NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
381192 |
1ivm   |
4751 | cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_1ivm
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 1306
_Distance_constraint_stats_list.Viol_count 3641
_Distance_constraint_stats_list.Viol_total 3817.757
_Distance_constraint_stats_list.Viol_max 0.254
_Distance_constraint_stats_list.Viol_rms 0.0245
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0073
_Distance_constraint_stats_list.Viol_average_violations_only 0.0524
_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 LYS 0.199 0.048 12 0 "[ . 1 . 2]"
1 2 VAL 0.003 0.003 11 0 "[ . 1 . 2]"
1 3 TYR 1.271 0.198 18 0 "[ . 1 . 2]"
1 4 GLU 0.191 0.078 8 0 "[ . 1 . 2]"
1 5 ARG 1.109 0.073 1 0 "[ . 1 . 2]"
1 6 CYS 5.857 0.144 18 0 "[ . 1 . 2]"
1 7 GLU 3.703 0.144 18 0 "[ . 1 . 2]"
1 8 PHE 1.123 0.123 17 0 "[ . 1 . 2]"
1 9 ALA 0.125 0.018 17 0 "[ . 1 . 2]"
1 10 ARG 2.582 0.143 8 0 "[ . 1 . 2]"
1 11 THR 0.250 0.056 17 0 "[ . 1 . 2]"
1 12 LEU 4.490 0.167 8 0 "[ . 1 . 2]"
1 13 LYS 1.836 0.093 19 0 "[ . 1 . 2]"
1 14 ARG 3.033 0.107 6 0 "[ . 1 . 2]"
1 15 ASN 4.891 0.133 20 0 "[ . 1 . 2]"
1 16 GLY 3.862 0.129 11 0 "[ . 1 . 2]"
1 17 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 ALA 1.937 0.152 14 0 "[ . 1 . 2]"
1 19 GLY 0.424 0.102 9 0 "[ . 1 . 2]"
1 20 TYR 1.909 0.152 14 0 "[ . 1 . 2]"
1 21 TYR 0.761 0.150 19 0 "[ . 1 . 2]"
1 22 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 VAL 1.102 0.140 14 0 "[ . 1 . 2]"
1 24 SER 0.360 0.050 14 0 "[ . 1 . 2]"
1 25 LEU 2.510 0.174 16 0 "[ . 1 . 2]"
1 26 ALA 1.850 0.168 14 0 "[ . 1 . 2]"
1 27 ASP 3.146 0.244 14 0 "[ . 1 . 2]"
1 28 TRP 3.307 0.127 13 0 "[ . 1 . 2]"
1 29 VAL 1.788 0.114 9 0 "[ . 1 . 2]"
1 30 CYS 2.678 0.114 14 0 "[ . 1 . 2]"
1 31 LEU 1.736 0.176 8 0 "[ . 1 . 2]"
1 32 ALA 0.941 0.081 1 0 "[ . 1 . 2]"
1 33 GLN 4.115 0.108 8 0 "[ . 1 . 2]"
1 34 HIS 10.418 0.158 12 0 "[ . 1 . 2]"
1 35 GLU 5.430 0.158 12 0 "[ . 1 . 2]"
1 36 SER 2.453 0.149 18 0 "[ . 1 . 2]"
1 37 ASN 1.356 0.153 13 0 "[ . 1 . 2]"
1 38 TYR 0.533 0.052 17 0 "[ . 1 . 2]"
1 39 ASN 3.208 0.198 18 0 "[ . 1 . 2]"
1 40 THR 2.060 0.142 18 0 "[ . 1 . 2]"
1 41 ARG 0.495 0.091 1 0 "[ . 1 . 2]"
1 42 ALA 2.267 0.151 1 0 "[ . 1 . 2]"
1 43 THR 0.017 0.016 20 0 "[ . 1 . 2]"
1 44 ASN 1.948 0.114 20 0 "[ . 1 . 2]"
1 45 TYR 2.978 0.143 20 0 "[ . 1 . 2]"
1 46 ASN 2.656 0.107 15 0 "[ . 1 . 2]"
1 47 ARG 3.877 0.123 14 0 "[ . 1 . 2]"
1 48 GLY 1.848 0.095 5 0 "[ . 1 . 2]"
1 49 ASP 0.286 0.065 5 0 "[ . 1 . 2]"
1 50 GLN 0.719 0.250 8 0 "[ . 1 . 2]"
1 51 SER 1.034 0.075 13 0 "[ . 1 . 2]"
1 52 THR 1.136 0.106 12 0 "[ . 1 . 2]"
1 53 ASP 1.417 0.105 10 0 "[ . 1 . 2]"
1 54 TYR 2.730 0.203 13 0 "[ . 1 . 2]"
1 55 GLY 4.337 0.203 13 0 "[ . 1 . 2]"
1 56 ILE 1.829 0.158 4 0 "[ . 1 . 2]"
1 57 PHE 4.539 0.172 18 0 "[ . 1 . 2]"
1 58 GLN 0.291 0.074 3 0 "[ . 1 . 2]"
1 59 ILE 0.441 0.061 20 0 "[ . 1 . 2]"
1 60 ASN 2.045 0.241 9 0 "[ . 1 . 2]"
1 61 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 ARG 1.849 0.100 13 0 "[ . 1 . 2]"
1 63 TYR 0.160 0.048 8 0 "[ . 1 . 2]"
1 64 TRP 0.019 0.019 18 0 "[ . 1 . 2]"
1 65 CYS 3.715 0.160 18 0 "[ . 1 . 2]"
1 66 ASN 1.545 0.145 3 0 "[ . 1 . 2]"
1 67 ASP 1.188 0.230 16 0 "[ . 1 . 2]"
1 68 GLY 2.664 0.230 16 0 "[ . 1 . 2]"
1 69 LYS 3.216 0.217 16 0 "[ . 1 . 2]"
1 70 THR 1.014 0.217 16 0 "[ . 1 . 2]"
1 72 ARG 1.684 0.100 19 0 "[ . 1 . 2]"
1 73 ALA 2.029 0.100 19 0 "[ . 1 . 2]"
1 74 VAL 1.025 0.126 12 0 "[ . 1 . 2]"
1 75 ASN 0.765 0.126 12 0 "[ . 1 . 2]"
1 76 ALA 0.173 0.048 8 0 "[ . 1 . 2]"
1 77 CYS 3.276 0.140 12 0 "[ . 1 . 2]"
1 78 GLY 3.899 0.178 4 0 "[ . 1 . 2]"
1 79 ILE 3.346 0.139 13 0 "[ . 1 . 2]"
1 80 ASN 1.682 0.156 7 0 "[ . 1 . 2]"
1 81 CYS 2.359 0.160 18 0 "[ . 1 . 2]"
1 82 SER 0.409 0.045 12 0 "[ . 1 . 2]"
1 83 ALA 0.739 0.045 12 0 "[ . 1 . 2]"
1 84 LEU 0.320 0.098 19 0 "[ . 1 . 2]"
1 85 LEU 0.399 0.069 19 0 "[ . 1 . 2]"
1 86 GLN 0.823 0.119 9 0 "[ . 1 . 2]"
1 87 ASP 3.022 0.122 17 0 "[ . 1 . 2]"
1 88 ASP 0.291 0.072 9 0 "[ . 1 . 2]"
1 89 ILE 1.551 0.099 13 0 "[ . 1 . 2]"
1 90 THR 5.396 0.172 8 0 "[ . 1 . 2]"
1 91 ALA 5.222 0.155 8 0 "[ . 1 . 2]"
1 92 ALA 3.316 0.155 8 0 "[ . 1 . 2]"
1 93 ILE 2.367 0.141 18 0 "[ . 1 . 2]"
1 94 GLN 4.636 0.145 19 0 "[ . 1 . 2]"
1 95 CYS 4.197 0.145 19 0 "[ . 1 . 2]"
1 96 ALA 1.193 0.112 11 0 "[ . 1 . 2]"
1 97 LYS 5.031 0.143 4 0 "[ . 1 . 2]"
1 98 ARG 3.477 0.122 14 0 "[ . 1 . 2]"
1 99 VAL 7.038 0.142 7 0 "[ . 1 . 2]"
1 100 VAL 4.605 0.187 14 0 "[ . 1 . 2]"
1 101 ARG 3.927 0.187 14 0 "[ . 1 . 2]"
1 102 ASP 1.266 0.169 9 0 "[ . 1 . 2]"
1 104 GLN 1.205 0.126 17 0 "[ . 1 . 2]"
1 105 GLY 2.553 0.159 15 0 "[ . 1 . 2]"
1 106 ILE 0.323 0.064 17 0 "[ . 1 . 2]"
1 107 ARG 0.313 0.042 11 0 "[ . 1 . 2]"
1 108 ALA 0.362 0.074 14 0 "[ . 1 . 2]"
1 109 TRP 3.085 0.163 11 0 "[ . 1 . 2]"
1 110 VAL 0.216 0.089 16 0 "[ . 1 . 2]"
1 111 ALA 1.179 0.089 16 0 "[ . 1 . 2]"
1 112 TRP 3.363 0.254 14 0 "[ . 1 . 2]"
1 113 ARG 1.290 0.254 14 0 "[ . 1 . 2]"
1 114 ALA 0.671 0.089 20 0 "[ . 1 . 2]"
1 115 HIS 4.286 0.248 16 0 "[ . 1 . 2]"
1 116 CYS 8.026 0.248 16 0 "[ . 1 . 2]"
1 117 GLN 5.027 0.189 19 0 "[ . 1 . 2]"
1 118 ASN 2.052 0.189 19 0 "[ . 1 . 2]"
1 119 ARG 3.420 0.132 14 0 "[ . 1 . 2]"
1 120 ASP 0.265 0.030 5 0 "[ . 1 . 2]"
1 121 LEU 5.487 0.132 14 0 "[ . 1 . 2]"
1 122 SER 2.726 0.148 15 0 "[ . 1 . 2]"
1 123 GLN 4.619 0.148 15 0 "[ . 1 . 2]"
1 124 TYR 4.044 0.136 14 0 "[ . 1 . 2]"
1 125 ILE 1.044 0.086 4 0 "[ . 1 . 2]"
1 126 ARG 1.938 0.202 5 0 "[ . 1 . 2]"
1 127 ASN 2.001 0.124 3 0 "[ . 1 . 2]"
1 128 CYS 3.688 0.202 5 0 "[ . 1 . 2]"
1 129 GLY 0.877 0.064 10 0 "[ . 1 . 2]"
1 130 VAL 2.390 0.106 17 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 LYS QB 1 87 ASP QB . . 5.500 3.586 1.984 4.154 . 0 0 "[ . 1 . 2]" 1
2 1 1 LYS O 1 40 THR H . . 1.800 1.808 1.773 1.848 0.048 12 0 "[ . 1 . 2]" 1
3 1 1 LYS O 1 40 THR N . . 2.800 2.737 2.674 2.794 . 0 0 "[ . 1 . 2]" 1
4 1 2 VAL H 1 2 VAL HB . . 2.830 2.563 2.209 2.833 0.003 11 0 "[ . 1 . 2]" 1
5 1 2 VAL HA 1 39 ASN HA . . 2.960 2.074 1.837 2.419 . 0 0 "[ . 1 . 2]" 1
6 1 2 VAL HA 1 40 THR H . . 4.380 3.304 2.800 3.680 . 0 0 "[ . 1 . 2]" 1
7 1 2 VAL HB 1 3 TYR H . . 5.500 4.345 3.953 4.536 . 0 0 "[ . 1 . 2]" 1
8 1 2 VAL QG 1 3 TYR H . . 4.990 2.598 2.036 3.048 . 0 0 "[ . 1 . 2]" 1
9 1 2 VAL QG 1 39 ASN HA . . 5.000 2.522 1.899 3.495 . 0 0 "[ . 1 . 2]" 1
10 1 2 VAL QG 1 39 ASN QB . . 6.890 2.966 1.948 4.171 . 0 0 "[ . 1 . 2]" 1
11 1 2 VAL QG 1 39 ASN QD . . 5.000 2.870 1.884 3.261 . 0 0 "[ . 1 . 2]" 1
12 1 2 VAL QG 1 40 THR H . . 6.410 3.697 2.755 4.857 . 0 0 "[ . 1 . 2]" 1
13 1 2 VAL MG1 1 3 TYR H . . 6.530 2.762 2.042 4.201 . 0 0 "[ . 1 . 2]" 1
14 1 2 VAL MG1 1 39 ASN HD21 . . 6.530 4.703 3.417 5.378 . 0 0 "[ . 1 . 2]" 1
15 1 2 VAL MG1 1 39 ASN HD22 . . 6.530 4.820 3.936 5.456 . 0 0 "[ . 1 . 2]" 1
16 1 2 VAL MG2 1 3 TYR H . . 6.530 3.772 2.418 4.165 . 0 0 "[ . 1 . 2]" 1
17 1 2 VAL MG2 1 39 ASN HD21 . . 6.530 3.257 1.916 4.018 . 0 0 "[ . 1 . 2]" 1
18 1 2 VAL MG2 1 39 ASN HD22 . . 6.530 3.701 2.708 4.908 . 0 0 "[ . 1 . 2]" 1
19 1 3 TYR H 1 3 TYR QB . . 3.400 2.624 2.149 3.257 . 0 0 "[ . 1 . 2]" 1
20 1 3 TYR H 1 3 TYR QE . . 7.070 5.471 3.720 6.083 . 0 0 "[ . 1 . 2]" 1
21 1 3 TYR H 1 4 GLU H . . 4.380 4.130 3.664 4.359 . 0 0 "[ . 1 . 2]" 1
22 1 3 TYR H 1 38 TYR O . . 1.800 1.657 1.403 1.814 0.014 19 0 "[ . 1 . 2]" 1
23 1 3 TYR H 1 39 ASN HA . . 3.330 3.129 1.909 3.528 0.198 18 0 "[ . 1 . 2]" 1
24 1 3 TYR H 1 40 THR H . . 5.250 4.531 3.769 5.119 . 0 0 "[ . 1 . 2]" 1
25 1 3 TYR H 1 40 THR MG . . 5.250 3.697 2.682 4.280 . 0 0 "[ . 1 . 2]" 1
26 1 3 TYR HA 1 4 GLU H . . 3.370 2.225 2.188 2.385 . 0 0 "[ . 1 . 2]" 1
27 1 3 TYR QB 1 4 GLU H . . 4.380 3.437 2.815 3.806 . 0 0 "[ . 1 . 2]" 1
28 1 3 TYR QB 1 8 PHE QB . . 5.080 3.276 2.770 3.819 . 0 0 "[ . 1 . 2]" 1
29 1 3 TYR QB 1 38 TYR QD . . 8.520 5.947 4.709 6.772 . 0 0 "[ . 1 . 2]" 1
30 1 3 TYR QB 1 56 ILE MD . . 5.850 2.860 1.744 4.605 . 0 0 "[ . 1 . 2]" 1
31 1 3 TYR QD 1 4 GLU H . . 6.150 3.800 2.568 4.573 . 0 0 "[ . 1 . 2]" 1
32 1 3 TYR QD 1 8 PHE QB . . 6.660 3.425 1.940 5.034 . 0 0 "[ . 1 . 2]" 1
33 1 3 TYR QE 1 89 ILE MD . . 5.730 3.477 2.520 4.431 . 0 0 "[ . 1 . 2]" 1
34 1 3 TYR N 1 38 TYR O . . 2.800 2.476 2.363 2.770 . 0 0 "[ . 1 . 2]" 1
35 1 3 TYR O 1 38 TYR H . . 1.800 1.825 1.810 1.852 0.052 17 0 "[ . 1 . 2]" 1
36 1 3 TYR O 1 38 TYR N . . 2.800 2.448 2.362 2.591 . 0 0 "[ . 1 . 2]" 1
37 1 4 GLU H 1 4 GLU QG . . 3.370 2.144 1.928 2.766 . 0 0 "[ . 1 . 2]" 1
38 1 4 GLU HA 1 5 ARG H . . 3.330 2.568 2.385 2.717 . 0 0 "[ . 1 . 2]" 1
39 1 4 GLU HA 1 6 CYS H . . 5.070 4.891 4.675 5.148 0.078 8 0 "[ . 1 . 2]" 1
40 1 4 GLU HA 1 7 GLU QB . . 5.070 4.360 4.201 4.618 . 0 0 "[ . 1 . 2]" 1
41 1 4 GLU QB 1 6 CYS H . . 4.670 3.638 3.326 3.899 . 0 0 "[ . 1 . 2]" 1
42 1 4 GLU QG 1 6 CYS H . . 4.580 2.401 2.055 2.895 . 0 0 "[ . 1 . 2]" 1
43 1 4 GLU QG 1 7 GLU H . . 3.370 2.078 1.819 2.494 . 0 0 "[ . 1 . 2]" 1
44 1 4 GLU QG 1 8 PHE H . . 4.670 3.507 2.937 3.989 . 0 0 "[ . 1 . 2]" 1
45 1 4 GLU O 1 8 PHE H . . 1.800 1.705 1.600 1.821 0.021 18 0 "[ . 1 . 2]" 1
46 1 4 GLU O 1 8 PHE N . . 2.800 2.608 2.481 2.739 . 0 0 "[ . 1 . 2]" 1
47 1 5 ARG H 1 5 ARG HA . . 2.680 2.621 2.584 2.668 . 0 0 "[ . 1 . 2]" 1
48 1 5 ARG H 1 5 ARG HG2 . . 4.570 2.042 1.906 2.708 . 0 0 "[ . 1 . 2]" 1
49 1 5 ARG H 1 5 ARG QG . . 4.420 1.926 1.836 1.995 . 0 0 "[ . 1 . 2]" 1
50 1 5 ARG H 1 5 ARG HG3 . . 4.570 3.040 1.996 3.529 . 0 0 "[ . 1 . 2]" 1
51 1 5 ARG H 1 6 CYS H . . 3.210 3.178 2.972 3.283 0.073 1 0 "[ . 1 . 2]" 1
52 1 5 ARG HA 1 6 CYS H . . 3.610 3.646 3.629 3.650 0.040 1 0 "[ . 1 . 2]" 1
53 1 5 ARG QG 1 6 CYS H . . 3.020 1.843 1.749 1.928 . 0 0 "[ . 1 . 2]" 1
54 1 5 ARG HG2 1 6 CYS H . . 3.640 2.431 1.897 3.585 . 0 0 "[ . 1 . 2]" 1
55 1 5 ARG HG3 1 6 CYS H . . 3.640 2.134 1.916 2.875 . 0 0 "[ . 1 . 2]" 1
56 1 5 ARG O 1 9 ALA H . . 1.800 1.711 1.523 1.805 0.005 7 0 "[ . 1 . 2]" 1
57 1 5 ARG O 1 9 ALA N . . 2.800 2.680 2.520 2.790 . 0 0 "[ . 1 . 2]" 1
58 1 6 CYS CB 1 128 CYS SG . . 3.100 3.047 2.983 3.114 0.014 8 0 "[ . 1 . 2]" 1
59 1 6 CYS H 1 6 CYS HA . . 2.680 2.717 2.683 2.759 0.079 10 0 "[ . 1 . 2]" 1
60 1 6 CYS H 1 6 CYS HB2 . . 3.610 2.254 2.025 2.583 . 0 0 "[ . 1 . 2]" 1
61 1 6 CYS H 1 6 CYS QB . . 3.410 2.222 2.005 2.526 . 0 0 "[ . 1 . 2]" 1
62 1 6 CYS H 1 6 CYS HB3 . . 3.610 3.431 3.222 3.569 . 0 0 "[ . 1 . 2]" 1
63 1 6 CYS H 1 7 GLU H . . 3.700 3.225 3.105 3.361 . 0 0 "[ . 1 . 2]" 1
64 1 6 CYS HA 1 7 GLU H . . 3.580 3.631 3.620 3.642 0.062 4 0 "[ . 1 . 2]" 1
65 1 6 CYS HA 1 8 PHE H . . 5.000 5.032 5.010 5.066 0.066 17 0 "[ . 1 . 2]" 1
66 1 6 CYS HA 1 9 ALA H . . 3.760 3.668 3.602 3.754 . 0 0 "[ . 1 . 2]" 1
67 1 6 CYS HA 1 9 ALA MB . . 4.640 2.628 2.420 2.903 . 0 0 "[ . 1 . 2]" 1
68 1 6 CYS HA 1 10 ARG H . . 3.860 3.915 3.763 3.980 0.120 8 0 "[ . 1 . 2]" 1
69 1 6 CYS QB 1 10 ARG H . . 6.380 4.549 4.447 4.670 . 0 0 "[ . 1 . 2]" 1
70 1 6 CYS QB 1 128 CYS H . . 6.380 5.689 5.559 5.777 . 0 0 "[ . 1 . 2]" 1
71 1 6 CYS HB2 1 7 GLU H . . 2.800 2.376 1.932 2.838 0.038 17 0 "[ . 1 . 2]" 1
72 1 6 CYS HB3 1 7 GLU H . . 2.800 2.495 1.945 2.944 0.144 18 0 "[ . 1 . 2]" 1
73 1 6 CYS O 1 10 ARG H . . 1.800 1.770 1.651 1.813 0.013 8 0 "[ . 1 . 2]" 1
74 1 6 CYS O 1 10 ARG N . . 2.800 2.722 2.615 2.772 . 0 0 "[ . 1 . 2]" 1
75 1 6 CYS SG 1 128 CYS CB . . 3.100 2.978 2.959 3.007 . 0 0 "[ . 1 . 2]" 1
76 1 6 CYS SG 1 128 CYS SG . . 2.100 2.086 1.965 2.134 0.034 5 0 "[ . 1 . 2]" 1
77 1 7 GLU H 1 7 GLU HA . . 2.590 2.606 2.575 2.624 0.034 3 0 "[ . 1 . 2]" 1
78 1 7 GLU H 1 7 GLU HB2 . . 3.920 2.195 2.143 2.230 . 0 0 "[ . 1 . 2]" 1
79 1 7 GLU H 1 7 GLU QB . . 3.520 2.172 2.123 2.207 . 0 0 "[ . 1 . 2]" 1
80 1 7 GLU H 1 7 GLU HB3 . . 3.920 3.477 3.431 3.502 . 0 0 "[ . 1 . 2]" 1
81 1 7 GLU H 1 8 PHE H . . 3.700 3.304 3.265 3.390 . 0 0 "[ . 1 . 2]" 1
82 1 7 GLU H 1 8 PHE QD . . 7.620 6.473 5.737 6.682 . 0 0 "[ . 1 . 2]" 1
83 1 7 GLU H 1 9 ALA H . . 4.850 4.508 4.389 4.708 . 0 0 "[ . 1 . 2]" 1
84 1 7 GLU HA 1 9 ALA H . . 5.500 4.637 4.506 4.882 . 0 0 "[ . 1 . 2]" 1
85 1 7 GLU HA 1 10 ARG H . . 3.480 3.537 3.466 3.623 0.143 8 0 "[ . 1 . 2]" 1
86 1 7 GLU HA 1 10 ARG QB . . 3.500 2.666 2.506 2.867 . 0 0 "[ . 1 . 2]" 1
87 1 7 GLU QB 1 8 PHE H . . 2.420 2.330 2.259 2.354 . 0 0 "[ . 1 . 2]" 1
88 1 7 GLU HB2 1 8 PHE H . . 2.650 2.667 2.624 2.773 0.123 17 0 "[ . 1 . 2]" 1
89 1 7 GLU HB3 1 8 PHE H . . 2.650 2.575 2.398 2.650 . 0 0 "[ . 1 . 2]" 1
90 1 7 GLU O 1 11 THR H . . 1.800 1.728 1.514 1.802 0.002 19 0 "[ . 1 . 2]" 1
91 1 7 GLU O 1 11 THR N . . 2.800 2.697 2.499 2.774 . 0 0 "[ . 1 . 2]" 1
92 1 8 PHE H 1 8 PHE HB2 . . 3.640 1.988 1.908 2.144 . 0 0 "[ . 1 . 2]" 1
93 1 8 PHE H 1 8 PHE HB3 . . 3.640 2.920 2.625 3.283 . 0 0 "[ . 1 . 2]" 1
94 1 8 PHE H 1 9 ALA H . . 3.700 3.041 2.980 3.128 . 0 0 "[ . 1 . 2]" 1
95 1 8 PHE HA 1 11 THR HB . . 3.500 2.651 2.273 2.839 . 0 0 "[ . 1 . 2]" 1
96 1 8 PHE QB 1 9 ALA H . . 3.360 2.255 2.066 2.434 . 0 0 "[ . 1 . 2]" 1
97 1 8 PHE HB2 1 9 ALA H . . 3.920 3.313 2.805 3.627 . 0 0 "[ . 1 . 2]" 1
98 1 8 PHE HB3 1 9 ALA H . . 3.920 2.305 2.091 2.588 . 0 0 "[ . 1 . 2]" 1
99 1 8 PHE QD 1 56 ILE MD . . 5.990 3.422 2.678 4.498 . 0 0 "[ . 1 . 2]" 1
100 1 8 PHE QE 1 9 ALA H . . 7.530 6.130 5.680 6.525 . 0 0 "[ . 1 . 2]" 1
101 1 8 PHE QE 1 56 ILE MD . . 5.500 2.640 1.842 3.966 . 0 0 "[ . 1 . 2]" 1
102 1 8 PHE HZ 1 89 ILE MD . . 5.080 3.652 2.169 4.197 . 0 0 "[ . 1 . 2]" 1
103 1 8 PHE O 1 12 LEU H . . 1.800 1.688 1.446 1.802 0.002 17 0 "[ . 1 . 2]" 1
104 1 8 PHE O 1 12 LEU N . . 2.800 2.682 2.430 2.792 . 0 0 "[ . 1 . 2]" 1
105 1 9 ALA H 1 9 ALA HA . . 2.830 2.761 2.710 2.791 . 0 0 "[ . 1 . 2]" 1
