NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
422778 |
2ett   |
6866 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ett
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 1251
_Distance_constraint_stats_list.Viol_count 1724
_Distance_constraint_stats_list.Viol_total 2230.313
_Distance_constraint_stats_list.Viol_max 0.350
_Distance_constraint_stats_list.Viol_rms 0.0218
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0045
_Distance_constraint_stats_list.Viol_average_violations_only 0.0647
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 7 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 LEU 0.929 0.115 20 0 "[ . 1 . 2]"
1 11 GLU 1.213 0.137 7 0 "[ . 1 . 2]"
1 12 VAL 4.809 0.244 7 0 "[ . 1 . 2]"
1 13 HIS 0.278 0.076 16 0 "[ . 1 . 2]"
1 14 ILE 1.926 0.130 5 0 "[ . 1 . 2]"
1 15 PRO 0.516 0.064 6 0 "[ . 1 . 2]"
1 16 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 VAL 3.812 0.247 20 0 "[ . 1 . 2]"
1 18 GLY 2.992 0.216 4 0 "[ . 1 . 2]"
1 19 PRO 2.353 0.188 5 0 "[ . 1 . 2]"
1 20 GLU 2.892 0.147 7 0 "[ . 1 . 2]"
1 21 ALA 1.025 0.164 7 0 "[ . 1 . 2]"
1 22 GLU 0.234 0.137 4 0 "[ . 1 . 2]"
1 23 GLY 0.406 0.076 15 0 "[ . 1 . 2]"
1 24 PRO 2.208 0.141 20 0 "[ . 1 . 2]"
1 25 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 GLN 0.033 0.033 12 0 "[ . 1 . 2]"
1 27 SER 1.153 0.124 18 0 "[ . 1 . 2]"
1 28 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 GLU 0.265 0.124 18 0 "[ . 1 . 2]"
1 30 LYS 1.815 0.176 20 0 "[ . 1 . 2]"
1 31 SER 0.406 0.139 5 0 "[ . 1 . 2]"
1 32 HIS 2.007 0.141 20 0 "[ . 1 . 2]"
1 33 MET 10.855 0.247 20 0 "[ . 1 . 2]"
1 34 VAL 5.387 0.186 7 0 "[ . 1 . 2]"
1 35 PHE 3.917 0.200 11 0 "[ . 1 . 2]"
1 36 ARG 2.864 0.216 4 0 "[ . 1 . 2]"
1 37 VAL 3.250 0.192 5 0 "[ . 1 . 2]"
1 38 GLU 1.845 0.106 16 0 "[ . 1 . 2]"
1 39 VAL 4.833 0.208 9 0 "[ . 1 . 2]"
1 40 LEU 2.103 0.137 9 0 "[ . 1 . 2]"
1 41 CYS 0.336 0.092 3 0 "[ . 1 . 2]"
1 42 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 GLY 0.403 0.093 17 0 "[ . 1 . 2]"
1 44 ARG 0.057 0.050 14 0 "[ . 1 . 2]"
1 45 ARG 1.149 0.137 9 0 "[ . 1 . 2]"
1 46 HIS 2.872 0.163 5 0 "[ . 1 . 2]"
1 47 THR 0.207 0.058 4 0 "[ . 1 . 2]"
1 48 VAL 2.889 0.167 18 0 "[ . 1 . 2]"
1 49 PRO 0.883 0.151 4 0 "[ . 1 . 2]"
1 50 ARG 1.709 0.115 17 0 "[ . 1 . 2]"
1 51 ARG 1.994 0.176 20 0 "[ . 1 . 2]"
1 52 TYR 2.672 0.136 5 0 "[ . 1 . 2]"
1 53 SER 0.293 0.083 12 0 "[ . 1 . 2]"
1 54 GLU 0.315 0.121 17 0 "[ . 1 . 2]"
1 55 PHE 3.282 0.234 15 0 "[ . 1 . 2]"
1 56 HIS 1.001 0.195 19 0 "[ . 1 . 2]"
1 57 ALA 1.749 0.156 18 0 "[ . 1 . 2]"
1 58 LEU 4.524 0.233 4 0 "[ . 1 . 2]"
1 59 HIS 2.659 0.252 15 0 "[ . 1 . 2]"
1 60 LYS 3.592 0.221 11 0 "[ . 1 . 2]"
1 61 ARG 0.955 0.120 17 0 "[ . 1 . 2]"
1 62 ILE 9.991 0.321 15 0 "[ . 1 . 2]"
1 63 LYS 0.540 0.136 19 0 "[ . 1 . 2]"
1 64 LYS 3.467 0.222 4 0 "[ . 1 . 2]"
1 65 LEU 1.058 0.087 2 0 "[ . 1 . 2]"
1 66 TYR 8.653 0.321 15 0 "[ . 1 . 2]"
1 67 LYS 2.363 0.131 13 0 "[ . 1 . 2]"
1 68 VAL 5.750 0.213 11 0 "[ . 1 . 2]"
1 69 PRO 1.033 0.092 16 0 "[ . 1 . 2]"
1 70 ASP 0.031 0.031 13 0 "[ . 1 . 2]"
1 71 PHE 0.721 0.113 11 0 "[ . 1 . 2]"
1 72 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 SER 0.477 0.116 2 0 "[ . 1 . 2]"
1 74 LYS 0.069 0.045 2 0 "[ . 1 . 2]"
1 75 ARG 0.032 0.025 17 0 "[ . 1 . 2]"
1 76 LEU 1.051 0.142 14 0 "[ . 1 . 2]"
1 77 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 TRP 4.309 0.239 18 0 "[ . 1 . 2]"
1 80 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 ARG 0.064 0.047 1 0 "[ . 1 . 2]"
1 83 GLY 0.624 0.264 18 0 "[ . 1 . 2]"
1 84 LEU 2.994 0.264 18 0 "[ . 1 . 2]"
1 85 GLU 0.113 0.096 13 0 "[ . 1 . 2]"
1 86 GLN 0.079 0.029 13 0 "[ . 1 . 2]"
1 87 ARG 3.440 0.322 14 0 "[ . 1 . 2]"
1 88 ARG 2.183 0.200 11 0 "[ . 1 . 2]"
1 89 GLN 1.220 0.322 14 0 "[ . 1 . 2]"
1 90 GLY 0.904 0.094 16 0 "[ . 1 . 2]"
1 91 LEU 1.153 0.089 13 0 "[ . 1 . 2]"
1 92 GLU 0.225 0.071 14 0 "[ . 1 . 2]"
1 93 ALA 0.580 0.071 14 0 "[ . 1 . 2]"
1 94 TYR 2.548 0.134 11 0 "[ . 1 . 2]"
1 95 ILE 6.459 0.234 15 0 "[ . 1 . 2]"
1 96 GLN 0.580 0.151 10 0 "[ . 1 . 2]"
1 97 GLY 0.463 0.067 17 0 "[ . 1 . 2]"
1 98 ILE 5.168 0.257 20 0 "[ . 1 . 2]"
1 99 LEU 3.285 0.244 7 0 "[ . 1 . 2]"
1 100 TYR 0.557 0.151 10 0 "[ . 1 . 2]"
1 101 LEU 3.241 0.239 18 0 "[ . 1 . 2]"
1 102 ASN 0.769 0.148 13 0 "[ . 1 . 2]"
1 103 GLN 3.434 0.257 20 0 "[ . 1 . 2]"
1 104 GLU 3.507 0.239 18 0 "[ . 1 . 2]"
1 105 VAL 2.321 0.147 4 0 "[ . 1 . 2]"
1 106 PRO 0.941 0.144 14 0 "[ . 1 . 2]"
1 107 LYS 0.795 0.117 4 0 "[ . 1 . 2]"
1 108 GLU 2.419 0.241 7 0 "[ . 1 . 2]"
1 109 LEU 5.417 0.350 19 0 "[ . 1 . 2]"
1 110 LEU 2.838 0.121 8 0 "[ . 1 . 2]"
1 111 GLU 0.059 0.047 18 0 "[ . 1 . 2]"
1 112 PHE 6.947 0.350 19 0 "[ . 1 . 2]"
1 113 LEU 4.407 0.196 15 0 "[ . 1 . 2]"
1 114 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 115 LEU 8.812 0.300 8 0 "[ . 1 . 2]"
1 116 ARG 0.045 0.043 8 0 "[ . 1 . 2]"
1 117 HIS 0.398 0.108 4 0 "[ . 1 . 2]"
1 118 PHE 1.372 0.121 17 0 "[ . 1 . 2]"
1 119 PRO 0.022 0.022 11 0 "[ . 1 . 2]"
1 120 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 121 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 122 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 123 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 124 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 125 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 126 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 127 TRP 0.241 0.106 2 0 "[ . 1 . 2]"
1 128 GLY 0.241 0.106 2 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 55 PHE QE 1 91 LEU MD1 0.000 . 4.950 3.200 2.380 4.605 . 0 0 "[ . 1 . 2]" 1
2 1 52 TYR QD 1 91 LEU MD2 0.000 . 5.260 3.396 2.032 4.738 . 0 0 "[ . 1 . 2]" 1
3 1 96 GLN HG2 1 97 GLY H 0.000 . 5.570 4.120 2.987 4.954 . 0 0 "[ . 1 . 2]" 1
4 1 84 LEU HA 1 84 LEU MD1 0.000 . 4.660 2.139 1.809 2.930 . 0 0 "[ . 1 . 2]" 1
5 1 18 GLY HA3 1 19 PRO HD2 0.000 . 5.030 2.933 2.562 3.627 . 0 0 "[ . 1 . 2]" 1
6 1 18 GLY HA3 1 19 PRO HD3 0.000 . 3.940 3.295 2.883 3.676 . 0 0 "[ . 1 . 2]" 1
7 1 58 LEU HG 1 95 ILE MD 0.000 . 5.430 4.981 3.694 5.591 0.161 17 0 "[ . 1 . 2]" 1
8 1 37 VAL MG1 1 95 ILE MD 0.000 . 4.940 2.871 1.874 4.960 0.020 16 0 "[ . 1 . 2]" 1
9 1 55 PHE QE 1 95 ILE MD 0.000 . 5.650 2.669 1.916 3.364 . 0 0 "[ . 1 . 2]" 1
10 1 14 ILE MD 1 91 LEU MD1 0.000 . 5.800 4.286 3.634 4.908 . 0 0 "[ . 1 . 2]" 1
11 1 14 ILE MD 1 91 LEU HB3 0.000 . 5.460 2.762 2.134 3.451 . 0 0 "[ . 1 . 2]" 1
12 1 14 ILE MD 1 35 PHE HB2 0.000 . 5.720 2.875 2.406 4.486 . 0 0 "[ . 1 . 2]" 1
13 1 14 ILE MD 1 92 GLU HA 0.000 . 4.890 2.838 2.426 4.342 . 0 0 "[ . 1 . 2]" 1
14 1 14 ILE MD 1 35 PHE QE 0.000 . 5.210 3.556 3.128 4.101 . 0 0 "[ . 1 . 2]" 1
15 1 62 ILE MD 1 66 TYR HB3 0.000 . 5.310 5.508 5.349 5.631 0.321 15 0 "[ . 1 . 2]" 1
16 1 58 LEU HB3 1 62 ILE MD 0.000 . 5.240 4.841 4.143 5.311 0.071 14 0 "[ . 1 . 2]" 1
17 1 58 LEU HA 1 62 ILE MD 0.000 . 5.800 4.755 4.215 5.190 . 0 0 "[ . 1 . 2]" 1
18 1 59 HIS HA 1 62 ILE MD 0.000 . 5.460 2.569 1.960 3.049 . 0 0 "[ . 1 . 2]" 1
19 1 95 ILE HA 1 98 ILE MD 0.000 . 4.880 2.341 2.014 2.677 . 0 0 "[ . 1 . 2]" 1
20 1 94 TYR HB3 1 98 ILE MD 0.000 . 5.540 4.314 2.295 5.509 . 0 0 "[ . 1 . 2]" 1
21 1 58 LEU MD2 1 98 ILE MD 0.000 . 5.350 4.093 3.233 5.050 . 0 0 "[ . 1 . 2]" 1
22 1 33 MET HA 1 33 MET ME 0.000 . 5.400 3.599 1.879 4.559 . 0 0 "[ . 1 . 2]" 1
23 1 18 GLY HA3 1 33 MET ME 0.000 . 4.950 4.890 4.139 5.122 0.172 6 0 "[ . 1 . 2]" 1
24 1 94 TYR HB2 1 98 ILE MG 0.000 . 5.750 5.587 4.670 5.884 0.134 11 0 "[ . 1 . 2]" 1
25 1 59 HIS HA 1 62 ILE MG 0.000 . 5.750 4.320 3.915 4.787 . 0 0 "[ . 1 . 2]" 1
26 1 61 ARG HA 1 62 ILE MG 0.000 . 5.510 4.875 4.456 5.061 . 0 0 "[ . 1 . 2]" 1
27 1 92 GLU HA 1 95 ILE MG 0.000 . 5.420 4.326 2.240 5.294 . 0 0 "[ . 1 . 2]" 1
28 1 58 LEU HG 1 62 ILE MG 0.000 . 4.470 4.196 3.211 4.619 0.149 14 0 "[ . 1 . 2]" 1
29 1 58 LEU MD1 1 62 ILE MG 0.000 . 4.530 2.935 2.250 3.692 . 0 0 "[ . 1 . 2]" 1
30 1 62 ILE H 1 62 ILE MG 0.000 . 4.770 2.526 2.256 2.930 . 0 0 "[ . 1 . 2]" 1
