NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
399264 |
1tvj   |
5177 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1tvj
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 2532
_Distance_constraint_stats_list.Viol_count 5968
_Distance_constraint_stats_list.Viol_total 7476.037
_Distance_constraint_stats_list.Viol_max 0.613
_Distance_constraint_stats_list.Viol_rms 0.0260
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0074
_Distance_constraint_stats_list.Viol_average_violations_only 0.0626
_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 4 GLY 1.910 0.613 7 2 "[ - + 1 . 2]"
1 5 VAL 9.108 0.613 7 2 "[ - + 1 . 2]"
1 6 THR 5.532 0.102 11 0 "[ . 1 . 2]"
1 7 VAL 5.361 0.164 16 0 "[ . 1 . 2]"
1 8 ASN 2.186 0.164 16 0 "[ . 1 . 2]"
1 9 ASP 1.175 0.074 10 0 "[ . 1 . 2]"
1 10 GLU 3.762 0.106 13 0 "[ . 1 . 2]"
1 11 VAL 1.793 0.095 16 0 "[ . 1 . 2]"
1 12 ILE 9.911 0.149 9 0 "[ . 1 . 2]"
1 13 LYS 1.289 0.090 19 0 "[ . 1 . 2]"
1 14 VAL 6.589 0.141 11 0 "[ . 1 . 2]"
1 15 PHE 4.038 0.131 3 0 "[ . 1 . 2]"
1 16 ASN 4.491 0.090 19 0 "[ . 1 . 2]"
1 17 ASP 6.802 0.094 20 0 "[ . 1 . 2]"
1 18 MET 7.332 0.169 10 0 "[ . 1 . 2]"
1 19 LYS 3.653 0.094 20 0 "[ . 1 . 2]"
1 20 VAL 7.765 0.169 10 0 "[ . 1 . 2]"
1 21 ARG 3.189 0.124 20 0 "[ . 1 . 2]"
1 22 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 SER 0.511 0.107 6 0 "[ . 1 . 2]"
1 24 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 THR 4.066 0.125 4 0 "[ . 1 . 2]"
1 26 PRO 1.495 0.065 9 0 "[ . 1 . 2]"
1 27 GLU 2.046 0.098 16 0 "[ . 1 . 2]"
1 28 GLU 1.784 0.066 1 0 "[ . 1 . 2]"
1 29 ILE 3.948 0.107 6 0 "[ . 1 . 2]"
1 30 LYS 5.312 0.162 4 0 "[ . 1 . 2]"
1 31 LYS 7.220 0.128 11 0 "[ . 1 . 2]"
1 32 ARG 11.173 0.227 9 0 "[ . 1 . 2]"
1 33 LYS 0.581 0.032 9 0 "[ . 1 . 2]"
1 34 LYS 0.250 0.031 20 0 "[ . 1 . 2]"
1 35 ALA 7.014 0.198 16 0 "[ . 1 . 2]"
1 36 VAL 7.293 0.190 11 0 "[ . 1 . 2]"
1 37 LEU 8.729 0.153 14 0 "[ . 1 . 2]"
1 38 PHE 6.264 0.176 4 0 "[ . 1 . 2]"
1 39 CYS 6.088 0.171 14 0 "[ . 1 . 2]"
1 40 LEU 6.260 0.150 14 0 "[ . 1 . 2]"
1 41 SER 5.869 0.167 5 0 "[ . 1 . 2]"
1 42 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 ASP 6.505 0.167 5 0 "[ . 1 . 2]"
1 44 LYS 10.939 0.201 11 0 "[ . 1 . 2]"
1 45 LYS 0.359 0.036 14 0 "[ . 1 . 2]"
1 46 GLN 4.417 0.169 19 0 "[ . 1 . 2]"
1 47 ILE 4.377 0.104 3 0 "[ . 1 . 2]"
1 48 ILE 5.512 0.137 20 0 "[ . 1 . 2]"
1 49 VAL 5.196 0.171 14 0 "[ . 1 . 2]"
1 50 GLU 2.472 0.140 14 0 "[ . 1 . 2]"
1 51 GLU 2.411 0.140 14 0 "[ . 1 . 2]"
1 52 ALA 1.362 0.076 2 0 "[ . 1 . 2]"
1 53 LYS 4.877 0.153 14 0 "[ . 1 . 2]"
1 54 GLN 2.729 0.119 14 0 "[ . 1 . 2]"
1 55 ILE 6.014 0.198 16 0 "[ . 1 . 2]"
1 56 LEU 2.772 0.059 5 0 "[ . 1 . 2]"
1 57 VAL 1.778 0.091 1 0 "[ . 1 . 2]"
1 58 GLY 0.673 0.059 5 0 "[ . 1 . 2]"
1 59 ASP 0.916 0.052 2 0 "[ . 1 . 2]"
1 60 ILE 3.045 0.091 1 0 "[ . 1 . 2]"
1 61 GLY 1.366 0.071 4 0 "[ . 1 . 2]"
1 62 ASP 0.639 0.052 2 0 "[ . 1 . 2]"
1 63 THR 6.003 0.201 10 0 "[ . 1 . 2]"
1 64 VAL 6.263 0.201 10 0 "[ . 1 . 2]"
1 65 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 ASP 0.516 0.037 2 0 "[ . 1 . 2]"
1 67 PRO 0.336 0.034 11 0 "[ . 1 . 2]"
1 68 TYR 1.642 0.066 2 0 "[ . 1 . 2]"
1 69 THR 9.230 0.138 19 0 "[ . 1 . 2]"
1 70 ALA 2.081 0.076 6 0 "[ . 1 . 2]"
1 71 PHE 2.498 0.112 5 0 "[ . 1 . 2]"
1 72 VAL 2.530 0.098 15 0 "[ . 1 . 2]"
1 73 LYS 1.863 0.070 5 0 "[ . 1 . 2]"
1 74 LEU 5.073 0.123 7 0 "[ . 1 . 2]"
1 75 LEU 3.198 0.113 14 0 "[ . 1 . 2]"
1 76 PRO 3.743 0.122 15 0 "[ . 1 . 2]"
1 77 LEU 8.089 0.173 7 0 "[ . 1 . 2]"
1 78 ASN 6.989 0.207 4 0 "[ . 1 . 2]"
1 79 ASP 2.288 0.101 3 0 "[ . 1 . 2]"
1 80 CYS 1.886 0.105 15 0 "[ . 1 . 2]"
1 81 ARG 1.995 0.105 15 0 "[ . 1 . 2]"
1 82 TYR 5.163 0.205 11 0 "[ . 1 . 2]"
1 83 ALA 10.391 0.205 11 0 "[ . 1 . 2]"
1 84 LEU 4.193 0.150 8 0 "[ . 1 . 2]"
1 85 TYR 2.967 0.129 11 0 "[ . 1 . 2]"
1 86 ASP 4.358 0.129 11 0 "[ . 1 . 2]"
1 87 ALA 2.749 0.177 2 0 "[ . 1 . 2]"
1 88 THR 5.298 0.157 8 0 "[ . 1 . 2]"
1 89 TYR 7.605 0.157 8 0 "[ . 1 . 2]"
1 90 GLU 3.798 0.122 6 0 "[ . 1 . 2]"
1 91 THR 2.790 0.155 16 0 "[ . 1 . 2]"
1 92 LYS 0.186 0.038 10 0 "[ . 1 . 2]"
1 93 GLU 2.637 0.098 13 0 "[ . 1 . 2]"
1 94 SER 4.238 0.098 13 0 "[ . 1 . 2]"
1 95 LYS 3.146 0.186 16 0 "[ . 1 . 2]"
1 96 LYS 5.061 0.155 16 0 "[ . 1 . 2]"
1 97 GLU 4.164 0.140 12 0 "[ . 1 . 2]"
1 98 ASP 7.626 0.131 15 0 "[ . 1 . 2]"
1 99 LEU 7.326 0.180 16 0 "[ . 1 . 2]"
1 100 VAL 11.995 0.293 10 0 "[ . 1 . 2]"
1 101 PHE 2.000 0.101 9 0 "[ . 1 . 2]"
1 102 ILE 6.068 0.152 11 0 "[ . 1 . 2]"
1 103 PHE 1.332 0.081 4 0 "[ . 1 . 2]"
1 104 TRP 7.039 0.145 8 0 "[ . 1 . 2]"
1 105 ALA 3.131 0.142 8 0 "[ . 1 . 2]"
1 106 PRO 6.797 0.126 11 0 "[ . 1 . 2]"
1 107 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 SER 9.504 0.138 15 0 "[ . 1 . 2]"
1 109 ALA 5.495 0.138 15 0 "[ . 1 . 2]"
1 110 PRO 0.125 0.019 7 0 "[ . 1 . 2]"
1 111 LEU 0.880 0.058 3 0 "[ . 1 . 2]"
1 112 LYS 3.773 0.110 3 0 "[ . 1 . 2]"
1 113 SER 2.811 0.110 3 0 "[ . 1 . 2]"
1 114 LYS 5.842 0.158 14 0 "[ . 1 . 2]"
1 115 MET 4.019 0.106 15 0 "[ . 1 . 2]"
1 116 ILE 6.813 0.182 14 0 "[ . 1 . 2]"
1 117 TYR 7.455 0.182 14 0 "[ . 1 . 2]"
1 118 ALA 2.356 0.077 10 0 "[ . 1 . 2]"
1 119 SER 6.434 0.160 4 0 "[ . 1 . 2]"
1 120 SER 2.294 0.146 10 0 "[ . 1 . 2]"
1 121 LYS 8.757 0.165 3 0 "[ . 1 . 2]"
1 122 ASP 9.795 0.186 16 0 "[ . 1 . 2]"
1 123 ALA 3.528 0.133 7 0 "[ . 1 . 2]"
1 124 ILE 2.339 0.076 2 0 "[ . 1 . 2]"
1 125 LYS 6.332 0.162 9 0 "[ . 1 . 2]"
1 126 LYS 8.890 0.186 16 0 "[ . 1 . 2]"
1 127 LYS 0.880 0.057 12 0 "[ . 1 . 2]"
1 128 PHE 8.557 0.162 9 0 "[ . 1 . 2]"
1 129 THR 0.505 0.041 7 0 "[ . 1 . 2]"
1 130 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 131 ILE 2.861 0.088 20 0 "[ . 1 . 2]"
1 132 LYS 0.032 0.009 12 0 "[ . 1 . 2]"
1 133 HIS 4.246 0.086 2 0 "[ . 1 . 2]"
1 134 GLU 1.429 0.086 2 0 "[ . 1 . 2]"
1 135 TRP 7.716 0.114 12 0 "[ . 1 . 2]"
1 136 GLN 2.177 0.114 12 0 "[ . 1 . 2]"
1 137 VAL 10.741 0.192 11 0 "[ . 1 . 2]"
1 138 ASN 3.017 0.126 11 0 "[ . 1 . 2]"
1 139 GLY 2.110 0.118 12 0 "[ . 1 . 2]"
1 140 LEU 4.238 0.130 16 0 "[ . 1 . 2]"
1 141 ASP 5.370 0.130 16 0 "[ . 1 . 2]"
1 142 ASP 7.083 0.192 11 0 "[ . 1 . 2]"
1 143 ILE 2.650 0.143 16 0 "[ . 1 . 2]"
1 144 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 145 ASP 8.040 0.224 13 0 "[ . 1 . 2]"
1 146 ARG 0.461 0.037 14 0 "[ . 1 . 2]"
1 147 SER 0.859 0.053 12 0 "[ . 1 . 2]"
1 148 THR 3.772 0.140 4 0 "[ . 1 . 2]"
1 149 LEU 5.517 0.146 11 0 "[ . 1 . 2]"
1 150 GLY 3.863 0.111 9 0 "[ . 1 . 2]"
1 151 GLU 0.970 0.063 7 0 "[ . 1 . 2]"
1 152 LYS 0.274 0.048 12 0 "[ . 1 . 2]"
1 153 LEU 11.855 0.293 10 0 "[ . 1 . 2]"
1 154 GLY 4.093 0.292 2 0 "[ . 1 . 2]"
1 155 GLY 0.830 0.072 3 0 "[ . 1 . 2]"
1 156 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 157 VAL 4.400 0.093 2 0 "[ . 1 . 2]"
1 158 VAL 3.061 0.093 2 0 "[ . 1 . 2]"
1 159 VAL 3.502 0.133 20 0 "[ . 1 . 2]"
1 160 SER 5.273 0.222 1 0 "[ . 1 . 2]"
1 161 LEU 3.375 0.069 20 0 "[ . 1 . 2]"
1 162 GLU 1.515 0.109 7 0 "[ . 1 . 2]"
1 163 GLY 2.088 0.092 6 0 "[ . 1 . 2]"
1 164 LYS 2.276 0.092 6 0 "[ . 1 . 2]"
1 165 PRO 1.209 0.062 7 0 "[ . 1 . 2]"
1 166 LEU 2.353 0.098 5 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 4 GLY HA3 1 5 VAL H 2.270 . 2.740 2.682 2.381 3.353 0.613 7 2 "[ - + 1 . 2]" 1
2 1 4 GLY HA3 1 5 VAL MG2 3.575 . 5.350 4.217 3.999 4.353 . 0 0 "[ . 1 . 2]" 1
3 1 4 GLY HA2 1 5 VAL H 2.270 . 2.740 2.490 2.137 2.755 0.015 6 0 "[ . 1 . 2]" 1
4 1 4 GLY HA2 1 5 VAL MG2 3.575 . 5.350 3.380 3.270 3.686 . 0 0 "[ . 1 . 2]" 1
5 1 4 GLY QA 1 5 VAL MG2 3.505 . 5.210 3.247 3.177 3.493 . 0 0 "[ . 1 . 2]" 1
6 1 5 VAL H 1 5 VAL HB 2.335 . 2.870 2.683 2.552 2.777 . 0 0 "[ . 1 . 2]" 1
7 1 5 VAL H 1 5 VAL MG1 3.205 . 4.610 3.873 3.819 3.921 . 0 0 "[ . 1 . 2]" 1
8 1 5 VAL H 1 5 VAL MG2 2.970 . 4.140 2.490 2.306 2.693 . 0 0 "[ . 1 . 2]" 1
9 1 5 VAL H 1 6 THR H 3.295 . 4.790 4.511 4.463 4.554 . 0 0 "[ . 1 . 2]" 1
10 1 5 VAL H 1 119 SER HA 2.985 . 4.170 4.278 4.246 4.297 0.127 7 0 "[ . 1 . 2]" 1
11 1 5 VAL H 1 120 SER HA 2.920 . 4.040 3.879 3.706 3.969 . 0 0 "[ . 1 . 2]" 1
12 1 5 VAL HA 1 5 VAL HB 2.365 . 2.930 2.998 2.995 3.001 0.071 4 0 "[ . 1 . 2]" 1
13 1 5 VAL HA 1 46 GLN HA 2.705 . 3.610 3.716 3.687 3.779 0.169 19 0 "[ . 1 . 2]" 1
14 1 5 VAL HB 1 6 THR H 2.675 . 3.550 3.627 3.581 3.652 0.102 11 0 "[ . 1 . 2]" 1
15 1 5 VAL MG1 1 6 THR H 3.015 . 4.230 1.936 1.924 1.942 . 0 0 "[ . 1 . 2]" 1
16 1 5 VAL MG1 1 6 THR HA 3.670 . 5.540 3.713 3.571 3.758 . 0 0 "[ . 1 . 2]" 1
17 1 5 VAL MG1 1 40 LEU HA 4.165 . 6.530 4.595 4.538 4.681 . 0 0 "[ . 1 . 2]" 1
18 1 5 VAL MG1 1 46 GLN H 3.855 . 5.910 3.310 3.271 3.424 . 0 0 "[ . 1 . 2]" 1
19 1 5 VAL MG1 1 46 GLN HA 3.000 . 4.200 1.919 1.889 2.008 . 0 0 "[ . 1 . 2]" 1
20 1 5 VAL MG1 1 47 ILE H 3.775 . 5.750 3.306 3.242 3.362 . 0 0 "[ . 1 . 2]" 1
21 1 5 VAL MG1 1 120 SER HA 3.405 . 5.010 3.531 2.964 3.721 . 0 0 "[ . 1 . 2]" 1
22 1 5 VAL MG1 1 120 SER HB2 3.545 . 5.290 2.080 1.947 2.218 . 0 0 "[ . 1 . 2]" 1
23 1 5 VAL MG1 1 120 SER HB3 3.545 . 5.290 2.908 1.946 3.232 . 0 0 "[ . 1 . 2]" 1
24 1 5 VAL MG1 1 120 SER QB 3.450 . 5.100 1.997 1.785 2.181 0.015 10 0 "[ . 1 . 2]" 1
25 1 5 VAL MG2 1 6 THR H 3.280 . 4.760 3.941 3.826 3.983 . 0 0 "[ . 1 . 2]" 1
26 1 5 VAL MG2 1 46 GLN H 3.995 . 6.190 5.071 4.964 5.094 . 0 0 "[ . 1 . 2]" 1
27 1 5 VAL MG2 1 46 GLN HA 3.545 . 5.290 4.397 4.320 4.426 . 0 0 "[ . 1 . 2]" 1
28 1 5 VAL MG2 1 120 SER HA 3.435 . 5.070 4.153 3.855 4.243 . 0 0 "[ . 1 . 2]" 1
29 1 6 THR H 1 6 THR MG 3.235 . 4.670 3.888 3.866 3.911 . 0 0 "[ . 1 . 2]" 1
30 1 6 THR H 1 7 VAL H 3.075 . 4.350 4.438 4.424 4.446 0.096 14 0 "[ . 1 . 2]" 1
31 1 6 THR H 1 46 GLN HA 2.410 . 3.020 2.051 1.992 2.079 . 0 0 "[ . 1 . 2]" 1
32 1 6 THR H 1 46 GLN HB3 3.045 . 4.290 3.150 3.061 3.265 . 0 0 "[ . 1 . 2]" 1
33 1 6 THR H 1 46 GLN QG 4.095 . 6.390 4.783 4.645 4.895 . 0 0 "[ . 1 . 2]" 1
34 1 6 THR H 1 47 ILE H 2.905 . 4.010 4.001 3.920 4.027 0.017 2 0 "[ . 1 . 2]" 1
35 1 6 THR HA 1 6 THR MG 2.615 . 3.430 2.089 2.054 2.135 . 0 0 "[ . 1 . 2]" 1
36 1 6 THR HA 1 7 VAL H 2.240 . 2.680 2.487 2.472 2.497 . 0 0 "[ . 1 . 2]" 1
37 1 6 THR HA 1 7 VAL QG 4.245 . 6.690 3.720 3.644 3.826 . 0 0 "[ . 1 . 2]" 1
38 1 6 THR HA 1 46 GLN HA 3.030 . 4.260 4.346 4.311 4.360 0.100 12 0 "[ . 1 . 2]" 1
39 1 6 THR HA 1 46 GLN HB2 3.635 . 5.470 5.127 5.008 5.249 . 0 0 "[ . 1 . 2]" 1
40 1 6 THR HA 1 46 GLN HB3 3.495 . 5.190 4.917 4.821 5.001 . 0 0 "[ . 1 . 2]" 1
41 1 6 THR HB 1 7 VAL H 2.350 . 2.900 2.920 2.901 2.929 0.029 13 0 "[ . 1 . 2]" 1
42 1 6 THR HB 1 7 VAL QG 4.370 . 6.940 4.245 4.199 4.282 . 0 0 "[ . 1 . 2]" 1
43 1 6 THR HB 1 46 GLN HA 3.200 . 4.600 3.698 3.538 3.779 . 0 0 "[ . 1 . 2]" 1
44 1 6 THR HB 1 46 GLN HB2 3.465 . 5.130 3.323 3.112 3.477 . 0 0 "[ . 1 . 2]" 1
45 1 6 THR HB 1 46 GLN HB3 3.230 . 4.660 2.713 2.580 2.829 . 0 0 "[ . 1 . 2]" 1
46 1 6 THR HB 1 46 GLN QG 3.505 . 5.210 4.698 4.589 4.734 . 0 0 "[ . 1 . 2]" 1
47 1 6 THR MG 1 7 VAL H 3.125 . 4.450 2.113 2.040 2.230 . 0 0 "[ . 1 . 2]" 1
48 1 6 THR MG 1 7 VAL HA 4.115 . 6.430 4.482 4.430 4.538 . 0 0 "[ . 1 . 2]" 1
49 1 6 THR MG 1 8 ASN H 4.165 . 6.530 5.291 5.203 5.354 . 0 0 "[ . 1 . 2]" 1
50 1 6 THR MG 1 46 GLN HA 3.825 . 5.850 4.891 4.789 4.938 . 0 0 "[ . 1 . 2]" 1
51 1 7 VAL H 1 7 VAL HB 2.365 . 2.930 2.968 2.948 3.002 0.072 8 0 "[ . 1 . 2]" 1
52 1 7 VAL H 1 7 VAL MG1 2.970 . 4.140 1.942 1.882 1.973 . 0 0 "[ . 1 . 2]" 1
53 1 7 VAL H 1 8 ASN H 3.185 . 4.570 4.332 4.266 4.362 . 0 0 "[ . 1 . 2]" 1
54 1 7 VAL HA 1 8 ASN H 2.365 . 2.930 2.095 2.083 2.108 . 0 0 "[ . 1 . 2]" 1
55 1 7 VAL HA 1 11 VAL MG1 3.745 . 5.690 4.660 4.618 4.723 . 0 0 "[ . 1 . 2]" 1
56 1 7 VAL HA 1 47 ILE H 2.550 . 3.300 2.132 2.092 2.168 . 0 0 "[ . 1 . 2]" 1
57 1 7 VAL HA 1 47 ILE HB 2.225 . 2.650 2.057 2.028 2.073 . 0 0 "[ . 1 . 2]" 1
58 1 7 VAL HA 1 47 ILE MG 3.110 . 4.420 3.763 3.729 3.790 . 0 0 "[ . 1 . 2]" 1
59 1 7 VAL HA 1 124 ILE HB 3.155 . 4.510 4.190 4.068 4.383 . 0 0 "[ . 1 . 2]" 1
60 1 7 VAL HB 1 8 ASN H 2.955 . 4.110 4.216 4.186 4.274 0.164 16 0 "[ . 1 . 2]" 1
61 1 7 VAL HB 1 47 ILE H 3.090 . 4.380 4.388 4.331 4.423 0.043 7 0 "[ . 1 . 2]" 1
62 1 7 VAL HB 1 124 ILE H 3.325 . 4.850 3.100 2.925 3.204 . 0 0 "[ . 1 . 2]" 1
63 1 7 VAL HB 1 124 ILE HA 3.060 . 4.320 2.089 1.970 2.525 . 0 0 "[ . 1 . 2]" 1
64 1 7 VAL MG1 1 8 ASN H 3.390 . 4.980 4.115 4.081 4.141 . 0 0 "[ . 1 . 2]" 1
65 1 7 VAL MG1 1 124 ILE H 3.280 . 4.760 3.922 3.909 3.947 . 0 0 "[ . 1 . 2]" 1
66 1 7 VAL MG2 1 8 ASN H 3.170 . 4.540 2.753 2.608 2.876 . 0 0 "[ . 1 . 2]" 1
67 1 7 VAL MG2 1 11 VAL H 3.465 . 5.130 3.424 3.364 3.538 . 0 0 "[ . 1 . 2]" 1
68 1 7 VAL MG2 1 12 ILE H 3.575 . 5.350 4.047 3.950 4.123 . 0 0 "[ . 1 . 2]" 1
69 1 7 VAL QG 1 47 ILE HB 3.840 . 5.880 2.510 2.306 2.747 . 0 0 "[ . 1 . 2]" 1
70 1 7 VAL QG 1 47 ILE MG 4.540 . 7.280 3.008 2.829 3.228 . 0 0 "[ . 1 . 2]" 1
71 1 7 VAL QG 1 123 ALA HA 4.660 . 7.520 3.262 3.044 3.432 . 0 0 "[ . 1 . 2]" 1
72 1 7 VAL QG 1 123 ALA MB 4.665 . 7.530 2.191 1.941 2.455 . 0 0 "[ . 1 . 2]" 1
73 1 7 VAL QG 1 124 ILE HA 3.750 . 5.700 1.999 1.917 2.061 . 0 0 "[ . 1 . 2]" 1
74 1 7 VAL QG 1 127 LYS QE 4.980 . 8.160 2.868 1.798 3.623 0.002 8 0 "[ . 1 . 2]" 1
75 1 7 VAL QG 1 128 PHE QE 5.770 . 9.740 4.318 4.085 4.604 . 0 0 "[ . 1 . 2]" 1
76 1 7 VAL QG 1 128 PHE HZ 4.695 . 7.590 4.569 4.405 4.888 . 0 0 "[ . 1 . 2]" 1
77 1 8 ASN H 1 8 ASN HB2 2.485 . 3.170 2.354 2.324 2.425 . 0 0 "[ . 1 . 2]" 1
78 1 8 ASN H 1 8 ASN HB3 2.470 . 3.140 2.765 2.687 2.802 . 0 0 "[ . 1 . 2]" 1
79 1 8 ASN H 1 8 ASN QD 4.055 . 6.310 4.356 3.986 4.650 . 0 0 "[ . 1 . 2]" 1
80 1 8 ASN H 1 10 GLU H 3.435 . 5.070 5.008 4.978 5.031 . 0 0 "[ . 1 . 2]" 1
81 1 8 ASN H 1 11 VAL H 3.650 . 5.500 4.438 4.371 4.495 . 0 0 "[ . 1 . 2]" 1
82 1 8 ASN H 1 11 VAL MG2 3.515 . 5.230 2.789 2.663 2.968 . 0 0 "[ . 1 . 2]" 1
83 1 8 ASN H 1 46 GLN HB2 3.570 . 5.340 2.787 2.660 2.896 . 0 0 "[ . 1 . 2]" 1
84 1 8 ASN H 1 46 GLN QG 4.095 . 6.390 3.850 3.612 4.295 . 0 0 "[ . 1 . 2]" 1
85 1 8 ASN H 1 47 ILE H 2.610 . 3.420 2.316 2.227 2.380 . 0 0 "[ . 1 . 2]" 1
86 1 8 ASN H 1 47 ILE HB 3.030 . 4.260 2.816 2.691 2.931 . 0 0 "[ . 1 . 2]" 1
87 1 8 ASN H 1 47 ILE HG12 3.495 . 5.190 4.258 4.022 4.530 . 0 0 "[ . 1 . 2]" 1
88 1 8 ASN H 1 47 ILE HG13 3.495 . 5.190 4.991 4.786 5.194 0.004 8 0 "[ . 1 . 2]" 1
89 1 8 ASN H 1 47 ILE QG 3.370 . 4.940 4.032 3.825 4.263 . 0 0 "[ . 1 . 2]" 1
90 1 8 ASN HA 1 8 ASN HB2 2.285 . 2.770 2.576 2.532 2.599 . 0 0 "[ . 1 . 2]" 1
91 1 8 ASN HA 1 8 ASN HD21 3.650 . 5.500 3.336 1.995 4.353 . 0 0 "[ . 1 . 2]" 1
92 1 8 ASN HA 1 8 ASN HD22 3.650 . 5.500 4.030 3.386 4.545 . 0 0 "[ . 1 . 2]" 1
93 1 8 ASN HA 1 9 ASP H 2.335 . 2.870 2.222 2.217 2.229 . 0 0 "[ . 1 . 2]" 1
94 1 8 ASN HA 1 10 GLU H 2.935 . 4.070 3.967 3.936 4.045 . 0 0 "[ . 1 . 2]" 1
95 1 8 ASN HA 1 47 ILE H 3.170 . 4.540 4.491 4.392 4.570 0.030 8 0 "[ . 1 . 2]" 1
96 1 8 ASN HB2 1 9 ASP H 3.090 . 4.380 4.146 4.101 4.169 . 0 0 "[ . 1 . 2]" 1
97 1 8 ASN HB2 1 10 GLU H 3.090 . 4.380 4.306 4.277 4.367 . 0 0 "[ . 1 . 2]" 1
98 1 8 ASN HB2 1 11 VAL MG2 3.465 . 5.130 3.853 3.764 3.965 . 0 0 "[ . 1 . 2]" 1
99 1 8 ASN HB2 1 46 GLN QG 4.095 . 6.390 2.467 2.147 3.029 . 0 0 "[ . 1 . 2]" 1
100 1 8 ASN HB2 1 48 ILE HA 3.570 . 5.340 3.197 2.993 3.580 . 0 0 "[ . 1 . 2]" 1
101 1 8 ASN HB2 1 48 ILE MG 3.110 . 4.420 3.710 3.687 3.733 . 0 0 "[ . 1 . 2]" 1
102 1 8 ASN HB3 1 10 GLU H 2.875 . 3.950 2.881 2.838 2.995 . 0 0 "[ . 1 . 2]" 1
103 1 8 ASN HB3 1 11 VAL MG2 3.420 . 5.040 2.854 2.683 3.114 . 0 0 "[ . 1 . 2]" 1
104 1 8 ASN HB3 1 48 ILE HA 2.935 . 4.070 2.170 1.968 2.580 . 0 0 "[ . 1 . 2]" 1
105 1 8 ASN HB3 1 48 ILE MG 3.280 . 4.760 4.065 4.035 4.087 . 0 0 "[ . 1 . 2]" 1
106 1 8 ASN HD21 1 48 ILE MD 4.025 . 6.250 3.301 2.196 4.696 . 0 0 "[ . 1 . 2]" 1
107 1 8 ASN HD22 1 48 ILE MD 4.025 . 6.250 2.994 2.377 4.036 . 0 0 "[ . 1 . 2]" 1
108 1 8 ASN QD 1 9 ASP H 3.980 . 6.160 3.374 2.587 3.861 . 0 0 "[ . 1 . 2]" 1
109 1 8 ASN QD 1 10 GLU H 3.685 . 5.570 3.259 1.996 4.348 . 0 0 "[ . 1 . 2]" 1
110 1 8 ASN QD 1 48 ILE MD 3.910 . 6.020 2.759 2.026 3.814 . 0 0 "[ . 1 . 2]" 1
111 1 9 ASP H 1 10 GLU H 2.440 . 3.080 2.856 2.818 2.941 . 0 0 "[ . 1 . 2]" 1
112 1 9 ASP HA 1 10 GLU H 2.675 . 3.550 3.481 3.473 3.495 . 0 0 "[ . 1 . 2]" 1
113 1 9 ASP HA 1 11 VAL H 2.955 . 4.110 4.012 3.916 4.129 0.019 19 0 "[ . 1 . 2]" 1
114 1 9 ASP HA 1 12 ILE H 2.795 . 3.790 3.242 3.212 3.295 . 0 0 "[ . 1 . 2]" 1
115 1 9 ASP HA 1 12 ILE HB 2.380 . 2.960 3.017 2.971 3.034 0.074 10 0 "[ . 1 . 2]" 1
116 1 9 ASP HA 1 12 ILE MG 3.805 . 5.810 4.291 4.260 4.319 . 0 0 "[ . 1 . 2]" 1
117 1 9 ASP HA 1 12 ILE HG12 3.110 . 4.420 3.206 3.178 3.244 . 0 0 "[ . 1 . 2]" 1
118 1 9 ASP HA 1 12 ILE HG13 3.110 . 4.420 4.393 4.371 4.418 . 0 0 "[ . 1 . 2]" 1
119 1 9 ASP HA 1 12 ILE QG 2.755 . 3.710 3.132 3.106 3.165 . 0 0 "[ . 1 . 2]" 1
120 1 9 ASP HA 1 12 ILE MD 2.830 . 3.860 1.897 1.881 1.933 . 0 0 "[ . 1 . 2]" 1
121 1 9 ASP HA 1 13 LYS H 3.185 . 4.570 4.484 4.335 4.579 0.009 10 0 "[ . 1 . 2]" 1
122 1 9 ASP QB 1 10 GLU H 3.150 . 4.500 3.098 2.890 3.601 . 0 0 "[ . 1 . 2]" 1
123 1 9 ASP QB 1 12 ILE HB 3.985 . 6.170 3.735 3.574 4.357 . 0 0 "[ . 1 . 2]" 1
124 1 10 GLU H 1 10 GLU HA 2.380 . 2.960 2.786 2.777 2.793 . 0 0 "[ . 1 . 2]" 1
125 1 10 GLU H 1 10 GLU QB 2.795 . 3.790 2.131 2.044 2.230 . 0 0 "[ . 1 . 2]" 1
126 1 10 GLU H 1 10 GLU QG 3.335 . 4.870 3.933 3.548 4.056 . 0 0 "[ . 1 . 2]" 1
127 1 10 GLU H 1 11 VAL H 2.410 . 3.020 2.646 2.619 2.696 . 0 0 "[ . 1 . 2]" 1
128 1 10 GLU H 1 12 ILE H 2.860 . 3.920 4.007 3.994 4.026 0.106 13 0 "[ . 1 . 2]" 1
129 1 10 GLU H 1 48 ILE QG 4.095 . 6.390 3.897 3.672 4.138 . 0 0 "[ . 1 . 2]" 1
130 1 10 GLU HA 1 11 VAL H 2.595 . 3.390 3.471 3.462 3.485 0.095 16 0 "[ . 1 . 2]" 1
131 1 10 GLU HA 1 11 VAL MG2 3.870 . 5.940 4.886 4.785 4.920 . 0 0 "[ . 1 . 2]" 1
132 1 10 GLU HA 1 12 ILE H 2.830 . 3.860 3.880 3.859 3.899 0.039 7 0 "[ . 1 . 2]" 1
133 1 10 GLU HA 1 14 VAL H 3.140 . 4.480 4.288 4.055 4.414 . 0 0 "[ . 1 . 2]" 1
134 1 10 GLU QB 1 11 VAL H 3.085 . 4.370 2.672 2.635 2.770 . 0 0 "[ . 1 . 2]" 1
135 1 10 GLU QB 1 49 VAL MG2 3.475 . 5.150 2.529 1.872 3.162 . 0 0 "[ . 1 . 2]" 1
136 1 10 GLU QG 1 11 VAL H 4.030 . 6.260 4.194 3.883 4.566 . 0 0 "[ . 1 . 2]" 1
137 1 10 GLU QG 1 49 VAL MG1 3.910 . 6.020 3.562 3.339 4.071 . 0 0 "[ . 1 . 2]" 1
138 1 10 GLU QG 1 49 VAL MG2 3.320 . 4.840 2.342 1.918 3.364 . 0 0 "[ . 1 . 2]" 1
139 1 11 VAL H 1 11 VAL HB 2.550 . 3.300 2.528 2.463 2.597 . 0 0 "[ . 1 . 2]" 1
140 1 11 VAL H 1 11 VAL MG1 3.310 . 4.820 3.747 3.739 3.752 . 0 0 "[ . 1 . 2]" 1
141 1 11 VAL H 1 11 VAL MG2 3.000 . 4.200 2.110 1.991 2.207 . 0 0 "[ . 1 . 2]" 1
142 1 11 VAL H 1 12 ILE H 2.425 . 3.050 2.594 2.555 2.636 . 0 0 "[ . 1 . 2]" 1
143 1 11 VAL HA 1 11 VAL MG2 2.615 . 3.430 2.316 2.262 2.468 . 0 0 "[ . 1 . 2]" 1
144 1 11 VAL HA 1 13 LYS H 3.370 . 4.940 4.749 4.704 4.798 . 0 0 "[ . 1 . 2]" 1
145 1 11 VAL HA 1 14 VAL H 2.705 . 3.610 3.607 3.529 3.648 0.038 19 0 "[ . 1 . 2]" 1
146 1 11 VAL HA 1 14 VAL HB 2.505 . 3.210 2.940 2.805 3.139 . 0 0 "[ . 1 . 2]" 1
147 1 11 VAL HA 1 49 VAL MG2 3.295 . 4.790 2.895 2.610 3.139 . 0 0 "[ . 1 . 2]" 1
148 1 11 VAL HA 1 128 PHE HZ 3.650 . 5.500 4.730 4.537 4.960 . 0 0 "[ . 1 . 2]" 1
149 1 11 VAL HB 1 12 ILE H 2.550 . 3.300 2.910 2.863 2.957 . 0 0 "[ . 1 . 2]" 1
150 1 11 VAL MG1 1 12 ILE H 3.590 . 5.380 3.766 3.733 3.803 . 0 0 "[ . 1 . 2]" 1
151 1 11 VAL MG1 1 12 ILE HA 3.685 . 5.570 3.740 3.655 3.815 . 0 0 "[ . 1 . 2]" 1
152 1 11 VAL MG1 1 13 LYS H 4.165 . 6.530 5.403 5.369 5.431 . 0 0 "[ . 1 . 2]" 1
153 1 11 VAL MG1 1 14 VAL HB 3.980 . 6.160 3.746 3.493 3.941 . 0 0 "[ . 1 . 2]" 1
154 1 11 VAL MG1 1 38 PHE QD 5.240 . 8.680 3.369 2.747 3.848 . 0 0 "[ . 1 . 2]" 1
155 1 11 VAL MG1 1 38 PHE QE 4.495 . 7.190 2.763 1.915 3.372 . 0 0 "[ . 1 . 2]" 1
156 1 11 VAL MG1 1 38 PHE HZ 3.095 . 4.390 3.427 3.352 3.549 . 0 0 "[ . 1 . 2]" 1
157 1 11 VAL MG1 1 49 VAL MG2 4.460 . 7.120 4.038 3.784 4.350 . 0 0 "[ . 1 . 2]" 1
158 1 11 VAL MG1 1 124 ILE QG 4.545 . 7.290 2.044 1.910 2.152 . 0 0 "[ . 1 . 2]" 1
159 1 11 VAL MG1 1 127 LYS HA 4.040 . 6.280 5.133 5.097 5.205 . 0 0 "[ . 1 . 2]" 1
160 1 11 VAL MG1 1 128 PHE QE 4.245 . 6.690 2.300 1.840 2.591 . 0 0 "[ . 1 . 2]" 1
161 1 11 VAL MG1 1 128 PHE HZ 2.860 . 3.920 2.498 2.338 2.698 . 0 0 "[ . 1 . 2]" 1
162 1 11 VAL MG2 1 38 PHE QD 4.290 . 6.780 2.218 1.873 3.004 . 0 0 "[ . 1 . 2]" 1
163 1 11 VAL MG2 1 48 ILE HA 3.095 . 4.390 2.716 2.404 3.030 . 0 0 "[ . 1 . 2]" 1
164 1 11 VAL MG2 1 49 VAL H 3.545 . 5.290 3.588 3.188 3.889 . 0 0 "[ . 1 . 2]" 1
165 1 12 ILE H 1 12 ILE HB 2.380 . 2.960 2.387 2.363 2.418 . 0 0 "[ . 1 . 2]" 1
166 1 12 ILE H 1 12 ILE HG12 2.720 . 3.640 3.771 3.750 3.789 0.149 9 0 "[ . 1 . 2]" 1
167 1 12 ILE H 1 12 ILE HG13 2.720 . 3.640 3.645 3.584 3.667 0.027 8 0 "[ . 1 . 2]" 1
168 1 12 ILE H 1 12 ILE MD 3.375 . 4.950 1.842 1.824 1.867 . 0 0 "[ . 1 . 2]" 1
169 1 12 ILE H 1 13 LYS H 2.455 . 3.110 2.500 2.445 2.563 . 0 0 "[ . 1 . 2]" 1
170 1 12 ILE H 1 14 VAL H 2.795 . 3.790 3.712 3.655 3.790 0.000 1 0 "[ . 1 . 2]" 1
171 1 12 ILE HA 1 12 ILE HG12 2.795 . 3.790 3.703 3.684 3.731 . 0 0 "[ . 1 . 2]" 1
172 1 12 ILE HA 1 12 ILE HG13 2.795 . 3.790 2.505 2.476 2.553 . 0 0 "[ . 1 . 2]" 1
173 1 12 ILE HA 1 12 ILE QG 2.600 . 3.400 2.467 2.440 2.512 . 0 0 "[ . 1 . 2]" 1
174 1 12 ILE HA 1 12 ILE MD 2.970 . 4.140 2.784 2.721 2.887 . 0 0 "[ . 1 . 2]" 1
175 1 12 ILE HA 1 15 PHE H 2.380 . 2.960 3.071 3.048 3.091 0.131 3 0 "[ . 1 . 2]" 1
176 1 12 ILE HA 1 15 PHE HB2 2.425 . 3.050 3.077 3.052 3.101 0.051 12 0 "[ . 1 . 2]" 1
177 1 12 ILE HA 1 15 PHE HB3 2.425 . 3.050 2.700 2.548 2.890 . 0 0 "[ . 1 . 2]" 1
178 1 12 ILE HA 1 15 PHE QB 2.330 . 2.860 2.534 2.434 2.655 . 0 0 "[ . 1 . 2]" 1
179 1 12 ILE HA 1 15 PHE QD 4.195 . 6.590 4.112 3.953 4.591 . 0 0 "[ . 1 . 2]" 1
180 1 12 ILE HA 1 15 PHE QE 4.725 . 7.650 6.210 6.070 6.508 . 0 0 "[ . 1 . 2]" 1
181 1 12 ILE HA 1 16 ASN H 2.735 . 3.670 3.717 3.690 3.738 0.068 13 0 "[ . 1 . 2]" 1
182 1 12 ILE HA 1 128 PHE QD 4.725 . 7.650 5.093 4.745 5.310 . 0 0 "[ . 1 . 2]" 1
183 1 12 ILE HA 1 128 PHE QE 4.230 . 6.660 4.914 4.659 5.110 . 0 0 "[ . 1 . 2]" 1
184 1 12 ILE MG 1 13 LYS H 3.295 . 4.790 3.147 3.055 3.227 . 0 0 "[ . 1 . 2]" 1
185 1 12 ILE MG 1 15 PHE QD 4.585 . 7.370 4.134 3.952 4.623 . 0 0 "[ . 1 . 2]" 1
186 1 12 ILE MG 1 16 ASN H 3.715 . 5.630 3.585 3.471 3.639 . 0 0 "[ . 1 . 2]" 1
187 1 12 ILE MG 1 16 ASN HD21 3.495 . 5.190 2.748 1.924 3.485 . 0 0 "[ . 1 . 2]" 1
188 1 12 ILE MG 1 16 ASN HD22 3.495 . 5.190 2.519 1.971 3.012 . 0 0 "[ . 1 . 2]" 1
189 1 12 ILE MG 1 16 ASN QD 3.370 . 4.940 2.294 1.743 2.781 0.057 1 0 "[ . 1 . 2]" 1
190 1 12 ILE QG 1 13 LYS H 3.225 . 4.650 4.322 4.309 4.329 . 0 0 "[ . 1 . 2]" 1
191 1 12 ILE MD 1 13 LYS H 3.465 . 5.130 3.685 3.601 3.736 . 0 0 "[ . 1 . 2]" 1
192 1 12 ILE MD 1 127 LYS HA 4.085 . 6.370 4.336 4.069 4.537 . 0 0 "[ . 1 . 2]" 1
193 1 13 LYS H 1 13 LYS QG 3.710 . 5.620 2.641 1.981 3.763 . 0 0 "[ . 1 . 2]" 1
194 1 13 LYS H 1 14 VAL H 2.440 . 3.080 2.701 2.651 2.741 . 0 0 "[ . 1 . 2]" 1
195 1 13 LYS HA 1 14 VAL H 2.660 . 3.520 3.488 3.481 3.494 . 0 0 "[ . 1 . 2]" 1
196 1 13 LYS HA 1 16 ASN H 2.675 . 3.550 3.611 3.571 3.640 0.090 19 0 "[ . 1 . 2]" 1
197 1 13 LYS HA 1 16 ASN HB2 2.365 . 2.930 2.832 2.736 2.947 0.017 3 0 "[ . 1 . 2]" 1
198 1 13 LYS HA 1 16 ASN HB3 3.200 . 4.600 4.406 4.264 4.607 0.007 13 0 "[ . 1 . 2]" 1
199 1 13 LYS HA 1 16 ASN HD21 3.620 . 5.440 3.851 3.298 5.459 0.019 3 0 "[ . 1 . 2]" 1
200 1 13 LYS HA 1 16 ASN HD22 3.620 . 5.440 5.059 4.249 5.328 . 0 0 "[ . 1 . 2]" 1
201 1 13 LYS HA 1 17 ASP H 2.955 . 4.110 3.942 3.855 3.998 . 0 0 "[ . 1 . 2]" 1
202 1 13 LYS QB 1 14 VAL H 3.135 . 4.470 2.949 2.777 3.597 . 0 0 "[ . 1 . 2]" 1
203 1 13 LYS QB 1 17 ASP H 3.690 . 5.580 4.869 4.797 4.981 . 0 0 "[ . 1 . 2]" 1
204 1 13 LYS QG 1 14 VAL H 4.095 . 6.390 4.000 2.128 4.591 . 0 0 "[ . 1 . 2]" 1
205 1 13 LYS QD 1 14 VAL H 4.095 . 6.390 4.851 3.905 5.473 . 0 0 "[ . 1 . 2]" 1
206 1 14 VAL H 1 14 VAL HB 2.315 . 2.830 2.578 2.539 2.611 . 0 0 "[ . 1 . 2]" 1
207 1 14 VAL H 1 14 VAL MG1 3.050 . 4.300 3.769 3.759 3.774 . 0 0 "[ . 1 . 2]" 1
208 1 14 VAL H 1 14 VAL MG2 2.970 . 4.140 2.210 2.117 2.298 . 0 0 "[ . 1 . 2]" 1
209 1 14 VAL H 1 15 PHE H 2.455 . 3.110 2.392 2.353 2.428 . 0 0 "[ . 1 . 2]" 1
210 1 14 VAL H 1 15 PHE QB 3.255 . 4.710 4.208 4.166 4.235 . 0 0 "[ . 1 . 2]" 1
211 1 14 VAL HA 1 14 VAL HB 2.350 . 2.900 3.008 3.004 3.011 0.111 2 0 "[ . 1 . 2]" 1
212 1 14 VAL HA 1 17 ASP H 2.580 . 3.360 3.411 3.391 3.424 0.064 10 0 "[ . 1 . 2]" 1
213 1 14 VAL HA 1 17 ASP HA 3.495 . 5.190 5.247 5.229 5.263 0.073 3 0 "[ . 1 . 2]" 1
214 1 14 VAL HA 1 17 ASP HB2 2.395 . 2.990 2.337 2.309 2.362 . 0 0 "[ . 1 . 2]" 1
215 1 14 VAL HA 1 17 ASP HB3 2.935 . 4.070 3.826 3.785 3.870 . 0 0 "[ . 1 . 2]" 1
216 1 14 VAL HA 1 18 MET H 2.830 . 3.860 3.551 3.494 3.670 . 0 0 "[ . 1 . 2]" 1
217 1 14 VAL HA 1 36 VAL MG2 3.605 . 5.410 4.370 4.325 4.422 . 0 0 "[ . 1 . 2]" 1
218 1 14 VAL HB 1 15 PHE H 2.395 . 2.990 2.701 2.633 2.811 . 0 0 "[ . 1 . 2]" 1
219 1 14 VAL HB 1 38 PHE HZ 2.625 . 3.450 2.728 2.632 2.812 . 0 0 "[ . 1 . 2]" 1
220 1 14 VAL MG1 1 15 PHE HA 3.250 . 4.700 3.789 3.624 3.838 . 0 0 "[ . 1 . 2]" 1
221 1 14 VAL MG1 1 18 MET QG 3.910 . 6.020 2.081 1.971 2.399 . 0 0 "[ . 1 . 2]" 1
222 1 14 VAL MG1 1 36 VAL MG2 3.190 . 4.580 1.694 1.659 1.753 0.141 11 0 "[ . 1 . 2]" 1
223 1 14 VAL MG2 1 36 VAL MG2 3.810 . 5.820 3.079 2.752 3.301 . 0 0 "[ . 1 . 2]" 1
224 1 14 VAL MG2 1 38 PHE HZ 2.970 . 4.140 3.413 3.386 3.433 . 0 0 "[ . 1 . 2]" 1
225 1 15 PHE H 1 15 PHE QB 2.655 . 3.510 2.261 2.250 2.283 . 0 0 "[ . 1 . 2]" 1
226 1 15 PHE H 1 16 ASN H 2.505 . 3.210 2.559 2.524 2.611 . 0 0 "[ . 1 . 2]" 1
227 1 15 PHE H 1 128 PHE QE 4.320 . 6.840 4.139 3.977 4.248 . 0 0 "[ . 1 . 2]" 1
228 1 15 PHE HA 1 18 MET H 2.595 . 3.390 3.454 3.425 3.482 0.092 9 0 "[ . 1 . 2]" 1
229 1 15 PHE HA 1 18 MET HB2 2.610 . 3.420 2.721 2.658 2.836 . 0 0 "[ . 1 . 2]" 1
230 1 15 PHE HA 1 18 MET QG 3.830 . 5.860 4.160 4.084 4.225 . 0 0 "[ . 1 . 2]" 1
231 1 15 PHE HA 1 18 MET ME 4.085 . 6.370 5.353 5.302 5.382 . 0 0 "[ . 1 . 2]" 1
232 1 15 PHE HA 1 84 LEU QD 3.865 . 5.930 3.181 2.667 3.803 . 0 0 "[ . 1 . 2]" 1
233 1 15 PHE HA 1 99 LEU QD 4.695 . 7.590 3.968 3.801 4.133 . 0 0 "[ . 1 . 2]" 1
234 1 15 PHE QB 1 16 ASN H 2.975 . 4.150 2.453 2.393 2.515 . 0 0 "[ . 1 . 2]" 1
235 1 15 PHE QD 1 16 ASN H 4.335 . 6.870 4.051 3.891 4.197 . 0 0 "[ . 1 . 2]" 1
236 1 15 PHE QD 1 16 ASN HA 4.505 . 7.210 4.370 3.786 4.600 . 0 0 "[ . 1 . 2]" 1
237 1 15 PHE QD 1 19 LYS H 4.725 . 7.650 4.955 4.746 5.144 . 0 0 "[ . 1 . 2]" 1
238 1 15 PHE QD 1 19 LYS QB 5.170 . 8.540 4.064 3.631 4.501 . 0 0 "[ . 1 . 2]" 1
239 1 15 PHE QD 1 84 LEU MD1 4.480 . 7.160 3.000 2.599 3.486 . 0 0 "[ . 1 . 2]" 1
240 1 15 PHE QD 1 84 LEU MD2 4.480 . 7.160 2.978 2.037 4.294 . 0 0 "[ . 1 . 2]" 1
241 1 15 PHE QD 1 84 LEU QD 4.310 . 6.820 2.457 2.008 2.975 . 0 0 "[ . 1 . 2]" 1
242 1 15 PHE QD 1 99 LEU QD 5.705 . 9.610 3.151 2.951 3.580 . 0 0 "[ . 1 . 2]" 1
243 1 15 PHE QD 1 128 PHE HA 4.230 . 6.660 3.176 2.999 3.322 . 0 0 "[ . 1 . 2]" 1
244 1 15 PHE QD 1 129 THR H 4.645 . 7.490 3.874 3.617 4.407 . 0 0 "[ . 1 . 2]" 1
245 1 15 PHE QD 1 131 ILE HB 4.725 . 7.650 4.783 4.523 4.920 . 0 0 "[ . 1 . 2]" 1
246 1 15 PHE QD 1 131 ILE MD 4.665 . 7.530 4.583 4.321 4.806 . 0 0 "[ . 1 . 2]" 1
247 1 15 PHE QE 1 16 ASN HA 4.725 . 7.650 5.644 5.376 5.876 . 0 0 "[ . 1 . 2]" 1
248 1 15 PHE QE 1 19 LYS HB2 4.475 . 7.150 4.548 3.793 5.267 . 0 0 "[ . 1 . 2]" 1
249 1 15 PHE QE 1 19 LYS HB3 4.475 . 7.150 5.137 4.621 5.361 . 0 0 "[ . 1 . 2]" 1
250 1 15 PHE QE 1 19 LYS QB 4.410 . 7.020 4.216 3.683 4.733 . 0 0 "[ . 1 . 2]" 1
251 1 15 PHE QE 1 19 LYS QG 4.860 . 7.920 3.775 2.863 5.046 . 0 0 "[ . 1 . 2]" 1
252 1 15 PHE QE 1 99 LEU QD 5.350 . 8.900 2.334 2.014 2.842 . 0 0 "[ . 1 . 2]" 1
253 1 15 PHE QE 1 128 PHE HA 3.810 . 5.820 2.944 2.860 3.108 . 0 0 "[ . 1 . 2]" 1
254 1 15 PHE QE 1 128 PHE HB2 4.725 . 7.650 4.737 4.081 4.962 . 0 0 "[ . 1 . 2]" 1
255 1 15 PHE QE 1 128 PHE HB3 4.725 . 7.650 3.345 2.446 3.643 . 0 0 "[ . 1 . 2]" 1
256 1 15 PHE QE 1 129 THR HA 4.725 . 7.650 4.249 3.954 4.789 . 0 0 "[ . 1 . 2]" 1
257 1 15 PHE QE 1 129 THR HB 4.245 . 6.690 2.937 2.560 3.857 . 0 0 "[ . 1 . 2]" 1
258 1 15 PHE QE 1 129 THR MG 5.175 . 8.550 4.199 3.966 4.693 . 0 0 "[ . 1 . 2]" 1
259 1 15 PHE QE 1 130 GLY QA 5.170 . 8.540 3.950 3.532 4.021 . 0 0 "[ . 1 . 2]" 1
260 1 15 PHE QE 1 131 ILE HA 4.510 . 7.220 3.873 3.642 3.980 . 0 0 "[ . 1 . 2]" 1
261 1 15 PHE QE 1 131 ILE HB 4.025 . 6.250 2.829 2.238 3.046 . 0 0 "[ . 1 . 2]" 1
262 1 15 PHE QE 1 131 ILE MG 4.385 . 6.970 4.099 3.566 4.249 . 0 0 "[ . 1 . 2]" 1
263 1 15 PHE QE 1 131 ILE MD 4.045 . 6.290 3.050 2.774 3.359 . 0 0 "[ . 1 . 2]" 1
264 1 16 ASN H 1 16 ASN HB2 2.410 . 3.020 2.340 2.263 2.727 . 0 0 "[ . 1 . 2]" 1
265 1 16 ASN H 1 16 ASN HD21 3.370 . 4.940 3.763 2.169 4.524 . 0 0 "[ . 1 . 2]" 1
