 . 2]" 1
1011 1 67 PRO HD2 1 69 ALA HA 4.900 . 4.900 4.762 3.929 4.977 0.077 6 0 "[ . 1 . 2]" 1
1012 1 67 PRO HD3 1 68 SER H 4.050 . 4.050 3.943 3.439 4.123 0.073 10 0 "[ . 1 . 2]" 1
1013 1 68 SER H 1 68 SER HB2 4.020 . 4.020 3.291 2.608 3.785 . 0 0 "[ . 1 . 2]" 1
1014 1 68 SER H 1 68 SER QB 3.410 . 3.410 2.835 2.415 3.191 . 0 0 "[ . 1 . 2]" 1
1015 1 68 SER H 1 68 SER HB3 4.020 . 4.020 3.293 2.539 4.031 0.011 10 0 "[ . 1 . 2]" 1
1016 1 68 SER H 1 69 ALA H 3.540 . 3.540 1.963 1.645 3.538 . 0 0 "[ . 1 . 2]" 1
1017 1 68 SER H 1 69 ALA HA 4.210 . 4.210 4.018 3.781 4.221 0.011 16 0 "[ . 1 . 2]" 1
1018 1 68 SER H 1 70 GLN H 4.210 . 4.210 3.802 3.329 4.235 0.025 6 0 "[ . 1 . 2]" 1
1019 1 68 SER HA 1 69 ALA MB 4.290 . 4.290 4.056 3.880 4.189 . 0 0 "[ . 1 . 2]" 1
1020 1 68 SER HA 1 70 GLN H 4.690 . 4.690 4.559 3.916 4.769 0.079 10 0 "[ . 1 . 2]" 1
1021 1 68 SER QB 1 69 ALA H 3.690 . 3.690 3.261 2.476 3.717 0.027 11 0 "[ . 1 . 2]" 1
1022 1 68 SER QB 1 69 ALA HA 5.340 . 5.340 4.853 4.286 5.263 . 0 0 "[ . 1 . 2]" 1
1023 1 68 SER HB2 1 69 ALA H 4.540 . 4.540 3.705 3.060 4.302 . 0 0 "[ . 1 . 2]" 1
1024 1 68 SER HB3 1 69 ALA H 4.540 . 4.540 3.861 2.508 4.377 . 0 0 "[ . 1 . 2]" 1
1025 1 69 ALA H 1 69 ALA MB 2.960 . 2.960 2.878 2.266 2.983 0.023 1 0 "[ . 1 . 2]" 1
1026 1 69 ALA MB 1 70 GLN H 4.100 . 4.100 3.592 3.358 3.675 . 0 0 "[ . 1 . 2]" 1
1027 1 71 PRO HA 1 72 TRP H 2.670 . 2.670 2.159 2.121 2.368 . 0 0 "[ . 1 . 2]" 1
1028 1 71 PRO HA 1 72 TRP HB2 4.730 . 4.730 4.642 4.443 4.755 0.025 2 0 "[ . 1 . 2]" 1
1029 1 71 PRO HA 1 72 TRP HB3 4.730 . 4.730 4.579 4.423 4.814 0.084 14 0 "[ . 1 . 2]" 1
1030 1 71 PRO QB 1 72 TRP H 3.590 . 3.590 3.557 3.148 3.761 0.171 14 0 "[ . 1 . 2]" 1
1031 1 71 PRO HB2 1 72 TRP H 4.420 . 4.420 3.940 3.315 4.124 . 0 0 "[ . 1 . 2]" 1
1032 1 71 PRO HB3 1 72 TRP H 4.420 . 4.420 4.078 3.650 4.392 . 0 0 "[ . 1 . 2]" 1
1033 1 72 TRP H 1 72 TRP HB2 3.160 . 3.160 2.879 2.379 3.270 0.110 14 0 "[ . 1 . 2]" 1
1034 1 72 TRP H 1 72 TRP HB3 3.160 . 3.160 2.507 2.335 2.751 . 0 0 "[ . 1 . 2]" 1
1035 1 72 TRP H 1 72 TRP HD1 4.950 . 4.950 4.747 4.612 5.000 0.050 5 0 "[ . 1 . 2]" 1
1036 1 72 TRP H 1 72 TRP HE3 5.390 . 5.390 5.098 4.421 5.404 0.014 14 0 "[ . 1 . 2]" 1
1037 1 72 TRP H 1 73 LYS H 4.660 . 4.660 4.430 4.129 4.562 . 0 0 "[ . 1 . 2]" 1
1038 1 72 TRP HA 1 72 TRP HE3 3.990 . 3.990 3.187 2.929 3.526 . 0 0 "[ . 1 . 2]" 1
1039 1 72 TRP HA 1 73 LYS H 2.780 . 2.780 2.164 1.993 2.267 . 0 0 "[ . 1 . 2]" 1
1040 1 72 TRP HA 1 74 GLY H 4.460 . 4.460 4.004 3.342 4.561 0.101 14 0 "[ . 1 . 2]" 1
1041 1 72 TRP QB 1 72 TRP HD1 3.410 . 3.410 2.611 2.526 2.713 . 0 0 "[ . 1 . 2]" 1
1042 1 72 TRP QB 1 72 TRP HE3 3.650 . 3.650 2.544 2.439 2.638 . 0 0 "[ . 1 . 2]" 1
1043 1 72 TRP HB2 1 73 LYS H 4.060 . 4.060 4.047 3.951 4.091 0.031 18 0 "[ . 1 . 2]" 1
1044 1 72 TRP HB3 1 73 LYS H 4.060 . 4.060 4.015 3.815 4.087 0.027 5 0 "[ . 1 . 2]" 1
1045 1 72 TRP HD1 1 73 LYS HA 3.670 . 3.670 3.577 3.045 3.746 0.076 2 0 "[ . 1 . 2]" 1
1046 1 72 TRP HE1 1 73 LYS H 4.720 . 4.720 4.552 4.136 4.794 0.074 5 0 "[ . 1 . 2]" 1
1047 1 72 TRP HE1 1 73 LYS HA 4.980 . 4.980 4.936 3.945 5.166 0.186 3 0 "[ . 1 . 2]" 1
1048 1 72 TRP HE1 1 74 GLY H 4.430 . 4.430 3.484 2.462 4.436 0.006 4 0 "[ . 1 . 2]" 1
1049 1 72 TRP HE1 1 74 GLY HA2 4.660 . 4.660 2.870 1.875 4.705 0.045 14 0 "[ . 1 . 2]" 1
1050 1 72 TRP HE1 1 74 GLY HA3 4.660 . 4.660 3.679 2.435 4.614 . 0 0 "[ . 1 . 2]" 1
1051 1 73 LYS H 1 73 LYS HB2 3.980 . 3.980 3.015 2.566 3.991 0.011 14 0 "[ . 1 . 2]" 1
1052 1 73 LYS H 1 73 LYS QB 3.210 . 3.210 2.657 2.456 3.282 0.072 14 0 "[ . 1 . 2]" 1
1053 1 73 LYS H 1 73 LYS HB3 3.980 . 3.980 3.262 2.588 3.864 . 0 0 "[ . 1 . 2]" 1
1054 1 73 LYS H 1 73 LYS QG 4.390 . 4.390 3.555 2.648 4.277 . 0 0 "[ . 1 . 2]" 1
1055 1 73 LYS H 1 74 GLY H 3.290 . 3.290 2.136 1.770 3.113 . 0 0 "[ . 1 . 2]" 1
1056 1 73 LYS HA 1 73 LYS QD 3.850 . 3.850 2.853 2.015 4.023 0.173 2 0 "[ . 1 . 2]" 1
1057 1 73 LYS HA 1 73 LYS QE 4.650 . 4.650 4.236 2.626 4.728 0.078 3 0 "[ . 1 . 2]" 1
1058 1 73 LYS HA 1 73 LYS HG2 3.930 . 3.930 3.297 2.555 4.053 0.123 14 0 "[ . 1 . 2]" 1
1059 1 73 LYS HA 1 73 LYS QG 3.270 . 3.270 2.814 2.349 3.337 0.067 14 0 "[ . 1 . 2]" 1
1060 1 73 LYS HA 1 73 LYS HG3 3.930 . 3.930 3.242 2.461 3.832 . 0 0 "[ . 1 . 2]" 1
1061 1 73 LYS QB 1 73 LYS QE 4.570 . 4.570 3.150 1.899 3.861 . 0 0 "[ . 1 . 2]" 1
1062 1 73 LYS QB 1 74 GLY H 3.790 . 3.790 2.978 2.091 3.867 0.077 1 0 "[ . 1 . 2]" 1
1063 1 73 LYS HB2 1 74 GLY H 4.350 . 4.350 3.685 2.288 4.380 0.030 5 0 "[ . 1 . 2]" 1
1064 1 73 LYS HB3 1 74 GLY H 4.350 . 4.350 3.460 2.105 4.362 0.012 14 0 "[ . 1 . 2]" 1
1065 1 73 LYS QE 1 73 LYS HG2 3.660 . 3.660 2.764 2.253 3.560 . 0 0 "[ . 1 . 2]" 1
1066 1 73 LYS QE 1 73 LYS HG3 3.660 . 3.660 2.809 2.366 3.498 . 0 0 "[ . 1 . 2]" 1
1067 1 73 LYS QG 1 74 GLY H 4.920 . 4.920 3.972 3.104 4.737 . 0 0 "[ . 1 . 2]" 1
1068 1 75 ASP HA 1 76 PRO HD2 3.300 . 3.300 2.322 2.100 2.706 . 0 0 "[ . 1 . 2]" 1
1069 1 75 ASP HA 1 76 PRO HD3 3.300 . 3.300 2.232 1.945 2.744 . 0 0 "[ . 1 . 2]" 1
1070 1 75 ASP HA 1 76 PRO QG 4.100 . 4.100 3.895 3.782 4.024 . 0 0 "[ . 1 . 2]" 1
1071 1 75 ASP QB 1 76 PRO QD 3.690 . 3.690 3.090 1.981 3.718 0.028 18 0 "[ . 1 . 2]" 1
1072 1 75 ASP HB2 1 76 PRO HD2 4.990 . 4.990 3.959 2.024 4.934 . 0 0 "[ . 1 . 2]" 1
1073 1 75 ASP HB2 1 76 PRO HD3 4.990 . 4.990 4.537 3.303 5.022 0.032 17 0 "[ . 1 . 2]" 1
1074 1 75 ASP HB3 1 76 PRO HD2 4.990 . 4.990 3.759 2.513 4.602 . 0 0 "[ . 1 . 2]" 1
1075 1 75 ASP HB3 1 76 PRO HD3 4.990 . 4.990 4.438 3.893 5.006 0.016 5 0 "[ . 1 . 2]" 1
1076 1 76 PRO HA 1 77 VAL H 3.470 . 3.470 2.479 2.130 3.508 0.038 12 0 "[ . 1 . 2]" 1
1077 1 76 PRO HA 1 77 VAL HA 5.240 . 5.240 4.332 4.244 4.486 . 0 0 "[ . 1 . 2]" 1
1078 1 76 PRO HA 1 78 GLU H 4.600 . 4.600 4.137 3.543 4.673 0.073 1 0 "[ . 1 . 2]" 1
1079 1 76 PRO QB 1 77 VAL H 3.410 . 3.410 2.504 1.805 3.015 . 0 0 "[ . 1 . 2]" 1
1080 1 76 PRO QB 1 77 VAL QG 4.490 . 4.490 3.306 2.735 3.757 . 0 0 "[ . 1 . 2]" 1
1081 1 76 PRO QB 1 78 GLU H 4.170 . 4.170 2.589 2.200 4.099 . 0 0 "[ . 1 . 2]" 1
1082 1 76 PRO HB2 1 77 VAL H 3.940 . 3.940 2.648 1.815 3.815 . 0 0 "[ . 1 . 2]" 1
1083 1 76 PRO HB3 1 77 VAL H 3.940 . 3.940 3.428 3.040 3.823 . 0 0 "[ . 1 . 2]" 1
1084 1 76 PRO QG 1 77 VAL QG 5.010 . 5.010 4.557 3.567 5.026 0.016 20 0 "[ . 1 . 2]" 1
1085 1 77 VAL H 1 77 VAL HB 3.010 . 3.010 2.595 2.429 2.902 . 0 0 "[ . 1 . 2]" 1
1086 1 77 VAL H 1 77 VAL MG1 3.830 . 3.830 2.069 1.852 2.279 . 0 0 "[ . 1 . 2]" 1
1087 1 77 VAL H 1 77 VAL QG 3.060 . 3.060 2.059 1.847 2.261 . 0 0 "[ . 1 . 2]" 1
1088 1 77 VAL H 1 77 VAL MG2 3.830 . 3.830 3.771 3.735 3.815 . 0 0 "[ . 1 . 2]" 1
1089 1 77 VAL H 1 78 GLU H 3.170 . 3.170 2.636 2.432 2.815 . 0 0 "[ . 1 . 2]" 1
1090 1 77 VAL H 1 79 GLN H 4.540 . 4.540 4.233 3.988 4.547 0.007 5 0 "[ . 1 . 2]" 1
1091 1 77 VAL HA 1 77 VAL MG1 3.330 . 3.330 3.230 3.208 3.248 . 0 0 "[ . 1 . 2]" 1
1092 1 77 VAL HA 1 77 VAL QG 2.890 . 2.890 2.346 2.261 2.446 . 0 0 "[ . 1 . 2]" 1
1093 1 77 VAL HA 1 77 VAL MG2 3.330 . 3.330 2.411 2.310 2.537 . 0 0 "[ . 1 . 2]" 1
1094 1 77 VAL HA 1 80 LEU HB2 4.460 . 4.460 2.929 2.279 3.402 . 0 0 "[ . 1 . 2]" 1
1095 1 77 VAL HA 1 80 LEU HB3 5.220 . 5.220 4.363 3.703 4.767 . 0 0 "[ . 1 . 2]" 1
1096 1 77 VAL HA 1 80 LEU MD1 5.030 . 5.030 2.786 2.053 4.843 . 0 0 "[ . 1 . 2]" 1
1097 1 77 VAL HA 1 80 LEU QD 3.500 . 3.500 2.235 1.879 2.718 . 0 0 "[ . 1 . 2]" 1
1098 1 77 VAL HA 1 80 LEU MD2 5.030 . 5.030 3.544 1.881 4.323 . 0 0 "[ . 1 . 2]" 1
1099 1 77 VAL HA 1 80 LEU HG 4.180 . 4.180 2.634 1.970 4.187 0.007 15 0 "[ . 1 . 2]" 1
1100 1 77 VAL HA 1 81 VAL H 5.310 . 5.310 4.780 3.901 5.341 0.031 10 0 "[ . 1 . 2]" 1
1101 1 77 VAL HB 1 80 LEU QD 4.820 . 4.820 3.488 2.887 4.161 . 0 0 "[ . 1 . 2]" 1
1102 1 77 VAL QG 1 78 GLU H 4.610 . 4.610 2.491 2.288 2.753 . 0 0 "[ . 1 . 2]" 1
1103 1 77 VAL QG 1 78 GLU HA 4.070 . 4.070 3.189 3.116 3.248 . 0 0 "[ . 1 . 2]" 1
1104 1 77 VAL QG 1 78 GLU QG 3.700 . 3.700 2.784 2.382 3.587 . 0 0 "[ . 1 . 2]" 1
1105 1 77 VAL QG 1 81 VAL H 4.670 . 4.670 4.153 3.442 4.713 0.043 14 0 "[ . 1 . 2]" 1
1106 1 77 VAL QG 1 81 VAL QG 4.780 . 4.780 2.775 1.979 3.570 . 0 0 "[ . 1 . 2]" 1
1107 1 77 VAL MG1 1 78 GLU HA 5.200 . 5.200 3.459 3.255 3.730 . 0 0 "[ . 1 . 2]" 1
1108 1 77 VAL MG1 1 78 GLU HG2 5.460 . 5.460 3.661 2.860 4.397 . 0 0 "[ . 1 . 2]" 1
1109 1 77 VAL MG1 1 78 GLU HG3 5.460 . 5.460 2.981 2.444 4.097 . 0 0 "[ . 1 . 2]" 1
1110 1 77 VAL MG2 1 78 GLU HA 5.200 . 5.200 3.844 3.413 4.257 . 0 0 "[ . 1 . 2]" 1
1111 1 77 VAL MG2 1 78 GLU HG2 5.460 . 5.460 5.274 4.529 5.607 0.147 8 0 "[ . 1 . 2]" 1
1112 1 77 VAL MG2 1 78 GLU HG3 5.460 . 5.460 4.651 3.988 5.367 . 0 0 "[ . 1 . 2]" 1
1113 1 78 GLU H 1 78 GLU HB2 3.800 . 3.800 2.523 2.367 2.703 . 0 0 "[ . 1 . 2]" 1
1114 1 78 GLU H 1 78 GLU QB 2.930 . 2.930 2.474 2.334 2.631 . 0 0 "[ . 1 . 2]" 1
1115 1 78 GLU H 1 78 GLU HB3 3.800 . 3.800 3.580 3.543 3.676 . 0 0 "[ . 1 . 2]" 1
1116 1 78 GLU H 1 78 GLU QG 3.610 . 3.610 2.424 1.978 3.266 . 0 0 "[ . 1 . 2]" 1
1117 1 78 GLU H 1 79 GLN H 3.090 . 3.090 2.617 2.523 2.811 . 0 0 "[ . 1 . 2]" 1
1118 1 78 GLU H 1 79 GLN QB 5.340 . 5.340 4.453 4.244 4.980 . 0 0 "[ . 1 . 2]" 1
