NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
422796 |
2evn   |
6338 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2evn
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 1888
_Distance_constraint_stats_list.Viol_count 2524
_Distance_constraint_stats_list.Viol_total 4657.776
_Distance_constraint_stats_list.Viol_max 0.967
_Distance_constraint_stats_list.Viol_rms 0.0397
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0062
_Distance_constraint_stats_list.Viol_average_violations_only 0.0923
_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 2 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 THR 0.069 0.069 1 0 "[ . 1 . 2]"
1 4 GLU 1.018 0.897 1 1 "[+ . 1 . 2]"
1 6 PRO 2.000 0.897 1 1 "[+ . 1 . 2]"
1 7 LYS 8.452 0.275 13 0 "[ . 1 . 2]"
1 8 ILE 7.617 0.355 18 0 "[ . 1 . 2]"
1 9 VAL 2.229 0.171 6 0 "[ . 1 . 2]"
1 10 TRP 2.741 0.432 15 0 "[ . 1 . 2]"
1 11 ASN 2.204 0.440 10 0 "[ . 1 . 2]"
1 12 GLU 4.720 0.432 15 0 "[ . 1 . 2]"
1 13 GLY 0.285 0.058 20 0 "[ . 1 . 2]"
1 14 LYS 5.790 0.647 10 4 "[ . - + .** 2]"
1 15 ARG 5.225 0.967 7 5 "[ . +* * .-* 2]"
1 16 ARG 5.635 0.967 7 4 "[ . +* 1 .-* 2]"
1 17 PHE 3.829 0.128 1 0 "[ . 1 . 2]"
1 18 GLU 8.644 0.702 5 5 "[ *+* 1 - * 2]"
1 19 THR 11.387 0.702 5 5 "[ *+* 1 - * 2]"
1 20 GLU 5.164 0.440 1 0 "[ . 1 . 2]"
1 21 ASP 10.836 0.440 1 0 "[ . 1 . 2]"
1 22 HIS 1.100 0.247 5 0 "[ . 1 . 2]"
1 23 GLU 0.914 0.081 15 0 "[ . 1 . 2]"
1 24 ALA 3.408 0.310 12 0 "[ . 1 . 2]"
1 25 PHE 0.147 0.063 2 0 "[ . 1 . 2]"
1 26 ILE 5.515 0.206 8 0 "[ . 1 . 2]"
1 27 GLU 3.242 0.451 18 0 "[ . 1 . 2]"
1 28 TYR 2.697 0.451 18 0 "[ . 1 . 2]"
1 29 LYS 8.419 0.913 11 4 "[ .- 1+ ** 2]"
1 30 MET 17.085 0.913 11 5 "[ .* *+ *- 2]"
1 31 ARG 6.665 0.952 13 3 "[ * . 1 + .- 2]"
1 32 ASN 0.152 0.031 17 0 "[ . 1 . 2]"
1 33 ASN 0.193 0.053 4 0 "[ . 1 . 2]"
1 34 GLY 10.294 0.623 3 3 "[ + . *1- . 2]"
1 35 LYS 5.271 0.665 8 4 "[ * . +*1- . 2]"
1 36 VAL 4.214 0.593 16 1 "[ . 1 .+ 2]"
1 37 MET 3.526 0.952 13 1 "[ . 1 + . 2]"
1 38 ASP 5.947 0.765 14 1 "[ . 1 +. 2]"
1 39 LEU 7.474 0.289 14 0 "[ . 1 . 2]"
1 40 VAL 5.465 0.801 14 1 "[ . 1 +. 2]"
1 41 HIS 7.038 0.209 19 0 "[ . 1 . 2]"
1 42 THR 8.473 0.304 5 0 "[ . 1 . 2]"
1 43 TYR 3.831 0.304 5 0 "[ . 1 . 2]"
1 44 VAL 4.340 0.310 12 0 "[ . 1 . 2]"
1 45 PRO 0.098 0.038 5 0 "[ . 1 . 2]"
1 46 SER 1.354 0.650 12 1 "[ . 1 + . 2]"
1 47 PHE 0.015 0.015 17 0 "[ . 1 . 2]"
1 48 LYS 0.415 0.280 17 0 "[ . 1 . 2]"
1 49 ARG 6.688 0.792 10 8 "[ *** -*+ * . *2]"
1 50 GLY 4.922 0.792 10 7 "[ *** -*+ . *2]"
1 51 LEU 0.543 0.223 17 0 "[ . 1 . 2]"
1 52 GLY 0.076 0.074 3 0 "[ . 1 . 2]"
1 53 LEU 2.211 0.223 17 0 "[ . 1 . 2]"
1 54 ALA 1.686 0.178 10 0 "[ . 1 . 2]"
1 55 SER 6.475 0.636 17 1 "[ . 1 . + 2]"
1 56 HIS 1.927 0.187 9 0 "[ . 1 . 2]"
1 57 LEU 1.917 0.187 3 0 "[ . 1 . 2]"
1 58 CYS 10.506 0.536 17 1 "[ . 1 . + 2]"
1 59 VAL 1.503 0.092 10 0 "[ . 1 . 2]"
1 60 ALA 3.225 0.309 2 0 "[ . 1 . 2]"
1 61 ALA 5.632 0.205 6 0 "[ . 1 . 2]"
1 62 PHE 18.553 0.708 7 4 "[ . + 1* .* -]"
1 63 GLU 6.465 0.567 20 1 "[ . 1 . +]"
1 64 HIS 1.591 0.089 11 0 "[ . 1 . 2]"
1 65 ALA 0.317 0.054 16 0 "[ . 1 . 2]"
1 66 SER 5.443 0.167 19 0 "[ . 1 . 2]"
1 67 SER 0.001 0.001 9 0 "[ . 1 . 2]"
1 68 HIS 0.683 0.137 10 0 "[ . 1 . 2]"
1 69 SER 0.484 0.137 10 0 "[ . 1 . 2]"
1 70 ILE 1.079 0.311 3 0 "[ . 1 . 2]"
1 71 SER 0.057 0.023 9 0 "[ . 1 . 2]"
1 72 ILE 14.387 0.278 12 0 "[ . 1 . 2]"
1 73 ILE 9.324 0.679 3 1 "[ + . 1 . 2]"
1 74 PRO 1.160 0.157 14 0 "[ . 1 . 2]"
1 75 SER 0.621 0.071 5 0 "[ . 1 . 2]"
1 76 CYS 9.160 0.801 14 2 "[ . 1 +. - 2]"
1 77 SER 8.365 0.879 4 7 "[* +* * *1 * . - 2]"
1 78 TYR 5.809 0.255 13 0 "[ . 1 . 2]"
1 79 VAL 1.564 0.104 8 0 "[ . 1 . 2]"
1 80 SER 1.675 0.116 8 0 "[ . 1 . 2]"
1 81 ASP 18.624 0.879 4 7 "[* +* * *1 * . - 2]"
1 82 THR 4.000 0.207 8 0 "[ . 1 . 2]"
1 83 PHE 13.376 0.708 7 3 "[ . + 1* .- 2]"
1 84 LEU 10.799 0.185 10 0 "[ . 1 . 2]"
1 85 PRO 5.152 0.757 4 1 "[ +. 1 . 2]"
1 86 ARG 3.167 0.749 6 3 "[ * .+ 1 -. 2]"
1 87 ASN 0.542 0.250 14 0 "[ . 1 . 2]"
1 88 PRO 1.294 0.130 14 0 "[ . 1 . 2]"
1 89 SER 4.315 0.350 12 0 "[ . 1 . 2]"
1 90 TRP 7.359 0.494 17 0 "[ . 1 . 2]"
1 91 LYS 7.198 0.942 12 3 "[ . *-+ . 2]"
1 92 PRO 9.818 0.494 17 0 "[ . 1 . 2]"
1 93 LEU 8.035 0.230 10 0 "[ . 1 . 2]"
1 94 ILE 3.046 0.222 2 0 "[ . 1 . 2]"
1 95 HIS 1.270 0.255 16 0 "[ . 1 . 2]"
1 96 SER 4.136 0.278 12 0 "[ . 1 . 2]"
1 97 GLU 5.608 0.757 4 1 "[ +. 1 . 2]"
1 98 VAL 5.253 0.826 14 3 "[ . * - +. 2]"
1 99 PHE 3.423 0.826 14 3 "[ . * - +. 2]"
1 100 LYS 6.669 0.942 12 3 "[ . *-+ . 2]"
1 101 SER 0.326 0.145 14 0 "[ . 1 . 2]"
1 102 SER 0.286 0.145 14 0 "[ . 1 . 2]"
1 103 ILE 0.141 0.141 15 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 18 GLU HA 1 19 THR HB 3.400 . 4.900 4.478 4.252 4.612 . 0 0 "[ . 1 . 2]" 1
2 1 19 THR HB 1 19 THR MG 2.300 . 3.000 2.124 2.117 2.131 . 0 0 "[ . 1 . 2]" 1
3 1 3 THR HB 1 4 GLU H 3.200 . 4.500 4.287 3.752 4.459 . 0 0 "[ . 1 . 2]" 1
4 1 19 THR HB 1 44 VAL HA 4.300 . 6.000 6.082 6.011 6.144 0.144 9 0 "[ . 1 . 2]" 1
5 1 82 THR HB 1 83 PHE H 3.500 . 5.000 3.973 3.936 4.062 . 0 0 "[ . 1 . 2]" 1
6 1 82 THR H 1 82 THR HB 2.800 . 3.800 2.883 2.790 2.942 . 0 0 "[ . 1 . 2]" 1
7 1 81 ASP HA 1 82 THR HB 3.300 . 6.000 5.709 5.556 5.779 . 0 0 "[ . 1 . 2]" 1
8 1 82 THR HA 1 82 THR HB 2.700 . 3.600 2.403 2.378 2.436 . 0 0 "[ . 1 . 2]" 1
9 1 59 VAL HA 1 62 PHE H 2.700 . 3.600 3.124 2.949 3.263 . 0 0 "[ . 1 . 2]" 1
10 1 59 VAL HA 1 62 PHE QD 2.000 . 2.500 1.559 1.475 1.742 0.025 2 0 "[ . 1 . 2]" 1
11 1 59 VAL HA 1 59 VAL HB 2.500 . 3.300 3.021 3.018 3.025 . 0 0 "[ . 1 . 2]" 1
12 1 59 VAL HA 1 62 PHE HB3 3.700 . 5.400 3.877 3.639 4.086 . 0 0 "[ . 1 . 2]" 1
13 1 59 VAL HA 1 59 VAL MG2 2.400 . 3.100 2.323 2.297 2.347 . 0 0 "[ . 1 . 2]" 1
14 1 59 VAL HA 1 59 VAL MG1 2.500 . 3.300 2.474 2.452 2.494 . 0 0 "[ . 1 . 2]" 1
15 1 59 VAL H 1 59 VAL HA 2.400 . 3.100 2.814 2.803 2.834 . 0 0 "[ . 1 . 2]" 1
16 1 42 THR H 1 42 THR HB 2.900 . 3.900 2.872 2.748 3.073 . 0 0 "[ . 1 . 2]" 1
17 1 41 HIS HA 1 42 THR HB 3.500 . 5.000 4.953 4.745 5.043 0.043 18 0 "[ . 1 . 2]" 1
18 1 42 THR HA 1 42 THR HB 2.400 . 3.100 2.452 2.379 2.517 . 0 0 "[ . 1 . 2]" 1
19 1 42 THR HB 1 42 THR HG1 2.500 . 3.300 2.170 2.089 2.773 . 0 0 "[ . 1 . 2]" 1
20 1 79 VAL HA 1 84 LEU H 3.100 . 6.000 4.970 4.815 5.126 . 0 0 "[ . 1 . 2]" 1
21 1 79 VAL HA 1 83 PHE H 2.700 . 3.600 3.228 3.107 3.342 . 0 0 "[ . 1 . 2]" 1
22 1 79 VAL HA 1 83 PHE HB2 3.400 . 4.800 2.928 2.711 3.269 . 0 0 "[ . 1 . 2]" 1
23 1 79 VAL HA 1 79 VAL HB 2.700 . 3.600 3.029 3.023 3.039 . 0 0 "[ . 1 . 2]" 1
24 1 79 VAL HA 1 79 VAL QG 2.500 . 3.300 2.147 2.132 2.161 . 0 0 "[ . 1 . 2]" 1
25 1 92 PRO HA 1 93 LEU HG 3.400 . 4.800 4.951 4.897 5.030 0.230 10 0 "[ . 1 . 2]" 1
26 1 92 PRO HA 1 92 PRO HB3 2.600 . 3.500 2.278 2.261 2.299 . 0 0 "[ . 1 . 2]" 1
27 1 85 PRO HA 1 86 ARG H 2.800 . 3.800 3.493 3.468 3.530 . 0 0 "[ . 1 . 2]" 1
28 1 85 PRO HA 1 85 PRO HB3 2.600 . 3.400 2.287 2.273 2.301 . 0 0 "[ . 1 . 2]" 1
29 1 85 PRO HA 1 85 PRO HG3 3.100 . 4.300 3.120 2.981 3.975 . 0 0 "[ . 1 . 2]" 1
30 1 85 PRO HA 1 85 PRO HD2 3.000 . 4.200 3.947 3.924 4.080 . 0 0 "[ . 1 . 2]" 1
31 1 88 PRO HA 1 88 PRO HD2 2.900 . 4.000 3.893 3.883 3.905 . 0 0 "[ . 1 . 2]" 1
32 1 88 PRO HA 1 88 PRO HB3 2.500 . 3.300 2.260 2.252 2.268 . 0 0 "[ . 1 . 2]" 1
33 1 87 ASN QB 1 88 PRO HA 2.800 . 6.000 4.785 4.561 5.085 . 0 0 "[ . 1 . 2]" 1
34 1 84 LEU QB 1 88 PRO HA 3.200 . 6.000 3.866 3.520 4.331 . 0 0 "[ . 1 . 2]" 1
35 1 88 PRO HA 1 88 PRO HD3 3.100 . 4.300 3.951 3.915 3.989 . 0 0 "[ . 1 . 2]" 1
36 1 82 THR HA 1 83 PHE H 2.900 . 3.900 3.555 3.545 3.569 . 0 0 "[ . 1 . 2]" 1
37 1 82 THR H 1 82 THR HA 2.700 . 3.600 2.907 2.897 2.927 . 0 0 "[ . 1 . 2]" 1
38 1 81 ASP HA 1 82 THR HA 2.900 . 6.000 4.590 4.551 4.614 . 0 0 "[ . 1 . 2]" 1
39 1 82 THR HA 1 85 PRO HB2 3.200 . 4.400 4.344 4.145 4.607 0.207 8 0 "[ . 1 . 2]" 1
40 1 82 THR HA 1 82 THR MG 3.300 . 4.700 3.218 3.206 3.225 . 0 0 "[ . 1 . 2]" 1
41 1 58 CYS HA 1 59 VAL H 2.700 . 3.600 3.529 3.518 3.546 . 0 0 "[ . 1 . 2]" 1
42 1 58 CYS H 1 58 CYS HA 2.600 . 3.500 2.817 2.802 2.836 . 0 0 "[ . 1 . 2]" 1
43 1 58 CYS HA 1 76 CYS HB2 3.100 . 6.000 4.689 4.492 5.011 . 0 0 "[ . 1 . 2]" 1
44 1 58 CYS HA 1 58 CYS HB3 2.700 . 3.600 3.033 3.025 3.051 . 0 0 "[ . 1 . 2]" 1
45 1 40 VAL HA 1 75 SER H 2.900 . 3.900 3.379 3.080 3.619 . 0 0 "[ . 1 . 2]" 1
46 1 40 VAL H 1 40 VAL HA 2.500 . 3.300 2.939 2.929 2.947 . 0 0 "[ . 1 . 2]" 1
47 1 40 VAL HA 1 76 CYS H 2.800 . 3.800 3.350 2.904 3.577 . 0 0 "[ . 1 . 2]" 1
48 1 40 VAL HA 1 41 HIS H 2.400 . 3.100 2.149 2.087 2.200 . 0 0 "[ . 1 . 2]" 1
49 1 40 VAL HA 1 76 CYS HB3 3.200 . 6.000 5.632 4.619 5.950 . 0 0 "[ . 1 . 2]" 1
50 1 40 VAL HA 1 76 CYS HB2 3.200 . 6.000 5.370 4.722 5.893 . 0 0 "[ . 1 . 2]" 1
51 1 40 VAL HA 1 40 VAL HB 2.700 . 3.600 2.934 2.408 3.028 . 0 0 "[ . 1 . 2]" 1
52 1 40 VAL HA 1 40 VAL QG 2.700 . 3.600 2.155 2.116 2.320 . 0 0 "[ . 1 . 2]" 1
53 1 78 TYR HA 1 78 TYR QD 2.900 . 4.000 3.139 2.977 3.276 . 0 0 "[ . 1 . 2]" 1
54 1 102 SER QB 1 103 ILE H 3.000 . 4.100 2.959 1.759 3.838 0.141 15 0 "[ . 1 . 2]" 1
55 1 100 LYS QD 1 101 SER QB 3.000 . 4.100 2.696 1.780 3.984 0.120 18 0 "[ . 1 . 2]" 1
56 1 99 PHE H 1 101 SER QB 2.100 . 6.000 5.741 4.603 5.953 . 0 0 "[ . 1 . 2]" 1
57 1 42 THR HA 1 43 TYR H 2.500 . 3.300 2.200 2.154 2.237 . 0 0 "[ . 1 . 2]" 1
58 1 42 THR H 1 42 THR HA 2.600 . 3.400 2.913 2.887 2.931 . 0 0 "[ . 1 . 2]" 1
59 1 26 ILE HA 1 42 THR HA 2.700 . 3.600 2.875 2.669 3.063 . 0 0 "[ . 1 . 2]" 1
60 1 26 ILE QG 1 42 THR HA 2.500 . 3.300 1.805 1.634 2.097 0.066 5 0 "[ . 1 . 2]" 1
61 1 42 THR HA 1 57 LEU HB2 3.000 . 4.100 4.099 4.018 4.163 0.063 20 0 "[ . 1 . 2]" 1
62 1 42 THR HA 1 42 THR HG1 2.900 . 3.900 3.195 3.000 3.509 . 0 0 "[ . 1 . 2]" 1
63 1 78 TYR HA 1 80 SER H 3.000 . 6.000 4.560 4.437 4.747 . 0 0 "[ . 1 . 2]" 1
64 1 75 SER HA 1 76 CYS H 2.900 . 3.900 3.378 3.341 3.428 . 0 0 "[ . 1 . 2]" 1
65 1 75 SER H 1 75 SER HA 2.700 . 3.600 2.870 2.836 2.884 . 0 0 "[ . 1 . 2]" 1
66 1 78 TYR HA 1 82 THR H 2.900 . 6.000 4.420 4.305 4.575 . 0 0 "[ . 1 . 2]" 1
67 1 77 SER H 1 77 SER HB3 3.000 . 4.200 3.143 2.523 3.555 . 0 0 "[ . 1 . 2]" 1
68 1 77 SER HB3 1 81 ASP HA 3.100 . 6.000 5.695 4.904 6.589 0.589 4 1 "[ +. 1 . 2]" 1
69 1 77 SER HB3 1 81 ASP QB 3.200 . 4.500 4.445 3.673 5.379 0.879 4 7 "[* +* * *1 * . - 2]" 1
70 1 67 SER H 1 67 SER HB3 2.700 . 3.600 2.970 2.501 3.601 0.001 9 0 "[ . 1 . 2]" 1
71 1 55 SER H 1 55 SER HA 2.500 . 3.300 2.822 2.794 2.845 . 0 0 "[ . 1 . 2]" 1
72 1 55 SER HA 1 78 TYR QE 3.100 . 4.300 3.997 3.707 4.331 0.031 18 0 "[ . 1 . 2]" 1
73 1 55 SER HA 1 58 CYS HB3 2.700 . 3.600 2.776 2.477 2.975 . 0 0 "[ . 1 . 2]" 1
74 1 83 PHE H 1 83 PHE HA 2.500 . 3.300 2.853 2.849 2.860 . 0 0 "[ . 1 . 2]" 1
75 1 98 VAL H 1 98 VAL HA 2.600 . 3.400 2.855 2.771 2.934 . 0 0 "[ . 1 . 2]" 1
76 1 83 PHE HA 1 87 ASN HD21 2.800 . 6.000 4.146 3.329 5.519 . 0 0 "[ . 1 . 2]" 1
77 1 83 PHE HA 1 83 PHE HB2 2.700 . 3.600 2.701 2.552 3.025 . 0 0 "[ . 1 . 2]" 1
78 1 98 VAL HA 1 98 VAL HB 2.500 . 3.300 2.446 2.345 2.846 . 0 0 "[ . 1 . 2]" 1
79 1 83 PHE HA 1 86 ARG QB 2.500 . 3.300 2.228 2.039 2.514 . 0 0 "[ . 1 . 2]" 1
80 1 81 ASP HA 1 98 VAL HA 3.100 . 4.300 4.043 3.259 4.478 0.178 5 0 "[ . 1 . 2]" 1
81 1 7 LYS H 1 19 THR HA 3.100 . 4.300 4.365 4.140 4.485 0.185 5 0 "[ . 1 . 2]" 1
82 1 19 THR HA 1 20 GLU H 2.400 . 3.100 2.495 2.388 2.670 . 0 0 "[ . 1 . 2]" 1
83 1 19 THR H 1 19 THR HA 2.500 . 3.300 2.833 2.793 2.882 . 0 0 "[ . 1 . 2]" 1
84 1 19 THR HA 1 19 THR MG 2.900 . 3.900 3.209 3.195 3.217 . 0 0 "[ . 1 . 2]" 1
85 1 8 ILE MG 1 19 THR HA 2.700 . 3.600 2.782 2.640 2.972 . 0 0 "[ . 1 . 2]" 1
86 1 6 PRO HA 1 7 LYS H 2.600 . 3.500 2.393 2.176 2.752 . 0 0 "[ . 1 . 2]" 1
87 1 6 PRO HA 1 53 LEU QD 3.500 . 5.100 4.308 3.798 4.609 . 0 0 "[ . 1 . 2]" 1
88 1 80 SER HA 1 81 ASP HA 2.900 . 6.000 4.756 4.697 4.859 . 0 0 "[ . 1 . 2]" 1
89 1 79 VAL HB 1 80 SER HA 2.900 . 6.000 4.024 3.936 4.076 . 0 0 "[ . 1 . 2]" 1
90 1 79 VAL QG 1 80 SER HA 3.300 . 3.400 3.210 3.002 3.370 . 0 0 "[ . 1 . 2]" 1
91 1 75 SER QB 1 76 CYS H 2.800 . 3.800 2.918 2.824 3.139 . 0 0 "[ . 1 . 2]" 1
92 1 40 VAL QG 1 75 SER QB 2.900 . 3.900 2.289 1.872 2.555 0.028 13 0 "[ . 1 . 2]" 1
93 1 62 PHE HA 1 63 GLU H 2.800 . 3.800 3.549 3.533 3.562 . 0 0 "[ . 1 . 2]" 1
94 1 62 PHE HA 1 65 ALA H 2.700 . 3.600 3.560 3.470 3.632 0.032 15 0 "[ . 1 . 2]" 1
95 1 62 PHE H 1 62 PHE HA 2.600 . 3.500 2.799 2.786 2.809 . 0 0 "[ . 1 . 2]" 1
96 1 62 PHE HA 1 62 PHE QD 2.400 . 3.100 2.076 1.997 2.165 . 0 0 "[ . 1 . 2]" 1
97 1 62 PHE HA 1 64 HIS QB 3.000 . 6.000 4.952 4.854 5.079 . 0 0 "[ . 1 . 2]" 1
98 1 62 PHE HA 1 62 PHE HB3 2.600 . 3.400 2.564 2.552 2.584 . 0 0 "[ . 1 . 2]" 1
99 1 62 PHE HA 1 65 ALA MB 3.200 . 4.500 3.056 2.757 3.207 . 0 0 "[ . 1 . 2]" 1
100 1 62 PHE HA 1 62 PHE HB2 2.800 . 3.800 3.014 3.009 3.020 . 0 0 "[ . 1 . 2]" 1
101 1 62 PHE HA 1 72 ILE MD 2.400 . 3.100 1.955 1.887 2.024 . 0 0 "[ . 1 . 2]" 1
102 1 19 THR HA 1 20 GLU QB 3.800 . 5.600 4.523 4.323 4.750 . 0 0 "[ . 1 . 2]" 1
103 1 7 LYS QB 1 19 THR HA 3.400 . 6.000 5.031 4.668 5.498 . 0 0 "[ . 1 . 2]" 1
104 1 18 GLU HG3 1 19 THR HA 3.400 . 6.000 6.110 5.588 6.702 0.702 5 5 "[ *+* 1 - * 2]" 1
105 1 3 THR HA 1 4 GLU H 2.800 . 3.800 2.217 2.088 2.373 . 0 0 "[ . 1 . 2]" 1
106 1 3 THR HA 1 6 PRO QD 2.800 . 6.000 5.830 5.708 6.069 0.069 1 0 "[ . 1 . 2]" 1
107 1 3 THR HA 1 3 THR MG 2.900 . 4.000 2.490 2.206 3.226 . 0 0 "[ . 1 . 2]" 1
108 1 91 LYS H 1 91 LYS HA 2.600 . 3.500 2.787 2.739 2.813 . 0 0 "[ . 1 . 2]" 1
109 1 91 LYS HA 1 92 PRO HD3 3.100 . 4.300 4.138 3.813 4.472 0.172 20 0 "[ . 1 . 2]" 1
110 1 91 LYS HA 1 91 LYS HB2 2.700 . 3.600 2.752 2.431 3.020 . 0 0 "[ . 1 . 2]" 1
111 1 80 SER HA 1 84 LEU QB 2.400 . 3.100 2.714 2.449 2.964 . 0 0 "[ . 1 . 2]" 1
112 1 75 SER H 1 75 SER QB 2.800 . 3.800 2.363 2.250 2.561 . 0 0 "[ . 1 . 2]" 1
113 1 74 PRO HB3 1 77 SER HA 3.400 . 4.900 4.725 4.200 5.057 0.157 14 0 "[ . 1 . 2]" 1
114 1 77 SER HA 1 81 ASP HA 3.200 . 6.000 5.521 5.286 5.712 . 0 0 "[ . 1 . 2]" 1
115 1 66 SER H 1 66 SER HA 2.600 . 3.500 2.762 2.750 2.782 . 0 0 "[ . 1 . 2]" 1
116 1 66 SER HA 1 93 LEU MD1 2.800 . 3.800 3.284 2.926 3.611 . 0 0 "[ . 1 . 2]" 1
117 1 89 SER HA 1 90 TRP H 2.900 . 4.000 3.212 3.022 3.324 . 0 0 "[ . 1 . 2]" 1
118 1 36 VAL HA 1 73 ILE HB 3.400 . 6.000 5.982 5.624 6.102 0.102 13 0 "[ . 1 . 2]" 1
119 1 36 VAL HA 1 37 MET H 2.400 . 3.100 2.152 2.120 2.191 . 0 0 "[ . 1 . 2]" 1
120 1 36 VAL HA 1 72 ILE HA 3.400 . 4.800 3.557 3.360 3.728 . 0 0 "[ . 1 . 2]" 1
121 1 36 VAL HA 1 37 MET HB3 4.100 . 6.000 5.604 4.888 5.735 . 0 0 "[ . 1 . 2]" 1
122 1 36 VAL HA 1 36 VAL HB 2.700 . 3.600 3.020 3.003 3.026 . 0 0 "[ . 1 . 2]" 1
123 1 67 SER H 1 67 SER HA 2.800 . 3.800 2.833 2.805 2.869 . 0 0 "[ . 1 . 2]" 1
124 1 67 SER HA 1 67 SER HB3 2.900 . 4.000 2.731 2.363 3.031 . 0 0 "[ . 1 . 2]" 1
125 1 76 CYS HA 1 77 SER H 2.700 . 3.600 3.022 2.992 3.088 . 0 0 "[ . 1 . 2]" 1
126 1 76 CYS H 1 76 CYS HA 2.700 . 3.600 2.802 2.764 2.825 . 0 0 "[ . 1 . 2]" 1
127 1 41 HIS HA 1 76 CYS HA 2.900 . 4.000 3.907 3.643 4.077 0.077 7 0 "[ . 1 . 2]" 1
128 1 76 CYS HA 1 76 CYS HB3 2.500 . 3.300 2.402 2.356 2.496 . 0 0 "[ . 1 . 2]" 1
129 1 64 HIS HA 1 65 ALA H 3.100 . 4.300 3.556 3.533 3.573 . 0 0 "[ . 1 . 2]" 1
130 1 64 HIS H 1 64 HIS HA 2.800 . 3.800 2.852 2.832 2.865 . 0 0 "[ . 1 . 2]" 1
131 1 64 HIS HA 1 64 HIS QB 3.100 . 3.600 2.402 2.354 2.477 . 0 0 "[ . 1 . 2]" 1
132 1 89 SER HA 1 91 LYS HB2 3.400 . 6.000 5.043 4.557 5.599 . 0 0 "[ . 1 . 2]" 1
133 1 74 PRO HA 1 75 SER H 2.400 . 3.100 2.241 2.216 2.270 . 0 0 "[ . 1 . 2]" 1
134 1 74 PRO HA 1 74 PRO HB3 2.300 . 2.900 2.257 2.244 2.281 . 0 0 "[ . 1 . 2]" 1
135 1 39 LEU HB3 1 74 PRO HA 3.600 . 5.200 3.254 3.144 3.422 . 0 0 "[ . 1 . 2]" 1
136 1 39 LEU MD2 1 74 PRO HA 3.000 . 4.100 3.402 3.222 3.558 . 0 0 "[ . 1 . 2]" 1
137 1 9 VAL H 1 9 VAL HA 2.700 . 3.600 2.933 2.914 2.958 . 0 0 "[ . 1 . 2]" 1
138 1 9 VAL HA 1 10 TRP H 2.600 . 3.500 2.220 2.120 2.421 . 0 0 "[ . 1 . 2]" 1
139 1 9 VAL HA 1 10 TRP HB3 3.500 . 5.000 4.593 4.524 4.667 . 0 0 "[ . 1 . 2]" 1
140 1 9 VAL HA 1 9 VAL HB 2.900 . 3.900 2.956 2.345 3.028 . 0 0 "[ . 1 . 2]" 1
141 1 9 VAL HA 1 9 VAL QG 2.800 . 3.800 2.161 2.122 2.425 . 0 0 "[ . 1 . 2]" 1
142 1 70 ILE H 1 70 ILE HA 2.700 . 3.600 2.935 2.903 2.950 . 0 0 "[ . 1 . 2]" 1
143 1 70 ILE HA 1 71 SER H 2.600 . 3.500 2.299 2.223 2.344 . 0 0 "[ . 1 . 2]" 1
144 1 66 SER HA 1 70 ILE HA 3.100 . 6.000 6.029 5.961 6.097 0.097 19 0 "[ . 1 . 2]" 1
145 1 69 SER HA 1 70 ILE HA 3.000 . 6.000 4.524 4.383 4.630 . 0 0 "[ . 1 . 2]" 1
146 1 70 ILE HA 1 70 ILE HB 2.600 . 3.500 3.034 3.026 3.041 . 0 0 "[ . 1 . 2]" 1
147 1 70 ILE HA 1 70 ILE HG13 2.900 . 3.900 3.096 3.014 3.165 . 0 0 "[ . 1 . 2]" 1
148 1 56 HIS HA 1 59 VAL H 2.900 . 3.900 3.154 2.899 3.430 . 0 0 "[ . 1 . 2]" 1
149 1 56 HIS H 1 56 HIS HA 2.600 . 3.500 2.815 2.773 2.847 . 0 0 "[ . 1 . 2]" 1
150 1 56 HIS HA 1 60 ALA H 3.200 . 4.500 4.022 3.788 4.293 . 0 0 "[ . 1 . 2]" 1
151 1 56 HIS HA 1 56 HIS QB 2.600 . 3.500 2.474 2.446 2.531 . 0 0 "[ . 1 . 2]" 1
152 1 56 HIS HA 1 59 VAL HB 2.500 . 3.300 2.300 2.122 2.567 . 0 0 "[ . 1 . 2]" 1
153 1 56 HIS HA 1 59 VAL MG2 2.800 . 3.800 2.715 2.422 3.021 . 0 0 "[ . 1 . 2]" 1
154 1 56 HIS HA 1 59 VAL MG1 3.500 . 5.000 3.702 3.568 3.839 . 0 0 "[ . 1 . 2]" 1
155 1 56 HIS HA 1 57 LEU H 2.700 . 3.600 3.491 3.464 3.513 . 0 0 "[ . 1 . 2]" 1
156 1 56 HIS HA 1 57 LEU HG 3.300 . 6.000 5.430 5.330 5.572 . 0 0 "[ . 1 . 2]" 1
157 1 42 THR HB 1 76 CYS HA 3.300 . 4.700 3.997 3.653 4.357 . 0 0 "[ . 1 . 2]" 1
158 1 63 GLU HA 1 63 GLU HG3 3.400 . 4.800 3.565 3.234 3.802 . 0 0 "[ . 1 . 2]" 1
159 1 63 GLU H 1 63 GLU HA 2.700 . 3.600 2.771 2.763 2.781 . 0 0 "[ . 1 . 2]" 1
160 1 63 GLU HA 1 66 SER HA 3.300 . 6.000 5.947 5.753 6.044 0.044 15 0 "[ . 1 . 2]" 1
161 1 63 GLU HA 1 63 GLU HG2 2.800 . 3.800 2.750 2.557 2.917 . 0 0 "[ . 1 . 2]" 1
162 1 63 GLU HA 1 63 GLU HB2 2.600 . 3.500 3.023 3.008 3.029 . 0 0 "[ . 1 . 2]" 1
163 1 61 ALA HA 1 64 HIS HA 3.600 . 5.300 5.280 5.171 5.370 0.070 4 0 "[ . 1 . 2]" 1
164 1 20 GLU H 1 20 GLU HA 2.700 . 3.600 2.812 2.770 2.844 . 0 0 "[ . 1 . 2]" 1
165 1 20 GLU HA 1 21 ASP H 2.500 . 3.300 3.254 3.190 3.339 0.039 17 0 "[ . 1 . 2]" 1
166 1 19 THR HB 1 20 GLU HA 3.400 . 6.000 6.005 5.959 6.045 0.045 18 0 "[ . 1 . 2]" 1
167 1 9 VAL QG 1 20 GLU HA 2.800 . 3.800 3.361 2.959 3.756 . 0 0 "[ . 1 . 2]" 1
168 1 26 ILE HA 1 27 GLU H 2.500 . 3.300 2.187 2.139 2.245 . 0 0 "[ . 1 . 2]" 1
169 1 26 ILE HA 1 27 GLU QB 3.600 . 5.200 4.058 3.963 4.225 . 0 0 "[ . 1 . 2]" 1
170 1 26 ILE HA 1 26 ILE QG 2.900 . 3.900 2.144 2.090 2.239 . 0 0 "[ . 1 . 2]" 1
171 1 26 ILE HA 1 26 ILE HB 2.500 . 3.300 2.817 2.772 2.949 . 0 0 "[ . 1 . 2]" 1
172 1 26 ILE HA 1 26 ILE MG 2.900 . 3.900 3.036 2.809 3.103 . 0 0 "[ . 1 . 2]" 1
173 1 26 ILE HA 1 26 ILE MD 3.300 . 4.700 3.141 2.214 3.691 . 0 0 "[ . 1 . 2]" 1
174 1 94 ILE HA 1 95 HIS H 2.700 . 3.600 2.833 2.705 3.042 . 0 0 "[ . 1 . 2]" 1
175 1 72 ILE H 1 94 ILE HA 2.700 . 3.600 2.962 2.504 3.203 . 0 0 "[ . 1 . 2]" 1
176 1 94 ILE HA 1 94 ILE MG 2.700 . 3.600 2.412 2.351 2.498 . 0 0 "[ . 1 . 2]" 1
177 1 69 SER HA 1 70 ILE H 2.800 . 3.800 2.748 2.347 2.967 . 0 0 "[ . 1 . 2]" 1
178 1 69 SER H 1 69 SER HA 2.700 . 3.600 2.268 2.258 2.274 . 0 0 "[ . 1 . 2]" 1
179 1 84 LEU H 1 84 LEU HA 2.600 . 3.400 2.839 2.816 2.871 . 0 0 "[ . 1 . 2]" 1
180 1 84 LEU HA 1 87 ASN H 2.600 . 3.500 3.061 2.631 3.264 . 0 0 "[ . 1 . 2]" 1
181 1 84 LEU HA 1 84 LEU QB 2.600 . 3.400 2.451 2.426 2.474 . 0 0 "[ . 1 . 2]" 1
182 1 84 LEU HA 1 84 LEU HG 2.600 . 3.400 2.741 2.613 2.885 . 0 0 "[ . 1 . 2]" 1
183 1 84 LEU HA 1 84 LEU MD1 3.600 . 5.200 3.762 3.708 3.802 . 0 0 "[ . 1 . 2]" 1
184 1 84 LEU HA 1 84 LEU MD2 2.500 . 3.300 1.857 1.687 1.991 0.013 11 0 "[ . 1 . 2]" 1
185 1 10 TRP HE1 1 12 GLU HA 2.600 . 3.500 2.723 2.525 2.938 . 0 0 "[ . 1 . 2]" 1
186 1 12 GLU H 1 12 GLU HA 2.700 . 3.600 2.793 2.716 2.857 . 0 0 "[ . 1 . 2]" 1
187 1 11 ASN HA 1 12 GLU HA 3.500 . 5.000 4.488 4.427 4.559 . 0 0 "[ . 1 . 2]" 1
188 1 12 GLU HA 1 12 GLU HB2 2.700 . 3.600 2.602 2.412 3.020 . 0 0 "[ . 1 . 2]" 1
189 1 12 GLU HA 1 12 GLU HB3 2.800 . 3.800 2.406 2.232 2.991 . 0 0 "[ . 1 . 2]" 1
190 1 72 ILE HA 1 72 ILE HB 2.500 . 3.300 3.030 3.020 3.038 . 0 0 "[ . 1 . 2]" 1
191 1 37 MET H 1 72 ILE HA 2.400 . 3.100 2.177 1.992 2.338 . 0 0 "[ . 1 . 2]" 1
192 1 72 ILE HA 1 73 ILE H 2.400 . 3.100 2.244 2.224 2.274 . 0 0 "[ . 1 . 2]" 1
193 1 37 MET HB3 1 72 ILE HA 3.100 . 4.300 3.848 2.416 4.146 . 0 0 "[ . 1 . 2]" 1
194 1 72 ILE HA 1 73 ILE HB 3.000 . 6.000 4.458 4.374 4.531 . 0 0 "[ . 1 . 2]" 1
195 1 72 ILE HA 1 73 ILE QG 2.900 . 3.900 3.953 3.833 4.008 0.108 15 0 "[ . 1 . 2]" 1
196 1 72 ILE HA 1 72 ILE HG12 2.400 . 3.100 2.346 2.274 2.411 . 0 0 "[ . 1 . 2]" 1
197 1 72 ILE HA 1 72 ILE MG 2.600 . 3.500 2.553 2.512 2.601 . 0 0 "[ . 1 . 2]" 1
198 1 72 ILE HA 1 72 ILE MD 3.400 . 4.800 3.714 3.675 3.755 . 0 0 "[ . 1 . 2]" 1
199 1 23 GLU H 1 23 GLU HA 2.700 . 3.600 2.892 2.845 2.944 . 0 0 "[ . 1 . 2]" 1
200 1 23 GLU HA 1 24 ALA H 2.900 . 3.900 3.423 3.281 3.505 . 0 0 "[ . 1 . 2]" 1
201 1 23 GLU HA 1 23 GLU QG 3.300 . 4.600 2.791 2.431 3.087 . 0 0 "[ . 1 . 2]" 1
