NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
406728 |
1xsf   |
6221 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1xsf
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 1477
_Distance_constraint_stats_list.Viol_count 1609
_Distance_constraint_stats_list.Viol_total 7104.262
_Distance_constraint_stats_list.Viol_max 0.997
_Distance_constraint_stats_list.Viol_rms 0.0426
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0053
_Distance_constraint_stats_list.Viol_average_violations_only 0.1472
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 2 VAL 0.166 0.166 13 0 "[ . 1 . 2 . 3]"
1 3 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 4 VAL 0.261 0.122 6 0 "[ . 1 . 2 . 3]"
1 5 THR 0.282 0.122 6 0 "[ . 1 . 2 . 3]"
1 6 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 7 ALA 0.018 0.014 18 0 "[ . 1 . 2 . 3]"
1 8 HIS 0.926 0.190 8 0 "[ . 1 . 2 . 3]"
1 9 GLU 5.644 0.603 8 2 "[ . + 1 .- 2 . 3]"
1 10 ALA 0.999 0.350 16 0 "[ . 1 . 2 . 3]"
1 11 VAL 8.271 0.484 15 0 "[ . 1 . 2 . 3]"
1 12 VAL 1.715 0.224 7 0 "[ . 1 . 2 . 3]"
1 13 ARG 7.653 0.723 19 3 "[ . 1 - . +2* . 3]"
1 14 VAL 0.689 0.571 22 1 "[ . 1 . 2 + . 3]"
1 15 GLY 7.746 0.997 1 6 "[+ * * * . 2*- . 3]"
1 16 THR 5.051 0.997 1 5 "[+ * - * . 2* . 3]"
1 17 LYS 12.328 0.846 19 8 "[ **. 1- . +2 * ** *3]"
1 18 PRO 8.184 0.315 2 0 "[ . 1 . 2 . 3]"
1 19 GLY 7.820 0.747 13 10 "[ **** *1 -+ ** 2 *. 3]"
1 20 THR 7.704 0.747 13 10 "[ **** *1 -+ ** 2 *. 3]"
1 21 GLU 3.816 0.696 27 4 "[ .- *1 . 2 . + *3]"
1 22 VAL 0.034 0.034 12 0 "[ . 1 . 2 . 3]"
1 23 PRO 4.694 0.186 26 0 "[ . 1 . 2 . 3]"
1 24 PRO 0.143 0.113 3 0 "[ . 1 . 2 . 3]"
1 25 VAL 3.932 0.657 19 1 "[ . 1 . +2 . 3]"
1 26 ILE 3.261 0.657 19 1 "[ . 1 . +2 . 3]"
1 27 ASP 2.558 0.152 23 0 "[ . 1 . 2 . 3]"
1 28 GLY 4.197 0.408 26 0 "[ . 1 . 2 . 3]"
1 29 SER 0.198 0.055 29 0 "[ . 1 . 2 . 3]"
1 30 ILE 0.607 0.077 18 0 "[ . 1 . 2 . 3]"
1 31 TRP 5.767 0.457 10 0 "[ . 1 . 2 . 3]"
1 32 ASP 2.894 0.197 17 0 "[ . 1 . 2 . 3]"
1 33 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 34 ILE 0.094 0.094 16 0 "[ . 1 . 2 . 3]"
1 35 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 36 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 37 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 38 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 39 ALA 4.285 0.190 18 0 "[ . 1 . 2 . 3]"
1 40 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 41 GLY 4.285 0.190 18 0 "[ . 1 . 2 . 3]"
1 42 ASN 9.924 0.582 19 4 "[ . - . +2 * *. 3]"
1 43 TRP 9.655 0.302 17 0 "[ . 1 . 2 . 3]"
1 44 ALA 0.523 0.105 6 0 "[ . 1 . 2 . 3]"
1 45 ILE 8.472 0.582 19 4 "[ . - . +2 * *. 3]"
1 46 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 47 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 48 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 49 ASN 0.215 0.083 17 0 "[ . 1 . 2 . 3]"
1 50 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 51 TYR 2.165 0.304 20 0 "[ . 1 . 2 . 3]"
1 52 TYR 4.852 0.272 27 0 "[ . 1 . 2 . 3]"
1 53 GLY 1.309 0.279 27 0 "[ . 1 . 2 . 3]"
1 54 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 55 VAL 1.062 0.089 26 0 "[ . 1 . 2 . 3]"
1 56 GLN 4.961 0.734 1 5 "[+ *. 1 *. -* 2 . 3]"
1 57 PHE 0.342 0.182 26 0 "[ . 1 . 2 . 3]"
1 58 ASP 2.082 0.304 20 0 "[ . 1 . 2 . 3]"
1 59 GLN 4.731 0.340 2 0 "[ . 1 . 2 . 3]"
1 60 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 61 THR 2.677 0.101 20 0 "[ . 1 . 2 . 3]"
1 62 TRP 13.578 0.955 2 6 "[*+ . * * . - 2* . 3]"
1 63 GLU 1.137 0.172 8 0 "[ . 1 . 2 . 3]"
1 64 ALA 8.877 0.392 28 0 "[ . 1 . 2 . 3]"
1 65 ASN 9.160 0.392 28 0 "[ . 1 . 2 . 3]"
1 66 GLY 1.678 0.221 26 0 "[ . 1 . 2 . 3]"
1 67 GLY 0.368 0.368 26 0 "[ . 1 . 2 . 3]"
1 68 LEU 14.057 0.955 2 6 "[*+ . * * . * 2* . 3]"
1 69 ARG 8.075 0.617 17 1 "[ . 1 . + 2 . 3]"
1 70 TYR 0.349 0.115 18 0 "[ . 1 . 2 . 3]"
1 71 ALA 2.916 0.146 14 0 "[ . 1 . 2 . 3]"
1 72 PRO 12.886 0.213 23 0 "[ . 1 . 2 . 3]"
1 73 ARG 1.743 0.159 23 0 "[ . 1 . 2 . 3]"
1 74 ALA 4.322 0.272 27 0 "[ . 1 . 2 . 3]"
1 75 ASP 1.935 0.279 27 0 "[ . 1 . 2 . 3]"
1 76 LEU 0.041 0.020 19 0 "[ . 1 . 2 . 3]"
1 77 ALA 0.430 0.178 10 0 "[ . 1 . 2 . 3]"
1 78 THR 0.155 0.087 9 0 "[ . 1 . 2 . 3]"
1 79 ARG 10.549 0.937 10 6 "[ . + ** *- 2 * 3]"
1 80 GLU 2.826 0.362 10 0 "[ . 1 . 2 . 3]"
1 81 GLU 12.428 0.960 3 8 "[* + . ** 1 -. 2 .* **3]"
1 82 GLN 6.838 0.734 1 7 "[+ *. 1 ** *- 2 * 3]"
1 83 ILE 1.656 0.619 28 1 "[ . 1 . 2 . + 3]"
1 84 ALA 9.471 0.960 3 3 "[ + . *- 1 . 2 . 3]"
1 85 VAL 4.052 0.860 26 2 "[ . * . 2 .+ 3]"
1 86 ALA 3.364 0.210 5 0 "[ . 1 . 2 . 3]"
1 87 GLU 17.779 0.598 10 2 "[ . + . 2 .- 3]"
1 88 VAL 2.601 0.175 11 0 "[ . 1 . 2 . 3]"
1 89 THR 1.775 0.282 15 0 "[ . 1 . 2 . 3]"
1 90 ARG 4.725 0.377 14 0 "[ . 1 . 2 . 3]"
1 91 LEU 6.292 0.655 20 9 "[ * ** * * * + -*. 3]"
1 92 ARG 7.241 0.985 8 2 "[ . + 1 - 2 . 3]"
1 93 GLN 8.153 0.985 8 2 "[ . + 1 - 2 . 3]"
1 94 GLY 0.446 0.178 4 0 "[ . 1 . 2 . 3]"
1 95 TRP 1.495 0.094 16 0 "[ . 1 . 2 . 3]"
1 96 GLY 0.020 0.020 11 0 "[ . 1 . 2 . 3]"
1 97 ALA 0.215 0.066 23 0 "[ . 1 . 2 . 3]"
1 98 TRP 1.652 0.282 15 0 "[ . 1 . 2 . 3]"
1 99 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 100 VAL 2.420 0.222 15 0 "[ . 1 . 2 . 3]"
1 101 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 102 ALA 0.614 0.087 6 0 "[ . 1 . 2 . 3]"
1 103 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 104 ARG 6.026 0.862 14 2 "[ - . 1 +. 2 . 3]"
1 105 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 106 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 107 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 108 ARG 0.095 0.044 29 0 "[ . 1 . 2 . 3]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 ASN H1 1 1 ASN HA 2.700 . 3.600 2.514 2.336 2.949 . 0 0 "[ . 1 . 2 . 3]" 1
2 1 1 ASN H1 1 1 ASN HB2 2.800 . 6.000 3.606 2.537 4.199 . 0 0 "[ . 1 . 2 . 3]" 1
3 1 1 ASN H1 1 2 VAL H 3.400 . 4.900 3.580 3.070 3.841 . 0 0 "[ . 1 . 2 . 3]" 1
4 1 1 ASN HA 1 1 ASN HB2 2.600 . 3.500 2.856 2.367 3.030 . 0 0 "[ . 1 . 2 . 3]" 1
5 1 1 ASN HA 1 2 VAL H 2.200 . 2.800 2.128 2.064 2.173 . 0 0 "[ . 1 . 2 . 3]" 1
6 1 1 ASN HB2 1 2 VAL H 3.700 . 5.400 4.079 3.101 4.499 . 0 0 "[ . 1 . 2 . 3]" 1
7 1 1 ASN HB3 1 1 ASN HD21 2.800 . 3.800 2.800 2.195 3.465 . 0 0 "[ . 1 . 2 . 3]" 1
8 1 1 ASN HB3 1 1 ASN HD22 4.000 . 6.000 3.732 3.465 4.044 . 0 0 "[ . 1 . 2 . 3]" 1
9 1 2 VAL H 1 2 VAL HA 2.700 . 3.600 2.850 2.244 2.937 . 0 0 "[ . 1 . 2 . 3]" 1
10 1 2 VAL H 1 2 VAL HB 2.400 . 3.100 2.648 2.506 3.266 0.166 13 0 "[ . 1 . 2 . 3]" 1
11 1 2 VAL H 1 2 VAL MG2 2.600 . 6.000 3.092 1.963 3.871 . 0 0 "[ . 1 . 2 . 3]" 1
12 1 2 VAL H 1 3 VAL H 3.100 . 4.300 2.552 2.020 3.554 . 0 0 "[ . 1 . 2 . 3]" 1
13 1 3 VAL H 1 3 VAL HB 2.200 . 2.800 2.559 2.485 2.659 . 0 0 "[ . 1 . 2 . 3]" 1
14 1 3 VAL H 1 3 VAL MG2 2.400 . 6.000 2.928 1.943 3.787 . 0 0 "[ . 1 . 2 . 3]" 1
15 1 3 VAL HA 1 3 VAL HB 2.500 . 3.300 2.722 2.390 3.022 . 0 0 "[ . 1 . 2 . 3]" 1
16 1 3 VAL HA 1 3 VAL MG2 1.700 . 6.000 2.395 2.340 2.449 . 0 0 "[ . 1 . 2 . 3]" 1
17 1 3 VAL HA 1 4 VAL H 1.900 . 2.400 2.176 2.105 2.315 . 0 0 "[ . 1 . 2 . 3]" 1
18 1 4 VAL H 1 4 VAL HB 2.400 . 3.100 2.703 2.593 2.915 . 0 0 "[ . 1 . 2 . 3]" 1
19 1 4 VAL H 1 4 VAL MG2 2.500 . 6.000 2.535 1.879 3.861 . 0 0 "[ . 1 . 2 . 3]" 1
20 1 4 VAL HA 1 4 VAL HB 2.600 . 3.500 2.869 2.359 3.029 . 0 0 "[ . 1 . 2 . 3]" 1
21 1 4 VAL HA 1 4 VAL MG2 2.200 . 6.000 2.492 2.177 2.547 . 0 0 "[ . 1 . 2 . 3]" 1
22 1 4 VAL HA 1 5 THR H 1.900 . 2.400 2.223 2.131 2.300 . 0 0 "[ . 1 . 2 . 3]" 1
23 1 4 VAL HB 1 5 THR H 3.400 . 4.800 3.753 3.628 3.920 . 0 0 "[ . 1 . 2 . 3]" 1
24 1 4 VAL MG1 1 5 THR H 2.800 . 3.800 2.552 1.972 3.922 0.122 6 0 "[ . 1 . 2 . 3]" 1
25 1 5 THR H 1 5 THR HA 2.700 . 3.600 2.920 2.865 2.949 . 0 0 "[ . 1 . 2 . 3]" 1
26 1 5 THR H 1 5 THR MG 2.900 . 3.900 2.807 1.879 3.275 0.021 13 0 "[ . 1 . 2 . 3]" 1
27 1 5 THR H 1 6 PRO HD2 5.200 . 6.000 5.191 4.663 5.411 . 0 0 "[ . 1 . 2 . 3]" 1
28 1 5 THR HA 1 5 THR MG 2.800 . 3.800 2.387 2.201 3.224 . 0 0 "[ . 1 . 2 . 3]" 1
29 1 5 THR HA 1 6 PRO HD2 2.800 . 3.800 2.570 1.893 2.758 . 0 0 "[ . 1 . 2 . 3]" 1
30 1 5 THR HA 1 6 PRO HD3 2.200 . 2.800 1.912 1.740 2.460 . 0 0 "[ . 1 . 2 . 3]" 1
31 1 5 THR HB 1 5 THR MG 2.100 . 2.600 2.134 2.131 2.136 . 0 0 "[ . 1 . 2 . 3]" 1
32 1 5 THR HB 1 6 PRO HD3 3.600 . 5.200 4.093 3.706 4.685 . 0 0 "[ . 1 . 2 . 3]" 1
33 1 6 PRO HA 1 7 ALA H 2.100 . 2.600 2.255 2.010 2.526 . 0 0 "[ . 1 . 2 . 3]" 1
34 1 6 PRO HB2 1 7 ALA H 3.100 . 4.300 3.034 2.346 4.161 . 0 0 "[ . 1 . 2 . 3]" 1
35 1 6 PRO HB3 1 7 ALA H 3.500 . 5.000 3.309 2.636 4.241 . 0 0 "[ . 1 . 2 . 3]" 1
36 1 6 PRO HD3 1 7 ALA H 3.300 . 6.000 5.577 5.141 5.712 . 0 0 "[ . 1 . 2 . 3]" 1
37 1 6 PRO HG2 1 7 ALA H 5.000 . 6.000 4.926 4.293 5.655 . 0 0 "[ . 1 . 2 . 3]" 1
38 1 7 ALA H 1 7 ALA HA 2.700 . 3.600 2.702 2.263 2.942 . 0 0 "[ . 1 . 2 . 3]" 1
39 1 7 ALA H 1 7 ALA MB 2.400 . 3.100 2.559 2.268 2.921 . 0 0 "[ . 1 . 2 . 3]" 1
40 1 7 ALA HA 1 7 ALA MB 1.900 . 6.000 2.125 2.109 2.139 . 0 0 "[ . 1 . 2 . 3]" 1
41 1 7 ALA MB 1 8 HIS H 2.900 . 4.000 3.078 1.786 3.650 0.014 18 0 "[ . 1 . 2 . 3]" 1
42 1 8 HIS H 1 8 HIS HA 2.700 . 3.600 2.687 2.253 2.932 . 0 0 "[ . 1 . 2 . 3]" 1
43 1 8 HIS H 1 8 HIS HB3 2.700 . 3.600 3.165 2.367 3.741 0.141 17 0 "[ . 1 . 2 . 3]" 1
44 1 8 HIS H 1 9 GLU HG2 5.200 . 6.000 4.059 2.712 6.190 0.190 8 0 "[ . 1 . 2 . 3]" 1
45 1 8 HIS HA 1 9 GLU H 2.400 . 6.000 3.292 3.076 3.429 . 0 0 "[ . 1 . 2 . 3]" 1
46 1 8 HIS HB2 1 9 GLU H 3.100 . 4.300 3.971 3.082 4.287 . 0 0 "[ . 1 . 2 . 3]" 1
47 1 9 GLU H 1 9 GLU HA 2.700 . 3.600 2.855 2.726 2.940 . 0 0 "[ . 1 . 2 . 3]" 1
48 1 9 GLU H 1 9 GLU HB2 3.200 . 4.500 3.438 2.148 3.746 . 0 0 "[ . 1 . 2 . 3]" 1
49 1 9 GLU H 1 9 GLU HB3 2.300 . 3.000 2.783 2.490 3.493 0.493 11 0 "[ . 1 . 2 . 3]" 1
50 1 9 GLU H 1 9 GLU HG2 2.800 . 3.700 2.354 1.826 4.303 0.603 8 2 "[ . + 1 .- 2 . 3]" 1
51 1 9 GLU HA 1 9 GLU HB2 2.100 . 2.700 2.515 2.407 2.965 0.265 8 0 "[ . 1 . 2 . 3]" 1
52 1 9 GLU HA 1 9 GLU HB3 2.500 . 3.300 2.477 2.389 2.716 . 0 0 "[ . 1 . 2 . 3]" 1
53 1 9 GLU HA 1 9 GLU HG2 3.100 . 4.300 3.608 2.140 3.878 . 0 0 "[ . 1 . 2 . 3]" 1
54 1 9 GLU HA 1 10 ALA H 1.900 . 2.300 2.207 2.094 2.445 0.145 11 0 "[ . 1 . 2 . 3]" 1
55 1 9 GLU HB2 1 10 ALA H 3.000 . 4.100 3.082 2.513 4.450 0.350 16 0 "[ . 1 . 2 . 3]" 1
56 1 9 GLU HB3 1 10 ALA H 4.900 . 6.000 3.884 1.913 4.225 . 0 0 "[ . 1 . 2 . 3]" 1
57 1 9 GLU HG2 1 10 ALA H 4.300 . 6.000 4.811 3.049 5.093 . 0 0 "[ . 1 . 2 . 3]" 1
58 1 9 GLU HG2 1 11 VAL H 3.000 . 6.000 5.089 4.090 5.919 . 0 0 "[ . 1 . 2 . 3]" 1
59 1 10 ALA H 1 10 ALA MB 2.300 . 6.000 2.560 2.300 2.890 . 0 0 "[ . 1 . 2 . 3]" 1
60 1 10 ALA H 1 11 VAL H 2.900 . 3.900 3.187 2.519 3.382 . 0 0 "[ . 1 . 2 . 3]" 1
61 1 10 ALA HA 1 11 VAL H 2.000 . 2.500 2.378 2.274 2.498 . 0 0 "[ . 1 . 2 . 3]" 1
62 1 10 ALA MB 1 11 VAL H 3.300 . 4.600 3.655 3.622 3.675 . 0 0 "[ . 1 . 2 . 3]" 1
63 1 11 VAL H 1 11 VAL HA 2.600 . 3.500 2.832 2.763 2.913 . 0 0 "[ . 1 . 2 . 3]" 1
64 1 11 VAL H 1 11 VAL HB 2.200 . 2.800 2.537 2.465 2.621 . 0 0 "[ . 1 . 2 . 3]" 1
65 1 11 VAL H 1 11 VAL MG2 2.500 . 3.300 2.647 1.937 3.784 0.484 15 0 "[ . 1 . 2 . 3]" 1
66 1 11 VAL H 1 12 VAL H 2.900 . 3.900 2.623 2.253 3.027 . 0 0 "[ . 1 . 2 . 3]" 1
67 1 11 VAL HA 1 11 VAL HB 2.200 . 2.800 2.832 2.420 2.997 0.197 29 0 "[ . 1 . 2 . 3]" 1
68 1 12 VAL H 1 12 VAL HB 2.300 . 2.900 2.872 2.488 3.124 0.224 7 0 "[ . 1 . 2 . 3]" 1
69 1 12 VAL H 1 12 VAL MG2 2.600 . 6.000 3.193 1.893 3.918 . 0 0 "[ . 1 . 2 . 3]" 1
70 1 12 VAL H 1 13 ARG H 3.800 . 5.600 3.530 3.445 3.985 . 0 0 "[ . 1 . 2 . 3]" 1
71 1 12 VAL HA 1 12 VAL MG2 1.800 . 6.000 2.356 2.187 2.458 . 0 0 "[ . 1 . 2 . 3]" 1
72 1 12 VAL HA 1 13 ARG H 1.900 . 2.300 2.176 2.055 2.248 . 0 0 "[ . 1 . 2 . 3]" 1
73 1 12 VAL HB 1 13 ARG H 4.000 . 6.000 4.397 4.315 4.440 . 0 0 "[ . 1 . 2 . 3]" 1
74 1 12 VAL MG1 1 13 ARG H 3.000 . 6.000 3.965 3.291 4.256 . 0 0 "[ . 1 . 2 . 3]" 1
75 1 13 ARG H 1 13 ARG HA 2.500 . 3.300 2.812 2.224 2.920 . 0 0 "[ . 1 . 2 . 3]" 1
76 1 13 ARG H 1 13 ARG HB2 2.700 . 6.000 3.205 2.208 3.903 . 0 0 "[ . 1 . 2 . 3]" 1
77 1 13 ARG H 1 13 ARG HB3 2.500 . 3.300 3.218 2.524 4.023 0.723 19 3 "[ . 1 - . +2* . 3]" 1
78 1 13 ARG H 1 13 ARG HE 5.100 . 6.000 4.403 3.232 4.863 . 0 0 "[ . 1 . 2 . 3]" 1
79 1 13 ARG H 1 14 VAL H 3.900 . 5.800 4.175 3.871 4.467 . 0 0 "[ . 1 . 2 . 3]" 1
80 1 13 ARG HA 1 13 ARG HB2 2.300 . 3.000 2.660 2.371 3.018 0.018 22 0 "[ . 1 . 2 . 3]" 1
81 1 13 ARG HA 1 13 ARG HB3 2.100 . 2.700 2.502 2.370 2.882 0.182 21 0 "[ . 1 . 2 . 3]" 1
82 1 13 ARG HA 1 13 ARG HG3 2.800 . 3.800 3.406 2.320 4.246 0.446 2 0 "[ . 1 . 2 . 3]" 1
83 1 13 ARG HA 1 14 VAL H 1.900 . 2.400 2.084 2.000 2.291 . 0 0 "[ . 1 . 2 . 3]" 1
84 1 13 ARG HB2 1 13 ARG HD2 2.900 . 3.900 3.129 2.426 4.180 0.280 6 0 "[ . 1 . 2 . 3]" 1
85 1 13 ARG HB2 1 14 VAL H 3.200 . 4.500 3.818 2.437 4.471 . 0 0 "[ . 1 . 2 . 3]" 1
86 1 13 ARG HD3 1 13 ARG HE 2.300 . 3.000 2.782 2.466 2.958 . 0 0 "[ . 1 . 2 . 3]" 1
87 1 13 ARG HD3 1 13 ARG HG2 2.200 . 2.800 2.579 2.308 3.016 0.216 26 0 "[ . 1 . 2 . 3]" 1
88 1 13 ARG HG2 1 14 VAL H 4.000 . 6.000 4.661 2.919 5.351 . 0 0 "[ . 1 . 2 . 3]" 1
89 1 13 ARG HG3 1 14 VAL H 4.300 . 6.000 4.593 3.433 5.342 . 0 0 "[ . 1 . 2 . 3]" 1
90 1 14 VAL H 1 14 VAL HA 2.600 . 3.500 2.892 2.655 2.928 . 0 0 "[ . 1 . 2 . 3]" 1
91 1 14 VAL H 1 14 VAL HB 2.400 . 3.100 2.762 2.609 2.866 . 0 0 "[ . 1 . 2 . 3]" 1
92 1 14 VAL H 1 14 VAL MG2 2.400 . 6.000 2.308 1.791 3.785 . 0 0 "[ . 1 . 2 . 3]" 1
93 1 14 VAL H 1 15 GLY H 3.800 . 5.600 4.420 4.338 4.527 . 0 0 "[ . 1 . 2 . 3]" 1
94 1 14 VAL HA 1 14 VAL HB 2.500 . 3.300 2.948 2.328 3.003 . 0 0 "[ . 1 . 2 . 3]" 1
95 1 14 VAL HA 1 15 GLY H 2.000 . 2.500 2.307 2.009 2.410 . 0 0 "[ . 1 . 2 . 3]" 1
96 1 14 VAL HB 1 15 GLY H 3.000 . 4.200 3.347 3.252 4.048 . 0 0 "[ . 1 . 2 . 3]" 1
97 1 14 VAL MG1 1 15 GLY H 2.700 . 3.600 1.958 1.782 4.171 0.571 22 1 "[ . 1 . 2 + . 3]" 1
98 1 14 VAL MG1 1 16 THR H 4.400 . 6.000 3.495 2.429 4.601 . 0 0 "[ . 1 . 2 . 3]" 1
99 1 15 GLY H 1 15 GLY HA2 2.100 . 2.700 2.643 2.308 2.938 0.238 21 0 "[ . 1 . 2 . 3]" 1
100 1 15 GLY H 1 16 THR H 2.800 . 3.800 2.834 2.145 3.256 . 0 0 "[ . 1 . 2 . 3]" 1
101 1 15 GLY H 1 16 THR HA 5.200 . 6.000 4.417 3.942 4.760 . 0 0 "[ . 1 . 2 . 3]" 1
102 1 15 GLY HA2 1 16 THR H 2.000 . 2.500 2.535 2.184 3.497 0.997 1 5 "[+ * - * . 2* . 3]" 1
103 1 15 GLY HA2 1 16 THR HB 3.000 . 6.000 4.941 4.449 5.989 . 0 0 "[ . 1 . 2 . 3]" 1
104 1 15 GLY HA3 1 17 LYS H 4.100 . 6.000 4.355 3.536 4.997 . 0 0 "[ . 1 . 2 . 3]" 1
105 1 16 THR H 1 16 THR HA 2.700 . 3.600 2.824 2.180 2.913 . 0 0 "[ . 1 . 2 . 3]" 1
106 1 16 THR H 1 16 THR HB 2.500 . 3.300 2.623 2.436 3.338 0.038 3 0 "[ . 1 . 2 . 3]" 1
107 1 16 THR H 1 16 THR MG 3.400 . 4.800 3.728 3.615 3.942 . 0 0 "[ . 1 . 2 . 3]" 1
108 1 16 THR H 1 17 LYS H 2.800 . 3.700 2.358 1.887 3.197 0.013 27 0 "[ . 1 . 2 . 3]" 1
109 1 16 THR HA 1 16 THR HB 2.800 . 3.800 3.008 2.956 3.022 . 0 0 "[ . 1 . 2 . 3]" 1
110 1 16 THR HA 1 16 THR MG 2.400 . 3.100 2.317 2.199 2.467 . 0 0 "[ . 1 . 2 . 3]" 1
111 1 16 THR HA 1 17 LYS H 2.200 . 6.000 3.425 3.369 3.471 . 0 0 "[ . 1 . 2 . 3]" 1
112 1 16 THR HB 1 16 THR MG 2.100 . 2.700 2.125 2.116 2.133 . 0 0 "[ . 1 . 2 . 3]" 1
113 1 16 THR HB 1 17 LYS H 2.800 . 3.800 2.726 1.857 3.072 . 0 0 "[ . 1 . 2 . 3]" 1
114 1 16 THR HB 1 17 LYS HB2 4.200 . 6.000 5.153 4.250 5.883 . 0 0 "[ . 1 . 2 . 3]" 1
115 1 16 THR MG 1 17 LYS H 3.300 . 6.000 3.706 3.103 3.877 . 0 0 "[ . 1 . 2 . 3]" 1
116 1 17 LYS H 1 17 LYS HB2 2.400 . 3.100 2.996 2.437 3.844 0.744 4 3 "[ *+. 1- . 2 . 3]" 1
117 1 17 LYS H 1 17 LYS QD 2.200 . 2.800 2.439 1.742 2.864 0.064 14 0 "[ . 1 . 2 . 3]" 1
118 1 17 LYS H 1 17 LYS HG2 2.800 . 3.800 3.151 1.830 4.392 0.592 22 4 "[ . 1 . 2 + -* *3]" 1
119 1 17 LYS H 1 18 PRO HD2 4.000 . 6.000 4.726 3.585 5.298 . 0 0 "[ . 1 . 2 . 3]" 1
120 1 17 LYS H 1 18 PRO HD3 4.400 . 6.000 3.574 2.234 4.434 . 0 0 "[ . 1 . 2 . 3]" 1
121 1 17 LYS HA 1 17 LYS QD 2.800 . 3.700 2.775 1.836 3.754 0.064 6 0 "[ . 1 . 2 . 3]" 1
122 1 17 LYS HA 1 17 LYS HE2 3.400 . 4.800 4.554 2.205 5.646 0.846 19 3 "[ . 1 . +2 * . -3]" 1
123 1 17 LYS HA 1 17 LYS HG2 3.600 . 5.200 3.511 3.046 4.184 . 0 0 "[ . 1 . 2 . 3]" 1
124 1 17 LYS HA 1 18 PRO HD2 2.400 . 3.100 2.545 1.961 2.904 . 0 0 "[ . 1 . 2 . 3]" 1
125 1 17 LYS HA 1 18 PRO HD3 2.300 . 3.000 2.130 1.776 2.675 . 0 0 "[ . 1 . 2 . 3]" 1
126 1 18 PRO HA 1 18 PRO HB2 2.400 . 3.100 2.885 2.646 3.011 . 0 0 "[ . 1 . 2 . 3]" 1
127 1 18 PRO HA 1 18 PRO HB3 2.400 . 3.100 2.275 2.251 2.347 . 0 0 "[ . 1 . 2 . 3]" 1
128 1 18 PRO HA 1 19 GLY H 2.000 . 2.500 2.232 1.997 2.496 . 0 0 "[ . 1 . 2 . 3]" 1
129 1 18 PRO HA 1 20 THR H 4.100 . 6.000 3.821 3.063 4.098 . 0 0 "[ . 1 . 2 . 3]" 1
130 1 18 PRO HB2 1 19 GLY H 3.000 . 4.100 3.139 2.605 4.170 0.070 5 0 "[ . 1 . 2 . 3]" 1
