NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
495573 |
2l5y   |
17289 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2l5y
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 2675
_Distance_constraint_stats_list.Viol_count 5412
_Distance_constraint_stats_list.Viol_total 5344.962
_Distance_constraint_stats_list.Viol_max 0.825
_Distance_constraint_stats_list.Viol_rms 0.0225
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0050
_Distance_constraint_stats_list.Viol_average_violations_only 0.0494
_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 7 THR 3.996 0.196 7 0 "[ . 1 . 2]"
1 8 GLU 2.378 0.196 7 0 "[ . 1 . 2]"
1 9 GLU 1.912 0.141 16 0 "[ . 1 . 2]"
1 10 ASP 2.089 0.165 3 0 "[ . 1 . 2]"
1 11 ARG 2.521 0.121 3 0 "[ . 1 . 2]"
1 12 PHE 5.358 0.234 18 0 "[ . 1 . 2]"
1 13 SER 0.446 0.073 3 0 "[ . 1 . 2]"
1 14 LEU 8.550 0.166 20 0 "[ . 1 . 2]"
1 15 GLU 4.353 0.234 18 0 "[ . 1 . 2]"
1 16 ALA 3.427 0.135 10 0 "[ . 1 . 2]"
1 17 LEU 3.489 0.151 18 0 "[ . 1 . 2]"
1 18 GLN 0.641 0.074 3 0 "[ . 1 . 2]"
1 19 THR 0.774 0.060 5 0 "[ . 1 . 2]"
1 20 ILE 3.534 0.118 15 0 "[ . 1 . 2]"
1 21 HIS 4.590 0.170 9 0 "[ . 1 . 2]"
1 22 LYS 6.053 0.274 3 0 "[ . 1 . 2]"
1 23 GLN 0.818 0.127 8 0 "[ . 1 . 2]"
1 24 MET 4.539 0.133 5 0 "[ . 1 . 2]"
1 25 ASP 8.124 0.283 5 0 "[ . 1 . 2]"
1 26 ASP 2.576 0.115 5 0 "[ . 1 . 2]"
1 27 ASP 1.358 0.189 12 0 "[ . 1 . 2]"
1 28 LYS 17.606 0.825 12 7 "[ * - *1 + ** *]"
1 29 ASP 12.294 0.825 12 7 "[ * - *1 + ** *]"
1 30 GLY 5.095 0.287 20 0 "[ . 1 . 2]"
1 31 GLY 1.836 0.144 6 0 "[ . 1 . 2]"
1 32 ILE 2.961 0.083 4 0 "[ . 1 . 2]"
1 33 GLU 8.130 0.283 5 0 "[ . 1 . 2]"
1 34 VAL 7.154 0.182 12 0 "[ . 1 . 2]"
1 35 GLU 2.836 0.138 19 0 "[ . 1 . 2]"
1 36 GLU 1.060 0.113 15 0 "[ . 1 . 2]"
1 37 SER 0.182 0.052 2 0 "[ . 1 . 2]"
1 38 ASP 0.973 0.106 2 0 "[ . 1 . 2]"
1 39 GLU 0.505 0.096 6 0 "[ . 1 . 2]"
1 40 PHE 3.179 0.118 15 0 "[ . 1 . 2]"
1 41 ILE 8.995 0.200 10 0 "[ . 1 . 2]"
1 42 ARG 2.218 0.182 6 0 "[ . 1 . 2]"
1 43 GLU 4.285 0.182 6 0 "[ . 1 . 2]"
1 44 ASP 0.358 0.050 16 0 "[ . 1 . 2]"
1 45 MET 7.090 0.154 14 0 "[ . 1 . 2]"
1 46 LYS 3.913 0.183 4 0 "[ . 1 . 2]"
1 47 TYR 2.714 0.138 14 0 "[ . 1 . 2]"
1 48 LYS 2.161 0.157 19 0 "[ . 1 . 2]"
1 49 ASP 4.249 0.200 10 0 "[ . 1 . 2]"
1 50 ALA 3.556 0.198 17 0 "[ . 1 . 2]"
1 51 THR 0.654 0.149 17 0 "[ . 1 . 2]"
1 52 ASN 2.205 0.198 17 0 "[ . 1 . 2]"
1 54 HIS 4.272 0.238 2 0 "[ . 1 . 2]"
1 55 SER 0.205 0.038 16 0 "[ . 1 . 2]"
1 56 HIS 1.225 0.134 13 0 "[ . 1 . 2]"
1 57 LEU 2.979 0.118 4 0 "[ . 1 . 2]"
1 58 HIS 1.315 0.118 4 0 "[ . 1 . 2]"
1 59 ARG 6.239 0.238 2 0 "[ . 1 . 2]"
1 60 GLU 1.697 0.132 20 0 "[ . 1 . 2]"
1 61 ASP 0.649 0.132 20 0 "[ . 1 . 2]"
1 62 LYS 5.013 0.193 9 0 "[ . 1 . 2]"
1 63 HIS 3.089 0.193 9 0 "[ . 1 . 2]"
1 64 ILE 6.040 0.216 16 0 "[ . 1 . 2]"
1 65 THR 3.299 0.144 6 0 "[ . 1 . 2]"
1 66 ILE 4.316 0.166 20 0 "[ . 1 . 2]"
1 67 GLU 1.273 0.054 3 0 "[ . 1 . 2]"
1 68 ASP 2.963 0.073 4 0 "[ . 1 . 2]"
1 69 LEU 5.132 0.155 7 0 "[ . 1 . 2]"
1 70 TRP 4.090 0.131 15 0 "[ . 1 . 2]"
1 71 LYS 6.222 0.175 14 0 "[ . 1 . 2]"
1 72 ARG 3.527 0.155 14 0 "[ . 1 . 2]"
1 73 TRP 2.000 0.126 9 0 "[ . 1 . 2]"
1 74 LYS 4.373 0.128 16 0 "[ . 1 . 2]"
1 75 THR 1.471 0.086 4 0 "[ . 1 . 2]"
1 76 SER 0.306 0.029 14 0 "[ . 1 . 2]"
1 77 GLU 1.289 0.175 18 0 "[ . 1 . 2]"
1 78 VAL 12.415 0.205 7 0 "[ . 1 . 2]"
1 79 HIS 3.695 0.205 7 0 "[ . 1 . 2]"
1 80 ASN 0.874 0.092 4 0 "[ . 1 . 2]"
1 81 TRP 3.795 0.121 19 0 "[ . 1 . 2]"
1 82 THR 2.672 0.088 16 0 "[ . 1 . 2]"
1 83 LEU 5.958 0.113 3 0 "[ . 1 . 2]"
1 84 GLU 2.618 0.097 12 0 "[ . 1 . 2]"
1 85 ASP 2.552 0.121 19 0 "[ . 1 . 2]"
1 86 THR 1.125 0.112 19 0 "[ . 1 . 2]"
1 87 LEU 7.208 0.117 8 0 "[ . 1 . 2]"
1 88 GLN 3.442 0.087 17 0 "[ . 1 . 2]"
1 89 TRP 3.502 0.149 13 0 "[ . 1 . 2]"
1 90 LEU 12.848 0.242 15 0 "[ . 1 . 2]"
1 91 ILE 13.206 0.209 4 0 "[ . 1 . 2]"
1 92 GLU 3.944 0.149 13 0 "[ . 1 . 2]"
1 93 PHE 2.307 0.095 20 0 "[ . 1 . 2]"
1 94 VAL 11.854 0.264 17 0 "[ . 1 . 2]"
1 95 GLU 3.584 0.138 19 0 "[ . 1 . 2]"
1 96 LEU 7.035 0.264 17 0 "[ . 1 . 2]"
1 97 PRO 1.023 0.045 19 0 "[ . 1 . 2]"
1 98 GLN 2.924 0.166 10 0 "[ . 1 . 2]"
1 99 TYR 2.374 0.114 17 0 "[ . 1 . 2]"
1 100 GLU 3.782 0.117 8 0 "[ . 1 . 2]"
1 101 LYS 4.804 0.136 2 0 "[ . 1 . 2]"
1 102 ASN 1.113 0.112 14 0 "[ . 1 . 2]"
1 103 PHE 10.756 0.271 19 0 "[ . 1 . 2]"
1 104 ARG 2.135 0.116 9 0 "[ . 1 . 2]"
1 105 ASP 0.396 0.093 9 0 "[ . 1 . 2]"
1 106 ASN 1.804 0.135 2 0 "[ . 1 . 2]"
1 107 ASN 1.763 0.081 20 0 "[ . 1 . 2]"
1 108 VAL 3.430 0.136 14 0 "[ . 1 . 2]"
1 109 LYS 2.458 0.136 14 0 "[ . 1 . 2]"
1 110 GLY 2.332 0.086 12 0 "[ . 1 . 2]"
1 111 THR 2.442 0.103 17 0 "[ . 1 . 2]"
1 112 THR 1.081 0.081 20 0 "[ . 1 . 2]"
1 113 LEU 4.925 0.181 6 0 "[ . 1 . 2]"
1 114 PRO 1.343 0.151 18 0 "[ . 1 . 2]"
1 115 ARG 1.494 0.133 18 0 "[ . 1 . 2]"
1 116 ILE 4.492 0.169 18 0 "[ . 1 . 2]"
1 117 ALA 2.167 0.210 7 0 "[ . 1 . 2]"
1 118 VAL 1.115 0.132 18 0 "[ . 1 . 2]"
1 119 HIS 0.302 0.056 15 0 "[ . 1 . 2]"
1 120 GLU 0.163 0.132 18 0 "[ . 1 . 2]"
1 122 SER 0.986 0.165 11 0 "[ . 1 . 2]"
1 123 PHE 1.751 0.196 7 0 "[ . 1 . 2]"
1 124 MET 1.719 0.166 7 0 "[ . 1 . 2]"
1 125 ILE 1.627 0.165 11 0 "[ . 1 . 2]"
1 126 SER 0.200 0.072 9 0 "[ . 1 . 2]"
1 127 GLN 0.203 0.050 5 0 "[ . 1 . 2]"
1 128 LEU 4.245 0.163 14 0 "[ . 1 . 2]"
1 129 LYS 1.030 0.249 13 0 "[ . 1 . 2]"
1 130 ILE 0.391 0.086 14 0 "[ . 1 . 2]"
1 131 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 133 ARG 1.211 0.103 4 0 "[ . 1 . 2]"
1 134 SER 1.986 0.134 15 0 "[ . 1 . 2]"
1 135 HIS 4.677 0.163 14 0 "[ . 1 . 2]"
1 136 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 137 GLN 0.883 0.115 20 0 "[ . 1 . 2]"
1 138 LYS 10.091 0.271 19 0 "[ . 1 . 2]"
1 139 LEU 11.373 0.181 6 0 "[ . 1 . 2]"
1 140 GLN 1.046 0.210 7 0 "[ . 1 . 2]"
1 141 LEU 6.733 0.165 10 0 "[ . 1 . 2]"
1 142 LYS 5.470 0.163 14 0 "[ . 1 . 2]"
1 143 ALA 2.636 0.142 16 0 "[ . 1 . 2]"
1 144 LEU 2.736 0.122 14 0 "[ . 1 . 2]"
1 145 ASP 2.761 0.154 14 0 "[ . 1 . 2]"
1 146 VAL 9.332 0.162 4 0 "[ . 1 . 2]"
1 147 VAL 1.941 0.135 18 0 "[ . 1 . 2]"
1 148 LEU 4.341 0.170 9 0 "[ . 1 . 2]"
1 149 PHE 3.228 0.154 19 0 "[ . 1 . 2]"
1 150 GLY 1.727 0.124 12 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 16 ALA MB 1 114 PRO QB 4.850 . 4.850 4.248 3.090 4.863 0.013 13 0 "[ . 1 . 2]" 1
2 1 14 LEU MD1 1 66 ILE MG 5.500 . 5.500 4.381 4.217 4.750 . 0 0 "[ . 1 . 2]" 1
3 1 14 LEU HB2 1 14 LEU MD1 3.340 . 3.340 2.529 2.385 3.266 . 0 0 "[ . 1 . 2]" 1
4 1 14 LEU HA 1 14 LEU MD1 3.650 . 3.650 2.156 2.022 2.642 . 0 0 "[ . 1 . 2]" 1
5 1 21 HIS HA 1 24 MET QB 4.270 . 4.270 3.034 2.760 3.207 . 0 0 "[ . 1 . 2]" 1
6 1 21 HIS HA 1 69 LEU MD2 4.020 . 4.020 3.366 3.176 3.482 . 0 0 "[ . 1 . 2]" 1
7 1 21 HIS HA 1 21 HIS HD2 4.670 . 4.670 3.213 3.089 3.323 . 0 0 "[ . 1 . 2]" 1
8 1 21 HIS HB3 1 69 LEU HG 4.700 . 4.700 4.340 4.204 4.474 . 0 0 "[ . 1 . 2]" 1
9 1 21 HIS HB2 1 69 LEU HG 4.700 . 4.700 2.755 2.649 2.852 . 0 0 "[ . 1 . 2]" 1
10 1 83 LEU QB 1 84 GLU HB3 4.800 . 4.800 4.815 4.746 4.841 0.041 16 0 "[ . 1 . 2]" 1
11 1 47 TYR QE 1 141 LEU HB2 5.500 . 5.500 4.982 4.166 5.539 0.039 14 0 "[ . 1 . 2]" 1
12 1 83 LEU QB 1 104 ARG QG 4.450 . 4.450 2.314 1.903 3.067 . 0 0 "[ . 1 . 2]" 1
13 1 83 LEU HA 1 83 LEU MD1 4.110 . 4.110 3.854 3.803 3.953 . 0 0 "[ . 1 . 2]" 1
14 1 82 THR HB 1 83 LEU MD1 5.500 . 5.500 5.542 5.509 5.588 0.088 16 0 "[ . 1 . 2]" 1
15 1 83 LEU MD1 1 108 VAL H 5.450 . 5.450 5.155 4.887 5.350 . 0 0 "[ . 1 . 2]" 1
16 1 83 LEU HA 1 83 LEU MD2 3.720 . 3.720 3.795 3.731 3.833 0.113 3 0 "[ . 1 . 2]" 1
17 1 82 THR HB 1 83 LEU MD2 4.900 . 4.900 4.936 4.889 4.977 0.077 3 0 "[ . 1 . 2]" 1
18 1 83 LEU MD2 1 109 LYS HA 5.310 . 5.310 4.710 4.119 5.132 . 0 0 "[ . 1 . 2]" 1
19 1 83 LEU HA 1 87 LEU HB2 5.500 . 5.500 4.856 4.686 5.180 . 0 0 "[ . 1 . 2]" 1
20 1 83 LEU HA 1 87 LEU HG 5.500 . 5.500 5.407 3.801 5.582 0.082 18 0 "[ . 1 . 2]" 1
21 1 48 LYS QD 1 142 LYS HA 4.000 . 4.000 2.955 2.219 3.468 . 0 0 "[ . 1 . 2]" 1
22 1 82 THR HB 1 83 LEU HG 4.580 . 4.580 4.491 4.457 4.527 . 0 0 "[ . 1 . 2]" 1
23 1 14 LEU HA 1 14 LEU HG 3.710 . 3.710 3.282 3.064 3.795 0.085 20 0 "[ . 1 . 2]" 1
24 1 83 LEU HG 1 84 GLU HB3 4.570 . 4.570 4.364 4.180 4.495 . 0 0 "[ . 1 . 2]" 1
25 1 83 LEU HA 1 109 LYS HB3 3.410 . 3.410 2.808 2.362 3.232 . 0 0 "[ . 1 . 2]" 1
26 1 83 LEU HA 1 87 LEU MD1 5.400 . 5.400 5.379 4.749 5.492 0.092 20 0 "[ . 1 . 2]" 1
27 1 83 LEU HA 1 86 THR MG 4.720 . 4.720 4.123 3.885 4.415 . 0 0 "[ . 1 . 2]" 1
28 1 128 LEU HA 1 128 LEU MD1 4.390 . 4.390 2.445 1.982 3.022 . 0 0 "[ . 1 . 2]" 1
29 1 128 LEU HG 1 135 HIS QB 4.480 . 4.480 3.515 2.839 4.643 0.163 14 0 "[ . 1 . 2]" 1
30 1 138 LYS QE 1 139 LEU MD2 3.830 . 3.830 3.472 2.550 3.876 0.046 10 0 "[ . 1 . 2]" 1
31 1 135 HIS HA 1 139 LEU MD2 4.890 . 4.890 4.751 4.257 5.012 0.122 1 0 "[ . 1 . 2]" 1
32 1 128 LEU HA 1 128 LEU MD2 4.390 . 4.390 2.432 1.996 3.827 . 0 0 "[ . 1 . 2]" 1
33 1 99 TYR QE 1 128 LEU QB 5.500 . 5.500 5.333 4.062 5.614 0.114 17 0 "[ . 1 . 2]" 1
34 1 128 LEU QB 1 135 HIS HD2 5.500 . 5.500 4.681 3.718 5.511 0.011 1 0 "[ . 1 . 2]" 1
35 1 99 TYR QE 1 128 LEU HG 5.500 . 5.500 5.217 3.563 5.570 0.070 7 0 "[ . 1 . 2]" 1
36 1 128 LEU HG 1 135 HIS HD2 5.500 . 5.500 3.957 3.198 5.567 0.067 9 0 "[ . 1 . 2]" 1
37 1 139 LEU H 1 139 LEU MD2 4.020 . 4.020 4.037 3.940 4.088 0.068 7 0 "[ . 1 . 2]" 1
38 1 65 THR HA 1 66 ILE MG 4.610 . 4.610 4.065 3.881 4.298 . 0 0 "[ . 1 . 2]" 1
39 1 31 GLY QA 1 65 THR HA 4.090 . 4.090 3.145 2.701 3.419 . 0 0 "[ . 1 . 2]" 1
40 1 31 GLY QA 1 65 THR HB 5.470 . 5.470 5.353 4.949 5.511 0.041 11 0 "[ . 1 . 2]" 1
41 1 65 THR HB 1 66 ILE MG 4.210 . 4.210 4.221 4.136 4.248 0.038 1 0 "[ . 1 . 2]" 1
42 1 65 THR MG 1 66 ILE MG 3.980 . 3.980 2.266 2.089 2.389 . 0 0 "[ . 1 . 2]" 1
43 1 31 GLY QA 1 65 THR MG 3.890 . 3.890 3.976 3.903 4.034 0.144 6 0 "[ . 1 . 2]" 1
44 1 65 THR HA 1 65 THR MG 2.860 . 2.860 2.272 2.216 2.450 . 0 0 "[ . 1 . 2]" 1
45 1 65 THR MG 1 67 GLU HB3 4.490 . 4.490 4.088 3.549 4.411 . 0 0 "[ . 1 . 2]" 1
46 1 30 GLY HA2 1 65 THR MG 4.830 . 4.830 2.370 1.960 3.141 . 0 0 "[ . 1 . 2]" 1
47 1 65 THR MG 1 66 ILE HA 4.660 . 4.660 4.206 4.048 4.291 . 0 0 "[ . 1 . 2]" 1
48 1 30 GLY HA3 1 65 THR MG 4.830 . 4.830 2.197 1.957 2.765 . 0 0 "[ . 1 . 2]" 1
49 1 65 THR HB 1 67 GLU HB3 5.020 . 5.020 4.928 4.697 5.058 0.038 3 0 "[ . 1 . 2]" 1
50 1 64 ILE MG 1 65 THR MG 4.920 . 4.920 4.927 4.825 4.976 0.056 1 0 "[ . 1 . 2]" 1
51 1 64 ILE MG 1 68 ASP HA 4.530 . 4.530 4.301 4.149 4.440 . 0 0 "[ . 1 . 2]" 1
52 1 83 LEU HA 1 109 LYS HA 4.120 . 4.120 2.601 2.175 3.044 . 0 0 "[ . 1 . 2]" 1
53 1 86 THR MG 1 109 LYS HA 3.740 . 3.740 3.402 2.623 3.798 0.058 8 0 "[ . 1 . 2]" 1
54 1 83 LEU MD2 1 109 LYS HB2 4.530 . 4.530 4.134 3.588 4.569 0.039 13 0 "[ . 1 . 2]" 1
55 1 83 LEU MD2 1 109 LYS HB3 4.520 . 4.520 2.917 2.307 3.281 . 0 0 "[ . 1 . 2]" 1
56 1 109 LYS HE2 1 109 LYS HG3 4.190 . 4.190 3.943 2.491 4.227 0.037 2 0 "[ . 1 . 2]" 1
57 1 82 THR HA 1 109 LYS HG3 5.010 . 5.010 4.740 2.948 5.018 0.008 3 0 "[ . 1 . 2]" 1
58 1 109 LYS HE2 1 109 LYS HG2 4.190 . 4.190 3.454 2.967 3.725 . 0 0 "[ . 1 . 2]" 1
59 1 82 THR HA 1 109 LYS HG2 5.010 . 5.010 3.941 3.392 4.333 . 0 0 "[ . 1 . 2]" 1
60 1 96 LEU MD2 1 138 LYS QD 5.190 . 5.190 3.031 2.689 3.258 . 0 0 "[ . 1 . 2]" 1
61 1 90 LEU HG 1 138 LYS QD 4.640 . 4.640 3.204 2.611 4.501 . 0 0 "[ . 1 . 2]" 1
62 1 22 LYS QD 1 23 GLN HA 4.860 . 4.860 4.452 4.112 4.987 0.127 8 0 "[ . 1 . 2]" 1
63 1 135 HIS HA 1 138 LYS QD 4.430 . 4.430 2.936 2.230 3.640 . 0 0 "[ . 1 . 2]" 1
64 1 103 PHE QD 1 138 LYS QD 4.840 . 4.840 4.980 4.850 5.111 0.271 19 0 "[ . 1 . 2]" 1
65 1 109 LYS HE3 1 109 LYS HG3 4.190 . 4.190 3.708 3.331 3.806 . 0 0 "[ . 1 . 2]" 1
66 1 101 LYS HA 1 101 LYS QE 5.500 . 5.500 5.341 5.242 5.404 . 0 0 "[ . 1 . 2]" 1
67 1 81 TRP HA 1 85 ASP QB 4.630 . 4.630 2.911 2.446 4.502 . 0 0 "[ . 1 . 2]" 1
68 1 81 TRP HA 1 82 THR MG 4.190 . 4.190 3.685 3.305 4.023 . 0 0 "[ . 1 . 2]" 1
69 1 81 TRP HA 1 81 TRP HD1 3.460 . 3.460 2.283 2.168 2.420 . 0 0 "[ . 1 . 2]" 1
70 1 99 TYR HA 1 99 TYR QE 4.720 . 4.720 4.570 4.349 4.727 0.007 18 0 "[ . 1 . 2]" 1
71 1 90 LEU MD1 1 99 TYR HB3 6.120 . 6.120 4.508 3.988 4.933 . 0 0 "[ . 1 . 2]" 1
72 1 77 GLU HA 1 80 ASN HA 5.190 . 5.190 5.137 4.920 5.256 0.066 5 0 "[ . 1 . 2]" 1
73 1 77 GLU HA 1 80 ASN HB3 4.350 . 4.350 3.116 2.034 4.136 . 0 0 "[ . 1 . 2]" 1
74 1 77 GLU HA 1 80 ASN HB2 4.350 . 4.350 2.810 2.172 3.624 . 0 0 "[ . 1 . 2]" 1
75 1 67 GLU HB3 1 67 GLU HG2 2.580 . 2.580 2.457 2.423 2.541 . 0 0 "[ . 1 . 2]" 1
76 1 83 LEU HG 1 84 GLU HG2 5.010 . 5.010 3.893 3.557 4.200 . 0 0 "[ . 1 . 2]" 1
77 1 84 GLU HG2 1 85 ASP QB 5.500 . 5.500 4.342 3.324 4.793 . 0 0 "[ . 1 . 2]" 1
78 1 84 GLU HB2 1 84 GLU HG3 2.850 . 2.850 2.472 2.406 2.517 . 0 0 "[ . 1 . 2]" 1
79 1 84 GLU HA 1 84 GLU HG2 3.830 . 3.830 3.747 3.662 3.818 . 0 0 "[ . 1 . 2]" 1
80 1 67 GLU HB2 1 68 ASP HA 4.530 . 4.530 4.395 4.316 4.482 . 0 0 "[ . 1 . 2]" 1
81 1 87 LEU HB3 1 100 GLU HB3 4.360 . 4.360 3.812 3.581 4.093 . 0 0 "[ . 1 . 2]" 1
82 1 87 LEU MD2 1 100 GLU HB3 5.500 . 5.500 5.214 2.920 5.505 0.005 19 0 "[ . 1 . 2]" 1
83 1 90 LEU HG 1 100 GLU HB3 5.500 . 5.500 4.860 3.576 5.232 . 0 0 "[ . 1 . 2]" 1
84 1 35 GLU QB 1 39 GLU H 5.500 . 5.500 5.261 4.804 5.546 0.046 1 0 "[ . 1 . 2]" 1
85 1 83 LEU MD1 1 84 GLU HA 4.370 . 4.370 3.266 3.060 3.595 . 0 0 "[ . 1 . 2]" 1
86 1 67 GLU HA 1 67 GLU HB3 2.850 . 2.850 2.396 2.361 2.438 . 0 0 "[ . 1 . 2]" 1
87 1 66 ILE MG 1 67 GLU HB3 4.220 . 4.220 3.152 3.057 3.249 . 0 0 "[ . 1 . 2]" 1
88 1 33 GLU QB 1 35 GLU QB 4.360 . 4.360 2.979 2.492 4.216 . 0 0 "[ . 1 . 2]" 1
89 1 135 HIS HA 1 136 ARG HA 4.900 . 4.900 4.751 4.546 4.893 . 0 0 "[ . 1 . 2]" 1
90 1 41 ILE MG 1 50 ALA HA 3.450 . 3.450 1.935 1.747 2.285 . 0 0 "[ . 1 . 2]" 1
91 1 49 ASP HA 1 50 ALA MB 3.860 . 3.860 3.868 3.790 3.956 0.096 6 0 "[ . 1 . 2]" 1
92 1 42 ARG HA 1 50 ALA MB 4.000 . 4.000 3.156 2.317 3.469 . 0 0 "[ . 1 . 2]" 1
93 1 46 LYS HA 1 50 ALA MB 4.340 . 4.340 2.809 2.263 3.264 . 0 0 "[ . 1 . 2]" 1
94 1 41 ILE HB 1 50 ALA MB 4.810 . 4.810 4.360 4.075 4.792 . 0 0 "[ . 1 . 2]" 1
95 1 83 LEU MD2 1 107 ASN HA 3.540 . 3.540 3.498 3.295 3.563 0.023 1 0 "[ . 1 . 2]" 1
96 1 83 LEU QB 1 107 ASN HA 4.380 . 4.380 3.622 3.456 4.055 . 0 0 "[ . 1 . 2]" 1
97 1 107 ASN HB2 1 108 VAL H 4.710 . 4.710 4.397 4.327 4.507 . 0 0 "[ . 1 . 2]" 1
98 1 83 LEU MD2 1 84 GLU HG2 5.440 . 5.440 5.199 4.855 5.468 0.028 10 0 "[ . 1 . 2]" 1
99 1 78 VAL HA 1 79 HIS HA 4.850 . 4.850 4.679 4.613 4.723 . 0 0 "[ . 1 . 2]" 1
100 1 78 VAL HA 1 81 TRP HD1 4.450 . 4.450 4.378 4.035 4.501 0.051 7 0 "[ . 1 . 2]" 1
101 1 78 VAL MG2 1 146 VAL MG2 3.680 . 3.680 1.826 1.777 1.892 . 0 0 "[ . 1 . 2]" 1
102 1 78 VAL HA 1 78 VAL MG2 3.480 . 3.480 2.429 2.397 2.467 . 0 0 "[ . 1 . 2]" 1
103 1 78 VAL MG2 1 79 HIS HB2 4.110 . 4.110 3.953 3.697 4.129 0.019 13 0 "[ . 1 . 2]" 1
104 1 78 VAL MG2 1 146 VAL HB 4.090 . 4.090 2.742 2.550 3.181 . 0 0 "[ . 1 . 2]" 1
105 1 78 VAL MG2 1 79 HIS HA 5.500 . 5.500 3.537 3.376 3.718 . 0 0 "[ . 1 . 2]" 1
106 1 78 VAL HB 1 147 VAL HA 5.330 . 5.330 3.806 3.380 4.314 . 0 0 "[ . 1 . 2]" 1
107 1 78 VAL MG2 1 80 ASN H 5.150 . 5.150 4.696 4.455 4.858 . 0 0 "[ . 1 . 2]" 1
108 1 78 VAL HA 1 78 VAL MG1 3.480 . 3.480 3.252 3.233 3.266 . 0 0 "[ . 1 . 2]" 1
109 1 78 VAL MG1 1 79 HIS HB2 4.110 . 4.110 2.400 2.315 2.461 . 0 0 "[ . 1 . 2]" 1
110 1 78 VAL MG1 1 79 HIS HA 5.500 . 5.500 3.446 3.333 3.580 . 0 0 "[ . 1 . 2]" 1
111 1 78 VAL MG1 1 147 VAL HA 4.460 . 4.460 2.311 1.898 2.779 . 0 0 "[ . 1 . 2]" 1
112 1 78 VAL H 1 78 VAL MG1 3.840 . 3.840 2.167 2.042 2.244 . 0 0 "[ . 1 . 2]" 1
113 1 74 LYS QE 1 74 LYS HG2 3.760 . 3.760 3.118 2.299 3.534 . 0 0 "[ . 1 . 2]" 1
114 1 74 LYS HB3 1 74 LYS QE 3.990 . 3.990 2.881 1.950 3.896 . 0 0 "[ . 1 . 2]" 1
115 1 71 LYS HA 1 74 LYS QE 5.130 . 5.130 3.343 1.934 4.641 . 0 0 "[ . 1 . 2]" 1
116 1 74 LYS HA 1 74 LYS QD 4.230 . 4.230 4.194 3.929 4.269 0.039 15 0 "[ . 1 . 2]" 1
117 1 74 LYS HA 1 74 LYS QE 4.400 . 4.400 4.102 3.762 4.469 0.069 8 0 "[ . 1 . 2]" 1
118 1 74 LYS HB2 1 74 LYS QE 3.990 . 3.990 2.475 1.963 3.895 . 0 0 "[ . 1 . 2]" 1
119 1 90 LEU HG 1 96 LEU HA 5.500 . 5.500 5.564 5.308 5.714 0.214 15 0 "[ . 1 . 2]" 1
120 1 74 LYS QE 1 74 LYS HG3 3.760 . 3.760 2.820 2.296 3.516 . 0 0 "[ . 1 . 2]" 1
121 1 148 LEU HB2 1 148 LEU MD1 3.560 . 3.560 2.222 2.131 2.303 . 0 0 "[ . 1 . 2]" 1
122 1 148 LEU HB3 1 148 LEU MD1 3.560 . 3.560 2.392 2.346 2.445 . 0 0 "[ . 1 . 2]" 1
123 1 24 MET QG 1 148 LEU MD1 4.790 . 4.790 3.794 3.654 4.042 . 0 0 "[ . 1 . 2]" 1
124 1 148 LEU HA 1 148 LEU MD1 4.060 . 4.060 3.792 3.752 3.829 . 0 0 "[ . 1 . 2]" 1
125 1 147 VAL HA 1 148 LEU HA 5.080 . 5.080 4.628 4.590 4.657 . 0 0 "[ . 1 . 2]" 1
126 1 20 ILE MD 1 148 LEU HA 4.450 . 4.450 3.907 3.591 4.242 . 0 0 "[ . 1 . 2]" 1
127 1 148 LEU HA 1 148 LEU HG 3.170 . 3.170 2.887 2.771 2.969 . 0 0 "[ . 1 . 2]" 1
128 1 148 LEU HB2 1 148 LEU MD2 3.560 . 3.560 3.192 3.169 3.207 . 0 0 "[ . 1 . 2]" 1
129 1 148 LEU HB3 1 148 LEU MD2 3.560 . 3.560 2.266 2.211 2.318 . 0 0 "[ . 1 . 2]" 1
130 1 20 ILE HB 1 148 LEU MD2 4.210 . 4.210 2.191 1.898 2.686 . 0 0 "[ . 1 . 2]" 1
131 1 24 MET QG 1 148 LEU MD2 4.790 . 4.790 3.833 3.561 4.180 . 0 0 "[ . 1 . 2]" 1
132 1 148 LEU HA 1 148 LEU MD2 4.060 . 4.060 2.058 1.983 2.179 . 0 0 "[ . 1 . 2]" 1
133 1 22 LYS HB2 1 28 LYS QG 3.410 . 3.410 2.548 2.050 3.551 0.141 12 0 "[ . 1 . 2]" 1
134 1 28 LYS HA 1 28 LYS HE2 5.500 . 5.500 4.774 4.317 5.510 0.010 1 0 "[ . 1 . 2]" 1
135 1 28 LYS HA 1 28 LYS QG 3.360 . 3.360 2.792 2.620 3.090 . 0 0 "[ . 1 . 2]" 1
136 1 109 LYS HB2 1 109 LYS HE3 3.780 . 3.780 2.518 2.024 3.784 0.004 14 0 "[ . 1 . 2]" 1
137 1 28 LYS HE3 1 28 LYS QG 3.570 . 3.570 2.464 2.223 3.477 . 0 0 "[ . 1 . 2]" 1
138 1 101 LYS QE 1 101 LYS QG 3.400 . 3.400 2.303 2.058 2.383 . 0 0 "[ . 1 . 2]" 1
139 1 109 LYS HE3 1 109 LYS HG2 4.190 . 4.190 2.866 2.406 3.649 . 0 0 "[ . 1 . 2]" 1
140 1 28 LYS QB 1 28 LYS HE2 4.180 . 4.180 2.200 1.970 3.222 . 0 0 "[ . 1 . 2]" 1
141 1 109 LYS HB2 1 109 LYS HE2 3.780 . 3.780 3.044 1.999 3.840 0.060 14 0 "[ . 1 . 2]" 1
142 1 135 HIS HA 1 138 LYS QE 3.880 . 3.880 2.607 2.008 3.524 . 0 0 "[ . 1 . 2]" 1
143 1 25 ASP HB3 1 28 LYS QB 4.180 . 4.180 3.462 2.899 3.736 . 0 0 "[ . 1 . 2]" 1
144 1 28 LYS HA 1 28 LYS QD 4.130 . 4.130 3.988 3.682 4.124 . 0 0 "[ . 1 . 2]" 1
145 1 25 ASP HB3 1 28 LYS HA 3.430 . 3.430 2.278 2.006 2.772 . 0 0 "[ . 1 . 2]" 1
146 1 90 LEU HG 1 138 LYS QE 4.740 . 4.740 3.478 3.162 4.161 . 0 0 "[ . 1 . 2]" 1
147 1 28 LYS QB 1 66 ILE HB 3.830 . 3.830 3.759 3.653 3.845 0.015 3 0 "[ . 1 . 2]" 1
148 1 32 ILE MD 1 64 ILE MD 4.240 . 4.240 2.928 2.305 3.434 . 0 0 "[ . 1 . 2]" 1
149 1 24 MET QB 1 32 ILE MD 3.280 . 3.280 2.173 2.025 2.302 . 0 0 "[ . 1 . 2]" 1
150 1 32 ILE HB 1 32 ILE MD 3.320 . 3.320 2.463 2.411 2.521 . 0 0 "[ . 1 . 2]" 1
151 1 24 MET QG 1 32 ILE MD 4.210 . 4.210 3.380 3.245 3.507 . 0 0 "[ . 1 . 2]" 1
152 1 32 ILE MD 1 36 GLU QB 5.500 . 5.500 4.872 4.477 5.305 . 0 0 "[ . 1 . 2]" 1
153 1 21 HIS HB2 1 32 ILE MD 4.270 . 4.270 3.172 2.953 3.276 . 0 0 "[ . 1 . 2]" 1
154 1 21 HIS HB3 1 32 ILE MD 4.270 . 4.270 4.306 4.161 4.351 0.081 15 0 "[ . 1 . 2]" 1
155 1 21 HIS HA 1 32 ILE MD 3.520 . 3.520 2.208 2.076 2.397 . 0 0 "[ . 1 . 2]" 1
156 1 24 MET HA 1 32 ILE MD 5.120 . 5.120 4.723 4.484 4.875 . 0 0 "[ . 1 . 2]" 1
157 1 32 ILE MD 1 66 ILE HA 5.470 . 5.470 4.512 4.404 4.654 . 0 0 "[ . 1 . 2]" 1
158 1 25 ASP HA 1 32 ILE MD 4.850 . 4.850 4.869 4.710 4.924 0.074 5 0 "[ . 1 . 2]" 1
159 1 21 HIS HD2 1 32 ILE MD 3.520 . 3.520 2.021 1.952 2.112 . 0 0 "[ . 1 . 2]" 1
160 1 32 ILE HA 1 32 ILE MD 3.950 . 3.950 3.871 3.842 3.904 . 0 0 "[ . 1 . 2]" 1
161 1 32 ILE HA 1 32 ILE HG13 3.870 . 3.870 2.991 2.926 3.067 . 0 0 "[ . 1 . 2]" 1
162 1 24 MET QB 1 32 ILE HA 4.620 . 4.620 3.941 3.845 4.076 . 0 0 "[ . 1 . 2]" 1
163 1 32 ILE MD 1 32 ILE MG 2.810 . 2.810 1.900 1.847 1.967 . 0 0 "[ . 1 . 2]" 1
164 1 24 MET QB 1 32 ILE MG 3.270 . 3.270 1.845 1.808 1.894 . 0 0 "[ . 1 . 2]" 1
165 1 86 THR MG 1 113 LEU MD2 4.660 . 4.660 2.041 1.744 2.775 . 0 0 "[ . 1 . 2]" 1
166 1 24 MET QG 1 32 ILE MG 3.720 . 3.720 3.456 3.387 3.592 . 0 0 "[ . 1 . 2]" 1
167 1 32 ILE MG 1 36 GLU QB 3.860 . 3.860 2.676 2.246 3.214 . 0 0 "[ . 1 . 2]" 1
168 1 32 ILE MG 1 34 VAL HA 4.170 . 4.170 3.698 3.422 3.974 . 0 0 "[ . 1 . 2]" 1
169 1 24 MET HA 1 32 ILE MG 3.720 . 3.720 3.752 3.462 3.803 0.083 4 0 "[ . 1 . 2]" 1
170 1 32 ILE HA 1 32 ILE MG 3.260 . 3.260 2.435 2.387 2.484 . 0 0 "[ . 1 . 2]" 1
171 1 21 HIS HA 1 32 ILE HG13 5.150 . 5.150 4.265 4.079 4.458 . 0 0 "[ . 1 . 2]" 1
172 1 21 HIS HA 1 32 ILE HG12 4.870 . 4.870 3.643 3.512 3.837 . 0 0 "[ . 1 . 2]" 1
173 1 32 ILE HG13 1 32 ILE MG 3.360 . 3.360 3.189 3.173 3.211 . 0 0 "[ . 1 . 2]" 1
174 1 24 MET QB 1 32 ILE HG12 4.340 . 4.340 2.443 2.332 2.532 . 0 0 "[ . 1 . 2]" 1
175 1 32 ILE HG13 1 64 ILE MD 5.500 . 5.500 4.794 4.244 5.242 . 0 0 "[ . 1 . 2]" 1
176 1 112 THR HA 1 112 THR MG 3.270 . 3.270 3.203 3.191 3.223 . 0 0 "[ . 1 . 2]" 1
177 1 112 THR MG 1 113 LEU HA 3.350 . 3.350 3.349 3.270 3.387 0.037 14 0 "[ . 1 . 2]" 1
178 1 103 PHE QD 1 112 THR MG 5.260 . 5.260 3.663 2.985 4.183 . 0 0 "[ . 1 . 2]" 1
179 1 112 THR HA 1 115 ARG H 4.130 . 4.130 3.085 2.740 3.225 . 0 0 "[ . 1 . 2]" 1
180 1 110 GLY HA2 1 112 THR MG 4.960 . 4.960 4.987 4.808 5.041 0.081 20 0 "[ . 1 . 2]" 1
181 1 113 LEU HA 1 113 LEU MD1 4.570 . 4.570 2.472 2.020 3.854 . 0 0 "[ . 1 . 2]" 1
182 1 113 LEU HA 1 113 LEU MD2 4.570 . 4.570 2.993 2.069 3.808 . 0 0 "[ . 1 . 2]" 1
183 1 26 ASP H 1 32 ILE MG 5.390 . 5.390 5.194 5.049 5.392 0.002 13 0 "[ . 1 . 2]" 1
184 1 20 ILE MG 1 144 LEU MD2 4.150 . 4.150 3.539 2.685 3.856 . 0 0 "[ . 1 . 2]" 1
185 1 20 ILE MG 1 147 VAL HB 4.860 . 4.860 4.522 4.119 4.881 0.021 8 0 "[ . 1 . 2]" 1
186 1 20 ILE HA 1 20 ILE MG 3.350 . 3.350 2.232 2.191 2.274 . 0 0 "[ . 1 . 2]" 1
187 1 17 LEU HA 1 20 ILE MG 3.970 . 3.970 3.897 3.718 4.000 0.030 15 0 "[ . 1 . 2]" 1
188 1 19 THR HB 1 20 ILE MG 4.590 . 4.590 3.306 3.069 3.588 . 0 0 "[ . 1 . 2]" 1
189 1 20 ILE MG 1 40 PHE QD 3.990 . 3.990 4.072 4.027 4.108 0.118 15 0 "[ . 1 . 2]" 1
190 1 20 ILE HG12 1 69 LEU MD2 5.500 . 5.500 5.492 5.358 5.534 0.034 18 0 "[ . 1 . 2]" 1
191 1 20 ILE HG12 1 69 LEU MD1 5.500 . 5.500 5.249 5.019 5.433 . 0 0 "[ . 1 . 2]" 1
192 1 25 ASP HB3 1 28 LYS QD 5.140 . 5.140 4.914 4.012 5.191 0.051 9 0 "[ . 1 . 2]" 1
193 1 41 ILE HA 1 42 ARG QB 5.400 . 5.400 5.422 5.357 5.451 0.051 1 0 "[ . 1 . 2]" 1
194 1 41 ILE HA 1 45 MET QB 4.910 . 4.910 1.885 1.796 2.024 . 0 0 "[ . 1 . 2]" 1
195 1 19 THR HA 1 20 ILE HA 4.850 . 4.850 4.684 4.635 4.727 . 0 0 "[ . 1 . 2]" 1
196 1 19 THR HB 1 20 ILE HA 4.580 . 4.580 4.314 4.149 4.434 . 0 0 "[ . 1 . 2]" 1
197 1 25 ASP HB3 1 29 ASP H 5.180 . 5.180 4.035 3.887 4.268 . 0 0 "[ . 1 . 2]" 1
198 1 20 ILE HG13 1 69 LEU MD2 5.500 . 5.500 4.325 4.108 4.574 . 0 0 "[ . 1 . 2]" 1
199 1 20 ILE HG13 1 69 LEU MD1 5.500 . 5.500 3.944 3.691 4.165 . 0 0 "[ . 1 . 2]" 1
200 1 22 LYS QD 1 27 ASP HA 4.890 . 4.890 4.618 4.034 5.002 0.112 8 0 "[ . 1 . 2]" 1
201 1 32 ILE HB 1 69 LEU MD2 5.500 . 5.500 4.721 4.528 5.007 . 0 0 "[ . 1 . 2]" 1
202 1 32 ILE HB 1 69 LEU MD1 5.500 . 5.500 4.984 4.777 5.298 . 0 0 "[ . 1 . 2]" 1
203 1 91 ILE HA 1 97 PRO HD3 4.710 . 4.710 3.603 3.359 3.929 . 0 0 "[ . 1 . 2]" 1
204 1 91 ILE HA 1 96 LEU HA 4.960 . 4.960 4.758 4.620 4.862 . 0 0 "[ . 1 . 2]" 1
205 1 91 ILE HA 1 92 GLU HA 4.840 . 4.840 4.707 4.656 4.761 . 0 0 "[ . 1 . 2]" 1
206 1 91 ILE HA 1 97 PRO HG3 5.500 . 5.500 5.383 5.144 5.522 0.022 17 0 "[ . 1 . 2]" 1
207 1 91 ILE HB 1 97 PRO HG3 4.450 . 4.450 3.642 3.287 3.826 . 0 0 "[ . 1 . 2]" 1
208 1 91 ILE HB 1 97 PRO HD2 4.570 . 4.570 4.500 4.250 4.615 0.045 19 0 "[ . 1 . 2]" 1
209 1 91 ILE HB 1 97 PRO HD3 4.810 . 4.810 2.832 2.539 3.108 . 0 0 "[ . 1 . 2]" 1
210 1 90 LEU MD2 1 91 ILE MG 4.140 . 4.140 1.980 1.831 2.659 . 0 0 "[ . 1 . 2]" 1
211 1 91 ILE QG 1 91 ILE MG 3.020 . 3.020 2.385 2.366 2.411 . 0 0 "[ . 1 . 2]" 1
212 1 91 ILE MG 1 97 PRO HG3 4.210 . 4.210 4.028 3.675 4.232 0.022 19 0 "[ . 1 . 2]" 1
213 1 91 ILE MG 1 100 GLU HB2 4.400 . 4.400 3.346 3.169 3.593 . 0 0 "[ . 1 . 2]" 1
214 1 91 ILE HA 1 91 ILE MG 3.070 . 3.070 2.528 2.496 2.564 . 0 0 "[ . 1 . 2]" 1
215 1 91 ILE MG 1 97 PRO HD3 4.190 . 4.190 3.415 3.125 3.801 . 0 0 "[ . 1 . 2]" 1
216 1 87 LEU HA 1 91 ILE MG 4.230 . 4.230 4.229 4.148 4.272 0.042 9 0 "[ . 1 . 2]" 1
217 1 91 ILE HB 1 92 GLU H 4.590 . 4.590 4.197 4.169 4.266 . 0 0 "[ . 1 . 2]" 1
218 1 91 ILE MG 1 92 GLU H 3.790 . 3.790 3.767 3.695 3.795 0.005 8 0 "[ . 1 . 2]" 1
219 1 91 ILE HB 1 91 ILE MD 3.360 . 3.360 3.224 3.206 3.239 . 0 0 "[ . 1 . 2]" 1
220 1 91 ILE MD 1 92 GLU HB2 3.650 . 3.650 3.408 3.259 3.497 . 0 0 "[ . 1 . 2]" 1
221 1 91 ILE HB 1 91 ILE QG 2.400 . 2.400 2.178 2.161 2.194 . 0 0 "[ . 1 . 2]" 1
222 1 91 ILE HA 1 91 ILE MD 3.740 . 3.740 3.644 3.601 3.688 . 0 0 "[ . 1 . 2]" 1
223 1 91 ILE QG 1 97 PRO HD3 4.880 . 4.880 4.514 4.296 4.710 . 0 0 "[ . 1 . 2]" 1
224 1 91 ILE QG 1 95 GLU HA 4.210 . 4.210 4.233 4.016 4.306 0.096 7 0 "[ . 1 . 2]" 1
225 1 91 ILE HB 1 92 GLU HA 5.140 . 5.140 4.917 4.808 4.986 . 0 0 "[ . 1 . 2]" 1
226 1 89 TRP HA 1 91 ILE MD 5.360 . 5.360 4.336 4.257 4.423 . 0 0 "[ . 1 . 2]" 1
227 1 20 ILE HA 1 20 ILE MD 4.260 . 4.260 4.192 4.169 4.208 . 0 0 "[ . 1 . 2]" 1
228 1 20 ILE MD 1 69 LEU MD2 5.100 . 5.100 4.596 4.353 4.839 . 0 0 "[ . 1 . 2]" 1
229 1 20 ILE MD 1 69 LEU MD1 5.340 . 5.340 3.459 3.047 3.845 . 0 0 "[ . 1 . 2]" 1
230 1 20 ILE HB 1 20 ILE MD 3.210 . 3.210 2.523 2.490 2.548 . 0 0 "[ . 1 . 2]" 1
231 1 20 ILE MD 1 147 VAL HB 3.990 . 3.990 3.627 3.435 3.910 . 0 0 "[ . 1 . 2]" 1
232 1 17 LEU HA 1 20 ILE MD 3.440 . 3.440 2.123 1.999 2.293 . 0 0 "[ . 1 . 2]" 1
233 1 20 ILE MD 1 20 ILE MG 2.400 . 2.400 1.938 1.886 1.966 . 0 0 "[ . 1 . 2]" 1
234 1 20 ILE HB 1 148 LEU MD1 4.210 . 4.210 2.502 2.216 2.744 . 0 0 "[ . 1 . 2]" 1
235 1 20 ILE MD 1 148 LEU HG 3.780 . 3.780 2.594 2.405 2.783 . 0 0 "[ . 1 . 2]" 1
236 1 20 ILE MG 1 148 LEU HG 4.190 . 4.190 3.269 2.719 3.930 . 0 0 "[ . 1 . 2]" 1
237 1 22 LYS QD 1 28 LYS QG 3.220 . 3.220 2.486 2.100 2.818 . 0 0 "[ . 1 . 2]" 1
238 1 32 ILE HB 1 64 ILE HB 4.230 . 4.230 2.259 2.036 2.527 . 0 0 "[ . 1 . 2]" 1
239 1 41 ILE MD 1 45 MET QG 3.900 . 3.900 1.971 1.828 2.261 . 0 0 "[ . 1 . 2]" 1
240 1 38 ASP QB 1 41 ILE MD 5.500 . 5.500 5.537 5.297 5.606 0.106 2 0 "[ . 1 . 2]" 1
241 1 41 ILE MG 1 50 ALA MB 3.600 . 3.600 3.314 2.993 3.617 0.017 9 0 "[ . 1 . 2]" 1
242 1 41 ILE MG 1 45 MET QG 4.010 . 4.010 2.567 2.212 2.861 . 0 0 "[ . 1 . 2]" 1
243 1 41 ILE HA 1 41 ILE MD 4.470 . 4.470 2.324 2.126 2.416 . 0 0 "[ . 1 . 2]" 1
244 1 41 ILE MD 1 54 HIS HA 5.500 . 5.500 4.291 3.650 5.566 0.066 17 0 "[ . 1 . 2]" 1
245 1 41 ILE MG 1 46 LYS HA 4.580 . 4.580 3.907 3.485 4.587 0.007 5 0 "[ . 1 . 2]" 1
246 1 41 ILE HB 1 50 ALA HA 4.950 . 4.950 3.684 3.351 4.162 . 0 0 "[ . 1 . 2]" 1
247 1 41 ILE HA 1 45 MET HA 4.470 . 4.470 4.399 4.329 4.482 0.012 9 0 "[ . 1 . 2]" 1
248 1 41 ILE MG 1 49 ASP HA 5.080 . 5.080 4.997 4.835 5.144 0.064 15 0 "[ . 1 . 2]" 1
249 1 40 PHE QD 1 41 ILE MD 4.120 . 4.120 3.156 2.869 3.677 . 0 0 "[ . 1 . 2]" 1
250 1 20 ILE HA 1 40 PHE QD 4.810 . 4.810 4.535 4.263 4.809 . 0 0 "[ . 1 . 2]" 1
251 1 40 PHE QD 1 41 ILE HA 5.140 . 5.140 4.406 3.817 4.855 . 0 0 "[ . 1 . 2]" 1
252 1 41 ILE MD 1 149 PHE QD 5.500 . 5.500 5.485 5.187 5.593 0.093 16 0 "[ . 1 . 2]" 1
253 1 41 ILE MG 1 149 PHE QD 5.500 . 5.500 5.494 4.966 5.611 0.111 14 0 "[ . 1 . 2]" 1
254 1 41 ILE HB 1 42 ARG QB 5.110 . 5.110 4.666 3.783 4.895 . 0 0 "[ . 1 . 2]" 1
255 1 57 LEU MD2 1 64 ILE MD 3.490 . 3.490 2.064 1.844 2.420 . 0 0 "[ . 1 . 2]" 1
256 1 32 ILE HB 1 64 ILE MD 4.350 . 4.350 3.344 2.842 3.715 . 0 0 "[ . 1 . 2]" 1
257 1 64 ILE MD 1 72 ARG QG 4.770 . 4.770 3.711 3.148 4.377 . 0 0 "[ . 1 . 2]" 1
258 1 64 ILE HB 1 64 ILE MD 3.400 . 3.400 2.422 2.316 2.514 . 0 0 "[ . 1 . 2]" 1
259 1 62 LYS HA 1 64 ILE MD 4.450 . 4.450 3.977 3.755 4.457 0.007 10 0 "[ . 1 . 2]" 1
260 1 64 ILE HA 1 64 ILE MD 4.070 . 4.070 3.896 3.807 3.959 . 0 0 "[ . 1 . 2]" 1
261 1 32 ILE MD 1 64 ILE HA 5.500 . 5.500 4.675 4.510 4.844 . 0 0 "[ . 1 . 2]" 1
262 1 64 ILE HA 1 64 ILE HG12 3.980 . 3.980 2.627 2.490 2.764 . 0 0 "[ . 1 . 2]" 1
263 1 64 ILE HA 1 64 ILE HG13 3.980 . 3.980 3.035 2.929 3.165 . 0 0 "[ . 1 . 2]" 1
264 1 32 ILE HB 1 64 ILE HA 5.500 . 5.500 4.569 4.377 4.921 . 0 0 "[ . 1 . 2]" 1
265 1 64 ILE HA 1 68 ASP HB2 4.690 . 4.690 3.631 2.981 3.962 . 0 0 "[ . 1 . 2]" 1
266 1 64 ILE HA 1 68 ASP HB3 4.690 . 4.690 3.316 2.875 3.655 . 0 0 "[ . 1 . 2]" 1
267 1 31 GLY QA 1 64 ILE HA 5.130 . 5.130 4.450 3.987 4.762 . 0 0 "[ . 1 . 2]" 1
268 1 32 ILE MD 1 64 ILE HB 4.280 . 4.280 2.086 1.889 2.372 . 0 0 "[ . 1 . 2]" 1
269 1 31 GLY QA 1 64 ILE HB 4.990 . 4.990 4.848 4.638 4.996 0.006 13 0 "[ . 1 . 2]" 1
270 1 64 ILE MD 1 64 ILE MG 2.890 . 2.890 2.013 1.906 2.105 . 0 0 "[ . 1 . 2]" 1
271 1 32 ILE MD 1 64 ILE MG 3.410 . 3.410 2.649 2.337 2.933 . 0 0 "[ . 1 . 2]" 1
272 1 64 ILE HG12 1 64 ILE MG 3.200 . 3.200 2.342 2.269 2.422 . 0 0 "[ . 1 . 2]" 1
273 1 64 ILE HG13 1 64 ILE MG 3.200 . 3.200 3.195 3.160 3.213 0.013 4 0 "[ . 1 . 2]" 1
274 1 64 ILE MG 1 72 ARG QG 4.330 . 4.330 3.067 2.643 3.444 . 0 0 "[ . 1 . 2]" 1
275 1 64 ILE MG 1 68 ASP HB2 3.210 . 3.210 3.080 2.072 3.280 0.070 4 0 "[ . 1 . 2]" 1
276 1 64 ILE MG 1 68 ASP HB3 3.210 . 3.210 1.992 1.897 2.217 . 0 0 "[ . 1 . 2]" 1
277 1 64 ILE MG 1 69 LEU HA 4.140 . 4.140 3.350 3.150 3.569 . 0 0 "[ . 1 . 2]" 1
278 1 54 HIS HA 1 64 ILE MD 5.500 . 5.500 5.579 5.425 5.716 0.216 16 0 "[ . 1 . 2]" 1
279 1 64 ILE MD 1 69 LEU HA 5.500 . 5.500 4.877 4.593 5.140 . 0 0 "[ . 1 . 2]" 1
280 1 64 ILE HA 1 64 ILE MG 3.180 . 3.180 2.362 2.280 2.431 . 0 0 "[ . 1 . 2]" 1
281 1 64 ILE MG 1 66 ILE HA 4.540 . 4.540 4.460 4.266 4.582 0.042 13 0 "[ . 1 . 2]" 1
282 1 21 HIS HD2 1 64 ILE MG 4.080 . 4.080 3.545 3.269 3.673 . 0 0 "[ . 1 . 2]" 1
283 1 21 HIS HA 1 64 ILE MG 5.500 . 5.500 5.390 5.024 5.533 0.033 1 0 "[ . 1 . 2]" 1
284 1 64 ILE MG 1 65 THR HB 4.790 . 4.790 4.422 4.251 4.528 . 0 0 "[ . 1 . 2]" 1
285 1 64 ILE H 1 64 ILE MG 4.590 . 4.590 3.788 3.744 3.859 . 0 0 "[ . 1 . 2]" 1
286 1 11 ARG HA 1 11 ARG HD3 4.900 . 4.900 4.675 4.618 4.733 . 0 0 "[ . 1 . 2]" 1
287 1 11 ARG HA 1 11 ARG HD2 4.130 . 4.130 4.160 4.076 4.227 0.097 8 0 "[ . 1 . 2]" 1
288 1 11 ARG HB2 1 11 ARG HD3 3.050 . 3.050 2.934 2.829 3.077 0.027 1 0 "[ . 1 . 2]" 1
