NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
526145 |
2lec   |
17707 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lec
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 1817
_Distance_constraint_stats_list.Viol_count 244
_Distance_constraint_stats_list.Viol_total 378.634
_Distance_constraint_stats_list.Viol_max 0.760
_Distance_constraint_stats_list.Viol_rms 0.0096
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0005
_Distance_constraint_stats_list.Viol_average_violations_only 0.0776
_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 36 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 TYR 0.330 0.165 17 0 "[ . 1 . 2]"
1 38 GLY 0.006 0.006 20 0 "[ . 1 . 2]"
1 39 ARG 0.025 0.025 1 0 "[ . 1 . 2]"
1 40 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 GLY 0.395 0.096 4 0 "[ . 1 . 2]"
1 47 MET 0.395 0.096 4 0 "[ . 1 . 2]"
1 48 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 LEU 0.055 0.055 19 0 "[ . 1 . 2]"
1 51 LYS 0.055 0.055 19 0 "[ . 1 . 2]"
1 52 VAL 1.190 0.192 12 0 "[ . 1 . 2]"
1 53 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 ASN 5.475 0.760 14 1 "[ . 1 +. 2]"
1 55 LEU 0.252 0.063 3 0 "[ . 1 . 2]"
1 56 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 TYR 0.166 0.166 15 0 "[ . 1 . 2]"
1 58 ARG 0.166 0.166 15 0 "[ . 1 . 2]"
1 59 THR 0.207 0.055 4 0 "[ . 1 . 2]"
1 60 SER 0.207 0.055 4 0 "[ . 1 . 2]"
1 61 PRO 0.005 0.005 20 0 "[ . 1 . 2]"
1 62 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 LEU 0.217 0.063 3 0 "[ . 1 . 2]"
1 65 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 VAL 0.121 0.044 6 0 "[ . 1 . 2]"
1 78 TYR 0.049 0.023 17 0 "[ . 1 . 2]"
1 79 ILE 0.005 0.005 20 0 "[ . 1 . 2]"
1 80 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 ASP 0.077 0.077 13 0 "[ . 1 . 2]"
1 83 ARG 0.275 0.099 5 0 "[ . 1 . 2]"
1 84 TYR 1.114 0.099 5 0 "[ . 1 . 2]"
1 85 THR 1.452 0.088 19 0 "[ . 1 . 2]"
1 86 LYS 0.520 0.072 14 0 "[ . 1 . 2]"
1 87 GLU 0.248 0.165 5 0 "[ . 1 . 2]"
1 88 SER 0.248 0.165 5 0 "[ . 1 . 2]"
1 89 ARG 0.269 0.078 18 0 "[ . 1 . 2]"
1 90 GLY 0.377 0.078 18 0 "[ . 1 . 2]"
1 91 PHE 0.143 0.058 20 0 "[ . 1 . 2]"
1 92 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 VAL 0.357 0.192 12 0 "[ . 1 . 2]"
1 95 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 HIS 0.007 0.007 8 0 "[ . 1 . 2]"
1 98 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 ARG 1.115 0.230 11 0 "[ . 1 . 2]"
1 101 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 105 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 ASP 0.137 0.033 17 0 "[ . 1 . 2]"
1 111 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 VAL 4.905 0.238 19 0 "[ . 1 . 2]"
1 114 LEU 1.285 0.183 4 0 "[ . 1 . 2]"
1 115 ASP 2.002 0.238 19 0 "[ . 1 . 2]"
1 116 GLY 1.040 0.186 17 0 "[ . 1 . 2]"
1 117 ARG 0.324 0.195 4 0 "[ . 1 . 2]"
1 118 GLU 5.070 0.760 14 1 "[ . 1 +. 2]"
1 119 LEU 2.241 0.361 17 0 "[ . 1 . 2]"
1 120 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 121 VAL 1.091 0.156 16 0 "[ . 1 . 2]"
1 122 GLN 0.255 0.102 4 0 "[ . 1 . 2]"
1 123 MET 0.255 0.102 4 0 "[ . 1 . 2]"
1 124 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 126 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 128 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 129 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 130 PRO 0.377 0.163 3 0 "[ . 1 . 2]"
1 131 ASP 0.422 0.163 3 0 "[ . 1 . 2]"
1 132 SER 0.321 0.086 18 0 "[ . 1 . 2]"
1 133 HIS 0.276 0.086 18 0 "[ . 1 . 2]"
1 134 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 135 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 1 U 0.013 0.013 6 0 "[ . 1 . 2]"
2 2 G 0.013 0.013 6 0 "[ . 1 . 2]"
2 3 G 0.049 0.023 17 0 "[ . 1 . 2]"
2 4 A 0.017 0.017 11 0 "[ . 1 . 2]"
2 5 G 0.023 0.023 8 0 "[ . 1 . 2]"
2 6 U 0.025 0.025 1 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 68 PHE QD 1 71 TYR QE 5.670 . 6.170 4.491 4.359 4.533 . 0 0 "[ . 1 . 2]" 1
2 1 65 ARG HA 1 68 PHE QD 5.900 . 6.400 5.021 4.857 5.245 . 0 0 "[ . 1 . 2]" 1
3 1 68 PHE QD 1 74 VAL QG 6.510 . 7.010 4.071 3.754 4.256 . 0 0 "[ . 1 . 2]" 1
4 1 68 PHE QD 1 96 PHE HZ 4.790 . 5.290 2.130 2.000 2.307 . 0 0 "[ . 1 . 2]" 1
5 1 71 TYR QE 1 96 PHE HZ 6.170 . 6.670 5.449 5.226 5.567 . 0 0 "[ . 1 . 2]" 1
6 1 74 VAL QG 1 96 PHE HZ 6.270 . 6.770 3.053 2.793 3.416 . 0 0 "[ . 1 . 2]" 1
7 1 94 VAL QG 1 96 PHE HZ 6.030 . 6.530 4.222 3.793 4.495 . 0 0 "[ . 1 . 2]" 1
8 1 68 PHE HB3 1 96 PHE HZ 4.860 . 5.360 1.887 1.838 1.956 . 0 0 "[ . 1 . 2]" 1
9 1 71 TYR HB2 1 96 PHE HZ 5.170 . 5.670 3.309 3.070 3.699 . 0 0 "[ . 1 . 2]" 1
10 1 96 PHE HZ 1 105 ALA MB 4.970 . 5.470 3.059 2.765 3.526 . 0 0 "[ . 1 . 2]" 1
11 1 68 PHE QD 1 71 TYR QD 5.930 . 6.430 4.113 3.917 4.274 . 0 0 "[ . 1 . 2]" 1
12 1 68 PHE HB3 1 71 TYR QD 5.410 . 5.910 4.185 4.116 4.307 . 0 0 "[ . 1 . 2]" 1
13 1 71 TYR QD 1 104 ASP QB 5.300 . 5.800 3.418 3.104 3.638 . 0 0 "[ . 1 . 2]" 1
14 1 71 TYR QD 1 109 MET QB 6.930 . 7.430 4.951 4.707 5.129 . 0 0 "[ . 1 . 2]" 1
15 1 70 LYS QD 1 71 TYR QD 6.630 . 7.130 4.448 3.725 4.545 . 0 0 "[ . 1 . 2]" 1
16 1 71 TYR QD 1 109 MET ME 7.400 . 7.900 3.547 3.466 3.873 . 0 0 "[ . 1 . 2]" 1
17 1 70 LYS HB3 1 71 TYR QD 5.590 . 6.090 4.937 4.814 5.015 . 0 0 "[ . 1 . 2]" 1
18 1 70 LYS QG 1 71 TYR QD 4.720 . 5.220 2.517 2.329 2.614 . 0 0 "[ . 1 . 2]" 1
19 1 67 VAL HA 1 71 TYR QD 6.170 . 6.670 5.400 5.267 5.521 . 0 0 "[ . 1 . 2]" 1
20 1 71 TYR QD 1 74 VAL QG 7.790 . 8.290 5.065 4.805 5.183 . 0 0 "[ . 1 . 2]" 1
21 1 68 PHE QD 1 96 PHE QD 6.390 . 6.890 4.517 4.359 4.694 . 0 0 "[ . 1 . 2]" 1
22 1 96 PHE QD 1 101 ASP HA 6.010 . 6.510 5.132 4.739 5.396 . 0 0 "[ . 1 . 2]" 1
23 1 96 PHE QD 1 101 ASP QB 5.090 . 5.590 3.012 2.513 3.757 . 0 0 "[ . 1 . 2]" 1
24 1 96 PHE QD 1 102 ALA HA 4.960 . 5.460 3.357 3.020 3.608 . 0 0 "[ . 1 . 2]" 1
25 1 73 ARG QB 1 96 PHE QD 6.930 . 7.430 5.544 5.487 5.581 . 0 0 "[ . 1 . 2]" 1
26 1 50 LEU QB 1 96 PHE QD 6.490 . 6.990 2.954 2.395 3.795 . 0 0 "[ . 1 . 2]" 1
27 1 74 VAL QG 1 96 PHE QD 6.490 . 6.990 3.178 2.920 3.552 . 0 0 "[ . 1 . 2]" 1
28 1 94 VAL QG 1 96 PHE QD 6.370 . 6.870 2.648 2.373 3.087 . 0 0 "[ . 1 . 2]" 1
29 1 37 TYR QD 1 38 GLY QA 6.820 . 7.320 5.470 5.373 5.563 . 0 0 "[ . 1 . 2]" 1
30 1 68 PHE QD 1 96 PHE QE 5.530 . 6.030 2.586 2.241 2.909 . 0 0 "[ . 1 . 2]" 1
31 1 68 PHE HA 1 96 PHE QE 5.800 . 6.300 4.425 4.278 4.557 . 0 0 "[ . 1 . 2]" 1
32 1 74 VAL QG 1 96 PHE QE 6.080 . 6.580 2.800 2.633 3.089 . 0 0 "[ . 1 . 2]" 1
33 1 68 PHE HB2 1 96 PHE QE 4.240 . 4.740 3.656 3.491 3.781 . 0 0 "[ . 1 . 2]" 1
34 1 68 PHE QE 1 96 PHE HZ 5.720 . 6.220 4.487 4.341 4.673 . 0 0 "[ . 1 . 2]" 1
35 1 68 PHE HZ 1 110 ASP HA 5.500 . 6.000 5.006 4.581 5.197 . 0 0 "[ . 1 . 2]" 1
36 1 51 LYS HA 1 93 PHE QD 5.990 . 6.490 4.686 4.208 5.074 . 0 0 "[ . 1 . 2]" 1
37 1 51 LYS HA 1 93 PHE HZ 5.500 . 6.000 5.003 4.546 5.452 . 0 0 "[ . 1 . 2]" 1
38 1 73 ARG HA 1 97 HIS HD2 5.140 . 5.640 5.277 5.143 5.326 . 0 0 "[ . 1 . 2]" 1
39 1 96 PHE HB2 1 97 HIS HD2 5.500 . 6.000 5.421 5.042 5.558 . 0 0 "[ . 1 . 2]" 1
40 1 97 HIS HD2 1 98 ASP HB3 5.500 . 6.000 5.275 4.764 5.574 . 0 0 "[ . 1 . 2]" 1
41 1 73 ARG QB 1 97 HIS HD2 4.210 . 4.710 3.691 3.315 3.791 . 0 0 "[ . 1 . 2]" 1
42 1 73 ARG QG 1 97 HIS HD2 4.360 . 4.860 2.011 1.933 2.161 . 0 0 "[ . 1 . 2]" 1
43 1 57 TYR QE 1 58 ARG HA 5.930 . 6.430 5.169 4.618 5.287 . 0 0 "[ . 1 . 2]" 1
44 1 36 SER HA 1 37 TYR QE 6.170 . 6.670 4.706 3.357 5.389 . 0 0 "[ . 1 . 2]" 1
45 1 78 TYR QD 1 80 PRO QD 6.930 . 7.430 3.481 2.142 4.848 . 0 0 "[ . 1 . 2]" 1
46 1 70 LYS QG 1 71 TYR QE 5.540 . 6.040 2.904 2.745 2.961 . 0 0 "[ . 1 . 2]" 1
47 1 68 PHE HA 1 71 TYR QE 4.240 . 4.740 2.958 2.847 3.053 . 0 0 "[ . 1 . 2]" 1
48 1 71 TYR QE 1 108 ALA HA 5.700 . 6.200 4.705 4.589 4.848 . 0 0 "[ . 1 . 2]" 1
49 1 71 TYR QE 1 104 ASP QB 6.820 . 7.320 5.069 4.729 5.339 . 0 0 "[ . 1 . 2]" 1
50 1 71 TYR QE 1 105 ALA HA 4.240 . 4.740 2.968 2.660 3.243 . 0 0 "[ . 1 . 2]" 1
51 1 71 TYR QE 1 109 MET QB 5.290 . 5.790 3.612 3.310 3.774 . 0 0 "[ . 1 . 2]" 1
52 1 71 TYR QE 1 109 MET ME 5.260 . 5.760 2.065 1.941 2.374 . 0 0 "[ . 1 . 2]" 1
53 1 71 TYR QE 1 105 ALA MB 5.540 . 6.040 3.853 3.606 4.112 . 0 0 "[ . 1 . 2]" 1
54 1 71 TYR QE 1 108 ALA MB 4.170 . 4.670 1.984 1.929 2.081 . 0 0 "[ . 1 . 2]" 1
55 1 78 TYR QE 1 80 PRO QG 6.480 . 6.980 4.062 2.514 5.209 . 0 0 "[ . 1 . 2]" 1
56 1 78 TYR QE 1 80 PRO HA 6.060 . 6.560 3.524 2.101 5.374 . 0 0 "[ . 1 . 2]" 1
57 1 55 LEU HB2 1 91 PHE QD 6.170 . 6.670 5.187 4.755 5.481 . 0 0 "[ . 1 . 2]" 1
58 1 55 LEU QD 1 91 PHE QD 8.320 . 8.820 4.466 4.221 4.645 . 0 0 "[ . 1 . 2]" 1
59 1 79 ILE MD 1 91 PHE QD 7.410 . 7.910 5.196 4.156 5.536 . 0 0 "[ . 1 . 2]" 1
60 1 53 ASP HA 1 91 PHE QD 5.240 . 5.740 3.968 3.398 4.470 . 0 0 "[ . 1 . 2]" 1
61 1 51 LYS QB 1 93 PHE HA 5.870 . 6.370 4.265 3.509 5.305 . 0 0 "[ . 1 . 2]" 1
62 1 53 ASP QB 1 91 PHE HA 5.510 . 6.010 3.965 3.545 4.285 . 0 0 "[ . 1 . 2]" 1
63 1 52 VAL QG 1 91 PHE HA 7.410 . 7.910 5.540 5.109 5.607 . 0 0 "[ . 1 . 2]" 1
64 1 55 LEU QD 1 91 PHE HA . . 5.820 2.095 1.984 2.239 . 0 0 "[ . 1 . 2]" 1
65 1 79 ILE MG 1 91 PHE HA 6.610 . 7.110 5.312 5.024 5.547 . 0 0 "[ . 1 . 2]" 1
66 1 53 ASP HA 1 91 PHE HB2 4.470 . 4.970 2.582 2.139 3.019 . 0 0 "[ . 1 . 2]" 1
67 1 53 ASP HA 1 55 LEU QD 6.030 . 6.530 2.649 2.448 2.964 . 0 0 "[ . 1 . 2]" 1
68 1 50 LEU HA 1 96 PHE QD 6.170 . 6.670 5.445 5.059 5.596 . 0 0 "[ . 1 . 2]" 1
69 1 69 GLU HA 1 74 VAL HA 5.500 . 6.000 5.218 4.827 5.440 . 0 0 "[ . 1 . 2]" 1
70 1 49 SER HA 1 96 PHE HB3 5.500 . 6.000 5.520 5.353 5.593 . 0 0 "[ . 1 . 2]" 1
71 1 69 GLU HA 1 96 PHE QE 5.290 . 5.790 4.531 4.354 4.730 . 0 0 "[ . 1 . 2]" 1
72 1 49 SER HA 1 95 ARG HA 5.500 . 6.000 4.222 3.621 4.701 . 0 0 "[ . 1 . 2]" 1
73 1 50 LEU HA 1 95 ARG HA 5.500 . 6.000 5.012 4.513 5.149 . 0 0 "[ . 1 . 2]" 1
74 1 97 HIS HB3 1 98 ASP HA 5.500 . 6.000 5.394 4.739 5.638 . 0 0 "[ . 1 . 2]" 1
75 1 50 LEU HA 1 102 ALA MB 6.060 . 6.560 3.930 3.563 4.109 . 0 0 "[ . 1 . 2]" 1
76 1 106 MET HA 1 121 VAL HA 5.500 . 6.000 5.444 5.193 5.594 . 0 0 "[ . 1 . 2]" 1
77 1 106 MET HA 1 122 GLN HA 5.500 . 6.000 5.560 5.509 5.643 . 0 0 "[ . 1 . 2]" 1
78 1 120 ARG HB2 1 121 VAL HA 5.370 . 5.870 5.069 4.940 5.183 . 0 0 "[ . 1 . 2]" 1
79 1 96 PHE HA 1 96 PHE QE 5.380 . 5.880 4.691 4.637 4.742 . 0 0 "[ . 1 . 2]" 1
80 1 74 VAL HA 1 96 PHE HA 3.850 . 4.350 2.585 2.296 2.943 . 0 0 "[ . 1 . 2]" 1
81 1 74 VAL QG 1 96 PHE HA 6.240 . 6.740 3.374 2.848 3.793 . 0 0 "[ . 1 . 2]" 1
82 1 51 LYS HA 1 93 PHE HA 4.790 . 5.290 4.787 4.313 4.947 . 0 0 "[ . 1 . 2]" 1
83 1 96 PHE HA 1 97 HIS HB3 5.500 . 6.000 5.101 4.583 5.445 . 0 0 "[ . 1 . 2]" 1
84 1 52 VAL HA 1 121 VAL HA 4.080 . 4.580 2.317 2.162 2.430 . 0 0 "[ . 1 . 2]" 1
85 1 91 PHE QE 1 92 ALA HA 6.170 . 6.670 4.942 4.670 5.510 . 0 0 "[ . 1 . 2]" 1
86 1 71 TYR QE 1 109 MET HA 6.170 . 6.670 5.365 5.195 5.498 . 0 0 "[ . 1 . 2]" 1
87 1 92 ALA HA 1 93 PHE QB 6.170 . 6.670 4.072 3.944 4.155 . 0 0 "[ . 1 . 2]" 1
88 1 52 VAL HA 1 121 VAL HB 4.610 . 5.110 3.598 2.616 4.832 . 0 0 "[ . 1 . 2]" 1
89 1 77 VAL HA 1 94 VAL HA 3.580 . 4.080 2.049 1.851 2.324 . 0 0 "[ . 1 . 2]" 1
90 1 77 VAL HA 1 94 VAL QG 5.510 . 6.010 2.364 1.905 2.833 . 0 0 "[ . 1 . 2]" 1
91 1 72 GLY QA 1 73 ARG QG 5.540 . 6.040 3.213 2.835 3.355 . 0 0 "[ . 1 . 2]" 1
92 1 72 GLY QA 1 96 PHE QD 6.900 . 7.400 4.752 4.375 5.073 . 0 0 "[ . 1 . 2]" 1
93 1 83 ARG HA 1 84 TYR HA 4.920 . 5.420 4.480 4.351 4.616 . 0 0 "[ . 1 . 2]" 1
94 1 44 VAL HA 1 47 MET HA 5.500 . 6.000 5.396 4.664 5.584 . 0 0 "[ . 1 . 2]" 1
95 1 84 TYR HA 1 85 THR HA 5.500 . 6.000 4.482 4.408 4.621 . 0 0 "[ . 1 . 2]" 1
96 1 48 THR HA 1 97 HIS HA 5.500 . 6.000 5.056 4.346 5.611 . 0 0 "[ . 1 . 2]" 1
97 1 54 ASN HA 1 117 ARG QD 6.170 . 6.670 3.707 3.027 4.247 . 0 0 "[ . 1 . 2]" 1
98 1 131 ASP HA 1 132 SER HA 5.500 . 6.000 4.390 4.164 4.833 . 0 0 "[ . 1 . 2]" 1
99 1 110 ASP HA 1 119 LEU HA 4.870 . 5.370 4.720 4.599 5.064 . 0 0 "[ . 1 . 2]" 1
100 1 60 SER QB 1 61 PRO HD2 3.230 . 3.730 1.859 1.819 1.913 . 0 0 "[ . 1 . 2]" 1
101 1 110 ASP HA 1 119 LEU QB 4.070 . 4.570 2.179 2.008 3.392 . 0 0 "[ . 1 . 2]" 1
102 1 82 ASP HA 1 84 TYR QE 5.400 . 5.900 4.243 3.293 4.939 . 0 0 "[ . 1 . 2]" 1
103 1 55 LEU HA 1 64 LEU QD 6.070 . 6.570 3.554 3.340 3.731 . 0 0 "[ . 1 . 2]" 1
104 1 54 ASN HD22 1 118 GLU HA 4.760 . 5.260 5.349 4.846 6.020 0.760 14 1 "[ . 1 +. 2]" 1
105 1 57 TYR QD 1 58 ARG HA 4.710 . 5.210 4.009 3.625 4.179 . 0 0 "[ . 1 . 2]" 1
106 1 107 ASP HA 1 110 ASP HB3 5.210 . 5.710 4.491 4.165 4.778 . 0 0 "[ . 1 . 2]" 1
107 1 78 TYR QE 1 79 ILE HA 6.170 . 6.670 5.362 4.531 5.653 . 0 0 "[ . 1 . 2]" 1
108 1 84 TYR QE 1 85 THR HA 6.170 . 6.670 5.549 5.177 5.674 . 0 0 "[ . 1 . 2]" 1
109 1 40 PRO HA 1 41 PRO QG 4.560 . 5.060 4.013 3.913 4.073 . 0 0 "[ . 1 . 2]" 1
110 1 85 THR HA 1 86 LYS QG 4.970 . 5.470 4.427 4.219 4.543 . 0 0 "[ . 1 . 2]" 1
111 1 40 PRO HA 1 41 PRO QB 6.130 . 6.630 4.559 4.439 4.627 . 0 0 "[ . 1 . 2]" 1
112 1 79 ILE HA 1 80 PRO QD 3.750 . 4.250 1.970 1.913 2.034 . 0 0 "[ . 1 . 2]" 1
113 1 96 PHE QE 1 101 ASP HA 6.030 . 6.530 5.027 4.748 5.318 . 0 0 "[ . 1 . 2]" 1
114 1 108 ALA HA 1 109 MET HA 4.660 . 5.160 4.426 4.401 4.449 . 0 0 "[ . 1 . 2]" 1
115 1 107 ASP QB 1 108 ALA HA . . 5.820 4.556 4.528 4.593 . 0 0 "[ . 1 . 2]" 1
116 1 64 LEU HA 1 68 PHE HB2 4.900 . 5.400 4.381 4.176 4.511 . 0 0 "[ . 1 . 2]" 1
117 1 64 LEU HA 1 65 ARG HA 5.150 . 5.650 4.719 4.675 4.753 . 0 0 "[ . 1 . 2]" 1
118 1 65 ARG HA 1 66 ARG HA 5.500 . 6.000 4.735 4.635 4.857 . 0 0 "[ . 1 . 2]" 1
119 1 100 ARG HA 1 103 GLU HG2 3.970 . 4.470 2.308 2.166 2.486 . 0 0 "[ . 1 . 2]" 1
120 1 66 ARG HA 1 69 GLU HB2 3.860 . 4.360 3.582 3.303 3.785 . 0 0 "[ . 1 . 2]" 1
121 1 100 ARG HA 1 103 GLU HG3 4.220 . 4.720 3.241 3.053 3.475 . 0 0 "[ . 1 . 2]" 1
122 1 64 LEU HA 1 67 VAL QG 4.650 . 5.150 3.226 3.176 3.276 . 0 0 "[ . 1 . 2]" 1
123 1 49 SER QB 1 93 PHE HZ 6.170 . 6.670 4.498 3.673 5.573 . 0 0 "[ . 1 . 2]" 1
124 1 66 ARG HA 1 69 GLU HB3 3.740 . 4.240 2.637 2.561 2.924 . 0 0 "[ . 1 . 2]" 1
125 1 55 LEU HA 1 59 THR HB 3.710 . 4.210 3.174 2.896 3.338 . 0 0 "[ . 1 . 2]" 1
126 1 60 SER QB 1 61 PRO HD3 4.550 . 5.050 3.170 3.084 3.260 . 0 0 "[ . 1 . 2]" 1
127 1 115 ASP QB 1 116 GLY HA3 5.170 . 5.670 4.572 4.392 4.647 . 0 0 "[ . 1 . 2]" 1
128 1 61 PRO HA 1 64 LEU HB3 3.880 . 4.380 3.179 2.921 3.487 . 0 0 "[ . 1 . 2]" 1
129 1 61 PRO HA 1 64 LEU HB2 3.460 . 3.960 2.234 2.137 2.356 . 0 0 "[ . 1 . 2]" 1
130 1 59 THR HB 1 64 LEU QD 5.310 . 5.810 3.696 3.475 3.944 . 0 0 "[ . 1 . 2]" 1
131 1 55 LEU QD 1 59 THR HB 5.080 . 5.390 2.080 1.933 2.142 . 0 0 "[ . 1 . 2]" 1
132 1 37 TYR QB 1 38 GLY QA 6.220 . 6.720 3.994 3.752 4.128 . 0 0 "[ . 1 . 2]" 1
133 1 60 SER QB 1 62 ASP QB 6.890 . 7.390 3.594 3.254 3.902 . 0 0 "[ . 1 . 2]" 1
134 1 78 TYR QD 1 80 PRO HA 5.840 . 6.340 4.516 3.815 5.211 . 0 0 "[ . 1 . 2]" 1
135 1 67 VAL HA 1 71 TYR QE 5.290 . 5.790 4.650 4.566 4.718 . 0 0 "[ . 1 . 2]" 1
136 1 67 VAL HA 1 68 PHE QD 6.150 . 6.650 4.850 4.722 5.010 . 0 0 "[ . 1 . 2]" 1
137 1 98 ASP HB3 1 99 LYS HA 5.500 . 6.000 4.937 4.802 5.067 . 0 0 "[ . 1 . 2]" 1
138 1 48 THR HB 1 99 LYS QE 5.860 . 6.360 3.787 3.462 4.234 . 0 0 "[ . 1 . 2]" 1
139 1 61 PRO HD2 1 79 ILE MG 6.610 . 7.110 5.544 5.400 5.581 . 0 0 "[ . 1 . 2]" 1
140 1 50 LEU QD 1 96 PHE HB3 6.690 . 7.190 3.856 3.514 4.483 . 0 0 "[ . 1 . 2]" 1
141 1 68 PHE QE 1 106 MET HA 5.140 . 5.640 4.252 4.046 4.506 . 0 0 "[ . 1 . 2]" 1
142 1 65 ARG HA 1 65 ARG QD 4.790 . 5.230 2.154 2.014 2.642 . 0 0 "[ . 1 . 2]" 1
143 1 106 MET HA 1 110 ASP HB2 5.240 . 5.740 3.200 2.784 3.502 . 0 0 "[ . 1 . 2]" 1
144 1 64 LEU HB3 1 65 ARG HA 4.740 . 5.240 4.125 4.020 4.191 . 0 0 "[ . 1 . 2]" 1
145 1 54 ASN HB3 1 119 LEU QD . . 6.550 3.968 3.587 4.540 . 0 0 "[ . 1 . 2]" 1
146 1 116 GLY HA2 1 117 ARG HA 4.700 . 5.200 4.596 4.510 4.719 . 0 0 "[ . 1 . 2]" 1
147 1 71 TYR HB3 1 96 PHE HZ 5.500 . 6.000 4.713 4.474 5.130 . 0 0 "[ . 1 . 2]" 1
148 1 70 LYS QG 1 71 TYR HB3 6.170 . 6.670 4.790 4.670 4.851 . 0 0 "[ . 1 . 2]" 1
149 1 71 TYR HB3 1 108 ALA MB 6.610 . 7.110 5.267 5.042 5.479 . 0 0 "[ . 1 . 2]" 1
150 1 42 PRO QD 1 44 VAL QG . . 7.250 3.572 2.206 3.691 . 0 0 "[ . 1 . 2]" 1
151 1 41 PRO QB 1 42 PRO QD 5.100 . 5.600 3.319 2.646 3.852 . 0 0 "[ . 1 . 2]" 1
152 1 65 ARG QD 1 69 GLU HA 6.170 . 6.670 4.088 3.916 4.318 . 0 0 "[ . 1 . 2]" 1
153 1 68 PHE HB3 1 69 GLU HA 5.500 . 6.000 4.448 4.341 4.545 . 0 0 "[ . 1 . 2]" 1
154 1 65 ARG QD 1 77 VAL QG 5.700 . 6.200 2.451 1.948 3.717 . 0 0 "[ . 1 . 2]" 1
155 1 52 VAL QG 1 68 PHE HB3 6.860 . 7.360 3.881 3.622 4.624 . 0 0 "[ . 1 . 2]" 1
156 1 110 ASP HB3 1 120 ARG HA 5.490 . 5.990 5.020 4.608 5.303 . 0 0 "[ . 1 . 2]" 1
157 1 117 ARG HA 1 117 ARG QD 4.730 . 5.230 4.031 3.712 4.304 . 0 0 "[ . 1 . 2]" 1
158 1 99 LYS QE 1 103 GLU HA 6.170 . 6.670 5.325 4.603 5.571 . 0 0 "[ . 1 . 2]" 1
159 1 73 ARG QG 1 98 ASP HB2 4.710 . 5.210 3.251 2.738 4.217 . 0 0 "[ . 1 . 2]" 1
160 1 55 LEU QD 1 91 PHE HB2 5.190 . 5.690 3.274 3.003 3.556 . 0 0 "[ . 1 . 2]" 1
161 1 54 ASN HB2 1 120 ARG QD 5.290 . 5.790 4.545 4.432 4.696 . 0 0 "[ . 1 . 2]" 1
162 1 68 PHE QD 1 71 TYR HB2 6.170 . 6.670 4.455 4.201 4.734 . 0 0 "[ . 1 . 2]" 1
163 1 68 PHE QE 1 105 ALA HA 6.170 . 6.670 4.687 4.517 4.925 . 0 0 "[ . 1 . 2]" 1
164 1 68 PHE QE 1 110 ASP HB2 6.170 . 6.670 5.514 5.356 5.575 . 0 0 "[ . 1 . 2]" 1
165 1 68 PHE HZ 1 110 ASP HB2 5.500 . 6.000 5.513 5.257 5.583 . 0 0 "[ . 1 . 2]" 1
166 1 105 ALA HA 1 108 ALA HA 5.500 . 6.000 5.538 5.515 5.575 . 0 0 "[ . 1 . 2]" 1
167 1 110 ASP HB2 1 119 LEU QD 7.270 . 7.770 4.917 4.708 5.115 . 0 0 "[ . 1 . 2]" 1
168 1 48 THR HB 1 96 PHE HB2 5.430 . 5.930 4.675 4.229 5.188 . 0 0 "[ . 1 . 2]" 1
169 1 61 PRO HD2 1 62 ASP QB 6.170 . 6.670 4.124 4.037 4.192 . 0 0 "[ . 1 . 2]" 1
170 1 74 VAL HA 1 96 PHE HB2 5.500 . 6.000 5.194 4.992 5.511 . 0 0 "[ . 1 . 2]" 1
171 1 66 ARG HA 1 69 GLU QG . . 5.350 4.392 4.343 4.417 . 0 0 "[ . 1 . 2]" 1
172 1 123 MET ME 1 123 MET HG2 3.750 . 4.250 2.377 2.338 2.416 . 0 0 "[ . 1 . 2]" 1
173 1 85 THR HB 1 87 GLU QG 3.700 . 4.200 2.880 2.127 3.368 . 0 0 "[ . 1 . 2]" 1
174 1 66 ARG QG 1 67 VAL HB 4.860 . 5.360 4.017 3.642 4.412 . 0 0 "[ . 1 . 2]" 1
175 1 106 MET ME 1 121 VAL QG 5.730 . 6.230 3.344 2.910 3.565 . 0 0 "[ . 1 . 2]" 1
176 1 50 LEU QD 1 106 MET ME 5.180 . 5.680 2.164 1.913 2.441 . 0 0 "[ . 1 . 2]" 1
177 1 106 MET ME 1 123 MET ME 4.050 . 4.550 1.926 1.848 2.128 . 0 0 "[ . 1 . 2]" 1
178 1 103 GLU HA 1 106 MET ME 3.030 . 3.530 1.887 1.809 1.981 . 0 0 "[ . 1 . 2]" 1
179 1 65 ARG QD 1 69 GLU HB2 4.370 . 4.870 2.429 2.095 2.689 . 0 0 "[ . 1 . 2]" 1
180 1 69 GLU HB2 1 74 VAL QG 4.300 . 4.800 2.992 2.616 3.206 . 0 0 "[ . 1 . 2]" 1
181 1 114 LEU QD 1 118 GLU QG 6.670 . 7.170 2.302 1.915 4.475 . 0 0 "[ . 1 . 2]" 1
182 1 110 ASP HB2 1 121 VAL HB 4.340 . 4.840 3.294 2.005 4.219 . 0 0 "[ . 1 . 2]" 1
183 1 102 ALA MB 1 123 MET ME 3.940 . 4.440 2.275 2.113 2.488 . 0 0 "[ . 1 . 2]" 1
184 1 65 ARG QB 1 77 VAL QG 4.800 . 5.300 2.068 1.901 2.401 . 0 0 "[ . 1 . 2]" 1
185 1 119 LEU HA 1 119 LEU HG 3.890 . 4.390 3.641 2.511 3.807 . 0 0 "[ . 1 . 2]" 1
186 1 106 MET HB2 1 122 GLN HA 3.890 . 4.390 3.731 3.391 3.932 . 0 0 "[ . 1 . 2]" 1
187 1 120 ARG HB2 1 120 ARG HG2 2.550 . 3.050 2.469 2.424 2.521 . 0 0 "[ . 1 . 2]" 1
188 1 47 MET ME 1 97 HIS HB3 4.790 . 5.290 2.453 1.960 3.027 . 0 0 "[ . 1 . 2]" 1
189 1 54 ASN HB3 1 120 ARG HB2 3.680 . 4.180 3.414 2.507 3.795 . 0 0 "[ . 1 . 2]" 1
190 1 52 VAL HB 1 68 PHE QD 6.170 . 6.670 4.958 4.611 5.152 . 0 0 "[ . 1 . 2]" 1
191 1 64 LEU HB3 1 94 VAL QG 4.970 . 5.470 2.361 1.998 2.671 . 0 0 "[ . 1 . 2]" 1
192 1 100 ARG QG 1 101 ASP QB 5.630 . 6.130 3.779 3.064 4.489 . 0 0 "[ . 1 . 2]" 1
193 1 42 PRO QG 1 44 VAL QG . . 5.720 2.073 1.923 2.187 . 0 0 "[ . 1 . 2]" 1
194 1 85 THR HA 1 86 LYS QD 3.760 . 4.260 3.045 2.818 3.360 . 0 0 "[ . 1 . 2]" 1
195 1 61 PRO HA 1 64 LEU HG 4.720 . 5.220 3.850 3.695 4.013 . 0 0 "[ . 1 . 2]" 1
196 1 61 PRO HD3 1 79 ILE HB 5.280 . 5.780 4.599 3.909 4.958 . 0 0 "[ . 1 . 2]" 1
197 1 64 LEU HG 1 92 ALA HA 5.500 . 6.000 5.482 5.402 5.533 . 0 0 "[ . 1 . 2]" 1