31 1 62 ILE MG 1 66 TYR QD 0.000 . 4.940 2.968 2.723 3.476 . 0 0 "[ . 1 . 2]" 1
32 1 62 ILE MG 1 66 TYR QE 0.000 . 5.160 2.244 1.953 3.141 . 0 0 "[ . 1 . 2]" 1
33 1 95 ILE MG 1 96 GLN H 0.000 . 5.640 3.483 2.526 3.918 . 0 0 "[ . 1 . 2]" 1
34 1 95 ILE MD 1 95 ILE MG 0.000 . 3.530 1.965 1.806 2.031 . 0 0 "[ . 1 . 2]" 1
35 1 95 ILE MG 1 99 LEU MD1 0.000 . 4.540 3.794 1.774 4.750 0.210 19 0 "[ . 1 . 2]" 1
36 1 94 TYR HB3 1 98 ILE MG 0.000 . 5.800 4.605 3.684 5.685 . 0 0 "[ . 1 . 2]" 1
37 1 94 TYR HA 1 98 ILE MG 0.000 . 5.800 4.601 3.444 5.884 0.084 11 0 "[ . 1 . 2]" 1
38 1 14 ILE MG 1 35 PHE QE 0.000 . 4.660 4.688 4.218 4.789 0.129 11 0 "[ . 1 . 2]" 1
39 1 14 ILE MG 1 35 PHE QD 0.000 . 5.570 3.163 2.768 3.397 . 0 0 "[ . 1 . 2]" 1
40 1 68 VAL H 1 68 VAL MG1 0.000 . 4.050 3.779 2.326 4.002 . 0 0 "[ . 1 . 2]" 1
41 1 17 VAL H 1 17 VAL MG2 0.000 . 4.340 2.745 2.404 2.913 . 0 0 "[ . 1 . 2]" 1
42 1 14 ILE MG 1 35 PHE HA 0.000 . 5.300 3.615 3.354 3.931 . 0 0 "[ . 1 . 2]" 1
43 1 14 ILE MG 1 37 VAL HA 0.000 . 5.680 3.060 2.299 3.469 . 0 0 "[ . 1 . 2]" 1
44 1 17 VAL MG2 1 35 PHE HA 0.000 . 5.390 2.792 2.436 3.243 . 0 0 "[ . 1 . 2]" 1
45 1 14 ILE MG 1 35 PHE HB2 0.000 . 4.770 1.995 1.840 2.191 . 0 0 "[ . 1 . 2]" 1
46 1 17 VAL MG2 1 33 MET ME 0.000 . 4.790 4.004 3.055 4.885 0.095 16 0 "[ . 1 . 2]" 1
47 1 17 VAL MG2 1 35 PHE HB3 0.000 . 5.800 2.009 1.809 2.271 . 0 0 "[ . 1 . 2]" 1
48 1 17 VAL MG2 1 35 PHE QD 0.000 . 5.490 3.460 2.802 3.852 . 0 0 "[ . 1 . 2]" 1
49 1 17 VAL MG2 1 35 PHE QE 0.000 . 5.520 5.172 4.661 5.509 . 0 0 "[ . 1 . 2]" 1
50 1 34 VAL H 1 34 VAL MG1 0.000 . 4.510 2.264 2.027 3.005 . 0 0 "[ . 1 . 2]" 1
51 1 17 VAL H 1 17 VAL MG1 0.000 . 4.640 3.917 3.857 3.994 . 0 0 "[ . 1 . 2]" 1
52 1 17 VAL MG1 1 35 PHE QE 0.000 . 5.570 4.849 4.316 5.221 . 0 0 "[ . 1 . 2]" 1
53 1 17 VAL MG1 1 35 PHE QD 0.000 . 5.760 2.991 2.486 3.385 . 0 0 "[ . 1 . 2]" 1
54 1 17 VAL MG1 1 35 PHE HA 0.000 . 5.270 2.328 1.899 2.753 . 0 0 "[ . 1 . 2]" 1
55 1 46 HIS QB 1 48 VAL MG2 0.000 . 4.840 2.726 1.927 3.746 . 0 0 "[ . 1 . 2]" 1
56 1 17 VAL MG1 1 33 MET ME 0.000 . 5.030 2.102 1.807 2.684 . 0 0 "[ . 1 . 2]" 1
57 1 91 LEU HA 1 91 LEU MD1 0.000 . 4.650 2.051 1.990 2.140 . 0 0 "[ . 1 . 2]" 1
58 1 55 PHE QD 1 91 LEU MD1 0.000 . 5.480 2.561 2.020 3.285 . 0 0 "[ . 1 . 2]" 1
59 1 52 TYR QD 1 91 LEU MD1 0.000 . 5.220 3.993 2.756 5.250 0.030 14 0 "[ . 1 . 2]" 1
60 1 47 THR MG 1 48 VAL H 0.000 . 4.620 3.329 3.028 4.119 . 0 0 "[ . 1 . 2]" 1
61 1 35 PHE QE 1 91 LEU MD1 0.000 . 5.620 3.433 2.931 4.074 . 0 0 "[ . 1 . 2]" 1
62 1 35 PHE QD 1 37 VAL MG1 0.000 . 4.870 1.958 1.791 2.067 . 0 0 "[ . 1 . 2]" 1
63 1 120 THR HA 1 120 THR MG 0.000 . 3.700 2.739 2.239 3.252 . 0 0 "[ . 1 . 2]" 1
64 1 38 GLU HA 1 47 THR MG 0.000 . 5.200 3.620 2.841 4.015 . 0 0 "[ . 1 . 2]" 1
65 1 36 ARG HA 1 47 THR MG 0.000 . 5.350 3.879 3.201 5.222 . 0 0 "[ . 1 . 2]" 1
66 1 52 TYR HB2 1 91 LEU MD1 0.000 . 5.660 4.848 2.190 5.723 0.063 19 0 "[ . 1 . 2]" 1
67 1 56 HIS HD2 1 91 LEU MD1 0.000 . 5.700 5.275 4.161 5.780 0.080 18 0 "[ . 1 . 2]" 1
68 1 37 VAL MG2 1 38 GLU H 0.000 . 4.930 4.016 3.331 4.233 . 0 0 "[ . 1 . 2]" 1
69 1 12 VAL MG1 1 39 VAL HA 0.000 . 4.150 2.207 1.941 2.487 . 0 0 "[ . 1 . 2]" 1
70 1 37 VAL MG2 1 55 PHE QE 0.000 . 5.550 5.039 2.948 5.662 0.112 19 0 "[ . 1 . 2]" 1
71 1 101 LEU H 1 101 LEU MD2 0.000 . 4.800 3.529 3.282 3.745 . 0 0 "[ . 1 . 2]" 1
72 1 39 VAL H 1 39 VAL MG1 0.000 . 4.500 3.810 3.721 3.879 . 0 0 "[ . 1 . 2]" 1
73 1 107 LYS HA 1 110 LEU MD1 0.000 . 4.270 3.025 1.871 4.237 . 0 0 "[ . 1 . 2]" 1
74 1 58 LEU HA 1 58 LEU MD1 0.000 . 4.280 2.863 2.252 4.053 . 0 0 "[ . 1 . 2]" 1
75 1 40 LEU HA 1 40 LEU MD2 0.000 . 4.590 2.876 2.311 3.183 . 0 0 "[ . 1 . 2]" 1
76 1 40 LEU MD2 1 43 GLY HA3 0.000 . 5.020 3.774 3.523 4.182 . 0 0 "[ . 1 . 2]" 1
77 1 40 LEU MD2 1 45 ARG HA 0.000 . 5.350 4.169 3.414 4.789 . 0 0 "[ . 1 . 2]" 1
78 1 58 LEU MD1 1 112 PHE QD 0.000 . 5.800 4.318 2.571 5.801 0.001 17 0 "[ . 1 . 2]" 1
79 1 58 LEU H 1 58 LEU MD1 0.000 . 5.410 4.209 4.081 4.313 . 0 0 "[ . 1 . 2]" 1
80 1 40 LEU MD2 1 41 CYS H 0.000 . 4.630 2.680 2.358 3.367 . 0 0 "[ . 1 . 2]" 1
81 1 40 LEU MD2 1 45 ARG H 0.000 . 5.410 4.755 3.911 5.372 . 0 0 "[ . 1 . 2]" 1
82 1 11 GLU QB 1 40 LEU MD2 0.000 . 4.930 3.600 2.826 4.464 . 0 0 "[ . 1 . 2]" 1
83 1 58 LEU MD2 1 95 ILE MD 0.000 . 4.330 3.443 1.967 4.488 0.158 7 0 "[ . 1 . 2]" 1
84 1 10 LEU HA 1 10 LEU MD2 0.000 . 4.590 2.582 2.072 3.790 . 0 0 "[ . 1 . 2]" 1
85 1 35 PHE QE 1 91 LEU MD2 0.000 . 5.620 3.285 2.476 4.040 . 0 0 "[ . 1 . 2]" 1
86 1 35 PHE QD 1 91 LEU MD2 0.000 . 5.720 4.123 3.494 4.808 . 0 0 "[ . 1 . 2]" 1
87 1 11 GLU HA 1 40 LEU MD1 0.000 . 5.280 4.820 4.417 5.400 0.120 13 0 "[ . 1 . 2]" 1
88 1 113 LEU H 1 113 LEU MD1 0.000 . 5.200 2.684 1.839 3.862 . 0 0 "[ . 1 . 2]" 1
89 1 110 LEU HA 1 110 LEU MD2 0.000 . 4.540 3.204 2.121 3.914 . 0 0 "[ . 1 . 2]" 1
90 1 110 LEU HA 1 113 LEU MD1 0.000 . 5.050 4.497 3.880 5.095 0.045 2 0 "[ . 1 . 2]" 1
91 1 11 GLU H 1 40 LEU HG 0.000 . 5.670 4.763 3.738 5.245 . 0 0 "[ . 1 . 2]" 1
92 1 69 PRO HB2 1 70 ASP H 0.000 . 5.280 2.271 1.808 3.925 . 0 0 "[ . 1 . 2]" 1
93 1 17 VAL HB 1 35 PHE HA 0.000 . 5.800 4.450 4.215 4.625 . 0 0 "[ . 1 . 2]" 1
94 1 11 GLU HG3 1 40 LEU MD1 0.000 . 5.650 2.751 2.127 3.126 . 0 0 "[ . 1 . 2]" 1
95 1 91 LEU HA 1 94 TYR HB2 0.000 . 5.800 3.148 2.706 4.003 . 0 0 "[ . 1 . 2]" 1
96 1 113 LEU QB 1 115 LEU MD2 0.000 . 4.930 1.956 1.816 2.440 . 0 0 "[ . 1 . 2]" 1
97 1 60 LYS HB2 1 60 LYS HE2 0.000 . 5.460 2.760 1.833 3.908 . 0 0 "[ . 1 . 2]" 1
98 1 11 GLU QB 1 40 LEU HB2 0.000 . 5.240 3.018 2.610 4.818 . 0 0 "[ . 1 . 2]" 1
99 1 23 GLY HA3 1 24 PRO HD2 0.000 . 4.290 3.690 2.886 3.994 . 0 0 "[ . 1 . 2]" 1
100 1 65 LEU HB2 1 66 TYR QD 0.000 . 5.800 4.202 2.904 5.221 . 0 0 "[ . 1 . 2]" 1
101 1 65 LEU HB3 1 66 TYR QD 0.000 . 5.800 3.022 2.497 4.372 . 0 0 "[ . 1 . 2]" 1
102 1 14 ILE HA 1 15 PRO HD3 0.000 . 5.720 2.451 2.005 2.747 . 0 0 "[ . 1 . 2]" 1
103 1 12 VAL MG2 1 104 GLU HA 0.000 . 5.760 5.299 4.693 5.755 . 0 0 "[ . 1 . 2]" 1
104 1 40 LEU HB2 1 45 ARG HA 0.000 . 5.270 3.821 3.144 4.704 . 0 0 "[ . 1 . 2]" 1
105 1 40 LEU HA 1 45 ARG HA 0.000 . 5.200 2.023 1.773 2.615 . 0 0 "[ . 1 . 2]" 1
106 1 57 ALA HA 1 60 LYS HB2 0.000 . 4.900 4.151 2.559 5.040 0.140 2 0 "[ . 1 . 2]" 1
107 1 123 LYS HA 1 123 LYS HG2 0.000 . 4.490 3.080 2.523 4.304 . 0 0 "[ . 1 . 2]" 1
108 1 30 LYS HA 1 30 LYS HD2 0.000 . 4.420 3.982 2.170 4.532 0.112 16 0 "[ . 1 . 2]" 1
109 1 30 LYS HA 1 31 SER H 0.000 . 4.460 2.535 1.997 3.509 . 0 0 "[ . 1 . 2]" 1
110 1 36 ARG HA 1 37 VAL H 0.000 . 4.450 2.129 1.906 2.308 . 0 0 "[ . 1 . 2]" 1
111 1 91 LEU HA 1 94 TYR H 0.000 . 4.730 3.297 3.098 3.545 . 0 0 "[ . 1 . 2]" 1
112 1 17 VAL HA 1 35 PHE HA 0.000 . 5.550 2.031 1.903 2.351 . 0 0 "[ . 1 . 2]" 1
113 1 58 LEU HA 1 62 ILE MG 0.000 . 4.700 4.191 3.726 4.516 . 0 0 "[ . 1 . 2]" 1
114 1 58 LEU HA 1 61 ARG QB 0.000 . 4.880 2.958 2.315 3.695 . 0 0 "[ . 1 . 2]" 1
115 1 110 LEU HA 1 110 LEU MD1 0.000 . 4.610 2.757 2.100 3.026 . 0 0 "[ . 1 . 2]" 1
116 1 56 HIS HA 1 59 HIS QB 0.000 . 5.630 2.829 1.891 4.239 . 0 0 "[ . 1 . 2]" 1
117 1 14 ILE HA 1 15 PRO HD2 0.000 . 5.200 2.204 1.979 2.599 . 0 0 "[ . 1 . 2]" 1
118 1 89 GLN HA 1 92 GLU H 0.000 . 5.120 3.634 3.078 4.084 . 0 0 "[ . 1 . 2]" 1
119 1 107 LYS HA 1 110 LEU MD2 0.000 . 4.650 3.298 2.276 4.029 . 0 0 "[ . 1 . 2]" 1
120 1 107 LYS HA 1 110 LEU HB3 0.000 . 5.330 3.587 2.207 4.896 . 0 0 "[ . 1 . 2]" 1
121 1 108 GLU HA 1 111 GLU QB 0.000 . 4.920 2.644 2.017 3.316 . 0 0 "[ . 1 . 2]" 1
122 1 47 THR HA 1 48 VAL MG2 0.000 . 5.490 3.626 3.389 3.838 . 0 0 "[ . 1 . 2]" 1
123 1 33 MET ME 1 34 VAL HA 0.000 . 5.240 5.258 4.925 5.392 0.152 14 0 "[ . 1 . 2]" 1
124 1 12 VAL HA 1 39 VAL HA 0.000 . 5.350 2.456 2.269 2.775 . 0 0 "[ . 1 . 2]" 1
125 1 38 GLU HA 1 47 THR HA 0.000 . 5.300 2.240 1.818 2.779 . 0 0 "[ . 1 . 2]" 1
126 1 34 VAL MG1 1 49 PRO HA 0.000 . 5.190 4.534 3.538 5.078 . 0 0 "[ . 1 . 2]" 1
127 1 36 ARG HA 1 49 PRO HA 0.000 . 4.880 2.037 1.802 2.466 . 0 0 "[ . 1 . 2]" 1