106 1 9 ALA H 1 11 THR H . . 5.190 4.446 4.317 4.657 . 0 0 "[ . 1 . 2]" 1
107 1 9 ALA H 1 29 VAL QG . . 5.500 3.071 2.593 3.365 . 0 0 "[ . 1 . 2]" 1
108 1 9 ALA HA 1 11 THR H . . 5.280 4.837 4.741 5.047 . 0 0 "[ . 1 . 2]" 1
109 1 9 ALA HA 1 12 LEU H . . 4.010 3.688 3.568 3.878 . 0 0 "[ . 1 . 2]" 1
110 1 9 ALA HA 1 12 LEU QB . . 4.360 2.663 2.497 2.902 . 0 0 "[ . 1 . 2]" 1
111 1 9 ALA HA 1 12 LEU QD . . 5.930 3.386 3.135 3.688 . 0 0 "[ . 1 . 2]" 1
112 1 9 ALA HA 1 13 LYS H . . 5.010 3.902 3.790 3.972 . 0 0 "[ . 1 . 2]" 1
113 1 9 ALA MB 1 125 ILE MD . . 6.250 3.993 3.551 4.159 . 0 0 "[ . 1 . 2]" 1
114 1 9 ALA MB 1 128 CYS QB . . 5.080 3.479 3.162 3.660 . 0 0 "[ . 1 . 2]" 1
115 1 9 ALA MB 1 130 VAL QG . . 6.250 2.801 1.885 3.389 . 0 0 "[ . 1 . 2]" 1
116 1 9 ALA O 1 13 LYS H . . 1.800 1.802 1.741 1.818 0.018 17 0 "[ . 1 . 2]" 1
117 1 9 ALA O 1 13 LYS N . . 2.800 2.790 2.721 2.804 0.004 17 0 "[ . 1 . 2]" 1
118 1 10 ARG H 1 10 ARG HB2 . . 2.900 2.290 2.151 2.479 . 0 0 "[ . 1 . 2]" 1
119 1 10 ARG H 1 10 ARG QB . . 2.620 2.160 2.094 2.210 . 0 0 "[ . 1 . 2]" 1
120 1 10 ARG H 1 10 ARG HB3 . . 2.900 2.698 2.482 2.878 . 0 0 "[ . 1 . 2]" 1
121 1 10 ARG H 1 10 ARG QG . . 4.580 3.903 3.759 4.011 . 0 0 "[ . 1 . 2]" 1
122 1 10 ARG H 1 11 THR H . . 3.110 2.957 2.774 3.065 . 0 0 "[ . 1 . 2]" 1
123 1 10 ARG H 1 12 LEU H . . 5.340 4.421 4.314 4.493 . 0 0 "[ . 1 . 2]" 1
124 1 10 ARG H 1 130 VAL QG . . 7.630 3.863 2.134 4.970 . 0 0 "[ . 1 . 2]" 1
125 1 10 ARG HA 1 13 LYS H . . 3.700 3.678 3.578 3.723 0.023 16 0 "[ . 1 . 2]" 1
126 1 10 ARG HA 1 13 LYS QB . . 3.470 3.022 2.706 3.134 . 0 0 "[ . 1 . 2]" 1
127 1 10 ARG QB 1 11 THR H . . 3.590 2.227 2.039 2.348 . 0 0 "[ . 1 . 2]" 1
128 1 10 ARG QG 1 14 ARG H . . 5.690 4.262 4.077 4.528 . 0 0 "[ . 1 . 2]" 1
129 1 10 ARG O 1 14 ARG H . . 1.800 1.806 1.800 1.815 0.015 15 0 "[ . 1 . 2]" 1
130 1 10 ARG O 1 14 ARG N . . 2.800 2.567 2.517 2.617 . 0 0 "[ . 1 . 2]" 1
131 1 11 THR H 1 11 THR HB . . 2.550 2.313 2.267 2.381 . 0 0 "[ . 1 . 2]" 1
132 1 11 THR H 1 11 THR MG . . 4.540 3.671 3.666 3.678 . 0 0 "[ . 1 . 2]" 1
133 1 11 THR H 1 12 LEU H . . 3.640 2.926 2.872 3.001 . 0 0 "[ . 1 . 2]" 1
134 1 11 THR H 1 12 LEU QD . . 7.630 4.974 4.550 5.188 . 0 0 "[ . 1 . 2]" 1
135 1 11 THR HA 1 14 ARG QB . . 3.840 2.039 1.923 2.355 . 0 0 "[ . 1 . 2]" 1
136 1 11 THR HB 1 12 LEU H . . 2.490 2.493 2.439 2.546 0.056 17 0 "[ . 1 . 2]" 1
137 1 11 THR MG 1 12 LEU H . . 3.990 3.214 3.097 3.338 . 0 0 "[ . 1 . 2]" 1
138 1 11 THR MG 1 14 ARG H . . 5.570 4.290 4.194 4.458 . 0 0 "[ . 1 . 2]" 1
139 1 11 THR MG 1 89 ILE MD . . 5.410 2.205 1.839 2.881 . 0 0 "[ . 1 . 2]" 1
140 1 11 THR O 1 15 ASN H . . 1.800 1.773 1.713 1.806 0.006 8 0 "[ . 1 . 2]" 1
141 1 11 THR O 1 15 ASN N . . 2.800 2.481 2.407 2.539 . 0 0 "[ . 1 . 2]" 1
142 1 12 LEU H 1 12 LEU HA . . 2.590 2.722 2.705 2.757 0.167 8 0 "[ . 1 . 2]" 1
143 1 12 LEU H 1 12 LEU HB2 . . 3.140 1.987 1.979 2.009 . 0 0 "[ . 1 . 2]" 1
144 1 12 LEU H 1 12 LEU HB3 . . 3.140 3.200 3.133 3.307 0.167 9 0 "[ . 1 . 2]" 1
145 1 12 LEU H 1 12 LEU QD . . 5.180 2.876 2.417 3.112 . 0 0 "[ . 1 . 2]" 1
146 1 12 LEU H 1 12 LEU HG . . 4.260 4.120 3.905 4.286 0.026 10 0 "[ . 1 . 2]" 1
147 1 12 LEU HA 1 13 LYS H . . 3.610 3.630 3.623 3.640 0.030 19 0 "[ . 1 . 2]" 1
148 1 12 LEU HA 1 15 ASN H . . 3.500 3.251 3.054 3.389 . 0 0 "[ . 1 . 2]" 1
149 1 12 LEU HA 1 15 ASN QB . . 3.590 2.716 2.348 2.929 . 0 0 "[ . 1 . 2]" 1
150 1 12 LEU HA 1 16 GLY H . . 5.120 3.839 3.629 4.032 . 0 0 "[ . 1 . 2]" 1
151 1 12 LEU HA 1 17 MET H . . 5.190 3.799 3.540 4.325 . 0 0 "[ . 1 . 2]" 1
152 1 12 LEU HA 1 18 ALA H . . 5.500 3.912 3.611 4.400 . 0 0 "[ . 1 . 2]" 1
153 1 12 LEU HA 1 93 ILE MD . . 3.920 2.815 1.916 3.151 . 0 0 "[ . 1 . 2]" 1
154 1 12 LEU QB 1 13 LYS H . . 3.620 2.553 2.407 2.665 . 0 0 "[ . 1 . 2]" 1
155 1 12 LEU QB 1 17 MET H . . 5.500 3.950 3.551 4.290 . 0 0 "[ . 1 . 2]" 1
156 1 12 LEU QB 1 17 MET QB . . 5.080 3.496 3.114 3.969 . 0 0 "[ . 1 . 2]" 1
157 1 12 LEU QD 1 13 LYS H . . 7.010 4.037 3.898 4.109 . 0 0 "[ . 1 . 2]" 1
158 1 12 LEU QD 1 17 MET H . . 5.500 3.891 3.392 4.226 . 0 0 "[ . 1 . 2]" 1
159 1 12 LEU QD 1 17 MET QB . . 4.450 2.280 1.948 2.842 . 0 0 "[ . 1 . 2]" 1
160 1 12 LEU QD 1 28 TRP QB . . 4.450 1.914 1.786 2.255 . 0 0 "[ . 1 . 2]" 1
161 1 12 LEU QD 1 29 VAL H . . 5.500 3.857 3.632 4.105 . 0 0 "[ . 1 . 2]" 1
162 1 12 LEU QD 1 57 PHE QE . . 6.520 3.730 3.288 4.171 . 0 0 "[ . 1 . 2]" 1
163 1 12 LEU QD 1 57 PHE HZ . . 5.500 3.160 2.526 3.743 . 0 0 "[ . 1 . 2]" 1
164 1 12 LEU QD 1 89 ILE MD . . 5.730 2.799 2.455 2.926 . 0 0 "[ . 1 . 2]" 1
165 1 13 LYS H 1 13 LYS HA . . 2.770 2.810 2.784 2.829 0.059 16 0 "[ . 1 . 2]" 1
166 1 13 LYS H 1 13 LYS HB2 . . 3.230 2.191 2.029 2.373 . 0 0 "[ . 1 . 2]" 1
167 1 13 LYS H 1 13 LYS HB3 . . 3.230 2.806 2.571 3.071 . 0 0 "[ . 1 . 2]" 1
168 1 13 LYS H 1 14 ARG H . . 2.550 2.567 2.504 2.643 0.093 19 0 "[ . 1 . 2]" 1
169 1 13 LYS H 1 15 ASN H . . 4.870 3.960 3.855 4.037 . 0 0 "[ . 1 . 2]" 1
170 1 13 LYS H 1 25 LEU QD . . 5.560 3.591 3.126 4.126 . 0 0 "[ . 1 . 2]" 1
171 1 13 LYS HA 1 14 ARG H . . 3.550 3.530 3.503 3.556 0.006 11 0 "[ . 1 . 2]" 1
172 1 13 LYS QB 1 14 ARG H . . 3.430 3.016 2.929 3.131 . 0 0 "[ . 1 . 2]" 1
173 1 13 LYS QB 1 18 ALA H . . 5.790 4.455 3.983 5.065 . 0 0 "[ . 1 . 2]" 1
174 1 13 LYS QB 1 130 VAL QG . . 5.050 2.875 2.258 3.344 . 0 0 "[ . 1 . 2]" 1
175 1 14 ARG H 1 14 ARG HB2 . . 2.520 2.477 2.445 2.524 0.004 14 0 "[ . 1 . 2]" 1
176 1 14 ARG H 1 14 ARG HB3 . . 2.520 2.546 2.513 2.591 0.071 8 0 "[ . 1 . 2]" 1
177 1 14 ARG H 1 15 ASN H . . 2.520 2.411 2.307 2.465 . 0 0 "[ . 1 . 2]" 1
178 1 14 ARG H 1 16 GLY H . . 3.890 3.972 3.945 3.997 0.107 6 0 "[ . 1 . 2]" 1
179 1 14 ARG HA 1 15 ASN H . . 3.550 3.514 3.480 3.533 . 0 0 "[ . 1 . 2]" 1
180 1 14 ARG HA 1 16 GLY H . . 4.720 4.610 4.511 4.730 0.010 9 0 "[ . 1 . 2]" 1
181 1 14 ARG QB 1 15 ASN H . . 3.420 2.968 2.908 3.070 . 0 0 "[ . 1 . 2]" 1
182 1 14 ARG HB2 1 15 ASN H . . 4.040 4.053 4.027 4.080 0.040 19 0 "[ . 1 . 2]" 1
183 1 14 ARG HB3 1 15 ASN H . . 4.040 3.053 2.981 3.176 . 0 0 "[ . 1 . 2]" 1
184 1 15 ASN H 1 15 ASN HA . . 2.860 2.868 2.864 2.872 0.012 5 0 "[ . 1 . 2]" 1
185 1 15 ASN H 1 15 ASN HB2 . . 2.800 2.249 2.233 2.271 . 0 0 "[ . 1 . 2]" 1
186 1 15 ASN H 1 15 ASN QB . . 2.460 2.178 2.168 2.192 . 0 0 "[ . 1 . 2]" 1
187 1 15 ASN H 1 15 ASN HB3 . . 2.800 2.912 2.887 2.933 0.133 20 0 "[ . 1 . 2]" 1
188 1 15 ASN H 1 16 GLY H . . 2.400 2.260 2.243 2.280 . 0 0 "[ . 1 . 2]" 1
189 1 15 ASN H 1 16 GLY QA . . 4.550 4.145 4.127 4.160 . 0 0 "[ . 1 . 2]" 1
190 1 15 ASN HA 1 93 ILE MD . . 5.630 4.671 4.540 4.727 . 0 0 "[ . 1 . 2]" 1
191 1 15 ASN QB 1 16 GLY H . . 3.070 2.607 2.529 2.665 . 0 0 "[ . 1 . 2]" 1
192 1 15 ASN QB 1 17 MET H . . 4.550 3.394 3.071 3.940 . 0 0 "[ . 1 . 2]" 1
193 1 15 ASN QB 1 93 ILE MD . . 4.450 2.512 2.326 2.687 . 0 0 "[ . 1 . 2]" 1
194 1 15 ASN HB2 1 16 GLY H . . 3.300 3.411 3.392 3.429 0.129 11 0 "[ . 1 . 2]" 1
195 1 15 ASN HB2 1 93 ILE MD . . 5.630 2.710 2.400 2.911 . 0 0 "[ . 1 . 2]" 1
196 1 15 ASN HB3 1 16 GLY H . . 3.300 2.706 2.610 2.780 . 0 0 "[ . 1 . 2]" 1
197 1 15 ASN HB3 1 93 ILE MD . . 5.630 3.005 2.703 3.269 . 0 0 "[ . 1 . 2]" 1
198 1 16 GLY H 1 16 GLY QA . . 2.480 2.300 2.263 2.337 . 0 0 "[ . 1 . 2]" 1
199 1 16 GLY H 1 17 MET H . . 2.930 2.115 1.911 2.458 . 0 0 "[ . 1 . 2]" 1
200 1 16 GLY H 1 18 ALA H . . 4.110 3.604 3.350 3.866 . 0 0 "[ . 1 . 2]" 1
201 1 16 GLY QA 1 17 MET H . . 3.140 2.729 2.532 2.848 . 0 0 "[ . 1 . 2]" 1
202 1 16 GLY QA 1 18 ALA H . . 4.740 4.039 3.774 4.154 . 0 0 "[ . 1 . 2]" 1
203 1 17 MET H 1 18 ALA H . . 2.400 1.889 1.848 1.951 . 0 0 "[ . 1 . 2]" 1
204 1 17 MET QB 1 28 TRP HE1 . . 5.660 4.193 3.616 4.847 . 0 0 "[ . 1 . 2]" 1
205 1 18 ALA H 1 18 ALA HA . . 2.710 2.749 2.693 2.821 0.111 17 0 "[ . 1 . 2]" 1
206 1 18 ALA H 1 18 ALA MB . . 3.430 2.040 1.933 2.162 . 0 0 "[ . 1 . 2]" 1
207 1 18 ALA H 1 20 TYR H . . 4.940 4.990 4.824 5.092 0.152 14 0 "[ . 1 . 2]" 1
208 1 18 ALA H 1 25 LEU QD . . 5.900 3.981 3.523 4.286 . 0 0 "[ . 1 . 2]" 1
209 1 18 ALA HA 1 19 GLY H . . 3.420 2.217 2.186 2.354 . 0 0 "[ . 1 . 2]" 1
210 1 18 ALA MB 1 19 GLY H . . 4.110 3.380 2.840 3.617 . 0 0 "[ . 1 . 2]" 1
211 1 18 ALA MB 1 20 TYR H . . 6.530 4.752 4.278 4.947 . 0 0 "[ . 1 . 2]" 1
212 1 18 ALA MB 1 25 LEU QB . . 5.080 1.903 1.754 2.064 . 0 0 "[ . 1 . 2]" 1
213 1 19 GLY H 1 19 GLY QA . . 2.550 2.219 2.196 2.290 . 0 0 "[ . 1 . 2]" 1
214 1 19 GLY H 1 20 TYR H . . 2.400 2.287 1.996 2.401 0.001 20 0 "[ . 1 . 2]" 1
215 1 19 GLY H 1 24 SER HA . . 4.450 2.874 1.925 3.489 . 0 0 "[ . 1 . 2]" 1
216 1 19 GLY H 1 28 TRP HE1 . . 3.700 3.680 3.189 3.802 0.102 9 0 "[ . 1 . 2]" 1
217 1 19 GLY QA 1 25 LEU H . . 3.890 2.667 2.081 3.298 . 0 0 "[ . 1 . 2]" 1
218 1 20 TYR H 1 20 TYR HA . . 2.770 2.718 2.690 2.751 . 0 0 "[ . 1 . 2]" 1
219 1 20 TYR H 1 20 TYR HB2 . . 3.450 2.030 1.907 2.179 . 0 0 "[ . 1 . 2]" 1
220 1 20 TYR H 1 20 TYR QB . . 3.210 1.970 1.884 2.053 . 0 0 "[ . 1 . 2]" 1
221 1 20 TYR H 1 20 TYR HB3 . . 3.450 2.708 2.510 2.927 . 0 0 "[ . 1 . 2]" 1
222 1 20 TYR H 1 20 TYR QE . . 7.450 5.997 5.771 6.134 . 0 0 "[ . 1 . 2]" 1
223 1 20 TYR H 1 21 TYR H . . 5.130 4.618 4.550 4.662 . 0 0 "[ . 1 . 2]" 1
224 1 20 TYR H 1 23 VAL MG1 . . 6.700 4.415 3.178 5.799 . 0 0 "[ . 1 . 2]" 1
225 1 20 TYR H 1 23 VAL QG . . 6.380 3.856 3.002 4.339 . 0 0 "[ . 1 . 2]" 1
226 1 20 TYR H 1 23 VAL MG2 . . 6.700 4.713 3.013 5.275 . 0 0 "[ . 1 . 2]" 1
227 1 20 TYR H 1 28 TRP HE1 . . 3.610 2.692 2.441 2.965 . 0 0 "[ . 1 . 2]" 1
228 1 20 TYR HA 1 21 TYR H . . 2.590 2.623 2.506 2.740 0.150 19 0 "[ . 1 . 2]" 1
229 1 20 TYR QB 1 23 VAL H . . 4.020 3.008 2.317 3.255 . 0 0 "[ . 1 . 2]" 1
230 1 20 TYR QB 1 28 TRP HE1 . . 3.470 1.956 1.845 2.267 . 0 0 "[ . 1 . 2]" 1
231 1 20 TYR QD 1 21 TYR H . . 5.970 2.781 2.434 3.046 . 0 0 "[ . 1 . 2]" 1
232 1 20 TYR QD 1 23 VAL H . . 5.160 3.251 2.414 3.911 . 0 0 "[ . 1 . 2]" 1
233 1 20 TYR QD 1 97 LYS HA . . 6.590 5.723 5.049 6.091 . 0 0 "[ . 1 . 2]" 1
234 1 20 TYR QE 1 21 TYR H . . 7.630 3.770 3.550 4.101 . 0 0 "[ . 1 . 2]" 1
235 1 21 TYR H 1 21 TYR HA . . 2.750 2.639 2.619 2.649 . 0 0 "[ . 1 . 2]" 1
236 1 21 TYR H 1 21 TYR HB2 . . 3.450 2.019 1.984 2.080 . 0 0 "[ . 1 . 2]" 1
237 1 21 TYR H 1 21 TYR QB . . 2.700 2.003 1.969 2.063 . 0 0 "[ . 1 . 2]" 1
238 1 21 TYR H 1 21 TYR HB3 . . 3.450 3.352 3.319 3.402 . 0 0 "[ . 1 . 2]" 1
239 1 21 TYR H 1 22 GLY H . . 5.340 3.133 2.991 3.232 . 0 0 "[ . 1 . 2]" 1
240 1 21 TYR QB 1 22 GLY H . . 3.330 2.448 2.268 2.784 . 0 0 "[ . 1 . 2]" 1
241 1 21 TYR QB 1 23 VAL H . . 4.640 4.206 4.018 4.244 . 0 0 "[ . 1 . 2]" 1
242 1 21 TYR HB2 1 22 GLY H . . 3.520 2.784 2.629 3.115 . 0 0 "[ . 1 . 2]" 1
243 1 21 TYR HB3 1 22 GLY H . . 3.520 2.721 2.474 3.146 . 0 0 "[ . 1 . 2]" 1
244 1 21 TYR QD 1 22 GLY H . . 7.640 4.473 4.340 4.697 . 0 0 "[ . 1 . 2]" 1
245 1 22 GLY H 1 22 GLY QA . . 2.550 2.363 2.304 2.468 . 0 0 "[ . 1 . 2]" 1
246 1 22 GLY H 1 23 VAL H . . 2.430 2.289 1.876 2.391 . 0 0 "[ . 1 . 2]" 1
247 1 22 GLY H 1 23 VAL QG . . 8.090 3.235 2.641 3.558 . 0 0 "[ . 1 . 2]" 1
248 1 23 VAL H 1 23 VAL HA . . 2.680 2.719 2.678 2.820 0.140 14 0 "[ . 1 . 2]" 1
249 1 23 VAL H 1 23 VAL HB . . 3.760 2.765 2.435 3.528 . 0 0 "[ . 1 . 2]" 1
250 1 23 VAL H 1 23 VAL MG1 . . 4.140 3.224 1.869 3.707 . 0 0 "[ . 1 . 2]" 1
251 1 23 VAL H 1 23 VAL QG . . 3.470 1.875 1.765 1.959 . 0 0 "[ . 1 . 2]" 1
252 1 23 VAL H 1 23 VAL MG2 . . 4.140 2.157 1.814 3.706 . 0 0 "[ . 1 . 2]" 1
253 1 23 VAL H 1 24 SER H . . 5.500 4.501 4.376 4.576 . 0 0 "[ . 1 . 2]" 1
254 1 23 VAL H 1 28 TRP HE1 . . 5.340 4.666 4.343 5.044 . 0 0 "[ . 1 . 2]" 1
255 1 23 VAL HA 1 24 SER H . . 2.490 2.188 2.182 2.204 . 0 0 "[ . 1 . 2]" 1
256 1 23 VAL HA 1 28 TRP HE1 . . 5.500 4.870 4.594 5.131 . 0 0 "[ . 1 . 2]" 1
257 1 23 VAL HB 1 24 SER H . . 5.470 4.192 3.651 4.447 . 0 0 "[ . 1 . 2]" 1
258 1 23 VAL HB 1 28 TRP HE1 . . 4.350 2.689 1.946 4.477 0.127 13 0 "[ . 1 . 2]" 1
259 1 23 VAL QG 1 24 SER H . . 4.850 2.996 2.544 3.707 . 0 0 "[ . 1 . 2]" 1
260 1 23 VAL QG 1 28 TRP H . . 7.380 3.438 2.995 4.684 . 0 0 "[ . 1 . 2]" 1
261 1 23 VAL QG 1 28 TRP HE1 . . 4.440 2.438 1.823 2.756 . 0 0 "[ . 1 . 2]" 1
262 1 23 VAL QG 1 106 ILE H . . 5.500 3.591 3.171 4.141 . 0 0 "[ . 1 . 2]" 1
263 1 23 VAL QG 1 106 ILE MD . . 4.450 2.237 1.847 2.526 . 0 0 "[ . 1 . 2]" 1
264 1 23 VAL QG 1 106 ILE MG . . 6.230 2.955 1.924 3.347 . 0 0 "[ . 1 . 2]" 1
265 1 23 VAL QG 1 112 TRP HE1 . . 7.910 4.907 3.365 5.785 . 0 0 "[ . 1 . 2]" 1
266 1 23 VAL MG1 1 24 SER H . . 5.880 3.254 2.567 4.330 . 0 0 "[ . 1 . 2]" 1
267 1 23 VAL MG1 1 28 TRP HE1 . . 5.190 2.875 1.865 4.462 . 0 0 "[ . 1 . 2]" 1
268 1 23 VAL MG2 1 24 SER H . . 5.880 4.089 3.119 4.326 . 0 0 "[ . 1 . 2]" 1
269 1 23 VAL MG2 1 28 TRP HE1 . . 5.190 3.280 1.866 4.207 . 0 0 "[ . 1 . 2]" 1
270 1 24 SER H 1 24 SER HA . . 2.910 2.877 2.873 2.880 . 0 0 "[ . 1 . 2]" 1
271 1 24 SER H 1 25 LEU H . . 5.500 4.597 4.564 4.608 . 0 0 "[ . 1 . 2]" 1
272 1 24 SER H 1 27 ASP QB . . 4.640 2.329 1.951 3.157 . 0 0 "[ . 1 . 2]" 1
273 1 24 SER H 1 28 TRP HE1 . . 5.500 5.313 4.949 5.528 0.028 7 0 "[ . 1 . 2]" 1
274 1 24 SER HA 1 25 LEU H . . 2.990 2.410 2.305 2.578 . 0 0 "[ . 1 . 2]" 1
275 1 24 SER HA 1 26 ALA H . . 4.420 4.325 4.171 4.456 0.036 7 0 "[ . 1 . 2]" 1
276 1 24 SER HA 1 27 ASP H . . 4.650 4.398 4.253 4.700 0.050 14 0 "[ . 1 . 2]" 1
277 1 24 SER O 1 28 TRP H . . 1.800 1.798 1.756 1.826 0.026 19 0 "[ . 1 . 2]" 1
278 1 24 SER O 1 28 TRP N . . 2.800 2.695 2.649 2.772 . 0 0 "[ . 1 . 2]" 1
279 1 25 LEU H 1 25 LEU HA . . 2.620 2.724 2.693 2.794 0.174 16 0 "[ . 1 . 2]" 1