198 1 55 LEU QD 1 64 LEU HG 4.770 . 5.270 2.035 1.865 2.265 . 0 0 "[ . 1 . 2]" 1
199 1 64 LEU HB2 1 64 LEU HG 2.510 . 3.010 2.376 2.351 2.426 . 0 0 "[ . 1 . 2]" 1
200 1 55 LEU HG 1 92 ALA HA 4.470 . 4.970 4.011 3.895 4.169 . 0 0 "[ . 1 . 2]" 1
201 1 70 LYS HB3 1 71 TYR QE 6.170 . 6.670 5.495 5.277 5.543 . 0 0 "[ . 1 . 2]" 1
202 1 96 PHE QE 1 102 ALA MB 6.850 . 7.350 4.852 4.572 5.093 . 0 0 "[ . 1 . 2]" 1
203 1 48 THR HA 1 102 ALA MB 6.390 . 6.890 5.117 4.643 5.344 . 0 0 "[ . 1 . 2]" 1
204 1 59 THR HA 1 63 THR MG 4.680 . 5.180 3.836 3.583 3.914 . 0 0 "[ . 1 . 2]" 1
205 1 63 THR MG 1 66 ARG QD 3.440 . 3.940 2.556 2.343 2.597 . 0 0 "[ . 1 . 2]" 1
206 1 48 THR MG 1 96 PHE QD 7.410 . 7.910 5.290 4.905 5.471 . 0 0 "[ . 1 . 2]" 1
207 1 57 TYR QD 1 58 ARG QG 6.500 . 7.000 4.217 3.645 4.550 . 0 0 "[ . 1 . 2]" 1
208 1 48 THR MG 1 123 MET HG3 6.610 . 7.110 4.496 4.290 4.820 . 0 0 "[ . 1 . 2]" 1
209 1 48 THR MG 1 96 PHE HB3 5.440 . 5.940 4.350 3.753 4.570 . 0 0 "[ . 1 . 2]" 1
210 1 55 LEU QD 1 59 THR MG 4.810 . 5.310 1.982 1.939 2.038 . 0 0 "[ . 1 . 2]" 1
211 1 59 THR MG 1 64 LEU QD 4.320 . 4.820 2.033 1.884 2.230 . 0 0 "[ . 1 . 2]" 1
212 1 67 VAL QG 1 68 PHE QD . . 5.600 2.570 2.402 2.745 . 0 0 "[ . 1 . 2]" 1
213 1 67 VAL QG 1 68 PHE QE . . 6.300 3.013 2.767 3.234 . 0 0 "[ . 1 . 2]" 1
214 1 68 PHE QD 1 121 VAL QG 7.400 . 7.900 3.707 3.543 3.886 . 0 0 "[ . 1 . 2]" 1
215 1 52 VAL QG 1 68 PHE QD . . 6.840 2.940 2.778 3.589 . 0 0 "[ . 1 . 2]" 1
216 1 52 VAL QG 1 94 VAL QG 5.720 . 5.950 2.048 1.608 2.554 0.192 12 0 "[ . 1 . 2]" 1
217 1 50 LEU QD 1 103 GLU HA . . 5.950 3.732 3.425 4.083 . 0 0 "[ . 1 . 2]" 1
218 1 50 LEU QD 1 106 MET HA 7.290 . 7.790 3.974 3.671 4.301 . 0 0 "[ . 1 . 2]" 1
219 1 50 LEU QD 1 96 PHE HZ 6.890 . 7.390 4.283 3.893 4.564 . 0 0 "[ . 1 . 2]" 1
220 1 61 PRO HA 1 92 ALA MB 4.400 . 4.900 2.837 2.728 2.957 . 0 0 "[ . 1 . 2]" 1
221 1 92 ALA MB 1 94 VAL QG 4.950 . 5.450 2.921 2.685 3.079 . 0 0 "[ . 1 . 2]" 1
222 1 64 LEU HG 1 92 ALA MB 4.280 . 4.780 2.406 2.334 2.454 . 0 0 "[ . 1 . 2]" 1
223 1 55 LEU QD 1 92 ALA MB 4.110 . 4.610 1.951 1.897 2.004 . 0 0 "[ . 1 . 2]" 1
224 1 79 ILE MD 1 92 ALA MB 4.140 . 4.640 2.053 1.847 2.310 . 0 0 "[ . 1 . 2]" 1
225 1 50 LEU QD 1 96 PHE QD . . 6.700 2.687 2.311 2.976 . 0 0 "[ . 1 . 2]" 1
226 1 50 LEU QD 1 96 PHE QE . . 6.220 3.292 2.812 3.575 . 0 0 "[ . 1 . 2]" 1
227 1 77 VAL QG 1 96 PHE QE 8.320 . 8.820 5.472 4.881 5.628 . 0 0 "[ . 1 . 2]" 1
228 1 79 ILE QG 1 92 ALA MB 5.150 . 5.650 2.362 2.005 3.504 . 0 0 "[ . 1 . 2]" 1
229 1 113 VAL QG 1 118 GLU QB 4.510 . 5.010 2.116 1.903 2.866 . 0 0 "[ . 1 . 2]" 1
230 1 74 VAL QG 1 77 VAL QG 5.030 . 5.530 2.455 1.933 2.777 . 0 0 "[ . 1 . 2]" 1
231 1 77 VAL QG 1 94 VAL QG 5.290 . 5.790 1.881 1.756 2.032 0.044 6 0 "[ . 1 . 2]" 1
232 1 77 VAL QG 1 94 VAL HA 6.210 . 6.490 3.405 3.083 3.710 . 0 0 "[ . 1 . 2]" 1
233 1 68 PHE HZ 1 119 LEU QD . . 5.650 2.242 2.089 3.080 . 0 0 "[ . 1 . 2]" 1
234 1 55 LEU QD 1 92 ALA HA 6.560 . 7.010 3.863 3.786 3.929 . 0 0 "[ . 1 . 2]" 1
235 1 109 MET HA 1 119 LEU QD . . 6.110 3.951 3.311 4.179 . 0 0 "[ . 1 . 2]" 1
236 1 118 GLU QB 1 119 LEU QD . . 5.180 2.019 1.807 3.119 . 0 0 "[ . 1 . 2]" 1
237 1 110 ASP HA 1 119 LEU QD 4.730 . 5.230 3.585 3.245 3.654 . 0 0 "[ . 1 . 2]" 1
238 1 44 VAL QG 1 97 HIS HB3 7.180 . 7.680 5.233 4.617 5.390 . 0 0 "[ . 1 . 2]" 1
239 1 44 VAL QG 1 95 ARG QD . . 6.280 2.720 2.086 3.332 . 0 0 "[ . 1 . 2]" 1
240 1 64 LEU QD 1 96 PHE HZ 7.410 . 7.910 5.548 5.504 5.602 . 0 0 "[ . 1 . 2]" 1
241 1 52 VAL HA 1 64 LEU QD 7.410 . 7.910 4.852 4.642 5.184 . 0 0 "[ . 1 . 2]" 1
242 1 64 LEU QD 1 77 VAL HA 7.410 . 7.910 5.262 4.898 5.537 . 0 0 "[ . 1 . 2]" 1
243 1 64 LEU QD 1 92 ALA HA 7.410 . 7.910 5.515 5.477 5.549 . 0 0 "[ . 1 . 2]" 1
244 1 113 VAL QG 1 114 LEU HA 6.390 . 6.890 3.259 2.756 3.493 . 0 0 "[ . 1 . 2]" 1
245 1 113 VAL QG 1 117 ARG HA 6.750 . 7.250 2.216 1.837 3.985 . 0 0 "[ . 1 . 2]" 1
246 1 64 LEU QD 1 94 VAL HB 5.800 . 6.300 3.693 2.542 4.190 . 0 0 "[ . 1 . 2]" 1
247 1 64 LEU QD 1 94 VAL QG 5.270 . 5.770 1.910 1.824 2.010 . 0 0 "[ . 1 . 2]" 1
248 1 61 PRO HD3 1 79 ILE MG 5.130 . 5.630 4.234 4.142 4.282 . 0 0 "[ . 1 . 2]" 1
249 1 79 ILE MD 1 79 ILE MG 3.460 . 3.960 1.919 1.876 1.985 . 0 0 "[ . 1 . 2]" 1
250 1 69 GLU QG 1 74 VAL QG . . 6.310 3.526 3.357 3.708 . 0 0 "[ . 1 . 2]" 1
251 1 55 LEU QD 1 90 GLY QA 8.320 . 8.820 4.799 4.584 4.905 . 0 0 "[ . 1 . 2]" 1
252 1 79 ILE MD 1 80 PRO QD 7.410 . 7.910 4.331 3.260 4.932 . 0 0 "[ . 1 . 2]" 1
253 1 55 LEU QD 1 91 PHE HB3 7.410 . 7.910 3.940 3.705 4.161 . 0 0 "[ . 1 . 2]" 1
254 1 74 VAL QG 1 94 VAL QG 5.560 . 6.060 2.303 1.873 2.723 . 0 0 "[ . 1 . 2]" 1
255 1 51 LYS HA 1 94 VAL QG 7.410 . 7.910 3.687 2.698 4.588 . 0 0 "[ . 1 . 2]" 1
256 1 94 VAL QG 1 96 PHE HA 7.410 . 7.910 4.595 4.185 4.976 . 0 0 "[ . 1 . 2]" 1
257 1 61 PRO HA 1 94 VAL QG 7.180 . 7.680 4.128 3.662 4.439 . 0 0 "[ . 1 . 2]" 1
258 1 74 VAL HB 1 94 VAL QG 7.280 . 7.780 4.605 4.040 5.213 . 0 0 "[ . 1 . 2]" 1
259 1 74 VAL HA 1 94 VAL QG 6.630 . 7.130 4.395 3.741 4.861 . 0 0 "[ . 1 . 2]" 1
260 1 73 ARG H 1 74 VAL H 4.520 . 5.020 4.365 4.324 4.392 . 0 0 "[ . 1 . 2]" 1
261 1 73 ARG HA 1 74 VAL H 3.010 . 3.510 2.364 2.307 2.432 . 0 0 "[ . 1 . 2]" 1
262 1 74 VAL H 1 74 VAL HB 3.220 . 3.720 2.685 2.586 2.851 . 0 0 "[ . 1 . 2]" 1
263 1 73 ARG QG 1 74 VAL H . . 5.910 3.811 3.736 3.926 . 0 0 "[ . 1 . 2]" 1
264 1 65 ARG QD 1 74 VAL H 5.890 . 6.390 4.730 4.432 4.966 . 0 0 "[ . 1 . 2]" 1
265 1 73 ARG QD 1 74 VAL H 6.170 . 6.670 4.374 4.216 4.529 . 0 0 "[ . 1 . 2]" 1
266 1 69 GLU QG 1 74 VAL H 5.530 . 5.940 3.945 3.132 4.217 . 0 0 "[ . 1 . 2]" 1
267 1 69 GLU HA 1 74 VAL H 4.560 . 5.060 4.237 3.554 4.485 . 0 0 "[ . 1 . 2]" 1
268 1 51 LYS QB 1 52 VAL H 5.120 . 5.620 2.999 2.406 3.703 . 0 0 "[ . 1 . 2]" 1
269 1 52 VAL H 1 93 PHE QD 5.390 . 5.890 4.479 4.157 4.813 . 0 0 "[ . 1 . 2]" 1
270 1 52 VAL H 1 93 PHE HA 4.650 . 5.150 3.299 3.008 3.563 . 0 0 "[ . 1 . 2]" 1
271 1 52 VAL H 1 52 VAL HB 3.940 . 4.440 3.065 2.646 3.956 . 0 0 "[ . 1 . 2]" 1
272 1 79 ILE H 1 79 ILE HB 4.170 . 4.670 2.697 2.531 2.864 . 0 0 "[ . 1 . 2]" 1
273 1 77 VAL QG 1 79 ILE H 7.000 . 7.500 5.145 4.829 5.246 . 0 0 "[ . 1 . 2]" 1
274 1 79 ILE H 1 92 ALA MB 6.610 . 7.110 4.801 4.336 5.141 . 0 0 "[ . 1 . 2]" 1
275 1 69 GLU HB3 1 72 GLY H 5.500 . 6.000 5.538 5.507 5.585 . 0 0 "[ . 1 . 2]" 1
276 1 71 TYR H 1 72 GLY H 3.190 . 3.690 2.560 2.530 2.585 . 0 0 "[ . 1 . 2]" 1
277 1 71 TYR QD 1 72 GLY H 4.960 . 5.460 4.301 4.167 4.355 . 0 0 "[ . 1 . 2]" 1
278 1 72 GLY H 1 96 PHE QE 4.790 . 5.290 3.973 3.753 4.247 . 0 0 "[ . 1 . 2]" 1
279 1 69 GLU HA 1 72 GLY H 3.730 . 4.230 3.494 3.388 3.583 . 0 0 "[ . 1 . 2]" 1
280 1 68 PHE HA 1 72 GLY H 5.500 . 6.000 5.573 5.527 5.596 . 0 0 "[ . 1 . 2]" 1
281 1 71 TYR HA 1 72 GLY H 3.550 . 4.050 3.496 3.470 3.557 . 0 0 "[ . 1 . 2]" 1
282 1 114 LEU HA 1 115 ASP H 3.510 . 4.010 3.252 3.125 3.349 . 0 0 "[ . 1 . 2]" 1
283 1 115 ASP H 1 116 GLY HA2 4.750 . 5.250 4.265 4.130 4.402 . 0 0 "[ . 1 . 2]" 1
284 1 113 VAL HB 1 115 ASP H 4.550 . 5.050 4.082 2.738 4.559 . 0 0 "[ . 1 . 2]" 1
285 1 114 LEU QB 1 115 ASP H 5.330 . 5.650 3.994 3.930 4.033 . 0 0 "[ . 1 . 2]" 1
286 1 72 GLY H 1 73 ARG H 3.890 . 4.390 3.238 2.950 3.409 . 0 0 "[ . 1 . 2]" 1
287 1 71 TYR HB3 1 72 GLY H 4.140 . 4.640 4.015 3.831 4.079 . 0 0 "[ . 1 . 2]" 1
288 1 71 TYR HB2 1 72 GLY H 4.030 . 4.530 3.152 2.876 3.237 . 0 0 "[ . 1 . 2]" 1
289 1 70 LYS QG 1 72 GLY H 5.370 . 5.870 4.521 4.443 4.596 . 0 0 "[ . 1 . 2]" 1
290 1 114 LEU QD 1 115 ASP H . . 4.890 2.579 2.087 2.785 . 0 0 "[ . 1 . 2]" 1
291 1 114 LEU H 1 118 GLU QB 4.440 . 4.940 3.712 2.999 4.081 . 0 0 "[ . 1 . 2]" 1
292 1 113 VAL HB 1 114 LEU H 3.400 . 3.900 3.348 2.280 3.647 . 0 0 "[ . 1 . 2]" 1
293 1 114 LEU H 1 114 LEU HG 4.070 . 4.570 3.561 2.797 3.943 . 0 0 "[ . 1 . 2]" 1
294 1 114 LEU H 1 114 LEU QD 4.490 . 4.990 2.057 1.927 2.169 . 0 0 "[ . 1 . 2]" 1
295 1 114 LEU H 1 115 ASP H 4.710 . 5.210 1.800 1.747 1.933 0.053 19 0 "[ . 1 . 2]" 1
296 1 54 ASN HD21 1 119 LEU H 5.500 . 6.000 2.818 2.236 3.946 . 0 0 "[ . 1 . 2]" 1
297 1 113 VAL H 1 119 LEU H 5.500 . 6.000 4.578 4.243 4.839 . 0 0 "[ . 1 . 2]" 1
298 1 119 LEU H 1 120 ARG H 4.720 . 5.220 4.396 4.319 4.593 . 0 0 "[ . 1 . 2]" 1
299 1 118 GLU QB 1 119 LEU H 4.040 . 4.540 2.637 2.396 3.608 . 0 0 "[ . 1 . 2]" 1
300 1 119 LEU H 1 119 LEU QD . . 4.980 2.750 1.439 3.178 0.361 17 0 "[ . 1 . 2]" 1
301 1 117 ARG QG 1 119 LEU H 6.170 . 6.670 4.928 4.069 5.712 . 0 0 "[ . 1 . 2]" 1
302 1 99 LYS H 1 102 ALA MB 6.570 . 7.070 4.447 4.221 4.641 . 0 0 "[ . 1 . 2]" 1
303 1 98 ASP HB2 1 99 LYS H 4.560 . 5.060 4.425 4.264 4.579 . 0 0 "[ . 1 . 2]" 1
304 1 99 LYS H 1 99 LYS QD 5.310 . 5.810 4.534 4.302 4.630 . 0 0 "[ . 1 . 2]" 1
305 1 48 THR MG 1 99 LYS H 5.730 . 6.230 4.254 3.909 4.519 . 0 0 "[ . 1 . 2]" 1
306 1 98 ASP HA 1 99 LYS H 2.920 . 3.420 2.185 2.101 2.293 . 0 0 "[ . 1 . 2]" 1
307 1 98 ASP HB3 1 99 LYS H 3.800 . 4.300 3.452 3.205 3.685 . 0 0 "[ . 1 . 2]" 1
308 1 99 LYS H 1 99 LYS HB3 3.360 . 3.860 2.316 2.261 2.390 . 0 0 "[ . 1 . 2]" 1
309 1 99 LYS H 1 99 LYS HB2 3.310 . 3.810 2.616 2.478 2.702 . 0 0 "[ . 1 . 2]" 1
310 1 51 LYS H 1 124 ALA H 4.560 . 5.060 3.587 2.758 3.930 . 0 0 "[ . 1 . 2]" 1
311 1 123 MET HA 1 124 ALA H 3.490 . 3.990 2.244 2.208 2.397 . 0 0 "[ . 1 . 2]" 1
312 1 123 MET HG3 1 124 ALA H 5.500 . 6.000 5.327 4.921 5.477 . 0 0 "[ . 1 . 2]" 1
313 1 123 MET HG2 1 124 ALA H 4.860 . 5.360 4.767 4.623 4.862 . 0 0 "[ . 1 . 2]" 1
314 1 123 MET QB 1 124 ALA H . . 5.510 3.000 2.431 3.208 . 0 0 "[ . 1 . 2]" 1
315 1 50 LEU HA 1 124 ALA H 3.860 . 4.360 2.823 2.574 3.202 . 0 0 "[ . 1 . 2]" 1
316 1 120 ARG HA 1 121 VAL H 3.200 . 3.700 2.161 2.129 2.194 . 0 0 "[ . 1 . 2]" 1
317 1 110 ASP HA 1 121 VAL H 3.770 . 4.270 3.720 3.534 3.793 . 0 0 "[ . 1 . 2]" 1
318 1 110 ASP HB3 1 121 VAL H 4.310 . 4.810 3.909 3.714 4.160 . 0 0 "[ . 1 . 2]" 1
319 1 121 VAL H 1 121 VAL HB 3.930 . 4.430 3.153 2.698 3.507 . 0 0 "[ . 1 . 2]" 1
320 1 120 ARG QD 1 121 VAL H 4.870 . 5.370 3.516 3.338 3.810 . 0 0 "[ . 1 . 2]" 1
321 1 106 MET HA 1 121 VAL H 5.030 . 5.530 4.829 4.517 5.051 . 0 0 "[ . 1 . 2]" 1
322 1 78 TYR H 1 94 VAL HA 4.190 . 4.690 3.304 2.914 3.850 . 0 0 "[ . 1 . 2]" 1
323 1 78 TYR H 1 93 PHE H 4.590 . 5.090 4.031 3.602 4.634 . 0 0 "[ . 1 . 2]" 1
324 1 78 TYR H 1 93 PHE QD 5.250 . 5.750 4.134 3.604 4.502 . 0 0 "[ . 1 . 2]" 1
325 1 78 TYR H 1 78 TYR QD 4.740 . 5.240 3.570 2.120 4.412 . 0 0 "[ . 1 . 2]" 1
326 1 77 VAL HA 1 78 TYR H 3.350 . 3.850 2.230 2.117 2.410 . 0 0 "[ . 1 . 2]" 1
327 1 77 VAL HB 1 78 TYR H 4.660 . 5.160 4.127 2.783 4.536 . 0 0 "[ . 1 . 2]" 1
328 1 77 VAL H 1 78 TYR H 4.680 . 5.180 3.910 3.302 4.507 . 0 0 "[ . 1 . 2]" 1
329 1 78 TYR H 1 94 VAL QG 5.890 . 6.390 3.290 2.686 4.115 . 0 0 "[ . 1 . 2]" 1
330 1 53 ASP H 1 121 VAL H 4.940 . 5.440 4.972 4.917 5.051 . 0 0 "[ . 1 . 2]" 1
331 1 82 ASP H 1 85 THR MG 6.610 . 7.110 5.496 5.216 5.631 . 0 0 "[ . 1 . 2]" 1
332 1 52 VAL H 1 53 ASP H 4.880 . 5.380 4.444 4.399 4.501 . 0 0 "[ . 1 . 2]" 1
333 1 52 VAL HB 1 53 ASP H 4.990 . 5.490 3.625 2.697 4.036 . 0 0 "[ . 1 . 2]" 1
334 1 53 ASP H 1 55 LEU QD 6.770 . 7.270 4.224 4.119 4.356 . 0 0 "[ . 1 . 2]" 1
335 1 53 ASP H 1 121 VAL HA 4.590 . 5.090 3.542 3.364 3.692 . 0 0 "[ . 1 . 2]" 1
336 1 52 VAL HA 1 53 ASP H 3.400 . 3.900 2.249 2.190 2.332 . 0 0 "[ . 1 . 2]" 1
337 1 115 ASP H 1 116 GLY H 3.670 . 4.170 1.808 1.760 1.943 0.040 19 0 "[ . 1 . 2]" 1
338 1 114 LEU H 1 116 GLY H 4.390 . 4.890 3.230 3.064 3.407 . 0 0 "[ . 1 . 2]" 1
339 1 116 GLY H 1 117 ARG H 3.510 . 4.010 2.327 2.207 2.523 . 0 0 "[ . 1 . 2]" 1
340 1 114 LEU HA 1 116 GLY H 4.400 . 4.900 4.236 3.797 4.527 . 0 0 "[ . 1 . 2]" 1
341 1 115 ASP HA 1 116 GLY H 3.210 . 3.710 3.281 3.208 3.370 . 0 0 "[ . 1 . 2]" 1
342 1 113 VAL HB 1 116 GLY H 4.090 . 4.590 4.033 3.174 4.388 . 0 0 "[ . 1 . 2]" 1
343 1 113 VAL QG 1 116 GLY H . . 4.360 1.939 1.614 2.690 0.186 17 0 "[ . 1 . 2]" 1
344 1 113 VAL HA 1 116 GLY H 5.200 . 5.700 4.965 4.539 5.209 . 0 0 "[ . 1 . 2]" 1
345 1 115 ASP QB 1 116 GLY H 5.110 . 5.390 3.498 3.381 3.598 . 0 0 "[ . 1 . 2]" 1
346 1 82 ASP QB 1 83 ARG H 4.990 . 5.160 3.423 1.723 3.928 0.077 13 0 "[ . 1 . 2]" 1
347 1 48 THR MG 1 50 LEU H 5.420 . 5.920 2.770 2.162 3.650 . 0 0 "[ . 1 . 2]" 1
348 1 50 LEU H 1 95 ARG HA 4.810 . 5.310 4.140 3.306 4.631 . 0 0 "[ . 1 . 2]" 1
349 1 49 SER QB 1 50 LEU H 5.290 . 5.790 3.969 3.837 4.093 . 0 0 "[ . 1 . 2]" 1
350 1 50 LEU H 1 96 PHE H 4.820 . 5.320 2.454 1.882 2.921 . 0 0 "[ . 1 . 2]" 1
351 1 55 LEU QD 1 60 SER H 6.580 . 7.080 2.977 2.858 3.092 . 0 0 "[ . 1 . 2]" 1
352 1 60 SER H 1 64 LEU MD2 5.660 . 6.160 3.541 3.287 3.803 . 0 0 "[ . 1 . 2]" 1
353 1 60 SER H 1 63 THR H 4.490 . 4.990 3.578 3.384 3.725 . 0 0 "[ . 1 . 2]" 1
354 1 59 THR H 1 60 SER H 4.790 . 5.290 4.525 4.484 4.608 . 0 0 "[ . 1 . 2]" 1
355 1 60 SER H 1 63 THR HB 3.630 . 4.130 2.362 2.159 2.486 . 0 0 "[ . 1 . 2]" 1
356 1 59 THR HA 1 60 SER H 2.950 . 3.450 2.454 2.397 2.565 . 0 0 "[ . 1 . 2]" 1
357 1 59 THR HB 1 60 SER H 3.360 . 3.860 3.312 3.191 3.371 . 0 0 "[ . 1 . 2]" 1
358 1 77 VAL HA 1 95 ARG H 4.180 . 4.680 3.736 3.156 4.081 . 0 0 "[ . 1 . 2]" 1
359 1 112 ALA H 1 119 LEU H 4.200 . 4.700 4.244 4.002 4.317 . 0 0 "[ . 1 . 2]" 1
360 1 111 GLY H 1 112 ALA H 3.320 . 3.820 2.643 2.541 2.744 . 0 0 "[ . 1 . 2]" 1
361 1 112 ALA H 1 113 VAL H 4.120 . 4.620 3.083 2.443 3.358 . 0 0 "[ . 1 . 2]" 1
362 1 111 GLY QA 1 112 ALA H 4.000 . 4.500 2.940 2.740 2.984 . 0 0 "[ . 1 . 2]" 1
363 1 112 ALA H 1 119 LEU QB 4.730 . 5.230 2.967 2.591 4.310 . 0 0 "[ . 1 . 2]" 1
364 1 112 ALA H 1 119 LEU HG 4.390 . 4.890 4.282 2.289 4.625 . 0 0 "[ . 1 . 2]" 1
365 1 109 MET QG 1 112 ALA H 6.170 . 6.670 4.214 3.809 4.691 . 0 0 "[ . 1 . 2]" 1
366 1 112 ALA H 1 118 GLU QB 6.170 . 6.670 4.156 3.188 5.558 . 0 0 "[ . 1 . 2]" 1
367 1 112 ALA H 1 112 ALA MB 3.280 . 3.780 2.269 2.237 2.543 . 0 0 "[ . 1 . 2]" 1
368 1 112 ALA H 1 113 VAL QG 6.350 . 6.850 3.671 2.625 4.769 . 0 0 "[ . 1 . 2]" 1
369 1 112 ALA H 1 119 LEU QD 7.130 . 7.630 2.932 1.803 3.714 . 0 0 "[ . 1 . 2]" 1
370 1 49 SER H 1 124 ALA MB 6.610 . 7.110 5.317 4.514 5.603 . 0 0 "[ . 1 . 2]" 1
371 1 49 SER H 1 102 ALA MB 6.390 . 6.890 5.224 4.654 5.478 . 0 0 "[ . 1 . 2]" 1
372 1 51 LYS H 1 123 MET HA 4.140 . 4.640 3.079 2.696 3.390 . 0 0 "[ . 1 . 2]" 1
373 1 50 LEU QB 1 51 LYS H 5.500 . 6.000 3.486 3.234 3.959 . 0 0 "[ . 1 . 2]" 1
374 1 48 THR MG 1 51 LYS H 6.610 . 7.110 5.475 5.148 5.610 . 0 0 "[ . 1 . 2]" 1
375 1 48 THR MG 1 49 SER H 4.250 . 4.750 3.468 1.942 3.579 . 0 0 "[ . 1 . 2]" 1
376 1 50 LEU HA 1 51 LYS H 3.480 . 3.980 2.346 2.084 2.529 . 0 0 "[ . 1 . 2]" 1
377 1 51 LYS H 1 124 ALA HA 5.160 . 5.660 4.711 4.184 5.102 . 0 0 "[ . 1 . 2]" 1
378 1 51 LYS H 1 106 MET ME 6.610 . 7.110 5.271 4.557 5.552 . 0 0 "[ . 1 . 2]" 1
379 1 51 LYS H 1 122 GLN QB 6.170 . 6.670 4.956 4.677 5.506 . 0 0 "[ . 1 . 2]" 1
380 1 51 LYS H 1 121 VAL QG 5.930 . 6.430 3.647 3.246 4.282 . 0 0 "[ . 1 . 2]" 1
381 1 44 VAL H 1 45 GLU H 3.430 . 3.930 2.853 2.759 3.054 . 0 0 "[ . 1 . 2]" 1
382 1 45 GLU H 1 47 MET H 4.960 . 5.460 4.332 3.801 4.993 . 0 0 "[ . 1 . 2]" 1
383 1 43 ASP HA 1 45 GLU H 3.630 . 4.130 3.104 2.997 3.297 . 0 0 "[ . 1 . 2]" 1
384 1 45 GLU H 1 45 GLU QB 3.190 . 3.690 2.464 2.349 2.531 . 0 0 "[ . 1 . 2]" 1
385 1 45 GLU H 1 47 MET ME 6.350 . 6.850 4.883 4.229 5.321 . 0 0 "[ . 1 . 2]" 1
386 1 44 VAL QG 1 45 GLU H 4.690 . 5.190 2.818 2.575 3.218 . 0 0 "[ . 1 . 2]" 1
387 1 77 VAL QG 1 94 VAL H 6.980 . 7.480 4.619 4.071 4.953 . 0 0 "[ . 1 . 2]" 1
388 1 92 ALA MB 1 94 VAL H 6.590 . 7.090 4.470 4.180 4.874 . 0 0 "[ . 1 . 2]" 1
389 1 93 PHE QD 1 94 VAL H 5.110 . 5.610 4.241 3.862 4.528 . 0 0 "[ . 1 . 2]" 1
390 1 93 PHE QB 1 94 VAL H 5.170 . 5.670 3.998 3.882 4.077 . 0 0 "[ . 1 . 2]" 1
391 1 51 LYS HA 1 94 VAL H 4.640 . 5.140 3.900 3.541 4.215 . 0 0 "[ . 1 . 2]" 1
392 1 134 HIS QB 1 135 SER H 4.440 . 4.940 3.423 2.335 3.983 . 0 0 "[ . 1 . 2]" 1
393 1 76 ASP HA 1 77 VAL H 3.030 . 3.530 2.295 2.204 2.458 . 0 0 "[ . 1 . 2]" 1
394 1 76 ASP QB 1 77 VAL H 4.680 . 5.180 3.135 2.213 3.660 . 0 0 "[ . 1 . 2]" 1
395 1 76 ASP H 1 77 VAL H 4.270 . 4.770 4.312 4.272 4.351 . 0 0 "[ . 1 . 2]" 1
396 1 77 VAL H 1 94 VAL HA 5.040 . 5.540 4.378 3.883 4.809 . 0 0 "[ . 1 . 2]" 1
397 1 77 VAL H 1 77 VAL HB 3.650 . 4.150 3.531 2.816 3.789 . 0 0 "[ . 1 . 2]" 1
398 1 74 VAL QG 1 77 VAL H 6.300 . 6.800 4.045 3.721 4.329 . 0 0 "[ . 1 . 2]" 1
399 1 105 ALA H 1 106 MET H 3.630 . 4.130 2.684 2.614 2.743 . 0 0 "[ . 1 . 2]" 1
400 1 104 ASP H 1 105 ALA H 3.290 . 3.790 2.606 2.489 2.681 . 0 0 "[ . 1 . 2]" 1
401 1 105 ALA H 1 107 ASP H 4.720 . 5.220 4.152 4.105 4.201 . 0 0 "[ . 1 . 2]" 1
402 1 71 TYR QD 1 105 ALA H 4.620 . 5.120 3.874 3.630 4.115 . 0 0 "[ . 1 . 2]" 1
403 1 101 ASP HA 1 105 ALA H 4.220 . 4.720 3.849 3.167 4.196 . 0 0 "[ . 1 . 2]" 1
404 1 103 GLU HA 1 105 ALA H 5.090 . 5.590 4.490 4.291 4.683 . 0 0 "[ . 1 . 2]" 1
405 1 71 TYR HB3 1 105 ALA H 4.330 . 4.830 3.826 3.485 4.254 . 0 0 "[ . 1 . 2]" 1
406 1 104 ASP QB 1 105 ALA H 3.690 . 4.190 2.578 2.470 2.665 . 0 0 "[ . 1 . 2]" 1
407 1 103 GLU HG3 1 105 ALA H 5.230 . 5.730 5.008 4.890 5.144 . 0 0 "[ . 1 . 2]" 1
408 1 105 ALA H 1 106 MET ME 6.610 . 7.110 5.114 4.825 5.353 . 0 0 "[ . 1 . 2]" 1
409 1 105 ALA H 1 108 ALA MB 5.900 . 6.400 4.503 4.457 4.548 . 0 0 "[ . 1 . 2]" 1
410 1 50 LEU QD 1 105 ALA H 7.350 . 7.850 4.302 3.782 4.774 . 0 0 "[ . 1 . 2]" 1
411 1 105 ALA H 1 106 MET HB3 4.980 . 5.480 4.703 4.448 4.945 . 0 0 "[ . 1 . 2]" 1
412 1 103 GLU QB 1 105 ALA H 6.170 . 6.670 5.373 5.194 5.505 . 0 0 "[ . 1 . 2]" 1
413 1 89 ARG H 1 90 GLY H 4.210 . 4.710 2.696 1.722 4.460 0.078 18 0 "[ . 1 . 2]" 1
414 1 89 ARG H 1 91 PHE QE 6.170 . 6.670 5.302 4.724 5.623 . 0 0 "[ . 1 . 2]" 1
415 1 123 MET H 1 123 MET HG2 3.330 . 3.830 2.112 1.874 2.318 . 0 0 "[ . 1 . 2]" 1
416 1 122 GLN QG 1 123 MET H 4.270 . 4.770 3.173 1.698 3.894 0.102 4 0 "[ . 1 . 2]" 1
417 1 122 GLN QB 1 123 MET H 3.340 . 3.840 2.449 1.901 3.068 . 0 0 "[ . 1 . 2]" 1
418 1 123 MET H 1 123 MET QB 3.670 . 4.170 2.280 2.235 2.351 . 0 0 "[ . 1 . 2]" 1
419 1 57 TYR H 1 57 TYR HB3 3.880 . 4.380 2.519 2.424 3.698 . 0 0 "[ . 1 . 2]" 1
420 1 57 TYR H 1 57 TYR HB2 3.850 . 4.350 3.568 3.530 4.101 . 0 0 "[ . 1 . 2]" 1
421 1 56 THR MG 1 57 TYR H 4.670 . 5.170 1.940 1.820 3.222 . 0 0 "[ . 1 . 2]" 1
422 1 49 SER HA 1 96 PHE H 4.560 . 5.060 3.323 2.794 3.799 . 0 0 "[ . 1 . 2]" 1
423 1 96 PHE H 1 96 PHE QD 4.330 . 4.830 2.765 2.319 3.042 . 0 0 "[ . 1 . 2]" 1
424 1 96 PHE H 1 96 PHE QE 6.170 . 6.670 5.095 4.650 5.356 . 0 0 "[ . 1 . 2]" 1
425 1 95 ARG QB 1 96 PHE H 5.350 . 5.850 3.361 2.888 3.934 . 0 0 "[ . 1 . 2]" 1
426 1 48 THR MG 1 96 PHE H 6.270 . 6.770 4.846 4.336 5.241 . 0 0 "[ . 1 . 2]" 1
427 1 123 MET H 1 124 ALA H 4.580 . 5.080 4.632 4.606 4.648 . 0 0 "[ . 1 . 2]" 1
428 1 122 GLN HA 1 123 MET H 2.990 . 3.490 2.474 2.353 2.619 . 0 0 "[ . 1 . 2]" 1
429 1 123 MET H 1 123 MET HG3 3.500 . 4.000 3.197 3.072 3.403 . 0 0 "[ . 1 . 2]" 1
430 1 37 TYR H 1 38 GLY QA 5.370 . 5.870 4.477 3.705 4.799 . 0 0 "[ . 1 . 2]" 1
431 1 36 SER HA 1 37 TYR H 2.730 . 3.230 2.463 2.123 2.773 . 0 0 "[ . 1 . 2]" 1
432 1 36 SER QB 1 37 TYR H 3.750 . 4.250 2.420 1.819 3.224 . 0 0 "[ . 1 . 2]" 1
433 1 37 TYR H 1 37 TYR QB 3.730 . 4.230 2.685 2.284 3.321 . 0 0 "[ . 1 . 2]" 1
434 1 121 VAL HB 1 122 GLN H 4.130 . 4.630 4.021 3.886 4.148 . 0 0 "[ . 1 . 2]" 1
435 1 121 VAL HA 1 122 GLN H 3.520 . 4.020 2.115 2.056 2.215 . 0 0 "[ . 1 . 2]" 1
436 1 51 LYS H 1 122 GLN H 4.870 . 5.370 3.390 3.040 3.949 . 0 0 "[ . 1 . 2]" 1
437 1 113 VAL HA 1 118 GLU H 4.060 . 4.560 3.969 3.619 4.161 . 0 0 "[ . 1 . 2]" 1
438 1 54 ASN HD21 1 118 GLU H 4.020 . 4.520 2.633 2.357 3.867 . 0 0 "[ . 1 . 2]" 1
439 1 54 ASN HD22 1 118 GLU H 3.850 . 4.350 3.307 2.828 4.090 . 0 0 "[ . 1 . 2]" 1
440 1 117 ARG HA 1 118 GLU H 2.890 . 3.390 2.230 2.138 2.335 . 0 0 "[ . 1 . 2]" 1
441 1 118 GLU H 1 118 GLU QB 3.410 . 3.910 2.800 2.648 3.155 . 0 0 "[ . 1 . 2]" 1
442 1 113 VAL HB 1 118 GLU H 4.150 . 4.650 3.717 3.044 4.301 . 0 0 "[ . 1 . 2]" 1