202 1 23 GLU HA 1 23 GLU HB3 2.600 . 3.400 2.435 2.383 2.511 . 0 0 "[ . 1 . 2]" 1
203 1 57 LEU HA 1 57 LEU HB3 2.400 . 3.100 2.467 2.440 2.506 . 0 0 "[ . 1 . 2]" 1
204 1 57 LEU HA 1 57 LEU HG 2.800 . 3.800 3.032 2.990 3.069 . 0 0 "[ . 1 . 2]" 1
205 1 57 LEU H 1 57 LEU HA 2.600 . 3.500 2.824 2.804 2.844 . 0 0 "[ . 1 . 2]" 1
206 1 57 LEU HA 1 60 ALA H 2.700 . 3.600 3.384 3.242 3.582 . 0 0 "[ . 1 . 2]" 1
207 1 57 LEU HA 1 58 CYS HA 2.900 . 6.000 4.798 4.758 4.821 . 0 0 "[ . 1 . 2]" 1
208 1 57 LEU HA 1 60 ALA MB 2.700 . 3.600 2.719 2.510 2.925 . 0 0 "[ . 1 . 2]" 1
209 1 57 LEU HA 1 57 LEU MD1 3.600 . 5.200 3.903 3.870 3.918 . 0 0 "[ . 1 . 2]" 1
210 1 8 ILE HA 1 9 VAL H 2.500 . 3.300 2.115 2.054 2.161 . 0 0 "[ . 1 . 2]" 1
211 1 8 ILE HA 1 8 ILE HB 2.700 . 3.600 3.017 3.008 3.025 . 0 0 "[ . 1 . 2]" 1
212 1 8 ILE HA 1 8 ILE MG 2.600 . 3.400 2.303 2.230 2.508 . 0 0 "[ . 1 . 2]" 1
213 1 8 ILE HA 1 8 ILE MD 2.600 . 3.400 2.330 2.129 2.946 . 0 0 "[ . 1 . 2]" 1
214 1 8 ILE HA 1 20 GLU H 2.900 . 4.000 3.644 3.218 3.960 . 0 0 "[ . 1 . 2]" 1
215 1 8 ILE H 1 8 ILE HA 2.600 . 3.400 2.898 2.879 2.919 . 0 0 "[ . 1 . 2]" 1
216 1 7 LYS HA 1 8 ILE HA 3.200 . 4.500 4.404 4.381 4.419 . 0 0 "[ . 1 . 2]" 1
217 1 96 SER QB 1 102 SER HA 2.100 . 6.000 4.561 2.939 5.699 . 0 0 "[ . 1 . 2]" 1
218 1 102 SER HA 1 103 ILE H 2.800 . 3.800 2.747 2.037 3.572 . 0 0 "[ . 1 . 2]" 1
219 1 101 SER HA 1 101 SER QB 2.900 . 3.900 2.315 2.151 2.467 . 0 0 "[ . 1 . 2]" 1
220 1 100 LYS QD 1 101 SER HA 2.900 . 6.000 3.863 2.820 4.803 . 0 0 "[ . 1 . 2]" 1
221 1 53 LEU HA 1 56 HIS QB 3.500 . 5.000 2.076 1.813 2.252 0.187 9 0 "[ . 1 . 2]" 1
222 1 53 LEU H 1 53 LEU HA 2.600 . 3.400 2.755 2.735 2.770 . 0 0 "[ . 1 . 2]" 1
223 1 53 LEU HA 1 56 HIS H 3.000 . 4.100 3.192 3.025 3.450 . 0 0 "[ . 1 . 2]" 1
224 1 53 LEU HA 1 56 HIS HD2 2.600 . 3.500 3.180 2.034 3.545 0.045 11 0 "[ . 1 . 2]" 1
225 1 17 PHE HA 1 18 GLU H 2.500 . 3.300 2.221 2.104 2.492 . 0 0 "[ . 1 . 2]" 1
226 1 11 ASN H 1 17 PHE HA 2.800 . 3.800 2.703 2.472 3.111 . 0 0 "[ . 1 . 2]" 1
227 1 17 PHE HA 1 17 PHE QD 2.600 . 3.400 2.499 2.276 2.758 . 0 0 "[ . 1 . 2]" 1
228 1 17 PHE HA 1 17 PHE HB3 2.400 . 3.100 2.442 2.408 2.473 . 0 0 "[ . 1 . 2]" 1
229 1 17 PHE HA 1 17 PHE HB2 2.900 . 3.900 3.026 3.023 3.030 . 0 0 "[ . 1 . 2]" 1
230 1 9 VAL HB 1 17 PHE HA 3.000 . 6.000 5.140 4.730 5.915 . 0 0 "[ . 1 . 2]" 1
231 1 73 ILE H 1 73 ILE HA 2.400 . 3.100 2.942 2.928 2.952 . 0 0 "[ . 1 . 2]" 1
232 1 73 ILE HA 1 95 HIS QB 3.800 . 5.600 5.489 5.398 5.583 . 0 0 "[ . 1 . 2]" 1
233 1 73 ILE HA 1 94 ILE HB 2.700 . 3.600 3.321 3.010 3.649 0.049 2 0 "[ . 1 . 2]" 1
234 1 73 ILE HA 1 74 PRO HG3 3.500 . 5.000 3.935 3.820 4.043 . 0 0 "[ . 1 . 2]" 1
235 1 73 ILE HA 1 73 ILE MG 2.700 . 3.600 2.526 2.484 2.558 . 0 0 "[ . 1 . 2]" 1
236 1 47 PHE HA 1 49 ARG H 3.000 . 6.000 4.522 4.332 5.286 . 0 0 "[ . 1 . 2]" 1
237 1 47 PHE HA 1 47 PHE QB 2.700 . 3.600 2.367 2.315 2.431 . 0 0 "[ . 1 . 2]" 1
238 1 47 PHE HA 1 48 LYS HB2 3.200 . 6.000 5.670 5.519 6.015 0.015 17 0 "[ . 1 . 2]" 1
239 1 96 SER HA 1 97 GLU H 2.900 . 3.900 3.250 2.165 3.576 . 0 0 "[ . 1 . 2]" 1
240 1 43 TYR H 1 43 TYR HA 2.700 . 3.600 2.924 2.912 2.950 . 0 0 "[ . 1 . 2]" 1
241 1 43 TYR HA 1 44 VAL H 2.700 . 3.600 2.199 2.116 2.259 . 0 0 "[ . 1 . 2]" 1
242 1 43 TYR HA 1 43 TYR QD 2.700 . 3.600 2.292 1.714 3.057 0.086 3 0 "[ . 1 . 2]" 1
243 1 43 TYR HA 1 43 TYR HB3 2.800 . 3.800 2.958 2.493 3.012 . 0 0 "[ . 1 . 2]" 1
244 1 43 TYR HA 1 44 VAL HB 3.000 . 6.000 4.391 4.241 4.615 . 0 0 "[ . 1 . 2]" 1
245 1 43 TYR HA 1 43 TYR HB2 2.700 . 3.600 2.654 2.568 3.025 . 0 0 "[ . 1 . 2]" 1
246 1 43 TYR HA 1 44 VAL QG 3.000 . 4.200 3.461 3.244 3.710 . 0 0 "[ . 1 . 2]" 1
247 1 44 VAL H 1 44 VAL HA 2.500 . 3.300 2.884 2.846 2.938 . 0 0 "[ . 1 . 2]" 1
248 1 24 ALA HA 1 44 VAL HA 2.600 . 3.400 2.474 2.254 2.674 . 0 0 "[ . 1 . 2]" 1
249 1 44 VAL HA 1 45 PRO HD3 2.300 . 2.900 2.141 1.695 2.523 0.005 17 0 "[ . 1 . 2]" 1
250 1 24 ALA MB 1 44 VAL HA 2.300 . 2.900 1.834 1.691 1.998 0.009 3 0 "[ . 1 . 2]" 1
251 1 44 VAL HA 1 44 VAL QG 2.600 . 3.400 2.295 2.151 2.349 . 0 0 "[ . 1 . 2]" 1
252 1 95 HIS H 1 95 HIS HA 2.700 . 3.600 2.844 2.754 2.915 . 0 0 "[ . 1 . 2]" 1
253 1 95 HIS HA 1 96 SER H 3.100 . 4.300 3.550 3.372 3.632 . 0 0 "[ . 1 . 2]" 1
254 1 49 ARG H 1 49 ARG HA 2.600 . 3.500 2.788 2.272 2.853 . 0 0 "[ . 1 . 2]" 1
255 1 49 ARG HA 1 49 ARG HB3 2.500 . 3.300 2.491 2.365 2.590 . 0 0 "[ . 1 . 2]" 1
256 1 49 ARG HA 1 49 ARG QG 2.900 . 3.900 2.847 2.333 3.353 . 0 0 "[ . 1 . 2]" 1
257 1 44 VAL QG 1 49 ARG HA 2.900 . 4.000 2.076 1.542 3.243 0.258 9 0 "[ . 1 . 2]" 1
258 1 15 ARG H 1 15 ARG HA 2.400 . 3.100 2.274 2.262 2.284 . 0 0 "[ . 1 . 2]" 1
259 1 15 ARG HA 1 15 ARG HB3 2.400 . 3.100 2.449 2.379 2.533 . 0 0 "[ . 1 . 2]" 1
260 1 15 ARG HA 1 15 ARG QG 3.100 . 4.300 2.539 2.388 2.921 . 0 0 "[ . 1 . 2]" 1
261 1 15 ARG HA 1 15 ARG HB2 2.900 . 4.000 3.024 3.014 3.028 . 0 0 "[ . 1 . 2]" 1
262 1 25 PHE HA 1 25 PHE QB 2.500 . 3.300 2.179 2.174 2.185 . 0 0 "[ . 1 . 2]" 1
263 1 18 GLU QB 1 25 PHE HA 3.500 . 5.000 4.172 3.333 4.620 . 0 0 "[ . 1 . 2]" 1
264 1 25 PHE HA 1 57 LEU MD1 2.500 . 3.300 2.693 2.464 2.914 . 0 0 "[ . 1 . 2]" 1
265 1 25 PHE HA 1 26 ILE H 2.500 . 3.300 2.329 2.253 2.411 . 0 0 "[ . 1 . 2]" 1
266 1 25 PHE H 1 25 PHE HA 2.600 . 3.400 2.877 2.853 2.895 . 0 0 "[ . 1 . 2]" 1
267 1 19 THR H 1 25 PHE HA 2.800 . 3.800 3.130 2.968 3.397 . 0 0 "[ . 1 . 2]" 1
268 1 25 PHE HA 1 57 LEU MD2 2.600 . 3.400 2.571 2.358 2.991 . 0 0 "[ . 1 . 2]" 1
269 1 41 HIS HA 1 42 THR H 2.500 . 3.300 2.197 2.076 2.271 . 0 0 "[ . 1 . 2]" 1
270 1 41 HIS H 1 41 HIS HA 2.500 . 3.300 2.262 2.246 2.287 . 0 0 "[ . 1 . 2]" 1
271 1 41 HIS HA 1 41 HIS HD2 2.800 . 3.800 3.078 2.490 3.813 0.013 11 0 "[ . 1 . 2]" 1
272 1 26 ILE HA 1 41 HIS HA 3.100 . 6.000 5.472 5.299 5.683 . 0 0 "[ . 1 . 2]" 1
273 1 41 HIS HA 1 41 HIS HB3 2.900 . 3.900 3.011 2.966 3.024 . 0 0 "[ . 1 . 2]" 1
274 1 41 HIS HA 1 76 CYS HB3 3.300 . 6.000 5.149 4.952 5.480 . 0 0 "[ . 1 . 2]" 1
275 1 41 HIS HA 1 76 CYS HB2 3.600 . 6.000 6.077 5.631 6.158 0.158 13 0 "[ . 1 . 2]" 1
276 1 90 TRP H 1 90 TRP HA 2.500 . 3.300 2.944 2.935 2.948 . 0 0 "[ . 1 . 2]" 1
277 1 62 PHE QD 1 90 TRP HA 3.300 . 4.700 4.702 4.591 4.785 0.085 18 0 "[ . 1 . 2]" 1
278 1 90 TRP HA 1 90 TRP HB3 2.400 . 3.100 2.358 2.325 2.391 . 0 0 "[ . 1 . 2]" 1
279 1 90 TRP HA 1 90 TRP HB2 2.900 . 4.000 3.008 2.995 3.016 . 0 0 "[ . 1 . 2]" 1
280 1 90 TRP HA 1 93 LEU HG 2.600 . 3.400 2.821 2.610 3.023 . 0 0 "[ . 1 . 2]" 1
281 1 90 TRP HA 1 92 PRO HG3 3.700 . 5.500 5.221 4.305 5.994 0.494 17 0 "[ . 1 . 2]" 1
282 1 90 TRP HA 1 93 LEU MD1 2.800 . 3.800 2.591 2.400 2.861 . 0 0 "[ . 1 . 2]" 1
283 1 90 TRP HA 1 93 LEU MD2 3.200 . 4.500 4.210 4.047 4.375 . 0 0 "[ . 1 . 2]" 1
284 1 68 HIS HA 1 68 HIS HD1 2.900 . 4.000 3.407 2.601 4.024 0.024 3 0 "[ . 1 . 2]" 1
285 1 68 HIS HA 1 68 HIS HB3 2.900 . 4.000 3.013 2.998 3.025 . 0 0 "[ . 1 . 2]" 1
286 1 68 HIS HA 1 68 HIS HB2 2.700 . 3.600 2.581 2.536 2.627 . 0 0 "[ . 1 . 2]" 1
287 1 35 LYS H 1 35 LYS HA 2.700 . 3.600 2.926 2.906 2.951 . 0 0 "[ . 1 . 2]" 1
288 1 35 LYS HA 1 35 LYS HB3 2.600 . 3.400 2.464 2.387 2.506 . 0 0 "[ . 1 . 2]" 1
289 1 35 LYS HA 1 35 LYS HD3 2.400 . 3.100 2.118 1.831 3.765 0.665 8 1 "[ . + 1 . 2]" 1
290 1 35 LYS HA 1 35 LYS QG 3.500 . 4.000 2.979 2.814 3.161 . 0 0 "[ . 1 . 2]" 1
291 1 35 LYS HA 1 70 ILE MG 2.600 . 3.500 2.869 2.390 3.358 . 0 0 "[ . 1 . 2]" 1
292 1 22 HIS H 1 22 HIS HA 2.500 . 3.300 2.249 2.239 2.262 . 0 0 "[ . 1 . 2]" 1
293 1 22 HIS HA 1 24 ALA H 3.200 . 4.400 3.874 3.410 4.407 0.007 17 0 "[ . 1 . 2]" 1
294 1 18 GLU HA 1 22 HIS HA 3.100 . 4.300 4.136 3.780 4.357 0.057 2 0 "[ . 1 . 2]" 1
295 1 19 THR HA 1 22 HIS HA 3.300 . 6.000 4.952 4.732 5.193 . 0 0 "[ . 1 . 2]" 1
296 1 22 HIS HA 1 22 HIS HB3 2.600 . 3.400 2.507 2.462 2.568 . 0 0 "[ . 1 . 2]" 1
297 1 22 HIS HA 1 22 HIS HB2 3.000 . 4.200 3.017 2.995 3.026 . 0 0 "[ . 1 . 2]" 1
298 1 18 GLU QB 1 22 HIS HA 2.700 . 3.600 2.928 2.061 3.532 . 0 0 "[ . 1 . 2]" 1
299 1 97 GLU HA 1 98 VAL H 2.700 . 3.600 3.063 2.926 3.337 . 0 0 "[ . 1 . 2]" 1
300 1 7 LYS H 1 7 LYS HA 2.600 . 3.500 2.942 2.911 2.956 . 0 0 "[ . 1 . 2]" 1
301 1 7 LYS HA 1 7 LYS HG2 2.900 . 4.000 3.377 2.940 3.754 . 0 0 "[ . 1 . 2]" 1
302 1 7 LYS HA 1 9 VAL QG 3.000 . 6.000 4.799 4.432 5.053 . 0 0 "[ . 1 . 2]" 1
303 1 100 LYS HA 1 101 SER H 2.800 . 3.800 3.070 2.197 3.550 . 0 0 "[ . 1 . 2]" 1
304 1 100 LYS H 1 100 LYS HA 2.600 . 3.400 2.810 2.275 2.960 . 0 0 "[ . 1 . 2]" 1
305 1 100 LYS HA 1 100 LYS HG3 3.200 . 4.500 3.613 3.450 3.751 . 0 0 "[ . 1 . 2]" 1
306 1 86 ARG HA 1 87 ASN H 2.900 . 4.000 3.536 3.489 3.563 . 0 0 "[ . 1 . 2]" 1
307 1 86 ARG H 1 86 ARG HA 2.800 . 3.800 2.853 2.824 2.867 . 0 0 "[ . 1 . 2]" 1
308 1 96 SER QB 1 97 GLU HA 3.100 . 6.000 4.487 4.159 5.245 . 0 0 "[ . 1 . 2]" 1
309 1 86 ARG HA 1 86 ARG HD3 3.600 . 5.200 4.656 4.332 4.773 . 0 0 "[ . 1 . 2]" 1
310 1 65 ALA HA 1 66 SER H 2.900 . 3.900 3.575 3.564 3.590 . 0 0 "[ . 1 . 2]" 1
311 1 65 ALA H 1 65 ALA HA 2.600 . 3.400 2.842 2.799 2.860 . 0 0 "[ . 1 . 2]" 1
312 1 64 HIS H 1 65 ALA HA 3.300 . 6.000 5.215 5.150 5.274 . 0 0 "[ . 1 . 2]" 1
313 1 65 ALA HA 1 70 ILE HB 2.400 . 3.100 2.192 1.691 2.454 0.009 2 0 "[ . 1 . 2]" 1
314 1 65 ALA HA 1 70 ILE MD 2.600 . 3.500 2.372 1.999 2.740 . 0 0 "[ . 1 . 2]" 1
315 1 65 ALA HA 1 70 ILE H 2.900 . 4.000 3.422 3.112 3.870 . 0 0 "[ . 1 . 2]" 1
316 1 65 ALA HA 1 68 HIS HB2 3.000 . 4.100 3.978 3.584 4.154 0.054 16 0 "[ . 1 . 2]" 1
317 1 54 ALA H 1 54 ALA HA 2.600 . 3.500 2.764 2.737 2.783 . 0 0 "[ . 1 . 2]" 1
318 1 54 ALA HA 1 55 SER H 2.900 . 3.900 3.542 3.510 3.571 . 0 0 "[ . 1 . 2]" 1
319 1 54 ALA HA 1 58 CYS H 3.000 . 6.000 4.804 4.525 4.892 . 0 0 "[ . 1 . 2]" 1
320 1 53 LEU HA 1 54 ALA HA 2.900 . 6.000 4.860 4.797 4.920 . 0 0 "[ . 1 . 2]" 1
321 1 54 ALA HA 1 57 LEU HB3 3.500 . 5.000 4.787 4.599 4.980 . 0 0 "[ . 1 . 2]" 1
322 1 53 LEU HG 1 54 ALA HA 3.500 . 6.000 5.645 3.185 5.910 . 0 0 "[ . 1 . 2]" 1
323 1 54 ALA HA 1 57 LEU HB2 2.700 . 3.600 3.398 3.175 3.544 . 0 0 "[ . 1 . 2]" 1
324 1 54 ALA HA 1 57 LEU MD1 2.500 . 3.300 2.049 1.862 2.296 . 0 0 "[ . 1 . 2]" 1
325 1 29 LYS HA 1 30 MET H 2.600 . 3.400 2.223 2.096 2.490 . 0 0 "[ . 1 . 2]" 1
326 1 28 TYR QD 1 29 LYS HA 2.700 . 3.600 3.223 2.586 3.658 0.058 10 0 "[ . 1 . 2]" 1
327 1 29 LYS HA 1 30 MET HG3 3.300 . 4.600 3.853 3.129 5.513 0.913 11 3 "[ .- 1+ * 2]" 1
328 1 29 LYS HA 1 29 LYS HB3 2.500 . 3.300 2.387 2.266 2.460 . 0 0 "[ . 1 . 2]" 1
329 1 29 LYS HA 1 29 LYS HB2 2.700 . 3.600 2.557 2.455 3.019 . 0 0 "[ . 1 . 2]" 1
330 1 29 LYS HA 1 29 LYS HG2 3.400 . 4.800 3.632 2.820 3.803 . 0 0 "[ . 1 . 2]" 1
331 1 10 TRP HA 1 11 ASN H 2.400 . 3.100 2.107 2.059 2.134 . 0 0 "[ . 1 . 2]" 1
332 1 10 TRP HA 1 10 TRP HB3 2.900 . 4.000 3.022 3.018 3.026 . 0 0 "[ . 1 . 2]" 1
333 1 28 TYR HA 1 29 LYS H 2.500 . 3.300 2.328 2.219 2.454 . 0 0 "[ . 1 . 2]" 1
334 1 28 TYR HA 1 40 VAL H 2.400 . 3.100 2.388 2.192 2.612 . 0 0 "[ . 1 . 2]" 1
335 1 28 TYR HA 1 39 LEU HA 2.700 . 3.600 2.818 2.433 3.134 . 0 0 "[ . 1 . 2]" 1
336 1 28 TYR HA 1 38 ASP QB 2.900 . 6.000 3.996 3.741 4.221 . 0 0 "[ . 1 . 2]" 1
337 1 28 TYR HA 1 28 TYR HB3 2.600 . 3.400 2.500 2.442 2.556 . 0 0 "[ . 1 . 2]" 1
338 1 28 TYR HA 1 28 TYR HB2 2.500 . 3.300 2.408 2.367 2.443 . 0 0 "[ . 1 . 2]" 1
339 1 28 TYR HA 1 40 VAL HB 2.800 . 3.800 3.315 3.151 3.805 0.005 8 0 "[ . 1 . 2]" 1
340 1 28 TYR HA 1 29 LYS HB3 2.800 . 6.000 4.615 4.337 5.425 . 0 0 "[ . 1 . 2]" 1
341 1 28 TYR HA 1 29 LYS QD 3.200 . 4.500 3.015 2.443 4.498 . 0 0 "[ . 1 . 2]" 1
342 1 28 TYR HA 1 29 LYS HG2 3.300 . 4.700 4.385 2.906 4.792 0.092 5 0 "[ . 1 . 2]" 1
343 1 28 TYR HA 1 40 VAL QG 2.800 . 3.800 2.687 1.789 3.498 0.211 8 0 "[ . 1 . 2]" 1
344 1 10 TRP HA 1 10 TRP HD1 2.500 . 3.300 2.325 2.254 2.394 . 0 0 "[ . 1 . 2]" 1
345 1 10 TRP HA 1 18 GLU H 3.100 . 4.300 3.531 3.280 3.870 . 0 0 "[ . 1 . 2]" 1
346 1 10 TRP HA 1 17 PHE QD 2.400 . 3.100 2.117 1.846 2.393 . 0 0 "[ . 1 . 2]" 1
347 1 10 TRP HA 1 17 PHE HA 2.400 . 3.100 2.252 2.154 2.362 . 0 0 "[ . 1 . 2]" 1
348 1 93 LEU HA 1 93 LEU HB3 2.500 . 3.300 2.324 2.292 2.357 . 0 0 "[ . 1 . 2]" 1
349 1 93 LEU HA 1 93 LEU HB2 2.900 . 3.900 3.012 2.999 3.019 . 0 0 "[ . 1 . 2]" 1
350 1 48 LYS H 1 48 LYS HA 2.700 . 3.600 2.940 2.926 2.950 . 0 0 "[ . 1 . 2]" 1
351 1 48 LYS HA 1 49 ARG H 2.700 . 3.600 3.037 2.610 3.563 . 0 0 "[ . 1 . 2]" 1
352 1 48 LYS HA 1 48 LYS HB3 2.500 . 3.300 2.501 2.375 2.580 . 0 0 "[ . 1 . 2]" 1
353 1 48 LYS HA 1 48 LYS HD2 3.500 . 5.000 4.393 2.744 4.773 . 0 0 "[ . 1 . 2]" 1
354 1 48 LYS HA 1 48 LYS HB2 2.800 . 3.800 3.020 3.009 3.028 . 0 0 "[ . 1 . 2]" 1
355 1 48 LYS HA 1 51 LEU QD 3.000 . 4.100 2.412 1.845 2.849 0.055 6 0 "[ . 1 . 2]" 1
356 1 44 VAL QG 1 48 LYS HA 3.200 . 4.500 3.809 3.670 4.058 . 0 0 "[ . 1 . 2]" 1
357 1 60 ALA HA 1 63 GLU H 2.800 . 3.800 3.366 3.133 3.570 . 0 0 "[ . 1 . 2]" 1
358 1 60 ALA HA 1 64 HIS H 2.900 . 6.000 4.322 4.183 4.501 . 0 0 "[ . 1 . 2]" 1
359 1 60 ALA H 1 60 ALA HA 2.800 . 3.800 2.807 2.783 2.837 . 0 0 "[ . 1 . 2]" 1
360 1 60 ALA HA 1 61 ALA H 2.900 . 4.000 3.547 3.513 3.579 . 0 0 "[ . 1 . 2]" 1
361 1 60 ALA HA 1 64 HIS QB 3.200 . 6.000 4.934 4.633 5.474 . 0 0 "[ . 1 . 2]" 1
362 1 60 ALA HA 1 63 GLU HG2 2.900 . 3.900 3.692 3.355 3.938 0.038 6 0 "[ . 1 . 2]" 1
363 1 60 ALA HA 1 63 GLU HB2 3.600 . 5.200 2.796 2.570 3.106 . 0 0 "[ . 1 . 2]" 1
364 1 59 VAL MG1 1 60 ALA HA 2.800 . 3.800 3.405 3.281 3.555 . 0 0 "[ . 1 . 2]" 1
365 1 60 ALA HA 1 63 GLU HG3 2.800 . 3.800 2.755 2.206 3.399 . 0 0 "[ . 1 . 2]" 1
366 1 27 GLU H 1 27 GLU HA 2.600 . 3.500 2.943 2.933 2.958 . 0 0 "[ . 1 . 2]" 1
367 1 27 GLU HA 1 28 TYR H 2.600 . 3.400 2.388 2.280 2.498 . 0 0 "[ . 1 . 2]" 1
368 1 27 GLU HA 1 28 TYR QD 2.900 . 4.000 3.810 3.600 4.045 0.045 17 0 "[ . 1 . 2]" 1
369 1 27 GLU HA 1 27 GLU HG3 2.600 . 3.400 2.538 2.147 2.770 . 0 0 "[ . 1 . 2]" 1
370 1 16 ARG QB 1 27 GLU HA 2.500 . 3.300 2.051 1.721 2.519 0.079 11 0 "[ . 1 . 2]" 1
371 1 16 ARG QG 1 27 GLU HA 3.600 . 5.200 4.134 3.842 4.496 . 0 0 "[ . 1 . 2]" 1
372 1 37 MET HA 1 70 ILE MG 3.000 . 6.000 4.053 3.795 4.286 . 0 0 "[ . 1 . 2]" 1
373 1 39 LEU HA 1 40 VAL H 2.400 . 3.100 2.131 2.093 2.184 . 0 0 "[ . 1 . 2]" 1
374 1 39 LEU HA 1 39 LEU HB2 2.600 . 3.500 3.007 3.000 3.017 . 0 0 "[ . 1 . 2]" 1
375 1 39 LEU HA 1 39 LEU MD1 2.500 . 3.300 2.311 2.178 2.410 . 0 0 "[ . 1 . 2]" 1
376 1 39 LEU HA 1 39 LEU HG 2.600 . 3.400 2.679 2.632 2.747 . 0 0 "[ . 1 . 2]" 1
377 1 39 LEU HA 1 75 SER QB 3.300 . 6.000 5.246 5.045 5.436 . 0 0 "[ . 1 . 2]" 1
378 1 39 LEU HA 1 74 PRO HB3 3.700 . 6.000 5.705 5.257 5.901 . 0 0 "[ . 1 . 2]" 1
379 1 51 LEU H 1 51 LEU HA 2.800 . 3.800 2.902 2.857 2.950 . 0 0 "[ . 1 . 2]" 1
380 1 51 LEU HA 1 51 LEU HB3 2.800 . 3.800 2.853 2.442 3.022 . 0 0 "[ . 1 . 2]" 1
381 1 51 LEU HA 1 51 LEU HG 2.800 . 3.800 3.105 2.526 3.685 . 0 0 "[ . 1 . 2]" 1
382 1 51 LEU HA 1 51 LEU QD 2.900 . 4.000 2.064 1.788 3.085 0.012 1 0 "[ . 1 . 2]" 1
383 1 14 LYS H 1 14 LYS HA 2.700 . 3.600 2.944 2.924 2.951 . 0 0 "[ . 1 . 2]" 1
384 1 14 LYS HA 1 14 LYS QB 2.600 . 3.400 2.390 2.290 2.527 . 0 0 "[ . 1 . 2]" 1
385 1 14 LYS HA 1 14 LYS HD3 2.600 . 3.400 2.857 1.957 4.047 0.647 10 2 "[ . - + . 2]" 1
386 1 14 LYS HA 1 14 LYS HG3 2.900 . 3.900 3.216 2.472 3.854 . 0 0 "[ . 1 . 2]" 1
387 1 61 ALA HA 1 65 ALA H 3.100 . 4.300 4.064 3.887 4.182 . 0 0 "[ . 1 . 2]" 1
388 1 61 ALA HA 1 62 PHE H 2.800 . 3.800 3.523 3.510 3.542 . 0 0 "[ . 1 . 2]" 1
389 1 61 ALA HA 1 64 HIS H 2.800 . 3.800 3.322 3.220 3.421 . 0 0 "[ . 1 . 2]" 1
390 1 61 ALA H 1 61 ALA HA 2.700 . 3.600 2.857 2.842 2.875 . 0 0 "[ . 1 . 2]" 1
391 1 28 TYR QD 1 61 ALA HA 3.100 . 6.000 4.810 4.476 5.236 . 0 0 "[ . 1 . 2]" 1
392 1 61 ALA HA 1 64 HIS QB 2.500 . 3.300 2.613 2.399 2.742 . 0 0 "[ . 1 . 2]" 1
393 1 60 ALA MB 1 61 ALA HA 3.000 . 4.100 3.928 3.864 3.987 . 0 0 "[ . 1 . 2]" 1
394 1 26 ILE MG 1 61 ALA HA 3.300 . 4.700 4.652 4.331 4.864 0.164 19 0 "[ . 1 . 2]" 1
395 1 18 GLU HA 1 25 PHE QB 3.100 . 3.100 2.482 2.177 2.684 . 0 0 "[ . 1 . 2]" 1
396 1 18 GLU HA 1 19 THR MG 3.400 . 4.900 3.882 3.584 4.157 . 0 0 "[ . 1 . 2]" 1
397 1 8 ILE MG 1 18 GLU HA 2.800 . 3.800 3.670 3.216 3.844 0.044 10 0 "[ . 1 . 2]" 1
398 1 18 GLU HA 1 57 LEU MD2 2.900 . 3.900 3.323 3.032 3.558 . 0 0 "[ . 1 . 2]" 1
399 1 18 GLU HA 1 19 THR H 2.400 . 3.100 2.155 2.116 2.261 . 0 0 "[ . 1 . 2]" 1
400 1 33 ASN HA 1 34 GLY H 2.900 . 3.900 3.203 2.983 3.414 . 0 0 "[ . 1 . 2]" 1
401 1 31 ARG QB 1 32 ASN HA 3.900 . 5.800 4.095 3.955 4.243 . 0 0 "[ . 1 . 2]" 1
402 1 32 ASN H 1 32 ASN HA 2.600 . 3.500 2.273 2.266 2.278 . 0 0 "[ . 1 . 2]" 1
403 1 32 ASN HA 1 32 ASN QB 2.900 . 3.600 2.437 2.397 2.496 . 0 0 "[ . 1 . 2]" 1
404 1 30 MET HA 1 31 ARG H 2.500 . 3.300 2.095 2.058 2.128 . 0 0 "[ . 1 . 2]" 1
405 1 30 MET H 1 30 MET HA 2.600 . 3.500 2.908 2.875 2.953 . 0 0 "[ . 1 . 2]" 1
406 1 30 MET HA 1 72 ILE HA 3.600 . 6.000 6.193 6.089 6.278 0.278 12 0 "[ . 1 . 2]" 1
407 1 30 MET HA 1 37 MET HA 2.500 . 3.300 2.293 2.108 2.533 . 0 0 "[ . 1 . 2]" 1
408 1 30 MET HA 1 30 MET HG3 3.000 . 4.100 3.229 3.025 3.746 . 0 0 "[ . 1 . 2]" 1
409 1 30 MET HA 1 30 MET HG2 2.700 . 3.600 2.792 2.504 3.791 0.191 11 0 "[ . 1 . 2]" 1
410 1 30 MET HA 1 30 MET HB3 2.500 . 3.300 2.441 2.371 2.485 . 0 0 "[ . 1 . 2]" 1
411 1 30 MET HA 1 30 MET HB2 2.800 . 3.800 2.947 2.416 3.038 . 0 0 "[ . 1 . 2]" 1
412 1 30 MET HA 1 31 ARG QB 3.200 . 4.500 4.268 4.029 4.373 . 0 0 "[ . 1 . 2]" 1
413 1 29 LYS HB2 1 30 MET HA 2.900 . 6.000 4.807 4.478 4.974 . 0 0 "[ . 1 . 2]" 1
414 1 21 ASP HA 1 22 HIS H 2.800 . 3.800 3.397 3.311 3.453 . 0 0 "[ . 1 . 2]" 1
415 1 21 ASP H 1 21 ASP HA 2.600 . 3.400 2.926 2.900 2.953 . 0 0 "[ . 1 . 2]" 1
416 1 21 ASP HA 1 21 ASP HB2 2.900 . 4.000 2.431 2.223 2.685 . 0 0 "[ . 1 . 2]" 1
417 1 21 ASP HA 1 21 ASP HB3 2.700 . 3.600 2.974 2.565 3.026 . 0 0 "[ . 1 . 2]" 1
418 1 21 ASP HA 1 23 GLU QG 3.100 . 4.300 4.297 4.143 4.381 0.081 15 0 "[ . 1 . 2]" 1
419 1 20 GLU QB 1 21 ASP HA 2.800 . 6.000 4.466 4.200 4.647 . 0 0 "[ . 1 . 2]" 1
420 1 21 ASP HA 1 22 HIS HD2 2.800 . 3.800 3.587 3.289 3.838 0.038 5 0 "[ . 1 . 2]" 1
421 1 2 ALA HA 1 2 ALA MB 2.900 . 3.900 2.130 2.124 2.135 . 0 0 "[ . 1 . 2]" 1
422 1 2 ALA HA 1 3 THR H 3.000 . 4.100 3.365 2.914 3.579 . 0 0 "[ . 1 . 2]" 1
423 1 38 ASP HA 1 39 LEU H 2.400 . 3.100 2.116 2.100 2.139 . 0 0 "[ . 1 . 2]" 1
424 1 38 ASP HA 1 73 ILE H 2.400 . 3.100 2.528 2.426 2.672 . 0 0 "[ . 1 . 2]" 1
425 1 38 ASP HA 1 39 LEU HG 3.900 . 5.800 5.901 5.844 5.957 0.157 14 0 "[ . 1 . 2]" 1
426 1 38 ASP H 1 38 ASP HA 2.600 . 3.500 2.907 2.899 2.921 . 0 0 "[ . 1 . 2]" 1
427 1 87 ASN H 1 87 ASN HA 2.800 . 3.800 2.928 2.871 2.952 . 0 0 "[ . 1 . 2]" 1
428 1 87 ASN HA 1 88 PRO HD2 2.700 . 3.600 2.684 2.598 2.804 . 0 0 "[ . 1 . 2]" 1
429 1 87 ASN HA 1 88 PRO HD3 2.700 . 3.600 2.041 1.820 2.271 . 0 0 "[ . 1 . 2]" 1
430 1 87 ASN HA 1 87 ASN QB 2.700 . 3.600 2.292 2.173 2.460 . 0 0 "[ . 1 . 2]" 1
431 1 91 LYS H 1 92 PRO HD3 2.700 . 3.600 2.918 2.485 3.373 . 0 0 "[ . 1 . 2]" 1
432 1 92 PRO HA 1 92 PRO HD3 2.900 . 4.000 3.536 3.270 3.811 . 0 0 "[ . 1 . 2]" 1
433 1 92 PRO HB2 1 92 PRO HD3 3.400 . 4.900 3.854 3.839 3.864 . 0 0 "[ . 1 . 2]" 1
434 1 91 LYS HB2 1 92 PRO HD3 2.700 . 3.600 2.895 1.890 4.087 0.487 5 0 "[ . 1 . 2]" 1
435 1 11 ASN H 1 11 ASN HA 2.700 . 3.600 2.917 2.895 2.940 . 0 0 "[ . 1 . 2]" 1
436 1 11 ASN HA 1 11 ASN QD 2.900 . 3.900 3.500 2.354 3.735 . 0 0 "[ . 1 . 2]" 1
437 1 11 ASN HA 1 12 GLU H 2.700 . 3.600 2.245 2.178 2.341 . 0 0 "[ . 1 . 2]" 1
438 1 11 ASN HA 1 11 ASN HB3 2.900 . 3.900 3.018 3.004 3.031 . 0 0 "[ . 1 . 2]" 1
439 1 11 ASN HA 1 11 ASN HB2 2.600 . 3.500 2.563 2.517 2.631 . 0 0 "[ . 1 . 2]" 1
440 1 11 ASN HA 1 12 GLU HB2 3.800 . 6.000 5.508 4.344 5.826 . 0 0 "[ . 1 . 2]" 1
441 1 11 ASN HA 1 12 GLU HB3 3.700 . 5.400 5.018 4.664 5.729 0.329 3 0 "[ . 1 . 2]" 1
442 1 87 ASN H 1 88 PRO HD3 3.600 . 5.200 3.356 3.046 3.658 . 0 0 "[ . 1 . 2]" 1
443 1 85 PRO HA 1 88 PRO HD3 3.500 . 5.000 4.478 4.029 4.916 . 0 0 "[ . 1 . 2]" 1
444 1 88 PRO HB2 1 88 PRO HD3 2.900 . 3.900 3.962 3.926 4.030 0.130 14 0 "[ . 1 . 2]" 1
445 1 88 PRO HD3 1 88 PRO HG2 2.500 . 3.300 2.681 2.661 2.715 . 0 0 "[ . 1 . 2]" 1
446 1 24 ALA HA 1 25 PHE H 2.600 . 3.500 2.177 2.130 2.250 . 0 0 "[ . 1 . 2]" 1
447 1 24 ALA H 1 24 ALA HA 2.600 . 3.400 2.929 2.899 2.944 . 0 0 "[ . 1 . 2]" 1
448 1 24 ALA HA 1 25 PHE QD 2.700 . 3.600 3.454 3.069 3.614 0.014 14 0 "[ . 1 . 2]" 1
449 1 24 ALA HA 1 45 PRO HD3 2.600 . 3.500 2.820 2.298 3.196 . 0 0 "[ . 1 . 2]" 1
450 1 84 LEU H 1 85 PRO HD3 2.800 . 3.800 2.710 2.613 3.195 . 0 0 "[ . 1 . 2]" 1
451 1 85 PRO HA 1 85 PRO HD3 2.800 . 3.800 3.713 3.473 3.783 . 0 0 "[ . 1 . 2]" 1
452 1 85 PRO HD3 1 85 PRO HG3 2.400 . 3.100 2.303 2.280 2.313 . 0 0 "[ . 1 . 2]" 1
453 1 84 LEU H 1 85 PRO HD2 2.400 . 3.100 2.412 1.916 2.540 . 0 0 "[ . 1 . 2]" 1
454 1 85 PRO HD2 1 86 ARG H 2.400 . 3.100 2.615 2.519 2.796 . 0 0 "[ . 1 . 2]" 1
455 1 6 PRO HA 1 6 PRO QD 3.000 . 4.100 3.447 3.306 3.500 . 0 0 "[ . 1 . 2]" 1
456 1 6 PRO QB 1 6 PRO QD 3.400 . 3.600 2.737 2.571 2.877 . 0 0 "[ . 1 . 2]" 1
457 1 81 ASP QB 1 85 PRO HD2 3.400 . 6.000 5.520 5.352 5.592 . 0 0 "[ . 1 . 2]" 1
