NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
451972 |
2rq0   |
11062 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2rq0
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 913
_Distance_constraint_stats_list.Viol_count 1237
_Distance_constraint_stats_list.Viol_total 736.433
_Distance_constraint_stats_list.Viol_max 0.362
_Distance_constraint_stats_list.Viol_rms 0.0342
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0081
_Distance_constraint_stats_list.Viol_average_violations_only 0.0595
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 SER 0.000 0.000 . 0 "[ . 1]"
1 3 GLN 0.000 0.000 . 0 "[ . 1]"
1 4 GLY 0.000 0.000 . 0 "[ . 1]"
1 5 HIS 0.007 0.007 6 0 "[ . 1]"
1 6 ASP 0.312 0.060 6 0 "[ . 1]"
1 7 THR 0.405 0.090 10 0 "[ . 1]"
1 8 VAL 4.451 0.166 3 0 "[ . 1]"
1 9 GLN 2.584 0.166 3 0 "[ . 1]"
1 10 PRO 0.000 0.000 . 0 "[ . 1]"
1 11 ASN 0.024 0.006 2 0 "[ . 1]"
1 12 PHE 1.527 0.150 6 0 "[ . 1]"
1 13 GLN 1.495 0.150 6 0 "[ . 1]"
1 14 GLN 0.038 0.010 10 0 "[ . 1]"
1 15 ASP 0.147 0.018 1 0 "[ . 1]"
1 16 LYS 0.038 0.010 5 0 "[ . 1]"
1 17 PHE 0.320 0.064 9 0 "[ . 1]"
1 18 LEU 0.183 0.034 9 0 "[ . 1]"
1 19 GLY 0.285 0.038 1 0 "[ . 1]"
1 20 ARG 0.041 0.023 2 0 "[ . 1]"
1 21 TRP 0.062 0.014 7 0 "[ . 1]"
1 22 TYR 0.225 0.034 7 0 "[ . 1]"
1 23 SER 0.296 0.035 10 0 "[ . 1]"
1 24 ALA 0.137 0.023 3 0 "[ . 1]"
1 25 GLY 0.687 0.064 7 0 "[ . 1]"
1 26 LEU 0.018 0.012 2 0 "[ . 1]"
1 27 ALA 0.143 0.043 8 0 "[ . 1]"
1 28 SER 0.001 0.001 2 0 "[ . 1]"
1 29 ASN 0.090 0.042 8 0 "[ . 1]"
1 30 SER 0.000 0.000 . 0 "[ . 1]"
1 31 SER 0.007 0.007 6 0 "[ . 1]"
1 32 TRP 0.000 0.000 . 0 "[ . 1]"
1 33 PHE 0.000 0.000 . 0 "[ . 1]"
1 34 ARG 0.007 0.007 6 0 "[ . 1]"
1 35 GLU 0.250 0.029 8 0 "[ . 1]"
1 36 LYS 0.219 0.029 8 0 "[ . 1]"
1 37 LYS 0.553 0.049 7 0 "[ . 1]"
1 38 ALA 0.869 0.049 7 0 "[ . 1]"
1 39 VAL 2.192 0.177 4 0 "[ . 1]"
1 40 LEU 0.025 0.009 9 0 "[ . 1]"
1 41 TYR 0.009 0.009 9 0 "[ . 1]"
1 42 MET 0.721 0.091 3 0 "[ . 1]"
1 43 ALA 3.525 0.362 9 0 "[ . 1]"
1 44 LYS 1.053 0.107 4 0 "[ . 1]"
1 45 THR 0.092 0.027 7 0 "[ . 1]"
1 46 VAL 0.210 0.038 1 0 "[ . 1]"
1 47 VAL 3.729 0.332 8 0 "[ . 1]"
1 48 ALA 0.000 0.000 . 0 "[ . 1]"
1 49 PRO 0.000 0.000 . 0 "[ . 1]"
1 50 SER 2.280 0.225 7 0 "[ . 1]"
1 51 THR 5.850 0.323 10 0 "[ . 1]"
1 52 GLU 4.486 0.323 10 0 "[ . 1]"
1 53 GLY 0.728 0.086 8 0 "[ . 1]"
1 54 GLY 0.272 0.044 7 0 "[ . 1]"
1 55 LEU 0.032 0.010 2 0 "[ . 1]"
1 56 ASN 0.173 0.025 7 0 "[ . 1]"
1 57 LEU 3.175 0.332 8 0 "[ . 1]"
1 58 THR 0.046 0.009 9 0 "[ . 1]"
1 59 SER 0.000 0.000 . 0 "[ . 1]"
1 60 THR 2.402 0.132 4 0 "[ . 1]"
1 61 PHE 4.818 0.362 9 0 "[ . 1]"
1 62 LEU 0.018 0.015 3 0 "[ . 1]"
1 63 ARG 1.078 0.091 3 0 "[ . 1]"
1 64 LYS 1.159 0.121 8 0 "[ . 1]"
1 65 ASN 1.589 0.121 8 0 "[ . 1]"
1 66 GLN 2.051 0.114 6 0 "[ . 1]"
1 67 CYS 0.038 0.028 3 0 "[ . 1]"
1 68 GLU 0.000 0.000 . 0 "[ . 1]"
1 69 THR 0.350 0.051 3 0 "[ . 1]"
1 70 LYS 0.267 0.051 3 0 "[ . 1]"
1 71 ILE 0.000 0.000 . 0 "[ . 1]"
1 72 MET 0.000 0.000 . 0 "[ . 1]"
1 73 VAL 0.124 0.023 8 0 "[ . 1]"
1 74 LEU 0.164 0.026 3 0 "[ . 1]"
1 75 GLN 0.020 0.007 7 0 "[ . 1]"
1 76 PRO 0.000 0.000 . 0 "[ . 1]"
1 77 ALA 0.012 0.003 3 0 "[ . 1]"
1 78 GLY 0.012 0.003 1 0 "[ . 1]"
1 79 ALA 0.005 0.003 1 0 "[ . 1]"
1 80 PRO 0.033 0.008 6 0 "[ . 1]"
1 81 GLY 0.003 0.003 5 0 "[ . 1]"
1 82 HIS 0.035 0.008 6 0 "[ . 1]"
1 83 TYR 0.009 0.004 5 0 "[ . 1]"
1 84 THR 0.026 0.007 7 0 "[ . 1]"
1 85 TYR 0.114 0.026 3 0 "[ . 1]"
1 86 SER 0.020 0.008 7 0 "[ . 1]"
1 87 SER 0.207 0.035 8 0 "[ . 1]"
1 88 PRO 0.011 0.011 3 0 "[ . 1]"
1 89 HIS 0.011 0.011 3 0 "[ . 1]"
1 90 SER 0.000 0.000 . 0 "[ . 1]"
1 91 GLY 0.000 0.000 . 0 "[ . 1]"
1 92 SER 0.000 0.000 . 0 "[ . 1]"
1 93 ILE 0.020 0.008 7 0 "[ . 1]"
1 94 HIS 0.038 0.013 9 0 "[ . 1]"
1 95 SER 0.006 0.003 1 0 "[ . 1]"
1 96 VAL 0.008 0.004 8 0 "[ . 1]"
1 97 SER 0.003 0.003 7 0 "[ . 1]"
1 98 VAL 0.147 0.028 8 0 "[ . 1]"
1 99 VAL 0.157 0.038 9 0 "[ . 1]"
1 100 GLU 0.101 0.027 1 0 "[ . 1]"
1 101 ALA 0.088 0.014 9 0 "[ . 1]"
1 106 TYR 0.005 0.005 7 0 "[ . 1]"
1 107 ALA 0.088 0.014 9 0 "[ . 1]"
1 108 LEU 0.029 0.015 1 0 "[ . 1]"
1 109 LEU 0.071 0.010 8 0 "[ . 1]"
1 110 PHE 0.000 0.000 . 0 "[ . 1]"
1 111 SER 0.541 0.068 7 0 "[ . 1]"
1 112 ARG 0.051 0.008 4 0 "[ . 1]"
1 113 GLY 0.000 0.000 . 0 "[ . 1]"
1 114 THR 6.908 0.340 9 0 "[ . 1]"
1 115 LYS 5.264 0.340 9 0 "[ . 1]"
1 116 GLY 0.022 0.016 2 0 "[ . 1]"
1 117 PRO 0.022 0.012 6 0 "[ . 1]"
1 118 GLY 0.293 0.045 2 0 "[ . 1]"
1 119 GLN 3.020 0.218 7 0 "[ . 1]"
1 120 ASP 2.609 0.218 7 0 "[ . 1]"
1 121 PHE 0.217 0.045 4 0 "[ . 1]"
1 122 ARG 0.051 0.008 4 0 "[ . 1]"
1 123 MET 0.143 0.043 8 0 "[ . 1]"
1 124 ALA 0.531 0.068 7 0 "[ . 1]"
1 125 THR 0.028 0.009 1 0 "[ . 1]"
1 126 LEU 0.456 0.044 5 0 "[ . 1]"
1 127 TYR 0.774 0.064 7 0 "[ . 1]"
1 128 SER 0.182 0.024 7 0 "[ . 1]"
1 129 ARG 0.003 0.003 3 0 "[ . 1]"
1 130 THR 0.018 0.015 6 0 "[ . 1]"
1 131 GLN 0.515 0.103 6 0 "[ . 1]"
1 132 THR 2.583 0.183 6 0 "[ . 1]"
1 133 LEU 3.005 0.152 2 0 "[ . 1]"
1 134 LYS 6.607 0.318 8 0 "[ . 1]"
1 135 ASP 1.757 0.152 6 0 "[ . 1]"
1 136 GLU 7.399 0.318 8 0 "[ . 1]"
1 137 LEU 2.238 0.125 5 0 "[ . 1]"
1 138 LYS 3.152 0.294 4 0 "[ . 1]"
1 139 GLU 1.215 0.125 5 0 "[ . 1]"
1 140 LYS 0.710 0.072 1 0 "[ . 1]"
1 141 PHE 1.853 0.105 10 0 "[ . 1]"
1 142 THR 0.785 0.105 10 0 "[ . 1]"
1 143 THR 0.751 0.075 1 0 "[ . 1]"
1 144 PHE 1.736 0.079 6 0 "[ . 1]"
1 145 SER 1.047 0.079 6 0 "[ . 1]"
1 146 LYS 0.570 0.055 10 0 "[ . 1]"
1 147 ALA 1.532 0.061 6 0 "[ . 1]"
1 148 GLN 1.064 0.061 6 0 "[ . 1]"
1 149 GLY 0.323 0.040 7 0 "[ . 1]"
1 150 LEU 0.065 0.035 6 0 "[ . 1]"
1 151 THR 1.701 0.106 5 0 "[ . 1]"
1 152 GLU 0.867 0.083 1 0 "[ . 1]"
1 153 GLU 0.260 0.029 7 0 "[ . 1]"
1 154 ASP 0.251 0.029 7 0 "[ . 1]"
1 155 ILE 0.029 0.012 7 0 "[ . 1]"
1 156 VAL 0.671 0.172 5 0 "[ . 1]"
1 157 PHE 0.674 0.072 2 0 "[ . 1]"
1 158 LEU 0.652 0.072 2 0 "[ . 1]"
1 161 PRO 0.000 0.000 . 0 "[ . 1]"
1 162 ASP 0.426 0.126 1 0 "[ . 1]"
1 163 LYS 0.547 0.126 1 0 "[ . 1]"
1 164 CYS 0.665 0.108 2 0 "[ . 1]"
1 165 ILE 0.719 0.125 2 0 "[ . 1]"
1 166 GLN 0.906 0.125 2 0 "[ . 1]"
1 167 GLU 0.027 0.006 8 0 "[ . 1]"
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 2 SER HA 1 3 GLN H 3.400 . 3.400 2.391 2.141 2.963 . 0 0 "[ . 1]" 1
2 1 3 GLN H 1 3 GLN QB 3.400 . 4.000 2.944 2.331 3.307 . 0 0 "[ . 1]" 1
3 1 3 GLN H 1 3 GLN QG 4.200 . 5.200 3.422 2.378 4.000 . 0 0 "[ . 1]" 1
4 1 3 GLN HA 1 4 GLY H 2.800 . 2.800 2.299 2.151 2.531 . 0 0 "[ . 1]" 1
5 1 3 GLN QB 1 4 GLY H 4.200 . 5.200 3.137 2.206 3.934 . 0 0 "[ . 1]" 1
6 1 4 GLY H 1 4 GLY QA 2.800 . 2.800 2.400 2.213 2.503 . 0 0 "[ . 1]" 1
7 1 4 GLY QA 1 5 HIS H 2.800 . 3.800 2.408 2.110 2.756 . 0 0 "[ . 1]" 1
8 1 4 GLY QA 1 6 ASP H 4.200 . 5.200 4.264 3.280 5.022 . 0 0 "[ . 1]" 1
9 1 5 HIS H 1 5 HIS QB 2.800 . 3.400 2.932 2.204 3.362 . 0 0 "[ . 1]" 1
10 1 5 HIS H 1 6 ASP H 3.400 . 3.400 2.644 1.966 3.407 0.007 6 0 "[ . 1]" 1
11 1 5 HIS QB 1 6 ASP H 3.400 . 4.400 3.373 2.031 4.000 . 0 0 "[ . 1]" 1
12 1 6 ASP H 1 6 ASP HA 2.800 . 2.800 2.723 2.273 2.860 0.060 6 0 "[ . 1]" 1
13 1 6 ASP H 1 6 ASP QB 2.800 . 3.400 2.946 2.181 3.346 . 0 0 "[ . 1]" 1
14 1 6 ASP H 1 7 THR H 4.200 . 4.200 3.529 2.119 4.204 0.004 5 0 "[ . 1]" 1
15 1 6 ASP H 1 7 THR MG 6.000 . 7.000 5.843 4.904 6.179 . 0 0 "[ . 1]" 1
16 1 6 ASP HA 1 7 THR H 2.800 . 2.800 2.342 2.138 2.820 0.020 1 0 "[ . 1]" 1
17 1 6 ASP QB 1 7 THR H 3.400 . 4.400 3.652 3.041 3.988 . 0 0 "[ . 1]" 1
18 1 7 THR H 1 7 THR HA 2.800 . 2.800 2.835 2.795 2.890 0.090 10 0 "[ . 1]" 1
19 1 7 THR H 1 7 THR HB 2.800 . 2.800 2.703 2.528 2.826 0.026 10 0 "[ . 1]" 1
20 1 7 THR H 1 7 THR MG 4.200 . 5.200 3.752 3.699 3.923 . 0 0 "[ . 1]" 1
21 1 7 THR H 1 8 VAL H 3.400 . 3.400 2.568 2.154 2.761 . 0 0 "[ . 1]" 1
22 1 7 THR HB 1 8 VAL H 3.400 . 3.400 2.885 2.033 3.384 . 0 0 "[ . 1]" 1
23 1 7 THR MG 1 8 VAL H 4.200 . 5.200 3.875 3.164 4.170 . 0 0 "[ . 1]" 1
24 1 8 VAL H 1 8 VAL HA 2.800 . 2.800 2.902 2.898 2.904 0.104 6 0 "[ . 1]" 1
25 1 8 VAL H 1 8 VAL HB 2.800 . 2.800 2.893 2.877 2.913 0.113 9 0 "[ . 1]" 1
26 1 8 VAL H 1 9 GLN H 4.200 . 4.200 4.344 4.322 4.366 0.166 3 0 "[ . 1]" 1
27 1 8 VAL HA 1 9 GLN H 2.800 . 2.800 2.208 2.199 2.220 . 0 0 "[ . 1]" 1
28 1 8 VAL HA 1 99 VAL HA 2.800 . 2.800 2.592 2.215 2.807 0.007 10 0 "[ . 1]" 1
29 1 8 VAL HB 1 9 GLN H 3.400 . 3.400 3.505 3.490 3.518 0.118 9 0 "[ . 1]" 1
30 1 8 VAL QG 1 9 GLN H 4.200 . 6.600 2.062 1.928 2.211 . 0 0 "[ . 1]" 1
31 1 8 VAL QG 1 97 SER QB 5.000 . 7.400 2.840 1.800 4.064 . 0 0 "[ . 1]" 1
32 1 8 VAL QG 1 98 VAL H 6.000 . 8.400 3.465 2.867 3.910 . 0 0 "[ . 1]" 1
33 1 9 GLN H 1 99 VAL HA 2.800 . 2.800 2.735 2.203 2.838 0.038 9 0 "[ . 1]" 1
34 1 9 GLN QB 1 98 VAL QG 6.000 . 8.400 4.903 3.007 6.943 . 0 0 "[ . 1]" 1
35 1 10 PRO HA 1 11 ASN H 2.800 . 2.800 2.286 2.159 2.609 . 0 0 "[ . 1]" 1
36 1 10 PRO QB 1 11 ASN H 3.400 . 4.000 3.299 2.319 3.993 . 0 0 "[ . 1]" 1
37 1 11 ASN H 1 11 ASN HA 2.800 . 2.800 2.644 2.274 2.806 0.006 2 0 "[ . 1]" 1
38 1 11 ASN H 1 11 ASN QB 3.400 . 4.000 3.062 2.920 3.403 . 0 0 "[ . 1]" 1
39 1 11 ASN H 1 12 PHE H 3.400 . 3.400 3.070 2.171 3.404 0.004 7 0 "[ . 1]" 1
40 1 11 ASN H 1 12 PHE QB 4.200 . 5.200 4.153 3.847 4.441 . 0 0 "[ . 1]" 1
41 1 11 ASN HA 1 12 PHE H 2.800 . 2.800 2.384 2.214 2.736 . 0 0 "[ . 1]" 1
42 1 11 ASN QB 1 12 PHE H 4.200 . 5.200 3.928 3.696 4.026 . 0 0 "[ . 1]" 1
43 1 12 PHE H 1 12 PHE QD 4.200 . 4.200 3.561 2.319 4.226 0.026 10 0 "[ . 1]" 1
44 1 12 PHE H 1 13 GLN H 4.200 . 4.200 4.347 4.342 4.350 0.150 6 0 "[ . 1]" 1
45 1 12 PHE H 1 80 PRO QB 4.200 . 5.200 4.029 2.580 5.201 0.001 7 0 "[ . 1]" 1
46 1 12 PHE HA 1 13 GLN H 2.800 . 2.800 2.094 2.091 2.097 . 0 0 "[ . 1]" 1
47 1 12 PHE QB 1 13 GLN H 4.200 . 5.200 3.499 3.260 3.784 . 0 0 "[ . 1]" 1