266 1 16 ASN H 1 16 ASN HD22 3.370 . 4.940 4.373 3.392 4.810 . 0 0 "[ . 1 . 2]" 1
267 1 16 ASN H 1 16 ASN QD 3.165 . 4.530 3.518 2.156 4.111 . 0 0 "[ . 1 . 2]" 1
268 1 16 ASN H 1 17 ASP H 2.470 . 3.140 2.531 2.504 2.584 . 0 0 "[ . 1 . 2]" 1
269 1 16 ASN HA 1 16 ASN HB2 2.365 . 2.930 3.001 2.994 3.016 0.086 5 0 "[ . 1 . 2]" 1
270 1 16 ASN HA 1 16 ASN HB3 2.270 . 2.740 2.564 2.370 2.608 . 0 0 "[ . 1 . 2]" 1
271 1 16 ASN HA 1 17 ASP H 2.625 . 3.450 3.488 3.480 3.498 0.048 9 0 "[ . 1 . 2]" 1
272 1 16 ASN HA 1 19 LYS H 2.735 . 3.670 3.529 3.392 3.658 . 0 0 "[ . 1 . 2]" 1
273 1 16 ASN HA 1 19 LYS QB 2.715 . 3.630 2.503 2.281 2.734 . 0 0 "[ . 1 . 2]" 1
274 1 16 ASN HA 1 19 LYS QG 2.995 . 4.190 3.657 3.539 3.821 . 0 0 "[ . 1 . 2]" 1
275 1 16 ASN HA 1 19 LYS QD 3.970 . 6.140 5.181 4.657 5.555 . 0 0 "[ . 1 . 2]" 1
276 1 16 ASN HB3 1 19 LYS QB 3.860 . 5.920 4.720 4.419 4.911 . 0 0 "[ . 1 . 2]" 1
277 1 16 ASN HB3 1 20 VAL QG 4.695 . 7.590 3.298 3.004 3.616 . 0 0 "[ . 1 . 2]" 1
278 1 16 ASN QD 1 17 ASP H 3.885 . 5.970 4.897 4.278 5.233 . 0 0 "[ . 1 . 2]" 1
279 1 17 ASP H 1 18 MET H 2.335 . 2.870 2.481 2.444 2.516 . 0 0 "[ . 1 . 2]" 1
280 1 17 ASP H 1 18 MET HB2 3.245 . 4.690 4.515 4.449 4.584 . 0 0 "[ . 1 . 2]" 1
281 1 17 ASP H 1 18 MET QG 3.535 . 5.270 4.374 4.308 4.436 . 0 0 "[ . 1 . 2]" 1
282 1 17 ASP HA 1 17 ASP HB2 2.350 . 2.900 2.985 2.983 2.988 0.088 14 0 "[ . 1 . 2]" 1
283 1 17 ASP HA 1 17 ASP HB3 2.285 . 2.770 2.606 2.600 2.611 . 0 0 "[ . 1 . 2]" 1
284 1 17 ASP HA 1 18 MET H 2.705 . 3.610 3.527 3.517 3.535 . 0 0 "[ . 1 . 2]" 1
285 1 17 ASP HA 1 19 LYS H 2.875 . 3.950 4.015 3.984 4.044 0.094 20 0 "[ . 1 . 2]" 1
286 1 17 ASP HA 1 20 VAL H 2.765 . 3.730 3.431 3.352 3.573 . 0 0 "[ . 1 . 2]" 1
287 1 17 ASP HA 1 20 VAL HB 2.735 . 3.670 3.191 3.112 3.474 . 0 0 "[ . 1 . 2]" 1
288 1 17 ASP HA 1 20 VAL QG 4.060 . 6.320 3.740 3.668 3.933 . 0 0 "[ . 1 . 2]" 1
289 1 17 ASP HB2 1 18 MET H 2.610 . 3.420 2.605 2.588 2.628 . 0 0 "[ . 1 . 2]" 1
290 1 17 ASP HB3 1 18 MET H 2.520 . 3.240 3.284 3.271 3.306 0.066 1 0 "[ . 1 . 2]" 1
291 1 17 ASP HB3 1 19 LYS H 3.465 . 5.130 5.085 5.054 5.113 . 0 0 "[ . 1 . 2]" 1
292 1 18 MET H 1 18 MET HB2 2.410 . 3.020 2.333 2.315 2.356 . 0 0 "[ . 1 . 2]" 1
293 1 18 MET H 1 18 MET HB3 2.690 . 3.580 3.558 3.549 3.567 . 0 0 "[ . 1 . 2]" 1
294 1 18 MET H 1 18 MET HG2 2.860 . 3.920 3.597 3.560 3.631 . 0 0 "[ . 1 . 2]" 1
295 1 18 MET H 1 18 MET HG3 2.860 . 3.920 2.462 2.412 2.515 . 0 0 "[ . 1 . 2]" 1
296 1 18 MET H 1 18 MET QG 2.665 . 3.530 2.422 2.375 2.471 . 0 0 "[ . 1 . 2]" 1
297 1 18 MET H 1 33 LYS QB 4.000 . 6.200 4.679 4.075 5.508 . 0 0 "[ . 1 . 2]" 1
298 1 18 MET H 1 33 LYS QD 4.065 . 6.330 4.606 2.757 5.703 . 0 0 "[ . 1 . 2]" 1
299 1 18 MET H 1 99 LEU QD 4.630 . 7.460 4.859 4.670 4.994 . 0 0 "[ . 1 . 2]" 1
300 1 18 MET HA 1 18 MET HG2 2.335 . 2.870 2.386 2.367 2.413 . 0 0 "[ . 1 . 2]" 1
301 1 18 MET HA 1 18 MET HG3 2.335 . 2.870 2.960 2.938 2.980 0.110 8 0 "[ . 1 . 2]" 1
302 1 18 MET HA 1 18 MET QG 2.220 . 2.640 2.291 2.277 2.313 . 0 0 "[ . 1 . 2]" 1
303 1 18 MET HA 1 18 MET ME 3.205 . 4.610 3.704 3.658 3.820 . 0 0 "[ . 1 . 2]" 1
304 1 18 MET HA 1 19 LYS H 2.690 . 3.580 3.425 3.404 3.437 . 0 0 "[ . 1 . 2]" 1
305 1 18 MET HA 1 20 VAL H 2.830 . 3.860 3.997 3.962 4.029 0.169 10 0 "[ . 1 . 2]" 1
306 1 18 MET HA 1 99 LEU QD 3.920 . 6.040 4.418 4.236 4.480 . 0 0 "[ . 1 . 2]" 1
307 1 18 MET HB2 1 19 LYS H 2.640 . 3.480 3.168 3.123 3.225 . 0 0 "[ . 1 . 2]" 1
308 1 18 MET HB2 1 99 LEU QD 4.090 . 6.380 3.347 3.090 3.459 . 0 0 "[ . 1 . 2]" 1
309 1 18 MET HB3 1 19 LYS H 2.860 . 3.920 3.952 3.932 3.986 0.066 19 0 "[ . 1 . 2]" 1
310 1 18 MET HB3 1 99 LEU QD 4.245 . 6.690 2.986 2.711 3.112 . 0 0 "[ . 1 . 2]" 1
311 1 18 MET HG2 1 19 LYS H 3.555 . 5.310 5.144 5.122 5.172 . 0 0 "[ . 1 . 2]" 1
312 1 18 MET HG2 1 36 VAL MG2 3.635 . 5.470 3.864 3.752 4.091 . 0 0 "[ . 1 . 2]" 1
313 1 18 MET HG3 1 19 LYS H 3.555 . 5.310 4.611 4.548 4.681 . 0 0 "[ . 1 . 2]" 1
314 1 18 MET HG3 1 36 VAL MG2 3.635 . 5.470 3.524 3.457 3.674 . 0 0 "[ . 1 . 2]" 1
315 1 18 MET QG 1 19 LYS H 3.340 . 4.880 4.301 4.257 4.352 . 0 0 "[ . 1 . 2]" 1
316 1 18 MET QG 1 34 LYS HA 3.490 . 5.180 4.001 3.771 4.250 . 0 0 "[ . 1 . 2]" 1
317 1 18 MET QG 1 36 VAL MG2 3.450 . 5.100 3.267 3.193 3.410 . 0 0 "[ . 1 . 2]" 1
318 1 18 MET ME 1 34 LYS HA 3.050 . 4.300 3.184 2.894 3.410 . 0 0 "[ . 1 . 2]" 1
319 1 18 MET ME 1 35 ALA H 3.095 . 4.390 3.481 3.365 3.573 . 0 0 "[ . 1 . 2]" 1
320 1 18 MET ME 1 35 ALA HA 3.110 . 4.420 2.249 1.977 2.620 . 0 0 "[ . 1 . 2]" 1
321 1 18 MET ME 1 36 VAL H 3.265 . 4.730 3.247 3.012 3.462 . 0 0 "[ . 1 . 2]" 1
322 1 18 MET ME 1 36 VAL MG2 3.300 . 4.800 2.739 2.617 3.151 . 0 0 "[ . 1 . 2]" 1
323 1 18 MET ME 1 38 PHE HZ 3.915 . 6.030 5.118 5.094 5.143 . 0 0 "[ . 1 . 2]" 1
324 1 18 MET ME 1 84 LEU HA 4.165 . 6.530 4.060 3.921 4.240 . 0 0 "[ . 1 . 2]" 1
325 1 18 MET ME 1 85 TYR H 4.165 . 6.530 3.324 3.168 3.551 . 0 0 "[ . 1 . 2]" 1
326 1 18 MET ME 1 85 TYR HA 3.340 . 4.880 2.076 1.896 2.415 . 0 0 "[ . 1 . 2]" 1
327 1 18 MET ME 1 86 ASP H 3.325 . 4.850 2.893 2.758 3.171 . 0 0 "[ . 1 . 2]" 1
328 1 18 MET ME 1 86 ASP HA 3.235 . 4.670 3.941 3.902 4.002 . 0 0 "[ . 1 . 2]" 1
329 1 18 MET ME 1 86 ASP QB 3.695 . 5.590 2.808 2.661 2.912 . 0 0 "[ . 1 . 2]" 1
330 1 19 LYS H 1 19 LYS HA 2.365 . 2.930 2.909 2.902 2.913 . 0 0 "[ . 1 . 2]" 1
331 1 19 LYS H 1 19 LYS QB 2.795 . 3.790 2.296 2.238 2.371 . 0 0 "[ . 1 . 2]" 1
332 1 19 LYS H 1 19 LYS QG 3.570 . 5.340 3.398 2.645 3.996 . 0 0 "[ . 1 . 2]" 1
333 1 19 LYS H 1 20 VAL H 2.395 . 2.990 2.247 2.216 2.272 . 0 0 "[ . 1 . 2]" 1
334 1 19 LYS H 1 20 VAL HB 3.170 . 4.540 4.561 4.553 4.589 0.049 9 0 "[ . 1 . 2]" 1
335 1 19 LYS H 1 20 VAL QG 4.255 . 6.710 3.618 3.502 3.766 . 0 0 "[ . 1 . 2]" 1
336 1 19 LYS H 1 99 LEU QD 4.150 . 6.500 3.957 3.758 4.179 . 0 0 "[ . 1 . 2]" 1
337 1 19 LYS HA 1 19 LYS QE 4.095 . 6.390 2.905 2.018 4.321 . 0 0 "[ . 1 . 2]" 1
338 1 19 LYS HA 1 20 VAL H 2.580 . 3.360 3.424 3.410 3.439 0.079 13 0 "[ . 1 . 2]" 1
339 1 19 LYS HA 1 99 LEU QD 4.075 . 6.350 2.633 2.278 2.898 . 0 0 "[ . 1 . 2]" 1
340 1 19 LYS QB 1 20 VAL H 2.935 . 4.070 3.069 3.033 3.107 . 0 0 "[ . 1 . 2]" 1
341 1 19 LYS QB 1 99 LEU QD 5.140 . 8.480 3.271 2.615 3.923 . 0 0 "[ . 1 . 2]" 1
342 1 19 LYS QG 1 20 VAL H 4.095 . 6.390 4.157 3.907 4.406 . 0 0 "[ . 1 . 2]" 1
343 1 19 LYS QE 1 20 VAL H 4.050 . 6.300 5.419 4.987 5.667 . 0 0 "[ . 1 . 2]" 1
344 1 19 LYS QE 1 130 GLY HA3 4.095 . 6.390 3.966 3.333 4.468 . 0 0 "[ . 1 . 2]" 1
345 1 19 LYS QE 1 130 GLY HA2 4.095 . 6.390 5.383 4.907 5.747 . 0 0 "[ . 1 . 2]" 1
346 1 19 LYS QE 1 130 GLY QA 3.830 . 5.860 3.866 3.281 4.320 . 0 0 "[ . 1 . 2]" 1
347 1 20 VAL H 1 20 VAL HA 2.365 . 2.930 2.936 2.934 2.939 0.009 20 0 "[ . 1 . 2]" 1
348 1 20 VAL H 1 20 VAL HB 2.365 . 2.930 2.641 2.632 2.653 . 0 0 "[ . 1 . 2]" 1
349 1 20 VAL H 1 20 VAL MG1 3.080 . 4.360 3.846 3.842 3.851 . 0 0 "[ . 1 . 2]" 1
350 1 20 VAL H 1 20 VAL MG2 3.080 . 4.360 2.554 2.449 2.722 . 0 0 "[ . 1 . 2]" 1
351 1 20 VAL H 1 20 VAL QG 2.870 . 3.940 2.519 2.422 2.669 . 0 0 "[ . 1 . 2]" 1
352 1 20 VAL H 1 21 ARG H 2.640 . 3.480 2.270 2.249 2.341 . 0 0 "[ . 1 . 2]" 1
353 1 20 VAL H 1 21 ARG QG 4.095 . 6.390 4.591 3.478 5.767 . 0 0 "[ . 1 . 2]" 1
354 1 20 VAL H 1 99 LEU QD 4.600 . 7.400 4.997 4.760 5.205 . 0 0 "[ . 1 . 2]" 1
355 1 20 VAL HA 1 21 ARG H 2.440 . 3.080 3.144 3.118 3.159 0.079 4 0 "[ . 1 . 2]" 1
356 1 20 VAL HB 1 21 ARG H 2.750 . 3.700 3.795 3.780 3.824 0.124 20 0 "[ . 1 . 2]" 1
357 1 20 VAL MG1 1 21 ARG H 3.420 . 5.040 4.168 4.159 4.176 . 0 0 "[ . 1 . 2]" 1
358 1 20 VAL MG2 1 21 ARG H 3.420 . 5.040 4.158 4.143 4.200 . 0 0 "[ . 1 . 2]" 1
359 1 20 VAL QG 1 22 LYS H 4.395 . 6.990 4.242 4.209 4.272 . 0 0 "[ . 1 . 2]" 1
360 1 21 ARG H 1 21 ARG QG 3.585 . 5.370 2.852 1.963 4.027 . 0 0 "[ . 1 . 2]" 1
361 1 21 ARG H 1 21 ARG QD 4.095 . 6.390 3.918 1.876 4.496 . 0 0 "[ . 1 . 2]" 1
362 1 21 ARG HA 1 22 LYS H 2.535 . 3.270 2.133 2.123 2.138 . 0 0 "[ . 1 . 2]" 1
363 1 21 ARG QB 1 22 LYS H 3.120 . 4.440 3.596 3.400 3.902 . 0 0 "[ . 1 . 2]" 1
364 1 22 LYS H 1 22 LYS QG 3.710 . 5.620 4.107 4.050 4.196 . 0 0 "[ . 1 . 2]" 1
365 1 22 LYS H 1 32 ARG QD 4.095 . 6.390 3.697 3.209 4.685 . 0 0 "[ . 1 . 2]" 1
366 1 22 LYS QG 1 23 SER H 3.615 . 5.430 2.445 1.978 3.364 . 0 0 "[ . 1 . 2]" 1
367 1 22 LYS QE 1 24 SER HA 4.095 . 6.390 4.535 3.445 5.625 . 0 0 "[ . 1 . 2]" 1
368 1 22 LYS QE 1 24 SER QB 4.540 . 7.280 4.334 2.804 5.422 . 0 0 "[ . 1 . 2]" 1
369 1 23 SER HA 1 29 ILE HA 3.185 . 4.570 4.293 4.054 4.603 0.033 6 0 "[ . 1 . 2]" 1
370 1 23 SER HA 1 29 ILE HB 3.605 . 5.410 5.286 5.161 5.517 0.107 6 0 "[ . 1 . 2]" 1
371 1 23 SER HA 1 29 ILE MG 3.745 . 5.690 4.697 4.607 4.731 . 0 0 "[ . 1 . 2]" 1
372 1 23 SER HA 1 29 ILE HG12 2.905 . 4.010 3.578 3.314 3.871 . 0 0 "[ . 1 . 2]" 1
373 1 23 SER HA 1 29 ILE HG13 2.905 . 4.010 3.033 2.774 3.698 . 0 0 "[ . 1 . 2]" 1
374 1 23 SER HA 1 29 ILE QG 2.600 . 3.400 2.841 2.689 3.104 . 0 0 "[ . 1 . 2]" 1
375 1 23 SER HA 1 29 ILE MD 2.970 . 4.140 1.862 1.813 1.925 . 0 0 "[ . 1 . 2]" 1
376 1 23 SER HB2 1 29 ILE HG12 3.230 . 4.660 3.348 2.713 4.593 . 0 0 "[ . 1 . 2]" 1
377 1 23 SER HB2 1 29 ILE HG13 3.230 . 4.660 3.411 2.813 4.419 . 0 0 "[ . 1 . 2]" 1
378 1 23 SER HB2 1 29 ILE MD 3.110 . 4.420 2.574 2.193 3.342 . 0 0 "[ . 1 . 2]" 1
379 1 23 SER HB3 1 29 ILE HG12 3.230 . 4.660 3.648 2.616 4.580 . 0 0 "[ . 1 . 2]" 1
380 1 23 SER HB3 1 29 ILE HG13 3.230 . 4.660 3.090 2.592 3.902 . 0 0 "[ . 1 . 2]" 1
381 1 23 SER HB3 1 29 ILE MD 3.110 . 4.420 2.839 2.036 3.426 . 0 0 "[ . 1 . 2]" 1
382 1 23 SER QB 1 29 ILE QG 2.985 . 4.170 2.559 2.309 3.289 . 0 0 "[ . 1 . 2]" 1
383 1 23 SER QB 1 29 ILE MD 3.035 . 4.270 2.253 1.945 2.418 . 0 0 "[ . 1 . 2]" 1
384 1 24 SER H 1 25 THR H 3.125 . 4.450 2.437 2.312 2.629 . 0 0 "[ . 1 . 2]" 1
385 1 24 SER H 1 28 GLU QB 3.490 . 5.180 3.436 3.137 4.675 . 0 0 "[ . 1 . 2]" 1
386 1 24 SER H 1 29 ILE QG 3.770 . 5.740 3.608 2.977 3.809 . 0 0 "[ . 1 . 2]" 1
387 1 24 SER HA 1 25 THR H 2.705 . 3.610 3.560 3.549 3.566 . 0 0 "[ . 1 . 2]" 1
388 1 24 SER HA 1 25 THR MG 3.295 . 4.790 3.852 3.788 3.906 . 0 0 "[ . 1 . 2]" 1
389 1 24 SER QB 1 25 THR H 3.040 . 4.280 2.206 1.977 3.011 . 0 0 "[ . 1 . 2]" 1
390 1 24 SER QB 1 25 THR MG 3.960 . 6.120 2.547 2.213 3.105 . 0 0 "[ . 1 . 2]" 1
391 1 25 THR H 1 25 THR HB 2.750 . 3.700 3.820 3.810 3.825 0.125 4 0 "[ . 1 . 2]" 1
392 1 25 THR H 1 25 THR MG 3.095 . 4.390 2.737 2.626 2.956 . 0 0 "[ . 1 . 2]" 1
393 1 25 THR H 1 28 GLU H 2.705 . 3.610 3.519 3.368 3.672 0.062 1 0 "[ . 1 . 2]" 1
394 1 25 THR H 1 28 GLU QB 3.120 . 4.440 2.497 2.110 3.920 . 0 0 "[ . 1 . 2]" 1
395 1 25 THR H 1 28 GLU QG 3.845 . 5.890 3.130 1.926 3.734 . 0 0 "[ . 1 . 2]" 1
396 1 25 THR H 1 29 ILE HG12 3.650 . 5.500 4.732 3.404 5.217 . 0 0 "[ . 1 . 2]" 1
397 1 25 THR H 1 29 ILE HG13 3.650 . 5.500 5.353 4.840 5.530 0.030 3 0 "[ . 1 . 2]" 1
398 1 25 THR H 1 29 ILE QG 3.485 . 5.170 4.404 3.340 4.710 . 0 0 "[ . 1 . 2]" 1
399 1 25 THR HA 1 26 PRO HA 3.110 . 4.420 4.428 4.393 4.440 0.020 10 0 "[ . 1 . 2]" 1
400 1 25 THR HA 1 26 PRO HG2 3.125 . 4.450 4.193 4.124 4.454 0.004 3 0 "[ . 1 . 2]" 1
401 1 25 THR HA 1 26 PRO HG3 3.125 . 4.450 4.502 4.464 4.515 0.065 9 0 "[ . 1 . 2]" 1
402 1 25 THR HA 1 26 PRO QG 3.045 . 4.290 3.855 3.815 3.972 . 0 0 "[ . 1 . 2]" 1
403 1 25 THR HA 1 26 PRO QD 2.685 . 3.570 1.963 1.925 2.077 . 0 0 "[ . 1 . 2]" 1
404 1 25 THR HB 1 26 PRO HG2 3.420 . 5.040 3.808 3.689 4.062 . 0 0 "[ . 1 . 2]" 1
405 1 25 THR HB 1 26 PRO HG3 3.420 . 5.040 4.956 4.822 5.038 . 0 0 "[ . 1 . 2]" 1
406 1 25 THR HB 1 26 PRO QG 3.085 . 4.370 3.691 3.581 3.890 . 0 0 "[ . 1 . 2]" 1
407 1 25 THR HB 1 26 PRO QD 2.735 . 3.670 2.508 2.166 2.643 . 0 0 "[ . 1 . 2]" 1
408 1 25 THR HB 1 27 GLU H 2.610 . 3.420 3.068 2.922 3.119 . 0 0 "[ . 1 . 2]" 1
409 1 25 THR HB 1 28 GLU H 2.905 . 4.010 4.007 3.948 4.042 0.032 3 0 "[ . 1 . 2]" 1
410 1 25 THR HB 1 28 GLU QB 4.095 . 6.390 4.921 4.726 5.436 . 0 0 "[ . 1 . 2]" 1
411 1 25 THR HB 1 28 GLU QG 3.490 . 5.180 4.234 3.835 4.673 . 0 0 "[ . 1 . 2]" 1
412 1 25 THR MG 1 26 PRO QD 3.790 . 5.780 3.451 3.233 3.521 . 0 0 "[ . 1 . 2]" 1
413 1 25 THR MG 1 27 GLU H 3.715 . 5.630 4.430 4.356 4.524 . 0 0 "[ . 1 . 2]" 1
414 1 25 THR MG 1 28 GLU H 3.605 . 5.410 4.337 4.286 4.504 . 0 0 "[ . 1 . 2]" 1
415 1 26 PRO HA 1 28 GLU H 3.060 . 4.320 4.325 4.217 4.350 0.030 3 0 "[ . 1 . 2]" 1
416 1 26 PRO HA 1 29 ILE H 2.660 . 3.520 3.444 3.172 3.546 0.026 3 0 "[ . 1 . 2]" 1
417 1 26 PRO HA 1 29 ILE HB 2.425 . 3.050 2.478 2.056 2.595 . 0 0 "[ . 1 . 2]" 1
418 1 26 PRO HA 1 29 ILE MG 3.205 . 4.610 3.736 3.429 3.817 . 0 0 "[ . 1 . 2]" 1
419 1 26 PRO HA 1 29 ILE HG12 3.650 . 5.500 3.466 3.038 3.703 . 0 0 "[ . 1 . 2]" 1
420 1 26 PRO HA 1 29 ILE HG13 3.650 . 5.500 4.601 3.096 5.073 . 0 0 "[ . 1 . 2]" 1
421 1 26 PRO HA 1 29 ILE QG 3.410 . 5.020 3.341 2.732 3.617 . 0 0 "[ . 1 . 2]" 1
422 1 26 PRO HA 1 29 ILE MD 3.435 . 5.070 3.517 2.922 4.360 . 0 0 "[ . 1 . 2]" 1
423 1 27 GLU H 1 27 GLU HA 2.300 . 2.800 2.841 2.810 2.854 0.054 15 0 "[ . 1 . 2]" 1
424 1 27 GLU H 1 27 GLU HB2 2.300 . 2.800 2.384 2.279 2.532 . 0 0 "[ . 1 . 2]" 1
425 1 27 GLU H 1 27 GLU HB3 2.300 . 2.800 2.711 2.564 2.804 0.004 16 0 "[ . 1 . 2]" 1
426 1 27 GLU H 1 27 GLU QG 3.320 . 4.840 3.976 3.878 4.069 . 0 0 "[ . 1 . 2]" 1
427 1 27 GLU H 1 28 GLU H 2.520 . 3.240 2.533 2.479 2.673 . 0 0 "[ . 1 . 2]" 1
428 1 27 GLU H 1 29 ILE H 3.325 . 4.850 3.947 3.810 4.028 . 0 0 "[ . 1 . 2]" 1
429 1 27 GLU HA 1 29 ILE H 3.090 . 4.380 4.441 4.401 4.478 0.098 16 0 "[ . 1 . 2]" 1
430 1 27 GLU HA 1 30 LYS QE 3.770 . 5.740 3.974 2.651 4.868 . 0 0 "[ . 1 . 2]" 1
431 1 28 GLU H 1 28 GLU HA 2.335 . 2.870 2.881 2.872 2.899 0.029 9 0 "[ . 1 . 2]" 1
432 1 28 GLU H 1 29 ILE H 2.365 . 2.930 2.410 2.310 2.461 . 0 0 "[ . 1 . 2]" 1
433 1 28 GLU H 1 30 LYS H 3.325 . 4.850 3.949 3.893 4.020 . 0 0 "[ . 1 . 2]" 1
434 1 28 GLU HA 1 29 ILE H 2.675 . 3.550 3.513 3.484 3.528 . 0 0 "[ . 1 . 2]" 1
435 1 28 GLU HA 1 31 LYS H 2.595 . 3.390 3.437 3.412 3.456 0.066 1 0 "[ . 1 . 2]" 1
436 1 28 GLU QG 1 29 ILE H 3.675 . 5.550 4.024 2.077 4.259 . 0 0 "[ . 1 . 2]" 1
437 1 29 ILE H 1 29 ILE HB 2.195 . 2.590 2.320 2.274 2.422 . 0 0 "[ . 1 . 2]" 1
438 1 29 ILE H 1 29 ILE HG12 3.090 . 4.380 3.434 2.300 3.807 . 0 0 "[ . 1 . 2]" 1
439 1 29 ILE H 1 29 ILE HG13 3.090 . 4.380 3.848 3.719 4.036 . 0 0 "[ . 1 . 2]" 1
440 1 29 ILE H 1 29 ILE QG 2.695 . 3.590 3.157 2.279 3.403 . 0 0 "[ . 1 . 2]" 1
441 1 29 ILE H 1 30 LYS H 2.640 . 3.480 2.663 2.614 2.713 . 0 0 "[ . 1 . 2]" 1
442 1 29 ILE HA 1 30 LYS H 2.610 . 3.420 3.470 3.456 3.483 0.063 2 0 "[ . 1 . 2]" 1
443 1 29 ILE HA 1 31 LYS H 3.140 . 4.480 3.797 3.706 3.864 . 0 0 "[ . 1 . 2]" 1
444 1 29 ILE HA 1 32 ARG H 2.625 . 3.450 2.929 2.901 2.967 . 0 0 "[ . 1 . 2]" 1
445 1 29 ILE HA 1 32 ARG HA 3.075 . 4.350 4.405 4.357 4.448 0.098 8 0 "[ . 1 . 2]" 1
446 1 29 ILE HA 1 32 ARG QB 3.555 . 5.310 2.017 1.974 2.071 . 0 0 "[ . 1 . 2]" 1
447 1 29 ILE HA 1 32 ARG HG2 3.200 . 4.600 2.858 2.755 2.943 . 0 0 "[ . 1 . 2]" 1
448 1 29 ILE HA 1 32 ARG HG3 3.200 . 4.600 4.124 4.048 4.210 . 0 0 "[ . 1 . 2]" 1
449 1 29 ILE HA 1 32 ARG QG 2.935 . 4.070 2.808 2.716 2.887 . 0 0 "[ . 1 . 2]" 1
450 1 29 ILE HA 1 32 ARG HD2 2.845 . 3.890 2.292 1.985 2.578 . 0 0 "[ . 1 . 2]" 1
451 1 29 ILE HA 1 32 ARG HD3 2.845 . 3.890 3.218 2.349 3.363 . 0 0 "[ . 1 . 2]" 1
452 1 29 ILE HA 1 32 ARG QD 2.755 . 3.710 2.230 1.965 2.490 . 0 0 "[ . 1 . 2]" 1
453 1 29 ILE MG 1 31 LYS H 3.825 . 5.850 4.689 4.638 4.749 . 0 0 "[ . 1 . 2]" 1
454 1 29 ILE MG 1 58 GLY HA3 3.670 . 5.540 4.375 4.333 4.434 . 0 0 "[ . 1 . 2]" 1
455 1 29 ILE MG 1 58 GLY HA2 3.670 . 5.540 3.877 3.697 3.989 . 0 0 "[ . 1 . 2]" 1
456 1 29 ILE MG 1 58 GLY QA 3.555 . 5.310 3.629 3.507 3.715 . 0 0 "[ . 1 . 2]" 1
457 1 29 ILE QG 1 30 LYS H 3.725 . 5.650 4.667 4.278 4.788 . 0 0 "[ . 1 . 2]" 1
458 1 29 ILE MD 1 31 LYS H 4.025 . 6.250 5.034 4.890 5.132 . 0 0 "[ . 1 . 2]" 1
459 1 29 ILE MD 1 32 ARG HD2 3.000 . 4.200 3.213 3.149 3.357 . 0 0 "[ . 1 . 2]" 1
460 1 29 ILE MD 1 32 ARG HD3 3.000 . 4.200 2.995 1.974 3.217 . 0 0 "[ . 1 . 2]" 1
461 1 30 LYS H 1 30 LYS HA 2.315 . 2.830 2.818 2.808 2.832 0.002 7 0 "[ . 1 . 2]" 1
462 1 30 LYS H 1 30 LYS QB 2.700 . 3.600 2.280 2.177 2.734 . 0 0 "[ . 1 . 2]" 1
463 1 30 LYS H 1 30 LYS QE 4.095 . 6.390 4.518 3.892 5.180 . 0 0 "[ . 1 . 2]" 1
464 1 30 LYS H 1 31 LYS H 2.315 . 2.830 2.553 2.505 2.591 . 0 0 "[ . 1 . 2]" 1
465 1 30 LYS HA 1 30 LYS QE 4.095 . 6.390 4.414 3.786 4.952 . 0 0 "[ . 1 . 2]" 1
466 1 30 LYS HA 1 31 LYS H 2.580 . 3.360 3.443 3.424 3.455 0.095 16 0 "[ . 1 . 2]" 1
467 1 30 LYS HA 1 32 ARG H 2.780 . 3.760 3.891 3.866 3.922 0.162 4 0 "[ . 1 . 2]" 1
468 1 30 LYS HA 1 56 LEU QB 3.040 . 4.280 3.867 3.638 3.957 . 0 0 "[ . 1 . 2]" 1
469 1 30 LYS HA 1 57 VAL HB 3.650 . 5.500 3.561 3.527 3.618 . 0 0 "[ . 1 . 2]" 1
470 1 30 LYS HA 1 57 VAL QG 3.575 . 5.350 4.112 4.084 4.148 . 0 0 "[ . 1 . 2]" 1
471 1 30 LYS HA 1 58 GLY H 2.425 . 3.050 2.318 2.138 2.417 . 0 0 "[ . 1 . 2]" 1
472 1 30 LYS HA 1 58 GLY HA3 2.565 . 3.330 1.954 1.916 2.017 . 0 0 "[ . 1 . 2]" 1
473 1 30 LYS HA 1 58 GLY HA2 2.565 . 3.330 2.957 2.784 3.091 . 0 0 "[ . 1 . 2]" 1
474 1 30 LYS HA 1 59 ASP H 3.000 . 4.200 4.098 3.902 4.228 0.028 4 0 "[ . 1 . 2]" 1
475 1 30 LYS QB 1 58 GLY H 3.615 . 5.430 4.179 3.737 4.485 . 0 0 "[ . 1 . 2]" 1
476 1 30 LYS QB 1 58 GLY HA3 3.445 . 5.090 2.758 1.943 3.319 . 0 0 "[ . 1 . 2]" 1
477 1 30 LYS QB 1 58 GLY HA2 3.445 . 5.090 3.833 3.106 4.292 . 0 0 "[ . 1 . 2]" 1
478 1 30 LYS QG 1 31 LYS H 3.400 . 5.000 3.991 2.498 4.403 . 0 0 "[ . 1 . 2]" 1
479 1 30 LYS QG 1 58 GLY H 4.095 . 6.390 3.610 3.181 5.115 . 0 0 "[ . 1 . 2]" 1
480 1 30 LYS QG 1 58 GLY HA3 4.095 . 6.390 2.098 1.831 4.029 . 0 0 "[ . 1 . 2]" 1
481 1 30 LYS QG 1 58 GLY HA2 4.095 . 6.390 3.318 2.524 5.209 . 0 0 "[ . 1 . 2]" 1
482 1 30 LYS QG 1 58 GLY QA 3.965 . 6.130 2.062 1.817 3.901 . 0 0 "[ . 1 . 2]" 1
483 1 30 LYS QD 1 58 GLY HA3 3.600 . 5.400 3.223 2.187 4.099 . 0 0 "[ . 1 . 2]" 1
484 1 30 LYS QD 1 58 GLY HA2 3.600 . 5.400 4.138 3.162 4.922 . 0 0 "[ . 1 . 2]" 1
485 1 30 LYS QD 1 58 GLY QA 3.445 . 5.090 3.101 2.149 3.791 . 0 0 "[ . 1 . 2]" 1
486 1 30 LYS QE 1 31 LYS HA 4.095 . 6.390 5.523 3.595 5.769 . 0 0 "[ . 1 . 2]" 1
487 1 30 LYS QE 1 58 GLY HA3 4.095 . 6.390 4.198 2.828 4.546 . 0 0 "[ . 1 . 2]" 1
488 1 30 LYS QE 1 58 GLY HA2 4.095 . 6.390 5.352 3.905 5.766 . 0 0 "[ . 1 . 2]" 1
489 1 31 LYS H 1 31 LYS HB2 2.395 . 2.990 2.923 2.899 2.961 . 0 0 "[ . 1 . 2]" 1
490 1 31 LYS H 1 31 LYS HB3 2.395 . 2.990 2.347 2.337 2.364 . 0 0 "[ . 1 . 2]" 1
491 1 31 LYS H 1 31 LYS QB 2.255 . 2.710 2.256 2.250 2.267 . 0 0 "[ . 1 . 2]" 1
492 1 31 LYS H 1 31 LYS QG 3.225 . 4.650 3.896 3.890 3.909 . 0 0 "[ . 1 . 2]" 1
493 1 31 LYS H 1 31 LYS QD 3.415 . 5.030 4.572 4.554 4.592 . 0 0 "[ . 1 . 2]" 1
494 1 31 LYS H 1 32 ARG H 2.300 . 2.800 2.235 2.196 2.261 . 0 0 "[ . 1 . 2]" 1
495 1 31 LYS H 1 32 ARG HA 3.200 . 4.600 4.703 4.665 4.718 0.118 14 0 "[ . 1 . 2]" 1
496 1 31 LYS HA 1 32 ARG H 2.520 . 3.240 3.361 3.349 3.368 0.128 11 0 "[ . 1 . 2]" 1
497 1 31 LYS HA 1 56 LEU MD1 2.895 . 3.990 3.010 2.923 3.174 . 0 0 "[ . 1 . 2]" 1
498 1 31 LYS HA 1 56 LEU MD2 3.620 . 5.440 3.018 2.718 3.298 . 0 0 "[ . 1 . 2]" 1
499 1 31 LYS HG2 1 32 ARG H 3.170 . 4.540 4.411 4.348 4.450 . 0 0 "[ . 1 . 2]" 1
500 1 31 LYS HG3 1 32 ARG H 3.170 . 4.540 4.546 4.529 4.559 0.019 8 0 "[ . 1 . 2]" 1
501 1 31 LYS QG 1 32 ARG H 3.040 . 4.280 3.987 3.960 3.999 . 0 0 "[ . 1 . 2]" 1
502 1 32 ARG H 1 32 ARG QG 2.900 . 4.000 3.730 3.695 3.765 . 0 0 "[ . 1 . 2]" 1
503 1 32 ARG H 1 32 ARG HD2 3.555 . 5.310 2.607 2.379 2.714 . 0 0 "[ . 1 . 2]" 1
504 1 32 ARG H 1 32 ARG HD3 3.555 . 5.310 4.277 3.799 4.391 . 0 0 "[ . 1 . 2]" 1
505 1 32 ARG H 1 32 ARG QD 3.410 . 5.020 2.586 2.356 2.689 . 0 0 "[ . 1 . 2]" 1
506 1 32 ARG H 1 33 LYS H 3.200 . 4.600 4.445 4.398 4.591 . 0 0 "[ . 1 . 2]" 1
507 1 32 ARG H 1 57 VAL H 2.955 . 4.110 4.094 4.040 4.125 0.015 15 0 "[ . 1 . 2]" 1
508 1 32 ARG H 1 57 VAL HB 3.110 . 4.420 4.153 4.047 4.276 . 0 0 "[ . 1 . 2]" 1
509 1 32 ARG HA 1 32 ARG HD2 2.690 . 3.580 2.875 2.470 3.112 . 0 0 "[ . 1 . 2]" 1
510 1 32 ARG HA 1 32 ARG HD3 2.690 . 3.580 3.717 3.673 3.807 0.227 9 0 "[ . 1 . 2]" 1
511 1 32 ARG HA 1 32 ARG QD 2.600 . 3.400 2.780 2.441 2.970 . 0 0 "[ . 1 . 2]" 1
512 1 32 ARG HA 1 33 LYS H 2.240 . 2.680 2.172 2.153 2.214 . 0 0 "[ . 1 . 2]" 1
513 1 32 ARG QD 1 33 LYS H 3.970 . 6.140 4.704 4.492 4.862 . 0 0 "[ . 1 . 2]" 1
514 1 33 LYS H 1 56 LEU MD2 3.310 . 4.820 3.781 3.621 3.938 . 0 0 "[ . 1 . 2]" 1
515 1 33 LYS HA 1 56 LEU HA 2.210 . 2.620 2.634 2.544 2.652 0.032 9 0 "[ . 1 . 2]" 1
516 1 33 LYS HA 1 56 LEU MD2 2.615 . 3.430 2.154 1.977 2.426 . 0 0 "[ . 1 . 2]" 1
517 1 33 LYS HA 1 57 VAL H 2.920 . 4.040 4.048 3.979 4.069 0.029 15 0 "[ . 1 . 2]" 1
518 1 33 LYS QE 1 56 LEU MD2 4.110 . 6.420 3.778 2.158 4.859 . 0 0 "[ . 1 . 2]" 1
519 1 34 LYS H 1 34 LYS QG 3.955 . 6.110 4.006 3.986 4.047 . 0 0 "[ . 1 . 2]" 1
520 1 34 LYS H 1 35 ALA H 2.380 . 2.960 2.199 2.005 2.280 . 0 0 "[ . 1 . 2]" 1
521 1 34 LYS H 1 56 LEU HA 2.705 . 3.610 2.289 2.119 2.374 . 0 0 "[ . 1 . 2]" 1
522 1 34 LYS H 1 56 LEU MD2 3.250 . 4.700 3.497 3.318 3.671 . 0 0 "[ . 1 . 2]" 1
523 1 34 LYS HA 1 35 ALA H 2.690 . 3.580 3.488 3.471 3.523 . 0 0 "[ . 1 . 2]" 1
524 1 34 LYS HA 1 57 VAL QG 3.730 . 5.660 3.588 3.306 3.715 . 0 0 "[ . 1 . 2]" 1
525 1 34 LYS HA 1 86 ASP QB 3.550 . 5.300 2.931 2.744 3.084 . 0 0 "[ . 1 . 2]" 1
526 1 34 LYS HB2 1 57 VAL HA 2.815 . 3.830 3.734 3.301 3.858 0.028 5 0 "[ . 1 . 2]" 1
527 1 34 LYS HB3 1 57 VAL HA 2.815 . 3.830 3.815 3.685 3.861 0.031 20 0 "[ . 1 . 2]" 1
528 1 34 LYS QB 1 35 ALA H 3.150 . 4.500 2.854 2.677 2.957 . 0 0 "[ . 1 . 2]" 1
529 1 34 LYS QG 1 35 ALA H 3.505 . 5.210 3.887 3.787 4.167 . 0 0 "[ . 1 . 2]" 1
530 1 34 LYS QD 1 86 ASP QB 4.475 . 7.150 4.016 2.144 4.756 . 0 0 "[ . 1 . 2]" 1
531 1 35 ALA H 1 36 VAL H 2.955 . 4.110 4.264 4.233 4.300 0.190 11 0 "[ . 1 . 2]" 1
532 1 35 ALA H 1 55 ILE H 2.535 . 3.270 3.440 3.400 3.468 0.198 16 0 "[ . 1 . 2]" 1
533 1 35 ALA H 1 55 ILE HB 3.170 . 4.540 3.549 3.365 3.679 . 0 0 "[ . 1 . 2]" 1
534 1 35 ALA H 1 55 ILE MG 3.870 . 5.940 3.776 3.526 3.917 . 0 0 "[ . 1 . 2]" 1
535 1 35 ALA H 1 56 LEU H 3.450 . 5.100 5.033 4.926 5.092 . 0 0 "[ . 1 . 2]" 1
536 1 35 ALA H 1 56 LEU HA 2.675 . 3.550 3.576 3.544 3.605 0.055 19 0 "[ . 1 . 2]" 1
537 1 35 ALA H 1 56 LEU MD2 4.165 . 6.530 4.361 4.253 4.454 . 0 0 "[ . 1 . 2]" 1
538 1 35 ALA H 1 57 VAL QG 4.350 . 6.900 4.657 4.604 4.780 . 0 0 "[ . 1 . 2]" 1
539 1 35 ALA HA 1 36 VAL H 2.240 . 2.680 2.224 2.195 2.341 . 0 0 "[ . 1 . 2]" 1
540 1 35 ALA HA 1 36 VAL MG2 3.545 . 5.290 3.367 3.276 3.415 . 0 0 "[ . 1 . 2]" 1
541 1 35 ALA HA 1 85 TYR HA 2.195 . 2.590 2.083 1.987 2.203 . 0 0 "[ . 1 . 2]" 1
542 1 35 ALA HA 1 85 TYR HB2 2.970 . 4.140 2.902 2.661 3.713 . 0 0 "[ . 1 . 2]" 1
543 1 35 ALA HA 1 85 TYR QD 4.725 . 7.650 2.832 2.624 4.187 . 0 0 "[ . 1 . 2]" 1
544 1 35 ALA HA 1 85 TYR QE 4.725 . 7.650 5.059 4.833 6.046 . 0 0 "[ . 1 . 2]" 1
545 1 35 ALA HA 1 86 ASP H 2.750 . 3.700 3.486 3.360 3.604 . 0 0 "[ . 1 . 2]" 1
546 1 35 ALA MB 1 36 VAL H 2.985 . 4.170 2.889 2.474 2.984 . 0 0 "[ . 1 . 2]" 1
547 1 35 ALA MB 1 55 ILE H 3.155 . 4.510 3.166 3.047 3.662 . 0 0 "[ . 1 . 2]" 1
548 1 35 ALA MB 1 85 TYR HB2 3.495 . 5.190 2.125 1.971 2.470 . 0 0 "[ . 1 . 2]" 1
549 1 35 ALA MB 1 85 TYR QD 4.185 . 6.570 1.889 1.862 1.922 . 0 0 "[ . 1 . 2]" 1
550 1 35 ALA MB 1 86 ASP H 3.450 . 5.100 3.656 2.612 4.001 . 0 0 "[ . 1 . 2]" 1
551 1 36 VAL H 1 36 VAL HB 2.800 . 3.800 3.873 3.858 3.900 0.100 11 0 "[ . 1 . 2]" 1
552 1 36 VAL H 1 36 VAL MG1 2.985 . 4.170 3.466 3.445 3.481 . 0 0 "[ . 1 . 2]" 1
553 1 36 VAL H 1 36 VAL MG2 3.015 . 4.230 2.179 2.125 2.350 . 0 0 "[ . 1 . 2]" 1
554 1 36 VAL H 1 37 LEU H 3.090 . 4.380 4.236 4.197 4.296 . 0 0 "[ . 1 . 2]" 1
555 1 36 VAL H 1 54 GLN HA 3.230 . 4.660 4.687 4.640 4.757 0.097 11 0 "[ . 1 . 2]" 1
556 1 36 VAL H 1 83 ALA MB 3.295 . 4.790 3.837 3.795 3.866 . 0 0 "[ . 1 . 2]" 1
557 1 36 VAL H 1 84 LEU H 2.675 . 3.550 3.242 3.090 3.372 . 0 0 "[ . 1 . 2]" 1
558 1 36 VAL H 1 85 TYR HA 2.660 . 3.520 3.457 3.370 3.555 0.035 12 0 "[ . 1 . 2]" 1
559 1 36 VAL H 1 85 TYR HB2 3.125 . 4.450 3.578 3.431 3.906 . 0 0 "[ . 1 . 2]" 1
560 1 36 VAL HA 1 36 VAL HB 2.315 . 2.830 2.554 2.535 2.560 . 0 0 "[ . 1 . 2]" 1
561 1 36 VAL HA 1 37 LEU H 2.240 . 2.680 2.190 2.161 2.295 . 0 0 "[ . 1 . 2]" 1
562 1 36 VAL HA 1 54 GLN HA 2.225 . 2.650 2.078 1.959 2.126 . 0 0 "[ . 1 . 2]" 1
563 1 36 VAL HA 1 54 GLN QB 3.550 . 5.300 2.702 2.443 3.211 . 0 0 "[ . 1 . 2]" 1
564 1 36 VAL HA 1 54 GLN QG 3.675 . 5.550 4.246 3.715 4.437 . 0 0 "[ . 1 . 2]" 1
565 1 36 VAL HA 1 55 ILE H 2.795 . 3.790 2.900 2.678 3.032 . 0 0 "[ . 1 . 2]" 1
566 1 36 VAL HB 1 37 LEU H 2.520 . 3.240 2.940 2.641 3.018 . 0 0 "[ . 1 . 2]" 1
567 1 36 VAL HB 1 38 PHE QD 4.660 . 7.520 4.616 4.203 4.902 . 0 0 "[ . 1 . 2]" 1
568 1 36 VAL HB 1 38 PHE QE 4.725 . 7.650 3.916 3.336 4.374 . 0 0 "[ . 1 . 2]" 1
569 1 36 VAL HB 1 54 GLN HA 3.075 . 4.350 4.145 3.533 4.265 . 0 0 "[ . 1 . 2]" 1
570 1 36 VAL MG1 1 37 LEU H 3.080 . 4.360 3.592 3.565 3.609 . 0 0 "[ . 1 . 2]" 1
571 1 36 VAL MG1 1 38 PHE QD 4.570 . 7.340 5.529 5.256 5.684 . 0 0 "[ . 1 . 2]" 1
572 1 36 VAL MG1 1 38 PHE QE 4.570 . 7.340 4.606 4.249 4.827 . 0 0 "[ . 1 . 2]" 1
573 1 36 VAL MG1 1 84 LEU H 4.025 . 6.250 5.138 5.018 5.222 . 0 0 "[ . 1 . 2]" 1
574 1 36 VAL MG2 1 37 LEU H 3.310 . 4.820 4.023 3.810 4.070 . 0 0 "[ . 1 . 2]" 1
575 1 36 VAL MG2 1 38 PHE QD 4.495 . 7.190 4.036 3.713 4.177 . 0 0 "[ . 1 . 2]" 1
576 1 36 VAL MG2 1 38 PHE QE 4.495 . 7.190 2.663 2.031 2.963 . 0 0 "[ . 1 . 2]" 1
577 1 36 VAL MG2 1 84 LEU H 3.205 . 4.610 2.761 2.557 2.926 . 0 0 "[ . 1 . 2]" 1
578 1 37 LEU H 1 37 LEU HB2 2.395 . 2.990 2.598 2.441 2.675 . 0 0 "[ . 1 . 2]" 1
579 1 37 LEU H 1 37 LEU HB3 2.830 . 3.860 3.721 3.653 3.762 . 0 0 "[ . 1 . 2]" 1
580 1 37 LEU H 1 37 LEU HG 2.845 . 3.890 2.828 2.682 3.045 . 0 0 "[ . 1 . 2]" 1
581 1 37 LEU H 1 37 LEU QD 3.670 . 5.540 3.095 2.950 3.370 . 0 0 "[ . 1 . 2]" 1
582 1 37 LEU H 1 38 PHE H 3.170 . 4.540 4.454 4.397 4.525 . 0 0 "[ . 1 . 2]" 1
583 1 37 LEU H 1 53 LYS HB2 3.510 . 5.220 4.019 3.623 4.225 . 0 0 "[ . 1 . 2]" 1
584 1 37 LEU H 1 53 LYS HB3 3.200 . 4.600 4.375 3.900 4.604 0.004 20 0 "[ . 1 . 2]" 1
585 1 37 LEU H 1 54 GLN HA 2.580 . 3.360 2.807 2.676 3.014 . 0 0 "[ . 1 . 2]" 1
586 1 37 LEU H 1 54 GLN QB 3.880 . 5.960 3.529 3.239 4.137 . 0 0 "[ . 1 . 2]" 1
587 1 37 LEU HA 1 38 PHE H 2.285 . 2.770 2.190 2.153 2.271 . 0 0 "[ . 1 . 2]" 1
588 1 37 LEU HA 1 38 PHE HA 3.110 . 4.420 4.356 4.347 4.383 . 0 0 "[ . 1 . 2]" 1
589 1 37 LEU HA 1 83 ALA H 3.155 . 4.510 4.509 4.469 4.552 0.042 4 0 "[ . 1 . 2]" 1
590 1 37 LEU HA 1 83 ALA HA 2.470 . 3.140 1.960 1.942 1.978 . 0 0 "[ . 1 . 2]" 1
591 1 37 LEU HA 1 83 ALA MB 2.845 . 3.890 2.307 2.086 2.411 . 0 0 "[ . 1 . 2]" 1
592 1 37 LEU HA 1 84 LEU H 2.550 . 3.300 3.389 3.359 3.422 0.122 15 0 "[ . 1 . 2]" 1
593 1 37 LEU HB2 1 38 PHE H 2.845 . 3.890 3.974 3.927 4.010 0.120 19 0 "[ . 1 . 2]" 1
594 1 37 LEU HB3 1 38 PHE H 2.440 . 3.080 3.015 2.754 3.110 0.030 14 0 "[ . 1 . 2]" 1
595 1 37 LEU HB3 1 83 ALA MB 3.155 . 4.510 3.271 2.970 3.618 . 0 0 "[ . 1 . 2]" 1
596 1 37 LEU HG 1 38 PHE H 3.540 . 5.280 4.763 4.635 4.831 . 0 0 "[ . 1 . 2]" 1
597 1 37 LEU HG 1 53 LYS HA 3.650 . 5.500 5.585 5.544 5.653 0.153 14 0 "[ . 1 . 2]" 1
598 1 37 LEU HG 1 71 PHE QD 4.725 . 7.650 3.947 3.629 4.210 . 0 0 "[ . 1 . 2]" 1
599 1 37 LEU HG 1 83 ALA HA 2.905 . 4.010 4.037 3.936 4.073 0.063 3 0 "[ . 1 . 2]" 1
600 1 37 LEU QD 1 38 PHE H 4.615 . 7.430 3.615 3.066 3.857 . 0 0 "[ . 1 . 2]" 1
601 1 37 LEU QD 1 53 LYS HA 4.695 . 7.590 3.131 2.983 3.372 . 0 0 "[ . 1 . 2]" 1
602 1 37 LEU QD 1 71 PHE QD 5.130 . 8.460 2.468 2.178 2.782 . 0 0 "[ . 1 . 2]" 1
603 1 37 LEU QD 1 71 PHE QE 5.770 . 9.740 3.271 3.016 3.447 . 0 0 "[ . 1 . 2]" 1
604 1 37 LEU QD 1 75 LEU MD1 5.205 . 8.610 3.808 3.617 3.999 . 0 0 "[ . 1 . 2]" 1
605 1 37 LEU QD 1 75 LEU MD2 4.820 . 7.840 2.103 1.946 2.284 . 0 0 "[ . 1 . 2]" 1
606 1 37 LEU QD 1 76 PRO HD2 4.320 . 6.840 4.828 4.483 5.018 . 0 0 "[ . 1 . 2]" 1
607 1 37 LEU QD 1 76 PRO HD3 4.445 . 7.090 4.198 3.831 4.396 . 0 0 "[ . 1 . 2]" 1
608 1 37 LEU QD 1 82 TYR H 4.695 . 7.590 4.517 4.031 4.842 . 0 0 "[ . 1 . 2]" 1
609 1 37 LEU QD 1 83 ALA HA 4.105 . 6.410 3.253 2.980 3.506 . 0 0 "[ . 1 . 2]" 1
610 1 37 LEU QD 1 83 ALA MB 4.400 . 7.000 1.670 1.655 1.696 0.145 19 0 "[ . 1 . 2]" 1
611 1 38 PHE H 1 38 PHE HB2 2.565 . 3.330 2.557 2.494 2.605 . 0 0 "[ . 1 . 2]" 1
612 1 38 PHE H 1 38 PHE HB3 2.660 . 3.520 3.667 3.656 3.696 0.176 4 0 "[ . 1 . 2]" 1
613 1 38 PHE H 1 82 TYR H 2.690 . 3.580 3.335 3.140 3.576 . 0 0 "[ . 1 . 2]" 1
614 1 38 PHE H 1 83 ALA HA 2.550 . 3.300 2.789 2.606 2.939 . 0 0 "[ . 1 . 2]" 1
615 1 38 PHE H 1 83 ALA MB 3.170 . 4.540 3.675 3.495 3.748 . 0 0 "[ . 1 . 2]" 1
