NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
452854 |
2wgo   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2wgo
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 1992
_Distance_constraint_stats_list.Viol_count 4151
_Distance_constraint_stats_list.Viol_total 15533.438
_Distance_constraint_stats_list.Viol_max 0.940
_Distance_constraint_stats_list.Viol_rms 0.0570
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0125
_Distance_constraint_stats_list.Viol_average_violations_only 0.1497
_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 3 LEU 14.895 0.570 6 1 "[ .+ 1 . 2 .]"
1 4 ILE 28.495 0.719 24 8 "[ ** . * -* * . * +.]"
1 5 LEU 27.539 0.644 20 4 "[* . -1 .* + .]"
1 6 ASP 0.704 0.246 9 0 "[ . 1 . 2 .]"
1 7 GLY 0.374 0.151 25 0 "[ . 1 . 2 .]"
1 8 ASP 17.214 0.786 8 5 "[* . +-1 .* 2* .]"
1 9 LEU 19.778 0.644 20 1 "[ . 1 . + .]"
1 10 LEU 16.187 0.644 20 1 "[ . 1 . + .]"
1 11 LYS 9.564 0.908 14 2 "[ . 1 +. - .]"
1 12 ASP 4.961 0.406 21 0 "[ . 1 . 2 .]"
1 13 LYS 18.655 0.908 14 3 "[ . *1 +. - .]"
1 14 LEU 29.231 0.644 20 1 "[ . 1 . + .]"
1 15 LYS 22.972 0.686 19 2 "[ . 1 . +- .]"
1 16 LEU 10.721 0.686 19 2 "[ . 1 . +- .]"
1 17 PRO 11.727 0.940 14 4 "[ . * 1 +. * 2 - .]"
1 18 VAL 38.587 0.940 14 8 "[ * . **1* +.** 2 * .]"
1 19 ILE 45.080 0.775 2 5 "[ + . 1 * .* - *.]"
1 20 ASP 5.577 0.667 24 1 "[ . 1 . 2 +.]"
1 21 ASN 0.870 0.283 24 0 "[ . 1 . 2 .]"
1 22 LEU 14.264 0.452 7 0 "[ . 1 . 2 .]"
1 23 PHE 6.715 0.347 24 0 "[ . 1 . 2 .]"
1 24 GLY 1.643 0.581 13 1 "[ . 1 + . 2 .]"
1 25 LYS 27.665 0.908 14 12 "[ ** * *1* +. -**2* * *]"
1 26 GLU 32.785 0.484 1 0 "[ . 1 . 2 .]"
1 27 LEU 62.983 0.719 24 3 "[ .* -1 . 2 +.]"
1 28 LEU 65.001 0.863 4 12 "[* *+. * -*** . * 2** *.]"
1 29 ASP 24.921 0.463 18 0 "[ . 1 . 2 .]"
1 30 LYS 20.205 0.684 7 5 "[ * . + ** - . 2 .]"
1 31 PHE 7.843 0.402 17 0 "[ . 1 . 2 .]"
1 32 GLN 13.125 0.391 2 0 "[ . 1 . 2 .]"
1 33 ASP 6.191 0.628 10 2 "[ . + . - 2 .]"
1 34 ASP 14.014 0.632 4 4 "[ +. * . - 2 * .]"
1 35 ILE 27.225 0.863 4 9 "[ +. * -*** . 2** *.]"
1 36 LYS 32.217 0.565 9 3 "[ . +1 . 2 -* .]"
1 37 ASP 16.119 0.632 4 2 "[ +. 1 . 2 - .]"
1 38 LYS 16.629 0.538 23 1 "[ . 1 . 2 + .]"
1 39 TYR 5.345 0.402 17 0 "[ . 1 . 2 .]"
1 40 GLY 4.547 0.451 17 0 "[ . 1 . 2 .]"
1 41 VAL 38.358 0.764 25 12 "[ ** * **1* . -**2* * +]"
1 42 ASP 6.092 0.447 5 0 "[ . 1 . 2 .]"
1 43 THR 26.870 0.764 25 11 "[ ** * *1* . -**2* * +]"
1 44 LYS 33.771 0.764 25 12 "[ ** * *1* . ***2*-* +]"
1 45 ASP 6.568 0.564 9 3 "[ . +1 . 2 -* .]"
1 46 LEU 44.744 0.764 25 17 "[***** * *** * . -**** * +]"
1 47 LYS 38.011 0.908 14 9 "[ ** . * **- *+. 2* .]"
1 48 ILE 41.588 0.908 14 3 "[ .* 1 -+. 2 .]"
1 49 LEU 19.677 0.684 7 5 "[ * . + ** - . 2 .]"
1 50 LYS 17.513 0.908 14 3 "[ . *1* +. 2 .]"
1 51 THR 5.012 0.449 7 0 "[ . 1 . 2 .]"
1 52 SER 10.412 0.401 15 0 "[ . 1 . 2 .]"
1 53 GLU 17.306 0.775 2 8 "[*+* . **1 *.- 2 * .]"
1 54 ASP 5.201 0.509 18 1 "[ . 1 . + 2 .]"
1 55 LYS 12.542 0.908 14 4 "[ . 1 +. * * - .]"
1 56 ARG 14.121 0.448 17 0 "[ . 1 . 2 .]"
1 57 PHE 4.084 0.402 17 0 "[ . 1 . 2 .]"
1 58 TYR 5.614 0.505 2 1 "[ + . 1 . 2 .]"
1 59 TYR 17.682 0.590 19 5 "[ * - 1 . *+2 *.]"
1 60 VAL 33.162 0.429 24 0 "[ . 1 . 2 .]"
1 61 SER 1.472 0.145 10 0 "[ . 1 . 2 .]"
1 62 VAL 31.540 0.439 20 0 "[ . 1 . 2 .]"
1 63 ASP 8.930 0.703 2 1 "[ + . 1 . 2 .]"
1 64 ALA 15.336 0.749 4 3 "[- +. 1 . * .]"
1 65 GLY 10.867 0.840 19 2 "[ - . 1 . +2 .]"
1 66 ASP 4.003 0.316 23 0 "[ . 1 . 2 .]"
1 67 GLY 7.333 0.840 19 2 "[ - . 1 . +2 .]"
1 68 GLU 22.500 0.727 9 5 "[* - . +1 . * *]"
1 69 LYS 35.743 0.749 4 9 "[***+. 1- . 2 ****]"
1 70 CYS 23.492 0.660 16 2 "[ . 1 .+ 2 -.]"
1 71 LYS 22.442 0.717 10 2 "[ . - + . 2 .]"
1 72 PHE 6.655 0.480 9 0 "[ . 1 . 2 .]"
1 73 LYS 45.752 0.731 2 11 "[*+*** -**1 . **2 *.]"
1 74 ILE 30.065 0.770 8 5 "[* * . + 1 *. 2 * .]"
1 75 ARG 22.022 0.592 18 4 "[* -*. 1 . + 2 .]"
1 76 LYS 25.844 0.590 19 4 "[ - * 1 . +2 *.]"
1 77 ASP 16.703 0.703 2 2 "[ + .- 1 . 2 .]"
1 78 VAL 22.449 0.609 24 1 "[ . 1 . 2 +.]"
1 79 ASP 12.684 0.786 8 3 "[- . + 1 . 2* .]"
1 80 VAL 19.019 0.570 6 2 "[ .+ - 1 . 2 .]"
1 81 PRO 9.643 0.727 9 1 "[ . +1 . 2 .]"
1 82 LYS 19.906 0.727 9 5 "[* -*. +1 . * 2 .]"
1 83 MET 31.022 0.770 8 7 "[* **. + 1 *. * 2 * .]"
1 84 VAL 12.962 0.480 9 0 "[ . 1 . 2 .]"
1 85 GLY 2.048 0.380 8 0 "[ . 1 . 2 .]"
1 86 ARG 12.463 0.759 7 3 "[- . + 1 .* 2 .]"
1 87 LYS 23.339 0.759 7 6 "[-* . +* * .* 2 .]"
1 88 CYS 13.228 0.466 8 0 "[ . 1 . 2 .]"
1 89 ARG 27.706 0.717 10 2 "[ . - + . 2 .]"
1 90 LYS 29.850 0.727 9 6 "[* * . * +* - . 2 .]"
1 91 ASP 1.003 0.225 24 0 "[ . 1 . 2 .]"
1 92 ASP 1.582 0.225 24 0 "[ . 1 . 2 .]"
1 93 ASP 3.169 0.485 15 0 "[ . 1 . 2 .]"
1 94 ASP 4.999 0.485 15 0 "[ . 1 . 2 .]"
1 95 ASP 4.397 0.485 15 0 "[ . 1 . 2 .]"
1 96 ASP 3.140 0.485 15 0 "[ . 1 . 2 .]"
1 97 GLY 0.398 0.110 24 0 "[ . 1 . 2 .]"
1 98 TYR 30.287 0.731 2 6 "[ + . *-* .* 2 *.]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 LEU HA 1 3 LEU QD 3.000 . 4.100 2.402 1.885 3.265 0.015 14 0 "[ . 1 . 2 .]" 1
2 1 3 LEU HA 1 4 ILE H 2.100 . 2.700 2.030 1.841 2.165 . 0 0 "[ . 1 . 2 .]" 1
3 1 3 LEU HA 1 5 LEU QD 3.200 . 4.500 2.319 1.692 3.047 0.208 3 0 "[ . 1 . 2 .]" 1
4 1 3 LEU HA 1 31 PHE QE 3.500 . 5.000 2.601 1.990 3.342 0.010 11 0 "[ . 1 . 2 .]" 1
5 1 3 LEU HA 1 77 ASP HA 3.600 . 5.200 5.181 3.972 5.770 0.570 6 1 "[ .+ 1 . 2 .]" 1
6 1 3 LEU QB 1 3 LEU QD 2.400 . 3.100 1.729 1.686 1.841 0.014 10 0 "[ . 1 . 2 .]" 1
7 1 3 LEU QB 1 4 ILE HA 3.500 . 5.000 3.719 3.319 4.224 . 0 0 "[ . 1 . 2 .]" 1
8 1 3 LEU QB 1 29 ASP H 3.700 . 5.400 4.114 3.084 4.656 . 0 0 "[ . 1 . 2 .]" 1
9 1 3 LEU QB 1 4 ILE MD 2.800 . 3.800 3.710 3.168 4.139 0.339 9 0 "[ . 1 . 2 .]" 1
10 1 3 LEU QB 1 5 LEU H 3.700 . 5.400 2.790 2.103 3.392 . 0 0 "[ . 1 . 2 .]" 1
11 1 3 LEU QB 1 9 LEU H 3.000 . 4.100 3.699 2.118 4.431 0.331 23 0 "[ . 1 . 2 .]" 1
12 1 3 LEU QB 1 82 LYS H 3.800 . 5.600 3.617 2.426 4.137 . 0 0 "[ . 1 . 2 .]" 1
13 1 3 LEU QD 1 4 ILE H 3.200 . 4.500 2.547 1.839 3.306 0.061 24 0 "[ . 1 . 2 .]" 1
14 1 3 LEU QD 1 4 ILE HA 3.600 . 5.200 2.786 1.683 3.203 0.317 16 0 "[ . 1 . 2 .]" 1
15 1 3 LEU QD 1 4 ILE MD 2.800 . 3.800 3.115 1.889 3.799 . 0 0 "[ . 1 . 2 .]" 1
16 1 3 LEU QD 1 6 ASP HA 3.000 . 4.100 2.919 2.177 3.223 . 0 0 "[ . 1 . 2 .]" 1
17 1 3 LEU QD 1 81 PRO HB3 3.000 . 4.100 3.795 3.393 4.387 0.287 3 0 "[ . 1 . 2 .]" 1
18 1 3 LEU QD 1 30 LYS HB2 3.500 . 5.000 3.969 3.204 4.951 . 0 0 "[ . 1 . 2 .]" 1
19 1 3 LEU QD 1 6 ASP HB2 3.300 . 4.700 3.234 1.654 4.556 0.246 9 0 "[ . 1 . 2 .]" 1
20 1 3 LEU QD 1 15 LYS HG2 2.900 . 4.000 2.323 1.464 3.346 0.336 7 0 "[ . 1 . 2 .]" 1
21 1 3 LEU QD 1 11 LYS QG 2.600 . 3.400 1.987 1.602 2.808 0.198 7 0 "[ . 1 . 2 .]" 1
22 1 3 LEU QD 1 13 LYS HG2 2.600 . 3.400 2.566 1.837 3.754 0.354 4 0 "[ . 1 . 2 .]" 1
23 1 3 LEU QD 1 26 GLU HB3 3.200 . 4.500 3.464 1.672 4.661 0.228 19 0 "[ . 1 . 2 .]" 1
24 1 3 LEU QD 1 15 LYS HG2 2.600 . 3.400 1.874 1.519 2.276 0.281 14 0 "[ . 1 . 2 .]" 1
25 1 3 LEU QD 1 30 LYS HB3 3.300 . 4.700 3.290 1.874 4.727 0.027 1 0 "[ . 1 . 2 .]" 1
26 1 3 LEU QD 1 30 LYS QE 3.400 . 4.800 3.853 3.178 4.621 . 0 0 "[ . 1 . 2 .]" 1
27 1 3 LEU QD 1 31 PHE QE 3.500 . 5.000 2.007 1.598 2.237 0.402 17 0 "[ . 1 . 2 .]" 1
28 1 3 LEU QD 1 81 PRO HG2 3.200 . 4.500 3.788 2.686 4.519 0.019 13 0 "[ . 1 . 2 .]" 1
29 1 3 LEU QD 1 81 PRO HG3 3.400 . 4.800 4.241 3.659 4.742 . 0 0 "[ . 1 . 2 .]" 1
30 1 3 LEU HG 1 4 ILE H 3.100 . 4.300 2.648 1.895 3.864 0.005 16 0 "[ . 1 . 2 .]" 1
31 1 3 LEU HG 1 11 LYS QG 2.400 . 3.100 2.970 1.656 3.548 0.448 17 0 "[ . 1 . 2 .]" 1
32 1 4 ILE H 1 4 ILE HB 3.300 . 4.700 2.963 2.190 3.584 . 0 0 "[ . 1 . 2 .]" 1
33 1 4 ILE H 1 4 ILE HB 2.400 . 3.100 2.135 1.951 2.265 . 0 0 "[ . 1 . 2 .]" 1
34 1 4 ILE H 1 4 ILE MD 2.700 . 3.600 3.149 2.191 3.462 . 0 0 "[ . 1 . 2 .]" 1
35 1 4 ILE H 1 4 ILE HG12 3.300 . 4.700 3.773 3.251 4.046 . 0 0 "[ . 1 . 2 .]" 1
36 1 4 ILE H 1 4 ILE HG13 3.800 . 5.600 4.442 2.957 4.765 . 0 0 "[ . 1 . 2 .]" 1
37 1 4 ILE H 1 25 LYS HD3 3.700 . 5.400 4.152 3.974 4.243 . 0 0 "[ . 1 . 2 .]" 1
38 1 4 ILE H 1 47 LYS HG3 3.400 . 4.800 4.011 3.718 4.379 . 0 0 "[ . 1 . 2 .]" 1
39 1 4 ILE H 1 63 ASP HB2 3.800 . 5.600 2.485 1.297 4.056 0.703 2 1 "[ + . 1 . 2 .]" 1
40 1 4 ILE H 1 76 LYS QB 3.000 . 4.100 2.811 2.423 3.348 . 0 0 "[ . 1 . 2 .]" 1
41 1 4 ILE HA 1 4 ILE MD 3.900 . 5.800 2.422 1.877 3.914 0.123 2 0 "[ . 1 . 2 .]" 1
42 1 4 ILE HA 1 4 ILE MD 3.100 . 4.300 2.136 1.859 2.884 0.041 2 0 "[ . 1 . 2 .]" 1
43 1 4 ILE HA 1 4 ILE MG 3.100 . 4.300 3.094 2.490 3.236 . 0 0 "[ . 1 . 2 .]" 1
44 1 4 ILE HA 1 5 LEU H 3.000 . 4.100 2.820 2.107 3.583 . 0 0 "[ . 1 . 2 .]" 1
45 1 4 ILE HA 1 58 TYR QE 3.800 . 5.600 4.008 2.949 4.864 . 0 0 "[ . 1 . 2 .]" 1
46 1 4 ILE HB 1 4 ILE MD 3.300 . 4.700 2.395 2.237 3.238 . 0 0 "[ . 1 . 2 .]" 1
47 1 4 ILE HB 1 4 ILE HG12 2.800 . 3.800 2.617 2.430 3.027 . 0 0 "[ . 1 . 2 .]" 1
48 1 4 ILE HB 1 5 LEU QD 3.200 . 4.500 3.345 1.357 4.266 0.543 20 1 "[ . 1 . + .]" 1
49 1 4 ILE HB 1 5 LEU QD 2.900 . 4.000 2.840 1.759 3.681 0.041 13 0 "[ . 1 . 2 .]" 1
50 1 4 ILE HB 1 29 ASP H 3.600 . 5.200 4.604 4.333 4.801 . 0 0 "[ . 1 . 2 .]" 1
51 1 4 ILE HB 1 27 LEU HB3 3.300 . 4.700 4.345 2.792 4.871 0.171 6 0 "[ . 1 . 2 .]" 1
52 1 4 ILE HB 1 34 ASP H 3.600 . 5.200 3.642 2.175 4.042 . 0 0 "[ . 1 . 2 .]" 1
53 1 4 ILE MD 1 4 ILE HG13 2.300 . 3.000 2.119 2.115 2.125 . 0 0 "[ . 1 . 2 .]" 1
54 1 4 ILE MD 1 14 LEU H 4.000 . 6.000 2.729 1.707 3.439 0.293 13 0 "[ . 1 . 2 .]" 1
55 1 4 ILE MD 1 30 LYS HG2 2.500 . 3.300 3.454 1.922 3.984 0.684 7 5 "[ * . + ** - . 2 .]" 1
56 1 4 ILE HG12 1 5 LEU HA 3.100 . 4.300 2.345 2.189 2.484 . 0 0 "[ . 1 . 2 .]" 1
57 1 4 ILE HG12 1 9 LEU H 3.400 . 4.800 2.247 1.707 3.550 0.293 5 0 "[ . 1 . 2 .]" 1
58 1 4 ILE HG12 1 10 LEU HA 3.100 . 4.300 3.831 3.300 4.385 0.085 20 0 "[ . 1 . 2 .]" 1
59 1 4 ILE HG12 1 76 LYS QE 3.100 . 4.300 3.333 1.974 3.513 . 0 0 "[ . 1 . 2 .]" 1
60 1 4 ILE HG12 1 76 LYS QD 2.800 . 3.800 2.123 2.060 2.210 . 0 0 "[ . 1 . 2 .]" 1
61 1 4 ILE HG13 1 4 ILE MG 2.800 . 3.800 2.642 2.285 3.225 . 0 0 "[ . 1 . 2 .]" 1
62 1 4 ILE MG 1 5 LEU HB3 2.900 . 4.000 2.187 2.080 2.445 . 0 0 "[ . 1 . 2 .]" 1
63 1 4 ILE MG 1 9 LEU H 3.600 . 5.200 1.953 1.578 2.447 0.422 12 0 "[ . 1 . 2 .]" 1
64 1 4 ILE MG 1 79 ASP H 3.400 . 4.800 3.080 2.081 3.719 . 0 0 "[ . 1 . 2 .]" 1
65 1 4 ILE MG 1 56 ARG HA 3.200 . 4.500 2.131 1.664 2.912 0.236 16 0 "[ . 1 . 2 .]" 1
66 1 4 ILE MG 1 16 LEU H 3.000 . 4.100 2.238 1.584 2.895 0.316 15 0 "[ . 1 . 2 .]" 1
67 1 4 ILE MG 1 27 LEU HA 4.000 . 6.000 6.144 5.388 6.719 0.719 24 2 "[ . -1 . 2 +.]" 1
68 1 4 ILE MG 1 27 LEU QD 2.700 . 3.600 2.785 2.261 3.212 . 0 0 "[ . 1 . 2 .]" 1
69 1 4 ILE MG 1 76 LYS QD 2.700 . 3.600 2.943 2.358 3.866 0.266 6 0 "[ . 1 . 2 .]" 1
70 1 4 ILE MG 1 76 LYS QG 3.000 . 4.100 2.731 1.790 4.148 0.110 16 0 "[ . 1 . 2 .]" 1
71 1 4 ILE MG 1 77 ASP QB 3.400 . 4.800 3.181 2.148 4.558 . 0 0 "[ . 1 . 2 .]" 1
72 1 4 ILE MG 1 78 VAL HA 4.100 . 6.000 6.146 5.753 6.609 0.609 24 1 "[ . 1 . 2 +.]" 1
73 1 5 LEU H 1 5 LEU HB3 3.600 . 5.200 3.059 2.362 3.868 . 0 0 "[ . 1 . 2 .]" 1
74 1 5 LEU HA 1 5 LEU HB2 2.800 . 3.800 2.738 2.342 3.009 . 0 0 "[ . 1 . 2 .]" 1
75 1 5 LEU HA 1 5 LEU HB3 3.000 . 4.100 2.615 2.336 2.994 . 0 0 "[ . 1 . 2 .]" 1
76 1 5 LEU HA 1 8 ASP H 3.000 . 4.100 4.196 3.152 4.665 0.565 16 3 "[* . -1 .+ 2 .]" 1
77 1 5 LEU HA 1 9 LEU H 3.000 . 4.100 4.024 3.328 4.531 0.431 21 0 "[ . 1 . 2 .]" 1
78 1 5 LEU HB3 1 8 ASP HA 2.500 . 3.300 3.021 1.951 3.689 0.389 25 0 "[ . 1 . 2 .]" 1
79 1 5 LEU HB3 1 18 VAL QG 2.300 . 3.000 1.870 1.543 2.402 0.057 19 0 "[ . 1 . 2 .]" 1
80 1 5 LEU HB3 1 11 LYS HA 3.000 . 4.100 3.119 1.834 3.739 0.066 18 0 "[ . 1 . 2 .]" 1
81 1 5 LEU HB3 1 58 TYR HB3 2.700 . 3.600 2.565 1.390 3.361 0.410 22 0 "[ . 1 . 2 .]" 1
82 1 5 LEU QD 1 7 GLY QA 3.500 . 5.000 4.148 2.160 5.151 0.151 25 0 "[ . 1 . 2 .]" 1
83 1 5 LEU QD 1 9 LEU H 3.700 . 5.400 2.368 1.596 3.140 0.404 16 0 "[ . 1 . 2 .]" 1
84 1 5 LEU QD 1 9 LEU HA 2.700 . 3.600 1.788 1.435 2.379 0.365 21 0 "[ . 1 . 2 .]" 1
85 1 5 LEU QD 1 9 LEU QB 3.400 . 4.800 2.540 1.356 3.726 0.644 20 1 "[ . 1 . + .]" 1
86 1 5 LEU QD 1 11 LYS QE 2.400 . 3.100 2.043 1.647 2.736 0.053 17 0 "[ . 1 . 2 .]" 1
87 1 5 LEU QD 1 9 LEU QD 1.700 . 2.200 1.897 1.522 2.368 0.168 3 0 "[ . 1 . 2 .]" 1
88 1 5 LEU QD 1 15 LYS HG2 2.800 . 3.800 2.255 1.461 3.358 0.339 7 0 "[ . 1 . 2 .]" 1
89 1 5 LEU QD 1 15 LYS HG2 3.000 . 4.100 2.273 1.466 3.686 0.434 7 0 "[ . 1 . 2 .]" 1
90 1 5 LEU QD 1 34 ASP QB 2.400 . 3.100 2.347 1.914 2.726 . 0 0 "[ . 1 . 2 .]" 1
91 1 5 LEU QD 1 29 ASP H 3.300 . 4.700 1.946 1.794 2.419 0.106 13 0 "[ . 1 . 2 .]" 1
92 1 5 LEU QD 1 34 ASP H 3.600 . 5.200 2.949 2.074 3.293 . 0 0 "[ . 1 . 2 .]" 1
93 1 5 LEU QD 1 78 VAL HA 2.800 . 3.800 2.194 1.815 2.388 0.185 4 0 "[ . 1 . 2 .]" 1
94 1 5 LEU QD 1 79 ASP H 3.300 . 4.700 3.010 2.077 3.625 . 0 0 "[ . 1 . 2 .]" 1
95 1 6 ASP H 1 6 ASP HA 2.300 . 3.000 1.845 1.690 2.094 . 0 0 "[ . 1 . 2 .]" 1
96 1 6 ASP H 1 6 ASP HA 2.100 . 2.700 1.818 1.633 2.076 . 0 0 "[ . 1 . 2 .]" 1
97 1 6 ASP H 1 6 ASP HB2 2.400 . 3.100 1.895 1.580 2.252 0.120 10 0 "[ . 1 . 2 .]" 1
98 1 6 ASP HA 1 6 ASP HB3 1.800 . 2.200 1.828 1.731 1.920 . 0 0 "[ . 1 . 2 .]" 1
99 1 6 ASP HA 1 6 ASP HB3 1.800 . 2.200 1.828 1.753 1.914 . 0 0 "[ . 1 . 2 .]" 1
100 1 7 GLY H 1 11 LYS QG 3.100 . 4.300 3.991 3.382 4.431 0.131 3 0 "[ . 1 . 2 .]" 1
101 1 8 ASP H 1 8 ASP HA 2.400 . 3.100 1.932 1.780 2.169 . 0 0 "[ . 1 . 2 .]" 1
102 1 8 ASP H 1 8 ASP HB2 2.500 . 3.300 2.049 1.629 2.472 0.071 14 0 "[ . 1 . 2 .]" 1
103 1 8 ASP H 1 11 LYS QG 3.400 . 4.800 3.840 3.392 4.042 . 0 0 "[ . 1 . 2 .]" 1
104 1 8 ASP H 1 79 ASP H 3.000 . 4.100 4.444 3.457 4.886 0.786 8 3 "[- . + 1 . 2* .]" 1
105 1 8 ASP HA 1 62 VAL MG2 3.200 . 4.500 2.652 1.461 3.382 0.439 20 0 "[ . 1 . 2 .]" 1
106 1 8 ASP QB 1 56 ARG QD 2.800 . 3.800 2.483 1.720 3.417 0.080 15 0 "[ . 1 . 2 .]" 1
107 1 8 ASP HB3 1 18 VAL QG 2.700 . 3.600 2.353 1.913 2.831 . 0 0 "[ . 1 . 2 .]" 1
108 1 9 LEU H 1 9 LEU HA 2.600 . 3.400 2.133 1.897 2.459 . 0 0 "[ . 1 . 2 .]" 1
109 1 9 LEU H 1 9 LEU QB 2.600 . 3.400 2.327 1.926 2.770 . 0 0 "[ . 1 . 2 .]" 1
110 1 9 LEU H 1 9 LEU QD 3.700 . 5.400 3.355 2.276 4.040 . 0 0 "[ . 1 . 2 .]" 1
111 1 9 LEU H 1 55 LYS HA 3.400 . 4.800 4.197 3.175 4.877 0.077 3 0 "[ . 1 . 2 .]" 1
112 1 9 LEU H 1 18 VAL QG 2.500 . 3.300 1.817 1.641 2.312 0.059 13 0 "[ . 1 . 2 .]" 1
113 1 9 LEU H 1 76 LYS QB 3.100 . 4.300 2.403 1.714 3.481 0.186 14 0 "[ . 1 . 2 .]" 1
114 1 9 LEU HA 1 9 LEU QB 2.300 . 3.000 2.144 1.994 2.295 . 0 0 "[ . 1 . 2 .]" 1
115 1 9 LEU HA 1 9 LEU QD 2.900 . 3.400 1.903 1.675 2.456 0.125 2 0 "[ . 1 . 2 .]" 1
116 1 9 LEU HA 1 9 LEU HG 2.900 . 4.000 2.671 2.165 3.087 . 0 0 "[ . 1 . 2 .]" 1
117 1 9 LEU HA 1 10 LEU H 3.400 . 4.800 2.423 2.096 3.156 . 0 0 "[ . 1 . 2 .]" 1
118 1 9 LEU HA 1 56 ARG QD 3.100 . 4.300 3.957 3.716 4.251 . 0 0 "[ . 1 . 2 .]" 1
119 1 9 LEU QB 1 9 LEU QD 2.500 . 3.300 1.813 1.761 1.860 0.139 8 0 "[ . 1 . 2 .]" 1
120 1 9 LEU QB 1 9 LEU HG 2.100 . 2.700 2.222 2.094 2.374 . 0 0 "[ . 1 . 2 .]" 1
121 1 9 LEU QB 1 10 LEU H 2.900 . 4.000 2.845 2.047 3.538 . 0 0 "[ . 1 . 2 .]" 1
122 1 9 LEU QB 1 10 LEU H 3.000 . 4.100 2.488 1.994 3.546 . 0 0 "[ . 1 . 2 .]" 1
123 1 9 LEU QB 1 11 LYS QE 2.200 . 2.800 1.902 1.527 2.573 0.073 4 0 "[ . 1 . 2 .]" 1
124 1 9 LEU QB 1 11 LYS QE 2.700 . 3.600 2.954 2.090 3.550 . 0 0 "[ . 1 . 2 .]" 1
125 1 9 LEU QD 1 10 LEU HA 3.100 . 4.300 1.922 1.666 2.636 0.234 3 0 "[ . 1 . 2 .]" 1
126 1 9 LEU QD 1 11 LYS QD 2.700 . 3.600 2.230 1.732 2.745 0.068 13 0 "[ . 1 . 2 .]" 1
127 1 9 LEU QD 1 11 LYS QG 2.500 . 3.300 1.837 1.504 2.202 0.196 14 0 "[ . 1 . 2 .]" 1
128 1 10 LEU HA 1 10 LEU QB 2.300 . 3.000 2.010 1.918 2.091 . 0 0 "[ . 1 . 2 .]" 1
129 1 10 LEU HA 1 10 LEU QD 2.400 . 3.100 1.925 1.667 2.656 0.033 3 0 "[ . 1 . 2 .]" 1
130 1 10 LEU HA 1 10 LEU HG 3.200 . 4.500 2.702 2.136 3.325 . 0 0 "[ . 1 . 2 .]" 1
131 1 10 LEU HA 1 11 LYS H 3.300 . 4.700 2.818 2.108 3.584 . 0 0 "[ . 1 . 2 .]" 1
132 1 10 LEU HA 1 11 LYS HB2 2.700 . 3.600 2.552 2.231 2.947 . 0 0 "[ . 1 . 2 .]" 1
133 1 10 LEU HA 1 11 LYS QD 3.000 . 4.100 3.358 1.863 3.907 0.037 19 0 "[ . 1 . 2 .]" 1
134 1 10 LEU HA 1 11 LYS QG 3.200 . 4.500 2.787 2.374 3.550 . 0 0 "[ . 1 . 2 .]" 1
135 1 10 LEU QB 1 10 LEU QD 2.600 . 3.400 1.945 1.881 2.061 . 0 0 "[ . 1 . 2 .]" 1
136 1 10 LEU QB 1 10 LEU QD 2.400 . 3.100 1.726 1.681 1.781 0.019 6 0 "[ . 1 . 2 .]" 1
137 1 10 LEU QB 1 10 LEU QD 2.200 . 2.800 1.730 1.674 1.770 . 0 0 "[ . 1 . 2 .]" 1
138 1 10 LEU QB 1 13 LYS H 2.800 . 3.800 3.201 1.938 3.841 0.041 2 0 "[ . 1 . 2 .]" 1
139 1 10 LEU HB2 1 10 LEU HB3 1.400 . 2.200 1.551 1.543 1.560 . 0 0 "[ . 1 . 2 .]" 1
140 1 10 LEU QB 1 13 LYS H 2.700 . 3.600 3.105 2.111 3.563 . 0 0 "[ . 1 . 2 .]" 1
141 1 10 LEU QB 1 12 ASP H 2.600 . 3.400 2.503 1.890 3.243 . 0 0 "[ . 1 . 2 .]" 1
142 1 10 LEU QB 1 12 ASP H 3.300 . 4.700 3.011 1.916 3.727 . 0 0 "[ . 1 . 2 .]" 1
143 1 10 LEU HB2 1 10 LEU HB3 1.400 . 2.200 1.562 1.559 1.565 . 0 0 "[ . 1 . 2 .]" 1
144 1 10 LEU QD 1 11 LYS QG 2.600 . 3.400 2.193 1.748 2.924 0.052 7 0 "[ . 1 . 2 .]" 1
145 1 10 LEU QD 1 11 LYS QG 2.600 . 3.400 2.214 1.759 2.934 0.041 7 0 "[ . 1 . 2 .]" 1
146 1 10 LEU QD 1 11 LYS QG 2.800 . 3.800 2.615 1.599 3.260 0.201 16 0 "[ . 1 . 2 .]" 1
147 1 10 LEU QD 1 13 LYS H 3.600 . 5.200 3.320 1.802 4.574 0.198 6 0 "[ . 1 . 2 .]" 1
148 1 10 LEU QD 1 15 LYS HG2 2.900 . 4.000 2.467 1.597 3.363 0.203 16 0 "[ . 1 . 2 .]" 1
149 1 10 LEU QD 1 58 TYR QE 3.500 . 5.000 3.370 1.956 4.402 0.044 17 0 "[ . 1 . 2 .]" 1
150 1 10 LEU QD 1 57 PHE HA 3.300 . 4.700 3.240 3.091 3.400 . 0 0 "[ . 1 . 2 .]" 1
151 1 11 LYS H 1 11 LYS HB2 3.400 . 4.800 3.218 2.540 3.695 . 0 0 "[ . 1 . 2 .]" 1
152 1 11 LYS H 1 73 LYS QD 3.200 . 4.500 4.305 3.619 4.639 0.139 16 0 "[ . 1 . 2 .]" 1
153 1 11 LYS HA 1 11 LYS QB 2.500 . 3.000 2.329 2.163 2.411 . 0 0 "[ . 1 . 2 .]" 1
154 1 11 LYS HA 1 11 LYS HB3 2.500 . 3.300 2.197 2.081 2.395 . 0 0 "[ . 1 . 2 .]" 1
155 1 11 LYS HA 1 11 LYS QD 2.900 . 4.000 2.866 1.777 3.675 0.023 4 0 "[ . 1 . 2 .]" 1
156 1 11 LYS HA 1 11 LYS QG 2.600 . 3.400 2.185 2.032 2.320 . 0 0 "[ . 1 . 2 .]" 1
157 1 11 LYS HA 1 12 ASP H 2.700 . 3.600 2.486 1.984 2.726 . 0 0 "[ . 1 . 2 .]" 1
158 1 11 LYS QB 1 11 LYS QE 2.400 . 3.100 2.085 1.541 2.885 0.159 4 0 "[ . 1 . 2 .]" 1
159 1 11 LYS QB 1 11 LYS QG 1.900 . 2.400 1.887 1.827 1.979 . 0 0 "[ . 1 . 2 .]" 1
160 1 11 LYS HB2 1 11 LYS QG 1.800 . 2.200 1.788 1.749 1.826 . 0 0 "[ . 1 . 2 .]" 1
161 1 11 LYS HB3 1 11 LYS QG 1.900 . 2.400 1.928 1.844 2.026 . 0 0 "[ . 1 . 2 .]" 1
162 1 11 LYS HB3 1 12 ASP H 3.200 . 4.500 2.755 2.022 3.744 . 0 0 "[ . 1 . 2 .]" 1
163 1 11 LYS HB3 1 12 ASP HA 2.200 . 2.800 2.318 2.253 2.431 . 0 0 "[ . 1 . 2 .]" 1
164 1 11 LYS HB3 1 12 ASP HB2 2.900 . 4.000 2.693 1.744 3.502 0.056 10 0 "[ . 1 . 2 .]" 1
165 1 11 LYS HB3 1 13 LYS H 2.900 . 4.000 3.283 2.491 3.723 . 0 0 "[ . 1 . 2 .]" 1
166 1 11 LYS QD 1 11 LYS QE 1.600 . 2.200 1.456 1.419 1.484 . 0 0 "[ . 1 . 2 .]" 1
167 1 11 LYS QD 1 11 LYS QE 1.700 . 2.200 1.497 1.477 1.530 . 0 0 "[ . 1 . 2 .]" 1
168 1 11 LYS QD 1 11 LYS QG 1.300 . 2.200 1.521 1.493 1.543 . 0 0 "[ . 1 . 2 .]" 1
169 1 11 LYS QD 1 11 LYS QG 1.300 . 2.200 1.500 1.472 1.527 . 0 0 "[ . 1 . 2 .]" 1
170 1 11 LYS QD 1 12 ASP H 3.000 . 4.100 3.693 3.180 3.969 . 0 0 "[ . 1 . 2 .]" 1
171 1 11 LYS QD 1 48 ILE HA 2.900 . 4.000 3.555 2.108 4.908 0.908 14 1 "[ . 1 +. 2 .]" 1
172 1 11 LYS QE 1 11 LYS QG 1.900 . 2.400 1.666 1.597 1.785 . 0 0 "[ . 1 . 2 .]" 1
173 1 11 LYS QE 1 11 LYS QG 2.300 . 3.000 1.907 1.801 2.039 . 0 0 "[ . 1 . 2 .]" 1
174 1 11 LYS QG 1 12 ASP H 3.700 . 5.400 3.453 2.915 3.879 . 0 0 "[ . 1 . 2 .]" 1
175 1 12 ASP H 1 12 ASP HA 2.700 . 3.600 2.599 2.062 2.791 . 0 0 "[ . 1 . 2 .]" 1
176 1 12 ASP H 1 13 LYS HG3 2.900 . 4.000 4.145 3.609 4.406 0.406 21 0 "[ . 1 . 2 .]" 1
177 1 12 ASP H 1 76 LYS QD 3.100 . 4.300 3.676 2.911 4.214 . 0 0 "[ . 1 . 2 .]" 1
178 1 12 ASP H 1 76 LYS QD 3.500 . 5.000 3.788 3.064 4.330 . 0 0 "[ . 1 . 2 .]" 1
179 1 12 ASP HA 1 12 ASP HB2 1.900 . 2.400 1.829 1.738 1.889 . 0 0 "[ . 1 . 2 .]" 1
180 1 13 LYS H 1 13 LYS HA 2.700 . 3.600 2.845 2.260 2.942 . 0 0 "[ . 1 . 2 .]" 1
181 1 13 LYS H 1 13 LYS HA 2.500 . 3.300 2.446 2.066 2.811 . 0 0 "[ . 1 . 2 .]" 1
182 1 13 LYS H 1 13 LYS HA 2.500 . 3.300 2.165 1.993 2.464 . 0 0 "[ . 1 . 2 .]" 1
183 1 13 LYS H 1 13 LYS HB2 2.800 . 3.800 2.056 1.626 2.460 0.174 18 0 "[ . 1 . 2 .]" 1
184 1 13 LYS H 1 13 LYS HB2 2.900 . 4.000 2.470 1.760 3.441 0.040 10 0 "[ . 1 . 2 .]" 1
185 1 13 LYS H 1 13 LYS HB3 2.800 . 3.800 2.675 1.809 3.428 . 0 0 "[ . 1 . 2 .]" 1
186 1 13 LYS H 1 13 LYS HG2 2.900 . 4.000 2.540 1.963 3.180 . 0 0 "[ . 1 . 2 .]" 1
187 1 13 LYS H 1 13 LYS HG2 3.000 . 4.100 2.674 1.948 3.708 . 0 0 "[ . 1 . 2 .]" 1
188 1 13 LYS HA 1 13 LYS HB2 2.600 . 3.400 2.641 2.414 3.028 . 0 0 "[ . 1 . 2 .]" 1
189 1 13 LYS HA 1 13 LYS HB3 2.500 . 3.300 2.530 2.237 3.025 . 0 0 "[ . 1 . 2 .]" 1
190 1 13 LYS HA 1 13 LYS HG2 2.800 . 3.800 2.964 2.317 3.523 . 0 0 "[ . 1 . 2 .]" 1
191 1 13 LYS HA 1 13 LYS HG2 2.700 . 3.600 2.272 2.075 2.401 . 0 0 "[ . 1 . 2 .]" 1
192 1 13 LYS HA 1 14 LEU QD 3.000 . 4.100 2.340 1.816 3.391 0.084 3 0 "[ . 1 . 2 .]" 1
193 1 13 LYS HB2 1 13 LYS HG3 2.100 . 2.700 2.288 2.131 2.507 . 0 0 "[ . 1 . 2 .]" 1
194 1 13 LYS QD 1 18 VAL HB 2.400 . 3.100 2.669 1.680 3.827 0.727 9 1 "[ . +1 . 2 .]" 1
195 1 13 LYS QE 1 13 LYS QG 2.200 . 2.800 1.861 1.729 2.061 . 0 0 "[ . 1 . 2 .]" 1
196 1 13 LYS QE 1 14 LEU QB 1.800 . 2.200 2.297 2.153 2.513 0.313 25 0 "[ . 1 . 2 .]" 1
197 1 14 LEU H 1 14 LEU HA 2.700 . 3.600 2.320 1.973 2.812 . 0 0 "[ . 1 . 2 .]" 1
198 1 14 LEU H 1 14 LEU QB 2.700 . 3.600 2.420 1.741 2.893 0.059 24 0 "[ . 1 . 2 .]" 1
199 1 14 LEU H 1 14 LEU HG 3.000 . 4.100 2.911 1.755 3.812 0.145 10 0 "[ . 1 . 2 .]" 1
200 1 14 LEU H 1 19 ILE MG 3.400 . 4.800 4.758 3.585 5.246 0.446 6 0 "[ . 1 . 2 .]" 1
201 1 14 LEU H 1 19 ILE MD 3.300 . 4.700 4.266 2.486 5.076 0.376 7 0 "[ . 1 . 2 .]" 1