443 1 117 ARG QG 1 118 GLU H 5.080 . 5.580 3.546 2.699 4.354 . 0 0 "[ . 1 . 2]" 1
444 1 118 GLU H 1 119 LEU QD . . 6.970 3.971 3.513 4.817 . 0 0 "[ . 1 . 2]" 1
445 1 113 VAL QG 1 118 GLU H . . 5.470 2.003 1.598 2.744 0.202 15 0 "[ . 1 . 2]" 1
446 1 118 GLU H 1 119 LEU H 4.640 . 5.140 2.067 1.735 4.429 0.065 13 0 "[ . 1 . 2]" 1
447 1 38 GLY QA 1 39 ARG H 3.720 . 4.220 2.566 2.219 2.803 . 0 0 "[ . 1 . 2]" 1
448 1 37 TYR QB 1 39 ARG H 5.600 . 6.100 3.863 2.898 5.005 . 0 0 "[ . 1 . 2]" 1
449 1 39 ARG H 1 39 ARG QD 5.870 . 6.370 4.381 2.281 5.037 . 0 0 "[ . 1 . 2]" 1
450 1 39 ARG H 1 39 ARG QG 3.890 . 4.390 2.960 2.575 3.527 . 0 0 "[ . 1 . 2]" 1
451 1 120 ARG H 1 120 ARG HG3 4.900 . 5.400 4.770 4.505 4.858 . 0 0 "[ . 1 . 2]" 1
452 1 119 LEU QB 1 120 ARG H 4.830 . 5.330 2.677 2.454 3.061 . 0 0 "[ . 1 . 2]" 1
453 1 120 ARG H 1 121 VAL H 4.650 . 5.150 3.884 3.684 4.277 . 0 0 "[ . 1 . 2]" 1
454 1 53 ASP H 1 120 ARG H 4.140 . 4.640 3.109 2.891 3.494 . 0 0 "[ . 1 . 2]" 1
455 1 119 LEU HA 1 120 ARG H 3.450 . 3.950 2.162 2.094 2.206 . 0 0 "[ . 1 . 2]" 1
456 1 53 ASP QB 1 120 ARG H 6.110 . 6.610 4.373 4.036 5.314 . 0 0 "[ . 1 . 2]" 1
457 1 52 VAL QG 1 120 ARG H 6.540 . 7.040 3.479 2.683 4.508 . 0 0 "[ . 1 . 2]" 1
458 1 104 ASP H 1 106 MET H 4.500 . 5.000 4.013 3.858 4.192 . 0 0 "[ . 1 . 2]" 1
459 1 103 GLU HG2 1 104 ASP H 4.120 . 4.620 3.121 2.976 3.390 . 0 0 "[ . 1 . 2]" 1
460 1 100 ARG HA 1 104 ASP H 4.350 . 4.850 4.230 4.019 4.351 . 0 0 "[ . 1 . 2]" 1
461 1 71 TYR HB3 1 104 ASP H 5.500 . 6.000 5.477 5.223 5.570 . 0 0 "[ . 1 . 2]" 1
462 1 103 GLU HG3 1 104 ASP H 3.720 . 4.220 2.504 2.348 2.693 . 0 0 "[ . 1 . 2]" 1
463 1 103 GLU QB 1 104 ASP H 4.290 . 4.790 3.693 3.615 3.783 . 0 0 "[ . 1 . 2]" 1
464 1 102 ALA H 1 104 ASP H 4.590 . 5.090 3.717 3.590 3.860 . 0 0 "[ . 1 . 2]" 1
465 1 104 ASP H 1 105 ALA MB 5.200 . 5.700 4.265 4.164 4.332 . 0 0 "[ . 1 . 2]" 1
466 1 96 PHE QD 1 97 HIS H 4.800 . 5.300 3.579 3.324 4.009 . 0 0 "[ . 1 . 2]" 1
467 1 115 ASP HA 1 117 ARG H 5.060 . 5.560 4.633 4.335 4.861 . 0 0 "[ . 1 . 2]" 1
468 1 113 VAL HB 1 117 ARG H 4.440 . 4.940 4.338 2.844 4.699 . 0 0 "[ . 1 . 2]" 1
469 1 113 VAL QG 1 117 ARG H 4.770 . 5.270 2.256 1.968 3.317 . 0 0 "[ . 1 . 2]" 1
470 1 115 ASP H 1 117 ARG H 4.600 . 5.100 2.862 2.638 3.044 . 0 0 "[ . 1 . 2]" 1
471 1 114 LEU H 1 117 ARG H 3.690 . 4.190 3.805 3.514 3.932 . 0 0 "[ . 1 . 2]" 1
472 1 117 ARG H 1 118 GLU H 4.280 . 4.780 3.944 2.903 4.302 . 0 0 "[ . 1 . 2]" 1
473 1 117 ARG H 1 117 ARG QD 5.100 . 5.600 4.358 3.846 4.730 . 0 0 "[ . 1 . 2]" 1
474 1 114 LEU QD 1 117 ARG H . . 7.110 4.306 3.273 4.625 . 0 0 "[ . 1 . 2]" 1
475 1 75 GLY H 1 97 HIS H 4.720 . 5.220 4.262 3.414 4.746 . 0 0 "[ . 1 . 2]" 1
476 1 96 PHE HB3 1 97 HIS H 3.880 . 4.380 2.395 1.963 2.939 . 0 0 "[ . 1 . 2]" 1
477 1 97 HIS H 1 97 HIS HB2 3.720 . 4.220 3.410 2.787 3.687 . 0 0 "[ . 1 . 2]" 1
478 1 97 HIS H 1 97 HIS HB3 3.920 . 4.420 3.623 3.415 3.783 . 0 0 "[ . 1 . 2]" 1
479 1 47 MET ME 1 97 HIS H 5.940 . 6.440 4.386 3.803 4.741 . 0 0 "[ . 1 . 2]" 1
480 1 97 HIS H 1 98 ASP H 3.860 . 4.360 2.050 1.803 2.467 . 0 0 "[ . 1 . 2]" 1
481 1 96 PHE HB2 1 97 HIS H 4.120 . 4.620 3.740 3.256 4.127 . 0 0 "[ . 1 . 2]" 1
482 1 106 MET HB3 1 110 ASP H 5.500 . 6.000 5.567 5.454 5.667 . 0 0 "[ . 1 . 2]" 1
483 1 110 ASP H 1 111 GLY H 4.800 . 5.300 4.601 4.553 4.623 . 0 0 "[ . 1 . 2]" 1
484 1 109 MET H 1 110 ASP H 3.480 . 3.980 1.984 1.925 2.054 . 0 0 "[ . 1 . 2]" 1
485 1 108 ALA H 1 110 ASP H 4.290 . 4.790 3.475 3.378 3.607 . 0 0 "[ . 1 . 2]" 1
486 1 68 PHE QE 1 110 ASP H 6.080 . 6.580 5.291 4.982 5.449 . 0 0 "[ . 1 . 2]" 1
487 1 68 PHE HZ 1 110 ASP H 5.500 . 6.000 5.423 5.190 5.532 . 0 0 "[ . 1 . 2]" 1
488 1 106 MET HA 1 110 ASP H 4.110 . 4.610 2.982 2.899 3.030 . 0 0 "[ . 1 . 2]" 1
489 1 110 ASP H 1 110 ASP HB3 3.350 . 3.850 2.292 2.156 2.394 . 0 0 "[ . 1 . 2]" 1
490 1 110 ASP H 1 110 ASP HB2 3.220 . 3.720 2.789 2.579 3.025 . 0 0 "[ . 1 . 2]" 1
491 1 109 MET QB 1 110 ASP H 3.850 . 4.350 3.017 2.917 3.295 . 0 0 "[ . 1 . 2]" 1
492 1 110 ASP H 1 112 ALA MB 6.570 . 7.070 4.663 4.544 4.993 . 0 0 "[ . 1 . 2]" 1
493 1 110 ASP H 1 121 VAL QG 4.910 . 5.410 3.131 2.611 3.632 . 0 0 "[ . 1 . 2]" 1
494 1 110 ASP H 1 121 VAL H 5.200 . 5.700 5.111 4.831 5.289 . 0 0 "[ . 1 . 2]" 1
495 1 108 ALA HA 1 110 ASP H 5.500 . 6.000 5.104 5.039 5.149 . 0 0 "[ . 1 . 2]" 1
496 1 131 ASP H 1 132 SER H 4.410 . 4.910 4.101 1.755 4.426 0.045 7 0 "[ . 1 . 2]" 1
497 1 130 PRO QD 1 131 ASP H 4.520 . 5.020 2.306 2.010 2.574 . 0 0 "[ . 1 . 2]" 1
498 1 131 ASP H 1 131 ASP QB 3.400 . 3.900 2.822 2.616 3.163 . 0 0 "[ . 1 . 2]" 1
499 1 130 PRO QB 1 131 ASP H 3.760 . 4.260 3.240 2.671 3.477 . 0 0 "[ . 1 . 2]" 1
500 1 96 PHE QD 1 98 ASP H 4.980 . 5.480 3.760 3.451 3.986 . 0 0 "[ . 1 . 2]" 1
501 1 98 ASP H 1 99 LYS H 4.790 . 5.290 4.540 4.450 4.602 . 0 0 "[ . 1 . 2]" 1
502 1 96 PHE HB3 1 98 ASP H 4.370 . 4.870 3.078 2.771 3.486 . 0 0 "[ . 1 . 2]" 1
503 1 97 HIS HB2 1 98 ASP H 3.860 . 4.360 3.269 2.630 3.732 . 0 0 "[ . 1 . 2]" 1
504 1 73 ARG QD 1 98 ASP H 4.760 . 5.260 4.056 3.267 4.266 . 0 0 "[ . 1 . 2]" 1
505 1 98 ASP H 1 98 ASP HB2 3.430 . 3.930 2.163 2.071 2.618 . 0 0 "[ . 1 . 2]" 1
506 1 98 ASP H 1 102 ALA MB 6.090 . 6.590 4.166 3.488 4.555 . 0 0 "[ . 1 . 2]" 1
507 1 97 HIS HD2 1 98 ASP H 4.340 . 4.840 2.438 1.963 3.575 . 0 0 "[ . 1 . 2]" 1
508 1 130 PRO QG 1 131 ASP H 3.750 . 4.250 2.174 1.637 2.554 0.163 3 0 "[ . 1 . 2]" 1
509 1 98 ASP H 1 101 ASP H 5.010 . 5.510 4.862 4.331 5.029 . 0 0 "[ . 1 . 2]" 1
510 1 101 ASP H 1 103 GLU H 4.520 . 5.020 4.137 3.827 4.333 . 0 0 "[ . 1 . 2]" 1
511 1 101 ASP H 1 102 ALA H 3.400 . 3.900 2.315 2.041 2.460 . 0 0 "[ . 1 . 2]" 1
512 1 98 ASP HB3 1 101 ASP H 3.480 . 3.980 2.463 2.144 3.073 . 0 0 "[ . 1 . 2]" 1
513 1 100 ARG QB 1 101 ASP H 4.100 . 4.600 3.645 3.577 3.698 . 0 0 "[ . 1 . 2]" 1
514 1 100 ARG QG 1 101 ASP H 4.110 . 4.610 2.577 2.165 3.220 . 0 0 "[ . 1 . 2]" 1
515 1 101 ASP H 1 102 ALA MB 5.120 . 5.620 3.908 3.675 4.058 . 0 0 "[ . 1 . 2]" 1
516 1 48 THR MG 1 101 ASP H 6.610 . 7.110 5.510 5.447 5.533 . 0 0 "[ . 1 . 2]" 1
517 1 99 LYS H 1 101 ASP H 4.520 . 5.020 4.238 3.974 4.478 . 0 0 "[ . 1 . 2]" 1
518 1 98 ASP HA 1 101 ASP H 4.810 . 5.310 4.526 4.304 4.861 . 0 0 "[ . 1 . 2]" 1
519 1 99 LYS QD 1 102 ALA H 6.170 . 6.670 4.604 4.157 5.607 . 0 0 "[ . 1 . 2]" 1
520 1 100 ARG QG 1 102 ALA H 6.170 . 6.670 4.634 4.369 4.917 . 0 0 "[ . 1 . 2]" 1
521 1 98 ASP H 1 102 ALA H 5.500 . 6.000 4.934 4.336 5.184 . 0 0 "[ . 1 . 2]" 1
522 1 102 ALA H 1 103 GLU H 3.450 . 3.950 2.463 2.400 2.542 . 0 0 "[ . 1 . 2]" 1
523 1 100 ARG HA 1 102 ALA H 4.740 . 5.240 4.136 4.003 4.335 . 0 0 "[ . 1 . 2]" 1
524 1 99 LYS HA 1 102 ALA H 4.060 . 4.560 3.467 3.359 3.700 . 0 0 "[ . 1 . 2]" 1
525 1 96 PHE HB3 1 102 ALA H 4.470 . 4.970 4.454 4.241 4.533 . 0 0 "[ . 1 . 2]" 1
526 1 101 ASP QB 1 102 ALA H 4.230 . 4.730 3.231 2.905 3.848 . 0 0 "[ . 1 . 2]" 1
527 1 98 ASP HB3 1 102 ALA H 4.680 . 5.180 4.085 3.830 4.668 . 0 0 "[ . 1 . 2]" 1
528 1 102 ALA H 1 106 MET ME 6.610 . 7.110 5.583 5.528 5.620 . 0 0 "[ . 1 . 2]" 1
529 1 102 ALA H 1 103 GLU QB 5.900 . 6.400 4.800 4.712 4.903 . 0 0 "[ . 1 . 2]" 1
530 1 50 LEU QB 1 102 ALA H 6.170 . 6.670 4.814 4.578 5.034 . 0 0 "[ . 1 . 2]" 1
531 1 100 ARG QB 1 102 ALA H 6.170 . 6.670 5.007 4.873 5.084 . 0 0 "[ . 1 . 2]" 1
532 1 68 PHE H 1 69 GLU H 3.550 . 4.050 2.264 2.217 2.317 . 0 0 "[ . 1 . 2]" 1
533 1 68 PHE HB2 1 69 GLU H 4.450 . 4.950 3.488 3.416 3.558 . 0 0 "[ . 1 . 2]" 1
534 1 69 GLU H 1 70 LYS QG 6.070 . 6.570 3.963 3.863 4.048 . 0 0 "[ . 1 . 2]" 1
535 1 65 ARG H 1 66 ARG H 3.280 . 3.780 2.593 2.494 2.673 . 0 0 "[ . 1 . 2]" 1
536 1 62 ASP HA 1 65 ARG H 3.960 . 4.460 3.535 3.421 3.629 . 0 0 "[ . 1 . 2]" 1
537 1 66 ARG HA 1 69 GLU H 4.200 . 4.700 3.536 3.434 3.675 . 0 0 "[ . 1 . 2]" 1
538 1 63 THR HA 1 65 ARG H 4.210 . 4.710 3.761 3.706 3.805 . 0 0 "[ . 1 . 2]" 1
539 1 68 PHE HB3 1 69 GLU H 4.810 . 5.310 3.975 3.905 4.071 . 0 0 "[ . 1 . 2]" 1
540 1 64 LEU HB2 1 65 ARG H 3.740 . 4.240 3.529 3.426 3.607 . 0 0 "[ . 1 . 2]" 1
541 1 64 LEU MD2 1 65 ARG H 6.160 . 6.660 4.603 4.482 4.675 . 0 0 "[ . 1 . 2]" 1
542 1 65 ARG H 1 94 VAL QG 7.140 . 7.640 4.657 4.259 4.983 . 0 0 "[ . 1 . 2]" 1
543 1 56 THR H 1 59 THR H 4.830 . 5.330 4.184 3.452 4.703 . 0 0 "[ . 1 . 2]" 1
544 1 59 THR H 1 59 THR HB 3.480 . 3.980 2.832 2.622 2.976 . 0 0 "[ . 1 . 2]" 1
545 1 58 ARG QB 1 59 THR H 5.420 . 5.920 4.028 3.880 4.054 . 0 0 "[ . 1 . 2]" 1
546 1 56 THR MG 1 59 THR H 6.230 . 6.730 4.661 4.412 4.915 . 0 0 "[ . 1 . 2]" 1
547 1 58 ARG QG 1 59 THR H 6.160 . 6.660 3.386 3.000 3.472 . 0 0 "[ . 1 . 2]" 1
548 1 55 LEU QD 1 59 THR H . . 7.320 4.173 3.953 4.303 . 0 0 "[ . 1 . 2]" 1
549 1 43 ASP H 1 44 VAL H 3.880 . 4.380 2.377 2.074 3.361 . 0 0 "[ . 1 . 2]" 1
550 1 43 ASP H 1 44 VAL QG 5.720 . 6.220 2.951 2.576 3.891 . 0 0 "[ . 1 . 2]" 1
551 1 43 ASP H 1 43 ASP QB 3.640 . 4.110 2.683 2.401 3.163 . 0 0 "[ . 1 . 2]" 1
552 1 42 PRO QB 1 43 ASP H 3.960 . 4.460 1.988 1.908 2.077 . 0 0 "[ . 1 . 2]" 1
553 1 42 PRO QG 1 43 ASP H 4.000 . 4.500 3.442 3.292 3.592 . 0 0 "[ . 1 . 2]" 1
554 1 47 MET ME 1 48 THR H 6.610 . 7.110 4.768 4.336 5.067 . 0 0 "[ . 1 . 2]" 1
555 1 48 THR H 1 99 LYS HB2 5.500 . 6.000 4.829 4.510 5.493 . 0 0 "[ . 1 . 2]" 1
556 1 48 THR H 1 48 THR HB 4.150 . 4.650 2.331 2.178 2.521 . 0 0 "[ . 1 . 2]" 1
557 1 47 MET QB 1 48 THR H 5.500 . 5.880 2.366 2.127 2.606 . 0 0 "[ . 1 . 2]" 1
558 1 48 THR H 1 49 SER H 4.570 . 5.070 3.167 2.502 4.632 . 0 0 "[ . 1 . 2]" 1
559 1 64 LEU H 1 65 ARG H 3.750 . 4.250 2.747 2.704 2.780 . 0 0 "[ . 1 . 2]" 1
560 1 64 LEU H 1 64 LEU MD2 4.280 . 4.780 2.866 2.594 3.109 . 0 0 "[ . 1 . 2]" 1
561 1 63 THR HB 1 64 LEU H 3.560 . 4.060 2.558 2.511 2.611 . 0 0 "[ . 1 . 2]" 1
562 1 64 LEU H 1 64 LEU HG 4.450 . 4.950 4.133 3.993 4.242 . 0 0 "[ . 1 . 2]" 1
563 1 59 THR MG 1 64 LEU H 5.360 . 5.860 3.491 3.344 3.707 . 0 0 "[ . 1 . 2]" 1
564 1 64 LEU H 1 67 VAL QG 6.430 . 6.930 4.347 4.289 4.398 . 0 0 "[ . 1 . 2]" 1
565 1 48 THR H 1 102 ALA MB 6.610 . 7.110 5.176 4.893 5.523 . 0 0 "[ . 1 . 2]" 1
566 1 112 ALA HA 1 113 VAL H 2.710 . 3.210 2.789 2.332 2.892 . 0 0 "[ . 1 . 2]" 1
567 1 113 VAL H 1 113 VAL HB 2.930 . 3.430 2.619 2.270 3.405 . 0 0 "[ . 1 . 2]" 1
568 1 113 VAL H 1 114 LEU H 4.630 . 5.130 4.572 4.509 4.638 . 0 0 "[ . 1 . 2]" 1
569 1 100 ARG H 1 102 ALA H 4.190 . 4.690 4.043 3.949 4.117 . 0 0 "[ . 1 . 2]" 1
570 1 98 ASP HB3 1 100 ARG H 3.930 . 4.430 3.365 3.151 3.499 . 0 0 "[ . 1 . 2]" 1
571 1 99 LYS HB3 1 100 ARG H 3.560 . 4.060 2.538 2.373 2.684 . 0 0 "[ . 1 . 2]" 1
572 1 99 LYS H 1 100 ARG H 3.540 . 4.040 2.805 2.698 2.915 . 0 0 "[ . 1 . 2]" 1
573 1 100 ARG H 1 103 GLU H 5.090 . 5.590 4.938 4.844 5.080 . 0 0 "[ . 1 . 2]" 1
574 1 100 ARG H 1 101 ASP H 3.320 . 3.820 2.796 2.679 2.928 . 0 0 "[ . 1 . 2]" 1
575 1 99 LYS QE 1 100 ARG H 6.170 . 6.670 5.000 4.422 5.322 . 0 0 "[ . 1 . 2]" 1
576 1 100 ARG H 1 101 ASP QB 6.170 . 6.670 4.953 4.436 5.393 . 0 0 "[ . 1 . 2]" 1
577 1 100 ARG H 1 100 ARG QB 3.130 . 3.630 2.503 2.435 2.660 . 0 0 "[ . 1 . 2]" 1
578 1 100 ARG H 1 100 ARG QG 3.770 . 4.270 2.826 1.747 3.197 0.053 14 0 "[ . 1 . 2]" 1
579 1 99 LYS QG 1 100 ARG H 5.320 . 5.820 3.233 2.990 3.520 . 0 0 "[ . 1 . 2]" 1
580 1 48 THR MG 1 100 ARG H 6.610 . 7.110 5.329 5.146 5.466 . 0 0 "[ . 1 . 2]" 1
581 1 106 MET H 1 107 ASP H 3.530 . 4.030 2.473 2.383 2.566 . 0 0 "[ . 1 . 2]" 1
582 1 102 ALA HA 1 106 MET H 4.790 . 5.290 4.425 4.196 4.591 . 0 0 "[ . 1 . 2]" 1
583 1 106 MET H 1 106 MET QG 4.280 . 4.780 3.140 2.326 3.823 . 0 0 "[ . 1 . 2]" 1
584 1 106 MET H 1 106 MET HB3 3.220 . 3.720 2.254 2.095 2.416 . 0 0 "[ . 1 . 2]" 1
585 1 106 MET H 1 106 MET HB2 3.620 . 4.120 3.210 2.690 3.640 . 0 0 "[ . 1 . 2]" 1
586 1 105 ALA MB 1 106 MET H 4.060 . 4.560 2.727 2.660 2.783 . 0 0 "[ . 1 . 2]" 1
587 1 106 MET H 1 121 VAL QG 5.230 . 5.730 3.488 3.326 3.666 . 0 0 "[ . 1 . 2]" 1
588 1 85 THR HA 1 87 GLU H 4.790 . 5.290 4.395 4.145 4.786 . 0 0 "[ . 1 . 2]" 1
589 1 82 ASP QB 1 87 GLU H 4.390 . 4.890 3.110 1.826 3.839 . 0 0 "[ . 1 . 2]" 1
590 1 87 GLU H 1 88 SER H 4.190 . 4.690 3.220 2.008 4.424 . 0 0 "[ . 1 . 2]" 1
591 1 86 LYS H 1 87 GLU H 3.610 . 4.110 3.003 2.882 3.141 . 0 0 "[ . 1 . 2]" 1
592 1 87 GLU H 1 87 GLU QG 4.060 . 4.460 2.090 1.812 2.503 . 0 0 "[ . 1 . 2]" 1
593 1 86 LYS QD 1 87 GLU H 5.490 . 5.990 4.648 4.413 4.893 . 0 0 "[ . 1 . 2]" 1
594 1 69 GLU H 1 70 LYS H 3.480 . 3.980 2.563 2.511 2.596 . 0 0 "[ . 1 . 2]" 1
595 1 70 LYS H 1 72 GLY H 4.200 . 4.700 4.159 4.116 4.214 . 0 0 "[ . 1 . 2]" 1
596 1 70 LYS H 1 71 TYR QE 5.440 . 5.940 4.751 4.672 4.811 . 0 0 "[ . 1 . 2]" 1
597 1 69 GLU QG 1 70 LYS H 6.170 . 6.670 3.845 3.718 4.492 . 0 0 "[ . 1 . 2]" 1
598 1 70 LYS H 1 70 LYS QG 3.320 . 3.820 2.073 1.989 2.132 . 0 0 "[ . 1 . 2]" 1
599 1 70 LYS H 1 74 VAL QG 6.630 . 7.130 4.847 4.649 4.939 . 0 0 "[ . 1 . 2]" 1
600 1 67 VAL H 1 70 LYS H 5.500 . 6.000 5.203 5.011 5.379 . 0 0 "[ . 1 . 2]" 1
601 1 70 LYS H 1 71 TYR H 3.430 . 3.930 2.619 2.602 2.637 . 0 0 "[ . 1 . 2]" 1
602 1 70 LYS H 1 71 TYR QD 4.420 . 4.920 3.424 3.336 3.522 . 0 0 "[ . 1 . 2]" 1
603 1 70 LYS H 1 70 LYS HA 2.930 . 3.430 2.869 2.862 2.879 . 0 0 "[ . 1 . 2]" 1
604 1 69 GLU HB3 1 70 LYS H 4.210 . 4.710 3.040 2.981 3.097 . 0 0 "[ . 1 . 2]" 1
605 1 69 GLU HB2 1 70 LYS H 4.310 . 4.810 4.201 4.152 4.238 . 0 0 "[ . 1 . 2]" 1
606 1 70 LYS H 1 70 LYS HB3 2.980 . 3.480 2.526 2.488 2.550 . 0 0 "[ . 1 . 2]" 1
607 1 43 ASP HA 1 44 VAL H 3.150 . 3.650 2.927 2.690 3.056 . 0 0 "[ . 1 . 2]" 1
608 1 43 ASP QB 1 44 VAL H 5.200 . 5.300 3.862 3.692 4.062 . 0 0 "[ . 1 . 2]" 1
609 1 44 VAL H 1 45 GLU QB 5.680 . 6.180 4.863 4.656 5.086 . 0 0 "[ . 1 . 2]" 1
610 1 68 PHE HA 1 70 LYS H 4.100 . 4.600 3.757 3.701 3.826 . 0 0 "[ . 1 . 2]" 1
611 1 44 VAL H 1 45 GLU HA 5.410 . 5.910 5.289 5.106 5.423 . 0 0 "[ . 1 . 2]" 1
612 1 63 THR H 1 65 ARG QB 5.790 . 6.290 4.763 4.548 4.901 . 0 0 "[ . 1 . 2]" 1
613 1 63 THR H 1 64 LEU MD2 6.400 . 6.900 4.731 4.381 5.037 . 0 0 "[ . 1 . 2]" 1
614 1 63 THR H 1 65 ARG H 4.450 . 4.950 3.817 3.630 3.936 . 0 0 "[ . 1 . 2]" 1
615 1 63 THR H 1 64 LEU H 3.470 . 3.970 2.516 2.462 2.556 . 0 0 "[ . 1 . 2]" 1
616 1 63 THR H 1 64 LEU HB3 5.500 . 6.000 5.511 5.406 5.550 . 0 0 "[ . 1 . 2]" 1
617 1 63 THR H 1 63 THR HB 3.220 . 3.720 2.466 2.429 2.506 . 0 0 "[ . 1 . 2]" 1
618 1 61 PRO HA 1 63 THR H 4.630 . 5.130 4.191 3.906 4.350 . 0 0 "[ . 1 . 2]" 1
619 1 63 THR H 1 64 LEU HB2 4.850 . 5.350 4.215 4.108 4.288 . 0 0 "[ . 1 . 2]" 1
620 1 47 MET H 1 48 THR H 4.680 . 5.180 4.514 4.447 4.669 . 0 0 "[ . 1 . 2]" 1
621 1 46 GLY H 1 47 MET H 3.890 . 4.390 1.995 1.704 2.436 0.096 4 0 "[ . 1 . 2]" 1
622 1 108 ALA H 1 109 MET QG 6.170 . 6.670 5.591 5.504 5.637 . 0 0 "[ . 1 . 2]" 1
623 1 84 TYR H 1 84 TYR QE 5.230 . 5.730 4.060 3.809 4.372 . 0 0 "[ . 1 . 2]" 1
624 1 82 ASP QB 1 84 TYR H . . 5.140 3.024 2.493 3.736 . 0 0 "[ . 1 . 2]" 1
625 1 44 VAL QG 1 47 MET H 7.350 . 7.850 4.583 3.397 4.954 . 0 0 "[ . 1 . 2]" 1
626 1 106 MET H 1 108 ALA H 4.350 . 4.850 3.855 3.803 3.895 . 0 0 "[ . 1 . 2]" 1
627 1 108 ALA H 1 109 MET H 3.380 . 3.880 1.948 1.915 2.010 . 0 0 "[ . 1 . 2]" 1
628 1 71 TYR QE 1 108 ALA H 5.590 . 6.090 4.564 4.464 4.650 . 0 0 "[ . 1 . 2]" 1
629 1 108 ALA H 1 109 MET HA 4.830 . 5.330 4.686 4.641 4.744 . 0 0 "[ . 1 . 2]" 1
630 1 107 ASP HA 1 108 ALA H 3.510 . 4.010 3.326 3.285 3.371 . 0 0 "[ . 1 . 2]" 1
631 1 106 MET HA 1 108 ALA H 4.420 . 4.920 3.679 3.614 3.752 . 0 0 "[ . 1 . 2]" 1
632 1 106 MET HB3 1 108 ALA H 5.290 . 5.790 5.035 4.688 5.307 . 0 0 "[ . 1 . 2]" 1
633 1 108 ALA H 1 109 MET QB 5.020 . 5.520 3.911 3.855 3.961 . 0 0 "[ . 1 . 2]" 1
634 1 53 ASP HA 1 92 ALA H 4.180 . 4.680 2.396 2.167 2.572 . 0 0 "[ . 1 . 2]" 1
635 1 91 PHE QD 1 92 ALA H 4.770 . 5.270 3.374 3.061 4.037 . 0 0 "[ . 1 . 2]" 1
636 1 91 PHE HB2 1 92 ALA H 3.850 . 4.350 2.370 2.183 2.545 . 0 0 "[ . 1 . 2]" 1
637 1 55 LEU HG 1 92 ALA H 4.360 . 4.860 3.090 2.894 3.341 . 0 0 "[ . 1 . 2]" 1
638 1 83 ARG QB 1 84 TYR H 4.620 . 5.120 3.805 2.940 4.036 . 0 0 "[ . 1 . 2]" 1
639 1 84 TYR H 1 85 THR H 3.410 . 3.910 1.758 1.712 1.848 0.088 19 0 "[ . 1 . 2]" 1
640 1 83 ARG H 1 84 TYR H 3.900 . 4.400 2.966 1.701 3.335 0.099 5 0 "[ . 1 . 2]" 1
641 1 84 TYR H 1 86 LYS H 4.050 . 4.550 3.051 2.719 3.492 . 0 0 "[ . 1 . 2]" 1
642 1 82 ASP HA 1 84 TYR H 4.490 . 4.990 3.843 3.263 4.154 . 0 0 "[ . 1 . 2]" 1
643 1 84 TYR H 1 84 TYR HB3 3.580 . 4.080 3.455 3.314 3.665 . 0 0 "[ . 1 . 2]" 1
644 1 91 PHE HA 1 92 ALA H 3.540 . 4.040 2.421 2.346 2.486 . 0 0 "[ . 1 . 2]" 1
645 1 110 ASP HB3 1 111 GLY H 4.520 . 5.020 4.267 4.172 4.453 . 0 0 "[ . 1 . 2]" 1
646 1 111 GLY H 1 121 VAL QG 6.590 . 7.090 4.355 3.982 4.506 . 0 0 "[ . 1 . 2]" 1
647 1 111 GLY H 1 121 VAL H 4.690 . 5.190 4.716 4.620 4.770 . 0 0 "[ . 1 . 2]" 1
648 1 111 GLY H 1 120 ARG HA 4.580 . 5.080 3.805 3.456 4.070 . 0 0 "[ . 1 . 2]" 1
649 1 110 ASP HA 1 111 GLY H 3.380 . 3.880 2.148 2.123 2.202 . 0 0 "[ . 1 . 2]" 1
650 1 111 GLY H 1 119 LEU QB 5.310 . 5.810 2.397 1.838 4.136 . 0 0 "[ . 1 . 2]" 1
651 1 109 MET QB 1 111 GLY H 6.170 . 6.670 5.582 5.532 5.612 . 0 0 "[ . 1 . 2]" 1
652 1 111 GLY H 1 119 LEU HG 5.500 . 6.000 4.542 3.321 4.892 . 0 0 "[ . 1 . 2]" 1
653 1 111 GLY H 1 112 ALA MB 5.380 . 5.880 4.355 4.204 4.448 . 0 0 "[ . 1 . 2]" 1
654 1 111 GLY H 1 119 LEU QD 7.090 . 7.590 3.800 3.039 4.254 . 0 0 "[ . 1 . 2]" 1
655 1 110 ASP HB2 1 111 GLY H 4.460 . 4.960 3.956 3.751 4.216 . 0 0 "[ . 1 . 2]" 1
656 1 111 GLY H 1 119 LEU H 4.680 . 5.180 3.685 3.416 4.540 . 0 0 "[ . 1 . 2]" 1
657 1 103 GLU H 1 103 GLU HG2 3.440 . 3.940 2.091 1.904 2.263 . 0 0 "[ . 1 . 2]" 1
658 1 103 GLU H 1 103 GLU HG3 3.380 . 3.880 2.998 2.884 3.146 . 0 0 "[ . 1 . 2]" 1
659 1 103 GLU H 1 103 GLU QB 3.590 . 4.090 2.617 2.534 2.666 . 0 0 "[ . 1 . 2]" 1
660 1 48 THR MG 1 103 GLU H 5.360 . 5.860 4.282 4.008 4.494 . 0 0 "[ . 1 . 2]" 1
661 1 105 ALA MB 1 107 ASP H 5.920 . 6.420 4.607 4.557 4.679 . 0 0 "[ . 1 . 2]" 1
662 1 104 ASP H 1 107 ASP H 5.220 . 5.720 4.627 4.453 4.804 . 0 0 "[ . 1 . 2]" 1
663 1 107 ASP H 1 109 MET H 5.500 . 6.000 4.315 4.243 4.384 . 0 0 "[ . 1 . 2]" 1
664 1 107 ASP H 1 107 ASP QB 3.380 . 3.880 2.234 2.218 2.255 . 0 0 "[ . 1 . 2]" 1
665 1 106 MET QG 1 107 ASP H 4.480 . 4.980 2.617 2.000 3.247 . 0 0 "[ . 1 . 2]" 1
666 1 107 ASP H 1 108 ALA MB 5.040 . 5.540 4.058 3.968 4.164 . 0 0 "[ . 1 . 2]" 1
667 1 107 ASP H 1 108 ALA H 3.390 . 3.890 2.716 2.648 2.787 . 0 0 "[ . 1 . 2]" 1
668 1 106 MET HB3 1 107 ASP H 3.600 . 4.100 3.190 2.596 3.675 . 0 0 "[ . 1 . 2]" 1
669 1 106 MET HB2 1 107 ASP H 4.220 . 4.720 4.018 3.859 4.141 . 0 0 "[ . 1 . 2]" 1
670 1 132 SER H 1 133 HIS H 4.140 . 4.640 2.462 1.714 4.147 0.086 18 0 "[ . 1 . 2]" 1
671 1 67 VAL H 1 68 PHE H 3.500 . 4.000 2.385 2.214 2.527 . 0 0 "[ . 1 . 2]" 1
672 1 68 PHE H 1 68 PHE QD 4.130 . 4.630 2.830 2.773 2.870 . 0 0 "[ . 1 . 2]" 1
673 1 68 PHE H 1 68 PHE QE 5.710 . 6.210 5.105 5.072 5.127 . 0 0 "[ . 1 . 2]" 1
674 1 68 PHE H 1 70 LYS H 5.010 . 5.510 4.160 4.094 4.228 . 0 0 "[ . 1 . 2]" 1
675 1 68 PHE H 1 69 GLU HA 5.040 . 5.540 4.838 4.797 4.886 . 0 0 "[ . 1 . 2]" 1
676 1 64 LEU HA 1 68 PHE H 4.250 . 4.750 4.005 3.849 4.152 . 0 0 "[ . 1 . 2]" 1
677 1 68 PHE H 1 68 PHE HB3 3.780 . 4.280 3.499 3.443 3.548 . 0 0 "[ . 1 . 2]" 1
678 1 68 PHE H 1 68 PHE HB2 3.690 . 4.190 2.236 2.160 2.303 . 0 0 "[ . 1 . 2]" 1
679 1 67 VAL HB 1 68 PHE H 3.920 . 4.420 2.862 2.798 2.909 . 0 0 "[ . 1 . 2]" 1
680 1 68 PHE H 1 96 PHE HZ 5.020 . 5.520 5.098 5.066 5.131 . 0 0 "[ . 1 . 2]" 1
681 1 65 ARG QB 1 68 PHE H 6.170 . 6.670 5.041 4.984 5.132 . 0 0 "[ . 1 . 2]" 1
682 1 66 ARG QB 1 68 PHE H 6.170 . 6.670 5.335 5.114 5.473 . 0 0 "[ . 1 . 2]" 1
683 1 63 THR MG 1 68 PHE H 6.610 . 7.110 5.567 5.542 5.581 . 0 0 "[ . 1 . 2]" 1
684 1 131 ASP HA 1 132 SER H 2.810 . 3.310 2.452 2.083 2.974 . 0 0 "[ . 1 . 2]" 1
685 1 68 PHE H 1 71 TYR QD 5.440 . 5.940 4.736 4.703 4.795 . 0 0 "[ . 1 . 2]" 1
686 1 68 PHE H 1 71 TYR QE 5.780 . 6.280 5.144 5.065 5.183 . 0 0 "[ . 1 . 2]" 1