128 1 95 ILE HA 1 98 ILE MG 0.000 . 4.840 4.005 3.561 4.512 . 0 0 "[ . 1 . 2]" 1
129 1 105 VAL MG2 1 106 PRO HA 0.000 . 5.520 4.427 4.230 4.561 . 0 0 "[ . 1 . 2]" 1
130 1 95 ILE HA 1 98 ILE HB 0.000 . 5.700 4.790 2.613 5.443 . 0 0 "[ . 1 . 2]" 1
131 1 62 ILE HA 1 65 LEU HB2 0.000 . 5.700 2.301 1.946 2.928 . 0 0 "[ . 1 . 2]" 1
132 1 101 LEU HA 1 101 LEU MD2 0.000 . 3.730 2.012 1.923 2.102 . 0 0 "[ . 1 . 2]" 1
133 1 10 LEU MD2 1 41 CYS HB3 0.000 . 5.050 3.913 2.533 5.142 0.092 3 0 "[ . 1 . 2]" 1
134 1 10 LEU MD2 1 41 CYS HB2 0.000 . 5.760 3.658 2.393 5.783 0.023 18 0 "[ . 1 . 2]" 1
135 1 34 VAL HA 1 51 ARG HA 0.000 . 5.460 2.506 2.157 3.083 . 0 0 "[ . 1 . 2]" 1
136 1 14 ILE HA 1 37 VAL HA 0.000 . 5.680 2.507 2.016 2.836 . 0 0 "[ . 1 . 2]" 1
137 1 72 PRO HG2 1 91 LEU MD1 0.000 . 4.800 2.791 1.848 3.869 . 0 0 "[ . 1 . 2]" 1
138 1 14 ILE MD 1 35 PHE QD 0.000 . 5.290 2.954 2.125 3.780 . 0 0 "[ . 1 . 2]" 1
139 1 10 LEU MD2 1 41 CYS HA 0.000 . 5.800 2.668 1.877 4.564 . 0 0 "[ . 1 . 2]" 1
140 1 68 VAL HA 1 69 PRO HA 0.000 . 5.620 4.521 4.426 4.580 . 0 0 "[ . 1 . 2]" 1
141 1 58 LEU MD1 1 108 GLU HA 0.000 . 5.800 5.158 4.570 5.881 0.081 14 0 "[ . 1 . 2]" 1
142 1 47 THR HA 1 48 VAL H 0.000 . 4.620 2.196 2.087 2.303 . 0 0 "[ . 1 . 2]" 1
143 1 37 VAL H 1 37 VAL MG1 0.000 . 4.700 2.461 2.217 2.867 . 0 0 "[ . 1 . 2]" 1
144 1 37 VAL MG1 1 55 PHE QE 0.000 . 5.680 4.336 1.909 5.350 . 0 0 "[ . 1 . 2]" 1
145 1 35 PHE QE 1 51 ARG HA 0.000 . 5.800 4.574 3.205 5.480 . 0 0 "[ . 1 . 2]" 1
146 1 34 VAL MG2 1 51 ARG HA 0.000 . 5.800 3.228 2.220 5.008 . 0 0 "[ . 1 . 2]" 1
147 1 20 GLU HA 1 34 VAL MG1 0.000 . 4.470 3.946 2.364 4.612 0.142 4 0 "[ . 1 . 2]" 1
148 1 95 ILE MD 1 98 ILE MD 0.000 . 4.260 3.174 2.238 4.314 0.054 3 0 "[ . 1 . 2]" 1
149 1 98 ILE HA 1 98 ILE MD 0.000 . 4.640 4.153 3.810 4.211 . 0 0 "[ . 1 . 2]" 1
150 1 95 ILE MD 1 96 GLN H 0.000 . 5.800 4.792 4.416 5.128 . 0 0 "[ . 1 . 2]" 1
151 1 14 ILE H 1 14 ILE MD 0.000 . 5.800 3.840 2.383 4.029 . 0 0 "[ . 1 . 2]" 1
152 1 14 ILE MD 1 93 ALA H 0.000 . 5.800 4.840 4.525 5.820 0.020 9 0 "[ . 1 . 2]" 1
153 1 91 LEU MD1 1 94 TYR H 0.000 . 5.800 4.720 4.427 4.970 . 0 0 "[ . 1 . 2]" 1
154 1 19 PRO HB3 1 33 MET ME 0.000 . 4.200 4.072 2.668 4.388 0.188 5 0 "[ . 1 . 2]" 1
155 1 20 GLU H 1 33 MET ME 0.000 . 5.790 5.454 3.635 5.911 0.121 6 0 "[ . 1 . 2]" 1
156 1 33 MET H 1 33 MET ME 0.000 . 5.470 4.907 3.943 5.623 0.153 10 0 "[ . 1 . 2]" 1
157 1 18 GLY H 1 33 MET ME 0.000 . 5.440 4.106 3.517 4.653 . 0 0 "[ . 1 . 2]" 1
158 1 55 PHE QE 1 91 LEU MD2 0.000 . 5.800 5.247 4.559 5.889 0.089 13 0 "[ . 1 . 2]" 1
159 1 86 GLN HG2 1 87 ARG H 0.000 . 5.540 4.567 3.512 5.211 . 0 0 "[ . 1 . 2]" 1
160 1 55 PHE QD 1 95 ILE MD 0.000 . 5.640 2.647 2.056 2.987 . 0 0 "[ . 1 . 2]" 1
161 1 14 ILE MD 1 37 VAL HA 0.000 . 5.800 3.829 3.091 4.320 . 0 0 "[ . 1 . 2]" 1
162 1 14 ILE MD 1 35 PHE HB3 0.000 . 5.800 3.926 3.182 5.597 . 0 0 "[ . 1 . 2]" 1
163 1 14 ILE MD 1 37 VAL HB 0.000 . 5.800 4.076 3.071 4.743 . 0 0 "[ . 1 . 2]" 1
164 1 14 ILE MD 1 91 LEU H 0.000 . 5.800 4.037 3.440 5.644 . 0 0 "[ . 1 . 2]" 1
165 1 14 ILE MD 1 37 VAL MG2 0.000 . 4.700 4.518 4.124 4.730 0.030 7 0 "[ . 1 . 2]" 1
166 1 58 LEU MD1 1 62 ILE MD 0.000 . 3.690 2.677 2.014 3.301 . 0 0 "[ . 1 . 2]" 1
167 1 62 ILE MD 1 68 VAL MG1 0.000 . 4.680 3.055 2.142 3.845 . 0 0 "[ . 1 . 2]" 1
168 1 62 ILE MD 1 66 TYR QE 0.000 . 5.800 2.085 1.830 2.667 . 0 0 "[ . 1 . 2]" 1
169 1 62 ILE MD 1 66 TYR QD 0.000 . 5.620 3.659 3.502 3.873 . 0 0 "[ . 1 . 2]" 1
170 1 59 HIS H 1 62 ILE MD 0.000 . 5.800 4.437 3.792 4.838 . 0 0 "[ . 1 . 2]" 1
171 1 95 ILE HB 1 98 ILE MD 0.000 . 5.520 4.708 3.288 5.239 . 0 0 "[ . 1 . 2]" 1
172 1 96 GLN H 1 98 ILE MD 0.000 . 5.800 5.320 4.962 5.574 . 0 0 "[ . 1 . 2]" 1
173 1 68 VAL MG1 1 98 ILE MG 0.000 . 4.850 2.161 1.826 3.973 . 0 0 "[ . 1 . 2]" 1
174 1 98 ILE MG 1 102 ASN H 0.000 . 5.800 5.230 4.726 5.660 . 0 0 "[ . 1 . 2]" 1
175 1 98 ILE MG 1 103 GLN H 0.000 . 5.340 5.404 4.877 5.597 0.257 20 0 "[ . 1 . 2]" 1
176 1 14 ILE MG 1 36 ARG H 0.000 . 5.340 2.692 2.407 3.133 . 0 0 "[ . 1 . 2]" 1
177 1 17 VAL MG2 1 36 ARG H 0.000 . 5.800 3.345 2.930 4.056 . 0 0 "[ . 1 . 2]" 1
178 1 101 LEU MD1 1 103 GLN H 0.000 . 5.800 5.373 4.454 5.820 0.020 6 0 "[ . 1 . 2]" 1
179 1 18 GLY H 1 34 VAL MG1 0.000 . 5.310 3.364 2.739 5.108 . 0 0 "[ . 1 . 2]" 1
180 1 118 PHE HB2 1 119 PRO HD2 0.000 . 5.210 4.401 3.645 5.232 0.022 11 0 "[ . 1 . 2]" 1
181 1 118 PHE HB2 1 119 PRO HD3 0.000 . 5.420 4.701 4.130 5.095 . 0 0 "[ . 1 . 2]" 1
182 1 118 PHE HB3 1 119 PRO HD3 0.000 . 5.490 4.200 2.789 5.010 . 0 0 "[ . 1 . 2]" 1
183 1 119 PRO HB2 1 119 PRO HD3 0.000 . 4.300 3.952 3.852 4.101 . 0 0 "[ . 1 . 2]" 1
184 1 118 PHE HA 1 119 PRO HD2 0.000 . 4.480 2.503 2.021 3.188 . 0 0 "[ . 1 . 2]" 1
185 1 52 TYR HA 1 55 PHE QD 0.000 . 5.240 4.504 3.825 5.204 . 0 0 "[ . 1 . 2]" 1
186 1 122 PRO HA 1 122 PRO HD2 0.000 . 4.660 4.015 3.874 4.101 . 0 0 "[ . 1 . 2]" 1
187 1 52 TYR HB3 1 53 SER H 0.000 . 5.800 3.103 2.269 4.308 . 0 0 "[ . 1 . 2]" 1
188 1 76 LEU MD1 1 87 ARG HD2 0.000 . 5.800 4.790 2.983 5.895 0.095 6 0 "[ . 1 . 2]" 1
189 1 50 ARG HA 1 50 ARG HD2 0.000 . 5.720 3.455 1.969 4.767 . 0 0 "[ . 1 . 2]" 1
190 1 50 ARG HA 1 50 ARG HD3 0.000 . 5.520 3.608 2.089 4.809 . 0 0 "[ . 1 . 2]" 1
191 1 55 PHE QE 1 58 LEU MD2 0.000 . 5.800 3.515 2.389 4.945 . 0 0 "[ . 1 . 2]" 1
192 1 98 ILE HA 1 101 LEU MD1 0.000 . 5.790 2.147 1.851 2.608 . 0 0 "[ . 1 . 2]" 1
193 1 43 GLY HA3 1 44 ARG H 0.000 . 5.100 3.005 2.498 3.478 . 0 0 "[ . 1 . 2]" 1
194 1 105 VAL MG2 1 110 LEU H 0.000 . 5.730 4.547 3.731 5.310 . 0 0 "[ . 1 . 2]" 1
195 1 106 PRO HA 1 108 GLU H 0.000 . 5.800 3.574 3.188 4.085 . 0 0 "[ . 1 . 2]" 1
196 1 65 LEU HA 1 66 TYR H 0.000 . 5.390 3.623 3.533 3.645 . 0 0 "[ . 1 . 2]" 1
197 1 117 HIS HA 1 117 HIS HD2 0.000 . 5.130 3.432 2.742 4.706 . 0 0 "[ . 1 . 2]" 1
198 1 91 LEU MD1 1 94 TYR HB2 0.000 . 5.670 3.717 3.136 4.525 . 0 0 "[ . 1 . 2]" 1
199 1 68 VAL MG2 1 69 PRO HD2 0.000 . 4.780 3.910 1.955 4.450 . 0 0 "[ . 1 . 2]" 1
200 1 37 VAL H 1 47 THR MG 0.000 . 5.420 4.368 3.813 5.428 0.008 4 0 "[ . 1 . 2]" 1
201 1 68 VAL H 1 68 VAL MG2 0.000 . 4.780 2.938 2.282 3.926 . 0 0 "[ . 1 . 2]" 1
202 1 109 LEU MD1 1 112 PHE HA 0.000 . 5.800 5.670 5.054 6.150 0.350 19 0 "[ . 1 . 2]" 1
203 1 55 PHE HA 1 58 LEU MD2 0.000 . 5.800 2.341 1.680 2.891 . 0 0 "[ . 1 . 2]" 1
204 1 55 PHE HA 1 58 LEU HB3 0.000 . 5.700 2.888 1.965 4.913 . 0 0 "[ . 1 . 2]" 1
205 1 55 PHE HA 1 58 LEU HB2 0.000 . 5.800 3.817 2.795 5.894 0.094 2 0 "[ . 1 . 2]" 1
206 1 55 PHE HA 1 55 PHE QE 0.000 . 5.800 4.496 4.227 4.826 . 0 0 "[ . 1 . 2]" 1
207 1 55 PHE HA 1 58 LEU H 0.000 . 5.800 3.388 3.060 3.966 . 0 0 "[ . 1 . 2]" 1
208 1 55 PHE HA 1 58 LEU MD1 0.000 . 5.800 4.376 3.578 4.858 . 0 0 "[ . 1 . 2]" 1
209 1 121 ASP HB2 1 122 PRO HD2 0.000 . 5.800 3.961 2.255 5.016 . 0 0 "[ . 1 . 2]" 1
210 1 28 PRO HD2 1 29 GLU H 0.000 . 5.800 2.867 2.383 3.516 . 0 0 "[ . 1 . 2]" 1
211 1 15 PRO HD2 1 16 SER H 0.000 . 5.800 2.748 2.138 3.084 . 0 0 "[ . 1 . 2]" 1
212 1 35 PHE QD 1 52 TYR HA 0.000 . 5.800 4.641 4.037 5.119 . 0 0 "[ . 1 . 2]" 1
213 1 35 PHE QE 1 52 TYR HA 0.000 . 5.800 2.725 2.070 3.509 . 0 0 "[ . 1 . 2]" 1
214 1 31 SER HB2 1 51 ARG HG2 0.000 . 5.380 4.754 2.950 5.519 0.139 5 0 "[ . 1 . 2]" 1
215 1 27 SER HB2 1 29 GLU HG2 0.000 . 5.800 5.110 3.221 5.924 0.124 18 0 "[ . 1 . 2]" 1
216 1 24 PRO HG2 1 27 SER HB2 0.000 . 5.800 4.067 2.813 5.806 0.006 7 0 "[ . 1 . 2]" 1
217 1 27 SER HB2 1 30 LYS HG2 0.000 . 5.800 4.367 2.097 5.864 0.064 20 0 "[ . 1 . 2]" 1
218 1 14 ILE HA 1 37 VAL MG2 0.000 . 5.800 5.296 4.790 5.585 . 0 0 "[ . 1 . 2]" 1
219 1 68 VAL HA 1 69 PRO HD2 0.000 . 4.760 2.505 2.142 3.033 . 0 0 "[ . 1 . 2]" 1
220 1 35 PHE HA 1 35 PHE QE 0.000 . 5.800 5.647 5.565 5.686 . 0 0 "[ . 1 . 2]" 1
221 1 68 VAL MG1 1 69 PRO HA 0.000 . 5.800 4.440 4.024 5.868 0.068 20 0 "[ . 1 . 2]" 1
222 1 76 LEU MD1 1 77 PRO HD2 0.000 . 5.380 3.469 2.006 4.799 . 0 0 "[ . 1 . 2]" 1
223 1 76 LEU HA 1 77 PRO HD2 0.000 . 4.740 2.679 2.008 3.295 . 0 0 "[ . 1 . 2]" 1