616 1 38 PHE H 1 84 LEU H 3.230 . 4.660 4.447 4.309 4.653 . 0 0 "[ . 1 . 2]" 1
617 1 38 PHE HA 1 39 CYS H 2.285 . 2.770 2.196 2.177 2.225 . 0 0 "[ . 1 . 2]" 1
618 1 38 PHE HA 1 47 ILE MG 3.885 . 5.970 3.918 3.824 4.001 . 0 0 "[ . 1 . 2]" 1
619 1 38 PHE HA 1 49 VAL HA 2.550 . 3.300 2.088 1.967 2.238 . 0 0 "[ . 1 . 2]" 1
620 1 38 PHE HA 1 49 VAL MG1 4.100 . 6.400 3.516 3.437 3.625 . 0 0 "[ . 1 . 2]" 1
621 1 38 PHE HA 1 49 VAL MG2 4.165 . 6.530 3.436 3.038 3.838 . 0 0 "[ . 1 . 2]" 1
622 1 38 PHE HA 1 50 GLU H 2.580 . 3.360 3.101 2.604 3.306 . 0 0 "[ . 1 . 2]" 1
623 1 38 PHE HB2 1 39 CYS H 2.815 . 3.830 3.886 3.838 3.947 0.117 6 0 "[ . 1 . 2]" 1
624 1 38 PHE HB2 1 47 ILE MG 3.280 . 4.760 2.750 2.536 3.086 . 0 0 "[ . 1 . 2]" 1
625 1 38 PHE HB2 1 124 ILE MD 3.515 . 5.230 2.566 2.207 2.801 . 0 0 "[ . 1 . 2]" 1
626 1 38 PHE HB3 1 47 ILE MG 2.985 . 4.170 2.064 1.980 2.155 . 0 0 "[ . 1 . 2]" 1
627 1 38 PHE HB3 1 124 ILE MD 4.165 . 6.530 3.050 2.797 3.506 . 0 0 "[ . 1 . 2]" 1
628 1 38 PHE QD 1 39 CYS H 4.230 . 6.660 4.130 3.926 4.365 . 0 0 "[ . 1 . 2]" 1
629 1 38 PHE QD 1 47 ILE MG 4.600 . 7.400 3.016 2.207 3.430 . 0 0 "[ . 1 . 2]" 1
630 1 38 PHE QD 1 49 VAL HA 3.625 . 5.450 3.041 2.296 3.971 . 0 0 "[ . 1 . 2]" 1
631 1 38 PHE QD 1 49 VAL MG2 4.200 . 6.600 2.138 1.859 2.903 . 0 0 "[ . 1 . 2]" 1
632 1 38 PHE QD 1 50 GLU H 4.540 . 7.280 4.835 4.156 5.259 . 0 0 "[ . 1 . 2]" 1
633 1 38 PHE QD 1 82 TYR HB2 4.660 . 7.520 3.054 2.381 3.836 . 0 0 "[ . 1 . 2]" 1
634 1 38 PHE QD 1 83 ALA H 4.725 . 7.650 3.865 3.606 4.273 . 0 0 "[ . 1 . 2]" 1
635 1 38 PHE QD 1 83 ALA HA 4.275 . 6.750 2.591 2.152 3.563 . 0 0 "[ . 1 . 2]" 1
636 1 38 PHE QD 1 83 ALA MB 4.865 . 7.930 4.105 3.740 4.788 . 0 0 "[ . 1 . 2]" 1
637 1 38 PHE QD 1 124 ILE MD 4.600 . 7.400 2.862 2.080 3.152 . 0 0 "[ . 1 . 2]" 1
638 1 38 PHE QE 1 49 VAL MG2 4.385 . 6.970 2.194 1.882 2.857 . 0 0 "[ . 1 . 2]" 1
639 1 38 PHE HZ 1 84 LEU H 2.970 . 4.140 4.104 3.877 4.212 0.072 8 0 "[ . 1 . 2]" 1
640 1 39 CYS H 1 47 ILE HA 3.245 . 4.690 4.586 4.525 4.646 . 0 0 "[ . 1 . 2]" 1
641 1 39 CYS H 1 47 ILE MG 3.360 . 4.920 3.391 3.259 3.560 . 0 0 "[ . 1 . 2]" 1
642 1 39 CYS H 1 48 ILE HB 3.650 . 5.500 5.608 5.579 5.634 0.134 11 0 "[ . 1 . 2]" 1
643 1 39 CYS H 1 48 ILE MG 3.435 . 5.070 3.486 3.327 3.547 . 0 0 "[ . 1 . 2]" 1
644 1 39 CYS H 1 48 ILE QG 3.615 . 5.430 4.662 4.466 4.760 . 0 0 "[ . 1 . 2]" 1
645 1 39 CYS H 1 49 VAL H 3.090 . 4.380 4.504 4.454 4.551 0.171 14 0 "[ . 1 . 2]" 1
646 1 39 CYS H 1 49 VAL HA 2.675 . 3.550 3.027 2.930 3.236 . 0 0 "[ . 1 . 2]" 1
647 1 39 CYS H 1 50 GLU H 2.830 . 3.860 3.863 3.763 3.926 0.066 4 0 "[ . 1 . 2]" 1
648 1 39 CYS HA 1 40 LEU H 2.550 . 3.300 2.536 2.526 2.548 . 0 0 "[ . 1 . 2]" 1
649 1 39 CYS HA 1 82 TYR H 2.970 . 4.140 4.113 4.025 4.159 0.019 15 0 "[ . 1 . 2]" 1
650 1 39 CYS HA 1 117 TYR QE 4.460 . 7.120 2.780 2.520 3.136 . 0 0 "[ . 1 . 2]" 1
651 1 39 CYS QB 1 117 TYR QE 5.170 . 8.540 4.466 3.986 4.823 . 0 0 "[ . 1 . 2]" 1
652 1 40 LEU H 1 40 LEU HG 2.765 . 3.730 2.887 2.760 3.064 . 0 0 "[ . 1 . 2]" 1
653 1 40 LEU H 1 40 LEU MD1 3.790 . 5.780 3.130 2.922 3.307 . 0 0 "[ . 1 . 2]" 1
654 1 40 LEU H 1 40 LEU MD2 3.635 . 5.470 4.140 4.090 4.201 . 0 0 "[ . 1 . 2]" 1
655 1 40 LEU H 1 41 SER H 3.200 . 4.600 4.570 4.560 4.580 . 0 0 "[ . 1 . 2]" 1
656 1 40 LEU H 1 81 ARG QG 4.095 . 6.390 4.500 4.220 5.027 . 0 0 "[ . 1 . 2]" 1
657 1 40 LEU HA 1 40 LEU HG 2.485 . 3.170 2.520 2.477 2.540 . 0 0 "[ . 1 . 2]" 1
658 1 40 LEU HA 1 40 LEU MD2 2.785 . 3.770 2.628 2.526 2.707 . 0 0 "[ . 1 . 2]" 1
659 1 40 LEU HA 1 41 SER H 2.350 . 2.900 2.190 2.179 2.204 . 0 0 "[ . 1 . 2]" 1
660 1 40 LEU HA 1 44 LYS HA 2.955 . 4.110 4.197 4.175 4.225 0.115 8 0 "[ . 1 . 2]" 1
661 1 40 LEU HA 1 46 GLN H 3.140 . 4.480 4.204 4.140 4.279 . 0 0 "[ . 1 . 2]" 1
662 1 40 LEU HA 1 47 ILE HA 2.180 . 2.560 2.635 2.615 2.664 0.104 3 0 "[ . 1 . 2]" 1
663 1 40 LEU HA 1 47 ILE MD 3.575 . 5.350 3.188 3.101 3.363 . 0 0 "[ . 1 . 2]" 1
664 1 40 LEU HA 1 48 ILE H 2.580 . 3.360 2.967 2.900 3.085 . 0 0 "[ . 1 . 2]" 1
665 1 40 LEU QB 1 44 LYS HA 2.995 . 4.190 1.914 1.880 1.944 . 0 0 "[ . 1 . 2]" 1
666 1 40 LEU QB 1 117 TYR QE 5.170 . 8.540 3.902 3.659 4.081 . 0 0 "[ . 1 . 2]" 1
667 1 40 LEU HG 1 41 SER H 3.155 . 4.510 4.530 4.454 4.562 0.052 16 0 "[ . 1 . 2]" 1
668 1 40 LEU HG 1 48 ILE H 3.650 . 5.500 4.860 4.825 4.929 . 0 0 "[ . 1 . 2]" 1
669 1 40 LEU HG 1 117 TYR QE 4.630 . 7.460 2.238 2.078 2.471 . 0 0 "[ . 1 . 2]" 1
670 1 40 LEU MD1 1 44 LYS HA 3.375 . 4.950 3.613 3.518 3.690 . 0 0 "[ . 1 . 2]" 1
671 1 40 LEU MD1 1 113 SER HA 4.115 . 6.430 4.073 3.825 4.237 . 0 0 "[ . 1 . 2]" 1
672 1 40 LEU MD1 1 116 ILE MG 3.780 . 5.760 1.673 1.650 1.724 0.150 14 0 "[ . 1 . 2]" 1
673 1 40 LEU MD1 1 117 TYR HA 3.730 . 5.660 3.800 3.544 4.004 . 0 0 "[ . 1 . 2]" 1
674 1 40 LEU MD1 1 117 TYR QD 5.240 . 8.680 3.216 3.014 3.345 . 0 0 "[ . 1 . 2]" 1
675 1 40 LEU MD1 1 117 TYR QE 4.850 . 7.900 2.775 2.577 2.877 . 0 0 "[ . 1 . 2]" 1
676 1 40 LEU MD2 1 41 SER H 3.265 . 4.730 3.453 3.115 3.624 . 0 0 "[ . 1 . 2]" 1
677 1 40 LEU MD2 1 44 LYS H 3.760 . 5.720 4.196 3.931 4.443 . 0 0 "[ . 1 . 2]" 1
678 1 40 LEU MD2 1 44 LYS HA 3.110 . 4.420 2.533 2.208 2.878 . 0 0 "[ . 1 . 2]" 1
679 1 40 LEU MD2 1 46 GLN H 3.635 . 5.470 2.856 2.582 3.064 . 0 0 "[ . 1 . 2]" 1
680 1 40 LEU MD2 1 47 ILE HA 3.095 . 4.390 3.379 3.288 3.523 . 0 0 "[ . 1 . 2]" 1
681 1 40 LEU MD2 1 48 ILE H 3.930 . 6.060 4.716 4.625 4.909 . 0 0 "[ . 1 . 2]" 1
682 1 40 LEU MD2 1 82 TYR QE 5.240 . 8.680 5.307 5.144 5.380 . 0 0 "[ . 1 . 2]" 1
683 1 40 LEU MD2 1 116 ILE MG 3.825 . 5.850 2.726 2.247 3.020 . 0 0 "[ . 1 . 2]" 1
684 1 40 LEU MD2 1 117 TYR HA 3.530 . 5.260 3.871 3.610 4.168 . 0 0 "[ . 1 . 2]" 1
685 1 40 LEU MD2 1 117 TYR QE 5.020 . 8.240 3.605 3.505 3.775 . 0 0 "[ . 1 . 2]" 1
686 1 40 LEU QD 1 44 LYS HB2 4.695 . 7.590 4.101 3.979 4.207 . 0 0 "[ . 1 . 2]" 1
687 1 40 LEU QD 1 44 LYS QG 4.285 . 6.770 2.373 2.264 2.471 . 0 0 "[ . 1 . 2]" 1
688 1 40 LEU QD 1 113 SER HA 4.585 . 7.370 4.015 3.763 4.180 . 0 0 "[ . 1 . 2]" 1
689 1 40 LEU QD 1 116 ILE HB 3.995 . 6.190 3.573 3.474 3.707 . 0 0 "[ . 1 . 2]" 1
690 1 40 LEU QD 1 116 ILE HG12 4.060 . 6.320 2.173 1.953 2.352 . 0 0 "[ . 1 . 2]" 1
691 1 40 LEU QD 1 116 ILE HG13 4.060 . 6.320 3.474 3.241 3.612 . 0 0 "[ . 1 . 2]" 1
692 1 40 LEU QD 1 116 ILE QG 3.955 . 6.110 2.152 1.938 2.322 . 0 0 "[ . 1 . 2]" 1
693 1 40 LEU QD 1 116 ILE MD 4.680 . 7.560 2.071 1.887 2.379 . 0 0 "[ . 1 . 2]" 1
694 1 41 SER H 1 41 SER HB2 2.595 . 3.390 2.752 2.282 2.792 . 0 0 "[ . 1 . 2]" 1
695 1 41 SER H 1 41 SER HB3 2.750 . 3.700 3.554 3.542 3.589 . 0 0 "[ . 1 . 2]" 1
696 1 41 SER H 1 43 ASP H 3.060 . 4.320 4.480 4.472 4.487 0.167 5 0 "[ . 1 . 2]" 1
697 1 41 SER H 1 45 LYS H 2.935 . 4.070 4.088 4.067 4.106 0.036 14 0 "[ . 1 . 2]" 1
698 1 41 SER H 1 46 GLN H 2.690 . 3.580 3.318 3.271 3.374 . 0 0 "[ . 1 . 2]" 1
699 1 41 SER H 1 47 ILE HA 2.780 . 3.760 3.791 3.772 3.804 0.044 19 0 "[ . 1 . 2]" 1
700 1 41 SER H 1 47 ILE MD 3.870 . 5.940 4.765 4.722 4.843 . 0 0 "[ . 1 . 2]" 1
701 1 41 SER H 1 48 ILE MG 3.465 . 5.130 2.206 2.167 2.255 . 0 0 "[ . 1 . 2]" 1
702 1 41 SER H 1 48 ILE MD 3.730 . 5.660 4.638 4.563 4.687 . 0 0 "[ . 1 . 2]" 1
703 1 41 SER HA 1 43 ASP H 2.895 . 3.990 4.051 4.044 4.058 0.068 5 0 "[ . 1 . 2]" 1
704 1 41 SER HB2 1 43 ASP H 2.860 . 3.920 2.370 2.306 2.972 . 0 0 "[ . 1 . 2]" 1
705 1 41 SER HB2 1 45 LYS H 3.295 . 4.790 3.711 3.567 3.763 . 0 0 "[ . 1 . 2]" 1
706 1 41 SER HB2 1 46 GLN H 3.465 . 5.130 3.758 3.284 3.843 . 0 0 "[ . 1 . 2]" 1
707 1 41 SER HB3 1 46 GLN QG 3.645 . 5.490 3.853 3.712 4.019 . 0 0 "[ . 1 . 2]" 1
708 1 42 ASP H 1 42 ASP QB 2.860 . 3.920 2.414 2.099 2.617 . 0 0 "[ . 1 . 2]" 1
709 1 43 ASP H 1 43 ASP HB2 2.690 . 3.580 3.589 3.587 3.592 0.012 20 0 "[ . 1 . 2]" 1
710 1 43 ASP H 1 43 ASP HB3 2.565 . 3.330 2.926 2.904 2.947 . 0 0 "[ . 1 . 2]" 1
711 1 43 ASP HA 1 43 ASP HB2 2.285 . 2.770 2.544 2.539 2.549 . 0 0 "[ . 1 . 2]" 1
712 1 43 ASP HA 1 43 ASP HB3 2.270 . 2.740 2.366 2.364 2.370 . 0 0 "[ . 1 . 2]" 1
713 1 43 ASP HA 1 44 LYS H 2.610 . 3.420 3.406 3.403 3.409 . 0 0 "[ . 1 . 2]" 1
714 1 43 ASP HB2 1 44 LYS H 2.845 . 3.890 3.985 3.982 3.989 0.099 5 0 "[ . 1 . 2]" 1
715 1 44 LYS H 1 44 LYS HA 2.335 . 2.870 2.237 2.235 2.241 . 0 0 "[ . 1 . 2]" 1
716 1 44 LYS H 1 44 LYS HB2 2.795 . 3.790 2.958 2.947 2.969 . 0 0 "[ . 1 . 2]" 1
717 1 44 LYS H 1 44 LYS HB3 2.595 . 3.390 3.579 3.570 3.591 0.201 11 0 "[ . 1 . 2]" 1
718 1 44 LYS H 1 44 LYS HG2 3.110 . 4.420 4.521 4.498 4.541 0.121 6 0 "[ . 1 . 2]" 1
719 1 44 LYS H 1 44 LYS HG3 3.110 . 4.420 4.494 4.479 4.510 0.090 16 0 "[ . 1 . 2]" 1
720 1 44 LYS H 1 44 LYS QD 3.925 . 6.050 5.248 5.093 5.364 . 0 0 "[ . 1 . 2]" 1
721 1 44 LYS H 1 45 LYS H 2.625 . 3.450 2.711 2.692 2.729 . 0 0 "[ . 1 . 2]" 1
722 1 44 LYS HA 1 44 LYS HG2 2.440 . 3.080 2.551 2.509 2.580 . 0 0 "[ . 1 . 2]" 1
723 1 44 LYS HA 1 44 LYS HG3 2.440 . 3.080 2.839 2.805 2.868 . 0 0 "[ . 1 . 2]" 1
724 1 44 LYS HA 1 44 LYS QG 2.275 . 2.750 2.377 2.359 2.390 . 0 0 "[ . 1 . 2]" 1
725 1 44 LYS HA 1 44 LYS QD 3.785 . 5.770 4.063 4.006 4.163 . 0 0 "[ . 1 . 2]" 1
726 1 44 LYS HA 1 44 LYS QE 4.095 . 6.390 4.458 3.962 4.941 . 0 0 "[ . 1 . 2]" 1
727 1 44 LYS HA 1 116 ILE MD 4.165 . 6.530 3.913 3.803 4.182 . 0 0 "[ . 1 . 2]" 1
728 1 45 LYS H 1 45 LYS QG 3.725 . 5.650 4.114 4.065 4.176 . 0 0 "[ . 1 . 2]" 1
729 1 45 LYS H 1 45 LYS QD 3.895 . 5.990 4.693 4.360 4.986 . 0 0 "[ . 1 . 2]" 1
730 1 45 LYS H 1 46 GLN H 2.395 . 2.990 1.960 1.952 1.970 . 0 0 "[ . 1 . 2]" 1
731 1 45 LYS HA 1 46 GLN H 2.625 . 3.450 3.417 3.388 3.444 . 0 0 "[ . 1 . 2]" 1
732 1 46 GLN H 1 46 GLN QG 3.985 . 6.170 2.158 2.055 2.347 . 0 0 "[ . 1 . 2]" 1
733 1 46 GLN H 1 47 ILE H 3.090 . 4.380 4.409 4.404 4.413 0.033 19 0 "[ . 1 . 2]" 1
734 1 46 GLN H 1 48 ILE MG 4.165 . 6.530 4.835 4.752 4.917 . 0 0 "[ . 1 . 2]" 1
735 1 46 GLN HA 1 47 ILE H 2.350 . 2.900 2.543 2.534 2.557 . 0 0 "[ . 1 . 2]" 1
736 1 46 GLN HB2 1 47 ILE H 2.625 . 3.450 2.144 2.123 2.163 . 0 0 "[ . 1 . 2]" 1
737 1 46 GLN HB3 1 47 ILE H 3.045 . 4.290 3.496 3.415 3.572 . 0 0 "[ . 1 . 2]" 1
738 1 46 GLN QG 1 47 ILE H 4.095 . 6.390 3.555 3.421 3.693 . 0 0 "[ . 1 . 2]" 1
739 1 46 GLN QG 1 48 ILE MG 3.630 . 5.460 3.661 3.493 3.813 . 0 0 "[ . 1 . 2]" 1
740 1 46 GLN QE 1 48 ILE MG 4.600 . 7.400 4.637 4.077 5.087 . 0 0 "[ . 1 . 2]" 1
741 1 46 GLN QE 1 48 ILE MD 4.260 . 6.720 4.294 3.591 4.620 . 0 0 "[ . 1 . 2]" 1
742 1 47 ILE H 1 47 ILE HB 2.485 . 3.170 2.569 2.507 2.622 . 0 0 "[ . 1 . 2]" 1
743 1 47 ILE H 1 47 ILE QG 3.305 . 4.810 2.369 2.246 2.541 . 0 0 "[ . 1 . 2]" 1
744 1 47 ILE H 1 47 ILE MD 3.265 . 4.730 3.569 3.417 3.737 . 0 0 "[ . 1 . 2]" 1
745 1 47 ILE H 1 48 ILE H 3.245 . 4.690 4.332 4.265 4.436 . 0 0 "[ . 1 . 2]" 1
746 1 47 ILE HA 1 47 ILE MG 2.720 . 3.640 2.301 2.216 2.424 . 0 0 "[ . 1 . 2]" 1
747 1 47 ILE HA 1 47 ILE MD 3.065 . 4.330 2.086 1.975 2.327 . 0 0 "[ . 1 . 2]" 1
748 1 47 ILE HA 1 48 ILE H 2.365 . 2.930 2.130 2.116 2.143 . 0 0 "[ . 1 . 2]" 1
749 1 47 ILE HB 1 48 ILE H 2.985 . 4.170 4.228 4.177 4.266 0.096 11 0 "[ . 1 . 2]" 1
750 1 47 ILE HB 1 124 ILE HB 3.155 . 4.510 3.378 3.252 3.570 . 0 0 "[ . 1 . 2]" 1
751 1 47 ILE HB 1 124 ILE MD 4.165 . 6.530 3.673 3.506 3.922 . 0 0 "[ . 1 . 2]" 1
752 1 47 ILE MG 1 48 ILE H 3.050 . 4.300 2.799 2.623 3.003 . 0 0 "[ . 1 . 2]" 1
753 1 47 ILE MG 1 82 TYR QD 4.415 . 7.030 2.610 2.150 3.213 . 0 0 "[ . 1 . 2]" 1
754 1 47 ILE MG 1 82 TYR QE 4.740 . 7.680 3.791 3.302 4.376 . 0 0 "[ . 1 . 2]" 1
755 1 47 ILE MG 1 124 ILE MG 4.645 . 7.490 3.639 3.568 3.845 . 0 0 "[ . 1 . 2]" 1
756 1 47 ILE MG 1 124 ILE MD 3.640 . 5.480 1.879 1.817 1.973 . 0 0 "[ . 1 . 2]" 1
757 1 47 ILE HG12 1 82 TYR QE 4.725 . 7.650 4.812 4.447 5.058 . 0 0 "[ . 1 . 2]" 1
758 1 47 ILE HG13 1 82 TYR QE 4.725 . 7.650 3.695 3.286 4.089 . 0 0 "[ . 1 . 2]" 1
759 1 47 ILE QG 1 48 ILE H 3.675 . 5.550 4.696 4.580 4.773 . 0 0 "[ . 1 . 2]" 1
760 1 47 ILE QG 1 82 TYR QD 5.170 . 8.540 3.849 3.692 4.028 . 0 0 "[ . 1 . 2]" 1
761 1 47 ILE MD 1 48 ILE H 3.530 . 5.260 3.777 3.416 3.960 . 0 0 "[ . 1 . 2]" 1
762 1 47 ILE MD 1 82 TYR QD 4.740 . 7.680 2.626 2.495 2.868 . 0 0 "[ . 1 . 2]" 1
763 1 47 ILE MD 1 82 TYR QE 4.415 . 7.030 2.464 2.038 2.677 . 0 0 "[ . 1 . 2]" 1
764 1 47 ILE MD 1 117 TYR HA 3.635 . 5.470 2.776 2.581 3.020 . 0 0 "[ . 1 . 2]" 1
765 1 47 ILE MD 1 120 SER HB2 2.985 . 4.170 2.383 2.157 2.587 . 0 0 "[ . 1 . 2]" 1
766 1 47 ILE MD 1 120 SER HB3 2.985 . 4.170 2.201 1.962 2.694 . 0 0 "[ . 1 . 2]" 1
767 1 47 ILE MD 1 124 ILE MG 3.905 . 6.010 3.980 3.923 4.027 . 0 0 "[ . 1 . 2]" 1
768 1 47 ILE MD 1 124 ILE QG 3.960 . 6.120 4.435 4.384 4.476 . 0 0 "[ . 1 . 2]" 1
769 1 47 ILE MD 1 124 ILE MD 4.120 . 6.440 3.216 3.049 3.399 . 0 0 "[ . 1 . 2]" 1
770 1 48 ILE H 1 48 ILE HB 3.000 . 4.200 3.138 3.021 3.316 . 0 0 "[ . 1 . 2]" 1
771 1 48 ILE H 1 48 ILE HG12 3.155 . 4.510 4.338 4.280 4.379 . 0 0 "[ . 1 . 2]" 1
772 1 48 ILE H 1 48 ILE HG13 3.155 . 4.510 4.620 4.601 4.647 0.137 20 0 "[ . 1 . 2]" 1
773 1 48 ILE H 1 48 ILE QG 3.025 . 4.250 3.976 3.938 3.992 . 0 0 "[ . 1 . 2]" 1
774 1 48 ILE HA 1 48 ILE HB 2.350 . 2.900 2.402 2.375 2.427 . 0 0 "[ . 1 . 2]" 1
775 1 48 ILE HA 1 48 ILE MD 3.140 . 4.480 3.775 3.758 3.796 . 0 0 "[ . 1 . 2]" 1
776 1 48 ILE HA 1 49 VAL H 2.425 . 3.050 2.317 2.262 2.417 . 0 0 "[ . 1 . 2]" 1
777 1 48 ILE QG 1 49 VAL H 4.095 . 6.390 2.080 1.879 2.220 . 0 0 "[ . 1 . 2]" 1
778 1 48 ILE MD 1 49 VAL H 3.590 . 5.380 3.768 3.572 3.918 . 0 0 "[ . 1 . 2]" 1
779 1 49 VAL H 1 49 VAL MG2 3.205 . 4.610 2.212 2.110 2.363 . 0 0 "[ . 1 . 2]" 1
780 1 49 VAL HA 1 49 VAL HB 2.335 . 2.870 3.006 3.003 3.008 0.138 10 0 "[ . 1 . 2]" 1
781 1 49 VAL HA 1 49 VAL MG1 2.740 . 3.680 2.366 2.292 2.464 . 0 0 "[ . 1 . 2]" 1
782 1 49 VAL HA 1 49 VAL MG2 2.740 . 3.680 2.406 2.260 2.477 . 0 0 "[ . 1 . 2]" 1
783 1 49 VAL HA 1 50 GLU H 2.410 . 3.020 2.217 2.202 2.224 . 0 0 "[ . 1 . 2]" 1
784 1 49 VAL MG1 1 50 GLU H 3.050 . 4.300 2.131 1.981 2.272 . 0 0 "[ . 1 . 2]" 1
785 1 49 VAL MG1 1 51 GLU HA 3.015 . 4.230 3.370 3.281 3.412 . 0 0 "[ . 1 . 2]" 1
786 1 49 VAL MG1 1 52 ALA H 4.165 . 6.530 5.215 5.114 5.323 . 0 0 "[ . 1 . 2]" 1
787 1 49 VAL MG2 1 50 GLU H 3.495 . 5.190 3.875 3.813 3.939 . 0 0 "[ . 1 . 2]" 1
788 1 50 GLU H 1 50 GLU HB2 2.535 . 3.270 2.466 2.351 2.569 . 0 0 "[ . 1 . 2]" 1
789 1 50 GLU H 1 50 GLU QG 3.275 . 4.750 2.910 2.670 3.148 . 0 0 "[ . 1 . 2]" 1
790 1 50 GLU H 1 51 GLU H 2.985 . 4.170 4.206 4.168 4.252 0.082 4 0 "[ . 1 . 2]" 1
791 1 50 GLU HA 1 51 GLU H 2.300 . 2.800 2.128 2.118 2.138 . 0 0 "[ . 1 . 2]" 1
792 1 50 GLU HA 1 52 ALA H 3.090 . 4.380 3.676 3.615 3.802 . 0 0 "[ . 1 . 2]" 1
793 1 50 GLU HB3 1 51 GLU H 2.675 . 3.550 3.624 3.564 3.690 0.140 14 0 "[ . 1 . 2]" 1
794 1 51 GLU H 1 51 GLU QB 2.825 . 3.850 2.607 2.231 2.717 . 0 0 "[ . 1 . 2]" 1
795 1 51 GLU H 1 51 GLU QG 3.180 . 4.560 2.363 1.961 4.037 . 0 0 "[ . 1 . 2]" 1
796 1 51 GLU H 1 52 ALA H 2.565 . 3.330 2.787 2.698 2.856 . 0 0 "[ . 1 . 2]" 1
797 1 51 GLU H 1 52 ALA MB 4.100 . 6.400 4.459 4.403 4.547 . 0 0 "[ . 1 . 2]" 1
798 1 51 GLU HA 1 52 ALA H 2.640 . 3.480 3.489 3.462 3.514 0.034 7 0 "[ . 1 . 2]" 1
799 1 51 GLU HA 1 54 GLN HE21 3.260 . 4.720 3.590 2.853 4.633 . 0 0 "[ . 1 . 2]" 1
800 1 51 GLU HA 1 54 GLN HE22 3.260 . 4.720 3.563 3.084 4.614 . 0 0 "[ . 1 . 2]" 1
801 1 51 GLU HA 1 54 GLN QE 3.185 . 4.570 3.180 2.659 4.119 . 0 0 "[ . 1 . 2]" 1
802 1 51 GLU QB 1 52 ALA HA 3.320 . 4.840 4.133 4.109 4.210 . 0 0 "[ . 1 . 2]" 1
803 1 51 GLU QB 1 52 ALA MB 4.235 . 6.670 4.331 3.770 4.505 . 0 0 "[ . 1 . 2]" 1
804 1 51 GLU QG 1 52 ALA H 3.970 . 6.140 2.481 2.066 3.923 . 0 0 "[ . 1 . 2]" 1
805 1 51 GLU QG 1 52 ALA HA 3.925 . 6.050 3.934 3.537 4.143 . 0 0 "[ . 1 . 2]" 1
806 1 51 GLU QG 1 52 ALA MB 3.910 . 6.020 3.449 3.166 4.477 . 0 0 "[ . 1 . 2]" 1
807 1 52 ALA H 1 53 LYS H 2.440 . 3.080 2.548 2.440 2.652 . 0 0 "[ . 1 . 2]" 1
808 1 52 ALA HA 1 53 LYS H 2.580 . 3.360 3.418 3.370 3.436 0.076 2 0 "[ . 1 . 2]" 1
809 1 52 ALA MB 1 53 LYS HA 3.855 . 5.910 4.129 4.062 4.213 . 0 0 "[ . 1 . 2]" 1
810 1 52 ALA MB 1 53 LYS QG 3.665 . 5.530 2.923 2.626 3.122 . 0 0 "[ . 1 . 2]" 1
811 1 52 ALA MB 1 73 LYS QE 4.330 . 6.860 4.917 4.714 5.047 . 0 0 "[ . 1 . 2]" 1
812 1 52 ALA MB 1 74 LEU QD 5.205 . 8.610 3.415 3.312 3.636 . 0 0 "[ . 1 . 2]" 1
813 1 53 LYS H 1 53 LYS QG 2.825 . 3.850 3.157 3.007 3.322 . 0 0 "[ . 1 . 2]" 1
814 1 53 LYS H 1 54 GLN H 2.690 . 3.580 3.531 3.384 3.605 0.025 11 0 "[ . 1 . 2]" 1
815 1 53 LYS HA 1 53 LYS QG 2.760 . 3.720 2.455 2.409 2.550 . 0 0 "[ . 1 . 2]" 1
816 1 53 LYS HA 1 54 GLN H 2.145 . 2.490 2.320 2.257 2.364 . 0 0 "[ . 1 . 2]" 1
817 1 53 LYS HA 1 74 LEU MD1 3.360 . 4.920 1.922 1.856 2.166 . 0 0 "[ . 1 . 2]" 1
818 1 53 LYS HA 1 74 LEU MD2 2.925 . 4.050 1.910 1.842 1.940 . 0 0 "[ . 1 . 2]" 1
819 1 53 LYS HA 1 74 LEU QD 3.625 . 5.450 1.703 1.677 1.757 0.123 7 0 "[ . 1 . 2]" 1
820 1 53 LYS HB3 1 74 LEU MD1 2.785 . 3.770 2.113 1.955 2.751 . 0 0 "[ . 1 . 2]" 1
821 1 53 LYS HB3 1 74 LEU MD2 2.720 . 3.640 2.908 2.722 2.975 . 0 0 "[ . 1 . 2]" 1
822 1 53 LYS QG 1 54 GLN H 3.660 . 5.520 4.489 4.456 4.561 . 0 0 "[ . 1 . 2]" 1
823 1 53 LYS QG 1 74 LEU H 3.675 . 5.550 5.077 5.047 5.120 . 0 0 "[ . 1 . 2]" 1
824 1 54 GLN H 1 54 GLN QG 3.180 . 4.560 2.291 2.224 2.670 . 0 0 "[ . 1 . 2]" 1
825 1 54 GLN H 1 55 ILE H 3.090 . 4.380 4.392 4.372 4.402 0.022 5 0 "[ . 1 . 2]" 1
826 1 54 GLN H 1 74 LEU MD1 3.325 . 4.850 2.824 2.676 2.959 . 0 0 "[ . 1 . 2]" 1
827 1 54 GLN H 1 74 LEU MD2 3.435 . 5.070 3.573 3.132 3.770 . 0 0 "[ . 1 . 2]" 1
828 1 54 GLN H 1 74 LEU QD 3.730 . 5.660 2.716 2.583 2.851 . 0 0 "[ . 1 . 2]" 1
829 1 54 GLN HA 1 54 GLN HB2 2.365 . 2.930 2.824 2.762 2.968 0.038 9 0 "[ . 1 . 2]" 1
830 1 54 GLN HA 1 54 GLN HB3 2.365 . 2.930 2.242 2.234 2.291 . 0 0 "[ . 1 . 2]" 1
831 1 54 GLN HA 1 54 GLN HG2 2.675 . 3.550 3.477 2.935 3.593 0.043 14 0 "[ . 1 . 2]" 1
832 1 54 GLN HA 1 54 GLN HG3 2.675 . 3.550 3.558 3.530 3.579 0.029 14 0 "[ . 1 . 2]" 1
833 1 54 GLN HA 1 55 ILE H 2.285 . 2.770 2.398 2.330 2.421 . 0 0 "[ . 1 . 2]" 1
834 1 54 GLN HA 1 74 LEU MD1 3.495 . 5.190 3.882 3.630 4.088 . 0 0 "[ . 1 . 2]" 1
835 1 54 GLN HB2 1 54 GLN HE21 3.905 . 6.010 2.928 2.375 3.424 . 0 0 "[ . 1 . 2]" 1
836 1 54 GLN HB2 1 54 GLN HE22 3.905 . 6.010 3.724 3.537 3.949 . 0 0 "[ . 1 . 2]" 1
837 1 54 GLN HB2 1 55 ILE H 2.470 . 3.140 2.849 2.654 3.210 0.070 9 0 "[ . 1 . 2]" 1
838 1 54 GLN HB3 1 54 GLN HE21 3.905 . 6.010 3.169 2.234 4.393 . 0 0 "[ . 1 . 2]" 1
839 1 54 GLN HB3 1 54 GLN HE22 3.905 . 6.010 4.231 3.755 4.857 . 0 0 "[ . 1 . 2]" 1
840 1 54 GLN HB3 1 55 ILE H 2.470 . 3.140 3.185 2.754 3.259 0.119 14 0 "[ . 1 . 2]" 1
841 1 54 GLN QG 1 55 ILE H 4.095 . 6.390 4.416 4.339 4.520 . 0 0 "[ . 1 . 2]" 1
842 1 54 GLN QG 1 56 LEU MD2 4.315 . 6.830 4.940 4.770 4.993 . 0 0 "[ . 1 . 2]" 1
843 1 54 GLN HE21 1 56 LEU MD2 3.745 . 5.690 4.311 4.031 4.538 . 0 0 "[ . 1 . 2]" 1
844 1 54 GLN HE22 1 56 LEU MD2 3.745 . 5.690 3.910 3.540 4.248 . 0 0 "[ . 1 . 2]" 1
845 1 55 ILE H 1 55 ILE HB 2.440 . 3.080 2.749 2.715 2.775 . 0 0 "[ . 1 . 2]" 1
846 1 55 ILE H 1 55 ILE QG 3.260 . 4.720 3.170 3.106 3.253 . 0 0 "[ . 1 . 2]" 1
847 1 55 ILE H 1 55 ILE MD 3.420 . 5.040 3.789 3.661 3.918 . 0 0 "[ . 1 . 2]" 1
848 1 55 ILE H 1 56 LEU H 3.030 . 4.260 4.070 3.984 4.177 . 0 0 "[ . 1 . 2]" 1
849 1 55 ILE H 1 74 LEU QD 4.570 . 7.340 4.929 4.689 5.047 . 0 0 "[ . 1 . 2]" 1
850 1 55 ILE HA 1 55 ILE QG 2.825 . 3.850 2.347 2.323 2.372 . 0 0 "[ . 1 . 2]" 1
851 1 55 ILE HA 1 56 LEU H 2.255 . 2.710 2.097 2.086 2.109 . 0 0 "[ . 1 . 2]" 1
852 1 55 ILE HA 1 74 LEU MD1 3.930 . 6.060 4.994 4.826 5.097 . 0 0 "[ . 1 . 2]" 1
853 1 55 ILE MG 1 57 VAL HA 4.165 . 6.530 4.252 4.188 4.307 . 0 0 "[ . 1 . 2]" 1
854 1 55 ILE MG 1 59 ASP QB 3.725 . 5.650 3.354 3.119 3.557 . 0 0 "[ . 1 . 2]" 1
855 1 55 ILE MG 1 85 TYR QE 5.240 . 8.680 4.385 4.023 4.555 . 0 0 "[ . 1 . 2]" 1
856 1 55 ILE HG12 1 56 LEU H 3.185 . 4.570 4.590 4.573 4.598 0.028 12 0 "[ . 1 . 2]" 1
857 1 55 ILE HG13 1 56 LEU H 3.185 . 4.570 4.600 4.583 4.611 0.041 13 0 "[ . 1 . 2]" 1
858 1 55 ILE QG 1 56 LEU H 3.110 . 4.420 4.093 4.078 4.102 . 0 0 "[ . 1 . 2]" 1
859 1 55 ILE MD 1 70 ALA MB 3.205 . 4.610 2.356 2.000 2.757 . 0 0 "[ . 1 . 2]" 1
860 1 55 ILE MD 1 71 PHE HA 2.800 . 3.800 2.667 2.429 2.894 . 0 0 "[ . 1 . 2]" 1
861 1 55 ILE MD 1 71 PHE HB2 3.340 . 4.880 2.198 2.009 2.382 . 0 0 "[ . 1 . 2]" 1
862 1 55 ILE MD 1 71 PHE HB3 3.340 . 4.880 2.488 2.302 2.690 . 0 0 "[ . 1 . 2]" 1
863 1 55 ILE MD 1 71 PHE QD 4.400 . 7.000 3.661 3.517 3.856 . 0 0 "[ . 1 . 2]" 1
864 1 55 ILE MD 1 85 TYR QD 5.240 . 8.680 4.704 3.545 4.985 . 0 0 "[ . 1 . 2]" 1
865 1 56 LEU H 1 56 LEU MD1 2.925 . 4.050 3.358 3.328 3.398 . 0 0 "[ . 1 . 2]" 1
866 1 56 LEU H 1 56 LEU MD2 3.205 . 4.610 3.613 3.455 3.740 . 0 0 "[ . 1 . 2]" 1
867 1 56 LEU H 1 59 ASP H 2.830 . 3.860 3.861 3.796 3.903 0.043 4 0 "[ . 1 . 2]" 1
868 1 56 LEU H 1 59 ASP QB 3.335 . 4.870 2.461 2.334 2.648 . 0 0 "[ . 1 . 2]" 1
869 1 56 LEU HA 1 56 LEU MD1 3.235 . 4.670 3.973 3.960 3.991 . 0 0 "[ . 1 . 2]" 1
870 1 56 LEU HA 1 56 LEU MD2 2.630 . 3.460 2.435 2.274 2.609 . 0 0 "[ . 1 . 2]" 1
871 1 56 LEU HA 1 57 VAL H 2.625 . 3.450 2.487 2.457 2.535 . 0 0 "[ . 1 . 2]" 1
872 1 56 LEU HA 1 58 GLY H 3.000 . 4.200 4.232 4.211 4.259 0.059 5 0 "[ . 1 . 2]" 1
873 1 56 LEU QB 1 58 GLY H 3.165 . 4.530 2.529 2.456 2.569 . 0 0 "[ . 1 . 2]" 1
874 1 56 LEU QB 1 59 ASP H 2.995 . 4.190 2.279 2.204 2.394 . 0 0 "[ . 1 . 2]" 1
875 1 56 LEU MD1 1 57 VAL H 3.960 . 6.120 4.492 4.375 4.546 . 0 0 "[ . 1 . 2]" 1
876 1 56 LEU MD1 1 58 GLY H 3.885 . 5.970 4.066 3.912 4.153 . 0 0 "[ . 1 . 2]" 1
877 1 56 LEU MD2 1 57 VAL H 3.960 . 6.120 3.718 3.623 3.876 . 0 0 "[ . 1 . 2]" 1
878 1 57 VAL H 1 57 VAL HB 2.580 . 3.360 2.712 2.636 2.811 . 0 0 "[ . 1 . 2]" 1
879 1 57 VAL H 1 58 GLY H 2.690 . 3.580 2.445 2.394 2.497 . 0 0 "[ . 1 . 2]" 1
880 1 57 VAL HA 1 57 VAL HB 2.410 . 3.020 3.010 2.999 3.016 . 0 0 "[ . 1 . 2]" 1
881 1 57 VAL HA 1 58 GLY H 2.690 . 3.580 3.467 3.448 3.480 . 0 0 "[ . 1 . 2]" 1
882 1 57 VAL HA 1 59 ASP H 3.170 . 4.540 4.383 4.289 4.499 . 0 0 "[ . 1 . 2]" 1
883 1 57 VAL HA 1 60 ILE H 2.815 . 3.830 3.891 3.849 3.921 0.091 1 0 "[ . 1 . 2]" 1
884 1 57 VAL HA 1 60 ILE HB 2.955 . 4.110 3.885 3.674 4.005 . 0 0 "[ . 1 . 2]" 1
885 1 57 VAL HA 1 60 ILE MG 4.040 . 6.280 5.033 4.877 5.123 . 0 0 "[ . 1 . 2]" 1
886 1 57 VAL HA 1 60 ILE QG 3.830 . 5.860 4.022 3.851 4.132 . 0 0 "[ . 1 . 2]" 1
887 1 57 VAL HA 1 60 ILE MD 3.185 . 4.570 2.164 1.961 2.547 . 0 0 "[ . 1 . 2]" 1
888 1 57 VAL HB 1 58 GLY H 2.595 . 3.390 3.048 2.927 3.152 . 0 0 "[ . 1 . 2]" 1
889 1 57 VAL QG 1 58 GLY H 3.870 . 5.940 3.446 3.367 3.489 . 0 0 "[ . 1 . 2]" 1
890 1 58 GLY H 1 58 GLY HA3 2.380 . 2.960 2.332 2.297 2.348 . 0 0 "[ . 1 . 2]" 1
891 1 58 GLY H 1 58 GLY HA2 2.380 . 2.960 2.902 2.877 2.913 . 0 0 "[ . 1 . 2]" 1
892 1 58 GLY H 1 59 ASP H 2.565 . 3.330 2.362 2.298 2.482 . 0 0 "[ . 1 . 2]" 1
893 1 58 GLY HA3 1 59 ASP H 2.660 . 3.520 2.920 2.814 2.971 . 0 0 "[ . 1 . 2]" 1
894 1 58 GLY HA2 1 59 ASP H 2.660 . 3.520 3.506 3.488 3.534 0.014 4 0 "[ . 1 . 2]" 1
895 1 58 GLY QA 1 60 ILE H 3.290 . 4.780 3.833 3.734 3.929 . 0 0 "[ . 1 . 2]" 1
896 1 59 ASP HA 1 62 ASP H 2.750 . 3.700 3.730 3.712 3.752 0.052 2 0 "[ . 1 . 2]" 1
897 1 59 ASP HA 1 62 ASP QB 3.290 . 4.780 2.892 2.811 2.966 . 0 0 "[ . 1 . 2]" 1
898 1 59 ASP HA 1 63 THR H 2.955 . 4.110 3.196 3.137 3.246 . 0 0 "[ . 1 . 2]" 1
899 1 59 ASP HA 1 64 VAL QG 4.360 . 6.920 3.262 3.028 3.534 . 0 0 "[ . 1 . 2]" 1
900 1 59 ASP QB 1 60 ILE HA 3.240 . 4.680 3.879 3.854 3.915 . 0 0 "[ . 1 . 2]" 1
901 1 59 ASP QB 1 64 VAL H 4.095 . 6.390 4.225 4.071 4.589 . 0 0 "[ . 1 . 2]" 1
902 1 59 ASP QB 1 64 VAL HB 3.520 . 5.240 3.158 3.011 3.393 . 0 0 "[ . 1 . 2]" 1
903 1 59 ASP QB 1 64 VAL QG 4.370 . 6.940 2.004 1.829 2.396 . 0 0 "[ . 1 . 2]" 1
904 1 60 ILE H 1 60 ILE HB 2.315 . 2.830 2.610 2.584 2.654 . 0 0 "[ . 1 . 2]" 1
905 1 60 ILE H 1 60 ILE QG 3.025 . 4.250 2.112 2.032 2.159 . 0 0 "[ . 1 . 2]" 1
906 1 60 ILE H 1 61 GLY H 3.030 . 4.260 4.263 4.237 4.280 0.020 6 0 "[ . 1 . 2]" 1
907 1 60 ILE HA 1 60 ILE MD 3.220 . 4.640 3.908 3.888 3.935 . 0 0 "[ . 1 . 2]" 1
908 1 60 ILE HA 1 61 GLY H 2.365 . 2.930 2.169 2.158 2.176 . 0 0 "[ . 1 . 2]" 1
909 1 60 ILE HA 1 62 ASP H 2.970 . 4.140 3.767 3.722 3.809 . 0 0 "[ . 1 . 2]" 1
910 1 60 ILE HA 1 64 VAL H 2.675 . 3.550 3.559 3.524 3.589 0.039 19 0 "[ . 1 . 2]" 1
911 1 60 ILE HA 1 64 VAL HB 2.210 . 2.620 1.986 1.969 1.996 . 0 0 "[ . 1 . 2]" 1
912 1 60 ILE HA 1 64 VAL QG 3.415 . 5.030 2.847 2.793 2.909 . 0 0 "[ . 1 . 2]" 1
913 1 60 ILE HB 1 61 GLY H 3.045 . 4.290 4.349 4.339 4.361 0.071 4 0 "[ . 1 . 2]" 1
914 1 60 ILE HB 1 61 GLY QA 3.395 . 4.990 4.441 4.420 4.457 . 0 0 "[ . 1 . 2]" 1
915 1 60 ILE MG 1 61 GLY HA3 3.745 . 5.690 3.747 3.721 3.801 . 0 0 "[ . 1 . 2]" 1
916 1 60 ILE MG 1 61 GLY HA2 3.745 . 5.690 3.872 3.796 3.955 . 0 0 "[ . 1 . 2]" 1
917 1 60 ILE MG 1 61 GLY QA 3.515 . 5.230 3.391 3.351 3.451 . 0 0 "[ . 1 . 2]" 1
918 1 60 ILE MG 1 66 ASP HA 3.495 . 5.190 2.527 2.187 3.110 . 0 0 "[ . 1 . 2]" 1
919 1 60 ILE MG 1 67 PRO HG2 3.360 . 4.920 3.733 3.050 3.974 . 0 0 "[ . 1 . 2]" 1
920 1 60 ILE MG 1 67 PRO HG3 3.360 . 4.920 2.500 1.881 2.784 . 0 0 "[ . 1 . 2]" 1
921 1 60 ILE MG 1 67 PRO HD2 3.760 . 5.720 3.234 2.991 3.451 . 0 0 "[ . 1 . 2]" 1
922 1 60 ILE MG 1 67 PRO HD3 3.760 . 5.720 1.830 1.802 2.014 . 0 0 "[ . 1 . 2]" 1
923 1 60 ILE MG 1 67 PRO QD 3.430 . 5.060 1.820 1.793 2.001 0.007 7 0 "[ . 1 . 2]" 1
924 1 60 ILE HG12 1 67 PRO HG2 3.840 . 5.880 4.135 3.650 4.382 . 0 0 "[ . 1 . 2]" 1
925 1 60 ILE HG12 1 67 PRO HG3 3.840 . 5.880 2.910 2.055 3.234 . 0 0 "[ . 1 . 2]" 1
926 1 60 ILE HG13 1 67 PRO HG2 3.840 . 5.880 5.738 5.255 5.910 0.030 6 0 "[ . 1 . 2]" 1
927 1 60 ILE HG13 1 67 PRO HG3 3.840 . 5.880 4.408 3.591 4.750 . 0 0 "[ . 1 . 2]" 1
928 1 60 ILE QG 1 66 ASP HA 3.925 . 6.050 4.035 3.837 4.321 . 0 0 "[ . 1 . 2]" 1
929 1 60 ILE QG 1 67 PRO HA 3.055 . 4.310 2.567 2.417 2.835 . 0 0 "[ . 1 . 2]" 1
930 1 60 ILE QG 1 67 PRO QG 3.335 . 4.870 2.805 2.032 3.090 . 0 0 "[ . 1 . 2]" 1
931 1 60 ILE MD 1 67 PRO HA 3.015 . 4.230 3.471 3.351 3.540 . 0 0 "[ . 1 . 2]" 1
932 1 60 ILE MD 1 67 PRO HG2 3.360 . 4.920 3.619 3.021 3.910 . 0 0 "[ . 1 . 2]" 1
933 1 60 ILE MD 1 67 PRO HG3 3.360 . 4.920 2.272 1.911 2.533 . 0 0 "[ . 1 . 2]" 1
934 1 60 ILE MD 1 67 PRO HD2 3.790 . 5.780 4.479 3.914 4.576 . 0 0 "[ . 1 . 2]" 1
935 1 60 ILE MD 1 67 PRO HD3 3.790 . 5.780 3.468 2.749 3.903 . 0 0 "[ . 1 . 2]" 1
936 1 60 ILE MD 1 67 PRO QD 3.670 . 5.540 3.350 2.698 3.692 . 0 0 "[ . 1 . 2]" 1
937 1 61 GLY H 1 62 ASP H 2.565 . 3.330 2.381 2.229 2.499 . 0 0 "[ . 1 . 2]" 1
938 1 61 GLY H 1 64 VAL H 2.815 . 3.830 2.684 2.660 2.706 . 0 0 "[ . 1 . 2]" 1
939 1 61 GLY H 1 64 VAL HB 2.735 . 3.670 2.934 2.873 2.981 . 0 0 "[ . 1 . 2]" 1
940 1 61 GLY H 1 64 VAL QG 4.425 . 7.050 3.618 3.576 3.661 . 0 0 "[ . 1 . 2]" 1
941 1 61 GLY HA3 1 62 ASP H 2.625 . 3.450 3.155 3.056 3.259 . 0 0 "[ . 1 . 2]" 1
942 1 61 GLY HA2 1 62 ASP H 2.625 . 3.450 3.409 3.346 3.458 0.008 14 0 "[ . 1 . 2]" 1
943 1 61 GLY QA 1 62 ASP HA 3.490 . 5.180 4.025 4.023 4.029 . 0 0 "[ . 1 . 2]" 1
944 1 61 GLY QA 1 64 VAL H 3.260 . 4.720 4.300 4.281 4.313 . 0 0 "[ . 1 . 2]" 1
945 1 62 ASP H 1 62 ASP HB2 2.580 . 3.360 2.254 2.137 2.376 . 0 0 "[ . 1 . 2]" 1
946 1 62 ASP H 1 62 ASP HB3 2.580 . 3.360 3.191 3.084 3.318 . 0 0 "[ . 1 . 2]" 1
947 1 62 ASP H 1 63 THR H 2.610 . 3.420 2.312 2.200 2.426 . 0 0 "[ . 1 . 2]" 1
948 1 62 ASP H 1 63 THR MG 4.165 . 6.530 5.551 5.510 5.591 . 0 0 "[ . 1 . 2]" 1
949 1 62 ASP H 1 64 VAL H 2.660 . 3.520 2.721 2.559 2.898 . 0 0 "[ . 1 . 2]" 1
950 1 62 ASP H 1 64 VAL QG 4.920 . 8.040 4.194 4.061 4.332 . 0 0 "[ . 1 . 2]" 1
951 1 62 ASP HB2 1 63 THR H 2.440 . 3.080 2.793 2.596 2.943 . 0 0 "[ . 1 . 2]" 1
952 1 62 ASP HB2 1 64 VAL H 3.075 . 4.350 4.218 4.048 4.345 . 0 0 "[ . 1 . 2]" 1
953 1 62 ASP HB3 1 63 THR H 2.440 . 3.080 2.364 2.236 2.512 . 0 0 "[ . 1 . 2]" 1
954 1 62 ASP HB3 1 64 VAL H 3.075 . 4.350 4.199 4.072 4.355 0.005 4 0 "[ . 1 . 2]" 1
955 1 62 ASP QB 1 63 THR H 2.320 . 2.840 2.233 2.167 2.280 . 0 0 "[ . 1 . 2]" 1
956 1 62 ASP QB 1 64 VAL H 2.880 . 3.960 3.742 3.723 3.759 . 0 0 "[ . 1 . 2]" 1
957 1 63 THR H 1 63 THR HB 2.890 . 3.980 3.239 3.059 3.381 . 0 0 "[ . 1 . 2]" 1
958 1 63 THR H 1 63 THR MG 3.325 . 4.850 3.740 3.614 3.857 . 0 0 "[ . 1 . 2]" 1
959 1 63 THR H 1 64 VAL HB 2.830 . 3.860 4.039 4.020 4.061 0.201 10 0 "[ . 1 . 2]" 1
960 1 63 THR H 1 64 VAL QG 4.330 . 6.860 3.212 3.140 3.331 . 0 0 "[ . 1 . 2]" 1
961 1 63 THR HA 1 63 THR MG 2.615 . 3.430 2.132 1.984 2.213 . 0 0 "[ . 1 . 2]" 1
962 1 63 THR HA 1 64 VAL H 2.520 . 3.240 3.361 3.348 3.374 0.134 10 0 "[ . 1 . 2]" 1
963 1 63 THR HB 1 64 VAL MG1 3.945 . 6.090 5.223 5.202 5.244 . 0 0 "[ . 1 . 2]" 1
964 1 63 THR HB 1 64 VAL MG2 3.945 . 6.090 2.869 2.655 2.987 . 0 0 "[ . 1 . 2]" 1
965 1 63 THR HB 1 64 VAL QG 3.630 . 5.460 2.856 2.647 2.970 . 0 0 "[ . 1 . 2]" 1
