NMR Restraints Grid
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NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
377592 |
1g9l   |
4915 | cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_1g9l
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 1682
_Distance_constraint_stats_list.Viol_count 4536
_Distance_constraint_stats_list.Viol_total 11900.518
_Distance_constraint_stats_list.Viol_max 0.970
_Distance_constraint_stats_list.Viol_rms 0.0450
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0079
_Distance_constraint_stats_list.Viol_average_violations_only 0.0875
_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 11 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 12 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 13 VAL 0.180 0.096 27 0 "[ . 1 . 2 . 3]"
1 14 ARG 0.174 0.165 7 0 "[ . 1 . 2 . 3]"
1 15 THR 0.022 0.022 29 0 "[ . 1 . 2 . 3]"
1 16 VAL 0.639 0.223 7 0 "[ . 1 . 2 . 3]"
1 17 PRO 0.853 0.332 26 0 "[ . 1 . 2 . 3]"
1 18 GLN 3.616 0.529 24 2 "[ - . 1 . 2 +. 3]"
1 19 TYR 4.000 0.420 8 0 "[ . 1 . 2 . 3]"
1 20 LYS 2.036 0.520 5 1 "[ + 1 . 2 . 3]"
1 21 TYR 0.110 0.071 12 0 "[ . 1 . 2 . 3]"
1 22 ALA 0.090 0.071 12 0 "[ . 1 . 2 . 3]"
1 23 ALA 0.000 0.000 6 0 "[ . 1 . 2 . 3]"
1 24 GLY 4.235 0.266 29 0 "[ . 1 . 2 . 3]"
1 25 VAL 6.577 0.266 20 0 "[ . 1 . 2 . 3]"
1 26 ARG 0.000 0.000 2 0 "[ . 1 . 2 . 3]"
1 27 ASN 0.006 0.006 19 0 "[ . 1 . 2 . 3]"
1 28 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 29 GLN 0.193 0.187 23 0 "[ . 1 . 2 . 3]"
1 30 GLN 1.321 0.734 6 2 "[ .+ 1- . 2 . 3]"
1 32 LEU 1.853 0.734 6 2 "[ .+ 1- . 2 . 3]"
1 33 ASN 0.531 0.331 7 0 "[ . 1 . 2 . 3]"
1 34 ALA 0.225 0.184 8 0 "[ . 1 . 2 . 3]"
1 35 GLN 0.432 0.184 8 0 "[ . 1 . 2 . 3]"
1 36 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 37 GLN 0.222 0.222 17 0 "[ . 1 . 2 . 3]"
1 38 VAL 1.051 0.221 12 0 "[ . 1 . 2 . 3]"
1 39 THR 0.014 0.014 10 0 "[ . 1 . 2 . 3]"
1 40 MET 0.209 0.085 25 0 "[ . 1 . 2 . 3]"
1 41 GLN 0.209 0.085 25 0 "[ . 1 . 2 . 3]"
1 42 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 43 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 44 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 45 VAL 2.787 0.439 25 0 "[ . 1 . 2 . 3]"
1 46 HIS 0.299 0.274 30 0 "[ . 1 . 2 . 3]"
1 47 VAL 0.206 0.068 1 0 "[ . 1 . 2 . 3]"
1 48 GLN 1.594 0.324 12 0 "[ . 1 . 2 . 3]"
1 49 GLY 4.598 0.455 17 0 "[ . 1 . 2 . 3]"
1 50 GLN 5.403 0.455 17 0 "[ . 1 . 2 . 3]"
1 51 GLU 1.088 0.191 16 0 "[ . 1 . 2 . 3]"
1 53 LEU 6.493 0.359 26 0 "[ . 1 . 2 . 3]"
1 54 THR 5.294 0.208 28 0 "[ . 1 . 2 . 3]"
1 55 ALA 2.543 0.094 27 0 "[ . 1 . 2 . 3]"
1 56 SER 3.516 0.564 23 2 "[ . 1- . 2 + . 3]"
1 57 MET 6.206 0.453 26 0 "[ . 1 . 2 . 3]"
1 58 LEU 3.121 0.112 28 0 "[ . 1 . 2 . 3]"
1 59 ALA 8.558 0.564 23 2 "[ . 1- . 2 + . 3]"
1 60 SER 0.355 0.043 28 0 "[ . 1 . 2 . 3]"
1 61 ALA 0.849 0.084 7 0 "[ . 1 . 2 . 3]"
1 64 GLN 5.298 0.260 1 0 "[ . 1 . 2 . 3]"
1 65 GLU 6.435 0.260 1 0 "[ . 1 . 2 . 3]"
1 66 GLN 6.540 0.314 26 0 "[ . 1 . 2 . 3]"
1 67 LYS 22.125 0.776 27 14 "[*** ** **1- *. 2** * +* 3]"
1 68 GLN 2.847 0.362 7 0 "[ . 1 . 2 . 3]"
1 69 MET 2.257 0.362 7 0 "[ . 1 . 2 . 3]"
1 70 LEU 16.718 0.795 25 8 "[ . * *-* . *2* + *3]"
1 71 GLY 17.952 0.636 10 6 "[ . * + * . *2- . *3]"
1 72 GLU 2.773 0.210 19 0 "[ . 1 . 2 . 3]"
1 73 ARG 6.292 0.379 13 0 "[ . 1 . 2 . 3]"
1 74 LEU 6.489 0.453 20 0 "[ . 1 . 2 . 3]"
1 75 PHE 4.842 0.379 13 0 "[ . 1 . 2 . 3]"
1 77 LEU 19.208 0.431 14 0 "[ . 1 . 2 . 3]"
1 78 ILE 18.787 0.431 14 0 "[ . 1 . 2 . 3]"
1 79 GLN 5.051 0.190 21 0 "[ . 1 . 2 . 3]"
1 80 ALA 5.479 0.172 19 0 "[ . 1 . 2 . 3]"
1 81 MET 17.777 0.926 6 6 "[ .+ 1 * *.* 2 * - 3]"
1 82 HIS 17.382 0.655 30 2 "[ . 1 . 2 - . +]"
1 84 THR 2.490 0.172 19 0 "[ . 1 . 2 . 3]"
1 85 LEU 3.979 0.655 30 2 "[ . 1 . 2 - . +]"
1 86 ALA 7.916 0.202 30 0 "[ . 1 . 2 . 3]"
1 87 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 88 LYS 6.840 0.347 17 0 "[ . 1 . 2 . 3]"
1 89 ILE 21.235 0.310 17 0 "[ . 1 . 2 . 3]"
1 90 THR 19.626 0.443 6 0 "[ . 1 . 2 . 3]"
1 91 GLY 0.251 0.050 16 0 "[ . 1 . 2 . 3]"
1 92 MET 22.307 0.819 7 6 "[ *. + 1 - .* 2 * * 3]"
1 93 LEU 15.765 0.347 3 0 "[ . 1 . 2 . 3]"
1 94 LEU 4.605 0.158 13 0 "[ . 1 . 2 . 3]"
1 95 GLU 2.864 0.070 22 0 "[ . 1 . 2 . 3]"
1 96 ILE 19.147 0.185 21 0 "[ . 1 . 2 . 3]"
1 97 ASP 6.104 0.141 25 0 "[ . 1 . 2 . 3]"
1 98 ASN 4.398 0.138 17 0 "[ . 1 . 2 . 3]"
1 99 SER 2.500 0.098 11 0 "[ . 1 . 2 . 3]"
1 100 GLU 15.029 0.247 8 0 "[ . 1 . 2 . 3]"
1 101 LEU 4.020 0.373 11 0 "[ . 1 . 2 . 3]"
1 102 LEU 1.782 0.241 8 0 "[ . 1 . 2 . 3]"
1 103 HIS 8.195 0.247 8 0 "[ . 1 . 2 . 3]"
1 104 MET 8.903 0.795 25 2 "[ . 1- . 2 + 3]"
1 105 LEU 4.868 0.336 25 0 "[ . 1 . 2 . 3]"
1 106 GLU 15.312 0.600 10 6 "[* . +* *. - 2 .* 3]"
1 107 SER 10.577 0.288 27 0 "[ . 1 . 2 . 3]"
1 109 GLU 5.715 0.858 25 4 "[ .- 1 * *. 2 + 3]"
1 110 SER 12.664 0.288 27 0 "[ . 1 . 2 . 3]"
1 111 LEU 5.298 0.111 29 0 "[ . 1 . 2 . 3]"
1 112 ARG 15.975 0.926 6 7 "[ * .+ 1 * *.* 2 * * 3]"
1 113 SER 0.164 0.131 28 0 "[ . 1 . 2 . 3]"
1 114 LYS 2.652 0.540 27 1 "[ . 1 . 2 . + 3]"
1 115 VAL 21.390 0.485 7 0 "[ . 1 . 2 . 3]"
1 116 ASP 7.669 0.154 30 0 "[ . 1 . 2 . 3]"
1 117 GLU 22.043 0.970 12 10 "[* ** 1 +* .** 2** * 3]"
1 118 ALA 3.214 0.224 27 0 "[ . 1 . 2 . 3]"
1 119 VAL 22.427 0.841 20 4 "[ * . 1 - * + . 3]"
1 120 ALA 14.710 0.970 12 6 "[* .* 1 +- .* 2 * . 3]"
1 121 VAL 8.165 0.109 12 0 "[ . 1 . 2 . 3]"
1 122 LEU 5.981 0.415 22 0 "[ . 1 . 2 . 3]"
1 123 GLN 19.575 0.841 20 4 "[ * . 1 - * + . 3]"
1 124 ALA 5.816 0.212 2 0 "[ . 1 . 2 . 3]"
1 125 HIS 5.307 0.519 11 1 "[ . 1+ . 2 . 3]"
1 126 GLN 0.924 0.166 4 0 "[ . 1 . 2 . 3]"
1 128 LYS 6.048 0.519 11 1 "[ . 1+ . 2 . 3]"
1 129 GLU 7.021 0.316 30 0 "[ . 1 . 2 . 3]"
1 130 ALA 3.381 0.412 23 0 "[ . 1 . 2 . 3]"
1 131 ALA 0.128 0.059 3 0 "[ . 1 . 2 . 3]"
1 132 GLN 2.447 0.545 12 1 "[ . 1 + . 2 . 3]"
1 133 LYS 0.725 0.298 6 0 "[ . 1 . 2 . 3]"
1 134 ALA 0.725 0.298 6 0 "[ . 1 . 2 . 3]"
1 135 VAL 1.506 0.240 15 0 "[ . 1 . 2 . 3]"
1 136 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 137 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 138 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 142 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 143 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 144 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
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 11 PRO HB2 1 12 ALA H 4.200 . 5.500 3.535 2.237 4.349 . 0 0 "[ . 1 . 2 . 3]" 1
2 1 11 PRO HB2 1 13 VAL H 3.600 . 5.200 3.765 2.203 5.154 . 0 0 "[ . 1 . 2 . 3]" 1
3 1 12 ALA H 1 13 VAL H 3.700 . 5.400 2.881 2.121 4.205 . 0 0 "[ . 1 . 2 . 3]" 1
4 1 12 ALA HA 1 13 VAL H 2.400 . 5.500 3.084 2.207 3.570 . 0 0 "[ . 1 . 2 . 3]" 1
5 1 12 ALA MB 1 13 VAL H 3.200 . 4.500 3.171 2.065 3.708 . 0 0 "[ . 1 . 2 . 3]" 1
6 1 13 VAL H 1 13 VAL HB 2.700 . 3.600 3.035 2.633 3.620 0.020 25 0 "[ . 1 . 2 . 3]" 1
7 1 13 VAL H 1 13 VAL MG1 2.900 . 4.000 3.128 1.704 3.866 0.096 27 0 "[ . 1 . 2 . 3]" 1
8 1 13 VAL H 1 14 ARG H 3.800 . 5.500 4.118 2.377 4.602 . 0 0 "[ . 1 . 2 . 3]" 1
9 1 13 VAL HA 1 14 ARG H 2.700 . 3.600 2.388 2.144 3.495 . 0 0 "[ . 1 . 2 . 3]" 1
10 1 13 VAL HB 1 14 ARG H 4.200 . 5.500 3.763 2.108 4.430 . 0 0 "[ . 1 . 2 . 3]" 1
11 1 13 VAL MG1 1 14 ARG H 3.600 . 5.200 3.400 2.023 4.353 . 0 0 "[ . 1 . 2 . 3]" 1
12 1 14 ARG H 1 14 ARG HB2 3.300 . 4.700 2.602 2.084 3.654 . 0 0 "[ . 1 . 2 . 3]" 1
13 1 14 ARG H 1 14 ARG HB3 3.700 . 5.400 3.153 2.582 3.670 . 0 0 "[ . 1 . 2 . 3]" 1
14 1 14 ARG H 1 14 ARG HG2 4.000 . 5.500 3.833 1.835 4.749 0.165 7 0 "[ . 1 . 2 . 3]" 1
15 1 14 ARG HA 1 15 THR H 2.800 . 3.800 2.669 2.137 3.571 . 0 0 "[ . 1 . 2 . 3]" 1
16 1 14 ARG HB2 1 15 THR H 4.400 . 5.500 3.848 2.068 4.660 . 0 0 "[ . 1 . 2 . 3]" 1
17 1 14 ARG HB3 1 15 THR H 4.700 . 5.500 3.666 2.132 4.601 . 0 0 "[ . 1 . 2 . 3]" 1
18 1 15 THR H 1 15 THR HB 3.700 . 5.400 3.244 2.624 3.722 . 0 0 "[ . 1 . 2 . 3]" 1
19 1 15 THR H 1 15 THR MG 4.400 . 5.500 3.115 2.000 3.817 0.000 12 0 "[ . 1 . 2 . 3]" 1
20 1 15 THR HA 1 16 VAL H 2.300 . 3.000 2.330 2.136 3.022 0.022 29 0 "[ . 1 . 2 . 3]" 1
21 1 15 THR HB 1 16 VAL H 3.600 . 5.200 3.542 2.010 4.602 . 0 0 "[ . 1 . 2 . 3]" 1
22 1 15 THR MG 1 16 VAL H 3.700 . 5.400 3.467 2.164 4.439 . 0 0 "[ . 1 . 2 . 3]" 1
23 1 16 VAL H 1 16 VAL HB 2.900 . 4.000 3.150 2.587 3.681 . 0 0 "[ . 1 . 2 . 3]" 1
24 1 16 VAL H 1 16 VAL QG 2.800 . 3.800 1.990 1.577 2.495 0.223 7 0 "[ . 1 . 2 . 3]" 1
25 1 16 VAL QG 1 18 GLN H 4.800 . 5.500 4.137 1.881 5.367 0.019 30 0 "[ . 1 . 2 . 3]" 1
26 1 17 PRO HG2 1 18 GLN H 3.900 . 5.500 4.227 1.997 5.832 0.332 26 0 "[ . 1 . 2 . 3]" 1
27 1 18 GLN H 1 18 GLN HA 3.000 . 4.100 2.887 2.844 2.933 . 0 0 "[ . 1 . 2 . 3]" 1
28 1 18 GLN H 1 18 GLN HB3 2.800 . 3.800 3.400 2.749 3.699 . 0 0 "[ . 1 . 2 . 3]" 1
29 1 18 GLN H 1 18 GLN HG2 3.000 . 4.100 3.497 1.774 4.629 0.529 24 2 "[ - . 1 . 2 +. 3]" 1
30 1 18 GLN H 1 19 TYR H 3.400 . 4.800 4.385 3.514 4.627 . 0 0 "[ . 1 . 2 . 3]" 1
31 1 18 GLN HA 1 19 TYR H 2.200 . 2.800 2.392 2.139 2.793 . 0 0 "[ . 1 . 2 . 3]" 1
32 1 18 GLN HG3 1 19 TYR H 3.900 . 5.500 4.617 2.992 5.798 0.298 26 0 "[ . 1 . 2 . 3]" 1
33 1 19 TYR H 1 19 TYR HB3 2.600 . 3.400 3.272 2.740 3.615 0.215 20 0 "[ . 1 . 2 . 3]" 1
34 1 19 TYR H 1 19 TYR QD 3.900 . 5.500 3.136 2.144 4.140 . 0 0 "[ . 1 . 2 . 3]" 1
35 1 19 TYR HA 1 20 LYS H 2.600 . 3.400 2.650 2.139 3.491 0.091 8 0 "[ . 1 . 2 . 3]" 1
36 1 19 TYR HB3 1 20 LYS H 3.400 . 4.800 3.087 1.580 4.508 0.420 8 0 "[ . 1 . 2 . 3]" 1
37 1 20 LYS H 1 20 LYS HB3 2.800 . 3.800 3.182 2.549 3.692 . 0 0 "[ . 1 . 2 . 3]" 1
38 1 20 LYS H 1 20 LYS HG3 3.500 . 5.000 3.522 1.480 4.565 0.520 5 1 "[ + 1 . 2 . 3]" 1
39 1 20 LYS HA 1 21 TYR H 2.400 . 3.100 2.453 2.139 3.117 0.017 5 0 "[ . 1 . 2 . 3]" 1
40 1 21 TYR H 1 21 TYR HA 3.000 . 4.100 2.879 2.815 2.920 . 0 0 "[ . 1 . 2 . 3]" 1
41 1 21 TYR H 1 21 TYR HB2 2.800 . 3.800 2.360 2.084 3.589 . 0 0 "[ . 1 . 2 . 3]" 1
42 1 21 TYR H 1 21 TYR HB3 2.900 . 4.000 3.313 2.559 3.646 . 0 0 "[ . 1 . 2 . 3]" 1
43 1 21 TYR H 1 21 TYR QD 3.800 . 5.500 3.243 2.426 4.236 . 0 0 "[ . 1 . 2 . 3]" 1
44 1 21 TYR H 1 22 ALA H 3.400 . 4.800 3.722 2.262 4.621 . 0 0 "[ . 1 . 2 . 3]" 1
45 1 21 TYR HA 1 22 ALA H 2.600 . 3.400 2.579 2.142 3.471 0.071 12 0 "[ . 1 . 2 . 3]" 1
46 1 21 TYR HB2 1 22 ALA H 3.500 . 5.000 4.230 3.201 4.673 . 0 0 "[ . 1 . 2 . 3]" 1
47 1 21 TYR HB3 1 22 ALA H 3.600 . 5.200 3.710 2.180 4.533 . 0 0 "[ . 1 . 2 . 3]" 1
48 1 21 TYR QD 1 22 ALA H 4.100 . 5.500 4.235 2.245 5.012 . 0 0 "[ . 1 . 2 . 3]" 1
49 1 22 ALA H 1 22 ALA MB 2.800 . 3.800 2.184 2.063 2.310 . 0 0 "[ . 1 . 2 . 3]" 1
50 1 23 ALA H 1 23 ALA MB 2.500 . 3.300 2.147 2.038 2.312 . 0 0 "[ . 1 . 2 . 3]" 1
51 1 23 ALA HA 1 24 GLY H 3.000 . 4.100 2.444 2.144 3.487 . 0 0 "[ . 1 . 2 . 3]" 1
52 1 23 ALA HA 1 25 VAL H 4.200 . 5.500 4.332 3.054 5.500 . 6 0 "[ . 1 . 2 . 3]" 1
53 1 23 ALA MB 1 24 GLY H 4.100 . 5.500 3.150 2.128 3.723 . 0 0 "[ . 1 . 2 . 3]" 1
54 1 24 GLY H 1 24 GLY HA3 2.800 . 3.800 2.355 2.311 2.415 . 0 0 "[ . 1 . 2 . 3]" 1
55 1 24 GLY H 1 25 VAL H 3.700 . 5.400 3.229 2.215 4.320 . 0 0 "[ . 1 . 2 . 3]" 1
56 1 24 GLY HA3 1 25 VAL H 2.500 . 3.300 3.302 2.162 3.566 0.266 29 0 "[ . 1 . 2 . 3]" 1
57 1 25 VAL H 1 25 VAL HB 2.800 . 3.800 3.136 2.569 3.704 . 0 0 "[ . 1 . 2 . 3]" 1
58 1 25 VAL H 1 25 VAL MG1 2.700 . 3.600 3.057 1.934 3.866 0.266 20 0 "[ . 1 . 2 . 3]" 1
59 1 25 VAL H 1 26 ARG H 3.500 . 5.000 3.414 2.000 4.584 0.000 2 0 "[ . 1 . 2 . 3]" 1
60 1 25 VAL HA 1 26 ARG H 2.800 . 3.800 2.770 2.140 3.570 . 0 0 "[ . 1 . 2 . 3]" 1
61 1 25 VAL HB 1 26 ARG H 3.900 . 5.500 3.615 2.028 4.587 . 0 0 "[ . 1 . 2 . 3]" 1
62 1 25 VAL MG2 1 26 ARG H 3.700 . 5.400 3.545 2.002 4.329 . 0 0 "[ . 1 . 2 . 3]" 1
63 1 26 ARG H 1 26 ARG HB3 3.000 . 4.100 3.245 2.488 3.676 . 0 0 "[ . 1 . 2 . 3]" 1
64 1 26 ARG H 1 26 ARG HG2 4.400 . 5.500 3.890 2.024 4.755 . 0 0 "[ . 1 . 2 . 3]" 1
65 1 26 ARG HA 1 27 ASN H 3.500 . 5.000 2.657 2.140 3.568 . 0 0 "[ . 1 . 2 . 3]" 1
66 1 27 ASN H 1 27 ASN HB3 4.300 . 5.500 3.433 2.738 3.675 . 0 0 "[ . 1 . 2 . 3]" 1
67 1 27 ASN HA 1 29 GLN H 4.400 . 5.500 4.603 3.013 5.506 0.006 19 0 "[ . 1 . 2 . 3]" 1
68 1 28 PRO HA 1 29 GLN H 2.700 . 3.600 2.838 2.157 3.574 . 0 0 "[ . 1 . 2 . 3]" 1
69 1 29 GLN H 1 29 GLN HA 3.000 . 4.100 2.906 2.855 2.932 . 0 0 "[ . 1 . 2 . 3]" 1
70 1 29 GLN H 1 29 GLN HB2 2.800 . 3.800 2.486 2.127 3.675 . 0 0 "[ . 1 . 2 . 3]" 1
71 1 29 GLN H 1 29 GLN HB3 3.400 . 4.800 3.247 2.484 3.673 . 0 0 "[ . 1 . 2 . 3]" 1
72 1 29 GLN H 1 29 GLN HG3 3.400 . 4.800 3.581 1.813 4.529 0.187 23 0 "[ . 1 . 2 . 3]" 1
73 1 29 GLN H 1 30 GLN H 3.700 . 5.400 3.852 2.347 4.614 . 0 0 "[ . 1 . 2 . 3]" 1
74 1 29 GLN HA 1 30 GLN H 3.000 . 4.100 2.622 2.140 3.557 . 0 0 "[ . 1 . 2 . 3]" 1
75 1 30 GLN H 1 30 GLN HB2 3.600 . 5.200 2.510 2.140 3.620 . 0 0 "[ . 1 . 2 . 3]" 1
76 1 30 GLN H 1 30 GLN HB3 3.000 . 4.100 3.326 2.597 3.676 . 0 0 "[ . 1 . 2 . 3]" 1
77 1 30 GLN H 1 32 LEU H 4.600 . 5.500 4.755 3.216 5.509 0.009 5 0 "[ . 1 . 2 . 3]" 1
78 1 30 GLN HB3 1 32 LEU H 2.700 . 3.600 3.103 2.076 4.334 0.734 6 2 "[ .+ 1- . 2 . 3]" 1
79 1 32 LEU H 1 32 LEU HA 3.000 . 4.100 2.897 2.842 2.930 . 0 0 "[ . 1 . 2 . 3]" 1
80 1 32 LEU HA 1 33 ASN H 3.200 . 4.500 2.644 2.137 3.570 . 0 0 "[ . 1 . 2 . 3]" 1
81 1 32 LEU HB3 1 33 ASN H 4.600 . 5.500 3.441 1.669 4.391 0.331 7 0 "[ . 1 . 2 . 3]" 1
82 1 33 ASN H 1 33 ASN HB2 3.800 . 5.500 2.740 2.139 3.619 . 0 0 "[ . 1 . 2 . 3]" 1
83 1 33 ASN H 1 33 ASN HB3 4.400 . 5.500 3.356 2.396 3.729 . 0 0 "[ . 1 . 2 . 3]" 1
84 1 33 ASN HA 1 34 ALA H 2.800 . 3.800 2.621 2.141 3.567 . 0 0 "[ . 1 . 2 . 3]" 1
85 1 34 ALA H 1 34 ALA MB 3.400 . 4.800 2.208 2.095 2.333 . 0 0 "[ . 1 . 2 . 3]" 1
86 1 34 ALA HA 1 35 GLN H 2.500 . 3.300 2.609 2.141 3.484 0.184 8 0 "[ . 1 . 2 . 3]" 1
87 1 34 ALA MB 1 35 GLN H 3.400 . 4.800 3.089 1.971 3.721 0.029 8 0 "[ . 1 . 2 . 3]" 1
88 1 35 GLN H 1 35 GLN HB2 2.900 . 4.000 2.491 2.115 3.644 . 0 0 "[ . 1 . 2 . 3]" 1
89 1 35 GLN H 1 35 GLN HB3 3.400 . 4.800 3.280 2.456 3.718 . 0 0 "[ . 1 . 2 . 3]" 1
90 1 35 GLN H 1 35 GLN HG2 3.600 . 5.200 3.749 1.835 4.761 0.165 3 0 "[ . 1 . 2 . 3]" 1
91 1 36 PRO HA 1 37 GLN H 2.700 . 3.600 2.716 2.148 3.572 . 0 0 "[ . 1 . 2 . 3]" 1
92 1 37 GLN H 1 37 GLN HA 3.000 . 4.100 2.900 2.842 2.935 . 0 0 "[ . 1 . 2 . 3]" 1
93 1 37 GLN H 1 37 GLN HB2 3.000 . 4.100 2.497 2.086 3.679 . 0 0 "[ . 1 . 2 . 3]" 1
94 1 37 GLN H 1 37 GLN HB3 3.400 . 4.800 3.294 2.434 3.699 . 0 0 "[ . 1 . 2 . 3]" 1
95 1 37 GLN H 1 37 GLN HG2 3.600 . 5.200 3.638 1.778 4.699 0.222 17 0 "[ . 1 . 2 . 3]" 1
96 1 37 GLN H 1 38 VAL H 4.000 . 5.500 4.171 2.657 4.593 . 0 0 "[ . 1 . 2 . 3]" 1
97 1 37 GLN HA 1 38 VAL H 2.300 . 3.000 2.408 2.138 2.992 . 0 0 "[ . 1 . 2 . 3]" 1
98 1 37 GLN HB2 1 38 VAL H 4.100 . 5.500 4.091 2.832 4.604 . 0 0 "[ . 1 . 2 . 3]" 1
99 1 38 VAL H 1 38 VAL HB 2.700 . 3.600 3.052 2.609 3.630 0.030 28 0 "[ . 1 . 2 . 3]" 1
100 1 38 VAL H 1 38 VAL MG2 2.800 . 3.800 2.482 1.579 3.851 0.221 12 0 "[ . 1 . 2 . 3]" 1
101 1 38 VAL HB 1 39 THR H 3.700 . 5.400 3.856 2.000 4.513 0.000 7 0 "[ . 1 . 2 . 3]" 1
102 1 38 VAL MG1 1 39 THR H 3.500 . 5.000 3.555 1.986 4.380 0.014 10 0 "[ . 1 . 2 . 3]" 1
103 1 39 THR H 1 39 THR HB 2.500 . 3.300 2.942 2.587 3.244 . 0 0 "[ . 1 . 2 . 3]" 1
104 1 39 THR H 1 39 THR MG 3.600 . 5.200 3.501 2.068 3.866 . 0 0 "[ . 1 . 2 . 3]" 1
105 1 39 THR HB 1 40 MET H 3.900 . 5.500 3.661 2.174 4.352 . 0 0 "[ . 1 . 2 . 3]" 1
106 1 39 THR MG 1 40 MET H 4.000 . 5.500 3.614 2.450 4.452 . 0 0 "[ . 1 . 2 . 3]" 1
107 1 40 MET H 1 40 MET HB2 3.300 . 4.700 2.574 2.149 3.660 . 0 0 "[ . 1 . 2 . 3]" 1
108 1 40 MET H 1 40 MET HB3 2.900 . 4.000 3.178 2.635 3.664 . 0 0 "[ . 1 . 2 . 3]" 1
109 1 40 MET H 1 40 MET HG3 4.400 . 5.500 3.716 2.025 4.561 . 0 0 "[ . 1 . 2 . 3]" 1
110 1 40 MET HA 1 41 GLN H 2.600 . 3.400 2.695 2.139 3.485 0.085 25 0 "[ . 1 . 2 . 3]" 1
111 1 41 GLN H 1 41 GLN HB2 3.200 . 4.500 3.036 2.067 3.925 . 0 0 "[ . 1 . 2 . 3]" 1
112 1 41 GLN H 1 41 GLN HB3 3.300 . 4.700 3.465 2.597 4.093 . 0 0 "[ . 1 . 2 . 3]" 1
113 1 41 GLN H 1 41 GLN HG3 4.000 . 5.500 3.841 2.250 4.799 . 0 0 "[ . 1 . 2 . 3]" 1
114 1 41 GLN H 1 42 GLN H 3.600 . 5.200 3.956 2.198 4.645 . 0 0 "[ . 1 . 2 . 3]" 1
115 1 41 GLN HA 1 42 GLN H 2.400 . 3.100 2.397 2.141 3.031 . 0 0 "[ . 1 . 2 . 3]" 1
116 1 41 GLN HB2 1 42 GLN H 3.100 . 5.500 3.959 1.719 4.662 . 0 0 "[ . 1 . 2 . 3]" 1
117 1 43 PRO HA 1 44 ALA H 2.200 . 2.800 2.300 2.146 2.663 . 0 0 "[ . 1 . 2 . 3]" 1
118 1 43 PRO HB3 1 44 ALA H 3.700 . 5.400 3.840 2.584 4.530 . 0 0 "[ . 1 . 2 . 3]" 1
119 1 44 ALA H 1 44 ALA HA 3.000 . 4.100 2.872 2.807 2.911 . 0 0 "[ . 1 . 2 . 3]" 1
120 1 44 ALA H 1 44 ALA MB 2.500 . 3.300 2.177 2.056 2.295 . 0 0 "[ . 1 . 2 . 3]" 1
121 1 44 ALA H 1 45 VAL H 3.400 . 4.800 4.264 3.221 4.639 . 0 0 "[ . 1 . 2 . 3]" 1
122 1 44 ALA HA 1 45 VAL H 2.200 . 2.800 2.335 2.140 2.770 . 0 0 "[ . 1 . 2 . 3]" 1
123 1 44 ALA MB 1 45 VAL H 2.800 . 3.800 3.128 2.179 3.721 . 0 0 "[ . 1 . 2 . 3]" 1
124 1 45 VAL H 1 45 VAL HB 2.700 . 3.600 3.288 2.580 3.637 0.037 2 0 "[ . 1 . 2 . 3]" 1
125 1 45 VAL H 1 45 VAL MG1 2.600 . 3.400 2.881 1.786 3.839 0.439 25 0 "[ . 1 . 2 . 3]" 1
126 1 45 VAL H 1 46 HIS H 4.400 . 5.500 3.687 2.107 4.602 . 0 0 "[ . 1 . 2 . 3]" 1
127 1 45 VAL HA 1 46 HIS H 2.900 . 4.000 2.664 2.154 3.571 . 0 0 "[ . 1 . 2 . 3]" 1
128 1 45 VAL MG2 1 46 HIS H 4.300 . 5.500 3.500 1.726 4.456 0.274 30 0 "[ . 1 . 2 . 3]" 1
129 1 46 HIS H 1 46 HIS HA 2.600 . 3.400 2.919 2.880 2.944 . 0 0 "[ . 1 . 2 . 3]" 1
130 1 46 HIS H 1 46 HIS HB2 3.800 . 5.500 2.635 2.134 3.733 . 0 0 "[ . 1 . 2 . 3]" 1
131 1 46 HIS H 1 46 HIS HB3 4.200 . 5.500 3.308 2.627 3.696 . 0 0 "[ . 1 . 2 . 3]" 1
132 1 46 HIS HB3 1 47 VAL H 3.400 . 4.800 3.692 2.207 4.538 . 0 0 "[ . 1 . 2 . 3]" 1
133 1 47 VAL H 1 47 VAL HB 2.800 . 3.800 3.087 2.544 3.703 . 0 0 "[ . 1 . 2 . 3]" 1
134 1 47 VAL H 1 47 VAL QG 2.900 . 4.000 2.062 1.732 2.426 0.068 1 0 "[ . 1 . 2 . 3]" 1
135 1 47 VAL H 1 48 GLN H 4.000 . 5.500 4.234 2.451 4.599 . 0 0 "[ . 1 . 2 . 3]" 1
136 1 47 VAL HA 1 48 GLN H 2.300 . 3.000 2.433 2.153 3.042 0.042 29 0 "[ . 1 . 2 . 3]" 1
137 1 47 VAL QG 1 48 GLN H 3.100 . 4.300 2.712 1.837 3.754 0.063 13 0 "[ . 1 . 2 . 3]" 1
138 1 47 VAL QG 1 50 GLN H 4.000 . 5.000 4.158 2.251 4.945 . 0 0 "[ . 1 . 2 . 3]" 1
139 1 48 GLN H 1 48 GLN HA 2.900 . 4.000 2.885 2.830 2.928 . 0 0 "[ . 1 . 2 . 3]" 1
140 1 48 GLN H 1 48 GLN HB2 2.700 . 3.600 2.541 2.123 3.647 0.047 4 0 "[ . 1 . 2 . 3]" 1
141 1 48 GLN H 1 48 GLN HB3 3.000 . 4.100 3.167 2.519 3.674 . 0 0 "[ . 1 . 2 . 3]" 1
142 1 48 GLN H 1 48 GLN HG3 3.400 . 4.800 3.542 2.005 4.666 . 0 0 "[ . 1 . 2 . 3]" 1
143 1 48 GLN HA 1 49 GLY H 2.700 . 3.600 3.052 2.153 3.571 . 0 0 "[ . 1 . 2 . 3]" 1
144 1 48 GLN HB3 1 49 GLY H 3.800 . 5.500 3.289 1.676 4.657 0.324 12 0 "[ . 1 . 2 . 3]" 1
145 1 48 GLN HG2 1 49 GLY H 4.000 . 5.500 4.254 2.368 5.817 0.317 17 0 "[ . 1 . 2 . 3]" 1
146 1 49 GLY H 1 49 GLY HA2 2.500 . 3.300 2.907 2.855 2.941 . 0 0 "[ . 1 . 2 . 3]" 1
147 1 49 GLY H 1 50 GLN H 3.200 . 4.500 3.575 2.255 4.546 0.046 6 0 "[ . 1 . 2 . 3]" 1
148 1 49 GLY HA2 1 50 GLN H 2.400 . 3.100 2.767 2.133 3.555 0.455 17 0 "[ . 1 . 2 . 3]" 1
149 1 50 GLN H 1 50 GLN HA 3.000 . 4.100 2.923 2.892 2.942 . 0 0 "[ . 1 . 2 . 3]" 1
150 1 50 GLN H 1 50 GLN HB2 2.600 . 3.400 2.758 2.189 3.626 0.226 17 0 "[ . 1 . 2 . 3]" 1