224 1 118 PHE HA 1 119 PRO HD3 0.000 . 4.420 2.180 1.900 2.513 . 0 0 "[ . 1 . 2]" 1
225 1 105 VAL MG2 1 106 PRO HD2 0.000 . 4.970 2.799 2.023 3.511 . 0 0 "[ . 1 . 2]" 1
226 1 105 VAL MG2 1 106 PRO HD3 0.000 . 4.930 3.720 3.443 4.317 . 0 0 "[ . 1 . 2]" 1
227 1 107 LYS HA 1 111 GLU H 0.000 . 5.800 4.340 3.859 4.716 . 0 0 "[ . 1 . 2]" 1
228 1 76 LEU HA 1 76 LEU MD1 0.000 . 4.610 3.306 2.015 3.897 . 0 0 "[ . 1 . 2]" 1
229 1 76 LEU HA 1 77 PRO HG2 0.000 . 5.080 4.591 4.168 5.075 . 0 0 "[ . 1 . 2]" 1
230 1 76 LEU HA 1 77 PRO HD3 0.000 . 4.660 2.357 1.975 2.828 . 0 0 "[ . 1 . 2]" 1
231 1 126 ASN HA 1 127 TRP H 0.000 . 5.800 2.263 2.052 3.569 . 0 0 "[ . 1 . 2]" 1
232 1 40 LEU MD1 1 45 ARG HA 0.000 . 5.800 4.674 3.960 5.338 . 0 0 "[ . 1 . 2]" 1
233 1 99 LEU H 1 99 LEU MD2 0.000 . 5.800 4.038 3.446 4.317 . 0 0 "[ . 1 . 2]" 1
234 1 11 GLU H 1 99 LEU MD2 0.000 . 5.620 4.761 3.810 5.757 0.137 7 0 "[ . 1 . 2]" 1
235 1 99 LEU MD2 1 100 TYR H 0.000 . 5.800 3.610 2.822 4.695 . 0 0 "[ . 1 . 2]" 1
236 1 88 ARG HA 1 91 LEU MD2 0.000 . 5.800 3.817 2.775 4.367 . 0 0 "[ . 1 . 2]" 1
237 1 20 GLU QB 1 33 MET HA 0.000 . 5.380 5.031 2.923 5.516 0.136 12 0 "[ . 1 . 2]" 1
238 1 8 LEU HA 1 9 GLU H 0.000 . 4.760 2.756 1.974 3.573 . 0 0 "[ . 1 . 2]" 1
239 1 22 GLU HA 1 22 GLU HG2 0.000 . 4.270 3.490 2.371 4.272 0.002 20 0 "[ . 1 . 2]" 1
240 1 62 ILE HA 1 66 TYR QE 0.000 . 5.800 4.493 4.096 5.109 . 0 0 "[ . 1 . 2]" 1
241 1 62 ILE HA 1 66 TYR QD 0.000 . 5.320 3.964 3.278 4.681 . 0 0 "[ . 1 . 2]" 1
242 1 62 ILE HA 1 65 LEU H 0.000 . 5.720 2.740 2.466 3.230 . 0 0 "[ . 1 . 2]" 1
243 1 62 ILE HB 1 66 TYR QD 0.000 . 5.390 2.707 2.141 3.529 . 0 0 "[ . 1 . 2]" 1
244 1 71 PHE HA 1 72 PRO HD2 0.000 . 5.270 2.715 2.122 3.205 . 0 0 "[ . 1 . 2]" 1
245 1 56 HIS HA 1 71 PHE QD 0.000 . 5.800 5.064 3.493 5.852 0.052 13 0 "[ . 1 . 2]" 1
246 1 60 LYS HA 1 60 LYS HD2 0.000 . 5.380 4.011 1.985 4.864 . 0 0 "[ . 1 . 2]" 1
247 1 68 VAL MG1 1 69 PRO HD2 0.000 . 5.770 2.579 1.912 3.808 . 0 0 "[ . 1 . 2]" 1
248 1 98 ILE HG12 1 99 LEU H 0.000 . 5.680 3.157 2.313 4.884 . 0 0 "[ . 1 . 2]" 1
249 1 63 LYS HA 1 68 VAL MG1 0.000 . 4.820 3.179 1.875 4.805 . 0 0 "[ . 1 . 2]" 1
250 1 37 VAL HA 1 39 VAL MG2 0.000 . 5.040 4.720 4.262 5.057 0.017 9 0 "[ . 1 . 2]" 1
251 1 38 GLU HA 1 47 THR HB 0.000 . 5.800 5.112 4.512 5.425 . 0 0 "[ . 1 . 2]" 1
252 1 71 PHE HA 1 72 PRO HD3 0.000 . 5.500 2.140 1.923 2.504 . 0 0 "[ . 1 . 2]" 1
253 1 72 PRO HD2 1 91 LEU MD1 0.000 . 5.800 3.759 2.147 4.865 . 0 0 "[ . 1 . 2]" 1
254 1 58 LEU MD2 1 112 PHE QB 0.000 . 5.800 4.600 3.129 5.546 . 0 0 "[ . 1 . 2]" 1
255 1 58 LEU MD2 1 62 ILE MD 0.000 . 4.750 3.818 3.071 4.515 . 0 0 "[ . 1 . 2]" 1
256 1 58 LEU MD2 1 112 PHE QD 0.000 . 5.460 4.651 2.921 5.557 0.097 10 0 "[ . 1 . 2]" 1
257 1 36 ARG HA 1 49 PRO HD2 0.000 . 5.190 5.215 5.063 5.341 0.151 4 0 "[ . 1 . 2]" 1
258 1 24 PRO HA 1 25 ARG H 0.000 . 5.000 3.044 2.374 3.572 . 0 0 "[ . 1 . 2]" 1
259 1 59 HIS QB 1 62 ILE H 0.000 . 5.700 5.166 4.889 5.346 . 0 0 "[ . 1 . 2]" 1
260 1 65 LEU HB3 1 66 TYR H 0.000 . 5.800 2.615 2.145 3.475 . 0 0 "[ . 1 . 2]" 1
261 1 19 PRO HB2 1 21 ALA H 0.000 . 5.420 5.086 4.524 5.584 0.164 7 0 "[ . 1 . 2]" 1
262 1 69 PRO HB3 1 94 TYR QD 0.000 . 5.800 4.583 3.498 5.810 0.010 18 0 "[ . 1 . 2]" 1
263 1 118 PHE HB3 1 119 PRO HD2 0.000 . 5.800 3.603 2.162 5.129 . 0 0 "[ . 1 . 2]" 1
264 1 14 ILE MD 1 92 GLU HG2 0.000 . 5.790 4.484 3.502 5.295 . 0 0 "[ . 1 . 2]" 1
265 1 69 PRO HB2 1 94 TYR QD 0.000 . 5.800 3.211 2.164 4.573 . 0 0 "[ . 1 . 2]" 1
266 1 110 LEU MD2 1 117 HIS QB 0.000 . 5.800 5.248 2.895 5.872 0.072 19 0 "[ . 1 . 2]" 1
267 1 118 PHE QD 1 119 PRO HD2 0.000 . 5.800 3.620 2.384 5.552 . 0 0 "[ . 1 . 2]" 1
268 1 110 LEU MD1 1 113 LEU H 0.000 . 5.460 5.454 5.278 5.581 0.121 8 0 "[ . 1 . 2]" 1
269 1 110 LEU MD1 1 111 GLU H 0.000 . 5.700 3.808 3.361 4.517 . 0 0 "[ . 1 . 2]" 1
270 1 14 ILE MD 1 91 LEU MD2 0.000 . 5.630 4.036 2.897 5.431 . 0 0 "[ . 1 . 2]" 1
271 1 86 GLN HA 1 89 GLN H 0.000 . 5.570 3.722 3.230 4.511 . 0 0 "[ . 1 . 2]" 1
272 1 37 VAL H 1 37 VAL MG2 0.000 . 4.730 2.144 1.961 2.258 . 0 0 "[ . 1 . 2]" 1
273 1 39 VAL H 1 39 VAL MG2 0.000 . 4.620 2.454 2.319 2.631 . 0 0 "[ . 1 . 2]" 1
274 1 101 LEU MD2 1 102 ASN H 0.000 . 5.430 4.630 4.494 4.698 . 0 0 "[ . 1 . 2]" 1
275 1 36 ARG HB2 1 47 THR MG 0.000 . 4.640 3.178 1.956 4.637 . 0 0 "[ . 1 . 2]" 1
276 1 71 PHE QD 1 73 SER HB2 0.000 . 5.800 5.411 4.099 5.898 0.098 4 0 "[ . 1 . 2]" 1
277 1 39 VAL MG1 1 40 LEU H 0.000 . 5.060 3.130 2.811 3.361 . 0 0 "[ . 1 . 2]" 1
278 1 37 VAL H 1 48 VAL MG2 0.000 . 5.790 4.731 4.057 5.017 . 0 0 "[ . 1 . 2]" 1
279 1 48 VAL MG2 1 49 PRO HD2 0.000 . 4.700 4.292 3.629 4.667 . 0 0 "[ . 1 . 2]" 1
280 1 14 ILE HA 1 37 VAL MG1 0.000 . 5.800 3.849 3.332 4.083 . 0 0 "[ . 1 . 2]" 1
281 1 35 PHE QE 1 52 TYR HB2 0.000 . 5.800 3.304 2.630 4.108 . 0 0 "[ . 1 . 2]" 1
282 1 35 PHE QD 1 52 TYR HB2 0.000 . 5.800 4.702 3.849 5.849 0.049 12 0 "[ . 1 . 2]" 1
283 1 98 ILE HA 1 103 GLN H 0.000 . 5.640 5.150 4.690 5.886 0.246 3 0 "[ . 1 . 2]" 1
284 1 91 LEU HA 1 95 ILE MD 0.000 . 5.800 4.556 3.909 5.842 0.042 4 0 "[ . 1 . 2]" 1
285 1 58 LEU MD1 1 95 ILE MG 0.000 . 5.360 5.393 4.579 5.593 0.233 4 0 "[ . 1 . 2]" 1
286 1 14 ILE HG12 1 95 ILE MG 0.000 . 5.020 4.953 4.410 5.124 0.104 1 0 "[ . 1 . 2]" 1
287 1 95 ILE MG 1 99 LEU H 0.000 . 5.800 4.265 3.791 5.232 . 0 0 "[ . 1 . 2]" 1
288 1 55 PHE QE 1 95 ILE MG 0.000 . 5.800 3.456 2.145 4.580 . 0 0 "[ . 1 . 2]" 1
289 1 68 VAL MG2 1 98 ILE MG 0.000 . 4.630 2.383 1.718 4.384 . 0 0 "[ . 1 . 2]" 1
290 1 17 VAL MG1 1 84 LEU MD2 0.000 . 5.190 3.703 1.971 5.174 . 0 0 "[ . 1 . 2]" 1
291 1 109 LEU H 1 115 LEU MD1 0.000 . 4.570 4.664 4.613 4.775 0.205 19 0 "[ . 1 . 2]" 1
292 1 93 ALA HA 1 96 GLN HG2 0.000 . 5.800 4.909 2.069 5.730 . 0 0 "[ . 1 . 2]" 1
293 1 34 VAL MG1 1 50 ARG H 0.000 . 5.800 4.768 4.005 5.230 . 0 0 "[ . 1 . 2]" 1
294 1 34 VAL MG2 1 35 PHE H 0.000 . 5.010 2.699 2.321 3.738 . 0 0 "[ . 1 . 2]" 1
295 1 67 LYS H 1 68 VAL MG2 0.000 . 5.800 4.087 3.671 5.815 0.015 5 0 "[ . 1 . 2]" 1
296 1 38 GLU HG2 1 47 THR MG 0.000 . 5.020 4.172 2.192 5.041 0.021 7 0 "[ . 1 . 2]" 1
297 1 61 ARG HA 1 61 ARG HG2 0.000 . 4.480 2.891 2.500 3.218 . 0 0 "[ . 1 . 2]" 1
298 1 61 ARG HA 1 62 ILE H 0.000 . 5.570 3.522 3.478 3.575 . 0 0 "[ . 1 . 2]" 1
299 1 61 ARG HA 1 64 LYS H 0.000 . 5.800 4.201 3.765 5.261 . 0 0 "[ . 1 . 2]" 1
300 1 75 ARG HA 1 76 LEU H 0.000 . 4.520 2.102 1.932 2.199 . 0 0 "[ . 1 . 2]" 1
301 1 17 VAL MG1 1 34 VAL MG2 0.000 . 4.370 4.413 4.123 4.556 0.186 7 0 "[ . 1 . 2]" 1
302 1 17 VAL MG1 1 33 MET HG3 0.000 . 5.280 3.488 2.341 4.715 . 0 0 "[ . 1 . 2]" 1
303 1 17 VAL MG1 1 33 MET HG2 0.000 . 5.670 3.215 2.479 3.966 . 0 0 "[ . 1 . 2]" 1
304 1 62 ILE MG 1 65 LEU H 0.000 . 5.590 4.431 4.133 4.795 . 0 0 "[ . 1 . 2]" 1
305 1 93 ALA MB 1 94 TYR H 0.000 . 4.730 2.546 2.371 2.802 . 0 0 "[ . 1 . 2]" 1
306 1 90 GLY HA3 1 93 ALA MB 0.000 . 4.730 4.401 4.095 4.733 0.003 4 0 "[ . 1 . 2]" 1
307 1 14 ILE MG 1 88 ARG HA 0.000 . 5.540 3.359 2.597 4.500 . 0 0 "[ . 1 . 2]" 1
308 1 14 ILE MG 1 35 PHE HB3 0.000 . 5.150 3.122 2.761 3.500 . 0 0 "[ . 1 . 2]" 1
309 1 14 ILE MG 1 15 PRO HD2 0.000 . 5.400 3.202 2.886 3.550 . 0 0 "[ . 1 . 2]" 1
310 1 14 ILE MG 1 38 GLU H 0.000 . 5.800 4.393 4.168 4.803 . 0 0 "[ . 1 . 2]" 1
311 1 17 VAL MG2 1 33 MET HG2 0.000 . 5.620 5.492 5.001 5.867 0.247 20 0 "[ . 1 . 2]" 1
312 1 17 VAL HA 1 36 ARG H 0.000 . 5.400 3.011 2.674 3.447 . 0 0 "[ . 1 . 2]" 1
313 1 34 VAL HB 1 50 ARG H 0.000 . 5.800 5.016 2.623 5.693 . 0 0 "[ . 1 . 2]" 1
314 1 55 PHE QD 1 58 LEU MD1 0.000 . 5.750 4.606 2.768 5.802 0.052 15 0 "[ . 1 . 2]" 1
315 1 108 GLU HA 1 111 GLU H 0.000 . 5.740 3.146 2.607 3.808 . 0 0 "[ . 1 . 2]" 1
316 1 110 LEU MD2 1 118 PHE HB2 0.000 . 5.800 5.242 3.961 5.864 0.064 8 0 "[ . 1 . 2]" 1
317 1 34 VAL MG1 1 49 PRO HB2 0.000 . 4.640 3.879 3.204 4.658 0.018 7 0 "[ . 1 . 2]" 1
318 1 34 VAL MG1 1 49 PRO HB3 0.000 . 4.040 3.574 2.547 4.107 0.067 16 0 "[ . 1 . 2]" 1