289 1 11 ARG HB3 1 11 ARG HD3 3.030 . 3.030 2.555 2.445 2.691 . 0 0 "[ . 1 . 2]" 1
290 1 11 ARG HA 1 11 ARG HG2 3.710 . 3.710 3.271 3.111 3.371 . 0 0 "[ . 1 . 2]" 1
291 1 11 ARG HA 1 11 ARG HG3 3.720 . 3.720 2.550 2.478 2.668 . 0 0 "[ . 1 . 2]" 1
292 1 11 ARG HB2 1 11 ARG HD2 3.360 . 3.360 2.349 2.239 2.523 . 0 0 "[ . 1 . 2]" 1
293 1 11 ARG HB3 1 11 ARG HG2 2.900 . 2.900 2.350 2.257 2.440 . 0 0 "[ . 1 . 2]" 1
294 1 11 ARG HG2 1 12 PHE HA 4.950 . 4.950 3.687 3.385 3.929 . 0 0 "[ . 1 . 2]" 1
295 1 11 ARG HA 1 12 PHE HA 4.740 . 4.740 4.531 4.479 4.664 . 0 0 "[ . 1 . 2]" 1
296 1 8 GLU HA 1 11 ARG HA 5.470 . 5.470 4.903 4.627 5.140 . 0 0 "[ . 1 . 2]" 1
297 1 8 GLU HA 1 11 ARG HG2 4.870 . 4.870 4.657 4.072 4.953 0.083 4 0 "[ . 1 . 2]" 1
298 1 8 GLU HA 1 11 ARG HD3 4.270 . 4.270 3.634 3.069 4.229 . 0 0 "[ . 1 . 2]" 1
299 1 8 GLU HA 1 11 ARG HD2 5.010 . 5.010 4.083 3.594 4.692 . 0 0 "[ . 1 . 2]" 1
300 1 8 GLU HA 1 11 ARG HG3 5.500 . 5.500 5.111 4.817 5.532 0.032 4 0 "[ . 1 . 2]" 1
301 1 11 ARG HB3 1 11 ARG HD2 3.480 . 3.480 3.087 2.995 3.244 . 0 0 "[ . 1 . 2]" 1
302 1 94 VAL MG2 1 139 LEU HA 5.190 . 5.190 4.051 3.515 5.265 0.075 17 0 "[ . 1 . 2]" 1
303 1 81 TRP QB 1 110 GLY HA3 4.580 . 4.580 2.915 2.282 3.319 . 0 0 "[ . 1 . 2]" 1
304 1 81 TRP QB 1 110 GLY HA2 5.120 . 5.120 3.144 2.741 3.493 . 0 0 "[ . 1 . 2]" 1
305 1 109 LYS HB2 1 110 GLY HA2 5.500 . 5.500 5.417 4.608 5.565 0.065 18 0 "[ . 1 . 2]" 1
306 1 83 LEU MD1 1 84 GLU HG2 4.350 . 4.350 3.614 3.235 3.913 . 0 0 "[ . 1 . 2]" 1
307 1 78 VAL MG1 1 146 VAL MG2 3.680 . 3.680 3.583 3.474 3.669 . 0 0 "[ . 1 . 2]" 1
308 1 143 ALA MB 1 146 VAL MG2 3.630 . 3.630 3.078 2.743 3.249 . 0 0 "[ . 1 . 2]" 1
309 1 146 VAL MG2 1 147 VAL HB 3.950 . 3.950 3.964 3.878 4.001 0.051 20 0 "[ . 1 . 2]" 1
310 1 144 LEU HA 1 146 VAL MG2 5.010 . 5.010 4.744 4.418 4.906 . 0 0 "[ . 1 . 2]" 1
311 1 146 VAL HA 1 146 VAL MG2 3.460 . 3.460 3.153 3.106 3.176 . 0 0 "[ . 1 . 2]" 1
312 1 146 VAL MG2 1 148 LEU H 4.520 . 4.520 4.530 4.453 4.565 0.045 4 0 "[ . 1 . 2]" 1
313 1 143 ALA MB 1 146 VAL MG1 4.750 . 4.750 4.499 4.086 4.695 . 0 0 "[ . 1 . 2]" 1
314 1 146 VAL HA 1 150 GLY QA 4.360 . 4.360 4.206 3.581 4.433 0.073 15 0 "[ . 1 . 2]" 1
315 1 78 VAL MG2 1 146 VAL HA 5.230 . 5.230 4.325 4.236 4.516 . 0 0 "[ . 1 . 2]" 1
316 1 78 VAL MG1 1 146 VAL HA 5.230 . 5.230 5.055 4.889 5.234 0.004 10 0 "[ . 1 . 2]" 1
317 1 145 ASP H 1 146 VAL HA 5.500 . 5.500 5.439 5.355 5.493 . 0 0 "[ . 1 . 2]" 1
318 1 78 VAL MG1 1 146 VAL HB 4.090 . 4.090 4.197 4.163 4.242 0.152 9 0 "[ . 1 . 2]" 1
319 1 146 VAL HA 1 146 VAL MG1 3.150 . 3.150 2.366 2.323 2.454 . 0 0 "[ . 1 . 2]" 1
320 1 143 ALA HA 1 146 VAL MG1 3.920 . 3.920 3.324 2.900 3.578 . 0 0 "[ . 1 . 2]" 1
321 1 143 ALA HA 1 146 VAL MG2 3.450 . 3.450 1.796 1.741 1.856 . 0 0 "[ . 1 . 2]" 1
322 1 89 TRP HD1 1 146 VAL MG1 4.350 . 4.350 3.654 3.103 4.358 0.008 19 0 "[ . 1 . 2]" 1
323 1 138 LYS HA 1 138 LYS HG3 3.740 . 3.740 3.704 3.633 3.774 0.034 10 0 "[ . 1 . 2]" 1
324 1 19 THR MG 1 22 LYS HB3 4.320 . 4.320 3.947 3.548 4.326 0.006 5 0 "[ . 1 . 2]" 1
325 1 138 LYS HB2 1 138 LYS QE 4.200 . 4.200 4.020 3.814 4.179 . 0 0 "[ . 1 . 2]" 1
326 1 135 HIS HA 1 138 LYS HB2 4.810 . 4.810 4.854 4.755 4.934 0.124 15 0 "[ . 1 . 2]" 1
327 1 22 LYS QE 1 22 LYS HG2 3.600 . 3.600 2.495 2.132 3.546 . 0 0 "[ . 1 . 2]" 1
328 1 138 LYS QE 1 138 LYS HG3 3.860 . 3.860 2.705 2.379 3.048 . 0 0 "[ . 1 . 2]" 1
329 1 138 LYS HB2 1 138 LYS QD 3.250 . 3.250 2.383 2.212 2.558 . 0 0 "[ . 1 . 2]" 1
330 1 98 GLN HA 1 101 LYS QD 4.450 . 4.450 3.952 3.469 4.275 . 0 0 "[ . 1 . 2]" 1
331 1 109 LYS HA 1 109 LYS QD 4.300 . 4.300 3.914 3.823 3.991 . 0 0 "[ . 1 . 2]" 1
332 1 46 LYS HD3 1 46 LYS QE 2.670 . 2.670 2.335 2.166 2.423 . 0 0 "[ . 1 . 2]" 1
333 1 48 LYS HA 1 48 LYS QE 4.690 . 4.690 4.172 1.955 4.640 . 0 0 "[ . 1 . 2]" 1
334 1 99 TYR QD 1 138 LYS QE 5.340 . 5.340 3.846 3.231 4.106 . 0 0 "[ . 1 . 2]" 1
335 1 90 LEU HB3 1 138 LYS QE 5.500 . 5.500 5.591 5.357 5.721 0.221 17 0 "[ . 1 . 2]" 1
336 1 128 LEU HG 1 138 LYS QE 5.500 . 5.500 5.054 4.138 5.567 0.067 15 0 "[ . 1 . 2]" 1
337 1 51 THR HA 1 51 THR MG 3.440 . 3.440 2.815 2.321 3.251 . 0 0 "[ . 1 . 2]" 1
338 1 34 VAL MG2 1 62 LYS HG2 6.140 . 6.140 3.164 2.478 4.979 . 0 0 "[ . 1 . 2]" 1
339 1 62 LYS QD 1 62 LYS HG2 2.710 . 2.710 2.322 2.249 2.357 . 0 0 "[ . 1 . 2]" 1
340 1 62 LYS QE 1 62 LYS HG2 3.400 . 3.400 2.327 2.214 2.884 . 0 0 "[ . 1 . 2]" 1
341 1 62 LYS HA 1 62 LYS HG2 3.980 . 3.980 2.560 2.395 3.147 . 0 0 "[ . 1 . 2]" 1
342 1 34 VAL MG2 1 62 LYS QD 3.600 . 3.600 3.087 2.051 3.643 0.043 8 0 "[ . 1 . 2]" 1
343 1 62 LYS QD 1 62 LYS HG3 2.710 . 2.710 2.340 2.303 2.382 . 0 0 "[ . 1 . 2]" 1
344 1 62 LYS HA 1 62 LYS QD 4.190 . 4.190 3.771 2.015 4.023 . 0 0 "[ . 1 . 2]" 1
345 1 61 ASP HA 1 62 LYS HA 4.590 . 4.590 4.416 4.312 4.532 . 0 0 "[ . 1 . 2]" 1
346 1 62 LYS HA 1 62 LYS HG3 3.980 . 3.980 3.098 2.772 3.799 . 0 0 "[ . 1 . 2]" 1
347 1 34 VAL MG2 1 62 LYS HA 5.100 . 5.100 3.962 3.517 4.356 . 0 0 "[ . 1 . 2]" 1
348 1 34 VAL MG1 1 62 LYS HA 5.100 . 5.100 5.147 5.045 5.204 0.104 4 0 "[ . 1 . 2]" 1
349 1 34 VAL MG1 1 62 LYS HG3 6.140 . 6.140 4.803 3.903 5.156 . 0 0 "[ . 1 . 2]" 1
350 1 34 VAL MG1 1 62 LYS QE 3.900 . 3.900 3.254 2.701 3.928 0.028 10 0 "[ . 1 . 2]" 1
351 1 62 LYS QE 1 62 LYS HG3 3.400 . 3.400 2.324 2.135 2.909 . 0 0 "[ . 1 . 2]" 1
352 1 62 LYS HA 1 62 LYS QE 4.610 . 4.610 4.435 3.999 4.650 0.040 8 0 "[ . 1 . 2]" 1
353 1 75 THR HA 1 75 THR MG 2.510 . 2.510 2.267 2.217 2.304 . 0 0 "[ . 1 . 2]" 1
354 1 75 THR HA 1 75 THR HB 2.940 . 2.940 2.517 2.502 2.539 . 0 0 "[ . 1 . 2]" 1
355 1 74 LYS HA 1 75 THR HA 5.050 . 5.050 4.521 4.404 4.601 . 0 0 "[ . 1 . 2]" 1
356 1 74 LYS HA 1 75 THR MG 4.510 . 4.510 4.571 4.548 4.596 0.086 4 0 "[ . 1 . 2]" 1
357 1 71 LYS HA 1 75 THR MG 3.890 . 3.890 3.729 3.442 3.889 . 0 0 "[ . 1 . 2]" 1
358 1 73 TRP HA 1 76 SER HB2 4.640 . 4.640 2.193 1.948 2.557 . 0 0 "[ . 1 . 2]" 1
359 1 75 THR MG 1 76 SER HA 5.500 . 5.500 5.510 5.474 5.529 0.029 14 0 "[ . 1 . 2]" 1
360 1 73 TRP HA 1 76 SER HB3 4.640 . 4.640 2.865 1.982 3.809 . 0 0 "[ . 1 . 2]" 1
361 1 64 ILE MG 1 69 LEU HG 4.060 . 4.060 4.039 4.001 4.076 0.016 6 0 "[ . 1 . 2]" 1
362 1 64 ILE MG 1 69 LEU MD2 3.650 . 3.650 2.029 1.965 2.132 . 0 0 "[ . 1 . 2]" 1
363 1 69 LEU HB3 1 69 LEU MD2 3.330 . 3.330 3.174 3.158 3.191 . 0 0 "[ . 1 . 2]" 1
364 1 69 LEU HB2 1 69 LEU MD2 3.340 . 3.340 2.280 2.262 2.295 . 0 0 "[ . 1 . 2]" 1
365 1 69 LEU HA 1 69 LEU MD2 3.610 . 3.610 3.136 3.096 3.198 . 0 0 "[ . 1 . 2]" 1
366 1 69 LEU HA 1 69 LEU HG 3.990 . 3.990 3.792 3.764 3.826 . 0 0 "[ . 1 . 2]" 1
367 1 21 HIS HD2 1 69 LEU MD2 4.030 . 4.030 2.013 1.944 2.113 . 0 0 "[ . 1 . 2]" 1
368 1 69 LEU HA 1 71 LYS QE 4.730 . 4.730 4.820 4.735 4.885 0.155 7 0 "[ . 1 . 2]" 1
369 1 64 ILE HA 1 69 LEU MD2 4.900 . 4.900 4.640 4.538 4.788 . 0 0 "[ . 1 . 2]" 1
370 1 77 GLU HA 1 77 GLU HG3 3.960 . 3.960 3.775 3.698 4.135 0.175 18 0 "[ . 1 . 2]" 1
371 1 77 GLU HA 1 77 GLU HG2 3.960 . 3.960 3.743 3.259 3.831 . 0 0 "[ . 1 . 2]" 1
372 1 12 PHE QB 1 13 SER HA 4.210 . 4.210 3.771 3.688 4.092 . 0 0 "[ . 1 . 2]" 1
373 1 14 LEU HB2 1 14 LEU MD2 3.340 . 3.340 2.265 2.181 2.335 . 0 0 "[ . 1 . 2]" 1
374 1 14 LEU HA 1 14 LEU MD2 3.650 . 3.650 3.624 2.230 3.801 0.151 5 0 "[ . 1 . 2]" 1
375 1 14 LEU HA 1 70 TRP HD1 4.680 . 4.680 4.228 4.047 4.549 . 0 0 "[ . 1 . 2]" 1
376 1 15 GLU QB 1 16 ALA HA 4.050 . 4.050 4.030 3.959 4.075 0.025 19 0 "[ . 1 . 2]" 1
377 1 16 ALA MB 1 114 PRO HA 5.000 . 5.000 4.199 3.567 4.455 . 0 0 "[ . 1 . 2]" 1
378 1 8 GLU QB 1 12 PHE QD 3.780 . 3.780 3.540 3.029 3.863 0.083 18 0 "[ . 1 . 2]" 1
379 1 15 GLU HA 1 15 GLU HG3 3.750 . 3.750 3.453 2.810 3.760 0.010 16 0 "[ . 1 . 2]" 1
380 1 15 GLU HA 1 15 GLU HG2 3.750 . 3.750 2.690 2.268 3.021 . 0 0 "[ . 1 . 2]" 1
381 1 15 GLU QB 1 16 ALA MB 3.980 . 3.980 4.023 3.906 4.115 0.135 10 0 "[ . 1 . 2]" 1
382 1 11 ARG HG3 1 15 GLU QB 4.950 . 4.950 3.797 3.399 4.293 . 0 0 "[ . 1 . 2]" 1
383 1 56 HIS HA 1 59 ARG HA 5.290 . 5.290 5.300 4.793 5.424 0.134 13 0 "[ . 1 . 2]" 1
384 1 12 PHE HA 1 15 GLU QB 3.800 . 3.800 3.652 2.902 4.034 0.234 18 0 "[ . 1 . 2]" 1
385 1 8 GLU QB 1 11 ARG HD3 4.710 . 4.710 4.040 3.289 4.530 . 0 0 "[ . 1 . 2]" 1
386 1 67 GLU HB3 1 68 ASP H 4.250 . 4.250 4.135 4.070 4.192 . 0 0 "[ . 1 . 2]" 1
387 1 100 GLU HB3 1 103 PHE QD 5.060 . 5.060 4.755 4.120 5.087 0.027 11 0 "[ . 1 . 2]" 1
388 1 83 LEU MD1 1 84 GLU HB3 4.040 . 4.040 2.805 2.561 3.061 . 0 0 "[ . 1 . 2]" 1
389 1 18 GLN HA 1 21 HIS HB2 4.000 . 4.000 3.716 3.442 4.025 0.025 9 0 "[ . 1 . 2]" 1
390 1 18 GLN HA 1 21 HIS HB3 4.000 . 4.000 2.426 2.200 2.645 . 0 0 "[ . 1 . 2]" 1
391 1 67 GLU HB3 1 70 TRP HB2 5.500 . 5.500 4.864 4.622 5.061 . 0 0 "[ . 1 . 2]" 1
392 1 17 LEU HB2 1 17 LEU MD2 3.410 . 3.410 3.189 3.166 3.208 . 0 0 "[ . 1 . 2]" 1
393 1 17 LEU HB3 1 17 LEU MD2 3.410 . 3.410 2.486 2.433 2.541 . 0 0 "[ . 1 . 2]" 1
394 1 17 LEU MD2 1 73 TRP QB 4.420 . 4.420 3.750 3.550 3.977 . 0 0 "[ . 1 . 2]" 1
395 1 17 LEU HA 1 17 LEU MD2 4.380 . 4.380 2.035 2.004 2.092 . 0 0 "[ . 1 . 2]" 1
396 1 17 LEU MD2 1 114 PRO HA 5.270 . 5.270 3.367 3.101 3.689 . 0 0 "[ . 1 . 2]" 1
397 1 17 LEU MD2 1 70 TRP HA 5.010 . 5.010 4.523 4.294 4.760 . 0 0 "[ . 1 . 2]" 1
398 1 17 LEU MD2 1 70 TRP HD1 4.730 . 4.730 4.762 4.162 4.834 0.104 19 0 "[ . 1 . 2]" 1
399 1 17 LEU HB2 1 17 LEU MD1 3.410 . 3.410 2.466 2.436 2.510 . 0 0 "[ . 1 . 2]" 1
400 1 17 LEU HB3 1 17 LEU MD1 3.410 . 3.410 2.332 2.309 2.396 . 0 0 "[ . 1 . 2]" 1
401 1 17 LEU MD1 1 73 TRP QB 4.420 . 4.420 3.217 2.978 3.396 . 0 0 "[ . 1 . 2]" 1
402 1 17 LEU MD1 1 114 PRO HA 5.270 . 5.270 5.055 4.795 5.421 0.151 18 0 "[ . 1 . 2]" 1
403 1 17 LEU HA 1 17 LEU MD1 4.380 . 4.380 3.813 3.800 3.832 . 0 0 "[ . 1 . 2]" 1
404 1 17 LEU MD1 1 70 TRP HA 5.010 . 5.010 2.321 2.169 2.489 . 0 0 "[ . 1 . 2]" 1
405 1 17 LEU MD1 1 70 TRP HD1 4.730 . 4.730 2.643 2.056 2.884 . 0 0 "[ . 1 . 2]" 1
406 1 17 LEU HB3 1 70 TRP HD1 4.760 . 4.760 3.253 2.593 3.417 . 0 0 "[ . 1 . 2]" 1
407 1 19 THR HA 1 20 ILE MG 5.310 . 5.310 5.064 4.856 5.251 . 0 0 "[ . 1 . 2]" 1
408 1 19 THR HA 1 22 LYS HG3 4.770 . 4.770 4.358 3.917 4.741 . 0 0 "[ . 1 . 2]" 1
409 1 19 THR HA 1 22 LYS HB2 4.190 . 4.190 3.922 3.450 4.250 0.060 5 0 "[ . 1 . 2]" 1
410 1 19 THR HB 1 20 ILE MD 5.230 . 5.230 4.984 4.812 5.231 0.001 15 0 "[ . 1 . 2]" 1
411 1 19 THR MG 1 22 LYS HG3 5.030 . 5.030 4.583 3.792 4.905 . 0 0 "[ . 1 . 2]" 1
412 1 19 THR HA 1 19 THR MG 2.960 . 2.960 2.411 2.325 2.484 . 0 0 "[ . 1 . 2]" 1
413 1 23 GLN HA 1 23 GLN HG3 3.750 . 3.750 3.673 2.642 3.772 0.022 9 0 "[ . 1 . 2]" 1
414 1 20 ILE HA 1 23 GLN HG3 4.510 . 4.510 3.151 2.619 3.717 . 0 0 "[ . 1 . 2]" 1
415 1 20 ILE HA 1 23 GLN HG2 4.510 . 4.510 2.841 2.125 4.453 . 0 0 "[ . 1 . 2]" 1
416 1 23 GLN HA 1 23 GLN HG2 3.750 . 3.750 3.080 2.598 3.217 . 0 0 "[ . 1 . 2]" 1
417 1 20 ILE HA 1 23 GLN HB2 4.080 . 4.080 2.429 2.134 2.694 . 0 0 "[ . 1 . 2]" 1
418 1 20 ILE HA 1 23 GLN HB3 4.770 . 4.770 4.005 3.680 4.322 . 0 0 "[ . 1 . 2]" 1
419 1 23 GLN HB3 1 40 PHE QD 4.180 . 4.180 2.663 2.213 2.911 . 0 0 "[ . 1 . 2]" 1
420 1 22 LYS QE 1 22 LYS HG3 3.560 . 3.560 2.535 2.173 3.512 . 0 0 "[ . 1 . 2]" 1
421 1 22 LYS HB2 1 22 LYS QE 4.440 . 4.440 3.721 2.087 4.106 . 0 0 "[ . 1 . 2]" 1
422 1 138 LYS HB3 1 138 LYS QE 4.920 . 4.920 4.139 3.888 4.256 . 0 0 "[ . 1 . 2]" 1
423 1 138 LYS HB3 1 138 LYS QD 3.220 . 3.220 2.488 2.151 2.642 . 0 0 "[ . 1 . 2]" 1
424 1 135 HIS HA 1 138 LYS HB3 4.280 . 4.280 3.953 3.700 4.296 0.016 20 0 "[ . 1 . 2]" 1
425 1 22 LYS HB3 1 22 LYS QD 3.420 . 3.420 3.317 3.212 3.451 0.031 17 0 "[ . 1 . 2]" 1
426 1 22 LYS HB3 1 22 LYS QE 4.680 . 4.680 4.147 3.319 4.370 . 0 0 "[ . 1 . 2]" 1
427 1 19 THR HA 1 22 LYS HB3 3.710 . 3.710 2.523 2.215 2.711 . 0 0 "[ . 1 . 2]" 1
428 1 70 TRP HB2 1 71 LYS HG3 5.250 . 5.250 4.450 4.119 4.566 . 0 0 "[ . 1 . 2]" 1
429 1 19 THR HA 1 22 LYS HG2 4.690 . 4.690 3.915 3.409 4.205 . 0 0 "[ . 1 . 2]" 1
430 1 69 LEU HA 1 71 LYS HG3 5.310 . 5.310 4.646 4.528 5.006 . 0 0 "[ . 1 . 2]" 1
431 1 22 LYS HB2 1 22 LYS QD 3.640 . 3.640 2.374 2.144 2.503 . 0 0 "[ . 1 . 2]" 1
432 1 46 LYS HB3 1 46 LYS QE 4.000 . 4.000 2.651 1.898 4.001 0.001 7 0 "[ . 1 . 2]" 1
433 1 71 LYS HB2 1 71 LYS QE 3.580 . 3.580 2.316 2.185 3.664 0.084 14 0 "[ . 1 . 2]" 1
434 1 96 LEU HG 1 138 LYS QE 3.890 . 3.890 3.361 2.713 3.750 . 0 0 "[ . 1 . 2]" 1
435 1 22 LYS HA 1 22 LYS QE 4.350 . 4.350 4.053 2.339 4.394 0.044 12 0 "[ . 1 . 2]" 1
436 1 22 LYS HA 1 22 LYS QD 3.590 . 3.590 2.459 2.131 3.281 . 0 0 "[ . 1 . 2]" 1
437 1 22 LYS HA 1 25 ASP HB3 3.870 . 3.870 3.316 3.174 3.534 . 0 0 "[ . 1 . 2]" 1
438 1 22 LYS HA 1 22 LYS HG2 4.100 . 4.100 3.955 3.828 4.088 . 0 0 "[ . 1 . 2]" 1
439 1 25 ASP HA 1 32 ILE HA 3.940 . 3.940 2.879 2.687 3.029 . 0 0 "[ . 1 . 2]" 1
440 1 25 ASP HA 1 36 GLU QB 4.780 . 4.780 2.650 2.472 2.997 . 0 0 "[ . 1 . 2]" 1
441 1 22 LYS HA 1 25 ASP HB2 4.920 . 4.920 4.787 4.588 4.958 0.038 13 0 "[ . 1 . 2]" 1
442 1 25 ASP HA 1 32 ILE MG 4.170 . 4.170 3.605 3.428 3.759 . 0 0 "[ . 1 . 2]" 1
443 1 25 ASP HA 1 32 ILE HG12 4.520 . 4.520 3.492 3.303 3.614 . 0 0 "[ . 1 . 2]" 1
444 1 43 GLU HA 1 46 LYS HA 4.970 . 4.970 4.691 4.339 4.976 0.006 16 0 "[ . 1 . 2]" 1
445 1 43 GLU HA 1 43 GLU HG2 3.780 . 3.780 3.694 3.063 3.832 0.052 14 0 "[ . 1 . 2]" 1
446 1 43 GLU HA 1 46 LYS HD2 4.150 . 4.150 3.521 1.950 4.321 0.171 10 0 "[ . 1 . 2]" 1
447 1 26 ASP HA 1 28 LYS QG 5.500 . 5.500 3.773 3.389 4.357 . 0 0 "[ . 1 . 2]" 1
448 1 43 GLU HA 1 50 ALA MB 5.500 . 5.500 5.518 4.887 5.669 0.169 19 0 "[ . 1 . 2]" 1
449 1 24 MET ME 1 24 MET QG 3.570 . 3.570 2.066 2.013 2.083 . 0 0 "[ . 1 . 2]" 1
450 1 23 GLN HB2 1 24 MET ME 4.630 . 4.630 4.358 3.935 4.636 0.006 5 0 "[ . 1 . 2]" 1
451 1 21 HIS HA 1 24 MET ME 4.750 . 4.750 4.711 4.444 4.832 0.082 13 0 "[ . 1 . 2]" 1
452 1 24 MET ME 1 40 PHE HA 5.500 . 5.500 5.256 4.873 5.486 . 0 0 "[ . 1 . 2]" 1
453 1 24 MET ME 1 40 PHE QD 2.980 . 2.980 2.054 1.896 2.265 . 0 0 "[ . 1 . 2]" 1
454 1 23 GLN HB2 1 24 MET QG 3.960 . 3.960 3.268 2.959 3.567 . 0 0 "[ . 1 . 2]" 1
455 1 24 MET QB 1 24 MET ME 3.750 . 3.750 3.456 3.403 3.481 . 0 0 "[ . 1 . 2]" 1
456 1 24 MET ME 1 148 LEU MD1 3.560 . 3.560 1.938 1.830 2.015 . 0 0 "[ . 1 . 2]" 1
457 1 24 MET ME 1 148 LEU MD2 3.560 . 3.560 1.976 1.884 2.100 . 0 0 "[ . 1 . 2]" 1
458 1 24 MET HA 1 24 MET ME 4.390 . 4.390 4.394 4.305 4.432 0.042 20 0 "[ . 1 . 2]" 1
459 1 143 ALA MB 1 144 LEU HA 4.640 . 4.640 3.856 3.729 3.946 . 0 0 "[ . 1 . 2]" 1
460 1 22 LYS HG3 1 23 GLN HA 3.360 . 3.360 3.339 3.096 3.441 0.081 20 0 "[ . 1 . 2]" 1
461 1 24 MET QG 1 40 PHE H 5.150 . 5.150 3.685 3.270 3.961 . 0 0 "[ . 1 . 2]" 1
462 1 27 ASP HA 1 28 LYS QG 4.280 . 4.280 3.892 3.269 4.337 0.057 16 0 "[ . 1 . 2]" 1
463 1 25 ASP HB2 1 32 ILE HA 4.400 . 4.400 2.699 2.464 2.975 . 0 0 "[ . 1 . 2]" 1
464 1 25 ASP HB2 1 31 GLY QA 5.500 . 5.500 4.812 4.517 5.106 . 0 0 "[ . 1 . 2]" 1
465 1 27 ASP HA 1 28 LYS HA 5.500 . 5.500 5.186 5.011 5.266 . 0 0 "[ . 1 . 2]" 1
466 1 28 LYS HA 1 29 ASP HA 5.500 . 5.500 4.456 4.248 4.634 . 0 0 "[ . 1 . 2]" 1
467 1 27 ASP HA 1 28 LYS QD 4.790 . 4.790 3.585 3.035 4.979 0.189 12 0 "[ . 1 . 2]" 1
468 1 33 GLU HA 1 36 GLU QB 4.430 . 4.430 4.191 3.987 4.450 0.020 13 0 "[ . 1 . 2]" 1
469 1 33 GLU QB 1 36 GLU QB 4.430 . 4.430 2.499 2.221 2.808 . 0 0 "[ . 1 . 2]" 1
470 1 34 VAL HB 1 35 GLU HA 5.500 . 5.500 5.598 5.554 5.638 0.138 19 0 "[ . 1 . 2]" 1
471 1 34 VAL HB 1 62 LYS HA 5.500 . 5.500 3.811 3.615 3.925 . 0 0 "[ . 1 . 2]" 1
472 1 34 VAL MG2 1 62 LYS QB 4.000 . 4.000 3.634 3.214 4.102 0.102 9 0 "[ . 1 . 2]" 1
473 1 34 VAL MG2 1 35 GLU QG 4.640 . 4.640 4.272 3.719 4.720 0.080 9 0 "[ . 1 . 2]" 1
474 1 34 VAL MG2 1 38 ASP QB 4.990 . 4.990 3.570 3.152 3.810 . 0 0 "[ . 1 . 2]" 1
475 1 34 VAL MG2 1 62 LYS QE 3.900 . 3.900 2.878 2.297 3.232 . 0 0 "[ . 1 . 2]" 1
476 1 34 VAL HA 1 34 VAL MG2 3.230 . 3.230 2.260 2.217 2.311 . 0 0 "[ . 1 . 2]" 1
477 1 34 VAL MG2 1 35 GLU HA 4.750 . 4.750 3.971 3.650 4.277 . 0 0 "[ . 1 . 2]" 1
478 1 33 GLU HA 1 34 VAL MG2 5.130 . 5.130 5.283 5.222 5.312 0.182 12 0 "[ . 1 . 2]" 1
479 1 34 VAL MG1 1 62 LYS HG2 6.140 . 6.140 3.997 3.556 5.430 . 0 0 "[ . 1 . 2]" 1
480 1 34 VAL MG1 1 62 LYS QD 3.600 . 3.600 2.538 2.219 3.227 . 0 0 "[ . 1 . 2]" 1
481 1 34 VAL MG1 1 62 LYS QB 4.000 . 4.000 3.496 3.230 3.814 . 0 0 "[ . 1 . 2]" 1
482 1 34 VAL MG1 1 35 GLU QG 4.640 . 4.640 2.392 2.079 2.811 . 0 0 "[ . 1 . 2]" 1
483 1 34 VAL MG1 1 38 ASP QB 4.990 . 4.990 4.473 4.183 4.776 . 0 0 "[ . 1 . 2]" 1
484 1 34 VAL HA 1 34 VAL MG1 3.230 . 3.230 3.232 3.219 3.243 0.013 1 0 "[ . 1 . 2]" 1
485 1 34 VAL MG1 1 35 GLU HA 4.750 . 4.750 3.317 3.166 3.445 . 0 0 "[ . 1 . 2]" 1
486 1 33 GLU HA 1 34 VAL MG1 5.130 . 5.130 3.997 3.796 4.251 . 0 0 "[ . 1 . 2]" 1
487 1 34 VAL HA 1 62 LYS QE 5.500 . 5.500 5.482 4.971 5.567 0.067 10 0 "[ . 1 . 2]" 1
488 1 40 PHE HA 1 40 PHE QD 3.730 . 3.730 2.270 2.002 2.643 . 0 0 "[ . 1 . 2]" 1
489 1 39 GLU QG 1 40 PHE HA 4.600 . 4.600 3.623 3.299 3.867 . 0 0 "[ . 1 . 2]" 1
490 1 41 ILE MG 1 42 ARG HA 4.440 . 4.440 3.908 3.409 4.231 . 0 0 "[ . 1 . 2]" 1
491 1 87 LEU MD2 1 104 ARG QD 5.500 . 5.500 3.749 3.081 4.813 . 0 0 "[ . 1 . 2]" 1
492 1 41 ILE MG 1 42 ARG QG 5.500 . 5.500 4.697 4.342 5.153 . 0 0 "[ . 1 . 2]" 1
493 1 42 ARG HA 1 46 LYS HA 4.600 . 4.600 4.602 4.238 4.726 0.126 19 0 "[ . 1 . 2]" 1
494 1 41 ILE HB 1 42 ARG QG 4.530 . 4.530 3.643 3.330 4.532 0.002 6 0 "[ . 1 . 2]" 1
495 1 42 ARG HA 1 42 ARG QG 3.790 . 3.790 2.854 2.725 3.484 . 0 0 "[ . 1 . 2]" 1
496 1 101 LYS HA 1 104 ARG QD 5.370 . 5.370 3.535 3.004 4.601 . 0 0 "[ . 1 . 2]" 1
497 1 59 ARG HA 1 59 ARG QD 3.660 . 3.660 3.710 3.634 3.745 0.085 10 0 "[ . 1 . 2]" 1
498 1 87 LEU HB3 1 104 ARG QD 5.280 . 5.280 4.099 3.101 5.316 0.036 17 0 "[ . 1 . 2]" 1
499 1 105 ASP HA 1 106 ASN HA 4.890 . 4.890 4.699 4.626 4.751 . 0 0 "[ . 1 . 2]" 1
500 1 87 LEU HG 1 104 ARG QB 3.300 . 3.300 1.972 1.808 3.102 . 0 0 "[ . 1 . 2]" 1
501 1 35 GLU HA 1 35 GLU QG 3.180 . 3.180 2.636 2.349 3.256 0.076 9 0 "[ . 1 . 2]" 1
502 1 43 GLU HA 1 43 GLU HG3 3.780 . 3.780 3.036 2.493 3.303 . 0 0 "[ . 1 . 2]" 1
503 1 46 LYS HB2 1 46 LYS HD2 3.820 . 3.820 3.354 2.356 3.750 . 0 0 "[ . 1 . 2]" 1
504 1 46 LYS HB3 1 46 LYS HD2 3.820 . 3.820 3.208 2.163 3.729 . 0 0 "[ . 1 . 2]" 1
505 1 43 GLU HA 1 46 LYS QG 3.880 . 3.880 3.703 3.168 3.907 0.027 14 0 "[ . 1 . 2]" 1
506 1 83 LEU MD2 1 108 VAL H 4.540 . 4.540 4.248 3.906 4.439 . 0 0 "[ . 1 . 2]" 1
507 1 46 LYS HB2 1 46 LYS HD3 3.820 . 3.820 2.909 2.403 3.856 0.036 15 0 "[ . 1 . 2]" 1
508 1 46 LYS HB3 1 46 LYS HD3 3.820 . 3.820 2.776 2.253 3.566 . 0 0 "[ . 1 . 2]" 1
509 1 46 LYS HA 1 46 LYS QG 3.140 . 3.140 2.534 2.371 2.798 . 0 0 "[ . 1 . 2]" 1
510 1 22 LYS QE 1 28 LYS QD 4.300 . 4.300 3.208 2.050 3.909 . 0 0 "[ . 1 . 2]" 1
511 1 46 LYS QE 1 46 LYS QG 3.120 . 3.120 2.252 2.024 2.682 . 0 0 "[ . 1 . 2]" 1
512 1 14 LEU HA 1 17 LEU HG 4.130 . 4.130 3.873 3.592 4.176 0.046 18 0 "[ . 1 . 2]" 1
513 1 43 GLU HA 1 46 LYS HD3 4.150 . 4.150 2.934 2.384 4.252 0.102 15 0 "[ . 1 . 2]" 1
514 1 47 TYR HA 1 47 TYR QE 4.390 . 4.390 4.443 4.388 4.528 0.138 14 0 "[ . 1 . 2]" 1
515 1 47 TYR HA 1 47 TYR QD 3.480 . 3.480 2.486 2.056 3.036 . 0 0 "[ . 1 . 2]" 1
516 1 48 LYS QB 1 48 LYS QD 3.450 . 3.450 2.369 2.217 2.693 . 0 0 "[ . 1 . 2]" 1
517 1 83 LEU HA 1 83 LEU HG 4.060 . 4.060 3.549 3.522 3.579 . 0 0 "[ . 1 . 2]" 1
518 1 28 LYS HE2 1 28 LYS QG 3.570 . 3.570 2.836 2.463 2.949 . 0 0 "[ . 1 . 2]" 1
519 1 48 LYS HA 1 48 LYS HG2 3.980 . 3.980 2.761 2.410 3.699 . 0 0 "[ . 1 . 2]" 1
520 1 48 LYS HA 1 48 LYS HG3 3.980 . 3.980 2.872 2.514 3.162 . 0 0 "[ . 1 . 2]" 1
521 1 48 LYS HA 1 48 LYS QD 4.330 . 4.330 4.141 3.458 4.239 . 0 0 "[ . 1 . 2]" 1
522 1 42 ARG QB 1 43 GLU HB3 5.500 . 5.500 4.487 4.148 5.263 . 0 0 "[ . 1 . 2]" 1
523 1 45 MET ME 1 48 LYS QD 4.180 . 4.180 3.607 3.219 4.196 0.016 17 0 "[ . 1 . 2]" 1
524 1 45 MET ME 1 48 LYS QE 4.950 . 4.950 3.431 1.918 5.055 0.105 6 0 "[ . 1 . 2]" 1
525 1 43 GLU HA 1 46 LYS QE 4.150 . 4.150 2.938 1.876 4.234 0.084 7 0 "[ . 1 . 2]" 1
526 1 48 LYS QE 1 142 LYS HA 4.110 . 4.110 3.815 3.215 4.215 0.105 11 0 "[ . 1 . 2]" 1
527 1 59 ARG QD 1 60 GLU QG 3.900 . 3.900 3.536 2.007 4.003 0.103 6 0 "[ . 1 . 2]" 1
528 1 28 LYS HA 1 66 ILE HB 5.500 . 5.500 5.108 4.679 5.601 0.101 9 0 "[ . 1 . 2]" 1
529 1 66 ILE HG13 1 66 ILE MG 3.000 . 3.000 2.374 2.294 2.418 . 0 0 "[ . 1 . 2]" 1
530 1 66 ILE HA 1 66 ILE MG 3.420 . 3.420 3.234 3.221 3.248 . 0 0 "[ . 1 . 2]" 1
531 1 21 HIS HD2 1 66 ILE MG 5.500 . 5.500 5.196 5.042 5.407 . 0 0 "[ . 1 . 2]" 1
532 1 14 LEU MD2 1 66 ILE MG 5.500 . 5.500 5.519 4.966 5.619 0.119 13 0 "[ . 1 . 2]" 1
533 1 18 GLN HB2 1 66 ILE MD 3.990 . 3.990 2.627 2.422 2.822 . 0 0 "[ . 1 . 2]" 1
534 1 66 ILE MD 1 69 LEU HB2 3.960 . 3.960 3.497 3.320 3.670 . 0 0 "[ . 1 . 2]" 1
535 1 18 GLN HB3 1 66 ILE MD 3.990 . 3.990 3.826 3.689 3.962 . 0 0 "[ . 1 . 2]" 1
536 1 21 HIS HB2 1 66 ILE MD 3.640 . 3.640 2.756 2.586 2.865 . 0 0 "[ . 1 . 2]" 1
537 1 21 HIS HB3 1 66 ILE MD 3.640 . 3.640 2.230 2.085 2.426 . 0 0 "[ . 1 . 2]" 1
538 1 66 ILE HA 1 66 ILE MD 3.190 . 3.190 2.137 2.085 2.183 . 0 0 "[ . 1 . 2]" 1
539 1 18 GLN HA 1 66 ILE MD 3.160 . 3.160 1.824 1.747 1.871 . 0 0 "[ . 1 . 2]" 1
540 1 21 HIS HD2 1 66 ILE MD 4.690 . 4.690 4.099 3.974 4.209 . 0 0 "[ . 1 . 2]" 1
541 1 66 ILE HB 1 66 ILE MD 3.160 . 3.160 2.467 2.435 2.512 . 0 0 "[ . 1 . 2]" 1
542 1 66 ILE HA 1 69 LEU HB3 5.500 . 5.500 5.417 5.246 5.514 0.014 19 0 "[ . 1 . 2]" 1
543 1 66 ILE HA 1 69 LEU HB2 4.400 . 4.400 3.880 3.660 4.021 . 0 0 "[ . 1 . 2]" 1
544 1 21 HIS HD2 1 66 ILE HA 4.480 . 4.480 3.106 2.963 3.329 . 0 0 "[ . 1 . 2]" 1
545 1 66 ILE HG12 1 66 ILE MG 3.000 . 3.000 2.312 2.275 2.342 . 0 0 "[ . 1 . 2]" 1
546 1 66 ILE HA 1 69 LEU MD2 4.130 . 4.130 2.004 1.955 2.035 . 0 0 "[ . 1 . 2]" 1
547 1 67 GLU HA 1 70 TRP HB3 4.880 . 4.880 4.305 4.104 4.479 . 0 0 "[ . 1 . 2]" 1
548 1 67 GLU HA 1 70 TRP HB2 4.210 . 4.210 2.753 2.575 3.211 . 0 0 "[ . 1 . 2]" 1
549 1 67 GLU HA 1 67 GLU HG3 3.990 . 3.990 3.775 3.730 3.821 . 0 0 "[ . 1 . 2]" 1
550 1 67 GLU HA 1 67 GLU HG2 3.850 . 3.850 3.716 3.658 3.755 . 0 0 "[ . 1 . 2]" 1
551 1 66 ILE MG 1 67 GLU HA 4.140 . 4.140 3.567 3.410 3.702 . 0 0 "[ . 1 . 2]" 1
552 1 66 ILE MG 1 67 GLU HB2 4.780 . 4.780 4.520 4.425 4.638 . 0 0 "[ . 1 . 2]" 1
553 1 67 GLU HB2 1 70 TRP HB2 4.660 . 4.660 4.116 3.883 4.392 . 0 0 "[ . 1 . 2]" 1
554 1 67 GLU HB2 1 70 TRP HB3 5.500 . 5.500 5.213 4.950 5.517 0.017 20 0 "[ . 1 . 2]" 1
555 1 8 GLU QB 1 8 GLU HG3 2.620 . 2.620 2.263 2.162 2.469 . 0 0 "[ . 1 . 2]" 1
556 1 67 GLU HG3 1 68 ASP HA 3.600 . 3.600 3.413 3.220 3.605 0.005 11 0 "[ . 1 . 2]" 1
557 1 84 GLU HG3 1 85 ASP QB 4.050 . 4.050 3.559 2.929 4.132 0.082 13 0 "[ . 1 . 2]" 1
558 1 66 ILE MG 1 67 GLU HG2 3.500 . 3.500 3.194 2.905 3.469 . 0 0 "[ . 1 . 2]" 1
559 1 67 GLU HG2 1 69 LEU H 5.500 . 5.500 5.301 5.093 5.503 0.003 14 0 "[ . 1 . 2]" 1
560 1 70 TRP HA 1 70 TRP HD1 3.990 . 3.990 3.200 2.496 3.426 . 0 0 "[ . 1 . 2]" 1
561 1 71 LYS QE 1 72 ARG QB 4.190 . 4.190 3.625 3.376 3.786 . 0 0 "[ . 1 . 2]" 1
562 1 46 LYS HB2 1 46 LYS QE 4.000 . 4.000 3.306 2.177 4.035 0.035 16 0 "[ . 1 . 2]" 1
563 1 71 LYS QE 1 72 ARG QG 3.090 . 3.090 2.190 2.039 2.504 . 0 0 "[ . 1 . 2]" 1
564 1 71 LYS H 1 71 LYS QE 4.400 . 4.400 3.964 3.708 4.038 . 0 0 "[ . 1 . 2]" 1
565 1 71 LYS QE 1 71 LYS HG2 3.270 . 3.270 3.200 2.246 3.274 0.004 19 0 "[ . 1 . 2]" 1
566 1 71 LYS HA 1 71 LYS HG2 4.170 . 4.170 3.853 3.705 4.137 . 0 0 "[ . 1 . 2]" 1
567 1 90 LEU MD1 1 138 LYS QD 5.500 . 5.500 2.970 2.085 3.426 . 0 0 "[ . 1 . 2]" 1
568 1 71 LYS HA 1 71 LYS QD 4.860 . 4.860 4.448 3.744 4.521 . 0 0 "[ . 1 . 2]" 1
569 1 71 LYS QD 1 72 ARG HA 5.210 . 5.210 4.868 2.930 5.220 0.010 15 0 "[ . 1 . 2]" 1
570 1 71 LYS HA 1 71 LYS HG3 3.720 . 3.720 3.507 3.421 3.572 . 0 0 "[ . 1 . 2]" 1
571 1 71 LYS QE 1 71 LYS HG3 3.130 . 3.130 2.177 2.050 2.226 . 0 0 "[ . 1 . 2]" 1
572 1 71 LYS HB3 1 71 LYS QE 4.310 . 4.310 3.628 3.562 3.985 . 0 0 "[ . 1 . 2]" 1
573 1 68 ASP HA 1 71 LYS QE 3.890 . 3.890 2.905 2.058 3.134 . 0 0 "[ . 1 . 2]" 1
574 1 68 ASP HA 1 71 LYS HG2 4.400 . 4.400 2.399 2.212 2.862 . 0 0 "[ . 1 . 2]" 1
575 1 68 ASP HA 1 71 LYS HG3 4.810 . 4.810 2.222 2.073 2.554 . 0 0 "[ . 1 . 2]" 1
576 1 68 ASP HA 1 71 LYS QD 4.240 . 4.240 2.230 2.029 3.779 . 0 0 "[ . 1 . 2]" 1
577 1 71 LYS HB2 1 71 LYS QD 3.150 . 3.150 2.359 2.137 2.409 . 0 0 "[ . 1 . 2]" 1
578 1 72 ARG QB 1 73 TRP HA 4.600 . 4.600 3.598 3.505 3.699 . 0 0 "[ . 1 . 2]" 1
579 1 73 TRP HA 1 73 TRP HE3 4.160 . 4.160 2.022 1.991 2.069 . 0 0 "[ . 1 . 2]" 1
580 1 73 TRP QB 1 78 VAL HB 4.800 . 4.800 4.882 4.842 4.926 0.126 9 0 "[ . 1 . 2]" 1
581 1 72 ARG QB 1 72 ARG QD 3.430 . 3.430 2.466 2.232 2.924 . 0 0 "[ . 1 . 2]" 1
582 1 64 ILE MG 1 72 ARG QD 5.500 . 5.500 4.426 3.944 5.064 . 0 0 "[ . 1 . 2]" 1
583 1 57 LEU HG 1 72 ARG QD 5.110 . 5.110 4.885 4.135 5.172 0.062 5 0 "[ . 1 . 2]" 1
584 1 69 LEU MD1 1 72 ARG QD 5.460 . 5.460 4.854 4.425 5.262 . 0 0 "[ . 1 . 2]" 1
585 1 69 LEU HA 1 72 ARG QD 5.390 . 5.390 4.774 4.396 5.212 . 0 0 "[ . 1 . 2]" 1
586 1 42 ARG HA 1 42 ARG HD3 4.340 . 4.340 2.422 1.867 4.342 0.002 6 0 "[ . 1 . 2]" 1
587 1 48 LYS QD 1 142 LYS QD 2.730 . 2.730 2.398 1.948 2.800 0.070 18 0 "[ . 1 . 2]" 1
588 1 69 LEU HA 1 72 ARG QG 3.250 . 3.250 2.887 2.454 3.347 0.097 10 0 "[ . 1 . 2]" 1
589 1 68 ASP HA 1 72 ARG QG 5.020 . 5.020 3.875 3.525 4.275 . 0 0 "[ . 1 . 2]" 1
590 1 71 LYS HG3 1 72 ARG QB 3.920 . 3.920 3.977 3.833 4.075 0.155 14 0 "[ . 1 . 2]" 1
591 1 69 LEU MD1 1 72 ARG QB 4.820 . 4.820 3.479 3.345 3.685 . 0 0 "[ . 1 . 2]" 1
592 1 69 LEU MD1 1 72 ARG QG 3.760 . 3.760 3.275 2.883 3.724 . 0 0 "[ . 1 . 2]" 1
593 1 72 ARG QB 1 73 TRP QB 4.610 . 4.610 4.160 4.047 4.309 . 0 0 "[ . 1 . 2]" 1
594 1 69 LEU HA 1 72 ARG QB 4.690 . 4.690 2.250 2.153 2.403 . 0 0 "[ . 1 . 2]" 1
595 1 72 ARG QB 1 73 TRP HE3 5.380 . 5.380 2.873 2.767 3.001 . 0 0 "[ . 1 . 2]" 1
596 1 71 LYS QE 1 72 ARG HA 3.880 . 3.880 2.975 2.687 3.645 . 0 0 "[ . 1 . 2]" 1
597 1 72 ARG HA 1 72 ARG QG 3.440 . 3.440 2.727 2.424 2.890 . 0 0 "[ . 1 . 2]" 1
598 1 71 LYS HG3 1 72 ARG HA 4.280 . 4.280 4.195 4.060 4.308 0.028 9 0 "[ . 1 . 2]" 1
599 1 72 ARG HA 1 72 ARG QD 4.100 . 4.100 2.281 1.924 3.202 . 0 0 "[ . 1 . 2]" 1
600 1 82 THR HA 1 109 LYS HB3 3.840 . 3.840 2.644 2.325 3.090 . 0 0 "[ . 1 . 2]" 1
601 1 82 THR MG 1 84 GLU HB2 4.360 . 4.360 4.237 4.140 4.342 . 0 0 "[ . 1 . 2]" 1
602 1 82 THR HA 1 109 LYS HB2 4.360 . 4.360 2.242 1.817 2.575 . 0 0 "[ . 1 . 2]" 1
603 1 82 THR HA 1 82 THR MG 3.250 . 3.250 3.222 3.205 3.237 . 0 0 "[ . 1 . 2]" 1
604 1 85 ASP HA 1 88 GLN QB 3.840 . 3.840 3.791 3.534 3.888 0.048 4 0 "[ . 1 . 2]" 1
605 1 56 HIS QB 1 57 LEU HA 4.510 . 4.510 4.159 3.773 4.414 . 0 0 "[ . 1 . 2]" 1
606 1 86 THR HA 1 89 TRP QB 4.870 . 4.870 2.774 2.422 3.109 . 0 0 "[ . 1 . 2]" 1
607 1 85 ASP QB 1 86 THR HB 5.500 . 5.500 4.749 4.406 5.612 0.112 19 0 "[ . 1 . 2]" 1
608 1 86 THR HB 1 109 LYS HB3 5.500 . 5.500 4.880 4.262 5.191 . 0 0 "[ . 1 . 2]" 1
609 1 86 THR MG 1 113 LEU MD1 4.660 . 4.660 2.592 1.858 3.260 . 0 0 "[ . 1 . 2]" 1
610 1 86 THR MG 1 103 PHE QB 4.640 . 4.640 4.107 3.629 4.391 . 0 0 "[ . 1 . 2]" 1
611 1 86 THR MG 1 110 GLY HA2 4.220 . 4.220 3.454 2.924 3.983 . 0 0 "[ . 1 . 2]" 1
612 1 86 THR HA 1 86 THR MG 3.410 . 3.410 2.344 2.309 2.437 . 0 0 "[ . 1 . 2]" 1
613 1 86 THR MG 1 87 LEU H 4.050 . 4.050 3.463 3.271 3.652 . 0 0 "[ . 1 . 2]" 1
614 1 87 LEU HA 1 90 LEU HB2 4.770 . 4.770 2.881 2.730 3.066 . 0 0 "[ . 1 . 2]" 1
615 1 87 LEU HA 1 87 LEU MD2 3.650 . 3.650 2.679 1.915 2.809 . 0 0 "[ . 1 . 2]" 1
616 1 87 LEU HA 1 91 ILE MD 5.030 . 5.030 4.600 4.498 4.686 . 0 0 "[ . 1 . 2]" 1
617 1 87 LEU HA 1 90 LEU H 3.880 . 3.880 2.841 2.736 3.026 . 0 0 "[ . 1 . 2]" 1
618 1 87 LEU HA 1 87 LEU MD1 3.650 . 3.650 1.976 1.848 3.610 . 0 0 "[ . 1 . 2]" 1
619 1 17 LEU HB2 1 70 TRP HD1 4.760 . 4.760 3.030 2.546 3.228 . 0 0 "[ . 1 . 2]" 1
620 1 87 LEU HA 1 103 PHE QB 4.830 . 4.830 4.784 4.602 4.877 0.047 7 0 "[ . 1 . 2]" 1
621 1 87 LEU HB2 1 104 ARG QB 4.310 . 4.310 3.751 3.380 4.355 0.045 12 0 "[ . 1 . 2]" 1
622 1 87 LEU HA 1 100 GLU HB2 3.860 . 3.860 3.886 3.735 3.977 0.117 8 0 "[ . 1 . 2]" 1
623 1 87 LEU MD2 1 103 PHE QD 4.330 . 4.330 4.199 2.751 4.424 0.094 13 0 "[ . 1 . 2]" 1
624 1 87 LEU MD1 1 103 PHE QD 4.330 . 4.330 2.776 2.331 4.384 0.054 12 0 "[ . 1 . 2]" 1
625 1 87 LEU MD1 1 88 GLN H 4.980 . 4.980 4.620 4.585 4.709 . 0 0 "[ . 1 . 2]" 1
626 1 87 LEU H 1 87 LEU MD1 4.350 . 4.350 3.692 3.615 3.850 . 0 0 "[ . 1 . 2]" 1
627 1 87 LEU HB2 1 91 ILE MD 5.360 . 5.360 5.064 4.815 5.155 . 0 0 "[ . 1 . 2]" 1
628 1 144 LEU QB 1 146 VAL MG2 5.500 . 5.500 5.202 5.109 5.289 . 0 0 "[ . 1 . 2]" 1
629 1 87 LEU HB3 1 91 ILE MG 4.690 . 4.690 3.778 3.654 4.029 . 0 0 "[ . 1 . 2]" 1
630 1 90 LEU HA 1 94 VAL HB 4.930 . 4.930 2.888 2.401 4.973 0.043 15 0 "[ . 1 . 2]" 1
631 1 90 LEU MD2 1 94 VAL MG2 4.850 . 4.850 3.760 2.066 4.446 . 0 0 "[ . 1 . 2]" 1
632 1 90 LEU MD2 1 99 TYR HB2 6.120 . 6.120 3.915 3.353 4.214 . 0 0 "[ . 1 . 2]" 1
633 1 90 LEU HA 1 90 LEU MD2 4.640 . 4.640 3.528 3.375 3.955 . 0 0 "[ . 1 . 2]" 1
634 1 87 LEU HA 1 90 LEU MD2 4.320 . 4.320 3.529 2.906 3.851 . 0 0 "[ . 1 . 2]" 1
635 1 90 LEU MD2 1 96 LEU H 4.630 . 4.630 2.756 2.388 4.631 0.001 19 0 "[ . 1 . 2]" 1
636 1 90 LEU MD1 1 94 VAL MG1 4.850 . 4.850 3.216 1.967 3.656 . 0 0 "[ . 1 . 2]" 1
637 1 90 LEU MD1 1 91 ILE MG 4.140 . 4.140 3.907 3.747 4.097 . 0 0 "[ . 1 . 2]" 1
638 1 90 LEU MD1 1 94 VAL HB 5.350 . 5.350 4.127 2.258 5.111 . 0 0 "[ . 1 . 2]" 1
639 1 90 LEU MD1 1 99 TYR HB2 6.120 . 6.120 3.632 3.385 3.860 . 0 0 "[ . 1 . 2]" 1
640 1 90 LEU HA 1 90 LEU MD1 4.640 . 4.640 3.593 2.405 3.779 . 0 0 "[ . 1 . 2]" 1
641 1 87 LEU HA 1 90 LEU MD1 4.320 . 4.320 3.423 3.207 4.381 0.061 19 0 "[ . 1 . 2]" 1
642 1 90 LEU H 1 90 LEU MD1 4.600 . 4.600 4.281 4.198 4.410 . 0 0 "[ . 1 . 2]" 1
643 1 90 LEU MD2 1 138 LYS QD 5.500 . 5.500 3.763 3.297 4.244 . 0 0 "[ . 1 . 2]" 1
644 1 89 TRP H 1 90 LEU HB2 5.500 . 5.500 5.110 5.007 5.274 . 0 0 "[ . 1 . 2]" 1
645 1 144 LEU QB 1 146 VAL H 5.500 . 5.500 4.811 4.690 4.992 . 0 0 "[ . 1 . 2]" 1
646 1 90 LEU HG 1 94 VAL MG1 4.730 . 4.730 2.500 2.209 3.534 . 0 0 "[ . 1 . 2]" 1
647 1 90 LEU HA 1 90 LEU HG 4.050 . 4.050 2.861 2.790 3.264 . 0 0 "[ . 1 . 2]" 1