280 1 25 LEU H 1 25 LEU HB2 . . 3.480 2.734 2.498 3.534 0.054 14 0 "[ . 1 . 2]" 1
281 1 25 LEU H 1 25 LEU QB . . 3.050 2.214 2.058 2.789 . 0 0 "[ . 1 . 2]" 1
282 1 25 LEU H 1 25 LEU HB3 . . 3.480 2.354 2.116 2.949 . 0 0 "[ . 1 . 2]" 1
283 1 25 LEU H 1 25 LEU HG . . 4.450 4.026 1.953 4.406 . 0 0 "[ . 1 . 2]" 1
284 1 25 LEU H 1 26 ALA H . . 3.020 2.867 2.703 2.984 . 0 0 "[ . 1 . 2]" 1
285 1 25 LEU H 1 27 ASP H . . 5.440 4.253 4.157 4.577 . 0 0 "[ . 1 . 2]" 1
286 1 25 LEU H 1 28 TRP QB . . 6.380 4.614 4.353 4.793 . 0 0 "[ . 1 . 2]" 1
287 1 25 LEU HA 1 28 TRP QB . . 4.330 2.250 1.902 2.434 . 0 0 "[ . 1 . 2]" 1
288 1 25 LEU HA 1 28 TRP HE1 . . 5.190 4.955 4.651 5.223 0.033 7 0 "[ . 1 . 2]" 1
289 1 25 LEU HA 1 29 VAL H . . 5.160 3.815 3.319 3.973 . 0 0 "[ . 1 . 2]" 1
290 1 25 LEU QB 1 125 ILE MD . . 5.520 2.687 2.012 3.967 . 0 0 "[ . 1 . 2]" 1
291 1 25 LEU QD 1 28 TRP H . . 7.010 4.241 3.786 5.150 . 0 0 "[ . 1 . 2]" 1
292 1 25 LEU QD 1 29 VAL H . . 6.700 3.414 2.733 5.071 . 0 0 "[ . 1 . 2]" 1
293 1 25 LEU QD 1 125 ILE MD . . 6.700 1.999 1.659 2.283 . 0 0 "[ . 1 . 2]" 1
294 1 25 LEU QD 1 130 VAL HB . . 6.700 3.823 3.243 4.650 . 0 0 "[ . 1 . 2]" 1
295 1 25 LEU QD 1 130 VAL QG . . 6.700 2.469 1.925 3.259 . 0 0 "[ . 1 . 2]" 1
296 1 25 LEU HG 1 26 ALA H . . 3.480 3.250 2.037 3.536 0.056 7 0 "[ . 1 . 2]" 1
297 1 25 LEU O 1 29 VAL H . . 1.800 1.740 1.512 1.808 0.008 12 0 "[ . 1 . 2]" 1
298 1 25 LEU O 1 29 VAL N . . 2.800 2.722 2.495 2.795 . 0 0 "[ . 1 . 2]" 1
299 1 26 ALA H 1 26 ALA HA . . 2.850 2.782 2.763 2.802 . 0 0 "[ . 1 . 2]" 1
300 1 26 ALA H 1 26 ALA MB . . 3.550 2.050 1.931 2.159 . 0 0 "[ . 1 . 2]" 1
301 1 26 ALA H 1 27 ASP H . . 2.680 2.719 2.653 2.848 0.168 14 0 "[ . 1 . 2]" 1
302 1 26 ALA H 1 28 TRP H . . 4.010 3.978 3.786 4.057 0.047 17 0 "[ . 1 . 2]" 1
303 1 26 ALA H 1 125 ILE MD . . 4.450 2.857 2.295 3.463 . 0 0 "[ . 1 . 2]" 1
304 1 26 ALA HA 1 28 TRP H . . 4.330 4.283 4.194 4.343 0.013 7 0 "[ . 1 . 2]" 1
305 1 26 ALA HA 1 29 VAL H . . 3.580 3.560 3.450 3.688 0.108 19 0 "[ . 1 . 2]" 1
306 1 26 ALA HA 1 29 VAL HB . . 3.500 2.802 2.544 3.151 . 0 0 "[ . 1 . 2]" 1
307 1 26 ALA HA 1 30 CYS H . . 5.500 3.584 3.338 3.990 . 0 0 "[ . 1 . 2]" 1
308 1 26 ALA HA 1 125 ILE H . . 5.310 4.597 4.021 5.095 . 0 0 "[ . 1 . 2]" 1
309 1 26 ALA HA 1 125 ILE MD . . 4.330 3.276 2.919 3.546 . 0 0 "[ . 1 . 2]" 1
310 1 26 ALA MB 1 27 ASP H . . 3.640 2.613 2.469 2.761 . 0 0 "[ . 1 . 2]" 1
311 1 26 ALA MB 1 121 LEU H . . 5.500 4.185 3.897 4.439 . 0 0 "[ . 1 . 2]" 1
312 1 26 ALA MB 1 121 LEU QB . . 5.080 3.181 2.758 3.383 . 0 0 "[ . 1 . 2]" 1
313 1 26 ALA MB 1 124 TYR H . . 6.530 4.531 3.897 4.984 . 0 0 "[ . 1 . 2]" 1
314 1 26 ALA MB 1 125 ILE MD . . 5.660 2.598 2.151 3.000 . 0 0 "[ . 1 . 2]" 1
315 1 26 ALA O 1 30 CYS H . . 1.800 1.739 1.623 1.816 0.016 14 0 "[ . 1 . 2]" 1
316 1 26 ALA O 1 30 CYS N . . 2.800 2.703 2.560 2.816 0.016 14 0 "[ . 1 . 2]" 1
317 1 27 ASP H 1 27 ASP QB . . 3.460 2.407 2.131 2.765 . 0 0 "[ . 1 . 2]" 1
318 1 27 ASP H 1 28 TRP H . . 2.590 2.595 2.528 2.644 0.054 17 0 "[ . 1 . 2]" 1
319 1 27 ASP H 1 29 VAL H . . 4.690 4.437 4.276 4.583 . 0 0 "[ . 1 . 2]" 1
320 1 27 ASP HA 1 30 CYS H . . 3.760 3.752 3.397 3.847 0.087 17 0 "[ . 1 . 2]" 1
321 1 27 ASP HA 1 30 CYS QB . . 4.580 3.064 2.460 3.559 . 0 0 "[ . 1 . 2]" 1
322 1 27 ASP HA 1 31 LEU H . . 5.410 3.571 3.241 3.757 . 0 0 "[ . 1 . 2]" 1
323 1 27 ASP HA 1 112 TRP HE1 . . 5.000 4.364 3.629 5.140 0.140 19 0 "[ . 1 . 2]" 1
324 1 27 ASP QB 1 28 TRP H . . 3.870 2.637 2.554 2.777 . 0 0 "[ . 1 . 2]" 1
325 1 27 ASP QB 1 31 LEU H . . 5.380 4.460 4.085 4.892 . 0 0 "[ . 1 . 2]" 1
326 1 27 ASP QB 1 112 TRP HE1 . . 4.450 3.313 2.841 3.744 . 0 0 "[ . 1 . 2]" 1
327 1 27 ASP HB2 1 112 TRP HE1 . . 5.000 4.395 3.090 5.244 0.244 14 0 "[ . 1 . 2]" 1
328 1 27 ASP HB3 1 112 TRP HE1 . . 5.000 3.701 2.895 5.125 0.125 11 0 "[ . 1 . 2]" 1
329 1 27 ASP O 1 31 LEU H . . 1.800 1.725 1.529 1.802 0.002 19 0 "[ . 1 . 2]" 1
330 1 27 ASP O 1 31 LEU N . . 2.800 2.634 2.475 2.786 . 0 0 "[ . 1 . 2]" 1
331 1 28 TRP H 1 28 TRP HA . . 2.770 2.804 2.770 2.825 0.055 19 0 "[ . 1 . 2]" 1
332 1 28 TRP H 1 28 TRP HB2 . . 3.860 2.211 2.097 2.289 . 0 0 "[ . 1 . 2]" 1
333 1 28 TRP H 1 28 TRP QB . . 3.180 2.187 2.079 2.261 . 0 0 "[ . 1 . 2]" 1
334 1 28 TRP H 1 28 TRP HB3 . . 3.860 3.481 3.408 3.519 . 0 0 "[ . 1 . 2]" 1
335 1 28 TRP H 1 29 VAL H . . 2.770 2.765 2.722 2.815 0.045 11 0 "[ . 1 . 2]" 1
336 1 28 TRP H 1 29 VAL QG . . 8.090 4.218 3.885 4.519 . 0 0 "[ . 1 . 2]" 1
337 1 28 TRP H 1 30 CYS H . . 5.380 4.254 4.084 4.399 . 0 0 "[ . 1 . 2]" 1
338 1 28 TRP H 1 31 LEU H . . 5.310 4.392 4.279 4.598 . 0 0 "[ . 1 . 2]" 1
339 1 28 TRP H 1 106 ILE MD . . 7.010 5.310 4.817 5.704 . 0 0 "[ . 1 . 2]" 1
340 1 28 TRP HA 1 29 VAL H . . 3.640 3.643 3.632 3.646 0.006 7 0 "[ . 1 . 2]" 1
341 1 28 TRP HA 1 31 LEU H . . 3.830 3.604 3.381 3.877 0.047 15 0 "[ . 1 . 2]" 1
342 1 28 TRP HA 1 31 LEU QB . . 4.610 2.424 2.135 2.813 . 0 0 "[ . 1 . 2]" 1
343 1 28 TRP HA 1 32 ALA H . . 5.440 3.872 3.530 4.118 . 0 0 "[ . 1 . 2]" 1
344 1 28 TRP HB2 1 29 VAL H . . 3.100 2.503 2.364 2.804 . 0 0 "[ . 1 . 2]" 1
345 1 28 TRP HB3 1 29 VAL H . . 3.100 3.120 2.937 3.214 0.114 9 0 "[ . 1 . 2]" 1
346 1 28 TRP HE1 1 100 VAL QG . . 7.310 5.201 4.187 5.426 . 0 0 "[ . 1 . 2]" 1
347 1 28 TRP HE1 1 106 ILE MD . . 7.310 5.311 4.784 5.874 . 0 0 "[ . 1 . 2]" 1
348 1 28 TRP HH2 1 106 ILE MD . . 4.390 3.138 2.792 3.382 . 0 0 "[ . 1 . 2]" 1
349 1 28 TRP HH2 1 106 ILE MG . . 7.310 5.906 5.506 6.093 . 0 0 "[ . 1 . 2]" 1
350 1 28 TRP HZ3 1 31 LEU QD . . 6.210 2.713 1.917 3.969 . 0 0 "[ . 1 . 2]" 1
351 1 28 TRP HZ3 1 96 ALA MB . . 4.390 2.816 2.008 3.444 . 0 0 "[ . 1 . 2]" 1
352 1 28 TRP O 1 32 ALA H . . 1.800 1.670 1.495 1.807 0.007 19 0 "[ . 1 . 2]" 1
353 1 28 TRP O 1 32 ALA N . . 2.800 2.642 2.484 2.783 . 0 0 "[ . 1 . 2]" 1
354 1 29 VAL H 1 29 VAL HA . . 2.800 2.753 2.707 2.802 0.002 16 0 "[ . 1 . 2]" 1
355 1 29 VAL H 1 29 VAL HB . . 3.390 2.382 2.178 2.657 . 0 0 "[ . 1 . 2]" 1
356 1 29 VAL H 1 29 VAL MG1 . . 4.200 3.681 3.625 3.701 . 0 0 "[ . 1 . 2]" 1
357 1 29 VAL H 1 29 VAL QG . . 3.500 2.202 1.868 2.541 . 0 0 "[ . 1 . 2]" 1
358 1 29 VAL H 1 29 VAL MG2 . . 4.200 2.222 1.874 2.595 . 0 0 "[ . 1 . 2]" 1
359 1 29 VAL H 1 30 CYS H . . 3.500 2.935 2.788 3.021 . 0 0 "[ . 1 . 2]" 1
360 1 29 VAL H 1 125 ILE MD . . 7.310 5.471 5.079 5.830 . 0 0 "[ . 1 . 2]" 1
361 1 29 VAL HA 1 30 CYS H . . 3.640 3.639 3.632 3.641 0.001 6 0 "[ . 1 . 2]" 1
362 1 29 VAL HA 1 32 ALA H . . 3.860 3.433 3.286 3.659 . 0 0 "[ . 1 . 2]" 1
363 1 29 VAL HA 1 32 ALA MB . . 3.990 2.660 2.315 2.982 . 0 0 "[ . 1 . 2]" 1
364 1 29 VAL HA 1 33 GLN H . . 4.510 4.088 3.876 4.197 . 0 0 "[ . 1 . 2]" 1
365 1 29 VAL HB 1 30 CYS H . . 3.520 2.371 2.205 2.582 . 0 0 "[ . 1 . 2]" 1
366 1 29 VAL HB 1 124 TYR HB2 . . 5.520 5.531 5.477 5.574 0.054 2 0 "[ . 1 . 2]" 1
367 1 29 VAL HB 1 124 TYR QB . . 5.120 3.993 3.845 4.174 . 0 0 "[ . 1 . 2]" 1
368 1 29 VAL HB 1 124 TYR HB3 . . 5.520 4.096 3.926 4.320 . 0 0 "[ . 1 . 2]" 1
369 1 29 VAL QG 1 30 CYS H . . 4.230 2.911 2.582 3.179 . 0 0 "[ . 1 . 2]" 1
370 1 29 VAL MG1 1 30 CYS H . . 4.740 3.043 2.620 3.531 . 0 0 "[ . 1 . 2]" 1
371 1 29 VAL MG2 1 30 CYS H . . 4.740 3.833 3.607 4.035 . 0 0 "[ . 1 . 2]" 1
372 1 29 VAL O 1 33 GLN H . . 1.800 1.764 1.671 1.810 0.010 3 0 "[ . 1 . 2]" 1
373 1 29 VAL O 1 33 GLN N . . 2.800 2.525 2.431 2.648 . 0 0 "[ . 1 . 2]" 1
374 1 30 CYS CB 1 116 CYS SG . . 3.100 2.916 2.849 2.992 . 0 0 "[ . 1 . 2]" 1
375 1 30 CYS H 1 30 CYS QB . . 3.620 2.131 2.060 2.242 . 0 0 "[ . 1 . 2]" 1
376 1 30 CYS H 1 31 LEU H . . 3.040 2.861 2.749 3.042 0.002 11 0 "[ . 1 . 2]" 1
377 1 30 CYS H 1 121 LEU QD . . 5.500 2.941 2.479 3.827 . 0 0 "[ . 1 . 2]" 1
378 1 30 CYS H 1 124 TYR QD . . 6.920 4.472 3.612 5.820 . 0 0 "[ . 1 . 2]" 1
379 1 30 CYS HA 1 33 GLN QB . . 3.560 2.208 1.870 2.536 . 0 0 "[ . 1 . 2]" 1
380 1 30 CYS QB 1 31 LEU H . . 4.240 3.125 2.271 3.415 . 0 0 "[ . 1 . 2]" 1
381 1 30 CYS QB 1 121 LEU QB . . 5.080 3.045 2.597 3.687 . 0 0 "[ . 1 . 2]" 1
382 1 30 CYS O 1 34 HIS H . . 1.800 1.784 1.601 1.815 0.015 13 0 "[ . 1 . 2]" 1
383 1 30 CYS O 1 34 HIS N . . 2.800 2.730 2.562 2.777 . 0 0 "[ . 1 . 2]" 1
384 1 30 CYS SG 1 116 CYS CB . . 3.100 3.137 3.051 3.177 0.077 6 0 "[ . 1 . 2]" 1
385 1 30 CYS SG 1 116 CYS SG . . 2.100 2.135 1.956 2.214 0.114 14 0 "[ . 1 . 2]" 1
386 1 31 LEU H 1 31 LEU HA . . 2.770 2.758 2.722 2.798 0.028 5 0 "[ . 1 . 2]" 1
387 1 31 LEU H 1 31 LEU HB2 . . 2.710 2.538 2.192 2.734 0.024 14 0 "[ . 1 . 2]" 1
388 1 31 LEU H 1 31 LEU QB . . 2.410 2.138 2.095 2.171 . 0 0 "[ . 1 . 2]" 1
389 1 31 LEU H 1 31 LEU HB3 . . 2.710 2.345 2.176 2.705 . 0 0 "[ . 1 . 2]" 1
390 1 31 LEU H 1 31 LEU HG . . 4.350 4.332 4.194 4.526 0.176 8 0 "[ . 1 . 2]" 1
391 1 31 LEU H 1 32 ALA H . . 2.990 2.890 2.802 3.002 0.012 3 0 "[ . 1 . 2]" 1
392 1 31 LEU H 1 106 ILE MD . . 6.530 5.250 4.804 5.464 . 0 0 "[ . 1 . 2]" 1
393 1 31 LEU HA 1 32 ALA H . . 3.610 3.631 3.599 3.639 0.029 14 0 "[ . 1 . 2]" 1
394 1 31 LEU HA 1 34 HIS H . . 4.380 3.482 3.175 3.813 . 0 0 "[ . 1 . 2]" 1
395 1 31 LEU QB 1 32 ALA H . . 3.420 2.494 2.166 2.677 . 0 0 "[ . 1 . 2]" 1
396 1 31 LEU QB 1 106 ILE MD . . 4.450 3.130 2.658 3.281 . 0 0 "[ . 1 . 2]" 1
397 1 31 LEU HB2 1 32 ALA H . . 3.920 3.897 3.673 3.988 0.068 9 0 "[ . 1 . 2]" 1
398 1 31 LEU HB3 1 32 ALA H . . 3.920 2.525 2.181 2.735 . 0 0 "[ . 1 . 2]" 1
399 1 31 LEU QD 1 32 ALA H . . 5.830 3.180 2.379 3.704 . 0 0 "[ . 1 . 2]" 1
400 1 31 LEU QD 1 35 GLU H . . 6.980 4.119 3.493 4.590 . 0 0 "[ . 1 . 2]" 1
401 1 31 LEU QD 1 35 GLU QG . . 4.350 2.224 1.712 2.597 . 0 0 "[ . 1 . 2]" 1
402 1 31 LEU QD 1 106 ILE MD . . 5.500 1.810 1.621 2.494 . 0 0 "[ . 1 . 2]" 1
403 1 31 LEU QD 1 106 ILE QG . . 6.210 3.531 3.316 4.144 . 0 0 "[ . 1 . 2]" 1
404 1 31 LEU QD 1 109 TRP H . . 7.010 3.810 3.487 4.079 . 0 0 "[ . 1 . 2]" 1
405 1 31 LEU QD 1 109 TRP QB . . 4.450 1.948 1.685 2.371 . 0 0 "[ . 1 . 2]" 1
406 1 31 LEU QD 1 109 TRP HD1 . . 5.800 3.281 2.527 3.744 . 0 0 "[ . 1 . 2]" 1
407 1 31 LEU QD 1 109 TRP HE1 . . 5.930 3.753 3.100 4.172 . 0 0 "[ . 1 . 2]" 1
408 1 31 LEU QD 1 109 TRP HE3 . . 4.450 2.443 1.944 2.916 . 0 0 "[ . 1 . 2]" 1
409 1 31 LEU QD 1 109 TRP HZ3 . . 5.960 3.361 2.598 4.109 . 0 0 "[ . 1 . 2]" 1
410 1 31 LEU QD 1 112 TRP H . . 6.420 3.798 3.185 4.834 . 0 0 "[ . 1 . 2]" 1
411 1 32 ALA H 1 32 ALA HA . . 2.820 2.793 2.697 2.859 0.039 13 0 "[ . 1 . 2]" 1
412 1 32 ALA H 1 32 ALA MB . . 3.430 2.056 1.935 2.166 . 0 0 "[ . 1 . 2]" 1
413 1 32 ALA H 1 33 GLN H . . 2.770 2.614 2.417 2.851 0.081 1 0 "[ . 1 . 2]" 1
414 1 32 ALA H 1 34 HIS H . . 5.500 4.575 4.404 4.667 . 0 0 "[ . 1 . 2]" 1
415 1 32 ALA HA 1 35 GLU H . . 3.510 3.361 3.240 3.510 . 0 0 "[ . 1 . 2]" 1
416 1 32 ALA HA 1 35 GLU QB . . 3.370 2.294 1.966 2.758 . 0 0 "[ . 1 . 2]" 1
417 1 33 GLN H 1 33 GLN HB2 . . 2.650 2.309 2.265 2.360 . 0 0 "[ . 1 . 2]" 1
418 1 33 GLN H 1 33 GLN QB . . 2.430 2.183 2.161 2.211 . 0 0 "[ . 1 . 2]" 1
419 1 33 GLN H 1 33 GLN HB3 . . 2.650 2.693 2.654 2.731 0.081 19 0 "[ . 1 . 2]" 1
420 1 33 GLN H 1 34 HIS H . . 2.620 2.674 2.607 2.728 0.108 8 0 "[ . 1 . 2]" 1
421 1 33 GLN H 1 37 ASN QB . . 5.160 3.892 3.322 4.367 . 0 0 "[ . 1 . 2]" 1
422 1 33 GLN HA 1 34 HIS H . . 3.580 3.636 3.632 3.642 0.062 11 0 "[ . 1 . 2]" 1
423 1 33 GLN HA 1 35 GLU H . . 4.200 3.946 3.750 4.119 . 0 0 "[ . 1 . 2]" 1
424 1 33 GLN HA 1 37 ASN H . . 4.850 3.851 2.363 4.740 . 0 0 "[ . 1 . 2]" 1
425 1 33 GLN QB 1 34 HIS H . . 2.910 2.343 2.263 2.393 . 0 0 "[ . 1 . 2]" 1
426 1 33 GLN QB 1 124 TYR QE . . 5.080 3.136 2.413 4.266 . 0 0 "[ . 1 . 2]" 1
427 1 33 GLN HB2 1 34 HIS H . . 3.550 3.597 3.567 3.653 0.103 13 0 "[ . 1 . 2]" 1
428 1 33 GLN HB2 1 124 TYR QE . . 5.960 3.236 2.447 4.642 . 0 0 "[ . 1 . 2]" 1
429 1 33 GLN HB3 1 34 HIS H . . 3.550 2.374 2.288 2.430 . 0 0 "[ . 1 . 2]" 1
430 1 33 GLN HB3 1 124 TYR QE . . 5.960 4.273 3.318 4.974 . 0 0 "[ . 1 . 2]" 1
431 1 34 HIS H 1 34 HIS HA . . 2.710 2.787 2.754 2.836 0.126 18 0 "[ . 1 . 2]" 1
432 1 34 HIS H 1 34 HIS HB2 . . 2.680 2.214 2.178 2.280 . 0 0 "[ . 1 . 2]" 1
433 1 34 HIS H 1 34 HIS QB . . 2.390 2.124 2.105 2.164 . 0 0 "[ . 1 . 2]" 1
434 1 34 HIS H 1 34 HIS HB3 . . 2.680 2.736 2.692 2.786 0.106 8 0 "[ . 1 . 2]" 1
435 1 34 HIS H 1 35 GLU H . . 2.680 2.614 2.469 2.701 0.021 14 0 "[ . 1 . 2]" 1
436 1 34 HIS HA 1 35 GLU H . . 3.390 3.505 3.461 3.536 0.146 3 0 "[ . 1 . 2]" 1
437 1 34 HIS QB 1 35 GLU H . . 3.680 3.053 2.959 3.181 . 0 0 "[ . 1 . 2]" 1
438 1 34 HIS QB 1 111 ALA MB . . 5.080 2.759 2.497 2.963 . 0 0 "[ . 1 . 2]" 1
439 1 34 HIS QB 1 115 HIS QB . . 5.080 3.341 2.757 3.803 . 0 0 "[ . 1 . 2]" 1
440 1 34 HIS HB2 1 35 GLU H . . 3.860 3.970 3.904 4.018 0.158 12 0 "[ . 1 . 2]" 1
441 1 34 HIS HB3 1 35 GLU H . . 3.860 3.174 3.065 3.339 . 0 0 "[ . 1 . 2]" 1
442 1 35 GLU H 1 35 GLU HA . . 2.830 2.833 2.812 2.853 0.023 13 0 "[ . 1 . 2]" 1
443 1 35 GLU H 1 35 GLU HB2 . . 3.760 2.360 2.212 2.564 . 0 0 "[ . 1 . 2]" 1
444 1 35 GLU H 1 35 GLU QB . . 3.340 2.327 2.189 2.511 . 0 0 "[ . 1 . 2]" 1
445 1 35 GLU H 1 35 GLU HB3 . . 3.760 3.545 3.490 3.592 . 0 0 "[ . 1 . 2]" 1
446 1 35 GLU H 1 35 GLU HG2 . . 4.510 2.487 2.171 2.778 . 0 0 "[ . 1 . 2]" 1
447 1 35 GLU H 1 35 GLU QG . . 3.880 2.439 2.130 2.725 . 0 0 "[ . 1 . 2]" 1
448 1 35 GLU H 1 35 GLU HG3 . . 4.510 3.544 2.988 3.937 . 0 0 "[ . 1 . 2]" 1
449 1 35 GLU H 1 36 SER H . . 2.680 2.703 2.610 2.776 0.096 1 0 "[ . 1 . 2]" 1
450 1 35 GLU H 1 111 ALA MB . . 6.530 5.351 5.014 5.463 . 0 0 "[ . 1 . 2]" 1
451 1 35 GLU HA 1 36 SER H . . 3.640 3.645 3.640 3.646 0.006 14 0 "[ . 1 . 2]" 1