458 1 84 LEU MD2 1 85 PRO HD2 3.800 . 5.600 5.191 4.755 5.335 . 0 0 "[ . 1 . 2]" 1
459 1 13 GLY HA2 1 14 LYS H 2.900 . 4.000 3.448 3.403 3.534 . 0 0 "[ . 1 . 2]" 1
460 1 12 GLU HB2 1 13 GLY HA2 3.000 . 6.000 4.457 4.093 5.442 . 0 0 "[ . 1 . 2]" 1
461 1 13 GLY H 1 13 GLY HA3 2.600 . 3.500 2.302 2.292 2.313 . 0 0 "[ . 1 . 2]" 1
462 1 13 GLY HA3 1 14 LYS H 2.700 . 3.600 3.004 2.780 3.164 . 0 0 "[ . 1 . 2]" 1
463 1 51 LEU HA 1 52 GLY HA3 3.000 . 6.000 4.490 4.349 4.575 . 0 0 "[ . 1 . 2]" 1
464 1 52 GLY H 1 52 GLY HA3 3.000 . 4.100 2.945 2.913 2.958 . 0 0 "[ . 1 . 2]" 1
465 1 52 GLY HA3 1 53 LEU H 2.700 . 3.600 3.018 2.949 3.096 . 0 0 "[ . 1 . 2]" 1
466 1 34 GLY QA 1 35 LYS H 3.100 . 3.600 2.810 2.723 2.878 . 0 0 "[ . 1 . 2]" 1
467 1 34 GLY QA 1 35 LYS HE3 3.000 . 6.000 5.618 4.105 6.623 0.623 3 3 "[ + . *1- . 2]" 1
468 1 30 MET HB3 1 34 GLY QA . . 3.100 1.886 1.575 3.251 0.425 3 0 "[ . 1 . 2]" 1
469 1 50 GLY QA 1 51 LEU H 3.100 . 3.600 2.840 2.725 2.929 . 0 0 "[ . 1 . 2]" 1
470 1 50 GLY QA 1 51 LEU HA 3.100 . 6.000 4.054 4.020 4.110 . 0 0 "[ . 1 . 2]" 1
471 1 30 MET HB2 1 34 GLY QA 2.500 . 3.300 2.391 1.610 2.798 0.090 11 0 "[ . 1 . 2]" 1
472 1 28 TYR HB3 1 29 LYS H 3.600 . 5.200 3.857 3.724 4.068 . 0 0 "[ . 1 . 2]" 1
473 1 28 TYR HB3 1 28 TYR QD 2.600 . 3.400 2.364 2.316 2.425 . 0 0 "[ . 1 . 2]" 1
474 1 28 TYR HB3 1 39 LEU HA 2.400 . 3.100 2.369 1.998 2.876 . 0 0 "[ . 1 . 2]" 1
475 1 26 ILE MD 1 28 TYR HB3 2.900 . 6.000 4.508 3.714 4.998 . 0 0 "[ . 1 . 2]" 1
476 1 28 TYR HB2 1 29 LYS H 2.400 . 3.100 2.544 2.296 2.850 . 0 0 "[ . 1 . 2]" 1
477 1 28 TYR H 1 28 TYR HB2 3.100 . 4.300 4.023 3.986 4.073 . 0 0 "[ . 1 . 2]" 1
478 1 28 TYR HB2 1 28 TYR QD 2.600 . 3.400 2.443 2.374 2.524 . 0 0 "[ . 1 . 2]" 1
479 1 28 TYR HB2 1 29 LYS HA 3.100 . 6.000 4.495 4.268 4.657 . 0 0 "[ . 1 . 2]" 1
480 1 28 TYR HB2 1 29 LYS HB3 3.200 . 6.000 5.678 5.490 6.130 0.130 2 0 "[ . 1 . 2]" 1
481 1 26 ILE MD 1 28 TYR HB2 3.500 . 6.000 5.773 5.050 6.107 0.107 20 0 "[ . 1 . 2]" 1
482 1 15 ARG QD 1 15 ARG QG 2.900 . 3.900 2.045 1.981 2.090 . 0 0 "[ . 1 . 2]" 1
483 1 14 LYS QB 1 16 ARG HD3 2.700 . 3.300 2.602 2.022 3.867 0.567 17 2 "[ . 1 .-+ 2]" 1
484 1 31 ARG HD3 1 36 VAL MG1 2.700 . 3.600 3.178 1.975 4.193 0.593 16 1 "[ . 1 .+ 2]" 1
485 1 31 ARG HA 1 31 ARG HD3 3.600 . 5.200 4.585 3.525 5.523 0.323 19 0 "[ . 1 . 2]" 1
486 1 86 ARG HD3 1 87 ASN QB 2.900 . 6.000 5.326 4.514 6.250 0.250 14 0 "[ . 1 . 2]" 1
487 1 31 ARG HD3 1 73 ILE MD 3.300 . 6.000 5.752 4.383 6.679 0.679 3 1 "[ + . 1 . 2]" 1
488 1 86 ARG H 1 86 ARG HD3 3.600 . 5.200 4.908 4.200 5.949 0.749 6 3 "[ * .+ 1 -. 2]" 1
489 1 82 THR MG 1 86 ARG HD3 2.100 . 6.000 5.214 4.157 6.169 0.169 6 0 "[ . 1 . 2]" 1
490 1 46 SER HA 1 49 ARG HD3 2.700 . 3.600 2.660 1.574 4.250 0.650 12 1 "[ . 1 + . 2]" 1
491 1 49 ARG HB3 1 49 ARG HD3 2.800 . 3.800 3.149 2.330 3.741 . 0 0 "[ . 1 . 2]" 1
492 1 49 ARG HD3 1 49 ARG QG 2.600 . 3.500 2.279 2.157 2.401 . 0 0 "[ . 1 . 2]" 1
493 1 44 VAL QG 1 49 ARG HD3 2.100 . 6.000 4.507 2.965 5.781 . 0 0 "[ . 1 . 2]" 1
494 1 49 ARG HA 1 49 ARG HD3 3.200 . 6.000 4.395 2.143 5.541 . 0 0 "[ . 1 . 2]" 1
495 1 62 PHE QD 1 93 LEU HB3 3.300 . 4.600 3.789 3.487 4.029 . 0 0 "[ . 1 . 2]" 1
496 1 62 PHE QE 1 93 LEU HB3 3.500 . 5.100 4.371 4.030 4.619 . 0 0 "[ . 1 . 2]" 1
497 1 93 LEU HA 1 93 LEU HB3 2.400 . 3.100 2.388 2.340 2.444 . 0 0 "[ . 1 . 2]" 1
498 1 93 LEU HB3 1 93 LEU MD1 2.700 . 3.600 2.419 2.385 2.483 . 0 0 "[ . 1 . 2]" 1
499 1 93 LEU HB2 1 93 LEU MD1 2.300 . 3.000 2.283 2.209 2.320 . 0 0 "[ . 1 . 2]" 1
500 1 51 LEU H 1 51 LEU HB3 2.900 . 4.000 2.925 2.407 3.666 . 0 0 "[ . 1 . 2]" 1
501 1 51 LEU HB3 1 51 LEU QD 3.000 . 4.100 2.218 2.083 2.358 . 0 0 "[ . 1 . 2]" 1
502 1 38 ASP H 1 38 ASP QB 2.700 . 3.600 2.283 2.228 2.319 . 0 0 "[ . 1 . 2]" 1
503 1 29 LYS HB3 1 38 ASP QB 3.300 . 4.700 4.404 3.910 4.630 . 0 0 "[ . 1 . 2]" 1
504 1 29 LYS HB2 1 38 ASP QB 2.900 . 3.900 2.287 1.664 2.868 0.236 6 0 "[ . 1 . 2]" 1
505 1 29 LYS HG2 1 38 ASP QB 2.800 . 3.800 2.234 1.802 4.565 0.765 14 1 "[ . 1 +. 2]" 1
506 1 28 TYR H 1 29 LYS QE 2.900 . 6.000 4.656 3.386 5.526 . 0 0 "[ . 1 . 2]" 1
507 1 29 LYS HA 1 29 LYS QE 3.800 . 5.600 4.028 3.284 5.186 . 0 0 "[ . 1 . 2]" 1
508 1 29 LYS QE 1 29 LYS HG2 3.200 . 4.500 3.257 2.563 3.473 . 0 0 "[ . 1 . 2]" 1
509 1 37 MET HA 1 38 ASP QB 3.100 . 4.300 4.041 3.977 4.115 . 0 0 "[ . 1 . 2]" 1
510 1 31 ARG HD2 1 38 ASP QB 2.800 . 3.700 2.481 2.021 3.086 . 0 0 "[ . 1 . 2]" 1
511 1 37 MET HB3 1 38 ASP QB 3.200 . 6.000 5.255 5.174 5.489 . 0 0 "[ . 1 . 2]" 1
512 1 19 THR HA 1 53 LEU QB 3.900 . 5.800 4.922 4.468 5.111 . 0 0 "[ . 1 . 2]" 1
513 1 44 VAL QG 1 53 LEU QB 2.400 . 3.100 2.221 1.978 2.463 0.022 9 0 "[ . 1 . 2]" 1
514 1 53 LEU QB 1 54 ALA H 2.400 . 3.100 2.531 2.459 2.647 . 0 0 "[ . 1 . 2]" 1
515 1 53 LEU H 1 53 LEU QB 2.600 . 3.300 2.173 2.122 2.284 . 0 0 "[ . 1 . 2]" 1
516 1 48 LYS QE 1 53 LEU QB 3.300 . 4.700 3.656 3.060 4.153 . 0 0 "[ . 1 . 2]" 1
517 1 53 LEU QB 1 53 LEU QD 2.300 . 3.000 2.044 1.917 2.060 . 0 0 "[ . 1 . 2]" 1
518 1 26 ILE HB 1 26 ILE QG 2.300 . 3.000 2.242 2.155 2.315 . 0 0 "[ . 1 . 2]" 1
519 1 26 ILE HB 1 26 ILE MG 2.400 . 3.100 2.133 2.126 2.138 . 0 0 "[ . 1 . 2]" 1
520 1 26 ILE HB 1 57 LEU MD2 3.200 . 4.500 2.989 2.741 3.276 . 0 0 "[ . 1 . 2]" 1
521 1 72 ILE H 1 72 ILE HB 2.500 . 3.300 2.732 2.671 2.777 . 0 0 "[ . 1 . 2]" 1
522 1 72 ILE HB 1 94 ILE HA 3.100 . 4.300 3.833 3.455 4.140 . 0 0 "[ . 1 . 2]" 1
523 1 72 ILE HB 1 74 PRO HB3 3.400 . 6.000 5.965 5.728 6.049 0.049 14 0 "[ . 1 . 2]" 1
524 1 72 ILE HB 1 72 ILE HG12 2.700 . 3.600 3.010 3.005 3.016 . 0 0 "[ . 1 . 2]" 1
525 1 72 ILE HB 1 72 ILE MG 2.300 . 3.000 2.119 2.115 2.123 . 0 0 "[ . 1 . 2]" 1
526 1 72 ILE HB 1 72 ILE MD 2.600 . 3.400 2.556 2.531 2.597 . 0 0 "[ . 1 . 2]" 1
527 1 25 PHE QB 1 26 ILE H . . 3.300 2.405 2.316 2.560 . 0 0 "[ . 1 . 2]" 1
528 1 18 GLU QB 1 25 PHE QB 3.200 . 4.300 3.067 2.020 3.660 . 0 0 "[ . 1 . 2]" 1
529 1 25 PHE QB 1 25 PHE QD 2.600 . 3.500 2.126 2.121 2.132 . 0 0 "[ . 1 . 2]" 1
530 1 97 GLU QB 1 100 LYS QE 2.900 . 4.000 2.697 1.682 3.816 0.118 12 0 "[ . 1 . 2]" 1
531 1 11 ASN QD 1 14 LYS QE 3.300 . 4.600 2.960 1.934 3.636 0.066 12 0 "[ . 1 . 2]" 1
532 1 14 LYS QB 1 14 LYS QE 3.400 . 4.800 3.613 2.069 3.872 . 0 0 "[ . 1 . 2]" 1
533 1 70 ILE H 1 70 ILE HB 2.500 . 3.300 2.585 2.485 2.796 . 0 0 "[ . 1 . 2]" 1
534 1 70 ILE HB 1 71 SER H 3.000 . 4.200 3.842 3.718 4.023 . 0 0 "[ . 1 . 2]" 1
535 1 64 HIS QB 1 70 ILE HB 2.100 . 6.000 5.760 5.167 5.879 . 0 0 "[ . 1 . 2]" 1
536 1 57 LEU HA 1 57 LEU HB2 2.800 . 3.800 3.024 3.018 3.030 . 0 0 "[ . 1 . 2]" 1
537 1 57 LEU HB2 1 58 CYS H 2.400 . 3.100 2.458 2.347 2.595 . 0 0 "[ . 1 . 2]" 1
538 1 39 LEU H 1 39 LEU HB3 3.300 . 4.600 3.553 3.532 3.582 . 0 0 "[ . 1 . 2]" 1
539 1 39 LEU HA 1 39 LEU HB3 2.400 . 3.100 2.601 2.584 2.615 . 0 0 "[ . 1 . 2]" 1
540 1 39 LEU HB3 1 39 LEU MD1 3.100 . 4.300 3.199 3.189 3.207 . 0 0 "[ . 1 . 2]" 1
541 1 57 LEU H 1 57 LEU HB3 3.200 . 4.400 3.585 3.570 3.595 . 0 0 "[ . 1 . 2]" 1
542 1 57 LEU HB3 1 58 CYS H 3.100 . 4.300 3.556 3.411 3.662 . 0 0 "[ . 1 . 2]" 1
543 1 57 LEU HB3 1 57 LEU MD1 2.500 . 3.300 2.451 2.409 2.488 . 0 0 "[ . 1 . 2]" 1
544 1 57 LEU HB3 1 57 LEU HG 2.700 . 3.600 3.015 3.012 3.019 . 0 0 "[ . 1 . 2]" 1
545 1 57 LEU HB3 1 57 LEU MD2 2.400 . 3.100 2.298 2.273 2.326 . 0 0 "[ . 1 . 2]" 1
546 1 39 LEU H 1 39 LEU HB2 2.300 . 3.000 2.284 2.253 2.327 . 0 0 "[ . 1 . 2]" 1
547 1 57 LEU H 1 57 LEU HB2 2.400 . 3.100 2.507 2.456 2.566 . 0 0 "[ . 1 . 2]" 1
548 1 57 LEU HB2 1 57 LEU MD1 2.500 . 3.300 2.260 2.243 2.282 . 0 0 "[ . 1 . 2]" 1
549 1 26 ILE HB 1 57 LEU HB2 3.200 . 4.500 2.865 2.498 3.811 . 0 0 "[ . 1 . 2]" 1
550 1 57 LEU HB2 1 57 LEU MD2 3.200 . 4.500 3.188 3.182 3.195 . 0 0 "[ . 1 . 2]" 1
551 1 83 PHE HB3 1 84 LEU H 2.900 . 3.900 2.992 2.671 3.788 . 0 0 "[ . 1 . 2]" 1
552 1 62 PHE QE 1 83 PHE HB3 3.300 . 4.700 4.872 4.664 5.408 0.708 7 3 "[ . + 1* .- 2]" 1
553 1 79 VAL HA 1 83 PHE HB3 2.600 . 6.000 3.905 3.536 4.662 . 0 0 "[ . 1 . 2]" 1
554 1 83 PHE H 1 83 PHE HB3 2.200 . 6.000 2.969 2.680 3.587 . 0 0 "[ . 1 . 2]" 1
555 1 83 PHE QB 1 85 PRO HD2 3.100 . 4.300 4.428 4.294 4.516 0.216 11 0 "[ . 1 . 2]" 1
556 1 83 PHE H 1 83 PHE HB2 3.000 . 4.100 2.296 2.201 2.471 . 0 0 "[ . 1 . 2]" 1
557 1 81 ASP H 1 81 ASP QB 2.600 . 3.500 2.205 2.145 2.249 . 0 0 "[ . 1 . 2]" 1
558 1 81 ASP QB 1 82 THR H 2.400 . 4.600 2.475 2.327 2.617 . 0 0 "[ . 1 . 2]" 1
559 1 81 ASP HA 1 81 ASP QB 2.600 . 3.400 2.302 2.264 2.341 . 0 0 "[ . 1 . 2]" 1
560 1 87 ASN QB 1 87 ASN HD21 3.300 . 4.700 2.362 2.096 2.857 . 0 0 "[ . 1 . 2]" 1
561 1 87 ASN H 1 87 ASN QB 3.000 . 4.000 2.891 2.454 3.271 . 0 0 "[ . 1 . 2]" 1
562 1 84 LEU HA 1 87 ASN QB 2.800 . 6.000 4.290 3.044 5.215 . 0 0 "[ . 1 . 2]" 1
563 1 39 LEU H 1 73 ILE HB 3.300 . 4.700 4.149 3.975 4.330 . 0 0 "[ . 1 . 2]" 1
564 1 73 ILE H 1 73 ILE HB 2.500 . 3.300 2.695 2.666 2.756 . 0 0 "[ . 1 . 2]" 1
565 1 73 ILE HA 1 73 ILE HB 2.600 . 3.500 3.031 3.023 3.042 . 0 0 "[ . 1 . 2]" 1
566 1 38 ASP QB 1 73 ILE HB 2.600 . 3.500 3.370 2.952 3.499 . 0 0 "[ . 1 . 2]" 1
567 1 73 ILE HB 1 73 ILE QG 2.600 . 3.400 2.183 2.178 2.188 . 0 0 "[ . 1 . 2]" 1
568 1 72 ILE MG 1 73 ILE HB 3.500 . 5.000 4.326 4.232 4.391 . 0 0 "[ . 1 . 2]" 1
569 1 21 ASP H 1 21 ASP HB2 2.700 . 3.600 2.920 2.360 3.674 0.074 6 0 "[ . 1 . 2]" 1
570 1 21 ASP HB2 1 23 GLU QG 2.700 . 6.000 4.670 3.540 5.071 . 0 0 "[ . 1 . 2]" 1
571 1 21 ASP H 1 21 ASP HB3 2.400 . 3.100 2.452 2.145 2.854 . 0 0 "[ . 1 . 2]" 1
572 1 21 ASP HB3 1 23 GLU QG 3.500 . 5.000 4.179 1.943 4.876 0.057 17 0 "[ . 1 . 2]" 1
573 1 43 TYR H 1 43 TYR HB3 3.000 . 4.100 3.105 2.981 3.711 . 0 0 "[ . 1 . 2]" 1
574 1 43 TYR HB3 1 44 VAL H 2.800 . 3.800 3.566 2.964 3.807 0.007 17 0 "[ . 1 . 2]" 1
575 1 25 PHE QD 1 43 TYR HB3 2.100 . 6.000 3.926 3.123 4.672 . 0 0 "[ . 1 . 2]" 1
576 1 43 TYR H 1 43 TYR HB2 2.500 . 3.300 2.956 2.515 3.108 . 0 0 "[ . 1 . 2]" 1
577 1 43 TYR HB2 1 43 TYR QD 2.800 . 3.800 2.610 2.433 2.724 . 0 0 "[ . 1 . 2]" 1
578 1 84 LEU H 1 84 LEU QB . . 3.000 2.243 2.181 2.301 . 0 0 "[ . 1 . 2]" 1
579 1 84 LEU QB 1 85 PRO HD3 2.800 . 2.800 2.110 1.910 2.528 . 0 0 "[ . 1 . 2]" 1
580 1 83 PHE HB3 1 84 LEU QB 3.900 . 5.800 4.648 4.353 5.385 . 0 0 "[ . 1 . 2]" 1
581 1 84 LEU QB 1 85 PRO HD2 3.600 . 4.100 3.189 2.721 3.390 . 0 0 "[ . 1 . 2]" 1
582 1 84 LEU QB 1 84 LEU MD1 2.700 . 3.300 2.106 2.088 2.126 . 0 0 "[ . 1 . 2]" 1
583 1 84 LEU QB 1 84 LEU MD2 2.600 . 3.400 2.287 2.244 2.383 . 0 0 "[ . 1 . 2]" 1
584 1 84 LEU QB 1 97 GLU QB 2.800 . 3.800 3.344 2.873 3.489 . 0 0 "[ . 1 . 2]" 1
585 1 84 LEU QB 1 84 LEU HG 2.400 . 3.100 2.380 2.312 2.416 . 0 0 "[ . 1 . 2]" 1
586 1 8 ILE HB 1 17 PHE HB3 3.300 . 4.700 4.050 3.776 4.672 . 0 0 "[ . 1 . 2]" 1
587 1 8 ILE MG 1 17 PHE HB3 2.300 . 3.000 1.832 1.707 2.303 . 0 0 "[ . 1 . 2]" 1
588 1 17 PHE H 1 17 PHE HB3 3.200 . 4.500 3.755 3.706 3.817 . 0 0 "[ . 1 . 2]" 1
589 1 17 PHE HB3 1 17 PHE QD 2.700 . 3.600 2.575 2.466 2.663 . 0 0 "[ . 1 . 2]" 1
590 1 17 PHE HB2 1 18 GLU H 3.300 . 4.600 3.933 3.393 4.186 . 0 0 "[ . 1 . 2]" 1
591 1 17 PHE HB2 1 17 PHE QD 2.400 . 3.100 2.267 2.248 2.314 . 0 0 "[ . 1 . 2]" 1
592 1 17 PHE HB2 1 26 ILE MG 2.800 . 3.800 2.639 2.100 3.192 . 0 0 "[ . 1 . 2]" 1
593 1 78 TYR H 1 78 TYR HB2 3.300 . 4.600 3.125 2.989 3.261 . 0 0 "[ . 1 . 2]" 1
594 1 78 TYR HB2 1 78 TYR QD 2.600 . 3.400 2.484 2.447 2.532 . 0 0 "[ . 1 . 2]" 1
595 1 78 TYR HB2 1 79 VAL H 3.500 . 5.000 3.985 3.938 4.030 . 0 0 "[ . 1 . 2]" 1
596 1 78 TYR HA 1 78 TYR HB2 2.600 . 3.500 2.275 2.256 2.308 . 0 0 "[ . 1 . 2]" 1
597 1 78 TYR HB3 1 78 TYR QD 2.500 . 3.300 2.345 2.311 2.379 . 0 0 "[ . 1 . 2]" 1
598 1 78 TYR HB3 1 79 VAL H 2.500 . 3.300 2.812 2.630 3.002 . 0 0 "[ . 1 . 2]" 1
599 1 8 ILE H 1 8 ILE HB 2.700 . 3.600 2.638 2.366 2.750 . 0 0 "[ . 1 . 2]" 1
600 1 7 LYS HA 1 8 ILE HB 3.800 . 5.600 4.861 4.576 5.039 . 0 0 "[ . 1 . 2]" 1
601 1 8 ILE HB 1 8 ILE QG 2.600 . 3.500 2.238 2.189 2.418 . 0 0 "[ . 1 . 2]" 1
602 1 8 ILE HB 1 8 ILE MD 3.300 . 4.600 3.070 2.388 3.244 . 0 0 "[ . 1 . 2]" 1
603 1 47 PHE H 1 47 PHE QB 3.300 . 3.600 2.415 2.203 2.579 . 0 0 "[ . 1 . 2]" 1
604 1 46 SER HA 1 47 PHE QB 3.300 . 6.000 5.310 5.100 5.481 . 0 0 "[ . 1 . 2]" 1
605 1 47 PHE QB 1 47 PHE QD 2.600 . 3.500 2.126 2.119 2.135 . 0 0 "[ . 1 . 2]" 1
606 1 11 ASN H 1 11 ASN HB3 2.600 . 3.400 2.647 2.499 2.784 . 0 0 "[ . 1 . 2]" 1
607 1 11 ASN HB3 1 11 ASN QD 2.300 . 3.000 2.593 2.155 2.902 . 0 0 "[ . 1 . 2]" 1
608 1 11 ASN HB3 1 12 GLU H 3.200 . 4.500 4.381 4.340 4.421 . 0 0 "[ . 1 . 2]" 1
609 1 11 ASN HB3 1 16 ARG QB 3.500 . 5.100 3.965 3.704 4.342 . 0 0 "[ . 1 . 2]" 1
610 1 11 ASN HB3 1 14 LYS QB 2.400 . 3.100 2.777 2.404 3.095 . 0 0 "[ . 1 . 2]" 1
611 1 33 ASN QB 1 33 ASN HD22 2.700 . 3.600 3.245 3.204 3.292 . 0 0 "[ . 1 . 2]" 1
612 1 33 ASN QB 1 35 LYS QG 2.700 . 3.600 2.778 2.142 3.238 . 0 0 "[ . 1 . 2]" 1
613 1 60 ALA MB 1 63 GLU HG3 2.100 . 6.000 4.290 3.912 4.779 . 0 0 "[ . 1 . 2]" 1
614 1 63 GLU H 1 63 GLU HG3 3.300 . 4.700 2.834 1.937 3.598 . 0 0 "[ . 1 . 2]" 1
615 1 62 PHE HB2 1 63 GLU HG3 3.600 . 5.200 4.417 3.521 5.218 0.018 13 0 "[ . 1 . 2]" 1
616 1 27 GLU HG3 1 28 TYR H 3.000 . 4.100 2.936 1.931 3.739 . 0 0 "[ . 1 . 2]" 1
617 1 27 GLU HG3 1 40 VAL QG 3.600 . 6.000 4.715 3.199 5.380 . 0 0 "[ . 1 . 2]" 1
618 1 16 ARG QB 1 27 GLU HG3 3.200 . 4.500 2.579 1.869 3.344 0.031 4 0 "[ . 1 . 2]" 1
619 1 63 GLU H 1 63 GLU HG2 2.400 . 3.100 2.544 2.075 3.115 0.015 6 0 "[ . 1 . 2]" 1
620 1 63 GLU HB2 1 63 GLU HG2 3.000 . 4.100 2.743 2.495 3.004 . 0 0 "[ . 1 . 2]" 1
621 1 62 PHE HB2 1 63 GLU HG2 2.900 . 3.900 3.817 3.325 4.467 0.567 20 1 "[ . 1 . +]" 1
622 1 11 ASN H 1 11 ASN HB2 2.600 . 3.400 2.603 2.500 2.805 . 0 0 "[ . 1 . 2]" 1
623 1 11 ASN HB2 1 12 GLU H 3.600 . 5.200 4.590 4.520 4.635 . 0 0 "[ . 1 . 2]" 1
624 1 11 ASN HB2 1 11 ASN QD 3.000 . 4.200 2.719 2.123 3.321 . 0 0 "[ . 1 . 2]" 1
625 1 27 GLU HG2 1 28 TYR H 2.700 . 3.600 2.504 1.792 4.051 0.451 18 0 "[ . 1 . 2]" 1
626 1 11 ASN HB2 1 14 LYS H 3.600 . 5.300 4.892 4.357 5.229 . 0 0 "[ . 1 . 2]" 1
627 1 27 GLU HA 1 27 GLU HG2 3.000 . 4.100 3.054 2.564 3.701 . 0 0 "[ . 1 . 2]" 1
628 1 20 GLU HG2 1 21 ASP HB2 3.400 . 4.800 4.023 3.203 5.240 0.440 1 0 "[ . 1 . 2]" 1
629 1 29 LYS H 1 29 LYS HB3 2.800 . 3.800 3.460 3.289 3.798 . 0 0 "[ . 1 . 2]" 1
630 1 29 LYS HB3 1 30 MET HG3 3.700 . 6.000 5.956 5.385 6.810 0.810 11 2 "[ . 1+ - 2]" 1
631 1 29 LYS H 1 29 LYS HB2 3.100 . 4.300 3.767 2.741 3.969 . 0 0 "[ . 1 . 2]" 1
632 1 29 LYS HB2 1 38 ASP QB 3.300 . 4.700 4.123 2.345 4.525 . 0 0 "[ . 1 . 2]" 1
633 1 29 LYS HB2 1 29 LYS QE 3.900 . 5.800 3.352 2.729 4.116 . 0 0 "[ . 1 . 2]" 1
634 1 29 LYS HB2 1 29 LYS HG2 2.500 . 3.300 2.645 2.473 2.996 . 0 0 "[ . 1 . 2]" 1
635 1 29 LYS HB2 1 40 VAL QG 3.800 . 5.600 4.993 3.385 5.435 . 0 0 "[ . 1 . 2]" 1
636 1 32 ASN QB 1 35 LYS H 2.600 . 3.400 2.786 2.578 3.144 . 0 0 "[ . 1 . 2]" 1
637 1 32 ASN QB 1 35 LYS HB2 2.400 . 3.100 2.326 1.885 2.963 . 0 0 "[ . 1 . 2]" 1
638 1 32 ASN QB 1 36 VAL H 2.600 . 3.500 3.054 2.751 3.356 . 0 0 "[ . 1 . 2]" 1
639 1 97 GLU HA 1 97 GLU HG3 2.600 . 3.400 2.782 2.237 3.171 . 0 0 "[ . 1 . 2]" 1
640 1 85 PRO HG3 1 97 GLU HG3 2.500 . 3.300 2.243 1.546 4.057 0.757 4 1 "[ +. 1 . 2]" 1
641 1 29 LYS HB3 1 40 VAL HB 3.300 . 6.000 5.764 5.377 6.278 0.278 14 0 "[ . 1 . 2]" 1
642 1 37 MET H 1 37 MET HB2 2.300 . 3.000 2.325 2.181 2.416 . 0 0 "[ . 1 . 2]" 1
643 1 37 MET HB2 1 70 ILE MG 2.700 . 3.600 3.134 2.639 3.631 0.031 12 0 "[ . 1 . 2]" 1
644 1 37 MET HA 1 37 MET HB2 2.700 . 3.600 2.975 2.671 3.031 . 0 0 "[ . 1 . 2]" 1
645 1 37 MET HB2 1 93 LEU MD2 3.700 . 6.000 6.050 6.008 6.091 0.091 15 0 "[ . 1 . 2]" 1
646 1 32 ASN QB 1 35 LYS QG 2.800 . 3.800 3.401 3.087 3.674 . 0 0 "[ . 1 . 2]" 1
647 1 32 ASN QB 1 32 ASN HD21 2.600 . 3.400 2.171 2.138 2.206 . 0 0 "[ . 1 . 2]" 1
648 1 94 ILE HB 1 94 ILE MD 2.500 . 3.300 2.336 2.181 2.474 . 0 0 "[ . 1 . 2]" 1
649 1 94 ILE HA 1 94 ILE HB 2.400 . 3.100 2.417 2.353 2.470 . 0 0 "[ . 1 . 2]" 1
650 1 12 GLU HA 1 12 GLU HG3 3.000 . 4.100 3.547 2.390 3.836 . 0 0 "[ . 1 . 2]" 1
651 1 12 GLU HB3 1 12 GLU HG3 2.600 . 3.500 2.910 2.430 3.013 . 0 0 "[ . 1 . 2]" 1
652 1 12 GLU H 1 12 GLU HG3 2.800 . 3.800 2.742 1.596 4.030 0.230 15 0 "[ . 1 . 2]" 1
653 1 12 GLU HA 1 12 GLU HG2 2.800 . 3.800 3.598 2.597 4.181 0.381 2 0 "[ . 1 . 2]" 1
654 1 32 ASN QB 1 36 VAL HB 2.800 . 3.600 3.091 2.823 3.312 . 0 0 "[ . 1 . 2]" 1
655 1 18 GLU QB 1 19 THR H 3.000 . 4.100 3.417 2.921 3.774 . 0 0 "[ . 1 . 2]" 1
656 1 23 GLU H 1 23 GLU QG 2.900 . 3.900 2.283 2.038 2.581 . 0 0 "[ . 1 . 2]" 1
657 1 23 GLU QG 1 24 ALA H 3.400 . 4.800 3.981 3.637 4.264 . 0 0 "[ . 1 . 2]" 1
658 1 9 VAL H 1 9 VAL HB 2.600 . 3.500 2.681 2.502 3.671 0.171 6 0 "[ . 1 . 2]" 1
659 1 9 VAL HB 1 10 TRP H 3.200 . 4.500 3.850 2.502 4.261 . 0 0 "[ . 1 . 2]" 1
660 1 16 ARG QB 1 17 PHE H . . 3.300 2.501 2.061 2.854 . 0 0 "[ . 1 . 2]" 1
661 1 16 ARG QB 1 16 ARG HD3 2.600 . 3.400 2.597 2.404 3.289 . 0 0 "[ . 1 . 2]" 1
662 1 16 ARG QB 1 25 PHE QB 3.300 . 6.000 3.400 2.873 3.962 . 0 0 "[ . 1 . 2]" 1
663 1 62 PHE H 1 62 PHE HB3 3.500 . 5.100 3.594 3.574 3.610 . 0 0 "[ . 1 . 2]" 1
664 1 62 PHE HB3 1 62 PHE QD 2.800 . 3.800 2.718 2.684 2.743 . 0 0 "[ . 1 . 2]" 1
665 1 62 PHE HB3 1 63 GLU H 2.900 . 3.900 3.248 3.157 3.349 . 0 0 "[ . 1 . 2]" 1
666 1 36 VAL HB 1 37 MET H 3.300 . 4.600 4.326 4.258 4.416 . 0 0 "[ . 1 . 2]" 1
667 1 31 ARG QB 1 36 VAL HB 3.000 . 4.100 2.309 1.752 3.825 0.148 13 0 "[ . 1 . 2]" 1
668 1 36 VAL H 1 36 VAL HB 2.600 . 3.400 2.597 2.487 2.671 . 0 0 "[ . 1 . 2]" 1
669 1 16 ARG QB 1 27 GLU QB 3.800 . 5.600 2.941 2.581 3.447 . 0 0 "[ . 1 . 2]" 1
670 1 14 LYS HG2 1 16 ARG QB 3.800 . 6.000 5.189 4.672 5.869 . 0 0 "[ . 1 . 2]" 1
671 1 62 PHE HB2 1 63 GLU H 2.400 . 3.100 2.441 2.377 2.525 . 0 0 "[ . 1 . 2]" 1
672 1 62 PHE H 1 62 PHE HB2 2.400 . 3.100 2.394 2.354 2.431 . 0 0 "[ . 1 . 2]" 1
673 1 62 PHE HB2 1 62 PHE QD 2.500 . 3.300 2.278 2.251 2.297 . 0 0 "[ . 1 . 2]" 1
674 1 59 VAL HA 1 62 PHE HB2 2.200 . 2.800 2.307 2.068 2.495 . 0 0 "[ . 1 . 2]" 1
675 1 59 VAL MG1 1 62 PHE HB2 2.700 . 3.600 3.027 2.831 3.257 . 0 0 "[ . 1 . 2]" 1
676 1 44 VAL H 1 44 VAL HB 2.800 . 3.800 3.367 2.853 3.477 . 0 0 "[ . 1 . 2]" 1
677 1 44 VAL HA 1 44 VAL HB 2.400 . 3.100 2.494 2.406 3.033 . 0 0 "[ . 1 . 2]" 1
678 1 18 GLU QB 1 18 GLU HG3 3.100 . 4.300 2.365 2.264 2.442 . 0 0 "[ . 1 . 2]" 1
679 1 27 GLU H 1 27 GLU QB 2.600 . 3.500 2.349 2.257 2.433 . 0 0 "[ . 1 . 2]" 1
680 1 27 GLU QB 1 28 TYR H 3.200 . 4.500 3.267 2.370 3.606 . 0 0 "[ . 1 . 2]" 1
681 1 27 GLU QB 1 41 HIS HB2 2.900 . 4.000 3.898 3.818 3.973 . 0 0 "[ . 1 . 2]" 1
682 1 27 GLU QB 1 27 GLU HG3 3.100 . 4.300 2.351 2.232 2.514 . 0 0 "[ . 1 . 2]" 1
683 1 16 ARG QB 1 27 GLU QB 3.600 . 5.200 3.157 2.629 3.783 . 0 0 "[ . 1 . 2]" 1
684 1 40 VAL H 1 40 VAL HB 2.600 . 3.400 2.648 2.445 3.120 . 0 0 "[ . 1 . 2]" 1
685 1 35 LYS H 1 35 LYS HB3 3.400 . 4.800 3.676 3.620 3.755 . 0 0 "[ . 1 . 2]" 1
686 1 35 LYS H 1 35 LYS HB2 2.500 . 3.300 2.528 2.418 2.658 . 0 0 "[ . 1 . 2]" 1
687 1 31 ARG HA 1 31 ARG QB 2.600 . 3.500 2.392 2.175 2.484 . 0 0 "[ . 1 . 2]" 1
688 1 31 ARG QB 1 32 ASN QB 3.200 . 4.500 3.113 2.736 3.486 . 0 0 "[ . 1 . 2]" 1
689 1 31 ARG H 1 31 ARG QB 2.500 . 3.300 2.354 2.116 2.712 . 0 0 "[ . 1 . 2]" 1
690 1 31 ARG QB 1 36 VAL MG1 2.600 . 3.500 2.824 2.196 3.578 0.078 19 0 "[ . 1 . 2]" 1
691 1 31 ARG QB 1 31 ARG HD3 2.500 . 3.300 2.421 2.284 3.260 . 0 0 "[ . 1 . 2]" 1
692 1 29 LYS HB2 1 31 ARG QB 3.100 . 6.000 5.132 4.433 5.550 . 0 0 "[ . 1 . 2]" 1
693 1 41 HIS H 1 41 HIS HB3 3.100 . 4.300 3.722 3.544 3.904 . 0 0 "[ . 1 . 2]" 1
694 1 27 GLU QB 1 41 HIS HB3 2.600 . 3.500 2.885 2.564 3.373 . 0 0 "[ . 1 . 2]" 1
695 1 40 VAL QG 1 41 HIS HB3 3.400 . 4.800 2.955 2.575 3.313 . 0 0 "[ . 1 . 2]" 1
696 1 41 HIS H 1 41 HIS HB2 2.800 . 3.800 3.242 3.185 3.343 . 0 0 "[ . 1 . 2]" 1
697 1 41 HIS HB2 1 41 HIS HD2 3.300 . 4.600 3.835 3.465 3.981 . 0 0 "[ . 1 . 2]" 1
698 1 40 VAL QG 1 41 HIS HB2 2.600 . 3.500 2.235 1.989 2.496 . 0 0 "[ . 1 . 2]" 1
699 1 32 ASN QB 1 35 LYS HB3 3.700 . 5.400 3.973 3.500 4.622 . 0 0 "[ . 1 . 2]" 1
700 1 35 LYS HB3 1 36 VAL H 3.300 . 4.700 4.044 3.867 4.264 . 0 0 "[ . 1 . 2]" 1
701 1 35 LYS HB3 1 35 LYS QG 2.600 . 3.400 2.328 2.277 2.368 . 0 0 "[ . 1 . 2]" 1
702 1 47 PHE QB 1 48 LYS HB3 3.400 . 6.000 4.888 4.707 5.073 . 0 0 "[ . 1 . 2]" 1
703 1 48 LYS H 1 48 LYS HB3 3.200 . 4.400 3.799 3.716 3.872 . 0 0 "[ . 1 . 2]" 1
704 1 48 LYS HB3 1 48 LYS HD2 3.200 . 4.400 2.596 2.363 3.373 . 0 0 "[ . 1 . 2]" 1
705 1 48 LYS HB3 1 51 LEU QD 3.000 . 4.100 2.953 2.598 3.556 . 0 0 "[ . 1 . 2]" 1
706 1 44 VAL QG 1 48 LYS HB3 2.800 . 3.800 2.664 2.505 2.886 . 0 0 "[ . 1 . 2]" 1
707 1 100 LYS H 1 100 LYS HB2 3.200 . 4.500 3.617 3.506 3.938 . 0 0 "[ . 1 . 2]" 1
708 1 100 LYS HA 1 100 LYS HB2 2.800 . 3.800 2.501 2.410 2.691 . 0 0 "[ . 1 . 2]" 1
709 1 100 LYS HB2 1 100 LYS HG3 2.900 . 4.000 2.929 2.684 3.010 . 0 0 "[ . 1 . 2]" 1
710 1 47 PHE QB 1 48 LYS HB2 2.700 . 6.000 3.849 3.635 4.482 . 0 0 "[ . 1 . 2]" 1
711 1 48 LYS HB2 1 48 LYS HD2 3.000 . 4.100 2.831 2.541 3.595 . 0 0 "[ . 1 . 2]" 1
712 1 48 LYS HB2 1 48 LYS HG3 2.500 . 3.300 2.519 2.392 2.739 . 0 0 "[ . 1 . 2]" 1