131 1 18 PRO HB3 1 19 GLY H 3.100 . 4.300 3.167 2.672 4.156 . 0 0 "[ . 1 . 2 . 3]" 1
132 1 18 PRO HD2 1 18 PRO HG3 2.100 . 2.700 2.969 2.696 3.015 0.315 2 0 "[ . 1 . 2 . 3]" 1
133 1 18 PRO HD3 1 19 GLY H 4.200 . 6.000 5.605 5.129 5.722 . 0 0 "[ . 1 . 2 . 3]" 1
134 1 18 PRO HG2 1 19 GLY H 4.600 . 6.000 5.032 4.634 5.636 . 0 0 "[ . 1 . 2 . 3]" 1
135 1 19 GLY H 1 20 THR H 2.600 . 3.500 2.376 1.893 3.014 . 0 0 "[ . 1 . 2 . 3]" 1
136 1 19 GLY HA2 1 20 THR H 2.200 . 2.800 3.012 2.534 3.547 0.747 13 10 "[ **** *1 -+ ** 2 *. 3]" 1
137 1 19 GLY HA2 1 21 GLU H 3.600 . 5.200 3.772 3.062 4.589 . 0 0 "[ . 1 . 2 . 3]" 1
138 1 20 THR H 1 20 THR HA 2.700 . 3.600 2.813 2.762 2.850 . 0 0 "[ . 1 . 2 . 3]" 1
139 1 20 THR H 1 20 THR HB 2.700 . 3.600 2.652 2.467 2.902 . 0 0 "[ . 1 . 2 . 3]" 1
140 1 20 THR H 1 20 THR MG 3.200 . 4.500 3.711 3.631 3.759 . 0 0 "[ . 1 . 2 . 3]" 1
141 1 20 THR H 1 21 GLU H 2.400 . 3.100 2.611 2.400 2.892 . 0 0 "[ . 1 . 2 . 3]" 1
142 1 20 THR HA 1 20 THR MG 2.200 . 2.800 2.305 2.212 2.401 . 0 0 "[ . 1 . 2 . 3]" 1
143 1 20 THR HB 1 20 THR MG 2.100 . 2.700 2.130 2.122 2.136 . 0 0 "[ . 1 . 2 . 3]" 1
144 1 20 THR HB 1 21 GLU H 2.800 . 3.800 2.592 2.202 2.875 . 0 0 "[ . 1 . 2 . 3]" 1
145 1 20 THR MG 1 21 GLU H 3.300 . 4.700 3.675 3.407 3.799 . 0 0 "[ . 1 . 2 . 3]" 1
146 1 21 GLU H 1 21 GLU HB2 2.400 . 3.100 2.942 2.514 3.796 0.696 27 4 "[ .- *1 . 2 . + *3]" 1
147 1 21 GLU H 1 21 GLU HB3 2.500 . 6.000 3.643 2.718 3.968 . 0 0 "[ . 1 . 2 . 3]" 1
148 1 21 GLU H 1 21 GLU HG3 2.700 . 3.600 3.103 2.374 3.696 0.096 4 0 "[ . 1 . 2 . 3]" 1
149 1 21 GLU H 1 22 VAL H 3.400 . 4.900 4.075 3.346 4.360 . 0 0 "[ . 1 . 2 . 3]" 1
150 1 21 GLU HA 1 22 VAL H 1.900 . 2.400 2.170 1.990 2.313 . 0 0 "[ . 1 . 2 . 3]" 1
151 1 21 GLU HB3 1 22 VAL H 3.800 . 5.600 3.530 2.785 4.411 . 0 0 "[ . 1 . 2 . 3]" 1
152 1 21 GLU HG3 1 22 VAL H 4.300 . 6.000 4.859 3.685 5.242 . 0 0 "[ . 1 . 2 . 3]" 1
153 1 22 VAL H 1 22 VAL HA 2.600 . 3.500 2.881 2.840 2.945 . 0 0 "[ . 1 . 2 . 3]" 1
154 1 22 VAL H 1 22 VAL HB 2.200 . 2.800 2.583 2.433 2.834 0.034 12 0 "[ . 1 . 2 . 3]" 1
155 1 22 VAL H 1 22 VAL MG2 2.400 . 6.000 2.435 1.938 3.781 . 0 0 "[ . 1 . 2 . 3]" 1
156 1 22 VAL H 1 23 PRO HD2 6.000 . 6.000 5.134 4.924 5.270 . 0 0 "[ . 1 . 2 . 3]" 1
157 1 22 VAL H 1 23 PRO HD3 4.800 . 6.000 4.378 4.050 4.665 . 0 0 "[ . 1 . 2 . 3]" 1
158 1 22 VAL HA 1 22 VAL MG2 2.300 . 6.000 2.420 2.323 2.460 . 0 0 "[ . 1 . 2 . 3]" 1
159 1 22 VAL MG2 1 23 PRO HD2 4.100 . 6.000 3.775 2.029 4.276 . 0 0 "[ . 1 . 2 . 3]" 1
160 1 23 PRO HA 1 23 PRO HD2 2.800 . 6.000 3.911 3.866 3.934 . 0 0 "[ . 1 . 2 . 3]" 1
161 1 23 PRO HA 1 23 PRO HD3 2.700 . 3.600 3.665 3.617 3.786 0.186 26 0 "[ . 1 . 2 . 3]" 1
162 1 23 PRO HD2 1 23 PRO HG2 1.700 . 2.200 2.291 2.279 2.311 0.111 8 0 "[ . 1 . 2 . 3]" 1
163 1 24 PRO HA 1 24 PRO HD2 2.100 . 6.000 3.999 3.806 4.040 . 0 0 "[ . 1 . 2 . 3]" 1
164 1 24 PRO HA 1 24 PRO HD3 2.700 . 3.600 3.241 3.173 3.713 0.113 3 0 "[ . 1 . 2 . 3]" 1
165 1 24 PRO HA 1 25 VAL H 2.100 . 2.700 2.149 2.073 2.356 . 0 0 "[ . 1 . 2 . 3]" 1
166 1 24 PRO HB2 1 25 VAL H 3.200 . 4.400 3.240 2.697 3.702 . 0 0 "[ . 1 . 2 . 3]" 1
167 1 24 PRO HB3 1 24 PRO HD3 3.900 . 5.800 2.926 2.750 4.019 . 0 0 "[ . 1 . 2 . 3]" 1
168 1 24 PRO HB3 1 25 VAL H 3.200 . 4.500 3.557 3.249 3.667 . 0 0 "[ . 1 . 2 . 3]" 1
169 1 24 PRO HD3 1 25 VAL H 3.800 . 5.600 5.264 5.189 5.631 0.031 3 0 "[ . 1 . 2 . 3]" 1
170 1 25 VAL H 1 25 VAL HA 2.800 . 3.800 2.902 2.854 2.948 . 0 0 "[ . 1 . 2 . 3]" 1
171 1 25 VAL H 1 25 VAL HB 2.300 . 2.900 2.612 2.363 2.864 . 0 0 "[ . 1 . 2 . 3]" 1
172 1 25 VAL H 1 25 VAL MG2 2.500 . 6.000 2.721 2.141 3.826 . 0 0 "[ . 1 . 2 . 3]" 1
173 1 25 VAL H 1 26 ILE H 3.700 . 5.400 4.468 4.356 4.556 . 0 0 "[ . 1 . 2 . 3]" 1
174 1 25 VAL HA 1 26 ILE H 2.100 . 2.700 2.206 2.033 2.475 . 0 0 "[ . 1 . 2 . 3]" 1
175 1 25 VAL HA 1 27 ASP H 4.900 . 6.000 4.042 3.540 4.520 . 0 0 "[ . 1 . 2 . 3]" 1
176 1 25 VAL QG 1 29 SER H 4.900 . 6.000 4.551 3.409 5.703 . 0 0 "[ . 1 . 2 . 3]" 1
177 1 25 VAL QG 1 83 ILE HA 5.700 . 6.000 4.637 4.196 5.124 . 0 0 "[ . 1 . 2 . 3]" 1
178 1 25 VAL MG1 1 26 ILE H 2.700 . 3.600 2.697 1.796 4.257 0.657 19 1 "[ . 1 . +2 . 3]" 1
179 1 25 VAL MG1 1 27 ASP H 3.700 . 5.500 2.504 1.788 5.208 0.112 2 0 "[ . 1 . 2 . 3]" 1
180 1 25 VAL MG1 1 28 GLY H 3.000 . 4.100 2.841 1.907 4.188 0.088 19 0 "[ . 1 . 2 . 3]" 1
181 1 25 VAL MG1 1 28 GLY HA3 2.400 . 6.000 3.575 1.738 4.728 . 0 0 "[ . 1 . 2 . 3]" 1
182 1 25 VAL MG1 1 80 GLU HA 4.100 . 6.000 4.735 3.484 6.062 0.062 14 0 "[ . 1 . 2 . 3]" 1
183 1 26 ILE H 1 26 ILE HA 2.800 . 3.800 2.819 2.753 2.897 . 0 0 "[ . 1 . 2 . 3]" 1
184 1 26 ILE H 1 26 ILE HB 2.400 . 3.100 2.547 2.389 2.654 . 0 0 "[ . 1 . 2 . 3]" 1
185 1 26 ILE H 1 26 ILE MD 3.000 . 4.100 2.838 1.820 3.323 0.080 10 0 "[ . 1 . 2 . 3]" 1
186 1 26 ILE H 1 26 ILE HG12 2.900 . 4.000 2.440 1.877 3.949 . 0 0 "[ . 1 . 2 . 3]" 1
187 1 26 ILE H 1 27 ASP H 3.400 . 4.900 2.620 2.332 2.893 . 0 0 "[ . 1 . 2 . 3]" 1
188 1 26 ILE HA 1 26 ILE MD 2.300 . 3.000 2.223 1.958 3.026 0.026 2 0 "[ . 1 . 2 . 3]" 1
189 1 26 ILE HA 1 27 ASP H 2.500 . 6.000 3.460 3.405 3.529 . 0 0 "[ . 1 . 2 . 3]" 1
190 1 26 ILE HA 1 28 GLY H 4.300 . 6.000 3.785 3.401 4.402 . 0 0 "[ . 1 . 2 . 3]" 1
191 1 26 ILE HB 1 27 ASP H 3.100 . 4.300 2.946 2.426 3.121 . 0 0 "[ . 1 . 2 . 3]" 1
192 1 26 ILE HB 1 27 ASP HB2 6.000 . 6.000 4.696 3.749 5.184 . 0 0 "[ . 1 . 2 . 3]" 1
193 1 26 ILE HG12 1 27 ASP H 5.500 . 6.000 4.483 4.032 5.448 . 0 0 "[ . 1 . 2 . 3]" 1
194 1 27 ASP H 1 27 ASP HA 2.600 . 3.500 2.904 2.857 2.935 . 0 0 "[ . 1 . 2 . 3]" 1
195 1 27 ASP H 1 27 ASP HB3 3.000 . 4.100 3.641 2.654 3.795 . 0 0 "[ . 1 . 2 . 3]" 1
196 1 27 ASP H 1 28 GLY H 2.700 . 3.600 2.194 1.894 2.410 . 0 0 "[ . 1 . 2 . 3]" 1
197 1 27 ASP H 1 29 SER H 4.700 . 6.000 4.154 3.911 4.344 . 0 0 "[ . 1 . 2 . 3]" 1
198 1 27 ASP H 1 31 TRP HD1 3.900 . 5.800 4.361 3.899 4.513 . 0 0 "[ . 1 . 2 . 3]" 1
199 1 27 ASP HA 1 28 GLY H 2.400 . 3.100 3.140 2.826 3.252 0.152 23 0 "[ . 1 . 2 . 3]" 1
200 1 27 ASP HA 1 29 SER H 3.400 . 4.800 3.020 2.788 3.326 . 0 0 "[ . 1 . 2 . 3]" 1
201 1 27 ASP HB2 1 90 ARG HD3 4.900 . 6.000 5.133 3.939 6.069 0.069 18 0 "[ . 1 . 2 . 3]" 1
202 1 27 ASP HB3 1 28 GLY H 3.800 . 5.600 4.205 3.079 4.436 . 0 0 "[ . 1 . 2 . 3]" 1
203 1 27 ASP HB3 1 29 SER H 3.400 . 4.800 4.630 4.217 4.855 0.055 29 0 "[ . 1 . 2 . 3]" 1
204 1 27 ASP HB3 1 31 TRP HE1 5.000 . 6.000 3.390 2.502 4.992 . 0 0 "[ . 1 . 2 . 3]" 1
205 1 28 GLY H 1 29 SER H 2.400 . 3.100 2.503 2.426 2.596 . 0 0 "[ . 1 . 2 . 3]" 1
206 1 28 GLY H 1 31 TRP H 4.600 . 6.000 4.662 4.505 4.786 . 0 0 "[ . 1 . 2 . 3]" 1
207 1 28 GLY HA3 1 31 TRP HE1 6.000 . 6.000 5.934 5.327 6.408 0.408 26 0 "[ . 1 . 2 . 3]" 1
208 1 29 SER H 1 29 SER HA 2.600 . 3.400 2.876 2.852 2.889 . 0 0 "[ . 1 . 2 . 3]" 1
209 1 29 SER H 1 29 SER HB3 2.700 . 3.600 3.540 2.587 3.621 0.021 28 0 "[ . 1 . 2 . 3]" 1
210 1 29 SER H 1 30 ILE H 2.600 . 3.400 2.370 2.286 2.482 . 0 0 "[ . 1 . 2 . 3]" 1
211 1 29 SER H 1 30 ILE HB 5.400 . 6.000 5.241 5.045 5.957 . 0 0 "[ . 1 . 2 . 3]" 1
212 1 29 SER H 1 30 ILE HG13 6.000 . 6.000 4.899 3.359 5.249 . 0 0 "[ . 1 . 2 . 3]" 1
213 1 29 SER H 1 31 TRP H 4.000 . 6.000 3.526 3.322 3.626 . 0 0 "[ . 1 . 2 . 3]" 1
214 1 29 SER HA 1 29 SER HB3 2.200 . 6.000 2.423 2.352 3.005 . 0 0 "[ . 1 . 2 . 3]" 1
215 1 29 SER HA 1 30 ILE H 2.900 . 4.000 3.472 3.447 3.508 . 0 0 "[ . 1 . 2 . 3]" 1
216 1 29 SER HB2 1 30 ILE H 2.500 . 6.000 2.564 2.304 3.739 . 0 0 "[ . 1 . 2 . 3]" 1
217 1 29 SER HB2 1 30 ILE MD 3.000 . 6.000 2.905 2.044 5.316 . 0 0 "[ . 1 . 2 . 3]" 1
218 1 29 SER HB2 1 31 TRP H 4.300 . 6.000 4.697 4.551 5.392 . 0 0 "[ . 1 . 2 . 3]" 1
219 1 29 SER HB2 1 32 ASP H 3.400 . 6.000 5.296 5.105 5.460 . 0 0 "[ . 1 . 2 . 3]" 1
220 1 29 SER HB2 1 33 ALA H 5.200 . 6.000 5.558 4.884 5.797 . 0 0 "[ . 1 . 2 . 3]" 1
221 1 30 ILE H 1 30 ILE HA 2.600 . 3.400 2.851 2.816 2.868 . 0 0 "[ . 1 . 2 . 3]" 1
222 1 30 ILE H 1 30 ILE HB 2.800 . 3.800 3.135 3.007 3.565 . 0 0 "[ . 1 . 2 . 3]" 1
223 1 30 ILE H 1 30 ILE MD 3.600 . 5.200 2.493 1.996 3.542 0.004 23 0 "[ . 1 . 2 . 3]" 1
224 1 30 ILE H 1 30 ILE HG12 2.600 . 3.400 1.848 1.782 2.241 0.018 6 0 "[ . 1 . 2 . 3]" 1
225 1 30 ILE H 1 30 ILE HG13 3.800 . 5.600 3.174 1.923 3.406 0.077 18 0 "[ . 1 . 2 . 3]" 1
226 1 30 ILE H 1 30 ILE MG 3.200 . 4.500 3.558 2.266 3.705 . 0 0 "[ . 1 . 2 . 3]" 1
227 1 30 ILE H 1 31 TRP H 2.600 . 3.500 2.355 2.283 2.427 . 0 0 "[ . 1 . 2 . 3]" 1
228 1 30 ILE H 1 32 ASP H 4.500 . 6.000 3.884 3.826 3.955 . 0 0 "[ . 1 . 2 . 3]" 1
229 1 30 ILE H 1 32 ASP HB3 6.000 . 6.000 5.113 4.945 5.246 . 0 0 "[ . 1 . 2 . 3]" 1
230 1 30 ILE H 1 33 ALA MB 5.500 . 6.000 4.738 4.518 4.941 . 0 0 "[ . 1 . 2 . 3]" 1
231 1 30 ILE HA 1 30 ILE HB 2.400 . 3.100 2.921 2.457 2.982 . 0 0 "[ . 1 . 2 . 3]" 1
232 1 30 ILE HA 1 30 ILE MD 3.000 . 6.000 2.912 2.542 4.162 . 0 0 "[ . 1 . 2 . 3]" 1
233 1 30 ILE HA 1 30 ILE HG13 3.100 . 4.300 3.986 3.672 4.135 . 0 0 "[ . 1 . 2 . 3]" 1
234 1 30 ILE HA 1 30 ILE MG 2.300 . 3.000 2.196 2.159 2.313 . 0 0 "[ . 1 . 2 . 3]" 1
235 1 30 ILE HA 1 31 TRP H 3.400 . 4.800 3.463 3.440 3.481 . 0 0 "[ . 1 . 2 . 3]" 1
236 1 30 ILE HA 1 33 ALA H 3.300 . 4.600 3.440 3.035 3.552 . 0 0 "[ . 1 . 2 . 3]" 1
237 1 30 ILE HA 1 33 ALA MB 2.300 . 3.000 2.702 2.315 2.866 . 0 0 "[ . 1 . 2 . 3]" 1
238 1 30 ILE HB 1 31 TRP H 2.800 . 3.800 2.881 2.688 3.750 . 0 0 "[ . 1 . 2 . 3]" 1
239 1 30 ILE MD 1 31 TRP H 4.000 . 6.000 4.116 3.886 4.511 . 0 0 "[ . 1 . 2 . 3]" 1
240 1 30 ILE MD 1 95 TRP HH2 4.600 . 6.000 3.594 1.975 4.351 0.025 16 0 "[ . 1 . 2 . 3]" 1
241 1 30 ILE MD 1 95 TRP HZ2 4.300 . 6.000 4.140 1.982 5.011 0.018 18 0 "[ . 1 . 2 . 3]" 1
242 1 30 ILE HG12 1 31 TRP H 4.400 . 6.000 3.219 2.364 4.140 . 0 0 "[ . 1 . 2 . 3]" 1
243 1 30 ILE HG13 1 31 TRP HD1 4.400 . 6.000 5.440 4.249 5.952 . 0 0 "[ . 1 . 2 . 3]" 1
244 1 30 ILE HG13 1 95 TRP HH2 2.700 . 3.600 2.333 1.783 3.070 0.017 23 0 "[ . 1 . 2 . 3]" 1
245 1 30 ILE HG13 1 95 TRP HZ2 3.000 . 4.100 3.570 2.821 4.164 0.064 1 0 "[ . 1 . 2 . 3]" 1
246 1 30 ILE MG 1 31 TRP H 3.400 . 6.000 4.054 3.913 4.147 . 0 0 "[ . 1 . 2 . 3]" 1
247 1 30 ILE MG 1 95 TRP HH2 3.600 . 5.200 3.169 2.608 4.407 . 0 0 "[ . 1 . 2 . 3]" 1
248 1 30 ILE MG 1 95 TRP HZ2 3.700 . 6.000 4.010 3.593 4.878 . 0 0 "[ . 1 . 2 . 3]" 1
249 1 31 TRP H 1 31 TRP HA 2.700 . 3.600 2.835 2.816 2.861 . 0 0 "[ . 1 . 2 . 3]" 1
250 1 31 TRP H 1 31 TRP QB 2.900 . 3.900 2.355 2.251 2.447 . 0 0 "[ . 1 . 2 . 3]" 1
251 1 31 TRP H 1 32 ASP H 2.700 . 3.600 2.522 2.468 2.570 . 0 0 "[ . 1 . 2 . 3]" 1
252 1 31 TRP H 1 32 ASP HB3 4.400 . 6.000 4.609 4.329 4.816 . 0 0 "[ . 1 . 2 . 3]" 1
253 1 31 TRP H 1 33 ALA H 4.600 . 6.000 3.957 3.822 4.107 . 0 0 "[ . 1 . 2 . 3]" 1
254 1 31 TRP H 1 34 ILE H 4.800 . 6.000 4.575 4.518 4.664 . 0 0 "[ . 1 . 2 . 3]" 1
255 1 31 TRP H 1 105 ALA MB 4.900 . 6.000 4.362 4.277 4.498 . 0 0 "[ . 1 . 2 . 3]" 1
256 1 31 TRP HA 1 31 TRP QB 2.800 . 3.800 2.404 2.367 2.456 . 0 0 "[ . 1 . 2 . 3]" 1
257 1 31 TRP HA 1 31 TRP HD1 4.300 . 6.000 4.586 4.496 4.660 . 0 0 "[ . 1 . 2 . 3]" 1
258 1 31 TRP HA 1 31 TRP HH2 6.000 . 6.000 5.732 5.604 5.862 . 0 0 "[ . 1 . 2 . 3]" 1
259 1 31 TRP HA 1 32 ASP H 3.300 . 4.700 3.507 3.486 3.520 . 0 0 "[ . 1 . 2 . 3]" 1
260 1 31 TRP HA 1 34 ILE HB 2.300 . 3.000 2.657 2.426 2.928 . 0 0 "[ . 1 . 2 . 3]" 1
261 1 31 TRP HA 1 34 ILE MD 3.300 . 4.700 2.647 2.372 3.122 . 0 0 "[ . 1 . 2 . 3]" 1
262 1 31 TRP HA 1 35 ALA H 6.000 . 6.000 3.957 3.771 4.346 . 0 0 "[ . 1 . 2 . 3]" 1
263 1 31 TRP HA 1 55 VAL MG1 3.300 . 4.700 3.047 2.472 3.550 . 0 0 "[ . 1 . 2 . 3]" 1
264 1 31 TRP HA 1 83 ILE HG13 4.200 . 6.000 5.391 4.449 6.044 0.044 10 0 "[ . 1 . 2 . 3]" 1
265 1 31 TRP QB 1 31 TRP HD1 . . 3.500 2.525 2.494 2.555 . 0 0 "[ . 1 . 2 . 3]" 1
266 1 31 TRP QB 1 32 ASP H 3.800 . 5.600 2.742 2.685 2.806 . 0 0 "[ . 1 . 2 . 3]" 1
267 1 31 TRP QB 1 33 ALA H 6.000 . 6.000 4.759 4.668 4.881 . 0 0 "[ . 1 . 2 . 3]" 1
268 1 31 TRP QB 1 43 TRP HH2 3.500 . 4.500 2.703 2.416 2.990 . 0 0 "[ . 1 . 2 . 3]" 1
269 1 31 TRP QB 1 43 TRP HZ2 5.200 . 6.000 4.330 3.944 4.613 . 0 0 "[ . 1 . 2 . 3]" 1
270 1 31 TRP QB 1 55 VAL MG1 3.100 . 6.000 3.199 2.052 3.830 . 0 0 "[ . 1 . 2 . 3]" 1
271 1 31 TRP QB 1 79 ARG HB3 5.100 . 6.000 5.008 4.575 6.432 0.432 10 0 "[ . 1 . 2 . 3]" 1
272 1 31 TRP QB 1 83 ILE HG13 2.400 . 3.100 2.681 2.101 3.140 0.040 10 0 "[ . 1 . 2 . 3]" 1
273 1 31 TRP HD1 1 83 ILE HG13 3.500 . 5.000 3.827 1.996 4.202 0.004 26 0 "[ . 1 . 2 . 3]" 1
274 1 31 TRP HD1 1 83 ILE MG 2.500 . 6.000 1.963 1.702 2.770 . 0 0 "[ . 1 . 2 . 3]" 1
275 1 31 TRP HE1 1 83 ILE MG 3.800 . 5.700 2.851 2.488 3.129 . 0 0 "[ . 1 . 2 . 3]" 1
276 1 31 TRP HE1 1 87 GLU HA 4.400 . 6.000 3.228 2.579 3.682 . 0 0 "[ . 1 . 2 . 3]" 1
277 1 31 TRP HE1 1 87 GLU HB2 6.000 . 6.000 4.213 2.436 5.429 . 0 0 "[ . 1 . 2 . 3]" 1
278 1 31 TRP HE1 1 87 GLU HG2 2.900 . 4.000 3.423 2.194 4.170 0.170 14 0 "[ . 1 . 2 . 3]" 1
279 1 31 TRP HE1 1 90 ARG HB2 4.800 . 6.000 5.469 5.277 5.664 . 0 0 "[ . 1 . 2 . 3]" 1
280 1 31 TRP HE3 1 83 ILE HG13 5.800 . 6.000 5.711 4.594 6.457 0.457 10 0 "[ . 1 . 2 . 3]" 1
281 1 31 TRP HE3 1 86 ALA MB 3.400 . 4.900 3.460 3.215 3.689 . 0 0 "[ . 1 . 2 . 3]" 1
282 1 31 TRP HH2 1 34 ILE MD 4.700 . 6.000 3.919 3.663 4.105 . 0 0 "[ . 1 . 2 . 3]" 1
283 1 31 TRP HZ2 1 87 GLU H 4.400 . 6.000 4.288 3.765 4.540 . 0 0 "[ . 1 . 2 . 3]" 1
284 1 31 TRP HZ2 1 87 GLU HA 2.300 . 3.000 2.500 1.739 3.060 0.060 11 0 "[ . 1 . 2 . 3]" 1
285 1 31 TRP HZ2 1 88 VAL H 3.000 . 6.000 5.621 5.023 6.040 0.040 28 0 "[ . 1 . 2 . 3]" 1
286 1 31 TRP HZ2 1 90 ARG HB3 3.200 . 4.500 1.943 1.840 2.106 0.060 12 0 "[ . 1 . 2 . 3]" 1
287 1 31 TRP HZ2 1 90 ARG HG3 2.700 . 3.600 3.410 2.721 3.859 0.259 10 0 "[ . 1 . 2 . 3]" 1
288 1 31 TRP HZ3 1 34 ILE MD 3.000 . 4.100 2.398 1.959 2.642 . 0 0 "[ . 1 . 2 . 3]" 1
289 1 32 ASP H 1 32 ASP HA 3.000 . 4.100 2.856 2.836 2.876 . 0 0 "[ . 1 . 2 . 3]" 1
290 1 32 ASP H 1 32 ASP HB3 2.400 . 3.100 2.335 2.072 2.488 . 0 0 "[ . 1 . 2 . 3]" 1
291 1 32 ASP H 1 33 ALA H 2.600 . 3.500 2.496 2.444 2.576 . 0 0 "[ . 1 . 2 . 3]" 1
292 1 32 ASP H 1 33 ALA HA 5.900 . 6.000 5.098 5.059 5.151 . 0 0 "[ . 1 . 2 . 3]" 1
293 1 32 ASP H 1 33 ALA MB 4.400 . 6.000 4.226 4.166 4.301 . 0 0 "[ . 1 . 2 . 3]" 1
294 1 32 ASP H 1 43 TRP HZ2 4.400 . 6.000 4.111 3.791 4.264 . 0 0 "[ . 1 . 2 . 3]" 1
295 1 32 ASP HA 1 33 ALA H 3.500 . 5.000 3.550 3.525 3.576 . 0 0 "[ . 1 . 2 . 3]" 1
296 1 32 ASP HA 1 34 ILE H 6.000 . 6.000 4.320 4.159 4.448 . 0 0 "[ . 1 . 2 . 3]" 1
297 1 32 ASP HA 1 35 ALA H 4.500 . 6.000 3.239 2.969 3.525 . 0 0 "[ . 1 . 2 . 3]" 1
298 1 32 ASP HA 1 35 ALA MB 2.700 . 3.600 2.347 2.063 2.849 . 0 0 "[ . 1 . 2 . 3]" 1
299 1 32 ASP HA 1 43 TRP HE1 4.600 . 6.000 3.991 3.530 4.222 . 0 0 "[ . 1 . 2 . 3]" 1
300 1 32 ASP HA 1 43 TRP HZ2 2.400 . 3.100 1.940 1.668 2.254 0.032 14 0 "[ . 1 . 2 . 3]" 1
301 1 32 ASP HB2 1 43 TRP HZ2 4.400 . 6.000 2.569 1.942 3.059 0.058 10 0 "[ . 1 . 2 . 3]" 1
302 1 32 ASP HB2 1 79 ARG HA 4.000 . 6.000 6.091 5.921 6.197 0.197 17 0 "[ . 1 . 2 . 3]" 1
303 1 32 ASP HB2 1 79 ARG QD 3.300 . 4.600 4.241 3.120 4.508 . 0 0 "[ . 1 . 2 . 3]" 1
304 1 32 ASP HB3 1 33 ALA H 2.600 . 3.400 2.818 2.591 3.110 . 0 0 "[ . 1 . 2 . 3]" 1
305 1 33 ALA H 1 33 ALA HA 2.700 . 3.600 2.826 2.806 2.833 . 0 0 "[ . 1 . 2 . 3]" 1
306 1 33 ALA H 1 33 ALA MB 2.200 . 2.800 2.248 2.234 2.263 . 0 0 "[ . 1 . 2 . 3]" 1
307 1 33 ALA H 1 34 ILE H 2.700 . 3.600 2.565 2.520 2.622 . 0 0 "[ . 1 . 2 . 3]" 1
308 1 33 ALA H 1 35 ALA H 5.600 . 6.000 4.064 3.924 4.247 . 0 0 "[ . 1 . 2 . 3]" 1
309 1 33 ALA H 1 105 ALA HA 6.000 . 6.000 4.763 4.679 4.857 . 0 0 "[ . 1 . 2 . 3]" 1
310 1 33 ALA H 1 105 ALA MB 4.300 . 6.000 3.419 3.304 3.572 . 0 0 "[ . 1 . 2 . 3]" 1
311 1 33 ALA HA 1 33 ALA MB 2.100 . 2.600 2.124 2.120 2.130 . 0 0 "[ . 1 . 2 . 3]" 1
312 1 33 ALA HA 1 34 ILE H 3.900 . 5.800 3.530 3.511 3.546 . 0 0 "[ . 1 . 2 . 3]" 1
313 1 33 ALA HA 1 36 GLY H 3.100 . 4.300 3.191 3.024 3.411 . 0 0 "[ . 1 . 2 . 3]" 1
314 1 33 ALA HA 1 105 ALA HA 3.600 . 5.200 4.756 4.552 4.893 . 0 0 "[ . 1 . 2 . 3]" 1
315 1 33 ALA MB 1 34 ILE HA 3.300 . 6.000 3.987 3.946 4.025 . 0 0 "[ . 1 . 2 . 3]" 1
316 1 33 ALA MB 1 36 GLY H 4.400 . 6.000 4.404 4.309 4.589 . 0 0 "[ . 1 . 2 . 3]" 1
317 1 34 ILE H 1 34 ILE HB 2.800 . 3.800 2.428 2.347 2.509 . 0 0 "[ . 1 . 2 . 3]" 1
318 1 34 ILE H 1 34 ILE MD 3.400 . 4.800 3.670 3.612 3.871 . 0 0 "[ . 1 . 2 . 3]" 1
319 1 34 ILE H 1 34 ILE HG13 2.600 . 3.400 2.326 2.190 2.474 . 0 0 "[ . 1 . 2 . 3]" 1
320 1 34 ILE H 1 34 ILE MG 4.200 . 6.000 3.759 3.728 3.780 . 0 0 "[ . 1 . 2 . 3]" 1
321 1 34 ILE H 1 35 ALA H 3.200 . 4.500 2.662 2.595 2.739 . 0 0 "[ . 1 . 2 . 3]" 1
322 1 34 ILE H 1 105 ALA MB 4.100 . 6.000 2.694 2.565 2.836 . 0 0 "[ . 1 . 2 . 3]" 1
323 1 34 ILE HA 1 34 ILE MD 3.500 . 5.000 3.793 3.681 3.831 . 0 0 "[ . 1 . 2 . 3]" 1