452 1 35 GLU QB 1 58 GLN QB . . 5.080 3.188 2.184 3.767 . 0 0 "[ . 1 . 2]" 1
453 1 35 GLU QB 1 109 TRP HE1 . . 7.230 5.057 4.025 6.148 . 0 0 "[ . 1 . 2]" 1
454 1 35 GLU QG 1 37 ASN H . . 6.380 5.578 5.161 5.778 . 0 0 "[ . 1 . 2]" 1
455 1 35 GLU QG 1 109 TRP HE1 . . 5.830 3.973 2.588 5.163 . 0 0 "[ . 1 . 2]" 1
456 1 35 GLU HG2 1 109 TRP HE1 . . 6.380 4.955 3.760 5.996 . 0 0 "[ . 1 . 2]" 1
457 1 35 GLU HG3 1 109 TRP HE1 . . 6.380 4.217 2.637 5.633 . 0 0 "[ . 1 . 2]" 1
458 1 36 SER H 1 36 SER HA . . 2.710 2.740 2.598 2.859 0.149 18 0 "[ . 1 . 2]" 1
459 1 36 SER H 1 36 SER QB . . 3.530 2.998 2.767 3.250 . 0 0 "[ . 1 . 2]" 1
460 1 36 SER H 1 37 ASN H . . 2.490 2.433 2.067 2.587 0.097 13 0 "[ . 1 . 2]" 1
461 1 36 SER QB 1 37 ASN H . . 4.360 2.833 1.936 3.992 . 0 0 "[ . 1 . 2]" 1
462 1 36 SER QB 1 42 ALA MB . . 5.080 2.587 1.858 3.574 . 0 0 "[ . 1 . 2]" 1
463 1 37 ASN H 1 37 ASN HA . . 2.650 2.376 2.166 2.803 0.153 13 0 "[ . 1 . 2]" 1
464 1 37 ASN H 1 37 ASN HB2 . . 3.830 3.062 2.095 3.546 . 0 0 "[ . 1 . 2]" 1
465 1 37 ASN H 1 37 ASN QB . . 3.580 2.719 2.054 3.085 . 0 0 "[ . 1 . 2]" 1
466 1 37 ASN H 1 37 ASN HB3 . . 3.830 3.381 2.325 3.882 0.052 20 0 "[ . 1 . 2]" 1
467 1 37 ASN H 1 38 TYR H . . 5.410 4.511 4.318 4.673 . 0 0 "[ . 1 . 2]" 1
468 1 38 TYR H 1 38 TYR QE . . 5.520 4.943 4.350 5.381 . 0 0 "[ . 1 . 2]" 1
469 1 38 TYR HA 1 56 ILE MD . . 6.530 4.940 4.448 5.494 . 0 0 "[ . 1 . 2]" 1
470 1 38 TYR QB 1 39 ASN H . . 3.810 2.087 1.686 3.387 . 0 0 "[ . 1 . 2]" 1
471 1 38 TYR QB 1 56 ILE MD . . 6.930 4.938 4.565 5.226 . 0 0 "[ . 1 . 2]" 1
472 1 38 TYR QE 1 39 ASN H . . 7.630 5.923 3.775 6.455 . 0 0 "[ . 1 . 2]" 1
473 1 39 ASN H 1 39 ASN HB2 . . 3.640 2.919 2.510 3.527 . 0 0 "[ . 1 . 2]" 1
474 1 39 ASN H 1 39 ASN QB . . 3.440 2.676 2.423 3.205 . 0 0 "[ . 1 . 2]" 1
475 1 39 ASN H 1 39 ASN HB3 . . 3.640 3.459 2.529 3.782 0.142 9 0 "[ . 1 . 2]" 1
476 1 39 ASN HA 1 40 THR H . . 2.400 2.353 2.270 2.500 0.100 13 0 "[ . 1 . 2]" 1
477 1 39 ASN QB 1 40 THR H . . 3.650 3.042 2.537 3.541 . 0 0 "[ . 1 . 2]" 1
478 1 39 ASN HB2 1 40 THR H . . 3.860 3.789 3.013 3.982 0.122 12 0 "[ . 1 . 2]" 1
479 1 39 ASN HB3 1 40 THR H . . 3.860 3.322 2.570 4.002 0.142 18 0 "[ . 1 . 2]" 1
480 1 39 ASN QD 1 41 ARG QB . . 5.500 3.848 1.969 4.505 . 0 0 "[ . 1 . 2]" 1
481 1 39 ASN HD21 1 41 ARG HB2 . . 6.680 4.466 3.152 5.313 . 0 0 "[ . 1 . 2]" 1
482 1 39 ASN HD21 1 41 ARG HB3 . . 6.680 5.255 4.188 6.175 . 0 0 "[ . 1 . 2]" 1
483 1 39 ASN HD22 1 41 ARG HB2 . . 6.680 5.346 1.991 6.458 . 0 0 "[ . 1 . 2]" 1
484 1 39 ASN HD22 1 41 ARG HB3 . . 6.680 5.966 3.415 6.682 0.002 9 0 "[ . 1 . 2]" 1
485 1 40 THR H 1 40 THR HA . . 2.940 2.913 2.845 2.948 0.008 13 0 "[ . 1 . 2]" 1
486 1 40 THR H 1 40 THR HB . . 3.920 3.526 2.911 3.762 . 0 0 "[ . 1 . 2]" 1
487 1 40 THR H 1 40 THR MG . . 3.430 2.156 1.889 2.500 . 0 0 "[ . 1 . 2]" 1
488 1 40 THR H 1 41 ARG H . . 3.580 3.276 2.523 3.671 0.091 1 0 "[ . 1 . 2]" 1
489 1 40 THR HA 1 41 ARG H . . 3.140 2.694 2.483 3.127 . 0 0 "[ . 1 . 2]" 1
490 1 40 THR MG 1 41 ARG H . . 5.750 4.266 3.797 4.392 . 0 0 "[ . 1 . 2]" 1
491 1 40 THR MG 1 56 ILE MD . . 5.500 2.315 1.675 3.601 . 0 0 "[ . 1 . 2]" 1
492 1 41 ARG H 1 41 ARG HB2 . . 3.170 2.684 2.310 2.876 . 0 0 "[ . 1 . 2]" 1
493 1 41 ARG H 1 41 ARG QB . . 2.670 2.353 2.175 2.513 . 0 0 "[ . 1 . 2]" 1
494 1 41 ARG H 1 41 ARG HB3 . . 3.170 2.640 2.258 2.936 . 0 0 "[ . 1 . 2]" 1
495 1 41 ARG H 1 42 ALA H . . 3.170 2.241 1.872 2.683 . 0 0 "[ . 1 . 2]" 1
496 1 41 ARG HA 1 85 LEU HA . . 6.190 5.699 3.841 6.246 0.056 19 0 "[ . 1 . 2]" 1
497 1 41 ARG QB 1 42 ALA H . . 4.120 3.329 2.508 3.725 . 0 0 "[ . 1 . 2]" 1
498 1 42 ALA H 1 42 ALA HA . . 2.620 2.721 2.669 2.771 0.151 1 0 "[ . 1 . 2]" 1
499 1 42 ALA H 1 42 ALA MB . . 3.430 2.085 1.936 2.183 . 0 0 "[ . 1 . 2]" 1
500 1 42 ALA H 1 43 THR H . . 5.500 4.325 4.222 4.519 . 0 0 "[ . 1 . 2]" 1
501 1 42 ALA MB 1 55 GLY H . . 4.450 2.931 2.665 3.435 . 0 0 "[ . 1 . 2]" 1
502 1 42 ALA MB 1 58 GLN HE21 . . 5.500 3.343 2.243 4.449 . 0 0 "[ . 1 . 2]" 1
503 1 42 ALA MB 1 58 GLN QE . . 5.150 2.881 2.181 3.737 . 0 0 "[ . 1 . 2]" 1
504 1 42 ALA MB 1 58 GLN HE22 . . 5.500 3.231 2.592 4.017 . 0 0 "[ . 1 . 2]" 1
505 1 42 ALA O 1 55 GLY H . . 1.800 1.807 1.686 1.822 0.022 19 0 "[ . 1 . 2]" 1
506 1 42 ALA O 1 55 GLY N . . 2.800 2.666 2.479 2.783 . 0 0 "[ . 1 . 2]" 1
507 1 43 THR HA 1 54 TYR HA . . 2.960 2.272 2.012 2.976 0.016 20 0 "[ . 1 . 2]" 1
508 1 43 THR HA 1 55 GLY H . . 3.920 3.548 2.417 3.855 . 0 0 "[ . 1 . 2]" 1
509 1 43 THR HB 1 44 ASN H . . 3.730 3.448 3.020 3.731 0.001 12 0 "[ . 1 . 2]" 1
510 1 43 THR MG 1 44 ASN H . . 6.500 3.919 3.764 4.083 . 0 0 "[ . 1 . 2]" 1
511 1 43 THR MG 1 52 THR MG . . 6.500 4.412 4.042 4.480 . 0 0 "[ . 1 . 2]" 1
512 1 43 THR MG 1 55 GLY H . . 4.450 2.953 2.439 3.252 . 0 0 "[ . 1 . 2]" 1
513 1 43 THR MG 1 85 LEU QD . . 5.050 2.071 1.567 2.760 . 0 0 "[ . 1 . 2]" 1
514 1 44 ASN H 1 44 ASN HA . . 2.800 2.878 2.871 2.914 0.114 20 0 "[ . 1 . 2]" 1
515 1 44 ASN H 1 44 ASN HB2 . . 3.640 2.815 2.585 2.958 . 0 0 "[ . 1 . 2]" 1
516 1 44 ASN H 1 44 ASN QB . . 3.200 2.674 2.480 2.723 . 0 0 "[ . 1 . 2]" 1
517 1 44 ASN H 1 44 ASN HB3 . . 3.640 3.364 3.184 3.610 . 0 0 "[ . 1 . 2]" 1
518 1 44 ASN H 1 45 TYR H . . 3.700 3.672 3.519 3.781 0.081 7 0 "[ . 1 . 2]" 1
519 1 44 ASN H 1 52 THR MG . . 4.450 3.065 2.904 3.379 . 0 0 "[ . 1 . 2]" 1
520 1 44 ASN H 1 53 ASP H . . 3.670 3.185 2.749 3.717 0.047 15 0 "[ . 1 . 2]" 1
521 1 44 ASN H 1 53 ASP QB . . 4.450 3.589 3.167 3.871 . 0 0 "[ . 1 . 2]" 1
522 1 44 ASN H 1 54 TYR HA . . 3.610 3.230 2.936 3.618 0.008 20 0 "[ . 1 . 2]" 1
523 1 44 ASN HA 1 45 TYR H . . 2.400 2.312 2.278 2.357 . 0 0 "[ . 1 . 2]" 1
524 1 44 ASN QB 1 53 ASP QB . . 5.080 2.209 1.867 2.793 . 0 0 "[ . 1 . 2]" 1
525 1 44 ASN O 1 53 ASP H . . 1.800 1.593 1.491 1.807 0.007 20 0 "[ . 1 . 2]" 1
526 1 44 ASN O 1 53 ASP N . . 2.800 2.512 2.445 2.662 . 0 0 "[ . 1 . 2]" 1
527 1 45 TYR H 1 45 TYR HA . . 2.770 2.901 2.895 2.913 0.143 20 0 "[ . 1 . 2]" 1
528 1 45 TYR H 1 45 TYR HB2 . . 3.500 3.215 2.027 3.510 0.010 13 0 "[ . 1 . 2]" 1
529 1 45 TYR H 1 45 TYR HB3 . . 3.500 2.573 2.144 3.454 . 0 0 "[ . 1 . 2]" 1
530 1 45 TYR HA 1 46 ASN H . . 2.430 2.380 2.316 2.440 0.010 13 0 "[ . 1 . 2]" 1
531 1 45 TYR HA 1 52 THR HA . . 2.960 2.171 1.980 2.665 . 0 0 "[ . 1 . 2]" 1
532 1 45 TYR HA 1 52 THR MG . . 4.360 2.015 1.894 2.496 . 0 0 "[ . 1 . 2]" 1
533 1 45 TYR HA 1 53 ASP H . . 3.420 3.072 2.548 3.435 0.015 18 0 "[ . 1 . 2]" 1
534 1 45 TYR QD 1 46 ASN H . . 7.640 3.239 2.445 3.912 . 0 0 "[ . 1 . 2]" 1
535 1 45 TYR QE 1 46 ASN H . . 7.630 5.368 3.896 6.025 . 0 0 "[ . 1 . 2]" 1
536 1 46 ASN H 1 46 ASN HA . . 2.740 2.837 2.828 2.847 0.107 15 0 "[ . 1 . 2]" 1
537 1 46 ASN H 1 46 ASN QB . . 3.280 2.851 2.829 2.874 . 0 0 "[ . 1 . 2]" 1
538 1 46 ASN H 1 47 ARG H . . 3.670 3.700 3.636 3.729 0.059 10 0 "[ . 1 . 2]" 1
539 1 46 ASN H 1 51 SER H . . 4.380 3.746 3.398 3.917 . 0 0 "[ . 1 . 2]" 1
540 1 46 ASN H 1 52 THR HA . . 3.200 2.894 2.395 3.207 0.007 2 0 "[ . 1 . 2]" 1
541 1 46 ASN H 1 52 THR MG . . 5.510 3.752 3.452 4.195 . 0 0 "[ . 1 . 2]" 1
542 1 46 ASN QB 1 47 ARG H . . 4.020 3.640 3.621 3.682 . 0 0 "[ . 1 . 2]" 1
543 1 46 ASN QB 1 51 SER H . . 4.420 3.292 2.895 3.527 . 0 0 "[ . 1 . 2]" 1
544 1 46 ASN O 1 51 SER H . . 1.800 1.772 1.606 1.812 0.012 17 0 "[ . 1 . 2]" 1
545 1 46 ASN O 1 51 SER N . . 2.800 2.737 2.593 2.802 0.002 6 0 "[ . 1 . 2]" 1
546 1 47 ARG H 1 47 ARG HB2 . . 2.770 2.210 2.182 2.271 . 0 0 "[ . 1 . 2]" 1
547 1 47 ARG H 1 47 ARG QB . . 2.440 2.139 2.118 2.182 . 0 0 "[ . 1 . 2]" 1
548 1 47 ARG H 1 47 ARG HB3 . . 2.770 2.854 2.822 2.893 0.123 14 0 "[ . 1 . 2]" 1
549 1 47 ARG H 1 48 GLY H . . 2.490 2.433 2.351 2.496 0.006 16 0 "[ . 1 . 2]" 1
550 1 47 ARG H 1 48 GLY QA . . 5.880 4.270 4.200 4.324 . 0 0 "[ . 1 . 2]" 1
551 1 47 ARG QB 1 48 GLY H . . 3.200 2.839 2.760 2.890 . 0 0 "[ . 1 . 2]" 1
552 1 47 ARG HB2 1 48 GLY H . . 3.610 3.688 3.660 3.705 0.095 5 0 "[ . 1 . 2]" 1
553 1 47 ARG HB3 1 48 GLY H . . 3.610 2.953 2.852 3.017 . 0 0 "[ . 1 . 2]" 1
554 1 48 GLY H 1 48 GLY HA2 . . 2.820 2.656 2.638 2.704 . 0 0 "[ . 1 . 2]" 1
555 1 48 GLY H 1 48 GLY QA . . 2.300 2.154 2.152 2.156 . 0 0 "[ . 1 . 2]" 1
556 1 48 GLY H 1 48 GLY HA3 . . 2.820 2.278 2.259 2.287 . 0 0 "[ . 1 . 2]" 1
557 1 48 GLY H 1 49 ASP H . . 3.020 3.029 2.985 3.085 0.065 5 0 "[ . 1 . 2]" 1
558 1 48 GLY H 1 49 ASP QB . . 6.190 4.961 4.877 5.039 . 0 0 "[ . 1 . 2]" 1
559 1 48 GLY QA 1 49 ASP H . . 3.090 2.802 2.727 2.847 . 0 0 "[ . 1 . 2]" 1
560 1 49 ASP H 1 49 ASP HB2 . . 3.210 2.698 2.414 3.048 . 0 0 "[ . 1 . 2]" 1
561 1 49 ASP H 1 49 ASP HB3 . . 3.210 3.046 2.588 3.214 0.004 9 0 "[ . 1 . 2]" 1
562 1 49 ASP H 1 50 GLN H . . 3.210 2.439 2.282 2.566 . 0 0 "[ . 1 . 2]" 1
563 1 50 GLN H 1 50 GLN HA . . 2.620 2.216 2.210 2.226 . 0 0 "[ . 1 . 2]" 1
564 1 50 GLN H 1 50 GLN HB2 . . 3.610 2.885 2.753 3.860 0.250 8 0 "[ . 1 . 2]" 1
565 1 50 GLN H 1 50 GLN QB . . 3.200 2.692 2.667 2.759 . 0 0 "[ . 1 . 2]" 1
566 1 50 GLN H 1 50 GLN HB3 . . 3.610 3.497 2.817 3.663 0.053 13 0 "[ . 1 . 2]" 1
567 1 50 GLN H 1 51 SER H . . 3.210 3.147 3.018 3.231 0.021 19 0 "[ . 1 . 2]" 1
568 1 50 GLN H 1 51 SER QB . . 6.160 4.996 4.860 5.163 . 0 0 "[ . 1 . 2]" 1
569 1 51 SER H 1 51 SER QB . . 3.440 2.993 2.633 3.139 . 0 0 "[ . 1 . 2]" 1
570 1 51 SER HA 1 52 THR H . . 2.400 2.320 2.216 2.416 0.016 12 0 "[ . 1 . 2]" 1
571 1 51 SER HA 1 62 ARG H . . 4.720 3.738 3.204 4.251 . 0 0 "[ . 1 . 2]" 1
572 1 51 SER HA 1 62 ARG HA . . 3.120 3.164 3.137 3.195 0.075 13 0 "[ . 1 . 2]" 1
573 1 51 SER QB 1 61 SER H . . 5.500 4.394 3.993 4.758 . 0 0 "[ . 1 . 2]" 1
574 1 51 SER QB 1 62 ARG H . . 5.080 3.608 3.228 3.978 . 0 0 "[ . 1 . 2]" 1
575 1 52 THR H 1 52 THR HB . . 2.650 2.588 2.255 2.756 0.106 12 0 "[ . 1 . 2]" 1
576 1 52 THR H 1 61 SER H . . 3.510 2.489 2.000 2.989 . 0 0 "[ . 1 . 2]" 1
577 1 52 THR H 1 61 SER QB . . 4.360 2.650 1.906 3.063 . 0 0 "[ . 1 . 2]" 1
578 1 52 THR H 1 62 ARG H . . 5.440 3.223 2.943 3.635 . 0 0 "[ . 1 . 2]" 1
579 1 52 THR HA 1 53 ASP H . . 2.400 2.256 2.162 2.469 0.069 20 0 "[ . 1 . 2]" 1
580 1 52 THR HB 1 53 ASP H . . 4.360 4.228 3.866 4.425 0.065 18 0 "[ . 1 . 2]" 1
581 1 52 THR MG 1 53 ASP H . . 3.430 2.366 1.842 2.781 . 0 0 "[ . 1 . 2]" 1
582 1 52 THR MG 1 53 ASP HA . . 5.440 3.700 3.138 4.059 . 0 0 "[ . 1 . 2]" 1
583 1 52 THR MG 1 54 TYR QE . . 4.820 2.562 1.928 3.777 . 0 0 "[ . 1 . 2]" 1
584 1 52 THR O 1 61 SER H . . 1.800 1.531 1.433 1.735 . 0 0 "[ . 1 . 2]" 1
585 1 52 THR O 1 61 SER N . . 2.800 2.436 2.383 2.502 . 0 0 "[ . 1 . 2]" 1
586 1 53 ASP H 1 53 ASP HB2 . . 3.830 2.595 2.172 3.009 . 0 0 "[ . 1 . 2]" 1
587 1 53 ASP H 1 53 ASP QB . . 3.430 2.533 2.148 2.914 . 0 0 "[ . 1 . 2]" 1
588 1 53 ASP H 1 53 ASP HB3 . . 3.830 3.618 3.140 3.892 0.062 20 0 "[ . 1 . 2]" 1
589 1 53 ASP HA 1 54 TYR H . . 2.400 2.280 2.252 2.329 . 0 0 "[ . 1 . 2]" 1
590 1 53 ASP HA 1 58 GLN QE . . 6.370 4.773 3.297 5.726 . 0 0 "[ . 1 . 2]" 1
591 1 53 ASP HA 1 59 ILE H . . 5.500 4.519 4.247 4.756 . 0 0 "[ . 1 . 2]" 1
592 1 53 ASP HA 1 60 ASN H . . 4.320 4.339 4.192 4.425 0.105 10 0 "[ . 1 . 2]" 1
593 1 53 ASP HA 1 60 ASN HA . . 2.900 2.104 1.923 2.311 . 0 0 "[ . 1 . 2]" 1
594 1 53 ASP QB 1 54 TYR H . . 4.320 3.631 3.248 3.880 . 0 0 "[ . 1 . 2]" 1
595 1 53 ASP QB 1 58 GLN QB . . 5.980 4.319 3.803 4.907 . 0 0 "[ . 1 . 2]" 1
596 1 54 TYR H 1 54 TYR HA . . 2.860 2.912 2.887 2.943 0.083 12 0 "[ . 1 . 2]" 1
597 1 54 TYR H 1 54 TYR QB . . 3.430 2.717 2.163 3.213 . 0 0 "[ . 1 . 2]" 1
598 1 54 TYR H 1 54 TYR QE . . 7.480 4.614 3.690 5.526 . 0 0 "[ . 1 . 2]" 1
599 1 54 TYR H 1 59 ILE H . . 3.830 3.219 2.663 3.577 . 0 0 "[ . 1 . 2]" 1
600 1 54 TYR H 1 59 ILE HA . . 5.500 4.729 4.247 4.890 . 0 0 "[ . 1 . 2]" 1
601 1 54 TYR H 1 59 ILE O . . 1.800 1.799 1.439 1.839 0.039 19 0 "[ . 1 . 2]" 1
602 1 54 TYR H 1 60 ASN HA . . 3.700 3.535 3.348 3.707 0.007 4 0 "[ . 1 . 2]" 1
603 1 54 TYR HA 1 55 GLY H . . 2.400 2.448 2.187 2.603 0.203 13 0 "[ . 1 . 2]" 1
604 1 54 TYR QB 1 55 GLY H . . 4.480 2.639 2.228 3.526 . 0 0 "[ . 1 . 2]" 1
605 1 54 TYR QB 1 59 ILE H . . 5.500 4.576 2.223 4.954 . 0 0 "[ . 1 . 2]" 1
606 1 54 TYR QB 1 84 LEU QB . . 5.280 4.035 3.312 4.472 . 0 0 "[ . 1 . 2]" 1
607 1 54 TYR HB2 1 55 GLY H . . 4.480 3.241 2.254 4.461 . 0 0 "[ . 1 . 2]" 1
608 1 54 TYR HB3 1 55 GLY H . . 4.480 3.397 2.760 4.023 . 0 0 "[ . 1 . 2]" 1
609 1 54 TYR QD 1 85 LEU QD . . 6.680 2.665 1.923 3.962 . 0 0 "[ . 1 . 2]" 1
610 1 54 TYR N 1 59 ILE O . . 2.800 2.689 2.397 2.765 . 0 0 "[ . 1 . 2]" 1
611 1 54 TYR O 1 59 ILE H . . 1.800 1.785 1.706 1.861 0.061 20 0 "[ . 1 . 2]" 1
612 1 54 TYR O 1 59 ILE N . . 2.800 2.669 2.535 2.776 . 0 0 "[ . 1 . 2]" 1
613 1 55 GLY H 1 55 GLY HA2 . . 2.800 2.414 2.332 2.793 . 0 0 "[ . 1 . 2]" 1
614 1 55 GLY H 1 55 GLY QA . . 2.460 2.289 2.158 2.369 . 0 0 "[ . 1 . 2]" 1
615 1 55 GLY H 1 55 GLY HA3 . . 2.800 2.915 2.246 2.961 0.161 9 0 "[ . 1 . 2]" 1
616 1 55 GLY H 1 58 GLN QE . . 6.150 4.804 4.049 5.305 . 0 0 "[ . 1 . 2]" 1
617 1 55 GLY QA 1 56 ILE H . . 2.960 2.268 2.214 2.699 . 0 0 "[ . 1 . 2]" 1
618 1 55 GLY O 1 58 GLN H . . 1.800 1.648 1.510 1.823 0.023 20 0 "[ . 1 . 2]" 1
619 1 55 GLY O 1 58 GLN N . . 2.800 2.544 2.467 2.744 . 0 0 "[ . 1 . 2]" 1
620 1 56 ILE H 1 56 ILE HA . . 2.850 2.729 2.594 2.759 . 0 0 "[ . 1 . 2]" 1
621 1 56 ILE H 1 56 ILE MD . . 4.980 4.063 3.751 4.255 . 0 0 "[ . 1 . 2]" 1
622 1 56 ILE H 1 57 PHE H . . 3.670 2.810 2.725 3.119 . 0 0 "[ . 1 . 2]" 1
623 1 56 ILE HA 1 57 PHE H . . 3.480 3.571 3.538 3.638 0.158 4 0 "[ . 1 . 2]" 1
624 1 56 ILE HB 1 57 PHE H . . 4.970 3.829 2.591 4.205 . 0 0 "[ . 1 . 2]" 1