687 1 36 SER H 1 37 TYR H 4.870 . 5.370 4.445 4.179 4.654 . 0 0 "[ . 1 . 2]" 1
688 1 131 ASP QB 1 132 SER H 4.070 . 4.570 3.296 1.912 3.772 . 0 0 "[ . 1 . 2]" 1
689 1 93 PHE H 1 93 PHE QD 4.950 . 5.450 4.137 4.068 4.188 . 0 0 "[ . 1 . 2]" 1
690 1 92 ALA MB 1 93 PHE H 4.320 . 4.820 3.521 3.442 3.601 . 0 0 "[ . 1 . 2]" 1
691 1 79 ILE MG 1 93 PHE H 6.270 . 6.770 4.667 4.166 5.024 . 0 0 "[ . 1 . 2]" 1
692 1 73 ARG H 1 96 PHE QD 4.790 . 5.290 3.523 3.304 3.799 . 0 0 "[ . 1 . 2]" 1
693 1 73 ARG H 1 96 PHE QE 5.100 . 5.600 3.284 3.171 3.557 . 0 0 "[ . 1 . 2]" 1
694 1 73 ARG H 1 74 VAL HA 4.890 . 5.390 4.745 4.690 4.828 . 0 0 "[ . 1 . 2]" 1
695 1 73 ARG H 1 73 ARG QD 5.210 . 5.710 4.533 4.358 4.628 . 0 0 "[ . 1 . 2]" 1
696 1 73 ARG H 1 73 ARG QG 3.670 . 4.170 2.538 2.382 2.644 . 0 0 "[ . 1 . 2]" 1
697 1 73 ARG H 1 74 VAL QG 6.250 . 6.750 3.892 3.761 4.034 . 0 0 "[ . 1 . 2]" 1
698 1 87 GLU QB 1 88 SER H 4.440 . 4.940 3.210 1.635 4.057 0.165 5 0 "[ . 1 . 2]" 1
699 1 73 ARG H 1 97 HIS HD2 4.360 . 4.860 4.430 4.381 4.501 . 0 0 "[ . 1 . 2]" 1
700 1 61 PRO HD2 1 62 ASP H 3.110 . 3.610 2.673 2.572 2.756 . 0 0 "[ . 1 . 2]" 1
701 1 61 PRO HG2 1 62 ASP H 3.130 . 3.630 2.438 2.184 2.563 . 0 0 "[ . 1 . 2]" 1
702 1 65 ARG QD 1 66 ARG H 5.670 . 5.830 4.151 3.329 4.412 . 0 0 "[ . 1 . 2]" 1
703 1 62 ASP QB 1 66 ARG H 6.060 . 6.560 5.329 5.097 5.490 . 0 0 "[ . 1 . 2]" 1
704 1 65 ARG QB 1 66 ARG H 3.230 . 3.730 2.269 2.171 2.363 . 0 0 "[ . 1 . 2]" 1
705 1 66 ARG H 1 66 ARG QG 3.780 . 4.280 2.437 1.969 3.491 . 0 0 "[ . 1 . 2]" 1
706 1 62 ASP H 1 63 THR H 3.490 . 3.990 2.577 2.543 2.652 . 0 0 "[ . 1 . 2]" 1
707 1 62 ASP H 1 64 LEU H 4.730 . 5.230 4.049 3.929 4.195 . 0 0 "[ . 1 . 2]" 1
708 1 60 SER HA 1 62 ASP H 4.920 . 5.420 4.316 4.161 4.440 . 0 0 "[ . 1 . 2]" 1
709 1 62 ASP H 1 62 ASP QB 3.200 . 3.700 2.273 2.249 2.320 . 0 0 "[ . 1 . 2]" 1
710 1 62 ASP H 1 77 VAL QG 7.000 . 7.500 4.368 4.018 4.578 . 0 0 "[ . 1 . 2]" 1
711 1 62 ASP H 1 92 ALA MB 6.610 . 7.110 5.549 5.441 5.631 . 0 0 "[ . 1 . 2]" 1
712 1 62 ASP H 1 79 ILE MD 6.340 . 6.840 4.882 4.638 5.113 . 0 0 "[ . 1 . 2]" 1
713 1 61 PRO HG3 1 62 ASP H 4.020 . 4.520 3.975 3.781 4.079 . 0 0 "[ . 1 . 2]" 1
714 1 65 ARG QG 1 66 ARG H . . 5.460 3.428 3.071 4.305 . 0 0 "[ . 1 . 2]" 1
715 1 62 ASP HA 1 66 ARG H 4.880 . 5.380 4.442 4.318 4.657 . 0 0 "[ . 1 . 2]" 1
716 1 63 THR HA 1 66 ARG H 3.730 . 4.230 3.370 3.276 3.478 . 0 0 "[ . 1 . 2]" 1
717 1 66 ARG H 1 66 ARG QD 4.490 . 4.990 3.664 2.153 4.089 . 0 0 "[ . 1 . 2]" 1
718 1 66 ARG H 1 67 VAL QG 5.890 . 6.390 3.927 3.816 3.998 . 0 0 "[ . 1 . 2]" 1
719 1 66 ARG H 1 68 PHE H 5.000 . 5.500 4.370 4.292 4.427 . 0 0 "[ . 1 . 2]" 1
720 1 64 LEU H 1 66 ARG H 5.250 . 5.750 4.718 4.606 4.819 . 0 0 "[ . 1 . 2]" 1
721 1 65 ARG H 1 67 VAL H 4.190 . 4.690 3.621 3.578 3.667 . 0 0 "[ . 1 . 2]" 1
722 1 67 VAL H 1 69 GLU H 4.480 . 4.980 3.601 3.386 3.748 . 0 0 "[ . 1 . 2]" 1
723 1 64 LEU H 1 67 VAL H 5.230 . 5.730 4.921 4.764 5.007 . 0 0 "[ . 1 . 2]" 1
724 1 67 VAL H 1 67 VAL HB 3.200 . 3.700 2.304 2.239 2.358 . 0 0 "[ . 1 . 2]" 1
725 1 67 VAL H 1 109 MET ME 6.610 . 7.110 5.502 5.410 5.556 . 0 0 "[ . 1 . 2]" 1
726 1 67 VAL H 1 67 VAL QG . . 3.940 2.443 2.330 2.566 . 0 0 "[ . 1 . 2]" 1
727 1 64 LEU MD2 1 67 VAL H 6.610 . 7.110 4.986 4.729 5.100 . 0 0 "[ . 1 . 2]" 1
728 1 64 LEU MD1 1 67 VAL H 6.610 . 7.110 4.820 4.678 4.984 . 0 0 "[ . 1 . 2]" 1
729 1 67 VAL H 1 68 PHE HB2 5.050 . 5.550 4.387 4.248 4.507 . 0 0 "[ . 1 . 2]" 1
730 1 66 ARG QB 1 67 VAL H 4.230 . 4.730 3.683 3.163 3.862 . 0 0 "[ . 1 . 2]" 1
731 1 66 ARG QG 1 67 VAL H 4.700 . 5.200 2.643 2.183 3.136 . 0 0 "[ . 1 . 2]" 1
732 1 76 ASP H 1 95 ARG H 4.360 . 4.860 2.799 2.473 3.115 . 0 0 "[ . 1 . 2]" 1
733 1 76 ASP H 1 94 VAL QG 6.310 . 6.810 4.112 3.599 4.719 . 0 0 "[ . 1 . 2]" 1
734 1 75 GLY H 1 76 ASP H 3.800 . 4.300 2.252 1.972 2.576 . 0 0 "[ . 1 . 2]" 1
735 1 76 ASP H 1 96 PHE HA 5.020 . 5.520 4.544 4.308 4.774 . 0 0 "[ . 1 . 2]" 1
736 1 71 TYR H 1 71 TYR QE 4.690 . 5.190 4.196 4.181 4.216 . 0 0 "[ . 1 . 2]" 1
737 1 71 TYR H 1 71 TYR QD 3.770 . 4.270 2.072 2.000 2.187 . 0 0 "[ . 1 . 2]" 1
738 1 68 PHE HA 1 71 TYR H 4.200 . 4.700 3.583 3.515 3.681 . 0 0 "[ . 1 . 2]" 1
739 1 71 TYR H 1 71 TYR HB3 3.750 . 4.250 3.588 3.573 3.597 . 0 0 "[ . 1 . 2]" 1
740 1 71 TYR H 1 71 TYR HB2 3.640 . 4.140 2.391 2.365 2.405 . 0 0 "[ . 1 . 2]" 1
741 1 70 LYS QG 1 71 TYR H 4.250 . 4.750 2.497 2.424 2.526 . 0 0 "[ . 1 . 2]" 1
742 1 75 GLY H 1 96 PHE HA 3.920 . 4.420 2.674 2.291 2.968 . 0 0 "[ . 1 . 2]" 1
743 1 74 VAL QG 1 75 GLY H . . 5.260 2.501 2.294 2.872 . 0 0 "[ . 1 . 2]" 1
744 1 74 VAL HA 1 75 GLY H 3.530 . 4.030 2.247 2.178 2.315 . 0 0 "[ . 1 . 2]" 1
745 1 47 MET ME 1 75 GLY H 5.560 . 6.060 4.412 4.084 4.676 . 0 0 "[ . 1 . 2]" 1
746 1 69 GLU H 1 71 TYR H 4.470 . 4.970 4.295 4.249 4.334 . 0 0 "[ . 1 . 2]" 1
747 1 55 LEU H 1 91 PHE HB2 4.480 . 4.980 3.683 3.248 4.239 . 0 0 "[ . 1 . 2]" 1
748 1 55 LEU H 1 91 PHE HA 4.440 . 4.940 1.912 1.779 2.290 0.021 17 0 "[ . 1 . 2]" 1
749 1 54 ASN H 1 55 LEU H 3.840 . 4.340 2.444 2.251 3.268 . 0 0 "[ . 1 . 2]" 1
750 1 55 LEU H 1 56 THR H 4.510 . 5.010 4.549 4.355 4.626 . 0 0 "[ . 1 . 2]" 1
751 1 54 ASN HA 1 55 LEU H 3.460 . 3.960 2.871 2.197 2.991 . 0 0 "[ . 1 . 2]" 1
752 1 54 ASN HB3 1 55 LEU H 4.550 . 5.050 4.233 4.112 4.353 . 0 0 "[ . 1 . 2]" 1
753 1 55 LEU H 1 55 LEU HG 4.290 . 4.790 3.443 3.348 3.993 . 0 0 "[ . 1 . 2]" 1
754 1 55 LEU H 1 55 LEU HB2 3.880 . 4.380 2.324 2.263 2.370 . 0 0 "[ . 1 . 2]" 1
755 1 55 LEU H 1 55 LEU HB3 3.700 . 4.200 3.531 3.500 3.579 . 0 0 "[ . 1 . 2]" 1
756 1 55 LEU H 1 59 THR HB 5.500 . 6.000 5.459 5.287 5.543 . 0 0 "[ . 1 . 2]" 1
757 1 57 TYR QE 1 58 ARG H 5.970 . 6.470 5.057 4.330 5.260 . 0 0 "[ . 1 . 2]" 1
758 1 57 TYR HB3 1 58 ARG H 4.610 . 5.110 4.479 4.171 4.550 . 0 0 "[ . 1 . 2]" 1
759 1 57 TYR H 1 58 ARG H 4.350 . 4.850 2.902 1.634 3.053 0.166 15 0 "[ . 1 . 2]" 1
760 1 57 TYR QD 1 58 ARG H 4.830 . 5.330 3.989 3.454 4.134 . 0 0 "[ . 1 . 2]" 1
761 1 58 ARG H 1 59 THR HA 5.480 . 5.980 4.552 4.480 4.629 . 0 0 "[ . 1 . 2]" 1
762 1 58 ARG H 1 59 THR HB 5.500 . 6.000 4.235 4.137 4.536 . 0 0 "[ . 1 . 2]" 1
763 1 58 ARG H 1 59 THR H 3.530 . 4.030 2.177 2.120 2.352 . 0 0 "[ . 1 . 2]" 1
764 1 58 ARG H 1 58 ARG QD 4.270 . 4.770 3.859 3.701 3.952 . 0 0 "[ . 1 . 2]" 1
765 1 56 THR MG 1 58 ARG H 5.000 . 5.500 2.920 2.670 3.378 . 0 0 "[ . 1 . 2]" 1
766 1 58 ARG H 1 58 ARG QG 4.310 . 4.810 2.040 1.848 2.177 . 0 0 "[ . 1 . 2]" 1
767 1 82 ASP HA 1 86 LYS H 4.830 . 5.330 4.786 4.168 4.981 . 0 0 "[ . 1 . 2]" 1
768 1 85 THR H 1 86 LYS H 3.860 . 4.360 1.814 1.728 2.130 0.072 14 0 "[ . 1 . 2]" 1
769 1 82 ASP QB 1 86 LYS H 4.430 . 4.930 2.721 2.147 3.209 . 0 0 "[ . 1 . 2]" 1
770 1 86 LYS H 1 86 LYS QD 4.690 . 5.190 2.999 2.729 3.223 . 0 0 "[ . 1 . 2]" 1
771 1 86 LYS H 1 87 GLU QB 6.170 . 6.670 5.052 4.783 5.256 . 0 0 "[ . 1 . 2]" 1
772 1 91 PHE H 1 92 ALA HA 4.810 . 5.310 4.760 4.660 4.829 . 0 0 "[ . 1 . 2]" 1
773 1 91 PHE H 1 92 ALA H 4.350 . 4.850 4.372 4.348 4.398 . 0 0 "[ . 1 . 2]" 1
774 1 90 GLY H 1 91 PHE H 3.600 . 4.100 2.450 1.742 2.822 0.058 20 0 "[ . 1 . 2]" 1
775 1 89 ARG H 1 91 PHE H 5.500 . 6.000 4.180 3.081 5.526 . 0 0 "[ . 1 . 2]" 1
776 1 91 PHE H 1 91 PHE QD 4.060 . 4.560 2.620 1.859 3.440 . 0 0 "[ . 1 . 2]" 1
777 1 89 ARG QB 1 91 PHE H 5.340 . 5.840 3.978 2.741 4.778 . 0 0 "[ . 1 . 2]" 1
778 1 55 LEU QD 1 91 PHE H 7.330 . 7.550 4.325 4.137 4.488 . 0 0 "[ . 1 . 2]" 1
779 1 79 ILE MG 1 91 PHE H 4.880 . 5.380 3.717 3.171 4.111 . 0 0 "[ . 1 . 2]" 1
780 1 79 ILE MD 1 91 PHE H 6.610 . 7.110 4.197 3.655 4.778 . 0 0 "[ . 1 . 2]" 1
781 1 54 ASN H 1 91 PHE HB2 5.500 . 6.000 2.482 2.006 2.774 . 0 0 "[ . 1 . 2]" 1
782 1 71 TYR QE 1 109 MET H 5.470 . 5.970 4.922 4.899 4.948 . 0 0 "[ . 1 . 2]" 1
783 1 105 ALA HA 1 109 MET H 4.470 . 4.970 4.254 4.194 4.294 . 0 0 "[ . 1 . 2]" 1
784 1 109 MET H 1 109 MET ME 5.870 . 6.370 4.588 4.470 4.658 . 0 0 "[ . 1 . 2]" 1
785 1 109 MET H 1 110 ASP HB3 4.840 . 5.340 4.009 3.853 4.090 . 0 0 "[ . 1 . 2]" 1
786 1 106 MET HA 1 109 MET H 4.260 . 4.760 3.543 3.465 3.642 . 0 0 "[ . 1 . 2]" 1
787 1 54 ASN HD21 1 120 ARG HG3 4.610 . 5.110 4.035 3.621 4.457 . 0 0 "[ . 1 . 2]" 1
788 1 54 ASN HD21 1 119 LEU HA 5.280 . 5.780 3.477 3.098 3.846 . 0 0 "[ . 1 . 2]" 1
789 1 54 ASN HD21 1 117 ARG QB 4.780 . 5.280 3.335 2.861 4.023 . 0 0 "[ . 1 . 2]" 1
790 1 54 ASN HD21 1 120 ARG HB2 4.590 . 5.090 4.041 3.629 4.324 . 0 0 "[ . 1 . 2]" 1
791 1 54 ASN HD22 1 117 ARG QG 5.250 . 5.750 3.489 2.430 4.702 . 0 0 "[ . 1 . 2]" 1
792 1 54 ASN HD22 1 119 LEU HA 4.690 . 5.190 5.176 4.830 5.417 0.227 14 0 "[ . 1 . 2]" 1
793 1 54 ASN HB3 1 54 ASN HD22 3.620 . 4.120 3.512 3.458 3.561 . 0 0 "[ . 1 . 2]" 1
794 1 54 ASN HB2 1 54 ASN HD22 3.790 . 4.290 3.810 3.732 3.926 . 0 0 "[ . 1 . 2]" 1
795 1 54 ASN HD22 1 117 ARG QB 4.510 . 5.010 2.364 1.605 3.720 0.195 4 0 "[ . 1 . 2]" 1
796 1 54 ASN HD22 1 120 ARG HB2 4.380 . 4.880 4.662 4.384 4.764 . 0 0 "[ . 1 . 2]" 1
797 1 54 ASN HA 1 54 ASN HD22 4.360 . 4.860 4.450 4.237 4.604 . 0 0 "[ . 1 . 2]" 1
798 1 54 ASN HD22 1 119 LEU QD 7.410 . 7.910 5.684 5.349 5.962 . 0 0 "[ . 1 . 2]" 1
799 1 55 LEU HA 1 56 THR H 3.150 . 3.650 2.197 2.131 2.523 . 0 0 "[ . 1 . 2]" 1
800 1 55 LEU HB3 1 56 THR H 4.330 . 4.830 3.287 2.204 3.628 . 0 0 "[ . 1 . 2]" 1
801 1 56 THR H 1 59 THR MG 5.640 . 6.140 3.592 3.338 3.955 . 0 0 "[ . 1 . 2]" 1
802 1 55 LEU QD 1 56 THR H 5.730 . 6.230 3.342 3.084 3.496 . 0 0 "[ . 1 . 2]" 1
803 1 54 ASN HD22 1 119 LEU H 4.950 . 5.450 4.199 3.553 5.548 0.098 17 0 "[ . 1 . 2]" 1
804 1 100 ARG H 1 100 ARG HE 5.500 . 6.000 3.412 2.686 5.173 . 0 0 "[ . 1 . 2]" 1
805 1 100 ARG HA 1 100 ARG HE 5.130 . 5.630 4.327 4.137 4.754 . 0 0 "[ . 1 . 2]" 1
806 1 100 ARG QB 1 100 ARG HE 4.280 . 4.780 2.025 1.897 2.331 . 0 0 "[ . 1 . 2]" 1
807 1 82 ASP QB 1 85 THR H . . 4.940 2.618 1.896 3.073 . 0 0 "[ . 1 . 2]" 1
808 1 85 THR H 1 86 LYS HA 4.830 . 5.330 3.984 3.820 4.301 . 0 0 "[ . 1 . 2]" 1
809 1 84 TYR HB3 1 85 THR H 4.490 . 4.990 4.507 4.386 4.567 . 0 0 "[ . 1 . 2]" 1
810 1 120 ARG HA 1 120 ARG HE 4.460 . 4.960 4.359 4.027 4.561 . 0 0 "[ . 1 . 2]" 1
811 1 120 ARG HB3 1 120 ARG HE 4.670 . 5.170 3.638 2.733 4.399 . 0 0 "[ . 1 . 2]" 1
812 1 37 TYR QD 1 38 GLY H 5.560 . 6.060 4.298 3.902 4.752 . 0 0 "[ . 1 . 2]" 1
813 1 38 GLY H 1 39 ARG H 3.630 . 4.130 3.190 2.401 3.915 . 0 0 "[ . 1 . 2]" 1
814 1 37 TYR H 1 38 GLY H 3.410 . 3.910 2.739 1.794 3.343 0.006 20 0 "[ . 1 . 2]" 1
815 1 36 SER QB 1 38 GLY H 5.750 . 6.250 3.373 2.528 4.668 . 0 0 "[ . 1 . 2]" 1
816 1 37 TYR QB 1 38 GLY H 4.840 . 5.160 3.094 2.180 3.869 . 0 0 "[ . 1 . 2]" 1
817 1 38 GLY H 1 39 ARG QG 6.170 . 6.670 4.887 4.292 5.562 . 0 0 "[ . 1 . 2]" 1
818 1 36 SER HA 1 38 GLY H 5.500 . 6.000 4.179 3.356 4.851 . 0 0 "[ . 1 . 2]" 1
819 1 47 MET ME 1 95 ARG HE 6.550 . 7.050 2.790 2.005 3.939 . 0 0 "[ . 1 . 2]" 1
820 1 56 THR MG 1 117 ARG HE 6.450 . 6.950 4.285 2.445 5.419 . 0 0 "[ . 1 . 2]" 1
821 1 44 VAL QG 1 95 ARG HE 6.700 . 7.200 2.467 2.001 3.669 . 0 0 "[ . 1 . 2]" 1
822 1 65 ARG HE 1 73 ARG HA 5.500 . 6.000 5.184 5.018 5.312 . 0 0 "[ . 1 . 2]" 1
823 1 73 ARG HA 1 73 ARG HE 5.500 . 6.000 4.838 4.327 5.150 . 0 0 "[ . 1 . 2]" 1
824 1 65 ARG HA 1 65 ARG HE 4.920 . 5.420 4.431 4.078 4.701 . 0 0 "[ . 1 . 2]" 1
825 1 65 ARG HE 1 77 VAL QG 6.650 . 7.150 4.424 3.427 4.849 . 0 0 "[ . 1 . 2]" 1
826 1 45 GLU QG 1 46 GLY H 5.220 . 5.720 3.688 2.843 4.459 . 0 0 "[ . 1 . 2]" 1
827 1 45 GLU QB 1 46 GLY H 4.510 . 5.010 3.691 3.182 4.021 . 0 0 "[ . 1 . 2]" 1
828 1 88 SER QB 1 90 GLY H 6.170 . 6.670 4.158 2.680 5.567 . 0 0 "[ . 1 . 2]" 1
829 1 68 PHE QE 1 109 MET ME 4.520 . 5.020 2.758 2.404 2.911 . 0 0 "[ . 1 . 2]" 1
830 1 68 PHE HZ 1 109 MET ME 4.440 . 4.940 3.071 2.457 3.315 . 0 0 "[ . 1 . 2]" 1
831 1 67 VAL HA 1 109 MET ME 6.000 . 6.500 4.434 4.277 4.655 . 0 0 "[ . 1 . 2]" 1
832 1 67 VAL QG 1 109 MET ME . . 4.450 1.960 1.910 2.012 . 0 0 "[ . 1 . 2]" 1
833 1 68 PHE QD 1 109 MET ME 5.190 . 5.690 2.969 2.864 3.098 . 0 0 "[ . 1 . 2]" 1
834 1 111 GLY QA 1 119 LEU QB 6.930 . 7.430 3.943 3.357 5.502 . 0 0 "[ . 1 . 2]" 1
835 1 74 VAL QG 1 75 GLY QA 7.340 . 7.840 3.549 3.467 3.640 . 0 0 "[ . 1 . 2]" 1
836 1 61 PRO HG3 1 79 ILE MD 4.580 . 5.080 2.724 2.233 3.129 . 0 0 "[ . 1 . 2]" 1
837 1 78 TYR HA 1 79 ILE MD 6.470 . 6.970 4.679 3.510 5.413 . 0 0 "[ . 1 . 2]" 1
838 1 113 VAL HA 1 114 LEU QB 5.670 . 6.170 4.114 3.928 4.399 . 0 0 "[ . 1 . 2]" 1
839 1 60 SER HA 1 79 ILE MD 4.340 . 4.840 3.309 2.950 3.657 . 0 0 "[ . 1 . 2]" 1
840 1 79 ILE MD 1 92 ALA HA 4.800 . 5.300 3.115 2.063 3.664 . 0 0 "[ . 1 . 2]" 1
841 1 61 PRO HD3 1 79 ILE MD 3.820 . 4.320 1.878 1.795 2.074 0.005 20 0 "[ . 1 . 2]" 1
842 1 79 ILE H 1 79 ILE MD 5.330 . 5.830 4.149 3.260 4.447 . 0 0 "[ . 1 . 2]" 1
843 1 61 PRO HG2 1 79 ILE MD 5.070 . 5.570 3.891 3.542 4.172 . 0 0 "[ . 1 . 2]" 1
844 1 53 ASP QB 1 54 ASN H 4.650 . 5.150 2.021 1.906 2.131 . 0 0 "[ . 1 . 2]" 1
845 1 53 ASP QB 1 55 LEU H 6.170 . 6.670 4.212 4.042 4.907 . 0 0 "[ . 1 . 2]" 1
846 1 53 ASP QB 1 54 ASN HA 5.170 . 5.670 3.672 3.551 3.925 . 0 0 "[ . 1 . 2]" 1
847 1 53 ASP QB 1 120 ARG HB3 4.690 . 5.190 3.689 2.934 4.333 . 0 0 "[ . 1 . 2]" 1
848 1 53 ASP QB 1 91 PHE HB2 4.950 . 5.450 2.367 2.218 2.715 . 0 0 "[ . 1 . 2]" 1
849 1 53 ASP QB 1 120 ARG HB2 4.560 . 5.060 2.952 2.475 4.007 . 0 0 "[ . 1 . 2]" 1
850 1 47 MET ME 1 95 ARG QD 6.070 . 6.570 2.858 2.116 3.561 . 0 0 "[ . 1 . 2]" 1
851 1 42 PRO QG 1 95 ARG QD 6.350 . 6.850 4.563 2.266 5.090 . 0 0 "[ . 1 . 2]" 1
852 1 98 ASP HB2 1 100 ARG QG 6.140 . 6.640 4.615 4.028 4.861 . 0 0 "[ . 1 . 2]" 1
853 1 82 ASP QB 1 86 LYS HA 6.050 . 6.550 3.640 2.686 4.355 . 0 0 "[ . 1 . 2]" 1
854 1 98 ASP HB2 1 100 ARG H 5.240 . 5.740 4.946 4.651 5.134 . 0 0 "[ . 1 . 2]" 1
855 1 98 ASP HB2 1 101 ASP H 3.930 . 4.430 3.481 3.186 3.974 . 0 0 "[ . 1 . 2]" 1
856 1 98 ASP HB3 1 100 ARG QG 5.040 . 5.540 3.205 2.695 3.467 . 0 0 "[ . 1 . 2]" 1
857 1 98 ASP H 1 98 ASP HB3 3.480 . 3.980 3.450 2.977 3.571 . 0 0 "[ . 1 . 2]" 1
858 1 98 ASP HB3 1 100 ARG QB 5.310 . 5.810 4.746 4.633 4.804 . 0 0 "[ . 1 . 2]" 1
859 1 50 LEU QB 1 121 VAL QG 6.640 . 7.140 4.095 3.858 4.332 . 0 0 "[ . 1 . 2]" 1
860 1 55 LEU HB3 1 92 ALA MB 5.850 . 6.350 4.264 4.122 4.417 . 0 0 "[ . 1 . 2]" 1
861 1 73 ARG QD 1 97 HIS H 6.030 . 6.530 4.513 3.727 4.947 . 0 0 "[ . 1 . 2]" 1
862 1 97 HIS HD2 1 98 ASP HB2 4.660 . 5.160 3.621 3.071 4.512 . 0 0 "[ . 1 . 2]" 1
863 1 98 ASP HB2 1 102 ALA H 5.390 . 5.890 4.432 4.125 5.316 . 0 0 "[ . 1 . 2]" 1
864 1 113 VAL QG 1 119 LEU QB 7.850 . 8.350 3.984 3.056 5.334 . 0 0 "[ . 1 . 2]" 1
865 1 63 THR HA 1 66 ARG QD 4.420 . 4.920 2.755 1.897 3.168 . 0 0 "[ . 1 . 2]" 1
866 1 66 ARG QD 1 67 VAL HA 5.030 . 5.530 3.913 2.850 4.657 . 0 0 "[ . 1 . 2]" 1
867 1 66 ARG QD 1 67 VAL H 4.930 . 5.430 3.645 2.722 4.271 . 0 0 "[ . 1 . 2]" 1
868 1 65 ARG QD 1 74 VAL HB 3.360 . 3.860 2.786 2.546 3.058 . 0 0 "[ . 1 . 2]" 1
869 1 65 ARG QD 1 69 GLU H 4.750 . 5.250 3.816 3.634 3.995 . 0 0 "[ . 1 . 2]" 1
870 1 54 ASN HD22 1 120 ARG QD 5.230 . 5.730 4.378 3.912 5.026 . 0 0 "[ . 1 . 2]" 1
871 1 120 ARG HA 1 120 ARG QD 3.820 . 4.320 1.905 1.833 2.033 . 0 0 "[ . 1 . 2]" 1
872 1 100 ARG QD 1 101 ASP H 4.430 . 4.930 2.505 2.152 3.152 . 0 0 "[ . 1 . 2]" 1
873 1 54 ASN HB3 1 120 ARG QD 5.900 . 6.400 5.115 4.778 5.313 . 0 0 "[ . 1 . 2]" 1
874 1 100 ARG H 1 100 ARG QD 4.390 . 4.890 2.184 1.570 3.823 0.230 11 0 "[ . 1 . 2]" 1
875 1 73 ARG QD 1 98 ASP HB2 5.440 . 5.940 3.872 2.674 4.274 . 0 0 "[ . 1 . 2]" 1
876 1 98 ASP HB2 1 100 ARG QD 5.610 . 6.110 3.828 3.567 4.712 . 0 0 "[ . 1 . 2]" 1
877 1 56 THR MG 1 58 ARG QD 4.420 . 4.920 3.045 2.532 3.310 . 0 0 "[ . 1 . 2]" 1
878 1 83 ARG QD 1 84 TYR QD 6.050 . 6.550 3.714 2.867 4.033 . 0 0 "[ . 1 . 2]" 1
879 1 119 LEU H 1 120 ARG QD 5.890 . 6.390 4.945 4.631 5.300 . 0 0 "[ . 1 . 2]" 1
880 1 56 THR H 1 117 ARG QD 4.390 . 4.890 3.814 3.454 4.059 . 0 0 "[ . 1 . 2]" 1
881 1 56 THR HA 1 117 ARG QD 4.460 . 4.960 2.257 2.038 3.323 . 0 0 "[ . 1 . 2]" 1
882 1 54 ASN HB3 1 117 ARG QD 5.260 . 5.760 4.049 3.654 4.584 . 0 0 "[ . 1 . 2]" 1
883 1 55 LEU QD 1 117 ARG QD 8.320 . 8.820 4.932 4.672 5.161 . 0 0 "[ . 1 . 2]" 1
884 1 117 ARG QD 1 119 LEU QD 8.320 . 8.820 5.314 4.948 5.588 . 0 0 "[ . 1 . 2]" 1
885 1 96 PHE HB3 1 98 ASP HB2 5.500 . 6.000 4.348 4.060 5.214 . 0 0 "[ . 1 . 2]" 1
886 1 96 PHE HB3 1 101 ASP QB 6.170 . 6.670 4.475 3.730 5.543 . 0 0 "[ . 1 . 2]" 1
887 1 64 LEU H 1 64 LEU HB3 3.690 . 4.190 3.240 3.174 3.332 . 0 0 "[ . 1 . 2]" 1
888 1 64 LEU H 1 64 LEU HB2 3.850 . 4.350 1.980 1.943 2.014 . 0 0 "[ . 1 . 2]" 1
889 1 59 THR MG 1 64 LEU HB2 5.430 . 5.930 3.833 3.506 4.086 . 0 0 "[ . 1 . 2]" 1
890 1 64 LEU HB2 1 67 VAL QG 6.890 . 7.390 5.148 5.104 5.204 . 0 0 "[ . 1 . 2]" 1
891 1 96 PHE HB3 1 102 ALA HA 4.770 . 5.270 3.747 3.366 3.949 . 0 0 "[ . 1 . 2]" 1
892 1 91 PHE HB3 1 92 ALA H 4.370 . 4.870 3.768 3.604 3.910 . 0 0 "[ . 1 . 2]" 1
893 1 64 LEU HB3 1 68 PHE QD 5.020 . 5.520 4.487 4.370 4.543 . 0 0 "[ . 1 . 2]" 1
894 1 59 THR MG 1 64 LEU HB3 6.610 . 7.110 5.115 4.877 5.341 . 0 0 "[ . 1 . 2]" 1
895 1 64 LEU HB3 1 67 VAL QG 7.410 . 7.910 5.255 5.161 5.308 . 0 0 "[ . 1 . 2]" 1
896 1 64 LEU HB3 1 65 ARG H 4.080 . 4.580 3.424 3.252 3.593 . 0 0 "[ . 1 . 2]" 1
897 1 64 LEU HB2 1 68 PHE QD 5.980 . 6.480 5.331 5.312 5.360 . 0 0 "[ . 1 . 2]" 1
898 1 70 LYS QE 1 71 TYR H 5.240 . 5.740 4.492 4.310 4.679 . 0 0 "[ . 1 . 2]" 1
899 1 99 LYS HA 1 99 LYS QE 4.610 . 5.110 2.288 2.012 2.579 . 0 0 "[ . 1 . 2]" 1
900 1 99 LYS QE 1 123 MET ME 3.990 . 4.490 2.101 1.879 2.421 . 0 0 "[ . 1 . 2]" 1
901 1 99 LYS HB2 1 99 LYS QE 3.850 . 4.350 2.488 2.075 3.479 . 0 0 "[ . 1 . 2]" 1
902 1 70 LYS QE 1 71 TYR QD 5.410 . 5.910 3.556 3.377 4.301 . 0 0 "[ . 1 . 2]" 1
903 1 70 LYS H 1 70 LYS QE 4.830 . 5.330 4.186 3.144 4.334 . 0 0 "[ . 1 . 2]" 1
904 1 70 LYS QE 1 71 TYR QE 4.650 . 5.150 2.208 2.068 3.701 . 0 0 "[ . 1 . 2]" 1
905 1 67 VAL HA 1 70 LYS QE 3.920 . 4.420 3.278 2.074 3.500 . 0 0 "[ . 1 . 2]" 1
906 1 67 VAL QG 1 70 LYS QE 6.110 . 6.610 2.952 2.795 3.097 . 0 0 "[ . 1 . 2]" 1
907 1 99 LYS QE 1 103 GLU H 6.170 . 6.670 4.351 3.233 4.819 . 0 0 "[ . 1 . 2]" 1
908 1 106 MET HB2 1 110 ASP HB2 4.960 . 5.460 4.154 3.297 4.985 . 0 0 "[ . 1 . 2]" 1
909 1 62 ASP QB 1 65 ARG H 5.710 . 6.210 4.887 4.775 4.976 . 0 0 "[ . 1 . 2]" 1
910 1 62 ASP QB 1 64 LEU H 5.760 . 6.260 4.793 4.674 4.935 . 0 0 "[ . 1 . 2]" 1
911 1 61 PRO HG2 1 62 ASP QB 5.040 . 5.540 3.748 3.576 3.986 . 0 0 "[ . 1 . 2]" 1
912 1 130 PRO QG 1 131 ASP QB 5.900 . 6.400 3.234 2.889 3.843 . 0 0 "[ . 1 . 2]" 1
913 1 62 ASP QB 1 63 THR H 3.430 . 3.930 2.683 2.590 2.843 . 0 0 "[ . 1 . 2]" 1
914 1 101 ASP QB 1 105 ALA MB 7.410 . 7.910 4.174 3.726 4.979 . 0 0 "[ . 1 . 2]" 1
915 1 131 ASP QB 1 133 HIS H 5.130 . 5.630 3.915 2.853 4.575 . 0 0 "[ . 1 . 2]" 1
916 1 98 ASP HB2 1 101 ASP QB 4.910 . 5.410 2.821 2.044 4.412 . 0 0 "[ . 1 . 2]" 1
917 1 107 ASP QB 1 108 ALA H 5.010 . 5.510 3.512 3.452 3.544 . 0 0 "[ . 1 . 2]" 1
918 1 72 GLY H 1 101 ASP QB 5.710 . 6.210 4.241 3.827 5.175 . 0 0 "[ . 1 . 2]" 1
919 1 106 MET QG 1 107 ASP QB 5.870 . 6.160 3.104 2.678 3.565 . 0 0 "[ . 1 . 2]" 1
920 1 96 PHE QE 1 101 ASP QB 6.150 . 6.650 3.134 2.890 3.947 . 0 0 "[ . 1 . 2]" 1
921 1 100 ARG QD 1 101 ASP QB 6.060 . 6.560 3.727 2.492 4.487 . 0 0 "[ . 1 . 2]" 1
922 1 61 PRO HG3 1 62 ASP QB 6.130 . 6.630 5.341 5.185 5.553 . 0 0 "[ . 1 . 2]" 1
923 1 43 ASP QB 1 45 GLU H 5.990 . 6.490 4.264 3.760 4.583 . 0 0 "[ . 1 . 2]" 1
924 1 104 ASP QB 1 106 MET H 6.170 . 6.670 4.681 4.535 4.806 . 0 0 "[ . 1 . 2]" 1
925 1 104 ASP QB 1 105 ALA MB 6.200 . 6.200 3.850 3.793 3.901 . 0 0 "[ . 1 . 2]" 1
926 1 42 PRO QG 1 43 ASP QB 6.930 . 7.430 5.100 4.779 5.333 . 0 0 "[ . 1 . 2]" 1
927 1 56 THR HB 1 59 THR H 5.500 . 6.000 3.898 3.165 4.365 . 0 0 "[ . 1 . 2]" 1
928 1 71 TYR HB2 1 105 ALA HA 4.850 . 5.350 4.538 4.277 4.837 . 0 0 "[ . 1 . 2]" 1
929 1 79 ILE HB 1 92 ALA MB 6.300 . 6.800 4.659 4.447 5.249 . 0 0 "[ . 1 . 2]" 1
930 1 56 THR HB 1 58 ARG QD 4.790 . 5.290 3.844 3.226 4.101 . 0 0 "[ . 1 . 2]" 1