48 1 12 PHE QD 1 13 GLN H 4.200 . 4.200 3.502 2.530 4.217 0.017 2 0 "[ . 1]" 1
49 1 13 GLN H 1 13 GLN QG 4.200 . 4.800 3.319 2.008 4.099 . 0 0 "[ . 1]" 1
50 1 13 GLN H 1 14 GLN H 5.000 . 5.000 4.530 4.437 4.610 . 0 0 "[ . 1]" 1
51 1 13 GLN HA 1 15 ASP H 4.200 . 4.200 4.092 3.813 4.203 0.003 2 0 "[ . 1]" 1
52 1 13 GLN QB 1 15 ASP H 4.200 . 5.200 2.767 2.381 3.200 . 0 0 "[ . 1]" 1
53 1 13 GLN QB 1 16 LYS H 4.200 . 5.200 2.805 2.433 3.733 . 0 0 "[ . 1]" 1
54 1 14 GLN H 1 14 GLN HA 2.800 . 2.800 2.786 2.752 2.810 0.010 10 0 "[ . 1]" 1
55 1 14 GLN H 1 14 GLN QB 2.800 . 3.400 2.385 2.152 2.583 . 0 0 "[ . 1]" 1
56 1 14 GLN H 1 15 ASP H 3.400 . 3.400 2.717 2.649 2.819 . 0 0 "[ . 1]" 1
57 1 14 GLN H 1 15 ASP QB 4.200 . 5.200 4.586 4.344 4.931 . 0 0 "[ . 1]" 1
58 1 14 GLN HA 1 14 GLN QB 2.800 . 2.800 2.352 2.178 2.504 . 0 0 "[ . 1]" 1
59 1 14 GLN HA 1 15 ASP H 4.200 . 4.200 3.513 3.488 3.528 . 0 0 "[ . 1]" 1
60 1 14 GLN HA 1 16 LYS H 4.200 . 4.200 4.176 4.034 4.206 0.006 6 0 "[ . 1]" 1
61 1 14 GLN HA 1 17 PHE H 4.200 . 4.200 3.371 3.136 3.550 . 0 0 "[ . 1]" 1
62 1 14 GLN QB 1 15 ASP H 3.400 . 4.400 2.941 2.619 3.516 . 0 0 "[ . 1]" 1
63 1 15 ASP H 1 15 ASP HA 2.800 . 2.800 2.805 2.786 2.818 0.018 1 0 "[ . 1]" 1
64 1 15 ASP H 1 15 ASP QB 2.800 . 3.400 2.272 2.102 2.567 . 0 0 "[ . 1]" 1
65 1 15 ASP H 1 16 LYS H 2.800 . 2.800 2.664 2.603 2.753 . 0 0 "[ . 1]" 1
66 1 15 ASP H 1 17 PHE H 4.200 . 4.200 4.100 3.960 4.202 0.002 2 0 "[ . 1]" 1
67 1 15 ASP H 1 18 LEU QD 4.200 . 6.600 4.664 3.221 6.050 . 0 0 "[ . 1]" 1
68 1 15 ASP HA 1 16 LYS H 4.200 . 4.200 3.516 3.495 3.535 . 0 0 "[ . 1]" 1
69 1 15 ASP HA 1 17 PHE H 4.200 . 4.200 4.099 3.900 4.203 0.003 3 0 "[ . 1]" 1
70 1 15 ASP HA 1 18 LEU H 3.400 . 3.400 3.367 3.194 3.417 0.017 6 0 "[ . 1]" 1
71 1 15 ASP QB 1 16 LYS H 4.200 . 5.200 2.864 2.622 3.472 . 0 0 "[ . 1]" 1
72 1 16 LYS H 1 16 LYS QB 3.400 . 4.000 2.212 2.047 2.445 . 0 0 "[ . 1]" 1
73 1 16 LYS H 1 17 PHE H 3.400 . 3.400 2.595 2.477 2.677 . 0 0 "[ . 1]" 1
74 1 16 LYS H 1 17 PHE QB 4.200 . 5.200 4.361 4.201 4.490 . 0 0 "[ . 1]" 1
75 1 16 LYS H 1 18 LEU H 4.200 . 4.200 4.080 3.916 4.210 0.010 5 0 "[ . 1]" 1
76 1 16 LYS HA 1 17 PHE H 4.200 . 4.200 3.494 3.467 3.517 . 0 0 "[ . 1]" 1
77 1 16 LYS HA 1 18 LEU H 4.200 . 4.200 4.090 3.908 4.204 0.004 7 0 "[ . 1]" 1
78 1 16 LYS QB 1 17 PHE H 4.200 . 5.200 2.785 2.659 2.961 . 0 0 "[ . 1]" 1
79 1 17 PHE H 1 17 PHE HA 2.800 . 2.800 2.831 2.807 2.864 0.064 9 0 "[ . 1]" 1
80 1 17 PHE H 1 17 PHE QB 3.400 . 4.000 2.170 2.043 2.266 . 0 0 "[ . 1]" 1
81 1 17 PHE H 1 17 PHE QD 4.200 . 5.200 3.247 2.207 4.181 . 0 0 "[ . 1]" 1
82 1 17 PHE H 1 18 LEU H 3.400 . 3.400 2.544 2.407 2.641 . 0 0 "[ . 1]" 1
83 1 17 PHE H 1 18 LEU QB 5.000 . 6.000 5.069 4.369 5.354 . 0 0 "[ . 1]" 1
84 1 17 PHE H 1 18 LEU QD 6.000 . 8.400 4.047 3.428 4.838 . 0 0 "[ . 1]" 1
85 1 17 PHE H 1 18 LEU HG 5.000 . 5.000 4.402 3.839 4.868 . 0 0 "[ . 1]" 1
86 1 17 PHE QB 1 18 LEU H 4.200 . 5.200 2.871 2.742 3.048 . 0 0 "[ . 1]" 1
87 1 18 LEU H 1 18 LEU QB 2.800 . 3.400 3.059 2.277 3.381 . 0 0 "[ . 1]" 1
88 1 18 LEU H 1 19 GLY H 4.200 . 4.200 4.188 4.073 4.234 0.034 9 0 "[ . 1]" 1
89 1 18 LEU HA 1 19 GLY H 2.800 . 2.800 2.171 2.144 2.222 . 0 0 "[ . 1]" 1
90 1 18 LEU QB 1 19 GLY H 3.400 . 4.400 3.261 2.949 3.716 . 0 0 "[ . 1]" 1
91 1 18 LEU QD 1 19 GLY H 4.200 . 6.600 4.060 3.663 4.319 . 0 0 "[ . 1]" 1
92 1 19 GLY H 1 21 TRP HD1 4.200 . 4.200 4.002 3.540 4.205 0.005 8 0 "[ . 1]" 1
93 1 19 GLY H 1 46 VAL HA 4.200 . 4.200 4.207 4.101 4.238 0.038 1 0 "[ . 1]" 1
94 1 19 GLY H 1 47 VAL H 3.400 . 3.400 2.810 2.655 2.952 . 0 0 "[ . 1]" 1
95 1 19 GLY H 1 47 VAL HB 3.400 . 3.400 3.116 2.820 3.404 0.004 1 0 "[ . 1]" 1
96 1 19 GLY H 1 47 VAL QG 4.200 . 6.600 3.275 2.932 3.658 . 0 0 "[ . 1]" 1
97 1 19 GLY H 1 48 ALA HA 5.000 . 5.000 4.561 4.327 4.965 . 0 0 "[ . 1]" 1
98 1 19 GLY QA 1 20 ARG H 2.800 . 3.800 2.255 2.217 2.285 . 0 0 "[ . 1]" 1
99 1 20 ARG H 1 21 TRP H 5.000 . 5.000 4.515 4.445 4.550 . 0 0 "[ . 1]" 1
100 1 20 ARG HA 1 21 TRP H 2.800 . 2.800 2.164 2.143 2.182 . 0 0 "[ . 1]" 1
101 1 20 ARG HA 1 46 VAL HA 2.800 . 2.800 2.597 2.451 2.726 . 0 0 "[ . 1]" 1
102 1 20 ARG HA 1 47 VAL H 4.200 . 4.200 4.132 4.010 4.223 0.023 2 0 "[ . 1]" 1
103 1 21 TRP H 1 21 TRP HD1 4.200 . 4.200 3.125 2.546 3.503 . 0 0 "[ . 1]" 1
104 1 21 TRP H 1 45 THR H 4.200 . 4.200 3.954 3.804 4.193 . 0 0 "[ . 1]" 1
105 1 21 TRP H 1 45 THR HB 4.200 . 4.200 4.170 4.090 4.214 0.014 7 0 "[ . 1]" 1
106 1 21 TRP H 1 46 VAL HA 4.200 . 4.200 3.035 2.851 3.209 . 0 0 "[ . 1]" 1
107 1 21 TRP HA 1 22 TYR H 3.400 . 3.400 2.354 2.251 2.439 . 0 0 "[ . 1]" 1
108 1 21 TRP QB 1 22 TYR H 4.200 . 5.200 2.520 2.338 2.774 . 0 0 "[ . 1]" 1
109 1 21 TRP HD1 1 47 VAL HB 5.000 . 5.000 4.864 4.264 5.004 0.004 8 0 "[ . 1]" 1
110 1 22 TYR H 1 22 TYR QD 4.200 . 4.200 3.162 2.580 3.906 . 0 0 "[ . 1]" 1
111 1 22 TYR H 1 22 TYR QE 5.000 . 6.000 5.255 4.672 6.032 0.032 10 0 "[ . 1]" 1
112 1 22 TYR H 1 127 TYR HA 5.000 . 5.000 5.011 4.937 5.034 0.034 7 0 "[ . 1]" 1
113 1 22 TYR H 1 128 SER H 4.200 . 4.200 3.974 3.791 4.199 . 0 0 "[ . 1]" 1
114 1 22 TYR H 1 129 ARG HA 5.000 . 5.000 4.338 3.795 5.003 0.003 3 0 "[ . 1]" 1
115 1 22 TYR HA 1 22 TYR QE 4.200 . 5.200 4.565 4.359 4.944 . 0 0 "[ . 1]" 1
116 1 22 TYR HA 1 23 SER H 3.400 . 3.400 2.171 2.144 2.225 . 0 0 "[ . 1]" 1
117 1 22 TYR HA 1 44 LYS HA 3.400 . 3.400 2.729 2.381 2.977 . 0 0 "[ . 1]" 1
118 1 22 TYR HA 1 45 THR H 4.200 . 4.200 3.185 2.930 3.419 . 0 0 "[ . 1]" 1
119 1 22 TYR QB 1 22 TYR QE 4.200 . 6.600 3.941 3.932 3.958 . 0 0 "[ . 1]" 1
120 1 22 TYR QB 1 23 SER H 4.200 . 5.200 3.235 2.905 3.732 . 0 0 "[ . 1]" 1
121 1 22 TYR QB 1 128 SER H 4.200 . 5.200 3.372 3.104 3.595 . 0 0 "[ . 1]" 1
122 1 22 TYR QD 1 44 LYS HA 5.000 . 5.000 4.101 3.038 4.728 . 0 0 "[ . 1]" 1
123 1 22 TYR QE 1 130 THR H 4.200 . 6.600 5.990 4.926 6.615 0.015 6 0 "[ . 1]" 1
124 1 22 TYR QE 1 131 GLN H 4.200 . 6.600 4.369 2.962 6.157 . 0 0 "[ . 1]" 1
125 1 22 TYR QE 1 131 GLN QE 4.200 . 6.600 4.258 2.623 5.949 . 0 0 "[ . 1]" 1
126 1 22 TYR QE 1 131 GLN QG 4.200 . 6.600 3.397 2.144 5.183 . 0 0 "[ . 1]" 1
127 1 23 SER H 1 24 ALA H 5.000 . 5.000 4.219 3.878 4.441 . 0 0 "[ . 1]" 1
128 1 23 SER H 1 43 ALA H 4.200 . 4.200 4.139 3.943 4.208 0.008 10 0 "[ . 1]" 1
129 1 23 SER H 1 44 LYS HA 4.200 . 4.200 2.946 2.729 3.253 . 0 0 "[ . 1]" 1
130 1 23 SER HA 1 24 ALA H 3.400 . 3.400 2.183 2.089 2.361 . 0 0 "[ . 1]" 1
131 1 23 SER HA 1 127 TYR HA 4.200 . 4.200 4.228 4.223 4.235 0.035 10 0 "[ . 1]" 1
132 1 23 SER QB 1 24 ALA H 4.200 . 5.200 3.710 3.327 4.042 . 0 0 "[ . 1]" 1
133 1 23 SER QB 1 43 ALA MB 5.000 . 6.000 2.991 2.396 3.614 . 0 0 "[ . 1]" 1
134 1 23 SER QB 1 127 TYR QE 4.200 . 5.200 3.960 3.198 4.562 . 0 0 "[ . 1]" 1
135 1 24 ALA H 1 24 ALA MB 3.400 . 4.000 2.600 2.366 2.781 . 0 0 "[ . 1]" 1
136 1 24 ALA H 1 127 TYR HA 4.200 . 5.200 2.380 2.150 2.679 . 0 0 "[ . 1]" 1
137 1 24 ALA H 1 128 SER H 5.000 . 5.000 3.510 2.998 4.005 . 0 0 "[ . 1]" 1
138 1 24 ALA HA 1 25 GLY H 4.200 . 5.200 2.527 2.516 2.541 . 0 0 "[ . 1]" 1
139 1 24 ALA MB 1 128 SER H 4.200 . 5.200 1.786 1.777 1.801 0.023 3 0 "[ . 1]" 1
140 1 24 ALA MB 1 128 SER QB 5.000 . 5.000 2.325 1.978 2.817 . 0 0 "[ . 1]" 1
141 1 24 ALA MB 1 133 LEU HA 5.000 . 6.000 5.146 4.858 5.238 . 0 0 "[ . 1]" 1
142 1 24 ALA MB 1 133 LEU QB 4.200 . 5.200 3.442 3.150 3.674 . 0 0 "[ . 1]" 1
143 1 24 ALA MB 1 133 LEU QD 5.000 . 6.600 3.448 2.525 4.054 . 0 0 "[ . 1]" 1
144 1 25 GLY H 1 126 LEU H 4.200 . 4.200 4.160 4.121 4.212 0.012 8 0 "[ . 1]" 1
145 1 25 GLY H 1 126 LEU QB 5.000 2.600 6.000 3.602 3.483 3.805 . 0 0 "[ . 1]" 1
146 1 25 GLY H 1 126 LEU HG 4.200 . 5.200 5.148 4.789 5.216 0.016 10 0 "[ . 1]" 1
147 1 25 GLY H 1 127 TYR HA 4.200 2.600 4.200 4.231 4.197 4.264 0.064 7 0 "[ . 1]" 1
148 1 25 GLY H 1 158 LEU H 5.000 . 6.000 4.151 3.739 4.422 . 0 0 "[ . 1]" 1
149 1 25 GLY QA 1 26 LEU H 2.800 . 3.800 2.145 2.108 2.171 . 0 0 "[ . 1]" 1
150 1 25 GLY QA 1 126 LEU QB 5.000 . 6.000 1.770 1.758 1.788 0.042 5 0 "[ . 1]" 1
151 1 25 GLY QA 1 157 PHE HA 4.200 . 5.200 3.882 3.395 4.276 . 0 0 "[ . 1]" 1
152 1 25 GLY QA 1 157 PHE QD 4.200 . 6.600 3.891 3.189 5.055 . 0 0 "[ . 1]" 1
153 1 26 LEU H 1 27 ALA H 5.000 . 5.000 4.314 4.267 4.358 . 0 0 "[ . 1]" 1
154 1 26 LEU H 1 27 ALA MB 4.200 . 5.200 4.376 4.265 4.456 . 0 0 "[ . 1]" 1
155 1 26 LEU H 1 155 ILE MG 4.200 . 5.200 3.669 3.097 4.185 . 0 0 "[ . 1]" 1
156 1 26 LEU H 1 156 VAL H 4.200 . 4.200 3.507 3.112 3.817 . 0 0 "[ . 1]" 1
157 1 26 LEU H 1 157 PHE HA 4.200 . 4.200 3.632 3.185 4.110 . 0 0 "[ . 1]" 1
158 1 26 LEU H 1 157 PHE QD 4.200 . 6.600 4.512 3.384 5.660 . 0 0 "[ . 1]" 1
159 1 26 LEU HA 1 27 ALA H 2.800 . 2.800 2.171 2.161 2.184 . 0 0 "[ . 1]" 1
160 1 26 LEU HA 1 125 THR HA 3.400 . 3.400 3.056 2.799 3.175 . 0 0 "[ . 1]" 1
161 1 26 LEU HA 1 126 LEU H 4.200 . 4.200 3.998 3.883 4.084 . 0 0 "[ . 1]" 1
162 1 26 LEU QB 1 27 ALA H 4.200 . 5.200 3.351 3.142 3.694 . 0 0 "[ . 1]" 1
163 1 26 LEU QB 1 156 VAL QG 5.000 . 7.400 2.421 1.788 3.391 0.012 2 0 "[ . 1]" 1
164 1 27 ALA H 1 123 MET HA 5.000 . 5.000 4.947 4.670 5.043 0.043 8 0 "[ . 1]" 1
165 1 27 ALA H 1 124 ALA H 4.200 . 4.200 3.557 3.416 3.675 . 0 0 "[ . 1]" 1
166 1 27 ALA H 1 124 ALA MB 4.200 . 5.200 4.159 3.846 4.377 . 0 0 "[ . 1]" 1
167 1 27 ALA H 1 125 THR HA 4.200 . 4.200 3.847 3.685 4.075 . 0 0 "[ . 1]" 1
168 1 27 ALA HA 1 28 SER H 2.800 . 3.800 2.156 2.146 2.172 . 0 0 "[ . 1]" 1
169 1 27 ALA HA 1 155 ILE HA 3.400 . 3.400 2.440 2.128 2.760 . 0 0 "[ . 1]" 1
170 1 27 ALA HA 1 156 VAL H 4.200 . 4.200 3.275 2.719 3.955 . 0 0 "[ . 1]" 1
171 1 27 ALA MB 1 28 SER H 4.200 . 5.200 3.089 3.022 3.128 . 0 0 "[ . 1]" 1
172 1 27 ALA MB 1 124 ALA H 4.200 . 5.200 2.656 2.161 3.068 . 0 0 "[ . 1]" 1