319 1 33 MET ME 1 35 PHE H 0.000 . 5.800 5.738 5.447 5.872 0.072 16 0 "[ . 1 . 2]" 1
320 1 22 GLU H 1 22 GLU HG2 0.000 . 5.360 2.743 1.969 4.195 . 0 0 "[ . 1 . 2]" 1
321 1 69 PRO HG2 1 94 TYR HA 0.000 . 5.500 3.584 2.245 5.144 . 0 0 "[ . 1 . 2]" 1
322 1 69 PRO HG2 1 94 TYR QD 0.000 . 5.800 2.889 2.128 4.486 . 0 0 "[ . 1 . 2]" 1
323 1 19 PRO HB3 1 20 GLU H 0.000 . 5.800 4.257 3.716 4.578 . 0 0 "[ . 1 . 2]" 1
324 1 19 PRO HB2 1 20 GLU H 0.000 . 5.740 3.984 3.167 4.367 . 0 0 "[ . 1 . 2]" 1
325 1 34 VAL MG2 1 49 PRO HB2 0.000 . 4.980 2.626 2.132 3.306 . 0 0 "[ . 1 . 2]" 1
326 1 34 VAL MG2 1 49 PRO HB3 0.000 . 4.720 2.641 2.066 3.299 . 0 0 "[ . 1 . 2]" 1
327 1 105 VAL MG2 1 106 PRO HB2 0.000 . 5.670 4.589 3.793 5.699 0.029 16 0 "[ . 1 . 2]" 1
328 1 105 VAL MG2 1 106 PRO HB3 0.000 . 5.460 5.303 4.677 5.599 0.139 3 0 "[ . 1 . 2]" 1
329 1 106 PRO HB3 1 107 LYS H 0.000 . 5.800 3.638 3.062 4.092 . 0 0 "[ . 1 . 2]" 1
330 1 40 LEU MD2 1 43 GLY H 0.000 . 5.250 2.315 1.762 3.285 . 0 0 "[ . 1 . 2]" 1
331 1 40 LEU MD2 1 44 ARG H 0.000 . 5.020 3.372 2.590 4.224 . 0 0 "[ . 1 . 2]" 1
332 1 40 LEU MD2 1 45 ARG HD3 0.000 . 5.200 4.782 1.759 5.324 0.124 11 0 "[ . 1 . 2]" 1
333 1 115 LEU HA 1 115 LEU MD1 0.000 . 4.400 3.861 3.788 3.950 . 0 0 "[ . 1 . 2]" 1
334 1 59 HIS HA 1 62 ILE HG13 0.000 . 5.500 2.733 2.434 3.091 . 0 0 "[ . 1 . 2]" 1
335 1 59 HIS HA 1 63 LYS H 0.000 . 5.800 4.200 3.828 4.556 . 0 0 "[ . 1 . 2]" 1
336 1 68 VAL MG2 1 98 ILE MD 0.000 . 4.660 3.582 2.927 4.494 . 0 0 "[ . 1 . 2]" 1
337 1 62 ILE MD 1 68 VAL MG2 0.000 . 4.140 2.640 2.198 3.695 . 0 0 "[ . 1 . 2]" 1
338 1 48 VAL H 1 49 PRO HD2 0.000 . 5.800 5.070 4.594 5.328 . 0 0 "[ . 1 . 2]" 1
339 1 66 TYR HB2 1 103 GLN HG2 0.000 . 5.170 4.704 3.542 5.295 0.125 17 0 "[ . 1 . 2]" 1
340 1 60 LYS HA 1 60 LYS HE2 0.000 . 5.640 3.545 1.865 4.646 . 0 0 "[ . 1 . 2]" 1
341 1 60 LYS HA 1 63 LYS HG2 0.000 . 5.800 2.357 1.913 3.362 . 0 0 "[ . 1 . 2]" 1
342 1 72 PRO HD2 1 94 TYR QD 0.000 . 5.800 4.482 3.386 5.319 . 0 0 "[ . 1 . 2]" 1
343 1 16 SER HA 1 17 VAL H 0.000 . 5.020 2.293 2.219 2.466 . 0 0 "[ . 1 . 2]" 1
344 1 87 ARG HA 1 90 GLY H 0.000 . 5.800 3.744 3.239 4.187 . 0 0 "[ . 1 . 2]" 1
345 1 87 ARG HA 1 88 ARG H 0.000 . 5.800 3.544 3.486 3.597 . 0 0 "[ . 1 . 2]" 1
346 1 33 MET ME 1 33 MET HG2 0.000 . 4.020 2.555 2.096 3.460 . 0 0 "[ . 1 . 2]" 1
347 1 19 PRO HB2 1 34 VAL H 0.000 . 5.800 5.777 5.508 5.920 0.120 20 0 "[ . 1 . 2]" 1
348 1 99 LEU HB3 1 100 TYR H 0.000 . 5.800 3.051 2.506 3.842 . 0 0 "[ . 1 . 2]" 1
349 1 83 GLY HA3 1 84 LEU MD2 0.000 . 5.800 4.747 3.500 6.064 0.264 18 0 "[ . 1 . 2]" 1
350 1 37 VAL MG2 1 55 PHE QD 0.000 . 4.830 4.821 4.593 4.977 0.147 8 0 "[ . 1 . 2]" 1
351 1 27 SER H 1 28 PRO HD2 0.000 . 5.800 4.989 4.662 5.247 . 0 0 "[ . 1 . 2]" 1
352 1 12 VAL HA 1 99 LEU MD2 0.000 . 5.360 5.261 4.763 5.461 0.101 1 0 "[ . 1 . 2]" 1
353 1 109 LEU HA 1 109 LEU MD1 0.000 . 4.490 2.239 1.941 3.419 . 0 0 "[ . 1 . 2]" 1
354 1 109 LEU MD1 1 112 PHE QB 0.000 . 4.970 3.046 2.337 3.907 . 0 0 "[ . 1 . 2]" 1
355 1 63 LYS HA 1 68 VAL MG2 0.000 . 4.760 2.401 1.819 3.999 . 0 0 "[ . 1 . 2]" 1
356 1 13 HIS H 1 39 VAL HA 0.000 . 5.700 3.785 3.335 4.245 . 0 0 "[ . 1 . 2]" 1
357 1 115 LEU MD1 1 116 ARG H 0.000 . 5.510 5.234 4.653 5.512 0.002 1 0 "[ . 1 . 2]" 1
358 1 65 LEU H 1 65 LEU MD1 0.000 . 5.260 4.210 3.850 4.416 . 0 0 "[ . 1 . 2]" 1
359 1 65 LEU MD1 1 66 TYR H 0.000 . 5.410 4.091 3.182 4.938 . 0 0 "[ . 1 . 2]" 1
360 1 65 LEU HB2 1 65 LEU MD1 0.000 . 3.670 2.875 2.180 3.252 . 0 0 "[ . 1 . 2]" 1
361 1 65 LEU HA 1 65 LEU MD1 0.000 . 3.770 2.942 2.001 3.807 0.037 8 0 "[ . 1 . 2]" 1
362 1 98 ILE MD 1 99 LEU H 0.000 . 5.790 4.085 3.813 4.494 . 0 0 "[ . 1 . 2]" 1
363 1 59 HIS HA 1 66 TYR HH 0.000 . 5.730 5.772 5.325 5.982 0.252 15 0 "[ . 1 . 2]" 1
364 1 23 GLY HA3 1 24 PRO HG2 0.000 . 5.800 5.578 5.010 5.819 0.019 11 0 "[ . 1 . 2]" 1
365 1 9 GLU HA 1 42 SER H 0.000 . 5.800 5.057 4.344 5.736 . 0 0 "[ . 1 . 2]" 1
366 1 80 ARG HA 1 80 ARG HD2 0.000 . 4.950 4.464 2.039 4.887 . 0 0 "[ . 1 . 2]" 1
367 1 107 LYS HG2 1 110 LEU MD1 0.000 . 4.100 3.956 3.660 4.193 0.093 13 0 "[ . 1 . 2]" 1
368 1 110 LEU HA 1 115 LEU HB2 0.000 . 5.800 1.801 1.692 1.929 . 0 0 "[ . 1 . 2]" 1
369 1 44 ARG HB2 1 44 ARG HD2 0.000 . 3.920 3.000 2.419 3.738 . 0 0 "[ . 1 . 2]" 1
370 1 45 ARG HB3 1 45 ARG HD2 0.000 . 3.800 2.935 2.326 3.749 . 0 0 "[ . 1 . 2]" 1
371 1 40 LEU MD1 1 45 ARG HD2 0.000 . 5.020 3.807 1.965 5.157 0.137 9 0 "[ . 1 . 2]" 1
372 1 72 PRO HG3 1 91 LEU MD1 0.000 . 5.800 3.039 2.041 4.512 . 0 0 "[ . 1 . 2]" 1
373 1 40 LEU MD1 1 43 GLY HA3 0.000 . 5.320 5.177 3.961 5.413 0.093 17 0 "[ . 1 . 2]" 1
374 1 110 LEU MD2 1 117 HIS HA 0.000 . 5.650 4.848 2.171 5.758 0.108 4 0 "[ . 1 . 2]" 1
375 1 11 GLU HG2 1 40 LEU MD1 0.000 . 4.900 3.880 1.925 4.634 . 0 0 "[ . 1 . 2]" 1
376 1 61 ARG HD2 1 108 GLU HG2 0.000 . 5.500 4.794 3.260 5.620 0.120 17 0 "[ . 1 . 2]" 1
377 1 97 GLY HA3 1 100 TYR HB2 0.000 . 5.800 5.583 5.281 5.822 0.022 7 0 "[ . 1 . 2]" 1
378 1 40 LEU HB2 1 40 LEU MD1 0.000 . 3.570 2.343 2.192 3.224 . 0 0 "[ . 1 . 2]" 1
379 1 33 MET ME 1 84 LEU MD1 0.000 . 3.980 2.008 1.733 2.984 . 0 0 "[ . 1 . 2]" 1
380 1 33 MET HG2 1 84 LEU MD2 0.000 . 5.060 4.873 4.280 5.202 0.142 1 0 "[ . 1 . 2]" 1
381 1 84 LEU MD2 1 87 ARG HD2 0.000 . 5.670 4.750 2.823 5.720 0.050 16 0 "[ . 1 . 2]" 1
382 1 35 PHE QE 1 95 ILE MD 0.000 . 5.450 3.610 2.240 5.215 . 0 0 "[ . 1 . 2]" 1
383 1 40 LEU MD1 1 45 ARG HD3 0.000 . 4.600 3.370 2.011 4.618 0.018 10 0 "[ . 1 . 2]" 1
384 1 35 PHE QD 1 37 VAL MG2 0.000 . 5.690 3.889 3.238 4.204 . 0 0 "[ . 1 . 2]" 1
385 1 100 TYR H 1 101 LEU MD2 0.000 . 5.530 5.154 4.884 5.414 . 0 0 "[ . 1 . 2]" 1
386 1 69 PRO HD2 1 98 ILE HA 0.000 . 5.240 4.144 3.206 4.715 . 0 0 "[ . 1 . 2]" 1
387 1 34 VAL HA 1 35 PHE QE 0.000 . 5.800 5.272 4.860 5.781 . 0 0 "[ . 1 . 2]" 1
388 1 75 ARG HA 1 75 ARG HD2 0.000 . 4.720 3.576 2.063 4.706 . 0 0 "[ . 1 . 2]" 1
389 1 69 PRO HD2 1 101 LEU MD1 0.000 . 4.850 3.294 3.000 3.934 . 0 0 "[ . 1 . 2]" 1
390 1 69 PRO HG2 1 101 LEU MD1 0.000 . 5.220 3.814 2.863 4.665 . 0 0 "[ . 1 . 2]" 1
391 1 18 GLY HA3 1 19 PRO HB2 0.000 . 5.800 5.802 5.606 5.865 0.065 5 0 "[ . 1 . 2]" 1
392 1 66 TYR HH 1 68 VAL MG2 0.000 . 5.570 3.755 2.882 5.628 0.058 20 0 "[ . 1 . 2]" 1
393 1 68 VAL HA 1 101 LEU MD1 0.000 . 5.210 2.607 2.036 2.997 . 0 0 "[ . 1 . 2]" 1
394 1 69 PRO HA 1 101 LEU MD1 0.000 . 5.700 4.179 2.510 4.763 . 0 0 "[ . 1 . 2]" 1
395 1 55 PHE HB2 1 91 LEU MD1 0.000 . 5.330 3.785 2.468 4.579 . 0 0 "[ . 1 . 2]" 1
396 1 62 ILE MD 1 62 ILE MG 0.000 . 3.740 1.862 1.752 1.992 . 0 0 "[ . 1 . 2]" 1
397 1 61 ARG QB 1 62 ILE MG 0.000 . 4.580 2.949 2.261 3.366 . 0 0 "[ . 1 . 2]" 1
398 1 37 VAL HB 1 48 VAL HB 0.000 . 5.570 4.727 4.311 5.235 . 0 0 "[ . 1 . 2]" 1
399 1 37 VAL MG1 1 48 VAL HB 0.000 . 5.800 4.436 4.109 4.924 . 0 0 "[ . 1 . 2]" 1
400 1 66 TYR QE 1 98 ILE MD 0.000 . 5.700 3.602 2.631 5.106 . 0 0 "[ . 1 . 2]" 1
401 1 94 TYR QD 1 98 ILE MD 0.000 . 5.800 5.054 2.738 5.862 0.062 2 0 "[ . 1 . 2]" 1
402 1 48 VAL MG1 1 50 ARG HD2 0.000 . 5.800 3.863 2.520 5.657 . 0 0 "[ . 1 . 2]" 1
403 1 52 TYR QD 1 87 ARG HD2 0.000 . 5.800 4.027 2.214 5.820 0.020 13 0 "[ . 1 . 2]" 1
404 1 11 GLU HG2 1 40 LEU HB2 0.000 . 5.800 5.546 3.704 5.865 0.065 19 0 "[ . 1 . 2]" 1
405 1 69 PRO HB2 1 101 LEU MD1 0.000 . 5.600 4.684 3.992 5.467 . 0 0 "[ . 1 . 2]" 1
406 1 44 ARG HD2 1 45 ARG H 0.000 . 5.800 5.057 2.406 5.850 0.050 14 0 "[ . 1 . 2]" 1
407 1 48 VAL HA 1 49 PRO HD2 0.000 . 4.420 2.461 1.909 2.791 . 0 0 "[ . 1 . 2]" 1
408 1 48 VAL MG1 1 49 PRO HD2 0.000 . 4.720 2.945 2.254 3.334 . 0 0 "[ . 1 . 2]" 1
409 1 21 ALA HA 1 22 GLU HB2 0.000 . 5.800 5.328 3.899 5.790 . 0 0 "[ . 1 . 2]" 1
410 1 121 ASP HA 1 122 PRO HB3 0.000 . 5.800 5.062 4.703 5.604 . 0 0 "[ . 1 . 2]" 1
411 1 121 ASP HA 1 122 PRO HD2 0.000 . 4.030 2.388 2.069 3.245 . 0 0 "[ . 1 . 2]" 1
412 1 44 ARG H 1 44 ARG HD2 0.000 . 5.800 3.790 2.260 5.232 . 0 0 "[ . 1 . 2]" 1
413 1 67 LYS HA 1 68 VAL MG2 0.000 . 5.250 3.651 3.213 5.299 0.049 5 0 "[ . 1 . 2]" 1
