NMR Restraints Grid
| |
NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
455464 |
2kts   |
16711 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kts
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 2049
_Distance_constraint_stats_list.Viol_count 3464
_Distance_constraint_stats_list.Viol_total 6153.324
_Distance_constraint_stats_list.Viol_max 0.990
_Distance_constraint_stats_list.Viol_rms 0.0435
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0083
_Distance_constraint_stats_list.Viol_average_violations_only 0.0935
_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 1 MET 0.394 0.105 3 0 "[ . 1 . ]"
1 2 VAL 3.898 0.118 13 0 "[ . 1 . ]"
1 3 THR 7.241 0.166 8 0 "[ . 1 . ]"
1 4 PRO 3.491 0.118 17 0 "[ . 1 . ]"
1 5 GLU 7.572 0.773 11 3 "[ . *+ .- ]"
1 6 GLN 6.764 0.191 8 0 "[ . 1 . ]"
1 7 LEU 8.730 0.191 8 0 "[ . 1 . ]"
1 8 GLN 9.740 0.773 11 3 "[ . *+ .- ]"
1 9 HIS 5.007 0.252 10 0 "[ . 1 . ]"
1 10 HIS 1.067 0.087 19 0 "[ . 1 . ]"
1 11 ARG 3.461 0.524 4 1 "[ +. 1 . ]"
1 12 PHE 4.430 0.367 4 0 "[ . 1 . ]"
1 13 VAL 4.575 0.105 12 0 "[ . 1 . ]"
1 14 LEU 3.785 0.103 3 0 "[ . 1 . ]"
1 15 GLU 1.278 0.103 3 0 "[ . 1 . ]"
1 16 SER 1.625 0.091 15 0 "[ . 1 . ]"
1 17 VAL 2.660 0.107 18 0 "[ . 1 . ]"
1 18 ASN 4.236 0.948 10 1 "[ . + . ]"
1 19 GLY 2.283 0.948 10 1 "[ . + . ]"
1 20 LYS 9.897 0.378 15 0 "[ . 1 . ]"
1 21 PRO 9.025 0.378 15 0 "[ . 1 . ]"
1 22 VAL 2.319 0.134 18 0 "[ . 1 . ]"
1 23 THR 2.040 0.102 17 0 "[ . 1 . ]"
1 24 SER 4.436 0.970 9 3 "[ .* +1 - . ]"
1 25 ASP 2.184 0.370 9 0 "[ . 1 . ]"
1 26 LYS 12.808 0.970 9 5 "[ .** +1 - * ]"
1 27 ASN 11.800 0.840 7 3 "[ .-+ 1 * ]"
1 28 PRO 4.056 0.287 3 0 "[ . 1 . ]"
1 29 PRO 3.406 0.087 13 0 "[ . 1 . ]"
1 30 GLU 3.150 0.108 17 0 "[ . 1 . ]"
1 31 ILE 6.144 0.936 10 2 "[ . + * ]"
1 32 SER 3.338 0.524 4 1 "[ +. 1 . ]"
1 33 PHE 7.885 0.555 11 1 "[ . 1+ . ]"
1 34 GLY 3.698 0.108 13 0 "[ . 1 . ]"
1 35 GLU 3.368 0.117 7 0 "[ . 1 . ]"
1 36 LYS 4.664 0.939 12 2 "[ . 1-+ . ]"
1 37 MET 13.559 0.927 13 5 "[* . *1- + .* ]"
1 38 MET 4.464 0.927 11 1 "[ . 1+ . ]"
1 39 ILE 3.445 0.651 10 2 "[ . + - . ]"
1 40 SER 3.070 0.651 10 2 "[ . + - . ]"
1 41 GLY 2.997 0.936 10 2 "[ . + - ]"
1 42 SER 0.824 0.107 1 0 "[ . 1 . ]"
1 43 MET 4.250 0.871 3 1 "[ + . 1 . ]"
1 44 CYS 1.254 0.091 1 0 "[ . 1 . ]"
1 45 ASN 4.470 0.331 3 0 "[ . 1 . ]"
1 46 ARG 3.344 0.331 3 0 "[ . 1 . ]"
1 47 PHE 6.137 0.518 10 1 "[ . + . ]"
1 48 SER 1.240 0.086 8 0 "[ . 1 . ]"
1 49 GLY 2.987 0.415 14 0 "[ . 1 . ]"
1 50 GLU 3.832 0.338 17 0 "[ . 1 . ]"
1 51 GLY 9.379 0.927 13 4 "[* . *1 + .- ]"
1 52 LYS 7.340 0.746 16 1 "[ . 1 .+ ]"
1 53 LEU 6.426 0.407 8 0 "[ . 1 . ]"
1 54 SER 2.451 0.322 11 0 "[ . 1 . ]"
1 55 ASN 2.654 0.316 1 0 "[ . 1 . ]"
1 56 GLY 1.041 0.082 5 0 "[ . 1 . ]"
1 57 GLU 4.379 0.906 18 2 "[ . - 1 . + ]"
1 58 LEU 7.778 0.322 13 0 "[ . 1 . ]"
1 59 THR 4.621 0.105 12 0 "[ . 1 . ]"
1 60 ALA 1.597 0.307 13 0 "[ . 1 . ]"
1 61 LYS 2.719 0.307 13 0 "[ . 1 . ]"
1 62 GLY 1.464 0.158 19 0 "[ . 1 . ]"
1 63 LEU 6.890 0.138 15 0 "[ . 1 . ]"
1 64 ALA 1.588 0.415 14 0 "[ . 1 . ]"
1 65 MET 7.520 0.880 18 1 "[ . 1 . + ]"
1 66 THR 9.992 0.676 1 6 "[+* .* 1* * - ]"
1 67 ARG 8.334 0.676 1 6 "[+* .* 1* * - ]"
1 68 MET 5.474 0.820 5 2 "[ + - 1 . ]"
1 69 MET 14.823 0.836 14 13 "[ ******** *+* * -]"
1 70 CYS 7.812 0.836 14 5 "[ *. ** +. -]"
1 71 ALA 0.561 0.145 14 0 "[ . 1 . ]"
1 72 ASN 6.081 0.437 19 0 "[ . 1 . ]"
1 73 PRO 5.501 0.477 18 0 "[ . 1 . ]"
1 74 GLN 5.592 0.477 18 0 "[ . 1 . ]"
1 75 LEU 2.074 0.201 2 0 "[ . 1 . ]"
1 76 ASN 3.308 0.675 1 1 "[+ . 1 . ]"
1 77 GLU 3.105 0.538 13 1 "[ . 1 + . ]"
1 78 LEU 2.942 0.871 3 1 "[ + . 1 . ]"
1 79 ASP 3.879 0.675 1 1 "[+ . 1 . ]"
1 80 ASN 10.141 0.645 6 2 "[ .+ - . ]"
1 81 THR 5.655 0.645 6 2 "[ .+ - . ]"
1 82 ILE 4.482 0.321 12 0 "[ . 1 . ]"
1 83 SER 7.301 0.880 18 1 "[ . 1 . + ]"
1 84 GLU 5.228 0.783 8 1 "[ . + 1 . ]"
1 85 MET 15.166 0.975 7 4 "[ * - +* 1 . ]"
1 86 LEU 5.350 0.321 12 0 "[ . 1 . ]"
1 87 LYS 8.496 0.430 8 0 "[ . 1 . ]"
1 88 GLU 2.224 0.215 18 0 "[ . 1 . ]"
1 89 GLY 1.499 0.080 9 0 "[ . 1 . ]"
1 90 ALA 2.945 0.105 12 0 "[ . 1 . ]"
1 91 GLN 8.335 0.906 18 2 "[ . - 1 . + ]"
1 92 VAL 5.228 0.984 13 2 "[ * . 1 + . ]"
1 93 ASP 3.658 0.802 13 2 "[ - . 1 + . ]"
1 94 LEU 2.963 0.089 8 0 "[ . 1 . ]"
1 95 THR 4.120 0.123 2 0 "[ . 1 . ]"
1 96 ALA 1.382 0.123 2 0 "[ . 1 . ]"
1 97 ASN 3.931 0.341 8 0 "[ . 1 . ]"
1 98 GLN 6.547 0.606 11 3 "[ * . -1+ . ]"
1 99 LEU 8.389 0.990 6 1 "[ .+ 1 . ]"
1 100 THR 2.132 0.094 2 0 "[ . 1 . ]"
1 101 LEU 15.642 0.984 13 6 "[ ** - ** 1 + . ]"
1 102 ALA 4.324 0.608 13 1 "[ . 1 + . ]"
1 103 THR 6.629 0.133 11 0 "[ . 1 . ]"
1 104 ALA 1.660 0.117 1 0 "[ . 1 . ]"
1 105 LYS 7.848 0.681 17 4 "[* . * 1 - + ]"
1 106 GLN 8.481 0.565 10 1 "[ . + . ]"
1 107 THR 4.591 0.105 8 0 "[ . 1 . ]"
1 108 LEU 1.832 0.098 13 0 "[ . 1 . ]"
1 109 THR 4.466 0.606 11 2 "[ . -1+ . ]"
1 110 TYR 7.523 0.990 6 2 "[ .+- 1 . ]"
1 111 LYS 2.559 0.095 13 0 "[ . 1 . ]"
1 112 LEU 8.893 0.104 15 0 "[ . 1 . ]"
1 113 ALA 3.529 0.119 1 0 "[ . 1 . ]"
1 114 ASP 3.016 0.105 11 0 "[ . 1 . ]"
1 115 LEU 4.623 0.126 10 0 "[ . 1 . ]"
1 116 MET 4.689 0.972 6 2 "[ .+ 1 .- ]"
1 117 ASN 2.744 0.972 6 2 "[ .+ 1 .- ]"
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 41 GLY HA2 1 47 PHE QE . . 4.790 4.353 3.882 4.784 . 0 0 "[ . 1 . ]" 1
2 1 41 GLY HA3 1 47 PHE QE . . 5.220 3.035 2.326 3.477 . 0 0 "[ . 1 . ]" 1
3 1 41 GLY HA2 1 47 PHE HZ . . 5.300 4.725 4.204 5.364 0.064 12 0 "[ . 1 . ]" 1
4 1 32 SER H 1 41 GLY HA2 . . 4.560 3.797 3.219 4.527 . 0 0 "[ . 1 . ]" 1
5 1 31 ILE HA 1 41 GLY HA2 . . 3.610 2.768 2.224 3.675 0.065 15 0 "[ . 1 . ]" 1
6 1 41 GLY HA3 1 47 PHE HZ . . 5.270 3.020 2.496 3.610 . 0 0 "[ . 1 . ]" 1
7 1 40 SER HA 1 41 GLY HA3 . . 5.420 4.451 4.337 4.568 . 0 0 "[ . 1 . ]" 1
8 1 1 MET QG 1 56 GLY HA3 . . 5.060 4.444 3.517 4.947 . 0 0 "[ . 1 . ]" 1
9 1 61 LYS QG 1 62 GLY HA2 . . 5.480 4.721 3.364 5.571 0.091 5 0 "[ . 1 . ]" 1
10 1 1 MET QG 1 56 GLY HA2 . . 5.130 4.176 3.363 4.744 . 0 0 "[ . 1 . ]" 1
11 1 56 GLY HA2 1 57 GLU QB . . 5.200 4.794 4.635 4.896 . 0 0 "[ . 1 . ]" 1
12 1 57 GLU HA 1 58 LEU HB3 . . 5.340 4.561 4.309 4.789 . 0 0 "[ . 1 . ]" 1
13 1 57 GLU HA 1 58 LEU HB2 . . 5.060 4.457 4.015 4.722 . 0 0 "[ . 1 . ]" 1
14 1 56 GLY HA3 1 57 GLU QB . . 4.690 4.295 4.055 4.514 . 0 0 "[ . 1 . ]" 1
15 1 58 LEU HB3 1 90 ALA H . . 4.520 3.686 3.218 3.930 . 0 0 "[ . 1 . ]" 1
16 1 58 LEU H 1 58 LEU HB3 . . 3.680 2.553 2.381 2.849 . 0 0 "[ . 1 . ]" 1
17 1 99 LEU HB2 1 100 THR H . . 5.190 4.524 4.341 4.721 . 0 0 "[ . 1 . ]" 1
18 1 12 PHE HZ 1 99 LEU HB2 . . 5.220 4.672 4.014 5.272 0.052 4 0 "[ . 1 . ]" 1
19 1 99 LEU HB2 1 110 TYR HB3 . . 3.680 3.750 3.300 4.670 0.990 6 1 "[ .+ 1 . ]" 1
20 1 53 LEU QD 1 58 LEU HB2 . . 4.380 3.653 3.066 4.120 . 0 0 "[ . 1 . ]" 1
21 1 99 LEU H 1 99 LEU HB3 . . 4.030 2.799 2.151 3.156 . 0 0 "[ . 1 . ]" 1
22 1 99 LEU HB3 1 110 TYR HB3 . . 4.050 3.673 2.862 4.030 . 0 0 "[ . 1 . ]" 1
23 1 49 GLY HA2 1 63 LEU QD . . 4.560 4.330 3.758 4.667 0.107 7 0 "[ . 1 . ]" 1
24 1 49 GLY HA2 1 50 GLU H . . 3.140 2.438 2.326 2.501 . 0 0 "[ . 1 . ]" 1
25 1 49 GLY HA3 1 63 LEU QD . . 4.290 3.046 2.493 3.406 . 0 0 "[ . 1 . ]" 1
26 1 49 GLY HA3 1 50 GLU H . . 3.210 2.763 2.592 2.925 . 0 0 "[ . 1 . ]" 1
27 1 49 GLY HA3 1 64 ALA H . . 4.680 4.253 3.888 5.095 0.415 14 0 "[ . 1 . ]" 1
28 1 99 LEU HB2 1 110 TYR H . . 4.760 3.777 3.287 4.758 . 0 0 "[ . 1 . ]" 1
29 1 58 LEU HB2 1 90 ALA H . . 5.300 5.120 4.739 5.368 0.068 7 0 "[ . 1 . ]" 1
30 1 12 PHE QD 1 99 LEU HB3 . . 5.160 3.801 2.518 4.637 . 0 0 "[ . 1 . ]" 1
31 1 49 GLY HA2 1 60 ALA MB . . 5.140 4.258 3.132 5.235 0.095 15 0 "[ . 1 . ]" 1
32 1 49 GLY HA3 1 60 ALA MB . . 5.010 2.848 2.058 3.990 . 0 0 "[ . 1 . ]" 1
33 1 93 ASP HB2 1 94 LEU H . . 4.740 4.597 4.152 4.727 . 0 0 "[ . 1 . ]" 1
34 1 93 ASP HB2 1 100 THR HB . . 3.380 2.915 2.083 3.471 0.091 6 0 "[ . 1 . ]" 1
35 1 93 ASP HB2 1 100 THR H . . 4.390 4.195 3.482 4.480 0.090 1 0 "[ . 1 . ]" 1
36 1 93 ASP H 1 93 ASP HB2 . . 3.650 2.610 2.254 2.820 . 0 0 "[ . 1 . ]" 1
37 1 93 ASP HB2 1 100 THR MG . . 4.780 3.564 1.968 4.745 . 0 0 "[ . 1 . ]" 1
38 1 108 LEU HB3 1 109 THR H . . 4.490 2.841 2.501 3.422 . 0 0 "[ . 1 . ]" 1
39 1 92 VAL HA 1 93 ASP HB3 . . 5.500 5.353 4.859 5.570 0.070 12 0 "[ . 1 . ]" 1
40 1 101 LEU H 1 108 LEU HB2 . . 4.670 3.734 2.953 4.068 . 0 0 "[ . 1 . ]" 1
41 1 108 LEU HB2 1 110 TYR QE . . 4.220 2.701 2.266 3.914 . 0 0 "[ . 1 . ]" 1
42 1 101 LEU MD2 1 108 LEU HB2 . . 5.450 4.109 2.968 4.687 . 0 0 "[ . 1 . ]" 1
43 1 14 LEU QD 1 108 LEU HB2 . . 4.640 3.740 3.287 4.130 . 0 0 "[ . 1 . ]" 1
44 1 101 LEU H 1 108 LEU HB3 . . 5.500 4.655 3.820 5.255 . 0 0 "[ . 1 . ]" 1
45 1 108 LEU HB3 1 110 TYR QE . . 4.170 2.912 2.327 3.549 . 0 0 "[ . 1 . ]" 1
46 1 14 LEU QD 1 108 LEU HB3 . . 4.220 2.521 2.084 3.011 . 0 0 "[ . 1 . ]" 1
47 1 94 LEU HB2 1 95 THR H . . 4.800 4.233 4.014 4.390 . 0 0 "[ . 1 . ]" 1
48 1 94 LEU H 1 94 LEU HB2 . . 4.090 3.002 2.506 3.499 . 0 0 "[ . 1 . ]" 1
49 1 94 LEU HB2 1 99 LEU QD . . 4.630 2.157 1.970 2.894 . 0 0 "[ . 1 . ]" 1
50 1 7 LEU MD2 1 94 LEU HB2 . . 5.500 3.036 2.611 3.725 . 0 0 "[ . 1 . ]" 1
51 1 39 ILE HG13 1 51 GLY HA2 . . 5.000 3.437 2.893 3.868 . 0 0 "[ . 1 . ]" 1
52 1 59 THR MG 1 89 GLY HA3 . . 3.680 2.429 1.977 2.698 . 0 0 "[ . 1 . ]" 1
53 1 58 LEU H 1 89 GLY HA3 . . 5.000 4.956 4.738 5.080 0.080 9 0 "[ . 1 . ]" 1
54 1 89 GLY HA3 1 90 ALA H . . 3.370 3.356 3.048 3.441 0.071 2 0 "[ . 1 . ]" 1
55 1 59 THR HA 1 89 GLY HA3 . . 4.560 4.238 3.521 4.629 0.069 3 0 "[ . 1 . ]" 1
56 1 58 LEU H 1 89 GLY HA2 . . 5.080 4.190 3.844 4.497 . 0 0 "[ . 1 . ]" 1
57 1 94 LEU H 1 94 LEU HB3 . . 3.780 2.531 2.365 2.905 . 0 0 "[ . 1 . ]" 1
58 1 101 LEU H 1 101 LEU HB2 . . 3.810 2.309 2.176 2.632 . 0 0 "[ . 1 . ]" 1
59 1 101 LEU HB3 1 108 LEU H . . 5.050 3.439 2.613 4.024 . 0 0 "[ . 1 . ]" 1
60 1 101 LEU HB3 1 110 TYR QE . . 5.500 4.088 3.164 5.305 . 0 0 "[ . 1 . ]" 1
61 1 101 LEU H 1 101 LEU HB3 . . 4.150 3.462 3.282 3.740 . 0 0 "[ . 1 . ]" 1
62 1 51 GLY HA2 1 52 LYS H . . 3.280 2.648 2.383 3.475 0.195 8 0 "[ . 1 . ]" 1
63 1 37 MET QB 1 51 GLY HA3 . . 4.590 3.383 2.164 4.322 . 0 0 "[ . 1 . ]" 1
64 1 89 GLY HA2 1 90 ALA H . . 3.040 2.159 2.049 2.206 . 0 0 "[ . 1 . ]" 1
65 1 39 ILE HG13 1 51 GLY HA3 . . 4.030 2.535 2.242 2.888 . 0 0 "[ . 1 . ]" 1
66 1 57 GLU HG2 1 89 GLY HA2 . . 4.540 3.119 2.556 4.140 . 0 0 "[ . 1 . ]" 1
67 1 6 GLN QG 1 94 LEU HB3 . . 5.330 4.391 3.605 5.412 0.082 3 0 "[ . 1 . ]" 1
68 1 2 VAL HA 1 94 LEU HB3 . . 5.500 3.724 2.725 4.349 . 0 0 "[ . 1 . ]" 1
69 1 53 LEU H 1 53 LEU HB3 . . 3.480 2.839 2.600 3.140 . 0 0 "[ . 1 . ]" 1
70 1 4 PRO HD3 1 53 LEU HB3 . . 5.220 3.149 2.404 3.772 . 0 0 "[ . 1 . ]" 1
71 1 52 LYS HA 1 53 LEU HB3 . . 4.810 4.549 4.267 4.850 0.040 14 0 "[ . 1 . ]" 1
72 1 52 LYS HA 1 53 LEU HB2 . . 5.110 4.545 4.265 4.706 . 0 0 "[ . 1 . ]" 1
73 1 53 LEU H 1 53 LEU HB2 . . 3.640 3.338 2.942 3.536 . 0 0 "[ . 1 . ]" 1
74 1 4 PRO HD3 1 53 LEU HB2 . . 5.450 4.574 3.630 5.181 . 0 0 "[ . 1 . ]" 1
75 1 37 MET HG3 1 53 LEU HB2 . . 5.470 3.790 2.329 5.482 0.012 11 0 "[ . 1 . ]" 1
76 1 13 VAL H 1 110 TYR HB2 . . 4.970 4.768 3.898 5.050 0.080 11 0 "[ . 1 . ]" 1
77 1 110 TYR HB2 1 111 LYS H . . 4.200 3.666 3.293 4.091 . 0 0 "[ . 1 . ]" 1
78 1 99 LEU H 1 110 TYR HB2 . . 5.080 3.550 3.177 3.851 . 0 0 "[ . 1 . ]" 1
79 1 14 LEU HA 1 110 TYR HB2 . . 5.250 4.659 4.089 5.101 . 0 0 "[ . 1 . ]" 1
80 1 13 VAL H 1 110 TYR HB3 . . 4.810 3.227 2.742 3.547 . 0 0 "[ . 1 . ]" 1
81 1 14 LEU HA 1 110 TYR HB3 . . 5.490 3.725 3.275 4.501 . 0 0 "[ . 1 . ]" 1
82 1 99 LEU HB2 1 110 TYR HB2 . . 3.980 2.505 2.138 3.613 . 0 0 "[ . 1 . ]" 1
83 1 99 LEU HB3 1 110 TYR HB2 . . 4.580 2.078 1.963 2.429 . 0 0 "[ . 1 . ]" 1
84 1 99 LEU QD 1 110 TYR HB2 . . 4.920 2.417 2.109 2.573 . 0 0 "[ . 1 . ]" 1
85 1 11 ARG QD 1 12 PHE H . . 5.150 4.449 3.835 5.039 . 0 0 "[ . 1 . ]" 1
86 1 11 ARG QD 1 114 ASP HA . . 4.780 2.630 1.994 3.622 . 0 0 "[ . 1 . ]" 1
87 1 11 ARG QD 1 115 LEU HG . . 3.440 2.986 1.973 3.521 0.081 3 0 "[ . 1 . ]" 1
88 1 6 GLN H 1 7 LEU HB2 . . 5.160 4.790 4.404 5.055 . 0 0 "[ . 1 . ]" 1
89 1 11 ARG QD 1 115 LEU H . . 5.260 3.361 1.748 5.026 . 0 0 "[ . 1 . ]" 1
90 1 47 PHE QB 1 48 SER H . . 3.600 2.488 2.201 2.837 . 0 0 "[ . 1 . ]" 1
91 1 47 PHE QB 1 65 MET HA . . 4.640 3.706 3.198 3.960 . 0 0 "[ . 1 . ]" 1
92 1 47 PHE QB 1 65 MET ME . . 3.200 1.999 1.963 2.066 . 0 0 "[ . 1 . ]" 1
93 1 47 PHE QB 1 63 LEU HG . . 4.290 2.532 2.229 3.267 . 0 0 "[ . 1 . ]" 1
94 1 47 PHE QB 1 63 LEU QD . . 3.660 2.373 1.980 2.969 . 0 0 "[ . 1 . ]" 1
95 1 47 PHE QB 1 65 MET HG2 . . 4.830 2.231 1.986 3.689 . 0 0 "[ . 1 . ]" 1
96 1 13 VAL HA 1 14 LEU HB3 . . 5.140 4.790 4.533 5.168 0.028 14 0 "[ . 1 . ]" 1
97 1 14 LEU H 1 14 LEU HB3 . . 3.690 2.549 2.351 2.910 . 0 0 "[ . 1 . ]" 1
98 1 14 LEU HB3 1 110 TYR QE . . 5.120 4.234 3.856 4.558 . 0 0 "[ . 1 . ]" 1
99 1 6 GLN HA 1 7 LEU HB2 . . 5.500 5.538 5.411 5.576 0.076 10 0 "[ . 1 . ]" 1
100 1 7 LEU HB2 1 33 PHE QD . . 5.050 4.533 3.437 5.090 0.040 2 0 "[ . 1 . ]" 1
101 1 7 LEU HB2 1 8 GLN QG . . 5.450 3.887 2.882 5.000 . 0 0 "[ . 1 . ]" 1
102 1 14 LEU HB2 1 29 PRO HB2 . . 3.860 3.117 2.749 3.309 . 0 0 "[ . 1 . ]" 1
103 1 14 LEU HB2 1 14 LEU QD . . 2.870 2.129 2.086 2.208 . 0 0 "[ . 1 . ]" 1
104 1 14 LEU HB2 1 15 GLU H . . 4.920 4.516 4.328 4.676 . 0 0 "[ . 1 . ]" 1
105 1 14 LEU HB2 1 29 PRO HB3 . . 4.810 4.823 4.432 4.897 0.087 13 0 "[ . 1 . ]" 1
106 1 7 LEU HB3 1 8 GLN H . . 4.460 3.410 3.231 3.555 . 0 0 "[ . 1 . ]" 1
107 1 7 LEU H 1 7 LEU HB3 . . 4.080 3.791 3.718 3.872 . 0 0 "[ . 1 . ]" 1
108 1 4 PRO HA 1 7 LEU HB3 . . 5.270 4.481 4.147 4.852 . 0 0 "[ . 1 . ]" 1
109 1 7 LEU HB3 1 8 GLN HA . . 5.500 4.290 4.081 4.475 . 0 0 "[ . 1 . ]" 1
110 1 67 ARG H 1 67 ARG QD . . 5.500 3.902 2.448 5.076 . 0 0 "[ . 1 . ]" 1
111 1 63 LEU QB 1 64 ALA H . . 4.420 3.739 3.100 3.997 . 0 0 "[ . 1 . ]" 1
112 1 63 LEU H 1 63 LEU QB . . 3.380 2.430 2.008 2.900 . 0 0 "[ . 1 . ]" 1
113 1 49 GLY HA3 1 63 LEU QB . . 5.370 4.164 2.284 5.014 . 0 0 "[ . 1 . ]" 1
114 1 47 PHE QB 1 63 LEU QB . . 4.910 4.320 3.669 4.627 . 0 0 "[ . 1 . ]" 1
115 1 60 ALA MB 1 63 LEU QB . . 4.770 2.757 1.978 3.809 . 0 0 "[ . 1 . ]" 1
116 1 63 LEU QB 1 87 LYS QE . . 4.970 3.505 2.205 4.705 . 0 0 "[ . 1 . ]" 1
117 1 46 ARG QD 1 47 PHE H . . 4.670 3.206 2.260 4.672 0.002 9 0 "[ . 1 . ]" 1
118 1 46 ARG H 1 46 ARG QD . . 4.840 4.341 2.159 4.941 0.101 10 0 "[ . 1 . ]" 1
119 1 46 ARG HA 1 46 ARG QD . . 4.210 3.022 2.172 4.174 . 0 0 "[ . 1 . ]" 1
120 1 9 HIS H 1 34 GLY HA2 . . 4.950 5.000 4.763 5.032 0.082 7 0 "[ . 1 . ]" 1
121 1 34 GLY HA2 1 38 MET H . . 5.500 5.088 4.792 5.445 . 0 0 "[ . 1 . ]" 1
122 1 33 PHE HA 1 34 GLY HA2 . . 4.680 4.598 4.403 4.737 0.057 18 0 "[ . 1 . ]" 1
123 1 34 GLY HA2 1 35 GLU QB . . 4.650 4.423 3.911 4.722 0.072 8 0 "[ . 1 . ]" 1
124 1 34 GLY HA2 1 35 GLU H . . 3.480 2.511 2.062 2.883 . 0 0 "[ . 1 . ]" 1
125 1 34 GLY HA3 1 35 GLU QB . . 4.030 3.978 3.653 4.137 0.107 15 0 "[ . 1 . ]" 1
126 1 34 GLY HA3 1 35 GLU H . . 3.390 2.621 2.258 3.302 . 0 0 "[ . 1 . ]" 1
127 1 34 GLY HA3 1 38 MET H . . 5.340 4.996 4.229 5.424 0.084 4 0 "[ . 1 . ]" 1
128 1 33 PHE HA 1 34 GLY HA3 . . 5.190 4.441 4.302 4.606 . 0 0 "[ . 1 . ]" 1
129 1 31 ILE HB 1 47 PHE HZ . . 4.700 3.321 2.393 4.420 . 0 0 "[ . 1 . ]" 1
130 1 31 ILE HB 1 110 TYR QE . . 4.420 3.154 2.325 4.461 0.041 10 0 "[ . 1 . ]" 1
131 1 31 ILE HB 1 31 ILE MD . . 3.670 2.332 2.222 2.511 . 0 0 "[ . 1 . ]" 1
132 1 31 ILE HB 1 32 SER H . . 4.720 4.225 4.022 4.417 . 0 0 "[ . 1 . ]" 1
133 1 34 GLY HA3 1 35 GLU QG . . 5.420 4.913 3.643 5.528 0.108 13 0 "[ . 1 . ]" 1
134 1 112 LEU HB3 1 113 ALA H . . 5.080 4.375 4.011 4.556 . 0 0 "[ . 1 . ]" 1
135 1 112 LEU H 1 112 LEU HB3 . . 3.470 2.401 2.236 2.569 . 0 0 "[ . 1 . ]" 1
136 1 111 LYS HA 1 112 LEU HB3 . . 5.040 4.597 4.347 4.755 . 0 0 "[ . 1 . ]" 1
137 1 31 ILE HB 1 41 GLY HA3 . . 5.220 3.729 3.226 4.722 . 0 0 "[ . 1 . ]" 1
138 1 112 LEU HB2 1 113 ALA H . . 4.790 4.666 4.522 4.747 . 0 0 "[ . 1 . ]" 1
139 1 112 LEU H 1 112 LEU HB2 . . 3.490 2.476 2.149 2.636 . 0 0 "[ . 1 . ]" 1
140 1 97 ASN H 1 112 LEU HB2 . . 5.500 5.448 4.895 5.584 0.084 2 0 "[ . 1 . ]" 1
141 1 12 PHE HZ 1 112 LEU HB2 . . 4.630 3.569 2.912 4.230 . 0 0 "[ . 1 . ]" 1
142 1 12 PHE QE 1 112 LEU HB2 . . 4.860 2.743 2.378 3.589 . 0 0 "[ . 1 . ]" 1
143 1 97 ASN HA 1 112 LEU HB2 . . 4.340 2.898 2.363 3.288 . 0 0 "[ . 1 . ]" 1
144 1 36 LYS HB2 1 36 LYS HE2 . . 4.310 3.466 2.187 5.249 0.939 12 1 "[ . 1 + . ]" 1
145 1 36 LYS HE2 1 36 LYS QG . . 3.520 2.665 2.093 3.517 . 0 0 "[ . 1 . ]" 1
146 1 45 ASN H 1 45 ASN HB2 . . 3.990 2.273 1.992 2.711 . 0 0 "[ . 1 . ]" 1
147 1 45 ASN HB2 1 46 ARG H . . 3.960 4.020 3.838 4.291 0.331 3 0 "[ . 1 . ]" 1
148 1 45 ASN HB2 1 65 MET ME . . 5.190 2.883 2.032 3.758 . 0 0 "[ . 1 . ]" 1
149 1 45 ASN HB2 1 66 THR MG . . 5.500 5.464 4.817 5.801 0.301 12 0 "[ . 1 . ]" 1
150 1 45 ASN HB3 1 65 MET ME . . 5.260 3.680 2.792 4.726 . 0 0 "[ . 1 . ]" 1
151 1 45 ASN HB3 1 66 THR H . . 4.560 2.496 2.139 3.109 . 0 0 "[ . 1 . ]" 1
152 1 45 ASN HB3 1 46 ARG H . . 4.360 4.302 4.038 4.441 0.081 8 0 "[ . 1 . ]" 1
153 1 45 ASN HB3 1 67 ARG HA . . 5.290 4.170 3.415 4.646 . 0 0 "[ . 1 . ]" 1
154 1 115 LEU HB3 1 116 MET H . . 4.500 4.482 4.298 4.572 0.072 10 0 "[ . 1 . ]" 1
155 1 115 LEU H 1 115 LEU HB3 . . 4.040 3.743 2.898 4.100 0.060 11 0 "[ . 1 . ]" 1
156 1 115 LEU HB3 1 115 LEU MD1 . . 3.670 2.462 2.315 2.817 . 0 0 "[ . 1 . ]" 1
157 1 115 LEU H 1 115 LEU HB2 . . 3.770 3.399 2.585 3.792 0.022 1 0 "[ . 1 . ]" 1
158 1 61 LYS QE 1 61 LYS QG . . 3.280 2.180 2.048 2.430 . 0 0 "[ . 1 . ]" 1
159 1 87 LYS HA 1 87 LYS QE . . 5.330 4.169 3.367 4.583 . 0 0 "[ . 1 . ]" 1
160 1 13 VAL QG 1 111 LYS QE . . 4.550 4.471 4.148 4.593 0.043 19 0 "[ . 1 . ]" 1
161 1 63 LEU QD 1 87 LYS QE . . 5.480 3.780 2.244 4.917 . 0 0 "[ . 1 . ]" 1
162 1 12 PHE HB3 1 111 LYS H . . 4.590 3.671 3.156 4.249 . 0 0 "[ . 1 . ]" 1
163 1 12 PHE HB3 1 13 VAL H . . 3.990 2.822 2.357 3.736 . 0 0 "[ . 1 . ]" 1
164 1 12 PHE HB3 1 99 LEU QD . . 5.120 3.086 2.515 3.487 . 0 0 "[ . 1 . ]" 1
165 1 52 LYS QE 1 54 SER HB2 . . 5.080 4.294 2.168 5.402 0.322 11 0 "[ . 1 . ]" 1
166 1 12 PHE HB2 1 31 ILE H . . 4.830 3.900 3.478 4.463 . 0 0 "[ . 1 . ]" 1
167 1 12 PHE H 1 12 PHE HB2 . . 3.890 2.648 2.406 2.799 . 0 0 "[ . 1 . ]" 1
168 1 44 CYS QB 1 45 ASN HB2 . . 5.500 3.955 2.969 4.517 . 0 0 "[ . 1 . ]" 1
169 1 43 MET HG3 1 78 LEU HB2 . . 4.680 4.202 3.608 4.748 0.068 3 0 "[ . 1 . ]" 1
170 1 12 PHE HB2 1 99 LEU HB2 . . 5.230 4.905 4.244 5.487 0.257 11 0 "[ . 1 . ]" 1
171 1 78 LEU H 1 78 LEU HB3 . . 4.140 3.493 3.270 3.624 . 0 0 "[ . 1 . ]" 1
172 1 78 LEU HB3 1 79 ASP H . . 4.980 3.626 3.165 4.082 . 0 0 "[ . 1 . ]" 1
173 1 43 MET HB2 1 78 LEU HB3 . . 4.760 3.718 2.630 4.756 . 0 0 "[ . 1 . ]" 1
174 1 43 MET HB2 1 78 LEU HB2 . . 4.910 4.350 3.143 5.781 0.871 3 1 "[ + . 1 . ]" 1
175 1 43 MET HA 1 78 LEU HB3 . . 5.500 4.219 3.613 5.040 . 0 0 "[ . 1 . ]" 1
176 1 25 ASP QB 1 26 LYS QG . . 5.320 4.722 2.551 5.452 0.132 6 0 "[ . 1 . ]" 1
177 1 25 ASP QB 1 26 LYS H . . 4.220 2.831 1.708 3.917 . 0 0 "[ . 1 . ]" 1
178 1 7 LEU HB2 1 33 PHE HB2 . . 4.820 4.190 3.420 4.894 0.074 10 0 "[ . 1 . ]" 1
179 1 33 PHE HB2 1 34 GLY H . . 5.140 3.730 3.244 4.323 . 0 0 "[ . 1 . ]" 1
180 1 9 HIS H 1 33 PHE HB2 . . 4.930 4.384 4.045 4.786 . 0 0 "[ . 1 . ]" 1
181 1 33 PHE H 1 33 PHE HB2 . . 3.900 2.692 2.262 2.843 . 0 0 "[ . 1 . ]" 1
182 1 33 PHE HB2 1 37 MET HA . . 5.430 5.111 4.297 5.985 0.555 11 1 "[ . 1+ . ]" 1
183 1 7 LEU HB3 1 33 PHE HB2 . . 4.780 3.192 2.472 3.898 . 0 0 "[ . 1 . ]" 1
184 1 7 LEU MD1 1 33 PHE HB2 . . 5.500 4.901 4.003 5.577 0.077 10 0 "[ . 1 . ]" 1
185 1 7 LEU HB2 1 33 PHE HB3 . . 5.410 4.354 3.348 5.200 . 0 0 "[ . 1 . ]" 1
186 1 7 LEU HB3 1 33 PHE HB3 . . 4.900 3.658 2.353 4.562 . 0 0 "[ . 1 . ]" 1
187 1 33 PHE HB3 1 34 GLY H . . 4.650 2.729 2.099 3.517 . 0 0 "[ . 1 . ]" 1
188 1 33 PHE H 1 33 PHE HB3 . . 4.080 3.779 3.529 3.879 . 0 0 "[ . 1 . ]" 1
189 1 76 ASN HA 1 79 ASP HB3 . . 4.880 3.703 2.183 5.555 0.675 1 1 "[+ . 1 . ]" 1
190 1 65 MET ME 1 79 ASP HB3 . . 5.110 3.673 2.080 4.423 . 0 0 "[ . 1 . ]" 1
191 1 65 MET ME 1 79 ASP HB2 . . 4.630 3.160 2.248 4.412 . 0 0 "[ . 1 . ]" 1
192 1 79 ASP H 1 79 ASP HB2 . . 3.880 2.896 2.224 3.616 . 0 0 "[ . 1 . ]" 1
193 1 79 ASP HB2 1 80 ASN H . . 4.460 3.838 2.510 4.536 0.076 12 0 "[ . 1 . ]" 1
194 1 76 ASN HA 1 79 ASP HB2 . . 5.500 3.986 2.482 5.256 . 0 0 "[ . 1 . ]" 1
195 1 114 ASP QB 1 115 LEU H . . 4.490 3.884 3.543 4.043 . 0 0 "[ . 1 . ]" 1
196 1 113 ALA HA 1 114 ASP QB . . 5.400 4.359 3.986 4.813 . 0 0 "[ . 1 . ]" 1
197 1 113 ALA H 1 114 ASP QB . . 5.450 4.514 3.806 5.257 . 0 0 "[ . 1 . ]" 1
198 1 75 LEU H 1 75 LEU HB2 . . 3.720 2.541 2.358 2.826 . 0 0 "[ . 1 . ]" 1
199 1 75 LEU HB2 1 76 ASN H . . 4.240 2.722 2.455 3.033 . 0 0 "[ . 1 . ]" 1
200 1 44 CYS HA 1 75 LEU HB2 . . 4.650 4.493 3.859 4.727 0.077 16 0 "[ . 1 . ]" 1
201 1 75 LEU HB3 1 76 ASN H . . 4.630 3.786 3.401 4.062 . 0 0 "[ . 1 . ]" 1