931 1 56 THR HB 1 57 TYR H 4.070 . 4.570 3.330 2.078 3.466 . 0 0 "[ . 1 . 2]" 1
932 1 56 THR HB 1 57 TYR QD 5.210 . 5.710 4.638 3.832 4.693 . 0 0 "[ . 1 . 2]" 1
933 1 36 SER HA 1 37 TYR QB 6.170 . 6.670 4.630 4.328 4.944 . 0 0 "[ . 1 . 2]" 1
934 1 84 TYR HB3 1 85 THR MG 5.720 . 6.220 4.639 4.176 4.783 . 0 0 "[ . 1 . 2]" 1
935 1 84 TYR HB2 1 85 THR H 4.440 . 4.940 4.268 3.951 4.504 . 0 0 "[ . 1 . 2]" 1
936 1 84 TYR H 1 84 TYR HB2 4.010 . 4.510 3.881 3.789 4.007 . 0 0 "[ . 1 . 2]" 1
937 1 85 THR HB 1 86 LYS H 4.250 . 4.750 4.149 3.951 4.326 . 0 0 "[ . 1 . 2]" 1
938 1 85 THR HB 1 87 GLU H 4.160 . 4.660 3.604 3.318 4.062 . 0 0 "[ . 1 . 2]" 1
939 1 85 THR HB 1 87 GLU QB . . 5.230 3.760 3.065 4.231 . 0 0 "[ . 1 . 2]" 1
940 1 48 THR HB 1 99 LYS HA 4.200 . 4.700 3.086 2.590 3.511 . 0 0 "[ . 1 . 2]" 1
941 1 48 THR HB 1 50 LEU QB 6.170 . 6.670 4.285 3.897 4.759 . 0 0 "[ . 1 . 2]" 1
942 1 48 THR HB 1 99 LYS HB2 5.500 . 6.000 4.038 3.698 4.329 . 0 0 "[ . 1 . 2]" 1
943 1 48 THR HB 1 102 ALA MB 4.340 . 4.840 3.272 2.863 3.547 . 0 0 "[ . 1 . 2]" 1
944 1 48 THR HB 1 49 SER H 4.370 . 4.870 3.513 3.092 4.463 . 0 0 "[ . 1 . 2]" 1
945 1 48 THR HB 1 99 LYS HB3 5.230 . 5.730 5.215 4.793 5.365 . 0 0 "[ . 1 . 2]" 1
946 1 48 THR HB 1 123 MET ME 6.520 . 7.020 4.585 4.341 4.803 . 0 0 "[ . 1 . 2]" 1
947 1 54 ASN HB3 1 55 LEU QD 6.480 . 6.980 4.241 4.038 4.407 . 0 0 "[ . 1 . 2]" 1
948 1 54 ASN HB3 1 120 ARG H 4.260 . 4.760 3.033 2.626 3.576 . 0 0 "[ . 1 . 2]" 1
949 1 54 ASN HB2 1 119 LEU HA 4.340 . 4.840 3.631 2.771 4.436 . 0 0 "[ . 1 . 2]" 1
950 1 54 ASN HB2 1 120 ARG H 4.220 . 4.720 2.949 2.400 3.857 . 0 0 "[ . 1 . 2]" 1
951 1 69 GLU QG 1 74 VAL HB 5.380 . 5.880 4.547 3.870 4.809 . 0 0 "[ . 1 . 2]" 1
952 1 54 ASN HB3 1 117 ARG QB 5.470 . 5.970 4.584 3.974 4.999 . 0 0 "[ . 1 . 2]" 1
953 1 53 ASP HA 1 54 ASN HB2 5.110 . 5.610 4.659 4.584 4.799 . 0 0 "[ . 1 . 2]" 1
954 1 54 ASN HB2 1 120 ARG HA 5.360 . 5.860 4.375 4.100 4.672 . 0 0 "[ . 1 . 2]" 1
955 1 99 LYS QD 1 103 GLU HG2 5.600 . 6.100 3.574 2.761 5.068 . 0 0 "[ . 1 . 2]" 1
956 1 100 ARG H 1 103 GLU HG2 5.360 . 5.860 4.450 4.338 4.600 . 0 0 "[ . 1 . 2]" 1
957 1 56 THR MG 1 57 TYR HB3 6.150 . 6.650 3.762 3.642 3.987 . 0 0 "[ . 1 . 2]" 1
958 1 65 ARG QG 1 69 GLU QG 6.930 . 7.430 4.820 4.538 5.516 . 0 0 "[ . 1 . 2]" 1
959 1 102 ALA H 1 103 GLU HG2 4.480 . 4.980 3.859 3.608 4.059 . 0 0 "[ . 1 . 2]" 1
960 1 103 GLU HA 1 103 GLU HG2 4.080 . 4.580 3.818 3.749 3.892 . 0 0 "[ . 1 . 2]" 1
961 1 103 GLU HA 1 103 GLU HG3 3.770 . 4.270 3.694 3.656 3.743 . 0 0 "[ . 1 . 2]" 1
962 1 63 THR HB 1 64 LEU QD 6.040 . 6.540 3.473 3.161 3.770 . 0 0 "[ . 1 . 2]" 1
963 1 63 THR HB 1 64 LEU HB2 4.670 . 5.170 4.215 4.153 4.323 . 0 0 "[ . 1 . 2]" 1
964 1 62 ASP QB 1 63 THR HB 5.470 . 5.970 4.780 4.695 4.894 . 0 0 "[ . 1 . 2]" 1
965 1 59 THR HB 1 63 THR MG 6.610 . 7.110 5.262 4.990 5.457 . 0 0 "[ . 1 . 2]" 1
966 1 118 GLU QG 1 119 LEU H 5.340 . 5.710 4.148 2.329 4.360 . 0 0 "[ . 1 . 2]" 1
967 1 117 ARG HA 1 118 GLU QG 6.170 . 6.670 4.370 3.946 4.602 . 0 0 "[ . 1 . 2]" 1
968 1 113 VAL H 1 118 GLU QG 6.170 . 6.670 4.295 3.193 4.599 . 0 0 "[ . 1 . 2]" 1
969 1 113 VAL HB 1 118 GLU QG 4.060 . 4.560 3.519 1.787 4.007 0.013 17 0 "[ . 1 . 2]" 1
970 1 118 GLU QG 1 119 LEU QD 8.320 . 8.600 3.550 1.762 4.251 0.038 11 0 "[ . 1 . 2]" 1
971 1 113 VAL HA 1 118 GLU QG . . 5.370 1.962 1.717 3.074 0.083 11 0 "[ . 1 . 2]" 1
972 1 118 GLU H 1 118 GLU QG 4.400 . 4.900 3.385 1.927 3.749 . 0 0 "[ . 1 . 2]" 1
973 1 44 VAL H 1 45 GLU QG 4.430 . 4.930 3.923 3.707 3.978 . 0 0 "[ . 1 . 2]" 1
974 1 45 GLU H 1 45 GLU QG 3.200 . 3.700 2.026 1.834 2.537 . 0 0 "[ . 1 . 2]" 1
975 1 43 ASP HA 1 45 GLU QG 4.980 . 5.480 3.283 2.560 4.445 . 0 0 "[ . 1 . 2]" 1
976 1 44 VAL QG 1 45 GLU QG 6.110 . 6.610 3.280 2.182 4.021 . 0 0 "[ . 1 . 2]" 1
977 1 45 GLU QG 1 47 MET H 6.170 . 6.670 5.230 4.152 5.604 . 0 0 "[ . 1 . 2]" 1
978 1 87 GLU QG 1 88 SER H 4.510 . 4.980 3.409 2.835 4.073 . 0 0 "[ . 1 . 2]" 1
979 1 85 THR HA 1 87 GLU QG 5.960 . 6.460 4.437 3.486 5.049 . 0 0 "[ . 1 . 2]" 1
980 1 86 LYS HA 1 87 GLU QG 6.170 . 6.670 4.598 4.267 5.017 . 0 0 "[ . 1 . 2]" 1
981 1 87 GLU QG 1 88 SER QB 6.930 . 7.110 4.504 3.015 5.342 . 0 0 "[ . 1 . 2]" 1
982 1 74 VAL QG 1 77 VAL HB 7.320 . 7.820 3.106 2.282 4.750 . 0 0 "[ . 1 . 2]" 1
983 1 61 PRO HA 1 77 VAL HB 5.500 . 6.000 5.127 3.083 5.614 . 0 0 "[ . 1 . 2]" 1
984 1 64 LEU HB3 1 77 VAL HB 4.580 . 5.080 4.182 3.397 4.721 . 0 0 "[ . 1 . 2]" 1
985 1 63 THR HA 1 66 ARG QG 4.930 . 5.430 2.446 1.964 3.908 . 0 0 "[ . 1 . 2]" 1
986 1 63 THR HA 1 64 LEU QD 7.360 . 7.860 4.997 4.779 5.152 . 0 0 "[ . 1 . 2]" 1
987 1 62 ASP QB 1 63 THR HA 4.680 . 5.180 4.117 4.001 4.182 . 0 0 "[ . 1 . 2]" 1
988 1 77 VAL HB 1 94 VAL HB 4.800 . 5.300 3.825 2.037 4.991 . 0 0 "[ . 1 . 2]" 1
989 1 52 VAL HB 1 94 VAL HB 5.500 . 6.000 4.021 1.989 5.602 . 0 0 "[ . 1 . 2]" 1
990 1 64 LEU HB3 1 94 VAL HB 5.500 . 6.000 4.741 4.260 5.323 . 0 0 "[ . 1 . 2]" 1
991 1 77 VAL QG 1 94 VAL HB . . 6.650 3.398 1.911 4.531 . 0 0 "[ . 1 . 2]" 1
992 1 52 VAL QG 1 94 VAL HB 5.770 . 6.270 3.168 1.772 4.312 0.028 1 0 "[ . 1 . 2]" 1
993 1 61 PRO HA 1 64 LEU H 4.590 . 5.090 3.150 3.036 3.206 . 0 0 "[ . 1 . 2]" 1
994 1 61 PRO HA 1 64 LEU QD 5.700 . 6.200 3.843 3.623 4.006 . 0 0 "[ . 1 . 2]" 1
995 1 52 VAL HB 1 94 VAL QG 7.200 . 7.700 2.699 1.794 4.499 0.006 9 0 "[ . 1 . 2]" 1
996 1 67 VAL HA 1 70 LYS H 4.770 . 5.270 4.345 4.194 4.448 . 0 0 "[ . 1 . 2]" 1
997 1 67 VAL HA 1 69 GLU H 4.300 . 4.800 4.318 4.262 4.349 . 0 0 "[ . 1 . 2]" 1
998 1 48 THR HA 1 99 LYS HB2 4.870 . 5.370 4.792 4.550 4.958 . 0 0 "[ . 1 . 2]" 1
999 1 50 LEU QD 1 106 MET HB2 . . 6.080 3.113 2.346 3.882 . 0 0 "[ . 1 . 2]" 1
1000 1 74 VAL HB 1 77 VAL QG 6.710 . 7.210 3.830 2.932 4.487 . 0 0 "[ . 1 . 2]" 1
1001 1 99 LYS HB2 1 100 ARG H 4.210 . 4.710 3.936 3.813 4.041 . 0 0 "[ . 1 . 2]" 1
1002 1 98 ASP HA 1 99 LYS HB2 4.790 . 5.290 4.653 4.427 4.789 . 0 0 "[ . 1 . 2]" 1
1003 1 106 MET ME 1 123 MET HG2 3.340 . 3.840 2.365 2.081 2.699 . 0 0 "[ . 1 . 2]" 1
1004 1 55 LEU QD 1 60 SER QB 8.110 . 8.610 4.404 4.185 4.542 . 0 0 "[ . 1 . 2]" 1
1005 1 59 THR HA 1 63 THR HB 4.300 . 4.800 3.816 3.609 3.952 . 0 0 "[ . 1 . 2]" 1
1006 1 135 SER H 1 135 SER QB 3.560 . 4.060 2.782 2.198 3.217 . 0 0 "[ . 1 . 2]" 1
1007 1 60 SER QB 1 63 THR H 5.170 . 5.670 3.580 2.811 3.808 . 0 0 "[ . 1 . 2]" 1
1008 1 60 SER QB 1 62 ASP H 5.010 . 5.450 2.954 2.739 3.153 . 0 0 "[ . 1 . 2]" 1
1009 1 60 SER QB 1 61 PRO HG3 5.850 . 5.980 4.449 4.385 4.504 . 0 0 "[ . 1 . 2]" 1
1010 1 106 MET ME 1 123 MET HG3 4.310 . 4.810 3.253 2.934 3.563 . 0 0 "[ . 1 . 2]" 1
1011 1 50 LEU QD 1 123 MET HG2 5.280 . 5.780 2.529 2.210 2.870 . 0 0 "[ . 1 . 2]" 1
1012 1 123 MET HA 1 123 MET HG2 4.030 . 4.530 2.673 2.552 2.787 . 0 0 "[ . 1 . 2]" 1
1013 1 120 ARG H 1 120 ARG HB2 4.140 . 4.640 2.827 2.588 2.905 . 0 0 "[ . 1 . 2]" 1
1014 1 60 SER QB 1 79 ILE MD 6.740 . 7.050 4.282 4.068 4.656 . 0 0 "[ . 1 . 2]" 1
1015 1 53 ASP H 1 120 ARG HB2 4.400 . 4.900 3.678 3.365 3.979 . 0 0 "[ . 1 . 2]" 1
1016 1 120 ARG HB2 1 121 VAL H 4.650 . 5.150 4.492 4.309 4.561 . 0 0 "[ . 1 . 2]" 1
1017 1 120 ARG H 1 120 ARG HB3 4.180 . 4.680 3.828 3.701 3.884 . 0 0 "[ . 1 . 2]" 1
1018 1 120 ARG HB3 1 121 VAL H 4.390 . 4.890 3.675 3.320 3.912 . 0 0 "[ . 1 . 2]" 1
1019 1 53 ASP H 1 120 ARG HB3 4.820 . 5.320 4.431 3.823 4.754 . 0 0 "[ . 1 . 2]" 1
1020 1 44 VAL HB 1 47 MET H 5.500 . 6.000 5.090 4.861 5.389 . 0 0 "[ . 1 . 2]" 1
1021 1 64 LEU H 1 67 VAL HB 5.500 . 6.000 4.770 4.710 4.850 . 0 0 "[ . 1 . 2]" 1
1022 1 64 LEU HA 1 67 VAL HB 4.250 . 4.750 2.564 2.468 2.624 . 0 0 "[ . 1 . 2]" 1
1023 1 67 VAL HB 1 68 PHE QD 4.100 . 4.600 2.712 2.635 2.801 . 0 0 "[ . 1 . 2]" 1
1024 1 36 SER QB 1 37 TYR QB 5.860 . 6.360 3.929 3.473 4.511 . 0 0 "[ . 1 . 2]" 1
1025 1 132 SER QB 1 133 HIS H 5.630 . 5.970 3.388 2.517 4.077 . 0 0 "[ . 1 . 2]" 1
1026 1 36 SER QB 1 37 TYR QD 4.810 . 5.310 3.163 2.136 3.872 . 0 0 "[ . 1 . 2]" 1
1027 1 36 SER H 1 36 SER QB 3.450 . 3.950 2.831 2.464 3.229 . 0 0 "[ . 1 . 2]" 1
1028 1 36 SER QB 1 37 TYR QE 6.610 . 7.110 4.535 2.769 5.268 . 0 0 "[ . 1 . 2]" 1
1029 1 129 PRO HA 1 130 PRO QB 5.290 . 5.790 4.617 4.489 4.733 . 0 0 "[ . 1 . 2]" 1
1030 1 42 PRO QB 1 44 VAL H 5.230 . 5.730 2.534 2.098 3.749 . 0 0 "[ . 1 . 2]" 1
1031 1 70 LYS HB3 1 70 LYS QE 4.500 . 5.000 3.878 1.957 4.005 . 0 0 "[ . 1 . 2]" 1
1032 1 70 LYS HB2 1 70 LYS QE 4.870 . 5.370 4.012 2.992 4.228 . 0 0 "[ . 1 . 2]" 1
1033 1 70 LYS HB2 1 71 TYR H 3.990 . 4.490 4.066 4.047 4.089 . 0 0 "[ . 1 . 2]" 1
1034 1 70 LYS H 1 70 LYS HB2 3.700 . 4.200 3.598 3.579 3.612 . 0 0 "[ . 1 . 2]" 1
1035 1 44 VAL HB 1 45 GLU H 4.590 . 5.090 4.262 4.145 4.486 . 0 0 "[ . 1 . 2]" 1
1036 1 70 LYS HB3 1 71 TYR H 4.120 . 4.620 4.135 4.089 4.159 . 0 0 "[ . 1 . 2]" 1
1037 1 50 LEU QD 1 123 MET QB 6.350 . 6.850 3.679 3.476 3.950 . 0 0 "[ . 1 . 2]" 1
1038 1 70 LYS HB2 1 71 TYR QD 6.070 . 6.570 4.997 4.851 5.110 . 0 0 "[ . 1 . 2]" 1
1039 1 68 PHE HA 1 70 LYS QE 5.140 . 5.640 4.113 4.001 4.395 . 0 0 "[ . 1 . 2]" 1
1040 1 68 PHE HA 1 96 PHE HZ 4.760 . 5.260 3.254 3.081 3.407 . 0 0 "[ . 1 . 2]" 1
1041 1 129 PRO HA 1 130 PRO HA 4.560 . 5.060 4.528 4.454 4.583 . 0 0 "[ . 1 . 2]" 1
1042 1 130 PRO HA 1 131 ASP HA 4.900 . 5.400 4.690 4.539 4.881 . 0 0 "[ . 1 . 2]" 1
1043 1 50 LEU QD 1 106 MET QG 7.230 . 7.730 3.894 3.746 4.138 . 0 0 "[ . 1 . 2]" 1
1044 1 68 PHE HA 1 71 TYR HB2 4.710 . 5.210 3.867 3.781 4.049 . 0 0 "[ . 1 . 2]" 1
1045 1 129 PRO QB 1 130 PRO HA 5.330 . 5.830 4.640 4.526 4.800 . 0 0 "[ . 1 . 2]" 1
1046 1 42 PRO HA 1 44 VAL H 4.950 . 5.450 4.419 4.150 4.653 . 0 0 "[ . 1 . 2]" 1
1047 1 106 MET QG 1 121 VAL QG 6.340 . 6.840 3.372 2.482 4.011 . 0 0 "[ . 1 . 2]" 1
1048 1 42 PRO HA 1 43 ASP QB 5.630 . 6.130 4.214 3.917 4.948 . 0 0 "[ . 1 . 2]" 1
1049 1 42 PRO HA 1 44 VAL QG 7.410 . 7.910 4.181 3.794 4.888 . 0 0 "[ . 1 . 2]" 1
1050 1 42 PRO HA 1 43 ASP H 2.860 . 3.360 2.732 2.596 2.823 . 0 0 "[ . 1 . 2]" 1
1051 1 67 VAL QG 1 68 PHE HA . . 5.560 3.508 3.442 3.550 . 0 0 "[ . 1 . 2]" 1
1052 1 68 PHE HA 1 70 LYS QG 5.520 . 6.020 3.435 3.246 3.508 . 0 0 "[ . 1 . 2]" 1
1053 1 73 ARG QB 1 74 VAL H 4.660 . 5.160 2.347 2.227 2.483 . 0 0 "[ . 1 . 2]" 1
1054 1 82 ASP QB 1 85 THR HA 6.170 . 6.670 4.526 4.126 4.806 . 0 0 "[ . 1 . 2]" 1
1055 1 85 THR HA 1 86 LYS QE 6.170 . 6.670 4.285 3.596 5.382 . 0 0 "[ . 1 . 2]" 1
1056 1 66 ARG H 1 66 ARG QB 3.370 . 3.870 2.321 1.863 2.550 . 0 0 "[ . 1 . 2]" 1
1057 1 66 ARG QB 1 67 VAL QG 7.020 . 7.520 3.921 3.486 4.034 . 0 0 "[ . 1 . 2]" 1
1058 1 84 TYR HB2 1 85 THR HA 4.860 . 5.360 4.769 4.434 4.882 . 0 0 "[ . 1 . 2]" 1
1059 1 74 VAL HA 1 75 GLY QA 5.230 . 5.700 3.929 3.908 3.948 . 0 0 "[ . 1 . 2]" 1
1060 1 85 THR HA 1 85 THR HB 2.690 . 3.190 2.359 2.277 2.428 . 0 0 "[ . 1 . 2]" 1
1061 1 74 VAL HA 1 97 HIS H 5.500 . 6.000 4.068 3.426 4.645 . 0 0 "[ . 1 . 2]" 1
1062 1 62 ASP QB 1 66 ARG QB 6.930 . 7.430 5.523 5.262 5.620 . 0 0 "[ . 1 . 2]" 1
1063 1 113 VAL HA 1 118 GLU QB 4.620 . 5.120 1.997 1.834 3.069 . 0 0 "[ . 1 . 2]" 1
1064 1 42 PRO QG 1 44 VAL HA 5.980 . 6.480 4.955 4.139 5.226 . 0 0 "[ . 1 . 2]" 1
1065 1 85 THR HA 1 87 GLU QB 6.170 . 6.670 5.137 4.513 5.600 . 0 0 "[ . 1 . 2]" 1
1066 1 97 HIS HB3 1 98 ASP H 4.250 . 4.750 4.280 3.957 4.374 . 0 0 "[ . 1 . 2]" 1
1067 1 114 LEU QD 1 118 GLU QB 7.250 . 7.750 3.645 2.862 4.326 . 0 0 "[ . 1 . 2]" 1
1068 1 117 ARG HA 1 118 GLU QB 5.250 . 5.750 4.499 4.213 4.774 . 0 0 "[ . 1 . 2]" 1
1069 1 129 PRO HA 1 130 PRO QD 3.420 . 3.870 1.998 1.954 2.054 . 0 0 "[ . 1 . 2]" 1
1070 1 52 VAL QG 1 94 VAL HA 7.000 . 7.500 4.560 3.705 5.066 . 0 0 "[ . 1 . 2]" 1
1071 1 43 ASP HA 1 44 VAL HA 4.900 . 5.400 4.823 4.755 4.885 . 0 0 "[ . 1 . 2]" 1
1072 1 133 HIS QB 1 133 HIS HD2 3.460 . 3.730 2.612 2.507 2.892 . 0 0 "[ . 1 . 2]" 1
1073 1 52 VAL HB 1 121 VAL HA 5.330 . 5.830 4.663 3.225 5.334 . 0 0 "[ . 1 . 2]" 1
1074 1 41 PRO HA 1 44 VAL QG 7.410 . 7.910 5.381 2.808 5.553 . 0 0 "[ . 1 . 2]" 1
1075 1 40 PRO HA 1 41 PRO QD 4.460 . 4.700 2.064 1.947 2.124 . 0 0 "[ . 1 . 2]" 1
1076 1 65 ARG HA 1 68 PHE H 4.330 . 4.830 3.595 3.495 3.788 . 0 0 "[ . 1 . 2]" 1
1077 1 44 VAL QG 1 45 GLU QB 6.930 . 7.430 3.763 3.286 4.448 . 0 0 "[ . 1 . 2]" 1
1078 1 100 ARG HA 1 103 GLU QB 4.970 . 5.470 4.331 4.185 4.466 . 0 0 "[ . 1 . 2]" 1
1079 1 55 LEU H 1 56 THR HA 5.440 . 5.940 5.511 4.930 5.579 . 0 0 "[ . 1 . 2]" 1
1080 1 65 ARG HA 1 67 VAL H 4.510 . 5.010 4.054 3.868 4.275 . 0 0 "[ . 1 . 2]" 1
1081 1 65 ARG HA 1 74 VAL QG 5.370 . 5.650 3.000 2.645 3.302 . 0 0 "[ . 1 . 2]" 1
1082 1 65 ARG HA 1 94 VAL QG 6.500 . 7.000 3.874 3.410 4.238 . 0 0 "[ . 1 . 2]" 1
1083 1 52 VAL HA 1 120 ARG H 5.480 . 5.980 4.612 4.370 5.096 . 0 0 "[ . 1 . 2]" 1
1084 1 64 LEU H 1 65 ARG HA 5.500 . 6.000 5.343 5.301 5.377 . 0 0 "[ . 1 . 2]" 1
1085 1 70 LYS H 1 70 LYS QD 4.940 . 5.440 3.700 3.603 4.004 . 0 0 "[ . 1 . 2]" 1
1086 1 70 LYS HB2 1 70 LYS QD 3.720 . 4.220 2.401 2.368 2.542 . 0 0 "[ . 1 . 2]" 1
1087 1 67 VAL QG 1 70 LYS QD 7.040 . 7.540 3.900 3.649 4.123 . 0 0 "[ . 1 . 2]" 1
1088 1 86 LYS HA 1 86 LYS QD 4.460 . 4.960 3.811 3.685 3.957 . 0 0 "[ . 1 . 2]" 1
1089 1 69 GLU HB3 1 70 LYS HA 4.780 . 5.280 4.407 4.346 4.460 . 0 0 "[ . 1 . 2]" 1
1090 1 99 LYS HA 1 101 ASP H 4.640 . 5.140 4.352 4.165 4.653 . 0 0 "[ . 1 . 2]" 1
1091 1 99 LYS HA 1 99 LYS QD 4.620 . 5.120 2.409 2.263 2.703 . 0 0 "[ . 1 . 2]" 1
1092 1 99 LYS HA 1 103 GLU H 4.740 . 5.240 3.964 3.726 4.318 . 0 0 "[ . 1 . 2]" 1
1093 1 103 GLU HA 1 106 MET QG 4.310 . 4.810 3.122 2.274 3.890 . 0 0 "[ . 1 . 2]" 1
1094 1 65 ARG QG 1 77 VAL QG 5.730 . 6.230 2.858 1.964 3.515 . 0 0 "[ . 1 . 2]" 1
1095 1 49 SER H 1 97 HIS HA 4.680 . 5.180 3.338 2.485 4.683 . 0 0 "[ . 1 . 2]" 1
1096 1 103 GLU HA 1 104 ASP HA 5.150 . 5.650 4.718 4.674 4.749 . 0 0 "[ . 1 . 2]" 1
1097 1 102 ALA HA 1 103 GLU HA 4.800 . 5.300 4.703 4.664 4.731 . 0 0 "[ . 1 . 2]" 1
1098 1 103 GLU HA 1 107 ASP H 4.800 . 5.300 3.945 3.814 4.106 . 0 0 "[ . 1 . 2]" 1
1099 1 106 MET HA 1 121 VAL QG 4.480 . 4.980 2.125 1.806 2.581 . 0 0 "[ . 1 . 2]" 1
1100 1 48 THR H 1 97 HIS HA 4.510 . 5.010 2.876 2.336 3.317 . 0 0 "[ . 1 . 2]" 1
1101 1 130 PRO QG 1 131 ASP HA 5.290 . 5.790 4.511 4.348 4.671 . 0 0 "[ . 1 . 2]" 1
1102 1 129 PRO HA 1 130 PRO QG 4.680 . 5.180 3.938 3.889 3.995 . 0 0 "[ . 1 . 2]" 1
1103 1 56 THR MG 1 57 TYR HA 6.050 . 6.550 4.192 4.088 4.814 . 0 0 "[ . 1 . 2]" 1
1104 1 57 TYR HA 1 57 TYR QD 4.270 . 4.770 3.751 3.738 3.763 . 0 0 "[ . 1 . 2]" 1
1105 1 120 ARG HB2 1 120 ARG HG3 2.630 . 3.130 2.459 2.412 2.509 . 0 0 "[ . 1 . 2]" 1
1106 1 55 LEU QD 1 64 LEU QD 5.580 . 6.080 1.801 1.737 1.856 0.063 3 0 "[ . 1 . 2]" 1
1107 1 55 LEU QD 1 94 VAL QG 9.160 . 9.660 3.547 3.345 3.686 . 0 0 "[ . 1 . 2]" 1
1108 1 57 TYR HA 1 59 THR H 4.220 . 4.720 3.941 3.754 4.103 . 0 0 "[ . 1 . 2]" 1
1109 1 70 LYS QG 1 71 TYR HA 4.780 . 5.280 3.445 3.378 3.489 . 0 0 "[ . 1 . 2]" 1
1110 1 70 LYS H 1 71 TYR HA 5.240 . 5.740 5.250 5.239 5.258 . 0 0 "[ . 1 . 2]" 1
1111 1 118 GLU H 1 120 ARG HG2 5.430 . 5.930 4.768 4.435 5.500 . 0 0 "[ . 1 . 2]" 1
1112 1 54 ASN HD21 1 120 ARG HG2 4.790 . 5.290 2.571 2.143 2.970 . 0 0 "[ . 1 . 2]" 1
1113 1 71 TYR HA 1 71 TYR QD 3.790 . 4.290 3.012 2.862 3.085 . 0 0 "[ . 1 . 2]" 1
1114 1 100 ARG HA 1 100 ARG QD 4.490 . 4.990 3.873 3.828 3.936 . 0 0 "[ . 1 . 2]" 1
1115 1 119 LEU QD 1 120 ARG HG2 7.410 . 7.910 5.358 5.214 5.507 . 0 0 "[ . 1 . 2]" 1
1116 1 50 LEU QD 1 68 PHE QE 6.290 . 6.790 3.783 3.335 4.073 . 0 0 "[ . 1 . 2]" 1
1117 1 50 LEU QD 1 121 VAL HB 6.500 . 7.000 3.904 3.669 4.121 . 0 0 "[ . 1 . 2]" 1
1118 1 131 ASP QB 1 132 SER HA 5.470 . 5.970 4.617 4.049 4.919 . 0 0 "[ . 1 . 2]" 1
1119 1 44 VAL QG 1 45 GLU HA 4.950 . 5.450 3.410 3.220 3.684 . 0 0 "[ . 1 . 2]" 1
1120 1 92 ALA MB 1 93 PHE QB 7.330 . 7.830 4.777 4.713 4.844 . 0 0 "[ . 1 . 2]" 1
1121 1 36 SER HA 1 37 TYR QD 4.210 . 4.710 3.569 2.498 3.820 . 0 0 "[ . 1 . 2]" 1
1122 1 131 ASP H 1 132 SER HA 5.140 . 5.640 4.683 3.965 4.940 . 0 0 "[ . 1 . 2]" 1
1123 1 69 GLU H 1 70 LYS HA 5.150 . 5.650 5.136 5.095 5.169 . 0 0 "[ . 1 . 2]" 1
1124 1 70 LYS HA 1 71 TYR QD 6.040 . 6.540 5.132 5.038 5.249 . 0 0 "[ . 1 . 2]" 1
1125 1 70 LYS HA 1 72 GLY H 4.200 . 4.700 3.800 3.703 4.051 . 0 0 "[ . 1 . 2]" 1
1126 1 70 LYS HA 1 70 LYS HB2 2.980 . 3.480 2.422 2.399 2.447 . 0 0 "[ . 1 . 2]" 1
1127 1 80 PRO QD 1 92 ALA MB 6.930 . 7.290 4.518 4.062 4.835 . 0 0 "[ . 1 . 2]" 1
1128 1 45 GLU HA 1 47 MET H 4.920 . 5.420 4.649 4.121 4.952 . 0 0 "[ . 1 . 2]" 1
1129 1 70 LYS HA 1 71 TYR HA 4.950 . 5.450 4.768 4.750 4.784 . 0 0 "[ . 1 . 2]" 1
1130 1 69 GLU HA 1 71 TYR H 4.350 . 4.850 3.951 3.911 4.020 . 0 0 "[ . 1 . 2]" 1
1131 1 69 GLU HA 1 70 LYS HA 4.910 . 5.410 4.792 4.781 4.819 . 0 0 "[ . 1 . 2]" 1
1132 1 69 GLU HA 1 74 VAL HB 4.780 . 5.280 4.248 3.616 4.505 . 0 0 "[ . 1 . 2]" 1
1133 1 62 ASP HA 1 64 LEU H 5.160 . 5.660 4.597 4.512 4.674 . 0 0 "[ . 1 . 2]" 1
1134 1 110 ASP HA 1 120 ARG H 5.440 . 5.940 4.456 4.328 4.585 . 0 0 "[ . 1 . 2]" 1
1135 1 73 ARG HA 1 74 VAL QG 5.320 . 5.820 3.186 3.036 3.435 . 0 0 "[ . 1 . 2]" 1
1136 1 64 LEU HA 1 94 VAL QG 6.420 . 6.920 4.210 4.001 4.512 . 0 0 "[ . 1 . 2]" 1
1137 1 73 ARG HA 1 74 VAL HA 4.730 . 5.230 4.476 4.445 4.550 . 0 0 "[ . 1 . 2]" 1
1138 1 106 MET HA 1 110 ASP HA 5.110 . 5.610 4.781 4.456 4.983 . 0 0 "[ . 1 . 2]" 1
1139 1 63 THR MG 1 64 LEU HA 4.530 . 5.030 3.468 3.408 3.530 . 0 0 "[ . 1 . 2]" 1
1140 1 64 LEU HA 1 64 LEU HG 3.950 . 4.450 3.609 3.590 3.624 . 0 0 "[ . 1 . 2]" 1
1141 1 109 MET QG 1 119 LEU QD 5.630 . 6.130 2.249 1.903 2.487 . 0 0 "[ . 1 . 2]" 1
1142 1 104 ASP HA 1 106 MET H 4.230 . 4.730 4.255 4.196 4.303 . 0 0 "[ . 1 . 2]" 1
1143 1 82 ASP HA 1 86 LYS HA 5.460 . 5.960 5.516 5.144 5.628 . 0 0 "[ . 1 . 2]" 1
1144 1 113 VAL HA 1 119 LEU QD 5.180 . 5.680 3.737 1.993 4.036 . 0 0 "[ . 1 . 2]" 1
1145 1 47 MET ME 1 96 PHE HA 5.700 . 6.200 4.598 4.058 4.846 . 0 0 "[ . 1 . 2]" 1
1146 1 96 PHE HA 1 102 ALA MB 5.780 . 6.280 4.865 4.782 4.916 . 0 0 "[ . 1 . 2]" 1
1147 1 104 ASP HA 1 107 ASP H 4.000 . 4.500 3.323 3.147 3.504 . 0 0 "[ . 1 . 2]" 1
1148 1 104 ASP HA 1 107 ASP QB 3.960 . 4.460 2.571 2.408 2.683 . 0 0 "[ . 1 . 2]" 1
1149 1 101 ASP HA 1 104 ASP QB 4.250 . 4.750 2.520 2.135 2.914 . 0 0 "[ . 1 . 2]" 1
1150 1 104 ASP HA 1 105 ALA MB 6.180 . 6.680 5.050 5.029 5.073 . 0 0 "[ . 1 . 2]" 1
1151 1 101 ASP HA 1 105 ALA MB 5.600 . 6.100 4.499 4.061 4.671 . 0 0 "[ . 1 . 2]" 1
1152 1 101 ASP HA 1 104 ASP H 3.880 . 4.380 3.288 2.642 3.675 . 0 0 "[ . 1 . 2]" 1
1153 1 71 TYR QD 1 101 ASP HA 5.970 . 6.470 4.985 4.620 5.255 . 0 0 "[ . 1 . 2]" 1
1154 1 107 ASP HA 1 108 ALA MB 5.990 . 6.490 4.709 4.690 4.731 . 0 0 "[ . 1 . 2]" 1
1155 1 100 ARG H 1 101 ASP HA 5.480 . 5.980 5.397 5.309 5.470 . 0 0 "[ . 1 . 2]" 1
1156 1 96 PHE QE 1 121 VAL QG 7.050 . 7.550 4.293 3.885 4.658 . 0 0 "[ . 1 . 2]" 1
1157 1 106 MET H 1 107 ASP HA 5.280 . 5.780 5.144 5.100 5.191 . 0 0 "[ . 1 . 2]" 1
1158 1 106 MET HB3 1 121 VAL QG 5.230 . 5.730 2.906 2.197 3.725 . 0 0 "[ . 1 . 2]" 1
1159 1 121 VAL QG 1 122 GLN H 5.000 . 5.500 2.578 2.384 2.920 . 0 0 "[ . 1 . 2]" 1
1160 1 106 MET HB2 1 121 VAL QG 5.100 . 5.600 2.347 2.024 2.766 . 0 0 "[ . 1 . 2]" 1
1161 1 92 ALA MB 1 93 PHE HA 5.810 . 6.310 4.562 4.459 4.611 . 0 0 "[ . 1 . 2]" 1
1162 1 52 VAL QG 1 93 PHE HA 7.410 . 7.910 4.258 3.330 4.710 . 0 0 "[ . 1 . 2]" 1
1163 1 64 LEU QD 1 93 PHE HA 7.410 . 7.910 5.511 5.418 5.573 . 0 0 "[ . 1 . 2]" 1
1164 1 68 PHE QE 1 121 VAL QG . . 5.570 2.222 2.095 2.387 . 0 0 "[ . 1 . 2]" 1
1165 1 94 VAL QG 1 121 VAL QG 9.090 . 9.590 4.157 3.546 4.750 . 0 0 "[ . 1 . 2]" 1
1166 1 89 ARG HA 1 91 PHE H 5.310 . 5.810 3.827 2.880 5.051 . 0 0 "[ . 1 . 2]" 1
1167 1 113 VAL HA 1 114 LEU QD . . 5.000 3.273 3.054 3.418 . 0 0 "[ . 1 . 2]" 1
1168 1 64 LEU QD 1 65 ARG H 5.880 . 6.380 4.088 4.036 4.128 . 0 0 "[ . 1 . 2]" 1
1169 1 64 LEU QD 1 94 VAL H 6.430 . 6.930 4.313 4.010 4.628 . 0 0 "[ . 1 . 2]" 1
1170 1 64 LEU QD 1 68 PHE QD 5.190 . 5.690 2.042 1.970 2.196 . 0 0 "[ . 1 . 2]" 1
1171 1 64 LEU H 1 64 LEU QD 4.740 . 5.240 2.821 2.568 3.037 . 0 0 "[ . 1 . 2]" 1