173 1 27 ALA MB 1 124 ALA MB 4.200 . 5.200 2.049 1.888 2.426 . 0 0 "[ . 1]" 1
174 1 27 ALA MB 1 141 PHE QD 5.000 . 7.400 4.361 3.765 4.923 . 0 0 "[ . 1]" 1
175 1 27 ALA MB 1 150 LEU QD 4.200 . 6.600 3.776 2.911 5.520 . 0 0 "[ . 1]" 1
176 1 27 ALA MB 1 155 ILE H 6.000 . 7.000 4.603 4.130 5.501 . 0 0 "[ . 1]" 1
177 1 27 ALA MB 1 156 VAL H 4.200 . 5.200 3.683 3.023 4.137 . 0 0 "[ . 1]" 1
178 1 28 SER H 1 150 LEU QD 5.000 . 7.400 5.201 4.248 6.619 . 0 0 "[ . 1]" 1
179 1 28 SER H 1 155 ILE HA 4.200 . 4.200 3.823 3.509 4.201 0.001 2 0 "[ . 1]" 1
180 1 28 SER HA 1 29 ASN H 3.400 . 3.400 2.228 2.151 2.293 . 0 0 "[ . 1]" 1
181 1 28 SER HA 1 30 SER H 5.000 . 5.000 4.192 3.848 4.691 . 0 0 "[ . 1]" 1
182 1 28 SER HA 1 123 MET HA 4.200 . 4.200 3.381 3.182 3.700 . 0 0 "[ . 1]" 1
183 1 28 SER HA 1 124 ALA H 5.000 . 5.000 4.251 4.118 4.386 . 0 0 "[ . 1]" 1
184 1 28 SER QB 1 29 ASN H 5.000 . 6.000 3.042 2.756 3.740 . 0 0 "[ . 1]" 1
185 1 28 SER QB 1 123 MET HA 4.200 . 5.200 4.563 3.904 5.135 . 0 0 "[ . 1]" 1
186 1 28 SER QB 1 123 MET QG 5.000 . 6.000 3.419 2.244 4.215 . 0 0 "[ . 1]" 1
187 1 29 ASN H 1 29 ASN HA 2.800 . 2.800 2.802 2.762 2.842 0.042 8 0 "[ . 1]" 1
188 1 29 ASN H 1 30 SER H 3.400 . 3.400 2.720 2.513 2.993 . 0 0 "[ . 1]" 1
189 1 29 ASN QB 1 150 LEU QD 5.000 . 7.400 4.855 3.944 5.689 . 0 0 "[ . 1]" 1
190 1 30 SER H 1 30 SER QB 3.400 . 4.000 2.386 2.091 3.446 . 0 0 "[ . 1]" 1
191 1 30 SER H 1 31 SER H 5.000 . 5.000 4.521 4.223 4.629 . 0 0 "[ . 1]" 1
192 1 30 SER HA 1 30 SER QB 2.800 . 2.800 2.421 2.168 2.529 . 0 0 "[ . 1]" 1
193 1 30 SER HA 1 31 SER H 2.800 . 2.800 2.504 2.253 2.737 . 0 0 "[ . 1]" 1
194 1 31 SER H 1 32 TRP H 4.200 . 4.200 2.543 1.987 3.201 . 0 0 "[ . 1]" 1
195 1 31 SER HA 1 34 ARG H 3.400 . 3.400 3.267 3.185 3.407 0.007 6 0 "[ . 1]" 1
196 1 31 SER QB 1 32 TRP H 4.200 . 5.200 3.686 2.708 4.045 . 0 0 "[ . 1]" 1
197 1 32 TRP H 1 33 PHE H 4.200 . 4.200 2.642 2.511 2.818 . 0 0 "[ . 1]" 1
198 1 32 TRP HA 1 33 PHE H 4.200 . 4.200 3.542 3.496 3.562 . 0 0 "[ . 1]" 1
199 1 32 TRP HA 1 34 ARG H 5.000 . 5.000 4.450 4.329 4.584 . 0 0 "[ . 1]" 1
200 1 32 TRP HA 1 35 GLU H 4.200 . 4.200 3.660 3.487 3.817 . 0 0 "[ . 1]" 1
201 1 33 PHE H 1 33 PHE QD 4.200 . 5.200 3.124 2.346 4.188 . 0 0 "[ . 1]" 1
202 1 33 PHE H 1 34 ARG H 4.200 . 4.200 2.647 2.596 2.722 . 0 0 "[ . 1]" 1
203 1 33 PHE H 1 35 GLU H 5.000 . 5.000 4.224 4.131 4.361 . 0 0 "[ . 1]" 1
204 1 33 PHE HA 1 34 ARG H 4.200 . 4.200 3.533 3.532 3.535 . 0 0 "[ . 1]" 1
205 1 33 PHE HA 1 36 LYS H 4.200 . 4.200 3.495 3.410 3.587 . 0 0 "[ . 1]" 1
206 1 33 PHE QB 1 34 ARG H 4.200 . 5.200 2.806 2.595 3.407 . 0 0 "[ . 1]" 1
207 1 33 PHE QD 1 34 ARG H 4.200 . 5.200 4.024 2.522 4.624 . 0 0 "[ . 1]" 1
208 1 33 PHE QD 1 156 VAL QG 5.000 . 7.400 3.370 2.354 4.802 . 0 0 "[ . 1]" 1
209 1 34 ARG H 1 34 ARG QB 2.800 . 3.400 2.190 2.040 2.477 . 0 0 "[ . 1]" 1
210 1 34 ARG H 1 35 GLU H 3.400 . 3.400 2.750 2.650 2.845 . 0 0 "[ . 1]" 1
211 1 34 ARG H 1 36 LYS H 5.000 . 5.000 4.019 3.924 4.089 . 0 0 "[ . 1]" 1
212 1 34 ARG HA 1 34 ARG QD 5.000 . 5.000 3.624 2.282 4.135 . 0 0 "[ . 1]" 1
213 1 34 ARG HA 1 35 GLU H 4.200 . 4.200 3.534 3.522 3.551 . 0 0 "[ . 1]" 1
214 1 34 ARG HA 1 36 LYS H 4.200 . 4.200 3.769 3.714 3.851 . 0 0 "[ . 1]" 1
215 1 34 ARG HA 1 37 LYS H 4.200 . 4.200 3.228 3.018 3.577 . 0 0 "[ . 1]" 1
216 1 34 ARG QB 1 34 ARG QD 2.800 . 2.800 2.145 1.988 2.400 . 0 0 "[ . 1]" 1
217 1 34 ARG QB 1 35 GLU H 4.200 . 5.200 2.615 2.475 2.764 . 0 0 "[ . 1]" 1
218 1 35 GLU H 1 35 GLU HA 2.800 . 2.800 2.804 2.792 2.822 0.022 9 0 "[ . 1]" 1
219 1 35 GLU H 1 35 GLU QG 3.400 . 4.000 3.489 2.069 4.007 0.007 6 0 "[ . 1]" 1
220 1 35 GLU H 1 36 LYS H 2.800 . 2.800 2.641 2.599 2.672 . 0 0 "[ . 1]" 1
221 1 35 GLU H 1 37 LYS H 4.200 . 4.200 4.038 3.870 4.183 . 0 0 "[ . 1]" 1
222 1 35 GLU HA 1 35 GLU QG 2.800 . 2.800 2.338 2.085 2.635 . 0 0 "[ . 1]" 1
223 1 35 GLU HA 1 36 LYS H 3.400 . 3.400 3.418 3.408 3.429 0.029 8 0 "[ . 1]" 1
224 1 35 GLU HA 1 37 LYS H 4.200 . 4.200 3.929 3.713 4.204 0.004 6 0 "[ . 1]" 1
225 1 36 LYS H 1 37 LYS H 4.200 . 4.200 2.257 2.114 2.434 . 0 0 "[ . 1]" 1
226 1 36 LYS H 1 38 ALA H 5.000 . 5.000 4.348 4.010 4.676 . 0 0 "[ . 1]" 1
227 1 36 LYS HA 1 36 LYS QD 4.200 . 4.200 3.432 2.218 3.979 . 0 0 "[ . 1]" 1
228 1 36 LYS HA 1 37 LYS H 3.400 . 3.400 3.306 3.160 3.417 0.017 6 0 "[ . 1]" 1
229 1 36 LYS HA 1 38 ALA H 4.200 . 4.200 3.596 3.366 3.807 . 0 0 "[ . 1]" 1
230 1 36 LYS HA 1 39 VAL H 5.000 2.600 5.000 3.615 3.358 3.804 . 0 0 "[ . 1]" 1
231 1 36 LYS HA 1 39 VAL QG 4.200 . 6.600 2.610 1.939 3.270 . 0 0 "[ . 1]" 1
232 1 37 LYS H 1 37 LYS HA 2.800 . 2.800 2.792 2.760 2.806 0.006 6 0 "[ . 1]" 1
233 1 37 LYS H 1 38 ALA H 3.400 . 3.400 2.636 2.595 2.728 . 0 0 "[ . 1]" 1
234 1 37 LYS HA 1 38 ALA H 3.400 . 3.400 3.449 3.447 3.449 0.049 7 0 "[ . 1]" 1
235 1 37 LYS HA 1 39 VAL H 5.000 . 5.000 3.695 3.593 3.815 . 0 0 "[ . 1]" 1
236 1 37 LYS HA 1 40 LEU H 4.200 . 4.200 3.163 2.978 3.614 . 0 0 "[ . 1]" 1
237 1 38 ALA H 1 38 ALA HA 2.800 . 2.800 2.798 2.776 2.838 0.038 6 0 "[ . 1]" 1
238 1 38 ALA H 1 38 ALA MB 2.800 . 3.400 2.151 2.089 2.238 . 0 0 "[ . 1]" 1
239 1 38 ALA H 1 39 VAL H 2.800 . 2.800 2.651 2.523 2.742 . 0 0 "[ . 1]" 1
240 1 38 ALA H 1 40 LEU H 4.200 . 4.200 4.148 3.917 4.204 0.004 4 0 "[ . 1]" 1
241 1 38 ALA HA 1 39 VAL H 3.400 . 3.400 3.429 3.411 3.439 0.039 10 0 "[ . 1]" 1
242 1 38 ALA HA 1 40 LEU H 5.000 . 5.000 4.407 3.834 5.006 0.006 6 0 "[ . 1]" 1
243 1 38 ALA MB 1 39 VAL H 4.200 . 5.200 2.963 2.892 3.062 . 0 0 "[ . 1]" 1
244 1 39 VAL H 1 39 VAL HA 2.800 . 2.800 2.892 2.841 2.919 0.119 9 0 "[ . 1]" 1
245 1 39 VAL H 1 39 VAL HB 3.400 . 3.400 2.929 2.605 3.424 0.024 9 0 "[ . 1]" 1
246 1 39 VAL H 1 40 LEU H 2.800 . 2.800 2.266 1.950 2.546 . 0 0 "[ . 1]" 1
247 1 39 VAL HA 1 39 VAL HB 2.800 . 2.800 2.826 2.449 2.977 0.177 4 0 "[ . 1]" 1
248 1 39 VAL HA 1 39 VAL QG 2.800 . 3.400 2.104 1.967 2.302 . 0 0 "[ . 1]" 1
249 1 40 LEU H 1 40 LEU QB 3.400 . 4.000 3.085 2.060 3.470 . 0 0 "[ . 1]" 1
250 1 40 LEU H 1 41 TYR H 4.200 . 4.200 3.721 3.428 4.209 0.009 9 0 "[ . 1]" 1
251 1 40 LEU HA 1 41 TYR H 2.800 . 2.800 2.189 2.139 2.290 . 0 0 "[ . 1]" 1
252 1 40 LEU QB 1 41 TYR H 4.200 . 5.200 3.608 3.169 3.896 . 0 0 "[ . 1]" 1
253 1 40 LEU QD 1 41 TYR H 5.000 . 7.400 4.010 3.434 4.378 . 0 0 "[ . 1]" 1
254 1 41 TYR H 1 41 TYR QD 4.200 . 5.200 2.882 2.418 3.394 . 0 0 "[ . 1]" 1
255 1 41 TYR QB 1 42 MET H 3.400 . 4.400 2.994 2.728 3.095 . 0 0 "[ . 1]" 1
256 1 41 TYR QB 1 62 LEU H 4.200 . 5.200 4.539 3.932 5.199 . 0 0 "[ . 1]" 1
257 1 41 TYR QD 1 42 MET H 4.200 . 5.200 4.092 3.620 4.809 . 0 0 "[ . 1]" 1
258 1 41 TYR QD 1 63 ARG QD 5.000 . 6.000 3.714 2.861 5.087 . 0 0 "[ . 1]" 1
259 1 42 MET H 1 43 ALA H 5.000 . 5.000 4.313 4.108 4.427 . 0 0 "[ . 1]" 1
260 1 42 MET H 1 43 ALA MB 5.000 . 6.000 4.899 4.594 5.078 . 0 0 "[ . 1]" 1
261 1 42 MET H 1 62 LEU H 5.000 . 5.000 3.113 2.775 3.300 . 0 0 "[ . 1]" 1
262 1 42 MET H 1 63 ARG HA 4.200 . 4.200 4.272 4.248 4.291 0.091 3 0 "[ . 1]" 1
263 1 42 MET ME 1 131 GLN HA 6.000 . 7.000 4.598 2.684 6.993 . 0 0 "[ . 1]" 1
264 1 42 MET QG 1 43 ALA H 4.200 . 5.200 3.392 2.569 4.804 . 0 0 "[ . 1]" 1
265 1 43 ALA HA 1 61 PHE H 2.800 . 2.800 3.150 3.137 3.162 0.362 9 0 "[ . 1]" 1
266 1 43 ALA HA 1 62 LEU H 4.200 . 4.200 3.943 3.891 4.005 . 0 0 "[ . 1]" 1
267 1 43 ALA MB 1 44 LYS H 4.200 . 5.200 3.014 2.964 3.067 . 0 0 "[ . 1]" 1
268 1 43 ALA MB 1 60 THR H 4.200 . 5.200 3.227 3.072 3.350 . 0 0 "[ . 1]" 1
269 1 43 ALA MB 1 61 PHE QD 4.200 . 5.200 1.884 1.800 2.152 . 0 0 "[ . 1]" 1
270 1 44 LYS H 1 44 LYS HA 2.800 . 2.800 2.905 2.904 2.907 0.107 4 0 "[ . 1]" 1
271 1 44 LYS H 1 44 LYS QB 2.800 . 3.400 2.358 2.190 2.582 . 0 0 "[ . 1]" 1
272 1 44 LYS H 1 60 THR H 4.200 . 4.200 2.235 2.167 2.355 . 0 0 "[ . 1]" 1
273 1 44 LYS H 1 61 PHE HA 4.200 . 4.200 3.355 3.288 3.406 . 0 0 "[ . 1]" 1
274 1 45 THR H 1 45 THR HB 3.400 . 3.400 3.004 2.711 3.427 0.027 7 0 "[ . 1]" 1
275 1 45 THR HA 1 46 VAL H 2.800 . 2.800 2.129 2.121 2.141 . 0 0 "[ . 1]" 1
276 1 45 THR HA 1 58 THR H 4.200 . 4.200 3.887 3.753 4.018 . 0 0 "[ . 1]" 1
277 1 45 THR HA 1 59 SER HA 2.800 . 2.800 2.012 1.952 2.127 . 0 0 "[ . 1]" 1
278 1 45 THR HA 1 60 THR H 4.200 . 4.200 3.762 3.646 3.871 . 0 0 "[ . 1]" 1
279 1 46 VAL H 1 46 VAL HB 3.400 . 3.400 2.863 2.832 2.892 . 0 0 "[ . 1]" 1
280 1 46 VAL H 1 58 THR H 4.200 . 4.200 2.198 2.046 2.317 . 0 0 "[ . 1]" 1
281 1 46 VAL H 1 59 SER HA 4.200 . 4.200 3.767 3.705 3.819 . 0 0 "[ . 1]" 1
282 1 46 VAL HA 1 47 VAL H 2.800 . 2.800 2.156 2.149 2.166 . 0 0 "[ . 1]" 1
283 1 46 VAL HB 1 58 THR H 4.200 . 4.200 3.186 3.129 3.232 . 0 0 "[ . 1]" 1
284 1 46 VAL HB 1 58 THR HB 3.400 . 3.400 3.372 3.202 3.409 0.009 9 0 "[ . 1]" 1
285 1 46 VAL QG 1 58 THR HB 5.000 . 7.400 3.853 3.709 3.936 . 0 0 "[ . 1]" 1
286 1 47 VAL H 1 47 VAL HB . . 2.800 2.850 2.823 2.893 0.093 10 0 "[ . 1]" 1
287 1 47 VAL HA 1 48 ALA H 2.800 . 2.800 2.195 2.183 2.207 . 0 0 "[ . 1]" 1
288 1 47 VAL HA 1 57 LEU H 2.800 . 2.800 3.118 3.103 3.132 0.332 8 0 "[ . 1]" 1
289 1 47 VAL HA 1 58 THR H 5.000 . 5.000 3.588 3.506 3.651 . 0 0 "[ . 1]" 1
290 1 47 VAL HB 1 48 ALA H 5.000 . 5.000 4.089 4.052 4.113 . 0 0 "[ . 1]" 1
291 1 47 VAL QG 1 48 ALA H 4.200 . 6.600 2.924 2.897 2.972 . 0 0 "[ . 1]" 1
292 1 47 VAL QG 1 58 THR H 5.000 . 7.400 3.992 3.938 4.084 . 0 0 "[ . 1]" 1
293 1 48 ALA H 1 56 ASN H 4.200 . 4.200 2.331 2.206 2.469 . 0 0 "[ . 1]" 1
294 1 48 ALA H 1 57 LEU HA 4.200 . 4.200 3.499 3.392 3.637 . 0 0 "[ . 1]" 1
295 1 48 ALA MB 1 56 ASN QB 5.000 . 5.000 3.540 3.165 4.376 . 0 0 "[ . 1]" 1
296 1 49 PRO HA 1 55 LEU HA 3.400 . 3.400 2.269 2.095 2.400 . 0 0 "[ . 1]" 1
297 1 49 PRO HA 1 56 ASN H 4.200 . 4.200 3.916 3.737 4.081 . 0 0 "[ . 1]" 1
298 1 49 PRO QB 1 50 SER H 3.400 . 4.400 3.394 3.280 3.707 . 0 0 "[ . 1]" 1