202 1 75 LEU HB3 1 76 ASN QB . . 5.500 5.009 4.598 5.314 . 0 0 "[ . 1 . ]" 1
203 1 114 ASP QB 1 115 LEU HG . . 5.420 4.965 4.624 5.109 . 0 0 "[ . 1 . ]" 1
204 1 39 ILE H 1 39 ILE HB . . 3.350 2.750 2.264 3.432 0.082 8 0 "[ . 1 . ]" 1
205 1 39 ILE HB 1 49 GLY H . . 3.850 2.737 2.131 3.541 . 0 0 "[ . 1 . ]" 1
206 1 39 ILE HB 1 51 GLY H . . 5.060 4.283 3.545 4.946 . 0 0 "[ . 1 . ]" 1
207 1 39 ILE HB 1 40 SER H . . 4.880 4.116 3.912 4.448 . 0 0 "[ . 1 . ]" 1
208 1 39 ILE HB 1 40 SER HA . . 5.130 4.574 4.061 5.128 . 0 0 "[ . 1 . ]" 1
209 1 39 ILE HB 1 51 GLY HA3 . . 5.500 4.845 4.331 5.289 . 0 0 "[ . 1 . ]" 1
210 1 39 ILE HB 1 48 SER HA . . 4.990 3.645 2.613 4.444 . 0 0 "[ . 1 . ]" 1
211 1 44 CYS H 1 75 LEU HB3 . . 5.010 4.756 4.299 5.033 0.023 15 0 "[ . 1 . ]" 1
212 1 70 CYS H 1 70 CYS HB3 . . 3.940 3.623 2.870 3.943 0.003 2 0 "[ . 1 . ]" 1
213 1 70 CYS HB3 1 71 ALA H . . 4.880 3.654 2.211 4.577 . 0 0 "[ . 1 . ]" 1
214 1 70 CYS HB3 1 75 LEU HB2 . . 4.390 3.260 2.541 3.992 . 0 0 "[ . 1 . ]" 1
215 1 70 CYS HB2 1 75 LEU HB2 . . 4.360 2.848 2.163 4.419 0.059 3 0 "[ . 1 . ]" 1
216 1 70 CYS H 1 70 CYS HB2 . . 3.700 2.897 2.405 3.677 . 0 0 "[ . 1 . ]" 1
217 1 70 CYS HB2 1 72 ASN H . . 4.100 3.179 2.467 3.937 . 0 0 "[ . 1 . ]" 1
218 1 70 CYS HB2 1 76 ASN H . . 5.250 4.165 3.302 5.084 . 0 0 "[ . 1 . ]" 1
219 1 70 CYS HB2 1 75 LEU QD . . 5.070 3.097 2.136 4.858 . 0 0 "[ . 1 . ]" 1
220 1 70 CYS HB2 1 71 ALA H . . 5.180 3.730 2.507 4.084 . 0 0 "[ . 1 . ]" 1
221 1 86 LEU H 1 86 LEU HB2 . . 3.640 2.247 2.016 2.433 . 0 0 "[ . 1 . ]" 1
222 1 60 ALA H 1 86 LEU HB2 . . 4.380 4.362 4.183 4.461 0.081 15 0 "[ . 1 . ]" 1
223 1 86 LEU HB2 1 87 LYS H . . 4.270 3.106 2.968 3.259 . 0 0 "[ . 1 . ]" 1
224 1 59 THR HA 1 86 LEU HB2 . . 5.500 5.414 5.111 5.580 0.080 19 0 "[ . 1 . ]" 1
225 1 60 ALA MB 1 86 LEU HB2 . . 4.520 3.286 2.764 3.804 . 0 0 "[ . 1 . ]" 1
226 1 59 THR HA 1 86 LEU HB3 . . 4.810 4.057 3.724 4.276 . 0 0 "[ . 1 . ]" 1
227 1 60 ALA H 1 86 LEU HB3 . . 4.090 2.822 2.679 2.960 . 0 0 "[ . 1 . ]" 1
228 1 58 LEU MD2 1 86 LEU HB3 . . 5.500 5.418 5.053 5.606 0.106 5 0 "[ . 1 . ]" 1
229 1 72 ASN QB 1 72 ASN HD22 . . 3.590 3.274 3.204 3.376 . 0 0 "[ . 1 . ]" 1
230 1 72 ASN QB 1 75 LEU QD . . 3.430 2.516 1.924 3.469 0.039 18 0 "[ . 1 . ]" 1
231 1 72 ASN QB 1 75 LEU HB2 . . 4.390 3.490 2.376 4.494 0.104 1 0 "[ . 1 . ]" 1
232 1 27 ASN H 1 27 ASN HB3 . . 4.110 3.757 3.252 4.109 . 0 0 "[ . 1 . ]" 1
233 1 97 ASN HB2 1 112 LEU H . . 4.420 3.841 3.368 4.358 . 0 0 "[ . 1 . ]" 1
234 1 97 ASN H 1 97 ASN HB2 . . 4.150 3.871 3.186 4.158 0.008 4 0 "[ . 1 . ]" 1
235 1 97 ASN HB2 1 112 LEU HB3 . . 3.960 2.834 2.343 3.761 . 0 0 "[ . 1 . ]" 1
236 1 97 ASN HB2 1 112 LEU HB2 . . 4.410 3.731 3.121 4.469 0.059 15 0 "[ . 1 . ]" 1
237 1 97 ASN HB2 1 112 LEU MD2 . . 4.870 3.111 2.346 4.287 . 0 0 "[ . 1 . ]" 1
238 1 97 ASN HB3 1 112 LEU HB2 . . 4.310 4.197 3.370 4.377 0.067 11 0 "[ . 1 . ]" 1
239 1 97 ASN H 1 97 ASN HB3 . . 4.120 3.708 3.476 4.041 . 0 0 "[ . 1 . ]" 1
240 1 97 ASN HB3 1 112 LEU HB3 . . 3.940 3.484 2.327 3.981 0.041 9 0 "[ . 1 . ]" 1
241 1 96 ALA MB 1 97 ASN HB3 . . 5.110 4.178 3.595 5.145 0.035 8 0 "[ . 1 . ]" 1
242 1 76 ASN QB 1 77 GLU H . . 3.930 2.928 2.420 3.475 . 0 0 "[ . 1 . ]" 1
243 1 76 ASN QB 1 77 GLU QB . . 5.340 4.081 3.574 4.531 . 0 0 "[ . 1 . ]" 1
244 1 76 ASN QB 1 76 ASN HD22 . . 3.730 3.302 3.246 3.412 . 0 0 "[ . 1 . ]" 1
245 1 44 CYS QB 1 76 ASN H . . 5.000 3.784 3.329 4.243 . 0 0 "[ . 1 . ]" 1
246 1 44 CYS QB 1 75 LEU HB2 . . 4.030 2.958 2.345 3.414 . 0 0 "[ . 1 . ]" 1
247 1 97 ASN HB3 1 97 ASN HD22 . . 3.780 3.557 3.484 4.121 0.341 8 0 "[ . 1 . ]" 1
248 1 80 ASN HB3 1 81 THR H . . 3.750 3.641 2.521 4.238 0.488 10 0 "[ . 1 . ]" 1
249 1 80 ASN HB3 1 81 THR HA . . 5.420 4.807 4.257 6.065 0.645 6 2 "[ .+ - . ]" 1
250 1 80 ASN H 1 80 ASN HB2 . . 3.750 2.809 2.190 3.792 0.042 18 0 "[ . 1 . ]" 1
251 1 80 ASN HB2 1 81 THR H . . 4.190 3.229 2.258 4.186 . 0 0 "[ . 1 . ]" 1
252 1 44 CYS QB 1 76 ASN QB . . 5.160 4.137 3.590 4.562 . 0 0 "[ . 1 . ]" 1
253 1 44 CYS QB 1 45 ASN H . . 3.680 2.333 1.870 3.436 . 0 0 "[ . 1 . ]" 1
254 1 44 CYS QB 1 45 ASN QD . . 4.540 3.237 2.514 3.683 . 0 0 "[ . 1 . ]" 1
255 1 44 CYS H 1 44 CYS QB . . 3.760 2.768 2.527 3.198 . 0 0 "[ . 1 . ]" 1
256 1 44 CYS QB 1 76 ASN HA . . 4.180 2.681 2.103 3.721 . 0 0 "[ . 1 . ]" 1
257 1 44 CYS QB 1 75 LEU HB3 . . 3.660 2.125 1.929 2.558 . 0 0 "[ . 1 . ]" 1
258 1 44 CYS QB 1 75 LEU QD . . 4.360 3.401 2.933 3.784 . 0 0 "[ . 1 . ]" 1
259 1 55 ASN HB3 1 56 GLY H . . 4.780 4.304 3.507 4.722 . 0 0 "[ . 1 . ]" 1
260 1 55 ASN HB3 1 55 ASN HD22 . . 4.020 3.738 3.492 4.018 . 0 0 "[ . 1 . ]" 1
261 1 55 ASN HB3 1 57 GLU H . . 5.240 4.466 3.061 5.297 0.057 14 0 "[ . 1 . ]" 1
262 1 55 ASN HB2 1 56 GLY H . . 4.930 4.213 2.654 4.663 . 0 0 "[ . 1 . ]" 1
263 1 55 ASN HB2 1 57 GLU H . . 5.220 4.436 2.625 5.075 . 0 0 "[ . 1 . ]" 1
264 1 55 ASN HB2 1 55 ASN HD22 . . 3.780 3.760 3.444 4.096 0.316 1 0 "[ . 1 . ]" 1
265 1 55 ASN HB2 1 57 GLU QB . . 4.940 4.144 2.391 5.009 0.069 8 0 "[ . 1 . ]" 1
266 1 82 ILE H 1 82 ILE HB . . 3.410 2.437 2.241 2.550 . 0 0 "[ . 1 . ]" 1
267 1 43 MET HG3 1 82 ILE HB . . 4.750 2.620 2.114 3.316 . 0 0 "[ . 1 . ]" 1
268 1 43 MET ME 1 82 ILE HB . . 3.690 2.218 2.051 2.508 . 0 0 "[ . 1 . ]" 1
269 1 82 ILE HB 1 108 LEU QD . . 4.470 3.926 3.220 4.402 . 0 0 "[ . 1 . ]" 1
270 1 82 ILE HB 1 83 SER H . . 4.560 4.003 3.892 4.089 . 0 0 "[ . 1 . ]" 1
271 1 43 MET HG2 1 82 ILE HB . . 5.010 3.541 2.952 4.379 . 0 0 "[ . 1 . ]" 1
272 1 81 THR MG 1 82 ILE HB . . 4.870 4.247 3.324 4.739 . 0 0 "[ . 1 . ]" 1
273 1 63 LEU QD 1 65 MET QB . . 5.140 3.982 3.391 4.669 . 0 0 "[ . 1 . ]" 1
274 1 65 MET QB 1 66 THR H . . 4.390 2.250 2.032 2.571 . 0 0 "[ . 1 . ]" 1
275 1 47 PHE HA 1 65 MET QB . . 4.810 3.960 1.977 4.444 . 0 0 "[ . 1 . ]" 1
276 1 17 VAL MG1 1 18 ASN HB2 . . 4.830 4.124 3.208 4.759 . 0 0 "[ . 1 . ]" 1
277 1 18 ASN HB2 1 107 THR H . . 5.120 2.544 1.774 3.439 . 0 0 "[ . 1 . ]" 1
278 1 18 ASN HB3 1 107 THR H . . 5.260 3.132 2.284 4.291 . 0 0 "[ . 1 . ]" 1
279 1 18 ASN HB3 1 106 GLN HE21 . . 4.490 4.000 3.202 5.055 0.565 10 1 "[ . + . ]" 1
280 1 65 MET H 1 65 MET QB . . 3.820 2.608 2.229 3.108 . 0 0 "[ . 1 . ]" 1
281 1 64 ALA HA 1 65 MET QB . . 4.800 4.392 3.803 4.652 . 0 0 "[ . 1 . ]" 1
282 1 5 GLU H 1 5 GLU HG2 . . 4.470 4.286 3.861 4.568 0.098 19 0 "[ . 1 . ]" 1
283 1 5 GLU HG3 1 6 GLN H . . 5.500 4.954 4.694 5.323 . 0 0 "[ . 1 . ]" 1
284 1 57 GLU H 1 57 GLU HG3 . . 4.710 4.687 4.523 4.780 0.070 15 0 "[ . 1 . ]" 1
285 1 5 GLU HG2 1 6 GLN H . . 5.480 4.459 3.744 5.566 0.086 17 0 "[ . 1 . ]" 1
286 1 5 GLU H 1 5 GLU HG3 . . 4.510 4.108 2.952 4.408 . 0 0 "[ . 1 . ]" 1
287 1 15 GLU H 1 15 GLU QG . . 4.670 3.638 3.115 4.119 . 0 0 "[ . 1 . ]" 1
288 1 15 GLU QG 1 111 LYS QG . . 4.820 2.881 2.149 3.626 . 0 0 "[ . 1 . ]" 1
289 1 15 GLU QG 1 111 LYS H . . 4.910 4.054 2.710 4.725 . 0 0 "[ . 1 . ]" 1
290 1 15 GLU HA 1 15 GLU QG . . 3.790 2.447 2.194 2.872 . 0 0 "[ . 1 . ]" 1
291 1 57 GLU HA 1 57 GLU HG3 . . 4.090 2.608 2.441 2.810 . 0 0 "[ . 1 . ]" 1
292 1 57 GLU HG3 1 89 GLY HA2 . . 4.900 3.886 3.227 4.962 0.062 9 0 "[ . 1 . ]" 1
293 1 57 GLU HG3 1 59 THR MG . . 4.970 3.979 3.541 4.621 . 0 0 "[ . 1 . ]" 1
294 1 57 GLU HG3 1 90 ALA H . . 4.640 3.984 3.018 4.670 0.030 1 0 "[ . 1 . ]" 1
295 1 57 GLU HG3 1 91 GLN HE22 . . 5.500 3.572 2.452 5.519 0.019 11 0 "[ . 1 . ]" 1
296 1 57 GLU HG3 1 91 GLN HA . . 5.280 3.628 3.050 4.113 . 0 0 "[ . 1 . ]" 1
297 1 57 GLU HG3 1 89 GLY HA3 . . 4.650 3.266 2.744 4.385 . 0 0 "[ . 1 . ]" 1
298 1 57 GLU HG2 1 91 GLN HA . . 5.030 4.895 4.390 5.347 0.317 16 0 "[ . 1 . ]" 1
299 1 57 GLU H 1 57 GLU HG2 . . 4.810 4.455 4.356 4.584 . 0 0 "[ . 1 . ]" 1
300 1 57 GLU HG2 1 58 LEU H . . 4.520 2.971 2.271 3.720 . 0 0 "[ . 1 . ]" 1
301 1 57 GLU HG2 1 90 ALA H . . 4.670 3.696 2.316 4.133 . 0 0 "[ . 1 . ]" 1
302 1 57 GLU HA 1 57 GLU HG2 . . 4.220 3.015 2.811 3.239 . 0 0 "[ . 1 . ]" 1
303 1 57 GLU HG2 1 89 GLY HA3 . . 4.540 2.965 2.299 3.915 . 0 0 "[ . 1 . ]" 1
304 1 57 GLU HG2 1 59 THR MG . . 4.540 2.669 2.258 3.521 . 0 0 "[ . 1 . ]" 1
305 1 15 GLU QG 1 109 THR MG . . 5.500 4.695 3.855 5.280 . 0 0 "[ . 1 . ]" 1
306 1 87 LYS H 1 88 GLU HG3 . . 5.500 5.119 4.159 5.715 0.215 18 0 "[ . 1 . ]" 1
307 1 50 GLU H 1 50 GLU HG2 . . 4.190 3.590 1.729 4.270 0.080 2 0 "[ . 1 . ]" 1
308 1 50 GLU HA 1 50 GLU HG2 . . 4.150 2.795 2.324 3.734 . 0 0 "[ . 1 . ]" 1
309 1 50 GLU H 1 50 GLU HG3 . . 4.310 3.043 2.538 4.387 0.077 12 0 "[ . 1 . ]" 1
310 1 50 GLU HG3 1 51 GLY H . . 5.060 4.770 3.426 5.113 0.053 6 0 "[ . 1 . ]" 1
311 1 88 GLU H 1 88 GLU HG3 . . 3.920 3.037 2.101 3.774 . 0 0 "[ . 1 . ]" 1
312 1 88 GLU HA 1 88 GLU HG3 . . 3.980 3.535 2.986 3.872 . 0 0 "[ . 1 . ]" 1
313 1 85 MET HA 1 88 GLU HG3 . . 5.500 4.470 3.365 5.568 0.068 16 0 "[ . 1 . ]" 1
314 1 88 GLU HG3 1 103 THR MG . . 5.260 3.600 2.028 4.942 . 0 0 "[ . 1 . ]" 1
315 1 50 GLU HG2 1 51 GLY H . . 4.810 4.550 3.776 5.148 0.338 17 0 "[ . 1 . ]" 1
316 1 35 GLU QG 1 36 LYS H . . 4.010 3.254 1.892 4.115 0.105 13 0 "[ . 1 . ]" 1
317 1 35 GLU H 1 35 GLU QG . . 3.590 3.235 2.477 3.707 0.117 7 0 "[ . 1 . ]" 1
318 1 35 GLU HA 1 35 GLU QG . . 3.620 2.352 1.993 3.373 . 0 0 "[ . 1 . ]" 1
319 1 35 GLU QG 1 36 LYS QG . . 4.140 3.695 2.306 4.252 0.112 13 0 "[ . 1 . ]" 1
320 1 84 GLU HG2 1 85 MET H . . 4.980 4.779 3.917 5.763 0.783 8 1 "[ . + 1 . ]" 1
321 1 84 GLU H 1 84 GLU HG2 . . 4.510 3.949 2.158 4.555 0.045 9 0 "[ . 1 . ]" 1
322 1 84 GLU HA 1 84 GLU HG2 . . 3.920 3.158 2.100 3.744 . 0 0 "[ . 1 . ]" 1
323 1 84 GLU H 1 84 GLU HG3 . . 4.790 3.950 2.256 4.589 . 0 0 "[ . 1 . ]" 1
324 1 84 GLU HA 1 84 GLU HG3 . . 3.970 2.854 2.272 3.821 . 0 0 "[ . 1 . ]" 1
325 1 88 GLU H 1 88 GLU HG2 . . 3.570 2.793 2.052 3.612 0.042 8 0 "[ . 1 . ]" 1
326 1 8 GLN QG 1 37 MET H . . 4.890 2.862 2.059 4.238 . 0 0 "[ . 1 . ]" 1
327 1 8 GLN QG 1 37 MET HA . . 5.260 3.045 2.119 4.946 . 0 0 "[ . 1 . ]" 1
328 1 8 GLN H 1 8 GLN QG . . 3.780 2.640 2.104 3.438 . 0 0 "[ . 1 . ]" 1
329 1 77 GLU H 1 77 GLU HG3 . . 4.130 4.051 2.534 4.668 0.538 13 1 "[ . 1 + . ]" 1
330 1 77 GLU HA 1 77 GLU HG3 . . 3.750 3.256 2.592 3.735 . 0 0 "[ . 1 . ]" 1
331 1 5 GLU HA 1 8 GLN QG . . 5.380 4.197 2.192 5.018 . 0 0 "[ . 1 . ]" 1
332 1 6 GLN HA 1 6 GLN QG . . 3.390 3.239 2.500 3.406 0.016 8 0 "[ . 1 . ]" 1
333 1 111 LYS H 1 111 LYS HB3 . . 3.310 2.784 2.523 3.108 . 0 0 "[ . 1 . ]" 1
334 1 13 VAL H 1 111 LYS HB3 . . 4.480 3.611 3.264 3.944 . 0 0 "[ . 1 . ]" 1
335 1 111 LYS HB3 1 112 LEU H . . 3.730 3.773 3.621 3.811 0.081 2 0 "[ . 1 . ]" 1
336 1 12 PHE HA 1 111 LYS HB3 . . 4.710 4.771 4.622 4.805 0.095 13 0 "[ . 1 . ]" 1
337 1 111 LYS HB3 1 111 LYS QE . . 4.340 3.296 2.048 3.819 . 0 0 "[ . 1 . ]" 1
338 1 15 GLU QG 1 111 LYS HB3 . . 4.000 3.357 2.710 3.956 . 0 0 "[ . 1 . ]" 1
339 1 13 VAL QG 1 111 LYS HB3 . . 4.360 2.612 2.044 4.228 . 0 0 "[ . 1 . ]" 1
340 1 6 GLN H 1 6 GLN QG . . 3.410 2.092 1.853 2.350 . 0 0 "[ . 1 . ]" 1
341 1 3 THR HA 1 6 GLN QG . . 4.310 4.208 4.013 4.396 0.086 3 0 "[ . 1 . ]" 1
342 1 2 VAL HA 1 6 GLN QG . . 5.500 3.758 3.200 4.646 . 0 0 "[ . 1 . ]" 1
343 1 103 THR HB 1 105 LYS QB . . 3.880 2.859 2.435 3.133 . 0 0 "[ . 1 . ]" 1
344 1 105 LYS H 1 105 LYS QB . . 3.550 2.202 1.907 2.430 . 0 0 "[ . 1 . ]" 1
345 1 105 LYS QB 1 106 GLN H . . 3.770 2.318 2.130 2.512 . 0 0 "[ . 1 . ]" 1
346 1 52 LYS HB2 1 52 LYS QE . . 4.530 3.439 2.253 4.068 . 0 0 "[ . 1 . ]" 1
347 1 98 GLN HG3 1 110 TYR H . . 5.500 4.541 3.660 5.594 0.094 9 0 "[ . 1 . ]" 1
348 1 98 GLN HG3 1 99 LEU H . . 4.490 3.520 3.050 4.100 . 0 0 "[ . 1 . ]" 1
349 1 98 GLN HG3 1 111 LYS HA . . 5.180 3.556 2.635 4.558 . 0 0 "[ . 1 . ]" 1
350 1 98 GLN HA 1 98 GLN HG3 . . 3.910 2.582 2.202 3.472 . 0 0 "[ . 1 . ]" 1
351 1 98 GLN HA 1 98 GLN HG2 . . 3.990 2.872 2.519 3.353 . 0 0 "[ . 1 . ]" 1
352 1 98 GLN HG2 1 99 LEU H . . 4.450 2.988 2.438 3.884 . 0 0 "[ . 1 . ]" 1
353 1 13 VAL H 1 13 VAL HB . . 3.500 3.185 2.783 3.452 . 0 0 "[ . 1 . ]" 1
354 1 13 VAL HB 1 14 LEU H . . 3.960 3.738 3.079 4.045 0.085 1 0 "[ . 1 . ]" 1
355 1 51 GLY HA2 1 52 LYS HB2 . . 4.760 4.579 4.201 5.506 0.746 16 1 "[ . 1 .+ ]" 1
356 1 52 LYS H 1 52 LYS HB2 . . 3.200 3.368 3.137 3.626 0.426 12 0 "[ . 1 . ]" 1
357 1 30 GLU H 1 30 GLU HG2 . . 4.170 2.351 1.914 3.008 . 0 0 "[ . 1 . ]" 1
358 1 30 GLU HB3 1 30 GLU HG2 . . 2.890 2.661 2.498 2.962 0.072 15 0 "[ . 1 . ]" 1
359 1 30 GLU HG2 1 42 SER H . . 4.960 4.338 3.086 5.022 0.062 1 0 "[ . 1 . ]" 1
360 1 30 GLU HB3 1 31 ILE H . . 4.290 3.940 3.773 4.171 . 0 0 "[ . 1 . ]" 1
361 1 29 PRO HA 1 30 GLU HB3 . . 5.170 4.880 4.354 5.155 . 0 0 "[ . 1 . ]" 1
362 1 13 VAL HA 1 30 GLU HG2 . . 5.500 5.166 4.953 5.506 0.006 3 0 "[ . 1 . ]" 1
363 1 30 GLU HG2 1 31 ILE H . . 4.700 4.143 3.447 4.661 . 0 0 "[ . 1 . ]" 1
364 1 13 VAL QG 1 30 GLU HG2 . . 5.330 4.407 4.116 4.794 . 0 0 "[ . 1 . ]" 1
365 1 30 GLU HB2 1 31 ILE H . . 4.190 2.581 2.334 2.977 . 0 0 "[ . 1 . ]" 1
366 1 13 VAL QG 1 30 GLU HB2 . . 4.690 2.747 2.070 3.377 . 0 0 "[ . 1 . ]" 1
367 1 30 GLU HA 1 30 GLU HG3 . . 3.980 3.790 3.638 4.046 0.066 15 0 "[ . 1 . ]" 1
368 1 13 VAL HA 1 30 GLU HG3 . . 4.840 4.900 4.722 4.930 0.090 12 0 "[ . 1 . ]" 1
369 1 30 GLU H 1 30 GLU HG3 . . 5.050 3.662 3.134 4.185 . 0 0 "[ . 1 . ]" 1
370 1 13 VAL QG 1 30 GLU HG3 . . 4.870 4.378 3.745 4.788 . 0 0 "[ . 1 . ]" 1
371 1 30 GLU HG3 1 31 ILE H . . 4.030 3.334 2.842 3.734 . 0 0 "[ . 1 . ]" 1
372 1 81 THR MG 1 85 MET QB . . 4.580 3.910 2.631 4.399 . 0 0 "[ . 1 . ]" 1
373 1 85 MET QB 1 86 LEU H . . 4.050 2.748 2.210 3.425 . 0 0 "[ . 1 . ]" 1
374 1 85 MET QB 1 86 LEU QD . . 5.410 2.502 2.076 4.613 . 0 0 "[ . 1 . ]" 1
375 1 85 MET H 1 85 MET QB . . 3.770 2.307 2.079 2.503 . 0 0 "[ . 1 . ]" 1
376 1 82 ILE MD 1 85 MET QB . . 5.450 2.887 2.375 3.767 . 0 0 "[ . 1 . ]" 1
377 1 82 ILE HA 1 85 MET QB . . 3.600 2.532 2.238 2.912 . 0 0 "[ . 1 . ]" 1
378 1 74 GLN HG3 1 78 LEU QD . . 4.530 3.414 2.511 4.395 . 0 0 "[ . 1 . ]" 1
379 1 74 GLN H 1 74 GLN HG3 . . 4.870 4.337 4.084 4.592 . 0 0 "[ . 1 . ]" 1
380 1 74 GLN HE21 1 74 GLN HG3 . . 3.590 2.721 2.310 3.486 . 0 0 "[ . 1 . ]" 1
381 1 74 GLN H 1 74 GLN HG2 . . 4.580 4.514 4.320 4.603 0.023 19 0 "[ . 1 . ]" 1
382 1 74 GLN HA 1 74 GLN HG2 . . 3.960 3.065 2.784 3.432 . 0 0 "[ . 1 . ]" 1
383 1 74 GLN HG2 1 78 LEU QD . . 4.150 2.576 1.924 3.169 . 0 0 "[ . 1 . ]" 1
384 1 85 MET QB 1 86 LEU HA . . 5.010 4.007 3.596 4.526 . 0 0 "[ . 1 . ]" 1
385 1 91 GLN H 1 91 GLN QG . . 3.400 2.985 2.369 3.482 0.082 18 0 "[ . 1 . ]" 1
386 1 91 GLN QG 1 102 ALA H . . 5.340 4.734 3.961 5.257 . 0 0 "[ . 1 . ]" 1
387 1 91 GLN HA 1 91 GLN QG . . 3.710 2.861 2.377 3.277 . 0 0 "[ . 1 . ]" 1
388 1 90 ALA MB 1 91 GLN QG . . 5.500 5.102 4.675 5.584 0.084 7 0 "[ . 1 . ]" 1
389 1 17 VAL HB 1 18 ASN H . . 4.890 3.426 2.624 3.738 . 0 0 "[ . 1 . ]" 1
390 1 17 VAL HB 1 74 GLN HE21 . . 5.100 3.808 2.738 5.165 0.065 10 0 "[ . 1 . ]" 1
391 1 91 GLN QG 1 103 THR HA . . 5.500 4.227 3.170 5.290 . 0 0 "[ . 1 . ]" 1
392 1 91 GLN QG 1 102 ALA MB . . 4.660 3.528 2.824 4.393 . 0 0 "[ . 1 . ]" 1
393 1 17 VAL HB 1 74 GLN HE22 . . 5.330 4.278 3.442 4.817 . 0 0 "[ . 1 . ]" 1
394 1 61 LYS H 1 61 LYS HB3 . . 3.290 2.710 2.213 3.384 0.094 18 0 "[ . 1 . ]" 1
395 1 61 LYS HB3 1 62 GLY H . . 4.600 3.830 2.296 4.540 . 0 0 "[ . 1 . ]" 1
396 1 14 LEU QD 1 17 VAL HB . . 5.140 4.294 3.948 4.946 . 0 0 "[ . 1 . ]" 1
397 1 61 LYS H 1 61 LYS HB2 . . 3.540 2.520 2.023 3.377 . 0 0 "[ . 1 . ]" 1
398 1 60 ALA HA 1 61 LYS HB2 . . 5.270 4.509 3.929 5.577 0.307 13 0 "[ . 1 . ]" 1
399 1 92 VAL HB 1 93 ASP H . . 4.520 4.435 4.254 4.593 0.073 6 0 "[ . 1 . ]" 1
400 1 92 VAL H 1 92 VAL HB . . 3.340 2.855 2.258 3.328 . 0 0 "[ . 1 . ]" 1
401 1 91 GLN HA 1 92 VAL HB . . 5.140 4.347 3.927 4.806 . 0 0 "[ . 1 . ]" 1
402 1 53 LEU QD 1 92 VAL HB . . 4.670 3.766 2.808 4.783 0.113 15 0 "[ . 1 . ]" 1
403 1 92 VAL HB 1 99 LEU QD . . 5.500 4.417 4.056 5.311 . 0 0 "[ . 1 . ]" 1
404 1 11 ARG QB 1 114 ASP HA . . 4.120 2.343 1.994 4.158 0.038 16 0 "[ . 1 . ]" 1
405 1 68 MET H 1 68 MET QB . . 3.710 2.664 2.368 3.203 . 0 0 "[ . 1 . ]" 1
406 1 68 MET QB 1 69 MET H . . 3.780 2.174 1.922 2.542 . 0 0 "[ . 1 . ]" 1
407 1 68 MET QB 1 69 MET HA . . 4.740 4.214 3.821 4.615 . 0 0 "[ . 1 . ]" 1
408 1 43 MET HG2 1 79 ASP HA . . 5.500 4.319 3.724 5.515 0.015 11 0 "[ . 1 . ]" 1
409 1 43 MET H 1 43 MET HG2 . . 5.150 2.639 2.092 3.276 . 0 0 "[ . 1 . ]" 1
410 1 37 MET HG2 1 53 LEU H . . 5.060 4.636 3.524 5.467 0.407 8 0 "[ . 1 . ]" 1
411 1 37 MET H 1 37 MET HG2 . . 4.530 3.619 3.181 4.457 . 0 0 "[ . 1 . ]" 1
412 1 37 MET HG2 1 52 LYS HA . . 5.500 4.454 3.729 4.998 . 0 0 "[ . 1 . ]" 1
413 1 4 PRO HA 1 37 MET HG2 . . 5.500 3.799 2.779 5.409 . 0 0 "[ . 1 . ]" 1
414 1 37 MET HG2 1 51 GLY HA3 . . 5.500 5.591 4.249 6.427 0.927 13 4 "[* . *1 + .- ]" 1
415 1 37 MET HG2 1 58 LEU MD1 . . 5.500 5.081 4.259 5.822 0.322 13 0 "[ . 1 . ]" 1
416 1 37 MET H 1 37 MET HG3 . . 4.690 4.526 3.864 4.771 0.081 5 0 "[ . 1 . ]" 1
417 1 43 MET HG3 1 47 PHE QE . . 4.510 3.961 3.550 4.563 0.053 17 0 "[ . 1 . ]" 1
418 1 43 MET H 1 43 MET HG3 . . 5.470 3.913 3.588 4.384 . 0 0 "[ . 1 . ]" 1
419 1 43 MET HG3 1 79 ASP HA . . 4.660 3.449 2.826 4.145 . 0 0 "[ . 1 . ]" 1
420 1 43 MET HG3 1 78 LEU QD . . 5.500 3.868 3.221 4.541 . 0 0 "[ . 1 . ]" 1
421 1 67 ARG HA 1 68 MET QB . . 5.290 4.800 4.550 5.061 . 0 0 "[ . 1 . ]" 1
422 1 69 MET HB2 1 70 CYS H . . 3.960 3.293 2.103 4.709 0.749 11 1 "[ . 1+ . ]" 1
423 1 69 MET H 1 69 MET HB2 . . 3.150 2.991 2.001 3.970 0.820 15 7 "[ .** -1 **+ * ]" 1
424 1 37 MET HG2 1 53 LEU QD . . 5.500 4.735 4.006 5.549 0.049 11 0 "[ . 1 . ]" 1
425 1 37 MET HG3 1 53 LEU QD . . 5.500 4.290 3.450 5.606 0.106 11 0 "[ . 1 . ]" 1
426 1 1 MET QB 1 3 THR MG . . 5.170 4.261 3.249 5.275 0.105 3 0 "[ . 1 . ]" 1
427 1 15 GLU H 1 15 GLU HB3 . . 3.700 2.978 2.415 3.359 . 0 0 "[ . 1 . ]" 1
428 1 15 GLU HB3 1 16 SER H . . 3.800 2.758 2.434 3.163 . 0 0 "[ . 1 . ]" 1
429 1 15 GLU HB3 1 111 LYS H . . 5.500 4.757 3.318 5.461 . 0 0 "[ . 1 . ]" 1
430 1 15 GLU HB3 1 110 TYR HA . . 4.650 4.124 3.058 4.735 0.085 9 0 "[ . 1 . ]" 1
431 1 15 GLU H 1 15 GLU HB2 . . 3.700 2.226 1.962 2.711 . 0 0 "[ . 1 . ]" 1
432 1 25 ASP QB 1 26 LYS HB3 . . 5.210 4.333 3.441 5.197 . 0 0 "[ . 1 . ]" 1
433 1 26 LYS H 1 26 LYS HB2 . . 3.810 3.172 2.769 3.877 0.067 8 0 "[ . 1 . ]" 1
434 1 26 LYS HB2 1 27 ASN H . . 4.220 4.162 3.517 4.532 0.312 14 0 "[ . 1 . ]" 1
435 1 25 ASP QB 1 26 LYS HB2 . . 4.940 4.071 2.784 5.310 0.370 9 0 "[ . 1 . ]" 1
436 1 22 VAL H 1 22 VAL HB . . 3.310 2.946 2.396 3.369 0.059 13 0 "[ . 1 . ]" 1
437 1 17 VAL MG2 1 22 VAL HB . . 4.440 3.434 2.263 4.530 0.090 17 0 "[ . 1 . ]" 1
438 1 26 LYS HB2 1 27 ASN HD21 . . 5.500 5.034 3.833 6.340 0.840 7 3 "[ .*+ 1 - ]" 1
439 1 21 PRO HA 1 22 VAL HB . . 4.890 4.520 4.138 4.953 0.063 15 0 "[ . 1 . ]" 1
440 1 87 LYS HB3 1 88 GLU H . . 3.660 2.855 2.367 3.424 . 0 0 "[ . 1 . ]" 1
441 1 87 LYS H 1 87 LYS HB3 . . 3.290 3.149 2.541 3.376 0.086 10 0 "[ . 1 . ]" 1
442 1 84 GLU HA 1 87 LYS HB3 . . 3.880 3.672 2.510 3.964 0.084 16 0 "[ . 1 . ]" 1
443 1 116 MET H 1 116 MET HB3 . . 3.990 3.036 2.357 3.905 . 0 0 "[ . 1 . ]" 1
444 1 84 GLU HA 1 87 LYS HB2 . . 3.670 2.747 2.170 3.397 . 0 0 "[ . 1 . ]" 1
445 1 26 LYS H 1 26 LYS HB3 . . 3.790 3.167 2.461 3.892 0.102 5 0 "[ . 1 . ]" 1
446 1 106 GLN HG2 1 107 THR H . . 4.450 3.908 2.283 4.512 0.062 17 0 "[ . 1 . ]" 1
447 1 14 LEU QD 1 29 PRO HB2 . . 3.570 2.559 2.241 2.746 . 0 0 "[ . 1 . ]" 1
448 1 87 LYS HB2 1 88 GLU H . . 3.550 3.217 2.686 3.617 0.067 9 0 "[ . 1 . ]" 1
449 1 2 VAL H 1 2 VAL HB . . 3.270 2.491 2.224 3.028 . 0 0 "[ . 1 . ]" 1
450 1 2 VAL HB 1 53 LEU QD . . 4.540 4.108 2.955 4.615 0.075 12 0 "[ . 1 . ]" 1
451 1 2 VAL HB 1 7 LEU MD1 . . 5.470 4.817 4.277 5.527 0.057 3 0 "[ . 1 . ]" 1
452 1 106 GLN HB2 1 107 THR H . . 5.060 2.804 1.825 3.762 . 0 0 "[ . 1 . ]" 1
453 1 106 GLN HB2 1 108 LEU QD . . 5.500 3.851 3.079 5.344 . 0 0 "[ . 1 . ]" 1
454 1 106 GLN HB3 1 106 GLN HE22 . . 4.790 4.069 3.568 4.677 . 0 0 "[ . 1 . ]" 1
455 1 57 GLU H 1 57 GLU QB . . 3.610 2.433 2.165 2.701 . 0 0 "[ . 1 . ]" 1
456 1 106 GLN H 1 106 GLN HG3 . . 4.350 3.627 3.146 4.412 0.062 5 0 "[ . 1 . ]" 1
457 1 10 HIS HB2 1 112 LEU MD2 . . 5.500 5.361 4.952 5.587 0.087 19 0 "[ . 1 . ]" 1
458 1 21 PRO HB2 1 22 VAL H . . 3.820 2.521 2.185 3.057 . 0 0 "[ . 1 . ]" 1
459 1 16 SER HA 1 21 PRO HB2 . . 5.010 4.439 3.779 5.053 0.043 19 0 "[ . 1 . ]" 1
460 1 21 PRO HB2 1 22 VAL QG . . 5.500 4.356 4.051 4.647 . 0 0 "[ . 1 . ]" 1
461 1 106 GLN HB2 1 106 GLN HE21 . . 4.170 2.882 1.889 3.662 . 0 0 "[ . 1 . ]" 1
462 1 106 GLN HB2 1 106 GLN HE22 . . 4.890 3.877 3.519 4.315 . 0 0 "[ . 1 . ]" 1
463 1 106 GLN HB3 1 106 GLN HE21 . . 4.140 2.986 2.134 4.248 0.108 12 0 "[ . 1 . ]" 1
464 1 81 THR MG 1 106 GLN HB3 . . 4.060 3.773 2.876 4.217 0.157 12 0 "[ . 1 . ]" 1
465 1 57 GLU QB 1 58 LEU H . . 4.590 3.740 3.497 3.968 . 0 0 "[ . 1 . ]" 1
466 1 54 SER H 1 57 GLU QB . . 5.500 4.747 4.313 5.279 . 0 0 "[ . 1 . ]" 1