414 1 33 MET ME 1 52 TYR QD 0.000 . 5.800 5.737 4.945 5.936 0.136 5 0 "[ . 1 . 2]" 1
415 1 55 PHE QD 1 58 LEU HG 0.000 . 5.800 4.431 3.253 5.731 . 0 0 "[ . 1 . 2]" 1
416 1 33 MET ME 1 79 TRP HE3 0.000 . 5.800 5.510 2.871 6.017 0.217 16 0 "[ . 1 . 2]" 1
417 1 20 GLU HG2 1 34 VAL MG1 0.000 . 4.770 2.642 1.855 3.933 . 0 0 "[ . 1 . 2]" 1
418 1 64 LYS H 1 64 LYS HD2 0.000 . 5.800 4.703 3.386 5.621 . 0 0 "[ . 1 . 2]" 1
419 1 68 VAL HB 1 69 PRO HD2 0.000 . 5.130 4.210 2.480 4.934 . 0 0 "[ . 1 . 2]" 1
420 1 79 TRP HZ2 1 87 ARG HA 0.000 . 5.800 4.903 2.809 5.995 0.195 16 0 "[ . 1 . 2]" 1
421 1 33 MET HG2 1 84 LEU MD1 0.000 . 4.890 4.241 3.386 4.860 . 0 0 "[ . 1 . 2]" 1
422 1 17 VAL MG1 1 84 LEU MD1 0.000 . 5.210 2.453 2.021 3.234 . 0 0 "[ . 1 . 2]" 1
423 1 65 LEU MD2 1 66 TYR H 0.000 . 5.800 3.987 2.923 4.643 . 0 0 "[ . 1 . 2]" 1
424 1 65 LEU H 1 65 LEU MD2 0.000 . 5.580 3.717 2.463 4.175 . 0 0 "[ . 1 . 2]" 1
425 1 13 HIS HA 1 92 GLU HG3 0.000 . 5.800 3.001 1.824 5.862 0.062 7 0 "[ . 1 . 2]" 1
426 1 68 VAL MG2 1 98 ILE HA 0.000 . 5.770 4.511 3.766 5.860 0.090 20 0 "[ . 1 . 2]" 1
427 1 58 LEU MD1 1 109 LEU HA 0.000 . 4.890 3.545 2.476 4.666 . 0 0 "[ . 1 . 2]" 1
428 1 35 PHE QD 1 88 ARG HA 0.000 . 5.450 4.651 4.217 5.118 . 0 0 "[ . 1 . 2]" 1
429 1 35 PHE QE 1 88 ARG HA 0.000 . 5.800 5.605 5.040 5.843 0.043 19 0 "[ . 1 . 2]" 1
430 1 121 ASP HB3 1 122 PRO HD2 0.000 . 5.500 3.716 2.157 4.711 . 0 0 "[ . 1 . 2]" 1
431 1 68 VAL HA 1 98 ILE MD 0.000 . 5.800 4.577 4.045 5.397 . 0 0 "[ . 1 . 2]" 1
432 1 68 VAL HB 1 98 ILE MD 0.000 . 5.610 5.309 3.442 5.704 0.094 12 0 "[ . 1 . 2]" 1
433 1 66 TYR H 1 68 VAL MG2 0.000 . 5.800 3.263 2.860 5.136 . 0 0 "[ . 1 . 2]" 1
434 1 66 TYR QE 1 68 VAL MG1 0.000 . 5.800 4.045 2.130 4.877 . 0 0 "[ . 1 . 2]" 1
435 1 109 LEU MD1 1 112 PHE QD 0.000 . 5.170 3.669 2.500 5.050 . 0 0 "[ . 1 . 2]" 1
436 1 109 LEU MD1 1 110 LEU H 0.000 . 5.800 4.312 2.217 4.790 . 0 0 "[ . 1 . 2]" 1
437 1 68 VAL MG1 1 94 TYR QD 0.000 . 5.800 5.036 3.976 5.858 0.058 5 0 "[ . 1 . 2]" 1
438 1 33 MET HA 1 34 VAL MG1 0.000 . 5.330 3.481 2.993 4.191 . 0 0 "[ . 1 . 2]" 1
439 1 17 VAL MG2 1 88 ARG HA 0.000 . 5.800 3.417 2.902 4.568 . 0 0 "[ . 1 . 2]" 1
440 1 59 HIS HA 1 68 VAL MG1 0.000 . 5.800 3.533 3.056 4.922 . 0 0 "[ . 1 . 2]" 1
441 1 67 LYS HA 1 68 VAL MG1 0.000 . 5.300 5.135 3.682 5.429 0.129 6 0 "[ . 1 . 2]" 1
442 1 14 ILE MG 1 15 PRO HD3 0.000 . 5.400 4.130 3.746 4.352 . 0 0 "[ . 1 . 2]" 1
443 1 35 PHE HB3 1 37 VAL MG1 0.000 . 5.800 4.880 4.545 5.089 . 0 0 "[ . 1 . 2]" 1
444 1 16 SER HA 1 17 VAL MG2 0.000 . 5.500 3.457 3.224 3.668 . 0 0 "[ . 1 . 2]" 1
445 1 16 SER QB 1 17 VAL MG2 0.000 . 5.730 4.368 4.236 4.516 . 0 0 "[ . 1 . 2]" 1
446 1 17 VAL MG2 1 37 VAL MG1 0.000 . 5.240 5.030 4.660 5.285 0.045 20 0 "[ . 1 . 2]" 1
447 1 35 PHE HB2 1 37 VAL MG1 0.000 . 5.670 3.641 3.208 3.865 . 0 0 "[ . 1 . 2]" 1
448 1 72 PRO HD3 1 91 LEU MD1 0.000 . 5.130 3.832 2.994 4.799 . 0 0 "[ . 1 . 2]" 1
449 1 71 PHE HA 1 71 PHE QE 0.000 . 5.800 5.672 5.641 5.698 . 0 0 "[ . 1 . 2]" 1
450 1 59 HIS HA 1 68 VAL MG2 0.000 . 5.650 4.124 3.282 4.578 . 0 0 "[ . 1 . 2]" 1
451 1 20 GLU HG2 1 34 VAL MG2 0.000 . 4.420 4.241 3.135 4.567 0.147 7 0 "[ . 1 . 2]" 1
452 1 100 TYR QD 1 101 LEU MD2 0.000 . 4.780 3.297 2.677 4.196 . 0 0 "[ . 1 . 2]" 1
453 1 75 ARG HB3 1 76 LEU H 0.000 . 5.620 4.058 3.404 4.368 . 0 0 "[ . 1 . 2]" 1
454 1 100 TYR QD 1 101 LEU HA 0.000 . 5.800 3.623 3.032 4.296 . 0 0 "[ . 1 . 2]" 1
455 1 55 PHE HB3 1 95 ILE MD 0.000 . 5.800 4.343 2.899 5.570 . 0 0 "[ . 1 . 2]" 1
456 1 11 GLU HG3 1 40 LEU MD2 0.000 . 5.330 3.563 2.653 4.787 . 0 0 "[ . 1 . 2]" 1
457 1 58 LEU MD1 1 112 PHE QB 0.000 . 5.030 3.853 2.787 4.902 . 0 0 "[ . 1 . 2]" 1
458 1 107 LYS HB2 1 108 GLU H 0.000 . 5.800 4.031 3.783 4.226 . 0 0 "[ . 1 . 2]" 1
459 1 109 LEU HA 1 112 PHE QB 0.000 . 5.430 2.207 1.662 2.568 . 0 0 "[ . 1 . 2]" 1
460 1 47 THR HA 1 48 VAL HB 0.000 . 5.800 4.764 4.564 5.015 . 0 0 "[ . 1 . 2]" 1
461 1 68 VAL MG1 1 98 ILE MD 0.000 . 5.400 3.068 2.181 5.447 0.047 5 0 "[ . 1 . 2]" 1
462 1 108 GLU HA 1 110 LEU HB2 0.000 . 5.800 5.151 4.311 5.835 0.035 4 0 "[ . 1 . 2]" 1
463 1 110 LEU MD1 1 118 PHE H 0.000 . 5.800 5.565 4.297 5.914 0.114 8 0 "[ . 1 . 2]" 1
464 1 69 PRO HG2 1 98 ILE H 0.000 . 5.800 4.597 4.021 4.888 . 0 0 "[ . 1 . 2]" 1
465 1 16 SER QB 1 36 ARG HB2 0.000 . 5.800 3.752 2.656 4.954 . 0 0 "[ . 1 . 2]" 1
466 1 69 PRO HB3 1 101 LEU MD1 0.000 . 5.800 3.773 2.634 4.964 . 0 0 "[ . 1 . 2]" 1
467 1 69 PRO HG2 1 97 GLY HA3 0.000 . 5.670 4.142 3.594 4.614 . 0 0 "[ . 1 . 2]" 1
468 1 88 ARG HA 1 91 LEU HB2 0.000 . 5.520 3.415 2.940 3.923 . 0 0 "[ . 1 . 2]" 1
469 1 17 VAL MG1 1 35 PHE H 0.000 . 5.800 3.444 3.150 3.940 . 0 0 "[ . 1 . 2]" 1
470 1 46 HIS HD2 1 48 VAL MG2 0.000 . 4.760 2.211 1.857 3.321 . 0 0 "[ . 1 . 2]" 1
471 1 15 PRO HD2 1 38 GLU HB2 0.000 . 5.800 3.329 2.871 4.667 . 0 0 "[ . 1 . 2]" 1
472 1 67 LYS HA 1 67 LYS HD2 0.000 . 5.410 4.138 2.009 4.718 . 0 0 "[ . 1 . 2]" 1
473 1 67 LYS HD2 1 101 LEU MD1 0.000 . 5.580 4.202 3.451 5.336 . 0 0 "[ . 1 . 2]" 1
474 1 67 LYS HD2 1 101 LEU MD2 0.000 . 5.430 4.145 2.931 5.306 . 0 0 "[ . 1 . 2]" 1
475 1 107 LYS HA 1 107 LYS HD2 0.000 . 5.640 3.897 3.036 4.477 . 0 0 "[ . 1 . 2]" 1
476 1 62 ILE HG13 1 68 VAL MG1 0.000 . 4.710 2.708 2.435 3.577 . 0 0 "[ . 1 . 2]" 1
477 1 66 TYR HH 1 68 VAL MG1 0.000 . 5.800 4.519 2.643 5.472 . 0 0 "[ . 1 . 2]" 1
478 1 66 TYR QE 1 68 VAL MG2 0.000 . 5.800 2.907 2.245 4.450 . 0 0 "[ . 1 . 2]" 1
479 1 66 TYR QD 1 68 VAL MG2 0.000 . 5.800 3.098 2.348 4.025 . 0 0 "[ . 1 . 2]" 1
480 1 35 PHE QE 1 37 VAL MG2 0.000 . 4.830 3.904 3.207 4.386 . 0 0 "[ . 1 . 2]" 1
481 1 67 LYS HA 1 101 LEU MD1 0.000 . 5.800 4.101 3.727 4.733 . 0 0 "[ . 1 . 2]" 1
482 1 114 ARG HA 1 115 LEU MD2 0.000 . 5.800 4.854 4.457 5.296 . 0 0 "[ . 1 . 2]" 1
483 1 64 LYS HA 1 65 LEU H 0.000 . 5.460 3.388 3.286 3.505 . 0 0 "[ . 1 . 2]" 1
484 1 63 LYS HB2 1 64 LYS H 0.000 . 5.800 3.943 2.290 4.277 . 0 0 "[ . 1 . 2]" 1
485 1 35 PHE QE 1 37 VAL MG1 0.000 . 5.120 2.400 2.162 2.926 . 0 0 "[ . 1 . 2]" 1
486 1 62 ILE HG13 1 68 VAL MG2 0.000 . 4.650 2.183 1.873 3.080 . 0 0 "[ . 1 . 2]" 1
487 1 64 LYS HA 1 64 LYS HD2 0.000 . 4.330 3.725 2.179 4.552 0.222 4 0 "[ . 1 . 2]" 1
488 1 60 LYS HA 1 63 LYS HD2 0.000 . 5.410 3.513 2.206 5.328 . 0 0 "[ . 1 . 2]" 1
489 1 63 LYS HA 1 63 LYS HD2 0.000 . 5.690 4.980 2.447 5.594 . 0 0 "[ . 1 . 2]" 1
490 1 63 LYS H 1 63 LYS HD2 0.000 . 5.770 4.531 3.280 5.019 . 0 0 "[ . 1 . 2]" 1
491 1 63 LYS HD2 1 64 LYS H 0.000 . 5.800 4.636 3.693 5.193 . 0 0 "[ . 1 . 2]" 1
492 1 62 ILE MD 1 109 LEU H 0.000 . 5.800 5.654 5.230 5.945 0.145 15 0 "[ . 1 . 2]" 1
493 1 62 ILE MD 1 106 PRO HD2 0.000 . 5.800 5.298 3.905 5.944 0.144 14 0 "[ . 1 . 2]" 1
494 1 57 ALA HA 1 60 LYS HD2 0.000 . 5.800 4.537 3.597 5.827 0.027 1 0 "[ . 1 . 2]" 1
495 1 60 LYS H 1 60 LYS HD2 0.000 . 5.800 4.502 3.577 4.956 . 0 0 "[ . 1 . 2]" 1
496 1 67 LYS HD2 1 68 VAL H 0.000 . 5.800 5.495 3.119 5.931 0.131 13 0 "[ . 1 . 2]" 1
497 1 105 VAL MG1 1 106 PRO HD2 0.000 . 5.310 4.635 4.015 5.017 . 0 0 "[ . 1 . 2]" 1
498 1 38 GLU HB3 1 47 THR MG 0.000 . 4.600 4.192 3.475 4.647 0.047 16 0 "[ . 1 . 2]" 1
499 1 63 LYS H 1 63 LYS HE2 0.000 . 5.590 5.007 4.459 5.587 . 0 0 "[ . 1 . 2]" 1
500 1 54 GLU HA 1 57 ALA MB 0.000 . 4.900 2.779 2.196 3.401 . 0 0 "[ . 1 . 2]" 1
501 1 35 PHE QE 1 95 ILE MG 0.000 . 5.800 5.291 4.223 5.888 0.088 2 0 "[ . 1 . 2]" 1
502 1 57 ALA HA 1 59 HIS QB 0.000 . 5.800 5.074 4.476 5.956 0.156 18 0 "[ . 1 . 2]" 1
503 1 33 MET ME 1 79 TRP HZ2 0.000 . 5.800 5.634 3.014 6.039 0.239 18 0 "[ . 1 . 2]" 1
504 1 62 ILE HA 1 65 LEU MD2 0.000 . 5.290 3.472 2.072 4.027 . 0 0 "[ . 1 . 2]" 1
505 1 65 LEU MD2 1 66 TYR QD 0.000 . 5.730 3.809 1.918 5.246 . 0 0 "[ . 1 . 2]" 1
506 1 62 ILE H 1 65 LEU MD2 0.000 . 5.800 5.486 3.885 5.887 0.087 2 0 "[ . 1 . 2]" 1
507 1 109 LEU HB2 1 115 LEU HB2 0.000 . 5.800 5.287 3.927 6.100 0.300 8 0 "[ . 1 . 2]" 1
508 1 52 TYR HA 1 55 PHE H 0.000 . 5.800 3.427 2.806 4.030 . 0 0 "[ . 1 . 2]" 1
