NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
518779 |
2l6m   |
17315 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2l6m
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 2260
_Distance_constraint_stats_list.Viol_count 4727
_Distance_constraint_stats_list.Viol_total 5121.563
_Distance_constraint_stats_list.Viol_max 0.434
_Distance_constraint_stats_list.Viol_rms 0.0233
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0057
_Distance_constraint_stats_list.Viol_average_violations_only 0.0542
_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 24 ASP 1.885 0.267 14 0 "[ . 1 . 2]"
1 25 ILE 10.765 0.267 14 0 "[ . 1 . 2]"
1 26 GLU 3.231 0.189 8 0 "[ . 1 . 2]"
1 27 HIS 1.748 0.139 7 0 "[ . 1 . 2]"
1 28 LYS 7.458 0.189 8 0 "[ . 1 . 2]"
1 29 VAL 9.136 0.239 15 0 "[ . 1 . 2]"
1 30 TYR 3.441 0.125 10 0 "[ . 1 . 2]"
1 31 GLN 6.974 0.169 17 0 "[ . 1 . 2]"
1 32 LEU 9.436 0.165 4 0 "[ . 1 . 2]"
1 33 LEU 9.579 0.292 14 0 "[ . 1 . 2]"
1 34 LYS 7.563 0.183 13 0 "[ . 1 . 2]"
1 35 ASP 2.843 0.139 9 0 "[ . 1 . 2]"
1 36 GLN 11.649 0.260 11 0 "[ . 1 . 2]"
1 37 GLY 1.833 0.132 1 0 "[ . 1 . 2]"
1 38 CYS 7.813 0.279 14 0 "[ . 1 . 2]"
1 39 GLU 5.284 0.233 18 0 "[ . 1 . 2]"
1 40 ASP 5.632 0.214 14 0 "[ . 1 . 2]"
1 41 PHE 12.247 0.216 14 0 "[ . 1 . 2]"
1 42 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 THR 1.317 0.110 18 0 "[ . 1 . 2]"
1 44 LYS 3.270 0.143 4 0 "[ . 1 . 2]"
1 45 CYS 0.331 0.073 4 0 "[ . 1 . 2]"
1 46 VAL 1.138 0.125 13 0 "[ . 1 . 2]"
1 47 ILE 7.317 0.161 5 0 "[ . 1 . 2]"
1 48 GLU 5.148 0.161 5 0 "[ . 1 . 2]"
1 49 GLU 2.208 0.184 20 0 "[ . 1 . 2]"
1 50 VAL 1.600 0.141 5 0 "[ . 1 . 2]"
1 51 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 SER 0.146 0.046 2 0 "[ . 1 . 2]"
1 55 LYS 0.910 0.144 15 0 "[ . 1 . 2]"
1 56 THR 2.496 0.144 15 0 "[ . 1 . 2]"
1 57 LEU 0.726 0.105 2 0 "[ . 1 . 2]"
1 58 LEU 13.562 0.434 6 0 "[ . 1 . 2]"
1 59 ASN 4.667 0.271 6 0 "[ . 1 . 2]"
1 60 THR 2.817 0.261 17 0 "[ . 1 . 2]"
1 61 GLU 5.169 0.434 6 0 "[ . 1 . 2]"
1 62 LEU 6.694 0.390 13 0 "[ . 1 . 2]"
1 63 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 LEU 2.543 0.127 10 0 "[ . 1 . 2]"
1 65 THR 4.022 0.148 1 0 "[ . 1 . 2]"
1 66 LYS 10.275 0.202 15 0 "[ . 1 . 2]"
1 67 TYR 5.007 0.141 5 0 "[ . 1 . 2]"
1 68 TYR 5.153 0.131 7 0 "[ . 1 . 2]"
1 69 GLY 2.295 0.125 13 0 "[ . 1 . 2]"
1 70 PHE 9.326 0.270 20 0 "[ . 1 . 2]"
1 71 SER 1.497 0.087 15 0 "[ . 1 . 2]"
1 72 PHE 6.444 0.171 19 0 "[ . 1 . 2]"
1 73 PHE 5.407 0.171 19 0 "[ . 1 . 2]"
1 74 ARG 5.938 0.239 15 0 "[ . 1 . 2]"
1 75 HIS 5.065 0.252 1 0 "[ . 1 . 2]"
1 76 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 ASN 3.478 0.215 18 0 "[ . 1 . 2]"
1 78 ILE 9.086 0.215 18 0 "[ . 1 . 2]"
1 79 VAL 10.896 0.166 16 0 "[ . 1 . 2]"
1 80 ALA 4.057 0.142 3 0 "[ . 1 . 2]"
1 81 TYR 3.514 0.126 20 0 "[ . 1 . 2]"
1 82 GLY 0.479 0.047 7 0 "[ . 1 . 2]"
1 83 LYS 4.270 0.241 5 0 "[ . 1 . 2]"
1 84 SER 1.706 0.149 14 0 "[ . 1 . 2]"
1 86 LYS 1.043 0.086 18 0 "[ . 1 . 2]"
1 87 VAL 7.289 0.270 20 0 "[ . 1 . 2]"
1 88 ALA 3.126 0.196 15 0 "[ . 1 . 2]"
1 89 ASN 2.046 0.144 7 0 "[ . 1 . 2]"
1 90 ALA 5.018 0.186 9 0 "[ . 1 . 2]"
1 91 LYS 12.310 0.307 8 0 "[ . 1 . 2]"
1 92 TYR 6.606 0.307 8 0 "[ . 1 . 2]"
1 93 ILE 7.410 0.144 7 0 "[ . 1 . 2]"
1 94 MET 9.642 0.197 7 0 "[ . 1 . 2]"
1 95 LYS 5.888 0.163 11 0 "[ . 1 . 2]"
1 96 GLN 2.524 0.082 9 0 "[ . 1 . 2]"
1 97 ARG 1.620 0.088 14 0 "[ . 1 . 2]"
1 98 LEU 11.152 0.210 7 0 "[ . 1 . 2]"
1 99 LEU 3.715 0.176 18 0 "[ . 1 . 2]"
1 100 LYS 5.173 0.193 12 0 "[ . 1 . 2]"
1 101 LEU 6.551 0.208 13 0 "[ . 1 . 2]"
1 102 LEU 9.472 0.164 1 0 "[ . 1 . 2]"
1 103 GLU 1.044 0.136 17 0 "[ . 1 . 2]"
1 104 ASP 3.319 0.136 7 0 "[ . 1 . 2]"
1 105 LYS 2.759 0.136 7 0 "[ . 1 . 2]"
1 106 SER 1.532 0.096 9 0 "[ . 1 . 2]"
1 107 ASN 3.045 0.104 9 0 "[ . 1 . 2]"
1 108 LEU 4.993 0.104 9 0 "[ . 1 . 2]"
1 109 LEU 22.416 0.308 5 0 "[ . 1 . 2]"
1 110 LEU 10.767 0.308 5 0 "[ . 1 . 2]"
1 111 TYR 6.453 0.224 1 0 "[ . 1 . 2]"
1 112 SER 0.856 0.090 1 0 "[ . 1 . 2]"
1 113 CYS 5.634 0.224 1 0 "[ . 1 . 2]"
1 114 ASN 0.452 0.121 8 0 "[ . 1 . 2]"
1 115 CYS 9.136 0.252 1 0 "[ . 1 . 2]"
1 116 LYS 2.873 0.132 1 0 "[ . 1 . 2]"
1 117 PHE 5.798 0.299 4 0 "[ . 1 . 2]"
1 118 SER 7.434 0.299 4 0 "[ . 1 . 2]"
1 119 LYS 6.156 0.310 20 0 "[ . 1 . 2]"
1 120 LYS 2.697 0.216 9 0 "[ . 1 . 2]"
1 121 LYS 4.865 0.372 7 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 46 VAL QG 1 48 GLU HA 4.080 . 4.080 3.944 3.706 4.145 0.065 20 0 "[ . 1 . 2]" 1
2 1 70 PHE QE 1 94 MET QG 5.500 . 5.500 5.277 5.030 5.608 0.108 12 0 "[ . 1 . 2]" 1
3 1 77 ASN HD21 1 79 VAL MG2 4.700 . 4.700 4.745 4.537 4.829 0.129 3 0 "[ . 1 . 2]" 1
4 1 96 GLN H 1 96 GLN HB2 3.200 . 3.200 2.421 2.314 2.558 . 0 0 "[ . 1 . 2]" 1
5 1 98 LEU H 1 102 LEU MD2 5.500 . 5.500 5.116 5.022 5.228 . 0 0 "[ . 1 . 2]" 1
6 1 100 LYS HB3 1 100 LYS QE 3.470 . 3.470 1.985 1.856 2.083 . 0 0 "[ . 1 . 2]" 1
7 1 110 LEU MD1 1 111 TYR H 5.500 . 5.500 5.280 5.182 5.357 . 0 0 "[ . 1 . 2]" 1
8 1 116 LYS HB3 1 117 PHE QE 5.500 . 5.500 5.521 5.374 5.580 0.080 13 0 "[ . 1 . 2]" 1
9 1 116 LYS QD 1 117 PHE QD 4.390 . 4.390 3.617 3.301 4.087 . 0 0 "[ . 1 . 2]" 1
10 1 119 LYS HB3 1 119 LYS QE 3.800 . 3.800 3.373 1.885 4.110 0.310 20 0 "[ . 1 . 2]" 1
11 1 31 GLN HA 1 34 LYS QE 4.070 . 4.070 2.797 1.892 4.011 . 0 0 "[ . 1 . 2]" 1
12 1 32 LEU HA 1 33 LEU HA 4.950 . 4.950 4.737 4.711 4.837 . 0 0 "[ . 1 . 2]" 1
13 1 32 LEU MD1 1 33 LEU MD1 3.840 . 3.840 3.319 1.937 3.471 . 0 0 "[ . 1 . 2]" 1
14 1 33 LEU MD2 1 109 LEU MD2 4.160 . 4.160 3.644 3.083 3.893 . 0 0 "[ . 1 . 2]" 1
15 1 38 CYS HA 1 40 ASP HB2 5.500 . 5.500 5.285 4.894 5.541 0.041 18 0 "[ . 1 . 2]" 1
16 1 44 LYS QE 1 46 VAL H 4.550 . 4.550 3.768 2.746 4.671 0.121 4 0 "[ . 1 . 2]" 1
17 1 45 CYS HB3 1 70 PHE HZ 5.210 . 5.210 3.766 3.188 5.095 . 0 0 "[ . 1 . 2]" 1
18 1 65 THR HA 1 66 LYS QD 3.990 . 3.990 3.870 3.649 4.064 0.074 13 0 "[ . 1 . 2]" 1
19 1 30 TYR QE 1 43 THR MG 4.640 . 4.640 4.264 3.816 4.598 . 0 0 "[ . 1 . 2]" 1
20 1 65 THR HA 1 66 LYS HB3 4.250 . 4.250 4.291 4.201 4.349 0.099 14 0 "[ . 1 . 2]" 1
21 1 73 PHE QD 1 78 ILE HA 5.050 . 5.050 4.451 4.064 4.587 . 0 0 "[ . 1 . 2]" 1
22 1 94 MET HA 1 94 MET QG 3.980 . 3.980 3.218 2.548 3.338 . 0 0 "[ . 1 . 2]" 1
23 1 118 SER QB 1 119 LYS QG 3.780 . 3.780 3.274 1.999 3.919 0.139 3 0 "[ . 1 . 2]" 1
24 1 108 LEU MD1 1 111 TYR QE 5.500 . 5.500 5.493 4.980 5.586 0.086 3 0 "[ . 1 . 2]" 1
25 1 111 TYR HA 1 112 SER HA 4.570 . 4.570 4.318 4.257 4.370 . 0 0 "[ . 1 . 2]" 1
26 1 31 GLN HG2 1 32 LEU HG 5.500 . 5.500 5.273 4.918 5.545 0.045 6 0 "[ . 1 . 2]" 1
27 1 45 CYS HB2 1 70 PHE QE 4.680 . 4.680 3.592 2.986 4.745 0.065 1 0 "[ . 1 . 2]" 1
28 1 100 LYS HB3 1 103 GLU H 5.470 . 5.470 5.236 5.122 5.409 . 0 0 "[ . 1 . 2]" 1
29 1 28 LYS HB2 1 28 LYS QE 4.400 . 4.400 4.234 4.202 4.431 0.031 12 0 "[ . 1 . 2]" 1
30 1 29 VAL HB 1 98 LEU MD1 5.290 . 5.290 4.397 3.615 5.307 0.017 2 0 "[ . 1 . 2]" 1
31 1 100 LYS QE 1 103 GLU HG3 5.500 . 5.500 5.426 4.980 5.598 0.098 7 0 "[ . 1 . 2]" 1
32 1 116 LYS QD 1 117 PHE QE 3.920 . 3.920 3.068 2.801 3.769 . 0 0 "[ . 1 . 2]" 1
33 1 47 ILE MG 1 49 GLU HB3 3.870 . 3.870 3.051 2.494 3.599 . 0 0 "[ . 1 . 2]" 1
34 1 48 GLU HB2 1 49 GLU HA 5.500 . 5.500 5.142 4.995 5.395 . 0 0 "[ . 1 . 2]" 1
35 1 49 GLU HB2 1 64 LEU H 5.500 . 5.500 5.424 4.962 5.627 0.127 10 0 "[ . 1 . 2]" 1
36 1 64 LEU MD2 1 65 THR H 5.140 . 5.140 3.789 1.886 4.429 . 0 0 "[ . 1 . 2]" 1
37 1 72 PHE HB2 1 94 MET ME 4.800 . 4.800 3.925 3.661 4.057 . 0 0 "[ . 1 . 2]" 1
38 1 79 VAL HB 1 80 ALA HA 5.130 . 5.130 4.736 4.660 4.799 . 0 0 "[ . 1 . 2]" 1
39 1 81 TYR H 1 97 ARG HD2 5.500 . 5.500 4.238 3.479 5.266 . 0 0 "[ . 1 . 2]" 1
40 1 81 TYR H 1 97 ARG HD3 5.500 . 5.500 4.197 3.268 5.228 . 0 0 "[ . 1 . 2]" 1
41 1 89 ASN HA 1 90 ALA MB 5.500 . 5.500 4.995 4.971 5.013 . 0 0 "[ . 1 . 2]" 1
42 1 102 LEU MD1 1 103 GLU HA 3.580 . 3.580 3.208 3.000 3.329 . 0 0 "[ . 1 . 2]" 1
43 1 30 TYR HA 1 31 GLN HA 5.500 . 5.500 4.855 4.834 4.901 . 0 0 "[ . 1 . 2]" 1
44 1 30 TYR QD 1 34 LYS QB 5.500 . 5.500 4.868 3.641 5.346 . 0 0 "[ . 1 . 2]" 1
45 1 58 LEU MD2 1 59 ASN HB3 4.650 . 4.650 4.772 4.088 4.921 0.271 6 0 "[ . 1 . 2]" 1
46 1 66 LYS QD 1 68 TYR QD 5.030 . 5.030 4.611 4.341 4.963 . 0 0 "[ . 1 . 2]" 1
47 1 24 ASP HA 1 25 ILE MG 4.600 . 4.600 4.527 3.977 4.721 0.121 6 0 "[ . 1 . 2]" 1
48 1 70 PHE HB2 1 91 LYS HA 4.170 . 4.170 3.611 3.148 4.046 . 0 0 "[ . 1 . 2]" 1
49 1 26 GLU QG 1 30 TYR QD 5.500 . 5.500 5.325 4.827 5.581 0.081 9 0 "[ . 1 . 2]" 1
50 1 30 TYR HB2 1 41 PHE HZ 5.500 . 5.500 5.554 5.505 5.589 0.089 12 0 "[ . 1 . 2]" 1
51 1 31 GLN HA 1 32 LEU MD1 5.340 . 5.340 5.346 5.251 5.408 0.068 5 0 "[ . 1 . 2]" 1
52 1 33 LEU MD2 1 74 ARG HD2 5.500 . 5.500 4.251 2.846 5.194 . 0 0 "[ . 1 . 2]" 1
53 1 49 GLU H 1 49 GLU HB3 3.870 . 3.870 2.736 2.371 3.448 . 0 0 "[ . 1 . 2]" 1
54 1 50 VAL H 1 66 LYS HB3 4.750 . 4.750 4.603 4.058 4.779 0.029 6 0 "[ . 1 . 2]" 1
55 1 66 LYS HB3 1 67 TYR H 4.970 . 4.970 4.132 4.077 4.190 . 0 0 "[ . 1 . 2]" 1
56 1 72 PHE HB2 1 98 LEU H 5.500 . 5.500 5.567 5.530 5.611 0.111 10 0 "[ . 1 . 2]" 1
57 1 83 LYS HA 1 90 ALA HA 5.450 . 5.450 4.192 3.727 4.576 . 0 0 "[ . 1 . 2]" 1
58 1 97 ARG H 1 97 ARG HD2 4.840 . 4.840 4.243 3.324 4.749 . 0 0 "[ . 1 . 2]" 1
59 1 98 LEU HA 1 98 LEU HG 4.010 . 4.010 2.905 2.828 3.125 . 0 0 "[ . 1 . 2]" 1
60 1 33 LEU H 1 36 GLN HG3 4.840 . 4.840 4.170 3.822 4.518 . 0 0 "[ . 1 . 2]" 1
61 1 45 CYS HB2 1 70 PHE HZ 5.210 . 5.210 3.864 3.435 5.227 0.017 1 0 "[ . 1 . 2]" 1
62 1 72 PHE HB3 1 80 ALA HA 5.070 . 5.070 4.405 4.213 4.546 . 0 0 "[ . 1 . 2]" 1
63 1 80 ALA HA 1 81 TYR HB3 5.500 . 5.500 4.727 4.559 5.000 . 0 0 "[ . 1 . 2]" 1
64 1 92 TYR QE 1 93 ILE H 5.030 . 5.030 4.976 4.675 5.065 0.035 15 0 "[ . 1 . 2]" 1
65 1 27 HIS HA 1 27 HIS HD2 4.090 . 4.090 2.962 2.230 4.117 0.027 9 0 "[ . 1 . 2]" 1
66 1 28 LYS HA 1 31 GLN H 4.030 . 4.030 3.468 3.381 3.608 . 0 0 "[ . 1 . 2]" 1
67 1 28 LYS HA 1 32 LEU MD2 5.280 . 5.280 4.528 4.287 4.760 . 0 0 "[ . 1 . 2]" 1
68 1 28 LYS HA 1 102 LEU MD2 5.050 . 5.050 4.179 4.026 4.329 . 0 0 "[ . 1 . 2]" 1
69 1 39 GLU HG3 1 40 ASP HA 5.050 . 5.050 5.115 5.006 5.190 0.140 5 0 "[ . 1 . 2]" 1
70 1 43 THR HA 1 44 LYS HB3 4.640 . 4.640 4.462 4.368 4.577 . 0 0 "[ . 1 . 2]" 1
71 1 43 THR HA 1 44 LYS QG 4.770 . 4.770 4.188 3.971 4.382 . 0 0 "[ . 1 . 2]" 1
72 1 44 LYS QG 1 71 SER HA 5.160 . 5.160 4.234 3.920 5.044 . 0 0 "[ . 1 . 2]" 1
73 1 60 THR HA 1 60 THR MG 2.720 . 2.720 2.238 2.168 2.346 . 0 0 "[ . 1 . 2]" 1
74 1 70 PHE QE 1 91 LYS QE 4.620 . 4.620 4.148 2.948 4.437 . 0 0 "[ . 1 . 2]" 1
75 1 74 ARG HD2 1 111 TYR QE 4.670 . 4.670 4.171 2.784 4.719 0.049 20 0 "[ . 1 . 2]" 1
76 1 75 HIS H 1 75 HIS HD2 4.060 . 4.060 3.137 3.016 3.251 . 0 0 "[ . 1 . 2]" 1
77 1 113 CYS HA 1 114 ASN HA 4.580 . 4.580 4.412 4.358 4.484 . 0 0 "[ . 1 . 2]" 1
78 1 116 LYS QE 1 117 PHE QD 4.050 . 4.050 2.047 1.877 2.385 . 0 0 "[ . 1 . 2]" 1
79 1 119 LYS H 1 119 LYS QE 4.620 . 4.620 3.567 2.646 4.628 0.008 7 0 "[ . 1 . 2]" 1
80 1 32 LEU MD1 1 110 LEU MD2 3.430 . 3.430 2.068 1.938 2.223 . 0 0 "[ . 1 . 2]" 1
81 1 34 LYS QB 1 41 PHE HZ 4.260 . 4.260 2.477 2.251 2.656 . 0 0 "[ . 1 . 2]" 1
82 1 44 LYS QG 1 78 ILE MD 3.740 . 3.740 3.507 3.182 3.883 0.143 4 0 "[ . 1 . 2]" 1
83 1 46 VAL QG 1 81 TYR QE 5.270 . 5.270 4.477 3.031 5.386 0.116 9 0 "[ . 1 . 2]" 1
84 1 50 VAL HB 1 65 THR MG 3.890 . 3.890 3.514 3.235 3.918 0.028 2 0 "[ . 1 . 2]" 1
85 1 72 PHE QD 1 94 MET ME 4.450 . 4.450 3.718 3.384 4.071 . 0 0 "[ . 1 . 2]" 1
86 1 79 VAL MG1 1 97 ARG QB 4.290 . 4.290 3.609 3.346 3.815 . 0 0 "[ . 1 . 2]" 1
87 1 109 LEU HG 1 110 LEU HA 4.560 . 4.560 3.556 3.279 3.755 . 0 0 "[ . 1 . 2]" 1
88 1 116 LYS QE 1 117 PHE H 4.300 . 4.300 4.125 3.831 4.331 0.031 12 0 "[ . 1 . 2]" 1
89 1 32 LEU MD2 1 105 LYS HD2 4.810 . 4.810 4.490 3.902 4.872 0.062 7 0 "[ . 1 . 2]" 1
90 1 32 LEU MD2 1 110 LEU MD2 2.700 . 2.700 2.191 1.938 2.460 . 0 0 "[ . 1 . 2]" 1
91 1 32 LEU MD1 1 36 GLN HE21 4.150 . 4.150 3.133 2.376 3.596 . 0 0 "[ . 1 . 2]" 1
92 1 40 ASP HB3 1 41 PHE QD 4.500 . 4.500 4.088 3.825 4.292 . 0 0 "[ . 1 . 2]" 1
93 1 45 CYS HA 1 70 PHE QE 4.930 . 4.930 4.492 4.005 4.867 . 0 0 "[ . 1 . 2]" 1
94 1 50 VAL H 1 66 LYS HA 3.870 . 3.870 2.409 2.156 2.601 . 0 0 "[ . 1 . 2]" 1
95 1 68 TYR QD 1 87 VAL HB 4.330 . 4.330 2.639 2.073 3.361 . 0 0 "[ . 1 . 2]" 1
96 1 78 ILE MG 1 80 ALA HA 3.970 . 3.970 3.748 3.610 3.901 . 0 0 "[ . 1 . 2]" 1
97 1 100 LYS QE 1 104 ASP H 3.780 . 3.780 3.616 3.455 3.775 . 0 0 "[ . 1 . 2]" 1
98 1 108 LEU MD2 1 110 LEU H 5.160 . 5.160 4.906 4.825 4.968 . 0 0 "[ . 1 . 2]" 1
99 1 116 LYS HB2 1 117 PHE QD 4.330 . 4.330 3.049 2.674 3.285 . 0 0 "[ . 1 . 2]" 1
100 1 43 THR MG 1 72 PHE HZ 5.130 . 5.130 4.576 4.294 4.866 . 0 0 "[ . 1 . 2]" 1
101 1 44 LYS HB3 1 73 PHE QD 4.190 . 4.190 2.737 2.107 3.376 . 0 0 "[ . 1 . 2]" 1
102 1 50 VAL HA 1 50 VAL MG1 3.550 . 3.550 2.404 2.317 2.466 . 0 0 "[ . 1 . 2]" 1
103 1 80 ALA HA 1 97 ARG QB 5.010 . 5.010 2.453 2.250 2.709 . 0 0 "[ . 1 . 2]" 1
104 1 84 SER QB 1 90 ALA MB 3.280 . 3.280 1.914 1.779 2.067 0.021 13 0 "[ . 1 . 2]" 1
105 1 87 VAL HA 1 88 ALA MB 5.100 . 5.100 5.023 4.985 5.046 . 0 0 "[ . 1 . 2]" 1
106 1 92 TYR HA 1 95 LYS QD 3.950 . 3.950 2.524 2.062 3.637 . 0 0 "[ . 1 . 2]" 1
107 1 99 LEU MD1 1 100 LYS HA 4.310 . 4.310 2.977 2.639 4.393 0.083 4 0 "[ . 1 . 2]" 1
108 1 111 TYR QE 1 112 SER HA 5.500 . 5.500 5.369 5.116 5.551 0.051 20 0 "[ . 1 . 2]" 1
109 1 32 LEU MD1 1 102 LEU HA 4.610 . 4.610 4.643 4.561 4.677 0.067 9 0 "[ . 1 . 2]" 1
110 1 43 THR HA 1 72 PHE HB3 5.500 . 5.500 5.087 4.964 5.297 . 0 0 "[ . 1 . 2]" 1
111 1 44 LYS QG 1 81 TYR QE 5.500 . 5.500 5.285 4.467 5.626 0.126 20 0 "[ . 1 . 2]" 1
112 1 66 LYS HA 1 66 LYS QE 4.750 . 4.750 4.889 4.832 4.952 0.202 15 0 "[ . 1 . 2]" 1
113 1 69 GLY HA3 1 83 LYS HA 4.770 . 4.770 4.341 3.811 4.667 . 0 0 "[ . 1 . 2]" 1
114 1 25 ILE MG 1 96 GLN H 5.500 . 5.500 4.901 4.787 5.130 . 0 0 "[ . 1 . 2]" 1
115 1 93 ILE QG 1 94 MET H 4.660 . 4.660 3.968 3.867 4.015 . 0 0 "[ . 1 . 2]" 1
116 1 96 GLN HB2 1 97 ARG H 3.490 . 3.490 3.050 2.832 3.248 . 0 0 "[ . 1 . 2]" 1
117 1 97 ARG H 1 97 ARG QB 3.600 . 3.600 2.447 2.369 2.546 . 0 0 "[ . 1 . 2]" 1
118 1 109 LEU HA 1 109 LEU HG 3.920 . 3.920 3.071 2.932 3.187 . 0 0 "[ . 1 . 2]" 1
119 1 28 LYS HA 1 102 LEU MD1 4.720 . 4.720 4.634 4.225 4.771 0.051 4 0 "[ . 1 . 2]" 1
120 1 115 CYS QB 1 116 LYS HA 4.610 . 4.610 4.431 4.156 4.612 0.002 15 0 "[ . 1 . 2]" 1
121 1 118 SER QB 1 119 LYS HA 4.690 . 4.690 4.277 3.937 4.449 . 0 0 "[ . 1 . 2]" 1
122 1 32 LEU MD2 1 102 LEU HB2 3.730 . 3.730 2.329 2.145 2.510 . 0 0 "[ . 1 . 2]" 1
123 1 32 LEU MD2 1 105 LYS QE 4.240 . 4.240 3.787 3.290 4.308 0.068 3 0 "[ . 1 . 2]" 1
124 1 45 CYS HA 1 70 PHE HA 3.820 . 3.820 2.533 2.174 2.930 . 0 0 "[ . 1 . 2]" 1
125 1 67 TYR HA 1 68 TYR QD 4.040 . 4.040 3.658 3.394 4.094 0.054 20 0 "[ . 1 . 2]" 1
126 1 72 PHE HB3 1 78 ILE MD 4.880 . 4.880 4.915 4.886 4.963 0.083 18 0 "[ . 1 . 2]" 1
127 1 84 SER HA 1 93 ILE MD 4.710 . 4.710 4.263 3.895 4.512 . 0 0 "[ . 1 . 2]" 1
128 1 100 LYS H 1 102 LEU MD2 4.820 . 4.820 4.912 4.893 4.947 0.127 3 0 "[ . 1 . 2]" 1
129 1 101 LEU HA 1 110 LEU MD2 5.500 . 5.500 5.585 5.535 5.618 0.118 14 0 "[ . 1 . 2]" 1
130 1 28 LYS QD 1 28 LYS HG2 2.550 . 2.550 2.328 2.300 2.353 . 0 0 "[ . 1 . 2]" 1
131 1 114 ASN HD22 1 117 PHE HA 4.170 . 4.170 2.900 2.153 4.214 0.044 1 0 "[ . 1 . 2]" 1
132 1 121 LYS HA 1 121 LYS QE 4.100 . 4.100 3.967 3.370 4.323 0.223 20 0 "[ . 1 . 2]" 1
133 1 31 GLN HE21 1 34 LYS QE 4.890 . 4.890 3.882 2.712 4.954 0.064 5 0 "[ . 1 . 2]" 1
134 1 34 LYS HA 1 41 PHE QE 4.410 . 4.410 3.461 3.279 3.800 . 0 0 "[ . 1 . 2]" 1
135 1 45 CYS HA 1 70 PHE HB3 5.500 . 5.500 5.017 4.756 5.338 . 0 0 "[ . 1 . 2]" 1
136 1 45 CYS HA 1 70 PHE QD 4.460 . 4.460 3.937 3.699 4.174 . 0 0 "[ . 1 . 2]" 1
137 1 50 VAL H 1 66 LYS H 4.900 . 4.900 4.637 4.503 4.763 . 0 0 "[ . 1 . 2]" 1
138 1 70 PHE HZ 1 91 LYS QE 4.500 . 4.500 4.105 2.134 4.532 0.032 6 0 "[ . 1 . 2]" 1
139 1 70 PHE QD 1 87 VAL MG1 5.500 . 5.500 5.660 5.562 5.770 0.270 20 0 "[ . 1 . 2]" 1
140 1 72 PHE HB3 1 94 MET ME 5.420 . 5.420 5.386 5.130 5.481 0.061 13 0 "[ . 1 . 2]" 1
141 1 73 PHE HZ 1 78 ILE HG12 4.150 . 4.150 4.178 4.074 4.226 0.076 19 0 "[ . 1 . 2]" 1
142 1 25 ILE HA 1 102 LEU MD2 5.020 . 5.020 3.888 3.763 4.103 . 0 0 "[ . 1 . 2]" 1
143 1 25 ILE HA 1 28 LYS HG2 4.110 . 4.110 1.992 1.800 2.079 . 0 0 "[ . 1 . 2]" 1
144 1 25 ILE MG 1 72 PHE QD 4.130 . 4.130 4.158 3.950 4.232 0.102 2 0 "[ . 1 . 2]" 1
145 1 94 MET QG 1 95 LYS HA 4.610 . 4.610 3.213 3.128 3.282 . 0 0 "[ . 1 . 2]" 1
146 1 97 ARG HA 1 97 ARG HD2 4.000 . 4.000 2.821 1.999 3.965 . 0 0 "[ . 1 . 2]" 1
147 1 97 ARG QB 1 99 LEU H 4.230 . 4.230 4.199 4.141 4.245 0.015 17 0 "[ . 1 . 2]" 1
148 1 30 TYR H 1 32 LEU MD1 4.760 . 4.760 4.471 4.368 4.578 . 0 0 "[ . 1 . 2]" 1
149 1 48 GLU H 1 68 TYR HA 4.020 . 4.020 3.446 3.096 3.714 . 0 0 "[ . 1 . 2]" 1
150 1 81 TYR HA 1 94 MET HA 4.740 . 4.740 4.303 4.101 4.619 . 0 0 "[ . 1 . 2]" 1
151 1 81 TYR QE 1 82 GLY H 4.340 . 4.340 4.298 3.944 4.387 0.047 7 0 "[ . 1 . 2]" 1
152 1 83 LYS QD 1 84 SER HA 5.500 . 5.500 5.304 4.833 5.567 0.067 3 0 "[ . 1 . 2]" 1
153 1 109 LEU H 1 109 LEU HG 5.080 . 5.080 4.286 4.218 4.343 . 0 0 "[ . 1 . 2]" 1
154 1 41 PHE H 1 41 PHE QD 3.990 . 3.990 3.426 3.278 3.489 . 0 0 "[ . 1 . 2]" 1
155 1 67 TYR QE 1 83 LYS QD 5.340 . 5.340 5.084 3.954 5.423 0.083 1 0 "[ . 1 . 2]" 1
156 1 72 PHE H 1 81 TYR QD 5.040 . 5.040 4.867 4.543 5.063 0.023 14 0 "[ . 1 . 2]" 1
157 1 79 VAL MG1 1 98 LEU HG 4.510 . 4.510 2.608 2.302 2.799 . 0 0 "[ . 1 . 2]" 1
158 1 95 LYS HA 1 99 LEU H 4.880 . 4.880 4.085 3.943 4.306 . 0 0 "[ . 1 . 2]" 1
159 1 101 LEU H 1 102 LEU HG 3.860 . 3.860 3.872 3.803 3.915 0.055 16 0 "[ . 1 . 2]" 1
160 1 28 LYS QD 1 31 GLN HG2 4.930 . 4.930 4.131 3.678 4.571 . 0 0 "[ . 1 . 2]" 1
161 1 44 LYS QD 1 71 SER H 4.580 . 4.580 4.001 3.032 4.667 0.087 15 0 "[ . 1 . 2]" 1
162 1 48 GLU H 1 67 TYR QD 5.500 . 5.500 5.389 5.093 5.537 0.037 14 0 "[ . 1 . 2]" 1
163 1 48 GLU HB2 1 69 GLY H 4.490 . 4.490 4.119 3.859 4.265 . 0 0 "[ . 1 . 2]" 1
164 1 56 THR MG 1 58 LEU QB 4.420 . 4.420 4.167 2.018 4.552 0.132 7 0 "[ . 1 . 2]" 1
165 1 57 LEU HA 1 57 LEU HB2 2.990 . 2.990 2.887 2.403 3.024 0.034 19 0 "[ . 1 . 2]" 1
166 1 66 LYS QE 1 68 TYR HA 4.720 . 4.720 4.766 4.629 4.851 0.131 13 0 "[ . 1 . 2]" 1
167 1 79 VAL H 1 80 ALA HA 5.100 . 5.100 4.861 4.785 4.955 . 0 0 "[ . 1 . 2]" 1
168 1 25 ILE MD 1 102 LEU MD2 3.390 . 3.390 1.728 1.704 1.771 0.096 1 0 "[ . 1 . 2]" 1
169 1 116 LYS QE 1 117 PHE HZ 4.140 . 4.140 4.140 3.747 4.204 0.064 9 0 "[ . 1 . 2]" 1
170 1 39 GLU HG2 1 40 ASP HA 5.050 . 5.050 3.531 3.250 4.229 . 0 0 "[ . 1 . 2]" 1
171 1 64 LEU MD2 1 65 THR HB 5.500 . 5.500 5.016 3.150 5.602 0.102 15 0 "[ . 1 . 2]" 1
172 1 70 PHE HB2 1 82 GLY H 4.510 . 4.510 3.821 3.534 4.034 . 0 0 "[ . 1 . 2]" 1
173 1 75 HIS HE1 1 114 ASN QB 5.500 . 5.500 4.914 4.289 5.499 . 0 0 "[ . 1 . 2]" 1
174 1 25 ILE MD 1 98 LEU HG 5.500 . 5.500 4.499 4.086 5.118 . 0 0 "[ . 1 . 2]" 1
175 1 25 ILE MG 1 98 LEU HG 5.470 . 5.470 4.625 4.396 5.164 . 0 0 "[ . 1 . 2]" 1
176 1 94 MET QG 1 95 LYS H 3.900 . 3.900 2.167 1.950 3.272 . 0 0 "[ . 1 . 2]" 1
177 1 100 LYS HB3 1 100 LYS HD2 3.800 . 3.800 3.121 3.026 3.193 . 0 0 "[ . 1 . 2]" 1
178 1 101 LEU MD2 1 109 LEU HB3 4.800 . 4.800 3.400 2.117 4.250 . 0 0 "[ . 1 . 2]" 1
179 1 104 ASP HA 1 105 LYS HA 5.500 . 5.500 5.210 5.176 5.251 . 0 0 "[ . 1 . 2]" 1
180 1 107 ASN HA 1 110 LEU HB2 4.700 . 4.700 2.505 2.209 2.873 . 0 0 "[ . 1 . 2]" 1
181 1 111 TYR QE 1 113 CYS HB2 4.140 . 4.140 3.153 2.773 3.631 . 0 0 "[ . 1 . 2]" 1
182 1 121 LYS HA 1 121 LYS QD 3.400 . 3.400 2.355 1.662 3.188 0.138 7 0 "[ . 1 . 2]" 1
183 1 40 ASP HB2 1 75 HIS HE1 5.500 . 5.500 5.214 4.742 5.521 0.021 19 0 "[ . 1 . 2]" 1
184 1 70 PHE HZ 1 91 LYS HB2 5.500 . 5.500 4.956 3.661 5.658 0.158 19 0 "[ . 1 . 2]" 1
185 1 73 PHE HZ 1 78 ILE MD 3.920 . 3.920 3.080 2.650 3.533 . 0 0 "[ . 1 . 2]" 1
186 1 75 HIS HD2 1 113 CYS HB3 5.030 . 5.030 4.750 4.615 4.883 . 0 0 "[ . 1 . 2]" 1
187 1 77 ASN HB2 1 78 ILE H 3.480 . 3.480 3.161 3.020 3.364 . 0 0 "[ . 1 . 2]" 1
188 1 25 ILE HA 1 28 LYS HA 5.500 . 5.500 5.155 5.040 5.309 . 0 0 "[ . 1 . 2]" 1
189 1 98 LEU HB2 1 102 LEU MD2 5.280 . 5.280 2.928 2.792 3.089 . 0 0 "[ . 1 . 2]" 1
190 1 100 LYS HA 1 102 LEU MD1 5.330 . 5.330 4.984 4.780 5.262 . 0 0 "[ . 1 . 2]" 1
191 1 100 LYS QG 1 103 GLU QB 4.430 . 4.430 4.249 4.027 4.459 0.029 12 0 "[ . 1 . 2]" 1
192 1 101 LEU HA 1 106 SER H 3.490 . 3.490 2.853 2.543 3.018 . 0 0 "[ . 1 . 2]" 1
193 1 102 LEU HG 1 103 GLU QB 5.090 . 5.090 4.383 4.182 4.521 . 0 0 "[ . 1 . 2]" 1
194 1 105 LYS HA 1 105 LYS HG2 3.550 . 3.550 3.020 2.916 3.166 . 0 0 "[ . 1 . 2]" 1
195 1 106 SER H 1 106 SER HB2 3.710 . 3.710 2.569 2.475 2.689 . 0 0 "[ . 1 . 2]" 1
196 1 28 LYS HA 1 28 LYS QE 4.600 . 4.600 4.274 4.080 4.436 . 0 0 "[ . 1 . 2]" 1
197 1 119 LYS HB3 1 119 LYS QD 3.170 . 3.170 2.587 2.290 3.101 . 0 0 "[ . 1 . 2]" 1
198 1 58 LEU HG 1 62 LEU H 3.400 . 3.400 3.313 2.142 3.550 0.150 7 0 "[ . 1 . 2]" 1
199 1 66 LYS QD 1 67 TYR H 4.550 . 4.550 4.235 4.086 4.350 . 0 0 "[ . 1 . 2]" 1
200 1 67 TYR H 1 83 LYS QD 5.040 . 5.040 4.676 4.299 5.053 0.013 11 0 "[ . 1 . 2]" 1
201 1 72 PHE HB3 1 98 LEU H 5.500 . 5.500 5.529 5.433 5.584 0.084 3 0 "[ . 1 . 2]" 1
202 1 25 ILE MD 1 29 VAL HA 4.670 . 4.670 4.424 4.152 4.769 0.099 2 0 "[ . 1 . 2]" 1
203 1 84 SER HA 1 90 ALA HA 4.910 . 4.910 4.838 4.615 4.951 0.041 11 0 "[ . 1 . 2]" 1
204 1 26 GLU HA 1 29 VAL HB 4.890 . 4.890 3.489 2.608 4.262 . 0 0 "[ . 1 . 2]" 1
205 1 92 TYR HA 1 95 LYS HB3 4.400 . 4.400 4.243 3.890 4.411 0.011 12 0 "[ . 1 . 2]" 1
206 1 94 MET ME 1 95 LYS QE 4.520 . 4.520 2.728 2.304 4.044 . 0 0 "[ . 1 . 2]" 1
207 1 99 LEU MD1 1 103 GLU H 5.260 . 5.260 4.190 3.979 4.502 . 0 0 "[ . 1 . 2]" 1
208 1 99 LEU MD2 1 100 LYS HA 4.310 . 4.310 4.223 3.758 4.331 0.021 11 0 "[ . 1 . 2]" 1
209 1 101 LEU HA 1 102 LEU HA 5.270 . 5.270 4.625 4.597 4.657 . 0 0 "[ . 1 . 2]" 1
210 1 105 LYS QE 1 110 LEU MD1 4.470 . 4.470 3.146 2.194 3.942 . 0 0 "[ . 1 . 2]" 1
211 1 117 PHE QE 1 118 SER QB 4.980 . 4.980 5.024 3.675 5.279 0.299 4 0 "[ . 1 . 2]" 1
212 1 49 GLU HB2 1 66 LYS HG3 5.500 . 5.500 5.382 4.812 5.684 0.184 20 0 "[ . 1 . 2]" 1
213 1 50 VAL HB 1 65 THR HB 4.580 . 4.580 3.077 2.486 3.507 . 0 0 "[ . 1 . 2]" 1
214 1 50 VAL HB 1 67 TYR QE 3.970 . 3.970 2.957 2.269 3.728 . 0 0 "[ . 1 . 2]" 1
215 1 70 PHE H 1 83 LYS QB 4.700 . 4.700 4.259 3.603 4.762 0.062 10 0 "[ . 1 . 2]" 1
216 1 71 SER H 1 72 PHE H 4.460 . 4.460 4.317 4.208 4.379 . 0 0 "[ . 1 . 2]" 1
217 1 78 ILE MG 1 79 VAL HA 3.920 . 3.920 3.739 3.614 3.878 . 0 0 "[ . 1 . 2]" 1
218 1 25 ILE HA 1 28 LYS QD 4.040 . 4.040 4.054 3.859 4.157 0.117 16 0 "[ . 1 . 2]" 1
219 1 100 LYS QE 1 103 GLU H 4.970 . 4.970 4.929 4.646 5.022 0.052 4 0 "[ . 1 . 2]" 1
220 1 107 ASN HB3 1 110 LEU MD1 5.500 . 5.500 5.289 4.771 5.540 0.040 11 0 "[ . 1 . 2]" 1
221 1 30 TYR H 1 30 TYR QE 4.550 . 4.550 4.404 4.250 4.563 0.013 3 0 "[ . 1 . 2]" 1
222 1 33 LEU HB2 1 41 PHE QE 4.420 . 4.420 3.193 2.962 3.649 . 0 0 "[ . 1 . 2]" 1
223 1 33 LEU HB3 1 34 LYS QB 5.500 . 5.500 4.725 4.186 4.855 . 0 0 "[ . 1 . 2]" 1
224 1 58 LEU HG 1 59 ASN HB3 4.730 . 4.730 3.348 3.042 3.567 . 0 0 "[ . 1 . 2]" 1
225 1 67 TYR QD 1 83 LYS HG2 4.220 . 4.220 3.181 2.324 4.250 0.030 11 0 "[ . 1 . 2]" 1
226 1 79 VAL MG1 1 80 ALA HA 4.520 . 4.520 3.802 3.586 3.952 . 0 0 "[ . 1 . 2]" 1
227 1 25 ILE MD 1 98 LEU H 4.690 . 4.690 4.097 3.818 4.674 . 0 0 "[ . 1 . 2]" 1
228 1 93 ILE MG 1 97 ARG HG3 4.420 . 4.420 3.588 3.380 3.827 . 0 0 "[ . 1 . 2]" 1
229 1 99 LEU MD1 1 103 GLU QB 4.900 . 4.900 3.430 3.155 4.034 . 0 0 "[ . 1 . 2]" 1
230 1 100 LYS HB3 1 100 LYS HD3 3.800 . 3.800 3.703 3.668 3.750 . 0 0 "[ . 1 . 2]" 1
231 1 105 LYS QE 1 105 LYS HG2 3.530 . 3.530 3.186 2.467 3.512 . 0 0 "[ . 1 . 2]" 1
232 1 109 LEU HA 1 110 LEU HG 4.480 . 4.480 4.501 4.434 4.552 0.072 17 0 "[ . 1 . 2]" 1
233 1 29 VAL HA 1 109 LEU MD2 4.800 . 4.800 2.846 2.703 3.123 . 0 0 "[ . 1 . 2]" 1
234 1 32 LEU MD2 1 102 LEU HA 3.790 . 3.790 3.375 3.201 3.587 . 0 0 "[ . 1 . 2]" 1
235 1 47 ILE MG 1 48 GLU HG3 5.430 . 5.430 4.858 4.472 5.120 . 0 0 "[ . 1 . 2]" 1
236 1 66 LYS QD 1 67 TYR QD 5.300 . 5.300 5.084 4.624 5.326 0.026 1 0 "[ . 1 . 2]" 1
237 1 68 TYR H 1 84 SER H 3.700 . 3.700 3.112 2.682 3.379 . 0 0 "[ . 1 . 2]" 1
238 1 69 GLY HA2 1 83 LYS HA 4.580 . 4.580 2.612 2.104 2.940 . 0 0 "[ . 1 . 2]" 1
239 1 71 SER HA 1 81 TYR QE 5.500 . 5.500 5.245 4.872 5.529 0.029 14 0 "[ . 1 . 2]" 1
240 1 78 ILE HA 1 79 VAL MG2 3.970 . 3.970 3.826 3.738 3.889 . 0 0 "[ . 1 . 2]" 1
241 1 79 VAL MG2 1 109 LEU HB3 4.720 . 4.720 4.611 4.413 4.749 0.029 15 0 "[ . 1 . 2]" 1
242 1 84 SER HA 1 89 ASN HB3 5.190 . 5.190 4.860 4.682 5.155 . 0 0 "[ . 1 . 2]" 1
243 1 91 LYS HA 1 94 MET QG 5.070 . 5.070 2.482 1.981 4.490 . 0 0 "[ . 1 . 2]" 1
244 1 92 TYR H 1 95 LYS HB2 5.500 . 5.500 4.928 4.675 5.057 . 0 0 "[ . 1 . 2]" 1
245 1 92 TYR QD 1 95 LYS HB2 4.990 . 4.990 4.568 4.272 4.843 . 0 0 "[ . 1 . 2]" 1
246 1 95 LYS HB2 1 97 ARG H 5.500 . 5.500 4.824 4.712 4.961 . 0 0 "[ . 1 . 2]" 1
247 1 27 HIS HA 1 28 LYS QD 4.950 . 4.950 4.986 4.782 5.041 0.091 5 0 "[ . 1 . 2]" 1
248 1 101 LEU HA 1 109 LEU HB3 5.500 . 5.500 4.870 4.493 5.068 . 0 0 "[ . 1 . 2]" 1
249 1 101 LEU MD1 1 109 LEU H 4.100 . 4.100 3.315 2.575 4.308 0.208 13 0 "[ . 1 . 2]" 1
250 1 102 LEU HG 1 104 ASP H 5.250 . 5.250 4.956 4.724 5.077 . 0 0 "[ . 1 . 2]" 1