467 1 21 PRO HB3 1 22 VAL H . . 3.670 3.450 3.154 3.804 0.134 18 0 "[ . 1 . ]" 1
468 1 38 MET HG2 1 39 ILE H . . 5.150 3.409 2.229 4.821 . 0 0 "[ . 1 . ]" 1
469 1 38 MET H 1 38 MET HG2 . . 4.070 3.740 2.268 4.259 0.189 11 0 "[ . 1 . ]" 1
470 1 38 MET H 1 38 MET HG3 . . 4.190 3.666 2.897 4.260 0.070 13 0 "[ . 1 . ]" 1
471 1 38 MET HA 1 38 MET HG3 . . 4.110 3.237 2.693 3.808 . 0 0 "[ . 1 . ]" 1
472 1 68 MET H 1 68 MET HG3 . . 3.910 2.976 2.326 3.478 . 0 0 "[ . 1 . ]" 1
473 1 68 MET HG3 1 69 MET H . . 5.040 4.291 2.754 4.943 . 0 0 "[ . 1 . ]" 1
474 1 68 MET H 1 68 MET HG2 . . 3.960 3.369 1.938 4.036 0.076 11 0 "[ . 1 . ]" 1
475 1 68 MET HA 1 68 MET HG2 . . 4.070 2.939 2.336 3.870 . 0 0 "[ . 1 . ]" 1
476 1 10 HIS HB3 1 11 ARG H . . 3.820 3.342 2.360 3.861 0.041 7 0 "[ . 1 . ]" 1
477 1 10 HIS HB3 1 12 PHE HZ . . 4.600 4.080 3.160 4.620 0.020 10 0 "[ . 1 . ]" 1
478 1 7 LEU HA 1 10 HIS HB3 . . 5.190 4.283 3.968 4.713 . 0 0 "[ . 1 . ]" 1
479 1 73 PRO HB2 1 74 GLN H . . 4.610 3.377 3.002 3.812 . 0 0 "[ . 1 . ]" 1
480 1 20 LYS HA 1 21 PRO HB2 . . 5.500 5.778 5.583 5.878 0.378 15 0 "[ . 1 . ]" 1
481 1 73 PRO HB3 1 74 GLN H . . 3.950 4.135 3.964 4.427 0.477 18 0 "[ . 1 . ]" 1
482 1 57 GLU QB 1 91 GLN HE21 . . 5.440 4.528 3.059 6.346 0.906 18 2 "[ . - 1 . + ]" 1
483 1 43 MET HB2 1 44 CYS H . . 3.540 2.404 2.096 2.748 . 0 0 "[ . 1 . ]" 1
484 1 116 MET H 1 116 MET HG3 . . 4.840 4.039 1.996 4.923 0.083 8 0 "[ . 1 . ]" 1
485 1 43 MET HB2 1 45 ASN H . . 4.680 3.873 3.410 4.302 . 0 0 "[ . 1 . ]" 1
486 1 43 MET HB2 1 79 ASP HA . . 4.480 2.847 2.168 3.879 . 0 0 "[ . 1 . ]" 1
487 1 68 MET HG2 1 69 MET H . . 4.200 4.209 3.845 5.020 0.820 5 2 "[ + - 1 . ]" 1
488 1 69 MET QG 1 70 CYS H . . 4.650 3.324 2.703 3.864 . 0 0 "[ . 1 . ]" 1
489 1 69 MET H 1 69 MET QG . . 4.300 3.458 2.290 4.052 . 0 0 "[ . 1 . ]" 1
490 1 69 MET QG 1 76 ASN HD21 . . 5.500 4.271 2.958 5.264 . 0 0 "[ . 1 . ]" 1
491 1 4 PRO HB3 1 53 LEU QD . . 5.010 3.368 2.591 3.857 . 0 0 "[ . 1 . ]" 1
492 1 85 MET H 1 85 MET QG . . 3.530 2.520 2.251 2.976 . 0 0 "[ . 1 . ]" 1
493 1 85 MET QG 1 86 LEU H . . 5.350 4.018 2.367 4.526 . 0 0 "[ . 1 . ]" 1
494 1 81 THR MG 1 85 MET QG . . 4.000 3.080 2.459 3.855 . 0 0 "[ . 1 . ]" 1
495 1 43 MET HB3 1 82 ILE MG . . 5.500 3.907 3.362 4.497 . 0 0 "[ . 1 . ]" 1
496 1 63 LEU QD 1 65 MET HG3 . . 5.500 2.743 2.121 4.365 . 0 0 "[ . 1 . ]" 1
497 1 47 PHE QD 1 65 MET HG3 . . 5.500 5.348 4.675 5.613 0.113 17 0 "[ . 1 . ]" 1
498 1 65 MET H 1 65 MET HG3 . . 5.030 3.201 2.472 4.760 . 0 0 "[ . 1 . ]" 1
499 1 47 PHE HA 1 65 MET HG3 . . 4.770 3.893 3.395 4.832 0.062 12 0 "[ . 1 . ]" 1
500 1 65 MET H 1 65 MET HG2 . . 5.500 3.808 2.441 4.181 . 0 0 "[ . 1 . ]" 1
501 1 65 MET HG2 1 66 THR H . . 4.260 4.122 3.199 4.328 0.068 17 0 "[ . 1 . ]" 1
502 1 47 PHE HA 1 65 MET HG2 . . 4.670 2.681 2.287 4.508 . 0 0 "[ . 1 . ]" 1
503 1 65 MET HA 1 65 MET HG2 . . 3.940 2.535 2.119 3.697 . 0 0 "[ . 1 . ]" 1
504 1 65 MET ME 1 65 MET HG2 . . 3.980 2.458 2.263 3.402 . 0 0 "[ . 1 . ]" 1
505 1 63 LEU HG 1 65 MET HG2 . . 5.500 3.873 2.943 4.962 . 0 0 "[ . 1 . ]" 1
506 1 64 ALA MB 1 65 MET HG2 . . 5.500 5.179 4.891 5.549 0.049 19 0 "[ . 1 . ]" 1
507 1 63 LEU QD 1 65 MET HG2 . . 5.500 3.186 2.504 3.850 . 0 0 "[ . 1 . ]" 1
508 1 47 PHE QD 1 65 MET HG2 . . 5.250 4.297 4.021 5.343 0.093 17 0 "[ . 1 . ]" 1
509 1 59 THR HB 1 60 ALA H . . 3.590 2.863 2.356 3.656 0.066 19 0 "[ . 1 . ]" 1
510 1 59 THR HB 1 87 LYS HA . . 4.970 4.783 4.177 5.039 0.069 12 0 "[ . 1 . ]" 1
511 1 28 PRO HB2 1 29 PRO HD3 . . 4.510 3.870 3.593 4.105 . 0 0 "[ . 1 . ]" 1
512 1 13 VAL QG 1 28 PRO HB2 . . 4.380 2.679 2.215 3.045 . 0 0 "[ . 1 . ]" 1
513 1 22 VAL QG 1 28 PRO HB2 . . 5.460 4.374 3.406 5.181 . 0 0 "[ . 1 . ]" 1
514 1 13 VAL QG 1 28 PRO HB3 . . 3.970 3.595 2.991 4.015 0.045 2 0 "[ . 1 . ]" 1
515 1 34 GLY H 1 38 MET QB . . 4.130 3.435 2.903 4.010 . 0 0 "[ . 1 . ]" 1
516 1 38 MET QB 1 39 ILE H . . 3.930 2.772 2.418 3.465 . 0 0 "[ . 1 . ]" 1
517 1 35 GLU H 1 38 MET QB . . 5.170 4.771 4.031 5.091 . 0 0 "[ . 1 . ]" 1
518 1 38 MET H 1 38 MET QB . . 3.100 2.118 1.952 2.499 . 0 0 "[ . 1 . ]" 1
519 1 46 ARG QB 1 47 PHE H . . 4.290 2.528 2.112 3.006 . 0 0 "[ . 1 . ]" 1
520 1 46 ARG QB 1 66 THR MG . . 3.510 2.407 2.086 3.457 . 0 0 "[ . 1 . ]" 1
521 1 46 ARG QB 1 66 THR H . . 5.260 3.789 3.417 4.961 . 0 0 "[ . 1 . ]" 1
522 1 45 ASN HA 1 46 ARG QB . . 5.090 4.270 3.876 4.631 . 0 0 "[ . 1 . ]" 1
523 1 38 MET QB 1 51 GLY H . . 5.170 4.315 3.353 4.765 . 0 0 "[ . 1 . ]" 1
524 1 42 SER HA 1 46 ARG QB . . 5.290 4.165 3.173 4.370 . 0 0 "[ . 1 . ]" 1
525 1 1 MET QG 1 2 VAL H . . 4.750 2.812 2.045 4.189 . 0 0 "[ . 1 . ]" 1
526 1 1 MET QG 1 3 THR MG . . 5.110 3.584 3.167 4.193 . 0 0 "[ . 1 . ]" 1
527 1 1 MET QG 1 3 THR HA . . 4.790 4.441 4.140 4.737 . 0 0 "[ . 1 . ]" 1
528 1 88 GLU H 1 88 GLU QB . . 3.310 2.463 2.284 2.840 . 0 0 "[ . 1 . ]" 1
529 1 1 MET QG 1 2 VAL MG2 . . 5.500 4.739 3.905 5.370 . 0 0 "[ . 1 . ]" 1
530 1 3 THR H 1 6 GLN HB3 . . 4.360 4.388 4.207 4.526 0.166 8 0 "[ . 1 . ]" 1
531 1 6 GLN HB3 1 7 LEU H . . 4.520 4.564 4.457 4.711 0.191 8 0 "[ . 1 . ]" 1
532 1 50 GLU H 1 50 GLU HB3 . . 3.490 3.233 2.328 3.563 0.073 15 0 "[ . 1 . ]" 1
533 1 50 GLU H 1 50 GLU HB2 . . 3.430 2.556 2.168 3.579 0.149 18 0 "[ . 1 . ]" 1
534 1 50 GLU HB2 1 51 GLY H . . 4.580 4.426 3.788 4.661 0.081 4 0 "[ . 1 . ]" 1
535 1 6 GLN HB2 1 7 LEU H . . 4.670 4.410 3.734 4.560 . 0 0 "[ . 1 . ]" 1
536 1 66 THR HA 1 67 ARG HB3 . . 5.280 5.187 4.199 5.956 0.676 1 6 "[+* .* 1* * - ]" 1
537 1 36 LYS HB3 1 36 LYS HE2 . . 4.300 3.202 1.958 4.380 0.080 5 0 "[ . 1 . ]" 1
538 1 36 LYS HB2 1 38 MET HA . . 5.500 5.057 4.606 5.589 0.089 3 0 "[ . 1 . ]" 1
539 1 67 ARG H 1 67 ARG HB3 . . 3.660 3.634 3.249 3.879 0.219 3 0 "[ . 1 . ]" 1
540 1 36 LYS HB3 1 36 LYS QD . . 3.610 2.570 2.222 3.384 . 0 0 "[ . 1 . ]" 1
541 1 35 GLU H 1 35 GLU QB . . 3.240 2.584 1.916 3.264 0.024 16 0 "[ . 1 . ]" 1
542 1 35 GLU QB 1 36 LYS H . . 3.800 3.245 2.094 3.882 0.082 13 0 "[ . 1 . ]" 1
543 1 36 LYS HB2 1 37 MET H . . 4.700 4.133 2.847 4.526 . 0 0 "[ . 1 . ]" 1
544 1 36 LYS HB2 1 38 MET HG2 . . 5.100 4.491 2.813 6.027 0.927 11 1 "[ . 1+ . ]" 1
545 1 84 GLU QB 1 85 MET H . . 3.540 2.894 2.405 3.408 . 0 0 "[ . 1 . ]" 1
546 1 84 GLU H 1 84 GLU QB . . 3.170 2.132 1.994 2.271 . 0 0 "[ . 1 . ]" 1
547 1 84 GLU QB 1 105 LYS QE . . 4.910 3.571 2.050 4.613 . 0 0 "[ . 1 . ]" 1
548 1 107 THR H 1 107 THR HB . . 3.580 3.277 2.811 3.503 . 0 0 "[ . 1 . ]" 1
549 1 102 ALA MB 1 107 THR HB . . 5.200 2.865 2.276 4.802 . 0 0 "[ . 1 . ]" 1
550 1 107 THR HB 1 108 LEU H . . 4.570 3.975 3.742 4.204 . 0 0 "[ . 1 . ]" 1
551 1 102 ALA HA 1 107 THR HB . . 5.490 2.741 2.267 4.836 . 0 0 "[ . 1 . ]" 1
552 1 77 GLU QB 1 78 LEU H . . 3.680 2.773 2.519 3.436 . 0 0 "[ . 1 . ]" 1
553 1 76 ASN H 1 77 GLU QB . . 5.200 4.196 3.873 4.878 . 0 0 "[ . 1 . ]" 1
554 1 8 GLN HB2 1 9 HIS H . . 4.880 3.637 3.133 4.543 . 0 0 "[ . 1 . ]" 1
555 1 8 GLN H 1 8 GLN HB2 . . 3.650 2.465 2.050 3.696 0.046 16 0 "[ . 1 . ]" 1
556 1 8 GLN HB2 1 8 GLN HE22 . . 4.240 3.657 3.292 4.595 0.355 11 0 "[ . 1 . ]" 1
557 1 5 GLU HA 1 8 GLN HB2 . . 4.490 3.494 2.551 5.263 0.773 11 3 "[ . *+ .- ]" 1
558 1 36 LYS HA 1 36 LYS QD . . 4.490 3.872 2.565 4.523 0.033 15 0 "[ . 1 . ]" 1
559 1 87 LYS QD 1 88 GLU H . . 5.200 4.841 4.612 5.092 . 0 0 "[ . 1 . ]" 1
560 1 8 GLN HB3 1 8 GLN HE21 . . 3.910 3.306 1.992 3.983 0.073 5 0 "[ . 1 . ]" 1
561 1 8 GLN H 1 8 GLN HB3 . . 4.030 3.340 2.158 3.608 . 0 0 "[ . 1 . ]" 1
562 1 8 GLN HB2 1 8 GLN HE21 . . 3.680 2.436 1.754 3.916 0.236 16 0 "[ . 1 . ]" 1
563 1 98 GLN HA 1 111 LYS QD . . 4.900 3.965 2.958 4.792 . 0 0 "[ . 1 . ]" 1
564 1 61 LYS H 1 61 LYS QD . . 5.500 4.425 3.626 4.876 . 0 0 "[ . 1 . ]" 1
565 1 61 LYS HA 1 61 LYS QD . . 4.070 4.034 3.924 4.164 0.094 13 0 "[ . 1 . ]" 1
566 1 20 LYS QD 1 20 LYS HG2 . . 2.560 2.370 2.133 2.548 . 0 0 "[ . 1 . ]" 1
567 1 52 LYS QD 1 53 LEU H . . 4.540 4.316 2.666 4.632 0.092 6 0 "[ . 1 . ]" 1
568 1 52 LYS HA 1 52 LYS QD . . 4.220 3.885 2.223 4.209 . 0 0 "[ . 1 . ]" 1
569 1 52 LYS QD 1 54 SER HB3 . . 5.500 5.014 4.134 5.596 0.096 6 0 "[ . 1 . ]" 1
570 1 52 LYS QD 1 54 SER HB2 . . 5.500 4.484 3.482 5.159 . 0 0 "[ . 1 . ]" 1
571 1 31 ILE HG12 1 47 PHE HZ . . 5.010 4.462 4.102 5.528 0.518 10 1 "[ . + . ]" 1
572 1 31 ILE HG12 1 41 GLY HA3 . . 4.810 4.410 3.851 5.746 0.936 10 2 "[ . + - ]" 1
573 1 11 ARG QG 1 12 PHE H . . 4.420 2.512 2.213 3.149 . 0 0 "[ . 1 . ]" 1
574 1 31 ILE HG12 1 47 PHE QE . . 5.290 4.530 3.676 5.318 0.028 18 0 "[ . 1 . ]" 1
575 1 31 ILE HA 1 31 ILE HG12 . . 3.850 3.056 2.887 3.379 . 0 0 "[ . 1 . ]" 1
576 1 8 GLN HB3 1 9 HIS H . . 4.610 3.996 3.466 4.437 . 0 0 "[ . 1 . ]" 1
577 1 8 GLN HB3 1 8 GLN HE22 . . 4.840 4.301 3.328 4.926 0.086 17 0 "[ . 1 . ]" 1
578 1 11 ARG QG 1 12 PHE HA . . 5.250 3.393 3.112 3.998 . 0 0 "[ . 1 . ]" 1
579 1 31 ILE HG13 1 33 PHE HZ . . 5.500 5.072 4.420 5.718 0.218 3 0 "[ . 1 . ]" 1
580 1 31 ILE HG13 1 32 SER H . . 4.300 2.977 2.594 3.554 . 0 0 "[ . 1 . ]" 1
581 1 31 ILE HG13 1 47 PHE QE . . 5.190 3.385 2.429 4.332 . 0 0 "[ . 1 . ]" 1
582 1 47 PHE HZ 1 82 ILE HG12 . . 5.460 3.160 2.720 4.040 . 0 0 "[ . 1 . ]" 1
583 1 82 ILE HG12 1 83 SER H . . 4.950 5.066 4.972 5.221 0.271 18 0 "[ . 1 . ]" 1
584 1 82 ILE HG12 1 86 LEU HG . . 4.590 4.170 3.710 4.911 0.321 12 0 "[ . 1 . ]" 1
585 1 47 PHE QE 1 82 ILE HG13 . . 5.500 4.000 2.980 4.915 . 0 0 "[ . 1 . ]" 1
586 1 43 MET ME 1 82 ILE HG13 . . 5.390 4.276 3.724 4.961 . 0 0 "[ . 1 . ]" 1
587 1 91 GLN H 1 91 GLN HB3 . . 3.470 3.536 3.485 3.557 0.087 3 0 "[ . 1 . ]" 1
588 1 91 GLN HB3 1 102 ALA H . . 4.730 4.264 3.837 4.790 0.060 2 0 "[ . 1 . ]" 1
589 1 91 GLN HB3 1 102 ALA MB . . 4.410 3.709 3.165 4.489 0.079 1 0 "[ . 1 . ]" 1
590 1 91 GLN HB3 1 92 VAL H . . 4.250 3.240 2.886 4.008 . 0 0 "[ . 1 . ]" 1
591 1 91 GLN HB2 1 92 VAL H . . 4.480 4.176 3.952 4.531 0.051 17 0 "[ . 1 . ]" 1
592 1 20 LYS HA 1 20 LYS QD . . 4.320 3.726 2.363 4.422 0.102 14 0 "[ . 1 . ]" 1
593 1 26 LYS HA 1 26 LYS QD . . 4.310 3.759 2.274 4.147 . 0 0 "[ . 1 . ]" 1
594 1 43 MET ME 1 82 ILE HG12 . . 5.470 3.184 2.249 3.914 . 0 0 "[ . 1 . ]" 1
595 1 82 ILE H 1 82 ILE HG12 . . 5.420 4.661 4.538 4.745 . 0 0 "[ . 1 . ]" 1
596 1 82 ILE HG13 1 83 SER HA . . 5.390 4.213 3.922 4.562 . 0 0 "[ . 1 . ]" 1
597 1 82 ILE HG13 1 86 LEU HG . . 4.940 2.814 2.274 3.825 . 0 0 "[ . 1 . ]" 1
598 1 43 MET HG3 1 82 ILE HG13 . . 5.340 4.996 4.419 5.433 0.093 18 0 "[ . 1 . ]" 1
599 1 95 THR HB 1 98 GLN H . . 5.170 3.535 2.482 4.995 . 0 0 "[ . 1 . ]" 1
600 1 94 LEU HA 1 95 THR HB . . 5.290 4.706 4.316 5.116 . 0 0 "[ . 1 . ]" 1
601 1 95 THR HB 1 96 ALA H . . 3.940 3.134 2.262 3.912 . 0 0 "[ . 1 . ]" 1
602 1 95 THR H 1 95 THR HB . . 3.760 2.829 2.531 3.076 . 0 0 "[ . 1 . ]" 1
603 1 95 THR HB 1 98 GLN HE21 . . 4.980 4.864 4.089 5.052 0.072 3 0 "[ . 1 . ]" 1
604 1 95 THR HB 1 98 GLN HB3 . . 4.860 3.562 2.342 4.772 . 0 0 "[ . 1 . ]" 1
605 1 95 THR HB 1 96 ALA MB . . 5.500 4.464 3.578 5.341 . 0 0 "[ . 1 . ]" 1
606 1 100 THR H 1 100 THR HB . . 3.620 2.628 2.313 3.078 . 0 0 "[ . 1 . ]" 1
607 1 93 ASP HB3 1 100 THR HB . . 3.180 2.759 2.213 3.236 0.056 6 0 "[ . 1 . ]" 1
608 1 93 ASP H 1 100 THR HB . . 4.140 3.500 2.731 4.111 . 0 0 "[ . 1 . ]" 1
609 1 5 GLU H 1 5 GLU HB2 . . 3.640 2.185 1.991 2.394 . 0 0 "[ . 1 . ]" 1
610 1 5 GLU HB3 1 6 GLN H . . 4.330 2.635 2.259 3.711 . 0 0 "[ . 1 . ]" 1
611 1 4 PRO HG3 1 53 LEU HG . . 4.580 4.411 3.960 4.646 0.066 13 0 "[ . 1 . ]" 1
612 1 16 SER H 1 109 THR HB . . 3.910 3.175 2.655 3.631 . 0 0 "[ . 1 . ]" 1
613 1 16 SER QB 1 109 THR HB . . 4.660 3.631 2.852 4.164 . 0 0 "[ . 1 . ]" 1
614 1 98 GLN HG3 1 109 THR HB . . 5.250 5.393 4.926 5.856 0.606 11 2 "[ . -1+ . ]" 1
615 1 15 GLU HB3 1 109 THR HB . . 4.880 4.049 3.243 4.957 0.077 5 0 "[ . 1 . ]" 1
616 1 109 THR H 1 109 THR HB . . 3.600 2.763 2.499 3.177 . 0 0 "[ . 1 . ]" 1
617 1 4 PRO HG2 1 5 GLU H . . 4.520 2.284 2.081 2.780 . 0 0 "[ . 1 . ]" 1
618 1 3 THR HA 1 4 PRO HG2 . . 4.930 4.623 4.458 4.772 . 0 0 "[ . 1 . ]" 1
619 1 3 THR HB 1 4 PRO HG2 . . 4.870 3.719 3.261 4.359 . 0 0 "[ . 1 . ]" 1
620 1 4 PRO HG2 1 53 LEU QD . . 4.850 4.749 4.325 4.968 0.118 17 0 "[ . 1 . ]" 1
621 1 4 PRO HG3 1 53 LEU QD . . 4.380 4.199 3.139 4.480 0.100 16 0 "[ . 1 . ]" 1
622 1 3 THR HA 1 4 PRO HG3 . . 5.140 4.676 4.399 4.774 . 0 0 "[ . 1 . ]" 1
623 1 108 LEU HA 1 109 THR HB . . 5.330 4.728 4.437 5.279 . 0 0 "[ . 1 . ]" 1
624 1 109 THR HB 1 110 TYR H . . 4.560 4.252 3.962 4.445 . 0 0 "[ . 1 . ]" 1
625 1 28 PRO HA 1 29 PRO HG2 . . 4.960 4.602 4.398 4.832 . 0 0 "[ . 1 . ]" 1
626 1 29 PRO HG2 1 75 LEU QD . . 4.220 3.811 3.471 4.218 . 0 0 "[ . 1 . ]" 1
627 1 29 PRO HG3 1 75 LEU QD . . 3.890 2.472 2.169 2.958 . 0 0 "[ . 1 . ]" 1
628 1 99 LEU QD 1 101 LEU HG . . 4.850 3.636 2.799 4.231 . 0 0 "[ . 1 . ]" 1
629 1 66 THR HB 1 68 MET H . . 4.560 4.316 2.768 4.643 0.083 5 0 "[ . 1 . ]" 1
630 1 66 THR HB 1 67 ARG H . . 3.150 2.107 1.913 2.441 . 0 0 "[ . 1 . ]" 1
631 1 28 PRO HA 1 29 PRO HG3 . . 4.830 4.649 4.539 4.842 0.012 14 0 "[ . 1 . ]" 1
632 1 101 LEU H 1 101 LEU HG . . 4.160 4.219 3.885 4.254 0.094 3 0 "[ . 1 . ]" 1
633 1 101 LEU HG 1 110 TYR QE . . 4.650 2.844 2.004 4.622 . 0 0 "[ . 1 . ]" 1
634 1 101 LEU HA 1 101 LEU HG . . 4.220 3.553 2.158 3.801 . 0 0 "[ . 1 . ]" 1
635 1 14 LEU QD 1 15 GLU H . . 3.500 2.825 2.141 3.274 . 0 0 "[ . 1 . ]" 1
636 1 14 LEU H 1 14 LEU QD . . 4.620 3.776 3.703 3.864 . 0 0 "[ . 1 . ]" 1
637 1 14 LEU QD 1 16 SER H . . 3.920 2.611 2.312 2.954 . 0 0 "[ . 1 . ]" 1
638 1 14 LEU QD 1 110 TYR QE . . 4.170 2.789 2.343 3.153 . 0 0 "[ . 1 . ]" 1
639 1 14 LEU QD 1 29 PRO HD3 . . 5.300 4.677 4.316 4.980 . 0 0 "[ . 1 . ]" 1
640 1 14 LEU HA 1 14 LEU QD . . 3.170 2.253 2.037 2.881 . 0 0 "[ . 1 . ]" 1
641 1 14 LEU QD 1 29 PRO HB3 . . 4.250 3.610 3.367 3.819 . 0 0 "[ . 1 . ]" 1
642 1 14 LEU QD 1 43 MET ME . . 4.110 2.154 1.980 2.532 . 0 0 "[ . 1 . ]" 1
643 1 14 LEU QD 1 29 PRO HG3 . . 3.840 2.951 2.513 3.283 . 0 0 "[ . 1 . ]" 1
644 1 42 SER HB2 1 46 ARG QG . . 4.400 2.862 2.032 4.134 . 0 0 "[ . 1 . ]" 1
645 1 14 LEU QD 1 29 PRO HA . . 5.490 4.785 4.544 4.931 . 0 0 "[ . 1 . ]" 1
646 1 23 THR H 1 23 THR HB . . 3.560 3.403 2.679 3.643 0.083 9 0 "[ . 1 . ]" 1
647 1 78 LEU HA 1 78 LEU HG . . 3.970 2.838 2.452 3.679 . 0 0 "[ . 1 . ]" 1
648 1 42 SER HA 1 46 ARG QG . . 5.350 3.668 2.874 4.793 . 0 0 "[ . 1 . ]" 1
649 1 46 ARG QG 1 66 THR MG . . 3.690 3.514 1.887 3.656 . 0 0 "[ . 1 . ]" 1
650 1 46 ARG H 1 46 ARG QG . . 4.180 3.160 2.522 3.893 . 0 0 "[ . 1 . ]" 1
651 1 46 ARG QG 1 47 PHE H . . 4.310 3.614 2.981 3.984 . 0 0 "[ . 1 . ]" 1
652 1 108 LEU H 1 108 LEU HG . . 4.340 4.010 2.997 4.433 0.093 9 0 "[ . 1 . ]" 1
653 1 14 LEU QD 1 108 LEU HG . . 5.370 3.047 2.047 4.405 . 0 0 "[ . 1 . ]" 1
654 1 37 MET QB 1 51 GLY H . . 4.740 4.205 3.211 4.853 0.113 11 0 "[ . 1 . ]" 1
655 1 37 MET QB 1 58 LEU MD1 . . 5.500 3.921 3.217 4.880 . 0 0 "[ . 1 . ]" 1
656 1 21 PRO QG 1 22 VAL H . . 5.170 4.083 3.846 4.458 . 0 0 "[ . 1 . ]" 1
657 1 94 LEU HG 1 95 THR H . . 4.830 4.305 2.892 4.919 0.089 8 0 "[ . 1 . ]" 1
658 1 39 ILE HG12 1 51 GLY H . . 5.500 3.994 3.491 4.734 . 0 0 "[ . 1 . ]" 1
659 1 39 ILE H 1 39 ILE HG12 . . 4.700 3.808 3.034 4.193 . 0 0 "[ . 1 . ]" 1
660 1 39 ILE HG12 1 40 SER H . . 5.400 4.834 4.375 5.181 . 0 0 "[ . 1 . ]" 1
661 1 37 MET QB 1 51 GLY HA2 . . 5.500 4.597 3.810 5.574 0.074 11 0 "[ . 1 . ]" 1
662 1 73 PRO HG2 1 74 GLN H . . 4.140 2.319 1.987 2.727 . 0 0 "[ . 1 . ]" 1
663 1 72 ASN HA 1 73 PRO HG2 . . 4.700 4.590 4.473 4.774 0.074 2 0 "[ . 1 . ]" 1
664 1 73 PRO HG3 1 74 GLN H . . 4.240 3.870 3.574 4.249 0.009 7 0 "[ . 1 . ]" 1
665 1 33 PHE QD 1 39 ILE HG13 . . 4.750 3.599 2.636 4.322 . 0 0 "[ . 1 . ]" 1
666 1 33 PHE QE 1 39 ILE HG13 . . 5.050 3.994 3.230 4.544 . 0 0 "[ . 1 . ]" 1
667 1 94 LEU HA 1 94 LEU HG . . 4.020 3.429 3.113 3.665 . 0 0 "[ . 1 . ]" 1
668 1 58 LEU H 1 58 LEU HG . . 5.420 4.467 4.341 4.639 . 0 0 "[ . 1 . ]" 1
669 1 58 LEU HG 1 59 THR H . . 4.500 3.728 2.098 4.420 . 0 0 "[ . 1 . ]" 1
670 1 33 PHE QD 1 39 ILE HG12 . . 4.410 2.409 2.134 3.039 . 0 0 "[ . 1 . ]" 1
671 1 33 PHE QE 1 39 ILE HG12 . . 4.440 2.351 2.216 2.926 . 0 0 "[ . 1 . ]" 1
672 1 39 ILE HG12 1 51 GLY HA3 . . 5.210 3.220 2.785 3.927 . 0 0 "[ . 1 . ]" 1
673 1 108 LEU H 1 108 LEU QD . . 4.530 3.188 2.493 3.822 . 0 0 "[ . 1 . ]" 1
674 1 108 LEU QD 1 110 TYR QE . . 4.090 2.717 2.106 3.468 . 0 0 "[ . 1 . ]" 1
675 1 108 LEU HA 1 108 LEU QD . . 3.220 2.302 2.114 2.465 . 0 0 "[ . 1 . ]" 1
676 1 43 MET ME 1 108 LEU QD . . 3.770 2.447 2.018 3.195 . 0 0 "[ . 1 . ]" 1
677 1 108 LEU HB2 1 108 LEU QD . . 3.250 2.237 2.122 2.345 . 0 0 "[ . 1 . ]" 1
678 1 14 LEU QD 1 108 LEU QD . . 3.730 2.040 1.838 2.657 . 0 0 "[ . 1 . ]" 1
679 1 3 THR HA 1 3 THR HB . . 3.020 2.589 2.392 2.761 . 0 0 "[ . 1 . ]" 1
680 1 3 THR HB 1 4 PRO HD2 . . 3.200 2.139 1.961 2.389 . 0 0 "[ . 1 . ]" 1
681 1 3 THR HB 1 5 GLU H . . 3.810 2.859 2.672 3.149 . 0 0 "[ . 1 . ]" 1
682 1 75 LEU HG 1 76 ASN H . . 5.500 4.366 4.104 4.997 . 0 0 "[ . 1 . ]" 1
683 1 72 ASN HD21 1 75 LEU HG . . 5.260 3.181 1.941 4.516 . 0 0 "[ . 1 . ]" 1
684 1 115 LEU HA 1 115 LEU HG . . 4.190 3.320 3.100 3.599 . 0 0 "[ . 1 . ]" 1
685 1 53 LEU HG 1 56 GLY H . . 5.280 4.412 3.645 5.341 0.061 4 0 "[ . 1 . ]" 1
686 1 3 THR HA 1 53 LEU HG . . 5.380 3.366 2.856 3.912 . 0 0 "[ . 1 . ]" 1
687 1 3 THR HB 1 53 LEU HG . . 5.500 5.462 5.084 5.589 0.089 15 0 "[ . 1 . ]" 1
688 1 58 LEU MD2 1 59 THR H . . 5.480 5.005 3.706 5.397 . 0 0 "[ . 1 . ]" 1
689 1 3 THR HB 1 6 GLN QG . . 4.510 3.632 2.936 4.176 . 0 0 "[ . 1 . ]" 1
690 1 85 MET H 1 86 LEU HG . . 5.500 5.581 5.559 5.592 0.092 15 0 "[ . 1 . ]" 1
691 1 86 LEU HG 1 87 LYS H . . 5.180 5.198 4.816 5.257 0.077 17 0 "[ . 1 . ]" 1
692 1 60 ALA MB 1 86 LEU HG . . 4.450 3.599 3.188 4.536 0.086 12 0 "[ . 1 . ]" 1
693 1 72 ASN HD22 1 75 LEU HG . . 5.410 4.179 2.004 5.427 0.017 5 0 "[ . 1 . ]" 1
694 1 75 LEU H 1 75 LEU HG . . 3.600 2.316 1.979 3.696 0.096 5 0 "[ . 1 . ]" 1
695 1 72 ASN QB 1 75 LEU HG . . 3.870 2.896 2.124 3.977 0.107 5 0 "[ . 1 . ]" 1
696 1 63 LEU HG 1 65 MET H . . 5.500 5.260 4.233 5.567 0.067 18 0 "[ . 1 . ]" 1
697 1 48 SER H 1 63 LEU HG . . 5.070 3.042 2.674 3.840 . 0 0 "[ . 1 . ]" 1
698 1 49 GLY HA3 1 63 LEU HG . . 5.380 4.555 3.788 5.177 . 0 0 "[ . 1 . ]" 1
699 1 99 LEU HG 1 100 THR H . . 4.370 3.729 2.780 4.464 0.094 2 0 "[ . 1 . ]" 1
700 1 31 ILE MG 1 99 LEU HG . . 5.500 5.460 4.999 5.608 0.108 2 0 "[ . 1 . ]" 1
701 1 99 LEU HG 1 110 TYR H . . 5.500 4.761 3.292 5.564 0.064 3 0 "[ . 1 . ]" 1
702 1 58 LEU H 1 58 LEU MD2 . . 4.780 4.425 4.233 4.618 . 0 0 "[ . 1 . ]" 1
703 1 58 LEU HA 1 58 LEU MD2 . . 4.690 3.903 3.861 3.942 . 0 0 "[ . 1 . ]" 1
704 1 58 LEU HB3 1 58 LEU MD2 . . 3.260 2.318 2.247 2.371 . 0 0 "[ . 1 . ]" 1
705 1 58 LEU HB2 1 58 LEU MD2 . . 3.290 2.460 2.346 2.599 . 0 0 "[ . 1 . ]" 1
706 1 58 LEU MD2 1 86 LEU QD . . 3.790 2.422 2.120 2.865 . 0 0 "[ . 1 . ]" 1
707 1 7 LEU MD1 1 58 LEU MD2 . . 5.500 4.039 3.249 4.580 . 0 0 "[ . 1 . ]" 1
708 1 94 LEU QD 1 99 LEU QD . . 3.850 2.635 2.026 3.159 . 0 0 "[ . 1 . ]" 1
709 1 81 THR HB 1 82 ILE HB . . 5.370 3.887 3.648 4.103 . 0 0 "[ . 1 . ]" 1
710 1 63 LEU HG 1 64 ALA H . . 4.160 3.180 2.085 4.096 . 0 0 "[ . 1 . ]" 1
711 1 63 LEU H 1 63 LEU HG . . 4.290 4.365 4.265 4.382 0.092 8 0 "[ . 1 . ]" 1
712 1 63 LEU HG 1 83 SER HA . . 5.500 4.811 4.473 5.459 . 0 0 "[ . 1 . ]" 1
713 1 67 ARG HA 1 67 ARG QG . . 3.790 2.982 2.272 3.517 . 0 0 "[ . 1 . ]" 1
714 1 112 LEU HA 1 112 LEU HG . . 4.260 3.187 2.922 3.439 . 0 0 "[ . 1 . ]" 1
715 1 112 LEU HG 1 114 ASP QB . . 4.880 3.510 2.288 4.453 . 0 0 "[ . 1 . ]" 1
716 1 112 LEU HG 1 114 ASP H . . 3.950 3.711 3.035 4.027 0.077 18 0 "[ . 1 . ]" 1
717 1 94 LEU QD 1 95 THR H . . 3.650 2.466 2.288 2.872 . 0 0 "[ . 1 . ]" 1
718 1 94 LEU HA 1 94 LEU QD . . 3.150 2.203 2.098 2.310 . 0 0 "[ . 1 . ]" 1
719 1 81 THR H 1 81 THR HB . . 3.620 2.671 2.527 2.843 . 0 0 "[ . 1 . ]" 1
720 1 81 THR HB 1 82 ILE H . . 3.650 2.369 2.083 2.592 . 0 0 "[ . 1 . ]" 1
721 1 78 LEU QD 1 81 THR HB . . 4.070 2.966 2.253 4.050 . 0 0 "[ . 1 . ]" 1
722 1 43 MET ME 1 81 THR HB . . 4.930 3.611 2.810 4.191 . 0 0 "[ . 1 . ]" 1
723 1 94 LEU H 1 94 LEU QD . . 5.200 3.840 3.710 4.046 . 0 0 "[ . 1 . ]" 1
724 1 12 PHE QE 1 94 LEU QD . . 3.090 2.143 1.965 2.437 . 0 0 "[ . 1 . ]" 1
725 1 94 LEU QD 1 95 THR HA . . 5.500 3.941 3.504 4.432 . 0 0 "[ . 1 . ]" 1
726 1 6 GLN HE21 1 94 LEU QD . . 4.750 2.139 1.704 4.401 . 0 0 "[ . 1 . ]" 1
727 1 12 PHE HZ 1 94 LEU QD . . 3.750 2.189 1.908 2.589 . 0 0 "[ . 1 . ]" 1
728 1 7 LEU HA 1 94 LEU QD . . 4.980 4.354 3.743 4.767 . 0 0 "[ . 1 . ]" 1
729 1 6 GLN QG 1 94 LEU QD . . 5.020 2.724 2.083 3.853 . 0 0 "[ . 1 . ]" 1
730 1 6 GLN HB2 1 94 LEU QD . . 3.830 3.159 2.432 3.880 0.050 17 0 "[ . 1 . ]" 1
731 1 7 LEU MD2 1 94 LEU QD . . 3.580 2.467 1.844 3.163 . 0 0 "[ . 1 . ]" 1
732 1 14 LEU HG 1 15 GLU HA . . 5.340 5.051 4.496 5.443 0.103 3 0 "[ . 1 . ]" 1
733 1 14 LEU HA 1 14 LEU HG . . 4.180 3.052 2.021 3.512 . 0 0 "[ . 1 . ]" 1