1119 1 78 GLU H 1 80 LEU H 4.470 . 4.470 3.993 3.786 4.148 . 0 0 "[ . 1 . 2]" 1
1120 1 78 GLU H 1 80 LEU HB2 5.500 . 5.500 5.293 5.087 5.518 0.018 4 0 "[ . 1 . 2]" 1
1121 1 78 GLU HA 1 78 GLU HG2 3.920 . 3.920 2.984 2.446 3.772 . 0 0 "[ . 1 . 2]" 1
1122 1 78 GLU HA 1 78 GLU HG3 3.920 . 3.920 2.892 2.388 3.301 . 0 0 "[ . 1 . 2]" 1
1123 1 78 GLU HA 1 81 VAL HB 4.180 . 4.180 3.177 2.587 3.896 . 0 0 "[ . 1 . 2]" 1
1124 1 78 GLU HA 1 81 VAL QG 4.690 . 4.690 3.138 2.388 3.748 . 0 0 "[ . 1 . 2]" 1
1125 1 78 GLU QB 1 79 GLN H 3.760 . 3.760 2.987 2.741 3.121 . 0 0 "[ . 1 . 2]" 1
1126 1 78 GLU HB2 1 79 GLN H 4.310 . 4.310 3.080 2.802 3.231 . 0 0 "[ . 1 . 2]" 1
1127 1 78 GLU HB3 1 79 GLN H 4.310 . 4.310 4.028 3.842 4.185 . 0 0 "[ . 1 . 2]" 1
1128 1 78 GLU QG 1 79 GLN H 4.850 . 4.850 4.293 3.948 4.755 . 0 0 "[ . 1 . 2]" 1
1129 1 79 GLN H 1 79 GLN HB2 3.720 . 3.720 2.604 2.239 2.786 . 0 0 "[ . 1 . 2]" 1
1130 1 79 GLN H 1 79 GLN QB 3.250 . 3.250 2.306 2.215 2.486 . 0 0 "[ . 1 . 2]" 1
1131 1 79 GLN H 1 79 GLN HB3 3.720 . 3.720 2.765 2.387 3.675 . 0 0 "[ . 1 . 2]" 1
1132 1 79 GLN H 1 80 LEU H 3.340 . 3.340 2.273 2.127 2.362 . 0 0 "[ . 1 . 2]" 1
1133 1 79 GLN HA 1 79 GLN HG2 3.670 . 3.670 3.172 2.501 3.785 0.115 3 0 "[ . 1 . 2]" 1
1134 1 79 GLN HA 1 79 GLN HG3 3.670 . 3.670 3.099 2.553 3.724 0.054 11 0 "[ . 1 . 2]" 1
1135 1 79 GLN HA 1 81 VAL H 5.500 . 5.500 3.731 3.352 4.313 . 0 0 "[ . 1 . 2]" 1
1136 1 80 LEU H 1 80 LEU HB2 3.680 . 3.680 2.522 2.355 2.594 . 0 0 "[ . 1 . 2]" 1
1137 1 80 LEU H 1 80 LEU MD1 4.260 . 4.260 3.687 3.329 3.799 . 0 0 "[ . 1 . 2]" 1
1138 1 80 LEU H 1 80 LEU QD 3.690 . 3.690 2.856 1.905 3.193 . 0 0 "[ . 1 . 2]" 1
1139 1 80 LEU H 1 80 LEU MD2 4.260 . 4.260 3.011 1.916 3.453 . 0 0 "[ . 1 . 2]" 1
1140 1 80 LEU H 1 80 LEU HG 4.120 . 4.120 2.697 2.154 4.132 0.012 15 0 "[ . 1 . 2]" 1
1141 1 80 LEU H 1 81 VAL H 3.400 . 3.400 2.390 2.259 2.653 . 0 0 "[ . 1 . 2]" 1
1142 1 80 LEU H 1 81 VAL QG 4.240 . 4.240 3.811 3.468 4.237 . 0 0 "[ . 1 . 2]" 1
1143 1 80 LEU HA 1 80 LEU MD1 3.890 . 3.890 3.515 2.025 3.900 0.010 3 0 "[ . 1 . 2]" 1
1144 1 80 LEU HA 1 80 LEU QD 3.020 . 3.020 2.109 1.990 2.216 . 0 0 "[ . 1 . 2]" 1
1145 1 80 LEU HA 1 80 LEU MD2 3.890 . 3.890 2.312 2.083 3.161 . 0 0 "[ . 1 . 2]" 1
1146 1 80 LEU HA 1 80 LEU HG 4.260 . 4.260 3.360 3.169 3.784 . 0 0 "[ . 1 . 2]" 1
1147 1 80 LEU HB2 1 80 LEU QD 3.080 . 3.080 2.299 2.253 2.355 . 0 0 "[ . 1 . 2]" 1
1148 1 80 LEU HB2 1 81 VAL H 3.920 . 3.920 3.160 2.685 3.582 . 0 0 "[ . 1 . 2]" 1
1149 1 80 LEU HB2 1 81 VAL QG 4.280 . 4.280 3.277 2.992 3.655 . 0 0 "[ . 1 . 2]" 1
1150 1 80 LEU HB3 1 80 LEU QD 3.130 . 3.130 2.166 2.101 2.379 . 0 0 "[ . 1 . 2]" 1
1151 1 80 LEU QD 1 81 VAL H 4.670 . 4.670 4.132 3.699 4.301 . 0 0 "[ . 1 . 2]" 1
1152 1 80 LEU MD1 1 81 VAL H 5.500 . 5.500 4.861 4.590 5.262 . 0 0 "[ . 1 . 2]" 1
1153 1 80 LEU MD2 1 81 VAL H 5.500 . 5.500 4.485 3.881 4.707 . 0 0 "[ . 1 . 2]" 1
1154 1 81 VAL H 1 81 VAL HB 3.570 . 3.570 2.507 2.443 2.586 . 0 0 "[ . 1 . 2]" 1
1155 1 81 VAL H 1 81 VAL MG1 4.310 . 4.310 3.783 3.753 3.829 . 0 0 "[ . 1 . 2]" 1
1156 1 81 VAL H 1 81 VAL QG 3.390 . 3.390 2.470 2.232 2.734 . 0 0 "[ . 1 . 2]" 1
1157 1 81 VAL H 1 81 VAL MG2 4.310 . 4.310 2.504 2.248 2.802 . 0 0 "[ . 1 . 2]" 1
1158 1 81 VAL H 1 82 ARG H 4.660 . 4.660 4.281 4.072 4.475 . 0 0 "[ . 1 . 2]" 1
1159 1 81 VAL HA 1 81 VAL MG1 3.670 . 3.670 2.424 2.390 2.470 . 0 0 "[ . 1 . 2]" 1
1160 1 81 VAL HA 1 81 VAL MG2 3.670 . 3.670 2.364 2.336 2.411 . 0 0 "[ . 1 . 2]" 1
1161 1 81 VAL HA 1 82 ARG H 3.460 . 3.460 2.089 2.037 2.181 . 0 0 "[ . 1 . 2]" 1
1162 1 81 VAL HB 1 82 ARG H 4.730 . 4.730 4.266 4.026 4.371 . 0 0 "[ . 1 . 2]" 1
1163 1 81 VAL QG 1 83 HIS HE1 4.180 . 4.180 2.838 2.369 3.268 . 0 0 "[ . 1 . 2]" 1
1164 1 81 VAL MG1 1 82 ARG H 4.130 . 4.130 2.873 2.409 3.162 . 0 0 "[ . 1 . 2]" 1
1165 1 81 VAL MG2 1 82 ARG H 4.130 . 4.130 4.011 3.867 4.137 0.007 13 0 "[ . 1 . 2]" 1
1166 1 82 ARG H 1 82 ARG HG2 4.350 . 4.350 2.694 2.163 3.832 . 0 0 "[ . 1 . 2]" 1
1167 1 82 ARG H 1 82 ARG QG 3.730 . 3.730 2.571 2.147 2.907 . 0 0 "[ . 1 . 2]" 1
1168 1 82 ARG H 1 82 ARG HG3 4.350 . 4.350 3.780 2.652 4.062 . 0 0 "[ . 1 . 2]" 1
1169 1 82 ARG HA 1 82 ARG QD 3.520 . 3.520 2.746 2.009 3.655 0.135 15 0 "[ . 1 . 2]" 1
1170 1 82 ARG HA 1 82 ARG QG 3.690 . 3.690 2.938 2.217 3.222 . 0 0 "[ . 1 . 2]" 1
1171 1 82 ARG HA 1 83 HIS H 3.240 . 3.240 2.177 2.093 2.303 . 0 0 "[ . 1 . 2]" 1
1172 1 82 ARG QB 1 83 HIS H 3.450 . 3.450 2.879 2.573 3.090 . 0 0 "[ . 1 . 2]" 1
1173 1 82 ARG QB 1 84 PHE H 5.180 . 5.180 4.806 4.713 5.067 . 0 0 "[ . 1 . 2]" 1
1174 1 82 ARG QB 1 84 PHE QE 4.300 . 4.300 2.195 1.934 2.614 . 0 0 "[ . 1 . 2]" 1
1175 1 82 ARG HB2 1 83 HIS H 3.940 . 3.940 3.930 3.743 4.011 0.071 12 0 "[ . 1 . 2]" 1
1176 1 82 ARG HB2 1 84 PHE QD 4.270 . 4.270 3.675 3.199 4.166 . 0 0 "[ . 1 . 2]" 1
1177 1 82 ARG HB3 1 83 HIS H 3.940 . 3.940 2.966 2.621 3.229 . 0 0 "[ . 1 . 2]" 1
1178 1 82 ARG HB3 1 84 PHE QD 4.270 . 4.270 3.699 3.294 4.103 . 0 0 "[ . 1 . 2]" 1
1179 1 82 ARG QD 1 83 HIS H 4.180 . 4.180 4.068 3.239 4.232 0.052 11 0 "[ . 1 . 2]" 1
1180 1 82 ARG QD 1 84 PHE QE 4.540 . 4.540 4.033 2.819 4.591 0.051 7 0 "[ . 1 . 2]" 1
1181 1 82 ARG QD 1 122 PRO QG 4.400 . 4.400 3.603 2.620 4.337 . 0 0 "[ . 1 . 2]" 1
1182 1 82 ARG QG 1 84 PHE QE 4.790 . 4.790 3.268 2.911 4.240 . 0 0 "[ . 1 . 2]" 1
1183 1 83 HIS H 1 84 PHE H 4.630 . 4.630 4.248 4.142 4.340 . 0 0 "[ . 1 . 2]" 1
1184 1 83 HIS H 1 84 PHE QE 4.680 . 4.680 4.642 4.331 4.736 0.056 15 0 "[ . 1 . 2]" 1
1185 1 83 HIS HA 1 83 HIS HD2 4.870 . 4.870 3.202 2.753 4.568 . 0 0 "[ . 1 . 2]" 1
1186 1 83 HIS HA 1 84 PHE H 3.320 . 3.320 2.044 1.996 2.098 . 0 0 "[ . 1 . 2]" 1
1187 1 83 HIS HA 1 84 PHE QD 4.390 . 4.390 3.869 3.578 4.186 . 0 0 "[ . 1 . 2]" 1
1188 1 84 PHE H 1 84 PHE HB2 4.040 . 4.040 2.666 2.598 2.733 . 0 0 "[ . 1 . 2]" 1
1189 1 84 PHE H 1 84 PHE HB3 4.120 . 4.120 3.774 3.739 3.811 . 0 0 "[ . 1 . 2]" 1
1190 1 84 PHE H 1 84 PHE QD 3.990 . 3.990 3.130 2.818 3.348 . 0 0 "[ . 1 . 2]" 1
1191 1 84 PHE HA 1 85 LEU H 3.250 . 3.250 2.334 2.140 2.550 . 0 0 "[ . 1 . 2]" 1
1192 1 84 PHE HA 1 85 LEU QD 4.380 . 4.380 3.423 2.862 4.420 0.040 5 0 "[ . 1 . 2]" 1
1193 1 84 PHE HB2 1 85 LEU H 4.260 . 4.260 3.934 3.476 4.264 0.004 9 0 "[ . 1 . 2]" 1
1194 1 84 PHE HB2 1 95 ILE MG 4.300 . 4.300 2.961 2.502 3.496 . 0 0 "[ . 1 . 2]" 1
1195 1 84 PHE HB3 1 85 LEU H 3.830 . 3.830 2.975 2.387 3.475 . 0 0 "[ . 1 . 2]" 1
1196 1 84 PHE HB3 1 85 LEU QD 5.440 . 5.440 4.648 3.987 5.438 . 0 0 "[ . 1 . 2]" 1
1197 1 84 PHE HB3 1 95 ILE MD 4.760 . 4.760 3.952 2.834 4.435 . 0 0 "[ . 1 . 2]" 1
1198 1 84 PHE HB3 1 95 ILE HG12 4.700 . 4.700 4.486 3.540 4.728 0.028 20 0 "[ . 1 . 2]" 1
1199 1 84 PHE HB3 1 95 ILE MG 4.050 . 4.050 2.094 1.897 2.421 . 0 0 "[ . 1 . 2]" 1
1200 1 84 PHE QD 1 85 LEU H 4.460 . 4.460 4.112 3.870 4.367 . 0 0 "[ . 1 . 2]" 1
1201 1 84 PHE QD 1 95 ILE MD 4.870 . 4.870 4.496 3.859 4.890 0.020 10 0 "[ . 1 . 2]" 1
1202 1 84 PHE QD 1 95 ILE MG 3.680 . 3.680 3.072 2.693 3.477 . 0 0 "[ . 1 . 2]" 1
1203 1 84 PHE QD 1 121 LEU HA 4.910 . 4.910 4.713 4.239 4.950 0.040 17 0 "[ . 1 . 2]" 1
1204 1 84 PHE QD 1 121 LEU QD 3.340 . 3.340 2.806 2.546 3.312 . 0 0 "[ . 1 . 2]" 1
1205 1 84 PHE QD 1 121 LEU HG 5.380 . 5.380 5.140 3.348 5.425 0.045 1 0 "[ . 1 . 2]" 1
1206 1 84 PHE QE 1 121 LEU QD 4.100 . 4.100 2.994 2.695 3.685 . 0 0 "[ . 1 . 2]" 1
1207 1 84 PHE QE 1 122 PRO QD 4.060 . 4.060 2.872 2.502 3.206 . 0 0 "[ . 1 . 2]" 1
1208 1 84 PHE QE 1 122 PRO QG 4.610 . 4.610 3.822 3.331 4.344 . 0 0 "[ . 1 . 2]" 1
1209 1 85 LEU H 1 85 LEU HB2 3.970 . 3.970 3.779 2.801 3.944 . 0 0 "[ . 1 . 2]" 1
1210 1 85 LEU H 1 85 LEU QB 3.310 . 3.310 3.033 2.727 3.269 . 0 0 "[ . 1 . 2]" 1
1211 1 85 LEU H 1 85 LEU HB3 3.970 . 3.970 3.235 2.869 3.755 . 0 0 "[ . 1 . 2]" 1
1212 1 85 LEU H 1 85 LEU QD 4.380 . 4.380 2.291 1.737 3.289 . 0 0 "[ . 1 . 2]" 1
1213 1 85 LEU H 1 86 ILE H 4.480 . 4.480 4.358 4.207 4.485 0.005 13 0 "[ . 1 . 2]" 1
1214 1 85 LEU H 1 95 ILE MG 4.710 . 4.710 3.524 2.986 4.163 . 0 0 "[ . 1 . 2]" 1
1215 1 85 LEU H 1 96 LYS H 4.680 . 4.680 3.528 3.004 4.056 . 0 0 "[ . 1 . 2]" 1
1216 1 85 LEU H 1 96 LYS QG 5.120 . 5.120 4.218 3.462 5.100 . 0 0 "[ . 1 . 2]" 1
1217 1 85 LEU HA 1 85 LEU MD1 4.060 . 4.060 3.921 3.202 4.080 0.020 8 0 "[ . 1 . 2]" 1
1218 1 85 LEU HA 1 85 LEU MD2 4.060 . 4.060 3.679 3.488 4.069 0.009 20 0 "[ . 1 . 2]" 1
1219 1 85 LEU HA 1 85 LEU HG 3.840 . 3.840 3.726 2.760 3.839 . 0 0 "[ . 1 . 2]" 1
1220 1 85 LEU HA 1 86 ILE H 3.360 . 3.360 2.092 2.003 2.388 . 0 0 "[ . 1 . 2]" 1
1221 1 85 LEU HA 1 86 ILE MD 4.940 . 4.940 4.426 2.630 4.752 . 0 0 "[ . 1 . 2]" 1
1222 1 85 LEU QB 1 85 LEU QD 2.640 . 2.640 1.861 1.819 1.917 . 0 0 "[ . 1 . 2]" 1
1223 1 85 LEU QB 1 86 ILE H 4.330 . 4.330 2.660 2.115 2.915 . 0 0 "[ . 1 . 2]" 1
1224 1 85 LEU QB 1 87 GLU QG 4.910 . 4.910 3.847 2.861 4.566 . 0 0 "[ . 1 . 2]" 1
1225 1 85 LEU QB 1 96 LYS QB 4.660 . 4.660 3.951 2.217 4.243 . 0 0 "[ . 1 . 2]" 1
1226 1 85 LEU QD 1 87 GLU QB 4.530 . 4.530 4.303 3.798 4.684 0.154 18 0 "[ . 1 . 2]" 1
1227 1 85 LEU QD 1 87 GLU QG 3.690 . 3.690 2.611 2.135 3.103 . 0 0 "[ . 1 . 2]" 1