151 1 50 GLN H 1 50 GLN HB3 2.700 . 3.600 3.391 2.758 3.654 0.054 13 0 "[ . 1 . 2 . 3]" 1
152 1 50 GLN H 1 50 GLN HG3 2.900 . 4.000 3.107 1.845 4.337 0.337 26 0 "[ . 1 . 2 . 3]" 1
153 1 50 GLN H 1 51 GLU H 3.200 . 5.500 4.096 2.929 4.590 . 0 0 "[ . 1 . 2 . 3]" 1
154 1 50 GLN HA 1 51 GLU H 2.200 . 2.800 2.356 2.139 2.817 0.017 20 0 "[ . 1 . 2 . 3]" 1
155 1 51 GLU H 1 51 GLU HA 2.700 . 3.600 2.875 2.815 2.913 . 0 0 "[ . 1 . 2 . 3]" 1
156 1 51 GLU H 1 51 GLU HB2 2.600 . 3.400 2.554 2.084 3.591 0.191 16 0 "[ . 1 . 2 . 3]" 1
157 1 51 GLU H 1 51 GLU HB3 2.700 . 3.600 3.289 2.662 3.626 0.026 30 0 "[ . 1 . 2 . 3]" 1
158 1 53 LEU H 1 54 THR H 3.300 . 4.700 4.586 4.537 4.635 . 0 0 "[ . 1 . 2 . 3]" 1
159 1 53 LEU HA 1 53 LEU QB 2.200 . 2.800 2.523 2.499 2.539 . 0 0 "[ . 1 . 2 . 3]" 1
160 1 53 LEU HA 1 53 LEU QD 2.200 . 3.400 2.514 1.790 2.962 0.010 14 0 "[ . 1 . 2 . 3]" 1
161 1 53 LEU HA 1 54 THR H 2.000 . 2.500 2.241 2.180 2.317 . 0 0 "[ . 1 . 2 . 3]" 1
162 1 53 LEU HA 1 54 THR MG 3.200 . 5.500 4.942 4.683 5.298 . 0 0 "[ . 1 . 2 . 3]" 1
163 1 53 LEU HA 1 57 MET QB 3.700 . 5.400 2.784 2.528 3.450 . 0 0 "[ . 1 . 2 . 3]" 1
164 1 53 LEU HA 1 57 MET ME 2.500 . 3.300 3.018 2.538 3.299 . 0 0 "[ . 1 . 2 . 3]" 1
165 1 53 LEU QB 1 53 LEU QD 2.200 . 2.800 1.839 1.697 2.049 0.103 11 0 "[ . 1 . 2 . 3]" 1
166 1 53 LEU QB 1 54 THR H 2.600 . 3.400 3.263 3.139 3.336 . 0 0 "[ . 1 . 2 . 3]" 1
167 1 53 LEU QB 1 54 THR HA 3.900 . 5.500 3.916 3.858 3.975 . 0 0 "[ . 1 . 2 . 3]" 1
168 1 53 LEU QB 1 54 THR MG 3.600 . 5.200 4.624 4.443 5.017 . 0 0 "[ . 1 . 2 . 3]" 1
169 1 53 LEU QB 1 57 MET ME 3.500 . 5.500 4.632 4.411 4.844 . 0 0 "[ . 1 . 2 . 3]" 1
170 1 53 LEU QB 1 58 LEU QD 3.200 . 4.500 4.019 3.679 4.159 . 0 0 "[ . 1 . 2 . 3]" 1
171 1 53 LEU QB 1 74 LEU QD 2.300 . 3.000 1.761 1.441 1.921 0.359 26 0 "[ . 1 . 2 . 3]" 1
172 1 53 LEU QB 1 77 LEU QD . . 2.800 1.900 1.566 2.466 0.234 27 0 "[ . 1 . 2 . 3]" 1
173 1 53 LEU QB 1 81 MET ME 2.800 . 5.500 5.164 5.063 5.245 . 0 0 "[ . 1 . 2 . 3]" 1
174 1 53 LEU QB 1 111 LEU QD 2.300 . 4.000 3.163 2.947 3.470 . 0 0 "[ . 1 . 2 . 3]" 1
175 1 53 LEU QD 1 54 THR H 2.600 . 3.400 2.748 2.224 3.220 . 0 0 "[ . 1 . 2 . 3]" 1
176 1 53 LEU QD 1 57 MET HA 4.200 . 5.500 4.436 4.030 4.822 . 0 0 "[ . 1 . 2 . 3]" 1
177 1 53 LEU QD 1 57 MET QB 2.400 . 3.100 2.328 1.902 2.603 . 0 0 "[ . 1 . 2 . 3]" 1
178 1 53 LEU QD 1 57 MET ME 2.400 . 5.500 4.054 3.528 4.450 . 0 0 "[ . 1 . 2 . 3]" 1
179 1 53 LEU QD 1 57 MET QG 3.400 . 4.700 2.709 2.045 3.355 . 0 0 "[ . 1 . 2 . 3]" 1
180 1 53 LEU QD 1 58 LEU HB2 2.800 . 5.500 4.900 4.572 5.181 . 0 0 "[ . 1 . 2 . 3]" 1
181 1 53 LEU QD 1 69 MET HA 3.400 . 4.800 4.263 3.572 4.640 . 0 0 "[ . 1 . 2 . 3]" 1
182 1 53 LEU QD 1 69 MET QB 2.800 . 3.800 2.874 1.899 3.409 . 0 0 "[ . 1 . 2 . 3]" 1
183 1 53 LEU QD 1 69 MET ME 2.500 . 3.300 2.992 2.328 3.196 . 0 0 "[ . 1 . 2 . 3]" 1
184 1 53 LEU QD 1 69 MET QG 4.200 . 5.500 3.122 2.422 4.044 . 0 0 "[ . 1 . 2 . 3]" 1
185 1 53 LEU QD 1 70 LEU HA 2.800 . 5.500 3.217 2.967 3.562 . 0 0 "[ . 1 . 2 . 3]" 1
186 1 53 LEU QD 1 72 GLU H 3.700 . 5.400 4.880 4.532 5.198 . 0 0 "[ . 1 . 2 . 3]" 1
187 1 53 LEU QD 1 73 ARG H 3.200 . 4.500 4.109 3.691 4.356 . 0 0 "[ . 1 . 2 . 3]" 1
188 1 53 LEU QD 1 73 ARG HA 3.100 . 5.500 4.612 3.699 4.933 . 0 0 "[ . 1 . 2 . 3]" 1
189 1 53 LEU QD 1 73 ARG HB3 3.300 . 4.700 2.682 1.774 3.024 0.126 7 0 "[ . 1 . 2 . 3]" 1
190 1 53 LEU QD 1 73 ARG QD 3.700 . 4.500 2.687 1.854 3.791 0.146 14 0 "[ . 1 . 2 . 3]" 1
191 1 53 LEU QD 1 74 LEU H 3.200 . 4.500 3.483 3.083 3.772 . 0 0 "[ . 1 . 2 . 3]" 1
192 1 53 LEU QD 1 74 LEU HB2 3.100 . 4.300 3.556 3.333 4.164 . 0 0 "[ . 1 . 2 . 3]" 1
193 1 53 LEU QD 1 75 PHE H 3.700 . 5.400 5.069 4.776 5.264 . 0 0 "[ . 1 . 2 . 3]" 1
194 1 53 LEU QD 1 77 LEU HB2 3.600 . 5.200 4.092 3.543 4.487 . 0 0 "[ . 1 . 2 . 3]" 1
195 1 53 LEU QD 1 77 LEU QD 2.200 . 2.800 2.118 1.619 2.672 . 0 0 "[ . 1 . 2 . 3]" 1
196 1 53 LEU QD 1 90 THR MG 2.300 . 5.500 4.524 4.360 4.743 . 0 0 "[ . 1 . 2 . 3]" 1
197 1 54 THR H 1 54 THR HA 2.600 . 3.400 2.826 2.797 2.853 . 0 0 "[ . 1 . 2 . 3]" 1
198 1 54 THR H 1 54 THR HB 3.300 . 4.700 3.617 3.379 3.733 . 0 0 "[ . 1 . 2 . 3]" 1
199 1 54 THR H 1 54 THR MG 2.400 . 5.500 3.965 3.855 4.087 . 0 0 "[ . 1 . 2 . 3]" 1
200 1 54 THR H 1 55 ALA H 3.800 . 5.500 4.325 4.265 4.369 . 0 0 "[ . 1 . 2 . 3]" 1
201 1 54 THR H 1 57 MET H 3.200 . 4.500 2.955 2.777 3.563 . 0 0 "[ . 1 . 2 . 3]" 1
202 1 54 THR H 1 57 MET QB 2.600 . 3.400 1.796 1.722 2.192 0.078 4 0 "[ . 1 . 2 . 3]" 1
203 1 54 THR H 1 57 MET QG 3.100 . 4.300 2.496 2.205 3.516 . 0 0 "[ . 1 . 2 . 3]" 1
204 1 54 THR H 1 58 LEU H 3.700 . 5.400 3.677 3.504 4.017 . 0 0 "[ . 1 . 2 . 3]" 1
205 1 54 THR H 1 58 LEU HB2 4.200 . 5.500 5.552 5.524 5.612 0.112 28 0 "[ . 1 . 2 . 3]" 1
206 1 54 THR H 1 74 LEU QD 3.000 . 4.100 3.680 3.470 3.793 . 0 0 "[ . 1 . 2 . 3]" 1
207 1 54 THR HA 1 54 THR MG 2.000 . 2.500 2.139 1.983 2.217 . 0 0 "[ . 1 . 2 . 3]" 1
208 1 54 THR HA 1 55 ALA H 2.400 . 3.100 2.699 2.568 2.867 . 0 0 "[ . 1 . 2 . 3]" 1
209 1 54 THR HA 1 55 ALA MB 3.500 . 5.000 4.375 4.283 4.456 . 0 0 "[ . 1 . 2 . 3]" 1
210 1 54 THR HA 1 74 LEU QD 2.900 . 4.000 3.154 2.999 3.441 . 0 0 "[ . 1 . 2 . 3]" 1
211 1 54 THR HA 1 111 LEU QD 2.800 . 5.500 2.284 1.633 2.724 . 0 0 "[ . 1 . 2 . 3]" 1
212 1 54 THR HB 1 54 THR MG 1.900 . 2.400 2.105 2.072 2.118 . 0 0 "[ . 1 . 2 . 3]" 1
213 1 54 THR HB 1 55 ALA H 2.400 . 3.100 2.160 1.703 2.648 . 0 0 "[ . 1 . 2 . 3]" 1
214 1 54 THR HB 1 55 ALA MB 3.400 . 4.800 3.574 3.383 3.932 . 0 0 "[ . 1 . 2 . 3]" 1
215 1 54 THR HB 1 57 MET H 3.500 . 5.000 3.719 3.369 4.052 . 0 0 "[ . 1 . 2 . 3]" 1
216 1 54 THR MG 1 55 ALA H 2.800 . 3.800 2.317 1.789 2.641 0.011 28 0 "[ . 1 . 2 . 3]" 1
217 1 54 THR MG 1 55 ALA MB 3.300 . 4.700 3.576 2.919 3.856 . 0 0 "[ . 1 . 2 . 3]" 1
218 1 54 THR MG 1 57 MET H 3.700 . 5.400 4.979 4.635 5.157 . 0 0 "[ . 1 . 2 . 3]" 1
219 1 54 THR MG 1 57 MET QB 4.000 . 5.500 5.114 5.043 5.226 . 0 0 "[ . 1 . 2 . 3]" 1
220 1 54 THR MG 1 57 MET ME 3.100 . 4.300 3.777 3.362 4.217 . 0 0 "[ . 1 . 2 . 3]" 1
221 1 54 THR MG 1 57 MET QG 3.700 . 5.400 5.234 5.221 5.289 . 0 0 "[ . 1 . 2 . 3]" 1
222 1 54 THR MG 1 74 LEU QD 3.300 . 4.700 3.648 3.393 4.107 . 0 0 "[ . 1 . 2 . 3]" 1
223 1 54 THR MG 1 81 MET ME 3.600 . 5.200 4.080 3.671 4.700 . 0 0 "[ . 1 . 2 . 3]" 1
224 1 54 THR MG 1 104 MET ME 3.300 . 5.500 5.164 4.808 5.422 . 0 0 "[ . 1 . 2 . 3]" 1
225 1 54 THR MG 1 107 SER QB 3.200 . 5.500 5.067 4.554 5.289 . 0 0 "[ . 1 . 2 . 3]" 1
226 1 54 THR MG 1 110 SER HA 2.600 . 5.500 5.599 5.509 5.708 0.208 28 0 "[ . 1 . 2 . 3]" 1
227 1 54 THR MG 1 111 LEU HB2 2.800 . 3.800 2.761 2.299 3.229 . 0 0 "[ . 1 . 2 . 3]" 1
228 1 54 THR MG 1 111 LEU QD 2.800 . 3.800 2.545 1.880 3.065 . 0 0 "[ . 1 . 2 . 3]" 1
229 1 54 THR MG 1 112 ARG QB 3.900 . 5.500 3.163 2.650 4.191 . 0 0 "[ . 1 . 2 . 3]" 1
230 1 55 ALA H 1 55 ALA HA 2.700 . 3.600 2.756 2.721 2.795 . 0 0 "[ . 1 . 2 . 3]" 1
231 1 55 ALA H 1 55 ALA MB 2.300 . 3.000 2.214 2.146 2.239 . 0 0 "[ . 1 . 2 . 3]" 1
232 1 55 ALA H 1 56 SER H 3.900 . 5.500 2.822 2.701 3.038 . 0 0 "[ . 1 . 2 . 3]" 1
233 1 55 ALA H 1 57 MET H 4.500 . 5.500 4.447 4.231 4.584 . 0 0 "[ . 1 . 2 . 3]" 1
234 1 55 ALA H 1 111 LEU QD 3.100 . 4.300 3.252 3.028 3.498 . 0 0 "[ . 1 . 2 . 3]" 1
235 1 55 ALA HA 1 55 ALA MB 1.900 . 2.400 2.120 2.113 2.124 . 0 0 "[ . 1 . 2 . 3]" 1
236 1 55 ALA HA 1 57 MET H 3.400 . 4.800 4.534 4.105 4.705 . 0 0 "[ . 1 . 2 . 3]" 1
237 1 55 ALA HA 1 58 LEU H 3.100 . 4.300 3.424 3.184 3.598 . 0 0 "[ . 1 . 2 . 3]" 1
238 1 55 ALA HA 1 58 LEU HB2 2.500 . 3.300 2.533 2.261 2.825 . 0 0 "[ . 1 . 2 . 3]" 1
239 1 55 ALA HA 1 58 LEU HB3 2.800 . 5.500 4.024 3.807 4.280 . 0 0 "[ . 1 . 2 . 3]" 1
240 1 55 ALA HA 1 58 LEU QD 2.500 . 3.300 1.723 1.670 1.823 0.030 28 0 "[ . 1 . 2 . 3]" 1
241 1 55 ALA HA 1 59 ALA H 3.000 . 4.100 4.112 4.006 4.156 0.056 26 0 "[ . 1 . 2 . 3]" 1
242 1 55 ALA HA 1 105 LEU MD2 2.400 . 5.500 3.659 3.499 3.773 . 0 0 "[ . 1 . 2 . 3]" 1
243 1 55 ALA HA 1 111 LEU QD 2.500 . 3.300 3.349 3.320 3.394 0.094 27 0 "[ . 1 . 2 . 3]" 1
244 1 55 ALA MB 1 56 SER H 3.400 . 4.800 2.621 2.202 2.882 . 0 0 "[ . 1 . 2 . 3]" 1
245 1 55 ALA MB 1 56 SER HA 3.300 . 4.700 3.826 3.637 3.928 . 0 0 "[ . 1 . 2 . 3]" 1
246 1 55 ALA MB 1 57 MET H 3.500 . 5.000 4.667 4.236 4.859 . 0 0 "[ . 1 . 2 . 3]" 1
247 1 55 ALA MB 1 58 LEU HB2 3.100 . 4.300 3.833 3.630 4.100 . 0 0 "[ . 1 . 2 . 3]" 1
248 1 55 ALA MB 1 58 LEU QD 3.300 . 4.700 3.000 2.911 3.112 . 0 0 "[ . 1 . 2 . 3]" 1
249 1 55 ALA MB 1 104 MET HA 3.200 . 4.500 3.808 3.660 3.981 . 0 0 "[ . 1 . 2 . 3]" 1
250 1 55 ALA MB 1 105 LEU HB3 2.300 . 5.500 4.337 4.166 4.488 . 0 0 "[ . 1 . 2 . 3]" 1
251 1 55 ALA MB 1 105 LEU MD2 2.300 . 5.500 4.191 4.066 4.331 . 0 0 "[ . 1 . 2 . 3]" 1
252 1 55 ALA MB 1 111 LEU QD 2.700 . 3.600 3.595 3.433 3.669 0.069 27 0 "[ . 1 . 2 . 3]" 1
253 1 56 SER H 1 56 SER HB2 3.300 . 4.700 2.678 2.083 3.142 . 0 0 "[ . 1 . 2 . 3]" 1
254 1 56 SER H 1 57 MET H 3.300 . 4.700 2.715 2.576 2.820 . 0 0 "[ . 1 . 2 . 3]" 1
255 1 56 SER HA 1 57 MET H 3.000 . 4.100 3.548 3.492 3.560 . 0 0 "[ . 1 . 2 . 3]" 1
256 1 56 SER HA 1 58 LEU H 3.600 . 5.200 4.349 4.200 4.505 . 0 0 "[ . 1 . 2 . 3]" 1
257 1 56 SER HA 1 59 ALA H 2.700 . 5.500 3.430 3.235 3.555 . 0 0 "[ . 1 . 2 . 3]" 1
258 1 56 SER HA 1 60 SER H 3.700 . 5.400 4.783 4.651 4.901 . 0 0 "[ . 1 . 2 . 3]" 1
259 1 56 SER HB2 1 57 MET H 2.700 . 3.600 2.660 2.340 4.053 0.453 26 0 "[ . 1 . 2 . 3]" 1
260 1 56 SER HB3 1 59 ALA H 3.700 . 5.400 5.388 5.141 5.550 0.150 26 0 "[ . 1 . 2 . 3]" 1
261 1 56 SER HB3 1 59 ALA MB 3.200 . 4.500 4.519 4.229 5.064 0.564 23 2 "[ . 1- . 2 + . 3]" 1
262 1 57 MET H 1 57 MET HA 2.600 . 3.400 2.805 2.788 2.863 . 0 0 "[ . 1 . 2 . 3]" 1
263 1 57 MET H 1 57 MET QB 2.400 . 3.100 2.284 2.251 2.330 . 0 0 "[ . 1 . 2 . 3]" 1
264 1 57 MET H 1 57 MET QG 2.600 . 3.400 3.176 2.394 3.248 . 0 0 "[ . 1 . 2 . 3]" 1
265 1 57 MET H 1 58 LEU H 2.300 . 3.000 2.644 2.454 2.699 . 0 0 "[ . 1 . 2 . 3]" 1
266 1 57 MET H 1 59 ALA H 3.400 . 4.800 4.190 3.844 4.260 . 0 0 "[ . 1 . 2 . 3]" 1
267 1 57 MET HA 1 58 LEU H 2.900 . 4.000 3.514 3.489 3.529 . 0 0 "[ . 1 . 2 . 3]" 1
268 1 57 MET QB 1 58 LEU H 2.600 . 3.400 2.570 2.520 2.644 . 0 0 "[ . 1 . 2 . 3]" 1
269 1 57 MET QB 1 59 ALA H 4.000 . 5.500 4.710 4.532 4.763 . 0 0 "[ . 1 . 2 . 3]" 1
270 1 57 MET QB 1 59 ALA MB 3.100 . 5.500 5.636 5.415 5.728 0.228 6 0 "[ . 1 . 2 . 3]" 1
271 1 57 MET ME 1 57 MET QG 2.700 . 3.400 2.185 2.025 2.320 . 0 0 "[ . 1 . 2 . 3]" 1
272 1 57 MET ME 1 111 LEU QD 2.600 . 5.500 4.875 4.550 5.053 . 0 0 "[ . 1 . 2 . 3]" 1
273 1 57 MET QG 1 58 LEU H 3.400 . 4.800 4.404 4.111 4.453 . 0 0 "[ . 1 . 2 . 3]" 1
274 1 58 LEU H 1 58 LEU HA 2.600 . 3.400 2.806 2.784 2.839 . 0 0 "[ . 1 . 2 . 3]" 1
275 1 58 LEU H 1 58 LEU HB2 2.100 . 2.700 2.401 2.228 2.588 . 0 0 "[ . 1 . 2 . 3]" 1
276 1 58 LEU H 1 58 LEU HB3 2.500 . 5.500 3.547 3.507 3.570 . 0 0 "[ . 1 . 2 . 3]" 1
277 1 58 LEU H 1 58 LEU QD 2.600 . 3.400 2.516 2.075 3.041 . 0 0 "[ . 1 . 2 . 3]" 1
278 1 58 LEU H 1 60 SER H 3.900 . 5.500 3.837 3.739 3.964 . 0 0 "[ . 1 . 2 . 3]" 1
279 1 58 LEU H 1 105 LEU MD2 3.600 . 5.200 5.067 4.867 5.228 0.028 20 0 "[ . 1 . 2 . 3]" 1
280 1 58 LEU HA 1 61 ALA MB 3.200 . 4.500 3.788 3.479 4.039 . 0 0 "[ . 1 . 2 . 3]" 1
281 1 58 LEU HA 1 69 MET ME 2.400 . 3.100 2.027 1.693 2.384 0.007 25 0 "[ . 1 . 2 . 3]" 1
282 1 58 LEU HB2 1 59 ALA H 2.500 . 3.300 2.494 2.416 2.680 . 0 0 "[ . 1 . 2 . 3]" 1
283 1 58 LEU HB2 1 59 ALA MB 3.100 . 4.300 3.880 3.705 4.043 . 0 0 "[ . 1 . 2 . 3]" 1
284 1 58 LEU HB2 1 60 SER H 3.900 . 5.500 4.605 4.481 4.833 . 0 0 "[ . 1 . 2 . 3]" 1
285 1 58 LEU HB2 1 69 MET ME 3.300 . 4.700 4.585 4.175 4.745 0.045 11 0 "[ . 1 . 2 . 3]" 1
286 1 58 LEU HB2 1 111 LEU QD 2.100 . 5.500 4.537 4.371 4.648 . 0 0 "[ . 1 . 2 . 3]" 1
287 1 58 LEU HB3 1 59 ALA H 2.700 . 3.600 3.443 3.217 3.658 0.058 13 0 "[ . 1 . 2 . 3]" 1
288 1 58 LEU HB3 1 60 SER H 4.500 . 5.500 4.948 4.806 5.153 . 0 0 "[ . 1 . 2 . 3]" 1
289 1 58 LEU HB3 1 61 ALA H 4.100 . 5.500 5.187 5.006 5.327 . 0 0 "[ . 1 . 2 . 3]" 1
290 1 58 LEU HB3 1 111 LEU QD 2.300 . 5.500 5.053 4.833 5.288 . 0 0 "[ . 1 . 2 . 3]" 1
291 1 58 LEU QD 1 59 ALA H 3.200 . 4.500 3.755 3.642 3.908 . 0 0 "[ . 1 . 2 . 3]" 1
292 1 58 LEU QD 1 60 SER H 4.300 . 5.500 4.746 4.468 5.068 . 0 0 "[ . 1 . 2 . 3]" 1
293 1 58 LEU QD 1 61 ALA H 3.900 . 5.500 5.137 4.849 5.329 . 0 0 "[ . 1 . 2 . 3]" 1
294 1 58 LEU QD 1 61 ALA MB 3.200 . 4.500 4.447 4.422 4.540 0.040 7 0 "[ . 1 . 2 . 3]" 1
295 1 58 LEU QD 1 69 MET H 3.400 . 4.800 3.954 2.989 4.397 . 0 0 "[ . 1 . 2 . 3]" 1
296 1 58 LEU QD 1 69 MET ME 2.300 . 3.000 2.489 1.746 2.975 . 0 0 "[ . 1 . 2 . 3]" 1
297 1 58 LEU QD 1 70 LEU HB2 3.500 . 5.000 3.560 3.130 4.186 . 0 0 "[ . 1 . 2 . 3]" 1
298 1 58 LEU QD 1 104 MET ME 1.900 . 5.500 3.745 3.466 3.920 . 0 0 "[ . 1 . 2 . 3]" 1
299 1 58 LEU QD 1 105 LEU HA 2.700 . 3.600 1.869 1.772 2.025 0.028 28 0 "[ . 1 . 2 . 3]" 1
300 1 58 LEU QD 1 105 LEU MD2 1.900 . 2.400 1.743 1.573 1.894 . 0 0 "[ . 1 . 2 . 3]" 1
301 1 58 LEU QD 1 106 GLU H 3.400 . 4.800 4.690 4.574 4.776 . 0 0 "[ . 1 . 2 . 3]" 1
302 1 58 LEU QD 1 106 GLU HA 3.800 . 5.500 5.516 5.475 5.572 0.072 28 0 "[ . 1 . 2 . 3]" 1
303 1 58 LEU QD 1 107 SER H 5.100 . 5.500 4.861 4.749 4.978 . 0 0 "[ . 1 . 2 . 3]" 1
304 1 58 LEU QD 1 111 LEU QD 1.800 . 2.200 1.905 1.798 2.075 . 0 0 "[ . 1 . 2 . 3]" 1
305 1 59 ALA H 1 59 ALA HA 2.300 . 3.000 2.828 2.799 2.850 . 0 0 "[ . 1 . 2 . 3]" 1
306 1 59 ALA H 1 59 ALA MB 2.100 . 2.700 2.149 2.024 2.240 . 0 0 "[ . 1 . 2 . 3]" 1
307 1 59 ALA H 1 60 SER H 2.600 . 3.400 2.620 2.511 2.692 . 0 0 "[ . 1 . 2 . 3]" 1
308 1 59 ALA H 1 61 ALA H 3.500 . 5.000 4.278 4.180 4.395 . 0 0 "[ . 1 . 2 . 3]" 1
309 1 59 ALA H 1 66 GLN HG2 4.700 . 5.500 4.663 4.220 5.058 . 0 0 "[ . 1 . 2 . 3]" 1
310 1 59 ALA H 1 66 GLN HG3 5.200 . 5.500 5.310 4.772 5.518 0.018 11 0 "[ . 1 . 2 . 3]" 1
311 1 59 ALA H 1 105 LEU MD2 4.400 . 5.500 5.538 5.512 5.569 0.069 6 0 "[ . 1 . 2 . 3]" 1
312 1 59 ALA HA 1 59 ALA MB 1.800 . 2.200 2.108 2.081 2.127 . 0 0 "[ . 1 . 2 . 3]" 1
313 1 59 ALA HA 1 60 SER H 2.600 . 3.400 3.361 3.281 3.443 0.043 28 0 "[ . 1 . 2 . 3]" 1
314 1 59 ALA HA 1 61 ALA H 2.900 . 4.000 3.476 3.308 3.706 . 0 0 "[ . 1 . 2 . 3]" 1
315 1 59 ALA MB 1 60 SER H 2.600 . 3.400 3.144 2.923 3.291 . 0 0 "[ . 1 . 2 . 3]" 1
316 1 59 ALA MB 1 61 ALA H 3.200 . 4.500 4.339 4.206 4.450 . 0 0 "[ . 1 . 2 . 3]" 1
317 1 60 SER H 1 60 SER HA 2.500 . 3.300 2.877 2.833 2.904 . 0 0 "[ . 1 . 2 . 3]" 1
318 1 60 SER H 1 60 SER QB 2.600 . 3.400 2.342 2.234 2.563 . 0 0 "[ . 1 . 2 . 3]" 1
319 1 60 SER H 1 61 ALA H 2.300 . 3.000 2.466 2.370 2.649 . 0 0 "[ . 1 . 2 . 3]" 1
320 1 60 SER H 1 66 GLN HG2 5.200 . 5.500 5.410 5.075 5.530 0.030 28 0 "[ . 1 . 2 . 3]" 1
321 1 60 SER H 1 66 GLN HG3 5.100 . 5.500 5.345 4.978 5.524 0.024 21 0 "[ . 1 . 2 . 3]" 1
322 1 60 SER HA 1 61 ALA H 2.700 . 3.600 3.340 3.305 3.438 . 0 0 "[ . 1 . 2 . 3]" 1
323 1 60 SER QB 1 61 ALA H 2.600 . 3.400 3.243 2.987 3.312 . 0 0 "[ . 1 . 2 . 3]" 1
324 1 60 SER QB 1 61 ALA MB 2.300 . 5.500 3.577 3.401 3.712 . 0 0 "[ . 1 . 2 . 3]" 1
325 1 60 SER QB 1 69 MET ME 2.500 . 3.300 3.213 3.011 3.276 . 0 0 "[ . 1 . 2 . 3]" 1
326 1 61 ALA H 1 61 ALA HA 2.600 . 3.400 2.939 2.929 2.944 . 0 0 "[ . 1 . 2 . 3]" 1
327 1 61 ALA H 1 61 ALA MB 2.200 . 2.800 2.514 2.431 2.587 . 0 0 "[ . 1 . 2 . 3]" 1
328 1 61 ALA H 1 64 GLN QB 3.400 . 5.500 5.104 4.791 5.451 . 0 0 "[ . 1 . 2 . 3]" 1
329 1 61 ALA H 1 66 GLN H 4.600 . 5.500 5.143 4.343 5.521 0.021 2 0 "[ . 1 . 2 . 3]" 1
330 1 61 ALA H 1 66 GLN HG2 3.300 . 4.700 4.487 4.221 4.704 0.004 7 0 "[ . 1 . 2 . 3]" 1
331 1 61 ALA H 1 66 GLN HG3 3.300 . 4.700 3.832 3.416 4.580 . 0 0 "[ . 1 . 2 . 3]" 1
332 1 61 ALA HA 1 61 ALA MB 2.000 . 2.500 2.108 2.086 2.127 . 0 0 "[ . 1 . 2 . 3]" 1
333 1 61 ALA HA 1 64 GLN QB 3.500 . 4.100 3.249 2.786 3.944 . 0 0 "[ . 1 . 2 . 3]" 1
334 1 61 ALA HA 1 65 GLU HG2 3.900 . 5.500 5.206 4.293 5.527 0.027 1 0 "[ . 1 . 2 . 3]" 1
335 1 61 ALA HA 1 69 MET ME 3.800 . 5.500 4.600 4.115 5.299 . 0 0 "[ . 1 . 2 . 3]" 1
336 1 61 ALA MB 1 64 GLN QB 2.400 . 3.100 1.885 1.675 2.268 0.025 2 0 "[ . 1 . 2 . 3]" 1
337 1 61 ALA MB 1 65 GLU H 3.200 . 5.500 1.741 1.379 2.321 . 0 0 "[ . 1 . 2 . 3]" 1
338 1 61 ALA MB 1 65 GLU HA 2.500 . 5.500 4.059 3.768 4.525 . 0 0 "[ . 1 . 2 . 3]" 1
339 1 61 ALA MB 1 65 GLU QB 2.300 . 3.000 2.824 2.221 3.084 0.084 7 0 "[ . 1 . 2 . 3]" 1
340 1 61 ALA MB 1 65 GLU HG3 2.400 . 3.100 2.915 2.442 3.119 0.019 13 0 "[ . 1 . 2 . 3]" 1
341 1 61 ALA MB 1 66 GLN HG2 2.400 . 5.500 4.782 4.351 5.142 . 0 0 "[ . 1 . 2 . 3]" 1
342 1 61 ALA MB 1 67 LYS H 4.500 . 5.500 5.297 4.936 5.528 0.028 29 0 "[ . 1 . 2 . 3]" 1
343 1 61 ALA MB 1 69 MET H 4.500 . 5.500 5.162 4.862 5.510 0.010 14 0 "[ . 1 . 2 . 3]" 1
344 1 61 ALA MB 1 69 MET ME 2.100 . 2.700 2.203 1.707 2.745 0.045 26 0 "[ . 1 . 2 . 3]" 1
345 1 61 ALA MB 1 69 MET QG 2.300 . 5.500 3.619 3.281 3.882 . 0 0 "[ . 1 . 2 . 3]" 1
346 1 64 GLN H 1 65 GLU H 2.600 . 3.400 3.156 2.854 3.464 0.064 18 0 "[ . 1 . 2 . 3]" 1
347 1 64 GLN H 1 66 GLN H 4.000 . 5.500 3.594 2.340 5.567 0.067 10 0 "[ . 1 . 2 . 3]" 1
348 1 64 GLN HA 1 65 GLU H 2.700 . 3.600 3.507 3.454 3.550 . 0 0 "[ . 1 . 2 . 3]" 1
349 1 64 GLN QB 1 65 GLU H 2.600 . 3.000 1.680 1.579 1.863 0.221 13 0 "[ . 1 . 2 . 3]" 1
350 1 64 GLN HG2 1 65 GLU H 3.100 . 4.300 3.580 2.698 4.369 0.069 25 0 "[ . 1 . 2 . 3]" 1
351 1 64 GLN HG3 1 65 GLU H 3.000 . 4.100 3.814 2.899 4.360 0.260 1 0 "[ . 1 . 2 . 3]" 1
352 1 65 GLU H 1 65 GLU HA 2.600 . 3.400 2.932 2.913 2.940 . 0 0 "[ . 1 . 2 . 3]" 1
353 1 65 GLU H 1 65 GLU QB 2.400 . 3.100 2.794 2.515 2.944 . 0 0 "[ . 1 . 2 . 3]" 1
354 1 65 GLU H 1 65 GLU HG2 2.600 . 3.400 2.057 1.683 2.464 0.117 22 0 "[ . 1 . 2 . 3]" 1
355 1 65 GLU H 1 66 GLN H 2.400 . 3.100 2.787 2.178 3.124 0.024 1 0 "[ . 1 . 2 . 3]" 1
356 1 65 GLU H 1 69 MET QG 3.200 . 4.500 4.405 4.219 4.557 0.057 14 0 "[ . 1 . 2 . 3]" 1
357 1 65 GLU HA 1 67 LYS H 3.700 . 5.400 3.530 3.089 4.253 . 0 0 "[ . 1 . 2 . 3]" 1
358 1 65 GLU HA 1 68 GLN H 2.700 . 3.600 3.361 2.903 3.669 0.069 10 0 "[ . 1 . 2 . 3]" 1
359 1 65 GLU HA 1 68 GLN QB 2.200 . 2.800 2.183 1.650 2.775 . 0 0 "[ . 1 . 2 . 3]" 1
360 1 65 GLU HA 1 69 MET H 3.400 . 4.800 3.471 2.702 4.494 . 0 0 "[ . 1 . 2 . 3]" 1
361 1 65 GLU HA 1 69 MET ME 3.800 . 5.500 4.910 4.262 5.413 . 0 0 "[ . 1 . 2 . 3]" 1
362 1 65 GLU QB 1 68 GLN H 3.400 . 4.800 3.485 2.393 4.225 . 0 0 "[ . 1 . 2 . 3]" 1
363 1 65 GLU QB 1 69 MET H 2.500 . 3.300 2.367 1.903 3.253 . 0 0 "[ . 1 . 2 . 3]" 1
364 1 65 GLU HG3 1 69 MET H 3.500 . 5.000 4.555 3.100 5.023 0.023 15 0 "[ . 1 . 2 . 3]" 1
365 1 65 GLU HG3 1 69 MET ME 2.600 . 3.400 2.887 1.779 3.404 0.021 26 0 "[ . 1 . 2 . 3]" 1
366 1 66 GLN H 1 67 LYS H 2.700 . 3.600 2.808 2.429 3.823 0.223 10 0 "[ . 1 . 2 . 3]" 1
367 1 66 GLN H 1 68 GLN H 3.600 . 5.200 3.974 3.297 4.262 . 0 0 "[ . 1 . 2 . 3]" 1
368 1 66 GLN HA 1 67 LYS H 3.100 . 4.300 3.491 3.383 3.567 . 0 0 "[ . 1 . 2 . 3]" 1
369 1 66 GLN QB 1 68 GLN H 3.300 . 4.700 4.561 3.943 4.765 0.065 14 0 "[ . 1 . 2 . 3]" 1
370 1 66 GLN HB2 1 67 LYS H 2.700 . 3.600 3.379 2.893 3.635 0.035 11 0 "[ . 1 . 2 . 3]" 1
371 1 66 GLN HG2 1 67 LYS H 3.600 . 5.200 4.737 4.211 5.041 . 0 0 "[ . 1 . 2 . 3]" 1
372 1 66 GLN HG2 1 69 MET ME 2.600 . 5.500 5.140 4.256 5.527 0.027 24 0 "[ . 1 . 2 . 3]" 1