966 1 63 THR MG 1 64 VAL H 3.635 . 5.470 4.404 4.360 4.434 . 0 0 "[ . 1 . 2]" 1
967 1 64 VAL H 1 64 VAL HB 2.365 . 2.930 2.554 2.530 2.574 . 0 0 "[ . 1 . 2]" 1
968 1 64 VAL H 1 64 VAL MG1 3.155 . 4.510 3.810 3.802 3.819 . 0 0 "[ . 1 . 2]" 1
969 1 64 VAL H 1 64 VAL MG2 3.155 . 4.510 2.533 2.464 2.631 . 0 0 "[ . 1 . 2]" 1
970 1 64 VAL H 1 64 VAL QG 2.930 . 4.060 2.498 2.435 2.586 . 0 0 "[ . 1 . 2]" 1
971 1 64 VAL MG1 1 67 PRO HD2 5.630 . 9.460 4.862 4.486 5.150 . 0 0 "[ . 1 . 2]" 1
972 1 64 VAL MG1 1 67 PRO HD3 5.630 . 9.460 4.167 3.671 4.451 . 0 0 "[ . 1 . 2]" 1
973 1 64 VAL MG2 1 67 PRO HD2 5.630 . 9.460 7.220 6.827 7.440 . 0 0 "[ . 1 . 2]" 1
974 1 64 VAL MG2 1 67 PRO HD3 5.630 . 9.460 6.323 5.722 6.613 . 0 0 "[ . 1 . 2]" 1
975 1 64 VAL QG 1 67 PRO QD 4.655 . 7.510 3.887 3.473 4.133 . 0 0 "[ . 1 . 2]" 1
976 1 65 GLU QG 1 66 ASP H 4.095 . 6.390 3.955 3.727 4.485 . 0 0 "[ . 1 . 2]" 1
977 1 66 ASP H 1 66 ASP HB2 2.935 . 4.070 2.915 2.847 2.997 . 0 0 "[ . 1 . 2]" 1
978 1 66 ASP H 1 66 ASP HB3 2.935 . 4.070 3.535 3.296 3.725 . 0 0 "[ . 1 . 2]" 1
979 1 66 ASP HA 1 66 ASP HB2 2.350 . 2.900 2.842 2.737 2.937 0.037 2 0 "[ . 1 . 2]" 1
980 1 66 ASP HA 1 66 ASP HB3 2.350 . 2.900 2.848 2.734 2.936 0.036 14 0 "[ . 1 . 2]" 1
981 1 66 ASP HA 1 67 PRO HG2 3.605 . 5.410 4.530 4.178 4.656 . 0 0 "[ . 1 . 2]" 1
982 1 66 ASP HA 1 67 PRO HG3 3.605 . 5.410 4.325 3.996 4.461 . 0 0 "[ . 1 . 2]" 1
983 1 66 ASP HA 1 67 PRO QG 3.465 . 5.130 3.925 3.763 4.043 . 0 0 "[ . 1 . 2]" 1
984 1 66 ASP HA 1 67 PRO HD2 2.395 . 2.990 2.577 1.991 3.024 0.034 11 0 "[ . 1 . 2]" 1
985 1 66 ASP HA 1 67 PRO HD3 2.395 . 2.990 2.198 1.953 2.582 . 0 0 "[ . 1 . 2]" 1
986 1 66 ASP HA 1 67 PRO QD 2.285 . 2.770 2.027 1.929 2.111 . 0 0 "[ . 1 . 2]" 1
987 1 66 ASP HB2 1 67 PRO HD2 4.235 . 6.670 4.193 4.017 4.407 . 0 0 "[ . 1 . 2]" 1
988 1 66 ASP HB2 1 67 PRO HD3 4.235 . 6.670 4.737 4.267 5.283 . 0 0 "[ . 1 . 2]" 1
989 1 66 ASP HB2 1 69 THR HB 2.535 . 3.270 2.979 2.471 3.282 0.012 14 0 "[ . 1 . 2]" 1
990 1 66 ASP HB3 1 67 PRO HD2 4.235 . 6.670 3.099 2.636 3.857 . 0 0 "[ . 1 . 2]" 1
991 1 66 ASP HB3 1 67 PRO HD3 4.235 . 6.670 4.070 3.425 4.921 . 0 0 "[ . 1 . 2]" 1
992 1 66 ASP HB3 1 69 THR HB 2.535 . 3.270 2.883 2.353 3.280 0.010 8 0 "[ . 1 . 2]" 1
993 1 66 ASP QB 1 67 PRO QD 3.600 . 5.400 2.899 2.554 3.481 . 0 0 "[ . 1 . 2]" 1
994 1 66 ASP QB 1 69 THR HB 2.385 . 2.970 2.547 2.304 2.765 . 0 0 "[ . 1 . 2]" 1
995 1 67 PRO HA 1 70 ALA MB 2.830 . 3.860 2.724 2.541 2.861 . 0 0 "[ . 1 . 2]" 1
996 1 67 PRO QB 1 68 TYR H 2.915 . 4.030 3.094 2.905 3.191 . 0 0 "[ . 1 . 2]" 1
997 1 67 PRO HG2 1 162 GLU QG 3.380 . 4.960 3.431 2.935 3.978 . 0 0 "[ . 1 . 2]" 1
998 1 67 PRO HG3 1 162 GLU QG 3.380 . 4.960 4.161 3.746 4.501 . 0 0 "[ . 1 . 2]" 1
999 1 67 PRO QG 1 68 TYR H 3.370 . 4.940 2.783 2.407 3.581 . 0 0 "[ . 1 . 2]" 1
1000 1 67 PRO QD 1 68 TYR H 3.470 . 5.140 2.375 2.010 2.895 . 0 0 "[ . 1 . 2]" 1
1001 1 68 TYR H 1 68 TYR HB2 2.410 . 3.020 2.853 2.821 2.878 . 0 0 "[ . 1 . 2]" 1
1002 1 68 TYR H 1 68 TYR HB3 2.410 . 3.020 2.214 2.182 2.235 . 0 0 "[ . 1 . 2]" 1
1003 1 68 TYR H 1 68 TYR QE 4.725 . 7.650 6.097 6.080 6.124 . 0 0 "[ . 1 . 2]" 1
1004 1 68 TYR H 1 69 THR H 2.485 . 3.170 2.703 2.613 2.756 . 0 0 "[ . 1 . 2]" 1
1005 1 68 TYR H 1 69 THR HB 3.245 . 4.690 4.739 4.722 4.756 0.066 2 0 "[ . 1 . 2]" 1
1006 1 68 TYR H 1 70 ALA H 2.795 . 3.790 3.823 3.796 3.836 0.046 14 0 "[ . 1 . 2]" 1
1007 1 68 TYR HA 1 71 PHE H 2.720 . 3.640 3.419 3.381 3.450 . 0 0 "[ . 1 . 2]" 1
1008 1 68 TYR HB3 1 69 THR H 2.535 . 3.270 2.492 2.429 2.584 . 0 0 "[ . 1 . 2]" 1
1009 1 68 TYR HB3 1 162 GLU QG 4.095 . 6.390 5.603 5.415 5.742 . 0 0 "[ . 1 . 2]" 1
1010 1 68 TYR QD 1 69 THR H 4.555 . 7.310 2.766 2.246 3.283 . 0 0 "[ . 1 . 2]" 1
1011 1 68 TYR QD 1 69 THR HA 4.365 . 6.930 3.447 2.639 4.045 . 0 0 "[ . 1 . 2]" 1
1012 1 68 TYR QD 1 72 VAL HB 4.725 . 7.650 4.561 3.961 4.922 . 0 0 "[ . 1 . 2]" 1
1013 1 68 TYR QD 1 72 VAL MG1 4.030 . 6.260 4.729 4.451 4.880 . 0 0 "[ . 1 . 2]" 1
1014 1 68 TYR QD 1 140 LEU QD 5.295 . 8.790 5.635 5.006 5.945 . 0 0 "[ . 1 . 2]" 1
1015 1 68 TYR QD 1 143 ILE MD 4.200 . 6.600 2.647 2.339 2.938 . 0 0 "[ . 1 . 2]" 1
1016 1 68 TYR QD 1 146 ARG HA 4.505 . 7.210 5.673 4.914 6.208 . 0 0 "[ . 1 . 2]" 1
1017 1 68 TYR QE 1 69 THR H 4.725 . 7.650 4.729 4.491 5.043 . 0 0 "[ . 1 . 2]" 1
1018 1 68 TYR QE 1 69 THR HA 4.725 . 7.650 4.098 3.532 4.622 . 0 0 "[ . 1 . 2]" 1
1019 1 68 TYR QE 1 72 VAL HB 4.725 . 7.650 4.433 3.844 4.797 . 0 0 "[ . 1 . 2]" 1
1020 1 68 TYR QE 1 72 VAL MG1 4.060 . 6.320 3.715 3.256 4.014 . 0 0 "[ . 1 . 2]" 1
1021 1 68 TYR QE 1 140 LEU QD 5.295 . 8.790 4.557 3.794 4.966 . 0 0 "[ . 1 . 2]" 1
1022 1 68 TYR QE 1 143 ILE MD 4.710 . 7.620 1.908 1.867 1.959 . 0 0 "[ . 1 . 2]" 1
1023 1 68 TYR QE 1 144 LYS H 4.725 . 7.650 4.234 4.081 4.378 . 0 0 "[ . 1 . 2]" 1
1024 1 68 TYR QE 1 146 ARG HA 4.135 . 6.470 5.644 4.924 6.096 . 0 0 "[ . 1 . 2]" 1
1025 1 69 THR H 1 69 THR HB 2.425 . 3.050 2.498 2.471 2.528 . 0 0 "[ . 1 . 2]" 1
1026 1 69 THR H 1 69 THR MG 3.310 . 4.820 3.749 3.746 3.752 . 0 0 "[ . 1 . 2]" 1
1027 1 69 THR H 1 70 ALA H 2.425 . 3.050 2.737 2.668 2.793 . 0 0 "[ . 1 . 2]" 1
1028 1 69 THR H 1 72 VAL H 3.155 . 4.510 4.521 4.512 4.533 0.023 14 0 "[ . 1 . 2]" 1
1029 1 69 THR HA 1 69 THR HB 2.335 . 2.870 3.006 3.004 3.008 0.138 19 0 "[ . 1 . 2]" 1
1030 1 69 THR HA 1 69 THR MG 2.645 . 3.490 2.458 2.375 2.523 . 0 0 "[ . 1 . 2]" 1
1031 1 69 THR HA 1 70 ALA H 2.610 . 3.420 3.490 3.479 3.496 0.076 6 0 "[ . 1 . 2]" 1
1032 1 69 THR HA 1 71 PHE H 3.000 . 4.200 4.280 4.262 4.312 0.112 5 0 "[ . 1 . 2]" 1
1033 1 69 THR HA 1 72 VAL H 2.580 . 3.360 3.119 3.106 3.133 . 0 0 "[ . 1 . 2]" 1
1034 1 69 THR HA 1 72 VAL HA 3.295 . 4.790 4.864 4.843 4.888 0.098 15 0 "[ . 1 . 2]" 1
1035 1 69 THR HA 1 72 VAL HB 2.195 . 2.590 2.091 2.052 2.137 . 0 0 "[ . 1 . 2]" 1
1036 1 69 THR HA 1 72 VAL MG1 3.015 . 4.230 3.510 3.485 3.534 . 0 0 "[ . 1 . 2]" 1
1037 1 69 THR HA 1 72 VAL MG2 3.390 . 4.980 2.472 2.294 2.660 . 0 0 "[ . 1 . 2]" 1
1038 1 69 THR HA 1 72 VAL QG 3.610 . 5.420 2.423 2.266 2.581 . 0 0 "[ . 1 . 2]" 1
1039 1 69 THR HA 1 73 LYS H 2.920 . 4.040 4.079 4.057 4.107 0.067 8 0 "[ . 1 . 2]" 1
1040 1 69 THR HB 1 70 ALA H 2.350 . 2.900 2.811 2.773 2.852 . 0 0 "[ . 1 . 2]" 1
1041 1 69 THR HB 1 72 VAL QG 4.695 . 7.590 4.716 4.607 4.832 . 0 0 "[ . 1 . 2]" 1
1042 1 69 THR MG 1 70 ALA H 3.185 . 4.570 3.643 3.593 3.678 . 0 0 "[ . 1 . 2]" 1
1043 1 69 THR MG 1 72 VAL QG 5.205 . 8.610 3.520 3.457 3.591 . 0 0 "[ . 1 . 2]" 1
1044 1 70 ALA H 1 70 ALA HA 2.380 . 2.960 2.833 2.826 2.840 . 0 0 "[ . 1 . 2]" 1
1045 1 70 ALA H 1 72 VAL H 2.935 . 4.070 3.873 3.817 3.917 . 0 0 "[ . 1 . 2]" 1
1046 1 70 ALA HA 1 73 LYS H 2.690 . 3.580 3.541 3.502 3.591 0.011 19 0 "[ . 1 . 2]" 1
1047 1 70 ALA MB 1 71 PHE H 3.080 . 4.360 2.530 2.474 2.633 . 0 0 "[ . 1 . 2]" 1
1048 1 71 PHE H 1 72 VAL H 2.485 . 3.170 2.502 2.480 2.516 . 0 0 "[ . 1 . 2]" 1
1049 1 71 PHE H 1 73 LYS H 3.295 . 4.790 3.927 3.837 4.057 . 0 0 "[ . 1 . 2]" 1
1050 1 71 PHE HA 1 74 LEU HG 2.765 . 3.730 3.440 3.174 3.563 . 0 0 "[ . 1 . 2]" 1
1051 1 71 PHE HA 1 74 LEU MD1 2.800 . 3.800 2.068 1.851 2.351 . 0 0 "[ . 1 . 2]" 1
1052 1 71 PHE HB2 1 72 VAL H 3.170 . 4.540 4.191 4.166 4.221 . 0 0 "[ . 1 . 2]" 1
1053 1 71 PHE HB3 1 72 VAL H 3.170 . 4.540 3.124 3.064 3.180 . 0 0 "[ . 1 . 2]" 1
1054 1 71 PHE QB 1 72 VAL H 3.095 . 4.390 3.042 2.990 3.092 . 0 0 "[ . 1 . 2]" 1
1055 1 71 PHE QD 1 72 VAL H 4.445 . 7.090 2.101 2.046 2.139 . 0 0 "[ . 1 . 2]" 1
1056 1 71 PHE QD 1 72 VAL HA 4.105 . 6.410 2.992 2.944 3.026 . 0 0 "[ . 1 . 2]" 1
1057 1 71 PHE QD 1 72 VAL HB 4.600 . 7.400 3.723 3.659 3.813 . 0 0 "[ . 1 . 2]" 1
1058 1 71 PHE QD 1 72 VAL MG2 4.895 . 7.990 1.912 1.880 1.964 . 0 0 "[ . 1 . 2]" 1
1059 1 71 PHE QD 1 73 LYS H 4.725 . 7.650 4.540 4.490 4.614 . 0 0 "[ . 1 . 2]" 1
1060 1 71 PHE QD 1 75 LEU MD1 4.185 . 6.570 3.324 3.275 3.368 . 0 0 "[ . 1 . 2]" 1
1061 1 71 PHE QD 1 140 LEU QB 4.920 . 8.040 5.785 5.692 5.963 . 0 0 "[ . 1 . 2]" 1
1062 1 71 PHE QD 1 140 LEU QD 4.940 . 8.080 4.422 3.796 4.663 . 0 0 "[ . 1 . 2]" 1
1063 1 71 PHE QD 1 143 ILE MG 4.430 . 7.060 4.759 4.701 4.805 . 0 0 "[ . 1 . 2]" 1
1064 1 71 PHE QD 1 143 ILE QG 5.170 . 8.540 4.841 4.814 4.887 . 0 0 "[ . 1 . 2]" 1
1065 1 71 PHE QE 1 75 LEU MD1 5.175 . 8.550 2.364 2.331 2.390 . 0 0 "[ . 1 . 2]" 1
1066 1 71 PHE QE 1 75 LEU MD2 5.240 . 8.680 2.879 2.603 3.023 . 0 0 "[ . 1 . 2]" 1
1067 1 71 PHE QE 1 102 ILE MG 4.570 . 7.340 3.480 3.361 3.665 . 0 0 "[ . 1 . 2]" 1
1068 1 71 PHE QE 1 102 ILE MD 4.000 . 6.200 3.470 3.186 3.641 . 0 0 "[ . 1 . 2]" 1
1069 1 71 PHE QE 1 140 LEU HA 4.400 . 7.000 4.311 4.164 4.394 . 0 0 "[ . 1 . 2]" 1
1070 1 71 PHE QE 1 140 LEU QD 5.655 . 9.510 3.465 2.534 3.786 . 0 0 "[ . 1 . 2]" 1
1071 1 71 PHE QE 1 143 ILE MG 5.190 . 8.580 2.900 2.806 2.988 . 0 0 "[ . 1 . 2]" 1
1072 1 71 PHE QE 1 143 ILE MD 4.680 . 7.560 1.802 1.783 1.835 0.017 8 0 "[ . 1 . 2]" 1
1073 1 71 PHE HZ 1 75 LEU MD1 4.165 . 6.530 2.210 2.150 2.278 . 0 0 "[ . 1 . 2]" 1
1074 1 71 PHE HZ 1 137 VAL HB 3.245 . 4.690 4.732 4.697 4.750 0.060 7 0 "[ . 1 . 2]" 1
1075 1 71 PHE HZ 1 137 VAL MG1 3.760 . 5.720 4.522 4.481 4.581 . 0 0 "[ . 1 . 2]" 1
1076 1 71 PHE HZ 1 137 VAL MG2 3.745 . 5.690 3.582 3.488 3.686 . 0 0 "[ . 1 . 2]" 1
1077 1 71 PHE HZ 1 140 LEU QB 4.095 . 6.390 5.481 5.402 5.594 . 0 0 "[ . 1 . 2]" 1
1078 1 71 PHE HZ 1 140 LEU QD 4.145 . 6.490 3.994 3.276 4.250 . 0 0 "[ . 1 . 2]" 1
1079 1 71 PHE HZ 1 143 ILE HB 3.420 . 5.040 3.850 3.805 3.913 . 0 0 "[ . 1 . 2]" 1
1080 1 71 PHE HZ 1 143 ILE MG 3.015 . 4.230 2.058 1.946 2.154 . 0 0 "[ . 1 . 2]" 1
1081 1 71 PHE HZ 1 143 ILE MD 3.590 . 5.380 2.163 1.988 2.342 . 0 0 "[ . 1 . 2]" 1
1082 1 72 VAL H 1 72 VAL HB 2.380 . 2.960 2.422 2.382 2.452 . 0 0 "[ . 1 . 2]" 1
1083 1 72 VAL H 1 72 VAL MG1 3.000 . 4.200 3.722 3.717 3.727 . 0 0 "[ . 1 . 2]" 1
1084 1 72 VAL H 1 73 LYS H 2.625 . 3.450 2.650 2.611 2.698 . 0 0 "[ . 1 . 2]" 1
1085 1 72 VAL H 1 75 LEU MD1 3.960 . 6.120 4.514 4.457 4.605 . 0 0 "[ . 1 . 2]" 1
1086 1 72 VAL HA 1 72 VAL HB 2.395 . 2.990 3.017 3.012 3.020 0.030 9 0 "[ . 1 . 2]" 1
1087 1 72 VAL HA 1 74 LEU H 3.060 . 4.320 4.326 4.260 4.366 0.046 9 0 "[ . 1 . 2]" 1
1088 1 72 VAL HA 1 75 LEU H 2.720 . 3.640 3.586 3.504 3.645 0.005 8 0 "[ . 1 . 2]" 1
1089 1 72 VAL HA 1 75 LEU HG 3.650 . 5.500 3.132 2.914 3.243 . 0 0 "[ . 1 . 2]" 1
1090 1 72 VAL HA 1 75 LEU MD1 2.925 . 4.050 2.641 2.544 2.783 . 0 0 "[ . 1 . 2]" 1
1091 1 72 VAL HA 1 75 LEU MD2 3.635 . 5.470 4.601 4.449 4.698 . 0 0 "[ . 1 . 2]" 1
1092 1 72 VAL HA 1 140 LEU QD 4.285 . 6.770 2.657 2.346 2.816 . 0 0 "[ . 1 . 2]" 1
1093 1 72 VAL MG1 1 75 LEU MD1 4.010 . 6.220 3.819 3.638 4.003 . 0 0 "[ . 1 . 2]" 1
1094 1 72 VAL MG2 1 75 LEU MD1 4.430 . 7.060 3.155 3.036 3.321 . 0 0 "[ . 1 . 2]" 1
1095 1 72 VAL MG2 1 140 LEU HA 3.715 . 5.630 4.573 4.550 4.595 . 0 0 "[ . 1 . 2]" 1
1096 1 72 VAL MG2 1 140 LEU QD 4.215 . 6.630 3.041 2.548 3.209 . 0 0 "[ . 1 . 2]" 1
1097 1 72 VAL MG2 1 144 LYS HA 3.295 . 4.790 3.998 3.962 4.032 . 0 0 "[ . 1 . 2]" 1
1098 1 72 VAL QG 1 73 LYS H 4.245 . 6.690 3.388 3.330 3.437 . 0 0 "[ . 1 . 2]" 1
1099 1 72 VAL QG 1 74 LEU H 4.695 . 7.590 4.665 4.595 4.716 . 0 0 "[ . 1 . 2]" 1
1100 1 72 VAL QG 1 75 LEU H 4.540 . 7.280 4.483 4.412 4.527 . 0 0 "[ . 1 . 2]" 1
1101 1 72 VAL QG 1 140 LEU QB 5.140 . 8.480 2.792 2.636 2.947 . 0 0 "[ . 1 . 2]" 1
1102 1 72 VAL QG 1 140 LEU HG 4.695 . 7.590 3.738 1.941 4.305 . 0 0 "[ . 1 . 2]" 1
1103 1 72 VAL QG 1 140 LEU QD 4.940 . 8.080 1.972 1.803 2.373 . 0 0 "[ . 1 . 2]" 1
1104 1 73 LYS H 1 73 LYS QD 3.275 . 4.750 4.150 3.901 4.316 . 0 0 "[ . 1 . 2]" 1
1105 1 73 LYS H 1 73 LYS QE 4.095 . 6.390 4.908 4.486 5.735 . 0 0 "[ . 1 . 2]" 1
1106 1 73 LYS H 1 74 LEU H 2.470 . 3.140 2.447 2.381 2.533 . 0 0 "[ . 1 . 2]" 1
1107 1 73 LYS HA 1 73 LYS QE 3.475 . 5.150 4.417 4.295 4.819 . 0 0 "[ . 1 . 2]" 1
1108 1 73 LYS HA 1 74 LEU H 2.625 . 3.450 3.502 3.490 3.520 0.070 5 0 "[ . 1 . 2]" 1
1109 1 73 LYS QB 1 74 LEU H 3.150 . 4.500 3.112 2.623 3.590 . 0 0 "[ . 1 . 2]" 1
1110 1 73 LYS QG 1 74 LEU H 4.095 . 6.390 3.132 2.083 4.230 . 0 0 "[ . 1 . 2]" 1
1111 1 73 LYS QD 1 74 LEU H 3.675 . 5.550 3.803 2.771 4.361 . 0 0 "[ . 1 . 2]" 1
1112 1 73 LYS QE 1 74 LEU MD2 4.160 . 6.520 2.041 1.774 2.811 0.026 6 0 "[ . 1 . 2]" 1
1113 1 74 LEU H 1 74 LEU HB2 2.550 . 3.300 2.521 2.458 2.607 . 0 0 "[ . 1 . 2]" 1
1114 1 74 LEU H 1 74 LEU HB3 2.690 . 3.580 3.580 3.566 3.598 0.018 6 0 "[ . 1 . 2]" 1
1115 1 74 LEU H 1 74 LEU HG 2.550 . 3.300 2.155 1.990 2.273 . 0 0 "[ . 1 . 2]" 1
1116 1 74 LEU H 1 74 LEU QD 3.715 . 5.630 3.005 2.898 3.067 . 0 0 "[ . 1 . 2]" 1
1117 1 74 LEU H 1 75 LEU H 2.380 . 2.960 2.479 2.455 2.524 . 0 0 "[ . 1 . 2]" 1
1118 1 74 LEU H 1 75 LEU HB2 3.125 . 4.450 4.491 4.467 4.518 0.068 5 0 "[ . 1 . 2]" 1
1119 1 74 LEU H 1 75 LEU MD1 4.165 . 6.530 5.405 5.366 5.443 . 0 0 "[ . 1 . 2]" 1
1120 1 74 LEU H 1 75 LEU MD2 4.165 . 6.530 5.079 4.986 5.147 . 0 0 "[ . 1 . 2]" 1
1121 1 74 LEU HA 1 74 LEU HG 2.735 . 3.670 2.948 2.888 3.036 . 0 0 "[ . 1 . 2]" 1
1122 1 74 LEU HA 1 74 LEU MD2 2.615 . 3.430 2.402 2.194 2.646 . 0 0 "[ . 1 . 2]" 1
1123 1 74 LEU HB2 1 74 LEU MD2 2.675 . 3.550 3.130 3.080 3.146 . 0 0 "[ . 1 . 2]" 1
1124 1 74 LEU HB2 1 75 LEU H 2.550 . 3.300 2.703 2.629 2.776 . 0 0 "[ . 1 . 2]" 1
1125 1 74 LEU HB3 1 75 LEU H 2.780 . 3.760 3.807 3.775 3.835 0.075 7 0 "[ . 1 . 2]" 1
1126 1 74 LEU HG 1 75 LEU H 3.325 . 4.850 4.213 4.082 4.314 . 0 0 "[ . 1 . 2]" 1
1127 1 75 LEU H 1 75 LEU HB2 2.550 . 3.300 2.355 2.335 2.380 . 0 0 "[ . 1 . 2]" 1
1128 1 75 LEU H 1 75 LEU HG 2.410 . 3.020 2.515 2.481 2.563 . 0 0 "[ . 1 . 2]" 1
1129 1 75 LEU H 1 75 LEU MD1 3.310 . 4.820 3.827 3.794 3.872 . 0 0 "[ . 1 . 2]" 1
1130 1 75 LEU H 1 75 LEU MD2 2.895 . 3.990 3.268 3.215 3.317 . 0 0 "[ . 1 . 2]" 1
1131 1 75 LEU H 1 76 PRO HD2 3.620 . 5.440 5.230 5.152 5.280 . 0 0 "[ . 1 . 2]" 1
1132 1 75 LEU H 1 76 PRO HD3 3.075 . 4.350 4.335 4.261 4.382 0.032 11 0 "[ . 1 . 2]" 1
1133 1 75 LEU H 1 140 LEU QD 4.660 . 7.520 4.150 3.908 4.269 . 0 0 "[ . 1 . 2]" 1
1134 1 75 LEU HA 1 75 LEU HG 2.625 . 3.450 3.104 3.078 3.132 . 0 0 "[ . 1 . 2]" 1
1135 1 75 LEU HA 1 75 LEU MD2 3.235 . 4.670 1.990 1.952 2.010 . 0 0 "[ . 1 . 2]" 1
1136 1 75 LEU HA 1 76 PRO HD2 2.735 . 3.670 2.560 2.489 2.614 . 0 0 "[ . 1 . 2]" 1
1137 1 75 LEU HA 1 76 PRO HD3 2.610 . 3.420 2.031 1.986 2.111 . 0 0 "[ . 1 . 2]" 1
1138 1 75 LEU HB2 1 76 PRO HD2 3.400 . 5.000 4.911 4.844 4.985 . 0 0 "[ . 1 . 2]" 1
1139 1 75 LEU HB2 1 104 TRP HE1 3.605 . 5.410 5.381 5.239 5.423 0.013 13 0 "[ . 1 . 2]" 1
1140 1 75 LEU HB2 1 104 TRP HH2 3.200 . 4.600 4.641 4.613 4.662 0.062 5 0 "[ . 1 . 2]" 1
1141 1 75 LEU HB3 1 76 PRO HD2 3.245 . 4.690 3.670 3.553 3.797 . 0 0 "[ . 1 . 2]" 1
1142 1 75 LEU HB3 1 104 TRP HH2 2.955 . 4.110 3.658 3.538 3.814 . 0 0 "[ . 1 . 2]" 1
1143 1 75 LEU MD1 1 83 ALA MB 4.680 . 7.560 4.899 4.632 5.124 . 0 0 "[ . 1 . 2]" 1
1144 1 75 LEU MD1 1 104 TRP HE3 3.360 . 4.920 2.721 2.645 2.792 . 0 0 "[ . 1 . 2]" 1
1145 1 75 LEU MD1 1 137 VAL MG2 4.680 . 7.560 3.936 3.826 4.057 . 0 0 "[ . 1 . 2]" 1
1146 1 75 LEU MD1 1 140 LEU QD 5.230 . 8.660 1.836 1.687 2.026 0.113 14 0 "[ . 1 . 2]" 1
1147 1 75 LEU MD1 1 143 ILE MG 4.230 . 6.660 2.780 2.678 2.911 . 0 0 "[ . 1 . 2]" 1
1148 1 75 LEU MD1 1 143 ILE MD 3.700 . 5.600 3.183 3.092 3.263 . 0 0 "[ . 1 . 2]" 1
1149 1 75 LEU MD2 1 76 PRO HD2 3.575 . 5.350 2.964 2.870 3.048 . 0 0 "[ . 1 . 2]" 1
1150 1 75 LEU MD2 1 76 PRO HD3 3.575 . 5.350 3.217 3.128 3.344 . 0 0 "[ . 1 . 2]" 1
1151 1 75 LEU MD2 1 83 ALA MB 4.385 . 6.970 3.633 3.374 3.777 . 0 0 "[ . 1 . 2]" 1
1152 1 75 LEU MD2 1 104 TRP HA 4.135 . 6.470 4.359 4.219 4.482 . 0 0 "[ . 1 . 2]" 1
1153 1 75 LEU MD2 1 104 TRP HB2 4.070 . 6.340 2.587 2.461 2.706 . 0 0 "[ . 1 . 2]" 1
1154 1 75 LEU MD2 1 104 TRP HE3 3.360 . 4.920 3.254 3.064 3.522 . 0 0 "[ . 1 . 2]" 1
1155 1 75 LEU MD2 1 104 TRP HE1 3.980 . 6.160 3.648 3.557 3.785 . 0 0 "[ . 1 . 2]" 1
1156 1 76 PRO HA 1 77 LEU H 2.270 . 2.740 2.135 2.129 2.141 . 0 0 "[ . 1 . 2]" 1
1157 1 76 PRO HA 1 78 ASN H 2.625 . 3.450 3.556 3.545 3.572 0.122 15 0 "[ . 1 . 2]" 1
1158 1 76 PRO HA 1 104 TRP HE1 3.590 . 5.380 4.291 4.211 4.371 . 0 0 "[ . 1 . 2]" 1
1159 1 76 PRO HB2 1 77 LEU H 2.920 . 4.040 3.661 3.646 3.681 . 0 0 "[ . 1 . 2]" 1
1160 1 76 PRO HB2 1 78 ASN H 3.045 . 4.290 3.018 2.978 3.086 . 0 0 "[ . 1 . 2]" 1
1161 1 76 PRO HB3 1 77 LEU H 2.920 . 4.040 4.113 4.097 4.128 0.088 3 0 "[ . 1 . 2]" 1
1162 1 76 PRO HB3 1 78 ASN H 3.045 . 4.290 4.276 4.244 4.310 0.020 3 0 "[ . 1 . 2]" 1
1163 1 76 PRO QB 1 77 LEU H 2.795 . 3.790 3.423 3.416 3.431 . 0 0 "[ . 1 . 2]" 1
1164 1 76 PRO QB 1 78 ASN H 2.825 . 3.850 2.959 2.922 3.019 . 0 0 "[ . 1 . 2]" 1
1165 1 76 PRO QB 1 79 ASP H 3.105 . 4.410 2.689 2.607 2.757 . 0 0 "[ . 1 . 2]" 1
1166 1 76 PRO HG2 1 77 LEU H 3.650 . 5.500 5.130 5.054 5.208 . 0 0 "[ . 1 . 2]" 1
1167 1 76 PRO HG2 1 78 ASN H 3.650 . 5.500 4.844 4.747 4.991 . 0 0 "[ . 1 . 2]" 1
1168 1 76 PRO HG2 1 79 ASP H 3.400 . 5.000 3.344 3.259 3.476 . 0 0 "[ . 1 . 2]" 1
1169 1 76 PRO HG2 1 104 TRP HE1 2.970 . 4.140 3.117 3.036 3.196 . 0 0 "[ . 1 . 2]" 1
1170 1 76 PRO HG3 1 104 TRP HE1 3.495 . 5.190 4.452 4.390 4.499 . 0 0 "[ . 1 . 2]" 1
1171 1 76 PRO HD2 1 104 TRP HE1 3.280 . 4.760 2.101 2.035 2.180 . 0 0 "[ . 1 . 2]" 1
1172 1 76 PRO HD3 1 104 TRP HE1 3.650 . 5.500 3.814 3.769 3.872 . 0 0 "[ . 1 . 2]" 1
1173 1 77 LEU H 1 77 LEU HB2 2.535 . 3.270 2.121 2.106 2.133 . 0 0 "[ . 1 . 2]" 1
1174 1 77 LEU H 1 77 LEU HB3 2.535 . 3.270 3.435 3.422 3.443 0.173 7 0 "[ . 1 . 2]" 1
1175 1 77 LEU H 1 77 LEU QB 2.415 . 3.030 2.102 2.087 2.113 . 0 0 "[ . 1 . 2]" 1
1176 1 77 LEU H 1 77 LEU HG 2.440 . 3.080 2.957 2.916 3.036 . 0 0 "[ . 1 . 2]" 1
1177 1 77 LEU H 1 77 LEU QD 3.905 . 6.010 3.273 3.181 3.353 . 0 0 "[ . 1 . 2]" 1
1178 1 77 LEU H 1 78 ASN H 2.455 . 3.110 2.539 2.516 2.561 . 0 0 "[ . 1 . 2]" 1
1179 1 77 LEU H 1 79 ASP H 3.260 . 4.720 4.097 4.055 4.130 . 0 0 "[ . 1 . 2]" 1
1180 1 77 LEU HA 1 78 ASN H 2.640 . 3.480 3.470 3.463 3.476 . 0 0 "[ . 1 . 2]" 1
1181 1 77 LEU HA 1 104 TRP HE1 3.295 . 4.790 3.460 3.391 3.535 . 0 0 "[ . 1 . 2]" 1
1182 1 77 LEU HA 1 104 TRP HZ2 2.335 . 2.870 2.305 2.186 2.404 . 0 0 "[ . 1 . 2]" 1
1183 1 77 LEU HA 1 104 TRP HH2 3.110 . 4.420 4.295 4.147 4.394 . 0 0 "[ . 1 . 2]" 1
1184 1 77 LEU HA 1 106 PRO HA 3.295 . 4.790 4.883 4.863 4.901 0.111 4 0 "[ . 1 . 2]" 1
1185 1 77 LEU HB2 1 78 ASN H 2.705 . 3.610 3.092 3.066 3.117 . 0 0 "[ . 1 . 2]" 1
1186 1 77 LEU HB3 1 78 ASN H 2.705 . 3.610 3.602 3.546 3.626 0.016 5 0 "[ . 1 . 2]" 1
1187 1 77 LEU QB 1 78 ASN H 2.580 . 3.360 2.923 2.903 2.946 . 0 0 "[ . 1 . 2]" 1
1188 1 77 LEU QB 1 79 ASP H 3.365 . 4.930 4.523 4.503 4.546 . 0 0 "[ . 1 . 2]" 1
1189 1 77 LEU HG 1 78 ASN H 3.295 . 4.790 4.859 4.845 4.882 0.092 3 0 "[ . 1 . 2]" 1
1190 1 77 LEU MD1 1 104 TRP HZ2 3.790 . 5.780 4.396 4.201 4.512 . 0 0 "[ . 1 . 2]" 1
1191 1 77 LEU MD1 1 104 TRP HH2 4.165 . 6.530 4.651 4.376 4.821 . 0 0 "[ . 1 . 2]" 1
1192 1 77 LEU MD2 1 104 TRP HE1 4.165 . 6.530 4.866 4.699 5.146 . 0 0 "[ . 1 . 2]" 1
1193 1 77 LEU MD2 1 104 TRP HZ3 4.165 . 6.530 4.964 4.820 5.161 . 0 0 "[ . 1 . 2]" 1
1194 1 77 LEU MD2 1 104 TRP HZ2 3.050 . 4.300 2.818 2.509 3.194 . 0 0 "[ . 1 . 2]" 1
1195 1 77 LEU MD2 1 104 TRP HH2 3.495 . 5.190 3.047 2.825 3.230 . 0 0 "[ . 1 . 2]" 1
1196 1 77 LEU QD 1 78 ASN H 4.505 . 7.210 4.290 4.262 4.314 . 0 0 "[ . 1 . 2]" 1
1197 1 77 LEU QD 1 104 TRP HE1 4.695 . 7.590 4.704 4.577 4.911 . 0 0 "[ . 1 . 2]" 1
1198 1 78 ASN H 1 78 ASN HB2 2.595 . 3.390 2.616 2.256 3.597 0.207 4 0 "[ . 1 . 2]" 1
1199 1 78 ASN H 1 78 ASN HB3 2.595 . 3.390 3.080 3.023 3.408 0.018 11 0 "[ . 1 . 2]" 1
1200 1 78 ASN H 1 79 ASP H 2.255 . 2.710 2.552 2.513 2.588 . 0 0 "[ . 1 . 2]" 1
1201 1 78 ASN H 1 79 ASP QB 3.335 . 4.870 3.913 3.865 3.940 . 0 0 "[ . 1 . 2]" 1
1202 1 78 ASN H 1 106 PRO QB 4.005 . 6.210 4.744 4.683 4.783 . 0 0 "[ . 1 . 2]" 1
1203 1 78 ASN HA 1 78 ASN HB2 2.350 . 2.900 2.720 2.548 2.921 0.021 11 0 "[ . 1 . 2]" 1
1204 1 78 ASN HA 1 78 ASN HB3 2.350 . 2.900 2.808 2.352 2.937 0.037 14 0 "[ . 1 . 2]" 1
1205 1 78 ASN HA 1 78 ASN QB 2.245 . 2.690 2.453 2.174 2.530 . 0 0 "[ . 1 . 2]" 1
1206 1 78 ASN HA 1 108 SER H 2.875 . 3.950 4.053 4.033 4.070 0.120 15 0 "[ . 1 . 2]" 1
1207 1 78 ASN HA 1 108 SER QB 3.320 . 4.840 1.950 1.939 1.961 . 0 0 "[ . 1 . 2]" 1
1208 1 78 ASN HA 1 109 ALA H 2.970 . 4.140 3.354 3.297 3.452 . 0 0 "[ . 1 . 2]" 1
1209 1 78 ASN HA 1 109 ALA HA 2.455 . 3.110 2.793 2.653 3.010 . 0 0 "[ . 1 . 2]" 1
1210 1 78 ASN HA 1 109 ALA MB 3.325 . 4.850 3.415 3.306 3.512 . 0 0 "[ . 1 . 2]" 1
1211 1 78 ASN QB 1 109 ALA HA 4.095 . 6.390 3.880 3.460 4.066 . 0 0 "[ . 1 . 2]" 1
1212 1 79 ASP H 1 79 ASP HB2 2.580 . 3.360 2.943 2.923 2.958 . 0 0 "[ . 1 . 2]" 1
1213 1 79 ASP H 1 79 ASP HB3 2.580 . 3.360 3.367 3.338 3.392 0.032 15 0 "[ . 1 . 2]" 1
1214 1 79 ASP H 1 80 CYS H 3.090 . 4.380 4.266 4.231 4.296 . 0 0 "[ . 1 . 2]" 1
1215 1 79 ASP H 1 104 TRP HD1 3.510 . 5.220 5.091 4.986 5.160 . 0 0 "[ . 1 . 2]" 1
1216 1 79 ASP H 1 104 TRP HE1 3.200 . 4.600 3.508 3.446 3.567 . 0 0 "[ . 1 . 2]" 1
1217 1 79 ASP H 1 104 TRP HZ2 3.465 . 5.130 5.074 4.987 5.133 0.003 4 0 "[ . 1 . 2]" 1
1218 1 79 ASP H 1 109 ALA MB 3.250 . 4.700 2.887 2.759 3.196 . 0 0 "[ . 1 . 2]" 1
1219 1 79 ASP HA 1 79 ASP HB2 2.335 . 2.870 2.754 2.738 2.769 . 0 0 "[ . 1 . 2]" 1
1220 1 79 ASP HA 1 79 ASP HB3 2.335 . 2.870 2.915 2.904 2.924 0.054 20 0 "[ . 1 . 2]" 1
1221 1 79 ASP HA 1 79 ASP QB 2.215 . 2.630 2.518 2.513 2.522 . 0 0 "[ . 1 . 2]" 1
1222 1 79 ASP HA 1 80 CYS H 2.395 . 2.990 2.207 2.193 2.219 . 0 0 "[ . 1 . 2]" 1
1223 1 79 ASP HA 1 109 ALA HA 2.440 . 3.080 3.133 3.108 3.181 0.101 3 0 "[ . 1 . 2]" 1
1224 1 79 ASP HA 1 109 ALA MB 2.800 . 3.800 2.063 1.969 2.205 . 0 0 "[ . 1 . 2]" 1
1225 1 79 ASP HA 1 110 PRO HD2 2.845 . 3.890 3.044 2.738 3.392 . 0 0 "[ . 1 . 2]" 1
1226 1 79 ASP HA 1 110 PRO HD3 2.845 . 3.890 3.887 3.833 3.909 0.019 7 0 "[ . 1 . 2]" 1
1227 1 79 ASP HA 1 110 PRO QD 2.670 . 3.540 2.930 2.686 3.196 . 0 0 "[ . 1 . 2]" 1
1228 1 79 ASP HB2 1 109 ALA MB 4.165 . 6.530 4.218 4.157 4.344 . 0 0 "[ . 1 . 2]" 1
1229 1 79 ASP HB3 1 109 ALA MB 4.165 . 6.530 4.330 4.287 4.439 . 0 0 "[ . 1 . 2]" 1
1230 1 79 ASP QB 1 109 ALA MB 3.850 . 5.900 3.806 3.759 3.911 . 0 0 "[ . 1 . 2]" 1
1231 1 80 CYS H 1 80 CYS HB2 2.815 . 3.830 2.681 2.625 2.744 . 0 0 "[ . 1 . 2]" 1
1232 1 80 CYS H 1 81 ARG H 3.125 . 4.450 4.544 4.497 4.555 0.105 15 0 "[ . 1 . 2]" 1
1233 1 80 CYS H 1 106 PRO QD 4.065 . 6.330 3.597 3.536 3.641 . 0 0 "[ . 1 . 2]" 1
1234 1 80 CYS H 1 113 SER QB 3.725 . 5.650 3.384 3.221 3.474 . 0 0 "[ . 1 . 2]" 1
1235 1 80 CYS H 1 114 LYS QG 3.195 . 4.590 4.180 4.164 4.198 . 0 0 "[ . 1 . 2]" 1
1236 1 80 CYS HA 1 81 ARG H 2.425 . 3.050 2.263 2.180 2.313 . 0 0 "[ . 1 . 2]" 1
1237 1 80 CYS HA 1 103 PHE QE 4.725 . 7.650 4.782 4.567 5.027 . 0 0 "[ . 1 . 2]" 1
1238 1 80 CYS HA 1 104 TRP HD1 2.815 . 3.830 2.387 2.299 2.470 . 0 0 "[ . 1 . 2]" 1
1239 1 80 CYS HA 1 105 ALA MB 4.165 . 6.530 4.110 3.989 4.197 . 0 0 "[ . 1 . 2]" 1
1240 1 80 CYS HA 1 106 PRO HD2 3.185 . 4.570 2.212 2.096 2.329 . 0 0 "[ . 1 . 2]" 1
1241 1 80 CYS HA 1 106 PRO HD3 3.185 . 4.570 2.820 2.766 2.914 . 0 0 "[ . 1 . 2]" 1
1242 1 80 CYS HA 1 106 PRO QD 2.855 . 3.910 2.136 2.038 2.227 . 0 0 "[ . 1 . 2]" 1
1243 1 80 CYS HB2 1 81 ARG H 2.875 . 3.950 3.637 3.526 3.881 . 0 0 "[ . 1 . 2]" 1
1244 1 80 CYS HB2 1 103 PHE QE 4.335 . 6.870 3.508 3.302 3.691 . 0 0 "[ . 1 . 2]" 1
1245 1 80 CYS HB2 1 103 PHE HZ 3.450 . 5.100 4.692 4.457 4.887 . 0 0 "[ . 1 . 2]" 1
1246 1 80 CYS HB2 1 105 ALA HA 3.650 . 5.500 3.696 3.539 3.815 . 0 0 "[ . 1 . 2]" 1
1247 1 80 CYS HB3 1 81 ARG H 2.580 . 3.360 2.785 2.607 3.160 . 0 0 "[ . 1 . 2]" 1
1248 1 80 CYS HB3 1 105 ALA HA 2.905 . 4.010 2.191 1.995 2.348 . 0 0 "[ . 1 . 2]" 1
1249 1 81 ARG H 1 81 ARG QG 3.830 . 5.860 3.389 3.030 3.638 . 0 0 "[ . 1 . 2]" 1
1250 1 81 ARG H 1 103 PHE QD 4.725 . 7.650 4.036 3.870 4.261 . 0 0 "[ . 1 . 2]" 1
1251 1 81 ARG H 1 103 PHE QE 4.725 . 7.650 3.946 3.752 4.232 . 0 0 "[ . 1 . 2]" 1
1252 1 81 ARG H 1 104 TRP H 2.640 . 3.480 3.440 3.395 3.510 0.030 10 0 "[ . 1 . 2]" 1
1253 1 81 ARG H 1 104 TRP HB2 3.215 . 4.630 4.187 4.080 4.320 . 0 0 "[ . 1 . 2]" 1
1254 1 81 ARG H 1 104 TRP HB3 3.000 . 4.200 2.507 2.388 2.654 . 0 0 "[ . 1 . 2]" 1
1255 1 81 ARG H 1 104 TRP HD1 2.860 . 3.920 2.396 2.158 2.470 . 0 0 "[ . 1 . 2]" 1
1256 1 81 ARG H 1 104 TRP HE1 3.325 . 4.850 4.817 4.621 4.868 0.018 15 0 "[ . 1 . 2]" 1
1257 1 81 ARG H 1 105 ALA H 3.370 . 4.940 4.830 4.800 4.905 . 0 0 "[ . 1 . 2]" 1
1258 1 81 ARG H 1 105 ALA HA 2.860 . 3.920 3.723 3.685 3.834 . 0 0 "[ . 1 . 2]" 1
1259 1 81 ARG H 1 105 ALA MB 4.165 . 6.530 4.369 4.296 4.512 . 0 0 "[ . 1 . 2]" 1
1260 1 81 ARG H 1 106 PRO HD2 3.650 . 5.500 4.227 4.095 4.349 . 0 0 "[ . 1 . 2]" 1
1261 1 81 ARG H 1 106 PRO HD3 3.650 . 5.500 4.271 4.198 4.338 . 0 0 "[ . 1 . 2]" 1
1262 1 81 ARG HA 1 81 ARG QD 4.080 . 6.360 3.816 3.590 3.969 . 0 0 "[ . 1 . 2]" 1
1263 1 81 ARG HA 1 82 TYR H 2.505 . 3.210 2.541 2.464 2.588 . 0 0 "[ . 1 . 2]" 1
1264 1 81 ARG HA 1 117 TYR QE 4.540 . 7.280 3.420 3.305 3.595 . 0 0 "[ . 1 . 2]" 1
1265 1 81 ARG HB2 1 82 TYR H 3.355 . 4.910 3.482 3.206 3.742 . 0 0 "[ . 1 . 2]" 1
1266 1 81 ARG HB3 1 82 TYR H 3.075 . 4.350 2.233 2.131 2.363 . 0 0 "[ . 1 . 2]" 1
1267 1 81 ARG QB 1 82 TYR H 3.120 . 4.440 2.207 2.109 2.339 . 0 0 "[ . 1 . 2]" 1
1268 1 81 ARG QG 1 82 TYR H 3.320 . 4.840 3.807 3.573 4.099 . 0 0 "[ . 1 . 2]" 1
1269 1 81 ARG QG 1 104 TRP HE1 4.050 . 6.300 4.845 4.502 5.159 . 0 0 "[ . 1 . 2]" 1
1270 1 81 ARG QD 1 82 TYR H 3.240 . 4.680 4.055 3.645 4.217 . 0 0 "[ . 1 . 2]" 1
1271 1 82 TYR H 1 82 TYR HB2 2.705 . 3.610 2.639 2.604 2.674 . 0 0 "[ . 1 . 2]" 1
1272 1 82 TYR H 1 82 TYR HB3 2.750 . 3.700 3.760 3.749 3.787 0.087 11 0 "[ . 1 . 2]" 1
1273 1 82 TYR H 1 83 ALA H 3.125 . 4.450 4.493 4.475 4.503 0.053 14 0 "[ . 1 . 2]" 1
1274 1 82 TYR H 1 103 PHE QD 4.695 . 7.590 5.048 4.904 5.213 . 0 0 "[ . 1 . 2]" 1
1275 1 82 TYR HA 1 83 ALA H 2.335 . 2.870 2.371 2.339 2.397 . 0 0 "[ . 1 . 2]" 1
1276 1 82 TYR HA 1 83 ALA MB 3.825 . 5.850 3.744 3.717 3.766 . 0 0 "[ . 1 . 2]" 1
1277 1 82 TYR HA 1 103 PHE HA 2.455 . 3.110 2.522 2.401 2.669 . 0 0 "[ . 1 . 2]" 1
1278 1 82 TYR HA 1 103 PHE QD 4.320 . 6.840 3.405 3.292 3.591 . 0 0 "[ . 1 . 2]" 1
1279 1 82 TYR HA 1 104 TRP H 2.720 . 3.640 2.581 2.542 2.641 . 0 0 "[ . 1 . 2]" 1
1280 1 82 TYR HB2 1 83 ALA H 2.625 . 3.450 3.602 3.566 3.655 0.205 11 0 "[ . 1 . 2]" 1
1281 1 82 TYR HB2 1 124 ILE MD 3.575 . 5.350 2.342 2.029 2.525 . 0 0 "[ . 1 . 2]" 1
1282 1 82 TYR HB3 1 83 ALA H 2.550 . 3.300 2.484 2.416 2.532 . 0 0 "[ . 1 . 2]" 1
1283 1 82 TYR HB3 1 103 PHE QD 4.525 . 7.250 4.736 4.636 4.863 . 0 0 "[ . 1 . 2]" 1
1284 1 82 TYR HB3 1 124 ILE MD 4.165 . 6.530 2.548 2.310 2.721 . 0 0 "[ . 1 . 2]" 1
1285 1 82 TYR QD 1 83 ALA H 4.260 . 6.720 3.760 3.590 3.847 . 0 0 "[ . 1 . 2]" 1
1286 1 82 TYR QD 1 103 PHE HA 4.040 . 6.280 2.018 1.973 2.117 . 0 0 "[ . 1 . 2]" 1
1287 1 82 TYR QD 1 103 PHE QB 5.075 . 8.350 2.611 2.418 2.719 . 0 0 "[ . 1 . 2]" 1
1288 1 82 TYR QD 1 104 TRP H 4.725 . 7.650 3.649 3.592 3.804 . 0 0 "[ . 1 . 2]" 1
1289 1 82 TYR QD 1 117 TYR HA 4.075 . 6.350 5.018 4.816 5.389 . 0 0 "[ . 1 . 2]" 1
1290 1 82 TYR QD 1 117 TYR HB2 4.365 . 6.930 5.505 5.309 5.898 . 0 0 "[ . 1 . 2]" 1
1291 1 82 TYR QD 1 117 TYR HB3 4.365 . 6.930 4.122 3.912 4.565 . 0 0 "[ . 1 . 2]" 1
1292 1 82 TYR QD 1 121 LYS HA 4.400 . 7.000 4.641 4.328 4.758 . 0 0 "[ . 1 . 2]" 1
1293 1 82 TYR QD 1 121 LYS QB 5.170 . 8.540 5.334 4.479 5.551 . 0 0 "[ . 1 . 2]" 1
1294 1 82 TYR QD 1 124 ILE MG 4.525 . 7.250 3.379 3.148 3.589 . 0 0 "[ . 1 . 2]" 1
1295 1 82 TYR QE 1 117 TYR H 4.725 . 7.650 5.182 4.985 5.575 . 0 0 "[ . 1 . 2]" 1
1296 1 82 TYR QE 1 117 TYR HA 4.675 . 7.550 2.962 2.825 3.283 . 0 0 "[ . 1 . 2]" 1
1297 1 82 TYR QE 1 121 LYS H 4.615 . 7.430 4.031 3.783 4.204 . 0 0 "[ . 1 . 2]" 1
1298 1 82 TYR QE 1 121 LYS HA 3.980 . 6.160 3.453 3.278 3.562 . 0 0 "[ . 1 . 2]" 1
1299 1 82 TYR QE 1 121 LYS QB 5.170 . 8.540 3.625 2.865 3.851 . 0 0 "[ . 1 . 2]" 1
1300 1 82 TYR QE 1 121 LYS QG 4.985 . 8.170 2.744 2.130 4.727 . 0 0 "[ . 1 . 2]" 1
1301 1 82 TYR QE 1 124 ILE HB 4.725 . 7.650 4.382 3.885 4.791 . 0 0 "[ . 1 . 2]" 1
1302 1 82 TYR QE 1 124 ILE MG 4.415 . 7.030 3.343 3.149 3.534 . 0 0 "[ . 1 . 2]" 1
1303 1 83 ALA H 1 84 LEU H 3.200 . 4.600 4.186 4.157 4.234 . 0 0 "[ . 1 . 2]" 1
1304 1 83 ALA H 1 84 LEU QD 4.610 . 7.420 4.791 4.097 5.248 . 0 0 "[ . 1 . 2]" 1
1305 1 83 ALA H 1 101 PHE HA 3.295 . 4.790 4.771 4.686 4.828 0.038 12 0 "[ . 1 . 2]" 1
1306 1 83 ALA H 1 102 ILE H 2.505 . 3.210 3.233 3.208 3.253 0.043 1 0 "[ . 1 . 2]" 1
1307 1 83 ALA H 1 102 ILE HB 2.875 . 3.950 3.112 3.059 3.150 . 0 0 "[ . 1 . 2]" 1
1308 1 83 ALA H 1 102 ILE MG 3.515 . 5.230 4.351 4.307 4.373 . 0 0 "[ . 1 . 2]" 1