1228 1 85 LEU QD 1 96 LYS QB 3.370 . 3.370 2.613 2.129 2.918 . 0 0 "[ . 1 . 2]" 1
1229 1 85 LEU QD 1 96 LYS QE 3.850 . 3.850 3.179 2.031 3.916 0.066 19 0 "[ . 1 . 2]" 1
1230 1 85 LEU QD 1 96 LYS QG 3.400 . 3.400 2.979 2.490 3.467 0.067 9 0 "[ . 1 . 2]" 1
1231 1 85 LEU MD1 1 87 GLU HG2 5.500 . 5.500 2.884 2.437 4.907 . 0 0 "[ . 1 . 2]" 1
1232 1 85 LEU MD1 1 87 GLU HG3 5.500 . 5.500 3.337 2.345 5.038 . 0 0 "[ . 1 . 2]" 1
1233 1 85 LEU MD1 1 96 LYS HB2 4.800 . 4.800 3.699 2.183 4.634 . 0 0 "[ . 1 . 2]" 1
1234 1 85 LEU MD1 1 96 LYS HB3 4.800 . 4.800 3.674 2.442 4.669 . 0 0 "[ . 1 . 2]" 1
1235 1 85 LEU MD1 1 96 LYS QD 4.940 . 4.940 3.284 1.972 4.865 . 0 0 "[ . 1 . 2]" 1
1236 1 85 LEU MD1 1 96 LYS QE 4.900 . 4.900 3.459 2.065 4.686 . 0 0 "[ . 1 . 2]" 1
1237 1 85 LEU MD2 1 87 GLU HG2 5.500 . 5.500 4.839 3.290 5.404 . 0 0 "[ . 1 . 2]" 1
1238 1 85 LEU MD2 1 87 GLU HG3 5.500 . 5.500 4.812 4.095 5.305 . 0 0 "[ . 1 . 2]" 1
1239 1 85 LEU MD2 1 96 LYS HB2 4.800 . 4.800 3.982 3.154 4.824 0.024 5 0 "[ . 1 . 2]" 1
1240 1 85 LEU MD2 1 96 LYS HB3 4.800 . 4.800 3.278 2.251 4.221 . 0 0 "[ . 1 . 2]" 1
1241 1 85 LEU MD2 1 96 LYS QD 4.940 . 4.940 3.363 2.096 4.949 0.009 12 0 "[ . 1 . 2]" 1
1242 1 85 LEU MD2 1 96 LYS QE 4.900 . 4.900 3.918 2.902 4.732 . 0 0 "[ . 1 . 2]" 1
1243 1 85 LEU HG 1 86 ILE H 4.780 . 4.780 4.398 4.045 4.718 . 0 0 "[ . 1 . 2]" 1
1244 1 86 ILE H 1 86 ILE HB 3.840 . 3.840 2.468 2.354 2.633 . 0 0 "[ . 1 . 2]" 1
1245 1 86 ILE H 1 86 ILE MD 4.220 . 4.220 3.540 1.999 3.988 . 0 0 "[ . 1 . 2]" 1
1246 1 86 ILE H 1 86 ILE QG 4.490 . 4.490 2.534 2.221 3.312 . 0 0 "[ . 1 . 2]" 1
1247 1 86 ILE H 1 86 ILE MG 3.810 . 3.810 3.743 3.687 3.825 0.015 20 0 "[ . 1 . 2]" 1
1248 1 86 ILE HA 1 86 ILE MD 4.060 . 4.060 3.809 3.260 3.898 . 0 0 "[ . 1 . 2]" 1
1249 1 86 ILE HA 1 86 ILE MG 3.510 . 3.510 2.380 2.303 2.461 . 0 0 "[ . 1 . 2]" 1
1250 1 86 ILE HA 1 87 GLU H 3.380 . 3.380 2.119 2.052 2.181 . 0 0 "[ . 1 . 2]" 1
1251 1 86 ILE HA 1 93 VAL QG 5.440 . 5.440 4.665 4.170 5.287 . 0 0 "[ . 1 . 2]" 1
1252 1 86 ILE HA 1 94 LYS H 4.600 . 4.600 4.062 3.497 4.570 . 0 0 "[ . 1 . 2]" 1
1253 1 86 ILE HA 1 95 ILE H 4.580 . 4.580 4.437 4.139 4.604 0.024 3 0 "[ . 1 . 2]" 1
1254 1 86 ILE HA 1 95 ILE HB 5.470 . 5.470 5.084 4.925 5.264 . 0 0 "[ . 1 . 2]" 1
1255 1 86 ILE HA 1 95 ILE HG12 4.770 . 4.770 3.597 3.263 4.001 . 0 0 "[ . 1 . 2]" 1
1256 1 86 ILE HA 1 96 LYS H 4.060 . 4.060 3.060 2.628 3.332 . 0 0 "[ . 1 . 2]" 1
1257 1 86 ILE HA 1 110 LEU QD 5.440 . 5.440 4.466 4.156 5.296 . 0 0 "[ . 1 . 2]" 1
1258 1 86 ILE HB 1 86 ILE MD 3.600 . 3.600 2.402 2.324 2.448 . 0 0 "[ . 1 . 2]" 1
1259 1 86 ILE HB 1 107 LEU MD1 5.190 . 5.190 4.391 3.155 4.830 . 0 0 "[ . 1 . 2]" 1
1260 1 86 ILE HB 1 107 LEU QD 4.030 . 4.030 3.110 2.634 3.448 . 0 0 "[ . 1 . 2]" 1
1261 1 86 ILE HB 1 107 LEU MD2 5.190 . 5.190 3.291 2.660 4.730 . 0 0 "[ . 1 . 2]" 1
1262 1 86 ILE HB 1 110 LEU QD 4.840 . 4.840 4.165 3.896 4.679 . 0 0 "[ . 1 . 2]" 1
1263 1 86 ILE MD 1 95 ILE HA 4.770 . 4.770 4.423 3.789 4.736 . 0 0 "[ . 1 . 2]" 1
1264 1 86 ILE MD 1 95 ILE MD 4.410 . 4.410 3.495 3.183 3.814 . 0 0 "[ . 1 . 2]" 1
1265 1 86 ILE MD 1 95 ILE HG13 5.060 . 5.060 4.037 3.414 4.488 . 0 0 "[ . 1 . 2]" 1
1266 1 86 ILE MD 1 107 LEU MD1 3.890 . 3.890 3.427 1.928 3.900 0.010 13 0 "[ . 1 . 2]" 1
1267 1 86 ILE MD 1 107 LEU QD 3.250 . 3.250 2.234 1.924 2.845 . 0 0 "[ . 1 . 2]" 1
1268 1 86 ILE MD 1 107 LEU MD2 3.890 . 3.890 2.376 1.990 3.949 0.059 1 0 "[ . 1 . 2]" 1
1269 1 86 ILE MD 1 107 LEU HG 5.320 . 5.320 4.500 2.118 5.361 0.041 15 0 "[ . 1 . 2]" 1
1270 1 86 ILE MD 1 110 LEU QD 3.750 . 3.750 2.099 1.831 3.331 . 0 0 "[ . 1 . 2]" 1
1271 1 86 ILE MD 1 111 VAL MG2 4.710 . 4.710 4.053 3.675 4.482 . 0 0 "[ . 1 . 2]" 1
1272 1 86 ILE QG 1 87 GLU H 4.340 . 4.340 4.205 4.105 4.356 0.016 1 0 "[ . 1 . 2]" 1
1273 1 86 ILE QG 1 95 ILE HG12 3.870 . 3.870 1.957 1.821 2.143 . 0 0 "[ . 1 . 2]" 1
1274 1 86 ILE QG 1 107 LEU QD 4.870 . 4.870 3.616 2.416 4.266 . 0 0 "[ . 1 . 2]" 1
1275 1 86 ILE QG 1 110 LEU QD 4.710 . 4.710 2.852 2.078 3.454 . 0 0 "[ . 1 . 2]" 1
1276 1 86 ILE MG 1 87 GLU H 3.630 . 3.630 2.808 2.481 3.049 . 0 0 "[ . 1 . 2]" 1
1277 1 86 ILE MG 1 87 GLU HA 5.090 . 5.090 3.895 3.795 4.077 . 0 0 "[ . 1 . 2]" 1
1278 1 86 ILE MG 1 87 GLU HG2 5.500 . 5.500 5.512 5.413 5.559 0.059 2 0 "[ . 1 . 2]" 1
1279 1 86 ILE MG 1 87 GLU HG3 5.500 . 5.500 4.810 4.497 5.071 . 0 0 "[ . 1 . 2]" 1
1280 1 86 ILE MG 1 88 THR HA 4.580 . 4.580 4.362 3.965 4.640 0.060 18 0 "[ . 1 . 2]" 1
1281 1 86 ILE MG 1 88 THR HB 4.800 . 4.800 3.724 3.279 4.074 . 0 0 "[ . 1 . 2]" 1
1282 1 86 ILE MG 1 88 THR MG 4.050 . 4.050 4.098 4.022 4.144 0.094 16 0 "[ . 1 . 2]" 1
1283 1 86 ILE MG 1 93 VAL HA 4.270 . 4.270 3.536 2.913 4.004 . 0 0 "[ . 1 . 2]" 1
1284 1 86 ILE MG 1 93 VAL QG 3.010 . 3.010 2.211 1.767 2.649 . 0 0 "[ . 1 . 2]" 1
1285 1 86 ILE MG 1 94 LYS H 3.600 . 3.600 2.699 2.241 3.041 . 0 0 "[ . 1 . 2]" 1
1286 1 86 ILE MG 1 94 LYS HA 4.290 . 4.290 3.359 2.764 4.041 . 0 0 "[ . 1 . 2]" 1
1287 1 86 ILE MG 1 95 ILE H 4.700 . 4.700 4.029 3.350 4.516 . 0 0 "[ . 1 . 2]" 1
1288 1 86 ILE MG 1 95 ILE HA 4.120 . 4.120 3.314 2.867 3.683 . 0 0 "[ . 1 . 2]" 1
1289 1 86 ILE MG 1 107 LEU HA 4.350 . 4.350 3.973 3.287 4.376 0.026 20 0 "[ . 1 . 2]" 1
1290 1 86 ILE MG 1 107 LEU MD1 4.080 . 4.080 3.760 2.136 4.094 0.014 15 0 "[ . 1 . 2]" 1
1291 1 86 ILE MG 1 107 LEU QD 3.280 . 3.280 2.115 1.956 2.622 . 0 0 "[ . 1 . 2]" 1
1292 1 86 ILE MG 1 107 LEU MD2 4.080 . 4.080 2.312 1.960 3.668 . 0 0 "[ . 1 . 2]" 1
1293 1 86 ILE MG 1 110 LEU QD 4.400 . 4.400 2.333 1.963 2.946 . 0 0 "[ . 1 . 2]" 1
1294 1 86 ILE MG 1 110 LEU HG 5.500 . 5.500 4.320 3.494 4.874 . 0 0 "[ . 1 . 2]" 1
1295 1 87 GLU H 1 87 GLU QB 3.680 . 3.680 2.492 2.419 2.622 . 0 0 "[ . 1 . 2]" 1
1296 1 87 GLU H 1 87 GLU QG 3.740 . 3.740 2.464 2.254 2.682 . 0 0 "[ . 1 . 2]" 1
1297 1 87 GLU H 1 94 LYS H 3.790 . 3.790 2.963 2.722 3.216 . 0 0 "[ . 1 . 2]" 1
1298 1 87 GLU HA 1 87 GLU HG2 4.180 . 4.180 2.659 2.558 2.825 . 0 0 "[ . 1 . 2]" 1
1299 1 87 GLU HA 1 87 GLU HG3 4.180 . 4.180 3.187 3.083 3.329 . 0 0 "[ . 1 . 2]" 1
1300 1 87 GLU HA 1 88 THR H 3.030 . 3.030 2.213 2.114 2.316 . 0 0 "[ . 1 . 2]" 1
1301 1 87 GLU HA 1 88 THR MG 4.400 . 4.400 3.589 3.432 3.902 . 0 0 "[ . 1 . 2]" 1
1302 1 87 GLU QB 1 88 THR H 3.640 . 3.640 2.956 2.580 3.267 . 0 0 "[ . 1 . 2]" 1
1303 1 87 GLU QB 1 88 THR MG 4.830 . 4.830 4.482 4.334 4.748 . 0 0 "[ . 1 . 2]" 1
1304 1 87 GLU QB 1 96 LYS QD 5.250 . 5.250 4.986 3.632 5.435 0.185 9 0 "[ . 1 . 2]" 1
1305 1 87 GLU QB 1 96 LYS QE 4.540 . 4.540 4.295 3.828 4.692 0.152 10 0 "[ . 1 . 2]" 1
1306 1 87 GLU QG 1 88 THR H 4.950 . 4.950 4.208 3.987 4.448 . 0 0 "[ . 1 . 2]" 1
1307 1 87 GLU QG 1 96 LYS QB 4.410 . 4.410 2.624 2.020 3.106 . 0 0 "[ . 1 . 2]" 1
1308 1 87 GLU QG 1 96 LYS QD 4.190 . 4.190 3.603 2.556 4.241 0.051 6 0 "[ . 1 . 2]" 1
1309 1 88 THR H 1 88 THR HB 3.770 . 3.770 3.247 2.951 3.471 . 0 0 "[ . 1 . 2]" 1
1310 1 88 THR H 1 88 THR MG 3.620 . 3.620 2.168 1.959 2.471 . 0 0 "[ . 1 . 2]" 1
1311 1 88 THR H 1 89 GLY H 4.570 . 4.570 4.278 4.041 4.402 . 0 0 "[ . 1 . 2]" 1
1312 1 88 THR H 1 93 VAL QG 4.640 . 4.640 4.138 3.462 4.669 0.029 8 0 "[ . 1 . 2]" 1
1313 1 88 THR HA 1 88 THR MG 3.260 . 3.260 3.208 3.179 3.224 . 0 0 "[ . 1 . 2]" 1
1314 1 88 THR HA 1 89 GLY H 2.990 . 2.990 2.122 1.986 2.289 . 0 0 "[ . 1 . 2]" 1
1315 1 88 THR HA 1 93 VAL HA 3.470 . 3.470 2.132 1.915 2.483 . 0 0 "[ . 1 . 2]" 1
1316 1 88 THR HA 1 93 VAL HB 4.630 . 4.630 3.811 3.115 4.571 . 0 0 "[ . 1 . 2]" 1
1317 1 88 THR HA 1 93 VAL QG 3.310 . 3.310 3.008 2.689 3.334 0.024 10 0 "[ . 1 . 2]" 1
1318 1 88 THR HA 1 94 LYS H 4.350 . 4.350 3.590 3.124 4.145 . 0 0 "[ . 1 . 2]" 1
1319 1 88 THR HA 1 94 LYS QD 4.120 . 4.120 4.004 3.492 4.213 0.093 18 0 "[ . 1 . 2]" 1
1320 1 88 THR HB 1 89 GLY H 4.170 . 4.170 3.961 3.763 4.177 0.007 11 0 "[ . 1 . 2]" 1
1321 1 88 THR HB 1 92 GLY QA 5.340 . 5.340 5.126 4.004 5.411 0.071 10 0 "[ . 1 . 2]" 1
1322 1 88 THR HB 1 93 VAL HA 4.290 . 4.290 2.962 2.586 3.251 . 0 0 "[ . 1 . 2]" 1
1323 1 88 THR HB 1 93 VAL QG 3.580 . 3.580 1.866 1.710 1.977 . 0 0 "[ . 1 . 2]" 1
1324 1 88 THR MG 1 89 GLY H 4.190 . 4.190 3.989 3.599 4.220 0.030 1 0 "[ . 1 . 2]" 1
1325 1 88 THR MG 1 89 GLY HA2 4.730 . 4.730 4.143 3.716 4.516 . 0 0 "[ . 1 . 2]" 1
1326 1 88 THR MG 1 89 GLY HA3 5.500 . 5.500 5.018 4.457 5.466 . 0 0 "[ . 1 . 2]" 1
1327 1 88 THR MG 1 93 VAL HA 4.360 . 4.360 4.341 4.092 4.459 0.099 11 0 "[ . 1 . 2]" 1
1328 1 88 THR MG 1 93 VAL HB 4.620 . 4.620 4.320 3.625 4.716 0.096 1 0 "[ . 1 . 2]" 1
1329 1 88 THR MG 1 93 VAL QG 3.170 . 3.170 3.088 2.729 3.219 0.049 14 0 "[ . 1 . 2]" 1
1330 1 89 GLY H 1 90 PRO QD 4.290 . 4.290 4.109 3.875 4.253 . 0 0 "[ . 1 . 2]" 1
1331 1 89 GLY H 1 92 GLY H 3.750 . 3.750 2.848 2.706 3.014 . 0 0 "[ . 1 . 2]" 1
1332 1 89 GLY H 1 93 VAL HA 4.110 . 4.110 3.578 3.083 4.135 0.025 9 0 "[ . 1 . 2]" 1
1333 1 89 GLY H 1 93 VAL QG 4.720 . 4.720 4.279 3.871 4.648 . 0 0 "[ . 1 . 2]" 1
1334 1 89 GLY HA2 1 90 PRO HD2 3.600 . 3.600 3.301 2.818 3.642 0.042 9 0 "[ . 1 . 2]" 1
1335 1 89 GLY HA2 1 90 PRO HD3 3.600 . 3.600 2.952 2.427 3.285 . 0 0 "[ . 1 . 2]" 1
1336 1 89 GLY HA2 1 90 PRO QG 4.870 . 4.870 4.587 4.014 4.871 0.001 15 0 "[ . 1 . 2]" 1