373 1 66 GLN HG3 1 67 LYS H 3.500 . 5.000 5.138 4.680 5.314 0.314 26 0 "[ . 1 . 2 . 3]" 1
374 1 67 LYS H 1 67 LYS HA 2.700 . 3.600 2.939 2.912 2.948 . 0 0 "[ . 1 . 2 . 3]" 1
375 1 67 LYS H 1 67 LYS HB2 2.500 . 5.500 3.390 2.631 3.856 . 0 0 "[ . 1 . 2 . 3]" 1
376 1 67 LYS H 1 67 LYS HB3 2.400 . 3.100 3.415 2.834 3.876 0.776 27 12 "[*** ** -1 *. 2** * +* 3]" 1
377 1 67 LYS H 1 67 LYS HE2 3.900 . 5.500 4.739 3.577 5.510 0.010 23 0 "[ . 1 . 2 . 3]" 1
378 1 67 LYS H 1 67 LYS HE3 4.000 . 5.500 4.893 3.653 5.523 0.023 18 0 "[ . 1 . 2 . 3]" 1
379 1 67 LYS H 1 67 LYS HG3 2.500 . 3.300 2.803 1.655 3.981 0.681 8 2 "[ . + 1- . 2 . 3]" 1
380 1 67 LYS H 1 69 MET H 3.900 . 5.500 4.424 3.876 4.791 . 0 0 "[ . 1 . 2 . 3]" 1
381 1 67 LYS H 1 70 LEU QD 3.800 . 4.800 3.548 2.896 4.207 . 0 0 "[ . 1 . 2 . 3]" 1
382 1 67 LYS HA 1 67 LYS HB2 2.100 . 2.700 2.705 2.408 3.025 0.325 27 0 "[ . 1 . 2 . 3]" 1
383 1 67 LYS HA 1 68 GLN H 2.400 . 3.100 2.924 2.784 3.140 0.040 27 0 "[ . 1 . 2 . 3]" 1
384 1 67 LYS HA 1 70 LEU HB2 3.500 . 5.000 4.887 4.643 5.062 0.062 26 0 "[ . 1 . 2 . 3]" 1
385 1 67 LYS HA 1 70 LEU QD 2.400 . 3.100 1.820 1.509 2.234 0.191 1 0 "[ . 1 . 2 . 3]" 1
386 1 67 LYS HB2 1 68 GLN H 2.800 . 5.500 4.283 3.762 4.505 . 0 0 "[ . 1 . 2 . 3]" 1
387 1 67 LYS HB3 1 68 GLN H 2.600 . 5.500 4.582 4.402 4.657 . 0 0 "[ . 1 . 2 . 3]" 1
388 1 67 LYS HB3 1 94 LEU QD 2.700 . 5.500 5.024 3.937 5.601 0.101 20 0 "[ . 1 . 2 . 3]" 1
389 1 68 GLN H 1 68 GLN QB 2.100 . 2.700 2.568 2.374 2.670 . 0 0 "[ . 1 . 2 . 3]" 1
390 1 68 GLN H 1 68 GLN HG3 2.600 . 5.500 4.196 3.223 4.932 . 0 0 "[ . 1 . 2 . 3]" 1
391 1 68 GLN H 1 69 MET H 2.500 . 3.300 2.188 2.026 2.374 . 0 0 "[ . 1 . 2 . 3]" 1
392 1 68 GLN H 1 70 LEU H 3.500 . 5.000 3.141 2.738 3.473 . 0 0 "[ . 1 . 2 . 3]" 1
393 1 68 GLN H 1 70 LEU QD 4.100 . 4.800 2.387 1.857 3.301 0.143 23 0 "[ . 1 . 2 . 3]" 1
394 1 68 GLN H 1 71 GLY H 4.300 . 5.500 5.261 4.916 5.515 0.015 20 0 "[ . 1 . 2 . 3]" 1
395 1 68 GLN HA 1 68 GLN QB 2.000 . 2.500 2.360 2.240 2.419 . 0 0 "[ . 1 . 2 . 3]" 1
396 1 68 GLN HA 1 94 LEU QD 2.400 . 5.500 3.675 2.771 4.745 . 0 0 "[ . 1 . 2 . 3]" 1
397 1 68 GLN QB 1 69 MET H 2.200 . 5.500 2.327 2.128 2.644 . 0 0 "[ . 1 . 2 . 3]" 1
398 1 68 GLN HG3 1 69 MET H 3.200 . 4.500 4.290 3.143 4.862 0.362 7 0 "[ . 1 . 2 . 3]" 1
399 1 69 MET H 1 69 MET HA 2.400 . 3.100 2.859 2.780 2.881 . 0 0 "[ . 1 . 2 . 3]" 1
400 1 69 MET H 1 69 MET QG 2.400 . 3.100 2.289 1.787 2.538 0.013 11 0 "[ . 1 . 2 . 3]" 1
401 1 69 MET H 1 70 LEU H 2.700 . 3.600 2.762 2.518 3.052 . 0 0 "[ . 1 . 2 . 3]" 1
402 1 69 MET H 1 71 GLY H 3.600 . 5.200 4.908 4.572 5.261 0.061 11 0 "[ . 1 . 2 . 3]" 1
403 1 69 MET H 1 72 GLU H 3.800 . 5.500 5.173 4.664 5.516 0.016 5 0 "[ . 1 . 2 . 3]" 1
404 1 69 MET HA 1 69 MET QG 2.500 . 5.500 3.160 2.376 3.350 . 0 0 "[ . 1 . 2 . 3]" 1
405 1 69 MET HA 1 70 LEU H 2.600 . 3.400 3.197 2.947 3.358 . 0 0 "[ . 1 . 2 . 3]" 1
406 1 69 MET HA 1 72 GLU H 2.500 . 3.300 3.045 2.860 3.256 . 0 0 "[ . 1 . 2 . 3]" 1
407 1 69 MET HA 1 73 ARG H 3.100 . 4.300 2.947 2.378 3.302 . 0 0 "[ . 1 . 2 . 3]" 1
408 1 69 MET HA 1 73 ARG HB2 2.100 . 2.700 2.196 1.781 2.592 . 0 0 "[ . 1 . 2 . 3]" 1
409 1 69 MET QB 1 69 MET ME 2.400 . 5.500 3.079 1.882 3.580 . 0 0 "[ . 1 . 2 . 3]" 1
410 1 69 MET QB 1 70 LEU H 3.700 . 5.400 3.802 3.215 4.037 . 0 0 "[ . 1 . 2 . 3]" 1
411 1 69 MET QB 1 73 ARG H 2.900 . 4.000 3.891 3.811 3.967 . 0 0 "[ . 1 . 2 . 3]" 1
412 1 69 MET ME 1 69 MET QG 2.500 . 2.800 2.195 2.004 2.502 . 0 0 "[ . 1 . 2 . 3]" 1
413 1 69 MET QG 1 70 LEU H 3.500 . 5.000 3.404 2.651 4.294 . 0 0 "[ . 1 . 2 . 3]" 1
414 1 70 LEU H 1 70 LEU HA 2.600 . 3.400 2.855 2.776 2.920 . 0 0 "[ . 1 . 2 . 3]" 1
415 1 70 LEU H 1 70 LEU HB2 2.500 . 5.500 3.377 2.983 3.658 . 0 0 "[ . 1 . 2 . 3]" 1
416 1 70 LEU H 1 70 LEU HB3 2.700 . 3.600 3.276 2.826 3.523 . 0 0 "[ . 1 . 2 . 3]" 1
417 1 70 LEU H 1 70 LEU QD 3.000 . 4.100 1.743 1.479 1.972 0.421 20 0 "[ . 1 . 2 . 3]" 1
418 1 70 LEU H 1 70 LEU HG 2.500 . 3.300 2.132 1.763 3.451 0.151 25 0 "[ . 1 . 2 . 3]" 1
419 1 70 LEU H 1 71 GLY H 2.600 . 3.400 2.535 2.183 2.890 . 0 0 "[ . 1 . 2 . 3]" 1
420 1 70 LEU H 1 72 GLU H 3.600 . 5.200 3.655 3.104 4.055 . 0 0 "[ . 1 . 2 . 3]" 1
421 1 70 LEU H 1 73 ARG H 4.700 . 5.500 4.614 4.126 4.975 . 0 0 "[ . 1 . 2 . 3]" 1
422 1 70 LEU H 1 94 LEU HG 3.600 . 5.500 5.200 4.445 5.575 0.075 30 0 "[ . 1 . 2 . 3]" 1
423 1 70 LEU HA 1 70 LEU HB2 2.900 . 4.000 2.771 2.467 2.959 . 0 0 "[ . 1 . 2 . 3]" 1
424 1 70 LEU HA 1 71 GLY H 3.000 . 4.100 3.524 3.455 3.569 . 0 0 "[ . 1 . 2 . 3]" 1
425 1 70 LEU HA 1 73 ARG H 3.100 . 5.500 4.814 4.286 5.229 . 0 0 "[ . 1 . 2 . 3]" 1
426 1 70 LEU HA 1 74 LEU H 3.800 . 5.500 4.723 4.181 5.218 . 0 0 "[ . 1 . 2 . 3]" 1
427 1 70 LEU HA 1 94 LEU QD 2.900 . 4.000 3.819 3.576 3.940 . 0 0 "[ . 1 . 2 . 3]" 1
428 1 70 LEU HB2 1 70 LEU QD 2.500 . 3.300 2.114 1.983 2.221 . 0 0 "[ . 1 . 2 . 3]" 1
429 1 70 LEU HB2 1 70 LEU HG 2.700 . 3.600 2.752 2.413 3.021 . 0 0 "[ . 1 . 2 . 3]" 1
430 1 70 LEU HB2 1 71 GLY H 2.700 . 3.600 3.073 2.127 3.641 0.041 15 0 "[ . 1 . 2 . 3]" 1
431 1 70 LEU HB2 1 94 LEU QD 1.900 . 2.400 1.852 1.577 2.393 . 0 0 "[ . 1 . 2 . 3]" 1
432 1 70 LEU HB2 1 104 MET QB 1.800 . 5.500 5.243 4.979 6.295 0.795 25 2 "[ . 1- . 2 + 3]" 1
433 1 70 LEU HB2 1 105 LEU MD2 2.300 . 3.000 2.725 2.092 3.336 0.336 25 0 "[ . 1 . 2 . 3]" 1
434 1 70 LEU HB3 1 71 GLY H 3.200 . 4.400 4.105 3.618 4.283 . 0 0 "[ . 1 . 2 . 3]" 1
435 1 70 LEU HB3 1 94 LEU QD 2.500 . 3.300 3.223 2.483 3.429 0.129 15 0 "[ . 1 . 2 . 3]" 1
436 1 70 LEU HB3 1 111 LEU QD 2.600 . 5.500 3.423 2.898 4.490 . 0 0 "[ . 1 . 2 . 3]" 1
437 1 70 LEU QD 1 71 GLY H 3.800 . 5.500 2.349 1.364 3.429 0.636 10 6 "[ . * + * . *2- . *3]" 1
438 1 70 LEU QD 1 71 GLY QA 2.600 . 5.500 3.570 2.876 4.339 . 0 0 "[ . 1 . 2 . 3]" 1
439 1 70 LEU QD 1 72 GLU H 3.300 . 4.600 3.898 3.101 4.502 . 0 0 "[ . 1 . 2 . 3]" 1
440 1 70 LEU QD 1 105 LEU HA 2.500 . 5.500 4.771 4.277 5.260 . 0 0 "[ . 1 . 2 . 3]" 1
441 1 70 LEU HG 1 71 GLY H 3.200 . 4.500 3.363 2.144 4.482 . 0 0 "[ . 1 . 2 . 3]" 1
442 1 70 LEU HG 1 94 LEU QD 2.400 . 5.500 2.826 1.436 3.461 . 0 0 "[ . 1 . 2 . 3]" 1
443 1 71 GLY H 1 71 GLY QA 2.200 . 2.800 2.402 2.322 2.456 . 0 0 "[ . 1 . 2 . 3]" 1
444 1 71 GLY H 1 72 GLU H 2.600 . 3.400 2.266 1.816 2.695 . 0 0 "[ . 1 . 2 . 3]" 1
445 1 71 GLY H 1 72 GLU HA 3.900 . 5.500 4.680 4.460 4.900 . 0 0 "[ . 1 . 2 . 3]" 1
446 1 71 GLY H 1 73 ARG H 3.700 . 5.400 3.852 3.416 4.279 . 0 0 "[ . 1 . 2 . 3]" 1
447 1 71 GLY H 1 74 LEU H 4.100 . 5.500 4.706 4.202 5.138 . 0 0 "[ . 1 . 2 . 3]" 1
448 1 71 GLY H 1 90 THR MG 3.600 . 5.200 3.961 3.830 4.068 . 0 0 "[ . 1 . 2 . 3]" 1
449 1 71 GLY H 1 94 LEU HG 3.300 . 4.700 3.673 2.798 4.583 . 0 0 "[ . 1 . 2 . 3]" 1
450 1 71 GLY QA 1 72 GLU H 2.900 . 4.000 2.845 2.750 2.916 . 0 0 "[ . 1 . 2 . 3]" 1
451 1 71 GLY QA 1 73 ARG H 3.700 . 5.400 3.794 3.670 3.981 . 0 0 "[ . 1 . 2 . 3]" 1
452 1 71 GLY QA 1 74 LEU H 3.200 . 4.500 3.781 3.646 3.925 . 0 0 "[ . 1 . 2 . 3]" 1
453 1 71 GLY QA 1 74 LEU HB2 3.000 . 4.100 3.221 3.027 3.443 . 0 0 "[ . 1 . 2 . 3]" 1
454 1 71 GLY QA 1 74 LEU HB3 3.300 . 4.700 4.344 4.063 4.618 . 0 0 "[ . 1 . 2 . 3]" 1
455 1 71 GLY QA 1 74 LEU QD 3.200 . 4.500 3.493 3.264 3.730 . 0 0 "[ . 1 . 2 . 3]" 1
456 1 71 GLY QA 1 90 THR MG 2.600 . 3.400 1.477 1.357 1.634 0.443 6 0 "[ . 1 . 2 . 3]" 1
457 1 71 GLY QA 1 93 LEU H 3.100 . 5.500 4.334 4.082 4.602 . 0 0 "[ . 1 . 2 . 3]" 1
458 1 71 GLY QA 1 93 LEU HB2 2.400 . 4.000 3.531 3.430 3.622 . 0 0 "[ . 1 . 2 . 3]" 1
459 1 71 GLY QA 1 93 LEU QD 2.100 . 5.500 4.572 4.513 4.624 . 0 0 "[ . 1 . 2 . 3]" 1
460 1 71 GLY QA 1 94 LEU H 3.600 . 5.200 3.841 3.603 3.985 . 0 0 "[ . 1 . 2 . 3]" 1
461 1 71 GLY QA 1 94 LEU QD 2.500 . 3.100 1.671 1.542 1.791 0.158 13 0 "[ . 1 . 2 . 3]" 1
462 1 71 GLY QA 1 94 LEU HG 3.700 . 5.400 3.370 2.255 4.207 . 0 0 "[ . 1 . 2 . 3]" 1
463 1 71 GLY QA 1 104 MET ME 3.200 . 4.500 3.830 3.694 3.930 . 0 0 "[ . 1 . 2 . 3]" 1
464 1 72 GLU H 1 72 GLU HA 2.500 . 3.300 2.933 2.902 2.949 . 0 0 "[ . 1 . 2 . 3]" 1
465 1 72 GLU H 1 72 GLU QB 2.300 . 3.000 2.719 2.561 2.904 . 0 0 "[ . 1 . 2 . 3]" 1
466 1 72 GLU H 1 72 GLU HG2 2.800 . 3.800 3.426 2.697 3.821 0.021 11 0 "[ . 1 . 2 . 3]" 1
467 1 72 GLU H 1 72 GLU HG3 2.700 . 3.600 3.507 3.034 3.810 0.210 19 0 "[ . 1 . 2 . 3]" 1
468 1 72 GLU H 1 73 ARG H 2.500 . 3.300 1.781 1.628 1.998 0.072 5 0 "[ . 1 . 2 . 3]" 1
469 1 72 GLU H 1 73 ARG HA 3.500 . 5.500 4.531 4.419 4.675 . 0 0 "[ . 1 . 2 . 3]" 1
470 1 72 GLU H 1 74 LEU H 3.100 . 4.300 3.063 2.738 3.524 . 0 0 "[ . 1 . 2 . 3]" 1
471 1 72 GLU H 1 90 THR MG 4.500 . 5.500 3.413 3.062 3.618 . 0 0 "[ . 1 . 2 . 3]" 1
472 1 72 GLU HA 1 73 ARG H 3.100 . 4.300 3.309 3.246 3.384 . 0 0 "[ . 1 . 2 . 3]" 1
473 1 72 GLU HA 1 74 LEU H 3.900 . 5.500 4.447 4.329 4.749 . 0 0 "[ . 1 . 2 . 3]" 1
474 1 72 GLU HA 1 75 PHE H 3.200 . 4.500 4.376 4.082 4.546 0.046 2 0 "[ . 1 . 2 . 3]" 1
475 1 72 GLU HA 1 90 THR MG 2.800 . 3.800 3.820 3.612 3.874 0.074 23 0 "[ . 1 . 2 . 3]" 1
476 1 72 GLU HA 1 91 GLY HA2 3.800 . 5.500 4.441 4.033 5.015 . 0 0 "[ . 1 . 2 . 3]" 1
477 1 72 GLU QB 1 73 ARG H 2.900 . 4.000 3.439 3.216 3.754 . 0 0 "[ . 1 . 2 . 3]" 1
478 1 72 GLU QB 1 74 LEU H 3.900 . 5.500 4.955 4.760 5.216 . 0 0 "[ . 1 . 2 . 3]" 1
479 1 72 GLU HG2 1 73 ARG H 3.600 . 5.200 4.510 3.254 4.970 . 0 0 "[ . 1 . 2 . 3]" 1
480 1 72 GLU HG3 1 73 ARG H 4.100 . 5.500 4.490 2.888 5.193 . 0 0 "[ . 1 . 2 . 3]" 1
481 1 73 ARG H 1 73 ARG HA 2.600 . 3.400 2.944 2.927 2.952 . 0 0 "[ . 1 . 2 . 3]" 1
482 1 73 ARG H 1 73 ARG HB2 2.800 . 3.800 2.827 2.657 3.155 . 0 0 "[ . 1 . 2 . 3]" 1
483 1 73 ARG H 1 73 ARG HB3 2.300 . 3.000 2.940 2.583 3.054 0.054 24 0 "[ . 1 . 2 . 3]" 1
484 1 73 ARG H 1 73 ARG QD 3.300 . 5.500 4.545 4.054 4.909 . 0 0 "[ . 1 . 2 . 3]" 1
485 1 73 ARG H 1 74 LEU H 2.300 . 3.000 1.763 1.593 1.906 0.007 30 0 "[ . 1 . 2 . 3]" 1
486 1 73 ARG H 1 74 LEU HB2 3.500 . 5.000 3.503 3.368 3.562 . 0 0 "[ . 1 . 2 . 3]" 1
487 1 73 ARG H 1 74 LEU QD 3.100 . 4.300 3.976 3.149 4.199 . 0 0 "[ . 1 . 2 . 3]" 1
488 1 73 ARG H 1 75 PHE H 3.300 . 4.700 3.443 3.134 3.642 . 0 0 "[ . 1 . 2 . 3]" 1
489 1 73 ARG H 1 75 PHE HB3 3.200 . 5.500 5.429 5.061 5.879 0.379 13 0 "[ . 1 . 2 . 3]" 1
490 1 73 ARG HA 1 73 ARG HB2 2.200 . 2.800 2.634 2.419 2.713 . 0 0 "[ . 1 . 2 . 3]" 1
491 1 73 ARG HA 1 73 ARG HB3 2.200 . 5.500 2.981 2.946 3.025 . 0 0 "[ . 1 . 2 . 3]" 1
492 1 73 ARG HA 1 73 ARG QD 2.600 . 3.400 3.086 2.124 3.334 . 0 0 "[ . 1 . 2 . 3]" 1
493 1 73 ARG HA 1 73 ARG HG3 2.500 . 3.300 3.185 2.300 3.545 0.245 26 0 "[ . 1 . 2 . 3]" 1
494 1 73 ARG HA 1 74 LEU H 3.100 . 4.300 3.426 3.365 3.532 . 0 0 "[ . 1 . 2 . 3]" 1
495 1 73 ARG HA 1 75 PHE H 3.300 . 4.700 3.765 3.471 4.109 . 0 0 "[ . 1 . 2 . 3]" 1
496 1 73 ARG HB2 1 74 LEU H 2.900 . 4.000 3.851 3.554 4.099 0.099 6 0 "[ . 1 . 2 . 3]" 1
497 1 73 ARG HB3 1 74 LEU H 2.500 . 3.300 3.127 2.832 3.326 0.026 1 0 "[ . 1 . 2 . 3]" 1
498 1 73 ARG HB3 1 75 PHE H 3.600 . 5.200 5.008 4.898 5.186 . 0 0 "[ . 1 . 2 . 3]" 1
499 1 74 LEU H 1 74 LEU HA 2.600 . 3.400 2.849 2.764 2.879 . 0 0 "[ . 1 . 2 . 3]" 1
500 1 74 LEU H 1 74 LEU HB2 2.400 . 3.100 2.067 2.009 2.099 . 0 0 "[ . 1 . 2 . 3]" 1
501 1 74 LEU H 1 74 LEU HB3 2.600 . 3.400 3.339 3.270 3.402 0.002 27 0 "[ . 1 . 2 . 3]" 1
502 1 74 LEU H 1 74 LEU QD 2.500 . 3.300 3.055 2.018 3.272 . 0 0 "[ . 1 . 2 . 3]" 1
503 1 74 LEU H 1 74 LEU HG 2.700 . 3.600 3.621 3.443 4.053 0.453 20 0 "[ . 1 . 2 . 3]" 1
504 1 74 LEU H 1 77 LEU QD 3.900 . 5.500 4.533 3.952 5.157 . 0 0 "[ . 1 . 2 . 3]" 1
505 1 74 LEU H 1 90 THR MG 3.500 . 5.000 2.628 2.428 2.784 . 0 0 "[ . 1 . 2 . 3]" 1
506 1 74 LEU HA 1 74 LEU HB2 2.400 . 3.100 2.916 2.887 2.965 . 0 0 "[ . 1 . 2 . 3]" 1
507 1 74 LEU HA 1 74 LEU QD 2.100 . 2.700 2.457 1.645 2.652 . 0 0 "[ . 1 . 2 . 3]" 1
508 1 74 LEU HA 1 75 PHE H 3.000 . 4.100 3.416 3.341 3.505 . 0 0 "[ . 1 . 2 . 3]" 1
509 1 74 LEU HA 1 77 LEU QD 2.400 . 3.100 2.365 1.683 3.104 0.017 28 0 "[ . 1 . 2 . 3]" 1
510 1 74 LEU HA 1 78 ILE MD 3.500 . 5.000 3.955 3.532 4.287 . 0 0 "[ . 1 . 2 . 3]" 1
511 1 74 LEU HB2 1 74 LEU QD 2.100 . 2.700 1.996 1.886 2.180 . 0 0 "[ . 1 . 2 . 3]" 1
512 1 74 LEU HB2 1 74 LEU HG 2.400 . 3.100 2.646 2.406 2.705 . 0 0 "[ . 1 . 2 . 3]" 1
513 1 74 LEU HB2 1 75 PHE H 2.700 . 3.600 3.270 2.719 3.594 . 0 0 "[ . 1 . 2 . 3]" 1
514 1 74 LEU HB2 1 90 THR HB 2.400 . 5.500 3.769 3.116 4.114 . 0 0 "[ . 1 . 2 . 3]" 1
515 1 74 LEU HB2 1 90 THR MG 2.900 . 5.500 1.684 1.443 1.784 . 0 0 "[ . 1 . 2 . 3]" 1
516 1 74 LEU HB2 1 111 LEU QD 3.000 . 4.100 3.787 3.580 3.883 . 0 0 "[ . 1 . 2 . 3]" 1
517 1 74 LEU HB3 1 74 LEU QD 2.400 . 3.100 2.133 2.034 2.423 . 0 0 "[ . 1 . 2 . 3]" 1
518 1 74 LEU HB3 1 75 PHE H 2.900 . 4.000 3.467 3.195 3.702 . 0 0 "[ . 1 . 2 . 3]" 1
519 1 74 LEU HB3 1 78 ILE MD 2.400 . 3.100 1.902 1.677 2.320 0.023 6 0 "[ . 1 . 2 . 3]" 1
520 1 74 LEU HB3 1 90 THR MG 2.700 . 3.600 2.288 2.035 2.637 . 0 0 "[ . 1 . 2 . 3]" 1
521 1 74 LEU QD 1 74 LEU HG 2.000 . 2.500 1.879 1.850 1.892 . 0 0 "[ . 1 . 2 . 3]" 1
522 1 74 LEU QD 1 75 PHE H 3.200 . 4.500 4.233 3.781 4.428 . 0 0 "[ . 1 . 2 . 3]" 1
523 1 74 LEU QD 1 77 LEU H 3.000 . 4.100 4.026 3.894 4.098 . 0 0 "[ . 1 . 2 . 3]" 1
524 1 74 LEU QD 1 77 LEU HB2 2.500 . 3.300 2.329 2.007 2.836 . 0 0 "[ . 1 . 2 . 3]" 1
525 1 74 LEU QD 1 77 LEU HB3 2.600 . 3.400 2.965 2.336 3.305 . 0 0 "[ . 1 . 2 . 3]" 1
526 1 74 LEU QD 1 77 LEU QD 2.400 . 3.100 2.948 2.682 3.037 . 0 0 "[ . 1 . 2 . 3]" 1
527 1 74 LEU QD 1 90 THR MG 2.300 . 3.000 2.914 2.807 3.003 0.003 27 0 "[ . 1 . 2 . 3]" 1
528 1 74 LEU QD 1 104 MET QB 3.200 . 4.500 4.162 3.872 4.343 . 0 0 "[ . 1 . 2 . 3]" 1
529 1 74 LEU QD 1 104 MET ME 2.500 . 3.300 2.933 2.634 3.250 . 0 0 "[ . 1 . 2 . 3]" 1
530 1 74 LEU HG 1 75 PHE H 3.200 . 5.500 5.019 4.912 5.249 . 0 0 "[ . 1 . 2 . 3]" 1
531 1 74 LEU HG 1 90 THR MG 3.000 . 4.100 4.035 3.285 4.206 0.106 30 0 "[ . 1 . 2 . 3]" 1
532 1 75 PHE H 1 75 PHE HA 2.500 . 3.300 2.695 2.587 2.746 . 0 0 "[ . 1 . 2 . 3]" 1
533 1 75 PHE H 1 75 PHE HB2 2.400 . 3.100 2.413 2.055 2.723 . 0 0 "[ . 1 . 2 . 3]" 1
534 1 75 PHE H 1 75 PHE HB3 2.400 . 3.100 2.738 2.394 3.170 0.070 13 0 "[ . 1 . 2 . 3]" 1
535 1 75 PHE H 1 75 PHE QD 3.100 . 4.300 4.030 3.699 4.196 . 0 0 "[ . 1 . 2 . 3]" 1
536 1 75 PHE H 1 77 LEU H 4.300 . 5.500 4.078 3.920 4.355 . 0 0 "[ . 1 . 2 . 3]" 1
537 1 75 PHE H 1 78 ILE H 4.500 . 5.500 4.754 4.575 4.885 . 0 0 "[ . 1 . 2 . 3]" 1
538 1 75 PHE H 1 90 THR HB 3.400 . 4.800 4.141 3.691 4.480 . 0 0 "[ . 1 . 2 . 3]" 1
539 1 75 PHE H 1 90 THR MG 3.000 . 4.100 2.513 2.020 2.841 . 0 0 "[ . 1 . 2 . 3]" 1
540 1 75 PHE HA 1 77 LEU H 3.900 . 5.500 3.976 3.722 4.501 . 0 0 "[ . 1 . 2 . 3]" 1
541 1 75 PHE HA 1 78 ILE H 3.300 . 4.700 3.484 3.277 3.785 . 0 0 "[ . 1 . 2 . 3]" 1
542 1 75 PHE HA 1 78 ILE HB 2.800 . 3.800 3.531 3.158 3.837 0.037 11 0 "[ . 1 . 2 . 3]" 1
543 1 75 PHE HA 1 78 ILE MD 3.500 . 5.000 4.018 3.652 4.542 . 0 0 "[ . 1 . 2 . 3]" 1
544 1 75 PHE HA 1 78 ILE MG 3.800 . 5.500 4.563 4.259 4.839 . 0 0 "[ . 1 . 2 . 3]" 1
545 1 75 PHE HA 1 79 GLN H 3.600 . 5.200 4.613 4.350 4.839 . 0 0 "[ . 1 . 2 . 3]" 1
546 1 75 PHE HA 1 86 ALA MB 3.500 . 5.000 3.219 2.819 3.562 . 0 0 "[ . 1 . 2 . 3]" 1
547 1 75 PHE HB2 1 90 THR MG 2.800 . 3.700 3.000 2.503 3.300 . 0 0 "[ . 1 . 2 . 3]" 1
548 1 75 PHE HB3 1 77 LEU H 4.600 . 5.500 4.641 4.510 4.758 . 0 0 "[ . 1 . 2 . 3]" 1
549 1 75 PHE HB3 1 90 THR MG 3.200 . 4.500 4.168 3.754 4.527 0.027 8 0 "[ . 1 . 2 . 3]" 1
550 1 75 PHE QD 1 78 ILE HB 4.000 . 5.000 3.801 3.471 4.292 . 0 0 "[ . 1 . 2 . 3]" 1
551 1 75 PHE QD 1 78 ILE MD 4.000 . 5.000 5.007 4.214 5.128 0.128 11 0 "[ . 1 . 2 . 3]" 1
552 1 75 PHE QD 1 78 ILE MG 4.000 . 5.000 4.714 4.175 5.009 0.009 30 0 "[ . 1 . 2 . 3]" 1
553 1 75 PHE QD 1 79 GLN H 3.800 . 5.500 4.876 4.336 5.561 0.061 9 0 "[ . 1 . 2 . 3]" 1
554 1 75 PHE QD 1 86 ALA HA 4.000 . 5.000 4.498 4.124 5.007 0.007 23 0 "[ . 1 . 2 . 3]" 1
555 1 75 PHE QD 1 86 ALA MB 3.200 . 4.000 2.425 1.802 3.568 . 0 0 "[ . 1 . 2 . 3]" 1
556 1 75 PHE QD 1 88 LYS H 4.000 . 5.500 4.801 4.177 5.521 0.021 7 0 "[ . 1 . 2 . 3]" 1
557 1 75 PHE QD 1 90 THR H 3.400 . 4.800 4.375 2.759 4.869 0.069 21 0 "[ . 1 . 2 . 3]" 1
558 1 75 PHE QD 1 91 GLY H 4.200 . 5.500 4.285 2.595 5.138 . 0 0 "[ . 1 . 2 . 3]" 1
559 1 75 PHE QE 1 86 ALA MB 3.200 . 4.000 2.518 1.808 3.933 . 0 0 "[ . 1 . 2 . 3]" 1
560 1 77 LEU H 1 77 LEU HA 2.500 . 3.300 2.908 2.870 2.924 . 0 0 "[ . 1 . 2 . 3]" 1
561 1 77 LEU H 1 77 LEU HB2 2.600 . 5.500 2.364 2.162 2.447 . 0 0 "[ . 1 . 2 . 3]" 1
562 1 77 LEU H 1 77 LEU HB3 2.500 . 3.300 3.587 3.355 3.641 0.341 17 0 "[ . 1 . 2 . 3]" 1
563 1 77 LEU H 1 77 LEU QD 2.700 . 3.600 2.823 1.937 3.351 . 0 0 "[ . 1 . 2 . 3]" 1
564 1 77 LEU H 1 78 ILE H 2.400 . 3.100 2.295 2.190 2.483 . 0 0 "[ . 1 . 2 . 3]" 1
565 1 77 LEU H 1 78 ILE HG12 4.000 . 5.500 3.450 3.254 3.727 . 0 0 "[ . 1 . 2 . 3]" 1
566 1 77 LEU H 1 79 GLN H 3.400 . 4.800 4.032 3.844 4.326 . 0 0 "[ . 1 . 2 . 3]" 1
567 1 77 LEU HA 1 78 ILE H 3.000 . 4.100 3.486 3.427 3.554 . 0 0 "[ . 1 . 2 . 3]" 1
568 1 77 LEU HA 1 79 GLN H 3.500 . 5.000 4.267 4.103 4.530 . 0 0 "[ . 1 . 2 . 3]" 1
569 1 77 LEU HB2 1 77 LEU QD 2.300 . 2.800 2.158 1.949 2.349 . 0 0 "[ . 1 . 2 . 3]" 1
570 1 77 LEU HB2 1 77 LEU HG 2.600 . 3.400 2.550 2.418 2.981 . 0 0 "[ . 1 . 2 . 3]" 1
571 1 77 LEU HB2 1 78 ILE H 2.900 . 4.000 3.033 2.704 3.289 . 0 0 "[ . 1 . 2 . 3]" 1
572 1 77 LEU HB2 1 78 ILE HA 4.400 . 5.500 4.509 4.341 4.947 . 0 0 "[ . 1 . 2 . 3]" 1
573 1 77 LEU HB2 1 78 ILE MD 3.300 . 4.700 3.732 3.304 4.381 . 0 0 "[ . 1 . 2 . 3]" 1
574 1 77 LEU HB2 1 81 MET ME 2.200 . 5.500 5.270 4.834 5.744 0.244 19 0 "[ . 1 . 2 . 3]" 1
575 1 77 LEU HB3 1 77 LEU QD 2.200 . 2.800 2.283 2.054 2.520 . 0 0 "[ . 1 . 2 . 3]" 1
576 1 77 LEU HB3 1 77 LEU HG 2.400 . 3.100 2.660 2.270 3.024 . 0 0 "[ . 1 . 2 . 3]" 1
577 1 77 LEU HB3 1 78 ILE H 2.700 . 3.600 3.803 3.405 4.031 0.431 14 0 "[ . 1 . 2 . 3]" 1
578 1 77 LEU MD1 1 77 LEU MD2 2.000 . 2.500 2.034 1.862 2.093 . 0 0 "[ . 1 . 2 . 3]" 1
579 1 77 LEU QD 1 77 LEU HG 2.200 . 2.500 1.877 1.855 1.892 . 0 0 "[ . 1 . 2 . 3]" 1
580 1 77 LEU QD 1 80 ALA MB 2.800 . 3.800 3.503 3.311 3.741 . 0 0 "[ . 1 . 2 . 3]" 1
581 1 78 ILE H 1 78 ILE HA 2.800 . 3.800 2.843 2.803 2.879 . 0 0 "[ . 1 . 2 . 3]" 1
582 1 78 ILE H 1 78 ILE HB 2.500 . 3.300 2.757 2.594 2.915 . 0 0 "[ . 1 . 2 . 3]" 1
583 1 78 ILE H 1 78 ILE MD 2.700 . 3.600 3.124 2.793 3.500 . 0 0 "[ . 1 . 2 . 3]" 1
584 1 78 ILE H 1 78 ILE HG12 3.200 . 5.500 1.872 1.687 2.107 . 0 0 "[ . 1 . 2 . 3]" 1
585 1 78 ILE H 1 78 ILE MG 2.500 . 5.500 3.773 3.731 3.805 . 0 0 "[ . 1 . 2 . 3]" 1
586 1 78 ILE H 1 79 GLN H 2.600 . 3.400 2.550 2.382 2.693 . 0 0 "[ . 1 . 2 . 3]" 1
587 1 78 ILE H 1 80 ALA H 3.400 . 4.800 3.911 3.715 4.113 . 0 0 "[ . 1 . 2 . 3]" 1
588 1 78 ILE H 1 115 VAL QG 4.500 . 5.500 4.935 4.675 5.134 . 0 0 "[ . 1 . 2 . 3]" 1
589 1 78 ILE HA 1 78 ILE HB 2.600 . 3.400 2.995 2.980 3.011 . 0 0 "[ . 1 . 2 . 3]" 1
590 1 78 ILE HA 1 78 ILE MD 2.400 . 3.100 2.206 2.079 2.547 . 0 0 "[ . 1 . 2 . 3]" 1
591 1 78 ILE HA 1 78 ILE MG 2.000 . 2.500 2.141 2.062 2.369 . 0 0 "[ . 1 . 2 . 3]" 1
592 1 78 ILE HA 1 79 GLN H 3.200 . 4.500 3.522 3.500 3.542 . 0 0 "[ . 1 . 2 . 3]" 1
593 1 78 ILE HA 1 79 GLN HB2 2.600 . 5.500 5.498 5.459 5.531 0.031 14 0 "[ . 1 . 2 . 3]" 1
594 1 78 ILE HA 1 80 ALA H 3.300 . 4.700 3.448 3.287 3.542 . 0 0 "[ . 1 . 2 . 3]" 1