734 1 14 LEU HG 1 29 PRO HB2 . . 4.960 4.762 4.307 5.040 0.080 3 0 "[ . 1 . ]" 1
735 1 14 LEU H 1 14 LEU HG . . 5.210 4.423 3.999 4.570 . 0 0 "[ . 1 . ]" 1
736 1 9 HIS QB 1 10 HIS H . . 5.500 3.815 3.645 4.123 . 0 0 "[ . 1 . ]" 1
737 1 29 PRO HD2 1 75 LEU QD . . 4.390 3.626 3.237 4.153 . 0 0 "[ . 1 . ]" 1
738 1 60 ALA H 1 86 LEU QD . . 4.470 3.265 2.941 3.634 . 0 0 "[ . 1 . ]" 1
739 1 86 LEU H 1 86 LEU QD . . 4.290 2.446 2.152 2.945 . 0 0 "[ . 1 . ]" 1
740 1 47 PHE HZ 1 86 LEU QD . . 5.500 4.808 3.666 5.168 . 0 0 "[ . 1 . ]" 1
741 1 59 THR HA 1 86 LEU QD . . 3.980 3.336 2.689 3.788 . 0 0 "[ . 1 . ]" 1
742 1 24 SER HB2 1 75 LEU QD . . 4.750 3.295 2.016 4.531 . 0 0 "[ . 1 . ]" 1
743 1 70 CYS HB3 1 75 LEU QD . . 4.310 2.643 1.938 4.049 . 0 0 "[ . 1 . ]" 1
744 1 74 GLN HE22 1 78 LEU QD . . 5.500 4.305 3.299 4.973 . 0 0 "[ . 1 . ]" 1
745 1 29 PRO HD2 1 78 LEU QD . . 5.500 5.080 4.527 5.500 . 0 0 "[ . 1 . ]" 1
746 1 29 PRO HB3 1 78 LEU QD . . 5.290 3.545 2.411 4.338 . 0 0 "[ . 1 . ]" 1
747 1 14 LEU QD 1 78 LEU QD . . 5.250 2.220 1.853 2.709 . 0 0 "[ . 1 . ]" 1
748 1 74 GLN HE21 1 78 LEU QD . . 5.070 3.253 1.987 3.793 . 0 0 "[ . 1 . ]" 1
749 1 112 LEU H 1 112 LEU MD2 . . 4.510 4.146 3.930 4.272 . 0 0 "[ . 1 . ]" 1
750 1 97 ASN H 1 112 LEU MD2 . . 4.850 4.761 4.386 4.954 0.104 15 0 "[ . 1 . ]" 1
751 1 12 PHE HZ 1 112 LEU MD2 . . 5.500 3.767 3.227 4.299 . 0 0 "[ . 1 . ]" 1
752 1 97 ASN HD21 1 112 LEU MD2 . . 4.830 4.179 3.493 4.825 . 0 0 "[ . 1 . ]" 1
753 1 112 LEU HA 1 112 LEU MD2 . . 4.510 3.886 3.792 3.942 . 0 0 "[ . 1 . ]" 1
754 1 97 ASN HB3 1 112 LEU MD2 . . 4.520 2.641 2.269 3.066 . 0 0 "[ . 1 . ]" 1
755 1 10 HIS HB3 1 112 LEU MD2 . . 4.520 4.359 4.057 4.599 0.079 19 0 "[ . 1 . ]" 1
756 1 36 LYS H 1 36 LYS QG . . 3.720 2.758 2.008 3.813 0.093 13 0 "[ . 1 . ]" 1
757 1 36 LYS QG 1 37 MET H . . 5.210 4.516 3.321 4.810 . 0 0 "[ . 1 . ]" 1
758 1 36 LYS HA 1 36 LYS QG . . 3.410 2.584 2.169 3.335 . 0 0 "[ . 1 . ]" 1
759 1 7 LEU H 1 7 LEU HG . . 3.930 3.157 3.025 3.384 . 0 0 "[ . 1 . ]" 1
760 1 4 PRO HA 1 7 LEU HG . . 5.170 3.707 2.917 4.169 . 0 0 "[ . 1 . ]" 1
761 1 6 GLN HB3 1 7 LEU HG . . 5.390 4.890 4.300 5.446 0.056 8 0 "[ . 1 . ]" 1
762 1 72 ASN HD22 1 75 LEU QD . . 4.590 4.051 2.562 4.791 0.201 2 0 "[ . 1 . ]" 1
763 1 75 LEU H 1 75 LEU QD . . 4.100 3.027 2.079 3.185 . 0 0 "[ . 1 . ]" 1
764 1 72 ASN HD21 1 75 LEU QD . . 5.120 3.231 1.661 4.174 . 0 0 "[ . 1 . ]" 1
765 1 44 CYS HA 1 75 LEU QD . . 4.000 3.581 3.087 3.806 . 0 0 "[ . 1 . ]" 1
766 1 75 LEU HA 1 75 LEU QD . . 3.050 2.193 2.074 2.330 . 0 0 "[ . 1 . ]" 1
767 1 78 LEU H 1 78 LEU QD . . 4.220 2.940 2.565 3.359 . 0 0 "[ . 1 . ]" 1
768 1 75 LEU HA 1 78 LEU QD . . 3.560 2.554 2.197 3.427 . 0 0 "[ . 1 . ]" 1
769 1 78 LEU HB2 1 78 LEU QD . . 3.180 2.206 2.126 2.324 . 0 0 "[ . 1 . ]" 1
770 1 93 ASP H 1 101 LEU MD2 . . 4.810 3.555 2.544 5.612 0.802 13 2 "[ - . 1 + . ]" 1
771 1 84 GLU HA 1 87 LYS HG2 . . 5.250 4.916 3.898 5.680 0.430 8 0 "[ . 1 . ]" 1
772 1 101 LEU HB2 1 101 LEU MD2 . . 3.250 2.586 2.482 3.071 . 0 0 "[ . 1 . ]" 1
773 1 101 LEU HB3 1 101 LEU MD2 . . 3.420 3.105 2.259 3.243 . 0 0 "[ . 1 . ]" 1
774 1 101 LEU HA 1 101 LEU MD2 . . 3.260 2.346 2.028 3.653 0.393 3 0 "[ . 1 . ]" 1
775 1 92 VAL H 1 101 LEU MD2 . . 5.500 5.135 4.473 6.196 0.696 3 2 "[ + . 1 - . ]" 1
776 1 87 LYS HG2 1 88 GLU H . . 5.500 4.942 4.468 5.532 0.032 2 0 "[ . 1 . ]" 1
777 1 87 LYS H 1 87 LYS HG2 . . 4.460 4.414 3.910 4.552 0.092 5 0 "[ . 1 . ]" 1
778 1 87 LYS HA 1 87 LYS HG2 . . 3.990 3.130 2.256 3.803 . 0 0 "[ . 1 . ]" 1
779 1 105 LYS HA 1 105 LYS HG3 . . 3.770 3.587 3.113 3.735 . 0 0 "[ . 1 . ]" 1
780 1 87 LYS H 1 87 LYS HG3 . . 4.750 3.990 2.805 4.603 . 0 0 "[ . 1 . ]" 1
781 1 87 LYS HA 1 87 LYS HG3 . . 3.960 2.502 2.192 2.987 . 0 0 "[ . 1 . ]" 1
782 1 105 LYS H 1 105 LYS HG2 . . 4.310 3.167 2.625 4.264 . 0 0 "[ . 1 . ]" 1
783 1 6 GLN H 1 7 LEU MD1 . . 5.500 4.898 4.436 5.405 . 0 0 "[ . 1 . ]" 1
784 1 7 LEU H 1 7 LEU MD1 . . 4.330 4.110 3.882 4.333 0.003 13 0 "[ . 1 . ]" 1
785 1 7 LEU HA 1 7 LEU MD1 . . 4.550 3.877 3.781 3.933 . 0 0 "[ . 1 . ]" 1
786 1 61 LYS H 1 61 LYS QG . . 3.960 3.738 2.118 4.061 0.101 12 0 "[ . 1 . ]" 1
787 1 61 LYS HA 1 61 LYS QG . . 3.930 2.410 2.107 3.508 . 0 0 "[ . 1 . ]" 1
788 1 105 LYS HA 1 105 LYS HG2 . . 3.740 2.583 2.159 3.827 0.087 16 0 "[ . 1 . ]" 1
789 1 7 LEU MD1 1 8 GLN H . . 5.310 4.284 4.108 4.484 . 0 0 "[ . 1 . ]" 1
790 1 7 LEU MD1 1 33 PHE QD . . 4.850 4.141 3.111 4.836 . 0 0 "[ . 1 . ]" 1
791 1 7 LEU MD1 1 33 PHE QE . . 4.660 4.054 2.968 4.760 0.100 15 0 "[ . 1 . ]" 1
792 1 7 LEU MD1 1 33 PHE HZ . . 5.310 4.632 3.410 5.378 0.068 2 0 "[ . 1 . ]" 1
793 1 4 PRO HA 1 7 LEU MD1 . . 4.410 2.388 2.177 2.770 . 0 0 "[ . 1 . ]" 1
794 1 81 THR HA 1 84 GLU QB . . 4.190 3.335 2.736 4.043 . 0 0 "[ . 1 . ]" 1
795 1 81 THR HA 1 84 GLU H . . 4.990 4.014 3.604 4.465 . 0 0 "[ . 1 . ]" 1
796 1 81 THR HA 1 83 SER H . . 5.500 4.616 4.284 4.829 . 0 0 "[ . 1 . ]" 1
797 1 17 VAL HA 1 108 LEU QD . . 3.640 2.520 2.000 3.519 . 0 0 "[ . 1 . ]" 1
798 1 108 LEU QD 1 109 THR H . . 4.160 3.652 2.960 3.876 . 0 0 "[ . 1 . ]" 1
799 1 63 LEU QD 1 83 SER HA . . 3.430 2.060 1.886 2.538 . 0 0 "[ . 1 . ]" 1
800 1 63 LEU QD 1 65 MET ME . . 4.780 2.958 2.191 3.983 . 0 0 "[ . 1 . ]" 1
801 1 47 PHE QD 1 63 LEU QD . . 3.690 2.425 2.025 2.766 . 0 0 "[ . 1 . ]" 1
802 1 47 PHE HA 1 63 LEU QD . . 4.980 4.051 3.480 4.682 . 0 0 "[ . 1 . ]" 1
803 1 48 SER HA 1 63 LEU QD . . 4.960 4.293 3.742 4.774 . 0 0 "[ . 1 . ]" 1
804 1 60 ALA HA 1 63 LEU QD . . 5.390 4.280 3.824 4.946 . 0 0 "[ . 1 . ]" 1
805 1 63 LEU HA 1 63 LEU QD . . 3.470 2.492 2.129 3.338 . 0 0 "[ . 1 . ]" 1
806 1 63 LEU QD 1 87 LYS HA . . 4.660 4.728 4.280 4.798 0.138 15 0 "[ . 1 . ]" 1
807 1 63 LEU QD 1 83 SER HB3 . . 3.780 3.608 2.673 3.908 0.128 11 0 "[ . 1 . ]" 1
808 1 63 LEU QD 1 64 ALA H . . 4.010 3.720 3.084 4.132 0.122 18 0 "[ . 1 . ]" 1
809 1 63 LEU H 1 63 LEU QD . . 4.550 3.571 3.217 4.111 . 0 0 "[ . 1 . ]" 1
810 1 63 LEU QD 1 86 LEU H . . 5.500 4.155 3.801 4.560 . 0 0 "[ . 1 . ]" 1
811 1 63 LEU QD 1 87 LYS H . . 5.500 4.344 4.030 4.682 . 0 0 "[ . 1 . ]" 1
812 1 99 LEU QD 1 110 TYR H . . 5.100 3.915 3.600 4.339 . 0 0 "[ . 1 . ]" 1
813 1 99 LEU QD 1 100 THR H . . 3.710 2.706 2.158 3.577 . 0 0 "[ . 1 . ]" 1
814 1 99 LEU H 1 99 LEU QD . . 4.870 3.705 3.530 3.896 . 0 0 "[ . 1 . ]" 1
815 1 12 PHE QD 1 99 LEU QD . . 4.350 2.985 2.619 3.295 . 0 0 "[ . 1 . ]" 1
816 1 99 LEU QD 1 110 TYR QE . . 5.500 3.663 3.201 4.219 . 0 0 "[ . 1 . ]" 1
817 1 99 LEU HA 1 99 LEU QD . . 3.390 2.106 2.022 2.211 . 0 0 "[ . 1 . ]" 1
818 1 98 GLN HA 1 111 LYS QG . . 5.370 4.413 3.498 5.097 . 0 0 "[ . 1 . ]" 1
819 1 20 LYS HA 1 20 LYS HG3 . . 4.160 3.483 2.869 4.221 0.061 12 0 "[ . 1 . ]" 1
820 1 20 LYS HG3 1 21 PRO QD . . 5.350 4.058 3.838 4.400 . 0 0 "[ . 1 . ]" 1
821 1 20 LYS HE2 1 20 LYS HG3 . . 3.770 3.028 2.517 3.851 0.081 9 0 "[ . 1 . ]" 1
822 1 20 LYS HB2 1 20 LYS HG3 . . 2.880 2.344 2.206 2.601 . 0 0 "[ . 1 . ]" 1
823 1 20 LYS QD 1 20 LYS HG3 . . 2.750 2.341 2.165 2.448 . 0 0 "[ . 1 . ]" 1
824 1 20 LYS H 1 20 LYS HG3 . . 4.230 3.848 3.002 4.300 0.070 18 0 "[ . 1 . ]" 1
825 1 20 LYS HG2 1 21 PRO QD . . 5.160 3.438 2.546 4.683 . 0 0 "[ . 1 . ]" 1
826 1 52 LYS HG2 1 53 LEU H . . 4.080 2.884 2.443 4.143 0.063 14 0 "[ . 1 . ]" 1
827 1 52 LYS HG2 1 54 SER HB3 . . 5.390 4.397 3.381 5.459 0.069 9 0 "[ . 1 . ]" 1
828 1 52 LYS HG3 1 53 LEU H . . 4.100 2.635 2.063 3.115 . 0 0 "[ . 1 . ]" 1
829 1 52 LYS HA 1 52 LYS HG3 . . 4.130 2.524 2.129 3.116 . 0 0 "[ . 1 . ]" 1
830 1 12 PHE HZ 1 99 LEU QD . . 5.500 3.928 2.895 4.651 . 0 0 "[ . 1 . ]" 1
831 1 12 PHE QE 1 99 LEU QD . . 5.220 3.337 2.552 3.866 . 0 0 "[ . 1 . ]" 1
832 1 33 PHE QE 1 99 LEU QD . . 3.640 2.926 2.404 3.489 . 0 0 "[ . 1 . ]" 1
833 1 99 LEU QD 1 110 TYR HB3 . . 3.790 3.297 2.758 3.662 . 0 0 "[ . 1 . ]" 1
834 1 94 LEU HB3 1 99 LEU QD . . 4.240 3.538 3.334 4.202 . 0 0 "[ . 1 . ]" 1
835 1 92 VAL QG 1 99 LEU QD . . 3.230 2.156 1.949 2.747 . 0 0 "[ . 1 . ]" 1
836 1 7 LEU MD2 1 99 LEU QD . . 3.890 2.804 2.015 3.533 . 0 0 "[ . 1 . ]" 1
837 1 99 LEU QD 1 111 LYS H . . 5.500 5.111 4.778 5.435 . 0 0 "[ . 1 . ]" 1
838 1 12 PHE HB2 1 99 LEU QD . . 4.420 3.177 2.603 3.664 . 0 0 "[ . 1 . ]" 1
839 1 99 LEU QD 1 101 LEU MD2 . . 3.580 2.193 1.705 3.668 0.088 13 0 "[ . 1 . ]" 1
840 1 31 ILE MG 1 99 LEU QD . . 3.750 3.036 2.736 3.261 . 0 0 "[ . 1 . ]" 1
841 1 111 LYS QG 1 112 LEU H . . 4.410 3.018 2.173 3.772 . 0 0 "[ . 1 . ]" 1
842 1 26 LYS QG 1 27 ASN H . . 5.270 3.905 2.028 4.953 . 0 0 "[ . 1 . ]" 1
843 1 26 LYS H 1 26 LYS QG . . 4.220 3.701 2.000 4.290 0.070 1 0 "[ . 1 . ]" 1
844 1 52 LYS HG2 1 54 SER HB2 . . 5.330 3.703 2.952 4.986 . 0 0 "[ . 1 . ]" 1
845 1 52 LYS HG3 1 54 SER HB2 . . 4.900 4.231 2.525 4.972 0.072 2 0 "[ . 1 . ]" 1
846 1 93 ASP H 1 99 LEU QD . . 4.370 3.301 2.645 4.337 . 0 0 "[ . 1 . ]" 1
847 1 92 VAL HA 1 99 LEU QD . . 4.970 3.625 2.755 4.506 . 0 0 "[ . 1 . ]" 1
848 1 33 PHE HZ 1 99 LEU QD . . 3.250 3.170 2.822 3.294 0.044 18 0 "[ . 1 . ]" 1
849 1 93 ASP HA 1 99 LEU QD . . 5.500 4.478 4.048 5.444 . 0 0 "[ . 1 . ]" 1
850 1 26 LYS QG 1 28 PRO HD3 . . 5.500 5.016 4.310 5.589 0.089 10 0 "[ . 1 . ]" 1
851 1 4 PRO HA 1 7 LEU HB2 . . 4.490 2.973 2.650 3.458 . 0 0 "[ . 1 . ]" 1
852 1 4 PRO HA 1 53 LEU QD . . 4.410 2.694 2.025 4.007 . 0 0 "[ . 1 . ]" 1
853 1 4 PRO HA 1 7 LEU H . . 4.930 4.206 3.679 4.652 . 0 0 "[ . 1 . ]" 1
854 1 4 PRO HA 1 8 GLN H . . 5.140 4.200 3.957 4.647 . 0 0 "[ . 1 . ]" 1
855 1 11 ARG QB 1 32 SER HB3 . . 5.120 3.604 2.820 5.206 0.086 14 0 "[ . 1 . ]" 1
856 1 32 SER HB3 1 33 PHE H . . 4.510 3.469 2.521 4.236 . 0 0 "[ . 1 . ]" 1
857 1 11 ARG QB 1 32 SER HB2 . . 4.780 3.985 3.123 5.009 0.229 4 0 "[ . 1 . ]" 1
858 1 16 SER QB 1 17 VAL H . . 3.990 2.898 2.316 3.552 . 0 0 "[ . 1 . ]" 1
859 1 16 SER QB 1 21 PRO HA . . 4.360 2.980 2.138 3.625 . 0 0 "[ . 1 . ]" 1
860 1 16 SER QB 1 22 VAL H . . 5.500 4.741 3.485 5.244 . 0 0 "[ . 1 . ]" 1
861 1 53 LEU QD 1 55 ASN H . . 4.670 2.698 1.987 3.658 . 0 0 "[ . 1 . ]" 1
862 1 53 LEU QD 1 54 SER H . . 3.780 2.406 1.830 3.160 . 0 0 "[ . 1 . ]" 1
863 1 53 LEU QD 1 92 VAL H . . 5.440 4.519 4.120 5.107 . 0 0 "[ . 1 . ]" 1
864 1 53 LEU QD 1 57 GLU H . . 4.240 2.695 2.160 3.255 . 0 0 "[ . 1 . ]" 1
865 1 53 LEU HA 1 53 LEU QD . . 3.380 2.190 2.044 2.479 . 0 0 "[ . 1 . ]" 1
866 1 53 LEU QD 1 57 GLU HA . . 5.500 4.221 3.705 4.806 . 0 0 "[ . 1 . ]" 1
867 1 3 THR HA 1 53 LEU QD . . 4.880 2.824 2.354 3.307 . 0 0 "[ . 1 . ]" 1
868 1 53 LEU QD 1 56 GLY HA2 . . 4.250 2.455 2.165 3.000 . 0 0 "[ . 1 . ]" 1
869 1 2 VAL MG1 1 53 LEU QD . . 3.400 2.122 1.918 2.348 . 0 0 "[ . 1 . ]" 1
870 1 53 LEU QD 1 56 GLY H . . 4.600 2.198 1.746 2.734 . 0 0 "[ . 1 . ]" 1
871 1 53 LEU QD 1 56 GLY HA3 . . 5.110 3.726 3.516 4.216 . 0 0 "[ . 1 . ]" 1
872 1 40 SER HA 1 48 SER QB . . 5.260 3.227 2.263 4.319 . 0 0 "[ . 1 . ]" 1
873 1 102 ALA H 1 102 ALA MB . . 3.250 2.625 2.381 2.772 . 0 0 "[ . 1 . ]" 1
874 1 102 ALA MB 1 107 THR HA . . 3.740 3.602 3.336 3.820 0.080 13 0 "[ . 1 . ]" 1
875 1 94 LEU QD 1 100 THR H . . 4.860 4.218 3.881 4.502 . 0 0 "[ . 1 . ]" 1
876 1 94 LEU QD 1 99 LEU H . . 4.750 3.220 2.954 3.636 . 0 0 "[ . 1 . ]" 1
877 1 94 LEU QD 1 98 GLN H . . 4.340 2.612 2.113 3.420 . 0 0 "[ . 1 . ]" 1
878 1 94 LEU QD 1 97 ASN HA . . 4.220 3.081 2.716 3.682 . 0 0 "[ . 1 . ]" 1
879 1 94 LEU QD 1 99 LEU HB2 . . 3.550 2.977 2.271 3.477 . 0 0 "[ . 1 . ]" 1
880 1 40 SER HB3 1 41 GLY H . . 4.120 3.535 2.773 4.483 0.363 10 0 "[ . 1 . ]" 1
881 1 40 SER HB2 1 41 GLY H . . 4.420 4.179 3.646 4.487 0.067 15 0 "[ . 1 . ]" 1
882 1 91 GLN H 1 102 ALA MB . . 4.730 3.774 3.340 4.829 0.099 1 0 "[ . 1 . ]" 1
883 1 91 GLN HB2 1 102 ALA MB . . 3.770 2.491 2.121 3.491 . 0 0 "[ . 1 . ]" 1
884 1 58 LEU H 1 58 LEU MD1 . . 4.780 4.292 4.013 4.431 . 0 0 "[ . 1 . ]" 1
885 1 58 LEU MD1 1 59 THR H . . 3.260 3.174 2.377 3.363 0.103 11 0 "[ . 1 . ]" 1
886 1 33 PHE QD 1 58 LEU MD1 . . 5.420 4.028 3.584 4.661 . 0 0 "[ . 1 . ]" 1
887 1 33 PHE QE 1 58 LEU MD1 . . 4.060 3.172 2.594 3.839 . 0 0 "[ . 1 . ]" 1
888 1 33 PHE HZ 1 58 LEU MD1 . . 5.500 4.588 4.001 4.974 . 0 0 "[ . 1 . ]" 1
889 1 58 LEU HA 1 58 LEU MD1 . . 3.200 2.166 2.026 2.271 . 0 0 "[ . 1 . ]" 1
890 1 51 GLY HA2 1 58 LEU MD1 . . 4.100 2.882 2.288 4.179 0.079 3 0 "[ . 1 . ]" 1
891 1 51 GLY HA3 1 58 LEU MD1 . . 4.130 2.569 2.040 3.681 . 0 0 "[ . 1 . ]" 1
892 1 58 LEU HB2 1 58 LEU MD1 . . 2.930 2.332 2.215 2.499 . 0 0 "[ . 1 . ]" 1
893 1 53 LEU QD 1 58 LEU MD1 . . 3.670 3.460 2.220 3.813 0.143 15 0 "[ . 1 . ]" 1
894 1 7 LEU MD1 1 58 LEU MD1 . . 4.640 3.894 2.967 4.400 . 0 0 "[ . 1 . ]" 1
895 1 103 THR MG 1 104 ALA H . . 4.290 2.029 1.770 3.305 . 0 0 "[ . 1 . ]" 1
896 1 85 MET HA 1 103 THR MG . . 3.370 2.193 1.982 2.403 . 0 0 "[ . 1 . ]" 1
897 1 85 MET QG 1 103 THR MG . . 3.620 3.120 2.827 3.306 . 0 0 "[ . 1 . ]" 1
898 1 85 MET QB 1 103 THR MG . . 3.180 3.071 2.142 3.211 0.031 10 0 "[ . 1 . ]" 1
899 1 78 LEU QD 1 81 THR H . . 4.960 4.339 3.974 4.776 . 0 0 "[ . 1 . ]" 1
900 1 78 LEU QD 1 82 ILE H . . 5.500 4.347 3.084 5.230 . 0 0 "[ . 1 . ]" 1
901 1 78 LEU HA 1 78 LEU QD . . 3.000 2.143 1.997 2.382 . 0 0 "[ . 1 . ]" 1
902 1 11 ARG H 1 112 LEU MD1 . . 4.040 3.884 2.948 4.139 0.099 14 0 "[ . 1 . ]" 1
903 1 112 LEU MD1 1 114 ASP H . . 4.290 4.068 3.546 4.392 0.102 19 0 "[ . 1 . ]" 1
904 1 12 PHE HZ 1 112 LEU MD1 . . 4.100 2.471 2.237 2.803 . 0 0 "[ . 1 . ]" 1
905 1 10 HIS HA 1 112 LEU MD1 . . 4.690 3.750 3.415 4.070 . 0 0 "[ . 1 . ]" 1
906 1 12 PHE HA 1 112 LEU MD1 . . 4.690 4.230 3.811 4.702 0.012 19 0 "[ . 1 . ]" 1
907 1 97 ASN HA 1 112 LEU MD1 . . 4.630 4.184 3.738 4.692 0.062 14 0 "[ . 1 . ]" 1
908 1 42 SER HB3 1 43 MET H . . 4.610 4.393 3.485 4.717 0.107 1 0 "[ . 1 . ]" 1
909 1 42 SER HB3 1 46 ARG QG . . 5.070 2.943 2.023 4.343 . 0 0 "[ . 1 . ]" 1
910 1 85 MET H 1 103 THR MG . . 5.130 4.734 4.525 4.959 . 0 0 "[ . 1 . ]" 1
911 1 103 THR MG 1 105 LYS H . . 4.650 3.177 2.803 3.664 . 0 0 "[ . 1 . ]" 1
912 1 103 THR MG 1 106 GLN H . . 5.060 4.598 4.133 4.922 . 0 0 "[ . 1 . ]" 1
913 1 78 LEU QD 1 79 ASP H . . 5.030 4.279 4.081 4.468 . 0 0 "[ . 1 . ]" 1
914 1 112 LEU H 1 112 LEU MD1 . . 4.560 4.170 3.967 4.298 . 0 0 "[ . 1 . ]" 1
915 1 112 LEU HA 1 112 LEU MD1 . . 3.180 2.190 2.100 2.282 . 0 0 "[ . 1 . ]" 1
916 1 10 HIS HB2 1 112 LEU MD1 . . 4.150 3.396 2.990 3.690 . 0 0 "[ . 1 . ]" 1
917 1 10 HIS HB3 1 112 LEU MD1 . . 3.440 2.223 2.076 2.459 . 0 0 "[ . 1 . ]" 1
918 1 112 LEU HB2 1 112 LEU MD1 . . 3.450 2.479 2.318 2.675 . 0 0 "[ . 1 . ]" 1
919 1 115 LEU H 1 115 LEU MD2 . . 4.590 2.639 1.740 3.382 . 0 0 "[ . 1 . ]" 1
920 1 115 LEU MD2 1 116 MET H . . 4.760 4.524 4.231 4.810 0.050 9 0 "[ . 1 . ]" 1
921 1 115 LEU HA 1 115 LEU MD2 . . 3.110 2.400 2.097 3.236 0.126 10 0 "[ . 1 . ]" 1
922 1 11 ARG QD 1 115 LEU MD2 . . 4.610 3.741 2.206 4.627 0.017 19 0 "[ . 1 . ]" 1
923 1 58 LEU H 1 92 VAL QG . . 3.750 2.743 2.344 3.117 . 0 0 "[ . 1 . ]" 1
924 1 91 GLN H 1 92 VAL QG . . 5.260 4.647 3.979 5.095 . 0 0 "[ . 1 . ]" 1
925 1 92 VAL QG 1 93 ASP H . . 3.580 3.043 2.698 3.477 . 0 0 "[ . 1 . ]" 1
926 1 92 VAL H 1 92 VAL QG . . 3.390 2.555 2.025 3.019 . 0 0 "[ . 1 . ]" 1
927 1 57 GLU H 1 92 VAL QG . . 5.500 4.007 2.837 5.186 . 0 0 "[ . 1 . ]" 1
928 1 58 LEU HA 1 92 VAL QG . . 5.390 3.727 3.331 4.073 . 0 0 "[ . 1 . ]" 1
929 1 91 GLN HA 1 92 VAL QG . . 4.210 3.594 3.364 3.922 . 0 0 "[ . 1 . ]" 1
930 1 56 GLY HA2 1 92 VAL QG . . 5.380 3.514 2.362 4.536 . 0 0 "[ . 1 . ]" 1
931 1 58 LEU HB2 1 92 VAL QG . . 3.060 2.101 1.905 2.245 . 0 0 "[ . 1 . ]" 1
932 1 53 LEU QD 1 92 VAL QG . . 3.800 2.396 1.867 3.200 . 0 0 "[ . 1 . ]" 1
933 1 7 LEU MD1 1 92 VAL QG . . 4.120 2.872 2.343 3.371 . 0 0 "[ . 1 . ]" 1
934 1 7 LEU MD2 1 8 GLN H . . 5.460 4.711 4.573 4.794 . 0 0 "[ . 1 . ]" 1
935 1 7 LEU MD2 1 33 PHE QD . . 4.120 3.570 2.781 4.222 0.102 15 0 "[ . 1 . ]" 1
936 1 7 LEU MD2 1 33 PHE QE . . 4.280 3.366 2.401 4.168 . 0 0 "[ . 1 . ]" 1
937 1 7 LEU HA 1 7 LEU MD2 . . 3.110 2.167 2.093 2.261 . 0 0 "[ . 1 . ]" 1
938 1 4 PRO HA 1 7 LEU MD2 . . 5.500 4.865 4.492 5.140 . 0 0 "[ . 1 . ]" 1
939 1 7 LEU MD2 1 33 PHE HB2 . . 5.280 4.636 3.537 5.179 . 0 0 "[ . 1 . ]" 1
940 1 6 GLN HB3 1 7 LEU MD2 . . 5.350 5.165 4.098 5.442 0.092 10 0 "[ . 1 . ]" 1
941 1 6 GLN HB2 1 7 LEU MD2 . . 5.260 4.254 3.529 4.591 . 0 0 "[ . 1 . ]" 1
942 1 7 LEU MD2 1 37 MET ME . . 4.880 4.238 3.756 4.968 0.088 9 0 "[ . 1 . ]" 1
943 1 6 GLN H 1 7 LEU MD2 . . 5.500 5.133 4.950 5.380 . 0 0 "[ . 1 . ]" 1
944 1 2 VAL H 1 2 VAL MG2 . . 3.830 3.584 2.195 3.923 0.093 3 0 "[ . 1 . ]" 1
945 1 2 VAL MG2 1 94 LEU H . . 3.670 2.652 1.859 3.478 . 0 0 "[ . 1 . ]" 1
946 1 2 VAL MG2 1 3 THR H . . 3.730 2.652 1.929 3.835 0.105 1 0 "[ . 1 . ]" 1
947 1 2 VAL MG2 1 6 GLN HE22 . . 4.960 3.448 2.615 4.853 . 0 0 "[ . 1 . ]" 1
948 1 2 VAL MG2 1 94 LEU HA . . 5.170 4.173 3.898 4.342 . 0 0 "[ . 1 . ]" 1
949 1 2 VAL HA 1 2 VAL MG2 . . 3.450 2.370 2.203 2.558 . 0 0 "[ . 1 . ]" 1
950 1 2 VAL MG2 1 53 LEU QD . . 5.500 2.506 1.997 4.155 . 0 0 "[ . 1 . ]" 1
951 1 2 VAL MG2 1 7 LEU MD2 . . 4.580 2.807 2.316 4.128 . 0 0 "[ . 1 . ]" 1
952 1 2 VAL MG2 1 7 LEU MD1 . . 4.230 2.509 1.973 4.340 0.110 15 0 "[ . 1 . ]" 1
953 1 73 PRO HA 1 76 ASN H . . 4.420 3.405 3.048 3.810 . 0 0 "[ . 1 . ]" 1
954 1 58 LEU HA 1 59 THR MG . . 5.500 4.409 4.108 4.620 . 0 0 "[ . 1 . ]" 1
955 1 58 LEU H 1 59 THR MG . . 5.500 4.421 3.925 4.755 . 0 0 "[ . 1 . ]" 1
956 1 59 THR H 1 59 THR MG . . 4.080 3.012 2.764 3.683 . 0 0 "[ . 1 . ]" 1
957 1 59 THR MG 1 60 ALA H . . 3.840 3.555 3.152 3.913 0.073 19 0 "[ . 1 . ]" 1
958 1 59 THR MG 1 89 GLY H . . 3.910 3.237 2.780 3.777 . 0 0 "[ . 1 . ]" 1
959 1 59 THR HA 1 59 THR MG . . 3.190 2.272 2.163 2.410 . 0 0 "[ . 1 . ]" 1
960 1 59 THR MG 1 89 GLY HA2 . . 3.180 2.047 1.961 2.170 . 0 0 "[ . 1 . ]" 1
961 1 92 VAL QG 1 100 THR H . . 5.040 4.438 3.905 4.893 . 0 0 "[ . 1 . ]" 1
962 1 92 VAL QG 1 94 LEU H . . 5.500 3.573 2.638 4.809 . 0 0 "[ . 1 . ]" 1
963 1 92 VAL QG 1 93 ASP HA . . 4.590 3.703 3.337 4.115 . 0 0 "[ . 1 . ]" 1
964 1 2 VAL MG2 1 92 VAL QG . . 3.500 2.597 2.134 3.484 . 0 0 "[ . 1 . ]" 1
965 1 24 SER HB3 1 25 ASP H . . 4.880 4.208 3.170 4.526 . 0 0 "[ . 1 . ]" 1
966 1 24 SER HB3 1 75 LEU QD . . 4.990 3.335 2.425 4.453 . 0 0 "[ . 1 . ]" 1
967 1 24 SER HB2 1 25 ASP H . . 4.830 4.316 3.282 4.668 . 0 0 "[ . 1 . ]" 1
968 1 60 ALA MB 1 61 LYS H . . 3.540 3.285 2.339 3.631 0.091 13 0 "[ . 1 . ]" 1
969 1 60 ALA H 1 60 ALA MB . . 3.450 2.511 2.048 2.890 . 0 0 "[ . 1 . ]" 1
970 1 60 ALA MB 1 86 LEU QD . . 3.360 2.192 1.999 2.704 . 0 0 "[ . 1 . ]" 1
971 1 81 THR MG 1 106 GLN HE22 . . 5.100 2.951 2.168 4.562 . 0 0 "[ . 1 . ]" 1
972 1 66 THR MG 1 68 MET H . . 5.390 5.090 4.144 5.484 0.094 7 0 "[ . 1 . ]" 1
973 1 66 THR MG 1 67 ARG H . . 3.860 3.761 3.620 3.950 0.090 3 0 "[ . 1 . ]" 1
974 1 66 THR H 1 66 THR MG . . 3.300 2.671 2.326 3.075 . 0 0 "[ . 1 . ]" 1
975 1 65 MET HA 1 66 THR MG . . 4.380 3.299 2.900 3.621 . 0 0 "[ . 1 . ]" 1
976 1 66 THR HA 1 66 THR MG . . 3.100 2.541 2.377 2.731 . 0 0 "[ . 1 . ]" 1
977 1 46 ARG QD 1 66 THR MG . . 4.810 4.092 2.381 4.935 0.125 3 0 "[ . 1 . ]" 1
978 1 3 THR MG 1 5 GLU H . . 5.010 4.313 4.097 4.606 . 0 0 "[ . 1 . ]" 1
979 1 3 THR H 1 3 THR MG . . 3.480 3.188 2.524 3.552 0.072 1 0 "[ . 1 . ]" 1
980 1 3 THR MG 1 6 GLN H . . 4.670 4.667 4.199 4.778 0.108 12 0 "[ . 1 . ]" 1
981 1 3 THR MG 1 6 GLN HE22 . . 5.400 5.019 4.009 5.490 0.090 16 0 "[ . 1 . ]" 1
982 1 3 THR HA 1 3 THR MG . . 2.950 2.258 2.112 2.436 . 0 0 "[ . 1 . ]" 1
983 1 3 THR MG 1 4 PRO HD2 . . 4.100 2.744 2.104 3.441 . 0 0 "[ . 1 . ]" 1
984 1 3 THR MG 1 4 PRO HD3 . . 4.190 3.649 2.586 4.274 0.084 10 0 "[ . 1 . ]" 1
985 1 3 THR MG 1 5 GLU HB2 . . 4.630 4.710 4.571 4.739 0.109 9 0 "[ . 1 . ]" 1
986 1 81 THR MG 1 106 GLN HE21 . . 4.960 2.419 1.660 3.300 . 0 0 "[ . 1 . ]" 1
987 1 81 THR MG 1 106 GLN HB2 . . 4.110 3.512 2.164 4.223 0.113 2 0 "[ . 1 . ]" 1
988 1 54 SER H 1 54 SER HB3 . . 3.930 3.003 2.635 3.343 . 0 0 "[ . 1 . ]" 1
989 1 53 LEU HA 1 54 SER HB3 . . 5.000 4.842 4.242 5.108 0.108 11 0 "[ . 1 . ]" 1
990 1 54 SER H 1 54 SER HB2 . . 3.970 3.173 2.556 3.450 . 0 0 "[ . 1 . ]" 1
991 1 109 THR MG 1 110 TYR H . . 3.590 3.014 2.421 3.659 0.069 2 0 "[ . 1 . ]" 1
992 1 16 SER H 1 109 THR MG . . 4.820 4.170 3.669 4.810 . 0 0 "[ . 1 . ]" 1
993 1 98 GLN HE21 1 109 THR MG . . 4.520 3.154 2.230 4.249 . 0 0 "[ . 1 . ]" 1
994 1 98 GLN HE22 1 109 THR MG . . 4.650 3.260 2.602 4.301 . 0 0 "[ . 1 . ]" 1
995 1 109 THR HA 1 109 THR MG . . 3.240 2.322 2.198 2.443 . 0 0 "[ . 1 . ]" 1
996 1 98 GLN HG3 1 109 THR MG . . 4.260 2.788 2.438 3.518 . 0 0 "[ . 1 . ]" 1
997 1 98 GLN HG2 1 109 THR MG . . 3.900 2.435 2.091 2.951 . 0 0 "[ . 1 . ]" 1
998 1 60 ALA MB 1 86 LEU HB3 . . 2.940 2.149 1.952 2.466 . 0 0 "[ . 1 . ]" 1
999 1 43 MET HA 1 75 LEU QD . . 4.400 3.803 3.061 4.147 . 0 0 "[ . 1 . ]" 1
1000 1 29 PRO HB3 1 75 LEU QD . . 4.670 3.106 2.337 3.568 . 0 0 "[ . 1 . ]" 1
1001 1 16 SER QB 1 109 THR MG . . 5.260 4.473 3.903 5.032 . 0 0 "[ . 1 . ]" 1