299 1 50 SER H 1 50 SER QB 2.800 . 3.400 2.503 2.233 3.069 . 0 0 "[ . 1]" 1
300 1 50 SER H 1 51 THR H 4.200 . 4.200 4.407 4.392 4.425 0.225 7 0 "[ . 1]" 1
301 1 50 SER H 1 53 GLY H 5.000 . 5.000 4.188 4.031 4.448 . 0 0 "[ . 1]" 1
302 1 50 SER H 1 54 GLY H 4.200 . 4.200 3.267 2.956 4.209 0.009 3 0 "[ . 1]" 1
303 1 50 SER H 1 55 LEU HA 2.800 . 2.800 2.702 2.321 2.810 0.010 2 0 "[ . 1]" 1
304 1 50 SER H 1 56 ASN H 4.200 . 4.200 4.098 3.451 4.225 0.025 7 0 "[ . 1]" 1
305 1 50 SER HA 1 50 SER QB 2.800 . 2.800 2.403 2.165 2.512 . 0 0 "[ . 1]" 1
306 1 50 SER HA 1 51 THR H 2.800 . 2.800 2.398 2.248 2.461 . 0 0 "[ . 1]" 1
307 1 50 SER QB 1 51 THR H 3.400 . 4.400 2.567 2.130 3.271 . 0 0 "[ . 1]" 1
308 1 50 SER QB 1 52 GLU H 4.200 . 5.200 2.319 2.110 2.654 . 0 0 "[ . 1]" 1
309 1 50 SER QB 1 53 GLY H 5.000 . 6.000 3.512 3.171 4.238 . 0 0 "[ . 1]" 1
310 1 50 SER QB 1 54 GLY H 5.000 . 6.000 3.351 2.707 4.441 . 0 0 "[ . 1]" 1
311 1 50 SER QB 1 56 ASN H 4.200 . 5.200 4.008 3.231 4.661 . 0 0 "[ . 1]" 1
312 1 50 SER QB 1 56 ASN QD 4.200 . 5.200 2.918 2.218 4.138 . 0 0 "[ . 1]" 1
313 1 50 SER QB 1 73 VAL QG 5.000 . 7.400 3.754 3.167 4.590 . 0 0 "[ . 1]" 1
314 1 51 THR H 1 51 THR HA 2.800 . 2.800 2.823 2.822 2.824 0.024 10 0 "[ . 1]" 1
315 1 51 THR H 1 51 THR HB 2.800 . 2.800 2.668 2.543 2.777 . 0 0 "[ . 1]" 1
316 1 51 THR H 1 51 THR MG 4.200 . 5.200 3.791 3.776 3.796 . 0 0 "[ . 1]" 1
317 1 51 THR H 1 52 GLU H 2.800 . 2.800 2.357 2.333 2.368 . 0 0 "[ . 1]" 1
318 1 51 THR H 1 52 GLU HA 5.000 . 5.000 4.936 4.882 4.963 . 0 0 "[ . 1]" 1
319 1 51 THR H 1 52 GLU QB 4.200 . 4.800 4.166 3.952 4.573 . 0 0 "[ . 1]" 1
320 1 51 THR H 1 53 GLY H 4.200 . 4.200 4.158 4.098 4.233 0.033 4 0 "[ . 1]" 1
321 1 51 THR H 1 54 GLY H 5.000 . 5.000 5.017 4.919 5.044 0.044 7 0 "[ . 1]" 1
322 1 51 THR H 1 56 ASN QD 5.000 . 6.000 5.460 4.672 6.007 0.007 3 0 "[ . 1]" 1
323 1 51 THR HA 1 51 THR MG 3.400 . 4.000 2.346 2.242 2.430 . 0 0 "[ . 1]" 1
324 1 51 THR HA 1 52 GLU H 2.800 . 2.800 3.122 3.119 3.123 0.323 10 0 "[ . 1]" 1
325 1 51 THR HA 1 53 GLY H 3.400 . 3.400 3.335 3.254 3.404 0.004 10 0 "[ . 1]" 1
326 1 51 THR HB 1 52 GLU H 3.400 . 3.400 3.315 3.298 3.331 . 0 0 "[ . 1]" 1
327 1 51 THR MG 1 52 GLU H 5.000 . 6.000 4.039 3.936 4.129 . 0 0 "[ . 1]" 1
328 1 52 GLU H 1 52 GLU HA 2.800 . 2.800 2.860 2.831 2.875 0.075 10 0 "[ . 1]" 1
329 1 52 GLU H 1 52 GLU QB 2.800 . 3.400 2.316 2.103 2.690 . 0 0 "[ . 1]" 1
330 1 52 GLU H 1 53 GLY H 2.800 . 2.800 2.440 2.374 2.525 . 0 0 "[ . 1]" 1
331 1 52 GLU H 1 53 GLY HA3 5.000 . 5.000 5.067 5.033 5.086 0.086 8 0 "[ . 1]" 1
332 1 52 GLU H 1 54 GLY H 4.200 . 4.200 3.627 3.460 4.110 . 0 0 "[ . 1]" 1
333 1 52 GLU HA 1 52 GLU QG 3.400 . 4.000 2.475 2.067 3.334 . 0 0 "[ . 1]" 1
334 1 52 GLU QB 1 53 GLY H 4.200 . 5.200 3.282 3.044 3.832 . 0 0 "[ . 1]" 1
335 1 53 GLY H 1 53 GLY QA 2.800 . 2.800 2.313 2.248 2.501 . 0 0 "[ . 1]" 1
336 1 53 GLY QA 1 54 GLY H 3.400 . 4.400 2.828 2.705 2.877 . 0 0 "[ . 1]" 1
337 1 54 GLY H 1 54 GLY QA 2.800 . 2.800 2.390 2.218 2.492 . 0 0 "[ . 1]" 1
338 1 54 GLY QA 1 55 LEU H 2.800 . 3.800 2.214 2.142 2.310 . 0 0 "[ . 1]" 1
339 1 54 GLY QA 1 75 GLN HA 4.200 . 5.200 3.315 2.895 3.612 . 0 0 "[ . 1]" 1
340 1 55 LEU H 1 74 LEU H 4.200 . 4.200 3.818 3.549 4.089 . 0 0 "[ . 1]" 1
341 1 55 LEU H 1 75 GLN HA 5.000 . 5.000 3.917 3.514 4.352 . 0 0 "[ . 1]" 1
342 1 55 LEU H 1 83 TYR QD 5.000 . 7.400 5.944 3.903 7.404 0.004 5 0 "[ . 1]" 1
343 1 55 LEU HA 1 56 ASN H 2.800 . 2.800 2.269 2.244 2.308 . 0 0 "[ . 1]" 1
344 1 55 LEU QB 1 56 ASN H 4.200 . 5.200 2.856 2.756 2.961 . 0 0 "[ . 1]" 1
345 1 55 LEU QB 1 74 LEU QB 5.000 . 6.000 3.403 2.697 4.668 . 0 0 "[ . 1]" 1
346 1 56 ASN HA 1 57 LEU H 2.800 . 2.800 2.113 2.104 2.118 . 0 0 "[ . 1]" 1
347 1 56 ASN HA 1 73 VAL HA 3.400 . 3.400 2.556 2.221 2.802 . 0 0 "[ . 1]" 1
348 1 56 ASN HA 1 74 LEU H 4.200 . 4.200 3.043 2.739 3.440 . 0 0 "[ . 1]" 1
349 1 57 LEU H 1 72 MET H 4.200 . 4.200 4.073 3.977 4.190 . 0 0 "[ . 1]" 1
350 1 57 LEU HA 1 58 THR H 2.800 . 2.800 2.155 2.143 2.168 . 0 0 "[ . 1]" 1
351 1 58 THR H 1 58 THR HB 3.400 . 3.400 2.571 2.531 2.725 . 0 0 "[ . 1]" 1
352 1 58 THR H 1 58 THR MG 4.200 . 5.200 3.831 3.812 3.877 . 0 0 "[ . 1]" 1
353 1 58 THR HA 1 59 SER H 2.800 . 2.800 2.149 2.144 2.153 . 0 0 "[ . 1]" 1
354 1 58 THR HA 1 71 ILE HA 2.800 . 2.800 2.484 2.267 2.682 . 0 0 "[ . 1]" 1
355 1 58 THR HA 1 72 MET H 4.200 . 4.200 3.040 2.893 3.241 . 0 0 "[ . 1]" 1
356 1 58 THR MG 1 59 SER H 4.200 . 5.200 2.941 2.835 3.096 . 0 0 "[ . 1]" 1
357 1 58 THR MG 1 60 THR H 6.000 . 7.000 4.238 4.127 4.583 . 0 0 "[ . 1]" 1
358 1 59 SER H 1 70 LYS H 4.200 . 4.200 3.729 3.561 3.874 . 0 0 "[ . 1]" 1
359 1 59 SER H 1 71 ILE HA 4.200 . 4.200 3.664 3.426 3.906 . 0 0 "[ . 1]" 1
360 1 59 SER HA 1 60 THR H 2.800 . 2.800 2.164 2.154 2.177 . 0 0 "[ . 1]" 1
361 1 59 SER QB 1 60 THR H 4.200 . 5.200 3.461 3.313 3.761 . 0 0 "[ . 1]" 1
362 1 59 SER QB 1 70 LYS QB 5.000 . 6.000 3.247 2.619 3.572 . 0 0 "[ . 1]" 1
363 1 60 THR H 1 60 THR HB 3.400 . 3.400 3.506 3.498 3.516 0.116 9 0 "[ . 1]" 1
364 1 60 THR H 1 60 THR MG 4.200 . 4.800 3.429 3.345 3.497 . 0 0 "[ . 1]" 1
365 1 60 THR HA 1 61 PHE H 2.800 . 2.800 2.102 2.096 2.112 . 0 0 "[ . 1]" 1
366 1 60 THR HA 1 69 THR HA 2.800 . 2.800 2.709 2.451 2.808 0.008 9 0 "[ . 1]" 1
367 1 60 THR HA 1 70 LYS H 3.400 . 3.400 3.407 3.402 3.416 0.016 7 0 "[ . 1]" 1
368 1 60 THR HB 1 61 PHE H 3.400 . 3.400 3.525 3.515 3.532 0.132 4 0 "[ . 1]" 1
369 1 60 THR MG 1 67 CYS QB 6.000 . 7.000 4.854 4.509 5.230 . 0 0 "[ . 1]" 1
370 1 61 PHE H 1 61 PHE QE 4.200 . 5.200 3.897 3.812 4.044 . 0 0 "[ . 1]" 1
371 1 61 PHE H 1 62 LEU H 5.000 . 5.000 4.487 4.477 4.493 . 0 0 "[ . 1]" 1
372 1 61 PHE H 1 68 GLU H 4.200 . 4.200 3.469 3.297 3.621 . 0 0 "[ . 1]" 1
373 1 61 PHE H 1 69 THR HA 4.200 . 4.200 4.135 3.893 4.215 0.015 9 0 "[ . 1]" 1
374 1 61 PHE HA 1 62 LEU H 2.800 . 2.800 2.245 2.208 2.288 . 0 0 "[ . 1]" 1
375 1 61 PHE QD 1 68 GLU QB 5.000 . 6.000 3.592 3.167 3.807 . 0 0 "[ . 1]" 1
376 1 62 LEU H 1 62 LEU QB 3.400 . 4.000 2.471 2.447 2.501 . 0 0 "[ . 1]" 1
377 1 62 LEU HA 1 63 ARG H 2.800 . 2.800 2.178 2.169 2.186 . 0 0 "[ . 1]" 1
378 1 62 LEU HA 1 67 CYS HA 3.400 . 3.400 2.219 2.001 2.381 . 0 0 "[ . 1]" 1
379 1 62 LEU HA 1 68 GLU H 4.200 . 4.200 3.721 3.624 3.800 . 0 0 "[ . 1]" 1
380 1 62 LEU QB 1 63 ARG H 4.200 . 5.200 3.927 3.879 3.939 . 0 0 "[ . 1]" 1
381 1 62 LEU QD 1 63 ARG H 4.200 . 6.600 3.450 3.071 3.817 . 0 0 "[ . 1]" 1
382 1 62 LEU QD 1 65 ASN H 4.200 . 6.600 2.769 2.375 3.443 . 0 0 "[ . 1]" 1
383 1 62 LEU QD 1 66 GLN H 4.200 . 6.600 2.873 2.042 3.286 . 0 0 "[ . 1]" 1
384 1 62 LEU QD 1 67 CYS HA 4.200 . 6.600 3.686 2.842 4.050 . 0 0 "[ . 1]" 1
385 1 62 LEU QD 1 67 CYS QB 5.000 . 6.000 2.911 2.005 4.103 . 0 0 "[ . 1]" 1
386 1 62 LEU QD 1 162 ASP H 5.000 . 7.400 3.628 2.002 5.291 . 0 0 "[ . 1]" 1
387 1 62 LEU QD 1 163 LYS H 5.000 . 6.600 2.762 1.785 4.265 0.015 3 0 "[ . 1]" 1
388 1 62 LEU QD 1 163 LYS QB 5.000 . 7.400 3.556 1.823 4.907 . 0 0 "[ . 1]" 1
389 1 62 LEU HG 1 63 ARG H 4.200 . 4.200 3.335 3.014 3.697 . 0 0 "[ . 1]" 1
390 1 62 LEU HG 1 65 ASN HA 4.200 . 4.200 3.812 3.480 4.203 0.003 10 0 "[ . 1]" 1
391 1 63 ARG H 1 63 ARG QB 3.400 . 4.000 2.942 2.740 3.128 . 0 0 "[ . 1]" 1
392 1 63 ARG H 1 65 ASN H 5.000 . 5.000 5.036 5.020 5.054 0.054 4 0 "[ . 1]" 1
393 1 63 ARG H 1 66 GLN H 3.400 . 3.400 3.134 3.054 3.196 . 0 0 "[ . 1]" 1
394 1 63 ARG H 1 67 CYS HA 4.200 . 4.200 3.382 3.234 3.517 . 0 0 "[ . 1]" 1
395 1 63 ARG HA 1 64 LYS H 2.800 . 2.800 2.138 2.125 2.155 . 0 0 "[ . 1]" 1
396 1 63 ARG QB 1 64 LYS H 4.200 . 5.200 3.397 3.333 3.428 . 0 0 "[ . 1]" 1
397 1 64 LYS H 1 64 LYS HA 2.800 . 2.800 2.283 2.268 2.294 . 0 0 "[ . 1]" 1
398 1 64 LYS H 1 65 ASN H 4.200 . 4.200 3.221 2.925 3.366 . 0 0 "[ . 1]" 1
399 1 64 LYS HA 1 64 LYS QB 2.800 . 2.800 2.421 2.285 2.530 . 0 0 "[ . 1]" 1
400 1 64 LYS HA 1 64 LYS QD 5.000 . 5.000 3.473 2.686 4.114 . 0 0 "[ . 1]" 1
401 1 64 LYS HA 1 66 GLN H 4.200 . 4.200 4.242 4.232 4.260 0.060 4 0 "[ . 1]" 1
402 1 64 LYS QB 1 65 ASN H 2.800 . 3.800 3.874 3.844 3.921 0.121 8 0 "[ . 1]" 1
403 1 65 ASN H 1 65 ASN HA 2.800 . 2.800 2.274 2.266 2.278 . 0 0 "[ . 1]" 1
404 1 65 ASN H 1 65 ASN QB 3.400 . 4.000 3.077 2.860 3.341 . 0 0 "[ . 1]" 1
405 1 65 ASN H 1 66 GLN H 2.800 . 2.800 2.737 2.684 2.777 . 0 0 "[ . 1]" 1
406 1 65 ASN HA 1 65 ASN QB 2.800 . 2.800 2.433 2.315 2.540 . 0 0 "[ . 1]" 1
407 1 65 ASN HA 1 66 GLN H 2.800 . 2.800 2.849 2.838 2.867 0.067 6 0 "[ . 1]" 1
408 1 65 ASN QB 1 66 GLN H 3.400 . 4.400 3.804 3.779 3.824 . 0 0 "[ . 1]" 1
409 1 66 GLN H 1 66 GLN HA 2.800 . 2.800 2.910 2.902 2.914 0.114 6 0 "[ . 1]" 1
410 1 66 GLN H 1 66 GLN QB 3.400 . 4.000 2.645 2.568 2.823 . 0 0 "[ . 1]" 1
411 1 66 GLN H 1 66 GLN QG 4.200 . 5.200 3.984 2.789 4.260 . 0 0 "[ . 1]" 1
412 1 66 GLN H 1 67 CYS H 4.200 . 4.200 4.156 3.942 4.228 0.028 3 0 "[ . 1]" 1
413 1 66 GLN HA 1 67 CYS H 2.800 . 2.800 2.158 2.152 2.170 . 0 0 "[ . 1]" 1
414 1 66 GLN QB 1 67 CYS H 3.400 . 4.400 3.620 3.241 3.857 . 0 0 "[ . 1]" 1
415 1 67 CYS H 1 67 CYS QB 2.800 . 3.400 2.414 2.339 2.462 . 0 0 "[ . 1]" 1
416 1 67 CYS HA 1 68 GLU H 2.800 . 2.800 2.162 2.154 2.170 . 0 0 "[ . 1]" 1
417 1 67 CYS QB 1 68 GLU H 4.200 . 5.200 3.415 3.047 3.650 . 0 0 "[ . 1]" 1
418 1 68 GLU H 1 69 THR H 5.000 . 5.000 4.424 4.387 4.468 . 0 0 "[ . 1]" 1
419 1 68 GLU HA 1 69 THR H 2.800 . 2.800 2.329 2.272 2.342 . 0 0 "[ . 1]" 1
420 1 68 GLU QG 1 69 THR H 3.400 . 4.400 2.992 2.053 4.259 . 0 0 "[ . 1]" 1
421 1 69 THR H 1 69 THR HB 3.400 . 3.400 3.261 3.071 3.422 0.022 7 0 "[ . 1]" 1
422 1 69 THR HA 1 70 LYS H 2.800 . 2.800 2.231 2.204 2.271 . 0 0 "[ . 1]" 1
423 1 69 THR HB 1 70 LYS H 3.400 . 3.400 3.356 3.080 3.451 0.051 3 0 "[ . 1]" 1