251 1 105 LYS HG2 1 106 SER H 5.370 . 5.370 4.929 4.831 5.014 . 0 0 "[ . 1 . 2]" 1
252 1 109 LEU HB3 1 110 LEU HA 5.500 . 5.500 4.557 4.426 4.721 . 0 0 "[ . 1 . 2]" 1
253 1 117 PHE HA 1 117 PHE QD 3.870 . 3.870 3.717 3.698 3.735 . 0 0 "[ . 1 . 2]" 1
254 1 119 LYS HB2 1 119 LYS QE 4.530 . 4.530 3.224 1.762 4.457 0.038 15 0 "[ . 1 . 2]" 1
255 1 30 TYR HA 1 33 LEU H 3.960 . 3.960 3.893 3.738 3.987 0.027 20 0 "[ . 1 . 2]" 1
256 1 37 GLY H 1 38 CYS HA 4.900 . 4.900 4.832 4.589 4.984 0.084 11 0 "[ . 1 . 2]" 1
257 1 43 THR MG 1 72 PHE HB3 4.800 . 4.800 4.270 4.037 4.560 . 0 0 "[ . 1 . 2]" 1
258 1 45 CYS HA 1 46 VAL QG 4.040 . 4.040 3.864 3.742 4.079 0.039 4 0 "[ . 1 . 2]" 1
259 1 56 THR HA 1 56 THR MG 3.190 . 3.190 2.956 2.150 3.218 0.028 16 0 "[ . 1 . 2]" 1
260 1 66 LYS HG2 1 68 TYR H 4.930 . 4.930 4.495 4.100 4.853 . 0 0 "[ . 1 . 2]" 1
261 1 70 PHE QE 1 87 VAL MG2 4.390 . 4.390 1.756 1.723 1.787 0.077 7 0 "[ . 1 . 2]" 1
262 1 71 SER HA 1 78 ILE MD 4.310 . 4.310 3.940 3.640 4.303 . 0 0 "[ . 1 . 2]" 1
263 1 25 ILE MG 1 95 LYS HA 3.450 . 3.450 1.804 1.720 2.275 0.080 3 0 "[ . 1 . 2]" 1
264 1 87 VAL H 1 90 ALA MB 4.670 . 4.670 4.665 4.544 4.737 0.067 2 0 "[ . 1 . 2]" 1
265 1 26 GLU QG 1 43 THR MG 3.620 . 3.620 2.417 2.197 2.837 . 0 0 "[ . 1 . 2]" 1
266 1 97 ARG HA 1 98 LEU HA 5.230 . 5.230 4.685 4.637 4.733 . 0 0 "[ . 1 . 2]" 1
267 1 98 LEU HA 1 101 LEU HA 5.500 . 5.500 4.910 4.737 5.173 . 0 0 "[ . 1 . 2]" 1
268 1 111 TYR QD 1 112 SER HA 4.700 . 4.700 3.809 3.654 3.944 . 0 0 "[ . 1 . 2]" 1
269 1 114 ASN HA 1 115 CYS QB 5.380 . 5.380 4.650 4.430 4.968 . 0 0 "[ . 1 . 2]" 1
270 1 29 VAL HA 1 109 LEU MD1 4.800 . 4.800 4.096 3.610 4.359 . 0 0 "[ . 1 . 2]" 1
271 1 120 LYS H 1 120 LYS QG 4.220 . 4.220 3.676 1.800 4.135 . 0 0 "[ . 1 . 2]" 1
272 1 121 LYS QE 1 121 LYS QG 2.990 . 2.990 2.310 2.128 2.712 . 0 0 "[ . 1 . 2]" 1
273 1 31 GLN H 1 34 LYS QB 5.500 . 5.500 5.535 5.419 5.615 0.115 14 0 "[ . 1 . 2]" 1
274 1 31 GLN QB 1 32 LEU HB2 5.500 . 5.500 5.074 4.915 5.190 . 0 0 "[ . 1 . 2]" 1
275 1 32 LEU HB2 1 36 GLN HG3 3.820 . 3.820 3.543 3.290 3.847 0.027 4 0 "[ . 1 . 2]" 1
276 1 32 LEU MD1 1 36 GLN HG3 4.900 . 4.900 4.098 3.909 4.337 . 0 0 "[ . 1 . 2]" 1
277 1 33 LEU H 1 36 GLN HG2 5.500 . 5.500 5.417 5.258 5.545 0.045 6 0 "[ . 1 . 2]" 1
278 1 36 GLN HG2 1 38 CYS H 5.500 . 5.500 5.679 5.569 5.760 0.260 11 0 "[ . 1 . 2]" 1
279 1 45 CYS HA 1 70 PHE H 5.000 . 5.000 4.569 4.190 5.049 0.049 6 0 "[ . 1 . 2]" 1
280 1 48 GLU HB3 1 67 TYR H 5.350 . 5.350 4.940 4.491 5.355 0.005 14 0 "[ . 1 . 2]" 1
281 1 64 LEU HB3 1 64 LEU MD1 3.310 . 3.310 2.925 2.250 3.208 . 0 0 "[ . 1 . 2]" 1
282 1 25 ILE MD 1 102 LEU MD1 3.060 . 3.060 3.152 3.043 3.204 0.144 10 0 "[ . 1 . 2]" 1
283 1 26 GLU H 1 28 LYS QE 5.360 . 5.360 5.449 5.381 5.549 0.189 8 0 "[ . 1 . 2]" 1
284 1 90 ALA MB 1 94 MET ME 5.500 . 5.500 5.380 5.149 5.509 0.009 4 0 "[ . 1 . 2]" 1
285 1 105 LYS QE 1 110 LEU MD2 4.500 . 4.500 4.058 3.283 4.535 0.035 14 0 "[ . 1 . 2]" 1
286 1 28 LYS HA 1 31 GLN HG3 4.690 . 4.690 3.156 2.817 3.612 . 0 0 "[ . 1 . 2]" 1
287 1 116 LYS H 1 117 PHE HA 4.400 . 4.400 4.108 3.799 4.409 0.009 9 0 "[ . 1 . 2]" 1
288 1 119 LYS QE 1 119 LYS QG 2.850 . 2.850 2.309 2.082 2.843 . 0 0 "[ . 1 . 2]" 1
289 1 29 VAL HA 1 31 GLN H 4.680 . 4.680 4.305 4.044 4.595 . 0 0 "[ . 1 . 2]" 1
290 1 44 LYS QG 1 73 PHE QD 3.860 . 3.860 2.481 1.853 3.357 . 0 0 "[ . 1 . 2]" 1
291 1 50 VAL MG2 1 65 THR HB 4.550 . 4.550 4.311 3.581 4.662 0.112 6 0 "[ . 1 . 2]" 1
292 1 67 TYR QD 1 84 SER HA 4.250 . 4.250 2.305 1.805 3.148 . 0 0 "[ . 1 . 2]" 1
293 1 72 PHE H 1 78 ILE MD 4.520 . 4.520 3.514 3.342 3.741 . 0 0 "[ . 1 . 2]" 1
294 1 74 ARG HB2 1 79 VAL MG2 4.190 . 4.190 2.375 1.796 2.901 0.004 20 0 "[ . 1 . 2]" 1
295 1 78 ILE MG 1 81 TYR QE 4.950 . 4.950 4.608 3.693 5.004 0.054 11 0 "[ . 1 . 2]" 1
296 1 25 ILE HG13 1 99 LEU HB2 4.740 . 4.740 2.984 2.064 4.750 0.010 18 0 "[ . 1 . 2]" 1
297 1 84 SER QB 1 90 ALA H 4.040 . 4.040 2.291 2.250 2.345 . 0 0 "[ . 1 . 2]" 1
298 1 90 ALA HA 1 92 TYR QD 5.500 . 5.500 5.517 5.120 5.594 0.094 11 0 "[ . 1 . 2]" 1
299 1 91 LYS HA 1 94 MET ME 3.900 . 3.900 2.701 2.349 2.878 . 0 0 "[ . 1 . 2]" 1
300 1 93 ILE HA 1 96 GLN H 4.080 . 4.080 3.723 3.515 3.886 . 0 0 "[ . 1 . 2]" 1
301 1 94 MET ME 1 95 LYS HA 3.490 . 3.490 3.525 3.481 3.563 0.073 4 0 "[ . 1 . 2]" 1
302 1 28 LYS QE 1 102 LEU MD2 5.020 . 5.020 4.788 4.623 5.054 0.034 12 0 "[ . 1 . 2]" 1
303 1 116 LYS QE 1 117 PHE HB2 5.500 . 5.500 5.327 5.109 5.517 0.017 10 0 "[ . 1 . 2]" 1
304 1 29 VAL HA 1 32 LEU HB2 5.500 . 5.500 5.460 5.309 5.534 0.034 16 0 "[ . 1 . 2]" 1
305 1 37 GLY H 1 38 CYS HB2 5.180 . 5.180 4.403 4.052 4.621 . 0 0 "[ . 1 . 2]" 1
306 1 37 GLY H 1 38 CYS HB3 5.180 . 5.180 4.767 4.478 5.004 . 0 0 "[ . 1 . 2]" 1
307 1 40 ASP HA 1 41 PHE QD 5.400 . 5.400 4.360 4.175 4.530 . 0 0 "[ . 1 . 2]" 1
308 1 46 VAL QG 1 47 ILE HA 4.220 . 4.220 3.693 3.329 3.859 . 0 0 "[ . 1 . 2]" 1
309 1 46 VAL QG 1 47 ILE MG 4.470 . 4.470 4.259 4.147 4.454 . 0 0 "[ . 1 . 2]" 1
310 1 67 TYR HB2 1 68 TYR H 4.180 . 4.180 4.049 3.913 4.229 0.049 14 0 "[ . 1 . 2]" 1
311 1 67 TYR QD 1 84 SER QB 5.470 . 5.470 4.141 3.878 4.721 . 0 0 "[ . 1 . 2]" 1
312 1 78 ILE MD 1 78 ILE MG 2.540 . 2.540 1.941 1.910 2.004 . 0 0 "[ . 1 . 2]" 1
313 1 25 ILE HA 1 28 LYS HG3 4.110 . 4.110 2.643 2.534 2.886 . 0 0 "[ . 1 . 2]" 1
314 1 25 ILE HA 1 28 LYS QE 4.150 . 4.150 3.475 3.210 3.655 . 0 0 "[ . 1 . 2]" 1
315 1 25 ILE MD 1 28 LYS H 4.510 . 4.510 3.787 3.608 3.906 . 0 0 "[ . 1 . 2]" 1
316 1 84 SER QB 1 89 ASN HB2 4.580 . 4.580 3.841 3.575 4.421 . 0 0 "[ . 1 . 2]" 1
317 1 26 GLU HA 1 26 GLU QG 3.290 . 3.290 2.377 2.180 2.490 . 0 0 "[ . 1 . 2]" 1
318 1 91 LYS HA 1 91 LYS HG2 4.250 . 4.250 2.727 2.442 3.232 . 0 0 "[ . 1 . 2]" 1
319 1 94 MET QG 1 95 LYS QE 4.970 . 4.970 4.142 3.640 5.120 0.150 13 0 "[ . 1 . 2]" 1
320 1 95 LYS H 1 97 ARG H 4.540 . 4.540 3.994 3.913 4.089 . 0 0 "[ . 1 . 2]" 1
321 1 99 LEU HA 1 102 LEU MD1 3.640 . 3.640 2.740 2.443 3.004 . 0 0 "[ . 1 . 2]" 1
322 1 99 LEU MD1 1 103 GLU HG3 4.330 . 4.330 2.429 2.058 2.876 . 0 0 "[ . 1 . 2]" 1
323 1 103 GLU HA 1 104 ASP HA 4.720 . 4.720 4.674 4.634 4.717 . 0 0 "[ . 1 . 2]" 1
324 1 104 ASP HA 1 105 LYS HG2 4.230 . 4.230 4.013 3.787 4.200 . 0 0 "[ . 1 . 2]" 1
325 1 107 ASN HB2 1 111 TYR QD 5.280 . 5.280 4.558 4.185 4.961 . 0 0 "[ . 1 . 2]" 1
326 1 109 LEU HA 1 111 TYR QD 4.870 . 4.870 3.941 3.546 4.208 . 0 0 "[ . 1 . 2]" 1
327 1 28 LYS HA 1 31 GLN HA 5.150 . 5.150 5.224 5.170 5.296 0.146 5 0 "[ . 1 . 2]" 1
328 1 28 LYS HB3 1 28 LYS QE 4.400 . 4.400 3.957 3.881 4.220 . 0 0 "[ . 1 . 2]" 1
329 1 116 LYS HB3 1 117 PHE QD 4.930 . 4.930 4.477 4.072 4.635 . 0 0 "[ . 1 . 2]" 1
330 1 43 THR HB 1 94 MET ME 4.150 . 4.150 3.157 2.796 3.553 . 0 0 "[ . 1 . 2]" 1
331 1 45 CYS HB3 1 70 PHE QE 4.680 . 4.680 3.170 2.515 4.621 . 0 0 "[ . 1 . 2]" 1
332 1 46 VAL QG 1 48 GLU HG2 3.450 . 3.450 3.043 2.423 3.477 0.027 10 0 "[ . 1 . 2]" 1
333 1 47 ILE MG 1 66 LYS QD 3.700 . 3.700 3.709 3.616 3.814 0.114 11 0 "[ . 1 . 2]" 1
334 1 50 VAL MG1 1 65 THR HB 4.550 . 4.550 4.095 3.799 4.569 0.019 9 0 "[ . 1 . 2]" 1
335 1 64 LEU MD1 1 65 THR H 5.140 . 5.140 2.752 2.106 4.241 . 0 0 "[ . 1 . 2]" 1
336 1 70 PHE HZ 1 91 LYS HG3 5.500 . 5.500 3.553 3.139 4.343 . 0 0 "[ . 1 . 2]" 1
337 1 71 SER HB2 1 78 ILE MG 4.320 . 4.320 4.066 2.807 4.333 0.013 10 0 "[ . 1 . 2]" 1
338 1 72 PHE HB2 1 78 ILE MG 5.500 . 5.500 5.504 5.402 5.543 0.043 12 0 "[ . 1 . 2]" 1
339 1 78 ILE HB 1 79 VAL MG2 5.500 . 5.500 5.519 5.431 5.553 0.053 11 0 "[ . 1 . 2]" 1
340 1 25 ILE HG13 1 25 ILE MG 3.360 . 3.360 2.320 2.239 2.373 . 0 0 "[ . 1 . 2]" 1
341 1 96 GLN HB3 1 97 ARG H 4.030 . 4.030 3.892 3.734 4.055 0.025 1 0 "[ . 1 . 2]" 1
342 1 98 LEU HA 1 102 LEU H 5.320 . 5.320 4.126 4.001 4.292 . 0 0 "[ . 1 . 2]" 1
343 1 99 LEU HA 1 102 LEU H 5.500 . 5.500 3.669 3.481 3.826 . 0 0 "[ . 1 . 2]" 1
344 1 110 LEU HA 1 110 LEU HG 3.640 . 3.640 3.085 3.006 3.156 . 0 0 "[ . 1 . 2]" 1
345 1 112 SER HA 1 113 CYS HA 5.110 . 5.110 4.452 4.414 4.495 . 0 0 "[ . 1 . 2]" 1
346 1 29 VAL H 1 30 TYR H 3.640 . 3.640 2.759 2.653 2.980 . 0 0 "[ . 1 . 2]" 1
347 1 29 VAL MG2 1 72 PHE HZ 4.460 . 4.460 2.953 2.198 3.780 . 0 0 "[ . 1 . 2]" 1
348 1 32 LEU H 1 35 ASP H 4.690 . 4.690 4.715 4.660 4.781 0.091 14 0 "[ . 1 . 2]" 1
349 1 32 LEU HB2 1 33 LEU HA 5.050 . 5.050 3.948 3.821 4.030 . 0 0 "[ . 1 . 2]" 1
350 1 32 LEU MD2 1 105 LYS HD3 4.810 . 4.810 4.438 4.162 4.838 0.028 2 0 "[ . 1 . 2]" 1
351 1 32 LEU MD1 1 33 LEU MD2 3.840 . 3.840 2.639 2.395 3.567 . 0 0 "[ . 1 . 2]" 1
352 1 33 LEU MD2 1 109 LEU MD1 4.160 . 4.160 3.139 2.082 3.677 . 0 0 "[ . 1 . 2]" 1
353 1 36 GLN HG2 1 110 LEU MD2 5.420 . 5.420 5.245 4.868 5.440 0.020 8 0 "[ . 1 . 2]" 1
354 1 43 THR HA 1 72 PHE HB2 5.310 . 5.310 4.163 4.015 4.478 . 0 0 "[ . 1 . 2]" 1
355 1 43 THR HB 1 70 PHE QE 4.590 . 4.590 4.252 3.746 4.609 0.019 20 0 "[ . 1 . 2]" 1
356 1 58 LEU MD1 1 59 ASN HB3 4.650 . 4.650 3.670 3.016 4.358 . 0 0 "[ . 1 . 2]" 1
357 1 59 ASN HA 1 60 THR HA 5.500 . 5.500 4.583 4.545 4.621 . 0 0 "[ . 1 . 2]" 1
358 1 64 LEU H 1 64 LEU HG 5.390 . 5.390 3.681 1.770 4.933 0.030 6 0 "[ . 1 . 2]" 1
359 1 71 SER HA 1 72 PHE HB2 5.500 . 5.500 4.452 4.360 4.568 . 0 0 "[ . 1 . 2]" 1
360 1 71 SER HA 1 78 ILE MG 4.410 . 4.410 3.943 3.753 4.139 . 0 0 "[ . 1 . 2]" 1
361 1 79 VAL MG1 1 109 LEU HG 3.710 . 3.710 3.813 3.729 3.876 0.166 16 0 "[ . 1 . 2]" 1
362 1 25 ILE MD 1 29 VAL H 3.480 . 3.480 3.261 3.020 3.531 0.051 18 0 "[ . 1 . 2]" 1
363 1 25 ILE MG 1 94 MET ME 3.170 . 3.170 2.975 2.469 3.246 0.076 5 0 "[ . 1 . 2]" 1
364 1 83 LYS HA 1 83 LYS QD 4.430 . 4.430 3.858 2.540 4.423 . 0 0 "[ . 1 . 2]" 1
365 1 83 LYS HG3 1 84 SER HA 5.500 . 5.500 4.361 3.426 5.416 . 0 0 "[ . 1 . 2]" 1
366 1 92 TYR QD 1 93 ILE HB 4.870 . 4.870 4.621 4.340 4.713 . 0 0 "[ . 1 . 2]" 1
367 1 102 LEU H 1 102 LEU MD1 3.630 . 3.630 3.487 3.408 3.614 . 0 0 "[ . 1 . 2]" 1
368 1 29 VAL MG1 1 72 PHE QD 4.440 . 4.440 3.633 3.188 3.927 . 0 0 "[ . 1 . 2]" 1
369 1 32 LEU MD1 1 34 LYS H 4.700 . 4.700 4.220 4.097 4.318 . 0 0 "[ . 1 . 2]" 1
370 1 33 LEU HA 1 110 LEU MD2 4.990 . 4.990 4.563 4.326 4.856 . 0 0 "[ . 1 . 2]" 1
371 1 38 CYS HA 1 115 CYS QB 3.810 . 3.810 2.220 2.167 2.265 . 0 0 "[ . 1 . 2]" 1
372 1 43 THR HB 1 70 PHE QD 5.020 . 5.020 3.741 3.337 4.263 . 0 0 "[ . 1 . 2]" 1
373 1 71 SER HB3 1 78 ILE MG 4.320 . 4.320 3.122 2.381 4.348 0.028 18 0 "[ . 1 . 2]" 1
374 1 73 PHE HA 1 78 ILE MG 4.700 . 4.700 4.539 4.364 4.705 0.005 1 0 "[ . 1 . 2]" 1
375 1 77 ASN HA 1 78 ILE HB 4.800 . 4.800 4.565 4.514 4.600 . 0 0 "[ . 1 . 2]" 1
376 1 79 VAL MG2 1 98 LEU HG 5.500 . 5.500 5.005 4.677 5.273 . 0 0 "[ . 1 . 2]" 1
377 1 80 ALA MB 1 98 LEU MD1 3.540 . 3.540 2.237 2.104 2.463 . 0 0 "[ . 1 . 2]" 1
378 1 96 GLN HA 1 97 ARG HA 5.310 . 5.310 4.801 4.762 4.851 . 0 0 "[ . 1 . 2]" 1
379 1 98 LEU HA 1 98 LEU MD2 3.890 . 3.890 3.540 3.392 3.771 . 0 0 "[ . 1 . 2]" 1
380 1 105 LYS HA 1 110 LEU MD2 4.740 . 4.740 4.161 4.049 4.283 . 0 0 "[ . 1 . 2]" 1
381 1 107 ASN HB2 1 108 LEU MD2 4.940 . 4.940 4.816 4.726 4.954 0.014 18 0 "[ . 1 . 2]" 1
382 1 108 LEU MD1 1 109 LEU H 5.090 . 5.090 4.538 4.506 4.561 . 0 0 "[ . 1 . 2]" 1
383 1 108 LEU MD1 1 111 TYR QD 5.440 . 5.440 4.483 4.183 4.588 . 0 0 "[ . 1 . 2]" 1
384 1 114 ASN QB 1 115 CYS HA 4.610 . 4.610 4.557 4.206 4.635 0.025 10 0 "[ . 1 . 2]" 1
385 1 120 LYS HA 1 121 LYS QB 5.220 . 5.220 4.685 4.193 5.317 0.097 9 0 "[ . 1 . 2]" 1
386 1 55 LYS HA 1 56 THR MG 4.920 . 4.920 4.107 3.460 5.009 0.089 19 0 "[ . 1 . 2]" 1
387 1 65 THR HB 1 67 TYR QE 4.270 . 4.270 3.601 3.079 4.109 . 0 0 "[ . 1 . 2]" 1
388 1 68 TYR HB2 1 69 GLY H 4.660 . 4.660 4.481 4.351 4.553 . 0 0 "[ . 1 . 2]" 1
389 1 25 ILE MG 1 72 PHE QE 4.720 . 4.720 4.591 4.320 4.773 0.053 4 0 "[ . 1 . 2]" 1
390 1 88 ALA MB 1 92 TYR QB 4.460 . 4.460 4.200 4.041 4.463 0.003 7 0 "[ . 1 . 2]" 1
391 1 98 LEU HB3 1 102 LEU MD2 5.280 . 5.280 3.194 2.976 3.638 . 0 0 "[ . 1 . 2]" 1
392 1 99 LEU HB3 1 100 LYS H 3.380 . 3.380 2.399 2.243 2.522 . 0 0 "[ . 1 . 2]" 1
393 1 116 LYS HA 1 116 LYS HB3 2.930 . 2.930 2.399 2.360 2.422 . 0 0 "[ . 1 . 2]" 1
394 1 117 PHE QD 1 118 SER QB 3.950 . 3.950 3.951 2.765 4.111 0.161 3 0 "[ . 1 . 2]" 1
395 1 32 LEU MD2 1 102 LEU HB3 3.730 . 3.730 2.352 2.140 2.527 . 0 0 "[ . 1 . 2]" 1
396 1 33 LEU H 1 34 LYS QB 5.130 . 5.130 4.864 4.715 5.024 . 0 0 "[ . 1 . 2]" 1
397 1 34 LYS QB 1 41 PHE QD 5.500 . 5.500 5.536 5.324 5.683 0.183 13 0 "[ . 1 . 2]" 1
398 1 46 VAL QG 1 48 GLU H 4.640 . 4.640 4.036 3.775 4.180 . 0 0 "[ . 1 . 2]" 1
399 1 46 VAL QG 1 48 GLU HG3 3.370 . 3.370 2.610 2.228 3.063 . 0 0 "[ . 1 . 2]" 1
400 1 57 LEU HA 1 57 LEU HB3 2.990 . 2.990 2.567 2.370 3.015 0.025 7 0 "[ . 1 . 2]" 1
401 1 58 LEU QB 1 59 ASN HB3 4.090 . 4.090 3.973 3.688 4.213 0.123 9 0 "[ . 1 . 2]" 1
402 1 80 ALA MB 1 82 GLY H 5.480 . 5.480 4.918 4.711 5.196 . 0 0 "[ . 1 . 2]" 1
403 1 87 VAL HB 1 90 ALA MB 5.150 . 5.150 4.813 4.582 5.117 . 0 0 "[ . 1 . 2]" 1
404 1 107 ASN HA 1 110 LEU HB3 4.700 . 4.700 4.150 3.898 4.493 . 0 0 "[ . 1 . 2]" 1
405 1 107 ASN HA 1 110 LEU MD1 3.990 . 3.990 3.628 3.162 3.868 . 0 0 "[ . 1 . 2]" 1
406 1 107 ASN HB3 1 111 TYR H 5.500 . 5.500 5.450 5.247 5.551 0.051 6 0 "[ . 1 . 2]" 1
407 1 120 LYS QE 1 121 LYS QB 4.130 . 4.130 3.508 2.502 4.274 0.144 14 0 "[ . 1 . 2]" 1
408 1 30 TYR HA 1 41 PHE QE 4.060 . 4.060 2.309 2.014 2.765 . 0 0 "[ . 1 . 2]" 1
409 1 31 GLN H 1 32 LEU MD2 5.290 . 5.290 5.252 5.138 5.327 0.037 2 0 "[ . 1 . 2]" 1
410 1 33 LEU H 1 33 LEU HB2 3.750 . 3.750 2.386 2.062 2.508 . 0 0 "[ . 1 . 2]" 1
411 1 41 PHE QD 1 75 HIS H 4.970 . 4.970 4.901 4.760 4.994 0.024 2 0 "[ . 1 . 2]" 1
412 1 47 ILE MG 1 66 LYS QE 3.880 . 3.880 3.400 3.087 3.712 . 0 0 "[ . 1 . 2]" 1
413 1 56 THR HA 1 56 THR HB 2.800 . 2.800 2.506 2.376 2.794 . 0 0 "[ . 1 . 2]" 1
414 1 57 LEU HA 1 58 LEU H 3.210 . 3.210 2.638 2.116 3.315 0.105 2 0 "[ . 1 . 2]" 1
415 1 65 THR MG 1 66 LYS HA 4.380 . 4.380 4.072 3.909 4.312 . 0 0 "[ . 1 . 2]" 1
416 1 67 TYR QE 1 84 SER HA 4.410 . 4.410 3.478 2.811 4.429 0.019 5 0 "[ . 1 . 2]" 1
417 1 69 GLY HA3 1 81 TYR QE 4.520 . 4.520 3.942 3.196 4.565 0.045 18 0 "[ . 1 . 2]" 1
418 1 70 PHE QE 1 94 MET ME 4.050 . 4.050 3.476 2.735 3.826 . 0 0 "[ . 1 . 2]" 1
419 1 71 SER HB3 1 78 ILE MD 4.180 . 4.180 2.165 1.791 3.229 0.009 2 0 "[ . 1 . 2]" 1
420 1 72 PHE HA 1 94 MET ME 4.980 . 4.980 4.798 4.527 5.025 0.045 12 0 "[ . 1 . 2]" 1
421 1 75 HIS HB2 1 76 GLY H 4.490 . 4.490 4.151 4.016 4.272 . 0 0 "[ . 1 . 2]" 1
422 1 79 VAL MG1 1 109 LEU HB3 3.980 . 3.980 3.307 3.159 3.492 . 0 0 "[ . 1 . 2]" 1
423 1 84 SER QB 1 86 LYS H 4.680 . 4.680 2.565 2.186 3.298 . 0 0 "[ . 1 . 2]" 1
424 1 91 LYS HA 1 91 LYS QD 4.600 . 4.600 3.959 3.800 4.042 . 0 0 "[ . 1 . 2]" 1
425 1 93 ILE MG 1 97 ARG HD2 4.590 . 4.590 4.181 3.141 4.678 0.088 14 0 "[ . 1 . 2]" 1
426 1 101 LEU HA 1 101 LEU HG 3.490 . 3.490 2.960 2.584 3.484 . 0 0 "[ . 1 . 2]" 1
427 1 102 LEU HA 1 102 LEU HG 3.670 . 3.670 3.612 3.587 3.628 . 0 0 "[ . 1 . 2]" 1
428 1 102 LEU MD1 1 103 GLU H 4.480 . 4.480 2.897 2.608 3.151 . 0 0 "[ . 1 . 2]" 1
429 1 102 LEU MD2 1 103 GLU H 4.340 . 4.340 4.200 4.003 4.348 0.008 2 0 "[ . 1 . 2]" 1
430 1 105 LYS HA 1 105 LYS HG3 4.170 . 4.170 3.729 3.686 3.782 . 0 0 "[ . 1 . 2]" 1
431 1 30 TYR QD 1 41 PHE QE 3.910 . 3.910 2.039 1.751 2.927 0.049 2 0 "[ . 1 . 2]" 1
432 1 34 LYS H 1 41 PHE HZ 4.140 . 4.140 2.965 2.825 3.219 . 0 0 "[ . 1 . 2]" 1
433 1 50 VAL HA 1 50 VAL MG2 3.550 . 3.550 2.387 2.323 2.473 . 0 0 "[ . 1 . 2]" 1
434 1 64 LEU HB3 1 65 THR H 4.390 . 4.390 3.684 3.244 4.068 . 0 0 "[ . 1 . 2]" 1
435 1 64 LEU HG 1 65 THR H 4.610 . 4.610 3.263 1.948 4.615 0.005 12 0 "[ . 1 . 2]" 1
436 1 84 SER HA 1 90 ALA H 5.290 . 5.290 5.331 5.298 5.367 0.077 14 0 "[ . 1 . 2]" 1
437 1 90 ALA HA 1 92 TYR H 4.910 . 4.910 4.382 4.313 4.513 . 0 0 "[ . 1 . 2]" 1
438 1 90 ALA HA 1 93 ILE MG 4.940 . 4.940 4.529 4.274 4.743 . 0 0 "[ . 1 . 2]" 1
439 1 92 TYR HA 1 93 ILE HA 4.840 . 4.840 4.818 4.799 4.840 . 0 0 "[ . 1 . 2]" 1
440 1 92 TYR QD 1 93 ILE HA 4.120 . 4.120 3.283 3.042 3.755 . 0 0 "[ . 1 . 2]" 1
441 1 27 HIS HA 1 30 TYR QE 5.260 . 5.260 4.588 3.833 5.333 0.073 15 0 "[ . 1 . 2]" 1
442 1 107 ASN HB3 1 108 LEU MD2 5.050 . 5.050 4.592 4.485 4.749 . 0 0 "[ . 1 . 2]" 1
443 1 111 TYR QE 1 112 SER H 5.380 . 5.380 5.410 5.290 5.470 0.090 1 0 "[ . 1 . 2]" 1
444 1 121 LYS H 1 121 LYS QD 3.710 . 3.710 2.973 1.794 4.082 0.372 7 0 "[ . 1 . 2]" 1
445 1 40 ASP HB3 1 41 PHE QE 5.430 . 5.430 5.471 5.324 5.556 0.126 6 0 "[ . 1 . 2]" 1
446 1 41 PHE HA 1 73 PHE QD 5.500 . 5.500 5.575 5.468 5.661 0.161 9 0 "[ . 1 . 2]" 1
447 1 48 GLU HA 1 67 TYR H 5.240 . 5.240 4.698 4.523 4.888 . 0 0 "[ . 1 . 2]" 1
448 1 70 PHE QD 1 87 VAL HB 5.500 . 5.500 5.286 4.727 5.535 0.035 6 0 "[ . 1 . 2]" 1
449 1 70 PHE QD 1 91 LYS HB3 5.500 . 5.500 5.027 4.785 5.280 . 0 0 "[ . 1 . 2]" 1
450 1 70 PHE QD 1 91 LYS QE 5.180 . 5.180 5.154 4.524 5.275 0.095 18 0 "[ . 1 . 2]" 1
451 1 71 SER HA 1 94 MET HA 5.450 . 5.450 4.932 4.424 5.427 . 0 0 "[ . 1 . 2]" 1
452 1 73 PHE HA 1 78 ILE HA 4.040 . 4.040 2.890 2.765 2.995 . 0 0 "[ . 1 . 2]" 1
453 1 74 ARG HB3 1 111 TYR QE 5.500 . 5.500 4.079 3.201 4.593 . 0 0 "[ . 1 . 2]" 1
454 1 25 ILE MG 1 95 LYS HB2 4.920 . 4.920 3.876 3.704 4.102 . 0 0 "[ . 1 . 2]" 1
455 1 84 SER QB 1 89 ASN H 4.420 . 4.420 4.035 3.832 4.273 . 0 0 "[ . 1 . 2]" 1
456 1 87 VAL HA 1 87 VAL MG1 3.340 . 3.340 3.206 3.194 3.221 . 0 0 "[ . 1 . 2]" 1
457 1 92 TYR QE 1 93 ILE HA 4.700 . 4.700 4.046 3.739 4.256 . 0 0 "[ . 1 . 2]" 1
458 1 93 ILE MG 1 94 MET HA 4.190 . 4.190 3.243 3.121 3.551 . 0 0 "[ . 1 . 2]" 1
459 1 97 ARG H 1 99 LEU H 4.680 . 4.680 3.744 3.609 3.898 . 0 0 "[ . 1 . 2]" 1
460 1 27 HIS H 1 28 LYS QE 4.880 . 4.880 4.751 4.547 4.931 0.051 12 0 "[ . 1 . 2]" 1
461 1 27 HIS HA 1 30 TYR H 4.270 . 4.270 3.666 3.364 3.973 . 0 0 "[ . 1 . 2]" 1
462 1 100 LYS HA 1 103 GLU HG2 4.080 . 4.080 3.741 3.317 4.027 . 0 0 "[ . 1 . 2]" 1
463 1 103 GLU H 1 104 ASP HA 5.500 . 5.500 5.157 4.991 5.278 . 0 0 "[ . 1 . 2]" 1
464 1 107 ASN HB2 1 111 TYR HA 3.680 . 3.680 2.932 2.483 3.222 . 0 0 "[ . 1 . 2]" 1
465 1 107 ASN HB3 1 108 LEU MD1 5.190 . 5.190 5.206 5.079 5.263 0.073 12 0 "[ . 1 . 2]" 1
466 1 108 LEU HB2 1 108 LEU MD2 3.200 . 3.200 2.251 2.238 2.267 . 0 0 "[ . 1 . 2]" 1
467 1 110 LEU H 1 111 TYR QD 4.410 . 4.410 4.065 3.822 4.313 . 0 0 "[ . 1 . 2]" 1
468 1 29 VAL MG1 1 72 PHE HZ 4.460 . 4.460 2.353 1.779 2.995 0.021 15 0 "[ . 1 . 2]" 1
469 1 34 LYS HA 1 41 PHE HZ 4.240 . 4.240 3.244 3.049 3.539 . 0 0 "[ . 1 . 2]" 1
470 1 38 CYS HA 1 115 CYS HA 5.020 . 5.020 5.044 4.922 5.102 0.082 17 0 "[ . 1 . 2]" 1
471 1 40 ASP HB3 1 75 HIS H 3.990 . 3.990 3.701 3.390 3.968 . 0 0 "[ . 1 . 2]" 1
472 1 41 PHE HA 1 72 PHE QE 4.560 . 4.560 4.023 3.720 4.372 . 0 0 "[ . 1 . 2]" 1
473 1 49 GLU H 1 66 LYS HA 4.710 . 4.710 4.489 4.232 4.722 0.012 2 0 "[ . 1 . 2]" 1
474 1 58 LEU HA 1 58 LEU QB 2.610 . 2.610 2.164 2.152 2.176 . 0 0 "[ . 1 . 2]" 1
475 1 66 LYS HB3 1 66 LYS QD 3.010 . 3.010 2.415 2.352 2.478 . 0 0 "[ . 1 . 2]" 1
476 1 68 TYR QE 1 87 VAL MG1 4.230 . 4.230 3.590 2.953 4.079 . 0 0 "[ . 1 . 2]" 1
477 1 70 PHE H 1 70 PHE QD 4.620 . 4.620 3.017 2.826 3.231 . 0 0 "[ . 1 . 2]" 1
478 1 74 ARG HE 1 75 HIS H 5.060 . 5.060 4.913 4.040 5.204 0.144 15 0 "[ . 1 . 2]" 1
479 1 78 ILE MG 1 82 GLY H 5.500 . 5.500 5.339 5.108 5.503 0.003 20 0 "[ . 1 . 2]" 1
480 1 25 ILE MD 1 99 LEU HB2 3.210 . 3.210 2.694 2.112 3.116 . 0 0 "[ . 1 . 2]" 1
481 1 25 ILE MD 1 99 LEU HB3 4.080 . 4.080 3.886 3.527 4.107 0.027 13 0 "[ . 1 . 2]" 1
482 1 25 ILE MD 1 102 LEU HG 4.330 . 4.330 3.418 3.321 3.522 . 0 0 "[ . 1 . 2]" 1
483 1 25 ILE MG 1 29 VAL H 4.290 . 4.290 4.119 3.865 4.502 0.212 2 0 "[ . 1 . 2]" 1
484 1 84 SER QB 1 90 ALA HA 4.030 . 4.030 2.619 2.248 2.844 . 0 0 "[ . 1 . 2]" 1
485 1 86 LYS H 1 90 ALA MB 4.150 . 4.150 4.136 3.792 4.236 0.086 18 0 "[ . 1 . 2]" 1
486 1 99 LEU MD2 1 103 GLU HG2 4.380 . 4.380 2.785 2.340 4.147 . 0 0 "[ . 1 . 2]" 1
487 1 99 LEU MD2 1 103 GLU HG3 4.330 . 4.330 3.079 2.702 3.367 . 0 0 "[ . 1 . 2]" 1
488 1 100 LYS HA 1 103 GLU QB 3.530 . 3.530 2.349 2.106 2.554 . 0 0 "[ . 1 . 2]" 1
489 1 105 LYS H 1 110 LEU MD1 3.610 . 3.610 3.299 3.153 3.502 . 0 0 "[ . 1 . 2]" 1
490 1 116 LYS HA 1 116 LYS HB2 2.920 . 2.920 2.502 2.471 2.552 . 0 0 "[ . 1 . 2]" 1
491 1 118 SER QB 1 119 LYS QE 4.420 . 4.420 4.182 3.290 4.593 0.173 7 0 "[ . 1 . 2]" 1
492 1 33 LEU HB2 1 41 PHE HZ 4.950 . 4.950 3.007 2.817 3.709 . 0 0 "[ . 1 . 2]" 1
493 1 36 GLN HE21 1 110 LEU MD2 3.830 . 3.830 2.895 2.695 3.066 . 0 0 "[ . 1 . 2]" 1
494 1 43 THR HA 1 73 PHE QD 4.920 . 4.920 4.400 3.926 4.825 . 0 0 "[ . 1 . 2]" 1
495 1 68 TYR QD 1 87 VAL HA 4.040 . 4.040 2.463 1.796 3.332 0.004 20 0 "[ . 1 . 2]" 1
496 1 68 TYR QD 1 87 VAL MG1 4.330 . 4.330 4.063 3.679 4.428 0.098 7 0 "[ . 1 . 2]" 1
497 1 70 PHE H 1 83 LYS HA 4.690 . 4.690 2.913 2.623 3.253 . 0 0 "[ . 1 . 2]" 1
498 1 72 PHE H 1 79 VAL HB 5.100 . 5.100 4.817 4.618 5.015 . 0 0 "[ . 1 . 2]" 1
499 1 72 PHE HB3 1 79 VAL MG2 4.490 . 4.490 4.253 3.964 4.438 . 0 0 "[ . 1 . 2]" 1
500 1 78 ILE MD 1 79 VAL MG2 5.300 . 5.300 4.944 4.822 5.098 . 0 0 "[ . 1 . 2]" 1
501 1 78 ILE MG 1 79 VAL HB 4.660 . 4.660 4.664 4.572 4.722 0.062 18 0 "[ . 1 . 2]" 1
502 1 83 LYS HG2 1 84 SER HA 5.500 . 5.500 3.936 3.351 4.932 . 0 0 "[ . 1 . 2]" 1
503 1 84 SER HA 1 90 ALA MB 4.220 . 4.220 4.001 3.916 4.123 . 0 0 "[ . 1 . 2]" 1
504 1 89 ASN HA 1 92 TYR QD 4.070 . 4.070 3.698 3.079 4.076 0.006 7 0 "[ . 1 . 2]" 1
505 1 90 ALA MB 1 91 LYS HA 4.360 . 4.360 3.826 3.736 3.911 . 0 0 "[ . 1 . 2]" 1
506 1 92 TYR QE 1 93 ILE MG 5.110 . 5.110 4.953 4.483 5.135 0.025 13 0 "[ . 1 . 2]" 1
507 1 98 LEU HA 1 109 LEU MD2 4.740 . 4.740 2.803 2.576 2.911 . 0 0 "[ . 1 . 2]" 1
508 1 100 LYS QE 1 101 LEU HA 4.330 . 4.330 4.253 3.369 4.523 0.193 12 0 "[ . 1 . 2]" 1
509 1 102 LEU HA 1 105 LYS H 3.970 . 3.970 3.330 3.153 3.522 . 0 0 "[ . 1 . 2]" 1
510 1 102 LEU HA 1 106 SER H 5.190 . 5.190 4.261 3.894 4.528 . 0 0 "[ . 1 . 2]" 1
511 1 102 LEU HG 1 103 GLU HA 4.850 . 4.850 4.693 4.523 4.843 . 0 0 "[ . 1 . 2]" 1
512 1 106 SER HB3 1 108 LEU MD2 4.900 . 4.900 1.946 1.827 2.117 . 0 0 "[ . 1 . 2]" 1
513 1 107 ASN HB2 1 108 LEU MD1 4.730 . 4.730 4.776 4.720 4.832 0.102 20 0 "[ . 1 . 2]" 1
514 1 28 LYS QD 1 28 LYS HG3 2.550 . 2.550 2.358 2.329 2.390 . 0 0 "[ . 1 . 2]" 1
515 1 29 VAL HA 1 32 LEU MD1 3.490 . 3.490 2.045 1.887 2.188 . 0 0 "[ . 1 . 2]" 1
516 1 39 GLU H 1 40 ASP H 3.200 . 3.200 2.043 1.788 3.216 0.016 7 0 "[ . 1 . 2]" 1
517 1 43 THR HB 1 72 PHE HA 4.640 . 4.640 4.188 3.896 4.419 . 0 0 "[ . 1 . 2]" 1
518 1 44 LYS QD 1 73 PHE QE 4.500 . 4.500 2.598 1.741 3.638 0.059 17 0 "[ . 1 . 2]" 1
519 1 44 LYS QE 1 78 ILE MD 3.910 . 3.910 3.187 2.241 3.956 0.046 19 0 "[ . 1 . 2]" 1
520 1 47 ILE MG 1 48 GLU HG2 5.000 . 5.000 5.065 5.017 5.161 0.161 5 0 "[ . 1 . 2]" 1
521 1 65 THR HA 1 67 TYR QD 5.500 . 5.500 5.383 4.953 5.517 0.017 12 0 "[ . 1 . 2]" 1
522 1 66 LYS HA 1 67 TYR QD 3.300 . 3.300 3.003 2.738 3.214 . 0 0 "[ . 1 . 2]" 1
523 1 67 TYR H 1 67 TYR QE 5.120 . 5.120 5.077 4.949 5.144 0.024 7 0 "[ . 1 . 2]" 1
524 1 70 PHE H 1 82 GLY HA3 5.250 . 5.250 4.760 4.505 4.940 . 0 0 "[ . 1 . 2]" 1
525 1 70 PHE HZ 1 87 VAL HB 5.380 . 5.380 4.851 4.361 5.411 0.031 7 0 "[ . 1 . 2]" 1
526 1 70 PHE HZ 1 91 LYS HB3 5.500 . 5.500 5.526 5.193 5.747 0.247 3 0 "[ . 1 . 2]" 1
527 1 70 PHE QD 1 91 LYS H 4.510 . 4.510 3.586 3.174 4.057 . 0 0 "[ . 1 . 2]" 1
528 1 71 SER HA 1 72 PHE HB3 5.250 . 5.250 4.822 4.651 4.902 . 0 0 "[ . 1 . 2]" 1
529 1 71 SER HA 1 81 TYR HB3 5.500 . 5.500 5.125 4.926 5.340 . 0 0 "[ . 1 . 2]" 1
530 1 73 PHE QE 1 78 ILE HG12 4.780 . 4.780 3.841 3.468 4.080 . 0 0 "[ . 1 . 2]" 1
531 1 74 ARG HA 1 75 HIS HD2 5.040 . 5.040 4.031 3.918 4.242 . 0 0 "[ . 1 . 2]" 1
532 1 78 ILE MG 1 79 VAL MG2 4.650 . 4.650 4.508 4.432 4.578 . 0 0 "[ . 1 . 2]" 1
533 1 81 TYR QE 1 83 LYS HA 4.700 . 4.700 4.365 2.828 4.771 0.071 6 0 "[ . 1 . 2]" 1
534 1 81 TYR QE 1 83 LYS HG3 5.500 . 5.500 4.615 3.842 5.200 . 0 0 "[ . 1 . 2]" 1
535 1 82 GLY HA3 1 93 ILE H 4.670 . 4.670 4.148 3.928 4.435 . 0 0 "[ . 1 . 2]" 1
536 1 87 VAL MG1 1 91 LYS QE 4.360 . 4.360 3.390 2.739 4.118 . 0 0 "[ . 1 . 2]" 1
537 1 89 ASN HB3 1 93 ILE MD 4.420 . 4.420 3.966 3.842 4.091 . 0 0 "[ . 1 . 2]" 1
538 1 90 ALA HA 1 93 ILE MD 3.430 . 3.430 2.092 1.784 2.317 0.016 6 0 "[ . 1 . 2]" 1
539 1 90 ALA MB 1 91 LYS QE 4.960 . 4.960 4.859 4.481 5.146 0.186 9 0 "[ . 1 . 2]" 1
540 1 91 LYS HG2 1 95 LYS QE 4.640 . 4.640 2.802 1.762 3.699 0.038 6 0 "[ . 1 . 2]" 1
541 1 93 ILE MG 1 97 ARG HG2 4.420 . 4.420 3.131 2.953 3.365 . 0 0 "[ . 1 . 2]" 1
542 1 100 LYS H 1 101 LEU MD1 5.380 . 5.380 4.759 3.896 5.344 . 0 0 "[ . 1 . 2]" 1
543 1 101 LEU HA 1 109 LEU H 5.500 . 5.500 5.083 4.649 5.305 . 0 0 "[ . 1 . 2]" 1
544 1 28 LYS HB2 1 29 VAL H 3.900 . 3.900 2.344 2.252 2.412 . 0 0 "[ . 1 . 2]" 1
545 1 110 LEU HA 1 111 TYR HA 5.350 . 5.350 4.723 4.668 4.765 . 0 0 "[ . 1 . 2]" 1
546 1 110 LEU HG 1 111 TYR H 4.680 . 4.680 4.635 4.568 4.706 0.026 4 0 "[ . 1 . 2]" 1
547 1 120 LYS HA 1 120 LYS QE 4.430 . 4.430 3.411 1.683 4.646 0.216 9 0 "[ . 1 . 2]" 1
548 1 120 LYS QG 1 121 LYS HA 4.770 . 4.770 4.238 3.358 4.860 0.090 5 0 "[ . 1 . 2]" 1
549 1 32 LEU H 1 33 LEU H 3.640 . 3.640 2.359 2.301 2.425 . 0 0 "[ . 1 . 2]" 1
550 1 32 LEU MD1 1 35 ASP H 5.190 . 5.190 5.012 4.913 5.069 . 0 0 "[ . 1 . 2]" 1
551 1 43 THR HA 1 94 MET ME 5.500 . 5.500 4.580 4.287 5.000 . 0 0 "[ . 1 . 2]" 1
552 1 50 VAL MG2 1 67 TYR QE 3.920 . 3.920 2.576 2.139 2.903 . 0 0 "[ . 1 . 2]" 1