1172 1 64 LEU QD 1 68 PHE QE 4.920 . 5.420 2.348 2.259 2.419 . 0 0 "[ . 1 . 2]" 1
1173 1 64 LEU QD 1 67 VAL HB 6.190 . 6.690 3.172 3.028 3.269 . 0 0 "[ . 1 . 2]" 1
1174 1 64 LEU QD 1 92 ALA H 6.710 . 7.210 4.562 4.429 4.729 . 0 0 "[ . 1 . 2]" 1
1175 1 114 LEU QD 1 115 ASP QB . . 6.080 2.505 2.216 2.992 . 0 0 "[ . 1 . 2]" 1
1176 1 122 GLN QB 1 123 MET HA 5.370 . 5.870 4.519 4.249 4.783 . 0 0 "[ . 1 . 2]" 1
1177 1 102 ALA MB 1 123 MET HA 5.880 . 6.380 4.903 4.753 4.960 . 0 0 "[ . 1 . 2]" 1
1178 1 123 MET HA 1 123 MET HG3 4.090 . 4.590 3.688 3.661 3.722 . 0 0 "[ . 1 . 2]" 1
1179 1 60 SER HA 1 61 PRO HG2 4.810 . 5.310 4.780 4.707 4.835 . 0 0 "[ . 1 . 2]" 1
1180 1 60 SER HA 1 61 PRO HG3 4.870 . 5.370 4.749 4.687 4.820 . 0 0 "[ . 1 . 2]" 1
1181 1 119 LEU HA 1 120 ARG HB2 4.840 . 5.340 4.437 4.114 4.552 . 0 0 "[ . 1 . 2]" 1
1182 1 119 LEU HA 1 120 ARG HG2 4.460 . 4.960 4.449 3.970 4.548 . 0 0 "[ . 1 . 2]" 1
1183 1 86 LYS H 1 87 GLU HA 5.500 . 6.000 5.508 5.408 5.595 . 0 0 "[ . 1 . 2]" 1
1184 1 86 LYS HA 1 87 GLU HA 4.980 . 5.480 4.650 4.353 4.805 . 0 0 "[ . 1 . 2]" 1
1185 1 87 GLU HA 1 88 SER QB 6.170 . 6.670 4.625 3.719 5.332 . 0 0 "[ . 1 . 2]" 1
1186 1 50 LEU QD 1 51 LYS HA 7.410 . 7.910 3.868 2.994 4.383 . 0 0 "[ . 1 . 2]" 1
1187 1 60 SER HA 1 92 ALA MB 6.610 . 7.110 4.457 4.284 4.585 . 0 0 "[ . 1 . 2]" 1
1188 1 74 VAL HB 1 76 ASP HA 5.500 . 6.000 5.423 4.647 5.631 . 0 0 "[ . 1 . 2]" 1
1189 1 76 ASP HA 1 77 VAL HB 5.500 . 6.000 4.848 4.547 5.672 . 0 0 "[ . 1 . 2]" 1
1190 1 82 ASP HA 1 83 ARG H 3.060 . 3.560 2.486 2.056 3.178 . 0 0 "[ . 1 . 2]" 1
1191 1 82 ASP HA 1 85 THR MG 6.340 . 6.840 4.624 3.268 5.303 . 0 0 "[ . 1 . 2]" 1
1192 1 51 LYS HA 1 52 VAL QG . . 5.880 3.427 2.870 3.766 . 0 0 "[ . 1 . 2]" 1
1193 1 51 LYS HA 1 121 VAL QG 7.410 . 7.910 4.490 3.892 4.815 . 0 0 "[ . 1 . 2]" 1
1194 1 51 LYS HA 1 93 PHE QR 5.490 . 5.990 4.007 3.682 4.407 . 0 0 "[ . 1 . 2]" 1
1195 1 50 LEU QD 1 51 LYS H 4.800 . 5.300 2.325 1.745 2.710 0.055 19 0 "[ . 1 . 2]" 1
1196 1 50 LEU QD 1 123 MET H 5.300 . 5.800 3.175 2.770 3.605 . 0 0 "[ . 1 . 2]" 1
1197 1 50 LEU QD 1 106 MET HB3 5.450 . 5.950 3.027 2.487 3.635 . 0 0 "[ . 1 . 2]" 1
1198 1 50 LEU QD 1 102 ALA MB 5.340 . 5.840 2.223 1.831 2.794 . 0 0 "[ . 1 . 2]" 1
1199 1 50 LEU QD 1 124 ALA H 5.260 . 5.760 3.850 3.676 3.954 . 0 0 "[ . 1 . 2]" 1
1200 1 50 LEU QD 1 123 MET HA 4.350 . 4.850 2.209 2.011 2.550 . 0 0 "[ . 1 . 2]" 1
1201 1 50 LEU QD 1 102 ALA HA . . 5.820 2.292 1.889 3.127 . 0 0 "[ . 1 . 2]" 1
1202 1 50 LEU QD 1 123 MET HG3 5.810 . 6.310 3.854 3.638 4.165 . 0 0 "[ . 1 . 2]" 1
1203 1 50 LEU QD 1 51 LYS QB 8.220 . 8.720 4.141 3.308 4.696 . 0 0 "[ . 1 . 2]" 1
1204 1 114 LEU QD 1 115 ASP HA . . 5.870 3.932 3.714 4.025 . 0 0 "[ . 1 . 2]" 1
1205 1 56 THR H 1 56 THR MG 4.420 . 4.920 3.741 3.673 3.870 . 0 0 "[ . 1 . 2]" 1
1206 1 56 THR MG 1 117 ARG H 5.810 . 6.310 4.659 4.102 4.907 . 0 0 "[ . 1 . 2]" 1
1207 1 56 THR MG 1 117 ARG QD 4.570 . 5.070 2.834 2.143 3.402 . 0 0 "[ . 1 . 2]" 1
1208 1 56 THR MG 1 58 ARG QB 6.080 . 6.580 3.837 3.588 4.517 . 0 0 "[ . 1 . 2]" 1
1209 1 113 VAL QG 1 115 ASP HA 6.550 . 7.050 4.223 3.639 4.912 . 0 0 "[ . 1 . 2]" 1
1210 1 56 THR MG 1 58 ARG QG 5.680 . 6.180 2.580 2.205 3.040 . 0 0 "[ . 1 . 2]" 1
1211 1 52 VAL QG 1 53 ASP H 4.430 . 4.930 2.351 1.999 2.954 . 0 0 "[ . 1 . 2]" 1
1212 1 52 VAL QG 1 92 ALA H 6.190 . 6.690 4.311 3.915 4.568 . 0 0 "[ . 1 . 2]" 1
1213 1 52 VAL QG 1 68 PHE QE 5.220 . 5.340 2.514 2.320 2.894 . 0 0 "[ . 1 . 2]" 1
1214 1 52 VAL QG 1 68 PHE HZ 5.060 . 5.560 2.731 2.171 3.395 . 0 0 "[ . 1 . 2]" 1
1215 1 52 VAL QG 1 53 ASP HA 5.740 . 6.240 3.268 3.134 3.400 . 0 0 "[ . 1 . 2]" 1
1216 1 52 VAL QG 1 54 ASN HB2 7.410 . 7.910 4.982 4.481 5.525 . 0 0 "[ . 1 . 2]" 1
1217 1 52 VAL QG 1 91 PHE HB2 7.410 . 7.910 5.323 5.013 5.515 . 0 0 "[ . 1 . 2]" 1
1218 1 105 ALA HA 1 107 ASP H 5.500 . 6.000 4.499 4.454 4.546 . 0 0 "[ . 1 . 2]" 1
1219 1 68 PHE QE 1 119 LEU QD . . 7.340 2.330 1.984 3.420 . 0 0 "[ . 1 . 2]" 1
1220 1 118 GLU HA 1 119 LEU QD 4.790 . 5.290 3.437 2.448 3.697 . 0 0 "[ . 1 . 2]" 1
1221 1 130 PRO QB 1 131 ASP HA 5.260 . 5.760 4.689 4.496 4.755 . 0 0 "[ . 1 . 2]" 1
1222 1 102 ALA HA 1 104 ASP H 4.970 . 5.470 4.319 4.168 4.608 . 0 0 "[ . 1 . 2]" 1
1223 1 105 ALA HA 1 108 ALA H 4.080 . 4.580 3.604 3.564 3.641 . 0 0 "[ . 1 . 2]" 1
1224 1 105 ALA HA 1 109 MET QB 4.940 . 5.440 3.750 3.664 3.857 . 0 0 "[ . 1 . 2]" 1
1225 1 53 ASP H 1 121 VAL QG 5.620 . 6.120 3.809 3.050 4.239 . 0 0 "[ . 1 . 2]" 1
1226 1 120 ARG H 1 121 VAL QG 5.890 . 6.390 3.433 2.828 4.221 . 0 0 "[ . 1 . 2]" 1
1227 1 68 PHE HZ 1 121 VAL QG 5.000 . 5.500 2.723 2.243 3.078 . 0 0 "[ . 1 . 2]" 1
1228 1 52 VAL HA 1 121 VAL QG 4.960 . 5.460 2.777 2.330 3.132 . 0 0 "[ . 1 . 2]" 1
1229 1 52 VAL QG 1 121 VAL QG 5.400 . 5.860 1.923 1.644 2.632 0.156 16 0 "[ . 1 . 2]" 1
1230 1 69 GLU HA 1 74 VAL QG . . 4.760 2.219 2.100 2.306 . 0 0 "[ . 1 . 2]" 1
1231 1 74 VAL QG 1 76 ASP H 4.480 . 4.980 2.108 1.824 2.390 . 0 0 "[ . 1 . 2]" 1
1232 1 74 VAL QG 1 94 VAL HA 5.530 . 6.030 3.865 3.612 4.102 . 0 0 "[ . 1 . 2]" 1
1233 1 65 ARG QD 1 74 VAL QG 6.350 . 6.420 2.492 2.171 2.938 . 0 0 "[ . 1 . 2]" 1
1234 1 65 ARG QG 1 74 VAL QG 6.700 . 7.200 3.760 2.525 4.326 . 0 0 "[ . 1 . 2]" 1
1235 1 74 VAL QG 1 95 ARG H 5.700 . 6.200 2.666 2.392 2.953 . 0 0 "[ . 1 . 2]" 1
1236 1 110 ASP HA 1 120 ARG HA 4.270 . 4.770 3.777 3.165 4.049 . 0 0 "[ . 1 . 2]" 1
1237 1 120 ARG HA 1 120 ARG HG3 3.930 . 4.430 3.689 3.643 3.747 . 0 0 "[ . 1 . 2]" 1
1238 1 120 ARG HA 1 120 ARG HG2 3.880 . 4.380 2.962 2.795 3.148 . 0 0 "[ . 1 . 2]" 1
1239 1 96 PHE QE 1 102 ALA HA 5.140 . 5.640 4.100 3.817 4.362 . 0 0 "[ . 1 . 2]" 1
1240 1 102 ALA HA 1 123 MET ME 6.100 . 6.600 4.413 4.201 4.701 . 0 0 "[ . 1 . 2]" 1
1241 1 63 THR MG 1 65 ARG H 5.680 . 6.180 4.571 4.539 4.612 . 0 0 "[ . 1 . 2]" 1
1242 1 52 VAL HB 1 121 VAL QG 5.970 . 6.470 3.560 1.971 4.413 . 0 0 "[ . 1 . 2]" 1
1243 1 109 MET H 1 121 VAL QG 6.620 . 7.120 4.054 3.637 4.532 . 0 0 "[ . 1 . 2]" 1
1244 1 120 ARG HA 1 121 VAL QG 5.390 . 5.890 3.517 3.348 3.848 . 0 0 "[ . 1 . 2]" 1
1245 1 110 ASP HA 1 121 VAL QG 4.560 . 5.060 2.745 2.306 2.956 . 0 0 "[ . 1 . 2]" 1
1246 1 110 ASP HB3 1 121 VAL QG 5.220 . 5.720 3.193 2.615 3.937 . 0 0 "[ . 1 . 2]" 1
1247 1 109 MET ME 1 121 VAL QG 7.330 . 7.830 3.991 3.500 4.211 . 0 0 "[ . 1 . 2]" 1
1248 1 65 ARG H 1 77 VAL QG 5.470 . 5.820 3.060 2.713 3.282 . 0 0 "[ . 1 . 2]" 1
1249 1 65 ARG HE 1 74 VAL QG 6.980 . 7.480 3.582 2.672 4.124 . 0 0 "[ . 1 . 2]" 1
1250 1 38 GLY QA 1 39 ARG HA 5.080 . 5.580 4.309 4.096 4.556 . 0 0 "[ . 1 . 2]" 1
1251 1 42 PRO QB 1 43 ASP HA 5.130 . 5.630 4.219 4.122 4.419 . 0 0 "[ . 1 . 2]" 1
1252 1 102 ALA HA 1 105 ALA H 4.630 . 5.130 3.672 3.479 4.006 . 0 0 "[ . 1 . 2]" 1
1253 1 60 SER H 1 63 THR MG 4.520 . 5.020 3.690 3.556 3.776 . 0 0 "[ . 1 . 2]" 1
1254 1 63 THR MG 1 67 VAL H 5.440 . 5.940 3.978 3.814 4.152 . 0 0 "[ . 1 . 2]" 1
1255 1 63 THR MG 1 64 LEU H 4.110 . 4.610 3.424 3.388 3.448 . 0 0 "[ . 1 . 2]" 1
1256 1 63 THR HA 1 63 THR MG 3.360 . 3.860 2.331 2.272 2.373 . 0 0 "[ . 1 . 2]" 1
1257 1 62 ASP QB 1 63 THR MG 7.060 . 7.560 5.185 5.100 5.253 . 0 0 "[ . 1 . 2]" 1
1258 1 63 THR MG 1 67 VAL HB 5.380 . 5.880 3.382 3.318 3.474 . 0 0 "[ . 1 . 2]" 1
1259 1 63 THR MG 1 64 LEU QD 5.600 . 6.100 3.258 3.048 3.447 . 0 0 "[ . 1 . 2]" 1
1260 1 48 THR MG 1 49 SER HA 5.720 . 6.220 4.344 3.535 4.468 . 0 0 "[ . 1 . 2]" 1
1261 1 77 VAL QG 1 78 TYR H 4.660 . 5.160 3.119 2.705 3.477 . 0 0 "[ . 1 . 2]" 1
1262 1 64 LEU H 1 77 VAL QG 5.860 . 6.360 3.990 3.653 4.268 . 0 0 "[ . 1 . 2]" 1
1263 1 77 VAL QG 1 78 TYR HA 6.190 . 6.690 3.508 3.022 4.120 . 0 0 "[ . 1 . 2]" 1
1264 1 61 PRO HA 1 77 VAL QG 4.210 . 4.710 2.779 2.444 3.252 . 0 0 "[ . 1 . 2]" 1
1265 1 64 LEU HB2 1 77 VAL QG 4.930 . 5.430 3.195 2.790 3.667 . 0 0 "[ . 1 . 2]" 1
1266 1 68 PHE HA 1 74 VAL QG 5.990 . 6.490 4.343 3.950 4.463 . 0 0 "[ . 1 . 2]" 1
1267 1 68 PHE H 1 74 VAL QG 5.540 . 6.040 3.990 3.607 4.139 . 0 0 "[ . 1 . 2]" 1
1268 1 69 GLU H 1 74 VAL QG 4.880 . 5.380 3.437 3.213 3.575 . 0 0 "[ . 1 . 2]" 1
1269 1 68 PHE HB2 1 74 VAL QG 5.840 . 6.340 3.037 2.536 3.211 . 0 0 "[ . 1 . 2]" 1
1270 1 117 ARG HA 1 118 GLU HA 4.470 . 4.970 4.415 4.353 4.501 . 0 0 "[ . 1 . 2]" 1
1271 1 48 THR MG 1 99 LYS HA 3.810 . 4.310 2.096 1.963 2.265 . 0 0 "[ . 1 . 2]" 1
1272 1 48 THR MG 1 99 LYS QE 4.740 . 5.240 2.025 1.910 2.168 . 0 0 "[ . 1 . 2]" 1
1273 1 65 ARG H 1 67 VAL QG 5.960 . 6.460 4.499 4.481 4.518 . 0 0 "[ . 1 . 2]" 1
1274 1 67 VAL QG 1 69 GLU H 6.710 . 7.210 4.531 4.504 4.549 . 0 0 "[ . 1 . 2]" 1
1275 1 67 VAL QG 1 68 PHE H . . 4.920 3.278 3.231 3.301 . 0 0 "[ . 1 . 2]" 1
1276 1 65 ARG HA 1 67 VAL QG 7.390 . 7.890 5.340 5.287 5.474 . 0 0 "[ . 1 . 2]" 1
1277 1 66 ARG QD 1 67 VAL QG 6.200 . 6.700 2.471 1.964 3.020 . 0 0 "[ . 1 . 2]" 1
1278 1 65 ARG HA 1 77 VAL QG . . 4.920 2.658 2.000 3.044 . 0 0 "[ . 1 . 2]" 1
1279 1 76 ASP HA 1 77 VAL QG 4.930 . 5.430 3.292 2.891 3.674 . 0 0 "[ . 1 . 2]" 1
1280 1 54 ASN HD21 1 117 ARG HA 4.370 . 4.870 3.386 2.794 3.982 . 0 0 "[ . 1 . 2]" 1
1281 1 39 ARG HA 1 40 PRO QD 3.240 . 3.740 2.408 2.036 2.931 . 0 0 "[ . 1 . 2]" 1
1282 1 43 ASP HA 1 45 GLU QB 4.980 . 5.480 4.337 4.021 4.477 . 0 0 "[ . 1 . 2]" 1
1283 1 107 ASP H 1 108 ALA HA 5.180 . 5.680 5.209 5.153 5.261 . 0 0 "[ . 1 . 2]" 1
1284 1 55 LEU HA 1 59 THR MG 5.010 . 5.510 3.461 3.231 3.674 . 0 0 "[ . 1 . 2]" 1
1285 1 59 THR HA 1 59 THR MG 3.410 . 3.910 2.214 2.167 2.250 . 0 0 "[ . 1 . 2]" 1
1286 1 63 THR MG 1 67 VAL QG 4.390 . 4.890 1.926 1.861 1.967 . 0 0 "[ . 1 . 2]" 1
1287 1 113 VAL QG 1 118 GLU QG 4.600 . 5.100 2.012 1.749 2.999 0.051 11 0 "[ . 1 . 2]" 1
1288 1 76 ASP H 1 77 VAL QG 6.280 . 6.780 4.102 3.420 4.632 . 0 0 "[ . 1 . 2]" 1
1289 1 39 ARG HA 1 39 ARG QD 4.500 . 5.000 4.147 3.743 4.252 . 0 0 "[ . 1 . 2]" 1
1290 1 54 ASN HA 1 55 LEU QD 5.620 . 6.120 4.016 3.639 4.087 . 0 0 "[ . 1 . 2]" 1
1291 1 59 THR MG 1 60 SER H 3.750 . 4.250 1.803 1.745 1.889 0.055 4 0 "[ . 1 . 2]" 1
1292 1 113 VAL QG 1 119 LEU H 4.580 . 5.080 2.500 1.794 3.565 0.006 10 0 "[ . 1 . 2]" 1
1293 1 113 VAL H 1 113 VAL QG 3.570 . 4.070 1.972 1.680 2.367 0.120 10 0 "[ . 1 . 2]" 1
1294 1 64 LEU HB3 1 77 VAL QG 3.550 . 4.050 2.373 1.999 2.697 . 0 0 "[ . 1 . 2]" 1
1295 1 113 VAL QG 1 116 GLY HA2 . . 5.110 3.148 2.437 3.441 . 0 0 "[ . 1 . 2]" 1
1296 1 122 GLN HA 1 123 MET HG3 4.810 . 5.310 4.991 4.969 5.021 . 0 0 "[ . 1 . 2]" 1
1297 1 106 MET ME 1 122 GLN HA 4.040 . 4.540 2.970 2.273 3.369 . 0 0 "[ . 1 . 2]" 1
1298 1 55 LEU HA 1 55 LEU HG 4.190 . 4.690 3.784 3.759 3.818 . 0 0 "[ . 1 . 2]" 1
1299 1 55 LEU HA 1 92 ALA MB 6.610 . 7.110 5.010 4.897 5.093 . 0 0 "[ . 1 . 2]" 1
1300 1 85 THR MG 1 87 GLU H 5.580 . 6.080 4.369 3.944 4.674 . 0 0 "[ . 1 . 2]" 1
1301 1 67 VAL QG 1 71 TYR QD 6.790 . 7.290 4.507 4.488 4.525 . 0 0 "[ . 1 . 2]" 1
1302 1 67 VAL QG 1 71 TYR QE 5.670 . 6.170 3.280 3.213 3.349 . 0 0 "[ . 1 . 2]" 1
1303 1 52 VAL QG 1 94 VAL H 6.340 . 6.840 3.108 1.829 3.805 . 0 0 "[ . 1 . 2]" 1
1304 1 52 VAL QG 1 122 GLN H 6.030 . 6.530 4.106 3.869 4.490 . 0 0 "[ . 1 . 2]" 1
1305 1 53 ASP HA 1 55 LEU H 4.910 . 5.410 3.820 3.617 4.964 . 0 0 "[ . 1 . 2]" 1
1306 1 85 THR H 1 85 THR MG 3.590 . 4.090 2.577 2.102 2.785 . 0 0 "[ . 1 . 2]" 1
1307 1 84 TYR H 1 85 THR MG 4.340 . 4.840 3.271 2.358 3.623 . 0 0 "[ . 1 . 2]" 1
1308 1 85 THR MG 1 86 LYS H 4.590 . 5.090 3.773 3.424 3.944 . 0 0 "[ . 1 . 2]" 1
1309 1 85 THR HA 1 85 THR MG 3.210 . 3.710 2.516 2.420 2.654 . 0 0 "[ . 1 . 2]" 1
1310 1 82 ASP QB 1 85 THR MG 5.590 . 6.090 2.708 2.200 3.643 . 0 0 "[ . 1 . 2]" 1
1311 1 85 THR MG 1 87 GLU QG 5.270 . 5.770 3.864 3.652 3.952 . 0 0 "[ . 1 . 2]" 1
1312 1 67 VAL QG 1 70 LYS H 7.000 . 7.500 4.904 4.807 4.976 . 0 0 "[ . 1 . 2]" 1
1313 1 53 ASP HA 1 91 PHE HA 4.210 . 4.710 3.549 3.209 3.908 . 0 0 "[ . 1 . 2]" 1
1314 1 54 ASN HA 1 117 ARG QG 6.170 . 6.670 4.605 3.113 5.545 . 0 0 "[ . 1 . 2]" 1
1315 1 52 VAL QG 1 121 VAL H 7.210 . 7.710 4.579 3.751 5.379 . 0 0 "[ . 1 . 2]" 1
1316 1 50 LEU HA 1 121 VAL QG 7.050 . 7.550 4.821 4.624 5.036 . 0 0 "[ . 1 . 2]" 1
1317 1 109 MET HA 1 112 ALA H 5.500 . 6.000 4.330 4.072 4.898 . 0 0 "[ . 1 . 2]" 1
1318 1 98 ASP HA 1 99 LYS HA 4.430 . 4.930 4.400 4.289 4.444 . 0 0 "[ . 1 . 2]" 1
1319 1 113 VAL QG 1 118 GLU HA . . 4.640 3.242 2.030 3.453 . 0 0 "[ . 1 . 2]" 1
1320 1 113 VAL QG 1 117 ARG QG 5.510 . 6.010 3.710 3.604 3.834 . 0 0 "[ . 1 . 2]" 1
1321 1 68 PHE QD 1 94 VAL QG 5.700 . 6.200 3.615 3.387 3.773 . 0 0 "[ . 1 . 2]" 1
1322 1 68 PHE HA 1 94 VAL QG 7.250 . 7.750 5.309 4.904 5.438 . 0 0 "[ . 1 . 2]" 1
1323 1 50 LEU HA 1 123 MET ME 5.250 . 5.750 4.067 3.939 4.200 . 0 0 "[ . 1 . 2]" 1
1324 1 48 THR MG 1 50 LEU HA 5.700 . 6.200 3.519 3.284 3.883 . 0 0 "[ . 1 . 2]" 1
1325 1 50 LEU HA 1 96 PHE H 4.780 . 5.280 4.293 3.871 4.463 . 0 0 "[ . 1 . 2]" 1
1326 1 93 PHE H 1 94 VAL QG 6.110 . 6.610 4.457 4.213 4.623 . 0 0 "[ . 1 . 2]" 1
1327 1 92 ALA H 1 94 VAL QG 7.240 . 7.740 4.524 4.303 4.721 . 0 0 "[ . 1 . 2]" 1
1328 1 94 VAL QG 1 95 ARG H 4.660 . 5.160 2.402 1.996 2.759 . 0 0 "[ . 1 . 2]" 1
1329 1 94 VAL QG 1 96 PHE QE 5.630 . 6.130 2.436 2.137 2.915 . 0 0 "[ . 1 . 2]" 1
1330 1 68 PHE HB3 1 94 VAL QG 5.140 . 5.640 3.422 2.933 3.635 . 0 0 "[ . 1 . 2]" 1
1331 1 77 VAL HB 1 94 VAL QG 5.340 . 5.840 2.554 1.892 3.996 . 0 0 "[ . 1 . 2]" 1
1332 1 123 MET HA 1 124 ALA HA 4.540 . 5.040 4.412 4.347 4.524 . 0 0 "[ . 1 . 2]" 1
1333 1 104 ASP QB 1 108 ALA MB 6.310 . 6.810 4.326 4.252 4.420 . 0 0 "[ . 1 . 2]" 1
1334 1 108 ALA MB 1 109 MET H 3.750 . 4.250 3.179 3.153 3.209 . 0 0 "[ . 1 . 2]" 1
1335 1 108 ALA H 1 108 ALA MB 3.280 . 3.780 2.437 2.406 2.472 . 0 0 "[ . 1 . 2]" 1
1336 1 71 TYR QD 1 108 ALA MB 4.920 . 5.420 3.402 3.199 3.585 . 0 0 "[ . 1 . 2]" 1
1337 1 104 ASP HA 1 108 ALA MB 4.650 . 5.150 3.878 3.858 3.894 . 0 0 "[ . 1 . 2]" 1
1338 1 105 ALA HA 1 108 ALA MB 3.780 . 4.280 2.677 2.625 2.735 . 0 0 "[ . 1 . 2]" 1
1339 1 108 ALA MB 1 109 MET QB 4.890 . 5.390 3.414 3.201 3.501 . 0 0 "[ . 1 . 2]" 1
1340 1 108 ALA MB 1 109 MET ME 6.690 . 7.190 4.367 4.194 4.655 . 0 0 "[ . 1 . 2]" 1
1341 1 105 ALA MB 1 108 ALA MB 6.040 . 6.540 4.110 4.064 4.154 . 0 0 "[ . 1 . 2]" 1
1342 1 106 MET HA 1 108 ALA MB 6.210 . 6.710 5.206 5.172 5.249 . 0 0 "[ . 1 . 2]" 1
1343 1 112 ALA MB 1 113 VAL HA 5.630 . 6.130 4.251 4.028 4.693 . 0 0 "[ . 1 . 2]" 1
1344 1 112 ALA MB 1 119 LEU QD 5.070 . 5.570 2.508 1.917 3.032 . 0 0 "[ . 1 . 2]" 1
1345 1 71 TYR QD 1 105 ALA MB 4.720 . 5.220 3.086 2.880 3.297 . 0 0 "[ . 1 . 2]" 1
1346 1 96 PHE QE 1 105 ALA MB 4.920 . 5.420 3.109 2.824 3.535 . 0 0 "[ . 1 . 2]" 1
1347 1 68 PHE QE 1 105 ALA MB 4.700 . 5.200 2.662 2.426 2.868 . 0 0 "[ . 1 . 2]" 1
1348 1 105 ALA MB 1 106 MET HA 4.830 . 5.330 3.944 3.900 3.985 . 0 0 "[ . 1 . 2]" 1
1349 1 105 ALA MB 1 106 MET HB3 5.270 . 5.770 4.161 3.933 4.399 . 0 0 "[ . 1 . 2]" 1
1350 1 105 ALA MB 1 109 MET QB 5.680 . 6.180 3.813 3.705 3.917 . 0 0 "[ . 1 . 2]" 1
1351 1 50 LEU QB 1 105 ALA MB 6.920 . 7.420 4.872 4.413 5.168 . 0 0 "[ . 1 . 2]" 1
1352 1 44 VAL QG 1 47 MET ME . . 5.360 2.014 1.863 2.426 . 0 0 "[ . 1 . 2]" 1
1353 1 47 MET ME 1 97 HIS HE1 5.510 . 6.010 4.511 3.692 4.637 . 0 0 "[ . 1 . 2]" 1
1354 1 47 MET ME 1 75 GLY QA 5.350 . 5.850 3.076 2.411 3.752 . 0 0 "[ . 1 . 2]" 1
1355 1 47 MET ME 1 97 HIS HB2 5.210 . 5.710 3.944 3.389 4.379 . 0 0 "[ . 1 . 2]" 1
1356 1 129 PRO QG 1 130 PRO QD 5.810 . 6.310 4.243 3.997 4.587 . 0 0 "[ . 1 . 2]" 1
1357 1 129 PRO QB 1 130 PRO QD 4.790 . 5.210 3.093 2.613 3.658 . 0 0 "[ . 1 . 2]" 1
1358 1 128 ARG H 1 129 PRO QD 5.440 . 5.940 4.347 4.084 4.412 . 0 0 "[ . 1 . 2]" 1
1359 1 102 ALA MB 1 103 GLU HA 4.890 . 5.390 3.831 3.739 3.935 . 0 0 "[ . 1 . 2]" 1
1360 1 99 LYS HB2 1 102 ALA MB 5.840 . 6.340 4.551 4.270 4.842 . 0 0 "[ . 1 . 2]" 1
1361 1 50 LEU QD 1 124 ALA MB 7.800 . 8.300 4.622 4.177 4.843 . 0 0 "[ . 1 . 2]" 1
1362 1 93 PHE QR 1 124 ALA MB 5.810 . 6.310 2.974 2.683 3.361 . 0 0 "[ . 1 . 2]" 1
1363 1 122 GLN HA 1 123 MET ME 6.170 . 6.670 4.478 4.197 4.754 . 0 0 "[ . 1 . 2]" 1
1364 1 99 LYS QD 1 123 MET ME 5.390 . 5.890 2.741 2.173 3.528 . 0 0 "[ . 1 . 2]" 1
1365 1 106 MET ME 1 123 MET H 4.430 . 4.930 3.480 3.031 3.738 . 0 0 "[ . 1 . 2]" 1
1366 1 103 GLU H 1 106 MET ME 4.950 . 5.450 3.989 3.922 4.054 . 0 0 "[ . 1 . 2]" 1
1367 1 106 MET ME 1 107 ASP H 4.950 . 5.450 4.138 3.925 4.255 . 0 0 "[ . 1 . 2]" 1
1368 1 106 MET H 1 106 MET ME 4.540 . 5.040 3.513 3.276 3.693 . 0 0 "[ . 1 . 2]" 1
1369 1 123 MET H 1 123 MET ME 5.180 . 5.680 4.098 3.819 4.312 . 0 0 "[ . 1 . 2]" 1
1370 1 103 GLU H 1 123 MET ME 4.530 . 5.030 3.459 3.150 3.786 . 0 0 "[ . 1 . 2]" 1
1371 1 80 PRO QD 1 92 ALA HA 4.930 . 5.190 3.367 2.721 3.792 . 0 0 "[ . 1 . 2]" 1
1372 1 79 ILE HB 1 92 ALA HA 5.500 . 6.000 4.913 4.689 5.447 . 0 0 "[ . 1 . 2]" 1
1373 1 80 PRO QG 1 92 ALA HA 6.170 . 6.670 5.115 4.393 5.573 . 0 0 "[ . 1 . 2]" 1
1374 1 79 ILE MG 1 88 SER QB 6.270 . 6.770 4.052 2.353 4.683 . 0 0 "[ . 1 . 2]" 1
1375 1 79 ILE MG 1 89 ARG H 4.970 . 5.470 3.907 3.062 4.295 . 0 0 "[ . 1 . 2]" 1
1376 1 79 ILE MG 1 80 PRO QD 5.570 . 6.070 2.855 2.110 3.517 . 0 0 "[ . 1 . 2]" 1
1377 1 109 MET HA 1 109 MET ME 5.460 . 5.960 4.153 4.083 4.296 . 0 0 "[ . 1 . 2]" 1
1378 1 61 PRO HD2 1 79 ILE MD 4.470 . 4.970 3.328 3.211 3.653 . 0 0 "[ . 1 . 2]" 1
1379 1 45 GLU QB 1 46 GLY QA 5.690 . 6.190 4.087 3.828 4.288 . 0 0 "[ . 1 . 2]" 1
1380 1 72 GLY QA 1 96 PHE QE 6.930 . 7.430 4.187 3.952 4.434 . 0 0 "[ . 1 . 2]" 1
1381 1 58 ARG QD 1 59 THR H 5.930 . 6.430 5.310 4.958 5.368 . 0 0 "[ . 1 . 2]" 1
1382 1 97 HIS HA 1 98 ASP HB2 5.500 . 6.000 5.576 5.174 5.635 . 0 0 "[ . 1 . 2]" 1
1383 1 63 THR HB 1 66 ARG QD 6.170 . 6.670 4.981 4.308 5.228 . 0 0 "[ . 1 . 2]" 1
1384 1 110 ASP HA 1 120 ARG QD 6.170 . 6.670 4.554 3.851 4.999 . 0 0 "[ . 1 . 2]" 1
1385 1 65 ARG QD 1 73 ARG HA 6.170 . 6.670 5.527 5.378 5.580 . 0 0 "[ . 1 . 2]" 1
1386 1 120 ARG H 1 120 ARG QD 4.920 . 5.420 4.229 3.963 4.416 . 0 0 "[ . 1 . 2]" 1
1387 1 55 LEU H 1 117 ARG QD 5.500 . 6.000 4.622 3.104 4.966 . 0 0 "[ . 1 . 2]" 1
1388 1 54 ASN HD22 1 117 ARG QD 4.690 . 5.190 3.925 2.713 4.561 . 0 0 "[ . 1 . 2]" 1
1389 1 54 ASN HD21 1 117 ARG QD 5.110 . 5.610 4.009 3.219 4.265 . 0 0 "[ . 1 . 2]" 1
1390 1 64 LEU HB2 1 65 ARG HA 5.410 . 5.910 5.293 5.131 5.402 . 0 0 "[ . 1 . 2]" 1
1391 1 96 PHE HB3 1 102 ALA MB 5.180 . 5.680 2.654 2.518 2.932 . 0 0 "[ . 1 . 2]" 1
1392 1 64 LEU HB2 1 94 VAL QG 5.540 . 6.040 3.646 3.293 3.957 . 0 0 "[ . 1 . 2]" 1
1393 1 64 LEU HB2 1 92 ALA MB 5.040 . 5.540 3.314 3.173 3.433 . 0 0 "[ . 1 . 2]" 1
1394 1 109 MET QB 1 110 ASP HB3 5.930 . 6.430 4.939 4.747 5.272 . 0 0 "[ . 1 . 2]" 1
1395 1 110 ASP HB3 1 121 VAL HB 5.500 . 6.000 4.799 3.510 5.666 . 0 0 "[ . 1 . 2]" 1
1396 1 110 ASP HB2 1 121 VAL H 4.420 . 4.920 2.401 2.116 2.760 . 0 0 "[ . 1 . 2]" 1
1397 1 110 ASP HB2 1 121 VAL QG 5.610 . 5.990 2.118 1.767 2.659 0.033 17 0 "[ . 1 . 2]" 1
1398 1 62 ASP QB 1 65 ARG QB 6.020 . 6.520 4.458 4.280 4.642 . 0 0 "[ . 1 . 2]" 1
1399 1 106 MET H 1 107 ASP QB 5.570 . 6.070 4.244 4.129 4.371 . 0 0 "[ . 1 . 2]" 1
1400 1 107 ASP QB 1 108 ALA MB . . 6.860 3.682 3.639 3.729 . 0 0 "[ . 1 . 2]" 1
1401 1 56 THR MG 1 115 ASP QB . . 5.820 3.495 2.052 3.966 . 0 0 "[ . 1 . 2]" 1
1402 1 71 TYR HB2 1 96 PHE QE 5.050 . 5.550 2.662 2.382 2.944 . 0 0 "[ . 1 . 2]" 1
1403 1 71 TYR HB2 1 105 ALA MB 5.220 . 5.720 2.797 2.488 3.150 . 0 0 "[ . 1 . 2]" 1
1404 1 56 THR HB 1 58 ARG H 4.160 . 4.660 2.652 2.366 2.822 . 0 0 "[ . 1 . 2]" 1
1405 1 84 TYR HB2 1 85 THR MG 5.140 . 5.640 3.830 3.659 4.011 . 0 0 "[ . 1 . 2]" 1
1406 1 54 ASN HB2 1 55 LEU QD 7.310 . 7.810 4.595 4.319 4.816 . 0 0 "[ . 1 . 2]" 1
1407 1 99 LYS QG 1 103 GLU HG2 5.440 . 5.940 3.452 3.036 3.765 . 0 0 "[ . 1 . 2]" 1
1408 1 102 ALA MB 1 103 GLU HG3 5.920 . 6.420 5.036 4.982 5.083 . 0 0 "[ . 1 . 2]" 1
1409 1 59 THR MG 1 63 THR HB 4.860 . 5.360 2.577 2.291 2.814 . 0 0 "[ . 1 . 2]" 1
1410 1 63 THR HB 1 67 VAL QG 6.270 . 6.770 4.000 3.929 4.076 . 0 0 "[ . 1 . 2]" 1