595 1 78 ILE HA 1 81 MET H 3.000 . 4.100 2.985 2.900 3.086 . 0 0 "[ . 1 . 2 . 3]" 1
596 1 78 ILE HA 1 81 MET HB2 2.700 . 3.600 3.512 3.236 3.619 0.019 9 0 "[ . 1 . 2 . 3]" 1
597 1 78 ILE HA 1 81 MET HB3 3.000 . 5.500 4.668 4.505 4.808 . 0 0 "[ . 1 . 2 . 3]" 1
598 1 78 ILE HA 1 81 MET ME 2.700 . 3.600 3.266 2.754 3.651 0.051 19 0 "[ . 1 . 2 . 3]" 1
599 1 78 ILE HA 1 81 MET QG 3.300 . 4.500 2.196 1.824 2.729 0.076 16 0 "[ . 1 . 2 . 3]" 1
600 1 78 ILE HA 1 82 HIS H 3.700 . 5.400 4.168 3.956 4.420 . 0 0 "[ . 1 . 2 . 3]" 1
601 1 78 ILE HA 1 86 ALA MB 3.600 . 5.200 4.153 3.797 4.401 . 0 0 "[ . 1 . 2 . 3]" 1
602 1 78 ILE HA 1 111 LEU QD 3.500 . 5.500 5.447 5.273 5.522 0.022 4 0 "[ . 1 . 2 . 3]" 1
603 1 78 ILE HA 1 115 VAL QG 3.100 . 4.300 3.506 3.352 3.726 . 0 0 "[ . 1 . 2 . 3]" 1
604 1 78 ILE HB 1 78 ILE MD 2.300 . 5.500 3.218 3.173 3.230 . 0 0 "[ . 1 . 2 . 3]" 1
605 1 78 ILE HB 1 78 ILE MG 1.900 . 2.400 2.089 2.077 2.124 . 0 0 "[ . 1 . 2 . 3]" 1
606 1 78 ILE HB 1 81 MET H 3.500 . 5.000 5.084 5.045 5.131 0.131 14 0 "[ . 1 . 2 . 3]" 1
607 1 78 ILE HB 1 86 ALA H 4.300 . 5.500 4.384 4.018 4.824 . 0 0 "[ . 1 . 2 . 3]" 1
608 1 78 ILE HB 1 86 ALA HA 3.400 . 4.800 3.674 3.361 4.045 . 0 0 "[ . 1 . 2 . 3]" 1
609 1 78 ILE HB 1 86 ALA MB 2.300 . 3.000 1.773 1.579 2.040 0.021 24 0 "[ . 1 . 2 . 3]" 1
610 1 78 ILE HB 1 89 ILE MG 2.700 . 5.500 4.361 4.108 4.708 . 0 0 "[ . 1 . 2 . 3]" 1
611 1 78 ILE HB 1 115 VAL QG 3.600 . 5.200 4.127 3.989 4.285 . 0 0 "[ . 1 . 2 . 3]" 1
612 1 78 ILE MD 1 78 ILE MG 1.900 . 2.400 1.973 1.745 2.111 . 0 0 "[ . 1 . 2 . 3]" 1
613 1 78 ILE MD 1 79 GLN H 3.400 . 4.800 4.616 4.489 4.824 0.024 27 0 "[ . 1 . 2 . 3]" 1
614 1 78 ILE MD 1 81 MET H 4.300 . 5.500 4.758 4.526 4.959 . 0 0 "[ . 1 . 2 . 3]" 1
615 1 78 ILE MD 1 81 MET HB3 2.700 . 5.500 5.205 4.835 5.411 . 0 0 "[ . 1 . 2 . 3]" 1
616 1 78 ILE MD 1 81 MET ME 2.100 . 2.700 2.402 1.803 2.780 0.080 3 0 "[ . 1 . 2 . 3]" 1
617 1 78 ILE MD 1 86 ALA MB 3.000 . 4.100 3.993 3.754 4.144 0.044 6 0 "[ . 1 . 2 . 3]" 1
618 1 78 ILE MD 1 89 ILE HB 2.700 . 3.600 3.578 3.284 3.643 0.043 12 0 "[ . 1 . 2 . 3]" 1
619 1 78 ILE MD 1 89 ILE MD 3.400 . 4.800 3.937 3.743 4.052 . 0 0 "[ . 1 . 2 . 3]" 1
620 1 78 ILE MD 1 89 ILE MG 2.100 . 2.700 2.682 2.453 2.740 0.040 1 0 "[ . 1 . 2 . 3]" 1
621 1 78 ILE MD 1 90 THR H 2.800 . 3.800 3.141 2.851 3.379 . 0 0 "[ . 1 . 2 . 3]" 1
622 1 78 ILE MD 1 90 THR HB 2.200 . 2.800 2.471 2.113 2.821 0.021 30 0 "[ . 1 . 2 . 3]" 1
623 1 78 ILE MD 1 90 THR MG 2.800 . 3.800 3.225 3.027 3.512 . 0 0 "[ . 1 . 2 . 3]" 1
624 1 78 ILE MD 1 91 GLY H 3.000 . 5.500 5.076 4.903 5.372 . 0 0 "[ . 1 . 2 . 3]" 1
625 1 78 ILE MD 1 93 LEU HB2 2.100 . 5.500 5.069 4.885 5.201 . 0 0 "[ . 1 . 2 . 3]" 1
626 1 78 ILE MD 1 112 ARG HA 3.300 . 4.700 4.538 4.169 4.782 0.082 29 0 "[ . 1 . 2 . 3]" 1
627 1 78 ILE MD 1 115 VAL QG 2.700 . 3.000 1.717 1.551 1.989 0.249 28 0 "[ . 1 . 2 . 3]" 1
628 1 78 ILE MD 1 118 ALA MB 3.300 . 5.500 5.380 5.161 5.526 0.026 16 0 "[ . 1 . 2 . 3]" 1
629 1 78 ILE HG13 1 90 THR H 2.800 . 3.800 2.500 2.267 2.924 . 0 0 "[ . 1 . 2 . 3]" 1
630 1 78 ILE MG 1 79 GLN H 2.800 . 3.800 3.755 3.521 3.857 0.057 21 0 "[ . 1 . 2 . 3]" 1
631 1 78 ILE MG 1 79 GLN HA 3.400 . 4.800 3.976 3.717 4.151 . 0 0 "[ . 1 . 2 . 3]" 1
632 1 78 ILE MG 1 79 GLN HB2 2.300 . 5.500 5.381 5.076 5.522 0.022 11 0 "[ . 1 . 2 . 3]" 1
633 1 78 ILE MG 1 80 ALA H 3.200 . 4.500 4.407 4.234 4.501 0.001 2 0 "[ . 1 . 2 . 3]" 1
634 1 78 ILE MG 1 81 MET H 3.300 . 4.700 3.729 3.585 3.817 . 0 0 "[ . 1 . 2 . 3]" 1
635 1 78 ILE MG 1 81 MET HB2 3.600 . 5.200 2.866 2.605 3.120 . 0 0 "[ . 1 . 2 . 3]" 1
636 1 78 ILE MG 1 81 MET ME 2.600 . 3.400 3.120 2.450 3.395 . 0 0 "[ . 1 . 2 . 3]" 1
637 1 78 ILE MG 1 81 MET QG 3.000 . 4.100 3.015 2.502 3.564 . 0 0 "[ . 1 . 2 . 3]" 1
638 1 78 ILE MG 1 82 HIS H 3.400 . 4.800 3.432 3.166 3.649 . 0 0 "[ . 1 . 2 . 3]" 1
639 1 78 ILE MG 1 82 HIS HB3 3.300 . 4.700 4.437 3.923 4.694 . 0 0 "[ . 1 . 2 . 3]" 1
640 1 78 ILE MG 1 82 HIS HD2 3.200 . 4.400 4.379 3.776 4.552 0.152 12 0 "[ . 1 . 2 . 3]" 1
641 1 78 ILE MG 1 86 ALA H 2.900 . 4.000 3.928 3.749 4.028 0.028 10 0 "[ . 1 . 2 . 3]" 1
642 1 78 ILE MG 1 86 ALA HA 2.100 . 5.500 2.971 2.745 3.338 . 0 0 "[ . 1 . 2 . 3]" 1
643 1 78 ILE MG 1 86 ALA MB 2.300 . 3.000 2.322 1.825 2.647 . 0 0 "[ . 1 . 2 . 3]" 1
644 1 78 ILE MG 1 89 ILE HB 2.300 . 3.000 2.310 1.836 2.652 . 0 0 "[ . 1 . 2 . 3]" 1
645 1 78 ILE MG 1 89 ILE MD 2.200 . 2.800 1.713 1.583 1.854 0.017 17 0 "[ . 1 . 2 . 3]" 1
646 1 78 ILE MG 1 90 THR HB 3.100 . 4.300 3.561 3.247 3.825 . 0 0 "[ . 1 . 2 . 3]" 1
647 1 78 ILE MG 1 93 LEU QD 2.500 . 5.500 4.313 4.113 4.467 . 0 0 "[ . 1 . 2 . 3]" 1
648 1 78 ILE MG 1 115 VAL QG 1.800 . 2.200 1.936 1.707 2.151 . 0 0 "[ . 1 . 2 . 3]" 1
649 1 78 ILE MG 1 119 VAL QG 2.800 . 3.800 3.175 3.048 3.652 . 0 0 "[ . 1 . 2 . 3]" 1
650 1 79 GLN H 1 79 GLN HA 2.600 . 3.400 2.770 2.734 2.795 . 0 0 "[ . 1 . 2 . 3]" 1
651 1 79 GLN H 1 79 GLN HB2 2.200 . 2.800 2.143 2.077 2.202 . 0 0 "[ . 1 . 2 . 3]" 1
652 1 79 GLN H 1 79 GLN HG2 3.100 . 4.300 4.126 3.824 4.346 0.046 23 0 "[ . 1 . 2 . 3]" 1
653 1 79 GLN H 1 79 GLN HG3 3.200 . 4.500 3.041 2.806 3.374 . 0 0 "[ . 1 . 2 . 3]" 1
654 1 79 GLN H 1 80 ALA H 2.500 . 3.300 2.688 2.627 2.778 . 0 0 "[ . 1 . 2 . 3]" 1
655 1 79 GLN H 1 81 MET H 3.600 . 5.200 4.343 4.271 4.447 . 0 0 "[ . 1 . 2 . 3]" 1
656 1 79 GLN H 1 84 THR HA 3.600 . 5.200 4.809 4.600 5.101 . 0 0 "[ . 1 . 2 . 3]" 1
657 1 79 GLN H 1 86 ALA H 5.300 . 5.500 4.781 4.604 5.010 . 0 0 "[ . 1 . 2 . 3]" 1
658 1 79 GLN H 1 86 ALA HA 3.800 . 5.500 5.496 5.268 5.580 0.080 30 0 "[ . 1 . 2 . 3]" 1
659 1 79 GLN H 1 86 ALA MB 2.300 . 3.000 2.800 2.469 2.944 . 0 0 "[ . 1 . 2 . 3]" 1
660 1 79 GLN HA 1 79 GLN HB2 2.400 . 3.100 2.950 2.915 2.968 . 0 0 "[ . 1 . 2 . 3]" 1
661 1 79 GLN HA 1 79 GLN HG2 2.500 . 3.300 2.617 2.309 3.163 . 0 0 "[ . 1 . 2 . 3]" 1
662 1 79 GLN HA 1 79 GLN HG3 2.600 . 3.400 2.507 2.111 2.859 . 0 0 "[ . 1 . 2 . 3]" 1
663 1 79 GLN HA 1 80 ALA H 2.900 . 4.000 3.381 3.324 3.417 . 0 0 "[ . 1 . 2 . 3]" 1
664 1 79 GLN HA 1 81 MET H 3.600 . 5.200 4.376 4.231 4.563 . 0 0 "[ . 1 . 2 . 3]" 1
665 1 79 GLN HA 1 82 HIS H 3.300 . 4.700 3.640 3.443 4.087 . 0 0 "[ . 1 . 2 . 3]" 1
666 1 79 GLN HA 1 82 HIS HB2 3.400 . 4.800 4.103 3.317 4.637 . 0 0 "[ . 1 . 2 . 3]" 1
667 1 79 GLN HA 1 84 THR HA 2.300 . 3.000 2.447 2.276 2.726 . 0 0 "[ . 1 . 2 . 3]" 1
668 1 79 GLN HA 1 86 ALA H 3.200 . 4.500 3.207 2.747 3.471 . 0 0 "[ . 1 . 2 . 3]" 1
669 1 79 GLN HA 1 86 ALA HA 3.600 . 5.200 5.146 4.612 5.300 0.100 21 0 "[ . 1 . 2 . 3]" 1
670 1 79 GLN HA 1 86 ALA MB 2.400 . 3.100 2.840 1.972 3.105 0.005 2 0 "[ . 1 . 2 . 3]" 1
671 1 79 GLN HA 1 89 ILE MD 3.500 . 5.000 4.493 4.179 4.791 . 0 0 "[ . 1 . 2 . 3]" 1
672 1 79 GLN HB2 1 80 ALA H 2.600 . 3.400 3.306 3.205 3.474 0.074 16 0 "[ . 1 . 2 . 3]" 1
673 1 79 GLN HB3 1 80 ALA H 2.700 . 3.600 3.639 3.614 3.672 0.072 12 0 "[ . 1 . 2 . 3]" 1
674 1 79 GLN HB3 1 80 ALA MB 3.200 . 4.500 4.478 4.346 4.534 0.034 25 0 "[ . 1 . 2 . 3]" 1
675 1 79 GLN HG2 1 84 THR H 3.700 . 5.400 3.606 3.333 4.660 . 0 0 "[ . 1 . 2 . 3]" 1
676 1 79 GLN HG2 1 86 ALA H 3.500 . 5.000 3.613 3.116 4.013 . 0 0 "[ . 1 . 2 . 3]" 1
677 1 79 GLN HG2 1 86 ALA MB 2.700 . 3.600 3.496 3.028 3.790 0.190 21 0 "[ . 1 . 2 . 3]" 1
678 1 79 GLN HG3 1 86 ALA MB 2.800 . 3.800 2.223 1.804 2.548 . 0 0 "[ . 1 . 2 . 3]" 1
679 1 80 ALA H 1 80 ALA HA 2.300 . 3.000 2.890 2.875 2.915 . 0 0 "[ . 1 . 2 . 3]" 1
680 1 80 ALA H 1 80 ALA MB 2.000 . 2.500 2.261 2.209 2.314 . 0 0 "[ . 1 . 2 . 3]" 1
681 1 80 ALA H 1 81 MET H 2.400 . 3.100 2.370 2.228 2.443 . 0 0 "[ . 1 . 2 . 3]" 1
682 1 80 ALA H 1 82 HIS H 3.000 . 4.100 3.871 3.522 4.205 0.105 16 0 "[ . 1 . 2 . 3]" 1
683 1 80 ALA H 1 84 THR HA 4.100 . 5.500 5.577 5.468 5.672 0.172 19 0 "[ . 1 . 2 . 3]" 1
684 1 80 ALA HA 1 80 ALA MB 1.800 . 2.200 2.123 2.111 2.131 . 0 0 "[ . 1 . 2 . 3]" 1
685 1 80 ALA HA 1 81 MET H 2.900 . 4.000 3.531 3.494 3.552 . 0 0 "[ . 1 . 2 . 3]" 1
686 1 80 ALA MB 1 81 MET H 2.500 . 3.300 2.573 2.466 2.742 . 0 0 "[ . 1 . 2 . 3]" 1
687 1 80 ALA MB 1 81 MET HB3 3.100 . 5.500 5.006 4.887 5.104 . 0 0 "[ . 1 . 2 . 3]" 1
688 1 80 ALA MB 1 81 MET ME 3.500 . 5.000 5.051 5.014 5.102 0.102 3 0 "[ . 1 . 2 . 3]" 1
689 1 80 ALA MB 1 81 MET QG 3.100 . 4.000 2.792 2.622 2.922 . 0 0 "[ . 1 . 2 . 3]" 1
690 1 81 MET H 1 81 MET HA 2.600 . 3.400 2.863 2.846 2.878 . 0 0 "[ . 1 . 2 . 3]" 1
691 1 81 MET H 1 81 MET HB2 2.400 . 3.100 2.819 2.763 2.882 . 0 0 "[ . 1 . 2 . 3]" 1
692 1 81 MET H 1 81 MET HB3 2.700 . 3.600 3.578 3.551 3.598 . 0 0 "[ . 1 . 2 . 3]" 1
693 1 81 MET H 1 81 MET QG 2.600 . 3.400 1.857 1.749 2.051 0.051 21 0 "[ . 1 . 2 . 3]" 1
694 1 81 MET H 1 82 HIS H 2.200 . 2.800 2.499 2.402 2.623 . 0 0 "[ . 1 . 2 . 3]" 1
695 1 81 MET H 1 86 ALA MB 3.800 . 5.500 5.325 4.641 5.530 0.030 1 0 "[ . 1 . 2 . 3]" 1
696 1 81 MET H 1 115 VAL QG 4.200 . 5.500 5.051 4.796 5.257 . 0 0 "[ . 1 . 2 . 3]" 1
697 1 81 MET HA 1 81 MET ME 3.100 . 5.500 4.696 4.439 4.844 . 0 0 "[ . 1 . 2 . 3]" 1
698 1 81 MET HA 1 81 MET QG 2.300 . 5.500 2.736 2.650 2.867 . 0 0 "[ . 1 . 2 . 3]" 1
699 1 81 MET HB2 1 81 MET QG 2.300 . 3.000 2.294 2.121 2.500 . 0 0 "[ . 1 . 2 . 3]" 1
700 1 81 MET HB2 1 82 HIS H 2.600 . 3.400 2.579 2.340 2.851 . 0 0 "[ . 1 . 2 . 3]" 1
701 1 81 MET HB2 1 82 HIS HA 3.000 . 5.500 4.278 3.793 4.442 . 0 0 "[ . 1 . 2 . 3]" 1
702 1 81 MET HB2 1 89 ILE MD 3.600 . 5.200 4.479 4.188 4.738 . 0 0 "[ . 1 . 2 . 3]" 1
703 1 81 MET HB2 1 115 VAL QG 2.900 . 3.800 3.433 3.218 3.624 . 0 0 "[ . 1 . 2 . 3]" 1
704 1 81 MET HB3 1 81 MET QG 2.500 . 3.000 2.368 2.164 2.525 . 0 0 "[ . 1 . 2 . 3]" 1
705 1 81 MET HB3 1 82 HIS H 2.900 . 4.000 3.889 3.719 4.049 0.049 30 0 "[ . 1 . 2 . 3]" 1
706 1 81 MET HB3 1 115 VAL QG 2.700 . 5.500 4.013 3.683 4.173 . 0 0 "[ . 1 . 2 . 3]" 1
707 1 81 MET HB3 1 116 ASP H 4.300 . 5.500 5.489 5.163 5.594 0.094 1 0 "[ . 1 . 2 . 3]" 1
708 1 81 MET ME 1 81 MET QG 2.400 . 3.100 2.106 1.986 2.295 . 0 0 "[ . 1 . 2 . 3]" 1
709 1 81 MET ME 1 89 ILE MD 4.900 . 5.500 4.876 4.503 5.081 . 0 0 "[ . 1 . 2 . 3]" 1
710 1 81 MET ME 1 89 ILE MG 3.000 . 4.100 4.142 4.021 4.197 0.097 14 0 "[ . 1 . 2 . 3]" 1
711 1 81 MET ME 1 111 LEU QD 2.600 . 3.400 2.810 2.556 3.018 . 0 0 "[ . 1 . 2 . 3]" 1
712 1 81 MET ME 1 112 ARG HA 2.400 . 3.100 1.899 1.678 2.194 0.022 11 0 "[ . 1 . 2 . 3]" 1
713 1 81 MET ME 1 112 ARG HD2 2.800 . 3.800 3.948 3.591 4.726 0.926 6 6 "[ .+ 1 * *.* 2 * - 3]" 1
714 1 81 MET ME 1 112 ARG QG 3.000 . 4.100 2.621 1.818 3.157 0.082 16 0 "[ . 1 . 2 . 3]" 1
715 1 81 MET ME 1 115 VAL HA 3.900 . 5.500 4.760 4.506 5.002 . 0 0 "[ . 1 . 2 . 3]" 1
716 1 81 MET ME 1 115 VAL QG 2.600 . 3.400 1.830 1.749 1.987 0.051 19 0 "[ . 1 . 2 . 3]" 1
717 1 81 MET ME 1 116 ASP HA 3.200 . 4.500 4.580 4.526 4.654 0.154 30 0 "[ . 1 . 2 . 3]" 1
718 1 81 MET ME 1 119 VAL QG 4.900 . 5.500 4.611 4.485 4.712 . 0 0 "[ . 1 . 2 . 3]" 1
719 1 81 MET QG 1 82 HIS H 3.400 . 4.800 3.576 3.388 3.719 . 0 0 "[ . 1 . 2 . 3]" 1
720 1 81 MET QG 1 115 VAL QG 2.900 . 4.000 3.460 2.561 3.769 . 0 0 "[ . 1 . 2 . 3]" 1
721 1 82 HIS H 1 82 HIS HA 2.700 . 3.600 2.941 2.844 2.948 . 0 0 "[ . 1 . 2 . 3]" 1
722 1 82 HIS H 1 82 HIS HB2 2.700 . 3.600 2.456 2.166 2.769 . 0 0 "[ . 1 . 2 . 3]" 1
723 1 82 HIS H 1 82 HIS HB3 2.900 . 4.000 3.562 3.107 3.763 . 0 0 "[ . 1 . 2 . 3]" 1
724 1 82 HIS H 1 86 ALA MB 3.600 . 5.200 4.763 4.124 5.084 . 0 0 "[ . 1 . 2 . 3]" 1
725 1 82 HIS H 1 89 ILE MD 4.000 . 5.500 4.378 4.120 4.727 . 0 0 "[ . 1 . 2 . 3]" 1
726 1 82 HIS H 1 115 VAL QG 4.300 . 5.500 4.982 4.597 5.277 . 0 0 "[ . 1 . 2 . 3]" 1
727 1 82 HIS HA 1 82 HIS HB2 2.400 . 3.100 2.972 2.728 3.022 . 0 0 "[ . 1 . 2 . 3]" 1
728 1 82 HIS HA 1 82 HIS HB3 2.300 . 3.000 2.623 2.372 2.920 . 0 0 "[ . 1 . 2 . 3]" 1
729 1 82 HIS HA 1 85 LEU HB2 3.500 . 5.000 4.356 4.017 4.936 . 0 0 "[ . 1 . 2 . 3]" 1
730 1 82 HIS HB2 1 84 THR H 4.600 . 5.500 4.625 3.368 5.654 0.154 16 0 "[ . 1 . 2 . 3]" 1
731 1 82 HIS HB2 1 85 LEU HB3 2.900 . 4.000 3.841 3.072 4.655 0.655 30 2 "[ . 1 . 2 - . +]" 1
732 1 82 HIS HB2 1 86 ALA H 3.500 . 5.000 4.208 3.420 4.919 . 0 0 "[ . 1 . 2 . 3]" 1
733 1 82 HIS HB2 1 86 ALA MB 3.600 . 5.200 4.236 3.257 4.706 . 0 0 "[ . 1 . 2 . 3]" 1
734 1 82 HIS HB2 1 89 ILE MD 2.600 . 3.400 2.858 2.708 3.129 . 0 0 "[ . 1 . 2 . 3]" 1
735 1 82 HIS HB2 1 119 VAL QG 3.300 . 4.700 3.278 2.891 3.951 . 0 0 "[ . 1 . 2 . 3]" 1
736 1 82 HIS HB3 1 85 LEU HB3 3.300 . 4.700 3.189 2.691 3.991 . 0 0 "[ . 1 . 2 . 3]" 1
737 1 82 HIS HB3 1 86 ALA H 3.600 . 5.200 4.609 3.228 5.229 0.029 11 0 "[ . 1 . 2 . 3]" 1
738 1 82 HIS HB3 1 89 ILE MD 2.600 . 3.400 3.445 3.281 3.565 0.165 19 0 "[ . 1 . 2 . 3]" 1
739 1 82 HIS HB3 1 115 VAL QG 3.600 . 5.500 5.729 5.497 5.932 0.432 27 0 "[ . 1 . 2 . 3]" 1
740 1 82 HIS HB3 1 119 VAL QG 3.700 . 5.400 3.233 3.003 4.451 . 0 0 "[ . 1 . 2 . 3]" 1
741 1 82 HIS HD2 1 89 ILE MD 4.000 . 5.000 4.368 1.936 4.812 0.064 30 0 "[ . 1 . 2 . 3]" 1
742 1 82 HIS HD2 1 115 VAL QG 4.000 . 5.000 4.301 3.757 5.033 0.033 30 0 "[ . 1 . 2 . 3]" 1
743 1 82 HIS HD2 1 119 VAL QG 3.200 . 4.500 3.408 2.804 3.905 . 0 0 "[ . 1 . 2 . 3]" 1
744 1 82 HIS HE1 1 119 VAL HA 4.000 . 5.000 5.142 5.096 5.207 0.207 30 0 "[ . 1 . 2 . 3]" 1
745 1 82 HIS HE1 1 119 VAL QG 3.200 . 4.000 2.242 1.828 2.508 . 0 0 "[ . 1 . 2 . 3]" 1
746 1 84 THR H 1 84 THR MG 3.300 . 4.700 3.146 2.307 3.910 . 0 0 "[ . 1 . 2 . 3]" 1
747 1 84 THR H 1 86 ALA H 3.900 . 5.500 4.420 3.780 5.507 0.007 16 0 "[ . 1 . 2 . 3]" 1
748 1 84 THR HA 1 86 ALA H 2.800 . 3.800 3.026 2.942 3.247 . 0 0 "[ . 1 . 2 . 3]" 1
749 1 84 THR HA 1 86 ALA MB 2.500 . 5.500 3.745 3.525 4.164 . 0 0 "[ . 1 . 2 . 3]" 1
750 1 84 THR MG 1 86 ALA H 3.700 . 5.400 4.513 3.809 5.073 . 0 0 "[ . 1 . 2 . 3]" 1
751 1 85 LEU H 1 85 LEU HB2 3.200 . 4.500 2.190 2.061 2.677 . 0 0 "[ . 1 . 2 . 3]" 1
752 1 85 LEU H 1 85 LEU MD1 4.000 . 5.500 3.581 2.516 4.315 . 0 0 "[ . 1 . 2 . 3]" 1
753 1 85 LEU H 1 86 ALA H 2.600 . 3.400 2.490 1.763 2.818 0.037 16 0 "[ . 1 . 2 . 3]" 1
754 1 85 LEU HB2 1 86 ALA H 2.800 . 3.800 3.820 3.719 3.894 0.094 18 0 "[ . 1 . 2 . 3]" 1
755 1 85 LEU HB3 1 89 ILE MD 2.300 . 3.000 2.485 2.143 3.029 0.029 30 0 "[ . 1 . 2 . 3]" 1
756 1 85 LEU HB3 1 119 VAL QG 3.600 . 4.000 2.430 1.997 3.648 0.003 3 0 "[ . 1 . 2 . 3]" 1
757 1 86 ALA H 1 86 ALA HA 2.500 . 3.300 2.853 2.814 2.897 . 0 0 "[ . 1 . 2 . 3]" 1
758 1 86 ALA H 1 86 ALA MB 2.100 . 2.700 2.179 2.044 2.262 . 0 0 "[ . 1 . 2 . 3]" 1
759 1 86 ALA H 1 88 LYS H 3.800 . 5.500 5.142 4.977 5.322 . 0 0 "[ . 1 . 2 . 3]" 1
760 1 86 ALA H 1 89 ILE H 4.600 . 5.500 5.438 5.295 5.577 0.077 9 0 "[ . 1 . 2 . 3]" 1
761 1 86 ALA H 1 89 ILE MD 3.400 . 5.500 3.060 2.927 3.182 . 0 0 "[ . 1 . 2 . 3]" 1
762 1 86 ALA HA 1 86 ALA MB 1.900 . 2.400 2.112 2.080 2.130 . 0 0 "[ . 1 . 2 . 3]" 1
763 1 86 ALA HA 1 88 LYS H 3.900 . 5.500 3.021 2.878 3.248 . 0 0 "[ . 1 . 2 . 3]" 1
764 1 86 ALA HA 1 89 ILE H 3.000 . 4.100 2.718 2.628 2.826 . 0 0 "[ . 1 . 2 . 3]" 1
765 1 86 ALA HA 1 89 ILE HA 3.200 . 4.500 4.622 4.547 4.702 0.202 30 0 "[ . 1 . 2 . 3]" 1
766 1 86 ALA HA 1 89 ILE HB 2.200 . 2.800 2.763 2.489 2.857 0.057 30 0 "[ . 1 . 2 . 3]" 1
767 1 86 ALA HA 1 89 ILE MD 2.400 . 3.100 1.713 1.680 1.835 0.020 20 0 "[ . 1 . 2 . 3]" 1
768 1 86 ALA HA 1 89 ILE MG 3.100 . 4.300 4.020 3.868 4.099 . 0 0 "[ . 1 . 2 . 3]" 1
769 1 86 ALA HA 1 90 THR H 3.300 . 4.700 4.210 3.868 4.432 . 0 0 "[ . 1 . 2 . 3]" 1
770 1 86 ALA HA 1 122 LEU QD 3.000 . 4.100 3.572 3.378 3.903 . 0 0 "[ . 1 . 2 . 3]" 1
771 1 86 ALA MB 1 88 LYS H 3.800 . 5.500 3.729 3.137 4.202 . 0 0 "[ . 1 . 2 . 3]" 1
772 1 86 ALA MB 1 89 ILE H 3.500 . 5.000 3.584 3.350 3.816 . 0 0 "[ . 1 . 2 . 3]" 1
773 1 86 ALA MB 1 89 ILE HB 3.800 . 5.500 3.116 2.756 3.351 . 0 0 "[ . 1 . 2 . 3]" 1
774 1 86 ALA MB 1 89 ILE MD 2.900 . 4.000 2.521 2.191 2.834 . 0 0 "[ . 1 . 2 . 3]" 1
775 1 86 ALA MB 1 119 VAL QG 3.600 . 5.200 4.506 4.248 4.713 . 0 0 "[ . 1 . 2 . 3]" 1
776 1 87 GLY H 1 88 LYS H 4.300 . 5.500 2.576 2.072 2.853 . 0 0 "[ . 1 . 2 . 3]" 1
777 1 87 GLY HA3 1 88 LYS H 2.800 . 3.800 3.137 2.977 3.363 . 0 0 "[ . 1 . 2 . 3]" 1
778 1 88 LYS H 1 88 LYS HA 2.300 . 3.000 2.841 2.769 2.889 . 0 0 "[ . 1 . 2 . 3]" 1
779 1 88 LYS H 1 88 LYS HB2 2.100 . 5.500 3.467 3.341 3.549 . 0 0 "[ . 1 . 2 . 3]" 1
780 1 88 LYS H 1 88 LYS HB3 2.600 . 3.400 3.057 2.891 3.266 . 0 0 "[ . 1 . 2 . 3]" 1
781 1 88 LYS H 1 88 LYS QE 3.900 . 5.500 5.062 4.576 5.205 . 0 0 "[ . 1 . 2 . 3]" 1
782 1 88 LYS H 1 89 ILE H 2.600 . 3.400 1.801 1.641 2.147 0.159 30 0 "[ . 1 . 2 . 3]" 1
783 1 88 LYS H 1 90 THR H 3.600 . 5.200 4.732 4.215 5.166 . 0 0 "[ . 1 . 2 . 3]" 1
784 1 88 LYS H 1 91 GLY H 3.600 . 5.200 4.782 4.126 5.250 0.050 16 0 "[ . 1 . 2 . 3]" 1
785 1 88 LYS H 1 122 LEU HB2 3.200 . 5.500 5.181 4.231 5.560 0.060 4 0 "[ . 1 . 2 . 3]" 1
786 1 88 LYS H 1 122 LEU QD 3.100 . 4.300 3.038 2.123 3.527 . 0 0 "[ . 1 . 2 . 3]" 1
787 1 88 LYS HA 1 89 ILE H 3.000 . 4.100 3.209 2.812 3.499 . 0 0 "[ . 1 . 2 . 3]" 1
788 1 88 LYS HA 1 90 THR H 3.300 . 5.500 5.328 5.039 5.484 . 0 0 "[ . 1 . 2 . 3]" 1
789 1 88 LYS HA 1 91 GLY H 2.700 . 5.500 3.850 3.598 4.142 . 0 0 "[ . 1 . 2 . 3]" 1
790 1 88 LYS HB2 1 88 LYS QG 2.100 . 5.500 2.285 2.176 2.398 . 0 0 "[ . 1 . 2 . 3]" 1
791 1 88 LYS HB2 1 89 ILE H 2.400 . 5.500 4.407 4.169 4.641 . 0 0 "[ . 1 . 2 . 3]" 1
792 1 88 LYS HB2 1 92 MET ME 3.700 . 5.400 5.451 5.414 5.520 0.120 24 0 "[ . 1 . 2 . 3]" 1
793 1 88 LYS HB2 1 122 LEU QD 2.700 . 3.600 3.054 2.851 3.369 . 0 0 "[ . 1 . 2 . 3]" 1
794 1 88 LYS HB3 1 92 MET ME 2.400 . 5.500 4.224 4.018 4.521 . 0 0 "[ . 1 . 2 . 3]" 1
795 1 88 LYS HB3 1 122 LEU HA 2.300 . 5.500 4.972 4.344 5.340 . 0 0 "[ . 1 . 2 . 3]" 1
796 1 88 LYS HB3 1 122 LEU HB3 2.200 . 5.500 4.689 4.425 5.084 . 0 0 "[ . 1 . 2 . 3]" 1
797 1 88 LYS HB3 1 122 LEU QD 2.500 . 3.300 1.734 1.664 2.129 0.036 22 0 "[ . 1 . 2 . 3]" 1
798 1 88 LYS QE 1 92 MET ME 3.700 . 5.400 2.935 1.653 4.298 0.347 17 0 "[ . 1 . 2 . 3]" 1
799 1 88 LYS QE 1 93 LEU QD 3.500 . 5.500 4.734 4.553 4.834 . 0 0 "[ . 1 . 2 . 3]" 1
800 1 88 LYS QE 1 96 ILE MG 3.900 . 5.400 4.675 4.469 4.884 . 0 0 "[ . 1 . 2 . 3]" 1
801 1 88 LYS QE 1 122 LEU QD 2.700 . 5.500 3.628 2.415 4.657 . 0 0 "[ . 1 . 2 . 3]" 1
802 1 88 LYS QG 1 91 GLY HA3 4.300 . 5.500 4.718 3.461 5.258 . 0 0 "[ . 1 . 2 . 3]" 1
803 1 88 LYS QG 1 92 MET H 3.800 . 5.500 3.679 3.127 4.017 . 0 0 "[ . 1 . 2 . 3]" 1
804 1 88 LYS QG 1 92 MET HA 4.400 . 5.500 3.999 3.457 4.549 . 0 0 "[ . 1 . 2 . 3]" 1
805 1 88 LYS QG 1 92 MET ME 3.800 . 5.500 3.309 2.834 3.868 . 0 0 "[ . 1 . 2 . 3]" 1
806 1 88 LYS QG 1 93 LEU QD 2.800 . 5.500 5.250 5.133 5.307 . 0 0 "[ . 1 . 2 . 3]" 1
807 1 88 LYS QG 1 122 LEU HA 3.300 . 5.500 4.625 3.712 5.285 . 0 0 "[ . 1 . 2 . 3]" 1
808 1 88 LYS QG 1 122 LEU QD 3.400 . 4.800 2.966 2.045 3.490 . 0 0 "[ . 1 . 2 . 3]" 1
809 1 89 ILE H 1 89 ILE HA 2.700 . 3.600 2.797 2.705 2.888 . 0 0 "[ . 1 . 2 . 3]" 1
810 1 89 ILE H 1 89 ILE HB 2.100 . 2.700 2.601 2.509 2.717 0.017 30 0 "[ . 1 . 2 . 3]" 1
811 1 89 ILE H 1 89 ILE MD 2.800 . 3.800 3.446 3.265 3.664 . 0 0 "[ . 1 . 2 . 3]" 1
812 1 89 ILE H 1 89 ILE HG12 2.900 . 4.000 3.465 3.136 3.829 . 0 0 "[ . 1 . 2 . 3]" 1
813 1 89 ILE H 1 89 ILE MG 2.500 . 5.500 3.772 3.748 3.794 . 0 0 "[ . 1 . 2 . 3]" 1
814 1 89 ILE H 1 90 THR H 2.600 . 3.400 3.284 3.030 3.449 0.049 29 0 "[ . 1 . 2 . 3]" 1