648 1 90 LEU HG 1 91 ILE HA 4.570 . 4.570 4.035 3.103 4.303 . 0 0 "[ . 1 . 2]" 1
649 1 90 LEU MD2 1 103 PHE QD 4.450 . 4.450 3.646 2.179 4.126 . 0 0 "[ . 1 . 2]" 1
650 1 90 LEU HG 1 103 PHE QD 4.640 . 4.640 4.729 4.687 4.789 0.149 10 0 "[ . 1 . 2]" 1
651 1 90 LEU MD1 1 103 PHE QD 4.450 . 4.450 2.187 2.029 3.138 . 0 0 "[ . 1 . 2]" 1
652 1 90 LEU H 1 90 LEU HG 4.600 . 4.600 4.600 4.405 4.646 0.046 20 0 "[ . 1 . 2]" 1
653 1 87 LEU HA 1 90 LEU HB3 4.710 . 4.710 2.221 2.107 2.369 . 0 0 "[ . 1 . 2]" 1
654 1 90 LEU MD2 1 94 VAL HB 5.350 . 5.350 3.552 3.049 5.405 0.055 10 0 "[ . 1 . 2]" 1
655 1 144 LEU HA 1 148 LEU HG 4.610 . 4.610 3.935 3.648 4.379 . 0 0 "[ . 1 . 2]" 1
656 1 40 PHE QD 1 148 LEU HG 5.500 . 5.500 5.414 5.092 5.527 0.027 17 0 "[ . 1 . 2]" 1
657 1 92 GLU HB3 1 93 PHE HA 4.480 . 4.480 4.313 4.186 4.489 0.009 9 0 "[ . 1 . 2]" 1
658 1 93 PHE HA 1 93 PHE QD 3.630 . 3.630 3.035 2.883 3.117 . 0 0 "[ . 1 . 2]" 1
659 1 94 VAL HA 1 142 LYS QD 4.340 . 4.340 3.749 3.049 4.408 0.068 15 0 "[ . 1 . 2]" 1
660 1 94 VAL HA 1 142 LYS QG 4.080 . 4.080 3.426 2.607 3.923 . 0 0 "[ . 1 . 2]" 1
661 1 90 LEU MD1 1 94 VAL MG2 4.850 . 4.850 3.300 2.000 3.910 . 0 0 "[ . 1 . 2]" 1
662 1 57 LEU MD2 1 64 ILE MG 3.950 . 3.950 3.645 3.386 3.888 . 0 0 "[ . 1 . 2]" 1
663 1 90 LEU HG 1 94 VAL MG2 4.730 . 4.730 2.684 1.760 4.039 . 0 0 "[ . 1 . 2]" 1
664 1 94 VAL MG2 1 138 LYS HG3 4.050 . 4.050 3.649 3.088 3.956 . 0 0 "[ . 1 . 2]" 1
665 1 94 VAL MG2 1 96 LEU H 4.470 . 4.470 4.035 1.671 4.513 0.043 13 0 "[ . 1 . 2]" 1
666 1 57 LEU MD2 1 58 HIS H 4.380 . 4.380 4.067 3.582 4.498 0.118 4 0 "[ . 1 . 2]" 1
667 1 91 ILE H 1 94 VAL MG2 5.190 . 5.190 4.792 3.907 4.987 . 0 0 "[ . 1 . 2]" 1
668 1 90 LEU MD2 1 94 VAL MG1 4.850 . 4.850 3.344 3.012 4.404 . 0 0 "[ . 1 . 2]" 1
669 1 94 VAL MG1 1 138 LYS HG3 4.050 . 4.050 3.177 2.778 3.539 . 0 0 "[ . 1 . 2]" 1
670 1 94 VAL MG1 1 142 LYS QG 4.620 . 4.620 3.780 1.752 4.282 . 0 0 "[ . 1 . 2]" 1
671 1 94 VAL HA 1 94 VAL MG1 3.600 . 3.600 2.555 2.507 2.595 . 0 0 "[ . 1 . 2]" 1
672 1 94 VAL MG1 1 139 LEU HA 5.190 . 5.190 4.625 3.558 5.079 . 0 0 "[ . 1 . 2]" 1
673 1 94 VAL MG1 1 138 LYS HA 4.800 . 4.800 3.611 2.674 3.967 . 0 0 "[ . 1 . 2]" 1
674 1 92 GLU HA 1 92 GLU HG3 3.680 . 3.680 3.244 2.831 3.645 . 0 0 "[ . 1 . 2]" 1
675 1 91 ILE QG 1 92 GLU HG3 4.630 . 4.630 3.689 2.738 4.618 . 0 0 "[ . 1 . 2]" 1
676 1 91 ILE MD 1 92 GLU HG3 3.750 . 3.750 3.014 2.243 3.782 0.032 15 0 "[ . 1 . 2]" 1
677 1 91 ILE MD 1 92 GLU HA 4.020 . 4.020 3.835 3.753 3.926 . 0 0 "[ . 1 . 2]" 1
678 1 92 GLU HB2 1 93 PHE QB 4.470 . 4.470 4.428 4.317 4.504 0.034 10 0 "[ . 1 . 2]" 1
679 1 91 ILE QG 1 92 GLU HB2 4.260 . 4.260 4.226 4.088 4.280 0.020 17 0 "[ . 1 . 2]" 1
680 1 91 ILE MD 1 92 GLU HB3 4.650 . 4.650 4.597 4.448 4.650 0.000 15 0 "[ . 1 . 2]" 1
681 1 89 TRP HA 1 92 GLU HB3 3.640 . 3.640 3.748 3.711 3.789 0.149 13 0 "[ . 1 . 2]" 1
682 1 96 LEU HA 1 97 PRO HG2 4.430 . 4.430 4.441 4.360 4.457 0.027 17 0 "[ . 1 . 2]" 1
683 1 91 ILE HB 1 96 LEU QB 5.500 . 5.500 5.499 5.325 5.551 0.051 18 0 "[ . 1 . 2]" 1
684 1 96 LEU MD1 1 138 LYS QE 4.970 . 4.970 3.933 3.389 4.389 . 0 0 "[ . 1 . 2]" 1
685 1 96 LEU HA 1 96 LEU MD1 3.740 . 3.740 2.205 2.122 2.423 . 0 0 "[ . 1 . 2]" 1
686 1 96 LEU MD1 1 134 SER HA 5.500 . 5.500 5.077 4.211 5.533 0.033 2 0 "[ . 1 . 2]" 1
687 1 96 LEU H 1 96 LEU MD1 4.540 . 4.540 4.386 4.311 4.429 . 0 0 "[ . 1 . 2]" 1
688 1 114 PRO HA 1 147 VAL MG2 4.090 . 4.090 1.947 1.863 2.082 . 0 0 "[ . 1 . 2]" 1
689 1 147 VAL HA 1 147 VAL MG2 3.750 . 3.750 2.310 2.289 2.343 . 0 0 "[ . 1 . 2]" 1
690 1 96 LEU HA 1 96 LEU MD2 2.950 . 2.950 2.371 2.258 2.462 . 0 0 "[ . 1 . 2]" 1
691 1 96 LEU H 1 96 LEU MD2 4.050 . 4.050 3.087 2.831 3.216 . 0 0 "[ . 1 . 2]" 1
692 1 147 VAL MG2 1 148 LEU H 4.110 . 4.110 3.869 3.782 3.920 . 0 0 "[ . 1 . 2]" 1
693 1 96 LEU H 1 96 LEU HG 4.580 . 4.580 4.508 4.232 4.605 0.025 18 0 "[ . 1 . 2]" 1
694 1 96 LEU HG 1 135 HIS HA 4.830 . 4.830 4.707 4.403 4.899 0.069 20 0 "[ . 1 . 2]" 1
695 1 95 GLU HA 1 97 PRO HD3 4.630 . 4.630 3.083 2.829 3.353 . 0 0 "[ . 1 . 2]" 1
696 1 91 ILE HA 1 95 GLU HA 4.390 . 4.390 2.596 2.482 2.769 . 0 0 "[ . 1 . 2]" 1
697 1 46 LYS HA 1 46 LYS QE 4.920 . 4.920 4.478 4.161 4.932 0.012 18 0 "[ . 1 . 2]" 1
698 1 46 LYS HA 1 49 ASP HA 4.680 . 4.680 4.268 3.922 4.690 0.010 5 0 "[ . 1 . 2]" 1
699 1 95 GLU HB3 1 96 LEU H 4.910 . 4.910 4.407 4.227 4.502 . 0 0 "[ . 1 . 2]" 1
700 1 100 GLU HB2 1 104 ARG H 4.660 . 4.660 4.660 4.512 4.698 0.038 7 0 "[ . 1 . 2]" 1
701 1 28 LYS QB 1 66 ILE MD 5.500 . 5.500 4.337 4.137 4.531 . 0 0 "[ . 1 . 2]" 1
702 1 100 GLU HB2 1 103 PHE QB 4.560 . 4.560 4.563 4.345 4.631 0.071 5 0 "[ . 1 . 2]" 1
703 1 102 ASN HA 1 106 ASN H 3.990 . 3.990 3.907 3.658 4.030 0.040 19 0 "[ . 1 . 2]" 1
704 1 101 LYS HA 1 101 LYS QG 3.440 . 3.440 3.484 3.450 3.504 0.064 8 0 "[ . 1 . 2]" 1
705 1 45 MET ME 1 48 LYS QB 4.170 . 4.170 3.795 2.894 4.268 0.098 18 0 "[ . 1 . 2]" 1
706 1 101 LYS HB3 1 101 LYS QE 4.590 . 4.590 4.162 3.957 4.241 . 0 0 "[ . 1 . 2]" 1
707 1 25 ASP HB2 1 28 LYS QG 5.500 . 5.500 4.814 4.515 5.537 0.037 12 0 "[ . 1 . 2]" 1
708 1 101 LYS QG 1 102 ASN HA 4.290 . 4.290 3.213 3.080 3.328 . 0 0 "[ . 1 . 2]" 1
709 1 71 LYS H 1 71 LYS HB2 3.890 . 3.890 3.617 3.570 3.650 . 0 0 "[ . 1 . 2]" 1
710 1 101 LYS QD 1 102 ASN HA 4.320 . 4.320 4.284 4.147 4.361 0.041 19 0 "[ . 1 . 2]" 1
711 1 101 LYS HA 1 101 LYS QD 3.830 . 3.830 3.701 3.652 3.829 . 0 0 "[ . 1 . 2]" 1
712 1 101 LYS HB3 1 101 LYS QD 2.590 . 2.590 2.390 2.348 2.450 . 0 0 "[ . 1 . 2]" 1
713 1 101 LYS QE 1 128 LEU MD1 5.500 . 5.500 4.709 3.733 5.552 0.052 1 0 "[ . 1 . 2]" 1
714 1 101 LYS QE 1 128 LEU MD2 5.500 . 5.500 5.458 4.755 5.622 0.122 14 0 "[ . 1 . 2]" 1
715 1 103 PHE QB 1 108 VAL HB 4.570 . 4.570 2.220 1.930 2.373 . 0 0 "[ . 1 . 2]" 1
716 1 103 PHE HA 1 106 ASN H 4.630 . 4.630 3.706 3.511 3.937 . 0 0 "[ . 1 . 2]" 1
717 1 103 PHE HA 1 103 PHE QD 4.100 . 4.100 2.137 1.939 2.378 . 0 0 "[ . 1 . 2]" 1
718 1 103 PHE HA 1 108 VAL H 4.780 . 4.780 4.684 4.536 4.802 0.022 9 0 "[ . 1 . 2]" 1
719 1 103 PHE QB 1 104 ARG QB 5.460 . 5.460 3.812 3.672 3.947 . 0 0 "[ . 1 . 2]" 1
720 1 104 ARG HA 1 104 ARG QD 4.170 . 4.170 4.011 3.860 4.221 0.051 18 0 "[ . 1 . 2]" 1
721 1 104 ARG QB 1 104 ARG QD 3.390 . 3.390 2.187 2.038 2.297 . 0 0 "[ . 1 . 2]" 1
722 1 101 LYS HA 1 104 ARG QG 4.970 . 4.970 4.412 4.103 4.732 . 0 0 "[ . 1 . 2]" 1
723 1 86 THR MG 1 139 LEU HG 5.500 . 5.500 5.463 5.032 5.584 0.084 3 0 "[ . 1 . 2]" 1
724 1 83 LEU MD1 1 104 ARG QG 4.590 . 4.590 2.462 2.024 2.912 . 0 0 "[ . 1 . 2]" 1
725 1 43 GLU HB2 1 46 LYS QE 5.270 . 5.270 4.543 3.599 5.292 0.022 19 0 "[ . 1 . 2]" 1
726 1 101 LYS HA 1 104 ARG QB 3.820 . 3.820 2.537 2.334 2.831 . 0 0 "[ . 1 . 2]" 1
727 1 133 ARG HB3 1 133 ARG QD 3.330 . 3.330 2.827 2.276 3.342 0.012 20 0 "[ . 1 . 2]" 1
728 1 133 ARG HB3 1 134 SER HA 4.070 . 4.070 4.054 3.853 4.135 0.065 2 0 "[ . 1 . 2]" 1
729 1 133 ARG HB2 1 134 SER QB 4.410 . 4.410 4.163 3.849 4.491 0.081 19 0 "[ . 1 . 2]" 1
730 1 71 LYS HA 1 71 LYS QE 4.680 . 4.680 4.218 4.035 4.855 0.175 14 0 "[ . 1 . 2]" 1
731 1 70 TRP HB2 1 71 LYS HA 4.930 . 4.930 4.779 4.107 4.890 . 0 0 "[ . 1 . 2]" 1
732 1 133 ARG HA 1 133 ARG QG 3.450 . 3.450 2.460 2.310 2.563 . 0 0 "[ . 1 . 2]" 1
733 1 71 LYS HA 1 74 LYS HA 4.880 . 4.880 4.943 4.889 5.008 0.128 16 0 "[ . 1 . 2]" 1
734 1 87 LEU HB3 1 104 ARG QB 4.630 . 4.630 3.948 3.723 4.594 . 0 0 "[ . 1 . 2]" 1
735 1 104 ARG QG 1 105 ASP HA 4.860 . 4.860 3.643 3.255 4.105 . 0 0 "[ . 1 . 2]" 1
736 1 111 THR HA 1 111 THR HB 2.990 . 2.990 2.787 2.610 3.010 0.020 9 0 "[ . 1 . 2]" 1
737 1 109 LYS QD 1 111 THR HA 4.750 . 4.750 4.305 3.093 4.755 0.005 1 0 "[ . 1 . 2]" 1
738 1 108 VAL MG1 1 111 THR HB 5.300 . 5.300 3.971 2.390 4.816 . 0 0 "[ . 1 . 2]" 1
739 1 108 VAL MG2 1 111 THR HB 5.300 . 5.300 4.156 3.388 5.066 . 0 0 "[ . 1 . 2]" 1
740 1 108 VAL HA 1 111 THR HB 4.940 . 4.940 3.958 2.959 4.740 . 0 0 "[ . 1 . 2]" 1
741 1 111 THR HB 1 113 LEU H 4.890 . 4.890 4.583 4.033 4.920 0.030 1 0 "[ . 1 . 2]" 1
742 1 111 THR HA 1 111 THR MG 3.130 . 3.130 2.214 2.173 2.263 . 0 0 "[ . 1 . 2]" 1
743 1 111 THR HA 1 113 LEU H 4.850 . 4.850 4.293 4.129 4.457 . 0 0 "[ . 1 . 2]" 1
744 1 108 VAL HA 1 111 THR MG 4.080 . 4.080 4.049 3.870 4.135 0.055 13 0 "[ . 1 . 2]" 1
745 1 104 ARG HA 1 108 VAL HB 5.500 . 5.500 3.110 2.884 3.495 . 0 0 "[ . 1 . 2]" 1
746 1 103 PHE QB 1 108 VAL MG2 4.050 . 4.050 2.202 2.010 2.456 . 0 0 "[ . 1 . 2]" 1
747 1 108 VAL HA 1 108 VAL MG2 3.470 . 3.470 2.296 2.216 2.386 . 0 0 "[ . 1 . 2]" 1
748 1 103 PHE HA 1 108 VAL MG2 4.460 . 4.460 2.427 2.339 2.518 . 0 0 "[ . 1 . 2]" 1
749 1 103 PHE QB 1 108 VAL MG1 4.050 . 4.050 2.544 2.225 2.805 . 0 0 "[ . 1 . 2]" 1
750 1 108 VAL HA 1 108 VAL MG1 3.470 . 3.470 2.498 2.409 2.539 . 0 0 "[ . 1 . 2]" 1
751 1 78 VAL MG2 1 147 VAL HA 4.460 . 4.460 2.677 2.258 3.165 . 0 0 "[ . 1 . 2]" 1
752 1 103 PHE HA 1 108 VAL MG1 4.460 . 4.460 4.290 3.968 4.488 0.028 16 0 "[ . 1 . 2]" 1
753 1 116 ILE HB 1 116 ILE MD 3.620 . 3.620 2.296 2.238 2.334 . 0 0 "[ . 1 . 2]" 1
754 1 116 ILE MD 1 118 VAL HB 5.060 . 5.060 4.977 4.307 5.154 0.094 19 0 "[ . 1 . 2]" 1
755 1 116 ILE MD 1 144 LEU HA 3.880 . 3.880 2.725 2.308 3.052 . 0 0 "[ . 1 . 2]" 1
756 1 116 ILE HG12 1 144 LEU HA 4.890 . 4.890 4.742 4.436 4.914 0.024 18 0 "[ . 1 . 2]" 1
757 1 116 ILE MD 1 116 ILE MG 3.110 . 3.110 2.116 1.988 2.286 . 0 0 "[ . 1 . 2]" 1
758 1 116 ILE HG12 1 116 ILE MG 3.430 . 3.430 2.251 2.186 2.350 . 0 0 "[ . 1 . 2]" 1
759 1 116 ILE MG 1 139 LEU HA 4.340 . 4.340 4.154 3.832 4.339 . 0 0 "[ . 1 . 2]" 1
760 1 116 ILE HA 1 116 ILE MG 3.230 . 3.230 2.278 2.217 2.333 . 0 0 "[ . 1 . 2]" 1
761 1 116 ILE MG 1 117 ALA H 4.880 . 4.880 3.323 3.077 3.656 . 0 0 "[ . 1 . 2]" 1
762 1 116 ILE HA 1 116 ILE MD 4.130 . 4.130 4.156 4.110 4.173 0.043 15 0 "[ . 1 . 2]" 1
763 1 116 ILE MD 1 117 ALA HA 5.110 . 5.110 4.818 4.138 5.279 0.169 18 0 "[ . 1 . 2]" 1
764 1 25 ASP HA 1 33 GLU QG 3.980 . 3.980 4.211 4.119 4.263 0.283 5 0 "[ . 1 . 2]" 1
765 1 116 ILE MG 1 117 ALA MB 5.500 . 5.500 4.776 4.453 5.043 . 0 0 "[ . 1 . 2]" 1
766 1 116 ILE HG13 1 117 ALA MB 5.500 . 5.500 5.227 4.912 5.497 . 0 0 "[ . 1 . 2]" 1
767 1 104 ARG H 1 104 ARG QD 4.550 . 4.550 4.426 4.095 4.628 0.078 14 0 "[ . 1 . 2]" 1
768 1 87 LEU HG 1 104 ARG HA 4.080 . 4.080 3.424 2.762 3.836 . 0 0 "[ . 1 . 2]" 1
769 1 104 ARG HA 1 104 ARG QG 3.840 . 3.840 2.437 2.304 2.559 . 0 0 "[ . 1 . 2]" 1
770 1 83 LEU MD1 1 104 ARG HA 4.400 . 4.400 4.259 3.951 4.424 0.024 15 0 "[ . 1 . 2]" 1
771 1 133 ARG HB2 1 133 ARG QD 2.900 . 2.900 2.323 2.144 2.435 . 0 0 "[ . 1 . 2]" 1
772 1 133 ARG HA 1 133 ARG QD 3.960 . 3.960 3.412 2.391 4.011 0.051 3 0 "[ . 1 . 2]" 1
773 1 133 ARG QD 1 134 SER QB 5.500 . 5.500 5.432 5.128 5.603 0.103 4 0 "[ . 1 . 2]" 1
774 1 48 LYS QD 1 145 ASP HA 5.070 . 5.070 4.283 3.934 5.015 . 0 0 "[ . 1 . 2]" 1
775 1 125 ILE HB 1 126 SER QB 5.500 . 5.500 4.864 3.878 5.572 0.072 9 0 "[ . 1 . 2]" 1
776 1 122 SER HB3 1 123 PHE H 4.160 . 4.160 3.025 2.086 4.250 0.090 13 0 "[ . 1 . 2]" 1
777 1 122 SER HA 1 125 ILE QG 5.280 . 5.280 4.408 2.420 5.297 0.017 5 0 "[ . 1 . 2]" 1
778 1 78 VAL HA 1 146 VAL HB 5.140 . 5.140 4.324 3.970 4.634 . 0 0 "[ . 1 . 2]" 1
779 1 118 VAL HB 1 119 HIS QB 5.500 . 5.500 4.123 3.203 5.556 0.056 15 0 "[ . 1 . 2]" 1
780 1 146 VAL HB 1 150 GLY QA 4.620 . 4.620 4.488 3.866 4.690 0.070 7 0 "[ . 1 . 2]" 1
781 1 146 VAL MG2 1 150 GLY QA 4.940 . 4.940 4.944 4.816 5.010 0.070 19 0 "[ . 1 . 2]" 1
782 1 78 VAL HB 1 150 GLY QA 5.320 . 5.320 3.443 2.955 3.889 . 0 0 "[ . 1 . 2]" 1
783 1 149 PHE HA 1 149 PHE QD 3.820 . 3.820 2.789 2.528 3.135 . 0 0 "[ . 1 . 2]" 1
784 1 10 ASP HA 1 14 LEU HA 4.980 . 4.980 4.550 4.367 5.145 0.165 3 0 "[ . 1 . 2]" 1
785 1 148 LEU HA 1 149 PHE HA 5.500 . 5.500 4.531 4.429 4.600 . 0 0 "[ . 1 . 2]" 1
786 1 28 LYS QB 1 28 LYS HE3 4.180 . 4.180 3.082 2.312 3.280 . 0 0 "[ . 1 . 2]" 1
787 1 87 LEU MD1 1 104 ARG QD 5.500 . 5.500 4.408 2.364 5.314 . 0 0 "[ . 1 . 2]" 1
788 1 71 LYS QE 1 72 ARG QD 3.790 . 3.790 3.130 2.546 3.821 0.031 7 0 "[ . 1 . 2]" 1
789 1 147 VAL HA 1 147 VAL MG1 3.750 . 3.750 2.514 2.453 2.542 . 0 0 "[ . 1 . 2]" 1
790 1 147 VAL MG1 1 148 LEU H 4.110 . 4.110 3.026 2.910 3.144 . 0 0 "[ . 1 . 2]" 1
791 1 95 GLU H 1 96 LEU MD2 4.570 . 4.570 4.227 4.100 4.362 . 0 0 "[ . 1 . 2]" 1
792 1 114 PRO QB 1 147 VAL HB 5.500 . 5.500 5.176 4.922 5.522 0.022 18 0 "[ . 1 . 2]" 1
793 1 147 VAL HB 1 148 LEU HG 5.500 . 5.500 3.241 2.983 3.418 . 0 0 "[ . 1 . 2]" 1
794 1 96 LEU MD2 1 138 LYS QE 4.850 . 4.850 4.436 3.990 4.768 . 0 0 "[ . 1 . 2]" 1
795 1 139 LEU MD1 1 143 ALA HA 5.000 . 5.000 4.206 3.941 4.417 . 0 0 "[ . 1 . 2]" 1
796 1 139 LEU HA 1 143 ALA MB 4.170 . 4.170 3.510 3.238 3.691 . 0 0 "[ . 1 . 2]" 1
797 1 140 GLN HA 1 143 ALA MB 3.870 . 3.870 3.196 2.782 3.502 . 0 0 "[ . 1 . 2]" 1
798 1 113 LEU HA 1 143 ALA MB 3.730 . 3.730 2.001 1.849 2.255 . 0 0 "[ . 1 . 2]" 1
799 1 139 LEU MD1 1 143 ALA MB 3.760 . 3.760 2.877 2.410 3.258 . 0 0 "[ . 1 . 2]" 1
800 1 139 LEU QB 1 143 ALA MB 5.280 . 5.280 3.734 3.482 3.927 . 0 0 "[ . 1 . 2]" 1
801 1 139 LEU HG 1 143 ALA MB 5.500 . 5.500 2.695 2.354 3.016 . 0 0 "[ . 1 . 2]" 1
802 1 143 ALA MB 1 144 LEU QB 4.260 . 4.260 3.848 3.664 4.018 . 0 0 "[ . 1 . 2]" 1
803 1 143 ALA MB 1 147 VAL H 4.550 . 4.550 4.229 4.103 4.364 . 0 0 "[ . 1 . 2]" 1
804 1 143 ALA MB 1 145 ASP H 4.640 . 4.640 4.435 4.329 4.573 . 0 0 "[ . 1 . 2]" 1
805 1 139 LEU HG 1 143 ALA HA 5.500 . 5.500 5.069 4.649 5.510 0.010 15 0 "[ . 1 . 2]" 1
806 1 142 LYS HA 1 146 VAL H 4.870 . 4.870 4.106 3.867 4.459 . 0 0 "[ . 1 . 2]" 1
807 1 45 MET QB 1 145 ASP HA 4.530 . 4.530 4.534 4.307 4.644 0.114 18 0 "[ . 1 . 2]" 1
808 1 142 LYS HA 1 142 LYS QG 3.970 . 3.970 2.500 2.291 3.004 . 0 0 "[ . 1 . 2]" 1
809 1 94 VAL MG2 1 142 LYS QG 4.620 . 4.620 2.327 1.827 4.433 . 0 0 "[ . 1 . 2]" 1
810 1 142 LYS HA 1 142 LYS QD 4.450 . 4.450 2.093 1.793 2.597 . 0 0 "[ . 1 . 2]" 1
811 1 142 LYS HA 1 142 LYS QE 4.920 . 4.920 3.828 3.479 4.120 . 0 0 "[ . 1 . 2]" 1
812 1 7 THR HA 1 8 GLU QB 4.720 . 4.720 4.641 4.428 4.757 0.037 5 0 "[ . 1 . 2]" 1
813 1 19 THR MG 1 20 ILE HA 4.860 . 4.860 3.420 3.206 3.602 . 0 0 "[ . 1 . 2]" 1
814 1 7 THR HA 1 7 THR MG 2.620 . 2.620 2.347 2.269 2.469 . 0 0 "[ . 1 . 2]" 1
815 1 9 GLU HA 1 12 PHE QD 3.660 . 3.660 2.576 1.959 3.630 . 0 0 "[ . 1 . 2]" 1
816 1 9 GLU HA 1 12 PHE QB 4.000 . 4.000 2.854 2.310 3.172 . 0 0 "[ . 1 . 2]" 1
817 1 9 GLU HA 1 9 GLU QG 3.480 . 3.480 3.357 3.328 3.420 . 0 0 "[ . 1 . 2]" 1
818 1 138 LYS HA 1 138 LYS QD 4.430 . 4.430 4.319 4.103 4.461 0.031 19 0 "[ . 1 . 2]" 1
819 1 138 LYS HA 1 142 LYS QD 4.710 . 4.710 4.194 2.397 4.781 0.071 17 0 "[ . 1 . 2]" 1
820 1 7 THR MG 1 9 GLU HA 4.210 . 4.210 4.285 4.232 4.351 0.141 16 0 "[ . 1 . 2]" 1
821 1 94 VAL MG2 1 138 LYS HA 4.800 . 4.800 4.253 3.717 4.741 . 0 0 "[ . 1 . 2]" 1
822 1 90 LEU HG 1 94 VAL HB 4.830 . 4.830 2.881 2.356 4.374 . 0 0 "[ . 1 . 2]" 1
823 1 7 THR MG 1 9 GLU HB3 4.330 . 4.330 3.347 2.982 3.564 . 0 0 "[ . 1 . 2]" 1
824 1 9 GLU QG 1 10 ASP HA 4.440 . 4.440 3.580 3.190 4.517 0.077 17 0 "[ . 1 . 2]" 1
825 1 7 THR HA 1 9 GLU QG 4.850 . 4.850 4.543 4.361 4.775 . 0 0 "[ . 1 . 2]" 1
826 1 7 THR MG 1 9 GLU QG 3.910 . 3.910 1.916 1.832 2.037 . 0 0 "[ . 1 . 2]" 1
827 1 7 THR MG 1 9 GLU HB2 4.330 . 4.330 4.281 4.162 4.351 0.021 3 0 "[ . 1 . 2]" 1
828 1 7 THR MG 1 10 ASP HA 5.500 . 5.500 5.483 5.323 5.585 0.085 1 0 "[ . 1 . 2]" 1
829 1 12 PHE HA 1 12 PHE QD 3.530 . 3.530 2.577 2.170 3.108 . 0 0 "[ . 1 . 2]" 1
830 1 11 ARG HG3 1 12 PHE HA 4.800 . 4.800 4.828 4.655 4.892 0.092 20 0 "[ . 1 . 2]" 1
831 1 9 GLU QG 1 12 PHE QB 5.500 . 5.500 5.329 4.848 5.557 0.057 17 0 "[ . 1 . 2]" 1
832 1 52 ASN HA 1 55 SER QB 3.630 . 3.630 2.283 2.071 2.637 . 0 0 "[ . 1 . 2]" 1
833 1 52 ASN HA 1 56 HIS QB 5.020 . 5.020 4.617 4.160 5.045 0.025 13 0 "[ . 1 . 2]" 1
834 1 60 GLU HA 1 60 GLU QG 3.290 . 3.290 2.759 2.197 3.335 0.045 9 0 "[ . 1 . 2]" 1
835 1 51 THR MG 1 52 ASN QB 4.020 . 4.020 3.678 3.029 4.169 0.149 17 0 "[ . 1 . 2]" 1
836 1 51 THR HA 1 52 ASN QB 5.500 . 5.500 5.150 5.058 5.403 . 0 0 "[ . 1 . 2]" 1
837 1 50 ALA MB 1 52 ASN QB 5.150 . 5.150 5.225 5.132 5.348 0.198 17 0 "[ . 1 . 2]" 1
838 1 58 HIS HA 1 59 ARG HA 5.070 . 5.070 4.784 4.581 4.881 . 0 0 "[ . 1 . 2]" 1
839 1 58 HIS HA 1 64 ILE MD 4.500 . 4.500 3.977 3.228 4.524 0.024 4 0 "[ . 1 . 2]" 1
840 1 39 GLU HA 1 42 ARG HA 5.500 . 5.500 5.359 4.975 5.596 0.096 6 0 "[ . 1 . 2]" 1
841 1 42 ARG HA 1 42 ARG HD2 4.340 . 4.340 2.994 1.981 3.793 . 0 0 "[ . 1 . 2]" 1
842 1 59 ARG QB 1 59 ARG QD 2.760 . 2.760 2.352 2.154 2.676 . 0 0 "[ . 1 . 2]" 1
843 1 59 ARG QD 1 59 ARG QG 2.400 . 2.400 2.044 1.975 2.091 . 0 0 "[ . 1 . 2]" 1
844 1 66 ILE MD 1 69 LEU HG 3.980 . 3.980 3.994 3.917 4.025 0.045 17 0 "[ . 1 . 2]" 1
845 1 14 LEU HB3 1 15 GLU HA 4.350 . 4.350 4.177 3.736 4.336 . 0 0 "[ . 1 . 2]" 1
846 1 18 GLN HA 1 66 ILE HB 4.780 . 4.780 4.673 4.535 4.782 0.002 20 0 "[ . 1 . 2]" 1
847 1 85 ASP HA 1 87 LEU H 4.930 . 4.930 4.468 4.093 4.670 . 0 0 "[ . 1 . 2]" 1
848 1 57 LEU HA 1 57 LEU MD2 3.820 . 3.820 2.952 1.945 3.901 0.081 13 0 "[ . 1 . 2]" 1
849 1 94 VAL HA 1 94 VAL MG2 3.600 . 3.600 2.519 2.365 3.205 . 0 0 "[ . 1 . 2]" 1
850 1 57 LEU MD1 1 64 ILE MD 3.490 . 3.490 2.353 1.962 2.761 . 0 0 "[ . 1 . 2]" 1
851 1 57 LEU HA 1 57 LEU MD1 3.820 . 3.820 3.157 1.997 3.884 0.064 10 0 "[ . 1 . 2]" 1
852 1 57 LEU MD1 1 58 HIS H 4.380 . 4.380 4.376 4.175 4.444 0.064 2 0 "[ . 1 . 2]" 1
853 1 139 LEU HA 1 139 LEU MD2 3.690 . 3.690 3.640 3.590 3.699 0.009 4 0 "[ . 1 . 2]" 1
854 1 139 LEU HA 1 139 LEU MD1 3.530 . 3.530 1.858 1.804 1.902 . 0 0 "[ . 1 . 2]" 1
855 1 138 LYS HB2 1 139 LEU HA 5.340 . 5.340 4.452 4.092 4.698 . 0 0 "[ . 1 . 2]" 1
856 1 86 THR MG 1 139 LEU MD1 4.050 . 4.050 3.735 3.390 4.055 0.005 7 0 "[ . 1 . 2]" 1
857 1 90 LEU HB2 1 139 LEU MD1 4.270 . 4.270 3.822 3.571 3.996 . 0 0 "[ . 1 . 2]" 1
858 1 139 LEU H 1 139 LEU MD1 4.870 . 4.870 3.753 3.559 3.877 . 0 0 "[ . 1 . 2]" 1
859 1 90 LEU H 1 139 LEU MD1 5.500 . 5.500 5.510 5.225 5.597 0.097 16 0 "[ . 1 . 2]" 1
860 1 139 LEU MD1 1 144 LEU H 5.500 . 5.500 5.529 5.303 5.594 0.094 15 0 "[ . 1 . 2]" 1
861 1 113 LEU H 1 139 LEU MD2 4.510 . 4.510 4.488 4.266 4.590 0.080 1 0 "[ . 1 . 2]" 1
862 1 113 LEU H 1 139 LEU HG 4.750 . 4.750 4.822 4.771 4.871 0.121 11 0 "[ . 1 . 2]" 1
863 1 116 ILE HG12 1 139 LEU QB 5.500 . 5.500 5.566 5.504 5.609 0.109 10 0 "[ . 1 . 2]" 1
864 1 116 ILE HA 1 139 LEU QB 5.360 . 5.360 5.256 4.603 5.470 0.110 10 0 "[ . 1 . 2]" 1
865 1 138 LYS HA 1 139 LEU QB 5.270 . 5.270 5.124 5.019 5.191 . 0 0 "[ . 1 . 2]" 1
866 1 11 ARG HA 1 15 GLU HA 4.980 . 4.980 4.972 4.773 5.101 0.121 3 0 "[ . 1 . 2]" 1
867 1 90 LEU HA 1 139 LEU MD1 4.610 . 4.610 4.405 4.052 4.633 0.023 13 0 "[ . 1 . 2]" 1
868 1 112 THR HA 1 139 LEU MD2 5.500 . 5.500 5.014 4.805 5.444 . 0 0 "[ . 1 . 2]" 1
869 1 113 LEU HA 1 139 LEU MD2 5.500 . 5.500 4.233 3.839 4.531 . 0 0 "[ . 1 . 2]" 1
870 1 83 LEU QB 1 87 LEU HB2 5.500 . 5.500 4.796 4.456 5.019 . 0 0 "[ . 1 . 2]" 1
871 1 83 LEU QB 1 87 LEU HG 5.500 . 5.500 4.822 3.708 5.025 . 0 0 "[ . 1 . 2]" 1
872 1 83 LEU QB 1 104 ARG HA 4.500 . 4.500 2.944 2.773 3.177 . 0 0 "[ . 1 . 2]" 1
873 1 82 THR HA 1 83 LEU QB 5.190 . 5.190 4.601 4.415 4.712 . 0 0 "[ . 1 . 2]" 1
874 1 141 LEU HB2 1 142 LYS HA 5.500 . 5.500 4.590 4.305 5.521 0.021 10 0 "[ . 1 . 2]" 1
875 1 141 LEU HB2 1 142 LYS H 4.700 . 4.700 4.059 3.937 4.192 . 0 0 "[ . 1 . 2]" 1
876 1 141 LEU HB3 1 142 LYS HA 5.500 . 5.500 5.527 4.549 5.626 0.126 20 0 "[ . 1 . 2]" 1
877 1 141 LEU HB3 1 142 LYS H 4.700 . 4.700 4.086 2.625 4.322 . 0 0 "[ . 1 . 2]" 1
878 1 47 TYR QE 1 141 LEU HB3 5.500 . 5.500 4.687 3.945 5.506 0.006 10 0 "[ . 1 . 2]" 1
879 1 83 LEU QB 1 85 ASP H 5.500 . 5.500 5.074 4.945 5.285 . 0 0 "[ . 1 . 2]" 1
880 1 83 LEU QB 1 109 LYS H 5.500 . 5.500 4.476 4.221 4.972 . 0 0 "[ . 1 . 2]" 1
881 1 141 LEU HA 1 145 ASP H 4.810 . 4.810 3.874 3.749 4.084 . 0 0 "[ . 1 . 2]" 1
882 1 20 ILE MG 1 144 LEU MD1 4.150 . 4.150 1.908 1.758 2.080 . 0 0 "[ . 1 . 2]" 1
883 1 115 ARG H 1 116 ILE HG12 4.910 . 4.910 4.280 4.223 4.439 . 0 0 "[ . 1 . 2]" 1
884 1 116 ILE HG12 1 144 LEU H 4.590 . 4.590 4.516 4.320 4.646 0.056 11 0 "[ . 1 . 2]" 1
885 1 144 LEU QB 1 145 ASP HA 4.510 . 4.510 4.014 3.828 4.163 . 0 0 "[ . 1 . 2]" 1
886 1 84 GLU HA 1 87 LEU HB2 4.980 . 4.980 3.133 2.758 3.332 . 0 0 "[ . 1 . 2]" 1
887 1 24 MET HA 1 40 PHE QD 4.830 . 4.830 4.681 4.380 4.857 0.027 16 0 "[ . 1 . 2]" 1
888 1 24 MET HA 1 24 MET QG 3.940 . 3.940 2.358 2.285 2.394 . 0 0 "[ . 1 . 2]" 1
889 1 144 LEU HA 1 144 LEU MD1 4.800 . 4.800 2.078 1.943 2.159 . 0 0 "[ . 1 . 2]" 1
890 1 116 ILE HG12 1 117 ALA H 5.500 . 5.500 4.919 4.555 5.233 . 0 0 "[ . 1 . 2]" 1
891 1 129 LYS HA 1 129 LYS QE 4.750 . 4.750 3.655 1.898 4.691 . 0 0 "[ . 1 . 2]" 1
892 1 129 LYS HA 1 129 LYS HG3 3.830 . 3.830 2.837 2.484 4.079 0.249 13 0 "[ . 1 . 2]" 1
893 1 129 LYS HA 1 129 LYS HG2 3.830 . 3.830 3.412 2.914 3.828 . 0 0 "[ . 1 . 2]" 1
894 1 129 LYS HA 1 129 LYS QD 4.300 . 4.300 3.559 2.048 4.405 0.105 1 0 "[ . 1 . 2]" 1
895 1 71 LYS QD 1 71 LYS HG3 2.750 . 2.750 2.424 2.341 2.450 . 0 0 "[ . 1 . 2]" 1
896 1 71 LYS HB3 1 71 LYS QD 3.820 . 3.820 2.879 2.737 3.155 . 0 0 "[ . 1 . 2]" 1
897 1 71 LYS H 1 71 LYS QD 4.370 . 4.370 3.936 3.844 4.015 . 0 0 "[ . 1 . 2]" 1
898 1 129 LYS QE 1 129 LYS HG2 3.690 . 3.690 2.992 2.349 3.541 . 0 0 "[ . 1 . 2]" 1
899 1 46 LYS HD2 1 46 LYS QE 2.670 . 2.670 2.293 2.069 2.375 . 0 0 "[ . 1 . 2]" 1
900 1 129 LYS QE 1 129 LYS HG3 3.690 . 3.690 2.944 2.345 3.531 . 0 0 "[ . 1 . 2]" 1
901 1 48 LYS QB 1 48 LYS QE 3.420 . 3.420 2.223 1.835 3.036 . 0 0 "[ . 1 . 2]" 1
902 1 58 HIS HA 1 62 LYS QE 5.500 . 5.500 4.939 4.316 5.574 0.074 2 0 "[ . 1 . 2]" 1
903 1 99 TYR QE 1 138 LYS QE 5.500 . 5.500 5.418 4.967 5.607 0.107 2 0 "[ . 1 . 2]" 1
904 1 84 GLU HA 1 84 GLU HG3 3.930 . 3.930 3.778 3.706 3.843 . 0 0 "[ . 1 . 2]" 1
905 1 129 LYS QE 1 130 ILE MG 5.500 . 5.500 4.898 4.182 5.461 . 0 0 "[ . 1 . 2]" 1
906 1 129 LYS QD 1 130 ILE QG 4.770 . 4.770 3.640 2.473 4.799 0.029 9 0 "[ . 1 . 2]" 1
907 1 130 ILE MD 1 130 ILE MG 3.660 . 3.660 1.949 1.906 2.051 . 0 0 "[ . 1 . 2]" 1
908 1 130 ILE HA 1 130 ILE MD 4.310 . 4.310 4.080 2.102 4.246 . 0 0 "[ . 1 . 2]" 1
909 1 83 LEU HG 1 84 GLU HA 4.870 . 4.870 4.833 4.715 4.896 0.026 12 0 "[ . 1 . 2]" 1
910 1 122 SER HA 1 125 ILE MD 4.170 . 4.170 3.876 2.380 4.284 0.114 5 0 "[ . 1 . 2]" 1
911 1 87 LEU HB3 1 91 ILE MD 4.050 . 4.050 4.073 3.947 4.132 0.082 7 0 "[ . 1 . 2]" 1
912 1 125 ILE MD 1 125 ILE MG 2.400 . 2.400 1.918 1.794 1.969 . 0 0 "[ . 1 . 2]" 1
913 1 125 ILE QG 1 125 ILE MG 3.070 . 3.070 2.348 2.252 2.437 . 0 0 "[ . 1 . 2]" 1
914 1 108 VAL HA 1 109 LYS QD 4.830 . 4.830 4.050 3.568 4.583 . 0 0 "[ . 1 . 2]" 1
915 1 125 ILE HA 1 125 ILE MD 4.220 . 4.220 4.004 3.778 4.220 . 0 0 "[ . 1 . 2]" 1
916 1 125 ILE HA 1 125 ILE MG 3.440 . 3.440 2.380 2.215 2.563 . 0 0 "[ . 1 . 2]" 1
917 1 88 GLN HA 1 91 ILE MD 3.550 . 3.550 1.868 1.792 1.968 . 0 0 "[ . 1 . 2]" 1
918 1 125 ILE HA 1 125 ILE QG 4.010 . 4.010 2.851 2.290 3.341 . 0 0 "[ . 1 . 2]" 1
919 1 60 GLU QG 1 61 ASP HA 5.100 . 5.100 4.025 3.494 5.232 0.132 20 0 "[ . 1 . 2]" 1
920 1 38 ASP HA 1 39 GLU QB 5.320 . 5.320 5.183 5.088 5.272 . 0 0 "[ . 1 . 2]" 1
921 1 36 GLU HA 1 39 GLU QB 4.640 . 4.640 3.455 3.045 3.845 . 0 0 "[ . 1 . 2]" 1
922 1 39 GLU QB 1 39 GLU QG 2.400 . 2.400 2.049 1.986 2.090 . 0 0 "[ . 1 . 2]" 1
923 1 77 GLU HG3 1 78 VAL H 4.710 . 4.710 2.754 2.254 4.736 0.026 5 0 "[ . 1 . 2]" 1
924 1 39 GLU HA 1 39 GLU QG 3.120 . 3.120 2.637 2.372 3.027 . 0 0 "[ . 1 . 2]" 1
925 1 35 GLU HA 1 38 ASP QB 4.020 . 4.020 2.675 2.224 3.085 . 0 0 "[ . 1 . 2]" 1
926 1 87 LEU HA 1 100 GLU HB3 4.750 . 4.750 4.648 4.353 4.771 0.021 17 0 "[ . 1 . 2]" 1
927 1 87 LEU MD1 1 100 GLU HB3 5.500 . 5.500 2.749 2.558 3.573 . 0 0 "[ . 1 . 2]" 1
928 1 91 ILE MG 1 100 GLU HB3 4.760 . 4.760 2.560 2.317 2.736 . 0 0 "[ . 1 . 2]" 1
929 1 90 LEU MD1 1 100 GLU HB3 4.690 . 4.690 3.474 3.064 4.442 . 0 0 "[ . 1 . 2]" 1
930 1 90 LEU MD2 1 100 GLU HB3 4.690 . 4.690 2.041 1.862 2.237 . 0 0 "[ . 1 . 2]" 1
931 1 33 GLU QB 1 35 GLU HA 5.260 . 5.260 4.638 4.396 5.321 0.061 16 0 "[ . 1 . 2]" 1
932 1 28 LYS QB 1 29 ASP HB3 5.500 . 5.500 5.248 4.712 6.048 0.548 12 3 "[ - *1 + . 2]" 1
933 1 100 GLU HB3 1 103 PHE QB 5.500 . 5.500 5.185 4.924 5.400 . 0 0 "[ . 1 . 2]" 1
934 1 33 GLU HA 1 35 GLU QG 5.500 . 5.500 5.297 4.395 5.592 0.092 16 0 "[ . 1 . 2]" 1
935 1 33 GLU HA 1 36 GLU QG 5.500 . 5.500 4.604 4.474 4.833 . 0 0 "[ . 1 . 2]" 1
936 1 18 GLN HA 1 66 ILE HG13 4.460 . 4.460 4.379 4.254 4.473 0.013 18 0 "[ . 1 . 2]" 1
937 1 32 ILE MG 1 36 GLU QG 4.920 . 4.920 4.456 4.053 4.947 0.027 9 0 "[ . 1 . 2]" 1
938 1 8 GLU QB 1 10 ASP H 5.110 . 5.110 4.700 4.546 4.895 . 0 0 "[ . 1 . 2]" 1
939 1 59 ARG HA 1 59 ARG QG 3.540 . 3.540 3.483 3.391 3.573 0.033 12 0 "[ . 1 . 2]" 1
940 1 8 GLU QB 1 11 ARG HB3 4.050 . 4.050 3.633 3.384 3.855 . 0 0 "[ . 1 . 2]" 1
941 1 8 GLU QB 1 9 GLU HA 4.130 . 4.130 3.951 3.799 4.136 0.006 6 0 "[ . 1 . 2]" 1
942 1 34 VAL HA 1 35 GLU QG 5.500 . 5.500 5.057 4.770 5.315 . 0 0 "[ . 1 . 2]" 1
943 1 32 ILE MG 1 36 GLU HA 5.500 . 5.500 4.869 4.315 5.516 0.016 9 0 "[ . 1 . 2]" 1
944 1 36 GLU QB 1 39 GLU H 5.260 . 5.260 5.068 4.910 5.265 0.005 7 0 "[ . 1 . 2]" 1
945 1 34 VAL HA 1 36 GLU QB 5.440 . 5.440 4.989 4.563 5.257 . 0 0 "[ . 1 . 2]" 1
946 1 24 MET QB 1 36 GLU QB 4.740 . 4.740 3.306 2.861 4.049 . 0 0 "[ . 1 . 2]" 1
947 1 39 GLU QG 1 40 PHE QD 5.070 . 5.070 4.849 4.343 5.101 0.031 7 0 "[ . 1 . 2]" 1
948 1 65 THR HB 1 67 GLU HG3 4.820 . 4.820 2.865 2.654 3.031 . 0 0 "[ . 1 . 2]" 1
949 1 38 ASP HA 1 41 ILE HB 3.820 . 3.820 2.945 2.579 3.317 . 0 0 "[ . 1 . 2]" 1
950 1 141 LEU HA 1 144 LEU QB 4.100 . 4.100 2.373 2.141 2.605 . 0 0 "[ . 1 . 2]" 1
951 1 91 ILE QG 1 92 GLU HA 3.910 . 3.910 3.121 2.997 3.209 . 0 0 "[ . 1 . 2]" 1
952 1 35 GLU QB 1 38 ASP QB 4.570 . 4.570 4.126 3.614 4.506 . 0 0 "[ . 1 . 2]" 1
953 1 55 SER QB 1 56 HIS HA 4.300 . 4.300 4.029 3.874 4.247 . 0 0 "[ . 1 . 2]" 1
954 1 56 HIS HA 1 59 ARG QB 4.130 . 4.130 3.086 2.897 3.317 . 0 0 "[ . 1 . 2]" 1
955 1 56 HIS HA 1 59 ARG QG 4.160 . 4.160 3.436 2.315 4.155 . 0 0 "[ . 1 . 2]" 1
956 1 55 SER QB 1 56 HIS QB 4.570 . 4.570 3.982 3.699 4.304 . 0 0 "[ . 1 . 2]" 1
957 1 56 HIS QB 1 59 ARG QG 5.500 . 5.500 4.856 3.669 5.515 0.015 2 0 "[ . 1 . 2]" 1
958 1 62 LYS QD 1 63 HIS QB 5.500 . 5.500 5.346 4.926 5.564 0.064 9 0 "[ . 1 . 2]" 1
959 1 55 SER H 1 56 HIS QB 5.040 . 5.040 4.585 4.270 5.016 . 0 0 "[ . 1 . 2]" 1
960 1 55 SER QB 1 58 HIS H 5.500 . 5.500 5.402 5.134 5.538 0.038 16 0 "[ . 1 . 2]" 1
961 1 18 GLN HA 1 66 ILE HG12 4.460 . 4.460 3.874 3.620 4.041 . 0 0 "[ . 1 . 2]" 1
962 1 34 VAL HB 1 62 LYS QB 4.720 . 4.720 2.397 2.073 2.963 . 0 0 "[ . 1 . 2]" 1
963 1 33 GLU HA 1 34 VAL HB 5.500 . 5.500 4.306 4.201 4.392 . 0 0 "[ . 1 . 2]" 1
964 1 54 HIS QB 1 58 HIS HA 5.500 . 5.500 5.223 4.915 5.478 . 0 0 "[ . 1 . 2]" 1
965 1 54 HIS QB 1 58 HIS H 4.650 . 4.650 3.725 3.503 3.989 . 0 0 "[ . 1 . 2]" 1
966 1 34 VAL HB 1 62 LYS QD 4.100 . 4.100 2.282 1.896 2.583 . 0 0 "[ . 1 . 2]" 1
967 1 54 HIS QB 1 59 ARG H 5.500 . 5.500 5.620 5.560 5.738 0.238 2 0 "[ . 1 . 2]" 1
968 1 44 ASP HA 1 45 MET HA 4.740 . 4.740 4.439 4.239 4.545 . 0 0 "[ . 1 . 2]" 1
969 1 45 MET ME 1 145 ASP HB2 3.680 . 3.680 2.537 2.331 2.812 . 0 0 "[ . 1 . 2]" 1
970 1 45 MET ME 1 145 ASP HB3 3.680 . 3.680 3.701 3.500 3.834 0.154 14 0 "[ . 1 . 2]" 1
971 1 41 ILE HA 1 45 MET ME 4.620 . 4.620 4.656 4.468 4.733 0.113 6 0 "[ . 1 . 2]" 1
972 1 45 MET ME 1 144 LEU HA 4.600 . 4.600 4.106 3.933 4.354 . 0 0 "[ . 1 . 2]" 1
973 1 45 MET HA 1 45 MET ME 3.260 . 3.260 1.887 1.776 2.448 . 0 0 "[ . 1 . 2]" 1
974 1 45 MET ME 1 145 ASP HA 3.230 . 3.230 2.178 1.943 2.442 . 0 0 "[ . 1 . 2]" 1
975 1 45 MET ME 1 144 LEU H 4.640 . 4.640 4.382 4.056 4.643 0.003 15 0 "[ . 1 . 2]" 1
976 1 45 MET ME 1 144 LEU MD1 3.400 . 3.400 3.469 3.419 3.522 0.122 14 0 "[ . 1 . 2]" 1
977 1 45 MET ME 1 144 LEU MD2 3.400 . 3.400 2.208 2.007 2.734 . 0 0 "[ . 1 . 2]" 1
978 1 45 MET ME 1 144 LEU HG 3.440 . 3.440 2.102 2.005 2.192 . 0 0 "[ . 1 . 2]" 1
979 1 135 HIS HA 1 138 LYS HG2 4.570 . 4.570 2.084 1.893 2.370 . 0 0 "[ . 1 . 2]" 1
980 1 32 ILE HG13 1 63 HIS HA 5.500 . 5.500 5.377 5.092 5.565 0.065 15 0 "[ . 1 . 2]" 1
981 1 63 HIS HA 1 64 ILE MG 5.500 . 5.500 5.422 5.356 5.509 0.009 13 0 "[ . 1 . 2]" 1
982 1 96 LEU MD1 1 135 HIS HA 5.140 . 5.140 5.042 4.706 5.252 0.112 17 0 "[ . 1 . 2]" 1
983 1 89 TRP HA 1 93 PHE QB 4.450 . 4.450 4.068 3.769 4.433 . 0 0 "[ . 1 . 2]" 1
984 1 88 GLN QB 1 89 TRP HA 4.850 . 4.850 4.539 4.414 4.638 . 0 0 "[ . 1 . 2]" 1
985 1 89 TRP HA 1 89 TRP HD1 4.050 . 4.050 3.778 3.278 4.079 0.029 11 0 "[ . 1 . 2]" 1
986 1 89 TRP HA 1 93 PHE QD 4.200 . 4.200 2.412 2.065 2.720 . 0 0 "[ . 1 . 2]" 1
987 1 88 GLN QB 1 89 TRP QB 5.380 . 5.380 4.826 4.737 4.926 . 0 0 "[ . 1 . 2]" 1
988 1 89 TRP QB 1 90 LEU HB2 5.500 . 5.500 4.441 4.325 4.647 . 0 0 "[ . 1 . 2]" 1
989 1 86 THR MG 1 89 TRP QB 5.100 . 5.100 3.784 3.484 4.147 . 0 0 "[ . 1 . 2]" 1
990 1 7 THR HA 1 8 GLU HA 4.830 . 4.830 4.291 4.203 4.427 . 0 0 "[ . 1 . 2]" 1
991 1 8 GLU HA 1 11 ARG HB2 3.650 . 3.650 2.975 2.550 3.331 . 0 0 "[ . 1 . 2]" 1
992 1 7 THR H 1 8 GLU HA 4.970 . 4.970 4.978 4.585 5.166 0.196 7 0 "[ . 1 . 2]" 1
993 1 87 LEU H 1 88 GLN QB 5.110 . 5.110 4.810 4.651 5.006 . 0 0 "[ . 1 . 2]" 1
994 1 88 GLN QB 1 90 LEU H 5.500 . 5.500 5.121 5.026 5.258 . 0 0 "[ . 1 . 2]" 1
995 1 78 VAL HB 1 79 HIS HB2 5.060 . 5.060 5.237 5.190 5.265 0.205 7 0 "[ . 1 . 2]" 1
996 1 88 GLN HG3 1 89 TRP HA 4.950 . 4.950 3.526 3.298 3.780 . 0 0 "[ . 1 . 2]" 1
997 1 88 GLN H 1 88 GLN HG3 4.170 . 4.170 3.540 3.322 3.765 . 0 0 "[ . 1 . 2]" 1
998 1 88 GLN HG2 1 89 TRP HA 4.950 . 4.950 4.749 4.423 4.997 0.047 9 0 "[ . 1 . 2]" 1
999 1 91 ILE HA 1 97 PRO HA 4.720 . 4.720 4.441 4.201 4.608 . 0 0 "[ . 1 . 2]" 1
1000 1 97 PRO HA 1 100 GLU HB3 4.500 . 4.500 2.699 2.338 2.942 . 0 0 "[ . 1 . 2]" 1
1001 1 91 ILE HB 1 97 PRO HA 4.200 . 4.200 3.562 3.129 3.841 . 0 0 "[ . 1 . 2]" 1
1002 1 91 ILE MG 1 97 PRO HA 3.410 . 3.410 1.919 1.760 2.013 . 0 0 "[ . 1 . 2]" 1
1003 1 97 PRO HD2 1 98 GLN HA 5.500 . 5.500 5.244 4.966 5.420 . 0 0 "[ . 1 . 2]" 1
1004 1 96 LEU MD2 1 97 PRO HD3 4.450 . 4.450 4.419 4.266 4.478 0.028 18 0 "[ . 1 . 2]" 1
1005 1 96 LEU MD2 1 97 PRO HD2 5.000 . 5.000 4.135 4.037 4.219 . 0 0 "[ . 1 . 2]" 1