424 1 71 ILE H 1 71 ILE HB 3.400 . 3.400 2.689 2.619 2.749 . 0 0 "[ . 1]" 1
425 1 71 ILE HA 1 71 ILE MG . . 2.800 2.292 2.206 2.388 . 0 0 "[ . 1]" 1
426 1 71 ILE HA 1 72 MET H 2.800 . 2.800 2.148 2.134 2.158 . 0 0 "[ . 1]" 1
427 1 71 ILE HB 1 72 MET H 4.200 . 4.200 4.098 4.050 4.193 . 0 0 "[ . 1]" 1
428 1 72 MET H 1 73 VAL H 5.000 . 5.000 4.305 4.235 4.372 . 0 0 "[ . 1]" 1
429 1 73 VAL H 1 73 VAL HB 2.800 . 2.800 2.718 2.616 2.823 0.023 8 0 "[ . 1]" 1
430 1 73 VAL H 1 74 LEU H 5.000 . 5.000 4.429 4.357 4.497 . 0 0 "[ . 1]" 1
431 1 73 VAL HB 1 74 LEU H 4.200 . 4.200 4.174 4.101 4.219 0.019 8 0 "[ . 1]" 1
432 1 74 LEU H 1 74 LEU QB 3.400 . 4.000 2.429 2.271 2.728 . 0 0 "[ . 1]" 1
433 1 74 LEU HA 1 75 GLN H 3.400 . 3.400 2.144 2.138 2.148 . 0 0 "[ . 1]" 1
434 1 74 LEU HA 1 83 TYR QB 5.000 . 6.000 4.470 3.978 4.843 . 0 0 "[ . 1]" 1
435 1 74 LEU HA 1 85 TYR HA 2.800 . 2.800 2.805 2.732 2.826 0.026 3 0 "[ . 1]" 1
436 1 74 LEU QB 1 75 GLN H 5.000 . 6.000 3.612 3.270 3.837 . 0 0 "[ . 1]" 1
437 1 75 GLN H 1 84 THR H 3.400 . 3.400 3.332 3.129 3.407 0.007 7 0 "[ . 1]" 1
438 1 75 GLN H 1 85 TYR HA 5.000 . 5.000 3.399 2.833 3.639 . 0 0 "[ . 1]" 1
439 1 76 PRO HA 1 77 ALA H 2.800 . 2.800 2.198 2.158 2.262 . 0 0 "[ . 1]" 1
440 1 76 PRO HA 1 83 TYR HA 4.200 . 4.200 2.763 2.255 3.364 . 0 0 "[ . 1]" 1
441 1 76 PRO HA 1 83 TYR QD 4.200 . 5.200 3.083 2.050 4.436 . 0 0 "[ . 1]" 1
442 1 76 PRO HA 1 84 THR H 5.000 . 5.000 3.842 3.332 4.308 . 0 0 "[ . 1]" 1
443 1 76 PRO QB 1 77 ALA H 3.400 . 4.400 3.096 2.877 3.272 . 0 0 "[ . 1]" 1
444 1 77 ALA H 1 78 GLY H 3.400 . 3.400 3.151 2.963 3.402 0.002 7 0 "[ . 1]" 1
445 1 77 ALA H 1 82 HIS H 5.000 . 5.000 4.736 4.523 4.916 . 0 0 "[ . 1]" 1
446 1 77 ALA H 1 83 TYR HA 2.800 . 2.800 2.705 2.531 2.802 0.002 10 0 "[ . 1]" 1
447 1 77 ALA H 1 83 TYR QD 4.200 . 5.200 4.329 3.731 5.202 0.002 6 0 "[ . 1]" 1
448 1 77 ALA HA 1 78 GLY H 2.800 . 2.800 2.746 2.642 2.803 0.003 3 0 "[ . 1]" 1
449 1 77 ALA MB 1 78 GLY H 4.200 . 5.200 3.700 3.685 3.722 . 0 0 "[ . 1]" 1
450 1 77 ALA MB 1 82 HIS QB 5.000 . 6.000 2.873 2.011 4.092 . 0 0 "[ . 1]" 1
451 1 77 ALA MB 1 83 TYR HA 4.200 . 5.200 2.979 2.424 3.415 . 0 0 "[ . 1]" 1
452 1 78 GLY H 1 78 GLY QA 2.800 . 2.800 2.245 2.209 2.308 . 0 0 "[ . 1]" 1
453 1 78 GLY H 1 79 ALA H 4.200 . 4.200 4.040 3.702 4.203 0.003 1 0 "[ . 1]" 1
454 1 78 GLY QA 1 79 ALA H 2.800 . 3.800 2.272 2.168 2.492 . 0 0 "[ . 1]" 1
455 1 80 PRO HA 1 81 GLY H 2.800 . 2.800 2.274 2.242 2.334 . 0 0 "[ . 1]" 1
456 1 80 PRO HA 1 82 HIS H 3.400 . 3.400 3.400 3.372 3.408 0.008 6 0 "[ . 1]" 1
457 1 80 PRO QB 1 81 GLY H 5.000 . 6.000 2.869 2.753 2.935 . 0 0 "[ . 1]" 1
458 1 81 GLY H 1 82 HIS H 3.400 . 3.400 2.669 2.281 2.838 . 0 0 "[ . 1]" 1
459 1 81 GLY QA 1 82 HIS H 3.400 . 4.400 2.831 2.817 2.849 . 0 0 "[ . 1]" 1
460 1 81 GLY QA 1 83 TYR QD 4.200 . 6.600 4.575 3.831 6.041 . 0 0 "[ . 1]" 1
461 1 81 GLY QA 1 98 VAL HB 4.200 . 5.200 4.496 2.446 5.203 0.003 5 0 "[ . 1]" 1
462 1 81 GLY QA 1 98 VAL QG 5.000 . 7.400 3.997 2.657 4.886 . 0 0 "[ . 1]" 1
463 1 82 HIS H 1 82 HIS QB 2.800 . 3.400 2.687 2.251 3.358 . 0 0 "[ . 1]" 1
464 1 82 HIS HA 1 83 TYR H 2.800 . 2.800 2.207 2.140 2.452 . 0 0 "[ . 1]" 1
465 1 82 HIS HA 1 97 SER HA 3.400 . 3.400 3.084 2.459 3.360 . 0 0 "[ . 1]" 1
466 1 82 HIS HA 1 97 SER QB 4.200 . 5.200 4.057 2.506 5.023 . 0 0 "[ . 1]" 1
467 1 82 HIS HA 1 98 VAL H 4.200 . 4.200 3.873 3.211 4.202 0.002 5 0 "[ . 1]" 1
468 1 83 TYR H 1 83 TYR QD 4.200 . 5.200 3.094 2.804 3.758 . 0 0 "[ . 1]" 1
469 1 83 TYR H 1 84 THR MG 4.200 . 5.200 4.151 3.840 4.548 . 0 0 "[ . 1]" 1
470 1 83 TYR H 1 96 VAL H 4.200 . 4.200 3.833 3.548 4.198 . 0 0 "[ . 1]" 1
471 1 83 TYR H 1 97 SER HA 4.200 . 4.200 3.632 3.123 4.152 . 0 0 "[ . 1]" 1
472 1 83 TYR HA 1 84 THR H 2.800 . 2.800 2.373 2.250 2.469 . 0 0 "[ . 1]" 1
473 1 83 TYR QB 1 84 THR H 3.400 . 4.400 2.528 2.305 2.794 . 0 0 "[ . 1]" 1
474 1 83 TYR QD 1 84 THR H 5.000 . 6.000 3.771 3.116 4.412 . 0 0 "[ . 1]" 1
475 1 83 TYR QD 1 96 VAL QG 4.200 . 7.400 3.859 1.934 6.134 . 0 0 "[ . 1]" 1
476 1 83 TYR QD 1 98 VAL HB 5.000 . 7.400 5.502 3.612 6.928 . 0 0 "[ . 1]" 1
477 1 83 TYR QD 1 98 VAL QG 5.000 . 8.200 3.765 1.924 5.029 . 0 0 "[ . 1]" 1
478 1 84 THR H 1 84 THR HB 4.200 . 4.200 3.832 3.679 3.934 . 0 0 "[ . 1]" 1
479 1 84 THR HA 1 84 THR HB 2.800 . 2.800 2.464 2.377 2.671 . 0 0 "[ . 1]" 1
480 1 84 THR HA 1 85 TYR H 2.800 . 2.800 2.234 2.152 2.302 . 0 0 "[ . 1]" 1
481 1 84 THR HA 1 95 SER HA 2.800 . 2.800 2.560 2.240 2.803 0.003 1 0 "[ . 1]" 1
482 1 84 THR HA 1 96 VAL H 5.000 . 5.000 3.010 2.683 3.574 . 0 0 "[ . 1]" 1
483 1 84 THR HB 1 85 TYR H 3.400 . 3.400 2.925 2.671 3.252 . 0 0 "[ . 1]" 1
484 1 85 TYR H 1 94 HIS H 4.200 . 4.200 3.558 3.010 3.980 . 0 0 "[ . 1]" 1
485 1 85 TYR H 1 95 SER HA 4.200 . 4.200 3.649 3.249 4.035 . 0 0 "[ . 1]" 1
486 1 85 TYR HA 1 86 SER H 3.400 . 3.400 2.281 2.174 2.419 . 0 0 "[ . 1]" 1
487 1 86 SER H 1 86 SER QB 3.400 . 4.000 2.813 2.211 3.175 . 0 0 "[ . 1]" 1
488 1 86 SER HA 1 93 ILE HA 2.800 . 2.800 2.703 2.400 2.808 0.008 7 0 "[ . 1]" 1
489 1 86 SER HA 1 94 HIS H 4.200 . 4.200 3.707 3.423 4.051 . 0 0 "[ . 1]" 1
490 1 86 SER QB 1 93 ILE HA 5.000 . 6.000 4.110 3.581 4.683 . 0 0 "[ . 1]" 1
491 1 87 SER H 1 87 SER HA 2.800 . 2.800 2.821 2.814 2.835 0.035 8 0 "[ . 1]" 1
492 1 87 SER H 1 93 ILE HA 4.200 . 4.200 3.492 2.750 4.118 . 0 0 "[ . 1]" 1
493 1 88 PRO HA 1 89 HIS H 3.400 . 3.400 2.551 2.149 3.411 0.011 3 0 "[ . 1]" 1
494 1 88 PRO QB 1 89 HIS H 4.200 . 5.200 3.770 3.263 4.009 . 0 0 "[ . 1]" 1
495 1 89 HIS H 1 90 SER H 5.000 . 5.000 2.893 2.532 4.337 . 0 0 "[ . 1]" 1
496 1 91 GLY H 1 91 GLY QA 2.800 . 2.800 2.279 2.192 2.443 . 0 0 "[ . 1]" 1
497 1 91 GLY H 1 92 SER H 3.400 . 3.400 2.311 1.992 2.754 . 0 0 "[ . 1]" 1
498 1 91 GLY H 1 92 SER QB 4.200 . 5.200 4.297 3.555 5.169 . 0 0 "[ . 1]" 1
499 1 91 GLY QA 1 92 SER H 4.200 . 4.200 2.807 2.637 2.909 . 0 0 "[ . 1]" 1
500 1 92 SER H 1 93 ILE H 5.000 . 5.000 4.520 4.350 4.635 . 0 0 "[ . 1]" 1
501 1 92 SER HA 1 93 ILE H 2.800 . 2.800 2.276 2.141 2.328 . 0 0 "[ . 1]" 1
502 1 92 SER QB 1 93 ILE H 4.200 . 5.200 3.110 2.596 3.660 . 0 0 "[ . 1]" 1
503 1 93 ILE H 1 93 ILE HB 2.800 . 2.800 2.728 2.656 2.800 . 0 0 "[ . 1]" 1
504 1 93 ILE HA 1 94 HIS H 3.400 . 3.400 2.147 2.138 2.184 . 0 0 "[ . 1]" 1
505 1 93 ILE MD 1 94 HIS H 5.000 . 6.000 5.166 4.950 5.342 . 0 0 "[ . 1]" 1
506 1 94 HIS HA 1 95 SER H 3.400 . 3.400 2.147 2.141 2.155 . 0 0 "[ . 1]" 1
507 1 94 HIS HA 1 114 THR H 5.000 . 5.000 4.947 4.686 5.013 0.013 9 0 "[ . 1]" 1
508 1 95 SER H 1 113 GLY QA 5.000 . 5.000 3.787 3.414 4.263 . 0 0 "[ . 1]" 1
509 1 95 SER QB 1 96 VAL H 4.200 . 5.200 3.379 2.984 3.835 . 0 0 "[ . 1]" 1
510 1 95 SER QB 1 112 ARG QB 5.000 . 6.000 4.067 2.991 4.785 . 0 0 "[ . 1]" 1
511 1 95 SER QB 1 112 ARG QG 5.000 . 7.000 5.430 2.559 6.533 . 0 0 "[ . 1]" 1
512 1 96 VAL HA 1 97 SER H 3.400 . 3.400 2.180 2.144 2.198 . 0 0 "[ . 1]" 1
513 1 96 VAL HA 1 111 SER HA 2.800 . 2.800 2.607 2.287 2.804 0.004 8 0 "[ . 1]" 1
514 1 97 SER H 1 98 VAL H 5.000 . 5.000 4.301 4.131 4.451 . 0 0 "[ . 1]" 1
515 1 97 SER H 1 110 PHE H 4.200 . 4.200 3.592 2.978 4.084 . 0 0 "[ . 1]" 1
516 1 97 SER H 1 111 SER HA 4.200 . 4.200 3.739 3.415 4.203 0.003 7 0 "[ . 1]" 1
517 1 97 SER HA 1 98 VAL H 2.800 . 2.800 2.168 2.141 2.266 . 0 0 "[ . 1]" 1
518 1 97 SER QB 1 98 VAL H 3.400 . 4.400 3.475 2.761 3.820 . 0 0 "[ . 1]" 1
519 1 97 SER QB 1 110 PHE H 4.200 . 5.200 4.562 4.069 5.173 . 0 0 "[ . 1]" 1
520 1 97 SER QB 1 110 PHE QB 5.000 . 6.000 3.725 2.865 5.151 . 0 0 "[ . 1]" 1
521 1 98 VAL H 1 98 VAL HB 2.800 . 2.800 2.670 2.596 2.768 . 0 0 "[ . 1]" 1
522 1 98 VAL HA 1 99 VAL H 2.800 . 2.800 2.165 2.139 2.229 . 0 0 "[ . 1]" 1
523 1 98 VAL HA 1 100 GLU H 4.200 . 4.200 4.186 4.129 4.227 0.027 1 0 "[ . 1]" 1
524 1 98 VAL HA 1 109 LEU HA 4.200 . 4.200 2.579 2.112 3.205 . 0 0 "[ . 1]" 1
525 1 98 VAL HB 1 99 VAL H 4.200 . 4.200 4.131 3.886 4.228 0.028 8 0 "[ . 1]" 1
526 1 98 VAL QG 1 99 VAL H 4.200 . 6.600 2.533 2.149 2.922 . 0 0 "[ . 1]" 1
527 1 98 VAL QG 1 100 GLU H 4.200 . 6.600 2.638 2.180 3.077 . 0 0 "[ . 1]" 1
528 1 98 VAL QG 1 101 ALA H 6.000 . 8.400 4.087 3.786 4.479 . 0 0 "[ . 1]" 1
529 1 98 VAL QG 1 109 LEU QD 5.000 . 7.400 2.097 1.790 3.431 0.010 8 0 "[ . 1]" 1
530 1 99 VAL H 1 99 VAL HB 3.400 . 3.400 2.649 2.597 2.715 . 0 0 "[ . 1]" 1
531 1 99 VAL H 1 109 LEU HA 4.200 . 4.200 3.286 2.946 3.720 . 0 0 "[ . 1]" 1
532 1 99 VAL HA 1 100 GLU H 4.200 . 4.200 3.567 3.556 3.575 . 0 0 "[ . 1]" 1
533 1 100 GLU H 1 108 LEU H 4.200 . 4.200 3.701 2.868 4.203 0.003 7 0 "[ . 1]" 1
534 1 100 GLU H 1 108 LEU QB 3.200 . 3.800 3.030 2.149 3.807 0.007 9 0 "[ . 1]" 1
535 1 100 GLU H 1 108 LEU QD 5.000 . 7.400 3.795 3.229 4.470 . 0 0 "[ . 1]" 1
536 1 100 GLU H 1 109 LEU HA 5.000 . 5.000 4.856 4.361 5.008 0.008 7 0 "[ . 1]" 1
537 1 101 ALA HA 1 107 ALA HA 2.800 . 2.800 2.804 2.752 2.814 0.014 9 0 "[ . 1]" 1
538 1 101 ALA HA 1 108 LEU H 4.200 . 4.200 3.380 2.657 3.898 . 0 0 "[ . 1]" 1
539 1 106 TYR H 1 106 TYR QE 5.000 . 7.400 4.373 3.750 4.705 . 0 0 "[ . 1]" 1
540 1 106 TYR HA 1 107 ALA H 3.400 . 3.400 2.351 2.269 2.395 . 0 0 "[ . 1]" 1
541 1 106 TYR HA 1 128 SER HA 4.200 . 4.200 3.061 1.977 3.644 . 0 0 "[ . 1]" 1
542 1 106 TYR QB 1 137 LEU QD 5.000 . 7.400 2.231 1.851 3.134 . 0 0 "[ . 1]" 1
543 1 106 TYR QD 1 140 LYS QE 5.000 . 7.400 5.552 4.086 7.103 . 0 0 "[ . 1]" 1
544 1 106 TYR QE 1 107 ALA H 5.000 . 7.400 5.811 5.462 6.477 . 0 0 "[ . 1]" 1
545 1 106 TYR QE 1 107 ALA HA 5.000 . 7.400 5.333 4.662 6.232 . 0 0 "[ . 1]" 1
546 1 106 TYR QE 1 108 LEU H 5.000 . 7.400 5.361 4.313 7.405 0.005 7 0 "[ . 1]" 1
547 1 106 TYR QE 1 137 LEU QD 5.000 . 7.400 3.185 2.513 3.893 . 0 0 "[ . 1]" 1
548 1 107 ALA H 1 127 TYR H 4.200 . 4.200 4.036 3.774 4.178 . 0 0 "[ . 1]" 1