815 1 89 ILE H 1 91 GLY H 3.700 . 5.400 3.839 3.423 4.183 . 0 0 "[ . 1 . 2 . 3]" 1
816 1 89 ILE H 1 92 MET H 5.000 . 5.500 4.381 4.207 4.613 . 0 0 "[ . 1 . 2 . 3]" 1
817 1 89 ILE H 1 115 VAL QG 5.000 . 5.500 5.090 5.000 5.149 . 0 0 "[ . 1 . 2 . 3]" 1
818 1 89 ILE H 1 122 LEU QD 2.400 . 5.500 3.184 2.893 3.569 . 0 0 "[ . 1 . 2 . 3]" 1
819 1 89 ILE HA 1 89 ILE MD 2.700 . 5.500 3.857 3.829 3.891 . 0 0 "[ . 1 . 2 . 3]" 1
820 1 89 ILE HA 1 89 ILE MG 2.200 . 2.800 2.299 2.223 2.390 . 0 0 "[ . 1 . 2 . 3]" 1
821 1 89 ILE HA 1 90 THR H 3.200 . 4.500 3.528 3.486 3.564 . 0 0 "[ . 1 . 2 . 3]" 1
822 1 89 ILE HA 1 91 GLY H 3.600 . 5.200 4.584 4.442 4.674 . 0 0 "[ . 1 . 2 . 3]" 1
823 1 89 ILE HA 1 92 MET H 2.800 . 5.500 3.748 3.607 3.880 . 0 0 "[ . 1 . 2 . 3]" 1
824 1 89 ILE HA 1 92 MET QB 2.400 . 5.500 3.033 2.794 3.247 . 0 0 "[ . 1 . 2 . 3]" 1
825 1 89 ILE HA 1 92 MET ME 3.000 . 4.100 2.880 2.495 3.290 . 0 0 "[ . 1 . 2 . 3]" 1
826 1 89 ILE HA 1 92 MET HG2 3.700 . 5.400 5.136 3.803 5.645 0.245 19 0 "[ . 1 . 2 . 3]" 1
827 1 89 ILE HA 1 93 LEU H 3.400 . 4.800 4.611 4.357 4.748 . 0 0 "[ . 1 . 2 . 3]" 1
828 1 89 ILE HA 1 93 LEU QD 4.100 . 5.500 3.308 3.182 3.463 . 0 0 "[ . 1 . 2 . 3]" 1
829 1 89 ILE HA 1 115 VAL QG 3.000 . 5.500 4.240 4.142 4.359 . 0 0 "[ . 1 . 2 . 3]" 1
830 1 89 ILE HA 1 118 ALA MB 2.600 . 3.400 3.354 3.106 3.428 0.028 29 0 "[ . 1 . 2 . 3]" 1
831 1 89 ILE HA 1 122 LEU QD 2.900 . 3.300 3.114 2.963 3.182 . 0 0 "[ . 1 . 2 . 3]" 1
832 1 89 ILE HB 1 89 ILE MD 2.300 . 3.000 2.362 2.253 2.481 . 0 0 "[ . 1 . 2 . 3]" 1
833 1 89 ILE HB 1 89 ILE MG 1.900 . 2.400 2.088 2.081 2.100 . 0 0 "[ . 1 . 2 . 3]" 1
834 1 89 ILE HB 1 90 THR H 2.500 . 5.500 1.827 1.711 1.932 . 0 0 "[ . 1 . 2 . 3]" 1
835 1 89 ILE HB 1 91 GLY H 3.600 . 5.200 4.215 4.051 4.370 . 0 0 "[ . 1 . 2 . 3]" 1
836 1 89 ILE HB 1 93 LEU QD 2.700 . 5.500 4.016 3.714 4.161 . 0 0 "[ . 1 . 2 . 3]" 1
837 1 89 ILE HB 1 115 VAL QG 3.100 . 4.300 3.221 3.106 3.294 . 0 0 "[ . 1 . 2 . 3]" 1
838 1 89 ILE HB 1 119 VAL QG 2.700 . 5.500 3.732 3.517 4.255 . 0 0 "[ . 1 . 2 . 3]" 1
839 1 89 ILE MD 1 89 ILE MG 2.000 . 2.500 2.138 1.987 2.325 . 0 0 "[ . 1 . 2 . 3]" 1
840 1 89 ILE MD 1 90 THR H 3.500 . 5.000 3.852 3.740 3.987 . 0 0 "[ . 1 . 2 . 3]" 1
841 1 89 ILE MD 1 93 LEU QD 2.000 . 5.500 4.691 4.435 4.818 . 0 0 "[ . 1 . 2 . 3]" 1
842 1 89 ILE MD 1 115 VAL HA 3.400 . 5.500 5.229 5.023 5.343 . 0 0 "[ . 1 . 2 . 3]" 1
843 1 89 ILE MD 1 115 VAL QG 2.300 . 3.000 2.884 2.625 2.967 . 0 0 "[ . 1 . 2 . 3]" 1
844 1 89 ILE MD 1 118 ALA MB 2.800 . 5.500 4.677 4.479 4.865 . 0 0 "[ . 1 . 2 . 3]" 1
845 1 89 ILE MD 1 119 VAL HA 2.900 . 4.000 3.499 3.271 3.687 . 0 0 "[ . 1 . 2 . 3]" 1
846 1 89 ILE MD 1 119 VAL HB 3.200 . 4.500 4.053 3.863 4.442 . 0 0 "[ . 1 . 2 . 3]" 1
847 1 89 ILE MD 1 119 VAL QG 2.600 . 3.400 1.654 1.490 1.778 0.310 17 0 "[ . 1 . 2 . 3]" 1
848 1 89 ILE MD 1 122 LEU HB3 3.300 . 4.700 4.684 4.528 4.757 0.057 28 0 "[ . 1 . 2 . 3]" 1
849 1 89 ILE MD 1 122 LEU QD 2.100 . 5.500 2.657 2.520 2.835 . 0 0 "[ . 1 . 2 . 3]" 1
850 1 89 ILE MG 1 90 THR H 2.600 . 3.400 2.513 2.351 2.690 . 0 0 "[ . 1 . 2 . 3]" 1
851 1 89 ILE MG 1 90 THR HB 2.800 . 3.800 3.705 3.571 3.815 0.015 10 0 "[ . 1 . 2 . 3]" 1
852 1 89 ILE MG 1 91 GLY H 3.600 . 5.200 4.611 4.523 4.689 . 0 0 "[ . 1 . 2 . 3]" 1
853 1 89 ILE MG 1 92 MET H 3.200 . 4.500 4.508 4.408 4.573 0.073 23 0 "[ . 1 . 2 . 3]" 1
854 1 89 ILE MG 1 92 MET QB 3.200 . 4.500 4.084 3.702 4.481 . 0 0 "[ . 1 . 2 . 3]" 1
855 1 89 ILE MG 1 92 MET ME 2.900 . 4.000 3.691 3.171 4.022 0.022 6 0 "[ . 1 . 2 . 3]" 1
856 1 89 ILE MG 1 93 LEU HB2 2.700 . 5.500 4.595 4.462 4.742 . 0 0 "[ . 1 . 2 . 3]" 1
857 1 89 ILE MG 1 93 LEU QD 2.000 . 2.500 2.089 1.958 2.279 . 0 0 "[ . 1 . 2 . 3]" 1
858 1 89 ILE MG 1 115 VAL H 3.300 . 4.700 4.757 4.703 4.794 0.094 24 0 "[ . 1 . 2 . 3]" 1
859 1 89 ILE MG 1 115 VAL HA 2.400 . 3.100 2.701 2.648 2.777 . 0 0 "[ . 1 . 2 . 3]" 1
860 1 89 ILE MG 1 115 VAL HB 3.200 . 4.500 3.816 3.749 3.874 . 0 0 "[ . 1 . 2 . 3]" 1
861 1 89 ILE MG 1 115 VAL QG 2.200 . 2.700 1.581 1.489 1.679 0.111 3 0 "[ . 1 . 2 . 3]" 1
862 1 89 ILE MG 1 116 ASP H 4.300 . 5.500 4.260 4.138 4.417 . 0 0 "[ . 1 . 2 . 3]" 1
863 1 89 ILE MG 1 118 ALA H 3.300 . 4.700 4.023 3.776 4.127 . 0 0 "[ . 1 . 2 . 3]" 1
864 1 89 ILE MG 1 118 ALA HA 3.200 . 5.500 4.805 4.588 4.948 . 0 0 "[ . 1 . 2 . 3]" 1
865 1 89 ILE MG 1 118 ALA MB 2.100 . 2.700 2.310 2.079 2.653 . 0 0 "[ . 1 . 2 . 3]" 1
866 1 89 ILE MG 1 119 VAL H 3.300 . 4.700 3.284 2.991 3.677 . 0 0 "[ . 1 . 2 . 3]" 1
867 1 89 ILE MG 1 119 VAL HA 4.400 . 5.500 3.419 3.229 3.678 . 0 0 "[ . 1 . 2 . 3]" 1
868 1 89 ILE MG 1 119 VAL QG 3.000 . 5.500 1.750 1.505 2.242 . 0 0 "[ . 1 . 2 . 3]" 1
869 1 89 ILE MG 1 122 LEU HB3 2.500 . 5.500 4.375 4.152 4.533 . 0 0 "[ . 1 . 2 . 3]" 1
870 1 90 THR H 1 90 THR HA 2.400 . 3.100 2.775 2.747 2.802 . 0 0 "[ . 1 . 2 . 3]" 1
871 1 90 THR H 1 90 THR HB 2.700 . 3.600 2.035 2.019 2.056 . 0 0 "[ . 1 . 2 . 3]" 1
872 1 90 THR H 1 91 GLY H 2.600 . 3.400 2.807 2.725 2.874 . 0 0 "[ . 1 . 2 . 3]" 1
873 1 90 THR H 1 92 MET H 3.800 . 5.500 4.056 3.947 4.176 . 0 0 "[ . 1 . 2 . 3]" 1
874 1 90 THR HA 1 90 THR MG 2.000 . 5.500 2.969 2.918 3.045 . 0 0 "[ . 1 . 2 . 3]" 1
875 1 90 THR HA 1 91 GLY H 2.400 . 5.500 3.542 3.526 3.552 . 0 0 "[ . 1 . 2 . 3]" 1
876 1 90 THR HA 1 91 GLY HA3 2.800 . 5.500 5.329 5.317 5.335 . 0 0 "[ . 1 . 2 . 3]" 1
877 1 90 THR HA 1 92 MET H 3.700 . 5.400 3.854 3.749 3.973 . 0 0 "[ . 1 . 2 . 3]" 1
878 1 90 THR HA 1 93 LEU HA 3.200 . 4.500 4.561 4.509 4.619 0.119 15 0 "[ . 1 . 2 . 3]" 1
879 1 90 THR HA 1 93 LEU HB3 2.700 . 3.600 3.612 3.551 3.656 0.056 8 0 "[ . 1 . 2 . 3]" 1
880 1 90 THR HA 1 93 LEU QD 3.300 . 4.700 2.160 1.886 2.391 0.014 19 0 "[ . 1 . 2 . 3]" 1
881 1 90 THR HA 1 111 LEU QD 3.300 . 5.500 4.587 4.294 4.916 . 0 0 "[ . 1 . 2 . 3]" 1
882 1 90 THR HB 1 90 THR MG 2.200 . 2.800 2.087 2.077 2.101 . 0 0 "[ . 1 . 2 . 3]" 1
883 1 90 THR HB 1 91 GLY H 3.100 . 4.300 3.210 3.089 3.376 . 0 0 "[ . 1 . 2 . 3]" 1
884 1 90 THR HB 1 92 MET H 3.500 . 5.000 5.122 5.060 5.175 0.175 6 0 "[ . 1 . 2 . 3]" 1
885 1 90 THR HB 1 93 LEU QD 3.500 . 5.000 4.221 3.973 4.372 . 0 0 "[ . 1 . 2 . 3]" 1
886 1 90 THR HB 1 93 LEU HG 3.100 . 5.500 5.178 5.054 5.376 . 0 0 "[ . 1 . 2 . 3]" 1
887 1 90 THR MG 1 91 GLY H 2.900 . 4.000 2.630 2.532 2.713 . 0 0 "[ . 1 . 2 . 3]" 1
888 1 90 THR MG 1 91 GLY HA2 4.100 . 5.500 2.915 2.828 2.991 . 0 0 "[ . 1 . 2 . 3]" 1
889 1 90 THR MG 1 91 GLY HA3 3.400 . 4.800 3.710 3.648 3.769 . 0 0 "[ . 1 . 2 . 3]" 1
890 1 90 THR MG 1 92 MET H 4.200 . 5.500 4.286 4.231 4.353 . 0 0 "[ . 1 . 2 . 3]" 1
891 1 90 THR MG 1 93 LEU H 4.100 . 5.500 4.217 4.085 4.372 . 0 0 "[ . 1 . 2 . 3]" 1
892 1 90 THR MG 1 94 LEU H 3.600 . 5.200 4.971 4.871 5.062 . 0 0 "[ . 1 . 2 . 3]" 1
893 1 90 THR MG 1 94 LEU HB2 3.400 . 4.800 4.777 4.555 4.846 0.046 30 0 "[ . 1 . 2 . 3]" 1
894 1 90 THR MG 1 94 LEU QD 2.700 . 3.600 3.507 3.342 3.629 0.029 3 0 "[ . 1 . 2 . 3]" 1
895 1 90 THR MG 1 104 MET ME 2.600 . 5.500 4.077 3.883 4.323 . 0 0 "[ . 1 . 2 . 3]" 1
896 1 90 THR MG 1 111 LEU QD 3.600 . 5.200 4.148 3.940 4.335 . 0 0 "[ . 1 . 2 . 3]" 1
897 1 90 THR MG 1 115 VAL QG 3.000 . 5.500 3.909 3.749 4.154 . 0 0 "[ . 1 . 2 . 3]" 1
898 1 91 GLY H 1 91 GLY HA2 2.400 . 3.100 2.810 2.791 2.832 . 0 0 "[ . 1 . 2 . 3]" 1
899 1 91 GLY H 1 91 GLY HA3 2.200 . 2.800 2.302 2.297 2.307 . 0 0 "[ . 1 . 2 . 3]" 1
900 1 91 GLY H 1 93 LEU H 3.700 . 5.400 3.906 3.840 3.994 . 0 0 "[ . 1 . 2 . 3]" 1
901 1 91 GLY H 1 94 LEU H 4.000 . 5.500 5.462 5.359 5.524 0.024 11 0 "[ . 1 . 2 . 3]" 1
902 1 91 GLY HA2 1 92 MET H 2.900 . 4.000 3.468 3.440 3.501 . 0 0 "[ . 1 . 2 . 3]" 1
903 1 91 GLY HA2 1 93 LEU H 4.300 . 5.500 4.197 4.095 4.350 . 0 0 "[ . 1 . 2 . 3]" 1
904 1 91 GLY HA2 1 94 LEU H 3.300 . 4.700 4.120 4.007 4.247 . 0 0 "[ . 1 . 2 . 3]" 1
905 1 91 GLY HA2 1 94 LEU HB2 3.500 . 5.000 3.627 3.324 3.819 . 0 0 "[ . 1 . 2 . 3]" 1
906 1 91 GLY HA3 1 92 MET H 2.700 . 3.600 2.915 2.881 2.938 . 0 0 "[ . 1 . 2 . 3]" 1
907 1 91 GLY HA3 1 92 MET HA 1.800 . 5.500 4.395 4.355 4.425 . 0 0 "[ . 1 . 2 . 3]" 1
908 1 91 GLY HA3 1 93 LEU H 4.100 . 5.500 4.559 4.444 4.672 . 0 0 "[ . 1 . 2 . 3]" 1
909 1 91 GLY HA3 1 94 LEU H 3.400 . 5.500 5.038 4.945 5.117 . 0 0 "[ . 1 . 2 . 3]" 1
910 1 91 GLY HA3 1 94 LEU HB2 3.600 . 5.200 5.025 4.776 5.201 0.001 11 0 "[ . 1 . 2 . 3]" 1
911 1 92 MET H 1 92 MET HA 2.400 . 3.100 2.888 2.872 2.902 . 0 0 "[ . 1 . 2 . 3]" 1
912 1 92 MET H 1 92 MET QB 2.200 . 2.800 2.162 2.049 2.274 . 0 0 "[ . 1 . 2 . 3]" 1
913 1 92 MET H 1 92 MET HG2 2.300 . 5.500 4.264 3.716 4.661 . 0 0 "[ . 1 . 2 . 3]" 1
914 1 92 MET H 1 92 MET HG3 3.100 . 4.300 4.326 4.151 4.565 0.265 6 0 "[ . 1 . 2 . 3]" 1
915 1 92 MET H 1 93 LEU H 2.400 . 3.100 2.298 2.250 2.386 . 0 0 "[ . 1 . 2 . 3]" 1
916 1 92 MET H 1 94 LEU H 3.300 . 4.700 3.973 3.879 4.084 . 0 0 "[ . 1 . 2 . 3]" 1
917 1 92 MET H 1 118 ALA MB 3.900 . 5.500 5.054 4.892 5.260 . 0 0 "[ . 1 . 2 . 3]" 1
918 1 92 MET HA 1 92 MET HG2 2.400 . 3.100 3.050 2.262 3.919 0.819 7 6 "[ *. + 1 - .* 2 * * 3]" 1
919 1 92 MET HA 1 93 LEU H 2.900 . 4.000 3.455 3.423 3.487 . 0 0 "[ . 1 . 2 . 3]" 1
920 1 92 MET HA 1 95 GLU HG2 2.400 . 3.100 1.881 1.677 1.995 0.023 22 0 "[ . 1 . 2 . 3]" 1
921 1 92 MET QB 1 92 MET HG2 2.100 . 2.700 2.335 2.181 2.505 . 0 0 "[ . 1 . 2 . 3]" 1
922 1 92 MET QB 1 93 LEU H 2.300 . 5.500 2.855 2.501 3.250 . 0 0 "[ . 1 . 2 . 3]" 1
923 1 92 MET QB 1 93 LEU QD 2.700 . 3.600 2.793 2.276 3.430 . 0 0 "[ . 1 . 2 . 3]" 1
924 1 92 MET QB 1 94 LEU H 3.000 . 5.500 4.356 4.203 4.549 . 0 0 "[ . 1 . 2 . 3]" 1
925 1 92 MET QB 1 95 GLU H 2.500 . 5.500 4.963 4.844 5.082 . 0 0 "[ . 1 . 2 . 3]" 1
926 1 92 MET QB 1 96 ILE H 3.000 . 5.500 4.859 4.569 5.121 . 0 0 "[ . 1 . 2 . 3]" 1
927 1 92 MET QB 1 122 LEU QD 3.300 . 4.700 4.149 3.973 4.225 . 0 0 "[ . 1 . 2 . 3]" 1
928 1 92 MET ME 1 92 MET HG2 2.600 . 3.400 2.793 2.050 3.376 . 0 0 "[ . 1 . 2 . 3]" 1
929 1 92 MET ME 1 92 MET HG3 2.700 . 3.600 2.876 2.014 3.375 . 0 0 "[ . 1 . 2 . 3]" 1
930 1 92 MET ME 1 93 LEU QD 2.700 . 3.600 3.282 2.921 3.541 . 0 0 "[ . 1 . 2 . 3]" 1
931 1 92 MET ME 1 95 GLU HG2 2.200 . 5.500 5.506 5.179 5.543 0.043 29 0 "[ . 1 . 2 . 3]" 1
932 1 92 MET ME 1 95 GLU HG3 3.700 . 5.400 5.375 5.151 5.437 0.037 19 0 "[ . 1 . 2 . 3]" 1
933 1 92 MET ME 1 96 ILE MG 2.300 . 3.000 3.033 2.791 3.109 0.109 29 0 "[ . 1 . 2 . 3]" 1
934 1 92 MET ME 1 115 VAL HA 4.500 . 5.500 5.316 4.779 5.532 0.032 11 0 "[ . 1 . 2 . 3]" 1
935 1 92 MET ME 1 118 ALA HA 2.100 . 5.500 3.193 2.994 3.475 . 0 0 "[ . 1 . 2 . 3]" 1
936 1 92 MET ME 1 118 ALA MB 2.100 . 2.700 2.171 1.771 2.503 . 0 0 "[ . 1 . 2 . 3]" 1
937 1 92 MET ME 1 119 VAL HA 3.700 . 5.400 3.699 3.446 3.988 . 0 0 "[ . 1 . 2 . 3]" 1
938 1 92 MET ME 1 119 VAL QG 4.000 . 5.500 4.187 3.972 4.421 . 0 0 "[ . 1 . 2 . 3]" 1
939 1 92 MET ME 1 121 VAL HA 3.700 . 5.400 4.490 4.232 4.726 . 0 0 "[ . 1 . 2 . 3]" 1
940 1 92 MET ME 1 121 VAL HB 2.100 . 2.700 2.714 2.605 2.752 0.052 6 0 "[ . 1 . 2 . 3]" 1
941 1 92 MET ME 1 121 VAL MG1 1.900 . 2.400 2.143 1.722 2.423 0.023 19 0 "[ . 1 . 2 . 3]" 1
942 1 92 MET ME 1 122 LEU HA 2.400 . 3.100 2.594 2.322 2.913 . 0 0 "[ . 1 . 2 . 3]" 1
943 1 92 MET ME 1 122 LEU HB2 2.800 . 3.800 2.076 1.826 2.383 . 0 0 "[ . 1 . 2 . 3]" 1
944 1 92 MET ME 1 122 LEU HB3 3.100 . 4.300 2.418 2.188 2.693 . 0 0 "[ . 1 . 2 . 3]" 1
945 1 92 MET ME 1 122 LEU QD 2.500 . 5.500 3.129 3.001 3.286 . 0 0 "[ . 1 . 2 . 3]" 1
946 1 92 MET ME 1 124 ALA MB 3.200 . 5.500 5.407 5.090 5.552 0.052 15 0 "[ . 1 . 2 . 3]" 1
947 1 92 MET ME 1 126 GLN QG 4.000 . 5.500 5.127 4.476 5.299 . 0 0 "[ . 1 . 2 . 3]" 1
948 1 92 MET HG2 1 93 LEU H 3.300 . 4.700 4.084 3.362 4.643 . 0 0 "[ . 1 . 2 . 3]" 1
949 1 92 MET HG2 1 96 ILE MD 3.400 . 4.800 4.542 3.749 4.843 0.043 9 0 "[ . 1 . 2 . 3]" 1
950 1 92 MET HG2 1 118 ALA MB 4.300 . 5.500 3.895 2.620 4.841 . 0 0 "[ . 1 . 2 . 3]" 1
951 1 92 MET HG3 1 93 LEU H 3.500 . 5.000 4.688 3.601 5.116 0.116 3 0 "[ . 1 . 2 . 3]" 1
952 1 92 MET HG3 1 93 LEU QD 3.500 . 5.000 4.427 3.359 4.893 . 0 0 "[ . 1 . 2 . 3]" 1
953 1 93 LEU H 1 93 LEU HA 2.600 . 3.400 2.780 2.747 2.814 . 0 0 "[ . 1 . 2 . 3]" 1
954 1 93 LEU H 1 93 LEU HB2 2.400 . 3.100 2.172 2.138 2.234 . 0 0 "[ . 1 . 2 . 3]" 1
955 1 93 LEU H 1 93 LEU HB3 2.400 . 5.500 3.480 3.460 3.510 . 0 0 "[ . 1 . 2 . 3]" 1
956 1 93 LEU H 1 93 LEU QD 3.000 . 3.400 1.845 1.746 2.028 0.154 26 0 "[ . 1 . 2 . 3]" 1
957 1 93 LEU H 1 93 LEU HG 2.600 . 5.500 3.882 3.794 3.981 . 0 0 "[ . 1 . 2 . 3]" 1
958 1 93 LEU H 1 94 LEU H 2.600 . 3.400 2.728 2.619 2.827 . 0 0 "[ . 1 . 2 . 3]" 1
959 1 93 LEU H 1 95 GLU H 3.800 . 5.500 4.396 4.245 4.455 . 0 0 "[ . 1 . 2 . 3]" 1
960 1 93 LEU H 1 118 ALA MB 3.400 . 4.800 4.370 4.158 4.648 . 0 0 "[ . 1 . 2 . 3]" 1
961 1 93 LEU HA 1 93 LEU HB3 2.600 . 3.400 2.653 2.616 2.690 . 0 0 "[ . 1 . 2 . 3]" 1
962 1 93 LEU HA 1 93 LEU QD 2.800 . 3.800 1.861 1.775 1.960 0.025 22 0 "[ . 1 . 2 . 3]" 1
963 1 93 LEU HA 1 94 LEU H 3.100 . 4.300 3.316 3.282 3.351 . 0 0 "[ . 1 . 2 . 3]" 1
964 1 93 LEU HA 1 95 GLU H 3.200 . 4.500 3.358 3.315 3.420 . 0 0 "[ . 1 . 2 . 3]" 1
965 1 93 LEU HA 1 96 ILE H 3.200 . 4.500 3.135 3.083 3.196 . 0 0 "[ . 1 . 2 . 3]" 1
966 1 93 LEU HB2 1 95 GLU H 3.900 . 5.500 5.170 5.128 5.210 . 0 0 "[ . 1 . 2 . 3]" 1
967 1 93 LEU HB2 1 96 ILE H 3.800 . 5.500 5.657 5.636 5.685 0.185 21 0 "[ . 1 . 2 . 3]" 1
968 1 93 LEU HB2 1 96 ILE MD 2.600 . 5.500 4.315 4.196 4.501 . 0 0 "[ . 1 . 2 . 3]" 1
969 1 93 LEU HB2 1 104 MET ME 3.000 . 4.100 2.567 2.435 2.687 . 0 0 "[ . 1 . 2 . 3]" 1
970 1 93 LEU HB2 1 118 ALA MB 2.800 . 5.500 4.889 4.811 4.965 . 0 0 "[ . 1 . 2 . 3]" 1
971 1 93 LEU HB3 1 93 LEU QD 2.300 . 3.000 2.315 2.262 2.342 . 0 0 "[ . 1 . 2 . 3]" 1
972 1 93 LEU HB3 1 93 LEU HG 2.500 . 3.300 2.472 2.455 2.491 . 0 0 "[ . 1 . 2 . 3]" 1
973 1 93 LEU HB3 1 96 ILE H 3.900 . 5.500 5.302 5.254 5.350 . 0 0 "[ . 1 . 2 . 3]" 1
974 1 93 LEU HB3 1 104 MET QB 3.500 . 5.000 4.172 4.048 4.290 . 0 0 "[ . 1 . 2 . 3]" 1
975 1 93 LEU HB3 1 104 MET ME 3.100 . 5.500 1.742 1.646 1.898 . 0 0 "[ . 1 . 2 . 3]" 1
976 1 93 LEU HB3 1 111 LEU QD 2.200 . 5.500 4.252 4.021 4.655 . 0 0 "[ . 1 . 2 . 3]" 1
977 1 93 LEU QD 1 93 LEU HG 2.200 . 2.800 1.868 1.856 1.881 . 0 0 "[ . 1 . 2 . 3]" 1
978 1 93 LEU QD 1 94 LEU H 3.300 . 4.700 3.865 3.834 3.945 . 0 0 "[ . 1 . 2 . 3]" 1
979 1 93 LEU QD 1 95 GLU H 3.300 . 4.700 4.312 4.293 4.332 . 0 0 "[ . 1 . 2 . 3]" 1
980 1 93 LEU QD 1 95 GLU HG2 3.400 . 5.500 5.194 5.102 5.243 . 0 0 "[ . 1 . 2 . 3]" 1
981 1 93 LEU QD 1 96 ILE H 3.600 . 5.200 4.027 3.990 4.064 . 0 0 "[ . 1 . 2 . 3]" 1
982 1 93 LEU QD 1 96 ILE HA 4.100 . 5.500 4.849 4.758 4.932 . 0 0 "[ . 1 . 2 . 3]" 1
983 1 93 LEU QD 1 96 ILE MD 2.200 . 5.500 2.351 2.059 2.719 . 0 0 "[ . 1 . 2 . 3]" 1
984 1 93 LEU QD 1 96 ILE MG 3.200 . 4.300 2.035 1.910 2.144 . 0 0 "[ . 1 . 2 . 3]" 1
985 1 93 LEU QD 1 98 ASN H 3.500 . 5.500 5.129 5.031 5.221 . 0 0 "[ . 1 . 2 . 3]" 1
986 1 93 LEU QD 1 100 GLU H 3.800 . 5.500 4.595 4.415 4.754 . 0 0 "[ . 1 . 2 . 3]" 1
987 1 93 LEU QD 1 101 LEU H 3.200 . 4.500 4.074 3.771 4.276 . 0 0 "[ . 1 . 2 . 3]" 1
988 1 93 LEU QD 1 104 MET H 3.400 . 4.800 4.566 4.451 4.715 . 0 0 "[ . 1 . 2 . 3]" 1
989 1 93 LEU QD 1 104 MET HA 3.200 . 5.500 5.026 4.919 5.157 . 0 0 "[ . 1 . 2 . 3]" 1
990 1 93 LEU QD 1 104 MET QB 3.500 . 5.500 2.928 2.803 3.139 . 0 0 "[ . 1 . 2 . 3]" 1
991 1 93 LEU QD 1 104 MET ME 2.100 . 2.700 1.961 1.719 2.301 . 0 0 "[ . 1 . 2 . 3]" 1
992 1 93 LEU QD 1 114 LYS H 4.100 . 5.500 4.597 4.428 4.755 . 0 0 "[ . 1 . 2 . 3]" 1
993 1 93 LEU QD 1 115 VAL H 3.600 . 5.200 3.599 3.427 3.779 . 0 0 "[ . 1 . 2 . 3]" 1
994 1 93 LEU QD 1 115 VAL HA 3.000 . 3.000 2.166 1.907 2.305 . 0 0 "[ . 1 . 2 . 3]" 1
995 1 93 LEU QD 1 115 VAL QG 2.600 . 3.400 1.972 1.847 2.257 0.053 21 0 "[ . 1 . 2 . 3]" 1
996 1 93 LEU QD 1 116 ASP H 3.800 . 5.500 4.821 4.737 4.959 . 0 0 "[ . 1 . 2 . 3]" 1
997 1 93 LEU QD 1 117 GLU H 3.800 . 5.500 4.927 4.738 5.046 . 0 0 "[ . 1 . 2 . 3]" 1
998 1 93 LEU QD 1 118 ALA H 3.100 . 4.300 3.667 3.433 3.814 . 0 0 "[ . 1 . 2 . 3]" 1
999 1 93 LEU QD 1 118 ALA HA 3.400 . 4.800 3.971 3.900 4.055 . 0 0 "[ . 1 . 2 . 3]" 1
1000 1 93 LEU QD 1 118 ALA MB 2.200 . 2.800 1.844 1.734 1.933 . 0 0 "[ . 1 . 2 . 3]" 1
1001 1 93 LEU QD 1 119 VAL HA 2.700 . 5.500 5.259 5.119 5.383 . 0 0 "[ . 1 . 2 . 3]" 1
1002 1 93 LEU QD 1 119 VAL QG 2.300 . 5.500 4.100 3.927 4.297 . 0 0 "[ . 1 . 2 . 3]" 1
1003 1 93 LEU QD 1 122 LEU HB3 2.000 . 5.500 5.395 5.327 5.467 . 0 0 "[ . 1 . 2 . 3]" 1
1004 1 93 LEU HG 1 104 MET ME 2.700 . 3.600 2.278 2.034 2.438 . 0 0 "[ . 1 . 2 . 3]" 1
1005 1 93 LEU HG 1 115 VAL H 3.600 . 5.200 4.522 4.239 4.720 . 0 0 "[ . 1 . 2 . 3]" 1
1006 1 93 LEU HG 1 115 VAL QG 3.100 . 4.300 1.722 1.553 1.947 0.347 3 0 "[ . 1 . 2 . 3]" 1
1007 1 94 LEU H 1 94 LEU HA 2.500 . 3.300 2.941 2.938 2.945 . 0 0 "[ . 1 . 2 . 3]" 1
1008 1 94 LEU H 1 94 LEU HB2 2.400 . 3.100 2.316 2.260 2.372 . 0 0 "[ . 1 . 2 . 3]" 1
1009 1 94 LEU H 1 94 LEU HB3 2.600 . 3.400 3.431 3.404 3.487 0.087 11 0 "[ . 1 . 2 . 3]" 1
1010 1 94 LEU H 1 94 LEU QD 2.700 . 3.600 3.012 2.828 3.128 . 0 0 "[ . 1 . 2 . 3]" 1
1011 1 94 LEU H 1 95 GLU H 2.700 . 3.600 2.515 2.368 2.591 . 0 0 "[ . 1 . 2 . 3]" 1
1012 1 94 LEU HA 1 94 LEU QD 2.100 . 2.700 1.974 1.816 2.232 . 0 0 "[ . 1 . 2 . 3]" 1
1013 1 94 LEU HB2 1 94 LEU QD 2.300 . 3.000 2.250 2.023 2.464 . 0 0 "[ . 1 . 2 . 3]" 1
1014 1 94 LEU HB2 1 95 GLU H 3.000 . 4.100 4.115 4.019 4.146 0.046 8 0 "[ . 1 . 2 . 3]" 1
1015 1 94 LEU HB2 1 96 ILE MD 2.600 . 5.500 5.157 5.057 5.297 . 0 0 "[ . 1 . 2 . 3]" 1
1016 1 94 LEU HB3 1 94 LEU QD 2.200 . 2.800 2.254 2.034 2.404 . 0 0 "[ . 1 . 2 . 3]" 1
1017 1 94 LEU HB3 1 95 GLU H 3.200 . 4.500 4.224 4.197 4.256 . 0 0 "[ . 1 . 2 . 3]" 1
1018 1 94 LEU QD 1 115 VAL QG 2.300 . 5.500 5.131 4.975 5.240 . 0 0 "[ . 1 . 2 . 3]" 1
1019 1 95 GLU H 1 95 GLU HA 2.300 . 3.000 2.840 2.827 2.861 . 0 0 "[ . 1 . 2 . 3]" 1
1020 1 95 GLU H 1 95 GLU HB3 2.200 . 5.500 3.348 3.283 3.408 . 0 0 "[ . 1 . 2 . 3]" 1
1021 1 95 GLU H 1 95 GLU HG2 2.500 . 5.500 3.090 2.947 3.235 . 0 0 "[ . 1 . 2 . 3]" 1
1022 1 95 GLU H 1 95 GLU HG3 2.400 . 5.500 3.509 3.413 3.590 . 0 0 "[ . 1 . 2 . 3]" 1
1023 1 95 GLU H 1 96 ILE H 2.200 . 5.500 1.533 1.499 1.584 . 0 0 "[ . 1 . 2 . 3]" 1
1024 1 95 GLU H 1 101 LEU HA 4.600 . 5.500 5.537 5.503 5.570 0.070 22 0 "[ . 1 . 2 . 3]" 1
1025 1 95 GLU HA 1 96 ILE H 2.900 . 4.000 3.285 3.258 3.325 . 0 0 "[ . 1 . 2 . 3]" 1
1026 1 95 GLU HB3 1 95 GLU HG2 2.300 . 3.000 2.357 2.316 2.405 . 0 0 "[ . 1 . 2 . 3]" 1
1027 1 95 GLU HB3 1 96 ILE H 3.100 . 4.300 4.295 4.235 4.335 0.035 27 0 "[ . 1 . 2 . 3]" 1
1028 1 95 GLU HG2 1 96 ILE H 3.600 . 5.200 3.637 3.481 3.739 . 0 0 "[ . 1 . 2 . 3]" 1
1029 1 95 GLU HG2 1 96 ILE MD 4.000 . 5.500 4.548 4.372 4.757 . 0 0 "[ . 1 . 2 . 3]" 1
1030 1 95 GLU HG3 1 96 ILE MD 3.200 . 4.500 4.481 4.350 4.530 0.030 25 0 "[ . 1 . 2 . 3]" 1
1031 1 95 GLU HG3 1 96 ILE MG 2.800 . 3.800 3.614 3.451 3.778 . 0 0 "[ . 1 . 2 . 3]" 1
1032 1 96 ILE H 1 96 ILE HA 2.600 . 3.400 2.808 2.787 2.819 . 0 0 "[ . 1 . 2 . 3]" 1
1033 1 96 ILE H 1 96 ILE HB 2.300 . 5.500 3.647 3.639 3.654 . 0 0 "[ . 1 . 2 . 3]" 1
1034 1 96 ILE H 1 96 ILE MD 2.500 . 5.500 1.440 1.367 1.681 . 0 0 "[ . 1 . 2 . 3]" 1
1035 1 96 ILE H 1 96 ILE HG12 2.500 . 5.500 3.435 3.359 3.556 . 0 0 "[ . 1 . 2 . 3]" 1