1309 1 83 ALA H 1 102 ILE HG12 3.570 . 5.340 5.466 5.442 5.492 0.152 11 0 "[ . 1 . 2]" 1
1310 1 83 ALA H 1 102 ILE HG13 3.570 . 5.340 4.434 4.387 4.487 . 0 0 "[ . 1 . 2]" 1
1311 1 83 ALA H 1 102 ILE QG 3.460 . 5.120 4.253 4.213 4.294 . 0 0 "[ . 1 . 2]" 1
1312 1 83 ALA H 1 102 ILE MD 4.165 . 6.530 5.120 5.043 5.188 . 0 0 "[ . 1 . 2]" 1
1313 1 83 ALA H 1 103 PHE HA 3.170 . 4.540 3.733 3.619 3.890 . 0 0 "[ . 1 . 2]" 1
1314 1 83 ALA H 1 104 TRP H 3.110 . 4.420 4.254 4.199 4.310 . 0 0 "[ . 1 . 2]" 1
1315 1 83 ALA HA 1 84 LEU H 2.350 . 2.900 2.133 2.120 2.171 . 0 0 "[ . 1 . 2]" 1
1316 1 83 ALA MB 1 84 LEU H 2.940 . 4.080 3.029 2.940 3.077 . 0 0 "[ . 1 . 2]" 1
1317 1 83 ALA MB 1 102 ILE H 3.420 . 5.040 3.874 3.747 4.043 . 0 0 "[ . 1 . 2]" 1
1318 1 84 LEU H 1 84 LEU HB2 2.580 . 3.360 2.647 2.344 2.842 . 0 0 "[ . 1 . 2]" 1
1319 1 84 LEU H 1 84 LEU HB3 2.440 . 3.080 2.880 2.744 3.122 0.042 16 0 "[ . 1 . 2]" 1
1320 1 84 LEU H 1 84 LEU HG 3.155 . 4.510 4.567 4.528 4.660 0.150 8 0 "[ . 1 . 2]" 1
1321 1 84 LEU H 1 84 LEU MD1 4.165 . 6.530 4.353 4.254 4.464 . 0 0 "[ . 1 . 2]" 1
1322 1 84 LEU H 1 84 LEU MD2 4.165 . 6.530 4.088 3.523 4.428 . 0 0 "[ . 1 . 2]" 1
1323 1 84 LEU H 1 84 LEU QD 3.930 . 6.060 3.711 3.396 3.907 . 0 0 "[ . 1 . 2]" 1
1324 1 84 LEU H 1 85 TYR H 3.090 . 4.380 4.329 4.247 4.385 0.005 3 0 "[ . 1 . 2]" 1
1325 1 84 LEU HA 1 84 LEU QD 3.075 . 4.350 2.322 1.891 2.673 . 0 0 "[ . 1 . 2]" 1
1326 1 84 LEU HA 1 85 TYR H 2.255 . 2.710 2.144 2.126 2.163 . 0 0 "[ . 1 . 2]" 1
1327 1 84 LEU HA 1 101 PHE HA 2.285 . 2.770 2.810 2.777 2.871 0.101 9 0 "[ . 1 . 2]" 1
1328 1 84 LEU HA 1 102 ILE H 2.705 . 3.610 3.039 2.879 3.197 . 0 0 "[ . 1 . 2]" 1
1329 1 84 LEU HB2 1 85 TYR H 3.185 . 4.570 4.393 4.264 4.571 0.001 16 0 "[ . 1 . 2]" 1
1330 1 84 LEU HB2 1 101 PHE HA 3.340 . 4.880 4.182 3.735 4.870 . 0 0 "[ . 1 . 2]" 1
1331 1 84 LEU HB3 1 85 TYR H 3.075 . 4.350 3.959 3.893 3.997 . 0 0 "[ . 1 . 2]" 1
1332 1 84 LEU MD1 1 85 TYR H 3.235 . 4.670 3.335 2.705 3.718 . 0 0 "[ . 1 . 2]" 1
1333 1 84 LEU MD1 1 101 PHE HA 3.885 . 5.970 2.721 1.974 3.742 . 0 0 "[ . 1 . 2]" 1
1334 1 84 LEU MD1 1 101 PHE HB2 4.745 . 7.690 3.135 2.446 4.207 . 0 0 "[ . 1 . 2]" 1
1335 1 84 LEU MD1 1 101 PHE HB3 4.745 . 7.690 4.397 3.717 5.396 . 0 0 "[ . 1 . 2]" 1
1336 1 84 LEU MD1 1 128 PHE QE 5.160 . 8.520 3.331 2.730 4.108 . 0 0 "[ . 1 . 2]" 1
1337 1 84 LEU MD1 1 128 PHE HZ 3.605 . 5.410 3.825 3.090 4.606 . 0 0 "[ . 1 . 2]" 1
1338 1 84 LEU MD2 1 85 TYR H 3.235 . 4.670 3.708 3.375 3.919 . 0 0 "[ . 1 . 2]" 1
1339 1 84 LEU MD2 1 101 PHE HA 3.885 . 5.970 3.608 1.834 4.818 . 0 0 "[ . 1 . 2]" 1
1340 1 84 LEU MD2 1 101 PHE HB2 4.745 . 7.690 3.955 2.291 5.065 . 0 0 "[ . 1 . 2]" 1
1341 1 84 LEU MD2 1 101 PHE HB3 4.745 . 7.690 5.258 3.566 6.397 . 0 0 "[ . 1 . 2]" 1
1342 1 84 LEU MD2 1 128 PHE QE 5.160 . 8.520 3.144 2.537 3.792 . 0 0 "[ . 1 . 2]" 1
1343 1 84 LEU MD2 1 128 PHE HZ 3.605 . 5.410 3.744 2.674 4.395 . 0 0 "[ . 1 . 2]" 1
1344 1 84 LEU QD 1 85 TYR H 3.045 . 4.290 3.097 2.601 3.374 . 0 0 "[ . 1 . 2]" 1
1345 1 84 LEU QD 1 99 LEU HB2 3.635 . 5.470 2.641 2.364 2.890 . 0 0 "[ . 1 . 2]" 1
1346 1 84 LEU QD 1 99 LEU HB3 3.650 . 5.500 3.608 3.502 3.730 . 0 0 "[ . 1 . 2]" 1
1347 1 84 LEU QD 1 100 VAL H 4.935 . 8.070 3.622 3.176 3.902 . 0 0 "[ . 1 . 2]" 1
1348 1 84 LEU QD 1 101 PHE HA 3.330 . 4.860 1.993 1.828 2.243 . 0 0 "[ . 1 . 2]" 1
1349 1 84 LEU QD 1 101 PHE QB 3.925 . 6.050 2.396 2.251 2.479 . 0 0 "[ . 1 . 2]" 1
1350 1 84 LEU QD 1 102 ILE H 4.160 . 6.520 3.474 3.036 3.857 . 0 0 "[ . 1 . 2]" 1
1351 1 84 LEU QD 1 128 PHE QE 5.005 . 8.210 2.727 2.514 2.988 . 0 0 "[ . 1 . 2]" 1
1352 1 84 LEU QD 1 128 PHE HZ 3.390 . 4.980 3.055 2.657 3.446 . 0 0 "[ . 1 . 2]" 1
1353 1 85 TYR H 1 85 TYR HB2 2.735 . 3.670 3.418 3.290 3.494 . 0 0 "[ . 1 . 2]" 1
1354 1 85 TYR H 1 85 TYR HB3 2.705 . 3.610 2.597 2.519 2.661 . 0 0 "[ . 1 . 2]" 1
1355 1 85 TYR H 1 100 VAL H 2.535 . 3.270 3.052 2.933 3.199 . 0 0 "[ . 1 . 2]" 1
1356 1 85 TYR H 1 100 VAL HB 3.200 . 4.600 4.077 3.863 4.181 . 0 0 "[ . 1 . 2]" 1
1357 1 85 TYR H 1 102 ILE QG 3.320 . 4.840 3.372 3.221 3.468 . 0 0 "[ . 1 . 2]" 1
1358 1 85 TYR H 1 102 ILE MD 3.590 . 5.380 4.095 3.965 4.197 . 0 0 "[ . 1 . 2]" 1
1359 1 85 TYR HA 1 86 ASP H 2.270 . 2.740 2.245 2.233 2.254 . 0 0 "[ . 1 . 2]" 1
1360 1 85 TYR HB2 1 86 ASP H 2.735 . 3.670 3.702 3.681 3.753 0.083 19 0 "[ . 1 . 2]" 1
1361 1 85 TYR HB3 1 86 ASP H 2.845 . 3.890 4.003 3.950 4.019 0.129 11 0 "[ . 1 . 2]" 1
1362 1 85 TYR QD 1 86 ASP H 4.725 . 7.650 2.461 2.219 3.231 . 0 0 "[ . 1 . 2]" 1
1363 1 85 TYR QD 1 87 ALA H 4.725 . 7.650 4.351 3.567 4.630 . 0 0 "[ . 1 . 2]" 1
1364 1 85 TYR QD 1 87 ALA HA 4.195 . 6.590 4.083 3.804 4.233 . 0 0 "[ . 1 . 2]" 1
1365 1 85 TYR QD 1 87 ALA MB 4.260 . 6.720 3.487 3.091 3.721 . 0 0 "[ . 1 . 2]" 1
1366 1 85 TYR QD 1 100 VAL HB 4.725 . 7.650 4.142 3.829 4.326 . 0 0 "[ . 1 . 2]" 1
1367 1 85 TYR QD 1 100 VAL QG 5.765 . 9.730 4.124 3.725 4.305 . 0 0 "[ . 1 . 2]" 1
1368 1 85 TYR QD 1 102 ILE MD 5.240 . 8.680 3.042 2.921 3.685 . 0 0 "[ . 1 . 2]" 1
1369 1 85 TYR QE 1 86 ASP H 4.725 . 7.650 3.709 3.580 4.152 . 0 0 "[ . 1 . 2]" 1
1370 1 85 TYR QE 1 87 ALA H 4.725 . 7.650 4.394 3.596 4.717 . 0 0 "[ . 1 . 2]" 1
1371 1 85 TYR QE 1 87 ALA HA 3.700 . 5.600 2.678 1.966 3.004 . 0 0 "[ . 1 . 2]" 1
1372 1 85 TYR QE 1 87 ALA MB 4.000 . 6.200 2.829 2.111 3.243 . 0 0 "[ . 1 . 2]" 1
1373 1 85 TYR QE 1 88 THR H 4.460 . 7.120 4.107 3.856 4.277 . 0 0 "[ . 1 . 2]" 1
1374 1 85 TYR QE 1 100 VAL QG 5.765 . 9.730 4.950 4.564 5.137 . 0 0 "[ . 1 . 2]" 1
1375 1 85 TYR QE 1 102 ILE MD 4.275 . 6.750 4.686 4.596 5.007 . 0 0 "[ . 1 . 2]" 1
1376 1 86 ASP H 1 86 ASP HB2 2.520 . 3.240 2.947 2.913 2.989 . 0 0 "[ . 1 . 2]" 1
1377 1 86 ASP H 1 86 ASP HB3 2.520 . 3.240 2.527 2.503 2.560 . 0 0 "[ . 1 . 2]" 1
1378 1 86 ASP H 1 87 ALA H 3.060 . 4.320 4.269 4.236 4.302 . 0 0 "[ . 1 . 2]" 1
1379 1 86 ASP HA 1 99 LEU QD 3.885 . 5.970 3.900 3.835 3.949 . 0 0 "[ . 1 . 2]" 1
1380 1 86 ASP HA 1 100 VAL H 2.565 . 3.330 3.401 3.372 3.434 0.104 3 0 "[ . 1 . 2]" 1
1381 1 86 ASP HB2 1 87 ALA H 3.075 . 4.350 4.337 4.316 4.349 . 0 0 "[ . 1 . 2]" 1
1382 1 86 ASP HB2 1 99 LEU QD 4.305 . 6.810 3.733 3.642 3.842 . 0 0 "[ . 1 . 2]" 1
1383 1 86 ASP HB3 1 87 ALA H 3.075 . 4.350 4.347 4.321 4.360 0.010 16 0 "[ . 1 . 2]" 1
1384 1 86 ASP HB3 1 99 LEU QD 4.305 . 6.810 4.992 4.949 5.048 . 0 0 "[ . 1 . 2]" 1
1385 1 86 ASP QB 1 87 ALA H 3.000 . 4.200 3.868 3.853 3.876 . 0 0 "[ . 1 . 2]" 1
1386 1 86 ASP QB 1 99 LEU QD 4.190 . 6.580 3.634 3.554 3.730 . 0 0 "[ . 1 . 2]" 1
1387 1 87 ALA H 1 98 ASP H 2.580 . 3.360 3.416 3.390 3.446 0.086 15 0 "[ . 1 . 2]" 1
1388 1 87 ALA H 1 99 LEU QD 4.260 . 6.720 4.845 4.753 4.895 . 0 0 "[ . 1 . 2]" 1
1389 1 87 ALA H 1 100 VAL H 2.935 . 4.070 3.930 3.849 4.034 . 0 0 "[ . 1 . 2]" 1
1390 1 87 ALA H 1 100 VAL QG 4.230 . 6.660 3.619 3.389 3.748 . 0 0 "[ . 1 . 2]" 1
1391 1 87 ALA HA 1 88 THR H 2.350 . 2.900 2.140 2.132 2.150 . 0 0 "[ . 1 . 2]" 1
1392 1 87 ALA HA 1 153 LEU QD 4.935 . 8.070 4.034 3.753 4.301 . 0 0 "[ . 1 . 2]" 1
1393 1 87 ALA HA 1 161 LEU QD 4.410 . 7.020 3.538 3.310 3.817 . 0 0 "[ . 1 . 2]" 1
1394 1 87 ALA MB 1 88 THR HA 3.915 . 6.030 4.243 4.215 4.277 . 0 0 "[ . 1 . 2]" 1
1395 1 87 ALA MB 1 89 TYR QD 4.385 . 6.970 2.621 2.466 2.684 . 0 0 "[ . 1 . 2]" 1
1396 1 87 ALA MB 1 97 GLU HA 4.165 . 6.530 4.551 4.456 4.636 . 0 0 "[ . 1 . 2]" 1
1397 1 87 ALA MB 1 98 ASP H 3.450 . 5.100 3.591 3.507 3.671 . 0 0 "[ . 1 . 2]" 1
1398 1 87 ALA MB 1 98 ASP HB2 3.605 . 5.410 3.946 3.773 4.108 . 0 0 "[ . 1 . 2]" 1
1399 1 87 ALA MB 1 98 ASP HB3 3.605 . 5.410 4.321 4.210 4.362 . 0 0 "[ . 1 . 2]" 1
1400 1 87 ALA MB 1 98 ASP QB 4.220 . 6.640 3.654 3.519 3.761 . 0 0 "[ . 1 . 2]" 1
1401 1 87 ALA MB 1 100 VAL H 4.165 . 6.530 4.440 4.316 4.622 . 0 0 "[ . 1 . 2]" 1
1402 1 87 ALA MB 1 149 LEU QD 4.705 . 7.610 2.689 2.457 2.818 . 0 0 "[ . 1 . 2]" 1
1403 1 87 ALA MB 1 153 LEU HA 3.930 . 6.060 4.887 4.705 5.086 . 0 0 "[ . 1 . 2]" 1
1404 1 87 ALA MB 1 153 LEU MD1 3.905 . 6.010 1.781 1.746 2.046 0.054 2 0 "[ . 1 . 2]" 1
1405 1 87 ALA MB 1 153 LEU MD2 3.905 . 6.010 2.921 1.928 3.232 . 0 0 "[ . 1 . 2]" 1
1406 1 87 ALA MB 1 153 LEU QD 3.715 . 5.630 1.761 1.623 1.998 0.177 2 0 "[ . 1 . 2]" 1
1407 1 88 THR H 1 88 THR HB 2.440 . 3.080 2.804 2.699 3.072 . 0 0 "[ . 1 . 2]" 1
1408 1 88 THR HA 1 88 THR HB 2.395 . 2.990 2.983 2.929 2.999 0.009 1 0 "[ . 1 . 2]" 1
1409 1 88 THR HA 1 88 THR MG 2.705 . 3.610 2.188 2.149 2.216 . 0 0 "[ . 1 . 2]" 1
1410 1 88 THR HA 1 89 TYR H 2.255 . 2.710 2.152 2.137 2.177 . 0 0 "[ . 1 . 2]" 1
1411 1 88 THR HA 1 89 TYR QD 4.305 . 6.810 3.264 3.170 3.462 . 0 0 "[ . 1 . 2]" 1
1412 1 88 THR HA 1 89 TYR QE 4.725 . 7.650 4.226 4.156 4.391 . 0 0 "[ . 1 . 2]" 1
1413 1 88 THR HA 1 97 GLU HA 2.180 . 2.560 2.505 2.454 2.573 0.013 16 0 "[ . 1 . 2]" 1
1414 1 88 THR HA 1 97 GLU HB2 3.370 . 4.940 4.531 4.469 4.640 . 0 0 "[ . 1 . 2]" 1
1415 1 88 THR HA 1 97 GLU HB3 3.370 . 4.940 3.299 3.200 3.400 . 0 0 "[ . 1 . 2]" 1
1416 1 88 THR HA 1 97 GLU QB 3.120 . 4.440 3.224 3.135 3.319 . 0 0 "[ . 1 . 2]" 1
1417 1 88 THR HA 1 97 GLU HG2 2.535 . 3.270 3.098 2.918 3.299 0.029 6 0 "[ . 1 . 2]" 1
1418 1 88 THR HA 1 97 GLU HG3 2.535 . 3.270 2.604 2.503 2.724 . 0 0 "[ . 1 . 2]" 1
1419 1 88 THR HA 1 98 ASP H 2.675 . 3.550 3.636 3.609 3.670 0.120 19 0 "[ . 1 . 2]" 1
1420 1 88 THR HA 1 161 LEU QD 4.640 . 7.480 4.463 4.257 4.720 . 0 0 "[ . 1 . 2]" 1
1421 1 88 THR HB 1 89 TYR H 2.905 . 4.010 4.122 4.051 4.167 0.157 8 0 "[ . 1 . 2]" 1
1422 1 88 THR HB 1 89 TYR HA 3.140 . 4.480 4.442 4.337 4.504 0.024 9 0 "[ . 1 . 2]" 1
1423 1 88 THR HB 1 97 GLU HG2 3.140 . 4.480 4.300 4.059 4.500 0.020 19 0 "[ . 1 . 2]" 1
1424 1 88 THR HB 1 97 GLU HG3 3.140 . 4.480 4.528 4.505 4.556 0.076 11 0 "[ . 1 . 2]" 1
1425 1 88 THR HB 1 162 GLU QG 4.095 . 6.390 4.793 3.855 5.769 . 0 0 "[ . 1 . 2]" 1
1426 1 88 THR MG 1 89 TYR H 3.050 . 4.300 3.024 2.894 3.338 . 0 0 "[ . 1 . 2]" 1
1427 1 88 THR MG 1 97 GLU HA 3.220 . 4.640 3.544 3.451 3.624 . 0 0 "[ . 1 . 2]" 1
1428 1 88 THR MG 1 97 GLU HG2 3.050 . 4.300 1.847 1.811 1.888 . 0 0 "[ . 1 . 2]" 1
1429 1 88 THR MG 1 97 GLU HG3 3.050 . 4.300 1.940 1.922 2.021 . 0 0 "[ . 1 . 2]" 1
1430 1 88 THR MG 1 98 ASP H 3.915 . 6.030 4.830 4.544 4.923 . 0 0 "[ . 1 . 2]" 1
1431 1 89 TYR H 1 89 TYR HB2 2.815 . 3.830 3.742 3.723 3.752 . 0 0 "[ . 1 . 2]" 1
1432 1 89 TYR H 1 89 TYR HB3 2.815 . 3.830 3.479 3.427 3.502 . 0 0 "[ . 1 . 2]" 1
1433 1 89 TYR H 1 89 TYR QE 4.570 . 7.340 3.913 3.822 4.006 . 0 0 "[ . 1 . 2]" 1
1434 1 89 TYR H 1 96 LYS H 2.830 . 3.860 3.936 3.889 3.969 0.109 16 0 "[ . 1 . 2]" 1
1435 1 89 TYR H 1 97 GLU HA 2.750 . 3.700 3.048 2.977 3.119 . 0 0 "[ . 1 . 2]" 1
1436 1 89 TYR H 1 97 GLU QG 4.015 . 6.230 3.179 2.989 3.337 . 0 0 "[ . 1 . 2]" 1
1437 1 89 TYR H 1 161 LEU QD 4.410 . 7.020 3.898 3.702 4.045 . 0 0 "[ . 1 . 2]" 1
1438 1 89 TYR HA 1 89 TYR HB2 2.270 . 2.740 2.599 2.587 2.604 . 0 0 "[ . 1 . 2]" 1
1439 1 89 TYR HA 1 89 TYR HB3 2.270 . 2.740 2.316 2.310 2.322 . 0 0 "[ . 1 . 2]" 1
1440 1 89 TYR HA 1 90 GLU H 2.550 . 3.300 2.396 2.379 2.407 . 0 0 "[ . 1 . 2]" 1
1441 1 89 TYR HA 1 158 VAL MG1 3.480 . 5.160 3.739 3.567 3.875 . 0 0 "[ . 1 . 2]" 1
1442 1 89 TYR HA 1 161 LEU HA 2.225 . 2.650 2.271 2.199 2.343 . 0 0 "[ . 1 . 2]" 1
1443 1 89 TYR HA 1 161 LEU HB2 3.650 . 5.500 4.282 4.258 4.330 . 0 0 "[ . 1 . 2]" 1
1444 1 89 TYR HA 1 161 LEU HB3 3.650 . 5.500 5.212 5.168 5.245 . 0 0 "[ . 1 . 2]" 1
1445 1 89 TYR HA 1 161 LEU QB 3.220 . 4.640 4.095 4.080 4.133 . 0 0 "[ . 1 . 2]" 1
1446 1 89 TYR HA 1 161 LEU HG 3.030 . 4.260 3.972 3.733 4.279 0.019 17 0 "[ . 1 . 2]" 1
1447 1 89 TYR HA 1 161 LEU MD1 4.165 . 6.530 3.574 3.342 3.691 . 0 0 "[ . 1 . 2]" 1
1448 1 89 TYR HA 1 161 LEU MD2 4.165 . 6.530 5.265 5.128 5.394 . 0 0 "[ . 1 . 2]" 1
1449 1 89 TYR HA 1 161 LEU QD 3.585 . 5.370 3.517 3.311 3.611 . 0 0 "[ . 1 . 2]" 1
1450 1 89 TYR HA 1 162 GLU H 3.015 . 4.230 2.640 2.600 2.697 . 0 0 "[ . 1 . 2]" 1
1451 1 89 TYR HA 1 162 GLU HA 3.140 . 4.480 4.556 4.523 4.589 0.109 7 0 "[ . 1 . 2]" 1
1452 1 89 TYR HB2 1 90 GLU H 2.520 . 3.240 2.364 2.345 2.379 . 0 0 "[ . 1 . 2]" 1
1453 1 89 TYR HB2 1 158 VAL MG1 3.155 . 4.510 1.912 1.830 2.046 . 0 0 "[ . 1 . 2]" 1
1454 1 89 TYR HB2 1 161 LEU HA 2.905 . 4.010 3.130 3.026 3.295 . 0 0 "[ . 1 . 2]" 1
1455 1 89 TYR HB2 1 161 LEU QD 3.555 . 5.310 3.117 3.053 3.199 . 0 0 "[ . 1 . 2]" 1
1456 1 89 TYR HB3 1 90 GLU H 2.580 . 3.360 3.468 3.460 3.482 0.122 6 0 "[ . 1 . 2]" 1
1457 1 89 TYR HB3 1 158 VAL MG1 3.050 . 4.300 2.576 2.371 2.772 . 0 0 "[ . 1 . 2]" 1
1458 1 89 TYR HB3 1 161 LEU HA 2.720 . 3.640 2.229 2.133 2.304 . 0 0 "[ . 1 . 2]" 1
1459 1 89 TYR HB3 1 161 LEU QD 3.620 . 5.440 1.883 1.846 1.935 . 0 0 "[ . 1 . 2]" 1
1460 1 89 TYR QD 1 90 GLU H 4.600 . 7.400 3.942 3.907 3.966 . 0 0 "[ . 1 . 2]" 1
1461 1 89 TYR QD 1 91 THR MG 4.215 . 6.630 2.748 2.605 3.017 . 0 0 "[ . 1 . 2]" 1
1462 1 89 TYR QD 1 96 LYS H 4.725 . 7.650 4.285 3.902 4.560 . 0 0 "[ . 1 . 2]" 1
1463 1 89 TYR QD 1 96 LYS QB 5.170 . 8.540 4.675 3.388 5.567 . 0 0 "[ . 1 . 2]" 1
1464 1 89 TYR QD 1 96 LYS QD 4.920 . 8.040 4.739 3.772 5.953 . 0 0 "[ . 1 . 2]" 1
1465 1 89 TYR QD 1 96 LYS QE 5.170 . 8.540 4.891 2.976 6.418 . 0 0 "[ . 1 . 2]" 1
1466 1 89 TYR QD 1 97 GLU HA 4.400 . 7.000 4.021 3.772 4.241 . 0 0 "[ . 1 . 2]" 1
1467 1 89 TYR QD 1 98 ASP H 4.725 . 7.650 4.479 4.348 4.677 . 0 0 "[ . 1 . 2]" 1
1468 1 89 TYR QD 1 153 LEU MD1 4.895 . 7.990 3.949 3.834 4.180 . 0 0 "[ . 1 . 2]" 1
1469 1 89 TYR QD 1 153 LEU MD2 4.895 . 7.990 5.235 4.096 5.462 . 0 0 "[ . 1 . 2]" 1
1470 1 89 TYR QD 1 153 LEU QD 4.720 . 7.640 3.828 3.685 4.006 . 0 0 "[ . 1 . 2]" 1
1471 1 89 TYR QD 1 158 VAL HA 4.725 . 7.650 3.746 3.502 3.981 . 0 0 "[ . 1 . 2]" 1
1472 1 89 TYR QD 1 158 VAL HB 4.725 . 7.650 4.534 4.320 4.837 . 0 0 "[ . 1 . 2]" 1
1473 1 89 TYR QD 1 158 VAL MG1 4.310 . 6.820 2.814 2.654 3.070 . 0 0 "[ . 1 . 2]" 1
1474 1 89 TYR QD 1 158 VAL MG2 4.275 . 6.750 1.959 1.871 2.102 . 0 0 "[ . 1 . 2]" 1
1475 1 89 TYR QD 1 160 SER H 4.725 . 7.650 5.293 5.119 5.481 . 0 0 "[ . 1 . 2]" 1
1476 1 89 TYR QD 1 161 LEU HA 4.725 . 7.650 4.221 4.156 4.315 . 0 0 "[ . 1 . 2]" 1
1477 1 89 TYR QD 1 161 LEU MD1 4.865 . 7.930 1.993 1.945 2.080 . 0 0 "[ . 1 . 2]" 1
1478 1 89 TYR QD 1 161 LEU MD2 4.865 . 7.930 4.490 4.368 4.547 . 0 0 "[ . 1 . 2]" 1
1479 1 89 TYR QD 1 161 LEU QD 4.635 . 7.470 1.991 1.943 2.077 . 0 0 "[ . 1 . 2]" 1
1480 1 89 TYR QE 1 91 THR MG 4.135 . 6.470 3.520 3.308 3.907 . 0 0 "[ . 1 . 2]" 1
1481 1 89 TYR QE 1 96 LYS HA 4.725 . 7.650 5.919 5.159 6.439 . 0 0 "[ . 1 . 2]" 1
1482 1 89 TYR QE 1 96 LYS HB2 4.725 . 7.650 4.414 3.365 5.230 . 0 0 "[ . 1 . 2]" 1
1483 1 89 TYR QE 1 96 LYS HB3 4.725 . 7.650 4.609 2.566 5.994 . 0 0 "[ . 1 . 2]" 1
1484 1 89 TYR QE 1 96 LYS QD 4.690 . 7.580 3.749 2.446 5.256 . 0 0 "[ . 1 . 2]" 1
1485 1 89 TYR QE 1 96 LYS QE 5.170 . 8.540 3.980 2.155 5.709 . 0 0 "[ . 1 . 2]" 1
1486 1 89 TYR QE 1 97 GLU HA 4.445 . 7.090 3.615 3.292 3.870 . 0 0 "[ . 1 . 2]" 1
1487 1 89 TYR QE 1 98 ASP H 4.400 . 7.000 3.201 3.052 3.483 . 0 0 "[ . 1 . 2]" 1
1488 1 89 TYR QE 1 98 ASP HA 4.725 . 7.650 5.187 5.045 5.520 . 0 0 "[ . 1 . 2]" 1
1489 1 89 TYR QE 1 98 ASP HB2 4.025 . 6.250 2.960 2.752 3.377 . 0 0 "[ . 1 . 2]" 1
1490 1 89 TYR QE 1 98 ASP HB3 4.025 . 6.250 4.157 3.977 4.395 . 0 0 "[ . 1 . 2]" 1
1491 1 89 TYR QE 1 98 ASP QB 3.950 . 6.100 2.899 2.705 3.274 . 0 0 "[ . 1 . 2]" 1
1492 1 89 TYR QE 1 99 LEU H 4.725 . 7.650 5.856 5.698 6.095 . 0 0 "[ . 1 . 2]" 1
1493 1 89 TYR QE 1 153 LEU MD1 4.805 . 7.810 2.146 1.969 3.423 . 0 0 "[ . 1 . 2]" 1
1494 1 89 TYR QE 1 153 LEU MD2 4.805 . 7.810 4.273 2.175 4.465 . 0 0 "[ . 1 . 2]" 1
1495 1 89 TYR QE 1 153 LEU QD 4.600 . 7.400 2.079 1.967 2.257 . 0 0 "[ . 1 . 2]" 1
1496 1 89 TYR QE 1 158 VAL HA 4.725 . 7.650 5.400 5.080 5.717 . 0 0 "[ . 1 . 2]" 1
1497 1 89 TYR QE 1 158 VAL MG1 5.190 . 8.580 4.497 4.336 4.722 . 0 0 "[ . 1 . 2]" 1
1498 1 89 TYR QE 1 158 VAL MG2 4.585 . 7.370 2.958 2.699 3.196 . 0 0 "[ . 1 . 2]" 1
1499 1 89 TYR QE 1 161 LEU MD1 4.865 . 7.930 3.575 3.515 3.616 . 0 0 "[ . 1 . 2]" 1
1500 1 89 TYR QE 1 161 LEU MD2 4.865 . 7.930 5.696 5.629 5.752 . 0 0 "[ . 1 . 2]" 1
1501 1 89 TYR QE 1 161 LEU QD 4.690 . 7.580 3.540 3.482 3.578 . 0 0 "[ . 1 . 2]" 1
1502 1 90 GLU H 1 90 GLU QG 3.845 . 5.890 2.261 1.997 4.245 . 0 0 "[ . 1 . 2]" 1
1503 1 90 GLU H 1 91 THR H 3.140 . 4.480 4.222 4.170 4.251 . 0 0 "[ . 1 . 2]" 1
1504 1 90 GLU H 1 158 VAL MG1 3.420 . 5.040 2.826 2.611 2.962 . 0 0 "[ . 1 . 2]" 1
1505 1 90 GLU H 1 160 SER H 2.735 . 3.670 3.314 3.211 3.469 . 0 0 "[ . 1 . 2]" 1
1506 1 90 GLU HA 1 91 THR H 2.350 . 2.900 2.118 2.103 2.135 . 0 0 "[ . 1 . 2]" 1
1507 1 90 GLU HA 1 94 SER H 3.555 . 5.310 5.370 5.091 5.407 0.097 9 0 "[ . 1 . 2]" 1
1508 1 90 GLU HA 1 95 LYS HA 2.115 . 2.430 1.915 1.840 1.937 . 0 0 "[ . 1 . 2]" 1
1509 1 90 GLU HA 1 95 LYS HB2 3.125 . 4.450 4.006 3.597 4.506 0.056 19 0 "[ . 1 . 2]" 1
1510 1 90 GLU HA 1 95 LYS HB3 3.125 . 4.450 3.007 2.742 3.472 . 0 0 "[ . 1 . 2]" 1
1511 1 90 GLU HA 1 95 LYS QB 3.010 . 4.220 2.920 2.664 3.315 . 0 0 "[ . 1 . 2]" 1
1512 1 90 GLU HA 1 95 LYS HG2 3.650 . 5.500 4.613 3.502 5.226 . 0 0 "[ . 1 . 2]" 1
1513 1 90 GLU HA 1 95 LYS HG3 3.650 . 5.500 5.170 3.985 5.510 0.010 6 0 "[ . 1 . 2]" 1
1514 1 90 GLU HA 1 95 LYS QG 3.475 . 5.150 4.266 3.409 4.719 . 0 0 "[ . 1 . 2]" 1
1515 1 90 GLU HA 1 96 LYS H 2.535 . 3.270 2.695 2.271 2.821 . 0 0 "[ . 1 . 2]" 1
1516 1 90 GLU HA 1 159 VAL QG 4.685 . 7.570 5.408 5.285 5.490 . 0 0 "[ . 1 . 2]" 1
1517 1 90 GLU HB2 1 95 LYS HA 2.690 . 3.580 3.262 2.464 3.413 . 0 0 "[ . 1 . 2]" 1
1518 1 90 GLU HB3 1 95 LYS HA 2.690 . 3.580 3.254 3.102 3.699 0.119 6 0 "[ . 1 . 2]" 1
1519 1 90 GLU QB 1 95 LYS HA 2.495 . 3.190 2.883 2.429 2.963 . 0 0 "[ . 1 . 2]" 1
1520 1 90 GLU QG 1 91 THR H 3.925 . 6.050 4.230 2.560 4.510 . 0 0 "[ . 1 . 2]" 1
1521 1 90 GLU QG 1 160 SER H 4.095 . 6.390 3.417 3.032 5.692 . 0 0 "[ . 1 . 2]" 1
1522 1 91 THR H 1 92 LYS H 3.230 . 4.660 4.514 4.494 4.537 . 0 0 "[ . 1 . 2]" 1
1523 1 91 THR H 1 92 LYS HA 3.650 . 5.500 5.457 5.419 5.507 0.007 6 0 "[ . 1 . 2]" 1
1524 1 91 THR H 1 94 SER H 2.780 . 3.760 3.588 3.429 3.648 . 0 0 "[ . 1 . 2]" 1
1525 1 91 THR H 1 95 LYS HA 2.640 . 3.480 2.646 2.497 2.994 . 0 0 "[ . 1 . 2]" 1
1526 1 91 THR H 1 96 LYS H 2.705 . 3.610 3.701 3.603 3.765 0.155 16 0 "[ . 1 . 2]" 1
1527 1 91 THR H 1 157 VAL QG 4.695 . 7.590 5.378 5.266 5.429 . 0 0 "[ . 1 . 2]" 1
1528 1 91 THR HA 1 91 THR HB 2.225 . 2.650 2.406 2.360 2.458 . 0 0 "[ . 1 . 2]" 1
1529 1 91 THR HA 1 91 THR MG 2.720 . 3.640 2.484 2.393 2.572 . 0 0 "[ . 1 . 2]" 1
1530 1 91 THR HA 1 92 LYS H 2.505 . 3.210 2.552 2.507 2.570 . 0 0 "[ . 1 . 2]" 1
1531 1 91 THR HA 1 157 VAL QG 4.640 . 7.480 4.510 4.416 4.656 . 0 0 "[ . 1 . 2]" 1
1532 1 91 THR HA 1 158 VAL HA 2.240 . 2.680 2.460 2.408 2.532 . 0 0 "[ . 1 . 2]" 1
1533 1 91 THR HA 1 158 VAL HB 3.650 . 5.500 5.418 5.355 5.488 . 0 0 "[ . 1 . 2]" 1
1534 1 91 THR HA 1 158 VAL MG2 3.465 . 5.130 4.122 4.080 4.202 . 0 0 "[ . 1 . 2]" 1
1535 1 91 THR HA 1 159 VAL H 2.660 . 3.520 1.922 1.902 1.944 . 0 0 "[ . 1 . 2]" 1
1536 1 91 THR HA 1 159 VAL HB 3.000 . 4.200 3.465 3.428 3.543 . 0 0 "[ . 1 . 2]" 1
1537 1 91 THR HA 1 159 VAL MG1 3.620 . 5.440 4.669 4.621 4.696 . 0 0 "[ . 1 . 2]" 1
1538 1 91 THR HA 1 159 VAL MG2 3.620 . 5.440 2.141 1.985 2.255 . 0 0 "[ . 1 . 2]" 1
1539 1 91 THR HA 1 159 VAL QG 3.185 . 4.570 2.137 1.983 2.250 . 0 0 "[ . 1 . 2]" 1
1540 1 91 THR HA 1 160 SER H 2.830 . 3.860 3.857 3.748 3.915 0.055 2 0 "[ . 1 . 2]" 1
1541 1 91 THR HB 1 157 VAL QG 3.740 . 5.680 3.484 3.391 3.703 . 0 0 "[ . 1 . 2]" 1
1542 1 91 THR HB 1 158 VAL HA 2.640 . 3.480 3.508 3.473 3.535 0.055 14 0 "[ . 1 . 2]" 1
1543 1 91 THR HB 1 159 VAL QG 4.115 . 6.430 3.398 3.308 3.456 . 0 0 "[ . 1 . 2]" 1
1544 1 91 THR MG 1 92 LYS H 3.495 . 5.190 3.744 3.639 3.819 . 0 0 "[ . 1 . 2]" 1
1545 1 91 THR MG 1 94 SER H 3.730 . 5.660 3.891 3.757 4.064 . 0 0 "[ . 1 . 2]" 1
1546 1 91 THR MG 1 158 VAL H 4.165 . 6.530 3.696 3.313 4.043 . 0 0 "[ . 1 . 2]" 1
1547 1 91 THR MG 1 158 VAL HA 2.925 . 4.050 2.189 1.932 2.568 . 0 0 "[ . 1 . 2]" 1
1548 1 91 THR MG 1 159 VAL H 3.900 . 6.000 3.454 3.242 3.657 . 0 0 "[ . 1 . 2]" 1
1549 1 92 LYS H 1 92 LYS QG 4.095 . 6.390 2.937 1.987 3.974 . 0 0 "[ . 1 . 2]" 1
1550 1 92 LYS H 1 92 LYS QD 4.095 . 6.390 3.980 2.385 4.871 . 0 0 "[ . 1 . 2]" 1
1551 1 92 LYS H 1 93 GLU H 2.750 . 3.700 2.666 2.652 2.726 . 0 0 "[ . 1 . 2]" 1
1552 1 92 LYS H 1 94 SER H 3.155 . 4.510 4.425 4.340 4.521 0.011 10 0 "[ . 1 . 2]" 1
1553 1 92 LYS H 1 157 VAL HB 3.510 . 5.220 4.458 4.278 4.825 . 0 0 "[ . 1 . 2]" 1
1554 1 92 LYS H 1 157 VAL QG 4.695 . 7.590 4.730 4.612 4.987 . 0 0 "[ . 1 . 2]" 1
1555 1 92 LYS H 1 159 VAL MG1 3.805 . 5.810 4.732 4.601 4.826 . 0 0 "[ . 1 . 2]" 1
1556 1 92 LYS H 1 159 VAL MG2 3.805 . 5.810 2.134 1.998 2.257 . 0 0 "[ . 1 . 2]" 1
1557 1 92 LYS H 1 159 VAL QG 3.615 . 5.430 2.131 1.996 2.253 . 0 0 "[ . 1 . 2]" 1
1558 1 92 LYS HA 1 93 GLU HA 3.260 . 4.720 4.544 4.534 4.566 . 0 0 "[ . 1 . 2]" 1
1559 1 92 LYS HA 1 94 SER H 3.370 . 4.940 4.895 4.824 4.978 0.038 10 0 "[ . 1 . 2]" 1
1560 1 92 LYS QG 1 93 GLU H 4.095 . 6.390 3.724 2.725 4.922 . 0 0 "[ . 1 . 2]" 1
1561 1 92 LYS QG 1 159 VAL QG 4.945 . 8.090 2.818 1.794 3.465 0.006 13 0 "[ . 1 . 2]" 1
1562 1 93 GLU H 1 93 GLU HB2 2.675 . 3.550 2.731 2.670 2.762 . 0 0 "[ . 1 . 2]" 1
1563 1 93 GLU H 1 93 GLU HB3 2.675 . 3.550 2.736 2.679 2.767 . 0 0 "[ . 1 . 2]" 1
1564 1 93 GLU H 1 93 GLU QB 2.470 . 3.140 2.435 2.405 2.455 . 0 0 "[ . 1 . 2]" 1
1565 1 93 GLU H 1 93 GLU QG 3.970 . 6.140 4.092 4.065 4.164 . 0 0 "[ . 1 . 2]" 1
1566 1 93 GLU H 1 94 SER H 2.440 . 3.080 2.120 2.049 2.193 . 0 0 "[ . 1 . 2]" 1
1567 1 93 GLU H 1 94 SER HA 3.170 . 4.540 4.573 4.557 4.624 0.084 6 0 "[ . 1 . 2]" 1
1568 1 93 GLU HA 1 94 SER H 2.625 . 3.450 3.536 3.527 3.548 0.098 13 0 "[ . 1 . 2]" 1
1569 1 93 GLU HB2 1 94 SER H 2.720 . 3.640 3.652 3.640 3.674 0.034 12 0 "[ . 1 . 2]" 1
1570 1 93 GLU HB3 1 94 SER H 2.720 . 3.640 2.496 2.379 2.577 . 0 0 "[ . 1 . 2]" 1
1571 1 93 GLU QB 1 94 SER QB 4.200 . 6.600 3.368 3.280 3.519 . 0 0 "[ . 1 . 2]" 1
1572 1 93 GLU QG 1 94 SER H 4.015 . 6.230 3.937 3.702 4.244 . 0 0 "[ . 1 . 2]" 1
1573 1 93 GLU QG 1 94 SER QB 4.370 . 6.940 3.860 3.370 4.548 . 0 0 "[ . 1 . 2]" 1
1574 1 94 SER H 1 95 LYS H 3.155 . 4.510 4.346 4.261 4.379 . 0 0 "[ . 1 . 2]" 1
1575 1 94 SER HA 1 95 LYS H 2.300 . 2.800 2.358 2.238 2.406 . 0 0 "[ . 1 . 2]" 1
1576 1 94 SER QB 1 95 LYS H 3.025 . 4.250 2.537 2.371 2.967 . 0 0 "[ . 1 . 2]" 1
1577 1 94 SER QB 1 96 LYS QG 3.980 . 6.160 4.827 4.588 4.999 . 0 0 "[ . 1 . 2]" 1
1578 1 94 SER QB 1 96 LYS QD 3.980 . 6.160 4.060 3.094 4.940 . 0 0 "[ . 1 . 2]" 1
1579 1 94 SER QB 1 96 LYS QE 3.935 . 6.070 4.048 2.899 4.902 . 0 0 "[ . 1 . 2]" 1
1580 1 95 LYS H 1 95 LYS HB2 2.610 . 3.420 3.286 2.747 3.526 0.106 3 0 "[ . 1 . 2]" 1
1581 1 95 LYS H 1 95 LYS HB3 2.610 . 3.420 3.422 3.290 3.606 0.186 16 0 "[ . 1 . 2]" 1
1582 1 95 LYS H 1 95 LYS HG2 3.260 . 4.720 2.513 1.996 3.564 . 0 0 "[ . 1 . 2]" 1
1583 1 95 LYS H 1 95 LYS HG3 3.260 . 4.720 2.231 1.969 3.502 . 0 0 "[ . 1 . 2]" 1
1584 1 95 LYS H 1 95 LYS QG 3.105 . 4.410 1.961 1.884 2.147 . 0 0 "[ . 1 . 2]" 1
1585 1 95 LYS H 1 95 LYS QD 4.095 . 6.390 3.576 1.975 4.056 . 0 0 "[ . 1 . 2]" 1
1586 1 95 LYS H 1 96 LYS H 3.230 . 4.660 4.510 4.464 4.559 . 0 0 "[ . 1 . 2]" 1
1587 1 95 LYS HB2 1 96 LYS H 2.780 . 3.760 3.466 3.227 3.829 0.069 16 0 "[ . 1 . 2]" 1
1588 1 95 LYS HB3 1 96 LYS H 2.780 . 3.760 3.604 3.132 3.806 0.046 20 0 "[ . 1 . 2]" 1
1589 1 95 LYS QB 1 96 LYS H 2.675 . 3.550 3.091 2.998 3.184 . 0 0 "[ . 1 . 2]" 1
1590 1 95 LYS QG 1 96 LYS H 3.570 . 5.340 4.557 4.409 4.807 . 0 0 "[ . 1 . 2]" 1
1591 1 96 LYS H 1 96 LYS QB 2.745 . 3.690 2.971 2.489 3.238 . 0 0 "[ . 1 . 2]" 1
1592 1 96 LYS H 1 96 LYS QG 3.660 . 5.520 2.843 2.045 4.179 . 0 0 "[ . 1 . 2]" 1
1593 1 96 LYS H 1 96 LYS QD 4.095 . 6.390 4.000 2.706 4.823 . 0 0 "[ . 1 . 2]" 1
1594 1 96 LYS H 1 97 GLU H 3.185 . 4.570 4.435 4.421 4.456 . 0 0 "[ . 1 . 2]" 1
1595 1 96 LYS H 1 97 GLU QG 3.600 . 5.400 4.331 4.250 4.432 . 0 0 "[ . 1 . 2]" 1
1596 1 96 LYS HA 1 96 LYS HB2 2.270 . 2.740 2.614 2.499 2.769 0.029 7 0 "[ . 1 . 2]" 1
1597 1 96 LYS HA 1 96 LYS HB3 2.270 . 2.740 2.537 2.322 2.892 0.152 20 0 "[ . 1 . 2]" 1
1598 1 96 LYS HA 1 96 LYS QB 2.150 . 2.500 2.285 2.162 2.506 0.006 7 0 "[ . 1 . 2]" 1
1599 1 96 LYS HA 1 96 LYS QG 2.795 . 3.790 2.887 1.985 3.409 . 0 0 "[ . 1 . 2]" 1
1600 1 96 LYS HA 1 97 GLU H 2.240 . 2.680 2.326 2.204 2.481 . 0 0 "[ . 1 . 2]" 1
1601 1 96 LYS QB 1 97 GLU H 3.025 . 4.250 2.648 2.145 3.245 . 0 0 "[ . 1 . 2]" 1
1602 1 96 LYS QG 1 97 GLU H 3.585 . 5.370 3.395 2.514 3.906 . 0 0 "[ . 1 . 2]" 1
1603 1 96 LYS QG 1 98 ASP H 4.095 . 6.390 5.620 5.408 5.801 . 0 0 "[ . 1 . 2]" 1
1604 1 96 LYS QD 1 97 GLU H 3.705 . 5.610 4.735 4.372 5.021 . 0 0 "[ . 1 . 2]" 1
1605 1 97 GLU H 1 97 GLU HG2 3.385 . 4.970 4.502 4.437 4.545 . 0 0 "[ . 1 . 2]" 1
1606 1 97 GLU H 1 97 GLU HG3 3.385 . 4.970 3.431 3.366 3.473 . 0 0 "[ . 1 . 2]" 1
1607 1 97 GLU H 1 97 GLU QG 3.315 . 4.830 3.330 3.270 3.360 . 0 0 "[ . 1 . 2]" 1
1608 1 97 GLU H 1 98 ASP H 3.090 . 4.380 4.396 4.353 4.423 0.043 14 0 "[ . 1 . 2]" 1
1609 1 97 GLU HA 1 97 GLU HG2 2.565 . 3.330 3.396 3.298 3.470 0.140 12 0 "[ . 1 . 2]" 1
1610 1 97 GLU HA 1 97 GLU HG3 2.565 . 3.330 2.438 2.419 2.458 . 0 0 "[ . 1 . 2]" 1
1611 1 97 GLU HA 1 97 GLU QG 2.465 . 3.130 2.386 2.367 2.405 . 0 0 "[ . 1 . 2]" 1
1612 1 97 GLU HA 1 98 ASP H 2.285 . 2.770 2.257 2.202 2.304 . 0 0 "[ . 1 . 2]" 1
1613 1 97 GLU HB2 1 98 ASP H 2.780 . 3.760 3.821 3.754 3.891 0.131 15 0 "[ . 1 . 2]" 1
1614 1 97 GLU HB3 1 98 ASP H 2.780 . 3.760 2.776 2.636 2.924 . 0 0 "[ . 1 . 2]" 1
1615 1 97 GLU HG2 1 98 ASP H 3.555 . 5.310 4.645 4.439 4.833 . 0 0 "[ . 1 . 2]" 1
1616 1 97 GLU HG3 1 98 ASP H 3.555 . 5.310 4.389 4.344 4.429 . 0 0 "[ . 1 . 2]" 1
1617 1 98 ASP H 1 98 ASP HB2 2.720 . 3.640 2.847 2.804 2.874 . 0 0 "[ . 1 . 2]" 1
1618 1 98 ASP H 1 98 ASP HB3 2.720 . 3.640 3.697 3.669 3.726 0.086 6 0 "[ . 1 . 2]" 1
1619 1 98 ASP H 1 99 LEU H 3.310 . 4.820 4.376 4.369 4.386 . 0 0 "[ . 1 . 2]" 1
1620 1 98 ASP H 1 153 LEU QD 4.695 . 7.590 3.666 3.269 3.899 . 0 0 "[ . 1 . 2]" 1
1621 1 98 ASP HA 1 99 LEU H 2.225 . 2.650 2.536 2.526 2.544 . 0 0 "[ . 1 . 2]" 1
1622 1 98 ASP HB2 1 99 LEU H 2.735 . 3.670 3.737 3.707 3.755 0.085 20 0 "[ . 1 . 2]" 1
1623 1 98 ASP HB2 1 100 VAL QG 4.695 . 7.590 4.481 4.397 4.565 . 0 0 "[ . 1 . 2]" 1
1624 1 98 ASP HB2 1 133 HIS HD2 2.815 . 3.830 3.856 3.836 3.870 0.040 16 0 "[ . 1 . 2]" 1
1625 1 98 ASP HB2 1 153 LEU QD 4.415 . 7.030 2.543 1.986 2.969 . 0 0 "[ . 1 . 2]" 1
1626 1 98 ASP HB3 1 99 LEU H 2.735 . 3.670 2.282 2.239 2.318 . 0 0 "[ . 1 . 2]" 1
1627 1 98 ASP HB3 1 100 VAL QG 4.695 . 7.590 3.572 3.502 3.691 . 0 0 "[ . 1 . 2]" 1
1628 1 98 ASP HB3 1 133 HIS HD2 2.815 . 3.830 2.499 2.255 2.605 . 0 0 "[ . 1 . 2]" 1
1629 1 98 ASP HB3 1 153 LEU QD 4.415 . 7.030 2.653 1.890 3.009 . 0 0 "[ . 1 . 2]" 1
1630 1 98 ASP QB 1 99 LEU H 2.640 . 3.480 2.263 2.221 2.297 . 0 0 "[ . 1 . 2]" 1
1631 1 98 ASP QB 1 153 LEU MD1 4.610 . 7.420 2.423 1.971 3.858 . 0 0 "[ . 1 . 2]" 1
1632 1 98 ASP QB 1 153 LEU MD2 4.610 . 7.420 4.380 1.725 4.760 0.075 2 0 "[ . 1 . 2]" 1
1633 1 98 ASP QB 1 153 LEU QD 4.110 . 6.420 2.309 1.723 2.662 0.077 2 0 "[ . 1 . 2]" 1
1634 1 99 LEU H 1 99 LEU HB3 2.470 . 3.140 3.298 3.282 3.320 0.180 16 0 "[ . 1 . 2]" 1
1635 1 99 LEU H 1 99 LEU HG 2.640 . 3.480 2.431 2.327 2.505 . 0 0 "[ . 1 . 2]" 1
1636 1 99 LEU H 1 99 LEU QD 4.025 . 6.250 2.104 1.957 2.274 . 0 0 "[ . 1 . 2]" 1
1637 1 99 LEU H 1 100 VAL H 3.090 . 4.380 4.392 4.383 4.402 0.022 15 0 "[ . 1 . 2]" 1
1638 1 99 LEU H 1 131 ILE MD 3.465 . 5.130 4.153 4.078 4.290 . 0 0 "[ . 1 . 2]" 1
1639 1 99 LEU H 1 133 HIS HD2 3.400 . 5.000 3.505 2.822 3.727 . 0 0 "[ . 1 . 2]" 1
1640 1 99 LEU HA 1 99 LEU HB2 2.410 . 3.020 2.514 2.504 2.536 . 0 0 "[ . 1 . 2]" 1
1641 1 99 LEU HA 1 99 LEU HG 2.920 . 4.040 3.683 3.670 3.699 . 0 0 "[ . 1 . 2]" 1
1642 1 99 LEU HA 1 100 VAL H 2.300 . 2.800 2.174 2.169 2.185 . 0 0 "[ . 1 . 2]" 1
1643 1 99 LEU HA 1 100 VAL HB 3.155 . 4.510 4.532 4.514 4.589 0.079 2 0 "[ . 1 . 2]" 1
1644 1 99 LEU HA 1 100 VAL QG 4.570 . 7.340 3.364 3.264 3.405 . 0 0 "[ . 1 . 2]" 1
1645 1 99 LEU HB2 1 100 VAL H 2.660 . 3.520 2.815 2.804 2.831 . 0 0 "[ . 1 . 2]" 1
1646 1 99 LEU HB3 1 100 VAL H 2.735 . 3.670 3.777 3.746 3.792 0.122 11 0 "[ . 1 . 2]" 1
1647 1 99 LEU HG 1 100 VAL H 3.465 . 5.130 4.421 4.380 4.485 . 0 0 "[ . 1 . 2]" 1
1648 1 99 LEU QD 1 100 VAL H 4.135 . 6.470 4.061 4.017 4.105 . 0 0 "[ . 1 . 2]" 1
1649 1 99 LEU QD 1 101 PHE H 4.695 . 7.590 5.455 5.402 5.501 . 0 0 "[ . 1 . 2]" 1
1650 1 100 VAL H 1 100 VAL HB 2.505 . 3.210 2.745 2.722 2.771 . 0 0 "[ . 1 . 2]" 1
1651 1 100 VAL H 1 131 ILE MD 4.055 . 6.310 3.565 3.405 3.726 . 0 0 "[ . 1 . 2]" 1
1652 1 100 VAL HA 1 101 PHE H 2.380 . 2.960 2.213 2.196 2.221 . 0 0 "[ . 1 . 2]" 1