1337 1 89 GLY HA3 1 90 PRO HD2 3.560 . 3.560 2.156 1.991 2.645 . 0 0 "[ . 1 . 2]" 1
1338 1 89 GLY HA3 1 90 PRO HD3 3.560 . 3.560 2.771 2.200 3.286 . 0 0 "[ . 1 . 2]" 1
1339 1 89 GLY HA3 1 90 PRO QG 4.310 . 4.310 3.920 3.809 4.120 . 0 0 "[ . 1 . 2]" 1
1340 1 90 PRO HB2 1 91 LYS H 3.900 . 3.900 3.409 2.414 3.917 0.017 12 0 "[ . 1 . 2]" 1
1341 1 90 PRO HB2 1 91 LYS HA 4.780 . 4.780 4.128 3.841 4.420 . 0 0 "[ . 1 . 2]" 1
1342 1 90 PRO HB3 1 91 LYS H 4.430 . 4.430 4.266 3.863 4.437 0.007 5 0 "[ . 1 . 2]" 1
1343 1 90 PRO QD 1 91 LYS H 3.710 . 3.710 2.828 2.369 3.282 . 0 0 "[ . 1 . 2]" 1
1344 1 90 PRO HD2 1 91 LYS H 4.320 . 4.320 2.894 2.397 3.404 . 0 0 "[ . 1 . 2]" 1
1345 1 90 PRO HD3 1 91 LYS H 4.320 . 4.320 4.001 3.702 4.299 . 0 0 "[ . 1 . 2]" 1
1346 1 90 PRO QG 1 91 LYS H 3.960 . 3.960 2.910 2.439 3.979 0.019 7 0 "[ . 1 . 2]" 1
1347 1 90 PRO QG 1 91 LYS QD 4.770 . 4.770 3.378 2.007 4.620 . 0 0 "[ . 1 . 2]" 1
1348 1 90 PRO QG 1 91 LYS QE 4.370 . 4.370 3.570 2.370 4.387 0.017 1 0 "[ . 1 . 2]" 1
1349 1 91 LYS H 1 91 LYS HB2 3.980 . 3.980 2.435 2.016 2.728 . 0 0 "[ . 1 . 2]" 1
1350 1 91 LYS H 1 91 LYS QB 3.230 . 3.230 2.399 1.999 2.666 . 0 0 "[ . 1 . 2]" 1
1351 1 91 LYS H 1 91 LYS HB3 3.980 . 3.980 3.621 3.316 3.753 . 0 0 "[ . 1 . 2]" 1
1352 1 91 LYS H 1 91 LYS QD 4.420 . 4.420 2.947 1.795 4.255 . 0 0 "[ . 1 . 2]" 1
1353 1 91 LYS H 1 91 LYS QG 3.310 . 3.310 2.980 2.286 3.531 0.221 9 0 "[ . 1 . 2]" 1
1354 1 91 LYS H 1 92 GLY H 3.040 . 3.040 2.391 1.900 2.928 . 0 0 "[ . 1 . 2]" 1
1355 1 91 LYS HA 1 91 LYS QD 3.710 . 3.710 2.767 1.956 3.795 0.085 13 0 "[ . 1 . 2]" 1
1356 1 91 LYS HA 1 91 LYS QE 3.930 . 3.930 3.990 3.516 4.131 0.201 7 0 "[ . 1 . 2]" 1
1357 1 91 LYS HA 1 91 LYS HG2 3.860 . 3.860 3.198 2.200 3.717 . 0 0 "[ . 1 . 2]" 1
1358 1 91 LYS HA 1 91 LYS QG 3.320 . 3.320 2.510 2.148 2.971 . 0 0 "[ . 1 . 2]" 1
1359 1 91 LYS HA 1 91 LYS HG3 3.860 . 3.860 2.940 2.249 3.774 . 0 0 "[ . 1 . 2]" 1
1360 1 91 LYS QB 1 91 LYS QD 2.900 . 2.900 2.305 2.063 2.844 . 0 0 "[ . 1 . 2]" 1
1361 1 91 LYS QB 1 91 LYS QE 4.160 . 4.160 3.475 1.817 3.867 . 0 0 "[ . 1 . 2]" 1
1362 1 91 LYS QB 1 92 GLY H 3.710 . 3.710 2.783 2.098 3.295 . 0 0 "[ . 1 . 2]" 1
1363 1 91 LYS QB 1 92 GLY QA 5.180 . 5.180 3.758 3.488 4.015 . 0 0 "[ . 1 . 2]" 1
1364 1 91 LYS QB 1 94 LYS QE 5.180 . 5.180 4.254 2.362 5.198 0.018 1 0 "[ . 1 . 2]" 1
1365 1 91 LYS QB 1 103 TYR QE 4.050 . 4.050 3.061 2.140 3.707 . 0 0 "[ . 1 . 2]" 1
1366 1 91 LYS HB2 1 91 LYS QD 3.390 . 3.390 2.738 2.237 3.313 . 0 0 "[ . 1 . 2]" 1
1367 1 91 LYS HB2 1 91 LYS QE 4.950 . 4.950 3.905 1.826 4.518 . 0 0 "[ . 1 . 2]" 1
1368 1 91 LYS HB2 1 92 GLY H 4.280 . 4.280 2.885 2.157 3.448 . 0 0 "[ . 1 . 2]" 1
1369 1 91 LYS HB2 1 103 TYR QD 4.240 . 4.240 3.210 2.609 3.931 . 0 0 "[ . 1 . 2]" 1
1370 1 91 LYS HB3 1 91 LYS QD 3.390 . 3.390 2.822 2.201 3.459 0.069 9 0 "[ . 1 . 2]" 1
1371 1 91 LYS HB3 1 91 LYS QE 4.950 . 4.950 4.020 3.257 4.477 . 0 0 "[ . 1 . 2]" 1
1372 1 91 LYS HB3 1 92 GLY H 4.280 . 4.280 3.697 2.761 4.183 . 0 0 "[ . 1 . 2]" 1
1373 1 91 LYS HB3 1 103 TYR QD 4.240 . 4.240 2.986 2.428 3.476 . 0 0 "[ . 1 . 2]" 1
1374 1 91 LYS QD 1 92 GLY H 4.940 . 4.940 4.452 3.581 5.033 0.093 5 0 "[ . 1 . 2]" 1
1375 1 91 LYS QD 1 103 TYR QD 4.640 . 4.640 4.289 3.319 4.731 0.091 7 0 "[ . 1 . 2]" 1
1376 1 91 LYS QD 1 103 TYR QE 4.070 . 4.070 3.802 2.312 4.172 0.102 9 0 "[ . 1 . 2]" 1
1377 1 91 LYS QE 1 91 LYS HG2 3.250 . 3.250 2.473 2.116 3.006 . 0 0 "[ . 1 . 2]" 1
1378 1 91 LYS QE 1 91 LYS HG3 3.250 . 3.250 2.486 2.194 3.324 0.074 7 0 "[ . 1 . 2]" 1
1379 1 91 LYS QG 1 92 GLY H 4.840 . 4.840 4.334 3.829 4.712 . 0 0 "[ . 1 . 2]" 1
1380 1 91 LYS QG 1 103 TYR QD 5.340 . 5.340 3.991 2.872 4.823 . 0 0 "[ . 1 . 2]" 1
1381 1 91 LYS HG2 1 103 TYR QE 5.500 . 5.500 4.090 2.728 5.510 0.010 20 0 "[ . 1 . 2]" 1
1382 1 91 LYS HG3 1 103 TYR QE 5.500 . 5.500 4.305 3.062 5.522 0.022 20 0 "[ . 1 . 2]" 1
1383 1 92 GLY H 1 93 VAL H 4.390 . 4.390 4.286 4.007 4.418 0.028 8 0 "[ . 1 . 2]" 1
1384 1 92 GLY H 1 103 TYR QD 4.560 . 4.560 4.187 3.388 4.633 0.073 15 0 "[ . 1 . 2]" 1
1385 1 92 GLY QA 1 93 VAL QG 3.920 . 3.920 3.340 3.068 3.704 . 0 0 "[ . 1 . 2]" 1
1386 1 92 GLY QA 1 103 TYR QD 5.250 . 5.250 3.921 3.062 4.663 . 0 0 "[ . 1 . 2]" 1
1387 1 92 GLY HA2 1 93 VAL MG1 5.500 . 5.500 3.860 3.425 4.449 . 0 0 "[ . 1 . 2]" 1
1388 1 92 GLY HA2 1 93 VAL MG2 5.500 . 5.500 4.994 4.418 5.501 0.001 5 0 "[ . 1 . 2]" 1
1389 1 92 GLY HA3 1 93 VAL MG1 5.500 . 5.500 4.020 3.877 4.178 . 0 0 "[ . 1 . 2]" 1
1390 1 92 GLY HA3 1 93 VAL MG2 5.500 . 5.500 4.825 4.008 5.545 0.045 5 0 "[ . 1 . 2]" 1
1391 1 93 VAL H 1 93 VAL MG1 4.030 . 4.030 2.390 2.090 2.838 . 0 0 "[ . 1 . 2]" 1
1392 1 93 VAL H 1 93 VAL QG 3.170 . 3.170 2.145 2.066 2.281 . 0 0 "[ . 1 . 2]" 1
1393 1 93 VAL H 1 93 VAL MG2 4.030 . 4.030 3.056 2.159 3.921 . 0 0 "[ . 1 . 2]" 1
1394 1 93 VAL H 1 94 LYS H 4.600 . 4.600 4.426 4.274 4.529 . 0 0 "[ . 1 . 2]" 1
1395 1 93 VAL H 1 103 TYR QD 4.910 . 4.910 4.547 4.029 4.919 0.009 19 0 "[ . 1 . 2]" 1
1396 1 93 VAL H 1 104 PHE H 3.830 . 3.830 3.112 2.644 3.618 . 0 0 "[ . 1 . 2]" 1
1397 1 93 VAL HA 1 93 VAL QG 3.010 . 3.010 2.344 2.226 2.439 . 0 0 "[ . 1 . 2]" 1
1398 1 93 VAL HA 1 94 LYS H 3.190 . 3.190 2.236 2.129 2.347 . 0 0 "[ . 1 . 2]" 1
1399 1 93 VAL HA 1 94 LYS QD 4.080 . 4.080 3.593 3.064 4.121 0.041 18 0 "[ . 1 . 2]" 1
1400 1 93 VAL HB 1 94 LYS H 4.370 . 4.370 3.621 2.652 4.383 0.013 10 0 "[ . 1 . 2]" 1
1401 1 93 VAL HB 1 107 LEU QD 4.560 . 4.560 3.500 2.624 4.420 . 0 0 "[ . 1 . 2]" 1
1402 1 93 VAL QG 1 94 LYS H 3.800 . 3.800 3.002 2.342 3.568 . 0 0 "[ . 1 . 2]" 1
1403 1 93 VAL QG 1 94 LYS HA 5.440 . 5.440 3.418 3.239 3.603 . 0 0 "[ . 1 . 2]" 1
1404 1 93 VAL QG 1 104 PHE H 4.070 . 4.070 3.039 2.579 3.753 . 0 0 "[ . 1 . 2]" 1
1405 1 93 VAL QG 1 104 PHE HA 4.500 . 4.500 4.085 3.838 4.428 . 0 0 "[ . 1 . 2]" 1
1406 1 93 VAL QG 1 104 PHE QB 3.450 . 3.450 2.117 1.886 2.376 . 0 0 "[ . 1 . 2]" 1
1407 1 93 VAL QG 1 104 PHE QD 3.630 . 3.630 3.086 2.465 3.642 0.012 4 0 "[ . 1 . 2]" 1
1408 1 93 VAL QG 1 106 SER H 3.870 . 3.870 3.337 2.918 3.721 . 0 0 "[ . 1 . 2]" 1
1409 1 93 VAL QG 1 106 SER HA 3.760 . 3.760 2.897 2.296 3.602 . 0 0 "[ . 1 . 2]" 1
1410 1 93 VAL QG 1 107 LEU H 3.890 . 3.890 3.261 2.581 3.603 . 0 0 "[ . 1 . 2]" 1
1411 1 93 VAL QG 1 107 LEU HA 3.460 . 3.460 2.802 2.450 3.170 . 0 0 "[ . 1 . 2]" 1
1412 1 93 VAL QG 1 107 LEU HB2 4.640 . 4.640 4.447 3.940 4.659 0.019 7 0 "[ . 1 . 2]" 1
1413 1 93 VAL QG 1 107 LEU QD 3.010 . 3.010 2.096 1.855 2.542 . 0 0 "[ . 1 . 2]" 1
1414 1 93 VAL QG 1 109 ALA MB 4.160 . 4.160 3.964 3.595 4.214 0.054 16 0 "[ . 1 . 2]" 1
1415 1 93 VAL QG 1 110 LEU QD 3.480 . 3.480 2.193 1.867 2.837 . 0 0 "[ . 1 . 2]" 1
1416 1 93 VAL MG1 1 106 SER HA 4.410 . 4.410 3.087 2.369 4.125 . 0 0 "[ . 1 . 2]" 1
1417 1 93 VAL MG1 1 107 LEU H 4.640 . 4.640 3.574 2.705 4.201 . 0 0 "[ . 1 . 2]" 1
1418 1 93 VAL MG1 1 107 LEU HA 4.330 . 4.330 3.578 2.828 4.287 . 0 0 "[ . 1 . 2]" 1
1419 1 93 VAL MG1 1 107 LEU HB2 5.410 . 5.410 5.049 4.275 5.425 0.015 15 0 "[ . 1 . 2]" 1
1420 1 93 VAL MG2 1 106 SER HA 4.410 . 4.410 3.916 3.081 4.469 0.059 13 0 "[ . 1 . 2]" 1
1421 1 93 VAL MG2 1 107 LEU H 4.640 . 4.640 3.902 3.259 4.469 . 0 0 "[ . 1 . 2]" 1
1422 1 93 VAL MG2 1 107 LEU HA 4.330 . 4.330 3.144 2.477 3.924 . 0 0 "[ . 1 . 2]" 1
1423 1 93 VAL MG2 1 107 LEU HB2 5.410 . 5.410 4.962 4.616 5.340 . 0 0 "[ . 1 . 2]" 1
1424 1 94 LYS HA 1 110 LEU QD 4.470 . 4.470 3.233 2.334 4.239 . 0 0 "[ . 1 . 2]" 1
1425 1 94 LYS QB 1 94 LYS HD2 3.850 . 3.850 2.643 2.256 3.528 . 0 0 "[ . 1 . 2]" 1
1426 1 94 LYS QB 1 94 LYS QD 3.350 . 3.350 2.410 2.060 2.703 . 0 0 "[ . 1 . 2]" 1
1427 1 94 LYS QB 1 94 LYS HD3 3.850 . 3.850 2.969 2.236 3.314 . 0 0 "[ . 1 . 2]" 1
1428 1 94 LYS QB 1 94 LYS HE2 4.610 . 4.610 3.831 2.094 4.200 . 0 0 "[ . 1 . 2]" 1
1429 1 94 LYS QB 1 94 LYS QE 3.740 . 3.740 3.488 2.046 3.797 0.057 20 0 "[ . 1 . 2]" 1
1430 1 94 LYS QB 1 94 LYS HE3 4.610 . 4.610 4.129 2.877 4.589 . 0 0 "[ . 1 . 2]" 1
1431 1 94 LYS QB 1 95 ILE H 4.490 . 4.490 2.622 2.041 2.953 . 0 0 "[ . 1 . 2]" 1
1432 1 94 LYS QB 1 103 TYR H 5.500 . 5.500 4.357 1.911 5.352 . 0 0 "[ . 1 . 2]" 1
1433 1 94 LYS QB 1 103 TYR HA 4.020 . 4.020 2.587 2.199 3.280 . 0 0 "[ . 1 . 2]" 1
1434 1 94 LYS QB 1 103 TYR QD 4.020 . 4.020 2.747 2.118 3.417 . 0 0 "[ . 1 . 2]" 1
1435 1 94 LYS QB 1 103 TYR QE 5.040 . 5.040 3.763 3.182 4.527 . 0 0 "[ . 1 . 2]" 1
1436 1 94 LYS QB 1 104 PHE H 5.080 . 5.080 3.538 2.893 4.321 . 0 0 "[ . 1 . 2]" 1
1437 1 94 LYS QD 1 103 TYR QD 3.730 . 3.730 2.625 1.922 3.830 0.100 20 0 "[ . 1 . 2]" 1
1438 1 94 LYS QD 1 103 TYR QE 3.920 . 3.920 2.803 1.839 3.854 . 0 0 "[ . 1 . 2]" 1
1439 1 94 LYS HD2 1 103 TYR QE 4.520 . 4.520 2.907 2.081 4.469 . 0 0 "[ . 1 . 2]" 1
1440 1 94 LYS HD3 1 103 TYR QE 4.520 . 4.520 3.997 2.042 4.567 0.047 19 0 "[ . 1 . 2]" 1
1441 1 94 LYS QE 1 94 LYS QG 3.190 . 3.190 2.261 2.060 2.407 . 0 0 "[ . 1 . 2]" 1
1442 1 94 LYS QE 1 103 TYR QD 3.920 . 3.920 3.580 3.003 4.028 0.108 8 0 "[ . 1 . 2]" 1
1443 1 94 LYS QE 1 103 TYR QE 3.360 . 3.360 2.193 1.896 2.711 . 0 0 "[ . 1 . 2]" 1
1444 1 94 LYS HE2 1 103 TYR QD 4.690 . 4.690 4.117 3.039 4.786 0.096 19 0 "[ . 1 . 2]" 1