324 1 34 ILE HA 1 34 ILE HG13 2.800 . 3.800 2.938 2.809 3.103 . 0 0 "[ . 1 . 2 . 3]" 1
325 1 34 ILE HA 1 34 ILE MG 3.300 . 4.700 2.485 2.418 2.566 . 0 0 "[ . 1 . 2 . 3]" 1
326 1 34 ILE HA 1 35 ALA H 3.700 . 5.400 3.549 3.533 3.565 . 0 0 "[ . 1 . 2 . 3]" 1
327 1 34 ILE HA 1 37 CYS H 3.900 . 5.800 3.297 3.115 3.594 . 0 0 "[ . 1 . 2 . 3]" 1
328 1 34 ILE HA 1 37 CYS HB3 3.200 . 4.400 2.389 2.064 2.686 . 0 0 "[ . 1 . 2 . 3]" 1
329 1 34 ILE HA 1 38 GLU H 6.000 . 6.000 4.009 3.656 4.415 . 0 0 "[ . 1 . 2 . 3]" 1
330 1 34 ILE HA 1 101 CYS HA 3.100 . 4.300 3.840 3.551 4.199 . 0 0 "[ . 1 . 2 . 3]" 1
331 1 34 ILE HA 1 101 CYS HB3 2.200 . 2.800 2.008 1.721 2.254 . 0 0 "[ . 1 . 2 . 3]" 1
332 1 34 ILE HA 1 105 ALA MB 3.700 . 5.400 3.213 2.906 3.438 . 0 0 "[ . 1 . 2 . 3]" 1
333 1 34 ILE HB 1 35 ALA H 2.900 . 4.000 2.489 2.384 2.562 . 0 0 "[ . 1 . 2 . 3]" 1
334 1 34 ILE HB 1 36 GLY H 5.500 . 6.000 4.810 4.762 4.850 . 0 0 "[ . 1 . 2 . 3]" 1
335 1 34 ILE MD 1 95 TRP HE3 3.400 . 4.900 2.302 1.906 2.687 . 0 0 "[ . 1 . 2 . 3]" 1
336 1 34 ILE MD 1 95 TRP HH2 5.600 . 6.000 4.496 3.798 4.975 . 0 0 "[ . 1 . 2 . 3]" 1
337 1 34 ILE MD 1 95 TRP HZ3 4.200 . 6.000 2.480 1.906 2.941 0.094 16 0 "[ . 1 . 2 . 3]" 1
338 1 34 ILE MD 1 98 TRP HB2 6.000 . 6.000 3.015 2.801 3.325 . 0 0 "[ . 1 . 2 . 3]" 1
339 1 34 ILE MD 1 98 TRP HE1 5.000 . 6.000 3.967 3.714 4.330 . 0 0 "[ . 1 . 2 . 3]" 1
340 1 34 ILE MD 1 102 ALA HA 2.700 . 3.600 2.294 2.054 2.771 . 0 0 "[ . 1 . 2 . 3]" 1
341 1 34 ILE MG 1 35 ALA H 5.100 . 6.000 3.157 2.944 3.342 . 0 0 "[ . 1 . 2 . 3]" 1
342 1 34 ILE MG 1 37 CYS HB3 4.700 . 6.000 3.406 3.159 3.650 . 0 0 "[ . 1 . 2 . 3]" 1
343 1 35 ALA H 1 35 ALA MB 2.300 . 3.000 2.228 2.217 2.241 . 0 0 "[ . 1 . 2 . 3]" 1
344 1 35 ALA H 1 36 GLY H 3.000 . 4.100 2.649 2.548 2.682 . 0 0 "[ . 1 . 2 . 3]" 1
345 1 35 ALA H 1 36 GLY HA2 6.000 . 6.000 5.290 5.206 5.313 . 0 0 "[ . 1 . 2 . 3]" 1
346 1 35 ALA H 1 36 GLY HA3 6.000 . 6.000 4.960 4.849 4.991 . 0 0 "[ . 1 . 2 . 3]" 1
347 1 35 ALA H 1 55 VAL MG1 3.600 . 6.000 3.669 2.787 4.386 . 0 0 "[ . 1 . 2 . 3]" 1
348 1 35 ALA HA 1 35 ALA MB 2.200 . 2.800 2.127 2.116 2.131 . 0 0 "[ . 1 . 2 . 3]" 1
349 1 35 ALA HA 1 36 GLY H 3.600 . 5.200 3.498 3.481 3.517 . 0 0 "[ . 1 . 2 . 3]" 1
350 1 35 ALA HA 1 39 ALA H 3.100 . 4.300 3.225 3.043 3.460 . 0 0 "[ . 1 . 2 . 3]" 1
351 1 35 ALA HA 1 41 GLY H 6.000 . 6.000 4.339 4.188 4.518 . 0 0 "[ . 1 . 2 . 3]" 1
352 1 35 ALA MB 1 36 GLY H 2.800 . 6.000 2.580 2.486 2.692 . 0 0 "[ . 1 . 2 . 3]" 1
353 1 35 ALA MB 1 37 CYS H 6.000 . 6.000 4.196 4.107 4.336 . 0 0 "[ . 1 . 2 . 3]" 1
354 1 35 ALA MB 1 38 GLU H 4.200 . 6.000 4.955 4.786 5.130 . 0 0 "[ . 1 . 2 . 3]" 1
355 1 35 ALA MB 1 39 ALA H 4.300 . 6.000 4.346 4.248 4.433 . 0 0 "[ . 1 . 2 . 3]" 1
356 1 35 ALA MB 1 41 GLY H 4.300 . 6.000 3.863 3.697 4.090 . 0 0 "[ . 1 . 2 . 3]" 1
357 1 35 ALA MB 1 41 GLY HA3 3.900 . 5.800 4.430 4.177 4.747 . 0 0 "[ . 1 . 2 . 3]" 1
358 1 35 ALA MB 1 43 TRP HE1 3.800 . 5.600 3.075 2.688 3.579 . 0 0 "[ . 1 . 2 . 3]" 1
359 1 35 ALA MB 1 43 TRP HZ2 2.900 . 4.000 2.839 2.552 3.130 . 0 0 "[ . 1 . 2 . 3]" 1
360 1 35 ALA MB 1 54 GLY HA3 5.000 . 6.000 3.568 2.619 4.041 . 0 0 "[ . 1 . 2 . 3]" 1
361 1 35 ALA MB 1 55 VAL H 4.000 . 6.000 3.862 3.287 4.415 . 0 0 "[ . 1 . 2 . 3]" 1
362 1 36 GLY H 1 36 GLY HA2 2.700 . 3.600 2.875 2.838 2.895 . 0 0 "[ . 1 . 2 . 3]" 1
363 1 36 GLY H 1 36 GLY HA3 2.500 . 3.300 2.317 2.306 2.325 . 0 0 "[ . 1 . 2 . 3]" 1
364 1 36 GLY H 1 37 CYS H 2.900 . 3.900 2.491 2.394 2.628 . 0 0 "[ . 1 . 2 . 3]" 1
365 1 36 GLY H 1 37 CYS HB3 4.800 . 6.000 4.496 4.279 4.680 . 0 0 "[ . 1 . 2 . 3]" 1
366 1 36 GLY H 1 38 GLU H 6.000 . 6.000 4.586 4.315 4.831 . 0 0 "[ . 1 . 2 . 3]" 1
367 1 36 GLY H 1 40 GLY H 6.000 . 6.000 5.164 4.857 5.404 . 0 0 "[ . 1 . 2 . 3]" 1
368 1 36 GLY H 1 41 GLY H 5.300 . 6.000 4.333 4.153 4.576 . 0 0 "[ . 1 . 2 . 3]" 1
369 1 36 GLY HA2 1 37 CYS H 3.200 . 4.500 3.358 3.222 3.457 . 0 0 "[ . 1 . 2 . 3]" 1
370 1 36 GLY HA2 1 41 GLY H 2.600 . 3.400 2.303 2.065 2.607 . 0 0 "[ . 1 . 2 . 3]" 1
371 1 36 GLY HA3 1 37 CYS H 3.700 . 5.400 3.111 2.934 3.300 . 0 0 "[ . 1 . 2 . 3]" 1
372 1 36 GLY HA3 1 40 GLY H 4.700 . 6.000 4.821 4.404 5.117 . 0 0 "[ . 1 . 2 . 3]" 1
373 1 36 GLY HA3 1 41 GLY H 4.100 . 6.000 4.020 3.779 4.335 . 0 0 "[ . 1 . 2 . 3]" 1
374 1 37 CYS H 1 37 CYS HA 2.700 . 3.600 2.894 2.846 2.930 . 0 0 "[ . 1 . 2 . 3]" 1
375 1 37 CYS H 1 37 CYS HB3 2.900 . 4.000 2.342 2.143 2.460 . 0 0 "[ . 1 . 2 . 3]" 1
376 1 37 CYS H 1 38 GLU H 3.000 . 4.100 2.509 2.262 2.824 . 0 0 "[ . 1 . 2 . 3]" 1
377 1 37 CYS H 1 101 CYS HB3 4.000 . 6.000 4.264 4.032 4.410 . 0 0 "[ . 1 . 2 . 3]" 1
378 1 37 CYS HA 1 37 CYS HB2 2.900 . 4.000 2.389 2.290 2.442 . 0 0 "[ . 1 . 2 . 3]" 1
379 1 37 CYS HA 1 37 CYS HB3 2.500 . 3.300 3.011 2.968 3.027 . 0 0 "[ . 1 . 2 . 3]" 1
380 1 37 CYS HA 1 38 GLU H 3.100 . 4.300 3.576 3.550 3.600 . 0 0 "[ . 1 . 2 . 3]" 1
381 1 37 CYS HA 1 40 GLY H 4.000 . 6.000 4.209 3.954 4.401 . 0 0 "[ . 1 . 2 . 3]" 1
382 1 37 CYS HB3 1 38 GLU H 4.000 . 6.000 2.409 2.275 2.537 . 0 0 "[ . 1 . 2 . 3]" 1
383 1 37 CYS HB3 1 39 ALA H 3.600 . 5.200 4.512 4.314 4.648 . 0 0 "[ . 1 . 2 . 3]" 1
384 1 37 CYS HB3 1 101 CYS HB3 3.800 . 5.600 2.232 2.031 2.485 . 0 0 "[ . 1 . 2 . 3]" 1
385 1 38 GLU H 1 38 GLU HA 3.000 . 4.100 2.910 2.901 2.930 . 0 0 "[ . 1 . 2 . 3]" 1
386 1 38 GLU H 1 38 GLU HB2 2.600 . 3.400 2.467 2.249 2.755 . 0 0 "[ . 1 . 2 . 3]" 1
387 1 38 GLU H 1 38 GLU HB3 3.400 . 4.900 3.219 2.487 3.670 . 0 0 "[ . 1 . 2 . 3]" 1
388 1 38 GLU H 1 38 GLU HG2 3.700 . 5.400 4.012 2.541 4.692 . 0 0 "[ . 1 . 2 . 3]" 1
389 1 38 GLU H 1 39 ALA H 2.900 . 3.900 2.232 2.190 2.266 . 0 0 "[ . 1 . 2 . 3]" 1
390 1 38 GLU H 1 39 ALA HA 6.000 . 6.000 4.907 4.864 4.925 . 0 0 "[ . 1 . 2 . 3]" 1
391 1 38 GLU H 1 39 ALA MB 5.700 . 6.000 4.064 3.983 4.124 . 0 0 "[ . 1 . 2 . 3]" 1
392 1 38 GLU H 1 40 GLY H 5.500 . 6.000 3.558 3.436 3.724 . 0 0 "[ . 1 . 2 . 3]" 1
393 1 38 GLU H 1 101 CYS HB3 4.500 . 6.000 3.989 3.628 4.314 . 0 0 "[ . 1 . 2 . 3]" 1
394 1 38 GLU HA 1 39 ALA H 3.000 . 4.100 3.482 3.440 3.496 . 0 0 "[ . 1 . 2 . 3]" 1
395 1 38 GLU HB2 1 39 ALA H 3.600 . 5.200 3.343 2.786 4.005 . 0 0 "[ . 1 . 2 . 3]" 1
396 1 38 GLU HB2 1 40 GLY H 5.200 . 6.000 5.178 4.789 5.645 . 0 0 "[ . 1 . 2 . 3]" 1
397 1 38 GLU HB3 1 39 ALA H 3.100 . 4.300 3.379 2.786 3.979 . 0 0 "[ . 1 . 2 . 3]" 1
398 1 39 ALA H 1 39 ALA MB 2.400 . 3.100 2.350 2.289 2.411 . 0 0 "[ . 1 . 2 . 3]" 1
399 1 39 ALA H 1 40 GLY H 2.000 . 2.500 2.218 2.084 2.355 . 0 0 "[ . 1 . 2 . 3]" 1
400 1 39 ALA H 1 40 GLY HA2 5.700 . 6.000 4.532 4.398 4.677 . 0 0 "[ . 1 . 2 . 3]" 1
401 1 39 ALA H 1 41 GLY H 4.200 . 6.000 3.285 3.094 3.545 . 0 0 "[ . 1 . 2 . 3]" 1
402 1 39 ALA H 1 42 ASN H 6.000 . 6.000 4.647 4.481 4.786 . 0 0 "[ . 1 . 2 . 3]" 1
403 1 39 ALA HA 1 39 ALA MB 2.200 . 2.800 2.119 2.114 2.124 . 0 0 "[ . 1 . 2 . 3]" 1
404 1 39 ALA HA 1 40 GLY H 3.300 . 4.600 3.342 3.303 3.392 . 0 0 "[ . 1 . 2 . 3]" 1
405 1 39 ALA HA 1 41 GLY HA2 2.900 . 6.000 6.143 6.086 6.190 0.190 18 0 "[ . 1 . 2 . 3]" 1
406 1 39 ALA HA 1 42 ASN H 5.900 . 6.000 4.594 4.385 4.705 . 0 0 "[ . 1 . 2 . 3]" 1
407 1 39 ALA HA 1 45 ILE MD 2.800 . 3.800 3.122 2.563 3.797 . 0 0 "[ . 1 . 2 . 3]" 1
408 1 39 ALA HA 1 45 ILE MG 3.500 . 5.000 3.124 2.604 3.771 . 0 0 "[ . 1 . 2 . 3]" 1
409 1 39 ALA MB 1 40 GLY H 3.300 . 4.700 3.134 3.027 3.203 . 0 0 "[ . 1 . 2 . 3]" 1
410 1 39 ALA MB 1 41 GLY H 3.000 . 4.200 2.559 2.276 2.745 . 0 0 "[ . 1 . 2 . 3]" 1
411 1 39 ALA MB 1 54 GLY H 3.900 . 5.800 2.646 2.263 3.369 . 0 0 "[ . 1 . 2 . 3]" 1
412 1 39 ALA MB 1 54 GLY HA3 3.700 . 5.400 4.353 3.826 4.917 . 0 0 "[ . 1 . 2 . 3]" 1
413 1 39 ALA MB 1 56 GLN H 5.800 . 6.000 4.076 3.589 5.000 . 0 0 "[ . 1 . 2 . 3]" 1
414 1 40 GLY H 1 40 GLY HA2 2.300 . 2.900 2.326 2.315 2.345 . 0 0 "[ . 1 . 2 . 3]" 1
415 1 40 GLY H 1 40 GLY HA3 2.700 . 3.600 2.891 2.878 2.910 . 0 0 "[ . 1 . 2 . 3]" 1
416 1 40 GLY H 1 41 GLY H 2.800 . 3.800 2.288 2.240 2.366 . 0 0 "[ . 1 . 2 . 3]" 1
417 1 40 GLY H 1 41 GLY HA2 4.400 . 6.000 4.490 4.427 4.537 . 0 0 "[ . 1 . 2 . 3]" 1
418 1 40 GLY H 1 42 ASN H 4.800 . 6.000 4.473 4.353 4.532 . 0 0 "[ . 1 . 2 . 3]" 1
419 1 40 GLY HA2 1 41 GLY H 2.900 . 4.000 3.073 2.957 3.249 . 0 0 "[ . 1 . 2 . 3]" 1
420 1 41 GLY H 1 41 GLY HA2 2.400 . 3.100 2.276 2.254 2.348 . 0 0 "[ . 1 . 2 . 3]" 1
421 1 41 GLY H 1 41 GLY HA3 2.800 . 3.800 2.876 2.830 2.928 . 0 0 "[ . 1 . 2 . 3]" 1
422 1 41 GLY H 1 42 ASN H 2.800 . 3.800 2.633 2.402 2.791 . 0 0 "[ . 1 . 2 . 3]" 1
423 1 41 GLY HA2 1 42 ASN H 2.900 . 4.000 2.548 2.456 2.682 . 0 0 "[ . 1 . 2 . 3]" 1
424 1 41 GLY HA2 1 43 TRP HE1 3.700 . 5.400 3.901 3.366 4.298 . 0 0 "[ . 1 . 2 . 3]" 1
425 1 41 GLY HA3 1 42 ASN H 3.700 . 5.400 3.565 3.546 3.585 . 0 0 "[ . 1 . 2 . 3]" 1
426 1 42 ASN H 1 42 ASN HA 2.800 . 3.800 2.899 2.866 2.927 . 0 0 "[ . 1 . 2 . 3]" 1
427 1 42 ASN H 1 42 ASN HB3 2.600 . 3.400 3.044 2.841 3.754 0.354 25 0 "[ . 1 . 2 . 3]" 1
428 1 42 ASN H 1 43 TRP QB 5.500 . 6.000 5.352 5.224 5.498 . 0 0 "[ . 1 . 2 . 3]" 1
429 1 42 ASN HA 1 42 ASN HB2 2.500 . 3.300 2.605 2.482 2.994 . 0 0 "[ . 1 . 2 . 3]" 1
430 1 42 ASN HA 1 42 ASN HD21 4.700 . 6.000 3.103 1.715 4.441 0.185 1 0 "[ . 1 . 2 . 3]" 1
431 1 42 ASN HA 1 43 TRP H 2.300 . 3.000 2.150 2.072 2.265 . 0 0 "[ . 1 . 2 . 3]" 1
432 1 42 ASN HA 1 44 ALA H 3.000 . 4.100 3.332 3.089 3.580 . 0 0 "[ . 1 . 2 . 3]" 1
433 1 42 ASN HA 1 45 ILE H 6.000 . 6.000 4.546 4.254 4.705 . 0 0 "[ . 1 . 2 . 3]" 1
434 1 42 ASN HB2 1 42 ASN HD21 3.400 . 4.900 3.110 2.209 3.498 . 0 0 "[ . 1 . 2 . 3]" 1
435 1 42 ASN HB2 1 43 TRP H 3.700 . 5.400 4.466 4.185 4.642 . 0 0 "[ . 1 . 2 . 3]" 1
436 1 42 ASN HB2 1 43 TRP HD1 6.000 . 6.000 5.518 5.110 5.955 . 0 0 "[ . 1 . 2 . 3]" 1
437 1 42 ASN HB2 1 44 ALA H 4.300 . 6.000 4.773 4.449 5.069 . 0 0 "[ . 1 . 2 . 3]" 1
438 1 42 ASN HB2 1 45 ILE H 4.600 . 6.000 4.842 4.037 5.215 . 0 0 "[ . 1 . 2 . 3]" 1
439 1 42 ASN HB2 1 45 ILE HA 4.300 . 6.000 5.545 4.841 5.899 . 0 0 "[ . 1 . 2 . 3]" 1
440 1 42 ASN HB2 1 45 ILE QG 3.300 . 4.700 4.595 3.869 5.106 0.406 2 0 "[ . 1 . 2 . 3]" 1
441 1 42 ASN HB2 1 45 ILE MG 4.600 . 6.000 4.320 2.834 5.021 . 0 0 "[ . 1 . 2 . 3]" 1
442 1 42 ASN HB2 1 54 GLY H 2.800 . 6.000 5.562 4.674 5.732 . 0 0 "[ . 1 . 2 . 3]" 1
443 1 42 ASN HB3 1 42 ASN HD21 2.700 . 3.600 2.748 2.223 3.523 . 0 0 "[ . 1 . 2 . 3]" 1
444 1 42 ASN HB3 1 42 ASN HD22 3.600 . 5.200 3.715 3.476 4.071 . 0 0 "[ . 1 . 2 . 3]" 1
445 1 42 ASN HB3 1 43 TRP H 4.100 . 6.000 4.195 3.804 4.382 . 0 0 "[ . 1 . 2 . 3]" 1
446 1 42 ASN HB3 1 45 ILE H 4.700 . 6.000 3.411 2.718 3.716 . 0 0 "[ . 1 . 2 . 3]" 1
447 1 42 ASN HB3 1 45 ILE HB 3.000 . 4.100 1.923 1.470 2.317 0.430 7 0 "[ . 1 . 2 . 3]" 1
448 1 42 ASN HB3 1 45 ILE MD 3.600 . 5.200 2.716 2.467 3.158 . 0 0 "[ . 1 . 2 . 3]" 1
449 1 42 ASN HD21 1 44 ALA MB 4.000 . 6.000 3.624 2.829 4.923 . 0 0 "[ . 1 . 2 . 3]" 1
450 1 42 ASN HD21 1 45 ILE H 3.000 . 4.100 3.399 2.131 4.682 0.582 19 3 "[ . - . +2 * . 3]" 1
451 1 42 ASN HD21 1 45 ILE HA 4.200 . 6.000 3.891 2.452 5.430 . 0 0 "[ . 1 . 2 . 3]" 1
452 1 42 ASN HD21 1 45 ILE HB 4.200 . 6.000 2.929 1.455 4.504 0.545 24 1 "[ . 1 . 2 +. 3]" 1
453 1 42 ASN HD21 1 45 ILE MD 4.100 . 6.000 4.158 2.616 5.539 . 0 0 "[ . 1 . 2 . 3]" 1
454 1 42 ASN HD21 1 45 ILE MG 5.200 . 6.000 4.284 3.158 5.665 . 0 0 "[ . 1 . 2 . 3]" 1
455 1 42 ASN HD22 1 43 TRP H 4.500 . 6.000 4.684 3.968 5.550 . 0 0 "[ . 1 . 2 . 3]" 1
456 1 42 ASN HD22 1 44 ALA H 4.400 . 6.000 3.435 2.838 5.150 . 0 0 "[ . 1 . 2 . 3]" 1
457 1 42 ASN HD22 1 44 ALA MB 3.700 . 5.400 2.940 2.269 4.737 . 0 0 "[ . 1 . 2 . 3]" 1
458 1 42 ASN HD22 1 45 ILE HA 3.900 . 5.800 3.788 2.857 5.540 . 0 0 "[ . 1 . 2 . 3]" 1
459 1 42 ASN HD22 1 45 ILE HG13 4.700 . 6.000 4.330 2.986 5.130 . 0 0 "[ . 1 . 2 . 3]" 1
460 1 43 TRP H 1 43 TRP QB 2.900 . 3.900 2.428 2.354 2.480 . 0 0 "[ . 1 . 2 . 3]" 1
461 1 43 TRP H 1 43 TRP HD1 2.600 . 3.400 2.032 1.793 2.248 0.007 29 0 "[ . 1 . 2 . 3]" 1
462 1 43 TRP H 1 43 TRP HE1 5.900 . 6.000 4.517 4.279 4.708 . 0 0 "[ . 1 . 2 . 3]" 1
463 1 43 TRP H 1 44 ALA H 2.500 . 3.300 2.320 2.084 2.545 . 0 0 "[ . 1 . 2 . 3]" 1
464 1 43 TRP H 1 44 ALA MB 4.200 . 6.000 3.969 3.756 4.174 . 0 0 "[ . 1 . 2 . 3]" 1
465 1 43 TRP H 1 45 ILE H 6.000 . 6.000 4.103 3.707 4.359 . 0 0 "[ . 1 . 2 . 3]" 1
466 1 43 TRP HA 1 43 TRP QB 2.200 . 2.800 2.353 2.333 2.374 . 0 0 "[ . 1 . 2 . 3]" 1
467 1 43 TRP HA 1 43 TRP HD1 4.500 . 6.000 3.768 3.544 3.927 . 0 0 "[ . 1 . 2 . 3]" 1
468 1 43 TRP HA 1 43 TRP HE3 3.600 . 5.200 3.817 3.598 4.068 . 0 0 "[ . 1 . 2 . 3]" 1
469 1 43 TRP HA 1 44 ALA H 2.800 . 3.800 3.286 3.197 3.347 . 0 0 "[ . 1 . 2 . 3]" 1
470 1 43 TRP HA 1 54 GLY H 2.800 . 3.800 2.135 1.901 2.448 . 0 0 "[ . 1 . 2 . 3]" 1
471 1 43 TRP HA 1 82 GLN HE21 5.400 . 6.000 3.885 2.950 4.461 . 0 0 "[ . 1 . 2 . 3]" 1
472 1 43 TRP QB 1 43 TRP HD1 3.400 . 4.800 2.783 2.728 2.885 . 0 0 "[ . 1 . 2 . 3]" 1
473 1 43 TRP QB 1 43 TRP HE3 2.800 . 3.800 2.401 2.346 2.444 . 0 0 "[ . 1 . 2 . 3]" 1
474 1 43 TRP QB 1 44 ALA H 3.500 . 5.000 3.205 3.022 3.375 . 0 0 "[ . 1 . 2 . 3]" 1
475 1 43 TRP QB 1 54 GLY H 6.000 . 6.000 4.219 4.008 4.473 . 0 0 "[ . 1 . 2 . 3]" 1
476 1 43 TRP QB 1 54 GLY HA3 3.300 . 4.700 3.221 3.000 3.739 . 0 0 "[ . 1 . 2 . 3]" 1
477 1 43 TRP QB 1 75 ASP QB 4.600 . 6.000 5.015 4.830 5.397 . 0 0 "[ . 1 . 2 . 3]" 1
478 1 43 TRP QB 1 79 ARG HA 3.600 . 5.200 4.210 3.711 4.935 . 0 0 "[ . 1 . 2 . 3]" 1
479 1 43 TRP QB 1 82 GLN HE21 6.000 . 6.000 2.569 2.105 3.378 . 0 0 "[ . 1 . 2 . 3]" 1
480 1 43 TRP QB 1 82 GLN HE22 6.000 . 6.000 2.256 1.768 3.081 . 0 0 "[ . 1 . 2 . 3]" 1
481 1 43 TRP HD1 1 44 ALA H 5.200 . 6.000 4.312 4.229 4.384 . 0 0 "[ . 1 . 2 . 3]" 1
482 1 43 TRP HD1 1 54 GLY HA3 5.400 . 6.000 5.280 4.850 5.682 . 0 0 "[ . 1 . 2 . 3]" 1
483 1 43 TRP HE1 1 79 ARG QD 4.600 . 6.000 3.931 3.299 4.407 . 0 0 "[ . 1 . 2 . 3]" 1
484 1 43 TRP HE1 1 79 ARG HE 4.000 . 6.000 3.420 2.543 4.397 . 0 0 "[ . 1 . 2 . 3]" 1
485 1 43 TRP HE3 1 54 GLY HA3 3.000 . 4.200 2.808 2.454 3.608 . 0 0 "[ . 1 . 2 . 3]" 1
486 1 43 TRP HE3 1 79 ARG HA 2.900 . 4.000 2.735 2.420 3.110 . 0 0 "[ . 1 . 2 . 3]" 1
487 1 43 TRP HH2 1 79 ARG HE 2.700 . 3.600 3.663 3.373 3.806 0.206 2 0 "[ . 1 . 2 . 3]" 1
488 1 43 TRP HH2 1 79 ARG HG3 3.800 . 5.600 5.233 4.372 5.710 0.110 5 0 "[ . 1 . 2 . 3]" 1
489 1 43 TRP HH2 1 80 GLU H 6.000 . 6.000 6.072 5.907 6.155 0.155 22 0 "[ . 1 . 2 . 3]" 1
490 1 43 TRP HZ2 1 79 ARG HE 3.100 . 4.300 2.282 1.865 2.821 0.035 27 0 "[ . 1 . 2 . 3]" 1
491 1 43 TRP HZ2 1 79 ARG HG3 4.400 . 6.000 4.812 4.369 5.314 . 0 0 "[ . 1 . 2 . 3]" 1
492 1 43 TRP HZ3 1 62 TRP HH2 3.500 . 6.000 6.156 6.056 6.302 0.302 17 0 "[ . 1 . 2 . 3]" 1
493 1 43 TRP HZ3 1 82 GLN HG3 6.000 . 6.000 3.814 3.281 4.503 . 0 0 "[ . 1 . 2 . 3]" 1
494 1 44 ALA H 1 44 ALA HA 2.700 . 3.600 2.943 2.937 2.951 . 0 0 "[ . 1 . 2 . 3]" 1
495 1 44 ALA H 1 44 ALA MB 2.300 . 2.900 2.389 2.345 2.425 . 0 0 "[ . 1 . 2 . 3]" 1
496 1 44 ALA H 1 45 ILE H 2.400 . 3.100 2.370 2.068 2.516 . 0 0 "[ . 1 . 2 . 3]" 1
497 1 44 ALA H 1 45 ILE HB 3.800 . 5.600 3.969 3.864 4.040 . 0 0 "[ . 1 . 2 . 3]" 1
498 1 44 ALA H 1 45 ILE MG 4.200 . 6.000 4.233 3.675 4.683 . 0 0 "[ . 1 . 2 . 3]" 1
499 1 44 ALA H 1 54 GLY HA3 6.000 . 6.000 5.726 5.557 5.945 . 0 0 "[ . 1 . 2 . 3]" 1
500 1 44 ALA HA 1 44 ALA MB 2.300 . 3.000 2.128 2.125 2.131 . 0 0 "[ . 1 . 2 . 3]" 1
501 1 44 ALA HA 1 45 ILE H 3.400 . 4.900 3.150 3.072 3.306 . 0 0 "[ . 1 . 2 . 3]" 1
502 1 44 ALA HA 1 53 GLY HA2 5.400 . 6.000 5.369 3.642 6.024 0.024 13 0 "[ . 1 . 2 . 3]" 1
503 1 44 ALA HA 1 75 ASP HA 3.100 . 4.300 2.658 2.014 3.054 . 0 0 "[ . 1 . 2 . 3]" 1
504 1 44 ALA HA 1 75 ASP QB . . 3.800 2.088 1.895 2.330 0.105 6 0 "[ . 1 . 2 . 3]" 1
505 1 44 ALA MB 1 45 ILE H 3.300 . 4.600 3.446 3.163 3.531 . 0 0 "[ . 1 . 2 . 3]" 1
506 1 45 ILE H 1 45 ILE HA 2.800 . 3.800 2.838 2.775 2.879 . 0 0 "[ . 1 . 2 . 3]" 1
507 1 45 ILE H 1 45 ILE HB 2.400 . 3.100 2.378 2.230 2.527 . 0 0 "[ . 1 . 2 . 3]" 1
508 1 45 ILE H 1 45 ILE MD 4.500 . 6.000 4.360 4.302 4.427 . 0 0 "[ . 1 . 2 . 3]" 1
509 1 45 ILE H 1 45 ILE HG13 3.700 . 5.400 4.252 4.033 4.370 . 0 0 "[ . 1 . 2 . 3]" 1
510 1 45 ILE H 1 45 ILE MG 2.700 . 3.600 2.393 2.160 2.784 . 0 0 "[ . 1 . 2 . 3]" 1
511 1 45 ILE H 1 46 ASN H 4.000 . 6.000 4.552 4.507 4.579 . 0 0 "[ . 1 . 2 . 3]" 1
512 1 45 ILE H 1 53 GLY H 6.000 . 6.000 4.206 3.730 4.763 . 0 0 "[ . 1 . 2 . 3]" 1
513 1 45 ILE H 1 53 GLY HA2 4.900 . 6.000 3.417 2.758 4.375 . 0 0 "[ . 1 . 2 . 3]" 1
514 1 45 ILE H 1 54 GLY H 4.400 . 6.000 3.466 2.843 4.012 . 0 0 "[ . 1 . 2 . 3]" 1
515 1 45 ILE HA 1 45 ILE HB 2.600 . 3.400 2.594 2.522 2.704 . 0 0 "[ . 1 . 2 . 3]" 1
516 1 45 ILE HA 1 45 ILE MD 3.200 . 4.500 3.724 3.686 3.780 . 0 0 "[ . 1 . 2 . 3]" 1
517 1 45 ILE HA 1 45 ILE MG 2.800 . 3.800 3.190 3.131 3.214 . 0 0 "[ . 1 . 2 . 3]" 1