1006 1 91 ILE MG 1 97 PRO HD2 4.710 . 4.710 4.408 4.208 4.580 . 0 0 "[ . 1 . 2]" 1
1007 1 91 ILE HB 1 97 PRO HB2 4.370 . 4.370 4.313 4.078 4.407 0.037 15 0 "[ . 1 . 2]" 1
1008 1 91 ILE MG 1 97 PRO HB2 3.900 . 3.900 3.345 3.249 3.417 . 0 0 "[ . 1 . 2]" 1
1009 1 97 PRO HB2 1 98 GLN HA 4.450 . 4.450 4.243 4.092 4.374 . 0 0 "[ . 1 . 2]" 1
1010 1 91 ILE HB 1 97 PRO HB3 4.870 . 4.870 2.569 2.322 2.700 . 0 0 "[ . 1 . 2]" 1
1011 1 91 ILE HA 1 97 PRO HB3 5.500 . 5.500 4.507 4.281 4.668 . 0 0 "[ . 1 . 2]" 1
1012 1 57 LEU MD1 1 64 ILE MG 3.950 . 3.950 3.838 3.633 4.037 0.087 1 0 "[ . 1 . 2]" 1
1013 1 138 LYS HG2 1 139 LEU MD2 4.400 . 4.400 4.421 4.168 4.543 0.143 11 0 "[ . 1 . 2]" 1
1014 1 139 LEU MD2 1 143 ALA MB 4.830 . 4.830 4.002 3.702 4.264 . 0 0 "[ . 1 . 2]" 1
1015 1 134 SER QB 1 135 HIS QB 5.500 . 5.500 4.583 4.205 5.173 . 0 0 "[ . 1 . 2]" 1
1016 1 32 ILE HA 1 33 GLU QG 4.610 . 4.610 3.460 3.039 3.631 . 0 0 "[ . 1 . 2]" 1
1017 1 32 ILE HA 1 36 GLU QB 5.210 . 5.210 3.140 2.811 3.570 . 0 0 "[ . 1 . 2]" 1
1018 1 32 ILE HA 1 33 GLU HA 4.430 . 4.430 4.421 4.336 4.446 0.016 3 0 "[ . 1 . 2]" 1
1019 1 22 LYS HA 1 22 LYS HG3 3.580 . 3.580 3.370 3.192 3.490 . 0 0 "[ . 1 . 2]" 1
1020 1 22 LYS HA 1 24 MET H 4.980 . 4.980 4.394 4.273 4.715 . 0 0 "[ . 1 . 2]" 1
1021 1 111 THR HA 1 113 LEU QB 4.920 . 4.920 4.936 4.808 5.022 0.102 15 0 "[ . 1 . 2]" 1
1022 1 134 SER HA 1 137 GLN HB2 5.430 . 5.430 5.045 4.767 5.316 . 0 0 "[ . 1 . 2]" 1
1023 1 31 GLY QA 1 63 HIS HA 4.730 . 4.730 3.394 3.032 3.875 . 0 0 "[ . 1 . 2]" 1
1024 1 135 HIS QB 1 138 LYS HG2 4.850 . 4.850 3.890 3.500 3.991 . 0 0 "[ . 1 . 2]" 1
1025 1 134 SER HA 1 135 HIS QB 5.500 . 5.500 5.494 5.365 5.540 0.040 2 0 "[ . 1 . 2]" 1
1026 1 135 HIS HA 1 135 HIS HD2 4.130 . 4.130 2.865 2.392 4.236 0.106 9 0 "[ . 1 . 2]" 1
1027 1 96 LEU HG 1 134 SER QB 5.400 . 5.400 4.332 3.583 5.124 . 0 0 "[ . 1 . 2]" 1
1028 1 134 SER HA 1 135 HIS HA 4.890 . 4.890 4.756 4.523 4.854 . 0 0 "[ . 1 . 2]" 1
1029 1 137 GLN HA 1 137 GLN HG3 3.900 . 3.900 3.768 3.733 3.799 . 0 0 "[ . 1 . 2]" 1
1030 1 137 GLN HA 1 141 LEU HG 5.500 . 5.500 4.523 3.749 5.516 0.016 10 0 "[ . 1 . 2]" 1
1031 1 20 ILE MG 1 23 GLN HB2 4.760 . 4.760 3.838 3.643 4.133 . 0 0 "[ . 1 . 2]" 1
1032 1 23 GLN HB2 1 40 PHE QD 4.340 . 4.340 3.493 3.013 4.020 . 0 0 "[ . 1 . 2]" 1
1033 1 133 ARG HB3 1 137 GLN HG2 4.890 . 4.890 4.335 3.682 4.910 0.020 20 0 "[ . 1 . 2]" 1
1034 1 134 SER HA 1 137 GLN HG2 4.460 . 4.460 2.174 1.928 2.400 . 0 0 "[ . 1 . 2]" 1
1035 1 137 GLN HA 1 137 GLN HG2 3.980 . 3.980 3.768 3.690 3.823 . 0 0 "[ . 1 . 2]" 1
1036 1 137 GLN HG3 1 138 LYS HG2 5.170 . 5.170 4.629 4.334 5.020 . 0 0 "[ . 1 . 2]" 1
1037 1 137 GLN HG3 1 138 LYS HB3 3.550 . 3.550 3.321 2.886 3.562 0.012 19 0 "[ . 1 . 2]" 1
1038 1 134 SER HA 1 137 GLN HG3 3.630 . 3.630 3.198 2.884 3.483 . 0 0 "[ . 1 . 2]" 1
1039 1 137 GLN HG3 1 138 LYS HA 3.530 . 3.530 3.396 3.274 3.545 0.015 19 0 "[ . 1 . 2]" 1
1040 1 87 LEU H 1 87 LEU HG 4.310 . 4.310 4.027 2.574 4.171 . 0 0 "[ . 1 . 2]" 1
1041 1 57 LEU HG 1 64 ILE MD 4.140 . 4.140 3.280 1.951 4.153 0.013 15 0 "[ . 1 . 2]" 1
1042 1 82 THR MG 1 85 ASP HA 4.390 . 4.390 4.113 3.778 4.430 0.040 1 0 "[ . 1 . 2]" 1
1043 1 64 ILE HB 1 69 LEU MD1 3.860 . 3.860 3.647 3.487 3.868 0.008 15 0 "[ . 1 . 2]" 1
1044 1 69 LEU HA 1 69 LEU MD1 3.020 . 3.020 2.121 2.080 2.147 . 0 0 "[ . 1 . 2]" 1
1045 1 64 ILE HA 1 69 LEU MD1 5.110 . 5.110 5.119 5.022 5.147 0.037 11 0 "[ . 1 . 2]" 1
1046 1 21 HIS HD2 1 69 LEU MD1 4.070 . 4.070 3.880 3.790 3.987 . 0 0 "[ . 1 . 2]" 1
1047 1 64 ILE MD 1 69 LEU MD1 3.240 . 3.240 3.013 2.805 3.193 . 0 0 "[ . 1 . 2]" 1
1048 1 20 ILE MD 1 69 LEU HG 4.240 . 4.240 3.471 3.164 3.760 . 0 0 "[ . 1 . 2]" 1
1049 1 64 ILE MG 1 69 LEU HB2 4.770 . 4.770 4.408 4.321 4.514 . 0 0 "[ . 1 . 2]" 1
1050 1 64 ILE MG 1 69 LEU MD1 3.650 . 3.650 1.998 1.928 2.046 . 0 0 "[ . 1 . 2]" 1
1051 1 87 LEU HG 1 104 ARG QG 5.220 . 5.220 3.406 2.505 4.351 . 0 0 "[ . 1 . 2]" 1
1052 1 87 LEU HG 1 88 GLN H 5.170 . 5.170 5.199 4.528 5.257 0.087 17 0 "[ . 1 . 2]" 1
1053 1 20 ILE MG 1 144 LEU HG 4.560 . 4.560 3.836 3.061 4.276 . 0 0 "[ . 1 . 2]" 1
1054 1 141 LEU HA 1 141 LEU HG 3.660 . 3.660 3.699 3.071 3.769 0.109 14 0 "[ . 1 . 2]" 1
1055 1 141 LEU HG 1 142 LYS QE 5.500 . 5.500 5.278 3.219 5.648 0.148 9 0 "[ . 1 . 2]" 1
1056 1 114 PRO HA 1 147 VAL H 5.500 . 5.500 5.556 5.483 5.635 0.135 18 0 "[ . 1 . 2]" 1
1057 1 20 ILE MG 1 144 LEU HA 4.410 . 4.410 3.850 3.560 4.355 . 0 0 "[ . 1 . 2]" 1
1058 1 103 PHE QD 1 124 MET HA 4.750 . 4.750 4.664 3.779 4.898 0.148 19 0 "[ . 1 . 2]" 1
1059 1 144 LEU HA 1 147 VAL H 4.580 . 4.580 3.840 3.415 4.040 . 0 0 "[ . 1 . 2]" 1
1060 1 144 LEU HA 1 144 LEU MD2 4.800 . 4.800 3.871 3.775 3.923 . 0 0 "[ . 1 . 2]" 1
1061 1 112 THR MG 1 124 MET ME 4.760 . 4.760 3.893 2.830 4.762 0.002 19 0 "[ . 1 . 2]" 1
1062 1 103 PHE QD 1 124 MET ME 4.650 . 4.650 4.255 2.563 4.816 0.166 7 0 "[ . 1 . 2]" 1
1063 1 91 ILE MD 1 92 GLU HG2 3.750 . 3.750 3.125 2.323 3.783 0.033 19 0 "[ . 1 . 2]" 1
1064 1 91 ILE QG 1 92 GLU HG2 4.630 . 4.630 3.300 2.844 3.826 . 0 0 "[ . 1 . 2]" 1
1065 1 92 GLU HA 1 92 GLU HG2 3.680 . 3.680 2.535 2.215 2.946 . 0 0 "[ . 1 . 2]" 1
1066 1 92 GLU H 1 92 GLU HG2 4.030 . 4.030 3.248 2.539 3.800 . 0 0 "[ . 1 . 2]" 1
1067 1 119 HIS HA 1 119 HIS QB 2.630 . 2.630 2.348 2.170 2.465 . 0 0 "[ . 1 . 2]" 1
1068 1 118 VAL MG2 1 119 HIS HA 5.500 . 5.500 5.134 3.421 5.537 0.037 12 0 "[ . 1 . 2]" 1
1069 1 118 VAL MG1 1 119 HIS HA 5.500 . 5.500 4.160 3.328 5.534 0.034 18 0 "[ . 1 . 2]" 1
1070 1 123 PHE H 1 125 ILE QG 4.820 . 4.820 4.031 2.474 4.842 0.022 15 0 "[ . 1 . 2]" 1
1071 1 45 MET QB 1 45 MET ME 3.310 . 3.310 2.767 2.111 3.188 . 0 0 "[ . 1 . 2]" 1
1072 1 139 LEU QB 1 142 LYS QB 4.740 . 4.740 4.729 4.407 4.903 0.163 14 0 "[ . 1 . 2]" 1
1073 1 8 GLU QB 1 8 GLU HG2 2.620 . 2.620 2.322 2.170 2.363 . 0 0 "[ . 1 . 2]" 1
1074 1 91 ILE MG 1 95 GLU HA 5.120 . 5.120 4.293 4.164 4.484 . 0 0 "[ . 1 . 2]" 1
1075 1 114 PRO HA 1 147 VAL MG1 4.090 . 4.090 3.283 2.931 3.511 . 0 0 "[ . 1 . 2]" 1
1076 1 83 LEU HA 1 87 LEU MD2 5.400 . 5.400 2.968 2.630 4.670 . 0 0 "[ . 1 . 2]" 1
1077 1 143 ALA H 1 146 VAL MG1 4.650 . 4.650 4.733 4.677 4.792 0.142 16 0 "[ . 1 . 2]" 1
1078 1 87 LEU HB3 1 88 GLN QB 4.820 . 4.820 4.857 4.833 4.883 0.063 13 0 "[ . 1 . 2]" 1
1079 1 88 GLN QB 1 91 ILE MD 4.150 . 4.150 2.888 2.679 3.061 . 0 0 "[ . 1 . 2]" 1
1080 1 137 GLN HA 1 140 GLN QB 3.990 . 3.990 2.907 2.343 4.016 0.026 10 0 "[ . 1 . 2]" 1
1081 1 140 GLN QB 1 144 LEU H 5.500 . 5.500 5.131 4.744 5.337 . 0 0 "[ . 1 . 2]" 1
1082 1 117 ALA HA 1 140 GLN QG 5.500 . 5.500 5.342 4.995 5.535 0.035 17 0 "[ . 1 . 2]" 1
1083 1 118 VAL HA 1 140 GLN QG 4.240 . 4.240 2.866 2.207 3.948 . 0 0 "[ . 1 . 2]" 1
1084 1 118 VAL HA 1 140 GLN QB 4.930 . 4.930 4.419 3.845 4.992 0.062 18 0 "[ . 1 . 2]" 1
1085 1 140 GLN QB 1 141 LEU HA 5.280 . 5.280 4.020 3.553 4.472 . 0 0 "[ . 1 . 2]" 1
1086 1 89 TRP HA 1 92 GLU H 4.900 . 4.900 3.588 3.510 3.687 . 0 0 "[ . 1 . 2]" 1
1087 1 134 SER QB 1 138 LYS QD 4.400 . 4.400 4.337 3.973 4.534 0.134 15 0 "[ . 1 . 2]" 1
1088 1 28 LYS HA 1 28 LYS HE3 5.500 . 5.500 5.378 4.620 5.655 0.155 12 0 "[ . 1 . 2]" 1
1089 1 117 ALA MB 1 123 PHE H 4.570 . 4.570 3.950 3.118 4.649 0.079 18 0 "[ . 1 . 2]" 1
1090 1 70 TRP HA 1 70 TRP HE1 4.960 . 4.960 4.729 4.606 4.977 0.017 20 0 "[ . 1 . 2]" 1
1091 1 68 ASP H 1 70 TRP H 4.590 . 4.590 4.066 3.946 4.255 . 0 0 "[ . 1 . 2]" 1
1092 1 67 GLU HA 1 70 TRP H 3.950 . 3.950 3.402 3.227 3.523 . 0 0 "[ . 1 . 2]" 1
1093 1 66 ILE HA 1 70 TRP H 5.170 . 5.170 5.077 4.847 5.212 0.042 19 0 "[ . 1 . 2]" 1
1094 1 70 TRP H 1 70 TRP HB3 3.740 . 3.740 3.483 3.426 3.627 . 0 0 "[ . 1 . 2]" 1
1095 1 70 TRP H 1 70 TRP HB2 3.370 . 3.370 2.164 2.077 2.701 . 0 0 "[ . 1 . 2]" 1
1096 1 69 LEU HB2 1 70 TRP H 3.820 . 3.820 2.509 2.434 2.582 . 0 0 "[ . 1 . 2]" 1
1097 1 69 LEU HB3 1 70 TRP H 4.080 . 4.080 3.456 3.374 3.519 . 0 0 "[ . 1 . 2]" 1
1098 1 69 LEU MD2 1 70 TRP H 3.740 . 3.740 3.765 3.722 3.790 0.050 12 0 "[ . 1 . 2]" 1
1099 1 20 ILE HG13 1 73 TRP HE1 5.270 . 5.270 4.345 4.147 4.584 . 0 0 "[ . 1 . 2]" 1
1100 1 20 ILE HG12 1 73 TRP HE1 5.270 . 5.270 5.179 4.986 5.303 0.033 3 0 "[ . 1 . 2]" 1
1101 1 72 ARG H 1 73 TRP H 3.730 . 3.730 2.819 2.751 2.882 . 0 0 "[ . 1 . 2]" 1
1102 1 70 TRP HA 1 73 TRP H 4.230 . 4.230 3.892 3.709 4.050 . 0 0 "[ . 1 . 2]" 1
1103 1 73 TRP H 1 73 TRP QB 3.300 . 3.300 2.706 2.643 2.755 . 0 0 "[ . 1 . 2]" 1
1104 1 72 ARG QB 1 73 TRP H 3.360 . 3.360 2.332 2.193 2.548 . 0 0 "[ . 1 . 2]" 1
1105 1 72 ARG QG 1 73 TRP H 4.420 . 4.420 4.115 3.942 4.359 . 0 0 "[ . 1 . 2]" 1
1106 1 81 TRP H 1 82 THR H 4.630 . 4.630 4.554 4.487 4.642 0.012 15 0 "[ . 1 . 2]" 1
1107 1 81 TRP H 1 81 TRP HE1 5.050 . 5.050 4.886 4.721 5.001 . 0 0 "[ . 1 . 2]" 1
1108 1 78 VAL H 1 81 TRP H 4.940 . 4.940 4.962 4.900 5.000 0.060 4 0 "[ . 1 . 2]" 1
1109 1 80 ASN H 1 81 TRP H 3.150 . 3.150 2.073 1.843 2.190 . 0 0 "[ . 1 . 2]" 1
1110 1 81 TRP H 1 81 TRP HD1 3.890 . 3.890 3.234 3.009 3.466 . 0 0 "[ . 1 . 2]" 1
1111 1 81 TRP H 1 110 GLY HA3 3.760 . 3.760 3.526 3.147 3.773 0.013 14 0 "[ . 1 . 2]" 1
1112 1 77 GLU HA 1 81 TRP H 4.520 . 4.520 4.428 4.295 4.540 0.020 8 0 "[ . 1 . 2]" 1
1113 1 81 TRP H 1 110 GLY HA2 4.680 . 4.680 4.620 4.166 4.759 0.079 13 0 "[ . 1 . 2]" 1
1114 1 81 TRP H 1 81 TRP QB 3.360 . 3.360 2.477 2.355 2.566 . 0 0 "[ . 1 . 2]" 1
1115 1 77 GLU QB 1 81 TRP H 4.600 . 4.600 4.595 4.473 4.653 0.053 13 0 "[ . 1 . 2]" 1
1116 1 78 VAL HA 1 81 TRP H 3.710 . 3.710 3.715 3.613 3.763 0.053 5 0 "[ . 1 . 2]" 1
1117 1 77 GLU HA 1 81 TRP HE1 4.630 . 4.630 4.507 4.207 4.648 0.018 8 0 "[ . 1 . 2]" 1
1118 1 81 TRP QB 1 81 TRP HE1 4.810 . 4.810 4.580 4.531 4.603 . 0 0 "[ . 1 . 2]" 1
1119 1 77 GLU QB 1 81 TRP HE1 3.590 . 3.590 2.352 2.009 2.555 . 0 0 "[ . 1 . 2]" 1
1120 1 78 VAL HA 1 81 TRP HE1 3.720 . 3.720 3.770 3.642 3.825 0.105 13 0 "[ . 1 . 2]" 1
1121 1 85 ASP HA 1 89 TRP H 4.240 . 4.240 4.049 3.885 4.146 . 0 0 "[ . 1 . 2]" 1
1122 1 89 TRP H 1 89 TRP QB 3.220 . 3.220 2.218 2.113 2.284 . 0 0 "[ . 1 . 2]" 1
1123 1 88 GLN QB 1 89 TRP H 3.510 . 3.510 3.521 3.465 3.570 0.060 11 0 "[ . 1 . 2]" 1
1124 1 85 ASP QB 1 89 TRP H 5.410 . 5.410 4.958 4.575 5.332 . 0 0 "[ . 1 . 2]" 1
1125 1 86 THR MG 1 89 TRP H 5.120 . 5.120 4.825 4.709 4.949 . 0 0 "[ . 1 . 2]" 1
1126 1 89 TRP H 1 90 LEU HB3 4.610 . 4.610 4.640 4.611 4.675 0.065 11 0 "[ . 1 . 2]" 1
1127 1 89 TRP H 1 91 ILE MD 4.290 . 4.290 4.180 4.135 4.217 . 0 0 "[ . 1 . 2]" 1
1128 1 88 GLN H 1 89 TRP H 3.170 . 3.170 2.647 2.583 2.705 . 0 0 "[ . 1 . 2]" 1
1129 1 89 TRP H 1 91 ILE H 4.640 . 4.640 4.479 4.392 4.588 . 0 0 "[ . 1 . 2]" 1
1130 1 89 TRP H 1 90 LEU H 3.300 . 3.300 2.616 2.534 2.718 . 0 0 "[ . 1 . 2]" 1
1131 1 89 TRP HA 1 89 TRP HE1 5.500 . 5.500 5.366 5.243 5.474 . 0 0 "[ . 1 . 2]" 1
1132 1 89 TRP QB 1 89 TRP HE1 4.750 . 4.750 4.452 4.413 4.492 . 0 0 "[ . 1 . 2]" 1
1133 1 89 TRP HE1 1 146 VAL MG2 5.270 . 5.270 4.204 3.644 4.679 . 0 0 "[ . 1 . 2]" 1
1134 1 47 TYR H 1 47 TYR QD 3.870 . 3.870 2.782 1.745 3.211 . 0 0 "[ . 1 . 2]" 1
1135 1 107 ASN H 1 108 VAL HB 4.980 . 4.980 4.283 4.139 4.456 . 0 0 "[ . 1 . 2]" 1
1136 1 46 LYS QG 1 47 TYR H 3.930 . 3.930 3.807 3.585 4.003 0.073 16 0 "[ . 1 . 2]" 1
1137 1 47 TYR H 1 47 TYR HB3 3.960 . 3.960 3.683 3.282 3.751 . 0 0 "[ . 1 . 2]" 1
1138 1 97 PRO HA 1 99 TYR H 4.030 . 4.030 3.582 3.465 3.728 . 0 0 "[ . 1 . 2]" 1
1139 1 99 TYR H 1 99 TYR HB3 3.940 . 3.940 3.808 3.746 3.859 . 0 0 "[ . 1 . 2]" 1
1140 1 97 PRO HD2 1 99 TYR H 5.380 . 5.380 5.121 4.983 5.314 . 0 0 "[ . 1 . 2]" 1
1141 1 99 TYR H 1 99 TYR HB2 3.940 . 3.940 2.702 2.606 2.793 . 0 0 "[ . 1 . 2]" 1
1142 1 99 TYR H 1 101 LYS QD 4.200 . 4.200 4.118 3.894 4.295 0.095 16 0 "[ . 1 . 2]" 1
1143 1 91 ILE MG 1 99 TYR H 4.680 . 4.680 4.579 4.235 4.718 0.038 18 0 "[ . 1 . 2]" 1
1144 1 90 LEU MD1 1 99 TYR H 4.700 . 4.700 4.499 4.340 4.750 0.050 17 0 "[ . 1 . 2]" 1
1145 1 90 LEU MD2 1 99 TYR H 4.700 . 4.700 3.652 3.522 3.837 . 0 0 "[ . 1 . 2]" 1
1146 1 99 TYR H 1 100 GLU H 3.250 . 3.250 2.046 1.938 2.212 . 0 0 "[ . 1 . 2]" 1
1147 1 99 TYR H 1 102 ASN H 5.500 . 5.500 5.314 5.055 5.505 0.005 13 0 "[ . 1 . 2]" 1
1148 1 47 TYR H 1 48 LYS H 4.490 . 4.490 2.920 2.800 3.046 . 0 0 "[ . 1 . 2]" 1
1149 1 105 ASP H 1 107 ASN H 4.100 . 4.100 3.830 3.765 3.941 . 0 0 "[ . 1 . 2]" 1
1150 1 106 ASN H 1 107 ASN H 3.060 . 3.060 2.382 2.230 2.508 . 0 0 "[ . 1 . 2]" 1
1151 1 107 ASN H 1 107 ASN HA 2.790 . 2.790 2.174 2.129 2.244 . 0 0 "[ . 1 . 2]" 1
1152 1 47 TYR H 1 47 TYR HB2 3.960 . 3.960 2.633 2.068 2.914 . 0 0 "[ . 1 . 2]" 1
1153 1 46 LYS HB2 1 47 TYR H 4.170 . 4.170 3.850 3.707 4.181 0.011 16 0 "[ . 1 . 2]" 1
1154 1 107 ASN H 1 107 ASN HD21 4.580 . 4.580 4.405 3.880 4.613 0.033 15 0 "[ . 1 . 2]" 1
1155 1 99 TYR HA 1 102 ASN H 3.820 . 3.820 3.354 3.183 3.599 . 0 0 "[ . 1 . 2]" 1
1156 1 100 GLU HA 1 102 ASN H 4.250 . 4.250 4.045 3.925 4.180 . 0 0 "[ . 1 . 2]" 1
1157 1 101 LYS HB2 1 102 ASN H 4.250 . 4.250 4.049 3.953 4.113 . 0 0 "[ . 1 . 2]" 1
1158 1 101 LYS QG 1 102 ASN H 3.640 . 3.640 2.666 2.537 2.781 . 0 0 "[ . 1 . 2]" 1
1159 1 77 GLU HA 1 80 ASN H 3.680 . 3.680 3.398 3.234 3.673 . 0 0 "[ . 1 . 2]" 1
1160 1 80 ASN H 1 80 ASN HB3 3.830 . 3.830 3.093 2.377 3.704 . 0 0 "[ . 1 . 2]" 1
1161 1 80 ASN H 1 80 ASN HB2 3.830 . 3.830 2.687 2.410 3.018 . 0 0 "[ . 1 . 2]" 1
1162 1 77 GLU QB 1 80 ASN H 4.930 . 4.930 4.443 4.301 4.563 . 0 0 "[ . 1 . 2]" 1
1163 1 79 HIS HB2 1 80 ASN H 5.250 . 5.250 4.074 3.893 4.255 . 0 0 "[ . 1 . 2]" 1
1164 1 78 VAL HA 1 80 ASN H 4.660 . 4.660 3.846 3.603 4.017 . 0 0 "[ . 1 . 2]" 1
1165 1 79 HIS HB3 1 80 ASN H 3.910 . 3.910 3.334 3.106 3.729 . 0 0 "[ . 1 . 2]" 1
1166 1 80 ASN HB3 1 80 ASN HD22 3.950 . 3.950 3.651 3.444 4.016 0.066 4 0 "[ . 1 . 2]" 1
1167 1 80 ASN HB2 1 80 ASN HD22 3.950 . 3.950 3.688 3.453 3.986 0.036 20 0 "[ . 1 . 2]" 1
1168 1 107 ASN HA 1 107 ASN HD22 4.270 . 4.270 3.649 3.312 3.797 . 0 0 "[ . 1 . 2]" 1
1169 1 107 ASN HA 1 107 ASN HD21 4.360 . 4.360 2.446 1.766 2.787 . 0 0 "[ . 1 . 2]" 1
1170 1 83 LEU MD1 1 107 ASN HD21 4.710 . 4.710 4.485 4.257 4.713 0.003 10 0 "[ . 1 . 2]" 1
1171 1 83 LEU MD1 1 107 ASN HD22 4.700 . 4.700 4.754 4.709 4.781 0.081 20 0 "[ . 1 . 2]" 1
1172 1 17 LEU H 1 18 GLN H 3.410 . 3.410 2.552 2.468 2.655 . 0 0 "[ . 1 . 2]" 1
1173 1 18 GLN H 1 20 ILE H 4.860 . 4.860 4.307 4.166 4.414 . 0 0 "[ . 1 . 2]" 1
1174 1 18 GLN H 1 19 THR H 3.410 . 3.410 2.517 2.444 2.592 . 0 0 "[ . 1 . 2]" 1
1175 1 16 ALA H 1 18 GLN H 4.500 . 4.500 3.972 3.867 4.034 . 0 0 "[ . 1 . 2]" 1
1176 1 15 GLU HA 1 18 GLN H 3.620 . 3.620 3.294 2.918 3.630 0.010 3 0 "[ . 1 . 2]" 1
1177 1 18 GLN H 1 18 GLN HB3 3.670 . 3.670 2.497 2.353 2.680 . 0 0 "[ . 1 . 2]" 1
1178 1 18 GLN H 1 18 GLN HB2 3.670 . 3.670 2.435 2.192 2.576 . 0 0 "[ . 1 . 2]" 1
1179 1 17 LEU HG 1 18 GLN H 5.150 . 5.150 4.370 4.252 4.427 . 0 0 "[ . 1 . 2]" 1
1180 1 86 THR H 1 88 GLN H 4.530 . 4.530 4.206 4.127 4.302 . 0 0 "[ . 1 . 2]" 1
1181 1 88 GLN H 1 88 GLN HG2 4.170 . 4.170 2.409 2.105 2.627 . 0 0 "[ . 1 . 2]" 1
1182 1 15 GLU H 1 15 GLU QB 3.020 . 3.020 2.325 2.182 2.377 . 0 0 "[ . 1 . 2]" 1
1183 1 88 GLN H 1 88 GLN QB 3.300 . 3.300 2.531 2.441 2.661 . 0 0 "[ . 1 . 2]" 1
1184 1 85 ASP QB 1 88 GLN H 5.350 . 5.350 5.040 4.851 5.143 . 0 0 "[ . 1 . 2]" 1
1185 1 14 LEU HB2 1 15 GLU H 4.450 . 4.450 3.788 3.392 3.912 . 0 0 "[ . 1 . 2]" 1
1186 1 87 LEU MD2 1 88 GLN H 4.980 . 4.980 4.253 4.175 4.583 . 0 0 "[ . 1 . 2]" 1
1187 1 98 GLN H 1 100 GLU H 4.580 . 4.580 3.822 3.655 4.029 . 0 0 "[ . 1 . 2]" 1
1188 1 98 GLN H 1 99 TYR H 3.420 . 3.420 2.277 2.195 2.401 . 0 0 "[ . 1 . 2]" 1
1189 1 98 GLN H 1 99 TYR QE 4.900 . 4.900 4.899 4.689 4.974 0.074 15 0 "[ . 1 . 2]" 1
1190 1 96 LEU HA 1 98 GLN H 4.610 . 4.610 3.256 3.112 3.366 . 0 0 "[ . 1 . 2]" 1
1191 1 97 PRO HD3 1 98 GLN H 4.180 . 4.180 4.024 3.875 4.096 . 0 0 "[ . 1 . 2]" 1
1192 1 97 PRO HD2 1 98 GLN H 3.990 . 3.990 3.003 2.748 3.179 . 0 0 "[ . 1 . 2]" 1
1193 1 97 PRO HB2 1 98 GLN H 4.000 . 4.000 3.959 3.779 4.026 0.026 16 0 "[ . 1 . 2]" 1
1194 1 97 PRO HG2 1 98 GLN H 3.430 . 3.430 3.297 3.030 3.435 0.005 17 0 "[ . 1 . 2]" 1
1195 1 91 ILE MG 1 98 GLN H 4.460 . 4.460 4.368 4.170 4.466 0.006 12 0 "[ . 1 . 2]" 1
1196 1 90 LEU MD1 1 98 GLN H 5.500 . 5.500 5.594 5.526 5.666 0.166 10 0 "[ . 1 . 2]" 1
1197 1 96 LEU MD2 1 98 GLN H 5.460 . 5.460 5.112 4.940 5.242 . 0 0 "[ . 1 . 2]" 1
1198 1 90 LEU MD2 1 98 GLN H 5.500 . 5.500 4.209 4.023 4.987 . 0 0 "[ . 1 . 2]" 1
1199 1 23 GLN H 1 24 MET H 3.460 . 3.460 2.690 2.566 2.824 . 0 0 "[ . 1 . 2]" 1
1200 1 20 ILE HA 1 23 GLN H 3.800 . 3.800 3.071 2.868 3.251 . 0 0 "[ . 1 . 2]" 1
1201 1 23 GLN H 1 23 GLN HG3 4.020 . 4.020 3.730 2.539 3.921 . 0 0 "[ . 1 . 2]" 1
1202 1 23 GLN H 1 23 GLN HB3 3.650 . 3.650 3.624 3.552 3.651 0.001 20 0 "[ . 1 . 2]" 1
1203 1 23 GLN H 1 23 GLN HB2 3.040 . 3.040 2.506 2.316 2.591 . 0 0 "[ . 1 . 2]" 1
1204 1 22 LYS HB3 1 23 GLN H 3.430 . 3.430 2.929 2.663 3.162 . 0 0 "[ . 1 . 2]" 1
1205 1 22 LYS HG3 1 23 GLN H 3.750 . 3.750 3.386 3.198 3.592 . 0 0 "[ . 1 . 2]" 1
1206 1 23 GLN H 1 24 MET QB 5.320 . 5.320 4.751 4.631 4.877 . 0 0 "[ . 1 . 2]" 1
1207 1 133 ARG HA 1 137 GLN H 4.580 . 4.580 3.955 3.599 4.350 . 0 0 "[ . 1 . 2]" 1
1208 1 137 GLN H 1 137 GLN HG2 3.610 . 3.610 2.204 2.032 2.332 . 0 0 "[ . 1 . 2]" 1
1209 1 137 GLN H 1 137 GLN HB3 3.250 . 3.250 2.652 2.546 2.731 . 0 0 "[ . 1 . 2]" 1
1210 1 133 ARG HB3 1 137 GLN H 5.420 . 5.420 4.867 4.202 5.422 0.002 9 0 "[ . 1 . 2]" 1
1211 1 137 GLN H 1 138 LYS HG2 4.770 . 4.770 4.575 4.446 4.721 . 0 0 "[ . 1 . 2]" 1
1212 1 137 GLN H 1 137 GLN HB2 3.810 . 3.810 3.652 3.620 3.689 . 0 0 "[ . 1 . 2]" 1
1213 1 15 GLU HA 1 18 GLN HE22 3.730 . 3.730 3.278 2.915 3.681 . 0 0 "[ . 1 . 2]" 1
1214 1 14 LEU HG 1 18 GLN HE22 4.500 . 4.500 3.728 2.504 4.548 0.048 20 0 "[ . 1 . 2]" 1
1215 1 14 LEU HG 1 18 GLN HE21 4.490 . 4.490 3.323 2.054 4.564 0.074 3 0 "[ . 1 . 2]" 1
1216 1 18 GLN HB2 1 18 GLN HE21 3.890 . 3.890 2.177 1.669 2.702 . 0 0 "[ . 1 . 2]" 1
1217 1 18 GLN HB3 1 18 GLN HE21 3.890 . 3.890 2.130 1.681 2.692 . 0 0 "[ . 1 . 2]" 1
1218 1 15 GLU HA 1 18 GLN HE21 3.880 . 3.880 2.351 1.965 2.897 . 0 0 "[ . 1 . 2]" 1
1219 1 137 GLN HE22 1 137 GLN HG3 3.910 . 3.910 3.582 3.462 3.785 . 0 0 "[ . 1 . 2]" 1
1220 1 137 GLN HB3 1 137 GLN HE22 4.480 . 4.480 4.167 3.770 4.424 . 0 0 "[ . 1 . 2]" 1
1221 1 137 GLN HB3 1 137 GLN HE21 4.480 . 4.480 3.469 2.644 3.933 . 0 0 "[ . 1 . 2]" 1
1222 1 7 THR HB 1 10 ASP H 4.220 . 4.220 2.448 1.918 2.767 . 0 0 "[ . 1 . 2]" 1
1223 1 10 ASP H 1 10 ASP HB2 3.720 . 3.720 2.652 2.476 3.714 . 0 0 "[ . 1 . 2]" 1
1224 1 9 GLU QG 1 10 ASP H 4.050 . 4.050 2.481 2.202 2.737 . 0 0 "[ . 1 . 2]" 1
1225 1 10 ASP H 1 11 ARG HB3 4.640 . 4.640 4.513 4.241 4.657 0.017 1 0 "[ . 1 . 2]" 1
1226 1 7 THR MG 1 10 ASP H 3.970 . 3.970 3.247 2.992 3.400 . 0 0 "[ . 1 . 2]" 1
1227 1 10 ASP H 1 10 ASP HB3 3.720 . 3.720 3.639 2.927 3.717 . 0 0 "[ . 1 . 2]" 1
1228 1 84 GLU H 1 85 ASP H 3.470 . 3.470 2.486 2.371 2.611 . 0 0 "[ . 1 . 2]" 1
1229 1 8 GLU HA 1 11 ARG H 3.870 . 3.870 3.022 2.786 3.224 . 0 0 "[ . 1 . 2]" 1
1230 1 84 GLU HG3 1 85 ASP H 3.970 . 3.970 2.420 2.261 2.637 . 0 0 "[ . 1 . 2]" 1
1231 1 11 ARG H 1 11 ARG HB3 3.350 . 3.350 2.472 2.358 2.572 . 0 0 "[ . 1 . 2]" 1
1232 1 85 ASP H 1 85 ASP QB 3.540 . 3.540 2.354 2.106 2.649 . 0 0 "[ . 1 . 2]" 1
1233 1 11 ARG H 1 11 ARG HG2 4.480 . 4.480 4.405 4.342 4.465 . 0 0 "[ . 1 . 2]" 1
1234 1 11 ARG H 1 11 ARG HG3 4.710 . 4.710 4.456 4.410 4.504 . 0 0 "[ . 1 . 2]" 1
1235 1 82 THR HA 1 85 ASP H 4.730 . 4.730 4.703 4.561 4.771 0.041 19 0 "[ . 1 . 2]" 1
1236 1 11 ARG H 1 11 ARG HB2 3.550 . 3.550 2.557 2.451 2.700 . 0 0 "[ . 1 . 2]" 1
1237 1 12 PHE H 1 12 PHE QD 3.610 . 3.610 3.018 2.655 3.837 0.227 18 0 "[ . 1 . 2]" 1
1238 1 12 PHE H 1 13 SER H 3.330 . 3.330 2.578 2.488 2.625 . 0 0 "[ . 1 . 2]" 1
1239 1 12 PHE H 1 14 LEU H 4.030 . 4.030 4.095 3.883 4.143 0.113 20 0 "[ . 1 . 2]" 1
1240 1 10 ASP HA 1 12 PHE H 4.130 . 4.130 4.107 3.917 4.256 0.126 3 0 "[ . 1 . 2]" 1
1241 1 9 GLU HA 1 12 PHE H 3.970 . 3.970 3.202 2.784 3.504 . 0 0 "[ . 1 . 2]" 1
1242 1 12 PHE H 1 12 PHE QB 3.110 . 3.110 2.405 1.897 2.507 . 0 0 "[ . 1 . 2]" 1
1243 1 12 PHE H 1 15 GLU QB 4.450 . 4.450 4.515 4.390 4.629 0.179 3 0 "[ . 1 . 2]" 1
1244 1 11 ARG HB3 1 12 PHE H 3.170 . 3.170 2.728 2.549 2.965 . 0 0 "[ . 1 . 2]" 1
1245 1 11 ARG HG2 1 12 PHE H 4.150 . 4.150 3.735 3.520 3.950 . 0 0 "[ . 1 . 2]" 1
1246 1 11 ARG HG3 1 12 PHE H 4.790 . 4.790 4.629 4.524 4.694 . 0 0 "[ . 1 . 2]" 1
1247 1 13 SER H 1 14 LEU H 3.390 . 3.390 2.518 2.304 2.641 . 0 0 "[ . 1 . 2]" 1
1248 1 10 ASP HA 1 13 SER H 3.930 . 3.930 3.361 3.057 3.638 . 0 0 "[ . 1 . 2]" 1
1249 1 13 SER H 1 13 SER HB3 3.850 . 3.850 3.440 2.577 3.624 . 0 0 "[ . 1 . 2]" 1
1250 1 13 SER H 1 13 SER HB2 3.850 . 3.850 2.529 2.436 2.670 . 0 0 "[ . 1 . 2]" 1
1251 1 12 PHE QB 1 13 SER H 3.410 . 3.410 2.468 2.128 2.552 . 0 0 "[ . 1 . 2]" 1
1252 1 13 SER H 1 14 LEU HB3 4.890 . 4.890 4.801 4.578 4.933 0.043 20 0 "[ . 1 . 2]" 1
1253 1 14 LEU H 1 15 GLU H 3.500 . 3.500 2.473 2.374 2.625 . 0 0 "[ . 1 . 2]" 1
1254 1 10 ASP HA 1 14 LEU H 4.360 . 4.360 2.411 2.132 3.366 . 0 0 "[ . 1 . 2]" 1
1255 1 14 LEU H 1 15 GLU QB 4.920 . 4.920 4.379 4.286 4.513 . 0 0 "[ . 1 . 2]" 1
1256 1 14 LEU H 1 14 LEU HB2 3.320 . 3.320 2.648 2.239 2.763 . 0 0 "[ . 1 . 2]" 1
1257 1 14 LEU H 1 14 LEU HG 4.860 . 4.860 4.473 4.384 4.561 . 0 0 "[ . 1 . 2]" 1
1258 1 14 LEU H 1 14 LEU HB3 3.510 . 3.510 2.515 2.431 2.736 . 0 0 "[ . 1 . 2]" 1
1259 1 15 GLU H 1 17 LEU H 4.440 . 4.440 4.320 4.209 4.445 0.005 3 0 "[ . 1 . 2]" 1
1260 1 12 PHE HA 1 15 GLU H 5.170 . 5.170 4.637 3.892 4.884 . 0 0 "[ . 1 . 2]" 1
1261 1 12 PHE QB 1 15 GLU H 5.500 . 5.500 5.402 5.102 5.512 0.012 8 0 "[ . 1 . 2]" 1
1262 1 87 LEU HB3 1 88 GLN H 3.410 . 3.410 3.447 3.425 3.480 0.070 12 0 "[ . 1 . 2]" 1
1263 1 14 LEU HG 1 15 GLU H 4.640 . 4.640 3.769 3.538 4.647 0.007 20 0 "[ . 1 . 2]" 1
1264 1 14 LEU HB3 1 15 GLU H 3.840 . 3.840 2.497 2.212 2.622 . 0 0 "[ . 1 . 2]" 1
1265 1 15 GLU H 1 16 ALA H 3.030 . 3.030 2.785 2.680 2.900 . 0 0 "[ . 1 . 2]" 1
1266 1 16 ALA H 1 17 LEU H 3.360 . 3.360 2.774 2.651 2.920 . 0 0 "[ . 1 . 2]" 1
1267 1 12 PHE HA 1 16 ALA H 4.280 . 4.280 4.027 3.861 4.168 . 0 0 "[ . 1 . 2]" 1
1268 1 15 GLU QB 1 16 ALA H 3.010 . 3.010 2.715 2.580 2.885 . 0 0 "[ . 1 . 2]" 1
1269 1 14 LEU HB3 1 16 ALA H 5.100 . 5.100 5.084 4.852 5.145 0.045 18 0 "[ . 1 . 2]" 1
1270 1 16 ALA H 1 16 ALA MB 2.900 . 2.900 2.232 2.174 2.268 . 0 0 "[ . 1 . 2]" 1
1271 1 9 GLU H 1 10 ASP H 3.710 . 3.710 2.659 2.559 2.875 . 0 0 "[ . 1 . 2]" 1
1272 1 7 THR HB 1 9 GLU H 3.660 . 3.660 3.162 2.852 3.511 . 0 0 "[ . 1 . 2]" 1
1273 1 9 GLU H 1 9 GLU QG 3.180 . 3.180 2.242 2.036 2.457 . 0 0 "[ . 1 . 2]" 1
1274 1 9 GLU H 1 9 GLU HB3 3.710 . 3.710 2.620 2.470 2.739 . 0 0 "[ . 1 . 2]" 1
1275 1 8 GLU QB 1 9 GLU H 3.400 . 3.400 2.847 2.617 3.103 . 0 0 "[ . 1 . 2]" 1
1276 1 9 GLU H 1 9 GLU HB2 3.710 . 3.710 3.645 3.601 3.688 . 0 0 "[ . 1 . 2]" 1
1277 1 17 LEU H 1 17 LEU HB3 3.690 . 3.690 3.629 3.610 3.659 . 0 0 "[ . 1 . 2]" 1
1278 1 17 LEU H 1 17 LEU HG 3.890 . 3.890 2.312 2.205 2.408 . 0 0 "[ . 1 . 2]" 1
1279 1 17 LEU H 1 17 LEU HB2 3.690 . 3.690 2.583 2.561 2.620 . 0 0 "[ . 1 . 2]" 1
1280 1 19 THR H 1 20 ILE H 3.650 . 3.650 2.794 2.696 2.893 . 0 0 "[ . 1 . 2]" 1
1281 1 19 THR H 1 19 THR HB 3.520 . 3.520 2.558 2.468 2.677 . 0 0 "[ . 1 . 2]" 1
1282 1 72 ARG H 1 72 ARG QG 3.550 . 3.550 2.698 2.447 3.109 . 0 0 "[ . 1 . 2]" 1
1283 1 19 THR H 1 19 THR MG 3.900 . 3.900 3.771 3.751 3.796 . 0 0 "[ . 1 . 2]" 1
1284 1 19 THR H 1 66 ILE MD 4.580 . 4.580 4.608 4.534 4.636 0.056 2 0 "[ . 1 . 2]" 1
1285 1 19 THR H 1 20 ILE MD 5.500 . 5.500 5.191 5.116 5.285 . 0 0 "[ . 1 . 2]" 1
1286 1 70 TRP HB2 1 72 ARG H 4.780 . 4.780 4.840 4.778 4.873 0.093 9 0 "[ . 1 . 2]" 1
1287 1 19 THR HB 1 20 ILE H 3.940 . 3.940 2.467 2.329 2.708 . 0 0 "[ . 1 . 2]" 1
1288 1 17 LEU HA 1 20 ILE H 3.770 . 3.770 3.398 3.280 3.489 . 0 0 "[ . 1 . 2]" 1
1289 1 20 ILE H 1 20 ILE HB 3.800 . 3.800 3.641 3.616 3.657 . 0 0 "[ . 1 . 2]" 1
1290 1 19 THR MG 1 20 ILE H 4.080 . 4.080 3.334 3.122 3.622 . 0 0 "[ . 1 . 2]" 1
1291 1 20 ILE H 1 20 ILE MG 3.310 . 3.310 2.439 2.262 2.584 . 0 0 "[ . 1 . 2]" 1
1292 1 20 ILE H 1 21 HIS H 3.770 . 3.770 2.647 2.542 2.728 . 0 0 "[ . 1 . 2]" 1
1293 1 19 THR HB 1 21 HIS H 5.060 . 5.060 4.911 4.802 5.060 0.000 8 0 "[ . 1 . 2]" 1
1294 1 21 HIS H 1 21 HIS HB3 3.470 . 3.470 2.377 2.315 2.445 . 0 0 "[ . 1 . 2]" 1
1295 1 21 HIS H 1 21 HIS HB2 3.470 . 3.470 2.628 2.578 2.678 . 0 0 "[ . 1 . 2]" 1
1296 1 20 ILE HB 1 21 HIS H 4.080 . 4.080 3.652 3.520 3.793 . 0 0 "[ . 1 . 2]" 1
1297 1 144 LEU H 1 144 LEU MD1 4.520 . 4.520 3.923 3.733 4.059 . 0 0 "[ . 1 . 2]" 1
1298 1 21 HIS H 1 66 ILE MD 4.200 . 4.200 3.910 3.770 4.081 . 0 0 "[ . 1 . 2]" 1
1299 1 20 ILE MG 1 21 HIS H 4.100 . 4.100 4.048 3.947 4.101 0.001 20 0 "[ . 1 . 2]" 1
1300 1 18 GLN HA 1 22 LYS H 5.190 . 5.190 3.818 3.626 3.949 . 0 0 "[ . 1 . 2]" 1
1301 1 19 THR HA 1 22 LYS H 5.400 . 5.400 3.464 3.230 3.620 . 0 0 "[ . 1 . 2]" 1
1302 1 22 LYS H 1 22 LYS HB2 4.020 . 4.020 2.733 2.449 2.900 . 0 0 "[ . 1 . 2]" 1
1303 1 21 HIS HA 1 24 MET H 3.960 . 3.960 3.362 3.122 3.477 . 0 0 "[ . 1 . 2]" 1
1304 1 23 GLN HB2 1 24 MET H 3.770 . 3.770 2.737 2.493 3.004 . 0 0 "[ . 1 . 2]" 1
1305 1 24 MET H 1 24 MET QG 3.520 . 3.520 2.253 2.212 2.351 . 0 0 "[ . 1 . 2]" 1
1306 1 24 MET H 1 24 MET QB 3.210 . 3.210 2.398 2.376 2.427 . 0 0 "[ . 1 . 2]" 1
1307 1 24 MET H 1 32 ILE MG 4.700 . 4.700 4.569 4.498 4.679 . 0 0 "[ . 1 . 2]" 1
1308 1 24 MET H 1 32 ILE MD 4.110 . 4.110 4.040 3.895 4.122 0.012 4 0 "[ . 1 . 2]" 1
1309 1 24 MET H 1 25 ASP H 3.400 . 3.400 2.581 2.434 2.680 . 0 0 "[ . 1 . 2]" 1
1310 1 22 LYS HA 1 25 ASP H 3.600 . 3.600 3.633 3.559 3.682 0.082 17 0 "[ . 1 . 2]" 1
1311 1 21 HIS HA 1 25 ASP H 4.460 . 4.460 3.406 3.158 3.567 . 0 0 "[ . 1 . 2]" 1
1312 1 25 ASP H 1 25 ASP HB2 3.190 . 3.190 2.593 2.495 2.857 . 0 0 "[ . 1 . 2]" 1
1313 1 24 MET QG 1 25 ASP H 4.680 . 4.680 3.881 3.790 4.090 . 0 0 "[ . 1 . 2]" 1
1314 1 25 ASP H 1 25 ASP HB3 3.270 . 3.270 2.655 2.545 2.752 . 0 0 "[ . 1 . 2]" 1
1315 1 24 MET QB 1 25 ASP H 3.500 . 3.500 2.266 2.120 2.840 . 0 0 "[ . 1 . 2]" 1
1316 1 25 ASP H 1 32 ILE MG 3.970 . 3.970 3.610 3.429 3.994 0.024 13 0 "[ . 1 . 2]" 1
1317 1 25 ASP H 1 32 ILE MD 3.910 . 3.910 3.454 3.271 3.772 . 0 0 "[ . 1 . 2]" 1
1318 1 25 ASP H 1 32 ILE HG12 4.530 . 4.530 2.652 2.517 2.974 . 0 0 "[ . 1 . 2]" 1
1319 1 26 ASP H 1 27 ASP H 3.530 . 3.530 2.401 2.284 2.613 . 0 0 "[ . 1 . 2]" 1
1320 1 25 ASP HA 1 26 ASP H 3.100 . 3.100 2.165 2.099 2.228 . 0 0 "[ . 1 . 2]" 1
1321 1 26 ASP H 1 26 ASP HB2 3.670 . 3.670 2.689 2.598 2.839 . 0 0 "[ . 1 . 2]" 1
1322 1 25 ASP HB3 1 26 ASP H 3.990 . 3.990 4.075 4.038 4.105 0.115 5 0 "[ . 1 . 2]" 1
1323 1 27 ASP H 1 28 LYS H 2.880 . 2.880 2.304 2.173 2.433 . 0 0 "[ . 1 . 2]" 1
1324 1 25 ASP HB2 1 26 ASP H 4.780 . 4.780 4.564 4.479 4.633 . 0 0 "[ . 1 . 2]" 1
1325 1 26 ASP H 1 33 GLU QG 5.350 . 5.350 5.176 4.767 5.395 0.045 1 0 "[ . 1 . 2]" 1
1326 1 26 ASP H 1 36 GLU QB 5.480 . 5.480 3.133 2.424 3.541 . 0 0 "[ . 1 . 2]" 1
1327 1 26 ASP H 1 26 ASP HB3 3.670 . 3.670 2.561 2.447 2.694 . 0 0 "[ . 1 . 2]" 1
1328 1 27 ASP H 1 28 LYS QG 4.670 . 4.670 4.063 3.852 4.256 . 0 0 "[ . 1 . 2]" 1
1329 1 28 LYS H 1 30 GLY H 3.860 . 3.860 4.097 4.028 4.147 0.287 20 0 "[ . 1 . 2]" 1
1330 1 27 ASP HA 1 28 LYS H 3.420 . 3.420 3.429 3.387 3.472 0.052 20 0 "[ . 1 . 2]" 1
1331 1 28 LYS H 1 28 LYS HA 2.720 . 2.720 2.130 1.961 2.218 . 0 0 "[ . 1 . 2]" 1
1332 1 27 ASP HB3 1 28 LYS H 4.540 . 4.540 4.367 4.096 4.569 0.029 1 0 "[ . 1 . 2]" 1
1333 1 27 ASP HB2 1 28 LYS H 4.540 . 4.540 4.156 3.975 4.375 . 0 0 "[ . 1 . 2]" 1
1334 1 28 LYS H 1 28 LYS QB 3.910 . 3.910 3.306 3.042 3.399 . 0 0 "[ . 1 . 2]" 1
1335 1 28 LYS H 1 28 LYS QD 3.820 . 3.820 3.736 3.265 4.006 0.186 1 0 "[ . 1 . 2]" 1
1336 1 28 LYS H 1 28 LYS QG 3.160 . 3.160 2.559 2.323 2.758 . 0 0 "[ . 1 . 2]" 1
1337 1 148 LEU H 1 148 LEU HG 3.360 . 3.360 2.490 2.369 2.617 . 0 0 "[ . 1 . 2]" 1
1338 1 29 ASP H 1 30 GLY H 2.870 . 2.870 2.206 2.028 2.345 . 0 0 "[ . 1 . 2]" 1
1339 1 28 LYS H 1 29 ASP H 3.450 . 3.450 2.598 2.356 2.973 . 0 0 "[ . 1 . 2]" 1
1340 1 28 LYS HA 1 29 ASP H 3.240 . 3.240 2.412 1.894 2.715 . 0 0 "[ . 1 . 2]" 1
1341 1 29 ASP H 1 29 ASP HB2 3.110 . 3.110 2.831 1.978 3.325 0.215 6 0 "[ . 1 . 2]" 1
1342 1 138 LYS HB3 1 139 LEU H 3.770 . 3.770 3.799 3.752 3.838 0.068 12 0 "[ . 1 . 2]" 1
1343 1 138 LYS HG2 1 139 LEU H 3.590 . 3.590 2.431 2.177 2.746 . 0 0 "[ . 1 . 2]" 1
1344 1 30 GLY H 1 31 GLY QA 4.380 . 4.380 3.923 3.809 3.994 . 0 0 "[ . 1 . 2]" 1
1345 1 28 LYS HA 1 30 GLY H 4.200 . 4.200 2.667 2.257 2.979 . 0 0 "[ . 1 . 2]" 1
1346 1 29 ASP HB3 1 30 GLY H 4.120 . 4.120 3.727 3.106 3.946 . 0 0 "[ . 1 . 2]" 1
1347 1 29 ASP HB2 1 30 GLY H 4.090 . 4.090 3.464 2.090 4.152 0.062 18 0 "[ . 1 . 2]" 1
1348 1 30 GLY H 1 31 GLY H 2.980 . 2.980 1.910 1.831 1.981 . 0 0 "[ . 1 . 2]" 1
1349 1 31 GLY H 1 65 THR HA 5.040 . 5.040 3.641 3.400 3.851 . 0 0 "[ . 1 . 2]" 1
1350 1 28 LYS HA 1 31 GLY H 4.740 . 4.740 3.775 3.345 4.192 . 0 0 "[ . 1 . 2]" 1
1351 1 29 ASP HB2 1 31 GLY H 5.500 . 5.500 4.016 2.049 5.277 . 0 0 "[ . 1 . 2]" 1
1352 1 31 GLY H 1 65 THR MG 4.820 . 4.820 4.223 4.058 4.543 . 0 0 "[ . 1 . 2]" 1
1353 1 32 ILE H 1 64 ILE H 4.210 . 4.210 2.514 2.261 2.752 . 0 0 "[ . 1 . 2]" 1
1354 1 31 GLY H 1 32 ILE H 4.440 . 4.440 3.337 3.117 3.511 . 0 0 "[ . 1 . 2]" 1
1355 1 32 ILE H 1 63 HIS HA 4.440 . 4.440 3.307 2.893 3.740 . 0 0 "[ . 1 . 2]" 1
1356 1 32 ILE H 1 64 ILE HB 4.240 . 4.240 3.410 3.198 3.601 . 0 0 "[ . 1 . 2]" 1
1357 1 32 ILE H 1 32 ILE HB 3.710 . 3.710 2.439 2.334 2.508 . 0 0 "[ . 1 . 2]" 1
1358 1 32 ILE H 1 32 ILE MG 3.800 . 3.800 3.727 3.682 3.759 . 0 0 "[ . 1 . 2]" 1
1359 1 32 ILE H 1 32 ILE MD 3.720 . 3.720 3.681 3.612 3.735 0.015 9 0 "[ . 1 . 2]" 1
1360 1 32 ILE H 1 32 ILE HG12 4.370 . 4.370 3.615 3.493 3.702 . 0 0 "[ . 1 . 2]" 1
1361 1 33 GLU H 1 33 GLU QG 3.730 . 3.730 1.955 1.760 2.394 . 0 0 "[ . 1 . 2]" 1
1362 1 33 GLU H 1 36 GLU QB 4.200 . 4.200 2.125 1.935 2.502 . 0 0 "[ . 1 . 2]" 1
1363 1 32 ILE MG 1 33 GLU H 3.860 . 3.860 2.929 2.571 3.106 . 0 0 "[ . 1 . 2]" 1
1364 1 32 ILE MD 1 33 GLU H 5.350 . 5.350 5.235 5.016 5.346 . 0 0 "[ . 1 . 2]" 1