1002 1 100 THR H 1 100 THR MG . . 4.450 3.772 2.771 3.974 . 0 0 "[ . 1 . ]" 1
1003 1 100 THR MG 1 101 LEU H . . 3.470 3.072 2.698 3.340 . 0 0 "[ . 1 . ]" 1
1004 1 100 THR HA 1 100 THR MG . . 3.270 2.430 2.170 3.198 . 0 0 "[ . 1 . ]" 1
1005 1 107 THR HA 1 107 THR MG . . 3.160 3.188 2.208 3.256 0.096 18 0 "[ . 1 . ]" 1
1006 1 58 LEU HA 1 86 LEU QD . . 5.500 4.504 4.165 4.848 . 0 0 "[ . 1 . ]" 1
1007 1 14 LEU QD 1 110 TYR H . . 5.500 4.592 3.941 5.345 . 0 0 "[ . 1 . ]" 1
1008 1 14 LEU QD 1 109 THR H . . 3.870 2.876 2.412 3.334 . 0 0 "[ . 1 . ]" 1
1009 1 14 LEU QD 1 110 TYR HA . . 4.220 3.497 2.912 4.117 . 0 0 "[ . 1 . ]" 1
1010 1 14 LEU QD 1 108 LEU HA . . 4.070 3.451 2.887 3.800 . 0 0 "[ . 1 . ]" 1
1011 1 14 LEU QD 1 109 THR HB . . 5.500 4.341 4.048 4.977 . 0 0 "[ . 1 . ]" 1
1012 1 29 PRO HA 1 30 GLU H . . 3.110 2.401 2.101 2.591 . 0 0 "[ . 1 . ]" 1
1013 1 29 PRO HA 1 30 GLU HG2 . . 5.000 4.459 3.960 5.075 0.075 4 0 "[ . 1 . ]" 1
1014 1 18 ASN H 1 107 THR MG . . 4.580 4.330 3.755 4.684 0.104 6 0 "[ . 1 . ]" 1
1015 1 102 ALA HA 1 107 THR MG . . 4.130 4.073 2.361 4.235 0.105 8 0 "[ . 1 . ]" 1
1016 1 18 ASN HA 1 107 THR MG . . 4.210 2.999 2.118 3.799 . 0 0 "[ . 1 . ]" 1
1017 1 17 VAL MG2 1 18 ASN H . . 4.200 4.047 3.829 4.270 0.070 13 0 "[ . 1 . ]" 1
1018 1 17 VAL H 1 17 VAL MG2 . . 3.890 2.189 1.983 2.539 . 0 0 "[ . 1 . ]" 1
1019 1 17 VAL MG2 1 109 THR H . . 5.150 4.982 4.118 5.248 0.098 7 0 "[ . 1 . ]" 1
1020 1 16 SER HA 1 17 VAL MG2 . . 4.130 3.263 2.636 3.619 . 0 0 "[ . 1 . ]" 1
1021 1 17 VAL HA 1 17 VAL MG2 . . 3.430 2.583 2.251 2.757 . 0 0 "[ . 1 . ]" 1
1022 1 17 VAL MG2 1 22 VAL QG . . 3.340 2.251 1.879 2.815 . 0 0 "[ . 1 . ]" 1
1023 1 14 LEU QD 1 17 VAL MG2 . . 3.650 2.115 1.879 3.055 . 0 0 "[ . 1 . ]" 1
1024 1 58 LEU H 1 86 LEU QD . . 5.500 4.811 4.560 5.252 . 0 0 "[ . 1 . ]" 1
1025 1 86 LEU QD 1 89 GLY HA2 . . 5.460 4.470 3.828 4.972 . 0 0 "[ . 1 . ]" 1
1026 1 86 LEU QD 1 89 GLY H . . 5.460 4.552 4.291 4.856 . 0 0 "[ . 1 . ]" 1
1027 1 86 LEU QD 1 87 LYS H . . 5.280 4.105 3.970 4.186 . 0 0 "[ . 1 . ]" 1
1028 1 86 LEU HA 1 86 LEU QD . . 2.980 2.102 1.991 2.595 . 0 0 "[ . 1 . ]" 1
1029 1 58 LEU HG 1 86 LEU QD . . 3.650 2.377 2.049 3.469 . 0 0 "[ . 1 . ]" 1
1030 1 39 ILE MG 1 86 LEU QD . . 3.240 3.144 2.851 3.297 0.057 11 0 "[ . 1 . ]" 1
1031 1 95 THR H 1 95 THR MG . . 4.420 3.215 2.201 3.827 . 0 0 "[ . 1 . ]" 1
1032 1 23 THR MG 1 24 SER H . . 4.020 3.397 1.908 4.122 0.102 17 0 "[ . 1 . ]" 1
1033 1 95 THR MG 1 96 ALA MB . . 3.160 3.199 3.015 3.283 0.123 2 0 "[ . 1 . ]" 1
1034 1 13 VAL QG 1 28 PRO HD3 . . 4.890 4.522 3.937 4.995 0.105 12 0 "[ . 1 . ]" 1
1035 1 13 VAL QG 1 29 PRO HD2 . . 5.180 4.440 3.829 5.143 . 0 0 "[ . 1 . ]" 1
1036 1 13 VAL QG 1 31 ILE H . . 4.660 4.116 3.604 4.470 . 0 0 "[ . 1 . ]" 1
1037 1 13 VAL H 1 13 VAL QG . . 3.370 2.118 1.866 2.561 . 0 0 "[ . 1 . ]" 1
1038 1 13 VAL QG 1 14 LEU H . . 3.760 2.633 2.144 3.445 . 0 0 "[ . 1 . ]" 1
1039 1 11 ARG HE 1 13 VAL QG . . 5.470 4.012 2.584 4.894 . 0 0 "[ . 1 . ]" 1
1040 1 13 VAL QG 1 30 GLU HA . . 4.400 2.851 2.607 3.164 . 0 0 "[ . 1 . ]" 1
1041 1 12 PHE HA 1 13 VAL QG . . 4.470 3.273 2.622 3.864 . 0 0 "[ . 1 . ]" 1
1042 1 13 VAL QG 1 15 GLU HA . . 5.500 3.852 3.167 4.582 . 0 0 "[ . 1 . ]" 1
1043 1 11 ARG QD 1 13 VAL QG . . 5.280 3.895 2.438 4.850 . 0 0 "[ . 1 . ]" 1
1044 1 95 THR MG 1 96 ALA H . . 4.040 2.144 1.796 2.752 . 0 0 "[ . 1 . ]" 1
1045 1 95 THR MG 1 98 GLN HE21 . . 5.500 4.409 2.724 5.590 0.090 8 0 "[ . 1 . ]" 1
1046 1 94 LEU HA 1 95 THR MG . . 5.500 4.803 3.823 5.393 . 0 0 "[ . 1 . ]" 1
1047 1 2 VAL MG1 1 94 LEU H . . 5.060 2.950 2.328 4.570 . 0 0 "[ . 1 . ]" 1
1048 1 2 VAL MG1 1 3 THR HA . . 4.180 3.995 3.445 4.255 0.075 4 0 "[ . 1 . ]" 1
1049 1 2 VAL HA 1 2 VAL MG1 . . 3.560 3.203 2.545 3.286 . 0 0 "[ . 1 . ]" 1
1050 1 2 VAL MG1 1 56 GLY HA2 . . 4.350 2.895 2.048 3.778 . 0 0 "[ . 1 . ]" 1
1051 1 22 VAL QG 1 74 GLN HG2 . . 4.310 3.373 2.393 4.403 0.093 10 0 "[ . 1 . ]" 1
1052 1 2 VAL MG1 1 7 LEU MD1 . . 3.680 3.530 2.200 3.798 0.118 13 0 "[ . 1 . ]" 1
1053 1 58 LEU H 1 90 ALA MB . . 4.390 3.307 2.895 3.609 . 0 0 "[ . 1 . ]" 1
1054 1 101 LEU MD1 1 102 ALA H . . 3.750 3.398 2.844 4.358 0.608 13 1 "[ . 1 + . ]" 1
1055 1 90 ALA H 1 90 ALA MB . . 3.260 2.293 2.067 2.466 . 0 0 "[ . 1 . ]" 1
1056 1 85 MET QG 1 90 ALA MB . . 5.160 3.895 2.024 4.457 . 0 0 "[ . 1 . ]" 1
1057 1 85 MET QB 1 90 ALA MB . . 3.410 2.654 2.154 3.382 . 0 0 "[ . 1 . ]" 1
1058 1 22 VAL QG 1 23 THR H . . 3.760 2.271 1.904 2.849 . 0 0 "[ . 1 . ]" 1
1059 1 22 VAL H 1 22 VAL QG . . 3.360 2.423 2.072 2.751 . 0 0 "[ . 1 . ]" 1
1060 1 22 VAL QG 1 74 GLN HE21 . . 4.650 3.113 2.077 3.907 . 0 0 "[ . 1 . ]" 1
1061 1 22 VAL QG 1 74 GLN HE22 . . 4.520 2.932 2.414 3.557 . 0 0 "[ . 1 . ]" 1
1062 1 86 LEU H 1 90 ALA MB . . 5.500 4.469 3.777 5.292 . 0 0 "[ . 1 . ]" 1
1063 1 86 LEU QD 1 90 ALA MB . . 4.260 2.579 2.007 3.562 . 0 0 "[ . 1 . ]" 1
1064 1 89 GLY H 1 90 ALA MB . . 5.500 4.227 3.674 4.781 . 0 0 "[ . 1 . ]" 1
1065 1 89 GLY HA2 1 90 ALA MB . . 4.860 4.029 3.672 4.230 . 0 0 "[ . 1 . ]" 1
1066 1 13 VAL QG 1 111 LYS H . . 4.220 3.083 2.589 4.102 . 0 0 "[ . 1 . ]" 1
1067 1 13 VAL QG 1 113 ALA HA . . 5.160 4.267 3.929 4.694 . 0 0 "[ . 1 . ]" 1
1068 1 13 VAL QG 1 110 TYR HB3 . . 5.370 4.340 3.899 4.842 . 0 0 "[ . 1 . ]" 1
1069 1 17 VAL H 1 22 VAL QG . . 4.150 3.715 2.878 4.249 0.099 11 0 "[ . 1 . ]" 1
1070 1 16 SER HA 1 22 VAL QG . . 3.780 3.337 2.244 3.871 0.091 15 0 "[ . 1 . ]" 1
1071 1 21 PRO HA 1 22 VAL QG . . 3.920 3.427 2.833 3.980 0.060 19 0 "[ . 1 . ]" 1
1072 1 66 THR HA 1 67 ARG H . . 2.950 2.798 2.588 2.948 . 0 0 "[ . 1 . ]" 1
1073 1 66 THR HA 1 67 ARG QG . . 4.230 3.791 3.323 4.178 . 0 0 "[ . 1 . ]" 1
1074 1 83 SER HB3 1 84 GLU H . . 3.760 2.913 2.306 3.753 . 0 0 "[ . 1 . ]" 1
1075 1 83 SER H 1 83 SER HB3 . . 3.460 2.962 2.370 3.511 0.051 6 0 "[ . 1 . ]" 1
1076 1 80 ASN HA 1 83 SER HB3 . . 4.070 3.256 2.451 4.147 0.077 12 0 "[ . 1 . ]" 1
1077 1 65 MET ME 1 83 SER HB3 . . 4.990 4.378 2.420 5.090 0.100 10 0 "[ . 1 . ]" 1
1078 1 83 SER HB2 1 84 GLU H . . 3.680 3.323 2.513 3.764 0.084 3 0 "[ . 1 . ]" 1
1079 1 13 VAL QG 1 14 LEU HA . . 5.500 4.151 3.757 4.678 . 0 0 "[ . 1 . ]" 1
1080 1 22 VAL QG 1 24 SER H . . 4.710 3.940 2.557 4.813 0.103 7 0 "[ . 1 . ]" 1
1081 1 22 VAL QG 1 29 PRO HD3 . . 4.930 3.013 2.332 3.939 . 0 0 "[ . 1 . ]" 1
1082 1 22 VAL QG 1 24 SER HB2 . . 4.750 3.887 2.411 4.846 0.096 12 0 "[ . 1 . ]" 1
1083 1 22 VAL QG 1 29 PRO HD2 . . 4.280 2.770 2.071 3.461 . 0 0 "[ . 1 . ]" 1
1084 1 17 VAL H 1 21 PRO HA . . 4.100 2.915 2.518 3.415 . 0 0 "[ . 1 . ]" 1
1085 1 21 PRO HA 1 22 VAL H . . 2.830 2.467 2.330 2.630 . 0 0 "[ . 1 . ]" 1
1086 1 83 SER HB3 1 84 GLU QB . . 5.140 4.214 3.471 5.359 0.219 19 0 "[ . 1 . ]" 1
1087 1 80 ASN HA 1 83 SER HB2 . . 4.070 3.038 2.164 4.143 0.073 18 0 "[ . 1 . ]" 1
1088 1 63 LEU QD 1 83 SER HB2 . . 4.470 3.348 2.182 4.537 0.067 12 0 "[ . 1 . ]" 1
1089 1 82 ILE MG 1 83 SER HB2 . . 4.940 3.626 3.035 4.538 . 0 0 "[ . 1 . ]" 1
1090 1 43 MET ME 1 82 ILE H . . 4.110 3.514 3.047 3.859 . 0 0 "[ . 1 . ]" 1
1091 1 43 MET ME 1 43 MET HG2 . . 3.730 2.868 2.569 3.363 . 0 0 "[ . 1 . ]" 1
1092 1 43 MET ME 1 43 MET HG3 . . 3.440 2.284 2.214 2.406 . 0 0 "[ . 1 . ]" 1
1093 1 43 MET ME 1 82 ILE MD . . 3.310 2.411 2.076 3.051 . 0 0 "[ . 1 . ]" 1
1094 1 43 MET ME 1 47 PHE QE . . 5.300 3.996 2.890 4.523 . 0 0 "[ . 1 . ]" 1
1095 1 43 MET ME 1 78 LEU HA . . 3.950 3.894 3.463 4.039 0.089 11 0 "[ . 1 . ]" 1
1096 1 64 ALA H 1 64 ALA MB . . 3.170 2.352 2.175 2.732 . 0 0 "[ . 1 . ]" 1
1097 1 48 SER H 1 64 ALA MB . . 4.050 3.620 2.990 4.114 0.064 17 0 "[ . 1 . ]" 1
1098 1 64 ALA MB 1 65 MET H . . 3.560 3.184 2.404 3.636 0.076 16 0 "[ . 1 . ]" 1
1099 1 47 PHE HA 1 64 ALA MB . . 5.040 4.303 3.575 4.617 . 0 0 "[ . 1 . ]" 1
1100 1 64 ALA MB 1 65 MET HA . . 4.780 4.186 3.825 4.384 . 0 0 "[ . 1 . ]" 1
1101 1 63 LEU HA 1 64 ALA MB . . 4.340 4.038 3.703 4.303 . 0 0 "[ . 1 . ]" 1
1102 1 48 SER QB 1 64 ALA MB . . 4.470 3.624 2.557 4.200 . 0 0 "[ . 1 . ]" 1
1103 1 47 PHE QB 1 64 ALA MB . . 5.500 5.027 4.456 5.283 . 0 0 "[ . 1 . ]" 1
1104 1 48 SER HA 1 64 ALA MB . . 5.470 5.253 4.859 5.552 0.082 2 0 "[ . 1 . ]" 1
1105 1 109 THR HA 1 110 TYR H . . 2.960 2.184 2.102 2.308 . 0 0 "[ . 1 . ]" 1
1106 1 101 LEU H 1 109 THR HA . . 4.330 3.696 3.233 4.367 0.037 19 0 "[ . 1 . ]" 1
1107 1 2 VAL HA 1 3 THR H . . 2.730 2.340 2.217 2.567 . 0 0 "[ . 1 . ]" 1
1108 1 2 VAL HA 1 6 GLN HE22 . . 4.750 2.679 2.051 4.265 . 0 0 "[ . 1 . ]" 1
1109 1 13 VAL H 1 113 ALA MB . . 3.860 3.696 3.119 3.959 0.099 18 0 "[ . 1 . ]" 1
1110 1 113 ALA H 1 113 ALA MB . . 3.480 2.384 2.218 2.744 . 0 0 "[ . 1 . ]" 1
1111 1 113 ALA MB 1 114 ASP H . . 4.140 3.660 3.495 3.748 . 0 0 "[ . 1 . ]" 1
1112 1 11 ARG HE 1 113 ALA MB . . 5.500 5.222 3.319 5.602 0.102 17 0 "[ . 1 . ]" 1
1113 1 13 VAL HB 1 113 ALA MB . . 4.020 3.556 2.913 4.118 0.098 18 0 "[ . 1 . ]" 1
1114 1 13 VAL QG 1 113 ALA MB . . 3.110 1.954 1.846 2.175 . 0 0 "[ . 1 . ]" 1
1115 1 111 LYS H 1 113 ALA MB . . 5.500 4.638 4.168 5.001 . 0 0 "[ . 1 . ]" 1
1116 1 13 VAL HA 1 113 ALA MB . . 5.500 5.104 4.753 5.498 . 0 0 "[ . 1 . ]" 1
1117 1 11 ARG QD 1 113 ALA MB . . 4.710 4.098 3.415 4.829 0.119 1 0 "[ . 1 . ]" 1
1118 1 31 ILE HA 1 32 SER H . . 3.100 2.297 2.049 2.468 . 0 0 "[ . 1 . ]" 1
1119 1 31 ILE HA 1 41 GLY HA3 . . 3.400 2.795 2.277 3.478 0.078 15 0 "[ . 1 . ]" 1
1120 1 23 THR HA 1 24 SER H . . 2.860 2.234 1.926 2.530 . 0 0 "[ . 1 . ]" 1
1121 1 23 THR HA 1 23 THR HB . . 2.950 2.749 2.345 3.020 0.070 7 0 "[ . 1 . ]" 1
1122 1 23 THR HA 1 23 THR MG . . 3.550 2.277 2.120 3.255 . 0 0 "[ . 1 . ]" 1
1123 1 22 VAL QG 1 23 THR HA . . 4.820 3.602 3.310 4.166 . 0 0 "[ . 1 . ]" 1
1124 1 17 VAL MG1 1 18 ASN H . . 4.020 2.016 1.651 2.287 . 0 0 "[ . 1 . ]" 1
1125 1 17 VAL MG1 1 20 LYS H . . 5.330 3.807 3.321 4.673 . 0 0 "[ . 1 . ]" 1
1126 1 17 VAL MG1 1 74 GLN HE21 . . 3.910 3.609 3.206 3.992 0.082 6 0 "[ . 1 . ]" 1
1127 1 17 VAL MG1 1 106 GLN HE21 . . 4.460 3.523 2.389 4.487 0.027 15 0 "[ . 1 . ]" 1
1128 1 17 VAL MG1 1 74 GLN HE22 . . 4.720 4.635 3.579 4.827 0.107 18 0 "[ . 1 . ]" 1
1129 1 17 VAL MG1 1 108 LEU HA . . 4.490 4.005 3.291 4.570 0.080 7 0 "[ . 1 . ]" 1
1130 1 17 VAL HA 1 17 VAL MG1 . . 3.470 2.381 2.224 2.582 . 0 0 "[ . 1 . ]" 1
1131 1 17 VAL MG1 1 18 ASN HB3 . . 4.350 3.046 2.475 3.664 . 0 0 "[ . 1 . ]" 1
1132 1 17 VAL MG1 1 74 GLN HG3 . . 5.500 4.656 4.099 5.210 . 0 0 "[ . 1 . ]" 1
1133 1 107 THR HA 1 108 LEU H . . 2.920 2.306 2.193 2.457 . 0 0 "[ . 1 . ]" 1
1134 1 103 THR H 1 107 THR HA . . 4.290 3.771 3.476 4.168 . 0 0 "[ . 1 . ]" 1
1135 1 102 ALA HA 1 107 THR HA . . 3.230 2.221 2.063 2.413 . 0 0 "[ . 1 . ]" 1
1136 1 28 PRO HA 1 29 PRO HD3 . . 3.000 2.488 2.320 2.718 . 0 0 "[ . 1 . ]" 1
1137 1 100 THR HA 1 110 TYR H . . 4.370 3.940 3.486 4.279 . 0 0 "[ . 1 . ]" 1
1138 1 100 THR HA 1 101 LEU H . . 2.870 2.221 2.109 2.334 . 0 0 "[ . 1 . ]" 1
1139 1 100 THR HA 1 109 THR HA . . 3.510 2.938 2.292 3.576 0.066 12 0 "[ . 1 . ]" 1
1140 1 100 THR HA 1 101 LEU HB2 . . 5.320 4.362 4.133 4.648 . 0 0 "[ . 1 . ]" 1
1141 1 95 THR HA 1 96 ALA H . . 3.140 2.733 2.458 3.006 . 0 0 "[ . 1 . ]" 1
1142 1 95 THR HA 1 96 ALA MB . . 4.730 4.399 4.223 4.554 . 0 0 "[ . 1 . ]" 1
1143 1 95 THR HA 1 95 THR MG . . 3.480 2.628 2.172 3.285 . 0 0 "[ . 1 . ]" 1
1144 1 83 SER HA 1 85 MET H . . 5.320 4.439 3.981 4.758 . 0 0 "[ . 1 . ]" 1
1145 1 65 MET ME 1 83 SER HA . . 5.500 4.230 3.050 4.939 . 0 0 "[ . 1 . ]" 1
1146 1 83 SER HA 1 86 LEU HB2 . . 4.190 3.384 2.916 3.934 . 0 0 "[ . 1 . ]" 1
1147 1 83 SER HA 1 86 LEU HB3 . . 5.090 4.906 4.385 5.172 0.082 3 0 "[ . 1 . ]" 1
1148 1 94 LEU HA 1 95 THR HA . . 4.890 4.418 4.366 4.469 . 0 0 "[ . 1 . ]" 1
1149 1 22 VAL HA 1 23 THR H . . 2.790 2.353 2.173 2.543 . 0 0 "[ . 1 . ]" 1
1150 1 22 VAL HA 1 74 GLN HE21 . . 4.820 4.248 3.527 4.750 . 0 0 "[ . 1 . ]" 1
1151 1 22 VAL HA 1 74 GLN HE22 . . 3.990 2.993 2.473 3.939 . 0 0 "[ . 1 . ]" 1
1152 1 17 VAL MG2 1 22 VAL HA . . 4.860 4.203 3.270 4.950 0.090 5 0 "[ . 1 . ]" 1
1153 1 22 VAL HA 1 22 VAL QG . . 3.320 2.233 2.099 2.372 . 0 0 "[ . 1 . ]" 1
1154 1 82 ILE HA 1 85 MET QG . . 4.490 3.430 2.054 4.009 . 0 0 "[ . 1 . ]" 1
1155 1 81 THR MG 1 82 ILE HA . . 4.600 3.490 3.017 3.893 . 0 0 "[ . 1 . ]" 1
1156 1 82 ILE HA 1 108 LEU QD . . 4.390 3.990 3.450 4.318 . 0 0 "[ . 1 . ]" 1
1157 1 82 ILE HA 1 86 LEU H . . 4.610 4.014 3.647 4.566 . 0 0 "[ . 1 . ]" 1
1158 1 39 ILE HA 1 40 SER HB2 . . 5.060 4.761 4.405 5.711 0.651 10 2 "[ . + - . ]" 1
1159 1 39 ILE HA 1 40 SER H . . 2.980 2.219 2.165 2.290 . 0 0 "[ . 1 . ]" 1
1160 1 33 PHE HA 1 39 ILE HA . . 3.670 2.695 2.288 3.070 . 0 0 "[ . 1 . ]" 1
1161 1 34 GLY H 1 39 ILE HA . . 4.460 4.279 3.571 4.523 0.063 10 0 "[ . 1 . ]" 1
1162 1 92 VAL HA 1 101 LEU MD1 . . 4.870 3.086 2.282 3.945 . 0 0 "[ . 1 . ]" 1
1163 1 33 PHE QD 1 39 ILE HA . . 4.950 2.789 2.327 3.511 . 0 0 "[ . 1 . ]" 1
1164 1 39 ILE HA 1 39 ILE HG13 . . 4.110 3.268 2.717 3.432 . 0 0 "[ . 1 . ]" 1
1165 1 39 ILE HA 1 39 ILE HG12 . . 3.820 2.846 2.578 3.070 . 0 0 "[ . 1 . ]" 1
1166 1 39 ILE HA 1 49 GLY H . . 4.830 4.792 4.457 4.911 0.081 5 0 "[ . 1 . ]" 1
1167 1 82 ILE H 1 82 ILE MG . . 3.320 2.295 2.154 2.503 . 0 0 "[ . 1 . ]" 1
1168 1 82 ILE MG 1 84 GLU H . . 5.460 4.636 4.367 4.889 . 0 0 "[ . 1 . ]" 1
1169 1 82 ILE MG 1 83 SER H . . 3.220 2.365 2.231 2.486 . 0 0 "[ . 1 . ]" 1
1170 1 79 ASP HA 1 82 ILE MG . . 3.580 2.629 2.068 3.654 0.074 9 0 "[ . 1 . ]" 1
1171 1 82 ILE MG 1 83 SER HA . . 4.110 3.249 2.984 3.576 . 0 0 "[ . 1 . ]" 1
1172 1 43 MET HB2 1 82 ILE MG . . 5.150 3.159 2.502 3.914 . 0 0 "[ . 1 . ]" 1
1173 1 43 MET HG2 1 82 ILE MG . . 4.030 2.410 2.165 3.025 . 0 0 "[ . 1 . ]" 1
1174 1 43 MET HG3 1 82 ILE MG . . 3.950 2.223 2.054 2.425 . 0 0 "[ . 1 . ]" 1
1175 1 43 MET ME 1 82 ILE MG . . 4.190 3.082 2.488 3.551 . 0 0 "[ . 1 . ]" 1
1176 1 82 ILE MG 1 86 LEU HG . . 5.340 4.456 3.879 5.452 0.112 12 0 "[ . 1 . ]" 1
1177 1 13 VAL HA 1 110 TYR HB3 . . 5.100 4.551 3.678 5.139 0.039 11 0 "[ . 1 . ]" 1
1178 1 11 ARG QG 1 13 VAL HA . . 5.370 4.560 4.267 5.268 . 0 0 "[ . 1 . ]" 1
1179 1 92 VAL HA 1 93 ASP H . . 2.850 2.129 2.051 2.190 . 0 0 "[ . 1 . ]" 1
1180 1 92 VAL HA 1 101 LEU MD2 . . 3.410 2.696 1.931 4.394 0.984 13 2 "[ - . 1 + . ]" 1
1181 1 91 GLN HB3 1 92 VAL HA . . 5.060 4.713 4.512 5.102 0.042 1 0 "[ . 1 . ]" 1
1182 1 71 ALA MB 1 72 ASN H . . 3.680 3.379 2.703 3.757 0.077 12 0 "[ . 1 . ]" 1
1183 1 70 CYS HB3 1 71 ALA MB . . 5.500 4.673 3.888 5.645 0.145 14 0 "[ . 1 . ]" 1
1184 1 71 ALA MB 1 72 ASN QB . . 4.560 3.887 3.203 4.613 0.053 18 0 "[ . 1 . ]" 1
1185 1 79 ASP H 1 82 ILE MG . . 5.500 4.564 4.256 5.034 . 0 0 "[ . 1 . ]" 1
1186 1 13 VAL HA 1 31 ILE H . . 4.370 3.177 2.915 3.432 . 0 0 "[ . 1 . ]" 1
1187 1 13 VAL HA 1 14 LEU H . . 3.010 2.266 2.068 2.422 . 0 0 "[ . 1 . ]" 1
1188 1 13 VAL HA 1 14 LEU HB2 . . 4.940 4.448 4.095 4.675 . 0 0 "[ . 1 . ]" 1
1189 1 13 VAL HA 1 30 GLU HB2 . . 4.220 2.777 2.644 2.914 . 0 0 "[ . 1 . ]" 1
1190 1 104 ALA H 1 104 ALA MB . . 3.060 2.231 2.172 2.289 . 0 0 "[ . 1 . ]" 1
1191 1 104 ALA MB 1 105 LYS H . . 3.570 2.755 2.400 3.244 . 0 0 "[ . 1 . ]" 1
1192 1 104 ALA MB 1 106 GLN H . . 5.310 5.198 5.022 5.355 0.045 16 0 "[ . 1 . ]" 1
1193 1 103 THR HB 1 104 ALA MB . . 4.370 4.057 3.466 4.341 . 0 0 "[ . 1 . ]" 1
1194 1 104 ALA MB 1 105 LYS HA . . 4.560 3.951 3.598 4.190 . 0 0 "[ . 1 . ]" 1
1195 1 104 ALA MB 1 105 LYS QE . . 5.500 4.959 4.056 5.617 0.117 1 0 "[ . 1 . ]" 1
1196 1 17 VAL HA 1 108 LEU HA . . 3.330 2.847 2.396 3.360 0.030 7 0 "[ . 1 . ]" 1
1197 1 17 VAL HA 1 18 ASN H . . 3.110 2.503 2.351 2.784 . 0 0 "[ . 1 . ]" 1
1198 1 85 MET HA 1 103 THR HB . . 4.780 3.174 2.684 3.704 . 0 0 "[ . 1 . ]" 1
1199 1 85 MET HA 1 85 MET QG . . 3.500 2.443 2.251 3.302 . 0 0 "[ . 1 . ]" 1
1200 1 85 MET HA 1 90 ALA MB . . 4.840 4.015 3.504 4.623 . 0 0 "[ . 1 . ]" 1
1201 1 17 VAL HA 1 18 ASN HA . . 4.810 4.423 4.256 4.573 . 0 0 "[ . 1 . ]" 1
1202 1 5 GLU HA 1 8 GLN HB3 . . 5.180 4.682 3.894 5.235 0.055 9 0 "[ . 1 . ]" 1
1203 1 5 GLU HA 1 8 GLN HE21 . . 4.580 2.548 1.870 3.642 . 0 0 "[ . 1 . ]" 1
1204 1 5 GLU HA 1 8 GLN HE22 . . 4.600 3.272 2.594 4.365 . 0 0 "[ . 1 . ]" 1
1205 1 5 GLU HA 1 5 GLU HG2 . . 3.940 2.598 2.082 3.517 . 0 0 "[ . 1 . ]" 1
1206 1 5 GLU HA 1 5 GLU HG3 . . 3.310 2.753 2.206 3.535 0.225 2 0 "[ . 1 . ]" 1
1207 1 103 THR HA 1 104 ALA H . . 3.440 2.602 2.420 2.889 . 0 0 "[ . 1 . ]" 1
1208 1 103 THR HA 1 103 THR MG . . 3.390 2.145 2.042 2.272 . 0 0 "[ . 1 . ]" 1
1209 1 5 GLU HA 1 8 GLN H . . 3.970 3.767 3.514 4.047 0.077 15 0 "[ . 1 . ]" 1
1210 1 5 GLU HA 1 5 GLU HB2 . . 2.780 2.682 2.521 2.872 0.092 5 0 "[ . 1 . ]" 1
1211 1 39 ILE MG 1 49 GLY H . . 5.500 4.085 2.861 4.613 . 0 0 "[ . 1 . ]" 1
1212 1 39 ILE MG 1 40 SER H . . 3.550 2.700 2.434 3.223 . 0 0 "[ . 1 . ]" 1
1213 1 39 ILE MG 1 41 GLY H . . 5.500 4.139 3.579 4.816 . 0 0 "[ . 1 . ]" 1
1214 1 33 PHE QD 1 39 ILE MG . . 4.570 3.170 2.716 4.426 . 0 0 "[ . 1 . ]" 1
1215 1 39 ILE MG 1 48 SER HA . . 4.460 3.803 2.168 4.540 0.080 9 0 "[ . 1 . ]" 1
1216 1 39 ILE MG 1 40 SER HA . . 4.370 3.668 3.259 4.144 . 0 0 "[ . 1 . ]" 1
1217 1 39 ILE HA 1 39 ILE MG . . 3.560 2.321 2.238 2.735 . 0 0 "[ . 1 . ]" 1
1218 1 39 ILE MG 1 51 GLY HA3 . . 4.930 4.908 4.677 5.234 0.304 8 0 "[ . 1 . ]" 1
1219 1 59 THR HA 1 90 ALA H . . 4.830 3.561 3.314 4.188 . 0 0 "[ . 1 . ]" 1
1220 1 59 THR HA 1 60 ALA H . . 2.980 2.299 2.131 2.557 . 0 0 "[ . 1 . ]" 1
1221 1 59 THR HA 1 89 GLY H . . 4.730 3.919 3.268 4.579 . 0 0 "[ . 1 . ]" 1
1222 1 59 THR HA 1 89 GLY HA2 . . 4.320 2.673 2.132 2.987 . 0 0 "[ . 1 . ]" 1
1223 1 58 LEU HG 1 59 THR HA . . 4.800 4.299 3.612 4.731 . 0 0 "[ . 1 . ]" 1
1224 1 68 MET ME 1 69 MET H . . 5.030 4.557 3.042 5.132 0.102 11 0 "[ . 1 . ]" 1
1225 1 66 THR MG 1 68 MET ME . . 5.000 3.348 2.120 5.128 0.128 9 0 "[ . 1 . ]" 1
1226 1 46 ARG QD 1 68 MET ME . . 5.500 4.452 2.293 5.605 0.105 11 0 "[ . 1 . ]" 1
1227 1 77 GLU HA 1 80 ASN HD21 . . 4.330 3.671 2.466 4.682 0.352 17 0 "[ . 1 . ]" 1
1228 1 77 GLU HA 1 80 ASN H . . 4.230 3.689 3.033 4.273 0.043 11 0 "[ . 1 . ]" 1
1229 1 77 GLU HA 1 77 GLU HG2 . . 3.810 2.721 2.159 3.888 0.078 14 0 "[ . 1 . ]" 1
1230 1 46 ARG H 1 68 MET ME . . 5.290 4.012 3.060 5.378 0.088 11 0 "[ . 1 . ]" 1
1231 1 45 ASN HA 1 68 MET ME . . 4.080 3.101 2.046 4.165 0.085 4 0 "[ . 1 . ]" 1
1232 1 85 MET ME 1 106 GLN HE21 . . 5.500 5.284 4.279 5.612 0.112 19 0 "[ . 1 . ]" 1
1233 1 82 ILE HA 1 85 MET ME . . 4.920 4.457 4.134 4.888 . 0 0 "[ . 1 . ]" 1
1234 1 85 MET ME 1 108 LEU H . . 3.480 3.387 2.985 3.578 0.098 13 0 "[ . 1 . ]" 1
1235 1 85 MET ME 1 103 THR H . . 3.380 3.131 2.124 3.484 0.104 12 0 "[ . 1 . ]" 1
1236 1 85 MET ME 1 102 ALA H . . 4.110 3.924 3.416 4.195 0.085 15 0 "[ . 1 . ]" 1
1237 1 85 MET ME 1 107 THR H . . 5.280 4.260 3.406 4.922 . 0 0 "[ . 1 . ]" 1
1238 1 85 MET H 1 85 MET ME . . 4.790 4.878 4.848 4.898 0.108 19 0 "[ . 1 . ]" 1
1239 1 85 MET ME 1 106 GLN H . . 4.510 3.044 2.304 3.654 . 0 0 "[ . 1 . ]" 1
1240 1 85 MET ME 1 102 ALA HA . . 3.210 3.208 2.828 3.326 0.116 1 0 "[ . 1 . ]" 1
1241 1 85 MET ME 1 107 THR HA . . 3.490 2.843 2.379 3.322 . 0 0 "[ . 1 . ]" 1
1242 1 85 MET ME 1 103 THR HB . . 3.830 3.110 2.436 3.936 0.106 15 0 "[ . 1 . ]" 1
1243 1 85 MET HA 1 85 MET ME . . 4.130 4.030 3.820 4.200 0.070 19 0 "[ . 1 . ]" 1
1244 1 85 MET ME 1 85 MET QG . . 3.470 2.303 2.110 2.539 . 0 0 "[ . 1 . ]" 1
1245 1 85 MET ME 1 103 THR MG . . 3.850 3.614 2.073 3.808 . 0 0 "[ . 1 . ]" 1
1246 1 85 MET ME 1 90 ALA MB . . 3.450 2.934 2.014 3.537 0.087 15 0 "[ . 1 . ]" 1
1247 1 85 MET ME 1 108 LEU QD . . 3.920 2.324 1.894 2.844 . 0 0 "[ . 1 . ]" 1
1248 1 85 MET ME 1 101 LEU MD2 . . 4.390 4.289 2.107 5.365 0.975 7 4 "[ * - +* 1 . ]" 1
1249 1 69 MET ME 1 70 CYS H . . 4.880 4.882 4.522 4.993 0.113 1 0 "[ . 1 . ]" 1
1250 1 69 MET H 1 69 MET ME . . 5.360 2.971 2.224 4.010 . 0 0 "[ . 1 . ]" 1
1251 1 69 MET ME 1 76 ASN HD22 . . 4.650 4.354 2.980 4.759 0.109 9 0 "[ . 1 . ]" 1
1252 1 45 ASN H 1 65 MET ME . . 4.590 3.704 3.094 4.205 . 0 0 "[ . 1 . ]" 1
1253 1 45 ASN QD 1 65 MET ME . . 5.350 4.669 4.017 5.189 . 0 0 "[ . 1 . ]" 1
1254 1 48 SER H 1 65 MET ME . . 5.460 5.183 4.768 5.422 . 0 0 "[ . 1 . ]" 1
1255 1 47 PHE H 1 65 MET ME . . 4.670 4.668 4.393 4.773 0.103 17 0 "[ . 1 . ]" 1
1256 1 65 MET ME 1 66 THR H . . 4.700 4.212 3.712 4.806 0.106 7 0 "[ . 1 . ]" 1
1257 1 46 ARG H 1 65 MET ME . . 5.500 4.487 4.058 4.730 . 0 0 "[ . 1 . ]" 1
1258 1 65 MET ME 1 80 ASN H . . 5.310 4.722 4.390 4.975 . 0 0 "[ . 1 . ]" 1
1259 1 47 PHE HA 1 65 MET ME . . 4.300 3.862 3.744 4.143 . 0 0 "[ . 1 . ]" 1
1260 1 65 MET HA 1 65 MET ME . . 4.330 3.978 3.603 4.390 0.060 17 0 "[ . 1 . ]" 1
1261 1 65 MET ME 1 79 ASP HA . . 3.250 2.337 2.071 2.679 . 0 0 "[ . 1 . ]" 1
1262 1 65 MET ME 1 83 SER HB2 . . 3.650 3.508 2.918 4.530 0.880 18 1 "[ . 1 . + ]" 1
1263 1 65 MET ME 1 82 ILE MG . . 3.120 2.505 2.046 3.206 0.086 9 0 "[ . 1 . ]" 1
1264 1 96 ALA MB 1 97 ASN H . . 3.100 2.771 2.454 3.196 0.096 4 0 "[ . 1 . ]" 1