518 1 45 ILE HA 1 46 ASN H 2.300 . 2.900 2.220 2.153 2.265 . 0 0 "[ . 1 . 2 . 3]" 1
519 1 45 ILE MD 1 46 ASN H 4.100 . 6.000 4.072 3.969 4.159 . 0 0 "[ . 1 . 2 . 3]" 1
520 1 45 ILE MD 1 47 THR H 5.700 . 6.000 4.674 4.020 5.223 . 0 0 "[ . 1 . 2 . 3]" 1
521 1 45 ILE HG12 1 47 THR H 4.700 . 6.000 3.782 2.994 4.469 . 0 0 "[ . 1 . 2 . 3]" 1
522 1 45 ILE HG13 1 46 ASN H 3.200 . 4.500 3.060 2.817 3.425 . 0 0 "[ . 1 . 2 . 3]" 1
523 1 45 ILE MG 1 46 ASN H 3.100 . 4.300 3.416 3.074 3.622 . 0 0 "[ . 1 . 2 . 3]" 1
524 1 45 ILE MG 1 47 THR H 3.800 . 5.600 3.639 2.989 4.511 . 0 0 "[ . 1 . 2 . 3]" 1
525 1 45 ILE MG 1 53 GLY H 3.200 . 4.500 3.446 2.543 3.873 . 0 0 "[ . 1 . 2 . 3]" 1
526 1 45 ILE MG 1 54 GLY H 5.700 . 6.000 2.493 1.868 3.018 . 0 0 "[ . 1 . 2 . 3]" 1
527 1 46 ASN H 1 46 ASN HB2 3.400 . 4.900 3.218 2.625 3.919 . 0 0 "[ . 1 . 2 . 3]" 1
528 1 46 ASN H 1 46 ASN HB3 3.300 . 4.700 3.124 2.891 3.848 . 0 0 "[ . 1 . 2 . 3]" 1
529 1 46 ASN H 1 46 ASN HD21 5.100 . 6.000 5.095 3.558 5.478 . 0 0 "[ . 1 . 2 . 3]" 1
530 1 46 ASN H 1 47 THR H 3.900 . 5.800 3.605 3.296 3.886 . 0 0 "[ . 1 . 2 . 3]" 1
531 1 46 ASN H 1 47 THR HA 3.700 . 5.400 4.263 4.182 4.365 . 0 0 "[ . 1 . 2 . 3]" 1
532 1 46 ASN H 1 47 THR MG 3.500 . 5.000 4.070 3.771 4.310 . 0 0 "[ . 1 . 2 . 3]" 1
533 1 46 ASN HA 1 47 THR H 2.600 . 3.400 2.172 2.088 2.273 . 0 0 "[ . 1 . 2 . 3]" 1
534 1 46 ASN HA 1 47 THR MG 5.600 . 6.000 4.163 3.792 4.777 . 0 0 "[ . 1 . 2 . 3]" 1
535 1 46 ASN HA 1 48 GLY H 3.500 . 5.100 3.293 3.132 3.561 . 0 0 "[ . 1 . 2 . 3]" 1
536 1 46 ASN HA 1 49 ASN H 6.000 . 6.000 4.887 4.238 5.044 . 0 0 "[ . 1 . 2 . 3]" 1
537 1 46 ASN HB2 1 47 THR H 5.500 . 6.000 4.507 3.550 4.609 . 0 0 "[ . 1 . 2 . 3]" 1
538 1 46 ASN HB3 1 46 ASN HD21 3.300 . 4.600 3.065 2.190 3.496 . 0 0 "[ . 1 . 2 . 3]" 1
539 1 46 ASN HB3 1 46 ASN HD22 4.100 . 6.000 3.856 3.459 4.069 . 0 0 "[ . 1 . 2 . 3]" 1
540 1 46 ASN HB3 1 47 THR H 5.900 . 6.000 4.317 3.883 4.440 . 0 0 "[ . 1 . 2 . 3]" 1
541 1 46 ASN HD21 1 52 TYR QE 3.700 . 5.400 3.837 3.362 5.212 . 0 0 "[ . 1 . 2 . 3]" 1
542 1 46 ASN HD21 1 73 ARG HE 3.900 . 5.800 3.523 2.721 5.225 . 0 0 "[ . 1 . 2 . 3]" 1
543 1 46 ASN HD22 1 52 TYR QE 3.200 . 6.000 2.826 2.159 4.722 . 0 0 "[ . 1 . 2 . 3]" 1
544 1 47 THR H 1 47 THR MG 2.800 . 3.800 2.549 2.307 2.980 . 0 0 "[ . 1 . 2 . 3]" 1
545 1 47 THR H 1 48 GLY H 2.700 . 3.600 2.464 2.292 2.660 . 0 0 "[ . 1 . 2 . 3]" 1
546 1 47 THR H 1 48 GLY HA2 6.000 . 6.000 4.791 4.598 4.937 . 0 0 "[ . 1 . 2 . 3]" 1
547 1 47 THR H 1 48 GLY HA3 6.000 . 6.000 5.125 4.983 5.250 . 0 0 "[ . 1 . 2 . 3]" 1
548 1 47 THR H 1 49 ASN H 4.300 . 6.000 3.706 3.296 4.045 . 0 0 "[ . 1 . 2 . 3]" 1
549 1 47 THR HA 1 47 THR HB 2.700 . 3.600 2.575 2.516 2.734 . 0 0 "[ . 1 . 2 . 3]" 1
550 1 47 THR HA 1 47 THR MG 2.100 . 2.700 2.259 2.162 2.314 . 0 0 "[ . 1 . 2 . 3]" 1
551 1 47 THR HA 1 48 GLY H 3.200 . 4.500 3.423 3.347 3.475 . 0 0 "[ . 1 . 2 . 3]" 1
552 1 47 THR HA 1 49 ASN H 6.000 . 6.000 4.742 4.494 4.831 . 0 0 "[ . 1 . 2 . 3]" 1
553 1 47 THR HB 1 47 THR MG 2.400 . 3.100 2.137 2.134 2.139 . 0 0 "[ . 1 . 2 . 3]" 1
554 1 47 THR HB 1 48 GLY H 6.000 . 6.000 3.860 3.578 4.099 . 0 0 "[ . 1 . 2 . 3]" 1
555 1 47 THR MG 1 48 GLY H 4.400 . 6.000 4.171 4.054 4.322 . 0 0 "[ . 1 . 2 . 3]" 1
556 1 47 THR MG 1 49 ASN H 4.100 . 6.000 4.644 4.322 4.854 . 0 0 "[ . 1 . 2 . 3]" 1
557 1 48 GLY H 1 48 GLY HA2 2.400 . 3.100 2.356 2.319 2.397 . 0 0 "[ . 1 . 2 . 3]" 1
558 1 48 GLY H 1 48 GLY HA3 2.700 . 3.600 2.919 2.889 2.943 . 0 0 "[ . 1 . 2 . 3]" 1
559 1 48 GLY H 1 49 ASN H 2.400 . 3.100 2.148 2.017 2.280 . 0 0 "[ . 1 . 2 . 3]" 1
560 1 48 GLY H 1 49 ASN HA 6.000 . 6.000 4.841 4.754 4.915 . 0 0 "[ . 1 . 2 . 3]" 1
561 1 48 GLY H 1 50 GLY H 4.000 . 6.000 3.791 3.518 4.167 . 0 0 "[ . 1 . 2 . 3]" 1
562 1 48 GLY HA2 1 49 ASN H 3.200 . 4.500 3.021 2.954 3.119 . 0 0 "[ . 1 . 2 . 3]" 1
563 1 48 GLY HA2 1 50 GLY H 4.000 . 6.000 3.243 3.058 3.347 . 0 0 "[ . 1 . 2 . 3]" 1
564 1 48 GLY HA3 1 49 ASN H 3.000 . 4.100 3.431 3.382 3.455 . 0 0 "[ . 1 . 2 . 3]" 1
565 1 49 ASN H 1 49 ASN HA 2.800 . 3.800 2.908 2.861 2.933 . 0 0 "[ . 1 . 2 . 3]" 1
566 1 49 ASN H 1 49 ASN HB2 3.000 . 4.100 3.159 2.337 3.733 . 0 0 "[ . 1 . 2 . 3]" 1
567 1 49 ASN H 1 49 ASN HB3 2.900 . 3.900 2.959 2.537 3.679 . 0 0 "[ . 1 . 2 . 3]" 1
568 1 49 ASN H 1 50 GLY H 2.500 . 3.300 2.497 2.269 2.666 . 0 0 "[ . 1 . 2 . 3]" 1
569 1 49 ASN H 1 51 TYR H 3.000 . 4.200 3.274 2.945 3.681 . 0 0 "[ . 1 . 2 . 3]" 1
570 1 49 ASN HA 1 49 ASN HB2 2.700 . 3.600 2.596 2.332 3.026 . 0 0 "[ . 1 . 2 . 3]" 1
571 1 49 ASN HA 1 49 ASN HB3 2.300 . 3.000 2.588 2.347 3.023 0.023 10 0 "[ . 1 . 2 . 3]" 1
572 1 49 ASN HA 1 49 ASN HD21 4.000 . 6.000 4.175 1.938 4.569 0.062 17 0 "[ . 1 . 2 . 3]" 1
573 1 49 ASN HA 1 50 GLY H 3.100 . 4.300 3.186 3.072 3.362 . 0 0 "[ . 1 . 2 . 3]" 1
574 1 49 ASN HA 1 51 TYR H 4.500 . 6.000 4.251 3.991 4.421 . 0 0 "[ . 1 . 2 . 3]" 1
575 1 49 ASN HB2 1 49 ASN HD21 2.900 . 3.900 2.684 2.163 3.504 . 0 0 "[ . 1 . 2 . 3]" 1
576 1 49 ASN HB2 1 49 ASN HD22 3.900 . 5.800 3.680 3.447 4.060 . 0 0 "[ . 1 . 2 . 3]" 1
577 1 49 ASN HB3 1 49 ASN HD21 3.000 . 4.100 2.683 2.218 3.515 . 0 0 "[ . 1 . 2 . 3]" 1
578 1 49 ASN HB3 1 49 ASN HD22 3.900 . 5.800 3.679 3.473 4.071 . 0 0 "[ . 1 . 2 . 3]" 1
579 1 49 ASN HB3 1 50 GLY H 4.400 . 6.000 4.218 3.347 4.630 . 0 0 "[ . 1 . 2 . 3]" 1
580 1 49 ASN HB3 1 51 TYR H 5.900 . 6.000 3.909 2.294 4.843 . 0 0 "[ . 1 . 2 . 3]" 1
581 1 49 ASN HD21 1 51 TYR HB2 6.000 . 6.000 4.301 2.919 6.083 0.083 17 0 "[ . 1 . 2 . 3]" 1
582 1 50 GLY H 1 50 GLY HA2 2.300 . 3.000 2.354 2.324 2.370 . 0 0 "[ . 1 . 2 . 3]" 1
583 1 50 GLY H 1 50 GLY HA3 2.700 . 3.600 2.919 2.894 2.932 . 0 0 "[ . 1 . 2 . 3]" 1
584 1 50 GLY H 1 51 TYR H 2.500 . 3.300 2.502 2.312 2.801 . 0 0 "[ . 1 . 2 . 3]" 1
585 1 50 GLY H 1 51 TYR QD 4.700 . 6.000 4.428 4.113 4.557 . 0 0 "[ . 1 . 2 . 3]" 1
586 1 50 GLY H 1 52 TYR QE 6.000 . 6.000 4.830 3.743 5.519 . 0 0 "[ . 1 . 2 . 3]" 1
587 1 50 GLY HA2 1 52 TYR QE 3.000 . 6.000 3.843 2.813 4.307 . 0 0 "[ . 1 . 2 . 3]" 1
588 1 50 GLY HA3 1 51 TYR H 3.100 . 4.300 3.126 3.036 3.243 . 0 0 "[ . 1 . 2 . 3]" 1
589 1 51 TYR H 1 51 TYR HA 2.900 . 3.900 2.929 2.906 2.944 . 0 0 "[ . 1 . 2 . 3]" 1
590 1 51 TYR H 1 51 TYR HB2 2.800 . 3.800 2.804 2.628 3.035 . 0 0 "[ . 1 . 2 . 3]" 1
591 1 51 TYR H 1 51 TYR HB3 3.500 . 5.000 3.772 3.675 3.849 . 0 0 "[ . 1 . 2 . 3]" 1
592 1 51 TYR H 1 51 TYR QD 2.700 . 3.600 2.603 2.250 2.852 . 0 0 "[ . 1 . 2 . 3]" 1
593 1 51 TYR H 1 52 TYR H 4.000 . 6.000 4.442 4.376 4.495 . 0 0 "[ . 1 . 2 . 3]" 1
594 1 51 TYR H 1 58 ASP HA 5.200 . 6.000 4.110 3.776 4.395 . 0 0 "[ . 1 . 2 . 3]" 1
595 1 51 TYR H 1 58 ASP HB3 6.000 . 6.000 5.560 5.146 6.304 0.304 20 0 "[ . 1 . 2 . 3]" 1
596 1 51 TYR HA 1 51 TYR HB3 3.000 . 4.100 2.370 2.308 2.430 . 0 0 "[ . 1 . 2 . 3]" 1
597 1 51 TYR HA 1 51 TYR QD 2.900 . 3.900 2.561 2.394 2.839 . 0 0 "[ . 1 . 2 . 3]" 1
598 1 51 TYR HA 1 52 TYR H 2.500 . 3.300 2.349 2.148 2.506 . 0 0 "[ . 1 . 2 . 3]" 1
599 1 51 TYR HA 1 58 ASP HA 2.700 . 3.600 1.817 1.725 2.044 0.075 20 0 "[ . 1 . 2 . 3]" 1
600 1 51 TYR HA 1 59 GLN H 4.100 . 6.000 3.128 2.758 3.390 . 0 0 "[ . 1 . 2 . 3]" 1
601 1 51 TYR HB2 1 51 TYR QD 2.300 . 6.000 2.560 2.395 2.749 . 0 0 "[ . 1 . 2 . 3]" 1
602 1 51 TYR HB2 1 52 TYR H 3.900 . 5.800 3.493 3.042 3.966 . 0 0 "[ . 1 . 2 . 3]" 1
603 1 51 TYR HB3 1 51 TYR QD 2.500 . 3.300 2.617 2.376 2.750 . 0 0 "[ . 1 . 2 . 3]" 1
604 1 51 TYR HB3 1 52 TYR H 3.500 . 5.100 2.706 2.375 3.104 . 0 0 "[ . 1 . 2 . 3]" 1
605 1 51 TYR HB3 1 56 GLN HA 3.100 . 4.300 3.647 2.875 4.184 . 0 0 "[ . 1 . 2 . 3]" 1
606 1 51 TYR HB3 1 57 PHE H 4.400 . 6.000 3.691 3.385 4.175 . 0 0 "[ . 1 . 2 . 3]" 1
607 1 51 TYR HB3 1 57 PHE HB3 6.000 . 6.000 4.917 4.656 5.839 . 0 0 "[ . 1 . 2 . 3]" 1
608 1 51 TYR QD 1 52 TYR H 5.000 . 6.000 4.457 4.362 4.598 . 0 0 "[ . 1 . 2 . 3]" 1
609 1 51 TYR QD 1 58 ASP H 3.900 . 5.800 3.980 3.565 4.221 . 0 0 "[ . 1 . 2 . 3]" 1
610 1 51 TYR QD 1 58 ASP HA 3.300 . 4.700 2.357 1.973 2.854 . 0 0 "[ . 1 . 2 . 3]" 1
611 1 51 TYR QD 1 58 ASP HB2 3.600 . 5.200 2.795 1.990 3.392 0.010 18 0 "[ . 1 . 2 . 3]" 1
612 1 51 TYR QD 1 58 ASP HB3 3.100 . 4.300 3.003 2.439 4.036 . 0 0 "[ . 1 . 2 . 3]" 1
613 1 51 TYR QD 1 59 GLN HB2 4.700 . 6.000 5.383 5.088 5.808 . 0 0 "[ . 1 . 2 . 3]" 1
614 1 51 TYR QE 1 58 ASP H 4.800 . 6.000 4.680 4.086 5.038 . 0 0 "[ . 1 . 2 . 3]" 1
615 1 51 TYR QE 1 58 ASP HA 4.900 . 6.000 4.036 3.679 4.301 . 0 0 "[ . 1 . 2 . 3]" 1
616 1 51 TYR QE 1 58 ASP HB2 3.200 . 4.500 2.946 2.190 3.357 . 0 0 "[ . 1 . 2 . 3]" 1
617 1 51 TYR QE 1 58 ASP HB3 2.900 . 6.000 2.976 2.350 3.905 . 0 0 "[ . 1 . 2 . 3]" 1
618 1 52 TYR H 1 52 TYR QB 3.100 . 4.300 2.603 2.431 3.077 . 0 0 "[ . 1 . 2 . 3]" 1
619 1 52 TYR H 1 52 TYR QD 3.000 . 4.100 2.637 2.191 3.192 . 0 0 "[ . 1 . 2 . 3]" 1
620 1 52 TYR H 1 52 TYR QE 6.000 . 6.000 4.588 4.328 4.699 . 0 0 "[ . 1 . 2 . 3]" 1
621 1 52 TYR H 1 56 GLN HA 3.500 . 5.000 3.482 2.890 4.101 . 0 0 "[ . 1 . 2 . 3]" 1
622 1 52 TYR H 1 57 PHE H 3.600 . 5.200 3.410 3.096 4.213 . 0 0 "[ . 1 . 2 . 3]" 1
623 1 52 TYR H 1 58 ASP HA 4.700 . 6.000 3.648 3.122 4.149 . 0 0 "[ . 1 . 2 . 3]" 1
624 1 52 TYR H 1 74 ALA MB 4.500 . 6.000 3.629 3.253 3.912 . 0 0 "[ . 1 . 2 . 3]" 1
625 1 52 TYR H 1 75 ASP H 6.000 . 6.000 5.849 5.563 6.053 0.053 11 0 "[ . 1 . 2 . 3]" 1
626 1 52 TYR HA 1 52 TYR QB 2.600 . 3.400 2.343 2.198 2.410 . 0 0 "[ . 1 . 2 . 3]" 1
627 1 52 TYR HA 1 52 TYR QD 3.000 . 4.100 2.901 2.247 3.284 . 0 0 "[ . 1 . 2 . 3]" 1
628 1 52 TYR HA 1 52 TYR QE 3.700 . 5.500 4.629 4.397 5.131 . 0 0 "[ . 1 . 2 . 3]" 1
629 1 52 TYR HA 1 53 GLY H 2.700 . 3.600 2.479 2.285 2.546 . 0 0 "[ . 1 . 2 . 3]" 1
630 1 52 TYR QB 1 52 TYR QD 2.500 . 3.300 2.137 2.121 2.153 . 0 0 "[ . 1 . 2 . 3]" 1
631 1 52 TYR QB 1 52 TYR QE 3.800 . 5.600 3.939 3.920 3.956 . 0 0 "[ . 1 . 2 . 3]" 1
632 1 52 TYR QB 1 53 GLY H 4.700 . 5.800 2.234 2.111 2.571 . 0 0 "[ . 1 . 2 . 3]" 1
633 1 52 TYR QB 1 73 ARG HB3 3.800 . 5.600 4.887 4.399 5.308 . 0 0 "[ . 1 . 2 . 3]" 1
634 1 52 TYR QB 1 74 ALA H . . 5.400 2.502 1.958 2.995 0.042 26 0 "[ . 1 . 2 . 3]" 1
635 1 52 TYR QB 1 74 ALA MB 4.100 . 6.000 1.857 1.728 1.927 0.272 27 0 "[ . 1 . 2 . 3]" 1
636 1 52 TYR QB 1 75 ASP H 3.200 . 3.800 2.351 2.145 2.564 . 0 0 "[ . 1 . 2 . 3]" 1
637 1 52 TYR QB 1 75 ASP QB 3.200 . 4.500 2.717 2.237 3.795 . 0 0 "[ . 1 . 2 . 3]" 1
638 1 52 TYR QD 1 53 GLY H 5.400 . 6.000 3.823 3.622 4.463 . 0 0 "[ . 1 . 2 . 3]" 1
639 1 52 TYR QD 1 58 ASP HA 4.500 . 6.000 3.827 3.191 4.607 . 0 0 "[ . 1 . 2 . 3]" 1
640 1 52 TYR QD 1 59 GLN H 4.400 . 6.000 3.740 2.879 4.373 . 0 0 "[ . 1 . 2 . 3]" 1
641 1 52 TYR QD 1 74 ALA MB 3.500 . 5.000 3.392 2.613 3.807 . 0 0 "[ . 1 . 2 . 3]" 1
642 1 52 TYR QD 1 75 ASP H 3.600 . 5.300 3.494 2.616 4.074 . 0 0 "[ . 1 . 2 . 3]" 1
643 1 52 TYR QE 1 58 ASP HA 5.100 . 6.000 4.207 3.514 4.718 . 0 0 "[ . 1 . 2 . 3]" 1
644 1 52 TYR QE 1 59 GLN H 3.500 . 5.000 2.860 2.427 3.288 . 0 0 "[ . 1 . 2 . 3]" 1
645 1 52 TYR QE 1 59 GLN HB2 2.600 . 3.500 1.771 1.684 1.974 0.016 9 0 "[ . 1 . 2 . 3]" 1
646 1 52 TYR QE 1 59 GLN HB3 3.900 . 5.800 3.114 2.271 3.450 . 0 0 "[ . 1 . 2 . 3]" 1
647 1 52 TYR QE 1 59 GLN HE21 3.900 . 5.800 2.945 1.893 4.280 0.107 15 0 "[ . 1 . 2 . 3]" 1
648 1 52 TYR QE 1 59 GLN HG2 3.700 . 5.400 3.782 3.124 4.197 . 0 0 "[ . 1 . 2 . 3]" 1
649 1 52 TYR QE 1 60 GLY H 6.000 . 6.000 4.837 4.602 4.925 . 0 0 "[ . 1 . 2 . 3]" 1
650 1 52 TYR QE 1 73 ARG HB3 3.500 . 5.100 3.767 3.034 4.961 . 0 0 "[ . 1 . 2 . 3]" 1
651 1 53 GLY H 1 75 ASP HA 4.000 . 6.000 3.786 3.382 4.240 . 0 0 "[ . 1 . 2 . 3]" 1
652 1 53 GLY H 1 75 ASP QB 4.100 . 6.000 2.113 1.721 3.485 0.279 27 0 "[ . 1 . 2 . 3]" 1
653 1 53 GLY HA2 1 54 GLY H 3.100 . 4.300 2.398 2.203 2.648 . 0 0 "[ . 1 . 2 . 3]" 1
654 1 53 GLY HA3 1 54 GLY H 4.200 . 6.000 2.651 2.376 3.446 . 0 0 "[ . 1 . 2 . 3]" 1
655 1 54 GLY H 1 55 VAL H 6.000 . 6.000 4.266 4.084 4.360 . 0 0 "[ . 1 . 2 . 3]" 1
656 1 54 GLY H 1 56 GLN H 3.200 . 4.500 3.939 3.707 4.090 . 0 0 "[ . 1 . 2 . 3]" 1
657 1 55 VAL H 1 55 VAL HB 4.000 . 6.000 3.094 2.661 3.628 . 0 0 "[ . 1 . 2 . 3]" 1
658 1 55 VAL H 1 55 VAL MG2 3.300 . 4.700 1.896 1.820 2.031 0.080 25 0 "[ . 1 . 2 . 3]" 1
659 1 55 VAL H 1 56 GLN H 2.900 . 3.900 2.348 2.248 2.592 . 0 0 "[ . 1 . 2 . 3]" 1
660 1 55 VAL HA 1 55 VAL MG1 2.300 . 3.000 2.239 2.134 2.318 . 0 0 "[ . 1 . 2 . 3]" 1
661 1 55 VAL HA 1 56 GLN H 3.800 . 5.600 3.245 3.059 3.325 . 0 0 "[ . 1 . 2 . 3]" 1
662 1 55 VAL HA 1 98 TRP HE1 4.600 . 6.000 4.232 3.799 4.391 . 0 0 "[ . 1 . 2 . 3]" 1
663 1 55 VAL HB 1 56 GLN H 3.100 . 4.300 3.722 3.367 4.165 . 0 0 "[ . 1 . 2 . 3]" 1
664 1 55 VAL HB 1 98 TRP HE1 2.700 . 3.600 2.924 1.788 3.505 0.012 17 0 "[ . 1 . 2 . 3]" 1
665 1 55 VAL MG1 1 98 TRP HZ2 3.100 . 4.300 3.487 2.762 4.389 0.089 26 0 "[ . 1 . 2 . 3]" 1
666 1 55 VAL MG2 1 56 GLN H 3.700 . 5.400 3.459 2.659 3.999 . 0 0 "[ . 1 . 2 . 3]" 1
667 1 55 VAL MG2 1 57 PHE H 5.500 . 6.000 4.168 2.828 5.249 . 0 0 "[ . 1 . 2 . 3]" 1
668 1 55 VAL MG2 1 98 TRP HE1 2.500 . 6.000 4.020 3.000 4.508 . 0 0 "[ . 1 . 2 . 3]" 1
669 1 56 GLN H 1 56 GLN HA 2.700 . 3.600 2.252 2.232 2.281 . 0 0 "[ . 1 . 2 . 3]" 1
670 1 56 GLN H 1 56 GLN HB2 3.400 . 4.800 3.202 2.862 3.954 . 0 0 "[ . 1 . 2 . 3]" 1
671 1 56 GLN H 1 56 GLN HB3 4.000 . 6.000 3.738 2.942 4.100 . 0 0 "[ . 1 . 2 . 3]" 1
672 1 56 GLN H 1 56 GLN HE22 4.400 . 6.000 5.257 4.467 6.407 0.407 8 0 "[ . 1 . 2 . 3]" 1
673 1 56 GLN H 1 56 GLN HG3 4.000 . 6.000 4.356 2.496 4.958 . 0 0 "[ . 1 . 2 . 3]" 1
674 1 56 GLN H 1 57 PHE H 3.400 . 4.800 2.930 2.696 3.212 . 0 0 "[ . 1 . 2 . 3]" 1
675 1 56 GLN H 1 82 GLN HE22 3.800 . 5.600 5.004 4.303 6.334 0.734 1 5 "[+ *. 1 *. -* 2 . 3]" 1
676 1 56 GLN HA 1 57 PHE H 2.800 . 3.800 2.732 2.620 2.930 . 0 0 "[ . 1 . 2 . 3]" 1
677 1 56 GLN HB3 1 57 PHE H 6.000 . 6.000 4.384 4.263 4.713 . 0 0 "[ . 1 . 2 . 3]" 1
678 1 57 PHE H 1 57 PHE HB2 3.900 . 5.800 3.607 2.202 3.896 . 0 0 "[ . 1 . 2 . 3]" 1
679 1 57 PHE H 1 57 PHE HB3 3.100 . 4.300 3.215 2.980 3.530 . 0 0 "[ . 1 . 2 . 3]" 1
680 1 57 PHE H 1 57 PHE QD 2.700 . 6.000 2.055 1.781 2.664 . 0 0 "[ . 1 . 2 . 3]" 1
681 1 57 PHE H 1 57 PHE QE 5.200 . 6.000 4.044 3.800 4.639 . 0 0 "[ . 1 . 2 . 3]" 1
682 1 57 PHE H 1 58 ASP H 6.000 . 6.000 4.414 2.495 4.573 . 0 0 "[ . 1 . 2 . 3]" 1
683 1 57 PHE H 1 74 ALA MB 3.600 . 5.300 3.867 3.353 4.119 . 0 0 "[ . 1 . 2 . 3]" 1
684 1 57 PHE HA 1 57 PHE HB2 2.900 . 3.900 2.504 2.389 2.986 . 0 0 "[ . 1 . 2 . 3]" 1
685 1 57 PHE HA 1 57 PHE HB3 2.400 . 3.100 2.415 2.348 2.616 . 0 0 "[ . 1 . 2 . 3]" 1
686 1 57 PHE HA 1 57 PHE QE 5.400 . 6.000 5.532 4.468 5.707 . 0 0 "[ . 1 . 2 . 3]" 1
687 1 57 PHE HA 1 58 ASP H 2.500 . 3.300 2.488 2.192 2.989 . 0 0 "[ . 1 . 2 . 3]" 1
688 1 57 PHE HA 1 61 THR HB 6.000 . 6.000 5.169 3.805 5.810 . 0 0 "[ . 1 . 2 . 3]" 1
689 1 57 PHE HB2 1 57 PHE QD 2.600 . 3.400 2.262 2.232 2.358 . 0 0 "[ . 1 . 2 . 3]" 1
690 1 57 PHE HB2 1 57 PHE QE 4.400 . 6.000 4.359 4.346 4.388 . 0 0 "[ . 1 . 2 . 3]" 1
691 1 57 PHE HB2 1 58 ASP H 3.300 . 4.700 2.496 1.932 4.424 . 0 0 "[ . 1 . 2 . 3]" 1
692 1 57 PHE HB3 1 57 PHE QD 2.900 . 4.000 2.607 2.366 2.712 . 0 0 "[ . 1 . 2 . 3]" 1
693 1 57 PHE QD 1 58 ASP H 3.600 . 5.200 3.451 2.928 4.081 . 0 0 "[ . 1 . 2 . 3]" 1
694 1 57 PHE QD 1 61 THR HB 2.600 . 6.000 2.433 2.086 2.864 . 0 0 "[ . 1 . 2 . 3]" 1
695 1 57 PHE QD 1 61 THR MG 2.500 . 6.000 2.318 1.746 2.763 . 0 0 "[ . 1 . 2 . 3]" 1
696 1 57 PHE QD 1 62 TRP HE3 4.000 . 6.000 3.749 2.675 4.026 . 0 0 "[ . 1 . 2 . 3]" 1
697 1 57 PHE QD 1 62 TRP HZ3 4.300 . 6.000 4.544 2.912 4.882 . 0 0 "[ . 1 . 2 . 3]" 1
698 1 57 PHE QD 1 85 VAL MG1 4.700 . 6.000 4.049 3.201 4.520 . 0 0 "[ . 1 . 2 . 3]" 1
699 1 57 PHE QD 1 89 THR MG 4.900 . 6.000 3.811 2.451 5.077 . 0 0 "[ . 1 . 2 . 3]" 1
700 1 57 PHE QE 1 62 TRP HZ3 3.100 . 6.000 2.901 2.553 3.156 . 0 0 "[ . 1 . 2 . 3]" 1
701 1 57 PHE QE 1 82 GLN HA 6.000 . 6.000 3.760 2.945 4.333 . 0 0 "[ . 1 . 2 . 3]" 1
702 1 57 PHE QE 1 85 VAL HB 4.000 . 6.000 3.479 3.177 4.809 . 0 0 "[ . 1 . 2 . 3]" 1
703 1 57 PHE QE 1 85 VAL MG1 2.800 . 6.000 2.176 1.951 2.757 . 0 0 "[ . 1 . 2 . 3]" 1
704 1 57 PHE QE 1 85 VAL MG2 4.500 . 6.000 4.237 2.235 4.442 . 0 0 "[ . 1 . 2 . 3]" 1
705 1 57 PHE QE 1 86 ALA HA 3.100 . 4.300 3.380 2.724 3.677 . 0 0 "[ . 1 . 2 . 3]" 1
706 1 57 PHE QE 1 86 ALA MB 2.900 . 6.000 2.657 2.331 3.046 . 0 0 "[ . 1 . 2 . 3]" 1
707 1 57 PHE HZ 1 85 VAL H 5.200 . 6.000 4.426 4.238 4.546 . 0 0 "[ . 1 . 2 . 3]" 1
708 1 57 PHE HZ 1 85 VAL HB 3.500 . 5.100 2.255 1.888 3.898 0.012 23 0 "[ . 1 . 2 . 3]" 1
709 1 57 PHE HZ 1 85 VAL MG1 2.900 . 3.900 2.327 1.718 3.011 0.182 26 0 "[ . 1 . 2 . 3]" 1
710 1 57 PHE HZ 1 86 ALA H 3.100 . 4.300 2.677 2.090 2.953 . 0 0 "[ . 1 . 2 . 3]" 1
711 1 57 PHE HZ 1 86 ALA HA 2.600 . 3.400 3.106 2.003 3.442 0.042 5 0 "[ . 1 . 2 . 3]" 1