625 1 56 ILE MD 1 57 PHE H . . 6.530 4.896 4.353 5.104 . 0 0 "[ . 1 . 2]" 1
626 1 56 ILE MD 1 57 PHE QD . . 7.160 4.895 2.883 5.464 . 0 0 "[ . 1 . 2]" 1
627 1 56 ILE MD 1 57 PHE QE . . 7.160 4.808 2.996 5.296 . 0 0 "[ . 1 . 2]" 1
628 1 56 ILE MD 1 57 PHE HZ . . 7.160 5.738 5.025 6.029 . 0 0 "[ . 1 . 2]" 1
629 1 56 ILE MD 1 89 ILE MD . . 6.500 4.075 3.741 4.401 . 0 0 "[ . 1 . 2]" 1
630 1 56 ILE MD 1 89 ILE MG . . 5.500 3.356 2.997 3.640 . 0 0 "[ . 1 . 2]" 1
631 1 56 ILE MG 1 57 PHE H . . 6.040 2.203 1.911 3.166 . 0 0 "[ . 1 . 2]" 1
632 1 56 ILE MG 1 92 ALA MB . . 6.530 2.730 1.645 4.496 . 0 0 "[ . 1 . 2]" 1
633 1 57 PHE H 1 57 PHE HA . . 2.860 2.907 2.894 2.933 0.073 18 0 "[ . 1 . 2]" 1
634 1 57 PHE H 1 57 PHE HB2 . . 3.360 2.198 2.058 2.601 . 0 0 "[ . 1 . 2]" 1
635 1 57 PHE H 1 57 PHE QB . . 2.910 2.172 2.041 2.527 . 0 0 "[ . 1 . 2]" 1
636 1 57 PHE H 1 57 PHE HB3 . . 3.360 3.449 3.374 3.532 0.172 18 0 "[ . 1 . 2]" 1
637 1 57 PHE H 1 58 GLN H . . 2.990 2.687 2.145 2.850 . 0 0 "[ . 1 . 2]" 1
638 1 57 PHE HA 1 58 GLN H . . 3.640 3.091 2.971 3.218 . 0 0 "[ . 1 . 2]" 1
639 1 57 PHE QB 1 58 GLN H . . 4.240 3.668 3.511 3.782 . 0 0 "[ . 1 . 2]" 1
640 1 57 PHE QB 1 109 TRP HE1 . . 4.240 3.377 3.078 3.545 . 0 0 "[ . 1 . 2]" 1
641 1 57 PHE QD 1 96 ALA MB . . 4.950 3.006 2.178 3.533 . 0 0 "[ . 1 . 2]" 1
642 1 58 GLN H 1 58 GLN HA . . 2.690 2.201 2.178 2.220 . 0 0 "[ . 1 . 2]" 1
643 1 58 GLN H 1 58 GLN HB2 . . 3.660 2.828 2.745 2.960 . 0 0 "[ . 1 . 2]" 1
644 1 58 GLN H 1 58 GLN QB . . 3.140 2.735 2.669 2.834 . 0 0 "[ . 1 . 2]" 1
645 1 58 GLN H 1 58 GLN HB3 . . 3.660 3.641 3.403 3.734 0.074 3 0 "[ . 1 . 2]" 1
646 1 58 GLN HA 1 59 ILE H . . 3.550 2.440 2.298 2.670 . 0 0 "[ . 1 . 2]" 1
647 1 58 GLN QB 1 59 ILE H . . 4.460 4.085 4.051 4.115 . 0 0 "[ . 1 . 2]" 1
648 1 59 ILE H 1 59 ILE HB . . 3.140 2.290 2.160 2.489 . 0 0 "[ . 1 . 2]" 1
649 1 59 ILE H 1 59 ILE MD . . 4.610 3.756 3.572 3.885 . 0 0 "[ . 1 . 2]" 1
650 1 59 ILE H 1 59 ILE QG . . 4.610 2.920 2.503 3.210 . 0 0 "[ . 1 . 2]" 1
651 1 59 ILE HA 1 60 ASN H . . 2.400 2.269 2.216 2.348 . 0 0 "[ . 1 . 2]" 1
652 1 59 ILE HA 1 109 TRP HE1 . . 5.500 4.533 3.819 5.471 . 0 0 "[ . 1 . 2]" 1
653 1 59 ILE HB 1 60 ASN H . . 5.500 4.227 4.003 4.396 . 0 0 "[ . 1 . 2]" 1
654 1 59 ILE HB 1 84 LEU QD . . 5.500 2.999 2.085 3.687 . 0 0 "[ . 1 . 2]" 1
655 1 59 ILE MD 1 84 LEU QD . . 5.500 2.453 1.881 2.907 . 0 0 "[ . 1 . 2]" 1
656 1 59 ILE MD 1 92 ALA MB . . 6.250 3.868 3.459 4.140 . 0 0 "[ . 1 . 2]" 1
657 1 59 ILE MD 1 96 ALA MB . . 5.500 3.541 3.368 3.645 . 0 0 "[ . 1 . 2]" 1
658 1 59 ILE MD 1 99 VAL MG1 . . 6.250 3.930 3.582 4.153 . 0 0 "[ . 1 . 2]" 1
659 1 59 ILE MD 1 99 VAL QG . . 5.500 2.784 2.432 3.031 . 0 0 "[ . 1 . 2]" 1
660 1 59 ILE MD 1 99 VAL MG2 . . 6.250 2.853 2.471 3.165 . 0 0 "[ . 1 . 2]" 1
661 1 59 ILE QG 1 60 ASN H . . 5.540 3.776 3.557 4.058 . 0 0 "[ . 1 . 2]" 1
662 1 59 ILE QG 1 109 TRP HE1 . . 4.450 3.938 3.495 4.076 . 0 0 "[ . 1 . 2]" 1
663 1 59 ILE MG 1 60 ASN H . . 4.020 2.313 1.925 2.640 . 0 0 "[ . 1 . 2]" 1
664 1 59 ILE MG 1 99 VAL QG . . 7.970 3.182 2.546 3.801 . 0 0 "[ . 1 . 2]" 1
665 1 60 ASN H 1 60 ASN HA . . 2.900 2.853 2.824 2.875 . 0 0 "[ . 1 . 2]" 1
666 1 60 ASN H 1 60 ASN HB2 . . 3.300 2.484 2.051 3.537 0.237 8 0 "[ . 1 . 2]" 1
667 1 60 ASN H 1 60 ASN HB3 . . 3.300 3.177 2.686 3.541 0.241 9 0 "[ . 1 . 2]" 1
668 1 60 ASN HA 1 61 SER H . . 2.400 2.302 2.262 2.341 . 0 0 "[ . 1 . 2]" 1
669 1 60 ASN QB 1 61 SER H . . 4.210 3.290 3.012 3.606 . 0 0 "[ . 1 . 2]" 1
670 1 60 ASN QB 1 63 TYR H . . 4.360 3.009 2.285 3.708 . 0 0 "[ . 1 . 2]" 1
671 1 61 SER H 1 61 SER QB . . 3.720 2.312 2.112 2.770 . 0 0 "[ . 1 . 2]" 1
672 1 61 SER QB 1 62 ARG H . . 4.050 3.628 3.502 3.772 . 0 0 "[ . 1 . 2]" 1
673 1 62 ARG H 1 62 ARG QB . . 3.430 2.396 2.132 2.823 . 0 0 "[ . 1 . 2]" 1
674 1 62 ARG H 1 62 ARG QG . . 4.210 3.039 1.850 3.942 . 0 0 "[ . 1 . 2]" 1
675 1 62 ARG H 1 63 TYR H . . 3.860 2.340 2.216 2.632 . 0 0 "[ . 1 . 2]" 1
676 1 62 ARG HA 1 63 TYR H . . 3.610 3.424 3.185 3.601 . 0 0 "[ . 1 . 2]" 1
677 1 62 ARG HA 1 73 ALA H . . 5.500 5.485 5.255 5.566 0.066 6 0 "[ . 1 . 2]" 1
678 1 62 ARG HA 1 74 VAL H . . 4.450 4.450 4.208 4.550 0.100 13 0 "[ . 1 . 2]" 1
679 1 62 ARG QG 1 63 TYR H . . 6.380 3.342 2.013 4.649 . 0 0 "[ . 1 . 2]" 1
680 1 63 TYR H 1 63 TYR HB2 . . 3.830 2.417 2.092 2.809 . 0 0 "[ . 1 . 2]" 1
681 1 63 TYR H 1 63 TYR QB . . 3.510 2.333 2.060 2.633 . 0 0 "[ . 1 . 2]" 1
682 1 63 TYR H 1 63 TYR HB3 . . 3.830 3.163 2.800 3.415 . 0 0 "[ . 1 . 2]" 1
683 1 63 TYR H 1 64 TRP H . . 2.490 2.016 1.775 2.454 . 0 0 "[ . 1 . 2]" 1
684 1 63 TYR HA 1 74 VAL H . . 4.450 3.061 2.338 3.794 . 0 0 "[ . 1 . 2]" 1
685 1 63 TYR HA 1 76 ALA H . . 4.450 4.276 3.859 4.498 0.048 8 0 "[ . 1 . 2]" 1
686 1 63 TYR QB 1 64 TRP H . . 3.180 2.463 2.104 2.964 . 0 0 "[ . 1 . 2]" 1
687 1 63 TYR HB2 1 64 TRP H . . 3.360 3.002 2.683 3.330 . 0 0 "[ . 1 . 2]" 1
688 1 63 TYR HB3 1 64 TRP H . . 3.360 2.671 2.198 3.324 . 0 0 "[ . 1 . 2]" 1
689 1 64 TRP H 1 64 TRP QB . . 3.460 2.484 2.358 2.713 . 0 0 "[ . 1 . 2]" 1
690 1 64 TRP H 1 65 CYS H . . 4.860 4.498 3.877 4.583 . 0 0 "[ . 1 . 2]" 1
691 1 64 TRP HA 1 65 CYS H . . 3.640 2.475 2.247 3.314 . 0 0 "[ . 1 . 2]" 1
692 1 64 TRP HA 1 76 ALA H . . 3.640 2.222 1.929 3.154 . 0 0 "[ . 1 . 2]" 1
693 1 64 TRP HA 1 77 CYS H . . 3.640 2.533 2.238 2.775 . 0 0 "[ . 1 . 2]" 1
694 1 64 TRP QB 1 65 CYS H . . 4.210 2.555 1.769 3.095 . 0 0 "[ . 1 . 2]" 1
695 1 64 TRP QB 1 77 CYS H . . 4.520 3.628 3.208 3.828 . 0 0 "[ . 1 . 2]" 1
696 1 64 TRP HD1 1 99 VAL QG . . 4.450 2.535 1.985 3.124 . 0 0 "[ . 1 . 2]" 1
697 1 64 TRP HE1 1 99 VAL HA . . 4.450 3.583 2.565 4.469 0.019 18 0 "[ . 1 . 2]" 1
698 1 64 TRP HE1 1 99 VAL MG1 . . 4.450 2.588 2.025 3.335 . 0 0 "[ . 1 . 2]" 1
699 1 64 TRP HE1 1 99 VAL QG . . 4.000 2.388 1.851 2.817 . 0 0 "[ . 1 . 2]" 1
700 1 64 TRP HE1 1 99 VAL MG2 . . 4.450 2.986 2.142 3.546 . 0 0 "[ . 1 . 2]" 1
701 1 64 TRP HE1 1 102 ASP QB . . 5.260 4.469 3.695 4.740 . 0 0 "[ . 1 . 2]" 1
702 1 64 TRP HZ2 1 99 VAL QG . . 5.950 3.046 2.175 3.977 . 0 0 "[ . 1 . 2]" 1
703 1 65 CYS CB 1 81 CYS SG . . 3.100 3.158 2.996 3.255 0.155 15 0 "[ . 1 . 2]" 1
704 1 65 CYS H 1 65 CYS HA . . 2.590 2.216 2.192 2.631 0.041 13 0 "[ . 1 . 2]" 1
705 1 65 CYS H 1 65 CYS HB2 . . 3.730 3.776 3.438 3.847 0.117 10 0 "[ . 1 . 2]" 1
706 1 65 CYS H 1 65 CYS QB . . 3.240 2.879 2.128 2.955 . 0 0 "[ . 1 . 2]" 1
707 1 65 CYS H 1 65 CYS HB3 . . 3.730 2.990 2.148 3.077 . 0 0 "[ . 1 . 2]" 1
708 1 65 CYS H 1 66 ASN H . . 5.500 4.358 4.047 4.663 . 0 0 "[ . 1 . 2]" 1
709 1 65 CYS H 1 77 CYS QB . . 5.260 2.085 1.741 2.908 . 0 0 "[ . 1 . 2]" 1
710 1 65 CYS HA 1 66 ASN H . . 3.420 2.420 2.258 2.659 . 0 0 "[ . 1 . 2]" 1
711 1 65 CYS HA 1 77 CYS H . . 4.540 4.197 3.780 4.610 0.070 12 0 "[ . 1 . 2]" 1
712 1 65 CYS HA 1 78 GLY H . . 4.540 3.791 3.393 4.470 . 0 0 "[ . 1 . 2]" 1
713 1 65 CYS HA 1 79 ILE H . . 3.420 2.580 2.275 3.104 . 0 0 "[ . 1 . 2]" 1
714 1 65 CYS QB 1 79 ILE H . . 5.360 4.126 3.656 4.667 . 0 0 "[ . 1 . 2]" 1
715 1 65 CYS QB 1 79 ILE HB . . 6.080 5.340 5.020 5.505 . 0 0 "[ . 1 . 2]" 1
716 1 65 CYS SG 1 81 CYS CB . . 3.100 3.145 2.984 3.260 0.160 18 0 "[ . 1 . 2]" 1
717 1 65 CYS SG 1 81 CYS SG . . 2.100 1.947 1.848 2.086 . 0 0 "[ . 1 . 2]" 1
718 1 66 ASN H 1 66 ASN HB2 . . 3.540 3.053 2.555 3.685 0.145 3 0 "[ . 1 . 2]" 1
719 1 66 ASN H 1 66 ASN HB3 . . 3.540 3.124 2.259 3.648 0.108 16 0 "[ . 1 . 2]" 1
720 1 66 ASN H 1 67 ASP H . . 5.280 4.169 3.140 4.479 . 0 0 "[ . 1 . 2]" 1
721 1 66 ASN H 1 75 ASN QB . . 4.450 3.294 2.697 3.873 . 0 0 "[ . 1 . 2]" 1
722 1 66 ASN H 1 79 ILE H . . 4.540 3.378 2.973 3.619 . 0 0 "[ . 1 . 2]" 1
723 1 66 ASN H 1 79 ILE HA . . 5.100 5.039 4.657 5.239 0.139 13 0 "[ . 1 . 2]" 1
724 1 66 ASN H 1 79 ILE QG . . 5.110 4.282 3.528 4.517 . 0 0 "[ . 1 . 2]" 1
725 1 66 ASN H 1 80 ASN HA . . 3.920 3.261 2.731 3.796 . 0 0 "[ . 1 . 2]" 1
726 1 66 ASN HA 1 67 ASP H . . 3.550 2.912 2.597 3.573 0.023 4 0 "[ . 1 . 2]" 1
727 1 66 ASN HA 1 68 GLY H . . 4.950 4.650 2.951 5.028 0.078 20 0 "[ . 1 . 2]" 1
728 1 66 ASN HA 1 81 CYS H . . 5.280 4.776 3.834 5.291 0.011 4 0 "[ . 1 . 2]" 1
729 1 66 ASN QB 1 67 ASP H . . 3.470 2.179 1.876 2.526 . 0 0 "[ . 1 . 2]" 1
730 1 66 ASN QB 1 68 GLY H . . 4.670 3.579 3.193 3.943 . 0 0 "[ . 1 . 2]" 1
731 1 66 ASN QB 1 75 ASN QB . . 5.080 1.955 1.763 2.159 . 0 0 "[ . 1 . 2]" 1
732 1 66 ASN QB 1 75 ASN QD . . 4.260 2.300 1.884 3.308 . 0 0 "[ . 1 . 2]" 1
733 1 66 ASN QB 1 81 CYS H . . 5.500 4.512 3.475 4.950 . 0 0 "[ . 1 . 2]" 1
734 1 66 ASN HB2 1 67 ASP H . . 3.640 3.214 2.015 3.709 0.069 13 0 "[ . 1 . 2]" 1
735 1 66 ASN HB2 1 75 ASN HD21 . . 5.500 2.723 1.946 3.736 . 0 0 "[ . 1 . 2]" 1
736 1 66 ASN HB2 1 75 ASN HD22 . . 5.500 3.696 3.002 4.765 . 0 0 "[ . 1 . 2]" 1
737 1 66 ASN HB3 1 67 ASP H . . 3.640 2.510 1.886 3.639 . 0 0 "[ . 1 . 2]" 1
738 1 66 ASN HB3 1 75 ASN HD21 . . 5.500 3.251 2.089 4.702 . 0 0 "[ . 1 . 2]" 1
739 1 66 ASN HB3 1 75 ASN HD22 . . 5.500 4.114 2.976 5.522 0.022 13 0 "[ . 1 . 2]" 1
740 1 67 ASP H 1 67 ASP HA . . 2.860 2.840 2.249 2.917 0.057 7 0 "[ . 1 . 2]" 1
741 1 67 ASP H 1 67 ASP HB2 . . 3.730 3.284 2.799 3.745 0.015 5 0 "[ . 1 . 2]" 1
742 1 67 ASP H 1 67 ASP QB . . 3.320 2.655 2.312 3.173 . 0 0 "[ . 1 . 2]" 1
743 1 67 ASP H 1 67 ASP HB3 . . 3.730 2.852 2.362 3.821 0.091 16 0 "[ . 1 . 2]" 1
744 1 67 ASP H 1 68 GLY H . . 3.110 2.063 1.897 2.495 . 0 0 "[ . 1 . 2]" 1
745 1 67 ASP H 1 68 GLY HA2 . . 4.790 3.954 3.762 5.020 0.230 16 0 "[ . 1 . 2]" 1
746 1 67 ASP H 1 68 GLY QA . . 4.610 3.646 3.444 4.279 . 0 0 "[ . 1 . 2]" 1
747 1 67 ASP H 1 68 GLY HA3 . . 4.790 4.298 3.925 4.655 . 0 0 "[ . 1 . 2]" 1
748 1 67 ASP H 1 69 LYS H . . 4.790 3.929 3.125 4.275 . 0 0 "[ . 1 . 2]" 1
749 1 67 ASP H 1 73 ALA MB . . 5.500 4.451 4.135 4.562 . 0 0 "[ . 1 . 2]" 1
750 1 67 ASP QB 1 69 LYS H . . 4.610 2.483 1.930 4.423 . 0 0 "[ . 1 . 2]" 1
751 1 67 ASP QB 1 81 CYS H . . 5.500 4.715 3.494 4.961 . 0 0 "[ . 1 . 2]" 1
752 1 67 ASP HB2 1 68 GLY H . . 5.410 3.725 3.384 4.053 . 0 0 "[ . 1 . 2]" 1
753 1 67 ASP HB3 1 68 GLY H . . 5.410 2.511 2.103 3.888 . 0 0 "[ . 1 . 2]" 1
754 1 68 GLY H 1 68 GLY QA . . 2.550 2.271 2.171 2.349 . 0 0 "[ . 1 . 2]" 1
755 1 68 GLY H 1 69 LYS HA . . 5.500 4.797 4.436 5.228 . 0 0 "[ . 1 . 2]" 1
756 1 68 GLY QA 1 69 LYS H . . 3.080 2.989 2.987 2.990 . 0 0 "[ . 1 . 2]" 1
757 1 68 GLY HA2 1 69 LYS H . . 3.300 3.363 3.325 3.398 0.098 13 0 "[ . 1 . 2]" 1
758 1 68 GLY HA3 1 69 LYS H . . 3.300 3.347 3.311 3.385 0.085 10 0 "[ . 1 . 2]" 1
759 1 69 LYS H 1 69 LYS QB . . 3.740 2.397 2.127 2.727 . 0 0 "[ . 1 . 2]" 1
760 1 69 LYS H 1 69 LYS QG . . 4.580 3.674 2.912 4.065 . 0 0 "[ . 1 . 2]" 1
761 1 69 LYS H 1 70 THR H . . 2.400 2.078 1.872 2.427 0.027 16 0 "[ . 1 . 2]" 1
762 1 69 LYS HA 1 70 THR H . . 3.420 3.401 2.885 3.637 0.217 16 0 "[ . 1 . 2]" 1
763 1 69 LYS QB 1 70 THR H . . 4.760 3.255 2.344 3.930 . 0 0 "[ . 1 . 2]" 1
764 1 69 LYS QG 1 70 THR H . . 5.450 4.505 3.644 4.806 . 0 0 "[ . 1 . 2]" 1
765 1 70 THR H 1 70 THR HB . . 3.240 2.726 2.292 3.246 0.006 14 0 "[ . 1 . 2]" 1
766 1 70 THR H 1 70 THR MG . . 4.420 3.169 1.959 3.765 . 0 0 "[ . 1 . 2]" 1
767 1 70 THR MG 1 73 ALA H . . 4.260 2.591 1.930 3.468 . 0 0 "[ . 1 . 2]" 1
768 1 72 ARG H 1 72 ARG HB2 . . 3.520 2.796 2.418 3.293 . 0 0 "[ . 1 . 2]" 1
769 1 72 ARG H 1 72 ARG HB3 . . 3.520 3.198 2.614 3.468 . 0 0 "[ . 1 . 2]" 1
770 1 72 ARG H 1 73 ALA H . . 2.680 2.071 1.882 2.420 . 0 0 "[ . 1 . 2]" 1
771 1 72 ARG HA 1 73 ALA H . . 3.550 3.634 3.598 3.650 0.100 19 0 "[ . 1 . 2]" 1
772 1 72 ARG QB 1 73 ALA H . . 4.330 2.434 2.021 2.639 . 0 0 "[ . 1 . 2]" 1
773 1 73 ALA H 1 73 ALA MB . . 3.430 2.012 1.933 2.180 . 0 0 "[ . 1 . 2]" 1
774 1 73 ALA H 1 74 VAL H . . 5.000 4.635 4.475 4.675 . 0 0 "[ . 1 . 2]" 1
775 1 73 ALA H 1 74 VAL QG . . 7.590 5.382 4.464 5.618 . 0 0 "[ . 1 . 2]" 1
776 1 73 ALA HA 1 74 VAL H . . 3.580 2.464 2.230 2.847 . 0 0 "[ . 1 . 2]" 1
777 1 74 VAL H 1 74 VAL HB . . 3.430 3.089 2.650 3.474 0.044 3 0 "[ . 1 . 2]" 1
778 1 74 VAL H 1 74 VAL MG1 . . 4.540 2.205 1.886 3.871 . 0 0 "[ . 1 . 2]" 1
779 1 74 VAL H 1 74 VAL QG . . 3.750 2.032 1.881 2.244 . 0 0 "[ . 1 . 2]" 1
780 1 74 VAL H 1 74 VAL MG2 . . 4.540 3.651 2.216 3.887 . 0 0 "[ . 1 . 2]" 1
781 1 74 VAL H 1 75 ASN H . . 3.550 3.305 2.939 3.676 0.126 12 0 "[ . 1 . 2]" 1
782 1 74 VAL HA 1 75 ASN H . . 3.420 2.557 2.240 2.751 . 0 0 "[ . 1 . 2]" 1
783 1 74 VAL HB 1 75 ASN H . . 5.500 4.624 4.151 4.690 . 0 0 "[ . 1 . 2]" 1
784 1 74 VAL QG 1 75 ASN H . . 5.280 3.549 3.363 3.608 . 0 0 "[ . 1 . 2]" 1
785 1 74 VAL QG 1 76 ALA H . . 5.000 3.642 3.443 3.899 . 0 0 "[ . 1 . 2]" 1
786 1 74 VAL MG1 1 75 ASN H . . 6.530 4.019 3.667 4.254 . 0 0 "[ . 1 . 2]" 1
787 1 74 VAL MG1 1 76 ALA H . . 5.280 4.018 3.666 4.389 . 0 0 "[ . 1 . 2]" 1
788 1 74 VAL MG2 1 75 ASN H . . 6.530 3.998 3.523 4.518 . 0 0 "[ . 1 . 2]" 1
789 1 74 VAL MG2 1 76 ALA H . . 5.280 4.183 3.977 4.378 . 0 0 "[ . 1 . 2]" 1
790 1 75 ASN H 1 75 ASN HA . . 2.860 2.664 2.610 2.784 . 0 0 "[ . 1 . 2]" 1
791 1 75 ASN H 1 75 ASN HB2 . . 3.830 3.498 2.177 3.583 . 0 0 "[ . 1 . 2]" 1
792 1 75 ASN H 1 75 ASN HB3 . . 3.830 2.549 2.436 2.833 . 0 0 "[ . 1 . 2]" 1
793 1 75 ASN H 1 76 ALA H . . 5.280 4.233 3.740 4.340 . 0 0 "[ . 1 . 2]" 1
794 1 75 ASN HA 1 76 ALA H . . 2.590 2.330 2.283 2.602 0.012 3 0 "[ . 1 . 2]" 1
795 1 75 ASN HA 1 77 CYS H . . 3.670 3.203 2.986 3.327 . 0 0 "[ . 1 . 2]" 1
796 1 75 ASN HA 1 78 GLY H . . 3.830 3.732 3.387 3.919 0.089 18 0 "[ . 1 . 2]" 1
797 1 75 ASN QB 1 78 GLY H . . 3.550 2.191 1.921 2.742 . 0 0 "[ . 1 . 2]" 1
798 1 75 ASN QB 1 79 ILE H . . 3.830 3.017 2.664 3.578 . 0 0 "[ . 1 . 2]" 1