549 1 107 ALA H 1 127 TYR QB 4.200 . 5.200 3.566 3.110 3.918 . 0 0 "[ . 1]" 1
550 1 107 ALA H 1 128 SER HA 4.200 . 4.200 3.755 2.947 4.179 . 0 0 "[ . 1]" 1
551 1 107 ALA HA 1 108 LEU H 4.200 . 4.200 2.190 2.161 2.293 . 0 0 "[ . 1]" 1
552 1 107 ALA MB 1 108 LEU H 4.200 . 5.200 2.989 2.656 3.113 . 0 0 "[ . 1]" 1
553 1 107 ALA MB 1 109 LEU QD 6.000 . 8.400 3.371 2.057 4.472 . 0 0 "[ . 1]" 1
554 1 107 ALA MB 1 127 TYR QB 5.000 . 6.000 2.741 2.356 3.316 . 0 0 "[ . 1]" 1
555 1 108 LEU H 1 109 LEU H 5.000 . 5.000 4.391 4.327 4.427 . 0 0 "[ . 1]" 1
556 1 108 LEU HA 1 109 LEU H 2.800 . 2.800 2.137 2.123 2.154 . 0 0 "[ . 1]" 1
557 1 108 LEU HA 1 126 LEU HA 2.800 . 2.800 2.612 2.455 2.815 0.015 1 0 "[ . 1]" 1
558 1 108 LEU HA 1 127 TYR H 4.200 . 4.200 3.768 3.533 3.921 . 0 0 "[ . 1]" 1
559 1 108 LEU QB 1 109 LEU H 5.000 . 6.000 3.605 3.255 3.793 . 0 0 "[ . 1]" 1
560 1 108 LEU QD 1 140 LYS QB 5.000 . 7.400 4.549 3.246 5.301 . 0 0 "[ . 1]" 1
561 1 108 LEU QD 1 141 PHE H 6.000 . 8.400 5.727 4.784 6.333 . 0 0 "[ . 1]" 1
562 1 108 LEU QD 1 141 PHE QD 5.000 . 7.400 3.398 2.746 4.406 . 0 0 "[ . 1]" 1
563 1 108 LEU QD 1 144 PHE QD 5.000 . 7.400 3.365 2.431 4.462 . 0 0 "[ . 1]" 1
564 1 108 LEU QD 1 144 PHE QE 5.000 . 7.400 3.174 1.960 5.017 . 0 0 "[ . 1]" 1
565 1 108 LEU HG 1 126 LEU QD 3.200 . 5.600 2.190 1.823 2.925 . 0 0 "[ . 1]" 1
566 1 109 LEU H 1 125 THR H 4.200 . 4.200 3.500 3.203 3.774 . 0 0 "[ . 1]" 1
567 1 109 LEU H 1 125 THR HB 4.200 . 4.200 3.601 3.133 3.893 . 0 0 "[ . 1]" 1
568 1 109 LEU H 1 126 LEU HA 4.200 . 4.200 3.164 2.895 3.513 . 0 0 "[ . 1]" 1
569 1 109 LEU HA 1 109 LEU HG 4.200 . 4.200 3.313 2.710 3.715 . 0 0 "[ . 1]" 1
570 1 109 LEU HA 1 110 PHE H 2.800 . 2.800 2.232 2.186 2.254 . 0 0 "[ . 1]" 1
571 1 109 LEU QB 1 110 PHE H 4.200 . 5.200 3.148 2.811 3.658 . 0 0 "[ . 1]" 1
572 1 109 LEU QB 1 125 THR H 4.200 . 5.200 3.854 3.097 4.767 . 0 0 "[ . 1]" 1
573 1 109 LEU QB 1 125 THR HB 3.400 . 4.400 2.695 1.972 4.191 . 0 0 "[ . 1]" 1
574 1 109 LEU QD 1 125 THR HB 4.200 . 6.600 2.879 1.879 4.009 . 0 0 "[ . 1]" 1
575 1 109 LEU QD 1 125 THR MG 6.000 . 8.400 3.355 2.086 4.338 . 0 0 "[ . 1]" 1
576 1 109 LEU HG 1 125 THR HB 4.200 . 4.200 3.611 1.982 4.209 0.009 10 0 "[ . 1]" 1
577 1 110 PHE H 1 110 PHE QD 5.000 . 6.000 3.606 2.526 4.381 . 0 0 "[ . 1]" 1
578 1 110 PHE HA 1 124 ALA HA 3.400 . 3.400 2.212 2.086 2.318 . 0 0 "[ . 1]" 1
579 1 110 PHE HA 1 125 THR H 4.200 . 4.200 2.756 2.482 3.186 . 0 0 "[ . 1]" 1
580 1 110 PHE QD 1 111 SER H 3.400 . 5.800 3.745 3.228 4.080 . 0 0 "[ . 1]" 1
581 1 110 PHE QD 1 111 SER HA 5.000 . 7.400 4.974 3.931 6.019 . 0 0 "[ . 1]" 1
582 1 110 PHE QD 1 124 ALA MB 4.200 . 5.200 3.092 2.071 5.083 . 0 0 "[ . 1]" 1
583 1 110 PHE QE 1 111 SER H 5.000 . 7.400 5.289 4.355 6.173 . 0 0 "[ . 1]" 1
584 1 111 SER H 1 123 MET H 4.200 . 4.200 3.523 3.105 3.922 . 0 0 "[ . 1]" 1
585 1 111 SER H 1 124 ALA H 4.200 . 4.200 4.253 4.231 4.268 0.068 7 0 "[ . 1]" 1
586 1 111 SER HA 1 112 ARG H 4.200 . 4.200 2.178 2.137 2.233 . 0 0 "[ . 1]" 1
587 1 112 ARG HA 1 112 ARG QD 5.000 . 5.000 3.168 2.210 4.064 . 0 0 "[ . 1]" 1
588 1 112 ARG HA 1 113 GLY H 3.400 . 3.400 2.263 2.189 2.385 . 0 0 "[ . 1]" 1
589 1 112 ARG HA 1 122 ARG HA 2.800 . 2.800 2.756 2.308 2.808 0.008 4 0 "[ . 1]" 1
590 1 112 ARG HA 1 123 MET H 4.200 . 4.200 3.080 2.665 3.536 . 0 0 "[ . 1]" 1
591 1 112 ARG QB 1 113 GLY H 4.200 . 5.200 3.164 2.466 3.553 . 0 0 "[ . 1]" 1
592 1 112 ARG QD 1 113 GLY H 5.000 . 6.000 2.844 1.982 3.985 . 0 0 "[ . 1]" 1
593 1 112 ARG QD 1 121 PHE H 4.200 . 5.200 4.472 3.814 5.200 . 8 0 "[ . 1]" 1
594 1 113 GLY H 1 114 THR H 5.000 . 5.000 4.389 4.280 4.471 . 0 0 "[ . 1]" 1
595 1 113 GLY H 1 121 PHE H 4.200 . 4.200 3.387 3.053 3.679 . 0 0 "[ . 1]" 1
596 1 113 GLY H 1 121 PHE QB 4.200 . 5.200 2.762 2.205 3.660 . 0 0 "[ . 1]" 1
597 1 113 GLY H 1 121 PHE QD 4.200 . 5.200 4.091 3.178 4.855 . 0 0 "[ . 1]" 1
598 1 113 GLY H 1 122 ARG HA 5.000 . 5.000 3.757 3.498 4.119 . 0 0 "[ . 1]" 1
599 1 113 GLY QA 1 114 THR H 2.800 . 3.800 2.243 2.183 2.282 . 0 0 "[ . 1]" 1
600 1 113 GLY QA 1 121 PHE H 4.200 . 5.200 3.724 3.453 4.293 . 0 0 "[ . 1]" 1
601 1 113 GLY QA 1 121 PHE QD 5.000 . 6.000 3.607 2.385 5.172 . 0 0 "[ . 1]" 1
602 1 114 THR H 1 114 THR HB 2.800 . 2.800 2.544 2.494 2.639 . 0 0 "[ . 1]" 1
603 1 114 THR H 1 115 LYS H 2.800 . 2.800 2.108 1.910 2.288 . 0 0 "[ . 1]" 1
604 1 114 THR H 1 115 LYS QB 4.200 . 5.200 4.492 4.326 4.684 . 0 0 "[ . 1]" 1
605 1 114 THR HA 1 114 THR HB 2.800 . 2.800 2.946 2.943 2.950 0.150 8 0 "[ . 1]" 1
606 1 114 THR HA 1 115 LYS H 2.800 . 2.800 3.137 3.133 3.140 0.340 9 0 "[ . 1]" 1
607 1 114 THR HA 1 119 GLN QB 5.000 . 6.000 5.511 5.183 5.861 . 0 0 "[ . 1]" 1
608 1 114 THR HA 1 120 ASP HA 2.800 . 2.800 2.819 2.795 2.838 0.038 7 0 "[ . 1]" 1
609 1 114 THR HA 1 121 PHE H 5.000 . 5.000 3.267 2.797 3.767 . 0 0 "[ . 1]" 1
610 1 114 THR HB 1 115 LYS H 2.800 . 2.800 2.984 2.962 3.000 0.200 4 0 "[ . 1]" 1
611 1 115 LYS H 1 115 LYS HA 2.800 . 2.800 2.311 2.291 2.361 . 0 0 "[ . 1]" 1
612 1 115 LYS H 1 115 LYS QB 2.800 . 3.400 2.811 2.568 2.929 . 0 0 "[ . 1]" 1
613 1 115 LYS H 1 115 LYS QD 4.200 . 5.200 4.279 3.558 5.078 . 0 0 "[ . 1]" 1
614 1 115 LYS H 1 116 GLY H 4.200 . 4.200 3.462 2.713 3.916 . 0 0 "[ . 1]" 1
615 1 115 LYS H 1 120 ASP H 5.000 . 5.000 4.838 4.673 5.016 0.016 8 0 "[ . 1]" 1
616 1 115 LYS HA 1 116 GLY H 2.800 . 2.800 2.346 2.158 2.816 0.016 2 0 "[ . 1]" 1
617 1 115 LYS QB 1 116 GLY H 4.200 . 5.200 3.903 3.712 4.015 . 0 0 "[ . 1]" 1
618 1 115 LYS QB 1 119 GLN H 4.200 . 5.200 2.727 2.032 3.553 . 0 0 "[ . 1]" 1
619 1 115 LYS QG 1 116 GLY H 4.200 . 5.200 3.997 3.146 4.473 . 0 0 "[ . 1]" 1
620 1 116 GLY H 1 116 GLY QA 2.800 . 2.800 2.197 2.181 2.235 . 0 0 "[ . 1]" 1
621 1 116 GLY H 1 117 PRO QD 5.000 . 6.000 4.149 3.935 4.394 . 0 0 "[ . 1]" 1
622 1 116 GLY H 1 119 GLN QB 4.200 . 5.200 4.962 4.718 5.202 0.002 6 0 "[ . 1]" 1
623 1 116 GLY QA 1 117 PRO QG 5.000 . 6.000 3.702 3.525 3.829 . 0 0 "[ . 1]" 1
624 1 116 GLY QA 1 118 GLY H 4.200 . 5.200 3.852 3.763 3.939 . 0 0 "[ . 1]" 1
625 1 117 PRO HA 1 118 GLY H 2.800 . 2.800 2.738 2.645 2.812 0.012 6 0 "[ . 1]" 1
626 1 117 PRO QB 1 118 GLY H 4.200 . 5.200 3.991 3.949 4.017 . 0 0 "[ . 1]" 1
627 1 117 PRO QD 1 118 GLY H 4.200 . 5.200 3.927 3.716 4.108 . 0 0 "[ . 1]" 1
628 1 118 GLY H 1 118 GLY QA 2.800 . 2.800 2.191 2.188 2.195 . 0 0 "[ . 1]" 1
629 1 118 GLY H 1 119 GLN H 2.800 . 2.800 2.827 2.808 2.845 0.045 2 0 "[ . 1]" 1
630 1 118 GLY H 1 119 GLN QB 4.200 . 5.200 4.469 4.374 4.677 . 0 0 "[ . 1]" 1
631 1 118 GLY QA 1 119 GLN H 2.800 . 3.800 2.661 2.573 2.728 . 0 0 "[ . 1]" 1
632 1 119 GLN H 1 119 GLN HA 2.800 . 2.800 2.858 2.856 2.860 0.060 7 0 "[ . 1]" 1
633 1 119 GLN H 1 119 GLN QB 2.800 . 3.400 2.208 2.167 2.268 . 0 0 "[ . 1]" 1
634 1 119 GLN H 1 120 ASP H 3.400 . 3.400 2.525 2.507 2.547 . 0 0 "[ . 1]" 1
635 1 119 GLN HA 1 120 ASP H 2.800 . 2.800 3.016 3.013 3.018 0.218 7 0 "[ . 1]" 1
636 1 119 GLN QB 1 120 ASP H 4.200 . 5.200 3.501 3.490 3.521 . 0 0 "[ . 1]" 1
637 1 120 ASP H 1 120 ASP HA 2.800 . 2.800 2.297 2.282 2.324 . 0 0 "[ . 1]" 1
638 1 120 ASP H 1 121 PHE H 3.400 . 3.400 3.416 3.345 3.445 0.045 4 0 "[ . 1]" 1
639 1 120 ASP HA 1 120 ASP QB 2.800 . 2.800 2.399 2.182 2.541 . 0 0 "[ . 1]" 1
640 1 120 ASP HA 1 121 PHE H 3.400 . 3.400 2.331 2.255 2.468 . 0 0 "[ . 1]" 1
641 1 120 ASP QB 1 121 PHE H 4.200 . 5.200 3.902 3.767 4.041 . 0 0 "[ . 1]" 1
642 1 121 PHE H 1 121 PHE QD 4.200 . 6.600 4.131 3.983 4.221 . 0 0 "[ . 1]" 1
643 1 122 ARG H 1 122 ARG QD 4.200 . 4.800 4.208 2.055 4.768 . 0 0 "[ . 1]" 1
644 1 122 ARG QB 1 123 MET H 4.200 . 5.200 3.376 2.854 3.712 . 0 0 "[ . 1]" 1
645 1 123 MET HA 1 124 ALA H 2.800 . 2.800 2.159 2.138 2.176 . 0 0 "[ . 1]" 1
646 1 123 MET QB 1 124 ALA H 4.200 . 5.200 3.363 3.062 3.627 . 0 0 "[ . 1]" 1
647 1 124 ALA H 1 125 THR H 5.000 . 5.000 4.353 4.229 4.498 . 0 0 "[ . 1]" 1
648 1 124 ALA HA 1 125 THR H 2.800 . 2.800 2.186 2.155 2.221 . 0 0 "[ . 1]" 1
649 1 124 ALA MB 1 125 THR H 4.200 . 5.200 3.065 2.944 3.227 . 0 0 "[ . 1]" 1
650 1 124 ALA MB 1 141 PHE QD 4.200 . 6.600 4.763 4.303 5.141 . 0 0 "[ . 1]" 1
651 1 124 ALA MB 1 144 PHE QD 5.000 . 7.400 4.742 4.321 5.351 . 0 0 "[ . 1]" 1
652 1 124 ALA MB 1 144 PHE QE 4.200 . 6.600 4.106 3.335 4.558 . 0 0 "[ . 1]" 1
653 1 124 ALA MB 1 150 LEU QD 6.000 . 8.400 4.274 2.972 6.383 . 0 0 "[ . 1]" 1
654 1 125 THR H 1 125 THR HB 3.400 . 3.400 3.012 2.758 3.409 0.009 1 0 "[ . 1]" 1
655 1 125 THR H 1 126 LEU H 5.000 . 5.000 4.361 4.236 4.432 . 0 0 "[ . 1]" 1
656 1 125 THR H 1 141 PHE QE 5.000 . 7.400 4.527 3.757 5.042 . 0 0 "[ . 1]" 1
657 1 125 THR HA 1 126 LEU H 3.400 . 3.400 2.150 2.122 2.177 . 0 0 "[ . 1]" 1
658 1 125 THR HB 1 126 LEU H 5.000 . 5.000 3.739 3.183 4.192 . 0 0 "[ . 1]" 1
659 1 126 LEU H 1 127 TYR H 5.000 . 5.000 3.721 3.649 3.864 . 0 0 "[ . 1]" 1
660 1 126 LEU H 1 141 PHE QD 5.000 . 7.400 5.090 4.420 5.457 . 0 0 "[ . 1]" 1
661 1 126 LEU HA 1 126 LEU QB 3.400 2.400 3.400 2.419 2.356 2.460 0.044 5 0 "[ . 1]" 1
662 1 126 LEU HA 1 127 TYR H 2.800 . 2.800 2.215 2.181 2.235 . 0 0 "[ . 1]" 1
663 1 126 LEU QB 1 127 TYR H 4.200 . 5.200 3.986 3.978 4.002 . 0 0 "[ . 1]" 1
664 1 126 LEU QB 1 141 PHE QD 5.000 . 7.400 2.702 2.148 3.317 . 0 0 "[ . 1]" 1
665 1 126 LEU HG 1 127 TYR H 4.200 . 4.200 3.930 3.614 4.211 0.011 1 0 "[ . 1]" 1
666 1 126 LEU HG 1 141 PHE QD 5.000 . 7.400 4.450 3.919 4.967 . 0 0 "[ . 1]" 1
667 1 127 TYR H 1 128 SER H 5.000 . 5.000 4.617 4.609 4.622 . 0 0 "[ . 1]" 1
668 1 127 TYR HA 1 128 SER H 2.800 . 2.800 2.256 2.237 2.261 . 0 0 "[ . 1]" 1
669 1 127 TYR QB 1 128 SER H 5.000 . 6.000 2.852 2.810 2.950 . 0 0 "[ . 1]" 1
670 1 128 SER HA 1 129 ARG H 3.400 . 3.400 2.213 2.147 2.367 . 0 0 "[ . 1]" 1