202 1 14 LEU H 1 15 LYS HG2 4.000 . 6.000 2.469 1.849 3.804 0.151 14 0 "[ . 1 . 2 .]" 1
203 1 14 LEU HA 1 15 LYS H 2.600 . 3.400 2.263 1.988 2.806 . 0 0 "[ . 1 . 2 .]" 1
204 1 14 LEU HA 1 15 LYS HG2 3.000 . 4.100 3.121 2.514 3.756 . 0 0 "[ . 1 . 2 .]" 1
205 1 14 LEU HA 1 19 ILE MG 3.500 . 5.000 4.607 4.013 5.320 0.320 2 0 "[ . 1 . 2 .]" 1
206 1 14 LEU QB 1 14 LEU QD 2.500 . 3.300 1.935 1.880 2.065 . 0 0 "[ . 1 . 2 .]" 1
207 1 14 LEU QB 1 16 LEU H 2.400 . 3.100 2.518 2.165 3.279 0.179 23 0 "[ . 1 . 2 .]" 1
208 1 14 LEU QD 1 15 LYS H 3.700 . 5.400 2.793 1.890 4.134 0.110 25 0 "[ . 1 . 2 .]" 1
209 1 14 LEU QD 1 15 LYS QD 2.800 . 3.800 2.598 1.660 3.447 0.140 9 0 "[ . 1 . 2 .]" 1
210 1 15 LYS HA 1 15 LYS HB2 2.900 . 4.000 2.753 2.446 3.030 . 0 0 "[ . 1 . 2 .]" 1
211 1 15 LYS HA 1 15 LYS HB2 2.600 . 3.400 2.621 1.825 2.939 . 0 0 "[ . 1 . 2 .]" 1
212 1 15 LYS HA 1 15 LYS HB3 2.600 . 3.400 2.597 2.244 3.031 . 0 0 "[ . 1 . 2 .]" 1
213 1 15 LYS HA 1 15 LYS HG2 3.000 . 4.100 3.209 2.518 4.067 . 0 0 "[ . 1 . 2 .]" 1
214 1 15 LYS HA 1 15 LYS HG3 3.000 . 4.100 3.097 2.391 4.249 0.149 5 0 "[ . 1 . 2 .]" 1
215 1 15 LYS HA 1 16 LEU H 2.200 . 2.800 2.765 2.147 3.486 0.686 19 2 "[ . 1 . +- .]" 1
216 1 15 LYS HB2 1 16 LEU H 3.300 . 4.700 2.526 1.657 3.235 0.243 11 0 "[ . 1 . 2 .]" 1
217 1 15 LYS HB3 1 16 LEU H 3.300 . 4.700 3.976 1.783 4.660 0.117 16 0 "[ . 1 . 2 .]" 1
218 1 15 LYS QD 1 16 LEU H 2.600 . 3.400 2.576 1.886 3.289 . 0 0 "[ . 1 . 2 .]" 1
219 1 15 LYS QE 1 15 LYS HG2 1.900 . 2.400 1.915 1.822 2.149 . 0 0 "[ . 1 . 2 .]" 1
220 1 15 LYS QE 1 15 LYS HG2 2.300 . 3.000 1.919 1.807 2.109 . 0 0 "[ . 1 . 2 .]" 1
221 1 15 LYS HG2 1 16 LEU H 3.700 . 5.400 2.705 1.737 3.374 0.263 12 0 "[ . 1 . 2 .]" 1
222 1 15 LYS HG3 1 16 LEU H 3.300 . 4.700 2.723 2.296 3.280 . 0 0 "[ . 1 . 2 .]" 1
223 1 16 LEU HA 1 16 LEU QB 2.600 . 3.400 2.322 2.144 2.454 . 0 0 "[ . 1 . 2 .]" 1
224 1 16 LEU HA 1 16 LEU QD 2.600 . 3.400 2.285 1.829 3.398 . 0 0 "[ . 1 . 2 .]" 1
225 1 16 LEU HA 1 17 PRO HD2 2.200 . 2.800 2.669 2.242 3.049 0.249 19 0 "[ . 1 . 2 .]" 1
226 1 16 LEU HA 1 17 PRO HD2 1.900 . 2.400 1.908 1.774 2.081 . 0 0 "[ . 1 . 2 .]" 1
227 1 16 LEU HA 1 17 PRO HD3 2.200 . 2.800 2.188 1.830 2.765 . 0 0 "[ . 1 . 2 .]" 1
228 1 16 LEU QB 1 16 LEU QD 2.100 . 2.700 1.940 1.842 2.035 . 0 0 "[ . 1 . 2 .]" 1
229 1 16 LEU QB 1 17 PRO HD2 2.700 . 3.600 2.118 1.671 2.649 0.129 23 0 "[ . 1 . 2 .]" 1
230 1 16 LEU QB 1 17 PRO QD 2.700 . 3.600 2.073 1.662 2.543 0.138 23 0 "[ . 1 . 2 .]" 1
231 1 16 LEU QB 1 17 PRO HD2 2.400 . 3.100 2.202 1.673 3.068 0.027 23 0 "[ . 1 . 2 .]" 1
232 1 16 LEU QB 1 17 PRO QD 2.400 . 3.100 2.151 1.665 2.894 0.035 23 0 "[ . 1 . 2 .]" 1
233 1 16 LEU QB 1 17 PRO HD3 2.700 . 3.600 3.196 2.557 3.641 0.041 20 0 "[ . 1 . 2 .]" 1
234 1 16 LEU QB 1 51 THR H 3.700 . 5.400 4.873 4.115 5.046 . 0 0 "[ . 1 . 2 .]" 1
235 1 16 LEU QD 1 17 PRO QD 2.700 . 3.600 2.755 2.260 3.377 . 0 0 "[ . 1 . 2 .]" 1
236 1 16 LEU QD 1 17 PRO HD2 2.500 . 3.300 2.177 1.697 2.742 0.003 18 0 "[ . 1 . 2 .]" 1
237 1 16 LEU QD 1 20 ASP H 3.700 . 5.400 4.095 3.374 4.724 . 0 0 "[ . 1 . 2 .]" 1
238 1 17 PRO HA 1 17 PRO HB2 2.600 . 3.400 2.809 2.620 2.976 . 0 0 "[ . 1 . 2 .]" 1
239 1 17 PRO HA 1 17 PRO HB3 2.200 . 2.800 2.295 2.265 2.324 . 0 0 "[ . 1 . 2 .]" 1
240 1 17 PRO HA 1 17 PRO QG 3.000 . 4.100 3.109 2.728 3.513 . 0 0 "[ . 1 . 2 .]" 1
241 1 17 PRO HA 1 17 PRO QG 2.600 . 3.400 3.004 2.705 3.389 . 0 0 "[ . 1 . 2 .]" 1
242 1 17 PRO HA 1 18 VAL H 2.000 . 2.500 2.665 2.109 3.440 0.940 14 4 "[ . * 1 +. * 2 - .]" 1
243 1 17 PRO HA 1 18 VAL QG 2.500 . 3.300 2.274 2.182 2.358 . 0 0 "[ . 1 . 2 .]" 1
244 1 17 PRO HB2 1 17 PRO QG 1.900 . 2.400 2.217 2.162 2.256 . 0 0 "[ . 1 . 2 .]" 1
245 1 17 PRO HB2 1 18 VAL H 2.900 . 4.000 2.755 1.764 4.005 0.036 10 0 "[ . 1 . 2 .]" 1
246 1 17 PRO HB2 1 18 VAL QG 2.700 . 3.600 1.820 1.651 2.041 0.149 12 0 "[ . 1 . 2 .]" 1
247 1 17 PRO HB3 1 17 PRO HD3 2.900 . 4.000 3.671 2.914 4.059 0.059 5 0 "[ . 1 . 2 .]" 1
248 1 17 PRO HB3 1 17 PRO QG 1.900 . 2.400 2.193 2.168 2.248 . 0 0 "[ . 1 . 2 .]" 1
249 1 17 PRO HB3 1 18 VAL H 3.000 . 4.100 3.130 2.290 4.168 0.068 23 0 "[ . 1 . 2 .]" 1
250 1 17 PRO HD2 1 17 PRO QG 2.100 . 2.700 2.223 2.172 2.257 . 0 0 "[ . 1 . 2 .]" 1
251 1 17 PRO HD2 1 18 VAL QG 3.200 . 4.500 3.904 3.505 4.198 . 0 0 "[ . 1 . 2 .]" 1
252 1 17 PRO HD3 1 17 PRO QG 2.000 . 2.500 2.199 2.174 2.247 . 0 0 "[ . 1 . 2 .]" 1
253 1 17 PRO HD3 1 18 VAL QG 3.200 . 4.500 3.291 2.996 3.516 . 0 0 "[ . 1 . 2 .]" 1
254 1 17 PRO QG 1 18 VAL H 2.400 . 3.100 2.708 2.360 2.984 . 0 0 "[ . 1 . 2 .]" 1
255 1 17 PRO QG 1 19 ILE H 3.000 . 4.100 4.119 3.803 4.235 0.135 22 0 "[ . 1 . 2 .]" 1
256 1 18 VAL H 1 18 VAL HA 2.700 . 3.600 2.634 2.240 2.925 . 0 0 "[ . 1 . 2 .]" 1
257 1 18 VAL H 1 18 VAL HB 2.300 . 3.000 2.813 2.476 3.242 0.242 14 0 "[ . 1 . 2 .]" 1
258 1 18 VAL H 1 18 VAL QG 2.300 . 3.000 2.433 1.876 3.075 0.075 11 0 "[ . 1 . 2 .]" 1
259 1 18 VAL H 1 19 ILE H 3.500 . 5.000 4.123 3.555 4.542 . 0 0 "[ . 1 . 2 .]" 1
260 1 18 VAL H 1 20 ASP H 3.500 . 5.000 4.366 3.845 4.701 . 0 0 "[ . 1 . 2 .]" 1
261 1 18 VAL HA 1 18 VAL HB 2.600 . 3.400 2.476 2.339 3.027 . 0 0 "[ . 1 . 2 .]" 1
262 1 18 VAL HA 1 18 VAL QG 2.400 . 3.100 2.307 2.129 2.397 . 0 0 "[ . 1 . 2 .]" 1
263 1 18 VAL HA 1 18 VAL QG 2.400 . 3.100 2.180 1.961 2.313 . 0 0 "[ . 1 . 2 .]" 1
264 1 18 VAL HA 1 19 ILE H 2.100 . 2.700 2.054 1.963 2.212 . 0 0 "[ . 1 . 2 .]" 1
265 1 18 VAL HA 1 19 ILE MG 3.500 . 5.000 4.543 3.926 4.748 . 0 0 "[ . 1 . 2 .]" 1
266 1 18 VAL HA 1 19 ILE MG 3.500 . 5.000 4.941 3.960 5.197 0.197 1 0 "[ . 1 . 2 .]" 1
267 1 18 VAL HA 1 25 LYS HD3 2.900 . 4.000 3.530 2.955 4.070 0.070 2 0 "[ . 1 . 2 .]" 1
268 1 18 VAL HA 1 50 LYS QG 3.200 . 4.500 2.811 2.339 3.201 . 0 0 "[ . 1 . 2 .]" 1
269 1 18 VAL HA 1 52 SER HA 3.100 . 4.300 4.019 2.944 4.532 0.232 3 0 "[ . 1 . 2 .]" 1
270 1 18 VAL HB 1 18 VAL QG 2.000 . 2.500 1.893 1.885 1.899 . 0 0 "[ . 1 . 2 .]" 1
271 1 18 VAL HB 1 18 VAL QG 1.900 . 2.400 1.686 1.683 1.689 . 0 0 "[ . 1 . 2 .]" 1
272 1 18 VAL HB 1 19 ILE H 3.000 . 4.100 4.174 3.836 4.265 0.165 25 0 "[ . 1 . 2 .]" 1
273 1 18 VAL HB 1 19 ILE MD 3.100 . 4.300 3.952 2.204 5.075 0.775 2 2 "[ + . 1 .- 2 .]" 1
274 1 18 VAL HB 1 25 LYS HD3 2.400 . 3.100 2.336 1.682 3.365 0.265 9 0 "[ . 1 . 2 .]" 1
275 1 18 VAL HB 1 25 LYS HD3 2.400 . 3.100 2.298 1.677 3.202 0.102 9 0 "[ . 1 . 2 .]" 1
276 1 18 VAL QG 1 50 LYS QG 2.200 . 2.800 1.629 1.328 2.050 0.272 1 0 "[ . 1 . 2 .]" 1
277 1 18 VAL QG 1 19 ILE H 2.700 . 3.600 2.678 2.008 2.977 . 0 0 "[ . 1 . 2 .]" 1
278 1 18 VAL QG 1 19 ILE H 2.500 . 3.300 2.582 1.911 2.922 . 0 0 "[ . 1 . 2 .]" 1
279 1 18 VAL QG 1 19 ILE HA 2.800 . 3.800 2.671 2.323 3.053 . 0 0 "[ . 1 . 2 .]" 1
280 1 18 VAL QG 1 19 ILE HB 3.100 . 4.300 3.361 3.238 3.515 . 0 0 "[ . 1 . 2 .]" 1
281 1 18 VAL QG 1 19 ILE MD 2.400 . 3.100 3.243 3.070 3.486 0.386 13 0 "[ . 1 . 2 .]" 1
282 1 18 VAL QG 1 19 ILE HG12 2.500 . 3.300 1.861 1.519 2.245 0.181 14 0 "[ . 1 . 2 .]" 1
283 1 18 VAL QG 1 19 ILE HG12 2.500 . 3.300 2.469 1.520 3.706 0.406 15 0 "[ . 1 . 2 .]" 1
284 1 18 VAL QG 1 19 ILE MG 2.100 . 2.700 1.988 1.787 2.414 . 0 0 "[ . 1 . 2 .]" 1
285 1 18 VAL QG 1 20 ASP QB 2.900 . 4.000 3.671 2.902 3.865 . 0 0 "[ . 1 . 2 .]" 1
286 1 18 VAL QG 1 20 ASP QB 2.600 . 3.400 2.228 1.853 2.773 . 0 0 "[ . 1 . 2 .]" 1
287 1 18 VAL QG 1 20 ASP QB 2.700 . 3.600 3.294 2.130 4.080 0.480 9 0 "[ . 1 . 2 .]" 1
288 1 18 VAL QG 1 22 LEU H 3.600 . 5.200 3.612 2.754 3.899 . 0 0 "[ . 1 . 2 .]" 1
289 1 18 VAL QG 1 24 GLY H 3.500 . 5.000 4.002 3.698 4.452 . 0 0 "[ . 1 . 2 .]" 1
290 1 18 VAL QG 1 49 LEU H 3.000 . 4.100 2.998 2.852 3.187 . 0 0 "[ . 1 . 2 .]" 1
291 1 18 VAL QG 1 50 LYS H 2.900 . 4.000 4.274 4.083 4.535 0.535 11 2 "[ . 1+ -. 2 .]" 1
292 1 18 VAL QG 1 50 LYS H 3.500 . 5.000 3.476 3.307 3.638 . 0 0 "[ . 1 . 2 .]" 1
293 1 18 VAL QG 1 50 LYS HA 2.600 . 3.400 1.864 1.720 2.222 0.080 3 0 "[ . 1 . 2 .]" 1
294 1 18 VAL QG 1 50 LYS QB 2.200 . 2.800 1.829 1.653 2.051 . 0 0 "[ . 1 . 2 .]" 1
295 1 18 VAL QG 1 50 LYS QE 2.700 . 3.600 2.551 2.068 2.752 . 0 0 "[ . 1 . 2 .]" 1
296 1 18 VAL QG 1 50 LYS QG 1.900 . 2.400 1.891 1.525 2.344 . 0 0 "[ . 1 . 2 .]" 1
297 1 18 VAL QG 1 51 THR H 2.900 . 4.000 2.250 1.913 2.853 0.087 20 0 "[ . 1 . 2 .]" 1
298 1 18 VAL QG 1 51 THR HA 3.000 . 4.100 2.665 2.334 3.055 . 0 0 "[ . 1 . 2 .]" 1
299 1 18 VAL QG 1 51 THR HA 2.900 . 4.000 2.683 2.341 3.128 . 0 0 "[ . 1 . 2 .]" 1
300 1 18 VAL QG 1 51 THR HB 2.500 . 3.300 2.217 1.632 2.824 0.068 16 0 "[ . 1 . 2 .]" 1
301 1 18 VAL QG 1 51 THR MG 2.200 . 2.800 2.073 1.590 2.557 0.010 2 0 "[ . 1 . 2 .]" 1
302 1 18 VAL QG 1 52 SER H 3.400 . 4.800 3.373 2.991 3.794 . 0 0 "[ . 1 . 2 .]" 1
303 1 18 VAL QG 1 61 SER QB 3.100 . 4.300 3.669 3.480 3.797 . 0 0 "[ . 1 . 2 .]" 1
304 1 19 ILE H 1 19 ILE HA 2.900 . 4.000 2.883 2.830 2.947 . 0 0 "[ . 1 . 2 .]" 1
305 1 19 ILE H 1 19 ILE HA 2.800 . 3.800 2.846 2.673 2.922 . 0 0 "[ . 1 . 2 .]" 1
306 1 19 ILE H 1 19 ILE HB 2.500 . 3.300 2.785 2.513 3.630 0.330 13 0 "[ . 1 . 2 .]" 1
307 1 19 ILE H 1 19 ILE HB 2.500 . 3.300 2.404 2.016 3.103 . 0 0 "[ . 1 . 2 .]" 1
308 1 19 ILE H 1 19 ILE MD 3.400 . 4.800 3.533 3.065 3.776 . 0 0 "[ . 1 . 2 .]" 1
309 1 19 ILE H 1 19 ILE HG12 2.800 . 3.800 2.920 1.808 3.391 . 0 0 "[ . 1 . 2 .]" 1
310 1 19 ILE H 1 19 ILE HG13 2.700 . 3.600 2.096 1.753 3.349 0.047 24 0 "[ . 1 . 2 .]" 1
311 1 19 ILE H 1 19 ILE MG 3.000 . 4.100 3.653 2.974 3.869 . 0 0 "[ . 1 . 2 .]" 1
312 1 19 ILE H 1 19 ILE MG 2.800 . 3.800 3.516 2.941 3.685 . 0 0 "[ . 1 . 2 .]" 1
313 1 19 ILE H 1 20 ASP H 3.700 . 5.400 4.223 2.626 4.417 . 0 0 "[ . 1 . 2 .]" 1
314 1 19 ILE H 1 52 SER HA 3.500 . 5.000 3.326 2.740 3.688 . 0 0 "[ . 1 . 2 .]" 1
315 1 19 ILE HA 1 19 ILE HB 2.900 . 4.000 2.941 2.541 3.023 . 0 0 "[ . 1 . 2 .]" 1
316 1 19 ILE HA 1 19 ILE HB 2.600 . 3.400 2.373 1.984 2.687 . 0 0 "[ . 1 . 2 .]" 1
317 1 19 ILE HA 1 19 ILE MD 2.900 . 4.000 3.871 2.295 4.171 0.171 2 0 "[ . 1 . 2 .]" 1
318 1 19 ILE HA 1 19 ILE MD 2.900 . 4.000 3.529 2.290 4.004 0.004 2 0 "[ . 1 . 2 .]" 1
319 1 19 ILE HA 1 19 ILE HG12 3.300 . 4.700 2.801 2.569 3.530 . 0 0 "[ . 1 . 2 .]" 1
320 1 19 ILE HA 1 19 ILE MG 2.700 . 3.600 2.293 2.148 2.390 . 0 0 "[ . 1 . 2 .]" 1
321 1 19 ILE HA 1 19 ILE MG 2.500 . 3.300 2.282 2.142 2.374 . 0 0 "[ . 1 . 2 .]" 1
322 1 19 ILE HA 1 20 ASP H 2.200 . 2.800 2.491 2.297 3.467 0.667 24 1 "[ . 1 . 2 +.]" 1
323 1 19 ILE HB 1 19 ILE MD 2.700 . 3.600 2.474 2.362 3.234 . 0 0 "[ . 1 . 2 .]" 1
324 1 19 ILE HB 1 19 ILE HG12 2.400 . 3.100 3.003 2.504 3.030 . 0 0 "[ . 1 . 2 .]" 1
325 1 19 ILE HB 1 19 ILE HG12 2.300 . 3.000 2.322 2.165 2.352 . 0 0 "[ . 1 . 2 .]" 1
326 1 19 ILE HB 1 19 ILE HG13 2.600 . 3.400 2.458 2.396 2.530 . 0 0 "[ . 1 . 2 .]" 1
327 1 19 ILE HB 1 19 ILE MG 2.200 . 2.500 1.894 1.890 1.898 . 0 0 "[ . 1 . 2 .]" 1
328 1 19 ILE HB 1 20 ASP H 3.100 . 4.300 3.183 1.777 3.795 0.123 13 0 "[ . 1 . 2 .]" 1
329 1 19 ILE HB 1 21 ASN QB 3.000 . 3.800 2.412 1.752 3.587 0.148 4 0 "[ . 1 . 2 .]" 1
330 1 19 ILE HB 1 21 ASN QB 2.900 . 4.000 2.459 1.755 3.988 0.045 4 0 "[ . 1 . 2 .]" 1
331 1 19 ILE HB 1 23 PHE H 2.800 . 3.800 3.561 2.804 3.803 0.003 12 0 "[ . 1 . 2 .]" 1
332 1 19 ILE HB 1 60 VAL QG 2.500 . 3.300 2.544 2.270 2.827 . 0 0 "[ . 1 . 2 .]" 1
333 1 19 ILE HB 1 35 ILE HA 2.800 . 3.800 3.023 2.996 3.031 . 0 0 "[ . 1 . 2 .]" 1
334 1 19 ILE HB 1 51 THR MG 2.900 . 4.000 2.586 1.883 4.005 0.005 2 0 "[ . 1 . 2 .]" 1
335 1 19 ILE MD 1 19 ILE HG12 2.300 . 3.000 2.119 2.113 2.126 . 0 0 "[ . 1 . 2 .]" 1
336 1 19 ILE MD 1 19 ILE HG13 2.400 . 3.100 2.120 2.115 2.130 . 0 0 "[ . 1 . 2 .]" 1
337 1 19 ILE MD 1 19 ILE MG 2.400 . 3.100 1.879 1.744 1.998 . 0 0 "[ . 1 . 2 .]" 1
338 1 19 ILE MD 1 20 ASP H 3.500 . 5.000 4.486 3.393 4.836 . 0 0 "[ . 1 . 2 .]" 1
339 1 19 ILE MD 1 20 ASP H 3.700 . 5.400 4.420 3.371 4.743 . 0 0 "[ . 1 . 2 .]" 1
340 1 19 ILE MD 1 23 PHE QR 2.800 . 3.800 2.740 1.779 3.882 0.082 21 0 "[ . 1 . 2 .]" 1
341 1 19 ILE MD 1 24 GLY HA3 3.300 . 4.700 1.980 1.818 2.445 0.082 4 0 "[ . 1 . 2 .]" 1
342 1 19 ILE MD 1 51 THR MG 2.600 . 3.400 2.176 1.774 2.913 0.026 23 0 "[ . 1 . 2 .]" 1
343 1 19 ILE MD 1 52 SER H 3.900 . 5.800 3.627 3.106 4.516 . 0 0 "[ . 1 . 2 .]" 1
344 1 19 ILE MD 1 53 GLU HB3 3.400 . 4.800 3.410 2.762 3.951 . 0 0 "[ . 1 . 2 .]" 1
345 1 19 ILE MD 1 58 TYR HB2 2.700 . 3.600 3.351 2.968 4.028 0.428 15 0 "[ . 1 . 2 .]" 1
346 1 19 ILE MD 1 58 TYR QD 3.200 . 4.500 2.650 2.400 3.179 . 0 0 "[ . 1 . 2 .]" 1
347 1 19 ILE MD 1 58 TYR QE 3.000 . 4.100 2.527 1.868 3.245 0.032 19 0 "[ . 1 . 2 .]" 1
348 1 19 ILE MD 1 52 SER HA 3.600 . 5.200 2.297 1.989 3.227 0.011 9 0 "[ . 1 . 2 .]" 1
349 1 19 ILE MD 1 53 GLU HB2 3.300 . 4.700 2.826 1.930 4.551 . 0 0 "[ . 1 . 2 .]" 1
350 1 19 ILE MD 1 53 GLU HB3 2.900 . 4.000 3.495 2.775 4.057 0.057 21 0 "[ . 1 . 2 .]" 1
351 1 19 ILE MD 1 58 TYR QE 2.900 . 4.000 2.936 1.879 4.002 0.002 21 0 "[ . 1 . 2 .]" 1
352 1 19 ILE HG12 1 19 ILE MG 2.700 . 3.600 2.415 2.323 3.184 . 0 0 "[ . 1 . 2 .]" 1
353 1 19 ILE HG12 1 19 ILE MG 2.200 . 2.800 2.319 2.188 2.424 . 0 0 "[ . 1 . 2 .]" 1
354 1 19 ILE HG12 1 58 TYR QE 3.700 . 5.400 3.240 2.296 3.727 . 0 0 "[ . 1 . 2 .]" 1
355 1 19 ILE HG12 1 54 ASP H 3.400 . 4.800 3.923 3.816 4.085 . 0 0 "[ . 1 . 2 .]" 1
356 1 19 ILE HG13 1 19 ILE MG 2.300 . 3.000 3.148 2.396 3.199 0.199 19 0 "[ . 1 . 2 .]" 1
357 1 19 ILE HG13 1 51 THR HB 3.100 . 4.300 3.462 1.451 4.336 0.449 7 0 "[ . 1 . 2 .]" 1
358 1 19 ILE MG 1 20 ASP H 2.700 . 3.600 2.166 1.630 3.501 0.170 11 0 "[ . 1 . 2 .]" 1
359 1 19 ILE MG 1 20 ASP HA 3.400 . 4.800 3.980 3.001 4.837 0.037 19 0 "[ . 1 . 2 .]" 1
360 1 19 ILE MG 1 21 ASN QB 2.800 . 3.800 2.801 2.487 3.408 . 0 0 "[ . 1 . 2 .]" 1
361 1 19 ILE MG 1 21 ASN QB 3.000 . 3.400 2.799 2.486 3.404 0.004 13 0 "[ . 1 . 2 .]" 1
362 1 19 ILE MG 1 21 ASN HD21 3.500 . 5.000 4.407 2.150 5.048 0.048 25 0 "[ . 1 . 2 .]" 1
363 1 19 ILE MG 1 23 PHE HB2 3.000 . 4.100 2.661 2.349 3.204 . 0 0 "[ . 1 . 2 .]" 1
364 1 19 ILE MG 1 23 PHE HB3 3.100 . 4.300 2.697 2.001 4.481 0.181 19 0 "[ . 1 . 2 .]" 1
365 1 19 ILE MG 1 23 PHE QR 2.900 . 4.000 2.641 2.109 3.706 . 0 0 "[ . 1 . 2 .]" 1
366 1 19 ILE MG 1 24 GLY H 3.300 . 4.700 3.731 3.124 4.379 . 0 0 "[ . 1 . 2 .]" 1
367 1 19 ILE MG 1 24 GLY HA2 3.500 . 5.000 2.930 2.568 3.478 . 0 0 "[ . 1 . 2 .]" 1
368 1 19 ILE MG 1 24 GLY HA3 3.100 . 4.300 4.241 3.919 4.881 0.581 13 1 "[ . 1 + . 2 .]" 1
369 1 19 ILE MG 1 25 LYS H 3.700 . 5.400 3.928 3.102 4.308 . 0 0 "[ . 1 . 2 .]" 1
370 1 19 ILE MG 1 25 LYS HA 2.800 . 3.800 3.188 2.817 3.573 . 0 0 "[ . 1 . 2 .]" 1
371 1 19 ILE MG 1 26 GLU HA 3.200 . 4.500 4.248 3.644 4.476 . 0 0 "[ . 1 . 2 .]" 1
372 1 19 ILE MG 1 47 LYS HG2 2.900 . 4.000 3.902 3.772 4.050 0.050 21 0 "[ . 1 . 2 .]" 1
373 1 19 ILE MG 1 51 THR H 3.700 . 5.400 3.193 2.927 3.691 . 0 0 "[ . 1 . 2 .]" 1
374 1 19 ILE MG 1 51 THR H 3.100 . 4.300 3.176 2.917 3.653 . 0 0 "[ . 1 . 2 .]" 1
375 1 19 ILE MG 1 51 THR HB 2.900 . 4.000 3.239 2.839 3.705 . 0 0 "[ . 1 . 2 .]" 1
376 1 19 ILE MG 1 51 THR MG 2.500 . 3.000 2.904 2.553 3.393 0.393 13 0 "[ . 1 . 2 .]" 1
377 1 19 ILE MG 1 52 SER H 2.900 . 4.000 3.675 3.567 3.874 . 0 0 "[ . 1 . 2 .]" 1
378 1 19 ILE MG 1 52 SER HA 3.000 . 4.100 4.370 4.222 4.501 0.401 15 0 "[ . 1 . 2 .]" 1
379 1 19 ILE MG 1 58 TYR QE 3.400 . 4.800 4.393 3.576 4.931 0.131 7 0 "[ . 1 . 2 .]" 1
380 1 20 ASP H 1 20 ASP HA 2.800 . 3.800 2.755 2.265 2.839 . 0 0 "[ . 1 . 2 .]" 1
381 1 20 ASP H 1 20 ASP QB 3.000 . 4.100 2.510 2.153 3.331 . 0 0 "[ . 1 . 2 .]" 1
382 1 20 ASP H 1 23 PHE H 2.900 . 4.000 3.667 2.932 3.879 . 0 0 "[ . 1 . 2 .]" 1
383 1 20 ASP H 1 23 PHE HB2 2.900 . 4.000 3.894 2.599 4.126 0.126 7 0 "[ . 1 . 2 .]" 1
384 1 20 ASP H 1 23 PHE HB3 2.800 . 3.800 3.769 3.279 4.147 0.347 24 0 "[ . 1 . 2 .]" 1
385 1 20 ASP H 1 23 PHE HB3 3.300 . 4.700 3.654 3.246 3.953 . 0 0 "[ . 1 . 2 .]" 1
386 1 20 ASP H 1 23 PHE QR 4.300 . 6.000 4.676 2.328 5.358 . 0 0 "[ . 1 . 2 .]" 1
387 1 20 ASP HA 1 20 ASP QB 2.400 . 3.100 2.385 2.192 2.459 . 0 0 "[ . 1 . 2 .]" 1
388 1 20 ASP QB 1 22 LEU H 3.500 . 5.000 3.162 2.448 4.886 . 0 0 "[ . 1 . 2 .]" 1
389 1 21 ASN QB 1 21 ASN HD21 3.000 . 4.100 2.239 2.116 2.823 . 0 0 "[ . 1 . 2 .]" 1
390 1 21 ASN QB 1 21 ASN HD22 3.300 . 4.100 3.263 3.204 3.491 . 0 0 "[ . 1 . 2 .]" 1
391 1 21 ASN QB 1 22 LEU H 3.600 . 5.200 3.542 2.554 4.036 . 0 0 "[ . 1 . 2 .]" 1
392 1 21 ASN QB 1 25 LYS H 3.600 . 5.200 3.378 2.657 5.176 . 0 0 "[ . 1 . 2 .]" 1
393 1 21 ASN QB 1 25 LYS H 3.800 . 5.600 4.467 4.008 5.883 0.283 24 0 "[ . 1 . 2 .]" 1
394 1 22 LEU H 1 22 LEU HA 2.700 . 3.600 2.724 2.235 2.858 . 0 0 "[ . 1 . 2 .]" 1
395 1 22 LEU H 1 22 LEU HB2 2.700 . 3.600 2.668 2.122 3.384 . 0 0 "[ . 1 . 2 .]" 1
396 1 22 LEU H 1 22 LEU HB3 2.700 . 3.600 2.711 2.240 4.052 0.452 7 0 "[ . 1 . 2 .]" 1
397 1 22 LEU H 1 22 LEU HB3 2.500 . 3.300 2.508 2.232 3.467 0.167 24 0 "[ . 1 . 2 .]" 1
398 1 22 LEU H 1 22 LEU HG 3.000 . 4.100 4.017 2.714 4.516 0.416 10 0 "[ . 1 . 2 .]" 1
399 1 22 LEU H 1 23 PHE H 2.600 . 3.400 2.682 2.492 3.082 . 0 0 "[ . 1 . 2 .]" 1
400 1 22 LEU H 1 25 LYS QB 3.100 . 4.300 4.255 3.498 4.488 0.188 15 0 "[ . 1 . 2 .]" 1
401 1 22 LEU HA 1 23 PHE H 3.100 . 4.300 3.457 2.676 3.562 . 0 0 "[ . 1 . 2 .]" 1
402 1 22 LEU HA 1 25 LYS H 2.700 . 3.600 2.777 2.280 3.184 . 0 0 "[ . 1 . 2 .]" 1
403 1 22 LEU HA 1 25 LYS QB 2.800 . 3.800 2.308 1.955 3.032 . 0 0 "[ . 1 . 2 .]" 1
404 1 22 LEU HA 1 25 LYS QB 2.500 . 3.300 2.065 1.878 2.303 . 0 0 "[ . 1 . 2 .]" 1
405 1 22 LEU HA 1 25 LYS HD2 2.800 . 3.800 3.743 3.378 4.037 0.237 25 0 "[ . 1 . 2 .]" 1
406 1 22 LEU HA 1 26 GLU H 3.400 . 4.800 3.919 3.181 4.173 . 0 0 "[ . 1 . 2 .]" 1
407 1 22 LEU HB3 1 23 PHE H 2.800 . 3.800 2.782 2.267 4.100 0.300 13 0 "[ . 1 . 2 .]" 1
408 1 22 LEU HB3 1 25 LYS H 3.500 . 5.000 3.347 2.863 3.811 . 0 0 "[ . 1 . 2 .]" 1
409 1 22 LEU HB3 1 26 GLU HG2 3.100 . 4.300 3.707 2.738 4.505 0.205 20 0 "[ . 1 . 2 .]" 1
410 1 22 LEU HB3 1 23 PHE HA 3.400 . 4.800 4.352 3.763 4.742 . 0 0 "[ . 1 . 2 .]" 1
411 1 22 LEU QD 1 25 LYS H 3.600 . 5.200 3.821 3.495 4.300 . 0 0 "[ . 1 . 2 .]" 1
412 1 22 LEU QD 1 25 LYS QB 3.200 . 4.500 2.699 1.979 3.220 . 0 0 "[ . 1 . 2 .]" 1
413 1 22 LEU QD 1 25 LYS QB 2.500 . 3.300 2.690 1.980 3.214 . 0 0 "[ . 1 . 2 .]" 1
414 1 22 LEU QD 1 26 GLU H 3.900 . 5.800 3.562 2.925 3.983 . 0 0 "[ . 1 . 2 .]" 1
415 1 22 LEU QD 1 26 GLU HB2 3.100 . 4.300 4.167 3.437 4.559 0.259 4 0 "[ . 1 . 2 .]" 1
416 1 22 LEU QD 1 26 GLU HG2 3.400 . 4.800 2.825 2.158 3.474 . 0 0 "[ . 1 . 2 .]" 1
417 1 22 LEU QD 1 26 GLU HG3 3.300 . 4.700 3.462 2.597 4.215 . 0 0 "[ . 1 . 2 .]" 1
418 1 22 LEU QD 1 26 GLU HG3 3.300 . 4.700 3.418 2.589 4.065 . 0 0 "[ . 1 . 2 .]" 1
419 1 22 LEU QD 1 27 LEU H 3.700 . 5.400 4.444 4.187 4.793 . 0 0 "[ . 1 . 2 .]" 1
420 1 23 PHE H 1 23 PHE HA 2.600 . 3.400 2.821 2.751 2.937 . 0 0 "[ . 1 . 2 .]" 1
421 1 23 PHE H 1 23 PHE HB2 2.500 . 3.300 2.464 2.099 2.572 . 0 0 "[ . 1 . 2 .]" 1
422 1 23 PHE H 1 23 PHE HB3 2.500 . 3.300 2.707 2.522 3.628 0.328 13 0 "[ . 1 . 2 .]" 1
423 1 23 PHE H 1 23 PHE QR 4.100 . 6.000 4.023 2.720 4.142 . 0 0 "[ . 1 . 2 .]" 1
424 1 23 PHE H 1 24 GLY H 2.600 . 3.400 2.653 2.427 2.892 . 0 0 "[ . 1 . 2 .]" 1
425 1 23 PHE HA 1 23 PHE HB2 2.600 . 3.400 2.555 2.458 3.007 . 0 0 "[ . 1 . 2 .]" 1
426 1 23 PHE HA 1 23 PHE HB3 2.800 . 3.800 2.991 2.580 3.038 . 0 0 "[ . 1 . 2 .]" 1
427 1 23 PHE HA 1 23 PHE QR 3.100 . 4.300 2.689 2.198 2.931 . 0 0 "[ . 1 . 2 .]" 1
428 1 23 PHE HA 1 24 GLY H 3.200 . 4.500 3.534 3.510 3.574 . 0 0 "[ . 1 . 2 .]" 1
429 1 23 PHE HA 1 25 LYS QB 2.800 . 3.800 3.806 3.313 3.954 0.154 4 0 "[ . 1 . 2 .]" 1
430 1 23 PHE HA 1 26 GLU H 2.800 . 3.800 3.487 3.310 3.849 0.049 13 0 "[ . 1 . 2 .]" 1
431 1 23 PHE HA 1 26 GLU HB2 2.900 . 4.000 2.538 2.206 2.798 . 0 0 "[ . 1 . 2 .]" 1
432 1 23 PHE HA 1 26 GLU HB3 3.000 . 4.100 3.954 3.352 4.127 0.027 23 0 "[ . 1 . 2 .]" 1
433 1 23 PHE HA 1 26 GLU HG2 3.500 . 5.000 3.995 3.252 5.221 0.221 2 0 "[ . 1 . 2 .]" 1
434 1 23 PHE HA 1 26 GLU HG3 3.600 . 5.200 3.284 2.792 3.916 . 0 0 "[ . 1 . 2 .]" 1
435 1 23 PHE HA 1 27 LEU H 3.300 . 4.700 4.325 4.090 4.608 . 0 0 "[ . 1 . 2 .]" 1
436 1 23 PHE HB2 1 23 PHE QD 3.200 . 4.500 2.456 2.261 2.582 . 0 0 "[ . 1 . 2 .]" 1
437 1 23 PHE HB2 1 24 GLY H 2.500 . 3.300 2.259 1.935 2.300 . 0 0 "[ . 1 . 2 .]" 1
438 1 23 PHE HB2 1 25 LYS H 3.200 . 4.500 2.760 2.657 2.951 . 0 0 "[ . 1 . 2 .]" 1
439 1 23 PHE HB2 1 27 LEU QD 3.500 . 5.000 3.290 2.944 3.629 . 0 0 "[ . 1 . 2 .]" 1
440 1 23 PHE HB2 1 51 THR MG 2.700 . 3.600 2.410 1.990 2.830 . 0 0 "[ . 1 . 2 .]" 1
441 1 23 PHE HB3 1 24 GLY H 2.900 . 4.000 2.570 2.275 2.740 . 0 0 "[ . 1 . 2 .]" 1
442 1 23 PHE HB3 1 51 THR MG 3.200 . 4.500 2.891 1.980 3.825 . 0 0 "[ . 1 . 2 .]" 1
443 1 23 PHE QR 1 27 LEU QD 2.800 . 3.800 2.324 2.090 2.658 . 0 0 "[ . 1 . 2 .]" 1
444 1 23 PHE QR 1 51 THR MG 2.700 . 3.600 2.335 1.815 3.188 . 0 0 "[ . 1 . 2 .]" 1
445 1 23 PHE QR 1 53 GLU HG3 3.700 . 5.400 4.816 3.794 5.666 0.266 15 0 "[ . 1 . 2 .]" 1
446 1 23 PHE QR 1 60 VAL QG 3.300 . 4.700 3.453 3.036 3.693 . 0 0 "[ . 1 . 2 .]" 1
447 1 23 PHE QR 1 74 ILE MD 3.800 . 5.600 3.913 3.390 4.587 . 0 0 "[ . 1 . 2 .]" 1
448 1 23 PHE QD 1 58 TYR QE 3.200 . 4.500 3.754 2.456 4.511 0.011 13 0 "[ . 1 . 2 .]" 1
449 1 23 PHE QE 1 53 GLU HB2 3.700 . 5.400 3.361 2.864 3.860 . 0 0 "[ . 1 . 2 .]" 1
450 1 23 PHE QE 1 74 ILE MG 3.100 . 4.300 3.047 2.328 3.874 . 0 0 "[ . 1 . 2 .]" 1
451 1 24 GLY H 1 24 GLY HA2 2.700 . 3.600 2.299 2.293 2.318 . 0 0 "[ . 1 . 2 .]" 1
452 1 24 GLY H 1 24 GLY HA3 2.500 . 3.300 2.835 2.811 2.876 . 0 0 "[ . 1 . 2 .]" 1
453 1 24 GLY H 1 25 LYS H 2.800 . 3.800 2.617 2.351 2.742 . 0 0 "[ . 1 . 2 .]" 1
454 1 24 GLY H 1 25 LYS QB 2.600 . 3.400 2.650 2.458 2.838 . 0 0 "[ . 1 . 2 .]" 1
455 1 24 GLY H 1 51 THR MG 2.800 . 3.800 2.628 1.824 3.406 . 0 0 "[ . 1 . 2 .]" 1
456 1 24 GLY HA2 1 25 LYS H 3.100 . 4.300 2.767 2.666 2.963 . 0 0 "[ . 1 . 2 .]" 1
457 1 24 GLY HA2 1 27 LEU HB2 2.700 . 3.600 2.420 1.986 2.789 . 0 0 "[ . 1 . 2 .]" 1