1365 1 32 ILE HG12 1 33 GLU H 4.630 . 4.630 4.435 4.194 4.577 . 0 0 "[ . 1 . 2]" 1
1366 1 34 VAL H 1 35 GLU H 4.160 . 4.160 2.560 2.428 2.720 . 0 0 "[ . 1 . 2]" 1
1367 1 34 VAL H 1 34 VAL HB 3.830 . 3.830 2.403 2.297 2.502 . 0 0 "[ . 1 . 2]" 1
1368 1 33 GLU QB 1 34 VAL H 4.250 . 4.250 2.719 2.533 3.107 . 0 0 "[ . 1 . 2]" 1
1369 1 34 VAL H 1 34 VAL MG2 3.860 . 3.860 3.690 3.625 3.732 . 0 0 "[ . 1 . 2]" 1
1370 1 34 VAL H 1 34 VAL MG1 3.860 . 3.860 2.185 1.989 2.404 . 0 0 "[ . 1 . 2]" 1
1371 1 35 GLU H 1 36 GLU QB 4.560 . 4.560 4.478 4.306 4.568 0.008 9 0 "[ . 1 . 2]" 1
1372 1 35 GLU H 1 35 GLU QG 3.470 . 3.470 2.172 1.657 2.382 . 0 0 "[ . 1 . 2]" 1
1373 1 35 GLU H 1 35 GLU QB 3.280 . 3.280 2.474 2.394 2.756 . 0 0 "[ . 1 . 2]" 1
1374 1 34 VAL HB 1 35 GLU H 4.190 . 4.190 3.885 3.789 4.035 . 0 0 "[ . 1 . 2]" 1
1375 1 34 VAL MG2 1 35 GLU H 4.360 . 4.360 3.836 3.578 4.028 . 0 0 "[ . 1 . 2]" 1
1376 1 34 VAL MG1 1 35 GLU H 4.360 . 4.360 2.328 2.132 2.483 . 0 0 "[ . 1 . 2]" 1
1377 1 35 GLU H 1 62 LYS QD 5.500 . 5.500 5.314 4.891 5.590 0.090 10 0 "[ . 1 . 2]" 1
1378 1 36 GLU H 1 38 ASP H 4.270 . 4.270 4.088 3.874 4.274 0.004 5 0 "[ . 1 . 2]" 1
1379 1 36 GLU H 1 37 SER H 3.340 . 3.340 2.668 2.509 2.826 . 0 0 "[ . 1 . 2]" 1
1380 1 35 GLU H 1 36 GLU H 3.500 . 3.500 2.493 2.416 2.592 . 0 0 "[ . 1 . 2]" 1
1381 1 36 GLU H 1 36 GLU QB 3.110 . 3.110 2.394 2.253 2.500 . 0 0 "[ . 1 . 2]" 1
1382 1 36 GLU H 1 36 GLU QG 3.450 . 3.450 2.642 2.530 2.821 . 0 0 "[ . 1 . 2]" 1
1383 1 35 GLU QB 1 36 GLU H 3.790 . 3.790 2.679 2.210 3.442 . 0 0 "[ . 1 . 2]" 1
1384 1 33 GLU QB 1 36 GLU H 4.410 . 4.410 1.944 1.636 2.847 . 0 0 "[ . 1 . 2]" 1
1385 1 35 GLU H 1 37 SER H 4.420 . 4.420 4.131 3.838 4.318 . 0 0 "[ . 1 . 2]" 1
1386 1 37 SER H 1 38 ASP H 3.780 . 3.780 2.574 2.479 2.750 . 0 0 "[ . 1 . 2]" 1
1387 1 34 VAL HA 1 37 SER H 4.480 . 4.480 3.447 3.229 3.615 . 0 0 "[ . 1 . 2]" 1
1388 1 36 GLU QB 1 37 SER H 3.590 . 3.590 2.602 2.374 2.733 . 0 0 "[ . 1 . 2]" 1
1389 1 36 GLU QG 1 37 SER H 4.560 . 4.560 4.271 4.132 4.382 . 0 0 "[ . 1 . 2]" 1
1390 1 33 GLU QB 1 37 SER H 4.560 . 4.560 3.880 3.479 4.387 . 0 0 "[ . 1 . 2]" 1
1391 1 32 ILE MG 1 37 SER H 3.670 . 3.670 2.749 2.378 3.164 . 0 0 "[ . 1 . 2]" 1
1392 1 108 VAL HA 1 109 LYS H 3.180 . 3.180 2.052 1.937 2.184 . 0 0 "[ . 1 . 2]" 1
1393 1 86 THR MG 1 109 LYS H 4.860 . 4.860 4.429 3.723 4.747 . 0 0 "[ . 1 . 2]" 1
1394 1 109 LYS H 1 109 LYS HG2 5.070 . 5.070 4.047 3.695 4.256 . 0 0 "[ . 1 . 2]" 1
1395 1 108 VAL MG2 1 109 LYS H 4.030 . 4.030 3.898 3.619 4.037 0.007 3 0 "[ . 1 . 2]" 1
1396 1 108 VAL MG1 1 109 LYS H 4.030 . 4.030 3.005 2.565 3.334 . 0 0 "[ . 1 . 2]" 1
1397 1 38 ASP H 1 39 GLU H 3.440 . 3.440 2.832 2.727 2.907 . 0 0 "[ . 1 . 2]" 1
1398 1 39 GLU H 1 40 PHE H 3.640 . 3.640 2.799 2.713 2.906 . 0 0 "[ . 1 . 2]" 1
1399 1 37 SER H 1 39 GLU H 4.500 . 4.500 4.292 4.077 4.482 . 0 0 "[ . 1 . 2]" 1
1400 1 39 GLU H 1 41 ILE H 4.460 . 4.460 4.091 3.966 4.199 . 0 0 "[ . 1 . 2]" 1
1401 1 36 GLU HA 1 39 GLU H 4.040 . 4.040 3.849 3.493 4.073 0.033 7 0 "[ . 1 . 2]" 1
1402 1 39 GLU H 1 40 PHE HB3 5.400 . 5.400 5.204 5.078 5.413 0.013 8 0 "[ . 1 . 2]" 1
1403 1 39 GLU H 1 40 PHE HB2 5.400 . 5.400 5.226 5.112 5.388 . 0 0 "[ . 1 . 2]" 1
1404 1 38 ASP QB 1 39 GLU H 3.360 . 3.360 2.564 2.398 2.854 . 0 0 "[ . 1 . 2]" 1
1405 1 39 GLU H 1 39 GLU QG 4.050 . 4.050 3.993 3.934 4.040 . 0 0 "[ . 1 . 2]" 1
1406 1 39 GLU H 1 39 GLU QB 2.990 . 2.990 2.244 2.143 2.327 . 0 0 "[ . 1 . 2]" 1
1407 1 40 PHE H 1 41 ILE H 3.850 . 3.850 2.506 2.366 2.573 . 0 0 "[ . 1 . 2]" 1
1408 1 40 PHE H 1 40 PHE QD 4.440 . 4.440 4.239 4.196 4.271 . 0 0 "[ . 1 . 2]" 1
1409 1 40 PHE QD 1 44 ASP H 4.850 . 4.850 4.520 4.078 4.849 . 0 0 "[ . 1 . 2]" 1
1410 1 40 PHE H 1 40 PHE HB3 3.480 . 3.480 2.623 2.564 2.709 . 0 0 "[ . 1 . 2]" 1
1411 1 40 PHE H 1 40 PHE HB2 3.480 . 3.480 2.578 2.500 2.692 . 0 0 "[ . 1 . 2]" 1
1412 1 36 GLU QB 1 40 PHE H 5.500 . 5.500 5.536 5.366 5.613 0.113 15 0 "[ . 1 . 2]" 1
1413 1 39 GLU QB 1 40 PHE H 3.530 . 3.530 2.548 2.324 2.821 . 0 0 "[ . 1 . 2]" 1
1414 1 39 GLU HA 1 41 ILE H 4.640 . 4.640 4.412 4.235 4.564 . 0 0 "[ . 1 . 2]" 1
1415 1 41 ILE H 1 41 ILE HG13 4.080 . 4.080 3.613 3.544 3.680 . 0 0 "[ . 1 . 2]" 1
1416 1 41 ILE H 1 41 ILE HB 3.610 . 3.610 2.832 2.674 2.931 . 0 0 "[ . 1 . 2]" 1
1417 1 24 MET ME 1 41 ILE H 5.500 . 5.500 4.055 3.639 4.212 . 0 0 "[ . 1 . 2]" 1
1418 1 41 ILE H 1 42 ARG QG 5.500 . 5.500 4.171 3.827 4.521 . 0 0 "[ . 1 . 2]" 1
1419 1 41 ILE H 1 41 ILE HG12 4.080 . 4.080 2.044 1.977 2.119 . 0 0 "[ . 1 . 2]" 1
1420 1 41 ILE H 1 42 ARG H 3.450 . 3.450 2.523 2.483 2.585 . 0 0 "[ . 1 . 2]" 1
1421 1 42 ARG H 1 43 GLU H 3.800 . 3.800 3.027 2.913 3.175 . 0 0 "[ . 1 . 2]" 1
1422 1 39 GLU HA 1 42 ARG H 4.160 . 4.160 3.581 3.308 3.770 . 0 0 "[ . 1 . 2]" 1
1423 1 41 ILE HB 1 42 ARG H 3.690 . 3.690 2.714 2.451 2.871 . 0 0 "[ . 1 . 2]" 1
1424 1 42 ARG H 1 42 ARG QB 3.170 . 3.170 2.436 2.298 2.568 . 0 0 "[ . 1 . 2]" 1
1425 1 42 ARG H 1 42 ARG QG 4.120 . 4.120 2.353 2.061 2.653 . 0 0 "[ . 1 . 2]" 1
1426 1 42 ARG H 1 50 ALA MB 5.120 . 5.120 4.976 4.415 5.169 0.049 14 0 "[ . 1 . 2]" 1
1427 1 41 ILE MG 1 42 ARG H 4.270 . 4.270 3.810 3.535 3.924 . 0 0 "[ . 1 . 2]" 1
1428 1 43 GLU H 1 43 GLU HB3 3.390 . 3.390 2.796 2.703 2.957 . 0 0 "[ . 1 . 2]" 1
1429 1 43 GLU H 1 43 GLU HB2 3.620 . 3.620 3.217 3.127 3.405 . 0 0 "[ . 1 . 2]" 1
1430 1 42 ARG QB 1 43 GLU H 3.450 . 3.450 3.239 2.969 3.632 0.182 6 0 "[ . 1 . 2]" 1
1431 1 41 ILE MG 1 43 GLU H 4.680 . 4.680 4.696 4.553 4.732 0.052 20 0 "[ . 1 . 2]" 1
1432 1 43 GLU H 1 44 ASP H 3.350 . 3.350 2.285 2.129 2.473 . 0 0 "[ . 1 . 2]" 1
1433 1 44 ASP H 1 46 LYS H 4.520 . 4.520 3.663 3.505 3.820 . 0 0 "[ . 1 . 2]" 1
1434 1 43 GLU HB3 1 44 ASP H 4.150 . 4.150 2.222 2.093 2.488 . 0 0 "[ . 1 . 2]" 1
1435 1 141 LEU H 1 141 LEU HB3 3.980 . 3.980 2.671 2.117 2.886 . 0 0 "[ . 1 . 2]" 1
1436 1 141 LEU H 1 141 LEU HB2 3.980 . 3.980 3.654 2.684 3.750 . 0 0 "[ . 1 . 2]" 1
1437 1 141 LEU H 1 141 LEU HG 3.780 . 3.780 2.459 2.154 3.945 0.165 10 0 "[ . 1 . 2]" 1
1438 1 44 ASP H 1 45 MET H 3.250 . 3.250 2.760 2.585 2.979 . 0 0 "[ . 1 . 2]" 1
1439 1 43 GLU H 1 45 MET H 4.070 . 4.070 3.094 2.826 3.280 . 0 0 "[ . 1 . 2]" 1
1440 1 45 MET H 1 46 LYS H 3.380 . 3.380 2.247 2.075 2.413 . 0 0 "[ . 1 . 2]" 1
1441 1 40 PHE HA 1 45 MET H 5.220 . 5.220 4.964 4.651 5.227 0.007 6 0 "[ . 1 . 2]" 1
1442 1 45 MET H 1 46 LYS HA 4.830 . 4.830 4.803 4.643 4.869 0.039 8 0 "[ . 1 . 2]" 1
1443 1 41 ILE HA 1 45 MET H 4.220 . 4.220 2.704 2.575 2.832 . 0 0 "[ . 1 . 2]" 1
1444 1 45 MET H 1 45 MET QG 3.380 . 3.380 2.659 2.352 3.007 . 0 0 "[ . 1 . 2]" 1
1445 1 41 ILE MG 1 45 MET H 4.160 . 4.160 3.904 3.641 4.085 . 0 0 "[ . 1 . 2]" 1
1446 1 41 ILE MD 1 45 MET H 4.680 . 4.680 4.386 4.099 4.578 . 0 0 "[ . 1 . 2]" 1
1447 1 45 MET H 1 45 MET QB 3.550 . 3.550 2.548 2.463 2.706 . 0 0 "[ . 1 . 2]" 1
1448 1 46 LYS H 1 47 TYR H 3.410 . 3.410 2.648 2.408 2.803 . 0 0 "[ . 1 . 2]" 1
1449 1 43 GLU HA 1 46 LYS H 3.990 . 3.990 3.391 3.095 3.693 . 0 0 "[ . 1 . 2]" 1
1450 1 45 MET QB 1 46 LYS H 4.280 . 4.280 3.073 2.918 3.352 . 0 0 "[ . 1 . 2]" 1
1451 1 46 LYS H 1 46 LYS HB2 3.770 . 3.770 2.472 2.260 2.793 . 0 0 "[ . 1 . 2]" 1
1452 1 46 LYS H 1 46 LYS QG 3.990 . 3.990 3.962 3.832 4.015 0.025 5 0 "[ . 1 . 2]" 1
1453 1 46 LYS H 1 46 LYS HB3 3.770 . 3.770 2.530 2.143 2.671 . 0 0 "[ . 1 . 2]" 1
1454 1 50 ALA H 1 52 ASN QB 5.160 . 5.160 3.812 3.519 4.069 . 0 0 "[ . 1 . 2]" 1
1455 1 50 ALA H 1 50 ALA MB 3.490 . 3.490 2.579 2.342 2.806 . 0 0 "[ . 1 . 2]" 1
1456 1 56 HIS H 1 57 LEU H 3.750 . 3.750 2.635 2.475 2.777 . 0 0 "[ . 1 . 2]" 1
1457 1 55 SER H 1 56 HIS H 4.470 . 4.470 2.741 2.564 2.909 . 0 0 "[ . 1 . 2]" 1
1458 1 54 HIS HA 1 56 HIS H 4.190 . 4.190 4.060 3.821 4.230 0.040 14 0 "[ . 1 . 2]" 1
1459 1 56 HIS H 1 56 HIS QB 3.720 . 3.720 2.289 2.190 2.404 . 0 0 "[ . 1 . 2]" 1
1460 1 56 HIS QB 1 57 LEU H 4.280 . 4.280 2.656 2.322 3.040 . 0 0 "[ . 1 . 2]" 1
1461 1 57 LEU H 1 57 LEU QB 3.820 . 3.820 2.240 2.179 2.311 . 0 0 "[ . 1 . 2]" 1
1462 1 57 LEU H 1 57 LEU MD2 4.470 . 4.470 4.246 3.883 4.341 . 0 0 "[ . 1 . 2]" 1
1463 1 58 HIS H 1 59 ARG H 3.830 . 3.830 2.521 2.412 2.714 . 0 0 "[ . 1 . 2]" 1
1464 1 56 HIS H 1 58 HIS H 5.080 . 5.080 4.179 4.008 4.325 . 0 0 "[ . 1 . 2]" 1
1465 1 57 LEU H 1 58 HIS H 3.720 . 3.720 2.491 2.336 2.737 . 0 0 "[ . 1 . 2]" 1
1466 1 58 HIS H 1 58 HIS HB3 3.750 . 3.750 3.444 2.505 3.726 . 0 0 "[ . 1 . 2]" 1
1467 1 58 HIS H 1 58 HIS HB2 3.750 . 3.750 2.697 2.280 3.720 . 0 0 "[ . 1 . 2]" 1
1468 1 57 LEU QB 1 58 HIS H 3.860 . 3.860 2.458 2.341 2.632 . 0 0 "[ . 1 . 2]" 1
1469 1 59 ARG H 1 60 GLU H 4.410 . 4.410 2.684 2.372 2.943 . 0 0 "[ . 1 . 2]" 1
1470 1 56 HIS HA 1 59 ARG H 4.540 . 4.540 4.168 3.582 4.573 0.033 16 0 "[ . 1 . 2]" 1
1471 1 58 HIS HB3 1 59 ARG H 4.790 . 4.790 4.291 4.100 4.413 . 0 0 "[ . 1 . 2]" 1
1472 1 59 ARG H 1 59 ARG QD 5.100 . 5.100 3.704 2.214 4.308 . 0 0 "[ . 1 . 2]" 1
1473 1 58 HIS HB2 1 59 ARG H 4.790 . 4.790 3.867 3.448 4.563 . 0 0 "[ . 1 . 2]" 1
1474 1 59 ARG H 1 59 ARG QB 3.380 . 3.380 2.485 2.290 2.640 . 0 0 "[ . 1 . 2]" 1
1475 1 59 ARG H 1 59 ARG QG 3.420 . 3.420 2.513 2.097 3.565 0.145 2 0 "[ . 1 . 2]" 1
1476 1 60 GLU H 1 61 ASP H 4.410 . 4.410 2.010 1.742 2.480 . 0 0 "[ . 1 . 2]" 1
1477 1 59 ARG QB 1 60 GLU H 4.210 . 4.210 3.593 3.349 3.707 . 0 0 "[ . 1 . 2]" 1
1478 1 59 ARG QG 1 60 GLU H 4.360 . 4.360 2.600 2.074 3.481 . 0 0 "[ . 1 . 2]" 1
1479 1 58 HIS HA 1 61 ASP H 3.640 . 3.640 3.208 2.683 3.697 0.057 7 0 "[ . 1 . 2]" 1
1480 1 61 ASP H 1 61 ASP HB3 3.870 . 3.870 3.461 2.836 3.787 . 0 0 "[ . 1 . 2]" 1
1481 1 61 ASP H 1 61 ASP HB2 3.870 . 3.870 2.779 2.410 3.750 . 0 0 "[ . 1 . 2]" 1
1482 1 60 GLU HB3 1 61 ASP H 4.310 . 4.310 2.725 1.981 4.218 . 0 0 "[ . 1 . 2]" 1
1483 1 60 GLU QG 1 61 ASP H 4.670 . 4.670 3.335 2.232 4.363 . 0 0 "[ . 1 . 2]" 1
1484 1 60 GLU HB2 1 61 ASP H 4.310 . 4.310 3.610 2.715 4.110 . 0 0 "[ . 1 . 2]" 1
1485 1 63 HIS H 1 64 ILE H 4.650 . 4.650 4.072 3.789 4.305 . 0 0 "[ . 1 . 2]" 1
1486 1 61 ASP HA 1 63 HIS H 4.660 . 4.660 4.048 3.621 4.463 . 0 0 "[ . 1 . 2]" 1
1487 1 63 HIS H 1 63 HIS QB 3.360 . 3.360 2.656 2.205 2.920 . 0 0 "[ . 1 . 2]" 1
1488 1 62 LYS QB 1 63 HIS H 4.140 . 4.140 2.045 1.781 2.207 . 0 0 "[ . 1 . 2]" 1
1489 1 62 LYS HG3 1 63 HIS H 4.650 . 4.650 4.021 3.887 4.418 . 0 0 "[ . 1 . 2]" 1
1490 1 62 LYS HG2 1 63 HIS H 4.650 . 4.650 4.555 3.768 4.695 0.045 2 0 "[ . 1 . 2]" 1
1491 1 63 HIS H 1 64 ILE MD 5.500 . 5.500 5.485 5.345 5.590 0.090 8 0 "[ . 1 . 2]" 1
1492 1 63 HIS QB 1 64 ILE H 4.250 . 4.250 3.684 3.512 3.913 . 0 0 "[ . 1 . 2]" 1
1493 1 64 ILE H 1 64 ILE HB 3.870 . 3.870 2.536 2.421 2.667 . 0 0 "[ . 1 . 2]" 1
1494 1 32 ILE HB 1 64 ILE H 4.190 . 4.190 2.362 2.161 2.640 . 0 0 "[ . 1 . 2]" 1
1495 1 32 ILE MD 1 64 ILE H 4.490 . 4.490 3.970 3.809 4.104 . 0 0 "[ . 1 . 2]" 1
1496 1 64 ILE H 1 64 ILE MD 4.210 . 4.210 3.667 3.386 4.054 . 0 0 "[ . 1 . 2]" 1
1497 1 66 ILE H 1 67 GLU H 3.470 . 3.470 2.990 2.912 3.070 . 0 0 "[ . 1 . 2]" 1
1498 1 65 THR H 1 67 GLU H 5.040 . 5.040 5.047 4.895 5.080 0.040 3 0 "[ . 1 . 2]" 1
1499 1 67 GLU H 1 69 LEU H 4.260 . 4.260 4.223 4.160 4.278 0.018 14 0 "[ . 1 . 2]" 1
1500 1 65 THR HA 1 67 GLU H 4.490 . 4.490 4.413 4.320 4.510 0.020 16 0 "[ . 1 . 2]" 1
1501 1 65 THR HB 1 67 GLU H 3.510 . 3.510 3.157 3.002 3.278 . 0 0 "[ . 1 . 2]" 1
1502 1 67 GLU H 1 68 ASP HA 5.470 . 5.470 5.033 4.954 5.127 . 0 0 "[ . 1 . 2]" 1
1503 1 67 GLU H 1 67 GLU HG3 3.770 . 3.770 3.034 2.907 3.219 . 0 0 "[ . 1 . 2]" 1
1504 1 67 GLU H 1 67 GLU HG2 3.490 . 3.490 1.898 1.792 1.994 . 0 0 "[ . 1 . 2]" 1
1505 1 67 GLU H 1 67 GLU HB3 3.020 . 3.020 2.701 2.609 2.775 . 0 0 "[ . 1 . 2]" 1
1506 1 65 THR MG 1 67 GLU H 3.570 . 3.570 2.420 2.001 2.702 . 0 0 "[ . 1 . 2]" 1
1507 1 66 ILE HB 1 67 GLU H 4.080 . 4.080 4.059 3.987 4.101 0.021 5 0 "[ . 1 . 2]" 1
1508 1 66 ILE MG 1 67 GLU H 2.820 . 2.820 2.141 2.057 2.199 . 0 0 "[ . 1 . 2]" 1
1509 1 65 THR H 1 69 LEU H 5.150 . 5.150 4.538 4.179 4.980 . 0 0 "[ . 1 . 2]" 1
1510 1 65 THR H 1 68 ASP HB3 4.140 . 4.140 2.522 2.027 3.635 . 0 0 "[ . 1 . 2]" 1
1511 1 65 THR H 1 68 ASP HB2 4.140 . 4.140 2.229 1.878 2.517 . 0 0 "[ . 1 . 2]" 1
1512 1 64 ILE HB 1 65 THR H 4.380 . 4.380 4.161 4.000 4.325 . 0 0 "[ . 1 . 2]" 1
1513 1 65 THR H 1 65 THR MG 3.840 . 3.840 3.721 3.637 3.777 . 0 0 "[ . 1 . 2]" 1
1514 1 64 ILE MG 1 65 THR H 3.640 . 3.640 2.729 2.434 3.004 . 0 0 "[ . 1 . 2]" 1
1515 1 65 THR H 1 66 ILE H 4.680 . 4.680 4.580 4.506 4.636 . 0 0 "[ . 1 . 2]" 1
1516 1 65 THR HA 1 66 ILE H 3.550 . 3.550 2.395 2.319 2.466 . 0 0 "[ . 1 . 2]" 1
1517 1 65 THR HB 1 66 ILE H 3.680 . 3.680 3.685 3.588 3.743 0.063 15 0 "[ . 1 . 2]" 1
1518 1 65 THR MG 1 66 ILE H 3.650 . 3.650 2.141 2.003 2.229 . 0 0 "[ . 1 . 2]" 1
1519 1 66 ILE H 1 66 ILE HB 3.550 . 3.550 2.579 2.555 2.618 . 0 0 "[ . 1 . 2]" 1
1520 1 66 ILE H 1 66 ILE MG 3.020 . 3.020 2.139 2.021 2.286 . 0 0 "[ . 1 . 2]" 1
1521 1 28 LYS QB 1 66 ILE H 5.260 . 5.260 5.028 4.825 5.102 . 0 0 "[ . 1 . 2]" 1
1522 1 21 HIS HD2 1 66 ILE H 4.540 . 4.540 3.891 3.807 4.007 . 0 0 "[ . 1 . 2]" 1
1523 1 67 GLU H 1 67 GLU HB2 3.640 . 3.640 3.570 3.544 3.599 . 0 0 "[ . 1 . 2]" 1
1524 1 67 GLU H 1 68 ASP H 3.220 . 3.220 2.464 2.389 2.568 . 0 0 "[ . 1 . 2]" 1
1525 1 68 ASP H 1 69 LEU H 3.440 . 3.440 2.476 2.394 2.611 . 0 0 "[ . 1 . 2]" 1
1526 1 66 ILE H 1 68 ASP H 4.590 . 4.590 4.114 3.993 4.228 . 0 0 "[ . 1 . 2]" 1
1527 1 65 THR H 1 68 ASP H 3.800 . 3.800 3.578 3.441 3.729 . 0 0 "[ . 1 . 2]" 1
1528 1 65 THR HB 1 68 ASP H 4.100 . 4.100 2.605 2.309 2.881 . 0 0 "[ . 1 . 2]" 1
1529 1 68 ASP H 1 68 ASP HB3 3.560 . 3.560 2.822 2.590 3.599 0.039 7 0 "[ . 1 . 2]" 1
1530 1 68 ASP H 1 68 ASP HB2 3.560 . 3.560 2.459 2.375 2.559 . 0 0 "[ . 1 . 2]" 1
1531 1 67 GLU HG3 1 68 ASP H 4.220 . 4.220 2.637 2.518 2.805 . 0 0 "[ . 1 . 2]" 1
1532 1 67 GLU HG2 1 68 ASP H 4.170 . 4.170 2.943 2.674 3.083 . 0 0 "[ . 1 . 2]" 1
1533 1 67 GLU HB2 1 68 ASP H 3.850 . 3.850 3.882 3.854 3.904 0.054 3 0 "[ . 1 . 2]" 1
1534 1 65 THR MG 1 68 ASP H 4.180 . 4.180 3.562 3.349 3.781 . 0 0 "[ . 1 . 2]" 1
1535 1 64 ILE MG 1 68 ASP H 3.840 . 3.840 3.859 3.750 3.913 0.073 4 0 "[ . 1 . 2]" 1
1536 1 68 ASP H 1 69 LEU MD2 3.660 . 3.660 3.400 3.280 3.469 . 0 0 "[ . 1 . 2]" 1
1537 1 69 LEU H 1 70 TRP H 3.680 . 3.680 2.709 2.596 2.825 . 0 0 "[ . 1 . 2]" 1
1538 1 69 LEU H 1 71 LYS H 4.740 . 4.740 4.476 4.381 4.546 . 0 0 "[ . 1 . 2]" 1
1539 1 21 HIS HD2 1 69 LEU H 5.340 . 5.340 5.015 4.888 5.180 . 0 0 "[ . 1 . 2]" 1
1540 1 66 ILE HA 1 69 LEU H 4.090 . 4.090 3.764 3.592 3.864 . 0 0 "[ . 1 . 2]" 1
1541 1 68 ASP HB3 1 69 LEU H 3.730 . 3.730 2.800 2.479 3.678 . 0 0 "[ . 1 . 2]" 1
1542 1 68 ASP HB2 1 69 LEU H 3.730 . 3.730 3.645 2.920 3.788 0.058 8 0 "[ . 1 . 2]" 1
1543 1 69 LEU H 1 69 LEU HB2 3.390 . 3.390 2.618 2.575 2.643 . 0 0 "[ . 1 . 2]" 1
1544 1 69 LEU H 1 69 LEU HG 4.560 . 4.560 4.069 4.030 4.095 . 0 0 "[ . 1 . 2]" 1
1545 1 69 LEU H 1 72 ARG QG 5.240 . 5.240 4.352 3.981 4.928 . 0 0 "[ . 1 . 2]" 1
1546 1 69 LEU H 1 69 LEU HB3 3.710 . 3.710 3.712 3.675 3.729 0.019 2 0 "[ . 1 . 2]" 1
1547 1 64 ILE MG 1 69 LEU H 3.650 . 3.650 3.051 2.932 3.230 . 0 0 "[ . 1 . 2]" 1
1548 1 69 LEU H 1 69 LEU MD2 3.280 . 3.280 1.865 1.821 1.915 . 0 0 "[ . 1 . 2]" 1
1549 1 70 TRP H 1 71 LYS H 3.370 . 3.370 2.930 2.854 2.979 . 0 0 "[ . 1 . 2]" 1
1550 1 70 TRP HB3 1 71 LYS H 3.740 . 3.740 2.861 2.729 3.445 . 0 0 "[ . 1 . 2]" 1
1551 1 70 TRP HB2 1 71 LYS H 3.520 . 3.520 2.578 2.174 2.672 . 0 0 "[ . 1 . 2]" 1
1552 1 71 LYS H 1 71 LYS HB3 2.880 . 2.880 2.896 2.740 2.931 0.051 15 0 "[ . 1 . 2]" 1
1553 1 71 LYS H 1 71 LYS HG2 3.490 . 3.490 2.415 2.185 3.056 . 0 0 "[ . 1 . 2]" 1
1554 1 71 LYS H 1 74 LYS QD 4.950 . 4.950 4.712 3.728 5.003 0.053 3 0 "[ . 1 . 2]" 1
1555 1 72 ARG H 1 74 LYS H 3.970 . 3.970 3.910 3.852 3.974 0.004 20 0 "[ . 1 . 2]" 1
1556 1 72 ARG H 1 73 TRP HA 5.500 . 5.500 5.309 5.254 5.362 . 0 0 "[ . 1 . 2]" 1
1557 1 72 ARG H 1 73 TRP QB 5.500 . 5.500 5.171 5.065 5.252 . 0 0 "[ . 1 . 2]" 1
1558 1 71 LYS QE 1 72 ARG H 4.210 . 4.210 2.765 2.559 2.966 . 0 0 "[ . 1 . 2]" 1
1559 1 72 ARG H 1 72 ARG QB 2.940 . 2.940 2.215 2.122 2.300 . 0 0 "[ . 1 . 2]" 1
1560 1 71 LYS HG3 1 72 ARG H 4.010 . 4.010 2.142 2.005 2.286 . 0 0 "[ . 1 . 2]" 1
1561 1 69 LEU MD1 1 72 ARG H 5.420 . 5.420 5.053 4.940 5.208 . 0 0 "[ . 1 . 2]" 1
1562 1 70 TRP HA 1 74 LYS H 4.500 . 4.500 4.023 3.840 4.153 . 0 0 "[ . 1 . 2]" 1
1563 1 71 LYS HA 1 74 LYS H 3.870 . 3.870 3.432 3.289 3.536 . 0 0 "[ . 1 . 2]" 1
1564 1 73 TRP QB 1 74 LYS H 3.910 . 3.910 2.974 2.850 3.074 . 0 0 "[ . 1 . 2]" 1
1565 1 72 ARG QB 1 74 LYS H 4.670 . 4.670 4.294 4.198 4.428 . 0 0 "[ . 1 . 2]" 1
1566 1 74 LYS H 1 74 LYS HB3 3.750 . 3.750 2.804 2.381 3.640 . 0 0 "[ . 1 . 2]" 1
1567 1 74 LYS H 1 74 LYS HB2 3.750 . 3.750 2.440 2.333 2.559 . 0 0 "[ . 1 . 2]" 1
1568 1 74 LYS H 1 75 THR H 3.500 . 3.500 2.730 2.684 2.821 . 0 0 "[ . 1 . 2]" 1
1569 1 73 TRP HA 1 75 THR H 4.220 . 4.220 3.913 3.764 4.148 . 0 0 "[ . 1 . 2]" 1
1570 1 75 THR H 1 75 THR HB 3.920 . 3.920 3.638 3.575 3.724 . 0 0 "[ . 1 . 2]" 1
1571 1 71 LYS HA 1 75 THR H 4.410 . 4.410 3.973 3.864 4.061 . 0 0 "[ . 1 . 2]" 1
1572 1 72 ARG HA 1 75 THR H 4.820 . 4.820 3.786 3.531 3.937 . 0 0 "[ . 1 . 2]" 1
1573 1 75 THR H 1 75 THR MG 3.100 . 3.100 2.576 2.433 2.765 . 0 0 "[ . 1 . 2]" 1
1574 1 75 THR H 1 76 SER H 3.100 . 3.100 2.528 2.367 2.667 . 0 0 "[ . 1 . 2]" 1
1575 1 76 SER H 1 79 HIS H 4.590 . 4.590 4.397 4.188 4.565 . 0 0 "[ . 1 . 2]" 1
1576 1 73 TRP HA 1 76 SER H 4.320 . 4.320 3.035 2.767 3.197 . 0 0 "[ . 1 . 2]" 1
1577 1 74 LYS HA 1 76 SER H 4.270 . 4.270 3.834 3.623 4.272 0.002 7 0 "[ . 1 . 2]" 1
1578 1 76 SER H 1 79 HIS HB2 4.860 . 4.860 4.632 4.150 4.881 0.021 20 0 "[ . 1 . 2]" 1
1579 1 75 THR MG 1 76 SER H 4.610 . 4.610 4.265 4.188 4.341 . 0 0 "[ . 1 . 2]" 1
1580 1 76 SER H 1 79 HIS HB3 4.960 . 4.960 3.945 3.717 4.323 . 0 0 "[ . 1 . 2]" 1
1581 1 74 LYS H 1 76 SER H 4.100 . 4.100 3.914 3.821 4.030 . 0 0 "[ . 1 . 2]" 1
1582 1 76 SER H 1 77 GLU H 4.580 . 4.580 4.455 4.399 4.557 . 0 0 "[ . 1 . 2]" 1
1583 1 77 GLU H 1 78 VAL H 3.490 . 3.490 2.670 2.317 2.824 . 0 0 "[ . 1 . 2]" 1
1584 1 76 SER HA 1 77 GLU H 3.130 . 3.130 2.362 2.218 2.558 . 0 0 "[ . 1 . 2]" 1
1585 1 77 GLU H 1 77 GLU HG3 3.810 . 3.810 3.248 2.996 3.668 . 0 0 "[ . 1 . 2]" 1
1586 1 77 GLU H 1 77 GLU QB 3.040 . 3.040 2.540 2.439 2.726 . 0 0 "[ . 1 . 2]" 1
1587 1 77 GLU H 1 78 VAL HB 5.430 . 5.430 4.951 4.652 5.212 . 0 0 "[ . 1 . 2]" 1
1588 1 77 GLU H 1 79 HIS H 4.700 . 4.700 4.631 4.422 4.729 0.029 10 0 "[ . 1 . 2]" 1
1589 1 77 GLU HG2 1 78 VAL H 4.710 . 4.710 2.981 2.576 3.868 . 0 0 "[ . 1 . 2]" 1
1590 1 77 GLU QB 1 78 VAL H 3.570 . 3.570 3.492 2.537 3.595 0.025 15 0 "[ . 1 . 2]" 1
1591 1 78 VAL H 1 78 VAL HB 3.340 . 3.340 2.511 2.434 2.608 . 0 0 "[ . 1 . 2]" 1
1592 1 78 VAL H 1 78 VAL MG2 3.840 . 3.840 3.773 3.734 3.802 . 0 0 "[ . 1 . 2]" 1
1593 1 78 VAL H 1 146 VAL MG2 5.460 . 5.460 5.461 5.181 5.549 0.089 9 0 "[ . 1 . 2]" 1
1594 1 78 VAL H 1 79 HIS H 3.440 . 3.440 2.845 2.727 2.951 . 0 0 "[ . 1 . 2]" 1
1595 1 79 HIS H 1 80 ASN H 3.540 . 3.540 2.388 2.281 2.619 . 0 0 "[ . 1 . 2]" 1
1596 1 78 VAL H 1 80 ASN H 4.660 . 4.660 3.955 3.791 4.046 . 0 0 "[ . 1 . 2]" 1
1597 1 77 GLU HA 1 79 HIS H 5.040 . 5.040 4.199 3.956 4.444 . 0 0 "[ . 1 . 2]" 1
1598 1 79 HIS H 1 79 HIS HB2 3.250 . 3.250 2.331 2.200 2.424 . 0 0 "[ . 1 . 2]" 1
1599 1 78 VAL HB 1 79 HIS H 4.140 . 4.140 3.867 3.797 3.933 . 0 0 "[ . 1 . 2]" 1
1600 1 79 HIS H 1 79 HIS HB3 3.390 . 3.390 2.387 2.265 2.580 . 0 0 "[ . 1 . 2]" 1
1601 1 78 VAL MG2 1 79 HIS H 3.880 . 3.880 3.536 3.357 3.673 . 0 0 "[ . 1 . 2]" 1
1602 1 78 VAL MG1 1 79 HIS H 3.880 . 3.880 2.141 1.990 2.284 . 0 0 "[ . 1 . 2]" 1
1603 1 78 VAL MG1 1 80 ASN H 5.150 . 5.150 4.087 4.021 4.172 . 0 0 "[ . 1 . 2]" 1
1604 1 82 THR H 1 83 LEU H 4.810 . 4.810 4.400 4.243 4.520 . 0 0 "[ . 1 . 2]" 1
1605 1 82 THR H 1 84 GLU H 5.040 . 5.040 4.812 4.462 5.053 0.013 11 0 "[ . 1 . 2]" 1
1606 1 82 THR H 1 86 THR H 4.160 . 4.160 4.003 3.708 4.179 0.019 9 0 "[ . 1 . 2]" 1
1607 1 82 THR H 1 85 ASP H 3.840 . 3.840 3.539 3.206 3.815 . 0 0 "[ . 1 . 2]" 1
1608 1 81 TRP HD1 1 82 THR H 4.430 . 4.430 4.198 3.904 4.379 . 0 0 "[ . 1 . 2]" 1
1609 1 81 TRP HA 1 82 THR H 3.140 . 3.140 2.122 2.004 2.214 . 0 0 "[ . 1 . 2]" 1
1610 1 82 THR H 1 85 ASP QB 3.700 . 3.700 2.370 1.920 3.747 0.047 19 0 "[ . 1 . 2]" 1
1611 1 82 THR H 1 82 THR MG 3.080 . 3.080 1.984 1.757 2.182 . 0 0 "[ . 1 . 2]" 1
1612 1 82 THR HB 1 83 LEU H 3.930 . 3.930 3.483 3.404 3.625 . 0 0 "[ . 1 . 2]" 1
1613 1 83 LEU H 1 109 LYS HA 4.330 . 4.330 3.788 3.409 4.320 . 0 0 "[ . 1 . 2]" 1
1614 1 83 LEU H 1 83 LEU HG 3.390 . 3.390 1.790 1.730 1.877 . 0 0 "[ . 1 . 2]" 1
1615 1 83 LEU H 1 109 LYS HB3 3.840 . 3.840 2.210 1.985 2.987 . 0 0 "[ . 1 . 2]" 1
1616 1 82 THR MG 1 83 LEU H 4.300 . 4.300 3.125 2.589 3.718 . 0 0 "[ . 1 . 2]" 1
1617 1 83 LEU H 1 83 LEU MD1 3.910 . 3.910 3.427 3.379 3.497 . 0 0 "[ . 1 . 2]" 1
1618 1 83 LEU H 1 84 GLU H 3.560 . 3.560 2.742 2.660 2.865 . 0 0 "[ . 1 . 2]" 1
1619 1 82 THR HB 1 84 GLU H 4.560 . 4.560 4.586 4.426 4.641 0.081 16 0 "[ . 1 . 2]" 1
1620 1 84 GLU H 1 84 GLU HG2 3.550 . 3.550 2.094 1.882 2.299 . 0 0 "[ . 1 . 2]" 1
1621 1 84 GLU H 1 84 GLU HG3 3.480 . 3.480 3.173 3.049 3.403 . 0 0 "[ . 1 . 2]" 1
1622 1 84 GLU H 1 84 GLU HB2 3.700 . 3.700 3.654 3.601 3.693 . 0 0 "[ . 1 . 2]" 1
1623 1 83 LEU HG 1 84 GLU H 3.340 . 3.340 2.519 2.371 2.629 . 0 0 "[ . 1 . 2]" 1
1624 1 82 THR MG 1 84 GLU H 3.820 . 3.820 2.347 1.814 3.112 . 0 0 "[ . 1 . 2]" 1
1625 1 83 LEU MD1 1 84 GLU H 3.900 . 3.900 2.530 2.328 2.758 . 0 0 "[ . 1 . 2]" 1
1626 1 84 GLU H 1 84 GLU HB3 3.690 . 3.690 2.688 2.613 2.779 . 0 0 "[ . 1 . 2]" 1
1627 1 85 ASP H 1 87 LEU H 4.530 . 4.530 4.078 3.921 4.205 . 0 0 "[ . 1 . 2]" 1
1628 1 87 LEU H 1 88 GLN H 3.660 . 3.660 2.543 2.479 2.672 . 0 0 "[ . 1 . 2]" 1
1629 1 86 THR HB 1 87 LEU H 4.010 . 4.010 2.513 2.377 2.660 . 0 0 "[ . 1 . 2]" 1
1630 1 87 LEU H 1 87 LEU HB2 3.230 . 3.230 2.241 2.185 2.331 . 0 0 "[ . 1 . 2]" 1
1631 1 85 ASP QB 1 87 LEU H 5.060 . 5.060 4.700 4.546 5.078 0.018 19 0 "[ . 1 . 2]" 1
1632 1 87 LEU H 1 87 LEU HB3 3.790 . 3.790 3.517 3.477 3.557 . 0 0 "[ . 1 . 2]" 1
1633 1 13 SER HA 1 15 GLU H 5.100 . 5.100 4.675 4.482 4.802 . 0 0 "[ . 1 . 2]" 1
1634 1 86 THR HB 1 89 TRP H 5.500 . 5.500 5.494 5.439 5.533 0.033 8 0 "[ . 1 . 2]" 1
1635 1 84 GLU HA 1 87 LEU H 3.940 . 3.940 3.651 3.449 3.797 . 0 0 "[ . 1 . 2]" 1
1636 1 89 TRP QB 1 90 LEU H 3.630 . 3.630 2.626 2.546 2.695 . 0 0 "[ . 1 . 2]" 1
1637 1 90 LEU H 1 90 LEU HB3 3.580 . 3.580 2.396 2.312 2.453 . 0 0 "[ . 1 . 2]" 1
1638 1 87 LEU H 1 87 LEU MD2 4.350 . 4.350 2.401 2.298 3.241 . 0 0 "[ . 1 . 2]" 1
1639 1 90 LEU H 1 91 ILE MD 4.200 . 4.200 4.064 3.975 4.174 . 0 0 "[ . 1 . 2]" 1
1640 1 90 LEU H 1 90 LEU MD2 4.600 . 4.600 4.037 3.948 4.127 . 0 0 "[ . 1 . 2]" 1
1641 1 91 ILE H 1 92 GLU H 3.390 . 3.390 2.578 2.498 2.623 . 0 0 "[ . 1 . 2]" 1
1642 1 90 LEU HB2 1 91 ILE H 3.970 . 3.970 3.927 3.773 3.961 . 0 0 "[ . 1 . 2]" 1
1643 1 91 ILE H 1 91 ILE QG 3.390 . 3.390 3.476 3.452 3.500 0.110 20 0 "[ . 1 . 2]" 1
1644 1 91 ILE H 1 91 ILE MG 3.390 . 3.390 2.036 1.935 2.113 . 0 0 "[ . 1 . 2]" 1
1645 1 90 LEU MD1 1 91 ILE H 4.380 . 4.380 4.411 4.146 4.461 0.081 10 0 "[ . 1 . 2]" 1
1646 1 90 LEU MD2 1 91 ILE H 4.380 . 4.380 2.615 2.423 3.510 . 0 0 "[ . 1 . 2]" 1
1647 1 92 GLU H 1 93 PHE H 3.280 . 3.280 2.675 2.612 2.725 . 0 0 "[ . 1 . 2]" 1
1648 1 92 GLU H 1 93 PHE QD 4.590 . 4.590 4.133 3.977 4.337 . 0 0 "[ . 1 . 2]" 1
1649 1 92 GLU H 1 95 GLU H 4.460 . 4.460 4.138 4.070 4.285 . 0 0 "[ . 1 . 2]" 1
1650 1 92 GLU H 1 92 GLU HB2 2.950 . 2.950 2.182 2.140 2.213 . 0 0 "[ . 1 . 2]" 1
1651 1 91 ILE QG 1 92 GLU H 3.350 . 3.350 2.745 2.694 2.847 . 0 0 "[ . 1 . 2]" 1
1652 1 90 LEU HB3 1 92 GLU H 4.750 . 4.750 4.814 4.732 4.838 0.088 6 0 "[ . 1 . 2]" 1
1653 1 91 ILE MD 1 92 GLU H 3.040 . 3.040 2.041 2.005 2.097 . 0 0 "[ . 1 . 2]" 1
1654 1 92 GLU H 1 92 GLU HB3 3.530 . 3.530 3.530 3.493 3.556 0.026 6 0 "[ . 1 . 2]" 1
1655 1 92 GLU H 1 92 GLU HG3 4.030 . 4.030 3.199 2.541 3.937 . 0 0 "[ . 1 . 2]" 1
1656 1 93 PHE H 1 93 PHE QD 4.000 . 4.000 2.657 2.470 2.800 . 0 0 "[ . 1 . 2]" 1
1657 1 93 PHE H 1 95 GLU H 3.880 . 3.880 3.425 3.232 3.531 . 0 0 "[ . 1 . 2]" 1
1658 1 89 TRP HA 1 93 PHE H 4.190 . 4.190 3.616 3.333 3.901 . 0 0 "[ . 1 . 2]" 1
1659 1 93 PHE H 1 95 GLU HA 5.070 . 5.070 5.081 4.907 5.130 0.060 18 0 "[ . 1 . 2]" 1
1660 1 93 PHE H 1 93 PHE QB 2.970 . 2.970 2.515 2.452 2.572 . 0 0 "[ . 1 . 2]" 1
1661 1 92 GLU HB2 1 93 PHE H 3.610 . 3.610 2.850 2.681 3.146 . 0 0 "[ . 1 . 2]" 1
1662 1 92 GLU HB3 1 93 PHE H 3.770 . 3.770 3.465 3.279 3.695 . 0 0 "[ . 1 . 2]" 1
1663 1 91 ILE QG 1 93 PHE H 4.930 . 4.930 4.903 4.814 4.952 0.022 16 0 "[ . 1 . 2]" 1
1664 1 91 ILE MD 1 93 PHE H 4.390 . 4.390 4.464 4.432 4.485 0.095 20 0 "[ . 1 . 2]" 1
1665 1 92 GLU H 1 94 VAL H 4.720 . 4.720 4.007 3.866 4.264 . 0 0 "[ . 1 . 2]" 1
1666 1 93 PHE H 1 94 VAL H 3.840 . 3.840 2.112 1.992 2.306 . 0 0 "[ . 1 . 2]" 1
1667 1 94 VAL H 1 96 LEU H 4.780 . 4.780 4.192 3.872 4.374 . 0 0 "[ . 1 . 2]" 1
1668 1 94 VAL H 1 95 GLU HA 5.030 . 5.030 4.335 4.137 4.573 . 0 0 "[ . 1 . 2]" 1
1669 1 93 PHE QB 1 94 VAL H 3.230 . 3.230 2.908 2.635 3.161 . 0 0 "[ . 1 . 2]" 1
1670 1 94 VAL H 1 94 VAL HB 3.610 . 3.610 2.512 2.268 3.676 0.066 15 0 "[ . 1 . 2]" 1
1671 1 94 VAL H 1 142 LYS QG 4.300 . 4.300 4.120 3.725 4.344 0.044 16 0 "[ . 1 . 2]" 1
1672 1 90 LEU HB3 1 94 VAL H 5.500 . 5.500 5.475 5.336 5.529 0.029 4 0 "[ . 1 . 2]" 1
1673 1 94 VAL H 1 94 VAL MG2 4.030 . 4.030 2.495 2.342 2.631 . 0 0 "[ . 1 . 2]" 1
1674 1 94 VAL H 1 94 VAL MG1 4.030 . 4.030 3.414 2.176 3.641 . 0 0 "[ . 1 . 2]" 1
1675 1 93 PHE QD 1 94 VAL H 4.680 . 4.680 4.307 4.175 4.474 . 0 0 "[ . 1 . 2]" 1
1676 1 94 VAL H 1 95 GLU H 3.330 . 3.330 2.249 2.069 2.489 . 0 0 "[ . 1 . 2]" 1
1677 1 93 PHE HA 1 95 GLU H 4.650 . 4.650 4.498 4.375 4.561 . 0 0 "[ . 1 . 2]" 1
1678 1 91 ILE HA 1 95 GLU H 3.310 . 3.310 2.379 2.269 2.434 . 0 0 "[ . 1 . 2]" 1
1679 1 94 VAL HB 1 95 GLU H 4.230 . 4.230 2.954 2.676 4.189 . 0 0 "[ . 1 . 2]" 1
1680 1 91 ILE MG 1 95 GLU H 4.530 . 4.530 4.538 4.458 4.568 0.038 13 0 "[ . 1 . 2]" 1
1681 1 94 VAL MG2 1 95 GLU H 3.970 . 3.970 3.751 2.471 3.984 0.014 18 0 "[ . 1 . 2]" 1
1682 1 94 VAL MG1 1 95 GLU H 3.970 . 3.970 3.379 3.231 3.987 0.017 15 0 "[ . 1 . 2]" 1
1683 1 95 GLU H 1 96 LEU H 3.170 . 3.170 2.637 2.525 2.714 . 0 0 "[ . 1 . 2]" 1
1684 1 95 GLU HA 1 96 LEU H 3.430 . 3.430 2.753 2.627 2.944 . 0 0 "[ . 1 . 2]" 1
1685 1 96 LEU H 1 97 PRO HD3 4.100 . 4.100 3.279 3.052 3.630 . 0 0 "[ . 1 . 2]" 1
1686 1 91 ILE HA 1 96 LEU H 3.290 . 3.290 2.200 2.093 2.338 . 0 0 "[ . 1 . 2]" 1
1687 1 94 VAL HB 1 96 LEU H 3.620 . 3.620 3.102 2.901 3.884 0.264 17 0 "[ . 1 . 2]" 1
1688 1 95 GLU HB2 1 96 LEU H 4.910 . 4.910 4.389 4.094 4.674 . 0 0 "[ . 1 . 2]" 1
1689 1 91 ILE QG 1 96 LEU H 5.220 . 5.220 5.186 5.079 5.279 0.059 10 0 "[ . 1 . 2]" 1
1690 1 90 LEU HG 1 96 LEU H 4.490 . 4.490 3.579 3.090 3.770 . 0 0 "[ . 1 . 2]" 1
1691 1 91 ILE MG 1 96 LEU H 4.040 . 4.040 3.443 3.313 3.593 . 0 0 "[ . 1 . 2]" 1
1692 1 90 LEU MD1 1 96 LEU H 4.630 . 4.630 4.509 3.585 4.705 0.075 8 0 "[ . 1 . 2]" 1
1693 1 94 VAL MG1 1 96 LEU H 4.470 . 4.470 2.678 2.315 4.272 . 0 0 "[ . 1 . 2]" 1
1694 1 99 TYR H 1 138 LYS QE 5.500 . 5.500 4.928 4.549 5.361 . 0 0 "[ . 1 . 2]" 1
1695 1 99 TYR H 1 99 TYR QE 5.380 . 5.380 4.950 4.758 5.178 . 0 0 "[ . 1 . 2]" 1
1696 1 100 GLU H 1 102 ASN H 4.390 . 4.390 4.045 3.810 4.296 . 0 0 "[ . 1 . 2]" 1
1697 1 98 GLN HA 1 100 GLU H 4.350 . 4.350 4.044 3.650 4.206 . 0 0 "[ . 1 . 2]" 1
1698 1 97 PRO HA 1 100 GLU H 4.080 . 4.080 3.359 3.125 3.506 . 0 0 "[ . 1 . 2]" 1
1699 1 100 GLU H 1 100 GLU HB3 3.140 . 3.140 2.642 2.596 2.736 . 0 0 "[ . 1 . 2]" 1
1700 1 100 GLU H 1 100 GLU HB2 3.780 . 3.780 3.638 3.605 3.675 . 0 0 "[ . 1 . 2]" 1
1701 1 100 GLU H 1 101 LYS HB3 4.730 . 4.730 4.728 4.653 4.771 0.041 18 0 "[ . 1 . 2]" 1
1702 1 100 GLU H 1 101 LYS QD 4.400 . 4.400 3.159 2.994 3.381 . 0 0 "[ . 1 . 2]" 1
1703 1 91 ILE MG 1 100 GLU H 4.340 . 4.340 4.212 3.898 4.352 0.012 18 0 "[ . 1 . 2]" 1
1704 1 90 LEU MD1 1 100 GLU H 5.060 . 5.060 4.390 4.049 5.130 0.070 19 0 "[ . 1 . 2]" 1
1705 1 90 LEU MD2 1 100 GLU H 5.060 . 5.060 3.591 3.271 3.764 . 0 0 "[ . 1 . 2]" 1
1706 1 101 LYS H 1 102 ASN H 3.120 . 3.120 2.592 2.408 2.784 . 0 0 "[ . 1 . 2]" 1
1707 1 100 GLU H 1 101 LYS H 3.280 . 3.280 2.490 2.440 2.551 . 0 0 "[ . 1 . 2]" 1
1708 1 99 TYR H 1 101 LYS H 4.770 . 4.770 4.315 4.109 4.461 . 0 0 "[ . 1 . 2]" 1
1709 1 99 TYR HA 1 101 LYS H 4.330 . 4.330 3.775 3.419 3.969 . 0 0 "[ . 1 . 2]" 1
1710 1 98 GLN HA 1 101 LYS H 5.280 . 5.280 5.222 4.758 5.369 0.089 14 0 "[ . 1 . 2]" 1
1711 1 101 LYS H 1 101 LYS QE 4.320 . 4.320 3.855 3.617 4.142 . 0 0 "[ . 1 . 2]" 1
1712 1 100 GLU HB3 1 101 LYS H 4.340 . 4.340 4.002 3.870 4.117 . 0 0 "[ . 1 . 2]" 1
1713 1 101 LYS H 1 101 LYS HB2 3.610 . 3.610 3.615 3.586 3.648 0.038 16 0 "[ . 1 . 2]" 1
1714 1 101 LYS H 1 101 LYS HB3 2.880 . 2.880 2.461 2.413 2.563 . 0 0 "[ . 1 . 2]" 1
1715 1 101 LYS H 1 101 LYS QD 3.620 . 3.620 1.934 1.724 2.095 . 0 0 "[ . 1 . 2]" 1
1716 1 101 LYS H 1 101 LYS QG 3.480 . 3.480 3.286 3.181 3.382 . 0 0 "[ . 1 . 2]" 1
1717 1 103 PHE H 1 105 ASP H 4.770 . 4.770 4.463 4.301 4.707 . 0 0 "[ . 1 . 2]" 1
1718 1 103 PHE H 1 103 PHE QD 3.390 . 3.390 3.228 3.010 3.414 0.024 9 0 "[ . 1 . 2]" 1
1719 1 103 PHE H 1 106 ASN H 4.740 . 4.740 4.740 4.637 4.783 0.043 8 0 "[ . 1 . 2]" 1
1720 1 101 LYS HA 1 103 PHE H 5.150 . 5.150 4.687 4.431 4.875 . 0 0 "[ . 1 . 2]" 1
1721 1 100 GLU HA 1 103 PHE H 3.680 . 3.680 3.560 3.359 3.691 0.011 11 0 "[ . 1 . 2]" 1
1722 1 103 PHE H 1 103 PHE QB 3.600 . 3.600 2.328 2.223 2.528 . 0 0 "[ . 1 . 2]" 1
1723 1 103 PHE H 1 104 ARG QB 4.880 . 4.880 4.354 4.183 4.612 . 0 0 "[ . 1 . 2]" 1
1724 1 101 LYS QG 1 103 PHE H 5.000 . 5.000 4.999 4.862 5.050 0.050 14 0 "[ . 1 . 2]" 1
1725 1 103 PHE H 1 104 ARG H 3.300 . 3.300 2.726 2.622 2.879 . 0 0 "[ . 1 . 2]" 1
1726 1 103 PHE QD 1 104 ARG H 4.270 . 4.270 4.298 4.111 4.386 0.116 9 0 "[ . 1 . 2]" 1
1727 1 104 ARG H 1 106 ASN H 4.520 . 4.520 4.270 4.106 4.448 . 0 0 "[ . 1 . 2]" 1
1728 1 101 LYS HA 1 104 ARG H 4.260 . 4.260 3.676 3.509 3.823 . 0 0 "[ . 1 . 2]" 1
1729 1 100 GLU HA 1 104 ARG H 4.080 . 4.080 3.850 3.712 4.004 . 0 0 "[ . 1 . 2]" 1