671 1 128 SER HA 1 130 THR H 5.000 . 6.000 4.058 3.735 4.810 . 0 0 "[ . 1]" 1
672 1 128 SER QB 1 130 THR H 4.200 . 5.200 3.029 2.519 3.890 . 0 0 "[ . 1]" 1
673 1 128 SER QB 1 133 LEU HG 5.000 . 6.000 5.797 5.370 6.024 0.024 7 0 "[ . 1]" 1
674 1 128 SER QB 1 137 LEU QD 5.000 . 7.400 3.659 2.719 4.818 . 0 0 "[ . 1]" 1
675 1 129 ARG H 1 130 THR H 3.400 . 3.400 2.719 2.306 3.004 . 0 0 "[ . 1]" 1
676 1 130 THR H 1 130 THR HB 4.200 . 4.200 3.619 3.452 3.730 . 0 0 "[ . 1]" 1
677 1 130 THR H 1 130 THR MG 4.200 . 5.200 3.068 2.266 3.852 . 0 0 "[ . 1]" 1
678 1 130 THR H 1 131 GLN H 5.000 . 5.000 4.495 4.329 4.639 . 0 0 "[ . 1]" 1
679 1 130 THR H 1 132 THR H 5.000 . 5.000 4.541 3.883 4.935 . 0 0 "[ . 1]" 1
680 1 130 THR HA 1 130 THR HB 2.800 . 2.800 2.624 2.480 2.778 . 0 0 "[ . 1]" 1
681 1 130 THR HA 1 131 GLN H 2.800 . 2.800 2.481 2.298 2.731 . 0 0 "[ . 1]" 1
682 1 130 THR HB 1 131 GLN H 2.800 . 2.800 2.346 1.953 2.737 . 0 0 "[ . 1]" 1
683 1 131 GLN H 1 131 GLN HA 2.800 . 2.800 2.811 2.787 2.903 0.103 6 0 "[ . 1]" 1
684 1 131 GLN H 1 131 GLN QB 2.800 . 3.400 2.407 2.045 2.702 . 0 0 "[ . 1]" 1
685 1 131 GLN H 1 132 THR H 2.800 . 2.800 2.670 2.539 2.821 0.021 6 0 "[ . 1]" 1
686 1 131 GLN HA 1 131 GLN QG 2.800 . 3.400 2.629 2.028 3.341 . 0 0 "[ . 1]" 1
687 1 131 GLN HA 1 132 THR H 3.400 . 3.400 3.387 2.918 3.473 0.073 1 0 "[ . 1]" 1
688 1 131 GLN QB 1 132 THR H 3.400 . 4.400 3.204 2.801 4.034 . 0 0 "[ . 1]" 1
689 1 132 THR H 1 132 THR HA 2.800 . 2.800 2.880 2.820 2.915 0.115 2 0 "[ . 1]" 1
690 1 132 THR H 1 132 THR HB 2.800 . 2.800 2.796 2.583 2.883 0.083 10 0 "[ . 1]" 1
691 1 132 THR H 1 133 LEU H 4.200 . 4.200 4.246 4.213 4.307 0.107 5 0 "[ . 1]" 1
692 1 132 THR HA 1 132 THR HB 2.800 . 2.800 2.688 2.435 2.983 0.183 6 0 "[ . 1]" 1
693 1 132 THR HA 1 133 LEU H 2.800 . 2.800 2.487 2.166 2.815 0.015 2 0 "[ . 1]" 1
694 1 133 LEU H 1 133 LEU HA 2.800 . 2.800 2.905 2.893 2.918 0.118 4 0 "[ . 1]" 1
695 1 133 LEU H 1 133 LEU QB 2.800 . 3.400 2.952 2.779 3.020 . 0 0 "[ . 1]" 1
696 1 133 LEU H 1 133 LEU HG 2.800 . 2.800 2.800 2.706 2.822 0.022 4 0 "[ . 1]" 1
697 1 133 LEU H 1 134 LYS H 4.200 . 4.200 4.297 4.255 4.352 0.152 2 0 "[ . 1]" 1
698 1 133 LEU HA 1 134 LYS H 2.800 . 2.800 2.208 2.158 2.309 . 0 0 "[ . 1]" 1
699 1 133 LEU QB 1 134 LYS H 4.200 . 5.200 3.071 2.642 3.284 . 0 0 "[ . 1]" 1
700 1 133 LEU QD 1 157 PHE QD 4.200 . 6.600 2.766 1.826 4.754 . 0 0 "[ . 1]" 1
701 1 133 LEU HG 1 134 LYS HA 4.200 . 4.200 4.235 4.213 4.254 0.054 4 0 "[ . 1]" 1
702 1 134 LYS H 1 134 LYS QB 2.800 . 3.400 2.224 2.138 2.450 . 0 0 "[ . 1]" 1
703 1 134 LYS H 1 135 ASP H 4.200 . 4.200 4.339 4.334 4.352 0.152 6 0 "[ . 1]" 1
704 1 134 LYS H 1 136 GLU H 4.200 . 4.200 4.492 4.457 4.518 0.318 8 0 "[ . 1]" 1
705 1 134 LYS H 1 137 LEU H 4.200 . 4.200 3.569 3.497 3.615 . 0 0 "[ . 1]" 1
706 1 134 LYS H 1 137 LEU QD 4.200 . 6.600 3.083 2.518 4.153 . 0 0 "[ . 1]" 1
707 1 134 LYS HA 1 135 ASP H 2.800 . 2.800 2.048 2.036 2.056 . 0 0 "[ . 1]" 1
708 1 134 LYS HA 1 136 GLU H 3.400 . 3.400 3.475 3.460 3.498 0.098 6 0 "[ . 1]" 1
709 1 134 LYS HA 1 137 LEU H 4.200 . 4.200 4.222 4.210 4.235 0.035 9 0 "[ . 1]" 1
710 1 134 LYS QB 1 135 ASP H 2.800 . 3.800 3.155 2.896 3.440 . 0 0 "[ . 1]" 1
711 1 135 ASP H 1 135 ASP HA 2.800 . 2.800 2.765 2.761 2.768 . 0 0 "[ . 1]" 1
712 1 135 ASP H 1 135 ASP QB 2.800 . 3.400 2.227 2.054 2.609 . 0 0 "[ . 1]" 1
713 1 135 ASP H 1 136 GLU H 2.800 . 2.800 2.550 2.537 2.561 . 0 0 "[ . 1]" 1
714 1 135 ASP H 1 136 GLU QB 4.200 . 5.200 4.246 4.200 4.344 . 0 0 "[ . 1]" 1
715 1 135 ASP H 1 137 LEU H 4.200 . 4.200 4.186 4.145 4.214 0.014 9 0 "[ . 1]" 1
716 1 135 ASP HA 1 135 ASP QB 2.800 . 2.800 2.434 2.188 2.539 . 0 0 "[ . 1]" 1
717 1 135 ASP HA 1 136 GLU H 4.200 . 4.200 3.371 3.368 3.374 . 0 0 "[ . 1]" 1
718 1 135 ASP HA 1 138 LYS H 4.200 . 4.200 3.020 2.959 3.073 . 0 0 "[ . 1]" 1
719 1 135 ASP HA 1 138 LYS QB 5.000 . 6.000 1.767 1.761 1.771 0.039 6 0 "[ . 1]" 1
720 1 136 GLU H 1 136 GLU HA 2.800 . 2.800 2.860 2.857 2.862 0.062 3 0 "[ . 1]" 1
721 1 136 GLU H 1 136 GLU QB 2.800 . 3.400 2.179 2.082 2.280 . 0 0 "[ . 1]" 1
722 1 136 GLU H 1 136 GLU QG 4.200 . 5.200 3.787 3.141 4.076 . 0 0 "[ . 1]" 1
723 1 136 GLU H 1 137 LEU H 2.800 . 2.800 2.311 2.293 2.323 . 0 0 "[ . 1]" 1
724 1 136 GLU H 1 138 LYS H 2.800 . 2.800 3.082 3.077 3.094 0.294 4 0 "[ . 1]" 1
725 1 136 GLU HA 1 136 GLU QG 2.800 . 3.800 2.255 2.032 2.708 . 0 0 "[ . 1]" 1
726 1 136 GLU HA 1 137 LEU H 3.400 . 3.400 3.430 3.426 3.435 0.035 9 0 "[ . 1]" 1
727 1 136 GLU HA 1 139 GLU H 4.200 . 4.200 3.044 2.947 3.096 . 0 0 "[ . 1]" 1
728 1 136 GLU HA 1 139 GLU QB 2.800 . 2.800 2.214 2.010 2.419 . 0 0 "[ . 1]" 1
729 1 136 GLU QB 1 137 LEU H 3.400 . 4.400 2.431 2.391 2.509 . 0 0 "[ . 1]" 1
730 1 137 LEU H 1 137 LEU HA 2.800 . 2.800 2.849 2.844 2.854 0.054 9 0 "[ . 1]" 1
731 1 137 LEU H 1 137 LEU QB 2.800 . 3.400 2.184 2.067 2.424 . 0 0 "[ . 1]" 1
732 1 137 LEU H 1 137 LEU QD 4.200 . 4.200 3.248 2.212 3.748 . 0 0 "[ . 1]" 1
733 1 137 LEU H 1 138 LYS H 2.800 . 2.800 2.147 2.138 2.155 . 0 0 "[ . 1]" 1
734 1 137 LEU H 1 139 GLU H 3.400 . 3.400 3.519 3.513 3.525 0.125 5 0 "[ . 1]" 1
735 1 137 LEU H 1 140 LYS H 5.000 . 5.000 4.743 4.592 4.933 . 0 0 "[ . 1]" 1
736 1 137 LEU HA 1 138 LYS H 4.200 . 4.200 3.461 3.456 3.469 . 0 0 "[ . 1]" 1
737 1 137 LEU HA 1 140 LYS QB 2.800 . 3.800 2.886 2.542 3.343 . 0 0 "[ . 1]" 1
738 1 137 LEU HA 1 140 LYS QD 5.000 . 7.400 4.489 2.205 6.222 . 0 0 "[ . 1]" 1
739 1 137 LEU QB 1 138 LYS H 2.800 . 3.800 2.765 2.705 2.825 . 0 0 "[ . 1]" 1
740 1 138 LYS H 1 138 LYS QB 2.800 . 3.400 2.230 2.158 2.311 . 0 0 "[ . 1]" 1
741 1 138 LYS H 1 139 GLU H 2.800 . 2.800 2.368 2.361 2.375 . 0 0 "[ . 1]" 1
742 1 138 LYS H 1 140 LYS H 5.000 . 5.000 4.109 4.029 4.183 . 0 0 "[ . 1]" 1
743 1 138 LYS HA 1 139 GLU H 4.200 . 4.200 3.460 3.456 3.463 . 0 0 "[ . 1]" 1
744 1 138 LYS HA 1 141 PHE H 4.200 . 4.200 3.561 3.417 3.690 . 0 0 "[ . 1]" 1
745 1 138 LYS HA 1 141 PHE QB 5.000 . 6.000 3.198 2.970 3.396 . 0 0 "[ . 1]" 1
746 1 138 LYS HA 1 142 THR H 5.000 . 5.000 4.665 4.285 4.939 . 0 0 "[ . 1]" 1
747 1 138 LYS QB 1 139 GLU H 2.800 . 3.800 2.769 2.742 2.818 . 0 0 "[ . 1]" 1
748 1 138 LYS QD 1 157 PHE QD 4.200 . 6.600 3.136 1.946 3.817 . 0 0 "[ . 1]" 1
749 1 138 LYS QE 1 157 PHE QD 5.000 . 7.400 3.291 2.054 4.239 . 0 0 "[ . 1]" 1
750 1 139 GLU H 1 140 LYS H 4.200 . 4.200 2.654 2.579 2.742 . 0 0 "[ . 1]" 1
751 1 139 GLU H 1 141 PHE H 5.000 . 5.000 4.188 4.058 4.282 . 0 0 "[ . 1]" 1
752 1 139 GLU HA 1 139 GLU QG 3.400 . 4.000 2.168 2.017 2.407 . 0 0 "[ . 1]" 1
753 1 139 GLU HA 1 140 LYS H 4.200 . 4.200 3.523 3.513 3.541 . 0 0 "[ . 1]" 1
754 1 139 GLU HA 1 142 THR H 3.400 . 3.400 3.247 3.121 3.414 0.014 3 0 "[ . 1]" 1
755 1 139 GLU HA 1 142 THR HB 4.200 . 4.200 3.720 2.628 4.203 0.003 9 0 "[ . 1]" 1
756 1 139 GLU HA 1 143 THR H 4.200 . 4.200 3.856 3.613 4.026 . 0 0 "[ . 1]" 1
757 1 139 GLU QB 1 140 LYS H 2.800 . 3.800 2.712 2.519 2.811 . 0 0 "[ . 1]" 1
758 1 140 LYS H 1 140 LYS HA 2.800 . 2.800 2.792 2.783 2.822 0.022 3 0 "[ . 1]" 1
759 1 140 LYS H 1 140 LYS QB 2.800 . 3.400 2.141 2.044 2.305 . 0 0 "[ . 1]" 1
760 1 140 LYS H 1 141 PHE H 2.800 . 2.800 2.648 2.546 2.682 . 0 0 "[ . 1]" 1
761 1 140 LYS H 1 142 THR H 4.200 . 4.200 4.048 3.879 4.198 . 0 0 "[ . 1]" 1
762 1 140 LYS HA 1 140 LYS QB 2.800 . 2.800 2.479 2.351 2.533 . 0 0 "[ . 1]" 1
763 1 140 LYS HA 1 141 PHE H 3.400 . 3.400 3.467 3.464 3.472 0.072 1 0 "[ . 1]" 1
764 1 140 LYS HA 1 143 THR H 4.200 . 4.200 3.706 3.555 3.837 . 0 0 "[ . 1]" 1
765 1 140 LYS HA 1 143 THR HB 3.400 . 3.400 3.206 2.804 3.400 . 0 0 "[ . 1]" 1
766 1 140 LYS HA 1 144 PHE H 4.200 . 4.200 4.030 3.786 4.204 0.004 4 0 "[ . 1]" 1
767 1 140 LYS QB 1 141 PHE H 2.800 . 3.800 2.719 2.673 2.791 . 0 0 "[ . 1]" 1
768 1 141 PHE H 1 141 PHE HA 2.800 . 2.800 2.846 2.831 2.855 0.055 1 0 "[ . 1]" 1
769 1 141 PHE H 1 141 PHE QB 2.800 . 3.400 2.226 2.154 2.278 . 0 0 "[ . 1]" 1
770 1 141 PHE H 1 141 PHE QD 5.000 . 6.000 4.071 3.856 4.180 . 0 0 "[ . 1]" 1
771 1 141 PHE H 1 142 THR H 3.400 . 3.400 2.470 2.415 2.521 . 0 0 "[ . 1]" 1
772 1 141 PHE H 1 143 THR H 5.000 . 5.000 4.198 3.840 4.288 . 0 0 "[ . 1]" 1
773 1 141 PHE HA 1 142 THR H 3.400 . 3.400 3.472 3.451 3.505 0.105 10 0 "[ . 1]" 1
774 1 141 PHE HA 1 144 PHE H 4.200 . 4.200 3.739 3.603 3.865 . 0 0 "[ . 1]" 1
775 1 141 PHE HA 1 144 PHE QB 4.200 . 5.200 2.778 2.615 2.904 . 0 0 "[ . 1]" 1
776 1 141 PHE HA 1 144 PHE QD 3.400 . 4.400 3.772 3.637 3.811 . 0 0 "[ . 1]" 1
777 1 141 PHE HA 1 145 SER H 4.200 . 4.200 3.960 3.837 4.201 0.001 10 0 "[ . 1]" 1
778 1 141 PHE QB 1 142 THR H 3.400 . 4.400 2.781 2.626 2.924 . 0 0 "[ . 1]" 1
779 1 141 PHE QD 1 142 THR H 4.200 . 5.200 4.410 3.998 4.604 . 0 0 "[ . 1]" 1
780 1 141 PHE QD 1 155 ILE MG 5.000 . 7.000 2.277 1.967 2.585 . 0 0 "[ . 1]" 1
781 1 141 PHE QD 1 156 VAL H 5.000 . 7.400 4.900 4.213 5.613 . 0 0 "[ . 1]" 1
782 1 142 THR H 1 143 THR H 3.400 . 3.400 2.562 2.453 2.718 . 0 0 "[ . 1]" 1
783 1 142 THR H 1 144 PHE H 5.000 . 5.000 3.930 3.856 4.026 . 0 0 "[ . 1]" 1
784 1 142 THR H 1 155 ILE MD 6.000 . 7.000 5.324 4.344 6.537 . 0 0 "[ . 1]" 1
785 1 142 THR HA 1 143 THR H 4.200 . 4.200 3.550 3.501 3.560 . 0 0 "[ . 1]" 1
786 1 142 THR HA 1 145 SER H 3.400 . 3.400 3.397 3.341 3.407 0.007 8 0 "[ . 1]" 1
787 1 142 THR HA 1 146 LYS H 5.000 . 5.000 3.906 3.618 4.203 . 0 0 "[ . 1]" 1
788 1 142 THR HA 1 155 ILE MD 4.200 . 5.200 3.218 2.303 4.651 . 0 0 "[ . 1]" 1
789 1 142 THR HB 1 143 THR MG 6.000 . 7.000 5.766 4.992 6.803 . 0 0 "[ . 1]" 1
790 1 142 THR MG 1 155 ILE MD 4.200 . 5.200 3.944 2.818 5.207 0.007 3 0 "[ . 1]" 1
791 1 142 THR MG 1 155 ILE MG 6.000 . 7.000 4.202 2.709 5.834 . 0 0 "[ . 1]" 1
792 1 142 THR MG 1 157 PHE QE 6.000 . 7.000 4.441 2.268 6.478 . 0 0 "[ . 1]" 1