713 1 44 VAL QG 1 48 LYS HB2 2.300 . 3.000 2.033 1.715 2.314 . 0 0 "[ . 1 . 2]" 1
714 1 76 CYS HB3 1 79 VAL HB 2.700 . 3.600 3.438 3.114 3.693 0.093 14 0 "[ . 1 . 2]" 1
715 1 98 VAL HB 1 99 PHE H 3.200 . 4.500 4.075 3.239 4.559 0.059 14 0 "[ . 1 . 2]" 1
716 1 98 VAL H 1 98 VAL HB 2.500 . 3.300 2.683 2.467 2.871 . 0 0 "[ . 1 . 2]" 1
717 1 7 LYS H 1 7 LYS HB3 3.400 . 4.800 3.397 2.800 3.813 . 0 0 "[ . 1 . 2]" 1
718 1 7 LYS HA 1 7 LYS HB3 2.600 . 3.400 2.703 2.372 3.017 . 0 0 "[ . 1 . 2]" 1
719 1 7 LYS QB 1 20 GLU QB 3.000 . 4.200 1.864 1.691 2.165 0.109 5 0 "[ . 1 . 2]" 1
720 1 7 LYS QB 1 8 ILE HA 2.900 . 6.000 4.413 4.202 4.563 . 0 0 "[ . 1 . 2]" 1
721 1 7 LYS QB 1 7 LYS HG2 2.600 . 3.500 2.250 2.136 2.420 . 0 0 "[ . 1 . 2]" 1
722 1 14 LYS H 1 14 LYS QB . . 3.100 2.486 2.190 2.637 . 0 0 "[ . 1 . 2]" 1
723 1 14 LYS QB 1 14 LYS HD3 2.900 . 4.000 2.739 2.278 3.206 . 0 0 "[ . 1 . 2]" 1
724 1 11 ASN QD 1 14 LYS QB 3.200 . 4.500 2.857 1.460 3.764 0.440 10 0 "[ . 1 . 2]" 1
725 1 14 LYS QB 1 15 ARG H 3.000 . 4.100 3.358 3.196 3.520 . 0 0 "[ . 1 . 2]" 1
726 1 14 LYS QB 1 14 LYS HD3 2.500 . 3.300 2.147 2.017 2.272 . 0 0 "[ . 1 . 2]" 1
727 1 79 VAL HB 1 80 SER H 2.400 . 3.100 2.407 2.318 2.494 . 0 0 "[ . 1 . 2]" 1
728 1 79 VAL H 1 79 VAL HB 2.400 . 3.100 2.526 2.485 2.577 . 0 0 "[ . 1 . 2]" 1
729 1 26 ILE MD 1 79 VAL HB 3.100 . 6.000 4.859 4.375 5.549 . 0 0 "[ . 1 . 2]" 1
730 1 6 PRO QB 1 7 LYS QE 3.100 . 6.000 4.565 3.884 5.169 . 0 0 "[ . 1 . 2]" 1
731 1 85 PRO HA 1 88 PRO HB2 3.900 . 5.800 5.323 4.929 5.789 . 0 0 "[ . 1 . 2]" 1
732 1 6 PRO QB 1 8 ILE MD 3.000 . 3.100 2.094 1.763 2.827 0.137 13 0 "[ . 1 . 2]" 1
733 1 88 PRO HB3 1 88 PRO HD3 3.500 . 5.000 3.996 3.921 4.039 . 0 0 "[ . 1 . 2]" 1
734 1 6 PRO QB 1 53 LEU QD 2.900 . 3.900 2.342 1.911 2.736 . 0 0 "[ . 1 . 2]" 1
735 1 85 PRO HB3 1 85 PRO HD2 3.300 . 4.700 3.916 3.890 3.958 . 0 0 "[ . 1 . 2]" 1
736 1 85 PRO HB3 1 85 PRO HD3 3.000 . 4.100 3.976 2.992 4.056 . 0 0 "[ . 1 . 2]" 1
737 1 59 VAL H 1 59 VAL HB 2.500 . 3.300 2.455 2.421 2.497 . 0 0 "[ . 1 . 2]" 1
738 1 59 VAL HB 1 60 ALA H 2.600 . 3.400 2.788 2.683 2.881 . 0 0 "[ . 1 . 2]" 1
739 1 92 PRO HB3 1 92 PRO HD3 3.500 . 5.000 3.542 2.880 4.073 . 0 0 "[ . 1 . 2]" 1
740 1 86 ARG QB 1 87 ASN HD21 2.800 . 3.800 2.940 2.458 3.826 0.026 12 0 "[ . 1 . 2]" 1
741 1 86 ARG H 1 86 ARG QB 2.700 . 3.600 2.238 2.179 2.446 . 0 0 "[ . 1 . 2]" 1
742 1 85 PRO HB2 1 86 ARG HA 2.800 . 6.000 3.973 3.893 4.127 . 0 0 "[ . 1 . 2]" 1
743 1 86 ARG QB 1 86 ARG HD3 2.700 . 3.600 2.466 2.221 3.292 . 0 0 "[ . 1 . 2]" 1
744 1 85 PRO HB2 1 97 GLU QB 3.500 . 6.000 5.586 5.127 5.826 . 0 0 "[ . 1 . 2]" 1
745 1 90 TRP H 1 90 TRP HB3 3.000 . 4.100 3.776 3.687 3.841 . 0 0 "[ . 1 . 2]" 1
746 1 62 PHE QD 1 90 TRP HB3 2.400 . 3.100 2.913 2.787 3.060 . 0 0 "[ . 1 . 2]" 1
747 1 84 LEU MD2 1 90 TRP HB3 3.600 . 5.200 3.441 3.142 3.701 . 0 0 "[ . 1 . 2]" 1
748 1 62 PHE QE 1 90 TRP HB3 2.500 . 3.300 3.175 2.948 3.420 0.120 7 0 "[ . 1 . 2]" 1
749 1 56 HIS QB 1 56 HIS HD2 3.300 . 4.700 2.832 2.537 3.054 . 0 0 "[ . 1 . 2]" 1
750 1 64 HIS QB 1 65 ALA H 2.400 . 3.100 2.384 2.304 2.558 . 0 0 "[ . 1 . 2]" 1
751 1 64 HIS H 1 64 HIS QB 2.700 . 3.600 2.235 2.165 2.263 . 0 0 "[ . 1 . 2]" 1
752 1 64 HIS QB 1 65 ALA MB 4.000 . 6.000 3.599 3.469 3.785 . 0 0 "[ . 1 . 2]" 1
753 1 62 PHE QE 1 90 TRP HB2 2.900 . 3.900 3.542 3.356 3.719 . 0 0 "[ . 1 . 2]" 1
754 1 90 TRP H 1 90 TRP HB2 2.400 . 3.100 2.785 2.676 2.891 . 0 0 "[ . 1 . 2]" 1
755 1 84 LEU MD2 1 90 TRP HB2 2.500 . 3.300 2.182 1.872 2.450 . 0 0 "[ . 1 . 2]" 1
756 1 30 MET HB3 1 30 MET HG2 2.500 . 3.300 2.424 2.363 2.466 . 0 0 "[ . 1 . 2]" 1
757 1 30 MET H 1 30 MET HB3 3.100 . 4.300 3.521 2.743 3.688 . 0 0 "[ . 1 . 2]" 1
758 1 23 GLU H 1 23 GLU HB3 3.200 . 4.500 3.625 3.579 3.709 . 0 0 "[ . 1 . 2]" 1
759 1 23 GLU HB3 1 24 ALA H 3.200 . 4.500 3.957 3.205 4.238 . 0 0 "[ . 1 . 2]" 1
760 1 90 TRP H 1 91 LYS HB2 3.800 . 5.600 4.216 3.574 4.674 . 0 0 "[ . 1 . 2]" 1
761 1 91 LYS H 1 91 LYS HB2 3.000 . 4.200 2.425 2.283 2.581 . 0 0 "[ . 1 . 2]" 1
762 1 85 PRO HB2 1 85 PRO HD2 3.000 . 4.200 3.057 2.927 4.009 . 0 0 "[ . 1 . 2]" 1
763 1 6 PRO QB 1 56 HIS QB 2.200 . 6.000 4.265 3.738 4.796 . 0 0 "[ . 1 . 2]" 1
764 1 56 HIS QB 1 59 VAL HB 3.000 . 6.000 4.043 3.639 4.487 . 0 0 "[ . 1 . 2]" 1
765 1 56 HIS QB 1 57 LEU H 2.900 . 3.900 2.786 2.447 2.918 . 0 0 "[ . 1 . 2]" 1
766 1 54 ALA MB 1 56 HIS QB 3.800 . 5.600 5.309 4.867 5.432 . 0 0 "[ . 1 . 2]" 1
767 1 56 HIS H 1 56 HIS QB 3.400 . 4.900 2.246 1.965 2.341 . 0 0 "[ . 1 . 2]" 1
768 1 8 ILE QG 1 56 HIS QB 2.500 . 6.000 3.631 3.119 4.284 . 0 0 "[ . 1 . 2]" 1
769 1 53 LEU QD 1 56 HIS QB 3.000 . 4.100 2.189 1.882 2.391 0.018 18 0 "[ . 1 . 2]" 1
770 1 20 GLU QB 1 21 ASP HB2 3.500 . 6.000 4.958 4.255 5.424 . 0 0 "[ . 1 . 2]" 1
771 1 20 GLU H 1 20 GLU QB 3.300 . 4.700 2.509 2.344 2.746 . 0 0 "[ . 1 . 2]" 1
772 1 8 ILE QG 1 20 GLU QB 3.700 . 6.000 5.588 5.239 5.669 . 0 0 "[ . 1 . 2]" 1
773 1 97 GLU QB 1 98 VAL MG2 3.900 . 5.800 5.205 4.622 5.536 . 0 0 "[ . 1 . 2]" 1
774 1 97 GLU QB 1 98 VAL H 2.200 . 2.800 2.381 1.683 2.734 . 0 0 "[ . 1 . 2]" 1
775 1 6 PRO HA 1 20 GLU QB 3.700 . 5.400 4.365 3.273 5.219 . 0 0 "[ . 1 . 2]" 1
776 1 49 ARG HB3 1 50 GLY QA 3.200 . 4.500 4.353 3.601 5.292 0.792 10 7 "[ *** -*+ . *2]" 1
777 1 49 ARG H 1 49 ARG HB3 3.200 . 4.500 3.287 2.611 4.012 . 0 0 "[ . 1 . 2]" 1
778 1 97 GLU H 1 97 GLU QB 2.700 . 3.600 2.659 2.339 2.932 . 0 0 "[ . 1 . 2]" 1
779 1 74 PRO HB3 1 74 PRO HG3 2.300 . 3.000 2.261 2.254 2.272 . 0 0 "[ . 1 . 2]" 1
780 1 74 PRO HB3 1 75 SER HA 3.500 . 6.000 5.857 5.752 5.918 . 0 0 "[ . 1 . 2]" 1
781 1 74 PRO HB2 1 75 SER HA 2.900 . 6.000 4.738 4.667 4.821 . 0 0 "[ . 1 . 2]" 1
782 1 74 PRO HB2 1 74 PRO HG3 2.900 . 3.900 2.883 2.808 2.929 . 0 0 "[ . 1 . 2]" 1
783 1 74 PRO HB2 1 79 VAL QG 2.900 . 6.000 4.771 4.570 4.920 . 0 0 "[ . 1 . 2]" 1
784 1 76 CYS H 1 76 CYS HB3 3.000 . 4.200 3.520 2.485 3.612 . 0 0 "[ . 1 . 2]" 1
785 1 76 CYS H 1 76 CYS HB2 2.500 . 3.300 2.677 2.409 3.602 0.302 14 0 "[ . 1 . 2]" 1
786 1 76 CYS HA 1 76 CYS HB2 3.000 . 4.100 2.987 2.381 3.030 . 0 0 "[ . 1 . 2]" 1
787 1 76 CYS HB2 1 79 VAL QG 3.000 . 4.100 3.336 2.401 3.722 . 0 0 "[ . 1 . 2]" 1
788 1 39 LEU HG 1 76 CYS HB2 2.100 . 6.000 5.470 5.099 6.289 0.289 14 0 "[ . 1 . 2]" 1
789 1 90 TRP HB2 1 93 LEU HG 3.400 . 4.900 4.923 4.822 4.957 0.057 14 0 "[ . 1 . 2]" 1
790 1 72 ILE MG 1 93 LEU HG 3.700 . 6.000 6.079 6.019 6.159 0.159 2 0 "[ . 1 . 2]" 1
791 1 93 LEU HA 1 93 LEU HG 2.900 . 4.000 3.195 3.094 3.269 . 0 0 "[ . 1 . 2]" 1
792 1 93 LEU HG 1 94 ILE MG 3.500 . 5.000 4.474 4.133 4.763 . 0 0 "[ . 1 . 2]" 1
793 1 62 PHE QD 1 93 LEU HG 3.300 . 4.700 4.629 4.432 4.737 0.037 17 0 "[ . 1 . 2]" 1
794 1 63 GLU HB2 1 64 HIS H 3.300 . 4.700 2.684 2.596 2.779 . 0 0 "[ . 1 . 2]" 1
795 1 29 LYS HA 1 29 LYS QD 3.600 . 5.200 3.792 2.536 4.612 . 0 0 "[ . 1 . 2]" 1
796 1 29 LYS QD 1 40 VAL HA 3.600 . 6.000 5.001 4.667 5.426 . 0 0 "[ . 1 . 2]" 1
797 1 91 LYS HE2 1 100 LYS QD 2.100 . 6.000 5.595 4.368 6.942 0.942 12 3 "[ . *-+ . 2]" 1
798 1 97 GLU HA 1 100 LYS QD 2.100 . 6.000 5.325 4.156 5.840 . 0 0 "[ . 1 . 2]" 1
799 1 47 PHE QB 1 48 LYS HD2 2.900 . 6.000 4.845 3.848 5.194 . 0 0 "[ . 1 . 2]" 1
800 1 48 LYS HD2 1 48 LYS QE 2.600 . 3.400 2.189 2.139 2.346 . 0 0 "[ . 1 . 2]" 1
801 1 48 LYS HD2 1 53 LEU QB 3.200 . 4.500 2.910 2.071 4.078 . 0 0 "[ . 1 . 2]" 1
802 1 48 LYS HD2 1 48 LYS HG2 2.600 . 3.400 2.558 2.393 3.000 . 0 0 "[ . 1 . 2]" 1
803 1 48 LYS HD2 1 48 LYS HG3 2.600 . 3.500 2.958 2.336 3.023 . 0 0 "[ . 1 . 2]" 1
804 1 44 VAL QG 1 48 LYS HD2 3.600 . 5.200 3.627 2.741 4.347 . 0 0 "[ . 1 . 2]" 1
805 1 6 PRO QB 1 48 LYS HD2 2.700 . 6.000 4.814 4.164 5.682 . 0 0 "[ . 1 . 2]" 1
806 1 65 ALA HA 1 68 HIS HB3 2.600 . 3.400 3.113 2.911 3.334 . 0 0 "[ . 1 . 2]" 1
807 1 9 VAL QG 1 10 TRP HB3 3.800 . 6.000 4.114 3.859 4.737 . 0 0 "[ . 1 . 2]" 1
808 1 10 TRP H 1 10 TRP HB3 2.600 . 3.400 2.465 2.403 2.589 . 0 0 "[ . 1 . 2]" 1
809 1 68 HIS H 1 68 HIS HB3 2.800 . 3.800 2.712 2.596 2.829 . 0 0 "[ . 1 . 2]" 1
810 1 68 HIS HB3 1 70 ILE HA 3.700 . 5.400 4.965 4.647 5.267 . 0 0 "[ . 1 . 2]" 1
811 1 68 HIS HB3 1 70 ILE MD 2.600 . 3.400 2.296 2.197 2.448 . 0 0 "[ . 1 . 2]" 1
812 1 68 HIS HB3 1 70 ILE HG13 2.300 . 2.900 1.918 1.696 2.133 0.004 19 0 "[ . 1 . 2]" 1
813 1 10 TRP HB2 1 17 PHE QD 2.400 . 3.100 2.356 2.284 2.459 . 0 0 "[ . 1 . 2]" 1
814 1 10 TRP HB2 1 17 PHE HB2 4.300 . 6.000 6.058 5.996 6.121 0.121 11 0 "[ . 1 . 2]" 1
815 1 10 TRP H 1 10 TRP HB2 2.900 . 4.000 2.829 2.649 3.079 . 0 0 "[ . 1 . 2]" 1
816 1 10 TRP HB2 1 17 PHE QE 2.400 . 3.100 2.366 1.962 2.887 . 0 0 "[ . 1 . 2]" 1
817 1 10 TRP HA 1 10 TRP HB2 2.400 . 3.100 2.422 2.392 2.446 . 0 0 "[ . 1 . 2]" 1
818 1 68 HIS H 1 68 HIS HB2 2.600 . 3.500 2.607 2.444 2.701 . 0 0 "[ . 1 . 2]" 1
819 1 68 HIS HB2 1 70 ILE MD 3.400 . 4.900 3.315 3.178 3.566 . 0 0 "[ . 1 . 2]" 1
820 1 65 ALA MB 1 93 LEU HG 3.500 . 6.000 5.254 4.914 5.587 . 0 0 "[ . 1 . 2]" 1
821 1 35 LYS H 1 35 LYS HD3 2.900 . 4.000 3.779 3.358 4.195 0.195 8 0 "[ . 1 . 2]" 1
822 1 100 LYS QD 1 102 SER H 3.000 . 6.000 4.620 2.542 5.736 . 0 0 "[ . 1 . 2]" 1
823 1 12 GLU HB2 1 13 GLY H 2.900 . 4.000 3.697 2.796 4.058 0.058 20 0 "[ . 1 . 2]" 1
824 1 12 GLU H 1 12 GLU HB2 3.000 . 4.100 3.337 2.114 3.621 . 0 0 "[ . 1 . 2]" 1
825 1 12 GLU HB2 1 12 GLU HG2 2.700 . 3.600 2.906 2.416 3.011 . 0 0 "[ . 1 . 2]" 1
826 1 12 GLU H 1 12 GLU HB3 2.700 . 3.600 2.835 2.476 3.587 . 0 0 "[ . 1 . 2]" 1
827 1 92 PRO HA 1 92 PRO HG3 2.900 . 3.900 3.409 2.930 3.971 0.071 6 0 "[ . 1 . 2]" 1
828 1 92 PRO HD3 1 92 PRO HG3 2.500 . 3.300 2.322 2.301 2.335 . 0 0 "[ . 1 . 2]" 1
829 1 25 PHE QB 1 26 ILE QG 2.100 . 6.000 5.315 5.022 5.456 . 0 0 "[ . 1 . 2]" 1
830 1 26 ILE QG 1 27 GLU H 3.600 . 5.300 3.199 2.651 3.947 . 0 0 "[ . 1 . 2]" 1
831 1 26 ILE QG 1 57 LEU HB2 2.300 . 3.000 2.708 2.031 2.995 . 0 0 "[ . 1 . 2]" 1
832 1 26 ILE QG 1 54 ALA MB 3.200 . 6.000 4.889 4.491 5.107 . 0 0 "[ . 1 . 2]" 1
833 1 26 ILE QG 1 57 LEU MD2 3.500 . 5.000 4.177 3.436 4.528 . 0 0 "[ . 1 . 2]" 1
834 1 84 LEU H 1 84 LEU HG 2.700 . 3.600 2.820 2.718 3.004 . 0 0 "[ . 1 . 2]" 1
835 1 84 LEU HG 1 85 PRO HD3 3.500 . 5.000 4.453 4.260 4.934 . 0 0 "[ . 1 . 2]" 1
836 1 82 THR MG 1 84 LEU HG 2.100 . 6.000 6.005 5.898 6.067 0.067 20 0 "[ . 1 . 2]" 1
837 1 62 PHE QE 1 84 LEU HG 2.600 . 3.500 3.510 3.109 3.622 0.122 13 0 "[ . 1 . 2]" 1
838 1 35 LYS HD3 1 35 LYS HE3 2.700 . 3.600 2.691 2.418 3.017 . 0 0 "[ . 1 . 2]" 1
839 1 14 LYS H 1 15 ARG QG 3.300 . 4.600 4.339 4.120 4.528 . 0 0 "[ . 1 . 2]" 1
840 1 91 LYS HA 1 94 ILE HG12 2.600 . 3.400 2.945 2.479 3.528 0.128 2 0 "[ . 1 . 2]" 1
841 1 31 ARG HD3 1 31 ARG HG3 2.600 . 3.500 2.572 2.344 3.017 . 0 0 "[ . 1 . 2]" 1
842 1 31 ARG HG3 1 37 MET HA 3.000 . 6.000 4.994 4.327 6.952 0.952 13 1 "[ . 1 + . 2]" 1
843 1 47 PHE QB 1 49 ARG QG 2.100 . 6.000 5.384 5.241 5.510 . 0 0 "[ . 1 . 2]" 1
844 1 49 ARG H 1 49 ARG QG 2.700 . 3.600 2.265 1.864 2.693 . 0 0 "[ . 1 . 2]" 1
845 1 46 SER HA 1 49 ARG QG 2.500 . 3.300 2.025 1.618 2.898 0.082 14 0 "[ . 1 . 2]" 1
846 1 15 ARG H 1 15 ARG QG 2.600 . 3.400 2.725 2.614 2.861 . 0 0 "[ . 1 . 2]" 1
847 1 8 ILE H 1 8 ILE QG 3.700 . 3.800 2.397 2.007 3.542 . 0 0 "[ . 1 . 2]" 1
848 1 8 ILE HA 1 8 ILE QG 3.200 . 4.500 2.874 2.269 3.085 . 0 0 "[ . 1 . 2]" 1
849 1 73 ILE H 1 73 ILE QG 2.800 . 3.800 3.235 3.141 3.306 . 0 0 "[ . 1 . 2]" 1
850 1 73 ILE HA 1 73 ILE QG 2.800 . 3.800 2.826 2.779 2.927 . 0 0 "[ . 1 . 2]" 1
851 1 36 VAL HB 1 73 ILE QG 3.500 . 5.000 4.321 4.024 4.843 . 0 0 "[ . 1 . 2]" 1
852 1 36 VAL MG1 1 73 ILE QG 2.700 . 3.600 1.977 1.786 2.310 0.014 20 0 "[ . 1 . 2]" 1
853 1 72 ILE H 1 72 ILE HG12 3.000 . 4.100 4.113 4.035 4.148 0.048 13 0 "[ . 1 . 2]" 1
854 1 72 ILE HG12 1 72 ILE MG 2.600 . 3.400 2.545 2.510 2.591 . 0 0 "[ . 1 . 2]" 1
855 1 72 ILE MD 1 72 ILE HG12 2.400 . 3.100 2.120 2.116 2.125 . 0 0 "[ . 1 . 2]" 1
856 1 70 ILE HB 1 72 ILE HG12 3.400 . 4.800 4.659 4.397 4.819 0.019 14 0 "[ . 1 . 2]" 1
857 1 72 ILE H 1 72 ILE HG13 2.600 . 3.500 3.370 3.297 3.468 . 0 0 "[ . 1 . 2]" 1
858 1 72 ILE HA 1 72 ILE HG13 3.000 . 4.100 3.115 3.075 3.146 . 0 0 "[ . 1 . 2]" 1
859 1 72 ILE HG13 1 72 ILE MG 3.100 . 4.300 3.177 3.168 3.184 . 0 0 "[ . 1 . 2]" 1
860 1 72 ILE MD 1 72 ILE HG13 2.400 . 3.100 2.117 2.113 2.121 . 0 0 "[ . 1 . 2]" 1
861 1 22 HIS HB3 1 22 HIS HD2 3.400 . 4.900 3.886 3.826 3.923 . 0 0 "[ . 1 . 2]" 1
862 1 22 HIS H 1 22 HIS HB2 2.900 . 3.900 3.544 3.438 3.629 . 0 0 "[ . 1 . 2]" 1
863 1 6 PRO QD 1 6 PRO HG3 3.200 . 4.500 2.238 2.178 2.283 . 0 0 "[ . 1 . 2]" 1
864 1 88 PRO HB2 1 88 PRO HG2 2.500 . 3.300 2.284 2.263 2.297 . 0 0 "[ . 1 . 2]" 1
865 1 88 PRO HD2 1 88 PRO HG3 2.500 . 3.300 2.993 2.975 3.003 . 0 0 "[ . 1 . 2]" 1
866 1 85 PRO HA 1 88 PRO HG3 2.500 . 3.300 2.907 2.465 3.338 0.038 12 0 "[ . 1 . 2]" 1
867 1 39 LEU HG 1 74 PRO HB3 3.600 . 5.200 5.115 4.724 5.305 0.105 14 0 "[ . 1 . 2]" 1
868 1 70 ILE HG13 1 71 SER H 3.700 . 5.400 5.013 4.955 5.064 . 0 0 "[ . 1 . 2]" 1
869 1 70 ILE HB 1 70 ILE HG13 2.300 . 3.000 2.461 2.445 2.478 . 0 0 "[ . 1 . 2]" 1
870 1 70 ILE HG13 1 93 LEU MD2 3.200 . 6.000 5.739 5.544 6.010 0.010 5 0 "[ . 1 . 2]" 1
871 1 7 LYS QB 1 8 ILE QG 3.900 . 5.800 5.061 4.862 5.594 . 0 0 "[ . 1 . 2]" 1
872 1 6 PRO HG3 1 8 ILE QG 3.700 . 6.000 5.176 3.994 6.355 0.355 18 0 "[ . 1 . 2]" 1
873 1 39 LEU MD2 1 62 PHE QE 2.800 . 3.800 3.261 2.947 3.526 . 0 0 "[ . 1 . 2]" 1
874 1 39 LEU HB3 1 39 LEU MD2 2.800 . 3.800 2.428 2.396 2.472 . 0 0 "[ . 1 . 2]" 1
875 1 39 LEU HB2 1 39 LEU MD2 2.400 . 3.100 2.253 2.233 2.279 . 0 0 "[ . 1 . 2]" 1
876 1 39 LEU MD2 1 72 ILE MG 2.600 . 3.400 2.078 1.893 2.294 . 0 0 "[ . 1 . 2]" 1
877 1 39 LEU MD2 1 72 ILE MD 2.700 . 3.600 2.382 2.139 2.580 . 0 0 "[ . 1 . 2]" 1
878 1 74 PRO HG3 1 94 ILE HB 2.900 . 4.000 3.539 3.073 3.886 . 0 0 "[ . 1 . 2]" 1
879 1 57 LEU H 1 57 LEU HG 2.400 . 3.100 2.201 2.110 2.306 . 0 0 "[ . 1 . 2]" 1
880 1 70 ILE H 1 70 ILE HG13 2.500 . 3.300 2.549 2.296 2.919 . 0 0 "[ . 1 . 2]" 1
881 1 65 ALA HA 1 70 ILE HG13 2.900 . 4.000 3.210 2.917 3.455 . 0 0 "[ . 1 . 2]" 1
882 1 68 HIS HB2 1 70 ILE HG13 3.700 . 5.400 3.671 3.452 3.886 . 0 0 "[ . 1 . 2]" 1
883 1 57 LEU MD2 1 57 LEU HG 2.400 . 3.100 2.128 2.127 2.132 . 0 0 "[ . 1 . 2]" 1
884 1 12 GLU HA 1 16 ARG QG 3.400 . 6.000 5.419 4.823 5.725 . 0 0 "[ . 1 . 2]" 1
885 1 19 THR MG 1 22 HIS HD2 3.600 . 5.200 5.080 4.753 5.238 0.038 19 0 "[ . 1 . 2]" 1
886 1 19 THR MG 1 23 GLU HA 3.500 . 5.000 4.868 4.234 5.045 0.045 15 0 "[ . 1 . 2]" 1
887 1 15 ARG HB2 1 27 GLU HG3 2.600 . 6.000 4.297 2.938 5.475 . 0 0 "[ . 1 . 2]" 1
888 1 54 ALA HA 1 57 LEU MD2 2.100 . 6.000 4.402 4.195 4.652 . 0 0 "[ . 1 . 2]" 1
889 1 57 LEU HA 1 57 LEU MD2 2.500 . 3.300 2.126 2.041 2.173 . 0 0 "[ . 1 . 2]" 1
890 1 57 LEU MD2 1 60 ALA MB 2.100 . 6.000 3.651 3.382 3.889 . 0 0 "[ . 1 . 2]" 1
891 1 57 LEU MD1 1 57 LEU MD2 2.600 . 3.500 2.082 2.068 2.090 . 0 0 "[ . 1 . 2]" 1
892 1 29 LYS H 1 29 LYS HG2 3.100 . 4.300 2.758 2.148 3.946 . 0 0 "[ . 1 . 2]" 1
893 1 29 LYS HB3 1 29 LYS HG2 2.800 . 3.800 2.908 2.340 3.011 . 0 0 "[ . 1 . 2]" 1
894 1 90 TRP HB3 1 93 LEU MD1 2.300 . 2.900 1.972 1.838 2.185 . 0 0 "[ . 1 . 2]" 1
895 1 19 THR MG 1 21 ASP HB3 3.000 . 4.100 1.988 1.532 2.871 0.368 20 0 "[ . 1 . 2]" 1
896 1 19 THR MG 1 20 GLU H 3.100 . 4.300 3.113 2.711 3.479 . 0 0 "[ . 1 . 2]" 1
897 1 19 THR H 1 19 THR MG 2.300 . 3.000 2.127 1.787 2.408 . 0 0 "[ . 1 . 2]" 1
898 1 19 THR MG 1 21 ASP H 2.000 . 2.500 1.512 1.387 1.815 0.113 15 0 "[ . 1 . 2]" 1
899 1 62 PHE QE 1 93 LEU MD1 2.600 . 3.500 3.448 3.257 3.599 0.099 7 0 "[ . 1 . 2]" 1
900 1 19 THR HA 1 19 THR MG 2.400 . 3.100 2.096 2.089 2.103 . 0 0 "[ . 1 . 2]" 1
901 1 19 THR MG 1 48 LYS QE 2.500 . 3.300 2.739 1.990 3.318 0.018 9 0 "[ . 1 . 2]" 1
902 1 19 THR MG 1 53 LEU HG 2.800 . 3.800 3.609 3.265 3.922 0.122 10 0 "[ . 1 . 2]" 1
903 1 84 LEU H 1 84 LEU MD1 3.500 . 5.100 3.726 3.566 3.906 . 0 0 "[ . 1 . 2]" 1
904 1 73 ILE HA 1 84 LEU MD1 3.900 . 6.000 6.079 5.871 6.185 0.185 10 0 "[ . 1 . 2]" 1
905 1 80 SER HA 1 84 LEU MD1 2.500 . 3.300 1.893 1.684 2.289 0.016 14 0 "[ . 1 . 2]" 1
906 1 84 LEU MD1 1 85 PRO HD2 3.900 . 5.800 5.063 4.698 5.278 . 0 0 "[ . 1 . 2]" 1
907 1 74 PRO HB2 1 84 LEU MD1 3.100 . 4.300 4.149 3.420 4.379 0.079 3 0 "[ . 1 . 2]" 1
908 1 53 LEU QD 1 54 ALA HA 2.600 . 3.400 2.982 2.809 3.578 0.178 10 0 "[ . 1 . 2]" 1
909 1 24 ALA MB 1 53 LEU QD 2.400 . 3.100 1.976 1.846 2.194 . 0 0 "[ . 1 . 2]" 1
910 1 53 LEU H 1 53 LEU QD 3.500 . 5.000 3.616 3.549 3.765 . 0 0 "[ . 1 . 2]" 1
911 1 53 LEU HA 1 53 LEU QD 2.900 . 3.300 1.905 1.824 2.259 . 0 0 "[ . 1 . 2]" 1
912 1 48 LYS QE 1 53 LEU QD 3.000 . 4.100 3.020 2.115 3.709 . 0 0 "[ . 1 . 2]" 1
913 1 48 LYS HB3 1 53 LEU QD 3.300 . 4.600 3.635 3.016 4.032 . 0 0 "[ . 1 . 2]" 1
914 1 51 LEU HB3 1 53 LEU QD 2.100 . 6.000 4.914 4.533 5.647 . 0 0 "[ . 1 . 2]" 1
915 1 53 LEU QD 1 56 HIS HA 3.400 . 6.000 4.665 4.435 4.901 . 0 0 "[ . 1 . 2]" 1
916 1 58 CYS HB3 1 59 VAL H 2.400 . 3.100 2.594 2.517 2.695 . 0 0 "[ . 1 . 2]" 1
917 1 58 CYS H 1 58 CYS HB3 2.600 . 3.400 2.541 2.512 2.582 . 0 0 "[ . 1 . 2]" 1
918 1 58 CYS HB3 1 76 CYS HB2 3.100 . 6.000 4.856 4.596 5.295 . 0 0 "[ . 1 . 2]" 1
919 1 26 ILE MG 1 58 CYS HB3 3.700 . 6.000 5.495 5.076 5.759 . 0 0 "[ . 1 . 2]" 1
920 1 58 CYS HB3 1 83 PHE QD 3.100 . 4.300 4.401 4.341 4.585 0.285 7 0 "[ . 1 . 2]" 1
921 1 35 LYS H 1 35 LYS QG 2.400 . 3.100 2.563 2.350 2.865 . 0 0 "[ . 1 . 2]" 1
922 1 48 LYS HG2 1 51 LEU HG 2.900 . 6.000 4.430 2.290 5.858 . 0 0 "[ . 1 . 2]" 1
923 1 97 GLU HA 1 100 LYS HG3 2.100 . 6.000 5.274 4.035 6.089 0.089 13 0 "[ . 1 . 2]" 1
924 1 11 ASN QD 1 14 LYS HG2 2.700 . 3.600 2.749 1.806 3.581 . 0 0 "[ . 1 . 2]" 1
925 1 14 LYS QE 1 14 LYS HG2 2.600 . 3.500 2.468 2.315 3.401 . 0 0 "[ . 1 . 2]" 1
926 1 66 SER H 1 93 LEU MD2 3.200 . 4.500 3.310 2.881 3.760 . 0 0 "[ . 1 . 2]" 1
927 1 62 PHE QD 1 93 LEU MD2 2.100 . 6.000 4.393 4.172 4.586 . 0 0 "[ . 1 . 2]" 1
928 1 71 SER HB3 1 93 LEU MD2 2.100 . 6.000 5.160 4.731 6.008 0.008 10 0 "[ . 1 . 2]" 1
929 1 93 LEU HA 1 93 LEU MD2 2.800 . 3.800 2.188 2.060 2.354 . 0 0 "[ . 1 . 2]" 1
930 1 66 SER HA 1 93 LEU MD2 2.600 . 3.400 2.057 1.793 2.476 0.007 7 0 "[ . 1 . 2]" 1
931 1 62 PHE HA 1 93 LEU MD2 2.100 . 6.000 4.643 4.327 4.943 . 0 0 "[ . 1 . 2]" 1
932 1 93 LEU HB3 1 93 LEU MD2 2.500 . 3.300 2.316 2.259 2.355 . 0 0 "[ . 1 . 2]" 1
933 1 72 ILE MD 1 93 LEU MD2 2.100 . 6.000 3.758 3.540 3.981 . 0 0 "[ . 1 . 2]" 1
934 1 14 LYS QE 1 14 LYS HG3 2.800 . 3.800 2.623 2.351 3.302 . 0 0 "[ . 1 . 2]" 1
935 1 48 LYS HA 1 48 LYS HG3 2.700 . 3.600 2.938 2.664 3.880 0.280 17 0 "[ . 1 . 2]" 1
936 1 58 CYS HB2 1 59 VAL H 3.100 . 4.300 3.869 3.793 3.951 . 0 0 "[ . 1 . 2]" 1
937 1 58 CYS H 1 58 CYS HB2 2.600 . 3.400 2.525 2.436 2.579 . 0 0 "[ . 1 . 2]" 1
938 1 55 SER HA 1 58 CYS HB2 3.000 . 4.100 3.287 3.169 3.479 . 0 0 "[ . 1 . 2]" 1
939 1 58 CYS HA 1 58 CYS HB2 2.500 . 3.300 2.467 2.444 2.497 . 0 0 "[ . 1 . 2]" 1
940 1 58 CYS HB2 1 76 CYS HB2 2.600 . 3.400 3.474 3.143 3.936 0.536 17 1 "[ . 1 . + 2]" 1
941 1 100 LYS QE 1 100 LYS HG3 2.900 . 3.900 2.840 2.262 3.577 . 0 0 "[ . 1 . 2]" 1
942 1 97 GLU QB 1 100 LYS HG3 2.300 . 3.000 2.427 1.639 3.181 0.181 13 0 "[ . 1 . 2]" 1
943 1 72 ILE HG12 1 93 LEU MD2 2.100 . 6.000 4.978 4.829 5.092 . 0 0 "[ . 1 . 2]" 1
944 1 53 LEU QD 1 58 CYS H 3.400 . 6.000 5.240 5.150 5.784 . 0 0 "[ . 1 . 2]" 1
945 1 53 LEU QD 1 56 HIS H 3.400 . 4.900 3.735 3.540 4.070 . 0 0 "[ . 1 . 2]" 1
946 1 53 LEU QD 1 56 HIS HD2 3.300 . 4.700 4.109 3.082 4.504 . 0 0 "[ . 1 . 2]" 1
947 1 19 THR HA 1 53 LEU QD 3.000 . 4.200 3.586 3.234 3.772 . 0 0 "[ . 1 . 2]" 1
948 1 53 LEU QD 1 57 LEU HB3 3.500 . 6.000 4.464 4.255 5.069 . 0 0 "[ . 1 . 2]" 1
949 1 19 THR MG 1 53 LEU QD 2.100 . 6.000 2.549 1.690 2.918 . 0 0 "[ . 1 . 2]" 1
950 1 48 LYS HB2 1 53 LEU QD 3.600 . 5.200 3.586 2.652 3.903 . 0 0 "[ . 1 . 2]" 1
951 1 53 LEU QD 1 54 ALA MB 3.600 . 5.200 3.760 3.602 3.916 . 0 0 "[ . 1 . 2]" 1
952 1 6 PRO QD 1 53 LEU QD 2.100 . 6.000 3.764 2.793 4.736 . 0 0 "[ . 1 . 2]" 1
953 1 59 VAL MG2 1 90 TRP HE1 2.700 . 3.600 3.123 2.643 3.606 0.006 14 0 "[ . 1 . 2]" 1
954 1 59 VAL H 1 59 VAL MG2 2.600 . 3.400 2.180 2.119 2.259 . 0 0 "[ . 1 . 2]" 1
955 1 56 HIS H 1 59 VAL MG2 2.100 . 6.000 4.252 4.129 4.350 . 0 0 "[ . 1 . 2]" 1
956 1 59 VAL MG2 1 60 ALA H 3.500 . 5.000 3.956 3.888 4.018 . 0 0 "[ . 1 . 2]" 1
957 1 59 VAL MG1 1 59 VAL MG2 2.800 . 3.700 2.078 2.070 2.085 . 0 0 "[ . 1 . 2]" 1
958 1 57 LEU H 1 57 LEU MD1 3.400 . 4.900 3.452 3.380 3.531 . 0 0 "[ . 1 . 2]" 1
959 1 26 ILE H 1 57 LEU MD1 2.800 . 3.800 3.351 3.137 3.681 . 0 0 "[ . 1 . 2]" 1
960 1 18 GLU HA 1 57 LEU MD1 3.200 . 4.500 4.379 3.783 4.550 0.050 17 0 "[ . 1 . 2]" 1
961 1 19 THR HA 1 57 LEU MD1 3.400 . 6.000 5.338 4.955 5.641 . 0 0 "[ . 1 . 2]" 1
962 1 17 PHE HB3 1 57 LEU MD1 3.400 . 6.000 5.605 5.313 5.801 . 0 0 "[ . 1 . 2]" 1
963 1 19 THR MG 1 57 LEU MD1 2.100 . 6.000 3.858 3.482 4.336 . 0 0 "[ . 1 . 2]" 1
964 1 79 VAL H 1 79 VAL QG 2.500 . 3.300 2.056 1.962 2.105 . 0 0 "[ . 1 . 2]" 1
965 1 78 TYR QD 1 79 VAL QG 2.300 . 3.000 2.024 1.877 2.204 . 0 0 "[ . 1 . 2]" 1
966 1 79 VAL QG 1 83 PHE QB 3.300 . 4.700 2.034 1.953 2.119 . 0 0 "[ . 1 . 2]" 1