1265 1 96 ALA MB 1 97 ASN HA . . 4.900 4.419 4.270 4.607 . 0 0 "[ . 1 . ]" 1
1266 1 96 ALA MB 1 97 ASN HB2 . . 5.330 4.974 4.582 5.401 0.071 18 0 "[ . 1 . ]" 1
1267 1 60 ALA H 1 87 LYS HA . . 4.390 3.499 3.033 3.943 . 0 0 "[ . 1 . ]" 1
1268 1 59 THR MG 1 87 LYS HA . . 5.250 4.420 3.942 4.773 . 0 0 "[ . 1 . ]" 1
1269 1 38 MET H 1 38 MET ME . . 5.230 4.986 4.599 5.349 0.119 2 0 "[ . 1 . ]" 1
1270 1 116 MET ME 1 117 ASN HB2 . . 4.130 3.537 2.049 5.102 0.972 6 2 "[ .+ 1 .- ]" 1
1271 1 38 MET ME 1 49 GLY HA2 . . 4.650 3.270 2.541 3.912 . 0 0 "[ . 1 . ]" 1
1272 1 116 MET ME 1 117 ASN HA . . 4.100 3.953 3.225 4.195 0.095 15 0 "[ . 1 . ]" 1
1273 1 74 GLN HA 1 74 GLN HG3 . . 3.590 2.499 2.298 2.801 . 0 0 "[ . 1 . ]" 1
1274 1 38 MET ME 1 39 ILE H . . 4.670 2.746 1.909 4.405 . 0 0 "[ . 1 . ]" 1
1275 1 38 MET ME 1 49 GLY H . . 4.130 2.646 2.029 3.403 . 0 0 "[ . 1 . ]" 1
1276 1 38 MET ME 1 50 GLU HA . . 3.880 3.538 2.578 3.960 0.080 11 0 "[ . 1 . ]" 1
1277 1 38 MET ME 1 48 SER QB . . 4.190 2.783 2.048 3.924 . 0 0 "[ . 1 . ]" 1
1278 1 38 MET ME 1 51 GLY H . . 5.290 4.398 3.530 4.707 . 0 0 "[ . 1 . ]" 1
1279 1 44 CYS HA 1 75 LEU HB3 . . 3.500 3.292 2.564 3.584 0.084 11 0 "[ . 1 . ]" 1
1280 1 8 GLN HA 1 34 GLY HA2 . . 5.440 2.817 2.352 4.204 . 0 0 "[ . 1 . ]" 1
1281 1 8 GLN HA 1 9 HIS HA . . 4.500 4.516 4.369 4.576 0.076 10 0 "[ . 1 . ]" 1
1282 1 37 MET ME 1 52 LYS H . . 3.910 3.563 2.877 3.998 0.088 17 0 "[ . 1 . ]" 1
1283 1 37 MET ME 1 51 GLY H . . 4.860 4.426 3.791 4.901 0.041 10 0 "[ . 1 . ]" 1
1284 1 37 MET H 1 37 MET ME . . 4.900 4.642 4.223 5.013 0.113 11 0 "[ . 1 . ]" 1
1285 1 8 GLN H 1 37 MET ME . . 5.480 4.793 3.554 5.502 0.022 11 0 "[ . 1 . ]" 1
1286 1 37 MET ME 1 38 MET H . . 5.220 4.602 3.882 4.973 . 0 0 "[ . 1 . ]" 1
1287 1 33 PHE HZ 1 37 MET ME . . 5.500 4.484 3.630 5.557 0.057 11 0 "[ . 1 . ]" 1
1288 1 37 MET ME 1 51 GLY HA2 . . 4.620 4.296 3.392 4.677 0.057 5 0 "[ . 1 . ]" 1
1289 1 37 MET ME 1 52 LYS HA . . 4.290 4.118 3.244 4.400 0.110 14 0 "[ . 1 . ]" 1
1290 1 37 MET HA 1 37 MET ME . . 3.950 2.779 2.245 3.472 . 0 0 "[ . 1 . ]" 1
1291 1 4 PRO HA 1 37 MET ME . . 4.060 3.856 2.874 4.130 0.070 14 0 "[ . 1 . ]" 1
1292 1 37 MET ME 1 51 GLY HA3 . . 4.010 2.971 2.102 3.473 . 0 0 "[ . 1 . ]" 1
1293 1 33 PHE HB2 1 37 MET ME . . 5.490 4.309 3.511 5.890 0.400 11 0 "[ . 1 . ]" 1
1294 1 37 MET QB 1 37 MET ME . . 3.180 2.566 2.024 3.271 0.091 14 0 "[ . 1 . ]" 1
1295 1 37 MET ME 1 53 LEU HB2 . . 4.030 3.221 2.221 4.029 . 0 0 "[ . 1 . ]" 1
1296 1 37 MET ME 1 58 LEU MD1 . . 3.220 2.193 1.975 2.655 . 0 0 "[ . 1 . ]" 1
1297 1 37 MET ME 1 53 LEU QD . . 3.640 3.379 2.203 3.778 0.138 12 0 "[ . 1 . ]" 1
1298 1 7 LEU MD1 1 37 MET ME . . 3.470 2.568 2.073 3.206 . 0 0 "[ . 1 . ]" 1
1299 1 8 GLN HA 1 8 GLN HE21 . . 4.730 4.364 4.066 4.619 . 0 0 "[ . 1 . ]" 1
1300 1 8 GLN HA 1 33 PHE HB2 . . 3.810 2.741 2.116 3.775 . 0 0 "[ . 1 . ]" 1
1301 1 8 GLN HA 1 33 PHE HB3 . . 3.790 2.898 2.339 3.219 . 0 0 "[ . 1 . ]" 1
1302 1 8 GLN HA 1 8 GLN QG . . 3.850 2.470 2.099 3.422 . 0 0 "[ . 1 . ]" 1
1303 1 24 SER HA 1 25 ASP QB . . 5.180 4.269 3.692 4.662 . 0 0 "[ . 1 . ]" 1
1304 1 88 GLU HA 1 103 THR MG . . 5.070 5.114 4.835 5.184 0.114 11 0 "[ . 1 . ]" 1
1305 1 59 THR MG 1 88 GLU HA . . 5.500 4.257 3.752 4.938 . 0 0 "[ . 1 . ]" 1
1306 1 79 ASP HA 1 80 ASN HA . . 4.550 4.610 4.492 4.636 0.086 14 0 "[ . 1 . ]" 1
1307 1 24 SER HA 1 25 ASP H . . 3.020 2.425 2.056 3.099 0.079 12 0 "[ . 1 . ]" 1
1308 1 24 SER HA 1 75 LEU QD . . 5.000 3.783 2.302 4.471 . 0 0 "[ . 1 . ]" 1
1309 1 79 ASP HA 1 81 THR H . . 5.300 4.666 4.251 5.057 . 0 0 "[ . 1 . ]" 1
1310 1 78 LEU HA 1 82 ILE H . . 4.430 3.691 3.367 4.270 . 0 0 "[ . 1 . ]" 1
1311 1 78 LEU HA 1 81 THR MG . . 4.700 3.624 3.154 4.164 . 0 0 "[ . 1 . ]" 1
1312 1 75 LEU HA 1 77 GLU H . . 5.320 4.256 3.722 4.789 . 0 0 "[ . 1 . ]" 1
1313 1 42 SER HA 1 43 MET HA . . 4.910 4.507 4.360 4.598 . 0 0 "[ . 1 . ]" 1
1314 1 16 SER HA 1 17 VAL H . . 2.910 2.229 2.103 2.441 . 0 0 "[ . 1 . ]" 1
1315 1 16 SER HA 1 22 VAL H . . 3.610 3.509 2.800 3.686 0.076 10 0 "[ . 1 . ]" 1
1316 1 16 SER HA 1 21 PRO HA . . 3.110 2.129 1.898 2.579 . 0 0 "[ . 1 . ]" 1
1317 1 16 SER HA 1 21 PRO HB3 . . 4.540 3.702 3.010 4.611 0.071 19 0 "[ . 1 . ]" 1
1318 1 75 LEU HA 1 78 LEU H . . 4.170 3.390 3.049 3.707 . 0 0 "[ . 1 . ]" 1
1319 1 44 CYS QB 1 75 LEU HA . . 5.210 3.577 3.151 3.929 . 0 0 "[ . 1 . ]" 1
1320 1 75 LEU HA 1 78 LEU HB2 . . 3.450 2.498 2.041 3.005 . 0 0 "[ . 1 . ]" 1
1321 1 42 SER HA 1 43 MET H . . 3.000 2.271 2.080 2.483 . 0 0 "[ . 1 . ]" 1
1322 1 42 SER HA 1 46 ARG HA . . 3.080 2.080 1.862 2.248 . 0 0 "[ . 1 . ]" 1
1323 1 39 ILE H 1 39 ILE MD . . 4.550 3.931 3.456 4.143 . 0 0 "[ . 1 . ]" 1
1324 1 39 ILE MD 1 52 LYS H . . 5.010 3.991 3.384 4.955 . 0 0 "[ . 1 . ]" 1
1325 1 39 ILE MD 1 51 GLY H . . 4.800 3.321 2.908 3.746 . 0 0 "[ . 1 . ]" 1
1326 1 33 PHE QD 1 39 ILE MD . . 4.730 3.970 3.661 4.553 . 0 0 "[ . 1 . ]" 1
1327 1 33 PHE QE 1 39 ILE MD . . 4.030 2.939 2.202 3.890 . 0 0 "[ . 1 . ]" 1
1328 1 33 PHE HZ 1 39 ILE MD . . 5.500 4.571 3.800 5.565 0.065 14 0 "[ . 1 . ]" 1
1329 1 39 ILE MD 1 51 GLY HA2 . . 3.670 2.434 2.002 3.025 . 0 0 "[ . 1 . ]" 1
1330 1 39 ILE MD 1 51 GLY HA3 . . 3.720 2.424 2.172 3.009 . 0 0 "[ . 1 . ]" 1
1331 1 39 ILE MD 1 60 ALA MB . . 3.710 2.685 1.955 3.686 . 0 0 "[ . 1 . ]" 1
1332 1 39 ILE MD 1 60 ALA H . . 5.410 4.759 4.368 5.233 . 0 0 "[ . 1 . ]" 1
1333 1 12 PHE H 1 32 SER HA . . 4.130 3.277 2.846 3.582 . 0 0 "[ . 1 . ]" 1
1334 1 32 SER HA 1 33 PHE H . . 3.090 2.403 2.136 2.634 . 0 0 "[ . 1 . ]" 1
1335 1 32 SER HA 1 33 PHE QD . . 4.600 3.402 2.839 4.191 . 0 0 "[ . 1 . ]" 1
1336 1 31 ILE MG 1 32 SER HA . . 5.500 3.779 3.256 4.644 . 0 0 "[ . 1 . ]" 1
1337 1 42 SER HA 1 47 PHE H . . 3.820 3.228 2.901 3.820 0.000 16 0 "[ . 1 . ]" 1
1338 1 36 LYS H 1 36 LYS HA . . 2.670 2.391 2.210 2.774 0.104 3 0 "[ . 1 . ]" 1
1339 1 12 PHE HZ 1 112 LEU HA . . 4.720 4.263 3.736 4.634 . 0 0 "[ . 1 . ]" 1
1340 1 12 PHE QE 1 112 LEU HA . . 3.960 3.393 2.696 3.864 . 0 0 "[ . 1 . ]" 1
1341 1 39 ILE HA 1 39 ILE MD . . 4.530 4.000 3.853 4.093 . 0 0 "[ . 1 . ]" 1
1342 1 31 ILE HG12 1 32 SER HA . . 5.470 4.063 3.677 4.403 . 0 0 "[ . 1 . ]" 1
1343 1 11 ARG QB 1 32 SER HA . . 4.490 4.112 3.014 4.581 0.091 19 0 "[ . 1 . ]" 1
1344 1 47 PHE QB 1 48 SER HA . . 5.460 4.251 3.978 4.513 . 0 0 "[ . 1 . ]" 1
1345 1 48 SER HA 1 49 GLY H . . 2.970 2.480 2.360 2.638 . 0 0 "[ . 1 . ]" 1
1346 1 31 ILE H 1 31 ILE MG . . 3.550 2.445 2.270 2.818 . 0 0 "[ . 1 . ]" 1
1347 1 12 PHE H 1 31 ILE MG . . 4.320 3.233 2.902 3.632 . 0 0 "[ . 1 . ]" 1
1348 1 31 ILE MG 1 32 SER H . . 5.030 3.792 3.376 4.415 . 0 0 "[ . 1 . ]" 1
1349 1 31 ILE MG 1 33 PHE QD . . 4.810 4.011 2.960 4.450 . 0 0 "[ . 1 . ]" 1
1350 1 31 ILE MG 1 110 TYR QE . . 4.100 2.845 2.334 3.722 . 0 0 "[ . 1 . ]" 1
1351 1 30 GLU HA 1 31 ILE MG . . 4.860 3.781 3.489 4.098 . 0 0 "[ . 1 . ]" 1
1352 1 12 PHE HA 1 31 ILE MG . . 4.790 4.363 4.186 4.838 0.048 10 0 "[ . 1 . ]" 1
1353 1 12 PHE HB3 1 31 ILE MG . . 3.850 3.016 2.534 3.431 . 0 0 "[ . 1 . ]" 1
1354 1 12 PHE HB2 1 31 ILE MG . . 3.400 2.183 2.027 2.467 . 0 0 "[ . 1 . ]" 1
1355 1 31 ILE MG 1 43 MET ME . . 5.500 5.267 4.574 5.612 0.112 6 0 "[ . 1 . ]" 1
1356 1 47 PHE HA 1 48 SER HA . . 4.980 4.567 4.486 4.625 . 0 0 "[ . 1 . ]" 1
1357 1 38 MET ME 1 40 SER HA . . 5.430 4.546 3.324 5.535 0.105 8 0 "[ . 1 . ]" 1
1358 1 40 SER HA 1 41 GLY H . . 3.150 2.303 2.204 2.408 . 0 0 "[ . 1 . ]" 1
1359 1 40 SER HA 1 48 SER HA . . 3.300 2.808 2.150 3.386 0.086 8 0 "[ . 1 . ]" 1
1360 1 50 GLU HA 1 51 GLY H . . 2.920 2.180 2.063 2.313 . 0 0 "[ . 1 . ]" 1
1361 1 50 GLU HA 1 50 GLU HG3 . . 4.060 2.946 2.358 3.927 . 0 0 "[ . 1 . ]" 1
1362 1 76 ASN HA 1 79 ASP H . . 4.260 3.605 2.966 4.243 . 0 0 "[ . 1 . ]" 1
1363 1 9 HIS HA 1 10 HIS HD2 . . 5.500 5.046 4.309 5.568 0.068 4 0 "[ . 1 . ]" 1
1364 1 14 LEU HA 1 111 LYS H . . 4.510 4.076 3.788 4.444 . 0 0 "[ . 1 . ]" 1
1365 1 14 LEU HA 1 15 GLU H . . 3.070 2.189 2.006 2.283 . 0 0 "[ . 1 . ]" 1
1366 1 14 LEU HA 1 110 TYR QE . . 5.150 3.652 3.235 4.158 . 0 0 "[ . 1 . ]" 1
1367 1 14 LEU HA 1 15 GLU HB2 . . 4.670 4.193 3.937 4.415 . 0 0 "[ . 1 . ]" 1
1368 1 38 MET HG3 1 50 GLU HA . . 5.160 3.925 2.404 5.231 0.071 7 0 "[ . 1 . ]" 1
1369 1 26 LYS HA 1 27 ASN H . . 3.330 3.028 2.104 3.419 0.089 17 0 "[ . 1 . ]" 1
1370 1 26 LYS HA 1 26 LYS QG . . 3.760 2.552 2.185 3.500 . 0 0 "[ . 1 . ]" 1
1371 1 13 VAL HA 1 14 LEU HA . . 4.940 4.351 4.118 4.506 . 0 0 "[ . 1 . ]" 1
1372 1 29 PRO HB3 1 43 MET HA . . 3.230 2.108 1.953 2.270 . 0 0 "[ . 1 . ]" 1
1373 1 91 GLN HA 1 91 GLN HE22 . . 5.310 4.079 3.150 5.250 . 0 0 "[ . 1 . ]" 1
1374 1 60 ALA HA 1 61 LYS HA . . 5.090 4.478 4.389 4.614 . 0 0 "[ . 1 . ]" 1
1375 1 59 THR HA 1 86 LEU HA . . 3.710 3.263 2.852 3.768 0.058 12 0 "[ . 1 . ]" 1
1376 1 60 ALA H 1 86 LEU HA . . 4.340 3.637 3.258 4.012 . 0 0 "[ . 1 . ]" 1
1377 1 86 LEU HA 1 89 GLY H . . 4.290 3.527 2.854 3.884 . 0 0 "[ . 1 . ]" 1
1378 1 86 LEU HA 1 90 ALA MB . . 4.420 3.315 2.834 4.110 . 0 0 "[ . 1 . ]" 1
1379 1 86 LEU HA 1 90 ALA H . . 5.010 3.359 2.780 4.816 . 0 0 "[ . 1 . ]" 1
1380 1 16 SER H 1 110 TYR HA . . 5.040 3.941 3.715 4.254 . 0 0 "[ . 1 . ]" 1
1381 1 15 GLU HB2 1 110 TYR HA . . 4.120 3.084 2.294 3.708 . 0 0 "[ . 1 . ]" 1
1382 1 110 TYR HA 1 111 LYS H . . 3.160 2.348 2.144 2.560 . 0 0 "[ . 1 . ]" 1
1383 1 15 GLU H 1 110 TYR HA . . 3.280 2.239 1.758 2.705 . 0 0 "[ . 1 . ]" 1
1384 1 14 LEU HA 1 110 TYR HA . . 3.290 2.576 2.100 2.848 . 0 0 "[ . 1 . ]" 1
1385 1 38 MET HA 1 39 ILE H . . 2.990 2.378 2.107 3.024 0.034 8 0 "[ . 1 . ]" 1
1386 1 58 LEU H 1 91 GLN HA . . 4.530 3.908 3.632 4.584 0.054 15 0 "[ . 1 . ]" 1
1387 1 91 GLN HA 1 92 VAL H . . 2.800 2.225 2.118 2.320 . 0 0 "[ . 1 . ]" 1
1388 1 57 GLU HA 1 91 GLN HA . . 3.340 2.648 2.251 3.319 . 0 0 "[ . 1 . ]" 1
1389 1 103 THR HB 1 105 LYS HA . . 4.850 4.882 4.739 4.936 0.086 14 0 "[ . 1 . ]" 1
1390 1 61 LYS HA 1 62 GLY H . . 3.440 2.988 2.094 3.521 0.081 18 0 "[ . 1 . ]" 1
1391 1 114 ASP HA 1 115 LEU MD2 . . 4.280 4.207 3.563 4.385 0.105 11 0 "[ . 1 . ]" 1
1392 1 80 ASN HA 1 84 GLU H . . 4.500 3.978 3.553 4.438 . 0 0 "[ . 1 . ]" 1
1393 1 80 ASN HA 1 83 SER H . . 4.140 3.489 3.130 4.108 . 0 0 "[ . 1 . ]" 1
1394 1 12 PHE HA 1 13 VAL HB . . 5.040 4.744 4.334 5.145 0.105 4 0 "[ . 1 . ]" 1
1395 1 12 PHE HA 1 13 VAL H . . 2.950 2.201 2.024 2.437 . 0 0 "[ . 1 . ]" 1
1396 1 12 PHE HA 1 12 PHE QD . . 4.490 3.084 2.466 3.375 . 0 0 "[ . 1 . ]" 1
1397 1 12 PHE HA 1 112 LEU HA . . 3.520 3.146 2.836 3.550 0.030 19 0 "[ . 1 . ]" 1
1398 1 12 PHE HA 1 113 ALA MB . . 4.310 4.113 3.701 4.403 0.093 16 0 "[ . 1 . ]" 1
1399 1 33 PHE HA 1 34 GLY H . . 3.060 2.426 2.251 2.776 . 0 0 "[ . 1 . ]" 1
1400 1 46 ARG HA 1 47 PHE QD . . 4.670 3.539 3.176 4.069 . 0 0 "[ . 1 . ]" 1
1401 1 68 MET HA 1 69 MET ME . . 3.390 2.927 2.103 3.476 0.086 2 0 "[ . 1 . ]" 1
1402 1 7 LEU HA 1 10 HIS HB2 . . 4.400 2.658 2.319 3.035 . 0 0 "[ . 1 . ]" 1
1403 1 7 LEU HA 1 7 LEU HG . . 3.560 3.108 2.983 3.290 . 0 0 "[ . 1 . ]" 1
1404 1 7 LEU HA 1 33 PHE QD . . 4.480 3.857 3.243 4.464 . 0 0 "[ . 1 . ]" 1
1405 1 46 ARG HA 1 47 PHE H . . 3.040 2.419 2.209 2.832 . 0 0 "[ . 1 . ]" 1
1406 1 42 SER HB2 1 46 ARG HA . . 4.090 2.918 2.127 3.878 . 0 0 "[ . 1 . ]" 1
1407 1 46 ARG HA 1 46 ARG QG . . 3.570 2.335 2.045 3.322 . 0 0 "[ . 1 . ]" 1
1408 1 114 ASP HA 1 115 LEU H . . 2.900 2.623 2.113 2.983 0.083 1 0 "[ . 1 . ]" 1
1409 1 114 ASP HA 1 115 LEU HG . . 4.270 3.604 2.968 4.335 0.065 19 0 "[ . 1 . ]" 1
1410 1 68 MET HA 1 69 MET H . . 2.840 2.590 2.302 2.894 0.054 14 0 "[ . 1 . ]" 1
1411 1 68 MET HA 1 68 MET HG3 . . 3.890 3.312 2.261 3.797 . 0 0 "[ . 1 . ]" 1
1412 1 52 LYS HA 1 53 LEU H . . 2.690 2.340 2.198 2.485 . 0 0 "[ . 1 . ]" 1
1413 1 49 GLY HA3 1 63 LEU HA . . 4.160 2.937 2.573 3.780 . 0 0 "[ . 1 . ]" 1
1414 1 63 LEU HA 1 64 ALA H . . 2.740 2.226 2.037 2.526 . 0 0 "[ . 1 . ]" 1
1415 1 63 LEU HA 1 63 LEU HG . . 3.670 2.439 2.177 3.104 . 0 0 "[ . 1 . ]" 1
1416 1 116 MET HA 1 117 ASN H . . 3.550 2.542 2.102 3.512 . 0 0 "[ . 1 . ]" 1
1417 1 31 ILE H 1 31 ILE MD . . 5.310 4.842 4.713 5.067 . 0 0 "[ . 1 . ]" 1
1418 1 12 PHE HB2 1 31 ILE MD . . 5.500 4.802 4.515 5.106 . 0 0 "[ . 1 . ]" 1
1419 1 31 ILE MD 1 31 ILE MG . . 3.460 2.101 2.043 2.206 . 0 0 "[ . 1 . ]" 1
1420 1 31 ILE MD 1 33 PHE HZ . . 4.060 2.539 2.140 2.915 . 0 0 "[ . 1 . ]" 1
1421 1 31 ILE MD 1 110 TYR QE . . 4.980 3.743 3.117 4.833 . 0 0 "[ . 1 . ]" 1
1422 1 31 ILE MD 1 41 GLY HA3 . . 5.500 3.915 3.369 5.101 . 0 0 "[ . 1 . ]" 1
1423 1 98 GLN HA 1 99 LEU H . . 2.900 2.163 2.041 2.281 . 0 0 "[ . 1 . ]" 1
1424 1 98 GLN HA 1 111 LYS HA . . 3.250 2.838 2.365 3.318 0.068 9 0 "[ . 1 . ]" 1
1425 1 98 GLN HA 1 99 LEU HB3 . . 5.400 4.919 4.189 5.393 . 0 0 "[ . 1 . ]" 1
1426 1 94 LEU QD 1 98 GLN HA . . 5.500 3.560 3.271 3.886 . 0 0 "[ . 1 . ]" 1
1427 1 47 PHE HZ 1 82 ILE MD . . 4.910 3.757 2.970 4.578 . 0 0 "[ . 1 . ]" 1
1428 1 31 ILE HA 1 31 ILE MD . . 4.420 3.749 3.671 3.821 . 0 0 "[ . 1 . ]" 1
1429 1 31 ILE MD 1 99 LEU QD . . 5.160 3.827 3.231 4.076 . 0 0 "[ . 1 . ]" 1
1430 1 31 ILE MD 1 32 SER H . . 4.590 4.233 3.857 4.676 0.086 10 0 "[ . 1 . ]" 1
1431 1 31 ILE MD 1 47 PHE QE . . 3.890 2.607 2.182 3.868 . 0 0 "[ . 1 . ]" 1
1432 1 31 ILE MD 1 43 MET ME . . 5.500 4.526 3.669 5.306 . 0 0 "[ . 1 . ]" 1
1433 1 48 SER H 1 65 MET HA . . 4.530 4.479 4.012 4.606 0.076 6 0 "[ . 1 . ]" 1
1434 1 65 MET HA 1 66 THR H . . 2.950 2.599 2.333 2.886 . 0 0 "[ . 1 . ]" 1
1435 1 65 MET HA 1 65 MET HG3 . . 3.940 3.322 3.063 3.988 0.048 17 0 "[ . 1 . ]" 1
1436 1 64 ALA HA 1 65 MET HA . . 4.770 4.532 4.338 4.619 . 0 0 "[ . 1 . ]" 1
1437 1 69 MET HA 1 70 CYS H . . 2.980 2.450 2.079 2.664 . 0 0 "[ . 1 . ]" 1
1438 1 67 ARG HA 1 68 MET H . . 3.380 2.515 2.175 3.147 . 0 0 "[ . 1 . ]" 1
1439 1 67 ARG HA 1 67 ARG QD . . 3.920 3.406 2.232 4.014 0.094 17 0 "[ . 1 . ]" 1
1440 1 82 ILE H 1 82 ILE MD . . 4.430 4.025 3.870 4.127 . 0 0 "[ . 1 . ]" 1
1441 1 82 ILE MD 1 86 LEU H . . 4.850 4.199 3.569 4.907 0.057 8 0 "[ . 1 . ]" 1
1442 1 47 PHE QE 1 82 ILE MD . . 4.630 3.828 2.588 4.666 0.036 6 0 "[ . 1 . ]" 1
1443 1 82 ILE HA 1 82 ILE MD . . 3.140 2.119 2.036 2.268 . 0 0 "[ . 1 . ]" 1
1444 1 82 ILE MD 1 85 MET HA . . 5.500 5.535 5.099 5.608 0.108 17 0 "[ . 1 . ]" 1
1445 1 43 MET HG2 1 82 ILE MD . . 5.500 4.331 3.574 5.359 . 0 0 "[ . 1 . ]" 1
1446 1 82 ILE MD 1 85 MET QG . . 5.500 4.046 2.048 4.666 . 0 0 "[ . 1 . ]" 1
1447 1 82 ILE MD 1 86 LEU HG . . 3.920 3.413 2.558 3.960 0.040 19 0 "[ . 1 . ]" 1
1448 1 82 ILE HB 1 82 ILE MD . . 3.450 2.329 2.237 2.464 . 0 0 "[ . 1 . ]" 1
1449 1 82 ILE MD 1 108 LEU QD . . 3.390 2.797 2.140 3.443 0.053 4 0 "[ . 1 . ]" 1
1450 1 63 LEU QD 1 65 MET HA . . 5.500 4.877 4.112 5.607 0.107 18 0 "[ . 1 . ]" 1
1451 1 69 MET HA 1 70 CYS HB2 . . 4.800 4.592 3.870 5.636 0.836 14 4 "[ *. * +. -]" 1
1452 1 18 ASN HA 1 19 GLY H . . 3.450 3.498 3.358 3.530 0.080 17 0 "[ . 1 . ]" 1
1453 1 17 VAL MG1 1 18 ASN HA . . 4.950 4.188 4.012 4.424 . 0 0 "[ . 1 . ]" 1
1454 1 114 ASP H 1 115 LEU HA . . 4.770 4.773 4.285 4.854 0.084 19 0 "[ . 1 . ]" 1
1455 1 115 LEU HA 1 116 MET H . . 3.050 3.094 2.988 3.134 0.084 2 0 "[ . 1 . ]" 1
1456 1 1 MET HA 1 2 VAL H . . 2.850 2.379 2.072 2.929 0.079 3 0 "[ . 1 . ]" 1
1457 1 1 MET HA 1 2 VAL HB . . 4.820 4.527 4.081 4.875 0.055 4 0 "[ . 1 . ]" 1
1458 1 1 MET HA 1 2 VAL MG1 . . 5.450 3.995 2.355 5.528 0.078 1 0 "[ . 1 . ]" 1
1459 1 104 ALA HA 1 106 GLN H . . 5.310 5.240 5.014 5.382 0.072 18 0 "[ . 1 . ]" 1
1460 1 30 GLU HA 1 31 ILE HB . . 5.420 4.227 3.748 4.833 . 0 0 "[ . 1 . ]" 1
1461 1 55 ASN HA 1 57 GLU H . . 4.950 4.660 4.213 5.033 0.083 17 0 "[ . 1 . ]" 1
1462 1 47 PHE HA 1 64 ALA H . . 4.990 4.437 3.745 5.071 0.081 17 0 "[ . 1 . ]" 1
1463 1 47 PHE HA 1 63 LEU HG . . 5.150 4.088 3.578 4.894 . 0 0 "[ . 1 . ]" 1
1464 1 47 PHE HA 1 48 SER H . . 3.030 2.383 2.242 2.485 . 0 0 "[ . 1 . ]" 1
1465 1 47 PHE HA 1 65 MET HA . . 3.250 2.604 2.229 2.904 . 0 0 "[ . 1 . ]" 1
1466 1 46 ARG HA 1 47 PHE HA . . 5.500 4.536 4.395 4.753 . 0 0 "[ . 1 . ]" 1
1467 1 30 GLU HA 1 110 TYR QE . . 4.240 3.862 2.894 4.348 0.108 17 0 "[ . 1 . ]" 1
1468 1 30 GLU HA 1 31 ILE H . . 3.160 2.488 2.365 2.656 . 0 0 "[ . 1 . ]" 1
1469 1 13 VAL H 1 30 GLU HA . . 4.840 4.773 4.463 4.906 0.066 13 0 "[ . 1 . ]" 1
1470 1 14 LEU H 1 30 GLU HA . . 3.750 2.637 2.351 2.965 . 0 0 "[ . 1 . ]" 1
1471 1 13 VAL HA 1 30 GLU HA . . 3.180 1.971 1.895 2.175 . 0 0 "[ . 1 . ]" 1
1472 1 10 HIS HA 1 11 ARG H . . 3.030 2.180 2.048 2.424 . 0 0 "[ . 1 . ]" 1
1473 1 10 HIS HA 1 11 ARG QB . . 4.480 4.045 3.734 4.386 . 0 0 "[ . 1 . ]" 1
1474 1 57 GLU HA 1 58 LEU H . . 2.900 2.219 2.134 2.433 . 0 0 "[ . 1 . ]" 1
1475 1 55 ASN HA 1 56 GLY H . . 3.420 3.200 2.775 3.502 0.082 5 0 "[ . 1 . ]" 1
1476 1 47 PHE HA 1 48 SER QB . . 5.390 4.433 3.968 4.928 . 0 0 "[ . 1 . ]" 1
1477 1 106 GLN HA 1 107 THR MG . . 4.740 3.570 2.937 4.843 0.103 6 0 "[ . 1 . ]" 1
1478 1 106 GLN HA 1 107 THR H . . 2.840 2.708 2.525 2.821 . 0 0 "[ . 1 . ]" 1
1479 1 106 GLN HA 1 106 GLN HG2 . . 3.520 3.153 2.256 3.911 0.391 11 0 "[ . 1 . ]" 1
1480 1 106 GLN HA 1 106 GLN HG3 . . 3.830 3.204 2.168 3.857 0.027 12 0 "[ . 1 . ]" 1
1481 1 11 ARG HA 1 12 PHE H . . 3.150 2.274 2.179 2.433 . 0 0 "[ . 1 . ]" 1
1482 1 11 ARG HA 1 32 SER HB2 . . 4.190 3.703 3.017 4.714 0.524 4 1 "[ +. 1 . ]" 1
1483 1 25 ASP HA 1 26 LYS H . . 3.510 3.298 2.528 3.572 0.062 19 0 "[ . 1 . ]" 1
1484 1 34 GLY H 1 37 MET HA . . 4.800 3.957 3.310 4.779 . 0 0 "[ . 1 . ]" 1
1485 1 8 GLN H 1 37 MET HA . . 5.130 5.057 4.205 5.219 0.089 15 0 "[ . 1 . ]" 1
1486 1 94 LEU HA 1 100 THR H . . 4.300 3.140 2.650 3.567 . 0 0 "[ . 1 . ]" 1
1487 1 94 LEU HA 1 95 THR H . . 2.950 2.015 1.911 2.117 . 0 0 "[ . 1 . ]" 1
1488 1 94 LEU HA 1 99 LEU QD . . 5.350 2.759 2.381 3.168 . 0 0 "[ . 1 . ]" 1
1489 1 33 PHE QD 1 37 MET HA . . 4.690 4.334 3.995 4.633 . 0 0 "[ . 1 . ]" 1
1490 1 7 LEU HB2 1 37 MET HA . . 5.320 5.113 4.270 5.400 0.080 5 0 "[ . 1 . ]" 1
1491 1 98 GLN HG2 1 111 LYS HA . . 5.280 4.506 3.608 5.225 . 0 0 "[ . 1 . ]" 1
1492 1 12 PHE QD 1 111 LYS HA . . 5.440 3.690 3.115 4.052 . 0 0 "[ . 1 . ]" 1
1493 1 95 THR HA 1 96 ALA HA . . 4.470 4.281 4.025 4.403 . 0 0 "[ . 1 . ]" 1
1494 1 95 THR MG 1 96 ALA HA . . 5.070 4.326 4.160 4.476 . 0 0 "[ . 1 . ]" 1
1495 1 111 LYS HA 1 112 LEU HA . . 5.500 4.504 4.369 4.587 . 0 0 "[ . 1 . ]" 1
1496 1 99 LEU H 1 111 LYS HA . . 4.180 3.504 3.247 3.729 . 0 0 "[ . 1 . ]" 1
1497 1 111 LYS HA 1 112 LEU H . . 2.930 2.234 2.153 2.324 . 0 0 "[ . 1 . ]" 1
1498 1 111 LYS HA 1 111 LYS QD . . 4.160 2.553 2.012 3.098 . 0 0 "[ . 1 . ]" 1
1499 1 111 LYS HA 1 112 LEU HB2 . . 4.700 4.481 4.188 4.718 0.018 6 0 "[ . 1 . ]" 1
1500 1 94 LEU HA 1 99 LEU H . . 5.140 4.564 4.235 4.828 . 0 0 "[ . 1 . ]" 1
1501 1 97 ASN HA 1 112 LEU H . . 4.700 4.291 3.761 4.753 0.053 2 0 "[ . 1 . ]" 1
1502 1 71 ALA HA 1 72 ASN QB . . 5.110 4.897 4.564 5.225 0.115 18 0 "[ . 1 . ]" 1
1503 1 18 ASN H 1 108 LEU HA . . 4.510 3.371 2.933 3.634 . 0 0 "[ . 1 . ]" 1
1504 1 108 LEU HA 1 109 THR H . . 2.980 2.331 2.189 2.443 . 0 0 "[ . 1 . ]" 1
1505 1 107 THR MG 1 108 LEU HA . . 4.820 4.414 3.955 4.695 . 0 0 "[ . 1 . ]" 1
1506 1 97 ASN HA 1 112 LEU HB3 . . 4.230 3.246 2.657 3.690 . 0 0 "[ . 1 . ]" 1
1507 1 97 ASN HA 1 112 LEU MD2 . . 4.080 2.389 2.067 2.633 . 0 0 "[ . 1 . ]" 1
1508 1 91 GLN H 1 101 LEU HA . . 5.110 4.641 4.108 5.072 . 0 0 "[ . 1 . ]" 1
1509 1 101 LEU HA 1 102 ALA H . . 2.880 2.231 2.076 2.357 . 0 0 "[ . 1 . ]" 1
1510 1 97 ASN HA 1 98 GLN HA . . 5.170 4.500 4.057 4.648 . 0 0 "[ . 1 . ]" 1
1511 1 58 LEU HA 1 59 THR H . . 2.930 2.237 2.156 2.374 . 0 0 "[ . 1 . ]" 1
1512 1 53 LEU QD 1 58 LEU HA . . 4.160 3.999 3.443 4.287 0.127 14 0 "[ . 1 . ]" 1
1513 1 101 LEU HA 1 102 ALA HA . . 5.150 4.485 4.430 4.543 . 0 0 "[ . 1 . ]" 1
1514 1 101 LEU HA 1 101 LEU MD1 . . 4.280 2.418 2.159 3.278 . 0 0 "[ . 1 . ]" 1
1515 1 45 ASN HA 1 66 THR H . . 4.590 4.146 3.654 4.577 . 0 0 "[ . 1 . ]" 1
1516 1 45 ASN HA 1 46 ARG H . . 3.040 2.997 2.825 3.117 0.077 6 0 "[ . 1 . ]" 1
1517 1 99 LEU HA 1 99 LEU HG . . 4.220 2.929 2.575 3.378 . 0 0 "[ . 1 . ]" 1
1518 1 99 LEU HA 1 100 THR H . . 3.010 2.240 2.080 2.441 . 0 0 "[ . 1 . ]" 1
1519 1 53 LEU HA 1 54 SER HA . . 5.090 4.420 4.309 4.554 . 0 0 "[ . 1 . ]" 1
1520 1 52 LYS HA 1 53 LEU HA . . 5.140 4.531 4.432 4.634 . 0 0 "[ . 1 . ]" 1
1521 1 53 LEU HA 1 58 LEU MD1 . . 5.140 4.128 2.872 4.624 . 0 0 "[ . 1 . ]" 1
1522 1 53 LEU HA 1 54 SER H . . 2.830 2.177 2.027 2.289 . 0 0 "[ . 1 . ]" 1
1523 1 53 LEU HA 1 57 GLU H . . 4.950 3.920 3.359 4.422 . 0 0 "[ . 1 . ]" 1
1524 1 20 LYS HA 1 21 PRO QD . . 3.020 2.244 2.084 2.421 . 0 0 "[ . 1 . ]" 1
1525 1 20 LYS HA 1 20 LYS HG2 . . 4.030 2.696 2.030 3.858 . 0 0 "[ . 1 . ]" 1
1526 1 20 LYS HA 1 21 PRO QG . . 4.390 4.175 4.059 4.332 . 0 0 "[ . 1 . ]" 1
1527 1 27 ASN HA 1 28 PRO HD3 . . 2.890 3.026 2.858 3.177 0.287 3 0 "[ . 1 . ]" 1
1528 1 27 ASN HA 1 28 PRO QG . . 4.070 4.004 3.874 4.161 0.091 5 0 "[ . 1 . ]" 1