553 1 70 PHE HZ 1 91 LYS QD 4.090 . 4.090 2.812 2.258 4.051 . 0 0 "[ . 1 . 2]" 1
554 1 70 PHE QD 1 71 SER HA 5.450 . 5.450 5.168 4.936 5.441 . 0 0 "[ . 1 . 2]" 1
555 1 70 PHE QD 1 94 MET ME 3.330 . 3.330 2.762 2.260 3.027 . 0 0 "[ . 1 . 2]" 1
556 1 71 SER HA 1 80 ALA H 4.770 . 4.770 4.572 4.452 4.759 . 0 0 "[ . 1 . 2]" 1
557 1 71 SER HA 1 94 MET HB3 5.180 . 5.180 3.665 3.173 5.227 0.047 7 0 "[ . 1 . 2]" 1
558 1 71 SER HA 1 94 MET ME 5.500 . 5.500 5.124 4.883 5.372 . 0 0 "[ . 1 . 2]" 1
559 1 78 ILE MG 1 80 ALA MB 4.120 . 4.120 4.037 3.936 4.120 . 0 0 "[ . 1 . 2]" 1
560 1 25 ILE MD 1 99 LEU HA 3.000 . 3.000 2.040 1.897 2.338 . 0 0 "[ . 1 . 2]" 1
561 1 25 ILE MG 1 43 THR MG 4.010 . 4.010 3.895 3.372 4.050 0.040 8 0 "[ . 1 . 2]" 1
562 1 87 VAL MG2 1 88 ALA HA 4.300 . 4.300 3.460 3.177 3.755 . 0 0 "[ . 1 . 2]" 1
563 1 88 ALA HA 1 89 ASN HA 4.920 . 4.920 4.736 4.685 4.787 . 0 0 "[ . 1 . 2]" 1
564 1 88 ALA MB 1 89 ASN HB2 4.100 . 4.100 3.969 3.796 4.159 0.059 7 0 "[ . 1 . 2]" 1
565 1 26 GLU HA 1 98 LEU MD1 5.050 . 5.050 4.501 4.132 4.717 . 0 0 "[ . 1 . 2]" 1
566 1 106 SER HB2 1 108 LEU MD2 4.900 . 4.900 2.649 2.507 2.822 . 0 0 "[ . 1 . 2]" 1
567 1 108 LEU MD2 1 109 LEU H 3.870 . 3.870 3.866 3.798 3.897 0.027 19 0 "[ . 1 . 2]" 1
568 1 28 LYS HA 1 28 LYS HG3 4.000 . 4.000 3.858 3.799 3.923 . 0 0 "[ . 1 . 2]" 1
569 1 28 LYS QE 1 102 LEU MD1 4.180 . 4.180 4.256 4.123 4.344 0.164 1 0 "[ . 1 . 2]" 1
570 1 31 GLN HA 1 32 LEU HG 4.910 . 4.910 4.976 4.934 5.023 0.113 7 0 "[ . 1 . 2]" 1
571 1 31 GLN HA 1 34 LYS QB 4.980 . 4.980 4.859 4.640 5.086 0.106 15 0 "[ . 1 . 2]" 1
572 1 33 LEU H 1 33 LEU MD1 3.860 . 3.860 3.794 2.479 3.901 0.041 1 0 "[ . 1 . 2]" 1
573 1 33 LEU H 1 110 LEU MD2 5.190 . 5.190 4.603 4.410 4.822 . 0 0 "[ . 1 . 2]" 1
574 1 34 LYS HG2 1 41 PHE HZ 5.220 . 5.220 4.521 4.331 4.742 . 0 0 "[ . 1 . 2]" 1
575 1 34 LYS QB 1 35 ASP H 3.620 . 3.620 3.595 3.521 3.672 0.052 16 0 "[ . 1 . 2]" 1
576 1 34 LYS QB 1 36 GLN H 5.500 . 5.500 5.226 4.938 5.417 . 0 0 "[ . 1 . 2]" 1
577 1 36 GLN HA 1 36 GLN HG3 3.850 . 3.850 3.660 3.470 3.781 . 0 0 "[ . 1 . 2]" 1
578 1 40 ASP HB2 1 41 PHE H 4.690 . 4.690 4.574 4.503 4.621 . 0 0 "[ . 1 . 2]" 1
579 1 43 THR MG 1 72 PHE HB2 4.370 . 4.370 2.922 2.643 3.232 . 0 0 "[ . 1 . 2]" 1
580 1 46 VAL QG 1 47 ILE H 3.440 . 3.440 2.460 1.848 3.024 . 0 0 "[ . 1 . 2]" 1
581 1 50 VAL H 1 50 VAL MG2 3.890 . 3.890 2.420 2.088 2.862 . 0 0 "[ . 1 . 2]" 1
582 1 50 VAL H 1 65 THR H 5.290 . 5.290 5.016 4.593 5.309 0.019 6 0 "[ . 1 . 2]" 1
583 1 59 ASN HB3 1 60 THR MG 4.660 . 4.660 4.034 2.957 4.851 0.191 12 0 "[ . 1 . 2]" 1
584 1 70 PHE HA 1 70 PHE QE 5.270 . 5.270 4.429 4.364 4.508 . 0 0 "[ . 1 . 2]" 1
585 1 71 SER HA 1 81 TYR QD 4.260 . 4.260 3.720 3.108 4.308 0.048 4 0 "[ . 1 . 2]" 1
586 1 72 PHE HA 1 80 ALA MB 4.530 . 4.530 4.026 3.822 4.207 . 0 0 "[ . 1 . 2]" 1
587 1 72 PHE QE 1 74 ARG HA 4.400 . 4.400 3.796 3.569 4.078 . 0 0 "[ . 1 . 2]" 1
588 1 78 ILE MG 1 81 TYR HB3 3.940 . 3.940 3.530 3.116 3.761 . 0 0 "[ . 1 . 2]" 1
589 1 80 ALA MB 1 94 MET HB2 3.990 . 3.990 2.274 1.929 3.535 . 0 0 "[ . 1 . 2]" 1
590 1 81 TYR QD 1 93 ILE MG 4.880 . 4.880 4.630 4.383 4.898 0.018 12 0 "[ . 1 . 2]" 1
591 1 82 GLY HA2 1 83 LYS QB 4.530 . 4.530 4.198 4.083 4.475 . 0 0 "[ . 1 . 2]" 1
592 1 82 GLY HA2 1 93 ILE HB 3.850 . 3.850 2.860 2.427 3.317 . 0 0 "[ . 1 . 2]" 1
593 1 89 ASN H 1 91 LYS H 4.550 . 4.550 4.066 3.896 4.310 . 0 0 "[ . 1 . 2]" 1
594 1 90 ALA HA 1 93 ILE QG 5.200 . 5.200 3.612 3.371 3.845 . 0 0 "[ . 1 . 2]" 1
595 1 93 ILE QG 1 93 ILE MG 3.220 . 3.220 2.217 2.201 2.241 . 0 0 "[ . 1 . 2]" 1
596 1 95 LYS HA 1 96 GLN HA 4.850 . 4.850 4.790 4.733 4.826 . 0 0 "[ . 1 . 2]" 1
597 1 97 ARG QB 1 98 LEU HA 5.450 . 5.450 3.823 3.760 3.877 . 0 0 "[ . 1 . 2]" 1
598 1 102 LEU HA 1 110 LEU MD2 3.520 . 3.520 2.790 2.594 3.085 . 0 0 "[ . 1 . 2]" 1
599 1 105 LYS H 1 110 LEU MD2 5.500 . 5.500 5.262 5.122 5.376 . 0 0 "[ . 1 . 2]" 1
600 1 113 CYS HA 1 114 ASN QB 4.600 . 4.600 4.076 3.962 4.381 . 0 0 "[ . 1 . 2]" 1
601 1 115 CYS H 1 117 PHE H 4.380 . 4.380 3.679 3.335 4.214 . 0 0 "[ . 1 . 2]" 1
602 1 118 SER HA 1 119 LYS QD 4.530 . 4.530 4.454 3.434 4.780 0.250 15 0 "[ . 1 . 2]" 1
603 1 29 VAL MG2 1 30 TYR QD 4.480 . 4.480 3.791 2.624 4.536 0.056 5 0 "[ . 1 . 2]" 1
604 1 30 TYR HA 1 41 PHE HZ 3.910 . 3.910 2.970 2.746 3.331 . 0 0 "[ . 1 . 2]" 1
605 1 30 TYR HB2 1 31 GLN QB 4.980 . 4.980 4.675 4.362 4.924 . 0 0 "[ . 1 . 2]" 1
606 1 39 GLU H 1 40 ASP HB3 4.520 . 4.520 4.070 3.868 4.466 . 0 0 "[ . 1 . 2]" 1
607 1 40 ASP H 1 41 PHE QD 3.720 . 3.720 3.018 2.099 3.381 . 0 0 "[ . 1 . 2]" 1
608 1 40 ASP HB3 1 75 HIS HD2 4.320 . 4.320 3.119 2.709 3.420 . 0 0 "[ . 1 . 2]" 1
609 1 41 PHE HA 1 75 HIS H 4.100 . 4.100 3.332 3.135 3.548 . 0 0 "[ . 1 . 2]" 1
610 1 43 THR HA 1 72 PHE HA 3.720 . 3.720 2.200 2.045 2.316 . 0 0 "[ . 1 . 2]" 1
611 1 47 ILE MG 1 69 GLY H 4.400 . 4.400 4.423 4.193 4.486 0.086 10 0 "[ . 1 . 2]" 1
612 1 56 THR MG 1 58 LEU H 4.710 . 4.710 3.549 1.982 4.648 . 0 0 "[ . 1 . 2]" 1
613 1 65 THR HB 1 67 TYR QD 4.880 . 4.880 4.767 4.505 4.925 0.045 12 0 "[ . 1 . 2]" 1
614 1 70 PHE QE 1 91 LYS QD 4.590 . 4.590 3.189 2.659 4.111 . 0 0 "[ . 1 . 2]" 1
615 1 78 ILE MD 1 81 TYR HB3 5.500 . 5.500 5.357 4.945 5.553 0.053 19 0 "[ . 1 . 2]" 1
616 1 79 VAL MG1 1 109 LEU MD1 3.750 . 3.750 1.769 1.753 1.787 0.047 1 0 "[ . 1 . 2]" 1
617 1 25 ILE MD 1 28 LYS HB2 3.590 . 3.590 2.098 1.956 2.282 . 0 0 "[ . 1 . 2]" 1
618 1 80 ALA MB 1 94 MET HB3 3.990 . 3.990 3.355 3.069 3.992 0.002 13 0 "[ . 1 . 2]" 1
619 1 96 GLN HA 1 100 LYS H 4.460 . 4.460 3.792 3.640 4.025 . 0 0 "[ . 1 . 2]" 1
620 1 97 ARG HA 1 100 LYS H 4.240 . 4.240 3.935 3.713 4.115 . 0 0 "[ . 1 . 2]" 1
621 1 98 LEU H 1 98 LEU MD2 4.100 . 4.100 3.709 3.573 3.832 . 0 0 "[ . 1 . 2]" 1
622 1 98 LEU HA 1 109 LEU HB3 4.030 . 4.030 4.058 3.943 4.137 0.107 14 0 "[ . 1 . 2]" 1
623 1 109 LEU HA 1 110 LEU MD2 5.410 . 5.410 4.740 4.553 4.902 . 0 0 "[ . 1 . 2]" 1
624 1 28 LYS H 1 28 LYS HG2 4.340 . 4.340 1.914 1.796 2.055 0.004 7 0 "[ . 1 . 2]" 1
625 1 112 SER HA 1 113 CYS H 2.830 . 2.830 2.200 2.094 2.275 . 0 0 "[ . 1 . 2]" 1
626 1 114 ASN HA 1 117 PHE H 4.280 . 4.280 3.243 2.800 3.697 . 0 0 "[ . 1 . 2]" 1
627 1 117 PHE QD 1 118 SER HA 4.470 . 4.470 2.623 2.337 4.308 . 0 0 "[ . 1 . 2]" 1
628 1 119 LYS HA 1 119 LYS HB3 2.900 . 2.900 2.400 2.345 2.509 . 0 0 "[ . 1 . 2]" 1
629 1 29 VAL MG2 1 72 PHE QD 4.440 . 4.440 3.679 3.424 3.888 . 0 0 "[ . 1 . 2]" 1
630 1 30 TYR H 1 31 GLN QB 4.480 . 4.480 4.491 4.270 4.553 0.073 3 0 "[ . 1 . 2]" 1
631 1 30 TYR QD 1 41 PHE HZ 4.360 . 4.360 4.002 3.760 4.362 0.002 14 0 "[ . 1 . 2]" 1
632 1 32 LEU MD1 1 33 LEU HA 4.040 . 4.040 3.347 3.264 3.432 . 0 0 "[ . 1 . 2]" 1
633 1 33 LEU H 1 33 LEU MD2 3.860 . 3.860 3.244 3.053 3.793 . 0 0 "[ . 1 . 2]" 1
634 1 33 LEU MD1 1 109 LEU MD2 4.160 . 4.160 3.311 2.857 3.607 . 0 0 "[ . 1 . 2]" 1
635 1 35 ASP H 1 36 GLN HG3 4.540 . 4.540 4.115 3.747 4.465 . 0 0 "[ . 1 . 2]" 1
636 1 43 THR HB 1 44 LYS H 3.940 . 3.940 2.920 2.731 3.134 . 0 0 "[ . 1 . 2]" 1
637 1 59 ASN HB3 1 60 THR HA 5.310 . 5.310 4.509 4.138 4.655 . 0 0 "[ . 1 . 2]" 1
638 1 60 THR HB 1 62 LEU H 4.800 . 4.800 4.532 3.085 5.061 0.261 17 0 "[ . 1 . 2]" 1
639 1 68 TYR H 1 90 ALA MB 4.230 . 4.230 3.823 3.488 4.093 . 0 0 "[ . 1 . 2]" 1
640 1 74 ARG HB3 1 79 VAL MG2 4.190 . 4.190 2.123 1.801 2.924 . 0 0 "[ . 1 . 2]" 1
641 1 75 HIS HB2 1 77 ASN H 4.450 . 4.450 3.572 3.421 3.698 . 0 0 "[ . 1 . 2]" 1
642 1 78 ILE HB 1 79 VAL H 4.540 . 4.540 4.376 4.308 4.425 . 0 0 "[ . 1 . 2]" 1
643 1 78 ILE MG 1 79 VAL H 3.420 . 3.420 2.979 2.795 3.138 . 0 0 "[ . 1 . 2]" 1
644 1 25 ILE MG 1 95 LYS QE 3.780 . 3.780 3.716 2.724 3.943 0.163 11 0 "[ . 1 . 2]" 1
645 1 80 ALA MB 1 94 MET H 4.520 . 4.520 4.527 4.405 4.578 0.058 15 0 "[ . 1 . 2]" 1
646 1 87 VAL HA 1 90 ALA H 4.000 . 4.000 3.757 3.581 4.009 0.009 15 0 "[ . 1 . 2]" 1
647 1 26 GLU QG 1 72 PHE QE 4.210 . 4.210 3.420 2.442 4.283 0.073 18 0 "[ . 1 . 2]" 1
648 1 91 LYS H 1 95 LYS QD 5.500 . 5.500 5.455 5.122 5.564 0.064 9 0 "[ . 1 . 2]" 1
649 1 91 LYS QD 1 94 MET ME 4.140 . 4.140 3.837 3.474 4.214 0.074 2 0 "[ . 1 . 2]" 1
650 1 92 TYR QE 1 96 GLN HG2 3.860 . 3.860 3.682 3.478 3.849 . 0 0 "[ . 1 . 2]" 1
651 1 99 LEU H 1 102 LEU MD2 4.260 . 4.260 3.817 3.697 3.924 . 0 0 "[ . 1 . 2]" 1
652 1 100 LYS HA 1 103 GLU H 3.960 . 3.960 3.347 3.268 3.495 . 0 0 "[ . 1 . 2]" 1
653 1 105 LYS QE 1 105 LYS HG3 3.580 . 3.580 2.659 2.309 3.059 . 0 0 "[ . 1 . 2]" 1
654 1 108 LEU HA 1 108 LEU MD2 3.410 . 3.410 3.118 3.086 3.175 . 0 0 "[ . 1 . 2]" 1
655 1 117 PHE H 1 117 PHE HB3 3.440 . 3.440 3.391 3.285 3.464 0.024 18 0 "[ . 1 . 2]" 1
656 1 118 SER HA 1 119 LYS HB2 5.120 . 5.120 4.961 4.675 5.389 0.269 1 0 "[ . 1 . 2]" 1
657 1 118 SER HA 1 119 LYS QG 4.470 . 4.470 3.514 2.897 4.491 0.021 4 0 "[ . 1 . 2]" 1
658 1 119 LYS HA 1 119 LYS QE 4.490 . 4.490 4.011 2.080 4.371 . 0 0 "[ . 1 . 2]" 1
659 1 29 VAL HA 1 32 LEU HG 4.340 . 4.340 3.607 3.370 3.900 . 0 0 "[ . 1 . 2]" 1
660 1 30 TYR HB2 1 31 GLN HG2 4.750 . 4.750 3.793 3.485 4.153 . 0 0 "[ . 1 . 2]" 1
661 1 32 LEU HB2 1 33 LEU H 3.400 . 3.400 3.313 3.194 3.415 0.015 4 0 "[ . 1 . 2]" 1
662 1 33 LEU H 1 33 LEU HG 3.820 . 3.820 2.621 2.419 4.112 0.292 14 0 "[ . 1 . 2]" 1
663 1 33 LEU HA 1 35 ASP H 4.050 . 4.050 3.959 3.845 4.093 0.043 14 0 "[ . 1 . 2]" 1
664 1 36 GLN HE21 1 110 LEU MD1 5.140 . 5.140 4.769 4.378 5.083 . 0 0 "[ . 1 . 2]" 1
665 1 40 ASP HB2 1 75 HIS HD2 5.500 . 5.500 4.840 4.425 5.143 . 0 0 "[ . 1 . 2]" 1
666 1 40 ASP HB3 1 41 PHE H 4.540 . 4.540 4.427 4.376 4.471 . 0 0 "[ . 1 . 2]" 1
667 1 41 PHE HA 1 41 PHE QD 4.300 . 4.300 3.720 3.705 3.747 . 0 0 "[ . 1 . 2]" 1
668 1 47 ILE MG 1 68 TYR H 4.810 . 4.810 4.727 4.367 4.875 0.065 19 0 "[ . 1 . 2]" 1
669 1 47 ILE MG 1 68 TYR QD 3.830 . 3.830 3.472 3.181 3.952 0.122 6 0 "[ . 1 . 2]" 1
670 1 60 THR HB 1 61 GLU H 3.970 . 3.970 2.428 1.624 4.151 0.181 13 0 "[ . 1 . 2]" 1
671 1 70 PHE QD 1 87 VAL MG2 5.500 . 5.500 3.738 3.484 3.828 . 0 0 "[ . 1 . 2]" 1
672 1 71 SER HB3 1 81 TYR QD 4.190 . 4.190 2.897 1.781 4.191 0.019 16 0 "[ . 1 . 2]" 1
673 1 74 ARG HB2 1 75 HIS H 4.650 . 4.650 4.436 4.161 4.607 . 0 0 "[ . 1 . 2]" 1
674 1 76 GLY H 1 77 ASN H 3.490 . 3.490 2.569 2.460 2.703 . 0 0 "[ . 1 . 2]" 1
675 1 78 ILE HA 1 80 ALA H 4.090 . 4.090 3.625 3.473 3.884 . 0 0 "[ . 1 . 2]" 1
676 1 79 VAL MG1 1 98 LEU HA 4.470 . 4.470 3.174 2.945 3.364 . 0 0 "[ . 1 . 2]" 1
677 1 79 VAL MG2 1 109 LEU HG 4.280 . 4.280 4.355 4.333 4.399 0.119 19 0 "[ . 1 . 2]" 1
678 1 82 GLY HA3 1 93 ILE HB 3.940 . 3.940 2.002 1.862 2.164 . 0 0 "[ . 1 . 2]" 1
679 1 83 LYS H 1 93 ILE MD 3.690 . 3.690 3.420 3.150 3.718 0.028 5 0 "[ . 1 . 2]" 1
680 1 83 LYS HA 1 83 LYS HG2 4.160 . 4.160 3.374 2.731 3.825 . 0 0 "[ . 1 . 2]" 1
681 1 88 ALA MB 1 91 LYS H 5.090 . 5.090 4.763 4.537 4.970 . 0 0 "[ . 1 . 2]" 1
682 1 89 ASN HA 1 92 TYR QB 3.420 . 3.420 2.310 2.134 2.478 . 0 0 "[ . 1 . 2]" 1
683 1 26 GLU HA 1 29 VAL MG2 4.540 . 4.540 3.637 2.472 4.575 0.035 7 0 "[ . 1 . 2]" 1
684 1 90 ALA H 1 92 TYR H 4.530 . 4.530 4.030 3.943 4.121 . 0 0 "[ . 1 . 2]" 1
685 1 91 LYS HA 1 91 LYS HG3 4.250 . 4.250 2.760 2.262 3.151 . 0 0 "[ . 1 . 2]" 1
686 1 97 ARG HA 1 100 LYS HB2 4.390 . 4.390 3.606 3.301 3.918 . 0 0 "[ . 1 . 2]" 1
687 1 99 LEU HA 1 102 LEU MD2 3.440 . 3.440 2.288 2.148 2.406 . 0 0 "[ . 1 . 2]" 1
688 1 100 LYS HA 1 104 ASP H 4.210 . 4.210 3.670 3.422 4.020 . 0 0 "[ . 1 . 2]" 1
689 1 101 LEU HA 1 104 ASP H 4.500 . 4.500 3.616 3.454 3.811 . 0 0 "[ . 1 . 2]" 1
690 1 29 VAL HA 1 30 TYR HA 4.950 . 4.950 4.737 4.695 4.796 . 0 0 "[ . 1 . 2]" 1
691 1 29 VAL HA 1 32 LEU H 4.240 . 4.240 3.927 3.725 4.104 . 0 0 "[ . 1 . 2]" 1
692 1 29 VAL HA 1 102 LEU MD2 3.700 . 3.700 3.373 3.115 3.699 . 0 0 "[ . 1 . 2]" 1
693 1 120 LYS QE 1 121 LYS H 4.730 . 4.730 3.058 1.775 4.660 0.025 11 0 "[ . 1 . 2]" 1
694 1 30 TYR HA 1 30 TYR QE 4.820 . 4.820 4.466 4.387 4.650 . 0 0 "[ . 1 . 2]" 1
695 1 31 GLN QB 1 32 LEU MD2 4.040 . 4.040 3.862 3.753 3.959 . 0 0 "[ . 1 . 2]" 1
696 1 34 LYS HG2 1 35 ASP H 4.380 . 4.380 3.147 2.548 4.185 . 0 0 "[ . 1 . 2]" 1
697 1 36 GLN HE22 1 110 LEU HA 3.990 . 3.990 2.745 1.788 3.454 0.012 14 0 "[ . 1 . 2]" 1
698 1 40 ASP HB3 1 74 ARG HA 5.500 . 5.500 5.119 4.825 5.389 . 0 0 "[ . 1 . 2]" 1
699 1 41 PHE HA 1 74 ARG HA 4.220 . 4.220 2.471 2.189 2.870 . 0 0 "[ . 1 . 2]" 1
700 1 44 LYS QE 1 46 VAL QG 3.280 . 3.280 2.611 1.928 3.316 0.036 4 0 "[ . 1 . 2]" 1
701 1 45 CYS HA 1 69 GLY H 5.280 . 5.280 4.749 4.381 5.176 . 0 0 "[ . 1 . 2]" 1
702 1 50 VAL MG2 1 67 TYR QD 4.430 . 4.430 2.031 1.794 2.250 0.006 6 0 "[ . 1 . 2]" 1
703 1 64 LEU HB2 1 64 LEU MD2 3.310 . 3.310 2.613 2.360 3.206 . 0 0 "[ . 1 . 2]" 1
704 1 69 GLY HA2 1 83 LYS QB 4.730 . 4.730 2.873 2.112 3.782 . 0 0 "[ . 1 . 2]" 1
705 1 70 PHE QD 1 91 LYS QD 5.400 . 5.400 4.370 3.828 5.142 . 0 0 "[ . 1 . 2]" 1
706 1 72 PHE HB3 1 73 PHE H 4.230 . 4.230 4.108 4.038 4.173 . 0 0 "[ . 1 . 2]" 1
707 1 72 PHE HZ 1 73 PHE H 5.500 . 5.500 5.490 5.379 5.551 0.051 6 0 "[ . 1 . 2]" 1
708 1 72 PHE QE 1 79 VAL HB 4.400 . 4.400 4.236 3.494 4.443 0.043 16 0 "[ . 1 . 2]" 1
709 1 74 ARG HE 1 75 HIS HD2 3.910 . 3.910 2.625 2.079 3.642 . 0 0 "[ . 1 . 2]" 1
710 1 77 ASN H 1 79 VAL MG2 5.200 . 5.200 4.958 4.692 5.194 . 0 0 "[ . 1 . 2]" 1
711 1 78 ILE MG 1 81 TYR HA 4.170 . 4.170 3.627 3.400 3.776 . 0 0 "[ . 1 . 2]" 1
712 1 79 VAL MG1 1 80 ALA H 3.550 . 3.550 3.460 3.285 3.579 0.029 15 0 "[ . 1 . 2]" 1
713 1 79 VAL MG1 1 109 LEU HB2 4.090 . 4.090 1.806 1.730 1.974 0.070 1 0 "[ . 1 . 2]" 1
714 1 80 ALA MB 1 94 MET HA 3.650 . 3.650 2.231 2.085 2.305 . 0 0 "[ . 1 . 2]" 1
715 1 80 ALA MB 1 97 ARG HG3 3.850 . 3.850 2.725 2.522 3.026 . 0 0 "[ . 1 . 2]" 1
716 1 80 ALA MB 1 98 LEU MD2 3.540 . 3.540 2.727 2.488 3.025 . 0 0 "[ . 1 . 2]" 1
717 1 83 LYS HA 1 83 LYS HG3 4.160 . 4.160 2.716 2.494 3.658 . 0 0 "[ . 1 . 2]" 1
718 1 26 GLU H 1 27 HIS H 4.450 . 4.450 2.590 2.419 2.792 . 0 0 "[ . 1 . 2]" 1
719 1 90 ALA H 1 93 ILE MD 4.170 . 4.170 4.061 3.779 4.197 0.027 7 0 "[ . 1 . 2]" 1
720 1 93 ILE HA 1 96 GLN HB2 4.330 . 4.330 3.090 2.708 3.251 . 0 0 "[ . 1 . 2]" 1
721 1 97 ARG HA 1 97 ARG HG3 3.840 . 3.840 3.758 3.689 3.819 . 0 0 "[ . 1 . 2]" 1
722 1 99 LEU H 1 102 LEU H 5.000 . 5.000 4.841 4.741 4.922 . 0 0 "[ . 1 . 2]" 1
723 1 100 LYS QE 1 104 ASP HA 4.740 . 4.740 4.453 3.810 4.780 0.040 4 0 "[ . 1 . 2]" 1
724 1 100 LYS QG 1 104 ASP H 5.500 . 5.500 5.521 5.462 5.560 0.060 7 0 "[ . 1 . 2]" 1
725 1 102 LEU H 1 110 LEU MD2 4.690 . 4.690 4.349 4.153 4.547 . 0 0 "[ . 1 . 2]" 1
726 1 105 LYS H 1 106 SER HA 5.320 . 5.320 5.129 5.060 5.185 . 0 0 "[ . 1 . 2]" 1
727 1 109 LEU HB3 1 109 LEU MD1 3.550 . 3.550 3.168 3.122 3.191 . 0 0 "[ . 1 . 2]" 1
728 1 28 LYS HG2 1 102 LEU MD2 3.950 . 3.950 3.959 3.786 4.029 0.079 4 0 "[ . 1 . 2]" 1
729 1 28 LYS HG3 1 102 LEU MD2 3.950 . 3.950 3.129 2.950 3.268 . 0 0 "[ . 1 . 2]" 1
730 1 110 LEU HA 1 110 LEU MD2 3.160 . 3.160 2.284 2.202 2.403 . 0 0 "[ . 1 . 2]" 1
731 1 117 PHE HB2 1 118 SER H 3.760 . 3.760 2.348 2.118 2.678 . 0 0 "[ . 1 . 2]" 1
732 1 29 VAL H 1 98 LEU MD2 5.100 . 5.100 4.710 4.329 5.034 . 0 0 "[ . 1 . 2]" 1
733 1 30 TYR HA 1 41 PHE QD 4.650 . 4.650 4.161 3.836 4.480 . 0 0 "[ . 1 . 2]" 1
734 1 32 LEU H 1 32 LEU MD2 3.790 . 3.790 3.498 3.453 3.563 . 0 0 "[ . 1 . 2]" 1
735 1 32 LEU HA 1 36 GLN HG3 4.690 . 4.690 4.371 4.058 4.696 0.006 4 0 "[ . 1 . 2]" 1
736 1 32 LEU HG 1 33 LEU H 3.690 . 3.690 3.312 3.254 3.391 . 0 0 "[ . 1 . 2]" 1
737 1 33 LEU MD1 1 41 PHE QE 4.290 . 4.290 3.332 2.992 4.506 0.216 14 0 "[ . 1 . 2]" 1
738 1 34 LYS HG3 1 35 ASP H 4.380 . 4.380 2.736 2.353 3.345 . 0 0 "[ . 1 . 2]" 1
739 1 44 LYS QG 1 46 VAL QG 4.220 . 4.220 3.530 2.706 4.170 . 0 0 "[ . 1 . 2]" 1
740 1 47 ILE MG 1 48 GLU HB2 4.540 . 4.540 4.545 4.357 4.632 0.092 13 0 "[ . 1 . 2]" 1
741 1 48 GLU HB3 1 49 GLU H 4.430 . 4.430 3.836 3.677 4.068 . 0 0 "[ . 1 . 2]" 1
742 1 48 GLU HB2 1 69 GLY HA3 4.000 . 4.000 3.905 3.366 4.117 0.117 17 0 "[ . 1 . 2]" 1
743 1 48 GLU HG3 1 69 GLY H 4.400 . 4.400 3.546 3.039 4.119 . 0 0 "[ . 1 . 2]" 1
744 1 50 VAL H 1 65 THR MG 4.940 . 4.940 4.247 3.850 4.764 . 0 0 "[ . 1 . 2]" 1
745 1 56 THR MG 1 58 LEU HG 4.710 . 4.710 4.279 3.654 4.772 0.062 9 0 "[ . 1 . 2]" 1
746 1 65 THR MG 1 67 TYR H 5.500 . 5.500 5.204 5.046 5.489 . 0 0 "[ . 1 . 2]" 1
747 1 69 GLY H 1 83 LYS HA 5.190 . 5.190 4.758 4.281 5.229 0.039 9 0 "[ . 1 . 2]" 1
748 1 70 PHE QD 1 91 LYS HB2 5.500 . 5.500 4.675 3.467 5.318 . 0 0 "[ . 1 . 2]" 1
749 1 71 SER HB3 1 81 TYR HA 5.100 . 5.100 3.499 2.588 4.410 . 0 0 "[ . 1 . 2]" 1
750 1 72 PHE HA 1 73 PHE QD 4.580 . 4.580 4.254 3.882 4.751 0.171 19 0 "[ . 1 . 2]" 1
751 1 72 PHE HA 1 79 VAL HB 5.500 . 5.500 5.373 5.120 5.572 0.072 4 0 "[ . 1 . 2]" 1
752 1 72 PHE HB2 1 98 LEU MD1 4.600 . 4.600 2.770 2.604 3.308 . 0 0 "[ . 1 . 2]" 1
753 1 73 PHE QD 1 76 GLY H 4.500 . 4.500 2.838 2.558 3.066 . 0 0 "[ . 1 . 2]" 1
754 1 79 VAL MG1 1 80 ALA MB 3.280 . 3.280 2.987 2.855 3.090 . 0 0 "[ . 1 . 2]" 1
755 1 86 LYS HA 1 87 VAL H 3.460 . 3.460 2.167 2.130 2.267 . 0 0 "[ . 1 . 2]" 1
756 1 92 TYR H 1 93 ILE HA 5.500 . 5.500 5.372 5.332 5.419 . 0 0 "[ . 1 . 2]" 1
757 1 92 TYR QD 1 93 ILE QG 3.710 . 3.710 2.263 1.909 2.362 . 0 0 "[ . 1 . 2]" 1
758 1 97 ARG HG2 1 98 LEU H 4.480 . 4.480 4.229 4.029 4.370 . 0 0 "[ . 1 . 2]" 1
759 1 98 LEU H 1 99 LEU HB3 4.850 . 4.850 4.792 4.615 4.867 0.017 2 0 "[ . 1 . 2]" 1
760 1 27 HIS HB3 1 28 LYS H 4.450 . 4.450 3.081 2.336 3.669 . 0 0 "[ . 1 . 2]" 1
761 1 107 ASN HA 1 110 LEU MD2 5.490 . 5.490 5.086 4.835 5.348 . 0 0 "[ . 1 . 2]" 1
762 1 109 LEU H 1 110 LEU HA 5.000 . 5.000 4.716 4.627 4.840 . 0 0 "[ . 1 . 2]" 1
763 1 109 LEU HB3 1 109 LEU MD2 3.550 . 3.550 2.183 2.131 2.231 . 0 0 "[ . 1 . 2]" 1
764 1 28 LYS H 1 29 VAL H 3.540 . 3.540 2.766 2.706 2.910 . 0 0 "[ . 1 . 2]" 1
765 1 28 LYS QD 1 29 VAL H 4.550 . 4.550 4.530 4.375 4.579 0.029 6 0 "[ . 1 . 2]" 1
766 1 110 LEU HB2 1 110 LEU MD1 2.950 . 2.950 2.240 2.200 2.272 . 0 0 "[ . 1 . 2]" 1
767 1 111 TYR H 1 111 TYR QE 4.240 . 4.240 4.262 4.074 4.338 0.098 8 0 "[ . 1 . 2]" 1
768 1 112 SER H 1 113 CYS H 4.670 . 4.670 4.536 4.464 4.577 . 0 0 "[ . 1 . 2]" 1
769 1 115 CYS H 1 115 CYS QB 3.000 . 3.000 2.319 2.259 2.388 . 0 0 "[ . 1 . 2]" 1
770 1 116 LYS QE 1 116 LYS HG3 3.450 . 3.450 2.378 2.307 2.437 . 0 0 "[ . 1 . 2]" 1
771 1 121 LYS HA 1 121 LYS QG 3.250 . 3.250 2.604 2.257 3.093 . 0 0 "[ . 1 . 2]" 1
772 1 31 GLN HG2 1 32 LEU H 5.060 . 5.060 4.530 4.337 4.722 . 0 0 "[ . 1 . 2]" 1
773 1 31 GLN QB 1 32 LEU HG 4.250 . 4.250 2.911 2.718 3.089 . 0 0 "[ . 1 . 2]" 1
774 1 33 LEU HG 1 41 PHE QE 5.180 . 5.180 4.774 3.460 4.925 . 0 0 "[ . 1 . 2]" 1
775 1 34 LYS H 1 36 GLN H 4.380 . 4.380 4.179 3.904 4.329 . 0 0 "[ . 1 . 2]" 1
776 1 35 ASP HA 1 37 GLY H 4.190 . 4.190 3.740 3.362 4.213 0.023 12 0 "[ . 1 . 2]" 1
777 1 36 GLN H 1 36 GLN HB2 3.050 . 3.050 2.748 2.605 2.829 . 0 0 "[ . 1 . 2]" 1
778 1 41 PHE HB2 1 72 PHE QE 4.670 . 4.670 2.216 1.856 2.919 . 0 0 "[ . 1 . 2]" 1
779 1 43 THR HA 1 72 PHE QD 4.690 . 4.690 3.493 3.186 3.776 . 0 0 "[ . 1 . 2]" 1
780 1 44 LYS H 1 44 LYS QG 4.470 . 4.470 2.418 2.288 2.608 . 0 0 "[ . 1 . 2]" 1
781 1 47 ILE H 1 47 ILE HG12 4.700 . 4.700 3.708 3.566 4.098 . 0 0 "[ . 1 . 2]" 1
782 1 49 GLU H 1 67 TYR H 4.720 . 4.720 4.293 4.110 4.460 . 0 0 "[ . 1 . 2]" 1
783 1 49 GLU HB2 1 67 TYR H 5.500 . 5.500 4.999 4.437 5.477 . 0 0 "[ . 1 . 2]" 1
784 1 49 GLU HB3 1 50 VAL H 4.310 . 4.310 4.072 3.379 4.310 . 18 0 "[ . 1 . 2]" 1
785 1 74 ARG HB3 1 75 HIS H 4.650 . 4.650 4.338 3.872 4.527 . 0 0 "[ . 1 . 2]" 1
786 1 77 ASN HA 1 78 ILE MD 5.170 . 5.170 4.620 4.408 4.799 . 0 0 "[ . 1 . 2]" 1
787 1 79 VAL HB 1 80 ALA MB 4.510 . 4.510 3.598 3.487 3.681 . 0 0 "[ . 1 . 2]" 1
788 1 79 VAL HB 1 98 LEU HG 5.200 . 5.200 3.951 3.591 4.300 . 0 0 "[ . 1 . 2]" 1
789 1 79 VAL HB 1 98 LEU MD1 5.420 . 5.420 4.799 4.512 5.300 . 0 0 "[ . 1 . 2]" 1
790 1 79 VAL HB 1 98 LEU MD2 5.420 . 5.420 2.903 2.646 3.198 . 0 0 "[ . 1 . 2]" 1
791 1 79 VAL MG1 1 109 LEU MD2 3.750 . 3.750 3.003 2.693 3.341 . 0 0 "[ . 1 . 2]" 1
792 1 79 VAL MG2 1 80 ALA MB 4.820 . 4.820 4.696 4.617 4.744 . 0 0 "[ . 1 . 2]" 1
793 1 25 ILE MD 1 28 LYS HB3 3.590 . 3.590 3.354 3.100 3.618 0.028 5 0 "[ . 1 . 2]" 1
794 1 25 ILE MD 1 28 LYS HG3 3.680 . 3.680 2.719 2.095 3.072 . 0 0 "[ . 1 . 2]" 1
795 1 25 ILE MG 1 26 GLU QG 4.000 . 4.000 2.796 2.214 3.304 . 0 0 "[ . 1 . 2]" 1
796 1 86 LYS H 1 89 ASN HB2 4.370 . 4.370 4.345 4.058 4.440 0.070 20 0 "[ . 1 . 2]" 1
797 1 89 ASN HB3 1 90 ALA MB 4.150 . 4.150 3.874 3.803 4.015 . 0 0 "[ . 1 . 2]" 1
798 1 26 GLU HA 1 98 LEU MD2 5.050 . 5.050 4.576 4.238 4.733 . 0 0 "[ . 1 . 2]" 1
799 1 91 LYS HA 1 94 MET H 4.340 . 4.340 3.776 3.599 3.943 . 0 0 "[ . 1 . 2]" 1
800 1 91 LYS QD 1 92 TYR H 5.220 . 5.220 5.102 4.431 5.284 0.064 4 0 "[ . 1 . 2]" 1
801 1 94 MET ME 1 95 LYS QD 3.860 . 3.860 3.707 1.908 3.969 0.109 16 0 "[ . 1 . 2]" 1
802 1 95 LYS H 1 95 LYS HB2 3.620 . 3.620 2.359 2.158 2.420 . 0 0 "[ . 1 . 2]" 1
803 1 98 LEU HA 1 101 LEU MD2 4.220 . 4.220 3.375 1.785 4.266 0.046 18 0 "[ . 1 . 2]" 1
804 1 100 LYS HB2 1 101 LEU H 3.750 . 3.750 3.210 2.997 3.443 . 0 0 "[ . 1 . 2]" 1
805 1 101 LEU H 1 101 LEU HG 4.060 . 4.060 3.086 2.286 4.217 0.157 13 0 "[ . 1 . 2]" 1
806 1 101 LEU H 1 102 LEU HA 5.350 . 5.350 5.228 5.174 5.295 . 0 0 "[ . 1 . 2]" 1
807 1 101 LEU HA 1 105 LYS H 4.080 . 4.080 3.898 3.694 4.094 0.014 15 0 "[ . 1 . 2]" 1
808 1 102 LEU HA 1 110 LEU MD1 3.540 . 3.540 1.942 1.786 2.164 0.014 8 0 "[ . 1 . 2]" 1
809 1 107 ASN HA 1 111 TYR QD 5.500 . 5.500 4.934 4.634 5.370 . 0 0 "[ . 1 . 2]" 1
810 1 109 LEU HA 1 111 TYR QE 4.920 . 4.920 4.043 3.470 4.327 . 0 0 "[ . 1 . 2]" 1
811 1 110 LEU HB2 1 110 LEU MD2 3.520 . 3.520 3.182 3.169 3.195 . 0 0 "[ . 1 . 2]" 1
812 1 114 ASN HD21 1 117 PHE HA 4.170 . 4.170 3.367 2.456 4.291 0.121 8 0 "[ . 1 . 2]" 1
813 1 120 LYS QE 1 121 LYS QD 3.910 . 3.910 3.816 2.424 4.024 0.114 8 0 "[ . 1 . 2]" 1
814 1 32 LEU MD2 1 36 GLN HE21 4.710 . 4.710 4.125 3.718 4.510 . 0 0 "[ . 1 . 2]" 1
815 1 33 LEU MD1 1 109 LEU MD1 4.160 . 4.160 1.985 1.793 2.474 0.007 7 0 "[ . 1 . 2]" 1
816 1 34 LYS H 1 41 PHE QE 4.380 . 4.380 3.874 3.751 4.042 . 0 0 "[ . 1 . 2]" 1
817 1 39 GLU H 1 115 CYS H 5.470 . 5.470 5.613 5.464 5.703 0.233 18 0 "[ . 1 . 2]" 1
818 1 41 PHE HB3 1 72 PHE QE 4.670 . 4.670 2.984 2.677 3.271 . 0 0 "[ . 1 . 2]" 1
819 1 43 THR MG 1 94 MET ME 3.110 . 3.110 2.153 1.873 2.572 . 0 0 "[ . 1 . 2]" 1
820 1 44 LYS HB2 1 73 PHE QE 4.460 . 4.460 4.079 3.267 4.501 0.041 15 0 "[ . 1 . 2]" 1
821 1 44 LYS QG 1 73 PHE QE 3.830 . 3.830 2.443 1.759 3.833 0.041 1 0 "[ . 1 . 2]" 1
822 1 46 VAL QG 1 69 GLY HA3 4.120 . 4.120 3.024 2.376 4.135 0.015 13 0 "[ . 1 . 2]" 1
823 1 47 ILE HA 1 48 GLU HB2 4.480 . 4.480 4.462 4.344 4.524 0.044 7 0 "[ . 1 . 2]" 1
824 1 48 GLU HB2 1 49 GLU H 4.550 . 4.550 4.448 4.345 4.529 . 0 0 "[ . 1 . 2]" 1
825 1 49 GLU HB3 1 66 LYS HG3 5.420 . 5.420 4.290 3.643 4.809 . 0 0 "[ . 1 . 2]" 1
826 1 50 VAL H 1 50 VAL MG1 3.890 . 3.890 3.806 3.769 3.897 0.007 13 0 "[ . 1 . 2]" 1
827 1 50 VAL MG1 1 67 TYR QE 3.920 . 3.920 3.723 3.376 3.969 0.049 9 0 "[ . 1 . 2]" 1
828 1 58 LEU HG 1 59 ASN HB2 5.500 . 5.500 4.355 3.949 4.607 . 0 0 "[ . 1 . 2]" 1
829 1 58 LEU QB 1 59 ASN HB2 5.330 . 5.330 4.075 3.778 4.511 . 0 0 "[ . 1 . 2]" 1
830 1 64 LEU HA 1 64 LEU MD2 3.960 . 3.960 3.635 1.841 4.072 0.112 2 0 "[ . 1 . 2]" 1
831 1 71 SER HB2 1 81 TYR QD 4.190 . 4.190 3.447 1.787 4.226 0.036 9 0 "[ . 1 . 2]" 1
832 1 73 PHE QD 1 74 ARG H 3.780 . 3.780 3.174 2.427 3.749 . 0 0 "[ . 1 . 2]" 1
833 1 75 HIS HD2 1 113 CYS HB2 5.030 . 5.030 4.896 4.619 5.074 0.044 4 0 "[ . 1 . 2]" 1
834 1 75 HIS HE1 1 115 CYS HA 4.520 . 4.520 4.643 4.479 4.772 0.252 1 0 "[ . 1 . 2]" 1
835 1 78 ILE HG12 1 78 ILE MG 3.320 . 3.320 3.201 3.195 3.207 . 0 0 "[ . 1 . 2]" 1
836 1 79 VAL H 1 79 VAL MG1 3.970 . 3.970 3.782 3.762 3.822 . 0 0 "[ . 1 . 2]" 1
837 1 80 ALA MB 1 97 ARG QB 3.320 . 3.320 1.990 1.873 2.033 . 0 0 "[ . 1 . 2]" 1
838 1 82 GLY HA2 1 93 ILE MD 4.140 . 4.140 2.997 2.816 3.220 . 0 0 "[ . 1 . 2]" 1
839 1 95 LYS HB2 1 96 GLN H 3.410 . 3.410 2.586 2.449 2.755 . 0 0 "[ . 1 . 2]" 1
840 1 96 GLN H 1 96 GLN HG3 4.370 . 4.370 3.690 3.535 3.776 . 0 0 "[ . 1 . 2]" 1
841 1 96 GLN HA 1 96 GLN HG3 3.700 . 3.700 3.709 3.667 3.760 0.060 4 0 "[ . 1 . 2]" 1
842 1 96 GLN HA 1 99 LEU HB2 3.860 . 3.860 2.795 2.577 3.231 . 0 0 "[ . 1 . 2]" 1
843 1 98 LEU HB3 1 99 LEU H 4.320 . 4.320 4.103 4.020 4.233 . 0 0 "[ . 1 . 2]" 1
844 1 100 LYS QG 1 101 LEU H 4.790 . 4.790 4.605 4.463 4.657 . 0 0 "[ . 1 . 2]" 1
845 1 101 LEU MD2 1 106 SER H 5.500 . 5.500 4.344 3.562 5.548 0.048 4 0 "[ . 1 . 2]" 1
846 1 109 LEU HA 1 109 LEU MD2 3.910 . 3.910 3.953 3.930 3.970 0.060 12 0 "[ . 1 . 2]" 1
847 1 29 VAL MG2 1 72 PHE QE 4.060 . 4.060 2.901 2.630 3.353 . 0 0 "[ . 1 . 2]" 1
848 1 120 LYS QB 1 121 LYS H 3.730 . 3.730 3.173 1.797 3.875 0.145 12 0 "[ . 1 . 2]" 1
849 1 32 LEU HA 1 36 GLN HG2 4.340 . 4.340 4.405 4.232 4.480 0.140 14 0 "[ . 1 . 2]" 1
850 1 32 LEU MD2 1 33 LEU H 4.570 . 4.570 4.306 4.254 4.415 . 0 0 "[ . 1 . 2]" 1
851 1 32 LEU MD2 1 102 LEU H 4.960 . 4.960 4.819 4.642 4.982 0.022 14 0 "[ . 1 . 2]" 1
852 1 34 LYS H 1 35 ASP HA 5.390 . 5.390 5.190 5.137 5.251 . 0 0 "[ . 1 . 2]" 1
853 1 37 GLY H 1 38 CYS H 3.120 . 3.120 2.129 1.877 2.347 . 0 0 "[ . 1 . 2]" 1
854 1 38 CYS H 1 39 GLU H 4.520 . 4.520 4.418 4.291 4.521 0.001 6 0 "[ . 1 . 2]" 1
855 1 42 GLY H 1 73 PHE H 3.990 . 3.990 3.165 3.073 3.271 . 0 0 "[ . 1 . 2]" 1
856 1 43 THR MG 1 94 MET QG 5.110 . 5.110 4.292 3.443 4.751 . 0 0 "[ . 1 . 2]" 1