967 1 79 VAL QG 1 84 LEU H 2.900 . 4.000 3.814 3.666 3.974 . 0 0 "[ . 1 . 2]" 1
968 1 79 VAL QG 1 84 LEU HA 3.100 . 6.000 4.773 4.602 4.943 . 0 0 "[ . 1 . 2]" 1
969 1 79 VAL QG 1 83 PHE HB2 2.600 . 3.400 2.344 2.069 2.485 . 0 0 "[ . 1 . 2]" 1
970 1 79 VAL QG 1 84 LEU HG 2.600 . 3.500 3.310 3.067 3.495 . 0 0 "[ . 1 . 2]" 1
971 1 79 VAL QG 1 86 ARG QB 3.700 . 6.000 5.529 5.382 5.661 . 0 0 "[ . 1 . 2]" 1
972 1 58 CYS HB2 1 79 VAL QG 2.900 . 4.000 2.060 1.949 2.173 . 0 0 "[ . 1 . 2]" 1
973 1 24 ALA MB 1 54 ALA H 3.400 . 4.900 4.918 4.652 5.008 0.108 12 0 "[ . 1 . 2]" 1
974 1 24 ALA MB 1 25 PHE H 2.700 . 3.600 2.974 2.687 3.082 . 0 0 "[ . 1 . 2]" 1
975 1 24 ALA H 1 24 ALA MB 2.500 . 3.300 2.374 2.265 2.510 . 0 0 "[ . 1 . 2]" 1
976 1 18 GLU HA 1 24 ALA MB 3.400 . 4.800 4.757 4.547 4.871 0.071 7 0 "[ . 1 . 2]" 1
977 1 24 ALA MB 1 45 PRO HD3 2.700 . 3.600 2.115 1.762 2.549 0.038 5 0 "[ . 1 . 2]" 1
978 1 24 ALA MB 1 47 PHE QB 3.300 . 6.000 5.554 4.549 5.826 . 0 0 "[ . 1 . 2]" 1
979 1 24 ALA MB 1 43 TYR HB3 3.000 . 6.000 4.451 3.944 4.767 . 0 0 "[ . 1 . 2]" 1
980 1 24 ALA MB 1 26 ILE HB 3.900 . 6.000 6.027 5.917 6.130 0.130 20 0 "[ . 1 . 2]" 1
981 1 24 ALA MB 1 44 VAL QG 3.600 . 5.200 2.052 1.690 2.340 0.310 12 0 "[ . 1 . 2]" 1
982 1 84 LEU MD2 1 85 PRO HD3 3.700 . 5.400 4.652 4.526 4.987 . 0 0 "[ . 1 . 2]" 1
983 1 51 LEU H 1 51 LEU QD 3.500 . 5.000 3.500 2.596 3.894 . 0 0 "[ . 1 . 2]" 1
984 1 50 GLY QA 1 51 LEU QD 2.100 . 6.000 4.554 3.414 5.148 . 0 0 "[ . 1 . 2]" 1
985 1 84 LEU MD2 1 94 ILE HB 3.400 . 6.000 5.617 4.952 6.038 0.038 4 0 "[ . 1 . 2]" 1
986 1 29 LYS H 1 39 LEU MD1 3.300 . 4.600 4.209 4.016 4.431 . 0 0 "[ . 1 . 2]" 1
987 1 39 LEU H 1 39 LEU MD1 2.400 . 3.100 2.314 2.216 2.400 . 0 0 "[ . 1 . 2]" 1
988 1 39 LEU MD1 1 40 VAL H 3.600 . 5.200 4.186 4.055 4.270 . 0 0 "[ . 1 . 2]" 1
989 1 28 TYR QD 1 39 LEU MD1 3.200 . 4.500 3.826 3.409 4.317 . 0 0 "[ . 1 . 2]" 1
990 1 28 TYR HA 1 39 LEU MD1 3.500 . 5.000 4.029 3.641 4.352 . 0 0 "[ . 1 . 2]" 1
991 1 28 TYR HB3 1 39 LEU MD1 2.800 . 3.800 2.915 2.537 3.478 . 0 0 "[ . 1 . 2]" 1
992 1 28 TYR HB2 1 39 LEU MD1 2.400 . 3.100 2.496 2.244 2.909 . 0 0 "[ . 1 . 2]" 1
993 1 37 MET HB3 1 39 LEU MD1 2.500 . 3.300 2.373 2.174 2.586 . 0 0 "[ . 1 . 2]" 1
994 1 39 LEU MD1 1 39 LEU HG 2.400 . 3.100 2.119 2.115 2.122 . 0 0 "[ . 1 . 2]" 1
995 1 26 ILE MG 1 39 LEU MD1 3.300 . 4.600 4.324 4.115 4.516 . 0 0 "[ . 1 . 2]" 1
996 1 39 LEU MD1 1 72 ILE MD 2.600 . 3.500 2.141 1.888 2.299 . 0 0 "[ . 1 . 2]" 1
997 1 82 THR MG 1 83 PHE H 2.400 . 3.100 1.973 1.853 2.081 . 0 0 "[ . 1 . 2]" 1
998 1 82 THR H 1 82 THR MG 2.400 . 3.100 1.948 1.875 2.042 . 0 0 "[ . 1 . 2]" 1
999 1 78 TYR QE 1 82 THR MG 2.700 . 3.600 3.281 3.079 3.422 . 0 0 "[ . 1 . 2]" 1
1000 1 81 ASP HA 1 82 THR MG 3.700 . 5.400 5.105 5.016 5.217 . 0 0 "[ . 1 . 2]" 1
1001 1 79 VAL QG 1 82 THR MG 3.500 . 5.000 3.566 3.447 3.705 . 0 0 "[ . 1 . 2]" 1
1002 1 40 VAL H 1 40 VAL QG 2.800 . 3.800 2.538 2.090 2.831 . 0 0 "[ . 1 . 2]" 1
1003 1 29 LYS QE 1 40 VAL QG 2.600 . 3.500 2.580 1.500 3.226 0.200 20 0 "[ . 1 . 2]" 1
1004 1 59 VAL H 1 59 VAL MG1 3.600 . 5.200 3.757 3.746 3.767 . 0 0 "[ . 1 . 2]" 1
1005 1 56 HIS H 1 59 VAL MG1 2.100 . 6.000 5.979 5.713 6.062 0.062 9 0 "[ . 1 . 2]" 1
1006 1 59 VAL MG1 1 60 ALA H 3.000 . 4.100 3.453 3.387 3.529 . 0 0 "[ . 1 . 2]" 1
1007 1 59 VAL MG1 1 63 GLU HG2 2.600 . 3.500 2.667 2.206 3.314 . 0 0 "[ . 1 . 2]" 1
1008 1 59 VAL MG1 1 63 GLU HG3 3.000 . 4.100 2.704 2.328 3.113 . 0 0 "[ . 1 . 2]" 1
1009 1 9 VAL H 1 9 VAL QG 2.700 . 3.600 2.240 1.931 2.365 0.069 9 0 "[ . 1 . 2]" 1
1010 1 9 VAL QG 1 10 TRP H . . 3.600 2.520 2.090 2.955 . 0 0 "[ . 1 . 2]" 1
1011 1 9 VAL QG 1 18 GLU QB 3.000 . 4.100 3.486 1.915 3.794 . 0 0 "[ . 1 . 2]" 1
1012 1 7 LYS QB 1 9 VAL QG 2.800 . 3.800 3.555 3.154 3.829 0.029 17 0 "[ . 1 . 2]" 1
1013 1 72 ILE HG12 1 94 ILE MG 2.100 . 6.000 4.305 4.156 4.497 . 0 0 "[ . 1 . 2]" 1
1014 1 98 VAL H 1 98 VAL MG1 2.400 . 3.100 2.028 1.809 3.215 0.115 4 0 "[ . 1 . 2]" 1
1015 1 82 THR HA 1 98 VAL MG1 2.200 . 6.000 5.942 5.191 6.090 0.090 14 0 "[ . 1 . 2]" 1
1016 1 98 VAL HA 1 98 VAL MG1 3.300 . 4.600 3.194 2.951 3.222 . 0 0 "[ . 1 . 2]" 1
1017 1 44 VAL QG 1 45 PRO HD3 3.300 . 4.700 3.112 2.857 3.279 . 0 0 "[ . 1 . 2]" 1
1018 1 36 VAL MG1 1 37 MET H 2.700 . 3.600 2.820 2.732 2.873 . 0 0 "[ . 1 . 2]" 1
1019 1 36 VAL MG1 1 73 ILE H 2.900 . 3.900 2.998 2.720 3.329 . 0 0 "[ . 1 . 2]" 1
1020 1 36 VAL MG1 1 72 ILE HA 2.700 . 3.600 2.755 2.478 3.050 . 0 0 "[ . 1 . 2]" 1
1021 1 36 VAL HA 1 36 VAL MG1 2.800 . 3.700 2.484 2.421 2.569 . 0 0 "[ . 1 . 2]" 1
1022 1 32 ASN QB 1 36 VAL MG1 3.200 . 6.000 4.236 3.970 4.485 . 0 0 "[ . 1 . 2]" 1
1023 1 36 VAL MG1 1 38 ASP QB 2.700 . 3.600 3.328 3.007 3.543 . 0 0 "[ . 1 . 2]" 1
1024 1 36 VAL HA 1 36 VAL MG2 2.700 . 3.600 2.314 2.239 2.376 . 0 0 "[ . 1 . 2]" 1
1025 1 32 ASN QB 1 36 VAL MG2 2.900 . 3.900 2.740 2.349 3.195 . 0 0 "[ . 1 . 2]" 1
1026 1 35 LYS HB2 1 36 VAL MG2 2.600 . 3.500 2.895 2.698 3.099 . 0 0 "[ . 1 . 2]" 1
1027 1 36 VAL MG2 1 72 ILE HG12 3.600 . 6.000 6.010 5.609 6.078 0.078 18 0 "[ . 1 . 2]" 1
1028 1 98 VAL MG2 1 99 PHE H 3.000 . 4.200 3.657 3.072 4.241 0.041 8 0 "[ . 1 . 2]" 1
1029 1 98 VAL H 1 98 VAL MG2 3.500 . 5.100 3.777 3.607 3.872 . 0 0 "[ . 1 . 2]" 1
1030 1 98 VAL HA 1 98 VAL MG2 2.800 . 3.800 2.378 2.107 2.502 . 0 0 "[ . 1 . 2]" 1
1031 1 42 THR MG 1 43 TYR H 3.200 . 4.500 4.012 3.742 4.253 . 0 0 "[ . 1 . 2]" 1
1032 1 42 THR H 1 42 THR MG 2.400 . 3.100 1.936 1.831 2.073 . 0 0 "[ . 1 . 2]" 1
1033 1 42 THR MG 1 43 TYR QE 3.000 . 6.000 6.175 6.018 6.304 0.304 5 0 "[ . 1 . 2]" 1
1034 1 26 ILE HA 1 42 THR MG 3.400 . 6.000 5.477 5.229 5.598 . 0 0 "[ . 1 . 2]" 1
1035 1 42 THR HA 1 42 THR MG 2.900 . 4.000 3.217 3.202 3.223 . 0 0 "[ . 1 . 2]" 1
1036 1 42 THR HB 1 42 THR MG 2.400 . 3.100 2.134 2.128 2.138 . 0 0 "[ . 1 . 2]" 1
1037 1 42 THR MG 1 76 CYS HB2 3.400 . 4.900 3.998 2.397 4.584 . 0 0 "[ . 1 . 2]" 1
1038 1 44 VAL H 1 44 VAL QG 2.700 . 3.600 2.495 2.317 2.707 . 0 0 "[ . 1 . 2]" 1
1039 1 43 TYR HB3 1 44 VAL QG 3.100 . 6.000 4.893 4.575 5.027 . 0 0 "[ . 1 . 2]" 1
1040 1 44 VAL QG 1 54 ALA H 2.800 . 3.800 2.706 2.215 2.922 . 0 0 "[ . 1 . 2]" 1
1041 1 8 ILE MG 1 17 PHE HB2 3.400 . 4.900 2.910 2.651 3.358 . 0 0 "[ . 1 . 2]" 1
1042 1 8 ILE MG 1 19 THR MG 3.300 . 4.700 4.620 4.471 4.721 0.021 4 0 "[ . 1 . 2]" 1
1043 1 8 ILE MG 1 26 ILE MG 3.900 . 5.800 4.550 4.130 4.902 . 0 0 "[ . 1 . 2]" 1
1044 1 8 ILE MG 1 57 LEU MD2 2.600 . 3.400 2.221 1.993 2.396 . 0 0 "[ . 1 . 2]" 1
1045 1 40 VAL QG 1 41 HIS H 3.100 . 4.300 2.922 2.710 3.140 . 0 0 "[ . 1 . 2]" 1
1046 1 37 MET H 1 70 ILE MG 2.700 . 3.600 2.680 2.460 2.953 . 0 0 "[ . 1 . 2]" 1
1047 1 70 ILE MG 1 71 SER H 2.500 . 3.300 2.176 2.069 2.365 . 0 0 "[ . 1 . 2]" 1
1048 1 7 LYS HA 1 8 ILE MG 3.800 . 5.700 5.506 5.460 5.558 . 0 0 "[ . 1 . 2]" 1
1049 1 70 ILE HB 1 70 ILE MG 2.400 . 3.100 2.129 2.126 2.132 . 0 0 "[ . 1 . 2]" 1
1050 1 70 ILE H 1 70 ILE MG 3.500 . 5.000 3.829 3.781 3.922 . 0 0 "[ . 1 . 2]" 1
1051 1 60 ALA H 1 60 ALA MB 2.700 . 3.600 2.242 2.228 2.252 . 0 0 "[ . 1 . 2]" 1
1052 1 60 ALA MB 1 61 ALA H 2.800 . 3.700 2.690 2.529 2.832 . 0 0 "[ . 1 . 2]" 1
1053 1 8 ILE HB 1 60 ALA MB 2.800 . 3.800 3.490 3.098 3.951 0.151 3 0 "[ . 1 . 2]" 1
1054 1 8 ILE MD 1 60 ALA MB 2.100 . 6.000 4.155 3.909 4.593 . 0 0 "[ . 1 . 2]" 1
1055 1 60 ALA MB 1 63 GLU HG2 3.500 . 5.000 5.108 4.845 5.309 0.309 2 0 "[ . 1 . 2]" 1
1056 1 68 HIS HB3 1 70 ILE MG 3.900 . 5.800 4.440 4.276 4.565 . 0 0 "[ . 1 . 2]" 1
1057 1 61 ALA MB 1 62 PHE H 2.700 . 3.600 2.631 2.574 2.688 . 0 0 "[ . 1 . 2]" 1
1058 1 61 ALA MB 1 62 PHE QD 3.200 . 4.500 4.376 4.310 4.438 . 0 0 "[ . 1 . 2]" 1
1059 1 28 TYR QD 1 61 ALA MB 2.900 . 3.900 3.347 2.922 3.940 0.040 17 0 "[ . 1 . 2]" 1
1060 1 58 CYS HA 1 61 ALA MB 2.700 . 3.600 3.141 2.839 3.387 . 0 0 "[ . 1 . 2]" 1
1061 1 26 ILE H 1 26 ILE MG 2.800 . 3.800 3.084 2.906 3.491 . 0 0 "[ . 1 . 2]" 1
1062 1 17 PHE H 1 26 ILE MG 2.600 . 3.500 2.590 2.260 3.107 . 0 0 "[ . 1 . 2]" 1
1063 1 17 PHE QD 1 26 ILE MG 2.500 . 3.300 1.954 1.658 2.465 0.042 2 0 "[ . 1 . 2]" 1
1064 1 26 ILE MG 1 57 LEU HA 3.300 . 4.700 3.969 3.660 4.575 . 0 0 "[ . 1 . 2]" 1
1065 1 26 ILE MG 1 58 CYS HA 3.000 . 4.100 3.016 2.519 3.309 . 0 0 "[ . 1 . 2]" 1
1066 1 17 PHE HB3 1 26 ILE MG 3.800 . 5.600 4.157 3.668 4.686 . 0 0 "[ . 1 . 2]" 1
1067 1 26 ILE MG 1 40 VAL HB 3.100 . 6.000 5.805 5.365 6.206 0.206 8 0 "[ . 1 . 2]" 1
1068 1 26 ILE QG 1 26 ILE MG 3.000 . 4.200 2.408 2.343 2.546 . 0 0 "[ . 1 . 2]" 1
1069 1 26 ILE MG 1 72 ILE MG 3.600 . 6.000 6.020 5.799 6.149 0.149 3 0 "[ . 1 . 2]" 1
1070 1 65 ALA MB 1 66 SER H 2.500 . 3.300 2.375 2.251 2.451 . 0 0 "[ . 1 . 2]" 1
1071 1 65 ALA H 1 65 ALA MB 2.500 . 3.300 2.246 2.227 2.259 . 0 0 "[ . 1 . 2]" 1
1072 1 65 ALA MB 1 70 ILE H 3.300 . 4.700 3.226 3.092 3.325 . 0 0 "[ . 1 . 2]" 1
1073 1 64 HIS H 1 65 ALA MB 3.400 . 4.800 4.316 4.198 4.392 . 0 0 "[ . 1 . 2]" 1
1074 1 65 ALA MB 1 66 SER HA 2.900 . 4.000 3.770 3.719 3.816 . 0 0 "[ . 1 . 2]" 1
1075 1 65 ALA MB 1 70 ILE HB 2.200 . 2.800 1.803 1.615 2.087 . 0 0 "[ . 1 . 2]" 1
1076 1 65 ALA MB 1 72 ILE QG 2.500 . 3.300 2.150 2.061 2.243 . 0 0 "[ . 1 . 2]" 1
1077 1 65 ALA MB 1 72 ILE MD 2.400 . 3.100 1.766 1.691 1.901 0.009 15 0 "[ . 1 . 2]" 1
1078 1 65 ALA MB 1 72 ILE MG 3.900 . 5.800 3.965 3.913 4.022 . 0 0 "[ . 1 . 2]" 1
1079 1 94 ILE MD 1 95 HIS H 2.500 . 3.300 2.924 2.436 3.343 0.043 16 0 "[ . 1 . 2]" 1
1080 1 73 ILE HA 1 94 ILE MD 3.600 . 5.200 4.531 4.166 5.060 . 0 0 "[ . 1 . 2]" 1
1081 1 74 PRO HG3 1 94 ILE MD 2.600 . 3.400 2.533 2.017 2.841 . 0 0 "[ . 1 . 2]" 1
1082 1 94 ILE MD 1 94 ILE MG 2.900 . 3.900 2.010 1.862 2.421 0.038 15 0 "[ . 1 . 2]" 1
1083 1 72 ILE MG 1 94 ILE MD 2.100 . 6.000 3.902 3.610 4.143 . 0 0 "[ . 1 . 2]" 1
1084 1 72 ILE MG 1 73 ILE H 2.300 . 2.900 2.186 2.075 2.256 . 0 0 "[ . 1 . 2]" 1
1085 1 72 ILE MG 1 73 ILE HA 2.800 . 3.800 3.146 3.101 3.222 . 0 0 "[ . 1 . 2]" 1
1086 1 39 LEU HG 1 72 ILE MG 3.500 . 5.000 3.873 3.787 3.994 . 0 0 "[ . 1 . 2]" 1
1087 1 72 ILE MD 1 72 ILE MG 2.400 . 3.100 1.784 1.755 1.829 . 0 0 "[ . 1 . 2]" 1
1088 1 73 ILE H 1 73 ILE MG 3.100 . 4.300 3.797 3.768 3.820 . 0 0 "[ . 1 . 2]" 1
1089 1 73 ILE MG 1 75 SER H 2.700 . 3.600 3.563 3.384 3.640 0.040 4 0 "[ . 1 . 2]" 1
1090 1 38 ASP HA 1 73 ILE MG 3.000 . 4.100 3.457 3.280 3.570 . 0 0 "[ . 1 . 2]" 1
1091 1 40 VAL HA 1 73 ILE MG 3.200 . 6.000 6.118 6.065 6.216 0.216 1 0 "[ . 1 . 2]" 1
1092 1 38 ASP QB 1 73 ILE MG 2.100 . 6.000 3.976 3.675 4.156 . 0 0 "[ . 1 . 2]" 1
1093 1 26 ILE MD 1 26 ILE MG 2.500 . 3.300 1.866 1.785 1.943 . 0 0 "[ . 1 . 2]" 1
1094 1 26 ILE MD 1 58 CYS HA 2.400 . 3.100 2.372 1.998 3.119 0.019 14 0 "[ . 1 . 2]" 1
1095 1 26 ILE MD 1 79 VAL QG 3.000 . 4.100 3.409 2.875 4.051 . 0 0 "[ . 1 . 2]" 1
1096 1 54 ALA H 1 54 ALA MB 2.600 . 3.500 2.222 2.208 2.231 . 0 0 "[ . 1 . 2]" 1
1097 1 54 ALA MB 1 55 SER H 2.600 . 3.400 2.339 2.213 2.464 . 0 0 "[ . 1 . 2]" 1
1098 1 54 ALA MB 1 78 TYR QE 2.700 . 3.600 2.090 1.902 2.572 . 0 0 "[ . 1 . 2]" 1
1099 1 52 GLY HA3 1 54 ALA MB 3.500 . 6.000 5.649 5.436 5.795 . 0 0 "[ . 1 . 2]" 1
1100 1 53 LEU QB 1 54 ALA MB 3.300 . 4.600 3.914 3.796 4.017 . 0 0 "[ . 1 . 2]" 1
1101 1 44 VAL HB 1 54 ALA MB 2.600 . 3.500 2.582 2.045 3.281 . 0 0 "[ . 1 . 2]" 1
1102 1 54 ALA MB 1 57 LEU HG 3.400 . 4.800 4.625 4.458 4.805 0.005 18 0 "[ . 1 . 2]" 1
1103 1 54 ALA MB 1 82 THR MG 3.100 . 6.000 5.604 5.343 5.972 . 0 0 "[ . 1 . 2]" 1
1104 1 70 ILE H 1 70 ILE MD 3.600 . 5.200 3.874 3.667 4.175 . 0 0 "[ . 1 . 2]" 1
1105 1 68 HIS H 1 70 ILE MD 2.100 . 6.000 4.234 4.017 4.476 . 0 0 "[ . 1 . 2]" 1
1106 1 73 ILE MD 1 94 ILE HG12 3.500 . 6.000 5.775 5.460 6.222 0.222 2 0 "[ . 1 . 2]" 1
1107 1 73 ILE MD 1 95 HIS H 2.800 . 3.800 3.292 2.923 3.792 . 0 0 "[ . 1 . 2]" 1
1108 1 73 ILE HA 1 73 ILE MD 2.400 . 3.100 1.958 1.917 2.056 . 0 0 "[ . 1 . 2]" 1
1109 1 70 ILE HA 1 70 ILE MD 3.700 . 5.400 3.845 3.802 3.886 . 0 0 "[ . 1 . 2]" 1
1110 1 64 HIS HA 1 70 ILE MD 2.100 . 6.000 5.626 5.260 5.995 . 0 0 "[ . 1 . 2]" 1
1111 1 64 HIS QB 1 70 ILE MD 2.100 . 6.000 4.734 4.002 5.095 . 0 0 "[ . 1 . 2]" 1
1112 1 73 ILE MD 1 74 PRO HG3 4.000 . 6.000 5.061 4.918 5.241 . 0 0 "[ . 1 . 2]" 1
1113 1 36 VAL MG1 1 73 ILE MD 3.500 . 5.100 3.339 3.018 3.675 . 0 0 "[ . 1 . 2]" 1
1114 1 73 ILE MD 1 95 HIS HD2 2.700 . 3.600 2.897 1.979 3.650 0.050 11 0 "[ . 1 . 2]" 1
1115 1 72 ILE H 1 72 ILE MD 3.500 . 5.000 4.499 4.446 4.558 . 0 0 "[ . 1 . 2]" 1
1116 1 62 PHE QD 1 72 ILE MD 2.400 . 3.100 1.669 1.625 1.744 0.075 5 0 "[ . 1 . 2]" 1
1117 1 72 ILE MD 1 93 LEU HB3 3.200 . 4.500 3.169 2.858 3.535 . 0 0 "[ . 1 . 2]" 1
1118 1 72 ILE MD 1 93 LEU HB2 3.100 . 4.300 3.597 3.433 3.995 . 0 0 "[ . 1 . 2]" 1
1119 1 26 ILE MD 1 72 ILE MD 3.400 . 6.000 6.022 5.912 6.080 0.080 10 0 "[ . 1 . 2]" 1
1120 1 8 ILE MD 1 9 VAL H 3.700 . 5.400 4.058 3.769 4.721 . 0 0 "[ . 1 . 2]" 1
1121 1 8 ILE MD 1 19 THR H 3.200 . 4.500 3.873 3.513 4.662 0.162 17 0 "[ . 1 . 2]" 1
1122 1 6 PRO HA 1 8 ILE MD 3.600 . 5.200 4.251 3.915 4.579 . 0 0 "[ . 1 . 2]" 1
1123 1 8 ILE H 1 8 ILE MD 3.000 . 4.100 3.046 2.167 3.391 . 0 0 "[ . 1 . 2]" 1
1124 1 8 ILE MD 1 57 LEU HA 3.200 . 4.500 3.911 3.495 4.317 . 0 0 "[ . 1 . 2]" 1
1125 1 8 ILE MD 1 17 PHE HB3 3.900 . 5.800 4.603 4.247 5.397 . 0 0 "[ . 1 . 2]" 1
1126 1 14 LYS HA 1 14 LYS QE 3.600 . 5.200 4.008 2.157 4.865 . 0 0 "[ . 1 . 2]" 1
1127 1 14 LYS HA 1 15 ARG H 2.800 . 3.800 3.254 3.178 3.329 . 0 0 "[ . 1 . 2]" 1
1128 1 17 PHE H 1 17 PHE HA 2.600 . 3.400 2.949 2.937 2.961 . 0 0 "[ . 1 . 2]" 1
1129 1 34 GLY H 1 35 LYS HA 3.500 . 5.000 4.831 4.498 5.051 0.051 11 0 "[ . 1 . 2]" 1
1130 1 28 TYR HB2 1 39 LEU HA 2.600 . 3.400 2.757 2.307 3.010 . 0 0 "[ . 1 . 2]" 1
1131 1 39 LEU HA 1 41 HIS H 3.300 . 6.000 5.689 5.400 5.875 . 0 0 "[ . 1 . 2]" 1
1132 1 52 GLY HA3 1 56 HIS HD2 2.700 . 3.600 3.156 2.539 3.674 0.074 3 0 "[ . 1 . 2]" 1
1133 1 53 LEU HA 1 54 ALA H 2.700 . 3.600 3.554 3.544 3.565 . 0 0 "[ . 1 . 2]" 1
1134 1 55 SER HA 1 58 CYS H 2.600 . 3.400 3.137 2.938 3.254 . 0 0 "[ . 1 . 2]" 1
1135 1 55 SER HA 1 76 CYS HB2 3.800 . 6.000 6.046 4.978 6.636 0.636 17 1 "[ . 1 . + 2]" 1
1136 1 66 SER HA 1 71 SER HA 3.500 . 6.000 5.787 5.524 6.023 0.023 9 0 "[ . 1 . 2]" 1
1137 1 76 CYS HA 1 79 VAL QG 3.500 . 5.000 4.102 3.948 4.195 . 0 0 "[ . 1 . 2]" 1
1138 1 76 CYS HB3 1 78 TYR HB3 3.000 . 6.000 4.845 4.464 6.141 0.141 14 0 "[ . 1 . 2]" 1
1139 1 78 TYR H 1 78 TYR HB3 2.400 . 3.100 2.149 2.122 2.212 . 0 0 "[ . 1 . 2]" 1
1140 1 84 LEU HA 1 87 ASN HD21 2.800 . 6.000 4.539 2.856 5.960 . 0 0 "[ . 1 . 2]" 1
1141 1 85 PRO HB3 1 86 ARG H 3.300 . 4.600 4.110 4.004 4.215 . 0 0 "[ . 1 . 2]" 1
1142 1 86 ARG QB 1 87 ASN H 2.700 . 3.600 2.568 2.206 2.805 . 0 0 "[ . 1 . 2]" 1
1143 1 86 ARG HD3 1 87 ASN HD21 2.900 . 6.000 3.997 3.178 6.007 0.007 3 0 "[ . 1 . 2]" 1
1144 1 88 PRO HA 1 89 SER H 2.400 . 3.100 2.624 2.233 2.869 . 0 0 "[ . 1 . 2]" 1
1145 1 16 ARG QB 1 17 PHE HA 3.000 . 6.000 4.494 4.143 4.720 . 0 0 "[ . 1 . 2]" 1
1146 1 8 ILE MG 1 17 PHE HA 3.300 . 4.600 3.414 3.147 3.946 . 0 0 "[ . 1 . 2]" 1
1147 1 30 MET HA 1 34 GLY QA 4.100 . 6.000 3.487 3.242 3.604 . 0 0 "[ . 1 . 2]" 1
1148 1 30 MET HG2 1 34 GLY QA 3.800 . 5.600 3.865 3.647 4.047 . 0 0 "[ . 1 . 2]" 1
1149 1 18 GLU HA 1 25 PHE HA 2.500 . 3.300 2.279 2.051 2.538 . 0 0 "[ . 1 . 2]" 1
1150 1 10 TRP HE1 1 11 ASN H 3.700 . 5.400 4.688 4.312 4.979 . 0 0 "[ . 1 . 2]" 1
1151 1 11 ASN H 1 17 PHE H 3.400 . 4.800 4.607 4.507 4.702 . 0 0 "[ . 1 . 2]" 1
1152 1 11 ASN H 1 11 ASN QD 3.700 . 5.400 4.538 4.285 4.731 . 0 0 "[ . 1 . 2]" 1
1153 1 11 ASN H 1 16 ARG H 3.000 . 4.100 3.512 3.113 3.946 . 0 0 "[ . 1 . 2]" 1
1154 1 11 ASN H 1 17 PHE QD 4.000 . 6.000 3.924 3.648 4.139 . 0 0 "[ . 1 . 2]" 1
1155 1 11 ASN H 1 17 PHE QE 4.100 . 6.000 5.341 5.098 5.619 . 0 0 "[ . 1 . 2]" 1
1156 1 10 TRP HD1 1 11 ASN H 2.900 . 3.900 2.566 2.190 2.898 . 0 0 "[ . 1 . 2]" 1
1157 1 10 TRP HB3 1 11 ASN H 3.800 . 5.600 4.367 4.266 4.428 . 0 0 "[ . 1 . 2]" 1
1158 1 11 ASN H 1 12 GLU HA 3.300 . 6.000 4.768 4.659 4.887 . 0 0 "[ . 1 . 2]" 1
1159 1 11 ASN H 1 16 ARG QB 3.700 . 5.400 4.765 4.583 4.920 . 0 0 "[ . 1 . 2]" 1
1160 1 9 VAL QG 1 11 ASN H 3.300 . 4.700 3.979 3.276 4.408 . 0 0 "[ . 1 . 2]" 1
1161 1 78 TYR H 1 79 VAL QG 3.900 . 5.800 4.093 4.036 4.165 . 0 0 "[ . 1 . 2]" 1
1162 1 77 SER H 1 78 TYR H 3.000 . 4.100 3.064 3.025 3.116 . 0 0 "[ . 1 . 2]" 1
1163 1 78 TYR H 1 79 VAL H 2.800 . 3.800 2.718 2.674 2.766 . 0 0 "[ . 1 . 2]" 1
1164 1 78 TYR H 1 78 TYR QD 3.800 . 5.600 3.778 3.558 3.971 . 0 0 "[ . 1 . 2]" 1
1165 1 77 SER HA 1 78 TYR H 2.900 . 4.000 3.477 3.456 3.513 . 0 0 "[ . 1 . 2]" 1
1166 1 95 HIS H 1 96 SER H 3.200 . 4.500 3.043 2.356 3.483 . 0 0 "[ . 1 . 2]" 1
1167 1 95 HIS H 1 95 HIS HD2 2.900 . 3.900 3.274 2.235 3.928 0.028 1 0 "[ . 1 . 2]" 1
1168 1 95 HIS H 1 102 SER QB 3.600 . 6.000 5.160 4.458 5.861 . 0 0 "[ . 1 . 2]" 1
1169 1 95 HIS H 1 95 HIS QB 3.600 . 5.200 2.330 2.062 2.900 . 0 0 "[ . 1 . 2]" 1
1170 1 94 ILE HB 1 95 HIS H 2.400 . 3.100 1.800 1.656 1.969 0.044 15 0 "[ . 1 . 2]" 1
1171 1 38 ASP H 1 39 LEU H 3.300 . 4.700 4.251 4.227 4.281 . 0 0 "[ . 1 . 2]" 1
1172 1 38 ASP H 1 73 ILE H 3.300 . 4.600 4.367 4.202 4.504 . 0 0 "[ . 1 . 2]" 1
1173 1 28 TYR QD 1 38 ASP H 3.100 . 4.300 4.103 3.747 4.355 0.055 3 0 "[ . 1 . 2]" 1
1174 1 28 TYR HA 1 38 ASP H 3.700 . 5.400 4.663 4.425 4.783 . 0 0 "[ . 1 . 2]" 1
1175 1 30 MET HA 1 38 ASP H 3.300 . 4.700 3.160 3.025 3.339 . 0 0 "[ . 1 . 2]" 1
1176 1 37 MET HA 1 38 ASP H 2.800 . 3.800 2.106 2.060 2.154 . 0 0 "[ . 1 . 2]" 1
1177 1 28 TYR HB2 1 38 ASP H 3.000 . 4.100 3.723 3.435 4.030 . 0 0 "[ . 1 . 2]" 1
1178 1 37 MET HB3 1 38 ASP H 2.900 . 3.900 3.675 3.528 4.099 0.199 5 0 "[ . 1 . 2]" 1
1179 1 38 ASP H 1 73 ILE HB 3.500 . 5.000 4.765 4.385 4.965 . 0 0 "[ . 1 . 2]" 1
1180 1 29 LYS HG2 1 38 ASP H 3.600 . 5.200 3.632 2.892 5.922 0.722 14 1 "[ . 1 +. 2]" 1
1181 1 38 ASP H 1 72 ILE MG 3.400 . 4.900 4.912 4.851 4.962 0.062 2 0 "[ . 1 . 2]" 1
1182 1 37 MET H 1 71 SER H 3.200 . 4.500 4.079 3.924 4.260 . 0 0 "[ . 1 . 2]" 1
1183 1 37 MET H 1 72 ILE MG 3.900 . 5.800 4.104 3.980 4.209 . 0 0 "[ . 1 . 2]" 1
1184 1 42 THR H 1 43 TYR H 3.300 . 4.600 4.461 4.326 4.547 . 0 0 "[ . 1 . 2]" 1
1185 1 41 HIS H 1 42 THR H 3.700 . 5.400 3.232 2.950 3.453 . 0 0 "[ . 1 . 2]" 1
1186 1 41 HIS HD2 1 42 THR H 3.000 . 4.100 3.527 2.793 4.147 0.047 11 0 "[ . 1 . 2]" 1
1187 1 26 ILE HA 1 42 THR H 3.400 . 6.000 4.961 4.774 5.111 . 0 0 "[ . 1 . 2]" 1
1188 1 42 THR H 1 76 CYS HA 3.300 . 4.700 3.069 2.650 3.348 . 0 0 "[ . 1 . 2]" 1
1189 1 42 THR H 1 76 CYS HB3 3.500 . 5.000 3.524 3.162 4.059 . 0 0 "[ . 1 . 2]" 1
1190 1 42 THR H 1 76 CYS HB2 4.200 . 6.000 4.833 3.757 5.319 . 0 0 "[ . 1 . 2]" 1
1191 1 42 THR H 1 42 THR HG1 3.800 . 5.600 4.556 4.181 4.659 . 0 0 "[ . 1 . 2]" 1
1192 1 37 MET H 1 37 MET HB3 3.600 . 5.200 3.503 2.771 3.640 . 0 0 "[ . 1 . 2]" 1
1193 1 27 GLU H 1 40 VAL H 2.900 . 4.000 3.873 3.507 4.037 0.037 19 0 "[ . 1 . 2]" 1
1194 1 27 GLU H 1 41 HIS H 3.200 . 6.000 4.900 4.778 4.985 . 0 0 "[ . 1 . 2]" 1
1195 1 25 PHE QD 1 27 GLU H 3.100 . 4.300 3.868 3.511 4.308 0.008 19 0 "[ . 1 . 2]" 1
1196 1 27 GLU H 1 41 HIS HB2 3.800 . 5.600 4.689 4.520 4.907 . 0 0 "[ . 1 . 2]" 1
1197 1 27 GLU H 1 27 GLU HG3 3.900 . 5.800 4.475 3.832 4.691 . 0 0 "[ . 1 . 2]" 1
1198 1 26 ILE HB 1 27 GLU H 3.600 . 5.200 4.435 4.352 4.525 . 0 0 "[ . 1 . 2]" 1
1199 1 26 ILE MD 1 27 GLU H 3.500 . 5.000 3.521 2.063 4.477 . 0 0 "[ . 1 . 2]" 1
1200 1 25 PHE H 1 43 TYR H 3.000 . 4.100 2.997 2.839 3.101 . 0 0 "[ . 1 . 2]" 1
1201 1 43 TYR H 1 44 VAL H 3.700 . 5.400 4.355 4.277 4.477 . 0 0 "[ . 1 . 2]" 1
1202 1 41 HIS HD2 1 43 TYR H 3.100 . 4.300 3.953 3.437 4.360 0.060 5 0 "[ . 1 . 2]" 1
1203 1 43 TYR H 1 43 TYR QD 3.700 . 5.400 4.289 2.633 4.437 . 0 0 "[ . 1 . 2]" 1
1204 1 26 ILE HA 1 43 TYR H 3.200 . 4.500 3.687 3.244 3.928 . 0 0 "[ . 1 . 2]" 1
1205 1 42 THR HB 1 43 TYR H 4.000 . 6.000 4.250 4.177 4.340 . 0 0 "[ . 1 . 2]" 1
1206 1 42 THR HG1 1 43 TYR H 3.400 . 4.900 3.996 3.702 4.269 . 0 0 "[ . 1 . 2]" 1
1207 1 62 PHE QD 1 90 TRP HE1 3.000 . 4.100 3.893 3.649 4.138 0.038 17 0 "[ . 1 . 2]" 1
1208 1 90 TRP HA 1 90 TRP HE1 3.500 . 6.000 5.858 5.771 5.919 . 0 0 "[ . 1 . 2]" 1
1209 1 90 TRP HB3 1 90 TRP HE1 3.600 . 5.200 5.186 5.162 5.204 0.004 5 0 "[ . 1 . 2]" 1
1210 1 59 VAL HA 1 90 TRP HE1 3.200 . 6.000 4.710 4.066 5.067 . 0 0 "[ . 1 . 2]" 1
1211 1 90 TRP HB2 1 90 TRP HE1 3.700 . 5.400 4.751 4.734 4.765 . 0 0 "[ . 1 . 2]" 1
1212 1 87 ASN QB 1 90 TRP HE1 3.700 . 4.100 3.303 2.635 3.940 . 0 0 "[ . 1 . 2]" 1
1213 1 84 LEU MD1 1 90 TRP HE1 2.400 . 6.000 6.076 6.037 6.150 0.150 11 0 "[ . 1 . 2]" 1
1214 1 36 VAL HA 1 73 ILE H 2.400 . 6.000 5.133 4.858 5.282 . 0 0 "[ . 1 . 2]" 1
1215 1 37 MET HB3 1 73 ILE H 3.400 . 4.900 4.510 3.520 4.750 . 0 0 "[ . 1 . 2]" 1
1216 1 10 TRP HE1 1 12 GLU H 3.400 . 4.800 4.778 4.606 4.858 0.058 11 0 "[ . 1 . 2]" 1
1217 1 10 TRP HE1 1 17 PHE QE 3.200 . 4.500 4.420 4.122 4.536 0.036 14 0 "[ . 1 . 2]" 1
1218 1 10 TRP HE1 1 16 ARG QB 3.600 . 6.000 5.559 5.289 5.702 . 0 0 "[ . 1 . 2]" 1
1219 1 10 TRP HE1 1 15 ARG QG 4.300 . 6.000 4.443 3.749 5.420 . 0 0 "[ . 1 . 2]" 1