1445 1 94 LYS HE2 1 103 TYR QE 3.850 . 3.850 2.763 1.910 3.861 0.011 1 0 "[ . 1 . 2]" 1
1446 1 94 LYS HE3 1 103 TYR QD 4.690 . 4.690 4.259 3.476 4.733 0.043 10 0 "[ . 1 . 2]" 1
1447 1 94 LYS HE3 1 103 TYR QE 3.850 . 3.850 3.040 1.985 3.876 0.026 20 0 "[ . 1 . 2]" 1
1448 1 94 LYS QG 1 103 TYR QD 5.240 . 5.240 3.123 1.863 3.995 . 0 0 "[ . 1 . 2]" 1
1449 1 95 ILE H 1 95 ILE MD 4.730 . 4.730 3.706 3.581 3.874 . 0 0 "[ . 1 . 2]" 1
1450 1 95 ILE H 1 95 ILE HG12 4.600 . 4.600 3.584 3.412 3.827 . 0 0 "[ . 1 . 2]" 1
1451 1 95 ILE H 1 95 ILE HG13 4.290 . 4.290 2.358 2.166 2.652 . 0 0 "[ . 1 . 2]" 1
1452 1 95 ILE H 1 110 LEU QD 5.000 . 5.000 3.961 3.212 4.958 . 0 0 "[ . 1 . 2]" 1
1453 1 95 ILE HA 1 95 ILE MD 4.100 . 4.100 3.863 3.799 3.904 . 0 0 "[ . 1 . 2]" 1
1454 1 95 ILE HA 1 95 ILE HG12 4.120 . 4.120 2.566 2.446 2.656 . 0 0 "[ . 1 . 2]" 1
1455 1 95 ILE HA 1 95 ILE MG 3.580 . 3.580 2.422 2.289 2.500 . 0 0 "[ . 1 . 2]" 1
1456 1 95 ILE HA 1 96 LYS H 3.420 . 3.420 2.156 2.090 2.234 . 0 0 "[ . 1 . 2]" 1
1457 1 95 ILE HB 1 95 ILE MD 3.560 . 3.560 2.449 2.422 2.487 . 0 0 "[ . 1 . 2]" 1
1458 1 95 ILE MD 1 95 ILE MG 2.880 . 2.880 1.955 1.921 1.984 . 0 0 "[ . 1 . 2]" 1
1459 1 95 ILE MD 1 110 LEU QD 4.610 . 4.610 2.544 1.924 3.048 . 0 0 "[ . 1 . 2]" 1
1460 1 95 ILE MD 1 110 LEU HG 5.480 . 5.480 4.633 2.763 5.485 0.005 19 0 "[ . 1 . 2]" 1
1461 1 95 ILE MD 1 121 LEU QB 5.340 . 5.340 4.606 4.225 5.201 . 0 0 "[ . 1 . 2]" 1
1462 1 95 ILE MD 1 121 LEU MD1 3.630 . 3.630 2.853 2.122 3.553 . 0 0 "[ . 1 . 2]" 1
1463 1 95 ILE MD 1 121 LEU QD 3.180 . 3.180 2.373 1.990 2.756 . 0 0 "[ . 1 . 2]" 1
1464 1 95 ILE MD 1 121 LEU MD2 3.630 . 3.630 2.686 2.240 3.609 . 0 0 "[ . 1 . 2]" 1
1465 1 95 ILE HG12 1 110 LEU QD 4.600 . 4.600 3.107 2.629 4.181 . 0 0 "[ . 1 . 2]" 1
1466 1 95 ILE HG13 1 110 LEU MD1 4.480 . 4.480 3.781 2.330 4.508 0.028 9 0 "[ . 1 . 2]" 1
1467 1 95 ILE HG13 1 110 LEU QD 3.840 . 3.840 2.712 2.138 3.647 . 0 0 "[ . 1 . 2]" 1
1468 1 95 ILE HG13 1 110 LEU MD2 4.480 . 4.480 2.929 2.148 4.052 . 0 0 "[ . 1 . 2]" 1
1469 1 95 ILE MG 1 96 LYS H 3.770 . 3.770 2.595 2.367 3.138 . 0 0 "[ . 1 . 2]" 1
1470 1 95 ILE MG 1 98 CYS H 4.980 . 4.980 3.907 2.799 4.913 . 0 0 "[ . 1 . 2]" 1
1471 1 95 ILE MG 1 98 CYS HB2 4.790 . 4.790 4.159 2.704 4.837 0.047 4 0 "[ . 1 . 2]" 1
1472 1 95 ILE MG 1 98 CYS QB 4.160 . 4.160 3.276 2.671 4.090 . 0 0 "[ . 1 . 2]" 1
1473 1 95 ILE MG 1 98 CYS HB3 4.790 . 4.790 3.677 2.906 4.618 . 0 0 "[ . 1 . 2]" 1
1474 1 95 ILE MG 1 121 LEU QD 4.120 . 4.120 3.088 2.690 3.689 . 0 0 "[ . 1 . 2]" 1
1475 1 96 LYS H 1 96 LYS HB2 3.820 . 3.820 2.690 2.383 3.025 . 0 0 "[ . 1 . 2]" 1
1476 1 96 LYS H 1 96 LYS QB 3.340 . 3.340 2.235 2.152 2.339 . 0 0 "[ . 1 . 2]" 1
1477 1 96 LYS H 1 96 LYS HB3 3.820 . 3.820 2.412 2.280 2.584 . 0 0 "[ . 1 . 2]" 1
1478 1 96 LYS H 1 96 LYS HG2 4.760 . 4.760 4.429 4.217 4.635 . 0 0 "[ . 1 . 2]" 1
1479 1 96 LYS H 1 96 LYS QG 4.100 . 4.100 3.969 3.895 4.049 . 0 0 "[ . 1 . 2]" 1
1480 1 96 LYS H 1 96 LYS HG3 4.760 . 4.760 4.498 4.366 4.614 . 0 0 "[ . 1 . 2]" 1
1481 1 96 LYS H 1 97 GLY H 4.780 . 4.780 4.145 2.846 4.580 . 0 0 "[ . 1 . 2]" 1
1482 1 96 LYS HA 1 96 LYS QD 4.260 . 4.260 3.346 1.995 4.283 0.023 13 0 "[ . 1 . 2]" 1
1483 1 96 LYS HA 1 96 LYS QE 4.250 . 4.250 3.689 1.896 4.212 . 0 0 "[ . 1 . 2]" 1
1484 1 96 LYS HA 1 96 LYS HG2 3.970 . 3.970 3.572 3.278 3.930 . 0 0 "[ . 1 . 2]" 1
1485 1 96 LYS HA 1 96 LYS QG 3.420 . 3.420 2.753 2.474 3.118 . 0 0 "[ . 1 . 2]" 1
1486 1 96 LYS HA 1 96 LYS HG3 3.970 . 3.970 2.865 2.555 3.281 . 0 0 "[ . 1 . 2]" 1
1487 1 96 LYS HA 1 98 CYS H 4.710 . 4.710 3.675 2.774 4.723 0.013 19 0 "[ . 1 . 2]" 1
1488 1 96 LYS QB 1 96 LYS QE 3.480 . 3.480 2.339 1.927 3.536 0.056 4 0 "[ . 1 . 2]" 1
1489 1 96 LYS QB 1 97 GLY H 4.480 . 4.480 3.472 2.256 3.964 . 0 0 "[ . 1 . 2]" 1
1490 1 96 LYS HB2 1 96 LYS QE 4.300 . 4.300 2.396 1.944 3.751 . 0 0 "[ . 1 . 2]" 1
1491 1 96 LYS HB3 1 96 LYS QE 4.300 . 4.300 3.487 3.157 4.326 0.026 4 0 "[ . 1 . 2]" 1
1492 1 96 LYS QE 1 96 LYS HG2 3.630 . 3.630 2.958 2.235 3.546 . 0 0 "[ . 1 . 2]" 1
1493 1 96 LYS QE 1 96 LYS HG3 3.630 . 3.630 2.786 2.267 3.309 . 0 0 "[ . 1 . 2]" 1
1494 1 96 LYS QG 1 97 GLY H 3.780 . 3.780 2.953 2.264 3.661 . 0 0 "[ . 1 . 2]" 1
1495 1 96 LYS QG 1 97 GLY QA 4.550 . 4.550 3.309 3.119 3.849 . 0 0 "[ . 1 . 2]" 1
1496 1 97 GLY H 1 98 CYS H 3.200 . 3.200 2.366 1.773 3.241 0.041 3 0 "[ . 1 . 2]" 1
1497 1 98 CYS H 1 98 CYS HB2 3.800 . 3.800 3.275 2.490 3.830 0.030 17 0 "[ . 1 . 2]" 1
1498 1 98 CYS H 1 98 CYS QB 3.290 . 3.290 2.654 2.253 3.020 . 0 0 "[ . 1 . 2]" 1
1499 1 98 CYS H 1 98 CYS HB3 3.800 . 3.800 2.860 2.447 3.648 . 0 0 "[ . 1 . 2]" 1
1500 1 98 CYS H 1 99 PRO QD 4.570 . 4.570 4.192 3.724 4.424 . 0 0 "[ . 1 . 2]" 1
1501 1 98 CYS HA 1 99 PRO HA 4.580 . 4.580 4.498 4.373 4.558 . 0 0 "[ . 1 . 2]" 1
1502 1 98 CYS HA 1 99 PRO HD2 3.540 . 3.540 2.602 2.188 3.023 . 0 0 "[ . 1 . 2]" 1
1503 1 98 CYS HA 1 99 PRO HD3 3.540 . 3.540 2.058 1.876 2.605 . 0 0 "[ . 1 . 2]" 1
1504 1 98 CYS HA 1 99 PRO HG2 4.570 . 4.570 4.492 4.354 4.588 0.018 7 0 "[ . 1 . 2]" 1
1505 1 98 CYS HA 1 99 PRO HG3 4.570 . 4.570 4.217 3.948 4.569 . 0 0 "[ . 1 . 2]" 1
1506 1 98 CYS HA 1 100 SER H 4.550 . 4.550 3.952 3.403 4.602 0.052 11 0 "[ . 1 . 2]" 1
1507 1 98 CYS QB 1 99 PRO QD 4.100 . 4.100 3.148 2.296 3.793 . 0 0 "[ . 1 . 2]" 1
1508 1 98 CYS QB 1 120 SER HA 4.630 . 4.630 3.586 1.948 4.709 0.079 6 0 "[ . 1 . 2]" 1
1509 1 98 CYS QB 1 120 SER QB 4.090 . 4.090 2.456 1.810 3.817 . 0 0 "[ . 1 . 2]" 1
1510 1 98 CYS HB2 1 99 PRO HD2 5.500 . 5.500 3.758 2.521 4.757 . 0 0 "[ . 1 . 2]" 1
1511 1 98 CYS HB2 1 99 PRO HD3 5.500 . 5.500 4.146 3.259 4.946 . 0 0 "[ . 1 . 2]" 1
1512 1 98 CYS HB2 1 120 SER HB2 5.500 . 5.500 3.743 2.227 5.462 . 0 0 "[ . 1 . 2]" 1
1513 1 98 CYS HB2 1 120 SER HB3 5.500 . 5.500 3.581 1.927 5.369 . 0 0 "[ . 1 . 2]" 1
1514 1 98 CYS HB3 1 99 PRO HD2 5.500 . 5.500 4.201 2.338 4.934 . 0 0 "[ . 1 . 2]" 1
1515 1 98 CYS HB3 1 99 PRO HD3 5.500 . 5.500 4.446 3.869 4.876 . 0 0 "[ . 1 . 2]" 1
1516 1 98 CYS HB3 1 120 SER HB2 5.500 . 5.500 3.651 2.105 4.791 . 0 0 "[ . 1 . 2]" 1
1517 1 98 CYS HB3 1 120 SER HB3 5.500 . 5.500 3.508 1.831 5.373 . 0 0 "[ . 1 . 2]" 1
1518 1 99 PRO QB 1 100 SER H 4.040 . 4.040 3.175 2.041 3.949 . 0 0 "[ . 1 . 2]" 1
1519 1 99 PRO QD 1 100 SER H 3.590 . 3.590 2.547 1.972 3.135 . 0 0 "[ . 1 . 2]" 1
1520 1 99 PRO HD2 1 100 SER H 4.110 . 4.110 2.592 1.982 3.244 . 0 0 "[ . 1 . 2]" 1
1521 1 99 PRO HD2 1 119 ILE MG 5.500 . 5.500 3.435 2.063 4.634 . 0 0 "[ . 1 . 2]" 1
1522 1 99 PRO HD3 1 100 SER H 4.110 . 4.110 3.839 3.305 4.147 0.037 3 0 "[ . 1 . 2]" 1
1523 1 99 PRO HD3 1 119 ILE MG 5.500 . 5.500 4.721 3.382 5.575 0.075 4 0 "[ . 1 . 2]" 1
1524 1 99 PRO QG 1 100 SER H 4.840 . 4.840 3.399 2.071 4.081 . 0 0 "[ . 1 . 2]" 1
1525 1 100 SER H 1 100 SER QB 3.250 . 3.250 2.695 2.269 3.163 . 0 0 "[ . 1 . 2]" 1
1526 1 100 SER H 1 101 GLU H 3.920 . 3.920 3.224 1.797 4.049 0.129 19 0 "[ . 1 . 2]" 1
1527 1 100 SER H 1 101 GLU QB 5.340 . 5.340 4.423 3.062 5.419 0.079 15 0 "[ . 1 . 2]" 1
1528 1 100 SER HA 1 101 GLU QB 5.340 . 5.340 4.510 3.869 5.348 0.008 6 0 "[ . 1 . 2]" 1
1529 1 100 SER QB 1 101 GLU H 3.930 . 3.930 2.744 1.710 3.804 . 0 0 "[ . 1 . 2]" 1
1530 1 100 SER QB 1 101 GLU QB 4.910 . 4.910 4.304 3.393 5.054 0.144 11 0 "[ . 1 . 2]" 1
1531 1 100 SER QB 1 101 GLU QG 5.370 . 5.370 4.877 3.659 5.539 0.169 3 0 "[ . 1 . 2]" 1
1532 1 100 SER QB 1 119 ILE MD 4.760 . 4.760 3.631 2.160 4.773 0.013 8 0 "[ . 1 . 2]" 1
1533 1 100 SER QB 1 119 ILE MG 3.740 . 3.740 2.659 1.921 3.758 0.018 11 0 "[ . 1 . 2]" 1
1534 1 101 GLU H 1 119 ILE MG 5.130 . 5.130 3.974 2.613 5.116 . 0 0 "[ . 1 . 2]" 1
1535 1 101 GLU HA 1 101 GLU QG 3.480 . 3.480 2.566 2.349 3.016 . 0 0 "[ . 1 . 2]" 1
1536 1 101 GLU QB 1 119 ILE MD 5.340 . 5.340 4.345 2.900 5.425 0.085 15 0 "[ . 1 . 2]" 1
1537 1 102 PRO HA 1 103 TYR H 3.050 . 3.050 2.606 2.031 3.295 0.245 19 0 "[ . 1 . 2]" 1
1538 1 102 PRO QB 1 103 TYR H 3.270 . 3.270 2.462 1.639 3.311 0.041 17 0 "[ . 1 . 2]" 1
1539 1 102 PRO HB2 1 103 TYR H 3.830 . 3.830 2.559 1.643 3.683 . 0 0 "[ . 1 . 2]" 1
1540 1 102 PRO HB3 1 103 TYR H 3.830 . 3.830 3.474 2.814 3.989 0.159 15 0 "[ . 1 . 2]" 1
1541 1 102 PRO QG 1 103 TYR H 5.030 . 5.030 3.757 2.343 4.852 . 0 0 "[ . 1 . 2]" 1
1542 1 102 PRO QG 1 104 PHE QD 4.620 . 4.620 4.102 2.299 4.693 0.073 10 0 "[ . 1 . 2]" 1
1543 1 102 PRO HG2 1 104 PHE QE 4.720 . 4.720 3.493 2.650 4.762 0.042 19 0 "[ . 1 . 2]" 1
1544 1 102 PRO HG3 1 104 PHE QE 4.720 . 4.720 4.307 2.516 4.746 0.026 10 0 "[ . 1 . 2]" 1
1545 1 103 TYR H 1 103 TYR HB2 3.900 . 3.900 2.719 2.439 3.544 . 0 0 "[ . 1 . 2]" 1
1546 1 103 TYR H 1 103 TYR QB 3.260 . 3.260 2.641 2.403 3.313 0.053 10 0 "[ . 1 . 2]" 1
1547 1 103 TYR H 1 103 TYR HB3 3.900 . 3.900 3.719 3.611 4.004 0.104 20 0 "[ . 1 . 2]" 1
1548 1 103 TYR H 1 103 TYR QD 3.780 . 3.780 2.758 2.269 3.502 . 0 0 "[ . 1 . 2]" 1
1549 1 103 TYR H 1 103 TYR QE 4.550 . 4.550 4.512 4.365 4.651 0.101 15 0 "[ . 1 . 2]" 1
1550 1 103 TYR H 1 104 PHE H 4.900 . 4.900 4.177 3.217 4.511 . 0 0 "[ . 1 . 2]" 1
1551 1 103 TYR HA 1 103 TYR QD 3.660 . 3.660 2.855 2.496 3.234 . 0 0 "[ . 1 . 2]" 1