857 1 44 LYS QE 1 73 PHE QE 4.460 . 4.460 2.628 1.770 3.599 0.030 12 0 "[ . 1 . 2]" 1
858 1 45 CYS HA 1 46 VAL HB 5.190 . 5.190 4.899 4.691 5.263 0.073 4 0 "[ . 1 . 2]" 1
859 1 47 ILE HG13 1 47 ILE MG 3.480 . 3.480 3.203 3.190 3.209 . 0 0 "[ . 1 . 2]" 1
860 1 48 GLU H 1 69 GLY H 3.830 . 3.830 3.010 2.718 3.187 . 0 0 "[ . 1 . 2]" 1
861 1 64 LEU MD1 1 65 THR HB 5.500 . 5.500 4.024 2.945 5.468 . 0 0 "[ . 1 . 2]" 1
862 1 68 TYR H 1 68 TYR QD 3.480 . 3.480 2.742 2.482 3.124 . 0 0 "[ . 1 . 2]" 1
863 1 70 PHE HZ 1 87 VAL MG1 4.910 . 4.910 4.868 4.705 4.967 0.057 12 0 "[ . 1 . 2]" 1
864 1 74 ARG H 1 75 HIS H 4.440 . 4.440 3.944 3.833 4.159 . 0 0 "[ . 1 . 2]" 1
865 1 78 ILE HA 1 78 ILE HG12 3.970 . 3.970 2.802 2.725 2.876 . 0 0 "[ . 1 . 2]" 1
866 1 79 VAL HB 1 80 ALA H 3.460 . 3.460 2.707 2.585 2.766 . 0 0 "[ . 1 . 2]" 1
867 1 87 VAL H 1 87 VAL MG2 3.780 . 3.780 3.762 3.750 3.775 . 0 0 "[ . 1 . 2]" 1
868 1 88 ALA MB 1 91 LYS QE 3.980 . 3.980 3.342 2.945 4.140 0.160 2 0 "[ . 1 . 2]" 1
869 1 26 GLU H 1 26 GLU QG 4.660 . 4.660 2.893 2.332 3.475 . 0 0 "[ . 1 . 2]" 1
870 1 26 GLU QG 1 98 LEU MD2 4.990 . 4.990 4.912 4.335 5.068 0.078 12 0 "[ . 1 . 2]" 1
871 1 92 TYR HA 1 95 LYS H 4.210 . 4.210 3.760 3.567 3.890 . 0 0 "[ . 1 . 2]" 1
872 1 94 MET H 1 94 MET ME 4.580 . 4.580 4.570 4.250 4.649 0.069 11 0 "[ . 1 . 2]" 1
873 1 95 LYS H 1 96 GLN HA 5.500 . 5.500 5.372 5.316 5.417 . 0 0 "[ . 1 . 2]" 1
874 1 96 GLN H 1 99 LEU HB3 4.570 . 4.570 4.566 4.459 4.623 0.053 18 0 "[ . 1 . 2]" 1
875 1 99 LEU HB2 1 100 LYS H 4.010 . 4.010 3.746 3.697 3.817 . 0 0 "[ . 1 . 2]" 1
876 1 27 HIS H 1 27 HIS HB3 4.130 . 4.130 3.222 2.504 3.607 . 0 0 "[ . 1 . 2]" 1
877 1 100 LYS HA 1 100 LYS HD3 3.660 . 3.660 3.486 3.372 3.609 . 0 0 "[ . 1 . 2]" 1
878 1 100 LYS QE 1 105 LYS H 5.480 . 5.480 5.399 5.115 5.509 0.029 18 0 "[ . 1 . 2]" 1
879 1 102 LEU H 1 103 GLU HG2 4.840 . 4.840 4.301 4.061 4.552 . 0 0 "[ . 1 . 2]" 1
880 1 105 LYS H 1 105 LYS QE 5.500 . 5.500 4.663 4.042 5.225 . 0 0 "[ . 1 . 2]" 1
881 1 105 LYS HA 1 110 LEU MD1 3.280 . 3.280 2.006 1.904 2.105 . 0 0 "[ . 1 . 2]" 1
882 1 111 TYR QD 1 113 CYS HA 4.140 . 4.140 3.801 3.510 4.063 . 0 0 "[ . 1 . 2]" 1
883 1 117 PHE QD 1 118 SER H 4.910 . 4.910 2.681 2.165 3.374 . 0 0 "[ . 1 . 2]" 1
884 1 29 VAL HB 1 30 TYR H 4.430 . 4.430 3.273 2.423 4.058 . 0 0 "[ . 1 . 2]" 1
885 1 29 VAL HB 1 98 LEU MD2 5.290 . 5.290 3.210 2.136 4.136 . 0 0 "[ . 1 . 2]" 1
886 1 31 GLN HE22 1 34 LYS QE 4.890 . 4.890 3.452 2.594 4.148 . 0 0 "[ . 1 . 2]" 1
887 1 31 GLN QB 1 33 LEU H 5.500 . 5.500 4.588 4.372 4.758 . 0 0 "[ . 1 . 2]" 1
888 1 32 LEU MD1 1 33 LEU HB2 3.600 . 3.600 3.260 2.920 3.426 . 0 0 "[ . 1 . 2]" 1
889 1 33 LEU HA 1 36 GLN HB2 3.670 . 3.670 3.109 2.821 3.426 . 0 0 "[ . 1 . 2]" 1
890 1 33 LEU HG 1 41 PHE QD 5.460 . 5.460 5.050 3.391 5.331 . 0 0 "[ . 1 . 2]" 1
891 1 36 GLN H 1 37 GLY H 3.160 . 3.160 2.523 2.269 2.656 . 0 0 "[ . 1 . 2]" 1
892 1 36 GLN HB2 1 36 GLN HE21 3.800 . 3.800 3.974 3.949 3.992 0.192 1 0 "[ . 1 . 2]" 1
893 1 36 GLN HB3 1 37 GLY H 4.510 . 4.510 4.196 3.888 4.442 . 0 0 "[ . 1 . 2]" 1
894 1 38 CYS H 1 41 PHE HZ 4.970 . 4.970 5.029 4.980 5.081 0.111 10 0 "[ . 1 . 2]" 1
895 1 38 CYS HA 1 115 CYS H 4.170 . 4.170 4.218 4.079 4.303 0.133 1 0 "[ . 1 . 2]" 1
896 1 39 GLU H 1 39 GLU HB2 4.070 . 4.070 3.692 3.168 3.853 . 0 0 "[ . 1 . 2]" 1
897 1 39 GLU H 1 115 CYS QB 3.810 . 3.810 2.853 2.547 2.951 . 0 0 "[ . 1 . 2]" 1
898 1 43 THR MG 1 73 PHE H 4.100 . 4.100 4.033 3.747 4.188 0.088 19 0 "[ . 1 . 2]" 1
899 1 44 LYS H 1 73 PHE H 3.990 . 3.990 3.985 3.739 4.078 0.088 10 0 "[ . 1 . 2]" 1
900 1 44 LYS HB2 1 46 VAL QG 4.200 . 4.200 3.771 2.182 4.317 0.117 16 0 "[ . 1 . 2]" 1
901 1 47 ILE MD 1 66 LYS HB3 4.980 . 4.980 4.714 4.165 5.044 0.064 9 0 "[ . 1 . 2]" 1
902 1 50 VAL H 1 50 VAL HB 3.710 . 3.710 2.552 2.463 2.765 . 0 0 "[ . 1 . 2]" 1
903 1 58 LEU H 1 58 LEU QB 3.290 . 3.290 3.050 2.378 3.351 0.061 17 0 "[ . 1 . 2]" 1
904 1 65 THR HA 1 67 TYR QE 5.050 . 5.050 4.936 4.632 5.095 0.045 18 0 "[ . 1 . 2]" 1
905 1 70 PHE HB3 1 94 MET ME 4.010 . 4.010 3.566 3.290 3.834 . 0 0 "[ . 1 . 2]" 1
906 1 70 PHE HZ 1 91 LYS HG2 5.500 . 5.500 4.048 3.257 5.506 0.006 15 0 "[ . 1 . 2]" 1
907 1 70 PHE QE 1 90 ALA MB 3.990 . 3.990 3.189 2.910 3.772 . 0 0 "[ . 1 . 2]" 1
908 1 72 PHE HB2 1 98 LEU MD2 4.600 . 4.600 2.609 2.311 2.906 . 0 0 "[ . 1 . 2]" 1
909 1 74 ARG HD2 1 75 HIS HD2 5.100 . 5.100 3.203 1.965 4.868 . 0 0 "[ . 1 . 2]" 1
910 1 75 HIS HA 1 77 ASN H 4.750 . 4.750 4.278 4.149 4.461 . 0 0 "[ . 1 . 2]" 1
911 1 75 HIS HD2 1 111 TYR QE 4.530 . 4.530 4.264 4.048 4.534 0.004 17 0 "[ . 1 . 2]" 1
912 1 77 ASN HA 1 78 ILE H 2.980 . 2.980 2.490 2.385 2.555 . 0 0 "[ . 1 . 2]" 1
913 1 78 ILE H 1 79 VAL H 4.500 . 4.500 4.215 4.107 4.361 . 0 0 "[ . 1 . 2]" 1
914 1 79 VAL MG1 1 98 LEU MD2 4.050 . 4.050 2.386 2.064 2.765 . 0 0 "[ . 1 . 2]" 1
915 1 25 ILE MD 1 28 LYS HG2 3.680 . 3.680 2.916 2.593 3.163 . 0 0 "[ . 1 . 2]" 1
916 1 80 ALA MB 1 93 ILE MG 4.690 . 4.690 4.754 4.697 4.799 0.109 15 0 "[ . 1 . 2]" 1
917 1 81 TYR H 1 97 ARG QB 4.050 . 4.050 3.497 3.320 3.778 . 0 0 "[ . 1 . 2]" 1
918 1 86 LYS HA 1 88 ALA H 4.370 . 4.370 4.087 3.823 4.337 . 0 0 "[ . 1 . 2]" 1
919 1 87 VAL MG2 1 91 LYS QE 4.360 . 4.360 2.416 1.791 3.676 0.009 14 0 "[ . 1 . 2]" 1
920 1 91 LYS H 1 91 LYS HB2 3.590 . 3.590 2.315 2.042 2.546 . 0 0 "[ . 1 . 2]" 1
921 1 93 ILE HA 1 93 ILE QG 3.700 . 3.700 2.432 2.407 2.470 . 0 0 "[ . 1 . 2]" 1
922 1 93 ILE HB 1 93 ILE MD 2.950 . 2.950 2.285 2.268 2.303 . 0 0 "[ . 1 . 2]" 1
923 1 93 ILE MG 1 94 MET H 3.580 . 3.580 3.181 3.101 3.329 . 0 0 "[ . 1 . 2]" 1
924 1 97 ARG HA 1 101 LEU H 5.290 . 5.290 4.807 4.598 4.968 . 0 0 "[ . 1 . 2]" 1
925 1 98 LEU HA 1 98 LEU MD1 3.890 . 3.890 3.718 3.660 3.797 . 0 0 "[ . 1 . 2]" 1
926 1 99 LEU MD2 1 103 GLU QB 4.900 . 4.900 4.118 3.880 4.428 . 0 0 "[ . 1 . 2]" 1
927 1 101 LEU H 1 101 LEU MD2 3.690 . 3.690 3.377 2.146 3.715 0.025 13 0 "[ . 1 . 2]" 1
928 1 101 LEU MD1 1 109 LEU HB3 4.800 . 4.800 3.339 2.500 4.512 . 0 0 "[ . 1 . 2]" 1
929 1 102 LEU H 1 103 GLU QB 4.580 . 4.580 4.397 4.306 4.519 . 0 0 "[ . 1 . 2]" 1
930 1 104 ASP H 1 110 LEU MD1 5.460 . 5.460 4.806 4.605 5.203 . 0 0 "[ . 1 . 2]" 1
931 1 106 SER H 1 108 LEU MD2 5.100 . 5.100 4.685 4.585 4.773 . 0 0 "[ . 1 . 2]" 1
932 1 107 ASN HA 1 109 LEU H 4.170 . 4.170 3.993 3.788 4.193 0.023 7 0 "[ . 1 . 2]" 1
933 1 107 ASN HB3 1 111 TYR HA 4.750 . 4.750 4.256 3.873 4.489 . 0 0 "[ . 1 . 2]" 1
934 1 108 LEU HA 1 111 TYR QD 4.030 . 4.030 3.359 3.013 3.488 . 0 0 "[ . 1 . 2]" 1
935 1 108 LEU HB2 1 108 LEU MD1 3.200 . 3.200 3.181 3.176 3.187 . 0 0 "[ . 1 . 2]" 1
936 1 108 LEU HB3 1 108 LEU MD2 3.200 . 3.200 3.170 3.162 3.176 . 0 0 "[ . 1 . 2]" 1
937 1 114 ASN HA 1 115 CYS HA 4.840 . 4.840 4.451 4.360 4.561 . 0 0 "[ . 1 . 2]" 1
938 1 116 LYS QE 1 116 LYS HG2 3.450 . 3.450 3.316 3.292 3.431 . 0 0 "[ . 1 . 2]" 1
939 1 116 LYS HG2 1 117 PHE QD 4.390 . 4.390 3.991 3.527 4.412 0.022 15 0 "[ . 1 . 2]" 1
940 1 119 LYS HA 1 119 LYS QG 3.650 . 3.650 2.886 2.533 3.332 . 0 0 "[ . 1 . 2]" 1
941 1 29 VAL H 1 31 GLN QB 5.220 . 5.220 4.871 4.530 5.036 . 0 0 "[ . 1 . 2]" 1
942 1 29 VAL H 1 29 VAL MG2 3.810 . 3.810 2.851 1.836 3.781 . 0 0 "[ . 1 . 2]" 1
943 1 29 VAL MG1 1 72 PHE QE 4.060 . 4.060 2.335 1.931 2.637 . 0 0 "[ . 1 . 2]" 1
944 1 121 LYS QD 1 121 LYS QG 2.470 . 2.470 2.070 2.004 2.090 . 0 0 "[ . 1 . 2]" 1
945 1 32 LEU HB2 1 110 LEU MD2 3.360 . 3.360 3.115 2.814 3.309 . 0 0 "[ . 1 . 2]" 1
946 1 33 LEU HB3 1 41 PHE HZ 4.760 . 4.760 3.380 2.750 3.510 . 0 0 "[ . 1 . 2]" 1
947 1 33 LEU MD1 1 74 ARG HE 4.430 . 4.430 3.620 2.276 4.358 . 0 0 "[ . 1 . 2]" 1
948 1 36 GLN HA 1 36 GLN HG2 3.530 . 3.530 2.630 2.500 2.705 . 0 0 "[ . 1 . 2]" 1
949 1 42 GLY H 1 72 PHE QE 4.080 . 4.080 3.421 3.199 3.753 . 0 0 "[ . 1 . 2]" 1
950 1 47 ILE MD 1 66 LYS HG2 3.970 . 3.970 3.380 3.155 3.638 . 0 0 "[ . 1 . 2]" 1
951 1 47 ILE HG12 1 47 ILE MG 3.480 . 3.480 2.378 2.305 2.414 . 0 0 "[ . 1 . 2]" 1
952 1 47 ILE MG 1 66 LYS HG3 3.460 . 3.460 2.123 1.999 2.313 . 0 0 "[ . 1 . 2]" 1
953 1 48 GLU H 1 49 GLU H 3.990 . 3.990 3.989 3.849 4.064 0.074 18 0 "[ . 1 . 2]" 1
954 1 49 GLU H 1 49 GLU HB2 3.630 . 3.630 3.604 3.320 3.658 0.028 12 0 "[ . 1 . 2]" 1
955 1 50 VAL MG1 1 67 TYR QD 4.430 . 4.430 4.459 4.237 4.571 0.141 5 0 "[ . 1 . 2]" 1
956 1 58 LEU QB 1 62 LEU H 4.870 . 4.870 4.795 4.301 4.974 0.104 5 0 "[ . 1 . 2]" 1
957 1 64 LEU HB2 1 64 LEU MD1 3.310 . 3.310 2.402 2.166 3.197 . 0 0 "[ . 1 . 2]" 1
958 1 64 LEU HB3 1 64 LEU MD2 3.310 . 3.310 2.373 2.227 3.198 . 0 0 "[ . 1 . 2]" 1
959 1 66 LYS H 1 66 LYS HB2 3.960 . 3.960 3.732 3.663 3.800 . 0 0 "[ . 1 . 2]" 1
960 1 69 GLY H 1 70 PHE H 4.400 . 4.400 3.859 3.736 3.973 . 0 0 "[ . 1 . 2]" 1
961 1 70 PHE HB2 1 94 MET ME 5.410 . 5.410 4.813 4.527 5.082 . 0 0 "[ . 1 . 2]" 1
962 1 71 SER HB2 1 78 ILE MD 4.180 . 4.180 2.863 1.808 3.555 . 0 0 "[ . 1 . 2]" 1
963 1 72 PHE HB2 1 80 ALA MB 3.520 . 3.520 2.204 2.022 2.326 . 0 0 "[ . 1 . 2]" 1
964 1 74 ARG HA 1 74 ARG HD3 5.250 . 5.250 3.510 2.874 4.686 . 0 0 "[ . 1 . 2]" 1
965 1 78 ILE HA 1 78 ILE MD 4.010 . 4.010 1.951 1.866 2.075 . 0 0 "[ . 1 . 2]" 1
966 1 78 ILE HA 1 79 VAL H 3.550 . 3.550 2.091 2.072 2.132 . 0 0 "[ . 1 . 2]" 1
967 1 78 ILE HB 1 78 ILE MD 3.210 . 3.210 3.226 3.219 3.234 0.024 4 0 "[ . 1 . 2]" 1
968 1 79 VAL MG1 1 111 TYR QE 5.500 . 5.500 5.306 4.790 5.563 0.063 1 0 "[ . 1 . 2]" 1
969 1 25 ILE HG12 1 99 LEU HA 4.470 . 4.470 3.422 2.971 3.890 . 0 0 "[ . 1 . 2]" 1
970 1 25 ILE MD 1 28 LYS HA 5.050 . 5.050 4.744 4.587 4.927 . 0 0 "[ . 1 . 2]" 1
971 1 25 ILE HG12 1 25 ILE MG 3.360 . 3.360 2.964 2.369 3.212 . 0 0 "[ . 1 . 2]" 1
972 1 83 LYS HA 1 90 ALA MB 3.770 . 3.770 3.017 2.483 3.356 . 0 0 "[ . 1 . 2]" 1
973 1 86 LYS HA 1 90 ALA H 5.500 . 5.500 5.147 4.908 5.423 . 0 0 "[ . 1 . 2]" 1
974 1 87 VAL MG1 1 88 ALA HA 4.300 . 4.300 3.328 3.194 3.484 . 0 0 "[ . 1 . 2]" 1
975 1 88 ALA H 1 91 LYS QD 5.440 . 5.440 5.399 4.511 5.636 0.196 15 0 "[ . 1 . 2]" 1
976 1 88 ALA HA 1 91 LYS QD 4.070 . 4.070 3.749 2.060 4.151 0.081 12 0 "[ . 1 . 2]" 1
977 1 26 GLU HA 1 29 VAL MG1 4.540 . 4.540 3.072 1.800 4.553 0.013 12 0 "[ . 1 . 2]" 1
978 1 92 TYR QB 1 93 ILE MD 4.210 . 4.210 4.245 4.101 4.286 0.076 8 0 "[ . 1 . 2]" 1
979 1 92 TYR QE 1 96 GLN HG3 3.860 . 3.860 3.215 2.864 3.475 . 0 0 "[ . 1 . 2]" 1
980 1 93 ILE HA 1 96 GLN HB3 4.790 . 4.790 4.713 4.341 4.868 0.078 5 0 "[ . 1 . 2]" 1
981 1 93 ILE MG 1 97 ARG H 4.680 . 4.680 4.538 4.305 4.677 . 0 0 "[ . 1 . 2]" 1
982 1 95 LYS HA 1 98 LEU MD1 4.850 . 4.850 2.313 2.098 2.474 . 0 0 "[ . 1 . 2]" 1
983 1 98 LEU HA 1 101 LEU HG 4.590 . 4.590 3.417 2.442 4.671 0.081 13 0 "[ . 1 . 2]" 1
984 1 99 LEU MD2 1 100 LYS H 4.180 . 4.180 4.049 3.254 4.222 0.042 14 0 "[ . 1 . 2]" 1
985 1 27 HIS HA 1 30 TYR HB2 4.290 . 4.290 3.008 2.678 3.430 . 0 0 "[ . 1 . 2]" 1
986 1 27 HIS HA 1 30 TYR QD 4.000 . 4.000 3.267 2.633 4.111 0.111 8 0 "[ . 1 . 2]" 1
987 1 100 LYS H 1 103 GLU HG2 5.500 . 5.500 5.149 4.591 5.373 . 0 0 "[ . 1 . 2]" 1
988 1 100 LYS HA 1 103 GLU HG3 3.710 . 3.710 3.406 2.987 3.739 0.029 13 0 "[ . 1 . 2]" 1
989 1 101 LEU H 1 101 LEU MD1 3.690 . 3.690 3.223 2.428 3.704 0.014 1 0 "[ . 1 . 2]" 1
990 1 104 ASP H 1 105 LYS HG2 4.420 . 4.420 4.510 4.453 4.556 0.136 7 0 "[ . 1 . 2]" 1
991 1 105 LYS H 1 105 LYS HG3 4.520 . 4.520 4.430 4.372 4.490 . 0 0 "[ . 1 . 2]" 1
992 1 106 SER H 1 109 LEU H 5.260 . 5.260 5.160 4.909 5.306 0.046 1 0 "[ . 1 . 2]" 1
993 1 108 LEU HB2 1 109 LEU H 4.080 . 4.080 2.728 2.613 2.840 . 0 0 "[ . 1 . 2]" 1
994 1 110 LEU HB3 1 110 LEU MD1 2.950 . 2.950 2.492 2.451 2.535 . 0 0 "[ . 1 . 2]" 1
995 1 111 TYR QE 1 113 CYS HA 4.120 . 4.120 3.838 3.352 4.170 0.050 12 0 "[ . 1 . 2]" 1
996 1 112 SER H 1 112 SER HB3 4.130 . 4.130 3.302 2.493 3.644 . 0 0 "[ . 1 . 2]" 1
997 1 113 CYS H 1 115 CYS H 5.380 . 5.380 4.650 4.349 4.988 . 0 0 "[ . 1 . 2]" 1
998 1 117 PHE QE 1 118 SER HA 5.020 . 5.020 3.805 3.373 5.272 0.252 1 0 "[ . 1 . 2]" 1
999 1 31 GLN HA 1 31 GLN HG2 3.360 . 3.360 2.963 2.616 3.232 . 0 0 "[ . 1 . 2]" 1
1000 1 32 LEU H 1 32 LEU HB3 3.690 . 3.690 3.271 3.185 3.371 . 0 0 "[ . 1 . 2]" 1
1001 1 32 LEU HB3 1 32 LEU MD2 2.740 . 2.740 2.203 2.190 2.223 . 0 0 "[ . 1 . 2]" 1
1002 1 33 LEU MD2 1 74 ARG HE 4.430 . 4.430 3.847 2.456 4.584 0.154 15 0 "[ . 1 . 2]" 1
1003 1 34 LYS HG3 1 41 PHE HZ 5.220 . 5.220 5.147 4.624 5.368 0.148 16 0 "[ . 1 . 2]" 1
1004 1 36 GLN HE21 1 110 LEU HA 3.990 . 3.990 3.331 2.851 3.750 . 0 0 "[ . 1 . 2]" 1
1005 1 36 GLN HG3 1 38 CYS H 4.940 . 4.940 4.816 4.552 4.964 0.024 5 0 "[ . 1 . 2]" 1
1006 1 38 CYS H 1 115 CYS QB 4.630 . 4.630 4.404 4.333 4.470 . 0 0 "[ . 1 . 2]" 1
1007 1 40 ASP HA 1 41 PHE H 3.330 . 3.330 2.277 2.213 2.316 . 0 0 "[ . 1 . 2]" 1
1008 1 43 THR HA 1 43 THR MG 3.140 . 3.140 2.256 2.166 2.312 . 0 0 "[ . 1 . 2]" 1
1009 1 46 VAL H 1 46 VAL HB 3.780 . 3.780 2.936 2.551 3.289 . 0 0 "[ . 1 . 2]" 1
1010 1 46 VAL QG 1 69 GLY H 3.890 . 3.890 3.566 2.942 4.015 0.125 13 0 "[ . 1 . 2]" 1
1011 1 47 ILE HA 1 68 TYR QD 4.450 . 4.450 3.729 3.234 4.221 . 0 0 "[ . 1 . 2]" 1
1012 1 47 ILE MG 1 66 LYS HG2 3.220 . 3.220 2.195 2.057 2.343 . 0 0 "[ . 1 . 2]" 1
1013 1 48 GLU HA 1 48 GLU HG3 4.230 . 4.230 3.163 3.055 3.250 . 0 0 "[ . 1 . 2]" 1
1014 1 66 LYS QD 1 68 TYR QE 4.520 . 4.520 4.094 3.830 4.554 0.034 15 0 "[ . 1 . 2]" 1
1015 1 68 TYR QD 1 87 VAL H 4.290 . 4.290 3.996 3.283 4.321 0.031 11 0 "[ . 1 . 2]" 1
1016 1 70 PHE HZ 1 87 VAL HA 5.150 . 5.150 4.697 4.396 5.102 . 0 0 "[ . 1 . 2]" 1
1017 1 70 PHE QD 1 90 ALA HA 5.390 . 5.390 4.443 4.218 5.022 . 0 0 "[ . 1 . 2]" 1
1018 1 70 PHE QE 1 87 VAL MG1 4.390 . 4.390 4.213 4.047 4.302 . 0 0 "[ . 1 . 2]" 1
1019 1 71 SER HA 1 80 ALA MB 4.600 . 4.600 3.579 3.396 3.977 . 0 0 "[ . 1 . 2]" 1
1020 1 72 PHE H 1 81 TYR H 4.650 . 4.650 4.633 4.492 4.690 0.040 19 0 "[ . 1 . 2]" 1
1021 1 72 PHE HB3 1 79 VAL HB 4.440 . 4.440 2.794 2.497 2.993 . 0 0 "[ . 1 . 2]" 1
1022 1 72 PHE QD 1 79 VAL MG2 3.250 . 3.250 3.040 2.535 3.282 0.032 2 0 "[ . 1 . 2]" 1
1023 1 73 PHE HA 1 78 ILE HG12 5.500 . 5.500 4.521 4.300 4.698 . 0 0 "[ . 1 . 2]" 1
1024 1 74 ARG HB2 1 74 ARG HE 5.220 . 5.220 4.633 3.871 4.863 . 0 0 "[ . 1 . 2]" 1
1025 1 75 HIS HE1 1 113 CYS HA 4.910 . 4.910 4.988 4.925 5.034 0.124 20 0 "[ . 1 . 2]" 1
1026 1 78 ILE MG 1 81 TYR HB2 3.470 . 3.470 2.212 1.889 2.417 . 0 0 "[ . 1 . 2]" 1
1027 1 81 TYR QE 1 83 LYS QD 3.980 . 3.980 3.577 2.363 4.038 0.058 13 0 "[ . 1 . 2]" 1
1028 1 82 GLY HA2 1 93 ILE MG 3.310 . 3.310 2.322 2.156 2.492 . 0 0 "[ . 1 . 2]" 1
1029 1 86 LYS H 1 89 ASN HB3 4.360 . 4.360 3.362 3.002 3.592 . 0 0 "[ . 1 . 2]" 1
1030 1 86 LYS HA 1 89 ASN H 5.090 . 5.090 4.511 4.193 5.073 . 0 0 "[ . 1 . 2]" 1
1031 1 87 VAL HB 1 88 ALA MB 5.370 . 5.370 5.324 5.164 5.432 0.062 18 0 "[ . 1 . 2]" 1
1032 1 89 ASN HA 1 91 LYS H 5.210 . 5.210 4.534 4.371 4.708 . 0 0 "[ . 1 . 2]" 1
1033 1 89 ASN HA 1 93 ILE H 4.600 . 4.600 4.222 4.059 4.380 . 0 0 "[ . 1 . 2]" 1
1034 1 91 LYS H 1 91 LYS HB3 3.590 . 3.590 3.273 2.599 3.605 0.015 19 0 "[ . 1 . 2]" 1
1035 1 93 ILE MG 1 97 ARG HD3 4.590 . 4.590 3.948 3.122 4.643 0.053 12 0 "[ . 1 . 2]" 1
1036 1 94 MET H 1 95 LYS H 3.770 . 3.770 2.723 2.664 2.894 . 0 0 "[ . 1 . 2]" 1
1037 1 97 ARG HA 1 97 ARG HD3 4.000 . 4.000 2.995 1.797 3.722 0.003 17 0 "[ . 1 . 2]" 1
1038 1 97 ARG HA 1 97 ARG HG2 3.840 . 3.840 2.980 2.801 3.222 . 0 0 "[ . 1 . 2]" 1
1039 1 98 LEU H 1 100 LYS H 4.960 . 4.960 4.488 4.360 4.693 . 0 0 "[ . 1 . 2]" 1
1040 1 100 LYS H 1 102 LEU H 4.540 . 4.540 4.311 4.219 4.414 . 0 0 "[ . 1 . 2]" 1
1041 1 100 LYS HB3 1 101 LEU H 3.990 . 3.990 3.395 3.052 3.496 . 0 0 "[ . 1 . 2]" 1
1042 1 101 LEU HA 1 101 LEU MD1 4.050 . 4.050 3.097 1.863 3.840 . 0 0 "[ . 1 . 2]" 1
1043 1 103 GLU HA 1 103 GLU HG2 3.110 . 3.110 2.876 2.640 3.026 . 0 0 "[ . 1 . 2]" 1
1044 1 104 ASP HB2 1 106 SER H 4.700 . 4.700 4.687 4.372 4.777 0.077 8 0 "[ . 1 . 2]" 1
1045 1 106 SER HA 1 108 LEU H 4.930 . 4.930 3.849 3.692 3.999 . 0 0 "[ . 1 . 2]" 1
1046 1 109 LEU HA 1 109 LEU MD1 3.910 . 3.910 2.292 2.176 2.498 . 0 0 "[ . 1 . 2]" 1
1047 1 28 LYS H 1 28 LYS QD 3.930 . 3.930 2.623 2.323 2.764 . 0 0 "[ . 1 . 2]" 1
1048 1 28 LYS HA 1 31 GLN HG2 4.500 . 4.500 3.048 2.486 3.571 . 0 0 "[ . 1 . 2]" 1
1049 1 28 LYS HA 1 28 LYS QD 3.520 . 3.520 2.275 2.102 2.451 . 0 0 "[ . 1 . 2]" 1
1050 1 28 LYS HB3 1 29 VAL H 3.900 . 3.900 3.679 3.565 3.768 . 0 0 "[ . 1 . 2]" 1
1051 1 110 LEU HB3 1 110 LEU MD2 3.520 . 3.520 2.274 2.235 2.307 . 0 0 "[ . 1 . 2]" 1
1052 1 114 ASN QB 1 115 CYS H 4.090 . 4.090 4.067 3.885 4.106 0.016 5 0 "[ . 1 . 2]" 1
1053 1 118 SER H 1 118 SER QB 3.550 . 3.550 3.189 2.450 3.411 . 0 0 "[ . 1 . 2]" 1
1054 1 118 SER QB 1 119 LYS H 4.440 . 4.440 2.141 1.749 2.782 0.051 14 0 "[ . 1 . 2]" 1
1055 1 29 VAL H 1 98 LEU MD1 5.100 . 5.100 5.106 4.949 5.157 0.057 1 0 "[ . 1 . 2]" 1
1056 1 30 TYR HB3 1 41 PHE HZ 4.620 . 4.620 4.221 3.954 4.487 . 0 0 "[ . 1 . 2]" 1
1057 1 31 GLN H 1 31 GLN HG3 4.080 . 4.080 3.817 3.717 3.989 . 0 0 "[ . 1 . 2]" 1
1058 1 31 GLN H 1 33 LEU H 4.890 . 4.890 4.287 4.130 4.457 . 0 0 "[ . 1 . 2]" 1
1059 1 32 LEU HA 1 35 ASP HB2 3.640 . 3.640 3.058 2.467 3.385 . 0 0 "[ . 1 . 2]" 1
1060 1 33 LEU HA 1 33 LEU MD1 3.820 . 3.820 3.623 1.916 3.743 . 0 0 "[ . 1 . 2]" 1
1061 1 33 LEU HA 1 36 GLN HG2 4.260 . 4.260 3.850 3.636 4.070 . 0 0 "[ . 1 . 2]" 1
1062 1 36 GLN HG2 1 37 GLY H 4.680 . 4.680 4.520 4.307 4.716 0.036 14 0 "[ . 1 . 2]" 1
1063 1 40 ASP HB3 1 75 HIS HE1 5.220 . 5.220 4.515 4.140 4.714 . 0 0 "[ . 1 . 2]" 1
1064 1 41 PHE HB3 1 74 ARG HA 4.950 . 4.950 2.628 2.368 2.827 . 0 0 "[ . 1 . 2]" 1
1065 1 43 THR MG 1 72 PHE H 5.480 . 5.480 4.553 4.100 5.111 . 0 0 "[ . 1 . 2]" 1
1066 1 44 LYS HB3 1 44 LYS QD 3.470 . 3.470 2.908 2.474 3.278 . 0 0 "[ . 1 . 2]" 1
1067 1 44 LYS HB3 1 44 LYS QE 4.570 . 4.570 4.067 2.916 4.512 . 0 0 "[ . 1 . 2]" 1
1068 1 47 ILE HA 1 69 GLY H 3.950 . 3.950 2.571 2.421 2.649 . 0 0 "[ . 1 . 2]" 1
1069 1 47 ILE MD 1 47 ILE MG 2.590 . 2.590 1.942 1.900 1.982 . 0 0 "[ . 1 . 2]" 1
1070 1 47 ILE MG 1 66 LYS HB2 3.500 . 3.500 2.400 2.106 2.703 . 0 0 "[ . 1 . 2]" 1
1071 1 48 GLU H 1 48 GLU HG2 4.090 . 4.090 3.878 3.631 4.082 . 0 0 "[ . 1 . 2]" 1
1072 1 48 GLU H 1 66 LYS HB2 5.500 . 5.500 4.694 4.365 5.017 . 0 0 "[ . 1 . 2]" 1
1073 1 48 GLU H 1 83 LYS QD 5.500 . 5.500 4.594 3.895 5.577 0.077 2 0 "[ . 1 . 2]" 1
1074 1 48 GLU HG2 1 49 GLU H 4.550 . 4.550 4.493 4.243 4.632 0.082 5 0 "[ . 1 . 2]" 1
1075 1 61 GLU HA 1 62 LEU H 3.170 . 3.170 2.418 2.074 3.105 . 0 0 "[ . 1 . 2]" 1
1076 1 65 THR H 1 66 LYS H 4.620 . 4.620 4.284 4.143 4.395 . 0 0 "[ . 1 . 2]" 1
1077 1 65 THR HA 1 66 LYS H 2.930 . 2.930 2.147 2.118 2.177 . 0 0 "[ . 1 . 2]" 1
1078 1 65 THR MG 1 66 LYS H 3.370 . 3.370 3.217 3.047 3.394 0.024 14 0 "[ . 1 . 2]" 1
1079 1 65 THR MG 1 67 TYR QE 3.300 . 3.300 2.178 1.804 2.479 . 0 0 "[ . 1 . 2]" 1
1080 1 66 LYS HA 1 67 TYR H 3.400 . 3.400 2.308 2.265 2.347 . 0 0 "[ . 1 . 2]" 1
1081 1 66 LYS HB2 1 66 LYS QE 4.260 . 4.260 4.210 4.178 4.301 0.041 5 0 "[ . 1 . 2]" 1
1082 1 68 TYR QD 1 90 ALA MB 4.670 . 4.670 3.771 3.422 4.255 . 0 0 "[ . 1 . 2]" 1
1083 1 70 PHE H 1 82 GLY H 4.200 . 4.200 3.878 3.681 4.202 0.002 4 0 "[ . 1 . 2]" 1
1084 1 70 PHE HB2 1 71 SER H 4.440 . 4.440 4.357 4.247 4.513 0.073 10 0 "[ . 1 . 2]" 1
1085 1 70 PHE HB2 1 90 ALA MB 4.080 . 4.080 2.162 1.900 2.473 . 0 0 "[ . 1 . 2]" 1
1086 1 72 PHE H 1 72 PHE QD 4.400 . 4.400 4.291 4.201 4.325 . 0 0 "[ . 1 . 2]" 1
1087 1 72 PHE H 1 78 ILE MG 3.920 . 3.920 3.282 3.001 3.393 . 0 0 "[ . 1 . 2]" 1
1088 1 72 PHE H 1 79 VAL H 4.330 . 4.330 4.078 3.828 4.292 . 0 0 "[ . 1 . 2]" 1
1089 1 72 PHE QD 1 80 ALA MB 4.320 . 4.320 3.759 3.608 3.869 . 0 0 "[ . 1 . 2]" 1
1090 1 72 PHE QD 1 98 LEU MD1 3.710 . 3.710 3.414 3.125 3.723 0.013 2 0 "[ . 1 . 2]" 1
1091 1 73 PHE H 1 78 ILE HA 5.200 . 5.200 5.181 5.097 5.238 0.038 8 0 "[ . 1 . 2]" 1
1092 1 74 ARG HA 1 74 ARG HD2 5.250 . 5.250 3.496 2.251 4.548 . 0 0 "[ . 1 . 2]" 1
1093 1 74 ARG HB3 1 74 ARG HE 5.220 . 5.220 4.599 2.458 5.089 . 0 0 "[ . 1 . 2]" 1
1094 1 77 ASN HA 1 78 ILE MG 5.500 . 5.500 5.499 5.473 5.511 0.011 5 0 "[ . 1 . 2]" 1
1095 1 78 ILE HG12 1 79 VAL H 4.760 . 4.760 4.861 4.821 4.901 0.141 18 0 "[ . 1 . 2]" 1
1096 1 78 ILE MD 1 79 VAL H 3.860 . 3.860 3.448 3.347 3.543 . 0 0 "[ . 1 . 2]" 1
1097 1 78 ILE MD 1 81 TYR HB2 4.000 . 4.000 3.832 3.376 4.043 0.043 4 0 "[ . 1 . 2]" 1
1098 1 79 VAL MG2 1 109 LEU HA 4.220 . 4.220 2.678 2.480 2.890 . 0 0 "[ . 1 . 2]" 1
1099 1 79 VAL MG2 1 111 TYR QE 4.590 . 4.590 3.600 3.408 3.943 . 0 0 "[ . 1 . 2]" 1
1100 1 25 ILE HA 1 25 ILE MD 3.060 . 3.060 2.083 1.789 2.326 0.011 15 0 "[ . 1 . 2]" 1
1101 1 25 ILE MD 1 99 LEU H 3.470 . 3.470 2.740 2.576 2.967 . 0 0 "[ . 1 . 2]" 1
1102 1 25 ILE MG 1 26 GLU H 4.100 . 4.100 2.412 2.197 2.622 . 0 0 "[ . 1 . 2]" 1
1103 1 81 TYR QD 1 83 LYS QB 4.280 . 4.280 3.748 2.940 4.317 0.037 11 0 "[ . 1 . 2]" 1
1104 1 82 GLY HA3 1 93 ILE MD 4.320 . 4.320 3.083 2.874 3.378 . 0 0 "[ . 1 . 2]" 1
1105 1 87 VAL MG1 1 91 LYS QD 4.590 . 4.590 4.336 3.695 4.662 0.072 9 0 "[ . 1 . 2]" 1
1106 1 89 ASN H 1 90 ALA MB 5.330 . 5.330 4.140 3.970 4.247 . 0 0 "[ . 1 . 2]" 1
1107 1 89 ASN HB2 1 93 ILE MD 4.920 . 4.920 4.980 4.844 5.064 0.144 7 0 "[ . 1 . 2]" 1
1108 1 91 LYS HB2 1 92 TYR H 4.050 . 4.050 2.885 2.400 3.631 . 0 0 "[ . 1 . 2]" 1
1109 1 92 TYR H 1 92 TYR QD 4.170 . 4.170 4.107 4.023 4.138 . 0 0 "[ . 1 . 2]" 1
1110 1 92 TYR HA 1 95 LYS HB2 4.300 . 4.300 2.715 2.411 2.854 . 0 0 "[ . 1 . 2]" 1
1111 1 93 ILE HA 1 93 ILE MG 3.050 . 3.050 2.402 2.358 2.433 . 0 0 "[ . 1 . 2]" 1
1112 1 95 LYS HA 1 95 LYS QD 4.200 . 4.200 3.953 2.542 4.047 . 0 0 "[ . 1 . 2]" 1
1113 1 95 LYS HA 1 98 LEU MD2 4.850 . 4.850 4.776 4.354 4.961 0.111 5 0 "[ . 1 . 2]" 1
1114 1 98 LEU HA 1 109 LEU MD1 4.740 . 4.740 4.085 3.611 4.488 . 0 0 "[ . 1 . 2]" 1
1115 1 99 LEU H 1 100 LYS HB2 5.050 . 5.050 4.766 4.694 4.861 . 0 0 "[ . 1 . 2]" 1
1116 1 99 LEU H 1 101 LEU H 4.320 . 4.320 3.938 3.851 4.141 . 0 0 "[ . 1 . 2]" 1
1117 1 99 LEU MD1 1 103 GLU HG2 4.380 . 4.380 2.899 2.424 3.295 . 0 0 "[ . 1 . 2]" 1
1118 1 27 HIS HA 1 31 GLN H 4.470 . 4.470 4.183 3.876 4.424 . 0 0 "[ . 1 . 2]" 1
1119 1 27 HIS HB2 1 28 LYS H 4.450 . 4.450 3.083 2.498 3.831 . 0 0 "[ . 1 . 2]" 1
1120 1 100 LYS HA 1 100 LYS HD2 3.660 . 3.660 1.932 1.794 2.152 0.006 14 0 "[ . 1 . 2]" 1
1121 1 100 LYS HD3 1 100 LYS QG 2.700 . 2.700 2.178 2.172 2.182 . 0 0 "[ . 1 . 2]" 1
1122 1 100 LYS QE 1 100 LYS QG 3.330 . 3.330 2.470 2.346 2.794 . 0 0 "[ . 1 . 2]" 1
1123 1 106 SER H 1 108 LEU H 4.840 . 4.840 4.855 4.716 4.936 0.096 9 0 "[ . 1 . 2]" 1
1124 1 106 SER H 1 110 LEU MD1 3.640 . 3.640 2.719 2.363 3.085 . 0 0 "[ . 1 . 2]" 1
1125 1 109 LEU H 1 110 LEU HG 3.690 . 3.690 3.087 2.962 3.207 . 0 0 "[ . 1 . 2]" 1
1126 1 109 LEU HB3 1 110 LEU MD1 4.360 . 4.360 3.881 3.723 3.996 . 0 0 "[ . 1 . 2]" 1
1127 1 109 LEU HB2 1 110 LEU H 4.310 . 4.310 4.271 4.177 4.339 0.029 3 0 "[ . 1 . 2]" 1
1128 1 28 LYS H 1 102 LEU MD2 4.980 . 4.980 4.643 4.497 4.768 . 0 0 "[ . 1 . 2]" 1
1129 1 111 TYR QD 1 113 CYS H 4.030 . 4.030 4.174 4.106 4.254 0.224 1 0 "[ . 1 . 2]" 1
1130 1 119 LYS H 1 119 LYS QD 3.820 . 3.820 3.364 2.323 3.932 0.112 8 0 "[ . 1 . 2]" 1
1131 1 29 VAL H 1 31 GLN H 4.470 . 4.470 4.078 3.916 4.268 . 0 0 "[ . 1 . 2]" 1
1132 1 29 VAL H 1 29 VAL MG1 3.810 . 3.810 2.905 1.915 3.777 . 0 0 "[ . 1 . 2]" 1
1133 1 29 VAL HB 1 31 GLN H 5.500 . 5.500 5.298 4.845 5.669 0.169 17 0 "[ . 1 . 2]" 1
1134 1 30 TYR H 1 30 TYR HB2 3.710 . 3.710 2.533 2.292 2.639 . 0 0 "[ . 1 . 2]" 1
1135 1 30 TYR HA 1 30 TYR QD 3.540 . 3.540 2.237 2.053 3.126 . 0 0 "[ . 1 . 2]" 1
1136 1 31 GLN H 1 31 GLN HG2 3.620 . 3.620 2.490 2.297 2.811 . 0 0 "[ . 1 . 2]" 1
1137 1 31 GLN H 1 32 LEU H 3.530 . 3.530 2.874 2.765 2.970 . 0 0 "[ . 1 . 2]" 1
1138 1 31 GLN HA 1 31 GLN HG3 3.700 . 3.700 3.653 3.572 3.705 0.005 19 0 "[ . 1 . 2]" 1
1139 1 32 LEU H 1 32 LEU HB2 3.460 . 3.460 3.480 3.460 3.502 0.042 5 0 "[ . 1 . 2]" 1
1140 1 32 LEU HA 1 32 LEU HG 3.790 . 3.790 3.477 3.451 3.506 . 0 0 "[ . 1 . 2]" 1
1141 1 32 LEU HB3 1 33 LEU H 4.080 . 4.080 4.191 4.153 4.245 0.165 4 0 "[ . 1 . 2]" 1
1142 1 32 LEU HB2 1 32 LEU MD2 2.930 . 2.930 2.545 2.509 2.585 . 0 0 "[ . 1 . 2]" 1
1143 1 32 LEU HB2 1 32 LEU MD1 2.820 . 2.820 2.256 2.224 2.280 . 0 0 "[ . 1 . 2]" 1
1144 1 33 LEU HA 1 36 GLN HG3 3.380 . 3.380 2.177 1.977 2.448 . 0 0 "[ . 1 . 2]" 1
1145 1 33 LEU MD2 1 41 PHE QD 4.430 . 4.430 4.259 2.202 4.498 0.068 8 0 "[ . 1 . 2]" 1
1146 1 34 LYS QB 1 41 PHE QE 4.540 . 4.540 3.689 3.490 3.830 . 0 0 "[ . 1 . 2]" 1
1147 1 36 GLN HG3 1 110 LEU MD2 4.620 . 4.620 4.591 4.369 4.690 0.070 2 0 "[ . 1 . 2]" 1
1148 1 37 GLY HA3 1 38 CYS H 3.600 . 3.600 3.516 3.478 3.549 . 0 0 "[ . 1 . 2]" 1
1149 1 39 GLU H 1 39 GLU HB3 4.070 . 4.070 2.936 2.569 3.209 . 0 0 "[ . 1 . 2]" 1
1150 1 40 ASP H 1 40 ASP HB3 3.520 . 3.520 2.603 2.432 3.094 . 0 0 "[ . 1 . 2]" 1
1151 1 41 PHE HB3 1 42 GLY H 4.340 . 4.340 3.663 3.502 3.827 . 0 0 "[ . 1 . 2]" 1
1152 1 41 PHE QD 1 74 ARG HA 4.540 . 4.540 4.378 4.144 4.564 0.024 4 0 "[ . 1 . 2]" 1
1153 1 43 THR MG 1 44 LYS H 3.660 . 3.660 3.588 3.248 3.715 0.055 14 0 "[ . 1 . 2]" 1
1154 1 43 THR MG 1 70 PHE QE 5.500 . 5.500 4.697 4.206 5.140 . 0 0 "[ . 1 . 2]" 1
1155 1 45 CYS HA 1 71 SER H 4.150 . 4.150 3.738 3.392 4.177 0.027 9 0 "[ . 1 . 2]" 1
1156 1 47 ILE H 1 47 ILE HG13 4.700 . 4.700 2.524 2.360 2.981 . 0 0 "[ . 1 . 2]" 1
1157 1 47 ILE HA 1 47 ILE MD 4.010 . 4.010 3.773 3.753 3.804 . 0 0 "[ . 1 . 2]" 1