458 1 24 GLY HA2 1 27 LEU QD 3.400 . 4.800 3.337 2.961 3.769 . 0 0 "[ . 1 . 2 .]" 1
459 1 24 GLY HA2 1 60 VAL QG 2.800 . 3.800 2.643 2.180 3.212 . 0 0 "[ . 1 . 2 .]" 1
460 1 24 GLY HA3 1 25 LYS H 2.900 . 4.000 3.524 3.451 3.558 . 0 0 "[ . 1 . 2 .]" 1
461 1 24 GLY HA3 1 25 LYS HD2 3.300 . 4.700 3.560 2.438 4.148 . 0 0 "[ . 1 . 2 .]" 1
462 1 24 GLY HA3 1 27 LEU HB2 2.700 . 3.600 2.280 1.966 2.503 . 0 0 "[ . 1 . 2 .]" 1
463 1 24 GLY HA3 1 48 ILE MD 3.400 . 4.800 3.563 3.268 3.860 . 0 0 "[ . 1 . 2 .]" 1
464 1 24 GLY HA3 1 51 THR MG 2.800 . 3.800 2.425 2.004 2.679 . 0 0 "[ . 1 . 2 .]" 1
465 1 24 GLY HA3 1 52 SER H 3.400 . 4.800 3.830 3.128 3.964 . 0 0 "[ . 1 . 2 .]" 1
466 1 24 GLY HA3 1 60 VAL QG 2.900 . 4.000 2.816 2.379 3.296 . 0 0 "[ . 1 . 2 .]" 1
467 1 25 LYS H 1 25 LYS HA 2.700 . 3.600 2.788 2.745 2.876 . 0 0 "[ . 1 . 2 .]" 1
468 1 25 LYS H 1 25 LYS HA 2.600 . 3.400 2.781 2.714 2.870 . 0 0 "[ . 1 . 2 .]" 1
469 1 25 LYS H 1 25 LYS QB 2.500 . 3.300 2.201 2.023 2.449 . 0 0 "[ . 1 . 2 .]" 1
470 1 25 LYS H 1 25 LYS QB 2.300 . 3.000 2.051 1.843 2.255 . 0 0 "[ . 1 . 2 .]" 1
471 1 25 LYS H 1 25 LYS QB 2.200 . 2.800 2.072 1.871 2.212 . 0 0 "[ . 1 . 2 .]" 1
472 1 25 LYS H 1 25 LYS QG 2.900 . 4.000 3.060 1.982 3.866 . 0 0 "[ . 1 . 2 .]" 1
473 1 25 LYS H 1 25 LYS QG 3.100 . 4.300 3.008 1.981 3.775 . 0 0 "[ . 1 . 2 .]" 1
474 1 25 LYS H 1 25 LYS QG 3.200 . 4.500 3.164 1.981 3.934 . 0 0 "[ . 1 . 2 .]" 1
475 1 25 LYS H 1 26 GLU H 2.500 . 3.300 2.673 2.360 2.842 . 0 0 "[ . 1 . 2 .]" 1
476 1 25 LYS H 1 27 LEU H 2.500 . 3.300 2.911 2.741 3.038 . 0 0 "[ . 1 . 2 .]" 1
477 1 25 LYS H 1 28 LEU QD 3.200 . 4.500 2.347 1.717 3.168 0.183 9 0 "[ . 1 . 2 .]" 1
478 1 25 LYS H 1 46 LEU QD 3.600 . 5.200 4.020 3.257 4.592 . 0 0 "[ . 1 . 2 .]" 1
479 1 25 LYS H 1 48 ILE MD 3.200 . 4.500 2.519 2.248 2.865 . 0 0 "[ . 1 . 2 .]" 1
480 1 25 LYS H 1 48 ILE H 3.200 . 4.500 4.327 3.035 4.735 0.235 13 0 "[ . 1 . 2 .]" 1
481 1 25 LYS H 1 48 ILE MD 2.800 . 3.800 2.548 2.264 2.975 . 0 0 "[ . 1 . 2 .]" 1
482 1 25 LYS HA 1 25 LYS HD2 3.400 . 4.800 2.594 1.874 4.601 0.126 18 0 "[ . 1 . 2 .]" 1
483 1 25 LYS HA 1 25 LYS HD3 2.900 . 4.000 2.931 1.861 4.040 0.040 6 0 "[ . 1 . 2 .]" 1
484 1 25 LYS HA 1 25 LYS HD3 2.800 . 3.800 2.513 1.845 2.924 . 0 0 "[ . 1 . 2 .]" 1
485 1 25 LYS HA 1 25 LYS QG 2.700 . 3.600 2.676 2.336 2.966 . 0 0 "[ . 1 . 2 .]" 1
486 1 25 LYS HA 1 25 LYS QG 2.500 . 3.300 2.641 2.322 2.913 . 0 0 "[ . 1 . 2 .]" 1
487 1 25 LYS HA 1 26 GLU H 2.900 . 4.000 3.471 3.430 3.500 . 0 0 "[ . 1 . 2 .]" 1
488 1 25 LYS HA 1 28 LEU H 2.700 . 3.600 3.182 2.926 3.292 . 0 0 "[ . 1 . 2 .]" 1
489 1 25 LYS HA 1 28 LEU HG 3.300 . 4.700 4.539 3.858 4.899 0.199 25 0 "[ . 1 . 2 .]" 1
490 1 25 LYS HA 1 29 ASP H 3.000 . 4.100 3.610 3.439 3.816 . 0 0 "[ . 1 . 2 .]" 1
491 1 25 LYS HA 1 74 ILE MD 3.700 . 5.400 3.788 3.311 4.365 . 0 0 "[ . 1 . 2 .]" 1
492 1 25 LYS HA 1 28 LEU HB2 3.200 . 4.500 2.648 2.042 3.349 . 0 0 "[ . 1 . 2 .]" 1
493 1 25 LYS HA 1 28 LEU QD 3.800 . 5.600 2.796 2.464 3.062 . 0 0 "[ . 1 . 2 .]" 1
494 1 25 LYS HA 1 44 LYS HA 3.500 . 5.000 4.549 4.197 4.782 . 0 0 "[ . 1 . 2 .]" 1
495 1 25 LYS HA 1 48 ILE MD 2.400 . 3.100 2.276 1.841 2.681 . 0 0 "[ . 1 . 2 .]" 1
496 1 25 LYS QB 1 25 LYS HD2 2.600 . 3.400 2.074 1.940 2.261 . 0 0 "[ . 1 . 2 .]" 1
497 1 25 LYS QB 1 25 LYS QG 2.300 . 3.000 2.006 1.988 2.074 . 0 0 "[ . 1 . 2 .]" 1
498 1 25 LYS QB 1 26 GLU H 3.000 . 3.400 2.621 2.406 2.806 . 0 0 "[ . 1 . 2 .]" 1
499 1 25 LYS QB 1 26 GLU H 2.200 . 2.800 2.535 2.361 2.691 . 0 0 "[ . 1 . 2 .]" 1
500 1 25 LYS QB 1 26 GLU HG2 2.300 . 3.000 2.869 2.608 2.946 . 0 0 "[ . 1 . 2 .]" 1
501 1 25 LYS QB 1 27 LEU H 2.900 . 4.000 2.909 2.508 3.484 . 0 0 "[ . 1 . 2 .]" 1
502 1 25 LYS QB 1 29 ASP H 3.800 . 5.600 4.049 3.367 4.382 . 0 0 "[ . 1 . 2 .]" 1
503 1 25 LYS QB 1 48 ILE MD 2.900 . 4.000 2.963 1.706 3.669 0.094 4 0 "[ . 1 . 2 .]" 1
504 1 25 LYS QB 1 43 THR HB 2.700 . 3.600 3.995 3.638 4.364 0.764 25 11 "[ ** * *1* . -**2* * +]" 1
505 1 25 LYS QB 1 48 ILE MD 2.200 . 2.800 2.347 1.677 2.615 . 0 0 "[ . 1 . 2 .]" 1
506 1 25 LYS QB 1 48 ILE MD 2.900 . 4.000 2.968 1.706 3.681 0.094 4 0 "[ . 1 . 2 .]" 1
507 1 25 LYS HD2 1 28 LEU QD 3.600 . 5.200 3.777 2.639 4.961 . 0 0 "[ . 1 . 2 .]" 1
508 1 25 LYS HD2 1 48 ILE MD 3.000 . 4.100 2.945 1.865 4.266 0.166 4 0 "[ . 1 . 2 .]" 1
509 1 25 LYS HD3 1 28 LEU QD 3.600 . 5.200 4.053 3.172 5.313 0.113 6 0 "[ . 1 . 2 .]" 1
510 1 25 LYS HD3 1 29 ASP H 3.100 . 4.300 3.529 2.870 3.939 . 0 0 "[ . 1 . 2 .]" 1
511 1 25 LYS HD3 1 48 ILE MD 2.800 . 3.800 1.785 1.575 2.230 0.225 25 0 "[ . 1 . 2 .]" 1
512 1 25 LYS HD3 1 48 ILE HG13 2.600 . 3.400 2.690 1.863 3.210 . 0 0 "[ . 1 . 2 .]" 1
513 1 25 LYS HD3 1 47 LYS HA 2.700 . 3.600 2.013 1.510 2.877 0.290 8 0 "[ . 1 . 2 .]" 1
514 1 25 LYS HD3 1 48 ILE H 3.000 . 4.100 3.383 2.236 3.850 . 0 0 "[ . 1 . 2 .]" 1
515 1 25 LYS HD3 1 48 ILE MD 3.200 . 4.500 2.608 1.911 4.040 . 0 0 "[ . 1 . 2 .]" 1
516 1 25 LYS QE 1 48 ILE H 4.000 . 6.000 3.925 2.123 5.077 . 0 0 "[ . 1 . 2 .]" 1
517 1 25 LYS QG 1 26 GLU H 3.100 . 4.300 4.086 3.592 4.317 0.017 25 0 "[ . 1 . 2 .]" 1
518 1 25 LYS QG 1 29 ASP H 3.500 . 5.000 4.316 3.501 5.062 0.062 2 0 "[ . 1 . 2 .]" 1
519 1 25 LYS QG 1 48 ILE H 3.100 . 4.300 3.600 2.715 4.622 0.322 24 0 "[ . 1 . 2 .]" 1
520 1 25 LYS QG 1 48 ILE MD 2.600 . 3.400 2.875 1.757 3.743 0.343 21 0 "[ . 1 . 2 .]" 1
521 1 26 GLU H 1 26 GLU HA 2.500 . 3.300 2.772 2.739 2.813 . 0 0 "[ . 1 . 2 .]" 1
522 1 26 GLU H 1 26 GLU HB2 2.300 . 3.000 2.078 1.943 2.257 . 0 0 "[ . 1 . 2 .]" 1
523 1 26 GLU H 1 26 GLU HB3 2.300 . 3.000 3.386 3.252 3.484 0.484 1 0 "[ . 1 . 2 .]" 1
524 1 26 GLU H 1 26 GLU HG2 2.500 . 3.300 2.888 2.405 3.672 0.372 2 0 "[ . 1 . 2 .]" 1
525 1 26 GLU H 1 26 GLU HG3 2.700 . 3.600 3.652 2.692 3.865 0.265 19 0 "[ . 1 . 2 .]" 1
526 1 26 GLU H 1 27 LEU H 2.500 . 3.300 2.802 2.542 2.942 . 0 0 "[ . 1 . 2 .]" 1
527 1 26 GLU H 1 27 LEU QD 3.600 . 5.200 4.502 3.819 4.807 . 0 0 "[ . 1 . 2 .]" 1
528 1 26 GLU H 1 29 ASP H 3.100 . 4.300 4.509 4.376 4.691 0.391 2 0 "[ . 1 . 2 .]" 1
529 1 26 GLU H 1 48 ILE MD 3.600 . 5.200 4.433 4.224 4.745 . 0 0 "[ . 1 . 2 .]" 1
530 1 26 GLU HA 1 26 GLU HB2 2.400 . 3.100 2.944 2.862 2.999 . 0 0 "[ . 1 . 2 .]" 1
531 1 26 GLU HA 1 26 GLU HB3 2.400 . 3.100 2.675 2.534 2.811 . 0 0 "[ . 1 . 2 .]" 1
532 1 26 GLU HA 1 26 GLU HG2 2.800 . 3.800 2.503 2.123 2.837 . 0 0 "[ . 1 . 2 .]" 1
533 1 26 GLU HA 1 26 GLU HG3 2.600 . 3.400 3.549 3.091 3.659 0.259 1 0 "[ . 1 . 2 .]" 1
534 1 26 GLU HA 1 27 LEU H 3.000 . 4.100 3.561 3.529 3.594 . 0 0 "[ . 1 . 2 .]" 1
535 1 26 GLU HA 1 27 LEU H 2.600 . 3.400 3.194 3.064 3.306 . 0 0 "[ . 1 . 2 .]" 1
536 1 26 GLU HA 1 29 ASP HB2 2.800 . 3.800 3.449 2.929 3.871 0.071 20 0 "[ . 1 . 2 .]" 1
537 1 26 GLU HA 1 29 ASP HB2 2.900 . 4.000 3.416 2.920 3.806 . 0 0 "[ . 1 . 2 .]" 1
538 1 26 GLU HA 1 29 ASP HB3 2.500 . 3.300 2.753 2.389 3.247 . 0 0 "[ . 1 . 2 .]" 1
539 1 26 GLU HA 1 30 LYS H 2.800 . 3.800 2.803 2.733 2.841 . 0 0 "[ . 1 . 2 .]" 1
540 1 26 GLU HB2 1 26 GLU HG2 2.500 . 3.300 2.545 2.436 2.946 . 0 0 "[ . 1 . 2 .]" 1
541 1 26 GLU HB2 1 26 GLU HG3 2.000 . 2.500 2.311 2.206 2.388 . 0 0 "[ . 1 . 2 .]" 1
542 1 26 GLU HB2 1 27 LEU H 2.800 . 3.800 2.605 2.404 2.839 . 0 0 "[ . 1 . 2 .]" 1
543 1 26 GLU HB2 1 27 LEU QD 2.800 . 3.800 3.085 2.624 3.373 . 0 0 "[ . 1 . 2 .]" 1
544 1 26 GLU HB3 1 26 GLU HG2 2.500 . 3.300 2.960 2.622 3.001 . 0 0 "[ . 1 . 2 .]" 1
545 1 26 GLU HB3 1 26 GLU HG3 2.000 . 2.500 2.533 2.423 2.943 0.443 2 0 "[ . 1 . 2 .]" 1
546 1 26 GLU HB3 1 27 LEU H 2.700 . 3.600 2.937 2.514 3.592 . 0 0 "[ . 1 . 2 .]" 1
547 1 26 GLU HG2 1 27 LEU H 3.300 . 4.700 4.497 4.271 4.633 . 0 0 "[ . 1 . 2 .]" 1
548 1 26 GLU HG2 1 29 ASP H 3.600 . 5.200 4.683 4.379 5.335 0.135 3 0 "[ . 1 . 2 .]" 1
549 1 26 GLU HG3 1 27 LEU H 3.200 . 4.500 4.695 4.533 4.840 0.340 17 0 "[ . 1 . 2 .]" 1
550 1 26 GLU HG3 1 27 LEU QD 3.000 . 4.100 4.074 3.802 4.227 0.127 18 0 "[ . 1 . 2 .]" 1
551 1 27 LEU H 1 27 LEU HA 2.500 . 3.300 2.767 2.733 2.829 . 0 0 "[ . 1 . 2 .]" 1
552 1 27 LEU H 1 27 LEU HB2 2.600 . 3.400 2.576 2.250 2.856 . 0 0 "[ . 1 . 2 .]" 1
553 1 27 LEU H 1 27 LEU HB3 2.600 . 3.400 3.512 3.438 3.555 0.155 17 0 "[ . 1 . 2 .]" 1
554 1 27 LEU H 1 27 LEU HB3 2.500 . 3.300 3.559 3.507 3.597 0.297 17 0 "[ . 1 . 2 .]" 1
555 1 27 LEU H 1 27 LEU QD 2.900 . 4.000 2.719 1.894 3.073 . 0 0 "[ . 1 . 2 .]" 1
556 1 27 LEU H 1 27 LEU QD 3.100 . 4.300 2.707 1.893 3.051 0.007 6 0 "[ . 1 . 2 .]" 1
557 1 27 LEU H 1 27 LEU HG 2.700 . 3.600 2.365 1.689 3.893 0.293 10 0 "[ . 1 . 2 .]" 1
558 1 27 LEU H 1 28 LEU H 2.300 . 3.000 2.534 2.405 2.662 . 0 0 "[ . 1 . 2 .]" 1
559 1 27 LEU H 1 28 LEU HG 3.200 . 4.500 4.713 4.366 4.963 0.463 18 0 "[ . 1 . 2 .]" 1
560 1 27 LEU H 1 31 PHE H 3.700 . 5.400 3.959 3.720 4.314 . 0 0 "[ . 1 . 2 .]" 1
561 1 27 LEU H 1 35 ILE MD 3.600 . 5.200 4.255 4.084 4.438 . 0 0 "[ . 1 . 2 .]" 1
562 1 27 LEU HA 1 27 LEU HB2 2.700 . 3.600 3.012 2.979 3.026 . 0 0 "[ . 1 . 2 .]" 1
563 1 27 LEU HA 1 27 LEU HB3 3.000 . 4.100 2.465 2.338 2.642 . 0 0 "[ . 1 . 2 .]" 1
564 1 27 LEU HA 1 27 LEU HB3 2.600 . 3.400 2.458 2.326 2.631 . 0 0 "[ . 1 . 2 .]" 1
565 1 27 LEU HA 1 27 LEU QD 2.600 . 3.400 2.224 2.006 2.804 . 0 0 "[ . 1 . 2 .]" 1
566 1 27 LEU HA 1 27 LEU HG 3.100 . 4.300 3.024 2.491 3.332 . 0 0 "[ . 1 . 2 .]" 1
567 1 27 LEU HA 1 28 LEU H 3.300 . 4.700 3.549 3.520 3.575 . 0 0 "[ . 1 . 2 .]" 1
568 1 27 LEU HA 1 30 LYS H 3.500 . 5.000 3.766 3.587 3.936 . 0 0 "[ . 1 . 2 .]" 1
569 1 27 LEU HA 1 30 LYS HB2 3.700 . 5.400 3.373 2.685 3.856 . 0 0 "[ . 1 . 2 .]" 1
570 1 27 LEU HA 1 30 LYS HB3 3.600 . 5.200 4.975 4.171 5.401 0.201 9 0 "[ . 1 . 2 .]" 1
571 1 27 LEU HA 1 30 LYS QD 3.000 . 4.100 3.031 1.885 3.702 0.015 21 0 "[ . 1 . 2 .]" 1
572 1 27 LEU HA 1 30 LYS QE 2.900 . 4.000 3.647 2.780 4.121 0.121 17 0 "[ . 1 . 2 .]" 1
573 1 27 LEU HB2 1 27 LEU QD 2.500 . 3.300 2.178 2.073 2.248 . 0 0 "[ . 1 . 2 .]" 1
574 1 27 LEU HB2 1 27 LEU QD 2.300 . 3.000 2.057 1.966 2.152 . 0 0 "[ . 1 . 2 .]" 1
575 1 27 LEU HB2 1 27 LEU HG 2.400 . 3.100 2.595 2.435 3.010 . 0 0 "[ . 1 . 2 .]" 1
576 1 27 LEU HB2 1 28 LEU H 2.700 . 3.600 2.057 1.819 2.344 . 0 0 "[ . 1 . 2 .]" 1
577 1 27 LEU HB2 1 48 ILE MD 3.300 . 4.700 2.889 2.458 3.592 . 0 0 "[ . 1 . 2 .]" 1
578 1 27 LEU HB2 1 60 VAL QG 2.700 . 2.800 2.020 1.584 2.377 0.216 2 0 "[ . 1 . 2 .]" 1
579 1 27 LEU HB2 1 74 ILE MD 2.600 . 3.400 2.905 2.454 3.705 0.305 19 0 "[ . 1 . 2 .]" 1
580 1 27 LEU HB2 1 60 VAL QG 3.200 . 4.500 2.931 2.706 3.450 . 0 0 "[ . 1 . 2 .]" 1
581 1 27 LEU HB3 1 27 LEU QD 2.300 . 3.000 2.134 2.090 2.290 . 0 0 "[ . 1 . 2 .]" 1
582 1 27 LEU HB3 1 27 LEU HG 2.400 . 3.100 2.887 2.392 3.007 . 0 0 "[ . 1 . 2 .]" 1
583 1 27 LEU HB3 1 28 LEU H 2.900 . 4.000 3.129 2.567 3.501 . 0 0 "[ . 1 . 2 .]" 1
584 1 27 LEU HB3 1 28 LEU H 2.800 . 3.800 3.120 2.565 3.478 . 0 0 "[ . 1 . 2 .]" 1
585 1 27 LEU HB3 1 29 ASP H 3.500 . 5.000 3.372 2.023 4.488 . 0 0 "[ . 1 . 2 .]" 1
586 1 27 LEU HB3 1 83 MET ME 2.500 . 3.300 2.808 1.830 3.423 0.123 19 0 "[ . 1 . 2 .]" 1
587 1 27 LEU HB3 1 60 VAL QG 2.600 . 3.400 2.803 2.638 3.427 0.027 21 0 "[ . 1 . 2 .]" 1
588 1 27 LEU HB3 1 60 VAL QG 3.200 . 4.500 3.515 3.199 4.151 . 0 0 "[ . 1 . 2 .]" 1
589 1 27 LEU HB3 1 74 ILE H 3.200 . 4.500 3.896 3.757 3.951 . 0 0 "[ . 1 . 2 .]" 1
590 1 27 LEU HB3 1 74 ILE MD 3.400 . 4.800 2.060 1.774 2.541 0.226 9 0 "[ . 1 . 2 .]" 1
591 1 27 LEU HB3 1 74 ILE MD 2.200 . 2.800 1.731 1.626 1.840 . 0 0 "[ . 1 . 2 .]" 1
592 1 27 LEU HB3 1 74 ILE MG 2.500 . 3.300 2.240 2.155 2.319 . 0 0 "[ . 1 . 2 .]" 1
593 1 27 LEU QD 1 28 LEU H 3.300 . 4.700 3.621 3.424 3.738 . 0 0 "[ . 1 . 2 .]" 1
594 1 27 LEU QD 1 28 LEU HA 3.300 . 4.700 4.908 4.804 5.008 0.308 24 0 "[ . 1 . 2 .]" 1
595 1 27 LEU QD 1 30 LYS QD 2.900 . 4.000 3.707 2.935 3.997 . 0 0 "[ . 1 . 2 .]" 1
596 1 27 LEU QD 1 30 LYS QE 3.000 . 4.100 3.739 3.086 4.172 0.072 2 0 "[ . 1 . 2 .]" 1
597 1 27 LEU QD 1 31 PHE QE 3.200 . 4.500 2.937 1.887 3.770 0.013 13 0 "[ . 1 . 2 .]" 1
598 1 27 LEU QD 1 48 ILE MD 2.900 . 4.000 4.331 4.157 4.640 0.640 6 1 "[ .+ 1 . 2 .]" 1
599 1 27 LEU QD 1 58 TYR HB2 2.800 . 3.800 3.287 2.929 3.957 0.157 15 0 "[ . 1 . 2 .]" 1
600 1 27 LEU QD 1 58 TYR HB3 2.900 . 4.000 2.742 2.332 3.512 . 0 0 "[ . 1 . 2 .]" 1
601 1 27 LEU QD 1 58 TYR QE 2.900 . 4.000 2.989 2.741 3.431 . 0 0 "[ . 1 . 2 .]" 1
602 1 27 LEU QD 1 60 VAL QG 2.600 . 3.100 2.125 1.767 2.719 0.033 24 0 "[ . 1 . 2 .]" 1
603 1 27 LEU QD 1 74 ILE HB 3.300 . 4.700 3.298 2.647 3.817 . 0 0 "[ . 1 . 2 .]" 1
604 1 27 LEU QD 1 74 ILE MD 2.500 . 3.100 2.175 1.783 2.857 . 0 0 "[ . 1 . 2 .]" 1
605 1 27 LEU QD 1 74 ILE MG 2.600 . 3.400 3.028 2.363 3.489 0.089 10 0 "[ . 1 . 2 .]" 1
606 1 27 LEU HG 1 74 ILE MD 2.800 . 3.800 4.005 3.458 4.272 0.472 17 0 "[ . 1 . 2 .]" 1
607 1 28 LEU H 1 28 LEU HA 2.600 . 3.400 2.764 2.694 2.804 . 0 0 "[ . 1 . 2 .]" 1
608 1 28 LEU H 1 28 LEU HB2 2.700 . 3.600 2.309 2.218 2.400 . 0 0 "[ . 1 . 2 .]" 1
609 1 28 LEU H 1 28 LEU HB3 2.600 . 3.400 3.532 3.468 3.585 0.185 9 0 "[ . 1 . 2 .]" 1
610 1 28 LEU H 1 28 LEU HB3 2.400 . 3.100 2.284 1.715 2.975 . 0 0 "[ . 1 . 2 .]" 1
611 1 28 LEU H 1 28 LEU QD 2.400 . 3.100 2.371 1.719 3.216 0.116 12 0 "[ . 1 . 2 .]" 1
612 1 28 LEU H 1 28 LEU QD 3.000 . 4.100 2.354 1.718 3.177 0.182 9 0 "[ . 1 . 2 .]" 1
613 1 28 LEU H 1 28 LEU HG 3.000 . 4.100 3.187 2.388 3.791 . 0 0 "[ . 1 . 2 .]" 1
614 1 28 LEU H 1 29 ASP H 2.400 . 3.100 2.758 2.590 2.965 . 0 0 "[ . 1 . 2 .]" 1
615 1 28 LEU H 1 35 ILE MD 3.600 . 5.200 4.891 4.501 5.276 0.076 23 0 "[ . 1 . 2 .]" 1
616 1 28 LEU H 1 35 ILE QG 3.300 . 4.700 3.665 3.524 3.900 . 0 0 "[ . 1 . 2 .]" 1
617 1 28 LEU H 1 35 ILE QG 3.700 . 5.400 3.564 3.439 3.799 . 0 0 "[ . 1 . 2 .]" 1
618 1 28 LEU H 1 43 THR MG 3.600 . 5.200 4.446 4.249 4.722 . 0 0 "[ . 1 . 2 .]" 1
619 1 28 LEU H 1 48 ILE MD 3.800 . 5.600 3.419 3.245 3.697 . 0 0 "[ . 1 . 2 .]" 1
620 1 28 LEU HA 1 28 LEU HB2 2.900 . 4.000 2.996 2.970 3.011 . 0 0 "[ . 1 . 2 .]" 1
621 1 28 LEU HA 1 28 LEU HB2 2.600 . 3.400 2.680 2.486 2.881 . 0 0 "[ . 1 . 2 .]" 1
622 1 28 LEU HA 1 28 LEU QD 3.400 . 4.800 2.372 1.846 2.759 0.154 4 0 "[ . 1 . 2 .]" 1
623 1 28 LEU HA 1 28 LEU QD 2.900 . 4.000 2.216 1.833 2.543 . 0 0 "[ . 1 . 2 .]" 1
624 1 28 LEU HA 1 28 LEU HG 2.400 . 3.100 2.573 2.417 2.780 . 0 0 "[ . 1 . 2 .]" 1
625 1 28 LEU HA 1 29 ASP H 3.000 . 4.100 3.510 3.466 3.574 . 0 0 "[ . 1 . 2 .]" 1
626 1 28 LEU HA 1 30 LYS H 3.000 . 4.100 3.269 2.947 3.536 . 0 0 "[ . 1 . 2 .]" 1
627 1 28 LEU HA 1 31 PHE H 2.900 . 4.000 3.378 2.994 3.651 . 0 0 "[ . 1 . 2 .]" 1
628 1 28 LEU HA 1 31 PHE QD 3.200 . 4.500 3.398 2.558 4.018 . 0 0 "[ . 1 . 2 .]" 1
629 1 28 LEU HA 1 35 ILE MD 2.900 . 4.000 2.704 2.335 3.036 . 0 0 "[ . 1 . 2 .]" 1
630 1 28 LEU HA 1 35 ILE QG 2.700 . 3.600 2.406 2.346 2.526 . 0 0 "[ . 1 . 2 .]" 1
631 1 28 LEU HA 1 43 THR MG 3.300 . 4.700 3.042 2.648 3.582 . 0 0 "[ . 1 . 2 .]" 1
632 1 28 LEU HA 1 43 THR HB 3.300 . 4.700 4.299 3.633 4.792 0.092 6 0 "[ . 1 . 2 .]" 1
633 1 28 LEU HA 1 48 ILE MD 3.400 . 4.800 4.650 3.473 5.062 0.262 21 0 "[ . 1 . 2 .]" 1
634 1 28 LEU HA 1 74 ILE MD 3.600 . 5.200 3.363 2.871 3.895 . 0 0 "[ . 1 . 2 .]" 1
635 1 28 LEU HB2 1 28 LEU QD 2.800 . 3.800 2.167 2.110 2.265 . 0 0 "[ . 1 . 2 .]" 1
636 1 28 LEU HB2 1 28 LEU QD 2.700 . 3.600 2.058 1.976 2.224 . 0 0 "[ . 1 . 2 .]" 1
637 1 28 LEU HB2 1 28 LEU HG 2.800 . 3.800 2.825 2.487 3.017 . 0 0 "[ . 1 . 2 .]" 1
638 1 28 LEU HB2 1 28 LEU HG 2.400 . 3.100 2.708 2.460 2.890 . 0 0 "[ . 1 . 2 .]" 1
639 1 28 LEU HB2 1 29 ASP H 2.900 . 4.000 2.859 2.569 3.061 . 0 0 "[ . 1 . 2 .]" 1
640 1 28 LEU HB2 1 29 ASP HA 2.900 . 4.000 3.611 2.850 3.971 . 0 0 "[ . 1 . 2 .]" 1
641 1 28 LEU HB2 1 32 GLN H 3.200 . 4.500 3.721 3.344 4.205 . 0 0 "[ . 1 . 2 .]" 1
642 1 28 LEU HB2 1 35 ILE MD 2.400 . 3.100 2.061 1.744 2.866 . 0 0 "[ . 1 . 2 .]" 1
643 1 28 LEU HB2 1 43 THR HB 2.900 . 4.000 3.031 2.773 3.712 . 0 0 "[ . 1 . 2 .]" 1
644 1 28 LEU HB2 1 46 LEU QD 2.800 . 3.800 2.055 1.759 2.561 0.041 12 0 "[ . 1 . 2 .]" 1
645 1 28 LEU HB2 1 48 ILE MD 2.400 . 3.100 2.078 2.046 2.098 . 0 0 "[ . 1 . 2 .]" 1
646 1 28 LEU HB3 1 28 LEU QD 2.400 . 3.100 2.191 2.085 2.317 . 0 0 "[ . 1 . 2 .]" 1
647 1 28 LEU HB3 1 28 LEU QD 2.800 . 3.800 2.159 2.062 2.253 . 0 0 "[ . 1 . 2 .]" 1
648 1 28 LEU HB3 1 43 THR MG 2.800 . 3.800 1.936 1.604 2.538 0.196 12 0 "[ . 1 . 2 .]" 1
649 1 28 LEU HB3 1 83 MET HG2 3.200 . 4.500 4.560 3.340 5.092 0.592 18 3 "[- *. 1 . + 2 .]" 1
650 1 28 LEU HB3 1 28 LEU HG 2.700 . 3.600 2.694 2.419 3.008 . 0 0 "[ . 1 . 2 .]" 1
651 1 28 LEU HB3 1 29 ASP H 2.800 . 3.800 3.580 3.231 3.744 . 0 0 "[ . 1 . 2 .]" 1
652 1 28 LEU HB3 1 29 ASP H 2.700 . 3.600 3.557 3.220 3.726 0.126 1 0 "[ . 1 . 2 .]" 1
653 1 28 LEU HB3 1 29 ASP HA 3.000 . 4.100 2.561 2.491 2.682 . 0 0 "[ . 1 . 2 .]" 1
654 1 28 LEU HB3 1 43 THR H 3.000 . 4.100 3.636 2.671 4.079 . 0 0 "[ . 1 . 2 .]" 1
655 1 28 LEU MD1 1 28 LEU MD2 2.500 . 3.300 2.086 2.080 2.095 . 0 0 "[ . 1 . 2 .]" 1
656 1 28 LEU QD 1 28 LEU HG 2.100 . 2.700 1.862 1.840 1.873 . 0 0 "[ . 1 . 2 .]" 1
657 1 28 LEU QD 1 29 ASP H 3.500 . 5.000 3.830 3.574 4.131 . 0 0 "[ . 1 . 2 .]" 1
658 1 28 LEU MD1 1 28 LEU MD2 2.700 . 3.600 2.080 2.070 2.085 . 0 0 "[ . 1 . 2 .]" 1
659 1 28 LEU QD 1 43 THR MG 2.300 . 3.000 1.840 1.616 2.079 . 0 0 "[ . 1 . 2 .]" 1
660 1 28 LEU QD 1 46 LEU QD 2.800 . 3.800 1.971 1.726 2.363 0.074 1 0 "[ . 1 . 2 .]" 1
661 1 28 LEU QD 1 60 VAL QG 2.800 . 3.800 1.749 1.407 2.346 0.393 17 0 "[ . 1 . 2 .]" 1
662 1 28 LEU QD 1 46 LEU H 3.600 . 5.200 2.775 2.307 3.448 . 0 0 "[ . 1 . 2 .]" 1
663 1 28 LEU QD 1 46 LEU QD 3.000 . 4.100 1.984 1.733 2.485 0.167 1 0 "[ . 1 . 2 .]" 1
664 1 28 LEU QD 1 48 ILE MD 2.500 . 3.300 1.839 1.617 2.398 0.083 25 0 "[ . 1 . 2 .]" 1
665 1 28 LEU QD 1 72 PHE H 3.100 . 4.300 3.105 2.855 3.397 . 0 0 "[ . 1 . 2 .]" 1
666 1 28 LEU QD 1 60 VAL HB 3.100 . 4.300 2.588 2.049 3.136 . 0 0 "[ . 1 . 2 .]" 1
667 1 28 LEU QD 1 60 VAL QG 2.700 . 3.100 1.606 1.382 2.031 0.418 17 0 "[ . 1 . 2 .]" 1
668 1 28 LEU QD 1 62 VAL MG1 2.500 . 3.300 2.036 1.855 2.272 . 0 0 "[ . 1 . 2 .]" 1
669 1 28 LEU QD 1 62 VAL QG 2.700 . 3.600 2.011 1.838 2.231 . 0 0 "[ . 1 . 2 .]" 1
670 1 28 LEU QD 1 68 GLU HB3 2.700 . 3.600 3.236 2.151 4.191 0.591 1 2 "[+ - . 1 . 2 .]" 1
671 1 28 LEU QD 1 72 PHE H 3.500 . 5.000 3.854 3.571 4.046 . 0 0 "[ . 1 . 2 .]" 1
672 1 28 LEU QD 1 72 PHE QE 3.900 . 5.800 3.209 2.698 4.045 . 0 0 "[ . 1 . 2 .]" 1
673 1 28 LEU HG 1 29 ASP H 3.600 . 5.200 4.925 4.638 5.161 . 0 0 "[ . 1 . 2 .]" 1
674 1 28 LEU HG 1 31 PHE QD 3.600 . 5.200 5.035 4.338 5.561 0.361 2 0 "[ . 1 . 2 .]" 1
675 1 28 LEU HG 1 35 ILE MD 2.400 . 3.100 3.320 2.664 3.963 0.863 4 9 "[ +. * -*** . 2** *.]" 1
676 1 28 LEU HG 1 35 ILE QG 2.400 . 3.100 2.949 2.552 3.136 0.036 6 0 "[ . 1 . 2 .]" 1
677 1 28 LEU HG 1 35 ILE QG 2.500 . 3.300 2.902 2.539 3.068 . 0 0 "[ . 1 . 2 .]" 1
678 1 28 LEU HG 1 43 THR MG 2.700 . 3.600 3.660 3.132 3.982 0.382 1 0 "[ . 1 . 2 .]" 1
679 1 28 LEU HG 1 46 LEU HB2 2.400 . 3.100 3.030 2.576 3.285 0.185 6 0 "[ . 1 . 2 .]" 1
680 1 28 LEU HG 1 46 LEU QD 3.000 . 4.100 3.910 3.388 4.136 0.036 4 0 "[ . 1 . 2 .]" 1
681 1 28 LEU HG 1 46 LEU QD 2.800 . 3.800 3.837 3.363 4.012 0.212 4 0 "[ . 1 . 2 .]" 1
682 1 28 LEU HG 1 48 ILE MD 2.900 . 4.000 4.052 3.640 4.254 0.254 5 0 "[ . 1 . 2 .]" 1
683 1 28 LEU HG 1 48 ILE MD 2.600 . 3.400 3.122 2.623 3.406 0.006 6 0 "[ . 1 . 2 .]" 1
684 1 28 LEU HG 1 60 VAL HB 2.800 . 3.800 3.889 3.795 3.991 0.191 17 0 "[ . 1 . 2 .]" 1
685 1 28 LEU HG 1 60 VAL HB 2.800 . 3.800 3.847 3.762 3.933 0.133 17 0 "[ . 1 . 2 .]" 1
686 1 28 LEU HG 1 60 VAL QG 2.600 . 3.400 3.042 2.580 3.301 . 0 0 "[ . 1 . 2 .]" 1
687 1 28 LEU HG 1 60 VAL QG 2.400 . 3.100 2.968 2.555 3.165 0.065 6 0 "[ . 1 . 2 .]" 1
688 1 28 LEU HG 1 72 PHE QB 3.000 . 4.100 3.535 3.100 3.823 . 0 0 "[ . 1 . 2 .]" 1
689 1 28 LEU HG 1 72 PHE QD 3.100 . 4.300 4.002 3.261 4.384 0.084 7 0 "[ . 1 . 2 .]" 1
690 1 28 LEU HG 1 72 PHE QE 3.500 . 5.000 4.818 3.808 5.262 0.262 10 0 "[ . 1 . 2 .]" 1
691 1 28 LEU HG 1 74 ILE MD 2.600 . 3.400 3.262 2.653 3.653 0.253 22 0 "[ . 1 . 2 .]" 1
692 1 29 ASP H 1 29 ASP HA 2.400 . 3.100 2.830 2.791 2.873 . 0 0 "[ . 1 . 2 .]" 1
693 1 29 ASP H 1 29 ASP HB2 2.300 . 3.000 2.546 2.337 2.723 . 0 0 "[ . 1 . 2 .]" 1
694 1 29 ASP H 1 29 ASP HB3 2.200 . 2.800 2.557 2.403 2.737 . 0 0 "[ . 1 . 2 .]" 1
695 1 29 ASP H 1 29 ASP HB3 2.300 . 3.000 2.523 2.385 2.680 . 0 0 "[ . 1 . 2 .]" 1
696 1 29 ASP H 1 30 LYS H 2.500 . 3.300 2.671 2.513 2.806 . 0 0 "[ . 1 . 2 .]" 1
697 1 29 ASP H 1 35 ILE QG 3.700 . 5.400 4.700 3.458 5.789 0.389 8 0 "[ . 1 . 2 .]" 1
698 1 29 ASP H 1 43 THR MG 3.400 . 4.800 4.016 3.625 4.216 . 0 0 "[ . 1 . 2 .]" 1
699 1 29 ASP H 1 48 ILE MD 3.900 . 5.800 4.716 4.508 5.018 . 0 0 "[ . 1 . 2 .]" 1
700 1 29 ASP HA 1 29 ASP HB2 2.200 . 2.800 2.470 2.395 2.563 . 0 0 "[ . 1 . 2 .]" 1
701 1 29 ASP HA 1 29 ASP HB3 2.600 . 3.400 3.001 2.960 3.022 . 0 0 "[ . 1 . 2 .]" 1
702 1 29 ASP HA 1 30 LYS H 3.400 . 4.800 3.535 3.502 3.571 . 0 0 "[ . 1 . 2 .]" 1
703 1 29 ASP HA 1 30 LYS H 2.800 . 3.800 3.384 3.288 3.461 . 0 0 "[ . 1 . 2 .]" 1
704 1 29 ASP HA 1 31 PHE H 3.400 . 4.800 4.352 3.850 4.708 . 0 0 "[ . 1 . 2 .]" 1
705 1 29 ASP HA 1 32 GLN H 2.800 . 3.800 3.570 3.211 3.859 0.059 5 0 "[ . 1 . 2 .]" 1
706 1 29 ASP HA 1 32 GLN HB2 2.700 . 3.600 2.703 2.091 3.607 0.007 5 0 "[ . 1 . 2 .]" 1
707 1 29 ASP HA 1 32 GLN HB3 2.700 . 3.600 3.291 2.005 3.725 0.125 11 0 "[ . 1 . 2 .]" 1
708 1 29 ASP HA 1 32 GLN QG 3.600 . 5.200 4.149 3.207 4.779 . 0 0 "[ . 1 . 2 .]" 1
709 1 29 ASP HA 1 43 THR HB 3.000 . 4.100 3.806 2.980 4.133 0.033 15 0 "[ . 1 . 2 .]" 1
710 1 29 ASP HA 1 43 THR MG 3.100 . 4.300 3.807 2.882 4.354 0.054 7 0 "[ . 1 . 2 .]" 1
711 1 29 ASP HB2 1 30 LYS H 3.400 . 4.800 3.872 3.708 4.073 . 0 0 "[ . 1 . 2 .]" 1
712 1 29 ASP HB2 1 30 LYS H 3.000 . 4.100 3.813 3.649 3.987 . 0 0 "[ . 1 . 2 .]" 1
713 1 29 ASP HB2 1 31 PHE QE 3.600 . 5.200 4.712 4.095 5.202 0.003 24 0 "[ . 1 . 2 .]" 1