1552 1 103 TYR HA 1 104 PHE H 3.370 . 3.370 2.144 2.029 2.375 . 0 0 "[ . 1 . 2]" 1
1553 1 103 TYR QB 1 104 PHE H 3.900 . 3.900 3.320 2.569 3.759 . 0 0 "[ . 1 . 2]" 1
1554 1 103 TYR HB2 1 104 PHE H 4.550 . 4.550 4.236 3.730 4.448 . 0 0 "[ . 1 . 2]" 1
1555 1 103 TYR HB3 1 104 PHE H 4.550 . 4.550 3.480 2.618 4.053 . 0 0 "[ . 1 . 2]" 1
1556 1 104 PHE H 1 104 PHE QD 4.150 . 4.150 2.555 2.151 3.081 . 0 0 "[ . 1 . 2]" 1
1557 1 104 PHE HA 1 109 ALA MB 4.210 . 4.210 3.914 3.181 4.264 0.054 15 0 "[ . 1 . 2]" 1
1558 1 104 PHE QB 1 105 GLY H 3.720 . 3.720 2.358 1.950 3.019 . 0 0 "[ . 1 . 2]" 1
1559 1 104 PHE QB 1 106 SER H 3.460 . 3.460 3.033 2.539 3.455 . 0 0 "[ . 1 . 2]" 1
1560 1 104 PHE QB 1 109 ALA MB 3.270 . 3.270 2.169 1.914 2.444 . 0 0 "[ . 1 . 2]" 1
1561 1 104 PHE QB 1 110 LEU H 4.290 . 4.290 3.456 3.036 3.744 . 0 0 "[ . 1 . 2]" 1
1562 1 104 PHE QB 1 110 LEU QD 4.670 . 4.670 2.825 2.084 3.416 . 0 0 "[ . 1 . 2]" 1
1563 1 104 PHE HB2 1 105 GLY H 4.450 . 4.450 3.316 1.978 3.971 . 0 0 "[ . 1 . 2]" 1
1564 1 104 PHE HB2 1 106 SER H 4.200 . 4.200 3.937 3.431 4.226 0.026 6 0 "[ . 1 . 2]" 1
1565 1 104 PHE HB2 1 109 ALA MB 3.790 . 3.790 3.413 2.653 3.763 . 0 0 "[ . 1 . 2]" 1
1566 1 104 PHE HB3 1 105 GLY H 4.450 . 4.450 2.551 2.067 3.196 . 0 0 "[ . 1 . 2]" 1
1567 1 104 PHE HB3 1 106 SER H 4.200 . 4.200 3.172 2.592 3.770 . 0 0 "[ . 1 . 2]" 1
1568 1 104 PHE HB3 1 109 ALA MB 3.790 . 3.790 2.196 1.938 2.476 . 0 0 "[ . 1 . 2]" 1
1569 1 104 PHE QD 1 109 ALA MB 3.510 . 3.510 2.557 2.090 3.166 . 0 0 "[ . 1 . 2]" 1
1570 1 104 PHE QD 1 110 LEU QD 3.400 . 3.400 2.686 2.331 3.039 . 0 0 "[ . 1 . 2]" 1
1571 1 104 PHE QD 1 110 LEU HG 4.570 . 4.570 4.265 3.520 4.590 0.020 8 0 "[ . 1 . 2]" 1
1572 1 104 PHE QE 1 109 ALA MB 4.820 . 4.820 3.968 3.073 4.848 0.028 13 0 "[ . 1 . 2]" 1
1573 1 104 PHE QE 1 119 ILE MD 4.750 . 4.750 4.400 3.544 4.816 0.066 6 0 "[ . 1 . 2]" 1
1574 1 105 GLY H 1 106 SER H 3.360 . 3.360 2.474 1.990 3.293 . 0 0 "[ . 1 . 2]" 1
1575 1 105 GLY H 1 109 ALA MB 3.880 . 3.880 3.361 2.707 3.928 0.048 1 0 "[ . 1 . 2]" 1
1576 1 105 GLY QA 1 109 ALA MB 4.880 . 4.880 4.321 3.431 4.781 . 0 0 "[ . 1 . 2]" 1
1577 1 106 SER H 1 106 SER QB 3.670 . 3.670 2.636 2.413 3.150 . 0 0 "[ . 1 . 2]" 1
1578 1 106 SER H 1 107 LEU H 4.690 . 4.690 4.432 4.312 4.560 . 0 0 "[ . 1 . 2]" 1
1579 1 106 SER H 1 109 ALA H 4.380 . 4.380 3.859 3.273 4.282 . 0 0 "[ . 1 . 2]" 1
1580 1 106 SER H 1 109 ALA MB 3.170 . 3.170 2.825 2.317 3.178 0.008 6 0 "[ . 1 . 2]" 1
1581 1 106 SER HA 1 107 LEU H 3.410 . 3.410 2.377 2.279 2.519 . 0 0 "[ . 1 . 2]" 1
1582 1 106 SER QB 1 107 LEU HB2 4.680 . 4.680 4.263 3.958 4.633 . 0 0 "[ . 1 . 2]" 1
1583 1 106 SER HB2 1 107 LEU H 3.910 . 3.910 3.639 2.569 3.921 0.011 2 0 "[ . 1 . 2]" 1
1584 1 106 SER HB2 1 108 SER H 3.870 . 3.870 3.420 2.173 3.879 0.009 15 0 "[ . 1 . 2]" 1
1585 1 106 SER HB3 1 107 LEU H 3.910 . 3.910 2.730 2.326 3.770 . 0 0 "[ . 1 . 2]" 1
1586 1 106 SER HB3 1 108 SER H 3.870 . 3.870 3.109 2.800 3.915 0.045 12 0 "[ . 1 . 2]" 1
1587 1 107 LEU H 1 107 LEU HB2 3.620 . 3.620 2.447 2.275 2.564 . 0 0 "[ . 1 . 2]" 1
1588 1 107 LEU H 1 107 LEU HB3 3.660 . 3.660 3.590 3.533 3.634 . 0 0 "[ . 1 . 2]" 1
1589 1 107 LEU H 1 107 LEU QD 4.190 . 4.190 2.967 2.058 3.288 . 0 0 "[ . 1 . 2]" 1
1590 1 107 LEU H 1 107 LEU HG 4.040 . 4.040 2.614 2.123 4.060 0.020 1 0 "[ . 1 . 2]" 1
1591 1 107 LEU H 1 108 SER H 3.740 . 3.740 2.683 2.363 2.858 . 0 0 "[ . 1 . 2]" 1
1592 1 107 LEU HA 1 107 LEU MD1 4.010 . 4.010 3.637 2.005 3.922 . 0 0 "[ . 1 . 2]" 1
1593 1 107 LEU HA 1 107 LEU QD 3.250 . 3.250 2.094 1.978 2.456 . 0 0 "[ . 1 . 2]" 1
1594 1 107 LEU HA 1 107 LEU MD2 4.010 . 4.010 2.292 2.016 3.842 . 0 0 "[ . 1 . 2]" 1
1595 1 107 LEU HA 1 109 ALA H 4.310 . 4.310 4.011 3.835 4.295 . 0 0 "[ . 1 . 2]" 1
1596 1 107 LEU HA 1 110 LEU H 4.160 . 4.160 3.513 3.255 3.661 . 0 0 "[ . 1 . 2]" 1
1597 1 107 LEU HA 1 110 LEU MD1 4.340 . 4.340 2.953 1.916 3.492 . 0 0 "[ . 1 . 2]" 1
1598 1 107 LEU HA 1 110 LEU QD 3.730 . 3.730 2.507 1.904 2.892 . 0 0 "[ . 1 . 2]" 1
1599 1 107 LEU HA 1 110 LEU MD2 4.340 . 4.340 2.883 2.504 3.538 . 0 0 "[ . 1 . 2]" 1
1600 1 107 LEU HA 1 111 VAL H 4.690 . 4.690 4.311 4.013 4.624 . 0 0 "[ . 1 . 2]" 1
1601 1 107 LEU HA 1 111 VAL MG2 4.590 . 4.590 3.826 3.646 4.060 . 0 0 "[ . 1 . 2]" 1
1602 1 107 LEU HB2 1 108 SER H 3.820 . 3.820 2.668 2.403 2.841 . 0 0 "[ . 1 . 2]" 1
1603 1 107 LEU HB2 1 109 ALA H 5.500 . 5.500 5.027 4.846 5.205 . 0 0 "[ . 1 . 2]" 1
1604 1 107 LEU HB2 1 110 LEU QD 5.280 . 5.280 4.311 3.977 4.725 . 0 0 "[ . 1 . 2]" 1
1605 1 107 LEU HB3 1 107 LEU MD1 3.590 . 3.590 2.458 2.335 3.207 . 0 0 "[ . 1 . 2]" 1
1606 1 107 LEU HB3 1 107 LEU QD 3.110 . 3.110 2.143 2.099 2.383 . 0 0 "[ . 1 . 2]" 1
1607 1 107 LEU HB3 1 107 LEU MD2 3.590 . 3.590 2.409 2.329 3.196 . 0 0 "[ . 1 . 2]" 1
1608 1 107 LEU HB3 1 108 SER H 4.350 . 4.350 3.580 3.190 3.831 . 0 0 "[ . 1 . 2]" 1
1609 1 107 LEU HB3 1 110 LEU MD1 4.610 . 4.610 3.439 2.840 4.368 . 0 0 "[ . 1 . 2]" 1
1610 1 107 LEU HB3 1 110 LEU QD 3.720 . 3.720 3.203 2.775 3.578 . 0 0 "[ . 1 . 2]" 1
1611 1 107 LEU HB3 1 110 LEU MD2 4.610 . 4.610 3.984 3.404 4.415 . 0 0 "[ . 1 . 2]" 1
1612 1 107 LEU HB3 1 111 VAL MG2 4.460 . 4.460 3.004 2.706 3.315 . 0 0 "[ . 1 . 2]" 1
1613 1 107 LEU QD 1 108 SER H 5.290 . 5.290 4.068 3.779 4.198 . 0 0 "[ . 1 . 2]" 1
1614 1 107 LEU QD 1 110 LEU QD 3.970 . 3.970 2.371 1.962 3.176 . 0 0 "[ . 1 . 2]" 1
1615 1 107 LEU QD 1 111 VAL MG2 4.250 . 4.250 3.689 3.302 4.039 . 0 0 "[ . 1 . 2]" 1
1616 1 107 LEU MD1 1 111 VAL MG2 5.050 . 5.050 4.299 3.713 5.007 . 0 0 "[ . 1 . 2]" 1
1617 1 107 LEU MD2 1 111 VAL MG2 5.050 . 5.050 4.072 3.506 4.942 . 0 0 "[ . 1 . 2]" 1
1618 1 108 SER H 1 108 SER QB 3.230 . 3.230 2.448 2.201 2.623 . 0 0 "[ . 1 . 2]" 1
1619 1 108 SER H 1 109 ALA H 3.650 . 3.650 2.801 2.652 2.872 . 0 0 "[ . 1 . 2]" 1
1620 1 108 SER H 1 109 ALA MB 4.890 . 4.890 4.467 4.331 4.548 . 0 0 "[ . 1 . 2]" 1
1621 1 108 SER H 1 110 LEU H 4.680 . 4.680 4.500 4.081 4.695 0.015 7 0 "[ . 1 . 2]" 1
1622 1 108 SER HA 1 111 VAL H 4.590 . 4.590 3.496 3.203 3.741 . 0 0 "[ . 1 . 2]" 1
1623 1 108 SER HA 1 111 VAL HB 4.180 . 4.180 2.336 2.045 2.569 . 0 0 "[ . 1 . 2]" 1
1624 1 108 SER HA 1 111 VAL MG1 4.300 . 4.300 3.592 3.307 3.937 . 0 0 "[ . 1 . 2]" 1
1625 1 108 SER HA 1 111 VAL MG2 4.110 . 4.110 2.891 2.573 3.213 . 0 0 "[ . 1 . 2]" 1
1626 1 108 SER QB 1 109 ALA H 3.570 . 3.570 2.801 2.504 3.429 . 0 0 "[ . 1 . 2]" 1
1627 1 108 SER QB 1 109 ALA MB 4.430 . 4.430 3.930 3.713 4.446 0.016 19 0 "[ . 1 . 2]" 1
1628 1 108 SER QB 1 111 VAL HB 4.590 . 4.590 4.127 3.766 4.595 0.005 13 0 "[ . 1 . 2]" 1
1629 1 108 SER QB 1 111 VAL MG1 5.320 . 5.320 4.757 4.249 5.330 0.010 13 0 "[ . 1 . 2]" 1
1630 1 108 SER QB 1 111 VAL MG2 4.970 . 4.970 4.452 4.125 4.789 . 0 0 "[ . 1 . 2]" 1
1631 1 109 ALA H 1 109 ALA MB 3.030 . 3.030 2.241 2.217 2.261 . 0 0 "[ . 1 . 2]" 1
1632 1 109 ALA H 1 110 LEU H 3.430 . 3.430 2.647 2.333 2.778 . 0 0 "[ . 1 . 2]" 1
1633 1 109 ALA H 1 112 SER H 4.980 . 4.980 4.743 4.620 4.894 . 0 0 "[ . 1 . 2]" 1
1634 1 109 ALA HA 1 112 SER H 4.090 . 4.090 3.694 3.384 4.039 . 0 0 "[ . 1 . 2]" 1
1635 1 109 ALA HA 1 112 SER QB 3.920 . 3.920 3.451 2.775 4.020 0.100 9 0 "[ . 1 . 2]" 1
1636 1 109 ALA MB 1 110 LEU H 3.390 . 3.390 2.507 2.307 2.675 . 0 0 "[ . 1 . 2]" 1
1637 1 109 ALA MB 1 112 SER QB 5.230 . 5.230 4.699 4.156 5.165 . 0 0 "[ . 1 . 2]" 1
1638 1 110 LEU H 1 110 LEU MD1 4.400 . 4.400 3.172 1.711 4.150 . 0 0 "[ . 1 . 2]" 1
1639 1 110 LEU H 1 110 LEU QD 3.830 . 3.830 2.889 1.700 3.643 . 0 0 "[ . 1 . 2]" 1
1640 1 110 LEU H 1 110 LEU MD2 4.400 . 4.400 3.462 2.966 4.033 . 0 0 "[ . 1 . 2]" 1
1641 1 110 LEU H 1 110 LEU HG 4.650 . 4.650 2.645 2.048 4.541 . 0 0 "[ . 1 . 2]" 1
1642 1 110 LEU H 1 111 VAL H 3.790 . 3.790 2.439 2.267 2.792 . 0 0 "[ . 1 . 2]" 1
1643 1 110 LEU H 1 111 VAL HB 4.980 . 4.980 4.537 4.316 4.873 . 0 0 "[ . 1 . 2]" 1
1644 1 110 LEU H 1 111 VAL MG2 4.700 . 4.700 3.951 3.641 4.339 . 0 0 "[ . 1 . 2]" 1
1645 1 110 LEU QD 1 111 VAL H 4.190 . 4.190 2.327 2.079 2.788 . 0 0 "[ . 1 . 2]" 1
1646 1 110 LEU QD 1 111 VAL HA 3.830 . 3.830 2.728 2.481 2.950 . 0 0 "[ . 1 . 2]" 1
1647 1 110 LEU QD 1 111 VAL HB 4.620 . 4.620 3.786 3.619 4.060 . 0 0 "[ . 1 . 2]" 1
1648 1 110 LEU QD 1 111 VAL MG2 3.190 . 3.190 2.098 1.998 2.324 . 0 0 "[ . 1 . 2]" 1
1649 1 110 LEU QD 1 114 HIS QB 4.600 . 4.600 4.223 3.464 4.645 0.045 8 0 "[ . 1 . 2]" 1
1650 1 110 LEU QD 1 125 LEU QD 3.980 . 3.980 3.045 2.548 3.504 . 0 0 "[ . 1 . 2]" 1
1651 1 110 LEU MD1 1 111 VAL MG2 4.150 . 4.150 2.490 2.002 4.162 0.012 13 0 "[ . 1 . 2]" 1
1652 1 110 LEU MD2 1 111 VAL MG2 4.150 . 4.150 3.645 2.015 4.180 0.030 11 0 "[ . 1 . 2]" 1
1653 1 111 VAL H 1 111 VAL HB 3.800 . 3.800 2.426 2.344 2.488 . 0 0 "[ . 1 . 2]" 1
1654 1 111 VAL H 1 111 VAL MG1 4.310 . 4.310 3.739 3.691 3.771 . 0 0 "[ . 1 . 2]" 1
1655 1 111 VAL H 1 111 VAL MG2 3.590 . 3.590 2.247 2.169 2.343 . 0 0 "[ . 1 . 2]" 1
1656 1 111 VAL HA 1 111 VAL MG1 3.730 . 3.730 2.500 2.448 2.537 . 0 0 "[ . 1 . 2]" 1
1657 1 111 VAL HA 1 111 VAL MG2 3.440 . 3.440 2.307 2.267 2.344 . 0 0 "[ . 1 . 2]" 1
1658 1 111 VAL HA 1 121 LEU QD 5.260 . 5.260 4.791 4.443 5.231 . 0 0 "[ . 1 . 2]" 1