1529 1 112 LEU HA 1 113 ALA HA . . 5.100 4.596 4.441 4.856 . 0 0 "[ . 1 . ]" 1
1530 1 113 ALA HA 1 115 LEU H . . 4.520 3.827 3.276 4.576 0.056 15 0 "[ . 1 . ]" 1
1531 1 102 ALA HA 1 103 THR H . . 2.880 2.386 2.220 2.512 . 0 0 "[ . 1 . ]" 1
1532 1 102 ALA HA 1 106 GLN H . . 5.230 4.815 4.537 5.232 0.002 10 0 "[ . 1 . ]" 1
1533 1 113 ALA HA 1 114 ASP H . . 2.990 2.303 2.150 2.482 . 0 0 "[ . 1 . ]" 1
1534 1 112 LEU HG 1 113 ALA HA . . 4.610 4.566 4.009 4.688 0.078 16 0 "[ . 1 . ]" 1
1535 1 72 ASN QB 1 73 PRO HD2 . . 4.790 3.354 2.442 3.859 . 0 0 "[ . 1 . ]" 1
1536 1 73 PRO HD2 1 74 GLN H . . 4.610 2.720 1.972 3.246 . 0 0 "[ . 1 . ]" 1
1537 1 73 PRO HD3 1 74 GLN H . . 4.040 3.854 3.442 4.112 0.072 9 0 "[ . 1 . ]" 1
1538 1 72 ASN H 1 73 PRO HD3 . . 5.060 4.739 4.109 5.055 . 0 0 "[ . 1 . ]" 1
1539 1 72 ASN QB 1 73 PRO HD3 . . 4.790 4.126 3.377 4.467 . 0 0 "[ . 1 . ]" 1
1540 1 60 ALA HA 1 61 LYS H . . 2.880 2.204 2.099 2.400 . 0 0 "[ . 1 . ]" 1
1541 1 64 ALA HA 1 65 MET H . . 2.780 2.284 2.122 2.439 . 0 0 "[ . 1 . ]" 1
1542 1 39 ILE MD 1 60 ALA HA . . 5.230 3.689 2.925 4.653 . 0 0 "[ . 1 . ]" 1
1543 1 20 LYS H 1 21 PRO QD . . 5.370 4.344 4.152 4.462 . 0 0 "[ . 1 . ]" 1
1544 1 20 LYS HB2 1 21 PRO QD . . 3.410 3.148 1.979 3.751 0.341 6 0 "[ . 1 . ]" 1
1545 1 14 LEU HB3 1 29 PRO HD3 . . 4.870 4.869 4.418 4.956 0.086 15 0 "[ . 1 . ]" 1
1546 1 29 PRO HD3 1 75 LEU QD . . 4.400 2.439 2.075 2.959 . 0 0 "[ . 1 . ]" 1
1547 1 26 LYS HA 1 28 PRO HD3 . . 5.110 3.696 2.731 4.992 . 0 0 "[ . 1 . ]" 1
1548 1 14 LEU H 1 29 PRO HD2 . . 5.500 4.672 4.219 5.302 . 0 0 "[ . 1 . ]" 1
1549 1 14 LEU HB3 1 29 PRO HD2 . . 4.340 3.652 2.912 3.960 . 0 0 "[ . 1 . ]" 1
1550 1 14 LEU HB2 1 29 PRO HD2 . . 5.100 5.014 3.835 5.176 0.076 18 0 "[ . 1 . ]" 1
1551 1 3 THR HA 1 4 PRO HD2 . . 3.790 2.491 2.315 2.874 . 0 0 "[ . 1 . ]" 1
1552 1 4 PRO HD2 1 53 LEU QD . . 4.910 3.865 3.582 4.174 . 0 0 "[ . 1 . ]" 1
1553 1 4 PRO HD3 1 5 GLU H . . 4.780 3.908 3.670 4.227 . 0 0 "[ . 1 . ]" 1
1554 1 3 THR HA 1 4 PRO HD3 . . 3.230 2.542 2.178 2.798 . 0 0 "[ . 1 . ]" 1
1555 1 3 THR HB 1 4 PRO HD3 . . 3.680 3.600 3.392 3.748 0.068 17 0 "[ . 1 . ]" 1
1556 1 4 PRO HD3 1 53 LEU HG . . 5.500 2.590 2.290 3.816 . 0 0 "[ . 1 . ]" 1
1557 1 4 PRO HD3 1 53 LEU QD . . 4.250 2.768 2.194 3.220 . 0 0 "[ . 1 . ]" 1
1558 1 27 ASN H 1 28 PRO HD3 . . 4.090 3.153 2.549 3.641 . 0 0 "[ . 1 . ]" 1
1559 1 28 PRO HA 1 29 PRO HD2 . . 3.400 2.465 2.217 2.726 . 0 0 "[ . 1 . ]" 1
1560 1 28 PRO HB2 1 29 PRO HD2 . . 4.420 2.520 2.167 2.843 . 0 0 "[ . 1 . ]" 1
1561 1 28 PRO HB3 1 29 PRO HD2 . . 3.900 3.026 2.741 3.373 . 0 0 "[ . 1 . ]" 1
1562 1 72 ASN HA 1 73 PRO HG3 . . 4.470 4.541 4.527 4.550 0.080 7 0 "[ . 1 . ]" 1
1563 1 72 ASN HA 1 73 PRO HD2 . . 3.100 2.457 2.259 2.799 . 0 0 "[ . 1 . ]" 1
1564 1 72 ASN HA 1 73 PRO HD3 . . 3.120 2.378 2.227 2.546 . 0 0 "[ . 1 . ]" 1
1565 1 71 ALA MB 1 72 ASN HA . . 5.190 4.357 3.876 4.564 . 0 0 "[ . 1 . ]" 1
1566 1 90 ALA HA 1 91 GLN H . . 2.900 2.265 2.156 2.365 . 0 0 "[ . 1 . ]" 1
1567 1 90 ALA HA 1 103 THR MG . . 4.320 2.157 1.965 2.673 . 0 0 "[ . 1 . ]" 1
1568 1 13 VAL H 1 113 ALA H . . 4.290 3.408 2.915 4.033 . 0 0 "[ . 1 . ]" 1
1569 1 112 LEU H 1 113 ALA H . . 5.350 3.654 3.220 4.382 . 0 0 "[ . 1 . ]" 1
1570 1 113 ALA H 1 114 ASP H . . 4.210 3.853 3.361 4.178 . 0 0 "[ . 1 . ]" 1
1571 1 12 PHE QD 1 113 ALA H . . 5.370 4.425 4.179 4.938 . 0 0 "[ . 1 . ]" 1
1572 1 112 LEU HA 1 113 ALA H . . 3.180 2.610 2.216 3.088 . 0 0 "[ . 1 . ]" 1
1573 1 111 LYS QD 1 113 ALA H . . 5.500 4.210 2.913 5.175 . 0 0 "[ . 1 . ]" 1
1574 1 112 LEU MD2 1 113 ALA H . . 5.500 5.496 5.058 5.601 0.101 2 0 "[ . 1 . ]" 1
1575 1 99 LEU H 1 110 TYR H . . 4.300 3.309 3.028 3.507 . 0 0 "[ . 1 . ]" 1
1576 1 98 GLN H 1 99 LEU H . . 5.500 4.200 3.979 4.459 . 0 0 "[ . 1 . ]" 1
1577 1 12 PHE QD 1 99 LEU H . . 5.500 3.471 2.999 4.144 . 0 0 "[ . 1 . ]" 1
1578 1 98 GLN HB3 1 99 LEU H . . 4.080 4.131 4.035 4.167 0.087 17 0 "[ . 1 . ]" 1
1579 1 99 LEU H 1 99 LEU HB2 . . 3.840 2.342 2.131 3.096 . 0 0 "[ . 1 . ]" 1
1580 1 94 LEU HB2 1 99 LEU H . . 5.500 5.574 5.540 5.584 0.084 9 0 "[ . 1 . ]" 1
1581 1 99 LEU H 1 110 TYR HB3 . . 4.570 4.562 4.150 4.980 0.410 3 0 "[ . 1 . ]" 1
1582 1 57 GLU H 1 58 LEU H . . 5.500 4.303 4.193 4.489 . 0 0 "[ . 1 . ]" 1
1583 1 57 GLU HG3 1 58 LEU H . . 4.510 3.376 2.670 4.085 . 0 0 "[ . 1 . ]" 1
1584 1 58 LEU H 1 92 VAL HB . . 3.590 3.602 3.041 3.677 0.087 6 0 "[ . 1 . ]" 1
1585 1 58 LEU H 1 58 LEU HB2 . . 3.740 2.894 2.453 3.219 . 0 0 "[ . 1 . ]" 1
1586 1 53 LEU QD 1 58 LEU H . . 5.400 4.479 3.883 4.971 . 0 0 "[ . 1 . ]" 1
1587 1 48 SER QB 1 64 ALA H . . 4.720 4.264 3.199 4.536 . 0 0 "[ . 1 . ]" 1
1588 1 47 PHE QB 1 64 ALA H . . 5.500 4.379 3.667 5.032 . 0 0 "[ . 1 . ]" 1
1589 1 63 LEU MD1 1 64 ALA H . . 4.580 4.051 3.177 4.599 0.019 14 0 "[ . 1 . ]" 1
1590 1 14 LEU H 1 30 GLU H . . 5.500 4.584 4.201 4.787 . 0 0 "[ . 1 . ]" 1
1591 1 94 LEU QD 1 96 ALA H . . 5.500 4.592 4.237 5.010 . 0 0 "[ . 1 . ]" 1
1592 1 13 VAL H 1 14 LEU H . . 5.120 4.459 4.337 4.588 . 0 0 "[ . 1 . ]" 1
1593 1 14 LEU H 1 110 TYR QE . . 4.960 3.746 3.207 4.102 . 0 0 "[ . 1 . ]" 1
1594 1 14 LEU H 1 14 LEU HB2 . . 3.620 2.540 2.217 2.845 . 0 0 "[ . 1 . ]" 1
1595 1 14 LEU H 1 31 ILE H . . 5.180 4.698 4.340 4.971 . 0 0 "[ . 1 . ]" 1
1596 1 39 ILE H 1 48 SER QB . . 5.500 4.816 4.042 5.404 . 0 0 "[ . 1 . ]" 1
1597 1 39 ILE H 1 51 GLY HA3 . . 5.500 4.715 4.052 5.277 . 0 0 "[ . 1 . ]" 1
1598 1 38 MET HG3 1 39 ILE H . . 5.450 4.333 3.092 5.524 0.074 8 0 "[ . 1 . ]" 1
1599 1 39 ILE H 1 39 ILE HG13 . . 3.840 2.692 2.413 3.058 . 0 0 "[ . 1 . ]" 1
1600 1 58 LEU H 1 90 ALA H . . 3.910 3.198 2.485 3.623 . 0 0 "[ . 1 . ]" 1
1601 1 59 THR H 1 90 ALA H . . 4.760 4.796 4.656 4.845 0.085 6 0 "[ . 1 . ]" 1
1602 1 89 GLY H 1 90 ALA H . . 4.390 3.282 2.818 4.062 . 0 0 "[ . 1 . ]" 1
1603 1 59 THR MG 1 90 ALA H . . 3.700 3.646 3.253 3.805 0.105 12 0 "[ . 1 . ]" 1
1604 1 90 ALA H 1 91 GLN H . . 5.140 4.582 4.425 4.711 . 0 0 "[ . 1 . ]" 1
1605 1 86 LEU QD 1 90 ALA H . . 5.500 3.615 3.115 4.790 . 0 0 "[ . 1 . ]" 1
1606 1 101 LEU H 1 108 LEU H . . 4.130 2.909 2.539 3.122 . 0 0 "[ . 1 . ]" 1
1607 1 102 ALA HA 1 108 LEU H . . 4.510 3.843 3.530 4.337 . 0 0 "[ . 1 . ]" 1
1608 1 100 THR HA 1 108 LEU H . . 5.500 4.610 4.076 5.136 . 0 0 "[ . 1 . ]" 1
1609 1 108 LEU H 1 108 LEU HB2 . . 3.610 2.616 2.331 2.954 . 0 0 "[ . 1 . ]" 1
1610 1 108 LEU H 1 108 LEU HB3 . . 4.180 3.689 3.402 3.967 . 0 0 "[ . 1 . ]" 1
1611 1 18 ASN H 1 106 GLN HE21 . . 5.500 4.608 3.422 5.563 0.063 15 0 "[ . 1 . ]" 1
1612 1 18 ASN H 1 19 GLY H . . 3.740 2.992 2.781 3.215 . 0 0 "[ . 1 . ]" 1
1613 1 18 ASN H 1 109 THR H . . 5.500 5.047 4.554 5.416 . 0 0 "[ . 1 . ]" 1
1614 1 18 ASN H 1 108 LEU QD . . 4.120 2.596 2.023 3.251 . 0 0 "[ . 1 . ]" 1
1615 1 37 MET HG3 1 53 LEU H . . 5.500 3.244 2.424 5.067 . 0 0 "[ . 1 . ]" 1
1616 1 93 ASP HA 1 94 LEU H . . 3.070 2.234 2.068 2.398 . 0 0 "[ . 1 . ]" 1
1617 1 2 VAL HA 1 94 LEU H . . 5.460 4.397 3.946 5.460 0.000 15 0 "[ . 1 . ]" 1
1618 1 93 ASP HB3 1 94 LEU H . . 4.320 4.034 2.891 4.387 0.067 18 0 "[ . 1 . ]" 1
1619 1 94 LEU H 1 94 LEU HG . . 5.500 4.561 4.163 4.846 . 0 0 "[ . 1 . ]" 1
1620 1 12 PHE HZ 1 112 LEU H . . 5.500 5.437 4.722 5.589 0.089 4 0 "[ . 1 . ]" 1
1621 1 12 PHE QD 1 112 LEU H . . 4.860 3.720 3.149 4.352 . 0 0 "[ . 1 . ]" 1
1622 1 98 GLN HA 1 112 LEU H . . 4.410 3.386 2.827 3.981 . 0 0 "[ . 1 . ]" 1
1623 1 111 LYS QD 1 112 LEU H . . 3.640 2.691 2.193 3.500 . 0 0 "[ . 1 . ]" 1
1624 1 112 LEU H 1 112 LEU HG . . 4.450 4.446 4.357 4.500 0.050 2 0 "[ . 1 . ]" 1
1625 1 110 TYR H 1 110 TYR QE . . 5.500 5.007 4.631 5.228 . 0 0 "[ . 1 . ]" 1
1626 1 110 TYR H 1 110 TYR HB3 . . 3.930 3.741 3.523 3.897 . 0 0 "[ . 1 . ]" 1
1627 1 93 ASP H 1 101 LEU MD1 . . 5.500 4.515 2.959 5.430 . 0 0 "[ . 1 . ]" 1
1628 1 92 VAL H 1 93 ASP H . . 5.500 4.109 3.547 4.434 . 0 0 "[ . 1 . ]" 1
1629 1 93 ASP H 1 94 LEU H . . 5.430 3.867 3.367 4.566 . 0 0 "[ . 1 . ]" 1
1630 1 93 ASP H 1 93 ASP HB3 . . 3.620 3.387 2.915 3.659 0.039 2 0 "[ . 1 . ]" 1
1631 1 2 VAL MG2 1 93 ASP H . . 5.500 4.867 4.218 5.551 0.051 3 0 "[ . 1 . ]" 1
1632 1 93 ASP H 1 100 THR H . . 3.870 3.100 2.722 3.504 . 0 0 "[ . 1 . ]" 1
1633 1 93 ASP H 1 101 LEU HA . . 4.550 3.706 3.128 4.226 . 0 0 "[ . 1 . ]" 1
1634 1 15 GLU H 1 109 THR HB . . 5.500 4.786 4.099 5.467 . 0 0 "[ . 1 . ]" 1
1635 1 15 GLU H 1 110 TYR HB3 . . 5.500 4.353 3.947 4.993 . 0 0 "[ . 1 . ]" 1
1636 1 101 LEU H 1 110 TYR H . . 5.500 4.701 4.363 5.132 . 0 0 "[ . 1 . ]" 1
1637 1 101 LEU H 1 110 TYR QE . . 5.500 4.761 3.629 5.564 0.064 7 0 "[ . 1 . ]" 1
1638 1 100 THR HB 1 101 LEU H . . 4.680 4.316 3.730 4.519 . 0 0 "[ . 1 . ]" 1
1639 1 101 LEU H 1 101 LEU MD2 . . 4.890 3.157 2.769 4.515 . 0 0 "[ . 1 . ]" 1
1640 1 101 LEU H 1 108 LEU QD . . 5.500 4.741 3.960 5.112 . 0 0 "[ . 1 . ]" 1
1641 1 14 LEU HG 1 15 GLU H . . 4.860 3.954 3.018 4.594 . 0 0 "[ . 1 . ]" 1
1642 1 116 MET H 1 117 ASN H . . 4.930 3.800 2.148 4.793 . 0 0 "[ . 1 . ]" 1
1643 1 116 MET ME 1 117 ASN H . . 5.500 3.199 1.670 4.725 . 0 0 "[ . 1 . ]" 1
1644 1 2 VAL H 1 53 LEU QD . . 5.500 4.554 3.961 5.104 . 0 0 "[ . 1 . ]" 1
1645 1 116 MET HB3 1 117 ASN H . . 5.500 4.056 2.451 4.667 . 0 0 "[ . 1 . ]" 1
1646 1 31 ILE H 1 110 TYR QE . . 4.920 4.389 3.542 5.012 0.092 3 0 "[ . 1 . ]" 1
1647 1 2 VAL H 1 3 THR H . . 5.160 4.632 3.728 4.769 . 0 0 "[ . 1 . ]" 1
1648 1 2 VAL H 1 56 GLY HA2 . . 5.400 5.121 4.712 5.470 0.070 9 0 "[ . 1 . ]" 1
1649 1 2 VAL H 1 2 VAL MG1 . . 4.510 2.338 1.896 3.766 . 0 0 "[ . 1 . ]" 1
1650 1 91 GLN H 1 102 ALA H . . 3.670 3.093 2.671 3.715 0.045 9 0 "[ . 1 . ]" 1
1651 1 90 ALA HA 1 102 ALA H . . 5.030 4.517 4.129 5.036 0.006 14 0 "[ . 1 . ]" 1
1652 1 91 GLN HB2 1 102 ALA H . . 4.550 2.985 2.574 3.570 . 0 0 "[ . 1 . ]" 1
1653 1 101 LEU MD2 1 102 ALA H . . 4.920 4.040 3.830 4.504 . 0 0 "[ . 1 . ]" 1
1654 1 99 LEU HB3 1 100 THR H . . 4.810 3.918 3.419 4.539 . 0 0 "[ . 1 . ]" 1
1655 1 99 LEU H 1 100 THR H . . 5.500 4.495 4.304 4.681 . 0 0 "[ . 1 . ]" 1
1656 1 93 ASP HA 1 100 THR H . . 4.900 4.725 4.392 4.945 0.045 2 0 "[ . 1 . ]" 1
1657 1 93 ASP HB3 1 100 THR H . . 4.460 3.880 3.347 4.525 0.065 7 0 "[ . 1 . ]" 1
1658 1 94 LEU HB2 1 100 THR H . . 4.630 4.505 4.067 4.708 0.078 12 0 "[ . 1 . ]" 1
1659 1 70 CYS H 1 76 ASN HD22 . . 5.160 3.490 2.153 4.586 . 0 0 "[ . 1 . ]" 1
1660 1 70 CYS H 1 76 ASN HD21 . . 4.320 3.087 2.401 3.962 . 0 0 "[ . 1 . ]" 1
1661 1 69 MET HG3 1 70 CYS H . . 4.980 3.732 2.995 4.401 . 0 0 "[ . 1 . ]" 1
1662 1 69 MET H 1 70 CYS H . . 5.110 4.352 4.138 4.609 . 0 0 "[ . 1 . ]" 1
1663 1 58 LEU H 1 92 VAL H . . 5.190 4.167 3.225 4.588 . 0 0 "[ . 1 . ]" 1
1664 1 91 GLN H 1 92 VAL H . . 5.340 4.448 4.143 4.574 . 0 0 "[ . 1 . ]" 1
1665 1 57 GLU HA 1 92 VAL H . . 3.810 3.146 2.567 3.781 . 0 0 "[ . 1 . ]" 1
1666 1 56 GLY HA2 1 92 VAL H . . 5.320 4.119 3.639 5.199 . 0 0 "[ . 1 . ]" 1
1667 1 91 GLN QG 1 92 VAL H . . 4.970 4.471 3.820 4.896 . 0 0 "[ . 1 . ]" 1
1668 1 91 GLN H 1 91 GLN HB2 . . 3.410 2.350 2.189 2.550 . 0 0 "[ . 1 . ]" 1
1669 1 91 GLN H 1 103 THR MG . . 4.410 3.510 2.735 4.061 . 0 0 "[ . 1 . ]" 1
1670 1 91 GLN H 1 101 LEU MD2 . . 5.500 5.550 4.456 5.842 0.342 2 0 "[ . 1 . ]" 1
1671 1 95 THR H 1 96 ALA H . . 5.240 4.472 4.318 4.650 . 0 0 "[ . 1 . ]" 1
1672 1 10 HIS H 1 11 ARG H . . 5.290 4.223 4.050 4.549 . 0 0 "[ . 1 . ]" 1
1673 1 11 ARG H 1 32 SER HA . . 5.470 5.182 4.820 5.437 . 0 0 "[ . 1 . ]" 1
1674 1 11 ARG H 1 114 ASP HA . . 4.670 3.540 2.829 4.053 . 0 0 "[ . 1 . ]" 1
1675 1 10 HIS HB2 1 11 ARG H . . 4.530 4.227 3.620 4.487 . 0 0 "[ . 1 . ]" 1
1676 1 11 ARG H 1 11 ARG QD . . 5.500 4.242 3.704 4.617 . 0 0 "[ . 1 . ]" 1
1677 1 11 ARG H 1 114 ASP QB . . 3.900 2.749 1.914 3.808 . 0 0 "[ . 1 . ]" 1
1678 1 11 ARG H 1 11 ARG QB . . 3.600 2.245 2.117 2.517 . 0 0 "[ . 1 . ]" 1
1679 1 11 ARG H 1 11 ARG QG . . 4.900 3.845 2.386 4.083 . 0 0 "[ . 1 . ]" 1
1680 1 11 ARG H 1 12 PHE H . . 5.420 4.596 4.343 4.699 . 0 0 "[ . 1 . ]" 1
1681 1 45 ASN QD 1 67 ARG HA . . 5.080 3.717 2.298 4.502 . 0 0 "[ . 1 . ]" 1
1682 1 95 THR H 1 100 THR H . . 5.430 4.072 3.452 4.516 . 0 0 "[ . 1 . ]" 1
1683 1 95 THR H 1 98 GLN H . . 4.620 3.245 2.928 3.553 . 0 0 "[ . 1 . ]" 1
1684 1 95 THR H 1 98 GLN HB3 . . 4.760 4.021 3.676 4.397 . 0 0 "[ . 1 . ]" 1
1685 1 2 VAL MG2 1 95 THR H . . 5.380 5.404 4.739 5.495 0.115 11 0 "[ . 1 . ]" 1
1686 1 45 ASN H 1 45 ASN QD . . 4.640 3.151 2.187 3.801 . 0 0 "[ . 1 . ]" 1
1687 1 45 ASN QD 1 69 MET H . . 5.500 4.947 3.985 5.377 . 0 0 "[ . 1 . ]" 1
1688 1 45 ASN QD 1 69 MET ME . . 5.500 4.458 2.715 5.360 . 0 0 "[ . 1 . ]" 1
1689 1 12 PHE H 1 31 ILE H . . 4.100 3.159 2.943 3.370 . 0 0 "[ . 1 . ]" 1
1690 1 12 PHE H 1 12 PHE QD . . 4.280 3.210 2.747 3.497 . 0 0 "[ . 1 . ]" 1
1691 1 11 ARG QB 1 12 PHE H . . 4.680 3.473 2.554 3.676 . 0 0 "[ . 1 . ]" 1
1692 1 12 PHE H 1 32 SER HB2 . . 5.270 5.003 4.101 5.637 0.367 4 0 "[ . 1 . ]" 1
1693 1 18 ASN H 1 20 LYS H . . 5.500 4.765 4.370 5.372 . 0 0 "[ . 1 . ]" 1
1694 1 19 GLY H 1 20 LYS H . . 3.780 2.489 1.849 3.033 . 0 0 "[ . 1 . ]" 1
1695 1 17 VAL HB 1 20 LYS H . . 3.290 2.582 1.955 3.349 0.059 9 0 "[ . 1 . ]" 1
1696 1 20 LYS H 1 20 LYS HG2 . . 4.130 3.726 2.066 4.313 0.183 15 0 "[ . 1 . ]" 1
1697 1 17 VAL MG2 1 20 LYS H . . 5.500 3.903 3.414 4.543 . 0 0 "[ . 1 . ]" 1
1698 1 115 LEU H 1 116 MET HA . . 5.500 5.153 4.535 5.521 0.021 9 0 "[ . 1 . ]" 1
1699 1 115 LEU H 1 115 LEU HG . . 3.310 2.550 1.853 3.357 0.047 11 0 "[ . 1 . ]" 1
1700 1 43 MET H 1 44 CYS H . . 5.070 2.570 1.852 2.990 . 0 0 "[ . 1 . ]" 1
1701 1 44 CYS H 1 65 MET ME . . 4.190 4.076 3.431 4.281 0.091 1 0 "[ . 1 . ]" 1
1702 1 45 ASN QD 1 68 MET H . . 3.760 3.052 2.187 3.659 . 0 0 "[ . 1 . ]" 1
1703 1 67 ARG HB2 1 68 MET H . . 4.370 4.339 4.046 4.573 0.203 1 0 "[ . 1 . ]" 1
1704 1 67 ARG HB3 1 68 MET H . . 5.310 4.421 4.129 4.658 . 0 0 "[ . 1 . ]" 1
1705 1 48 SER H 1 65 MET H . . 5.500 5.323 5.065 5.568 0.068 1 0 "[ . 1 . ]" 1
1706 1 50 GLU H 1 63 LEU HA . . 5.500 5.080 4.185 5.579 0.079 18 0 "[ . 1 . ]" 1
1707 1 50 GLU H 1 63 LEU MD1 . . 5.500 5.302 4.592 5.602 0.102 14 0 "[ . 1 . ]" 1
1708 1 64 ALA H 1 65 MET H . . 5.070 4.375 4.014 4.644 . 0 0 "[ . 1 . ]" 1
1709 1 65 MET H 1 66 THR HA . . 5.320 4.900 4.356 5.265 . 0 0 "[ . 1 . ]" 1
1710 1 65 MET H 1 66 THR H . . 5.500 4.444 4.274 4.631 . 0 0 "[ . 1 . ]" 1
1711 1 50 GLU H 1 51 GLY H . . 5.190 4.159 3.956 4.440 . 0 0 "[ . 1 . ]" 1
1712 1 114 ASP QB 1 116 MET H . . 4.880 3.726 2.831 4.318 . 0 0 "[ . 1 . ]" 1
1713 1 79 ASP H 1 81 THR H . . 5.330 4.135 3.942 4.413 . 0 0 "[ . 1 . ]" 1
1714 1 78 LEU H 1 79 ASP H . . 3.810 2.706 2.319 2.815 . 0 0 "[ . 1 . ]" 1
1715 1 79 ASP H 1 80 ASN H . . 3.640 2.761 2.559 2.939 . 0 0 "[ . 1 . ]" 1
1716 1 79 ASP H 1 79 ASP HB3 . . 3.550 2.559 2.041 3.634 0.084 14 0 "[ . 1 . ]" 1
1717 1 78 LEU HB2 1 79 ASP H . . 4.260 3.229 2.871 3.706 . 0 0 "[ . 1 . ]" 1
1718 1 65 MET ME 1 79 ASP H . . 4.740 4.685 4.446 4.825 0.085 19 0 "[ . 1 . ]" 1
1719 1 115 LEU H 1 116 MET H . . 3.930 2.798 2.449 2.985 . 0 0 "[ . 1 . ]" 1
1720 1 116 MET H 1 116 MET ME . . 5.130 4.544 3.902 5.210 0.080 10 0 "[ . 1 . ]" 1
1721 1 115 LEU HB2 1 116 MET H . . 4.310 3.923 3.635 4.225 . 0 0 "[ . 1 . ]" 1
1722 1 68 MET H 1 69 MET H . . 4.830 4.426 4.256 4.616 . 0 0 "[ . 1 . ]" 1
1723 1 69 MET H 1 69 MET HG3 . . 4.340 4.112 3.789 4.551 0.211 16 0 "[ . 1 . ]" 1
1724 1 22 VAL H 1 23 THR H . . 4.870 4.443 4.167 4.646 . 0 0 "[ . 1 . ]" 1
1725 1 23 THR H 1 74 GLN HE22 . . 5.120 4.952 4.151 5.195 0.075 6 0 "[ . 1 . ]" 1
1726 1 17 VAL H 1 22 VAL H . . 5.240 4.610 4.243 4.921 . 0 0 "[ . 1 . ]" 1
1727 1 17 VAL MG2 1 22 VAL H . . 5.500 3.985 3.479 4.792 . 0 0 "[ . 1 . ]" 1
1728 1 31 ILE H 1 32 SER H . . 5.500 4.240 3.691 4.392 . 0 0 "[ . 1 . ]" 1
1729 1 32 SER H 1 39 ILE HA . . 5.500 4.726 4.303 5.531 0.031 10 0 "[ . 1 . ]" 1
1730 1 32 SER H 1 41 GLY HA3 . . 4.340 4.063 3.533 4.619 0.279 10 0 "[ . 1 . ]" 1
1731 1 32 SER H 1 32 SER HB2 . . 3.820 3.526 2.724 3.899 0.079 3 0 "[ . 1 . ]" 1
1732 1 31 ILE HG12 1 32 SER H . . 4.000 2.758 2.216 3.914 . 0 0 "[ . 1 . ]" 1
1733 1 114 ASP H 1 115 LEU H . . 4.340 3.072 2.591 3.826 . 0 0 "[ . 1 . ]" 1
1734 1 112 LEU HA 1 114 ASP H . . 5.220 4.535 4.056 5.228 0.008 12 0 "[ . 1 . ]" 1
1735 1 114 ASP H 1 114 ASP QB . . 3.320 2.485 2.134 2.910 . 0 0 "[ . 1 . ]" 1
1736 1 63 LEU H 1 64 ALA H . . 4.880 3.899 2.927 4.633 . 0 0 "[ . 1 . ]" 1
1737 1 62 GLY H 1 63 LEU H . . 3.920 3.140 2.138 3.862 . 0 0 "[ . 1 . ]" 1
1738 1 60 ALA MB 1 63 LEU H . . 5.160 3.602 2.688 5.194 0.034 17 0 "[ . 1 . ]" 1
1739 1 63 LEU H 1 63 LEU MD1 . . 4.650 3.834 3.342 4.542 . 0 0 "[ . 1 . ]" 1
1740 1 104 ALA H 1 105 LYS H . . 3.710 2.863 2.610 3.093 . 0 0 "[ . 1 . ]" 1
1741 1 104 ALA H 1 106 GLN H . . 5.140 5.062 4.829 5.170 0.030 13 0 "[ . 1 . ]" 1
1742 1 103 THR HB 1 104 ALA H . . 2.930 2.908 2.284 3.011 0.081 17 0 "[ . 1 . ]" 1
1743 1 77 GLU H 1 78 LEU H . . 3.640 2.423 1.992 2.864 . 0 0 "[ . 1 . ]" 1
1744 1 76 ASN H 1 77 GLU H . . 3.550 2.578 2.279 2.870 . 0 0 "[ . 1 . ]" 1
1745 1 77 GLU H 1 77 GLU QB . . 3.140 2.109 1.974 2.373 . 0 0 "[ . 1 . ]" 1
1746 1 84 GLU H 1 85 MET H . . 3.540 2.693 2.164 2.887 . 0 0 "[ . 1 . ]" 1
1747 1 84 GLU H 1 86 LEU H . . 5.290 4.303 3.989 4.510 . 0 0 "[ . 1 . ]" 1
1748 1 83 SER H 1 84 GLU H . . 3.540 2.788 2.546 2.986 . 0 0 "[ . 1 . ]" 1
1749 1 84 GLU H 1 85 MET QG . . 5.500 4.476 4.027 5.202 . 0 0 "[ . 1 . ]" 1
1750 1 110 TYR H 1 111 LYS H . . 5.500 4.474 4.369 4.551 . 0 0 "[ . 1 . ]" 1
1751 1 111 LYS H 1 112 LEU H . . 5.260 4.473 4.289 4.656 . 0 0 "[ . 1 . ]" 1
1752 1 13 VAL HA 1 111 LYS H . . 5.450 4.716 4.499 5.112 . 0 0 "[ . 1 . ]" 1
1753 1 110 TYR HB3 1 111 LYS H . . 3.790 2.548 2.082 2.984 . 0 0 "[ . 1 . ]" 1
1754 1 15 GLU HB2 1 111 LYS H . . 3.680 3.271 2.483 3.724 0.044 16 0 "[ . 1 . ]" 1
1755 1 43 MET H 1 45 ASN H . . 4.470 4.339 3.389 4.549 0.079 5 0 "[ . 1 . ]" 1
1756 1 29 PRO HB3 1 43 MET H . . 4.800 4.816 4.684 4.884 0.084 9 0 "[ . 1 . ]" 1
1757 1 43 MET H 1 65 MET ME . . 5.170 4.083 3.293 4.489 . 0 0 "[ . 1 . ]" 1
1758 1 52 LYS H 1 53 LEU HB2 . . 4.990 4.665 4.246 5.069 0.079 8 0 "[ . 1 . ]" 1
1759 1 39 ILE HG13 1 40 SER H . . 5.500 5.271 4.861 5.423 . 0 0 "[ . 1 . ]" 1
1760 1 43 MET H 1 46 ARG HA . . 4.880 3.738 2.890 4.073 . 0 0 "[ . 1 . ]" 1
1761 1 34 GLY H 1 40 SER H . . 5.500 5.274 4.397 5.571 0.071 3 0 "[ . 1 . ]" 1
1762 1 32 SER H 1 40 SER H . . 3.900 3.136 2.881 3.930 0.030 10 0 "[ . 1 . ]" 1
1763 1 40 SER H 1 41 GLY H . . 5.280 4.249 3.792 4.542 . 0 0 "[ . 1 . ]" 1
1764 1 33 PHE HA 1 40 SER H . . 4.770 3.379 2.755 3.907 . 0 0 "[ . 1 . ]" 1
1765 1 40 SER H 1 40 SER HB2 . . 3.890 2.859 2.365 3.808 . 0 0 "[ . 1 . ]" 1
1766 1 54 SER H 1 56 GLY HA2 . . 5.500 5.302 4.654 5.568 0.068 10 0 "[ . 1 . ]" 1
1767 1 53 LEU HB2 1 54 SER H . . 4.850 4.329 3.963 4.661 . 0 0 "[ . 1 . ]" 1
1768 1 54 SER H 1 55 ASN H . . 5.180 1.907 1.551 2.373 . 0 0 "[ . 1 . ]" 1
1769 1 36 LYS H 1 37 MET H . . 3.830 2.950 2.054 3.891 0.061 11 0 "[ . 1 . ]" 1
1770 1 36 LYS H 1 38 MET H . . 4.600 4.192 2.395 4.679 0.079 10 0 "[ . 1 . ]" 1
1771 1 17 VAL H 1 20 LYS H . . 3.900 3.570 2.878 3.979 0.079 9 0 "[ . 1 . ]" 1
1772 1 17 VAL H 1 17 VAL HB . . 3.690 2.582 2.312 2.815 . 0 0 "[ . 1 . ]" 1
1773 1 17 VAL H 1 18 ASN H . . 5.490 4.506 4.216 4.602 . 0 0 "[ . 1 . ]" 1
1774 1 81 THR MG 1 82 ILE H . . 3.780 3.446 2.987 3.741 . 0 0 "[ . 1 . ]" 1
1775 1 80 ASN H 1 82 ILE H . . 5.260 4.238 3.988 4.527 . 0 0 "[ . 1 . ]" 1
1776 1 78 LEU H 1 80 ASN H . . 4.970 4.372 4.032 4.735 . 0 0 "[ . 1 . ]" 1
1777 1 78 LEU H 1 78 LEU HB2 . . 3.310 2.237 2.060 2.404 . 0 0 "[ . 1 . ]" 1
1778 1 55 ASN H 1 57 GLU H . . 4.910 3.038 2.731 3.933 . 0 0 "[ . 1 . ]" 1
1779 1 56 GLY H 1 57 GLU H . . 3.720 2.432 1.585 3.028 . 0 0 "[ . 1 . ]" 1
1780 1 54 SER H 1 57 GLU H . . 3.750 3.632 3.186 3.829 0.079 16 0 "[ . 1 . ]" 1
1781 1 16 SER H 1 17 VAL H . . 5.500 4.309 4.187 4.410 . 0 0 "[ . 1 . ]" 1
1782 1 97 ASN HB2 1 98 GLN H . . 5.400 4.383 4.002 4.559 . 0 0 "[ . 1 . ]" 1
1783 1 2 VAL MG1 1 57 GLU H . . 5.500 5.147 4.129 5.604 0.104 15 0 "[ . 1 . ]" 1
1784 1 46 ARG H 1 46 ARG QB . . 3.380 3.211 2.721 3.299 . 0 0 "[ . 1 . ]" 1
1785 1 96 ALA H 1 98 GLN H . . 5.500 4.263 4.047 4.726 . 0 0 "[ . 1 . ]" 1
1786 1 96 ALA HA 1 98 GLN H . . 5.500 4.934 4.669 5.189 . 0 0 "[ . 1 . ]" 1
1787 1 98 GLN H 1 98 GLN HG3 . . 4.770 4.794 4.639 5.346 0.576 2 1 "[ + . 1 . ]" 1
1788 1 98 GLN H 1 98 GLN HB3 . . 3.320 2.849 2.593 3.201 . 0 0 "[ . 1 . ]" 1
1789 1 96 ALA MB 1 98 GLN H . . 4.880 4.452 4.214 4.811 . 0 0 "[ . 1 . ]" 1
1790 1 97 ASN HB3 1 98 GLN H . . 5.460 4.728 4.628 4.798 . 0 0 "[ . 1 . ]" 1
1791 1 26 LYS H 1 27 ASN H . . 4.050 2.684 1.693 4.131 0.081 12 0 "[ . 1 . ]" 1
1792 1 25 ASP H 1 26 LYS H . . 3.890 3.200 1.817 3.965 0.075 2 0 "[ . 1 . ]" 1
1793 1 24 SER HB2 1 26 LYS H . . 4.930 4.750 3.658 5.900 0.970 9 3 "[ .* +1 - . ]" 1
1794 1 44 CYS H 1 45 ASN H . . 3.500 2.154 1.641 2.633 . 0 0 "[ . 1 . ]" 1
1795 1 45 ASN H 1 46 ARG H . . 5.500 2.950 2.209 3.146 . 0 0 "[ . 1 . ]" 1