712 1 57 PHE HZ 1 86 ALA MB 2.600 . 6.000 2.817 1.762 3.560 . 0 0 "[ . 1 . 2 . 3]" 1
713 1 57 PHE HZ 1 87 GLU H 6.000 . 6.000 5.027 4.211 5.198 . 0 0 "[ . 1 . 2 . 3]" 1
714 1 58 ASP H 1 58 ASP HB2 4.000 . 6.000 3.481 2.583 3.641 . 0 0 "[ . 1 . 2 . 3]" 1
715 1 58 ASP H 1 58 ASP HB3 3.100 . 4.300 2.549 2.007 3.432 . 0 0 "[ . 1 . 2 . 3]" 1
716 1 58 ASP H 1 59 GLN H 6.000 . 6.000 4.544 3.932 4.629 . 0 0 "[ . 1 . 2 . 3]" 1
717 1 58 ASP H 1 61 THR HB 3.400 . 4.800 3.293 3.015 4.448 . 0 0 "[ . 1 . 2 . 3]" 1
718 1 58 ASP H 1 61 THR MG 4.700 . 6.000 4.294 3.974 5.313 . 0 0 "[ . 1 . 2 . 3]" 1
719 1 58 ASP H 1 62 TRP H 4.400 . 6.000 4.476 4.131 4.765 . 0 0 "[ . 1 . 2 . 3]" 1
720 1 58 ASP HA 1 58 ASP HB2 2.700 . 3.600 2.388 2.217 2.474 . 0 0 "[ . 1 . 2 . 3]" 1
721 1 58 ASP HA 1 58 ASP HB3 2.600 . 3.400 2.563 2.414 3.003 . 0 0 "[ . 1 . 2 . 3]" 1
722 1 58 ASP HA 1 59 GLN H 2.500 . 3.300 2.261 2.086 2.385 . 0 0 "[ . 1 . 2 . 3]" 1
723 1 58 ASP HA 1 60 GLY H 4.500 . 6.000 4.162 3.903 4.310 . 0 0 "[ . 1 . 2 . 3]" 1
724 1 58 ASP HB2 1 59 GLN H 2.900 . 4.000 2.703 2.287 3.898 . 0 0 "[ . 1 . 2 . 3]" 1
725 1 58 ASP HB2 1 60 GLY H 3.200 . 4.500 3.112 2.603 4.396 . 0 0 "[ . 1 . 2 . 3]" 1
726 1 58 ASP HB3 1 59 GLN H 3.500 . 5.000 3.828 3.635 4.215 . 0 0 "[ . 1 . 2 . 3]" 1
727 1 58 ASP HB3 1 60 GLY H 5.300 . 6.000 4.265 3.575 4.415 . 0 0 "[ . 1 . 2 . 3]" 1
728 1 59 GLN H 1 59 GLN HA 2.900 . 3.900 2.768 2.729 2.801 . 0 0 "[ . 1 . 2 . 3]" 1
729 1 59 GLN H 1 59 GLN HB2 2.800 . 3.800 2.491 2.293 2.664 . 0 0 "[ . 1 . 2 . 3]" 1
730 1 59 GLN H 1 59 GLN HB3 2.600 . 3.500 2.344 2.140 2.589 . 0 0 "[ . 1 . 2 . 3]" 1
731 1 59 GLN H 1 59 GLN HE22 6.000 . 6.000 5.617 5.402 5.862 . 0 0 "[ . 1 . 2 . 3]" 1
732 1 59 GLN H 1 59 GLN HG3 3.700 . 5.400 4.309 4.173 4.425 . 0 0 "[ . 1 . 2 . 3]" 1
733 1 59 GLN H 1 60 GLY H 2.900 . 4.000 2.688 2.559 2.791 . 0 0 "[ . 1 . 2 . 3]" 1
734 1 59 GLN H 1 60 GLY HA3 6.000 . 6.000 4.983 4.856 5.094 . 0 0 "[ . 1 . 2 . 3]" 1
735 1 59 GLN HA 1 59 GLN HB2 2.600 . 3.400 2.407 2.297 2.501 . 0 0 "[ . 1 . 2 . 3]" 1
736 1 59 GLN HA 1 59 GLN HG3 2.800 . 3.800 3.116 2.908 3.369 . 0 0 "[ . 1 . 2 . 3]" 1
737 1 59 GLN HA 1 60 GLY H 3.000 . 4.100 3.498 3.463 3.522 . 0 0 "[ . 1 . 2 . 3]" 1
738 1 59 GLN HA 1 62 TRP H 3.700 . 5.500 3.678 3.136 3.982 . 0 0 "[ . 1 . 2 . 3]" 1
739 1 59 GLN HA 1 63 GLU H 4.100 . 6.000 3.802 3.492 4.103 . 0 0 "[ . 1 . 2 . 3]" 1
740 1 59 GLN HB2 1 60 GLY H 3.700 . 5.400 3.934 3.720 4.070 . 0 0 "[ . 1 . 2 . 3]" 1
741 1 59 GLN HB3 1 59 GLN HE21 5.000 . 6.000 3.666 3.348 4.099 . 0 0 "[ . 1 . 2 . 3]" 1
742 1 59 GLN HB3 1 60 GLY H 2.900 . 3.900 2.669 2.433 2.831 . 0 0 "[ . 1 . 2 . 3]" 1
743 1 59 GLN HB3 1 62 TRP HB3 5.200 . 6.000 5.114 4.643 5.389 . 0 0 "[ . 1 . 2 . 3]" 1
744 1 59 GLN HE21 1 59 GLN HG3 2.800 . 3.800 2.874 2.260 3.452 . 0 0 "[ . 1 . 2 . 3]" 1
745 1 59 GLN HE21 1 62 TRP HB3 3.700 . 5.400 3.106 2.615 3.962 . 0 0 "[ . 1 . 2 . 3]" 1
746 1 59 GLN HE21 1 63 GLU HB3 3.900 . 6.000 5.145 3.004 6.140 0.140 23 0 "[ . 1 . 2 . 3]" 1
747 1 59 GLN HE21 1 68 LEU MD1 4.200 . 6.000 4.435 3.234 5.764 . 0 0 "[ . 1 . 2 . 3]" 1
748 1 59 GLN HE21 1 74 ALA H 6.000 . 6.000 4.747 3.533 5.524 . 0 0 "[ . 1 . 2 . 3]" 1
749 1 59 GLN HE22 1 62 TRP HB3 3.700 . 5.400 3.923 3.109 4.214 . 0 0 "[ . 1 . 2 . 3]" 1
750 1 59 GLN HE22 1 62 TRP HE1 3.600 . 5.200 4.191 3.215 4.450 . 0 0 "[ . 1 . 2 . 3]" 1
751 1 59 GLN HE22 1 63 GLU HB3 4.100 . 6.000 5.859 4.562 6.045 0.045 14 0 "[ . 1 . 2 . 3]" 1
752 1 59 GLN HE22 1 68 LEU MD1 3.400 . 4.800 4.079 3.321 5.140 0.340 2 0 "[ . 1 . 2 . 3]" 1
753 1 59 GLN HE22 1 73 ARG HA 3.200 . 4.500 2.615 2.268 2.841 . 0 0 "[ . 1 . 2 . 3]" 1
754 1 59 GLN HE22 1 73 ARG HG3 6.000 . 6.000 6.053 5.943 6.159 0.159 23 0 "[ . 1 . 2 . 3]" 1
755 1 59 GLN QG 1 62 TRP HB3 5.000 . 6.000 4.299 4.032 4.536 . 0 0 "[ . 1 . 2 . 3]" 1
756 1 59 GLN HG2 1 60 GLY H 4.000 . 6.000 4.567 4.234 4.800 . 0 0 "[ . 1 . 2 . 3]" 1
757 1 59 GLN HG2 1 63 GLU H 6.000 . 6.000 5.901 5.702 6.172 0.172 8 0 "[ . 1 . 2 . 3]" 1
758 1 59 GLN HG3 1 62 TRP HB3 4.100 . 6.000 4.454 4.153 4.759 . 0 0 "[ . 1 . 2 . 3]" 1
759 1 60 GLY H 1 60 GLY HA2 2.700 . 3.600 2.838 2.787 2.852 . 0 0 "[ . 1 . 2 . 3]" 1
760 1 60 GLY H 1 60 GLY HA3 2.000 . 2.500 2.301 2.281 2.312 . 0 0 "[ . 1 . 2 . 3]" 1
761 1 60 GLY H 1 61 THR H 2.700 . 3.600 2.678 2.593 2.751 . 0 0 "[ . 1 . 2 . 3]" 1
762 1 60 GLY H 1 61 THR HB 5.600 . 6.000 4.750 4.690 4.819 . 0 0 "[ . 1 . 2 . 3]" 1
763 1 60 GLY H 1 62 TRP H 4.800 . 6.000 3.917 3.775 3.997 . 0 0 "[ . 1 . 2 . 3]" 1
764 1 60 GLY H 1 62 TRP HB3 6.000 . 6.000 4.599 4.353 4.766 . 0 0 "[ . 1 . 2 . 3]" 1
765 1 60 GLY H 1 63 GLU HB3 4.500 . 6.000 4.903 4.691 5.028 . 0 0 "[ . 1 . 2 . 3]" 1
766 1 60 GLY HA2 1 61 THR H 3.600 . 5.200 3.542 3.526 3.570 . 0 0 "[ . 1 . 2 . 3]" 1
767 1 61 THR H 1 61 THR HA 2.600 . 3.400 2.814 2.795 2.844 . 0 0 "[ . 1 . 2 . 3]" 1
768 1 61 THR H 1 61 THR HB 2.900 . 4.000 2.460 2.409 2.522 . 0 0 "[ . 1 . 2 . 3]" 1
769 1 61 THR H 1 61 THR MG 4.000 . 6.000 3.736 3.705 3.751 . 0 0 "[ . 1 . 2 . 3]" 1
770 1 61 THR H 1 62 TRP H 3.000 . 4.100 2.637 2.543 2.698 . 0 0 "[ . 1 . 2 . 3]" 1
771 1 61 THR H 1 62 TRP HB3 4.900 . 6.000 4.598 4.404 4.691 . 0 0 "[ . 1 . 2 . 3]" 1
772 1 61 THR H 1 64 ALA MB 5.100 . 6.000 4.377 4.252 4.546 . 0 0 "[ . 1 . 2 . 3]" 1
773 1 61 THR HA 1 61 THR HB 2.300 . 2.900 2.989 2.986 3.001 0.101 20 0 "[ . 1 . 2 . 3]" 1
774 1 61 THR HA 1 61 THR MG 2.000 . 6.000 2.409 2.354 2.469 . 0 0 "[ . 1 . 2 . 3]" 1
775 1 61 THR HA 1 63 GLU H 3.900 . 5.800 4.416 4.307 4.456 . 0 0 "[ . 1 . 2 . 3]" 1
776 1 61 THR HA 1 64 ALA H 3.000 . 4.100 3.209 2.939 3.433 . 0 0 "[ . 1 . 2 . 3]" 1
777 1 61 THR HA 1 64 ALA MB 1.900 . 6.000 2.323 2.133 2.526 . 0 0 "[ . 1 . 2 . 3]" 1
778 1 61 THR HA 1 65 ASN H 3.900 . 5.800 4.046 3.978 4.115 . 0 0 "[ . 1 . 2 . 3]" 1
779 1 61 THR HA 1 65 ASN HD21 4.800 . 6.000 4.753 3.666 5.481 . 0 0 "[ . 1 . 2 . 3]" 1
780 1 61 THR HA 1 65 ASN HD22 4.000 . 6.000 4.373 3.873 4.649 . 0 0 "[ . 1 . 2 . 3]" 1
781 1 61 THR HB 1 61 THR MG 2.200 . 2.800 2.135 2.128 2.142 . 0 0 "[ . 1 . 2 . 3]" 1
782 1 61 THR HB 1 62 TRP H 3.400 . 4.800 2.532 2.461 2.698 . 0 0 "[ . 1 . 2 . 3]" 1
783 1 61 THR MG 1 62 TRP H 3.600 . 5.200 3.427 3.294 3.569 . 0 0 "[ . 1 . 2 . 3]" 1
784 1 61 THR MG 1 65 ASN H 4.400 . 6.000 4.016 3.884 4.244 . 0 0 "[ . 1 . 2 . 3]" 1
785 1 61 THR MG 1 65 ASN HD21 3.700 . 5.400 3.660 2.397 4.584 . 0 0 "[ . 1 . 2 . 3]" 1
786 1 61 THR MG 1 65 ASN HD22 2.800 . 3.700 2.843 2.040 3.431 . 0 0 "[ . 1 . 2 . 3]" 1
787 1 61 THR MG 1 93 GLN HE22 3.200 . 6.000 4.441 3.136 5.337 . 0 0 "[ . 1 . 2 . 3]" 1
788 1 62 TRP H 1 62 TRP HA 2.800 . 3.800 2.783 2.766 2.802 . 0 0 "[ . 1 . 2 . 3]" 1
789 1 62 TRP H 1 62 TRP HB2 2.700 . 3.600 2.483 2.417 2.534 . 0 0 "[ . 1 . 2 . 3]" 1
790 1 62 TRP H 1 62 TRP HB3 2.500 . 3.300 2.403 2.350 2.438 . 0 0 "[ . 1 . 2 . 3]" 1
791 1 62 TRP H 1 62 TRP HD1 5.300 . 6.000 4.834 4.791 4.873 . 0 0 "[ . 1 . 2 . 3]" 1
792 1 62 TRP H 1 62 TRP HE3 6.000 . 6.000 4.702 4.615 4.754 . 0 0 "[ . 1 . 2 . 3]" 1
793 1 62 TRP H 1 63 GLU H 3.100 . 4.300 2.707 2.634 2.809 . 0 0 "[ . 1 . 2 . 3]" 1
794 1 62 TRP H 1 63 GLU HB3 4.800 . 6.000 4.707 4.495 4.814 . 0 0 "[ . 1 . 2 . 3]" 1
795 1 62 TRP H 1 64 ALA H 6.000 . 6.000 3.916 3.828 4.035 . 0 0 "[ . 1 . 2 . 3]" 1
796 1 62 TRP H 1 85 VAL MG1 6.000 . 6.000 4.402 4.131 6.110 0.110 26 0 "[ . 1 . 2 . 3]" 1
797 1 62 TRP HA 1 62 TRP HE3 3.200 . 4.500 3.150 2.915 3.373 . 0 0 "[ . 1 . 2 . 3]" 1
798 1 62 TRP HA 1 63 GLU H 3.500 . 5.100 3.524 3.508 3.545 . 0 0 "[ . 1 . 2 . 3]" 1
799 1 62 TRP HA 1 66 GLY H 6.000 . 6.000 4.669 4.356 4.779 . 0 0 "[ . 1 . 2 . 3]" 1
800 1 62 TRP HA 1 85 VAL MG1 2.800 . 3.700 2.113 1.824 4.037 0.337 26 0 "[ . 1 . 2 . 3]" 1
801 1 62 TRP HB2 1 62 TRP HD1 3.400 . 4.900 3.791 3.737 3.823 . 0 0 "[ . 1 . 2 . 3]" 1
802 1 62 TRP HB2 1 63 GLU H 4.200 . 6.000 3.720 3.665 3.780 . 0 0 "[ . 1 . 2 . 3]" 1
803 1 62 TRP HB3 1 62 TRP HD1 2.400 . 3.100 2.634 2.567 2.685 . 0 0 "[ . 1 . 2 . 3]" 1
804 1 62 TRP HB3 1 62 TRP HE1 5.100 . 6.000 4.764 4.738 4.804 . 0 0 "[ . 1 . 2 . 3]" 1
805 1 62 TRP HB3 1 63 GLU H 2.300 . 2.900 2.314 2.243 2.382 . 0 0 "[ . 1 . 2 . 3]" 1
806 1 62 TRP HB3 1 63 GLU HA 3.400 . 4.900 4.223 4.169 4.291 . 0 0 "[ . 1 . 2 . 3]" 1
807 1 62 TRP HB3 1 63 GLU HB3 2.600 . 6.000 4.320 3.755 4.481 . 0 0 "[ . 1 . 2 . 3]" 1
808 1 62 TRP HB3 1 64 ALA H 4.600 . 6.000 4.657 4.615 4.692 . 0 0 "[ . 1 . 2 . 3]" 1
809 1 62 TRP HB3 1 66 GLY H 4.400 . 6.000 6.040 5.825 6.094 0.094 9 0 "[ . 1 . 2 . 3]" 1
810 1 62 TRP HB3 1 68 LEU H 6.000 . 6.000 5.935 5.640 6.046 0.046 8 0 "[ . 1 . 2 . 3]" 1
811 1 62 TRP HB3 1 68 LEU MD1 4.000 . 6.000 4.435 3.711 5.862 . 0 0 "[ . 1 . 2 . 3]" 1
812 1 62 TRP HD1 1 63 GLU H 3.600 . 5.200 3.298 3.199 3.398 . 0 0 "[ . 1 . 2 . 3]" 1
813 1 62 TRP HD1 1 63 GLU HA 3.400 . 4.900 3.063 2.932 3.307 . 0 0 "[ . 1 . 2 . 3]" 1
814 1 62 TRP HD1 1 63 GLU HB3 3.400 . 4.900 4.636 3.807 4.861 . 0 0 "[ . 1 . 2 . 3]" 1
815 1 62 TRP HD1 1 68 LEU HB3 4.200 . 6.000 5.421 5.001 5.640 . 0 0 "[ . 1 . 2 . 3]" 1
816 1 62 TRP HD1 1 68 LEU MD1 2.500 . 3.300 2.636 1.949 4.255 0.955 2 6 "[*+ . * * . - 2* . 3]" 1
817 1 62 TRP HD1 1 68 LEU MD2 3.300 . 6.000 3.835 1.783 4.470 . 0 0 "[ . 1 . 2 . 3]" 1
818 1 62 TRP HD1 1 68 LEU HG 3.200 . 4.400 3.323 2.412 3.551 . 0 0 "[ . 1 . 2 . 3]" 1
819 1 62 TRP HE1 1 67 GLY H 5.800 . 6.000 4.247 3.958 4.451 . 0 0 "[ . 1 . 2 . 3]" 1
820 1 62 TRP HE1 1 68 LEU H 3.800 . 5.600 3.373 3.059 3.614 . 0 0 "[ . 1 . 2 . 3]" 1
821 1 62 TRP HE1 1 68 LEU HA 2.600 . 3.500 2.485 2.365 2.637 . 0 0 "[ . 1 . 2 . 3]" 1
822 1 62 TRP HE1 1 68 LEU HB2 6.000 . 6.000 4.854 4.741 5.111 . 0 0 "[ . 1 . 2 . 3]" 1
823 1 62 TRP HE1 1 68 LEU MD1 2.900 . 6.000 3.503 2.788 5.109 . 0 0 "[ . 1 . 2 . 3]" 1
824 1 62 TRP HE1 1 68 LEU MD2 3.900 . 6.000 4.346 2.260 5.003 . 0 0 "[ . 1 . 2 . 3]" 1
825 1 62 TRP HE1 1 68 LEU HG 4.000 . 6.000 3.503 2.825 4.328 . 0 0 "[ . 1 . 2 . 3]" 1
826 1 62 TRP HE1 1 70 TYR H 6.000 . 6.000 4.681 4.518 4.805 . 0 0 "[ . 1 . 2 . 3]" 1
827 1 62 TRP HE1 1 71 ALA H 3.400 . 4.800 3.662 3.537 3.876 . 0 0 "[ . 1 . 2 . 3]" 1
828 1 62 TRP HE1 1 71 ALA MB 3.200 . 4.500 4.064 3.962 4.244 . 0 0 "[ . 1 . 2 . 3]" 1
829 1 62 TRP HE1 1 72 PRO HB2 5.600 . 6.000 5.274 5.106 5.379 . 0 0 "[ . 1 . 2 . 3]" 1
830 1 62 TRP HE1 1 73 ARG H 3.600 . 5.200 3.457 2.891 3.605 . 0 0 "[ . 1 . 2 . 3]" 1
831 1 62 TRP HE1 1 73 ARG HA 3.400 . 4.800 3.779 3.539 4.094 . 0 0 "[ . 1 . 2 . 3]" 1
832 1 62 TRP HE1 1 77 ALA MB 6.000 . 6.000 4.632 4.298 5.515 . 0 0 "[ . 1 . 2 . 3]" 1
833 1 62 TRP HE1 1 85 VAL MG2 6.000 . 6.000 4.215 3.985 4.653 . 0 0 "[ . 1 . 2 . 3]" 1
834 1 62 TRP HE3 1 85 VAL MG1 3.400 . 4.900 2.680 2.458 3.185 . 0 0 "[ . 1 . 2 . 3]" 1
835 1 62 TRP HH2 1 71 ALA MB 3.700 . 5.400 4.194 3.869 4.385 . 0 0 "[ . 1 . 2 . 3]" 1
836 1 62 TRP HH2 1 77 ALA MB 2.600 . 3.400 2.276 1.955 3.578 0.178 10 0 "[ . 1 . 2 . 3]" 1
837 1 62 TRP HH2 1 82 GLN HA 3.200 . 4.500 2.427 1.863 3.079 0.037 28 0 "[ . 1 . 2 . 3]" 1
838 1 62 TRP HH2 1 82 GLN HB3 4.400 . 6.000 4.239 3.799 5.011 . 0 0 "[ . 1 . 2 . 3]" 1
839 1 62 TRP HH2 1 82 GLN HG2 3.700 . 5.400 3.039 1.932 5.130 0.068 24 0 "[ . 1 . 2 . 3]" 1
840 1 62 TRP HH2 1 85 VAL HB 3.800 . 5.600 4.266 3.944 4.826 . 0 0 "[ . 1 . 2 . 3]" 1
841 1 62 TRP HZ2 1 68 LEU HA 3.900 . 5.800 4.477 4.302 4.630 . 0 0 "[ . 1 . 2 . 3]" 1
842 1 62 TRP HZ2 1 70 TYR H 4.000 . 6.000 4.448 4.394 4.625 . 0 0 "[ . 1 . 2 . 3]" 1
843 1 62 TRP HZ2 1 70 TYR HB3 3.500 . 5.000 3.973 3.395 5.115 0.115 18 0 "[ . 1 . 2 . 3]" 1
844 1 62 TRP HZ2 1 71 ALA H 2.800 . 3.800 3.420 3.310 3.579 . 0 0 "[ . 1 . 2 . 3]" 1
845 1 62 TRP HZ2 1 71 ALA MB 2.400 . 3.100 2.741 2.483 2.919 . 0 0 "[ . 1 . 2 . 3]" 1
846 1 62 TRP HZ2 1 74 ALA HA 2.800 . 3.800 3.134 2.895 3.423 . 0 0 "[ . 1 . 2 . 3]" 1
847 1 62 TRP HZ2 1 74 ALA MB 3.200 . 6.000 4.323 4.131 4.529 . 0 0 "[ . 1 . 2 . 3]" 1
848 1 62 TRP HZ2 1 77 ALA H 4.100 . 6.000 4.202 4.126 4.350 . 0 0 "[ . 1 . 2 . 3]" 1
849 1 62 TRP HZ2 1 77 ALA MB 2.500 . 3.300 2.424 2.141 3.380 0.080 10 0 "[ . 1 . 2 . 3]" 1
850 1 62 TRP HZ2 1 81 GLU HG2 4.600 . 6.000 4.939 3.397 6.230 0.230 8 0 "[ . 1 . 2 . 3]" 1
851 1 62 TRP HZ3 1 74 ALA MB 2.400 . 6.000 2.676 2.418 2.842 . 0 0 "[ . 1 . 2 . 3]" 1
852 1 62 TRP HZ3 1 82 GLN HA 2.500 . 3.300 1.973 1.743 2.529 . 0 0 "[ . 1 . 2 . 3]" 1
853 1 63 GLU H 1 63 GLU HA 2.800 . 3.800 2.816 2.797 2.835 . 0 0 "[ . 1 . 2 . 3]" 1
854 1 63 GLU H 1 63 GLU HB3 2.200 . 2.800 2.328 2.046 2.445 . 0 0 "[ . 1 . 2 . 3]" 1
855 1 63 GLU H 1 64 ALA H 2.700 . 3.600 2.557 2.504 2.612 . 0 0 "[ . 1 . 2 . 3]" 1
856 1 63 GLU H 1 64 ALA MB 3.900 . 5.800 4.251 4.196 4.311 . 0 0 "[ . 1 . 2 . 3]" 1
857 1 63 GLU H 1 68 LEU MD1 5.000 . 6.000 3.757 3.311 4.819 . 0 0 "[ . 1 . 2 . 3]" 1
858 1 63 GLU HA 1 64 ALA H 3.300 . 4.700 3.502 3.482 3.524 . 0 0 "[ . 1 . 2 . 3]" 1
859 1 63 GLU HA 1 68 LEU H 2.900 . 3.900 3.201 2.952 3.362 . 0 0 "[ . 1 . 2 . 3]" 1
860 1 63 GLU HB3 1 68 LEU H 4.500 . 6.000 4.713 4.228 5.555 . 0 0 "[ . 1 . 2 . 3]" 1
861 1 63 GLU HB3 1 64 ALA H 2.500 . 3.300 2.797 2.663 3.348 0.048 8 0 "[ . 1 . 2 . 3]" 1
862 1 63 GLU HB3 1 67 GLY H 5.400 . 6.000 5.467 5.342 5.614 . 0 0 "[ . 1 . 2 . 3]" 1
863 1 64 ALA H 1 64 ALA HA 2.700 . 3.600 2.825 2.811 2.842 . 0 0 "[ . 1 . 2 . 3]" 1
864 1 64 ALA H 1 64 ALA MB 2.200 . 2.800 2.244 2.233 2.254 . 0 0 "[ . 1 . 2 . 3]" 1
865 1 64 ALA H 1 65 ASN H 2.700 . 3.600 2.688 2.556 2.780 . 0 0 "[ . 1 . 2 . 3]" 1
866 1 64 ALA H 1 65 ASN HB3 6.000 . 6.000 6.278 6.130 6.392 0.392 28 0 "[ . 1 . 2 . 3]" 1
867 1 64 ALA H 1 65 ASN HD21 4.700 . 6.000 4.829 3.908 5.624 . 0 0 "[ . 1 . 2 . 3]" 1
868 1 64 ALA HA 1 64 ALA MB 2.000 . 2.500 2.128 2.125 2.131 . 0 0 "[ . 1 . 2 . 3]" 1
869 1 64 ALA HA 1 65 ASN H 3.400 . 4.800 3.553 3.512 3.586 . 0 0 "[ . 1 . 2 . 3]" 1
870 1 64 ALA HA 1 66 GLY H 3.700 . 5.400 3.855 3.721 4.090 . 0 0 "[ . 1 . 2 . 3]" 1
871 1 64 ALA MB 1 65 ASN H 2.600 . 6.000 2.505 2.459 2.597 . 0 0 "[ . 1 . 2 . 3]" 1
872 1 64 ALA MB 1 65 ASN HD21 3.100 . 4.300 3.286 2.177 4.559 0.259 23 0 "[ . 1 . 2 . 3]" 1
873 1 64 ALA MB 1 65 ASN HD22 3.200 . 4.500 3.438 3.023 4.171 . 0 0 "[ . 1 . 2 . 3]" 1
874 1 64 ALA MB 1 66 GLY H 4.500 . 6.000 4.130 4.054 4.233 . 0 0 "[ . 1 . 2 . 3]" 1
875 1 65 ASN H 1 65 ASN HB2 2.700 . 3.600 2.543 2.390 2.747 . 0 0 "[ . 1 . 2 . 3]" 1
876 1 65 ASN H 1 65 ASN HB3 3.200 . 4.500 3.609 3.574 3.644 . 0 0 "[ . 1 . 2 . 3]" 1
877 1 65 ASN H 1 65 ASN HD21 3.000 . 4.100 2.724 1.874 3.581 0.026 6 0 "[ . 1 . 2 . 3]" 1
878 1 65 ASN H 1 65 ASN HD22 4.000 . 6.000 3.603 3.287 4.113 . 0 0 "[ . 1 . 2 . 3]" 1
879 1 65 ASN H 1 66 GLY H 2.500 . 3.300 2.421 2.324 2.479 . 0 0 "[ . 1 . 2 . 3]" 1
880 1 65 ASN H 1 67 GLY H 4.400 . 6.000 4.164 4.028 4.289 . 0 0 "[ . 1 . 2 . 3]" 1
881 1 65 ASN H 1 85 VAL MG1 4.000 . 6.000 3.648 3.185 6.228 0.228 26 0 "[ . 1 . 2 . 3]" 1
882 1 65 ASN H 1 88 VAL HB 5.400 . 6.000 5.204 5.077 5.357 . 0 0 "[ . 1 . 2 . 3]" 1
883 1 65 ASN H 1 88 VAL MG1 4.400 . 6.000 4.805 4.566 5.120 . 0 0 "[ . 1 . 2 . 3]" 1
884 1 65 ASN HA 1 65 ASN HB3 2.700 . 3.600 2.436 2.373 2.506 . 0 0 "[ . 1 . 2 . 3]" 1
885 1 65 ASN HA 1 66 GLY H 4.900 . 6.000 3.363 3.294 3.431 . 0 0 "[ . 1 . 2 . 3]" 1
886 1 65 ASN HA 1 88 VAL HB 4.500 . 6.000 3.790 3.290 4.124 . 0 0 "[ . 1 . 2 . 3]" 1
887 1 65 ASN HA 1 88 VAL MG1 2.900 . 3.900 2.708 2.292 3.031 . 0 0 "[ . 1 . 2 . 3]" 1
888 1 65 ASN HA 1 88 VAL MG2 5.200 . 6.000 3.623 3.104 4.078 . 0 0 "[ . 1 . 2 . 3]" 1
889 1 65 ASN HB2 1 65 ASN HD21 3.900 . 5.800 2.981 2.117 3.535 . 0 0 "[ . 1 . 2 . 3]" 1
890 1 65 ASN HB2 1 66 GLY H 4.000 . 6.000 3.281 3.079 3.469 . 0 0 "[ . 1 . 2 . 3]" 1
891 1 65 ASN HB2 1 67 GLY H 6.000 . 6.000 4.093 3.662 4.436 . 0 0 "[ . 1 . 2 . 3]" 1
892 1 65 ASN HB2 1 88 VAL MG2 4.900 . 6.000 3.860 3.599 4.108 . 0 0 "[ . 1 . 2 . 3]" 1
893 1 65 ASN HB2 1 89 THR H 6.000 . 6.000 4.772 4.490 5.205 . 0 0 "[ . 1 . 2 . 3]" 1
894 1 65 ASN HB3 1 65 ASN HD21 3.300 . 4.700 3.157 2.872 3.527 . 0 0 "[ . 1 . 2 . 3]" 1
895 1 65 ASN HB3 1 65 ASN HD22 3.800 . 5.600 3.897 3.754 4.076 . 0 0 "[ . 1 . 2 . 3]" 1
896 1 65 ASN HB3 1 66 GLY H 4.600 . 6.000 4.197 4.069 4.316 . 0 0 "[ . 1 . 2 . 3]" 1
897 1 65 ASN HB3 1 88 VAL H 5.400 . 6.000 4.081 3.755 4.412 . 0 0 "[ . 1 . 2 . 3]" 1
898 1 65 ASN HD21 1 89 THR MG 4.500 . 6.000 4.254 2.966 5.656 . 0 0 "[ . 1 . 2 . 3]" 1
899 1 65 ASN HD22 1 89 THR HA 4.200 . 6.000 3.467 2.624 4.362 . 0 0 "[ . 1 . 2 . 3]" 1
900 1 65 ASN HD22 1 89 THR MG 3.100 . 4.300 2.890 1.863 4.308 0.037 29 0 "[ . 1 . 2 . 3]" 1
901 1 66 GLY H 1 66 GLY HA2 2.400 . 3.100 2.342 2.307 2.389 . 0 0 "[ . 1 . 2 . 3]" 1
902 1 66 GLY H 1 66 GLY HA3 2.700 . 3.600 2.912 2.881 2.938 . 0 0 "[ . 1 . 2 . 3]" 1
903 1 66 GLY H 1 67 GLY H 2.900 . 3.900 2.460 2.235 2.600 . 0 0 "[ . 1 . 2 . 3]" 1
904 1 66 GLY H 1 67 GLY HA2 4.400 . 6.000 4.806 4.662 4.924 . 0 0 "[ . 1 . 2 . 3]" 1