1411 1 63 THR HB 1 64 LEU MD2 5.150 . 5.650 3.506 3.181 3.819 . 0 0 "[ . 1 . 2]" 1
1412 1 56 THR H 1 59 THR HB 4.170 . 4.670 2.906 2.099 3.493 . 0 0 "[ . 1 . 2]" 1
1413 1 55 LEU HB2 1 59 THR HB 4.150 . 4.650 4.222 4.192 4.251 . 0 0 "[ . 1 . 2]" 1
1414 1 114 LEU HA 1 118 GLU QG 6.170 . 6.670 4.723 4.462 5.942 . 0 0 "[ . 1 . 2]" 1
1415 1 63 THR HA 1 66 ARG QB 4.840 . 5.340 3.842 2.734 4.217 . 0 0 "[ . 1 . 2]" 1
1416 1 63 THR HA 1 67 VAL QG 5.690 . 6.190 3.275 3.202 3.361 . 0 0 "[ . 1 . 2]" 1
1417 1 94 VAL H 1 94 VAL HB 4.110 . 4.610 3.213 2.330 3.863 . 0 0 "[ . 1 . 2]" 1
1418 1 61 PRO HA 1 79 ILE MD 4.320 . 4.820 3.384 3.028 3.687 . 0 0 "[ . 1 . 2]" 1
1419 1 66 ARG QG 1 67 VAL HA 5.240 . 5.740 3.596 2.849 4.487 . 0 0 "[ . 1 . 2]" 1
1420 1 66 ARG QB 1 67 VAL HA 5.480 . 5.980 4.619 4.354 4.821 . 0 0 "[ . 1 . 2]" 1
1421 1 50 LEU QD 1 122 GLN QG 7.660 . 8.160 4.277 3.815 4.743 . 0 0 "[ . 1 . 2]" 1
1422 1 106 MET HB3 1 106 MET ME 4.580 . 5.080 2.096 1.996 2.166 . 0 0 "[ . 1 . 2]" 1
1423 1 73 ARG HA 1 74 VAL HB 4.600 . 5.100 4.360 4.178 4.609 . 0 0 "[ . 1 . 2]" 1
1424 1 65 ARG QG 1 74 VAL HB 5.520 . 6.020 4.401 3.410 4.812 . 0 0 "[ . 1 . 2]" 1
1425 1 74 VAL HB 1 75 GLY QA 6.170 . 6.670 4.762 4.555 4.935 . 0 0 "[ . 1 . 2]" 1
1426 1 106 MET HB2 1 107 ASP HA 5.500 . 6.000 5.269 4.818 5.619 . 0 0 "[ . 1 . 2]" 1
1427 1 58 ARG QG 1 59 THR HA 5.080 . 5.580 3.865 3.629 4.172 . 0 0 "[ . 1 . 2]" 1
1428 1 59 THR MG 1 60 SER QB 7.410 . 7.910 4.306 4.082 4.395 . 0 0 "[ . 1 . 2]" 1
1429 1 88 SER QB 1 89 ARG H 5.030 . 5.350 2.978 1.860 3.790 . 0 0 "[ . 1 . 2]" 1
1430 1 44 VAL HB 1 47 MET ME 4.490 . 4.990 3.688 2.277 3.823 . 0 0 "[ . 1 . 2]" 1
1431 1 130 PRO HA 1 131 ASP QB 5.800 . 6.300 4.686 4.292 5.246 . 0 0 "[ . 1 . 2]" 1
1432 1 106 MET QG 1 107 ASP HA 5.250 . 5.750 3.175 3.041 3.348 . 0 0 "[ . 1 . 2]" 1
1433 1 68 PHE HA 1 105 ALA MB 5.400 . 5.900 4.014 3.610 4.285 . 0 0 "[ . 1 . 2]" 1
1434 1 68 PHE HA 1 68 PHE QD 4.150 . 4.650 3.036 2.991 3.065 . 0 0 "[ . 1 . 2]" 1
1435 1 68 PHE HA 1 71 TYR QD 4.050 . 4.550 2.081 2.019 2.210 . 0 0 "[ . 1 . 2]" 1
1436 1 42 PRO HA 1 43 ASP HA 4.610 . 5.110 4.586 4.406 4.627 . 0 0 "[ . 1 . 2]" 1
1437 1 84 TYR H 1 85 THR HA 4.650 . 5.150 4.503 4.295 4.612 . 0 0 "[ . 1 . 2]" 1
1438 1 65 ARG H 1 66 ARG QB 5.990 . 6.490 4.654 3.960 4.944 . 0 0 "[ . 1 . 2]" 1
1439 1 66 ARG QB 1 69 GLU H 6.170 . 6.670 5.063 4.946 5.212 . 0 0 "[ . 1 . 2]" 1
1440 1 77 VAL HA 1 94 VAL HB 4.980 . 5.480 3.599 2.251 4.841 . 0 0 "[ . 1 . 2]" 1
1441 1 74 VAL HA 1 76 ASP H 4.490 . 4.990 3.936 3.593 4.350 . 0 0 "[ . 1 . 2]" 1
1442 1 74 VAL HA 1 96 PHE QE 5.120 . 5.620 4.449 4.274 4.653 . 0 0 "[ . 1 . 2]" 1
1443 1 65 ARG HA 1 66 ARG QB 6.170 . 6.670 5.385 5.135 5.521 . 0 0 "[ . 1 . 2]" 1
1444 1 118 GLU QB 1 119 LEU HA 5.410 . 5.910 4.317 4.203 4.747 . 0 0 "[ . 1 . 2]" 1
1445 1 74 VAL HA 1 97 HIS HD2 4.760 . 5.260 3.953 3.640 4.274 . 0 0 "[ . 1 . 2]" 1
1446 1 54 ASN HD22 1 118 GLU QB 6.170 . 6.670 5.646 4.837 6.189 . 0 0 "[ . 1 . 2]" 1
1447 1 57 TYR QE 1 58 ARG QB 6.930 . 7.430 3.277 2.736 3.604 . 0 0 "[ . 1 . 2]" 1
1448 1 41 PRO HA 1 42 PRO QD 3.630 . 4.130 1.994 1.926 2.188 . 0 0 "[ . 1 . 2]" 1
1449 1 41 PRO HA 1 42 PRO QG 4.390 . 4.890 3.919 3.866 4.031 . 0 0 "[ . 1 . 2]" 1
1450 1 52 VAL HA 1 122 GLN H 4.130 . 4.630 3.658 3.484 3.828 . 0 0 "[ . 1 . 2]" 1
1451 1 69 GLU H 1 69 GLU HB3 3.730 . 4.230 2.340 2.307 2.387 . 0 0 "[ . 1 . 2]" 1
1452 1 69 GLU H 1 69 GLU HB2 3.720 . 4.220 2.631 2.538 2.677 . 0 0 "[ . 1 . 2]" 1
1453 1 99 LYS QG 1 103 GLU QB 5.460 . 5.960 4.095 3.771 4.383 . 0 0 "[ . 1 . 2]" 1
1454 1 67 VAL HA 1 70 LYS QD 4.420 . 4.920 3.399 3.025 3.982 . 0 0 "[ . 1 . 2]" 1
1455 1 52 VAL HA 1 68 PHE QE 6.170 . 6.670 5.192 4.875 5.506 . 0 0 "[ . 1 . 2]" 1
1456 1 52 VAL HA 1 68 PHE HZ 5.500 . 6.000 5.363 4.988 5.571 . 0 0 "[ . 1 . 2]" 1
1457 1 56 THR HA 1 58 ARG H 4.610 . 5.110 4.081 3.890 4.803 . 0 0 "[ . 1 . 2]" 1
1458 1 70 LYS QD 1 71 TYR QE 5.720 . 6.220 3.946 2.528 4.063 . 0 0 "[ . 1 . 2]" 1
1459 1 56 THR HA 1 57 TYR QD 5.310 . 5.810 3.946 3.766 4.128 . 0 0 "[ . 1 . 2]" 1
1460 1 61 PRO HG3 1 79 ILE MG 5.460 . 5.960 4.541 4.330 4.626 . 0 0 "[ . 1 . 2]" 1
1461 1 47 MET HA 1 97 HIS HA 5.250 . 5.750 4.295 2.935 4.833 . 0 0 "[ . 1 . 2]" 1
1462 1 47 MET QB 1 97 HIS HA 4.690 . 5.190 2.331 1.885 3.183 . 0 0 "[ . 1 . 2]" 1
1463 1 99 LYS HA 1 123 MET ME 5.060 . 5.560 3.483 3.070 3.830 . 0 0 "[ . 1 . 2]" 1
1464 1 99 LYS HA 1 102 ALA MB 4.110 . 4.610 2.443 2.138 2.702 . 0 0 "[ . 1 . 2]" 1
1465 1 103 GLU HA 1 106 MET HB3 3.520 . 4.020 3.039 2.362 3.627 . 0 0 "[ . 1 . 2]" 1
1466 1 84 TYR HA 1 85 THR MG 5.780 . 6.280 4.460 4.153 4.703 . 0 0 "[ . 1 . 2]" 1
1467 1 106 MET HA 1 107 ASP HA 4.920 . 5.420 4.718 4.653 4.774 . 0 0 "[ . 1 . 2]" 1
1468 1 114 LEU HG 1 115 ASP H 5.230 . 5.730 4.048 3.682 4.357 . 0 0 "[ . 1 . 2]" 1
1469 1 56 THR HA 1 117 ARG QG 5.240 . 5.740 3.829 2.948 4.309 . 0 0 "[ . 1 . 2]" 1
1470 1 55 LEU QD 1 64 LEU H 6.970 . 7.470 3.717 3.537 3.942 . 0 0 "[ . 1 . 2]" 1
1471 1 55 LEU QD 1 92 ALA H 5.370 . 5.870 2.045 1.919 2.173 . 0 0 "[ . 1 . 2]" 1
1472 1 70 LYS HB2 1 71 TYR HA 5.330 . 5.830 4.735 4.682 4.792 . 0 0 "[ . 1 . 2]" 1
1473 1 54 ASN HD22 1 120 ARG HG3 4.680 . 5.180 3.797 3.401 4.151 . 0 0 "[ . 1 . 2]" 1
1474 1 120 ARG HG2 1 121 VAL H 5.240 . 5.740 5.080 4.914 5.182 . 0 0 "[ . 1 . 2]" 1
1475 1 120 ARG HE 1 120 ARG HG2 3.720 . 4.220 3.322 2.622 3.759 . 0 0 "[ . 1 . 2]" 1
1476 1 117 ARG H 1 117 ARG QG 4.710 . 5.210 3.337 2.514 4.252 . 0 0 "[ . 1 . 2]" 1
1477 1 71 TYR HA 1 105 ALA MB 6.240 . 6.740 4.772 4.590 5.187 . 0 0 "[ . 1 . 2]" 1
1478 1 100 ARG HA 1 103 GLU H 3.940 . 4.440 3.702 3.553 3.888 . 0 0 "[ . 1 . 2]" 1
1479 1 120 ARG H 1 120 ARG HG2 3.910 . 4.410 3.691 3.362 3.818 . 0 0 "[ . 1 . 2]" 1
1480 1 50 LEU QD 1 68 PHE QD 6.480 . 6.980 3.838 3.306 4.129 . 0 0 "[ . 1 . 2]" 1
1481 1 50 LEU QD 1 106 MET H 5.880 . 6.380 3.541 3.229 3.952 . 0 0 "[ . 1 . 2]" 1
1482 1 50 LEU QD 1 122 GLN H . . 5.660 3.096 2.682 3.395 . 0 0 "[ . 1 . 2]" 1
1483 1 45 GLU HA 1 45 GLU QG 3.740 . 4.240 2.881 2.327 3.341 . 0 0 "[ . 1 . 2]" 1
1484 1 91 PHE HA 1 92 ALA MB 5.330 . 5.830 3.891 3.772 3.994 . 0 0 "[ . 1 . 2]" 1
1485 1 59 THR HB 1 92 ALA MB 6.610 . 7.110 5.280 5.072 5.462 . 0 0 "[ . 1 . 2]" 1
1486 1 64 LEU HA 1 92 ALA MB 6.610 . 7.110 5.328 5.215 5.412 . 0 0 "[ . 1 . 2]" 1
1487 1 64 LEU HB3 1 92 ALA MB 4.470 . 4.970 3.580 3.390 3.738 . 0 0 "[ . 1 . 2]" 1
1488 1 79 ILE HA 1 93 PHE H 4.230 . 4.730 3.340 2.951 3.719 . 0 0 "[ . 1 . 2]" 1
1489 1 79 ILE HA 1 92 ALA HA 4.550 . 5.050 2.747 2.369 3.040 . 0 0 "[ . 1 . 2]" 1
1490 1 79 ILE HA 1 92 ALA MB 4.820 . 5.320 3.832 3.572 4.040 . 0 0 "[ . 1 . 2]" 1
1491 1 91 PHE H 1 92 ALA MB 5.980 . 6.480 4.654 4.443 4.854 . 0 0 "[ . 1 . 2]" 1
1492 1 91 PHE HB2 1 92 ALA MB 6.610 . 7.110 4.594 4.425 4.736 . 0 0 "[ . 1 . 2]" 1
1493 1 64 LEU H 1 64 LEU MD1 5.360 . 5.860 4.218 4.128 4.282 . 0 0 "[ . 1 . 2]" 1
1494 1 64 LEU MD1 1 65 ARG H 6.170 . 6.670 4.581 4.443 4.731 . 0 0 "[ . 1 . 2]" 1
1495 1 64 LEU MD1 1 94 VAL H 6.590 . 7.090 4.379 4.066 4.706 . 0 0 "[ . 1 . 2]" 1
1496 1 64 LEU MD1 1 68 PHE QE 5.300 . 5.800 2.427 2.308 2.520 . 0 0 "[ . 1 . 2]" 1
1497 1 64 LEU HA 1 64 LEU MD1 4.240 . 4.740 2.236 2.089 2.365 . 0 0 "[ . 1 . 2]" 1
1498 1 64 LEU MD1 1 77 VAL QG 6.570 . 7.070 3.518 3.099 3.900 . 0 0 "[ . 1 . 2]" 1
1499 1 64 LEU MD1 1 92 ALA MB 6.100 . 6.600 3.591 3.449 3.783 . 0 0 "[ . 1 . 2]" 1
1500 1 64 LEU HA 1 68 PHE QD 4.470 . 4.970 2.963 2.834 3.053 . 0 0 "[ . 1 . 2]" 1
1501 1 64 LEU HA 1 64 LEU MD2 4.060 . 4.560 1.945 1.922 1.994 . 0 0 "[ . 1 . 2]" 1
1502 1 119 LEU QD 1 120 ARG H . . 6.360 3.246 2.785 4.268 . 0 0 "[ . 1 . 2]" 1
1503 1 64 LEU MD1 1 67 VAL HB 6.380 . 6.880 3.630 3.404 3.805 . 0 0 "[ . 1 . 2]" 1
1504 1 96 PHE HA 1 97 HIS HA 4.510 . 5.010 4.429 4.308 4.529 . 0 0 "[ . 1 . 2]" 1
1505 1 62 ASP HA 1 77 VAL QG 6.590 . 7.090 3.747 3.218 4.124 . 0 0 "[ . 1 . 2]" 1
1506 1 109 MET QB 1 119 LEU QD 6.630 . 7.130 3.231 2.539 3.428 . 0 0 "[ . 1 . 2]" 1
1507 1 109 MET ME 1 119 LEU QD 6.270 . 6.770 3.232 2.149 3.587 . 0 0 "[ . 1 . 2]" 1
1508 1 104 ASP HA 1 108 ALA H 4.850 . 5.350 4.604 4.517 4.684 . 0 0 "[ . 1 . 2]" 1
1509 1 100 ARG QB 1 101 ASP HA 5.250 . 5.750 4.451 4.266 4.573 . 0 0 "[ . 1 . 2]" 1
1510 1 93 PHE HA 1 94 VAL QG 5.660 . 6.160 3.697 3.412 4.052 . 0 0 "[ . 1 . 2]" 1
1511 1 89 ARG HA 1 91 PHE QD 5.220 . 5.720 4.612 3.879 4.742 . 0 0 "[ . 1 . 2]" 1
1512 1 67 VAL HA 1 70 LYS QG 4.920 . 5.420 3.737 3.566 3.919 . 0 0 "[ . 1 . 2]" 1
1513 1 55 LEU QD 1 64 LEU HB3 7.410 . 7.910 3.727 3.557 3.901 . 0 0 "[ . 1 . 2]" 1
1514 1 64 LEU MD2 1 68 PHE QE 5.610 . 6.110 3.155 2.873 3.404 . 0 0 "[ . 1 . 2]" 1
1515 1 64 LEU MD2 1 94 VAL QG 7.010 . 7.510 3.912 3.728 4.130 . 0 0 "[ . 1 . 2]" 1
1516 1 117 ARG H 1 118 GLU HA 4.960 . 5.460 4.581 3.543 4.833 . 0 0 "[ . 1 . 2]" 1
1517 1 64 LEU MD2 1 68 PHE QD 5.580 . 6.080 3.452 3.248 3.643 . 0 0 "[ . 1 . 2]" 1
1518 1 123 MET HA 1 124 ALA MB 4.830 . 5.330 4.002 3.842 4.038 . 0 0 "[ . 1 . 2]" 1
1519 1 50 LEU HA 1 123 MET HA 3.870 . 4.370 2.234 2.041 2.537 . 0 0 "[ . 1 . 2]" 1
1520 1 60 SER HA 1 64 LEU MD2 6.560 . 7.060 5.077 4.865 5.368 . 0 0 "[ . 1 . 2]" 1
1521 1 60 SER HA 1 79 ILE MG 6.610 . 7.110 5.550 5.469 5.592 . 0 0 "[ . 1 . 2]" 1
1522 1 121 VAL QG 1 123 MET HA 7.200 . 7.700 5.124 4.918 5.257 . 0 0 "[ . 1 . 2]" 1
1523 1 114 LEU H 1 118 GLU HA 4.970 . 5.470 4.989 2.850 5.260 . 0 0 "[ . 1 . 2]" 1
1524 1 57 TYR HB2 1 58 ARG HA 5.080 . 5.580 4.930 4.773 5.026 . 0 0 "[ . 1 . 2]" 1
1525 1 60 SER HA 1 61 PRO HD2 3.480 . 3.980 2.689 2.582 2.770 . 0 0 "[ . 1 . 2]" 1
1526 1 60 SER HA 1 61 PRO HD3 3.640 . 4.140 2.491 2.436 2.551 . 0 0 "[ . 1 . 2]" 1
1527 1 51 LYS HA 1 124 ALA MB 5.780 . 6.280 4.286 3.865 4.840 . 0 0 "[ . 1 . 2]" 1
1528 1 59 THR MG 1 60 SER HA 5.750 . 6.250 3.997 3.930 4.069 . 0 0 "[ . 1 . 2]" 1
1529 1 60 SER HA 1 79 ILE QG 6.060 . 6.560 5.032 4.399 5.509 . 0 0 "[ . 1 . 2]" 1
1530 1 54 ASN HB3 1 119 LEU HA 4.210 . 4.710 2.565 2.106 2.861 . 0 0 "[ . 1 . 2]" 1
1531 1 82 ASP HA 1 83 ARG HA 4.810 . 5.310 4.589 4.260 4.975 . 0 0 "[ . 1 . 2]" 1
1532 1 114 LEU HA 1 115 ASP HA 4.540 . 5.040 4.453 4.386 4.534 . 0 0 "[ . 1 . 2]" 1
1533 1 55 LEU HG 1 91 PHE HA 4.440 . 4.940 2.948 2.740 3.200 . 0 0 "[ . 1 . 2]" 1
1534 1 115 ASP HA 1 116 GLY HA2 5.050 . 5.550 4.848 4.716 4.983 . 0 0 "[ . 1 . 2]" 1
1535 1 52 VAL QG 1 121 VAL HA . . 6.310 3.156 2.786 3.530 . 0 0 "[ . 1 . 2]" 1
1536 1 54 ASN HB2 1 119 LEU QD 7.410 . 7.910 4.863 4.113 5.509 . 0 0 "[ . 1 . 2]" 1
1537 1 54 ASN H 1 91 PHE HA 4.650 . 5.150 2.705 2.295 3.052 . 0 0 "[ . 1 . 2]" 1
1538 1 129 PRO QB 1 131 ASP HA 5.440 . 5.940 4.464 3.774 4.892 . 0 0 "[ . 1 . 2]" 1
1539 1 71 TYR QD 1 105 ALA HA 4.710 . 5.210 2.826 2.661 3.120 . 0 0 "[ . 1 . 2]" 1
1540 1 68 PHE QD 1 105 ALA HA 5.880 . 6.380 4.872 4.617 5.126 . 0 0 "[ . 1 . 2]" 1
1541 1 119 LEU QB 1 121 VAL QG 8.020 . 8.520 2.686 2.248 3.624 . 0 0 "[ . 1 . 2]" 1
1542 1 65 ARG H 1 74 VAL QG 7.410 . 7.910 5.177 4.875 5.427 . 0 0 "[ . 1 . 2]" 1
1543 1 54 ASN HA 1 55 LEU HA 5.090 . 5.590 4.805 4.445 4.866 . 0 0 "[ . 1 . 2]" 1
1544 1 63 THR H 1 63 THR MG 4.520 . 5.020 3.753 3.741 3.771 . 0 0 "[ . 1 . 2]" 1
1545 1 63 THR MG 1 66 ARG QB 6.590 . 7.090 4.703 3.884 4.967 . 0 0 "[ . 1 . 2]" 1
1546 1 63 THR MG 1 64 LEU MD2 6.010 . 6.510 3.312 3.089 3.512 . 0 0 "[ . 1 . 2]" 1
1547 1 63 THR MG 1 66 ARG QG 6.340 . 6.840 3.096 2.816 3.902 . 0 0 "[ . 1 . 2]" 1
1548 1 48 THR MG 1 102 ALA H 5.090 . 5.590 4.120 4.015 4.244 . 0 0 "[ . 1 . 2]" 1
1549 1 65 ARG QB 1 67 VAL QG 7.840 . 8.340 5.237 5.209 5.263 . 0 0 "[ . 1 . 2]" 1
1550 1 68 PHE HB3 1 74 VAL QG 6.210 . 6.710 2.742 2.339 2.915 . 0 0 "[ . 1 . 2]" 1
1551 1 54 ASN HD22 1 117 ARG HA 4.090 . 4.590 2.845 2.533 3.481 . 0 0 "[ . 1 . 2]" 1
1552 1 39 ARG HA 1 39 ARG QG 3.610 . 4.110 3.142 2.296 3.363 . 0 0 "[ . 1 . 2]" 1
1553 1 43 ASP HA 1 47 MET ME 6.340 . 6.840 4.888 3.970 5.371 . 0 0 "[ . 1 . 2]" 1
1554 1 54 ASN HA 1 120 ARG HB2 5.470 . 5.970 4.397 4.247 4.730 . 0 0 "[ . 1 . 2]" 1
1555 1 48 THR MG 1 123 MET HG2 5.570 . 6.070 4.527 4.425 4.682 . 0 0 "[ . 1 . 2]" 1
1556 1 48 THR MG 1 106 MET ME 7.100 . 7.600 4.467 4.265 4.770 . 0 0 "[ . 1 . 2]" 1
1557 1 59 THR MG 1 64 LEU MD2 4.200 . 4.700 2.037 1.887 2.236 . 0 0 "[ . 1 . 2]" 1
1558 1 113 VAL QG 1 114 LEU H . . 4.870 1.972 1.617 2.921 0.183 4 0 "[ . 1 . 2]" 1
1559 1 112 ALA MB 1 113 VAL QG 7.590 . 8.090 4.180 3.879 4.595 . 0 0 "[ . 1 . 2]" 1
1560 1 77 VAL QG 1 95 ARG H 7.090 . 7.590 4.160 3.516 4.609 . 0 0 "[ . 1 . 2]" 1
1561 1 122 GLN HA 1 123 MET HG2 4.320 . 4.820 3.467 3.369 3.617 . 0 0 "[ . 1 . 2]" 1
1562 1 121 VAL QG 1 122 GLN HA 5.770 . 6.270 3.315 3.102 3.441 . 0 0 "[ . 1 . 2]" 1
1563 1 53 ASP HA 1 54 ASN HA 4.840 . 5.340 4.752 4.706 4.793 . 0 0 "[ . 1 . 2]" 1
1564 1 55 LEU HA 1 56 THR MG 6.610 . 7.110 5.391 5.270 5.453 . 0 0 "[ . 1 . 2]" 1
1565 1 95 ARG HA 1 95 ARG HE 5.180 . 5.680 4.833 4.570 5.109 . 0 0 "[ . 1 . 2]" 1
1566 1 53 ASP HA 1 91 PHE HB3 4.710 . 5.210 3.972 3.553 4.553 . 0 0 "[ . 1 . 2]" 1
1567 1 50 LEU QD 1 122 GLN HA 5.760 . 6.260 2.747 2.424 3.107 . 0 0 "[ . 1 . 2]" 1
1568 1 50 LEU HA 1 124 ALA MB 5.280 . 5.780 3.847 3.615 4.215 . 0 0 "[ . 1 . 2]" 1
1569 1 108 ALA MB 1 109 MET HA 5.190 . 5.690 4.219 4.192 4.239 . 0 0 "[ . 1 . 2]" 1
1570 1 109 MET HA 1 112 ALA MB 4.680 . 5.180 2.671 2.447 2.986 . 0 0 "[ . 1 . 2]" 1
1571 1 113 VAL QG 1 115 ASP H 5.320 . 5.820 1.928 1.562 3.117 0.238 19 0 "[ . 1 . 2]" 1
1572 1 112 ALA HA 1 113 VAL QG . . 6.150 4.093 3.725 4.212 . 0 0 "[ . 1 . 2]" 1
1573 1 51 LYS QB 1 52 VAL QG 7.750 . 8.250 4.324 3.882 4.603 . 0 0 "[ . 1 . 2]" 1
1574 1 98 ASP HA 1 100 ARG H 4.340 . 4.840 4.186 3.986 4.341 . 0 0 "[ . 1 . 2]" 1
1575 1 98 ASP HA 1 99 LYS HB3 4.820 . 5.320 4.457 4.356 4.616 . 0 0 "[ . 1 . 2]" 1
1576 1 64 LEU MD1 1 94 VAL QG 5.590 . 6.090 1.914 1.827 2.015 . 0 0 "[ . 1 . 2]" 1
1577 1 68 PHE HB2 1 94 VAL QG 5.500 . 6.000 3.270 2.823 3.493 . 0 0 "[ . 1 . 2]" 1
1578 1 68 PHE H 1 94 VAL QG 7.410 . 7.910 4.780 4.337 5.054 . 0 0 "[ . 1 . 2]" 1
1579 1 93 PHE HZ 1 124 ALA HA 5.500 . 6.000 5.539 5.497 5.588 . 0 0 "[ . 1 . 2]" 1
1580 1 111 GLY QA 1 112 ALA MB 6.440 . 6.940 4.247 4.050 4.298 . 0 0 "[ . 1 . 2]" 1
1581 1 112 ALA MB 1 119 LEU H 6.200 . 6.700 5.074 4.882 5.281 . 0 0 "[ . 1 . 2]" 1
1582 1 71 TYR HB3 1 105 ALA MB 4.490 . 4.990 2.710 2.510 3.196 . 0 0 "[ . 1 . 2]" 1
1583 1 50 LEU QD 1 105 ALA MB 5.280 . 5.780 2.825 2.278 3.165 . 0 0 "[ . 1 . 2]" 1
1584 1 94 VAL QG 1 105 ALA MB 8.580 . 9.080 5.110 4.854 5.350 . 0 0 "[ . 1 . 2]" 1
1585 1 68 PHE QD 1 105 ALA MB 4.410 . 4.910 2.426 2.236 2.643 . 0 0 "[ . 1 . 2]" 1
1586 1 102 ALA HA 1 105 ALA MB 3.980 . 4.480 3.058 2.853 3.302 . 0 0 "[ . 1 . 2]" 1
1587 1 105 ALA MB 1 106 MET HB2 6.550 . 7.050 4.693 4.145 5.220 . 0 0 "[ . 1 . 2]" 1
1588 1 105 ALA MB 1 121 VAL HB 6.610 . 7.110 5.131 4.824 5.424 . 0 0 "[ . 1 . 2]" 1
1589 1 44 VAL H 1 47 MET ME 5.120 . 5.620 3.293 2.642 3.852 . 0 0 "[ . 1 . 2]" 1
1590 1 47 MET ME 1 97 HIS HA 3.930 . 4.430 2.990 2.278 3.299 . 0 0 "[ . 1 . 2]" 1
1591 1 44 VAL HA 1 47 MET ME 3.690 . 4.190 2.377 2.013 2.849 . 0 0 "[ . 1 . 2]" 1
1592 1 96 PHE H 1 102 ALA MB 5.370 . 5.870 4.508 4.317 4.576 . 0 0 "[ . 1 . 2]" 1
1593 1 96 PHE QD 1 102 ALA MB 5.030 . 5.530 3.460 3.247 3.739 . 0 0 "[ . 1 . 2]" 1
1594 1 96 PHE HB2 1 102 ALA MB 4.460 . 4.960 2.607 2.371 2.869 . 0 0 "[ . 1 . 2]" 1
1595 1 50 LEU QB 1 102 ALA MB 5.060 . 5.560 1.919 1.816 2.004 . 0 0 "[ . 1 . 2]" 1
1596 1 48 THR MG 1 102 ALA MB 3.880 . 4.380 2.119 1.965 2.213 . 0 0 "[ . 1 . 2]" 1
1597 1 102 ALA MB 1 103 GLU H 4.050 . 4.550 2.442 2.278 2.547 . 0 0 "[ . 1 . 2]" 1
1598 1 102 ALA MB 1 103 GLU HG2 5.510 . 6.010 3.961 3.752 4.090 . 0 0 "[ . 1 . 2]" 1
1599 1 51 LYS H 1 124 ALA MB 4.920 . 5.420 3.896 3.264 4.129 . 0 0 "[ . 1 . 2]" 1
1600 1 49 SER HA 1 124 ALA MB 5.560 . 6.060 4.375 4.168 4.656 . 0 0 "[ . 1 . 2]" 1
1601 1 49 SER QB 1 124 ALA MB 5.350 . 5.530 2.636 2.207 3.215 . 0 0 "[ . 1 . 2]" 1
1602 1 93 PHE HZ 1 124 ALA MB 4.130 . 4.630 3.277 2.898 3.466 . 0 0 "[ . 1 . 2]" 1
1603 1 91 PHE QD 1 92 ALA HA 4.980 . 5.480 3.756 3.043 4.286 . 0 0 "[ . 1 . 2]" 1
1604 1 123 MET HA 1 123 MET ME 4.480 . 4.980 3.769 3.702 3.801 . 0 0 "[ . 1 . 2]" 1
1605 1 103 GLU HA 1 123 MET ME 4.260 . 4.760 3.146 2.895 3.448 . 0 0 "[ . 1 . 2]" 1
1606 1 48 THR MG 1 123 MET ME 4.050 . 4.550 2.196 2.004 2.421 . 0 0 "[ . 1 . 2]" 1
1607 1 50 LEU QD 1 123 MET ME 4.820 . 5.320 2.144 1.958 2.382 . 0 0 "[ . 1 . 2]" 1
1608 1 79 ILE MG 1 92 ALA HA 4.920 . 5.420 3.372 2.953 3.747 . 0 0 "[ . 1 . 2]" 1
1609 1 106 MET HB2 1 106 MET ME 3.790 . 4.290 2.720 2.349 3.189 . 0 0 "[ . 1 . 2]" 1
1610 1 102 ALA H 1 123 MET ME 6.350 . 6.850 4.500 4.273 4.816 . 0 0 "[ . 1 . 2]" 1
1611 1 102 ALA MB 1 106 MET ME 5.410 . 5.910 3.508 3.372 3.634 . 0 0 "[ . 1 . 2]" 1
1612 1 83 ARG QB 1 84 TYR QD 5.350 . 5.850 3.502 2.479 3.876 . 0 0 "[ . 1 . 2]" 1
1613 1 84 TYR QD 1 85 THR H 4.240 . 4.740 3.717 3.295 3.880 . 0 0 "[ . 1 . 2]" 1
1614 1 84 TYR H 1 84 TYR QD 3.740 . 4.240 2.942 2.276 3.355 . 0 0 "[ . 1 . 2]" 1
1615 1 84 TYR HA 1 84 TYR QD 4.180 . 4.680 3.697 3.642 3.735 . 0 0 "[ . 1 . 2]" 1
1616 1 84 TYR QD 1 85 THR MG 4.720 . 5.220 2.243 2.030 2.798 . 0 0 "[ . 1 . 2]" 1
1617 1 37 TYR H 1 37 TYR QD 3.950 . 4.450 2.311 1.635 3.041 0.165 17 0 "[ . 1 . 2]" 1
1618 1 37 TYR HA 1 37 TYR QD 3.970 . 4.470 3.005 2.127 3.226 . 0 0 "[ . 1 . 2]" 1
1619 1 56 THR MG 1 57 TYR QD 5.580 . 6.080 2.308 2.039 2.417 . 0 0 "[ . 1 . 2]" 1
1620 1 57 TYR H 1 57 TYR QD 3.890 . 4.390 2.124 1.952 3.588 . 0 0 "[ . 1 . 2]" 1
1621 1 91 PHE QD 1 93 PHE H 5.540 . 6.040 3.245 2.666 4.688 . 0 0 "[ . 1 . 2]" 1
1622 1 64 LEU MD1 1 68 PHE QD 5.510 . 6.010 2.058 1.979 2.219 . 0 0 "[ . 1 . 2]" 1
1623 1 78 TYR QD 1 79 ILE H 4.710 . 5.210 2.832 1.905 3.796 . 0 0 "[ . 1 . 2]" 1
1624 1 51 LYS QB 1 93 PHE QD 4.880 . 5.380 3.154 2.362 3.905 . 0 0 "[ . 1 . 2]" 1
1625 1 78 TYR QD 1 93 PHE QD 5.230 . 5.730 3.377 2.942 3.991 . 0 0 "[ . 1 . 2]" 1
1626 1 64 LEU HA 1 68 PHE QE 4.910 . 5.410 4.099 4.010 4.213 . 0 0 "[ . 1 . 2]" 1
1627 1 68 PHE QE 1 94 VAL QG 7.550 . 8.050 4.290 4.028 4.539 . 0 0 "[ . 1 . 2]" 1
1628 1 68 PHE QE 1 109 MET QB 5.710 . 6.210 3.441 3.138 3.772 . 0 0 "[ . 1 . 2]" 1
1629 1 68 PHE QE 1 121 VAL HB 5.460 . 5.960 3.723 3.040 4.541 . 0 0 "[ . 1 . 2]" 1
1630 1 68 PHE HB2 1 96 PHE HZ 4.470 . 4.970 3.616 3.568 3.681 . 0 0 "[ . 1 . 2]" 1
1631 1 51 LYS QB 1 93 PHE HZ 5.130 . 5.630 3.641 3.106 4.190 . 0 0 "[ . 1 . 2]" 1
1632 1 68 PHE HZ 1 109 MET QB 5.240 . 5.740 3.126 2.714 3.671 . 0 0 "[ . 1 . 2]" 1
1633 1 68 PHE HZ 1 119 LEU HG 5.350 . 5.850 3.371 2.848 5.419 . 0 0 "[ . 1 . 2]" 1
1634 1 97 HIS H 1 97 HIS HD2 3.370 . 3.870 1.929 1.793 2.089 0.007 8 0 "[ . 1 . 2]" 1
1635 1 96 PHE HA 1 97 HIS HD2 4.540 . 5.040 3.487 3.061 3.779 . 0 0 "[ . 1 . 2]" 1
1636 1 97 HIS HA 1 97 HIS HD2 4.410 . 4.910 4.241 4.147 4.310 . 0 0 "[ . 1 . 2]" 1
1637 1 97 HIS HB2 1 97 HIS HD2 3.450 . 3.950 3.263 2.833 3.510 . 0 0 "[ . 1 . 2]" 1
1638 1 73 ARG QD 1 97 HIS HD2 3.660 . 4.160 2.914 2.501 3.225 . 0 0 "[ . 1 . 2]" 1
1639 1 74 VAL QG 1 97 HIS HD2 7.410 . 7.910 4.847 4.608 5.085 . 0 0 "[ . 1 . 2]" 1
1640 1 96 PHE HB3 1 97 HIS HD2 5.360 . 5.860 3.896 3.508 4.103 . 0 0 "[ . 1 . 2]" 1
1641 1 73 ARG QD 1 97 HIS HE1 5.430 . 5.930 3.841 3.444 4.171 . 0 0 "[ . 1 . 2]" 1
1642 1 75 GLY QA 1 97 HIS HE1 4.730 . 5.230 2.086 1.972 2.394 . 0 0 "[ . 1 . 2]" 1
1643 1 56 THR MG 1 57 TYR QE 5.510 . 6.010 2.811 2.479 3.012 . 0 0 "[ . 1 . 2]" 1
1644 1 57 TYR H 1 57 TYR QE 5.590 . 6.090 4.040 3.874 5.013 . 0 0 "[ . 1 . 2]" 1
1645 1 71 TYR HA 1 71 TYR QE 5.310 . 5.810 4.617 4.558 4.667 . 0 0 "[ . 1 . 2]" 1
1646 1 83 ARG QB 1 84 TYR QE 5.220 . 5.720 4.207 3.480 4.326 . 0 0 "[ . 1 . 2]" 1
1647 1 83 ARG QD 1 84 TYR QE 6.100 . 6.600 3.994 2.873 4.888 . 0 0 "[ . 1 . 2]" 1
1648 1 84 TYR QE 1 85 THR MG 5.530 . 6.030 2.508 2.372 2.791 . 0 0 "[ . 1 . 2]" 1
1649 1 57 TYR QE 1 58 ARG QD 5.250 . 5.750 3.453 2.828 4.202 . 0 0 "[ . 1 . 2]" 1
1650 2 1 U H1' 2 1 U H2' 3.500 . 4.000 3.009 2.832 3.038 . 0 0 "[ . 1 . 2]" 1