1653 1 100 VAL HA 1 131 ILE MD 3.980 . 6.160 2.001 1.919 2.129 . 0 0 "[ . 1 . 2]" 1
1654 1 100 VAL HA 1 133 HIS H 2.625 . 3.450 3.489 3.416 3.518 0.068 19 0 "[ . 1 . 2]" 1
1655 1 100 VAL HA 1 133 HIS HB2 2.440 . 3.080 1.991 1.949 2.041 . 0 0 "[ . 1 . 2]" 1
1656 1 100 VAL HA 1 133 HIS HB3 2.550 . 3.300 3.300 3.235 3.385 0.085 2 0 "[ . 1 . 2]" 1
1657 1 100 VAL HA 1 133 HIS HD2 3.650 . 5.500 3.868 3.783 4.022 . 0 0 "[ . 1 . 2]" 1
1658 1 100 VAL HA 1 135 TRP H 3.650 . 5.500 5.525 5.510 5.544 0.044 11 0 "[ . 1 . 2]" 1
1659 1 100 VAL HA 1 153 LEU QD 4.695 . 7.590 3.985 3.869 4.060 . 0 0 "[ . 1 . 2]" 1
1660 1 100 VAL HB 1 101 PHE H 2.780 . 3.760 3.786 3.773 3.803 0.043 4 0 "[ . 1 . 2]" 1
1661 1 100 VAL HB 1 149 LEU QD 4.935 . 8.070 3.874 3.676 4.089 . 0 0 "[ . 1 . 2]" 1
1662 1 100 VAL HB 1 153 LEU QD 4.695 . 7.590 3.188 3.073 3.431 . 0 0 "[ . 1 . 2]" 1
1663 1 100 VAL QG 1 101 PHE H 3.700 . 5.600 1.963 1.935 2.133 . 0 0 "[ . 1 . 2]" 1
1664 1 100 VAL QG 1 102 ILE QG 4.565 . 7.330 2.551 2.489 2.620 . 0 0 "[ . 1 . 2]" 1
1665 1 100 VAL QG 1 133 HIS HA 4.105 . 6.410 3.361 3.340 3.375 . 0 0 "[ . 1 . 2]" 1
1666 1 100 VAL QG 1 133 HIS HB2 3.920 . 6.040 1.906 1.848 2.001 . 0 0 "[ . 1 . 2]" 1
1667 1 100 VAL QG 1 133 HIS HB3 3.670 . 5.540 1.772 1.724 1.877 0.076 20 0 "[ . 1 . 2]" 1
1668 1 100 VAL QG 1 133 HIS HD2 4.290 . 6.780 2.264 2.074 2.749 . 0 0 "[ . 1 . 2]" 1
1669 1 100 VAL QG 1 134 GLU H 4.695 . 7.590 2.787 2.728 2.861 . 0 0 "[ . 1 . 2]" 1
1670 1 100 VAL QG 1 134 GLU HA 3.920 . 6.040 2.590 2.288 2.706 . 0 0 "[ . 1 . 2]" 1
1671 1 100 VAL QG 1 135 TRP H 4.350 . 6.900 2.695 2.647 2.912 . 0 0 "[ . 1 . 2]" 1
1672 1 100 VAL QG 1 135 TRP HE3 4.260 . 6.720 3.546 3.308 3.665 . 0 0 "[ . 1 . 2]" 1
1673 1 100 VAL QG 1 149 LEU QD 5.450 . 9.100 3.095 2.913 3.303 . 0 0 "[ . 1 . 2]" 1
1674 1 100 VAL QG 1 153 LEU QD 5.350 . 8.900 1.548 1.507 1.598 0.293 10 0 "[ . 1 . 2]" 1
1675 1 101 PHE H 1 101 PHE HB2 2.735 . 3.670 2.989 2.956 3.065 . 0 0 "[ . 1 . 2]" 1
1676 1 101 PHE H 1 101 PHE HB3 2.735 . 3.670 2.344 2.292 2.368 . 0 0 "[ . 1 . 2]" 1
1677 1 101 PHE H 1 101 PHE QB 2.565 . 3.330 2.264 2.232 2.281 . 0 0 "[ . 1 . 2]" 1
1678 1 101 PHE H 1 102 ILE H 3.140 . 4.480 4.267 4.250 4.298 . 0 0 "[ . 1 . 2]" 1
1679 1 101 PHE H 1 131 ILE MD 4.085 . 6.370 2.415 2.200 2.541 . 0 0 "[ . 1 . 2]" 1
1680 1 101 PHE H 1 133 HIS HB2 3.090 . 4.380 3.378 3.317 3.567 . 0 0 "[ . 1 . 2]" 1
1681 1 101 PHE H 1 134 GLU HA 2.705 . 3.610 2.768 2.443 2.843 . 0 0 "[ . 1 . 2]" 1
1682 1 101 PHE H 1 135 TRP H 2.955 . 4.110 3.890 3.857 3.945 . 0 0 "[ . 1 . 2]" 1
1683 1 101 PHE HA 1 102 ILE H 2.270 . 2.740 2.177 2.165 2.185 . 0 0 "[ . 1 . 2]" 1
1684 1 101 PHE HA 1 131 ILE MD 3.435 . 5.070 3.412 3.248 3.513 . 0 0 "[ . 1 . 2]" 1
1685 1 101 PHE HB2 1 131 ILE MG 3.205 . 4.610 3.496 3.372 3.624 . 0 0 "[ . 1 . 2]" 1
1686 1 101 PHE HB2 1 131 ILE MD 3.030 . 4.260 2.775 2.600 2.920 . 0 0 "[ . 1 . 2]" 1
1687 1 101 PHE HB2 1 134 GLU HA 3.110 . 4.420 4.446 4.399 4.476 0.056 19 0 "[ . 1 . 2]" 1
1688 1 101 PHE HB2 1 134 GLU QB 3.925 . 6.050 4.963 4.662 5.178 . 0 0 "[ . 1 . 2]" 1
1689 1 101 PHE HB3 1 131 ILE MG 3.205 . 4.610 3.658 3.521 3.718 . 0 0 "[ . 1 . 2]" 1
1690 1 101 PHE HB3 1 131 ILE MD 3.030 . 4.260 3.322 3.213 3.406 . 0 0 "[ . 1 . 2]" 1
1691 1 101 PHE HB3 1 134 GLU HA 3.110 . 4.420 2.797 2.768 2.838 . 0 0 "[ . 1 . 2]" 1
1692 1 101 PHE HB3 1 134 GLU QB 3.925 . 6.050 3.420 3.088 3.627 . 0 0 "[ . 1 . 2]" 1
1693 1 101 PHE QB 1 131 ILE MD 2.915 . 4.030 2.641 2.508 2.742 . 0 0 "[ . 1 . 2]" 1
1694 1 101 PHE QB 1 135 TRP H 3.985 . 6.170 4.086 4.053 4.140 . 0 0 "[ . 1 . 2]" 1
1695 1 101 PHE QD 1 102 ILE H 4.600 . 7.400 3.038 2.748 3.240 . 0 0 "[ . 1 . 2]" 1
1696 1 101 PHE QD 1 121 LYS QG 5.170 . 8.540 5.057 4.595 6.588 . 0 0 "[ . 1 . 2]" 1
1697 1 101 PHE QD 1 124 ILE MG 4.990 . 8.180 4.204 4.072 4.284 . 0 0 "[ . 1 . 2]" 1
1698 1 101 PHE QD 1 124 ILE MD 4.710 . 7.620 3.668 3.414 3.827 . 0 0 "[ . 1 . 2]" 1
1699 1 101 PHE QD 1 131 ILE MG 5.035 . 8.270 3.913 3.510 4.104 . 0 0 "[ . 1 . 2]" 1
1700 1 101 PHE QD 1 131 ILE MD 4.820 . 7.840 4.456 4.352 4.559 . 0 0 "[ . 1 . 2]" 1
1701 1 101 PHE QD 1 134 GLU HA 4.385 . 6.970 3.683 3.485 3.974 . 0 0 "[ . 1 . 2]" 1
1702 1 101 PHE QD 1 134 GLU QB 4.845 . 7.890 3.179 2.933 3.550 . 0 0 "[ . 1 . 2]" 1
1703 1 101 PHE QD 1 134 GLU QG 5.000 . 8.200 4.244 2.115 5.204 . 0 0 "[ . 1 . 2]" 1
1704 1 101 PHE QE 1 102 ILE H 4.725 . 7.650 4.632 4.506 4.757 . 0 0 "[ . 1 . 2]" 1
1705 1 101 PHE QE 1 104 TRP H 4.725 . 7.650 6.061 5.740 6.182 . 0 0 "[ . 1 . 2]" 1
1706 1 101 PHE QE 1 121 LYS QG 4.800 . 7.800 3.019 2.501 4.584 . 0 0 "[ . 1 . 2]" 1
1707 1 101 PHE QE 1 124 ILE MG 4.495 . 7.190 2.815 2.637 2.923 . 0 0 "[ . 1 . 2]" 1
1708 1 101 PHE QE 1 124 ILE HG12 4.725 . 7.650 3.564 3.359 3.896 . 0 0 "[ . 1 . 2]" 1
1709 1 101 PHE QE 1 124 ILE HG13 4.725 . 7.650 4.710 4.525 5.098 . 0 0 "[ . 1 . 2]" 1
1710 1 101 PHE QE 1 124 ILE MD 4.170 . 6.540 2.018 1.935 2.384 . 0 0 "[ . 1 . 2]" 1
1711 1 101 PHE QE 1 134 GLU HA 4.725 . 7.650 5.555 5.406 5.803 . 0 0 "[ . 1 . 2]" 1
1712 1 101 PHE QE 1 134 GLU QB 5.170 . 8.540 4.640 4.303 5.197 . 0 0 "[ . 1 . 2]" 1
1713 1 101 PHE QE 1 134 GLU QG 5.170 . 8.540 5.430 3.296 6.462 . 0 0 "[ . 1 . 2]" 1
1714 1 101 PHE HZ 1 121 LYS QG 3.520 . 5.240 2.921 2.614 4.621 . 0 0 "[ . 1 . 2]" 1
1715 1 101 PHE HZ 1 124 ILE MG 3.030 . 4.260 2.234 1.999 2.407 . 0 0 "[ . 1 . 2]" 1
1716 1 101 PHE HZ 1 124 ILE MD 3.295 . 4.790 3.168 2.871 3.719 . 0 0 "[ . 1 . 2]" 1
1717 1 102 ILE H 1 102 ILE HB 2.455 . 3.110 2.789 2.779 2.799 . 0 0 "[ . 1 . 2]" 1
1718 1 102 ILE H 1 102 ILE HG12 3.155 . 4.510 2.925 2.901 2.965 . 0 0 "[ . 1 . 2]" 1
1719 1 102 ILE H 1 102 ILE HG13 3.155 . 4.510 2.301 2.249 2.323 . 0 0 "[ . 1 . 2]" 1
1720 1 102 ILE H 1 102 ILE QG 3.080 . 4.360 2.221 2.185 2.239 . 0 0 "[ . 1 . 2]" 1
1721 1 102 ILE H 1 102 ILE MD 3.435 . 5.070 3.897 3.865 3.914 . 0 0 "[ . 1 . 2]" 1
1722 1 102 ILE HA 1 102 ILE QG 2.890 . 3.980 2.531 2.505 2.538 . 0 0 "[ . 1 . 2]" 1
1723 1 102 ILE HA 1 102 ILE MD 3.340 . 4.880 3.728 3.718 3.759 . 0 0 "[ . 1 . 2]" 1
1724 1 102 ILE HA 1 103 PHE H 2.485 . 3.170 2.176 2.164 2.211 . 0 0 "[ . 1 . 2]" 1
1725 1 102 ILE HA 1 103 PHE HA 3.230 . 4.660 4.390 4.384 4.396 . 0 0 "[ . 1 . 2]" 1
1726 1 102 ILE HA 1 103 PHE QB 3.505 . 5.210 3.969 3.946 3.983 . 0 0 "[ . 1 . 2]" 1
1727 1 102 ILE HA 1 135 TRP H 2.520 . 3.240 2.386 2.343 2.411 . 0 0 "[ . 1 . 2]" 1
1728 1 102 ILE HA 1 135 TRP HB2 3.110 . 4.420 3.560 3.548 3.574 . 0 0 "[ . 1 . 2]" 1
1729 1 102 ILE HA 1 135 TRP HB3 2.890 . 3.980 2.279 2.260 2.305 . 0 0 "[ . 1 . 2]" 1
1730 1 102 ILE HA 1 135 TRP HE3 3.200 . 4.600 4.678 4.673 4.687 0.087 2 0 "[ . 1 . 2]" 1
1731 1 102 ILE HA 1 137 VAL MG2 4.165 . 6.530 4.103 4.054 4.169 . 0 0 "[ . 1 . 2]" 1
1732 1 102 ILE HB 1 103 PHE H 2.720 . 3.640 3.704 3.589 3.721 0.081 4 0 "[ . 1 . 2]" 1
1733 1 102 ILE HB 1 135 TRP HB2 3.650 . 5.500 5.498 5.449 5.515 0.015 11 0 "[ . 1 . 2]" 1
1734 1 102 ILE HB 1 135 TRP HB3 2.985 . 4.170 4.068 4.034 4.081 . 0 0 "[ . 1 . 2]" 1
1735 1 102 ILE MG 1 103 PHE H 3.265 . 4.730 1.939 1.929 1.970 . 0 0 "[ . 1 . 2]" 1
1736 1 102 ILE MG 1 103 PHE HA 3.745 . 5.690 3.925 3.839 3.959 . 0 0 "[ . 1 . 2]" 1
1737 1 102 ILE MG 1 104 TRP H 3.605 . 5.410 4.042 3.810 4.085 . 0 0 "[ . 1 . 2]" 1
1738 1 102 ILE MG 1 104 TRP HA 3.560 . 5.320 3.986 3.772 4.071 . 0 0 "[ . 1 . 2]" 1
1739 1 102 ILE MG 1 104 TRP HB2 3.805 . 5.810 3.833 3.663 3.885 . 0 0 "[ . 1 . 2]" 1
1740 1 102 ILE MG 1 104 TRP HB3 4.135 . 6.470 4.953 4.767 5.003 . 0 0 "[ . 1 . 2]" 1
1741 1 102 ILE MG 1 135 TRP H 3.885 . 5.970 3.805 3.672 3.845 . 0 0 "[ . 1 . 2]" 1
1742 1 102 ILE MG 1 135 TRP HA 3.495 . 5.190 4.228 4.122 4.244 . 0 0 "[ . 1 . 2]" 1
1743 1 102 ILE MG 1 135 TRP HB2 3.700 . 5.600 3.309 3.291 3.438 . 0 0 "[ . 1 . 2]" 1
1744 1 102 ILE MG 1 135 TRP HB3 4.040 . 6.280 1.925 1.917 1.959 . 0 0 "[ . 1 . 2]" 1
1745 1 102 ILE MG 1 135 TRP HE3 3.480 . 5.160 2.746 2.625 3.027 . 0 0 "[ . 1 . 2]" 1
1746 1 102 ILE MG 1 137 VAL H 3.575 . 5.350 3.232 3.180 3.293 . 0 0 "[ . 1 . 2]" 1
1747 1 102 ILE MG 1 137 VAL MG2 3.870 . 5.940 1.982 1.908 2.065 . 0 0 "[ . 1 . 2]" 1
1748 1 102 ILE HG12 1 135 TRP H 3.400 . 5.000 3.609 3.569 3.694 . 0 0 "[ . 1 . 2]" 1
1749 1 102 ILE HG12 1 135 TRP HE3 3.075 . 4.350 2.927 2.836 2.998 . 0 0 "[ . 1 . 2]" 1
1750 1 102 ILE HG13 1 135 TRP H 3.400 . 5.000 5.004 4.982 5.017 0.017 10 0 "[ . 1 . 2]" 1
1751 1 102 ILE HG13 1 135 TRP HE3 3.075 . 4.350 4.096 4.014 4.152 . 0 0 "[ . 1 . 2]" 1
1752 1 102 ILE QG 1 135 TRP H 3.285 . 4.770 3.530 3.495 3.604 . 0 0 "[ . 1 . 2]" 1
1753 1 102 ILE QG 1 135 TRP HB2 3.445 . 5.090 3.057 2.960 3.086 . 0 0 "[ . 1 . 2]" 1
1754 1 102 ILE QG 1 135 TRP HB3 3.225 . 4.650 2.504 2.421 2.564 . 0 0 "[ . 1 . 2]" 1
1755 1 102 ILE QG 1 135 TRP HE3 2.695 . 3.590 2.867 2.781 2.932 . 0 0 "[ . 1 . 2]" 1
1756 1 102 ILE MD 1 103 PHE H 3.825 . 5.850 4.760 4.618 4.776 . 0 0 "[ . 1 . 2]" 1
1757 1 102 ILE MD 1 135 TRP HA 4.150 . 6.500 5.403 5.384 5.431 . 0 0 "[ . 1 . 2]" 1
1758 1 102 ILE MD 1 135 TRP HB2 3.125 . 4.450 3.602 3.589 3.620 . 0 0 "[ . 1 . 2]" 1
1759 1 102 ILE MD 1 135 TRP HB3 3.110 . 4.420 2.988 2.962 3.021 . 0 0 "[ . 1 . 2]" 1
1760 1 102 ILE MD 1 135 TRP HE3 2.830 . 3.860 1.837 1.830 1.847 . 0 0 "[ . 1 . 2]" 1
1761 1 102 ILE MD 1 137 VAL MG2 4.505 . 7.210 3.335 3.196 3.463 . 0 0 "[ . 1 . 2]" 1
1762 1 103 PHE H 1 103 PHE QE 4.725 . 7.650 6.258 6.236 6.269 . 0 0 "[ . 1 . 2]" 1
1763 1 103 PHE H 1 135 TRP H 2.905 . 4.010 3.800 3.724 3.872 . 0 0 "[ . 1 . 2]" 1
1764 1 103 PHE H 1 136 GLN HA 2.705 . 3.610 3.014 2.950 3.077 . 0 0 "[ . 1 . 2]" 1
1765 1 103 PHE H 1 136 GLN QG 4.095 . 6.390 4.511 4.223 4.909 . 0 0 "[ . 1 . 2]" 1
1766 1 103 PHE H 1 137 VAL H 2.750 . 3.700 3.353 3.268 3.402 . 0 0 "[ . 1 . 2]" 1
1767 1 103 PHE HA 1 104 TRP H 2.425 . 3.050 2.143 2.136 2.150 . 0 0 "[ . 1 . 2]" 1
1768 1 103 PHE QB 1 136 GLN HA 3.070 . 4.340 2.523 2.426 2.546 . 0 0 "[ . 1 . 2]" 1
1769 1 103 PHE QB 1 136 GLN QB 4.540 . 7.280 3.919 3.623 4.108 . 0 0 "[ . 1 . 2]" 1
1770 1 103 PHE QB 1 136 GLN QG 4.350 . 6.900 2.840 2.415 3.477 . 0 0 "[ . 1 . 2]" 1
1771 1 103 PHE QB 1 137 VAL H 3.705 . 5.610 3.698 3.568 3.744 . 0 0 "[ . 1 . 2]" 1
1772 1 103 PHE QD 1 104 TRP H 4.245 . 6.690 2.629 2.497 2.764 . 0 0 "[ . 1 . 2]" 1
1773 1 103 PHE QD 1 105 ALA H 4.725 . 7.650 4.730 4.599 4.831 . 0 0 "[ . 1 . 2]" 1
1774 1 103 PHE QD 1 105 ALA MB 4.975 . 8.150 3.437 3.363 3.495 . 0 0 "[ . 1 . 2]" 1
1775 1 103 PHE QD 1 117 TYR QB 5.165 . 8.530 4.492 4.347 4.594 . 0 0 "[ . 1 . 2]" 1
1776 1 103 PHE QD 1 118 ALA HA 4.725 . 7.650 6.066 5.773 6.260 . 0 0 "[ . 1 . 2]" 1
1777 1 103 PHE QD 1 118 ALA MB 5.240 . 8.680 6.044 5.768 6.216 . 0 0 "[ . 1 . 2]" 1
1778 1 103 PHE QD 1 121 LYS QG 5.170 . 8.540 4.384 3.881 5.919 . 0 0 "[ . 1 . 2]" 1
1779 1 103 PHE QD 1 136 GLN HA 4.570 . 7.340 3.688 3.551 3.795 . 0 0 "[ . 1 . 2]" 1
1780 1 103 PHE QD 1 136 GLN QG 4.935 . 8.070 2.279 1.979 3.056 . 0 0 "[ . 1 . 2]" 1
1781 1 103 PHE QD 1 137 VAL H 4.725 . 7.650 4.801 4.685 4.890 . 0 0 "[ . 1 . 2]" 1
1782 1 103 PHE QE 1 105 ALA HA 4.725 . 7.650 4.040 3.839 4.232 . 0 0 "[ . 1 . 2]" 1
1783 1 103 PHE QE 1 105 ALA MB 4.230 . 6.660 2.627 2.420 2.764 . 0 0 "[ . 1 . 2]" 1
1784 1 103 PHE QE 1 114 LYS HA 4.430 . 7.060 4.209 4.149 4.349 . 0 0 "[ . 1 . 2]" 1
1785 1 103 PHE QE 1 117 TYR HB2 4.370 . 6.940 3.714 3.551 3.852 . 0 0 "[ . 1 . 2]" 1
1786 1 103 PHE QE 1 117 TYR HB3 4.370 . 6.940 3.520 3.273 3.698 . 0 0 "[ . 1 . 2]" 1
1787 1 103 PHE QE 1 118 ALA H 4.275 . 6.750 5.241 5.080 5.357 . 0 0 "[ . 1 . 2]" 1
1788 1 103 PHE QE 1 118 ALA HA 3.825 . 5.850 4.925 4.627 5.151 . 0 0 "[ . 1 . 2]" 1
1789 1 103 PHE QE 1 118 ALA MB 4.060 . 6.320 4.604 4.281 4.751 . 0 0 "[ . 1 . 2]" 1
1790 1 103 PHE QE 1 136 GLN QG 5.170 . 8.540 3.687 3.544 4.185 . 0 0 "[ . 1 . 2]" 1
1791 1 103 PHE HZ 1 105 ALA HA 3.650 . 5.500 4.675 4.606 4.728 . 0 0 "[ . 1 . 2]" 1
1792 1 103 PHE HZ 1 105 ALA MB 3.885 . 5.970 2.497 2.373 2.606 . 0 0 "[ . 1 . 2]" 1
1793 1 104 TRP H 1 104 TRP HB2 2.595 . 3.390 2.867 2.854 2.885 . 0 0 "[ . 1 . 2]" 1
1794 1 104 TRP H 1 104 TRP HB3 2.580 . 3.360 2.342 2.324 2.352 . 0 0 "[ . 1 . 2]" 1
1795 1 104 TRP H 1 104 TRP HD1 3.230 . 4.660 4.668 4.629 4.684 0.024 4 0 "[ . 1 . 2]" 1
1796 1 104 TRP H 1 105 ALA H 3.295 . 4.790 4.325 4.311 4.335 . 0 0 "[ . 1 . 2]" 1
1797 1 104 TRP HA 1 104 TRP HE3 2.765 . 3.730 2.700 2.671 2.744 . 0 0 "[ . 1 . 2]" 1
1798 1 104 TRP HA 1 105 ALA H 2.285 . 2.770 2.179 2.174 2.187 . 0 0 "[ . 1 . 2]" 1
1799 1 104 TRP HA 1 137 VAL H 2.860 . 3.920 3.507 3.468 3.571 . 0 0 "[ . 1 . 2]" 1
1800 1 104 TRP HA 1 137 VAL HA 3.590 . 5.380 5.159 5.144 5.179 . 0 0 "[ . 1 . 2]" 1
1801 1 104 TRP HA 1 137 VAL HB 2.815 . 3.830 3.961 3.945 3.975 0.145 8 0 "[ . 1 . 2]" 1
1802 1 104 TRP HA 1 137 VAL MG2 3.050 . 4.300 2.912 2.873 2.966 . 0 0 "[ . 1 . 2]" 1
1803 1 104 TRP HB2 1 104 TRP HE3 2.985 . 4.170 2.717 2.704 2.751 . 0 0 "[ . 1 . 2]" 1
1804 1 104 TRP HB2 1 105 ALA H 3.125 . 4.450 4.376 4.361 4.392 . 0 0 "[ . 1 . 2]" 1
1805 1 104 TRP HB3 1 105 ALA H 3.245 . 4.690 4.468 4.456 4.478 . 0 0 "[ . 1 . 2]" 1
1806 1 104 TRP HE3 1 105 ALA H 2.875 . 3.950 4.072 4.044 4.092 0.142 8 0 "[ . 1 . 2]" 1
1807 1 104 TRP HE3 1 137 VAL HB 2.505 . 3.210 2.843 2.800 2.885 . 0 0 "[ . 1 . 2]" 1
1808 1 104 TRP HE3 1 137 VAL MG2 3.015 . 4.230 2.897 2.807 2.981 . 0 0 "[ . 1 . 2]" 1
1809 1 104 TRP HE3 1 143 ILE MG 3.480 . 5.160 3.207 3.132 3.290 . 0 0 "[ . 1 . 2]" 1
1810 1 104 TRP HE3 1 143 ILE MD 4.070 . 6.340 5.207 5.183 5.228 . 0 0 "[ . 1 . 2]" 1
1811 1 104 TRP HE1 1 106 PRO QB 3.710 . 5.620 3.900 3.801 3.975 . 0 0 "[ . 1 . 2]" 1
1812 1 104 TRP HE1 1 106 PRO HG2 3.310 . 4.820 4.033 3.908 4.143 . 0 0 "[ . 1 . 2]" 1
1813 1 104 TRP HE1 1 106 PRO HG3 2.985 . 4.170 2.470 2.384 2.556 . 0 0 "[ . 1 . 2]" 1
1814 1 104 TRP HE1 1 106 PRO HD2 3.310 . 4.820 3.804 3.756 3.873 . 0 0 "[ . 1 . 2]" 1
1815 1 104 TRP HE1 1 106 PRO HD3 3.310 . 4.820 2.784 2.725 2.841 . 0 0 "[ . 1 . 2]" 1
1816 1 104 TRP HE1 1 106 PRO QD 3.215 . 4.630 2.718 2.666 2.772 . 0 0 "[ . 1 . 2]" 1
1817 1 104 TRP HZ3 1 139 GLY H 3.465 . 5.130 4.071 3.991 4.174 . 0 0 "[ . 1 . 2]" 1
1818 1 104 TRP HZ3 1 139 GLY HA3 3.325 . 4.850 4.202 4.169 4.236 . 0 0 "[ . 1 . 2]" 1
1819 1 104 TRP HZ3 1 139 GLY HA2 3.325 . 4.850 3.111 3.047 3.185 . 0 0 "[ . 1 . 2]" 1
1820 1 104 TRP HZ3 1 139 GLY QA 3.250 . 4.700 3.032 2.976 3.098 . 0 0 "[ . 1 . 2]" 1
1821 1 104 TRP HZ3 1 140 LEU H 3.650 . 5.500 3.480 3.142 3.670 . 0 0 "[ . 1 . 2]" 1
1822 1 104 TRP HZ3 1 140 LEU HA 2.625 . 3.450 2.611 2.369 2.773 . 0 0 "[ . 1 . 2]" 1
1823 1 104 TRP HH2 1 139 GLY HA3 3.125 . 4.450 3.611 3.526 3.773 . 0 0 "[ . 1 . 2]" 1
1824 1 104 TRP HH2 1 139 GLY HA2 3.125 . 4.450 2.240 2.149 2.385 . 0 0 "[ . 1 . 2]" 1
1825 1 104 TRP HH2 1 139 GLY QA 3.025 . 4.250 2.219 2.131 2.361 . 0 0 "[ . 1 . 2]" 1
1826 1 104 TRP HH2 1 140 LEU H 3.245 . 4.690 2.273 1.999 2.485 . 0 0 "[ . 1 . 2]" 1
1827 1 104 TRP HH2 1 140 LEU HA 2.535 . 3.270 3.306 3.293 3.317 0.047 9 0 "[ . 1 . 2]" 1
1828 1 104 TRP HH2 1 140 LEU HG 3.000 . 4.200 2.831 2.325 4.208 0.008 14 0 "[ . 1 . 2]" 1
1829 1 105 ALA H 1 106 PRO HD2 3.170 . 4.540 4.302 4.246 4.363 . 0 0 "[ . 1 . 2]" 1
1830 1 105 ALA H 1 106 PRO HD3 3.170 . 4.540 3.574 3.540 3.612 . 0 0 "[ . 1 . 2]" 1
1831 1 105 ALA H 1 106 PRO QD 3.065 . 4.330 3.408 3.395 3.428 . 0 0 "[ . 1 . 2]" 1
1832 1 105 ALA H 1 137 VAL H 3.000 . 4.200 3.991 3.970 4.020 . 0 0 "[ . 1 . 2]" 1
1833 1 105 ALA H 1 137 VAL HB 3.230 . 4.660 4.695 4.683 4.709 0.049 16 0 "[ . 1 . 2]" 1
1834 1 105 ALA H 1 137 VAL MG2 3.545 . 5.290 4.241 4.227 4.263 . 0 0 "[ . 1 . 2]" 1
1835 1 105 ALA H 1 138 ASN HA 2.470 . 3.140 2.276 2.210 2.377 . 0 0 "[ . 1 . 2]" 1
1836 1 105 ALA HA 1 106 PRO HD2 2.535 . 3.270 2.087 2.035 2.147 . 0 0 "[ . 1 . 2]" 1
1837 1 105 ALA HA 1 106 PRO HD3 2.535 . 3.270 2.760 2.702 2.819 . 0 0 "[ . 1 . 2]" 1
1838 1 105 ALA MB 1 106 PRO QD 3.175 . 4.550 3.443 3.427 3.456 . 0 0 "[ . 1 . 2]" 1
1839 1 105 ALA MB 1 114 LYS HA 3.515 . 5.230 4.173 4.100 4.259 . 0 0 "[ . 1 . 2]" 1
1840 1 105 ALA MB 1 114 LYS HG2 3.745 . 5.690 3.268 3.091 3.371 . 0 0 "[ . 1 . 2]" 1
1841 1 105 ALA MB 1 114 LYS HG3 3.745 . 5.690 4.534 4.330 4.608 . 0 0 "[ . 1 . 2]" 1
1842 1 105 ALA MB 1 114 LYS HE2 3.650 . 5.500 4.312 4.159 4.429 . 0 0 "[ . 1 . 2]" 1
1843 1 105 ALA MB 1 114 LYS HE3 3.650 . 5.500 4.328 4.135 4.412 . 0 0 "[ . 1 . 2]" 1
1844 1 105 ALA MB 1 136 GLN QG 4.035 . 6.270 3.960 3.766 4.401 . 0 0 "[ . 1 . 2]" 1
1845 1 105 ALA MB 1 136 GLN HE21 4.070 . 6.340 3.702 2.554 4.886 . 0 0 "[ . 1 . 2]" 1
1846 1 105 ALA MB 1 136 GLN HE22 4.070 . 6.340 4.334 2.664 5.169 . 0 0 "[ . 1 . 2]" 1
1847 1 105 ALA MB 1 136 GLN QE 3.965 . 6.130 3.446 2.439 4.256 . 0 0 "[ . 1 . 2]" 1
1848 1 105 ALA MB 1 138 ASN HA 3.295 . 4.790 3.242 3.173 3.319 . 0 0 "[ . 1 . 2]" 1
1849 1 105 ALA MB 1 138 ASN HD21 4.150 . 6.500 4.460 2.436 4.988 . 0 0 "[ . 1 . 2]" 1
1850 1 105 ALA MB 1 138 ASN HD22 4.150 . 6.500 3.930 3.117 4.307 . 0 0 "[ . 1 . 2]" 1
1851 1 105 ALA MB 1 138 ASN QD 3.960 . 6.120 3.671 2.354 4.046 . 0 0 "[ . 1 . 2]" 1
1852 1 106 PRO HA 1 107 GLU H 2.225 . 2.650 2.291 2.270 2.302 . 0 0 "[ . 1 . 2]" 1
1853 1 106 PRO HA 1 108 SER H 2.795 . 3.790 3.867 3.848 3.881 0.091 5 0 "[ . 1 . 2]" 1
1854 1 106 PRO HA 1 138 ASN HA 2.410 . 3.020 3.116 3.094 3.146 0.126 11 0 "[ . 1 . 2]" 1
1855 1 106 PRO HA 1 139 GLY QA 3.180 . 4.560 3.623 3.591 3.666 . 0 0 "[ . 1 . 2]" 1
1856 1 106 PRO HB2 1 108 SER H 2.765 . 3.730 2.108 2.093 2.123 . 0 0 "[ . 1 . 2]" 1
1857 1 106 PRO HB3 1 108 SER H 2.765 . 3.730 3.804 3.786 3.820 0.090 16 0 "[ . 1 . 2]" 1
1858 1 106 PRO QB 1 108 SER H 2.680 . 3.560 2.098 2.083 2.113 . 0 0 "[ . 1 . 2]" 1
1859 1 106 PRO QB 1 109 ALA H 3.260 . 4.720 3.084 2.963 3.196 . 0 0 "[ . 1 . 2]" 1
1860 1 106 PRO HG2 1 109 ALA H 2.875 . 3.950 2.677 2.630 2.741 . 0 0 "[ . 1 . 2]" 1
1861 1 106 PRO HG3 1 109 ALA H 3.140 . 4.480 4.315 4.227 4.419 . 0 0 "[ . 1 . 2]" 1
1862 1 106 PRO QD 1 109 ALA H 4.095 . 6.390 4.226 4.127 4.302 . 0 0 "[ . 1 . 2]" 1
1863 1 107 GLU H 1 107 GLU HA 2.365 . 2.930 2.873 2.858 2.881 . 0 0 "[ . 1 . 2]" 1
1864 1 107 GLU H 1 108 SER H 2.720 . 3.640 2.526 2.484 2.596 . 0 0 "[ . 1 . 2]" 1
1865 1 107 GLU QB 1 109 ALA H 3.520 . 5.240 4.785 4.750 4.853 . 0 0 "[ . 1 . 2]" 1
1866 1 107 GLU QG 1 108 SER H 4.095 . 6.390 4.000 2.639 4.780 . 0 0 "[ . 1 . 2]" 1
1867 1 108 SER H 1 108 SER HB2 2.640 . 3.480 2.130 2.109 2.147 . 0 0 "[ . 1 . 2]" 1
1868 1 108 SER H 1 108 SER HB3 2.640 . 3.480 3.277 3.265 3.287 . 0 0 "[ . 1 . 2]" 1
1869 1 108 SER H 1 108 SER QB 2.520 . 3.240 2.104 2.084 2.120 . 0 0 "[ . 1 . 2]" 1
1870 1 108 SER H 1 109 ALA H 2.550 . 3.300 2.313 2.288 2.332 . 0 0 "[ . 1 . 2]" 1
1871 1 108 SER H 1 109 ALA MB 4.115 . 6.430 3.938 3.884 3.964 . 0 0 "[ . 1 . 2]" 1
1872 1 108 SER HA 1 109 ALA H 2.580 . 3.360 3.384 3.375 3.388 0.028 8 0 "[ . 1 . 2]" 1
1873 1 108 SER HB2 1 109 ALA H 2.640 . 3.480 3.556 3.545 3.564 0.084 2 0 "[ . 1 . 2]" 1
1874 1 108 SER HB3 1 109 ALA H 2.640 . 3.480 3.602 3.591 3.618 0.138 15 0 "[ . 1 . 2]" 1
1875 1 109 ALA HA 1 110 PRO HD2 2.410 . 3.020 2.586 2.385 2.766 . 0 0 "[ . 1 . 2]" 1
1876 1 109 ALA HA 1 110 PRO HD3 2.410 . 3.020 2.151 1.946 2.330 . 0 0 "[ . 1 . 2]" 1
1877 1 109 ALA HA 1 110 PRO QD 2.295 . 2.790 2.029 1.909 2.136 . 0 0 "[ . 1 . 2]" 1
1878 1 109 ALA MB 1 110 PRO HD2 3.140 . 4.480 2.581 2.276 2.944 . 0 0 "[ . 1 . 2]" 1
1879 1 109 ALA MB 1 110 PRO HD3 3.140 . 4.480 3.369 3.304 3.494 . 0 0 "[ . 1 . 2]" 1
1880 1 109 ALA MB 1 110 PRO QD 3.065 . 4.330 2.486 2.241 2.766 . 0 0 "[ . 1 . 2]" 1
1881 1 111 LEU HA 1 113 SER H 2.890 . 3.980 3.838 3.660 3.904 . 0 0 "[ . 1 . 2]" 1
1882 1 111 LEU HA 1 114 LYS H 2.580 . 3.360 3.199 3.139 3.261 . 0 0 "[ . 1 . 2]" 1
1883 1 111 LEU HA 1 115 MET H 2.815 . 3.830 3.874 3.856 3.888 0.058 3 0 "[ . 1 . 2]" 1
1884 1 111 LEU QB 1 112 LYS H 2.965 . 4.130 2.854 2.777 3.381 . 0 0 "[ . 1 . 2]" 1
1885 1 111 LEU QB 1 113 SER H 3.380 . 4.960 4.541 4.518 4.635 . 0 0 "[ . 1 . 2]" 1
1886 1 111 LEU QD 1 112 LYS H 4.350 . 6.900 4.016 2.398 4.241 . 0 0 "[ . 1 . 2]" 1
1887 1 111 LEU QD 1 115 MET HG2 4.025 . 6.250 3.539 2.333 4.303 . 0 0 "[ . 1 . 2]" 1
1888 1 111 LEU QD 1 115 MET HG3 4.025 . 6.250 3.099 1.919 3.956 . 0 0 "[ . 1 . 2]" 1
1889 1 111 LEU QD 1 115 MET QG 3.950 . 6.100 2.882 1.847 3.436 . 0 0 "[ . 1 . 2]" 1
1890 1 111 LEU QD 1 115 MET ME 5.205 . 8.610 4.495 3.546 5.124 . 0 0 "[ . 1 . 2]" 1
1891 1 112 LYS H 1 112 LYS QB 2.855 . 3.910 2.319 2.070 2.677 . 0 0 "[ . 1 . 2]" 1
1892 1 112 LYS H 1 112 LYS QG 3.845 . 5.890 3.078 2.029 4.046 . 0 0 "[ . 1 . 2]" 1
1893 1 112 LYS H 1 113 SER H 2.485 . 3.170 2.559 2.527 2.630 . 0 0 "[ . 1 . 2]" 1
1894 1 112 LYS H 1 113 SER QB 3.690 . 5.580 4.322 4.284 4.398 . 0 0 "[ . 1 . 2]" 1
1895 1 112 LYS H 1 114 LYS H 3.015 . 4.230 4.114 4.067 4.239 0.009 20 0 "[ . 1 . 2]" 1
1896 1 112 LYS H 1 114 LYS QD 3.320 . 4.840 4.343 4.316 4.414 . 0 0 "[ . 1 . 2]" 1
1897 1 112 LYS HA 1 113 SER H 2.565 . 3.330 3.430 3.405 3.440 0.110 3 0 "[ . 1 . 2]" 1
1898 1 112 LYS HA 1 114 LYS H 3.090 . 4.380 4.414 4.391 4.432 0.052 10 0 "[ . 1 . 2]" 1
1899 1 112 LYS HA 1 115 MET H 2.595 . 3.390 3.444 3.424 3.462 0.072 14 0 "[ . 1 . 2]" 1
1900 1 112 LYS QB 1 113 SER H 2.870 . 3.940 3.064 2.917 3.584 . 0 0 "[ . 1 . 2]" 1
1901 1 112 LYS QG 1 113 SER H 4.020 . 6.240 4.093 2.322 4.698 . 0 0 "[ . 1 . 2]" 1
1902 1 113 SER H 1 114 LYS H 2.380 . 2.960 2.293 2.256 2.356 . 0 0 "[ . 1 . 2]" 1
1903 1 113 SER H 1 114 LYS QG 3.815 . 5.830 3.738 3.680 3.811 . 0 0 "[ . 1 . 2]" 1
1904 1 113 SER H 1 114 LYS QD 3.705 . 5.610 3.849 3.723 3.939 . 0 0 "[ . 1 . 2]" 1
1905 1 113 SER H 1 115 MET H 2.780 . 3.760 3.629 3.559 3.680 . 0 0 "[ . 1 . 2]" 1
1906 1 113 SER HA 1 116 ILE H 2.750 . 3.700 3.561 3.511 3.629 . 0 0 "[ . 1 . 2]" 1
1907 1 113 SER HA 1 116 ILE HB 2.535 . 3.270 3.310 3.286 3.337 0.067 14 0 "[ . 1 . 2]" 1
1908 1 113 SER HA 1 116 ILE MG 3.015 . 4.230 2.404 2.279 2.630 . 0 0 "[ . 1 . 2]" 1
1909 1 113 SER HA 1 116 ILE MD 3.435 . 5.070 4.087 4.012 4.107 . 0 0 "[ . 1 . 2]" 1
1910 1 113 SER HA 1 117 TYR H 3.170 . 4.540 4.113 4.016 4.303 . 0 0 "[ . 1 . 2]" 1
1911 1 113 SER HA 1 117 TYR QD 4.725 . 7.650 3.956 3.748 4.131 . 0 0 "[ . 1 . 2]" 1
1912 1 113 SER HA 1 117 TYR QE 4.725 . 7.650 4.507 4.442 4.590 . 0 0 "[ . 1 . 2]" 1
1913 1 114 LYS H 1 114 LYS HA 2.270 . 2.740 2.840 2.835 2.846 0.106 20 0 "[ . 1 . 2]" 1
1914 1 114 LYS H 1 114 LYS QB 2.840 . 3.880 2.571 2.547 2.597 . 0 0 "[ . 1 . 2]" 1
1915 1 114 LYS H 1 114 LYS HG2 2.610 . 3.420 3.564 3.552 3.578 0.158 14 0 "[ . 1 . 2]" 1
1916 1 114 LYS H 1 114 LYS HG3 2.610 . 3.420 2.044 2.027 2.068 . 0 0 "[ . 1 . 2]" 1
1917 1 114 LYS H 1 114 LYS HD2 3.015 . 4.230 3.041 2.968 3.143 . 0 0 "[ . 1 . 2]" 1
1918 1 114 LYS H 1 114 LYS HD3 3.015 . 4.230 3.463 3.352 3.547 . 0 0 "[ . 1 . 2]" 1
1919 1 114 LYS H 1 115 MET H 2.470 . 3.140 2.447 2.412 2.469 . 0 0 "[ . 1 . 2]" 1
1920 1 114 LYS H 1 115 MET QB 3.445 . 5.090 4.252 4.235 4.268 . 0 0 "[ . 1 . 2]" 1
1921 1 114 LYS HA 1 114 LYS HG2 2.830 . 3.860 3.133 3.080 3.194 . 0 0 "[ . 1 . 2]" 1
1922 1 114 LYS HA 1 114 LYS HG3 2.830 . 3.860 2.793 2.773 2.817 . 0 0 "[ . 1 . 2]" 1
1923 1 114 LYS HA 1 114 LYS QG 2.685 . 3.570 2.610 2.592 2.633 . 0 0 "[ . 1 . 2]" 1
1924 1 114 LYS HA 1 115 MET H 2.640 . 3.480 3.493 3.488 3.498 0.018 19 0 "[ . 1 . 2]" 1
1925 1 114 LYS HA 1 117 TYR QD 4.725 . 7.650 3.608 3.400 3.895 . 0 0 "[ . 1 . 2]" 1
1926 1 114 LYS QB 1 115 MET H 2.870 . 3.940 2.783 2.730 2.840 . 0 0 "[ . 1 . 2]" 1
1927 1 114 LYS QG 1 115 MET H 3.815 . 5.830 3.999 3.956 4.025 . 0 0 "[ . 1 . 2]" 1
1928 1 115 MET H 1 115 MET QB 2.825 . 3.850 2.154 2.133 2.196 . 0 0 "[ . 1 . 2]" 1
1929 1 115 MET H 1 115 MET HG2 2.830 . 3.860 3.269 2.790 3.536 . 0 0 "[ . 1 . 2]" 1
1930 1 115 MET H 1 115 MET HG3 2.830 . 3.860 3.627 3.247 3.891 0.031 15 0 "[ . 1 . 2]" 1
1931 1 115 MET H 1 115 MET QG 2.740 . 3.680 3.023 2.731 3.124 . 0 0 "[ . 1 . 2]" 1
1932 1 115 MET H 1 116 ILE H 2.455 . 3.110 2.498 2.440 2.554 . 0 0 "[ . 1 . 2]" 1
1933 1 115 MET HA 1 115 MET HG2 2.660 . 3.520 2.279 2.117 2.756 . 0 0 "[ . 1 . 2]" 1
1934 1 115 MET HA 1 115 MET HG3 2.660 . 3.520 3.522 3.347 3.626 0.106 15 0 "[ . 1 . 2]" 1
1935 1 115 MET HA 1 115 MET QG 2.495 . 3.190 2.249 2.097 2.676 . 0 0 "[ . 1 . 2]" 1
1936 1 115 MET HA 1 115 MET ME 2.740 . 3.680 2.421 1.974 2.899 . 0 0 "[ . 1 . 2]" 1
1937 1 115 MET HA 1 116 ILE H 2.660 . 3.520 3.540 3.532 3.545 0.025 10 0 "[ . 1 . 2]" 1
1938 1 115 MET HA 1 118 ALA H 2.595 . 3.390 3.356 3.310 3.414 0.024 3 0 "[ . 1 . 2]" 1
1939 1 115 MET HA 1 119 SER H 3.000 . 4.200 4.239 4.201 4.256 0.056 19 0 "[ . 1 . 2]" 1
1940 1 115 MET QB 1 116 ILE H 2.980 . 4.160 2.687 2.631 2.723 . 0 0 "[ . 1 . 2]" 1
1941 1 115 MET QB 1 116 ILE HA 3.630 . 5.460 3.817 3.806 3.837 . 0 0 "[ . 1 . 2]" 1
1942 1 115 MET HG2 1 116 ILE H 3.570 . 5.340 4.815 4.650 4.897 . 0 0 "[ . 1 . 2]" 1
1943 1 115 MET HG3 1 116 ILE H 3.570 . 5.340 4.993 4.886 5.053 . 0 0 "[ . 1 . 2]" 1
1944 1 116 ILE H 1 116 ILE HA 2.365 . 2.930 2.797 2.789 2.804 . 0 0 "[ . 1 . 2]" 1
1945 1 116 ILE H 1 116 ILE QG 3.445 . 5.090 3.855 3.824 3.884 . 0 0 "[ . 1 . 2]" 1
1946 1 116 ILE H 1 117 TYR H 2.470 . 3.140 2.748 2.709 2.776 . 0 0 "[ . 1 . 2]" 1
1947 1 116 ILE H 1 118 ALA H 2.935 . 4.070 3.938 3.895 3.976 . 0 0 "[ . 1 . 2]" 1
1948 1 116 ILE HA 1 116 ILE HB 2.225 . 2.650 2.624 2.597 2.644 . 0 0 "[ . 1 . 2]" 1
1949 1 116 ILE HA 1 116 ILE HG12 2.425 . 3.050 2.984 2.926 3.059 0.009 19 0 "[ . 1 . 2]" 1
1950 1 116 ILE HA 1 116 ILE HG13 2.425 . 3.050 2.146 2.100 2.185 . 0 0 "[ . 1 . 2]" 1
1951 1 116 ILE HA 1 116 ILE MD 3.030 . 4.260 3.594 3.541 3.634 . 0 0 "[ . 1 . 2]" 1
1952 1 116 ILE HA 1 117 TYR H 2.660 . 3.520 3.526 3.521 3.537 0.017 3 0 "[ . 1 . 2]" 1
1953 1 116 ILE HB 1 117 TYR H 2.580 . 3.360 3.507 3.484 3.542 0.182 14 0 "[ . 1 . 2]" 1
1954 1 116 ILE MG 1 117 TYR H 3.340 . 4.880 1.906 1.888 1.937 . 0 0 "[ . 1 . 2]" 1
1955 1 116 ILE MG 1 117 TYR QD 4.820 . 7.840 2.838 2.523 2.963 . 0 0 "[ . 1 . 2]" 1
1956 1 116 ILE MG 1 117 TYR QE 5.160 . 8.520 3.478 3.306 3.551 . 0 0 "[ . 1 . 2]" 1
1957 1 116 ILE MG 1 118 ALA H 3.760 . 5.720 4.056 4.015 4.094 . 0 0 "[ . 1 . 2]" 1
1958 1 116 ILE QG 1 117 TYR H 3.400 . 5.000 4.006 3.951 4.081 . 0 0 "[ . 1 . 2]" 1
1959 1 117 TYR H 1 117 TYR HB2 2.675 . 3.550 2.258 2.244 2.273 . 0 0 "[ . 1 . 2]" 1
1960 1 117 TYR H 1 117 TYR HB3 2.675 . 3.550 3.538 3.530 3.546 . 0 0 "[ . 1 . 2]" 1
1961 1 117 TYR H 1 117 TYR QB 2.545 . 3.290 2.234 2.221 2.247 . 0 0 "[ . 1 . 2]" 1
1962 1 117 TYR H 1 117 TYR QE 4.725 . 7.650 4.864 4.786 4.917 . 0 0 "[ . 1 . 2]" 1
1963 1 117 TYR HA 1 117 TYR HB2 2.380 . 2.960 2.998 2.993 3.002 0.042 2 0 "[ . 1 . 2]" 1
1964 1 117 TYR HA 1 117 TYR HB3 2.380 . 2.960 2.600 2.586 2.607 . 0 0 "[ . 1 . 2]" 1
1965 1 117 TYR HA 1 120 SER H 2.455 . 3.110 3.065 2.932 3.128 0.018 8 0 "[ . 1 . 2]" 1
1966 1 117 TYR HA 1 121 LYS H 2.890 . 3.980 4.098 4.040 4.145 0.165 3 0 "[ . 1 . 2]" 1
1967 1 117 TYR HB2 1 118 ALA H 2.625 . 3.450 2.810 2.768 2.860 . 0 0 "[ . 1 . 2]" 1
1968 1 117 TYR HB3 1 118 ALA H 2.625 . 3.450 3.512 3.501 3.527 0.077 10 0 "[ . 1 . 2]" 1
1969 1 117 TYR QB 1 118 ALA H 2.515 . 3.230 2.703 2.670 2.743 . 0 0 "[ . 1 . 2]" 1
1970 1 118 ALA H 1 118 ALA HA 2.270 . 2.740 2.778 2.750 2.796 0.056 16 0 "[ . 1 . 2]" 1
1971 1 118 ALA H 1 119 SER H 2.425 . 3.050 2.708 2.619 2.897 . 0 0 "[ . 1 . 2]" 1
1972 1 118 ALA H 1 120 SER H 2.935 . 4.070 4.065 3.976 4.107 0.037 13 0 "[ . 1 . 2]" 1
1973 1 118 ALA HA 1 121 LYS H 2.580 . 3.360 3.295 3.221 3.384 0.024 8 0 "[ . 1 . 2]" 1
1974 1 118 ALA MB 1 119 SER H 2.895 . 3.990 2.743 2.568 2.836 . 0 0 "[ . 1 . 2]" 1
1975 1 119 SER H 1 120 SER H 2.395 . 2.990 2.455 2.403 2.522 . 0 0 "[ . 1 . 2]" 1
1976 1 119 SER H 1 121 LYS H 2.890 . 3.980 3.741 3.676 3.913 . 0 0 "[ . 1 . 2]" 1
1977 1 119 SER HA 1 120 SER H 2.610 . 3.420 3.470 3.456 3.482 0.062 5 0 "[ . 1 . 2]" 1
1978 1 119 SER HA 1 121 LYS H 2.875 . 3.950 4.074 4.056 4.110 0.160 4 0 "[ . 1 . 2]" 1
1979 1 120 SER H 1 121 LYS H 2.300 . 2.800 2.301 2.263 2.401 . 0 0 "[ . 1 . 2]" 1
1980 1 120 SER H 1 122 ASP H 3.370 . 4.940 4.635 4.536 4.723 . 0 0 "[ . 1 . 2]" 1
1981 1 120 SER HA 1 121 LYS H 2.595 . 3.390 3.410 3.396 3.445 0.055 19 0 "[ . 1 . 2]" 1
1982 1 120 SER HA 1 123 ALA H 2.660 . 3.520 3.086 2.952 3.257 . 0 0 "[ . 1 . 2]" 1
1983 1 120 SER HA 1 123 ALA MB 3.030 . 4.260 2.476 2.302 2.627 . 0 0 "[ . 1 . 2]" 1
1984 1 120 SER HA 1 124 ILE H 3.000 . 4.200 3.878 3.831 3.963 . 0 0 "[ . 1 . 2]" 1
1985 1 120 SER HB2 1 121 LYS H 2.875 . 3.950 3.844 3.726 4.096 0.146 10 0 "[ . 1 . 2]" 1
1986 1 120 SER HB3 1 121 LYS H 2.875 . 3.950 3.539 3.382 3.745 . 0 0 "[ . 1 . 2]" 1
1987 1 120 SER QB 1 121 LYS H 2.785 . 3.770 3.269 3.165 3.468 . 0 0 "[ . 1 . 2]" 1
1988 1 121 LYS H 1 121 LYS QB 2.795 . 3.790 2.172 2.070 2.251 . 0 0 "[ . 1 . 2]" 1
1989 1 121 LYS H 1 121 LYS QG 3.520 . 5.240 3.794 2.855 3.987 . 0 0 "[ . 1 . 2]" 1