1036 1 96 ILE H 1 96 ILE HG13 2.400 . 5.500 3.764 3.678 3.877 . 0 0 "[ . 1 . 2 . 3]" 1
1037 1 96 ILE H 1 96 ILE MG 2.500 . 3.300 2.125 1.995 2.230 . 0 0 "[ . 1 . 2 . 3]" 1
1038 1 96 ILE H 1 101 LEU H 3.800 . 5.500 5.163 4.777 5.368 . 0 0 "[ . 1 . 2 . 3]" 1
1039 1 96 ILE H 1 101 LEU HB2 3.400 . 4.800 4.005 3.878 4.716 . 0 0 "[ . 1 . 2 . 3]" 1
1040 1 96 ILE HA 1 96 ILE HB 2.300 . 3.000 2.409 2.385 2.424 . 0 0 "[ . 1 . 2 . 3]" 1
1041 1 96 ILE HA 1 96 ILE MD 2.600 . 3.400 3.450 3.421 3.482 0.082 17 0 "[ . 1 . 2 . 3]" 1
1042 1 96 ILE HA 1 96 ILE HG12 2.300 . 5.500 3.684 3.621 3.747 . 0 0 "[ . 1 . 2 . 3]" 1
1043 1 96 ILE HA 1 96 ILE HG13 2.400 . 5.500 4.253 4.231 4.266 . 0 0 "[ . 1 . 2 . 3]" 1
1044 1 96 ILE HA 1 96 ILE MG 2.200 . 2.800 2.453 2.396 2.510 . 0 0 "[ . 1 . 2 . 3]" 1
1045 1 96 ILE HA 1 97 ASP H 2.100 . 5.500 2.910 2.869 2.944 . 0 0 "[ . 1 . 2 . 3]" 1
1046 1 96 ILE HA 1 97 ASP HA 3.400 . 4.800 4.429 4.402 4.469 . 0 0 "[ . 1 . 2 . 3]" 1
1047 1 96 ILE HA 1 98 ASN H 3.600 . 5.200 3.979 3.948 4.004 . 0 0 "[ . 1 . 2 . 3]" 1
1048 1 96 ILE HB 1 96 ILE MD 2.000 . 5.500 3.215 3.198 3.232 . 0 0 "[ . 1 . 2 . 3]" 1
1049 1 96 ILE HB 1 96 ILE HG12 2.500 . 3.300 2.445 2.389 2.491 . 0 0 "[ . 1 . 2 . 3]" 1
1050 1 96 ILE HB 1 96 ILE HG13 2.300 . 3.000 2.427 2.373 2.489 . 0 0 "[ . 1 . 2 . 3]" 1
1051 1 96 ILE HB 1 96 ILE MG 2.000 . 2.500 2.086 2.067 2.110 . 0 0 "[ . 1 . 2 . 3]" 1
1052 1 96 ILE HB 1 97 ASP H 2.500 . 5.500 1.604 1.567 1.638 . 0 0 "[ . 1 . 2 . 3]" 1
1053 1 96 ILE HB 1 97 ASP HB2 3.300 . 4.700 3.446 3.422 3.480 . 0 0 "[ . 1 . 2 . 3]" 1
1054 1 96 ILE HB 1 98 ASN H 3.700 . 5.400 3.531 3.476 3.578 . 0 0 "[ . 1 . 2 . 3]" 1
1055 1 96 ILE HB 1 98 ASN HA 2.100 . 5.500 5.589 5.544 5.638 0.138 17 0 "[ . 1 . 2 . 3]" 1
1056 1 96 ILE HB 1 99 SER H 3.700 . 5.500 5.519 5.440 5.598 0.098 11 0 "[ . 1 . 2 . 3]" 1
1057 1 96 ILE MD 1 96 ILE HG12 2.000 . 2.500 2.074 2.061 2.112 . 0 0 "[ . 1 . 2 . 3]" 1
1058 1 96 ILE MD 1 96 ILE HG13 2.000 . 2.500 2.072 2.061 2.110 . 0 0 "[ . 1 . 2 . 3]" 1
1059 1 96 ILE MD 1 96 ILE MG 1.900 . 2.400 2.101 2.000 2.218 . 0 0 "[ . 1 . 2 . 3]" 1
1060 1 96 ILE MD 1 97 ASP H 3.000 . 4.100 3.616 3.558 3.665 . 0 0 "[ . 1 . 2 . 3]" 1
1061 1 96 ILE MD 1 97 ASP HA 3.500 . 5.000 5.014 4.831 5.076 0.076 29 0 "[ . 1 . 2 . 3]" 1
1062 1 96 ILE MD 1 98 ASN H 3.800 . 5.500 2.313 2.065 2.477 . 0 0 "[ . 1 . 2 . 3]" 1
1063 1 96 ILE MD 1 98 ASN HA 2.700 . 3.600 2.465 2.275 2.738 . 0 0 "[ . 1 . 2 . 3]" 1
1064 1 96 ILE MD 1 98 ASN QB 2.900 . 5.500 4.218 3.781 4.382 . 0 0 "[ . 1 . 2 . 3]" 1
1065 1 96 ILE MD 1 99 SER H 3.900 . 5.500 4.266 4.041 4.540 . 0 0 "[ . 1 . 2 . 3]" 1
1066 1 96 ILE MD 1 100 GLU H 3.300 . 4.700 3.358 3.074 3.584 . 0 0 "[ . 1 . 2 . 3]" 1
1067 1 96 ILE MD 1 100 GLU HA 3.300 . 4.700 4.418 4.195 4.542 . 0 0 "[ . 1 . 2 . 3]" 1
1068 1 96 ILE MD 1 100 GLU HB2 2.700 . 3.600 2.454 2.112 2.715 . 0 0 "[ . 1 . 2 . 3]" 1
1069 1 96 ILE MD 1 100 GLU QG 3.000 . 4.100 3.665 3.398 3.943 . 0 0 "[ . 1 . 2 . 3]" 1
1070 1 96 ILE MD 1 101 LEU H 2.700 . 3.600 2.249 1.937 2.480 . 0 0 "[ . 1 . 2 . 3]" 1
1071 1 96 ILE MD 1 104 MET QB 3.600 . 5.200 4.874 4.641 4.995 . 0 0 "[ . 1 . 2 . 3]" 1
1072 1 96 ILE MD 1 104 MET ME 2.300 . 5.500 3.957 3.754 4.187 . 0 0 "[ . 1 . 2 . 3]" 1
1073 1 96 ILE HG12 1 96 ILE MG 2.100 . 5.500 3.187 3.175 3.197 . 0 0 "[ . 1 . 2 . 3]" 1
1074 1 96 ILE HG12 1 97 ASP H 3.100 . 4.300 2.162 2.033 2.286 . 0 0 "[ . 1 . 2 . 3]" 1
1075 1 96 ILE HG13 1 96 ILE MG 2.300 . 3.000 2.285 2.194 2.378 . 0 0 "[ . 1 . 2 . 3]" 1
1076 1 96 ILE HG13 1 97 ASP H 2.900 . 4.000 3.038 2.820 3.243 . 0 0 "[ . 1 . 2 . 3]" 1
1077 1 96 ILE HG13 1 104 MET ME 3.100 . 5.500 5.239 4.981 5.508 0.008 26 0 "[ . 1 . 2 . 3]" 1
1078 1 96 ILE HG13 1 118 ALA MB 2.100 . 5.500 4.454 4.149 4.738 . 0 0 "[ . 1 . 2 . 3]" 1
1079 1 96 ILE MG 1 97 ASP H 2.400 . 5.500 3.365 3.342 3.382 . 0 0 "[ . 1 . 2 . 3]" 1
1080 1 96 ILE MG 1 97 ASP HA 3.500 . 5.500 5.469 5.450 5.484 . 0 0 "[ . 1 . 2 . 3]" 1
1081 1 96 ILE MG 1 97 ASP HB2 3.400 . 4.800 4.894 4.878 4.919 0.119 19 0 "[ . 1 . 2 . 3]" 1
1082 1 96 ILE MG 1 97 ASP HB3 3.200 . 5.500 5.366 5.238 5.485 . 0 0 "[ . 1 . 2 . 3]" 1
1083 1 96 ILE MG 1 100 GLU HA 3.100 . 5.500 5.629 5.586 5.671 0.171 24 0 "[ . 1 . 2 . 3]" 1
1084 1 96 ILE MG 1 100 GLU HB2 2.200 . 5.500 3.053 2.981 3.153 . 0 0 "[ . 1 . 2 . 3]" 1
1085 1 96 ILE MG 1 100 GLU QG 2.600 . 5.500 3.637 3.426 3.873 . 0 0 "[ . 1 . 2 . 3]" 1
1086 1 96 ILE MG 1 104 MET ME 2.800 . 5.500 4.550 4.405 4.700 . 0 0 "[ . 1 . 2 . 3]" 1
1087 1 96 ILE MG 1 115 VAL QG 2.600 . 5.500 4.662 4.503 4.857 . 0 0 "[ . 1 . 2 . 3]" 1
1088 1 96 ILE MG 1 118 ALA MB 2.700 . 3.600 2.559 2.297 2.775 . 0 0 "[ . 1 . 2 . 3]" 1
1089 1 97 ASP H 1 97 ASP HA 2.500 . 3.300 2.786 2.765 2.796 . 0 0 "[ . 1 . 2 . 3]" 1
1090 1 97 ASP H 1 97 ASP HB2 2.300 . 3.000 2.152 2.121 2.188 . 0 0 "[ . 1 . 2 . 3]" 1
1091 1 97 ASP H 1 97 ASP HB3 2.400 . 3.100 2.840 2.767 2.919 . 0 0 "[ . 1 . 2 . 3]" 1
1092 1 97 ASP H 1 98 ASN H 3.100 . 4.300 2.714 2.670 2.747 . 0 0 "[ . 1 . 2 . 3]" 1
1093 1 97 ASP H 1 99 SER H 4.000 . 5.500 4.347 4.256 4.464 . 0 0 "[ . 1 . 2 . 3]" 1
1094 1 97 ASP H 1 100 GLU H 3.500 . 5.000 4.119 4.058 4.212 . 0 0 "[ . 1 . 2 . 3]" 1
1095 1 97 ASP HA 1 97 ASP HB3 2.300 . 3.000 2.997 2.982 3.011 0.011 26 0 "[ . 1 . 2 . 3]" 1
1096 1 97 ASP HB2 1 98 ASN H 3.000 . 4.100 4.044 3.983 4.103 0.003 27 0 "[ . 1 . 2 . 3]" 1
1097 1 97 ASP HB2 1 99 SER H 3.200 . 4.500 4.183 4.089 4.306 . 0 0 "[ . 1 . 2 . 3]" 1
1098 1 97 ASP HB2 1 100 GLU H 3.100 . 5.500 4.426 4.292 4.556 . 0 0 "[ . 1 . 2 . 3]" 1
1099 1 97 ASP HB2 1 100 GLU HB2 3.400 . 5.500 5.176 4.862 5.515 0.015 27 0 "[ . 1 . 2 . 3]" 1
1100 1 97 ASP HB2 1 100 GLU QG 3.600 . 5.200 3.487 2.914 4.517 . 0 0 "[ . 1 . 2 . 3]" 1
1101 1 97 ASP HB3 1 98 ASN H 3.000 . 4.100 3.451 3.276 3.544 . 0 0 "[ . 1 . 2 . 3]" 1
1102 1 97 ASP HB3 1 99 SER H 2.800 . 3.800 2.544 2.427 2.672 . 0 0 "[ . 1 . 2 . 3]" 1
1103 1 97 ASP HB3 1 99 SER QB 3.400 . 4.800 3.113 2.936 3.267 . 0 0 "[ . 1 . 2 . 3]" 1
1104 1 97 ASP HB3 1 100 GLU H 2.800 . 3.800 3.086 2.952 3.201 . 0 0 "[ . 1 . 2 . 3]" 1
1105 1 97 ASP HB3 1 100 GLU HB2 3.000 . 5.500 4.669 4.221 4.911 . 0 0 "[ . 1 . 2 . 3]" 1
1106 1 97 ASP HB3 1 100 GLU HB3 3.100 . 5.500 5.580 5.545 5.641 0.141 25 0 "[ . 1 . 2 . 3]" 1
1107 1 97 ASP HB3 1 100 GLU QG 3.300 . 4.700 3.100 2.633 4.143 . 0 0 "[ . 1 . 2 . 3]" 1
1108 1 98 ASN H 1 98 ASN QB 2.400 . 5.500 3.227 3.075 3.413 . 0 0 "[ . 1 . 2 . 3]" 1
1109 1 98 ASN H 1 100 GLU H 3.800 . 5.500 3.307 3.217 3.454 . 0 0 "[ . 1 . 2 . 3]" 1
1110 1 98 ASN H 1 101 LEU H 4.300 . 5.500 3.536 3.422 3.647 . 0 0 "[ . 1 . 2 . 3]" 1
1111 1 98 ASN HA 1 98 ASN QB 2.300 . 2.800 2.386 2.139 2.536 . 0 0 "[ . 1 . 2 . 3]" 1
1112 1 98 ASN HA 1 99 SER H 2.600 . 3.400 3.457 3.424 3.482 0.082 2 0 "[ . 1 . 2 . 3]" 1
1113 1 98 ASN HA 1 102 LEU QB 2.800 . 5.500 5.280 5.060 5.373 . 0 0 "[ . 1 . 2 . 3]" 1
1114 1 98 ASN HA 1 102 LEU QD 3.100 . 4.300 3.979 3.599 4.232 . 0 0 "[ . 1 . 2 . 3]" 1
1115 1 98 ASN QB 1 99 SER H 2.700 . 3.600 3.074 2.885 3.393 . 0 0 "[ . 1 . 2 . 3]" 1
1116 1 98 ASN QB 1 100 GLU H 4.200 . 5.500 4.706 4.575 4.891 . 0 0 "[ . 1 . 2 . 3]" 1
1117 1 98 ASN QB 1 102 LEU H 4.600 . 5.500 5.131 4.928 5.241 . 0 0 "[ . 1 . 2 . 3]" 1
1118 1 98 ASN QB 1 102 LEU QD 2.600 . 5.500 3.511 3.232 4.042 . 0 0 "[ . 1 . 2 . 3]" 1
1119 1 99 SER H 1 99 SER HA 2.400 . 3.100 2.866 2.838 2.887 . 0 0 "[ . 1 . 2 . 3]" 1
1120 1 99 SER H 1 99 SER QB 2.200 . 2.800 2.500 2.082 2.717 . 0 0 "[ . 1 . 2 . 3]" 1
1121 1 99 SER H 1 100 GLU H 2.400 . 3.100 2.390 2.302 2.495 . 0 0 "[ . 1 . 2 . 3]" 1
1122 1 99 SER H 1 101 LEU H 3.300 . 4.700 3.758 3.659 4.036 . 0 0 "[ . 1 . 2 . 3]" 1
1123 1 99 SER H 1 102 LEU H 4.200 . 5.500 4.718 4.571 4.823 . 0 0 "[ . 1 . 2 . 3]" 1
1124 1 99 SER HA 1 100 GLU H 2.800 . 3.800 3.460 3.428 3.501 . 0 0 "[ . 1 . 2 . 3]" 1
1125 1 99 SER HA 1 102 LEU H 2.900 . 4.000 3.317 3.231 3.468 . 0 0 "[ . 1 . 2 . 3]" 1
1126 1 99 SER HA 1 102 LEU QB 3.000 . 4.100 2.557 2.366 2.664 . 0 0 "[ . 1 . 2 . 3]" 1
1127 1 99 SER HA 1 102 LEU QD 2.800 . 3.800 3.213 2.985 3.595 . 0 0 "[ . 1 . 2 . 3]" 1
1128 1 99 SER HA 1 103 HIS H 3.500 . 5.000 3.966 3.727 4.223 . 0 0 "[ . 1 . 2 . 3]" 1
1129 1 99 SER QB 1 100 GLU H 2.500 . 3.300 3.007 2.799 3.219 . 0 0 "[ . 1 . 2 . 3]" 1
1130 1 99 SER QB 1 102 LEU QB 3.000 . 4.500 4.081 3.892 4.146 . 0 0 "[ . 1 . 2 . 3]" 1
1131 1 100 GLU H 1 100 GLU HA 2.400 . 3.100 2.882 2.850 2.906 . 0 0 "[ . 1 . 2 . 3]" 1
1132 1 100 GLU H 1 100 GLU HB2 2.300 . 3.000 2.704 2.378 2.878 . 0 0 "[ . 1 . 2 . 3]" 1
1133 1 100 GLU H 1 100 GLU HB3 2.400 . 5.500 3.592 3.567 3.618 . 0 0 "[ . 1 . 2 . 3]" 1
1134 1 100 GLU H 1 100 GLU QG 2.800 . 3.800 2.372 1.870 3.195 . 0 0 "[ . 1 . 2 . 3]" 1
1135 1 100 GLU H 1 101 LEU H 2.400 . 3.100 2.331 2.209 2.570 . 0 0 "[ . 1 . 2 . 3]" 1
1136 1 100 GLU H 1 102 LEU H 3.200 . 4.500 3.765 3.583 3.891 . 0 0 "[ . 1 . 2 . 3]" 1
1137 1 100 GLU HA 1 100 GLU HB3 2.100 . 2.700 2.354 2.282 2.500 . 0 0 "[ . 1 . 2 . 3]" 1
1138 1 100 GLU HA 1 100 GLU QG 2.400 . 3.100 2.589 2.311 2.804 . 0 0 "[ . 1 . 2 . 3]" 1
1139 1 100 GLU HA 1 102 LEU H 3.000 . 4.100 3.859 3.655 4.006 . 0 0 "[ . 1 . 2 . 3]" 1
1140 1 100 GLU HA 1 103 HIS H 2.700 . 3.600 3.261 3.073 3.330 . 0 0 "[ . 1 . 2 . 3]" 1
1141 1 100 GLU HA 1 103 HIS HA 3.700 . 5.400 5.318 5.235 5.359 . 0 0 "[ . 1 . 2 . 3]" 1
1142 1 100 GLU HA 1 103 HIS HB2 2.500 . 3.300 3.021 2.898 3.157 . 0 0 "[ . 1 . 2 . 3]" 1
1143 1 100 GLU HA 1 103 HIS HB3 2.400 . 3.100 3.285 3.060 3.347 0.247 8 0 "[ . 1 . 2 . 3]" 1
1144 1 100 GLU HA 1 104 MET H 3.500 . 5.000 3.481 3.366 3.638 . 0 0 "[ . 1 . 2 . 3]" 1
1145 1 100 GLU HA 1 104 MET ME 3.600 . 5.200 5.277 5.230 5.330 0.130 27 0 "[ . 1 . 2 . 3]" 1
1146 1 100 GLU HB2 1 102 LEU H 3.700 . 5.400 4.932 4.684 5.012 . 0 0 "[ . 1 . 2 . 3]" 1
1147 1 100 GLU HB2 1 104 MET ME 3.100 . 5.500 4.664 4.455 4.908 . 0 0 "[ . 1 . 2 . 3]" 1
1148 1 100 GLU HB2 1 118 ALA MB 3.300 . 4.700 4.595 4.364 4.842 0.142 27 0 "[ . 1 . 2 . 3]" 1
1149 1 100 GLU HB3 1 102 LEU H 2.700 . 5.500 5.445 5.082 5.558 0.058 15 0 "[ . 1 . 2 . 3]" 1
1150 1 100 GLU HB3 1 104 MET ME 1.900 . 5.500 4.457 3.990 4.739 . 0 0 "[ . 1 . 2 . 3]" 1
1151 1 100 GLU QG 1 103 HIS H 3.900 . 5.500 5.284 5.205 5.353 . 0 0 "[ . 1 . 2 . 3]" 1
1152 1 101 LEU H 1 101 LEU HA 2.800 . 3.800 2.860 2.769 2.882 . 0 0 "[ . 1 . 2 . 3]" 1
1153 1 101 LEU H 1 101 LEU HB2 2.300 . 3.000 2.857 2.451 3.373 0.373 11 0 "[ . 1 . 2 . 3]" 1
1154 1 101 LEU H 1 101 LEU HB3 2.800 . 3.800 2.274 2.077 2.558 . 0 0 "[ . 1 . 2 . 3]" 1
1155 1 101 LEU H 1 102 LEU H 2.600 . 3.400 2.399 2.294 2.732 . 0 0 "[ . 1 . 2 . 3]" 1
1156 1 101 LEU H 1 103 HIS H 3.500 . 5.000 4.135 4.021 4.449 . 0 0 "[ . 1 . 2 . 3]" 1
1157 1 101 LEU H 1 104 MET H 4.100 . 5.500 4.743 4.653 4.916 . 0 0 "[ . 1 . 2 . 3]" 1
1158 1 101 LEU HA 1 102 LEU H 3.100 . 4.300 3.446 3.409 3.480 . 0 0 "[ . 1 . 2 . 3]" 1
1159 1 101 LEU HA 1 103 HIS H 3.700 . 5.400 4.833 4.740 4.926 . 0 0 "[ . 1 . 2 . 3]" 1
1160 1 101 LEU HA 1 104 MET H 2.900 . 4.000 4.027 3.908 4.075 0.075 26 0 "[ . 1 . 2 . 3]" 1
1161 1 101 LEU HA 1 105 LEU H 3.500 . 5.000 4.712 4.583 4.863 . 0 0 "[ . 1 . 2 . 3]" 1
1162 1 101 LEU HB3 1 102 LEU H 3.800 . 5.500 3.044 2.877 3.565 . 0 0 "[ . 1 . 2 . 3]" 1
1163 1 101 LEU MD2 1 102 LEU H 3.000 . 4.100 3.894 3.300 4.341 0.241 8 0 "[ . 1 . 2 . 3]" 1
1164 1 102 LEU H 1 102 LEU HA 2.500 . 3.300 2.904 2.882 2.916 . 0 0 "[ . 1 . 2 . 3]" 1
1165 1 102 LEU H 1 102 LEU QB 2.300 . 3.100 2.140 2.087 2.247 . 0 0 "[ . 1 . 2 . 3]" 1
1166 1 102 LEU H 1 102 LEU QD 2.700 . 3.600 2.731 2.446 3.030 . 0 0 "[ . 1 . 2 . 3]" 1
1167 1 102 LEU H 1 102 LEU HG 2.500 . 5.500 4.004 3.047 4.318 . 0 0 "[ . 1 . 2 . 3]" 1
1168 1 102 LEU H 1 103 HIS H 2.600 . 3.400 2.400 2.309 2.498 . 0 0 "[ . 1 . 2 . 3]" 1
1169 1 102 LEU HA 1 102 LEU QB 2.200 . 2.800 2.505 2.439 2.528 . 0 0 "[ . 1 . 2 . 3]" 1
1170 1 102 LEU HA 1 102 LEU QD 1.800 . 5.500 2.404 1.638 2.742 . 0 0 "[ . 1 . 2 . 3]" 1
1171 1 102 LEU HA 1 103 HIS H 2.800 . 3.800 3.548 3.539 3.555 . 0 0 "[ . 1 . 2 . 3]" 1
1172 1 102 LEU HA 1 105 LEU HB2 2.200 . 5.500 3.592 3.238 3.823 . 0 0 "[ . 1 . 2 . 3]" 1
1173 1 102 LEU HA 1 105 LEU HB3 2.700 . 5.500 5.178 4.850 5.404 . 0 0 "[ . 1 . 2 . 3]" 1
1174 1 102 LEU HA 1 105 LEU MD1 2.000 . 5.500 2.952 2.721 3.163 . 0 0 "[ . 1 . 2 . 3]" 1
1175 1 102 LEU HA 1 105 LEU HG 2.500 . 5.500 3.560 3.355 3.783 . 0 0 "[ . 1 . 2 . 3]" 1
1176 1 102 LEU HA 1 106 GLU QB 3.300 . 4.700 4.648 4.575 4.737 0.037 28 0 "[ . 1 . 2 . 3]" 1
1177 1 102 LEU QB 1 102 LEU QD 2.400 . 3.100 1.904 1.817 1.995 . 0 0 "[ . 1 . 2 . 3]" 1
1178 1 102 LEU QB 1 103 HIS H 2.600 . 3.400 2.540 2.353 2.651 . 0 0 "[ . 1 . 2 . 3]" 1
1179 1 102 LEU QB 1 104 MET H 3.800 . 5.200 4.606 4.480 4.712 . 0 0 "[ . 1 . 2 . 3]" 1
1180 1 102 LEU QB 1 106 GLU H 4.800 . 5.500 5.238 5.141 5.319 . 0 0 "[ . 1 . 2 . 3]" 1
1181 1 102 LEU QD 1 103 HIS H 3.300 . 4.700 3.956 3.900 4.016 . 0 0 "[ . 1 . 2 . 3]" 1
1182 1 103 HIS H 1 103 HIS HA 2.500 . 3.300 2.811 2.787 2.828 . 0 0 "[ . 1 . 2 . 3]" 1
1183 1 103 HIS H 1 103 HIS HB2 2.300 . 3.000 2.073 2.038 2.162 . 0 0 "[ . 1 . 2 . 3]" 1
1184 1 103 HIS H 1 103 HIS HB3 2.300 . 3.000 3.061 2.963 3.092 0.092 25 0 "[ . 1 . 2 . 3]" 1
1185 1 103 HIS H 1 104 MET H 2.500 . 3.300 2.667 2.598 2.778 . 0 0 "[ . 1 . 2 . 3]" 1
1186 1 103 HIS H 1 105 LEU H 3.500 . 5.000 4.188 4.105 4.278 . 0 0 "[ . 1 . 2 . 3]" 1
1187 1 103 HIS H 1 106 GLU H 3.600 . 5.200 4.773 4.652 4.905 . 0 0 "[ . 1 . 2 . 3]" 1
1188 1 103 HIS HA 1 103 HIS HB2 2.500 . 3.300 2.755 2.684 2.778 . 0 0 "[ . 1 . 2 . 3]" 1
1189 1 103 HIS HA 1 103 HIS HB3 2.300 . 3.000 2.931 2.915 2.978 . 0 0 "[ . 1 . 2 . 3]" 1
1190 1 103 HIS HA 1 104 MET H 3.000 . 4.100 3.538 3.498 3.565 . 0 0 "[ . 1 . 2 . 3]" 1
1191 1 103 HIS HA 1 105 LEU H 3.500 . 5.000 4.126 4.033 4.225 . 0 0 "[ . 1 . 2 . 3]" 1
1192 1 103 HIS HA 1 106 GLU H 2.900 . 4.000 3.196 3.085 3.340 . 0 0 "[ . 1 . 2 . 3]" 1
1193 1 103 HIS HA 1 106 GLU HA 2.900 . 5.500 5.068 4.805 5.268 . 0 0 "[ . 1 . 2 . 3]" 1
1194 1 103 HIS HA 1 106 GLU QB 2.400 . 3.100 2.622 1.898 3.074 . 0 0 "[ . 1 . 2 . 3]" 1
1195 1 103 HIS HA 1 106 GLU HG2 2.800 . 3.800 2.699 1.795 3.868 0.068 9 0 "[ . 1 . 2 . 3]" 1
1196 1 103 HIS HA 1 106 GLU HG3 2.800 . 3.800 3.250 2.389 3.820 0.020 4 0 "[ . 1 . 2 . 3]" 1
1197 1 103 HIS HA 1 107 SER H 3.500 . 5.000 4.254 4.121 4.527 . 0 0 "[ . 1 . 2 . 3]" 1
1198 1 103 HIS HB2 1 104 MET H 2.900 . 4.000 3.401 3.298 3.564 . 0 0 "[ . 1 . 2 . 3]" 1
1199 1 103 HIS HB3 1 104 MET H 2.700 . 3.600 2.791 2.531 3.053 . 0 0 "[ . 1 . 2 . 3]" 1
1200 1 103 HIS HB3 1 105 LEU H 4.200 . 5.500 5.011 4.870 5.112 . 0 0 "[ . 1 . 2 . 3]" 1
1201 1 104 MET H 1 104 MET HA 2.600 . 3.400 2.784 2.740 2.828 . 0 0 "[ . 1 . 2 . 3]" 1
1202 1 104 MET H 1 104 MET QB 2.200 . 2.800 2.406 2.289 2.625 . 0 0 "[ . 1 . 2 . 3]" 1
1203 1 104 MET H 1 104 MET QG 2.300 . 3.000 2.371 2.127 2.523 . 0 0 "[ . 1 . 2 . 3]" 1
1204 1 104 MET H 1 105 LEU H 2.600 . 3.400 2.736 2.584 2.873 . 0 0 "[ . 1 . 2 . 3]" 1
1205 1 104 MET H 1 106 GLU H 3.300 . 4.700 3.850 3.661 3.981 . 0 0 "[ . 1 . 2 . 3]" 1
1206 1 104 MET H 1 107 SER H 3.900 . 5.500 4.885 4.775 5.057 . 0 0 "[ . 1 . 2 . 3]" 1
1207 1 104 MET H 1 110 SER QB 3.000 . 4.100 3.035 2.906 3.311 . 0 0 "[ . 1 . 2 . 3]" 1
1208 1 104 MET H 1 111 LEU HA 3.700 . 5.400 4.409 4.220 4.521 . 0 0 "[ . 1 . 2 . 3]" 1
1209 1 104 MET H 1 111 LEU HB2 2.700 . 5.500 5.308 4.763 5.600 0.100 29 0 "[ . 1 . 2 . 3]" 1
1210 1 104 MET HA 1 104 MET QB 2.000 . 2.500 2.186 2.178 2.193 . 0 0 "[ . 1 . 2 . 3]" 1
1211 1 104 MET HA 1 104 MET ME 2.900 . 4.000 4.028 3.934 4.073 0.073 23 0 "[ . 1 . 2 . 3]" 1
1212 1 104 MET HA 1 104 MET QG 2.900 . 4.000 3.314 3.290 3.327 . 0 0 "[ . 1 . 2 . 3]" 1
1213 1 104 MET HA 1 105 LEU H 3.100 . 4.300 3.517 3.500 3.537 . 0 0 "[ . 1 . 2 . 3]" 1
1214 1 104 MET HA 1 106 GLU H 3.200 . 4.500 3.905 3.791 3.971 . 0 0 "[ . 1 . 2 . 3]" 1
1215 1 104 MET HA 1 107 SER H 2.700 . 3.600 3.611 3.443 3.667 0.067 18 0 "[ . 1 . 2 . 3]" 1
1216 1 104 MET HA 1 107 SER QB 3.100 . 4.300 3.994 3.799 4.097 . 0 0 "[ . 1 . 2 . 3]" 1
1217 1 104 MET HA 1 110 SER H 3.800 . 5.500 3.971 3.838 4.106 . 0 0 "[ . 1 . 2 . 3]" 1
1218 1 104 MET HA 1 110 SER QB 2.200 . 2.800 2.098 1.962 2.456 . 0 0 "[ . 1 . 2 . 3]" 1
1219 1 104 MET HA 1 111 LEU H 3.300 . 4.700 2.200 1.984 2.327 . 0 0 "[ . 1 . 2 . 3]" 1
1220 1 104 MET HA 1 111 LEU HA 3.500 . 5.000 2.614 2.501 2.732 . 0 0 "[ . 1 . 2 . 3]" 1
1221 1 104 MET HA 1 111 LEU HB2 3.000 . 4.100 2.827 2.347 3.096 . 0 0 "[ . 1 . 2 . 3]" 1
1222 1 104 MET HA 1 111 LEU QD 2.800 . 3.800 3.479 3.125 3.738 . 0 0 "[ . 1 . 2 . 3]" 1
1223 1 104 MET QB 1 104 MET ME 1.800 . 2.200 1.927 1.805 1.995 . 0 0 "[ . 1 . 2 . 3]" 1
1224 1 104 MET QB 1 105 LEU H 2.500 . 5.500 3.473 3.416 3.511 . 0 0 "[ . 1 . 2 . 3]" 1
1225 1 104 MET QB 1 105 LEU MD2 3.400 . 4.800 3.608 3.304 4.013 . 0 0 "[ . 1 . 2 . 3]" 1
1226 1 104 MET QB 1 110 SER QB 2.700 . 3.600 3.350 3.276 3.471 . 0 0 "[ . 1 . 2 . 3]" 1
1227 1 104 MET QB 1 111 LEU H 3.100 . 4.300 3.382 3.200 3.517 . 0 0 "[ . 1 . 2 . 3]" 1
1228 1 104 MET QB 1 111 LEU HB2 3.300 . 4.700 2.576 1.946 3.028 . 0 0 "[ . 1 . 2 . 3]" 1
1229 1 104 MET QB 1 111 LEU QD 2.400 . 3.100 1.971 1.652 2.461 0.048 29 0 "[ . 1 . 2 . 3]" 1
1230 1 104 MET QB 1 112 ARG H 3.900 . 5.500 4.753 4.632 4.847 . 0 0 "[ . 1 . 2 . 3]" 1
1231 1 104 MET QB 1 114 LYS H 4.400 . 5.500 4.900 4.677 5.358 . 0 0 "[ . 1 . 2 . 3]" 1
1232 1 104 MET ME 1 104 MET QG 2.200 . 2.800 2.526 2.469 2.608 . 0 0 "[ . 1 . 2 . 3]" 1
1233 1 104 MET ME 1 105 LEU HG 2.800 . 5.500 4.576 4.448 4.665 . 0 0 "[ . 1 . 2 . 3]" 1
1234 1 104 MET ME 1 110 SER QB 3.200 . 5.500 5.069 4.958 5.178 . 0 0 "[ . 1 . 2 . 3]" 1
1235 1 104 MET ME 1 111 LEU HA 2.400 . 3.100 2.659 2.480 2.864 . 0 0 "[ . 1 . 2 . 3]" 1
1236 1 104 MET ME 1 111 LEU QD 1.800 . 2.200 1.644 1.367 1.961 0.033 13 0 "[ . 1 . 2 . 3]" 1
1237 1 104 MET ME 1 115 VAL HA 3.900 . 5.500 4.604 4.419 4.877 . 0 0 "[ . 1 . 2 . 3]" 1
1238 1 104 MET ME 1 115 VAL HB 3.500 . 5.000 4.723 4.528 4.846 . 0 0 "[ . 1 . 2 . 3]" 1
1239 1 104 MET ME 1 115 VAL QG 2.800 . 3.800 2.819 2.675 2.953 . 0 0 "[ . 1 . 2 . 3]" 1
1240 1 104 MET ME 1 118 ALA MB 2.200 . 5.500 4.974 4.854 5.161 . 0 0 "[ . 1 . 2 . 3]" 1
1241 1 104 MET QG 1 105 LEU H 3.200 . 4.500 1.903 1.822 2.081 0.078 22 0 "[ . 1 . 2 . 3]" 1
1242 1 104 MET QG 1 105 LEU HA 3.100 . 4.300 3.416 3.188 3.812 . 0 0 "[ . 1 . 2 . 3]" 1
1243 1 104 MET QG 1 105 LEU MD2 3.200 . 4.500 2.306 1.893 2.834 0.007 13 0 "[ . 1 . 2 . 3]" 1
1244 1 104 MET QG 1 106 GLU H 4.700 . 5.500 3.961 3.863 4.056 . 0 0 "[ . 1 . 2 . 3]" 1
1245 1 104 MET QG 1 107 SER H 4.900 . 5.500 5.089 4.950 5.218 . 0 0 "[ . 1 . 2 . 3]" 1
1246 1 104 MET QG 1 110 SER QB 3.500 . 5.000 4.425 4.328 4.611 . 0 0 "[ . 1 . 2 . 3]" 1
1247 1 104 MET QG 1 111 LEU H 4.300 . 5.500 5.026 4.807 5.157 . 0 0 "[ . 1 . 2 . 3]" 1
1248 1 104 MET QG 1 111 LEU QD 3.200 . 4.500 2.963 2.117 3.623 . 0 0 "[ . 1 . 2 . 3]" 1
1249 1 105 LEU H 1 105 LEU HA 2.400 . 3.100 2.903 2.875 2.917 . 0 0 "[ . 1 . 2 . 3]" 1
1250 1 105 LEU H 1 105 LEU HB2 2.200 . 2.800 2.680 2.517 2.816 0.016 4 0 "[ . 1 . 2 . 3]" 1
1251 1 105 LEU H 1 105 LEU HB3 2.500 . 5.500 3.641 3.606 3.659 . 0 0 "[ . 1 . 2 . 3]" 1
1252 1 105 LEU H 1 105 LEU MD1 2.700 . 3.600 3.584 3.471 3.631 0.031 7 0 "[ . 1 . 2 . 3]" 1
1253 1 105 LEU H 1 105 LEU MD2 2.500 . 3.300 3.199 3.056 3.347 0.047 7 0 "[ . 1 . 2 . 3]" 1