793 1 143 THR H 1 143 THR HB 2.800 . 2.800 2.663 2.480 2.787 . 0 0 "[ . 1]" 1
794 1 143 THR H 1 144 PHE H 3.400 . 3.400 2.628 2.486 2.677 . 0 0 "[ . 1]" 1
795 1 143 THR H 1 144 PHE QB 5.000 . 5.600 4.400 4.246 4.450 . 0 0 "[ . 1]" 1
796 1 143 THR H 1 145 SER H 5.000 . 5.000 4.029 3.922 4.082 . 0 0 "[ . 1]" 1
797 1 143 THR HA 1 144 PHE H 3.400 . 3.400 3.474 3.473 3.475 0.075 1 0 "[ . 1]" 1
798 1 143 THR HA 1 146 LYS H 4.200 . 4.200 3.728 3.513 3.786 . 0 0 "[ . 1]" 1
799 1 143 THR HA 1 146 LYS QD 4.200 . 5.200 4.184 2.662 5.213 0.013 10 0 "[ . 1]" 1
800 1 143 THR HA 1 147 ALA H 5.000 . 5.000 4.141 3.950 4.452 . 0 0 "[ . 1]" 1
801 1 143 THR HB 1 144 PHE H 2.800 . 2.800 2.580 2.569 2.603 . 0 0 "[ . 1]" 1
802 1 143 THR HB 1 144 PHE QB 4.200 . 5.200 3.898 3.871 4.017 . 0 0 "[ . 1]" 1
803 1 143 THR MG 1 144 PHE H 4.200 . 5.200 3.692 3.519 3.829 . 0 0 "[ . 1]" 1
804 1 143 THR MG 1 144 PHE QB 5.000 . 6.000 4.460 4.263 4.642 . 0 0 "[ . 1]" 1
805 1 144 PHE H 1 144 PHE QB 2.800 . 3.400 2.260 2.229 2.273 . 0 0 "[ . 1]" 1
806 1 144 PHE H 1 144 PHE QD 5.000 . 6.000 4.178 4.113 4.197 . 0 0 "[ . 1]" 1
807 1 144 PHE H 1 145 SER H 3.400 . 3.400 2.512 2.488 2.547 . 0 0 "[ . 1]" 1
808 1 144 PHE H 1 146 LYS H 5.000 . 5.000 4.228 4.121 4.311 . 0 0 "[ . 1]" 1
809 1 144 PHE HA 1 144 PHE QB 2.800 . 2.800 2.340 2.298 2.386 . 0 0 "[ . 1]" 1
810 1 144 PHE HA 1 144 PHE QD 4.200 . 5.200 2.455 2.121 3.067 . 0 0 "[ . 1]" 1
811 1 144 PHE HA 1 145 SER H 3.400 . 3.400 3.475 3.473 3.479 0.079 6 0 "[ . 1]" 1
812 1 144 PHE HA 1 147 ALA H 4.200 . 4.200 3.387 3.283 3.508 . 0 0 "[ . 1]" 1
813 1 144 PHE HA 1 147 ALA MB 4.200 . 4.200 2.225 1.948 2.378 . 0 0 "[ . 1]" 1
814 1 144 PHE HA 1 148 GLN H 4.200 . 4.200 4.223 4.213 4.246 0.046 8 0 "[ . 1]" 1
815 1 144 PHE QD 1 145 SER H 3.400 . 4.400 3.782 3.107 4.137 . 0 0 "[ . 1]" 1
816 1 144 PHE QE 1 145 SER H 5.000 . 6.000 5.706 5.272 6.001 0.001 2 0 "[ . 1]" 1
817 1 145 SER H 1 146 LYS H 4.200 . 4.200 2.728 2.647 2.825 . 0 0 "[ . 1]" 1
818 1 145 SER H 1 146 LYS QB 4.200 . 5.200 4.616 4.327 5.025 . 0 0 "[ . 1]" 1
819 1 145 SER H 1 147 ALA H 5.000 . 5.000 3.818 3.723 3.896 . 0 0 "[ . 1]" 1
820 1 145 SER HA 1 146 LYS H 4.200 . 4.200 3.548 3.532 3.556 . 0 0 "[ . 1]" 1
821 1 145 SER HA 1 147 ALA H 4.200 . 4.200 4.226 4.217 4.246 0.046 8 0 "[ . 1]" 1
822 1 145 SER HA 1 148 GLN H 4.200 . 4.200 3.524 3.464 3.726 . 0 0 "[ . 1]" 1
823 1 145 SER HA 1 149 GLY H 5.000 . 5.000 4.486 4.293 4.832 . 0 0 "[ . 1]" 1
824 1 145 SER QB 1 146 LYS H 4.200 . 5.200 2.621 2.448 3.262 . 0 0 "[ . 1]" 1
825 1 146 LYS H 1 146 LYS QG 3.400 . 4.400 3.012 1.966 3.978 . 0 0 "[ . 1]" 1
826 1 146 LYS H 1 147 ALA H 3.400 . 3.400 2.502 2.430 2.532 . 0 0 "[ . 1]" 1
827 1 146 LYS HA 1 147 ALA H 3.400 . 3.400 3.452 3.445 3.455 0.055 10 0 "[ . 1]" 1
828 1 146 LYS HA 1 148 GLN H 4.200 . 4.200 4.059 3.918 4.130 . 0 0 "[ . 1]" 1
829 1 146 LYS HA 1 149 GLY H 3.400 . 3.400 3.265 3.173 3.427 0.027 8 0 "[ . 1]" 1
830 1 146 LYS HA 1 150 LEU H 2.800 . 2.800 2.638 2.270 2.801 0.001 10 0 "[ . 1]" 1
831 1 147 ALA H 1 147 ALA HA 2.800 . 2.800 2.820 2.801 2.826 0.026 2 0 "[ . 1]" 1
832 1 147 ALA H 1 147 ALA MB 2.800 . 3.400 2.150 2.099 2.245 . 0 0 "[ . 1]" 1
833 1 147 ALA H 1 148 GLN H 3.400 . 3.400 2.546 2.517 2.645 . 0 0 "[ . 1]" 1
834 1 147 ALA HA 1 148 GLN H 3.400 . 3.400 3.455 3.451 3.461 0.061 6 0 "[ . 1]" 1
835 1 148 GLN H 1 148 GLN QB 2.800 . 3.400 2.332 2.144 2.859 . 0 0 "[ . 1]" 1
836 1 148 GLN H 1 148 GLN QG 4.200 . 5.200 3.608 2.762 4.184 . 0 0 "[ . 1]" 1
837 1 148 GLN H 1 149 GLY H 3.400 . 3.400 2.376 2.276 2.470 . 0 0 "[ . 1]" 1
838 1 148 GLN H 1 150 LEU H 4.200 . 4.200 4.052 3.738 4.226 0.026 8 0 "[ . 1]" 1
839 1 148 GLN HA 1 149 GLY H 3.400 . 3.400 3.286 2.670 3.440 0.040 7 0 "[ . 1]" 1
840 1 148 GLN QB 1 149 GLY H 3.400 . 4.400 3.215 2.966 3.922 . 0 0 "[ . 1]" 1
841 1 149 GLY H 1 149 GLY QA 2.800 . 2.800 2.335 2.276 2.490 . 0 0 "[ . 1]" 1
842 1 149 GLY H 1 150 LEU H 2.800 . 2.800 2.385 2.091 2.835 0.035 6 0 "[ . 1]" 1
843 1 149 GLY QA 1 150 LEU H 3.400 . 4.400 2.588 2.336 2.810 . 0 0 "[ . 1]" 1
844 1 150 LEU H 1 150 LEU QB 2.800 . 3.400 2.710 2.467 3.319 . 0 0 "[ . 1]" 1
845 1 150 LEU H 1 151 THR H 5.000 . 5.000 4.378 4.290 4.482 . 0 0 "[ . 1]" 1
846 1 150 LEU QB 1 151 THR H 2.800 . 3.800 2.750 1.932 3.143 . 0 0 "[ . 1]" 1
847 1 150 LEU QD 1 151 THR H 4.200 . 6.600 3.337 2.251 3.894 . 0 0 "[ . 1]" 1
848 1 150 LEU QD 1 154 ASP QB 4.200 . 6.600 2.305 1.800 3.100 . 0 0 "[ . 1]" 1
849 1 151 THR H 1 151 THR HB 2.800 . 2.800 2.891 2.885 2.906 0.106 5 0 "[ . 1]" 1
850 1 151 THR H 1 152 GLU H 5.000 . 5.000 4.512 4.504 4.519 . 0 0 "[ . 1]" 1
851 1 151 THR HB 1 152 GLU H 2.800 . 2.800 2.879 2.867 2.883 0.083 1 0 "[ . 1]" 1
852 1 151 THR MG 1 152 GLU H 4.200 . 5.200 2.056 1.947 2.136 . 0 0 "[ . 1]" 1
853 1 151 THR MG 1 153 GLU H 4.200 . 5.200 2.992 2.867 3.179 . 0 0 "[ . 1]" 1
854 1 152 GLU H 1 152 GLU HA 2.800 . 2.800 2.802 2.771 2.809 0.009 3 0 "[ . 1]" 1
855 1 152 GLU H 1 152 GLU QB 2.800 . 3.400 2.331 2.080 2.625 . 0 0 "[ . 1]" 1
856 1 152 GLU H 1 152 GLU QG 4.200 . 5.200 2.814 1.980 3.820 . 0 0 "[ . 1]" 1
857 1 152 GLU H 1 153 GLU H 3.400 . 3.400 2.694 2.632 2.796 . 0 0 "[ . 1]" 1
858 1 152 GLU H 1 155 ILE MD 4.200 . 5.200 4.089 3.623 5.212 0.012 7 0 "[ . 1]" 1
859 1 152 GLU HA 1 154 ASP H 4.200 . 4.200 3.595 3.342 3.882 . 0 0 "[ . 1]" 1
860 1 152 GLU HA 1 155 ILE HB 4.200 . 4.200 3.023 2.406 4.090 . 0 0 "[ . 1]" 1
861 1 153 GLU H 1 153 GLU HA 2.800 . 2.800 2.796 2.789 2.801 0.001 9 0 "[ . 1]" 1
862 1 153 GLU H 1 153 GLU QB 2.800 . 3.400 2.310 2.238 2.486 . 0 0 "[ . 1]" 1
863 1 153 GLU H 1 154 ASP H 2.800 . 2.800 2.676 2.662 2.703 . 0 0 "[ . 1]" 1
864 1 153 GLU H 1 154 ASP QB 5.000 . 6.000 4.471 4.366 4.712 . 0 0 "[ . 1]" 1
865 1 153 GLU H 1 155 ILE MD 5.000 . 6.000 4.699 4.112 5.535 . 0 0 "[ . 1]" 1
866 1 153 GLU HA 1 154 ASP H 3.400 . 3.400 3.425 3.423 3.429 0.029 7 0 "[ . 1]" 1
867 1 153 GLU HA 1 155 ILE H 4.200 . 4.200 4.026 3.791 4.204 0.004 3 0 "[ . 1]" 1
868 1 153 GLU QB 1 154 ASP H 4.200 . 5.200 3.231 3.024 3.676 . 0 0 "[ . 1]" 1
869 1 154 ASP H 1 154 ASP QB 3.400 . 4.000 2.283 2.134 2.457 . 0 0 "[ . 1]" 1
870 1 154 ASP H 1 155 ILE H 2.800 . 2.800 2.307 2.102 2.498 . 0 0 "[ . 1]" 1
871 1 154 ASP HA 1 154 ASP QB 2.800 . 2.800 2.481 2.397 2.540 . 0 0 "[ . 1]" 1
872 1 154 ASP QB 1 155 ILE H 4.200 . 5.200 3.197 2.892 3.731 . 0 0 "[ . 1]" 1
873 1 155 ILE H 1 155 ILE HB 2.800 . 3.400 2.741 2.624 3.016 . 0 0 "[ . 1]" 1
874 1 155 ILE H 1 155 ILE MD 4.200 . 4.200 2.958 1.973 4.019 . 0 0 "[ . 1]" 1
875 1 155 ILE H 1 155 ILE MG 4.200 . 5.200 3.867 3.819 3.912 . 0 0 "[ . 1]" 1
876 1 155 ILE HA 1 156 VAL H 2.800 . 2.800 2.250 2.186 2.309 . 0 0 "[ . 1]" 1
877 1 155 ILE HB 1 155 ILE MD 3.400 . 3.400 2.269 2.004 3.221 . 0 0 "[ . 1]" 1
878 1 155 ILE HB 1 156 VAL H 4.200 . 5.200 3.752 3.527 3.952 . 0 0 "[ . 1]" 1
879 1 155 ILE MG 1 157 PHE QD 5.000 . 6.000 3.712 2.866 4.910 . 0 0 "[ . 1]" 1
880 1 156 VAL H 1 156 VAL HB 3.400 . 3.400 3.293 2.991 3.416 0.016 8 0 "[ . 1]" 1
881 1 156 VAL HA 1 156 VAL HB 2.800 . 2.800 2.686 2.443 2.972 0.172 5 0 "[ . 1]" 1
882 1 156 VAL HA 1 157 PHE H 2.800 . 2.800 2.156 2.132 2.218 . 0 0 "[ . 1]" 1
883 1 156 VAL HB 1 157 PHE H 4.200 . 4.200 3.976 3.521 4.222 0.022 6 0 "[ . 1]" 1
884 1 157 PHE H 1 157 PHE QB 2.800 . 3.400 2.483 2.225 3.035 . 0 0 "[ . 1]" 1
885 1 157 PHE H 1 158 LEU H 4.200 . 4.200 4.265 4.262 4.272 0.072 2 0 "[ . 1]" 1
886 1 157 PHE HA 1 157 PHE QD 3.400 . 5.800 2.589 1.992 3.661 . 0 0 "[ . 1]" 1
887 1 157 PHE HA 1 158 LEU H 2.800 . 2.800 2.132 2.125 2.142 . 0 0 "[ . 1]" 1
888 1 157 PHE QB 1 158 LEU H 4.200 . 5.200 3.551 3.456 3.887 . 0 0 "[ . 1]" 1
889 1 157 PHE QD 1 158 LEU H 5.000 . 7.400 4.101 2.988 4.755 . 0 0 "[ . 1]" 1
890 1 161 PRO HA 1 162 ASP H 2.800 . 2.800 2.525 2.251 2.697 . 0 0 "[ . 1]" 1
891 1 162 ASP H 1 162 ASP QB 3.400 . 4.000 2.834 2.343 3.416 . 0 0 "[ . 1]" 1
892 1 162 ASP H 1 163 LYS H 3.400 . 3.400 2.628 1.951 3.403 0.003 5 0 "[ . 1]" 1
893 1 162 ASP HA 1 163 LYS H 3.400 . 3.400 3.004 2.199 3.526 0.126 1 0 "[ . 1]" 1
894 1 162 ASP QB 1 163 LYS H 4.200 . 5.200 3.314 1.890 4.010 . 0 0 "[ . 1]" 1
895 1 163 LYS H 1 164 CYS H 4.200 . 4.200 3.733 2.589 4.263 0.063 7 0 "[ . 1]" 1
896 1 163 LYS HA 1 163 LYS QB 2.800 . 2.800 2.418 2.170 2.540 . 0 0 "[ . 1]" 1
897 1 163 LYS HA 1 164 CYS H 2.800 . 2.800 2.355 2.142 2.814 0.014 7 0 "[ . 1]" 1
898 1 164 CYS H 1 164 CYS HA 2.800 . 2.800 2.797 2.274 2.908 0.108 2 0 "[ . 1]" 1
899 1 164 CYS H 1 165 ILE H 4.200 . 4.200 3.186 2.151 4.240 0.040 2 0 "[ . 1]" 1
900 1 164 CYS HA 1 165 ILE H 3.400 . 3.400 2.854 2.190 3.425 0.025 1 0 "[ . 1]" 1
901 1 164 CYS QB 1 165 ILE H 4.200 . 5.200 3.289 1.970 4.028 . 0 0 "[ . 1]" 1
902 1 165 ILE H 1 165 ILE HB 4.200 . 4.200 3.007 2.508 3.719 . 0 0 "[ . 1]" 1
903 1 165 ILE H 1 165 ILE MD 4.200 . 4.200 3.323 2.021 4.205 0.005 6 0 "[ . 1]" 1
904 1 165 ILE H 1 166 GLN H 2.800 . 2.800 2.258 1.929 2.688 . 0 0 "[ . 1]" 1
905 1 165 ILE HA 1 165 ILE MG 3.400 . 4.000 2.470 2.190 3.202 . 0 0 "[ . 1]" 1
906 1 165 ILE HA 1 166 GLN H 3.400 . 3.400 3.439 3.173 3.525 0.125 2 0 "[ . 1]" 1
907 1 165 ILE HB 1 166 GLN H 4.200 . 4.200 3.293 1.972 4.233 0.033 9 0 "[ . 1]" 1
908 1 166 GLN H 1 166 GLN HA 2.800 . 2.800 2.825 2.797 2.881 0.081 6 0 "[ . 1]" 1
909 1 166 GLN H 1 166 GLN QB 2.800 . 3.400 2.307 2.046 2.694 . 0 0 "[ . 1]" 1
910 1 166 GLN HA 1 166 GLN QB 2.800 . 2.800 2.409 2.178 2.540 . 0 0 "[ . 1]" 1
911 1 166 GLN HA 1 167 GLU H 2.800 . 2.800 2.192 2.140 2.297 . 0 0 "[ . 1]" 1
912 1 166 GLN QB 1 167 GLU H 2.800 . 3.800 3.435 2.651 3.740 . 0 0 "[ . 1]" 1
913 1 167 GLU H 1 167 GLU HA 2.800 . 2.800 2.697 2.274 2.806 0.006 8 0 "[ . 1]" 1
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