1659 1 111 VAL HA 1 125 LEU MD1 5.210 . 5.210 3.224 1.862 5.066 . 0 0 "[ . 1 . 2]" 1
1660 1 111 VAL HA 1 125 LEU QD 3.730 . 3.730 2.004 1.831 2.677 . 0 0 "[ . 1 . 2]" 1
1661 1 111 VAL HA 1 125 LEU MD2 5.210 . 5.210 3.273 1.832 4.754 . 0 0 "[ . 1 . 2]" 1
1662 1 111 VAL HB 1 112 SER H 3.600 . 3.600 2.540 2.340 2.763 . 0 0 "[ . 1 . 2]" 1
1663 1 111 VAL MG1 1 112 SER H 3.790 . 3.790 3.139 2.856 3.368 . 0 0 "[ . 1 . 2]" 1
1664 1 111 VAL MG1 1 112 SER QB 4.020 . 4.020 3.878 3.563 4.110 0.090 2 0 "[ . 1 . 2]" 1
1665 1 111 VAL MG1 1 125 LEU QD 3.730 . 3.730 2.587 2.007 3.578 . 0 0 "[ . 1 . 2]" 1
1666 1 111 VAL MG1 1 127 ILE HB 5.390 . 5.390 4.493 4.219 4.857 . 0 0 "[ . 1 . 2]" 1
1667 1 111 VAL MG1 1 127 ILE MD 3.550 . 3.550 2.296 1.900 3.084 . 0 0 "[ . 1 . 2]" 1
1668 1 111 VAL MG1 1 127 ILE HG12 4.340 . 4.340 2.491 2.009 3.142 . 0 0 "[ . 1 . 2]" 1
1669 1 111 VAL MG1 1 127 ILE QG 3.770 . 3.770 2.204 1.931 2.824 . 0 0 "[ . 1 . 2]" 1
1670 1 111 VAL MG1 1 127 ILE HG13 4.340 . 4.340 2.695 2.014 3.726 . 0 0 "[ . 1 . 2]" 1
1671 1 111 VAL MG1 1 127 ILE MG 3.910 . 3.910 3.283 2.614 3.899 . 0 0 "[ . 1 . 2]" 1
1672 1 111 VAL MG2 1 112 SER H 4.110 . 4.110 3.885 3.800 3.975 . 0 0 "[ . 1 . 2]" 1
1673 1 111 VAL MG2 1 112 SER QB 5.340 . 5.340 5.226 4.986 5.398 0.058 17 0 "[ . 1 . 2]" 1
1674 1 111 VAL MG2 1 121 LEU QD 5.440 . 5.440 4.977 4.585 5.333 . 0 0 "[ . 1 . 2]" 1
1675 1 111 VAL MG2 1 127 ILE MG 5.500 . 5.500 4.963 4.372 5.445 . 0 0 "[ . 1 . 2]" 1
1676 1 112 SER H 1 112 SER QB 2.990 . 2.990 2.377 2.216 2.659 . 0 0 "[ . 1 . 2]" 1
1677 1 112 SER HA 1 127 ILE MD 3.840 . 3.840 2.817 1.998 3.422 . 0 0 "[ . 1 . 2]" 1
1678 1 112 SER QB 1 127 ILE MD 4.550 . 4.550 4.109 3.163 4.638 0.088 1 0 "[ . 1 . 2]" 1
1679 1 114 HIS HA 1 116 ILE H 4.360 . 4.360 3.612 3.184 4.078 . 0 0 "[ . 1 . 2]" 1
1680 1 114 HIS HA 1 117 SER H 4.240 . 4.240 3.132 2.683 4.328 0.088 1 0 "[ . 1 . 2]" 1
1681 1 114 HIS HA 1 121 LEU QD 4.780 . 4.780 4.334 3.274 4.798 0.018 14 0 "[ . 1 . 2]" 1
1682 1 114 HIS HA 1 125 LEU H 4.860 . 4.860 4.399 3.862 4.744 . 0 0 "[ . 1 . 2]" 1
1683 1 114 HIS HA 1 125 LEU QD 5.050 . 5.050 4.398 2.862 4.751 . 0 0 "[ . 1 . 2]" 1
1684 1 114 HIS QB 1 121 LEU QD 4.050 . 4.050 2.413 1.978 4.147 0.097 1 0 "[ . 1 . 2]" 1
1685 1 114 HIS QB 1 125 LEU QD 3.440 . 3.440 2.153 1.986 2.347 . 0 0 "[ . 1 . 2]" 1
1686 1 114 HIS QB 1 125 LEU HG 4.620 . 4.620 3.149 2.016 4.485 . 0 0 "[ . 1 . 2]" 1
1687 1 114 HIS HB2 1 125 LEU MD1 4.980 . 4.980 3.147 2.018 4.333 . 0 0 "[ . 1 . 2]" 1
1688 1 114 HIS HB2 1 125 LEU MD2 4.980 . 4.980 3.169 2.057 4.119 . 0 0 "[ . 1 . 2]" 1
1689 1 114 HIS HB2 1 125 LEU HG 5.340 . 5.340 3.467 2.338 4.974 . 0 0 "[ . 1 . 2]" 1
1690 1 114 HIS HB3 1 125 LEU MD1 4.980 . 4.980 3.614 2.426 4.780 . 0 0 "[ . 1 . 2]" 1
1691 1 114 HIS HB3 1 125 LEU MD2 4.980 . 4.980 3.550 2.377 4.540 . 0 0 "[ . 1 . 2]" 1
1692 1 114 HIS HB3 1 125 LEU HG 5.340 . 5.340 3.727 2.108 5.356 0.016 3 0 "[ . 1 . 2]" 1
1693 1 115 SER H 1 115 SER HB2 3.890 . 3.890 2.632 2.438 3.490 . 0 0 "[ . 1 . 2]" 1
1694 1 115 SER H 1 115 SER HB3 3.890 . 3.890 3.276 2.523 3.599 . 0 0 "[ . 1 . 2]" 1
1695 1 115 SER H 1 116 ILE H 3.530 . 3.530 2.333 2.197 2.583 . 0 0 "[ . 1 . 2]" 1
1696 1 115 SER H 1 117 SER H 4.640 . 4.640 4.045 3.634 4.527 . 0 0 "[ . 1 . 2]" 1
1697 1 115 SER HA 1 124 CYS HA 4.680 . 4.680 3.830 3.133 4.665 . 0 0 "[ . 1 . 2]" 1
1698 1 115 SER HA 1 124 CYS HB2 4.520 . 4.520 3.655 2.092 4.574 0.054 3 0 "[ . 1 . 2]" 1
1699 1 115 SER HA 1 124 CYS QB 3.950 . 3.950 2.676 2.081 3.281 . 0 0 "[ . 1 . 2]" 1
1700 1 115 SER HA 1 124 CYS HB3 4.520 . 4.520 3.243 2.342 4.544 0.024 17 0 "[ . 1 . 2]" 1
1701 1 115 SER HA 1 125 LEU H 5.050 . 5.050 2.760 2.167 5.080 0.030 11 0 "[ . 1 . 2]" 1
1702 1 115 SER QB 1 116 ILE H 4.090 . 4.090 2.845 2.423 3.761 . 0 0 "[ . 1 . 2]" 1
1703 1 115 SER QB 1 116 ILE HG12 4.450 . 4.450 3.929 3.640 4.476 0.026 11 0 "[ . 1 . 2]" 1
1704 1 115 SER QB 1 116 ILE HG13 4.460 . 4.460 2.875 2.479 3.954 . 0 0 "[ . 1 . 2]" 1
1705 1 115 SER QB 1 127 ILE MD 4.230 . 4.230 3.369 2.046 4.468 0.238 11 0 "[ . 1 . 2]" 1
1706 1 115 SER HB2 1 116 ILE HG13 5.290 . 5.290 3.259 2.508 4.946 . 0 0 "[ . 1 . 2]" 1
1707 1 115 SER HB3 1 116 ILE HG13 5.290 . 5.290 3.962 2.880 4.789 . 0 0 "[ . 1 . 2]" 1
1708 1 116 ILE H 1 116 ILE HB 3.560 . 3.560 2.533 2.476 2.589 . 0 0 "[ . 1 . 2]" 1
1709 1 116 ILE H 1 116 ILE MD 4.190 . 4.190 3.744 3.538 3.932 . 0 0 "[ . 1 . 2]" 1
1710 1 116 ILE H 1 116 ILE HG12 4.230 . 4.230 3.633 3.399 3.820 . 0 0 "[ . 1 . 2]" 1
1711 1 116 ILE H 1 116 ILE HG13 4.070 . 4.070 2.413 2.137 2.667 . 0 0 "[ . 1 . 2]" 1
1712 1 116 ILE H 1 116 ILE MG 4.110 . 4.110 3.795 3.762 3.834 . 0 0 "[ . 1 . 2]" 1
1713 1 116 ILE H 1 117 SER H 2.990 . 2.990 2.327 2.134 2.802 . 0 0 "[ . 1 . 2]" 1
1714 1 116 ILE HA 1 116 ILE MD 3.900 . 3.900 3.874 3.828 3.922 0.022 13 0 "[ . 1 . 2]" 1
1715 1 116 ILE HA 1 116 ILE HG12 3.710 . 3.710 2.596 2.498 2.730 . 0 0 "[ . 1 . 2]" 1
1716 1 116 ILE HA 1 116 ILE HG13 3.770 . 3.770 3.068 2.993 3.134 . 0 0 "[ . 1 . 2]" 1
1717 1 116 ILE HA 1 116 ILE MG 3.180 . 3.180 2.394 2.315 2.448 . 0 0 "[ . 1 . 2]" 1
1718 1 116 ILE HB 1 116 ILE MD 3.070 . 3.070 2.436 2.358 2.477 . 0 0 "[ . 1 . 2]" 1
1719 1 116 ILE HB 1 117 SER H 3.640 . 3.640 2.305 2.024 2.627 . 0 0 "[ . 1 . 2]" 1
1720 1 116 ILE HB 1 117 SER QB 4.460 . 4.460 3.780 3.157 4.193 . 0 0 "[ . 1 . 2]" 1
1721 1 116 ILE MD 1 117 SER H 4.750 . 4.750 4.314 3.920 4.631 . 0 0 "[ . 1 . 2]" 1
1722 1 116 ILE HG12 1 117 SER H 5.100 . 5.100 4.823 4.652 4.951 . 0 0 "[ . 1 . 2]" 1
1723 1 116 ILE HG13 1 116 ILE MG 3.210 . 3.210 3.211 3.202 3.215 0.005 1 0 "[ . 1 . 2]" 1
1724 1 116 ILE HG13 1 117 SER H 4.250 . 4.250 4.031 3.753 4.249 . 0 0 "[ . 1 . 2]" 1
1725 1 116 ILE MG 1 117 SER H 4.040 . 4.040 3.284 2.959 3.524 . 0 0 "[ . 1 . 2]" 1
1726 1 116 ILE MG 1 117 SER HB2 4.580 . 4.580 3.950 3.020 4.308 . 0 0 "[ . 1 . 2]" 1
1727 1 116 ILE MG 1 117 SER QB 3.940 . 3.940 3.688 2.948 3.944 0.004 3 0 "[ . 1 . 2]" 1
1728 1 116 ILE MG 1 117 SER HB3 4.580 . 4.580 4.469 4.067 4.594 0.014 1 0 "[ . 1 . 2]" 1
1729 1 117 SER H 1 117 SER QB 3.630 . 3.630 2.563 2.316 2.800 . 0 0 "[ . 1 . 2]" 1
1730 1 117 SER QB 1 119 ILE MD 3.970 . 3.970 3.230 2.464 3.931 . 0 0 "[ . 1 . 2]" 1
1731 1 117 SER QB 1 119 ILE QG 3.820 . 3.820 2.867 2.350 3.828 0.008 11 0 "[ . 1 . 2]" 1
1732 1 117 SER HB2 1 119 ILE MD 4.530 . 4.530 3.699 2.896 4.550 0.020 11 0 "[ . 1 . 2]" 1
1733 1 117 SER HB2 1 119 ILE HG12 5.500 . 5.500 4.386 3.724 5.511 0.011 11 0 "[ . 1 . 2]" 1
1734 1 117 SER HB2 1 119 ILE HG13 5.500 . 5.500 3.634 2.851 4.848 . 0 0 "[ . 1 . 2]" 1
1735 1 117 SER HB3 1 119 ILE MD 4.530 . 4.530 3.662 2.544 4.544 0.014 15 0 "[ . 1 . 2]" 1
1736 1 117 SER HB3 1 119 ILE HG12 5.500 . 5.500 3.669 2.938 5.437 . 0 0 "[ . 1 . 2]" 1
1737 1 117 SER HB3 1 119 ILE HG13 5.500 . 5.500 3.381 2.587 4.264 . 0 0 "[ . 1 . 2]" 1
1738 1 118 PRO QB 1 119 ILE H 4.010 . 4.010 3.750 3.543 3.881 . 0 0 "[ . 1 . 2]" 1
1739 1 118 PRO HB2 1 124 CYS HA 4.530 . 4.530 4.009 3.119 4.569 0.039 11 0 "[ . 1 . 2]" 1
1740 1 118 PRO HB3 1 124 CYS HA 4.530 . 4.530 2.529 2.123 3.522 . 0 0 "[ . 1 . 2]" 1
1741 1 119 ILE H 1 119 ILE MD 4.140 . 4.140 3.657 3.464 3.773 . 0 0 "[ . 1 . 2]" 1
1742 1 119 ILE H 1 119 ILE HG12 4.080 . 4.080 3.485 3.185 3.708 . 0 0 "[ . 1 . 2]" 1
1743 1 119 ILE H 1 119 ILE QG 3.490 . 3.490 2.209 1.884 2.432 . 0 0 "[ . 1 . 2]" 1
1744 1 119 ILE H 1 119 ILE HG13 4.080 . 4.080 2.234 1.898 2.465 . 0 0 "[ . 1 . 2]" 1
1745 1 119 ILE H 1 119 ILE MG 4.000 . 4.000 3.799 3.753 3.838 . 0 0 "[ . 1 . 2]" 1
1746 1 119 ILE HA 1 119 ILE MD 4.030 . 4.030 3.880 3.824 3.931 . 0 0 "[ . 1 . 2]" 1
1747 1 119 ILE HA 1 119 ILE HG12 4.230 . 4.230 2.605 2.510 2.701 . 0 0 "[ . 1 . 2]" 1
1748 1 119 ILE HA 1 119 ILE QG 3.630 . 3.630 2.471 2.394 2.544 . 0 0 "[ . 1 . 2]" 1
1749 1 119 ILE HA 1 119 ILE HG13 4.230 . 4.230 3.072 2.986 3.166 . 0 0 "[ . 1 . 2]" 1
1750 1 119 ILE HA 1 119 ILE MG 3.240 . 3.240 2.372 2.273 2.457 . 0 0 "[ . 1 . 2]" 1
1751 1 119 ILE MD 1 119 ILE MG 2.960 . 2.960 1.975 1.921 2.038 . 0 0 "[ . 1 . 2]" 1
1752 1 119 ILE MG 1 120 SER HA 3.840 . 3.840 3.438 3.186 3.711 . 0 0 "[ . 1 . 2]" 1
1753 1 119 ILE MG 1 120 SER HB2 5.500 . 5.500 4.360 3.219 5.198 . 0 0 "[ . 1 . 2]" 1
1754 1 119 ILE MG 1 120 SER HB3 5.500 . 5.500 4.526 3.577 5.451 . 0 0 "[ . 1 . 2]" 1
1755 1 121 LEU H 1 121 LEU HB2 4.120 . 4.120 2.512 2.263 2.672 . 0 0 "[ . 1 . 2]" 1
1756 1 121 LEU H 1 121 LEU QB 3.500 . 3.500 2.468 2.237 2.620 . 0 0 "[ . 1 . 2]" 1
1757 1 121 LEU H 1 121 LEU HB3 4.120 . 4.120 3.633 3.513 3.774 . 0 0 "[ . 1 . 2]" 1
1758 1 121 LEU H 1 121 LEU MD1 4.040 . 4.040 3.503 2.070 4.033 . 0 0 "[ . 1 . 2]" 1
1759 1 121 LEU H 1 121 LEU MD2 4.040 . 4.040 3.166 1.871 3.753 . 0 0 "[ . 1 . 2]" 1
1760 1 121 LEU H 1 121 LEU HG 3.920 . 3.920 2.976 2.171 3.993 0.073 20 0 "[ . 1 . 2]" 1
1761 1 121 LEU HA 1 121 LEU MD1 4.520 . 4.520 3.401 2.111 3.896 . 0 0 "[ . 1 . 2]" 1
1762 1 121 LEU HA 1 121 LEU QD 3.340 . 3.340 2.155 2.042 2.629 . 0 0 "[ . 1 . 2]" 1
1763 1 121 LEU HA 1 121 LEU MD2 4.520 . 4.520 2.526 2.049 3.843 . 0 0 "[ . 1 . 2]" 1
1764 1 121 LEU HA 1 122 PRO QD 3.580 . 3.580 2.014 1.921 2.094 . 0 0 "[ . 1 . 2]" 1