1651 2 1 U H1' 2 1 U H3' 5.000 . 5.500 3.813 3.623 3.955 . 0 0 "[ . 1 . 2]" 1
1652 2 1 U H1' 2 1 U H4' 3.500 . 4.000 3.385 3.040 3.631 . 0 0 "[ . 1 . 2]" 1
1653 2 1 U H1' 2 1 U Q5' 5.610 . 6.110 4.061 3.816 4.258 . 0 0 "[ . 1 . 2]" 1
1654 2 1 U H2' 2 1 U H4' 5.000 . 5.500 3.810 3.729 3.938 . 0 0 "[ . 1 . 2]" 1
1655 2 1 U H2' 2 1 U Q5' 5.610 . 6.110 2.868 2.180 3.980 . 0 0 "[ . 1 . 2]" 1
1656 2 1 U H3' 2 1 U H4' 4.000 . 4.500 2.758 2.701 3.007 . 0 0 "[ . 1 . 2]" 1
1657 2 1 U H4' 2 1 U H5' 3.000 . 3.500 2.525 2.486 2.567 . 0 0 "[ . 1 . 2]" 1
1658 2 1 U H3' 2 1 U Q5' 5.610 . 6.110 2.343 2.160 2.553 . 0 0 "[ . 1 . 2]" 1
1659 2 1 U H3' 2 1 U H6 5.000 . 5.500 4.727 4.137 5.125 . 0 0 "[ . 1 . 2]" 1
1660 2 1 U H4' 2 1 U H6 5.500 . 6.000 5.112 3.867 5.637 . 0 0 "[ . 1 . 2]" 1
1661 2 1 U Q5' 2 1 U H6 6.170 . 6.670 4.337 2.416 5.610 . 0 0 "[ . 1 . 2]" 1
1662 2 1 U H5 2 1 U H6 2.500 . 3.000 2.436 2.402 2.455 . 0 0 "[ . 1 . 2]" 1
1663 2 1 U H1' 2 1 U H6 3.500 . 4.000 2.960 2.222 3.680 . 0 0 "[ . 1 . 2]" 1
1664 2 1 U H4' 2 2 G H2' 5.500 . 6.000 3.952 2.910 5.117 . 0 0 "[ . 1 . 2]" 1
1665 2 1 U H4' 2 2 G H3' 5.000 . 5.500 2.586 1.951 3.484 . 0 0 "[ . 1 . 2]" 1
1666 2 1 U H4' 2 2 G Q5' 5.050 . 5.550 3.216 1.787 3.585 0.013 6 0 "[ . 1 . 2]" 1
1667 2 1 U H1' 2 2 G H2' 5.500 . 6.000 5.535 5.396 5.664 . 0 0 "[ . 1 . 2]" 1
1668 2 1 U H1' 2 2 G H3' 5.500 . 6.000 3.421 3.052 4.219 . 0 0 "[ . 1 . 2]" 1
1669 2 1 U H1' 2 2 G Q5' 5.610 . 6.110 2.835 2.003 3.324 . 0 0 "[ . 1 . 2]" 1
1670 2 1 U H3' 2 2 G H3' 5.500 . 6.000 5.015 4.600 5.683 . 0 0 "[ . 1 . 2]" 1
1671 2 2 G H1' 2 2 G H2' 5.000 . 5.500 3.011 2.818 3.049 . 0 0 "[ . 1 . 2]" 1
1672 2 2 G H1' 2 2 G H3' 4.500 . 5.000 3.735 3.625 3.829 . 0 0 "[ . 1 . 2]" 1
1673 2 2 G H1' 2 2 G H4' 5.000 . 5.500 2.656 2.396 3.128 . 0 0 "[ . 1 . 2]" 1
1674 2 2 G H1' 2 2 G H8 3.000 . 3.500 2.558 2.381 2.679 . 0 0 "[ . 1 . 2]" 1
1675 2 2 G H2' 2 2 G H3' 3.000 . 3.500 2.270 2.136 2.411 . 0 0 "[ . 1 . 2]" 1
1676 2 2 G H2' 2 2 G H4' 5.000 . 5.500 3.799 3.692 3.903 . 0 0 "[ . 1 . 2]" 1
1677 2 2 G H2' 2 2 G Q5' 5.610 . 6.110 3.925 2.771 4.602 . 0 0 "[ . 1 . 2]" 1
1678 2 2 G H2' 2 2 G H8 5.000 . 5.500 4.099 3.411 4.581 . 0 0 "[ . 1 . 2]" 1
1679 2 2 G H3' 2 2 G H4' 4.000 . 4.500 2.936 2.790 3.040 . 0 0 "[ . 1 . 2]" 1
1680 2 2 G H3' 2 2 G Q5' 5.050 . 5.550 2.626 1.987 2.993 . 0 0 "[ . 1 . 2]" 1
1681 2 2 G H3' 2 2 G H8 5.500 . 6.000 5.694 5.132 5.876 . 0 0 "[ . 1 . 2]" 1
1682 2 2 G H4' 2 2 G Q5' 6.170 . 6.670 2.207 2.146 2.457 . 0 0 "[ . 1 . 2]" 1
1683 2 2 G H4' 2 2 G H8 5.500 . 6.000 5.164 4.736 5.563 . 0 0 "[ . 1 . 2]" 1
1684 2 3 G H1' 2 3 G H2' 3.500 . 4.000 2.744 2.672 2.874 . 0 0 "[ . 1 . 2]" 1
1685 2 3 G H1' 2 3 G H3' 5.500 . 6.000 3.758 3.612 3.888 . 0 0 "[ . 1 . 2]" 1
1686 2 3 G H1' 2 3 G H4' 5.500 . 6.000 3.220 2.688 3.442 . 0 0 "[ . 1 . 2]" 1
1687 2 3 G H1' 2 3 G Q5' 6.170 . 6.670 4.222 4.058 4.340 . 0 0 "[ . 1 . 2]" 1
1688 2 3 G H1' 2 3 G H8 3.000 . 3.500 2.628 2.497 2.734 . 0 0 "[ . 1 . 2]" 1
1689 2 3 G H2' 2 3 G H3' 3.500 . 4.000 2.370 2.315 2.426 . 0 0 "[ . 1 . 2]" 1
1690 2 3 G H2' 2 3 G H4' 5.000 . 5.500 3.761 3.584 3.879 . 0 0 "[ . 1 . 2]" 1
1691 2 3 G H2' 2 3 G H8 5.500 . 6.000 3.226 2.956 3.646 . 0 0 "[ . 1 . 2]" 1
1692 2 3 G H3' 2 3 G H4' 5.000 . 5.500 3.024 3.002 3.045 . 0 0 "[ . 1 . 2]" 1
1693 2 3 G H3' 2 3 G H8 5.500 . 6.000 4.847 4.455 5.485 . 0 0 "[ . 1 . 2]" 1
1694 2 3 G H1' 2 4 A H3' 5.000 . 5.500 4.866 4.578 5.127 . 0 0 "[ . 1 . 2]" 1
1695 2 3 G H2' 2 4 A H3' 4.500 . 5.000 3.697 3.238 4.485 . 0 0 "[ . 1 . 2]" 1
1696 2 3 G H4' 2 4 A H3' 5.500 . 6.000 5.278 4.756 5.671 . 0 0 "[ . 1 . 2]" 1
1697 2 3 G H8 2 4 A H3' 5.500 . 6.000 5.637 5.520 5.817 . 0 0 "[ . 1 . 2]" 1
1698 2 4 A H1' 2 4 A H4' 5.000 . 5.500 3.810 3.592 3.990 . 0 0 "[ . 1 . 2]" 1
1699 2 4 A H1' 2 4 A Q5' 6.170 . 6.670 3.916 3.557 4.228 . 0 0 "[ . 1 . 2]" 1
1700 2 4 A H1' 2 4 A H2 5.000 . 5.500 4.622 4.464 4.788 . 0 0 "[ . 1 . 2]" 1
1701 2 4 A H1' 2 4 A H8 4.000 . 4.500 3.772 3.688 3.878 . 0 0 "[ . 1 . 2]" 1
1702 2 4 A H1' 2 4 A H2' 4.000 . 4.500 2.924 2.792 3.023 . 0 0 "[ . 1 . 2]" 1
1703 2 4 A H2' 2 4 A H4' 5.500 . 6.000 3.924 3.761 4.106 . 0 0 "[ . 1 . 2]" 1
1704 2 4 A H2' 2 4 A H8 3.500 . 4.000 2.065 1.844 2.985 . 0 0 "[ . 1 . 2]" 1
1705 2 4 A H1' 2 4 A H3' 4.500 . 5.000 4.034 3.841 4.177 . 0 0 "[ . 1 . 2]" 1
1706 2 4 A H3' 2 4 A H4' 5.000 . 5.500 2.712 2.630 2.836 . 0 0 "[ . 1 . 2]" 1
1707 2 4 A H3' 2 4 A Q5' 5.610 . 6.110 2.740 2.068 3.120 . 0 0 "[ . 1 . 2]" 1
1708 2 4 A H3' 2 4 A H8 4.000 . 4.500 3.509 2.655 4.200 . 0 0 "[ . 1 . 2]" 1
1709 2 4 A H4' 2 4 A Q5' 4.490 . 4.990 2.187 2.137 2.552 . 0 0 "[ . 1 . 2]" 1
1710 2 4 A H4' 2 4 A H8 5.000 . 5.500 4.438 3.911 4.819 . 0 0 "[ . 1 . 2]" 1
1711 2 4 A Q5' 2 4 A H8 6.170 . 6.670 2.575 1.865 3.881 . 0 0 "[ . 1 . 2]" 1
1712 2 4 A H3' 2 5 G H8 5.500 . 6.000 4.365 3.213 5.237 . 0 0 "[ . 1 . 2]" 1
1713 2 4 A H4' 2 5 G H8 5.000 . 5.500 4.904 4.327 5.186 . 0 0 "[ . 1 . 2]" 1
1714 2 5 G H1' 2 5 G H2' 4.000 . 4.500 2.976 2.872 3.034 . 0 0 "[ . 1 . 2]" 1
1715 2 5 G H1' 2 5 G H3' 4.000 . 4.500 3.955 3.840 4.059 . 0 0 "[ . 1 . 2]" 1
1716 2 5 G H1' 2 5 G H4' 5.500 . 6.000 3.665 3.464 3.850 . 0 0 "[ . 1 . 2]" 1
1717 2 5 G H1' 2 5 G Q5' 6.170 . 6.670 4.184 3.825 4.347 . 0 0 "[ . 1 . 2]" 1
1718 2 5 G H1' 2 5 G H8 4.500 . 5.000 3.848 3.742 3.953 . 0 0 "[ . 1 . 2]" 1
1719 2 5 G H2' 2 5 G Q5' 5.610 . 6.110 3.234 2.229 3.693 . 0 0 "[ . 1 . 2]" 1
1720 2 5 G H2' 2 5 G H8 3.000 . 3.500 2.164 1.893 3.015 . 0 0 "[ . 1 . 2]" 1
1721 2 5 G H3' 2 5 G Q5' 5.610 . 6.110 2.529 2.160 3.058 . 0 0 "[ . 1 . 2]" 1
1722 2 5 G H3' 2 5 G H8 4.000 . 4.500 4.058 3.559 4.225 . 0 0 "[ . 1 . 2]" 1
1723 2 5 G H4' 2 5 G Q5' 5.610 . 6.110 2.183 2.146 2.391 . 0 0 "[ . 1 . 2]" 1
1724 2 5 G H4' 2 5 G H8 5.000 . 5.500 4.792 4.239 5.082 . 0 0 "[ . 1 . 2]" 1
1725 2 5 G Q5' 2 5 G H8 5.050 . 5.550 3.326 1.777 3.905 0.023 8 0 "[ . 1 . 2]" 1
1726 2 5 G H3' 2 6 U H1' 5.000 . 5.500 4.878 3.829 5.359 . 0 0 "[ . 1 . 2]" 1
1727 2 5 G H3' 2 6 U H4' 4.500 . 5.000 4.330 3.877 4.678 . 0 0 "[ . 1 . 2]" 1
1728 2 5 G H3' 2 6 U H6 5.000 . 5.500 4.509 3.016 5.102 . 0 0 "[ . 1 . 2]" 1
1729 2 6 U H1' 2 6 U H4' 4.000 . 4.500 3.168 2.355 3.698 . 0 0 "[ . 1 . 2]" 1
1730 2 6 U H4' 2 6 U H6 5.000 . 5.500 4.725 4.268 5.246 . 0 0 "[ . 1 . 2]" 1
1731 2 6 U H5 2 6 U H6 2.500 . 3.000 2.426 2.411 2.450 . 0 0 "[ . 1 . 2]" 1
1732 1 91 PHE QD 2 1 U H1' 5.610 . 6.110 4.325 3.276 5.031 . 0 0 "[ . 1 . 2]" 1
1733 1 91 PHE QE 2 1 U H2' 5.610 . 6.110 5.033 4.946 5.116 . 0 0 "[ . 1 . 2]" 1
1734 1 51 LYS QG 2 2 G H8 5.050 . 5.550 4.265 3.209 4.602 . 0 0 "[ . 1 . 2]" 1
1735 1 51 LYS QD 2 2 G H8 5.610 . 6.110 2.744 2.350 3.184 . 0 0 "[ . 1 . 2]" 1
1736 1 91 PHE QD 2 2 G H4' 5.610 . 6.110 3.481 2.571 4.775 . 0 0 "[ . 1 . 2]" 1
1737 1 91 PHE QE 2 2 G H1' 5.610 . 6.110 5.019 4.894 5.068 . 0 0 "[ . 1 . 2]" 1
1738 1 91 PHE QE 2 2 G H3' 5.610 . 6.110 4.504 3.623 5.049 . 0 0 "[ . 1 . 2]" 1
1739 1 91 PHE QE 2 2 G H4' 4.490 . 4.990 3.336 2.770 4.012 . 0 0 "[ . 1 . 2]" 1
1740 1 93 PHE QD 2 2 G H1' 3.930 . 4.430 2.690 2.000 3.513 . 0 0 "[ . 1 . 2]" 1
1741 1 93 PHE QD 2 2 G H8 3.930 . 4.430 3.665 3.612 3.726 . 0 0 "[ . 1 . 2]" 1
1742 1 124 ALA MB 2 2 G H8 4.200 . 4.700 3.478 3.075 3.598 . 0 0 "[ . 1 . 2]" 1
1743 1 126 TYR HA 2 2 G H8 5.500 . 6.000 5.680 5.614 5.760 . 0 0 "[ . 1 . 2]" 1
1744 1 126 TYR QB 2 2 G H8 4.490 . 4.990 3.000 2.635 3.724 . 0 0 "[ . 1 . 2]" 1
1745 1 126 TYR QD 2 2 G H1' 6.170 . 6.670 3.897 3.502 4.426 . 0 0 "[ . 1 . 2]" 1
1746 1 126 TYR QD 2 2 G H8 6.170 . 6.670 2.970 2.603 3.415 . 0 0 "[ . 1 . 2]" 1
1747 1 126 TYR QE 2 2 G H1' 5.610 . 6.110 5.019 4.788 5.089 . 0 0 "[ . 1 . 2]" 1
1748 1 126 TYR QE 2 2 G H3' 6.170 . 6.670 4.864 3.686 5.503 . 0 0 "[ . 1 . 2]" 1
1749 1 126 TYR QE 2 2 G H8 5.610 . 6.110 4.784 4.263 5.086 . 0 0 "[ . 1 . 2]" 1
1750 1 78 TYR QD 2 3 G H1' 5.050 . 5.550 2.743 1.893 3.687 . 0 0 "[ . 1 . 2]" 1
1751 1 78 TYR QD 2 3 G H8 4.490 . 4.990 3.458 2.227 4.267 . 0 0 "[ . 1 . 2]" 1
1752 1 78 TYR QE 2 3 G H1' 3.930 . 4.430 2.212 1.777 3.382 0.023 17 0 "[ . 1 . 2]" 1
1753 1 78 TYR QE 2 3 G H3' 5.610 . 6.110 5.090 5.029 5.175 . 0 0 "[ . 1 . 2]" 1
1754 1 78 TYR QE 2 3 G H8 3.930 . 4.430 3.182 2.136 3.615 . 0 0 "[ . 1 . 2]" 1
1755 1 80 PRO QG 2 3 G H1' 5.610 . 6.110 3.556 2.007 5.056 . 0 0 "[ . 1 . 2]" 1
1756 1 80 PRO HD3 2 3 G H1' 5.000 . 5.500 3.968 3.464 4.903 . 0 0 "[ . 1 . 2]" 1
1757 1 91 PHE QE 2 3 G H4' 5.050 . 5.550 3.931 2.375 4.601 . 0 0 "[ . 1 . 2]" 1
1758 1 91 PHE QE 2 3 G Q5' 6.930 . 7.430 3.550 1.970 4.862 . 0 0 "[ . 1 . 2]" 1
1759 1 93 PHE QE 2 3 G H1' 5.050 . 5.550 4.536 4.473 4.634 . 0 0 "[ . 1 . 2]" 1
1760 1 93 PHE QE 2 3 G H2' 6.170 . 6.670 5.617 5.551 5.692 . 0 0 "[ . 1 . 2]" 1
1761 1 93 PHE QE 2 3 G H8 5.050 . 5.550 3.421 3.147 3.763 . 0 0 "[ . 1 . 2]" 1
1762 1 95 ARG QB 2 3 G H8 6.170 . 6.670 5.647 5.439 5.773 . 0 0 "[ . 1 . 2]" 1
1763 1 95 ARG QD 2 3 G H8 5.610 . 6.110 4.980 4.731 5.049 . 0 0 "[ . 1 . 2]" 1
1764 1 129 PRO QG 2 3 G H1' 5.610 . 6.110 4.767 4.092 5.114 . 0 0 "[ . 1 . 2]" 1
1765 1 129 PRO QG 2 3 G H2' 5.610 . 6.110 2.523 1.978 2.889 . 0 0 "[ . 1 . 2]" 1
1766 1 129 PRO HD2 2 3 G H1' 5.500 . 6.000 5.444 5.105 5.611 . 0 0 "[ . 1 . 2]" 1
1767 1 129 PRO HD3 2 3 G H1' 5.500 . 6.000 4.704 4.034 5.351 . 0 0 "[ . 1 . 2]" 1
1768 1 129 PRO HD2 2 3 G H2' 5.500 . 6.000 3.289 2.788 3.860 . 0 0 "[ . 1 . 2]" 1
1769 1 129 PRO HD3 2 3 G H2' 5.500 . 6.000 2.341 1.974 3.183 . 0 0 "[ . 1 . 2]" 1
1770 1 51 LYS QD 2 3 G H1 6.170 . 6.670 5.394 4.976 5.613 . 0 0 "[ . 1 . 2]" 1
1771 1 124 ALA HA 2 3 G H1 5.500 . 6.000 5.521 5.271 5.632 . 0 0 "[ . 1 . 2]" 1
1772 1 124 ALA MB 2 3 G H1 5.400 . 5.900 3.426 3.224 3.781 . 0 0 "[ . 1 . 2]" 1
1773 1 126 TYR QB 2 3 G H1 5.610 . 6.110 2.971 2.134 4.381 . 0 0 "[ . 1 . 2]" 1
1774 1 126 TYR QD 2 3 G H1 5.050 . 5.550 4.324 4.065 4.545 . 0 0 "[ . 1 . 2]" 1
1775 1 80 PRO QG 2 4 A H8 5.610 . 6.110 4.667 3.510 5.106 . 0 0 "[ . 1 . 2]" 1
1776 1 82 ASP HA 2 4 A H2 4.500 . 5.000 4.089 2.826 4.683 . 0 0 "[ . 1 . 2]" 1
1777 1 82 ASP QB 2 4 A H2 5.610 . 6.110 4.882 3.554 5.125 . 0 0 "[ . 1 . 2]" 1
1778 1 83 ARG HB3 2 4 A H1' 5.000 . 5.500 2.655 1.800 4.193 0.000 6 0 "[ . 1 . 2]" 1
1779 1 83 ARG HB3 2 4 A H2 5.500 . 6.000 4.215 3.170 5.522 . 0 0 "[ . 1 . 2]" 1
1780 1 83 ARG HB3 2 4 A H8 5.000 . 5.500 5.113 4.963 5.350 . 0 0 "[ . 1 . 2]" 1
1781 1 83 ARG QD 2 4 A H1' 5.610 . 6.110 2.048 1.783 3.071 0.017 11 0 "[ . 1 . 2]" 1
1782 1 83 ARG QD 2 4 A H2 5.050 . 5.550 3.632 2.778 4.578 . 0 0 "[ . 1 . 2]" 1
1783 1 83 ARG QD 2 4 A H8 5.610 . 6.110 5.102 4.675 5.219 . 0 0 "[ . 1 . 2]" 1
1784 1 84 TYR QE 2 4 A H2 5.050 . 5.550 2.170 1.989 2.511 . 0 0 "[ . 1 . 2]" 1
1785 1 129 PRO QG 2 4 A H1' 6.170 . 6.670 5.572 5.357 5.746 . 0 0 "[ . 1 . 2]" 1
1786 1 129 PRO QG 2 4 A H8 5.050 . 5.550 4.524 3.885 4.672 . 0 0 "[ . 1 . 2]" 1
1787 1 132 SER QB 2 4 A H1' 5.050 . 5.550 3.494 2.177 4.596 . 0 0 "[ . 1 . 2]" 1
1788 1 132 SER QB 2 4 A H2 5.050 . 5.550 4.434 3.610 4.673 . 0 0 "[ . 1 . 2]" 1
1789 1 132 SER QB 2 4 A H8 5.610 . 6.110 4.726 3.122 5.195 . 0 0 "[ . 1 . 2]" 1
1790 1 133 HIS QB 2 4 A H1' 5.610 . 6.110 3.992 1.979 5.144 . 0 0 "[ . 1 . 2]" 1
1791 1 133 HIS QB 2 4 A H2 5.050 . 5.550 3.769 3.153 4.530 . 0 0 "[ . 1 . 2]" 1
1792 1 133 HIS QB 2 4 A H8 5.610 . 6.110 4.984 3.823 5.259 . 0 0 "[ . 1 . 2]" 1
1793 1 78 TYR QD 2 5 G H1' 5.610 . 6.110 4.869 3.969 5.119 . 0 0 "[ . 1 . 2]" 1
1794 1 78 TYR QE 2 5 G H1' 4.490 . 4.990 4.006 3.805 4.106 . 0 0 "[ . 1 . 2]" 1
1795 1 78 TYR QE 2 5 G H8 5.610 . 6.110 4.443 3.238 5.031 . 0 0 "[ . 1 . 2]" 1
1796 1 37 TYR HB2 2 5 G H1' 4.500 . 5.000 3.808 2.761 4.585 . 0 0 "[ . 1 . 2]" 1
1797 1 37 TYR HB3 2 5 G H1' 4.500 . 5.000 4.245 2.913 4.598 . 0 0 "[ . 1 . 2]" 1
1798 1 38 GLY QA 2 5 G H1' 5.050 . 5.550 4.053 2.055 4.706 . 0 0 "[ . 1 . 2]" 1
1799 1 39 ARG HA 2 5 G H1' 4.500 . 5.000 4.280 3.300 4.586 . 0 0 "[ . 1 . 2]" 1
1800 1 39 ARG QB 2 5 G H1' 5.610 . 6.110 4.814 4.073 5.181 . 0 0 "[ . 1 . 2]" 1
1801 1 40 PRO QD 2 5 G H1' 5.050 . 5.550 4.320 3.129 4.617 . 0 0 "[ . 1 . 2]" 1
1802 1 38 GLY QA 2 6 U H1' 5.610 . 6.110 4.289 2.504 5.052 . 0 0 "[ . 1 . 2]" 1
1803 1 38 GLY QA 2 6 U H2' 5.050 . 5.550 4.197 2.673 4.783 . 0 0 "[ . 1 . 2]" 1
1804 1 38 GLY QA 2 6 U H3' 5.050 . 5.550 3.802 2.805 4.655 . 0 0 "[ . 1 . 2]" 1
1805 1 38 GLY QA 2 6 U H6 6.170 . 6.670 4.427 2.111 5.630 . 0 0 "[ . 1 . 2]" 1
1806 1 39 ARG QG 2 6 U H1' 5.050 . 5.550 3.334 2.142 4.588 . 0 0 "[ . 1 . 2]" 1
1807 1 39 ARG QG 2 6 U H2' 5.050 . 5.550 4.128 2.089 4.692 . 0 0 "[ . 1 . 2]" 1
1808 1 39 ARG QG 2 6 U H3' 4.490 . 4.990 3.782 1.954 4.177 . 0 0 "[ . 1 . 2]" 1
1809 1 39 ARG QG 2 6 U H6 6.170 . 6.670 4.695 2.234 5.643 . 0 0 "[ . 1 . 2]" 1
1810 1 39 ARG QD 2 6 U H1' 4.490 . 4.990 2.856 1.775 4.177 0.025 1 0 "[ . 1 . 2]" 1
1811 1 39 ARG QD 2 6 U H2' 5.050 . 5.550 3.913 1.993 4.619 . 0 0 "[ . 1 . 2]" 1
1812 1 39 ARG QD 2 6 U H3' 4.490 . 4.990 3.786 2.092 4.157 . 0 0 "[ . 1 . 2]" 1
1813 1 39 ARG QD 2 6 U H6 5.610 . 6.110 4.502 2.325 5.064 . 0 0 "[ . 1 . 2]" 1
1814 1 44 VAL MG1 1 76 ASP QB 7.410 . 7.910 5.002 3.765 5.557 . 0 0 "[ . 1 . 2]" 1
1815 1 44 VAL MG1 1 95 ARG QD 6.740 . 7.240 2.768 2.093 3.736 . 0 0 "[ . 1 . 2]" 1
1816 1 37 TYR QE 1 74 VAL MG1 7.410 . 7.910 5.459 4.551 5.565 . 0 0 "[ . 1 . 2]" 1
1817 1 37 TYR QE 1 77 VAL MG2 6.740 . 7.240 4.401 2.675 5.031 . 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 66
_Distance_constraint_stats_list.Viol_count 28
_Distance_constraint_stats_list.Viol_total 137.056
_Distance_constraint_stats_list.Viol_max 0.796
_Distance_constraint_stats_list.Viol_rms 0.0486
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0052
_Distance_constraint_stats_list.Viol_average_violations_only 0.2447
_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 50 LEU 0.005 0.005 19 0 "[ . 1 . 2]"
1 51 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 ASP 6.800 0.796 14 3 "[ . 1* *+. 2]"
1 78 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 ARG 0.039 0.028 17 0 "[ . 1 . 2]"
1 96 PHE 0.005 0.005 19 0 "[ . 1 . 2]"
1 98 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 105 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 120 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 122 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 125 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 126 TYR 0.015 0.015 15 0 "[ . 1 . 2]"
2 2 G 0.000 0.000 . 0 "[ . 1 . 2]"
2 3 G 0.048 0.028 17 0 "[ . 1 . 2]"
2 5 G 6.794 0.796 14 3 "[ . 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 60 SER O 1 64 LEU H 2.400 . 2.900 1.978 1.900 2.097 . 0 0 "[ . 1 . 2]" 2
2 1 60 SER O 1 64 LEU N 3.400 2.400 3.900 2.958 2.886 3.070 . 0 0 "[ . 1 . 2]" 2
3 1 61 PRO O 1 65 ARG H 2.400 . 2.900 2.396 2.318 2.438 . 0 0 "[ . 1 . 2]" 2
4 1 61 PRO O 1 65 ARG N 3.400 2.400 3.900 3.075 3.001 3.139 . 0 0 "[ . 1 . 2]" 2
5 1 62 ASP O 1 66 ARG H 2.400 . 2.900 2.373 2.245 2.502 . 0 0 "[ . 1 . 2]" 2
6 1 62 ASP O 1 66 ARG N 3.400 2.400 3.900 3.372 3.247 3.498 . 0 0 "[ . 1 . 2]" 2
7 1 63 THR O 1 67 VAL H 2.400 . 2.900 2.070 1.868 2.244 . 0 0 "[ . 1 . 2]" 2
8 1 63 THR O 1 67 VAL N 3.400 2.400 3.900 2.904 2.774 3.023 . 0 0 "[ . 1 . 2]" 2
9 1 64 LEU O 1 68 PHE H 2.400 . 2.900 2.468 2.444 2.497 . 0 0 "[ . 1 . 2]" 2
10 1 64 LEU O 1 68 PHE N 3.400 2.400 3.900 3.320 3.294 3.356 . 0 0 "[ . 1 . 2]" 2
11 1 65 ARG O 1 69 GLU H 2.400 . 2.900 1.952 1.868 2.026 . 0 0 "[ . 1 . 2]" 2
12 1 65 ARG O 1 69 GLU N 3.400 2.400 3.900 2.760 2.711 2.848 . 0 0 "[ . 1 . 2]" 2
13 1 98 ASP O 1 102 ALA H 2.400 . 2.900 2.239 2.071 2.415 . 0 0 "[ . 1 . 2]" 2
14 1 98 ASP O 1 102 ALA N 3.400 2.400 3.900 2.989 2.834 3.165 . 0 0 "[ . 1 . 2]" 2
15 1 99 LYS O 1 103 GLU H 2.400 . 2.900 1.977 1.846 2.233 . 0 0 "[ . 1 . 2]" 2
16 1 99 LYS O 1 103 GLU N 3.400 2.400 3.900 2.965 2.843 3.204 . 0 0 "[ . 1 . 2]" 2
17 1 100 ARG O 1 104 ASP H 2.400 . 2.900 2.507 2.478 2.559 . 0 0 "[ . 1 . 2]" 2
18 1 100 ARG O 1 104 ASP N 3.400 2.400 3.900 3.343 3.280 3.416 . 0 0 "[ . 1 . 2]" 2
19 1 101 ASP O 1 105 ALA H 2.400 . 2.900 2.321 2.159 2.462 . 0 0 "[ . 1 . 2]" 2
20 1 101 ASP O 1 105 ALA N 3.400 2.400 3.900 3.262 3.122 3.428 . 0 0 "[ . 1 . 2]" 2
21 1 102 ALA O 1 106 MET H 2.400 . 2.900 2.395 2.141 2.499 . 0 0 "[ . 1 . 2]" 2
22 1 102 ALA O 1 106 MET N 3.400 2.400 3.900 3.297 3.071 3.396 . 0 0 "[ . 1 . 2]" 2
23 1 103 GLU O 1 107 ASP H 2.400 . 2.900 2.129 1.940 2.411 . 0 0 "[ . 1 . 2]" 2
24 1 103 GLU O 1 107 ASP N 3.400 2.400 3.900 3.040 2.839 3.325 . 0 0 "[ . 1 . 2]" 2
25 1 104 ASP O 1 108 ALA H 2.400 . 2.900 2.518 2.479 2.560 . 0 0 "[ . 1 . 2]" 2
26 1 104 ASP O 1 108 ALA N 3.400 2.400 3.900 2.882 2.849 2.912 . 0 0 "[ . 1 . 2]" 2
27 1 105 ALA O 1 109 MET H 2.400 . 2.900 2.427 2.405 2.450 . 0 0 "[ . 1 . 2]" 2
28 1 105 ALA O 1 109 MET N 3.400 2.400 3.900 3.060 3.003 3.107 . 0 0 "[ . 1 . 2]" 2
29 1 106 MET O 1 110 ASP H 2.400 . 2.900 2.403 2.306 2.448 . 0 0 "[ . 1 . 2]" 2
30 1 106 MET O 1 110 ASP N 3.400 2.400 3.900 3.310 3.204 3.363 . 0 0 "[ . 1 . 2]" 2
31 1 51 LYS H 1 122 GLN O 2.400 . 2.900 2.038 1.828 2.435 . 0 0 "[ . 1 . 2]" 2
32 1 51 LYS N 1 122 GLN O 3.400 2.400 3.900 2.955 2.760 3.405 . 0 0 "[ . 1 . 2]" 2
33 1 51 LYS O 1 122 GLN H 2.400 . 2.900 2.219 2.013 2.425 . 0 0 "[ . 1 . 2]" 2
34 1 51 LYS O 1 122 GLN N 3.400 2.400 3.900 3.145 2.948 3.353 . 0 0 "[ . 1 . 2]" 2
35 1 53 ASP H 1 120 ARG O 2.400 . 2.900 1.963 1.838 2.119 . 0 0 "[ . 1 . 2]" 2
36 1 53 ASP N 1 120 ARG O 3.400 2.400 3.900 2.866 2.754 3.026 . 0 0 "[ . 1 . 2]" 2
37 1 53 ASP O 1 120 ARG H 2.400 . 2.900 2.410 2.221 2.497 . 0 0 "[ . 1 . 2]" 2
38 1 53 ASP O 1 120 ARG N 3.400 2.400 3.900 3.230 3.083 3.409 . 0 0 "[ . 1 . 2]" 2
39 1 50 LEU H 1 96 PHE O 2.400 . 2.900 2.567 2.504 2.655 . 0 0 "[ . 1 . 2]" 2
40 1 50 LEU N 1 96 PHE O 3.400 2.400 3.900 3.401 3.286 3.518 . 0 0 "[ . 1 . 2]" 2
41 1 50 LEU O 1 96 PHE H 2.400 . 2.900 2.376 1.795 2.611 0.005 19 0 "[ . 1 . 2]" 2
42 1 50 LEU O 1 96 PHE N 3.400 2.400 3.900 3.245 2.690 3.494 . 0 0 "[ . 1 . 2]" 2
43 1 52 VAL H 1 94 VAL O 2.400 . 2.900 2.568 2.473 2.653 . 0 0 "[ . 1 . 2]" 2
44 1 52 VAL N 1 94 VAL O 3.400 2.400 3.900 3.399 3.290 3.503 . 0 0 "[ . 1 . 2]" 2
45 1 52 VAL O 1 94 VAL H 2.400 . 2.900 2.530 2.488 2.574 . 0 0 "[ . 1 . 2]" 2
46 1 52 VAL O 1 94 VAL N 3.400 2.400 3.900 3.453 3.425 3.488 . 0 0 "[ . 1 . 2]" 2
47 1 76 ASP O 1 95 ARG H 2.400 . 2.900 1.883 1.794 1.996 0.006 20 0 "[ . 1 . 2]" 2
48 1 76 ASP O 1 95 ARG N 3.400 2.400 3.900 2.806 2.699 2.952 . 0 0 "[ . 1 . 2]" 2
49 1 76 ASP H 1 95 ARG O 2.400 . 2.900 2.457 2.319 2.536 . 0 0 "[ . 1 . 2]" 2
50 1 76 ASP N 1 95 ARG O 3.400 2.400 3.900 3.395 3.252 3.479 . 0 0 "[ . 1 . 2]" 2
51 1 78 TYR O 1 93 PHE H 2.400 . 2.900 2.505 2.403 2.565 . 0 0 "[ . 1 . 2]" 2
52 1 78 TYR O 1 93 PHE N 3.400 2.400 3.900 2.956 2.810 3.147 . 0 0 "[ . 1 . 2]" 2
53 1 78 TYR H 1 93 PHE O 2.400 . 2.900 2.332 2.045 2.475 . 0 0 "[ . 1 . 2]" 2
54 1 78 TYR N 1 93 PHE O 3.400 2.400 3.900 3.207 3.018 3.418 . 0 0 "[ . 1 . 2]" 2
55 1 125 ARG H 2 2 G N7 2.400 . 2.900 2.354 2.096 2.498 . 0 0 "[ . 1 . 2]" 2
56 1 125 ARG N 2 2 G N7 3.400 2.400 3.900 3.277 2.984 3.465 . 0 0 "[ . 1 . 2]" 2
57 1 76 ASP OD1 2 5 G H1 2.400 . 2.900 2.611 1.820 3.371 0.471 15 0 "[ . 1 . 2]" 2
58 1 76 ASP OD1 2 5 G N1 3.400 2.400 3.900 3.358 2.741 3.968 0.068 15 0 "[ . 1 . 2]" 2
59 1 126 TYR O 2 3 G H1 2.400 . 2.900 2.102 1.785 2.471 0.015 15 0 "[ . 1 . 2]" 2
60 1 126 TYR O 2 3 G N1 3.400 2.400 3.900 3.016 2.768 3.341 . 0 0 "[ . 1 . 2]" 2
61 1 76 ASP OD2 2 5 G H21 2.400 . 2.900 2.902 1.997 3.696 0.796 14 3 "[ . 1* -+. 2]" 2
62 1 76 ASP OD2 2 5 G N2 3.400 2.400 3.900 3.619 2.863 4.406 0.506 14 1 "[ . 1 +. 2]" 2
63 1 95 ARG QH1 2 3 G N7 2.690 . 3.190 2.318 1.967 2.455 . 0 0 "[ . 1 . 2]" 2
64 1 95 ARG NH1 2 3 G N7 3.400 2.400 3.900 3.014 2.799 3.113 . 0 0 "[ . 1 . 2]" 2
65 1 95 ARG QH2 2 3 G O6 2.690 . 3.190 2.140 1.772 2.432 0.028 17 0 "[ . 1 . 2]" 2
66 1 95 ARG NH2 2 3 G O6 3.400 2.400 3.900 2.924 2.671 3.095 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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