905 1 66 GLY H 1 68 LEU H 5.800 . 6.000 4.432 4.167 4.520 . 0 0 "[ . 1 . 2 . 3]" 1
906 1 66 GLY H 1 68 LEU MD1 4.500 . 6.000 4.264 3.834 5.315 . 0 0 "[ . 1 . 2 . 3]" 1
907 1 66 GLY H 1 85 VAL MG1 4.500 . 6.000 3.801 3.211 6.221 0.221 26 0 "[ . 1 . 2 . 3]" 1
908 1 66 GLY HA2 1 67 GLY H 3.100 . 4.300 2.703 2.657 2.798 . 0 0 "[ . 1 . 2 . 3]" 1
909 1 66 GLY HA2 1 68 LEU H 3.000 . 4.100 3.309 3.056 3.499 . 0 0 "[ . 1 . 2 . 3]" 1
910 1 66 GLY HA3 1 67 GLY H 3.400 . 4.800 3.568 3.556 3.588 . 0 0 "[ . 1 . 2 . 3]" 1
911 1 66 GLY HA3 1 69 ARG H 4.500 . 6.000 4.752 4.536 4.867 . 0 0 "[ . 1 . 2 . 3]" 1
912 1 67 GLY H 1 67 GLY HA2 2.700 . 3.600 2.880 2.872 2.895 . 0 0 "[ . 1 . 2 . 3]" 1
913 1 67 GLY H 1 68 LEU H 2.700 . 3.600 2.408 2.279 2.462 . 0 0 "[ . 1 . 2 . 3]" 1
914 1 67 GLY H 1 68 LEU HA 6.000 . 6.000 4.845 4.764 4.898 . 0 0 "[ . 1 . 2 . 3]" 1
915 1 67 GLY H 1 68 LEU MD1 4.100 . 6.000 3.121 2.645 4.831 . 0 0 "[ . 1 . 2 . 3]" 1
916 1 67 GLY H 1 69 ARG H 3.300 . 4.700 4.424 4.155 4.559 . 0 0 "[ . 1 . 2 . 3]" 1
917 1 67 GLY H 1 85 VAL MG1 3.300 . 4.600 3.280 2.858 4.968 0.368 26 0 "[ . 1 . 2 . 3]" 1
918 1 67 GLY H 1 85 VAL MG2 3.800 . 5.600 3.645 3.083 3.950 . 0 0 "[ . 1 . 2 . 3]" 1
919 1 67 GLY HA2 1 68 LEU H 3.300 . 4.700 3.414 3.326 3.484 . 0 0 "[ . 1 . 2 . 3]" 1
920 1 67 GLY HA2 1 69 ARG H 4.300 . 6.000 3.815 3.555 3.999 . 0 0 "[ . 1 . 2 . 3]" 1
921 1 67 GLY HA2 1 70 TYR H 5.400 . 6.000 3.421 3.341 3.541 . 0 0 "[ . 1 . 2 . 3]" 1
922 1 67 GLY HA2 1 85 VAL H 6.000 . 6.000 5.078 4.834 5.194 . 0 0 "[ . 1 . 2 . 3]" 1
923 1 67 GLY HA3 1 70 TYR QE 4.300 . 6.000 4.258 3.954 4.613 . 0 0 "[ . 1 . 2 . 3]" 1
924 1 68 LEU H 1 68 LEU HA 2.400 . 3.100 2.760 2.723 2.798 . 0 0 "[ . 1 . 2 . 3]" 1
925 1 68 LEU H 1 68 LEU HB2 2.100 . 2.700 2.413 2.266 2.732 0.032 17 0 "[ . 1 . 2 . 3]" 1
926 1 68 LEU H 1 68 LEU HB3 3.100 . 4.300 3.539 3.493 3.596 . 0 0 "[ . 1 . 2 . 3]" 1
927 1 68 LEU H 1 68 LEU MD1 2.300 . 3.000 2.120 1.770 3.620 0.620 17 2 "[ - . 1 . + 2 . 3]" 1
928 1 68 LEU H 1 68 LEU MD2 3.200 . 6.000 3.719 2.565 3.968 . 0 0 "[ . 1 . 2 . 3]" 1
929 1 68 LEU H 1 68 LEU HG 2.700 . 3.600 3.031 1.764 3.446 0.036 10 0 "[ . 1 . 2 . 3]" 1
930 1 68 LEU H 1 69 ARG H 2.400 . 3.100 2.693 2.574 2.789 . 0 0 "[ . 1 . 2 . 3]" 1
931 1 68 LEU H 1 69 ARG HA 6.000 . 6.000 5.263 5.166 5.331 . 0 0 "[ . 1 . 2 . 3]" 1
932 1 68 LEU H 1 70 TYR H 4.400 . 6.000 4.157 4.000 4.260 . 0 0 "[ . 1 . 2 . 3]" 1
933 1 68 LEU H 1 71 ALA H 4.800 . 6.000 4.459 4.383 4.589 . 0 0 "[ . 1 . 2 . 3]" 1
934 1 68 LEU H 1 72 PRO HD3 6.000 . 6.000 6.143 6.077 6.192 0.192 10 0 "[ . 1 . 2 . 3]" 1
935 1 68 LEU H 1 85 VAL MG2 6.000 . 6.000 4.645 4.489 4.814 . 0 0 "[ . 1 . 2 . 3]" 1
936 1 68 LEU HA 1 68 LEU MD1 2.300 . 6.000 3.179 2.814 3.953 . 0 0 "[ . 1 . 2 . 3]" 1
937 1 68 LEU HA 1 68 LEU MD2 2.700 . 6.000 3.354 2.186 3.676 . 0 0 "[ . 1 . 2 . 3]" 1
938 1 68 LEU HA 1 69 ARG H 2.900 . 4.000 3.448 3.387 3.488 . 0 0 "[ . 1 . 2 . 3]" 1
939 1 68 LEU HA 1 70 TYR H 3.400 . 4.800 3.910 3.800 3.967 . 0 0 "[ . 1 . 2 . 3]" 1
940 1 68 LEU HA 1 71 ALA H 2.400 . 3.100 2.914 2.723 3.110 0.010 17 0 "[ . 1 . 2 . 3]" 1
941 1 68 LEU HB2 1 69 ARG H 2.800 . 3.800 2.999 2.744 3.181 . 0 0 "[ . 1 . 2 . 3]" 1
942 1 68 LEU HB3 1 69 ARG H 3.400 . 4.900 3.856 3.634 4.113 . 0 0 "[ . 1 . 2 . 3]" 1
943 1 68 LEU MD2 1 69 ARG H 3.800 . 6.000 4.956 4.426 5.158 . 0 0 "[ . 1 . 2 . 3]" 1
944 1 69 ARG H 1 69 ARG HA 2.400 . 3.100 2.831 2.818 2.842 . 0 0 "[ . 1 . 2 . 3]" 1
945 1 69 ARG H 1 69 ARG HB3 2.100 . 2.600 2.576 2.370 2.661 0.061 25 0 "[ . 1 . 2 . 3]" 1
946 1 69 ARG H 1 69 ARG HG3 2.400 . 3.100 3.059 2.557 3.717 0.617 17 1 "[ . 1 . + 2 . 3]" 1
947 1 69 ARG H 1 70 TYR H 2.300 . 3.000 2.484 2.402 2.551 . 0 0 "[ . 1 . 2 . 3]" 1
948 1 69 ARG H 1 70 TYR HA 6.000 . 6.000 5.160 5.069 5.218 . 0 0 "[ . 1 . 2 . 3]" 1
949 1 69 ARG H 1 70 TYR HB2 4.800 . 6.000 4.683 4.500 4.849 . 0 0 "[ . 1 . 2 . 3]" 1
950 1 69 ARG H 1 71 ALA H 3.400 . 4.900 3.609 3.484 3.708 . 0 0 "[ . 1 . 2 . 3]" 1
951 1 69 ARG HA 1 69 ARG HB3 2.100 . 2.600 2.448 2.394 2.569 . 0 0 "[ . 1 . 2 . 3]" 1
952 1 69 ARG HA 1 69 ARG HG3 2.300 . 6.000 3.675 3.553 3.805 . 0 0 "[ . 1 . 2 . 3]" 1
953 1 69 ARG HA 1 70 TYR H 3.000 . 4.100 3.481 3.460 3.501 . 0 0 "[ . 1 . 2 . 3]" 1
954 1 69 ARG HA 1 71 ALA H 3.900 . 5.800 4.180 4.086 4.308 . 0 0 "[ . 1 . 2 . 3]" 1
955 1 69 ARG HB2 1 69 ARG HD2 4.000 . 6.000 3.222 2.422 3.732 . 0 0 "[ . 1 . 2 . 3]" 1
956 1 69 ARG HB2 1 70 TYR H 3.200 . 4.500 3.876 3.745 4.139 . 0 0 "[ . 1 . 2 . 3]" 1
957 1 69 ARG HB2 1 70 TYR QD 2.900 . 6.000 4.974 4.770 5.176 . 0 0 "[ . 1 . 2 . 3]" 1
958 1 69 ARG HB2 1 71 ALA H 3.100 . 6.000 5.438 5.350 5.657 . 0 0 "[ . 1 . 2 . 3]" 1
959 1 69 ARG HB3 1 69 ARG HE 3.300 . 4.600 3.029 2.011 4.495 . 0 0 "[ . 1 . 2 . 3]" 1
960 1 69 ARG HD2 1 69 ARG HG3 2.300 . 3.000 2.717 2.261 3.023 0.023 4 0 "[ . 1 . 2 . 3]" 1
961 1 69 ARG HD3 1 69 ARG HE 2.400 . 3.100 2.810 2.544 2.957 . 0 0 "[ . 1 . 2 . 3]" 1
962 1 69 ARG HD3 1 70 TYR QE 3.600 . 5.200 3.506 2.486 4.608 . 0 0 "[ . 1 . 2 . 3]" 1
963 1 69 ARG HE 1 69 ARG HG2 2.500 . 3.300 3.107 2.226 3.691 0.391 28 0 "[ . 1 . 2 . 3]" 1
964 1 69 ARG HG2 1 70 TYR H 2.500 . 3.300 2.816 2.324 3.373 0.073 5 0 "[ . 1 . 2 . 3]" 1
965 1 69 ARG HG2 1 70 TYR QD 2.700 . 6.000 3.089 2.297 3.547 . 0 0 "[ . 1 . 2 . 3]" 1
966 1 69 ARG HG2 1 70 TYR QE 3.000 . 6.000 3.188 2.968 3.387 . 0 0 "[ . 1 . 2 . 3]" 1
967 1 69 ARG HG3 1 71 ALA H 4.000 . 6.000 4.322 4.017 4.916 . 0 0 "[ . 1 . 2 . 3]" 1
968 1 70 TYR H 1 70 TYR HA 2.800 . 3.800 2.896 2.872 2.937 . 0 0 "[ . 1 . 2 . 3]" 1
969 1 70 TYR H 1 70 TYR HB2 2.500 . 3.300 2.435 2.297 2.603 . 0 0 "[ . 1 . 2 . 3]" 1
970 1 70 TYR H 1 70 TYR HB3 3.300 . 4.700 3.558 3.496 3.625 . 0 0 "[ . 1 . 2 . 3]" 1
971 1 70 TYR H 1 70 TYR QD 2.400 . 6.000 2.303 1.996 2.550 . 0 0 "[ . 1 . 2 . 3]" 1
972 1 70 TYR H 1 70 TYR QE 4.000 . 6.000 4.139 4.099 4.191 . 0 0 "[ . 1 . 2 . 3]" 1
973 1 70 TYR H 1 71 ALA H 2.200 . 2.800 2.062 1.888 2.127 . 0 0 "[ . 1 . 2 . 3]" 1
974 1 70 TYR H 1 71 ALA HA 5.400 . 6.000 4.591 4.464 4.632 . 0 0 "[ . 1 . 2 . 3]" 1
975 1 70 TYR H 1 85 VAL MG2 6.000 . 6.000 4.372 4.067 5.869 . 0 0 "[ . 1 . 2 . 3]" 1
976 1 70 TYR HA 1 70 TYR HB2 3.000 . 4.100 3.025 2.999 3.034 . 0 0 "[ . 1 . 2 . 3]" 1
977 1 70 TYR HA 1 70 TYR HB3 2.800 . 3.800 2.455 2.379 2.511 . 0 0 "[ . 1 . 2 . 3]" 1
978 1 70 TYR HA 1 70 TYR QE 4.100 . 6.000 4.755 4.671 4.888 . 0 0 "[ . 1 . 2 . 3]" 1
979 1 70 TYR HA 1 71 ALA H 3.300 . 4.700 3.419 3.384 3.442 . 0 0 "[ . 1 . 2 . 3]" 1
980 1 70 TYR HA 1 81 GLU HB3 4.500 . 6.000 4.443 3.691 6.010 0.010 17 0 "[ . 1 . 2 . 3]" 1
981 1 70 TYR HB2 1 70 TYR QD 2.400 . 3.100 2.299 2.223 2.398 . 0 0 "[ . 1 . 2 . 3]" 1
982 1 70 TYR HB2 1 70 TYR QE 4.500 . 6.000 4.357 4.319 4.396 . 0 0 "[ . 1 . 2 . 3]" 1
983 1 70 TYR HB2 1 71 ALA H 2.600 . 3.400 2.523 2.411 2.617 . 0 0 "[ . 1 . 2 . 3]" 1
984 1 70 TYR HB3 1 70 TYR QD 2.300 . 3.000 2.472 2.385 2.532 . 0 0 "[ . 1 . 2 . 3]" 1
985 1 70 TYR HB3 1 71 ALA H 3.600 . 5.300 3.736 3.605 3.897 . 0 0 "[ . 1 . 2 . 3]" 1
986 1 70 TYR QD 1 71 ALA H 3.600 . 6.000 3.579 3.427 3.656 . 0 0 "[ . 1 . 2 . 3]" 1
987 1 70 TYR QD 1 81 GLU HG2 2.700 . 6.000 3.425 1.881 4.812 . 0 0 "[ . 1 . 2 . 3]" 1
988 1 70 TYR QD 1 84 ALA MB 3.000 . 6.000 3.644 3.297 4.163 . 0 0 "[ . 1 . 2 . 3]" 1
989 1 70 TYR QD 1 85 VAL MG2 2.600 . 6.000 2.549 2.224 4.036 . 0 0 "[ . 1 . 2 . 3]" 1
990 1 70 TYR QE 1 84 ALA MB 2.700 . 3.600 2.741 2.190 3.391 . 0 0 "[ . 1 . 2 . 3]" 1
991 1 70 TYR QE 1 85 VAL H 4.600 . 6.000 4.448 4.194 4.526 . 0 0 "[ . 1 . 2 . 3]" 1
992 1 70 TYR QE 1 85 VAL HA 4.000 . 6.000 3.864 3.348 4.231 . 0 0 "[ . 1 . 2 . 3]" 1
993 1 70 TYR QE 1 85 VAL MG2 2.400 . 6.000 2.520 1.943 3.725 . 0 0 "[ . 1 . 2 . 3]" 1
994 1 71 ALA H 1 71 ALA HA 3.000 . 4.100 2.713 2.676 2.795 . 0 0 "[ . 1 . 2 . 3]" 1
995 1 71 ALA H 1 71 ALA MB 2.600 . 6.000 3.011 2.910 3.053 . 0 0 "[ . 1 . 2 . 3]" 1
996 1 71 ALA H 1 72 PRO HB3 6.000 . 6.000 6.088 5.737 6.146 0.146 14 0 "[ . 1 . 2 . 3]" 1
997 1 71 ALA H 1 72 PRO HD2 3.900 . 5.800 4.672 4.507 4.745 . 0 0 "[ . 1 . 2 . 3]" 1
998 1 71 ALA H 1 72 PRO HD3 4.500 . 6.000 3.769 3.658 4.060 . 0 0 "[ . 1 . 2 . 3]" 1
999 1 71 ALA H 1 73 ARG H 4.200 . 6.000 4.530 4.295 4.597 . 0 0 "[ . 1 . 2 . 3]" 1
1000 1 71 ALA HA 1 71 ALA MB 2.100 . 2.600 2.144 2.137 2.147 . 0 0 "[ . 1 . 2 . 3]" 1
1001 1 71 ALA HA 1 73 ARG H 4.100 . 6.000 3.720 3.568 3.899 . 0 0 "[ . 1 . 2 . 3]" 1
1002 1 71 ALA MB 1 72 PRO HD2 3.000 . 4.200 2.896 2.747 3.083 . 0 0 "[ . 1 . 2 . 3]" 1
1003 1 71 ALA MB 1 73 ARG H 2.300 . 3.000 2.580 2.521 2.683 . 0 0 "[ . 1 . 2 . 3]" 1
1004 1 71 ALA MB 1 75 ASP H 5.200 . 6.000 5.040 4.855 5.092 . 0 0 "[ . 1 . 2 . 3]" 1
1005 1 71 ALA MB 1 76 LEU H 3.200 . 4.500 3.472 3.177 3.610 . 0 0 "[ . 1 . 2 . 3]" 1
1006 1 71 ALA MB 1 76 LEU HA 2.700 . 6.000 4.116 3.960 4.312 . 0 0 "[ . 1 . 2 . 3]" 1
1007 1 71 ALA MB 1 77 ALA H 2.600 . 3.400 2.510 2.308 2.664 . 0 0 "[ . 1 . 2 . 3]" 1
1008 1 71 ALA MB 1 78 THR H 2.700 . 6.000 4.506 4.280 4.707 . 0 0 "[ . 1 . 2 . 3]" 1
1009 1 72 PRO HA 1 72 PRO HB2 2.100 . 2.700 2.890 2.714 2.913 0.213 23 0 "[ . 1 . 2 . 3]" 1
1010 1 72 PRO HA 1 73 ARG H 2.700 . 3.600 3.324 2.986 3.368 . 0 0 "[ . 1 . 2 . 3]" 1
1011 1 72 PRO HB2 1 73 ARG H 3.400 . 4.800 3.488 3.351 4.197 . 0 0 "[ . 1 . 2 . 3]" 1
1012 1 72 PRO HB3 1 73 ARG H 3.100 . 6.000 4.434 4.373 4.620 . 0 0 "[ . 1 . 2 . 3]" 1
1013 1 72 PRO HD2 1 72 PRO HG3 3.000 . 4.100 2.928 2.700 2.956 . 0 0 "[ . 1 . 2 . 3]" 1
1014 1 72 PRO HD2 1 73 ARG H 3.700 . 5.400 3.191 3.098 3.769 . 0 0 "[ . 1 . 2 . 3]" 1
1015 1 72 PRO HG2 1 73 ARG H 4.300 . 6.000 4.440 4.086 4.503 . 0 0 "[ . 1 . 2 . 3]" 1
1016 1 72 PRO HG2 1 73 ARG QD 5.000 . 6.000 5.038 3.761 5.848 . 0 0 "[ . 1 . 2 . 3]" 1
1017 1 72 PRO HG3 1 73 ARG H 3.200 . 6.000 4.893 4.841 5.182 . 0 0 "[ . 1 . 2 . 3]" 1
1018 1 73 ARG H 1 73 ARG HA 2.800 . 3.800 2.900 2.798 2.917 . 0 0 "[ . 1 . 2 . 3]" 1
1019 1 73 ARG H 1 73 ARG HB2 3.900 . 5.800 3.943 3.911 4.074 . 0 0 "[ . 1 . 2 . 3]" 1
1020 1 73 ARG H 1 73 ARG HB3 3.200 . 4.400 3.301 3.240 3.503 . 0 0 "[ . 1 . 2 . 3]" 1
1021 1 73 ARG H 1 73 ARG QD 6.000 . 6.000 4.107 3.895 4.482 . 0 0 "[ . 1 . 2 . 3]" 1
1022 1 73 ARG H 1 73 ARG HG2 2.200 . 2.800 2.422 2.319 2.796 . 0 0 "[ . 1 . 2 . 3]" 1
1023 1 73 ARG H 1 73 ARG HG3 3.600 . 5.200 3.568 3.353 3.829 . 0 0 "[ . 1 . 2 . 3]" 1
1024 1 73 ARG H 1 74 ALA H 3.600 . 5.200 4.226 4.107 4.278 . 0 0 "[ . 1 . 2 . 3]" 1
1025 1 73 ARG HA 1 73 ARG HG3 2.400 . 6.000 3.784 3.686 3.883 . 0 0 "[ . 1 . 2 . 3]" 1
1026 1 73 ARG HB2 1 73 ARG HE 4.400 . 6.000 2.856 2.462 4.410 . 0 0 "[ . 1 . 2 . 3]" 1
1027 1 73 ARG HB2 1 75 ASP H 4.300 . 6.000 2.988 2.771 3.112 . 0 0 "[ . 1 . 2 . 3]" 1
1028 1 73 ARG HB3 1 73 ARG QD 2.700 . 3.600 2.280 2.089 2.423 . 0 0 "[ . 1 . 2 . 3]" 1
1029 1 73 ARG HB3 1 73 ARG HE 3.400 . 4.800 3.698 3.369 4.744 . 0 0 "[ . 1 . 2 . 3]" 1
1030 1 73 ARG HB3 1 74 ALA H 3.700 . 5.400 4.105 3.976 4.195 . 0 0 "[ . 1 . 2 . 3]" 1
1031 1 73 ARG HB3 1 75 ASP H 4.800 . 6.000 4.545 4.343 4.638 . 0 0 "[ . 1 . 2 . 3]" 1
1032 1 73 ARG HB3 1 76 LEU H 5.600 . 6.000 4.897 4.646 5.235 . 0 0 "[ . 1 . 2 . 3]" 1
1033 1 73 ARG QD 1 73 ARG HG2 4.300 . 6.000 2.169 2.137 2.351 . 0 0 "[ . 1 . 2 . 3]" 1
1034 1 73 ARG QD 1 73 ARG HG3 2.600 . 3.400 2.417 2.319 2.530 . 0 0 "[ . 1 . 2 . 3]" 1
1035 1 73 ARG QD 1 75 ASP QB 6.000 . 6.000 4.979 2.701 5.252 . 0 0 "[ . 1 . 2 . 3]" 1
1036 1 73 ARG QD 1 76 LEU HB3 4.100 . 6.000 3.659 3.041 4.550 . 0 0 "[ . 1 . 2 . 3]" 1
1037 1 73 ARG HE 1 73 ARG HG2 3.400 . 4.900 3.571 3.157 3.754 . 0 0 "[ . 1 . 2 . 3]" 1
1038 1 73 ARG HE 1 73 ARG HG3 2.600 . 3.500 2.394 2.164 2.827 . 0 0 "[ . 1 . 2 . 3]" 1
1039 1 73 ARG HE 1 75 ASP H 4.500 . 6.000 3.607 3.273 4.330 . 0 0 "[ . 1 . 2 . 3]" 1
1040 1 73 ARG HE 1 76 LEU HB2 3.000 . 4.100 3.858 2.943 4.120 0.020 19 0 "[ . 1 . 2 . 3]" 1
1041 1 73 ARG HG3 1 74 ALA H 3.200 . 4.500 4.022 3.901 4.106 . 0 0 "[ . 1 . 2 . 3]" 1
1042 1 73 ARG HG3 1 75 ASP H 2.900 . 4.000 2.684 2.410 2.842 . 0 0 "[ . 1 . 2 . 3]" 1
1043 1 73 ARG HG3 1 75 ASP HA 2.700 . 6.000 4.667 4.499 4.759 . 0 0 "[ . 1 . 2 . 3]" 1
1044 1 74 ALA H 1 74 ALA HA 2.700 . 3.600 2.771 2.748 2.819 . 0 0 "[ . 1 . 2 . 3]" 1
1045 1 74 ALA H 1 74 ALA MB 2.500 . 3.300 2.197 2.142 2.240 . 0 0 "[ . 1 . 2 . 3]" 1
1046 1 74 ALA H 1 75 ASP H 3.400 . 4.900 2.770 2.626 2.859 . 0 0 "[ . 1 . 2 . 3]" 1
1047 1 74 ALA H 1 76 LEU HB3 6.000 . 6.000 5.526 5.445 5.681 . 0 0 "[ . 1 . 2 . 3]" 1
1048 1 74 ALA MB 1 75 ASP H 2.800 . 6.000 2.871 2.710 2.981 . 0 0 "[ . 1 . 2 . 3]" 1
1049 1 74 ALA MB 1 82 GLN HG2 3.100 . 6.000 2.700 1.892 4.121 . 0 0 "[ . 1 . 2 . 3]" 1
1050 1 75 ASP H 1 75 ASP HA 3.000 . 4.200 2.887 2.861 2.901 . 0 0 "[ . 1 . 2 . 3]" 1
1051 1 75 ASP H 1 75 ASP QB 2.900 . 4.000 2.661 2.089 2.889 . 0 0 "[ . 1 . 2 . 3]" 1
1052 1 75 ASP H 1 76 LEU H 2.600 . 3.400 2.436 2.285 2.559 . 0 0 "[ . 1 . 2 . 3]" 1
1053 1 75 ASP H 1 76 LEU HB2 4.500 . 6.000 4.689 4.445 4.817 . 0 0 "[ . 1 . 2 . 3]" 1
1054 1 75 ASP H 1 76 LEU HB3 4.400 . 6.000 4.622 4.460 4.717 . 0 0 "[ . 1 . 2 . 3]" 1
1055 1 75 ASP H 1 77 ALA H 4.700 . 6.000 3.954 3.738 4.477 . 0 0 "[ . 1 . 2 . 3]" 1
1056 1 75 ASP HA 1 75 ASP QB 2.600 . 3.100 2.171 2.151 2.188 . 0 0 "[ . 1 . 2 . 3]" 1
1057 1 76 LEU H 1 76 LEU HA 2.700 . 3.600 2.929 2.901 2.946 . 0 0 "[ . 1 . 2 . 3]" 1
1058 1 76 LEU H 1 76 LEU HB2 2.600 . 3.500 2.825 2.666 3.018 . 0 0 "[ . 1 . 2 . 3]" 1
1059 1 76 LEU H 1 76 LEU HB3 3.000 . 4.100 2.494 2.434 2.589 . 0 0 "[ . 1 . 2 . 3]" 1
1060 1 76 LEU H 1 76 LEU MD2 3.300 . 4.700 4.348 4.273 4.435 . 0 0 "[ . 1 . 2 . 3]" 1
1061 1 76 LEU H 1 77 ALA H 2.300 . 2.900 2.050 1.884 2.241 . 0 0 "[ . 1 . 2 . 3]" 1
1062 1 76 LEU HA 1 76 LEU HB2 2.000 . 2.500 2.464 2.441 2.491 . 0 0 "[ . 1 . 2 . 3]" 1
1063 1 76 LEU MD2 1 77 ALA H 2.500 . 6.000 4.440 4.345 4.512 . 0 0 "[ . 1 . 2 . 3]" 1
1064 1 76 LEU HG 1 77 ALA H 3.400 . 4.800 3.976 3.885 4.034 . 0 0 "[ . 1 . 2 . 3]" 1
1065 1 77 ALA H 1 77 ALA MB 2.200 . 6.000 2.230 2.186 2.389 . 0 0 "[ . 1 . 2 . 3]" 1
1066 1 77 ALA H 1 78 THR H 5.700 . 6.000 4.554 4.448 4.593 . 0 0 "[ . 1 . 2 . 3]" 1
1067 1 77 ALA H 1 81 GLU HB2 6.000 . 6.000 5.223 4.880 5.806 . 0 0 "[ . 1 . 2 . 3]" 1
1068 1 77 ALA HA 1 77 ALA MB 2.400 . 3.100 2.130 2.113 2.136 . 0 0 "[ . 1 . 2 . 3]" 1
1069 1 77 ALA HA 1 78 THR H 3.300 . 4.600 2.368 2.200 2.534 . 0 0 "[ . 1 . 2 . 3]" 1
1070 1 77 ALA MB 1 78 THR H 2.700 . 3.600 2.460 2.083 2.791 . 0 0 "[ . 1 . 2 . 3]" 1
1071 1 78 THR H 1 78 THR HB 4.500 . 6.000 3.676 3.600 3.754 . 0 0 "[ . 1 . 2 . 3]" 1
1072 1 78 THR H 1 78 THR MG 2.400 . 6.000 2.345 2.034 2.601 . 0 0 "[ . 1 . 2 . 3]" 1
1073 1 78 THR H 1 81 GLU H 4.100 . 6.000 3.428 3.273 3.798 . 0 0 "[ . 1 . 2 . 3]" 1
1074 1 78 THR H 1 81 GLU HB2 3.900 . 5.900 2.574 1.813 4.293 0.087 9 0 "[ . 1 . 2 . 3]" 1
1075 1 78 THR H 1 81 GLU HG3 4.500 . 6.000 4.068 1.995 5.141 . 0 0 "[ . 1 . 2 . 3]" 1
1076 1 78 THR HA 1 78 THR HB 2.200 . 2.800 2.428 2.376 2.516 . 0 0 "[ . 1 . 2 . 3]" 1
1077 1 78 THR HA 1 79 ARG H 2.500 . 3.300 2.661 2.451 2.750 . 0 0 "[ . 1 . 2 . 3]" 1
1078 1 78 THR HA 1 80 GLU H 6.000 . 6.000 4.798 4.404 4.874 . 0 0 "[ . 1 . 2 . 3]" 1
1079 1 78 THR HB 1 79 ARG H 2.400 . 3.100 2.051 1.964 2.367 . 0 0 "[ . 1 . 2 . 3]" 1
1080 1 78 THR HB 1 80 GLU H 3.400 . 4.900 3.626 3.323 3.898 . 0 0 "[ . 1 . 2 . 3]" 1
1081 1 78 THR MG 1 79 ARG H 3.600 . 5.300 3.629 3.515 3.748 . 0 0 "[ . 1 . 2 . 3]" 1
1082 1 78 THR MG 1 80 GLU H 4.300 . 6.000 4.710 4.537 4.786 . 0 0 "[ . 1 . 2 . 3]" 1
1083 1 78 THR MG 1 81 GLU H 2.500 . 6.000 4.659 4.371 4.879 . 0 0 "[ . 1 . 2 . 3]" 1
1084 1 79 ARG H 1 79 ARG HA 2.800 . 3.800 2.746 2.711 2.781 . 0 0 "[ . 1 . 2 . 3]" 1
1085 1 79 ARG H 1 79 ARG QD 5.600 . 6.000 3.761 2.618 3.987 . 0 0 "[ . 1 . 2 . 3]" 1
1086 1 79 ARG H 1 79 ARG HG3 2.300 . 3.000 2.226 1.796 3.937 0.937 10 1 "[ . + . 2 . 3]" 1
1087 1 79 ARG H 1 80 GLU H 2.900 . 4.000 2.886 2.796 2.964 . 0 0 "[ . 1 . 2 . 3]" 1
1088 1 79 ARG H 1 80 GLU HB3 5.800 . 6.000 5.424 5.223 5.613 . 0 0 "[ . 1 . 2 . 3]" 1
1089 1 79 ARG H 1 82 GLN HE21 5.500 . 6.000 5.386 4.855 6.727 0.727 15 5 "[ . 1 *+ *- 2 * 3]" 1
1090 1 79 ARG HA 1 79 ARG HB2 3.000 . 4.100 2.995 2.336 3.029 . 0 0 "[ . 1 . 2 . 3]" 1
1091 1 79 ARG HA 1 79 ARG HB3 2.900 . 3.900 2.468 2.308 2.544 . 0 0 "[ . 1 . 2 . 3]" 1
1092 1 79 ARG HA 1 79 ARG HG2 3.100 . 4.300 2.599 2.350 3.753 . 0 0 "[ . 1 . 2 . 3]" 1
1093 1 79 ARG HA 1 79 ARG HG3 3.000 . 4.100 3.203 3.047 3.976 . 0 0 "[ . 1 . 2 . 3]" 1
1094 1 79 ARG HA 1 80 GLU H 3.500 . 5.000 3.533 3.497 3.564 . 0 0 "[ . 1 . 2 . 3]" 1
1095 1 79 ARG HA 1 82 GLN HE21 4.500 . 6.000 4.459 3.673 5.455 . 0 0 "[ . 1 . 2 . 3]" 1
1096 1 79 ARG HA 1 82 GLN HG3 3.200 . 6.000 4.380 3.258 5.895 . 0 0 "[ . 1 . 2 . 3]" 1
1097 1 79 ARG HB2 1 80 GLU H 2.700 . 3.600 2.382 2.206 3.962 0.362 10 0 "[ . 1 . 2 . 3]" 1