714 1 29 ASP HB2 1 32 GLN HB2 2.200 . 2.800 2.295 2.093 2.479 . 0 0 "[ . 1 . 2 .]" 1
715 1 29 ASP HB2 1 32 GLN HE21 3.400 . 4.800 2.469 2.141 2.793 . 0 0 "[ . 1 . 2 .]" 1
716 1 29 ASP HB2 1 32 GLN HE22 3.100 . 4.300 3.335 3.199 3.478 . 0 0 "[ . 1 . 2 .]" 1
717 1 29 ASP HB2 1 43 THR MG 3.100 . 4.300 2.757 1.966 3.820 . 0 0 "[ . 1 . 2 .]" 1
718 1 29 ASP HB3 1 30 LYS H 3.400 . 4.800 2.615 2.398 2.833 . 0 0 "[ . 1 . 2 .]" 1
719 1 30 LYS H 1 30 LYS HA 2.500 . 3.300 2.729 2.689 2.761 . 0 0 "[ . 1 . 2 .]" 1
720 1 30 LYS H 1 30 LYS HB2 2.900 . 4.000 2.541 2.267 2.689 . 0 0 "[ . 1 . 2 .]" 1
721 1 30 LYS H 1 30 LYS HB2 2.600 . 3.400 2.313 2.131 2.432 . 0 0 "[ . 1 . 2 .]" 1
722 1 30 LYS H 1 30 LYS HB3 2.700 . 3.600 3.114 2.952 3.399 . 0 0 "[ . 1 . 2 .]" 1
723 1 30 LYS H 1 30 LYS HB3 2.700 . 3.600 3.271 3.015 3.381 . 0 0 "[ . 1 . 2 .]" 1
724 1 30 LYS H 1 30 LYS QD 3.100 . 4.300 3.698 2.089 3.964 . 0 0 "[ . 1 . 2 .]" 1
725 1 30 LYS H 1 30 LYS QD 3.000 . 4.100 3.549 2.083 3.831 . 0 0 "[ . 1 . 2 .]" 1
726 1 30 LYS H 1 30 LYS HG2 2.500 . 3.300 3.217 3.024 3.578 0.278 14 0 "[ . 1 . 2 .]" 1
727 1 30 LYS H 1 30 LYS HG3 3.700 . 5.400 2.238 1.965 3.347 0.035 7 0 "[ . 1 . 2 .]" 1
728 1 30 LYS H 1 30 LYS HG3 3.200 . 4.500 2.229 1.960 3.300 . 0 0 "[ . 1 . 2 .]" 1
729 1 30 LYS H 1 32 GLN H 2.300 . 3.000 2.432 2.258 2.607 . 0 0 "[ . 1 . 2 .]" 1
730 1 30 LYS H 1 35 ILE MD 3.500 . 5.000 4.002 3.584 4.784 . 0 0 "[ . 1 . 2 .]" 1
731 1 30 LYS H 1 43 THR MG 3.400 . 4.800 4.355 3.887 4.666 . 0 0 "[ . 1 . 2 .]" 1
732 1 30 LYS H 1 32 GLN H 3.400 . 4.800 3.877 3.658 4.090 . 0 0 "[ . 1 . 2 .]" 1
733 1 30 LYS HA 1 30 LYS HB2 2.600 . 3.400 3.022 2.998 3.029 . 0 0 "[ . 1 . 2 .]" 1
734 1 30 LYS HA 1 30 LYS HB3 2.800 . 3.800 2.455 2.392 2.604 . 0 0 "[ . 1 . 2 .]" 1
735 1 30 LYS HA 1 30 LYS HB3 2.300 . 3.000 2.270 2.216 2.485 . 0 0 "[ . 1 . 2 .]" 1
736 1 30 LYS HA 1 30 LYS HG2 2.700 . 3.600 2.571 2.424 3.131 . 0 0 "[ . 1 . 2 .]" 1
737 1 30 LYS HA 1 30 LYS HG3 2.700 . 3.600 3.073 2.389 3.269 . 0 0 "[ . 1 . 2 .]" 1
738 1 30 LYS HA 1 31 PHE H 2.800 . 3.800 3.504 3.424 3.554 . 0 0 "[ . 1 . 2 .]" 1
739 1 30 LYS HA 1 32 GLN H 3.100 . 4.300 3.867 3.721 4.044 . 0 0 "[ . 1 . 2 .]" 1
740 1 30 LYS HB2 1 30 LYS HG3 2.800 . 3.800 2.488 2.404 2.973 . 0 0 "[ . 1 . 2 .]" 1
741 1 30 LYS HB2 1 31 PHE H 3.000 . 4.100 2.696 2.341 3.093 . 0 0 "[ . 1 . 2 .]" 1
742 1 30 LYS HB3 1 30 LYS HG3 2.600 . 3.400 2.989 2.632 3.012 . 0 0 "[ . 1 . 2 .]" 1
743 1 30 LYS HB3 1 31 PHE H 2.900 . 4.000 3.764 3.268 4.038 0.038 20 0 "[ . 1 . 2 .]" 1
744 1 30 LYS QD 1 30 LYS QE 1.900 . 2.400 2.013 1.945 2.087 . 0 0 "[ . 1 . 2 .]" 1
745 1 30 LYS QD 1 30 LYS HG3 2.100 . 2.700 2.367 2.161 2.438 . 0 0 "[ . 1 . 2 .]" 1
746 1 30 LYS QD 1 30 LYS HG3 2.000 . 2.500 2.091 1.955 2.147 . 0 0 "[ . 1 . 2 .]" 1
747 1 30 LYS QD 1 31 PHE QE 3.300 . 4.700 3.556 2.850 4.475 . 0 0 "[ . 1 . 2 .]" 1
748 1 30 LYS QE 1 30 LYS HG2 3.000 . 4.100 2.790 2.383 3.157 . 0 0 "[ . 1 . 2 .]" 1
749 1 30 LYS QE 1 30 LYS HG2 2.300 . 3.000 2.539 2.188 2.927 . 0 0 "[ . 1 . 2 .]" 1
750 1 30 LYS QE 1 30 LYS HG2 2.800 . 3.800 2.230 2.042 2.553 . 0 0 "[ . 1 . 2 .]" 1
751 1 30 LYS QE 1 30 LYS HG3 2.500 . 3.300 2.572 2.276 3.302 0.002 1 0 "[ . 1 . 2 .]" 1
752 1 30 LYS HG3 1 31 PHE QE 3.200 . 4.500 2.205 1.805 2.686 0.095 24 0 "[ . 1 . 2 .]" 1
753 1 30 LYS HG3 1 34 ASP H 3.800 . 5.600 4.342 3.732 5.049 . 0 0 "[ . 1 . 2 .]" 1
754 1 31 PHE H 1 31 PHE HA 2.700 . 3.600 2.919 2.843 2.944 . 0 0 "[ . 1 . 2 .]" 1
755 1 31 PHE H 1 31 PHE HB2 2.600 . 3.400 2.555 2.292 2.793 . 0 0 "[ . 1 . 2 .]" 1
756 1 31 PHE H 1 31 PHE HB3 2.800 . 3.800 3.654 3.549 3.712 . 0 0 "[ . 1 . 2 .]" 1
757 1 31 PHE H 1 31 PHE QD 3.100 . 4.300 2.761 1.988 3.296 . 0 0 "[ . 1 . 2 .]" 1
758 1 31 PHE H 1 31 PHE QE 3.900 . 5.800 4.478 4.268 4.935 . 0 0 "[ . 1 . 2 .]" 1
759 1 31 PHE H 1 32 GLN H 2.300 . 3.000 2.459 2.274 2.647 . 0 0 "[ . 1 . 2 .]" 1
760 1 31 PHE H 1 32 GLN HA 3.600 . 5.200 4.618 4.385 4.997 . 0 0 "[ . 1 . 2 .]" 1
761 1 31 PHE H 1 32 GLN HB2 3.700 . 5.400 4.642 4.002 5.554 0.154 5 0 "[ . 1 . 2 .]" 1
762 1 31 PHE H 1 32 GLN HB3 3.600 . 5.200 4.660 3.952 5.013 . 0 0 "[ . 1 . 2 .]" 1
763 1 31 PHE HA 1 31 PHE HB2 2.900 . 4.000 3.016 3.001 3.027 . 0 0 "[ . 1 . 2 .]" 1
764 1 31 PHE HA 1 31 PHE HB3 3.000 . 4.100 2.445 2.337 2.584 . 0 0 "[ . 1 . 2 .]" 1
765 1 31 PHE HA 1 32 GLN H 2.800 . 3.800 3.205 3.079 3.371 . 0 0 "[ . 1 . 2 .]" 1
766 1 31 PHE HA 1 34 ASP H 3.000 . 4.100 3.258 2.716 3.668 . 0 0 "[ . 1 . 2 .]" 1
767 1 31 PHE HB2 1 31 PHE QD 2.900 . 4.000 2.356 2.257 2.654 . 0 0 "[ . 1 . 2 .]" 1
768 1 31 PHE HB2 1 32 GLN H 3.400 . 4.800 3.677 3.411 3.867 . 0 0 "[ . 1 . 2 .]" 1
769 1 31 PHE HB2 1 36 LYS H 3.600 . 5.200 4.221 3.946 4.340 . 0 0 "[ . 1 . 2 .]" 1
770 1 31 PHE HB2 1 35 ILE H 3.500 . 5.000 4.563 4.010 5.064 0.064 2 0 "[ . 1 . 2 .]" 1
771 1 31 PHE HB2 1 35 ILE MD 2.700 . 3.600 2.589 2.097 3.395 . 0 0 "[ . 1 . 2 .]" 1
772 1 31 PHE HB3 1 31 PHE QD 3.000 . 4.100 2.532 2.245 2.760 . 0 0 "[ . 1 . 2 .]" 1
773 1 31 PHE HB3 1 32 GLN H 3.800 . 5.600 4.350 4.043 4.540 . 0 0 "[ . 1 . 2 .]" 1
774 1 31 PHE HB3 1 35 ILE H 3.700 . 5.400 3.850 3.121 4.615 . 0 0 "[ . 1 . 2 .]" 1
775 1 31 PHE HB3 1 35 ILE MD 3.000 . 4.100 3.197 1.971 4.108 0.029 4 0 "[ . 1 . 2 .]" 1
776 1 31 PHE HB3 1 83 MET H 4.100 . 6.000 5.047 3.776 6.128 0.128 22 0 "[ . 1 . 2 .]" 1
777 1 31 PHE HB3 1 83 MET ME 3.100 . 4.300 3.314 2.254 4.448 0.148 1 0 "[ . 1 . 2 .]" 1
778 1 31 PHE QD 1 32 GLN H 3.200 . 4.500 4.583 4.364 4.794 0.294 14 0 "[ . 1 . 2 .]" 1
779 1 31 PHE QD 1 35 ILE MD 3.500 . 5.000 3.765 2.708 4.520 . 0 0 "[ . 1 . 2 .]" 1
780 1 31 PHE QD 1 74 ILE MD 3.100 . 4.300 2.427 1.742 3.495 0.158 17 0 "[ . 1 . 2 .]" 1
781 1 31 PHE QD 1 83 MET H 4.900 . 6.000 4.469 2.705 6.065 0.065 17 0 "[ . 1 . 2 .]" 1
782 1 31 PHE QE 1 35 ILE MD 3.300 . 4.700 2.888 2.206 3.179 . 0 0 "[ . 1 . 2 .]" 1
783 1 31 PHE QE 1 35 ILE QG 3.100 . 4.300 2.986 2.362 3.301 . 0 0 "[ . 1 . 2 .]" 1
784 1 31 PHE QE 1 83 MET H 4.100 . 6.000 4.363 1.986 6.063 0.063 10 0 "[ . 1 . 2 .]" 1
785 1 31 PHE QE 1 62 VAL MG2 3.000 . 4.100 2.378 1.933 2.762 . 0 0 "[ . 1 . 2 .]" 1
786 1 31 PHE QE 1 58 TYR H 4.000 . 6.000 4.050 3.450 4.319 . 0 0 "[ . 1 . 2 .]" 1
787 1 31 PHE QE 1 74 ILE H 4.100 . 6.000 4.752 4.179 5.114 . 0 0 "[ . 1 . 2 .]" 1
788 1 31 PHE QE 1 78 VAL QG 2.200 . 2.800 2.380 1.626 2.799 . 0 0 "[ . 1 . 2 .]" 1
789 1 31 PHE QE 1 73 LYS QG 3.100 . 4.300 2.894 1.823 3.453 0.077 1 0 "[ . 1 . 2 .]" 1
790 1 31 PHE QE 1 75 ARG HB3 3.100 . 4.300 4.099 3.672 4.414 0.114 6 0 "[ . 1 . 2 .]" 1
791 1 31 PHE QE 1 75 ARG HB3 3.200 . 4.500 4.007 3.657 4.343 . 0 0 "[ . 1 . 2 .]" 1
792 1 31 PHE QE 1 76 LYS H 4.100 . 6.000 4.189 3.309 4.892 . 0 0 "[ . 1 . 2 .]" 1
793 1 31 PHE QE 1 74 ILE MD 2.900 . 4.000 2.438 1.720 3.297 0.080 3 0 "[ . 1 . 2 .]" 1
794 1 31 PHE QE 1 74 ILE QG 3.200 . 4.500 3.328 2.691 3.704 . 0 0 "[ . 1 . 2 .]" 1
795 1 31 PHE QE 1 74 ILE MG 2.700 . 3.600 2.223 1.977 2.572 . 0 0 "[ . 1 . 2 .]" 1
796 1 32 GLN H 1 32 GLN HA 2.400 . 3.100 2.750 2.705 2.822 . 0 0 "[ . 1 . 2 .]" 1
797 1 32 GLN H 1 32 GLN HB2 2.500 . 3.300 2.652 2.206 3.479 0.179 19 0 "[ . 1 . 2 .]" 1
798 1 32 GLN H 1 32 GLN HB3 2.400 . 3.100 2.403 2.093 2.626 . 0 0 "[ . 1 . 2 .]" 1
799 1 32 GLN H 1 32 GLN QG 2.900 . 3.800 3.645 2.668 3.859 0.059 12 0 "[ . 1 . 2 .]" 1
800 1 32 GLN H 1 33 ASP H 3.100 . 4.300 2.769 2.564 2.928 . 0 0 "[ . 1 . 2 .]" 1
801 1 32 GLN H 1 33 ASP H 2.900 . 4.000 2.682 2.535 2.802 . 0 0 "[ . 1 . 2 .]" 1
802 1 32 GLN H 1 34 ASP H 3.400 . 4.800 4.154 3.841 4.489 . 0 0 "[ . 1 . 2 .]" 1
803 1 32 GLN H 1 43 THR MG 3.200 . 4.500 3.753 3.362 4.266 . 0 0 "[ . 1 . 2 .]" 1
804 1 32 GLN HA 1 32 GLN HB2 2.400 . 3.100 2.393 2.219 2.537 . 0 0 "[ . 1 . 2 .]" 1
805 1 32 GLN HA 1 32 GLN HB3 2.500 . 3.300 2.943 2.614 3.022 . 0 0 "[ . 1 . 2 .]" 1
806 1 32 GLN HA 1 32 GLN QG 2.800 . 3.800 2.590 2.279 3.250 . 0 0 "[ . 1 . 2 .]" 1
807 1 32 GLN HA 1 33 ASP H 3.300 . 4.700 3.512 3.170 3.562 . 0 0 "[ . 1 . 2 .]" 1
808 1 32 GLN HA 1 33 ASP H 3.000 . 4.100 3.082 2.943 3.216 . 0 0 "[ . 1 . 2 .]" 1
809 1 32 GLN HA 1 34 ASP H 3.600 . 5.200 3.960 3.429 4.190 . 0 0 "[ . 1 . 2 .]" 1
810 1 32 GLN HA 1 35 ILE H 3.500 . 5.000 3.428 3.169 3.767 . 0 0 "[ . 1 . 2 .]" 1
811 1 32 GLN HA 1 35 ILE HB 2.500 . 3.300 2.524 2.011 3.001 . 0 0 "[ . 1 . 2 .]" 1
812 1 32 GLN HA 1 35 ILE MD 3.000 . 4.100 2.537 1.950 3.809 . 0 0 "[ . 1 . 2 .]" 1
813 1 32 GLN HA 1 35 ILE QG 3.600 . 5.200 3.626 2.939 4.528 . 0 0 "[ . 1 . 2 .]" 1
814 1 32 GLN HA 1 35 ILE MG 3.500 . 5.000 3.898 3.396 4.318 . 0 0 "[ . 1 . 2 .]" 1
815 1 32 GLN HA 1 43 THR MG 2.600 . 3.400 2.314 1.940 2.747 . 0 0 "[ . 1 . 2 .]" 1
816 1 32 GLN HB2 1 32 GLN QG 2.100 . 2.500 2.298 2.097 2.482 . 0 0 "[ . 1 . 2 .]" 1
817 1 32 GLN HB2 1 33 ASP H 3.300 . 4.700 3.938 3.653 4.310 . 0 0 "[ . 1 . 2 .]" 1
818 1 32 GLN HB2 1 33 ASP H 3.400 . 4.800 3.859 3.609 4.221 . 0 0 "[ . 1 . 2 .]" 1
819 1 32 GLN HB2 1 35 ILE HB 3.400 . 4.800 4.679 3.693 5.080 0.280 15 0 "[ . 1 . 2 .]" 1
820 1 32 GLN HB2 1 43 THR MG 3.000 . 4.100 2.720 2.125 3.255 . 0 0 "[ . 1 . 2 .]" 1
821 1 32 GLN HB3 1 32 GLN QG 2.400 . 2.700 2.288 2.107 2.433 . 0 0 "[ . 1 . 2 .]" 1
822 1 32 GLN HB3 1 33 ASP H 3.000 . 4.100 2.827 2.328 3.815 . 0 0 "[ . 1 . 2 .]" 1
823 1 32 GLN HB3 1 34 ASP H 3.600 . 5.200 4.513 3.838 5.077 . 0 0 "[ . 1 . 2 .]" 1
824 1 32 GLN HB3 1 43 THR MG 3.200 . 4.500 3.866 2.779 4.325 . 0 0 "[ . 1 . 2 .]" 1
825 1 32 GLN HB3 1 43 THR MG 3.000 . 4.100 3.807 2.778 4.195 0.095 1 0 "[ . 1 . 2 .]" 1
826 1 32 GLN HE21 1 32 GLN QG 3.500 . 5.000 2.480 2.142 2.808 . 0 0 "[ . 1 . 2 .]" 1
827 1 32 GLN HE22 1 32 GLN QG 3.400 . 4.300 3.365 3.214 3.493 . 0 0 "[ . 1 . 2 .]" 1
828 1 32 GLN QG 1 33 ASP H 3.300 . 4.700 3.306 2.267 4.344 . 0 0 "[ . 1 . 2 .]" 1
829 1 32 GLN QG 1 33 ASP H 3.400 . 4.800 3.242 2.263 4.185 . 0 0 "[ . 1 . 2 .]" 1
830 1 32 GLN QG 1 35 ILE HB 3.200 . 4.500 4.114 3.436 4.614 0.114 25 0 "[ . 1 . 2 .]" 1
831 1 32 GLN QG 1 43 THR H 2.800 . 3.800 2.266 1.920 2.645 . 0 0 "[ . 1 . 2 .]" 1
832 1 32 GLN QG 1 43 THR MG 3.400 . 4.700 2.822 1.968 4.062 0.032 23 0 "[ . 1 . 2 .]" 1
833 1 33 ASP H 1 33 ASP HA 2.700 . 3.600 2.684 2.657 2.769 . 0 0 "[ . 1 . 2 .]" 1
834 1 33 ASP H 1 33 ASP HA 3.000 . 4.100 2.473 2.164 2.590 . 0 0 "[ . 1 . 2 .]" 1
835 1 33 ASP H 1 33 ASP HB2 2.600 . 3.400 2.680 2.289 3.598 0.198 21 0 "[ . 1 . 2 .]" 1
836 1 33 ASP H 1 33 ASP HB3 2.700 . 3.600 2.784 2.388 3.612 0.012 2 0 "[ . 1 . 2 .]" 1
837 1 33 ASP H 1 34 ASP H 2.600 . 3.400 2.615 1.975 2.780 . 0 0 "[ . 1 . 2 .]" 1
838 1 33 ASP H 1 34 ASP H 2.300 . 3.000 2.220 1.896 2.364 . 0 0 "[ . 1 . 2 .]" 1
839 1 33 ASP H 1 34 ASP QB 2.700 . 3.600 2.457 2.140 2.776 . 0 0 "[ . 1 . 2 .]" 1
840 1 33 ASP H 1 34 ASP QB 3.400 . 4.800 3.442 1.699 3.982 0.301 24 0 "[ . 1 . 2 .]" 1
841 1 33 ASP H 1 35 ILE MD 3.000 . 4.100 3.327 3.139 3.450 . 0 0 "[ . 1 . 2 .]" 1
842 1 33 ASP H 1 37 ASP H 3.500 . 5.000 3.894 3.683 4.077 . 0 0 "[ . 1 . 2 .]" 1
843 1 33 ASP H 1 35 ILE HB 3.400 . 4.800 2.759 2.380 3.284 . 0 0 "[ . 1 . 2 .]" 1
844 1 33 ASP H 1 36 LYS QB 3.600 . 5.200 3.876 3.103 4.277 . 0 0 "[ . 1 . 2 .]" 1
845 1 33 ASP H 1 43 THR MG 3.500 . 5.000 4.399 4.075 4.543 . 0 0 "[ . 1 . 2 .]" 1
846 1 33 ASP HA 1 33 ASP HB2 2.600 . 3.400 2.590 2.399 3.026 . 0 0 "[ . 1 . 2 .]" 1
847 1 33 ASP HA 1 33 ASP QB 2.100 . 2.700 2.110 2.034 2.158 . 0 0 "[ . 1 . 2 .]" 1
848 1 33 ASP HA 1 33 ASP HB3 2.500 . 3.300 2.830 2.350 3.034 . 0 0 "[ . 1 . 2 .]" 1
849 1 33 ASP HA 1 34 ASP H 2.300 . 3.000 2.748 2.713 2.772 . 0 0 "[ . 1 . 2 .]" 1
850 1 33 ASP HA 1 35 ILE H 3.300 . 4.700 3.414 3.353 3.483 . 0 0 "[ . 1 . 2 .]" 1
851 1 33 ASP HA 1 36 LYS H 3.000 . 4.100 3.348 3.029 3.588 . 0 0 "[ . 1 . 2 .]" 1
852 1 33 ASP HA 1 36 LYS QB 3.000 . 4.100 2.673 2.144 2.851 . 0 0 "[ . 1 . 2 .]" 1
853 1 33 ASP HA 1 37 ASP H 2.800 . 3.800 3.103 2.847 3.287 . 0 0 "[ . 1 . 2 .]" 1
854 1 33 ASP HA 1 37 ASP HB2 2.500 . 3.300 3.118 2.710 3.558 0.258 4 0 "[ . 1 . 2 .]" 1
855 1 33 ASP HA 1 36 LYS QB 2.500 . 3.300 2.683 2.146 2.866 . 0 0 "[ . 1 . 2 .]" 1
856 1 33 ASP QB 1 36 LYS QG 3.300 . 4.700 2.555 1.592 3.853 0.308 11 0 "[ . 1 . 2 .]" 1
857 1 33 ASP HB2 1 34 ASP H 2.300 . 3.000 2.038 1.886 2.228 . 0 0 "[ . 1 . 2 .]" 1
858 1 33 ASP HB2 1 35 ILE H 3.100 . 4.300 2.459 2.149 2.776 . 0 0 "[ . 1 . 2 .]" 1
859 1 33 ASP HB3 1 34 ASP H 2.700 . 3.600 3.193 2.614 4.228 0.628 10 2 "[ . + . - 2 .]" 1
860 1 33 ASP HB3 1 37 ASP HA 3.500 . 5.000 2.978 1.620 5.106 0.380 8 0 "[ . 1 . 2 .]" 1
861 1 34 ASP H 1 34 ASP QB 2.300 . 3.000 2.287 2.081 2.477 . 0 0 "[ . 1 . 2 .]" 1
862 1 34 ASP H 1 34 ASP QB 2.200 . 2.800 2.141 1.999 2.340 . 0 0 "[ . 1 . 2 .]" 1
863 1 34 ASP H 1 35 ILE H 2.600 . 3.400 2.420 2.060 2.635 . 0 0 "[ . 1 . 2 .]" 1
864 1 34 ASP H 1 35 ILE HA 3.100 . 4.300 4.331 4.209 4.443 0.143 19 0 "[ . 1 . 2 .]" 1
865 1 34 ASP H 1 35 ILE HB 3.300 . 4.700 4.513 3.919 4.768 0.068 1 0 "[ . 1 . 2 .]" 1
866 1 34 ASP H 1 35 ILE QG 3.000 . 4.100 4.001 3.660 4.143 0.043 17 0 "[ . 1 . 2 .]" 1
867 1 34 ASP H 1 35 ILE QG 3.600 . 5.200 3.903 3.475 4.047 . 0 0 "[ . 1 . 2 .]" 1
868 1 34 ASP H 1 36 LYS QB 3.700 . 5.400 4.520 4.094 4.764 . 0 0 "[ . 1 . 2 .]" 1
869 1 34 ASP H 1 43 THR MG 3.800 . 5.600 5.586 4.914 5.901 0.301 18 0 "[ . 1 . 2 .]" 1
870 1 34 ASP HA 1 34 ASP QB 2.500 . 2.700 2.429 2.340 2.540 . 0 0 "[ . 1 . 2 .]" 1
871 1 34 ASP HA 1 34 ASP QB 2.100 . 2.700 2.130 1.836 2.352 . 0 0 "[ . 1 . 2 .]" 1
872 1 34 ASP HA 1 37 ASP H 2.500 . 3.300 3.106 2.778 3.347 0.047 15 0 "[ . 1 . 2 .]" 1
873 1 34 ASP HA 1 37 ASP HB2 2.400 . 3.100 3.178 2.730 3.732 0.632 4 2 "[ +. 1 . 2 - .]" 1
874 1 34 ASP HA 1 38 LYS H 3.500 . 5.000 3.850 3.444 4.438 . 0 0 "[ . 1 . 2 .]" 1
875 1 34 ASP QB 1 35 ILE H 2.900 . 4.000 2.469 2.151 2.800 . 0 0 "[ . 1 . 2 .]" 1
876 1 34 ASP QB 1 35 ILE HA 2.900 . 4.000 2.838 2.168 3.442 . 0 0 "[ . 1 . 2 .]" 1
877 1 34 ASP QB 1 35 ILE MD 3.400 . 4.800 3.550 3.207 3.996 . 0 0 "[ . 1 . 2 .]" 1
878 1 34 ASP QB 1 35 ILE MG 2.900 . 4.000 2.934 2.688 3.107 . 0 0 "[ . 1 . 2 .]" 1
879 1 34 ASP QB 1 36 LYS QG 2.800 . 3.800 2.208 1.751 2.711 0.049 7 0 "[ . 1 . 2 .]" 1
880 1 34 ASP QB 1 83 MET ME 2.600 . 3.400 2.708 1.867 3.293 . 0 0 "[ . 1 . 2 .]" 1
881 1 34 ASP QB 1 83 MET ME 2.800 . 3.800 2.722 1.869 3.245 . 0 0 "[ . 1 . 2 .]" 1
882 1 34 ASP QB 1 44 LYS HB3 2.600 . 3.400 2.296 1.737 2.694 0.063 10 0 "[ . 1 . 2 .]" 1
883 1 34 ASP HB2 1 34 ASP HB3 1.600 . 2.200 1.566 1.564 1.569 . 0 0 "[ . 1 . 2 .]" 1
884 1 34 ASP QB 1 56 ARG HD2 2.400 . 3.100 2.535 1.720 3.324 0.224 7 0 "[ . 1 . 2 .]" 1
885 1 34 ASP QB 1 71 LYS HB2 2.400 . 3.100 2.091 1.667 2.778 0.033 25 0 "[ . 1 . 2 .]" 1
886 1 35 ILE H 1 35 ILE HA 2.800 . 3.800 2.817 2.779 2.845 . 0 0 "[ . 1 . 2 .]" 1
887 1 35 ILE H 1 35 ILE HB 2.400 . 3.100 2.486 2.353 2.675 . 0 0 "[ . 1 . 2 .]" 1
888 1 35 ILE H 1 35 ILE QG 2.800 . 3.800 2.082 1.817 2.323 . 0 0 "[ . 1 . 2 .]" 1
889 1 35 ILE H 1 35 ILE MG 2.900 . 4.000 3.743 3.708 3.768 . 0 0 "[ . 1 . 2 .]" 1
890 1 35 ILE H 1 36 LYS H 2.700 . 3.600 2.598 2.527 2.734 . 0 0 "[ . 1 . 2 .]" 1
891 1 35 ILE H 1 36 LYS QB 3.700 . 5.400 4.274 4.113 4.441 . 0 0 "[ . 1 . 2 .]" 1
892 1 35 ILE H 1 37 ASP H 3.700 . 5.400 3.759 3.593 3.916 . 0 0 "[ . 1 . 2 .]" 1
893 1 35 ILE H 1 83 MET ME 3.200 . 4.500 3.562 3.037 4.414 . 0 0 "[ . 1 . 2 .]" 1
894 1 35 ILE HA 1 35 ILE MD 3.300 . 4.700 3.862 3.826 3.920 . 0 0 "[ . 1 . 2 .]" 1
895 1 35 ILE HA 1 35 ILE QG 2.700 . 3.600 2.414 2.353 2.538 . 0 0 "[ . 1 . 2 .]" 1
896 1 35 ILE HA 1 35 ILE MG 2.700 . 3.600 2.436 2.323 2.510 . 0 0 "[ . 1 . 2 .]" 1
897 1 35 ILE HA 1 36 LYS H 3.400 . 4.800 3.484 3.419 3.520 . 0 0 "[ . 1 . 2 .]" 1
898 1 35 ILE HA 1 38 LYS HB2 3.200 . 4.500 2.989 2.324 3.556 . 0 0 "[ . 1 . 2 .]" 1
899 1 35 ILE HA 1 39 TYR H 3.200 . 4.500 3.609 3.338 3.939 . 0 0 "[ . 1 . 2 .]" 1
900 1 35 ILE HA 1 39 TYR QD 2.700 . 3.600 2.464 1.781 3.135 0.019 19 0 "[ . 1 . 2 .]" 1
901 1 35 ILE HA 1 39 TYR QE 3.200 . 4.500 3.220 2.494 3.846 . 0 0 "[ . 1 . 2 .]" 1
902 1 35 ILE HA 1 83 MET ME 3.200 . 4.500 2.879 1.757 3.885 0.143 10 0 "[ . 1 . 2 .]" 1
903 1 35 ILE HB 1 35 ILE MD 2.700 . 3.600 2.368 2.302 2.441 . 0 0 "[ . 1 . 2 .]" 1
904 1 35 ILE HB 1 35 ILE MD 2.400 . 3.100 2.284 2.193 2.357 . 0 0 "[ . 1 . 2 .]" 1
905 1 35 ILE HB 1 35 ILE MG 2.100 . 2.700 1.700 1.637 1.836 . 0 0 "[ . 1 . 2 .]" 1
906 1 35 ILE HB 1 36 LYS H 2.800 . 3.800 2.811 2.585 3.122 . 0 0 "[ . 1 . 2 .]" 1
907 1 35 ILE HB 1 40 GLY H 3.700 . 5.400 4.329 3.856 4.674 . 0 0 "[ . 1 . 2 .]" 1
908 1 35 ILE HB 1 42 ASP H 2.800 . 3.800 3.731 3.651 3.818 0.018 19 0 "[ . 1 . 2 .]" 1
909 1 35 ILE HB 1 43 THR MG 2.600 . 3.400 2.835 2.369 3.189 . 0 0 "[ . 1 . 2 .]" 1
910 1 35 ILE HB 1 43 THR MG 3.000 . 4.100 2.976 2.620 3.426 . 0 0 "[ . 1 . 2 .]" 1
911 1 35 ILE MD 1 35 ILE MG 2.300 . 3.000 2.072 1.950 2.233 . 0 0 "[ . 1 . 2 .]" 1
912 1 35 ILE MD 1 39 TYR QE 3.500 . 5.000 4.696 4.041 5.096 0.096 12 0 "[ . 1 . 2 .]" 1
913 1 35 ILE MD 1 41 VAL H 3.400 . 4.800 4.329 4.248 4.438 . 0 0 "[ . 1 . 2 .]" 1
914 1 35 ILE MD 1 72 PHE QE 3.400 . 4.800 2.531 1.963 3.117 0.037 3 0 "[ . 1 . 2 .]" 1
915 1 35 ILE QG 1 35 ILE MG 2.600 . 3.400 2.242 2.181 2.326 . 0 0 "[ . 1 . 2 .]" 1
916 1 35 ILE QG 1 39 TYR QE 3.300 . 4.700 3.545 2.493 3.961 . 0 0 "[ . 1 . 2 .]" 1
917 1 35 ILE QG 1 86 ARG QD 3.000 . 4.100 2.132 2.008 2.333 . 0 0 "[ . 1 . 2 .]" 1
918 1 35 ILE QG 1 83 MET HG2 3.000 . 4.100 3.113 1.950 4.047 . 0 0 "[ . 1 . 2 .]" 1
919 1 35 ILE QG 1 83 MET HG3 3.000 . 4.100 3.143 1.837 3.866 0.063 11 0 "[ . 1 . 2 .]" 1
920 1 35 ILE QG 1 72 PHE QD 3.200 . 4.500 2.084 1.872 2.276 0.028 18 0 "[ . 1 . 2 .]" 1
921 1 35 ILE QG 1 72 PHE QE 3.100 . 4.300 2.508 1.967 2.936 . 0 0 "[ . 1 . 2 .]" 1
922 1 35 ILE QG 1 73 LYS H 3.600 . 5.200 3.144 2.205 3.602 . 0 0 "[ . 1 . 2 .]" 1
923 1 35 ILE QG 1 83 MET H 3.400 . 4.800 3.656 2.960 4.166 . 0 0 "[ . 1 . 2 .]" 1
924 1 35 ILE QG 1 83 MET ME 2.500 . 3.300 1.951 1.348 2.686 0.352 7 0 "[ . 1 . 2 .]" 1
925 1 35 ILE QG 1 83 MET ME 2.800 . 3.800 1.983 1.349 2.967 0.451 7 0 "[ . 1 . 2 .]" 1
926 1 35 ILE MG 1 36 LYS H 3.100 . 4.300 3.566 3.294 3.787 . 0 0 "[ . 1 . 2 .]" 1
927 1 35 ILE MG 1 36 LYS H 3.000 . 4.100 3.293 3.096 3.508 . 0 0 "[ . 1 . 2 .]" 1
928 1 35 ILE MG 1 36 LYS HA 3.300 . 4.700 3.516 3.161 3.808 . 0 0 "[ . 1 . 2 .]" 1
929 1 35 ILE MG 1 37 ASP H 3.800 . 5.600 4.826 4.613 5.169 . 0 0 "[ . 1 . 2 .]" 1
930 1 35 ILE MG 1 38 LYS H 3.000 . 4.100 3.665 2.830 3.979 . 0 0 "[ . 1 . 2 .]" 1
931 1 35 ILE MG 1 38 LYS HB2 2.400 . 3.100 2.743 2.177 3.111 0.011 12 0 "[ . 1 . 2 .]" 1
932 1 35 ILE MG 1 39 TYR H 3.300 . 4.700 3.779 3.567 4.081 . 0 0 "[ . 1 . 2 .]" 1
933 1 35 ILE MG 1 39 TYR QE 3.500 . 5.000 3.360 2.831 4.031 . 0 0 "[ . 1 . 2 .]" 1
934 1 35 ILE MG 1 40 GLY H 4.000 . 6.000 3.915 3.317 4.398 . 0 0 "[ . 1 . 2 .]" 1
935 1 35 ILE MG 1 83 MET ME 2.900 . 4.000 3.447 2.410 4.161 0.161 16 0 "[ . 1 . 2 .]" 1
936 1 35 ILE MG 1 39 TYR H 3.400 . 4.800 3.884 3.652 4.240 . 0 0 "[ . 1 . 2 .]" 1
937 1 35 ILE MG 1 39 TYR HB2 3.200 . 4.500 2.953 2.699 3.129 . 0 0 "[ . 1 . 2 .]" 1
938 1 35 ILE MG 1 39 TYR HB3 3.100 . 4.300 4.276 4.019 4.440 0.140 17 0 "[ . 1 . 2 .]" 1
939 1 35 ILE MG 1 39 TYR QD 2.600 . 3.400 2.194 1.803 2.638 . 0 0 "[ . 1 . 2 .]" 1
940 1 35 ILE MG 1 39 TYR QE 2.500 . 3.300 2.768 2.471 3.028 . 0 0 "[ . 1 . 2 .]" 1
941 1 35 ILE MG 1 41 VAL H 3.000 . 4.100 2.976 2.529 3.266 . 0 0 "[ . 1 . 2 .]" 1
942 1 35 ILE MG 1 41 VAL HB 2.600 . 3.400 1.790 1.701 2.005 0.099 19 0 "[ . 1 . 2 .]" 1
943 1 35 ILE MG 1 41 VAL MG1 2.400 . 3.100 2.856 2.652 3.105 0.005 16 0 "[ . 1 . 2 .]" 1
944 1 35 ILE MG 1 41 VAL QG 2.200 . 2.800 2.220 1.942 2.492 . 0 0 "[ . 1 . 2 .]" 1
945 1 35 ILE MG 1 41 VAL MG2 2.300 . 3.000 2.324 1.986 2.756 . 0 0 "[ . 1 . 2 .]" 1
946 1 35 ILE MG 1 43 THR H 3.000 . 4.100 3.078 2.672 3.347 . 0 0 "[ . 1 . 2 .]" 1
947 1 35 ILE MG 1 43 THR MG 2.400 . 3.100 2.785 2.180 3.170 0.070 12 0 "[ . 1 . 2 .]" 1
948 1 35 ILE MG 1 72 PHE QD 3.600 . 5.200 3.889 3.037 4.338 . 0 0 "[ . 1 . 2 .]" 1
949 1 36 LYS H 1 36 LYS HA 2.700 . 3.600 2.886 2.870 2.909 . 0 0 "[ . 1 . 2 .]" 1
950 1 36 LYS H 1 36 LYS HA 2.400 . 3.100 2.120 1.760 2.452 . 0 0 "[ . 1 . 2 .]" 1
951 1 36 LYS H 1 36 LYS QB 2.400 . 3.100 2.238 2.177 2.297 . 0 0 "[ . 1 . 2 .]" 1
952 1 36 LYS H 1 36 LYS QG 3.100 . 4.300 3.458 3.300 3.593 . 0 0 "[ . 1 . 2 .]" 1
953 1 36 LYS H 1 37 ASP H 2.600 . 3.400 2.298 2.206 2.371 . 0 0 "[ . 1 . 2 .]" 1
954 1 36 LYS H 1 37 ASP HA 3.400 . 4.800 4.965 4.898 5.011 0.211 21 0 "[ . 1 . 2 .]" 1
955 1 36 LYS H 1 38 LYS H 3.100 . 4.300 3.434 3.245 3.568 . 0 0 "[ . 1 . 2 .]" 1
956 1 36 LYS H 1 38 LYS HA 3.400 . 4.800 4.865 4.497 5.251 0.451 17 0 "[ . 1 . 2 .]" 1
957 1 36 LYS H 1 41 VAL H 2.500 . 3.300 2.462 1.965 2.724 . 0 0 "[ . 1 . 2 .]" 1
958 1 36 LYS HA 1 36 LYS QB 2.500 . 3.000 2.381 2.311 2.425 . 0 0 "[ . 1 . 2 .]" 1
959 1 36 LYS HA 1 36 LYS QD 2.700 . 3.600 3.232 1.736 3.695 0.095 3 0 "[ . 1 . 2 .]" 1
960 1 36 LYS HA 1 36 LYS QG 2.600 . 3.400 2.348 2.258 2.473 . 0 0 "[ . 1 . 2 .]" 1
961 1 36 LYS HA 1 36 LYS QG 2.600 . 3.400 2.157 1.443 2.430 0.357 22 0 "[ . 1 . 2 .]" 1
962 1 36 LYS HA 1 37 ASP H 3.200 . 4.500 3.478 3.405 3.523 . 0 0 "[ . 1 . 2 .]" 1
963 1 36 LYS HA 1 37 ASP H 3.100 . 4.300 3.353 3.255 3.401 . 0 0 "[ . 1 . 2 .]" 1
964 1 36 LYS HA 1 39 TYR HB2 2.300 . 3.000 2.373 2.142 2.961 . 0 0 "[ . 1 . 2 .]" 1
965 1 36 LYS HA 1 40 GLY H 2.600 . 3.400 2.198 1.775 2.655 0.025 13 0 "[ . 1 . 2 .]" 1
966 1 36 LYS HA 1 41 VAL H 2.300 . 3.000 1.651 1.515 1.984 0.085 14 0 "[ . 1 . 2 .]" 1
967 1 36 LYS HA 1 41 VAL HB 3.400 . 4.800 3.838 3.455 4.114 . 0 0 "[ . 1 . 2 .]" 1
968 1 36 LYS HA 1 41 VAL QG 3.200 . 4.500 2.837 1.335 3.452 0.565 9 1 "[ . +1 . 2 .]" 1
969 1 36 LYS QB 1 36 LYS QD 2.700 . 3.600 2.141 2.013 2.338 . 0 0 "[ . 1 . 2 .]" 1
970 1 36 LYS QB 1 37 ASP H 2.500 . 3.300 2.676 2.469 2.884 . 0 0 "[ . 1 . 2 .]" 1
971 1 36 LYS QB 1 41 VAL HB 3.000 . 4.100 4.340 4.172 4.490 0.390 25 0 "[ . 1 . 2 .]" 1
972 1 36 LYS QB 1 43 THR H 3.400 . 4.800 2.478 2.195 2.800 . 0 0 "[ . 1 . 2 .]" 1