799 1 75 ASN HB2 1 76 ALA H . . 5.470 4.018 3.892 4.723 . 0 0 "[ . 1 . 2]" 1
800 1 75 ASN HB3 1 76 ALA H . . 5.470 4.545 4.392 4.736 . 0 0 "[ . 1 . 2]" 1
801 1 75 ASN QD 1 78 GLY QA . . 4.230 2.158 1.894 3.190 . 0 0 "[ . 1 . 2]" 1
802 1 75 ASN QD 1 79 ILE H . . 4.680 3.295 1.825 3.709 . 0 0 "[ . 1 . 2]" 1
803 1 75 ASN HD21 1 78 GLY HA2 . . 4.670 2.252 1.934 3.656 . 0 0 "[ . 1 . 2]" 1
804 1 75 ASN HD21 1 78 GLY HA3 . . 4.670 3.910 3.586 4.620 . 0 0 "[ . 1 . 2]" 1
805 1 75 ASN HD21 1 79 ILE H . . 5.160 3.407 2.864 3.803 . 0 0 "[ . 1 . 2]" 1
806 1 75 ASN HD22 1 78 GLY HA2 . . 4.670 3.076 2.588 3.790 . 0 0 "[ . 1 . 2]" 1
807 1 75 ASN HD22 1 78 GLY HA3 . . 4.670 4.392 3.924 4.735 0.065 12 0 "[ . 1 . 2]" 1
808 1 75 ASN HD22 1 79 ILE H . . 5.160 4.859 1.841 5.251 0.091 13 0 "[ . 1 . 2]" 1
809 1 76 ALA H 1 76 ALA MB . . 3.430 2.094 1.975 2.214 . 0 0 "[ . 1 . 2]" 1
810 1 76 ALA H 1 77 CYS H . . 2.800 2.400 2.235 2.708 . 0 0 "[ . 1 . 2]" 1
811 1 76 ALA HA 1 77 CYS H . . 3.540 3.443 3.391 3.499 . 0 0 "[ . 1 . 2]" 1
812 1 76 ALA HA 1 78 GLY H . . 4.690 4.220 3.991 4.385 . 0 0 "[ . 1 . 2]" 1
813 1 76 ALA MB 1 77 CYS H . . 4.020 3.153 3.025 3.278 . 0 0 "[ . 1 . 2]" 1
814 1 76 ALA MB 1 78 GLY H . . 6.530 4.675 4.510 4.828 . 0 0 "[ . 1 . 2]" 1
815 1 77 CYS CB 1 95 CYS SG . . 3.100 3.025 2.903 3.146 0.046 15 0 "[ . 1 . 2]" 1
816 1 77 CYS H 1 77 CYS HA . . 2.800 2.890 2.885 2.896 0.096 10 0 "[ . 1 . 2]" 1
817 1 77 CYS H 1 77 CYS HB2 . . 2.770 2.451 2.313 2.605 . 0 0 "[ . 1 . 2]" 1
818 1 77 CYS H 1 77 CYS QB . . 2.450 2.273 2.222 2.302 . 0 0 "[ . 1 . 2]" 1
819 1 77 CYS H 1 77 CYS HB3 . . 2.770 2.714 2.549 2.869 0.099 17 0 "[ . 1 . 2]" 1
820 1 77 CYS H 1 78 GLY H . . 2.430 2.179 2.142 2.218 . 0 0 "[ . 1 . 2]" 1
821 1 77 CYS H 1 79 ILE MD . . 6.530 4.013 3.581 4.834 . 0 0 "[ . 1 . 2]" 1
822 1 77 CYS H 1 79 ILE MG . . 6.530 4.374 4.138 4.530 . 0 0 "[ . 1 . 2]" 1
823 1 77 CYS QB 1 78 GLY H . . 4.400 2.842 2.678 3.011 . 0 0 "[ . 1 . 2]" 1
824 1 77 CYS QB 1 79 ILE H . . 4.610 3.181 2.860 3.501 . 0 0 "[ . 1 . 2]" 1
825 1 77 CYS QB 1 79 ILE MD . . 4.610 1.902 1.747 2.237 . 0 0 "[ . 1 . 2]" 1
826 1 77 CYS SG 1 95 CYS CB . . 3.100 3.143 2.981 3.240 0.140 12 0 "[ . 1 . 2]" 1
827 1 77 CYS SG 1 95 CYS SG . . 2.100 2.060 1.978 2.171 0.071 6 0 "[ . 1 . 2]" 1
828 1 78 GLY H 1 78 GLY HA2 . . 2.680 2.251 2.246 2.262 . 0 0 "[ . 1 . 2]" 1
829 1 78 GLY H 1 78 GLY QA . . 2.390 2.167 2.158 2.180 . 0 0 "[ . 1 . 2]" 1
830 1 78 GLY H 1 78 GLY HA3 . . 2.680 2.825 2.793 2.858 0.178 4 0 "[ . 1 . 2]" 1
831 1 78 GLY H 1 79 ILE H . . 2.710 2.744 2.683 2.793 0.083 13 0 "[ . 1 . 2]" 1
832 1 78 GLY H 1 79 ILE MD . . 6.530 3.569 3.158 4.886 . 0 0 "[ . 1 . 2]" 1
833 1 78 GLY H 1 79 ILE MG . . 6.530 3.441 3.230 3.594 . 0 0 "[ . 1 . 2]" 1
834 1 78 GLY QA 1 79 ILE H . . 3.060 2.654 2.581 2.740 . 0 0 "[ . 1 . 2]" 1
835 1 79 ILE H 1 79 ILE HA . . 2.800 2.893 2.881 2.919 0.119 9 0 "[ . 1 . 2]" 1
836 1 79 ILE H 1 79 ILE HB . . 4.040 3.949 3.868 3.975 . 0 0 "[ . 1 . 2]" 1
837 1 79 ILE H 1 79 ILE MD . . 4.420 2.194 1.909 3.641 . 0 0 "[ . 1 . 2]" 1
838 1 79 ILE H 1 80 ASN H . . 5.500 4.351 4.029 4.420 . 0 0 "[ . 1 . 2]" 1
839 1 79 ILE HA 1 80 ASN H . . 2.590 2.405 2.176 2.580 . 0 0 "[ . 1 . 2]" 1
840 1 79 ILE HB 1 80 ASN H . . 4.820 2.895 2.575 3.630 . 0 0 "[ . 1 . 2]" 1
841 1 79 ILE MD 1 80 ASN H . . 5.720 4.117 3.454 4.594 . 0 0 "[ . 1 . 2]" 1
842 1 79 ILE MD 1 83 ALA MB . . 6.530 3.763 3.071 4.326 . 0 0 "[ . 1 . 2]" 1
843 1 79 ILE MD 1 84 LEU QD . . 4.480 2.377 1.909 2.693 . 0 0 "[ . 1 . 2]" 1
844 1 79 ILE MD 1 95 CYS QB . . 5.270 3.226 2.278 3.652 . 0 0 "[ . 1 . 2]" 1
845 1 79 ILE QG 1 80 ASN H . . 6.380 2.879 2.251 3.741 . 0 0 "[ . 1 . 2]" 1
846 1 79 ILE QG 1 83 ALA H . . 4.830 3.954 3.553 4.261 . 0 0 "[ . 1 . 2]" 1
847 1 79 ILE MG 1 80 ASN H . . 6.530 4.168 4.022 4.408 . 0 0 "[ . 1 . 2]" 1
848 1 80 ASN H 1 80 ASN HA . . 2.710 2.793 2.691 2.866 0.156 7 0 "[ . 1 . 2]" 1
849 1 80 ASN H 1 80 ASN QB . . 3.280 2.141 2.006 2.614 . 0 0 "[ . 1 . 2]" 1
850 1 80 ASN H 1 83 ALA MB . . 4.480 3.168 2.793 3.584 . 0 0 "[ . 1 . 2]" 1
851 1 80 ASN HA 1 81 CYS H . . 3.330 2.262 2.253 2.280 . 0 0 "[ . 1 . 2]" 1
852 1 80 ASN HA 1 82 SER H . . 4.480 3.796 3.588 4.090 . 0 0 "[ . 1 . 2]" 1
853 1 80 ASN HA 1 83 ALA H . . 5.500 4.394 4.181 4.545 . 0 0 "[ . 1 . 2]" 1
854 1 80 ASN QB 1 81 CYS H . . 4.300 3.432 3.281 3.713 . 0 0 "[ . 1 . 2]" 1
855 1 80 ASN QB 1 82 SER H . . 4.210 2.622 2.300 3.368 . 0 0 "[ . 1 . 2]" 1
856 1 80 ASN QB 1 83 ALA H . . 4.580 2.612 2.249 3.161 . 0 0 "[ . 1 . 2]" 1
857 1 80 ASN HB2 1 81 CYS H . . 5.070 4.448 3.544 4.607 . 0 0 "[ . 1 . 2]" 1
858 1 80 ASN HB3 1 81 CYS H . . 5.070 3.602 3.411 4.315 . 0 0 "[ . 1 . 2]" 1
859 1 81 CYS HA 1 84 LEU QB . . 4.580 3.592 3.193 3.969 . 0 0 "[ . 1 . 2]" 1
860 1 81 CYS O 1 84 LEU H . . 1.800 1.710 1.542 1.802 0.002 19 0 "[ . 1 . 2]" 1
861 1 81 CYS O 1 84 LEU N . . 2.800 2.646 2.497 2.766 . 0 0 "[ . 1 . 2]" 1
862 1 82 SER H 1 82 SER HA . . 2.770 2.732 2.702 2.754 . 0 0 "[ . 1 . 2]" 1
863 1 82 SER H 1 83 ALA H . . 2.830 2.723 2.661 2.784 . 0 0 "[ . 1 . 2]" 1
864 1 82 SER HA 1 83 ALA H . . 3.550 3.545 3.496 3.595 0.045 12 0 "[ . 1 . 2]" 1
865 1 82 SER HA 1 84 LEU H . . 4.110 3.501 3.301 3.852 . 0 0 "[ . 1 . 2]" 1
866 1 82 SER HA 1 85 LEU H . . 4.200 3.414 3.226 3.622 . 0 0 "[ . 1 . 2]" 1
867 1 82 SER HA 1 86 GLN H . . 5.500 5.324 4.685 5.534 0.034 13 0 "[ . 1 . 2]" 1
868 1 82 SER O 1 85 LEU H . . 1.800 1.731 1.577 1.804 0.004 15 0 "[ . 1 . 2]" 1
869 1 82 SER O 1 85 LEU N . . 2.800 2.662 2.516 2.746 . 0 0 "[ . 1 . 2]" 1
870 1 83 ALA H 1 83 ALA HA . . 2.770 2.795 2.775 2.814 0.044 6 0 "[ . 1 . 2]" 1
871 1 83 ALA H 1 83 ALA MB . . 3.430 2.084 1.945 2.158 . 0 0 "[ . 1 . 2]" 1
872 1 83 ALA H 1 84 LEU H . . 3.140 2.629 2.593 2.671 . 0 0 "[ . 1 . 2]" 1
873 1 83 ALA H 1 85 LEU H . . 5.000 4.058 3.884 4.198 . 0 0 "[ . 1 . 2]" 1
874 1 83 ALA MB 1 91 ALA MB . . 5.080 2.148 1.722 2.665 . 0 0 "[ . 1 . 2]" 1
875 1 84 LEU H 1 84 LEU QB . . 3.570 2.527 2.399 2.746 . 0 0 "[ . 1 . 2]" 1
876 1 84 LEU H 1 84 LEU HG . . 2.740 2.626 2.102 2.838 0.098 19 0 "[ . 1 . 2]" 1
877 1 84 LEU H 1 85 LEU H . . 2.460 2.424 2.274 2.529 0.069 19 0 "[ . 1 . 2]" 1
878 1 84 LEU H 1 86 GLN H . . 5.500 4.288 3.790 5.161 . 0 0 "[ . 1 . 2]" 1
879 1 84 LEU QB 1 85 LEU H . . 4.270 3.680 3.551 3.788 . 0 0 "[ . 1 . 2]" 1
880 1 84 LEU QD 1 85 LEU H . . 5.930 4.347 3.986 4.527 . 0 0 "[ . 1 . 2]" 1
881 1 84 LEU QD 1 95 CYS QB . . 6.840 2.529 1.931 2.965 . 0 0 "[ . 1 . 2]" 1
882 1 85 LEU H 1 85 LEU HB2 . . 3.360 2.705 2.423 3.050 . 0 0 "[ . 1 . 2]" 1
883 1 85 LEU H 1 85 LEU HB3 . . 3.360 3.102 2.623 3.336 . 0 0 "[ . 1 . 2]" 1
884 1 85 LEU H 1 86 GLN H . . 3.210 2.205 1.855 2.735 . 0 0 "[ . 1 . 2]" 1
885 1 85 LEU QB 1 86 GLN H . . 4.330 3.677 1.943 3.902 . 0 0 "[ . 1 . 2]" 1
886 1 86 GLN H 1 86 GLN QB . . 3.710 2.612 2.299 3.147 . 0 0 "[ . 1 . 2]" 1
887 1 86 GLN H 1 86 GLN HG2 . . 3.300 2.698 2.147 3.245 . 0 0 "[ . 1 . 2]" 1
888 1 86 GLN H 1 86 GLN QG . . 2.850 2.424 2.110 2.807 . 0 0 "[ . 1 . 2]" 1
889 1 86 GLN H 1 86 GLN HG3 . . 3.300 2.876 2.524 3.299 . 0 0 "[ . 1 . 2]" 1
890 1 86 GLN H 1 87 ASP H . . 4.330 4.243 2.251 4.449 0.119 9 0 "[ . 1 . 2]" 1
891 1 86 GLN HA 1 87 ASP H . . 3.210 2.877 2.783 2.998 . 0 0 "[ . 1 . 2]" 1
892 1 87 ASP H 1 87 ASP HA . . 2.800 2.855 2.821 2.874 0.074 20 0 "[ . 1 . 2]" 1
893 1 87 ASP H 1 87 ASP HB2 . . 3.240 2.946 2.082 3.327 0.087 15 0 "[ . 1 . 2]" 1
894 1 87 ASP H 1 87 ASP HB3 . . 3.240 2.672 2.146 3.362 0.122 17 0 "[ . 1 . 2]" 1
895 1 87 ASP H 1 88 ASP H . . 2.710 2.628 2.383 2.782 0.072 9 0 "[ . 1 . 2]" 1
896 1 87 ASP QB 1 88 ASP H . . 3.500 2.254 1.932 2.609 . 0 0 "[ . 1 . 2]" 1
897 1 88 ASP H 1 88 ASP HB2 . . 4.110 2.638 2.095 3.522 . 0 0 "[ . 1 . 2]" 1
898 1 88 ASP H 1 88 ASP QB . . 3.800 2.508 2.076 2.829 . 0 0 "[ . 1 . 2]" 1
899 1 88 ASP H 1 88 ASP HB3 . . 4.110 3.472 2.860 3.764 . 0 0 "[ . 1 . 2]" 1
900 1 88 ASP HA 1 89 ILE H . . 3.240 2.334 2.252 2.716 . 0 0 "[ . 1 . 2]" 1
901 1 88 ASP QB 1 90 THR H . . 3.380 2.290 1.925 2.689 . 0 0 "[ . 1 . 2]" 1
902 1 88 ASP HB2 1 90 THR H . . 3.700 3.256 1.988 3.725 0.025 5 0 "[ . 1 . 2]" 1
903 1 88 ASP HB3 1 90 THR H . . 3.700 2.498 1.937 3.725 0.025 15 0 "[ . 1 . 2]" 1
904 1 89 ILE H 1 89 ILE HA . . 2.830 2.899 2.868 2.929 0.099 13 0 "[ . 1 . 2]" 1
905 1 89 ILE H 1 89 ILE HB . . 3.670 3.607 3.562 3.660 . 0 0 "[ . 1 . 2]" 1
906 1 89 ILE H 1 89 ILE QG . . 3.800 2.131 1.905 2.383 . 0 0 "[ . 1 . 2]" 1
907 1 89 ILE H 1 89 ILE MG . . 3.740 2.447 2.161 2.742 . 0 0 "[ . 1 . 2]" 1
908 1 89 ILE H 1 90 THR H . . 2.520 2.432 2.088 2.557 0.037 2 0 "[ . 1 . 2]" 1
909 1 89 ILE H 1 91 ALA H . . 5.500 4.756 4.388 4.978 . 0 0 "[ . 1 . 2]" 1
910 1 89 ILE HA 1 92 ALA H . . 3.920 2.808 2.748 2.878 . 0 0 "[ . 1 . 2]" 1
911 1 89 ILE QG 1 90 THR H . . 5.970 3.113 2.760 3.294 . 0 0 "[ . 1 . 2]" 1
912 1 89 ILE MG 1 92 ALA H . . 6.530 4.483 4.245 4.872 . 0 0 "[ . 1 . 2]" 1
913 1 89 ILE O 1 93 ILE H . . 1.800 1.772 1.635 1.815 0.015 19 0 "[ . 1 . 2]" 1
914 1 89 ILE O 1 93 ILE N . . 2.800 2.696 2.588 2.741 . 0 0 "[ . 1 . 2]" 1
915 1 90 THR H 1 90 THR HA . . 2.550 2.712 2.696 2.722 0.172 8 0 "[ . 1 . 2]" 1
916 1 90 THR H 1 90 THR HB . . 3.420 2.208 1.985 2.362 . 0 0 "[ . 1 . 2]" 1
917 1 90 THR H 1 90 THR MG . . 4.050 2.686 2.258 3.492 . 0 0 "[ . 1 . 2]" 1
918 1 90 THR H 1 91 ALA H . . 2.830 2.919 2.884 2.972 0.142 7 0 "[ . 1 . 2]" 1
919 1 90 THR H 1 92 ALA H . . 5.470 4.218 4.073 4.315 . 0 0 "[ . 1 . 2]" 1
920 1 90 THR HA 1 92 ALA H . . 5.440 4.442 4.323 4.579 . 0 0 "[ . 1 . 2]" 1
921 1 90 THR HA 1 93 ILE H . . 3.550 3.437 3.344 3.555 0.005 5 0 "[ . 1 . 2]" 1
922 1 90 THR HA 1 93 ILE QG . . 4.520 3.151 2.992 3.478 . 0 0 "[ . 1 . 2]" 1
923 1 90 THR HA 1 94 GLN H . . 4.910 3.779 3.660 3.921 . 0 0 "[ . 1 . 2]" 1
924 1 90 THR MG 1 91 ALA H . . 3.830 2.238 1.897 2.797 . 0 0 "[ . 1 . 2]" 1
925 1 90 THR MG 1 94 GLN H . . 5.940 4.561 3.909 4.888 . 0 0 "[ . 1 . 2]" 1
926 1 90 THR O 1 94 GLN H . . 1.800 1.808 1.802 1.818 0.018 7 0 "[ . 1 . 2]" 1
927 1 90 THR O 1 94 GLN N . . 2.800 2.789 2.769 2.811 0.011 8 0 "[ . 1 . 2]" 1
928 1 91 ALA H 1 91 ALA MB . . 3.430 2.050 1.960 2.170 . 0 0 "[ . 1 . 2]" 1
929 1 91 ALA H 1 92 ALA H . . 2.400 2.494 2.454 2.555 0.155 8 0 "[ . 1 . 2]" 1
930 1 91 ALA HA 1 92 ALA H . . 3.550 3.597 3.583 3.610 0.060 17 0 "[ . 1 . 2]" 1
931 1 91 ALA HA 1 94 GLN H . . 3.300 3.330 3.278 3.369 0.069 10 0 "[ . 1 . 2]" 1
932 1 91 ALA HA 1 94 GLN QB . . 4.020 2.496 2.348 2.603 . 0 0 "[ . 1 . 2]" 1
933 1 91 ALA MB 1 92 ALA H . . 3.430 2.702 2.634 2.811 . 0 0 "[ . 1 . 2]" 1
934 1 91 ALA MB 1 94 GLN H . . 6.120 4.622 4.569 4.667 . 0 0 "[ . 1 . 2]" 1
935 1 91 ALA MB 1 95 CYS H . . 5.880 4.225 4.047 4.385 . 0 0 "[ . 1 . 2]" 1
936 1 91 ALA O 1 95 CYS H . . 1.800 1.659 1.519 1.797 . 0 0 "[ . 1 . 2]" 1
937 1 91 ALA O 1 95 CYS N . . 2.800 2.630 2.491 2.786 . 0 0 "[ . 1 . 2]" 1
938 1 92 ALA H 1 92 ALA HA . . 2.770 2.794 2.768 2.809 0.039 13 0 "[ . 1 . 2]" 1
939 1 92 ALA H 1 92 ALA MB . . 3.430 2.056 1.941 2.162 . 0 0 "[ . 1 . 2]" 1
940 1 92 ALA H 1 93 ILE MD . . 6.530 5.265 5.095 5.350 . 0 0 "[ . 1 . 2]" 1
941 1 92 ALA HA 1 95 CYS QB . . 4.770 2.985 2.858 3.113 . 0 0 "[ . 1 . 2]" 1
942 1 92 ALA O 1 96 ALA H . . 1.800 1.782 1.658 1.805 0.005 4 0 "[ . 1 . 2]" 1
943 1 92 ALA O 1 96 ALA N . . 2.800 2.668 2.601 2.745 . 0 0 "[ . 1 . 2]" 1
944 1 93 ILE H 1 93 ILE HA . . 2.800 2.843 2.809 2.856 0.056 15 0 "[ . 1 . 2]" 1
945 1 93 ILE H 1 93 ILE HB . . 3.300 2.516 2.445 2.555 . 0 0 "[ . 1 . 2]" 1
946 1 93 ILE H 1 93 ILE MD . . 5.440 3.597 3.484 3.665 . 0 0 "[ . 1 . 2]" 1
947 1 93 ILE H 1 93 ILE QG . . 3.560 1.949 1.906 2.051 . 0 0 "[ . 1 . 2]" 1
948 1 93 ILE H 1 94 GLN H . . 2.860 2.594 2.570 2.675 . 0 0 "[ . 1 . 2]" 1
949 1 93 ILE HA 1 96 ALA H . . 3.510 3.343 3.215 3.497 . 0 0 "[ . 1 . 2]" 1
950 1 93 ILE HA 1 96 ALA MB . . 4.820 2.044 1.951 2.257 . 0 0 "[ . 1 . 2]" 1
951 1 93 ILE HB 1 94 GLN H . . 2.650 2.492 2.427 2.560 . 0 0 "[ . 1 . 2]" 1
952 1 93 ILE MD 1 94 GLN H . . 5.440 4.484 4.406 4.541 . 0 0 "[ . 1 . 2]" 1
953 1 93 ILE QG 1 94 GLN H . . 4.470 3.812 3.737 3.908 . 0 0 "[ . 1 . 2]" 1
954 1 93 ILE HG12 1 94 GLN H . . 4.760 4.827 4.770 4.901 0.141 18 0 "[ . 1 . 2]" 1
955 1 93 ILE HG13 1 94 GLN H . . 4.760 3.992 3.904 4.113 . 0 0 "[ . 1 . 2]" 1
956 1 93 ILE MG 1 94 GLN H . . 4.760 3.559 3.376 3.664 . 0 0 "[ . 1 . 2]" 1
957 1 93 ILE O 1 97 LYS H . . 1.800 1.789 1.677 1.815 0.015 5 0 "[ . 1 . 2]" 1
958 1 93 ILE O 1 97 LYS N . . 2.800 2.749 2.657 2.786 . 0 0 "[ . 1 . 2]" 1
959 1 94 GLN H 1 94 GLN HB2 . . 2.740 2.241 2.221 2.340 . 0 0 "[ . 1 . 2]" 1
960 1 94 GLN H 1 94 GLN HB3 . . 2.740 2.732 2.612 2.758 0.018 18 0 "[ . 1 . 2]" 1
961 1 94 GLN H 1 95 CYS H . . 2.710 2.812 2.773 2.855 0.145 19 0 "[ . 1 . 2]" 1
962 1 94 GLN H 1 96 ALA H . . 5.500 4.111 3.987 4.354 . 0 0 "[ . 1 . 2]" 1
963 1 94 GLN HA 1 97 LYS H . . 3.670 3.633 3.551 3.713 0.043 11 0 "[ . 1 . 2]" 1
964 1 94 GLN HA 1 97 LYS QB . . 4.610 3.991 3.880 4.115 . 0 0 "[ . 1 . 2]" 1
965 1 94 GLN QB 1 95 CYS H . . 3.130 2.527 2.449 2.609 . 0 0 "[ . 1 . 2]" 1
966 1 94 GLN HB2 1 95 CYS H . . 3.730 3.722 3.663 3.771 0.041 3 0 "[ . 1 . 2]" 1
967 1 94 GLN HB3 1 95 CYS H . . 3.730 2.571 2.486 2.661 . 0 0 "[ . 1 . 2]" 1
968 1 94 GLN O 1 98 ARG H . . 1.800 1.803 1.775 1.810 0.010 13 0 "[ . 1 . 2]" 1
969 1 94 GLN O 1 98 ARG N . . 2.800 2.733 2.680 2.775 . 0 0 "[ . 1 . 2]" 1
970 1 95 CYS H 1 95 CYS HA . . 2.900 2.814 2.805 2.830 . 0 0 "[ . 1 . 2]" 1
971 1 95 CYS H 1 95 CYS HB2 . . 3.730 2.205 2.041 2.374 . 0 0 "[ . 1 . 2]" 1
972 1 95 CYS H 1 95 CYS QB . . 3.090 2.126 2.021 2.204 . 0 0 "[ . 1 . 2]" 1