1730 1 103 PHE QB 1 104 ARG H 3.830 . 3.830 2.359 2.278 2.447 . 0 0 "[ . 1 . 2]" 1
1731 1 104 ARG H 1 104 ARG QB 3.030 . 3.030 2.181 2.071 2.314 . 0 0 "[ . 1 . 2]" 1
1732 1 104 ARG H 1 104 ARG QG 4.100 . 4.100 3.925 3.830 4.001 . 0 0 "[ . 1 . 2]" 1
1733 1 87 LEU HB3 1 104 ARG H 5.500 . 5.500 5.299 5.126 5.568 0.068 12 0 "[ . 1 . 2]" 1
1734 1 104 ARG H 1 105 ASP H 3.360 . 3.360 2.939 2.886 3.029 . 0 0 "[ . 1 . 2]" 1
1735 1 102 ASN H 1 105 ASP H 5.350 . 5.350 4.734 4.622 4.817 . 0 0 "[ . 1 . 2]" 1
1736 1 105 ASP H 1 106 ASN H 3.380 . 3.380 2.766 2.603 2.944 . 0 0 "[ . 1 . 2]" 1
1737 1 102 ASN HA 1 105 ASP H 4.420 . 4.420 3.972 3.750 4.237 . 0 0 "[ . 1 . 2]" 1
1738 1 101 LYS HA 1 105 ASP H 3.960 . 3.960 3.627 3.437 3.877 . 0 0 "[ . 1 . 2]" 1
1739 1 103 PHE QB 1 105 ASP H 5.110 . 5.110 4.815 4.722 4.982 . 0 0 "[ . 1 . 2]" 1
1740 1 105 ASP H 1 105 ASP HB2 3.690 . 3.690 2.499 2.281 2.673 . 0 0 "[ . 1 . 2]" 1
1741 1 104 ARG QB 1 105 ASP H 3.230 . 3.230 2.101 1.947 2.321 . 0 0 "[ . 1 . 2]" 1
1742 1 104 ARG QG 1 105 ASP H 4.260 . 4.260 3.416 3.160 3.738 . 0 0 "[ . 1 . 2]" 1
1743 1 101 LYS QG 1 105 ASP H 5.370 . 5.370 5.082 4.902 5.215 . 0 0 "[ . 1 . 2]" 1
1744 1 105 ASP H 1 105 ASP HB3 3.690 . 3.690 2.735 2.368 3.596 . 0 0 "[ . 1 . 2]" 1
1745 1 107 ASN H 1 108 VAL H 3.800 . 3.800 2.400 2.247 2.544 . 0 0 "[ . 1 . 2]" 1
1746 1 106 ASN H 1 108 VAL H 4.540 . 4.540 4.353 4.155 4.549 0.009 1 0 "[ . 1 . 2]" 1
1747 1 107 ASN HA 1 108 VAL H 3.090 . 3.090 2.047 1.950 2.283 . 0 0 "[ . 1 . 2]" 1
1748 1 107 ASN HB3 1 108 VAL H 4.710 . 4.710 4.399 4.360 4.432 . 0 0 "[ . 1 . 2]" 1
1749 1 108 VAL H 1 108 VAL HB 3.340 . 3.340 2.640 2.589 2.720 . 0 0 "[ . 1 . 2]" 1
1750 1 108 VAL H 1 108 VAL MG2 3.870 . 3.870 2.887 2.801 2.968 . 0 0 "[ . 1 . 2]" 1
1751 1 108 VAL H 1 108 VAL MG1 3.870 . 3.870 3.853 3.814 3.891 0.021 1 0 "[ . 1 . 2]" 1
1752 1 38 ASP H 1 38 ASP QB 3.790 . 3.790 2.205 2.144 2.249 . 0 0 "[ . 1 . 2]" 1
1753 1 109 LYS H 1 109 LYS HG3 5.070 . 5.070 2.699 2.100 4.534 . 0 0 "[ . 1 . 2]" 1
1754 1 109 LYS H 1 111 THR MG 4.000 . 4.000 3.381 2.891 3.930 . 0 0 "[ . 1 . 2]" 1
1755 1 32 ILE MG 1 38 ASP H 5.240 . 5.240 4.581 4.329 4.849 . 0 0 "[ . 1 . 2]" 1
1756 1 86 THR H 1 110 GLY H 4.850 . 4.850 4.618 4.274 4.930 0.080 7 0 "[ . 1 . 2]" 1
1757 1 82 THR HA 1 110 GLY H 5.500 . 5.500 4.593 3.428 5.161 . 0 0 "[ . 1 . 2]" 1
1758 1 83 LEU HA 1 110 GLY H 5.500 . 5.500 4.430 4.077 4.849 . 0 0 "[ . 1 . 2]" 1
1759 1 81 TRP QB 1 110 GLY H 4.000 . 4.000 3.154 2.775 3.644 . 0 0 "[ . 1 . 2]" 1
1760 1 109 LYS HB2 1 110 GLY H 4.200 . 4.200 3.677 1.899 4.061 . 0 0 "[ . 1 . 2]" 1
1761 1 86 THR MG 1 110 GLY H 3.870 . 3.870 2.817 2.392 3.930 0.060 13 0 "[ . 1 . 2]" 1
1762 1 110 GLY H 1 111 THR H 3.650 . 3.650 2.863 2.517 3.672 0.022 12 0 "[ . 1 . 2]" 1
1763 1 109 LYS H 1 111 THR H 3.600 . 3.600 2.818 2.644 3.265 . 0 0 "[ . 1 . 2]" 1
1764 1 111 THR H 1 111 THR HB 3.520 . 3.520 3.160 2.658 3.534 0.014 17 0 "[ . 1 . 2]" 1
1765 1 109 LYS HB2 1 111 THR H 5.250 . 5.250 4.904 4.594 5.205 . 0 0 "[ . 1 . 2]" 1
1766 1 86 THR MG 1 111 THR H 3.990 . 3.990 3.869 3.624 4.019 0.029 4 0 "[ . 1 . 2]" 1
1767 1 111 THR H 1 111 THR MG 4.420 . 4.420 3.301 2.890 3.812 . 0 0 "[ . 1 . 2]" 1
1768 1 111 THR H 1 112 THR MG 4.770 . 4.770 3.695 3.521 3.904 . 0 0 "[ . 1 . 2]" 1
1769 1 112 THR H 1 113 LEU H 3.300 . 3.300 2.606 2.481 2.703 . 0 0 "[ . 1 . 2]" 1
1770 1 111 THR H 1 112 THR H 3.530 . 3.530 2.652 2.453 2.829 . 0 0 "[ . 1 . 2]" 1
1771 1 68 ASP HA 1 71 LYS H 4.120 . 4.120 3.422 3.315 3.623 . 0 0 "[ . 1 . 2]" 1
1772 1 111 THR HB 1 112 THR H 3.990 . 3.990 2.340 1.736 2.895 . 0 0 "[ . 1 . 2]" 1
1773 1 71 LYS H 1 71 LYS HG3 3.820 . 3.820 2.074 1.970 2.146 . 0 0 "[ . 1 . 2]" 1
1774 1 112 THR H 1 112 THR MG 4.080 . 4.080 2.040 1.876 2.239 . 0 0 "[ . 1 . 2]" 1
1775 1 113 LEU H 1 115 ARG H 4.270 . 4.270 3.695 3.534 3.871 . 0 0 "[ . 1 . 2]" 1
1776 1 110 GLY HA2 1 113 LEU H 4.100 . 4.100 3.859 3.606 4.003 . 0 0 "[ . 1 . 2]" 1
1777 1 113 LEU H 1 143 ALA MB 4.590 . 4.590 4.229 4.104 4.368 . 0 0 "[ . 1 . 2]" 1
1778 1 112 THR MG 1 113 LEU H 3.990 . 3.990 2.520 2.353 2.654 . 0 0 "[ . 1 . 2]" 1
1779 1 113 LEU H 1 113 LEU MD1 4.730 . 4.730 3.100 2.190 3.586 . 0 0 "[ . 1 . 2]" 1
1780 1 118 VAL H 1 119 HIS H 4.780 . 4.780 2.727 1.896 4.479 . 0 0 "[ . 1 . 2]" 1
1781 1 118 VAL H 1 140 GLN QG 5.290 . 5.290 4.501 2.631 4.916 . 0 0 "[ . 1 . 2]" 1
1782 1 118 VAL HB 1 119 HIS H 3.970 . 3.970 2.852 2.142 3.991 0.021 15 0 "[ . 1 . 2]" 1
1783 1 119 HIS H 1 119 HIS QB 3.430 . 3.430 2.626 2.181 3.111 . 0 0 "[ . 1 . 2]" 1
1784 1 122 SER H 1 122 SER HB3 3.730 . 3.730 3.155 2.550 3.602 . 0 0 "[ . 1 . 2]" 1
1785 1 122 SER H 1 125 ILE QG 5.220 . 5.220 3.909 2.714 5.192 . 0 0 "[ . 1 . 2]" 1
1786 1 122 SER H 1 122 SER HB2 3.730 . 3.730 2.794 2.349 3.566 . 0 0 "[ . 1 . 2]" 1
1787 1 117 ALA H 1 123 PHE H 4.400 . 4.400 4.293 3.619 4.596 0.196 7 0 "[ . 1 . 2]" 1
1788 1 122 SER HB2 1 123 PHE H 4.160 . 4.160 3.516 2.828 4.212 0.052 11 0 "[ . 1 . 2]" 1
1789 1 123 PHE H 1 125 ILE MD 4.660 . 4.660 4.402 3.448 4.786 0.126 14 0 "[ . 1 . 2]" 1
1790 1 133 ARG QD 1 134 SER H 4.670 . 4.670 4.144 3.440 4.652 . 0 0 "[ . 1 . 2]" 1
1791 1 134 SER H 1 137 GLN HG2 4.920 . 4.920 4.296 4.005 4.629 . 0 0 "[ . 1 . 2]" 1
1792 1 133 ARG HB3 1 134 SER H 3.680 . 3.680 3.327 3.067 3.628 . 0 0 "[ . 1 . 2]" 1
1793 1 135 HIS H 1 136 ARG H 3.370 . 3.370 2.578 2.471 2.842 . 0 0 "[ . 1 . 2]" 1
1794 1 135 HIS H 1 135 HIS HD2 3.640 . 3.640 3.318 2.124 3.706 0.066 3 0 "[ . 1 . 2]" 1
1795 1 133 ARG HA 1 135 HIS H 4.930 . 4.930 4.523 4.189 4.896 . 0 0 "[ . 1 . 2]" 1
1796 1 135 HIS H 1 135 HIS QB 3.520 . 3.520 2.527 2.312 2.718 . 0 0 "[ . 1 . 2]" 1
1797 1 135 HIS H 1 137 GLN HG2 4.870 . 4.870 4.484 4.201 4.778 . 0 0 "[ . 1 . 2]" 1
1798 1 133 ARG HB2 1 135 HIS H 5.440 . 5.440 4.874 4.536 5.221 . 0 0 "[ . 1 . 2]" 1
1799 1 135 HIS H 1 138 LYS HG2 4.770 . 4.770 4.447 4.081 4.765 . 0 0 "[ . 1 . 2]" 1
1800 1 136 ARG H 1 138 LYS H 4.920 . 4.920 4.190 4.012 4.311 . 0 0 "[ . 1 . 2]" 1
1801 1 133 ARG HA 1 136 ARG H 4.210 . 4.210 3.724 3.395 4.160 . 0 0 "[ . 1 . 2]" 1
1802 1 135 HIS QB 1 136 ARG H 4.100 . 4.100 2.542 2.326 3.583 . 0 0 "[ . 1 . 2]" 1
1803 1 137 GLN H 1 138 LYS H 3.510 . 3.510 2.697 2.567 2.776 . 0 0 "[ . 1 . 2]" 1
1804 1 138 LYS H 1 139 LEU H 3.870 . 3.870 2.758 2.657 2.865 . 0 0 "[ . 1 . 2]" 1
1805 1 135 HIS HA 1 138 LYS H 4.600 . 4.600 3.777 3.585 3.992 . 0 0 "[ . 1 . 2]" 1
1806 1 138 LYS H 1 139 LEU HA 5.500 . 5.500 5.277 5.200 5.373 . 0 0 "[ . 1 . 2]" 1
1807 1 137 GLN HG2 1 138 LYS H 4.550 . 4.550 2.707 2.554 2.858 . 0 0 "[ . 1 . 2]" 1
1808 1 137 GLN HB3 1 138 LYS H 3.980 . 3.980 3.998 3.979 4.022 0.042 20 0 "[ . 1 . 2]" 1
1809 1 138 LYS H 1 138 LYS HB3 3.740 . 3.740 2.478 2.334 2.653 . 0 0 "[ . 1 . 2]" 1
1810 1 138 LYS H 1 138 LYS HB2 3.730 . 3.730 3.649 3.581 3.706 . 0 0 "[ . 1 . 2]" 1
1811 1 138 LYS H 1 138 LYS HG3 4.060 . 4.060 3.645 3.396 3.880 . 0 0 "[ . 1 . 2]" 1
1812 1 29 ASP H 1 29 ASP HB3 3.190 . 3.190 2.598 2.143 3.330 0.140 12 0 "[ . 1 . 2]" 1
1813 1 138 LYS HB2 1 139 LEU H 4.090 . 4.090 3.839 3.636 4.008 . 0 0 "[ . 1 . 2]" 1
1814 1 40 PHE HA 1 44 ASP H 4.380 . 4.380 4.040 3.546 4.385 0.005 16 0 "[ . 1 . 2]" 1
1815 1 140 GLN QB 1 141 LEU H 3.690 . 3.690 2.500 2.259 2.811 . 0 0 "[ . 1 . 2]" 1
1816 1 41 ILE HA 1 44 ASP H 4.740 . 4.740 4.676 4.445 4.756 0.016 20 0 "[ . 1 . 2]" 1
1817 1 90 LEU H 1 91 ILE H 3.590 . 3.590 3.004 2.956 3.080 . 0 0 "[ . 1 . 2]" 1
1818 1 141 LEU H 1 142 LYS H 3.710 . 3.710 2.625 2.574 2.687 . 0 0 "[ . 1 . 2]" 1
1819 1 91 ILE H 1 96 LEU H 4.600 . 4.600 4.615 4.490 4.748 0.148 10 0 "[ . 1 . 2]" 1
1820 1 139 LEU HA 1 142 LYS H 4.140 . 4.140 3.384 3.131 3.651 . 0 0 "[ . 1 . 2]" 1
1821 1 142 LYS H 1 142 LYS QB 3.590 . 3.590 2.172 2.051 2.422 . 0 0 "[ . 1 . 2]" 1
1822 1 141 LEU HG 1 142 LYS H 3.230 . 3.230 2.707 2.354 3.057 . 0 0 "[ . 1 . 2]" 1
1823 1 142 LYS H 1 142 LYS QD 3.930 . 3.930 3.279 2.462 3.696 . 0 0 "[ . 1 . 2]" 1
1824 1 90 LEU HB3 1 91 ILE H 4.010 . 4.010 2.498 2.345 2.536 . 0 0 "[ . 1 . 2]" 1
1825 1 91 ILE H 1 91 ILE MD 3.350 . 3.350 2.188 2.123 2.242 . 0 0 "[ . 1 . 2]" 1
1826 1 91 ILE H 1 94 VAL MG1 5.190 . 5.190 5.236 4.969 5.299 0.109 19 0 "[ . 1 . 2]" 1
1827 1 143 ALA H 1 144 LEU H 3.270 . 3.270 2.584 2.485 2.703 . 0 0 "[ . 1 . 2]" 1
1828 1 142 LYS H 1 143 ALA H 3.290 . 3.290 2.589 2.491 2.689 . 0 0 "[ . 1 . 2]" 1
1829 1 141 LEU H 1 143 ALA H 4.490 . 4.490 4.252 4.088 4.417 . 0 0 "[ . 1 . 2]" 1
1830 1 143 ALA H 1 145 ASP H 4.350 . 4.350 4.004 3.838 4.187 . 0 0 "[ . 1 . 2]" 1
1831 1 141 LEU HA 1 143 ALA H 5.070 . 5.070 4.540 4.398 4.671 . 0 0 "[ . 1 . 2]" 1
1832 1 139 LEU HA 1 143 ALA H 4.040 . 4.040 3.084 2.824 3.315 . 0 0 "[ . 1 . 2]" 1
1833 1 142 LYS QB 1 143 ALA H 3.710 . 3.710 2.709 2.555 2.907 . 0 0 "[ . 1 . 2]" 1
1834 1 143 ALA H 1 144 LEU QB 4.590 . 4.590 4.188 4.061 4.391 . 0 0 "[ . 1 . 2]" 1
1835 1 142 LYS QG 1 143 ALA H 4.370 . 4.370 4.383 4.141 4.493 0.123 10 0 "[ . 1 . 2]" 1
1836 1 143 ALA H 1 143 ALA MB 2.940 . 2.940 2.252 2.212 2.290 . 0 0 "[ . 1 . 2]" 1
1837 1 143 ALA H 1 146 VAL MG2 4.440 . 4.440 4.062 3.886 4.206 . 0 0 "[ . 1 . 2]" 1
1838 1 139 LEU MD1 1 143 ALA H 4.040 . 4.040 3.414 3.197 3.538 . 0 0 "[ . 1 . 2]" 1
1839 1 19 THR H 1 21 HIS H 4.300 . 4.300 4.059 3.960 4.171 . 0 0 "[ . 1 . 2]" 1
1840 1 142 LYS HA 1 144 LEU H 4.950 . 4.950 4.444 4.255 4.804 . 0 0 "[ . 1 . 2]" 1
1841 1 141 LEU HA 1 144 LEU H 3.940 . 3.940 3.521 3.320 3.766 . 0 0 "[ . 1 . 2]" 1
1842 1 18 GLN HA 1 21 HIS H 3.850 . 3.850 3.554 3.432 3.664 . 0 0 "[ . 1 . 2]" 1
1843 1 144 LEU H 1 144 LEU QB 3.280 . 3.280 2.166 2.106 2.220 . 0 0 "[ . 1 . 2]" 1
1844 1 144 LEU H 1 144 LEU HG 4.570 . 4.570 4.532 4.460 4.576 0.006 15 0 "[ . 1 . 2]" 1
1845 1 143 ALA MB 1 144 LEU H 3.700 . 3.700 2.453 2.315 2.614 . 0 0 "[ . 1 . 2]" 1
1846 1 144 LEU H 1 144 LEU MD2 4.520 . 4.520 4.148 4.050 4.243 . 0 0 "[ . 1 . 2]" 1
1847 1 144 LEU H 1 146 VAL MG2 4.880 . 4.880 4.296 4.207 4.393 . 0 0 "[ . 1 . 2]" 1
1848 1 20 ILE MD 1 21 HIS H 3.820 . 3.820 3.854 3.837 3.875 0.055 16 0 "[ . 1 . 2]" 1
1849 1 144 LEU H 1 145 ASP H 3.710 . 3.710 2.713 2.599 2.811 . 0 0 "[ . 1 . 2]" 1
1850 1 145 ASP H 1 145 ASP HB3 3.480 . 3.480 2.397 2.186 2.615 . 0 0 "[ . 1 . 2]" 1
1851 1 145 ASP H 1 145 ASP HB2 3.480 . 3.480 2.505 2.327 2.685 . 0 0 "[ . 1 . 2]" 1
1852 1 45 MET ME 1 145 ASP H 3.430 . 3.430 2.580 2.319 2.788 . 0 0 "[ . 1 . 2]" 1
1853 1 144 LEU QB 1 145 ASP H 3.710 . 3.710 2.277 2.134 2.528 . 0 0 "[ . 1 . 2]" 1
1854 1 145 ASP H 1 146 VAL MG1 5.050 . 5.050 4.335 4.252 4.461 . 0 0 "[ . 1 . 2]" 1
1855 1 145 ASP H 1 146 VAL MG2 4.520 . 4.520 4.104 3.970 4.220 . 0 0 "[ . 1 . 2]" 1
1856 1 145 ASP H 1 146 VAL H 3.700 . 3.700 2.882 2.746 2.990 . 0 0 "[ . 1 . 2]" 1
1857 1 143 ALA HA 1 146 VAL H 4.360 . 4.360 3.218 2.930 3.465 . 0 0 "[ . 1 . 2]" 1
1858 1 146 VAL H 1 147 VAL HA 5.340 . 5.340 5.233 5.095 5.341 0.001 19 0 "[ . 1 . 2]" 1
1859 1 145 ASP HB3 1 146 VAL H 3.990 . 3.990 2.300 2.201 2.431 . 0 0 "[ . 1 . 2]" 1
1860 1 145 ASP HB2 1 146 VAL H 3.990 . 3.990 3.735 3.663 3.857 . 0 0 "[ . 1 . 2]" 1
1861 1 146 VAL H 1 146 VAL HB 3.650 . 3.650 3.655 3.637 3.676 0.026 11 0 "[ . 1 . 2]" 1
1862 1 146 VAL H 1 147 VAL HB 4.960 . 4.960 4.758 4.603 4.969 0.009 18 0 "[ . 1 . 2]" 1
1863 1 143 ALA MB 1 146 VAL H 5.030 . 5.030 4.498 4.323 4.624 . 0 0 "[ . 1 . 2]" 1
1864 1 146 VAL H 1 146 VAL MG1 3.300 . 3.300 2.080 1.970 2.237 . 0 0 "[ . 1 . 2]" 1
1865 1 146 VAL H 1 146 VAL MG2 3.140 . 3.140 2.077 1.986 2.259 . 0 0 "[ . 1 . 2]" 1
1866 1 147 VAL H 1 148 LEU H 3.500 . 3.500 2.731 2.658 2.800 . 0 0 "[ . 1 . 2]" 1
1867 1 146 VAL H 1 147 VAL H 3.410 . 3.410 2.671 2.518 2.832 . 0 0 "[ . 1 . 2]" 1
1868 1 143 ALA HA 1 147 VAL H 4.880 . 4.880 3.723 3.604 3.833 . 0 0 "[ . 1 . 2]" 1
1869 1 146 VAL HB 1 147 VAL H 4.180 . 4.180 3.885 3.831 3.948 . 0 0 "[ . 1 . 2]" 1
1870 1 147 VAL H 1 147 VAL HB 3.370 . 3.370 2.376 2.324 2.428 . 0 0 "[ . 1 . 2]" 1
1871 1 146 VAL MG1 1 147 VAL H 3.900 . 3.900 3.916 3.898 3.933 0.033 18 0 "[ . 1 . 2]" 1
1872 1 146 VAL MG2 1 147 VAL H 3.420 . 3.420 2.266 2.204 2.333 . 0 0 "[ . 1 . 2]" 1
1873 1 147 VAL H 1 147 VAL MG2 3.770 . 3.770 2.297 2.184 2.376 . 0 0 "[ . 1 . 2]" 1
1874 1 147 VAL H 1 147 VAL MG1 3.770 . 3.770 3.719 3.694 3.755 . 0 0 "[ . 1 . 2]" 1
1875 1 145 ASP HA 1 148 LEU H 5.080 . 5.080 3.890 3.675 4.142 . 0 0 "[ . 1 . 2]" 1
1876 1 28 LYS H 1 29 ASP HB3 5.460 . 5.460 4.787 3.953 6.285 0.825 12 7 "[ * * -1 + ** *]" 1
1877 1 147 VAL HB 1 148 LEU H 3.880 . 3.880 2.460 2.336 2.535 . 0 0 "[ . 1 . 2]" 1
1878 1 148 LEU H 1 148 LEU HB3 3.830 . 3.830 3.588 3.553 3.618 . 0 0 "[ . 1 . 2]" 1
1879 1 148 LEU H 1 148 LEU MD1 3.900 . 3.900 3.503 3.324 3.607 . 0 0 "[ . 1 . 2]" 1
1880 1 148 LEU H 1 148 LEU MD2 3.900 . 3.900 3.648 3.546 3.735 . 0 0 "[ . 1 . 2]" 1
1881 1 148 LEU H 1 148 LEU HB2 3.830 . 3.830 2.381 2.328 2.420 . 0 0 "[ . 1 . 2]" 1
1882 1 148 LEU H 1 150 GLY H 4.920 . 4.920 4.190 3.821 4.630 . 0 0 "[ . 1 . 2]" 1
1883 1 148 LEU H 1 149 PHE H 3.750 . 3.750 2.578 2.477 2.663 . 0 0 "[ . 1 . 2]" 1
1884 1 146 VAL HA 1 149 PHE H 4.290 . 4.290 3.421 3.070 3.804 . 0 0 "[ . 1 . 2]" 1
1885 1 149 PHE H 1 150 GLY QA 4.800 . 4.800 4.121 3.918 4.257 . 0 0 "[ . 1 . 2]" 1
1886 1 148 LEU HG 1 149 PHE H 4.710 . 4.710 4.615 4.501 4.700 . 0 0 "[ . 1 . 2]" 1
1887 1 148 LEU MD1 1 149 PHE H 4.750 . 4.750 4.821 4.753 4.904 0.154 19 0 "[ . 1 . 2]" 1
1888 1 148 LEU MD2 1 149 PHE H 4.750 . 4.750 4.765 4.718 4.797 0.047 9 0 "[ . 1 . 2]" 1
1889 1 149 PHE H 1 150 GLY H 3.160 . 3.160 2.300 2.133 2.561 . 0 0 "[ . 1 . 2]" 1
1890 1 146 VAL HA 1 150 GLY H 3.290 . 3.290 3.024 2.240 3.295 0.005 7 0 "[ . 1 . 2]" 1
1891 1 150 GLY H 1 150 GLY QA 2.660 . 2.660 2.186 2.107 2.420 . 0 0 "[ . 1 . 2]" 1
1892 1 149 PHE HB3 1 150 GLY H 4.370 . 4.370 2.612 2.081 3.098 . 0 0 "[ . 1 . 2]" 1
1893 1 149 PHE HB2 1 150 GLY H 4.370 . 4.370 3.806 3.508 4.062 . 0 0 "[ . 1 . 2]" 1
1894 1 146 VAL HB 1 150 GLY H 4.650 . 4.650 4.353 4.002 4.613 . 0 0 "[ . 1 . 2]" 1
1895 1 146 VAL MG2 1 150 GLY H 4.720 . 4.720 4.729 4.626 4.787 0.067 3 0 "[ . 1 . 2]" 1
1896 1 14 LEU H 1 16 ALA H 4.620 . 4.620 3.990 3.832 4.140 . 0 0 "[ . 1 . 2]" 1
1897 1 14 LEU H 1 14 LEU MD2 4.490 . 4.490 4.232 3.863 4.335 . 0 0 "[ . 1 . 2]" 1
1898 1 11 ARG HA 1 14 LEU H 5.180 . 5.180 4.588 3.561 4.992 . 0 0 "[ . 1 . 2]" 1
1899 1 11 ARG HA 1 15 GLU H 4.780 . 4.780 3.428 3.152 3.638 . 0 0 "[ . 1 . 2]" 1
1900 1 17 LEU H 1 17 LEU MD1 4.250 . 4.250 3.804 3.696 3.910 . 0 0 "[ . 1 . 2]" 1
1901 1 17 LEU H 1 17 LEU MD2 4.250 . 4.250 2.925 2.840 2.997 . 0 0 "[ . 1 . 2]" 1
1902 1 68 ASP HA 1 72 ARG H 4.180 . 4.180 3.823 3.733 3.936 . 0 0 "[ . 1 . 2]" 1
1903 1 22 LYS H 1 22 LYS HG3 4.450 . 4.450 4.121 3.926 4.305 . 0 0 "[ . 1 . 2]" 1
1904 1 23 GLN H 1 23 GLN HG2 4.020 . 4.020 2.457 2.247 3.849 . 0 0 "[ . 1 . 2]" 1
1905 1 32 ILE H 1 65 THR HA 4.680 . 4.680 3.752 3.472 3.940 . 0 0 "[ . 1 . 2]" 1
1906 1 40 PHE H 1 42 ARG H 4.430 . 4.430 3.988 3.865 4.135 . 0 0 "[ . 1 . 2]" 1
1907 1 41 ILE H 1 45 MET H 4.830 . 4.830 4.907 4.871 4.950 0.120 1 0 "[ . 1 . 2]" 1
1908 1 59 ARG H 1 61 ASP H 5.000 . 5.000 4.069 3.634 4.505 . 0 0 "[ . 1 . 2]" 1
1909 1 33 GLU H 1 34 VAL HA 5.500 . 5.500 5.346 5.109 5.519 0.019 2 0 "[ . 1 . 2]" 1
1910 1 25 ASP H 1 26 ASP H 4.770 . 4.770 3.947 3.545 4.176 . 0 0 "[ . 1 . 2]" 1
1911 1 26 ASP H 1 28 LYS HA 5.190 . 5.190 5.214 5.119 5.268 0.078 16 0 "[ . 1 . 2]" 1
1912 1 24 MET HA 1 37 SER H 4.690 . 4.690 4.541 4.014 4.742 0.052 2 0 "[ . 1 . 2]" 1
1913 1 35 GLU QB 1 37 SER H 5.090 . 5.090 4.854 4.478 5.131 0.041 9 0 "[ . 1 . 2]" 1
1914 1 43 GLU H 1 45 MET QB 5.500 . 5.500 4.548 4.327 4.790 . 0 0 "[ . 1 . 2]" 1
1915 1 40 PHE HA 1 43 GLU H 4.650 . 4.650 4.085 3.792 4.383 . 0 0 "[ . 1 . 2]" 1
1916 1 46 LYS HB3 1 47 TYR H 4.170 . 4.170 2.649 2.433 3.035 . 0 0 "[ . 1 . 2]" 1
1917 1 48 LYS QE 1 49 ASP H 4.850 . 4.850 4.342 2.893 5.007 0.157 19 0 "[ . 1 . 2]" 1
1918 1 45 MET QB 1 49 ASP H 4.230 . 4.230 3.410 3.213 3.643 . 0 0 "[ . 1 . 2]" 1
1919 1 48 LYS QB 1 49 ASP H 4.440 . 4.440 2.321 1.875 2.678 . 0 0 "[ . 1 . 2]" 1
1920 1 41 ILE MG 1 49 ASP H 4.480 . 4.480 4.356 4.060 4.534 0.054 9 0 "[ . 1 . 2]" 1
1921 1 85 ASP H 1 86 THR H 3.420 . 3.420 2.546 2.425 2.692 . 0 0 "[ . 1 . 2]" 1
1922 1 52 ASN QB 1 55 SER H 5.170 . 5.170 4.949 4.642 5.125 . 0 0 "[ . 1 . 2]" 1
1923 1 41 ILE MG 1 50 ALA H 4.470 . 4.470 3.927 3.514 4.338 . 0 0 "[ . 1 . 2]" 1
1924 1 86 THR H 1 87 LEU H 3.350 . 3.350 2.726 2.617 2.810 . 0 0 "[ . 1 . 2]" 1
1925 1 86 THR H 1 86 THR HB 3.860 . 3.860 2.560 2.361 2.671 . 0 0 "[ . 1 . 2]" 1
1926 1 86 THR H 1 87 LEU HB2 4.890 . 4.890 4.767 4.561 4.897 0.007 12 0 "[ . 1 . 2]" 1
1927 1 85 ASP QB 1 86 THR H 3.700 . 3.700 2.483 2.225 3.568 . 0 0 "[ . 1 . 2]" 1
1928 1 86 THR H 1 86 THR MG 3.890 . 3.890 3.733 3.648 3.773 . 0 0 "[ . 1 . 2]" 1
1929 1 64 ILE MD 1 65 THR H 5.440 . 5.440 5.231 5.080 5.357 . 0 0 "[ . 1 . 2]" 1
1930 1 57 LEU H 1 59 ARG H 4.650 . 4.650 3.803 3.618 4.060 . 0 0 "[ . 1 . 2]" 1
1931 1 41 ILE MG 1 46 LYS H 4.780 . 4.780 3.871 3.458 4.286 . 0 0 "[ . 1 . 2]" 1
1932 1 61 ASP H 1 64 ILE MD 5.400 . 5.400 5.230 4.391 5.476 0.076 17 0 "[ . 1 . 2]" 1
1933 1 16 ALA MB 1 115 ARG H 4.790 . 4.790 4.745 4.461 4.893 0.103 13 0 "[ . 1 . 2]" 1
1934 1 118 VAL HB 1 120 GLU H 5.500 . 5.500 4.845 4.034 5.632 0.132 18 0 "[ . 1 . 2]" 1
1935 1 119 HIS QB 1 120 GLU H 4.150 . 4.150 2.999 2.079 3.971 . 0 0 "[ . 1 . 2]" 1
1936 1 124 MET H 1 125 ILE HA 5.500 . 5.500 5.158 4.987 5.365 . 0 0 "[ . 1 . 2]" 1
1937 1 124 MET H 1 124 MET ME 4.740 . 4.740 4.284 3.593 4.771 0.031 2 0 "[ . 1 . 2]" 1
1938 1 124 MET H 1 125 ILE QG 4.680 . 4.680 3.873 3.549 4.326 . 0 0 "[ . 1 . 2]" 1
1939 1 112 THR MG 1 124 MET H 4.600 . 4.600 4.257 3.650 4.667 0.067 13 0 "[ . 1 . 2]" 1
1940 1 123 PHE H 1 125 ILE H 4.460 . 4.460 3.791 3.003 4.218 . 0 0 "[ . 1 . 2]" 1
1941 1 125 ILE HA 1 127 GLN H 4.180 . 4.180 4.059 3.839 4.226 0.046 15 0 "[ . 1 . 2]" 1
1942 1 125 ILE QG 1 127 GLN H 5.500 . 5.500 5.002 4.165 5.550 0.050 5 0 "[ . 1 . 2]" 1
1943 1 66 ILE MD 1 70 TRP HE1 4.700 . 4.700 4.005 2.426 4.373 . 0 0 "[ . 1 . 2]" 1
1944 1 18 GLN H 1 18 GLN HE21 4.280 . 4.280 3.933 3.640 4.048 . 0 0 "[ . 1 . 2]" 1
1945 1 18 GLN H 1 18 GLN HE22 5.500 . 5.500 5.475 5.295 5.564 0.064 11 0 "[ . 1 . 2]" 1
1946 1 83 LEU QB 1 107 ASN HD22 4.670 . 4.670 3.924 3.252 4.425 . 0 0 "[ . 1 . 2]" 1
1947 1 14 LEU H 1 14 LEU MD1 4.490 . 4.490 4.215 4.115 4.338 . 0 0 "[ . 1 . 2]" 1
1948 1 20 ILE H 1 20 ILE MD 3.510 . 3.510 3.517 3.488 3.545 0.035 15 0 "[ . 1 . 2]" 1
1949 1 20 ILE H 1 20 ILE HG13 4.310 . 4.310 3.069 2.920 3.214 . 0 0 "[ . 1 . 2]" 1
1950 1 20 ILE H 1 20 ILE HG12 4.310 . 4.310 1.878 1.822 1.963 . 0 0 "[ . 1 . 2]" 1
1951 1 24 MET H 1 25 ASP HA 5.200 . 5.200 5.206 5.148 5.232 0.032 11 0 "[ . 1 . 2]" 1
1952 1 24 MET H 1 32 ILE HG12 4.820 . 4.820 4.490 4.324 4.664 . 0 0 "[ . 1 . 2]" 1
1953 1 22 LYS H 1 22 LYS HG2 5.490 . 5.490 4.406 4.253 4.526 . 0 0 "[ . 1 . 2]" 1
1954 1 22 LYS H 1 22 LYS QD 5.500 . 5.500 4.347 4.045 4.823 . 0 0 "[ . 1 . 2]" 1
1955 1 22 LYS H 1 22 LYS QE 5.500 . 5.500 5.542 4.757 5.774 0.274 3 0 "[ . 1 . 2]" 1
1956 1 24 MET H 1 24 MET ME 4.100 . 4.100 4.212 4.159 4.233 0.133 5 0 "[ . 1 . 2]" 1
1957 1 32 ILE H 1 32 ILE HG13 3.530 . 3.530 2.363 2.193 2.485 . 0 0 "[ . 1 . 2]" 1
1958 1 41 ILE H 1 41 ILE MG 4.340 . 4.340 3.831 3.768 3.874 . 0 0 "[ . 1 . 2]" 1
1959 1 41 ILE H 1 41 ILE MD 4.520 . 4.520 2.891 2.728 3.056 . 0 0 "[ . 1 . 2]" 1
1960 1 46 LYS H 1 46 LYS QE 5.480 . 5.480 4.772 4.184 5.663 0.183 4 0 "[ . 1 . 2]" 1
1961 1 48 LYS H 1 48 LYS HG3 5.500 . 5.500 3.148 2.818 4.463 . 0 0 "[ . 1 . 2]" 1
1962 1 48 LYS H 1 48 LYS HG2 5.500 . 5.500 4.227 3.944 4.725 . 0 0 "[ . 1 . 2]" 1
1963 1 48 LYS H 1 48 LYS QE 5.500 . 5.500 4.193 2.986 5.531 0.031 5 0 "[ . 1 . 2]" 1
1964 1 48 LYS H 1 48 LYS QD 5.500 . 5.500 4.385 2.799 4.811 . 0 0 "[ . 1 . 2]" 1
1965 1 57 LEU H 1 57 LEU MD1 4.470 . 4.470 4.165 3.704 4.313 . 0 0 "[ . 1 . 2]" 1
1966 1 57 LEU H 1 57 LEU HG 5.470 . 5.470 4.221 2.978 4.533 . 0 0 "[ . 1 . 2]" 1
1967 1 60 GLU H 1 60 GLU QG 4.340 . 4.340 3.714 2.089 4.257 . 0 0 "[ . 1 . 2]" 1
1968 1 62 LYS QE 1 63 HIS H 5.500 . 5.500 5.604 5.539 5.693 0.193 9 0 "[ . 1 . 2]" 1
1969 1 62 LYS QD 1 63 HIS H 4.940 . 4.940 4.210 3.877 4.463 . 0 0 "[ . 1 . 2]" 1
1970 1 32 ILE HG13 1 64 ILE H 4.620 . 4.620 4.000 3.794 4.193 . 0 0 "[ . 1 . 2]" 1
1971 1 66 ILE H 1 69 LEU MD2 3.800 . 3.800 3.838 3.815 3.881 0.081 20 0 "[ . 1 . 2]" 1
1972 1 66 ILE H 1 66 ILE MD 4.330 . 4.330 4.115 4.087 4.164 . 0 0 "[ . 1 . 2]" 1
1973 1 69 LEU H 1 69 LEU MD1 3.480 . 3.480 3.299 3.191 3.352 . 0 0 "[ . 1 . 2]" 1
1974 1 72 ARG H 1 72 ARG QD 4.520 . 4.520 4.053 3.769 4.648 0.128 9 0 "[ . 1 . 2]" 1
1975 1 74 LYS H 1 74 LYS QD 4.510 . 4.510 4.329 3.711 4.542 0.032 18 0 "[ . 1 . 2]" 1
1976 1 74 LYS H 1 74 LYS HG3 4.570 . 4.570 3.869 2.421 4.486 . 0 0 "[ . 1 . 2]" 1
1977 1 74 LYS H 1 74 LYS HG2 4.570 . 4.570 4.218 3.561 4.466 . 0 0 "[ . 1 . 2]" 1
1978 1 74 LYS H 1 74 LYS QE 5.410 . 5.410 4.448 4.009 5.348 . 0 0 "[ . 1 . 2]" 1
1979 1 73 TRP QB 1 76 SER H 4.740 . 4.740 4.357 4.293 4.447 . 0 0 "[ . 1 . 2]" 1
1980 1 77 GLU H 1 77 GLU HG2 3.810 . 3.810 2.259 1.922 3.466 . 0 0 "[ . 1 . 2]" 1
1981 1 83 LEU H 1 83 LEU MD2 5.500 . 5.500 2.668 2.495 2.738 . 0 0 "[ . 1 . 2]" 1
1982 1 83 LEU H 1 86 THR H 5.030 . 5.030 4.711 4.603 4.884 . 0 0 "[ . 1 . 2]" 1
1983 1 81 TRP HA 1 85 ASP H 5.150 . 5.150 5.102 4.691 5.271 0.121 19 0 "[ . 1 . 2]" 1
1984 1 85 ASP H 1 86 THR HB 5.500 . 5.500 4.719 4.459 5.038 . 0 0 "[ . 1 . 2]" 1
1985 1 83 LEU HA 1 85 ASP H 5.500 . 5.500 4.319 4.147 4.516 . 0 0 "[ . 1 . 2]" 1
1986 1 81 TRP QB 1 85 ASP H 5.040 . 5.040 4.338 4.123 4.798 . 0 0 "[ . 1 . 2]" 1
1987 1 84 GLU HG2 1 85 ASP H 4.540 . 4.540 2.818 2.489 3.049 . 0 0 "[ . 1 . 2]" 1
1988 1 84 GLU HB3 1 85 ASP H 3.960 . 3.960 3.994 3.907 4.057 0.097 12 0 "[ . 1 . 2]" 1
1989 1 84 GLU HB2 1 85 ASP H 3.870 . 3.870 3.821 3.700 3.884 0.014 15 0 "[ . 1 . 2]" 1
1990 1 82 THR MG 1 85 ASP H 3.920 . 3.920 2.063 1.907 2.329 . 0 0 "[ . 1 . 2]" 1
1991 1 86 THR H 1 109 LYS HA 4.530 . 4.530 4.208 3.736 4.413 . 0 0 "[ . 1 . 2]" 1
1992 1 81 TRP HA 1 86 THR H 5.060 . 5.060 4.799 4.580 5.019 . 0 0 "[ . 1 . 2]" 1
1993 1 81 TRP QB 1 86 THR H 4.040 . 4.040 2.931 2.635 3.399 . 0 0 "[ . 1 . 2]" 1
1994 1 88 GLN HG3 1 90 LEU H 5.500 . 5.500 5.048 4.749 5.314 . 0 0 "[ . 1 . 2]" 1
1995 1 88 GLN HG2 1 90 LEU H 5.500 . 5.500 5.140 4.905 5.395 . 0 0 "[ . 1 . 2]" 1
1996 1 91 ILE MD 1 96 LEU H 5.500 . 5.500 5.428 5.308 5.549 0.049 10 0 "[ . 1 . 2]" 1
1997 1 97 PRO HG3 1 98 GLN H 4.650 . 4.650 4.582 4.399 4.687 0.037 16 0 "[ . 1 . 2]" 1
1998 1 109 LYS H 1 109 LYS QD 4.280 . 4.280 2.485 2.197 2.899 . 0 0 "[ . 1 . 2]" 1
1999 1 109 LYS H 1 109 LYS HE3 5.180 . 5.180 4.572 2.399 5.240 0.060 12 0 "[ . 1 . 2]" 1
2000 1 109 LYS H 1 109 LYS HE2 5.180 . 5.180 4.611 4.020 5.259 0.079 13 0 "[ . 1 . 2]" 1
2001 1 113 LEU H 1 113 LEU MD2 4.730 . 4.730 2.656 1.706 4.081 . 0 0 "[ . 1 . 2]" 1
2002 1 125 ILE H 1 125 ILE MD 5.500 . 5.500 3.634 3.492 3.824 . 0 0 "[ . 1 . 2]" 1
2003 1 142 LYS H 1 142 LYS QE 5.330 . 5.330 4.967 3.127 5.390 0.060 14 0 "[ . 1 . 2]" 1
2004 1 29 ASP H 1 31 GLY QA 5.410 . 5.410 4.863 4.376 5.195 . 0 0 "[ . 1 . 2]" 1
2005 1 135 HIS QB 1 138 LYS H 5.500 . 5.500 5.114 5.020 5.204 . 0 0 "[ . 1 . 2]" 1
2006 1 138 LYS H 1 138 LYS QE 5.500 . 5.500 5.056 4.624 5.385 . 0 0 "[ . 1 . 2]" 1
2007 1 138 LYS H 1 138 LYS QD 5.120 . 5.120 4.115 3.612 4.252 . 0 0 "[ . 1 . 2]" 1
2008 1 138 LYS H 1 138 LYS HG2 4.990 . 4.990 2.625 2.527 2.735 . 0 0 "[ . 1 . 2]" 1
2009 1 137 GLN H 1 137 GLN HG3 4.450 . 4.450 3.323 3.209 3.562 . 0 0 "[ . 1 . 2]" 1
2010 1 133 ARG HB2 1 134 SER H 3.940 . 3.940 2.437 2.183 2.720 . 0 0 "[ . 1 . 2]" 1
2011 1 133 ARG QG 1 134 SER H 4.740 . 4.740 4.201 3.884 4.478 . 0 0 "[ . 1 . 2]" 1
2012 1 115 ARG H 1 116 ILE HA 4.970 . 4.970 4.889 4.716 4.999 0.029 14 0 "[ . 1 . 2]" 1
2013 1 115 ARG H 1 116 ILE MG 5.500 . 5.500 4.216 4.010 4.431 . 0 0 "[ . 1 . 2]" 1
2014 1 115 ARG H 1 116 ILE HG13 5.500 . 5.500 4.960 4.706 5.243 . 0 0 "[ . 1 . 2]" 1
2015 1 115 ARG H 1 116 ILE MD 5.500 . 5.500 5.545 5.508 5.633 0.133 18 0 "[ . 1 . 2]" 1
2016 1 117 ALA H 1 140 GLN HA 5.200 . 5.200 5.128 4.622 5.410 0.210 7 0 "[ . 1 . 2]" 1
2017 1 101 LYS QE 1 102 ASN H 3.700 . 3.700 3.365 3.123 3.552 . 0 0 "[ . 1 . 2]" 1
2018 1 102 ASN H 1 102 ASN HB2 4.000 . 4.000 2.507 2.410 2.669 . 0 0 "[ . 1 . 2]" 1
2019 1 102 ASN H 1 102 ASN HB3 4.000 . 4.000 3.620 3.582 3.685 . 0 0 "[ . 1 . 2]" 1
2020 1 32 ILE MD 1 65 THR H 5.500 . 5.500 5.093 4.866 5.351 . 0 0 "[ . 1 . 2]" 1
2021 1 25 ASP HB3 1 31 GLY H 5.500 . 5.500 4.337 4.055 4.615 . 0 0 "[ . 1 . 2]" 1
2022 1 7 THR H 1 9 GLU H 5.500 . 5.500 4.906 4.676 5.227 . 0 0 "[ . 1 . 2]" 1
2023 1 10 ASP H 1 11 ARG HA 5.350 . 5.350 5.057 4.962 5.236 . 0 0 "[ . 1 . 2]" 1
2024 1 47 TYR H 1 47 TYR QE 5.500 . 5.500 4.418 4.029 5.458 . 0 0 "[ . 1 . 2]" 1
2025 1 21 HIS H 1 21 HIS HD2 5.360 . 5.360 5.211 5.134 5.288 . 0 0 "[ . 1 . 2]" 1
2026 1 73 TRP H 1 73 TRP HD1 5.370 . 5.370 3.772 3.692 3.839 . 0 0 "[ . 1 . 2]" 1
2027 1 7 THR HA 1 8 GLU QG 3.810 . 3.810 3.843 3.756 3.901 0.091 17 0 "[ . 1 . 2]" 1
2028 1 7 THR HB 1 9 GLU QB 4.630 . 4.630 4.322 4.017 4.702 0.072 18 0 "[ . 1 . 2]" 1
2029 1 7 THR HB 1 10 ASP QB 4.200 . 4.200 3.467 2.924 4.026 . 0 0 "[ . 1 . 2]" 1
2030 1 7 THR MG 1 8 GLU QG 4.030 . 4.030 3.830 3.458 4.062 0.032 18 0 "[ . 1 . 2]" 1
2031 1 7 THR MG 1 9 GLU QB 3.750 . 3.750 3.232 2.920 3.411 . 0 0 "[ . 1 . 2]" 1
2032 1 7 THR MG 1 10 ASP QB 4.960 . 4.960 4.604 4.282 4.965 0.005 12 0 "[ . 1 . 2]" 1
2033 1 8 GLU HA 1 8 GLU QG 2.930 . 2.930 2.641 2.289 2.978 0.048 4 0 "[ . 1 . 2]" 1
2034 1 9 GLU H 1 9 GLU QB 3.210 . 3.210 2.564 2.431 2.668 . 0 0 "[ . 1 . 2]" 1
2035 1 9 GLU QB 1 10 ASP H 3.910 . 3.910 3.609 3.485 3.738 . 0 0 "[ . 1 . 2]" 1
2036 1 9 GLU QB 1 12 PHE QD 4.750 . 4.750 4.189 3.386 4.777 0.027 18 0 "[ . 1 . 2]" 1
2037 1 9 GLU QG 1 10 ASP QB 5.330 . 5.330 4.083 3.237 4.642 . 0 0 "[ . 1 . 2]" 1
2038 1 10 ASP H 1 10 ASP QB 3.230 . 3.230 2.560 2.437 2.824 . 0 0 "[ . 1 . 2]" 1
2039 1 10 ASP QB 1 11 ARG H 3.830 . 3.830 2.597 2.297 3.544 . 0 0 "[ . 1 . 2]" 1
2040 1 10 ASP QB 1 11 ARG HA 4.210 . 4.210 3.824 3.687 4.288 0.078 1 0 "[ . 1 . 2]" 1
2041 1 10 ASP QB 1 12 PHE H 4.960 . 4.960 4.635 4.494 4.970 0.010 1 0 "[ . 1 . 2]" 1
2042 1 10 ASP QB 1 14 LEU H 4.880 . 4.880 3.752 3.337 4.144 . 0 0 "[ . 1 . 2]" 1
2043 1 10 ASP QB 1 14 LEU HA 5.290 . 5.290 4.988 4.642 5.312 0.022 8 0 "[ . 1 . 2]" 1
2044 1 10 ASP QB 1 14 LEU HG 4.120 . 4.120 4.119 3.470 4.213 0.093 9 0 "[ . 1 . 2]" 1
2045 1 10 ASP QB 1 14 LEU QD 3.910 . 3.910 2.545 2.306 3.606 . 0 0 "[ . 1 . 2]" 1
2046 1 11 ARG HG3 1 15 GLU QG 4.020 . 4.020 3.145 2.282 4.032 0.012 18 0 "[ . 1 . 2]" 1
2047 1 12 PHE QB 1 13 SER QB 4.150 . 4.150 4.035 3.286 4.223 0.073 3 0 "[ . 1 . 2]" 1
2048 1 13 SER H 1 13 SER QB 3.380 . 3.380 2.447 2.280 2.549 . 0 0 "[ . 1 . 2]" 1
2049 1 13 SER QB 1 14 LEU HB2 4.480 . 4.480 3.953 3.600 4.259 . 0 0 "[ . 1 . 2]" 1
2050 1 14 LEU H 1 14 LEU QD 3.830 . 3.830 3.759 3.601 3.820 . 0 0 "[ . 1 . 2]" 1
2051 1 14 LEU H 1 15 GLU QG 5.340 . 5.340 4.266 3.915 4.672 . 0 0 "[ . 1 . 2]" 1
2052 1 14 LEU HA 1 14 LEU QD 2.910 . 2.910 2.096 2.014 2.148 . 0 0 "[ . 1 . 2]" 1
2053 1 14 LEU HA 1 17 LEU QB 4.000 . 4.000 3.087 2.845 3.255 . 0 0 "[ . 1 . 2]" 1
2054 1 14 LEU HA 1 17 LEU QD 4.160 . 4.160 3.641 3.450 3.821 . 0 0 "[ . 1 . 2]" 1
2055 1 14 LEU HB2 1 15 GLU QG 5.340 . 5.340 4.825 4.449 5.044 . 0 0 "[ . 1 . 2]" 1
2056 1 14 LEU HG 1 15 GLU QG 5.150 . 5.150 3.907 3.409 4.864 . 0 0 "[ . 1 . 2]" 1
2057 1 14 LEU QD 1 15 GLU H 4.420 . 4.420 3.811 3.494 3.931 . 0 0 "[ . 1 . 2]" 1
2058 1 14 LEU QD 1 15 GLU HA 5.190 . 5.190 4.020 3.228 4.219 . 0 0 "[ . 1 . 2]" 1
2059 1 14 LEU QD 1 15 GLU QB 5.440 . 5.440 4.854 4.519 4.955 . 0 0 "[ . 1 . 2]" 1
2060 1 14 LEU QD 1 15 GLU QG 3.790 . 3.790 3.807 3.578 3.912 0.122 8 0 "[ . 1 . 2]" 1
2061 1 14 LEU QD 1 17 LEU QB 3.750 . 3.750 3.340 3.005 3.657 . 0 0 "[ . 1 . 2]" 1
2062 1 14 LEU QD 1 18 GLN H 4.810 . 4.810 3.735 3.379 3.950 . 0 0 "[ . 1 . 2]" 1
2063 1 14 LEU QD 1 18 GLN HA 4.760 . 4.760 4.274 3.927 4.510 . 0 0 "[ . 1 . 2]" 1
2064 1 14 LEU QD 1 18 GLN QB 4.380 . 4.380 2.961 2.087 3.255 . 0 0 "[ . 1 . 2]" 1
2065 1 14 LEU QD 1 66 ILE MG 4.260 . 4.260 4.214 4.093 4.426 0.166 20 0 "[ . 1 . 2]" 1
2066 1 14 LEU QD 1 66 ILE MD 3.170 . 3.170 2.969 2.841 3.171 0.001 20 0 "[ . 1 . 2]" 1
2067 1 14 LEU QD 1 70 TRP HA 5.440 . 5.440 5.469 4.940 5.571 0.131 15 0 "[ . 1 . 2]" 1
2068 1 14 LEU QD 1 70 TRP HD1 3.850 . 3.850 3.331 3.150 3.695 . 0 0 "[ . 1 . 2]" 1
2069 1 14 LEU QD 1 70 TRP HE1 4.070 . 4.070 2.011 1.760 2.555 . 0 0 "[ . 1 . 2]" 1
2070 1 15 GLU H 1 15 GLU QG 3.270 . 3.270 2.338 2.100 2.545 . 0 0 "[ . 1 . 2]" 1
2071 1 15 GLU H 1 18 GLN QB 4.970 . 4.970 4.295 4.033 4.419 . 0 0 "[ . 1 . 2]" 1
2072 1 15 GLU HA 1 15 GLU QG 3.040 . 3.040 2.600 2.194 2.895 . 0 0 "[ . 1 . 2]" 1
2073 1 15 GLU HA 1 18 GLN QB 3.540 . 3.540 2.225 1.877 2.422 . 0 0 "[ . 1 . 2]" 1
2074 1 15 GLU QG 1 16 ALA H 4.720 . 4.720 4.264 4.118 4.386 . 0 0 "[ . 1 . 2]" 1
2075 1 15 GLU QG 1 18 GLN HE22 4.020 . 4.020 3.488 2.100 4.059 0.039 7 0 "[ . 1 . 2]" 1
2076 1 16 ALA HA 1 17 LEU QD 4.530 . 4.530 4.600 4.547 4.645 0.115 19 0 "[ . 1 . 2]" 1
2077 1 16 ALA MB 1 17 LEU QD 3.650 . 3.650 2.869 2.789 2.966 . 0 0 "[ . 1 . 2]" 1
2078 1 16 ALA MB 1 118 VAL QG 4.260 . 4.260 3.530 2.262 4.303 0.043 19 0 "[ . 1 . 2]" 1
2079 1 17 LEU H 1 17 LEU QB 3.080 . 3.080 2.531 2.511 2.565 . 0 0 "[ . 1 . 2]" 1
2080 1 17 LEU H 1 17 LEU QD 3.560 . 3.560 2.834 2.771 2.881 . 0 0 "[ . 1 . 2]" 1
2081 1 17 LEU HA 1 17 LEU QD 2.970 . 2.970 2.027 1.997 2.082 . 0 0 "[ . 1 . 2]" 1
2082 1 17 LEU HA 1 20 ILE QG 3.650 . 3.650 2.002 1.952 2.074 . 0 0 "[ . 1 . 2]" 1
2083 1 17 LEU HA 1 21 HIS QB 5.340 . 5.340 4.558 4.355 4.756 . 0 0 "[ . 1 . 2]" 1
2084 1 17 LEU QB 1 17 LEU QD 2.570 . 2.570 1.995 1.981 2.011 . 0 0 "[ . 1 . 2]" 1
2085 1 17 LEU QB 1 18 GLN H 3.940 . 3.940 2.862 2.804 2.928 . 0 0 "[ . 1 . 2]" 1
2086 1 17 LEU QB 1 20 ILE MD 4.520 . 4.520 3.159 2.952 3.339 . 0 0 "[ . 1 . 2]" 1
2087 1 17 LEU QB 1 70 TRP HE1 4.280 . 4.280 2.460 2.281 2.739 . 0 0 "[ . 1 . 2]" 1
2088 1 17 LEU QB 1 73 TRP HE1 5.220 . 5.220 3.940 3.657 4.215 . 0 0 "[ . 1 . 2]" 1