1990 1 121 LYS H 1 121 LYS QD 3.925 . 6.050 4.455 3.728 4.702 . 0 0 "[ . 1 . 2]" 1
1991 1 121 LYS H 1 121 LYS QE 4.095 . 6.390 5.198 4.515 5.706 . 0 0 "[ . 1 . 2]" 1
1992 1 121 LYS H 1 122 ASP H 2.485 . 3.170 2.992 2.914 3.072 . 0 0 "[ . 1 . 2]" 1
1993 1 121 LYS H 1 124 ILE MG 3.930 . 6.060 3.821 3.765 3.884 . 0 0 "[ . 1 . 2]" 1
1994 1 121 LYS HA 1 122 ASP HA 3.230 . 4.660 4.694 4.674 4.711 0.051 7 0 "[ . 1 . 2]" 1
1995 1 121 LYS HA 1 124 ILE H 2.765 . 3.730 3.793 3.781 3.806 0.076 2 0 "[ . 1 . 2]" 1
1996 1 121 LYS HA 1 124 ILE HB 2.845 . 3.890 3.936 3.894 3.958 0.068 9 0 "[ . 1 . 2]" 1
1997 1 121 LYS HA 1 124 ILE MG 2.800 . 3.800 1.906 1.888 1.929 . 0 0 "[ . 1 . 2]" 1
1998 1 121 LYS QB 1 122 ASP H 2.995 . 4.190 2.664 2.509 3.458 . 0 0 "[ . 1 . 2]" 1
1999 1 121 LYS QB 1 124 ILE MG 4.610 . 7.420 3.690 3.403 3.769 . 0 0 "[ . 1 . 2]" 1
2000 1 121 LYS QG 1 124 ILE MG 3.710 . 5.620 3.173 3.014 4.122 . 0 0 "[ . 1 . 2]" 1
2001 1 122 ASP H 1 122 ASP HA 2.380 . 2.960 2.867 2.849 2.888 . 0 0 "[ . 1 . 2]" 1
2002 1 122 ASP H 1 122 ASP HB2 2.350 . 2.900 2.133 2.092 2.167 . 0 0 "[ . 1 . 2]" 1
2003 1 122 ASP H 1 122 ASP HB3 2.350 . 2.900 3.014 3.008 3.032 0.132 7 0 "[ . 1 . 2]" 1
2004 1 122 ASP H 1 123 ALA H 2.365 . 2.930 2.472 2.386 2.533 . 0 0 "[ . 1 . 2]" 1
2005 1 122 ASP H 1 124 ILE H 3.125 . 4.450 4.043 3.934 4.267 . 0 0 "[ . 1 . 2]" 1
2006 1 122 ASP HA 1 122 ASP HB2 2.365 . 2.930 2.753 2.746 2.760 . 0 0 "[ . 1 . 2]" 1
2007 1 122 ASP HA 1 122 ASP HB3 2.365 . 2.930 2.935 2.931 2.939 0.009 20 0 "[ . 1 . 2]" 1
2008 1 122 ASP HA 1 125 LYS H 2.660 . 3.520 3.294 3.237 3.394 . 0 0 "[ . 1 . 2]" 1
2009 1 122 ASP HA 1 125 LYS HB2 2.395 . 2.990 3.045 3.026 3.076 0.086 8 0 "[ . 1 . 2]" 1
2010 1 122 ASP HA 1 125 LYS HB3 2.395 . 2.990 2.886 2.638 3.010 0.020 10 0 "[ . 1 . 2]" 1
2011 1 122 ASP HA 1 126 LYS H 2.720 . 3.640 3.802 3.783 3.826 0.186 16 0 "[ . 1 . 2]" 1
2012 1 122 ASP HB2 1 123 ALA H 2.505 . 3.210 3.328 3.318 3.343 0.133 7 0 "[ . 1 . 2]" 1
2013 1 122 ASP HB3 1 123 ALA H 2.505 . 3.210 2.695 2.651 2.774 . 0 0 "[ . 1 . 2]" 1
2014 1 122 ASP QB 1 123 ALA H 2.410 . 3.020 2.585 2.552 2.646 . 0 0 "[ . 1 . 2]" 1
2015 1 122 ASP QB 1 123 ALA HA 3.395 . 4.990 3.766 3.756 3.783 . 0 0 "[ . 1 . 2]" 1
2016 1 122 ASP QB 1 126 LYS H 3.645 . 5.490 4.735 4.712 4.750 . 0 0 "[ . 1 . 2]" 1
2017 1 123 ALA H 1 123 ALA HA 2.285 . 2.770 2.806 2.802 2.812 0.042 7 0 "[ . 1 . 2]" 1
2018 1 123 ALA H 1 124 ILE H 2.270 . 2.740 2.696 2.660 2.751 0.011 7 0 "[ . 1 . 2]" 1
2019 1 123 ALA H 1 124 ILE MG 3.420 . 5.040 3.932 3.899 4.073 . 0 0 "[ . 1 . 2]" 1
2020 1 123 ALA HA 1 125 LYS H 3.000 . 4.200 4.222 4.186 4.240 0.040 13 0 "[ . 1 . 2]" 1
2021 1 123 ALA HA 1 126 LYS QB 2.995 . 4.190 2.471 2.301 2.578 . 0 0 "[ . 1 . 2]" 1
2022 1 123 ALA HA 1 126 LYS QE 4.095 . 6.390 4.803 2.918 5.703 . 0 0 "[ . 1 . 2]" 1
2023 1 123 ALA MB 1 124 ILE H 2.875 . 3.950 2.467 2.291 2.607 . 0 0 "[ . 1 . 2]" 1
2024 1 123 ALA MB 1 124 ILE HA 3.900 . 6.000 3.779 3.694 3.828 . 0 0 "[ . 1 . 2]" 1
2025 1 123 ALA MB 1 124 ILE MG 4.680 . 7.560 4.019 3.947 4.113 . 0 0 "[ . 1 . 2]" 1
2026 1 124 ILE H 1 124 ILE HB 2.365 . 2.930 2.430 2.382 2.462 . 0 0 "[ . 1 . 2]" 1
2027 1 124 ILE H 1 124 ILE MG 2.860 . 3.920 2.221 2.185 2.375 . 0 0 "[ . 1 . 2]" 1
2028 1 124 ILE H 1 124 ILE QG 4.020 . 6.240 3.941 3.925 3.952 . 0 0 "[ . 1 . 2]" 1
2029 1 124 ILE H 1 124 ILE MD 3.685 . 5.570 4.366 4.338 4.411 . 0 0 "[ . 1 . 2]" 1
2030 1 124 ILE H 1 125 LYS H 2.380 . 2.960 2.595 2.538 2.717 . 0 0 "[ . 1 . 2]" 1
2031 1 124 ILE HA 1 124 ILE HB 2.255 . 2.710 2.513 2.505 2.523 . 0 0 "[ . 1 . 2]" 1
2032 1 124 ILE HA 1 124 ILE HG12 2.905 . 4.010 2.851 2.777 2.918 . 0 0 "[ . 1 . 2]" 1
2033 1 124 ILE HA 1 124 ILE HG13 2.905 . 4.010 2.463 2.432 2.499 . 0 0 "[ . 1 . 2]" 1
2034 1 124 ILE HA 1 124 ILE QG 2.800 . 3.800 2.324 2.313 2.332 . 0 0 "[ . 1 . 2]" 1
2035 1 124 ILE HA 1 126 LYS H 3.060 . 4.320 4.319 4.289 4.336 0.016 2 0 "[ . 1 . 2]" 1
2036 1 124 ILE HA 1 127 LYS H 2.795 . 3.790 3.702 3.590 3.800 0.010 16 0 "[ . 1 . 2]" 1
2037 1 124 ILE HA 1 128 PHE H 3.480 . 5.160 5.068 4.890 5.170 0.010 16 0 "[ . 1 . 2]" 1
2038 1 124 ILE HA 1 128 PHE HZ 3.650 . 5.500 5.290 5.009 5.509 0.009 13 0 "[ . 1 . 2]" 1
2039 1 124 ILE HB 1 128 PHE QE 4.725 . 7.650 4.920 4.829 5.124 . 0 0 "[ . 1 . 2]" 1
2040 1 124 ILE MG 1 125 LYS H 3.110 . 4.420 2.268 1.970 2.313 . 0 0 "[ . 1 . 2]" 1
2041 1 124 ILE MG 1 125 LYS HA 3.405 . 5.010 3.271 3.230 3.439 . 0 0 "[ . 1 . 2]" 1
2042 1 124 ILE MG 1 125 LYS QB 4.485 . 7.170 2.889 2.835 2.920 . 0 0 "[ . 1 . 2]" 1
2043 1 124 ILE MG 1 126 LYS H 3.685 . 5.570 4.200 4.105 4.229 . 0 0 "[ . 1 . 2]" 1
2044 1 124 ILE MG 1 128 PHE QE 4.450 . 7.100 3.188 2.913 3.457 . 0 0 "[ . 1 . 2]" 1
2045 1 124 ILE HG12 1 128 PHE QE 4.725 . 7.650 2.254 2.189 2.527 . 0 0 "[ . 1 . 2]" 1
2046 1 124 ILE HG12 1 128 PHE HZ 3.570 . 5.340 2.955 2.672 3.163 . 0 0 "[ . 1 . 2]" 1
2047 1 124 ILE HG13 1 128 PHE QE 4.725 . 7.650 3.750 3.704 3.884 . 0 0 "[ . 1 . 2]" 1
2048 1 124 ILE HG13 1 128 PHE HZ 3.570 . 5.340 3.700 3.446 3.923 . 0 0 "[ . 1 . 2]" 1
2049 1 124 ILE QG 1 128 PHE HZ 3.435 . 5.070 2.842 2.586 3.037 . 0 0 "[ . 1 . 2]" 1
2050 1 124 ILE MD 1 128 PHE QE 4.605 . 7.410 2.458 2.153 2.785 . 0 0 "[ . 1 . 2]" 1
2051 1 124 ILE MD 1 128 PHE HZ 2.830 . 3.860 3.050 2.903 3.101 . 0 0 "[ . 1 . 2]" 1
2052 1 125 LYS H 1 125 LYS QG 3.380 . 4.960 3.920 3.873 4.079 . 0 0 "[ . 1 . 2]" 1
2053 1 125 LYS HA 1 126 LYS H 2.595 . 3.390 3.474 3.469 3.480 0.090 1 0 "[ . 1 . 2]" 1
2054 1 125 LYS HA 1 127 LYS H 3.000 . 4.200 4.205 4.143 4.239 0.039 6 0 "[ . 1 . 2]" 1
2055 1 125 LYS HA 1 128 PHE H 2.535 . 3.270 3.166 3.125 3.201 . 0 0 "[ . 1 . 2]" 1
2056 1 125 LYS HA 1 128 PHE HB2 2.705 . 3.610 2.179 2.118 2.229 . 0 0 "[ . 1 . 2]" 1
2057 1 125 LYS HA 1 128 PHE HB3 2.705 . 3.610 3.750 3.725 3.772 0.162 9 0 "[ . 1 . 2]" 1
2058 1 125 LYS HA 1 128 PHE QB 2.550 . 3.300 2.166 2.107 2.214 . 0 0 "[ . 1 . 2]" 1
2059 1 125 LYS HA 1 128 PHE QD 4.570 . 7.340 2.078 1.966 2.519 . 0 0 "[ . 1 . 2]" 1
2060 1 125 LYS HA 1 128 PHE QE 4.725 . 7.650 3.967 3.738 4.413 . 0 0 "[ . 1 . 2]" 1
2061 1 125 LYS QG 1 126 LYS H 3.940 . 6.080 4.366 4.156 4.551 . 0 0 "[ . 1 . 2]" 1
2062 1 126 LYS H 1 126 LYS HA 2.270 . 2.740 2.795 2.784 2.809 0.069 1 0 "[ . 1 . 2]" 1
2063 1 126 LYS H 1 127 LYS H 2.395 . 2.990 2.666 2.581 2.725 . 0 0 "[ . 1 . 2]" 1
2064 1 126 LYS H 1 127 LYS QG 4.095 . 6.390 5.042 4.033 5.777 . 0 0 "[ . 1 . 2]" 1
2065 1 126 LYS H 1 128 PHE H 2.705 . 3.610 3.748 3.715 3.771 0.161 19 0 "[ . 1 . 2]" 1
2066 1 126 LYS QE 1 127 LYS HA 3.925 . 6.050 4.768 3.543 5.459 . 0 0 "[ . 1 . 2]" 1
2067 1 127 LYS H 1 127 LYS QG 3.845 . 5.890 2.908 1.969 3.641 . 0 0 "[ . 1 . 2]" 1
2068 1 127 LYS H 1 128 PHE H 2.240 . 2.680 2.528 2.500 2.545 . 0 0 "[ . 1 . 2]" 1
2069 1 127 LYS HA 1 128 PHE H 2.565 . 3.330 3.360 3.340 3.387 0.057 12 0 "[ . 1 . 2]" 1
2070 1 127 LYS QB 1 128 PHE H 2.935 . 4.070 3.232 3.145 3.305 . 0 0 "[ . 1 . 2]" 1
2071 1 128 PHE HA 1 129 THR H 2.395 . 2.990 2.773 2.731 2.799 . 0 0 "[ . 1 . 2]" 1
2072 1 128 PHE HA 1 131 ILE HB 2.860 . 3.920 3.979 3.929 4.008 0.088 20 0 "[ . 1 . 2]" 1
2073 1 128 PHE HA 1 131 ILE MG 3.325 . 4.850 3.957 3.933 3.999 . 0 0 "[ . 1 . 2]" 1
2074 1 128 PHE HB2 1 129 THR H 3.090 . 4.380 4.249 4.224 4.277 . 0 0 "[ . 1 . 2]" 1
2075 1 128 PHE HB2 1 131 ILE HB 2.750 . 3.700 3.734 3.710 3.763 0.063 6 0 "[ . 1 . 2]" 1
2076 1 128 PHE HB3 1 129 THR H 3.090 . 4.380 4.405 4.389 4.421 0.041 7 0 "[ . 1 . 2]" 1
2077 1 128 PHE HB3 1 131 ILE HB 2.750 . 3.700 2.148 2.086 2.195 . 0 0 "[ . 1 . 2]" 1
2078 1 128 PHE QB 1 129 THR H 2.990 . 4.180 3.851 3.841 3.865 . 0 0 "[ . 1 . 2]" 1
2079 1 128 PHE QB 1 131 ILE HB 2.635 . 3.470 2.136 2.076 2.180 . 0 0 "[ . 1 . 2]" 1
2080 1 128 PHE QB 1 131 ILE MG 3.630 . 5.460 1.841 1.827 1.863 . 0 0 "[ . 1 . 2]" 1
2081 1 128 PHE QD 1 129 THR H 4.725 . 7.650 4.464 4.341 4.548 . 0 0 "[ . 1 . 2]" 1
2082 1 128 PHE QD 1 131 ILE HB 4.725 . 7.650 4.139 3.984 4.229 . 0 0 "[ . 1 . 2]" 1
2083 1 128 PHE QD 1 131 ILE MG 5.175 . 8.550 3.309 3.147 3.397 . 0 0 "[ . 1 . 2]" 1
2084 1 128 PHE QD 1 131 ILE MD 4.755 . 7.710 4.504 4.366 4.655 . 0 0 "[ . 1 . 2]" 1
2085 1 129 THR H 1 129 THR HB 2.550 . 3.300 2.630 2.529 2.690 . 0 0 "[ . 1 . 2]" 1
2086 1 129 THR HA 1 129 THR MG 2.630 . 3.460 2.385 2.246 2.469 . 0 0 "[ . 1 . 2]" 1
2087 1 129 THR MG 1 130 GLY HA3 3.465 . 5.130 3.872 3.721 4.033 . 0 0 "[ . 1 . 2]" 1
2088 1 129 THR MG 1 130 GLY HA2 3.465 . 5.130 3.789 3.676 3.932 . 0 0 "[ . 1 . 2]" 1
2089 1 129 THR MG 1 130 GLY QA 3.350 . 4.900 3.410 3.295 3.546 . 0 0 "[ . 1 . 2]" 1
2090 1 131 ILE H 1 131 ILE HA 2.380 . 2.960 2.839 2.837 2.843 . 0 0 "[ . 1 . 2]" 1
2091 1 131 ILE H 1 131 ILE MG 2.910 . 4.020 1.960 1.947 1.971 . 0 0 "[ . 1 . 2]" 1
2092 1 131 ILE HA 1 131 ILE HB 2.210 . 2.620 2.460 2.453 2.465 . 0 0 "[ . 1 . 2]" 1
2093 1 131 ILE HB 1 132 LYS H 3.125 . 4.450 4.442 4.399 4.459 0.009 12 0 "[ . 1 . 2]" 1
2094 1 131 ILE HB 1 133 HIS H 3.200 . 4.600 4.648 4.627 4.669 0.069 11 0 "[ . 1 . 2]" 1
2095 1 131 ILE MG 1 132 LYS H 3.685 . 5.570 4.157 4.135 4.165 . 0 0 "[ . 1 . 2]" 1
2096 1 131 ILE HG12 1 133 HIS H 3.075 . 4.350 3.713 3.657 3.782 . 0 0 "[ . 1 . 2]" 1
2097 1 131 ILE HG13 1 133 HIS H 3.075 . 4.350 2.026 1.991 2.133 . 0 0 "[ . 1 . 2]" 1
2098 1 131 ILE QG 1 133 HIS H 2.750 . 3.700 2.017 1.983 2.121 . 0 0 "[ . 1 . 2]" 1
2099 1 131 ILE MD 1 134 GLU HA 4.165 . 6.530 4.576 4.413 4.646 . 0 0 "[ . 1 . 2]" 1
2100 1 132 LYS H 1 132 LYS HG2 3.650 . 5.500 4.501 4.430 4.527 . 0 0 "[ . 1 . 2]" 1
2101 1 132 LYS H 1 132 LYS HG3 3.650 . 5.500 4.487 4.465 4.522 . 0 0 "[ . 1 . 2]" 1
2102 1 132 LYS H 1 132 LYS QG 3.440 . 5.080 4.004 3.986 4.015 . 0 0 "[ . 1 . 2]" 1
2103 1 132 LYS H 1 132 LYS QD 4.095 . 6.390 4.465 4.418 4.598 . 0 0 "[ . 1 . 2]" 1
2104 1 132 LYS H 1 133 HIS H 2.720 . 3.640 2.556 2.505 2.616 . 0 0 "[ . 1 . 2]" 1
2105 1 132 LYS HG2 1 133 HIS H 3.555 . 5.310 4.665 4.554 4.771 . 0 0 "[ . 1 . 2]" 1
2106 1 132 LYS HG3 1 133 HIS H 3.555 . 5.310 5.171 4.987 5.249 . 0 0 "[ . 1 . 2]" 1
2107 1 132 LYS QG 1 133 HIS H 3.325 . 4.850 4.341 4.232 4.389 . 0 0 "[ . 1 . 2]" 1
2108 1 132 LYS QD 1 133 HIS HD2 4.095 . 6.390 5.597 5.478 5.710 . 0 0 "[ . 1 . 2]" 1
2109 1 132 LYS QD 1 133 HIS HE1 4.095 . 6.390 4.272 3.770 5.358 . 0 0 "[ . 1 . 2]" 1
2110 1 133 HIS H 1 133 HIS HB2 2.690 . 3.580 2.670 2.619 2.811 . 0 0 "[ . 1 . 2]" 1
2111 1 133 HIS H 1 133 HIS HB3 2.795 . 3.790 3.794 3.768 3.845 0.055 2 0 "[ . 1 . 2]" 1
2112 1 133 HIS H 1 133 HIS HD2 3.200 . 4.600 4.184 3.713 4.393 . 0 0 "[ . 1 . 2]" 1
2113 1 133 HIS H 1 134 GLU H 3.125 . 4.450 4.439 4.372 4.456 0.006 16 0 "[ . 1 . 2]" 1
2114 1 133 HIS H 1 134 GLU QB 3.830 . 5.860 4.863 4.750 4.984 . 0 0 "[ . 1 . 2]" 1
2115 1 133 HIS HA 1 133 HIS HD2 3.355 . 4.910 4.696 4.554 4.762 . 0 0 "[ . 1 . 2]" 1
2116 1 133 HIS HA 1 134 GLU H 2.315 . 2.830 2.254 2.162 2.292 . 0 0 "[ . 1 . 2]" 1
2117 1 133 HIS HA 1 153 LEU QD 4.765 . 7.730 4.629 4.533 4.861 . 0 0 "[ . 1 . 2]" 1
2118 1 133 HIS HB2 1 134 GLU H 2.795 . 3.790 3.834 3.813 3.876 0.086 2 0 "[ . 1 . 2]" 1
2119 1 133 HIS HB2 1 153 LEU MD1 3.375 . 4.950 3.697 3.512 4.122 . 0 0 "[ . 1 . 2]" 1
2120 1 133 HIS HB2 1 153 LEU MD2 3.375 . 4.950 3.920 3.318 3.991 . 0 0 "[ . 1 . 2]" 1
2121 1 133 HIS HB2 1 153 LEU QD 3.180 . 4.560 3.371 3.187 3.467 . 0 0 "[ . 1 . 2]" 1
2122 1 133 HIS HB3 1 134 GLU H 2.690 . 3.580 2.678 2.628 2.955 . 0 0 "[ . 1 . 2]" 1
2123 1 133 HIS HB3 1 153 LEU QD 4.935 . 8.070 3.032 2.966 3.310 . 0 0 "[ . 1 . 2]" 1
2124 1 133 HIS HD2 1 153 LEU QD 4.085 . 6.370 2.308 2.076 2.543 . 0 0 "[ . 1 . 2]" 1
2125 1 133 HIS HE1 1 153 LEU HA 2.985 . 4.170 3.130 2.625 3.602 . 0 0 "[ . 1 . 2]" 1
2126 1 133 HIS HE1 1 153 LEU QD 4.515 . 7.230 3.930 3.656 4.216 . 0 0 "[ . 1 . 2]" 1
2127 1 134 GLU H 1 134 GLU QG 4.050 . 6.300 2.906 2.147 4.356 . 0 0 "[ . 1 . 2]" 1
2128 1 134 GLU HA 1 135 TRP H 2.335 . 2.870 2.168 2.155 2.229 . 0 0 "[ . 1 . 2]" 1
2129 1 134 GLU QB 1 135 TRP H 3.150 . 4.500 3.439 2.931 3.839 . 0 0 "[ . 1 . 2]" 1
2130 1 134 GLU QG 1 135 TRP H 3.755 . 5.710 3.867 2.903 4.540 . 0 0 "[ . 1 . 2]" 1
2131 1 135 TRP H 1 135 TRP HB2 2.550 . 3.300 2.783 2.742 2.932 . 0 0 "[ . 1 . 2]" 1
2132 1 135 TRP H 1 135 TRP HB3 2.625 . 3.450 2.725 2.696 2.826 . 0 0 "[ . 1 . 2]" 1
2133 1 135 TRP HA 1 135 TRP HB2 2.160 . 2.520 2.519 2.510 2.526 0.006 15 0 "[ . 1 . 2]" 1
2134 1 135 TRP HA 1 135 TRP HB3 2.335 . 2.870 2.979 2.976 2.981 0.111 13 0 "[ . 1 . 2]" 1
2135 1 135 TRP HA 1 135 TRP HD1 2.145 . 2.490 2.263 2.224 2.291 . 0 0 "[ . 1 . 2]" 1
2136 1 135 TRP HA 1 136 GLN H 2.425 . 3.050 2.121 2.115 2.126 . 0 0 "[ . 1 . 2]" 1
2137 1 135 TRP HA 1 152 LYS HE2 3.075 . 4.350 3.126 2.014 4.361 0.011 12 0 "[ . 1 . 2]" 1
2138 1 135 TRP HA 1 152 LYS HE3 3.075 . 4.350 2.879 2.543 3.604 . 0 0 "[ . 1 . 2]" 1
2139 1 135 TRP HA 1 152 LYS QE 2.970 . 4.140 2.587 2.004 2.859 . 0 0 "[ . 1 . 2]" 1
2140 1 135 TRP HB2 1 135 TRP HE3 2.675 . 3.550 2.843 2.825 2.870 . 0 0 "[ . 1 . 2]" 1
2141 1 135 TRP HB2 1 136 GLN H 3.015 . 4.230 4.339 4.331 4.344 0.114 12 0 "[ . 1 . 2]" 1
2142 1 135 TRP HB2 1 149 LEU QD 4.640 . 7.480 4.146 3.998 4.337 . 0 0 "[ . 1 . 2]" 1
2143 1 135 TRP HB3 1 135 TRP HE3 2.660 . 3.520 2.921 2.905 2.938 . 0 0 "[ . 1 . 2]" 1
2144 1 135 TRP HB3 1 137 VAL MG2 4.085 . 6.370 3.296 3.263 3.349 . 0 0 "[ . 1 . 2]" 1
2145 1 135 TRP HD1 1 136 GLN H 2.690 . 3.580 1.889 1.869 1.912 . 0 0 "[ . 1 . 2]" 1
2146 1 135 TRP HD1 1 152 LYS HD2 3.650 . 5.500 5.167 3.354 5.505 0.005 8 0 "[ . 1 . 2]" 1
2147 1 135 TRP HD1 1 152 LYS HD3 3.650 . 5.500 4.738 3.557 5.296 . 0 0 "[ . 1 . 2]" 1
2148 1 135 TRP HD1 1 152 LYS QD 3.425 . 5.050 4.358 3.069 4.582 . 0 0 "[ . 1 . 2]" 1
2149 1 135 TRP HD1 1 152 LYS HE2 2.890 . 3.980 2.645 2.454 3.603 . 0 0 "[ . 1 . 2]" 1
2150 1 135 TRP HD1 1 152 LYS HE3 2.890 . 3.980 3.420 2.597 3.990 0.010 5 0 "[ . 1 . 2]" 1
2151 1 135 TRP HD1 1 152 LYS QE 2.800 . 3.800 2.509 2.413 2.766 . 0 0 "[ . 1 . 2]" 1
2152 1 135 TRP HE3 1 137 VAL MG2 3.390 . 4.980 4.116 4.089 4.133 . 0 0 "[ . 1 . 2]" 1
2153 1 135 TRP HE1 1 136 GLN H 3.110 . 4.420 4.305 4.281 4.337 . 0 0 "[ . 1 . 2]" 1
2154 1 135 TRP HE1 1 137 VAL HA 3.325 . 4.850 4.465 4.406 4.541 . 0 0 "[ . 1 . 2]" 1
2155 1 135 TRP HE1 1 137 VAL MG1 3.515 . 5.230 2.467 2.416 2.521 . 0 0 "[ . 1 . 2]" 1
2156 1 135 TRP HE1 1 137 VAL MG2 3.620 . 5.440 3.721 3.626 3.811 . 0 0 "[ . 1 . 2]" 1
2157 1 135 TRP HE1 1 142 ASP QB 4.095 . 6.390 4.216 4.135 4.321 . 0 0 "[ . 1 . 2]" 1
2158 1 135 TRP HE1 1 148 THR HB 3.650 . 5.500 4.949 4.906 4.994 . 0 0 "[ . 1 . 2]" 1
2159 1 135 TRP HE1 1 148 THR MG 3.155 . 4.510 2.540 2.466 2.625 . 0 0 "[ . 1 . 2]" 1
2160 1 135 TRP HE1 1 149 LEU QD 4.640 . 7.480 5.287 5.236 5.428 . 0 0 "[ . 1 . 2]" 1
2161 1 135 TRP HE1 1 152 LYS HE2 3.450 . 5.100 3.346 2.986 4.366 . 0 0 "[ . 1 . 2]" 1
2162 1 135 TRP HE1 1 152 LYS HE3 3.450 . 5.100 4.658 3.764 5.102 0.002 16 0 "[ . 1 . 2]" 1
2163 1 135 TRP HE1 1 152 LYS QE 3.370 . 4.940 3.262 2.946 4.124 . 0 0 "[ . 1 . 2]" 1
2164 1 135 TRP HZ3 1 149 LEU QD 4.530 . 7.260 1.940 1.856 2.016 . 0 0 "[ . 1 . 2]" 1
2165 1 135 TRP HZ2 1 137 VAL MG1 3.080 . 4.360 2.956 2.924 2.980 . 0 0 "[ . 1 . 2]" 1
2166 1 135 TRP HZ2 1 137 VAL MG2 3.545 . 5.290 4.322 4.300 4.344 . 0 0 "[ . 1 . 2]" 1
2167 1 135 TRP HZ2 1 142 ASP QB 3.770 . 5.740 4.935 4.878 4.997 . 0 0 "[ . 1 . 2]" 1
2168 1 135 TRP HZ2 1 143 ILE HA 2.595 . 3.390 1.926 1.883 1.955 . 0 0 "[ . 1 . 2]" 1
2169 1 135 TRP HZ2 1 143 ILE HB 3.650 . 5.500 2.936 2.816 3.047 . 0 0 "[ . 1 . 2]" 1
2170 1 135 TRP HZ2 1 143 ILE MG 3.515 . 5.230 4.339 4.270 4.390 . 0 0 "[ . 1 . 2]" 1
2171 1 135 TRP HZ2 1 143 ILE QG 3.675 . 5.550 3.119 3.074 3.166 . 0 0 "[ . 1 . 2]" 1
2172 1 135 TRP HZ2 1 143 ILE MD 3.545 . 5.290 4.572 4.546 4.591 . 0 0 "[ . 1 . 2]" 1
2173 1 135 TRP HZ2 1 148 THR HA 3.450 . 5.100 4.994 4.926 5.052 . 0 0 "[ . 1 . 2]" 1
2174 1 135 TRP HZ2 1 148 THR HB 2.350 . 2.900 2.952 2.936 2.974 0.074 12 0 "[ . 1 . 2]" 1
2175 1 135 TRP HZ2 1 148 THR MG 2.955 . 4.110 1.916 1.855 1.955 . 0 0 "[ . 1 . 2]" 1
2176 1 135 TRP HZ2 1 149 LEU H 3.245 . 4.690 4.328 4.294 4.360 . 0 0 "[ . 1 . 2]" 1
2177 1 135 TRP HZ2 1 149 LEU HA 3.570 . 5.340 4.091 3.912 4.246 . 0 0 "[ . 1 . 2]" 1
2178 1 135 TRP HZ2 1 149 LEU QD 4.655 . 7.510 4.192 4.098 4.334 . 0 0 "[ . 1 . 2]" 1
2179 1 135 TRP HH2 1 137 VAL MG1 3.450 . 5.100 4.280 4.248 4.296 . 0 0 "[ . 1 . 2]" 1
2180 1 135 TRP HH2 1 143 ILE HA 3.650 . 5.500 3.067 3.000 3.126 . 0 0 "[ . 1 . 2]" 1
2181 1 135 TRP HH2 1 148 THR HB 3.650 . 5.500 3.952 3.881 4.082 . 0 0 "[ . 1 . 2]" 1
2182 1 135 TRP HH2 1 149 LEU HA 3.185 . 4.570 3.621 3.472 3.774 . 0 0 "[ . 1 . 2]" 1
2183 1 135 TRP HH2 1 149 LEU QD 3.835 . 5.870 2.857 2.729 2.968 . 0 0 "[ . 1 . 2]" 1
2184 1 136 GLN H 1 136 GLN QG 3.490 . 5.180 4.009 3.737 4.100 . 0 0 "[ . 1 . 2]" 1
2185 1 136 GLN HA 1 136 GLN QG 2.760 . 3.720 2.194 2.080 2.360 . 0 0 "[ . 1 . 2]" 1
2186 1 136 GLN HA 1 137 VAL H 2.285 . 2.770 2.178 2.175 2.181 . 0 0 "[ . 1 . 2]" 1
2187 1 136 GLN HA 1 137 VAL MG1 4.165 . 6.530 4.891 4.880 4.908 . 0 0 "[ . 1 . 2]" 1
2188 1 136 GLN HA 1 137 VAL MG2 3.840 . 5.880 3.552 3.500 3.588 . 0 0 "[ . 1 . 2]" 1
2189 1 136 GLN QG 1 137 VAL H 3.365 . 4.930 3.445 3.225 3.959 . 0 0 "[ . 1 . 2]" 1
2190 1 137 VAL H 1 137 VAL MG2 3.185 . 4.570 2.102 2.028 2.155 . 0 0 "[ . 1 . 2]" 1
2191 1 137 VAL H 1 138 ASN H 3.015 . 4.230 4.256 4.229 4.276 0.046 11 0 "[ . 1 . 2]" 1
2192 1 137 VAL HA 1 137 VAL HB 2.410 . 3.020 2.752 2.745 2.759 . 0 0 "[ . 1 . 2]" 1
2193 1 137 VAL HA 1 137 VAL MG1 2.660 . 3.520 1.943 1.937 1.946 . 0 0 "[ . 1 . 2]" 1
2194 1 137 VAL HA 1 138 ASN H 2.350 . 2.900 2.120 2.101 2.129 . 0 0 "[ . 1 . 2]" 1
2195 1 137 VAL HA 1 139 GLY H 2.830 . 3.860 3.960 3.944 3.978 0.118 12 0 "[ . 1 . 2]" 1
2196 1 137 VAL HA 1 142 ASP HA 3.370 . 4.940 5.106 5.088 5.132 0.192 11 0 "[ . 1 . 2]" 1
2197 1 137 VAL HA 1 142 ASP QB 2.915 . 4.030 2.477 2.456 2.493 . 0 0 "[ . 1 . 2]" 1
2198 1 137 VAL HB 1 142 ASP QB 3.505 . 5.210 2.808 2.786 2.849 . 0 0 "[ . 1 . 2]" 1
2199 1 137 VAL HB 1 143 ILE HA 3.650 . 5.500 5.114 5.055 5.169 . 0 0 "[ . 1 . 2]" 1
2200 1 137 VAL MG1 1 138 ASN H 3.670 . 5.540 3.388 3.353 3.432 . 0 0 "[ . 1 . 2]" 1
2201 1 137 VAL MG1 1 139 GLY H 3.340 . 4.880 4.005 3.989 4.027 . 0 0 "[ . 1 . 2]" 1
2202 1 137 VAL MG1 1 142 ASP H 3.715 . 5.630 3.572 3.511 3.658 . 0 0 "[ . 1 . 2]" 1
2203 1 137 VAL MG1 1 142 ASP HA 3.220 . 4.640 3.478 3.466 3.512 . 0 0 "[ . 1 . 2]" 1
2204 1 137 VAL MG1 1 142 ASP QB 3.385 . 4.970 1.763 1.746 1.791 0.054 13 0 "[ . 1 . 2]" 1
2205 1 137 VAL MG1 1 143 ILE HA 2.955 . 4.110 2.727 2.686 2.771 . 0 0 "[ . 1 . 2]" 1
2206 1 137 VAL MG1 1 143 ILE HB 3.125 . 4.450 1.805 1.793 1.820 0.007 19 0 "[ . 1 . 2]" 1
2207 1 137 VAL MG1 1 143 ILE MG 3.390 . 4.980 1.877 1.851 1.892 . 0 0 "[ . 1 . 2]" 1
2208 1 137 VAL MG2 1 138 ASN H 4.040 . 6.280 4.414 4.384 4.439 . 0 0 "[ . 1 . 2]" 1
2209 1 137 VAL MG2 1 142 ASP QB 4.065 . 6.330 3.868 3.852 3.885 . 0 0 "[ . 1 . 2]" 1
2210 1 137 VAL MG2 1 143 ILE H 3.825 . 5.850 4.840 4.822 4.863 . 0 0 "[ . 1 . 2]" 1
2211 1 137 VAL MG2 1 143 ILE HA 4.165 . 6.530 4.386 4.312 4.455 . 0 0 "[ . 1 . 2]" 1
2212 1 137 VAL MG2 1 143 ILE HB 3.715 . 5.630 2.498 2.384 2.611 . 0 0 "[ . 1 . 2]" 1
2213 1 137 VAL MG2 1 143 ILE MG 3.965 . 6.130 2.525 2.426 2.703 . 0 0 "[ . 1 . 2]" 1
2214 1 137 VAL MG2 1 143 ILE QG 4.470 . 7.140 3.163 3.094 3.236 . 0 0 "[ . 1 . 2]" 1
2215 1 137 VAL MG2 1 143 ILE MD 3.980 . 6.160 4.115 4.086 4.135 . 0 0 "[ . 1 . 2]" 1
2216 1 138 ASN H 1 138 ASN HB2 2.485 . 3.170 2.323 2.287 2.432 . 0 0 "[ . 1 . 2]" 1
2217 1 138 ASN H 1 138 ASN HB3 2.675 . 3.550 3.573 3.559 3.591 0.041 12 0 "[ . 1 . 2]" 1
2218 1 138 ASN H 1 139 GLY H 2.550 . 3.300 2.407 2.325 2.457 . 0 0 "[ . 1 . 2]" 1
2219 1 138 ASN HA 1 138 ASN HB3 2.285 . 2.770 2.560 2.479 2.594 . 0 0 "[ . 1 . 2]" 1
2220 1 138 ASN HA 1 138 ASN HD21 3.650 . 5.500 3.725 1.985 4.367 . 0 0 "[ . 1 . 2]" 1
2221 1 138 ASN HA 1 138 ASN HD22 3.650 . 5.500 4.216 3.507 4.554 . 0 0 "[ . 1 . 2]" 1
2222 1 138 ASN HB2 1 139 GLY H 2.815 . 3.830 2.573 2.405 2.623 . 0 0 "[ . 1 . 2]" 1
2223 1 138 ASN HB3 1 139 GLY H 2.610 . 3.420 3.404 3.338 3.476 0.056 12 0 "[ . 1 . 2]" 1
2224 1 139 GLY HA3 1 140 LEU H 2.505 . 3.210 2.578 2.511 2.777 . 0 0 "[ . 1 . 2]" 1
2225 1 139 GLY HA3 1 140 LEU MD1 4.185 . 6.570 5.431 4.885 5.546 . 0 0 "[ . 1 . 2]" 1
2226 1 139 GLY HA3 1 140 LEU MD2 4.185 . 6.570 4.526 4.111 4.738 . 0 0 "[ . 1 . 2]" 1
2227 1 139 GLY HA3 1 140 LEU QD 4.180 . 6.560 4.313 3.908 4.473 . 0 0 "[ . 1 . 2]" 1
2228 1 139 GLY HA2 1 140 LEU H 2.505 . 3.210 2.508 2.393 2.560 . 0 0 "[ . 1 . 2]" 1
2229 1 139 GLY HA2 1 140 LEU MD1 4.185 . 6.570 4.991 3.945 5.283 . 0 0 "[ . 1 . 2]" 1
2230 1 139 GLY HA2 1 140 LEU MD2 4.185 . 6.570 3.670 3.457 3.834 . 0 0 "[ . 1 . 2]" 1
2231 1 139 GLY HA2 1 140 LEU QD 4.180 . 6.560 3.574 3.248 3.731 . 0 0 "[ . 1 . 2]" 1
2232 1 139 GLY QA 1 140 LEU QD 3.620 . 5.440 3.410 3.098 3.555 . 0 0 "[ . 1 . 2]" 1
2233 1 139 GLY QA 1 141 ASP H 3.350 . 4.900 3.152 3.030 3.461 . 0 0 "[ . 1 . 2]" 1
2234 1 140 LEU H 1 140 LEU QD 4.180 . 6.560 2.571 1.889 2.847 . 0 0 "[ . 1 . 2]" 1
2235 1 140 LEU H 1 141 ASP H 2.640 . 3.480 2.555 2.481 2.707 . 0 0 "[ . 1 . 2]" 1
2236 1 140 LEU H 1 142 ASP H 2.920 . 4.040 4.015 3.950 4.087 0.047 6 0 "[ . 1 . 2]" 1
2237 1 140 LEU HA 1 141 ASP H 2.595 . 3.390 3.472 3.455 3.520 0.130 16 0 "[ . 1 . 2]" 1
2238 1 140 LEU HA 1 142 ASP H 2.705 . 3.610 3.675 3.651 3.720 0.110 11 0 "[ . 1 . 2]" 1
2239 1 140 LEU HA 1 143 ILE H 2.720 . 3.640 3.333 3.270 3.413 . 0 0 "[ . 1 . 2]" 1
2240 1 140 LEU HA 1 143 ILE MG 2.675 . 3.550 2.202 2.085 2.306 . 0 0 "[ . 1 . 2]" 1
2241 1 140 LEU HA 1 143 ILE MD 3.220 . 4.640 3.577 3.523 3.603 . 0 0 "[ . 1 . 2]" 1
2242 1 140 LEU QB 1 141 ASP H 3.010 . 4.220 2.888 2.536 3.003 . 0 0 "[ . 1 . 2]" 1
2243 1 140 LEU QB 1 142 ASP H 3.430 . 5.060 4.520 4.398 4.575 . 0 0 "[ . 1 . 2]" 1
2244 1 140 LEU QB 1 143 ILE H 3.490 . 5.180 4.523 4.411 4.585 . 0 0 "[ . 1 . 2]" 1
2245 1 140 LEU QD 1 141 ASP H 4.475 . 7.150 3.965 3.630 4.090 . 0 0 "[ . 1 . 2]" 1
2246 1 140 LEU QD 1 142 ASP H 4.540 . 7.280 4.883 4.575 5.006 . 0 0 "[ . 1 . 2]" 1
2247 1 141 ASP H 1 141 ASP HA 2.380 . 2.960 2.836 2.780 2.856 . 0 0 "[ . 1 . 2]" 1
2248 1 141 ASP H 1 142 ASP H 2.440 . 3.080 2.573 2.500 2.760 . 0 0 "[ . 1 . 2]" 1
2249 1 141 ASP H 1 143 ILE H 3.125 . 4.450 4.115 4.040 4.230 . 0 0 "[ . 1 . 2]" 1
2250 1 141 ASP HA 1 142 ASP H 2.565 . 3.330 3.410 3.398 3.436 0.106 8 0 "[ . 1 . 2]" 1
2251 1 141 ASP HA 1 143 ILE H 2.920 . 4.040 3.843 3.729 3.940 . 0 0 "[ . 1 . 2]" 1
2252 1 141 ASP HA 1 144 LYS H 2.765 . 3.730 3.214 3.042 3.383 . 0 0 "[ . 1 . 2]" 1
2253 1 141 ASP HA 1 144 LYS QB 2.810 . 3.820 2.922 2.348 3.277 . 0 0 "[ . 1 . 2]" 1
2254 1 141 ASP HA 1 145 ASP H 3.045 . 4.290 4.396 4.369 4.413 0.123 19 0 "[ . 1 . 2]" 1
2255 1 141 ASP QB 1 143 ILE MG 4.610 . 7.420 5.416 5.334 5.495 . 0 0 "[ . 1 . 2]" 1
2256 1 142 ASP H 1 142 ASP QB 2.855 . 3.910 2.469 2.418 2.502 . 0 0 "[ . 1 . 2]" 1
2257 1 142 ASP H 1 143 ILE H 2.335 . 2.870 2.376 2.337 2.441 . 0 0 "[ . 1 . 2]" 1
2258 1 142 ASP H 1 144 LYS H 2.970 . 4.140 3.698 3.665 3.740 . 0 0 "[ . 1 . 2]" 1
2259 1 142 ASP HA 1 143 ILE H 2.705 . 3.610 3.433 3.402 3.453 . 0 0 "[ . 1 . 2]" 1
2260 1 142 ASP HA 1 143 ILE MG 3.930 . 6.060 4.563 4.467 4.668 . 0 0 "[ . 1 . 2]" 1
2261 1 142 ASP HA 1 144 LYS QG 4.020 . 6.240 4.943 4.695 5.669 . 0 0 "[ . 1 . 2]" 1
2262 1 142 ASP HA 1 148 THR MG 3.790 . 5.780 4.133 3.909 4.284 . 0 0 "[ . 1 . 2]" 1
2263 1 142 ASP QB 1 143 ILE H 3.135 . 4.470 3.037 2.994 3.090 . 0 0 "[ . 1 . 2]" 1
2264 1 142 ASP QB 1 143 ILE MG 4.610 . 7.420 2.919 2.793 3.079 . 0 0 "[ . 1 . 2]" 1
2265 1 143 ILE H 1 143 ILE HB 2.565 . 3.330 3.377 3.346 3.394 0.064 5 0 "[ . 1 . 2]" 1
2266 1 143 ILE H 1 143 ILE MG 2.895 . 3.990 1.934 1.892 1.961 . 0 0 "[ . 1 . 2]" 1
2267 1 143 ILE H 1 143 ILE QG 3.910 . 6.020 4.180 4.156 4.196 . 0 0 "[ . 1 . 2]" 1
2268 1 143 ILE H 1 143 ILE MD 3.340 . 4.880 3.746 3.722 3.779 . 0 0 "[ . 1 . 2]" 1
2269 1 143 ILE H 1 145 ASP H 2.830 . 3.860 3.942 3.899 4.003 0.143 16 0 "[ . 1 . 2]" 1
2270 1 143 ILE HA 1 143 ILE QG 2.745 . 3.690 2.644 2.617 2.660 . 0 0 "[ . 1 . 2]" 1
2271 1 143 ILE HA 1 143 ILE MD 3.220 . 4.640 3.585 3.563 3.607 . 0 0 "[ . 1 . 2]" 1
2272 1 143 ILE HA 1 148 THR HB 3.480 . 5.160 3.356 3.245 3.496 . 0 0 "[ . 1 . 2]" 1
2273 1 143 ILE HA 1 148 THR MG 3.405 . 5.010 2.784 2.600 2.979 . 0 0 "[ . 1 . 2]" 1
2274 1 143 ILE MD 1 144 LYS H 3.340 . 4.880 3.327 3.230 3.432 . 0 0 "[ . 1 . 2]" 1
2275 1 144 LYS H 1 145 ASP H 2.610 . 3.420 2.715 2.680 2.746 . 0 0 "[ . 1 . 2]" 1
2276 1 144 LYS HA 1 145 ASP H 2.675 . 3.550 3.488 3.478 3.497 . 0 0 "[ . 1 . 2]" 1
2277 1 145 ASP H 1 145 ASP HB2 2.335 . 2.870 2.337 2.187 2.623 . 0 0 "[ . 1 . 2]" 1
2278 1 145 ASP H 1 145 ASP HB3 2.335 . 2.870 2.760 2.422 2.935 0.065 12 0 "[ . 1 . 2]" 1
2279 1 145 ASP H 1 148 THR MG 3.590 . 5.380 4.413 4.385 4.456 . 0 0 "[ . 1 . 2]" 1
2280 1 145 ASP HA 1 145 ASP HB2 2.285 . 2.770 2.581 2.413 2.671 . 0 0 "[ . 1 . 2]" 1
2281 1 145 ASP HA 1 145 ASP HB3 2.285 . 2.770 2.954 2.927 2.994 0.224 13 0 "[ . 1 . 2]" 1
2282 1 145 ASP HA 1 145 ASP QB 2.180 . 2.560 2.423 2.317 2.475 . 0 0 "[ . 1 . 2]" 1
2283 1 145 ASP HA 1 146 ARG H 2.610 . 3.420 2.165 2.150 2.170 . 0 0 "[ . 1 . 2]" 1
2284 1 145 ASP HA 1 146 ARG HA 3.325 . 4.850 4.434 4.417 4.441 . 0 0 "[ . 1 . 2]" 1
2285 1 145 ASP HA 1 147 SER H 3.125 . 4.450 3.594 3.542 3.719 . 0 0 "[ . 1 . 2]" 1
2286 1 145 ASP HB2 1 148 THR MG 4.165 . 6.530 4.496 4.301 4.812 . 0 0 "[ . 1 . 2]" 1
2287 1 145 ASP HB3 1 148 THR MG 4.165 . 6.530 3.560 3.391 3.682 . 0 0 "[ . 1 . 2]" 1
2288 1 145 ASP QB 1 148 THR HB 4.095 . 6.390 2.374 2.243 2.517 . 0 0 "[ . 1 . 2]" 1
2289 1 145 ASP QB 1 148 THR MG 4.020 . 6.240 3.424 3.319 3.511 . 0 0 "[ . 1 . 2]" 1
2290 1 146 ARG H 1 146 ARG QG 3.985 . 6.170 2.769 1.968 3.934 . 0 0 "[ . 1 . 2]" 1
2291 1 146 ARG H 1 147 SER H 2.750 . 3.700 2.791 2.743 2.841 . 0 0 "[ . 1 . 2]" 1
2292 1 146 ARG HA 1 147 SER H 2.660 . 3.520 3.492 3.474 3.523 0.003 10 0 "[ . 1 . 2]" 1
2293 1 146 ARG HA 1 149 LEU H 2.955 . 4.110 3.712 3.640 3.814 . 0 0 "[ . 1 . 2]" 1
2294 1 146 ARG HA 1 150 GLY H 3.060 . 4.320 4.339 4.283 4.357 0.037 14 0 "[ . 1 . 2]" 1
2295 1 146 ARG QG 1 147 SER H 3.955 . 6.110 3.453 2.052 4.622 . 0 0 "[ . 1 . 2]" 1
2296 1 146 ARG QD 1 147 SER H 4.095 . 6.390 4.436 2.778 5.402 . 0 0 "[ . 1 . 2]" 1
2297 1 147 SER H 1 147 SER HA 2.315 . 2.830 2.853 2.830 2.872 0.042 11 0 "[ . 1 . 2]" 1
2298 1 147 SER H 1 148 THR H 2.455 . 3.110 2.503 2.422 2.593 . 0 0 "[ . 1 . 2]" 1
2299 1 147 SER H 1 166 LEU QD 4.120 . 6.440 3.946 3.609 4.204 . 0 0 "[ . 1 . 2]" 1
2300 1 147 SER HA 1 150 GLY H 2.565 . 3.330 3.347 3.305 3.383 0.053 12 0 "[ . 1 . 2]" 1
2301 1 147 SER HA 1 150 GLY QA 3.150 . 4.500 3.595 3.542 3.681 . 0 0 "[ . 1 . 2]" 1
2302 1 147 SER HA 1 166 LEU MD1 2.895 . 3.990 2.580 1.831 3.235 . 0 0 "[ . 1 . 2]" 1
2303 1 147 SER HA 1 166 LEU MD2 2.895 . 3.990 2.360 1.886 3.166 . 0 0 "[ . 1 . 2]" 1
2304 1 147 SER HA 1 166 LEU QD 2.590 . 3.380 1.921 1.805 2.025 . 0 0 "[ . 1 . 2]" 1
2305 1 148 THR H 1 148 THR HB 2.425 . 3.050 2.407 2.365 2.464 . 0 0 "[ . 1 . 2]" 1
2306 1 148 THR H 1 149 LEU H 2.410 . 3.020 2.701 2.683 2.729 . 0 0 "[ . 1 . 2]" 1
2307 1 148 THR HA 1 148 THR HB 2.335 . 2.870 3.006 3.002 3.010 0.140 4 0 "[ . 1 . 2]" 1
2308 1 148 THR HA 1 148 THR MG 2.690 . 3.580 2.559 2.498 2.607 . 0 0 "[ . 1 . 2]" 1
2309 1 148 THR HA 1 151 GLU QB 3.010 . 4.220 3.191 2.988 3.694 . 0 0 "[ . 1 . 2]" 1
2310 1 148 THR HA 1 151 GLU QG 4.095 . 6.390 4.457 2.095 5.231 . 0 0 "[ . 1 . 2]" 1
2311 1 148 THR HB 1 149 LEU H 2.675 . 3.550 2.952 2.904 2.994 . 0 0 "[ . 1 . 2]" 1
2312 1 148 THR MG 1 149 LEU QD 5.450 . 9.100 4.282 4.172 4.434 . 0 0 "[ . 1 . 2]" 1
2313 1 149 LEU H 1 149 LEU HG 3.000 . 4.200 4.330 4.303 4.346 0.146 11 0 "[ . 1 . 2]" 1
2314 1 149 LEU H 1 149 LEU MD1 3.515 . 5.230 4.121 4.109 4.156 . 0 0 "[ . 1 . 2]" 1
2315 1 149 LEU H 1 149 LEU MD2 3.515 . 5.230 4.242 4.207 4.269 . 0 0 "[ . 1 . 2]" 1
2316 1 149 LEU H 1 149 LEU QD 3.310 . 4.820 3.723 3.706 3.736 . 0 0 "[ . 1 . 2]" 1
2317 1 149 LEU H 1 150 GLY H 2.505 . 3.210 2.458 2.428 2.493 . 0 0 "[ . 1 . 2]" 1
2318 1 149 LEU HA 1 149 LEU MD1 3.140 . 4.480 1.959 1.931 2.054 . 0 0 "[ . 1 . 2]" 1
2319 1 149 LEU HA 1 149 LEU MD2 3.140 . 4.480 3.799 3.781 3.820 . 0 0 "[ . 1 . 2]" 1
2320 1 149 LEU HA 1 149 LEU QD 2.800 . 3.800 1.952 1.926 2.046 . 0 0 "[ . 1 . 2]" 1
2321 1 149 LEU HA 1 150 GLY H 2.705 . 3.610 3.544 3.539 3.549 . 0 0 "[ . 1 . 2]" 1
2322 1 149 LEU HA 1 151 GLU H 2.830 . 3.860 3.909 3.900 3.923 0.063 7 0 "[ . 1 . 2]" 1
2323 1 149 LEU HA 1 152 LYS H 2.690 . 3.580 3.513 3.415 3.588 0.008 2 0 "[ . 1 . 2]" 1
2324 1 149 LEU HA 1 152 LYS QB 3.070 . 4.340 3.137 2.873 3.661 . 0 0 "[ . 1 . 2]" 1
2325 1 149 LEU HA 1 153 LEU QD 4.695 . 7.590 3.657 3.496 4.102 . 0 0 "[ . 1 . 2]" 1
2326 1 149 LEU HB2 1 150 GLY H 2.690 . 3.580 3.677 3.655 3.691 0.111 9 0 "[ . 1 . 2]" 1