1220 1 10 TRP HE1 1 12 GLU HB3 3.700 . 5.400 4.272 3.413 5.832 0.432 15 0 "[ . 1 . 2]" 1
1221 1 72 ILE MD 1 73 ILE H 4.400 . 6.000 4.447 4.280 4.562 . 0 0 "[ . 1 . 2]" 1
1222 1 37 MET H 1 73 ILE H 3.700 . 5.400 3.908 3.739 4.081 . 0 0 "[ . 1 . 2]" 1
1223 1 38 ASP QB 1 73 ILE H 3.900 . 5.800 4.342 4.169 4.466 . 0 0 "[ . 1 . 2]" 1
1224 1 73 ILE H 1 94 ILE MD 4.000 . 6.000 6.084 6.008 6.143 0.143 19 0 "[ . 1 . 2]" 1
1225 1 8 ILE H 1 9 VAL H 3.600 . 5.300 4.425 4.318 4.518 . 0 0 "[ . 1 . 2]" 1
1226 1 7 LYS HA 1 8 ILE H 2.800 . 3.800 2.228 2.168 2.322 . 0 0 "[ . 1 . 2]" 1
1227 1 7 LYS QE 1 8 ILE H 3.600 . 5.300 4.242 2.710 5.347 0.047 16 0 "[ . 1 . 2]" 1
1228 1 8 ILE H 1 8 ILE MG 3.900 . 5.800 3.795 3.701 3.839 . 0 0 "[ . 1 . 2]" 1
1229 1 41 HIS HD2 1 44 VAL H 2.400 . 6.000 6.014 5.703 6.149 0.149 18 0 "[ . 1 . 2]" 1
1230 1 43 TYR QD 1 44 VAL H 3.300 . 4.700 3.173 2.201 4.039 . 0 0 "[ . 1 . 2]" 1
1231 1 44 VAL H 1 45 PRO HD3 3.400 . 4.900 4.401 4.075 4.809 . 0 0 "[ . 1 . 2]" 1
1232 1 43 TYR HB2 1 44 VAL H 3.800 . 5.600 4.149 4.021 4.311 . 0 0 "[ . 1 . 2]" 1
1233 1 39 LEU H 1 76 CYS H 3.700 . 5.400 4.727 4.551 4.879 . 0 0 "[ . 1 . 2]" 1
1234 1 28 TYR HB2 1 39 LEU H 3.400 . 4.900 4.344 3.996 4.635 . 0 0 "[ . 1 . 2]" 1
1235 1 39 LEU H 1 73 ILE H 3.000 . 4.100 3.135 3.041 3.268 . 0 0 "[ . 1 . 2]" 1
1236 1 39 LEU H 1 40 VAL H 3.500 . 5.000 4.316 4.153 4.419 . 0 0 "[ . 1 . 2]" 1
1237 1 39 LEU H 1 75 SER H 3.000 . 4.100 3.311 3.132 3.479 . 0 0 "[ . 1 . 2]" 1
1238 1 39 LEU H 1 74 PRO HA 2.800 . 3.800 2.617 2.383 2.781 . 0 0 "[ . 1 . 2]" 1
1239 1 39 LEU H 1 74 PRO HD3 3.200 . 6.000 5.115 4.894 5.221 . 0 0 "[ . 1 . 2]" 1
1240 1 37 MET HB3 1 39 LEU H 3.300 . 4.700 4.700 4.547 4.758 0.058 12 0 "[ . 1 . 2]" 1
1241 1 39 LEU H 1 39 LEU HG 3.700 . 5.400 4.115 4.055 4.162 . 0 0 "[ . 1 . 2]" 1
1242 1 39 LEU H 1 72 ILE MG 3.200 . 4.500 3.022 2.861 3.195 . 0 0 "[ . 1 . 2]" 1
1243 1 39 LEU H 1 72 ILE MD 4.200 . 6.000 4.983 4.704 5.191 . 0 0 "[ . 1 . 2]" 1
1244 1 77 SER H 1 77 SER HA 2.900 . 3.900 2.720 2.704 2.728 . 0 0 "[ . 1 . 2]" 1
1245 1 76 CYS HB3 1 77 SER H 3.500 . 5.000 4.487 4.404 4.569 . 0 0 "[ . 1 . 2]" 1
1246 1 77 SER H 1 79 VAL H 3.400 . 4.800 4.618 4.536 4.729 . 0 0 "[ . 1 . 2]" 1
1247 1 76 CYS HB2 1 77 SER H 3.200 . 4.500 4.019 3.913 4.447 . 0 0 "[ . 1 . 2]" 1
1248 1 10 TRP H 1 17 PHE QD 3.500 . 5.100 3.912 3.663 4.480 . 0 0 "[ . 1 . 2]" 1
1249 1 10 TRP H 1 17 PHE QE 4.100 . 6.000 5.071 4.682 5.834 . 0 0 "[ . 1 . 2]" 1
1250 1 10 TRP H 1 10 TRP HD1 3.800 . 5.600 4.897 4.826 4.967 . 0 0 "[ . 1 . 2]" 1
1251 1 4 GLU H 1 6 PRO HG3 3.100 . 6.000 5.604 4.556 6.897 0.897 1 1 "[+ . 1 . 2]" 1
1252 1 2 ALA MB 1 4 GLU H 2.400 . 6.000 4.945 4.022 5.943 . 0 0 "[ . 1 . 2]" 1
1253 1 3 THR MG 1 4 GLU H 3.500 . 5.100 3.704 2.968 4.203 . 0 0 "[ . 1 . 2]" 1
1254 1 11 ASN H 1 12 GLU H 3.300 . 4.700 3.946 3.753 4.103 . 0 0 "[ . 1 . 2]" 1
1255 1 12 GLU H 1 13 GLY H 3.000 . 4.100 2.712 2.521 2.930 . 0 0 "[ . 1 . 2]" 1
1256 1 10 TRP HD1 1 12 GLU H 3.200 . 4.500 4.455 4.002 4.559 0.059 8 0 "[ . 1 . 2]" 1
1257 1 12 GLU H 1 13 GLY HA3 4.000 . 6.000 5.005 4.817 5.221 . 0 0 "[ . 1 . 2]" 1
1258 1 10 TRP HB2 1 12 GLU H 3.500 . 6.000 5.714 5.304 5.997 . 0 0 "[ . 1 . 2]" 1
1259 1 12 GLU H 1 14 LYS QB 3.700 . 6.000 5.707 5.405 5.855 . 0 0 "[ . 1 . 2]" 1
1260 1 9 VAL H 1 20 GLU H 3.700 . 5.400 4.882 4.507 5.186 . 0 0 "[ . 1 . 2]" 1
1261 1 7 LYS HA 1 9 VAL H 3.800 . 6.000 5.776 5.501 5.964 . 0 0 "[ . 1 . 2]" 1
1262 1 9 VAL H 1 20 GLU HA 3.300 . 6.000 4.901 4.470 5.147 . 0 0 "[ . 1 . 2]" 1
1263 1 8 ILE HB 1 9 VAL H 3.400 . 4.900 4.132 3.960 4.278 . 0 0 "[ . 1 . 2]" 1
1264 1 76 CYS H 1 79 VAL QG 3.800 . 5.600 5.214 5.032 5.319 . 0 0 "[ . 1 . 2]" 1
1265 1 9 VAL H 1 17 PHE HA 3.600 . 5.200 4.698 4.530 4.983 . 0 0 "[ . 1 . 2]" 1
1266 1 9 VAL H 1 17 PHE HB3 3.500 . 5.100 4.411 4.193 4.585 . 0 0 "[ . 1 . 2]" 1
1267 1 9 VAL H 1 18 GLU QB 3.100 . 4.300 3.715 3.452 4.086 . 0 0 "[ . 1 . 2]" 1
1268 1 41 HIS HA 1 76 CYS H 3.700 . 6.000 5.379 5.056 5.669 . 0 0 "[ . 1 . 2]" 1
1269 1 39 LEU HB3 1 76 CYS H 3.300 . 4.700 3.679 3.516 3.827 . 0 0 "[ . 1 . 2]" 1
1270 1 98 VAL MG1 1 100 LYS H 3.700 . 5.400 3.104 2.180 4.258 . 0 0 "[ . 1 . 2]" 1
1271 1 98 VAL HA 1 99 PHE H 3.000 . 4.100 3.449 2.753 3.600 . 0 0 "[ . 1 . 2]" 1
1272 1 98 VAL MG1 1 99 PHE H 2.700 . 3.600 2.360 1.795 3.734 0.134 14 0 "[ . 1 . 2]" 1
1273 1 81 ASP HA 1 100 LYS H 2.400 . 6.000 5.836 5.519 6.109 0.109 18 0 "[ . 1 . 2]" 1
1274 1 100 LYS H 1 101 SER QB 3.300 . 6.000 4.714 3.911 5.217 . 0 0 "[ . 1 . 2]" 1
1275 1 99 PHE HB3 1 100 LYS H 3.200 . 4.500 3.759 2.784 4.563 0.063 9 0 "[ . 1 . 2]" 1
1276 1 100 LYS H 1 100 LYS HB3 2.900 . 4.000 2.749 2.450 3.202 . 0 0 "[ . 1 . 2]" 1
1277 1 100 LYS H 1 100 LYS HG3 2.400 . 3.100 2.138 1.519 3.265 0.181 17 0 "[ . 1 . 2]" 1
1278 1 98 VAL H 1 99 PHE H 2.700 . 3.600 2.660 2.096 3.161 . 0 0 "[ . 1 . 2]" 1
1279 1 81 ASP HA 1 99 PHE H 3.800 . 5.600 4.786 3.287 5.609 0.009 14 0 "[ . 1 . 2]" 1
1280 1 99 PHE H 1 99 PHE HB3 2.900 . 4.000 3.398 2.739 4.135 0.135 10 0 "[ . 1 . 2]" 1
1281 1 65 ALA H 1 66 SER H 2.800 . 3.800 2.682 2.623 2.830 . 0 0 "[ . 1 . 2]" 1
1282 1 64 HIS H 1 65 ALA H 3.000 . 4.100 2.605 2.520 2.684 . 0 0 "[ . 1 . 2]" 1
1283 1 65 ALA H 1 66 SER HA 3.700 . 5.400 5.262 5.214 5.376 . 0 0 "[ . 1 . 2]" 1
1284 1 65 ALA H 1 70 ILE HB 4.200 . 6.000 4.596 4.283 4.740 . 0 0 "[ . 1 . 2]" 1
1285 1 65 ALA H 1 72 ILE QG 3.700 . 5.400 4.437 4.331 4.549 . 0 0 "[ . 1 . 2]" 1
1286 1 65 ALA H 1 72 ILE MG 4.100 . 6.000 5.821 5.753 5.925 . 0 0 "[ . 1 . 2]" 1
1287 1 65 ALA H 1 72 ILE MD 3.100 . 4.300 3.039 2.948 3.120 . 0 0 "[ . 1 . 2]" 1
1288 1 81 ASP HA 1 97 GLU H 3.700 . 6.000 6.174 6.051 6.266 0.266 4 0 "[ . 1 . 2]" 1
1289 1 28 TYR QD 1 30 MET H 3.300 . 4.600 3.939 3.323 4.574 . 0 0 "[ . 1 . 2]" 1
1290 1 30 MET H 1 30 MET HG3 2.800 . 3.800 2.433 2.017 3.206 . 0 0 "[ . 1 . 2]" 1
1291 1 30 MET H 1 30 MET HG2 3.400 . 4.800 3.312 2.072 3.774 . 0 0 "[ . 1 . 2]" 1
1292 1 29 LYS HB3 1 30 MET H 3.900 . 5.800 3.925 3.394 4.113 . 0 0 "[ . 1 . 2]" 1
1293 1 29 LYS HB2 1 30 MET H 3.000 . 4.100 3.073 2.310 4.106 0.006 14 0 "[ . 1 . 2]" 1
1294 1 29 LYS HG2 1 30 MET H 3.700 . 5.400 4.454 3.772 5.309 . 0 0 "[ . 1 . 2]" 1
1295 1 15 ARG HB2 1 30 MET H 2.400 . 6.000 5.863 5.195 6.678 0.678 10 2 "[ . + .- 2]" 1
1296 1 7 LYS H 1 8 ILE HA 3.100 . 4.300 4.386 4.149 4.490 0.190 6 0 "[ . 1 . 2]" 1
1297 1 7 LYS H 1 20 GLU HA 4.000 . 6.000 4.614 3.571 5.379 . 0 0 "[ . 1 . 2]" 1
1298 1 6 PRO QD 1 7 LYS H 2.400 . 6.000 4.829 4.448 5.007 . 0 0 "[ . 1 . 2]" 1
1299 1 7 LYS H 1 7 LYS QE 2.900 . 4.000 3.416 2.184 4.012 0.012 7 0 "[ . 1 . 2]" 1
1300 1 6 PRO QB 1 7 LYS H 2.900 . 3.900 2.704 2.211 3.146 . 0 0 "[ . 1 . 2]" 1
1301 1 7 LYS H 1 20 GLU QB 4.200 . 6.000 2.630 1.917 3.217 0.083 1 0 "[ . 1 . 2]" 1
1302 1 7 LYS H 1 19 THR MG 4.000 . 6.000 5.393 5.015 5.807 . 0 0 "[ . 1 . 2]" 1
1303 1 7 LYS H 1 8 ILE MG 3.800 . 5.600 5.637 5.466 5.875 0.275 13 0 "[ . 1 . 2]" 1
1304 1 7 LYS H 1 8 ILE MD 3.000 . 4.100 3.305 2.686 3.612 . 0 0 "[ . 1 . 2]" 1
1305 1 79 VAL H 1 80 SER H 2.800 . 3.800 2.614 2.523 2.707 . 0 0 "[ . 1 . 2]" 1
1306 1 79 VAL H 1 82 THR H 3.300 . 6.000 5.143 5.058 5.240 . 0 0 "[ . 1 . 2]" 1
1307 1 78 TYR QD 1 79 VAL H 2.800 . 3.800 2.567 2.480 2.707 . 0 0 "[ . 1 . 2]" 1
1308 1 76 CYS HA 1 79 VAL H 3.200 . 4.500 4.251 4.142 4.328 . 0 0 "[ . 1 . 2]" 1
1309 1 79 VAL H 1 79 VAL HA 2.900 . 3.900 2.822 2.807 2.844 . 0 0 "[ . 1 . 2]" 1
1310 1 78 TYR QB 1 79 VAL H 3.000 . 4.100 2.757 2.593 2.924 . 0 0 "[ . 1 . 2]" 1
1311 1 76 CYS HB2 1 79 VAL H 3.300 . 4.600 4.226 3.205 4.562 . 0 0 "[ . 1 . 2]" 1
1312 1 31 ARG H 1 32 ASN H 3.600 . 5.200 4.530 4.506 4.562 . 0 0 "[ . 1 . 2]" 1
1313 1 31 ARG H 1 36 VAL H 2.900 . 4.000 3.162 3.018 3.330 . 0 0 "[ . 1 . 2]" 1
1314 1 31 ARG H 1 35 LYS H 3.300 . 4.600 4.484 4.174 4.648 0.048 2 0 "[ . 1 . 2]" 1
1315 1 31 ARG H 1 36 VAL HA 3.200 . 4.500 4.582 4.514 4.652 0.152 3 0 "[ . 1 . 2]" 1
1316 1 31 ARG H 1 34 GLY QA 2.900 . 4.000 3.796 3.596 3.944 . 0 0 "[ . 1 . 2]" 1
1317 1 31 ARG H 1 31 ARG HD2 3.900 . 5.800 4.554 3.024 5.081 . 0 0 "[ . 1 . 2]" 1
1318 1 30 MET HG2 1 31 ARG H 3.800 . 5.600 4.705 4.455 5.225 . 0 0 "[ . 1 . 2]" 1
1319 1 31 ARG H 1 32 ASN QB 3.400 . 6.000 4.638 4.469 4.745 . 0 0 "[ . 1 . 2]" 1
1320 1 30 MET HB3 1 31 ARG H 3.100 . 4.300 3.738 3.558 4.285 . 0 0 "[ . 1 . 2]" 1
1321 1 31 ARG H 1 31 ARG HG3 3.000 . 4.100 2.786 2.499 4.133 0.033 13 0 "[ . 1 . 2]" 1
1322 1 31 ARG H 1 36 VAL MG1 3.200 . 4.500 3.473 3.171 3.718 . 0 0 "[ . 1 . 2]" 1
1323 1 57 LEU H 1 59 VAL H 3.100 . 4.300 3.957 3.866 4.069 . 0 0 "[ . 1 . 2]" 1
1324 1 56 HIS H 1 57 LEU H 2.800 . 3.800 2.622 2.541 2.704 . 0 0 "[ . 1 . 2]" 1
1325 1 57 LEU H 1 58 CYS H 2.800 . 3.800 2.636 2.554 2.752 . 0 0 "[ . 1 . 2]" 1
1326 1 56 HIS HD2 1 57 LEU H 3.800 . 5.600 5.202 4.865 5.787 0.187 3 0 "[ . 1 . 2]" 1
1327 1 55 SER HA 1 57 LEU H 2.900 . 4.000 4.042 3.974 4.088 0.088 3 0 "[ . 1 . 2]" 1
1328 1 54 ALA HA 1 57 LEU H 3.100 . 4.300 3.626 3.523 3.764 . 0 0 "[ . 1 . 2]" 1
1329 1 57 LEU H 1 57 LEU MD2 3.600 . 5.200 3.413 3.353 3.478 . 0 0 "[ . 1 . 2]" 1
1330 1 75 SER H 1 76 CYS H 2.800 . 3.800 2.327 2.256 2.441 . 0 0 "[ . 1 . 2]" 1
1331 1 38 ASP HA 1 75 SER H 3.200 . 4.500 4.369 4.119 4.571 0.071 5 0 "[ . 1 . 2]" 1
1332 1 39 LEU HA 1 75 SER H 3.300 . 4.700 4.676 4.548 4.750 0.050 17 0 "[ . 1 . 2]" 1
1333 1 74 PRO HB3 1 75 SER H 3.900 . 5.800 4.295 4.223 4.362 . 0 0 "[ . 1 . 2]" 1
1334 1 40 VAL QG 1 75 SER H 3.400 . 4.900 3.645 3.311 4.291 . 0 0 "[ . 1 . 2]" 1
1335 1 81 ASP HA 1 83 PHE H 3.500 . 6.000 5.161 5.085 5.219 . 0 0 "[ . 1 . 2]" 1
1336 1 83 PHE H 1 84 LEU H 2.700 . 3.600 2.580 2.531 2.625 . 0 0 "[ . 1 . 2]" 1
1337 1 82 THR H 1 83 PHE H 3.000 . 4.100 2.439 2.394 2.486 . 0 0 "[ . 1 . 2]" 1
1338 1 78 TYR QD 1 83 PHE H 2.400 . 6.000 6.019 5.903 6.072 0.072 5 0 "[ . 1 . 2]" 1
1339 1 78 TYR QE 1 83 PHE H 2.400 . 6.000 6.081 5.943 6.177 0.177 18 0 "[ . 1 . 2]" 1
1340 1 81 ASP QB 1 83 PHE H 4.300 . 6.000 4.678 4.487 4.820 . 0 0 "[ . 1 . 2]" 1
1341 1 83 PHE H 1 84 LEU HG 3.500 . 6.000 4.823 4.670 4.982 . 0 0 "[ . 1 . 2]" 1
1342 1 79 VAL QG 1 83 PHE H 3.700 . 5.000 3.543 3.476 3.626 . 0 0 "[ . 1 . 2]" 1
1343 1 39 LEU HB3 1 61 ALA H 3.900 . 6.000 6.152 6.089 6.205 0.205 6 0 "[ . 1 . 2]" 1
1344 1 63 GLU H 1 64 HIS H 2.800 . 3.800 2.739 2.698 2.768 . 0 0 "[ . 1 . 2]" 1
1345 1 64 HIS H 1 66 SER H 3.300 . 4.600 4.184 4.074 4.277 . 0 0 "[ . 1 . 2]" 1
1346 1 62 PHE HA 1 64 HIS H 3.000 . 4.100 4.166 4.127 4.189 0.089 11 0 "[ . 1 . 2]" 1
1347 1 64 HIS H 1 72 ILE MD 3.500 . 5.000 4.520 4.461 4.592 . 0 0 "[ . 1 . 2]" 1
1348 1 61 ALA H 1 63 GLU H 3.500 . 5.000 4.157 4.019 4.270 . 0 0 "[ . 1 . 2]" 1
1349 1 61 ALA H 1 62 PHE H 2.900 . 3.900 2.484 2.409 2.535 . 0 0 "[ . 1 . 2]" 1
1350 1 58 CYS HA 1 61 ALA H 2.900 . 3.900 3.494 3.393 3.587 . 0 0 "[ . 1 . 2]" 1
1351 1 61 ALA H 1 64 HIS QB 3.600 . 6.000 4.850 4.720 4.949 . 0 0 "[ . 1 . 2]" 1
1352 1 61 ALA H 1 62 PHE HB3 4.500 . 6.000 5.975 5.859 6.034 0.034 19 0 "[ . 1 . 2]" 1
1353 1 61 ALA H 1 61 ALA MB 2.800 . 3.800 2.248 2.235 2.263 . 0 0 "[ . 1 . 2]" 1
1354 1 61 ALA H 1 72 ILE MG 4.100 . 6.000 6.070 6.013 6.138 0.138 14 0 "[ . 1 . 2]" 1
1355 1 61 ALA H 1 72 ILE MD 3.700 . 5.400 4.948 4.743 5.069 . 0 0 "[ . 1 . 2]" 1
1356 1 20 GLU H 1 21 ASP H 2.600 . 3.400 2.636 2.533 2.777 . 0 0 "[ . 1 . 2]" 1
1357 1 7 LYS HB3 1 20 GLU H 4.100 . 6.000 4.546 3.444 5.468 . 0 0 "[ . 1 . 2]" 1
1358 1 8 ILE MD 1 20 GLU H 3.100 . 4.300 3.114 2.849 3.564 . 0 0 "[ . 1 . 2]" 1
1359 1 54 ALA H 1 55 SER H 2.900 . 4.000 2.864 2.745 2.988 . 0 0 "[ . 1 . 2]" 1
1360 1 54 ALA H 1 78 TYR QE 3.900 . 5.800 4.873 4.466 5.653 . 0 0 "[ . 1 . 2]" 1
1361 1 54 ALA H 1 57 LEU MD1 3.900 . 5.800 4.286 4.126 4.443 . 0 0 "[ . 1 . 2]" 1
1362 1 28 TYR H 1 29 LYS H 3.500 . 5.000 4.326 4.257 4.367 . 0 0 "[ . 1 . 2]" 1
1363 1 28 TYR H 1 28 TYR QD 3.000 . 4.100 3.327 2.941 3.544 . 0 0 "[ . 1 . 2]" 1
1364 1 28 TYR H 1 28 TYR HA 2.900 . 3.900 2.866 2.821 2.896 . 0 0 "[ . 1 . 2]" 1
1365 1 28 TYR H 1 28 TYR HB3 2.900 . 4.000 3.394 3.260 3.519 . 0 0 "[ . 1 . 2]" 1
1366 1 15 ARG QG 1 28 TYR H 2.400 . 6.000 5.403 5.046 5.647 . 0 0 "[ . 1 . 2]" 1
1367 1 15 ARG HB2 1 28 TYR H 2.900 . 3.900 3.617 3.035 3.812 . 0 0 "[ . 1 . 2]" 1
1368 1 81 ASP HA 1 98 VAL H 2.700 . 3.600 2.526 2.337 2.774 . 0 0 "[ . 1 . 2]" 1
1369 1 96 SER QB 1 98 VAL H 3.600 . 6.000 5.660 4.960 5.874 . 0 0 "[ . 1 . 2]" 1
1370 1 98 VAL H 1 99 PHE HB3 3.700 . 6.000 5.697 4.715 6.826 0.826 14 3 "[ . * - +. 2]" 1
1371 1 81 ASP QB 1 98 VAL H 4.200 . 6.000 3.963 3.588 4.346 . 0 0 "[ . 1 . 2]" 1
1372 1 97 GLU HG3 1 98 VAL H 3.700 . 5.400 3.115 2.744 4.547 . 0 0 "[ . 1 . 2]" 1
1373 1 96 SER H 1 100 LYS H 3.400 . 6.000 6.000 5.134 6.278 0.278 12 0 "[ . 1 . 2]" 1
1374 1 96 SER H 1 96 SER QB 3.100 . 4.300 3.080 2.879 3.472 . 0 0 "[ . 1 . 2]" 1
1375 1 95 HIS QB 1 96 SER H 3.100 . 4.300 2.029 1.645 2.735 0.255 16 0 "[ . 1 . 2]" 1
1376 1 96 SER H 1 97 GLU QB 3.700 . 5.400 4.522 4.152 5.162 . 0 0 "[ . 1 . 2]" 1
1377 1 94 ILE MD 1 96 SER H 2.800 . 3.800 2.813 1.862 3.793 . 0 0 "[ . 1 . 2]" 1
1378 1 17 PHE H 1 26 ILE H 2.800 . 3.800 2.814 2.603 3.016 . 0 0 "[ . 1 . 2]" 1
1379 1 37 MET H 1 72 ILE H 3.200 . 4.500 4.196 4.020 4.377 . 0 0 "[ . 1 . 2]" 1
1380 1 72 ILE H 1 94 ILE H 3.500 . 5.000 4.316 3.946 4.560 . 0 0 "[ . 1 . 2]" 1
1381 1 17 PHE H 1 17 PHE QD 3.100 . 4.300 3.223 2.968 3.423 . 0 0 "[ . 1 . 2]" 1
1382 1 17 PHE H 1 17 PHE QE 3.500 . 5.000 4.859 4.653 5.016 0.016 1 0 "[ . 1 . 2]" 1
1383 1 71 SER HA 1 72 ILE H 2.900 . 3.900 2.496 2.409 2.533 . 0 0 "[ . 1 . 2]" 1
1384 1 71 SER HB3 1 72 ILE H 2.900 . 3.900 2.780 2.394 3.721 . 0 0 "[ . 1 . 2]" 1
1385 1 72 ILE H 1 73 ILE HA 3.200 . 6.000 4.931 4.879 5.002 . 0 0 "[ . 1 . 2]" 1
1386 1 10 TRP HA 1 17 PHE H 3.700 . 5.400 4.830 4.748 4.953 . 0 0 "[ . 1 . 2]" 1
1387 1 16 ARG HA 1 17 PHE H 2.800 . 3.800 2.370 2.289 2.449 . 0 0 "[ . 1 . 2]" 1
1388 1 17 PHE H 1 25 PHE QB 3.900 . 5.800 4.003 3.687 4.340 . 0 0 "[ . 1 . 2]" 1
1389 1 17 PHE H 1 17 PHE HB2 2.700 . 3.600 2.637 2.554 2.735 . 0 0 "[ . 1 . 2]" 1
1390 1 11 ASN HB2 1 17 PHE H 3.500 . 6.000 5.964 5.692 6.128 0.128 1 0 "[ . 1 . 2]" 1
1391 1 17 PHE H 1 18 GLU QB 3.300 . 6.000 5.272 4.901 5.673 . 0 0 "[ . 1 . 2]" 1
1392 1 37 MET HB2 1 72 ILE H 3.600 . 5.200 5.223 5.081 5.372 0.172 5 0 "[ . 1 . 2]" 1
1393 1 72 ILE H 1 72 ILE MG 3.600 . 5.200 3.848 3.797 3.876 . 0 0 "[ . 1 . 2]" 1
1394 1 51 LEU H 1 52 GLY H 2.900 . 3.900 2.328 1.950 2.578 . 0 0 "[ . 1 . 2]" 1
1395 1 51 LEU H 1 51 LEU HG 3.600 . 5.200 4.041 2.378 4.609 . 0 0 "[ . 1 . 2]" 1
1396 1 51 LEU H 1 53 LEU QB 3.800 . 5.600 4.450 4.070 4.830 . 0 0 "[ . 1 . 2]" 1
1397 1 44 VAL QG 1 51 LEU H 3.200 . 4.500 3.921 3.382 4.333 . 0 0 "[ . 1 . 2]" 1
1398 1 90 TRP HA 1 91 LYS H 3.000 . 4.100 3.146 3.065 3.217 . 0 0 "[ . 1 . 2]" 1
1399 1 91 LYS H 1 96 SER HA 3.500 . 5.000 4.859 4.535 5.157 0.157 14 0 "[ . 1 . 2]" 1
1400 1 90 TRP HB2 1 91 LYS H 3.100 . 4.300 3.741 3.658 3.841 . 0 0 "[ . 1 . 2]" 1
1401 1 91 LYS H 1 93 LEU HB3 3.400 . 4.900 4.846 4.659 4.979 0.079 14 0 "[ . 1 . 2]" 1
1402 1 84 LEU MD2 1 91 LYS H 3.300 . 4.600 4.220 3.529 4.485 . 0 0 "[ . 1 . 2]" 1
1403 1 47 PHE QB 1 48 LYS H 3.400 . 3.900 2.810 2.729 2.923 . 0 0 "[ . 1 . 2]" 1
1404 1 48 LYS H 1 49 ARG QG 3.400 . 4.900 3.472 3.179 3.708 . 0 0 "[ . 1 . 2]" 1
1405 1 48 LYS H 1 48 LYS HB2 2.700 . 3.600 2.692 2.533 2.801 . 0 0 "[ . 1 . 2]" 1
1406 1 48 LYS H 1 48 LYS HG3 3.000 . 4.100 3.208 2.785 3.870 . 0 0 "[ . 1 . 2]" 1
1407 1 44 VAL QG 1 48 LYS H 2.900 . 3.900 2.895 2.709 3.144 . 0 0 "[ . 1 . 2]" 1
1408 1 82 THR H 1 84 LEU H 3.200 . 4.500 4.042 3.984 4.117 . 0 0 "[ . 1 . 2]" 1
1409 1 62 PHE QE 1 84 LEU H 3.400 . 6.000 5.793 5.600 5.900 . 0 0 "[ . 1 . 2]" 1
1410 1 84 LEU H 1 86 ARG H 3.300 . 4.600 3.782 3.668 3.855 . 0 0 "[ . 1 . 2]" 1
1411 1 84 LEU H 1 85 PRO HA 3.700 . 5.400 5.449 5.395 5.490 0.090 3 0 "[ . 1 . 2]" 1
1412 1 83 PHE HB2 1 84 LEU H 2.700 . 3.600 3.537 2.757 3.775 0.175 8 0 "[ . 1 . 2]" 1
1413 1 84 LEU H 1 84 LEU MD2 4.000 . 6.000 3.795 3.570 3.956 . 0 0 "[ . 1 . 2]" 1
1414 1 59 VAL H 1 62 PHE QE 3.400 . 4.800 4.670 4.525 4.758 . 0 0 "[ . 1 . 2]" 1
1415 1 11 ASN H 1 18 GLU H 3.500 . 5.000 3.781 3.206 4.409 . 0 0 "[ . 1 . 2]" 1
1416 1 17 PHE H 1 18 GLU H 3.500 . 5.000 4.429 4.302 4.503 . 0 0 "[ . 1 . 2]" 1
1417 1 18 GLU H 1 19 THR H 3.500 . 5.000 4.302 4.043 4.456 . 0 0 "[ . 1 . 2]" 1
1418 1 17 PHE QD 1 18 GLU H 3.600 . 5.300 3.956 3.659 4.202 . 0 0 "[ . 1 . 2]" 1
1419 1 18 GLU H 1 18 GLU HA 2.800 . 3.800 2.938 2.868 2.960 . 0 0 "[ . 1 . 2]" 1
1420 1 17 PHE HB3 1 18 GLU H 2.900 . 3.900 2.976 2.203 3.347 . 0 0 "[ . 1 . 2]" 1
1421 1 18 GLU H 1 18 GLU QB 3.200 . 4.500 2.669 2.289 3.185 . 0 0 "[ . 1 . 2]" 1
1422 1 18 GLU H 1 18 GLU HG3 3.400 . 4.800 3.845 2.227 4.759 . 0 0 "[ . 1 . 2]" 1
1423 1 8 ILE MG 1 18 GLU H 3.000 . 4.100 2.818 2.293 3.210 . 0 0 "[ . 1 . 2]" 1
1424 1 8 ILE MD 1 18 GLU H 4.000 . 6.000 5.141 4.476 5.996 . 0 0 "[ . 1 . 2]" 1
1425 1 62 PHE H 1 63 GLU H 2.900 . 3.900 2.776 2.719 2.836 . 0 0 "[ . 1 . 2]" 1
1426 1 62 PHE QD 1 63 GLU H 3.900 . 5.800 4.315 4.263 4.373 . 0 0 "[ . 1 . 2]" 1
1427 1 63 GLU H 1 63 GLU HB2 3.700 . 5.400 2.567 2.369 2.754 . 0 0 "[ . 1 . 2]" 1
1428 1 61 ALA MB 1 63 GLU H 3.600 . 5.200 4.703 4.640 4.787 . 0 0 "[ . 1 . 2]" 1
1429 1 63 GLU H 1 72 ILE MD 3.700 . 5.400 4.723 4.668 4.791 . 0 0 "[ . 1 . 2]" 1
1430 1 59 VAL H 1 60 ALA HA 3.800 . 5.600 5.258 5.211 5.303 . 0 0 "[ . 1 . 2]" 1
1431 1 59 VAL H 1 60 ALA H 2.900 . 4.000 2.660 2.600 2.717 . 0 0 "[ . 1 . 2]" 1
1432 1 59 VAL HA 1 60 ALA H 2.800 . 3.800 3.524 3.504 3.542 . 0 0 "[ . 1 . 2]" 1
1433 1 48 LYS H 1 49 ARG H 2.900 . 3.900 2.272 2.028 2.892 . 0 0 "[ . 1 . 2]" 1
1434 1 49 ARG H 1 50 GLY QA 3.700 . 6.000 4.956 4.478 5.417 . 0 0 "[ . 1 . 2]" 1
1435 1 49 ARG H 1 49 ARG HD3 3.600 . 5.200 4.314 3.937 5.005 . 0 0 "[ . 1 . 2]" 1
1436 1 48 LYS HB2 1 49 ARG H 3.400 . 4.800 3.917 2.400 4.421 . 0 0 "[ . 1 . 2]" 1
1437 1 48 LYS HG3 1 49 ARG H 3.600 . 6.000 4.824 4.516 4.982 . 0 0 "[ . 1 . 2]" 1
1438 1 44 VAL QG 1 49 ARG H 3.200 . 4.500 3.229 1.990 4.146 . 0 0 "[ . 1 . 2]" 1
1439 1 94 ILE H 1 95 HIS H 3.500 . 5.000 4.245 4.109 4.323 . 0 0 "[ . 1 . 2]" 1
1440 1 62 PHE QD 1 94 ILE H 2.400 . 6.000 5.558 4.901 6.012 0.012 13 0 "[ . 1 . 2]" 1
1441 1 62 PHE QE 1 94 ILE H 3.500 . 5.000 4.595 3.957 5.056 0.056 16 0 "[ . 1 . 2]" 1
1442 1 92 PRO HA 1 94 ILE H 2.400 . 6.000 4.782 4.448 5.150 . 0 0 "[ . 1 . 2]" 1
1443 1 91 LYS HA 1 94 ILE H 2.900 . 4.000 3.303 3.056 3.566 . 0 0 "[ . 1 . 2]" 1
1444 1 94 ILE H 1 94 ILE HB 3.200 . 4.500 3.745 3.677 3.809 . 0 0 "[ . 1 . 2]" 1
1445 1 94 ILE H 1 94 ILE QG 2.800 . 3.800 2.192 1.929 2.509 . 0 0 "[ . 1 . 2]" 1
1446 1 94 ILE H 1 94 ILE MG 2.600 . 3.400 2.541 2.176 2.804 . 0 0 "[ . 1 . 2]" 1
1447 1 72 ILE HB 1 94 ILE H 3.600 . 5.200 4.231 3.646 4.625 . 0 0 "[ . 1 . 2]" 1
1448 1 94 ILE H 1 94 ILE MD 3.800 . 5.600 3.850 3.620 4.109 . 0 0 "[ . 1 . 2]" 1
1449 1 56 HIS H 1 59 VAL H 3.300 . 4.700 4.578 4.484 4.671 . 0 0 "[ . 1 . 2]" 1
1450 1 53 LEU H 1 56 HIS H 3.300 . 4.700 4.617 4.544 4.716 0.016 11 0 "[ . 1 . 2]" 1
1451 1 56 HIS H 1 56 HIS HD2 3.300 . 4.700 3.005 2.444 4.520 . 0 0 "[ . 1 . 2]" 1
1452 1 55 SER HA 1 56 HIS H 2.900 . 4.000 3.517 3.452 3.561 . 0 0 "[ . 1 . 2]" 1
1453 1 54 ALA HA 1 56 HIS H 3.200 . 4.500 4.347 4.283 4.481 . 0 0 "[ . 1 . 2]" 1
1454 1 56 HIS H 1 57 LEU MD1 3.900 . 5.800 5.032 4.894 5.191 . 0 0 "[ . 1 . 2]" 1
1455 1 54 ALA MB 1 56 HIS H 3.700 . 5.400 4.314 4.135 4.438 . 0 0 "[ . 1 . 2]" 1
1456 1 53 LEU H 1 54 ALA H 3.000 . 4.100 2.881 2.840 2.938 . 0 0 "[ . 1 . 2]" 1
1457 1 53 LEU H 1 56 HIS HD2 3.200 . 4.500 4.189 3.241 4.572 0.072 3 0 "[ . 1 . 2]" 1
1458 1 51 LEU HA 1 53 LEU H 3.600 . 5.200 4.594 4.315 4.897 . 0 0 "[ . 1 . 2]" 1
1459 1 53 LEU H 1 54 ALA HA 3.700 . 5.400 5.433 5.389 5.464 0.064 3 0 "[ . 1 . 2]" 1
1460 1 53 LEU H 1 56 HIS QB 4.400 . 6.000 4.464 3.794 4.738 . 0 0 "[ . 1 . 2]" 1
1461 1 51 LEU HB3 1 53 LEU H 2.800 . 3.800 2.942 2.221 4.023 0.223 17 0 "[ . 1 . 2]" 1
1462 1 53 LEU H 1 54 ALA MB 3.700 . 5.400 4.490 4.413 4.550 . 0 0 "[ . 1 . 2]" 1
1463 1 90 TRP H 1 91 LYS H 2.500 . 3.300 2.141 1.832 2.373 . 0 0 "[ . 1 . 2]" 1
1464 1 62 PHE QE 1 90 TRP H 3.700 . 6.000 5.815 5.562 5.994 . 0 0 "[ . 1 . 2]" 1
1465 1 90 TRP H 1 96 SER HA 3.500 . 6.000 5.904 5.494 6.211 0.211 10 0 "[ . 1 . 2]" 1
1466 1 19 THR HB 1 23 GLU H 4.000 . 6.000 5.921 5.094 6.067 0.067 15 0 "[ . 1 . 2]" 1
1467 1 13 GLY HA3 1 15 ARG H 3.800 . 5.600 4.422 4.202 4.587 . 0 0 "[ . 1 . 2]" 1
1468 1 15 ARG H 1 16 ARG HD3 3.800 . 6.000 6.052 5.466 6.967 0.967 7 4 "[ . +- 1 .** 2]" 1
1469 1 14 LYS H 1 15 ARG H 2.600 . 3.400 2.072 1.905 2.290 . 0 0 "[ . 1 . 2]" 1
1470 1 15 ARG H 1 15 ARG HB3 3.600 . 5.200 4.038 3.999 4.082 . 0 0 "[ . 1 . 2]" 1
1471 1 15 ARG H 1 15 ARG HB2 3.300 . 4.700 3.587 3.464 3.724 . 0 0 "[ . 1 . 2]" 1
1472 1 25 PHE QD 1 26 ILE H 3.400 . 4.800 3.540 3.301 3.746 . 0 0 "[ . 1 . 2]" 1
1473 1 26 ILE H 1 26 ILE HA 2.800 . 3.800 2.930 2.919 2.939 . 0 0 "[ . 1 . 2]" 1
1474 1 17 PHE HB2 1 26 ILE H 2.800 . 3.800 3.272 2.728 3.546 . 0 0 "[ . 1 . 2]" 1
1475 1 18 GLU QB 1 26 ILE H 2.400 . 6.000 4.980 4.575 5.438 . 0 0 "[ . 1 . 2]" 1