2089 1 17 LEU QB 1 147 VAL QG 5.070 . 5.070 4.370 4.225 4.550 . 0 0 "[ . 1 . 2]" 1
2090 1 17 LEU QD 1 18 GLN H 4.200 . 4.200 4.159 4.097 4.199 . 0 0 "[ . 1 . 2]" 1
2091 1 17 LEU QD 1 19 THR H 5.440 . 5.440 5.137 5.001 5.269 . 0 0 "[ . 1 . 2]" 1
2092 1 17 LEU QD 1 20 ILE QG 5.120 . 5.120 3.120 3.034 3.218 . 0 0 "[ . 1 . 2]" 1
2093 1 17 LEU QD 1 70 TRP H 4.400 . 4.400 3.494 3.207 3.734 . 0 0 "[ . 1 . 2]" 1
2094 1 17 LEU QD 1 70 TRP HA 3.470 . 3.470 2.313 2.163 2.480 . 0 0 "[ . 1 . 2]" 1
2095 1 17 LEU QD 1 70 TRP HD1 3.270 . 3.270 2.630 2.051 2.862 . 0 0 "[ . 1 . 2]" 1
2096 1 17 LEU QD 1 71 LYS H 5.200 . 5.200 5.020 4.840 5.210 0.010 9 0 "[ . 1 . 2]" 1
2097 1 17 LEU QD 1 73 TRP H 4.130 . 4.130 4.124 3.987 4.178 0.048 6 0 "[ . 1 . 2]" 1
2098 1 17 LEU QD 1 73 TRP QB 3.390 . 3.390 3.040 2.840 3.146 . 0 0 "[ . 1 . 2]" 1
2099 1 17 LEU QD 1 73 TRP HE1 4.430 . 4.430 2.682 2.361 3.102 . 0 0 "[ . 1 . 2]" 1
2100 1 17 LEU QD 1 74 LYS H 4.640 . 4.640 4.616 4.446 4.710 0.070 10 0 "[ . 1 . 2]" 1
2101 1 17 LEU QD 1 114 PRO HA 3.820 . 3.820 3.320 3.069 3.631 . 0 0 "[ . 1 . 2]" 1
2102 1 17 LEU QD 1 147 VAL QG 3.110 . 3.110 2.202 2.054 2.372 . 0 0 "[ . 1 . 2]" 1
2103 1 18 GLN H 1 18 GLN QB 3.130 . 3.130 2.190 2.099 2.227 . 0 0 "[ . 1 . 2]" 1
2104 1 18 GLN HA 1 18 GLN QB 2.600 . 2.600 2.370 2.323 2.447 . 0 0 "[ . 1 . 2]" 1
2105 1 18 GLN HA 1 21 HIS QB 3.220 . 3.220 2.396 2.176 2.611 . 0 0 "[ . 1 . 2]" 1
2106 1 18 GLN HA 1 66 ILE QG 3.780 . 3.780 3.629 3.434 3.738 . 0 0 "[ . 1 . 2]" 1
2107 1 18 GLN QB 1 18 GLN HE21 3.180 . 3.180 1.746 1.654 1.844 . 0 0 "[ . 1 . 2]" 1
2108 1 18 GLN QB 1 18 GLN HE22 3.670 . 3.670 3.124 3.064 3.170 . 0 0 "[ . 1 . 2]" 1
2109 1 18 GLN QB 1 21 HIS QB 5.180 . 5.180 4.318 4.129 4.512 . 0 0 "[ . 1 . 2]" 1
2110 1 18 GLN QB 1 66 ILE QG 4.200 . 4.200 3.806 3.604 4.037 . 0 0 "[ . 1 . 2]" 1
2111 1 18 GLN QB 1 66 ILE MD 3.400 . 3.400 2.583 2.393 2.765 . 0 0 "[ . 1 . 2]" 1
2112 1 19 THR H 1 21 HIS QB 5.310 . 5.310 4.661 4.499 4.814 . 0 0 "[ . 1 . 2]" 1
2113 1 19 THR MG 1 23 GLN QG 4.260 . 4.260 2.564 2.403 2.959 . 0 0 "[ . 1 . 2]" 1
2114 1 20 ILE H 1 20 ILE QG 3.490 . 3.490 1.862 1.807 1.946 . 0 0 "[ . 1 . 2]" 1
2115 1 20 ILE H 1 21 HIS QB 5.340 . 5.340 4.353 4.202 4.470 . 0 0 "[ . 1 . 2]" 1
2116 1 20 ILE HA 1 23 GLN QG 3.950 . 3.950 2.621 2.038 3.393 . 0 0 "[ . 1 . 2]" 1
2117 1 20 ILE HA 1 144 LEU QD 5.440 . 5.440 4.051 3.828 4.196 . 0 0 "[ . 1 . 2]" 1
2118 1 20 ILE HA 1 148 LEU QD 4.590 . 4.590 3.808 3.511 4.207 . 0 0 "[ . 1 . 2]" 1
2119 1 20 ILE HB 1 20 ILE QG 2.590 . 2.590 2.330 2.310 2.342 . 0 0 "[ . 1 . 2]" 1
2120 1 20 ILE HB 1 148 LEU QD 3.470 . 3.470 2.050 1.809 2.382 . 0 0 "[ . 1 . 2]" 1
2121 1 20 ILE MG 1 23 GLN QG 5.270 . 5.270 3.551 3.036 4.382 . 0 0 "[ . 1 . 2]" 1
2122 1 20 ILE MG 1 144 LEU QD 3.290 . 3.290 1.900 1.742 2.071 . 0 0 "[ . 1 . 2]" 1
2123 1 20 ILE QG 1 21 HIS QB 3.970 . 3.970 3.231 3.191 3.275 . 0 0 "[ . 1 . 2]" 1
2124 1 20 ILE QG 1 22 LYS H 5.030 . 5.030 4.543 4.435 4.632 . 0 0 "[ . 1 . 2]" 1
2125 1 20 ILE QG 1 69 LEU MD2 4.830 . 4.830 4.172 3.983 4.366 . 0 0 "[ . 1 . 2]" 1
2126 1 20 ILE QG 1 73 TRP HE1 4.510 . 4.510 4.133 3.954 4.325 . 0 0 "[ . 1 . 2]" 1
2127 1 20 ILE QG 1 148 LEU QD 4.840 . 4.840 2.824 2.615 2.948 . 0 0 "[ . 1 . 2]" 1
2128 1 20 ILE MD 1 21 HIS QB 4.400 . 4.400 4.423 4.396 4.451 0.051 19 0 "[ . 1 . 2]" 1
2129 1 20 ILE MD 1 144 LEU QD 3.360 . 3.360 3.135 2.433 3.395 0.035 18 0 "[ . 1 . 2]" 1
2130 1 20 ILE MD 1 147 VAL QG 3.220 . 3.220 2.236 2.087 2.395 . 0 0 "[ . 1 . 2]" 1
2131 1 21 HIS QB 1 32 ILE HG12 5.180 . 5.180 4.817 4.696 5.007 . 0 0 "[ . 1 . 2]" 1
2132 1 21 HIS QB 1 32 ILE HG13 5.010 . 5.010 4.704 4.581 4.873 . 0 0 "[ . 1 . 2]" 1
2133 1 21 HIS QB 1 32 ILE MD 3.570 . 3.570 3.094 2.895 3.183 . 0 0 "[ . 1 . 2]" 1
2134 1 21 HIS QB 1 66 ILE HA 4.280 . 4.280 3.045 2.899 3.157 . 0 0 "[ . 1 . 2]" 1
2135 1 21 HIS QB 1 66 ILE HB 4.760 . 4.760 3.890 3.710 4.089 . 0 0 "[ . 1 . 2]" 1
2136 1 21 HIS QB 1 69 LEU HG 4.100 . 4.100 2.726 2.623 2.820 . 0 0 "[ . 1 . 2]" 1
2137 1 21 HIS QB 1 69 LEU MD2 3.900 . 3.900 2.227 2.117 2.336 . 0 0 "[ . 1 . 2]" 1
2138 1 21 HIS QB 1 148 LEU QD 4.630 . 4.630 4.733 4.661 4.800 0.170 9 0 "[ . 1 . 2]" 1
2139 1 22 LYS H 1 23 GLN QG 4.740 . 4.740 4.346 4.079 4.545 . 0 0 "[ . 1 . 2]" 1
2140 1 22 LYS HB2 1 28 LYS QE 3.980 . 3.980 3.317 3.113 3.535 . 0 0 "[ . 1 . 2]" 1
2141 1 22 LYS HB3 1 28 LYS QE 4.810 . 4.810 4.833 4.587 4.927 0.117 1 0 "[ . 1 . 2]" 1
2142 1 23 GLN H 1 23 GLN QG 3.360 . 3.360 2.367 2.229 2.505 . 0 0 "[ . 1 . 2]" 1
2143 1 23 GLN QG 1 24 MET H 4.800 . 4.800 4.177 3.949 4.352 . 0 0 "[ . 1 . 2]" 1
2144 1 23 GLN QG 1 40 PHE QD 3.890 . 3.890 3.740 3.227 3.925 0.035 7 0 "[ . 1 . 2]" 1
2145 1 24 MET QG 1 40 PHE QB 3.970 . 3.970 2.170 1.957 2.373 . 0 0 "[ . 1 . 2]" 1
2146 1 24 MET QG 1 148 LEU QD 4.080 . 4.080 3.396 3.235 3.650 . 0 0 "[ . 1 . 2]" 1
2147 1 24 MET ME 1 40 PHE QB 3.530 . 3.530 2.684 2.258 2.942 . 0 0 "[ . 1 . 2]" 1
2148 1 24 MET ME 1 148 LEU QD 2.530 . 2.530 1.741 1.678 1.807 . 0 0 "[ . 1 . 2]" 1
2149 1 26 ASP H 1 26 ASP QB 2.880 . 2.880 2.331 2.273 2.382 . 0 0 "[ . 1 . 2]" 1
2150 1 26 ASP QB 1 27 ASP H 2.780 . 2.780 2.719 2.560 2.840 0.060 11 0 "[ . 1 . 2]" 1
2151 1 27 ASP H 1 27 ASP QB 3.120 . 3.120 2.799 2.532 3.047 . 0 0 "[ . 1 . 2]" 1
2152 1 27 ASP QB 1 28 LYS HA 5.340 . 5.340 5.237 4.997 5.403 0.063 2 0 "[ . 1 . 2]" 1
2153 1 28 LYS HA 1 28 LYS QE 4.710 . 4.710 4.446 4.189 4.583 . 0 0 "[ . 1 . 2]" 1
2154 1 28 LYS QB 1 28 LYS QE . . 3.320 2.117 1.954 2.316 . 0 0 "[ . 1 . 2]" 1
2155 1 28 LYS QE 1 28 LYS QG 2.930 . 2.930 2.295 2.127 2.703 . 0 0 "[ . 1 . 2]" 1
2156 1 30 GLY QA 1 31 GLY H 3.100 . 3.100 2.671 2.571 2.736 . 0 0 "[ . 1 . 2]" 1
2157 1 30 GLY QA 1 65 THR MG 4.230 . 4.230 2.002 1.805 2.594 . 0 0 "[ . 1 . 2]" 1
2158 1 32 ILE HB 1 64 ILE QG 5.340 . 5.340 3.334 2.845 3.691 . 0 0 "[ . 1 . 2]" 1
2159 1 32 ILE MD 1 64 ILE QG 5.340 . 5.340 3.853 3.477 4.186 . 0 0 "[ . 1 . 2]" 1
2160 1 32 ILE MD 1 148 LEU QD 4.540 . 4.540 3.840 3.606 4.069 . 0 0 "[ . 1 . 2]" 1
2161 1 33 GLU HA 1 34 VAL QG 4.170 . 4.170 3.882 3.716 4.081 . 0 0 "[ . 1 . 2]" 1
2162 1 34 VAL H 1 34 VAL QG 3.250 . 3.250 2.169 1.981 2.374 . 0 0 "[ . 1 . 2]" 1
2163 1 34 VAL HA 1 58 HIS QB 5.050 . 5.050 4.011 3.597 4.546 . 0 0 "[ . 1 . 2]" 1
2164 1 34 VAL HB 1 58 HIS QB 4.530 . 4.530 3.560 2.840 4.468 . 0 0 "[ . 1 . 2]" 1
2165 1 34 VAL QG 1 35 GLU H 3.210 . 3.210 2.309 2.116 2.461 . 0 0 "[ . 1 . 2]" 1
2166 1 34 VAL QG 1 35 GLU HA 3.650 . 3.650 3.153 3.080 3.280 . 0 0 "[ . 1 . 2]" 1
2167 1 34 VAL QG 1 35 GLU QG 3.720 . 3.720 2.379 2.069 2.790 . 0 0 "[ . 1 . 2]" 1
2168 1 34 VAL QG 1 36 GLU H 4.310 . 4.310 4.160 4.038 4.342 0.032 13 0 "[ . 1 . 2]" 1
2169 1 34 VAL QG 1 36 GLU QB 5.440 . 5.440 5.248 5.077 5.447 0.007 13 0 "[ . 1 . 2]" 1
2170 1 34 VAL QG 1 38 ASP QB 4.390 . 4.390 3.431 3.089 3.632 . 0 0 "[ . 1 . 2]" 1
2171 1 34 VAL QG 1 58 HIS HA 5.280 . 5.280 4.626 4.273 5.291 0.011 10 0 "[ . 1 . 2]" 1
2172 1 34 VAL QG 1 58 HIS QB 3.490 . 3.490 2.457 2.053 3.058 . 0 0 "[ . 1 . 2]" 1
2173 1 34 VAL QG 1 62 LYS HA 4.130 . 4.130 3.832 3.460 4.134 0.004 2 0 "[ . 1 . 2]" 1
2174 1 34 VAL QG 1 62 LYS QG 3.880 . 3.880 2.894 2.411 3.775 . 0 0 "[ . 1 . 2]" 1
2175 1 34 VAL MG2 1 62 LYS HG3 6.140 . 6.140 4.410 3.880 4.742 . 0 0 "[ . 1 . 2]" 1
2176 1 34 VAL QG 1 62 LYS QD 3.160 . 3.160 2.364 2.029 2.586 . 0 0 "[ . 1 . 2]" 1
2177 1 34 VAL QG 1 62 LYS QE 3.400 . 3.400 2.670 2.245 2.983 . 0 0 "[ . 1 . 2]" 1
2178 1 38 ASP HA 1 41 ILE QG 3.880 . 3.880 2.577 2.311 2.760 . 0 0 "[ . 1 . 2]" 1
2179 1 39 GLU QG 1 40 PHE QB 4.830 . 4.830 4.328 3.902 4.596 . 0 0 "[ . 1 . 2]" 1
2180 1 40 PHE HA 1 44 ASP QB 3.910 . 3.910 3.831 3.544 3.960 0.050 16 0 "[ . 1 . 2]" 1
2181 1 40 PHE QB 1 41 ILE H 4.220 . 4.220 2.785 2.602 2.902 . 0 0 "[ . 1 . 2]" 1
2182 1 40 PHE QB 1 41 ILE QG 5.180 . 5.180 3.603 3.354 3.707 . 0 0 "[ . 1 . 2]" 1
2183 1 40 PHE QB 1 41 ILE MD 4.470 . 4.470 3.186 2.883 3.439 . 0 0 "[ . 1 . 2]" 1
2184 1 40 PHE QB 1 42 ARG H 5.200 . 5.200 4.774 4.623 4.915 . 0 0 "[ . 1 . 2]" 1
2185 1 40 PHE QB 1 148 LEU QD 5.280 . 5.280 4.070 3.712 4.219 . 0 0 "[ . 1 . 2]" 1
2186 1 40 PHE QD 1 41 ILE QG 5.130 . 5.130 4.639 4.219 5.041 . 0 0 "[ . 1 . 2]" 1
2187 1 40 PHE QD 1 148 LEU QD 3.480 . 3.480 2.569 2.305 2.731 . 0 0 "[ . 1 . 2]" 1
2188 1 41 ILE H 1 41 ILE QG 3.500 . 3.500 2.033 1.967 2.106 . 0 0 "[ . 1 . 2]" 1
2189 1 41 ILE MG 1 49 ASP QB 3.440 . 3.440 3.571 3.494 3.640 0.200 10 0 "[ . 1 . 2]" 1
2190 1 41 ILE QG 1 42 ARG H 5.000 . 5.000 3.752 3.644 3.834 . 0 0 "[ . 1 . 2]" 1
2191 1 41 ILE QG 1 45 MET QB 4.470 . 4.470 4.062 3.882 4.176 . 0 0 "[ . 1 . 2]" 1
2192 1 41 ILE QG 1 50 ALA HA 5.340 . 5.340 4.806 4.356 5.355 0.015 9 0 "[ . 1 . 2]" 1
2193 1 41 ILE MD 1 49 ASP QB 5.340 . 5.340 5.168 4.857 5.358 0.018 7 0 "[ . 1 . 2]" 1
2194 1 41 ILE MD 1 57 LEU QD 5.230 . 5.230 4.171 3.192 5.051 . 0 0 "[ . 1 . 2]" 1
2195 1 42 ARG H 1 42 ARG QD 4.540 . 4.540 3.645 3.440 4.126 . 0 0 "[ . 1 . 2]" 1
2196 1 42 ARG HA 1 42 ARG QD 3.750 . 3.750 2.062 1.853 3.567 . 0 0 "[ . 1 . 2]" 1
2197 1 42 ARG QB 1 42 ARG QD 3.350 . 3.350 2.448 2.138 2.881 . 0 0 "[ . 1 . 2]" 1
2198 1 42 ARG QD 1 46 LYS QB 5.180 . 5.180 4.368 3.620 5.072 . 0 0 "[ . 1 . 2]" 1
2199 1 42 ARG QD 1 50 ALA MB 4.800 . 4.800 2.949 1.991 4.960 0.160 6 0 "[ . 1 . 2]" 1
2200 1 43 GLU H 1 43 GLU QG 4.130 . 4.130 4.164 4.056 4.197 0.067 8 0 "[ . 1 . 2]" 1
2201 1 43 GLU HA 1 43 GLU QG 3.140 . 3.140 2.901 2.410 3.119 . 0 0 "[ . 1 . 2]" 1
2202 1 43 GLU HA 1 46 LYS QB 3.180 . 3.180 1.996 1.787 2.188 . 0 0 "[ . 1 . 2]" 1
2203 1 43 GLU HA 1 46 LYS QD 3.440 . 3.440 2.516 1.942 3.038 . 0 0 "[ . 1 . 2]" 1
2204 1 43 GLU HB2 1 43 GLU QG 2.610 . 2.610 2.332 2.286 2.409 . 0 0 "[ . 1 . 2]" 1
2205 1 43 GLU HB3 1 43 GLU QG 2.510 . 2.510 2.173 2.137 2.359 . 0 0 "[ . 1 . 2]" 1
2206 1 43 GLU QG 1 44 ASP H 3.790 . 3.790 3.227 3.042 3.506 . 0 0 "[ . 1 . 2]" 1
2207 1 43 GLU QG 1 44 ASP HA 4.030 . 4.030 3.435 3.034 3.680 . 0 0 "[ . 1 . 2]" 1
2208 1 44 ASP H 1 44 ASP QB 3.200 . 3.200 2.331 2.107 2.444 . 0 0 "[ . 1 . 2]" 1
2209 1 45 MET QG 1 145 ASP QB 5.340 . 5.340 5.333 5.057 5.455 0.115 17 0 "[ . 1 . 2]" 1
2210 1 45 MET QG 1 148 LEU QD 4.100 . 4.100 2.917 2.628 3.274 . 0 0 "[ . 1 . 2]" 1
2211 1 45 MET ME 1 48 LYS QG 5.340 . 5.340 4.330 3.700 5.016 . 0 0 "[ . 1 . 2]" 1
2212 1 45 MET ME 1 144 LEU QD 2.610 . 2.610 2.179 1.996 2.645 0.035 17 0 "[ . 1 . 2]" 1
2213 1 45 MET ME 1 148 LEU QD 3.440 . 3.440 3.044 2.478 3.478 0.038 19 0 "[ . 1 . 2]" 1
2214 1 46 LYS H 1 46 LYS QB 3.290 . 3.290 2.205 2.078 2.304 . 0 0 "[ . 1 . 2]" 1
2215 1 46 LYS H 1 46 LYS QD 4.670 . 4.670 4.415 3.760 4.674 0.004 17 0 "[ . 1 . 2]" 1
2216 1 46 LYS QB 1 46 LYS QD 2.430 . 2.430 2.202 2.030 2.339 . 0 0 "[ . 1 . 2]" 1
2217 1 46 LYS QB 1 46 LYS QE 3.380 . 3.380 2.431 1.880 3.424 0.044 18 0 "[ . 1 . 2]" 1
2218 1 46 LYS QB 1 47 TYR H 3.540 . 3.540 2.604 2.403 2.967 . 0 0 "[ . 1 . 2]" 1
2219 1 46 LYS QB 1 50 ALA HA 4.760 . 4.760 4.215 3.313 4.705 . 0 0 "[ . 1 . 2]" 1
2220 1 46 LYS QB 1 50 ALA MB 4.560 . 4.560 3.345 2.601 3.778 . 0 0 "[ . 1 . 2]" 1
2221 1 47 TYR H 1 47 TYR QB 3.130 . 3.130 2.576 2.048 2.819 . 0 0 "[ . 1 . 2]" 1
2222 1 47 TYR QB 1 141 LEU HG 5.340 . 5.340 5.128 4.272 5.438 0.098 3 0 "[ . 1 . 2]" 1
2223 1 47 TYR QB 1 141 LEU QD 3.730 . 3.730 2.585 1.966 2.822 . 0 0 "[ . 1 . 2]" 1
2224 1 47 TYR QD 1 141 LEU QD 3.640 . 3.640 2.687 2.076 3.118 . 0 0 "[ . 1 . 2]" 1
2225 1 47 TYR QE 1 141 LEU QD 3.690 . 3.690 3.669 3.111 3.787 0.097 9 0 "[ . 1 . 2]" 1
2226 1 48 LYS H 1 48 LYS QG 4.810 . 4.810 3.057 2.773 4.081 . 0 0 "[ . 1 . 2]" 1
2227 1 48 LYS QB 1 141 LEU QD 5.440 . 5.440 4.181 2.899 4.716 . 0 0 "[ . 1 . 2]" 1
2228 1 48 LYS QB 1 145 ASP QB 4.800 . 4.800 3.696 2.913 4.478 . 0 0 "[ . 1 . 2]" 1
2229 1 48 LYS QG 1 49 ASP H 4.800 . 4.800 4.033 3.539 4.324 . 0 0 "[ . 1 . 2]" 1
2230 1 48 LYS QD 1 145 ASP QB 2.850 . 2.850 2.235 1.908 2.968 0.118 18 0 "[ . 1 . 2]" 1
2231 1 48 LYS QE 1 141 LEU QD 5.390 . 5.390 3.382 2.126 4.361 . 0 0 "[ . 1 . 2]" 1
2232 1 49 ASP QB 1 50 ALA H 4.470 . 4.470 3.026 2.339 3.624 . 0 0 "[ . 1 . 2]" 1
2233 1 49 ASP QB 1 50 ALA HA 5.150 . 5.150 4.055 3.789 4.299 . 0 0 "[ . 1 . 2]" 1
2234 1 57 LEU H 1 57 LEU QD 3.900 . 3.900 3.744 3.406 3.832 . 0 0 "[ . 1 . 2]" 1
2235 1 57 LEU QD 1 58 HIS HA 5.260 . 5.260 3.841 3.149 4.742 . 0 0 "[ . 1 . 2]" 1
2236 1 57 LEU QD 1 58 HIS QB 5.280 . 5.280 4.379 3.678 5.060 . 0 0 "[ . 1 . 2]" 1
2237 1 57 LEU QD 1 64 ILE MG 3.280 . 3.280 3.317 3.160 3.394 0.114 8 0 "[ . 1 . 2]" 1
2238 1 57 LEU QD 1 64 ILE QG 4.420 . 4.420 3.230 2.714 3.734 . 0 0 "[ . 1 . 2]" 1
2239 1 57 LEU QD 1 64 ILE MD 2.770 . 2.770 1.919 1.775 2.148 . 0 0 "[ . 1 . 2]" 1
2240 1 57 LEU QD 1 72 ARG QG 4.170 . 4.170 3.253 2.681 3.763 . 0 0 "[ . 1 . 2]" 1
2241 1 57 LEU QD 1 72 ARG QD 4.660 . 4.660 3.005 2.477 3.816 . 0 0 "[ . 1 . 2]" 1
2242 1 58 HIS HA 1 64 ILE QG 5.180 . 5.180 4.689 4.088 5.196 0.016 4 0 "[ . 1 . 2]" 1
2243 1 58 HIS QB 1 59 ARG H 4.100 . 4.100 3.587 3.278 3.911 . 0 0 "[ . 1 . 2]" 1
2244 1 58 HIS QB 1 62 LYS QG 4.650 . 4.650 2.298 1.753 4.172 . 0 0 "[ . 1 . 2]" 1
2245 1 58 HIS QB 1 62 LYS QD 4.030 . 4.030 3.750 1.994 4.071 0.041 3 0 "[ . 1 . 2]" 1
2246 1 59 ARG HA 1 60 GLU QB 5.340 . 5.340 4.805 4.536 5.264 . 0 0 "[ . 1 . 2]" 1
2247 1 59 ARG QG 1 60 GLU QB 3.250 . 3.250 3.156 2.378 3.371 0.121 7 0 "[ . 1 . 2]" 1
2248 1 59 ARG QD 1 60 GLU QB 3.020 . 3.020 2.215 1.896 3.132 0.112 9 0 "[ . 1 . 2]" 1
2249 1 60 GLU H 1 60 GLU QB 3.340 . 3.340 2.690 2.251 3.065 . 0 0 "[ . 1 . 2]" 1
2250 1 60 GLU QB 1 60 GLU QG 2.400 . 2.400 2.044 1.959 2.090 . 0 0 "[ . 1 . 2]" 1
2251 1 60 GLU QB 1 61 ASP H 3.740 . 3.740 2.548 1.969 3.590 . 0 0 "[ . 1 . 2]" 1
2252 1 60 GLU QB 1 61 ASP HA 4.720 . 4.720 4.223 3.501 4.777 0.057 2 0 "[ . 1 . 2]" 1
2253 1 61 ASP QB 1 62 LYS HA 5.340 . 5.340 4.434 4.176 4.879 . 0 0 "[ . 1 . 2]" 1
2254 1 61 ASP QB 1 64 ILE HA 5.290 . 5.290 4.453 3.576 5.308 0.018 8 0 "[ . 1 . 2]" 1
2255 1 61 ASP QB 1 64 ILE QG 4.260 . 4.260 2.972 2.061 3.809 . 0 0 "[ . 1 . 2]" 1
2256 1 61 ASP QB 1 64 ILE MD 4.500 . 4.500 3.626 2.707 4.531 0.031 19 0 "[ . 1 . 2]" 1
2257 1 62 LYS HA 1 62 LYS QG 3.490 . 3.490 2.443 2.309 2.998 . 0 0 "[ . 1 . 2]" 1
2258 1 62 LYS QD 1 62 LYS QG 2.340 . 2.340 2.076 2.057 2.089 . 0 0 "[ . 1 . 2]" 1
2259 1 62 LYS QE 1 62 LYS QG 2.530 . 2.530 2.054 1.970 2.236 . 0 0 "[ . 1 . 2]" 1
2260 1 62 LYS QG 1 63 HIS H 4.080 . 4.080 3.749 3.487 3.847 . 0 0 "[ . 1 . 2]" 1
2261 1 64 ILE H 1 64 ILE QG 3.540 . 3.540 2.315 2.016 2.732 . 0 0 "[ . 1 . 2]" 1
2262 1 64 ILE HA 1 68 ASP QB 3.920 . 3.920 3.050 2.732 3.280 . 0 0 "[ . 1 . 2]" 1
2263 1 64 ILE HB 1 68 ASP QB 4.930 . 4.930 4.329 4.147 4.460 . 0 0 "[ . 1 . 2]" 1
2264 1 64 ILE QG 1 68 ASP QB 5.180 . 5.180 4.021 3.548 4.293 . 0 0 "[ . 1 . 2]" 1
2265 1 64 ILE MD 1 68 ASP QB 4.620 . 4.620 4.521 4.041 4.672 0.052 20 0 "[ . 1 . 2]" 1
2266 1 65 THR H 1 68 ASP QB 3.420 . 3.420 2.055 1.774 2.313 . 0 0 "[ . 1 . 2]" 1
2267 1 66 ILE H 1 66 ILE QG 4.590 . 4.590 4.109 4.067 4.146 . 0 0 "[ . 1 . 2]" 1
2268 1 66 ILE HA 1 66 ILE QG 3.730 . 3.730 3.053 3.008 3.085 . 0 0 "[ . 1 . 2]" 1
2269 1 66 ILE QG 1 66 ILE MG 2.420 . 2.420 2.086 2.036 2.115 . 0 0 "[ . 1 . 2]" 1
2270 1 66 ILE QG 1 67 GLU H 4.900 . 4.900 3.591 3.515 3.697 . 0 0 "[ . 1 . 2]" 1
2271 1 67 GLU H 1 68 ASP QB 4.660 . 4.660 4.252 4.075 4.560 . 0 0 "[ . 1 . 2]" 1
2272 1 67 GLU HG3 1 68 ASP QB 5.110 . 5.110 3.453 3.120 4.183 . 0 0 "[ . 1 . 2]" 1
2273 1 68 ASP H 1 68 ASP QB 3.100 . 3.100 2.292 2.240 2.355 . 0 0 "[ . 1 . 2]" 1
2274 1 68 ASP QB 1 69 LEU HA 4.980 . 4.980 3.990 3.781 4.067 . 0 0 "[ . 1 . 2]" 1
2275 1 68 ASP QB 1 69 LEU MD1 3.890 . 3.890 3.843 3.692 3.923 0.033 19 0 "[ . 1 . 2]" 1
2276 1 68 ASP QB 1 69 LEU MD2 4.150 . 4.150 2.962 2.803 3.069 . 0 0 "[ . 1 . 2]" 1
2277 1 68 ASP QB 1 71 LYS HG3 4.800 . 4.800 4.151 3.754 4.558 . 0 0 "[ . 1 . 2]" 1
2278 1 71 LYS HA 1 74 LYS QB 3.720 . 3.720 2.074 2.027 2.151 . 0 0 "[ . 1 . 2]" 1
2279 1 71 LYS HA 1 74 LYS QG 3.780 . 3.780 3.712 2.889 3.869 0.089 8 0 "[ . 1 . 2]" 1
2280 1 71 LYS HB2 1 74 LYS QB 4.790 . 4.790 4.068 3.882 4.291 . 0 0 "[ . 1 . 2]" 1
2281 1 71 LYS HB3 1 74 LYS QB 4.300 . 4.300 4.109 4.021 4.273 . 0 0 "[ . 1 . 2]" 1
2282 1 71 LYS HG3 1 74 LYS QB 5.180 . 5.180 5.071 4.933 5.238 0.058 16 0 "[ . 1 . 2]" 1
2283 1 72 ARG H 1 74 LYS QB 4.680 . 4.680 4.401 4.246 4.680 . 16 0 "[ . 1 . 2]" 1
2284 1 73 TRP HA 1 76 SER QB 3.970 . 3.970 1.988 1.836 2.198 . 0 0 "[ . 1 . 2]" 1
2285 1 73 TRP QB 1 78 VAL QG 4.160 . 4.160 2.383 2.259 2.522 . 0 0 "[ . 1 . 2]" 1
2286 1 73 TRP QB 1 147 VAL QG 4.190 . 4.190 3.018 2.757 3.228 . 0 0 "[ . 1 . 2]" 1
2287 1 73 TRP HD1 1 147 VAL QG 4.230 . 4.230 2.673 2.488 2.777 . 0 0 "[ . 1 . 2]" 1
2288 1 74 LYS H 1 74 LYS QB 3.280 . 3.280 2.240 2.156 2.431 . 0 0 "[ . 1 . 2]" 1
2289 1 74 LYS H 1 76 SER QB 4.970 . 4.970 4.673 4.359 4.977 0.007 10 0 "[ . 1 . 2]" 1
2290 1 74 LYS QB 1 74 LYS QD 2.530 . 2.530 2.266 2.092 2.388 . 0 0 "[ . 1 . 2]" 1
2291 1 76 SER H 1 76 SER QB 2.880 . 2.880 2.429 2.300 2.534 . 0 0 "[ . 1 . 2]" 1
2292 1 76 SER H 1 78 VAL QG 4.360 . 4.360 4.036 3.786 4.246 . 0 0 "[ . 1 . 2]" 1
2293 1 76 SER QB 1 78 VAL H 4.110 . 4.110 2.970 2.682 3.277 . 0 0 "[ . 1 . 2]" 1
2294 1 76 SER QB 1 78 VAL HB 4.980 . 4.980 4.062 3.666 4.400 . 0 0 "[ . 1 . 2]" 1
2295 1 76 SER QB 1 78 VAL QG 3.800 . 3.800 2.171 2.043 2.400 . 0 0 "[ . 1 . 2]" 1
2296 1 76 SER QB 1 79 HIS H 4.640 . 4.640 3.557 3.195 3.855 . 0 0 "[ . 1 . 2]" 1
2297 1 76 SER QB 1 79 HIS HB2 5.340 . 5.340 4.238 3.861 4.608 . 0 0 "[ . 1 . 2]" 1
2298 1 76 SER QB 1 147 VAL HA 5.340 . 5.340 5.114 4.930 5.340 . 0 0 "[ . 1 . 2]" 1
2299 1 76 SER QB 1 150 GLY QA 4.630 . 4.630 3.158 2.490 4.052 . 0 0 "[ . 1 . 2]" 1
2300 1 77 GLU H 1 77 GLU QG 3.260 . 3.260 2.203 1.913 3.169 . 0 0 "[ . 1 . 2]" 1
2301 1 77 GLU H 1 78 VAL QG 4.190 . 4.190 3.883 3.511 4.042 . 0 0 "[ . 1 . 2]" 1
2302 1 77 GLU HA 1 77 GLU QG 3.430 . 3.430 3.342 3.089 3.490 0.060 4 0 "[ . 1 . 2]" 1
2303 1 77 GLU HA 1 80 ASN QB 3.700 . 3.700 2.284 2.003 2.481 . 0 0 "[ . 1 . 2]" 1
2304 1 77 GLU HA 1 80 ASN QD 3.950 . 3.950 2.996 2.307 3.965 0.015 18 0 "[ . 1 . 2]" 1
2305 1 77 GLU QB 1 80 ASN QD 4.880 . 4.880 3.978 3.474 4.844 . 0 0 "[ . 1 . 2]" 1
2306 1 77 GLU QG 1 78 VAL H 3.940 . 3.940 2.454 2.169 3.704 . 0 0 "[ . 1 . 2]" 1
2307 1 77 GLU QG 1 78 VAL HB 5.340 . 5.340 3.706 3.395 5.414 0.074 5 0 "[ . 1 . 2]" 1
2308 1 77 GLU QG 1 78 VAL QG 5.220 . 5.220 3.750 3.539 4.818 . 0 0 "[ . 1 . 2]" 1
2309 1 77 GLU QG 1 81 TRP HE1 4.130 . 4.130 2.419 1.885 3.568 . 0 0 "[ . 1 . 2]" 1
2310 1 78 VAL H 1 78 VAL QG 2.870 . 2.870 2.154 2.034 2.227 . 0 0 "[ . 1 . 2]" 1
2311 1 78 VAL HA 1 78 VAL QG 2.970 . 2.970 2.365 2.339 2.396 . 0 0 "[ . 1 . 2]" 1
2312 1 78 VAL HB 1 113 LEU QD 5.440 . 5.440 5.202 4.593 5.495 0.055 19 0 "[ . 1 . 2]" 1
2313 1 78 VAL QG 1 79 HIS HA 3.990 . 3.990 3.105 3.044 3.182 . 0 0 "[ . 1 . 2]" 1
2314 1 78 VAL QG 1 79 HIS HB2 3.130 . 3.130 2.380 2.293 2.443 . 0 0 "[ . 1 . 2]" 1
2315 1 78 VAL QG 1 80 ASN H 4.350 . 4.350 3.847 3.785 3.944 . 0 0 "[ . 1 . 2]" 1
2316 1 78 VAL QG 1 81 TRP H 4.690 . 4.690 4.412 4.262 4.497 . 0 0 "[ . 1 . 2]" 1
2317 1 78 VAL QG 1 81 TRP QB 4.660 . 4.660 4.271 3.862 4.542 . 0 0 "[ . 1 . 2]" 1
2318 1 78 VAL QG 1 110 GLY HA2 4.300 . 4.300 3.876 3.574 4.199 . 0 0 "[ . 1 . 2]" 1
2319 1 78 VAL QG 1 113 LEU QD 4.220 . 4.220 3.000 2.352 3.384 . 0 0 "[ . 1 . 2]" 1
2320 1 78 VAL QG 1 146 VAL H 5.440 . 5.440 4.553 4.454 4.689 . 0 0 "[ . 1 . 2]" 1
2321 1 78 VAL QG 1 146 VAL HA 4.010 . 4.010 4.090 4.035 4.172 0.162 4 0 "[ . 1 . 2]" 1
2322 1 78 VAL QG 1 146 VAL HB 3.350 . 3.350 2.705 2.529 3.086 . 0 0 "[ . 1 . 2]" 1
2323 1 78 VAL QG 1 146 VAL MG1 4.210 . 4.210 3.599 3.454 3.826 . 0 0 "[ . 1 . 2]" 1
2324 1 78 VAL QG 1 146 VAL MG2 3.050 . 3.050 1.821 1.772 1.886 . 0 0 "[ . 1 . 2]" 1
2325 1 78 VAL QG 1 147 VAL HA 3.590 . 3.590 2.178 1.805 2.610 . 0 0 "[ . 1 . 2]" 1
2326 1 78 VAL QG 1 147 VAL HB 4.810 . 4.810 4.156 3.849 4.508 . 0 0 "[ . 1 . 2]" 1
2327 1 78 VAL QG 1 147 VAL QG 4.000 . 4.000 2.305 2.084 2.572 . 0 0 "[ . 1 . 2]" 1
2328 1 78 VAL QG 1 150 GLY QA 3.480 . 3.480 3.024 2.591 3.604 0.124 12 0 "[ . 1 . 2]" 1
2329 1 80 ASN H 1 80 ASN QB 3.120 . 3.120 2.405 2.291 2.501 . 0 0 "[ . 1 . 2]" 1
2330 1 80 ASN QB 1 80 ASN QD 3.000 . 3.000 2.148 2.094 2.235 . 0 0 "[ . 1 . 2]" 1
2331 1 80 ASN QB 1 81 TRP H 3.680 . 3.680 3.172 3.029 3.375 . 0 0 "[ . 1 . 2]" 1
2332 1 80 ASN QB 1 81 TRP HA 4.520 . 4.520 4.179 4.019 4.371 . 0 0 "[ . 1 . 2]" 1
2333 1 80 ASN QB 1 81 TRP QB 5.270 . 5.270 5.012 4.896 5.138 . 0 0 "[ . 1 . 2]" 1
2334 1 80 ASN QB 1 81 TRP HE1 5.340 . 5.340 5.298 5.053 5.432 0.092 4 0 "[ . 1 . 2]" 1
2335 1 82 THR HA 1 109 LYS QG 4.160 . 4.160 3.743 2.777 4.081 . 0 0 "[ . 1 . 2]" 1
2336 1 82 THR HA 1 109 LYS QE 4.410 . 4.410 3.672 2.952 4.460 0.050 14 0 "[ . 1 . 2]" 1
2337 1 83 LEU H 1 109 LYS QG 4.500 . 4.500 3.606 3.329 3.987 . 0 0 "[ . 1 . 2]" 1
2338 1 83 LEU HA 1 87 LEU QD 4.660 . 4.660 2.934 2.624 4.195 . 0 0 "[ . 1 . 2]" 1
2339 1 83 LEU HA 1 108 VAL QG 4.880 . 4.880 3.960 3.747 4.239 . 0 0 "[ . 1 . 2]" 1
2340 1 83 LEU QB 1 87 LEU QD 5.070 . 5.070 3.019 2.712 3.550 . 0 0 "[ . 1 . 2]" 1
2341 1 83 LEU QB 1 108 VAL QG 5.320 . 5.320 4.285 4.068 4.439 . 0 0 "[ . 1 . 2]" 1
2342 1 83 LEU MD2 1 107 ASN QB 4.440 . 4.440 4.229 4.011 4.477 0.037 8 0 "[ . 1 . 2]" 1
2343 1 84 GLU H 1 87 LEU QD 5.440 . 5.440 4.642 4.514 4.973 . 0 0 "[ . 1 . 2]" 1
2344 1 84 GLU HA 1 87 LEU QD 3.880 . 3.880 3.810 3.360 3.908 0.028 19 0 "[ . 1 . 2]" 1
2345 1 85 ASP HA 1 88 GLN QG 4.640 . 4.640 1.968 1.784 2.179 . 0 0 "[ . 1 . 2]" 1
2346 1 85 ASP QB 1 88 GLN QG 4.510 . 4.510 3.758 3.198 4.005 . 0 0 "[ . 1 . 2]" 1
2347 1 86 THR H 1 88 GLN QG 5.330 . 5.330 4.288 4.108 4.469 . 0 0 "[ . 1 . 2]" 1
2348 1 86 THR MG 1 87 LEU QD 4.410 . 4.410 2.446 2.178 2.904 . 0 0 "[ . 1 . 2]" 1
2349 1 86 THR MG 1 108 VAL QG 4.950 . 4.950 1.946 1.773 2.269 . 0 0 "[ . 1 . 2]" 1
2350 1 86 THR MG 1 113 LEU QD 3.400 . 3.400 1.831 1.726 1.926 . 0 0 "[ . 1 . 2]" 1
2351 1 87 LEU H 1 87 LEU QD 3.410 . 3.410 2.369 2.275 3.080 . 0 0 "[ . 1 . 2]" 1
2352 1 87 LEU H 1 88 GLN QG 5.110 . 5.110 4.099 3.900 4.320 . 0 0 "[ . 1 . 2]" 1
2353 1 87 LEU HA 1 87 LEU QD 2.620 . 2.620 1.859 1.816 1.908 . 0 0 "[ . 1 . 2]" 1
2354 1 87 LEU HA 1 90 LEU QD 3.630 . 3.630 3.044 2.867 3.186 . 0 0 "[ . 1 . 2]" 1
2355 1 87 LEU HB3 1 100 GLU QG 5.340 . 5.340 4.163 3.913 4.561 . 0 0 "[ . 1 . 2]" 1
2356 1 87 LEU QD 1 88 GLN H 4.290 . 4.290 3.928 3.878 4.110 . 0 0 "[ . 1 . 2]" 1
2357 1 87 LEU QD 1 90 LEU HA 5.440 . 5.440 4.745 4.597 5.243 . 0 0 "[ . 1 . 2]" 1
2358 1 87 LEU QD 1 90 LEU QD 3.170 . 3.170 1.893 1.785 2.239 . 0 0 "[ . 1 . 2]" 1
2359 1 87 LEU QD 1 99 TYR H 5.440 . 5.440 5.290 5.087 5.443 0.003 13 0 "[ . 1 . 2]" 1
2360 1 87 LEU QD 1 100 GLU H 4.330 . 4.330 4.170 4.092 4.286 . 0 0 "[ . 1 . 2]" 1
2361 1 87 LEU QD 1 100 GLU HA 3.130 . 3.130 2.018 1.915 2.170 . 0 0 "[ . 1 . 2]" 1
2362 1 87 LEU QD 1 100 GLU HB2 2.930 . 2.930 1.935 1.820 2.072 . 0 0 "[ . 1 . 2]" 1
2363 1 87 LEU QD 1 100 GLU HB3 4.150 . 4.150 2.703 2.552 2.872 . 0 0 "[ . 1 . 2]" 1
2364 1 87 LEU QD 1 100 GLU QG 3.710 . 3.710 3.715 3.293 3.782 0.072 9 0 "[ . 1 . 2]" 1
2365 1 87 LEU QD 1 101 LYS H 4.500 . 4.500 4.378 3.822 4.494 . 0 0 "[ . 1 . 2]" 1
2366 1 87 LEU QD 1 101 LYS QD 5.440 . 5.440 5.224 4.763 5.481 0.041 20 0 "[ . 1 . 2]" 1
2367 1 87 LEU QD 1 103 PHE H 3.690 . 3.690 3.492 3.378 3.576 . 0 0 "[ . 1 . 2]" 1
2368 1 87 LEU QD 1 103 PHE HA 4.510 . 4.510 4.053 3.958 4.239 . 0 0 "[ . 1 . 2]" 1
2369 1 87 LEU QD 1 103 PHE QB 3.520 . 3.520 1.808 1.756 1.912 . 0 0 "[ . 1 . 2]" 1
2370 1 87 LEU QD 1 103 PHE QD 3.390 . 3.390 2.666 2.319 2.978 . 0 0 "[ . 1 . 2]" 1
2371 1 87 LEU QD 1 104 ARG H 3.660 . 3.660 2.471 2.149 2.592 . 0 0 "[ . 1 . 2]" 1
2372 1 87 LEU QD 1 104 ARG HA 3.320 . 3.320 2.216 2.027 3.020 . 0 0 "[ . 1 . 2]" 1
2373 1 87 LEU QD 1 104 ARG QD 4.310 . 4.310 3.455 2.358 4.165 . 0 0 "[ . 1 . 2]" 1
2374 1 87 LEU QD 1 105 ASP H 4.720 . 4.720 4.433 4.096 4.564 . 0 0 "[ . 1 . 2]" 1
2375 1 87 LEU QD 1 108 VAL QG 4.260 . 4.260 2.673 2.374 3.069 . 0 0 "[ . 1 . 2]" 1
2376 1 88 GLN H 1 88 GLN QG 3.330 . 3.330 2.370 2.084 2.559 . 0 0 "[ . 1 . 2]" 1
2377 1 88 GLN HA 1 88 GLN QG 3.530 . 3.530 3.345 3.316 3.377 . 0 0 "[ . 1 . 2]" 1
2378 1 88 GLN QG 1 89 TRP H 3.370 . 3.370 2.332 2.117 2.454 . 0 0 "[ . 1 . 2]" 1
2379 1 88 GLN QG 1 89 TRP HA 4.160 . 4.160 3.434 3.241 3.674 . 0 0 "[ . 1 . 2]" 1
2380 1 88 GLN QG 1 89 TRP QB 4.660 . 4.660 3.268 3.091 3.440 . 0 0 "[ . 1 . 2]" 1
2381 1 89 TRP HA 1 92 GLU QG 4.860 . 4.860 3.980 3.583 4.376 . 0 0 "[ . 1 . 2]" 1
2382 1 90 LEU H 1 90 LEU QD 3.980 . 3.980 3.693 3.647 3.727 . 0 0 "[ . 1 . 2]" 1
2383 1 90 LEU H 1 94 VAL QG 4.770 . 4.770 4.291 4.210 4.421 . 0 0 "[ . 1 . 2]" 1
2384 1 90 LEU HA 1 90 LEU QD 3.350 . 3.350 3.124 2.386 3.226 . 0 0 "[ . 1 . 2]" 1
2385 1 90 LEU HA 1 94 VAL QG 4.180 . 4.180 2.171 2.068 2.367 . 0 0 "[ . 1 . 2]" 1
2386 1 90 LEU HA 1 113 LEU QD 5.440 . 5.440 4.994 4.635 5.277 . 0 0 "[ . 1 . 2]" 1
2387 1 90 LEU HB2 1 94 VAL QG 5.030 . 5.030 3.412 3.246 3.604 . 0 0 "[ . 1 . 2]" 1
2388 1 90 LEU HG 1 94 VAL QG 4.040 . 4.040 2.202 1.740 3.322 . 0 0 "[ . 1 . 2]" 1
2389 1 90 LEU QD 1 91 ILE H 3.830 . 3.830 2.591 2.412 3.331 . 0 0 "[ . 1 . 2]" 1
2390 1 90 LEU QD 1 91 ILE HA 5.080 . 5.080 2.503 2.260 3.723 . 0 0 "[ . 1 . 2]" 1
2391 1 90 LEU QD 1 91 ILE MG 3.560 . 3.560 1.973 1.828 2.610 . 0 0 "[ . 1 . 2]" 1
2392 1 90 LEU QD 1 91 ILE QG 5.390 . 5.390 4.325 4.232 4.982 . 0 0 "[ . 1 . 2]" 1
2393 1 90 LEU QD 1 91 ILE MD 3.840 . 3.840 3.668 3.578 3.975 0.135 19 0 "[ . 1 . 2]" 1
2394 1 90 LEU QD 1 92 GLU H 5.440 . 5.440 4.429 4.312 5.089 . 0 0 "[ . 1 . 2]" 1
2395 1 90 LEU QD 1 94 VAL H 4.620 . 4.620 4.331 3.929 4.470 . 0 0 "[ . 1 . 2]" 1
2396 1 90 LEU QD 1 94 VAL HB 3.950 . 3.950 3.201 2.253 4.192 0.242 15 0 "[ . 1 . 2]" 1
2397 1 90 LEU QD 1 94 VAL QG 2.820 . 2.820 2.550 1.803 2.834 0.014 13 0 "[ . 1 . 2]" 1
2398 1 90 LEU QD 1 95 GLU H 4.360 . 4.360 3.984 3.769 4.464 0.104 17 0 "[ . 1 . 2]" 1
2399 1 90 LEU QD 1 96 LEU H 3.670 . 3.670 2.669 2.380 3.470 . 0 0 "[ . 1 . 2]" 1
2400 1 90 LEU QD 1 96 LEU HA 5.200 . 5.200 3.961 3.713 4.634 . 0 0 "[ . 1 . 2]" 1
2401 1 90 LEU QD 1 97 PRO HA 4.770 . 4.770 3.050 2.826 3.723 . 0 0 "[ . 1 . 2]" 1
2402 1 90 LEU QD 1 98 GLN H 4.740 . 4.740 4.089 3.931 4.653 . 0 0 "[ . 1 . 2]" 1
2403 1 90 LEU QD 1 99 TYR H 3.950 . 3.950 3.499 3.429 3.668 . 0 0 "[ . 1 . 2]" 1
2404 1 90 LEU QD 1 99 TYR HA 5.410 . 5.410 4.881 4.603 5.157 . 0 0 "[ . 1 . 2]" 1
2405 1 90 LEU QD 1 99 TYR QB 3.880 . 3.880 3.215 3.030 3.451 . 0 0 "[ . 1 . 2]" 1
2406 1 90 LEU MD2 1 99 TYR HB3 6.120 . 6.120 5.120 4.263 5.517 . 0 0 "[ . 1 . 2]" 1
2407 1 90 LEU QD 1 100 GLU H 3.690 . 3.690 3.424 3.236 3.562 . 0 0 "[ . 1 . 2]" 1
2408 1 90 LEU QD 1 100 GLU HA 3.530 . 3.530 2.433 2.083 2.582 . 0 0 "[ . 1 . 2]" 1
2409 1 90 LEU QD 1 100 GLU HB2 3.580 . 3.580 2.830 2.515 3.066 . 0 0 "[ . 1 . 2]" 1
2410 1 90 LEU QD 1 100 GLU HB3 3.950 . 3.950 2.026 1.848 2.213 . 0 0 "[ . 1 . 2]" 1
2411 1 90 LEU QD 1 100 GLU QG 4.470 . 4.470 3.533 3.284 3.843 . 0 0 "[ . 1 . 2]" 1
2412 1 90 LEU QD 1 101 LYS H 5.150 . 5.150 4.775 4.575 4.944 . 0 0 "[ . 1 . 2]" 1
2413 1 90 LEU QD 1 103 PHE H 5.300 . 5.300 4.512 4.301 4.702 . 0 0 "[ . 1 . 2]" 1
2414 1 90 LEU QD 1 103 PHE QB 5.070 . 5.070 3.221 2.979 3.541 . 0 0 "[ . 1 . 2]" 1
2415 1 90 LEU QD 1 103 PHE QD 3.770 . 3.770 2.123 2.014 2.198 . 0 0 "[ . 1 . 2]" 1
2416 1 90 LEU QD 1 138 LYS QD 4.490 . 4.490 2.844 2.076 3.234 . 0 0 "[ . 1 . 2]" 1
2417 1 90 LEU QD 1 139 LEU HA 5.440 . 5.440 5.095 4.204 5.454 0.014 11 0 "[ . 1 . 2]" 1
2418 1 91 ILE H 1 94 VAL QG 4.340 . 4.340 4.420 3.771 4.549 0.209 4 0 "[ . 1 . 2]" 1
2419 1 91 ILE HA 1 94 VAL QG 3.700 . 3.700 3.581 2.579 3.769 0.069 13 0 "[ . 1 . 2]" 1
2420 1 91 ILE HA 1 95 GLU QB 5.340 . 5.340 4.532 4.385 4.654 . 0 0 "[ . 1 . 2]" 1
2421 1 91 ILE MG 1 100 GLU QG 3.880 . 3.880 2.839 2.313 3.651 . 0 0 "[ . 1 . 2]" 1
2422 1 91 ILE QG 1 92 GLU QG 3.860 . 3.860 2.863 2.647 3.013 . 0 0 "[ . 1 . 2]" 1
2423 1 91 ILE MD 1 92 GLU QG 3.100 . 3.100 2.408 2.215 2.524 . 0 0 "[ . 1 . 2]" 1
2424 1 92 GLU H 1 92 GLU QG 3.300 . 3.300 2.619 2.501 2.723 . 0 0 "[ . 1 . 2]" 1
2425 1 92 GLU HB3 1 92 GLU QG 2.580 . 2.580 2.402 2.307 2.486 . 0 0 "[ . 1 . 2]" 1
2426 1 93 PHE H 1 94 VAL QG 3.900 . 3.900 3.698 3.447 3.862 . 0 0 "[ . 1 . 2]" 1
2427 1 93 PHE QB 1 94 VAL QG 3.260 . 3.260 3.062 2.929 3.158 . 0 0 "[ . 1 . 2]" 1
2428 1 93 PHE QD 1 94 VAL QG 4.700 . 4.700 4.669 4.537 4.733 0.033 3 0 "[ . 1 . 2]" 1
2429 1 94 VAL H 1 94 VAL QG 3.150 . 3.150 2.400 2.064 2.572 . 0 0 "[ . 1 . 2]" 1
2430 1 94 VAL HA 1 94 VAL QG 3.130 . 3.130 2.237 2.174 2.481 . 0 0 "[ . 1 . 2]" 1
2431 1 94 VAL HA 1 141 LEU QD 4.940 . 4.940 4.911 4.654 5.031 0.091 10 0 "[ . 1 . 2]" 1
2432 1 94 VAL QG 1 95 GLU HA 4.000 . 4.000 4.046 3.656 4.138 0.138 19 0 "[ . 1 . 2]" 1
2433 1 94 VAL QG 1 96 LEU H 3.370 . 3.370 2.297 1.670 2.503 . 0 0 "[ . 1 . 2]" 1
2434 1 94 VAL QG 1 96 LEU HA 5.110 . 5.110 3.756 3.432 3.869 . 0 0 "[ . 1 . 2]" 1
2435 1 94 VAL QG 1 96 LEU HG 2.770 . 2.770 2.856 2.804 2.958 0.188 15 0 "[ . 1 . 2]" 1
2436 1 94 VAL QG 1 96 LEU MD2 2.830 . 2.830 1.903 1.832 2.057 . 0 0 "[ . 1 . 2]" 1
2437 1 94 VAL QG 1 135 HIS HA 5.350 . 5.350 5.035 4.887 5.289 . 0 0 "[ . 1 . 2]" 1
2438 1 94 VAL QG 1 138 LYS HA 4.200 . 4.200 3.397 2.639 3.704 . 0 0 "[ . 1 . 2]" 1
2439 1 94 VAL QG 1 138 LYS HB2 4.270 . 4.270 1.949 1.835 2.059 . 0 0 "[ . 1 . 2]" 1
2440 1 94 VAL QG 1 138 LYS HB3 4.780 . 4.780 3.091 2.630 3.367 . 0 0 "[ . 1 . 2]" 1
2441 1 94 VAL QG 1 138 LYS HG3 3.350 . 3.350 2.986 2.645 3.282 . 0 0 "[ . 1 . 2]" 1
2442 1 94 VAL QG 1 138 LYS QD 3.400 . 3.400 1.859 1.738 2.074 . 0 0 "[ . 1 . 2]" 1
2443 1 94 VAL QG 1 138 LYS QE 4.280 . 4.280 3.078 2.653 3.363 . 0 0 "[ . 1 . 2]" 1
2444 1 94 VAL QG 1 139 LEU H 5.150 . 5.150 4.421 4.114 4.584 . 0 0 "[ . 1 . 2]" 1
2445 1 94 VAL QG 1 139 LEU HA 3.790 . 3.790 3.672 3.389 3.860 0.070 5 0 "[ . 1 . 2]" 1
2446 1 94 VAL QG 1 139 LEU MD1 3.990 . 3.990 2.988 2.220 3.424 . 0 0 "[ . 1 . 2]" 1
2447 1 94 VAL QG 1 141 LEU HG 5.440 . 5.440 5.066 4.624 5.479 0.039 4 0 "[ . 1 . 2]" 1
2448 1 94 VAL QG 1 141 LEU QD 4.650 . 4.650 3.997 3.717 4.356 . 0 0 "[ . 1 . 2]" 1
2449 1 94 VAL QG 1 142 LYS H 5.370 . 5.370 4.309 3.954 4.529 . 0 0 "[ . 1 . 2]" 1
2450 1 94 VAL QG 1 142 LYS QG 3.380 . 3.380 1.961 1.750 2.153 . 0 0 "[ . 1 . 2]" 1