2327 1 149 LEU HB3 1 150 GLY H 2.690 . 3.580 2.233 2.203 2.259 . 0 0 "[ . 1 . 2]" 1
2328 1 149 LEU QB 1 150 GLY H 2.555 . 3.310 2.214 2.186 2.240 . 0 0 "[ . 1 . 2]" 1
2329 1 149 LEU HG 1 150 GLY H 2.935 . 4.070 3.237 3.098 3.310 . 0 0 "[ . 1 . 2]" 1
2330 1 149 LEU HG 1 153 LEU QD 4.195 . 6.590 3.725 3.412 4.087 . 0 0 "[ . 1 . 2]" 1
2331 1 149 LEU MD1 1 150 GLY H 3.745 . 5.690 4.078 3.868 4.143 . 0 0 "[ . 1 . 2]" 1
2332 1 149 LEU MD2 1 150 GLY H 3.745 . 5.690 4.055 4.010 4.108 . 0 0 "[ . 1 . 2]" 1
2333 1 149 LEU QD 1 150 GLY H 3.460 . 5.120 3.622 3.528 3.662 . 0 0 "[ . 1 . 2]" 1
2334 1 149 LEU QD 1 152 LYS H 4.255 . 6.710 4.280 3.899 4.383 . 0 0 "[ . 1 . 2]" 1
2335 1 149 LEU QD 1 153 LEU H 4.455 . 7.110 4.002 3.849 4.228 . 0 0 "[ . 1 . 2]" 1
2336 1 149 LEU QD 1 153 LEU QD 5.435 . 9.070 2.163 1.918 2.433 . 0 0 "[ . 1 . 2]" 1
2337 1 150 GLY H 1 151 GLU H 2.470 . 3.140 2.807 2.739 2.889 . 0 0 "[ . 1 . 2]" 1
2338 1 150 GLY H 1 151 GLU QB 3.630 . 5.460 4.636 4.558 4.708 . 0 0 "[ . 1 . 2]" 1
2339 1 150 GLY H 1 161 LEU MD1 3.650 . 5.500 3.583 3.358 3.818 . 0 0 "[ . 1 . 2]" 1
2340 1 150 GLY H 1 161 LEU MD2 3.650 . 5.500 2.573 2.218 3.114 . 0 0 "[ . 1 . 2]" 1
2341 1 150 GLY HA3 1 153 LEU QD 4.695 . 7.590 5.325 5.031 5.529 . 0 0 "[ . 1 . 2]" 1
2342 1 150 GLY HA3 1 161 LEU MD1 4.825 . 7.850 2.830 2.685 2.921 . 0 0 "[ . 1 . 2]" 1
2343 1 150 GLY HA3 1 161 LEU MD2 4.825 . 7.850 2.966 2.691 3.369 . 0 0 "[ . 1 . 2]" 1
2344 1 150 GLY HA3 1 166 LEU MD1 3.140 . 4.480 1.958 1.862 2.074 . 0 0 "[ . 1 . 2]" 1
2345 1 150 GLY HA3 1 166 LEU MD2 3.140 . 4.480 2.113 1.981 2.389 . 0 0 "[ . 1 . 2]" 1
2346 1 150 GLY HA2 1 153 LEU QD 4.695 . 7.590 4.109 3.593 4.375 . 0 0 "[ . 1 . 2]" 1
2347 1 150 GLY HA2 1 161 LEU MD1 4.825 . 7.850 1.863 1.828 1.951 . 0 0 "[ . 1 . 2]" 1
2348 1 150 GLY HA2 1 161 LEU MD2 4.825 . 7.850 2.748 2.201 3.156 . 0 0 "[ . 1 . 2]" 1
2349 1 150 GLY HA2 1 166 LEU MD1 3.140 . 4.480 3.295 3.026 3.584 . 0 0 "[ . 1 . 2]" 1
2350 1 150 GLY HA2 1 166 LEU MD2 3.140 . 4.480 3.453 3.249 3.548 . 0 0 "[ . 1 . 2]" 1
2351 1 150 GLY QA 1 151 GLU QB 4.355 . 6.910 4.425 4.249 4.530 . 0 0 "[ . 1 . 2]" 1
2352 1 150 GLY QA 1 153 LEU H 3.815 . 5.830 3.824 3.726 3.953 . 0 0 "[ . 1 . 2]" 1
2353 1 150 GLY QA 1 161 LEU QD 3.980 . 6.160 1.789 1.746 1.850 0.054 15 0 "[ . 1 . 2]" 1
2354 1 150 GLY QA 1 166 LEU HG 3.845 . 5.890 2.887 1.968 3.762 . 0 0 "[ . 1 . 2]" 1
2355 1 150 GLY QA 1 166 LEU QD 2.895 . 3.990 1.787 1.702 1.936 0.098 5 0 "[ . 1 . 2]" 1
2356 1 151 GLU H 1 151 GLU QB 2.715 . 3.630 2.239 2.176 2.507 . 0 0 "[ . 1 . 2]" 1
2357 1 151 GLU H 1 152 LYS H 2.350 . 2.900 2.417 2.389 2.459 . 0 0 "[ . 1 . 2]" 1
2358 1 151 GLU HA 1 154 GLY H 2.765 . 3.730 3.552 3.447 3.669 . 0 0 "[ . 1 . 2]" 1
2359 1 151 GLU HA 1 155 GLY H 2.470 . 3.140 1.974 1.928 1.997 . 0 0 "[ . 1 . 2]" 1
2360 1 151 GLU QB 1 152 LYS H 3.025 . 4.250 2.656 2.497 3.466 . 0 0 "[ . 1 . 2]" 1
2361 1 151 GLU QB 1 155 GLY H 3.475 . 5.150 3.989 3.797 4.050 . 0 0 "[ . 1 . 2]" 1
2362 1 151 GLU QB 1 155 GLY HA3 3.365 . 4.930 4.279 3.946 4.570 . 0 0 "[ . 1 . 2]" 1
2363 1 151 GLU QB 1 155 GLY HA2 3.365 . 4.930 2.739 2.385 3.040 . 0 0 "[ . 1 . 2]" 1
2364 1 151 GLU QG 1 155 GLY HA3 4.095 . 6.390 3.889 3.014 5.771 . 0 0 "[ . 1 . 2]" 1
2365 1 151 GLU QG 1 155 GLY HA2 4.095 . 6.390 2.567 1.883 4.279 . 0 0 "[ . 1 . 2]" 1
2366 1 151 GLU QG 1 155 GLY QA 3.995 . 6.190 2.532 1.865 4.171 . 0 0 "[ . 1 . 2]" 1
2367 1 152 LYS H 1 152 LYS QB 2.855 . 3.910 2.487 2.358 2.701 . 0 0 "[ . 1 . 2]" 1
2368 1 152 LYS H 1 152 LYS HG2 2.780 . 3.760 2.208 2.061 3.462 . 0 0 "[ . 1 . 2]" 1
2369 1 152 LYS H 1 152 LYS HG3 2.780 . 3.760 3.132 2.132 3.551 . 0 0 "[ . 1 . 2]" 1
2370 1 152 LYS H 1 152 LYS QG 2.695 . 3.590 2.104 1.996 2.304 . 0 0 "[ . 1 . 2]" 1
2371 1 152 LYS H 1 152 LYS HD2 3.090 . 4.380 4.224 4.122 4.401 0.021 9 0 "[ . 1 . 2]" 1
2372 1 152 LYS H 1 152 LYS HD3 3.090 . 4.380 4.304 4.083 4.418 0.038 12 0 "[ . 1 . 2]" 1
2373 1 152 LYS H 1 152 LYS QD 2.970 . 4.140 3.792 3.761 3.883 . 0 0 "[ . 1 . 2]" 1
2374 1 152 LYS H 1 153 LEU H 2.470 . 3.140 2.785 2.688 2.909 . 0 0 "[ . 1 . 2]" 1
2375 1 152 LYS H 1 153 LEU QD 4.615 . 7.430 3.618 3.518 4.308 . 0 0 "[ . 1 . 2]" 1
2376 1 152 LYS HA 1 152 LYS HE2 3.435 . 5.070 4.997 4.582 5.117 0.047 5 0 "[ . 1 . 2]" 1
2377 1 152 LYS HA 1 152 LYS HE3 3.435 . 5.070 4.423 3.980 5.118 0.048 12 0 "[ . 1 . 2]" 1
2378 1 152 LYS QB 1 153 LEU H 3.150 . 4.500 2.789 2.601 2.998 . 0 0 "[ . 1 . 2]" 1
2379 1 152 LYS QB 1 153 LEU QD 5.140 . 8.480 2.163 1.944 2.813 . 0 0 "[ . 1 . 2]" 1
2380 1 153 LEU H 1 153 LEU HB2 2.675 . 3.550 2.358 2.273 2.414 . 0 0 "[ . 1 . 2]" 1
2381 1 153 LEU H 1 153 LEU HB3 2.675 . 3.550 3.580 3.551 3.619 0.069 7 0 "[ . 1 . 2]" 1
2382 1 153 LEU H 1 153 LEU HG 2.625 . 3.450 3.462 3.318 3.493 0.043 5 0 "[ . 1 . 2]" 1
2383 1 153 LEU H 1 153 LEU QD 4.150 . 6.500 2.144 1.952 2.726 . 0 0 "[ . 1 . 2]" 1
2384 1 153 LEU HA 1 153 LEU MD1 3.170 . 4.540 2.849 2.608 3.493 . 0 0 "[ . 1 . 2]" 1
2385 1 153 LEU HA 1 153 LEU MD2 3.170 . 4.540 2.224 2.082 3.107 . 0 0 "[ . 1 . 2]" 1
2386 1 153 LEU HA 1 153 LEU QD 2.785 . 3.770 2.146 2.042 2.905 . 0 0 "[ . 1 . 2]" 1
2387 1 153 LEU HA 1 154 GLY H 2.640 . 3.480 3.533 3.510 3.542 0.062 7 0 "[ . 1 . 2]" 1
2388 1 153 LEU HB2 1 154 GLY H 3.015 . 4.230 2.379 2.355 2.511 . 0 0 "[ . 1 . 2]" 1
2389 1 153 LEU HB3 1 154 GLY H 3.015 . 4.230 3.326 3.237 3.394 . 0 0 "[ . 1 . 2]" 1
2390 1 153 LEU QB 1 154 GLY H 2.845 . 3.890 2.329 2.309 2.430 . 0 0 "[ . 1 . 2]" 1
2391 1 153 LEU HG 1 154 GLY H 3.090 . 4.380 4.531 4.495 4.672 0.292 2 0 "[ . 1 . 2]" 1
2392 1 153 LEU QD 1 154 GLY H 4.695 . 7.590 3.781 3.742 3.828 . 0 0 "[ . 1 . 2]" 1
2393 1 153 LEU QD 1 158 VAL MG2 4.940 . 8.080 4.770 4.621 4.897 . 0 0 "[ . 1 . 2]" 1
2394 1 153 LEU QD 1 161 LEU MD1 5.205 . 8.610 3.539 2.997 3.740 . 0 0 "[ . 1 . 2]" 1
2395 1 153 LEU QD 1 161 LEU MD2 5.205 . 8.610 4.466 4.023 4.735 . 0 0 "[ . 1 . 2]" 1
2396 1 153 LEU QD 1 161 LEU QD 4.825 . 7.850 3.410 2.919 3.607 . 0 0 "[ . 1 . 2]" 1
2397 1 154 GLY H 1 155 GLY H 2.440 . 3.080 2.143 2.092 2.216 . 0 0 "[ . 1 . 2]" 1
2398 1 154 GLY H 1 158 VAL MG2 3.390 . 4.980 2.878 2.685 3.174 . 0 0 "[ . 1 . 2]" 1
2399 1 154 GLY HA3 1 157 VAL MG1 4.685 . 7.570 5.060 4.881 5.260 . 0 0 "[ . 1 . 2]" 1
2400 1 154 GLY HA3 1 157 VAL MG2 4.685 . 7.570 2.677 2.471 2.880 . 0 0 "[ . 1 . 2]" 1
2401 1 154 GLY HA3 1 157 VAL QG 4.370 . 6.940 2.667 2.464 2.867 . 0 0 "[ . 1 . 2]" 1
2402 1 154 GLY HA3 1 158 VAL MG2 3.235 . 4.670 1.887 1.856 1.927 . 0 0 "[ . 1 . 2]" 1
2403 1 154 GLY HA2 1 157 VAL MG1 4.685 . 7.570 5.049 4.869 5.277 . 0 0 "[ . 1 . 2]" 1
2404 1 154 GLY HA2 1 157 VAL MG2 4.685 . 7.570 3.066 2.924 3.259 . 0 0 "[ . 1 . 2]" 1
2405 1 154 GLY HA2 1 157 VAL QG 4.370 . 6.940 3.041 2.902 3.228 . 0 0 "[ . 1 . 2]" 1
2406 1 154 GLY HA2 1 158 VAL MG2 3.235 . 4.670 3.342 3.273 3.422 . 0 0 "[ . 1 . 2]" 1
2407 1 154 GLY QA 1 157 VAL QG 3.815 . 5.830 2.505 2.337 2.680 . 0 0 "[ . 1 . 2]" 1
2408 1 154 GLY QA 1 158 VAL MG2 3.015 . 4.230 1.877 1.845 1.917 . 0 0 "[ . 1 . 2]" 1
2409 1 155 GLY H 1 158 VAL MG2 3.635 . 5.470 2.728 2.420 2.945 . 0 0 "[ . 1 . 2]" 1
2410 1 155 GLY HA3 1 157 VAL H 3.075 . 4.350 3.453 3.364 3.534 . 0 0 "[ . 1 . 2]" 1
2411 1 155 GLY HA2 1 157 VAL H 3.075 . 4.350 4.392 4.354 4.422 0.072 3 0 "[ . 1 . 2]" 1
2412 1 155 GLY QA 1 157 VAL H 2.970 . 4.140 3.332 3.260 3.399 . 0 0 "[ . 1 . 2]" 1
2413 1 156 ASN HA 1 157 VAL QG 3.950 . 6.100 4.307 4.280 4.344 . 0 0 "[ . 1 . 2]" 1
2414 1 156 ASN HA 1 158 VAL H 2.845 . 3.890 3.806 3.711 3.885 . 0 0 "[ . 1 . 2]" 1
2415 1 156 ASN HB2 1 157 VAL H 3.355 . 4.910 3.646 3.623 3.675 . 0 0 "[ . 1 . 2]" 1
2416 1 156 ASN HB3 1 157 VAL H 3.355 . 4.910 4.259 4.185 4.355 . 0 0 "[ . 1 . 2]" 1
2417 1 156 ASN QB 1 157 VAL H 3.070 . 4.340 3.449 3.440 3.458 . 0 0 "[ . 1 . 2]" 1
2418 1 156 ASN QB 1 157 VAL HA 3.135 . 4.470 4.085 4.075 4.091 . 0 0 "[ . 1 . 2]" 1
2419 1 157 VAL H 1 157 VAL HB 2.705 . 3.610 3.664 3.651 3.676 0.066 14 0 "[ . 1 . 2]" 1
2420 1 157 VAL H 1 158 VAL H 2.455 . 3.110 2.290 2.240 2.335 . 0 0 "[ . 1 . 2]" 1
2421 1 157 VAL H 1 158 VAL HB 3.125 . 4.450 4.527 4.499 4.543 0.093 2 0 "[ . 1 . 2]" 1
2422 1 157 VAL HA 1 157 VAL HB 2.210 . 2.620 2.464 2.452 2.474 . 0 0 "[ . 1 . 2]" 1
2423 1 157 VAL HA 1 158 VAL H 2.580 . 3.360 3.407 3.398 3.414 0.054 5 0 "[ . 1 . 2]" 1
2424 1 157 VAL HB 1 158 VAL H 3.110 . 4.420 4.096 4.084 4.124 . 0 0 "[ . 1 . 2]" 1
2425 1 157 VAL QG 1 158 VAL H 4.120 . 6.440 2.479 2.363 2.584 . 0 0 "[ . 1 . 2]" 1
2426 1 158 VAL H 1 158 VAL HB 2.335 . 2.870 2.472 2.434 2.514 . 0 0 "[ . 1 . 2]" 1
2427 1 158 VAL H 1 158 VAL MG2 3.065 . 4.330 2.338 2.207 2.439 . 0 0 "[ . 1 . 2]" 1
2428 1 158 VAL H 1 166 LEU QD 4.695 . 7.590 4.338 4.018 4.676 . 0 0 "[ . 1 . 2]" 1
2429 1 158 VAL HA 1 159 VAL H 2.440 . 3.080 2.103 2.098 2.121 . 0 0 "[ . 1 . 2]" 1
2430 1 158 VAL HA 1 159 VAL QG 3.665 . 5.530 3.441 3.365 3.559 . 0 0 "[ . 1 . 2]" 1
2431 1 158 VAL HA 1 160 SER H 2.780 . 3.760 3.479 3.408 3.640 . 0 0 "[ . 1 . 2]" 1
2432 1 158 VAL MG1 1 160 SER H 3.050 . 4.300 2.178 2.097 2.264 . 0 0 "[ . 1 . 2]" 1
2433 1 158 VAL MG1 1 160 SER HA 3.870 . 5.940 3.244 3.175 3.344 . 0 0 "[ . 1 . 2]" 1
2434 1 158 VAL MG1 1 162 GLU H 3.790 . 5.780 4.895 4.859 4.925 . 0 0 "[ . 1 . 2]" 1
2435 1 158 VAL MG1 1 166 LEU QB 4.610 . 7.420 2.303 1.946 2.673 . 0 0 "[ . 1 . 2]" 1
2436 1 158 VAL MG2 1 160 SER H 3.545 . 5.290 4.449 4.423 4.469 . 0 0 "[ . 1 . 2]" 1
2437 1 159 VAL H 1 159 VAL HB 2.660 . 3.520 2.589 2.564 2.626 . 0 0 "[ . 1 . 2]" 1
2438 1 159 VAL H 1 159 VAL MG1 3.205 . 4.610 3.764 3.755 3.783 . 0 0 "[ . 1 . 2]" 1
2439 1 159 VAL H 1 159 VAL MG2 3.205 . 4.610 2.015 1.960 2.199 . 0 0 "[ . 1 . 2]" 1
2440 1 159 VAL H 1 160 SER H 2.380 . 2.960 2.371 2.296 2.418 . 0 0 "[ . 1 . 2]" 1
2441 1 159 VAL HA 1 159 VAL HB 2.335 . 2.870 3.002 3.000 3.003 0.133 20 0 "[ . 1 . 2]" 1
2442 1 159 VAL HA 1 160 SER H 2.610 . 3.420 3.454 3.441 3.471 0.051 6 0 "[ . 1 . 2]" 1
2443 1 159 VAL HA 1 166 LEU H 2.830 . 3.860 3.816 3.683 3.897 0.037 4 0 "[ . 1 . 2]" 1
2444 1 159 VAL HB 1 160 SER H 2.535 . 3.270 2.971 2.877 3.047 . 0 0 "[ . 1 . 2]" 1
2445 1 159 VAL MG1 1 160 SER HB2 5.055 . 8.310 4.923 4.581 5.094 . 0 0 "[ . 1 . 2]" 1
2446 1 159 VAL MG1 1 160 SER HB3 5.055 . 8.310 3.962 3.851 4.433 . 0 0 "[ . 1 . 2]" 1
2447 1 159 VAL MG2 1 160 SER HB2 5.055 . 8.310 6.210 5.825 6.259 . 0 0 "[ . 1 . 2]" 1
2448 1 159 VAL MG2 1 160 SER HB3 5.055 . 8.310 5.846 5.777 6.207 . 0 0 "[ . 1 . 2]" 1
2449 1 159 VAL QG 1 160 SER H 3.895 . 5.990 3.414 3.375 3.451 . 0 0 "[ . 1 . 2]" 1
2450 1 159 VAL QG 1 160 SER QB 4.050 . 6.300 3.725 3.656 3.902 . 0 0 "[ . 1 . 2]" 1
2451 1 159 VAL QG 1 165 PRO HA 4.255 . 6.710 4.082 3.904 4.321 . 0 0 "[ . 1 . 2]" 1
2452 1 159 VAL QG 1 166 LEU H 4.935 . 8.070 3.907 3.768 4.046 . 0 0 "[ . 1 . 2]" 1
2453 1 160 SER H 1 160 SER HB2 2.780 . 3.760 3.701 3.373 3.743 . 0 0 "[ . 1 . 2]" 1
2454 1 160 SER H 1 160 SER HB3 2.780 . 3.760 3.837 3.804 3.982 0.222 1 0 "[ . 1 . 2]" 1
2455 1 160 SER H 1 161 LEU H 3.015 . 4.230 4.253 4.222 4.286 0.056 12 0 "[ . 1 . 2]" 1
2456 1 160 SER H 1 166 LEU H 2.890 . 3.980 3.983 3.891 4.013 0.033 5 0 "[ . 1 . 2]" 1
2457 1 160 SER HA 1 165 PRO HA 2.180 . 2.560 2.315 2.169 2.412 . 0 0 "[ . 1 . 2]" 1
2458 1 160 SER HA 1 165 PRO QB 3.975 . 6.150 4.155 4.058 4.258 . 0 0 "[ . 1 . 2]" 1
2459 1 160 SER HA 1 166 LEU HG 3.075 . 4.350 4.383 4.294 4.436 0.086 19 0 "[ . 1 . 2]" 1
2460 1 160 SER HA 1 166 LEU QD 4.220 . 6.640 2.873 2.421 3.441 . 0 0 "[ . 1 . 2]" 1
2461 1 160 SER HB2 1 161 LEU H 2.595 . 3.390 2.966 2.850 3.419 0.029 1 0 "[ . 1 . 2]" 1
2462 1 160 SER HB2 1 165 PRO HA 2.690 . 3.580 3.544 3.490 3.599 0.019 2 0 "[ . 1 . 2]" 1
2463 1 160 SER HB2 1 165 PRO HG2 4.540 . 7.280 6.683 6.472 6.869 . 0 0 "[ . 1 . 2]" 1
2464 1 160 SER HB2 1 165 PRO HG3 4.540 . 7.280 5.711 4.993 6.814 . 0 0 "[ . 1 . 2]" 1
2465 1 160 SER HB2 1 166 LEU H 3.420 . 5.040 4.651 4.505 4.775 . 0 0 "[ . 1 . 2]" 1
2466 1 160 SER HB3 1 161 LEU H 2.595 . 3.390 3.431 3.097 3.459 0.069 20 0 "[ . 1 . 2]" 1
2467 1 160 SER HB3 1 165 PRO HA 2.690 . 3.580 1.992 1.938 2.133 . 0 0 "[ . 1 . 2]" 1
2468 1 160 SER HB3 1 165 PRO HG2 4.540 . 7.280 5.291 4.919 5.671 . 0 0 "[ . 1 . 2]" 1
2469 1 160 SER HB3 1 165 PRO HG3 4.540 . 7.280 4.273 3.549 5.454 . 0 0 "[ . 1 . 2]" 1
2470 1 160 SER HB3 1 166 LEU H 3.420 . 5.040 3.452 3.326 3.671 . 0 0 "[ . 1 . 2]" 1
2471 1 160 SER QB 1 161 LEU H 2.490 . 3.180 2.790 2.721 2.878 . 0 0 "[ . 1 . 2]" 1
2472 1 160 SER QB 1 164 LYS H 3.180 . 4.560 3.651 3.512 3.787 . 0 0 "[ . 1 . 2]" 1
2473 1 160 SER QB 1 165 PRO HA 2.600 . 3.400 1.982 1.930 2.118 . 0 0 "[ . 1 . 2]" 1
2474 1 160 SER QB 1 165 PRO QB 4.545 . 7.290 3.607 3.282 3.867 . 0 0 "[ . 1 . 2]" 1
2475 1 160 SER QB 1 165 PRO QG 3.950 . 6.100 3.938 3.405 4.746 . 0 0 "[ . 1 . 2]" 1
2476 1 160 SER QB 1 166 LEU H 3.325 . 4.850 3.364 3.253 3.556 . 0 0 "[ . 1 . 2]" 1
2477 1 161 LEU H 1 161 LEU QB 2.790 . 3.780 2.582 2.545 2.618 . 0 0 "[ . 1 . 2]" 1
2478 1 161 LEU H 1 161 LEU MD1 4.085 . 6.370 4.632 4.562 4.678 . 0 0 "[ . 1 . 2]" 1
2479 1 161 LEU H 1 161 LEU MD2 4.085 . 6.370 4.254 4.186 4.321 . 0 0 "[ . 1 . 2]" 1
2480 1 161 LEU H 1 161 LEU QD 3.835 . 5.870 3.933 3.903 3.974 . 0 0 "[ . 1 . 2]" 1
2481 1 161 LEU H 1 164 LYS H 2.455 . 3.110 3.025 2.903 3.130 0.020 7 0 "[ . 1 . 2]" 1
2482 1 161 LEU H 1 165 PRO HA 2.780 . 3.760 3.793 3.642 3.822 0.062 7 0 "[ . 1 . 2]" 1
2483 1 161 LEU H 1 166 LEU H 2.955 . 4.110 4.051 3.910 4.133 0.023 19 0 "[ . 1 . 2]" 1
2484 1 161 LEU H 1 166 LEU HG 3.140 . 4.480 4.348 4.115 4.511 0.031 15 0 "[ . 1 . 2]" 1
2485 1 161 LEU H 1 166 LEU QD 4.430 . 7.060 2.416 2.138 2.715 . 0 0 "[ . 1 . 2]" 1
2486 1 161 LEU HA 1 161 LEU HB2 2.395 . 2.990 2.425 2.403 2.464 . 0 0 "[ . 1 . 2]" 1
2487 1 161 LEU HA 1 161 LEU HB3 2.395 . 2.990 3.003 3.000 3.008 0.018 6 0 "[ . 1 . 2]" 1
2488 1 161 LEU HA 1 161 LEU MD1 3.095 . 4.390 2.938 2.724 3.083 . 0 0 "[ . 1 . 2]" 1
2489 1 161 LEU HA 1 161 LEU MD2 3.095 . 4.390 3.816 3.759 3.882 . 0 0 "[ . 1 . 2]" 1
2490 1 161 LEU HA 1 161 LEU QD 2.785 . 3.770 2.844 2.673 2.950 . 0 0 "[ . 1 . 2]" 1
2491 1 161 LEU HA 1 162 GLU H 2.580 . 3.360 2.121 2.094 2.156 . 0 0 "[ . 1 . 2]" 1
2492 1 161 LEU HG 1 162 GLU QG 3.165 . 4.530 3.993 3.708 4.133 . 0 0 "[ . 1 . 2]" 1
2493 1 161 LEU MD1 1 162 GLU QG 4.575 . 7.350 4.919 4.721 5.206 . 0 0 "[ . 1 . 2]" 1
2494 1 161 LEU MD2 1 162 GLU QG 4.575 . 7.350 3.516 2.479 3.985 . 0 0 "[ . 1 . 2]" 1
2495 1 161 LEU QD 1 162 GLU QG 4.085 . 6.370 3.434 2.470 3.827 . 0 0 "[ . 1 . 2]" 1
2496 1 162 GLU H 1 162 GLU QG 4.095 . 6.390 3.973 3.804 4.197 . 0 0 "[ . 1 . 2]" 1
2497 1 162 GLU H 1 163 GLY H 2.875 . 3.950 2.739 2.643 2.892 . 0 0 "[ . 1 . 2]" 1
2498 1 162 GLU QG 1 163 GLY H 4.095 . 6.390 4.639 3.724 5.000 . 0 0 "[ . 1 . 2]" 1
2499 1 163 GLY H 1 164 LYS H 2.640 . 3.480 2.544 2.476 2.640 . 0 0 "[ . 1 . 2]" 1
2500 1 163 GLY HA3 1 164 LYS H 2.520 . 3.240 3.276 3.250 3.294 0.054 9 0 "[ . 1 . 2]" 1
2501 1 163 GLY HA2 1 164 LYS H 2.520 . 3.240 3.308 3.289 3.332 0.092 6 0 "[ . 1 . 2]" 1
2502 1 164 LYS H 1 164 LYS QB 2.755 . 3.710 2.351 2.244 2.546 . 0 0 "[ . 1 . 2]" 1
2503 1 164 LYS H 1 164 LYS QE 4.095 . 6.390 4.884 3.107 5.758 . 0 0 "[ . 1 . 2]" 1
2504 1 164 LYS H 1 165 PRO HD2 3.650 . 5.500 5.058 4.751 5.283 . 0 0 "[ . 1 . 2]" 1
2505 1 164 LYS H 1 165 PRO HD3 3.650 . 5.500 4.707 4.333 5.134 . 0 0 "[ . 1 . 2]" 1
2506 1 164 LYS H 1 166 LEU QD 4.695 . 7.590 4.652 4.338 4.832 . 0 0 "[ . 1 . 2]" 1
2507 1 164 LYS HA 1 164 LYS HG2 2.750 . 3.700 2.992 2.038 3.627 . 0 0 "[ . 1 . 2]" 1
2508 1 164 LYS HA 1 164 LYS HG3 2.750 . 3.700 2.594 2.076 3.677 . 0 0 "[ . 1 . 2]" 1
2509 1 164 LYS HA 1 164 LYS QG 2.650 . 3.500 2.218 2.021 2.674 . 0 0 "[ . 1 . 2]" 1
2510 1 164 LYS HA 1 164 LYS QE 4.095 . 6.390 3.944 2.194 4.779 . 0 0 "[ . 1 . 2]" 1
2511 1 164 LYS HA 1 165 PRO HG2 3.155 . 4.510 4.426 4.244 4.536 0.026 9 0 "[ . 1 . 2]" 1
2512 1 164 LYS HA 1 165 PRO HG3 3.155 . 4.510 4.334 4.161 4.527 0.017 4 0 "[ . 1 . 2]" 1
2513 1 164 LYS HA 1 165 PRO QG 3.045 . 4.290 3.892 3.831 3.933 . 0 0 "[ . 1 . 2]" 1
2514 1 164 LYS HA 1 165 PRO HD2 2.240 . 2.680 2.415 2.064 2.648 . 0 0 "[ . 1 . 2]" 1
2515 1 164 LYS HA 1 165 PRO HD3 2.240 . 2.680 2.222 1.979 2.625 . 0 0 "[ . 1 . 2]" 1
2516 1 164 LYS HB2 1 165 PRO HD2 3.725 . 5.650 4.485 3.912 4.949 . 0 0 "[ . 1 . 2]" 1
2517 1 164 LYS HB2 1 165 PRO HD3 3.725 . 5.650 4.925 4.464 5.268 . 0 0 "[ . 1 . 2]" 1
2518 1 164 LYS HB3 1 165 PRO HD2 3.725 . 5.650 3.415 2.484 4.207 . 0 0 "[ . 1 . 2]" 1
2519 1 164 LYS HB3 1 165 PRO HD3 3.725 . 5.650 4.297 3.857 4.851 . 0 0 "[ . 1 . 2]" 1
2520 1 164 LYS QB 1 165 PRO QD 3.210 . 4.620 3.127 2.433 3.627 . 0 0 "[ . 1 . 2]" 1
2521 1 164 LYS HG2 1 165 PRO HD2 4.000 . 6.200 3.673 1.986 4.552 . 0 0 "[ . 1 . 2]" 1
2522 1 164 LYS HG2 1 165 PRO HD3 4.000 . 6.200 4.609 3.097 5.338 . 0 0 "[ . 1 . 2]" 1
2523 1 164 LYS HG3 1 165 PRO HD2 4.000 . 6.200 3.537 2.423 4.803 . 0 0 "[ . 1 . 2]" 1
2524 1 164 LYS HG3 1 165 PRO HD3 4.000 . 6.200 4.281 3.173 6.074 . 0 0 "[ . 1 . 2]" 1
2525 1 164 LYS QG 1 165 PRO QD 3.315 . 4.830 2.845 1.890 3.639 . 0 0 "[ . 1 . 2]" 1
2526 1 165 PRO HA 1 166 LEU H 2.455 . 3.110 2.171 2.145 2.193 . 0 0 "[ . 1 . 2]" 1
2527 1 165 PRO HB2 1 166 LEU H 2.780 . 3.760 3.624 3.343 3.799 0.039 15 0 "[ . 1 . 2]" 1
2528 1 165 PRO HB3 1 166 LEU H 2.780 . 3.760 3.474 3.232 3.801 0.041 5 0 "[ . 1 . 2]" 1
2529 1 165 PRO QB 1 166 LEU H 2.655 . 3.510 3.124 3.052 3.182 . 0 0 "[ . 1 . 2]" 1
2530 1 166 LEU H 1 166 LEU QD 4.695 . 7.590 3.364 3.132 3.609 . 0 0 "[ . 1 . 2]" 1
2531 1 166 LEU HA 1 166 LEU MD1 2.755 . 3.710 2.834 2.227 3.222 . 0 0 "[ . 1 . 2]" 1
2532 1 166 LEU HA 1 166 LEU MD2 2.755 . 3.710 2.588 1.936 3.204 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 92
_Distance_constraint_stats_list.Viol_count 528
_Distance_constraint_stats_list.Viol_total 536.956
_Distance_constraint_stats_list.Viol_max 0.164
_Distance_constraint_stats_list.Viol_rms 0.0314
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0146
_Distance_constraint_stats_list.Viol_average_violations_only 0.0508
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 6 THR 2.565 0.138 14 0 "[ . 1 . 2]"
1 8 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 GLU 0.080 0.025 13 0 "[ . 1 . 2]"
1 11 VAL 0.041 0.037 7 0 "[ . 1 . 2]"
1 12 ILE 1.034 0.053 1 0 "[ . 1 . 2]"
1 13 LYS 0.008 0.006 11 0 "[ . 1 . 2]"
1 14 VAL 1.013 0.079 7 0 "[ . 1 . 2]"
1 15 PHE 0.300 0.047 10 0 "[ . 1 . 2]"
1 16 ASN 1.034 0.053 1 0 "[ . 1 . 2]"
1 17 ASP 0.008 0.006 11 0 "[ . 1 . 2]"
1 18 MET 0.933 0.079 7 0 "[ . 1 . 2]"
1 19 LYS 0.259 0.047 10 0 "[ . 1 . 2]"
1 32 ARG 0.013 0.009 3 0 "[ . 1 . 2]"
1 34 LYS 0.015 0.006 10 0 "[ . 1 . 2]"
1 35 ALA 1.150 0.066 12 0 "[ . 1 . 2]"
1 36 VAL 0.074 0.030 4 0 "[ . 1 . 2]"
1 37 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 PHE 2.213 0.106 3 0 "[ . 1 . 2]"
1 39 CYS 2.895 0.130 11 0 "[ . 1 . 2]"
1 40 LEU 0.031 0.011 15 0 "[ . 1 . 2]"
1 47 ILE 2.565 0.138 14 0 "[ . 1 . 2]"
1 48 ILE 2.895 0.130 11 0 "[ . 1 . 2]"
1 53 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 ILE 1.150 0.066 12 0 "[ . 1 . 2]"
1 57 VAL 0.013 0.009 3 0 "[ . 1 . 2]"
1 66 ASP 0.608 0.050 7 0 "[ . 1 . 2]"
1 67 PRO 0.998 0.061 13 0 "[ . 1 . 2]"
1 68 TYR 0.420 0.045 5 0 "[ . 1 . 2]"
1 69 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 ALA 3.265 0.164 6 0 "[ . 1 . 2]"
1 71 PHE 0.998 0.061 13 0 "[ . 1 . 2]"
1 72 VAL 0.420 0.045 5 0 "[ . 1 . 2]"
1 73 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 LEU 2.657 0.164 6 0 "[ . 1 . 2]"
1 75 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 ASP 2.147 0.117 14 0 "[ . 1 . 2]"
1 80 CYS 0.504 0.044 16 0 "[ . 1 . 2]"
1 81 ARG 1.606 0.083 4 0 "[ . 1 . 2]"
1 82 TYR 2.213 0.106 3 0 "[ . 1 . 2]"
1 83 ALA 0.022 0.008 5 0 "[ . 1 . 2]"
1 84 LEU 0.074 0.030 4 0 "[ . 1 . 2]"
1 85 TYR 0.069 0.024 13 0 "[ . 1 . 2]"
1 86 ASP 0.015 0.006 10 0 "[ . 1 . 2]"
1 87 ALA 2.229 0.123 15 0 "[ . 1 . 2]"
1 98 ASP 2.229 0.123 15 0 "[ . 1 . 2]"
1 100 VAL 0.069 0.024 13 0 "[ . 1 . 2]"
1 101 PHE 0.002 0.002 19 0 "[ . 1 . 2]"
1 102 ILE 0.022 0.008 5 0 "[ . 1 . 2]"
1 103 PHE 2.350 0.098 16 0 "[ . 1 . 2]"
1 104 TRP 3.753 0.117 14 0 "[ . 1 . 2]"
1 105 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 SER 0.504 0.044 16 0 "[ . 1 . 2]"
1 117 TYR 0.031 0.011 15 0 "[ . 1 . 2]"
1 120 SER 1.451 0.067 1 0 "[ . 1 . 2]"
1 121 LYS 0.194 0.075 11 0 "[ . 1 . 2]"
1 124 ILE 1.451 0.067 1 0 "[ . 1 . 2]"
1 125 LYS 0.194 0.075 11 0 "[ . 1 . 2]"
1 128 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 131 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 133 HIS 0.002 0.002 19 0 "[ . 1 . 2]"
1 135 TRP 2.350 0.098 16 0 "[ . 1 . 2]"
1 137 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 140 LEU 0.278 0.029 8 0 "[ . 1 . 2]"
1 143 ILE 0.278 0.029 8 0 "[ . 1 . 2]"
1 145 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 147 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 148 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 151 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 159 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 166 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 6 THR O 1 47 ILE N 3.000 2.700 3.300 2.572 2.562 2.582 0.138 14 0 "[ . 1 . 2]" 2
2 1 6 THR O 1 47 ILE H 2.000 . 2.300 1.788 1.772 1.814 . 0 0 "[ . 1 . 2]" 2
3 1 8 ASN O 1 11 VAL N 3.000 2.700 3.300 2.754 2.710 2.817 . 0 0 "[ . 1 . 2]" 2
4 1 8 ASN O 1 11 VAL H 2.000 . 2.300 1.884 1.818 1.970 . 0 0 "[ . 1 . 2]" 2
5 1 9 ASP O 1 12 ILE N 3.000 2.700 3.300 2.833 2.792 2.872 . 0 0 "[ . 1 . 2]" 2
6 1 9 ASP O 1 12 ILE H 2.000 . 2.300 2.049 1.990 2.097 . 0 0 "[ . 1 . 2]" 2
7 1 10 GLU O 1 14 VAL N 3.000 2.700 3.300 3.047 2.837 3.174 . 0 0 "[ . 1 . 2]" 2
8 1 10 GLU O 1 14 VAL H 2.000 . 2.300 2.206 1.972 2.325 0.025 13 0 "[ . 1 . 2]" 2
9 1 11 VAL O 1 15 PHE N 3.000 2.700 3.300 3.031 2.936 3.165 . 0 0 "[ . 1 . 2]" 2
10 1 11 VAL O 1 15 PHE H 2.000 . 2.300 2.235 2.125 2.337 0.037 7 0 "[ . 1 . 2]" 2
11 1 12 ILE O 1 16 ASN N 3.000 2.700 3.300 2.664 2.647 2.676 0.053 1 0 "[ . 1 . 2]" 2
12 1 12 ILE O 1 16 ASN H 2.000 . 2.300 1.684 1.667 1.695 0.033 1 0 "[ . 1 . 2]" 2
13 1 13 LYS O 1 17 ASP N 3.000 2.700 3.300 2.990 2.890 3.053 . 0 0 "[ . 1 . 2]" 2
14 1 13 LYS O 1 17 ASP H 2.000 . 2.300 2.242 2.109 2.306 0.006 11 0 "[ . 1 . 2]" 2
15 1 14 VAL O 1 18 MET N 3.000 2.700 3.300 2.654 2.621 2.691 0.079 7 0 "[ . 1 . 2]" 2
16 1 14 VAL O 1 18 MET H 2.000 . 2.300 1.731 1.690 1.757 0.010 7 0 "[ . 1 . 2]" 2
17 1 15 PHE O 1 19 LYS N 3.000 2.700 3.300 2.700 2.653 2.766 0.047 10 0 "[ . 1 . 2]" 2
18 1 15 PHE O 1 19 LYS H 2.000 . 2.300 2.002 1.949 2.054 . 0 0 "[ . 1 . 2]" 2
19 1 32 ARG O 1 57 VAL N 2.550 . 3.300 3.158 3.091 3.215 . 0 0 "[ . 1 . 2]" 2
20 1 32 ARG O 1 57 VAL H 2.050 . 2.300 2.274 2.206 2.309 0.009 3 0 "[ . 1 . 2]" 2
21 1 34 LYS O 1 86 ASP N 3.000 2.700 3.300 2.772 2.694 2.876 0.006 10 0 "[ . 1 . 2]" 2
22 1 34 LYS O 1 86 ASP H 2.000 . 2.300 1.858 1.774 2.078 . 0 0 "[ . 1 . 2]" 2
23 1 35 ALA O 1 55 ILE N 3.000 2.700 3.300 2.652 2.634 2.660 0.066 12 0 "[ . 1 . 2]" 2
24 1 35 ALA O 1 55 ILE H 2.000 . 2.300 1.692 1.678 1.718 0.022 12 0 "[ . 1 . 2]" 2
25 1 36 VAL O 1 84 LEU N 3.000 2.700 3.300 2.730 2.670 2.784 0.030 4 0 "[ . 1 . 2]" 2
26 1 36 VAL O 1 84 LEU H 2.000 . 2.300 1.864 1.785 1.942 . 0 0 "[ . 1 . 2]" 2
27 1 38 PHE O 1 82 TYR N 3.000 2.700 3.300 3.329 3.308 3.358 0.058 11 0 "[ . 1 . 2]" 2
28 1 38 PHE O 1 82 TYR H 2.000 . 2.300 2.382 2.346 2.406 0.106 3 0 "[ . 1 . 2]" 2
29 1 39 CYS O 1 48 ILE N 3.000 2.700 3.300 2.585 2.570 2.594 0.130 11 0 "[ . 1 . 2]" 2
30 1 39 CYS O 1 48 ILE H 2.000 . 2.300 1.671 1.634 1.711 0.066 4 0 "[ . 1 . 2]" 2
31 1 37 LEU N 1 53 LYS O 3.000 2.700 3.300 3.036 2.916 3.104 . 0 0 "[ . 1 . 2]" 2
32 1 37 LEU H 1 53 LYS O 2.000 . 2.300 2.144 1.994 2.230 . 0 0 "[ . 1 . 2]" 2
33 1 35 ALA N 1 55 ILE O 3.000 2.700 3.300 2.783 2.709 2.834 . 0 0 "[ . 1 . 2]" 2
34 1 35 ALA H 1 55 ILE O 2.000 . 2.300 1.957 1.839 2.025 . 0 0 "[ . 1 . 2]" 2
35 1 66 ASP O 1 70 ALA N 3.000 2.700 3.300 3.171 3.088 3.198 . 0 0 "[ . 1 . 2]" 2
36 1 66 ASP O 1 70 ALA H 2.000 . 2.300 2.323 2.189 2.350 0.050 7 0 "[ . 1 . 2]" 2
37 1 67 PRO O 1 71 PHE N 3.000 2.700 3.300 3.218 3.202 3.225 . 0 0 "[ . 1 . 2]" 2
38 1 67 PRO O 1 71 PHE H 2.000 . 2.300 2.350 2.339 2.361 0.061 13 0 "[ . 1 . 2]" 2
39 1 68 TYR O 1 72 VAL N 3.000 2.700 3.300 2.679 2.655 2.702 0.045 5 0 "[ . 1 . 2]" 2
40 1 68 TYR O 1 72 VAL H 2.000 . 2.300 1.748 1.734 1.762 . 0 0 "[ . 1 . 2]" 2
41 1 69 THR O 1 73 LYS N 3.000 2.700 3.300 2.881 2.810 2.975 . 0 0 "[ . 1 . 2]" 2
42 1 69 THR O 1 73 LYS H 2.000 . 2.300 2.118 2.082 2.167 . 0 0 "[ . 1 . 2]" 2
43 1 70 ALA O 1 74 LEU N 3.000 2.700 3.300 3.279 3.243 3.318 0.018 5 0 "[ . 1 . 2]" 2
44 1 70 ALA O 1 74 LEU H 2.000 . 2.300 2.431 2.400 2.464 0.164 6 0 "[ . 1 . 2]" 2
45 1 71 PHE O 1 75 LEU N 3.000 2.700 3.300 2.925 2.826 3.024 . 0 0 "[ . 1 . 2]" 2
46 1 71 PHE O 1 75 LEU H 2.000 . 2.300 1.997 1.919 2.093 . 0 0 "[ . 1 . 2]" 2
47 1 79 ASP O 1 104 TRP NE1 3.000 2.700 3.300 2.991 2.956 3.021 . 0 0 "[ . 1 . 2]" 2
48 1 79 ASP O 1 104 TRP HE1 2.000 . 2.300 2.407 2.390 2.417 0.117 14 0 "[ . 1 . 2]" 2
49 1 81 ARG O 1 104 TRP N 3.000 2.700 3.300 2.634 2.617 2.668 0.083 4 0 "[ . 1 . 2]" 2
50 1 81 ARG O 1 104 TRP H 2.000 . 2.300 1.815 1.799 1.840 . 0 0 "[ . 1 . 2]" 2
51 1 83 ALA O 1 102 ILE N 3.000 2.700 3.300 2.733 2.692 2.808 0.008 5 0 "[ . 1 . 2]" 2
52 1 83 ALA O 1 102 ILE H 2.000 . 2.300 1.815 1.784 1.884 . 0 0 "[ . 1 . 2]" 2
53 1 36 VAL N 1 84 LEU O 3.000 2.700 3.300 2.869 2.722 2.962 . 0 0 "[ . 1 . 2]" 2
54 1 36 VAL H 1 84 LEU O 2.000 . 2.300 2.021 1.811 2.137 . 0 0 "[ . 1 . 2]" 2
55 1 85 TYR O 1 100 VAL N 3.000 2.700 3.300 2.827 2.771 2.869 . 0 0 "[ . 1 . 2]" 2
56 1 85 TYR O 1 100 VAL H 2.000 . 2.300 1.863 1.806 1.902 . 0 0 "[ . 1 . 2]" 2
57 1 87 ALA O 1 98 ASP N 3.000 2.700 3.300 3.169 3.086 3.220 . 0 0 "[ . 1 . 2]" 2
58 1 87 ALA O 1 98 ASP H 2.000 . 2.300 2.258 2.168 2.315 0.015 3 0 "[ . 1 . 2]" 2
59 1 87 ALA N 1 98 ASP O 3.000 2.700 3.300 2.589 2.577 2.603 0.123 15 0 "[ . 1 . 2]" 2
60 1 87 ALA H 1 98 ASP O 2.000 . 2.300 1.923 1.883 1.944 . 0 0 "[ . 1 . 2]" 2
61 1 85 TYR N 1 100 VAL O 3.000 2.700 3.300 3.222 3.176 3.276 . 0 0 "[ . 1 . 2]" 2
62 1 85 TYR H 1 100 VAL O 2.000 . 2.300 2.267 2.216 2.324 0.024 13 0 "[ . 1 . 2]" 2
63 1 83 ALA N 1 102 ILE O 3.000 2.700 3.300 2.875 2.786 3.115 . 0 0 "[ . 1 . 2]" 2
64 1 83 ALA H 1 102 ILE O 2.000 . 2.300 1.934 1.838 2.158 . 0 0 "[ . 1 . 2]" 2
65 1 103 PHE O 1 137 VAL N 3.000 2.700 3.300 3.062 3.037 3.079 . 0 0 "[ . 1 . 2]" 2
66 1 103 PHE O 1 137 VAL H 2.000 . 2.300 2.162 2.134 2.176 . 0 0 "[ . 1 . 2]" 2
67 1 81 ARG N 1 104 TRP O 3.000 2.700 3.300 2.688 2.654 2.724 0.046 6 0 "[ . 1 . 2]" 2
68 1 81 ARG H 1 104 TRP O 2.000 . 2.300 1.786 1.753 1.918 . 0 0 "[ . 1 . 2]" 2
69 1 80 CYS N 1 113 SER OG 3.000 2.700 3.300 3.273 3.210 3.300 . 0 0 "[ . 1 . 2]" 2
70 1 80 CYS H 1 113 SER OG 2.000 . 2.300 2.324 2.282 2.344 0.044 16 0 "[ . 1 . 2]" 2
71 1 40 LEU N 1 117 TYR OH 3.000 2.700 3.300 2.931 2.696 3.073 0.004 3 0 "[ . 1 . 2]" 2
72 1 40 LEU H 1 117 TYR OH 2.000 . 2.300 2.188 1.908 2.311 0.011 15 0 "[ . 1 . 2]" 2
73 1 120 SER O 1 124 ILE N 3.000 2.700 3.300 2.651 2.633 2.678 0.067 1 0 "[ . 1 . 2]" 2
74 1 120 SER O 1 124 ILE H 2.000 . 2.300 1.677 1.660 1.712 0.040 1 0 "[ . 1 . 2]" 2
75 1 121 LYS O 1 125 LYS N 3.000 2.700 3.300 3.041 2.941 3.130 . 0 0 "[ . 1 . 2]" 2
76 1 121 LYS O 1 125 LYS H 2.000 . 2.300 2.279 2.157 2.375 0.075 11 0 "[ . 1 . 2]" 2
77 1 128 PHE O 1 131 ILE N 3.000 2.700 3.300 2.873 2.827 2.940 . 0 0 "[ . 1 . 2]" 2
78 1 128 PHE O 1 131 ILE H 2.000 . 2.300 1.940 1.893 1.996 . 0 0 "[ . 1 . 2]" 2
79 1 101 PHE N 1 133 HIS O 3.000 2.700 3.300 3.207 2.822 3.262 . 0 0 "[ . 1 . 2]" 2
80 1 101 PHE H 1 133 HIS O 2.000 . 2.300 2.250 1.852 2.302 0.002 19 0 "[ . 1 . 2]" 2
81 1 103 PHE N 1 135 TRP O 3.000 2.700 3.300 2.613 2.602 2.622 0.098 16 0 "[ . 1 . 2]" 2
82 1 103 PHE H 1 135 TRP O 2.000 . 2.300 1.670 1.659 1.705 0.041 8 0 "[ . 1 . 2]" 2
83 1 105 ALA N 1 137 VAL O 3.000 2.700 3.300 2.944 2.908 2.988 . 0 0 "[ . 1 . 2]" 2
84 1 105 ALA H 1 137 VAL O 2.000 . 2.300 2.002 1.960 2.051 . 0 0 "[ . 1 . 2]" 2
85 1 140 LEU O 1 143 ILE N 3.000 2.700 3.300 3.068 2.671 3.176 0.029 8 0 "[ . 1 . 2]" 2
86 1 140 LEU O 1 143 ILE H 2.000 . 2.300 2.208 1.783 2.325 0.025 3 0 "[ . 1 . 2]" 2
87 1 145 ASP O 1 148 THR N 3.000 2.700 3.300 2.796 2.752 2.881 . 0 0 "[ . 1 . 2]" 2
88 1 145 ASP O 1 148 THR H 2.000 . 2.300 2.104 2.020 2.204 . 0 0 "[ . 1 . 2]" 2
89 1 147 SER O 1 151 GLU N 3.000 2.700 3.300 2.892 2.777 3.010 . 0 0 "[ . 1 . 2]" 2
90 1 147 SER O 1 151 GLU H 2.000 . 2.300 2.103 2.014 2.208 . 0 0 "[ . 1 . 2]" 2
91 1 159 VAL O 1 166 LEU N 3.000 2.700 3.300 2.928 2.746 3.045 . 0 0 "[ . 1 . 2]" 2
92 1 159 VAL O 1 166 LEU H 2.000 . 2.300 1.958 1.772 2.090 . 0 0 "[ . 1 . 2]" 2
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