1254 1 105 LEU H 1 105 LEU HG 2.300 . 3.000 2.128 1.951 2.323 . 0 0 "[ . 1 . 2 . 3]" 1
1255 1 105 LEU H 1 106 GLU H 2.400 . 3.100 2.308 2.198 2.450 . 0 0 "[ . 1 . 2 . 3]" 1
1256 1 105 LEU H 1 107 SER H 3.100 . 4.300 3.988 3.897 4.120 . 0 0 "[ . 1 . 2 . 3]" 1
1257 1 105 LEU HA 1 105 LEU HB2 2.300 . 3.000 3.006 2.985 3.020 0.020 3 0 "[ . 1 . 2 . 3]" 1
1258 1 105 LEU HA 1 105 LEU HB3 2.100 . 2.700 2.368 2.317 2.436 . 0 0 "[ . 1 . 2 . 3]" 1
1259 1 105 LEU HA 1 105 LEU MD2 2.000 . 2.500 2.280 1.964 2.478 . 0 0 "[ . 1 . 2 . 3]" 1
1260 1 105 LEU HA 1 105 LEU HG 2.500 . 3.300 3.268 3.155 3.333 0.033 28 0 "[ . 1 . 2 . 3]" 1
1261 1 105 LEU HA 1 106 GLU H 2.700 . 3.600 3.347 3.281 3.383 . 0 0 "[ . 1 . 2 . 3]" 1
1262 1 105 LEU HA 1 111 LEU QD 2.100 . 5.500 3.513 3.247 3.877 . 0 0 "[ . 1 . 2 . 3]" 1
1263 1 105 LEU HB2 1 106 GLU H 2.700 . 3.600 3.287 3.163 3.386 . 0 0 "[ . 1 . 2 . 3]" 1
1264 1 105 LEU HB2 1 107 SER H 3.300 . 5.500 5.219 5.137 5.333 . 0 0 "[ . 1 . 2 . 3]" 1
1265 1 105 LEU HB3 1 105 LEU MD2 2.100 . 2.700 2.272 2.156 2.354 . 0 0 "[ . 1 . 2 . 3]" 1
1266 1 105 LEU HB3 1 106 GLU H 2.900 . 5.500 4.259 4.134 4.355 . 0 0 "[ . 1 . 2 . 3]" 1
1267 1 105 LEU MD2 1 105 LEU HG 1.900 . 2.400 2.105 2.078 2.125 . 0 0 "[ . 1 . 2 . 3]" 1
1268 1 105 LEU MD2 1 106 GLU H 3.500 . 5.000 4.615 4.517 4.699 . 0 0 "[ . 1 . 2 . 3]" 1
1269 1 105 LEU MD2 1 107 SER H 3.900 . 5.500 5.544 5.506 5.573 0.073 9 0 "[ . 1 . 2 . 3]" 1
1270 1 105 LEU HG 1 106 GLU H 3.300 . 4.700 4.200 3.964 4.410 . 0 0 "[ . 1 . 2 . 3]" 1
1271 1 106 GLU H 1 106 GLU HA 2.500 . 3.300 2.925 2.909 2.935 . 0 0 "[ . 1 . 2 . 3]" 1
1272 1 106 GLU H 1 106 GLU QB 2.200 . 2.800 2.390 2.227 2.520 . 0 0 "[ . 1 . 2 . 3]" 1
1273 1 106 GLU H 1 106 GLU HG2 2.300 . 3.000 3.179 2.694 3.600 0.600 10 6 "[* . +* *. - 2 .* 3]" 1
1274 1 106 GLU H 1 111 LEU HB2 4.000 . 5.500 5.531 5.391 5.611 0.111 29 0 "[ . 1 . 2 . 3]" 1
1275 1 106 GLU HA 1 106 GLU QB 2.200 . 2.800 2.280 2.152 2.472 . 0 0 "[ . 1 . 2 . 3]" 1
1276 1 106 GLU HA 1 106 GLU HG2 2.800 . 3.800 3.624 2.891 4.218 0.418 14 0 "[ . 1 . 2 . 3]" 1
1277 1 106 GLU HA 1 106 GLU HG3 3.200 . 4.500 3.581 3.487 3.653 . 0 0 "[ . 1 . 2 . 3]" 1
1278 1 106 GLU HA 1 107 SER H 2.600 . 3.400 3.350 3.302 3.412 0.012 22 0 "[ . 1 . 2 . 3]" 1
1279 1 106 GLU QB 1 107 SER H 2.500 . 5.500 3.577 3.138 3.837 . 0 0 "[ . 1 . 2 . 3]" 1
1280 1 106 GLU QB 1 107 SER HA 2.900 . 5.500 4.705 4.244 4.970 . 0 0 "[ . 1 . 2 . 3]" 1
1281 1 106 GLU QB 1 107 SER QB 4.100 . 5.500 3.964 3.441 4.351 . 0 0 "[ . 1 . 2 . 3]" 1
1282 1 106 GLU HG2 1 107 SER H 3.400 . 4.800 4.353 3.092 4.879 0.079 30 0 "[ . 1 . 2 . 3]" 1
1283 1 107 SER H 1 107 SER HA 2.500 . 3.300 2.928 2.914 2.940 . 0 0 "[ . 1 . 2 . 3]" 1
1284 1 107 SER H 1 107 SER QB 2.400 . 3.100 2.699 2.463 2.754 . 0 0 "[ . 1 . 2 . 3]" 1
1285 1 107 SER H 1 110 SER H 3.900 . 5.500 4.159 4.005 4.346 . 0 0 "[ . 1 . 2 . 3]" 1
1286 1 107 SER H 1 111 LEU H 4.000 . 5.500 4.153 4.037 4.278 . 0 0 "[ . 1 . 2 . 3]" 1
1287 1 107 SER H 1 111 LEU HB2 3.600 . 5.200 4.728 4.548 4.850 . 0 0 "[ . 1 . 2 . 3]" 1
1288 1 107 SER H 1 111 LEU QD 4.200 . 5.500 5.077 4.826 5.284 . 0 0 "[ . 1 . 2 . 3]" 1
1289 1 107 SER HA 1 107 SER QB 2.400 . 3.000 2.487 2.463 2.522 . 0 0 "[ . 1 . 2 . 3]" 1
1290 1 107 SER HA 1 109 GLU H 3.300 . 4.700 3.639 3.587 3.801 . 0 0 "[ . 1 . 2 . 3]" 1
1291 1 107 SER HA 1 109 GLU QB 3.300 . 5.500 5.265 4.991 5.372 . 0 0 "[ . 1 . 2 . 3]" 1
1292 1 107 SER HA 1 110 SER H 3.700 . 5.400 4.203 4.141 4.335 . 0 0 "[ . 1 . 2 . 3]" 1
1293 1 107 SER HA 1 110 SER QB 2.000 . 5.500 4.231 4.010 4.999 . 0 0 "[ . 1 . 2 . 3]" 1
1294 1 107 SER QB 1 109 GLU H 4.500 . 5.500 2.608 2.265 2.738 . 0 0 "[ . 1 . 2 . 3]" 1
1295 1 107 SER QB 1 110 SER H 3.000 . 4.800 1.882 1.742 1.993 0.258 24 0 "[ . 1 . 2 . 3]" 1
1296 1 107 SER QB 1 110 SER QB 2.300 . 3.100 1.658 1.412 2.379 0.288 27 0 "[ . 1 . 2 . 3]" 1
1297 1 107 SER QB 1 111 LEU H 3.800 . 5.500 3.613 3.496 3.746 . 0 0 "[ . 1 . 2 . 3]" 1
1298 1 109 GLU H 1 109 GLU HA 2.500 . 3.300 2.949 2.920 2.955 . 0 0 "[ . 1 . 2 . 3]" 1
1299 1 109 GLU H 1 109 GLU QB 2.200 . 2.800 2.561 2.372 2.661 . 0 0 "[ . 1 . 2 . 3]" 1
1300 1 109 GLU H 1 109 GLU QG 3.200 . 3.800 3.109 2.784 3.622 . 0 0 "[ . 1 . 2 . 3]" 1
1301 1 109 GLU H 1 110 SER H 2.600 . 3.400 1.781 1.700 1.871 0.100 22 0 "[ . 1 . 2 . 3]" 1
1302 1 109 GLU H 1 111 LEU H 3.700 . 5.400 3.708 3.290 3.856 . 0 0 "[ . 1 . 2 . 3]" 1
1303 1 109 GLU H 1 112 ARG H 4.500 . 5.500 4.660 4.426 4.761 . 0 0 "[ . 1 . 2 . 3]" 1
1304 1 109 GLU HA 1 109 GLU QG 2.300 . 3.000 2.595 2.365 3.047 0.047 15 0 "[ . 1 . 2 . 3]" 1
1305 1 109 GLU HA 1 110 SER H 2.900 . 4.000 3.417 3.351 3.487 . 0 0 "[ . 1 . 2 . 3]" 1
1306 1 109 GLU HA 1 112 ARG H 2.700 . 3.600 3.359 3.276 3.429 . 0 0 "[ . 1 . 2 . 3]" 1
1307 1 109 GLU HA 1 112 ARG HA 4.100 . 5.500 5.517 5.455 5.551 0.051 27 0 "[ . 1 . 2 . 3]" 1
1308 1 109 GLU HA 1 112 ARG QB 2.100 . 2.700 2.737 2.695 2.804 0.104 28 0 "[ . 1 . 2 . 3]" 1
1309 1 109 GLU HA 1 112 ARG HD3 3.400 . 4.800 3.808 2.311 5.658 0.858 25 4 "[ .- 1 * *. 2 + 3]" 1
1310 1 109 GLU HA 1 112 ARG QG 2.900 . 4.000 3.928 3.877 3.954 . 0 0 "[ . 1 . 2 . 3]" 1
1311 1 109 GLU HA 1 113 SER H 3.100 . 4.300 3.799 3.444 4.113 . 0 0 "[ . 1 . 2 . 3]" 1
1312 1 109 GLU QB 1 110 SER H 2.500 . 3.300 3.123 2.948 3.237 . 0 0 "[ . 1 . 2 . 3]" 1
1313 1 109 GLU QB 1 110 SER HA 4.300 . 5.500 4.197 3.984 4.663 . 0 0 "[ . 1 . 2 . 3]" 1
1314 1 109 GLU QB 1 111 LEU H 3.100 . 5.500 5.101 5.021 5.190 . 0 0 "[ . 1 . 2 . 3]" 1
1315 1 109 GLU QB 1 112 ARG H 3.000 . 5.500 4.758 4.505 4.958 . 0 0 "[ . 1 . 2 . 3]" 1
1316 1 109 GLU QB 1 113 SER QB 3.900 . 5.500 3.991 3.461 4.670 . 0 0 "[ . 1 . 2 . 3]" 1
1317 1 109 GLU QG 1 110 SER H 3.900 . 4.500 3.879 2.703 4.304 . 0 0 "[ . 1 . 2 . 3]" 1
1318 1 110 SER H 1 110 SER HA 2.400 . 3.100 2.844 2.789 2.885 . 0 0 "[ . 1 . 2 . 3]" 1
1319 1 110 SER H 1 110 SER QB 2.300 . 3.000 2.221 2.078 2.790 . 0 0 "[ . 1 . 2 . 3]" 1
1320 1 110 SER H 1 112 ARG H 3.500 . 5.000 3.860 3.717 4.057 . 0 0 "[ . 1 . 2 . 3]" 1
1321 1 110 SER HA 1 110 SER QB 2.100 . 2.700 2.467 2.190 2.534 . 0 0 "[ . 1 . 2 . 3]" 1
1322 1 110 SER HA 1 111 LEU H 2.600 . 5.500 3.524 3.503 3.548 . 0 0 "[ . 1 . 2 . 3]" 1
1323 1 110 SER HA 1 112 ARG H 2.900 . 4.000 3.931 3.606 4.067 0.067 25 0 "[ . 1 . 2 . 3]" 1
1324 1 110 SER HA 1 113 SER H 3.100 . 4.300 3.470 3.218 3.870 . 0 0 "[ . 1 . 2 . 3]" 1
1325 1 110 SER HA 1 113 SER QB 2.300 . 3.000 2.588 2.291 2.966 . 0 0 "[ . 1 . 2 . 3]" 1
1326 1 110 SER HA 1 114 LYS H 3.500 . 5.000 3.147 2.780 3.454 . 0 0 "[ . 1 . 2 . 3]" 1
1327 1 110 SER HA 1 115 VAL H 3.800 . 5.500 5.425 5.236 5.599 0.099 1 0 "[ . 1 . 2 . 3]" 1
1328 1 110 SER QB 1 111 LEU H 2.600 . 3.400 2.663 2.392 3.056 . 0 0 "[ . 1 . 2 . 3]" 1
1329 1 110 SER QB 1 112 ARG H 3.600 . 5.200 4.487 4.253 4.771 . 0 0 "[ . 1 . 2 . 3]" 1
1330 1 110 SER QB 1 113 SER QB 2.600 . 5.500 4.521 4.179 4.862 . 0 0 "[ . 1 . 2 . 3]" 1
1331 1 111 LEU H 1 111 LEU HA 2.600 . 3.400 2.748 2.716 2.796 . 0 0 "[ . 1 . 2 . 3]" 1
1332 1 111 LEU H 1 111 LEU HB2 2.300 . 3.000 2.274 2.113 2.441 . 0 0 "[ . 1 . 2 . 3]" 1
1333 1 111 LEU H 1 111 LEU HB3 2.400 . 3.100 2.676 2.571 2.762 . 0 0 "[ . 1 . 2 . 3]" 1
1334 1 111 LEU H 1 111 LEU QD 3.000 . 4.100 3.573 3.369 3.690 . 0 0 "[ . 1 . 2 . 3]" 1
1335 1 111 LEU H 1 111 LEU HG 3.200 . 4.500 4.465 4.352 4.571 0.071 26 0 "[ . 1 . 2 . 3]" 1
1336 1 111 LEU H 1 112 ARG H 2.600 . 3.400 2.766 2.670 2.856 . 0 0 "[ . 1 . 2 . 3]" 1
1337 1 111 LEU H 1 113 SER H 3.400 . 4.800 4.681 4.310 4.818 0.018 29 0 "[ . 1 . 2 . 3]" 1
1338 1 111 LEU H 1 114 LYS H 3.600 . 5.200 4.766 4.668 4.999 . 0 0 "[ . 1 . 2 . 3]" 1
1339 1 111 LEU HA 1 111 LEU HB3 2.400 . 3.100 3.016 3.007 3.022 . 0 0 "[ . 1 . 2 . 3]" 1
1340 1 111 LEU HA 1 111 LEU QD 2.100 . 5.500 2.539 2.054 3.057 . 0 0 "[ . 1 . 2 . 3]" 1
1341 1 111 LEU HA 1 115 VAL QG 3.300 . 4.700 3.707 3.511 3.897 . 0 0 "[ . 1 . 2 . 3]" 1
1342 1 111 LEU HB2 1 111 LEU QD 2.100 . 2.700 2.025 1.865 2.158 . 0 0 "[ . 1 . 2 . 3]" 1
1343 1 111 LEU HB3 1 111 LEU QD 2.700 . 3.600 2.268 2.039 2.519 . 0 0 "[ . 1 . 2 . 3]" 1
1344 1 111 LEU HB3 1 112 ARG H 2.800 . 3.800 2.716 2.461 2.980 . 0 0 "[ . 1 . 2 . 3]" 1
1345 1 111 LEU HB3 1 112 ARG HA 3.200 . 4.500 4.253 4.119 4.382 . 0 0 "[ . 1 . 2 . 3]" 1
1346 1 111 LEU QD 1 112 ARG H 3.500 . 4.800 3.423 3.164 3.677 . 0 0 "[ . 1 . 2 . 3]" 1
1347 1 111 LEU QD 1 112 ARG HA 3.500 . 5.000 3.072 2.711 3.413 . 0 0 "[ . 1 . 2 . 3]" 1
1348 1 111 LEU QD 1 113 SER H 4.000 . 5.500 5.202 4.903 5.389 . 0 0 "[ . 1 . 2 . 3]" 1
1349 1 111 LEU QD 1 114 LYS H 3.300 . 5.500 5.152 4.732 5.389 . 0 0 "[ . 1 . 2 . 3]" 1
1350 1 111 LEU QD 1 115 VAL H 2.900 . 5.500 4.303 3.811 4.610 . 0 0 "[ . 1 . 2 . 3]" 1
1351 1 111 LEU QD 1 115 VAL HB 3.100 . 4.300 3.452 3.253 3.619 . 0 0 "[ . 1 . 2 . 3]" 1
1352 1 111 LEU QD 1 115 VAL QG 2.000 . 5.500 2.386 1.998 2.736 . 0 0 "[ . 1 . 2 . 3]" 1
1353 1 111 LEU HG 1 112 ARG H 3.300 . 5.500 4.712 4.525 5.072 . 0 0 "[ . 1 . 2 . 3]" 1
1354 1 112 ARG H 1 112 ARG HA 2.500 . 3.300 2.889 2.859 2.924 . 0 0 "[ . 1 . 2 . 3]" 1
1355 1 112 ARG H 1 112 ARG QB 2.000 . 2.500 2.156 2.069 2.351 . 0 0 "[ . 1 . 2 . 3]" 1
1356 1 112 ARG H 1 112 ARG HD3 3.500 . 5.000 4.679 3.572 5.847 0.847 14 5 "[ * .- 1 * +. 2 * 3]" 1
1357 1 112 ARG H 1 112 ARG QG 2.800 . 5.500 3.375 2.608 3.684 . 0 0 "[ . 1 . 2 . 3]" 1
1358 1 112 ARG H 1 113 SER H 2.600 . 3.400 2.633 2.379 2.799 . 0 0 "[ . 1 . 2 . 3]" 1
1359 1 112 ARG H 1 114 LYS H 3.700 . 5.400 3.813 3.333 4.256 . 0 0 "[ . 1 . 2 . 3]" 1
1360 1 112 ARG H 1 115 VAL H 4.400 . 5.500 4.330 4.027 4.554 . 0 0 "[ . 1 . 2 . 3]" 1
1361 1 112 ARG HA 1 112 ARG QB 2.000 . 2.500 2.246 2.167 2.431 . 0 0 "[ . 1 . 2 . 3]" 1
1362 1 112 ARG HA 1 112 ARG QG 2.300 . 3.000 2.705 2.293 2.901 . 0 0 "[ . 1 . 2 . 3]" 1
1363 1 112 ARG HA 1 113 SER H 3.000 . 4.100 3.565 3.542 3.578 . 0 0 "[ . 1 . 2 . 3]" 1
1364 1 112 ARG HA 1 114 LYS H 3.800 . 5.500 4.403 3.896 4.926 . 0 0 "[ . 1 . 2 . 3]" 1
1365 1 112 ARG HA 1 115 VAL H 2.900 . 4.000 3.336 3.004 3.593 . 0 0 "[ . 1 . 2 . 3]" 1
1366 1 112 ARG HA 1 115 VAL HA 4.400 . 5.500 5.262 4.947 5.507 0.007 23 0 "[ . 1 . 2 . 3]" 1
1367 1 112 ARG HA 1 115 VAL HB 2.100 . 2.700 2.424 2.180 2.623 . 0 0 "[ . 1 . 2 . 3]" 1
1368 1 112 ARG HA 1 115 VAL QG 2.700 . 3.600 3.097 2.969 3.192 . 0 0 "[ . 1 . 2 . 3]" 1
1369 1 112 ARG HA 1 116 ASP H 3.100 . 4.300 3.707 3.271 3.932 . 0 0 "[ . 1 . 2 . 3]" 1
1370 1 112 ARG QB 1 112 ARG HD3 2.400 . 3.100 2.534 2.167 3.212 0.112 3 0 "[ . 1 . 2 . 3]" 1
1371 1 112 ARG QB 1 113 SER H 2.300 . 3.000 2.502 2.063 2.856 . 0 0 "[ . 1 . 2 . 3]" 1
1372 1 112 ARG QB 1 113 SER HA 3.000 . 5.500 4.324 3.744 4.597 . 0 0 "[ . 1 . 2 . 3]" 1
1373 1 112 ARG QB 1 113 SER QB 4.400 . 5.500 4.247 3.720 4.799 . 0 0 "[ . 1 . 2 . 3]" 1
1374 1 112 ARG QB 1 115 VAL QG 3.800 . 5.500 4.279 4.096 4.381 . 0 0 "[ . 1 . 2 . 3]" 1
1375 1 112 ARG QB 1 116 ASP H 4.100 . 5.500 4.866 4.163 5.187 . 0 0 "[ . 1 . 2 . 3]" 1
1376 1 112 ARG HD3 1 113 SER H 4.000 . 5.500 4.517 4.081 5.631 0.131 28 0 "[ . 1 . 2 . 3]" 1
1377 1 112 ARG QG 1 113 SER H 3.400 . 4.800 2.712 2.012 4.086 . 0 0 "[ . 1 . 2 . 3]" 1
1378 1 112 ARG QG 1 114 LYS H 3.300 . 5.500 4.732 4.373 5.227 . 0 0 "[ . 1 . 2 . 3]" 1
1379 1 112 ARG QG 1 115 VAL H 3.600 . 5.200 4.677 4.458 4.927 . 0 0 "[ . 1 . 2 . 3]" 1
1380 1 112 ARG QG 1 116 ASP H 3.600 . 5.200 4.222 3.744 4.973 . 0 0 "[ . 1 . 2 . 3]" 1
1381 1 113 SER H 1 113 SER HA 2.300 . 3.000 2.755 2.716 2.841 . 0 0 "[ . 1 . 2 . 3]" 1
1382 1 113 SER H 1 113 SER QB 2.200 . 2.800 2.305 2.074 2.735 . 0 0 "[ . 1 . 2 . 3]" 1
1383 1 113 SER H 1 114 LYS H 2.500 . 3.300 2.825 2.514 3.016 . 0 0 "[ . 1 . 2 . 3]" 1
1384 1 113 SER H 1 115 VAL H 3.400 . 4.800 4.076 3.809 4.268 . 0 0 "[ . 1 . 2 . 3]" 1
1385 1 113 SER H 1 116 ASP H 3.700 . 5.400 4.861 4.767 5.019 . 0 0 "[ . 1 . 2 . 3]" 1
1386 1 113 SER HA 1 113 SER QB 2.300 . 3.000 2.393 2.252 2.538 . 0 0 "[ . 1 . 2 . 3]" 1
1387 1 113 SER HA 1 114 LYS H 3.000 . 4.100 3.518 3.452 3.580 . 0 0 "[ . 1 . 2 . 3]" 1
1388 1 113 SER HA 1 115 VAL H 4.000 . 5.500 4.324 4.110 4.703 . 0 0 "[ . 1 . 2 . 3]" 1
1389 1 113 SER HA 1 116 ASP H 3.200 . 4.500 3.857 3.610 4.221 . 0 0 "[ . 1 . 2 . 3]" 1
1390 1 113 SER QB 1 114 LYS H 2.500 . 3.300 2.622 2.228 2.880 . 0 0 "[ . 1 . 2 . 3]" 1
1391 1 113 SER QB 1 114 LYS HG2 3.600 . 5.200 3.275 3.044 4.230 . 0 0 "[ . 1 . 2 . 3]" 1
1392 1 113 SER QB 1 115 VAL H 3.700 . 5.400 4.629 4.406 4.922 . 0 0 "[ . 1 . 2 . 3]" 1
1393 1 114 LYS H 1 114 LYS HA 2.900 . 4.000 2.850 2.760 2.908 . 0 0 "[ . 1 . 2 . 3]" 1
1394 1 114 LYS H 1 114 LYS HB2 2.400 . 3.100 2.567 2.451 3.640 0.540 27 1 "[ . 1 . 2 . + 3]" 1
1395 1 114 LYS H 1 114 LYS HB3 2.600 . 5.500 3.590 2.713 3.663 . 0 0 "[ . 1 . 2 . 3]" 1
1396 1 114 LYS H 1 114 LYS HG2 2.500 . 3.300 2.299 1.972 3.089 . 0 0 "[ . 1 . 2 . 3]" 1
1397 1 114 LYS H 1 115 VAL H 2.400 . 3.100 2.512 2.326 2.804 . 0 0 "[ . 1 . 2 . 3]" 1
1398 1 114 LYS H 1 116 ASP H 3.400 . 4.800 4.406 4.144 4.793 . 0 0 "[ . 1 . 2 . 3]" 1
1399 1 114 LYS HA 1 115 VAL H 3.500 . 5.000 3.520 3.473 3.573 . 0 0 "[ . 1 . 2 . 3]" 1
1400 1 114 LYS HB2 1 115 VAL H 2.900 . 4.000 2.877 2.628 4.037 0.037 27 0 "[ . 1 . 2 . 3]" 1
1401 1 114 LYS HB3 1 115 VAL H 2.900 . 4.000 3.867 3.627 4.163 0.163 27 0 "[ . 1 . 2 . 3]" 1
1402 1 114 LYS HB3 1 115 VAL HA 3.800 . 5.500 4.557 4.359 5.691 0.191 27 0 "[ . 1 . 2 . 3]" 1
1403 1 114 LYS HB3 1 117 GLU H 4.300 . 5.500 5.401 5.059 5.536 0.036 16 0 "[ . 1 . 2 . 3]" 1
1404 1 114 LYS HB3 1 118 ALA H 4.300 . 5.500 4.912 4.647 5.724 0.224 27 0 "[ . 1 . 2 . 3]" 1
1405 1 114 LYS HG2 1 115 VAL H 3.100 . 4.300 4.279 2.359 4.785 0.485 7 0 "[ . 1 . 2 . 3]" 1
1406 1 115 VAL H 1 115 VAL HA 2.600 . 3.400 2.856 2.827 2.880 . 0 0 "[ . 1 . 2 . 3]" 1
1407 1 115 VAL H 1 115 VAL HB 2.300 . 3.000 2.206 2.185 2.234 . 0 0 "[ . 1 . 2 . 3]" 1
1408 1 115 VAL H 1 115 VAL QG 2.700 . 3.600 2.874 2.771 2.972 . 0 0 "[ . 1 . 2 . 3]" 1
1409 1 115 VAL H 1 117 GLU H 3.000 . 4.100 3.809 3.558 4.004 . 0 0 "[ . 1 . 2 . 3]" 1
1410 1 115 VAL H 1 118 ALA H 4.000 . 5.500 4.347 4.190 4.498 . 0 0 "[ . 1 . 2 . 3]" 1
1411 1 115 VAL HA 1 115 VAL HB 2.400 . 3.100 2.947 2.910 2.977 . 0 0 "[ . 1 . 2 . 3]" 1
1412 1 115 VAL HA 1 115 VAL QG 2.300 . 2.500 1.970 1.896 2.093 . 0 0 "[ . 1 . 2 . 3]" 1
1413 1 115 VAL HA 1 116 ASP H 3.100 . 4.300 3.574 3.553 3.588 . 0 0 "[ . 1 . 2 . 3]" 1
1414 1 115 VAL HA 1 117 GLU H 3.600 . 5.200 4.217 3.956 4.378 . 0 0 "[ . 1 . 2 . 3]" 1
1415 1 115 VAL HA 1 118 ALA H 2.900 . 4.000 3.201 2.995 3.314 . 0 0 "[ . 1 . 2 . 3]" 1
1416 1 115 VAL HA 1 118 ALA MB 2.200 . 2.800 2.415 2.121 2.612 . 0 0 "[ . 1 . 2 . 3]" 1
1417 1 115 VAL HA 1 119 VAL H 3.300 . 4.700 4.313 4.208 4.444 . 0 0 "[ . 1 . 2 . 3]" 1
1418 1 115 VAL HA 1 119 VAL QG 3.100 . 4.300 3.968 3.851 4.107 . 0 0 "[ . 1 . 2 . 3]" 1
1419 1 115 VAL HB 1 115 VAL QG 2.000 . 2.500 1.873 1.860 1.892 . 0 0 "[ . 1 . 2 . 3]" 1
1420 1 115 VAL HB 1 116 ASP H 2.500 . 3.300 2.711 2.513 2.913 . 0 0 "[ . 1 . 2 . 3]" 1
1421 1 115 VAL HB 1 117 GLU H 3.300 . 5.500 4.969 4.772 5.130 . 0 0 "[ . 1 . 2 . 3]" 1
1422 1 115 VAL HB 1 119 VAL QG 3.500 . 5.000 4.832 4.664 4.977 . 0 0 "[ . 1 . 2 . 3]" 1
1423 1 115 VAL QG 1 116 ASP H 2.800 . 3.800 2.368 2.190 2.572 . 0 0 "[ . 1 . 2 . 3]" 1
1424 1 115 VAL QG 1 116 ASP HA 2.700 . 3.600 2.834 2.684 2.956 . 0 0 "[ . 1 . 2 . 3]" 1
1425 1 115 VAL QG 1 117 GLU H 3.800 . 5.500 4.173 4.032 4.276 . 0 0 "[ . 1 . 2 . 3]" 1
1426 1 115 VAL QG 1 118 ALA H 3.300 . 4.700 4.055 3.948 4.179 . 0 0 "[ . 1 . 2 . 3]" 1
1427 1 115 VAL QG 1 118 ALA MB 2.800 . 3.800 3.216 3.038 3.327 . 0 0 "[ . 1 . 2 . 3]" 1
1428 1 115 VAL QG 1 119 VAL H 3.100 . 4.300 4.038 3.821 4.144 . 0 0 "[ . 1 . 2 . 3]" 1
1429 1 115 VAL QG 1 119 VAL HA 4.900 . 5.500 4.961 4.797 5.100 . 0 0 "[ . 1 . 2 . 3]" 1
1430 1 115 VAL QG 1 119 VAL QG 2.900 . 4.300 2.627 2.416 2.786 . 0 0 "[ . 1 . 2 . 3]" 1
1431 1 116 ASP H 1 116 ASP HA 2.500 . 3.300 2.765 2.733 2.797 . 0 0 "[ . 1 . 2 . 3]" 1
1432 1 116 ASP H 1 116 ASP HB2 2.400 . 3.100 2.548 2.052 3.134 0.034 27 0 "[ . 1 . 2 . 3]" 1
1433 1 116 ASP H 1 116 ASP HB3 2.500 . 3.300 2.604 2.071 3.334 0.034 15 0 "[ . 1 . 2 . 3]" 1
1434 1 116 ASP H 1 117 GLU H 2.600 . 3.400 2.772 2.640 2.893 . 0 0 "[ . 1 . 2 . 3]" 1
1435 1 116 ASP H 1 118 ALA H 3.500 . 5.000 4.053 3.878 4.309 . 0 0 "[ . 1 . 2 . 3]" 1
1436 1 116 ASP HA 1 116 ASP HB2 2.200 . 2.800 2.487 2.246 2.866 0.066 20 0 "[ . 1 . 2 . 3]" 1
1437 1 116 ASP HA 1 116 ASP HB3 2.400 . 3.100 2.963 2.830 3.033 . 0 0 "[ . 1 . 2 . 3]" 1
1438 1 116 ASP HA 1 117 GLU H 2.900 . 4.000 3.516 3.464 3.544 . 0 0 "[ . 1 . 2 . 3]" 1
1439 1 116 ASP HA 1 117 GLU HA 3.600 . 5.200 4.726 4.701 4.749 . 0 0 "[ . 1 . 2 . 3]" 1
1440 1 116 ASP HA 1 118 ALA H 3.500 . 5.000 4.319 4.075 4.569 . 0 0 "[ . 1 . 2 . 3]" 1
1441 1 116 ASP HA 1 119 VAL H 2.900 . 4.000 3.452 3.317 3.538 . 0 0 "[ . 1 . 2 . 3]" 1
1442 1 116 ASP HA 1 119 VAL HA 4.200 . 5.500 5.210 4.913 5.343 . 0 0 "[ . 1 . 2 . 3]" 1
1443 1 116 ASP HA 1 119 VAL HB 2.600 . 3.400 3.353 2.856 3.479 0.079 15 0 "[ . 1 . 2 . 3]" 1
1444 1 116 ASP HA 1 119 VAL QG 2.600 . 3.100 1.737 1.650 1.977 0.050 17 0 "[ . 1 . 2 . 3]" 1
1445 1 116 ASP HA 1 120 ALA H 3.300 . 5.500 4.792 4.729 4.844 . 0 0 "[ . 1 . 2 . 3]" 1
1446 1 116 ASP HA 1 120 ALA MB 5.000 . 5.500 5.594 5.527 5.643 0.143 21 0 "[ . 1 . 2 . 3]" 1
1447 1 116 ASP HB2 1 117 GLU H 2.600 . 5.500 3.862 3.120 4.225 . 0 0 "[ . 1 . 2 . 3]" 1
1448 1 116 ASP HB3 1 117 GLU H 2.800 . 3.800 2.881 2.644 3.184 . 0 0 "[ . 1 . 2 . 3]" 1
1449 1 116 ASP HB3 1 119 VAL H 4.500 . 5.500 5.369 5.105 5.544 0.044 13 0 "[ . 1 . 2 . 3]" 1
1450 1 117 GLU H 1 117 GLU HA 2.300 . 3.000 2.873 2.854 2.898 . 0 0 "[ . 1 . 2 . 3]" 1
1451 1 117 GLU H 1 117 GLU QB 2.100 . 2.700 2.157 2.040 2.315 . 0 0 "[ . 1 . 2 . 3]" 1
1452 1 117 GLU H 1 117 GLU HG3 2.700 . 3.600 3.618 2.995 4.351 0.751 22 10 "[* ** 1 *- .** 2*+ * 3]" 1
1453 1 117 GLU H 1 118 ALA H 2.500 . 3.300 2.413 2.272 2.545 . 0 0 "[ . 1 . 2 . 3]" 1
1454 1 117 GLU H 1 119 VAL H 3.500 . 5.000 3.752 3.507 3.867 . 0 0 "[ . 1 . 2 . 3]" 1
1455 1 117 GLU HA 1 117 GLU HG2 2.400 . 3.100 2.761 2.051 3.864 0.764 13 7 "[ ** 1 -+ . * 2* * 3]" 1
1456 1 117 GLU HA 1 120 ALA H 2.900 . 4.000 3.319 3.200 3.392 . 0 0 "[ . 1 . 2 . 3]" 1
1457 1 117 GLU HA 1 120 ALA MB 2.200 . 2.800 2.852 2.827 2.890 0.090 12 0 "[ . 1 . 2 . 3]" 1
1458 1 117 GLU QB 1 118 ALA H 2.300 . 3.000 2.824 2.645 2.979 . 0 0 "[ . 1 . 2 . 3]" 1
1459 1 117 GLU QB 1 119 VAL H 3.500 . 5.000 4.485 4.285 4.676 . 0 0 "[ . 1 . 2 . 3]" 1
1460 1 117 GLU QB 1 120 ALA MB 2.800 . 5.500 4.208 4.066 4.309 . 0 0 "[ . 1 . 2 . 3]" 1
1461 1 117 GLU HG2 1 120 ALA MB 3.400 . 4.800 4.681 3.947 5.770 0.970 12 6 "[* .* 1 +- .* 2 * . 3]" 1
1462 1 117 GLU HG3 1 118 ALA H 3.600 . 5.200 4.737 3.380 5.348 0.148 6 0 "[ . 1 . 2 . 3]" 1
1463 1 118 ALA H 1 118 ALA HA 2.400 . 3.100 2.838 2.803 2.862 . 0 0 "[ . 1 . 2 . 3]" 1
1464 1 118 ALA H 1 118 ALA MB 2.200 . 2.800 2.200 2.053 2.276 . 0 0 "[ . 1 . 2 . 3]" 1
1465 1 118 ALA H 1 119 VAL H 2.500 . 3.300 2.485 2.353 2.606 . 0 0 "[ . 1 . 2 . 3]" 1
1466 1 118 ALA H 1 120 ALA H 3.200 . 4.500 4.316 4.205 4.444 . 0 0 "[ . 1 . 2 . 3]" 1
1467 1 118 ALA H 1 121 VAL H 4.300 . 5.500 4.749 4.684 4.838 . 0 0 "[ . 1 . 2 . 3]" 1
1468 1 118 ALA HA 1 118 ALA MB 1.900 . 2.400 2.108 2.079 2.130 . 0 0 "[ . 1 . 2 . 3]" 1