509 1 97 GLY HA3 1 99 LEU H 0.000 . 5.800 4.543 4.360 4.865 . 0 0 "[ . 1 . 2]" 1
510 1 110 LEU HB3 1 111 GLU H 0.000 . 5.800 3.062 2.245 3.765 . 0 0 "[ . 1 . 2]" 1
511 1 110 LEU HB2 1 111 GLU H 0.000 . 5.800 3.155 2.708 3.686 . 0 0 "[ . 1 . 2]" 1
512 1 95 ILE HB 1 96 GLN H 0.000 . 5.800 2.770 2.314 4.141 . 0 0 "[ . 1 . 2]" 1
513 1 29 GLU H 1 29 GLU HG2 0.000 . 4.850 2.994 1.948 4.412 . 0 0 "[ . 1 . 2]" 1
514 1 61 ARG H 1 61 ARG HG2 0.000 . 5.450 3.956 2.171 4.528 . 0 0 "[ . 1 . 2]" 1
515 1 77 PRO HG2 1 79 TRP H 0.000 . 5.800 4.375 2.937 5.790 . 0 0 "[ . 1 . 2]" 1
516 1 24 PRO HD2 1 32 HIS HA 0.000 . 5.330 5.213 3.463 5.471 0.141 20 0 "[ . 1 . 2]" 1
517 1 61 ARG HA 1 61 ARG HD2 0.000 . 5.240 4.292 3.172 4.700 . 0 0 "[ . 1 . 2]" 1
518 1 31 SER HB2 1 33 MET H 0.000 . 5.800 4.247 2.484 5.573 . 0 0 "[ . 1 . 2]" 1
519 1 87 ARG HD2 1 91 LEU MD2 0.000 . 5.800 4.468 3.419 5.157 . 0 0 "[ . 1 . 2]" 1
520 1 24 PRO HD2 1 27 SER HB2 0.000 . 4.910 4.798 3.650 5.028 0.118 13 0 "[ . 1 . 2]" 1
521 1 18 GLY H 1 34 VAL MG2 0.000 . 5.800 4.353 3.060 4.887 . 0 0 "[ . 1 . 2]" 1
522 1 62 ILE MG 1 66 TYR HB2 0.000 . 5.740 5.760 5.554 5.836 0.096 16 0 "[ . 1 . 2]" 1
523 1 68 VAL HB 1 98 ILE MG 0.000 . 5.800 3.829 1.915 5.932 0.132 11 0 "[ . 1 . 2]" 1
524 1 62 ILE MG 1 68 VAL MG1 0.000 . 4.820 4.830 4.151 5.033 0.213 11 0 "[ . 1 . 2]" 1
525 1 63 LYS HE2 1 64 LYS H 0.000 . 5.800 5.262 4.389 5.831 0.031 10 0 "[ . 1 . 2]" 1
526 1 55 PHE QD 1 58 LEU MD2 0.000 . 5.800 2.592 1.844 3.865 . 0 0 "[ . 1 . 2]" 1
527 1 58 LEU MD2 1 109 LEU HA 0.000 . 5.700 4.537 3.837 5.420 . 0 0 "[ . 1 . 2]" 1
528 1 110 LEU H 1 113 LEU MD1 0.000 . 5.800 5.006 4.563 5.522 . 0 0 "[ . 1 . 2]" 1
529 1 58 LEU MD2 1 109 LEU MD1 0.000 . 4.580 2.422 1.789 4.220 . 0 0 "[ . 1 . 2]" 1
530 1 58 LEU MD1 1 109 LEU MD1 0.000 . 4.510 2.449 1.866 4.257 . 0 0 "[ . 1 . 2]" 1
531 1 109 LEU MD2 1 110 LEU H 0.000 . 5.800 4.249 3.661 4.854 . 0 0 "[ . 1 . 2]" 1
532 1 109 LEU MD2 1 112 PHE QD 0.000 . 5.800 5.291 4.209 5.822 0.022 8 0 "[ . 1 . 2]" 1
533 1 50 ARG HD2 1 112 PHE QB 0.000 . 5.800 5.637 4.645 5.907 0.107 20 0 "[ . 1 . 2]" 1
534 1 112 PHE HA 1 113 LEU H 0.000 . 5.800 3.529 3.449 3.614 . 0 0 "[ . 1 . 2]" 1
535 1 37 VAL MG2 1 50 ARG HA 0.000 . 5.800 5.257 4.259 5.873 0.073 5 0 "[ . 1 . 2]" 1
536 1 115 LEU MD1 1 118 PHE QD 0.000 . 5.400 4.656 3.272 5.510 0.110 10 0 "[ . 1 . 2]" 1
537 1 14 ILE MD 1 91 LEU HB2 0.000 . 5.800 2.615 1.881 4.164 . 0 0 "[ . 1 . 2]" 1
538 1 21 ALA HA 1 22 GLU HG2 0.000 . 5.800 4.574 3.771 5.937 0.137 4 0 "[ . 1 . 2]" 1
539 1 48 VAL HB 1 113 LEU MD1 0.000 . 4.500 4.182 2.750 4.603 0.103 13 0 "[ . 1 . 2]" 1
540 1 113 LEU MD1 1 115 LEU HB2 0.000 . 4.230 4.352 4.259 4.426 0.196 15 0 "[ . 1 . 2]" 1
541 1 113 LEU MD1 1 115 LEU MD1 0.000 . 3.310 1.957 1.790 2.132 . 0 0 "[ . 1 . 2]" 1
542 1 113 LEU MD1 1 114 ARG H 0.000 . 5.800 4.377 3.767 5.048 . 0 0 "[ . 1 . 2]" 1
543 1 36 ARG H 1 36 ARG HD2 0.000 . 5.800 3.620 1.925 5.111 . 0 0 "[ . 1 . 2]" 1
544 1 36 ARG HD2 1 37 VAL H 0.000 . 5.800 5.353 4.627 5.992 0.192 5 0 "[ . 1 . 2]" 1
545 1 36 ARG HD2 1 47 THR MG 0.000 . 5.310 4.100 2.551 5.359 0.049 13 0 "[ . 1 . 2]" 1
546 1 75 ARG HD2 1 76 LEU H 0.000 . 5.800 4.570 2.388 5.825 0.025 17 0 "[ . 1 . 2]" 1
547 1 76 LEU HA 1 76 LEU MD2 0.000 . 4.220 2.427 1.984 3.831 . 0 0 "[ . 1 . 2]" 1
548 1 76 LEU MD2 1 77 PRO HD3 0.000 . 4.900 3.699 2.974 4.872 . 0 0 "[ . 1 . 2]" 1
549 1 76 LEU MD2 1 77 PRO HD2 0.000 . 4.940 3.215 1.931 4.864 . 0 0 "[ . 1 . 2]" 1
550 1 73 SER HB2 1 76 LEU MD2 0.000 . 5.620 4.992 3.204 5.736 0.116 2 0 "[ . 1 . 2]" 1
551 1 76 LEU H 1 76 LEU MD2 0.000 . 5.800 3.678 2.241 4.544 . 0 0 "[ . 1 . 2]" 1
552 1 10 LEU MD2 1 104 GLU HG2 0.000 . 5.410 4.454 2.776 5.525 0.115 20 0 "[ . 1 . 2]" 1
553 1 10 LEU MD2 1 104 GLU HB3 0.000 . 4.880 3.969 2.025 4.946 0.066 11 0 "[ . 1 . 2]" 1
554 1 55 PHE HA 1 91 LEU MD1 0.000 . 5.800 5.237 4.435 5.817 0.017 12 0 "[ . 1 . 2]" 1
555 1 79 TRP HE3 1 87 ARG HA 0.000 . 5.800 5.621 3.037 6.039 0.239 18 0 "[ . 1 . 2]" 1
556 1 76 LEU MD1 1 87 ARG HA 0.000 . 5.570 4.733 2.607 5.635 0.065 11 0 "[ . 1 . 2]" 1
557 1 76 LEU MD2 1 87 ARG HA 0.000 . 5.700 5.122 4.129 5.842 0.142 14 0 "[ . 1 . 2]" 1
558 1 12 VAL MG1 1 39 VAL HB 0.000 . 3.890 4.045 3.948 4.098 0.208 9 0 "[ . 1 . 2]" 1
559 1 12 VAL MG1 1 99 LEU HB3 0.000 . 4.000 4.018 3.563 4.244 0.244 7 0 "[ . 1 . 2]" 1
560 1 38 GLU HG2 1 46 HIS QB 0.000 . 5.800 5.804 5.478 5.906 0.106 16 0 "[ . 1 . 2]" 1
561 1 38 GLU HG2 1 47 THR HA 0.000 . 5.800 3.808 1.834 4.569 . 0 0 "[ . 1 . 2]" 1
562 1 15 PRO HD2 1 38 GLU HG2 0.000 . 5.800 5.592 4.389 5.864 0.064 6 0 "[ . 1 . 2]" 1
563 1 38 GLU HG2 1 45 ARG HG2 0.000 . 5.800 5.068 3.347 5.902 0.102 8 0 "[ . 1 . 2]" 1
564 1 61 ARG H 1 61 ARG HG3 0.000 . 5.640 3.962 2.363 4.703 . 0 0 "[ . 1 . 2]" 1
565 1 44 ARG HG2 1 45 ARG H 0.000 . 5.800 4.854 3.916 5.356 . 0 0 "[ . 1 . 2]" 1
566 1 14 ILE HA 1 15 PRO HG2 0.000 . 5.800 4.330 4.111 4.540 . 0 0 "[ . 1 . 2]" 1
567 1 19 PRO HG2 1 20 GLU H 0.000 . 5.800 5.112 4.301 5.805 0.005 13 0 "[ . 1 . 2]" 1
568 1 122 PRO HG2 1 123 LYS H 0.000 . 5.800 4.728 2.199 5.776 . 0 0 "[ . 1 . 2]" 1
569 1 18 GLY HA3 1 19 PRO HG2 0.000 . 5.710 4.978 4.415 5.695 . 0 0 "[ . 1 . 2]" 1
570 1 10 LEU HB2 1 41 CYS HA 0.000 . 5.800 4.868 3.013 5.810 0.010 2 0 "[ . 1 . 2]" 1
571 1 52 TYR QD 1 74 LYS HA 0.000 . 5.800 4.795 3.476 5.845 0.045 2 0 "[ . 1 . 2]" 1
572 1 37 VAL MG1 1 50 ARG HA 0.000 . 5.800 5.587 4.805 5.898 0.098 11 0 "[ . 1 . 2]" 1
573 1 62 ILE MG 1 66 TYR HB3 0.000 . 4.610 4.663 4.585 4.807 0.197 20 0 "[ . 1 . 2]" 1
574 1 109 LEU MD1 1 112 PHE H 0.000 . 5.700 4.488 4.059 4.797 . 0 0 "[ . 1 . 2]" 1
575 1 62 ILE HA 1 65 LEU MD1 0.000 . 5.540 3.847 2.842 5.423 . 0 0 "[ . 1 . 2]" 1
576 1 65 LEU HB3 1 65 LEU MD1 0.000 . 2.890 2.453 2.404 2.493 . 0 0 "[ . 1 . 2]" 1
577 1 59 HIS HD2 1 63 LYS HE2 0.000 . 5.800 5.196 3.415 5.885 0.085 8 0 "[ . 1 . 2]" 1
578 1 56 HIS HA 1 59 HIS HD2 0.000 . 5.800 5.487 4.652 5.995 0.195 19 0 "[ . 1 . 2]" 1
579 1 55 PHE HA 1 58 LEU HG 0.000 . 5.800 3.944 2.361 4.787 . 0 0 "[ . 1 . 2]" 1
580 1 92 GLU HG3 1 93 ALA H 0.000 . 5.800 4.395 2.543 5.109 . 0 0 "[ . 1 . 2]" 1
581 1 54 GLU HA 1 57 ALA H 0.000 . 5.800 3.374 3.121 4.074 . 0 0 "[ . 1 . 2]" 1
582 1 62 ILE MG 1 108 GLU HA 0.000 . 5.520 5.174 4.565 5.582 0.062 15 0 "[ . 1 . 2]" 1
583 1 105 VAL HA 1 106 PRO HD2 0.000 . 5.040 2.297 1.915 2.708 . 0 0 "[ . 1 . 2]" 1
584 1 13 HIS HE1 1 38 GLU HB2 0.000 . 5.800 4.999 3.929 5.853 0.053 12 0 "[ . 1 . 2]" 1
585 1 13 HIS HE1 1 38 GLU HB3 0.000 . 5.800 4.441 3.591 5.810 0.010 16 0 "[ . 1 . 2]" 1
586 1 38 GLU HB3 1 47 THR HA 0.000 . 5.800 4.288 3.685 4.877 . 0 0 "[ . 1 . 2]" 1
587 1 17 VAL MG1 1 37 VAL MG1 0.000 . 5.800 5.804 5.468 5.898 0.098 14 0 "[ . 1 . 2]" 1
588 1 14 ILE MG 1 36 ARG HA 0.000 . 5.550 4.210 3.997 4.475 . 0 0 "[ . 1 . 2]" 1
589 1 11 GLU QB 1 40 LEU MD1 0.000 . 5.750 2.513 2.031 3.742 . 0 0 "[ . 1 . 2]" 1
590 1 48 VAL MG1 1 50 ARG HD3 0.000 . 5.800 3.816 1.851 5.200 . 0 0 "[ . 1 . 2]" 1
591 1 36 ARG HA 1 48 VAL MG1 0.000 . 4.930 4.934 4.776 4.996 0.066 5 0 "[ . 1 . 2]" 1
592 1 46 HIS QB 1 48 VAL MG1 0.000 . 4.940 4.909 4.076 5.103 0.163 5 0 "[ . 1 . 2]" 1
593 1 46 HIS HD2 1 48 VAL MG1 0.000 . 4.820 4.290 3.228 4.947 0.127 4 0 "[ . 1 . 2]" 1
594 1 67 LYS HG2 1 101 LEU MD1 0.000 . 5.420 4.427 1.984 5.479 0.059 15 0 "[ . 1 . 2]" 1
595 1 68 VAL MG1 1 101 LEU MD1 0.000 . 5.800 4.046 3.078 4.507 . 0 0 "[ . 1 . 2]" 1
596 1 66 TYR H 1 68 VAL MG1 0.000 . 5.800 5.185 3.984 5.825 0.025 8 0 "[ . 1 . 2]" 1
597 1 71 PHE HB3 1 94 TYR QD 0.000 . 5.800 5.519 4.112 5.913 0.113 11 0 "[ . 1 . 2]" 1
598 1 95 ILE MG 1 98 ILE MD 0.000 . 4.610 2.986 2.184 4.117 . 0 0 "[ . 1 . 2]" 1
599 1 100 TYR HA 1 101 LEU H 0.000 . 5.800 3.464 3.317 3.540 . 0 0 "[ . 1 . 2]" 1
600 1 96 GLN HE22 1 100 TYR HB2 0.000 . 5.800 4.962 2.346 5.951 0.151 10 0 "[ . 1 . 2]" 1
601 1 109 LEU HB2 1 113 LEU MD1 0.000 . 4.260 4.038 2.399 4.439 0.179 9 0 "[ . 1 . 2]" 1
602 1 99 LEU MD2 1 105 VAL HA 0.000 . 5.800 4.372 2.438 5.907 0.107 15 0 "[ . 1 . 2]" 1