1158 1 50 VAL HB 1 67 TYR QD 4.380 . 4.380 3.517 3.097 4.118 . 0 0 "[ . 1 . 2]" 1
1159 1 61 GLU H 1 61 GLU HG3 4.270 . 4.270 3.337 2.029 4.597 0.327 17 0 "[ . 1 . 2]" 1
1160 1 61 GLU HA 1 61 GLU HG3 4.010 . 4.010 3.266 2.316 4.199 0.189 9 0 "[ . 1 . 2]" 1
1161 1 64 LEU HA 1 64 LEU MD1 3.960 . 3.960 3.009 1.862 4.080 0.120 18 0 "[ . 1 . 2]" 1
1162 1 65 THR HA 1 65 THR MG 3.060 . 3.060 2.286 2.218 2.332 . 0 0 "[ . 1 . 2]" 1
1163 1 66 LYS QE 1 68 TYR QE 3.680 . 3.680 2.040 1.767 2.678 0.033 8 0 "[ . 1 . 2]" 1
1164 1 67 TYR HA 1 68 TYR H 3.350 . 3.350 2.207 2.125 2.293 . 0 0 "[ . 1 . 2]" 1
1165 1 67 TYR HB3 1 68 TYR H 4.180 . 4.180 2.918 2.744 3.217 . 0 0 "[ . 1 . 2]" 1
1166 1 67 TYR QD 1 83 LYS QD 3.930 . 3.930 3.711 3.076 3.979 0.049 16 0 "[ . 1 . 2]" 1
1167 1 68 TYR QD 1 70 PHE QE 4.910 . 4.910 2.179 1.771 3.154 0.029 11 0 "[ . 1 . 2]" 1
1168 1 68 TYR QE 1 70 PHE HZ 5.420 . 5.420 5.018 4.335 5.482 0.062 10 0 "[ . 1 . 2]" 1
1169 1 68 TYR QE 1 87 VAL HA 4.500 . 4.500 3.997 3.380 4.488 . 0 0 "[ . 1 . 2]" 1
1170 1 69 GLY HA2 1 81 TYR QE 4.240 . 4.240 3.826 2.596 4.303 0.063 7 0 "[ . 1 . 2]" 1
1171 1 70 PHE HA 1 70 PHE QD 4.300 . 4.300 2.860 2.679 3.000 . 0 0 "[ . 1 . 2]" 1
1172 1 70 PHE HA 1 71 SER H 3.340 . 3.340 2.167 2.118 2.216 . 0 0 "[ . 1 . 2]" 1
1173 1 70 PHE HZ 1 90 ALA MB 5.500 . 5.500 4.972 4.747 5.265 . 0 0 "[ . 1 . 2]" 1
1174 1 70 PHE QE 1 87 VAL HB 4.540 . 4.540 3.452 3.041 3.838 . 0 0 "[ . 1 . 2]" 1
1175 1 71 SER HA 1 81 TYR HB2 4.660 . 4.660 4.166 3.829 4.529 . 0 0 "[ . 1 . 2]" 1
1176 1 71 SER HA 1 94 MET HB2 5.180 . 5.180 3.420 3.110 3.767 . 0 0 "[ . 1 . 2]" 1
1177 1 71 SER HB2 1 81 TYR HA 5.100 . 5.100 4.104 2.790 4.822 . 0 0 "[ . 1 . 2]" 1
1178 1 72 PHE HB3 1 80 ALA MB 3.530 . 3.530 2.169 1.919 2.317 . 0 0 "[ . 1 . 2]" 1
1179 1 72 PHE QE 1 79 VAL MG2 4.080 . 4.080 3.729 2.716 4.070 . 0 0 "[ . 1 . 2]" 1
1180 1 73 PHE HA 1 79 VAL MG2 4.480 . 4.480 4.237 3.887 4.503 0.023 4 0 "[ . 1 . 2]" 1
1181 1 73 PHE QD 1 74 ARG HA 5.170 . 5.170 4.997 4.572 5.225 0.055 14 0 "[ . 1 . 2]" 1
1182 1 75 HIS HB3 1 77 ASN H 4.450 . 4.450 4.013 3.806 4.169 . 0 0 "[ . 1 . 2]" 1
1183 1 75 HIS HE1 1 115 CYS H 4.930 . 4.930 4.786 4.289 4.943 0.013 10 0 "[ . 1 . 2]" 1
1184 1 77 ASN HB3 1 78 ILE H 3.480 . 3.480 2.218 2.147 2.344 . 0 0 "[ . 1 . 2]" 1
1185 1 79 VAL HA 1 80 ALA MB 4.900 . 4.900 4.719 4.639 4.828 . 0 0 "[ . 1 . 2]" 1
1186 1 79 VAL MG1 1 98 LEU MD1 4.050 . 4.050 3.954 3.704 4.098 0.048 3 0 "[ . 1 . 2]" 1
1187 1 25 ILE HA 1 25 ILE MG 3.360 . 3.360 3.131 3.076 3.203 . 0 0 "[ . 1 . 2]" 1
1188 1 80 ALA MB 1 97 ARG H 3.780 . 3.780 3.703 3.635 3.759 . 0 0 "[ . 1 . 2]" 1
1189 1 82 GLY H 1 83 LYS QB 5.360 . 5.360 4.500 4.317 4.863 . 0 0 "[ . 1 . 2]" 1
1190 1 82 GLY H 1 90 ALA MB 5.500 . 5.500 4.667 4.415 4.897 . 0 0 "[ . 1 . 2]" 1
1191 1 82 GLY H 1 93 ILE HB 5.500 . 5.500 4.594 4.421 4.730 . 0 0 "[ . 1 . 2]" 1
1192 1 82 GLY H 1 94 MET HA 5.190 . 5.190 4.494 4.165 4.809 . 0 0 "[ . 1 . 2]" 1
1193 1 87 VAL MG2 1 88 ALA H 3.940 . 3.940 3.458 3.150 3.708 . 0 0 "[ . 1 . 2]" 1
1194 1 88 ALA MB 1 89 ASN HA 4.080 . 4.080 3.831 3.734 3.929 . 0 0 "[ . 1 . 2]" 1
1195 1 26 GLU QG 1 72 PHE QD 4.610 . 4.610 3.608 2.885 4.069 . 0 0 "[ . 1 . 2]" 1
1196 1 91 LYS HB3 1 91 LYS QD 3.710 . 3.710 2.698 2.362 3.261 . 0 0 "[ . 1 . 2]" 1
1197 1 92 TYR HA 1 92 TYR QD 3.430 . 3.430 2.894 2.821 2.986 . 0 0 "[ . 1 . 2]" 1
1198 1 94 MET ME 1 95 LYS H 3.560 . 3.560 3.525 3.225 3.604 0.044 5 0 "[ . 1 . 2]" 1
1199 1 95 LYS HB3 1 96 GLN H 3.850 . 3.850 3.380 2.900 3.661 . 0 0 "[ . 1 . 2]" 1
1200 1 96 GLN H 1 96 GLN HG2 4.370 . 4.370 2.330 2.049 2.564 . 0 0 "[ . 1 . 2]" 1
1201 1 97 ARG H 1 97 ARG HG2 3.750 . 3.750 2.257 2.111 2.412 . 0 0 "[ . 1 . 2]" 1
1202 1 99 LEU H 1 99 LEU HB2 3.350 . 3.350 2.434 2.348 2.710 . 0 0 "[ . 1 . 2]" 1
1203 1 99 LEU HA 1 103 GLU H 4.670 . 4.670 4.308 4.001 4.628 . 0 0 "[ . 1 . 2]" 1
1204 1 100 LYS H 1 100 LYS HB2 3.210 . 3.210 2.133 2.095 2.168 . 0 0 "[ . 1 . 2]" 1
1205 1 100 LYS H 1 100 LYS QG 3.630 . 3.630 3.154 2.870 3.606 . 0 0 "[ . 1 . 2]" 1
1206 1 100 LYS HA 1 100 LYS QG 3.040 . 3.040 2.552 2.451 2.632 . 0 0 "[ . 1 . 2]" 1
1207 1 102 LEU H 1 102 LEU HB2 3.760 . 3.760 3.620 3.597 3.641 . 0 0 "[ . 1 . 2]" 1
1208 1 103 GLU H 1 104 ASP H 3.420 . 3.420 2.482 2.282 2.647 . 0 0 "[ . 1 . 2]" 1
1209 1 104 ASP H 1 106 SER H 4.690 . 4.690 3.915 3.795 4.180 . 0 0 "[ . 1 . 2]" 1
1210 1 107 ASN HB2 1 108 LEU HA 4.830 . 4.830 4.797 4.711 4.867 0.037 1 0 "[ . 1 . 2]" 1
1211 1 108 LEU HA 1 108 LEU HG 3.640 . 3.640 3.635 3.614 3.656 0.016 5 0 "[ . 1 . 2]" 1
1212 1 108 LEU HA 1 111 TYR QE 5.070 . 5.070 4.799 4.149 4.958 . 0 0 "[ . 1 . 2]" 1
1213 1 110 LEU H 1 110 LEU MD1 3.940 . 3.940 3.511 3.381 3.685 . 0 0 "[ . 1 . 2]" 1
1214 1 110 LEU HB3 1 111 TYR H 4.810 . 4.810 4.505 4.461 4.546 . 0 0 "[ . 1 . 2]" 1
1215 1 111 TYR QE 1 113 CYS HB3 4.140 . 4.140 2.188 1.905 2.523 . 0 0 "[ . 1 . 2]" 1
1216 1 115 CYS H 1 116 LYS H 3.680 . 3.680 2.345 2.149 2.521 . 0 0 "[ . 1 . 2]" 1
1217 1 29 VAL HA 1 29 VAL MG1 3.230 . 3.230 2.796 2.333 3.221 . 0 0 "[ . 1 . 2]" 1
1218 1 30 TYR H 1 30 TYR QD 3.720 . 3.720 2.695 1.978 2.974 . 0 0 "[ . 1 . 2]" 1
1219 1 30 TYR HA 1 34 LYS H 4.050 . 4.050 3.378 3.034 3.562 . 0 0 "[ . 1 . 2]" 1
1220 1 31 GLN QB 1 31 GLN HG2 2.720 . 2.720 2.315 2.241 2.383 . 0 0 "[ . 1 . 2]" 1
1221 1 31 GLN QB 1 32 LEU MD1 4.210 . 4.210 4.047 3.844 4.199 . 0 0 "[ . 1 . 2]" 1
1222 1 32 LEU HA 1 32 LEU MD2 3.990 . 3.990 3.948 3.916 3.975 . 0 0 "[ . 1 . 2]" 1
1223 1 32 LEU HA 1 35 ASP HB3 3.640 . 3.640 2.791 2.295 3.731 0.091 1 0 "[ . 1 . 2]" 1
1224 1 33 LEU HA 1 33 LEU MD2 3.820 . 3.820 1.891 1.787 3.707 0.013 11 0 "[ . 1 . 2]" 1
1225 1 33 LEU HA 1 38 CYS H 4.420 . 4.420 4.228 3.911 4.431 0.011 9 0 "[ . 1 . 2]" 1
1226 1 33 LEU MD1 1 41 PHE HZ 5.270 . 5.270 4.123 3.958 5.338 0.068 14 0 "[ . 1 . 2]" 1
1227 1 33 LEU MD1 1 41 PHE QD 4.430 . 4.430 2.830 2.558 4.502 0.072 14 0 "[ . 1 . 2]" 1
1228 1 33 LEU MD1 1 74 ARG HD2 5.500 . 5.500 3.379 1.904 4.372 . 0 0 "[ . 1 . 2]" 1
1229 1 33 LEU MD2 1 74 ARG HD3 5.500 . 5.500 4.212 3.801 5.281 . 0 0 "[ . 1 . 2]" 1
1230 1 36 GLN H 1 36 GLN HG3 3.310 . 3.310 2.380 2.006 2.539 . 0 0 "[ . 1 . 2]" 1
1231 1 36 GLN H 1 36 GLN HG2 3.430 . 3.430 2.475 2.163 3.027 . 0 0 "[ . 1 . 2]" 1
1232 1 36 GLN HB2 1 36 GLN HG3 2.760 . 2.760 2.222 2.185 2.304 . 0 0 "[ . 1 . 2]" 1
1233 1 36 GLN HB2 1 36 GLN HG2 2.960 . 2.960 2.917 2.878 2.970 0.010 14 0 "[ . 1 . 2]" 1
1234 1 36 GLN HE22 1 110 LEU MD1 4.390 . 4.390 4.091 3.586 4.422 0.032 6 0 "[ . 1 . 2]" 1
1235 1 42 GLY H 1 72 PHE HZ 5.210 . 5.210 3.677 3.360 3.879 . 0 0 "[ . 1 . 2]" 1
1236 1 43 THR MG 1 72 PHE QD 3.230 . 3.230 1.813 1.690 1.877 0.110 18 0 "[ . 1 . 2]" 1
1237 1 44 LYS H 1 44 LYS HB2 4.170 . 4.170 3.834 3.720 3.915 . 0 0 "[ . 1 . 2]" 1
1238 1 46 VAL H 1 70 PHE HA 4.310 . 4.310 3.898 3.425 4.212 . 0 0 "[ . 1 . 2]" 1
1239 1 47 ILE HA 1 47 ILE MG 3.190 . 3.190 2.473 2.421 2.508 . 0 0 "[ . 1 . 2]" 1
1240 1 47 ILE HA 1 48 GLU H 3.100 . 3.100 2.099 2.063 2.133 . 0 0 "[ . 1 . 2]" 1
1241 1 47 ILE MG 1 66 LYS HB3 4.190 . 4.190 3.497 3.272 3.732 . 0 0 "[ . 1 . 2]" 1
1242 1 49 GLU HB2 1 50 VAL H 3.970 . 3.970 3.132 2.487 3.669 . 0 0 "[ . 1 . 2]" 1
1243 1 49 GLU HB3 1 67 TYR H 5.500 . 5.500 4.441 3.819 5.072 . 0 0 "[ . 1 . 2]" 1
1244 1 67 TYR H 1 67 TYR HB3 4.020 . 4.020 3.738 3.684 3.797 . 0 0 "[ . 1 . 2]" 1
1245 1 67 TYR HA 1 67 TYR QD 3.820 . 3.820 3.094 2.972 3.163 . 0 0 "[ . 1 . 2]" 1
1246 1 68 TYR H 1 83 LYS HA 5.050 . 5.050 4.626 4.386 4.875 . 0 0 "[ . 1 . 2]" 1
1247 1 68 TYR QE 1 70 PHE QE 5.110 . 5.110 3.993 3.253 4.660 . 0 0 "[ . 1 . 2]" 1
1248 1 70 PHE H 1 90 ALA MB 4.020 . 4.020 2.696 2.499 2.883 . 0 0 "[ . 1 . 2]" 1
1249 1 70 PHE QD 1 90 ALA MB 3.300 . 3.300 1.892 1.752 2.437 0.048 3 0 "[ . 1 . 2]" 1
1250 1 72 PHE HB3 1 98 LEU MD2 4.280 . 4.280 2.358 2.059 2.742 . 0 0 "[ . 1 . 2]" 1
1251 1 73 PHE HB3 1 74 ARG H 4.280 . 4.280 3.199 3.017 3.335 . 0 0 "[ . 1 . 2]" 1
1252 1 73 PHE QD 1 77 ASN H 4.310 . 4.310 3.433 3.036 3.695 . 0 0 "[ . 1 . 2]" 1
1253 1 74 ARG H 1 78 ILE HA 4.010 . 4.010 3.699 3.519 3.919 . 0 0 "[ . 1 . 2]" 1
1254 1 74 ARG HA 1 79 VAL MG2 5.030 . 5.030 4.256 4.132 4.518 . 0 0 "[ . 1 . 2]" 1
1255 1 74 ARG HD3 1 111 TYR QE 4.670 . 4.670 3.970 2.758 4.698 0.028 4 0 "[ . 1 . 2]" 1
1256 1 75 HIS HB3 1 76 GLY H 4.490 . 4.490 4.311 4.273 4.351 . 0 0 "[ . 1 . 2]" 1
1257 1 77 ASN HA 1 78 ILE HG12 4.200 . 4.200 3.631 3.515 3.726 . 0 0 "[ . 1 . 2]" 1
1258 1 80 ALA HA 1 81 TYR HB2 4.620 . 4.620 4.431 4.251 4.580 . 0 0 "[ . 1 . 2]" 1
1259 1 80 ALA MB 1 98 LEU H 3.590 . 3.590 2.737 2.643 2.873 . 0 0 "[ . 1 . 2]" 1
1260 1 81 TYR QE 1 83 LYS QB 3.300 . 3.300 2.336 1.763 2.859 0.037 10 0 "[ . 1 . 2]" 1
1261 1 82 GLY H 1 93 ILE MG 4.350 . 4.350 4.325 4.224 4.376 0.026 20 0 "[ . 1 . 2]" 1
1262 1 83 LYS H 1 83 LYS QB 3.160 . 3.160 2.334 2.169 2.679 . 0 0 "[ . 1 . 2]" 1
1263 1 83 LYS HG2 1 84 SER H 4.450 . 4.450 3.708 3.040 4.599 0.149 14 0 "[ . 1 . 2]" 1
1264 1 87 VAL MG1 1 88 ALA H 3.940 . 3.940 1.993 1.818 2.158 . 0 0 "[ . 1 . 2]" 1
1265 1 87 VAL MG2 1 90 ALA MB 4.990 . 4.990 3.809 3.603 4.128 . 0 0 "[ . 1 . 2]" 1
1266 1 87 VAL MG2 1 91 LYS QD 4.590 . 4.590 2.679 1.862 3.591 . 0 0 "[ . 1 . 2]" 1
1267 1 88 ALA H 1 90 ALA H 4.510 . 4.510 4.238 4.052 4.412 . 0 0 "[ . 1 . 2]" 1
1268 1 88 ALA MB 1 89 ASN HB3 5.060 . 5.060 4.796 4.591 4.980 . 0 0 "[ . 1 . 2]" 1
1269 1 89 ASN HB2 1 90 ALA MB 5.290 . 5.290 5.165 5.067 5.300 0.010 16 0 "[ . 1 . 2]" 1
1270 1 26 GLU QG 1 98 LEU MD1 4.990 . 4.990 4.442 3.740 4.869 . 0 0 "[ . 1 . 2]" 1
1271 1 91 LYS HA 1 95 LYS H 4.410 . 4.410 3.996 3.861 4.112 . 0 0 "[ . 1 . 2]" 1
1272 1 91 LYS HB2 1 91 LYS QD 3.710 . 3.710 2.647 2.300 3.007 . 0 0 "[ . 1 . 2]" 1
1273 1 91 LYS HG3 1 95 LYS QE 4.640 . 4.640 3.905 2.793 4.656 0.016 4 0 "[ . 1 . 2]" 1
1274 1 93 ILE H 1 93 ILE MD 3.200 . 3.200 3.178 3.123 3.213 0.013 17 0 "[ . 1 . 2]" 1
1275 1 93 ILE HA 1 93 ILE MD 3.810 . 3.810 3.861 3.841 3.888 0.078 12 0 "[ . 1 . 2]" 1
1276 1 93 ILE MD 1 94 MET H 4.090 . 4.090 4.138 4.107 4.166 0.076 9 0 "[ . 1 . 2]" 1
1277 1 93 ILE MD 1 93 ILE MG 2.910 . 2.910 2.174 2.126 2.241 . 0 0 "[ . 1 . 2]" 1
1278 1 95 LYS H 1 96 GLN HB2 5.040 . 5.040 4.875 4.746 5.050 0.010 4 0 "[ . 1 . 2]" 1
1279 1 96 GLN H 1 97 ARG H 3.470 . 3.470 2.662 2.612 2.716 . 0 0 "[ . 1 . 2]" 1
1280 1 98 LEU H 1 98 LEU MD1 4.100 . 4.100 1.826 1.732 2.030 0.068 7 0 "[ . 1 . 2]" 1
1281 1 98 LEU HA 1 101 LEU MD1 4.220 . 4.220 2.550 1.943 4.239 0.019 4 0 "[ . 1 . 2]" 1
1282 1 98 LEU HB2 1 99 LEU H 4.320 . 4.320 2.880 2.777 3.065 . 0 0 "[ . 1 . 2]" 1
1283 1 98 LEU MD1 1 99 LEU H 4.830 . 4.830 2.953 2.435 3.155 . 0 0 "[ . 1 . 2]" 1
1284 1 99 LEU MD2 1 103 GLU H 5.260 . 5.260 4.260 3.786 5.396 0.136 17 0 "[ . 1 . 2]" 1
1285 1 100 LYS H 1 101 LEU MD2 5.380 . 5.380 5.036 3.774 5.377 . 0 0 "[ . 1 . 2]" 1
1286 1 100 LYS HD2 1 100 LYS QG 2.700 . 2.700 2.333 2.315 2.357 . 0 0 "[ . 1 . 2]" 1
1287 1 101 LEU HA 1 101 LEU MD2 4.050 . 4.050 2.674 1.940 3.801 . 0 0 "[ . 1 . 2]" 1
1288 1 101 LEU HG 1 102 LEU H 5.280 . 5.280 4.702 4.344 5.237 . 0 0 "[ . 1 . 2]" 1
1289 1 102 LEU HA 1 105 LYS HA 5.200 . 5.200 3.188 2.965 3.390 . 0 0 "[ . 1 . 2]" 1
1290 1 104 ASP H 1 105 LYS HA 4.630 . 4.630 4.473 4.402 4.567 . 0 0 "[ . 1 . 2]" 1
1291 1 105 LYS H 1 105 LYS HD3 4.440 . 4.440 3.718 3.041 4.480 0.040 12 0 "[ . 1 . 2]" 1
1292 1 105 LYS HA 1 106 SER H 3.380 . 3.380 2.687 2.473 2.820 . 0 0 "[ . 1 . 2]" 1
1293 1 106 SER H 1 106 SER HB3 3.710 . 3.710 3.603 3.542 3.677 . 0 0 "[ . 1 . 2]" 1
1294 1 107 ASN HB3 1 108 LEU H 4.360 . 4.360 4.332 4.226 4.432 0.072 15 0 "[ . 1 . 2]" 1
1295 1 107 ASN HB3 1 110 LEU H 5.500 . 5.500 5.255 5.058 5.453 . 0 0 "[ . 1 . 2]" 1
1296 1 28 LYS HA 1 31 GLN QB 3.660 . 3.660 2.603 2.412 2.746 . 0 0 "[ . 1 . 2]" 1
1297 1 28 LYS HA 1 28 LYS HG2 4.000 . 4.000 3.406 3.349 3.545 . 0 0 "[ . 1 . 2]" 1
1298 1 111 TYR H 1 111 TYR HB3 3.600 . 3.600 2.587 2.523 2.648 . 0 0 "[ . 1 . 2]" 1
1299 1 115 CYS HA 1 116 LYS HB3 5.380 . 5.380 5.211 4.941 5.448 0.068 14 0 "[ . 1 . 2]" 1
1300 1 117 PHE HB3 1 118 SER H 4.390 . 4.390 3.775 3.584 3.929 . 0 0 "[ . 1 . 2]" 1
1301 1 29 VAL H 1 29 VAL HB 3.200 . 3.200 2.606 2.505 2.697 . 0 0 "[ . 1 . 2]" 1
1302 1 29 VAL HA 1 29 VAL MG2 3.230 . 3.230 2.391 2.315 2.465 . 0 0 "[ . 1 . 2]" 1
1303 1 30 TYR HA 1 33 LEU HG 5.190 . 5.190 4.679 4.315 5.315 0.125 14 0 "[ . 1 . 2]" 1
1304 1 30 TYR HB3 1 34 LYS H 4.730 . 4.730 4.672 4.491 4.781 0.051 8 0 "[ . 1 . 2]" 1
1305 1 31 GLN H 1 32 LEU HG 4.330 . 4.330 3.976 3.843 4.081 . 0 0 "[ . 1 . 2]" 1
1306 1 31 GLN H 1 32 LEU MD1 4.300 . 4.300 4.171 3.964 4.311 0.011 1 0 "[ . 1 . 2]" 1
1307 1 32 LEU MD2 1 36 GLN HE22 5.390 . 5.390 4.751 4.063 5.185 . 0 0 "[ . 1 . 2]" 1
1308 1 33 LEU HG 1 110 LEU HA 5.500 . 5.500 4.829 4.350 5.274 . 0 0 "[ . 1 . 2]" 1
1309 1 34 LYS H 1 34 LYS HG3 3.890 . 3.890 3.260 2.342 3.924 0.034 12 0 "[ . 1 . 2]" 1
1310 1 34 LYS HA 1 38 CYS H 3.760 . 3.760 2.658 2.387 2.850 . 0 0 "[ . 1 . 2]" 1
1311 1 39 GLU H 1 115 CYS HA 5.380 . 5.380 5.290 4.840 5.454 0.074 9 0 "[ . 1 . 2]" 1
1312 1 40 ASP H 1 41 PHE H 3.710 . 3.710 3.773 3.151 3.924 0.214 14 0 "[ . 1 . 2]" 1
1313 1 40 ASP HA 1 41 PHE QE 5.360 . 5.360 5.391 5.260 5.446 0.086 12 0 "[ . 1 . 2]" 1
1314 1 44 LYS HB3 1 73 PHE QE 4.110 . 4.110 3.516 2.538 4.133 0.023 5 0 "[ . 1 . 2]" 1
1315 1 44 LYS QD 1 46 VAL QG 3.420 . 3.420 2.320 1.919 3.441 0.021 17 0 "[ . 1 . 2]" 1
1316 1 47 ILE H 1 47 ILE MG 4.090 . 4.090 3.744 3.723 3.778 . 0 0 "[ . 1 . 2]" 1
1317 1 47 ILE HB 1 47 ILE MD 2.760 . 2.760 2.432 2.401 2.448 . 0 0 "[ . 1 . 2]" 1
1318 1 47 ILE HB 1 68 TYR QD 5.500 . 5.500 5.356 4.942 5.631 0.131 7 0 "[ . 1 . 2]" 1
1319 1 47 ILE MD 1 66 LYS QE 3.790 . 3.790 3.016 2.442 3.596 . 0 0 "[ . 1 . 2]" 1
1320 1 47 ILE MD 1 68 TYR QD 3.720 . 3.720 3.607 3.328 3.772 0.052 7 0 "[ . 1 . 2]" 1
1321 1 48 GLU HB2 1 67 TYR QD 5.500 . 5.500 5.115 4.163 5.432 . 0 0 "[ . 1 . 2]" 1
1322 1 61 GLU HB2 1 62 LEU H 4.690 . 4.690 4.198 3.509 4.533 . 0 0 "[ . 1 . 2]" 1
1323 1 66 LYS H 1 66 LYS HB3 3.450 . 3.450 2.582 2.457 2.686 . 0 0 "[ . 1 . 2]" 1
1324 1 66 LYS HB3 1 66 LYS QE 4.110 . 4.110 4.021 3.972 4.147 0.037 12 0 "[ . 1 . 2]" 1
1325 1 66 LYS QE 1 66 LYS HG3 2.950 . 2.950 2.547 2.423 2.881 . 0 0 "[ . 1 . 2]" 1
1326 1 66 LYS QD 1 68 TYR H 5.500 . 5.500 5.494 5.213 5.569 0.069 3 0 "[ . 1 . 2]" 1
1327 1 67 TYR HA 1 67 TYR QE 5.000 . 5.000 4.659 4.583 4.721 . 0 0 "[ . 1 . 2]" 1
1328 1 68 TYR H 1 83 LYS QD 5.500 . 5.500 5.269 4.562 5.566 0.066 4 0 "[ . 1 . 2]" 1
1329 1 68 TYR HB3 1 69 GLY H 4.660 . 4.660 3.699 3.516 3.824 . 0 0 "[ . 1 . 2]" 1
1330 1 68 TYR QD 1 87 VAL MG2 4.330 . 4.330 2.393 1.958 2.784 . 0 0 "[ . 1 . 2]" 1
1331 1 71 SER HB2 1 72 PHE H 4.210 . 4.210 3.741 2.821 4.192 . 0 0 "[ . 1 . 2]" 1
1332 1 72 PHE H 1 80 ALA H 3.880 . 3.880 2.676 2.513 2.864 . 0 0 "[ . 1 . 2]" 1
1333 1 72 PHE HA 1 72 PHE QE 4.910 . 4.910 4.565 4.515 4.633 . 0 0 "[ . 1 . 2]" 1
1334 1 74 ARG H 1 77 ASN H 3.560 . 3.560 2.918 2.734 3.085 . 0 0 "[ . 1 . 2]" 1
1335 1 75 HIS H 1 76 GLY H 3.120 . 3.120 2.677 2.562 2.825 . 0 0 "[ . 1 . 2]" 1
1336 1 78 ILE H 1 78 ILE HB 3.210 . 3.210 2.510 2.462 2.555 . 0 0 "[ . 1 . 2]" 1
1337 1 79 VAL H 1 79 VAL HB 3.620 . 3.620 2.484 2.440 2.574 . 0 0 "[ . 1 . 2]" 1
1338 1 79 VAL H 1 79 VAL MG2 3.060 . 3.060 2.519 2.370 2.693 . 0 0 "[ . 1 . 2]" 1
1339 1 79 VAL HA 1 79 VAL MG1 2.940 . 2.940 2.417 2.340 2.465 . 0 0 "[ . 1 . 2]" 1
1340 1 25 ILE HG13 1 99 LEU HA 4.470 . 4.470 3.799 3.249 4.478 0.008 15 0 "[ . 1 . 2]" 1
1341 1 25 ILE MD 1 28 LYS QD 4.650 . 4.650 4.242 3.840 4.505 . 0 0 "[ . 1 . 2]" 1
1342 1 25 ILE MG 1 98 LEU MD2 3.550 . 3.550 3.492 3.165 3.680 0.130 2 0 "[ . 1 . 2]" 1
1343 1 80 ALA H 1 80 ALA MB 3.410 . 3.410 2.544 2.475 2.600 . 0 0 "[ . 1 . 2]" 1
1344 1 80 ALA HA 1 81 TYR H 3.440 . 3.440 2.203 2.155 2.243 . 0 0 "[ . 1 . 2]" 1
1345 1 80 ALA MB 1 97 ARG HA 4.520 . 4.520 4.528 4.395 4.583 0.063 2 0 "[ . 1 . 2]" 1
1346 1 80 ALA MB 1 97 ARG HG2 3.850 . 3.850 3.426 2.976 3.619 . 0 0 "[ . 1 . 2]" 1
1347 1 81 TYR QD 1 83 LYS H 4.480 . 4.480 3.412 2.777 4.009 . 0 0 "[ . 1 . 2]" 1
1348 1 83 LYS QB 1 83 LYS QD 3.070 . 3.070 2.278 2.072 2.475 . 0 0 "[ . 1 . 2]" 1
1349 1 87 VAL H 1 87 VAL MG1 3.780 . 3.780 1.977 1.839 2.183 . 0 0 "[ . 1 . 2]" 1
1350 1 87 VAL HA 1 87 VAL MG2 3.340 . 3.340 2.464 2.403 2.532 . 0 0 "[ . 1 . 2]" 1
1351 1 89 ASN H 1 90 ALA HA 5.500 . 5.500 5.172 5.026 5.273 . 0 0 "[ . 1 . 2]" 1
1352 1 90 ALA MB 1 92 TYR H 4.880 . 4.880 4.373 4.306 4.485 . 0 0 "[ . 1 . 2]" 1
1353 1 90 ALA MB 1 93 ILE MD 4.130 . 4.130 3.557 3.328 3.738 . 0 0 "[ . 1 . 2]" 1
1354 1 92 TYR H 1 92 TYR QB 2.990 . 2.990 2.176 2.120 2.204 . 0 0 "[ . 1 . 2]" 1
1355 1 95 LYS H 1 95 LYS QD 3.490 . 3.490 3.495 2.557 3.608 0.118 15 0 "[ . 1 . 2]" 1
1356 1 95 LYS HA 1 98 LEU H 4.220 . 4.220 3.914 3.760 4.155 . 0 0 "[ . 1 . 2]" 1
1357 1 96 GLN HA 1 96 GLN HG2 3.700 . 3.700 2.987 2.819 3.127 . 0 0 "[ . 1 . 2]" 1
1358 1 96 GLN HA 1 99 LEU HB3 3.420 . 3.420 2.025 1.927 2.290 . 0 0 "[ . 1 . 2]" 1
1359 1 98 LEU H 1 98 LEU HB2 4.070 . 4.070 3.017 2.928 3.238 . 0 0 "[ . 1 . 2]" 1
1360 1 99 LEU H 1 99 LEU HB3 3.140 . 3.140 2.549 2.414 2.620 . 0 0 "[ . 1 . 2]" 1
1361 1 100 LYS H 1 100 LYS HB3 3.460 . 3.460 3.405 3.136 3.479 0.019 12 0 "[ . 1 . 2]" 1
1362 1 101 LEU H 1 102 LEU MD2 4.340 . 4.340 4.356 4.200 4.394 0.054 13 0 "[ . 1 . 2]" 1
1363 1 102 LEU HB2 1 103 GLU H 4.360 . 4.360 3.904 3.730 4.076 . 0 0 "[ . 1 . 2]" 1
1364 1 102 LEU HB3 1 103 GLU H 4.360 . 4.360 4.243 4.127 4.306 . 0 0 "[ . 1 . 2]" 1
1365 1 102 LEU MD1 1 103 GLU HG3 4.150 . 4.150 3.764 3.550 4.025 . 0 0 "[ . 1 . 2]" 1
1366 1 103 GLU H 1 103 GLU HG2 3.260 . 3.260 2.534 2.303 2.715 . 0 0 "[ . 1 . 2]" 1
1367 1 103 GLU H 1 103 GLU QB 3.550 . 3.550 2.347 2.268 2.417 . 0 0 "[ . 1 . 2]" 1
1368 1 103 GLU HA 1 103 GLU HG3 3.820 . 3.820 3.743 3.687 3.796 . 0 0 "[ . 1 . 2]" 1
1369 1 103 GLU QB 1 104 ASP H 3.470 . 3.470 2.529 2.389 2.687 . 0 0 "[ . 1 . 2]" 1
1370 1 106 SER H 1 110 LEU MD2 5.290 . 5.290 5.098 4.789 5.300 0.010 12 0 "[ . 1 . 2]" 1
1371 1 107 ASN HB2 1 108 LEU H 4.330 . 4.330 4.314 4.216 4.382 0.052 1 0 "[ . 1 . 2]" 1
1372 1 107 ASN HB2 1 111 TYR H 4.660 . 4.660 4.119 3.868 4.310 . 0 0 "[ . 1 . 2]" 1
1373 1 108 LEU H 1 111 TYR H 5.500 . 5.500 5.139 5.018 5.220 . 0 0 "[ . 1 . 2]" 1
1374 1 108 LEU HA 1 108 LEU MD1 2.500 . 2.500 1.877 1.823 1.916 . 0 0 "[ . 1 . 2]" 1
1375 1 109 LEU H 1 110 LEU MD1 3.880 . 3.880 4.033 3.996 4.075 0.195 9 0 "[ . 1 . 2]" 1
1376 1 28 LYS HB2 1 28 LYS QD 3.730 . 3.730 3.307 3.292 3.324 . 0 0 "[ . 1 . 2]" 1
1377 1 110 LEU H 1 110 LEU HG 3.690 . 3.690 2.387 2.159 2.522 . 0 0 "[ . 1 . 2]" 1
1378 1 111 TYR H 1 111 TYR HB2 3.600 . 3.600 3.628 3.612 3.641 0.041 7 0 "[ . 1 . 2]" 1
1379 1 111 TYR HA 1 111 TYR QD 3.870 . 3.870 3.733 3.722 3.749 . 0 0 "[ . 1 . 2]" 1
1380 1 111 TYR HB3 1 112 SER H 4.290 . 4.290 3.805 3.677 3.922 . 0 0 "[ . 1 . 2]" 1
1381 1 116 LYS HB3 1 116 LYS QE 4.000 . 4.000 2.894 2.689 3.686 . 0 0 "[ . 1 . 2]" 1
1382 1 29 VAL MG1 1 30 TYR QD 4.480 . 4.480 2.631 2.016 3.892 . 0 0 "[ . 1 . 2]" 1
1383 1 31 GLN HA 1 31 GLN HE21 4.470 . 4.470 2.652 2.141 3.933 . 0 0 "[ . 1 . 2]" 1
1384 1 31 GLN HA 1 31 GLN HE22 4.470 . 4.470 3.232 3.019 3.985 . 0 0 "[ . 1 . 2]" 1
1385 1 31 GLN QB 1 32 LEU H 3.530 . 3.530 2.517 2.251 2.704 . 0 0 "[ . 1 . 2]" 1
1386 1 32 LEU HA 1 36 GLN H 4.370 . 4.370 4.232 4.013 4.417 0.047 3 0 "[ . 1 . 2]" 1
1387 1 33 LEU H 1 34 LYS H 3.580 . 3.580 2.770 2.685 2.934 . 0 0 "[ . 1 . 2]" 1
1388 1 33 LEU H 1 35 ASP H 4.180 . 4.180 3.890 3.789 4.039 . 0 0 "[ . 1 . 2]" 1
1389 1 33 LEU HA 1 41 PHE HZ 5.440 . 5.440 5.207 5.114 5.335 . 0 0 "[ . 1 . 2]" 1
1390 1 33 LEU MD2 1 34 LYS H 4.570 . 4.570 4.540 4.481 4.611 0.041 14 0 "[ . 1 . 2]" 1
1391 1 34 LYS HA 1 37 GLY H 3.790 . 3.790 3.525 3.221 3.686 . 0 0 "[ . 1 . 2]" 1
1392 1 35 ASP H 1 35 ASP HB2 3.360 . 3.360 2.503 2.117 2.699 . 0 0 "[ . 1 . 2]" 1
1393 1 35 ASP H 1 35 ASP HB3 3.360 . 3.360 2.644 2.390 3.446 0.086 1 0 "[ . 1 . 2]" 1
1394 1 35 ASP H 1 36 GLN HG2 4.710 . 4.710 4.492 4.238 4.722 0.012 15 0 "[ . 1 . 2]" 1
1395 1 36 GLN HE22 1 36 GLN HG3 4.060 . 4.060 3.445 3.429 3.465 . 0 0 "[ . 1 . 2]" 1
1396 1 36 GLN HE21 1 36 GLN HG2 3.280 . 3.280 2.951 2.913 2.989 . 0 0 "[ . 1 . 2]" 1
1397 1 41 PHE HB2 1 42 GLY H 4.340 . 4.340 2.572 2.226 2.830 . 0 0 "[ . 1 . 2]" 1
1398 1 41 PHE HB2 1 74 ARG HA 4.950 . 4.950 3.579 3.320 3.821 . 0 0 "[ . 1 . 2]" 1
1399 1 41 PHE QD 1 42 GLY H 4.490 . 4.490 3.889 3.500 4.163 . 0 0 "[ . 1 . 2]" 1
1400 1 43 THR H 1 43 THR MG 4.240 . 4.240 2.931 2.629 3.222 . 0 0 "[ . 1 . 2]" 1
1401 1 43 THR MG 1 72 PHE HA 3.450 . 3.450 2.734 2.405 3.096 . 0 0 "[ . 1 . 2]" 1
1402 1 44 LYS H 1 72 PHE HA 4.290 . 4.290 3.274 3.102 3.590 . 0 0 "[ . 1 . 2]" 1
1403 1 44 LYS QE 1 44 LYS QG 3.080 . 3.080 2.210 2.127 2.391 . 0 0 "[ . 1 . 2]" 1
1404 1 47 ILE H 1 47 ILE MD 3.980 . 3.980 3.775 3.693 4.006 0.026 16 0 "[ . 1 . 2]" 1
1405 1 47 ILE HA 1 68 TYR QE 5.040 . 5.040 5.020 4.907 5.109 0.069 17 0 "[ . 1 . 2]" 1
1406 1 47 ILE MD 1 48 GLU H 4.910 . 4.910 4.961 4.917 5.000 0.090 1 0 "[ . 1 . 2]" 1
1407 1 47 ILE MD 1 68 TYR QE 3.300 . 3.300 2.561 2.260 2.788 . 0 0 "[ . 1 . 2]" 1
1408 1 47 ILE MG 1 66 LYS HA 4.360 . 4.360 3.824 3.576 4.050 . 0 0 "[ . 1 . 2]" 1
1409 1 47 ILE MG 1 68 TYR QE 4.180 . 4.180 3.875 3.600 4.139 . 0 0 "[ . 1 . 2]" 1
1410 1 48 GLU HA 1 48 GLU HG2 4.070 . 4.070 2.407 2.257 2.590 . 0 0 "[ . 1 . 2]" 1
1411 1 48 GLU HB2 1 67 TYR H 4.480 . 4.480 4.117 3.525 4.446 . 0 0 "[ . 1 . 2]" 1
1412 1 49 GLU H 1 50 VAL H 5.050 . 5.050 4.525 4.352 4.602 . 0 0 "[ . 1 . 2]" 1
1413 1 58 LEU MD1 1 62 LEU H 4.770 . 4.770 2.685 2.127 4.111 . 0 0 "[ . 1 . 2]" 1
1414 1 61 GLU H 1 61 GLU HG2 4.270 . 4.270 3.208 1.762 4.409 0.139 17 0 "[ . 1 . 2]" 1
1415 1 65 THR MG 1 67 TYR QD 3.660 . 3.660 3.419 3.143 3.668 0.008 19 0 "[ . 1 . 2]" 1
1416 1 66 LYS H 1 66 LYS HG2 4.560 . 4.560 3.861 3.766 3.990 . 0 0 "[ . 1 . 2]" 1
1417 1 66 LYS H 1 66 LYS HG3 5.090 . 5.090 4.257 4.103 4.433 . 0 0 "[ . 1 . 2]" 1
1418 1 66 LYS HB2 1 67 TYR H 3.840 . 3.840 2.947 2.836 3.063 . 0 0 "[ . 1 . 2]" 1
1419 1 66 LYS QE 1 66 LYS HG2 2.890 . 2.890 2.227 2.124 2.295 . 0 0 "[ . 1 . 2]" 1
1420 1 66 LYS QE 1 67 TYR H 4.390 . 4.390 4.459 4.413 4.517 0.127 17 0 "[ . 1 . 2]" 1
1421 1 68 TYR QE 1 87 VAL H 4.610 . 4.610 4.197 2.962 4.645 0.035 16 0 "[ . 1 . 2]" 1
1422 1 70 PHE QD 1 91 LYS HA 4.160 . 4.160 3.467 2.869 3.683 . 0 0 "[ . 1 . 2]" 1
1423 1 70 PHE QE 1 87 VAL HA 4.090 . 4.090 2.539 2.255 3.083 . 0 0 "[ . 1 . 2]" 1
1424 1 72 PHE H 1 81 TYR HA 4.170 . 4.170 3.655 3.426 3.817 . 0 0 "[ . 1 . 2]" 1
1425 1 72 PHE HA 1 72 PHE QD 4.140 . 4.140 2.974 2.852 3.039 . 0 0 "[ . 1 . 2]" 1
1426 1 72 PHE HB3 1 98 LEU MD1 4.280 . 4.280 3.422 3.197 3.993 . 0 0 "[ . 1 . 2]" 1
1427 1 72 PHE QD 1 79 VAL HB 3.420 . 3.420 2.371 1.777 2.568 0.023 15 0 "[ . 1 . 2]" 1
1428 1 72 PHE QD 1 98 LEU MD2 3.710 . 3.710 2.620 2.575 2.655 . 0 0 "[ . 1 . 2]" 1
1429 1 72 PHE QE 1 73 PHE H 4.500 . 4.500 4.438 4.316 4.530 0.030 7 0 "[ . 1 . 2]" 1
1430 1 73 PHE H 1 73 PHE QD 3.680 . 3.680 3.267 2.921 3.652 . 0 0 "[ . 1 . 2]" 1
1431 1 73 PHE HA 1 77 ASN H 5.080 . 5.080 4.523 4.250 4.866 . 0 0 "[ . 1 . 2]" 1
1432 1 73 PHE HA 1 78 ILE MD 4.210 . 4.210 2.746 2.425 3.016 . 0 0 "[ . 1 . 2]" 1
1433 1 73 PHE HA 1 80 ALA H 4.960 . 4.960 4.887 4.805 4.974 0.014 17 0 "[ . 1 . 2]" 1
1434 1 73 PHE QE 1 78 ILE MD 3.560 . 3.560 2.737 2.431 3.234 . 0 0 "[ . 1 . 2]" 1
1435 1 74 ARG HB2 1 111 TYR QE 5.500 . 5.500 5.100 4.191 5.517 0.017 9 0 "[ . 1 . 2]" 1
1436 1 74 ARG HD3 1 75 HIS HD2 5.100 . 5.100 3.471 1.830 4.833 . 0 0 "[ . 1 . 2]" 1
1437 1 74 ARG HE 1 111 TYR QE 5.010 . 5.010 3.813 2.719 5.087 0.077 8 0 "[ . 1 . 2]" 1
1438 1 75 HIS HE1 1 111 TYR QE 5.010 . 5.010 4.793 4.549 5.021 0.011 18 0 "[ . 1 . 2]" 1
1439 1 78 ILE H 1 78 ILE MG 3.890 . 3.890 3.767 3.749 3.793 . 0 0 "[ . 1 . 2]" 1
1440 1 78 ILE MD 1 81 TYR QD 4.090 . 4.090 3.088 2.428 3.431 . 0 0 "[ . 1 . 2]" 1
1441 1 25 ILE MD 1 98 LEU MD1 4.030 . 4.030 2.561 1.974 3.404 . 0 0 "[ . 1 . 2]" 1
1442 1 25 ILE MG 1 98 LEU MD1 3.550 . 3.550 2.063 1.853 2.582 . 0 0 "[ . 1 . 2]" 1
1443 1 81 TYR H 1 81 TYR HB2 3.770 . 3.770 3.197 2.905 3.301 . 0 0 "[ . 1 . 2]" 1
1444 1 81 TYR QD 1 82 GLY H 3.690 . 3.690 3.279 2.774 3.518 . 0 0 "[ . 1 . 2]" 1
1445 1 82 GLY HA3 1 93 ILE MG 3.460 . 3.460 2.724 2.343 3.038 . 0 0 "[ . 1 . 2]" 1
1446 1 82 GLY HA3 1 94 MET H 4.320 . 4.320 2.705 2.435 3.037 . 0 0 "[ . 1 . 2]" 1
1447 1 87 VAL MG1 1 90 ALA MB 4.990 . 4.990 4.831 4.698 4.980 . 0 0 "[ . 1 . 2]" 1
1448 1 88 ALA H 1 88 ALA MB 2.750 . 2.750 2.231 2.207 2.258 . 0 0 "[ . 1 . 2]" 1
1449 1 88 ALA H 1 90 ALA MB 4.810 . 4.810 4.771 4.631 4.824 0.014 12 0 "[ . 1 . 2]" 1
1450 1 89 ASN H 1 89 ASN HB3 3.450 . 3.450 2.677 2.540 2.756 . 0 0 "[ . 1 . 2]" 1
1451 1 89 ASN H 1 92 TYR QB 4.850 . 4.850 4.528 4.391 4.719 . 0 0 "[ . 1 . 2]" 1
1452 1 92 TYR H 1 93 ILE HB 5.500 . 5.500 4.967 4.886 5.054 . 0 0 "[ . 1 . 2]" 1
1453 1 92 TYR H 1 93 ILE MD 4.800 . 4.800 4.832 4.795 4.860 0.060 5 0 "[ . 1 . 2]" 1
1454 1 92 TYR QD 1 93 ILE H 3.620 . 3.620 2.951 2.724 3.047 . 0 0 "[ . 1 . 2]" 1
1455 1 92 TYR QD 1 93 ILE MG 4.900 . 4.900 4.492 4.361 4.757 . 0 0 "[ . 1 . 2]" 1
1456 1 93 ILE HB 1 94 MET H 3.940 . 3.940 2.328 2.276 2.354 . 0 0 "[ . 1 . 2]" 1
1457 1 94 MET HA 1 97 ARG H 4.050 . 4.050 3.422 3.301 3.737 . 0 0 "[ . 1 . 2]" 1
1458 1 94 MET QG 1 97 ARG H 5.360 . 5.360 4.889 4.760 4.978 . 0 0 "[ . 1 . 2]" 1