1469 1 118 ALA HA 1 119 VAL H 2.800 . 3.800 3.443 3.350 3.479 . 0 0 "[ . 1 . 2 . 3]" 1
1470 1 118 ALA HA 1 119 VAL QG 3.400 . 4.800 4.659 4.602 4.737 . 0 0 "[ . 1 . 2 . 3]" 1
1471 1 118 ALA HA 1 121 VAL H 2.500 . 3.300 3.151 3.085 3.244 . 0 0 "[ . 1 . 2 . 3]" 1
1472 1 118 ALA HA 1 121 VAL HB 2.200 . 2.800 2.127 1.985 2.278 . 0 0 "[ . 1 . 2 . 3]" 1
1473 1 118 ALA HA 1 121 VAL MG1 2.800 . 3.800 3.428 3.243 3.602 . 0 0 "[ . 1 . 2 . 3]" 1
1474 1 118 ALA HA 1 121 VAL MG2 2.300 . 3.000 2.790 2.422 3.006 0.006 16 0 "[ . 1 . 2 . 3]" 1
1475 1 118 ALA HA 1 122 LEU HB3 2.500 . 5.500 5.024 4.755 5.191 . 0 0 "[ . 1 . 2 . 3]" 1
1476 1 118 ALA MB 1 119 VAL H 2.500 . 3.300 2.906 2.773 3.050 . 0 0 "[ . 1 . 2 . 3]" 1
1477 1 118 ALA MB 1 119 VAL HA 3.000 . 4.100 3.892 3.836 3.970 . 0 0 "[ . 1 . 2 . 3]" 1
1478 1 118 ALA MB 1 119 VAL QG 2.900 . 4.000 3.302 3.197 3.436 . 0 0 "[ . 1 . 2 . 3]" 1
1479 1 118 ALA MB 1 121 VAL H 3.300 . 4.700 4.259 4.177 4.328 . 0 0 "[ . 1 . 2 . 3]" 1
1480 1 118 ALA MB 1 121 VAL HB 3.000 . 4.100 3.374 3.245 3.468 . 0 0 "[ . 1 . 2 . 3]" 1
1481 1 118 ALA MB 1 121 VAL MG1 2.700 . 3.600 3.669 3.643 3.709 0.109 12 0 "[ . 1 . 2 . 3]" 1
1482 1 118 ALA MB 1 122 LEU H 3.400 . 4.800 4.306 4.194 4.370 . 0 0 "[ . 1 . 2 . 3]" 1
1483 1 118 ALA MB 1 122 LEU HB3 2.600 . 5.500 4.166 3.995 4.302 . 0 0 "[ . 1 . 2 . 3]" 1
1484 1 118 ALA MB 1 122 LEU QD 2.500 . 5.500 4.329 4.175 4.485 . 0 0 "[ . 1 . 2 . 3]" 1
1485 1 119 VAL H 1 119 VAL HA 2.600 . 3.400 2.826 2.790 2.857 . 0 0 "[ . 1 . 2 . 3]" 1
1486 1 119 VAL H 1 119 VAL HB 2.200 . 2.800 2.639 2.306 2.701 . 0 0 "[ . 1 . 2 . 3]" 1
1487 1 119 VAL H 1 119 VAL QG 2.800 . 3.000 2.032 1.762 2.342 0.138 24 0 "[ . 1 . 2 . 3]" 1
1488 1 119 VAL H 1 120 ALA H 2.400 . 3.100 2.609 2.506 2.777 . 0 0 "[ . 1 . 2 . 3]" 1
1489 1 119 VAL H 1 121 VAL H 3.500 . 5.000 3.642 3.498 3.771 . 0 0 "[ . 1 . 2 . 3]" 1
1490 1 119 VAL H 1 122 LEU H 4.200 . 5.500 4.340 4.215 4.409 . 0 0 "[ . 1 . 2 . 3]" 1
1491 1 119 VAL HA 1 119 VAL HB 2.400 . 3.100 3.004 2.996 3.013 . 0 0 "[ . 1 . 2 . 3]" 1
1492 1 119 VAL HA 1 119 VAL QG 2.100 . 2.500 2.087 2.030 2.151 . 0 0 "[ . 1 . 2 . 3]" 1
1493 1 119 VAL HA 1 120 ALA H 3.000 . 4.100 3.528 3.514 3.544 . 0 0 "[ . 1 . 2 . 3]" 1
1494 1 119 VAL HA 1 120 ALA HA 3.500 . 5.000 4.818 4.792 4.849 . 0 0 "[ . 1 . 2 . 3]" 1
1495 1 119 VAL HA 1 121 VAL H 3.700 . 5.400 3.842 3.719 4.059 . 0 0 "[ . 1 . 2 . 3]" 1
1496 1 119 VAL HA 1 122 LEU H 3.000 . 4.100 2.968 2.803 3.082 . 0 0 "[ . 1 . 2 . 3]" 1
1497 1 119 VAL HA 1 122 LEU HA 4.400 . 5.500 4.947 4.672 5.062 . 0 0 "[ . 1 . 2 . 3]" 1
1498 1 119 VAL HA 1 122 LEU HB2 2.500 . 5.500 3.872 3.484 4.048 . 0 0 "[ . 1 . 2 . 3]" 1
1499 1 119 VAL HA 1 122 LEU HB3 2.300 . 3.000 2.231 1.877 2.408 . 0 0 "[ . 1 . 2 . 3]" 1
1500 1 119 VAL HA 1 122 LEU QD 3.100 . 4.300 1.875 1.485 2.076 0.415 22 0 "[ . 1 . 2 . 3]" 1
1501 1 119 VAL HA 1 123 GLN H 3.100 . 4.300 3.862 3.801 4.058 . 0 0 "[ . 1 . 2 . 3]" 1
1502 1 119 VAL HA 1 123 GLN HG3 3.900 . 5.500 5.055 4.371 5.777 0.277 24 0 "[ . 1 . 2 . 3]" 1
1503 1 119 VAL HB 1 119 VAL QG 1.900 . 2.400 1.879 1.863 1.893 . 0 0 "[ . 1 . 2 . 3]" 1
1504 1 119 VAL HB 1 120 ALA H 2.500 . 3.300 2.320 2.076 2.443 . 0 0 "[ . 1 . 2 . 3]" 1
1505 1 119 VAL HB 1 120 ALA MB 2.400 . 5.500 3.716 3.547 3.809 . 0 0 "[ . 1 . 2 . 3]" 1
1506 1 119 VAL HB 1 121 VAL H 4.100 . 5.500 4.496 4.365 4.647 . 0 0 "[ . 1 . 2 . 3]" 1
1507 1 119 VAL HB 1 122 LEU H 4.400 . 5.500 5.010 4.902 5.090 . 0 0 "[ . 1 . 2 . 3]" 1
1508 1 119 VAL HB 1 122 LEU HB3 2.400 . 5.500 5.129 4.763 5.289 . 0 0 "[ . 1 . 2 . 3]" 1
1509 1 119 VAL HB 1 123 GLN HG3 1.900 . 5.500 5.142 4.455 5.752 0.252 24 0 "[ . 1 . 2 . 3]" 1
1510 1 119 VAL MG1 1 119 VAL MG2 1.800 . 2.200 2.057 1.928 2.109 . 0 0 "[ . 1 . 2 . 3]" 1
1511 1 119 VAL QG 1 120 ALA H 2.800 . 3.800 3.098 2.825 3.158 . 0 0 "[ . 1 . 2 . 3]" 1
1512 1 119 VAL QG 1 120 ALA HA 2.700 . 3.600 3.558 3.052 3.614 0.014 6 0 "[ . 1 . 2 . 3]" 1
1513 1 119 VAL QG 1 120 ALA MB 3.100 . 4.300 3.915 3.587 3.972 . 0 0 "[ . 1 . 2 . 3]" 1
1514 1 119 VAL QG 1 121 VAL H 4.600 . 5.500 4.207 4.121 4.353 . 0 0 "[ . 1 . 2 . 3]" 1
1515 1 119 VAL QG 1 122 LEU H 4.000 . 5.500 3.952 3.838 4.051 . 0 0 "[ . 1 . 2 . 3]" 1
1516 1 119 VAL QG 1 122 LEU HB3 3.200 . 4.300 3.452 3.088 3.616 . 0 0 "[ . 1 . 2 . 3]" 1
1517 1 119 VAL QG 1 122 LEU QD 2.300 . 3.000 1.815 1.696 2.205 0.004 16 0 "[ . 1 . 2 . 3]" 1
1518 1 119 VAL QG 1 123 GLN H 3.300 . 4.700 3.702 3.525 3.899 . 0 0 "[ . 1 . 2 . 3]" 1
1519 1 119 VAL QG 1 123 GLN HB2 2.900 . 4.000 4.108 3.966 4.841 0.841 20 4 "[ * . 1 * - + . 3]" 1
1520 1 119 VAL QG 1 123 GLN HG2 2.800 . 3.800 2.906 2.639 3.358 . 0 0 "[ . 1 . 2 . 3]" 1
1521 1 119 VAL QG 1 123 GLN HG3 2.400 . 3.100 2.991 2.279 3.842 0.742 3 4 "[ + . 1 - * * . 3]" 1
1522 1 120 ALA H 1 120 ALA HA 2.300 . 3.000 2.795 2.763 2.821 . 0 0 "[ . 1 . 2 . 3]" 1
1523 1 120 ALA H 1 120 ALA MB 2.100 . 2.700 1.999 1.970 2.039 . 0 0 "[ . 1 . 2 . 3]" 1
1524 1 120 ALA H 1 121 VAL H 2.500 . 3.300 2.569 2.501 2.673 . 0 0 "[ . 1 . 2 . 3]" 1
1525 1 120 ALA H 1 121 VAL HB 3.100 . 5.500 4.571 4.482 4.687 . 0 0 "[ . 1 . 2 . 3]" 1
1526 1 120 ALA H 1 122 LEU H 3.400 . 4.800 3.982 3.874 4.074 . 0 0 "[ . 1 . 2 . 3]" 1
1527 1 120 ALA H 1 123 GLN H 4.100 . 5.500 4.764 4.641 4.832 . 0 0 "[ . 1 . 2 . 3]" 1
1528 1 120 ALA HA 1 120 ALA MB 1.800 . 2.200 2.093 2.080 2.101 . 0 0 "[ . 1 . 2 . 3]" 1
1529 1 120 ALA HA 1 121 VAL HA 3.400 . 4.800 4.705 4.683 4.744 . 0 0 "[ . 1 . 2 . 3]" 1
1530 1 120 ALA HA 1 122 LEU H 3.100 . 4.300 4.311 4.239 4.373 0.073 5 0 "[ . 1 . 2 . 3]" 1
1531 1 120 ALA HA 1 122 LEU QD 4.300 . 5.500 4.761 4.531 5.082 . 0 0 "[ . 1 . 2 . 3]" 1
1532 1 120 ALA HA 1 123 GLN HB3 2.700 . 5.500 4.509 4.210 4.786 . 0 0 "[ . 1 . 2 . 3]" 1
1533 1 120 ALA HA 1 123 GLN HG2 3.300 . 4.700 4.146 2.189 4.735 0.035 5 0 "[ . 1 . 2 . 3]" 1
1534 1 120 ALA HA 1 123 GLN HG3 3.300 . 4.700 3.547 2.332 4.363 . 0 0 "[ . 1 . 2 . 3]" 1
1535 1 120 ALA MB 1 121 VAL H 2.400 . 3.100 2.884 2.787 2.952 . 0 0 "[ . 1 . 2 . 3]" 1
1536 1 120 ALA MB 1 121 VAL HA 3.100 . 4.300 3.854 3.811 3.890 . 0 0 "[ . 1 . 2 . 3]" 1
1537 1 120 ALA MB 1 121 VAL MG1 3.500 . 5.000 5.037 5.013 5.058 0.058 15 0 "[ . 1 . 2 . 3]" 1
1538 1 120 ALA MB 1 121 VAL MG2 2.400 . 3.100 3.125 3.107 3.150 0.050 3 0 "[ . 1 . 2 . 3]" 1
1539 1 120 ALA MB 1 123 GLN HB2 2.800 . 5.500 4.569 4.152 5.702 0.202 3 0 "[ . 1 . 2 . 3]" 1
1540 1 121 VAL H 1 121 VAL HA 2.500 . 3.300 2.890 2.872 2.901 . 0 0 "[ . 1 . 2 . 3]" 1
1541 1 121 VAL H 1 121 VAL HB 2.300 . 3.000 2.265 2.240 2.333 . 0 0 "[ . 1 . 2 . 3]" 1
1542 1 121 VAL H 1 121 VAL MG1 2.700 . 3.600 3.657 3.628 3.693 0.093 14 0 "[ . 1 . 2 . 3]" 1
1543 1 121 VAL H 1 121 VAL MG2 2.300 . 3.000 2.679 2.566 2.781 . 0 0 "[ . 1 . 2 . 3]" 1
1544 1 121 VAL H 1 122 LEU H 2.500 . 3.300 2.297 2.230 2.370 . 0 0 "[ . 1 . 2 . 3]" 1
1545 1 121 VAL H 1 123 GLN H 3.500 . 5.000 3.874 3.655 4.007 . 0 0 "[ . 1 . 2 . 3]" 1
1546 1 121 VAL HA 1 121 VAL HB 2.300 . 3.000 3.003 2.995 3.014 0.014 14 0 "[ . 1 . 2 . 3]" 1
1547 1 121 VAL HA 1 121 VAL MG1 2.100 . 2.700 2.569 2.529 2.620 . 0 0 "[ . 1 . 2 . 3]" 1
1548 1 121 VAL HA 1 121 VAL MG2 2.000 . 2.500 2.287 2.257 2.346 . 0 0 "[ . 1 . 2 . 3]" 1
1549 1 121 VAL HA 1 122 LEU H 3.100 . 4.300 3.492 3.481 3.504 . 0 0 "[ . 1 . 2 . 3]" 1
1550 1 121 VAL HA 1 122 LEU HB3 3.700 . 5.500 5.520 5.503 5.533 0.033 2 0 "[ . 1 . 2 . 3]" 1
1551 1 121 VAL HA 1 123 GLN H 3.700 . 5.400 4.366 4.062 4.549 . 0 0 "[ . 1 . 2 . 3]" 1
1552 1 121 VAL HA 1 124 ALA H 3.000 . 4.100 3.337 2.985 3.517 . 0 0 "[ . 1 . 2 . 3]" 1
1553 1 121 VAL HA 1 124 ALA MB 2.100 . 2.700 2.426 2.130 2.713 0.013 22 0 "[ . 1 . 2 . 3]" 1
1554 1 121 VAL HB 1 121 VAL MG1 2.000 . 2.500 2.077 2.074 2.105 . 0 0 "[ . 1 . 2 . 3]" 1
1555 1 121 VAL HB 1 121 VAL MG2 2.000 . 2.500 2.112 2.096 2.125 . 0 0 "[ . 1 . 2 . 3]" 1
1556 1 121 VAL HB 1 122 LEU H 2.500 . 3.300 2.903 2.819 2.965 . 0 0 "[ . 1 . 2 . 3]" 1
1557 1 121 VAL HB 1 123 GLN H 3.500 . 5.500 5.148 4.938 5.238 . 0 0 "[ . 1 . 2 . 3]" 1
1558 1 121 VAL HB 1 124 ALA MB 3.600 . 5.200 4.982 4.783 5.184 . 0 0 "[ . 1 . 2 . 3]" 1
1559 1 121 VAL MG1 1 121 VAL MG2 1.900 . 2.400 2.005 1.916 2.055 . 0 0 "[ . 1 . 2 . 3]" 1
1560 1 121 VAL MG1 1 122 LEU H 2.600 . 3.400 3.388 3.299 3.425 0.025 26 0 "[ . 1 . 2 . 3]" 1
1561 1 121 VAL MG1 1 124 ALA H 3.600 . 5.200 4.411 4.099 4.589 . 0 0 "[ . 1 . 2 . 3]" 1
1562 1 121 VAL MG1 1 124 ALA MB 2.700 . 3.600 3.600 3.504 3.657 0.057 12 0 "[ . 1 . 2 . 3]" 1
1563 1 121 VAL MG1 1 125 HIS H 3.900 . 5.500 4.010 3.366 4.457 . 0 0 "[ . 1 . 2 . 3]" 1
1564 1 121 VAL MG1 1 125 HIS HA 3.800 . 5.500 5.079 4.773 5.379 . 0 0 "[ . 1 . 2 . 3]" 1
1565 1 121 VAL MG1 1 125 HIS HB2 3.100 . 4.300 2.924 2.645 3.324 . 0 0 "[ . 1 . 2 . 3]" 1
1566 1 121 VAL MG1 1 125 HIS HB3 3.200 . 4.500 4.190 3.816 4.514 0.014 13 0 "[ . 1 . 2 . 3]" 1
1567 1 121 VAL MG2 1 122 LEU H 3.000 . 4.100 4.083 4.005 4.126 0.026 27 0 "[ . 1 . 2 . 3]" 1
1568 1 121 VAL MG2 1 123 GLN H 4.200 . 5.500 5.468 5.256 5.549 0.049 26 0 "[ . 1 . 2 . 3]" 1
1569 1 121 VAL MG2 1 124 ALA H 4.100 . 5.500 5.039 4.738 5.188 . 0 0 "[ . 1 . 2 . 3]" 1
1570 1 121 VAL MG2 1 124 ALA MB 3.000 . 4.100 3.819 3.480 4.048 . 0 0 "[ . 1 . 2 . 3]" 1
1571 1 122 LEU H 1 122 LEU HA 2.600 . 3.400 2.855 2.837 2.870 . 0 0 "[ . 1 . 2 . 3]" 1
1572 1 122 LEU H 1 122 LEU HB2 2.600 . 3.400 3.314 3.205 3.384 . 0 0 "[ . 1 . 2 . 3]" 1
1573 1 122 LEU H 1 122 LEU HB3 2.500 . 3.300 2.081 2.059 2.111 . 0 0 "[ . 1 . 2 . 3]" 1
1574 1 122 LEU H 1 122 LEU QD 2.900 . 4.000 3.276 3.139 3.465 . 0 0 "[ . 1 . 2 . 3]" 1
1575 1 122 LEU H 1 122 LEU HG 2.400 . 5.500 3.730 3.641 3.827 . 0 0 "[ . 1 . 2 . 3]" 1
1576 1 122 LEU H 1 123 GLN H 2.600 . 3.400 2.466 2.361 2.522 . 0 0 "[ . 1 . 2 . 3]" 1
1577 1 122 LEU H 1 124 ALA H 3.300 . 4.700 3.739 3.613 3.911 . 0 0 "[ . 1 . 2 . 3]" 1
1578 1 122 LEU H 1 125 HIS H 4.200 . 5.500 4.792 4.438 5.217 . 0 0 "[ . 1 . 2 . 3]" 1
1579 1 122 LEU HA 1 122 LEU HB2 2.100 . 2.700 2.224 2.216 2.231 . 0 0 "[ . 1 . 2 . 3]" 1
1580 1 122 LEU HA 1 122 LEU HB3 2.200 . 2.800 2.836 2.808 2.873 0.073 16 0 "[ . 1 . 2 . 3]" 1
1581 1 122 LEU HA 1 122 LEU QD 1.800 . 5.500 3.121 2.840 3.240 . 0 0 "[ . 1 . 2 . 3]" 1
1582 1 122 LEU HA 1 123 GLN H 3.000 . 4.100 3.509 3.465 3.535 . 0 0 "[ . 1 . 2 . 3]" 1
1583 1 122 LEU HA 1 124 ALA H 3.900 . 5.500 4.093 3.925 4.272 . 0 0 "[ . 1 . 2 . 3]" 1
1584 1 122 LEU HA 1 125 HIS H 3.700 . 5.400 3.551 3.203 4.109 . 0 0 "[ . 1 . 2 . 3]" 1
1585 1 122 LEU HA 1 125 HIS HB2 2.600 . 3.400 3.257 2.880 3.455 0.055 22 0 "[ . 1 . 2 . 3]" 1
1586 1 122 LEU HA 1 125 HIS HB3 2.700 . 3.600 3.392 2.597 3.623 0.023 4 0 "[ . 1 . 2 . 3]" 1
1587 1 122 LEU HA 1 126 GLN H 3.900 . 5.500 4.061 3.252 4.574 . 0 0 "[ . 1 . 2 . 3]" 1
1588 1 122 LEU HB2 1 122 LEU QD 2.100 . 2.700 1.988 1.864 2.094 . 0 0 "[ . 1 . 2 . 3]" 1
1589 1 122 LEU HB3 1 122 LEU QD 2.100 . 2.700 2.032 1.898 2.110 . 0 0 "[ . 1 . 2 . 3]" 1
1590 1 122 LEU HB3 1 123 GLN H 2.700 . 3.600 3.200 3.116 3.352 . 0 0 "[ . 1 . 2 . 3]" 1
1591 1 122 LEU HB3 1 124 ALA H 3.900 . 5.500 5.133 5.006 5.355 . 0 0 "[ . 1 . 2 . 3]" 1
1592 1 122 LEU QD 1 123 GLN H 3.200 . 4.500 3.011 2.705 3.445 . 0 0 "[ . 1 . 2 . 3]" 1
1593 1 122 LEU QD 1 123 GLN HA 2.900 . 4.000 3.532 3.434 3.698 . 0 0 "[ . 1 . 2 . 3]" 1
1594 1 122 LEU QD 1 123 GLN HG3 4.200 . 5.500 3.629 3.109 4.119 . 0 0 "[ . 1 . 2 . 3]" 1
1595 1 122 LEU QD 1 125 HIS HB3 3.700 . 5.400 4.908 4.415 5.183 . 0 0 "[ . 1 . 2 . 3]" 1
1596 1 122 LEU QD 1 126 GLN H 4.100 . 5.500 4.404 3.817 4.719 . 0 0 "[ . 1 . 2 . 3]" 1
1597 1 122 LEU HG 1 123 GLN H 3.300 . 4.700 2.578 2.369 2.876 . 0 0 "[ . 1 . 2 . 3]" 1
1598 1 122 LEU HG 1 124 ALA H 4.700 . 5.500 4.552 4.419 4.726 . 0 0 "[ . 1 . 2 . 3]" 1
1599 1 123 GLN H 1 123 GLN HA 2.400 . 3.100 2.843 2.810 2.901 . 0 0 "[ . 1 . 2 . 3]" 1
1600 1 123 GLN H 1 123 GLN HB2 2.400 . 3.100 2.499 2.254 3.551 0.451 3 0 "[ . 1 . 2 . 3]" 1
1601 1 123 GLN H 1 123 GLN HB3 2.600 . 5.500 3.466 2.833 3.616 . 0 0 "[ . 1 . 2 . 3]" 1
1602 1 123 GLN H 1 123 GLN HG2 2.800 . 3.800 2.676 2.410 3.192 . 0 0 "[ . 1 . 2 . 3]" 1
1603 1 123 GLN H 1 123 GLN HG3 2.600 . 3.400 3.226 1.791 3.821 0.421 24 0 "[ . 1 . 2 . 3]" 1
1604 1 123 GLN H 1 124 ALA H 2.400 . 3.100 2.458 2.233 2.597 . 0 0 "[ . 1 . 2 . 3]" 1
1605 1 123 GLN H 1 125 HIS H 3.700 . 5.400 4.141 3.745 4.976 . 0 0 "[ . 1 . 2 . 3]" 1
1606 1 123 GLN H 1 126 GLN H 4.100 . 5.500 4.783 4.517 5.073 . 0 0 "[ . 1 . 2 . 3]" 1
1607 1 123 GLN HA 1 124 ALA H 2.700 . 3.600 3.469 3.410 3.514 . 0 0 "[ . 1 . 2 . 3]" 1
1608 1 123 GLN HA 1 125 HIS H 4.100 . 5.500 4.318 3.505 5.578 0.078 25 0 "[ . 1 . 2 . 3]" 1
1609 1 123 GLN HB2 1 124 ALA H 2.900 . 4.000 2.994 2.710 3.732 . 0 0 "[ . 1 . 2 . 3]" 1
1610 1 123 GLN HB3 1 124 ALA H 2.900 . 4.000 3.782 3.497 4.126 0.126 3 0 "[ . 1 . 2 . 3]" 1
1611 1 123 GLN HG2 1 124 ALA H 3.800 . 5.500 4.497 3.871 4.805 . 0 0 "[ . 1 . 2 . 3]" 1
1612 1 123 GLN HG3 1 124 ALA H 3.600 . 5.200 4.602 2.165 5.278 0.078 19 0 "[ . 1 . 2 . 3]" 1
1613 1 124 ALA H 1 124 ALA HA 2.400 . 3.100 2.888 2.837 2.920 . 0 0 "[ . 1 . 2 . 3]" 1
1614 1 124 ALA H 1 124 ALA MB 2.100 . 2.700 2.221 2.039 2.298 . 0 0 "[ . 1 . 2 . 3]" 1
1615 1 124 ALA H 1 125 HIS H 2.700 . 3.600 2.582 2.332 3.093 . 0 0 "[ . 1 . 2 . 3]" 1
1616 1 124 ALA H 1 126 GLN H 4.200 . 5.500 3.923 3.668 4.186 . 0 0 "[ . 1 . 2 . 3]" 1
1617 1 124 ALA HA 1 124 ALA MB 1.800 . 2.200 2.120 2.084 2.129 . 0 0 "[ . 1 . 2 . 3]" 1
1618 1 124 ALA HA 1 125 HIS H 3.100 . 4.300 3.408 3.152 3.578 . 0 0 "[ . 1 . 2 . 3]" 1
1619 1 124 ALA HA 1 126 GLN H 3.700 . 5.400 4.237 3.865 5.194 . 0 0 "[ . 1 . 2 . 3]" 1
1620 1 124 ALA HA 1 128 LYS H 2.600 . 5.500 4.306 2.575 5.529 0.029 15 0 "[ . 1 . 2 . 3]" 1
1621 1 124 ALA HA 1 129 GLU H 3.700 . 5.400 5.195 3.424 5.612 0.212 2 0 "[ . 1 . 2 . 3]" 1
1622 1 124 ALA HA 1 130 ALA MB 1.800 . 5.500 5.025 2.611 5.673 0.173 23 0 "[ . 1 . 2 . 3]" 1
1623 1 124 ALA MB 1 125 HIS H 2.800 . 3.800 2.776 1.797 3.445 0.003 10 0 "[ . 1 . 2 . 3]" 1
1624 1 124 ALA MB 1 125 HIS HA 3.000 . 4.100 3.926 3.480 4.155 0.055 5 0 "[ . 1 . 2 . 3]" 1
1625 1 124 ALA MB 1 126 GLN H 3.300 . 4.700 4.481 4.041 4.866 0.166 4 0 "[ . 1 . 2 . 3]" 1
1626 1 125 HIS H 1 125 HIS HA 2.800 . 3.800 2.851 2.613 2.948 . 0 0 "[ . 1 . 2 . 3]" 1
1627 1 125 HIS H 1 125 HIS HB2 2.800 . 3.800 2.418 2.133 2.782 . 0 0 "[ . 1 . 2 . 3]" 1
1628 1 125 HIS H 1 125 HIS HB3 2.700 . 3.600 3.141 2.593 3.408 . 0 0 "[ . 1 . 2 . 3]" 1
1629 1 125 HIS HA 1 125 HIS HB2 2.200 . 5.500 2.750 2.505 2.896 . 0 0 "[ . 1 . 2 . 3]" 1
1630 1 125 HIS HA 1 125 HIS HB3 2.200 . 5.500 2.931 2.804 3.031 . 0 0 "[ . 1 . 2 . 3]" 1
1631 1 125 HIS HA 1 126 GLN H 3.000 . 4.100 3.411 3.177 3.561 . 0 0 "[ . 1 . 2 . 3]" 1
1632 1 125 HIS HA 1 128 LYS H 3.100 . 4.300 4.171 3.722 4.368 0.068 2 0 "[ . 1 . 2 . 3]" 1
1633 1 125 HIS HA 1 128 LYS QB 2.700 . 5.500 3.726 1.577 5.208 . 0 0 "[ . 1 . 2 . 3]" 1
1634 1 125 HIS HA 1 128 LYS HD2 4.200 . 5.500 4.599 2.466 6.019 0.519 11 1 "[ . 1+ . 2 . 3]" 1
1635 1 125 HIS HA 1 128 LYS QG 3.300 . 4.700 3.050 1.855 4.405 0.045 15 0 "[ . 1 . 2 . 3]" 1
1636 1 125 HIS HA 1 129 GLU H 3.700 . 5.400 5.407 5.113 5.505 0.105 6 0 "[ . 1 . 2 . 3]" 1
1637 1 125 HIS HB2 1 126 GLN H 2.900 . 4.000 3.706 3.236 4.033 0.033 21 0 "[ . 1 . 2 . 3]" 1
1638 1 125 HIS HB3 1 126 GLN H 3.000 . 4.100 3.212 2.563 3.995 . 0 0 "[ . 1 . 2 . 3]" 1
1639 1 126 GLN H 1 126 GLN HA 2.600 . 3.400 2.860 2.806 2.915 . 0 0 "[ . 1 . 2 . 3]" 1
1640 1 126 GLN H 1 126 GLN HB2 2.400 . 3.100 2.242 2.135 2.455 . 0 0 "[ . 1 . 2 . 3]" 1
1641 1 126 GLN H 1 126 GLN QG 3.100 . 4.300 2.871 2.402 3.250 . 0 0 "[ . 1 . 2 . 3]" 1
1642 1 126 GLN HB2 1 128 LYS H 3.800 . 5.500 4.524 3.849 5.289 . 0 0 "[ . 1 . 2 . 3]" 1
1643 1 128 LYS H 1 128 LYS HA 2.400 . 3.100 2.888 2.764 2.935 . 0 0 "[ . 1 . 2 . 3]" 1
1644 1 128 LYS H 1 128 LYS QB 2.200 . 5.500 2.564 2.174 3.021 . 0 0 "[ . 1 . 2 . 3]" 1
1645 1 128 LYS H 1 128 LYS QG 2.300 . 3.000 2.409 1.755 2.880 . 0 0 "[ . 1 . 2 . 3]" 1
1646 1 128 LYS H 1 129 GLU H 3.100 . 4.300 4.298 4.087 4.474 0.174 30 0 "[ . 1 . 2 . 3]" 1
1647 1 128 LYS HA 1 129 GLU H 2.400 . 3.100 2.685 2.045 3.058 . 0 0 "[ . 1 . 2 . 3]" 1
1648 1 128 LYS QB 1 129 GLU H 2.500 . 5.500 2.136 1.528 3.625 . 0 0 "[ . 1 . 2 . 3]" 1
1649 1 128 LYS QB 1 130 ALA HA 3.600 . 5.200 4.836 3.695 5.099 . 0 0 "[ . 1 . 2 . 3]" 1
1650 1 128 LYS QG 1 129 GLU H 3.500 . 5.000 3.236 2.150 4.315 . 0 0 "[ . 1 . 2 . 3]" 1
1651 1 128 LYS QG 1 130 ALA MB 3.000 . 4.100 2.779 1.488 3.991 0.412 23 0 "[ . 1 . 2 . 3]" 1
1652 1 129 GLU H 1 129 GLU HA 2.500 . 3.300 2.913 2.880 2.929 . 0 0 "[ . 1 . 2 . 3]" 1
1653 1 129 GLU H 1 129 GLU HB2 2.500 . 3.300 2.634 2.115 3.616 0.316 30 0 "[ . 1 . 2 . 3]" 1
1654 1 129 GLU H 1 129 GLU HB3 2.700 . 3.600 3.184 2.772 3.651 0.051 13 0 "[ . 1 . 2 . 3]" 1
1655 1 129 GLU H 1 129 GLU HG2 3.100 . 5.500 3.854 1.945 4.802 . 0 0 "[ . 1 . 2 . 3]" 1
1656 1 129 GLU H 1 129 GLU HG3 3.000 . 5.500 3.443 1.712 4.494 . 0 0 "[ . 1 . 2 . 3]" 1
1657 1 130 ALA H 1 130 ALA MB 2.000 . 2.500 2.134 1.994 2.309 . 0 0 "[ . 1 . 2 . 3]" 1
1658 1 130 ALA H 1 131 ALA H 2.400 . 3.100 2.789 2.419 3.135 0.035 21 0 "[ . 1 . 2 . 3]" 1
1659 1 130 ALA HA 1 130 ALA MB 2.000 . 2.500 2.104 2.077 2.130 . 0 0 "[ . 1 . 2 . 3]" 1
1660 1 131 ALA H 1 131 ALA HA 2.300 . 3.000 2.863 2.801 2.921 . 0 0 "[ . 1 . 2 . 3]" 1
1661 1 131 ALA H 1 131 ALA MB 2.100 . 2.700 2.161 2.033 2.331 . 0 0 "[ . 1 . 2 . 3]" 1
1662 1 131 ALA MB 1 132 GLN H 2.700 . 3.600 2.966 1.817 3.659 0.059 3 0 "[ . 1 . 2 . 3]" 1
1663 1 132 GLN H 1 132 GLN HA 2.400 . 3.100 2.885 2.834 2.929 . 0 0 "[ . 1 . 2 . 3]" 1
1664 1 132 GLN H 1 132 GLN HB2 2.600 . 3.400 2.532 2.064 3.640 0.240 18 0 "[ . 1 . 2 . 3]" 1
1665 1 132 GLN H 1 132 GLN HB3 2.900 . 4.000 3.451 2.780 3.690 . 0 0 "[ . 1 . 2 . 3]" 1
1666 1 132 GLN H 1 132 GLN HG2 3.000 . 4.100 3.358 1.728 4.645 0.545 12 1 "[ . 1 + . 2 . 3]" 1
1667 1 133 LYS HA 1 134 ALA H 2.800 . 3.800 2.893 2.138 3.571 . 0 0 "[ . 1 . 2 . 3]" 1
1668 1 133 LYS HB3 1 134 ALA H 3.100 . 4.300 3.535 1.852 4.598 0.298 6 0 "[ . 1 . 2 . 3]" 1
1669 1 134 ALA H 1 134 ALA HA 2.900 . 4.000 2.877 2.821 2.920 . 0 0 "[ . 1 . 2 . 3]" 1
1670 1 134 ALA H 1 134 ALA MB 2.500 . 3.300 2.180 2.047 2.300 . 0 0 "[ . 1 . 2 . 3]" 1
1671 1 134 ALA MB 1 135 VAL H 3.000 . 4.100 2.971 2.057 3.721 . 0 0 "[ . 1 . 2 . 3]" 1
1672 1 135 VAL H 1 135 VAL HB 2.800 . 3.800 3.258 2.529 3.681 . 0 0 "[ . 1 . 2 . 3]" 1
1673 1 135 VAL H 1 135 VAL MG2 2.700 . 3.600 2.229 1.625 3.840 0.240 15 0 "[ . 1 . 2 . 3]" 1
1674 1 135 VAL H 1 136 ASN H 3.600 . 5.200 3.823 2.119 4.622 . 0 0 "[ . 1 . 2 . 3]" 1
1675 1 135 VAL HA 1 136 ASN H 3.300 . 4.700 2.626 2.157 3.563 . 0 0 "[ . 1 . 2 . 3]" 1
1676 1 135 VAL MG1 1 136 ASN H 4.100 . 5.500 3.299 2.008 4.337 . 0 0 "[ . 1 . 2 . 3]" 1
1677 1 136 ASN H 1 136 ASN HB2 4.100 . 5.500 2.645 2.085 3.632 . 0 0 "[ . 1 . 2 . 3]" 1
1678 1 136 ASN H 1 136 ASN HB3 4.200 . 5.500 3.256 2.551 3.658 . 0 0 "[ . 1 . 2 . 3]" 1
1679 1 137 SER HA 1 138 ALA H 3.400 . 4.800 2.599 2.140 3.572 . 0 0 "[ . 1 . 2 . 3]" 1
1680 1 138 ALA H 1 138 ALA MB 3.600 . 5.200 2.153 2.031 2.287 . 0 0 "[ . 1 . 2 . 3]" 1
1681 1 142 PRO HA 1 143 THR H 3.000 . 4.100 2.529 2.146 3.575 . 0 0 "[ . 1 . 2 . 3]" 1
1682 1 143 THR HA 1 144 VAL H 3.400 . 4.800 2.870 2.142 3.574 . 0 0 "[ . 1 . 2 . 3]" 1
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