973 1 95 CYS H 1 95 CYS HB3 . . 3.730 2.838 2.613 3.259 . 0 0 "[ . 1 . 2]" 1
974 1 95 CYS H 1 96 ALA H . . 2.900 2.556 2.484 2.639 . 0 0 "[ . 1 . 2]" 1
975 1 95 CYS HA 1 97 LYS H . . 5.440 4.374 4.167 4.494 . 0 0 "[ . 1 . 2]" 1
976 1 95 CYS HA 1 98 ARG H . . 3.670 3.096 2.992 3.165 . 0 0 "[ . 1 . 2]" 1
977 1 95 CYS HA 1 98 ARG QB . . 4.640 2.040 1.947 2.140 . 0 0 "[ . 1 . 2]" 1
978 1 95 CYS HA 1 99 VAL H . . 5.280 3.966 3.835 4.095 . 0 0 "[ . 1 . 2]" 1
979 1 95 CYS QB 1 96 ALA H . . 3.030 2.588 2.358 2.779 . 0 0 "[ . 1 . 2]" 1
980 1 95 CYS HB2 1 96 ALA H . . 3.550 3.552 3.141 3.662 0.112 11 0 "[ . 1 . 2]" 1
981 1 95 CYS HB3 1 96 ALA H . . 3.550 2.672 2.387 3.099 . 0 0 "[ . 1 . 2]" 1
982 1 95 CYS O 1 99 VAL H . . 1.800 1.762 1.669 1.803 0.003 4 0 "[ . 1 . 2]" 1
983 1 95 CYS O 1 99 VAL N . . 2.800 2.493 2.455 2.573 . 0 0 "[ . 1 . 2]" 1
984 1 96 ALA H 1 96 ALA MB . . 3.430 2.124 2.096 2.172 . 0 0 "[ . 1 . 2]" 1
985 1 96 ALA H 1 97 LYS H . . 3.730 2.878 2.773 2.965 . 0 0 "[ . 1 . 2]" 1
986 1 96 ALA H 1 98 ARG H . . 5.250 4.089 4.007 4.161 . 0 0 "[ . 1 . 2]" 1
987 1 96 ALA HA 1 99 VAL H . . 3.550 3.554 3.474 3.625 0.075 14 0 "[ . 1 . 2]" 1
988 1 96 ALA HA 1 99 VAL HB . . 3.500 2.726 2.613 2.872 . 0 0 "[ . 1 . 2]" 1
989 1 96 ALA HA 1 99 VAL QG . . 5.010 3.130 2.902 3.387 . 0 0 "[ . 1 . 2]" 1
990 1 96 ALA MB 1 97 LYS H . . 3.520 2.534 2.400 2.660 . 0 0 "[ . 1 . 2]" 1
991 1 96 ALA O 1 100 VAL H . . 1.800 1.802 1.758 1.810 0.010 12 0 "[ . 1 . 2]" 1
992 1 96 ALA O 1 100 VAL N . . 2.800 2.799 2.752 2.810 0.010 12 0 "[ . 1 . 2]" 1
993 1 97 LYS H 1 97 LYS HA . . 2.920 2.839 2.827 2.864 . 0 0 "[ . 1 . 2]" 1
994 1 97 LYS H 1 97 LYS QB . . 3.520 2.516 2.454 2.571 . 0 0 "[ . 1 . 2]" 1
995 1 97 LYS H 1 97 LYS HG2 . . 2.830 2.082 1.914 2.279 . 0 0 "[ . 1 . 2]" 1
996 1 97 LYS H 1 97 LYS QG . . 2.470 2.037 1.889 2.202 . 0 0 "[ . 1 . 2]" 1
997 1 97 LYS H 1 97 LYS HG3 . . 2.830 2.909 2.842 2.973 0.143 4 0 "[ . 1 . 2]" 1
998 1 97 LYS H 1 98 ARG H . . 2.520 2.528 2.449 2.587 0.067 18 0 "[ . 1 . 2]" 1
999 1 97 LYS H 1 99 VAL H . . 3.700 3.781 3.739 3.842 0.142 7 0 "[ . 1 . 2]" 1
1000 1 97 LYS HA 1 98 ARG H . . 3.550 3.602 3.593 3.612 0.062 18 0 "[ . 1 . 2]" 1
1001 1 97 LYS HA 1 100 VAL H . . 3.550 3.354 3.285 3.441 . 0 0 "[ . 1 . 2]" 1
1002 1 97 LYS QB 1 98 ARG H . . 4.020 3.492 3.434 3.534 . 0 0 "[ . 1 . 2]" 1
1003 1 97 LYS QG 1 98 ARG H . . 4.120 1.916 1.888 1.971 . 0 0 "[ . 1 . 2]" 1
1004 1 97 LYS HG2 1 98 ARG H . . 4.480 2.746 2.638 2.900 . 0 0 "[ . 1 . 2]" 1
1005 1 97 LYS HG3 1 98 ARG H . . 4.480 1.957 1.920 2.022 . 0 0 "[ . 1 . 2]" 1
1006 1 97 LYS O 1 101 ARG H . . 1.800 1.812 1.807 1.819 0.019 7 0 "[ . 1 . 2]" 1
1007 1 97 LYS O 1 101 ARG N . . 2.800 2.665 2.586 2.726 . 0 0 "[ . 1 . 2]" 1
1008 1 98 ARG H 1 98 ARG HB2 . . 2.550 2.402 2.374 2.516 . 0 0 "[ . 1 . 2]" 1
1009 1 98 ARG H 1 98 ARG HB3 . . 2.550 2.555 2.439 2.584 0.034 2 0 "[ . 1 . 2]" 1
1010 1 98 ARG H 1 99 VAL H . . 2.550 2.635 2.587 2.672 0.122 14 0 "[ . 1 . 2]" 1
1011 1 98 ARG H 1 100 VAL H . . 4.620 4.524 4.466 4.577 . 0 0 "[ . 1 . 2]" 1
1012 1 98 ARG HA 1 99 VAL H . . 3.550 3.505 3.470 3.535 . 0 0 "[ . 1 . 2]" 1
1013 1 99 VAL H 1 99 VAL HA . . 2.770 2.895 2.882 2.905 0.135 4 0 "[ . 1 . 2]" 1
1014 1 99 VAL H 1 99 VAL HB . . 3.240 2.249 2.182 2.303 . 0 0 "[ . 1 . 2]" 1
1015 1 99 VAL H 1 99 VAL MG1 . . 4.730 3.656 3.605 3.693 . 0 0 "[ . 1 . 2]" 1
1016 1 99 VAL H 1 99 VAL QG . . 4.210 2.586 2.438 2.707 . 0 0 "[ . 1 . 2]" 1
1017 1 99 VAL H 1 99 VAL MG2 . . 4.730 2.645 2.474 2.797 . 0 0 "[ . 1 . 2]" 1
1018 1 99 VAL H 1 100 VAL QG . . 6.540 4.031 3.702 4.187 . 0 0 "[ . 1 . 2]" 1
1019 1 99 VAL H 1 101 ARG H . . 3.580 3.416 3.331 3.524 . 0 0 "[ . 1 . 2]" 1
1020 1 99 VAL HB 1 100 VAL H . . 2.400 2.433 2.370 2.499 0.099 18 0 "[ . 1 . 2]" 1
1021 1 99 VAL QG 1 100 VAL H . . 3.890 2.873 2.733 3.016 . 0 0 "[ . 1 . 2]" 1
1022 1 99 VAL QG 1 109 TRP HH2 . . 5.500 2.762 2.253 3.767 . 0 0 "[ . 1 . 2]" 1
1023 1 99 VAL MG1 1 100 VAL H . . 4.730 2.958 2.786 3.149 . 0 0 "[ . 1 . 2]" 1
1024 1 99 VAL MG2 1 100 VAL H . . 4.730 3.920 3.856 3.983 . 0 0 "[ . 1 . 2]" 1
1025 1 99 VAL O 1 102 ASP H . . 1.800 1.811 1.805 1.818 0.018 5 0 "[ . 1 . 2]" 1
1026 1 99 VAL O 1 102 ASP N . . 2.800 2.784 2.712 2.798 . 0 0 "[ . 1 . 2]" 1
1027 1 100 VAL H 1 100 VAL HA . . 2.770 2.768 2.746 2.789 0.019 6 0 "[ . 1 . 2]" 1
1028 1 100 VAL H 1 100 VAL HB . . 2.770 2.231 2.012 2.603 . 0 0 "[ . 1 . 2]" 1
1029 1 100 VAL H 1 100 VAL MG1 . . 4.260 3.371 2.774 3.701 . 0 0 "[ . 1 . 2]" 1
1030 1 100 VAL H 1 100 VAL MG2 . . 4.260 2.670 1.869 3.490 . 0 0 "[ . 1 . 2]" 1
1031 1 100 VAL H 1 101 ARG H . . 2.550 2.686 2.630 2.737 0.187 14 0 "[ . 1 . 2]" 1
1032 1 100 VAL HA 1 102 ASP H . . 4.260 3.451 3.315 3.611 . 0 0 "[ . 1 . 2]" 1
1033 1 100 VAL HA 1 105 GLY H . . 3.670 3.011 2.765 3.714 0.044 9 0 "[ . 1 . 2]" 1
1034 1 100 VAL HA 1 106 ILE H . . 4.600 4.458 3.455 4.664 0.064 17 0 "[ . 1 . 2]" 1
1035 1 100 VAL HB 1 101 ARG H . . 3.610 3.278 2.864 3.704 0.094 20 0 "[ . 1 . 2]" 1
1036 1 100 VAL HB 1 106 ILE H . . 5.500 5.214 4.706 5.518 0.018 6 0 "[ . 1 . 2]" 1
1037 1 100 VAL QG 1 101 ARG H . . 4.660 2.987 2.161 3.538 . 0 0 "[ . 1 . 2]" 1
1038 1 100 VAL QG 1 102 ASP H . . 5.590 4.049 3.931 4.235 . 0 0 "[ . 1 . 2]" 1
1039 1 100 VAL QG 1 105 GLY H . . 7.000 3.403 3.064 4.302 . 0 0 "[ . 1 . 2]" 1
1040 1 100 VAL QG 1 106 ILE H . . 4.300 2.392 2.122 2.750 . 0 0 "[ . 1 . 2]" 1
1041 1 100 VAL MG1 1 101 ARG H . . 5.010 3.160 2.167 4.014 . 0 0 "[ . 1 . 2]" 1
1042 1 100 VAL MG1 1 102 ASP H . . 5.880 4.312 4.179 4.579 . 0 0 "[ . 1 . 2]" 1
1043 1 100 VAL MG2 1 101 ARG H . . 5.010 4.145 3.843 4.287 . 0 0 "[ . 1 . 2]" 1
1044 1 100 VAL MG2 1 102 ASP H . . 5.880 4.917 4.785 4.990 . 0 0 "[ . 1 . 2]" 1
1045 1 101 ARG H 1 101 ARG HB2 . . 3.520 2.197 2.025 3.521 0.001 4 0 "[ . 1 . 2]" 1
1046 1 101 ARG H 1 101 ARG QB . . 3.210 2.092 2.005 2.274 . 0 0 "[ . 1 . 2]" 1
1047 1 101 ARG H 1 101 ARG HB3 . . 3.520 3.123 2.302 3.446 . 0 0 "[ . 1 . 2]" 1
1048 1 101 ARG H 1 101 ARG QG . . 4.920 3.300 2.526 4.014 . 0 0 "[ . 1 . 2]" 1
1049 1 101 ARG H 1 102 ASP H . . 3.480 2.758 2.592 2.862 . 0 0 "[ . 1 . 2]" 1
1050 1 101 ARG HA 1 102 ASP H . . 3.480 3.494 3.432 3.540 0.060 15 0 "[ . 1 . 2]" 1
1051 1 101 ARG QB 1 102 ASP H . . 3.990 3.105 2.894 3.656 . 0 0 "[ . 1 . 2]" 1
1052 1 101 ARG QG 1 102 ASP H . . 5.420 4.403 2.081 4.652 . 0 0 "[ . 1 . 2]" 1
1053 1 102 ASP H 1 102 ASP HA . . 2.800 2.804 2.706 2.849 0.049 13 0 "[ . 1 . 2]" 1
1054 1 102 ASP H 1 102 ASP HB2 . . 3.230 2.100 2.007 3.399 0.169 9 0 "[ . 1 . 2]" 1
1055 1 102 ASP H 1 102 ASP QB . . 2.830 2.012 1.987 2.070 . 0 0 "[ . 1 . 2]" 1
1056 1 102 ASP H 1 102 ASP HB3 . . 3.230 3.134 2.088 3.366 0.136 17 0 "[ . 1 . 2]" 1
1057 1 102 ASP HA 1 104 GLN H . . 5.010 4.101 4.014 4.496 . 0 0 "[ . 1 . 2]" 1
1058 1 102 ASP QB 1 104 GLN H . . 3.680 2.054 1.883 3.306 . 0 0 "[ . 1 . 2]" 1
1059 1 102 ASP QB 1 105 GLY H . . 4.150 3.674 2.465 3.816 . 0 0 "[ . 1 . 2]" 1
1060 1 104 GLN H 1 104 GLN HA . . 2.800 2.803 2.719 2.895 0.095 17 0 "[ . 1 . 2]" 1
1061 1 104 GLN H 1 104 GLN HB2 . . 3.660 2.636 2.510 3.506 . 0 0 "[ . 1 . 2]" 1
1062 1 104 GLN H 1 104 GLN QB . . 3.370 2.536 2.464 3.218 . 0 0 "[ . 1 . 2]" 1
1063 1 104 GLN H 1 104 GLN HB3 . . 3.660 3.536 2.817 3.781 0.121 17 0 "[ . 1 . 2]" 1
1064 1 104 GLN H 1 104 GLN HG2 . . 3.390 2.148 1.964 2.705 . 0 0 "[ . 1 . 2]" 1
1065 1 104 GLN H 1 104 GLN QG . . 2.960 2.070 1.854 2.344 . 0 0 "[ . 1 . 2]" 1
1066 1 104 GLN H 1 104 GLN HG3 . . 3.390 2.925 2.012 3.141 . 0 0 "[ . 1 . 2]" 1
1067 1 104 GLN H 1 105 GLY H . . 3.480 2.830 2.579 3.470 . 0 0 "[ . 1 . 2]" 1
1068 1 104 GLN QB 1 105 GLY H . . 3.080 2.157 1.938 2.200 . 0 0 "[ . 1 . 2]" 1
1069 1 104 GLN HB2 1 105 GLY H . . 3.360 2.182 1.948 2.227 . 0 0 "[ . 1 . 2]" 1
1070 1 104 GLN HB3 1 105 GLY H . . 3.360 3.402 3.361 3.486 0.126 17 0 "[ . 1 . 2]" 1
1071 1 104 GLN QG 1 105 GLY H . . 4.150 3.631 1.971 3.824 . 0 0 "[ . 1 . 2]" 1
1072 1 105 GLY H 1 105 GLY HA2 . . 2.800 2.295 2.255 2.495 . 0 0 "[ . 1 . 2]" 1
1073 1 105 GLY H 1 105 GLY QA . . 2.460 2.209 2.151 2.370 . 0 0 "[ . 1 . 2]" 1
1074 1 105 GLY H 1 105 GLY HA3 . . 2.800 2.879 2.719 2.959 0.159 15 0 "[ . 1 . 2]" 1
1075 1 105 GLY H 1 106 ILE H . . 4.630 4.355 4.237 4.524 . 0 0 "[ . 1 . 2]" 1
1076 1 105 GLY QA 1 106 ILE H . . 3.160 2.280 2.174 2.333 . 0 0 "[ . 1 . 2]" 1
1077 1 105 GLY O 1 108 ALA H . . 1.800 1.691 1.547 1.812 0.012 11 0 "[ . 1 . 2]" 1
1078 1 105 GLY O 1 108 ALA N . . 2.800 2.672 2.476 2.795 . 0 0 "[ . 1 . 2]" 1
1079 1 106 ILE H 1 106 ILE HA . . 2.770 2.687 2.673 2.721 . 0 0 "[ . 1 . 2]" 1
1080 1 106 ILE H 1 106 ILE HB . . 3.170 2.256 2.146 2.375 . 0 0 "[ . 1 . 2]" 1
1081 1 106 ILE H 1 106 ILE HG12 . . 3.790 2.426 2.119 2.674 . 0 0 "[ . 1 . 2]" 1
1082 1 106 ILE H 1 106 ILE HG13 . . 3.790 3.482 3.206 3.758 . 0 0 "[ . 1 . 2]" 1
1083 1 106 ILE H 1 106 ILE MG . . 4.610 3.656 3.584 3.704 . 0 0 "[ . 1 . 2]" 1
1084 1 106 ILE H 1 107 ARG H . . 3.210 2.874 2.797 2.915 . 0 0 "[ . 1 . 2]" 1
1085 1 106 ILE HA 1 107 ARG H . . 3.610 3.541 3.510 3.601 . 0 0 "[ . 1 . 2]" 1
1086 1 106 ILE HB 1 107 ARG H . . 4.630 3.129 2.837 3.237 . 0 0 "[ . 1 . 2]" 1
1087 1 106 ILE MD 1 109 TRP H . . 6.530 4.304 3.954 4.638 . 0 0 "[ . 1 . 2]" 1
1088 1 106 ILE MD 1 109 TRP QB . . 6.400 3.493 3.003 3.960 . 0 0 "[ . 1 . 2]" 1
1089 1 106 ILE MD 1 109 TRP HE3 . . 4.230 2.174 1.991 2.565 . 0 0 "[ . 1 . 2]" 1
1090 1 106 ILE MD 1 109 TRP HZ3 . . 4.230 2.180 1.924 2.640 . 0 0 "[ . 1 . 2]" 1
1091 1 106 ILE QG 1 109 TRP H . . 6.530 5.578 5.457 5.713 . 0 0 "[ . 1 . 2]" 1
1092 1 106 ILE QG 1 109 TRP HE3 . . 4.490 3.864 3.495 4.084 . 0 0 "[ . 1 . 2]" 1
1093 1 106 ILE QG 1 109 TRP HZ3 . . 4.490 3.192 2.412 3.812 . 0 0 "[ . 1 . 2]" 1
1094 1 106 ILE MG 1 107 ARG H . . 4.420 3.354 3.081 3.550 . 0 0 "[ . 1 . 2]" 1
1095 1 106 ILE MG 1 108 ALA H . . 5.500 4.448 4.296 4.512 . 0 0 "[ . 1 . 2]" 1
1096 1 106 ILE MG 1 112 TRP HE1 . . 5.500 3.947 2.864 4.708 . 0 0 "[ . 1 . 2]" 1
1097 1 106 ILE O 1 109 TRP H . . 1.800 1.537 1.443 1.604 . 0 0 "[ . 1 . 2]" 1
1098 1 106 ILE O 1 109 TRP N . . 2.800 2.504 2.424 2.556 . 0 0 "[ . 1 . 2]" 1
1099 1 107 ARG H 1 107 ARG HA . . 2.860 2.632 2.592 2.671 . 0 0 "[ . 1 . 2]" 1
1100 1 107 ARG H 1 107 ARG HB2 . . 2.930 2.164 2.111 2.250 . 0 0 "[ . 1 . 2]" 1
1101 1 107 ARG H 1 107 ARG QB . . 2.530 2.110 2.069 2.161 . 0 0 "[ . 1 . 2]" 1
1102 1 107 ARG H 1 107 ARG HB3 . . 2.930 2.934 2.788 2.972 0.042 11 0 "[ . 1 . 2]" 1
1103 1 107 ARG HA 1 109 TRP H . . 4.120 3.766 3.700 3.864 . 0 0 "[ . 1 . 2]" 1
1104 1 107 ARG QB 1 108 ALA H . . 4.310 2.712 2.640 2.824 . 0 0 "[ . 1 . 2]" 1
1105 1 107 ARG QB 1 109 TRP H . . 5.120 4.599 4.570 4.640 . 0 0 "[ . 1 . 2]" 1
1106 1 108 ALA H 1 108 ALA HA . . 2.680 2.697 2.676 2.754 0.074 14 0 "[ . 1 . 2]" 1
1107 1 108 ALA H 1 108 ALA MB . . 3.430 2.099 1.953 2.180 . 0 0 "[ . 1 . 2]" 1
1108 1 108 ALA H 1 109 TRP H . . 2.960 2.872 2.733 2.926 . 0 0 "[ . 1 . 2]" 1
1109 1 108 ALA H 1 110 VAL H . . 5.500 5.073 4.617 5.387 . 0 0 "[ . 1 . 2]" 1
1110 1 108 ALA MB 1 109 TRP H . . 4.020 2.752 2.650 2.892 . 0 0 "[ . 1 . 2]" 1
1111 1 108 ALA MB 1 109 TRP HE3 . . 6.530 3.388 2.890 3.846 . 0 0 "[ . 1 . 2]" 1
1112 1 109 TRP H 1 109 TRP HA . . 2.770 2.919 2.904 2.933 0.163 11 0 "[ . 1 . 2]" 1
1113 1 109 TRP H 1 109 TRP HB2 . . 3.670 2.437 2.367 2.546 . 0 0 "[ . 1 . 2]" 1
1114 1 109 TRP H 1 109 TRP QB . . 3.200 2.401 2.336 2.502 . 0 0 "[ . 1 . 2]" 1
1115 1 109 TRP H 1 109 TRP HB3 . . 3.670 3.619 3.583 3.675 0.005 11 0 "[ . 1 . 2]" 1
1116 1 109 TRP H 1 110 VAL H . . 5.380 3.454 3.112 3.681 . 0 0 "[ . 1 . 2]" 1
1117 1 109 TRP HA 1 110 VAL H . . 3.630 2.616 2.510 2.808 . 0 0 "[ . 1 . 2]" 1
1118 1 109 TRP HA 1 111 ALA H . . 4.230 3.119 2.986 3.262 . 0 0 "[ . 1 . 2]" 1
1119 1 109 TRP HA 1 112 TRP H . . 5.500 4.353 4.232 4.466 . 0 0 "[ . 1 . 2]" 1
1120 1 109 TRP QB 1 110 VAL H . . 4.460 3.982 3.960 3.992 . 0 0 "[ . 1 . 2]" 1
1121 1 109 TRP O 1 112 TRP H . . 1.800 1.791 1.742 1.826 0.026 20 0 "[ . 1 . 2]" 1
1122 1 109 TRP O 1 112 TRP N . . 2.800 2.624 2.551 2.702 . 0 0 "[ . 1 . 2]" 1
1123 1 110 VAL H 1 110 VAL HA . . 2.850 2.682 2.642 2.726 . 0 0 "[ . 1 . 2]" 1
1124 1 110 VAL H 1 110 VAL HB . . 3.240 2.347 2.228 2.519 . 0 0 "[ . 1 . 2]" 1
1125 1 110 VAL H 1 110 VAL MG1 . . 4.460 2.813 2.142 3.712 . 0 0 "[ . 1 . 2]" 1
1126 1 110 VAL H 1 110 VAL QG . . 3.760 2.220 1.954 2.430 . 0 0 "[ . 1 . 2]" 1
1127 1 110 VAL H 1 110 VAL MG2 . . 4.460 3.115 1.961 3.717 . 0 0 "[ . 1 . 2]" 1
1128 1 110 VAL H 1 111 ALA H . . 2.900 2.881 2.778 2.989 0.089 16 0 "[ . 1 . 2]" 1
1129 1 110 VAL QG 1 111 ALA H . . 5.580 2.600 2.010 3.484 . 0 0 "[ . 1 . 2]" 1
1130 1 110 VAL QG 1 112 TRP H . . 6.530 4.394 4.205 4.651 . 0 0 "[ . 1 . 2]" 1
1131 1 110 VAL QG 1 113 ARG H . . 5.580 3.614 3.440 4.119 . 0 0 "[ . 1 . 2]" 1
1132 1 111 ALA H 1 111 ALA HA . . 2.770 2.705 2.672 2.732 . 0 0 "[ . 1 . 2]" 1
1133 1 111 ALA H 1 111 ALA MB . . 3.430 2.015 1.940 2.171 . 0 0 "[ . 1 . 2]" 1
1134 1 111 ALA H 1 112 TRP H . . 3.420 2.962 2.827 3.071 . 0 0 "[ . 1 . 2]" 1
1135 1 111 ALA H 1 113 ARG H . . 4.680 4.102 3.905 4.620 . 0 0 "[ . 1 . 2]" 1
1136 1 111 ALA HA 1 112 TRP H . . 3.580 3.627 3.603 3.639 0.059 16 0 "[ . 1 . 2]" 1
1137 1 111 ALA HA 1 115 HIS H . . 5.500 5.312 5.053 5.509 0.009 9 0 "[ . 1 . 2]" 1
1138 1 111 ALA MB 1 112 TRP H . . 4.080 2.520 2.374 2.645 . 0 0 "[ . 1 . 2]" 1
1139 1 111 ALA MB 1 113 ARG H . . 6.060 4.375 4.193 4.725 . 0 0 "[ . 1 . 2]" 1
1140 1 111 ALA MB 1 114 ALA H . . 6.060 4.273 4.183 4.374 . 0 0 "[ . 1 . 2]" 1
1141 1 112 TRP H 1 112 TRP HA . . 2.850 2.768 2.721 2.811 . 0 0 "[ . 1 . 2]" 1