973 1 36 LYS QB 1 46 LEU QD 3.100 . 4.300 2.950 2.532 3.174 . 0 0 "[ . 1 . 2 .]" 1
974 1 36 LYS QB 1 83 MET ME 2.800 . 3.800 3.342 2.070 3.890 0.090 15 0 "[ . 1 . 2 .]" 1
975 1 36 LYS QD 1 36 LYS QE 1.900 . 2.400 1.785 1.739 1.846 . 0 0 "[ . 1 . 2 .]" 1
976 1 36 LYS QD 1 43 THR H 3.400 . 4.800 3.786 3.302 4.057 . 0 0 "[ . 1 . 2 .]" 1
977 1 36 LYS QE 1 36 LYS QG 2.300 . 3.000 1.986 1.870 2.148 . 0 0 "[ . 1 . 2 .]" 1
978 1 36 LYS QE 1 38 LYS HB3 2.500 . 3.300 2.725 1.835 3.351 0.051 15 0 "[ . 1 . 2 .]" 1
979 1 36 LYS QE 1 41 VAL H 3.300 . 4.700 3.391 2.718 3.817 . 0 0 "[ . 1 . 2 .]" 1
980 1 36 LYS QE 1 41 VAL MG1 2.900 . 4.000 3.305 2.256 3.478 . 0 0 "[ . 1 . 2 .]" 1
981 1 36 LYS QE 1 43 THR H 3.200 . 4.500 3.523 2.964 3.714 . 0 0 "[ . 1 . 2 .]" 1
982 1 36 LYS QE 1 44 LYS H 3.100 . 4.300 3.478 2.889 3.670 . 0 0 "[ . 1 . 2 .]" 1
983 1 36 LYS QG 1 37 ASP H 3.500 . 5.000 3.961 3.452 4.164 . 0 0 "[ . 1 . 2 .]" 1
984 1 36 LYS QG 1 37 ASP H 3.000 . 4.100 3.858 3.398 4.062 . 0 0 "[ . 1 . 2 .]" 1
985 1 36 LYS QG 1 37 ASP H 3.700 . 5.400 3.859 3.341 4.089 . 0 0 "[ . 1 . 2 .]" 1
986 1 36 LYS QG 1 40 GLY H 3.800 . 5.600 3.816 3.524 4.115 . 0 0 "[ . 1 . 2 .]" 1
987 1 36 LYS QG 1 44 LYS H 2.700 . 3.600 2.972 1.821 3.951 0.351 2 0 "[ . 1 . 2 .]" 1
988 1 36 LYS QG 1 45 ASP H 3.200 . 4.500 4.459 2.615 5.064 0.564 9 3 "[ . +1 . 2 -* .]" 1
989 1 37 ASP H 1 37 ASP HA 2.400 . 3.100 2.810 2.758 2.856 . 0 0 "[ . 1 . 2 .]" 1
990 1 37 ASP H 1 37 ASP HA 2.200 . 2.800 2.705 2.665 2.742 . 0 0 "[ . 1 . 2 .]" 1
991 1 37 ASP H 1 37 ASP HB2 2.300 . 3.000 2.583 2.477 2.681 . 0 0 "[ . 1 . 2 .]" 1
992 1 37 ASP H 1 37 ASP HB2 2.000 . 2.500 2.542 2.440 2.635 0.135 22 0 "[ . 1 . 2 .]" 1
993 1 37 ASP H 1 37 ASP HB3 2.400 . 3.100 2.475 2.323 2.605 . 0 0 "[ . 1 . 2 .]" 1
994 1 37 ASP H 1 37 ASP HB3 1.900 . 2.400 2.182 2.078 2.253 . 0 0 "[ . 1 . 2 .]" 1
995 1 37 ASP H 1 38 LYS QD 3.100 . 4.300 3.525 2.675 4.050 . 0 0 "[ . 1 . 2 .]" 1
996 1 37 ASP H 1 38 LYS HG2 3.000 . 4.100 3.772 2.832 4.161 0.061 14 0 "[ . 1 . 2 .]" 1
997 1 37 ASP H 1 39 TYR H 2.400 . 3.100 2.553 2.151 2.828 . 0 0 "[ . 1 . 2 .]" 1
998 1 37 ASP H 1 40 GLY H 3.400 . 4.800 3.551 3.304 3.886 . 0 0 "[ . 1 . 2 .]" 1
999 1 37 ASP H 1 38 LYS HA 3.600 . 5.200 5.032 4.918 5.156 . 0 0 "[ . 1 . 2 .]" 1
1000 1 37 ASP H 1 38 LYS HB2 3.900 . 5.800 4.760 4.481 5.142 . 0 0 "[ . 1 . 2 .]" 1
1001 1 37 ASP HA 1 37 ASP HB2 2.200 . 2.800 2.434 2.353 2.506 . 0 0 "[ . 1 . 2 .]" 1
1002 1 37 ASP HA 1 37 ASP HB3 2.200 . 2.800 3.008 2.996 3.014 0.214 17 0 "[ . 1 . 2 .]" 1
1003 1 37 ASP HA 1 38 LYS H 3.200 . 4.500 3.527 3.494 3.547 . 0 0 "[ . 1 . 2 .]" 1
1004 1 37 ASP HB2 1 37 ASP HB3 1.600 . 2.200 1.567 1.566 1.569 . 0 0 "[ . 1 . 2 .]" 1
1005 1 37 ASP HB2 1 38 LYS H 2.900 . 4.000 3.797 3.650 4.047 0.047 11 0 "[ . 1 . 2 .]" 1
1006 1 37 ASP HB3 1 38 LYS H 2.700 . 3.600 2.444 2.261 2.796 . 0 0 "[ . 1 . 2 .]" 1
1007 1 38 LYS H 1 38 LYS HA 2.500 . 3.300 2.853 2.803 2.921 . 0 0 "[ . 1 . 2 .]" 1
1008 1 38 LYS H 1 38 LYS HB2 2.500 . 3.300 2.350 2.228 2.675 . 0 0 "[ . 1 . 2 .]" 1
1009 1 38 LYS H 1 38 LYS HB3 2.700 . 3.600 3.566 3.519 3.630 0.030 11 0 "[ . 1 . 2 .]" 1
1010 1 38 LYS H 1 38 LYS QD 3.300 . 4.700 3.573 2.696 4.114 . 0 0 "[ . 1 . 2 .]" 1
1011 1 38 LYS H 1 38 LYS HG3 2.700 . 3.600 2.615 2.013 2.990 . 0 0 "[ . 1 . 2 .]" 1
1012 1 38 LYS H 1 39 TYR H 2.600 . 3.400 2.578 2.159 2.866 . 0 0 "[ . 1 . 2 .]" 1
1013 1 38 LYS HA 1 38 LYS HB2 2.500 . 3.300 2.991 2.972 3.007 . 0 0 "[ . 1 . 2 .]" 1
1014 1 38 LYS HA 1 38 LYS HB3 2.400 . 3.100 2.527 2.368 2.611 . 0 0 "[ . 1 . 2 .]" 1
1015 1 38 LYS HA 1 38 LYS QD 2.900 . 4.000 3.933 3.706 4.125 0.125 23 0 "[ . 1 . 2 .]" 1
1016 1 38 LYS HA 1 38 LYS HG2 2.500 . 3.300 2.614 2.313 3.138 . 0 0 "[ . 1 . 2 .]" 1
1017 1 38 LYS HA 1 38 LYS HG3 2.700 . 3.600 2.773 2.359 3.394 . 0 0 "[ . 1 . 2 .]" 1
1018 1 38 LYS HA 1 39 TYR H 3.000 . 4.100 3.438 3.291 3.481 . 0 0 "[ . 1 . 2 .]" 1
1019 1 38 LYS HB2 1 38 LYS QD 2.600 . 3.400 2.285 2.154 2.512 . 0 0 "[ . 1 . 2 .]" 1
1020 1 38 LYS HB2 1 38 LYS HG2 2.200 . 2.800 2.973 2.858 3.006 0.206 2 0 "[ . 1 . 2 .]" 1
1021 1 38 LYS HB2 1 38 LYS HG3 2.400 . 3.100 2.517 2.297 2.806 . 0 0 "[ . 1 . 2 .]" 1
1022 1 38 LYS HB2 1 39 TYR H 3.000 . 4.100 2.705 2.347 3.269 . 0 0 "[ . 1 . 2 .]" 1
1023 1 38 LYS HB2 1 40 GLY H 3.900 . 5.800 4.530 4.187 4.834 . 0 0 "[ . 1 . 2 .]" 1
1024 1 38 LYS HB2 1 41 VAL MG2 2.800 . 3.800 3.170 1.535 3.753 0.265 16 0 "[ . 1 . 2 .]" 1
1025 1 38 LYS HB2 1 83 MET ME 3.100 . 4.300 4.003 2.725 4.563 0.263 25 0 "[ . 1 . 2 .]" 1
1026 1 38 LYS HB3 1 38 LYS QD 2.600 . 3.400 2.573 2.226 3.285 . 0 0 "[ . 1 . 2 .]" 1
1027 1 38 LYS HB3 1 38 LYS HG2 2.200 . 2.800 2.370 2.218 2.581 . 0 0 "[ . 1 . 2 .]" 1
1028 1 38 LYS HB3 1 38 LYS HG3 2.500 . 3.300 2.980 2.867 3.005 . 0 0 "[ . 1 . 2 .]" 1
1029 1 38 LYS HB3 1 39 TYR H 3.000 . 4.100 3.522 2.969 4.104 0.004 16 0 "[ . 1 . 2 .]" 1
1030 1 38 LYS HB3 1 83 MET ME 3.600 . 5.200 4.878 3.432 5.383 0.183 25 0 "[ . 1 . 2 .]" 1
1031 1 38 LYS QD 1 38 LYS QE 2.200 . 2.800 2.006 1.987 2.086 . 0 0 "[ . 1 . 2 .]" 1
1032 1 38 LYS QD 1 38 LYS HG2 2.300 . 3.000 2.331 2.231 2.385 . 0 0 "[ . 1 . 2 .]" 1
1033 1 38 LYS QD 1 38 LYS HG3 1.800 . 2.200 2.286 2.143 2.402 0.202 1 0 "[ . 1 . 2 .]" 1
1034 1 38 LYS QD 1 39 TYR QE 3.400 . 4.800 3.278 2.540 3.965 . 0 0 "[ . 1 . 2 .]" 1
1035 1 38 LYS QE 1 38 LYS HG2 2.900 . 4.000 2.740 2.389 3.086 . 0 0 "[ . 1 . 2 .]" 1
1036 1 38 LYS QE 1 38 LYS HG3 2.800 . 3.800 2.786 2.362 3.500 . 0 0 "[ . 1 . 2 .]" 1
1037 1 38 LYS QE 1 38 LYS HG3 2.200 . 2.800 2.548 2.150 3.338 0.538 23 1 "[ . 1 . 2 + .]" 1
1038 1 38 LYS QE 1 83 MET ME 2.800 . 3.800 3.110 1.949 3.791 . 0 0 "[ . 1 . 2 .]" 1
1039 1 38 LYS HG2 1 83 MET H 3.700 . 5.400 4.723 3.037 5.384 . 0 0 "[ . 1 . 2 .]" 1
1040 1 39 TYR H 1 39 TYR HA 2.800 . 3.800 2.945 2.929 2.954 . 0 0 "[ . 1 . 2 .]" 1
1041 1 39 TYR H 1 39 TYR HB2 2.700 . 3.600 2.707 2.566 2.853 . 0 0 "[ . 1 . 2 .]" 1
1042 1 39 TYR H 1 39 TYR HB3 3.000 . 4.100 3.767 3.677 3.898 . 0 0 "[ . 1 . 2 .]" 1
1043 1 39 TYR H 1 39 TYR QD 3.400 . 4.800 2.952 2.481 3.387 . 0 0 "[ . 1 . 2 .]" 1
1044 1 39 TYR H 1 39 TYR QE 3.200 . 4.500 3.737 3.410 4.069 . 0 0 "[ . 1 . 2 .]" 1
1045 1 39 TYR H 1 40 GLY H 2.200 . 2.800 2.005 1.815 2.128 . 0 0 "[ . 1 . 2 .]" 1
1046 1 39 TYR H 1 40 GLY HA3 3.100 . 4.300 4.251 3.960 4.421 0.121 6 0 "[ . 1 . 2 .]" 1
1047 1 39 TYR H 1 41 VAL H 3.200 . 4.500 3.972 3.482 4.371 . 0 0 "[ . 1 . 2 .]" 1
1048 1 39 TYR HA 1 39 TYR HB2 2.700 . 3.600 3.019 2.996 3.030 . 0 0 "[ . 1 . 2 .]" 1
1049 1 39 TYR HA 1 39 TYR HB3 2.500 . 3.300 2.405 2.326 2.474 . 0 0 "[ . 1 . 2 .]" 1
1050 1 39 TYR HA 1 39 TYR QD 2.400 . 3.100 2.712 2.286 3.017 . 0 0 "[ . 1 . 2 .]" 1
1051 1 39 TYR HA 1 40 GLY H 3.000 . 4.100 3.465 3.331 3.540 . 0 0 "[ . 1 . 2 .]" 1
1052 1 39 TYR HB2 1 39 TYR QD 2.700 . 3.600 2.313 2.244 2.407 . 0 0 "[ . 1 . 2 .]" 1
1053 1 39 TYR HB2 1 40 GLY H 3.200 . 4.500 2.888 2.201 3.437 . 0 0 "[ . 1 . 2 .]" 1
1054 1 39 TYR HB2 1 41 VAL MG2 2.600 . 3.400 1.824 1.683 2.057 0.117 22 0 "[ . 1 . 2 .]" 1
1055 1 39 TYR HB3 1 39 TYR QD 2.700 . 3.600 2.516 2.361 2.680 . 0 0 "[ . 1 . 2 .]" 1
1056 1 39 TYR HB3 1 39 TYR QE 3.100 . 4.300 4.083 3.735 4.244 . 0 0 "[ . 1 . 2 .]" 1
1057 1 39 TYR HB3 1 40 GLY H 3.500 . 5.000 3.976 3.398 4.349 . 0 0 "[ . 1 . 2 .]" 1
1058 1 39 TYR HB3 1 41 VAL H 3.600 . 5.200 4.810 4.022 5.271 0.071 2 0 "[ . 1 . 2 .]" 1
1059 1 39 TYR HB3 1 41 VAL MG2 2.600 . 3.400 2.679 2.256 2.899 . 0 0 "[ . 1 . 2 .]" 1
1060 1 39 TYR QD 1 41 VAL MG1 3.300 . 4.700 3.961 2.846 4.269 . 0 0 "[ . 1 . 2 .]" 1
1061 1 39 TYR QD 1 41 VAL MG2 3.200 . 4.500 3.178 2.616 3.665 . 0 0 "[ . 1 . 2 .]" 1
1062 1 39 TYR QD 1 73 LYS H 4.300 . 6.000 4.172 3.420 4.508 . 0 0 "[ . 1 . 2 .]" 1
1063 1 39 TYR QD 1 86 ARG QB 2.900 . 4.000 2.921 2.183 3.459 . 0 0 "[ . 1 . 2 .]" 1
1064 1 39 TYR QD 1 86 ARG QD 3.500 . 5.000 3.260 1.962 4.353 0.038 10 0 "[ . 1 . 2 .]" 1
1065 1 39 TYR QE 1 86 ARG QD 3.600 . 5.200 2.729 1.784 3.566 0.216 13 0 "[ . 1 . 2 .]" 1
1066 1 39 TYR QE 1 74 ILE MG 3.600 . 5.200 4.520 3.809 5.420 0.220 19 0 "[ . 1 . 2 .]" 1
1067 1 39 TYR QE 1 83 MET ME 2.900 . 4.000 2.825 1.905 4.319 0.319 17 0 "[ . 1 . 2 .]" 1
1068 1 39 TYR QE 1 86 ARG QB 3.300 . 4.700 3.262 2.389 4.254 . 0 0 "[ . 1 . 2 .]" 1
1069 1 40 GLY H 1 40 GLY HA3 2.200 . 2.800 2.354 2.299 2.499 . 0 0 "[ . 1 . 2 .]" 1
1070 1 40 GLY H 1 41 VAL H 2.500 . 3.300 2.490 1.971 2.792 . 0 0 "[ . 1 . 2 .]" 1
1071 1 40 GLY H 1 41 VAL QG 3.400 . 4.800 3.133 2.571 3.647 . 0 0 "[ . 1 . 2 .]" 1
1072 1 40 GLY H 1 41 VAL MG2 2.900 . 4.000 1.938 1.791 2.396 0.009 13 0 "[ . 1 . 2 .]" 1
1073 1 40 GLY HA3 1 41 VAL H 2.700 . 3.600 2.695 2.493 3.020 . 0 0 "[ . 1 . 2 .]" 1
1074 1 41 VAL H 1 41 VAL HA 2.600 . 3.400 2.934 2.878 2.945 . 0 0 "[ . 1 . 2 .]" 1
1075 1 41 VAL H 1 41 VAL HB 2.400 . 3.100 2.642 2.511 2.757 . 0 0 "[ . 1 . 2 .]" 1
1076 1 41 VAL H 1 41 VAL MG1 2.700 . 3.600 3.838 3.755 3.898 0.298 14 0 "[ . 1 . 2 .]" 1
1077 1 41 VAL H 1 41 VAL QG 2.300 . 3.000 2.365 2.025 2.610 . 0 0 "[ . 1 . 2 .]" 1
1078 1 41 VAL H 1 41 VAL MG2 2.300 . 3.000 2.389 2.033 2.651 . 0 0 "[ . 1 . 2 .]" 1
1079 1 41 VAL H 1 42 ASP H 3.600 . 5.200 4.469 4.383 4.580 . 0 0 "[ . 1 . 2 .]" 1
1080 1 41 VAL HA 1 41 VAL HB 2.500 . 3.300 3.007 2.992 3.018 . 0 0 "[ . 1 . 2 .]" 1
1081 1 41 VAL HA 1 41 VAL MG1 2.800 . 3.800 2.334 2.272 2.390 . 0 0 "[ . 1 . 2 .]" 1
1082 1 41 VAL HA 1 41 VAL QG 2.400 . 3.100 2.140 2.121 2.155 . 0 0 "[ . 1 . 2 .]" 1
1083 1 41 VAL HA 1 41 VAL MG2 2.600 . 3.400 2.491 2.433 2.577 . 0 0 "[ . 1 . 2 .]" 1
1084 1 41 VAL HA 1 42 ASP H 2.000 . 2.500 2.242 2.152 2.282 . 0 0 "[ . 1 . 2 .]" 1
1085 1 41 VAL HA 1 42 ASP QB 3.300 . 4.700 4.054 3.906 4.150 . 0 0 "[ . 1 . 2 .]" 1
1086 1 41 VAL HA 1 43 THR HA 3.600 . 5.200 4.669 4.374 4.984 . 0 0 "[ . 1 . 2 .]" 1
1087 1 41 VAL HA 1 45 ASP H 3.700 . 5.400 4.778 4.544 5.158 . 0 0 "[ . 1 . 2 .]" 1
1088 1 41 VAL HA 1 46 LEU QD 3.500 . 5.000 2.010 1.792 2.173 0.208 20 0 "[ . 1 . 2 .]" 1
1089 1 41 VAL HA 1 64 ALA MB 3.500 . 5.000 4.208 3.796 4.421 . 0 0 "[ . 1 . 2 .]" 1
1090 1 41 VAL HB 1 41 VAL QG 2.100 . 2.700 1.896 1.892 1.899 . 0 0 "[ . 1 . 2 .]" 1
1091 1 41 VAL HB 1 41 VAL MG1 2.200 . 2.800 2.047 1.613 2.113 . 0 0 "[ . 1 . 2 .]" 1
1092 1 41 VAL HB 1 41 VAL MG2 2.200 . 2.800 2.132 2.129 2.135 . 0 0 "[ . 1 . 2 .]" 1
1093 1 41 VAL HB 1 42 ASP H 2.700 . 3.600 3.765 3.683 3.865 0.265 6 0 "[ . 1 . 2 .]" 1
1094 1 41 VAL HB 1 46 LEU QD 3.100 . 4.300 3.527 2.987 4.019 . 0 0 "[ . 1 . 2 .]" 1
1095 1 41 VAL QG 1 42 ASP H 2.500 . 3.300 2.190 2.054 2.408 . 0 0 "[ . 1 . 2 .]" 1
1096 1 41 VAL QG 1 43 THR HA 3.100 . 4.300 3.164 2.498 3.655 . 0 0 "[ . 1 . 2 .]" 1
1097 1 41 VAL QG 1 45 ASP H 3.700 . 5.400 4.638 3.007 5.238 . 0 0 "[ . 1 . 2 .]" 1
1098 1 41 VAL QG 1 70 CYS QB 2.700 . 3.600 2.305 1.805 2.710 . 0 0 "[ . 1 . 2 .]" 1
1099 1 41 VAL QG 1 64 ALA MB 2.400 . 3.100 3.055 2.407 3.350 0.250 24 0 "[ . 1 . 2 .]" 1
1100 1 41 VAL QG 1 83 MET ME 2.700 . 3.600 3.718 2.952 4.143 0.543 8 1 "[ . + 1 . 2 .]" 1
1101 1 41 VAL MG1 1 42 ASP H 2.700 . 3.600 2.201 2.060 2.425 . 0 0 "[ . 1 . 2 .]" 1
1102 1 41 VAL MG1 1 42 ASP QB 2.500 . 3.300 2.729 2.308 2.941 . 0 0 "[ . 1 . 2 .]" 1
1103 1 41 VAL MG1 1 43 THR H 2.600 . 3.400 2.652 1.608 3.043 0.192 5 0 "[ . 1 . 2 .]" 1
1104 1 41 VAL MG1 1 43 THR HA 3.300 . 4.700 3.213 2.512 3.739 . 0 0 "[ . 1 . 2 .]" 1
1105 1 41 VAL MG1 1 46 LEU H 3.400 . 4.800 4.060 2.839 4.455 . 0 0 "[ . 1 . 2 .]" 1
1106 1 41 VAL MG1 1 46 LEU HA 3.200 . 4.500 3.643 3.287 3.979 . 0 0 "[ . 1 . 2 .]" 1
1107 1 41 VAL MG1 1 70 CYS QB 2.500 . 3.300 2.327 1.807 2.791 . 0 0 "[ . 1 . 2 .]" 1
1108 1 41 VAL MG1 1 64 ALA MB 3.200 . 4.500 4.131 3.339 4.626 0.126 17 0 "[ . 1 . 2 .]" 1
1109 1 41 VAL MG2 1 42 ASP H 2.900 . 4.000 4.000 3.904 4.119 0.119 16 0 "[ . 1 . 2 .]" 1
1110 1 42 ASP H 1 42 ASP HA 2.800 . 3.800 2.939 2.875 2.950 . 0 0 "[ . 1 . 2 .]" 1
1111 1 42 ASP H 1 42 ASP QB 2.300 . 3.000 2.405 2.208 2.477 . 0 0 "[ . 1 . 2 .]" 1
1112 1 42 ASP H 1 46 LEU QD 3.800 . 5.600 3.997 3.255 4.801 . 0 0 "[ . 1 . 2 .]" 1
1113 1 42 ASP HA 1 42 ASP QB 2.500 . 3.300 2.376 2.308 2.437 . 0 0 "[ . 1 . 2 .]" 1
1114 1 42 ASP HA 1 43 THR H 2.200 . 2.800 2.317 2.117 3.247 0.447 5 0 "[ . 1 . 2 .]" 1
1115 1 42 ASP HA 1 43 THR MG 3.300 . 4.700 3.761 3.531 4.244 . 0 0 "[ . 1 . 2 .]" 1
1116 1 42 ASP QB 1 43 THR H 3.200 . 4.500 3.752 3.191 3.946 . 0 0 "[ . 1 . 2 .]" 1
1117 1 42 ASP QB 1 44 LYS H 3.400 . 4.800 3.759 2.944 4.043 . 0 0 "[ . 1 . 2 .]" 1
1118 1 42 ASP QB 1 45 ASP H 3.400 . 4.800 3.388 3.003 4.240 . 0 0 "[ . 1 . 2 .]" 1
1119 1 42 ASP QB 1 46 LEU H 3.600 . 5.200 2.840 2.355 3.257 . 0 0 "[ . 1 . 2 .]" 1
1120 1 43 THR H 1 43 THR HA 2.700 . 3.600 2.762 2.218 2.904 . 0 0 "[ . 1 . 2 .]" 1
1121 1 43 THR H 1 43 THR HB 2.800 . 3.800 3.667 3.556 4.045 0.245 5 0 "[ . 1 . 2 .]" 1
1122 1 43 THR H 1 43 THR HB 3.300 . 4.700 3.592 3.493 3.962 . 0 0 "[ . 1 . 2 .]" 1
1123 1 43 THR H 1 43 THR MG 2.300 . 3.000 2.465 2.178 2.735 . 0 0 "[ . 1 . 2 .]" 1
1124 1 43 THR H 1 44 LYS H 2.500 . 3.300 2.623 2.265 3.447 0.147 5 0 "[ . 1 . 2 .]" 1
1125 1 43 THR H 1 44 LYS HB2 3.300 . 4.700 3.833 3.583 4.017 . 0 0 "[ . 1 . 2 .]" 1
1126 1 43 THR H 1 44 LYS HB3 3.300 . 4.700 3.397 2.579 3.842 . 0 0 "[ . 1 . 2 .]" 1
1127 1 43 THR H 1 44 LYS HB3 3.100 . 4.300 3.537 2.304 4.116 . 0 0 "[ . 1 . 2 .]" 1
1128 1 43 THR H 1 45 ASP H 3.700 . 5.400 4.093 3.506 4.411 . 0 0 "[ . 1 . 2 .]" 1
1129 1 43 THR H 1 46 LEU QD 3.300 . 4.700 3.512 3.070 3.792 . 0 0 "[ . 1 . 2 .]" 1
1130 1 43 THR HA 1 43 THR HB 2.300 . 3.000 2.495 2.438 2.559 . 0 0 "[ . 1 . 2 .]" 1
1131 1 43 THR HA 1 43 THR MG 2.400 . 3.100 2.271 2.197 2.315 . 0 0 "[ . 1 . 2 .]" 1
1132 1 43 THR HA 1 44 LYS H 3.200 . 4.500 3.408 3.354 3.538 . 0 0 "[ . 1 . 2 .]" 1
1133 1 43 THR HA 1 45 ASP H 3.200 . 4.500 3.765 3.323 4.499 . 0 0 "[ . 1 . 2 .]" 1
1134 1 43 THR HA 1 46 LEU H 3.000 . 4.100 3.080 2.779 3.374 . 0 0 "[ . 1 . 2 .]" 1
1135 1 43 THR HA 1 46 LEU HB3 3.500 . 5.000 3.958 2.058 4.490 . 0 0 "[ . 1 . 2 .]" 1
1136 1 43 THR HA 1 46 LEU HB3 2.300 . 3.000 2.290 1.788 3.572 0.572 21 1 "[ . 1 . 2+ .]" 1
1137 1 43 THR HA 1 46 LEU QD 2.700 . 3.100 1.982 1.751 2.593 0.249 18 0 "[ . 1 . 2 .]" 1
1138 1 43 THR HA 1 46 LEU HG 3.100 . 4.300 2.547 1.790 4.303 0.110 1 0 "[ . 1 . 2 .]" 1
1139 1 43 THR HB 1 43 THR MG 2.200 . 2.800 2.132 2.123 2.137 . 0 0 "[ . 1 . 2 .]" 1
1140 1 43 THR HB 1 44 LYS H 2.900 . 4.000 4.017 3.695 4.127 0.127 15 0 "[ . 1 . 2 .]" 1
1141 1 43 THR HB 1 44 LYS H 2.400 . 3.100 2.790 2.734 2.840 . 0 0 "[ . 1 . 2 .]" 1
1142 1 43 THR HB 1 45 ASP H 2.700 . 3.600 3.388 3.227 3.510 . 0 0 "[ . 1 . 2 .]" 1
1143 1 43 THR HB 1 46 LEU H 3.200 . 4.500 3.874 3.549 4.279 . 0 0 "[ . 1 . 2 .]" 1
1144 1 43 THR HB 1 48 ILE HG13 3.200 . 4.500 3.771 2.776 4.132 . 0 0 "[ . 1 . 2 .]" 1
1145 1 43 THR HB 1 46 LEU QD 2.900 . 4.000 2.986 2.480 3.665 . 0 0 "[ . 1 . 2 .]" 1
1146 1 43 THR MG 1 44 LYS H 3.300 . 4.700 4.163 4.025 4.330 . 0 0 "[ . 1 . 2 .]" 1
1147 1 43 THR MG 1 46 LEU QD 2.500 . 3.300 2.060 1.761 2.577 . 0 0 "[ . 1 . 2 .]" 1
1148 1 43 THR MG 1 48 ILE MD 3.400 . 4.800 4.574 4.058 4.860 0.060 5 0 "[ . 1 . 2 .]" 1
1149 1 44 LYS H 1 44 LYS HA 2.400 . 3.100 2.846 2.775 2.904 . 0 0 "[ . 1 . 2 .]" 1
1150 1 44 LYS H 1 44 LYS HB2 2.500 . 3.300 2.620 2.335 3.594 0.294 8 0 "[ . 1 . 2 .]" 1
1151 1 44 LYS H 1 44 LYS HB3 2.500 . 3.300 2.967 2.132 3.600 0.300 25 0 "[ . 1 . 2 .]" 1
1152 1 44 LYS H 1 45 ASP H 2.500 . 3.300 2.446 2.169 2.735 . 0 0 "[ . 1 . 2 .]" 1
1153 1 44 LYS H 1 46 LEU H 3.700 . 5.400 3.855 3.361 4.220 . 0 0 "[ . 1 . 2 .]" 1
1154 1 44 LYS HA 1 44 LYS HB2 2.200 . 2.800 2.717 2.296 3.027 0.227 5 0 "[ . 1 . 2 .]" 1
1155 1 44 LYS HA 1 44 LYS HB3 2.400 . 3.100 2.707 2.350 3.028 . 0 0 "[ . 1 . 2 .]" 1
1156 1 44 LYS HA 1 44 LYS QG 2.700 . 3.600 2.565 2.335 3.319 . 0 0 "[ . 1 . 2 .]" 1
1157 1 44 LYS HA 1 45 ASP H 2.900 . 4.000 3.429 3.270 3.540 . 0 0 "[ . 1 . 2 .]" 1
1158 1 44 LYS HB2 1 44 LYS HG2 2.200 . 2.800 2.965 2.496 3.015 0.215 25 0 "[ . 1 . 2 .]" 1
1159 1 44 LYS HB2 1 45 ASP H 3.200 . 4.500 3.521 2.440 4.296 . 0 0 "[ . 1 . 2 .]" 1
1160 1 44 LYS HB3 1 44 LYS QG 2.200 . 2.800 2.313 2.139 2.384 . 0 0 "[ . 1 . 2 .]" 1
1161 1 44 LYS HB3 1 44 LYS QG 2.200 . 2.800 2.201 1.828 2.331 . 0 0 "[ . 1 . 2 .]" 1
1162 1 44 LYS HB3 1 45 ASP H 2.800 . 3.800 3.163 2.468 3.829 0.029 21 0 "[ . 1 . 2 .]" 1
1163 1 44 LYS HB3 1 45 ASP H 2.400 . 3.100 2.472 2.102 3.338 0.238 17 0 "[ . 1 . 2 .]" 1
1164 1 44 LYS QG 1 45 ASP H 3.000 . 4.100 3.858 2.299 4.273 0.173 20 0 "[ . 1 . 2 .]" 1
1165 1 45 ASP H 1 45 ASP QB 2.500 . 3.000 2.289 2.162 2.400 . 0 0 "[ . 1 . 2 .]" 1
1166 1 45 ASP H 1 46 LEU H 2.300 . 3.000 2.267 1.946 2.716 . 0 0 "[ . 1 . 2 .]" 1
1167 1 45 ASP H 1 46 LEU HB2 3.700 . 5.400 4.409 3.934 5.087 . 0 0 "[ . 1 . 2 .]" 1
1168 1 45 ASP H 1 46 LEU QD 3.500 . 5.000 4.207 3.283 5.091 0.091 14 0 "[ . 1 . 2 .]" 1
1169 1 45 ASP H 1 64 ALA MB 3.300 . 4.700 3.577 1.861 4.801 0.101 9 0 "[ . 1 . 2 .]" 1
1170 1 45 ASP HA 1 45 ASP QB 2.200 . 2.800 2.375 2.325 2.472 . 0 0 "[ . 1 . 2 .]" 1
1171 1 45 ASP QB 1 46 LEU H 2.600 . 3.400 2.867 2.358 3.286 . 0 0 "[ . 1 . 2 .]" 1
1172 1 45 ASP QB 1 46 LEU H 3.100 . 4.300 2.062 1.977 2.097 . 0 0 "[ . 1 . 2 .]" 1
1173 1 45 ASP QB 1 64 ALA MB 3.500 . 5.000 4.015 2.638 5.154 0.154 19 0 "[ . 1 . 2 .]" 1
1174 1 46 LEU H 1 46 LEU HA 2.700 . 3.600 2.809 2.729 2.888 . 0 0 "[ . 1 . 2 .]" 1
1175 1 46 LEU H 1 46 LEU HB2 2.900 . 4.000 2.435 2.049 2.665 . 0 0 "[ . 1 . 2 .]" 1
1176 1 46 LEU H 1 46 LEU HB3 2.600 . 3.400 3.487 2.716 3.612 0.212 7 0 "[ . 1 . 2 .]" 1
1177 1 46 LEU H 1 46 LEU HB3 2.400 . 3.100 2.382 1.903 3.304 0.204 18 0 "[ . 1 . 2 .]" 1
1178 1 46 LEU H 1 46 LEU QD 2.900 . 3.400 2.997 2.460 3.507 0.107 14 0 "[ . 1 . 2 .]" 1
1179 1 46 LEU H 1 46 LEU QD 2.900 . 4.000 2.805 2.381 3.155 . 0 0 "[ . 1 . 2 .]" 1
1180 1 46 LEU H 1 47 LYS H 3.600 . 5.200 4.462 4.296 4.614 . 0 0 "[ . 1 . 2 .]" 1
1181 1 46 LEU H 1 62 VAL MG1 2.800 . 3.800 2.704 2.345 3.262 . 0 0 "[ . 1 . 2 .]" 1
1182 1 46 LEU HA 1 46 LEU HB2 2.600 . 3.400 2.968 2.527 3.020 . 0 0 "[ . 1 . 2 .]" 1
1183 1 46 LEU HA 1 46 LEU HB3 2.600 . 3.400 2.535 2.372 3.011 . 0 0 "[ . 1 . 2 .]" 1
1184 1 46 LEU HA 1 46 LEU QD 2.400 . 3.100 2.013 1.793 2.178 . 0 0 "[ . 1 . 2 .]" 1
1185 1 46 LEU HA 1 47 LYS H 2.300 . 3.000 2.142 2.047 2.237 . 0 0 "[ . 1 . 2 .]" 1
1186 1 46 LEU HA 1 47 LYS HA 2.700 . 3.600 3.394 2.710 3.809 0.209 14 0 "[ . 1 . 2 .]" 1
1187 1 46 LEU HB2 1 46 LEU QD 2.500 . 3.300 2.232 2.081 2.315 . 0 0 "[ . 1 . 2 .]" 1
1188 1 46 LEU HB2 1 47 LYS H 2.900 . 4.000 4.249 3.821 4.561 0.561 21 2 "[ . 1- . 2+ .]" 1
1189 1 46 LEU HB2 1 62 VAL QG 2.800 . 3.800 3.377 2.925 4.133 0.333 20 0 "[ . 1 . 2 .]" 1
1190 1 46 LEU HB3 1 46 LEU QD 2.500 . 3.300 2.155 2.107 2.372 . 0 0 "[ . 1 . 2 .]" 1
1191 1 46 LEU HB3 1 62 VAL HB 2.600 . 3.400 2.383 1.867 2.843 . 0 0 "[ . 1 . 2 .]" 1
1192 1 46 LEU HB3 1 64 ALA MB 2.600 . 3.400 3.092 1.906 4.075 0.675 20 2 "[- . 1 . + .]" 1
1193 1 46 LEU HB3 1 63 ASP H 3.000 . 4.100 2.756 2.300 3.078 . 0 0 "[ . 1 . 2 .]" 1
1194 1 46 LEU HB3 1 64 ALA H 3.800 . 5.600 4.119 2.014 5.012 . 0 0 "[ . 1 . 2 .]" 1
1195 1 46 LEU HB3 1 48 ILE HG13 2.200 . 2.800 2.405 2.336 2.441 . 0 0 "[ . 1 . 2 .]" 1
1196 1 46 LEU HB3 1 62 VAL HB 3.000 . 4.100 2.564 2.117 3.903 . 0 0 "[ . 1 . 2 .]" 1
1197 1 46 LEU QD 1 47 LYS H 3.000 . 4.100 3.498 2.457 3.942 . 0 0 "[ . 1 . 2 .]" 1
1198 1 46 LEU QD 1 48 ILE H 3.000 . 4.100 3.716 3.658 3.760 . 0 0 "[ . 1 . 2 .]" 1
1199 1 46 LEU QD 1 48 ILE HG13 2.500 . 3.300 3.107 2.490 3.182 . 0 0 "[ . 1 . 2 .]" 1
1200 1 46 LEU QD 1 62 VAL HA 2.900 . 4.000 2.816 2.723 2.908 . 0 0 "[ . 1 . 2 .]" 1
1201 1 46 LEU QD 1 62 VAL HB 2.700 . 3.600 3.033 2.560 3.291 . 0 0 "[ . 1 . 2 .]" 1
1202 1 46 LEU QD 1 60 VAL QG 2.100 . 2.700 1.951 1.776 2.357 . 0 0 "[ . 1 . 2 .]" 1
1203 1 46 LEU QD 1 63 ASP H 2.700 . 3.600 2.452 2.123 2.695 . 0 0 "[ . 1 . 2 .]" 1
1204 1 46 LEU QD 1 64 ALA H 3.300 . 4.700 3.973 3.674 4.191 . 0 0 "[ . 1 . 2 .]" 1
1205 1 46 LEU QD 1 62 VAL HB 3.100 . 4.300 3.013 2.553 3.277 . 0 0 "[ . 1 . 2 .]" 1
1206 1 46 LEU QD 1 64 ALA HA 2.500 . 3.300 2.288 1.816 2.727 . 0 0 "[ . 1 . 2 .]" 1
1207 1 46 LEU QD 1 64 ALA MB 2.600 . 3.100 2.936 2.036 3.287 0.187 10 0 "[ . 1 . 2 .]" 1
1208 1 46 LEU HG 1 64 ALA H 3.700 . 5.400 5.354 4.344 6.149 0.749 4 1 "[ +. 1 . 2 .]" 1
1209 1 47 LYS H 1 47 LYS HA 2.900 . 4.000 2.847 2.785 2.904 . 0 0 "[ . 1 . 2 .]" 1
1210 1 47 LYS H 1 47 LYS QB 2.300 . 3.000 2.252 2.153 2.455 . 0 0 "[ . 1 . 2 .]" 1
1211 1 47 LYS H 1 47 LYS HG3 3.200 . 4.500 4.546 4.273 4.749 0.249 7 0 "[ . 1 . 2 .]" 1
1212 1 47 LYS H 1 48 ILE H 3.400 . 4.800 4.295 4.079 4.425 . 0 0 "[ . 1 . 2 .]" 1
1213 1 47 LYS H 1 48 ILE H 2.800 . 3.800 3.161 2.899 3.422 . 0 0 "[ . 1 . 2 .]" 1
1214 1 47 LYS H 1 62 VAL HA 3.400 . 4.800 4.771 4.555 4.950 0.150 14 0 "[ . 1 . 2 .]" 1
1215 1 47 LYS H 1 62 VAL HB 3.400 . 4.800 3.371 3.001 3.865 . 0 0 "[ . 1 . 2 .]" 1
1216 1 47 LYS H 1 62 VAL MG2 3.100 . 4.300 2.060 1.886 3.099 0.014 24 0 "[ . 1 . 2 .]" 1
1217 1 47 LYS H 1 63 ASP H 3.000 . 4.100 3.259 2.950 3.568 . 0 0 "[ . 1 . 2 .]" 1
1218 1 47 LYS H 1 63 ASP HB3 3.300 . 4.700 3.357 2.726 3.854 . 0 0 "[ . 1 . 2 .]" 1
1219 1 47 LYS HA 1 47 LYS QB 2.400 . 3.100 2.339 2.272 2.456 . 0 0 "[ . 1 . 2 .]" 1
1220 1 47 LYS HA 1 47 LYS HG2 2.700 . 3.600 2.040 1.528 2.521 0.272 12 0 "[ . 1 . 2 .]" 1
1221 1 47 LYS HA 1 47 LYS HG3 2.600 . 3.400 2.823 2.481 3.644 0.244 6 0 "[ . 1 . 2 .]" 1
1222 1 47 LYS HA 1 47 LYS HG3 2.600 . 3.400 2.006 1.523 2.483 0.277 12 0 "[ . 1 . 2 .]" 1
1223 1 47 LYS HA 1 48 ILE H 2.000 . 2.500 2.177 2.124 2.215 . 0 0 "[ . 1 . 2 .]" 1
1224 1 47 LYS HA 1 48 ILE HB 3.300 . 4.700 4.662 4.505 4.757 0.057 6 0 "[ . 1 . 2 .]" 1
1225 1 47 LYS HA 1 48 ILE MD 3.600 . 5.200 5.292 4.704 5.519 0.319 25 0 "[ . 1 . 2 .]" 1
1226 1 47 LYS QB 1 47 LYS HG3 2.200 . 2.800 2.292 2.134 2.370 . 0 0 "[ . 1 . 2 .]" 1
1227 1 47 LYS QB 1 47 LYS HG3 2.200 . 2.800 2.080 1.999 2.122 . 0 0 "[ . 1 . 2 .]" 1