1796 1 45 ASN H 1 45 ASN HB3 . . 3.650 3.459 3.138 3.699 0.049 18 0 "[ . 1 . ]" 1
1797 1 42 SER HA 1 45 ASN H . . 5.500 5.133 4.319 5.568 0.068 7 0 "[ . 1 . ]" 1
1798 1 86 LEU HA 1 87 LYS H . . 3.560 3.524 3.436 3.607 0.047 19 0 "[ . 1 . ]" 1
1799 1 84 GLU HA 1 87 LYS H . . 4.340 3.439 2.960 3.872 . 0 0 "[ . 1 . ]" 1
1800 1 83 SER HA 1 87 LYS H . . 4.780 4.576 4.180 4.844 0.064 12 0 "[ . 1 . ]" 1
1801 1 87 LYS H 1 87 LYS HB2 . . 3.180 2.147 2.045 2.336 . 0 0 "[ . 1 . ]" 1
1802 1 87 LYS H 1 87 LYS QD . . 4.080 3.711 2.883 4.183 0.103 9 0 "[ . 1 . ]" 1
1803 1 86 LEU HB3 1 87 LYS H . . 4.410 3.734 3.403 3.964 . 0 0 "[ . 1 . ]" 1
1804 1 59 THR MG 1 87 LYS H . . 5.500 5.476 4.867 5.598 0.098 5 0 "[ . 1 . ]" 1
1805 1 13 VAL H 1 31 ILE MG . . 5.500 4.466 4.087 4.902 . 0 0 "[ . 1 . ]" 1
1806 1 13 VAL H 1 111 LYS H . . 3.800 2.657 2.290 3.164 . 0 0 "[ . 1 . ]" 1
1807 1 13 VAL H 1 112 LEU HA . . 4.980 4.559 4.296 4.852 . 0 0 "[ . 1 . ]" 1
1808 1 12 PHE HB2 1 13 VAL H . . 4.750 3.974 3.565 4.505 . 0 0 "[ . 1 . ]" 1
1809 1 11 ARG QG 1 13 VAL H . . 4.390 4.322 4.252 4.367 . 0 0 "[ . 1 . ]" 1
1810 1 67 ARG H 1 68 MET H . . 4.060 3.103 2.218 3.707 . 0 0 "[ . 1 . ]" 1
1811 1 67 ARG H 1 68 MET HG2 . . 5.320 4.239 3.652 5.383 0.063 11 0 "[ . 1 . ]" 1
1812 1 67 ARG H 1 67 ARG QG . . 3.670 2.871 2.180 3.548 . 0 0 "[ . 1 . ]" 1
1813 1 11 ARG QB 1 11 ARG HE . . 4.730 3.817 2.234 4.171 . 0 0 "[ . 1 . ]" 1
1814 1 81 THR H 1 82 ILE H . . 4.200 3.016 2.561 3.368 . 0 0 "[ . 1 . ]" 1
1815 1 81 THR H 1 84 GLU H . . 5.500 5.012 4.770 5.285 . 0 0 "[ . 1 . ]" 1
1816 1 81 THR H 1 83 SER H . . 5.120 4.268 3.940 4.572 . 0 0 "[ . 1 . ]" 1
1817 1 78 LEU HA 1 81 THR H . . 3.210 3.001 2.672 3.277 0.067 7 0 "[ . 1 . ]" 1
1818 1 81 THR H 1 82 ILE MG . . 5.500 4.425 3.893 4.848 . 0 0 "[ . 1 . ]" 1
1819 1 43 MET H 1 47 PHE H . . 5.500 4.748 4.288 5.130 . 0 0 "[ . 1 . ]" 1
1820 1 41 GLY H 1 47 PHE H . . 3.970 3.424 2.964 3.942 . 0 0 "[ . 1 . ]" 1
1821 1 24 SER H 1 25 ASP H . . 3.870 3.268 2.186 3.963 0.093 7 0 "[ . 1 . ]" 1
1822 1 23 THR HB 1 24 SER H . . 3.980 3.689 2.628 4.062 0.082 15 0 "[ . 1 . ]" 1
1823 1 24 SER H 1 24 SER HB2 . . 3.700 3.101 2.418 3.864 0.164 7 0 "[ . 1 . ]" 1
1824 1 74 GLN H 1 76 ASN H . . 5.390 4.166 3.930 4.523 . 0 0 "[ . 1 . ]" 1
1825 1 83 SER H 1 85 MET H . . 5.240 4.083 3.946 4.247 . 0 0 "[ . 1 . ]" 1
1826 1 82 ILE HA 1 85 MET H . . 4.080 3.262 3.106 3.640 . 0 0 "[ . 1 . ]" 1
1827 1 81 THR MG 1 85 MET H . . 5.500 4.455 3.803 5.061 . 0 0 "[ . 1 . ]" 1
1828 1 82 ILE MD 1 85 MET H . . 5.500 4.463 4.114 4.737 . 0 0 "[ . 1 . ]" 1
1829 1 85 MET H 1 86 LEU QD . . 5.500 3.812 3.429 4.769 . 0 0 "[ . 1 . ]" 1
1830 1 72 ASN HD21 1 74 GLN H . . 5.130 4.057 2.724 5.095 . 0 0 "[ . 1 . ]" 1
1831 1 74 GLN H 1 75 LEU H . . 3.480 2.859 2.678 3.141 . 0 0 "[ . 1 . ]" 1
1832 1 72 ASN QB 1 74 GLN H . . 5.060 3.733 2.427 4.300 . 0 0 "[ . 1 . ]" 1
1833 1 74 GLN H 1 74 GLN HB3 . . 3.000 2.631 2.250 2.926 . 0 0 "[ . 1 . ]" 1
1834 1 32 SER H 1 33 PHE H . . 5.500 4.329 4.214 4.514 . 0 0 "[ . 1 . ]" 1
1835 1 33 PHE H 1 33 PHE QD . . 4.180 3.097 2.494 3.644 . 0 0 "[ . 1 . ]" 1
1836 1 11 ARG HA 1 33 PHE H . . 4.890 3.928 2.995 4.428 . 0 0 "[ . 1 . ]" 1
1837 1 32 SER HB2 1 33 PHE H . . 3.800 3.005 2.176 3.868 0.068 1 0 "[ . 1 . ]" 1
1838 1 11 ARG QB 1 33 PHE H . . 5.500 5.135 4.241 5.577 0.077 12 0 "[ . 1 . ]" 1
1839 1 27 ASN H 1 27 ASN HB2 . . 3.740 3.228 2.496 4.100 0.360 17 0 "[ . 1 . ]" 1
1840 1 35 GLU H 1 36 LYS H . . 5.500 4.095 2.918 4.799 . 0 0 "[ . 1 . ]" 1
1841 1 35 GLU H 1 38 MET H . . 5.500 4.841 4.031 5.379 . 0 0 "[ . 1 . ]" 1
1842 1 8 GLN QG 1 35 GLU H . . 4.140 3.669 2.430 4.125 . 0 0 "[ . 1 . ]" 1
1843 1 46 ARG HE 1 47 PHE H . . 5.500 5.028 3.477 5.576 0.076 7 0 "[ . 1 . ]" 1
1844 1 80 ASN H 1 81 THR H . . 3.380 2.323 2.105 2.587 . 0 0 "[ . 1 . ]" 1
1845 1 78 LEU HA 1 80 ASN H . . 3.890 3.891 3.397 3.973 0.083 2 0 "[ . 1 . ]" 1
1846 1 79 ASP HB3 1 80 ASN H . . 3.760 3.299 2.214 3.946 0.186 6 0 "[ . 1 . ]" 1
1847 1 80 ASN H 1 80 ASN HB3 . . 3.440 3.276 2.338 3.792 0.352 12 0 "[ . 1 . ]" 1
1848 1 82 ILE H 1 83 SER H . . 3.590 2.704 2.555 2.813 . 0 0 "[ . 1 . ]" 1
1849 1 83 SER H 1 83 SER HB2 . . 3.240 2.361 1.997 3.530 0.290 18 0 "[ . 1 . ]" 1
1850 1 81 THR MG 1 83 SER H . . 5.500 5.141 4.879 5.359 . 0 0 "[ . 1 . ]" 1
1851 1 103 THR HB 1 106 GLN H . . 4.330 3.123 2.744 3.635 . 0 0 "[ . 1 . ]" 1
1852 1 80 ASN H 1 81 THR HA . . 5.500 4.982 4.736 5.209 . 0 0 "[ . 1 . ]" 1
1853 1 80 ASN H 1 83 SER H . . 4.810 4.777 4.555 4.894 0.084 12 0 "[ . 1 . ]" 1
1854 1 83 SER H 1 84 GLU QB . . 5.170 4.445 4.266 4.774 . 0 0 "[ . 1 . ]" 1
1855 1 65 MET ME 1 83 SER H . . 5.230 3.757 3.200 4.632 . 0 0 "[ . 1 . ]" 1
1856 1 105 LYS H 1 106 GLN H . . 3.220 3.051 2.580 3.289 0.069 7 0 "[ . 1 . ]" 1
1857 1 105 LYS HG2 1 106 GLN H . . 4.740 4.695 3.817 4.910 0.170 17 0 "[ . 1 . ]" 1
1858 1 38 MET H 1 39 ILE H . . 5.230 4.458 2.264 4.658 . 0 0 "[ . 1 . ]" 1
1859 1 37 MET H 1 38 MET H . . 3.890 2.677 1.843 3.208 . 0 0 "[ . 1 . ]" 1
1860 1 33 PHE QD 1 38 MET H . . 5.290 5.190 4.648 5.374 0.084 13 0 "[ . 1 . ]" 1
1861 1 36 LYS HA 1 38 MET H . . 5.500 4.568 4.096 5.294 . 0 0 "[ . 1 . ]" 1
1862 1 109 THR H 1 110 TYR H . . 5.240 4.182 3.860 4.474 . 0 0 "[ . 1 . ]" 1
1863 1 108 LEU H 1 109 THR H . . 5.320 4.387 4.192 4.525 . 0 0 "[ . 1 . ]" 1
1864 1 16 SER H 1 109 THR H . . 4.200 3.467 3.134 3.874 . 0 0 "[ . 1 . ]" 1
1865 1 17 VAL HA 1 109 THR H . . 5.500 3.531 3.035 3.892 . 0 0 "[ . 1 . ]" 1
1866 1 108 LEU HB2 1 109 THR H . . 4.680 3.972 3.586 4.247 . 0 0 "[ . 1 . ]" 1
1867 1 87 LYS H 1 88 GLU H . . 3.530 2.596 2.387 3.108 . 0 0 "[ . 1 . ]" 1
1868 1 85 MET HA 1 88 GLU H . . 4.850 4.041 3.654 4.605 . 0 0 "[ . 1 . ]" 1
1869 1 88 GLU H 1 103 THR MG . . 5.500 4.096 3.766 4.670 . 0 0 "[ . 1 . ]" 1
1870 1 59 THR MG 1 88 GLU H . . 5.500 4.737 4.301 5.273 . 0 0 "[ . 1 . ]" 1
1871 1 3 THR H 1 6 GLN H . . 4.490 4.022 3.562 4.448 . 0 0 "[ . 1 . ]" 1
1872 1 6 GLN H 1 7 LEU H . . 3.420 3.020 2.682 3.268 . 0 0 "[ . 1 . ]" 1
1873 1 6 GLN H 1 6 GLN HB3 . . 3.540 2.712 2.365 3.649 0.109 3 0 "[ . 1 . ]" 1
1874 1 6 GLN H 1 6 GLN HB2 . . 3.740 3.447 2.678 3.795 0.055 17 0 "[ . 1 . ]" 1
1875 1 6 GLN H 1 7 LEU HG . . 4.740 4.007 3.685 4.328 . 0 0 "[ . 1 . ]" 1
1876 1 28 PRO HB2 1 30 GLU H . . 4.050 3.954 3.401 4.134 0.084 9 0 "[ . 1 . ]" 1
1877 1 30 GLU H 1 31 ILE H . . 5.500 4.579 4.363 4.716 . 0 0 "[ . 1 . ]" 1
1878 1 75 LEU QD 1 76 ASN H . . 5.500 4.132 3.901 4.307 . 0 0 "[ . 1 . ]" 1
1879 1 76 ASN H 1 78 LEU H . . 5.410 3.982 3.669 4.356 . 0 0 "[ . 1 . ]" 1
1880 1 75 LEU H 1 76 ASN H . . 3.490 2.628 2.401 2.856 . 0 0 "[ . 1 . ]" 1
1881 1 76 ASN H 1 76 ASN QB . . 3.660 2.124 1.932 2.250 . 0 0 "[ . 1 . ]" 1
1882 1 18 ASN H 1 107 THR H . . 4.290 4.178 3.610 4.365 0.075 17 0 "[ . 1 . ]" 1
1883 1 107 THR H 1 108 LEU H . . 5.150 4.358 4.274 4.468 . 0 0 "[ . 1 . ]" 1
1884 1 106 GLN H 1 107 THR H . . 5.070 4.316 4.217 4.426 . 0 0 "[ . 1 . ]" 1
1885 1 106 GLN HE21 1 107 THR H . . 5.030 4.654 3.787 5.105 0.075 11 0 "[ . 1 . ]" 1
1886 1 18 ASN HA 1 107 THR H . . 4.550 4.204 3.694 4.586 0.036 13 0 "[ . 1 . ]" 1
1887 1 74 GLN HB3 1 75 LEU H . . 3.830 2.654 2.165 3.058 . 0 0 "[ . 1 . ]" 1
1888 1 73 PRO HA 1 75 LEU H . . 5.500 4.403 3.862 4.882 . 0 0 "[ . 1 . ]" 1
1889 1 74 GLN HG3 1 75 LEU H . . 5.500 4.819 4.329 5.166 . 0 0 "[ . 1 . ]" 1
1890 1 107 THR H 1 108 LEU QD . . 5.170 3.696 3.111 4.637 . 0 0 "[ . 1 . ]" 1
1891 1 71 ALA H 1 72 ASN H . . 4.180 2.988 2.237 3.445 . 0 0 "[ . 1 . ]" 1
1892 1 70 CYS HA 1 72 ASN H . . 4.110 4.151 4.003 4.203 0.093 11 0 "[ . 1 . ]" 1
1893 1 70 CYS HB3 1 72 ASN H . . 3.750 3.349 1.923 4.187 0.437 19 0 "[ . 1 . ]" 1
1894 1 72 ASN H 1 72 ASN QB . . 3.130 2.641 2.187 3.135 0.005 18 0 "[ . 1 . ]" 1
1895 1 58 LEU H 1 59 THR H . . 5.360 4.127 3.880 4.411 . 0 0 "[ . 1 . ]" 1
1896 1 3 THR H 1 6 GLN QG . . 4.480 2.232 1.942 2.786 . 0 0 "[ . 1 . ]" 1
1897 1 3 THR H 1 6 GLN HB2 . . 4.760 4.515 3.031 4.849 0.089 5 0 "[ . 1 . ]" 1
1898 1 2 VAL MG1 1 3 THR H . . 4.360 3.797 2.369 4.405 0.045 9 0 "[ . 1 . ]" 1
1899 1 3 THR H 1 53 LEU QD . . 5.500 3.736 3.271 4.733 . 0 0 "[ . 1 . ]" 1
1900 1 5 GLU H 1 6 GLN H . . 3.660 2.980 2.834 3.139 . 0 0 "[ . 1 . ]" 1
1901 1 5 GLU H 1 7 LEU H . . 5.110 4.375 4.222 4.599 . 0 0 "[ . 1 . ]" 1
1902 1 4 PRO HD2 1 5 GLU H . . 3.560 2.875 2.419 3.241 . 0 0 "[ . 1 . ]" 1
1903 1 4 PRO HB3 1 5 GLU H . . 3.890 3.978 3.962 3.986 0.096 3 0 "[ . 1 . ]" 1
1904 1 5 GLU H 1 5 GLU HB3 . . 3.350 2.994 2.602 3.434 0.084 5 0 "[ . 1 . ]" 1
1905 1 4 PRO HB2 1 5 GLU H . . 3.830 3.134 2.800 3.377 . 0 0 "[ . 1 . ]" 1
1906 1 34 GLY H 1 35 GLU H . . 4.840 4.183 3.417 4.384 . 0 0 "[ . 1 . ]" 1
1907 1 33 PHE H 1 34 GLY H . . 5.500 4.374 4.127 4.540 . 0 0 "[ . 1 . ]" 1
1908 1 33 PHE QD 1 34 GLY H . . 5.370 4.065 3.693 4.396 . 0 0 "[ . 1 . ]" 1
1909 1 34 GLY H 1 38 MET H . . 4.670 3.357 2.917 3.735 . 0 0 "[ . 1 . ]" 1
1910 1 7 LEU H 1 8 GLN QG . . 5.400 4.370 3.277 5.074 . 0 0 "[ . 1 . ]" 1
1911 1 5 GLU HA 1 7 LEU H . . 4.390 3.561 3.375 3.715 . 0 0 "[ . 1 . ]" 1
1912 1 6 GLN QG 1 7 LEU H . . 5.040 3.740 3.402 4.397 . 0 0 "[ . 1 . ]" 1
1913 1 7 LEU H 1 8 GLN HB2 . . 5.500 3.988 3.297 5.664 0.164 11 0 "[ . 1 . ]" 1
1914 1 7 LEU H 1 7 LEU HB2 . . 3.380 2.633 2.512 2.783 . 0 0 "[ . 1 . ]" 1
1915 1 49 GLY H 1 51 GLY H . . 4.720 4.767 4.468 4.820 0.100 11 0 "[ . 1 . ]" 1
1916 1 39 ILE HG13 1 51 GLY H . . 4.380 2.450 2.077 3.077 . 0 0 "[ . 1 . ]" 1
1917 1 39 ILE H 1 51 GLY H . . 4.640 3.271 2.845 3.885 . 0 0 "[ . 1 . ]" 1
1918 1 69 MET H 1 76 ASN HD22 . . 5.500 5.485 5.128 5.595 0.095 3 0 "[ . 1 . ]" 1
1919 1 80 ASN HA 1 80 ASN HD22 . . 5.500 4.620 3.844 5.320 . 0 0 "[ . 1 . ]" 1
1920 1 80 ASN H 1 80 ASN HD22 . . 5.500 4.333 2.884 5.584 0.084 7 0 "[ . 1 . ]" 1
1921 1 69 MET HA 1 76 ASN HD21 . . 5.220 3.461 2.359 4.339 . 0 0 "[ . 1 . ]" 1
1922 1 73 PRO HA 1 76 ASN HD21 . . 4.860 4.349 3.630 4.940 0.080 2 0 "[ . 1 . ]" 1
1923 1 69 MET HG3 1 76 ASN HD21 . . 5.500 4.615 3.247 5.567 0.067 6 0 "[ . 1 . ]" 1
1924 1 47 PHE HA 1 66 THR H . . 4.840 4.853 4.589 4.917 0.077 2 0 "[ . 1 . ]" 1
1925 1 45 ASN HB2 1 66 THR H . . 3.970 3.766 3.119 4.028 0.058 3 0 "[ . 1 . ]" 1
1926 1 7 LEU H 1 8 GLN H . . 3.310 2.119 1.977 2.320 . 0 0 "[ . 1 . ]" 1
1927 1 7 LEU HB2 1 8 GLN H . . 3.590 2.341 2.124 2.517 . 0 0 "[ . 1 . ]" 1
1928 1 9 HIS H 1 10 HIS H . . 3.590 2.190 1.890 2.502 . 0 0 "[ . 1 . ]" 1
1929 1 8 GLN HA 1 10 HIS H . . 4.440 4.150 3.909 4.424 . 0 0 "[ . 1 . ]" 1
1930 1 10 HIS H 1 10 HIS HB2 . . 3.660 2.640 2.491 2.729 . 0 0 "[ . 1 . ]" 1
1931 1 18 ASN QD 1 19 GLY HA2 . . 4.520 3.801 2.926 5.468 0.948 10 1 "[ . + . ]" 1
1932 1 18 ASN QD 1 106 GLN HB3 . . 5.500 4.315 2.523 5.441 . 0 0 "[ . 1 . ]" 1
1933 1 102 ALA H 1 103 THR H . . 5.500 4.344 3.183 4.620 . 0 0 "[ . 1 . ]" 1
1934 1 103 THR H 1 106 GLN H . . 3.950 3.384 3.091 3.681 . 0 0 "[ . 1 . ]" 1
1935 1 103 THR H 1 105 LYS QB . . 5.160 4.813 4.633 4.996 . 0 0 "[ . 1 . ]" 1
1936 1 103 THR H 1 103 THR MG . . 3.780 3.879 3.650 3.913 0.133 11 0 "[ . 1 . ]" 1
1937 1 91 GLN H 1 103 THR H . . 4.840 4.876 4.773 4.928 0.088 9 0 "[ . 1 . ]" 1
1938 1 26 LYS HB2 1 27 ASN HD22 . . 5.500 5.412 4.442 6.225 0.725 15 3 "[ .-* 1 + ]" 1
1939 1 27 ASN H 1 27 ASN HD21 . . 5.500 3.568 2.136 4.949 . 0 0 "[ . 1 . ]" 1
1940 1 55 ASN HD21 1 57 GLU H . . 5.130 4.628 3.455 5.208 0.078 15 0 "[ . 1 . ]" 1
1941 1 85 MET H 1 86 LEU H . . 3.740 2.547 2.173 2.743 . 0 0 "[ . 1 . ]" 1
1942 1 86 LEU H 1 87 LYS H . . 3.790 2.512 1.935 2.782 . 0 0 "[ . 1 . ]" 1
1943 1 83 SER HA 1 86 LEU H . . 4.270 3.967 3.626 4.332 0.062 3 0 "[ . 1 . ]" 1
1944 1 86 LEU H 1 86 LEU HB3 . . 3.900 3.511 3.353 3.629 . 0 0 "[ . 1 . ]" 1
1945 1 96 ALA H 1 97 ASN H . . 4.460 3.142 2.851 3.405 . 0 0 "[ . 1 . ]" 1
1946 1 97 ASN H 1 98 GLN HA . . 5.500 4.595 4.347 4.823 . 0 0 "[ . 1 . ]" 1
1947 1 95 THR HA 1 97 ASN H . . 5.300 4.744 4.380 5.116 . 0 0 "[ . 1 . ]" 1
1948 1 95 THR HB 1 97 ASN H . . 5.500 3.816 2.805 5.284 . 0 0 "[ . 1 . ]" 1
1949 1 97 ASN H 1 98 GLN HB3 . . 5.160 4.043 3.764 4.444 . 0 0 "[ . 1 . ]" 1
1950 1 94 LEU QD 1 97 ASN H . . 5.500 3.714 3.177 4.083 . 0 0 "[ . 1 . ]" 1
1951 1 97 ASN H 1 97 ASN HD22 . . 5.500 4.455 3.806 4.996 . 0 0 "[ . 1 . ]" 1
1952 1 95 THR MG 1 97 ASN H . . 5.500 3.384 2.175 4.340 . 0 0 "[ . 1 . ]" 1
1953 1 91 GLN H 1 91 GLN HE21 . . 5.500 3.543 2.644 4.618 . 0 0 "[ . 1 . ]" 1
1954 1 91 GLN HE21 1 103 THR HA . . 5.500 4.496 2.386 5.583 0.083 10 0 "[ . 1 . ]" 1
1955 1 91 GLN HA 1 91 GLN HE21 . . 5.500 3.587 2.531 4.668 . 0 0 "[ . 1 . ]" 1
1956 1 72 ASN HD22 1 74 GLN HB3 . . 5.500 3.277 1.918 5.575 0.075 18 0 "[ . 1 . ]" 1
1957 1 97 ASN HB2 1 97 ASN HD22 . . 3.980 3.928 3.687 4.056 0.076 6 0 "[ . 1 . ]" 1
1958 1 96 ALA MB 1 97 ASN HD22 . . 5.500 3.460 2.580 4.563 . 0 0 "[ . 1 . ]" 1
1959 1 97 ASN HD22 1 112 LEU MD2 . . 5.500 5.414 4.793 5.599 0.099 3 0 "[ . 1 . ]" 1
1960 1 97 ASN HA 1 97 ASN HD22 . . 5.500 5.128 4.492 5.452 . 0 0 "[ . 1 . ]" 1
1961 1 72 ASN HD21 1 74 GLN HB3 . . 4.960 3.359 2.048 5.001 0.041 10 0 "[ . 1 . ]" 1
1962 1 96 ALA MB 1 97 ASN HD21 . . 5.500 3.546 2.590 4.628 . 0 0 "[ . 1 . ]" 1
1963 1 41 GLY HA3 1 42 SER H . . 3.300 2.625 2.461 2.857 . 0 0 "[ . 1 . ]" 1
1964 1 8 GLN HE21 1 37 MET H . . 5.500 4.799 2.881 5.548 0.048 15 0 "[ . 1 . ]" 1
1965 1 37 MET H 1 38 MET QB . . 4.500 4.369 4.084 4.455 . 0 0 "[ . 1 . ]" 1
1966 1 15 GLU H 1 16 SER H . . 3.300 2.533 2.132 2.875 . 0 0 "[ . 1 . ]" 1
1967 1 14 LEU HA 1 16 SER H . . 4.160 3.856 3.506 4.228 0.068 14 0 "[ . 1 . ]" 1
1968 1 15 GLU HB2 1 16 SER H . . 3.730 3.351 2.775 3.803 0.073 19 0 "[ . 1 . ]" 1
1969 1 14 LEU HG 1 16 SER H . . 4.280 3.905 3.408 4.336 0.056 2 0 "[ . 1 . ]" 1
1970 1 16 SER H 1 17 VAL MG2 . . 5.500 4.685 4.169 5.043 . 0 0 "[ . 1 . ]" 1
1971 1 98 GLN HA 1 98 GLN HE21 . . 5.500 4.798 4.455 5.177 . 0 0 "[ . 1 . ]" 1
1972 1 98 GLN HB3 1 98 GLN HE21 . . 3.870 2.631 1.945 3.259 . 0 0 "[ . 1 . ]" 1
1973 1 98 GLN HB3 1 98 GLN HE22 . . 4.620 3.777 3.398 4.240 . 0 0 "[ . 1 . ]" 1
1974 1 103 THR H 1 105 LYS H . . 5.180 4.383 3.878 4.779 . 0 0 "[ . 1 . ]" 1
1975 1 103 THR HB 1 105 LYS H . . 3.780 2.344 1.870 2.666 . 0 0 "[ . 1 . ]" 1
1976 1 85 MET ME 1 105 LYS H . . 4.660 4.649 4.069 4.764 0.104 18 0 "[ . 1 . ]" 1
1977 1 105 LYS H 1 105 LYS HG3 . . 3.610 3.779 2.989 4.291 0.681 17 4 "[* . * 1 - + ]" 1
1978 1 48 SER H 1 64 ALA H . . 3.840 2.920 2.278 3.650 . 0 0 "[ . 1 . ]" 1
1979 1 47 PHE QD 1 48 SER H . . 4.880 3.390 2.938 4.090 . 0 0 "[ . 1 . ]" 1
1980 1 48 SER H 1 63 LEU HA . . 5.080 3.615 3.057 4.132 . 0 0 "[ . 1 . ]" 1
1981 1 48 SER H 1 63 LEU MD1 . . 4.840 3.665 2.887 4.258 . 0 0 "[ . 1 . ]" 1
1982 1 8 GLN HA 1 9 HIS H . . 3.420 3.304 3.084 3.437 0.017 6 0 "[ . 1 . ]" 1
1983 1 9 HIS H 1 10 HIS HB2 . . 5.050 3.809 3.580 4.041 . 0 0 "[ . 1 . ]" 1
1984 1 8 GLN QG 1 9 HIS H . . 5.440 4.395 3.324 4.824 . 0 0 "[ . 1 . ]" 1
1985 1 7 LEU HB2 1 9 HIS H . . 4.720 4.790 4.740 4.807 0.087 18 0 "[ . 1 . ]" 1
1986 1 2 VAL HA 1 6 GLN HE21 . . 5.500 3.105 2.030 5.177 . 0 0 "[ . 1 . ]" 1
1987 1 6 GLN HE21 1 7 LEU HG . . 5.500 4.514 3.854 5.574 0.074 14 0 "[ . 1 . ]" 1
1988 1 74 GLN HA 1 74 GLN HE21 . . 5.500 4.992 4.695 5.157 . 0 0 "[ . 1 . ]" 1
1989 1 17 VAL MG2 1 74 GLN HE21 . . 4.710 2.538 1.989 3.712 . 0 0 "[ . 1 . ]" 1
1990 1 3 THR H 1 6 GLN HE22 . . 5.380 3.484 2.747 4.402 . 0 0 "[ . 1 . ]" 1
1991 1 17 VAL MG2 1 74 GLN HE22 . . 5.040 3.085 1.871 4.120 . 0 0 "[ . 1 . ]" 1
1992 1 61 LYS H 1 62 GLY H . . 4.420 3.225 1.647 4.422 0.002 3 0 "[ . 1 . ]" 1
1993 1 60 ALA HA 1 62 GLY H . . 5.500 4.194 3.208 5.584 0.084 3 0 "[ . 1 . ]" 1
1994 1 61 LYS HB2 1 62 GLY H . . 4.510 4.211 2.226 4.668 0.158 19 0 "[ . 1 . ]" 1
1995 1 81 THR HA 1 106 GLN HE21 . . 5.500 5.324 3.993 5.586 0.086 6 0 "[ . 1 . ]" 1
1996 1 106 GLN HE22 1 108 LEU QD . . 5.500 3.964 2.601 5.403 . 0 0 "[ . 1 . ]" 1
1997 1 87 LYS H 1 89 GLY H . . 4.990 4.018 3.723 4.402 . 0 0 "[ . 1 . ]" 1
1998 1 89 GLY H 1 103 THR MG . . 5.500 3.385 2.730 3.977 . 0 0 "[ . 1 . ]" 1
1999 1 88 GLU HG3 1 89 GLY H . . 5.500 4.155 2.209 5.556 0.056 14 0 "[ . 1 . ]" 1
2000 1 5 GLU H 1 8 GLN HE21 . . 5.500 3.749 3.397 4.359 . 0 0 "[ . 1 . ]" 1
2001 1 8 GLN H 1 8 GLN HE21 . . 5.500 2.876 2.576 3.525 . 0 0 "[ . 1 . ]" 1
2002 1 7 LEU HB2 1 8 GLN HE21 . . 4.300 4.180 3.836 4.384 0.084 17 0 "[ . 1 . ]" 1
2003 1 5 GLU H 1 8 GLN HE22 . . 5.100 3.895 3.311 4.390 . 0 0 "[ . 1 . ]" 1
2004 1 7 LEU HB2 1 8 GLN HE22 . . 5.500 5.174 2.970 5.591 0.091 9 0 "[ . 1 . ]" 1
2005 1 4 PRO HB3 1 8 GLN HE21 . . 5.500 4.203 3.179 4.754 . 0 0 "[ . 1 . ]" 1
2006 1 41 GLY H 1 42 SER H . . 4.800 4.355 4.294 4.440 . 0 0 "[ . 1 . ]" 1
2007 1 41 GLY H 1 47 PHE QD . . 5.500 4.131 3.667 4.717 . 0 0 "[ . 1 . ]" 1
2008 1 41 GLY H 1 48 SER HA . . 4.430 3.779 3.391 4.261 . 0 0 "[ . 1 . ]" 1
2009 1 39 ILE H 1 49 GLY H . . 4.100 2.912 2.639 4.172 0.072 8 0 "[ . 1 . ]" 1
2010 1 47 PHE QD 1 49 GLY H . . 5.500 4.766 4.260 5.592 0.092 11 0 "[ . 1 . ]" 1
2011 1 40 SER HA 1 49 GLY H . . 5.270 4.394 3.810 5.318 0.048 8 0 "[ . 1 . ]" 1
2012 1 48 SER QB 1 49 GLY H . . 3.340 2.889 2.476 3.245 . 0 0 "[ . 1 . ]" 1
2013 1 39 ILE HG13 1 49 GLY H . . 5.500 4.268 3.537 4.784 . 0 0 "[ . 1 . ]" 1
2014 1 49 GLY H 1 63 LEU MD1 . . 5.120 4.351 3.766 4.867 . 0 0 "[ . 1 . ]" 1
2015 1 55 ASN H 1 56 GLY H . . 4.400 2.435 1.753 2.832 . 0 0 "[ . 1 . ]" 1
2016 1 54 SER H 1 56 GLY H . . 5.350 3.385 2.775 3.855 . 0 0 "[ . 1 . ]" 1
2017 1 56 GLY H 1 57 GLU QB . . 5.300 4.282 3.167 4.751 . 0 0 "[ . 1 . ]" 1
2018 1 2 VAL MG1 1 56 GLY H . . 5.500 4.285 2.784 5.581 0.081 4 0 "[ . 1 . ]" 1
2019 1 17 VAL HB 1 19 GLY H . . 5.420 2.881 2.341 3.724 . 0 0 "[ . 1 . ]" 1
2020 1 17 VAL MG2 1 19 GLY H . . 5.500 4.400 3.988 5.040 . 0 0 "[ . 1 . ]" 1
2021 1 33 PHE HA 1 33 PHE QD . . 3.100 2.878 2.359 3.165 0.065 9 0 "[ . 1 . ]" 1
2022 1 7 LEU HB3 1 33 PHE QD . . 3.550 3.146 2.033 3.647 0.097 9 0 "[ . 1 . ]" 1
2023 1 33 PHE QD 1 37 MET ME . . 3.070 2.665 2.191 3.204 0.134 11 0 "[ . 1 . ]" 1
2024 1 43 MET H 1 47 PHE QD . . 3.530 2.483 2.115 3.370 . 0 0 "[ . 1 . ]" 1
2025 1 47 PHE H 1 47 PHE QD . . 3.190 3.162 2.708 3.286 0.096 19 0 "[ . 1 . ]" 1
2026 1 47 PHE QD 1 65 MET ME . . 3.160 2.987 2.122 3.263 0.103 4 0 "[ . 1 . ]" 1
2027 1 47 PHE QD 1 63 LEU MD1 . . 2.730 2.515 2.043 2.840 0.110 4 0 "[ . 1 . ]" 1
2028 1 42 SER HA 1 47 PHE QD . . 3.100 2.744 2.198 3.183 0.083 2 0 "[ . 1 . ]" 1
2029 1 12 PHE QD 1 31 ILE MG . . 3.890 3.605 3.018 3.975 0.085 6 0 "[ . 1 . ]" 1
2030 1 33 PHE QE 1 37 MET ME . . 3.520 3.137 2.719 3.606 0.086 1 0 "[ . 1 . ]" 1
2031 1 33 PHE QE 1 58 LEU MD2 . . 2.810 2.297 1.982 2.879 0.069 13 0 "[ . 1 . ]" 1
2032 1 31 ILE MG 1 33 PHE QE . . 2.960 2.726 2.031 3.051 0.091 10 0 "[ . 1 . ]" 1
2033 1 43 MET H 1 47 PHE QE . . 3.890 2.682 1.939 3.709 . 0 0 "[ . 1 . ]" 1
2034 1 42 SER HA 1 47 PHE QE . . 3.960 3.438 3.017 3.993 0.033 17 0 "[ . 1 . ]" 1
2035 1 43 MET HG2 1 47 PHE QE . . 3.200 2.367 2.075 3.002 . 0 0 "[ . 1 . ]" 1
2036 1 31 ILE MD 1 47 PHE HZ . . 3.470 2.413 2.140 3.334 . 0 0 "[ . 1 . ]" 1
2037 1 10 HIS HB2 1 12 PHE QE . . 3.750 2.502 2.149 2.800 . 0 0 "[ . 1 . ]" 1
2038 1 12 PHE QE 1 112 LEU MD1 . . 3.410 2.811 2.513 3.142 . 0 0 "[ . 1 . ]" 1
2039 1 7 LEU MD2 1 12 PHE QE . . 3.310 2.656 2.265 3.289 . 0 0 "[ . 1 . ]" 1
2040 1 7 LEU HA 1 12 PHE QE . . 3.710 2.960 2.386 3.453 . 0 0 "[ . 1 . ]" 1
2041 1 33 PHE HZ 1 58 LEU MD2 . . 2.860 2.928 2.500 2.975 0.115 17 0 "[ . 1 . ]" 1
2042 1 31 ILE MG 1 33 PHE HZ . . 3.300 3.290 2.847 3.411 0.111 11 0 "[ . 1 . ]" 1
2043 1 6 GLN HA 1 10 HIS HD2 . . 3.830 3.035 2.470 3.738 . 0 0 "[ . 1 . ]" 1
2044 1 10 HIS HB2 1 10 HIS HD2 . . 3.220 2.691 2.584 2.838 . 0 0 "[ . 1 . ]" 1
2045 1 8 GLN HB2 1 9 HIS HD2 . . 3.690 3.371 2.501 3.765 0.075 13 0 "[ . 1 . ]" 1
2046 1 9 HIS QB 1 9 HIS HD2 . . 3.210 2.780 2.537 3.129 . 0 0 "[ . 1 . ]" 1
2047 1 8 GLN HB3 1 9 HIS HD2 . . 3.550 3.456 2.492 3.802 0.252 10 0 "[ . 1 . ]" 1
2048 1 101 LEU MD2 1 110 TYR QE . . 3.450 3.297 2.348 4.382 0.932 7 1 "[ . + 1 . ]" 1
2049 1 14 LEU HB2 1 110 TYR QE . . 3.360 2.628 2.147 3.024 . 0 0 "[ . 1 . ]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 3
_Distance_constraint_stats_list.Viol_count 55
_Distance_constraint_stats_list.Viol_total 114.532
_Distance_constraint_stats_list.Viol_max 0.201
_Distance_constraint_stats_list.Viol_rms 0.0677
_Distance_constraint_stats_list.Viol_average_all_restraints 0.1058
_Distance_constraint_stats_list.Viol_average_violations_only 0.1096
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 44 CYS 6.028 0.201 11 0 "[ . 1 . ]"
1 70 CYS 6.028 0.201 11 0 "[ . 1 . ]"
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 44 CYS SG 1 70 CYS SG . . 2.100 2.295 2.293 2.301 0.201 11 0 "[ . 1 . ]" 2
2 1 44 CYS SG 1 70 CYS CB . . 3.100 3.161 3.090 3.197 0.097 3 0 "[ . 1 . ]" 2
3 1 44 CYS CB 1 70 CYS SG . . 3.100 3.156 3.009 3.203 0.103 16 0 "[ . 1 . ]" 2
stop_
save_
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