1765 1 121 LEU HA 1 123 CYS H 4.540 . 4.540 3.846 3.499 4.271 . 0 0 "[ . 1 . 2]" 1
1766 1 121 LEU QB 1 122 PRO QD 4.100 . 4.100 2.633 2.354 3.084 . 0 0 "[ . 1 . 2]" 1
1767 1 121 LEU QB 1 123 CYS H 3.400 . 3.400 2.675 2.386 2.978 . 0 0 "[ . 1 . 2]" 1
1768 1 121 LEU HB2 1 123 CYS H 3.990 . 3.990 3.611 3.290 4.003 0.013 13 0 "[ . 1 . 2]" 1
1769 1 121 LEU HB3 1 123 CYS H 3.990 . 3.990 2.763 2.413 3.107 . 0 0 "[ . 1 . 2]" 1
1770 1 121 LEU QD 1 122 PRO QD 3.890 . 3.890 2.963 2.703 3.543 . 0 0 "[ . 1 . 2]" 1
1771 1 121 LEU QD 1 122 PRO QG 4.890 . 4.890 4.395 4.123 4.915 0.025 15 0 "[ . 1 . 2]" 1
1772 1 121 LEU QD 1 123 CYS H 4.480 . 4.480 4.070 3.834 4.377 . 0 0 "[ . 1 . 2]" 1
1773 1 121 LEU QD 1 125 LEU H 4.400 . 4.400 3.856 3.212 4.408 0.008 6 0 "[ . 1 . 2]" 1
1774 1 121 LEU QD 1 125 LEU HA 4.610 . 4.610 4.013 3.181 4.700 0.090 6 0 "[ . 1 . 2]" 1
1775 1 121 LEU QD 1 125 LEU QD 3.130 . 3.130 1.932 1.791 2.266 . 0 0 "[ . 1 . 2]" 1
1776 1 121 LEU QD 1 125 LEU HG 4.170 . 4.170 3.273 2.185 4.202 0.032 1 0 "[ . 1 . 2]" 1
1777 1 121 LEU MD1 1 123 CYS H 5.150 . 5.150 4.596 4.235 5.185 0.035 15 0 "[ . 1 . 2]" 1
1778 1 121 LEU MD2 1 123 CYS H 5.150 . 5.150 4.613 4.075 5.200 0.050 1 0 "[ . 1 . 2]" 1
1779 1 121 LEU HG 1 125 LEU QD 5.210 . 5.210 3.648 1.955 4.356 . 0 0 "[ . 1 . 2]" 1
1780 1 122 PRO QB 1 123 CYS H 3.620 . 3.620 3.405 3.062 3.617 . 0 0 "[ . 1 . 2]" 1
1781 1 122 PRO HB2 1 123 CYS H 4.370 . 4.370 3.579 3.143 3.851 . 0 0 "[ . 1 . 2]" 1
1782 1 122 PRO HB3 1 123 CYS H 4.370 . 4.370 4.293 4.143 4.397 0.027 17 0 "[ . 1 . 2]" 1
1783 1 122 PRO QD 1 123 CYS H 4.020 . 4.020 2.687 2.180 2.903 . 0 0 "[ . 1 . 2]" 1
1784 1 122 PRO QG 1 123 CYS H 3.380 . 3.380 2.805 2.439 3.418 0.038 8 0 "[ . 1 . 2]" 1
1785 1 123 CYS H 1 123 CYS QB 3.600 . 3.600 2.668 2.483 3.128 . 0 0 "[ . 1 . 2]" 1
1786 1 123 CYS H 1 124 CYS H 4.650 . 4.650 4.371 4.230 4.482 . 0 0 "[ . 1 . 2]" 1
1787 1 123 CYS HA 1 124 CYS H 3.430 . 3.430 2.362 2.238 2.536 . 0 0 "[ . 1 . 2]" 1
1788 1 123 CYS QB 1 124 CYS H 3.500 . 3.500 2.828 2.322 3.513 0.013 5 0 "[ . 1 . 2]" 1
1789 1 123 CYS HB2 1 124 CYS H 4.000 . 4.000 3.597 2.362 4.015 0.015 3 0 "[ . 1 . 2]" 1
1790 1 123 CYS HB3 1 124 CYS H 4.000 . 4.000 3.174 2.357 3.920 . 0 0 "[ . 1 . 2]" 1
1791 1 124 CYS H 1 124 CYS HB2 4.060 . 4.060 2.874 2.415 3.578 . 0 0 "[ . 1 . 2]" 1
1792 1 124 CYS H 1 124 CYS QB 3.440 . 3.440 2.521 2.380 2.675 . 0 0 "[ . 1 . 2]" 1
1793 1 124 CYS H 1 124 CYS HB3 4.060 . 4.060 3.264 2.595 3.604 . 0 0 "[ . 1 . 2]" 1
1794 1 124 CYS H 1 125 LEU H 5.090 . 5.090 4.518 4.312 4.579 . 0 0 "[ . 1 . 2]" 1
1795 1 124 CYS HB2 1 125 LEU H 4.200 . 4.200 3.591 2.554 4.221 0.021 1 0 "[ . 1 . 2]" 1
1796 1 124 CYS HB3 1 125 LEU H 4.200 . 4.200 3.356 2.758 4.030 . 0 0 "[ . 1 . 2]" 1
1797 1 125 LEU H 1 125 LEU MD1 4.410 . 4.410 3.881 3.608 4.091 . 0 0 "[ . 1 . 2]" 1
1798 1 125 LEU H 1 125 LEU MD2 4.410 . 4.410 3.793 3.072 4.276 . 0 0 "[ . 1 . 2]" 1
1799 1 125 LEU H 1 126 ARG H 5.450 . 5.450 4.413 3.974 4.618 . 0 0 "[ . 1 . 2]" 1
1800 1 125 LEU HA 1 125 LEU MD1 4.240 . 4.240 2.937 1.984 3.881 . 0 0 "[ . 1 . 2]" 1
1801 1 125 LEU HA 1 125 LEU QD 3.290 . 3.290 2.035 1.950 2.172 . 0 0 "[ . 1 . 2]" 1
1802 1 125 LEU HA 1 125 LEU MD2 4.240 . 4.240 2.952 1.956 3.914 . 0 0 "[ . 1 . 2]" 1
1803 1 125 LEU HA 1 126 ARG H 3.310 . 3.310 2.170 2.006 2.263 . 0 0 "[ . 1 . 2]" 1
1804 1 125 LEU QB 1 126 ARG H 4.070 . 4.070 3.576 3.136 3.947 . 0 0 "[ . 1 . 2]" 1
1805 1 125 LEU QD 1 126 ARG H 3.940 . 3.940 3.239 2.515 3.911 . 0 0 "[ . 1 . 2]" 1
1806 1 125 LEU QD 1 127 ILE MD 4.050 . 4.050 3.710 3.123 4.089 0.039 11 0 "[ . 1 . 2]" 1
1807 1 125 LEU QD 1 127 ILE QG 4.990 . 4.990 3.915 3.292 4.439 . 0 0 "[ . 1 . 2]" 1
1808 1 125 LEU QD 1 127 ILE MG 5.440 . 5.440 5.166 4.500 5.535 0.095 6 0 "[ . 1 . 2]" 1
1809 1 126 ARG H 1 126 ARG HB2 3.930 . 3.930 2.731 2.491 3.186 . 0 0 "[ . 1 . 2]" 1
1810 1 126 ARG H 1 126 ARG HB3 3.930 . 3.930 3.064 2.341 3.797 . 0 0 "[ . 1 . 2]" 1
1811 1 126 ARG H 1 127 ILE H 4.330 . 4.330 4.210 4.005 4.363 0.033 13 0 "[ . 1 . 2]" 1
1812 1 126 ARG HA 1 126 ARG HD2 4.200 . 4.200 2.790 1.984 4.228 0.028 13 0 "[ . 1 . 2]" 1
1813 1 126 ARG HA 1 126 ARG QD 3.670 . 3.670 2.303 1.868 3.164 . 0 0 "[ . 1 . 2]" 1
1814 1 126 ARG HA 1 126 ARG HD3 4.200 . 4.200 2.943 1.911 4.265 0.065 15 0 "[ . 1 . 2]" 1
1815 1 126 ARG HA 1 126 ARG HG2 3.890 . 3.890 3.360 2.422 3.913 0.023 2 0 "[ . 1 . 2]" 1
1816 1 126 ARG HA 1 126 ARG QG 3.160 . 3.160 2.914 2.388 3.144 . 0 0 "[ . 1 . 2]" 1
1817 1 126 ARG HA 1 126 ARG HG3 3.890 . 3.890 3.461 2.604 3.804 . 0 0 "[ . 1 . 2]" 1
1818 1 126 ARG HA 1 127 ILE H 3.020 . 3.020 2.100 1.990 2.213 . 0 0 "[ . 1 . 2]" 1
1819 1 126 ARG HA 1 127 ILE MD 4.720 . 4.720 3.433 2.549 4.780 0.060 2 0 "[ . 1 . 2]" 1
1820 1 126 ARG QB 1 126 ARG QD 3.240 . 3.240 2.449 2.271 2.905 . 0 0 "[ . 1 . 2]" 1
1821 1 126 ARG QB 1 127 ILE HA 5.340 . 5.340 4.689 4.184 5.030 . 0 0 "[ . 1 . 2]" 1
1822 1 126 ARG QD 1 127 ILE MD 5.140 . 5.140 4.435 3.236 5.278 0.138 10 0 "[ . 1 . 2]" 1
1823 1 126 ARG QG 1 127 ILE H 5.270 . 5.270 4.024 3.132 4.804 . 0 0 "[ . 1 . 2]" 1
1824 1 127 ILE H 1 127 ILE HB 3.370 . 3.370 2.584 2.443 2.764 . 0 0 "[ . 1 . 2]" 1
1825 1 127 ILE H 1 127 ILE MD 4.010 . 4.010 2.333 1.690 3.535 . 0 0 "[ . 1 . 2]" 1
1826 1 127 ILE H 1 127 ILE HG12 4.160 . 4.160 3.815 3.248 4.151 . 0 0 "[ . 1 . 2]" 1
1827 1 127 ILE H 1 127 ILE QG 3.350 . 3.350 2.854 1.877 3.384 0.034 7 0 "[ . 1 . 2]" 1
1828 1 127 ILE H 1 127 ILE HG13 4.160 . 4.160 2.986 1.889 3.600 . 0 0 "[ . 1 . 2]" 1
1829 1 127 ILE H 1 127 ILE MG 3.860 . 3.860 3.790 3.705 3.857 . 0 0 "[ . 1 . 2]" 1
1830 1 127 ILE HA 1 127 ILE MD 4.310 . 4.310 3.429 2.956 3.916 . 0 0 "[ . 1 . 2]" 1
1831 1 127 ILE HA 1 127 ILE HG12 4.050 . 4.050 3.431 2.590 3.800 . 0 0 "[ . 1 . 2]" 1
1832 1 127 ILE HA 1 127 ILE QG 3.550 . 3.550 2.524 2.451 2.705 . 0 0 "[ . 1 . 2]" 1
1833 1 127 ILE HA 1 127 ILE HG13 4.050 . 4.050 2.704 2.497 3.041 . 0 0 "[ . 1 . 2]" 1
1834 1 127 ILE HA 1 127 ILE MG 3.180 . 3.180 2.389 2.252 2.545 . 0 0 "[ . 1 . 2]" 1
1835 1 127 ILE HA 1 128 PRO QB 5.230 . 5.230 4.646 4.405 4.771 . 0 0 "[ . 1 . 2]" 1
1836 1 127 ILE HA 1 128 PRO QG 4.650 . 4.650 3.855 3.794 3.924 . 0 0 "[ . 1 . 2]" 1
1837 1 127 ILE HB 1 127 ILE MD 3.220 . 3.220 2.382 2.304 2.443 . 0 0 "[ . 1 . 2]" 1
1838 1 127 ILE QG 1 127 ILE MG 3.120 . 3.120 2.118 2.021 2.282 . 0 0 "[ . 1 . 2]" 1
1839 1 127 ILE HG12 1 127 ILE MG 3.670 . 3.670 2.226 2.131 2.335 . 0 0 "[ . 1 . 2]" 1
1840 1 127 ILE HG13 1 127 ILE MG 3.670 . 3.670 2.718 2.363 3.217 . 0 0 "[ . 1 . 2]" 1
1841 1 127 ILE MG 1 128 PRO HA 4.270 . 4.270 4.293 4.250 4.357 0.087 2 0 "[ . 1 . 2]" 1
1842 1 127 ILE MG 1 128 PRO QB 4.480 . 4.480 4.022 3.541 4.599 0.119 17 0 "[ . 1 . 2]" 1
1843 1 127 ILE MG 1 129 SER H 4.200 . 4.200 1.999 1.632 2.723 . 0 0 "[ . 1 . 2]" 1
1844 1 127 ILE MG 1 129 SER HB2 4.760 . 4.760 3.029 1.994 4.541 . 0 0 "[ . 1 . 2]" 1
1845 1 127 ILE MG 1 129 SER HB3 4.760 . 4.760 3.430 2.151 4.234 . 0 0 "[ . 1 . 2]" 1
1846 1 128 PRO HA 1 130 LYS H 4.490 . 4.490 4.026 3.669 4.497 0.007 1 0 "[ . 1 . 2]" 1
1847 1 128 PRO HB2 1 129 SER H 4.020 . 4.020 2.810 1.957 3.929 . 0 0 "[ . 1 . 2]" 1
1848 1 128 PRO HB3 1 129 SER H 4.020 . 4.020 3.953 3.503 4.181 0.161 4 0 "[ . 1 . 2]" 1
1849 1 128 PRO QG 1 129 SER H 3.770 . 3.770 3.358 2.394 3.843 0.073 10 0 "[ . 1 . 2]" 1
1850 1 129 SER H 1 129 SER HB2 3.760 . 3.760 3.057 2.432 3.902 0.142 20 0 "[ . 1 . 2]" 1
1851 1 129 SER H 1 129 SER HB3 3.760 . 3.760 3.423 2.478 3.900 0.140 17 0 "[ . 1 . 2]" 1
1852 1 129 SER H 1 130 LYS H 3.530 . 3.530 2.764 2.323 3.740 0.210 4 0 "[ . 1 . 2]" 1
1853 1 129 SER QB 1 130 LYS H 3.800 . 3.800 3.315 2.620 3.858 0.058 20 0 "[ . 1 . 2]" 1
1854 1 129 SER HB2 1 130 LYS H 4.320 . 4.320 3.892 2.845 4.393 0.073 9 0 "[ . 1 . 2]" 1
1855 1 129 SER HB3 1 130 LYS H 4.320 . 4.320 3.843 2.660 4.391 0.071 20 0 "[ . 1 . 2]" 1
1856 1 130 LYS H 1 130 LYS HB2 3.800 . 3.800 2.976 2.356 3.471 . 0 0 "[ . 1 . 2]" 1
1857 1 130 LYS H 1 130 LYS QB 3.240 . 3.240 2.605 2.325 2.916 . 0 0 "[ . 1 . 2]" 1
1858 1 130 LYS H 1 130 LYS HB3 3.800 . 3.800 3.131 2.521 3.821 0.021 7 0 "[ . 1 . 2]" 1
1859 1 130 LYS H 1 131 ASP H 4.240 . 4.240 4.110 3.389 4.326 0.086 4 0 "[ . 1 . 2]" 1
1860 1 130 LYS HA 1 130 LYS QD 3.840 . 3.840 2.693 1.948 3.905 0.065 4 0 "[ . 1 . 2]" 1
1861 1 130 LYS HA 1 130 LYS QE 4.520 . 4.520 3.903 2.038 4.575 0.055 8 0 "[ . 1 . 2]" 1
1862 1 130 LYS HA 1 130 LYS QG 3.700 . 3.700 2.732 2.360 3.062 . 0 0 "[ . 1 . 2]" 1
1863 1 130 LYS HA 1 131 ASP H 2.820 . 2.820 2.242 1.992 2.685 . 0 0 "[ . 1 . 2]" 1
1864 1 130 LYS QB 1 131 ASP H 3.910 . 3.910 3.229 1.655 3.958 0.048 2 0 "[ . 1 . 2]" 1
1865 1 130 LYS QD 1 131 ASP H 3.580 . 3.580 2.996 2.188 3.731 0.151 16 0 "[ . 1 . 2]" 1
1866 1 130 LYS QG 1 131 ASP H 4.270 . 4.270 3.446 1.808 4.323 0.053 17 0 "[ . 1 . 2]" 1
1867 1 131 ASP H 1 131 ASP HB2 3.780 . 3.780 3.018 2.366 3.820 0.040 5 0 "[ . 1 . 2]" 1
1868 1 131 ASP H 1 131 ASP QB 2.980 . 2.980 2.526 2.266 3.087 0.107 2 0 "[ . 1 . 2]" 1
1869 1 131 ASP H 1 131 ASP HB3 3.780 . 3.780 2.893 2.465 3.716 . 0 0 "[ . 1 . 2]" 1
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