1228 1 47 LYS QB 1 48 ILE H 2.500 . 3.300 2.718 2.289 3.003 . 0 0 "[ . 1 . 2 .]" 1
1229 1 47 LYS QB 1 48 ILE HA 2.700 . 3.600 2.986 2.967 2.995 . 0 0 "[ . 1 . 2 .]" 1
1230 1 47 LYS QB 1 49 LEU H 3.400 . 4.800 3.803 3.741 3.855 . 0 0 "[ . 1 . 2 .]" 1
1231 1 47 LYS QB 1 49 LEU QD 2.900 . 4.000 3.051 2.614 3.367 . 0 0 "[ . 1 . 2 .]" 1
1232 1 47 LYS QB 1 58 TYR HB3 2.400 . 3.100 2.570 1.982 2.844 . 0 0 "[ . 1 . 2 .]" 1
1233 1 47 LYS QB 1 63 ASP HB2 2.600 . 3.400 3.217 2.678 3.457 0.057 10 0 "[ . 1 . 2 .]" 1
1234 1 47 LYS QB 1 63 ASP HB3 2.200 . 2.800 1.974 1.608 2.580 . 0 0 "[ . 1 . 2 .]" 1
1235 1 47 LYS QE 1 49 LEU MD2 3.100 . 4.300 2.910 2.225 4.037 . 0 0 "[ . 1 . 2 .]" 1
1236 1 47 LYS QE 1 60 VAL QG 3.000 . 4.100 2.649 2.422 2.902 . 0 0 "[ . 1 . 2 .]" 1
1237 1 47 LYS HG2 1 48 ILE H 3.300 . 4.700 3.700 2.718 5.079 0.379 24 0 "[ . 1 . 2 .]" 1
1238 1 47 LYS HG2 1 48 ILE H 3.000 . 4.100 3.295 2.703 4.262 0.162 24 0 "[ . 1 . 2 .]" 1
1239 1 47 LYS HG2 1 49 LEU HA 2.300 . 3.000 2.262 2.246 2.286 . 0 0 "[ . 1 . 2 .]" 1
1240 1 47 LYS HG2 1 49 LEU MD2 2.300 . 3.000 2.056 1.789 2.344 . 0 0 "[ . 1 . 2 .]" 1
1241 1 47 LYS HG2 1 62 VAL HA 3.000 . 4.100 3.638 3.467 3.876 . 0 0 "[ . 1 . 2 .]" 1
1242 1 47 LYS HG3 1 48 ILE H 3.000 . 4.100 3.509 2.810 4.192 0.092 6 0 "[ . 1 . 2 .]" 1
1243 1 47 LYS HG3 1 63 ASP HB2 3.000 . 4.100 3.545 3.118 3.832 . 0 0 "[ . 1 . 2 .]" 1
1244 1 47 LYS HG3 1 49 LEU MD1 2.800 . 3.800 3.246 2.055 4.222 0.422 16 0 "[ . 1 . 2 .]" 1
1245 1 48 ILE H 1 48 ILE HA 2.800 . 3.800 2.864 2.834 2.897 . 0 0 "[ . 1 . 2 .]" 1
1246 1 48 ILE H 1 48 ILE HA 2.800 . 3.800 2.782 2.758 2.816 . 0 0 "[ . 1 . 2 .]" 1
1247 1 48 ILE H 1 48 ILE HB 2.200 . 2.800 2.509 2.398 2.639 . 0 0 "[ . 1 . 2 .]" 1
1248 1 48 ILE H 1 48 ILE MD 2.900 . 4.000 3.771 3.380 3.954 . 0 0 "[ . 1 . 2 .]" 1
1249 1 48 ILE H 1 48 ILE HG12 2.700 . 3.600 3.343 2.019 3.582 . 0 0 "[ . 1 . 2 .]" 1
1250 1 48 ILE H 1 48 ILE HG13 2.600 . 3.400 2.444 2.234 3.442 0.042 21 0 "[ . 1 . 2 .]" 1
1251 1 48 ILE H 1 48 ILE MG 2.800 . 3.800 3.716 3.692 3.743 . 0 0 "[ . 1 . 2 .]" 1
1252 1 48 ILE H 1 49 LEU H 3.900 . 5.800 4.422 4.321 4.506 . 0 0 "[ . 1 . 2 .]" 1
1253 1 48 ILE H 1 49 LEU H 3.200 . 4.500 3.686 3.408 3.857 . 0 0 "[ . 1 . 2 .]" 1
1254 1 48 ILE H 1 49 LEU MD1 3.300 . 4.700 3.267 2.993 3.599 . 0 0 "[ . 1 . 2 .]" 1
1255 1 48 ILE H 1 49 LEU MD2 3.000 . 4.100 2.533 2.169 2.862 . 0 0 "[ . 1 . 2 .]" 1
1256 1 48 ILE H 1 60 VAL QG 3.600 . 5.200 3.659 3.500 3.803 . 0 0 "[ . 1 . 2 .]" 1
1257 1 48 ILE H 1 62 VAL MG1 2.700 . 3.600 3.383 3.257 3.473 . 0 0 "[ . 1 . 2 .]" 1
1258 1 48 ILE H 1 62 VAL MG2 2.900 . 4.000 3.430 3.203 3.750 . 0 0 "[ . 1 . 2 .]" 1
1259 1 48 ILE HA 1 48 ILE HB 3.000 . 4.100 3.015 2.999 3.024 . 0 0 "[ . 1 . 2 .]" 1
1260 1 48 ILE HA 1 48 ILE MD 2.800 . 3.800 3.633 2.335 3.807 0.007 7 0 "[ . 1 . 2 .]" 1
1261 1 48 ILE HA 1 48 ILE HG12 3.000 . 4.100 2.441 2.263 3.030 . 0 0 "[ . 1 . 2 .]" 1
1262 1 48 ILE HA 1 48 ILE HG13 3.000 . 4.100 3.123 2.954 3.841 . 0 0 "[ . 1 . 2 .]" 1
1263 1 48 ILE HA 1 48 ILE MG 2.500 . 3.300 2.403 2.323 2.497 . 0 0 "[ . 1 . 2 .]" 1
1264 1 48 ILE HA 1 49 LEU H 2.300 . 3.000 2.072 2.032 2.134 . 0 0 "[ . 1 . 2 .]" 1
1265 1 48 ILE HA 1 49 LEU QB 3.300 . 4.700 4.473 4.386 4.535 . 0 0 "[ . 1 . 2 .]" 1
1266 1 48 ILE HA 1 49 LEU HG 3.200 . 4.500 3.422 3.236 3.744 . 0 0 "[ . 1 . 2 .]" 1
1267 1 48 ILE HA 1 50 LYS H 2.900 . 4.000 3.894 3.579 4.099 0.099 7 0 "[ . 1 . 2 .]" 1
1268 1 48 ILE HA 1 62 VAL HA 2.800 . 3.800 2.382 2.208 2.851 . 0 0 "[ . 1 . 2 .]" 1
1269 1 48 ILE HA 1 62 VAL HB 3.400 . 4.800 3.175 2.848 3.830 . 0 0 "[ . 1 . 2 .]" 1
1270 1 48 ILE HA 1 62 VAL MG1 2.600 . 3.400 1.748 1.652 1.911 0.148 11 0 "[ . 1 . 2 .]" 1
1271 1 48 ILE HA 1 62 VAL MG2 2.900 . 4.000 2.256 2.114 2.382 . 0 0 "[ . 1 . 2 .]" 1
1272 1 48 ILE HA 1 63 ASP H 3.300 . 4.700 3.801 3.565 4.420 . 0 0 "[ . 1 . 2 .]" 1
1273 1 48 ILE HB 1 48 ILE MD 2.800 . 3.800 2.570 2.466 3.245 . 0 0 "[ . 1 . 2 .]" 1
1274 1 48 ILE HB 1 48 ILE HG12 2.500 . 3.300 2.990 2.547 3.032 . 0 0 "[ . 1 . 2 .]" 1
1275 1 48 ILE HB 1 49 LEU H 3.300 . 4.700 4.238 4.069 4.350 . 0 0 "[ . 1 . 2 .]" 1
1276 1 48 ILE HB 1 50 LYS H 2.900 . 4.000 2.704 2.602 2.812 . 0 0 "[ . 1 . 2 .]" 1
1277 1 48 ILE HB 1 51 THR H 3.300 . 4.700 3.830 3.551 3.941 . 0 0 "[ . 1 . 2 .]" 1
1278 1 48 ILE HB 1 61 SER H 4.000 . 6.000 3.324 3.067 3.579 . 0 0 "[ . 1 . 2 .]" 1
1279 1 48 ILE MD 1 48 ILE HG13 2.300 . 3.000 2.114 2.108 2.121 . 0 0 "[ . 1 . 2 .]" 1
1280 1 48 ILE MD 1 48 ILE MG 2.000 . 2.500 1.907 1.854 1.976 . 0 0 "[ . 1 . 2 .]" 1
1281 1 48 ILE MD 1 49 LEU H 3.600 . 5.200 4.930 4.081 5.197 . 0 0 "[ . 1 . 2 .]" 1
1282 1 48 ILE MD 1 60 VAL HB 3.000 . 4.100 4.122 3.291 4.273 0.173 16 0 "[ . 1 . 2 .]" 1
1283 1 48 ILE MD 1 60 VAL HB 3.300 . 4.700 3.529 3.164 3.820 . 0 0 "[ . 1 . 2 .]" 1
1284 1 48 ILE MD 1 60 VAL QG 2.300 . 3.000 2.129 1.943 2.330 . 0 0 "[ . 1 . 2 .]" 1
1285 1 48 ILE MD 1 60 VAL QG 2.300 . 3.000 2.067 1.618 2.264 . 0 0 "[ . 1 . 2 .]" 1
1286 1 48 ILE HG12 1 48 ILE MG 2.300 . 3.000 2.519 2.423 3.183 0.183 21 0 "[ . 1 . 2 .]" 1
1287 1 48 ILE HG12 1 60 VAL QG 2.500 . 3.300 1.876 1.690 3.243 0.110 5 0 "[ . 1 . 2 .]" 1
1288 1 48 ILE MG 1 49 LEU H 2.500 . 3.300 2.763 2.475 3.066 . 0 0 "[ . 1 . 2 .]" 1
1289 1 48 ILE MG 1 49 LEU HA 3.100 . 4.300 3.984 3.773 4.216 . 0 0 "[ . 1 . 2 .]" 1
1290 1 48 ILE MG 1 50 LYS H 2.800 . 3.800 2.755 2.530 3.028 . 0 0 "[ . 1 . 2 .]" 1
1291 1 48 ILE MG 1 50 LYS H 2.500 . 3.300 2.803 2.546 3.154 . 0 0 "[ . 1 . 2 .]" 1
1292 1 48 ILE MG 1 62 VAL HA 3.500 . 5.000 3.966 3.670 4.385 . 0 0 "[ . 1 . 2 .]" 1
1293 1 49 LEU H 1 49 LEU HA 3.000 . 4.100 2.909 2.877 2.935 . 0 0 "[ . 1 . 2 .]" 1
1294 1 49 LEU H 1 49 LEU QB 2.600 . 3.400 2.608 2.508 2.674 . 0 0 "[ . 1 . 2 .]" 1
1295 1 49 LEU H 1 49 LEU MD1 3.300 . 4.700 3.604 3.518 3.682 . 0 0 "[ . 1 . 2 .]" 1
1296 1 49 LEU H 1 49 LEU QD 3.200 . 4.500 2.860 2.761 2.974 . 0 0 "[ . 1 . 2 .]" 1
1297 1 49 LEU H 1 49 LEU MD2 2.900 . 4.000 3.003 2.875 3.180 . 0 0 "[ . 1 . 2 .]" 1
1298 1 49 LEU H 1 49 LEU HG 2.700 . 3.600 2.064 1.935 2.199 . 0 0 "[ . 1 . 2 .]" 1
1299 1 49 LEU H 1 50 LYS H 2.400 . 3.100 2.283 2.150 2.490 . 0 0 "[ . 1 . 2 .]" 1
1300 1 49 LEU H 1 60 VAL HB 3.700 . 5.400 4.284 3.945 4.691 . 0 0 "[ . 1 . 2 .]" 1
1301 1 49 LEU H 1 62 VAL HA 2.600 . 3.400 2.271 2.005 2.605 . 0 0 "[ . 1 . 2 .]" 1
1302 1 49 LEU H 1 62 VAL MG1 2.700 . 3.600 3.037 2.884 3.244 . 0 0 "[ . 1 . 2 .]" 1
1303 1 49 LEU HA 1 49 LEU MD1 3.400 . 4.800 3.933 3.895 3.966 . 0 0 "[ . 1 . 2 .]" 1
1304 1 49 LEU HA 1 49 LEU QD 2.300 . 3.000 2.270 2.173 2.361 . 0 0 "[ . 1 . 2 .]" 1
1305 1 49 LEU HA 1 49 LEU MD2 2.300 . 3.000 2.284 2.184 2.379 . 0 0 "[ . 1 . 2 .]" 1
1306 1 49 LEU HA 1 49 LEU HG 3.200 . 4.500 3.375 3.251 3.436 . 0 0 "[ . 1 . 2 .]" 1
1307 1 49 LEU HA 1 50 LYS H 3.000 . 4.100 3.526 3.483 3.551 . 0 0 "[ . 1 . 2 .]" 1
1308 1 49 LEU QB 1 49 LEU QD 2.300 . 3.000 1.947 1.936 1.958 . 0 0 "[ . 1 . 2 .]" 1
1309 1 49 LEU QB 1 49 LEU MD1 2.200 . 2.800 2.073 1.959 2.094 . 0 0 "[ . 1 . 2 .]" 1
1310 1 49 LEU QB 1 49 LEU HG 2.200 . 2.800 2.358 2.327 2.381 . 0 0 "[ . 1 . 2 .]" 1
1311 1 49 LEU QB 1 50 LYS H 2.400 . 3.100 2.363 2.075 2.639 . 0 0 "[ . 1 . 2 .]" 1
1312 1 49 LEU QB 1 50 LYS QB 2.200 . 2.800 2.041 2.001 2.060 . 0 0 "[ . 1 . 2 .]" 1
1313 1 49 LEU QB 1 61 SER H 3.900 . 5.800 3.619 2.591 4.081 . 0 0 "[ . 1 . 2 .]" 1
1314 1 49 LEU QB 1 61 SER QB 2.300 . 3.000 2.450 2.024 2.788 . 0 0 "[ . 1 . 2 .]" 1
1315 1 49 LEU QB 1 61 SER QB 2.900 . 4.000 2.474 2.032 2.858 . 0 0 "[ . 1 . 2 .]" 1
1316 1 49 LEU QD 1 50 LYS H 3.300 . 4.700 3.797 3.603 3.971 . 0 0 "[ . 1 . 2 .]" 1
1317 1 49 LEU QD 1 61 SER QB 2.800 . 3.800 2.969 2.328 3.445 . 0 0 "[ . 1 . 2 .]" 1
1318 1 49 LEU QD 1 63 ASP HB2 2.400 . 3.100 1.942 1.733 2.676 . 0 0 "[ . 1 . 2 .]" 1
1319 1 49 LEU QD 1 69 LYS HB2 3.500 . 5.000 4.019 3.438 4.934 . 0 0 "[ . 1 . 2 .]" 1
1320 1 49 LEU QD 1 69 LYS HB3 3.400 . 4.800 3.404 2.217 4.911 0.111 23 0 "[ . 1 . 2 .]" 1
1321 1 49 LEU MD1 1 49 LEU HG 2.300 . 3.000 2.024 1.835 2.124 . 0 0 "[ . 1 . 2 .]" 1
1322 1 49 LEU MD1 1 61 SER QB 3.200 . 4.500 3.001 2.336 3.507 . 0 0 "[ . 1 . 2 .]" 1
1323 1 49 LEU MD1 1 62 VAL HA 3.600 . 5.200 3.295 3.146 3.465 . 0 0 "[ . 1 . 2 .]" 1
1324 1 49 LEU MD1 1 63 ASP HA 3.300 . 4.700 3.184 2.875 3.699 . 0 0 "[ . 1 . 2 .]" 1
1325 1 49 LEU MD1 1 63 ASP HB2 2.700 . 3.600 2.812 2.271 3.237 . 0 0 "[ . 1 . 2 .]" 1
1326 1 49 LEU MD1 1 63 ASP HB3 2.700 . 3.600 3.146 1.892 3.953 0.353 15 0 "[ . 1 . 2 .]" 1
1327 1 49 LEU MD1 1 69 LYS HD2 3.100 . 4.300 3.643 2.347 4.301 0.001 5 0 "[ . 1 . 2 .]" 1
1328 1 49 LEU MD1 1 69 LYS HD3 2.900 . 4.000 2.850 2.006 4.189 0.189 19 0 "[ . 1 . 2 .]" 1
1329 1 49 LEU MD2 1 49 LEU HG 2.300 . 3.000 2.134 2.130 2.139 . 0 0 "[ . 1 . 2 .]" 1
1330 1 49 LEU MD2 1 62 VAL HA 3.700 . 5.400 3.237 3.067 3.479 . 0 0 "[ . 1 . 2 .]" 1
1331 1 49 LEU MD2 1 63 ASP HB2 2.700 . 3.600 1.992 1.756 2.854 0.044 10 0 "[ . 1 . 2 .]" 1
1332 1 49 LEU MD2 1 63 ASP HB3 2.800 . 3.800 2.913 2.365 3.241 . 0 0 "[ . 1 . 2 .]" 1
1333 1 49 LEU HG 1 50 LYS H 3.100 . 4.300 3.573 3.367 3.833 . 0 0 "[ . 1 . 2 .]" 1
1334 1 49 LEU HG 1 60 VAL QG 2.500 . 3.300 3.616 3.468 3.729 0.429 24 0 "[ . 1 . 2 .]" 1
1335 1 49 LEU HG 1 61 SER QB 2.700 . 3.600 3.202 2.494 3.505 . 0 0 "[ . 1 . 2 .]" 1
1336 1 49 LEU HG 1 62 VAL HA 2.700 . 3.600 1.941 1.771 2.104 0.029 6 0 "[ . 1 . 2 .]" 1
1337 1 49 LEU HG 1 63 ASP H 3.000 . 4.100 2.775 2.463 3.129 . 0 0 "[ . 1 . 2 .]" 1
1338 1 49 LEU HG 1 64 ALA H 3.900 . 5.800 4.992 4.214 5.334 . 0 0 "[ . 1 . 2 .]" 1
1339 1 50 LYS H 1 50 LYS QB 2.900 . 4.000 2.713 2.607 2.826 . 0 0 "[ . 1 . 2 .]" 1
1340 1 50 LYS H 1 51 THR H 3.700 . 5.400 3.839 3.583 4.172 . 0 0 "[ . 1 . 2 .]" 1
1341 1 50 LYS H 1 61 SER H 3.000 . 4.100 3.327 3.049 3.502 . 0 0 "[ . 1 . 2 .]" 1
1342 1 50 LYS H 1 61 SER H 2.800 . 3.800 3.286 3.031 3.447 . 0 0 "[ . 1 . 2 .]" 1
1343 1 50 LYS H 1 61 SER QB 2.300 . 3.000 2.472 1.758 2.836 . 0 0 "[ . 1 . 2 .]" 1
1344 1 50 LYS H 1 62 VAL HA 3.500 . 5.000 4.169 3.955 4.481 . 0 0 "[ . 1 . 2 .]" 1
1345 1 50 LYS QB 1 51 THR H 3.200 . 4.500 3.890 3.572 4.023 . 0 0 "[ . 1 . 2 .]" 1
1346 1 50 LYS QB 1 61 SER H 3.900 . 5.800 3.327 3.070 3.581 . 0 0 "[ . 1 . 2 .]" 1
1347 1 50 LYS QB 1 61 SER QB 2.500 . 3.000 2.226 1.940 2.590 . 0 0 "[ . 1 . 2 .]" 1
1348 1 50 LYS QG 1 51 THR H 3.100 . 4.300 3.236 2.474 3.820 . 0 0 "[ . 1 . 2 .]" 1
1349 1 50 LYS QG 1 51 THR H 2.900 . 4.000 2.530 1.697 3.125 0.103 3 0 "[ . 1 . 2 .]" 1
1350 1 51 THR H 1 51 THR HB 2.700 . 3.600 2.653 2.509 2.802 . 0 0 "[ . 1 . 2 .]" 1
1351 1 51 THR H 1 51 THR MG 3.300 . 4.700 3.805 3.751 3.878 . 0 0 "[ . 1 . 2 .]" 1
1352 1 51 THR H 1 51 THR MG 3.200 . 4.500 3.714 3.676 3.762 . 0 0 "[ . 1 . 2 .]" 1
1353 1 51 THR HA 1 51 THR MG 2.500 . 3.300 2.321 2.228 2.454 . 0 0 "[ . 1 . 2 .]" 1
1354 1 51 THR HA 1 52 SER H 2.100 . 2.700 2.203 2.141 2.262 . 0 0 "[ . 1 . 2 .]" 1
1355 1 51 THR HA 1 52 SER H 2.200 . 2.800 2.177 2.118 2.239 . 0 0 "[ . 1 . 2 .]" 1
1356 1 51 THR HA 1 58 TYR QE 3.700 . 5.400 4.279 4.157 4.338 . 0 0 "[ . 1 . 2 .]" 1
1357 1 51 THR HA 1 60 VAL HA 2.800 . 3.800 2.328 2.037 2.671 . 0 0 "[ . 1 . 2 .]" 1
1358 1 51 THR HA 1 60 VAL QG 3.100 . 4.300 2.710 2.354 3.197 . 0 0 "[ . 1 . 2 .]" 1
1359 1 51 THR HA 1 61 SER H 3.000 . 4.100 3.459 3.026 3.846 . 0 0 "[ . 1 . 2 .]" 1
1360 1 51 THR HB 1 51 THR MG 2.300 . 3.000 2.134 2.129 2.138 . 0 0 "[ . 1 . 2 .]" 1
1361 1 51 THR HB 1 52 SER H 3.600 . 5.200 4.076 3.806 4.256 . 0 0 "[ . 1 . 2 .]" 1
1362 1 51 THR MG 1 52 SER H 2.400 . 3.100 2.691 2.431 2.869 . 0 0 "[ . 1 . 2 .]" 1
1363 1 51 THR MG 1 52 SER HA 3.600 . 5.200 3.443 3.161 3.862 . 0 0 "[ . 1 . 2 .]" 1
1364 1 51 THR MG 1 59 TYR H 3.300 . 4.700 4.406 3.903 4.790 0.090 8 0 "[ . 1 . 2 .]" 1
1365 1 51 THR MG 1 59 TYR H 3.600 . 5.200 4.147 3.764 4.479 . 0 0 "[ . 1 . 2 .]" 1
1366 1 51 THR MG 1 60 VAL HA 3.100 . 4.300 3.383 2.472 3.966 . 0 0 "[ . 1 . 2 .]" 1
1367 1 52 SER H 1 52 SER HA 2.900 . 4.000 2.887 2.830 2.923 . 0 0 "[ . 1 . 2 .]" 1
1368 1 52 SER H 1 52 SER HB2 2.800 . 3.800 3.140 2.872 3.948 0.148 14 0 "[ . 1 . 2 .]" 1
1369 1 52 SER H 1 52 SER HB3 3.100 . 4.300 3.877 3.148 4.015 . 0 0 "[ . 1 . 2 .]" 1
1370 1 52 SER H 1 58 TYR HB2 3.200 . 4.500 3.734 2.916 4.152 . 0 0 "[ . 1 . 2 .]" 1
1371 1 52 SER H 1 58 TYR HB3 3.500 . 5.000 4.286 4.019 4.478 . 0 0 "[ . 1 . 2 .]" 1
1372 1 52 SER H 1 59 TYR H 2.900 . 4.000 3.167 2.710 3.539 . 0 0 "[ . 1 . 2 .]" 1
1373 1 52 SER H 1 59 TYR H 2.800 . 3.800 3.154 2.706 3.514 . 0 0 "[ . 1 . 2 .]" 1
1374 1 52 SER H 1 59 TYR HB2 3.000 . 4.100 3.669 2.887 4.068 . 0 0 "[ . 1 . 2 .]" 1
1375 1 52 SER H 1 59 TYR HB3 3.200 . 4.500 4.491 4.231 4.684 0.184 6 0 "[ . 1 . 2 .]" 1
1376 1 52 SER H 1 60 VAL H 3.000 . 4.100 3.044 2.820 3.286 . 0 0 "[ . 1 . 2 .]" 1
1377 1 52 SER H 1 60 VAL HA 3.100 . 4.300 3.237 2.750 4.002 . 0 0 "[ . 1 . 2 .]" 1
1378 1 52 SER H 1 60 VAL HA 2.100 . 2.700 2.169 2.119 2.248 . 0 0 "[ . 1 . 2 .]" 1
1379 1 52 SER H 1 60 VAL QG 2.400 . 3.100 2.458 2.373 2.545 . 0 0 "[ . 1 . 2 .]" 1
1380 1 52 SER H 1 60 VAL QG 2.600 . 3.400 2.831 2.713 2.971 . 0 0 "[ . 1 . 2 .]" 1
1381 1 52 SER H 1 71 LYS QG 2.700 . 3.600 2.939 2.577 3.606 0.006 3 0 "[ . 1 . 2 .]" 1
1382 1 52 SER HA 1 52 SER HB2 2.400 . 3.100 2.944 2.504 3.043 . 0 0 "[ . 1 . 2 .]" 1
1383 1 52 SER HA 1 52 SER HB3 2.500 . 3.300 2.460 2.339 3.038 . 0 0 "[ . 1 . 2 .]" 1
1384 1 52 SER HA 1 53 GLU H 2.400 . 3.100 2.574 2.304 2.720 . 0 0 "[ . 1 . 2 .]" 1
1385 1 52 SER HB2 1 53 GLU H 2.800 . 3.800 3.060 1.820 3.806 0.006 13 0 "[ . 1 . 2 .]" 1
1386 1 52 SER HB3 1 53 GLU H 2.300 . 3.000 2.415 1.896 3.394 0.394 24 0 "[ . 1 . 2 .]" 1
1387 1 53 GLU H 1 53 GLU HB2 3.200 . 4.000 2.796 2.316 3.641 . 0 0 "[ . 1 . 2 .]" 1
1388 1 53 GLU H 1 53 GLU HB3 3.200 . 4.500 3.365 3.076 3.594 . 0 0 "[ . 1 . 2 .]" 1
1389 1 53 GLU H 1 53 GLU HG3 3.200 . 4.500 3.133 2.451 3.968 . 0 0 "[ . 1 . 2 .]" 1
1390 1 53 GLU HA 1 53 GLU HB2 3.000 . 4.100 2.418 2.345 2.510 . 0 0 "[ . 1 . 2 .]" 1
1391 1 53 GLU HA 1 53 GLU HB3 2.500 . 3.300 2.447 2.368 2.544 . 0 0 "[ . 1 . 2 .]" 1
1392 1 53 GLU HA 1 53 GLU HG3 3.100 . 4.300 3.725 3.581 4.257 . 0 0 "[ . 1 . 2 .]" 1
1393 1 53 GLU HA 1 54 ASP H 2.400 . 3.100 2.365 2.189 2.612 . 0 0 "[ . 1 . 2 .]" 1
1394 1 53 GLU HA 1 58 TYR HA 2.800 . 3.800 2.187 1.847 2.704 . 0 0 "[ . 1 . 2 .]" 1
1395 1 53 GLU HA 1 58 TYR QD 3.300 . 4.700 3.630 3.125 4.223 . 0 0 "[ . 1 . 2 .]" 1
1396 1 53 GLU HA 1 59 TYR H 2.600 . 3.400 2.436 2.100 2.710 . 0 0 "[ . 1 . 2 .]" 1
1397 1 53 GLU HA 1 59 TYR HB2 3.000 . 4.100 2.846 2.355 2.995 . 0 0 "[ . 1 . 2 .]" 1
1398 1 53 GLU HA 1 59 TYR QD 3.200 . 4.500 2.355 1.992 2.699 . 0 0 "[ . 1 . 2 .]" 1
1399 1 53 GLU HA 1 60 VAL QG 3.500 . 5.000 3.607 3.395 3.842 . 0 0 "[ . 1 . 2 .]" 1
1400 1 53 GLU HA 1 59 TYR QD 3.100 . 4.300 2.822 2.045 3.792 . 0 0 "[ . 1 . 2 .]" 1
1401 1 53 GLU HB2 1 54 ASP H 3.500 . 5.000 2.384 2.040 2.755 . 0 0 "[ . 1 . 2 .]" 1
1402 1 53 GLU HB2 1 58 TYR HA 3.600 . 5.200 2.869 2.219 3.495 . 0 0 "[ . 1 . 2 .]" 1
1403 1 53 GLU HB2 1 57 PHE HA 3.100 . 4.300 2.197 2.036 2.307 . 0 0 "[ . 1 . 2 .]" 1
1404 1 53 GLU HB2 1 58 TYR H 3.000 . 4.100 2.912 2.542 3.224 . 0 0 "[ . 1 . 2 .]" 1
1405 1 53 GLU HB2 1 74 ILE H 3.500 . 5.000 4.304 3.553 4.762 . 0 0 "[ . 1 . 2 .]" 1
1406 1 53 GLU HB2 1 74 ILE MD 3.500 . 5.000 4.543 3.302 5.770 0.770 8 5 "[- * . + 1 *. 2 * .]" 1
1407 1 53 GLU HB3 1 53 GLU HG3 2.100 . 2.700 2.934 2.489 3.010 0.310 5 0 "[ . 1 . 2 .]" 1
1408 1 53 GLU HB3 1 54 ASP H 2.800 . 3.800 3.762 3.498 4.003 0.203 25 0 "[ . 1 . 2 .]" 1
1409 1 53 GLU HB3 1 54 ASP H 2.700 . 3.600 3.328 2.836 3.774 0.174 25 0 "[ . 1 . 2 .]" 1
1410 1 53 GLU HB3 1 57 PHE H 3.400 . 4.800 3.262 2.327 4.351 . 0 0 "[ . 1 . 2 .]" 1
1411 1 53 GLU HB3 1 57 PHE HA 2.900 . 4.000 2.522 1.839 2.969 . 0 0 "[ . 1 . 2 .]" 1
1412 1 53 GLU HB3 1 58 TYR H 3.700 . 5.400 3.813 2.981 4.416 . 0 0 "[ . 1 . 2 .]" 1
1413 1 53 GLU HB3 1 58 TYR HA 3.300 . 4.700 2.696 1.843 3.752 0.057 1 0 "[ . 1 . 2 .]" 1
1414 1 53 GLU HB3 1 58 TYR QD 3.000 . 4.100 2.423 1.886 3.544 0.014 23 0 "[ . 1 . 2 .]" 1
1415 1 53 GLU HB3 1 58 TYR QD 3.300 . 4.700 2.229 1.866 2.759 0.034 23 0 "[ . 1 . 2 .]" 1
1416 1 53 GLU HB3 1 58 TYR QE 2.900 . 4.000 2.414 1.668 2.824 0.132 25 0 "[ . 1 . 2 .]" 1
1417 1 53 GLU HG3 1 54 ASP H 3.300 . 4.700 3.802 3.004 4.718 0.018 9 0 "[ . 1 . 2 .]" 1
1418 1 54 ASP H 1 54 ASP HA 2.900 . 4.000 2.920 2.844 2.951 . 0 0 "[ . 1 . 2 .]" 1
1419 1 54 ASP H 1 54 ASP HB3 3.400 . 4.800 2.872 2.496 3.513 . 0 0 "[ . 1 . 2 .]" 1
1420 1 54 ASP H 1 55 LYS H 3.800 . 5.600 3.732 2.683 4.330 . 0 0 "[ . 1 . 2 .]" 1
1421 1 54 ASP H 1 55 LYS HG2 3.700 . 5.400 3.570 2.142 4.304 . 0 0 "[ . 1 . 2 .]" 1
1422 1 54 ASP H 1 57 PHE H 3.000 . 4.100 3.334 2.773 3.659 . 0 0 "[ . 1 . 2 .]" 1
1423 1 54 ASP H 1 57 PHE H 3.100 . 4.300 3.101 2.599 3.573 . 0 0 "[ . 1 . 2 .]" 1
1424 1 54 ASP H 1 57 PHE HA 3.000 . 4.100 3.325 2.829 3.964 . 0 0 "[ . 1 . 2 .]" 1
1425 1 54 ASP H 1 58 TYR HB3 3.500 . 5.000 3.107 2.611 3.510 . 0 0 "[ . 1 . 2 .]" 1
1426 1 54 ASP H 1 59 TYR QD 3.900 . 5.800 3.411 2.269 4.929 . 0 0 "[ . 1 . 2 .]" 1
1427 1 54 ASP H 1 59 TYR QD 4.100 . 6.000 3.100 2.262 3.599 . 0 0 "[ . 1 . 2 .]" 1
1428 1 54 ASP H 1 59 TYR QE 3.600 . 5.200 3.507 2.541 4.999 . 0 0 "[ . 1 . 2 .]" 1
1429 1 54 ASP HA 1 54 ASP HB2 2.700 . 3.600 2.558 2.433 2.996 . 0 0 "[ . 1 . 2 .]" 1
1430 1 54 ASP HA 1 54 ASP HB3 2.400 . 3.100 3.009 2.607 3.048 . 0 0 "[ . 1 . 2 .]" 1
1431 1 54 ASP HB3 1 59 TYR QE 3.600 . 5.200 2.355 1.491 3.584 0.509 18 1 "[ . 1 . + 2 .]" 1
1432 1 55 LYS H 1 55 LYS HA 3.200 . 4.500 2.355 2.058 2.806 . 0 0 "[ . 1 . 2 .]" 1
1433 1 55 LYS H 1 57 PHE H 2.300 . 3.000 2.719 2.430 3.023 0.023 13 0 "[ . 1 . 2 .]" 1
1434 1 55 LYS HA 1 55 LYS HB2 2.500 . 3.300 2.967 2.463 3.030 . 0 0 "[ . 1 . 2 .]" 1
1435 1 55 LYS HA 1 55 LYS HB3 2.400 . 3.100 2.524 2.371 3.028 . 0 0 "[ . 1 . 2 .]" 1
1436 1 55 LYS HA 1 55 LYS QD 2.800 . 3.800 2.749 1.918 3.877 0.077 22 0 "[ . 1 . 2 .]" 1
1437 1 55 LYS HA 1 55 LYS HG2 2.900 . 4.000 3.133 2.384 3.802 . 0 0 "[ . 1 . 2 .]" 1
1438 1 55 LYS HA 1 55 LYS HG3 3.100 . 4.300 3.306 2.437 3.870 . 0 0 "[ . 1 . 2 .]" 1
1439 1 55 LYS HA 1 55 LYS HG3 2.800 . 3.800 3.272 2.436 3.805 0.005 23 0 "[ . 1 . 2 .]" 1
1440 1 55 LYS HA 1 56 ARG H 3.200 . 4.500 2.897 2.114 3.559 . 0 0 "[ . 1 . 2 .]" 1
1441 1 55 LYS HB2 1 55 LYS HG2 2.000 . 2.500 2.614 2.406 3.004 0.504 17 2 "[ . 1 . + 2 - .]" 1
1442 1 55 LYS HB2 1 56 ARG H 3.300 . 4.700 3.175 1.762 4.624 0.138 23 0 "[ . 1 . 2 .]" 1
1443 1 55 LYS HB3 1 55 LYS HG2 2.000 . 2.500 1.994 1.916 2.052 . 0 0 "[ . 1 . 2 .]" 1
1444 1 55 LYS HB3 1 56 ARG H 3.500 . 5.000 3.119 1.832 4.232 0.168 12 0 "[ . 1 . 2 .]" 1
1445 1 55 LYS HB3 1 56 ARG QB 2.900 . 4.000 3.787 3.308 4.403 0.403 11 0 "[ . 1 . 2 .]" 1
1446 1 55 LYS HB3 1 56 ARG HD3 2.400 . 3.100 2.171 1.985 2.474 . 0 0 "[ . 1 . 2 .]" 1
1447 1 55 LYS HG3 1 57 PHE H 3.000 . 4.100 3.365 2.669 3.662 . 0 0 "[ . 1 . 2 .]" 1
1448 1 55 LYS HG3 1 59 TYR QE 3.600 . 5.200 2.800 1.971 4.372 0.029 14 0 "[ . 1 . 2 .]" 1
1449 1 56 ARG H 1 56 ARG QB 3.000 . 4.100 2.736 2.168 3.412 . 0 0 "[ . 1 . 2 .]" 1
1450 1 56 ARG H 1 56 ARG QB 2.700 . 3.600 2.664 2.161 3.190 . 0 0 "[ . 1 . 2 .]" 1
1451 1 56 ARG H 1 56 ARG QB 3.200 . 4.500 2.639 2.165 3.311 . 0 0 "[ . 1 . 2 .]" 1
1452 1 56 ARG H 1 56 ARG HG3 3.300 . 4.700 3.184 2.059 4.762 0.062 16 0 "[ . 1 . 2 .]" 1
1453 1 56 ARG H 1 57 PHE H 2.400 . 3.100 2.850 2.633 3.252 0.152 13 0 "[ . 1 . 2 .]" 1
1454 1 56 ARG H 1 57 PHE QR 3.900 . 5.800 3.752 2.537 5.302 . 0 0 "[ . 1 . 2 .]" 1
1455 1 56 ARG H 1 76 LYS QB 2.900 . 4.000 2.463 1.850 3.707 . 0 0 "[ . 1 . 2 .]" 1
1456 1 56 ARG HA 1 56 ARG QB 2.600 . 3.400 2.398 2.281 2.516 . 0 0 "[ . 1 . 2 .]" 1
1457 1 56 ARG HA 1 56 ARG QB 2.300 . 3.000 2.217 2.153 2.325 . 0 0 "[ . 1 . 2 .]" 1
1458 1 56 ARG HA 1 56 ARG QB 2.300 . 3.000 2.242 2.096 2.375 . 0 0 "[ . 1 . 2 .]" 1
1459 1 56 ARG HA 1 56 ARG HG3 2.600 . 3.400 2.877 2.418 3.208 . 0 0 "[ . 1 . 2 .]" 1
1460 1 56 ARG HA 1 57 PHE H 3.100 . 4.300 3.222 2.920 3.525 . 0 0 "[ . 1 . 2 .]" 1
1461 1 56 ARG HA 1 76 LYS QD 3.500 . 4.100 2.767 2.279 3.416 . 0 0 "[ . 1 . 2 .]" 1
1462 1 56 ARG HA 1 76 LYS QE 3.500 . 5.000 3.537 2.855 4.302 . 0 0 "[ . 1 . 2 .]" 1
1463 1 56 ARG HA 1 76 LYS QG 3.100 . 4.300 2.447 2.041 2.710 . 0 0 "[ . 1 . 2 .]" 1
1464 1 56 ARG QB 1 56 ARG QD 2.400 . 3.100 2.172 2.079 2.374 . 0 0 "[ . 1 . 2 .]" 1
1465 1 56 ARG QB 1 56 ARG QD 2.000 . 2.500 1.978 1.932 2.046 . 0 0 "[ . 1 . 2 .]" 1
1466 1 56 ARG QB 1 57 PHE QR 2.800 . 3.800 2.770 2.355 3.157 . 0 0 "[ . 1 . 2 .]" 1
1467 1 56 ARG QB 1 56 ARG HG3 2.200 . 2.800 2.349 2.257 2.440 . 0 0 "[ . 1 . 2 .]" 1
1468 1 56 ARG QB 1 57 PHE H 3.200 . 4.500 3.186 2.676 3.522 . 0 0 "[ . 1 . 2 .]" 1
1469 1 56 ARG QB 1 57 PHE QR 2.700 . 3.600 2.803 2.361 3.362 . 0 0 "[ . 1 . 2 .]" 1
1470 1 56 ARG QB 1 76 LYS QB 3.000 . 4.100 2.124 2.055 2.219 . 0 0 "[ . 1 . 2 .]" 1
1471 1 56 ARG QD 1 56 ARG HG3 2.200 . 2.800 2.327 2.171 2.421 . 0 0 "[ . 1 . 2 .]" 1
1472 1 56 ARG QD 1 57 PHE QR 2.800 . 3.800 3.727 2.515 3.985 0.185 8 0 "[ . 1 . 2 .]" 1
1473 1 56 ARG QD 1 78 VAL QG 3.400 . 4.800 2.500 1.885 4.333 0.115 3 0 "[ . 1 . 2 .]" 1
1474 1 56 ARG HG3 1 57 PHE H 3.900 . 5.800 4.844 4.412 5.203 . 0 0 "[ . 1 . 2 .]" 1
1475 1 57 PHE H 1 57 PHE HA 3.000 . 4.100 2.935 2.876 2.962 . 0 0 "[ . 1 . 2 .]" 1
1476 1 57 PHE H 1 57 PHE QB 2.800 . 3.800 2.735 2.419 2.947 . 0 0 "[ . 1 . 2 .]" 1
1477 1 57 PHE H 1 57 PHE QR 3.200 . 4.500 3.076 2.270 3.355 . 0 0 "[ . 1 . 2 .]" 1
1478 1 57 PHE H 1 58 TYR H 3.800 . 5.600 4.349 4.003 4.508 . 0 0 "[ . 1 . 2 .]" 1
1479 1 57 PHE H 1 59 TYR QE 4.400 . 6.000 4.709 3.816 5.132 . 0 0 "[ . 1 . 2 .]" 1
1480 1 57 PHE H 1 76 LYS QE 3.200 . 4.500 3.292 2.328 4.425 . 0 0 "[ . 1 . 2 .]" 1
1481 1 57 PHE HA 1 57 PHE QB 3.400 . 4.800 2.325 2.251 2.415 . 0 0 "[ . 1 . 2 .]" 1
1482 1 57 PHE HA 1 57 PHE QB 3.400 . 4.800 2.312 2.238 2.397 . 0 0 "[ . 1 . 2 .]" 1
1483 1 57 PHE HA 1 57 PHE QR 3.100 . 4.300 2.748 2.249 3.203 . 0 0 "[ . 1 . 2 .]" 1