1142 1 112 TRP H 1 112 TRP HB2 . . 3.520 3.021 2.581 3.167 . 0 0 "[ . 1 . 2]" 1
1143 1 112 TRP H 1 112 TRP HB3 . . 3.520 2.060 2.006 2.349 . 0 0 "[ . 1 . 2]" 1
1144 1 112 TRP H 1 113 ARG H . . 2.740 2.698 2.524 2.994 0.254 14 0 "[ . 1 . 2]" 1
1145 1 112 TRP H 1 114 ALA H . . 4.760 3.881 3.722 4.039 . 0 0 "[ . 1 . 2]" 1
1146 1 112 TRP QB 1 113 ARG H . . 4.300 3.030 2.394 3.279 . 0 0 "[ . 1 . 2]" 1
1147 1 112 TRP HE1 1 117 GLN H . . 5.500 4.569 2.953 5.682 0.182 11 0 "[ . 1 . 2]" 1
1148 1 112 TRP O 1 116 CYS H . . 1.800 1.695 1.581 1.805 0.005 20 0 "[ . 1 . 2]" 1
1149 1 112 TRP O 1 116 CYS N . . 2.800 2.625 2.523 2.749 . 0 0 "[ . 1 . 2]" 1
1150 1 113 ARG H 1 113 ARG HA . . 2.770 2.764 2.667 2.820 0.050 11 0 "[ . 1 . 2]" 1
1151 1 113 ARG H 1 113 ARG HB2 . . 2.710 2.261 2.242 2.292 . 0 0 "[ . 1 . 2]" 1
1152 1 113 ARG H 1 113 ARG QB . . 2.410 2.158 2.145 2.180 . 0 0 "[ . 1 . 2]" 1
1153 1 113 ARG H 1 113 ARG HB3 . . 2.710 2.731 2.678 2.758 0.048 15 0 "[ . 1 . 2]" 1
1154 1 113 ARG H 1 113 ARG QG . . 4.300 3.865 3.843 3.884 . 0 0 "[ . 1 . 2]" 1
1155 1 113 ARG H 1 114 ALA H . . 2.960 2.642 2.498 2.842 . 0 0 "[ . 1 . 2]" 1
1156 1 113 ARG HA 1 115 HIS H . . 5.440 3.889 3.748 4.055 . 0 0 "[ . 1 . 2]" 1
1157 1 113 ARG HA 1 116 CYS H . . 4.540 4.211 4.058 4.516 . 0 0 "[ . 1 . 2]" 1
1158 1 113 ARG HA 1 117 GLN H . . 4.070 3.120 2.870 3.404 . 0 0 "[ . 1 . 2]" 1
1159 1 113 ARG QB 1 114 ALA H . . 3.560 3.168 3.057 3.312 . 0 0 "[ . 1 . 2]" 1
1160 1 113 ARG QG 1 114 ALA H . . 6.380 4.450 4.198 4.717 . 0 0 "[ . 1 . 2]" 1
1161 1 114 ALA H 1 114 ALA MB . . 3.430 2.431 2.354 2.509 . 0 0 "[ . 1 . 2]" 1
1162 1 114 ALA H 1 115 HIS H . . 2.460 2.490 2.406 2.549 0.089 20 0 "[ . 1 . 2]" 1
1163 1 114 ALA HA 1 115 HIS H . . 3.300 2.945 2.885 2.980 . 0 0 "[ . 1 . 2]" 1
1164 1 114 ALA HA 1 116 CYS H . . 5.500 4.816 4.690 5.001 . 0 0 "[ . 1 . 2]" 1
1165 1 115 HIS H 1 115 HIS HA . . 2.770 2.880 2.871 2.892 0.122 17 0 "[ . 1 . 2]" 1
1166 1 115 HIS H 1 115 HIS HB2 . . 3.360 2.952 2.813 3.139 . 0 0 "[ . 1 . 2]" 1
1167 1 115 HIS H 1 115 HIS QB . . 3.180 2.747 2.685 2.785 . 0 0 "[ . 1 . 2]" 1
1168 1 115 HIS H 1 115 HIS HB3 . . 3.360 3.298 3.086 3.398 0.038 17 0 "[ . 1 . 2]" 1
1169 1 115 HIS H 1 116 CYS H . . 2.400 1.926 1.825 2.110 . 0 0 "[ . 1 . 2]" 1
1170 1 115 HIS H 1 117 GLN H . . 4.450 2.950 2.743 3.215 . 0 0 "[ . 1 . 2]" 1
1171 1 115 HIS QB 1 116 CYS H . . 3.120 2.614 2.356 2.746 . 0 0 "[ . 1 . 2]" 1
1172 1 115 HIS QB 1 117 GLN H . . 6.380 4.690 4.458 4.939 . 0 0 "[ . 1 . 2]" 1
1173 1 115 HIS HB2 1 116 CYS H . . 3.330 3.380 3.221 3.578 0.248 16 0 "[ . 1 . 2]" 1
1174 1 115 HIS HB3 1 116 CYS H . . 3.330 2.735 2.391 2.926 . 0 0 "[ . 1 . 2]" 1
1175 1 116 CYS H 1 116 CYS HA . . 2.740 2.886 2.882 2.888 0.148 3 0 "[ . 1 . 2]" 1
1176 1 116 CYS H 1 116 CYS HB2 . . 3.430 2.152 2.129 2.264 . 0 0 "[ . 1 . 2]" 1
1177 1 116 CYS H 1 116 CYS QB . . 3.020 2.122 2.103 2.238 . 0 0 "[ . 1 . 2]" 1
1178 1 116 CYS H 1 116 CYS HB3 . . 3.430 3.246 3.169 3.523 0.093 10 0 "[ . 1 . 2]" 1
1179 1 116 CYS H 1 117 GLN H . . 2.400 2.378 2.293 2.514 0.114 10 0 "[ . 1 . 2]" 1
1180 1 116 CYS H 1 117 GLN QB . . 5.880 4.058 3.922 4.254 . 0 0 "[ . 1 . 2]" 1
1181 1 116 CYS HA 1 117 GLN H . . 3.580 3.640 3.626 3.649 0.069 10 0 "[ . 1 . 2]" 1
1182 1 116 CYS QB 1 117 GLN H . . 2.710 2.537 2.295 2.673 . 0 0 "[ . 1 . 2]" 1
1183 1 116 CYS HB2 1 117 GLN H . . 2.960 2.934 2.374 3.057 0.097 20 0 "[ . 1 . 2]" 1
1184 1 116 CYS HB3 1 117 GLN H . . 2.960 2.803 2.654 3.042 0.082 10 0 "[ . 1 . 2]" 1
1185 1 117 GLN H 1 117 GLN HB2 . . 3.240 2.094 2.037 2.312 . 0 0 "[ . 1 . 2]" 1
1186 1 117 GLN H 1 117 GLN HB3 . . 3.240 3.150 2.647 3.334 0.094 11 0 "[ . 1 . 2]" 1
1187 1 117 GLN H 1 117 GLN QG . . 5.110 3.507 3.161 4.002 . 0 0 "[ . 1 . 2]" 1
1188 1 117 GLN H 1 118 ASN H . . 3.580 3.381 2.654 3.769 0.189 19 0 "[ . 1 . 2]" 1
1189 1 117 GLN HA 1 119 ARG H . . 4.970 4.701 4.338 4.996 0.026 6 0 "[ . 1 . 2]" 1
1190 1 117 GLN HB2 1 118 ASN H . . 4.540 4.438 3.844 4.657 0.117 19 0 "[ . 1 . 2]" 1
1191 1 117 GLN HB3 1 118 ASN H . . 4.540 4.057 2.914 4.395 . 0 0 "[ . 1 . 2]" 1
1192 1 117 GLN QG 1 118 ASN H . . 6.380 4.461 3.993 4.702 . 0 0 "[ . 1 . 2]" 1
1193 1 118 ASN H 1 118 ASN HB2 . . 3.140 2.744 2.042 3.116 . 0 0 "[ . 1 . 2]" 1
1194 1 118 ASN H 1 118 ASN QB . . 2.940 2.520 2.015 2.791 . 0 0 "[ . 1 . 2]" 1
1195 1 118 ASN H 1 118 ASN HB3 . . 3.140 3.004 2.654 3.153 0.013 19 0 "[ . 1 . 2]" 1
1196 1 118 ASN H 1 119 ARG H . . 3.790 2.381 1.867 3.019 . 0 0 "[ . 1 . 2]" 1
1197 1 118 ASN QB 1 119 ARG H . . 3.180 2.131 1.910 2.485 . 0 0 "[ . 1 . 2]" 1
1198 1 118 ASN HB2 1 119 ARG H . . 3.480 3.305 2.925 3.494 0.014 11 0 "[ . 1 . 2]" 1
1199 1 118 ASN HB3 1 119 ARG H . . 3.480 2.161 1.921 2.545 . 0 0 "[ . 1 . 2]" 1
1200 1 119 ARG H 1 119 ARG HA . . 2.830 2.908 2.898 2.913 0.083 7 0 "[ . 1 . 2]" 1
1201 1 119 ARG H 1 119 ARG HB2 . . 2.930 2.766 2.605 2.879 . 0 0 "[ . 1 . 2]" 1
1202 1 119 ARG H 1 119 ARG QB . . 2.730 2.547 2.453 2.628 . 0 0 "[ . 1 . 2]" 1
1203 1 119 ARG H 1 119 ARG HB3 . . 2.930 2.984 2.945 3.037 0.107 18 0 "[ . 1 . 2]" 1
1204 1 119 ARG H 1 120 ASP H . . 4.660 4.337 4.222 4.368 . 0 0 "[ . 1 . 2]" 1
1205 1 119 ARG H 1 121 LEU H . . 4.910 4.941 4.780 5.042 0.132 14 0 "[ . 1 . 2]" 1
1206 1 119 ARG HA 1 120 ASP H . . 2.980 2.836 2.805 2.973 . 0 0 "[ . 1 . 2]" 1
1207 1 119 ARG QB 1 120 ASP H . . 3.010 2.467 2.205 2.523 . 0 0 "[ . 1 . 2]" 1
1208 1 119 ARG HB2 1 120 ASP H . . 3.730 3.654 3.496 3.695 . 0 0 "[ . 1 . 2]" 1
1209 1 119 ARG HB3 1 120 ASP H . . 3.730 2.508 2.229 2.569 . 0 0 "[ . 1 . 2]" 1
1210 1 119 ARG QG 1 120 ASP H . . 4.830 1.908 1.844 1.991 . 0 0 "[ . 1 . 2]" 1
1211 1 120 ASP H 1 120 ASP HB2 . . 2.550 2.537 2.459 2.580 0.030 5 0 "[ . 1 . 2]" 1
1212 1 120 ASP H 1 120 ASP QB . . 2.320 2.260 2.203 2.296 . 0 0 "[ . 1 . 2]" 1
1213 1 120 ASP H 1 120 ASP HB3 . . 2.550 2.538 2.467 2.579 0.029 11 0 "[ . 1 . 2]" 1
1214 1 120 ASP H 1 121 LEU H . . 5.500 4.249 4.193 4.346 . 0 0 "[ . 1 . 2]" 1
1215 1 120 ASP HA 1 121 LEU H . . 3.330 2.285 2.270 2.303 . 0 0 "[ . 1 . 2]" 1
1216 1 120 ASP HA 1 122 SER H . . 3.580 3.284 3.213 3.368 . 0 0 "[ . 1 . 2]" 1
1217 1 120 ASP HA 1 123 GLN H . . 5.440 5.235 4.987 5.463 0.023 15 0 "[ . 1 . 2]" 1
1218 1 120 ASP HB2 1 121 LEU H . . 5.250 4.620 4.576 4.644 . 0 0 "[ . 1 . 2]" 1
1219 1 120 ASP HB3 1 121 LEU H . . 5.250 4.401 4.363 4.445 . 0 0 "[ . 1 . 2]" 1
1220 1 121 LEU H 1 121 LEU HA . . 2.800 2.917 2.900 2.929 0.129 20 0 "[ . 1 . 2]" 1
1221 1 121 LEU H 1 121 LEU HB2 . . 2.590 2.551 2.435 2.641 0.051 16 0 "[ . 1 . 2]" 1
1222 1 121 LEU H 1 121 LEU HB3 . . 2.590 2.646 2.600 2.677 0.087 1 0 "[ . 1 . 2]" 1
1223 1 121 LEU H 1 121 LEU QD . . 5.120 3.713 3.630 3.783 . 0 0 "[ . 1 . 2]" 1
1224 1 121 LEU H 1 122 SER H . . 2.520 2.576 2.530 2.617 0.097 3 0 "[ . 1 . 2]" 1
1225 1 121 LEU HA 1 122 SER H . . 3.210 3.123 3.055 3.202 . 0 0 "[ . 1 . 2]" 1
1226 1 121 LEU HA 1 123 GLN H . . 3.510 3.346 3.108 3.523 0.013 7 0 "[ . 1 . 2]" 1
1227 1 121 LEU HA 1 124 TYR H . . 3.670 3.578 3.441 3.677 0.007 18 0 "[ . 1 . 2]" 1
1228 1 121 LEU QB 1 122 SER H . . 4.770 3.727 3.635 3.798 . 0 0 "[ . 1 . 2]" 1
1229 1 121 LEU QD 1 123 GLN H . . 7.510 4.367 3.822 4.860 . 0 0 "[ . 1 . 2]" 1
1230 1 121 LEU QD 1 124 TYR QD . . 5.120 2.509 2.019 2.913 . 0 0 "[ . 1 . 2]" 1
1231 1 122 SER H 1 122 SER HA . . 2.800 2.823 2.798 2.851 0.051 6 0 "[ . 1 . 2]" 1
1232 1 122 SER H 1 123 GLN H . . 2.400 2.453 2.363 2.548 0.148 15 0 "[ . 1 . 2]" 1
1233 1 122 SER HA 1 125 ILE H . . 4.380 3.417 3.172 3.682 . 0 0 "[ . 1 . 2]" 1
1234 1 123 GLN H 1 123 GLN HA . . 2.770 2.809 2.772 2.841 0.071 14 0 "[ . 1 . 2]" 1
1235 1 123 GLN H 1 123 GLN HB2 . . 2.430 2.481 2.440 2.513 0.083 14 0 "[ . 1 . 2]" 1
1236 1 123 GLN H 1 123 GLN HB3 . . 2.430 2.507 2.473 2.560 0.130 15 0 "[ . 1 . 2]" 1
1237 1 123 GLN H 1 123 GLN QG . . 4.800 3.966 3.932 4.019 . 0 0 "[ . 1 . 2]" 1
1238 1 123 GLN H 1 124 TYR H . . 2.620 2.564 2.453 2.667 0.047 18 0 "[ . 1 . 2]" 1
1239 1 123 GLN H 1 124 TYR QD . . 6.650 5.468 5.318 5.679 . 0 0 "[ . 1 . 2]" 1
1240 1 123 GLN H 1 125 ILE H . . 5.410 4.341 4.208 4.441 . 0 0 "[ . 1 . 2]" 1
1241 1 123 GLN HA 1 126 ARG H . . 3.890 3.125 2.864 3.384 . 0 0 "[ . 1 . 2]" 1
1242 1 123 GLN QB 1 124 TYR H . . 3.740 3.264 3.181 3.333 . 0 0 "[ . 1 . 2]" 1
1243 1 124 TYR H 1 124 TYR HA . . 2.740 2.860 2.849 2.876 0.136 14 0 "[ . 1 . 2]" 1
1244 1 124 TYR H 1 124 TYR HB2 . . 2.800 1.974 1.946 2.043 . 0 0 "[ . 1 . 2]" 1
1245 1 124 TYR H 1 124 TYR QB . . 2.460 1.936 1.914 1.983 . 0 0 "[ . 1 . 2]" 1
1246 1 124 TYR H 1 124 TYR HB3 . . 2.800 2.797 2.678 2.834 0.034 12 0 "[ . 1 . 2]" 1
1247 1 124 TYR H 1 124 TYR QE . . 7.480 5.938 5.889 6.038 . 0 0 "[ . 1 . 2]" 1
1248 1 124 TYR H 1 125 ILE H . . 2.400 2.447 2.404 2.486 0.086 4 0 "[ . 1 . 2]" 1
1249 1 124 TYR H 1 125 ILE MD . . 6.530 5.304 5.008 5.529 . 0 0 "[ . 1 . 2]" 1
1250 1 124 TYR H 1 125 ILE QG . . 6.380 3.675 3.433 3.875 . 0 0 "[ . 1 . 2]" 1
1251 1 124 TYR H 1 126 ARG H . . 4.600 3.702 3.598 3.886 . 0 0 "[ . 1 . 2]" 1
1252 1 124 TYR QB 1 125 ILE H . . 3.590 2.712 2.565 2.856 . 0 0 "[ . 1 . 2]" 1
1253 1 125 ILE H 1 125 ILE HA . . 2.930 2.916 2.899 2.938 0.008 16 0 "[ . 1 . 2]" 1
1254 1 125 ILE H 1 125 ILE HB . . 3.730 3.605 3.546 3.716 . 0 0 "[ . 1 . 2]" 1
1255 1 125 ILE H 1 125 ILE MD . . 5.600 3.723 3.601 3.830 . 0 0 "[ . 1 . 2]" 1
1256 1 125 ILE H 1 125 ILE HG12 . . 4.330 2.382 1.947 3.091 . 0 0 "[ . 1 . 2]" 1
1257 1 125 ILE H 1 125 ILE HG13 . . 4.330 2.245 1.968 2.534 . 0 0 "[ . 1 . 2]" 1
1258 1 125 ILE H 1 125 ILE MG . . 4.330 2.729 2.510 2.985 . 0 0 "[ . 1 . 2]" 1
1259 1 125 ILE H 1 126 ARG H . . 2.400 2.115 1.891 2.254 . 0 0 "[ . 1 . 2]" 1
1260 1 125 ILE HA 1 126 ARG H . . 3.580 3.565 3.526 3.604 0.024 19 0 "[ . 1 . 2]" 1
1261 1 125 ILE HB 1 126 ARG H . . 4.170 3.869 3.547 4.071 . 0 0 "[ . 1 . 2]" 1
1262 1 125 ILE MD 1 126 ARG H . . 4.450 3.642 3.245 3.789 . 0 0 "[ . 1 . 2]" 1
1263 1 125 ILE QG 1 126 ARG H . . 3.300 1.995 1.932 2.141 . 0 0 "[ . 1 . 2]" 1
1264 1 125 ILE HG12 1 126 ARG H . . 3.670 3.392 2.965 3.698 0.028 16 0 "[ . 1 . 2]" 1
1265 1 125 ILE HG13 1 126 ARG H . . 3.670 2.011 1.948 2.156 . 0 0 "[ . 1 . 2]" 1
1266 1 126 ARG H 1 126 ARG HA . . 2.830 2.806 2.746 2.846 0.016 11 0 "[ . 1 . 2]" 1
1267 1 126 ARG H 1 126 ARG HB2 . . 2.550 2.491 2.436 2.565 0.015 11 0 "[ . 1 . 2]" 1
1268 1 126 ARG H 1 126 ARG QB . . 2.320 2.224 2.203 2.252 . 0 0 "[ . 1 . 2]" 1
1269 1 126 ARG H 1 126 ARG HB3 . . 2.550 2.506 2.423 2.572 0.022 6 0 "[ . 1 . 2]" 1
1270 1 126 ARG H 1 127 ASN H . . 4.970 4.330 2.619 4.583 . 0 0 "[ . 1 . 2]" 1
1271 1 126 ARG HA 1 127 ASN H . . 3.240 2.298 2.228 3.311 0.071 3 0 "[ . 1 . 2]" 1
1272 1 126 ARG HA 1 128 CYS H . . 3.670 3.579 3.325 3.730 0.060 5 0 "[ . 1 . 2]" 1
1273 1 126 ARG HB2 1 127 ASN H . . 4.820 4.491 4.335 4.613 . 0 0 "[ . 1 . 2]" 1
1274 1 126 ARG HB2 1 128 CYS H . . 5.900 5.896 5.602 6.102 0.202 5 0 "[ . 1 . 2]" 1
1275 1 126 ARG HB3 1 127 ASN H . . 4.820 4.344 3.611 4.511 . 0 0 "[ . 1 . 2]" 1
1276 1 126 ARG HB3 1 128 CYS H . . 5.900 5.688 5.273 5.977 0.077 5 0 "[ . 1 . 2]" 1
1277 1 127 ASN H 1 127 ASN HA . . 2.730 2.481 2.178 2.854 0.124 3 0 "[ . 1 . 2]" 1
1278 1 127 ASN H 1 127 ASN HB2 . . 3.730 3.311 3.243 3.620 . 0 0 "[ . 1 . 2]" 1
1279 1 127 ASN H 1 127 ASN QB . . 3.530 3.076 2.708 3.132 . 0 0 "[ . 1 . 2]" 1
1280 1 127 ASN H 1 127 ASN HB3 . . 3.730 3.737 2.807 3.841 0.111 11 0 "[ . 1 . 2]" 1
1281 1 127 ASN H 1 128 CYS H . . 2.490 2.079 1.769 2.467 . 0 0 "[ . 1 . 2]" 1
1282 1 127 ASN HA 1 129 GLY H . . 3.830 3.792 3.493 3.894 0.064 10 0 "[ . 1 . 2]" 1
1283 1 127 ASN QB 1 128 CYS H . . 4.150 3.313 2.836 3.822 . 0 0 "[ . 1 . 2]" 1
1284 1 128 CYS H 1 128 CYS HA . . 2.860 2.854 2.825 2.910 0.050 15 0 "[ . 1 . 2]" 1
1285 1 128 CYS H 1 128 CYS HB2 . . 2.920 2.190 2.114 2.385 . 0 0 "[ . 1 . 2]" 1
1286 1 128 CYS H 1 128 CYS QB . . 2.650 2.132 2.073 2.277 . 0 0 "[ . 1 . 2]" 1
1287 1 128 CYS H 1 128 CYS HB3 . . 2.920 2.955 2.839 2.995 0.075 9 0 "[ . 1 . 2]" 1
1288 1 128 CYS H 1 129 GLY H . . 2.400 2.324 2.043 2.437 0.037 17 0 "[ . 1 . 2]" 1
1289 1 128 CYS H 1 129 GLY QA . . 5.820 4.283 4.032 4.377 . 0 0 "[ . 1 . 2]" 1
1290 1 128 CYS H 1 130 VAL H . . 3.640 3.610 3.419 3.665 0.025 3 0 "[ . 1 . 2]" 1
1291 1 128 CYS HA 1 129 GLY H . . 3.640 3.539 3.518 3.584 . 0 0 "[ . 1 . 2]" 1
1292 1 128 CYS QB 1 129 GLY H . . 3.360 2.990 2.824 3.071 . 0 0 "[ . 1 . 2]" 1
1293 1 128 CYS QB 1 130 VAL H . . 4.080 3.431 3.197 3.614 . 0 0 "[ . 1 . 2]" 1
1294 1 128 CYS HB2 1 129 GLY H . . 3.670 3.669 3.571 3.709 0.039 10 0 "[ . 1 . 2]" 1
1295 1 128 CYS HB2 1 130 VAL H . . 4.540 4.438 4.238 4.569 0.029 15 0 "[ . 1 . 2]" 1
1296 1 128 CYS HB3 1 129 GLY H . . 3.670 3.171 2.935 3.280 . 0 0 "[ . 1 . 2]" 1
1297 1 128 CYS HB3 1 130 VAL H . . 4.540 3.572 3.304 3.799 . 0 0 "[ . 1 . 2]" 1
1298 1 129 GLY H 1 129 GLY QA . . 2.550 2.315 2.263 2.498 . 0 0 "[ . 1 . 2]" 1
1299 1 129 GLY H 1 130 VAL H . . 2.400 1.990 1.888 2.086 . 0 0 "[ . 1 . 2]" 1
1300 1 129 GLY H 1 130 VAL HB . . 3.950 3.905 3.793 3.984 0.034 12 0 "[ . 1 . 2]" 1
1301 1 129 GLY H 1 130 VAL QG . . 5.890 3.757 3.524 4.083 . 0 0 "[ . 1 . 2]" 1
1302 1 129 GLY QA 1 130 VAL H . . 3.060 2.850 2.805 2.890 . 0 0 "[ . 1 . 2]" 1
1303 1 130 VAL H 1 130 VAL HA . . 2.800 2.902 2.900 2.906 0.106 17 0 "[ . 1 . 2]" 1
1304 1 130 VAL H 1 130 VAL HB . . 3.170 2.241 2.177 2.427 . 0 0 "[ . 1 . 2]" 1
1305 1 130 VAL H 1 130 VAL MG1 . . 4.260 3.333 2.221 3.689 . 0 0 "[ . 1 . 2]" 1
1306 1 130 VAL H 1 130 VAL MG2 . . 4.260 2.990 2.509 3.741 . 0 0 "[ . 1 . 2]" 1
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