1476 1 16 ARG QB 1 26 ILE H 3.900 . 5.800 3.534 3.224 3.932 . 0 0 "[ . 1 . 2]" 1
1477 1 26 ILE H 1 26 ILE HB 2.600 . 3.500 2.690 2.549 2.791 . 0 0 "[ . 1 . 2]" 1
1478 1 26 ILE H 1 57 LEU MD2 3.200 . 4.500 3.136 2.827 3.649 . 0 0 "[ . 1 . 2]" 1
1479 1 31 ARG HA 1 32 ASN H 3.000 . 4.100 2.409 2.292 2.494 . 0 0 "[ . 1 . 2]" 1
1480 1 32 ASN H 1 32 ASN QB 3.500 . 4.200 2.920 2.883 2.944 . 0 0 "[ . 1 . 2]" 1
1481 1 31 ARG QB 1 32 ASN H 2.700 . 3.600 2.364 2.169 2.624 . 0 0 "[ . 1 . 2]" 1
1482 1 32 ASN H 1 36 VAL HB 3.400 . 4.900 4.723 4.307 4.931 0.031 10 0 "[ . 1 . 2]" 1
1483 1 39 LEU HB2 1 40 VAL H 3.500 . 5.100 4.458 4.392 4.534 . 0 0 "[ . 1 . 2]" 1
1484 1 30 MET HA 1 36 VAL H 3.500 . 5.100 4.089 3.837 4.380 . 0 0 "[ . 1 . 2]" 1
1485 1 34 GLY QA 1 36 VAL H 3.200 . 4.400 3.448 3.291 3.629 . 0 0 "[ . 1 . 2]" 1
1486 1 31 ARG QB 1 36 VAL H 3.500 . 5.000 3.748 3.513 4.624 . 0 0 "[ . 1 . 2]" 1
1487 1 35 LYS QG 1 36 VAL H 3.800 . 5.600 4.192 4.031 4.346 . 0 0 "[ . 1 . 2]" 1
1488 1 36 VAL H 1 37 MET H 3.500 . 5.000 4.269 4.216 4.330 . 0 0 "[ . 1 . 2]" 1
1489 1 40 VAL H 1 41 HIS HA 3.700 . 6.000 5.955 5.852 6.052 0.052 14 0 "[ . 1 . 2]" 1
1490 1 39 LEU HG 1 40 VAL H 3.800 . 5.600 4.448 4.218 4.679 . 0 0 "[ . 1 . 2]" 1
1491 1 19 THR H 1 24 ALA H 3.500 . 5.000 3.983 3.831 4.264 . 0 0 "[ . 1 . 2]" 1
1492 1 23 GLU H 1 24 ALA H 2.700 . 3.600 2.260 1.941 2.670 . 0 0 "[ . 1 . 2]" 1
1493 1 18 GLU HA 1 24 ALA H 3.800 . 5.600 5.255 4.994 5.597 . 0 0 "[ . 1 . 2]" 1
1494 1 19 THR HB 1 24 ALA H 3.500 . 5.100 4.476 3.630 4.720 . 0 0 "[ . 1 . 2]" 1
1495 1 24 ALA H 1 48 LYS QE 3.500 . 6.000 4.622 3.794 5.413 . 0 0 "[ . 1 . 2]" 1
1496 1 86 ARG H 1 87 ASN H 2.900 . 4.000 2.566 2.455 2.716 . 0 0 "[ . 1 . 2]" 1
1497 1 24 ALA H 1 25 PHE QB 3.100 . 6.000 4.724 4.472 4.981 . 0 0 "[ . 1 . 2]" 1
1498 1 81 ASP H 1 84 LEU H 3.200 . 4.500 4.592 4.552 4.638 0.138 14 0 "[ . 1 . 2]" 1
1499 1 81 ASP H 1 82 THR H 2.800 . 3.800 2.725 2.632 2.844 . 0 0 "[ . 1 . 2]" 1
1500 1 78 TYR HA 1 81 ASP H 3.100 . 4.300 3.750 3.624 3.907 . 0 0 "[ . 1 . 2]" 1
1501 1 81 ASP H 1 84 LEU QB 3.100 . 6.000 4.719 4.580 4.819 . 0 0 "[ . 1 . 2]" 1
1502 1 62 PHE H 1 72 ILE MG 3.600 . 5.200 4.839 4.754 4.917 . 0 0 "[ . 1 . 2]" 1
1503 1 62 PHE H 1 63 GLU HG3 4.200 . 6.000 5.102 4.129 6.009 0.009 13 0 "[ . 1 . 2]" 1
1504 1 62 PHE H 1 72 ILE MD 3.400 . 4.900 3.505 3.340 3.570 . 0 0 "[ . 1 . 2]" 1
1505 1 40 VAL H 1 41 HIS H 3.400 . 4.800 4.217 4.029 4.312 . 0 0 "[ . 1 . 2]" 1
1506 1 26 ILE HA 1 41 HIS H 3.400 . 6.000 5.791 5.631 5.996 . 0 0 "[ . 1 . 2]" 1
1507 1 41 HIS H 1 76 CYS HB3 3.200 . 4.500 4.511 4.001 4.593 0.093 12 0 "[ . 1 . 2]" 1
1508 1 41 HIS H 1 76 CYS HB2 3.500 . 5.000 4.852 4.591 5.014 0.014 16 0 "[ . 1 . 2]" 1
1509 1 40 VAL HB 1 41 HIS H 3.600 . 5.300 4.322 4.173 4.458 . 0 0 "[ . 1 . 2]" 1
1510 1 28 TYR QD 1 29 LYS H 3.000 . 4.100 3.152 2.514 3.598 . 0 0 "[ . 1 . 2]" 1
1511 1 29 LYS H 1 30 MET HA 3.300 . 4.600 4.595 4.463 4.665 0.065 12 0 "[ . 1 . 2]" 1
1512 1 29 LYS H 1 38 ASP HA 3.400 . 4.800 4.472 4.214 4.589 . 0 0 "[ . 1 . 2]" 1
1513 1 29 LYS H 1 39 LEU HA 3.600 . 5.300 4.130 3.839 4.362 . 0 0 "[ . 1 . 2]" 1
1514 1 29 LYS H 1 38 ASP QB 2.900 . 3.900 2.673 2.487 2.930 . 0 0 "[ . 1 . 2]" 1
1515 1 29 LYS H 1 40 VAL QG 3.400 . 4.800 3.451 3.081 4.029 . 0 0 "[ . 1 . 2]" 1
1516 1 89 SER H 1 91 LYS H 3.900 . 5.800 4.025 3.686 4.434 . 0 0 "[ . 1 . 2]" 1
1517 1 89 SER H 1 89 SER HA 3.000 . 4.100 2.934 2.906 2.954 . 0 0 "[ . 1 . 2]" 1
1518 1 89 SER H 1 89 SER HB3 3.000 . 4.100 3.249 2.590 3.829 . 0 0 "[ . 1 . 2]" 1
1519 1 81 ASP H 1 81 ASP HA 3.000 . 4.100 2.829 2.795 2.862 . 0 0 "[ . 1 . 2]" 1
1520 1 68 HIS H 1 70 ILE HB 3.500 . 5.000 4.627 4.366 4.905 . 0 0 "[ . 1 . 2]" 1
1521 1 66 SER H 1 68 HIS H 3.300 . 4.600 4.190 4.052 4.279 . 0 0 "[ . 1 . 2]" 1
1522 1 67 SER H 1 68 HIS H 2.900 . 4.000 2.593 2.470 2.698 . 0 0 "[ . 1 . 2]" 1
1523 1 68 HIS H 1 68 HIS HD1 3.700 . 5.400 4.940 4.718 5.109 . 0 0 "[ . 1 . 2]" 1
1524 1 67 SER HA 1 68 HIS H 3.200 . 4.500 3.491 3.419 3.532 . 0 0 "[ . 1 . 2]" 1
1525 1 67 SER HB3 1 68 HIS H 3.100 . 4.300 3.449 2.718 4.288 . 0 0 "[ . 1 . 2]" 1
1526 1 90 TRP HA 1 93 LEU H 3.400 . 4.800 3.674 3.387 3.839 . 0 0 "[ . 1 . 2]" 1
1527 1 93 LEU H 1 93 LEU HA 3.000 . 4.100 2.930 2.898 2.946 . 0 0 "[ . 1 . 2]" 1
1528 1 91 LYS HA 1 93 LEU H 2.900 . 4.000 3.625 3.414 3.902 . 0 0 "[ . 1 . 2]" 1
1529 1 92 PRO HD3 1 93 LEU H 3.400 . 4.900 4.109 3.972 4.222 . 0 0 "[ . 1 . 2]" 1
1530 1 90 TRP HB2 1 93 LEU H 3.600 . 5.200 4.963 4.841 5.062 . 0 0 "[ . 1 . 2]" 1
1531 1 93 LEU H 1 93 LEU HG 2.600 . 3.400 2.310 2.036 2.711 . 0 0 "[ . 1 . 2]" 1
1532 1 93 LEU H 1 93 LEU HB2 3.000 . 4.100 2.625 2.555 2.727 . 0 0 "[ . 1 . 2]" 1
1533 1 84 LEU MD2 1 93 LEU H 3.600 . 6.000 5.991 5.568 6.163 0.163 20 0 "[ . 1 . 2]" 1
1534 1 35 LYS H 1 36 VAL H 2.700 . 3.600 2.126 1.925 2.277 . 0 0 "[ . 1 . 2]" 1
1535 1 32 ASN HA 1 35 LYS H 3.500 . 5.000 4.690 4.545 4.775 . 0 0 "[ . 1 . 2]" 1
1536 1 33 ASN QB 1 35 LYS H 3.400 . 4.800 3.913 3.528 4.292 . 0 0 "[ . 1 . 2]" 1
1537 1 13 GLY H 1 14 LYS H 2.800 . 3.800 2.577 2.408 2.758 . 0 0 "[ . 1 . 2]" 1
1538 1 11 ASN HA 1 14 LYS H 3.300 . 4.700 4.414 4.230 4.710 0.010 13 0 "[ . 1 . 2]" 1
1539 1 14 LYS H 1 15 ARG HA 4.100 . 6.000 4.206 4.031 4.456 . 0 0 "[ . 1 . 2]" 1
1540 1 11 ASN HB3 1 14 LYS H 3.000 . 4.100 3.514 3.082 3.692 . 0 0 "[ . 1 . 2]" 1
1541 1 14 LYS H 1 14 LYS HG2 3.200 . 4.500 3.432 2.416 4.548 0.048 10 0 "[ . 1 . 2]" 1
1542 1 12 GLU HB2 1 14 LYS H 3.400 . 6.000 5.260 4.890 5.819 . 0 0 "[ . 1 . 2]" 1
1543 1 71 SER H 1 72 ILE H 3.600 . 5.200 4.563 4.547 4.579 . 0 0 "[ . 1 . 2]" 1
1544 1 71 SER H 1 71 SER HB3 3.200 . 4.400 3.361 2.525 3.659 . 0 0 "[ . 1 . 2]" 1
1545 1 70 ILE QG 1 71 SER H 3.900 . 5.800 4.064 3.949 4.145 . 0 0 "[ . 1 . 2]" 1
1546 1 70 ILE H 1 71 SER H 3.700 . 5.400 4.532 4.393 4.598 . 0 0 "[ . 1 . 2]" 1
1547 1 58 CYS H 1 59 VAL H 2.800 . 3.800 2.667 2.613 2.714 . 0 0 "[ . 1 . 2]" 1
1548 1 17 PHE QD 1 58 CYS H 3.600 . 6.000 6.082 6.004 6.118 0.118 4 0 "[ . 1 . 2]" 1
1549 1 58 CYS H 1 78 TYR QE 3.800 . 6.000 6.168 6.077 6.255 0.255 13 0 "[ . 1 . 2]" 1
1550 1 58 CYS H 1 76 CYS HB2 3.700 . 6.000 5.848 5.347 6.166 0.166 17 0 "[ . 1 . 2]" 1
1551 1 31 ARG HA 1 33 ASN H 3.300 . 4.700 3.930 3.534 4.430 . 0 0 "[ . 1 . 2]" 1
1552 1 33 ASN H 1 33 ASN HA 3.000 . 4.100 2.270 2.263 2.282 . 0 0 "[ . 1 . 2]" 1
1553 1 57 LEU HA 1 58 CYS H 3.100 . 4.300 3.537 3.519 3.559 . 0 0 "[ . 1 . 2]" 1
1554 1 57 LEU HG 1 58 CYS H 3.600 . 5.200 4.219 4.119 4.332 . 0 0 "[ . 1 . 2]" 1
1555 1 24 ALA H 1 25 PHE H 3.600 . 5.200 4.436 4.326 4.533 . 0 0 "[ . 1 . 2]" 1
1556 1 25 PHE H 1 25 PHE QD 3.100 . 4.300 3.153 2.830 3.352 . 0 0 "[ . 1 . 2]" 1
1557 1 25 PHE H 1 42 THR HA 3.600 . 5.200 4.846 4.665 4.974 . 0 0 "[ . 1 . 2]" 1
1558 1 25 PHE H 1 44 VAL HA 3.600 . 5.200 4.035 3.777 4.238 . 0 0 "[ . 1 . 2]" 1
1559 1 25 PHE H 1 45 PRO HD3 4.000 . 6.000 4.954 4.376 5.395 . 0 0 "[ . 1 . 2]" 1
1560 1 25 PHE H 1 25 PHE QB 3.400 . 4.800 3.274 3.232 3.326 . 0 0 "[ . 1 . 2]" 1
1561 1 25 PHE H 1 43 TYR HB3 3.000 . 4.100 2.853 2.368 3.402 . 0 0 "[ . 1 . 2]" 1
1562 1 25 PHE H 1 57 LEU MD1 2.900 . 4.000 2.709 2.527 2.839 . 0 0 "[ . 1 . 2]" 1
1563 1 25 PHE H 1 57 LEU MD2 3.600 . 5.200 4.160 3.892 4.533 . 0 0 "[ . 1 . 2]" 1
1564 1 82 THR H 1 83 PHE QD 4.300 . 6.000 5.727 4.650 6.075 0.075 10 0 "[ . 1 . 2]" 1
1565 1 81 ASP HA 1 82 THR H 3.000 . 4.100 3.577 3.546 3.602 . 0 0 "[ . 1 . 2]" 1
1566 1 79 VAL HA 1 82 THR H 3.400 . 4.800 3.898 3.802 3.996 . 0 0 "[ . 1 . 2]" 1
1567 1 79 VAL HB 1 82 THR H 3.600 . 6.000 5.920 5.849 6.009 0.009 11 0 "[ . 1 . 2]" 1
1568 1 82 THR H 1 84 LEU QB 3.300 . 6.000 5.146 5.064 5.217 . 0 0 "[ . 1 . 2]" 1
1569 1 82 THR H 1 98 VAL H 3.700 . 6.000 5.971 5.785 6.182 0.182 6 0 "[ . 1 . 2]" 1
1570 1 82 THR H 1 98 VAL HB 4.000 . 6.000 5.066 4.747 5.412 . 0 0 "[ . 1 . 2]" 1
1571 1 47 PHE H 1 48 LYS H 2.800 . 3.800 2.686 2.527 2.842 . 0 0 "[ . 1 . 2]" 1
1572 1 66 SER H 1 67 SER H 2.900 . 4.000 2.894 2.769 2.976 . 0 0 "[ . 1 . 2]" 1
1573 1 67 SER H 1 68 HIS HA 3.900 . 5.800 5.235 5.121 5.321 . 0 0 "[ . 1 . 2]" 1
1574 1 67 SER H 1 68 HIS HB3 4.000 . 6.000 5.132 5.000 5.253 . 0 0 "[ . 1 . 2]" 1
1575 1 64 HIS QB 1 67 SER H 2.400 . 6.000 5.261 5.002 5.407 . 0 0 "[ . 1 . 2]" 1
1576 1 67 SER H 1 68 HIS HB2 3.800 . 5.600 4.831 4.637 5.000 . 0 0 "[ . 1 . 2]" 1
1577 1 65 ALA MB 1 67 SER H 3.600 . 5.200 4.506 4.311 4.640 . 0 0 "[ . 1 . 2]" 1
1578 1 69 SER H 1 70 ILE HB 3.600 . 5.200 4.932 4.806 5.057 . 0 0 "[ . 1 . 2]" 1
1579 1 21 ASP H 1 22 HIS H 2.400 . 3.100 2.015 1.912 2.153 . 0 0 "[ . 1 . 2]" 1
1580 1 18 GLU HA 1 21 ASP H 4.700 . 6.000 6.109 6.059 6.270 0.270 17 0 "[ . 1 . 2]" 1
1581 1 19 THR HA 1 21 ASP H 3.500 . 5.100 3.520 3.368 3.684 . 0 0 "[ . 1 . 2]" 1
1582 1 21 ASP H 1 48 LYS QE 3.300 . 6.000 4.508 3.975 5.799 . 0 0 "[ . 1 . 2]" 1
1583 1 21 ASP H 1 23 GLU QG 4.000 . 6.000 5.529 4.348 5.769 . 0 0 "[ . 1 . 2]" 1
1584 1 20 GLU QB 1 21 ASP H 3.100 . 4.300 3.744 3.665 3.847 . 0 0 "[ . 1 . 2]" 1
1585 1 8 ILE MG 1 21 ASP H 3.800 . 6.000 6.104 6.057 6.190 0.190 6 0 "[ . 1 . 2]" 1
1586 1 69 SER H 1 70 ILE H 3.000 . 4.100 2.704 2.585 2.992 . 0 0 "[ . 1 . 2]" 1
1587 1 68 HIS HD1 1 69 SER H 3.500 . 6.000 5.563 4.837 6.137 0.137 10 0 "[ . 1 . 2]" 1
1588 1 68 HIS HA 1 69 SER H 3.100 . 4.300 3.175 3.115 3.233 . 0 0 "[ . 1 . 2]" 1
1589 1 65 ALA HA 1 69 SER H 3.400 . 4.900 4.744 4.612 4.857 . 0 0 "[ . 1 . 2]" 1
1590 1 68 HIS HB3 1 69 SER H 3.300 . 4.600 3.724 3.598 3.827 . 0 0 "[ . 1 . 2]" 1
1591 1 68 HIS HB2 1 69 SER H 3.700 . 5.400 4.306 4.192 4.369 . 0 0 "[ . 1 . 2]" 1
1592 1 65 ALA MB 1 69 SER H 3.700 . 5.400 5.011 4.940 5.051 . 0 0 "[ . 1 . 2]" 1
1593 1 3 THR H 1 3 THR HB 3.200 . 4.500 3.080 2.555 4.046 . 0 0 "[ . 1 . 2]" 1
1594 1 2 ALA MB 1 3 THR H 3.300 . 4.700 2.857 2.129 3.610 . 0 0 "[ . 1 . 2]" 1
1595 1 3 THR H 1 3 THR MG 3.200 . 4.500 3.360 2.163 4.008 . 0 0 "[ . 1 . 2]" 1
1596 1 86 ARG H 1 87 ASN HA 3.800 . 5.600 5.108 5.040 5.176 . 0 0 "[ . 1 . 2]" 1
1597 1 84 LEU HA 1 86 ARG H 3.100 . 4.300 3.905 3.763 3.959 . 0 0 "[ . 1 . 2]" 1
1598 1 85 PRO HD3 1 86 ARG H 3.600 . 5.200 3.852 3.776 3.974 . 0 0 "[ . 1 . 2]" 1
1599 1 84 LEU QB 1 86 ARG H 3.500 . 5.100 4.463 4.405 4.524 . 0 0 "[ . 1 . 2]" 1
1600 1 84 LEU HG 1 86 ARG H 3.700 . 6.000 5.960 5.863 6.027 0.027 13 0 "[ . 1 . 2]" 1
1601 1 82 THR MG 1 86 ARG H 2.400 . 6.000 5.462 5.371 5.580 . 0 0 "[ . 1 . 2]" 1
1602 1 62 PHE QD 1 66 SER H 3.300 . 4.700 4.769 4.713 4.842 0.142 7 0 "[ . 1 . 2]" 1
1603 1 63 GLU HA 1 66 SER H 3.200 . 4.500 4.157 4.025 4.301 . 0 0 "[ . 1 . 2]" 1
1604 1 62 PHE HA 1 66 SER H 2.900 . 3.900 3.526 3.389 3.589 . 0 0 "[ . 1 . 2]" 1
1605 1 64 HIS QB 1 66 SER H 3.900 . 5.800 4.767 4.648 4.875 . 0 0 "[ . 1 . 2]" 1
1606 1 62 PHE HB3 1 66 SER H 3.200 . 4.500 4.570 4.542 4.598 0.098 18 0 "[ . 1 . 2]" 1
1607 1 66 SER H 1 72 ILE HG13 3.300 . 4.600 4.689 4.639 4.767 0.167 19 0 "[ . 1 . 2]" 1
1608 1 66 SER H 1 72 ILE MD 3.000 . 4.100 3.554 3.348 3.853 . 0 0 "[ . 1 . 2]" 1
1609 1 20 GLU H 1 22 HIS H 3.600 . 5.200 4.143 4.051 4.248 . 0 0 "[ . 1 . 2]" 1
1610 1 22 HIS H 1 22 HIS HD2 3.000 . 4.100 3.713 3.538 4.034 . 0 0 "[ . 1 . 2]" 1
1611 1 18 GLU HA 1 22 HIS H 3.800 . 5.600 5.027 4.876 5.181 . 0 0 "[ . 1 . 2]" 1
1612 1 19 THR HA 1 22 HIS H 3.700 . 5.400 3.999 3.862 4.215 . 0 0 "[ . 1 . 2]" 1
1613 1 20 GLU HA 1 22 HIS H 3.100 . 4.300 3.993 3.769 4.214 . 0 0 "[ . 1 . 2]" 1
1614 1 22 HIS H 1 25 PHE QB 3.700 . 6.000 5.656 5.487 5.889 . 0 0 "[ . 1 . 2]" 1
1615 1 21 ASP HB3 1 22 HIS H 3.800 . 5.600 3.160 2.908 3.996 . 0 0 "[ . 1 . 2]" 1
1616 1 18 GLU QB 1 22 HIS H 3.800 . 6.000 4.153 3.447 4.772 . 0 0 "[ . 1 . 2]" 1
1617 1 55 SER H 1 83 PHE QD 3.800 . 5.600 5.469 4.649 5.724 0.124 6 0 "[ . 1 . 2]" 1
1618 1 55 SER H 1 78 TYR QE 3.100 . 4.300 3.634 3.119 4.305 0.005 7 0 "[ . 1 . 2]" 1
1619 1 55 SER H 1 55 SER HB3 3.600 . 5.200 3.350 2.496 3.583 . 0 0 "[ . 1 . 2]" 1
1620 1 42 THR HB 1 55 SER H 3.700 . 6.000 6.139 6.057 6.185 0.185 15 0 "[ . 1 . 2]" 1
1621 1 55 SER H 1 83 PHE QB 4.000 . 6.000 5.578 5.276 6.094 0.094 7 0 "[ . 1 . 2]" 1
1622 1 55 SER H 1 56 HIS QB 4.400 . 6.000 4.454 4.005 4.598 . 0 0 "[ . 1 . 2]" 1
1623 1 53 LEU QB 1 55 SER H 3.600 . 5.200 4.883 4.698 4.979 . 0 0 "[ . 1 . 2]" 1
1624 1 55 SER H 1 57 LEU HG 3.400 . 6.000 5.234 5.106 5.391 . 0 0 "[ . 1 . 2]" 1
1625 1 55 SER H 1 79 VAL QG 3.900 . 5.800 3.365 3.164 3.667 . 0 0 "[ . 1 . 2]" 1
1626 1 78 TYR H 1 80 SER H 3.300 . 4.600 3.921 3.808 4.053 . 0 0 "[ . 1 . 2]" 1
1627 1 80 SER H 1 82 THR H 3.200 . 4.500 4.568 4.535 4.616 0.116 8 0 "[ . 1 . 2]" 1
1628 1 78 TYR QD 1 80 SER H 2.400 . 6.000 4.995 4.904 5.144 . 0 0 "[ . 1 . 2]" 1
1629 1 77 SER HA 1 80 SER H 2.700 . 3.600 2.348 2.183 2.621 . 0 0 "[ . 1 . 2]" 1
1630 1 80 SER H 1 80 SER HA 2.800 . 3.800 2.794 2.754 2.834 . 0 0 "[ . 1 . 2]" 1
1631 1 79 VAL HA 1 80 SER H 3.100 . 4.300 3.533 3.513 3.562 . 0 0 "[ . 1 . 2]" 1
1632 1 80 SER H 1 83 PHE QB 3.300 . 4.700 4.675 4.599 4.742 0.042 16 0 "[ . 1 . 2]" 1
1633 1 76 CYS HB2 1 80 SER H 3.200 . 4.500 4.355 3.851 4.556 0.056 17 0 "[ . 1 . 2]" 1
1634 1 80 SER H 1 84 LEU HG 3.700 . 5.400 4.673 4.399 4.908 . 0 0 "[ . 1 . 2]" 1
1635 1 79 VAL QG 1 80 SER H 3.700 . 4.300 3.101 3.030 3.173 . 0 0 "[ . 1 . 2]" 1
1636 1 80 SER H 1 84 LEU MD2 4.100 . 6.000 5.810 5.606 6.019 0.019 20 0 "[ . 1 . 2]" 1
1637 1 51 LEU HA 1 52 GLY H 3.200 . 4.500 3.429 3.245 3.529 . 0 0 "[ . 1 . 2]" 1
1638 1 51 LEU HB3 1 52 GLY H 3.100 . 4.300 3.359 2.755 4.263 . 0 0 "[ . 1 . 2]" 1
1639 1 16 ARG H 1 17 PHE H 3.500 . 5.000 4.409 4.360 4.483 . 0 0 "[ . 1 . 2]" 1
1640 1 14 LYS H 1 16 ARG H 3.300 . 4.700 3.559 3.260 3.834 . 0 0 "[ . 1 . 2]" 1
1641 1 16 ARG H 1 27 GLU HA 3.700 . 5.400 4.791 4.503 4.988 . 0 0 "[ . 1 . 2]" 1
1642 1 14 LYS HA 1 16 ARG H 3.500 . 5.100 4.991 4.648 5.196 0.096 17 0 "[ . 1 . 2]" 1
1643 1 15 ARG HA 1 16 ARG H 2.800 . 3.800 2.701 2.518 3.000 . 0 0 "[ . 1 . 2]" 1
1644 1 11 ASN HB3 1 16 ARG H 2.900 . 3.900 3.112 2.647 3.404 . 0 0 "[ . 1 . 2]" 1
1645 1 11 ASN HB2 1 16 ARG H 4.000 . 6.000 4.640 4.221 4.888 . 0 0 "[ . 1 . 2]" 1
1646 1 16 ARG H 1 16 ARG QB 3.000 . 4.100 3.008 2.794 3.248 . 0 0 "[ . 1 . 2]" 1
1647 1 19 THR H 1 23 GLU H 3.700 . 5.400 5.217 4.651 5.428 0.028 18 0 "[ . 1 . 2]" 1
1648 1 19 THR H 1 25 PHE QD 3.600 . 5.200 5.090 4.795 5.263 0.063 2 0 "[ . 1 . 2]" 1
1649 1 19 THR H 1 24 ALA HA 3.500 . 5.000 5.033 4.921 5.093 0.093 14 0 "[ . 1 . 2]" 1
1650 1 19 THR H 1 22 HIS HA 3.200 . 4.500 3.768 3.489 4.040 . 0 0 "[ . 1 . 2]" 1
1651 1 19 THR H 1 25 PHE QB 3.400 . 4.800 3.736 3.436 3.911 . 0 0 "[ . 1 . 2]" 1
1652 1 19 THR H 1 21 ASP HB3 4.700 . 6.000 5.240 4.532 6.170 0.170 6 0 "[ . 1 . 2]" 1
1653 1 19 THR H 1 57 LEU HG 3.800 . 5.600 5.509 5.273 5.632 0.032 11 0 "[ . 1 . 2]" 1
1654 1 8 ILE MG 1 19 THR H 3.100 . 4.300 3.579 3.338 3.859 . 0 0 "[ . 1 . 2]" 1
1655 1 19 THR H 1 57 LEU MD2 3.000 . 4.100 2.936 2.698 3.103 . 0 0 "[ . 1 . 2]" 1
1656 1 11 ASN HA 1 13 GLY H 3.200 . 4.500 3.555 3.332 3.842 . 0 0 "[ . 1 . 2]" 1
1657 1 13 GLY H 1 14 LYS HA 3.800 . 5.600 5.232 5.105 5.376 . 0 0 "[ . 1 . 2]" 1
1658 1 12 GLU HA 1 13 GLY H 3.100 . 4.300 3.482 3.409 3.554 . 0 0 "[ . 1 . 2]" 1
1659 1 13 GLY H 1 14 LYS QE 3.800 . 6.000 5.439 4.071 5.888 . 0 0 "[ . 1 . 2]" 1
1660 1 13 GLY H 1 16 ARG QG 4.100 . 6.000 5.481 5.054 5.781 . 0 0 "[ . 1 . 2]" 1
1661 1 13 GLY H 1 14 LYS QB 3.600 . 5.300 4.657 4.378 4.941 . 0 0 "[ . 1 . 2]" 1
1662 1 12 GLU HB3 1 13 GLY H 3.100 . 4.300 4.090 2.669 4.339 0.039 2 0 "[ . 1 . 2]" 1
1663 1 34 GLY H 1 35 LYS QG 3.300 . 4.700 3.756 3.323 4.204 . 0 0 "[ . 1 . 2]" 1
1664 1 31 ARG H 1 34 GLY H 3.200 . 4.500 4.365 4.144 4.539 0.039 5 0 "[ . 1 . 2]" 1
1665 1 33 ASN H 1 34 GLY H 2.900 . 4.000 2.693 2.556 2.922 . 0 0 "[ . 1 . 2]" 1
1666 1 34 GLY H 1 35 LYS H 2.800 . 3.800 2.135 1.797 2.377 0.003 20 0 "[ . 1 . 2]" 1
1667 1 31 ARG HA 1 34 GLY H 3.000 . 4.100 3.852 3.513 4.166 0.066 13 0 "[ . 1 . 2]" 1
1668 1 33 ASN QB 1 34 GLY H 3.200 . 4.500 3.485 3.120 3.741 . 0 0 "[ . 1 . 2]" 1
1669 1 32 ASN QB 1 34 GLY H 3.600 . 5.300 3.570 3.217 3.885 . 0 0 "[ . 1 . 2]" 1
1670 1 30 MET HB3 1 34 GLY H 4.000 . 6.000 4.181 3.785 5.609 . 0 0 "[ . 1 . 2]" 1
1671 1 32 ASN HA 1 32 ASN HD21 3.500 . 5.000 4.028 2.895 4.468 . 0 0 "[ . 1 . 2]" 1
1672 1 31 ARG QB 1 32 ASN HD21 3.500 . 6.000 5.132 4.051 5.646 . 0 0 "[ . 1 . 2]" 1
1673 1 25 PHE H 1 43 TYR HA 3.400 . 4.900 4.659 4.297 4.898 . 0 0 "[ . 1 . 2]" 1
1674 1 26 ILE H 1 42 THR HA 3.600 . 5.200 5.186 5.002 5.277 0.077 18 0 "[ . 1 . 2]" 1
1675 1 27 GLU H 1 42 THR HA 3.700 . 5.400 4.384 4.158 4.665 . 0 0 "[ . 1 . 2]" 1
1676 1 27 GLU H 1 41 HIS HA 3.500 . 5.000 5.113 5.036 5.209 0.209 19 0 "[ . 1 . 2]" 1
1677 1 16 ARG QB 1 27 GLU H 3.300 . 4.700 3.997 3.607 4.309 . 0 0 "[ . 1 . 2]" 1
1678 1 34 GLY H 1 36 VAL H 3.700 . 5.500 3.534 3.348 3.773 . 0 0 "[ . 1 . 2]" 1
1679 1 43 TYR H 1 57 LEU MD2 3.700 . 6.000 5.026 4.746 5.186 . 0 0 "[ . 1 . 2]" 1
1680 1 24 ALA HA 1 43 TYR H 3.500 . 5.100 4.465 4.276 4.640 . 0 0 "[ . 1 . 2]" 1
1681 1 26 ILE HB 1 43 TYR H 3.700 . 5.400 4.789 4.466 5.311 . 0 0 "[ . 1 . 2]" 1
1682 1 77 SER H 1 79 VAL QG 3.700 . 5.400 5.164 5.137 5.207 . 0 0 "[ . 1 . 2]" 1
1683 1 42 THR HG1 1 79 VAL H 3.800 . 5.600 5.646 5.605 5.704 0.104 8 0 "[ . 1 . 2]" 1
1684 1 42 THR HB 1 79 VAL H 3.700 . 5.400 4.937 4.781 5.206 . 0 0 "[ . 1 . 2]" 1
1685 1 77 SER HA 1 79 VAL H 3.300 . 4.600 3.900 3.772 4.066 . 0 0 "[ . 1 . 2]" 1
1686 1 74 PRO HB2 1 80 SER H 3.000 . 4.100 3.958 3.636 4.093 . 0 0 "[ . 1 . 2]" 1
1687 1 77 SER HA 1 81 ASP H 3.100 . 4.300 3.414 3.167 3.565 . 0 0 "[ . 1 . 2]" 1
1688 1 79 VAL HA 1 81 ASP H 3.200 . 4.500 4.360 4.290 4.455 . 0 0 "[ . 1 . 2]" 1
1689 1 89 SER H 1 90 TRP H 2.200 . 2.800 2.171 1.814 2.531 . 0 0 "[ . 1 . 2]" 1
1690 1 88 PRO HB2 1 89 SER H 3.400 . 4.900 4.264 4.123 4.325 . 0 0 "[ . 1 . 2]" 1
1691 1 93 LEU H 1 94 ILE H 2.700 . 3.600 2.190 2.033 2.449 . 0 0 "[ . 1 . 2]" 1
1692 1 95 HIS QB 1 97 GLU H 3.700 . 5.400 3.732 2.432 5.182 . 0 0 "[ . 1 . 2]" 1
1693 1 97 GLU H 1 98 VAL H 3.200 . 4.500 4.123 3.537 4.607 0.107 9 0 "[ . 1 . 2]" 1
1694 1 9 VAL H 1 18 GLU H 2.900 . 3.900 2.944 2.764 3.086 . 0 0 "[ . 1 . 2]" 1
1695 1 9 VAL H 1 18 GLU HA 3.200 . 4.500 4.586 4.533 4.645 0.145 6 0 "[ . 1 . 2]" 1
1696 1 9 VAL H 1 17 PHE HB2 4.300 . 6.000 5.894 5.699 6.026 0.026 18 0 "[ . 1 . 2]" 1
1697 1 13 GLY H 1 15 ARG H 3.600 . 5.200 3.753 3.519 4.022 . 0 0 "[ . 1 . 2]" 1
1698 1 12 GLU HB3 1 15 ARG H 2.400 . 6.000 5.167 4.808 5.530 . 0 0 "[ . 1 . 2]" 1
1699 1 10 TRP HE1 1 16 ARG H 3.200 . 4.500 3.300 2.850 3.583 . 0 0 "[ . 1 . 2]" 1
1700 1 10 TRP HD1 1 16 ARG H 2.900 . 4.000 3.209 2.984 3.652 . 0 0 "[ . 1 . 2]" 1
1701 1 12 GLU HA 1 16 ARG H 3.300 . 4.600 3.666 3.091 4.028 . 0 0 "[ . 1 . 2]" 1
1702 1 17 PHE H 1 27 GLU HA 3.400 . 4.800 3.632 3.414 3.951 . 0 0 "[ . 1 . 2]" 1
1703 1 17 PHE H 1 57 LEU MD2 3.500 . 5.100 4.668 4.455 4.994 . 0 0 "[ . 1 . 2]" 1
1704 1 10 TRP HD1 1 17 PHE H 3.300 . 4.600 4.435 4.164 4.666 0.066 3 0 "[ . 1 . 2]" 1
1705 1 18 GLU H 1 57 LEU MD2 3.400 . 4.800 4.336 3.855 4.568 . 0 0 "[ . 1 . 2]" 1
1706 1 16 ARG QG 1 18 GLU H 3.000 . 6.000 4.414 3.727 5.807 . 0 0 "[ . 1 . 2]" 1
1707 1 19 THR H 1 20 GLU H 3.600 . 5.200 4.590 4.499 4.644 . 0 0 "[ . 1 . 2]" 1
1708 1 8 ILE MD 1 21 ASP H 3.800 . 5.600 4.872 4.554 5.368 . 0 0 "[ . 1 . 2]" 1
1709 1 18 GLU HG3 1 22 HIS H 4.100 . 6.000 5.353 4.379 6.247 0.247 5 0 "[ . 1 . 2]" 1
1710 1 19 THR MG 1 22 HIS H 2.800 . 3.800 2.014 1.752 2.278 0.048 14 0 "[ . 1 . 2]" 1
1711 1 23 GLU H 1 48 LYS QE 3.800 . 6.000 5.323 4.514 5.824 . 0 0 "[ . 1 . 2]" 1
1712 1 21 ASP HB3 1 23 GLU H 4.200 . 6.000 3.163 2.150 4.435 . 0 0 "[ . 1 . 2]" 1
1713 1 22 HIS HB3 1 23 GLU H 3.400 . 4.900 4.141 4.050 4.352 . 0 0 "[ . 1 . 2]" 1
1714 1 24 ALA H 1 45 PRO HD3 3.000 . 4.100 3.311 2.897 3.606 . 0 0 "[ . 1 . 2]" 1
1715 1 15 ARG HA 1 28 TYR H 3.300 . 6.000 5.145 4.775 5.576 . 0 0 "[ . 1 . 2]" 1
1716 1 16 ARG QB 1 28 TYR H 3.900 . 5.800 3.472 3.077 3.998 . 0 0 "[ . 1 . 2]" 1
1717 1 30 MET H 1 34 GLY QA 4.400 . 6.000 4.559 4.272 4.729 . 0 0 "[ . 1 . 2]" 1
1718 1 33 ASN H 1 33 ASN QB 3.200 . 4.500 3.142 2.983 3.400 . 0 0 "[ . 1 . 2]" 1
1719 1 35 LYS H 1 36 VAL HB 3.900 . 5.800 4.335 3.984 4.487 . 0 0 "[ . 1 . 2]" 1
1720 1 33 ASN HD21 1 35 LYS H 2.400 . 6.000 5.465 4.555 6.053 0.053 4 0 "[ . 1 . 2]" 1
1721 1 29 LYS HA 1 38 ASP H 3.300 . 4.700 4.598 4.399 4.675 . 0 0 "[ . 1 . 2]" 1
1722 1 28 TYR HB2 1 40 VAL H 3.800 . 5.600 3.911 3.614 4.278 . 0 0 "[ . 1 . 2]" 1
1723 1 40 VAL H 1 41 HIS HB3 3.200 . 6.000 5.132 4.887 5.523 . 0 0 "[ . 1 . 2]" 1
1724 1 27 GLU QB 1 40 VAL H 2.900 . 4.000 3.673 3.185 3.911 . 0 0 "[ . 1 . 2]" 1
1725 1 40 VAL H 1 76 CYS HB2 3.400 . 6.000 6.013 5.437 6.801 0.801 14 1 "[ . 1 +. 2]" 1
1726 1 26 ILE QG 1 41 HIS H 3.600 . 6.000 4.839 4.313 5.729 . 0 0 "[ . 1 . 2]" 1
1727 1 92 PRO HA 1 93 LEU H 2.800 . 3.800 3.329 3.204 3.415 . 0 0 "[ . 1 . 2]" 1
1728 1 81 ASP QB 1 82 THR HA 2.700 . 3.600 3.173 3.066 3.270 . 0 0 "[ . 1 . 2]" 1
1729 1 58 CYS HA 1 60 ALA MB 3.200 . 4.500 3.734 3.671 3.809 . 0 0 "[ . 1 . 2]" 1
1730 1 40 VAL QG 1 75 SER HA 3.200 . 4.500 3.893 3.768 4.016 . 0 0 "[ . 1 . 2]" 1