1484 1 57 PHE HA 1 58 TYR H 2.600 . 3.100 2.133 2.083 2.207 . 0 0 "[ . 1 . 2 .]" 1
1485 1 57 PHE HA 1 58 TYR HB2 2.700 . 3.600 2.936 2.850 2.971 . 0 0 "[ . 1 . 2 .]" 1
1486 1 57 PHE HA 1 58 TYR HB3 2.800 . 3.800 2.667 2.596 2.813 . 0 0 "[ . 1 . 2 .]" 1
1487 1 57 PHE HA 1 59 TYR QD 3.500 . 5.000 3.827 3.295 4.270 . 0 0 "[ . 1 . 2 .]" 1
1488 1 57 PHE HA 1 73 LYS HG2 2.900 . 4.000 2.907 2.294 3.719 . 0 0 "[ . 1 . 2 .]" 1
1489 1 57 PHE HA 1 76 LYS QE 3.400 . 4.800 3.364 2.517 3.941 . 0 0 "[ . 1 . 2 .]" 1
1490 1 57 PHE HA 1 76 LYS H 3.300 . 4.700 3.009 2.098 4.461 . 0 0 "[ . 1 . 2 .]" 1
1491 1 57 PHE QB 1 57 PHE QD 3.100 . 4.000 2.129 2.119 2.165 . 0 0 "[ . 1 . 2 .]" 1
1492 1 57 PHE QB 1 58 TYR H 3.000 . 4.100 2.943 2.548 3.358 . 0 0 "[ . 1 . 2 .]" 1
1493 1 57 PHE QB 1 74 ILE H 3.800 . 5.600 4.676 4.054 5.165 . 0 0 "[ . 1 . 2 .]" 1
1494 1 57 PHE QR 1 73 LYS QD 3.100 . 4.300 3.916 2.392 4.330 0.030 4 0 "[ . 1 . 2 .]" 1
1495 1 57 PHE QR 1 73 LYS HE2 3.000 . 4.100 3.190 1.991 4.206 0.106 1 0 "[ . 1 . 2 .]" 1
1496 1 57 PHE QR 1 73 LYS HE3 2.900 . 4.000 2.985 2.170 4.263 0.263 1 0 "[ . 1 . 2 .]" 1
1497 1 57 PHE QR 1 73 LYS HG3 3.200 . 4.500 3.409 1.948 4.133 . 0 0 "[ . 1 . 2 .]" 1
1498 1 57 PHE QR 1 75 ARG HA 2.700 . 3.600 2.592 1.986 3.381 . 0 0 "[ . 1 . 2 .]" 1
1499 1 57 PHE QR 1 75 ARG HB2 3.100 . 4.300 3.018 2.402 3.689 . 0 0 "[ . 1 . 2 .]" 1
1500 1 57 PHE QR 1 75 ARG QD 2.600 . 3.400 2.318 1.738 2.908 0.062 13 0 "[ . 1 . 2 .]" 1
1501 1 57 PHE QR 1 75 ARG HG2 3.200 . 4.500 3.619 3.124 4.189 . 0 0 "[ . 1 . 2 .]" 1
1502 1 57 PHE QR 1 75 ARG HG3 3.000 . 4.100 2.266 1.784 3.017 0.116 3 0 "[ . 1 . 2 .]" 1
1503 1 58 TYR H 1 58 TYR HB2 3.500 . 5.000 2.327 2.215 2.543 . 0 0 "[ . 1 . 2 .]" 1
1504 1 58 TYR H 1 58 TYR HB3 2.900 . 4.000 3.528 3.304 3.643 . 0 0 "[ . 1 . 2 .]" 1
1505 1 58 TYR H 1 58 TYR QD 4.100 . 6.000 3.391 2.993 3.853 . 0 0 "[ . 1 . 2 .]" 1
1506 1 58 TYR H 1 76 LYS QE 3.300 . 4.700 3.918 2.989 4.631 . 0 0 "[ . 1 . 2 .]" 1
1507 1 58 TYR H 1 74 ILE HB 3.600 . 5.200 3.464 2.933 3.901 . 0 0 "[ . 1 . 2 .]" 1
1508 1 58 TYR H 1 75 ARG HA 3.600 . 5.200 3.183 2.468 3.586 . 0 0 "[ . 1 . 2 .]" 1
1509 1 58 TYR HA 1 58 TYR HB2 2.700 . 3.600 2.940 2.861 2.973 . 0 0 "[ . 1 . 2 .]" 1
1510 1 58 TYR HA 1 58 TYR QD 2.800 . 3.800 2.674 2.269 2.992 . 0 0 "[ . 1 . 2 .]" 1
1511 1 58 TYR HA 1 59 TYR H 2.400 . 3.100 2.263 2.151 2.384 . 0 0 "[ . 1 . 2 .]" 1
1512 1 58 TYR HB2 1 58 TYR QD 2.600 . 3.400 2.313 2.270 2.423 . 0 0 "[ . 1 . 2 .]" 1
1513 1 58 TYR HB2 1 59 TYR H 2.700 . 3.600 2.656 2.577 2.732 . 0 0 "[ . 1 . 2 .]" 1
1514 1 58 TYR HB2 1 59 TYR HA 2.800 . 3.800 2.999 2.990 3.009 . 0 0 "[ . 1 . 2 .]" 1
1515 1 58 TYR HB2 1 73 LYS H 3.500 . 5.000 3.478 3.144 3.771 . 0 0 "[ . 1 . 2 .]" 1
1516 1 58 TYR HB2 1 74 ILE H 3.800 . 5.600 2.952 2.454 3.606 . 0 0 "[ . 1 . 2 .]" 1
1517 1 58 TYR HB2 1 74 ILE MD 2.800 . 3.800 2.759 2.448 3.034 . 0 0 "[ . 1 . 2 .]" 1
1518 1 58 TYR HB3 1 58 TYR QD 2.700 . 3.600 2.513 2.360 2.664 . 0 0 "[ . 1 . 2 .]" 1
1519 1 58 TYR HB3 1 59 TYR H 2.800 . 3.800 2.813 2.545 3.223 . 0 0 "[ . 1 . 2 .]" 1
1520 1 58 TYR HB3 1 60 VAL QG 3.300 . 4.700 2.863 2.412 3.121 . 0 0 "[ . 1 . 2 .]" 1
1521 1 58 TYR HB3 1 74 ILE H 3.500 . 5.000 3.440 3.035 3.918 . 0 0 "[ . 1 . 2 .]" 1
1522 1 58 TYR HB3 1 74 ILE HB 2.700 . 3.600 2.738 2.023 3.099 . 0 0 "[ . 1 . 2 .]" 1
1523 1 58 TYR HB3 1 74 ILE MD 3.100 . 4.300 3.278 2.657 4.251 . 0 0 "[ . 1 . 2 .]" 1
1524 1 58 TYR QD 1 59 TYR H 3.800 . 5.600 3.062 2.525 3.402 . 0 0 "[ . 1 . 2 .]" 1
1525 1 58 TYR QD 1 74 ILE HB 3.200 . 4.500 3.312 2.425 4.500 0.000 19 0 "[ . 1 . 2 .]" 1
1526 1 58 TYR QD 1 76 LYS QE 3.400 . 4.800 2.954 2.228 3.719 . 0 0 "[ . 1 . 2 .]" 1
1527 1 58 TYR QD 1 76 LYS QG 3.400 . 4.800 2.147 1.495 3.566 0.505 2 1 "[ + . 1 . 2 .]" 1
1528 1 58 TYR QE 1 60 VAL QG 3.600 . 5.200 5.057 4.315 5.252 0.052 23 0 "[ . 1 . 2 .]" 1
1529 1 58 TYR QE 1 60 VAL QG 3.400 . 4.800 3.087 2.128 3.617 . 0 0 "[ . 1 . 2 .]" 1
1530 1 58 TYR QE 1 76 LYS QB 3.700 . 4.800 3.707 2.318 4.487 . 0 0 "[ . 1 . 2 .]" 1
1531 1 58 TYR QE 1 76 LYS QD 3.500 . 5.000 3.124 2.130 3.692 . 0 0 "[ . 1 . 2 .]" 1
1532 1 58 TYR QE 1 76 LYS QE 2.900 . 4.000 2.681 1.681 3.696 0.119 25 0 "[ . 1 . 2 .]" 1
1533 1 58 TYR QE 1 76 LYS QG 3.200 . 4.500 2.662 2.071 3.999 . 0 0 "[ . 1 . 2 .]" 1
1534 1 59 TYR H 1 59 TYR HA 3.000 . 4.100 2.936 2.923 2.949 . 0 0 "[ . 1 . 2 .]" 1
1535 1 59 TYR H 1 59 TYR QD 3.300 . 4.700 3.357 2.736 3.679 . 0 0 "[ . 1 . 2 .]" 1
1536 1 59 TYR H 1 59 TYR QE 4.400 . 6.000 5.198 4.274 5.484 . 0 0 "[ . 1 . 2 .]" 1
1537 1 59 TYR H 1 60 VAL QG 3.200 . 4.500 3.653 3.378 3.942 . 0 0 "[ . 1 . 2 .]" 1
1538 1 59 TYR H 1 71 LYS QG 3.200 . 4.500 3.879 3.774 4.031 . 0 0 "[ . 1 . 2 .]" 1
1539 1 59 TYR H 1 76 LYS H 3.600 . 5.200 5.551 5.340 5.790 0.590 19 3 "[ * 1 . +2 -.]" 1
1540 1 59 TYR H 1 74 ILE H 3.600 . 5.200 3.886 3.354 4.253 . 0 0 "[ . 1 . 2 .]" 1
1541 1 59 TYR HA 1 59 TYR HB3 2.800 . 3.800 2.509 2.364 2.561 . 0 0 "[ . 1 . 2 .]" 1
1542 1 59 TYR HA 1 59 TYR QD 3.100 . 4.300 2.658 2.259 3.052 . 0 0 "[ . 1 . 2 .]" 1
1543 1 59 TYR HA 1 60 VAL H 2.200 . 2.800 2.185 2.081 2.316 . 0 0 "[ . 1 . 2 .]" 1
1544 1 59 TYR HA 1 60 VAL QG 3.300 . 4.700 3.654 3.421 3.893 . 0 0 "[ . 1 . 2 .]" 1
1545 1 59 TYR HA 1 73 LYS HA 3.300 . 4.700 2.735 2.337 3.276 . 0 0 "[ . 1 . 2 .]" 1
1546 1 59 TYR HA 1 73 LYS QB 3.700 . 5.400 4.158 3.487 5.050 . 0 0 "[ . 1 . 2 .]" 1
1547 1 59 TYR HA 1 74 ILE H 3.100 . 4.300 3.599 3.016 4.248 . 0 0 "[ . 1 . 2 .]" 1
1548 1 59 TYR HB2 1 59 TYR QD 2.600 . 3.400 2.328 2.273 2.468 . 0 0 "[ . 1 . 2 .]" 1
1549 1 59 TYR HB2 1 60 VAL H 3.000 . 4.100 2.993 2.459 3.385 . 0 0 "[ . 1 . 2 .]" 1
1550 1 59 TYR HB2 1 71 LYS QD 2.900 . 4.000 3.418 2.995 4.052 0.052 11 0 "[ . 1 . 2 .]" 1
1551 1 59 TYR HB3 1 59 TYR QD 2.700 . 3.600 2.506 2.332 2.693 . 0 0 "[ . 1 . 2 .]" 1
1552 1 59 TYR HB3 1 60 VAL H 3.300 . 4.700 3.845 3.523 4.148 . 0 0 "[ . 1 . 2 .]" 1
1553 1 59 TYR HB3 1 89 ARG QB 3.100 . 4.300 2.745 1.746 3.687 0.154 10 0 "[ . 1 . 2 .]" 1
1554 1 59 TYR HB3 1 89 ARG QD 2.800 . 3.800 2.711 1.788 3.621 0.012 15 0 "[ . 1 . 2 .]" 1
1555 1 59 TYR HB3 1 98 TYR QE 3.700 . 5.400 3.333 1.515 4.367 0.485 15 0 "[ . 1 . 2 .]" 1
1556 1 59 TYR HB3 1 71 LYS QD 2.900 . 4.000 1.952 1.649 2.551 0.151 18 0 "[ . 1 . 2 .]" 1
1557 1 59 TYR HB3 1 98 TYR H 3.600 . 5.200 4.957 3.970 5.633 0.433 22 0 "[ . 1 . 2 .]" 1
1558 1 59 TYR QD 1 71 LYS QD 3.300 . 4.700 2.500 1.804 3.616 0.096 8 0 "[ . 1 . 2 .]" 1
1559 1 59 TYR QD 1 71 LYS QG 3.000 . 4.100 2.359 1.862 3.032 0.038 20 0 "[ . 1 . 2 .]" 1
1560 1 59 TYR QD 1 73 LYS H 4.300 . 6.000 4.307 3.318 5.155 . 0 0 "[ . 1 . 2 .]" 1
1561 1 59 TYR QD 1 73 LYS QB 3.300 . 4.700 2.944 2.220 3.610 . 0 0 "[ . 1 . 2 .]" 1
1562 1 59 TYR QD 1 73 LYS QD 3.600 . 5.200 3.850 3.060 4.668 . 0 0 "[ . 1 . 2 .]" 1
1563 1 59 TYR QD 1 73 LYS QD 3.200 . 4.500 3.585 3.004 4.472 . 0 0 "[ . 1 . 2 .]" 1
1564 1 59 TYR QE 1 73 LYS QD 2.800 . 3.800 2.607 1.800 3.848 0.100 3 0 "[ . 1 . 2 .]" 1
1565 1 59 TYR QE 1 73 LYS HE2 3.200 . 4.500 4.222 1.768 5.007 0.507 7 1 "[ . + 1 . 2 .]" 1
1566 1 59 TYR QE 1 73 LYS HE3 3.500 . 5.000 3.670 1.983 4.958 0.017 14 0 "[ . 1 . 2 .]" 1
1567 1 59 TYR QE 1 73 LYS QG 3.400 . 4.800 2.818 1.802 4.321 0.198 19 0 "[ . 1 . 2 .]" 1
1568 1 60 VAL H 1 60 VAL HA 3.100 . 4.300 2.900 2.868 2.918 . 0 0 "[ . 1 . 2 .]" 1
1569 1 60 VAL H 1 60 VAL HB 3.000 . 4.100 2.703 2.620 2.781 . 0 0 "[ . 1 . 2 .]" 1
1570 1 60 VAL H 1 60 VAL HB 2.800 . 3.800 2.694 2.612 2.772 . 0 0 "[ . 1 . 2 .]" 1
1571 1 60 VAL H 1 60 VAL QG 2.500 . 3.300 2.303 2.158 2.447 . 0 0 "[ . 1 . 2 .]" 1
1572 1 60 VAL H 1 71 LYS QG 2.900 . 4.000 3.176 2.852 3.735 . 0 0 "[ . 1 . 2 .]" 1
1573 1 60 VAL H 1 74 ILE MD 3.300 . 4.700 4.340 3.935 4.668 . 0 0 "[ . 1 . 2 .]" 1
1574 1 60 VAL HA 1 60 VAL QG 2.500 . 3.100 2.137 2.119 2.156 . 0 0 "[ . 1 . 2 .]" 1
1575 1 60 VAL HA 1 61 SER H 2.200 . 2.800 2.209 2.150 2.260 . 0 0 "[ . 1 . 2 .]" 1
1576 1 60 VAL HB 1 60 VAL QG 2.100 . 2.700 1.892 1.886 1.895 . 0 0 "[ . 1 . 2 .]" 1
1577 1 60 VAL HB 1 61 SER H 3.200 . 4.500 2.867 2.723 3.018 . 0 0 "[ . 1 . 2 .]" 1
1578 1 60 VAL HB 1 61 SER H 3.900 . 5.800 4.326 4.252 4.384 . 0 0 "[ . 1 . 2 .]" 1
1579 1 60 VAL HB 1 61 SER HA 3.300 . 4.700 4.224 4.096 4.442 . 0 0 "[ . 1 . 2 .]" 1
1580 1 60 VAL HB 1 62 VAL H 3.500 . 5.000 3.315 3.073 3.463 . 0 0 "[ . 1 . 2 .]" 1
1581 1 60 VAL HB 1 71 LYS H 3.100 . 4.300 3.125 2.614 3.546 . 0 0 "[ . 1 . 2 .]" 1
1582 1 60 VAL HB 1 72 PHE H 3.500 . 5.000 2.954 2.787 3.126 . 0 0 "[ . 1 . 2 .]" 1
1583 1 60 VAL HB 1 71 LYS QE 3.000 . 4.100 1.917 1.674 2.326 0.226 3 0 "[ . 1 . 2 .]" 1
1584 1 60 VAL HB 1 72 PHE QB 2.700 . 3.600 1.917 1.674 2.326 0.126 3 0 "[ . 1 . 2 .]" 1
1585 1 60 VAL HB 1 74 ILE MD 3.000 . 4.100 3.426 2.990 3.767 . 0 0 "[ . 1 . 2 .]" 1
1586 1 60 VAL QG 1 61 SER H 2.500 . 3.300 3.231 2.990 3.391 0.091 13 0 "[ . 1 . 2 .]" 1
1587 1 60 VAL QG 1 61 SER HA 3.200 . 4.500 3.408 3.282 3.532 . 0 0 "[ . 1 . 2 .]" 1
1588 1 60 VAL QG 1 72 PHE QE 2.900 . 4.000 3.300 2.347 4.004 0.004 21 0 "[ . 1 . 2 .]" 1
1589 1 60 VAL QG 1 71 LYS HA 3.700 . 5.400 4.443 4.222 4.633 . 0 0 "[ . 1 . 2 .]" 1
1590 1 60 VAL QG 1 73 LYS H 3.400 . 4.800 3.255 2.213 3.777 . 0 0 "[ . 1 . 2 .]" 1
1591 1 60 VAL QG 1 74 ILE H 3.200 . 4.500 2.298 2.082 2.663 . 0 0 "[ . 1 . 2 .]" 1
1592 1 60 VAL QG 1 74 ILE MD 2.400 . 3.100 2.419 2.079 2.963 . 0 0 "[ . 1 . 2 .]" 1
1593 1 61 SER H 1 61 SER HA 3.000 . 4.100 2.872 2.776 2.921 . 0 0 "[ . 1 . 2 .]" 1
1594 1 61 SER H 1 61 SER HA 2.200 . 2.800 2.108 2.077 2.138 . 0 0 "[ . 1 . 2 .]" 1
1595 1 61 SER H 1 61 SER QB 2.500 . 3.300 2.376 2.180 2.593 . 0 0 "[ . 1 . 2 .]" 1
1596 1 61 SER H 1 61 SER QB 2.100 . 2.700 2.331 2.167 2.498 . 0 0 "[ . 1 . 2 .]" 1
1597 1 61 SER H 1 71 LYS HB3 3.200 . 4.500 4.181 4.066 4.292 . 0 0 "[ . 1 . 2 .]" 1
1598 1 61 SER H 1 71 LYS QE 2.800 . 3.800 2.274 2.193 2.377 . 0 0 "[ . 1 . 2 .]" 1
1599 1 61 SER HA 1 61 SER QB 2.500 . 3.300 2.385 2.294 2.502 . 0 0 "[ . 1 . 2 .]" 1
1600 1 61 SER HA 1 62 VAL H 2.200 . 2.800 2.169 2.130 2.202 . 0 0 "[ . 1 . 2 .]" 1
1601 1 61 SER HA 1 62 VAL QG 3.200 . 4.500 3.296 3.174 3.432 . 0 0 "[ . 1 . 2 .]" 1
1602 1 61 SER HA 1 64 ALA MB 3.100 . 4.300 3.076 2.317 4.006 . 0 0 "[ . 1 . 2 .]" 1
1603 1 61 SER HA 1 70 CYS H 3.400 . 4.800 4.743 4.195 4.907 0.107 17 0 "[ . 1 . 2 .]" 1
1604 1 61 SER HA 1 71 LYS HA 2.700 . 3.600 1.836 1.655 2.166 0.145 10 0 "[ . 1 . 2 .]" 1
1605 1 61 SER HA 1 71 LYS QB 3.200 . 4.500 2.947 2.362 3.400 . 0 0 "[ . 1 . 2 .]" 1
1606 1 61 SER HA 1 71 LYS QG 3.400 . 4.800 3.096 2.317 4.192 . 0 0 "[ . 1 . 2 .]" 1
1607 1 61 SER HA 1 72 PHE H 3.100 . 4.300 3.463 3.209 4.059 . 0 0 "[ . 1 . 2 .]" 1
1608 1 61 SER QB 1 62 VAL H 3.100 . 4.300 3.549 3.159 3.870 . 0 0 "[ . 1 . 2 .]" 1
1609 1 61 SER QB 1 71 LYS HA 3.200 . 4.500 3.717 3.435 4.299 . 0 0 "[ . 1 . 2 .]" 1
1610 1 62 VAL H 1 62 VAL HA 2.900 . 4.000 2.939 2.918 2.951 . 0 0 "[ . 1 . 2 .]" 1
1611 1 62 VAL H 1 62 VAL QG 2.300 . 3.000 2.224 2.127 2.340 . 0 0 "[ . 1 . 2 .]" 1
1612 1 62 VAL H 1 62 VAL MG2 2.300 . 3.000 2.285 2.180 2.369 . 0 0 "[ . 1 . 2 .]" 1
1613 1 62 VAL H 1 70 CYS H 2.900 . 4.000 3.126 2.696 3.381 . 0 0 "[ . 1 . 2 .]" 1
1614 1 62 VAL H 1 71 LYS HA 3.000 . 4.100 3.102 2.764 3.421 . 0 0 "[ . 1 . 2 .]" 1
1615 1 62 VAL H 1 71 LYS HA 2.300 . 3.000 2.140 2.059 2.334 . 0 0 "[ . 1 . 2 .]" 1
1616 1 62 VAL HA 1 62 VAL HB 2.500 . 3.300 2.423 2.377 2.497 . 0 0 "[ . 1 . 2 .]" 1
1617 1 62 VAL HA 1 62 VAL MG1 2.600 . 3.400 2.379 2.309 2.447 . 0 0 "[ . 1 . 2 .]" 1
1618 1 62 VAL HA 1 62 VAL QG 2.500 . 3.300 2.318 2.259 2.374 . 0 0 "[ . 1 . 2 .]" 1
1619 1 62 VAL HA 1 62 VAL MG2 2.900 . 4.000 3.133 3.091 3.154 . 0 0 "[ . 1 . 2 .]" 1
1620 1 62 VAL HA 1 63 ASP H 2.200 . 2.800 2.257 2.196 2.327 . 0 0 "[ . 1 . 2 .]" 1
1621 1 62 VAL HA 1 63 ASP HB2 3.500 . 5.000 4.533 4.384 4.857 . 0 0 "[ . 1 . 2 .]" 1
1622 1 62 VAL HB 1 62 VAL QG 2.100 . 2.700 1.893 1.890 1.898 . 0 0 "[ . 1 . 2 .]" 1
1623 1 62 VAL HB 1 63 ASP H 2.400 . 3.100 2.673 2.474 2.943 . 0 0 "[ . 1 . 2 .]" 1
1624 1 62 VAL HB 1 70 CYS H 3.400 . 4.800 2.495 2.198 2.820 . 0 0 "[ . 1 . 2 .]" 1
1625 1 62 VAL QG 1 63 ASP H 2.600 . 3.400 3.229 3.085 3.404 0.004 21 0 "[ . 1 . 2 .]" 1
1626 1 62 VAL QG 1 64 ALA H 3.300 . 4.700 3.754 3.363 4.222 . 0 0 "[ . 1 . 2 .]" 1
1627 1 62 VAL QG 1 72 PHE H 3.500 . 5.000 3.175 2.866 3.489 . 0 0 "[ . 1 . 2 .]" 1
1628 1 62 VAL MG2 1 63 ASP HB2 2.300 . 3.000 2.335 1.811 2.804 . 0 0 "[ . 1 . 2 .]" 1
1629 1 62 VAL MG2 1 64 ALA MB 2.600 . 3.400 2.330 1.518 3.154 0.282 1 0 "[ . 1 . 2 .]" 1
1630 1 62 VAL MG2 1 70 CYS H 2.500 . 3.300 2.940 2.543 3.252 . 0 0 "[ . 1 . 2 .]" 1
1631 1 62 VAL MG2 1 72 PHE QE 2.600 . 3.400 1.850 1.741 2.315 0.059 2 0 "[ . 1 . 2 .]" 1
1632 1 62 VAL MG2 1 87 LYS H 3.600 . 5.200 3.525 2.820 3.791 . 0 0 "[ . 1 . 2 .]" 1
1633 1 63 ASP H 1 63 ASP HA 3.000 . 4.100 2.915 2.875 2.944 . 0 0 "[ . 1 . 2 .]" 1
1634 1 63 ASP H 1 63 ASP HB2 2.500 . 3.300 2.708 2.525 3.007 . 0 0 "[ . 1 . 2 .]" 1
1635 1 63 ASP H 1 63 ASP HB3 2.500 . 3.300 2.559 2.354 2.735 . 0 0 "[ . 1 . 2 .]" 1
1636 1 63 ASP H 1 64 ALA H 2.300 . 3.000 2.539 2.078 2.881 . 0 0 "[ . 1 . 2 .]" 1
1637 1 63 ASP H 1 64 ALA HA 2.700 . 3.600 3.252 2.875 3.502 . 0 0 "[ . 1 . 2 .]" 1
1638 1 63 ASP HA 1 64 ALA H 2.200 . 2.800 2.160 2.114 2.201 . 0 0 "[ . 1 . 2 .]" 1
1639 1 63 ASP HA 1 64 ALA MB 3.200 . 4.500 3.962 3.839 4.015 . 0 0 "[ . 1 . 2 .]" 1
1640 1 63 ASP HA 1 64 ALA MB 2.600 . 3.400 3.409 2.632 3.809 0.409 17 0 "[ . 1 . 2 .]" 1
1641 1 63 ASP HA 1 65 GLY H 3.200 . 4.500 3.689 3.383 4.490 . 0 0 "[ . 1 . 2 .]" 1
1642 1 63 ASP HB2 1 64 ALA H 3.600 . 5.200 3.888 2.950 4.185 . 0 0 "[ . 1 . 2 .]" 1
1643 1 63 ASP HB2 1 64 ALA MB 3.300 . 4.700 3.139 2.017 4.487 . 0 0 "[ . 1 . 2 .]" 1
1644 1 63 ASP HB3 1 64 ALA H 3.700 . 5.400 4.163 3.914 4.352 . 0 0 "[ . 1 . 2 .]" 1
1645 1 64 ALA H 1 64 ALA HA 2.600 . 3.400 2.885 2.818 2.948 . 0 0 "[ . 1 . 2 .]" 1
1646 1 64 ALA H 1 64 ALA MB 2.200 . 2.800 2.282 2.231 2.465 . 0 0 "[ . 1 . 2 .]" 1
1647 1 64 ALA H 1 65 GLY H 2.300 . 3.000 2.557 2.081 2.923 . 0 0 "[ . 1 . 2 .]" 1
1648 1 64 ALA H 1 65 GLY HA3 3.800 . 5.600 4.943 4.549 5.289 . 0 0 "[ . 1 . 2 .]" 1
1649 1 64 ALA H 1 68 GLU H 4.000 . 6.000 4.252 3.691 5.031 . 0 0 "[ . 1 . 2 .]" 1
1650 1 64 ALA H 1 68 GLU HB3 4.000 . 6.000 3.939 2.435 5.697 . 0 0 "[ . 1 . 2 .]" 1
1651 1 64 ALA H 1 69 LYS H 3.500 . 5.000 3.596 2.734 4.176 . 0 0 "[ . 1 . 2 .]" 1
1652 1 64 ALA H 1 69 LYS HA 2.700 . 3.600 3.136 2.655 3.719 0.119 19 0 "[ . 1 . 2 .]" 1
1653 1 64 ALA H 1 69 LYS HG2 3.800 . 5.600 4.651 3.872 5.474 . 0 0 "[ . 1 . 2 .]" 1
1654 1 64 ALA HA 1 64 ALA MB 2.100 . 2.700 2.123 2.113 2.132 . 0 0 "[ . 1 . 2 .]" 1
1655 1 64 ALA HA 1 65 GLY H 2.900 . 4.000 3.279 2.888 3.502 . 0 0 "[ . 1 . 2 .]" 1
1656 1 64 ALA MB 1 65 GLY H 2.800 . 3.800 3.215 2.105 3.644 . 0 0 "[ . 1 . 2 .]" 1
1657 1 64 ALA MB 1 68 GLU HB3 2.200 . 2.800 2.333 1.589 3.077 0.277 24 0 "[ . 1 . 2 .]" 1
1658 1 64 ALA MB 1 68 GLU HB3 2.500 . 3.300 2.356 1.882 3.112 . 0 0 "[ . 1 . 2 .]" 1
1659 1 64 ALA MB 1 68 GLU QG 2.600 . 3.400 2.855 1.593 3.682 0.282 24 0 "[ . 1 . 2 .]" 1
1660 1 64 ALA MB 1 69 LYS H 3.100 . 4.300 3.577 2.951 4.344 0.044 2 0 "[ . 1 . 2 .]" 1
1661 1 64 ALA MB 1 69 LYS HA 3.400 . 4.800 4.060 3.527 4.849 0.049 19 0 "[ . 1 . 2 .]" 1
1662 1 64 ALA MB 1 69 LYS HA 2.600 . 3.400 2.727 2.328 3.244 . 0 0 "[ . 1 . 2 .]" 1
1663 1 64 ALA MB 1 70 CYS H 3.000 . 4.100 3.372 2.955 3.975 . 0 0 "[ . 1 . 2 .]" 1
1664 1 65 GLY H 1 65 GLY HA2 2.400 . 3.100 2.870 2.332 2.958 . 0 0 "[ . 1 . 2 .]" 1
1665 1 65 GLY H 1 65 GLY HA3 2.200 . 2.800 2.454 2.298 2.918 0.118 19 0 "[ . 1 . 2 .]" 1
1666 1 65 GLY H 1 66 ASP H 2.900 . 4.000 3.213 2.310 4.316 0.316 23 0 "[ . 1 . 2 .]" 1
1667 1 65 GLY H 1 69 LYS H 3.100 . 4.300 4.475 4.228 4.773 0.473 19 0 "[ . 1 . 2 .]" 1
1668 1 65 GLY H 1 68 GLU H 3.700 . 5.400 4.396 3.039 4.839 . 0 0 "[ . 1 . 2 .]" 1
1669 1 65 GLY HA2 1 66 ASP H 2.800 . 3.800 2.724 2.098 3.197 . 0 0 "[ . 1 . 2 .]" 1
1670 1 65 GLY HA3 1 66 ASP H 2.600 . 3.400 3.363 2.383 3.542 0.142 22 0 "[ . 1 . 2 .]" 1
1671 1 65 GLY HA3 1 66 ASP HA 3.300 . 4.700 4.641 4.254 4.855 0.155 18 0 "[ . 1 . 2 .]" 1
1672 1 65 GLY HA3 1 67 GLY H 3.200 . 4.500 4.113 3.424 5.340 0.840 19 2 "[ - . 1 . +2 .]" 1
1673 1 66 ASP H 1 66 ASP HA 2.400 . 3.100 2.849 2.280 2.950 . 0 0 "[ . 1 . 2 .]" 1
1674 1 66 ASP H 1 66 ASP HB2 3.300 . 4.700 2.774 2.344 3.880 . 0 0 "[ . 1 . 2 .]" 1
1675 1 66 ASP H 1 66 ASP HB3 3.400 . 4.800 2.821 2.397 3.768 . 0 0 "[ . 1 . 2 .]" 1
1676 1 66 ASP H 1 67 GLY H 2.800 . 3.800 2.576 1.747 3.598 0.053 15 0 "[ . 1 . 2 .]" 1
1677 1 66 ASP H 1 68 GLU H 3.700 . 5.400 3.681 2.852 5.152 . 0 0 "[ . 1 . 2 .]" 1
1678 1 66 ASP HA 1 66 ASP HB2 2.400 . 3.100 2.563 2.359 3.028 . 0 0 "[ . 1 . 2 .]" 1
1679 1 66 ASP HA 1 66 ASP HB3 2.400 . 3.100 2.874 2.482 3.030 . 0 0 "[ . 1 . 2 .]" 1
1680 1 66 ASP HA 1 67 GLY H 2.600 . 3.400 3.266 2.315 3.523 0.123 6 0 "[ . 1 . 2 .]" 1
1681 1 66 ASP HB2 1 67 GLY H 3.600 . 5.200 4.095 3.171 4.587 . 0 0 "[ . 1 . 2 .]" 1
1682 1 66 ASP HB3 1 67 GLY H 3.900 . 5.800 3.467 2.433 4.468 . 0 0 "[ . 1 . 2 .]" 1
1683 1 67 GLY H 1 67 GLY HA2 2.500 . 3.300 2.878 2.507 2.954 . 0 0 "[ . 1 . 2 .]" 1
1684 1 67 GLY H 1 67 GLY HA3 2.300 . 3.000 2.570 2.331 2.956 . 0 0 "[ . 1 . 2 .]" 1
1685 1 67 GLY H 1 68 GLU H 2.500 . 3.300 2.266 1.720 2.972 . 0 0 "[ . 1 . 2 .]" 1
1686 1 67 GLY HA3 1 68 GLU H 2.800 . 3.800 3.424 3.194 3.521 . 0 0 "[ . 1 . 2 .]" 1
1687 1 68 GLU H 1 68 GLU HA 2.600 . 3.400 2.851 2.792 2.944 . 0 0 "[ . 1 . 2 .]" 1
1688 1 68 GLU H 1 68 GLU HB3 2.500 . 3.300 3.173 2.221 3.668 0.368 21 0 "[ . 1 . 2 .]" 1
1689 1 68 GLU H 1 68 GLU QG 2.600 . 3.400 2.710 1.632 3.973 0.573 25 1 "[ . 1 . 2 +]" 1
1690 1 68 GLU H 1 69 LYS H 3.800 . 5.600 4.524 3.935 4.619 . 0 0 "[ . 1 . 2 .]" 1
1691 1 68 GLU HA 1 68 GLU HB2 2.700 . 3.600 2.785 2.302 3.020 . 0 0 "[ . 1 . 2 .]" 1
1692 1 68 GLU HA 1 68 GLU HB2 2.200 . 2.800 2.208 1.967 2.354 . 0 0 "[ . 1 . 2 .]" 1
1693 1 68 GLU HA 1 68 GLU HB3 2.700 . 3.600 2.596 2.305 3.015 . 0 0 "[ . 1 . 2 .]" 1
1694 1 68 GLU HA 1 68 GLU QG 2.300 . 3.000 2.657 2.175 3.312 0.312 18 0 "[ . 1 . 2 .]" 1
1695 1 68 GLU HA 1 69 LYS H 2.100 . 2.700 2.264 2.080 2.527 . 0 0 "[ . 1 . 2 .]" 1
1696 1 68 GLU HA 1 89 ARG QB 2.400 . 3.100 2.272 2.085 2.429 . 0 0 "[ . 1 . 2 .]" 1
1697 1 68 GLU HA 1 89 ARG QB 2.500 . 3.300 2.341 2.099 2.461 . 0 0 "[ . 1 . 2 .]" 1
1698 1 68 GLU HA 1 90 LYS QG 2.500 . 3.300 2.411 1.554 3.259 0.146 12 0 "[ . 1 . 2 .]" 1
1699 1 68 GLU HB2 1 68 GLU HB3 1.700 . 2.200 1.705 1.677 1.722 . 0 0 "[ . 1 . 2 .]" 1
1700 1 68 GLU HB2 1 68 GLU QG 1.900 . 2.400 2.320 2.142 2.463 0.063 23 0 "[ . 1 . 2 .]" 1
1701 1 68 GLU HB2 1 69 LYS H 3.200 . 4.500 3.626 2.311 4.379 . 0 0 "[ . 1 . 2 .]" 1
1702 1 68 GLU HB2 1 69 LYS H 3.000 . 4.100 3.220 2.304 3.860 . 0 0 "[ . 1 . 2 .]" 1
1703 1 68 GLU HB3 1 69 LYS H 2.700 . 3.600 2.852 1.888 3.654 0.054 2 0 "[ . 1 . 2 .]" 1
1704 1 68 GLU HB3 1 88 CYS HB2 2.800 . 3.800 3.602 2.869 4.075 0.275 20 0 "[ . 1 . 2 .]" 1
1705 1 68 GLU HB3 1 69 LYS H 2.800 . 3.800 3.221 2.116 4.105 0.305 9 0 "[ . 1 . 2 .]" 1
1706 1 68 GLU QG 1 69 LYS H 2.800 . 3.800 3.484 1.922 4.184 0.384 2 0 "[ . 1 . 2 .]" 1
1707 1 68 GLU QG 1 88 CYS HB3 2.700 . 3.600 2.966 1.837 3.584 . 0 0 "[ . 1 . 2 .]" 1
1708 1 69 LYS H 1 69 LYS HA 2.900 . 4.000 2.913 2.852 2.936 . 0 0 "[ . 1 . 2 .]" 1
1709 1 69 LYS H 1 69 LYS HA 2.100 . 2.700 2.092 2.033 2.196 . 0 0 "[ . 1 . 2 .]" 1
1710 1 69 LYS H 1 69 LYS HB2 2.600 . 3.400 2.663 2.295 3.243 . 0 0 "[ . 1 . 2 .]" 1
1711 1 69 LYS H 1 69 LYS HB2 2.800 . 3.800 2.499 2.147 3.038 . 0 0 "[ . 1 . 2 .]" 1
1712 1 69 LYS H 1 69 LYS HB3 3.000 . 4.100 3.401 2.598 3.897 . 0 0 "[ . 1 . 2 .]" 1
1713 1 69 LYS H 1 69 LYS HB3 2.500 . 3.300 3.044 2.576 3.433 0.133 1 0 "[ . 1 . 2 .]" 1
1714 1 69 LYS H 1 69 LYS HG2 2.700 . 3.600 1.956 1.533 2.660 0.267 16 0 "[ . 1 . 2 .]" 1
1715 1 69 LYS H 1 69 LYS HG2 3.100 . 4.300 1.975 1.533 2.830 0.367 16 0 "[ . 1 . 2 .]" 1
1716 1 69 LYS H 1 89 ARG H 3.100 . 4.300 4.331 3.916 4.644 0.344 25 0 "[ . 1 . 2 .]" 1
1717 1 69 LYS H 1 90 LYS QG 2.700 . 3.600 1.981 1.538 2.855 0.262 16 0 "[ . 1 . 2 .]" 1
1718 1 69 LYS HA 1 69 LYS HB2 2.700 . 3.600 2.851 2.426 3.026 . 0 0 "[ . 1 . 2 .]" 1
1719 1 69 LYS HA 1 69 LYS HB3 2.600 . 3.400 2.680 2.452 3.033 . 0 0 "[ . 1 . 2 .]" 1
1720 1 69 LYS HA 1 69 LYS HG2 3.100 . 4.300 2.688 2.411 3.166 . 0 0 "[ . 1 . 2 .]" 1
1721 1 69 LYS HA 1 70 CYS H 2.100 . 2.700 2.144 2.074 2.271 . 0 0 "[ . 1 . 2 .]" 1
1722 1 69 LYS HA 1 90 LYS QG 2.900 . 4.000 4.080 3.880 4.259 0.259 7 0 "[ . 1 . 2 .]" 1
1723 1 69 LYS HB2 1 69 LYS HG2 2.300 . 3.000 2.439 1.892 2.916 . 0 0 "[ . 1 . 2 .]" 1
1724 1 69 LYS HB2 1 90 LYS HA 2.400 . 3.100 2.165 1.526 2.924 0.174 19 0 "[ . 1 . 2 .]" 1
1725 1 69 LYS HB3 1 69 LYS HG2 2.300 . 3.000 2.376 2.040 2.957 . 0 0 "[ . 1 . 2 .]" 1
1726 1 69 LYS HB3 1 69 LYS HG3 2.600 . 3.400 2.766 2.145 2.968 . 0 0 "[ . 1 . 2 .]" 1
1727 1 69 LYS QD 1 69 LYS HE3 2.500 . 3.300 2.320 2.157 2.394 . 0 0 "[ . 1 . 2 .]" 1
1728 1 69 LYS HD2 1 69 LYS HE3 2.600 . 3.400 2.554 2.302 3.014 . 0 0 "[ . 1 . 2 .]" 1
1729 1 69 LYS HD2 1 69 LYS HG3 2.000 . 2.500 2.567 2.382 3.019 0.519 2 6 "[ + *. 1- . 2 * **]" 1
1730 1 69 LYS HD3 1 69 LYS QE 2.500 . 3.300 2.313 2.169 2.452 . 0 0 "[ . 1 . 2 .]" 1
1731 1 69 LYS HD3 1 69 LYS HE2 2.400 . 3.100 2.413 1.805 2.909 . 0 0 "[ . 1 . 2 .]" 1
1732 1 69 LYS HG2 1 70 CYS H 3.500 . 5.000 3.869 2.455 4.588 . 0 0 "[ . 1 . 2 .]" 1
1733 1 70 CYS H 1 70 CYS HA 3.000 . 4.100 2.939 2.905 2.963 . 0 0 "[ . 1 . 2 .]" 1
1734 1 70 CYS H 1 70 CYS QB 3.000 . 3.600 2.501 2.200 2.838 . 0 0 "[ . 1 . 2 .]" 1
1735 1 70 CYS H 1 71 LYS H 3.600 . 5.200 4.400 4.197 4.513 . 0 0 "[ . 1 . 2 .]" 1
1736 1 70 CYS HA 1 70 CYS QB 3.000 . 3.800 2.392 2.256 2.533 . 0 0 "[ . 1 . 2 .]" 1
1737 1 70 CYS HA 1 71 LYS H 2.400 . 3.100 2.266 2.075 2.539 . 0 0 "[ . 1 . 2 .]" 1
1738 1 70 CYS HA 1 87 LYS H 4.000 . 6.000 5.450 4.362 6.092 0.092 25 0 "[ . 1 . 2 .]" 1