1459 1 95 LYS HA 1 97 ARG H 4.560 . 4.560 3.987 3.885 4.115 . 0 0 "[ . 1 . 2]" 1
1460 1 95 LYS QD 1 96 GLN H 4.660 . 4.660 4.533 4.371 4.690 0.030 10 0 "[ . 1 . 2]" 1
1461 1 96 GLN H 1 96 GLN HB3 3.840 . 3.840 3.582 3.560 3.603 . 0 0 "[ . 1 . 2]" 1
1462 1 97 ARG H 1 97 ARG HG3 3.750 . 3.750 3.601 3.362 3.774 0.024 2 0 "[ . 1 . 2]" 1
1463 1 99 LEU HB2 1 99 LEU MD1 3.230 . 3.230 3.016 2.228 3.163 . 0 0 "[ . 1 . 2]" 1
1464 1 99 LEU HB2 1 99 LEU MD2 3.230 . 3.230 2.572 2.546 2.601 . 0 0 "[ . 1 . 2]" 1
1465 1 99 LEU MD1 1 100 LYS H 4.180 . 4.180 3.238 2.949 4.279 0.099 4 0 "[ . 1 . 2]" 1
1466 1 27 HIS H 1 27 HIS HB2 4.130 . 4.130 2.364 2.154 2.554 . 0 0 "[ . 1 . 2]" 1
1467 1 27 HIS H 1 28 LYS H 4.300 . 4.300 2.673 2.563 2.847 . 0 0 "[ . 1 . 2]" 1
1468 1 101 LEU H 1 101 LEU HB2 3.680 . 3.680 2.343 2.092 2.496 . 0 0 "[ . 1 . 2]" 1
1469 1 101 LEU HB2 1 102 LEU H 4.000 . 4.000 2.809 2.661 3.080 . 0 0 "[ . 1 . 2]" 1
1470 1 101 LEU MD2 1 109 LEU H 4.100 . 4.100 3.103 2.190 3.953 . 0 0 "[ . 1 . 2]" 1
1471 1 102 LEU MD1 1 103 GLU HG2 4.100 . 4.100 2.289 2.101 2.583 . 0 0 "[ . 1 . 2]" 1
1472 1 104 ASP HB2 1 105 LYS H 4.240 . 4.240 4.007 3.803 4.203 . 0 0 "[ . 1 . 2]" 1
1473 1 108 LEU H 1 110 LEU H 4.310 . 4.310 3.588 3.454 3.732 . 0 0 "[ . 1 . 2]" 1
1474 1 108 LEU HB3 1 108 LEU MD1 3.200 . 3.200 2.530 2.512 2.554 . 0 0 "[ . 1 . 2]" 1
1475 1 109 LEU HB3 1 110 LEU H 4.500 . 4.500 3.265 3.088 3.423 . 0 0 "[ . 1 . 2]" 1
1476 1 111 TYR HB2 1 112 SER H 4.290 . 4.290 2.469 2.276 2.625 . 0 0 "[ . 1 . 2]" 1
1477 1 115 CYS QB 1 116 LYS H 3.910 . 3.910 3.156 2.458 3.533 . 0 0 "[ . 1 . 2]" 1
1478 1 116 LYS HG3 1 117 PHE QD 4.390 . 4.390 2.301 1.794 2.840 0.006 1 0 "[ . 1 . 2]" 1
1479 1 117 PHE H 1 117 PHE QD 3.880 . 3.880 3.326 2.695 3.489 . 0 0 "[ . 1 . 2]" 1
1480 1 120 LYS QG 1 121 LYS H 3.660 . 3.660 2.899 1.810 3.852 0.192 4 0 "[ . 1 . 2]" 1
1481 1 30 TYR H 1 31 GLN H 3.650 . 3.650 2.551 2.440 2.680 . 0 0 "[ . 1 . 2]" 1
1482 1 30 TYR HB2 1 31 GLN H 3.710 . 3.710 2.697 2.390 2.970 . 0 0 "[ . 1 . 2]" 1
1483 1 30 TYR QD 1 31 GLN H 4.430 . 4.430 4.364 4.200 4.429 . 0 0 "[ . 1 . 2]" 1
1484 1 31 GLN QB 1 31 GLN HE22 4.410 . 4.410 4.032 3.358 4.433 0.023 4 0 "[ . 1 . 2]" 1
1485 1 32 LEU HB3 1 110 LEU MD2 4.300 . 4.300 4.038 3.685 4.302 0.002 5 0 "[ . 1 . 2]" 1
1486 1 33 LEU HG 1 34 LYS H 4.940 . 4.940 4.535 4.418 4.882 . 0 0 "[ . 1 . 2]" 1
1487 1 33 LEU MD1 1 34 LYS H 4.570 . 4.570 4.599 4.366 4.645 0.075 9 0 "[ . 1 . 2]" 1
1488 1 33 LEU MD1 1 74 ARG HD3 5.500 . 5.500 3.347 2.533 5.129 . 0 0 "[ . 1 . 2]" 1
1489 1 33 LEU MD2 1 41 PHE HZ 5.270 . 5.270 5.227 3.999 5.334 0.064 9 0 "[ . 1 . 2]" 1
1490 1 34 LYS HA 1 36 GLN H 4.640 . 4.640 4.344 3.993 4.533 . 0 0 "[ . 1 . 2]" 1
1491 1 35 ASP H 1 37 GLY H 4.070 . 4.070 3.726 3.575 3.867 . 0 0 "[ . 1 . 2]" 1
1492 1 35 ASP HB2 1 36 GLN H 3.710 . 3.710 3.732 3.252 3.849 0.139 9 0 "[ . 1 . 2]" 1
1493 1 35 ASP HB3 1 36 GLN H 3.710 . 3.710 2.726 2.421 3.718 0.008 1 0 "[ . 1 . 2]" 1
1494 1 36 GLN HA 1 37 GLY H 3.550 . 3.550 3.363 3.253 3.490 . 0 0 "[ . 1 . 2]" 1
1495 1 36 GLN HB2 1 36 GLN HE22 4.700 . 4.700 4.672 4.523 4.748 0.048 4 0 "[ . 1 . 2]" 1
1496 1 36 GLN HB2 1 37 GLY H 3.680 . 3.680 3.181 2.658 3.575 . 0 0 "[ . 1 . 2]" 1
1497 1 36 GLN HB2 1 38 CYS H 3.850 . 3.850 3.520 3.193 3.768 . 0 0 "[ . 1 . 2]" 1
1498 1 36 GLN HG3 1 37 GLY H 4.480 . 4.480 4.299 3.864 4.546 0.066 3 0 "[ . 1 . 2]" 1
1499 1 43 THR HA 1 73 PHE H 3.780 . 3.780 2.871 2.694 3.034 . 0 0 "[ . 1 . 2]" 1
1500 1 44 LYS QE 1 73 PHE QD 4.550 . 4.550 3.965 3.030 4.630 0.080 9 0 "[ . 1 . 2]" 1
1501 1 45 CYS HA 1 46 VAL H 3.390 . 3.390 2.286 2.115 2.690 . 0 0 "[ . 1 . 2]" 1
1502 1 46 VAL H 1 46 VAL QG 3.530 . 3.530 2.076 1.871 2.442 . 0 0 "[ . 1 . 2]" 1
1503 1 46 VAL HB 1 47 ILE H 4.530 . 4.530 4.143 3.964 4.356 . 0 0 "[ . 1 . 2]" 1
1504 1 47 ILE HB 1 68 TYR QE 5.500 . 5.500 5.439 5.300 5.520 0.020 4 0 "[ . 1 . 2]" 1
1505 1 47 ILE MG 1 67 TYR H 4.060 . 4.060 2.973 2.685 3.201 . 0 0 "[ . 1 . 2]" 1
1506 1 48 GLU H 1 48 GLU HG3 3.830 . 3.830 3.025 2.639 3.330 . 0 0 "[ . 1 . 2]" 1
1507 1 58 LEU H 1 58 LEU HG 4.280 . 4.280 3.467 2.911 3.828 . 0 0 "[ . 1 . 2]" 1
1508 1 58 LEU HG 1 62 LEU HA 4.540 . 4.540 4.609 4.148 4.733 0.193 18 0 "[ . 1 . 2]" 1
1509 1 58 LEU MD2 1 62 LEU H 4.770 . 4.770 2.018 1.747 2.520 0.053 18 0 "[ . 1 . 2]" 1
1510 1 61 GLU H 1 62 LEU H 4.210 . 4.210 3.638 1.911 4.296 0.086 7 0 "[ . 1 . 2]" 1
1511 1 64 LEU HA 1 65 THR H 3.510 . 3.510 2.439 2.184 2.738 . 0 0 "[ . 1 . 2]" 1
1512 1 64 LEU HB2 1 65 THR H 4.390 . 4.390 3.180 1.821 4.381 . 0 0 "[ . 1 . 2]" 1
1513 1 65 THR H 1 65 THR HB 3.820 . 3.820 2.708 2.612 2.859 . 0 0 "[ . 1 . 2]" 1
1514 1 67 TYR H 1 67 TYR HB2 4.020 . 4.020 2.592 2.511 2.682 . 0 0 "[ . 1 . 2]" 1
1515 1 68 TYR QD 1 69 GLY H 4.270 . 4.270 4.228 3.899 4.364 0.094 9 0 "[ . 1 . 2]" 1
1516 1 68 TYR QD 1 70 PHE HZ 5.230 . 5.230 4.086 3.529 4.594 . 0 0 "[ . 1 . 2]" 1
1517 1 70 PHE HB3 1 71 SER H 4.140 . 4.140 3.307 3.083 3.666 . 0 0 "[ . 1 . 2]" 1
1518 1 70 PHE QD 1 71 SER H 4.250 . 4.250 3.354 3.079 3.730 . 0 0 "[ . 1 . 2]" 1
1519 1 71 SER HA 1 72 PHE H 3.380 . 3.380 2.270 2.199 2.360 . 0 0 "[ . 1 . 2]" 1
1520 1 71 SER HA 1 81 TYR HA 3.810 . 3.810 2.204 2.073 2.378 . 0 0 "[ . 1 . 2]" 1
1521 1 71 SER HA 1 82 GLY H 4.220 . 4.220 3.321 2.887 3.518 . 0 0 "[ . 1 . 2]" 1
1522 1 71 SER HB3 1 72 PHE H 4.210 . 4.210 3.126 2.601 3.921 . 0 0 "[ . 1 . 2]" 1
1523 1 72 PHE HA 1 73 PHE H 3.210 . 3.210 2.101 2.080 2.116 . 0 0 "[ . 1 . 2]" 1
1524 1 72 PHE QD 1 79 VAL MG1 3.800 . 3.800 3.684 3.324 3.831 0.031 12 0 "[ . 1 . 2]" 1
1525 1 72 PHE QD 1 80 ALA H 4.100 . 4.100 3.788 3.282 4.002 . 0 0 "[ . 1 . 2]" 1
1526 1 73 PHE HA 1 73 PHE QD 4.270 . 4.270 2.900 2.488 3.030 . 0 0 "[ . 1 . 2]" 1
1527 1 73 PHE HA 1 74 ARG H 3.390 . 3.390 2.145 2.122 2.178 . 0 0 "[ . 1 . 2]" 1
1528 1 73 PHE HA 1 79 VAL H 4.030 . 4.030 3.478 3.302 3.625 . 0 0 "[ . 1 . 2]" 1
1529 1 73 PHE HB2 1 74 ARG H 4.280 . 4.280 4.285 4.181 4.363 0.083 11 0 "[ . 1 . 2]" 1
1530 1 73 PHE QD 1 78 ILE MD 3.870 . 3.870 3.107 2.970 3.376 . 0 0 "[ . 1 . 2]" 1
1531 1 73 PHE QD 1 78 ILE MG 5.270 . 5.270 5.198 5.089 5.318 0.048 19 0 "[ . 1 . 2]" 1
1532 1 75 HIS HA 1 76 GLY H 3.550 . 3.550 2.941 2.824 3.051 . 0 0 "[ . 1 . 2]" 1
1533 1 77 ASN H 1 77 ASN HD22 4.040 . 4.040 3.546 3.357 3.761 . 0 0 "[ . 1 . 2]" 1
1534 1 77 ASN HA 1 77 ASN HD21 4.310 . 4.310 4.078 3.969 4.144 . 0 0 "[ . 1 . 2]" 1
1535 1 77 ASN HA 1 77 ASN HD22 4.760 . 4.760 4.598 4.495 4.694 . 0 0 "[ . 1 . 2]" 1
1536 1 78 ILE H 1 78 ILE HG12 3.600 . 3.600 2.979 2.835 3.116 . 0 0 "[ . 1 . 2]" 1
1537 1 78 ILE H 1 78 ILE MD 4.350 . 4.350 3.942 3.811 4.109 . 0 0 "[ . 1 . 2]" 1
1538 1 78 ILE MD 1 81 TYR QE 4.610 . 4.610 4.332 3.309 4.694 0.084 17 0 "[ . 1 . 2]" 1
1539 1 79 VAL MG1 1 109 LEU HA 3.700 . 3.700 2.809 2.503 3.043 . 0 0 "[ . 1 . 2]" 1
1540 1 25 ILE HA 1 28 LYS H 4.330 . 4.330 3.194 3.022 3.355 . 0 0 "[ . 1 . 2]" 1
1541 1 25 ILE HG12 1 99 LEU HB2 4.740 . 4.740 2.723 2.233 3.495 . 0 0 "[ . 1 . 2]" 1
1542 1 25 ILE MD 1 98 LEU MD2 4.030 . 4.030 3.543 3.085 4.143 0.113 16 0 "[ . 1 . 2]" 1
1543 1 80 ALA H 1 81 TYR H 4.600 . 4.600 4.369 4.305 4.439 . 0 0 "[ . 1 . 2]" 1
1544 1 80 ALA MB 1 81 TYR H 3.270 . 3.270 2.886 2.700 3.087 . 0 0 "[ . 1 . 2]" 1
1545 1 80 ALA MB 1 81 TYR HA 5.030 . 5.030 3.871 3.812 3.933 . 0 0 "[ . 1 . 2]" 1
1546 1 80 ALA MB 1 81 TYR HB2 4.880 . 4.880 4.857 4.778 4.933 0.053 6 0 "[ . 1 . 2]" 1
1547 1 80 ALA MB 1 94 MET ME 4.030 . 4.030 4.112 4.050 4.172 0.142 3 0 "[ . 1 . 2]" 1
1548 1 81 TYR H 1 81 TYR HB3 3.770 . 3.770 2.931 2.817 3.063 . 0 0 "[ . 1 . 2]" 1
1549 1 81 TYR HA 1 81 TYR QD 3.520 . 3.520 2.829 2.384 3.091 . 0 0 "[ . 1 . 2]" 1
1550 1 81 TYR HA 1 82 GLY H 3.410 . 3.410 2.155 2.117 2.215 . 0 0 "[ . 1 . 2]" 1
1551 1 81 TYR HB2 1 82 GLY H 4.340 . 4.340 4.239 4.088 4.387 0.047 4 0 "[ . 1 . 2]" 1
1552 1 81 TYR QE 1 83 LYS HG2 5.500 . 5.500 4.606 2.646 5.283 . 0 0 "[ . 1 . 2]" 1
1553 1 82 GLY H 1 83 LYS H 4.230 . 4.230 3.740 3.586 4.019 . 0 0 "[ . 1 . 2]" 1
1554 1 82 GLY HA2 1 83 LYS H 3.330 . 3.330 2.198 2.144 2.248 . 0 0 "[ . 1 . 2]" 1
1555 1 82 GLY HA3 1 83 LYS H 3.470 . 3.470 3.420 3.335 3.474 0.004 6 0 "[ . 1 . 2]" 1
1556 1 83 LYS HG3 1 84 SER H 4.450 . 4.450 3.196 2.558 3.890 . 0 0 "[ . 1 . 2]" 1
1557 1 83 LYS QB 1 84 SER H 4.210 . 4.210 3.707 2.675 3.868 . 0 0 "[ . 1 . 2]" 1
1558 1 84 SER H 1 90 ALA MB 3.410 . 3.410 2.331 2.104 2.520 . 0 0 "[ . 1 . 2]" 1
1559 1 86 LYS H 1 90 ALA H 4.470 . 4.470 4.142 3.696 4.337 . 0 0 "[ . 1 . 2]" 1
1560 1 87 VAL H 1 88 ALA MB 4.420 . 4.420 4.439 4.372 4.492 0.072 2 0 "[ . 1 . 2]" 1
1561 1 88 ALA MB 1 89 ASN H 3.230 . 3.230 2.610 2.347 2.843 . 0 0 "[ . 1 . 2]" 1
1562 1 88 ALA MB 1 92 TYR H 4.700 . 4.700 4.600 4.366 4.761 0.061 18 0 "[ . 1 . 2]" 1
1563 1 89 ASN H 1 89 ASN HB2 3.530 . 3.530 2.469 2.335 2.657 . 0 0 "[ . 1 . 2]" 1
1564 1 89 ASN HA 1 92 TYR H 3.760 . 3.760 3.339 3.150 3.518 . 0 0 "[ . 1 . 2]" 1
1565 1 26 GLU HA 1 29 VAL H 4.280 . 4.280 3.462 3.191 3.661 . 0 0 "[ . 1 . 2]" 1
1566 1 90 ALA HA 1 93 ILE H 4.320 . 4.320 3.645 3.488 3.781 . 0 0 "[ . 1 . 2]" 1
1567 1 90 ALA MB 1 91 LYS H 3.340 . 3.340 2.324 2.229 2.407 . 0 0 "[ . 1 . 2]" 1
1568 1 91 LYS H 1 91 LYS HG2 4.720 . 4.720 3.865 3.252 4.534 . 0 0 "[ . 1 . 2]" 1
1569 1 91 LYS H 1 91 LYS QD 4.390 . 4.390 4.162 3.336 4.386 . 0 0 "[ . 1 . 2]" 1
1570 1 91 LYS H 1 92 TYR H 3.590 . 3.590 2.675 2.563 2.780 . 0 0 "[ . 1 . 2]" 1
1571 1 91 LYS HB3 1 92 TYR H 4.050 . 4.050 3.118 2.398 3.660 . 0 0 "[ . 1 . 2]" 1
1572 1 92 TYR QD 1 93 ILE MD 3.830 . 3.830 3.742 3.398 3.892 0.062 15 0 "[ . 1 . 2]" 1
1573 1 93 ILE H 1 93 ILE QG 3.510 . 3.510 1.988 1.885 2.053 . 0 0 "[ . 1 . 2]" 1
1574 1 95 LYS HA 1 95 LYS QE 5.110 . 5.110 4.788 4.468 4.910 . 0 0 "[ . 1 . 2]" 1
1575 1 95 LYS HA 1 98 LEU HG 5.050 . 5.050 4.878 4.567 5.088 0.038 18 0 "[ . 1 . 2]" 1
1576 1 97 ARG H 1 98 LEU H 3.390 . 3.390 2.955 2.851 3.043 . 0 0 "[ . 1 . 2]" 1
1577 1 97 ARG HG3 1 98 LEU H 4.480 . 4.480 4.503 4.342 4.565 0.085 2 0 "[ . 1 . 2]" 1
1578 1 97 ARG QB 1 98 LEU H 3.570 . 3.570 2.109 2.054 2.170 . 0 0 "[ . 1 . 2]" 1
1579 1 98 LEU H 1 98 LEU HB3 4.070 . 4.070 3.590 3.481 3.645 . 0 0 "[ . 1 . 2]" 1
1580 1 98 LEU HA 1 101 LEU H 4.050 . 4.050 3.097 2.953 3.321 . 0 0 "[ . 1 . 2]" 1
1581 1 98 LEU MD2 1 99 LEU H 4.830 . 4.830 4.828 4.660 4.862 0.032 7 0 "[ . 1 . 2]" 1
1582 1 101 LEU HB3 1 102 LEU H 4.000 . 4.000 3.562 3.146 3.790 . 0 0 "[ . 1 . 2]" 1
1583 1 102 LEU H 1 102 LEU HB3 3.760 . 3.760 2.888 2.835 2.972 . 0 0 "[ . 1 . 2]" 1
1584 1 102 LEU H 1 102 LEU HG 3.520 . 3.520 1.860 1.783 1.962 0.017 14 0 "[ . 1 . 2]" 1
1585 1 102 LEU H 1 103 GLU H 3.670 . 3.670 2.408 2.326 2.487 . 0 0 "[ . 1 . 2]" 1
1586 1 103 GLU H 1 103 GLU HG3 4.000 . 4.000 3.714 3.581 3.928 . 0 0 "[ . 1 . 2]" 1
1587 1 103 GLU HG2 1 104 ASP H 4.730 . 4.730 4.402 4.289 4.549 . 0 0 "[ . 1 . 2]" 1
1588 1 104 ASP HB3 1 105 LYS H 4.240 . 4.240 3.188 3.082 3.323 . 0 0 "[ . 1 . 2]" 1
1589 1 105 LYS H 1 105 LYS HD2 4.440 . 4.440 3.736 2.741 4.519 0.079 13 0 "[ . 1 . 2]" 1
1590 1 105 LYS H 1 106 SER H 3.240 . 3.240 2.612 2.482 2.781 . 0 0 "[ . 1 . 2]" 1
1591 1 107 ASN HA 1 110 LEU H 3.950 . 3.950 2.859 2.684 3.039 . 0 0 "[ . 1 . 2]" 1
1592 1 107 ASN HA 1 111 TYR H 3.860 . 3.860 3.637 3.422 3.862 0.002 12 0 "[ . 1 . 2]" 1
1593 1 108 LEU H 1 108 LEU HB2 3.670 . 3.670 2.452 2.426 2.483 . 0 0 "[ . 1 . 2]" 1
1594 1 108 LEU H 1 110 LEU MD1 4.660 . 4.660 4.628 4.456 4.722 0.062 11 0 "[ . 1 . 2]" 1
1595 1 108 LEU HB3 1 109 LEU H 4.080 . 4.080 3.627 3.509 3.732 . 0 0 "[ . 1 . 2]" 1
1596 1 108 LEU HG 1 109 LEU H 5.150 . 5.150 5.181 5.096 5.250 0.100 3 0 "[ . 1 . 2]" 1
1597 1 28 LYS HB3 1 28 LYS QD 3.730 . 3.730 2.449 2.387 2.528 . 0 0 "[ . 1 . 2]" 1
1598 1 110 LEU H 1 110 LEU HB3 3.990 . 3.990 3.696 3.648 3.752 . 0 0 "[ . 1 . 2]" 1
1599 1 110 LEU H 1 110 LEU MD2 4.240 . 4.240 3.613 3.481 3.706 . 0 0 "[ . 1 . 2]" 1
1600 1 110 LEU H 1 111 TYR H 3.800 . 3.800 2.583 2.434 2.721 . 0 0 "[ . 1 . 2]" 1
1601 1 110 LEU HA 1 110 LEU MD1 4.110 . 4.110 3.937 3.911 3.978 . 0 0 "[ . 1 . 2]" 1
1602 1 110 LEU HB2 1 111 TYR H 4.810 . 4.810 3.918 3.803 3.991 . 0 0 "[ . 1 . 2]" 1
1603 1 111 TYR H 1 112 SER H 4.640 . 4.640 4.613 4.594 4.626 . 0 0 "[ . 1 . 2]" 1
1604 1 111 TYR QD 1 112 SER H 4.150 . 4.150 3.149 3.006 3.221 . 0 0 "[ . 1 . 2]" 1
1605 1 111 TYR QE 1 113 CYS H 5.220 . 5.220 4.920 4.644 5.126 . 0 0 "[ . 1 . 2]" 1
1606 1 113 CYS H 1 113 CYS HB2 3.980 . 3.980 3.877 3.808 3.946 . 0 0 "[ . 1 . 2]" 1
1607 1 113 CYS H 1 113 CYS HB3 3.980 . 3.980 3.083 2.950 3.228 . 0 0 "[ . 1 . 2]" 1
1608 1 113 CYS HA 1 115 CYS H 4.990 . 4.990 4.981 4.686 5.096 0.106 10 0 "[ . 1 . 2]" 1
1609 1 114 ASN HA 1 115 CYS H 3.520 . 3.520 2.562 2.351 2.960 . 0 0 "[ . 1 . 2]" 1
1610 1 116 LYS H 1 116 LYS HG3 4.050 . 4.050 3.191 2.949 3.377 . 0 0 "[ . 1 . 2]" 1
1611 1 116 LYS QE 1 117 PHE QE 3.530 . 3.530 1.860 1.789 1.918 0.011 1 0 "[ . 1 . 2]" 1
1612 1 29 VAL MG1 1 30 TYR H 4.170 . 4.170 2.799 2.067 3.563 . 0 0 "[ . 1 . 2]" 1
1613 1 30 TYR H 1 30 TYR HB3 3.870 . 3.870 3.620 3.561 3.648 . 0 0 "[ . 1 . 2]" 1
1614 1 30 TYR HB3 1 31 GLN H 4.280 . 4.280 3.726 3.401 3.989 . 0 0 "[ . 1 . 2]" 1
1615 1 31 GLN H 1 31 GLN QB 3.070 . 3.070 2.350 2.202 2.457 . 0 0 "[ . 1 . 2]" 1
1616 1 31 GLN HE22 1 31 GLN HG3 4.060 . 4.060 3.955 3.516 4.060 . 0 0 "[ . 1 . 2]" 1
1617 1 32 LEU H 1 32 LEU HG 3.120 . 3.120 1.741 1.691 1.817 0.109 6 0 "[ . 1 . 2]" 1
1618 1 32 LEU HA 1 35 ASP H 3.790 . 3.790 3.457 3.274 3.621 . 0 0 "[ . 1 . 2]" 1
1619 1 32 LEU MD1 1 33 LEU HB3 4.730 . 4.730 4.198 4.114 4.286 . 0 0 "[ . 1 . 2]" 1
1620 1 33 LEU HA 1 36 GLN H 3.770 . 3.770 3.271 3.124 3.385 . 0 0 "[ . 1 . 2]" 1
1621 1 33 LEU HB2 1 34 LYS H 4.200 . 4.200 2.626 2.558 2.927 . 0 0 "[ . 1 . 2]" 1
1622 1 33 LEU MD2 1 41 PHE QE 4.290 . 4.290 4.214 3.070 4.330 0.040 6 0 "[ . 1 . 2]" 1
1623 1 34 LYS H 1 34 LYS HG2 3.890 . 3.890 2.790 2.362 3.590 . 0 0 "[ . 1 . 2]" 1
1624 1 34 LYS H 1 34 LYS QB 3.200 . 3.200 2.380 2.256 2.456 . 0 0 "[ . 1 . 2]" 1
1625 1 34 LYS H 1 35 ASP H 3.330 . 3.330 2.558 2.500 2.613 . 0 0 "[ . 1 . 2]" 1
1626 1 35 ASP H 1 36 GLN H 3.390 . 3.390 2.447 2.273 2.588 . 0 0 "[ . 1 . 2]" 1
1627 1 36 GLN H 1 38 CYS H 3.880 . 3.880 3.748 3.402 3.923 0.043 13 0 "[ . 1 . 2]" 1
1628 1 36 GLN HE22 1 110 LEU MD2 4.020 . 4.020 2.905 2.112 3.563 . 0 0 "[ . 1 . 2]" 1
1629 1 37 GLY HA2 1 38 CYS H 3.600 . 3.600 2.920 2.819 3.026 . 0 0 "[ . 1 . 2]" 1
1630 1 38 CYS HA 1 40 ASP H 4.290 . 4.290 3.479 3.283 4.340 0.050 7 0 "[ . 1 . 2]" 1
1631 1 40 ASP H 1 40 ASP HB2 3.970 . 3.970 2.792 2.536 3.352 . 0 0 "[ . 1 . 2]" 1
1632 1 43 THR HB 1 73 PHE H 5.500 . 5.500 5.406 5.198 5.554 0.054 18 0 "[ . 1 . 2]" 1
1633 1 44 LYS HB2 1 44 LYS QE 4.510 . 4.510 3.707 1.780 4.093 0.020 19 0 "[ . 1 . 2]" 1
1634 1 47 ILE H 1 47 ILE HB 3.990 . 3.990 2.431 2.400 2.514 . 0 0 "[ . 1 . 2]" 1
1635 1 47 ILE HB 1 48 GLU H 4.280 . 4.280 4.227 4.147 4.261 . 0 0 "[ . 1 . 2]" 1
1636 1 47 ILE MG 1 48 GLU H 3.310 . 3.310 2.628 2.523 2.696 . 0 0 "[ . 1 . 2]" 1
1637 1 48 GLU H 1 48 GLU HB3 3.900 . 3.900 3.710 3.629 3.796 . 0 0 "[ . 1 . 2]" 1
1638 1 48 GLU H 1 48 GLU HB2 3.590 . 3.590 2.542 2.418 2.678 . 0 0 "[ . 1 . 2]" 1
1639 1 48 GLU H 1 67 TYR H 3.810 . 3.810 3.200 2.993 3.463 . 0 0 "[ . 1 . 2]" 1
1640 1 57 LEU H 1 58 LEU QB 4.970 . 4.970 4.374 3.778 4.906 . 0 0 "[ . 1 . 2]" 1
1641 1 59 ASN HB2 1 59 ASN HD22 4.040 . 4.040 3.799 3.470 4.057 0.017 1 0 "[ . 1 . 2]" 1
1642 1 61 GLU H 1 61 GLU HB2 4.090 . 4.090 2.962 2.218 3.689 . 0 0 "[ . 1 . 2]" 1
1643 1 61 GLU H 1 61 GLU HB3 4.090 . 4.090 3.409 2.660 4.027 . 0 0 "[ . 1 . 2]" 1
1644 1 61 GLU HA 1 61 GLU HG2 4.010 . 4.010 3.306 2.572 4.170 0.160 11 0 "[ . 1 . 2]" 1
1645 1 61 GLU HB3 1 62 LEU H 4.690 . 4.690 4.210 3.838 4.633 . 0 0 "[ . 1 . 2]" 1
1646 1 65 THR H 1 65 THR MG 3.970 . 3.970 3.739 3.671 3.785 . 0 0 "[ . 1 . 2]" 1
1647 1 65 THR HB 1 66 LYS H 4.170 . 4.170 4.272 4.194 4.318 0.148 1 0 "[ . 1 . 2]" 1
1648 1 66 LYS H 1 67 TYR H 4.680 . 4.680 4.481 4.436 4.524 . 0 0 "[ . 1 . 2]" 1
1649 1 66 LYS HG2 1 67 TYR H 3.670 . 3.670 2.899 2.787 2.974 . 0 0 "[ . 1 . 2]" 1
1650 1 66 LYS HG3 1 67 TYR H 4.350 . 4.350 4.230 4.083 4.337 . 0 0 "[ . 1 . 2]" 1
1651 1 67 TYR QD 1 83 LYS HG3 4.220 . 4.220 3.538 2.017 4.236 0.016 6 0 "[ . 1 . 2]" 1
1652 1 68 TYR H 1 69 GLY H 4.540 . 4.540 4.316 4.239 4.390 . 0 0 "[ . 1 . 2]" 1
1653 1 68 TYR QE 1 87 VAL MG2 4.230 . 4.230 2.900 2.158 3.393 . 0 0 "[ . 1 . 2]" 1
1654 1 70 PHE HB3 1 90 ALA MB 4.680 . 4.680 3.644 3.373 3.962 . 0 0 "[ . 1 . 2]" 1
1655 1 70 PHE HZ 1 87 VAL MG2 4.910 . 4.910 2.352 2.031 2.648 . 0 0 "[ . 1 . 2]" 1
1656 1 72 PHE H 1 72 PHE HB2 3.970 . 3.970 2.872 2.808 2.976 . 0 0 "[ . 1 . 2]" 1
1657 1 72 PHE H 1 72 PHE HB3 3.770 . 3.770 2.693 2.528 2.766 . 0 0 "[ . 1 . 2]" 1
1658 1 72 PHE H 1 80 ALA MB 4.130 . 4.130 2.497 2.239 2.711 . 0 0 "[ . 1 . 2]" 1
1659 1 72 PHE HA 1 98 LEU MD1 5.500 . 5.500 5.008 4.817 5.509 0.009 2 0 "[ . 1 . 2]" 1
1660 1 72 PHE HA 1 98 LEU MD2 5.500 . 5.500 4.378 4.231 4.581 . 0 0 "[ . 1 . 2]" 1
1661 1 72 PHE HB2 1 73 PHE H 4.370 . 4.370 4.284 4.200 4.352 . 0 0 "[ . 1 . 2]" 1
1662 1 72 PHE HB2 1 80 ALA H 4.450 . 4.450 3.816 3.705 3.951 . 0 0 "[ . 1 . 2]" 1
1663 1 72 PHE HB3 1 80 ALA H 3.860 . 3.860 2.389 2.222 2.553 . 0 0 "[ . 1 . 2]" 1
1664 1 72 PHE QD 1 73 PHE H 3.880 . 3.880 3.479 3.336 3.630 . 0 0 "[ . 1 . 2]" 1
1665 1 72 PHE QD 1 79 VAL H 4.350 . 4.350 3.456 2.880 3.622 . 0 0 "[ . 1 . 2]" 1
1666 1 73 PHE H 1 73 PHE HB2 4.020 . 4.020 2.224 2.184 2.283 . 0 0 "[ . 1 . 2]" 1
1667 1 73 PHE H 1 73 PHE HB3 4.020 . 4.020 3.426 3.331 3.523 . 0 0 "[ . 1 . 2]" 1
1668 1 73 PHE QE 1 77 ASN HA 5.500 . 5.500 4.194 3.557 4.597 . 0 0 "[ . 1 . 2]" 1
1669 1 74 ARG H 1 79 VAL H 4.440 . 4.440 3.953 3.652 4.160 . 0 0 "[ . 1 . 2]" 1
1670 1 74 ARG H 1 79 VAL MG2 4.140 . 4.140 3.457 2.879 3.876 . 0 0 "[ . 1 . 2]" 1
1671 1 77 ASN H 1 77 ASN HD21 3.930 . 3.930 2.448 2.301 2.699 . 0 0 "[ . 1 . 2]" 1
1672 1 77 ASN H 1 78 ILE H 4.510 . 4.510 4.486 4.437 4.515 0.005 7 0 "[ . 1 . 2]" 1
1673 1 77 ASN HD21 1 78 ILE H 5.020 . 5.020 5.136 5.066 5.235 0.215 18 0 "[ . 1 . 2]" 1
1674 1 78 ILE MD 1 80 ALA H 4.200 . 4.200 3.971 3.816 4.162 . 0 0 "[ . 1 . 2]" 1
1675 1 78 ILE MD 1 81 TYR HA 4.590 . 4.590 4.379 4.074 4.632 0.042 13 0 "[ . 1 . 2]" 1
1676 1 78 ILE MG 1 80 ALA H 3.210 . 3.210 2.802 2.679 2.936 . 0 0 "[ . 1 . 2]" 1
1677 1 78 ILE MG 1 81 TYR H 4.380 . 4.380 3.899 3.635 4.115 . 0 0 "[ . 1 . 2]" 1
1678 1 79 VAL H 1 80 ALA H 3.300 . 3.300 2.188 2.099 2.281 . 0 0 "[ . 1 . 2]" 1
1679 1 79 VAL H 1 80 ALA MB 4.420 . 4.420 4.280 4.180 4.345 . 0 0 "[ . 1 . 2]" 1
1680 1 79 VAL MG2 1 80 ALA H 4.070 . 4.070 3.882 3.820 3.941 . 0 0 "[ . 1 . 2]" 1
1681 1 25 ILE MG 1 95 LYS H 4.840 . 4.840 4.059 3.840 4.282 . 0 0 "[ . 1 . 2]" 1
1682 1 81 TYR H 1 81 TYR QD 4.670 . 4.670 4.428 4.384 4.482 . 0 0 "[ . 1 . 2]" 1
1683 1 81 TYR HA 1 81 TYR QE 4.870 . 4.870 4.551 4.381 4.665 . 0 0 "[ . 1 . 2]" 1
1684 1 81 TYR HB3 1 82 GLY H 4.210 . 4.210 4.024 3.883 4.156 . 0 0 "[ . 1 . 2]" 1
1685 1 83 LYS H 1 83 LYS QD 4.650 . 4.650 4.703 4.116 4.891 0.241 5 0 "[ . 1 . 2]" 1
1686 1 83 LYS H 1 90 ALA HA 5.060 . 5.060 4.592 4.282 5.025 . 0 0 "[ . 1 . 2]" 1
1687 1 83 LYS H 1 93 ILE MG 4.120 . 4.120 3.816 3.422 4.133 0.013 5 0 "[ . 1 . 2]" 1
1688 1 86 LYS H 1 89 ASN H 4.870 . 4.870 4.483 4.290 4.643 . 0 0 "[ . 1 . 2]" 1
1689 1 87 VAL H 1 87 VAL HB 3.680 . 3.680 2.577 2.497 2.678 . 0 0 "[ . 1 . 2]" 1
1690 1 87 VAL H 1 88 ALA H 3.780 . 3.780 2.782 2.727 2.891 . 0 0 "[ . 1 . 2]" 1
1691 1 87 VAL H 1 89 ASN H 5.290 . 5.290 4.279 4.068 4.570 . 0 0 "[ . 1 . 2]" 1
1692 1 87 VAL HB 1 88 ALA H 3.980 . 3.980 3.949 3.884 4.008 0.028 18 0 "[ . 1 . 2]" 1
1693 1 88 ALA H 1 89 ASN H 3.510 . 3.510 2.672 2.479 2.857 . 0 0 "[ . 1 . 2]" 1
1694 1 88 ALA HA 1 91 LYS H 4.140 . 4.140 3.677 3.288 3.900 . 0 0 "[ . 1 . 2]" 1
1695 1 88 ALA MB 1 90 ALA H 4.670 . 4.670 4.612 4.438 4.723 0.053 15 0 "[ . 1 . 2]" 1
1696 1 89 ASN H 1 90 ALA H 3.480 . 3.480 2.540 2.365 2.645 . 0 0 "[ . 1 . 2]" 1
1697 1 89 ASN HB3 1 90 ALA H 3.870 . 3.870 2.472 2.345 2.622 . 0 0 "[ . 1 . 2]" 1
1698 1 89 ASN HB2 1 90 ALA H 3.920 . 3.920 3.678 3.565 3.792 . 0 0 "[ . 1 . 2]" 1
1699 1 90 ALA H 1 90 ALA MB 3.090 . 3.090 2.202 2.180 2.224 . 0 0 "[ . 1 . 2]" 1
1700 1 90 ALA H 1 91 LYS H 3.600 . 3.600 2.763 2.636 2.846 . 0 0 "[ . 1 . 2]" 1
1701 1 91 LYS H 1 91 LYS HG3 4.720 . 4.720 2.986 2.149 4.237 . 0 0 "[ . 1 . 2]" 1
1702 1 92 TYR H 1 93 ILE H 3.670 . 3.670 2.790 2.746 2.840 . 0 0 "[ . 1 . 2]" 1
1703 1 92 TYR QB 1 93 ILE H 3.560 . 3.560 2.528 2.468 2.621 . 0 0 "[ . 1 . 2]" 1
1704 1 93 ILE H 1 93 ILE HB 3.540 . 3.540 2.527 2.491 2.594 . 0 0 "[ . 1 . 2]" 1
1705 1 93 ILE H 1 93 ILE MG 3.920 . 3.920 3.750 3.740 3.759 . 0 0 "[ . 1 . 2]" 1
1706 1 93 ILE H 1 94 MET H 3.890 . 3.890 2.845 2.737 2.918 . 0 0 "[ . 1 . 2]" 1
1707 1 95 LYS H 1 95 LYS HB3 4.150 . 4.150 3.563 3.461 3.584 . 0 0 "[ . 1 . 2]" 1
1708 1 95 LYS H 1 96 GLN H 3.620 . 3.620 2.785 2.715 2.837 . 0 0 "[ . 1 . 2]" 1
1709 1 97 ARG H 1 97 ARG HD3 4.840 . 4.840 4.196 3.112 4.762 . 0 0 "[ . 1 . 2]" 1
1710 1 98 LEU H 1 98 LEU HG 4.030 . 4.030 2.181 1.975 2.451 . 0 0 "[ . 1 . 2]" 1
1711 1 99 LEU H 1 100 LYS H 3.610 . 3.610 2.871 2.793 2.971 . 0 0 "[ . 1 . 2]" 1
1712 1 100 LYS H 1 101 LEU H 3.550 . 3.550 2.570 2.457 2.728 . 0 0 "[ . 1 . 2]" 1
1713 1 101 LEU H 1 101 LEU HB3 3.680 . 3.680 3.541 3.404 3.609 . 0 0 "[ . 1 . 2]" 1
1714 1 101 LEU H 1 102 LEU H 3.450 . 3.450 2.618 2.541 2.712 . 0 0 "[ . 1 . 2]" 1
1715 1 101 LEU MD1 1 106 SER H 5.500 . 5.500 4.804 3.558 5.411 . 0 0 "[ . 1 . 2]" 1
1716 1 102 LEU HG 1 103 GLU H 3.880 . 3.880 2.592 2.342 2.788 . 0 0 "[ . 1 . 2]" 1
1717 1 104 ASP HB3 1 106 SER H 4.700 . 4.700 3.106 2.720 3.489 . 0 0 "[ . 1 . 2]" 1
1718 1 105 LYS H 1 105 LYS HG2 3.550 . 3.550 2.910 2.831 3.018 . 0 0 "[ . 1 . 2]" 1
1719 1 108 LEU H 1 108 LEU HB3 3.670 . 3.670 3.603 3.595 3.611 . 0 0 "[ . 1 . 2]" 1
1720 1 108 LEU H 1 108 LEU HG 3.970 . 3.970 3.932 3.890 3.984 0.014 15 0 "[ . 1 . 2]" 1
1721 1 108 LEU H 1 108 LEU MD1 3.370 . 3.370 3.038 2.950 3.118 . 0 0 "[ . 1 . 2]" 1
1722 1 108 LEU H 1 109 LEU H 3.590 . 3.590 2.721 2.595 2.820 . 0 0 "[ . 1 . 2]" 1
1723 1 109 LEU H 1 109 LEU HB3 3.500 . 3.500 2.446 2.352 2.543 . 0 0 "[ . 1 . 2]" 1
1724 1 109 LEU H 1 109 LEU HB2 3.830 . 3.830 3.066 2.992 3.144 . 0 0 "[ . 1 . 2]" 1
1725 1 109 LEU H 1 110 LEU H 3.380 . 3.380 2.045 1.938 2.217 . 0 0 "[ . 1 . 2]" 1
1726 1 28 LYS H 1 28 LYS HB2 3.750 . 3.750 2.804 2.708 2.939 . 0 0 "[ . 1 . 2]" 1
1727 1 28 LYS H 1 28 LYS HB3 3.750 . 3.750 3.588 3.556 3.619 . 0 0 "[ . 1 . 2]" 1
1728 1 28 LYS H 1 28 LYS HG3 4.340 . 4.340 3.492 3.399 3.580 . 0 0 "[ . 1 . 2]" 1
1729 1 110 LEU H 1 110 LEU HB2 3.990 . 3.990 2.640 2.577 2.713 . 0 0 "[ . 1 . 2]" 1
1730 1 112 SER H 1 112 SER HB2 4.130 . 4.130 2.702 2.428 3.624 . 0 0 "[ . 1 . 2]" 1
1731 1 114 ASN QB 1 114 ASN HD22 3.580 . 3.580 3.315 3.213 3.479 . 0 0 "[ . 1 . 2]" 1
1732 1 116 LYS H 1 116 LYS HB3 3.810 . 3.810 3.420 3.065 3.630 . 0 0 "[ . 1 . 2]" 1
1733 1 116 LYS H 1 116 LYS HB2 3.910 . 3.910 3.886 3.704 3.967 0.057 6 0 "[ . 1 . 2]" 1
1734 1 116 LYS H 1 116 LYS HG2 4.050 . 4.050 2.496 1.961 2.768 . 0 0 "[ . 1 . 2]" 1
1735 1 116 LYS H 1 117 PHE H 3.980 . 3.980 2.001 1.785 2.324 0.015 18 0 "[ . 1 . 2]" 1
1736 1 116 LYS HB3 1 117 PHE H 3.940 . 3.940 3.908 3.815 3.993 0.053 9 0 "[ . 1 . 2]" 1
1737 1 116 LYS HB2 1 116 LYS QE 3.200 . 3.200 2.079 1.887 2.958 . 0 0 "[ . 1 . 2]" 1
1738 1 116 LYS HB2 1 117 PHE H 3.780 . 3.780 3.526 3.281 3.741 . 0 0 "[ . 1 . 2]" 1
1739 1 116 LYS HG2 1 117 PHE H 4.150 . 4.150 2.575 2.454 2.800 . 0 0 "[ . 1 . 2]" 1
1740 1 116 LYS HG3 1 117 PHE H 4.150 . 4.150 2.061 1.801 2.327 . 0 0 "[ . 1 . 2]" 1
1741 1 117 PHE H 1 117 PHE HB2 4.180 . 4.180 4.004 3.886 4.072 . 0 0 "[ . 1 . 2]" 1
1742 1 118 SER HA 1 118 SER QB 2.550 . 2.550 2.224 2.170 2.368 . 0 0 "[ . 1 . 2]" 1
1743 1 29 VAL MG2 1 30 TYR H 4.170 . 4.170 3.692 3.432 3.857 . 0 0 "[ . 1 . 2]" 1
1744 1 24 ASP QB 1 25 ILE MG 5.110 . 5.110 4.800 3.935 5.377 0.267 14 0 "[ . 1 . 2]" 1
1745 1 24 ASP QB 1 27 HIS QB 4.040 . 4.040 3.064 2.165 4.108 0.068 12 0 "[ . 1 . 2]" 1
1746 1 25 ILE HA 1 25 ILE QG 3.660 . 3.660 2.493 2.299 2.942 . 0 0 "[ . 1 . 2]" 1
1747 1 25 ILE HA 1 28 LYS QB 3.620 . 3.620 2.989 2.817 3.178 . 0 0 "[ . 1 . 2]" 1
1748 1 25 ILE HA 1 29 VAL QG 4.780 . 4.780 4.294 3.748 4.769 . 0 0 "[ . 1 . 2]" 1
1749 1 25 ILE HB 1 98 LEU QD 5.440 . 5.440 3.941 3.503 4.216 . 0 0 "[ . 1 . 2]" 1
1750 1 25 ILE QG 1 25 ILE MG 2.870 . 2.870 2.220 2.064 2.313 . 0 0 "[ . 1 . 2]" 1
1751 1 25 ILE MG 1 29 VAL QG 3.140 . 3.140 2.954 2.590 3.195 0.055 18 0 "[ . 1 . 2]" 1
1752 1 25 ILE MG 1 98 LEU QD 2.810 . 2.810 2.048 1.841 2.534 . 0 0 "[ . 1 . 2]" 1
1753 1 25 ILE QG 1 28 LYS QG 4.900 . 4.900 3.429 2.979 3.991 . 0 0 "[ . 1 . 2]" 1
1754 1 25 ILE QG 1 95 LYS HA 3.700 . 3.700 2.691 2.386 2.949 . 0 0 "[ . 1 . 2]" 1
1755 1 25 ILE QG 1 95 LYS HB2 4.890 . 4.890 4.399 4.005 4.906 0.016 1 0 "[ . 1 . 2]" 1
1756 1 25 ILE QG 1 98 LEU QB 4.330 . 4.330 2.998 1.940 3.471 . 0 0 "[ . 1 . 2]" 1
1757 1 25 ILE QG 1 98 LEU HG 5.340 . 5.340 4.913 4.015 5.378 0.038 19 0 "[ . 1 . 2]" 1
1758 1 25 ILE QG 1 98 LEU QD 3.220 . 3.220 2.590 1.850 3.051 . 0 0 "[ . 1 . 2]" 1
1759 1 25 ILE QG 1 99 LEU H 4.040 . 4.040 2.765 2.569 2.994 . 0 0 "[ . 1 . 2]" 1
1760 1 25 ILE QG 1 99 LEU HA 3.890 . 3.890 3.182 2.754 3.665 . 0 0 "[ . 1 . 2]" 1
1761 1 25 ILE QG 1 99 LEU HB2 3.990 . 3.990 2.430 1.922 3.410 . 0 0 "[ . 1 . 2]" 1