1098 1 79 ARG HB3 1 79 ARG QD 4.000 . 6.000 2.594 2.133 2.994 . 0 0 "[ . 1 . 2 . 3]" 1
1099 1 79 ARG HB3 1 79 ARG HG2 2.500 . 3.300 2.489 2.386 3.001 . 0 0 "[ . 1 . 2 . 3]" 1
1100 1 79 ARG HB3 1 80 GLU HA 4.500 . 6.000 4.219 3.914 5.518 . 0 0 "[ . 1 . 2 . 3]" 1
1101 1 79 ARG QD 1 79 ARG HE 3.600 . 4.100 2.377 2.220 2.494 . 0 0 "[ . 1 . 2 . 3]" 1
1102 1 79 ARG QD 1 79 ARG HG2 3.100 . 4.300 2.393 2.129 2.527 . 0 0 "[ . 1 . 2 . 3]" 1
1103 1 79 ARG QD 1 79 ARG HG3 3.100 . 4.300 2.189 2.132 2.514 . 0 0 "[ . 1 . 2 . 3]" 1
1104 1 79 ARG QD 1 80 GLU H 5.400 . 6.000 4.517 4.054 4.674 . 0 0 "[ . 1 . 2 . 3]" 1
1105 1 79 ARG HE 1 83 ILE MD 3.500 . 6.000 3.987 3.061 5.025 . 0 0 "[ . 1 . 2 . 3]" 1
1106 1 79 ARG HG3 1 80 GLU H 3.600 . 5.200 4.087 2.808 4.294 . 0 0 "[ . 1 . 2 . 3]" 1
1107 1 80 GLU H 1 80 GLU HA 2.900 . 3.900 2.794 2.779 2.815 . 0 0 "[ . 1 . 2 . 3]" 1
1108 1 80 GLU H 1 80 GLU HB2 3.200 . 4.500 3.567 3.509 3.625 . 0 0 "[ . 1 . 2 . 3]" 1
1109 1 80 GLU H 1 80 GLU HB3 2.700 . 3.600 2.647 2.404 2.882 . 0 0 "[ . 1 . 2 . 3]" 1
1110 1 80 GLU H 1 80 GLU HG3 3.500 . 5.000 3.379 2.710 3.642 . 0 0 "[ . 1 . 2 . 3]" 1
1111 1 80 GLU H 1 81 GLU H 3.100 . 4.300 2.787 2.666 2.951 . 0 0 "[ . 1 . 2 . 3]" 1
1112 1 80 GLU H 1 82 GLN H 4.300 . 6.000 4.345 4.277 4.414 . 0 0 "[ . 1 . 2 . 3]" 1
1113 1 80 GLU HA 1 80 GLU HB3 2.400 . 3.100 2.371 2.268 2.518 . 0 0 "[ . 1 . 2 . 3]" 1
1114 1 80 GLU HA 1 80 GLU QG 3.500 . 5.000 3.379 3.321 3.454 . 0 0 "[ . 1 . 2 . 3]" 1
1115 1 80 GLU HA 1 81 GLU H 4.300 . 6.000 3.552 3.489 3.621 . 0 0 "[ . 1 . 2 . 3]" 1
1116 1 80 GLU HA 1 83 ILE H 3.700 . 5.400 3.629 3.310 3.888 . 0 0 "[ . 1 . 2 . 3]" 1
1117 1 80 GLU HA 1 84 ALA H 4.400 . 6.000 4.173 3.904 4.419 . 0 0 "[ . 1 . 2 . 3]" 1
1118 1 81 GLU H 1 81 GLU HA 2.900 . 4.000 2.817 2.760 2.854 . 0 0 "[ . 1 . 2 . 3]" 1
1119 1 81 GLU H 1 81 GLU HB2 2.700 . 3.600 2.451 2.072 3.300 . 0 0 "[ . 1 . 2 . 3]" 1
1120 1 81 GLU H 1 81 GLU HB3 3.300 . 4.600 3.387 1.963 3.634 0.037 10 0 "[ . 1 . 2 . 3]" 1
1121 1 81 GLU H 1 81 GLU HG2 2.700 . 3.600 3.716 1.889 4.223 0.623 29 5 "[* . 1 -. 2 .* *+3]" 1
1122 1 81 GLU H 1 81 GLU HG3 3.000 . 4.100 3.438 2.712 4.450 0.350 10 0 "[ . 1 . 2 . 3]" 1
1123 1 81 GLU H 1 82 GLN H 2.900 . 3.900 2.728 2.558 2.907 . 0 0 "[ . 1 . 2 . 3]" 1
1124 1 81 GLU H 1 83 ILE H 4.200 . 6.000 4.002 3.763 4.229 . 0 0 "[ . 1 . 2 . 3]" 1
1125 1 81 GLU H 1 84 ALA MB 4.300 . 6.000 4.812 4.660 4.910 . 0 0 "[ . 1 . 2 . 3]" 1
1126 1 81 GLU HA 1 84 ALA H 3.100 . 4.300 3.395 2.887 3.611 . 0 0 "[ . 1 . 2 . 3]" 1
1127 1 81 GLU HB3 1 82 GLN H 2.900 . 4.000 3.244 2.871 3.676 . 0 0 "[ . 1 . 2 . 3]" 1
1128 1 81 GLU HB3 1 84 ALA H 5.000 . 6.000 5.199 4.809 5.525 . 0 0 "[ . 1 . 2 . 3]" 1
1129 1 81 GLU HG3 1 84 ALA H 3.600 . 6.000 5.844 4.813 6.960 0.960 3 3 "[ + . *- 1 . 2 . 3]" 1
1130 1 82 GLN H 1 82 GLN HB3 3.300 . 4.600 3.382 2.244 3.635 . 0 0 "[ . 1 . 2 . 3]" 1
1131 1 82 GLN H 1 82 GLN HG2 3.400 . 4.800 3.578 3.029 4.352 . 0 0 "[ . 1 . 2 . 3]" 1
1132 1 82 GLN H 1 82 GLN HG3 3.300 . 4.700 2.894 2.083 4.433 . 0 0 "[ . 1 . 2 . 3]" 1
1133 1 82 GLN H 1 83 ILE H 2.900 . 4.000 2.603 2.506 2.693 . 0 0 "[ . 1 . 2 . 3]" 1
1134 1 82 GLN H 1 84 ALA H 5.600 . 6.000 4.135 4.001 4.266 . 0 0 "[ . 1 . 2 . 3]" 1
1135 1 82 GLN HA 1 82 GLN HG2 3.700 . 5.400 2.796 2.254 3.599 . 0 0 "[ . 1 . 2 . 3]" 1
1136 1 82 GLN HA 1 83 ILE H 4.600 . 6.000 3.489 3.459 3.518 . 0 0 "[ . 1 . 2 . 3]" 1
1137 1 82 GLN HB3 1 82 GLN HG2 2.900 . 3.900 2.445 2.201 2.619 . 0 0 "[ . 1 . 2 . 3]" 1
1138 1 82 GLN HG2 1 83 ILE H 4.500 . 6.000 4.712 3.560 5.291 . 0 0 "[ . 1 . 2 . 3]" 1
1139 1 82 GLN HG3 1 83 ILE H 4.100 . 6.000 4.391 4.140 4.907 . 0 0 "[ . 1 . 2 . 3]" 1
1140 1 83 ILE H 1 83 ILE HB 2.700 . 3.600 2.316 2.223 2.426 . 0 0 "[ . 1 . 2 . 3]" 1
1141 1 83 ILE H 1 83 ILE HG12 3.300 . 4.700 3.854 3.600 4.092 . 0 0 "[ . 1 . 2 . 3]" 1
1142 1 83 ILE H 1 83 ILE HG13 2.600 . 3.500 2.607 2.240 4.119 0.619 28 1 "[ . 1 . 2 . + 3]" 1
1143 1 83 ILE H 1 83 ILE MG 3.500 . 5.100 3.692 3.625 3.735 . 0 0 "[ . 1 . 2 . 3]" 1
1144 1 83 ILE H 1 84 ALA H 3.000 . 4.100 2.724 2.649 2.826 . 0 0 "[ . 1 . 2 . 3]" 1
1145 1 83 ILE H 1 86 ALA MB 5.200 . 6.000 4.599 4.458 4.794 . 0 0 "[ . 1 . 2 . 3]" 1
1146 1 83 ILE HA 1 83 ILE HG12 3.200 . 4.500 2.692 2.534 3.598 . 0 0 "[ . 1 . 2 . 3]" 1
1147 1 83 ILE HA 1 83 ILE MG 2.500 . 6.000 2.571 2.491 2.674 . 0 0 "[ . 1 . 2 . 3]" 1
1148 1 83 ILE HA 1 84 ALA H 3.700 . 5.400 3.558 3.513 3.600 . 0 0 "[ . 1 . 2 . 3]" 1
1149 1 83 ILE HA 1 86 ALA H 3.600 . 5.200 3.765 3.167 4.114 . 0 0 "[ . 1 . 2 . 3]" 1
1150 1 83 ILE HA 1 86 ALA MB 2.600 . 3.400 2.699 2.277 3.250 . 0 0 "[ . 1 . 2 . 3]" 1
1151 1 83 ILE HA 1 87 GLU H 4.500 . 6.000 3.959 3.688 4.167 . 0 0 "[ . 1 . 2 . 3]" 1
1152 1 83 ILE HB 1 84 ALA H 3.600 . 5.200 2.666 2.447 2.934 . 0 0 "[ . 1 . 2 . 3]" 1
1153 1 83 ILE MD 1 84 ALA H 4.100 . 6.000 4.506 4.244 4.727 . 0 0 "[ . 1 . 2 . 3]" 1
1154 1 83 ILE MG 1 84 ALA H 3.000 . 4.100 3.019 2.850 3.120 . 0 0 "[ . 1 . 2 . 3]" 1
1155 1 83 ILE MG 1 87 GLU H 3.800 . 5.600 4.047 3.614 4.353 . 0 0 "[ . 1 . 2 . 3]" 1
1156 1 84 ALA H 1 84 ALA HA 2.700 . 3.600 2.818 2.793 2.838 . 0 0 "[ . 1 . 2 . 3]" 1
1157 1 84 ALA H 1 84 ALA MB 2.200 . 2.800 2.227 2.206 2.241 . 0 0 "[ . 1 . 2 . 3]" 1
1158 1 84 ALA H 1 85 VAL H 2.600 . 3.500 2.696 2.582 2.812 . 0 0 "[ . 1 . 2 . 3]" 1
1159 1 84 ALA H 1 85 VAL HA 6.000 . 6.000 5.312 5.225 5.409 . 0 0 "[ . 1 . 2 . 3]" 1
1160 1 84 ALA H 1 86 ALA H 4.600 . 6.000 4.302 4.177 4.400 . 0 0 "[ . 1 . 2 . 3]" 1
1161 1 84 ALA H 1 86 ALA MB 6.000 . 6.000 4.858 4.652 5.083 . 0 0 "[ . 1 . 2 . 3]" 1
1162 1 84 ALA H 1 87 GLU H 6.000 . 6.000 4.499 4.379 4.603 . 0 0 "[ . 1 . 2 . 3]" 1
1163 1 84 ALA H 1 87 GLU HB3 5.200 . 6.000 5.811 4.807 6.415 0.415 26 0 "[ . 1 . 2 . 3]" 1
1164 1 84 ALA H 1 87 GLU HG2 4.700 . 6.000 4.489 4.053 6.006 0.006 10 0 "[ . 1 . 2 . 3]" 1
1165 1 84 ALA HA 1 85 VAL H 4.300 . 6.000 3.536 3.496 3.560 . 0 0 "[ . 1 . 2 . 3]" 1
1166 1 84 ALA HA 1 87 GLU H 3.600 . 5.200 3.509 3.158 3.790 . 0 0 "[ . 1 . 2 . 3]" 1
1167 1 84 ALA MB 1 85 VAL H 2.700 . 3.600 2.484 2.390 2.597 . 0 0 "[ . 1 . 2 . 3]" 1
1168 1 84 ALA MB 1 86 ALA H 4.200 . 6.000 4.663 4.564 4.741 . 0 0 "[ . 1 . 2 . 3]" 1
1169 1 84 ALA MB 1 87 GLU H 4.900 . 6.000 4.492 4.312 4.695 . 0 0 "[ . 1 . 2 . 3]" 1
1170 1 85 VAL H 1 85 VAL HA 2.900 . 4.000 2.832 2.817 2.852 . 0 0 "[ . 1 . 2 . 3]" 1
1171 1 85 VAL H 1 85 VAL HB 2.600 . 3.500 2.554 2.442 2.727 . 0 0 "[ . 1 . 2 . 3]" 1
1172 1 85 VAL H 1 85 VAL MG1 3.700 . 5.400 3.684 1.800 3.764 0.200 26 0 "[ . 1 . 2 . 3]" 1
1173 1 85 VAL H 1 85 VAL MG2 2.300 . 2.900 1.997 1.856 3.760 0.860 26 1 "[ . 1 . 2 .+ 3]" 1
1174 1 85 VAL H 1 86 ALA H 2.700 . 3.600 2.704 2.578 2.812 . 0 0 "[ . 1 . 2 . 3]" 1
1175 1 85 VAL H 1 86 ALA MB 5.400 . 6.000 4.308 4.201 4.443 . 0 0 "[ . 1 . 2 . 3]" 1
1176 1 85 VAL H 1 87 GLU H 5.500 . 6.000 3.731 3.613 3.896 . 0 0 "[ . 1 . 2 . 3]" 1
1177 1 85 VAL H 1 87 GLU HG2 6.000 . 6.000 5.205 4.160 6.598 0.598 10 2 "[ . + . 2 .- 3]" 1
1178 1 85 VAL HA 1 85 VAL MG1 2.500 . 3.300 2.389 2.317 3.191 . 0 0 "[ . 1 . 2 . 3]" 1
1179 1 85 VAL HA 1 85 VAL MG2 2.600 . 3.400 2.425 2.374 2.496 . 0 0 "[ . 1 . 2 . 3]" 1
1180 1 85 VAL HA 1 86 ALA H 3.700 . 5.400 3.568 3.539 3.594 . 0 0 "[ . 1 . 2 . 3]" 1
1181 1 85 VAL HA 1 87 GLU H 3.900 . 5.800 4.062 3.854 4.250 . 0 0 "[ . 1 . 2 . 3]" 1
1182 1 85 VAL HA 1 88 VAL MG2 3.000 . 4.100 2.991 2.707 3.341 . 0 0 "[ . 1 . 2 . 3]" 1
1183 1 85 VAL HB 1 86 ALA H 2.900 . 3.900 2.375 2.282 3.919 0.019 26 0 "[ . 1 . 2 . 3]" 1
1184 1 85 VAL HB 1 87 GLU H 5.000 . 6.000 4.612 4.535 5.383 . 0 0 "[ . 1 . 2 . 3]" 1
1185 1 85 VAL MG1 1 86 ALA H 3.500 . 5.000 3.298 1.881 3.485 0.119 26 0 "[ . 1 . 2 . 3]" 1
1186 1 85 VAL MG1 1 86 ALA HA 4.100 . 6.000 3.560 3.389 3.837 . 0 0 "[ . 1 . 2 . 3]" 1
1187 1 85 VAL MG1 1 88 VAL H 4.400 . 6.000 4.637 4.490 5.083 . 0 0 "[ . 1 . 2 . 3]" 1
1188 1 85 VAL MG1 1 89 THR H 3.400 . 6.000 4.444 4.031 5.385 . 0 0 "[ . 1 . 2 . 3]" 1
1189 1 85 VAL MG2 1 86 ALA H 3.800 . 5.600 3.623 3.317 3.717 . 0 0 "[ . 1 . 2 . 3]" 1
1190 1 86 ALA H 1 86 ALA HA 3.000 . 4.200 2.791 2.756 2.822 . 0 0 "[ . 1 . 2 . 3]" 1
1191 1 86 ALA H 1 86 ALA MB 2.400 . 3.100 2.220 2.206 2.234 . 0 0 "[ . 1 . 2 . 3]" 1
1192 1 86 ALA H 1 87 GLU H 3.000 . 4.100 2.603 2.523 2.661 . 0 0 "[ . 1 . 2 . 3]" 1
1193 1 86 ALA H 1 87 GLU HB3 5.800 . 6.000 5.643 4.637 6.210 0.210 5 0 "[ . 1 . 2 . 3]" 1
1194 1 86 ALA H 1 88 VAL H 5.400 . 6.000 4.370 4.175 4.546 . 0 0 "[ . 1 . 2 . 3]" 1
1195 1 86 ALA H 1 98 TRP HZ2 6.000 . 6.000 4.982 4.903 5.124 . 0 0 "[ . 1 . 2 . 3]" 1
1196 1 86 ALA HA 1 87 GLU H 3.900 . 5.800 3.466 3.445 3.493 . 0 0 "[ . 1 . 2 . 3]" 1
1197 1 86 ALA HA 1 89 THR H 4.300 . 6.000 3.248 3.022 3.600 . 0 0 "[ . 1 . 2 . 3]" 1
1198 1 86 ALA HA 1 98 TRP HH2 3.500 . 5.100 2.728 2.434 3.125 . 0 0 "[ . 1 . 2 . 3]" 1
1199 1 86 ALA MB 1 87 GLU H 2.900 . 4.000 2.750 2.667 2.797 . 0 0 "[ . 1 . 2 . 3]" 1
1200 1 86 ALA MB 1 90 ARG H 6.000 . 6.000 4.129 3.931 4.357 . 0 0 "[ . 1 . 2 . 3]" 1
1201 1 86 ALA MB 1 98 TRP HZ2 2.900 . 3.900 2.342 1.961 2.625 . 0 0 "[ . 1 . 2 . 3]" 1
1202 1 87 GLU H 1 87 GLU HA 2.900 . 4.000 2.828 2.788 2.859 . 0 0 "[ . 1 . 2 . 3]" 1
1203 1 87 GLU H 1 87 GLU HB3 2.500 . 3.300 3.171 2.343 3.616 0.316 10 0 "[ . 1 . 2 . 3]" 1
1204 1 87 GLU H 1 88 VAL H 3.000 . 4.100 2.694 2.548 2.787 . 0 0 "[ . 1 . 2 . 3]" 1
1205 1 87 GLU H 1 88 VAL MG2 4.200 . 6.000 4.176 4.009 4.347 . 0 0 "[ . 1 . 2 . 3]" 1
1206 1 87 GLU H 1 90 ARG HB3 6.000 . 6.000 5.215 4.651 5.604 . 0 0 "[ . 1 . 2 . 3]" 1
1207 1 87 GLU HA 1 87 GLU HB3 2.400 . 3.100 2.596 2.515 2.647 . 0 0 "[ . 1 . 2 . 3]" 1
1208 1 87 GLU HA 1 87 GLU HG3 3.000 . 4.100 3.642 3.008 3.727 . 0 0 "[ . 1 . 2 . 3]" 1
1209 1 87 GLU HA 1 88 VAL H 3.500 . 5.000 3.548 3.502 3.577 . 0 0 "[ . 1 . 2 . 3]" 1
1210 1 87 GLU HA 1 90 ARG H 3.600 . 5.200 3.360 2.729 3.758 . 0 0 "[ . 1 . 2 . 3]" 1
1211 1 87 GLU HA 1 90 ARG HE 5.300 . 6.000 2.959 2.333 4.676 . 0 0 "[ . 1 . 2 . 3]" 1
1212 1 87 GLU HB3 1 88 VAL H 2.900 . 4.000 3.563 3.226 4.026 0.026 6 0 "[ . 1 . 2 . 3]" 1
1213 1 88 VAL H 1 88 VAL HA 2.500 . 3.300 2.822 2.808 2.848 . 0 0 "[ . 1 . 2 . 3]" 1
1214 1 88 VAL H 1 88 VAL HB 2.200 . 2.800 2.613 2.516 2.707 . 0 0 "[ . 1 . 2 . 3]" 1
1215 1 88 VAL H 1 88 VAL MG1 3.300 . 4.700 3.796 3.777 3.815 . 0 0 "[ . 1 . 2 . 3]" 1
1216 1 88 VAL H 1 88 VAL MG2 2.400 . 6.000 2.105 1.946 2.192 . 0 0 "[ . 1 . 2 . 3]" 1
1217 1 88 VAL H 1 89 THR H 3.000 . 4.100 2.649 2.569 2.740 . 0 0 "[ . 1 . 2 . 3]" 1
1218 1 88 VAL H 1 89 THR HA 6.000 . 6.000 5.249 5.185 5.324 . 0 0 "[ . 1 . 2 . 3]" 1
1219 1 88 VAL H 1 92 ARG QD 3.900 . 5.800 5.883 5.835 5.975 0.175 11 0 "[ . 1 . 2 . 3]" 1
1220 1 88 VAL HA 1 88 VAL HB 2.500 . 3.300 3.037 3.020 3.054 . 0 0 "[ . 1 . 2 . 3]" 1
1221 1 88 VAL HA 1 88 VAL MG1 2.200 . 6.000 2.396 2.322 2.464 . 0 0 "[ . 1 . 2 . 3]" 1
1222 1 88 VAL HA 1 88 VAL MG2 2.200 . 6.000 2.399 2.353 2.471 . 0 0 "[ . 1 . 2 . 3]" 1
1223 1 88 VAL HA 1 89 THR H 3.500 . 5.000 3.527 3.487 3.556 . 0 0 "[ . 1 . 2 . 3]" 1
1224 1 88 VAL HA 1 91 LEU H 3.400 . 4.800 3.814 3.486 4.063 . 0 0 "[ . 1 . 2 . 3]" 1
1225 1 88 VAL HA 1 92 ARG H 6.000 . 6.000 5.079 4.851 5.406 . 0 0 "[ . 1 . 2 . 3]" 1
1226 1 88 VAL HB 1 89 THR H 2.800 . 3.800 2.531 2.398 2.677 . 0 0 "[ . 1 . 2 . 3]" 1
1227 1 88 VAL MG1 1 89 THR H 3.200 . 4.500 3.401 3.140 3.636 . 0 0 "[ . 1 . 2 . 3]" 1
1228 1 88 VAL MG1 1 89 THR HA 3.100 . 6.000 3.306 3.032 3.549 . 0 0 "[ . 1 . 2 . 3]" 1
1229 1 88 VAL MG1 1 92 ARG QD 2.600 . 3.400 2.210 2.048 2.347 . 0 0 "[ . 1 . 2 . 3]" 1
1230 1 88 VAL MG1 1 92 ARG HD3 2.400 . 6.000 2.231 2.064 2.373 . 0 0 "[ . 1 . 2 . 3]" 1
1231 1 88 VAL MG1 1 92 ARG HE 3.700 . 5.500 4.461 4.339 4.545 . 0 0 "[ . 1 . 2 . 3]" 1
1232 1 88 VAL MG2 1 89 THR H 4.100 . 6.000 3.756 3.670 3.827 . 0 0 "[ . 1 . 2 . 3]" 1
1233 1 89 THR H 1 89 THR HA 3.000 . 4.100 2.818 2.788 2.846 . 0 0 "[ . 1 . 2 . 3]" 1
1234 1 89 THR H 1 89 THR MG 3.300 . 4.700 3.399 2.064 3.739 . 0 0 "[ . 1 . 2 . 3]" 1
1235 1 89 THR H 1 90 ARG H 3.100 . 4.300 2.666 2.556 2.804 . 0 0 "[ . 1 . 2 . 3]" 1
1236 1 89 THR HA 1 89 THR MG 2.300 . 6.000 2.342 2.098 3.208 . 0 0 "[ . 1 . 2 . 3]" 1
1237 1 89 THR HA 1 90 ARG H 3.400 . 4.800 3.549 3.524 3.572 . 0 0 "[ . 1 . 2 . 3]" 1
1238 1 89 THR HA 1 92 ARG H 3.800 . 5.600 3.711 3.155 3.982 . 0 0 "[ . 1 . 2 . 3]" 1
1239 1 89 THR HA 1 92 ARG HD3 2.200 . 2.800 2.483 2.030 2.833 0.033 6 0 "[ . 1 . 2 . 3]" 1
1240 1 89 THR HA 1 93 GLN H 4.400 . 6.000 4.445 3.928 4.597 . 0 0 "[ . 1 . 2 . 3]" 1
1241 1 89 THR HB 1 89 THR MG 2.400 . 3.100 2.123 2.095 2.131 . 0 0 "[ . 1 . 2 . 3]" 1
1242 1 89 THR HB 1 90 ARG H 3.300 . 4.700 2.802 2.464 4.137 . 0 0 "[ . 1 . 2 . 3]" 1
1243 1 89 THR MG 1 90 ARG H 3.300 . 6.000 3.658 2.296 4.099 . 0 0 "[ . 1 . 2 . 3]" 1
1244 1 89 THR MG 1 93 GLN H 4.500 . 6.000 4.410 3.749 5.221 . 0 0 "[ . 1 . 2 . 3]" 1
1245 1 89 THR MG 1 93 GLN HE21 3.600 . 5.200 2.376 1.898 3.467 0.102 6 0 "[ . 1 . 2 . 3]" 1
1246 1 89 THR MG 1 93 GLN HE22 3.300 . 4.700 2.015 1.822 2.613 0.078 13 0 "[ . 1 . 2 . 3]" 1
1247 1 89 THR MG 1 98 TRP HH2 3.500 . 5.000 2.689 1.718 3.202 0.282 15 0 "[ . 1 . 2 . 3]" 1
1248 1 89 THR MG 1 98 TRP HZ2 3.300 . 6.000 3.730 2.864 4.343 . 0 0 "[ . 1 . 2 . 3]" 1
1249 1 89 THR MG 1 98 TRP HZ3 4.300 . 6.000 3.411 2.821 3.951 . 0 0 "[ . 1 . 2 . 3]" 1
1250 1 90 ARG H 1 90 ARG HA 2.700 . 3.600 2.814 2.794 2.856 . 0 0 "[ . 1 . 2 . 3]" 1
1251 1 90 ARG H 1 90 ARG HG2 3.000 . 4.100 2.893 2.354 3.724 . 0 0 "[ . 1 . 2 . 3]" 1
1252 1 90 ARG H 1 91 LEU H 2.900 . 4.000 2.612 2.402 2.714 . 0 0 "[ . 1 . 2 . 3]" 1
1253 1 90 ARG H 1 93 GLN HE21 3.500 . 5.000 4.268 3.428 5.376 0.376 17 0 "[ . 1 . 2 . 3]" 1
1254 1 90 ARG H 1 98 TRP HZ3 3.600 . 5.200 3.176 2.933 3.438 . 0 0 "[ . 1 . 2 . 3]" 1
1255 1 90 ARG HA 1 90 ARG HB2 2.000 . 2.500 2.361 2.266 2.437 . 0 0 "[ . 1 . 2 . 3]" 1
1256 1 90 ARG HA 1 90 ARG HD2 3.300 . 4.700 4.438 3.754 4.783 0.083 25 0 "[ . 1 . 2 . 3]" 1
1257 1 90 ARG HA 1 90 ARG HD3 3.700 . 5.400 4.596 3.823 5.113 . 0 0 "[ . 1 . 2 . 3]" 1
1258 1 90 ARG HA 1 90 ARG HG2 3.200 . 4.500 4.036 3.783 4.271 . 0 0 "[ . 1 . 2 . 3]" 1
1259 1 90 ARG HA 1 91 LEU H 3.200 . 4.500 3.463 3.395 3.502 . 0 0 "[ . 1 . 2 . 3]" 1
1260 1 90 ARG HB2 1 93 GLN HE21 4.000 . 6.000 5.206 4.295 6.377 0.377 14 0 "[ . 1 . 2 . 3]" 1
1261 1 90 ARG HB3 1 93 GLN HE21 3.700 . 6.000 4.873 4.057 6.020 0.020 10 0 "[ . 1 . 2 . 3]" 1
1262 1 90 ARG HD2 1 91 LEU H 4.700 . 6.000 4.259 2.704 5.111 . 0 0 "[ . 1 . 2 . 3]" 1
1263 1 90 ARG HD2 1 95 TRP HE1 5.700 . 6.000 3.660 2.818 4.417 . 0 0 "[ . 1 . 2 . 3]" 1
1264 1 90 ARG HG2 1 91 LEU H 2.300 . 6.000 3.246 2.329 3.995 . 0 0 "[ . 1 . 2 . 3]" 1
1265 1 90 ARG HG3 1 91 LEU H 3.000 . 4.100 2.308 1.977 3.168 . 0 0 "[ . 1 . 2 . 3]" 1
1266 1 90 ARG HG3 1 92 ARG H 3.300 . 4.700 4.517 4.323 4.815 0.115 10 0 "[ . 1 . 2 . 3]" 1
1267 1 91 LEU H 1 91 LEU HA 2.800 . 3.800 2.849 2.783 2.879 . 0 0 "[ . 1 . 2 . 3]" 1
1268 1 91 LEU H 1 91 LEU HB3 2.300 . 3.000 2.945 2.277 3.655 0.655 20 9 "[ * ** * * * + -*. 3]" 1
1269 1 91 LEU H 1 91 LEU MD1 3.400 . 4.800 3.652 3.438 4.270 . 0 0 "[ . 1 . 2 . 3]" 1
1270 1 91 LEU H 1 91 LEU MD2 3.500 . 5.000 3.353 2.782 4.207 . 0 0 "[ . 1 . 2 . 3]" 1
1271 1 91 LEU H 1 92 ARG H 2.700 . 3.600 2.509 2.417 2.662 . 0 0 "[ . 1 . 2 . 3]" 1
1272 1 91 LEU H 1 93 GLN H 6.000 . 6.000 4.224 3.863 4.431 . 0 0 "[ . 1 . 2 . 3]" 1
1273 1 91 LEU H 1 94 GLY H 6.000 . 6.000 4.595 4.174 4.743 . 0 0 "[ . 1 . 2 . 3]" 1
1274 1 91 LEU H 1 98 TRP HZ3 5.300 . 6.000 4.853 4.737 5.004 . 0 0 "[ . 1 . 2 . 3]" 1
1275 1 91 LEU HA 1 91 LEU HG 2.600 . 6.000 3.539 3.069 3.776 . 0 0 "[ . 1 . 2 . 3]" 1
1276 1 91 LEU HA 1 92 ARG H 3.500 . 5.000 3.425 3.383 3.475 . 0 0 "[ . 1 . 2 . 3]" 1
1277 1 91 LEU HA 1 94 GLY H 4.200 . 6.000 4.247 3.809 4.461 . 0 0 "[ . 1 . 2 . 3]" 1
1278 1 91 LEU MD1 1 92 ARG H 3.800 . 5.600 3.552 2.595 4.672 . 0 0 "[ . 1 . 2 . 3]" 1
1279 1 91 LEU MD2 1 92 ARG H 4.400 . 6.000 4.459 4.337 4.566 . 0 0 "[ . 1 . 2 . 3]" 1
1280 1 91 LEU HG 1 92 ARG HA 2.500 . 6.000 4.978 3.573 6.110 0.110 20 0 "[ . 1 . 2 . 3]" 1
1281 1 91 LEU HG 1 92 ARG HD3 2.500 . 6.000 4.921 4.022 6.050 0.050 21 0 "[ . 1 . 2 . 3]" 1
1282 1 92 ARG H 1 92 ARG HA 2.700 . 3.600 2.888 2.870 2.917 . 0 0 "[ . 1 . 2 . 3]" 1
1283 1 92 ARG H 1 92 ARG HB3 2.800 . 3.800 3.612 3.568 3.635 . 0 0 "[ . 1 . 2 . 3]" 1
1284 1 92 ARG H 1 92 ARG HG3 2.300 . 2.900 1.912 1.777 2.016 . 0 0 "[ . 1 . 2 . 3]" 1
1285 1 92 ARG H 1 93 GLN H 2.500 . 3.300 2.314 2.095 2.444 . 0 0 "[ . 1 . 2 . 3]" 1
1286 1 92 ARG H 1 93 GLN HA 6.000 . 6.000 4.953 4.824 5.002 . 0 0 "[ . 1 . 2 . 3]" 1
1287 1 92 ARG H 1 94 GLY H 3.500 . 5.000 3.659 3.220 3.867 . 0 0 "[ . 1 . 2 . 3]" 1
1288 1 92 ARG HA 1 92 ARG HB3 2.000 . 2.500 2.334 2.315 2.364 . 0 0 "[ . 1 . 2 . 3]" 1