2451 1 94 VAL QG 1 142 LYS QD 4.170 . 4.170 2.992 2.077 3.554 . 0 0 "[ . 1 . 2]" 1
2452 1 94 VAL QG 1 143 ALA H 5.010 . 5.010 4.924 4.578 5.072 0.062 12 0 "[ . 1 . 2]" 1
2453 1 95 GLU H 1 95 GLU QB 3.620 . 3.620 3.203 2.918 3.393 . 0 0 "[ . 1 . 2]" 1
2454 1 95 GLU QB 1 96 LEU H 4.160 . 4.160 3.907 3.796 4.016 . 0 0 "[ . 1 . 2]" 1
2455 1 99 TYR H 1 99 TYR QB 3.290 . 3.290 2.648 2.560 2.731 . 0 0 "[ . 1 . 2]" 1
2456 1 99 TYR HA 1 128 LEU QD 5.440 . 5.440 3.665 3.304 4.294 . 0 0 "[ . 1 . 2]" 1
2457 1 99 TYR QB 1 100 GLU H 4.440 . 4.440 3.575 3.460 3.642 . 0 0 "[ . 1 . 2]" 1
2458 1 99 TYR QB 1 102 ASN H 5.100 . 5.100 4.245 4.002 4.496 . 0 0 "[ . 1 . 2]" 1
2459 1 99 TYR QB 1 138 LYS QE 5.340 . 5.340 2.928 2.586 3.372 . 0 0 "[ . 1 . 2]" 1
2460 1 100 GLU H 1 100 GLU QG 3.550 . 3.550 2.213 1.999 2.406 . 0 0 "[ . 1 . 2]" 1
2461 1 100 GLU QG 1 101 LYS H 4.040 . 4.040 2.252 1.990 2.474 . 0 0 "[ . 1 . 2]" 1
2462 1 100 GLU QG 1 101 LYS HA 3.930 . 3.930 3.653 3.103 4.046 0.116 3 0 "[ . 1 . 2]" 1
2463 1 100 GLU QG 1 101 LYS HB2 4.990 . 4.990 4.758 4.360 5.043 0.053 9 0 "[ . 1 . 2]" 1
2464 1 100 GLU QG 1 101 LYS HB3 3.830 . 3.830 3.373 3.014 3.585 . 0 0 "[ . 1 . 2]" 1
2465 1 100 GLU QG 1 101 LYS QG 5.340 . 5.340 4.743 4.449 5.010 . 0 0 "[ . 1 . 2]" 1
2466 1 101 LYS H 1 102 ASN QD 5.300 . 5.300 5.140 4.055 5.380 0.080 18 0 "[ . 1 . 2]" 1
2467 1 101 LYS HA 1 105 ASP QB 4.920 . 4.920 4.249 3.860 4.926 0.006 7 0 "[ . 1 . 2]" 1
2468 1 101 LYS QG 1 105 ASP QB 5.340 . 5.340 4.312 4.046 4.697 . 0 0 "[ . 1 . 2]" 1
2469 1 101 LYS QE 1 128 LEU QD 4.750 . 4.750 4.390 3.682 4.886 0.136 2 0 "[ . 1 . 2]" 1
2470 1 102 ASN H 1 102 ASN QD 4.670 . 4.670 3.457 2.534 3.786 . 0 0 "[ . 1 . 2]" 1
2471 1 102 ASN HA 1 102 ASN QD 4.290 . 4.290 3.221 1.766 4.116 . 0 0 "[ . 1 . 2]" 1
2472 1 102 ASN HA 1 105 ASP QB 4.480 . 4.480 3.207 2.799 3.764 . 0 0 "[ . 1 . 2]" 1
2473 1 102 ASN HA 1 106 ASN QD 4.890 . 4.890 3.844 3.015 5.002 0.112 14 0 "[ . 1 . 2]" 1
2474 1 102 ASN HA 1 128 LEU QD 4.740 . 4.740 4.072 3.775 4.352 . 0 0 "[ . 1 . 2]" 1
2475 1 102 ASN QB 1 128 LEU QD 3.920 . 3.920 1.983 1.795 2.191 . 0 0 "[ . 1 . 2]" 1
2476 1 102 ASN QD 1 129 LYS QB 5.180 . 5.180 3.621 2.808 5.216 0.036 13 0 "[ . 1 . 2]" 1
2477 1 102 ASN QD 1 129 LYS QE 3.800 . 3.800 3.284 2.466 3.883 0.083 12 0 "[ . 1 . 2]" 1
2478 1 103 PHE H 1 108 VAL QG 4.260 . 4.260 4.358 4.325 4.389 0.129 6 0 "[ . 1 . 2]" 1
2479 1 103 PHE H 1 128 LEU QD 4.550 . 4.550 3.437 3.071 3.801 . 0 0 "[ . 1 . 2]" 1
2480 1 103 PHE HA 1 106 ASN QB 3.970 . 3.970 3.019 2.616 4.010 0.040 17 0 "[ . 1 . 2]" 1
2481 1 103 PHE HA 1 108 VAL QG 3.270 . 3.270 2.414 2.329 2.505 . 0 0 "[ . 1 . 2]" 1
2482 1 103 PHE HA 1 128 LEU QD 4.170 . 4.170 3.665 3.107 4.005 . 0 0 "[ . 1 . 2]" 1
2483 1 103 PHE QD 1 108 VAL QG 3.730 . 3.730 2.249 1.899 2.816 . 0 0 "[ . 1 . 2]" 1
2484 1 103 PHE QD 1 128 LEU QD 4.290 . 4.290 3.059 2.665 3.285 . 0 0 "[ . 1 . 2]" 1
2485 1 104 ARG H 1 105 ASP QB 5.200 . 5.200 4.680 4.491 4.967 . 0 0 "[ . 1 . 2]" 1
2486 1 104 ARG HA 1 108 VAL QG 5.440 . 5.440 3.819 3.655 4.065 . 0 0 "[ . 1 . 2]" 1
2487 1 105 ASP H 1 105 ASP QB 2.990 . 2.990 2.245 2.191 2.347 . 0 0 "[ . 1 . 2]" 1
2488 1 105 ASP QB 1 106 ASN H 3.160 . 3.160 2.733 2.509 2.969 . 0 0 "[ . 1 . 2]" 1
2489 1 105 ASP QB 1 106 ASN QB 4.570 . 4.570 4.485 3.908 4.663 0.093 9 0 "[ . 1 . 2]" 1
2490 1 106 ASN H 1 106 ASN QB 3.350 . 3.350 2.400 2.151 2.631 . 0 0 "[ . 1 . 2]" 1
2491 1 106 ASN H 1 106 ASN QD 4.150 . 4.150 3.351 2.438 4.212 0.062 14 0 "[ . 1 . 2]" 1
2492 1 106 ASN H 1 108 VAL QG 4.310 . 4.310 4.100 3.961 4.290 . 0 0 "[ . 1 . 2]" 1
2493 1 106 ASN HA 1 107 ASN QB 4.880 . 4.880 4.028 3.914 4.127 . 0 0 "[ . 1 . 2]" 1
2494 1 106 ASN QB 1 106 ASN QD 3.100 . 3.100 2.126 2.011 2.193 . 0 0 "[ . 1 . 2]" 1
2495 1 106 ASN QB 1 107 ASN H 4.190 . 4.190 3.083 2.858 3.646 . 0 0 "[ . 1 . 2]" 1
2496 1 106 ASN QB 1 108 VAL H 5.340 . 5.340 4.624 4.216 5.388 0.048 2 0 "[ . 1 . 2]" 1
2497 1 106 ASN QB 1 108 VAL QG 3.900 . 3.900 3.096 2.601 4.035 0.135 2 0 "[ . 1 . 2]" 1
2498 1 106 ASN QB 1 128 LEU QD 4.990 . 4.990 4.342 3.647 4.794 . 0 0 "[ . 1 . 2]" 1
2499 1 106 ASN QD 1 108 VAL QG 4.420 . 4.420 3.830 1.932 4.492 0.072 19 0 "[ . 1 . 2]" 1
2500 1 106 ASN QD 1 128 LEU QD 3.640 . 3.640 3.072 2.196 3.683 0.043 15 0 "[ . 1 . 2]" 1
2501 1 107 ASN H 1 107 ASN QB 3.210 . 3.210 3.227 3.187 3.242 0.032 19 0 "[ . 1 . 2]" 1
2502 1 107 ASN H 1 108 VAL QG 3.840 . 3.840 3.270 3.188 3.354 . 0 0 "[ . 1 . 2]" 1
2503 1 107 ASN QB 1 107 ASN HD21 2.860 . 2.860 2.381 2.215 2.735 . 0 0 "[ . 1 . 2]" 1
2504 1 107 ASN QB 1 108 VAL H 4.060 . 4.060 3.918 3.889 3.955 . 0 0 "[ . 1 . 2]" 1
2505 1 108 VAL H 1 108 VAL QG 2.860 . 2.860 2.810 2.740 2.876 0.016 13 0 "[ . 1 . 2]" 1
2506 1 108 VAL HA 1 108 VAL QG 3.020 . 3.020 2.121 2.085 2.156 . 0 0 "[ . 1 . 2]" 1
2507 1 108 VAL QG 1 109 LYS H 3.360 . 3.360 2.907 2.532 3.176 . 0 0 "[ . 1 . 2]" 1
2508 1 108 VAL QG 1 109 LYS HA 4.640 . 4.640 3.311 2.933 3.487 . 0 0 "[ . 1 . 2]" 1
2509 1 108 VAL QG 1 109 LYS QG 4.780 . 4.780 4.377 4.149 4.916 0.136 14 0 "[ . 1 . 2]" 1
2510 1 108 VAL QG 1 110 GLY H 4.800 . 4.800 3.445 3.000 4.886 0.086 12 0 "[ . 1 . 2]" 1
2511 1 108 VAL QG 1 111 THR H 3.780 . 3.780 3.033 2.574 3.565 . 0 0 "[ . 1 . 2]" 1
2512 1 108 VAL QG 1 111 THR HB 4.080 . 4.080 3.589 2.347 4.129 0.049 6 0 "[ . 1 . 2]" 1
2513 1 108 VAL QG 1 112 THR H 4.690 . 4.690 2.646 2.374 3.054 . 0 0 "[ . 1 . 2]" 1
2514 1 108 VAL QG 1 113 LEU H 4.420 . 4.420 3.706 3.408 4.015 . 0 0 "[ . 1 . 2]" 1
2515 1 108 VAL QG 1 113 LEU QD 3.870 . 3.870 2.780 2.424 3.508 . 0 0 "[ . 1 . 2]" 1
2516 1 108 VAL QG 1 124 MET HA 5.440 . 5.440 4.584 3.484 5.258 . 0 0 "[ . 1 . 2]" 1
2517 1 108 VAL QG 1 124 MET ME 4.850 . 4.850 2.958 1.911 4.904 0.054 1 0 "[ . 1 . 2]" 1
2518 1 109 LYS H 1 109 LYS QG 4.250 . 4.250 2.626 2.088 3.656 . 0 0 "[ . 1 . 2]" 1
2519 1 109 LYS H 1 109 LYS QE 4.500 . 4.500 4.002 2.381 4.396 . 0 0 "[ . 1 . 2]" 1
2520 1 109 LYS H 1 113 LEU QD 5.440 . 5.440 4.891 4.207 5.463 0.023 8 0 "[ . 1 . 2]" 1
2521 1 109 LYS HA 1 109 LYS QE 4.650 . 4.650 4.161 3.705 4.285 . 0 0 "[ . 1 . 2]" 1
2522 1 109 LYS HB3 1 109 LYS QE 4.440 . 4.440 3.449 2.167 3.709 . 0 0 "[ . 1 . 2]" 1
2523 1 109 LYS QE 1 109 LYS QG 3.000 . 3.000 2.586 2.283 2.855 . 0 0 "[ . 1 . 2]" 1
2524 1 109 LYS QE 1 111 THR H 4.780 . 4.780 4.727 4.129 4.851 0.071 9 0 "[ . 1 . 2]" 1
2525 1 110 GLY H 1 113 LEU QD 4.790 . 4.790 3.190 2.613 4.266 . 0 0 "[ . 1 . 2]" 1
2526 1 110 GLY HA2 1 113 LEU QD 4.790 . 4.790 2.290 1.847 3.048 . 0 0 "[ . 1 . 2]" 1
2527 1 111 THR H 1 113 LEU QD 3.600 . 3.600 3.238 2.526 3.703 0.103 17 0 "[ . 1 . 2]" 1
2528 1 112 THR H 1 113 LEU QD 5.180 . 5.180 3.508 2.989 4.500 . 0 0 "[ . 1 . 2]" 1
2529 1 113 LEU H 1 113 LEU QD 3.980 . 3.980 2.121 1.701 3.045 . 0 0 "[ . 1 . 2]" 1
2530 1 113 LEU HA 1 113 LEU QD 3.870 . 3.870 2.166 1.983 2.656 . 0 0 "[ . 1 . 2]" 1
2531 1 113 LEU HA 1 147 VAL QG 5.190 . 5.190 4.134 3.867 4.527 . 0 0 "[ . 1 . 2]" 1
2532 1 113 LEU QD 1 139 LEU HA 3.980 . 3.980 4.034 3.814 4.161 0.181 6 0 "[ . 1 . 2]" 1
2533 1 113 LEU QD 1 139 LEU HG 5.340 . 5.340 2.649 2.207 2.994 . 0 0 "[ . 1 . 2]" 1
2534 1 113 LEU QD 1 139 LEU MD1 3.530 . 3.530 2.105 1.885 2.330 . 0 0 "[ . 1 . 2]" 1
2535 1 113 LEU QD 1 139 LEU MD2 3.820 . 3.820 2.909 2.465 3.536 . 0 0 "[ . 1 . 2]" 1
2536 1 113 LEU QD 1 143 ALA HA 4.190 . 4.190 2.510 2.098 3.400 . 0 0 "[ . 1 . 2]" 1
2537 1 113 LEU QD 1 143 ALA MB 3.180 . 3.180 2.209 1.893 2.822 . 0 0 "[ . 1 . 2]" 1
2538 1 114 PRO HA 1 147 VAL QG 3.310 . 3.310 1.933 1.844 2.068 . 0 0 "[ . 1 . 2]" 1
2539 1 114 PRO QB 1 147 VAL QG 4.180 . 4.180 2.516 2.306 2.971 . 0 0 "[ . 1 . 2]" 1
2540 1 116 ILE HB 1 118 VAL QG 4.560 . 4.560 3.704 2.856 4.129 . 0 0 "[ . 1 . 2]" 1
2541 1 116 ILE MD 1 118 VAL QG 3.210 . 3.210 2.460 1.839 2.842 . 0 0 "[ . 1 . 2]" 1
2542 1 118 VAL H 1 118 VAL QG 4.130 . 4.130 2.176 1.924 2.837 . 0 0 "[ . 1 . 2]" 1
2543 1 118 VAL QG 1 119 HIS HA 4.500 . 4.500 3.741 3.299 4.550 0.050 8 0 "[ . 1 . 2]" 1
2544 1 118 VAL QG 1 119 HIS QB 4.930 . 4.930 3.642 2.560 4.439 . 0 0 "[ . 1 . 2]" 1
2545 1 118 VAL QG 1 120 GLU H 5.440 . 5.440 4.440 3.747 5.062 . 0 0 "[ . 1 . 2]" 1
2546 1 118 VAL QG 1 140 GLN QB 4.690 . 4.690 4.099 2.920 4.705 0.015 6 0 "[ . 1 . 2]" 1
2547 1 118 VAL QG 1 140 GLN QG 4.100 . 4.100 2.607 1.928 4.076 . 0 0 "[ . 1 . 2]" 1
2548 1 118 VAL QG 1 144 LEU HA 5.430 . 5.430 4.581 4.061 5.238 . 0 0 "[ . 1 . 2]" 1
2549 1 118 VAL QG 1 144 LEU QB 4.020 . 4.020 3.673 3.050 4.028 0.008 20 0 "[ . 1 . 2]" 1
2550 1 122 SER QB 1 123 PHE H 3.450 . 3.450 2.783 2.035 3.547 0.097 13 0 "[ . 1 . 2]" 1
2551 1 122 SER QB 1 124 MET H 5.340 . 5.340 4.080 2.991 5.349 0.009 9 0 "[ . 1 . 2]" 1
2552 1 122 SER QB 1 125 ILE HB 4.210 . 4.210 3.474 1.805 4.375 0.165 11 0 "[ . 1 . 2]" 1
2553 1 122 SER QB 1 125 ILE QG 4.410 . 4.410 2.338 1.889 3.081 . 0 0 "[ . 1 . 2]" 1
2554 1 122 SER QB 1 125 ILE MD 3.410 . 3.410 2.093 1.775 2.683 . 0 0 "[ . 1 . 2]" 1
2555 1 124 MET ME 1 128 LEU QD 5.440 . 5.440 4.867 3.372 5.600 0.160 16 0 "[ . 1 . 2]" 1
2556 1 128 LEU HA 1 128 LEU QD 3.130 . 3.130 1.998 1.840 2.431 . 0 0 "[ . 1 . 2]" 1
2557 1 128 LEU QD 1 135 HIS H 5.140 . 5.140 5.093 4.512 5.251 0.111 13 0 "[ . 1 . 2]" 1
2558 1 128 LEU QD 1 135 HIS HA 5.440 . 5.440 4.779 3.587 5.410 . 0 0 "[ . 1 . 2]" 1
2559 1 128 LEU QD 1 135 HIS QB 3.860 . 3.860 3.354 2.102 3.900 0.040 17 0 "[ . 1 . 2]" 1
2560 1 129 LYS HA 1 129 LYS QB 2.590 . 2.590 2.360 2.105 2.520 . 0 0 "[ . 1 . 2]" 1
2561 1 129 LYS QB 1 129 LYS QD 3.110 . 3.110 2.444 2.190 2.856 . 0 0 "[ . 1 . 2]" 1
2562 1 129 LYS QB 1 129 LYS QE 3.170 . 3.170 2.062 1.958 2.508 . 0 0 "[ . 1 . 2]" 1
2563 1 129 LYS QB 1 130 ILE MD 4.440 . 4.440 4.265 3.931 4.526 0.086 14 0 "[ . 1 . 2]" 1
2564 1 129 LYS QE 1 129 LYS QG 2.860 . 2.860 2.476 2.300 2.872 0.012 17 0 "[ . 1 . 2]" 1
2565 1 129 LYS QG 1 130 ILE HA 5.010 . 5.010 4.113 3.374 4.612 . 0 0 "[ . 1 . 2]" 1
2566 1 129 LYS QG 1 130 ILE MG 4.650 . 4.650 2.705 1.963 4.724 0.074 11 0 "[ . 1 . 2]" 1
2567 1 129 LYS QG 1 130 ILE QG 3.660 . 3.660 2.513 1.905 3.505 . 0 0 "[ . 1 . 2]" 1
2568 1 131 SER HA 1 131 SER QB 2.530 . 2.530 2.346 2.180 2.430 . 0 0 "[ . 1 . 2]" 1
2569 1 137 GLN HA 1 141 LEU QB 5.240 . 5.240 4.466 2.967 4.829 . 0 0 "[ . 1 . 2]" 1
2570 1 137 GLN HB2 1 141 LEU QB 4.950 . 4.950 4.812 4.089 5.065 0.115 20 0 "[ . 1 . 2]" 1
2571 1 137 GLN HB2 1 141 LEU QD 4.560 . 4.560 2.999 2.308 3.489 . 0 0 "[ . 1 . 2]" 1
2572 1 137 GLN HB3 1 137 GLN QE 3.940 . 3.940 3.286 2.595 3.676 . 0 0 "[ . 1 . 2]" 1
2573 1 137 GLN QE 1 137 GLN HG2 3.470 . 3.470 3.280 3.257 3.318 . 0 0 "[ . 1 . 2]" 1
2574 1 137 GLN QE 1 137 GLN HG3 3.360 . 3.360 2.431 2.190 2.853 . 0 0 "[ . 1 . 2]" 1
2575 1 137 GLN HG3 1 141 LEU QD 5.160 . 5.160 4.050 3.583 4.660 . 0 0 "[ . 1 . 2]" 1
2576 1 137 GLN QE 1 141 LEU QD 4.190 . 4.190 3.534 2.913 4.127 . 0 0 "[ . 1 . 2]" 1
2577 1 138 LYS HB3 1 141 LEU QD 5.440 . 5.440 4.964 4.515 5.467 0.027 10 0 "[ . 1 . 2]" 1
2578 1 140 GLN QB 1 141 LEU QB 4.930 . 4.930 3.850 3.481 4.249 . 0 0 "[ . 1 . 2]" 1
2579 1 141 LEU H 1 141 LEU QB 3.410 . 3.410 2.607 2.042 2.788 . 0 0 "[ . 1 . 2]" 1
2580 1 141 LEU H 1 141 LEU QD 4.020 . 4.020 3.146 3.023 3.639 . 0 0 "[ . 1 . 2]" 1
2581 1 141 LEU HA 1 144 LEU QD 3.140 . 3.140 2.819 2.513 3.171 0.031 4 0 "[ . 1 . 2]" 1
2582 1 141 LEU QB 1 141 LEU QD 2.840 . 2.840 1.904 1.885 1.925 . 0 0 "[ . 1 . 2]" 1
2583 1 141 LEU QB 1 142 LYS H 4.060 . 4.060 3.605 2.591 3.729 . 0 0 "[ . 1 . 2]" 1
2584 1 141 LEU QB 1 142 LYS QD 5.340 . 5.340 4.225 2.914 4.650 . 0 0 "[ . 1 . 2]" 1
2585 1 141 LEU QB 1 144 LEU QB 5.340 . 5.340 3.810 3.451 4.274 . 0 0 "[ . 1 . 2]" 1
2586 1 141 LEU QD 1 142 LYS H 3.770 . 3.770 2.676 2.331 3.476 . 0 0 "[ . 1 . 2]" 1
2587 1 141 LEU QD 1 142 LYS HA 4.020 . 4.020 2.693 2.482 3.747 . 0 0 "[ . 1 . 2]" 1
2588 1 141 LEU QD 1 142 LYS QB 4.170 . 4.170 3.164 2.713 4.238 0.068 10 0 "[ . 1 . 2]" 1
2589 1 141 LEU QD 1 142 LYS QG 4.440 . 4.440 3.510 2.426 3.871 . 0 0 "[ . 1 . 2]" 1
2590 1 141 LEU QD 1 142 LYS QD 3.490 . 3.490 1.998 1.799 2.273 . 0 0 "[ . 1 . 2]" 1
2591 1 141 LEU QD 1 142 LYS QE 4.380 . 4.380 3.239 2.261 3.740 . 0 0 "[ . 1 . 2]" 1
2592 1 142 LYS HA 1 145 ASP QB 4.180 . 4.180 2.486 2.065 2.970 . 0 0 "[ . 1 . 2]" 1
2593 1 143 ALA H 1 145 ASP QB 5.340 . 5.340 4.539 4.227 4.954 . 0 0 "[ . 1 . 2]" 1
2594 1 143 ALA HA 1 147 VAL QG 4.610 . 4.610 3.497 3.253 3.689 . 0 0 "[ . 1 . 2]" 1
2595 1 143 ALA MB 1 147 VAL QG 4.040 . 4.040 2.907 2.707 3.065 . 0 0 "[ . 1 . 2]" 1
2596 1 144 LEU H 1 144 LEU QD 3.890 . 3.890 3.584 3.460 3.676 . 0 0 "[ . 1 . 2]" 1
2597 1 144 LEU H 1 147 VAL QG 4.650 . 4.650 4.374 4.208 4.596 . 0 0 "[ . 1 . 2]" 1
2598 1 144 LEU HA 1 144 LEU QD 3.850 . 3.850 2.070 1.937 2.149 . 0 0 "[ . 1 . 2]" 1
2599 1 144 LEU HA 1 147 VAL QG 3.780 . 3.780 3.330 2.943 3.608 . 0 0 "[ . 1 . 2]" 1
2600 1 144 LEU HG 1 148 LEU QD 4.640 . 4.640 2.436 2.130 2.803 . 0 0 "[ . 1 . 2]" 1
2601 1 144 LEU QD 1 145 ASP H 4.710 . 4.710 3.786 3.683 3.908 . 0 0 "[ . 1 . 2]" 1
2602 1 144 LEU QD 1 147 VAL H 5.440 . 5.440 4.945 4.333 5.271 . 0 0 "[ . 1 . 2]" 1
2603 1 144 LEU QD 1 148 LEU H 4.750 . 4.750 4.169 3.415 4.721 . 0 0 "[ . 1 . 2]" 1
2604 1 144 LEU QD 1 148 LEU QB 4.860 . 4.860 3.962 3.597 4.508 . 0 0 "[ . 1 . 2]" 1
2605 1 144 LEU QD 1 148 LEU QD 3.410 . 3.410 2.302 2.029 2.897 . 0 0 "[ . 1 . 2]" 1
2606 1 145 ASP HA 1 148 LEU QB 4.550 . 4.550 3.414 3.086 3.633 . 0 0 "[ . 1 . 2]" 1
2607 1 145 ASP HA 1 148 LEU QD 4.820 . 4.820 3.973 3.518 4.244 . 0 0 "[ . 1 . 2]" 1
2608 1 145 ASP QB 1 146 VAL H 3.480 . 3.480 2.279 2.185 2.401 . 0 0 "[ . 1 . 2]" 1
2609 1 145 ASP QB 1 146 VAL HA 4.890 . 4.890 4.186 4.053 4.342 . 0 0 "[ . 1 . 2]" 1
2610 1 145 ASP QB 1 146 VAL HB 5.340 . 5.340 5.363 5.292 5.478 0.138 17 0 "[ . 1 . 2]" 1
2611 1 146 VAL H 1 147 VAL QG 4.730 . 4.730 4.182 4.044 4.287 . 0 0 "[ . 1 . 2]" 1
2612 1 146 VAL HA 1 149 PHE QB 4.440 . 4.440 2.764 2.154 3.408 . 0 0 "[ . 1 . 2]" 1
2613 1 146 VAL MG2 1 147 VAL QG 3.110 . 3.110 2.476 2.338 2.592 . 0 0 "[ . 1 . 2]" 1
2614 1 147 VAL H 1 147 VAL QG 3.100 . 3.100 2.276 2.170 2.350 . 0 0 "[ . 1 . 2]" 1
2615 1 147 VAL HB 1 148 LEU QD 5.440 . 5.440 3.903 3.716 4.043 . 0 0 "[ . 1 . 2]" 1
2616 1 147 VAL QG 1 148 LEU H 3.550 . 3.550 2.923 2.829 3.015 . 0 0 "[ . 1 . 2]" 1
2617 1 147 VAL QG 1 148 LEU HA 3.470 . 3.470 3.086 2.998 3.223 . 0 0 "[ . 1 . 2]" 1
2618 1 147 VAL QG 1 148 LEU QB 4.980 . 4.980 3.999 3.936 4.087 . 0 0 "[ . 1 . 2]" 1
2619 1 147 VAL QG 1 148 LEU HG 4.300 . 4.300 2.853 2.651 3.023 . 0 0 "[ . 1 . 2]" 1
2620 1 148 LEU H 1 148 LEU QB 3.280 . 3.280 2.348 2.298 2.385 . 0 0 "[ . 1 . 2]" 1
2621 1 148 LEU H 1 149 PHE QB 5.340 . 5.340 4.425 4.220 4.611 . 0 0 "[ . 1 . 2]" 1
2622 1 148 LEU HA 1 148 LEU QD 2.730 . 2.730 2.050 1.976 2.166 . 0 0 "[ . 1 . 2]" 1
2623 1 148 LEU QB 1 148 LEU QD 2.670 . 2.670 1.889 1.843 1.926 . 0 0 "[ . 1 . 2]" 1
2624 1 148 LEU QB 1 149 PHE H 3.830 . 3.830 2.995 2.840 3.249 . 0 0 "[ . 1 . 2]" 1
2625 1 148 LEU QB 1 149 PHE HA 4.570 . 4.570 4.059 3.980 4.181 . 0 0 "[ . 1 . 2]" 1
2626 1 148 LEU QB 1 149 PHE QB 4.190 . 4.190 3.968 3.760 4.192 0.002 15 0 "[ . 1 . 2]" 1
2627 1 148 LEU QD 1 149 PHE QB 5.280 . 5.280 5.031 4.867 5.186 . 0 0 "[ . 1 . 2]" 1
2628 1 149 PHE QB 1 150 GLY H 3.810 . 3.810 2.566 2.066 3.007 . 0 0 "[ . 1 . 2]" 1
2629 1 103 PHE QR 1 138 LYS QD 4.840 . 4.840 3.507 3.229 3.745 . 0 0 "[ . 1 . 2]" 1
2630 1 103 PHE QR 1 112 THR MG 5.260 . 5.260 3.376 2.779 3.968 . 0 0 "[ . 1 . 2]" 1
2631 1 20 ILE MG 1 40 PHE QR 3.990 . 3.990 2.411 2.131 2.658 . 0 0 "[ . 1 . 2]" 1
2632 1 40 PHE QR 1 41 ILE MD 4.120 . 4.120 3.105 2.833 3.598 . 0 0 "[ . 1 . 2]" 1
2633 1 20 ILE HA 1 40 PHE QR 4.810 . 4.810 3.579 3.172 3.930 . 0 0 "[ . 1 . 2]" 1
2634 1 40 PHE QR 1 41 ILE HA 5.140 . 5.140 4.252 3.731 4.666 . 0 0 "[ . 1 . 2]" 1
2635 1 41 ILE MD 1 149 PHE QR 5.500 . 5.500 5.275 4.983 5.359 . 0 0 "[ . 1 . 2]" 1
2636 1 41 ILE MG 1 149 PHE QR 5.500 . 5.500 5.180 4.720 5.295 . 0 0 "[ . 1 . 2]" 1
2637 1 8 GLU QB 1 12 PHE QR 3.780 . 3.780 2.843 2.553 3.801 0.021 18 0 "[ . 1 . 2]" 1
2638 1 100 GLU HB3 1 103 PHE QR 5.060 . 5.060 4.605 3.990 4.937 . 0 0 "[ . 1 . 2]" 1
2639 1 23 GLN HB3 1 40 PHE QR 4.180 . 4.180 2.554 2.167 2.778 . 0 0 "[ . 1 . 2]" 1
2640 1 24 MET ME 1 40 PHE QR 2.980 . 2.980 2.036 1.879 2.241 . 0 0 "[ . 1 . 2]" 1
2641 1 40 PHE HA 1 40 PHE QR 3.730 . 3.730 2.263 1.999 2.626 . 0 0 "[ . 1 . 2]" 1
2642 1 87 LEU MD2 1 103 PHE QR 4.330 . 4.330 4.111 2.728 4.329 . 0 0 "[ . 1 . 2]" 1
2643 1 87 LEU MD1 1 103 PHE QR 4.330 . 4.330 2.752 2.319 4.298 . 0 0 "[ . 1 . 2]" 1
2644 1 90 LEU MD2 1 103 PHE QR 4.450 . 4.450 3.435 2.156 3.929 . 0 0 "[ . 1 . 2]" 1
2645 1 90 LEU HG 1 103 PHE QR 4.640 . 4.640 4.233 3.941 4.454 . 0 0 "[ . 1 . 2]" 1
2646 1 90 LEU MD1 1 103 PHE QR 4.450 . 4.450 2.065 1.849 2.779 . 0 0 "[ . 1 . 2]" 1
2647 1 40 PHE QR 1 148 LEU HG 5.500 . 5.500 4.232 4.116 4.423 . 0 0 "[ . 1 . 2]" 1
2648 1 93 PHE HA 1 93 PHE QR 3.630 . 3.630 2.995 2.853 3.071 . 0 0 "[ . 1 . 2]" 1
2649 1 103 PHE HA 1 103 PHE QR 4.100 . 4.100 2.132 1.936 2.369 . 0 0 "[ . 1 . 2]" 1
2650 1 149 PHE HA 1 149 PHE QR 3.820 . 3.820 2.766 2.516 3.093 . 0 0 "[ . 1 . 2]" 1
2651 1 9 GLU HA 1 12 PHE QR 3.660 . 3.660 2.561 1.955 3.572 . 0 0 "[ . 1 . 2]" 1
2652 1 12 PHE HA 1 12 PHE QR 3.530 . 3.530 2.560 2.164 3.077 . 0 0 "[ . 1 . 2]" 1
2653 1 24 MET HA 1 40 PHE QR 4.830 . 4.830 4.570 4.280 4.733 . 0 0 "[ . 1 . 2]" 1
2654 1 39 GLU QG 1 40 PHE QR 5.070 . 5.070 4.749 4.267 4.986 . 0 0 "[ . 1 . 2]" 1
2655 1 89 TRP HA 1 93 PHE QR 4.200 . 4.200 2.366 2.042 2.660 . 0 0 "[ . 1 . 2]" 1
2656 1 23 GLN HB2 1 40 PHE QR 4.340 . 4.340 3.183 2.778 3.621 . 0 0 "[ . 1 . 2]" 1
2657 1 103 PHE QR 1 124 MET HA 4.750 . 4.750 3.877 3.052 4.280 . 0 0 "[ . 1 . 2]" 1
2658 1 103 PHE QR 1 124 MET ME 4.650 . 4.650 3.722 2.393 4.484 . 0 0 "[ . 1 . 2]" 1
2659 1 12 PHE H 1 12 PHE QR 3.610 . 3.610 2.988 2.640 3.791 0.181 18 0 "[ . 1 . 2]" 1
2660 1 40 PHE H 1 40 PHE QR 4.440 . 4.440 4.174 4.134 4.205 . 0 0 "[ . 1 . 2]" 1
2661 1 40 PHE QR 1 44 ASP H 4.850 . 4.850 4.201 3.844 4.469 . 0 0 "[ . 1 . 2]" 1
2662 1 92 GLU H 1 93 PHE QR 4.590 . 4.590 4.040 3.887 4.227 . 0 0 "[ . 1 . 2]" 1
2663 1 93 PHE H 1 93 PHE QR 4.000 . 4.000 2.644 2.461 2.783 . 0 0 "[ . 1 . 2]" 1
2664 1 93 PHE QR 1 94 VAL H 4.680 . 4.680 4.245 4.120 4.406 . 0 0 "[ . 1 . 2]" 1
2665 1 103 PHE H 1 103 PHE QR 3.390 . 3.390 3.170 2.957 3.354 . 0 0 "[ . 1 . 2]" 1
2666 1 103 PHE QR 1 104 ARG H 4.270 . 4.270 4.226 4.037 4.313 0.043 9 0 "[ . 1 . 2]" 1
2667 1 9 GLU QB 1 12 PHE QR 4.750 . 4.750 4.078 3.327 4.636 . 0 0 "[ . 1 . 2]" 1
2668 1 23 GLN QG 1 40 PHE QR 3.890 . 3.890 2.795 2.443 3.302 . 0 0 "[ . 1 . 2]" 1
2669 1 40 PHE QR 1 41 ILE QG 5.130 . 5.130 4.535 4.139 4.908 . 0 0 "[ . 1 . 2]" 1
2670 1 40 PHE QR 1 148 LEU QD 3.480 . 3.480 1.969 1.840 2.136 . 0 0 "[ . 1 . 2]" 1
2671 1 87 LEU QD 1 103 PHE QR 3.390 . 3.390 2.643 2.305 2.942 . 0 0 "[ . 1 . 2]" 1
2672 1 90 LEU QD 1 103 PHE QR 3.770 . 3.770 2.018 1.825 2.145 . 0 0 "[ . 1 . 2]" 1
2673 1 93 PHE QR 1 94 VAL QG 4.700 . 4.700 4.555 4.427 4.616 . 0 0 "[ . 1 . 2]" 1
2674 1 103 PHE QR 1 108 VAL QG 3.730 . 3.730 2.235 1.893 2.788 . 0 0 "[ . 1 . 2]" 1
2675 1 103 PHE QR 1 128 LEU QD 4.290 . 4.290 2.409 1.973 2.751 . 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 91
_Distance_constraint_stats_list.Viol_count 673
_Distance_constraint_stats_list.Viol_total 926.639
_Distance_constraint_stats_list.Viol_max 0.260
_Distance_constraint_stats_list.Viol_rms 0.0496
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0255
_Distance_constraint_stats_list.Viol_average_violations_only 0.0688
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 9 GLU 0.037 0.037 3 0 "[ . 1 . 2]"
1 12 PHE 1.642 0.125 15 0 "[ . 1 . 2]"
1 13 SER 0.425 0.049 11 0 "[ . 1 . 2]"
1 14 LEU 0.008 0.008 10 0 "[ . 1 . 2]"
1 15 GLU 0.157 0.049 9 0 "[ . 1 . 2]"
1 16 ALA 1.642 0.125 15 0 "[ . 1 . 2]"
1 17 LEU 0.876 0.055 20 0 "[ . 1 . 2]"
1 18 GLN 0.008 0.008 10 0 "[ . 1 . 2]"
1 19 THR 0.274 0.049 9 0 "[ . 1 . 2]"
1 20 ILE 0.547 0.056 10 0 "[ . 1 . 2]"
1 21 HIS 0.487 0.055 20 0 "[ . 1 . 2]"
1 22 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 GLN 0.117 0.046 9 0 "[ . 1 . 2]"
1 24 MET 0.547 0.056 10 0 "[ . 1 . 2]"
1 25 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 SER 1.448 0.117 20 0 "[ . 1 . 2]"
1 41 ILE 1.448 0.117 20 0 "[ . 1 . 2]"
1 43 GLU 4.366 0.215 5 0 "[ . 1 . 2]"
1 47 TYR 4.366 0.215 5 0 "[ . 1 . 2]"
1 51 THR 0.560 0.080 5 0 "[ . 1 . 2]"
1 52 ASN 0.344 0.065 4 0 "[ . 1 . 2]"
1 54 HIS 0.087 0.064 17 0 "[ . 1 . 2]"
1 55 SER 0.560 0.080 5 0 "[ . 1 . 2]"
1 56 HIS 0.344 0.065 4 0 "[ . 1 . 2]"
1 58 HIS 0.087 0.064 17 0 "[ . 1 . 2]"
1 67 GLU 3.079 0.114 1 0 "[ . 1 . 2]"
1 68 ASP 0.010 0.010 18 0 "[ . 1 . 2]"
1 69 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 TRP 0.226 0.046 12 0 "[ . 1 . 2]"
1 71 LYS 4.265 0.114 1 0 "[ . 1 . 2]"
1 72 ARG 0.010 0.010 18 0 "[ . 1 . 2]"
1 73 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 LYS 0.226 0.046 12 0 "[ . 1 . 2]"
1 75 THR 1.186 0.086 7 0 "[ . 1 . 2]"
1 84 GLU 0.283 0.053 18 0 "[ . 1 . 2]"
1 85 ASP 0.649 0.083 4 0 "[ . 1 . 2]"
1 86 THR 0.179 0.039 20 0 "[ . 1 . 2]"
1 87 LEU 0.627 0.082 19 0 "[ . 1 . 2]"
1 88 GLN 0.729 0.083 7 0 "[ . 1 . 2]"
1 89 TRP 0.670 0.083 4 0 "[ . 1 . 2]"
1 90 LEU 0.397 0.059 8 0 "[ . 1 . 2]"
1 91 ILE 4.010 0.208 2 0 "[ . 1 . 2]"
1 92 GLU 0.446 0.083 7 0 "[ . 1 . 2]"
1 93 PHE 0.021 0.012 15 0 "[ . 1 . 2]"
1 94 VAL 0.217 0.059 8 0 "[ . 1 . 2]"
1 95 GLU 3.383 0.208 2 0 "[ . 1 . 2]"
1 100 GLU 0.021 0.020 8 0 "[ . 1 . 2]"
1 101 LYS 0.216 0.038 2 0 "[ . 1 . 2]"
1 102 ASN 0.173 0.048 12 0 "[ . 1 . 2]"
1 103 PHE 3.388 0.209 19 0 "[ . 1 . 2]"
1 104 ARG 7.298 0.260 12 0 "[ . 1 . 2]"
1 105 ASP 0.216 0.038 2 0 "[ . 1 . 2]"
1 106 ASN 0.173 0.048 12 0 "[ . 1 . 2]"
1 107 ASN 3.388 0.209 19 0 "[ . 1 . 2]"
1 108 VAL 7.278 0.260 12 0 "[ . 1 . 2]"
1 109 LYS 1.416 0.114 7 0 "[ . 1 . 2]"
1 111 THR 4.772 0.216 5 0 "[ . 1 . 2]"
1 112 THR 3.118 0.215 6 0 "[ . 1 . 2]"
1 115 ARG 3.356 0.216 5 0 "[ . 1 . 2]"
1 116 ILE 3.118 0.215 6 0 "[ . 1 . 2]"
1 134 SER 0.459 0.062 10 0 "[ . 1 . 2]"
1 135 HIS 2.003 0.135 14 0 "[ . 1 . 2]"
1 138 LYS 2.084 0.125 14 0 "[ . 1 . 2]"
1 139 LEU 2.025 0.135 14 0 "[ . 1 . 2]"
1 140 GLN 0.644 0.090 14 0 "[ . 1 . 2]"
1 141 LEU 1.113 0.105 11 0 "[ . 1 . 2]"
1 142 LYS 1.836 0.125 14 0 "[ . 1 . 2]"
1 143 ALA 0.022 0.008 4 0 "[ . 1 . 2]"
1 144 LEU 1.073 0.090 14 0 "[ . 1 . 2]"
1 145 ASP 1.480 0.105 11 0 "[ . 1 . 2]"
1 146 VAL 0.211 0.057 11 0 "[ . 1 . 2]"
1 147 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 148 LEU 0.428 0.070 20 0 "[ . 1 . 2]"
1 149 PHE 0.367 0.064 10 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 9 GLU O 1 13 SER H 2.000 . 2.000 1.786 1.670 2.037 0.037 3 0 "[ . 1 . 2]" 2
2 1 9 GLU O 1 13 SER N 3.000 . 3.000 2.751 2.651 2.992 . 0 0 "[ . 1 . 2]" 2
3 1 12 PHE O 1 16 ALA H 2.000 . 2.000 2.079 2.012 2.125 0.125 15 0 "[ . 1 . 2]" 2
4 1 12 PHE O 1 16 ALA N 3.000 . 3.000 2.970 2.909 3.028 0.028 15 0 "[ . 1 . 2]" 2
5 1 13 SER O 1 17 LEU H 2.000 . 2.000 1.979 1.820 2.049 0.049 11 0 "[ . 1 . 2]" 2
6 1 13 SER O 1 17 LEU N 3.000 . 3.000 2.947 2.794 3.025 0.025 10 0 "[ . 1 . 2]" 2
7 1 14 LEU O 1 18 GLN H 2.000 . 2.000 1.898 1.755 2.008 0.008 10 0 "[ . 1 . 2]" 2
8 1 14 LEU O 1 18 GLN N 3.000 . 3.000 2.746 2.662 2.804 . 0 0 "[ . 1 . 2]" 2
9 1 15 GLU O 1 19 THR H 2.000 . 2.000 1.939 1.798 2.049 0.049 9 0 "[ . 1 . 2]" 2
10 1 15 GLU O 1 19 THR N 3.000 . 3.000 2.806 2.654 2.912 . 0 0 "[ . 1 . 2]" 2
11 1 17 LEU O 1 21 HIS H 2.000 . 2.000 2.019 1.938 2.055 0.055 20 0 "[ . 1 . 2]" 2
12 1 17 LEU O 1 21 HIS N 3.000 . 3.000 2.947 2.862 2.998 . 0 0 "[ . 1 . 2]" 2
13 1 18 GLN O 1 22 LYS H 2.000 . 2.000 1.801 1.701 1.979 . 0 0 "[ . 1 . 2]" 2
14 1 18 GLN O 1 22 LYS N 3.000 . 3.000 2.739 2.651 2.903 . 0 0 "[ . 1 . 2]" 2
15 1 19 THR O 1 23 GLN H 2.000 . 2.000 1.922 1.829 2.046 0.046 9 0 "[ . 1 . 2]" 2
16 1 19 THR O 1 23 GLN N 3.000 . 3.000 2.782 2.687 2.890 . 0 0 "[ . 1 . 2]" 2
17 1 20 ILE O 1 24 MET H 2.000 . 2.000 2.019 1.910 2.056 0.056 10 0 "[ . 1 . 2]" 2
18 1 20 ILE O 1 24 MET N 3.000 . 3.000 2.947 2.853 2.999 . 0 0 "[ . 1 . 2]" 2
19 1 21 HIS O 1 25 ASP H 2.000 . 2.000 1.642 1.617 1.691 . 0 0 "[ . 1 . 2]" 2
20 1 21 HIS O 1 25 ASP N 3.000 . 3.000 2.563 2.548 2.587 . 0 0 "[ . 1 . 2]" 2
21 1 37 SER O 1 41 ILE H 2.000 . 2.000 2.067 2.003 2.117 0.117 20 0 "[ . 1 . 2]" 2
22 1 37 SER O 1 41 ILE N 3.000 . 3.000 2.995 2.934 3.024 0.024 20 0 "[ . 1 . 2]" 2
23 1 43 GLU O 1 47 TYR H 2.000 . 2.000 2.160 2.069 2.215 0.215 5 0 "[ . 1 . 2]" 2
24 1 43 GLU O 1 47 TYR N 3.000 . 3.000 3.057 2.975 3.126 0.126 5 0 "[ . 1 . 2]" 2
25 1 51 THR O 1 55 SER H 2.000 . 2.000 2.016 1.888 2.080 0.080 5 0 "[ . 1 . 2]" 2
26 1 51 THR O 1 55 SER N 3.000 . 3.000 2.952 2.833 3.012 0.012 5 0 "[ . 1 . 2]" 2
27 1 52 ASN O 1 56 HIS H 2.000 . 2.000 1.963 1.816 2.065 0.065 4 0 "[ . 1 . 2]" 2
28 1 52 ASN O 1 56 HIS N 3.000 . 3.000 2.870 2.739 3.010 0.010 14 0 "[ . 1 . 2]" 2
29 1 54 HIS O 1 58 HIS H 2.000 . 2.000 1.807 1.637 2.064 0.064 17 0 "[ . 1 . 2]" 2
30 1 54 HIS O 1 58 HIS N 3.000 . 3.000 2.687 2.570 2.808 . 0 0 "[ . 1 . 2]" 2
31 1 71 LYS O 1 75 THR H 2.000 . 2.000 2.059 2.036 2.086 0.086 7 0 "[ . 1 . 2]" 2
32 1 71 LYS O 1 75 THR N 3.000 . 3.000 2.914 2.843 2.980 . 0 0 "[ . 1 . 2]" 2
33 1 70 TRP O 1 74 LYS H 2.000 . 2.000 1.977 1.819 2.046 0.046 12 0 "[ . 1 . 2]" 2
34 1 70 TRP O 1 74 LYS N 3.000 . 3.000 2.879 2.760 2.938 . 0 0 "[ . 1 . 2]" 2
35 1 69 LEU O 1 73 TRP H 2.000 . 2.000 1.915 1.824 1.994 . 0 0 "[ . 1 . 2]" 2
36 1 69 LEU O 1 73 TRP N 3.000 . 3.000 2.892 2.802 2.966 . 0 0 "[ . 1 . 2]" 2
37 1 68 ASP O 1 72 ARG H 2.000 . 2.000 1.854 1.775 2.010 0.010 18 0 "[ . 1 . 2]" 2
38 1 68 ASP O 1 72 ARG N 3.000 . 3.000 2.748 2.686 2.907 . 0 0 "[ . 1 . 2]" 2
39 1 67 GLU O 1 71 LYS H 2.000 . 2.000 2.089 2.056 2.114 0.114 1 0 "[ . 1 . 2]" 2
40 1 67 GLU O 1 71 LYS N 3.000 . 3.000 3.065 3.035 3.091 0.091 1 0 "[ . 1 . 2]" 2
41 1 84 GLU O 1 88 GLN H 2.000 . 2.000 1.992 1.855 2.053 0.053 18 0 "[ . 1 . 2]" 2
42 1 84 GLU O 1 88 GLN N 3.000 . 3.000 2.924 2.790 3.014 0.014 18 0 "[ . 1 . 2]" 2
43 1 85 ASP O 1 89 TRP H 2.000 . 2.000 2.030 1.973 2.083 0.083 4 0 "[ . 1 . 2]" 2
44 1 85 ASP O 1 89 TRP N 3.000 . 3.000 2.941 2.877 3.009 0.009 4 0 "[ . 1 . 2]" 2
45 1 86 THR O 1 90 LEU H 2.000 . 2.000 1.973 1.847 2.039 0.039 20 0 "[ . 1 . 2]" 2
46 1 86 THR O 1 90 LEU N 3.000 . 3.000 2.862 2.738 2.942 . 0 0 "[ . 1 . 2]" 2
47 1 87 LEU O 1 91 ILE H 2.000 . 2.000 2.024 1.960 2.082 0.082 19 0 "[ . 1 . 2]" 2
48 1 87 LEU O 1 91 ILE N 3.000 . 3.000 2.983 2.921 3.043 0.043 19 0 "[ . 1 . 2]" 2
49 1 88 GLN O 1 92 GLU H 2.000 . 2.000 1.974 1.799 2.083 0.083 7 0 "[ . 1 . 2]" 2
50 1 88 GLN O 1 92 GLU N 3.000 . 3.000 2.892 2.746 3.006 0.006 7 0 "[ . 1 . 2]" 2
51 1 89 TRP O 1 93 PHE H 2.000 . 2.000 1.856 1.745 2.012 0.012 15 0 "[ . 1 . 2]" 2
52 1 89 TRP O 1 93 PHE N 3.000 . 3.000 2.751 2.663 2.836 . 0 0 "[ . 1 . 2]" 2
53 1 90 LEU O 1 94 VAL H 2.000 . 2.000 1.931 1.684 2.059 0.059 8 0 "[ . 1 . 2]" 2
54 1 90 LEU O 1 94 VAL N 3.000 . 3.000 2.718 2.584 2.809 . 0 0 "[ . 1 . 2]" 2
55 1 91 ILE O 1 95 GLU H 2.000 . 2.000 2.169 2.129 2.208 0.208 2 0 "[ . 1 . 2]" 2
56 1 91 ILE O 1 95 GLU N 3.000 . 3.000 2.850 2.824 2.872 . 0 0 "[ . 1 . 2]" 2
57 1 100 GLU O 1 104 ARG H 2.000 . 2.000 1.903 1.735 2.020 0.020 8 0 "[ . 1 . 2]" 2
58 1 100 GLU O 1 104 ARG N 3.000 . 3.000 2.863 2.697 2.982 . 0 0 "[ . 1 . 2]" 2
59 1 101 LYS O 1 105 ASP H 2.000 . 2.000 1.989 1.907 2.038 0.038 2 0 "[ . 1 . 2]" 2
60 1 101 LYS O 1 105 ASP N 3.000 . 3.000 2.940 2.862 2.990 . 0 0 "[ . 1 . 2]" 2
61 1 102 ASN O 1 106 ASN H 2.000 . 2.000 1.979 1.841 2.048 0.048 12 0 "[ . 1 . 2]" 2
62 1 102 ASN O 1 106 ASN N 3.000 . 3.000 2.902 2.785 2.989 . 0 0 "[ . 1 . 2]" 2
63 1 103 PHE O 1 107 ASN H 2.000 . 2.000 2.168 2.143 2.209 0.209 19 0 "[ . 1 . 2]" 2
64 1 103 PHE O 1 107 ASN N 3.000 . 3.000 2.955 2.921 3.017 0.017 4 0 "[ . 1 . 2]" 2
65 1 104 ARG O 1 108 VAL H 2.000 . 2.000 2.226 2.186 2.260 0.260 12 0 "[ . 1 . 2]" 2
66 1 104 ARG O 1 108 VAL N 3.000 . 3.000 3.138 3.107 3.164 0.164 15 0 "[ . 1 . 2]" 2
67 1 109 LYS H 1 111 THR OG1 2.000 . 2.000 2.071 2.024 2.114 0.114 7 0 "[ . 1 . 2]" 2
68 1 111 THR O 1 115 ARG H 2.000 . 2.000 2.162 2.104 2.216 0.216 5 0 "[ . 1 . 2]" 2
69 1 111 THR O 1 115 ARG N 3.000 . 3.000 2.969 2.892 3.041 0.041 11 0 "[ . 1 . 2]" 2
70 1 112 THR O 1 116 ILE H 2.000 . 2.000 2.156 2.109 2.215 0.215 6 0 "[ . 1 . 2]" 2
71 1 112 THR O 1 116 ILE N 3.000 . 3.000 2.647 2.591 2.699 . 0 0 "[ . 1 . 2]" 2
72 1 134 SER O 1 138 LYS H 2.000 . 2.000 2.010 1.925 2.062 0.062 10 0 "[ . 1 . 2]" 2
73 1 134 SER O 1 138 LYS N 3.000 . 3.000 2.947 2.851 3.012 0.012 18 0 "[ . 1 . 2]" 2
74 1 135 HIS O 1 139 LEU H 2.000 . 2.000 2.064 1.859 2.135 0.135 14 0 "[ . 1 . 2]" 2
75 1 135 HIS O 1 139 LEU N 3.000 . 3.000 3.008 2.812 3.095 0.095 14 0 "[ . 1 . 2]" 2
76 1 138 LYS O 1 142 LYS H 2.000 . 2.000 2.070 1.949 2.125 0.125 14 0 "[ . 1 . 2]" 2
77 1 138 LYS O 1 142 LYS N 3.000 . 3.000 2.977 2.838 3.062 0.062 19 0 "[ . 1 . 2]" 2
78 1 139 LEU O 1 143 ALA H 2.000 . 2.000 1.849 1.683 2.008 0.008 4 0 "[ . 1 . 2]" 2
79 1 139 LEU O 1 143 ALA N 3.000 . 3.000 2.751 2.613 2.891 . 0 0 "[ . 1 . 2]" 2
80 1 140 GLN O 1 144 LEU H 2.000 . 2.000 2.024 1.935 2.090 0.090 14 0 "[ . 1 . 2]" 2
81 1 140 GLN O 1 144 LEU N 3.000 . 3.000 2.918 2.823 2.976 . 0 0 "[ . 1 . 2]" 2
82 1 141 LEU O 1 145 ASP H 2.000 . 2.000 2.052 1.996 2.105 0.105 11 0 "[ . 1 . 2]" 2
83 1 141 LEU O 1 145 ASP N 3.000 . 3.000 2.954 2.885 3.022 0.022 7 0 "[ . 1 . 2]" 2
84 1 142 LYS O 1 146 VAL H 2.000 . 2.000 1.958 1.829 2.057 0.057 11 0 "[ . 1 . 2]" 2
85 1 142 LYS O 1 146 VAL N 3.000 . 3.000 2.918 2.811 3.016 0.016 11 0 "[ . 1 . 2]" 2
86 1 143 ALA O 1 147 VAL H 2.000 . 2.000 1.795 1.725 1.872 . 0 0 "[ . 1 . 2]" 2
87 1 143 ALA O 1 147 VAL N 3.000 . 3.000 2.747 2.687 2.845 . 0 0 "[ . 1 . 2]" 2
88 1 144 LEU O 1 148 LEU H 2.000 . 2.000 1.983 1.862 2.070 0.070 20 0 "[ . 1 . 2]" 2
89 1 144 LEU O 1 148 LEU N 3.000 . 3.000 2.945 2.831 3.042 0.042 20 0 "[ . 1 . 2]" 2
90 1 145 ASP O 1 149 PHE H 2.000 . 2.000 1.937 1.709 2.064 0.064 10 0 "[ . 1 . 2]" 2
91 1 145 ASP O 1 149 PHE N 3.000 . 3.000 2.749 2.614 2.928 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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