1762 1 25 ILE QG 1 99 LEU HB3 4.310 . 4.310 3.789 3.360 4.377 0.067 16 0 "[ . 1 . 2]" 1
1763 1 25 ILE QG 1 102 LEU MD2 4.170 . 4.170 3.240 3.082 3.401 . 0 0 "[ . 1 . 2]" 1
1764 1 25 ILE MD 1 28 LYS QB 2.890 . 2.890 2.078 1.941 2.258 . 0 0 "[ . 1 . 2]" 1
1765 1 25 ILE MD 1 28 LYS QG 3.100 . 3.100 2.495 2.012 2.775 . 0 0 "[ . 1 . 2]" 1
1766 1 25 ILE MD 1 29 VAL QG 5.440 . 5.440 3.015 2.157 4.002 . 0 0 "[ . 1 . 2]" 1
1767 1 25 ILE MD 1 98 LEU QB 3.550 . 3.550 2.098 1.829 2.757 . 0 0 "[ . 1 . 2]" 1
1768 1 25 ILE MD 1 98 LEU QD 3.170 . 3.170 2.497 1.955 3.246 0.076 7 0 "[ . 1 . 2]" 1
1769 1 26 GLU H 1 26 GLU QB 3.610 . 3.610 2.420 2.249 2.620 . 0 0 "[ . 1 . 2]" 1
1770 1 26 GLU HA 1 29 VAL QG 3.530 . 3.530 2.315 1.799 2.918 0.001 10 0 "[ . 1 . 2]" 1
1771 1 26 GLU HA 1 98 LEU QD 4.390 . 4.390 4.036 3.781 4.171 . 0 0 "[ . 1 . 2]" 1
1772 1 26 GLU QB 1 27 HIS H 4.050 . 4.050 2.610 2.440 2.838 . 0 0 "[ . 1 . 2]" 1
1773 1 26 GLU QB 1 30 TYR QD 4.170 . 4.170 4.076 3.404 4.295 0.125 10 0 "[ . 1 . 2]" 1
1774 1 26 GLU QB 1 30 TYR QE 3.930 . 3.930 3.195 2.833 3.622 . 0 0 "[ . 1 . 2]" 1
1775 1 26 GLU QG 1 29 VAL QG 4.630 . 4.630 3.654 3.162 4.212 . 0 0 "[ . 1 . 2]" 1
1776 1 27 HIS QB 1 27 HIS HD2 3.460 . 3.460 2.939 2.614 3.285 . 0 0 "[ . 1 . 2]" 1
1777 1 27 HIS QB 1 28 LYS H 3.800 . 3.800 2.547 2.308 2.725 . 0 0 "[ . 1 . 2]" 1
1778 1 27 HIS QB 1 31 GLN QB 5.180 . 5.180 5.010 4.638 5.319 0.139 7 0 "[ . 1 . 2]" 1
1779 1 28 LYS H 1 28 LYS QB 3.290 . 3.290 2.709 2.633 2.811 . 0 0 "[ . 1 . 2]" 1
1780 1 28 LYS H 1 28 LYS QG 3.810 . 3.810 1.905 1.790 2.043 0.010 7 0 "[ . 1 . 2]" 1
1781 1 28 LYS H 1 29 VAL QG 4.330 . 4.330 3.920 3.726 4.132 . 0 0 "[ . 1 . 2]" 1
1782 1 28 LYS HA 1 28 LYS QG 3.440 . 3.440 3.193 3.143 3.278 . 0 0 "[ . 1 . 2]" 1
1783 1 28 LYS HA 1 29 VAL QG 5.330 . 5.330 4.796 4.738 4.878 . 0 0 "[ . 1 . 2]" 1
1784 1 28 LYS QB 1 28 LYS QD 3.190 . 3.190 2.387 2.335 2.453 . 0 0 "[ . 1 . 2]" 1
1785 1 28 LYS QB 1 29 VAL H 3.100 . 3.100 2.319 2.231 2.383 . 0 0 "[ . 1 . 2]" 1
1786 1 28 LYS QB 1 31 GLN H 5.340 . 5.340 4.721 4.609 4.824 . 0 0 "[ . 1 . 2]" 1
1787 1 28 LYS QB 1 102 LEU MD1 3.760 . 3.760 2.638 2.252 2.807 . 0 0 "[ . 1 . 2]" 1
1788 1 28 LYS QB 1 102 LEU MD2 3.180 . 3.180 2.097 1.936 2.176 . 0 0 "[ . 1 . 2]" 1
1789 1 28 LYS QE 1 28 LYS QG 3.310 . 3.310 2.122 2.094 2.284 . 0 0 "[ . 1 . 2]" 1
1790 1 28 LYS QG 1 29 VAL H 4.390 . 4.390 3.560 3.463 3.654 . 0 0 "[ . 1 . 2]" 1
1791 1 28 LYS QG 1 31 GLN QB 5.340 . 5.340 5.273 5.119 5.380 0.040 4 0 "[ . 1 . 2]" 1
1792 1 28 LYS QG 1 102 LEU MD1 3.370 . 3.370 3.052 2.502 3.255 . 0 0 "[ . 1 . 2]" 1
1793 1 28 LYS QG 1 102 LEU MD2 3.260 . 3.260 3.016 2.871 3.131 . 0 0 "[ . 1 . 2]" 1
1794 1 29 VAL H 1 29 VAL QG 2.880 . 2.880 1.977 1.832 2.106 . 0 0 "[ . 1 . 2]" 1
1795 1 29 VAL HA 1 29 VAL QG 2.800 . 2.800 2.219 2.122 2.340 . 0 0 "[ . 1 . 2]" 1
1796 1 29 VAL HA 1 109 LEU QD 3.910 . 3.910 2.794 2.646 3.055 . 0 0 "[ . 1 . 2]" 1
1797 1 29 VAL HB 1 98 LEU QD 4.110 . 4.110 3.122 2.122 3.976 . 0 0 "[ . 1 . 2]" 1
1798 1 29 VAL HB 1 109 LEU QD 4.700 . 4.700 3.440 2.594 4.302 . 0 0 "[ . 1 . 2]" 1
1799 1 29 VAL QG 1 30 TYR H 3.660 . 3.660 2.661 2.051 3.266 . 0 0 "[ . 1 . 2]" 1
1800 1 29 VAL QG 1 30 TYR HA 3.810 . 3.810 3.261 3.080 3.534 . 0 0 "[ . 1 . 2]" 1
1801 1 29 VAL QG 1 30 TYR QD 3.840 . 3.840 2.573 1.989 3.623 . 0 0 "[ . 1 . 2]" 1
1802 1 29 VAL QG 1 30 TYR QE 4.440 . 4.440 3.229 2.661 4.214 . 0 0 "[ . 1 . 2]" 1
1803 1 29 VAL QG 1 32 LEU H 5.440 . 5.440 4.656 4.525 4.803 . 0 0 "[ . 1 . 2]" 1
1804 1 29 VAL QG 1 33 LEU HB2 4.290 . 4.290 3.216 2.995 3.437 . 0 0 "[ . 1 . 2]" 1
1805 1 29 VAL QG 1 33 LEU HG 3.950 . 3.950 2.719 2.491 4.022 0.072 14 0 "[ . 1 . 2]" 1
1806 1 29 VAL QG 1 33 LEU QD 2.810 . 2.810 1.808 1.673 1.884 0.127 14 0 "[ . 1 . 2]" 1
1807 1 29 VAL QG 1 41 PHE HA 5.440 . 5.440 5.388 5.124 5.532 0.092 18 0 "[ . 1 . 2]" 1
1808 1 29 VAL QG 1 41 PHE QD 4.180 . 4.180 3.133 2.801 3.636 . 0 0 "[ . 1 . 2]" 1
1809 1 29 VAL QG 1 41 PHE HZ 5.440 . 5.440 4.599 4.010 5.083 . 0 0 "[ . 1 . 2]" 1
1810 1 29 VAL QG 1 72 PHE QD 3.900 . 3.900 3.246 2.989 3.409 . 0 0 "[ . 1 . 2]" 1
1811 1 29 VAL QG 1 72 PHE QE 3.300 . 3.300 2.240 1.891 2.539 . 0 0 "[ . 1 . 2]" 1
1812 1 29 VAL QG 1 72 PHE HZ 3.570 . 3.570 2.072 1.773 2.288 0.027 15 0 "[ . 1 . 2]" 1
1813 1 29 VAL QG 1 74 ARG HA 5.440 . 5.440 5.598 5.468 5.679 0.239 15 0 "[ . 1 . 2]" 1
1814 1 29 VAL QG 1 74 ARG QD 5.130 . 5.130 4.486 3.845 5.237 0.107 1 0 "[ . 1 . 2]" 1
1815 1 29 VAL QG 1 79 VAL MG1 4.700 . 4.700 3.992 3.807 4.229 . 0 0 "[ . 1 . 2]" 1
1816 1 29 VAL QG 1 79 VAL MG2 4.470 . 4.470 4.384 4.205 4.538 0.068 3 0 "[ . 1 . 2]" 1
1817 1 29 VAL QG 1 98 LEU HA 5.440 . 5.440 4.830 4.414 5.246 . 0 0 "[ . 1 . 2]" 1
1818 1 29 VAL QG 1 98 LEU QB 4.070 . 4.070 2.843 2.343 3.339 . 0 0 "[ . 1 . 2]" 1
1819 1 29 VAL QG 1 98 LEU QD 2.580 . 2.580 1.928 1.703 2.253 0.097 16 0 "[ . 1 . 2]" 1
1820 1 29 VAL QG 1 102 LEU MD2 4.650 . 4.650 3.330 2.585 3.805 . 0 0 "[ . 1 . 2]" 1
1821 1 29 VAL QG 1 109 LEU HG 3.630 . 3.630 3.280 3.081 3.718 0.088 15 0 "[ . 1 . 2]" 1
1822 1 29 VAL QG 1 109 LEU QD 2.520 . 2.520 1.776 1.725 2.033 0.075 9 0 "[ . 1 . 2]" 1
1823 1 30 TYR HA 1 33 LEU QD 4.190 . 4.190 3.914 3.287 4.229 0.039 12 0 "[ . 1 . 2]" 1
1824 1 30 TYR HB3 1 34 LYS QG 4.710 . 4.710 4.005 3.328 4.494 . 0 0 "[ . 1 . 2]" 1
1825 1 30 TYR QD 1 33 LEU QD 5.180 . 5.180 4.051 3.149 5.100 . 0 0 "[ . 1 . 2]" 1
1826 1 31 GLN HA 1 34 LYS QG 4.340 . 4.340 3.155 2.946 3.623 . 0 0 "[ . 1 . 2]" 1
1827 1 31 GLN QE 1 31 GLN HG3 3.380 . 3.380 3.110 2.283 3.289 . 0 0 "[ . 1 . 2]" 1
1828 1 31 GLN QE 1 34 LYS QE 4.260 . 4.260 3.217 2.463 3.948 . 0 0 "[ . 1 . 2]" 1
1829 1 32 LEU H 1 33 LEU QD 5.440 . 5.440 4.571 3.990 4.718 . 0 0 "[ . 1 . 2]" 1
1830 1 32 LEU HB2 1 33 LEU QD 4.160 . 4.160 3.603 3.399 3.764 . 0 0 "[ . 1 . 2]" 1
1831 1 32 LEU MD1 1 33 LEU QD 3.370 . 3.370 2.482 1.929 2.602 . 0 0 "[ . 1 . 2]" 1
1832 1 32 LEU MD1 1 102 LEU QB 3.820 . 3.820 3.190 3.118 3.250 . 0 0 "[ . 1 . 2]" 1
1833 1 32 LEU MD1 1 109 LEU QD 3.160 . 3.160 2.669 2.453 2.857 . 0 0 "[ . 1 . 2]" 1
1834 1 32 LEU MD2 1 102 LEU QB 3.080 . 3.080 2.077 1.944 2.220 . 0 0 "[ . 1 . 2]" 1
1835 1 33 LEU H 1 33 LEU QD 3.280 . 3.280 3.033 2.448 3.160 . 0 0 "[ . 1 . 2]" 1
1836 1 33 LEU HA 1 33 LEU QD 2.830 . 2.830 1.798 1.783 1.910 0.017 11 0 "[ . 1 . 2]" 1
1837 1 33 LEU HB2 1 34 LYS QG 5.230 . 5.230 4.756 4.590 5.082 . 0 0 "[ . 1 . 2]" 1
1838 1 33 LEU HG 1 109 LEU QD 5.140 . 5.140 3.217 2.970 3.823 . 0 0 "[ . 1 . 2]" 1
1839 1 33 LEU QD 1 34 LYS H 3.940 . 3.940 4.069 3.988 4.090 0.150 10 0 "[ . 1 . 2]" 1
1840 1 33 LEU QD 1 36 GLN H 4.750 . 4.750 4.398 4.292 4.599 . 0 0 "[ . 1 . 2]" 1
1841 1 33 LEU QD 1 36 GLN HB2 4.040 . 4.040 3.609 3.385 4.004 . 0 0 "[ . 1 . 2]" 1
1842 1 33 LEU QD 1 36 GLN HB3 5.150 . 5.150 4.545 4.269 4.824 . 0 0 "[ . 1 . 2]" 1
1843 1 33 LEU QD 1 36 GLN HG2 5.440 . 5.440 4.275 4.057 4.452 . 0 0 "[ . 1 . 2]" 1
1844 1 33 LEU QD 1 36 GLN HG3 3.440 . 3.440 2.853 2.590 3.173 . 0 0 "[ . 1 . 2]" 1
1845 1 33 LEU QD 1 36 GLN HE21 3.750 . 3.750 2.504 2.094 2.969 . 0 0 "[ . 1 . 2]" 1
1846 1 33 LEU QD 1 36 GLN HE22 4.310 . 4.310 3.390 2.520 4.052 . 0 0 "[ . 1 . 2]" 1
1847 1 33 LEU QD 1 38 CYS H 4.680 . 4.680 4.604 4.319 4.959 0.279 14 0 "[ . 1 . 2]" 1
1848 1 33 LEU QD 1 41 PHE HA 5.440 . 5.440 4.846 4.406 5.165 . 0 0 "[ . 1 . 2]" 1
1849 1 33 LEU QD 1 41 PHE QB 4.490 . 4.490 2.772 2.350 3.060 . 0 0 "[ . 1 . 2]" 1
1850 1 33 LEU QD 1 41 PHE QD 3.570 . 3.570 2.689 2.197 2.842 . 0 0 "[ . 1 . 2]" 1
1851 1 33 LEU QD 1 41 PHE QE 3.620 . 3.620 3.164 2.909 3.268 . 0 0 "[ . 1 . 2]" 1
1852 1 33 LEU QD 1 41 PHE HZ 4.390 . 4.390 3.933 3.857 4.061 . 0 0 "[ . 1 . 2]" 1
1853 1 33 LEU QD 1 72 PHE QD 5.440 . 5.440 4.625 4.324 4.852 . 0 0 "[ . 1 . 2]" 1
1854 1 33 LEU QD 1 72 PHE QE 4.470 . 4.470 3.091 2.736 3.397 . 0 0 "[ . 1 . 2]" 1
1855 1 33 LEU QD 1 72 PHE HZ 4.650 . 4.650 3.240 2.693 3.787 . 0 0 "[ . 1 . 2]" 1
1856 1 33 LEU QD 1 74 ARG HA 5.440 . 5.440 4.592 4.139 5.075 . 0 0 "[ . 1 . 2]" 1
1857 1 33 LEU QD 1 74 ARG QD 4.110 . 4.110 2.623 1.863 3.459 . 0 0 "[ . 1 . 2]" 1
1858 1 33 LEU QD 1 74 ARG HE 3.760 . 3.760 3.276 2.247 3.925 0.165 15 0 "[ . 1 . 2]" 1
1859 1 33 LEU QD 1 79 VAL MG2 5.440 . 5.440 3.945 3.769 4.170 . 0 0 "[ . 1 . 2]" 1
1860 1 33 LEU QD 1 109 LEU QD 2.970 . 2.970 1.924 1.760 2.372 0.040 15 0 "[ . 1 . 2]" 1
1861 1 33 LEU QD 1 110 LEU HA 3.520 . 3.520 2.558 2.056 3.045 . 0 0 "[ . 1 . 2]" 1
1862 1 33 LEU QD 1 110 LEU HG 4.980 . 4.980 4.244 3.880 4.620 . 0 0 "[ . 1 . 2]" 1
1863 1 33 LEU QD 1 110 LEU MD2 3.220 . 3.220 2.634 2.144 2.966 . 0 0 "[ . 1 . 2]" 1
1864 1 33 LEU QD 1 111 TYR QE 5.440 . 5.440 4.887 4.748 5.217 . 0 0 "[ . 1 . 2]" 1
1865 1 34 LYS HA 1 34 LYS QG 3.460 . 3.460 3.369 3.288 3.505 0.045 5 0 "[ . 1 . 2]" 1
1866 1 34 LYS QG 1 35 ASP H 3.830 . 3.830 2.449 2.321 2.681 . 0 0 "[ . 1 . 2]" 1
1867 1 34 LYS QG 1 35 ASP HA 3.910 . 3.910 3.424 3.088 4.018 0.108 2 0 "[ . 1 . 2]" 1
1868 1 34 LYS QG 1 41 PHE QE 5.260 . 5.260 4.979 4.870 5.139 . 0 0 "[ . 1 . 2]" 1
1869 1 34 LYS QG 1 41 PHE HZ 4.580 . 4.580 4.227 4.133 4.353 . 0 0 "[ . 1 . 2]" 1
1870 1 35 ASP H 1 35 ASP QB 2.930 . 2.930 2.230 2.095 2.287 . 0 0 "[ . 1 . 2]" 1
1871 1 35 ASP QB 1 36 GLN HG2 4.390 . 4.390 3.361 2.809 4.114 . 0 0 "[ . 1 . 2]" 1
1872 1 35 ASP QB 1 37 GLY H 4.950 . 4.950 4.398 4.282 4.653 . 0 0 "[ . 1 . 2]" 1
1873 1 36 GLN H 1 37 GLY QA 5.140 . 5.140 4.463 4.288 4.563 . 0 0 "[ . 1 . 2]" 1
1874 1 36 GLN HB2 1 37 GLY QA 4.570 . 4.570 4.255 3.956 4.472 . 0 0 "[ . 1 . 2]" 1
1875 1 36 GLN HE21 1 110 LEU QB 5.070 . 5.070 3.337 2.944 3.852 . 0 0 "[ . 1 . 2]" 1
1876 1 37 GLY H 1 38 CYS QB 4.430 . 4.430 4.062 3.772 4.249 . 0 0 "[ . 1 . 2]" 1
1877 1 37 GLY QA 1 38 CYS HA 4.590 . 4.590 3.952 3.891 3.996 . 0 0 "[ . 1 . 2]" 1
1878 1 37 GLY QA 1 116 LYS QD 3.380 . 3.380 1.783 1.668 1.952 0.132 1 0 "[ . 1 . 2]" 1
1879 1 37 GLY QA 1 116 LYS QE 4.120 . 4.120 3.607 3.221 3.779 . 0 0 "[ . 1 . 2]" 1
1880 1 37 GLY QA 1 117 PHE QD 5.190 . 5.190 4.756 3.612 5.269 0.079 1 0 "[ . 1 . 2]" 1
1881 1 38 CYS H 1 38 CYS QB 3.240 . 3.240 2.507 2.397 2.584 . 0 0 "[ . 1 . 2]" 1
1882 1 38 CYS HA 1 39 GLU QB 4.540 . 4.540 4.344 3.951 4.557 0.017 10 0 "[ . 1 . 2]" 1
1883 1 38 CYS QB 1 40 ASP H 4.420 . 4.420 3.747 3.409 3.932 . 0 0 "[ . 1 . 2]" 1
1884 1 39 GLU H 1 39 GLU QB 3.450 . 3.450 2.824 2.466 3.021 . 0 0 "[ . 1 . 2]" 1
1885 1 39 GLU QB 1 39 GLU QG 2.320 . 2.320 2.021 2.001 2.089 . 0 0 "[ . 1 . 2]" 1
1886 1 39 GLU QB 1 115 CYS QB 4.210 . 4.210 4.120 2.975 4.367 0.157 10 0 "[ . 1 . 2]" 1
1887 1 41 PHE HA 1 74 ARG QB 5.320 . 5.320 4.152 3.495 4.651 . 0 0 "[ . 1 . 2]" 1
1888 1 41 PHE QB 1 42 GLY H 3.760 . 3.760 2.523 2.203 2.754 . 0 0 "[ . 1 . 2]" 1
1889 1 41 PHE QB 1 72 PHE HZ 4.180 . 4.180 2.260 1.794 2.670 0.006 15 0 "[ . 1 . 2]" 1
1890 1 41 PHE QB 1 74 ARG HA 4.340 . 4.340 2.564 2.322 2.754 . 0 0 "[ . 1 . 2]" 1
1891 1 41 PHE QB 1 74 ARG HE 5.340 . 5.340 4.284 3.147 5.159 . 0 0 "[ . 1 . 2]" 1
1892 1 41 PHE QB 1 75 HIS H 5.340 . 5.340 3.852 3.683 4.015 . 0 0 "[ . 1 . 2]" 1
1893 1 41 PHE QD 1 42 GLY QA 4.590 . 4.590 3.419 3.110 3.676 . 0 0 "[ . 1 . 2]" 1
1894 1 42 GLY QA 1 72 PHE QE 4.510 . 4.510 3.455 3.104 3.698 . 0 0 "[ . 1 . 2]" 1
1895 1 43 THR MG 1 98 LEU QD 4.550 . 4.550 3.589 3.325 3.750 . 0 0 "[ . 1 . 2]" 1
1896 1 44 LYS QG 1 71 SER QB 4.490 . 4.490 2.021 1.763 3.544 0.037 4 0 "[ . 1 . 2]" 1
1897 1 44 LYS QD 1 71 SER QB 4.650 . 4.650 3.070 1.862 4.268 . 0 0 "[ . 1 . 2]" 1
1898 1 44 LYS QE 1 71 SER QB 4.610 . 4.610 2.172 1.757 3.617 0.043 20 0 "[ . 1 . 2]" 1
1899 1 45 CYS QB 1 46 VAL QG 5.090 . 5.090 4.807 4.535 4.944 . 0 0 "[ . 1 . 2]" 1
1900 1 45 CYS QB 1 70 PHE QD 4.420 . 4.420 3.347 2.834 4.152 . 0 0 "[ . 1 . 2]" 1
1901 1 45 CYS QB 1 70 PHE QE 4.040 . 4.040 2.846 2.459 3.661 . 0 0 "[ . 1 . 2]" 1
1902 1 46 VAL HA 1 47 ILE QG 5.340 . 5.340 3.852 3.689 4.074 . 0 0 "[ . 1 . 2]" 1
1903 1 47 ILE HA 1 47 ILE QG 3.250 . 3.250 2.314 2.292 2.354 . 0 0 "[ . 1 . 2]" 1
1904 1 47 ILE QG 1 47 ILE MG 2.710 . 2.710 2.317 2.254 2.347 . 0 0 "[ . 1 . 2]" 1
1905 1 47 ILE QG 1 48 GLU H 3.980 . 3.980 3.918 3.845 3.994 0.014 13 0 "[ . 1 . 2]" 1
1906 1 47 ILE QG 1 66 LYS HG3 4.520 . 4.520 3.819 3.481 4.172 . 0 0 "[ . 1 . 2]" 1
1907 1 47 ILE QG 1 66 LYS QE 4.000 . 4.000 3.703 3.419 3.899 . 0 0 "[ . 1 . 2]" 1
1908 1 47 ILE QG 1 67 TYR HA 5.340 . 5.340 5.396 5.355 5.453 0.113 6 0 "[ . 1 . 2]" 1
1909 1 47 ILE QG 1 68 TYR HA 3.620 . 3.620 2.902 2.777 3.059 . 0 0 "[ . 1 . 2]" 1
1910 1 47 ILE QG 1 68 TYR QD 3.360 . 3.360 2.587 2.079 3.093 . 0 0 "[ . 1 . 2]" 1
1911 1 47 ILE QG 1 68 TYR QE 3.170 . 3.170 2.853 2.661 3.065 . 0 0 "[ . 1 . 2]" 1
1912 1 48 GLU H 1 67 TYR QB 4.480 . 4.480 3.696 3.421 3.949 . 0 0 "[ . 1 . 2]" 1
1913 1 48 GLU HB2 1 50 VAL QG 4.880 . 4.880 4.544 3.976 4.956 0.076 14 0 "[ . 1 . 2]" 1
1914 1 48 GLU HB2 1 67 TYR QB 4.410 . 4.410 3.276 2.440 3.757 . 0 0 "[ . 1 . 2]" 1
1915 1 49 GLU HB2 1 64 LEU QD 3.230 . 3.230 1.972 1.768 2.385 0.032 2 0 "[ . 1 . 2]" 1
1916 1 49 GLU HB3 1 64 LEU QD 3.880 . 3.880 3.138 2.214 3.913 0.033 7 0 "[ . 1 . 2]" 1
1917 1 50 VAL H 1 50 VAL QG 3.120 . 3.120 2.392 2.078 2.793 . 0 0 "[ . 1 . 2]" 1
1918 1 50 VAL H 1 64 LEU QD 4.060 . 4.060 3.375 2.433 3.933 . 0 0 "[ . 1 . 2]" 1
1919 1 50 VAL HA 1 50 VAL QG 2.890 . 2.890 2.132 2.118 2.149 . 0 0 "[ . 1 . 2]" 1
1920 1 50 VAL QG 1 51 LYS H 4.400 . 4.400 2.934 2.062 3.407 . 0 0 "[ . 1 . 2]" 1
1921 1 50 VAL QG 1 65 THR MG 4.030 . 4.030 3.531 3.050 3.973 . 0 0 "[ . 1 . 2]" 1
1922 1 50 VAL QG 1 66 LYS HA 3.880 . 3.880 3.494 2.694 3.846 . 0 0 "[ . 1 . 2]" 1
1923 1 50 VAL QG 1 67 TYR H 4.170 . 4.170 3.727 3.158 4.110 . 0 0 "[ . 1 . 2]" 1
1924 1 50 VAL QG 1 67 TYR HA 5.250 . 5.250 5.011 4.504 5.247 . 0 0 "[ . 1 . 2]" 1
1925 1 50 VAL QG 1 67 TYR QB 3.910 . 3.910 3.230 2.936 3.601 . 0 0 "[ . 1 . 2]" 1
1926 1 50 VAL QG 1 67 TYR QD 3.190 . 3.190 2.028 1.792 2.244 0.008 6 0 "[ . 1 . 2]" 1
1927 1 50 VAL QG 1 67 TYR QE 3.130 . 3.130 2.527 2.129 2.831 . 0 0 "[ . 1 . 2]" 1
1928 1 52 SER H 1 64 LEU QD 4.870 . 4.870 2.709 2.000 4.121 . 0 0 "[ . 1 . 2]" 1
1929 1 52 SER QB 1 64 LEU QD 4.380 . 4.380 3.440 2.023 4.426 0.046 2 0 "[ . 1 . 2]" 1
1930 1 55 LYS QB 1 56 THR MG 4.620 . 4.620 4.264 3.128 4.764 0.144 15 0 "[ . 1 . 2]" 1
1931 1 56 THR HA 1 57 LEU QB 4.680 . 4.680 4.343 3.920 4.746 0.066 17 0 "[ . 1 . 2]" 1
1932 1 56 THR HA 1 58 LEU QD 4.760 . 4.760 4.059 2.835 4.826 0.066 6 0 "[ . 1 . 2]" 1
1933 1 56 THR HB 1 58 LEU QD 4.520 . 4.520 3.430 1.718 4.247 0.082 11 0 "[ . 1 . 2]" 1
1934 1 56 THR MG 1 58 LEU QD 2.980 . 2.980 2.158 1.742 3.073 0.093 15 0 "[ . 1 . 2]" 1
1935 1 56 THR MG 1 61 GLU QB 4.560 . 4.560 3.760 2.524 4.602 0.042 15 0 "[ . 1 . 2]" 1
1936 1 58 LEU H 1 58 LEU QD 3.810 . 3.810 1.945 1.705 2.396 0.095 9 0 "[ . 1 . 2]" 1
1937 1 58 LEU QB 1 58 LEU QD 2.510 . 2.510 1.924 1.883 1.964 . 0 0 "[ . 1 . 2]" 1
1938 1 58 LEU QD 1 59 ASN HA 4.950 . 4.950 4.636 4.329 5.072 0.122 13 0 "[ . 1 . 2]" 1
1939 1 58 LEU QD 1 59 ASN HB3 4.020 . 4.020 3.525 2.986 4.061 0.041 3 0 "[ . 1 . 2]" 1
1940 1 58 LEU QD 1 59 ASN QD 5.270 . 5.270 4.953 4.152 5.417 0.147 6 0 "[ . 1 . 2]" 1
1941 1 58 LEU QD 1 61 GLU HA 2.720 . 2.720 2.556 1.921 3.154 0.434 6 0 "[ . 1 . 2]" 1
1942 1 58 LEU QD 1 61 GLU QB 4.530 . 4.530 3.919 1.733 4.376 0.067 6 0 "[ . 1 . 2]" 1
1943 1 58 LEU QD 1 61 GLU QG 4.500 . 4.500 4.307 3.347 4.800 0.300 9 0 "[ . 1 . 2]" 1
1944 1 58 LEU QD 1 62 LEU H 3.970 . 3.970 1.926 1.715 2.498 0.085 17 0 "[ . 1 . 2]" 1
1945 1 58 LEU QD 1 62 LEU HA 3.000 . 3.000 2.719 2.116 3.390 0.390 13 0 "[ . 1 . 2]" 1
1946 1 59 ASN HB2 1 59 ASN QD 3.390 . 3.390 2.825 2.180 3.285 . 0 0 "[ . 1 . 2]" 1
1947 1 59 ASN HB3 1 59 ASN QD 3.420 . 3.420 2.676 2.183 3.327 . 0 0 "[ . 1 . 2]" 1
1948 1 60 THR HB 1 61 GLU QG 4.870 . 4.870 4.336 2.418 5.027 0.157 16 0 "[ . 1 . 2]" 1
1949 1 61 GLU H 1 61 GLU QB 3.580 . 3.580 2.635 2.195 3.383 . 0 0 "[ . 1 . 2]" 1
1950 1 61 GLU HA 1 61 GLU QG 3.430 . 3.430 2.796 2.289 3.423 . 0 0 "[ . 1 . 2]" 1
1951 1 61 GLU QB 1 64 LEU QD 5.020 . 5.020 2.716 1.769 4.184 0.031 18 0 "[ . 1 . 2]" 1
1952 1 61 GLU QG 1 62 LEU H 4.810 . 4.810 4.424 3.406 4.896 0.086 6 0 "[ . 1 . 2]" 1
1953 1 61 GLU QG 1 64 LEU QB 4.370 . 4.370 3.552 1.987 4.398 0.028 13 0 "[ . 1 . 2]" 1
1954 1 61 GLU QG 1 64 LEU QD 4.460 . 4.460 3.176 1.805 4.530 0.070 16 0 "[ . 1 . 2]" 1
1955 1 63 HIS QB 1 64 LEU HA 5.330 . 5.330 4.516 4.184 4.779 . 0 0 "[ . 1 . 2]" 1
1956 1 64 LEU H 1 64 LEU QD 4.620 . 4.620 3.066 1.745 3.915 0.055 1 0 "[ . 1 . 2]" 1
1957 1 64 LEU HA 1 64 LEU QD 3.450 . 3.450 2.668 1.816 3.380 . 0 0 "[ . 1 . 2]" 1
1958 1 64 LEU QB 1 64 LEU QD 2.390 . 2.390 1.939 1.888 2.066 . 0 0 "[ . 1 . 2]" 1
1959 1 64 LEU QD 1 65 THR H 3.970 . 3.970 2.581 1.780 3.219 0.020 13 0 "[ . 1 . 2]" 1
1960 1 64 LEU QD 1 65 THR HA 4.690 . 4.690 4.222 3.565 4.735 0.045 20 0 "[ . 1 . 2]" 1
1961 1 64 LEU QD 1 65 THR HB 4.350 . 4.350 3.785 2.862 4.284 . 0 0 "[ . 1 . 2]" 1
1962 1 67 TYR QB 1 68 TYR H 3.580 . 3.580 2.854 2.693 3.123 . 0 0 "[ . 1 . 2]" 1
1963 1 67 TYR QB 1 69 GLY HA2 5.340 . 5.340 4.474 4.203 4.639 . 0 0 "[ . 1 . 2]" 1
1964 1 67 TYR QB 1 83 LYS HA 4.770 . 4.770 3.901 3.483 4.212 . 0 0 "[ . 1 . 2]" 1
1965 1 67 TYR QB 1 83 LYS QB 4.280 . 4.280 3.727 2.181 4.192 . 0 0 "[ . 1 . 2]" 1
1966 1 67 TYR QB 1 83 LYS QG 3.150 . 3.150 2.024 1.739 2.828 0.061 2 0 "[ . 1 . 2]" 1
1967 1 67 TYR QB 1 83 LYS QD 3.030 . 3.030 2.366 2.111 2.646 . 0 0 "[ . 1 . 2]" 1
1968 1 67 TYR QB 1 84 SER HA 5.340 . 5.340 3.754 3.340 4.135 . 0 0 "[ . 1 . 2]" 1
1969 1 67 TYR QD 1 83 LYS QG 3.490 . 3.490 2.775 1.977 3.309 . 0 0 "[ . 1 . 2]" 1
1970 1 67 TYR QE 1 83 LYS QG 5.340 . 5.340 4.419 3.780 4.784 . 0 0 "[ . 1 . 2]" 1
1971 1 68 TYR H 1 68 TYR QB 3.590 . 3.590 2.258 2.156 2.443 . 0 0 "[ . 1 . 2]" 1
1972 1 68 TYR QB 1 69 GLY H 3.820 . 3.820 3.533 3.385 3.635 . 0 0 "[ . 1 . 2]" 1
1973 1 68 TYR QB 1 70 PHE QE 5.230 . 5.230 2.878 2.506 3.249 . 0 0 "[ . 1 . 2]" 1
1974 1 68 TYR QB 1 87 VAL HA 4.320 . 4.320 2.826 2.333 3.233 . 0 0 "[ . 1 . 2]" 1
1975 1 68 TYR QB 1 90 ALA MB 4.270 . 4.270 2.504 2.379 2.634 . 0 0 "[ . 1 . 2]" 1
1976 1 68 TYR QD 1 87 VAL QG 3.290 . 3.290 2.371 1.955 2.705 . 0 0 "[ . 1 . 2]" 1
1977 1 68 TYR QE 1 87 VAL QG 3.300 . 3.300 2.728 2.147 2.950 . 0 0 "[ . 1 . 2]" 1
1978 1 70 PHE QD 1 87 VAL QG 3.990 . 3.990 3.688 3.451 3.774 . 0 0 "[ . 1 . 2]" 1
1979 1 70 PHE QD 1 91 LYS QB 4.850 . 4.850 4.226 3.393 4.699 . 0 0 "[ . 1 . 2]" 1
1980 1 70 PHE QD 1 91 LYS QG 5.290 . 5.290 3.118 2.929 3.334 . 0 0 "[ . 1 . 2]" 1
1981 1 70 PHE QE 1 87 VAL QG 3.160 . 3.160 1.754 1.722 1.786 0.078 7 0 "[ . 1 . 2]" 1
1982 1 70 PHE QE 1 91 LYS QB 5.340 . 5.340 4.055 3.076 4.469 . 0 0 "[ . 1 . 2]" 1
1983 1 70 PHE QE 1 91 LYS QG 4.990 . 4.990 2.749 2.453 3.222 . 0 0 "[ . 1 . 2]" 1
1984 1 70 PHE HZ 1 87 VAL QG 3.660 . 3.660 2.347 2.029 2.637 . 0 0 "[ . 1 . 2]" 1
1985 1 70 PHE HZ 1 91 LYS QG 4.830 . 4.830 3.287 2.846 4.190 . 0 0 "[ . 1 . 2]" 1
1986 1 71 SER H 1 71 SER QB 3.700 . 3.700 2.911 2.677 3.295 . 0 0 "[ . 1 . 2]" 1
1987 1 71 SER HA 1 94 MET QB 4.470 . 4.470 3.103 2.833 3.686 . 0 0 "[ . 1 . 2]" 1
1988 1 71 SER QB 1 72 PHE H 3.640 . 3.640 2.935 2.536 3.600 . 0 0 "[ . 1 . 2]" 1
1989 1 71 SER QB 1 73 PHE QD 4.540 . 4.540 3.556 3.022 4.396 . 0 0 "[ . 1 . 2]" 1
1990 1 71 SER QB 1 78 ILE MG 3.680 . 3.680 2.931 2.357 3.718 0.038 18 0 "[ . 1 . 2]" 1
1991 1 71 SER QB 1 78 ILE MD 3.440 . 3.440 2.048 1.754 2.997 0.046 17 0 "[ . 1 . 2]" 1
1992 1 71 SER QB 1 81 TYR HA 4.290 . 4.290 3.115 2.529 3.466 . 0 0 "[ . 1 . 2]" 1
1993 1 71 SER QB 1 81 TYR HB2 4.650 . 4.650 3.735 2.977 4.102 . 0 0 "[ . 1 . 2]" 1
1994 1 71 SER QB 1 81 TYR QD 3.560 . 3.560 2.546 1.765 3.204 0.035 16 0 "[ . 1 . 2]" 1
1995 1 71 SER QB 1 81 TYR QE 4.680 . 4.680 3.705 2.684 4.321 . 0 0 "[ . 1 . 2]" 1
1996 1 72 PHE HA 1 98 LEU QD 4.780 . 4.780 4.111 4.022 4.228 . 0 0 "[ . 1 . 2]" 1
1997 1 72 PHE HB2 1 98 LEU QD 3.990 . 3.990 2.369 2.249 2.514 . 0 0 "[ . 1 . 2]" 1
1998 1 72 PHE HB3 1 98 LEU QD 3.600 . 3.600 2.310 2.045 2.625 . 0 0 "[ . 1 . 2]" 1
1999 1 72 PHE HB3 1 109 LEU QD 5.020 . 5.020 4.324 4.099 4.447 . 0 0 "[ . 1 . 2]" 1
2000 1 72 PHE QD 1 74 ARG QB 4.150 . 4.150 3.024 2.658 3.335 . 0 0 "[ . 1 . 2]" 1
2001 1 72 PHE QD 1 98 LEU QD 3.140 . 3.140 2.538 2.492 2.581 . 0 0 "[ . 1 . 2]" 1
2002 1 72 PHE QD 1 109 LEU QD 4.510 . 4.510 3.334 3.173 3.571 . 0 0 "[ . 1 . 2]" 1
2003 1 72 PHE QE 1 74 ARG QB 5.240 . 5.240 2.702 1.797 3.529 0.003 15 0 "[ . 1 . 2]" 1
2004 1 72 PHE QE 1 74 ARG QD 5.330 . 5.330 3.805 2.959 4.893 . 0 0 "[ . 1 . 2]" 1
2005 1 72 PHE QE 1 98 LEU QB 5.340 . 5.340 5.241 5.114 5.339 . 0 0 "[ . 1 . 2]" 1
2006 1 72 PHE QE 1 98 LEU QD 4.590 . 4.590 3.172 3.018 3.297 . 0 0 "[ . 1 . 2]" 1
2007 1 72 PHE QE 1 109 LEU QD 3.530 . 3.530 2.958 2.513 3.363 . 0 0 "[ . 1 . 2]" 1
2008 1 72 PHE HZ 1 98 LEU QD 4.490 . 4.490 3.871 3.624 4.073 . 0 0 "[ . 1 . 2]" 1
2009 1 72 PHE HZ 1 109 LEU QD 4.530 . 4.530 3.932 3.255 4.274 . 0 0 "[ . 1 . 2]" 1
2010 1 73 PHE QB 1 74 ARG H 3.440 . 3.440 3.115 2.951 3.236 . 0 0 "[ . 1 . 2]" 1
2011 1 73 PHE QB 1 78 ILE HA 5.150 . 5.150 4.954 4.894 5.032 . 0 0 "[ . 1 . 2]" 1
2012 1 73 PHE QB 1 78 ILE MD 4.290 . 4.290 3.970 3.774 4.106 . 0 0 "[ . 1 . 2]" 1
2013 1 73 PHE QD 1 76 GLY QA 4.410 . 4.410 2.173 1.888 2.670 . 0 0 "[ . 1 . 2]" 1
2014 1 73 PHE QE 1 76 GLY QA 4.790 . 4.790 2.787 2.314 3.164 . 0 0 "[ . 1 . 2]" 1
2015 1 74 ARG QB 1 74 ARG HE 4.390 . 4.390 4.076 2.432 4.370 . 0 0 "[ . 1 . 2]" 1
2016 1 74 ARG QB 1 75 HIS H 4.070 . 4.070 3.896 3.682 3.978 . 0 0 "[ . 1 . 2]" 1
2017 1 74 ARG QB 1 75 HIS HD2 5.340 . 5.340 4.416 3.672 4.804 . 0 0 "[ . 1 . 2]" 1
2018 1 74 ARG QB 1 79 VAL MG1 4.370 . 4.370 3.995 3.839 4.290 . 0 0 "[ . 1 . 2]" 1
2019 1 74 ARG QB 1 79 VAL MG2 3.510 . 3.510 1.921 1.746 2.318 0.054 17 0 "[ . 1 . 2]" 1
2020 1 74 ARG QB 1 111 TYR QE 4.800 . 4.800 3.904 3.106 4.268 . 0 0 "[ . 1 . 2]" 1
2021 1 74 ARG QD 1 75 HIS H 5.340 . 5.340 3.629 2.735 5.267 . 0 0 "[ . 1 . 2]" 1
2022 1 74 ARG QD 1 75 HIS HD2 4.240 . 4.240 2.616 1.821 4.321 0.081 20 0 "[ . 1 . 2]" 1
2023 1 74 ARG QD 1 79 VAL MG2 3.780 . 3.780 3.278 2.481 3.649 . 0 0 "[ . 1 . 2]" 1
2024 1 74 ARG HE 1 113 CYS QB 5.340 . 5.340 4.281 3.590 5.375 0.035 14 0 "[ . 1 . 2]" 1
2025 1 75 HIS HA 1 76 GLY QA 4.550 . 4.550 4.046 3.993 4.082 . 0 0 "[ . 1 . 2]" 1
2026 1 75 HIS QB 1 77 ASN H 3.760 . 3.760 3.339 3.197 3.458 . 0 0 "[ . 1 . 2]" 1
2027 1 75 HIS QB 1 111 TYR QE 5.280 . 5.280 3.999 3.617 4.352 . 0 0 "[ . 1 . 2]" 1
2028 1 75 HIS HD2 1 113 CYS QB 4.320 . 4.320 4.291 4.113 4.397 0.077 13 0 "[ . 1 . 2]" 1
2029 1 75 HIS HE1 1 113 CYS QB 4.610 . 4.610 2.769 2.664 2.902 . 0 0 "[ . 1 . 2]" 1
2030 1 77 ASN H 1 77 ASN QB 2.920 . 2.920 2.622 2.555 2.703 . 0 0 "[ . 1 . 2]" 1
2031 1 77 ASN QB 1 79 VAL MG2 4.090 . 4.090 3.470 3.257 3.657 . 0 0 "[ . 1 . 2]" 1
2032 1 79 VAL HB 1 98 LEU QD 4.360 . 4.360 2.878 2.633 3.159 . 0 0 "[ . 1 . 2]" 1
2033 1 79 VAL HB 1 101 LEU QD 5.410 . 5.410 4.353 4.181 4.461 . 0 0 "[ . 1 . 2]" 1
2034 1 79 VAL MG1 1 98 LEU QB 4.330 . 4.330 3.209 2.914 3.479 . 0 0 "[ . 1 . 2]" 1
2035 1 79 VAL MG1 1 98 LEU QD 3.050 . 3.050 2.365 2.056 2.722 . 0 0 "[ . 1 . 2]" 1
2036 1 79 VAL MG1 1 101 LEU QD 2.720 . 2.720 2.058 1.915 2.165 . 0 0 "[ . 1 . 2]" 1
2037 1 79 VAL MG1 1 108 LEU QB 4.760 . 4.760 3.311 3.016 3.600 . 0 0 "[ . 1 . 2]" 1
2038 1 79 VAL MG1 1 109 LEU QD 2.530 . 2.530 1.756 1.734 1.775 0.066 1 0 "[ . 1 . 2]" 1
2039 1 79 VAL MG2 1 98 LEU QD 3.990 . 3.990 3.557 3.355 3.865 . 0 0 "[ . 1 . 2]" 1
2040 1 79 VAL MG2 1 109 LEU QD 2.910 . 2.910 2.141 2.038 2.273 . 0 0 "[ . 1 . 2]" 1
2041 1 80 ALA H 1 98 LEU QD 5.440 . 5.440 3.774 3.580 3.972 . 0 0 "[ . 1 . 2]" 1
2042 1 80 ALA H 1 109 LEU QD 5.440 . 5.440 5.031 4.808 5.177 . 0 0 "[ . 1 . 2]" 1
2043 1 80 ALA HA 1 94 MET QB 5.340 . 5.340 4.285 4.001 5.372 0.032 7 0 "[ . 1 . 2]" 1
2044 1 80 ALA HA 1 97 ARG QG 3.850 . 3.850 2.478 2.104 2.719 . 0 0 "[ . 1 . 2]" 1
2045 1 80 ALA HA 1 97 ARG QD 5.340 . 5.340 3.814 3.203 4.523 . 0 0 "[ . 1 . 2]" 1
2046 1 80 ALA MB 1 97 ARG QG 3.330 . 3.330 2.619 2.393 2.795 . 0 0 "[ . 1 . 2]" 1
2047 1 80 ALA MB 1 97 ARG QD 4.770 . 4.770 4.195 3.866 4.456 . 0 0 "[ . 1 . 2]" 1
2048 1 80 ALA MB 1 98 LEU QD 2.900 . 2.900 2.130 2.046 2.225 . 0 0 "[ . 1 . 2]" 1
2049 1 80 ALA MB 1 109 LEU QD 5.220 . 5.220 4.220 4.037 4.335 . 0 0 "[ . 1 . 2]" 1
2050 1 81 TYR H 1 97 ARG QG 4.550 . 4.550 2.112 1.845 2.471 . 0 0 "[ . 1 . 2]" 1
2051 1 81 TYR H 1 97 ARG QD 4.820 . 4.820 3.632 3.081 4.116 . 0 0 "[ . 1 . 2]" 1
2052 1 81 TYR HA 1 94 MET QB 4.440 . 4.440 3.257 2.888 3.995 . 0 0 "[ . 1 . 2]" 1
2053 1 81 TYR QE 1 83 LYS QG 4.770 . 4.770 4.038 2.623 4.550 . 0 0 "[ . 1 . 2]" 1
2054 1 82 GLY H 1 94 MET QB 4.140 . 4.140 2.950 2.316 3.601 . 0 0 "[ . 1 . 2]" 1
2055 1 83 LYS H 1 83 LYS QG 4.450 . 4.450 3.805 2.339 4.028 . 0 0 "[ . 1 . 2]" 1
2056 1 83 LYS QG 1 84 SER HA 4.740 . 4.740 3.497 3.264 3.717 . 0 0 "[ . 1 . 2]" 1
2057 1 86 LYS H 1 86 LYS QB 3.530 . 3.530 2.437 2.278 2.612 . 0 0 "[ . 1 . 2]" 1
2058 1 86 LYS QB 1 87 VAL H 4.060 . 4.060 3.341 2.656 3.835 . 0 0 "[ . 1 . 2]" 1
2059 1 86 LYS QB 1 87 VAL QG 4.600 . 4.600 3.950 3.288 4.553 . 0 0 "[ . 1 . 2]" 1
2060 1 86 LYS QB 1 88 ALA H 4.060 . 4.060 3.368 2.750 4.097 0.037 9 0 "[ . 1 . 2]" 1
2061 1 86 LYS QB 1 88 ALA MB 4.200 . 4.200 3.554 3.069 4.201 0.001 9 0 "[ . 1 . 2]" 1
2062 1 86 LYS QB 1 89 ASN H 3.590 . 3.590 2.562 2.034 2.992 . 0 0 "[ . 1 . 2]" 1
2063 1 86 LYS QB 1 89 ASN HB2 4.130 . 4.130 2.462 2.030 3.335 . 0 0 "[ . 1 . 2]" 1
2064 1 86 LYS QB 1 89 ASN HB3 4.200 . 4.200 2.532 1.751 3.470 0.049 15 0 "[ . 1 . 2]" 1