1289 1 92 ARG HA 1 92 ARG HD3 4.700 . 6.000 5.039 4.968 5.093 . 0 0 "[ . 1 . 2 . 3]" 1
1290 1 92 ARG HA 1 92 ARG HE 5.800 . 6.000 4.430 4.340 4.528 . 0 0 "[ . 1 . 2 . 3]" 1
1291 1 92 ARG HA 1 92 ARG HG3 2.600 . 3.500 3.116 2.991 3.212 . 0 0 "[ . 1 . 2 . 3]" 1
1292 1 92 ARG HA 1 93 GLN H 2.900 . 4.000 3.517 3.463 3.555 . 0 0 "[ . 1 . 2 . 3]" 1
1293 1 92 ARG QB 1 92 ARG QD 2.400 . 3.100 2.531 2.492 2.599 . 0 0 "[ . 1 . 2 . 3]" 1
1294 1 92 ARG HB2 1 93 GLN H 2.000 . 2.500 2.426 2.262 2.551 0.051 21 0 "[ . 1 . 2 . 3]" 1
1295 1 92 ARG HB2 1 94 GLY H 3.400 . 4.800 4.673 4.377 4.891 0.091 21 0 "[ . 1 . 2 . 3]" 1
1296 1 92 ARG HD2 1 92 ARG HG2 2.500 . 3.300 2.305 2.283 2.327 . 0 0 "[ . 1 . 2 . 3]" 1
1297 1 92 ARG HD3 1 92 ARG HE 2.100 . 2.700 2.688 2.570 2.786 0.086 7 0 "[ . 1 . 2 . 3]" 1
1298 1 92 ARG HD3 1 92 ARG HG3 2.200 . 2.800 2.299 2.271 2.325 . 0 0 "[ . 1 . 2 . 3]" 1
1299 1 92 ARG HE 1 92 ARG HG3 2.300 . 3.000 2.750 2.679 2.824 . 0 0 "[ . 1 . 2 . 3]" 1
1300 1 92 ARG HE 1 93 GLN HB3 2.600 . 6.000 3.481 3.222 4.979 . 0 0 "[ . 1 . 2 . 3]" 1
1301 1 92 ARG HE 1 93 GLN HE21 2.900 . 4.000 4.028 3.615 4.985 0.985 8 2 "[ . + 1 - 2 . 3]" 1
1302 1 92 ARG HE 1 93 GLN HE22 4.000 . 6.000 4.328 3.835 5.077 . 0 0 "[ . 1 . 2 . 3]" 1
1303 1 92 ARG HG2 1 93 GLN H 5.400 . 6.000 4.767 4.659 4.846 . 0 0 "[ . 1 . 2 . 3]" 1
1304 1 92 ARG HG3 1 93 GLN HA 5.100 . 6.000 6.030 5.866 6.097 0.097 6 0 "[ . 1 . 2 . 3]" 1
1305 1 93 GLN H 1 93 GLN HA 2.800 . 3.800 2.908 2.882 2.927 . 0 0 "[ . 1 . 2 . 3]" 1
1306 1 93 GLN H 1 93 GLN HB2 3.700 . 5.400 3.604 2.149 3.781 . 0 0 "[ . 1 . 2 . 3]" 1
1307 1 93 GLN H 1 93 GLN HB3 3.400 . 4.900 2.631 2.254 3.483 . 0 0 "[ . 1 . 2 . 3]" 1
1308 1 93 GLN H 1 93 GLN HG3 3.400 . 4.800 3.771 2.696 4.472 . 0 0 "[ . 1 . 2 . 3]" 1
1309 1 93 GLN H 1 94 GLY H 2.400 . 3.100 2.270 2.085 2.429 . 0 0 "[ . 1 . 2 . 3]" 1
1310 1 93 GLN H 1 94 GLY HA3 6.000 . 6.000 4.911 4.796 5.064 . 0 0 "[ . 1 . 2 . 3]" 1
1311 1 93 GLN HA 1 93 GLN HB2 2.900 . 4.000 2.359 2.206 2.969 . 0 0 "[ . 1 . 2 . 3]" 1
1312 1 93 GLN HA 1 93 GLN HE21 6.000 . 6.000 5.337 4.193 5.762 . 0 0 "[ . 1 . 2 . 3]" 1
1313 1 93 GLN HA 1 93 GLN HG3 3.900 . 5.800 3.937 2.803 4.190 . 0 0 "[ . 1 . 2 . 3]" 1
1314 1 93 GLN HA 1 94 GLY H 3.400 . 4.800 3.484 3.232 3.540 . 0 0 "[ . 1 . 2 . 3]" 1
1315 1 93 GLN HA 1 96 GLY H 6.000 . 6.000 4.755 4.389 4.926 . 0 0 "[ . 1 . 2 . 3]" 1
1316 1 93 GLN HB2 1 93 GLN HE21 3.400 . 4.900 4.114 1.781 4.582 0.119 4 0 "[ . 1 . 2 . 3]" 1
1317 1 93 GLN HB2 1 93 GLN HE22 4.400 . 6.000 4.876 3.399 5.313 . 0 0 "[ . 1 . 2 . 3]" 1
1318 1 93 GLN HB2 1 94 GLY H 5.000 . 6.000 4.118 2.904 4.550 . 0 0 "[ . 1 . 2 . 3]" 1
1319 1 93 GLN HB3 1 94 GLY H 5.100 . 6.000 3.953 3.579 4.137 . 0 0 "[ . 1 . 2 . 3]" 1
1320 1 93 GLN HE21 1 93 GLN HG3 3.000 . 4.100 2.735 2.240 3.420 . 0 0 "[ . 1 . 2 . 3]" 1
1321 1 93 GLN HE21 1 95 TRP HA 4.100 . 6.000 4.553 2.989 5.307 . 0 0 "[ . 1 . 2 . 3]" 1
1322 1 93 GLN HE21 1 97 ALA H 4.700 . 6.000 3.729 2.479 4.801 . 0 0 "[ . 1 . 2 . 3]" 1
1323 1 93 GLN HE21 1 97 ALA MB 5.000 . 6.000 2.872 1.981 4.169 . 0 0 "[ . 1 . 2 . 3]" 1
1324 1 93 GLN HE21 1 98 TRP HZ2 5.100 . 6.000 5.429 4.922 6.023 0.023 6 0 "[ . 1 . 2 . 3]" 1
1325 1 93 GLN HE22 1 97 ALA H 4.500 . 6.000 3.988 3.413 4.486 . 0 0 "[ . 1 . 2 . 3]" 1
1326 1 93 GLN HE22 1 97 ALA HA 6.000 . 6.000 5.512 4.739 6.066 0.066 23 0 "[ . 1 . 2 . 3]" 1
1327 1 93 GLN HE22 1 97 ALA MB 4.000 . 6.000 2.680 2.122 3.178 . 0 0 "[ . 1 . 2 . 3]" 1
1328 1 93 GLN HG2 1 94 GLY H 3.500 . 5.000 2.912 2.141 5.178 0.178 4 0 "[ . 1 . 2 . 3]" 1
1329 1 94 GLY H 1 94 GLY HA2 2.200 . 2.800 2.355 2.293 2.417 . 0 0 "[ . 1 . 2 . 3]" 1
1330 1 94 GLY H 1 94 GLY HA3 2.700 . 3.600 2.918 2.857 2.951 . 0 0 "[ . 1 . 2 . 3]" 1
1331 1 94 GLY H 1 95 TRP H 4.100 . 6.000 2.628 2.123 4.341 . 0 0 "[ . 1 . 2 . 3]" 1
1332 1 94 GLY H 1 98 TRP HE3 6.000 . 6.000 5.391 5.309 5.491 . 0 0 "[ . 1 . 2 . 3]" 1
1333 1 94 GLY HA2 1 95 TRP H 2.500 . 3.300 2.860 2.655 3.378 0.078 11 0 "[ . 1 . 2 . 3]" 1
1334 1 94 GLY HA2 1 96 GLY H 4.400 . 6.000 4.193 3.966 4.589 . 0 0 "[ . 1 . 2 . 3]" 1
1335 1 94 GLY HA2 1 108 ARG H 3.600 . 6.000 5.398 5.184 5.696 . 0 0 "[ . 1 . 2 . 3]" 1
1336 1 94 GLY HA3 1 95 TRP H 2.800 . 3.800 3.275 2.019 3.539 . 0 0 "[ . 1 . 2 . 3]" 1
1337 1 95 TRP H 1 95 TRP HA 2.900 . 3.900 2.355 2.222 2.913 . 0 0 "[ . 1 . 2 . 3]" 1
1338 1 95 TRP H 1 95 TRP HB2 2.900 . 4.000 3.618 2.890 3.807 . 0 0 "[ . 1 . 2 . 3]" 1
1339 1 95 TRP H 1 95 TRP HB3 3.200 . 4.500 3.994 3.832 4.082 . 0 0 "[ . 1 . 2 . 3]" 1
1340 1 95 TRP H 1 95 TRP HD1 3.000 . 4.100 3.369 2.527 3.581 . 0 0 "[ . 1 . 2 . 3]" 1
1341 1 95 TRP H 1 96 GLY H 2.900 . 4.000 2.455 1.780 2.658 0.020 11 0 "[ . 1 . 2 . 3]" 1
1342 1 95 TRP H 1 97 ALA H 4.500 . 6.000 4.083 3.803 4.478 . 0 0 "[ . 1 . 2 . 3]" 1
1343 1 95 TRP H 1 98 TRP H 4.800 . 6.000 4.861 4.714 5.024 . 0 0 "[ . 1 . 2 . 3]" 1
1344 1 95 TRP HA 1 95 TRP HB2 2.700 . 3.600 3.016 2.993 3.038 . 0 0 "[ . 1 . 2 . 3]" 1
1345 1 95 TRP HA 1 95 TRP HB3 2.700 . 3.600 2.375 2.318 2.443 . 0 0 "[ . 1 . 2 . 3]" 1
1346 1 95 TRP HA 1 95 TRP HE3 3.100 . 4.300 3.447 3.298 3.701 . 0 0 "[ . 1 . 2 . 3]" 1
1347 1 95 TRP HA 1 96 GLY H 3.700 . 5.400 3.051 2.889 3.225 . 0 0 "[ . 1 . 2 . 3]" 1
1348 1 95 TRP HA 1 97 ALA H 4.000 . 6.000 3.505 3.159 3.973 . 0 0 "[ . 1 . 2 . 3]" 1
1349 1 95 TRP HA 1 98 TRP HE3 2.500 . 3.300 1.711 1.645 1.798 0.055 30 0 "[ . 1 . 2 . 3]" 1
1350 1 95 TRP HA 1 98 TRP HZ3 4.200 . 6.000 3.288 2.721 3.684 . 0 0 "[ . 1 . 2 . 3]" 1
1351 1 95 TRP HB2 1 95 TRP HD1 3.000 . 4.200 2.738 2.690 2.819 . 0 0 "[ . 1 . 2 . 3]" 1
1352 1 95 TRP HB2 1 96 GLY H 6.000 . 6.000 3.889 3.677 4.074 . 0 0 "[ . 1 . 2 . 3]" 1
1353 1 95 TRP HB2 1 102 ALA MB 3.600 . 5.200 2.846 2.603 3.144 . 0 0 "[ . 1 . 2 . 3]" 1
1354 1 95 TRP HB3 1 95 TRP HE1 4.800 . 6.000 5.248 5.233 5.269 . 0 0 "[ . 1 . 2 . 3]" 1
1355 1 95 TRP HB3 1 95 TRP HE3 3.600 . 5.200 2.479 2.420 2.521 . 0 0 "[ . 1 . 2 . 3]" 1
1356 1 95 TRP HB3 1 96 GLY H 4.900 . 6.000 4.510 4.426 4.576 . 0 0 "[ . 1 . 2 . 3]" 1
1357 1 95 TRP HB3 1 102 ALA MB 3.200 . 4.500 1.905 1.813 2.038 0.087 6 0 "[ . 1 . 2 . 3]" 1
1358 1 95 TRP HD1 1 96 GLY H 6.000 . 6.000 4.690 4.588 4.765 . 0 0 "[ . 1 . 2 . 3]" 1
1359 1 95 TRP HD1 1 108 ARG H 4.200 . 6.000 2.884 2.313 3.628 . 0 0 "[ . 1 . 2 . 3]" 1
1360 1 95 TRP HE1 1 107 ALA HA 4.900 . 6.000 4.170 3.868 4.410 . 0 0 "[ . 1 . 2 . 3]" 1
1361 1 95 TRP HE1 1 107 ALA MB 4.700 . 6.000 4.252 3.474 4.908 . 0 0 "[ . 1 . 2 . 3]" 1
1362 1 95 TRP HE1 1 108 ARG H 4.400 . 6.000 2.333 1.956 2.836 0.044 29 0 "[ . 1 . 2 . 3]" 1
1363 1 95 TRP HE1 1 108 ARG HA 4.600 . 6.000 3.743 2.007 4.453 . 0 0 "[ . 1 . 2 . 3]" 1
1364 1 95 TRP HE1 1 108 ARG QG 4.300 . 6.000 3.410 2.266 4.242 . 0 0 "[ . 1 . 2 . 3]" 1
1365 1 95 TRP HE3 1 98 TRP HE3 3.300 . 4.700 3.705 3.272 4.089 . 0 0 "[ . 1 . 2 . 3]" 1
1366 1 95 TRP HZ2 1 108 ARG QG 3.500 . 5.000 3.754 2.040 4.980 . 0 0 "[ . 1 . 2 . 3]" 1
1367 1 96 GLY H 1 96 GLY HA2 2.800 . 3.800 2.832 2.776 2.892 . 0 0 "[ . 1 . 2 . 3]" 1
1368 1 96 GLY H 1 96 GLY HA3 2.400 . 3.100 2.300 2.286 2.323 . 0 0 "[ . 1 . 2 . 3]" 1
1369 1 96 GLY H 1 97 ALA H 2.900 . 4.000 2.623 2.366 2.858 . 0 0 "[ . 1 . 2 . 3]" 1
1370 1 96 GLY H 1 97 ALA MB 6.000 . 6.000 4.348 4.128 4.574 . 0 0 "[ . 1 . 2 . 3]" 1
1371 1 96 GLY H 1 98 TRP H 6.000 . 6.000 3.946 3.627 4.077 . 0 0 "[ . 1 . 2 . 3]" 1
1372 1 96 GLY HA2 1 97 ALA H 3.400 . 4.900 3.492 3.396 3.562 . 0 0 "[ . 1 . 2 . 3]" 1
1373 1 96 GLY HA2 1 98 TRP H 3.600 . 5.300 4.001 3.761 4.313 . 0 0 "[ . 1 . 2 . 3]" 1
1374 1 97 ALA H 1 97 ALA HA 2.500 . 3.300 2.868 2.816 2.915 . 0 0 "[ . 1 . 2 . 3]" 1
1375 1 97 ALA H 1 97 ALA MB 2.400 . 3.100 2.275 2.246 2.314 . 0 0 "[ . 1 . 2 . 3]" 1
1376 1 97 ALA H 1 98 TRP H 2.600 . 3.400 2.394 2.195 2.550 . 0 0 "[ . 1 . 2 . 3]" 1
1377 1 97 ALA HA 1 98 TRP H 2.900 . 4.000 3.446 3.379 3.513 . 0 0 "[ . 1 . 2 . 3]" 1
1378 1 97 ALA MB 1 98 TRP H 3.100 . 4.300 2.857 2.678 3.039 . 0 0 "[ . 1 . 2 . 3]" 1
1379 1 98 TRP H 1 98 TRP HA 2.800 . 3.800 2.930 2.904 2.955 . 0 0 "[ . 1 . 2 . 3]" 1
1380 1 98 TRP H 1 98 TRP HB2 2.900 . 3.900 2.423 2.336 2.512 . 0 0 "[ . 1 . 2 . 3]" 1
1381 1 98 TRP H 1 98 TRP HB3 3.800 . 5.600 3.634 3.583 3.684 . 0 0 "[ . 1 . 2 . 3]" 1
1382 1 98 TRP H 1 98 TRP HZ3 4.400 . 6.000 4.708 4.610 4.819 . 0 0 "[ . 1 . 2 . 3]" 1
1383 1 98 TRP H 1 99 PRO HA 5.300 . 6.000 4.944 4.825 5.059 . 0 0 "[ . 1 . 2 . 3]" 1
1384 1 98 TRP H 1 99 PRO HD3 3.200 . 4.500 4.050 3.989 4.145 . 0 0 "[ . 1 . 2 . 3]" 1
1385 1 98 TRP H 1 102 ALA MB 4.500 . 6.000 3.845 3.582 4.232 . 0 0 "[ . 1 . 2 . 3]" 1
1386 1 98 TRP HA 1 98 TRP HB2 3.000 . 4.100 3.026 3.013 3.037 . 0 0 "[ . 1 . 2 . 3]" 1
1387 1 98 TRP HB2 1 98 TRP HE3 3.900 . 5.800 2.580 2.519 2.645 . 0 0 "[ . 1 . 2 . 3]" 1
1388 1 98 TRP HD1 1 101 CYS HB2 3.100 . 4.300 4.039 3.641 4.227 . 0 0 "[ . 1 . 2 . 3]" 1
1389 1 98 TRP HE3 1 102 ALA MB 3.300 . 6.000 3.969 3.536 4.346 . 0 0 "[ . 1 . 2 . 3]" 1
1390 1 99 PRO HA 1 99 PRO HB2 2.500 . 3.300 2.956 2.915 2.981 . 0 0 "[ . 1 . 2 . 3]" 1
1391 1 99 PRO HA 1 99 PRO HD3 3.300 . 4.700 3.814 3.730 3.908 . 0 0 "[ . 1 . 2 . 3]" 1
1392 1 99 PRO HA 1 100 VAL H 3.300 . 4.600 3.280 2.946 3.530 . 0 0 "[ . 1 . 2 . 3]" 1
1393 1 99 PRO HA 1 101 CYS H 4.500 . 6.000 4.511 4.408 4.605 . 0 0 "[ . 1 . 2 . 3]" 1
1394 1 99 PRO HA 1 103 ALA H 6.000 . 6.000 5.277 4.709 5.762 . 0 0 "[ . 1 . 2 . 3]" 1
1395 1 99 PRO HB2 1 99 PRO QD 3.600 . 5.200 2.751 2.698 2.806 . 0 0 "[ . 1 . 2 . 3]" 1
1396 1 99 PRO HB3 1 100 VAL H 3.000 . 4.200 2.766 2.260 3.306 . 0 0 "[ . 1 . 2 . 3]" 1
1397 1 99 PRO HG2 1 101 CYS H 6.000 . 6.000 4.948 4.531 5.242 . 0 0 "[ . 1 . 2 . 3]" 1
1398 1 100 VAL H 1 100 VAL HA 3.000 . 4.100 2.810 2.756 2.861 . 0 0 "[ . 1 . 2 . 3]" 1
1399 1 100 VAL H 1 100 VAL HB 3.100 . 4.300 2.732 2.256 3.609 . 0 0 "[ . 1 . 2 . 3]" 1
1400 1 100 VAL H 1 100 VAL QG 2.700 . 3.600 1.983 1.778 2.470 0.222 15 0 "[ . 1 . 2 . 3]" 1
1401 1 100 VAL H 1 101 CYS H 3.000 . 4.100 2.569 2.316 2.764 . 0 0 "[ . 1 . 2 . 3]" 1
1402 1 100 VAL HA 1 101 CYS H 3.400 . 4.900 3.439 3.397 3.482 . 0 0 "[ . 1 . 2 . 3]" 1
1403 1 100 VAL HB 1 101 CYS H 2.800 . 3.800 3.176 2.886 3.780 . 0 0 "[ . 1 . 2 . 3]" 1
1404 1 100 VAL QG 1 101 CYS H 3.800 . 4.900 3.109 2.182 3.450 . 0 0 "[ . 1 . 2 . 3]" 1
1405 1 100 VAL QG 1 104 ARG H 4.700 . 6.000 3.892 3.244 4.546 . 0 0 "[ . 1 . 2 . 3]" 1
1406 1 100 VAL QG 1 104 ARG HE 3.500 . 5.000 4.026 2.104 4.958 . 0 0 "[ . 1 . 2 . 3]" 1
1407 1 101 CYS H 1 101 CYS HA 3.000 . 4.100 2.826 2.764 2.915 . 0 0 "[ . 1 . 2 . 3]" 1
1408 1 101 CYS H 1 101 CYS HB2 3.600 . 5.200 2.510 2.382 2.644 . 0 0 "[ . 1 . 2 . 3]" 1
1409 1 101 CYS H 1 101 CYS HB3 3.200 . 4.500 3.599 3.573 3.669 . 0 0 "[ . 1 . 2 . 3]" 1
1410 1 101 CYS H 1 102 ALA MB 5.000 . 6.000 4.349 4.119 4.520 . 0 0 "[ . 1 . 2 . 3]" 1
1411 1 101 CYS HA 1 101 CYS HB3 2.600 . 3.500 2.467 2.406 2.528 . 0 0 "[ . 1 . 2 . 3]" 1
1412 1 101 CYS HA 1 102 ALA H 5.100 . 6.000 3.524 3.481 3.556 . 0 0 "[ . 1 . 2 . 3]" 1
1413 1 101 CYS HA 1 104 ARG H 3.200 . 4.500 3.463 3.210 3.725 . 0 0 "[ . 1 . 2 . 3]" 1
1414 1 101 CYS HA 1 104 ARG HB3 3.400 . 4.900 3.829 2.599 4.210 . 0 0 "[ . 1 . 2 . 3]" 1
1415 1 101 CYS HA 1 104 ARG HG3 4.100 . 6.000 4.480 2.596 5.873 . 0 0 "[ . 1 . 2 . 3]" 1
1416 1 101 CYS HB2 1 102 ALA H 4.000 . 6.000 2.829 2.648 3.060 . 0 0 "[ . 1 . 2 . 3]" 1
1417 1 101 CYS HB3 1 102 ALA H 4.300 . 6.000 3.833 3.672 4.026 . 0 0 "[ . 1 . 2 . 3]" 1
1418 1 102 ALA H 1 102 ALA MB 2.600 . 3.400 2.257 2.237 2.277 . 0 0 "[ . 1 . 2 . 3]" 1
1419 1 102 ALA H 1 103 ALA H 3.300 . 4.600 2.582 2.493 2.668 . 0 0 "[ . 1 . 2 . 3]" 1
1420 1 102 ALA HA 1 103 ALA H 4.100 . 6.000 3.540 3.517 3.557 . 0 0 "[ . 1 . 2 . 3]" 1
1421 1 102 ALA HA 1 105 ALA H 5.300 . 6.000 3.279 3.121 3.467 . 0 0 "[ . 1 . 2 . 3]" 1
1422 1 102 ALA HA 1 105 ALA MB 2.700 . 3.600 2.427 2.150 2.817 . 0 0 "[ . 1 . 2 . 3]" 1
1423 1 103 ALA H 1 103 ALA HA 2.900 . 4.000 2.810 2.789 2.836 . 0 0 "[ . 1 . 2 . 3]" 1
1424 1 103 ALA H 1 103 ALA MB 2.300 . 3.000 2.237 2.223 2.254 . 0 0 "[ . 1 . 2 . 3]" 1
1425 1 103 ALA H 1 104 ARG H 2.600 . 3.400 2.640 2.528 2.746 . 0 0 "[ . 1 . 2 . 3]" 1
1426 1 103 ALA HA 1 103 ALA MB 2.100 . 6.000 2.129 2.126 2.133 . 0 0 "[ . 1 . 2 . 3]" 1
1427 1 103 ALA HA 1 104 ARG H 2.700 . 3.600 3.510 3.487 3.534 . 0 0 "[ . 1 . 2 . 3]" 1
1428 1 103 ALA HA 1 107 ALA H 3.000 . 4.100 2.787 2.286 3.335 . 0 0 "[ . 1 . 2 . 3]" 1
1429 1 103 ALA MB 1 104 ARG H 2.400 . 6.000 2.541 2.419 2.700 . 0 0 "[ . 1 . 2 . 3]" 1
1430 1 104 ARG H 1 104 ARG HA 2.700 . 3.600 2.832 2.791 2.856 . 0 0 "[ . 1 . 2 . 3]" 1
1431 1 104 ARG H 1 104 ARG HB3 2.900 . 3.900 3.394 2.136 3.609 . 0 0 "[ . 1 . 2 . 3]" 1
1432 1 104 ARG H 1 104 ARG HD2 3.400 . 4.800 3.965 2.336 5.662 0.862 14 1 "[ . 1 +. 2 . 3]" 1
1433 1 104 ARG H 1 104 ARG HE 6.000 . 6.000 3.797 2.481 5.012 . 0 0 "[ . 1 . 2 . 3]" 1
1434 1 104 ARG H 1 104 ARG HG2 3.000 . 4.100 3.647 2.287 4.461 0.361 18 0 "[ . 1 . 2 . 3]" 1
1435 1 104 ARG H 1 104 ARG HG3 3.300 . 4.700 3.646 2.319 4.345 . 0 0 "[ . 1 . 2 . 3]" 1
1436 1 104 ARG H 1 105 ALA H 2.600 . 3.400 2.549 2.469 2.672 . 0 0 "[ . 1 . 2 . 3]" 1
1437 1 104 ARG H 1 105 ALA MB 4.100 . 6.000 4.197 4.086 4.327 . 0 0 "[ . 1 . 2 . 3]" 1
1438 1 104 ARG HA 1 104 ARG HB3 2.400 . 3.100 2.654 2.515 3.023 . 0 0 "[ . 1 . 2 . 3]" 1
1439 1 104 ARG HA 1 104 ARG HD2 3.600 . 5.200 3.724 2.085 5.034 . 0 0 "[ . 1 . 2 . 3]" 1
1440 1 104 ARG HA 1 104 ARG HD3 3.900 . 5.800 3.601 1.947 4.692 0.053 8 0 "[ . 1 . 2 . 3]" 1
1441 1 104 ARG HA 1 104 ARG HE 3.700 . 5.400 3.054 1.862 4.534 0.138 26 0 "[ . 1 . 2 . 3]" 1
1442 1 104 ARG HA 1 104 ARG HG2 2.700 . 3.600 3.256 2.458 4.238 0.638 2 1 "[ + . 1 . 2 . 3]" 1
1443 1 104 ARG HA 1 105 ALA H 3.800 . 5.600 3.462 3.401 3.541 . 0 0 "[ . 1 . 2 . 3]" 1
1444 1 104 ARG QB 1 104 ARG HD3 3.800 . 5.600 2.901 2.289 3.478 . 0 0 "[ . 1 . 2 . 3]" 1
1445 1 104 ARG HB2 1 105 ALA H 3.100 . 4.300 3.133 2.655 4.298 . 0 0 "[ . 1 . 2 . 3]" 1
1446 1 104 ARG HB3 1 104 ARG HD2 3.000 . 4.100 3.722 3.070 4.234 0.134 3 0 "[ . 1 . 2 . 3]" 1
1447 1 104 ARG HB3 1 104 ARG HD3 3.600 . 5.200 3.565 2.316 4.238 . 0 0 "[ . 1 . 2 . 3]" 1
1448 1 104 ARG HB3 1 104 ARG HE 3.100 . 4.300 3.289 1.735 4.532 0.232 30 0 "[ . 1 . 2 . 3]" 1
1449 1 104 ARG HD3 1 104 ARG HE 2.400 . 3.100 2.794 2.312 2.954 . 0 0 "[ . 1 . 2 . 3]" 1
1450 1 104 ARG HE 1 104 ARG HG2 3.100 . 4.300 3.068 2.120 4.040 . 0 0 "[ . 1 . 2 . 3]" 1
1451 1 104 ARG HE 1 104 ARG HG3 3.200 . 4.500 3.262 2.233 3.975 . 0 0 "[ . 1 . 2 . 3]" 1
1452 1 105 ALA H 1 105 ALA HA 2.900 . 4.000 2.904 2.871 2.935 . 0 0 "[ . 1 . 2 . 3]" 1
1453 1 105 ALA H 1 105 ALA MB 2.500 . 3.300 2.251 2.212 2.299 . 0 0 "[ . 1 . 2 . 3]" 1
1454 1 105 ALA HA 1 106 GLY H 3.300 . 4.700 3.462 3.431 3.508 . 0 0 "[ . 1 . 2 . 3]" 1
1455 1 105 ALA MB 1 106 GLY H 3.400 . 4.900 2.900 2.815 2.959 . 0 0 "[ . 1 . 2 . 3]" 1
1456 1 105 ALA MB 1 107 ALA H 2.800 . 6.000 4.258 3.773 4.393 . 0 0 "[ . 1 . 2 . 3]" 1
1457 1 106 GLY H 1 106 GLY HA2 2.500 . 3.300 2.432 2.384 2.500 . 0 0 "[ . 1 . 2 . 3]" 1
1458 1 106 GLY H 1 106 GLY HA3 2.900 . 4.000 2.952 2.939 2.960 . 0 0 "[ . 1 . 2 . 3]" 1
1459 1 106 GLY HA2 1 107 ALA H 2.900 . 3.900 2.530 2.446 2.692 . 0 0 "[ . 1 . 2 . 3]" 1
1460 1 106 GLY HA3 1 107 ALA H 3.700 . 5.400 3.547 3.521 3.565 . 0 0 "[ . 1 . 2 . 3]" 1
1461 1 107 ALA H 1 107 ALA HA 2.700 . 3.600 2.805 2.762 2.851 . 0 0 "[ . 1 . 2 . 3]" 1
1462 1 107 ALA H 1 107 ALA MB 2.500 . 3.300 2.225 2.207 2.249 . 0 0 "[ . 1 . 2 . 3]" 1
1463 1 107 ALA H 1 108 ARG QG 3.300 . 4.700 4.517 4.420 4.621 . 0 0 "[ . 1 . 2 . 3]" 1
1464 1 107 ALA HA 1 108 ARG H 2.200 . 2.800 2.279 2.208 2.336 . 0 0 "[ . 1 . 2 . 3]" 1
1465 1 107 ALA MB 1 108 ARG H 3.000 . 4.100 2.632 2.558 2.794 . 0 0 "[ . 1 . 2 . 3]" 1
1466 1 108 ARG H 1 108 ARG HA 2.700 . 3.600 2.737 2.245 2.939 . 0 0 "[ . 1 . 2 . 3]" 1
1467 1 108 ARG H 1 108 ARG HB2 3.400 . 4.900 3.393 2.652 3.960 . 0 0 "[ . 1 . 2 . 3]" 1
1468 1 108 ARG H 1 108 ARG HB3 3.400 . 4.800 3.836 3.629 4.003 . 0 0 "[ . 1 . 2 . 3]" 1
1469 1 108 ARG H 1 108 ARG HD3 4.500 . 6.000 4.210 2.775 5.288 . 0 0 "[ . 1 . 2 . 3]" 1
1470 1 108 ARG H 1 108 ARG QG 2.700 . 3.600 2.663 2.227 3.089 . 0 0 "[ . 1 . 2 . 3]" 1
1471 1 108 ARG HA 1 108 ARG HB2 3.000 . 4.100 2.880 2.574 3.029 . 0 0 "[ . 1 . 2 . 3]" 1
1472 1 108 ARG HA 1 108 ARG HB3 2.500 . 3.300 2.364 2.259 2.497 . 0 0 "[ . 1 . 2 . 3]" 1
1473 1 108 ARG HB3 1 108 ARG HE 3.900 . 5.800 3.325 1.975 4.645 0.025 19 0 "[ . 1 . 2 . 3]" 1
1474 1 108 ARG QD 1 108 ARG QG 3.100 . 4.300 2.030 1.965 2.097 . 0 0 "[ . 1 . 2 . 3]" 1
1475 1 108 ARG HD2 1 108 ARG QG 3.000 . 4.100 2.251 2.161 2.403 . 0 0 "[ . 1 . 2 . 3]" 1
1476 1 108 ARG HD3 1 108 ARG HE 2.500 . 3.300 2.800 2.483 2.948 . 0 0 "[ . 1 . 2 . 3]" 1
1477 1 108 ARG HD3 1 108 ARG QG 3.100 . 4.300 2.325 2.162 2.418 . 0 0 "[ . 1 . 2 . 3]" 1
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