1739 1 70 CYS HA 1 88 CYS HB2 3.100 . 4.300 3.891 3.382 4.466 0.166 10 0 "[ . 1 . 2 .]" 1
1740 1 70 CYS HA 1 88 CYS HB3 3.100 . 4.300 2.664 1.829 4.279 0.071 11 0 "[ . 1 . 2 .]" 1
1741 1 70 CYS HA 1 89 ARG H 3.200 . 4.500 3.070 2.068 4.494 . 0 0 "[ . 1 . 2 .]" 1
1742 1 70 CYS HA 1 98 TYR QE 3.700 . 5.400 5.663 5.130 6.060 0.660 16 2 "[ . 1 .+ 2 -.]" 1
1743 1 70 CYS QB 1 71 LYS H 2.700 . 3.600 3.130 2.615 3.556 . 0 0 "[ . 1 . 2 .]" 1
1744 1 70 CYS QB 1 72 PHE QE 3.600 . 4.800 3.147 2.216 3.913 . 0 0 "[ . 1 . 2 .]" 1
1745 1 71 LYS H 1 71 LYS HB2 2.700 . 3.600 3.076 2.666 3.471 . 0 0 "[ . 1 . 2 .]" 1
1746 1 71 LYS H 1 71 LYS QB 2.700 . 3.600 2.504 2.281 2.802 . 0 0 "[ . 1 . 2 .]" 1
1747 1 71 LYS H 1 71 LYS HB3 2.900 . 4.000 2.659 2.376 2.981 . 0 0 "[ . 1 . 2 .]" 1
1748 1 71 LYS H 1 87 LYS H 3.000 . 4.100 3.889 2.841 4.421 0.321 11 0 "[ . 1 . 2 .]" 1
1749 1 71 LYS HA 1 71 LYS HB2 2.900 . 4.000 2.458 2.362 2.565 . 0 0 "[ . 1 . 2 .]" 1
1750 1 71 LYS HA 1 71 LYS HB3 2.900 . 4.000 3.028 3.005 3.037 . 0 0 "[ . 1 . 2 .]" 1
1751 1 71 LYS HA 1 71 LYS QG 2.900 . 4.000 2.515 2.339 2.755 . 0 0 "[ . 1 . 2 .]" 1
1752 1 71 LYS HA 1 72 PHE H 2.300 . 3.000 2.183 2.099 2.381 . 0 0 "[ . 1 . 2 .]" 1
1753 1 71 LYS HA 1 72 PHE QD 3.400 . 4.800 3.942 3.178 4.381 . 0 0 "[ . 1 . 2 .]" 1
1754 1 71 LYS QB 1 71 LYS QG 2.200 . 2.800 2.067 2.015 2.082 . 0 0 "[ . 1 . 2 .]" 1
1755 1 71 LYS HB2 1 71 LYS QD 2.300 . 3.000 2.794 2.372 3.119 0.119 19 0 "[ . 1 . 2 .]" 1
1756 1 71 LYS HB2 1 71 LYS QE 2.900 . 4.000 1.986 1.540 2.850 0.260 11 0 "[ . 1 . 2 .]" 1
1757 1 71 LYS HB2 1 71 LYS QG 2.200 . 2.800 2.345 2.227 2.481 . 0 0 "[ . 1 . 2 .]" 1
1758 1 71 LYS HB2 1 98 TYR QE 3.500 . 5.000 3.089 2.438 4.812 . 0 0 "[ . 1 . 2 .]" 1
1759 1 71 LYS HB3 1 71 LYS QE 2.900 . 4.000 2.747 1.952 3.712 . 0 0 "[ . 1 . 2 .]" 1
1760 1 71 LYS HB3 1 71 LYS QG 2.200 . 2.800 2.313 2.135 2.440 . 0 0 "[ . 1 . 2 .]" 1
1761 1 71 LYS HB3 1 98 TYR QE 3.600 . 5.200 2.550 1.791 4.839 0.209 20 0 "[ . 1 . 2 .]" 1
1762 1 71 LYS HB3 1 87 LYS QB 2.900 . 4.000 3.251 1.320 4.009 0.480 5 0 "[ . 1 . 2 .]" 1
1763 1 71 LYS HB3 1 88 CYS HB2 2.900 . 4.000 4.214 3.822 4.466 0.466 8 0 "[ . 1 . 2 .]" 1
1764 1 71 LYS HB3 1 88 CYS HB3 2.900 . 4.000 3.899 3.291 4.319 0.319 1 0 "[ . 1 . 2 .]" 1
1765 1 71 LYS HB3 1 89 ARG QD 2.400 . 3.100 2.161 1.980 2.468 . 0 0 "[ . 1 . 2 .]" 1
1766 1 71 LYS QD 1 71 LYS QE 2.200 . 2.800 2.075 2.005 2.090 . 0 0 "[ . 1 . 2 .]" 1
1767 1 71 LYS QD 1 71 LYS QG 1.900 . 2.400 2.006 1.987 2.024 . 0 0 "[ . 1 . 2 .]" 1
1768 1 71 LYS QD 1 98 TYR QD 3.400 . 4.800 2.176 1.376 2.863 0.624 8 1 "[ . + 1 . 2 .]" 1
1769 1 71 LYS HD3 1 98 TYR QE 3.500 . 5.000 2.686 1.283 3.269 0.717 10 1 "[ . + . 2 .]" 1
1770 1 71 LYS QE 1 71 LYS QG 2.300 . 3.000 2.145 1.925 2.471 . 0 0 "[ . 1 . 2 .]" 1
1771 1 71 LYS QE 1 71 LYS QG 2.700 . 3.600 2.047 1.928 2.233 . 0 0 "[ . 1 . 2 .]" 1
1772 1 71 LYS QE 1 72 PHE H 3.000 . 4.100 2.286 2.202 2.384 . 0 0 "[ . 1 . 2 .]" 1
1773 1 71 LYS QE 1 98 TYR QE 3.500 . 5.000 3.052 1.975 3.915 0.025 13 0 "[ . 1 . 2 .]" 1
1774 1 71 LYS QE 1 98 TYR QE 3.500 . 5.000 3.625 2.023 4.593 . 0 0 "[ . 1 . 2 .]" 1
1775 1 71 LYS QE 1 89 ARG QB 3.100 . 4.300 2.531 1.675 3.522 0.225 24 0 "[ . 1 . 2 .]" 1
1776 1 71 LYS QG 1 72 PHE H 3.200 . 4.500 3.375 2.987 3.876 . 0 0 "[ . 1 . 2 .]" 1
1777 1 71 LYS QG 1 87 LYS H 3.600 . 5.200 4.744 4.127 5.246 0.046 11 0 "[ . 1 . 2 .]" 1
1778 1 71 LYS QG 1 87 LYS H 3.500 . 5.000 3.638 2.646 4.097 . 0 0 "[ . 1 . 2 .]" 1
1779 1 72 PHE H 1 72 PHE QB 2.800 . 3.800 2.288 2.203 2.386 . 0 0 "[ . 1 . 2 .]" 1
1780 1 72 PHE H 1 72 PHE QD 3.400 . 4.800 2.376 2.038 2.682 . 0 0 "[ . 1 . 2 .]" 1
1781 1 72 PHE HA 1 73 LYS H 2.300 . 3.000 2.106 2.028 2.199 . 0 0 "[ . 1 . 2 .]" 1
1782 1 72 PHE QB 1 72 PHE QD 3.100 . 4.300 2.122 2.113 2.130 . 0 0 "[ . 1 . 2 .]" 1
1783 1 72 PHE QB 1 73 LYS H 3.100 . 4.300 3.340 3.098 3.640 . 0 0 "[ . 1 . 2 .]" 1
1784 1 72 PHE QB 1 74 ILE MD 2.800 . 3.800 2.943 2.520 3.409 . 0 0 "[ . 1 . 2 .]" 1
1785 1 73 LYS H 1 73 LYS QB 2.600 . 3.400 2.256 2.070 2.370 . 0 0 "[ . 1 . 2 .]" 1
1786 1 73 LYS H 1 83 MET QB 2.800 . 3.800 2.489 2.044 3.290 . 0 0 "[ . 1 . 2 .]" 1
1787 1 73 LYS HA 1 74 ILE H 2.300 . 3.000 2.161 2.040 2.282 . 0 0 "[ . 1 . 2 .]" 1
1788 1 73 LYS QB 1 73 LYS QD 2.300 . 3.000 1.948 1.881 2.038 . 0 0 "[ . 1 . 2 .]" 1
1789 1 73 LYS QB 1 73 LYS QD 2.500 . 3.300 2.040 1.985 2.181 . 0 0 "[ . 1 . 2 .]" 1
1790 1 73 LYS QB 1 73 LYS HG2 2.400 . 3.100 2.210 2.082 2.431 . 0 0 "[ . 1 . 2 .]" 1
1791 1 73 LYS QB 1 73 LYS HG3 2.500 . 3.300 2.223 2.035 2.452 . 0 0 "[ . 1 . 2 .]" 1
1792 1 73 LYS QB 1 98 TYR QE 3.400 . 4.800 3.803 2.338 5.100 0.300 1 0 "[ . 1 . 2 .]" 1
1793 1 73 LYS QB 1 73 LYS HG2 2.500 . 3.300 2.316 2.204 2.493 . 0 0 "[ . 1 . 2 .]" 1
1794 1 73 LYS QD 1 73 LYS HE2 2.600 . 3.400 2.290 2.149 2.469 . 0 0 "[ . 1 . 2 .]" 1
1795 1 73 LYS QD 1 73 LYS HE2 2.400 . 3.100 2.078 1.675 2.423 0.025 6 0 "[ . 1 . 2 .]" 1
1796 1 73 LYS QD 1 73 LYS HE3 2.400 . 3.100 2.175 1.662 2.406 0.038 9 0 "[ . 1 . 2 .]" 1
1797 1 73 LYS QD 1 73 LYS HG2 2.400 . 3.000 2.347 2.160 2.437 . 0 0 "[ . 1 . 2 .]" 1
1798 1 73 LYS QD 1 73 LYS QG 2.300 . 3.000 2.084 2.011 2.096 . 0 0 "[ . 1 . 2 .]" 1
1799 1 73 LYS QD 1 75 ARG HB3 2.400 . 3.100 2.516 1.933 3.020 . 0 0 "[ . 1 . 2 .]" 1
1800 1 73 LYS QD 1 83 MET HA 3.500 . 4.700 3.152 1.730 4.721 0.270 2 0 "[ . 1 . 2 .]" 1
1801 1 73 LYS QD 1 87 LYS QB 2.900 . 4.000 4.097 2.938 4.494 0.494 17 0 "[ . 1 . 2 .]" 1
1802 1 73 LYS HE2 1 73 LYS HG2 2.600 . 3.400 2.975 2.422 3.737 0.337 9 0 "[ . 1 . 2 .]" 1
1803 1 73 LYS HE2 1 75 ARG QD 2.100 . 2.700 2.342 2.299 2.408 . 0 0 "[ . 1 . 2 .]" 1
1804 1 73 LYS HE2 1 98 TYR HA 2.700 . 3.600 3.156 1.738 4.331 0.731 2 1 "[ + . 1 . 2 .]" 1
1805 1 73 LYS HE3 1 73 LYS QG 2.700 . 3.600 2.529 2.157 3.399 . 0 0 "[ . 1 . 2 .]" 1
1806 1 73 LYS HE3 1 75 ARG QD 2.200 . 2.800 2.293 2.152 2.386 . 0 0 "[ . 1 . 2 .]" 1
1807 1 73 LYS HG2 1 76 LYS QE 2.500 . 3.300 2.135 2.071 2.297 . 0 0 "[ . 1 . 2 .]" 1
1808 1 73 LYS HG2 1 84 VAL QG 2.300 . 3.000 2.013 1.842 2.354 . 0 0 "[ . 1 . 2 .]" 1
1809 1 74 ILE H 1 74 ILE HB 2.800 . 3.800 2.509 2.298 2.751 . 0 0 "[ . 1 . 2 .]" 1
1810 1 74 ILE H 1 74 ILE MD 3.100 . 4.300 3.619 3.250 4.141 . 0 0 "[ . 1 . 2 .]" 1
1811 1 74 ILE H 1 74 ILE QG 3.000 . 4.100 2.357 2.106 2.839 . 0 0 "[ . 1 . 2 .]" 1
1812 1 74 ILE H 1 74 ILE MG 2.900 . 4.000 3.775 3.675 3.900 . 0 0 "[ . 1 . 2 .]" 1
1813 1 74 ILE HA 1 74 ILE MD 3.200 . 4.500 3.851 3.784 3.927 . 0 0 "[ . 1 . 2 .]" 1
1814 1 74 ILE HA 1 74 ILE QG 2.900 . 4.000 2.416 2.289 2.533 . 0 0 "[ . 1 . 2 .]" 1
1815 1 74 ILE HA 1 74 ILE MG 2.700 . 3.600 2.405 2.340 2.562 . 0 0 "[ . 1 . 2 .]" 1
1816 1 74 ILE HA 1 75 ARG H 3.400 . 4.800 2.193 2.098 2.363 . 0 0 "[ . 1 . 2 .]" 1
1817 1 74 ILE HB 1 74 ILE MD 2.600 . 3.400 2.391 2.304 2.482 . 0 0 "[ . 1 . 2 .]" 1
1818 1 74 ILE HB 1 74 ILE MG 2.300 . 3.000 2.129 2.125 2.134 . 0 0 "[ . 1 . 2 .]" 1
1819 1 74 ILE HB 1 76 LYS HA 3.200 . 4.500 4.490 3.631 4.780 0.280 20 0 "[ . 1 . 2 .]" 1
1820 1 74 ILE MD 1 74 ILE QG 2.000 . 2.500 1.733 1.679 1.789 . 0 0 "[ . 1 . 2 .]" 1
1821 1 74 ILE MD 1 74 ILE MG 2.500 . 3.300 2.019 1.887 2.216 . 0 0 "[ . 1 . 2 .]" 1
1822 1 74 ILE MD 1 83 MET ME 2.600 . 3.400 3.323 2.286 3.701 0.301 5 0 "[ . 1 . 2 .]" 1
1823 1 74 ILE QG 1 75 ARG H 3.800 . 5.600 2.358 1.940 2.695 0.060 19 0 "[ . 1 . 2 .]" 1
1824 1 74 ILE QG 1 83 MET HA 3.200 . 4.500 3.898 2.781 4.426 . 0 0 "[ . 1 . 2 .]" 1
1825 1 74 ILE QG 1 83 MET QB 2.900 . 4.000 2.546 1.943 3.560 . 0 0 "[ . 1 . 2 .]" 1
1826 1 74 ILE MG 1 75 ARG H 2.900 . 4.000 3.264 2.503 3.722 . 0 0 "[ . 1 . 2 .]" 1
1827 1 74 ILE MG 1 82 LYS H 3.500 . 5.000 2.646 1.964 4.266 0.036 22 0 "[ . 1 . 2 .]" 1
1828 1 74 ILE MG 1 83 MET HA 3.400 . 4.800 2.959 2.080 3.889 . 0 0 "[ . 1 . 2 .]" 1
1829 1 75 ARG H 1 75 ARG HB2 3.000 . 4.100 2.357 2.133 2.570 . 0 0 "[ . 1 . 2 .]" 1
1830 1 75 ARG H 1 75 ARG HB3 3.300 . 4.700 2.721 2.535 2.914 . 0 0 "[ . 1 . 2 .]" 1
1831 1 75 ARG H 1 84 VAL QG 2.900 . 4.000 2.488 1.953 3.165 . 0 0 "[ . 1 . 2 .]" 1
1832 1 75 ARG HA 1 75 ARG HB2 2.900 . 4.000 2.582 2.509 2.713 . 0 0 "[ . 1 . 2 .]" 1
1833 1 75 ARG HA 1 75 ARG QD 3.100 . 4.300 3.443 3.063 3.905 . 0 0 "[ . 1 . 2 .]" 1
1834 1 75 ARG HA 1 75 ARG HG3 3.100 . 4.300 2.348 2.190 2.486 . 0 0 "[ . 1 . 2 .]" 1
1835 1 75 ARG HA 1 75 ARG HG3 2.900 . 4.000 2.338 2.180 2.472 . 0 0 "[ . 1 . 2 .]" 1
1836 1 75 ARG HA 1 76 LYS H 2.600 . 3.400 2.399 2.088 3.103 . 0 0 "[ . 1 . 2 .]" 1
1837 1 75 ARG HA 1 84 VAL QG 2.300 . 3.000 2.244 2.157 2.306 . 0 0 "[ . 1 . 2 .]" 1
1838 1 75 ARG HB2 1 75 ARG QD 2.300 . 3.000 2.268 2.177 2.383 . 0 0 "[ . 1 . 2 .]" 1
1839 1 75 ARG HB3 1 75 ARG QD 2.500 . 3.300 2.650 2.434 3.134 . 0 0 "[ . 1 . 2 .]" 1
1840 1 75 ARG HB3 1 75 ARG HG2 2.300 . 3.000 2.330 2.269 2.391 . 0 0 "[ . 1 . 2 .]" 1
1841 1 75 ARG HB3 1 75 ARG HG3 2.700 . 3.600 2.993 2.960 3.009 . 0 0 "[ . 1 . 2 .]" 1
1842 1 75 ARG HB3 1 82 LYS H 2.800 . 3.800 3.751 2.551 4.230 0.430 13 0 "[ . 1 . 2 .]" 1
1843 1 75 ARG QD 1 75 ARG HG2 2.500 . 3.300 2.354 2.307 2.409 . 0 0 "[ . 1 . 2 .]" 1
1844 1 75 ARG QD 1 75 ARG HG3 2.500 . 3.300 2.301 2.171 2.389 . 0 0 "[ . 1 . 2 .]" 1
1845 1 75 ARG QD 1 78 VAL QG 3.300 . 4.700 3.403 1.947 4.243 . 0 0 "[ . 1 . 2 .]" 1
1846 1 75 ARG QD 1 78 VAL QG 3.400 . 4.800 2.814 1.946 3.624 0.054 19 0 "[ . 1 . 2 .]" 1
1847 1 75 ARG QD 1 84 VAL QG 2.500 . 3.300 2.040 1.682 2.480 0.018 23 0 "[ . 1 . 2 .]" 1
1848 1 75 ARG QD 1 98 TYR H 4.000 . 6.000 6.148 5.935 6.317 0.317 6 0 "[ . 1 . 2 .]" 1
1849 1 76 LYS H 1 76 LYS QG 2.900 . 4.000 2.260 1.525 2.866 0.275 3 0 "[ . 1 . 2 .]" 1
1850 1 76 LYS HA 1 76 LYS QB 3.000 . 4.100 2.328 2.170 2.445 . 0 0 "[ . 1 . 2 .]" 1
1851 1 76 LYS HA 1 76 LYS QD 3.200 . 4.500 4.001 3.344 4.445 . 0 0 "[ . 1 . 2 .]" 1
1852 1 76 LYS HA 1 76 LYS QG 2.800 . 3.800 2.545 2.081 3.342 . 0 0 "[ . 1 . 2 .]" 1
1853 1 76 LYS HA 1 77 ASP H 2.800 . 3.800 2.541 2.067 3.545 . 0 0 "[ . 1 . 2 .]" 1
1854 1 76 LYS QB 1 76 LYS QD 2.800 . 3.400 2.130 2.062 2.221 . 0 0 "[ . 1 . 2 .]" 1
1855 1 76 LYS QB 1 76 LYS QE 3.300 . 4.700 3.172 1.952 3.502 0.048 20 0 "[ . 1 . 2 .]" 1
1856 1 76 LYS QD 1 76 LYS QG 2.300 . 3.000 2.082 2.011 2.095 . 0 0 "[ . 1 . 2 .]" 1
1857 1 76 LYS QE 1 76 LYS QG 2.300 . 3.000 2.139 2.075 2.304 . 0 0 "[ . 1 . 2 .]" 1
1858 1 77 ASP H 1 77 ASP QB 3.300 . 4.700 2.386 2.172 3.246 . 0 0 "[ . 1 . 2 .]" 1
1859 1 77 ASP H 1 77 ASP QB 3.000 . 4.100 2.357 2.158 3.071 . 0 0 "[ . 1 . 2 .]" 1
1860 1 77 ASP H 1 79 ASP H 3.400 . 4.800 3.298 2.116 4.406 . 0 0 "[ . 1 . 2 .]" 1
1861 1 77 ASP HA 1 78 VAL H 3.200 . 4.500 2.584 2.157 3.168 . 0 0 "[ . 1 . 2 .]" 1
1862 1 77 ASP HA 1 80 VAL QG 2.600 . 3.400 2.290 2.030 2.401 . 0 0 "[ . 1 . 2 .]" 1
1863 1 77 ASP HA 1 81 PRO HG2 3.400 . 4.800 4.389 4.091 4.738 . 0 0 "[ . 1 . 2 .]" 1
1864 1 77 ASP QB 1 79 ASP H 3.900 . 5.800 4.738 3.842 5.537 . 0 0 "[ . 1 . 2 .]" 1
1865 1 77 ASP QB 1 80 VAL H 2.800 . 3.800 3.098 2.277 3.840 0.040 13 0 "[ . 1 . 2 .]" 1
1866 1 77 ASP QB 1 82 LYS H 4.200 . 6.000 5.289 3.877 6.121 0.121 19 0 "[ . 1 . 2 .]" 1
1867 1 78 VAL H 1 78 VAL HB 3.400 . 4.800 3.331 2.065 3.833 . 0 0 "[ . 1 . 2 .]" 1
1868 1 78 VAL H 1 78 VAL QG 3.000 . 4.100 1.960 1.806 2.443 0.094 4 0 "[ . 1 . 2 .]" 1
1869 1 78 VAL HA 1 78 VAL HB 2.700 . 3.600 2.534 2.358 3.021 . 0 0 "[ . 1 . 2 .]" 1
1870 1 78 VAL HA 1 78 VAL QG 2.500 . 3.300 2.264 2.120 2.395 . 0 0 "[ . 1 . 2 .]" 1
1871 1 78 VAL HA 1 79 ASP H 3.100 . 4.300 2.626 2.069 3.389 . 0 0 "[ . 1 . 2 .]" 1
1872 1 78 VAL HB 1 78 VAL QG 1.800 . 2.200 1.573 1.556 1.577 . 0 0 "[ . 1 . 2 .]" 1
1873 1 78 VAL HB 1 79 ASP H 3.000 . 4.100 4.021 3.354 4.324 0.224 14 0 "[ . 1 . 2 .]" 1
1874 1 78 VAL QG 1 81 PRO HA 2.900 . 4.000 3.848 3.439 4.385 0.385 20 0 "[ . 1 . 2 .]" 1
1875 1 79 ASP H 1 79 ASP QB 2.700 . 3.600 3.085 2.878 3.448 . 0 0 "[ . 1 . 2 .]" 1
1876 1 79 ASP HA 1 79 ASP QB 2.300 . 3.000 2.370 2.335 2.407 . 0 0 "[ . 1 . 2 .]" 1
1877 1 79 ASP QB 1 80 VAL H 2.700 . 3.600 2.019 1.708 2.584 0.092 6 0 "[ . 1 . 2 .]" 1
1878 1 79 ASP QB 1 80 VAL HA 1.900 . 2.400 1.954 1.864 2.056 . 0 0 "[ . 1 . 2 .]" 1
1879 1 79 ASP QB 1 80 VAL QG 2.500 . 3.300 2.918 2.040 3.456 0.156 18 0 "[ . 1 . 2 .]" 1
1880 1 80 VAL H 1 80 VAL HB 3.300 . 4.700 3.378 2.706 3.880 . 0 0 "[ . 1 . 2 .]" 1
1881 1 80 VAL H 1 80 VAL QG 4.000 . 6.000 2.088 1.901 3.259 0.099 24 0 "[ . 1 . 2 .]" 1
1882 1 80 VAL HA 1 80 VAL HB 2.500 . 3.300 2.468 2.372 2.746 . 0 0 "[ . 1 . 2 .]" 1
1883 1 80 VAL HA 1 80 VAL QG 2.400 . 3.100 2.303 2.038 2.426 . 0 0 "[ . 1 . 2 .]" 1
1884 1 80 VAL HA 1 81 PRO QD 1.900 . 2.400 1.961 1.827 2.161 . 0 0 "[ . 1 . 2 .]" 1
1885 1 80 VAL HA 1 81 PRO HG3 3.500 . 5.000 4.295 4.109 4.494 . 0 0 "[ . 1 . 2 .]" 1
1886 1 80 VAL HB 1 80 VAL QG 2.000 . 2.500 1.891 1.881 1.897 . 0 0 "[ . 1 . 2 .]" 1
1887 1 80 VAL HB 1 80 VAL QG 1.800 . 2.200 1.683 1.664 1.689 . 0 0 "[ . 1 . 2 .]" 1
1888 1 80 VAL HB 1 81 PRO QD 2.600 . 3.400 2.804 1.811 3.635 0.235 18 0 "[ . 1 . 2 .]" 1
1889 1 80 VAL HB 1 81 PRO QD 2.100 . 2.700 2.038 1.726 2.172 . 0 0 "[ . 1 . 2 .]" 1
1890 1 80 VAL MG1 1 80 VAL MG2 2.000 . 2.500 2.078 2.040 2.098 . 0 0 "[ . 1 . 2 .]" 1
1891 1 80 VAL QG 1 81 PRO QD 2.700 . 3.600 2.357 1.700 3.014 0.100 18 0 "[ . 1 . 2 .]" 1
1892 1 80 VAL QG 1 82 LYS H 3.400 . 4.800 2.668 1.965 4.431 0.035 22 0 "[ . 1 . 2 .]" 1
1893 1 80 VAL QG 1 82 LYS HA 3.500 . 5.000 4.369 3.704 5.175 0.175 3 0 "[ . 1 . 2 .]" 1
1894 1 80 VAL QG 1 82 LYS HB3 3.300 . 4.700 3.692 2.679 5.066 0.366 3 0 "[ . 1 . 2 .]" 1
1895 1 80 VAL QG 1 82 LYS QE 3.100 . 4.300 3.058 2.188 4.019 . 0 0 "[ . 1 . 2 .]" 1
1896 1 81 PRO HA 1 81 PRO HB3 2.700 . 3.600 2.324 2.263 2.361 . 0 0 "[ . 1 . 2 .]" 1
1897 1 81 PRO HB2 1 81 PRO QD 2.700 . 3.600 3.516 3.267 3.545 . 0 0 "[ . 1 . 2 .]" 1
1898 1 81 PRO HB2 1 81 PRO HG2 2.200 . 2.800 2.305 2.231 2.353 . 0 0 "[ . 1 . 2 .]" 1
1899 1 81 PRO HB2 1 81 PRO HG3 2.200 . 2.800 2.662 2.604 2.858 0.058 3 0 "[ . 1 . 2 .]" 1
1900 1 81 PRO HB3 1 81 PRO QD 2.800 . 3.800 2.956 2.735 3.422 . 0 0 "[ . 1 . 2 .]" 1
1901 1 81 PRO HB3 1 81 PRO HG2 2.400 . 3.100 2.981 2.835 3.005 . 0 0 "[ . 1 . 2 .]" 1
1902 1 81 PRO HB3 1 81 PRO HG3 2.500 . 3.300 2.322 2.241 2.359 . 0 0 "[ . 1 . 2 .]" 1
1903 1 81 PRO HB3 1 82 LYS H 3.800 . 5.600 4.464 3.138 4.700 . 0 0 "[ . 1 . 2 .]" 1
1904 1 81 PRO QD 1 81 PRO HG2 2.200 . 2.800 2.205 2.163 2.243 . 0 0 "[ . 1 . 2 .]" 1
1905 1 81 PRO HG2 1 82 LYS QG 2.800 . 3.800 3.745 2.811 4.025 0.225 7 0 "[ . 1 . 2 .]" 1
1906 1 82 LYS H 1 82 LYS HB2 3.300 . 4.700 3.112 2.310 4.021 . 0 0 "[ . 1 . 2 .]" 1
1907 1 82 LYS H 1 82 LYS HB2 3.400 . 4.800 3.045 2.300 3.862 . 0 0 "[ . 1 . 2 .]" 1
1908 1 82 LYS H 1 82 LYS HB3 3.200 . 4.500 3.482 2.382 3.831 . 0 0 "[ . 1 . 2 .]" 1
1909 1 82 LYS H 1 82 LYS QG 3.900 . 5.800 3.632 2.427 4.147 . 0 0 "[ . 1 . 2 .]" 1
1910 1 82 LYS H 1 83 MET H 4.100 . 6.000 4.323 4.090 4.599 . 0 0 "[ . 1 . 2 .]" 1
1911 1 82 LYS HA 1 83 MET H 2.700 . 3.600 2.459 2.067 3.564 . 0 0 "[ . 1 . 2 .]" 1
1912 1 82 LYS HB2 1 83 MET H 3.900 . 5.800 3.201 1.883 4.059 0.117 21 0 "[ . 1 . 2 .]" 1
1913 1 82 LYS HB2 1 82 LYS QG 2.300 . 3.000 2.299 2.204 2.387 . 0 0 "[ . 1 . 2 .]" 1
1914 1 82 LYS HB3 1 82 LYS QG 2.300 . 3.000 2.381 2.300 2.466 . 0 0 "[ . 1 . 2 .]" 1
1915 1 82 LYS HB3 1 83 MET H 3.200 . 4.500 2.915 1.902 3.932 . 0 0 "[ . 1 . 2 .]" 1
1916 1 82 LYS HB3 1 83 MET H 3.500 . 5.000 2.538 1.784 3.540 0.216 4 0 "[ . 1 . 2 .]" 1
1917 1 82 LYS QE 1 82 LYS QG 2.800 . 3.800 2.396 2.119 2.867 . 0 0 "[ . 1 . 2 .]" 1
1918 1 82 LYS QG 1 83 MET H 4.000 . 6.000 2.779 1.699 3.673 0.301 3 0 "[ . 1 . 2 .]" 1
1919 1 82 LYS QG 1 83 MET ME 2.900 . 4.000 4.078 3.409 4.420 0.420 15 0 "[ . 1 . 2 .]" 1
1920 1 83 MET H 1 83 MET QB 3.000 . 4.100 2.508 2.045 3.327 . 0 0 "[ . 1 . 2 .]" 1
1921 1 83 MET H 1 83 MET HG2 4.200 . 6.000 3.466 1.918 4.449 0.082 8 0 "[ . 1 . 2 .]" 1
1922 1 83 MET HA 1 83 MET HG2 3.300 . 4.700 3.298 2.527 3.879 . 0 0 "[ . 1 . 2 .]" 1
1923 1 83 MET HA 1 83 MET HG3 3.600 . 5.200 3.437 2.536 4.252 . 0 0 "[ . 1 . 2 .]" 1
1924 1 83 MET HA 1 84 VAL H 2.900 . 4.000 2.214 2.093 2.401 . 0 0 "[ . 1 . 2 .]" 1
1925 1 83 MET QB 1 83 MET ME 2.600 . 3.400 2.196 1.641 3.526 0.159 15 0 "[ . 1 . 2 .]" 1
1926 1 83 MET QB 1 83 MET HG2 2.400 . 3.100 2.317 2.153 2.464 . 0 0 "[ . 1 . 2 .]" 1
1927 1 83 MET QB 1 83 MET HG3 2.400 . 3.100 2.304 2.131 2.500 . 0 0 "[ . 1 . 2 .]" 1
1928 1 83 MET ME 1 83 MET HG2 2.700 . 3.600 2.979 2.238 3.410 . 0 0 "[ . 1 . 2 .]" 1
1929 1 83 MET ME 1 83 MET HG3 2.900 . 4.000 2.736 2.266 3.398 . 0 0 "[ . 1 . 2 .]" 1
1930 1 83 MET HG2 1 84 VAL H 4.200 . 6.000 4.314 2.247 5.901 . 0 0 "[ . 1 . 2 .]" 1
1931 1 84 VAL H 1 84 VAL HB 2.900 . 4.000 2.643 2.403 3.637 . 0 0 "[ . 1 . 2 .]" 1
1932 1 84 VAL H 1 84 VAL QG 2.400 . 3.100 2.091 1.879 2.377 0.021 12 0 "[ . 1 . 2 .]" 1
1933 1 84 VAL HA 1 84 VAL HB 2.900 . 4.000 2.466 2.386 2.581 . 0 0 "[ . 1 . 2 .]" 1
1934 1 84 VAL HB 1 84 VAL QG 2.100 . 2.700 1.894 1.891 1.897 . 0 0 "[ . 1 . 2 .]" 1
1935 1 85 GLY QA 1 86 ARG H 3.500 . 4.800 2.185 2.039 2.594 . 0 0 "[ . 1 . 2 .]" 1
1936 1 86 ARG H 1 86 ARG QB 4.100 . 6.000 2.542 1.688 3.124 0.312 11 0 "[ . 1 . 2 .]" 1
1937 1 86 ARG HA 1 86 ARG QB 3.400 . 4.300 2.253 2.164 2.416 . 0 0 "[ . 1 . 2 .]" 1
1938 1 86 ARG HA 1 87 LYS H 2.300 . 3.000 2.367 2.093 2.963 . 0 0 "[ . 1 . 2 .]" 1
1939 1 86 ARG QB 1 86 ARG QD 3.100 . 4.300 2.175 2.017 2.354 . 0 0 "[ . 1 . 2 .]" 1
1940 1 86 ARG QB 1 87 LYS H 3.100 . 4.300 3.373 2.733 3.811 . 0 0 "[ . 1 . 2 .]" 1
1941 1 86 ARG HG2 1 87 LYS H 3.200 . 4.500 4.143 2.891 5.259 0.759 7 3 "[- . + 1 .* 2 .]" 1
1942 1 86 ARG HG3 1 87 LYS H 3.500 . 5.000 4.658 3.417 5.344 0.344 8 0 "[ . 1 . 2 .]" 1
1943 1 87 LYS H 1 87 LYS QB 2.800 . 3.800 2.364 2.095 2.736 . 0 0 "[ . 1 . 2 .]" 1
1944 1 87 LYS H 1 87 LYS QB 2.800 . 3.800 2.351 2.090 2.722 . 0 0 "[ . 1 . 2 .]" 1
1945 1 87 LYS H 1 98 TYR QE 4.200 . 6.000 3.790 2.462 5.402 . 0 0 "[ . 1 . 2 .]" 1
1946 1 87 LYS HA 1 87 LYS QD 3.200 . 4.500 2.898 1.831 3.986 0.069 21 0 "[ . 1 . 2 .]" 1
1947 1 87 LYS HB2 1 87 LYS HB3 1.700 . 2.200 1.737 1.714 1.761 . 0 0 "[ . 1 . 2 .]" 1
1948 1 87 LYS QB 1 98 TYR QB 3.300 . 4.700 2.573 1.592 3.989 0.308 11 0 "[ . 1 . 2 .]" 1
1949 1 87 LYS QB 1 87 LYS QE 3.200 . 4.500 3.454 1.861 3.839 0.039 2 0 "[ . 1 . 2 .]" 1
1950 1 87 LYS QB 1 87 LYS QG 2.100 . 2.700 2.035 1.967 2.092 . 0 0 "[ . 1 . 2 .]" 1
1951 1 87 LYS QB 1 89 ARG H 3.300 . 4.700 3.173 1.950 4.051 . 0 0 "[ . 1 . 2 .]" 1
1952 1 87 LYS QD 1 87 LYS QE 2.200 . 2.500 2.037 1.983 2.091 . 0 0 "[ . 1 . 2 .]" 1
1953 1 87 LYS QD 1 87 LYS QG 1.800 . 2.200 2.072 1.989 2.087 . 0 0 "[ . 1 . 2 .]" 1
1954 1 87 LYS QE 1 87 LYS QG 2.300 . 3.000 2.278 2.097 2.824 . 0 0 "[ . 1 . 2 .]" 1
1955 1 88 CYS HA 1 88 CYS HB2 2.700 . 3.600 2.992 2.841 3.023 . 0 0 "[ . 1 . 2 .]" 1
1956 1 88 CYS HA 1 88 CYS HB3 2.700 . 3.600 2.357 2.238 2.584 . 0 0 "[ . 1 . 2 .]" 1
1957 1 88 CYS HA 1 89 ARG H 2.500 . 3.300 2.306 2.046 3.510 0.210 25 0 "[ . 1 . 2 .]" 1
1958 1 88 CYS HB2 1 89 ARG H 2.800 . 3.800 3.660 1.700 4.237 0.437 23 0 "[ . 1 . 2 .]" 1
1959 1 88 CYS HB3 1 89 ARG H 2.700 . 3.600 3.126 1.721 3.863 0.263 16 0 "[ . 1 . 2 .]" 1
1960 1 89 ARG H 1 89 ARG QB 3.100 . 4.300 2.747 2.383 3.313 . 0 0 "[ . 1 . 2 .]" 1
1961 1 89 ARG H 1 89 ARG QG 3.100 . 4.300 3.237 1.952 4.164 . 0 0 "[ . 1 . 2 .]" 1
1962 1 89 ARG HA 1 89 ARG QD 2.700 . 3.600 2.921 1.615 3.606 0.185 16 0 "[ . 1 . 2 .]" 1
1963 1 89 ARG HA 1 89 ARG QG 2.900 . 4.000 2.519 2.173 3.372 . 0 0 "[ . 1 . 2 .]" 1
1964 1 89 ARG HA 1 91 ASP H 2.900 . 4.000 2.725 2.258 2.900 . 0 0 "[ . 1 . 2 .]" 1
1965 1 89 ARG HA 1 92 ASP H 2.600 . 3.400 2.986 2.141 3.423 0.023 1 0 "[ . 1 . 2 .]" 1
1966 1 89 ARG QB 1 89 ARG QD 2.500 . 3.300 2.172 1.986 2.476 . 0 0 "[ . 1 . 2 .]" 1
1967 1 89 ARG QB 1 89 ARG QG 2.300 . 2.700 2.070 1.977 2.089 . 0 0 "[ . 1 . 2 .]" 1
1968 1 89 ARG QD 1 89 ARG QG 2.000 . 2.500 2.055 1.985 2.095 . 0 0 "[ . 1 . 2 .]" 1
1969 1 89 ARG QD 1 98 TYR QD 3.200 . 4.500 4.272 3.471 4.776 0.276 10 0 "[ . 1 . 2 .]" 1
1970 1 90 LYS HA 1 90 LYS QG 2.600 . 3.400 2.455 2.092 2.808 . 0 0 "[ . 1 . 2 .]" 1
1971 1 90 LYS HB2 1 90 LYS QG 2.100 . 2.700 2.244 2.130 2.382 . 0 0 "[ . 1 . 2 .]" 1
1972 1 90 LYS HB2 1 91 ASP H 3.100 . 4.300 3.610 1.967 4.421 0.121 6 0 "[ . 1 . 2 .]" 1
1973 1 91 ASP H 1 91 ASP QB 2.800 . 3.800 2.565 2.231 3.091 . 0 0 "[ . 1 . 2 .]" 1
1974 1 92 ASP H 1 92 ASP HB2 2.200 . 2.800 1.825 1.547 2.116 0.053 10 0 "[ . 1 . 2 .]" 1
1975 1 92 ASP H 1 93 ASP H 2.800 . 3.800 3.276 1.908 3.935 0.135 24 0 "[ . 1 . 2 .]" 1
1976 1 92 ASP HA 1 93 ASP H 2.400 . 3.100 2.308 2.068 2.767 . 0 0 "[ . 1 . 2 .]" 1
1977 1 92 ASP HB2 1 93 ASP H 2.500 . 3.300 2.531 1.953 3.047 . 0 0 "[ . 1 . 2 .]" 1
1978 1 92 ASP HB3 1 93 ASP H 2.600 . 3.400 2.457 1.775 3.032 0.025 9 0 "[ . 1 . 2 .]" 1
1979 1 93 ASP HA 1 93 ASP QB 1.900 . 2.400 1.876 1.781 1.933 . 0 0 "[ . 1 . 2 .]" 1
1980 1 93 ASP HA 1 93 ASP QB 1.900 . 2.400 2.007 1.906 2.109 . 0 0 "[ . 1 . 2 .]" 1
1981 1 93 ASP QB 1 94 ASP H 2.500 . 3.300 2.085 1.641 2.564 0.059 14 0 "[ . 1 . 2 .]" 1
1982 1 96 ASP H 1 98 TYR H 3.300 . 4.700 3.828 2.804 4.504 . 0 0 "[ . 1 . 2 .]" 1
1983 1 96 ASP QB 1 97 GLY H 3.700 . 5.400 2.781 1.890 3.953 0.110 24 0 "[ . 1 . 2 .]" 1
1984 1 97 GLY H 1 97 GLY QA 2.500 . 3.300 2.286 2.194 2.485 . 0 0 "[ . 1 . 2 .]" 1
1985 1 97 GLY H 1 98 TYR H 3.700 . 5.400 3.903 2.806 4.559 . 0 0 "[ . 1 . 2 .]" 1
1986 1 97 GLY QA 1 98 TYR H 2.200 . 2.800 2.260 2.087 2.569 . 0 0 "[ . 1 . 2 .]" 1
1987 1 98 TYR H 1 98 TYR HA 2.600 . 3.400 2.785 2.214 2.957 . 0 0 "[ . 1 . 2 .]" 1
1988 1 98 TYR H 1 98 TYR QB 2.600 . 3.400 2.626 2.295 3.682 0.282 24 0 "[ . 1 . 2 .]" 1
1989 1 98 TYR H 1 98 TYR QD 3.100 . 4.300 3.396 1.793 4.596 0.296 19 0 "[ . 1 . 2 .]" 1
1990 1 98 TYR HA 1 98 TYR QB 2.600 . 3.100 2.388 2.148 3.014 . 0 0 "[ . 1 . 2 .]" 1
1991 1 98 TYR HA 1 98 TYR QD 2.800 . 3.800 2.842 1.921 3.784 . 0 0 "[ . 1 . 2 .]" 1
1992 1 98 TYR QB 1 98 TYR QD 2.500 . 3.300 2.200 2.122 2.418 . 0 0 "[ . 1 . 2 .]" 1
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