2065 1 86 LYS QB 1 90 ALA H 4.230 . 4.230 3.686 3.092 4.182 . 0 0 "[ . 1 . 2]" 1
2066 1 87 VAL H 1 87 VAL QG 3.140 . 3.140 1.969 1.835 2.170 . 0 0 "[ . 1 . 2]" 1
2067 1 87 VAL HA 1 87 VAL QG 2.850 . 2.850 2.388 2.340 2.440 . 0 0 "[ . 1 . 2]" 1
2068 1 87 VAL QG 1 88 ALA H 2.950 . 2.950 1.981 1.809 2.144 . 0 0 "[ . 1 . 2]" 1
2069 1 87 VAL QG 1 88 ALA HA 3.320 . 3.320 3.009 2.936 3.115 . 0 0 "[ . 1 . 2]" 1
2070 1 87 VAL QG 1 88 ALA MB 3.120 . 3.120 2.782 2.562 2.910 . 0 0 "[ . 1 . 2]" 1
2071 1 87 VAL QG 1 89 ASN H 4.670 . 4.670 4.041 3.943 4.188 . 0 0 "[ . 1 . 2]" 1
2072 1 87 VAL QG 1 90 ALA MB 3.940 . 3.940 3.674 3.493 3.939 . 0 0 "[ . 1 . 2]" 1
2073 1 87 VAL QG 1 91 LYS H 5.230 . 5.230 3.873 3.657 4.094 . 0 0 "[ . 1 . 2]" 1
2074 1 87 VAL QG 1 91 LYS QB 4.840 . 4.840 3.521 2.670 4.088 . 0 0 "[ . 1 . 2]" 1
2075 1 87 VAL QG 1 91 LYS QE 3.760 . 3.760 2.343 1.779 3.434 0.021 14 0 "[ . 1 . 2]" 1
2076 1 88 ALA H 1 91 LYS QB 5.340 . 5.340 4.818 4.379 5.215 . 0 0 "[ . 1 . 2]" 1
2077 1 88 ALA HA 1 91 LYS QB 3.920 . 3.920 2.714 2.416 3.053 . 0 0 "[ . 1 . 2]" 1
2078 1 88 ALA HA 1 91 LYS QG 5.340 . 5.340 3.855 2.968 4.611 . 0 0 "[ . 1 . 2]" 1
2079 1 89 ASN QD 1 90 ALA MB 5.140 . 5.140 4.328 3.952 5.228 0.088 15 0 "[ . 1 . 2]" 1
2080 1 89 ASN QD 1 93 ILE MD 4.430 . 4.430 2.235 1.927 2.960 . 0 0 "[ . 1 . 2]" 1
2081 1 90 ALA H 1 91 LYS QB 4.990 . 4.990 4.497 4.192 4.775 . 0 0 "[ . 1 . 2]" 1
2082 1 90 ALA MB 1 91 LYS QB 4.190 . 4.190 3.954 3.432 4.254 0.064 19 0 "[ . 1 . 2]" 1
2083 1 91 LYS H 1 91 LYS QG 3.870 . 3.870 2.852 2.120 3.874 0.004 12 0 "[ . 1 . 2]" 1
2084 1 91 LYS HA 1 91 LYS QG 3.690 . 3.690 2.342 2.185 2.422 . 0 0 "[ . 1 . 2]" 1
2085 1 91 LYS HA 1 94 MET QB 4.370 . 4.370 3.883 2.529 4.299 . 0 0 "[ . 1 . 2]" 1
2086 1 91 LYS QB 1 91 LYS QD 3.240 . 3.240 2.291 2.086 2.372 . 0 0 "[ . 1 . 2]" 1
2087 1 91 LYS QB 1 92 TYR H 3.460 . 3.460 2.467 2.343 2.625 . 0 0 "[ . 1 . 2]" 1
2088 1 91 LYS QB 1 92 TYR HA 5.340 . 5.340 3.758 3.588 3.974 . 0 0 "[ . 1 . 2]" 1
2089 1 91 LYS QB 1 94 MET ME 3.740 . 3.740 3.401 2.804 3.839 0.099 6 0 "[ . 1 . 2]" 1
2090 1 91 LYS QB 1 95 LYS H 5.060 . 5.060 4.729 4.359 5.154 0.094 4 0 "[ . 1 . 2]" 1
2091 1 91 LYS QB 1 95 LYS QD 3.500 . 3.500 2.965 2.392 3.539 0.039 6 0 "[ . 1 . 2]" 1
2092 1 91 LYS QB 1 95 LYS QE 3.900 . 3.900 2.470 1.756 3.905 0.044 7 0 "[ . 1 . 2]" 1
2093 1 91 LYS QE 1 91 LYS QG 3.440 . 3.440 2.397 2.156 2.808 . 0 0 "[ . 1 . 2]" 1
2094 1 91 LYS QG 1 92 TYR H 4.860 . 4.860 4.041 3.881 4.387 . 0 0 "[ . 1 . 2]" 1
2095 1 91 LYS QG 1 92 TYR HA 5.340 . 5.340 5.189 4.285 5.647 0.307 8 0 "[ . 1 . 2]" 1
2096 1 91 LYS QG 1 94 MET QG 5.250 . 5.250 3.953 3.333 5.447 0.197 7 0 "[ . 1 . 2]" 1
2097 1 91 LYS QG 1 94 MET ME 4.050 . 4.050 2.670 1.968 3.193 . 0 0 "[ . 1 . 2]" 1
2098 1 91 LYS QG 1 95 LYS QD 5.340 . 5.340 3.892 2.424 4.838 . 0 0 "[ . 1 . 2]" 1
2099 1 91 LYS QG 1 95 LYS QE 4.060 . 4.060 2.730 1.747 3.540 0.053 6 0 "[ . 1 . 2]" 1
2100 1 92 TYR QD 1 96 GLN QG 4.170 . 4.170 3.380 3.065 3.605 . 0 0 "[ . 1 . 2]" 1
2101 1 92 TYR QD 1 96 GLN QE 4.490 . 4.490 3.587 2.377 4.540 0.050 17 0 "[ . 1 . 2]" 1
2102 1 92 TYR QE 1 96 GLN QG 3.140 . 3.140 3.022 2.737 3.213 0.073 14 0 "[ . 1 . 2]" 1
2103 1 93 ILE MG 1 97 ARG QD 3.970 . 3.970 3.447 3.045 4.034 0.064 16 0 "[ . 1 . 2]" 1
2104 1 93 ILE MD 1 94 MET QB 5.340 . 5.340 5.235 5.143 5.342 0.002 15 0 "[ . 1 . 2]" 1
2105 1 94 MET QB 1 94 MET ME 3.240 . 3.240 3.181 2.122 3.403 0.163 6 0 "[ . 1 . 2]" 1
2106 1 94 MET QB 1 95 LYS H 4.090 . 4.090 3.292 2.325 3.487 . 0 0 "[ . 1 . 2]" 1
2107 1 94 MET QB 1 98 LEU QD 5.280 . 5.280 3.465 3.202 4.137 . 0 0 "[ . 1 . 2]" 1
2108 1 94 MET ME 1 98 LEU QD 3.450 . 3.450 3.377 3.242 3.506 0.056 9 0 "[ . 1 . 2]" 1
2109 1 95 LYS H 1 98 LEU QD 4.580 . 4.580 4.025 3.886 4.103 . 0 0 "[ . 1 . 2]" 1
2110 1 95 LYS HA 1 98 LEU QD 3.350 . 3.350 2.308 2.096 2.467 . 0 0 "[ . 1 . 2]" 1
2111 1 95 LYS HB2 1 98 LEU QD 5.440 . 5.440 4.698 4.456 4.798 . 0 0 "[ . 1 . 2]" 1
2112 1 96 GLN H 1 96 GLN QG 3.590 . 3.590 2.306 2.037 2.524 . 0 0 "[ . 1 . 2]" 1
2113 1 96 GLN H 1 96 GLN QE 5.340 . 5.340 3.850 3.001 4.900 . 0 0 "[ . 1 . 2]" 1
2114 1 96 GLN H 1 99 LEU QD 5.200 . 5.200 5.109 4.543 5.233 0.033 2 0 "[ . 1 . 2]" 1
2115 1 96 GLN HA 1 96 GLN QG 3.110 . 3.110 2.868 2.732 2.981 . 0 0 "[ . 1 . 2]" 1
2116 1 96 GLN HA 1 96 GLN QE 4.220 . 4.220 3.182 2.336 3.795 . 0 0 "[ . 1 . 2]" 1
2117 1 96 GLN HA 1 99 LEU QD 3.000 . 3.000 2.978 2.433 3.082 0.082 9 0 "[ . 1 . 2]" 1
2118 1 96 GLN QE 1 96 GLN QG 3.040 . 3.040 2.153 2.115 2.198 . 0 0 "[ . 1 . 2]" 1
2119 1 96 GLN QG 1 97 ARG H 5.340 . 5.340 4.301 4.095 4.445 . 0 0 "[ . 1 . 2]" 1
2120 1 96 GLN QG 1 99 LEU QD 5.010 . 5.010 4.326 3.858 4.524 . 0 0 "[ . 1 . 2]" 1
2121 1 96 GLN QE 1 99 LEU QD 3.360 . 3.360 3.184 2.892 3.411 0.051 3 0 "[ . 1 . 2]" 1
2122 1 97 ARG H 1 97 ARG QG 3.100 . 3.100 2.234 2.098 2.379 . 0 0 "[ . 1 . 2]" 1
2123 1 97 ARG H 1 97 ARG QD 4.150 . 4.150 3.658 3.038 4.200 0.050 12 0 "[ . 1 . 2]" 1
2124 1 97 ARG H 1 98 LEU QD 4.330 . 4.330 3.503 3.332 3.608 . 0 0 "[ . 1 . 2]" 1
2125 1 97 ARG HA 1 97 ARG QG 3.220 . 3.220 2.869 2.723 3.049 . 0 0 "[ . 1 . 2]" 1
2126 1 97 ARG HA 1 97 ARG QD 3.500 . 3.500 2.306 1.788 3.290 0.012 17 0 "[ . 1 . 2]" 1
2127 1 97 ARG HA 1 101 LEU QD 5.090 . 5.090 3.974 3.563 4.254 . 0 0 "[ . 1 . 2]" 1
2128 1 97 ARG QB 1 97 ARG QD 3.370 . 3.370 2.467 2.249 2.854 . 0 0 "[ . 1 . 2]" 1
2129 1 97 ARG QB 1 101 LEU QD 4.660 . 4.660 3.413 3.273 3.545 . 0 0 "[ . 1 . 2]" 1
2130 1 97 ARG QG 1 98 LEU H 3.940 . 3.940 3.875 3.762 3.957 0.017 7 0 "[ . 1 . 2]" 1
2131 1 97 ARG QG 1 98 LEU QD 4.850 . 4.850 4.136 3.929 4.230 . 0 0 "[ . 1 . 2]" 1
2132 1 97 ARG QD 1 98 LEU H 5.340 . 5.340 4.848 4.606 5.119 . 0 0 "[ . 1 . 2]" 1
2133 1 98 LEU H 1 98 LEU QB 3.380 . 3.380 2.867 2.806 2.979 . 0 0 "[ . 1 . 2]" 1
2134 1 98 LEU H 1 98 LEU QD 3.390 . 3.390 1.822 1.730 2.020 0.070 7 0 "[ . 1 . 2]" 1
2135 1 98 LEU H 1 101 LEU QD 4.470 . 4.470 3.948 3.669 4.141 . 0 0 "[ . 1 . 2]" 1
2136 1 98 LEU H 1 109 LEU QD 5.440 . 5.440 4.418 4.316 4.504 . 0 0 "[ . 1 . 2]" 1
2137 1 98 LEU HA 1 101 LEU QB 4.560 . 4.560 2.219 1.970 2.634 . 0 0 "[ . 1 . 2]" 1
2138 1 98 LEU HA 1 101 LEU QD 3.260 . 3.260 2.082 1.783 2.372 0.017 4 0 "[ . 1 . 2]" 1
2139 1 98 LEU QB 1 98 LEU QD 2.780 . 2.780 1.859 1.846 1.875 . 0 0 "[ . 1 . 2]" 1
2140 1 98 LEU QB 1 99 LEU H 3.540 . 3.540 2.826 2.730 2.997 . 0 0 "[ . 1 . 2]" 1
2141 1 98 LEU QB 1 102 LEU MD2 4.570 . 4.570 2.704 2.576 2.875 . 0 0 "[ . 1 . 2]" 1
2142 1 98 LEU QB 1 109 LEU HB3 3.900 . 3.900 4.035 3.961 4.110 0.210 7 0 "[ . 1 . 2]" 1
2143 1 98 LEU QD 1 99 LEU H 3.890 . 3.890 2.927 2.427 3.118 . 0 0 "[ . 1 . 2]" 1
2144 1 98 LEU QD 1 99 LEU HB2 5.440 . 5.440 4.250 3.731 4.614 . 0 0 "[ . 1 . 2]" 1
2145 1 98 LEU QD 1 101 LEU QD 4.950 . 4.950 3.576 3.371 3.774 . 0 0 "[ . 1 . 2]" 1
2146 1 98 LEU QD 1 109 LEU QD 2.910 . 2.910 1.775 1.695 2.004 0.105 15 0 "[ . 1 . 2]" 1
2147 1 99 LEU H 1 99 LEU QD 4.010 . 4.010 3.669 3.642 3.778 . 0 0 "[ . 1 . 2]" 1
2148 1 99 LEU HA 1 99 LEU QD 2.920 . 2.920 2.053 1.961 2.357 . 0 0 "[ . 1 . 2]" 1
2149 1 99 LEU HA 1 102 LEU QB 4.920 . 4.920 4.439 4.227 4.579 . 0 0 "[ . 1 . 2]" 1
2150 1 99 LEU HB2 1 99 LEU QD 2.760 . 2.760 2.410 2.101 2.482 . 0 0 "[ . 1 . 2]" 1
2151 1 99 LEU HB3 1 99 LEU QD 2.730 . 2.730 2.182 2.167 2.201 . 0 0 "[ . 1 . 2]" 1
2152 1 99 LEU QD 1 100 LYS H 3.350 . 3.350 3.019 2.890 3.245 . 0 0 "[ . 1 . 2]" 1
2153 1 99 LEU QD 1 100 LYS HA 3.410 . 3.410 2.832 2.612 3.586 0.176 18 0 "[ . 1 . 2]" 1
2154 1 99 LEU QD 1 100 LYS QG 3.910 . 3.910 2.959 2.794 3.399 . 0 0 "[ . 1 . 2]" 1
2155 1 99 LEU QD 1 100 LYS QD 4.180 . 4.180 3.435 3.008 4.018 . 0 0 "[ . 1 . 2]" 1
2156 1 99 LEU QD 1 100 LYS QE 5.210 . 5.210 4.771 4.475 5.229 0.019 17 0 "[ . 1 . 2]" 1
2157 1 99 LEU QD 1 101 LEU H 4.940 . 4.940 4.416 4.267 4.959 0.019 4 0 "[ . 1 . 2]" 1
2158 1 99 LEU QD 1 102 LEU MD1 2.970 . 2.970 2.134 1.941 2.315 . 0 0 "[ . 1 . 2]" 1
2159 1 99 LEU QD 1 103 GLU H 4.470 . 4.470 3.726 3.451 4.063 . 0 0 "[ . 1 . 2]" 1
2160 1 99 LEU QD 1 103 GLU HA 5.030 . 5.030 4.583 4.382 4.881 . 0 0 "[ . 1 . 2]" 1
2161 1 99 LEU QD 1 103 GLU QB 4.100 . 4.100 3.265 3.024 3.741 . 0 0 "[ . 1 . 2]" 1
2162 1 99 LEU QD 1 103 GLU HG2 3.000 . 3.000 2.424 2.217 2.603 . 0 0 "[ . 1 . 2]" 1
2163 1 99 LEU QD 1 103 GLU HG3 3.220 . 3.220 2.335 2.023 2.723 . 0 0 "[ . 1 . 2]" 1
2164 1 100 LYS H 1 100 LYS QD 4.580 . 4.580 4.218 3.993 4.484 . 0 0 "[ . 1 . 2]" 1
2165 1 100 LYS H 1 101 LEU QD 4.700 . 4.700 4.255 3.635 4.650 . 0 0 "[ . 1 . 2]" 1
2166 1 100 LYS HA 1 100 LYS QD 2.980 . 2.980 1.922 1.788 2.136 0.012 14 0 "[ . 1 . 2]" 1
2167 1 100 LYS HB2 1 100 LYS QD 3.660 . 3.660 3.508 3.479 3.529 . 0 0 "[ . 1 . 2]" 1
2168 1 100 LYS HB3 1 100 LYS QD 3.270 . 3.270 2.966 2.894 3.018 . 0 0 "[ . 1 . 2]" 1
2169 1 100 LYS HB3 1 101 LEU QD 4.080 . 4.080 3.386 3.021 3.754 . 0 0 "[ . 1 . 2]" 1
2170 1 100 LYS QG 1 101 LEU QD 5.380 . 5.380 4.758 4.324 5.098 . 0 0 "[ . 1 . 2]" 1
2171 1 100 LYS QD 1 101 LEU H 5.040 . 5.040 4.965 4.701 5.051 0.011 4 0 "[ . 1 . 2]" 1
2172 1 100 LYS QD 1 103 GLU QB 4.360 . 4.360 2.730 2.550 2.950 . 0 0 "[ . 1 . 2]" 1
2173 1 100 LYS QD 1 103 GLU HG3 4.390 . 4.390 3.769 3.357 4.063 . 0 0 "[ . 1 . 2]" 1
2174 1 100 LYS QD 1 104 ASP H 4.120 . 4.120 4.096 3.769 4.194 0.074 6 0 "[ . 1 . 2]" 1
2175 1 100 LYS QE 1 101 LEU QD 4.340 . 4.340 4.037 3.254 4.334 . 0 0 "[ . 1 . 2]" 1
2176 1 100 LYS QE 1 104 ASP QB 4.500 . 4.500 2.186 1.954 2.420 . 0 0 "[ . 1 . 2]" 1
2177 1 101 LEU H 1 101 LEU QB 3.200 . 3.200 2.310 2.073 2.452 . 0 0 "[ . 1 . 2]" 1
2178 1 101 LEU H 1 101 LEU QD 3.140 . 3.140 2.811 2.084 3.118 . 0 0 "[ . 1 . 2]" 1
2179 1 101 LEU H 1 109 LEU QD 5.160 . 5.160 4.407 4.141 4.595 . 0 0 "[ . 1 . 2]" 1
2180 1 101 LEU HA 1 101 LEU QD 2.660 . 2.660 1.973 1.855 2.043 . 0 0 "[ . 1 . 2]" 1
2181 1 101 LEU HA 1 104 ASP QB 3.830 . 3.830 3.166 2.895 3.461 . 0 0 "[ . 1 . 2]" 1
2182 1 101 LEU HA 1 106 SER QB 4.770 . 4.770 2.586 2.301 2.871 . 0 0 "[ . 1 . 2]" 1
2183 1 101 LEU HA 1 109 LEU QD 5.440 . 5.440 4.958 4.704 5.135 . 0 0 "[ . 1 . 2]" 1
2184 1 101 LEU QB 1 101 LEU QD 2.780 . 2.780 1.968 1.954 2.035 . 0 0 "[ . 1 . 2]" 1
2185 1 101 LEU QB 1 102 LEU H 3.480 . 3.480 2.694 2.599 2.866 . 0 0 "[ . 1 . 2]" 1
2186 1 101 LEU QB 1 106 SER H 4.440 . 4.440 3.710 3.429 4.131 . 0 0 "[ . 1 . 2]" 1
2187 1 101 LEU QB 1 109 LEU QD 3.610 . 3.610 2.634 2.414 2.785 . 0 0 "[ . 1 . 2]" 1
2188 1 101 LEU QB 1 110 LEU HG 4.710 . 4.710 3.254 2.826 3.470 . 0 0 "[ . 1 . 2]" 1
2189 1 101 LEU HG 1 106 SER QB 4.420 . 4.420 3.491 1.777 4.454 0.034 3 0 "[ . 1 . 2]" 1
2190 1 101 LEU HG 1 109 LEU QD 4.990 . 4.990 4.385 3.672 4.537 . 0 0 "[ . 1 . 2]" 1
2191 1 101 LEU QD 1 102 LEU H 4.560 . 4.560 4.077 3.727 4.183 . 0 0 "[ . 1 . 2]" 1
2192 1 101 LEU QD 1 104 ASP H 5.220 . 5.220 4.782 4.575 4.939 . 0 0 "[ . 1 . 2]" 1
2193 1 101 LEU QD 1 104 ASP QB 4.350 . 4.350 3.796 3.553 4.025 . 0 0 "[ . 1 . 2]" 1
2194 1 101 LEU QD 1 106 SER H 4.090 . 4.090 3.773 3.507 4.098 0.008 13 0 "[ . 1 . 2]" 1
2195 1 101 LEU QD 1 106 SER QB 3.390 . 3.390 2.133 1.739 2.727 0.061 4 0 "[ . 1 . 2]" 1
2196 1 101 LEU QD 1 108 LEU H 4.040 . 4.040 3.384 3.094 3.822 . 0 0 "[ . 1 . 2]" 1
2197 1 101 LEU QD 1 108 LEU QB 3.260 . 3.260 1.967 1.778 2.233 0.022 8 0 "[ . 1 . 2]" 1
2198 1 101 LEU QD 1 109 LEU H 3.550 . 3.550 2.538 2.184 3.167 . 0 0 "[ . 1 . 2]" 1
2199 1 101 LEU QD 1 109 LEU HA 4.020 . 4.020 3.467 3.060 4.112 0.092 4 0 "[ . 1 . 2]" 1
2200 1 101 LEU QD 1 109 LEU HB2 4.270 . 4.270 2.015 1.757 2.307 0.043 13 0 "[ . 1 . 2]" 1
2201 1 101 LEU QD 1 109 LEU HB3 3.490 . 3.490 2.481 2.113 2.945 . 0 0 "[ . 1 . 2]" 1
2202 1 101 LEU QD 1 109 LEU HG 4.830 . 4.830 4.314 4.115 4.573 . 0 0 "[ . 1 . 2]" 1
2203 1 80 ALA MB 1 101 LEU QD 4.660 . 4.660 4.146 3.825 4.411 . 0 0 "[ . 1 . 2]" 1
2204 1 101 LEU QD 1 109 LEU QD 3.680 . 3.680 2.839 2.715 2.962 . 0 0 "[ . 1 . 2]" 1
2205 1 101 LEU QD 1 110 LEU H 4.560 . 4.560 4.135 3.935 4.509 . 0 0 "[ . 1 . 2]" 1
2206 1 102 LEU H 1 102 LEU QB 3.090 . 3.090 2.779 2.738 2.843 . 0 0 "[ . 1 . 2]" 1
2207 1 102 LEU H 1 109 LEU QD 4.080 . 4.080 3.611 3.405 3.818 . 0 0 "[ . 1 . 2]" 1
2208 1 102 LEU HA 1 105 LYS QD 4.260 . 4.260 2.958 2.673 3.247 . 0 0 "[ . 1 . 2]" 1
2209 1 102 LEU HA 1 109 LEU QD 4.020 . 4.020 3.956 3.618 4.087 0.067 15 0 "[ . 1 . 2]" 1
2210 1 102 LEU QB 1 103 GLU H 3.790 . 3.790 3.607 3.469 3.724 . 0 0 "[ . 1 . 2]" 1
2211 1 102 LEU QB 1 103 GLU HA 5.340 . 5.340 4.403 4.275 4.495 . 0 0 "[ . 1 . 2]" 1
2212 1 102 LEU QB 1 109 LEU QD 3.890 . 3.890 2.885 2.558 3.063 . 0 0 "[ . 1 . 2]" 1
2213 1 102 LEU QB 1 110 LEU MD2 4.300 . 4.300 2.614 2.384 2.842 . 0 0 "[ . 1 . 2]" 1
2214 1 102 LEU HG 1 109 LEU QD 5.190 . 5.190 4.164 3.817 4.392 . 0 0 "[ . 1 . 2]" 1
2215 1 103 GLU HA 1 105 LYS QD 5.340 . 5.340 4.463 3.702 4.890 . 0 0 "[ . 1 . 2]" 1
2216 1 104 ASP H 1 104 ASP QB 2.940 . 2.940 2.268 2.182 2.322 . 0 0 "[ . 1 . 2]" 1
2217 1 104 ASP H 1 105 LYS QD 5.020 . 5.020 4.832 4.379 5.028 0.008 12 0 "[ . 1 . 2]" 1
2218 1 104 ASP QB 1 105 LYS H 3.730 . 3.730 3.067 2.967 3.158 . 0 0 "[ . 1 . 2]" 1
2219 1 104 ASP QB 1 105 LYS HG2 5.100 . 5.100 5.066 4.947 5.145 0.045 6 0 "[ . 1 . 2]" 1
2220 1 105 LYS H 1 105 LYS QD 3.620 . 3.620 3.045 2.697 3.253 . 0 0 "[ . 1 . 2]" 1
2221 1 105 LYS HA 1 105 LYS QD 3.730 . 3.730 1.976 1.846 2.069 . 0 0 "[ . 1 . 2]" 1
2222 1 105 LYS QD 1 106 SER H 5.210 . 5.210 4.393 4.224 4.580 . 0 0 "[ . 1 . 2]" 1
2223 1 105 LYS QD 1 110 LEU MD1 4.930 . 4.930 2.463 2.193 2.789 . 0 0 "[ . 1 . 2]" 1
2224 1 105 LYS QD 1 110 LEU MD2 4.720 . 4.720 3.834 3.552 4.159 . 0 0 "[ . 1 . 2]" 1
2225 1 106 SER H 1 106 SER QB 3.250 . 3.250 2.516 2.433 2.612 . 0 0 "[ . 1 . 2]" 1
2226 1 106 SER QB 1 108 LEU H 4.430 . 4.430 2.696 2.622 2.827 . 0 0 "[ . 1 . 2]" 1
2227 1 106 SER QB 1 108 LEU MD1 5.340 . 5.340 4.188 4.115 4.281 . 0 0 "[ . 1 . 2]" 1
2228 1 106 SER QB 1 108 LEU MD2 4.080 . 4.080 1.897 1.801 2.040 . 0 0 "[ . 1 . 2]" 1
2229 1 107 ASN HA 1 110 LEU QB 3.990 . 3.990 2.485 2.198 2.842 . 0 0 "[ . 1 . 2]" 1
2230 1 107 ASN QD 1 108 LEU H 4.460 . 4.460 4.074 2.714 4.564 0.104 9 0 "[ . 1 . 2]" 1
2231 1 107 ASN QD 1 108 LEU MD1 4.060 . 4.060 3.179 2.524 3.794 . 0 0 "[ . 1 . 2]" 1
2232 1 108 LEU H 1 108 LEU QB 3.100 . 3.100 2.414 2.390 2.442 . 0 0 "[ . 1 . 2]" 1
2233 1 108 LEU QB 1 108 LEU MD1 2.690 . 2.690 2.437 2.422 2.455 . 0 0 "[ . 1 . 2]" 1
2234 1 108 LEU QB 1 108 LEU MD2 2.660 . 2.660 2.206 2.194 2.220 . 0 0 "[ . 1 . 2]" 1
2235 1 108 LEU QB 1 109 LEU H 3.440 . 3.440 2.653 2.545 2.756 . 0 0 "[ . 1 . 2]" 1
2236 1 109 LEU H 1 109 LEU QD 4.280 . 4.280 3.845 3.804 3.881 . 0 0 "[ . 1 . 2]" 1
2237 1 109 LEU HA 1 109 LEU QD 3.020 . 3.020 2.278 2.166 2.473 . 0 0 "[ . 1 . 2]" 1
2238 1 109 LEU HB3 1 109 LEU QD 2.970 . 2.970 2.146 2.098 2.191 . 0 0 "[ . 1 . 2]" 1
2239 1 109 LEU QD 1 110 LEU H 3.890 . 3.890 4.110 4.006 4.198 0.308 5 0 "[ . 1 . 2]" 1
2240 1 109 LEU QD 1 110 LEU HA 4.940 . 4.940 4.099 3.945 4.242 . 0 0 "[ . 1 . 2]" 1
2241 1 109 LEU QD 1 110 LEU QB 5.280 . 5.280 4.514 4.386 4.669 . 0 0 "[ . 1 . 2]" 1
2242 1 109 LEU QD 1 110 LEU HG 3.350 . 3.350 3.169 2.916 3.366 0.016 19 0 "[ . 1 . 2]" 1
2243 1 109 LEU QD 1 111 TYR H 5.440 . 5.440 4.962 4.821 5.133 . 0 0 "[ . 1 . 2]" 1
2244 1 109 LEU QD 1 111 TYR QE 5.420 . 5.420 4.820 4.401 5.086 . 0 0 "[ . 1 . 2]" 1
2245 1 110 LEU H 1 110 LEU QB 3.400 . 3.400 2.586 2.530 2.653 . 0 0 "[ . 1 . 2]" 1
2246 1 110 LEU QB 1 110 LEU MD2 2.980 . 2.980 2.227 2.192 2.257 . 0 0 "[ . 1 . 2]" 1
2247 1 110 LEU QB 1 111 TYR H 4.140 . 4.140 3.690 3.604 3.746 . 0 0 "[ . 1 . 2]" 1
2248 1 111 TYR QD 1 113 CYS QB 4.080 . 4.080 2.968 2.798 3.193 . 0 0 "[ . 1 . 2]" 1
2249 1 112 SER H 1 112 SER QB 3.620 . 3.620 2.485 2.278 2.765 . 0 0 "[ . 1 . 2]" 1
2250 1 112 SER QB 1 113 CYS H 4.020 . 4.020 3.026 2.712 3.581 . 0 0 "[ . 1 . 2]" 1
2251 1 113 CYS QB 1 115 CYS H 4.730 . 4.730 3.969 3.531 4.121 . 0 0 "[ . 1 . 2]" 1
2252 1 114 ASN HA 1 114 ASN QD 4.230 . 4.230 2.898 1.825 3.832 . 0 0 "[ . 1 . 2]" 1
2253 1 114 ASN QB 1 114 ASN QD 3.100 . 3.100 2.256 2.132 2.658 . 0 0 "[ . 1 . 2]" 1
2254 1 114 ASN QD 1 117 PHE HA 3.540 . 3.540 2.677 2.118 3.214 . 0 0 "[ . 1 . 2]" 1
2255 1 115 CYS HA 1 116 LYS QG 5.340 . 5.340 4.888 4.387 5.186 . 0 0 "[ . 1 . 2]" 1
2256 1 116 LYS HA 1 116 LYS QG 3.660 . 3.660 3.351 3.329 3.364 . 0 0 "[ . 1 . 2]" 1
2257 1 116 LYS QE 1 116 LYS QG 3.020 . 3.020 2.328 2.264 2.378 . 0 0 "[ . 1 . 2]" 1
2258 1 116 LYS QG 1 117 PHE HA 5.340 . 5.340 4.205 4.110 4.312 . 0 0 "[ . 1 . 2]" 1
2259 1 116 LYS QG 1 117 PHE QD 3.810 . 3.810 2.287 1.788 2.807 0.012 1 0 "[ . 1 . 2]" 1
2260 1 116 LYS QG 1 117 PHE QE 4.830 . 4.830 3.217 3.041 3.615 . 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 82
_Distance_constraint_stats_list.Viol_count 120
_Distance_constraint_stats_list.Viol_total 77.462
_Distance_constraint_stats_list.Viol_max 0.123
_Distance_constraint_stats_list.Viol_rms 0.0109
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0024
_Distance_constraint_stats_list.Viol_average_violations_only 0.0323
_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 24 ASP 0.522 0.074 11 0 "[ . 1 . 2]"
1 25 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 LYS 0.562 0.074 11 0 "[ . 1 . 2]"
1 29 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 LEU 0.040 0.030 3 0 "[ . 1 . 2]"
1 33 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 ASP 0.291 0.052 4 0 "[ . 1 . 2]"
1 42 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 VAL 0.284 0.049 4 0 "[ . 1 . 2]"
1 48 GLU 0.013 0.013 14 0 "[ . 1 . 2]"
1 50 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 TYR 0.013 0.013 14 0 "[ . 1 . 2]"
1 68 TYR 0.060 0.027 11 0 "[ . 1 . 2]"
1 69 GLY 0.284 0.049 4 0 "[ . 1 . 2]"
1 70 PHE 0.082 0.016 11 0 "[ . 1 . 2]"
1 71 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 PHE 1.175 0.087 15 0 "[ . 1 . 2]"
1 73 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 HIS 0.291 0.052 4 0 "[ . 1 . 2]"
1 77 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 ALA 1.175 0.087 15 0 "[ . 1 . 2]"
1 82 GLY 0.082 0.016 11 0 "[ . 1 . 2]"
1 84 SER 0.060 0.027 11 0 "[ . 1 . 2]"
1 86 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 88 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 ILE 0.116 0.044 18 0 "[ . 1 . 2]"
1 94 MET 1.075 0.123 7 0 "[ . 1 . 2]"
1 95 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 ARG 0.328 0.061 4 0 "[ . 1 . 2]"
1 98 LEU 1.075 0.123 7 0 "[ . 1 . 2]"
1 99 LEU 0.003 0.003 14 0 "[ . 1 . 2]"
1 100 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 LEU 0.212 0.061 4 0 "[ . 1 . 2]"
1 102 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 GLU 0.003 0.003 14 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 42 GLY H 1 73 PHE O 1.900 . 2.500 2.010 1.849 2.273 . 0 0 "[ . 1 . 2]" 2
2 1 44 LYS H 1 71 SER O 1.900 . 2.500 1.805 1.700 2.046 . 0 0 "[ . 1 . 2]" 2
3 1 46 VAL H 1 69 GLY O 1.900 . 2.500 2.475 2.132 2.549 0.049 4 0 "[ . 1 . 2]" 2
4 1 48 GLU H 1 67 TYR O 1.900 . 2.500 1.771 1.679 1.887 . 0 0 "[ . 1 . 2]" 2
5 1 50 VAL H 1 65 THR O 1.900 . 2.500 1.969 1.677 2.267 . 0 0 "[ . 1 . 2]" 2
6 1 48 GLU O 1 67 TYR H 1.900 . 2.500 2.132 1.894 2.513 0.013 14 0 "[ . 1 . 2]" 2
7 1 68 TYR H 1 84 SER O 1.900 . 2.500 1.780 1.666 1.992 . 0 0 "[ . 1 . 2]" 2
8 1 46 VAL O 1 69 GLY H 1.900 . 2.500 1.921 1.692 2.067 . 0 0 "[ . 1 . 2]" 2
9 1 70 PHE H 1 82 GLY O 1.900 . 2.500 2.431 2.209 2.516 0.016 11 0 "[ . 1 . 2]" 2
10 1 44 LYS O 1 71 SER H 1.900 . 2.500 2.101 1.875 2.450 . 0 0 "[ . 1 . 2]" 2
11 1 72 PHE H 1 80 ALA O 1.900 . 2.500 1.796 1.714 1.878 . 0 0 "[ . 1 . 2]" 2
12 1 42 GLY O 1 73 PHE H 1.900 . 2.500 1.764 1.715 1.854 . 0 0 "[ . 1 . 2]" 2
13 1 74 ARG H 1 77 ASN O 1.900 . 2.500 1.974 1.809 2.157 . 0 0 "[ . 1 . 2]" 2
14 1 40 ASP O 1 75 HIS H 1.900 . 2.500 2.482 2.354 2.552 0.052 4 0 "[ . 1 . 2]" 2
15 1 72 PHE O 1 79 VAL H 1.900 . 2.500 2.019 1.911 2.143 . 0 0 "[ . 1 . 2]" 2
16 1 72 PHE O 1 80 ALA H 1.900 . 2.500 2.559 2.526 2.587 0.087 15 0 "[ . 1 . 2]" 2
17 1 70 PHE O 1 82 GLY H 1.900 . 2.500 1.756 1.685 1.897 . 0 0 "[ . 1 . 2]" 2
18 1 68 TYR O 1 84 SER H 1.900 . 2.500 2.339 2.026 2.527 0.027 11 0 "[ . 1 . 2]" 2
19 1 24 ASP O 1 28 LYS H 1.900 . 2.500 2.505 2.298 2.574 0.074 11 0 "[ . 1 . 2]" 2
20 1 25 ILE O 1 29 VAL H 1.900 . 2.500 1.933 1.785 2.163 . 0 0 "[ . 1 . 2]" 2
21 1 26 GLU O 1 30 TYR H 1.900 . 2.500 2.184 1.950 2.447 . 0 0 "[ . 1 . 2]" 2
22 1 27 HIS O 1 31 GLN H 1.900 . 2.500 2.005 1.816 2.197 . 0 0 "[ . 1 . 2]" 2
23 1 28 LYS O 1 32 LEU H 1.900 . 2.500 2.438 2.328 2.530 0.030 3 0 "[ . 1 . 2]" 2
24 1 29 VAL O 1 33 LEU H 1.900 . 2.500 2.218 1.979 2.385 . 0 0 "[ . 1 . 2]" 2
25 1 30 TYR O 1 34 LYS H 1.900 . 2.500 2.115 1.871 2.351 . 0 0 "[ . 1 . 2]" 2
26 1 32 LEU O 1 36 GLN H 1.900 . 2.500 2.009 1.809 2.235 . 0 0 "[ . 1 . 2]" 2
27 1 33 LEU O 1 38 CYS H 1.900 . 2.500 1.892 1.687 2.022 . 0 0 "[ . 1 . 2]" 2
28 1 86 LYS O 1 90 ALA H 1.900 . 2.500 1.960 1.793 2.245 . 0 0 "[ . 1 . 2]" 2
29 1 87 VAL O 1 91 LYS H 1.900 . 2.500 1.996 1.780 2.176 . 0 0 "[ . 1 . 2]" 2
30 1 88 ALA O 1 92 TYR H 1.900 . 2.500 2.050 1.848 2.394 . 0 0 "[ . 1 . 2]" 2
31 1 89 ASN O 1 93 ILE H 1.900 . 2.500 2.094 1.921 2.223 . 0 0 "[ . 1 . 2]" 2
32 1 90 ALA O 1 94 MET H 1.900 . 2.500 2.293 2.046 2.484 . 0 0 "[ . 1 . 2]" 2
33 1 91 LYS O 1 95 LYS H 1.900 . 2.500 1.925 1.721 2.122 . 0 0 "[ . 1 . 2]" 2
34 1 92 TYR O 1 96 GLN H 1.900 . 2.500 2.025 1.880 2.149 . 0 0 "[ . 1 . 2]" 2
35 1 93 ILE O 1 97 ARG H 1.900 . 2.500 2.445 2.187 2.544 0.044 18 0 "[ . 1 . 2]" 2
36 1 94 MET O 1 98 LEU H 1.900 . 2.500 2.554 2.510 2.623 0.123 7 0 "[ . 1 . 2]" 2
37 1 95 LYS O 1 99 LEU H 1.900 . 2.500 1.971 1.853 2.129 . 0 0 "[ . 1 . 2]" 2
38 1 96 GLN O 1 100 LYS H 1.900 . 2.500 2.182 1.998 2.420 . 0 0 "[ . 1 . 2]" 2
39 1 97 ARG O 1 101 LEU H 1.900 . 2.500 2.463 2.251 2.561 0.061 4 0 "[ . 1 . 2]" 2
40 1 98 LEU O 1 102 LEU H 1.900 . 2.500 1.958 1.874 2.072 . 0 0 "[ . 1 . 2]" 2
41 1 99 LEU O 1 103 GLU H 1.900 . 2.500 2.149 1.752 2.503 0.003 14 0 "[ . 1 . 2]" 2
42 1 42 GLY N 1 73 PHE O 2.900 2.400 3.600 2.948 2.798 3.168 . 0 0 "[ . 1 . 2]" 2
43 1 44 LYS N 1 71 SER O 2.900 2.400 3.600 2.778 2.662 2.990 . 0 0 "[ . 1 . 2]" 2
44 1 46 VAL N 1 69 GLY O 2.900 2.400 3.600 3.352 3.054 3.499 . 0 0 "[ . 1 . 2]" 2
45 1 48 GLU N 1 67 TYR O 2.900 2.400 3.600 2.716 2.619 2.810 . 0 0 "[ . 1 . 2]" 2
46 1 50 VAL N 1 65 THR O 2.900 2.400 3.600 2.867 2.659 3.156 . 0 0 "[ . 1 . 2]" 2
47 1 48 GLU O 1 67 TYR N 2.900 2.400 3.600 3.004 2.820 3.335 . 0 0 "[ . 1 . 2]" 2
48 1 68 TYR N 1 84 SER O 2.900 2.400 3.600 2.692 2.615 2.841 . 0 0 "[ . 1 . 2]" 2
49 1 46 VAL O 1 69 GLY N 2.900 2.400 3.600 2.735 2.587 2.852 . 0 0 "[ . 1 . 2]" 2
50 1 70 PHE N 1 82 GLY O 2.900 2.400 3.600 3.187 3.022 3.315 . 0 0 "[ . 1 . 2]" 2
51 1 44 LYS O 1 71 SER N 2.900 2.400 3.600 3.015 2.784 3.285 . 0 0 "[ . 1 . 2]" 2
52 1 72 PHE N 1 80 ALA O 2.900 2.400 3.600 2.732 2.645 2.819 . 0 0 "[ . 1 . 2]" 2
53 1 42 GLY O 1 73 PHE N 2.900 2.400 3.600 2.693 2.638 2.817 . 0 0 "[ . 1 . 2]" 2
54 1 74 ARG N 1 77 ASN O 2.900 2.400 3.600 2.920 2.753 3.097 . 0 0 "[ . 1 . 2]" 2
55 1 40 ASP O 1 75 HIS N 2.900 2.400 3.600 3.341 3.192 3.483 . 0 0 "[ . 1 . 2]" 2
56 1 72 PHE O 1 79 VAL N 2.900 2.400 3.600 2.961 2.871 3.072 . 0 0 "[ . 1 . 2]" 2
57 1 72 PHE O 1 80 ALA N 2.900 2.400 3.600 3.536 3.499 3.569 . 0 0 "[ . 1 . 2]" 2
58 1 70 PHE O 1 82 GLY N 2.900 2.400 3.600 2.714 2.653 2.821 . 0 0 "[ . 1 . 2]" 2
59 1 68 TYR O 1 84 SER N 2.900 2.400 3.600 3.259 2.957 3.470 . 0 0 "[ . 1 . 2]" 2
60 1 24 ASP O 1 28 LYS N 2.900 2.400 3.600 3.425 3.189 3.506 . 0 0 "[ . 1 . 2]" 2
61 1 25 ILE O 1 29 VAL N 2.900 2.400 3.600 2.904 2.769 3.130 . 0 0 "[ . 1 . 2]" 2
62 1 26 GLU O 1 30 TYR N 2.900 2.400 3.600 3.115 2.896 3.355 . 0 0 "[ . 1 . 2]" 2
63 1 27 HIS O 1 31 GLN N 2.900 2.400 3.600 2.864 2.738 2.956 . 0 0 "[ . 1 . 2]" 2
64 1 28 LYS O 1 32 LEU N 2.900 2.400 3.600 3.355 3.230 3.443 . 0 0 "[ . 1 . 2]" 2
65 1 29 VAL O 1 33 LEU N 2.900 2.400 3.600 3.119 2.879 3.267 . 0 0 "[ . 1 . 2]" 2
66 1 30 TYR O 1 34 LYS N 2.900 2.400 3.600 3.046 2.821 3.261 . 0 0 "[ . 1 . 2]" 2
67 1 32 LEU O 1 36 GLN N 2.900 2.400 3.600 2.881 2.753 3.128 . 0 0 "[ . 1 . 2]" 2
68 1 33 LEU O 1 38 CYS N 2.900 2.400 3.600 2.783 2.642 2.875 . 0 0 "[ . 1 . 2]" 2
69 1 86 LYS O 1 90 ALA N 2.900 2.400 3.600 2.932 2.775 3.204 . 0 0 "[ . 1 . 2]" 2
70 1 87 VAL O 1 91 LYS N 2.900 2.400 3.600 2.942 2.725 3.112 . 0 0 "[ . 1 . 2]" 2
71 1 88 ALA O 1 92 TYR N 2.900 2.400 3.600 2.917 2.730 3.203 . 0 0 "[ . 1 . 2]" 2
72 1 89 ASN O 1 93 ILE N 2.900 2.400 3.600 3.032 2.854 3.143 . 0 0 "[ . 1 . 2]" 2
73 1 90 ALA O 1 94 MET N 2.900 2.400 3.600 3.273 3.027 3.468 . 0 0 "[ . 1 . 2]" 2
74 1 91 LYS O 1 95 LYS N 2.900 2.400 3.600 2.874 2.693 3.050 . 0 0 "[ . 1 . 2]" 2
75 1 92 TYR O 1 96 GLN N 2.900 2.400 3.600 2.976 2.830 3.083 . 0 0 "[ . 1 . 2]" 2
76 1 93 ILE O 1 97 ARG N 2.900 2.400 3.600 3.204 3.018 3.367 . 0 0 "[ . 1 . 2]" 2
77 1 94 MET O 1 98 LEU N 2.900 2.400 3.600 3.479 3.427 3.557 . 0 0 "[ . 1 . 2]" 2
78 1 95 LYS O 1 99 LEU N 2.900 2.400 3.600 2.877 2.765 3.021 . 0 0 "[ . 1 . 2]" 2
79 1 96 GLN O 1 100 LYS N 2.900 2.400 3.600 3.108 2.960 3.340 . 0 0 "[ . 1 . 2]" 2
80 1 97 ARG O 1 101 LEU N 2.900 2.400 3.600 3.301 3.069 3.451 . 0 0 "[ . 1 . 2]" 2
81 1 98 LEU O 1 102 LEU N 2.900 2.400 3.600 2.870 2.802 2.954 . 0 0 "[ . 1 . 2]" 2
82 1 99 LEU O 1 103 GLU N 2.900 2.400 3.600 3.008 2.694 3.311 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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