1731 1 80 SER H 1 80 SER HA 2.500 . 3.300 2.592 2.539 2.655 . 0 0 "[ . 1 . 2]" 1
1732 1 61 ALA MB 1 62 PHE HA 3.100 . 4.300 3.739 3.710 3.782 . 0 0 "[ . 1 . 2]" 1
1733 1 91 LYS HA 1 93 LEU H 2.700 . 3.600 3.020 2.871 3.196 . 0 0 "[ . 1 . 2]" 1
1734 1 79 VAL HA 1 80 SER HA 3.100 . 6.000 3.985 3.622 4.431 . 0 0 "[ . 1 . 2]" 1
1735 1 80 SER HA 1 94 ILE MG 3.400 . 4.800 4.469 4.250 4.729 . 0 0 "[ . 1 . 2]" 1
1736 1 36 VAL H 1 36 VAL HA 2.600 . 3.500 2.700 2.631 2.778 . 0 0 "[ . 1 . 2]" 1
1737 1 52 GLY HA3 1 56 HIS HA 2.900 . 6.000 4.707 4.157 5.330 . 0 0 "[ . 1 . 2]" 1
1738 1 93 LEU H 1 94 ILE HA 2.600 . 3.500 2.917 2.893 2.927 . 0 0 "[ . 1 . 2]" 1
1739 1 7 LYS HA 1 20 GLU HA 3.100 . 4.300 4.444 4.299 4.510 0.210 14 0 "[ . 1 . 2]" 1
1740 1 72 ILE HA 1 73 ILE HA 3.000 . 6.000 4.412 4.391 4.445 . 0 0 "[ . 1 . 2]" 1
1741 1 56 HIS QB 1 57 LEU HA 2.700 . 6.000 3.920 3.748 4.036 . 0 0 "[ . 1 . 2]" 1
1742 1 8 ILE HA 1 8 ILE QG 3.200 . 4.500 2.853 2.265 3.050 . 0 0 "[ . 1 . 2]" 1
1743 1 73 ILE HA 1 73 ILE QG 2.900 . 3.900 2.797 2.756 2.909 . 0 0 "[ . 1 . 2]" 1
1744 1 36 VAL MG1 1 73 ILE HA 2.900 . 4.000 3.053 2.991 3.127 . 0 0 "[ . 1 . 2]" 1
1745 1 47 PHE HA 1 51 LEU QD 3.100 . 6.000 5.133 4.389 5.556 . 0 0 "[ . 1 . 2]" 1
1746 1 42 THR MG 1 43 TYR HA 3.000 . 4.100 3.195 3.065 3.449 . 0 0 "[ . 1 . 2]" 1
1747 1 16 ARG QB 1 25 PHE HA 3.100 . 4.300 4.062 3.771 4.247 . 0 0 "[ . 1 . 2]" 1
1748 1 10 TRP HA 1 10 TRP HB2 2.500 . 3.300 2.399 2.371 2.415 . 0 0 "[ . 1 . 2]" 1
1749 1 10 TRP HA 1 17 PHE HB2 3.700 . 5.400 4.255 3.718 4.476 . 0 0 "[ . 1 . 2]" 1
1750 1 93 LEU H 1 93 LEU HA 2.800 . 3.800 2.793 2.773 2.809 . 0 0 "[ . 1 . 2]" 1
1751 1 39 LEU HB3 1 61 ALA HA 3.800 . 5.600 4.891 4.761 5.021 . 0 0 "[ . 1 . 2]" 1
1752 1 31 ARG HA 1 32 ASN HA 3.600 . 5.300 4.342 4.272 4.390 . 0 0 "[ . 1 . 2]" 1
1753 1 38 ASP HA 1 61 ALA MB 3.800 . 5.600 5.210 5.076 5.321 . 0 0 "[ . 1 . 2]" 1
1754 1 38 ASP HA 1 39 LEU MD1 3.200 . 4.500 3.318 3.233 3.361 . 0 0 "[ . 1 . 2]" 1
1755 1 36 VAL MG1 1 38 ASP HA 3.200 . 4.500 3.202 3.050 3.301 . 0 0 "[ . 1 . 2]" 1
1756 1 24 ALA HA 1 44 VAL QG 3.500 . 5.100 3.761 3.324 3.961 . 0 0 "[ . 1 . 2]" 1
1757 1 85 PRO HA 1 85 PRO HD2 3.100 . 4.300 3.844 3.814 3.985 . 0 0 "[ . 1 . 2]" 1
1758 1 6 PRO QD 1 6 PRO HG3 3.100 . 4.300 2.177 2.091 2.216 . 0 0 "[ . 1 . 2]" 1
1759 1 52 GLY HA3 1 55 SER H 3.200 . 4.500 4.237 4.183 4.357 . 0 0 "[ . 1 . 2]" 1
1760 1 51 LEU HB3 1 52 GLY HA3 3.000 . 4.200 4.058 3.902 4.136 . 0 0 "[ . 1 . 2]" 1
1761 1 15 ARG QD 1 29 LYS H 3.000 . 4.200 3.536 2.889 4.135 . 0 0 "[ . 1 . 2]" 1
1762 1 31 ARG HD3 1 31 ARG HG3 2.600 . 3.500 2.210 2.046 2.787 . 0 0 "[ . 1 . 2]" 1
1763 1 93 LEU H 1 93 LEU HB3 3.400 . 4.800 3.285 3.153 3.405 . 0 0 "[ . 1 . 2]" 1
1764 1 93 LEU H 1 93 LEU HB2 2.200 . 2.800 2.259 2.041 2.430 . 0 0 "[ . 1 . 2]" 1
1765 1 38 ASP QB 1 40 VAL QG 2.900 . 4.000 2.883 2.279 3.543 . 0 0 "[ . 1 . 2]" 1
1766 1 29 LYS QD 1 38 ASP QB 2.900 . 3.900 2.191 1.648 2.748 0.252 6 0 "[ . 1 . 2]" 1
1767 1 37 MET H 1 72 ILE HB 3.600 . 5.200 4.660 4.508 4.770 . 0 0 "[ . 1 . 2]" 1
1768 1 7 LYS QE 1 8 ILE MG 3.200 . 6.000 5.333 3.498 5.735 . 0 0 "[ . 1 . 2]" 1
1769 1 7 LYS QE 1 7 LYS HG3 2.900 . 4.000 2.434 2.156 2.817 . 0 0 "[ . 1 . 2]" 1
1770 1 65 ALA MB 1 70 ILE HB 2.200 . 2.800 1.756 1.594 1.976 0.006 9 0 "[ . 1 . 2]" 1
1771 1 26 ILE MD 1 39 LEU HB2 2.800 . 3.800 2.520 2.487 2.556 . 0 0 "[ . 1 . 2]" 1
1772 1 55 SER HB3 1 83 PHE HB3 2.400 . 3.100 2.740 2.441 2.878 . 0 0 "[ . 1 . 2]" 1
1773 1 87 ASN QB 1 88 PRO HD2 3.500 . 5.000 3.852 3.417 4.222 . 0 0 "[ . 1 . 2]" 1
1774 1 36 VAL MG1 1 73 ILE HB 3.000 . 4.100 2.723 2.371 2.948 . 0 0 "[ . 1 . 2]" 1
1775 1 76 CYS HA 1 78 TYR HB3 3.100 . 4.300 2.881 2.839 2.942 . 0 0 "[ . 1 . 2]" 1
1776 1 11 ASN HB2 1 14 LYS HG2 3.700 . 5.400 4.579 4.090 5.010 . 0 0 "[ . 1 . 2]" 1
1777 1 11 ASN HB2 1 14 LYS QB 3.400 . 4.800 3.464 2.443 3.998 . 0 0 "[ . 1 . 2]" 1
1778 1 27 GLU H 1 27 GLU HG2 3.400 . 4.800 4.225 3.982 4.630 . 0 0 "[ . 1 . 2]" 1
1779 1 31 ARG QB 1 32 ASN QB 2.800 . 3.800 2.757 2.504 2.908 . 0 0 "[ . 1 . 2]" 1
1780 1 31 ARG QB 1 32 ASN QB 3.100 . 4.300 2.250 1.869 2.718 0.031 17 0 "[ . 1 . 2]" 1
1781 1 29 LYS HB2 1 38 ASP QB 3.600 . 6.000 4.087 2.343 4.489 . 0 0 "[ . 1 . 2]" 1
1782 1 37 MET HB2 1 39 LEU MD1 3.300 . 4.700 2.839 2.641 3.245 . 0 0 "[ . 1 . 2]" 1
1783 1 93 LEU H 1 94 ILE HB 3.000 . 4.100 3.705 3.645 3.766 . 0 0 "[ . 1 . 2]" 1
1784 1 21 ASP HA 1 23 GLU QG 3.200 . 4.500 4.126 3.998 4.204 . 0 0 "[ . 1 . 2]" 1
1785 1 21 ASP H 1 23 GLU QG 3.400 . 4.800 3.893 3.463 4.152 . 0 0 "[ . 1 . 2]" 1
1786 1 18 GLU QB 1 24 ALA MB 3.500 . 6.000 4.701 4.414 4.838 . 0 0 "[ . 1 . 2]" 1
1787 1 59 VAL MG2 1 62 PHE HB2 3.300 . 4.700 3.877 3.652 4.053 . 0 0 "[ . 1 . 2]" 1
1788 1 59 VAL MG2 1 62 PHE HB2 3.500 . 5.000 3.604 3.444 3.778 . 0 0 "[ . 1 . 2]" 1
1789 1 35 LYS H 1 35 LYS HB3 3.400 . 4.800 3.484 3.429 3.553 . 0 0 "[ . 1 . 2]" 1
1790 1 31 ARG QB 1 36 VAL H 2.600 . 3.400 2.959 2.806 3.128 . 0 0 "[ . 1 . 2]" 1
1791 1 31 ARG QB 1 36 VAL QG 2.900 . 4.000 2.482 2.113 2.887 . 0 0 "[ . 1 . 2]" 1
1792 1 6 PRO QB 1 6 PRO QD 3.500 . 5.000 2.556 2.430 2.615 . 0 0 "[ . 1 . 2]" 1
1793 1 6 PRO QB 1 7 LYS H 2.700 . 3.600 2.672 2.204 3.070 . 0 0 "[ . 1 . 2]" 1
1794 1 6 PRO QB 1 8 ILE QG 3.600 . 5.200 2.800 2.368 3.607 . 0 0 "[ . 1 . 2]" 1
1795 1 92 PRO HB2 1 93 LEU H 2.700 . 3.600 3.407 2.948 3.659 0.059 6 0 "[ . 1 . 2]" 1
1796 1 58 CYS HB3 1 76 CYS HB2 2.600 . 3.500 2.946 2.444 3.143 . 0 0 "[ . 1 . 2]" 1
1797 1 93 LEU H 1 93 LEU HG 2.400 . 3.100 2.293 2.028 2.673 . 0 0 "[ . 1 . 2]" 1
1798 1 9 VAL QG 1 10 TRP HB3 3.700 . 5.400 3.783 3.634 4.100 . 0 0 "[ . 1 . 2]" 1
1799 1 7 LYS HA 1 7 LYS QD 2.700 . 3.600 2.360 1.709 3.482 0.091 3 0 "[ . 1 . 2]" 1
1800 1 94 ILE H 1 94 ILE HG12 2.600 . 3.400 2.276 1.947 2.814 . 0 0 "[ . 1 . 2]" 1
1801 1 70 ILE HB 1 72 ILE HG12 3.500 . 5.100 3.968 3.818 4.130 . 0 0 "[ . 1 . 2]" 1
1802 1 65 ALA MB 1 72 ILE HG13 2.300 . 3.000 2.073 1.997 2.149 . 0 0 "[ . 1 . 2]" 1
1803 1 33 ASN QB 1 35 LYS QG 2.600 . 3.400 2.279 2.084 2.834 . 0 0 "[ . 1 . 2]" 1
1804 1 27 GLU QB 1 29 LYS HG2 3.200 . 6.000 5.381 4.002 5.971 . 0 0 "[ . 1 . 2]" 1
1805 1 19 THR MG 1 22 HIS H 2.600 . 3.500 1.981 1.740 2.213 . 0 0 "[ . 1 . 2]" 1
1806 1 6 PRO HG3 1 19 THR MG 3.500 . 5.000 4.524 4.107 4.988 . 0 0 "[ . 1 . 2]" 1
1807 1 39 LEU MD2 1 93 LEU MD1 2.700 . 6.000 4.791 4.616 4.973 . 0 0 "[ . 1 . 2]" 1
1808 1 20 GLU HG2 1 53 LEU QD 2.500 . 6.000 4.907 3.807 5.490 . 0 0 "[ . 1 . 2]" 1
1809 1 39 LEU HB3 1 58 CYS HB3 3.300 . 4.600 4.653 4.588 4.692 0.092 10 0 "[ . 1 . 2]" 1
1810 1 31 ARG QB 1 35 LYS QG 3.600 . 6.000 5.365 5.165 5.481 . 0 0 "[ . 1 . 2]" 1
1811 1 63 GLU HA 1 93 LEU MD2 2.200 . 6.000 5.549 5.290 5.718 . 0 0 "[ . 1 . 2]" 1
1812 1 58 CYS HB3 1 59 VAL MG2 2.900 . 3.900 3.236 3.123 3.336 . 0 0 "[ . 1 . 2]" 1
1813 1 39 LEU MD2 1 59 VAL MG2 3.400 . 4.800 4.424 4.337 4.501 . 0 0 "[ . 1 . 2]" 1
1814 1 24 ALA MB 1 48 LYS HB3 3.800 . 5.600 4.529 4.248 4.736 . 0 0 "[ . 1 . 2]" 1
1815 1 24 ALA MB 1 53 LEU QD 2.500 . 3.300 1.804 1.612 1.879 0.088 8 0 "[ . 1 . 2]" 1
1816 1 82 THR MG 1 85 PRO HB2 3.500 . 5.000 4.495 4.322 4.826 . 0 0 "[ . 1 . 2]" 1
1817 1 27 GLU H 1 40 VAL QG 3.000 . 4.100 3.254 3.003 3.670 . 0 0 "[ . 1 . 2]" 1
1818 1 9 VAL QG 1 10 TRP HB2 3.600 . 5.300 4.335 4.146 4.463 . 0 0 "[ . 1 . 2]" 1
1819 1 31 ARG QB 1 36 VAL MG1 3.300 . 4.700 2.812 2.195 3.525 . 0 0 "[ . 1 . 2]" 1
1820 1 8 ILE MG 1 9 VAL H 2.900 . 3.900 2.132 1.883 2.234 0.017 9 0 "[ . 1 . 2]" 1
1821 1 8 ILE MG 1 17 PHE HA 3.300 . 4.600 3.155 2.984 3.383 . 0 0 "[ . 1 . 2]" 1
1822 1 8 ILE HA 1 8 ILE MG 2.700 . 3.600 1.978 1.939 2.172 . 0 0 "[ . 1 . 2]" 1
1823 1 8 ILE H 1 8 ILE MG 3.300 . 4.700 2.497 2.080 2.761 . 0 0 "[ . 1 . 2]" 1
1824 1 56 HIS QB 1 60 ALA MB 2.700 . 6.000 3.906 3.774 4.140 . 0 0 "[ . 1 . 2]" 1
1825 1 39 LEU HG 1 60 ALA MB 3.500 . 6.000 5.706 5.548 5.831 . 0 0 "[ . 1 . 2]" 1
1826 1 65 ALA MB 1 68 HIS HB2 3.300 . 4.700 3.580 3.275 3.838 . 0 0 "[ . 1 . 2]" 1
1827 1 94 ILE H 1 94 ILE MD 2.600 . 3.500 2.686 1.859 3.317 . 0 0 "[ . 1 . 2]" 1
1828 1 72 ILE MG 1 74 PRO HB3 3.000 . 4.100 3.223 3.086 3.347 . 0 0 "[ . 1 . 2]" 1
1829 1 38 ASP QB 1 72 ILE MG 3.700 . 5.400 4.130 4.027 4.254 . 0 0 "[ . 1 . 2]" 1
1830 1 39 LEU MD2 1 72 ILE MG 2.700 . 3.600 2.050 1.879 2.243 . 0 0 "[ . 1 . 2]" 1
1831 1 38 ASP QB 1 73 ILE MG 3.000 . 4.100 3.838 3.590 3.975 . 0 0 "[ . 1 . 2]" 1
1832 1 36 VAL MG1 1 73 ILE MG 3.600 . 5.200 3.571 3.357 3.705 . 0 0 "[ . 1 . 2]" 1
1833 1 26 ILE HB 1 26 ILE MD 2.700 . 3.600 2.597 2.421 2.933 . 0 0 "[ . 1 . 2]" 1
1834 1 39 LEU HA 1 72 ILE MG 3.600 . 5.200 3.894 3.733 4.052 . 0 0 "[ . 1 . 2]" 1
1835 1 26 ILE MD 1 54 ALA MB 3.500 . 5.100 3.653 3.508 3.817 . 0 0 "[ . 1 . 2]" 1
1836 1 38 ASP HA 1 73 ILE MD 3.500 . 5.100 4.643 4.241 4.973 . 0 0 "[ . 1 . 2]" 1
1837 1 31 ARG HD3 1 73 ILE MD 2.100 . 6.000 5.477 4.365 6.311 0.311 3 0 "[ . 1 . 2]" 1
1838 1 70 ILE HB 1 70 ILE MD 2.800 . 3.800 2.370 2.356 2.393 . 0 0 "[ . 1 . 2]" 1
1839 1 65 ALA MB 1 72 ILE MD 2.400 . 3.100 1.735 1.667 1.856 0.033 15 0 "[ . 1 . 2]" 1
1840 1 8 ILE MD 1 18 GLU QB 3.100 . 6.000 4.318 4.173 4.626 . 0 0 "[ . 1 . 2]" 1
1841 1 8 ILE MD 1 26 ILE HB 3.800 . 6.000 5.677 5.397 6.171 0.171 13 0 "[ . 1 . 2]" 1
1842 1 64 HIS HA 1 72 ILE HB 3.100 . 6.000 5.828 5.654 5.982 . 0 0 "[ . 1 . 2]" 1
1843 1 28 TYR H 1 38 ASP H 3.900 . 5.800 5.714 5.384 5.832 0.032 17 0 "[ . 1 . 2]" 1
1844 1 28 TYR HB3 1 38 ASP H 4.100 . 6.000 4.944 4.694 5.133 . 0 0 "[ . 1 . 2]" 1
1845 1 38 ASP H 1 61 ALA MB 4.000 . 6.000 5.233 5.082 5.359 . 0 0 "[ . 1 . 2]" 1
1846 1 38 ASP H 1 39 LEU MD1 3.200 . 4.400 3.856 3.713 4.001 . 0 0 "[ . 1 . 2]" 1
1847 1 43 TYR H 1 45 PRO HD3 3.300 . 4.700 4.353 4.075 4.723 0.023 18 0 "[ . 1 . 2]" 1
1848 1 38 ASP QB 1 73 ILE H 3.500 . 5.100 4.120 3.985 4.220 . 0 0 "[ . 1 . 2]" 1
1849 1 39 LEU MD1 1 73 ILE H 3.400 . 4.900 3.058 2.960 3.191 . 0 0 "[ . 1 . 2]" 1
1850 1 6 PRO QB 1 8 ILE H 3.900 . 5.800 3.888 3.673 4.377 . 0 0 "[ . 1 . 2]" 1
1851 1 44 VAL H 1 53 LEU QD 3.700 . 5.400 4.583 4.402 4.736 . 0 0 "[ . 1 . 2]" 1
1852 1 8 ILE QG 1 9 VAL H 4.000 . 6.000 4.329 3.682 4.517 . 0 0 "[ . 1 . 2]" 1
1853 1 62 PHE H 1 65 ALA H 3.500 . 5.000 4.557 4.453 4.618 . 0 0 "[ . 1 . 2]" 1
1854 1 30 MET H 1 31 ARG H 3.500 . 5.000 3.961 3.874 4.013 . 0 0 "[ . 1 . 2]" 1
1855 1 31 ARG H 1 31 ARG HA 3.200 . 4.500 2.738 2.645 2.807 . 0 0 "[ . 1 . 2]" 1
1856 1 31 ARG H 1 32 ASN HA 4.100 . 6.000 3.764 3.572 3.904 . 0 0 "[ . 1 . 2]" 1
1857 1 63 GLU HA 1 64 HIS H 3.300 . 4.700 3.433 3.423 3.444 . 0 0 "[ . 1 . 2]" 1
1858 1 79 VAL HB 1 83 PHE H 3.700 . 5.400 5.210 5.143 5.309 . 0 0 "[ . 1 . 2]" 1
1859 1 52 GLY HA3 1 54 ALA H 3.100 . 4.300 3.476 3.464 3.491 . 0 0 "[ . 1 . 2]" 1
1860 1 17 PHE H 1 17 PHE HB3 3.400 . 4.800 3.438 3.318 3.521 . 0 0 "[ . 1 . 2]" 1
1861 1 16 ARG QB 1 17 PHE H 2.700 . 3.600 2.301 2.008 2.470 . 0 0 "[ . 1 . 2]" 1
1862 1 91 LYS H 1 93 LEU H 3.200 . 4.400 3.937 3.844 4.015 . 0 0 "[ . 1 . 2]" 1
1863 1 59 VAL HA 1 63 GLU H 3.500 . 5.000 3.715 3.598 3.804 . 0 0 "[ . 1 . 2]" 1
1864 1 60 ALA MB 1 63 GLU H 3.100 . 6.000 4.354 4.248 4.463 . 0 0 "[ . 1 . 2]" 1
1865 1 58 CYS H 1 59 VAL H 2.900 . 3.900 2.373 2.337 2.414 . 0 0 "[ . 1 . 2]" 1
1866 1 60 ALA H 1 61 ALA MB 3.200 . 4.400 3.145 2.794 3.352 . 0 0 "[ . 1 . 2]" 1
1867 1 56 HIS H 1 58 CYS HB3 3.500 . 5.100 5.122 5.061 5.185 0.085 16 0 "[ . 1 . 2]" 1
1868 1 56 HIS H 1 59 VAL MG2 3.500 . 5.000 4.188 4.082 4.267 . 0 0 "[ . 1 . 2]" 1
1869 1 87 ASN QB 1 90 TRP H 3.500 . 6.000 5.030 4.525 5.517 . 0 0 "[ . 1 . 2]" 1
1870 1 101 SER QB 1 102 SER H 3.200 . 4.500 2.551 1.755 3.152 0.145 14 0 "[ . 1 . 2]" 1
1871 1 31 ARG HA 1 36 VAL H 3.400 . 4.800 4.259 4.178 4.356 . 0 0 "[ . 1 . 2]" 1
1872 1 35 LYS HA 1 36 VAL H 3.000 . 4.100 2.777 2.730 2.792 . 0 0 "[ . 1 . 2]" 1
1873 1 85 PRO HA 1 87 ASN H 3.200 . 4.500 3.412 3.327 3.469 . 0 0 "[ . 1 . 2]" 1
1874 1 59 VAL MG2 1 62 PHE H 3.700 . 5.400 3.186 3.064 3.273 . 0 0 "[ . 1 . 2]" 1
1875 1 61 ALA H 1 62 PHE H 3.000 . 4.100 2.418 2.351 2.458 . 0 0 "[ . 1 . 2]" 1
1876 1 62 PHE QE 1 81 ASP H 3.400 . 6.000 6.216 6.120 6.350 0.350 12 0 "[ . 1 . 2]" 1
1877 1 81 ASP H 1 82 THR HB 3.800 . 5.600 4.728 4.652 4.836 . 0 0 "[ . 1 . 2]" 1
1878 1 65 ALA MB 1 68 HIS H 3.600 . 5.200 3.637 3.427 3.778 . 0 0 "[ . 1 . 2]" 1
1879 1 31 ARG HA 1 35 LYS H 3.500 . 5.000 4.884 4.706 5.078 0.078 11 0 "[ . 1 . 2]" 1
1880 1 14 LYS H 1 15 ARG HB3 4.000 . 6.000 4.792 4.630 5.074 . 0 0 "[ . 1 . 2]" 1
1881 1 58 CYS H 1 78 TYR QD 4.000 . 6.000 5.738 5.608 5.906 . 0 0 "[ . 1 . 2]" 1
1882 1 82 THR H 1 85 PRO HB2 3.800 . 6.000 5.658 5.550 5.931 . 0 0 "[ . 1 . 2]" 1
1883 1 82 THR H 1 84 LEU HG 3.700 . 6.000 5.630 5.158 5.814 . 0 0 "[ . 1 . 2]" 1
1884 1 18 GLU QB 1 22 HIS H 3.400 . 4.900 3.851 3.376 4.226 . 0 0 "[ . 1 . 2]" 1
1885 1 19 THR H 1 21 ASP H 3.800 . 5.600 3.655 3.558 3.808 . 0 0 "[ . 1 . 2]" 1
1886 1 19 THR H 1 20 GLU HA 3.700 . 5.400 5.322 5.189 5.414 0.014 8 0 "[ . 1 . 2]" 1
1887 1 30 MET HB2 1 34 GLY H 3.900 . 5.800 3.894 3.613 4.150 . 0 0 "[ . 1 . 2]" 1
1888 1 31 ARG QB 1 32 ASN HD21 3.300 . 4.600 4.330 3.886 4.469 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 74
_Distance_constraint_stats_list.Viol_count 142
_Distance_constraint_stats_list.Viol_total 194.499
_Distance_constraint_stats_list.Viol_max 0.238
_Distance_constraint_stats_list.Viol_rms 0.0273
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0066
_Distance_constraint_stats_list.Viol_average_violations_only 0.0685
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 9 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 PHE 0.055 0.024 3 0 "[ . 1 . 2]"
1 27 GLU 0.031 0.031 19 0 "[ . 1 . 2]"
1 29 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 VAL 0.031 0.031 19 0 "[ . 1 . 2]"
1 43 TYR 0.055 0.024 3 0 "[ . 1 . 2]"
1 53 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 ALA 0.367 0.072 3 0 "[ . 1 . 2]"
1 55 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 LEU 0.507 0.118 2 0 "[ . 1 . 2]"
1 58 CYS 0.367 0.072 3 0 "[ . 1 . 2]"
1 59 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 ALA 0.039 0.024 3 0 "[ . 1 . 2]"
1 61 ALA 0.507 0.118 2 0 "[ . 1 . 2]"
1 62 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 GLU 0.151 0.034 13 0 "[ . 1 . 2]"
1 64 HIS 1.085 0.109 15 0 "[ . 1 . 2]"
1 65 ALA 0.203 0.061 13 0 "[ . 1 . 2]"
1 66 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 SER 0.151 0.034 13 0 "[ . 1 . 2]"
1 68 HIS 1.045 0.109 15 0 "[ . 1 . 2]"
1 69 SER 0.203 0.061 13 0 "[ . 1 . 2]"
1 71 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 CYS 3.989 0.238 2 0 "[ . 1 . 2]"
1 77 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 TYR 0.044 0.019 19 0 "[ . 1 . 2]"
1 79 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 SER 5.973 0.238 2 0 "[ . 1 . 2]"
1 81 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 THR 1.353 0.123 1 0 "[ . 1 . 2]"
1 83 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 LEU 1.985 0.141 12 0 "[ . 1 . 2]"
1 86 ARG 1.309 0.123 1 0 "[ . 1 . 2]"
1 87 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 53 LEU O 1 57 LEU H 1.900 . 2.500 2.059 1.871 2.190 . 0 0 "[ . 1 . 2]" 2
2 1 53 LEU O 1 57 LEU N 2.900 2.400 3.600 2.914 2.762 3.048 . 0 0 "[ . 1 . 2]" 2
3 1 54 ALA O 1 58 CYS H 1.900 . 2.500 2.493 2.227 2.572 0.072 3 0 "[ . 1 . 2]" 2
4 1 54 ALA O 1 58 CYS N 2.900 2.400 3.600 3.420 3.185 3.513 . 0 0 "[ . 1 . 2]" 2
5 1 55 SER O 1 59 VAL H 1.900 . 2.500 1.863 1.587 2.022 . 0 0 "[ . 1 . 2]" 2
6 1 55 SER O 1 59 VAL N 2.900 2.400 3.600 2.791 2.546 2.944 . 0 0 "[ . 1 . 2]" 2
7 1 56 HIS O 1 60 ALA H 1.900 . 2.500 2.015 1.925 2.090 . 0 0 "[ . 1 . 2]" 2
8 1 56 HIS O 1 60 ALA N 2.900 2.400 3.600 2.859 2.768 2.930 . 0 0 "[ . 1 . 2]" 2
9 1 57 LEU O 1 61 ALA H 1.900 . 2.500 2.511 2.370 2.618 0.118 2 0 "[ . 1 . 2]" 2
10 1 57 LEU O 1 61 ALA N 2.900 2.400 3.600 3.368 3.231 3.493 . 0 0 "[ . 1 . 2]" 2
11 1 58 CYS O 1 62 PHE H 1.900 . 2.500 2.207 2.078 2.367 . 0 0 "[ . 1 . 2]" 2
12 1 58 CYS O 1 62 PHE N 2.900 2.400 3.600 3.122 2.997 3.271 . 0 0 "[ . 1 . 2]" 2
13 1 59 VAL O 1 63 GLU H 1.900 . 2.500 1.790 1.697 1.866 . 0 0 "[ . 1 . 2]" 2
14 1 59 VAL O 1 63 GLU N 2.900 2.400 3.600 2.757 2.671 2.822 . 0 0 "[ . 1 . 2]" 2
15 1 60 ALA O 1 64 HIS H 1.900 . 2.500 2.391 2.206 2.524 0.024 3 0 "[ . 1 . 2]" 2
16 1 60 ALA O 1 64 HIS N 2.900 2.400 3.600 3.203 3.026 3.331 . 0 0 "[ . 1 . 2]" 2
17 1 61 ALA O 1 65 ALA H 1.900 . 2.500 1.988 1.835 2.107 . 0 0 "[ . 1 . 2]" 2
18 1 61 ALA O 1 65 ALA N 2.900 2.400 3.600 2.954 2.806 3.070 . 0 0 "[ . 1 . 2]" 2
19 1 62 PHE O 1 66 SER H 1.900 . 2.500 1.830 1.746 1.878 . 0 0 "[ . 1 . 2]" 2
20 1 62 PHE O 1 66 SER N 2.900 2.400 3.600 2.774 2.702 2.825 . 0 0 "[ . 1 . 2]" 2
21 1 63 GLU O 1 67 SER H 1.900 . 2.500 2.432 2.127 2.534 0.034 13 0 "[ . 1 . 2]" 2
22 1 63 GLU O 1 67 SER N 2.900 2.400 3.600 3.320 3.031 3.443 . 0 0 "[ . 1 . 2]" 2
23 1 64 HIS O 1 68 HIS H 1.900 . 2.500 2.530 2.303 2.609 0.109 15 0 "[ . 1 . 2]" 2
24 1 64 HIS O 1 68 HIS N 2.900 2.400 3.600 3.318 3.067 3.455 . 0 0 "[ . 1 . 2]" 2
25 1 65 ALA O 1 69 SER H 1.900 . 2.500 2.485 2.376 2.561 0.061 13 0 "[ . 1 . 2]" 2
26 1 65 ALA O 1 69 SER N 2.900 2.400 3.600 2.825 2.762 2.903 . 0 0 "[ . 1 . 2]" 2
27 1 76 CYS O 1 80 SER H 1.900 . 2.500 2.687 2.623 2.738 0.238 2 0 "[ . 1 . 2]" 2
28 1 76 CYS O 1 80 SER N 2.900 2.400 3.600 3.605 3.543 3.647 0.047 2 0 "[ . 1 . 2]" 2
29 1 77 SER O 1 81 ASP H 1.900 . 2.500 1.919 1.811 2.171 . 0 0 "[ . 1 . 2]" 2
30 1 77 SER O 1 81 ASP N 2.900 2.400 3.600 2.790 2.673 3.034 . 0 0 "[ . 1 . 2]" 2
31 1 78 TYR O 1 82 THR H 1.900 . 2.500 2.443 2.315 2.519 0.019 19 0 "[ . 1 . 2]" 2
32 1 78 TYR O 1 82 THR N 2.900 2.400 3.600 3.414 3.290 3.493 . 0 0 "[ . 1 . 2]" 2
33 1 79 VAL O 1 83 PHE H 1.900 . 2.500 1.826 1.751 1.898 . 0 0 "[ . 1 . 2]" 2
34 1 79 VAL O 1 83 PHE N 2.900 2.400 3.600 2.641 2.604 2.684 . 0 0 "[ . 1 . 2]" 2
35 1 80 SER O 1 84 LEU H 1.900 . 2.500 2.599 2.558 2.641 0.141 12 0 "[ . 1 . 2]" 2
36 1 80 SER O 1 84 LEU N 2.900 2.400 3.600 3.385 3.340 3.439 . 0 0 "[ . 1 . 2]" 2
37 1 82 THR O 1 86 ARG H 1.900 . 2.500 2.558 2.352 2.623 0.123 1 0 "[ . 1 . 2]" 2
38 1 82 THR O 1 86 ARG N 2.900 2.400 3.600 3.352 3.133 3.449 . 0 0 "[ . 1 . 2]" 2
39 1 83 PHE O 1 87 ASN H 1.900 . 2.500 1.883 1.638 2.107 . 0 0 "[ . 1 . 2]" 2
40 1 83 PHE O 1 87 ASN N 2.900 2.400 3.600 2.758 2.604 2.938 . 0 0 "[ . 1 . 2]" 2
41 1 9 VAL H 1 18 GLU O 1.900 . 2.500 1.637 1.579 1.718 . 0 0 "[ . 1 . 2]" 2
42 1 9 VAL N 1 18 GLU O 2.900 2.400 3.600 2.605 2.543 2.695 . 0 0 "[ . 1 . 2]" 2
43 1 9 VAL O 1 18 GLU H 1.900 . 2.500 1.742 1.645 1.998 . 0 0 "[ . 1 . 2]" 2
44 1 9 VAL O 1 18 GLU N 2.900 2.400 3.600 2.684 2.621 2.840 . 0 0 "[ . 1 . 2]" 2
45 1 11 ASN O 1 16 ARG H 1.900 . 2.500 2.128 1.917 2.364 . 0 0 "[ . 1 . 2]" 2
46 1 11 ASN O 1 16 ARG N 2.900 2.400 3.600 3.083 2.865 3.319 . 0 0 "[ . 1 . 2]" 2
47 1 11 ASN H 1 16 ARG O 1.900 . 2.500 1.786 1.678 2.005 . 0 0 "[ . 1 . 2]" 2
48 1 11 ASN N 1 16 ARG O 2.900 2.400 3.600 2.631 2.572 2.687 . 0 0 "[ . 1 . 2]" 2
49 1 31 ARG O 1 36 VAL H 1.900 . 2.500 2.026 1.905 2.180 . 0 0 "[ . 1 . 2]" 2
50 1 31 ARG O 1 36 VAL N 2.900 2.400 3.600 2.972 2.871 3.055 . 0 0 "[ . 1 . 2]" 2
51 1 31 ARG H 1 36 VAL O 1.900 . 2.500 1.578 1.540 1.649 . 0 0 "[ . 1 . 2]" 2
52 1 31 ARG N 1 36 VAL O 2.900 2.400 3.600 2.518 2.481 2.556 . 0 0 "[ . 1 . 2]" 2
53 1 29 LYS O 1 38 ASP H 1.900 . 2.500 1.759 1.668 1.917 . 0 0 "[ . 1 . 2]" 2
54 1 29 LYS O 1 38 ASP N 2.900 2.400 3.600 2.725 2.638 2.853 . 0 0 "[ . 1 . 2]" 2
55 1 29 LYS H 1 38 ASP O 1.900 . 2.500 2.078 1.779 2.229 . 0 0 "[ . 1 . 2]" 2
56 1 29 LYS N 1 38 ASP O 2.900 2.400 3.600 2.950 2.693 3.084 . 0 0 "[ . 1 . 2]" 2
57 1 27 GLU O 1 40 VAL H 1.900 . 2.500 1.772 1.667 1.868 . 0 0 "[ . 1 . 2]" 2
58 1 27 GLU O 1 40 VAL N 2.900 2.400 3.600 2.665 2.591 2.781 . 0 0 "[ . 1 . 2]" 2
59 1 27 GLU H 1 40 VAL O 1.900 . 2.500 2.183 1.963 2.531 0.031 19 0 "[ . 1 . 2]" 2
60 1 27 GLU N 1 40 VAL O 2.900 2.400 3.600 2.953 2.754 3.262 . 0 0 "[ . 1 . 2]" 2
61 1 25 PHE O 1 43 TYR H 1.900 . 2.500 2.115 1.858 2.326 . 0 0 "[ . 1 . 2]" 2
62 1 25 PHE O 1 43 TYR N 2.900 2.400 3.600 2.996 2.759 3.178 . 0 0 "[ . 1 . 2]" 2
63 1 25 PHE H 1 43 TYR O 1.900 . 2.500 2.268 1.954 2.524 0.024 3 0 "[ . 1 . 2]" 2
64 1 25 PHE N 1 43 TYR O 2.900 2.400 3.600 3.034 2.812 3.224 . 0 0 "[ . 1 . 2]" 2
65 1 35 LYS O 1 71 SER H 1.900 . 2.500 2.047 1.772 2.294 . 0 0 "[ . 1 . 2]" 2
66 1 35 LYS O 1 71 SER N 2.900 2.400 3.600 2.950 2.708 3.186 . 0 0 "[ . 1 . 2]" 2
67 1 37 MET H 1 71 SER O 1.900 . 2.500 1.622 1.571 1.684 . 0 0 "[ . 1 . 2]" 2
68 1 37 MET N 1 71 SER O 2.900 2.400 3.600 2.589 2.546 2.650 . 0 0 "[ . 1 . 2]" 2
69 1 37 MET O 1 73 ILE H 1.900 . 2.500 1.764 1.667 1.866 . 0 0 "[ . 1 . 2]" 2
70 1 37 MET O 1 73 ILE N 2.900 2.400 3.600 2.720 2.629 2.815 . 0 0 "[ . 1 . 2]" 2
71 1 39 LEU H 1 73 ILE O 1.900 . 2.500 1.898 1.770 2.092 . 0 0 "[ . 1 . 2]" 2
72 1 39 LEU N 1 73 ILE O 2.900 2.400 3.600 2.719 2.648 2.826 . 0 0 "[ . 1 . 2]" 2
73 1 39 LEU O 1 75 SER H 1.900 . 2.500 1.981 1.845 2.241 . 0 0 "[ . 1 . 2]" 2
74 1 39 LEU O 1 75 SER N 2.900 2.400 3.600 2.645 2.583 2.736 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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