603 1 99 LEU MD2 1 105 VAL HB 0.000 . 5.550 4.248 2.018 5.626 0.076 5 0 "[ . 1 . 2]" 1
604 1 12 VAL MG2 1 99 LEU MD2 0.000 . 3.610 2.178 1.942 2.561 . 0 0 "[ . 1 . 2]" 1
605 1 39 VAL MG1 1 41 CYS HB3 0.000 . 4.640 3.525 2.370 4.589 . 0 0 "[ . 1 . 2]" 1
606 1 69 PRO HD2 1 98 ILE HG13 0.000 . 5.800 5.529 2.690 5.892 0.092 16 0 "[ . 1 . 2]" 1
607 1 68 VAL MG2 1 98 ILE HG13 0.000 . 5.730 5.319 4.639 5.940 0.210 20 0 "[ . 1 . 2]" 1
608 1 69 PRO HD2 1 98 ILE MD 0.000 . 5.360 4.056 2.944 4.406 . 0 0 "[ . 1 . 2]" 1
609 1 55 PHE HB2 1 56 HIS H 0.000 . 5.800 3.767 2.955 4.118 . 0 0 "[ . 1 . 2]" 1
610 1 96 GLN HA 1 99 LEU MD1 0.000 . 4.870 3.311 1.926 4.304 . 0 0 "[ . 1 . 2]" 1
611 1 12 VAL HA 1 40 LEU H 0.000 . 5.800 2.892 2.686 3.391 . 0 0 "[ . 1 . 2]" 1
612 1 93 ALA HA 1 96 GLN HB2 0.000 . 5.590 4.333 3.520 5.387 . 0 0 "[ . 1 . 2]" 1
613 1 57 ALA HA 1 60 LYS HG3 0.000 . 5.800 3.334 2.279 4.129 . 0 0 "[ . 1 . 2]" 1
614 1 57 ALA HA 1 61 ARG H 0.000 . 5.800 4.260 3.874 4.596 . 0 0 "[ . 1 . 2]" 1
615 1 67 LYS HE2 1 101 LEU MD1 0.000 . 5.800 5.316 3.426 5.875 0.075 10 0 "[ . 1 . 2]" 1
616 1 67 LYS HE2 1 101 LEU MD2 0.000 . 5.780 5.061 3.144 5.804 0.024 20 0 "[ . 1 . 2]" 1
617 1 67 LYS H 1 67 LYS HD2 0.000 . 5.800 4.477 3.701 4.997 . 0 0 "[ . 1 . 2]" 1
618 1 67 LYS HB2 1 101 LEU MD1 0.000 . 5.800 3.333 2.425 5.239 . 0 0 "[ . 1 . 2]" 1
619 1 92 GLU HB2 1 93 ALA H 0.000 . 5.800 3.679 2.195 4.104 . 0 0 "[ . 1 . 2]" 1
620 1 39 VAL MG1 1 41 CYS HB2 0.000 . 5.410 3.519 2.697 4.549 . 0 0 "[ . 1 . 2]" 1
621 1 39 VAL HA 1 99 LEU MD2 0.000 . 5.800 5.252 4.496 5.804 0.004 1 0 "[ . 1 . 2]" 1
622 1 39 VAL HA 1 105 VAL HB 0.000 . 5.800 5.835 5.607 5.947 0.147 4 0 "[ . 1 . 2]" 1
623 1 111 GLU HA 1 113 LEU H 0.000 . 5.800 4.832 4.447 5.160 . 0 0 "[ . 1 . 2]" 1
624 1 41 CYS HA 1 42 SER HA 0.000 . 5.800 4.304 4.216 4.356 . 0 0 "[ . 1 . 2]" 1
625 1 91 LEU HA 1 94 TYR QD 0.000 . 5.800 3.087 1.928 4.439 . 0 0 "[ . 1 . 2]" 1
626 1 110 LEU MD1 1 118 PHE QD 0.000 . 5.800 5.192 3.761 5.921 0.121 17 0 "[ . 1 . 2]" 1
627 1 48 VAL MG1 1 112 PHE QD 0.000 . 5.800 5.269 4.218 5.967 0.167 18 0 "[ . 1 . 2]" 1
628 1 21 ALA HA 1 22 GLU HB3 0.000 . 5.800 4.819 4.353 5.785 . 0 0 "[ . 1 . 2]" 1
629 1 99 LEU HA 1 99 LEU MD2 0.000 . 4.500 3.039 2.055 3.658 . 0 0 "[ . 1 . 2]" 1
630 1 68 VAL HA 1 98 ILE MG 0.000 . 5.800 2.149 1.834 3.991 . 0 0 "[ . 1 . 2]" 1
631 1 97 GLY HA3 1 101 LEU MD1 0.000 . 5.800 4.061 3.524 4.718 . 0 0 "[ . 1 . 2]" 1
632 1 85 GLU HA 1 86 GLN H 0.000 . 5.800 3.523 3.451 3.609 . 0 0 "[ . 1 . 2]" 1
633 1 79 TRP HE3 1 84 LEU MD1 0.000 . 5.080 4.074 2.712 5.192 0.112 5 0 "[ . 1 . 2]" 1
634 1 52 TYR QD 1 84 LEU MD1 0.000 . 5.670 5.711 5.448 5.797 0.127 13 0 "[ . 1 . 2]" 1
635 1 79 TRP HZ2 1 84 LEU MD1 0.000 . 5.740 4.747 1.911 5.796 0.056 11 0 "[ . 1 . 2]" 1
636 1 60 LYS HE2 1 64 LYS H 0.000 . 5.800 5.922 5.841 6.021 0.221 11 0 "[ . 1 . 2]" 1
637 1 19 PRO HA 1 33 MET HA 0.000 . 4.740 2.130 1.707 3.216 . 0 0 "[ . 1 . 2]" 1
638 1 91 LEU H 1 91 LEU MD2 0.000 . 5.800 2.127 1.985 2.282 . 0 0 "[ . 1 . 2]" 1
639 1 54 GLU H 1 55 PHE H 0.000 . 5.100 2.609 2.444 2.803 . 0 0 "[ . 1 . 2]" 1
640 1 38 GLU H 1 48 VAL H 0.000 . 5.800 4.549 4.321 4.950 . 0 0 "[ . 1 . 2]" 1
641 1 51 ARG HA 1 52 TYR H 0.000 . 5.490 2.382 2.154 2.581 . 0 0 "[ . 1 . 2]" 1
642 1 67 LYS HB2 1 68 VAL H 0.000 . 4.590 4.235 4.086 4.588 . 0 0 "[ . 1 . 2]" 1
643 1 67 LYS HG2 1 68 VAL H 0.000 . 5.270 4.325 3.487 5.114 . 0 0 "[ . 1 . 2]" 1
644 1 68 VAL H 1 69 PRO HD2 0.000 . 5.710 4.985 4.728 5.331 . 0 0 "[ . 1 . 2]" 1
645 1 120 THR HA 1 121 ASP H 0.000 . 4.940 2.372 2.074 3.226 . 0 0 "[ . 1 . 2]" 1
646 1 40 LEU HG 1 43 GLY H 0.000 . 5.800 4.313 3.263 5.807 0.007 17 0 "[ . 1 . 2]" 1
647 1 41 CYS H 1 43 GLY H 0.000 . 5.800 3.897 3.194 5.152 . 0 0 "[ . 1 . 2]" 1
648 1 97 GLY H 1 98 ILE HG12 0.000 . 5.800 4.248 3.949 5.821 0.021 11 0 "[ . 1 . 2]" 1
649 1 96 GLN HA 1 97 GLY H 0.000 . 4.860 3.502 3.413 3.553 . 0 0 "[ . 1 . 2]" 1
650 1 94 TYR HA 1 97 GLY H 0.000 . 5.800 3.374 3.023 3.726 . 0 0 "[ . 1 . 2]" 1
651 1 15 PRO HA 1 16 SER H 0.000 . 5.020 3.546 3.487 3.600 . 0 0 "[ . 1 . 2]" 1
652 1 15 PRO HD3 1 16 SER H 0.000 . 5.800 3.955 3.577 4.213 . 0 0 "[ . 1 . 2]" 1
653 1 14 ILE MG 1 16 SER H 0.000 . 5.390 2.711 2.380 2.983 . 0 0 "[ . 1 . 2]" 1
654 1 15 PRO HG2 1 16 SER H 0.000 . 4.900 2.900 2.363 4.341 . 0 0 "[ . 1 . 2]" 1
655 1 15 PRO HB2 1 16 SER H 0.000 . 5.800 3.356 2.837 3.741 . 0 0 "[ . 1 . 2]" 1
656 1 89 GLN HB2 1 90 GLY H 0.000 . 5.100 3.882 3.434 4.032 . 0 0 "[ . 1 . 2]" 1
657 1 14 ILE HA 1 16 SER H 0.000 . 5.800 3.775 3.537 3.917 . 0 0 "[ . 1 . 2]" 1
658 1 22 GLU H 1 23 GLY H 0.000 . 5.160 4.397 4.191 4.590 . 0 0 "[ . 1 . 2]" 1
659 1 22 GLU HA 1 23 GLY H 0.000 . 4.110 2.209 1.944 2.517 . 0 0 "[ . 1 . 2]" 1
660 1 23 GLY H 1 24 PRO HD2 0.000 . 5.800 4.034 2.658 5.204 . 0 0 "[ . 1 . 2]" 1
661 1 23 GLY H 1 24 PRO HB3 0.000 . 5.800 5.530 4.575 5.872 0.072 6 0 "[ . 1 . 2]" 1
662 1 61 ARG QB 1 62 ILE H 0.000 . 4.990 2.396 2.020 2.685 . 0 0 "[ . 1 . 2]" 1
663 1 62 ILE H 1 62 ILE MD 0.000 . 5.460 3.635 3.455 3.762 . 0 0 "[ . 1 . 2]" 1
664 1 62 ILE H 1 62 ILE HG12 0.000 . 4.980 1.995 1.779 2.123 . 0 0 "[ . 1 . 2]" 1
665 1 62 ILE H 1 62 ILE HG13 0.000 . 4.750 3.008 2.813 3.175 . 0 0 "[ . 1 . 2]" 1
666 1 17 VAL HB 1 18 GLY H 0.000 . 5.570 3.916 3.549 4.219 . 0 0 "[ . 1 . 2]" 1
667 1 17 VAL MG2 1 18 GLY H 0.000 . 5.530 4.192 4.029 4.308 . 0 0 "[ . 1 . 2]" 1
668 1 17 VAL MG1 1 18 GLY H 0.000 . 4.870 2.528 2.019 2.887 . 0 0 "[ . 1 . 2]" 1
669 1 18 GLY H 1 35 PHE HA 0.000 . 5.700 3.248 2.843 3.679 . 0 0 "[ . 1 . 2]" 1
670 1 17 VAL HA 1 18 GLY H 0.000 . 4.410 2.260 2.190 2.394 . 0 0 "[ . 1 . 2]" 1
671 1 18 GLY H 1 34 VAL H 0.000 . 5.230 3.248 2.819 3.897 . 0 0 "[ . 1 . 2]" 1
672 1 119 PRO HA 1 120 THR H 0.000 . 4.410 2.858 2.181 3.600 . 0 0 "[ . 1 . 2]" 1
673 1 119 PRO HB2 1 120 THR H 0.000 . 5.800 2.825 2.018 4.155 . 0 0 "[ . 1 . 2]" 1
674 1 52 TYR HB2 1 53 SER H 0.000 . 5.800 3.795 2.899 4.170 . 0 0 "[ . 1 . 2]" 1
675 1 57 ALA MB 1 60 LYS H 0.000 . 5.420 4.586 4.407 4.742 . 0 0 "[ . 1 . 2]" 1
676 1 60 LYS H 1 60 LYS HG2 0.000 . 4.660 2.684 2.269 4.354 . 0 0 "[ . 1 . 2]" 1
677 1 60 LYS H 1 61 ARG QB 0.000 . 5.650 4.460 4.264 4.785 . 0 0 "[ . 1 . 2]" 1
678 1 59 HIS QB 1 60 LYS H 0.000 . 4.930 2.698 2.480 3.662 . 0 0 "[ . 1 . 2]" 1
679 1 57 ALA HA 1 60 LYS H 0.000 . 5.570 3.430 3.130 3.672 . 0 0 "[ . 1 . 2]" 1
680 1 59 HIS HA 1 60 LYS H 0.000 . 5.800 3.568 3.478 3.629 . 0 0 "[ . 1 . 2]" 1
681 1 60 LYS H 1 62 ILE H 0.000 . 5.800 4.282 4.142 4.488 . 0 0 "[ . 1 . 2]" 1
682 1 124 ALA HA 1 125 SER H 0.000 . 5.550 2.340 2.127 3.529 . 0 0 "[ . 1 . 2]" 1
683 1 124 ALA MB 1 125 SER H 0.000 . 5.800 3.359 2.010 3.610 . 0 0 "[ . 1 . 2]" 1
684 1 99 LEU MD2 1 102 ASN H 0.000 . 5.800 5.620 4.694 5.948 0.148 13 0 "[ . 1 . 2]" 1
685 1 101 LEU HB2 1 102 ASN H 0.000 . 5.800 2.376 1.979 2.581 . 0 0 "[ . 1 . 2]" 1
686 1 101 LEU HB3 1 102 ASN H 0.000 . 5.240 3.218 3.033 3.354 . 0 0 "[ . 1 . 2]" 1
687 1 98 ILE HA 1 102 ASN H 0.000 . 5.800 4.159 3.683 4.941 . 0 0 "[ . 1 . 2]" 1
688 1 99 LEU HA 1 102 ASN H 0.000 . 5.180 4.195 3.738 4.760 . 0 0 "[ . 1 . 2]" 1
689 1 101 LEU H 1 102 ASN H 0.000 . 4.700 2.894 2.695 3.059 . 0 0 "[ . 1 . 2]" 1
690 1 102 ASN H 1 103 GLN H 0.000 . 5.000 2.353 1.606 3.026 . 0 0 "[ . 1 . 2]" 1
691 1 46 HIS QB 1 47 THR H 0.000 . 4.460 3.284 2.578 3.785 . 0 0 "[ . 1 . 2]" 1
692 1 46 HIS HA 1 47 THR H 0.000 . 4.280 2.075 1.932 2.259 . 0 0 "[ . 1 . 2]" 1
693 1 110 LEU HA 1 113 LEU H 0.000 . 5.550 4.100 3.655 4.671 . 0 0 "[ . 1 . 2]" 1
694 1 113 LEU H 1 114 ARG H 0.000 . 4.900 2.242 1.979 2.469 . 0 0 "[ . 1 . 2]" 1
695 1 113 LEU H 1 115 LEU MD2 0.000 . 4.630 3.971 3.691 4.405 . 0 0 "[ . 1 . 2]" 1
696 1 112 PHE QB 1 113 LEU H 0.000 . 5.350 2.470 2.143 2.701 . 0 0 "[ . 1 . 2]" 1
697 1 60 LYS HB2 1 61 ARG H 0.000 . 4.400 3.658 2.712 4.169 . 0 0 "[ . 1 . 2]" 1
698 1 60 LYS HG2 1 61 ARG H 0.000 . 5.750 3.822 2.967 4.668 . 0 0 "[ . 1 . 2]" 1
699 1 61 ARG H 1 62 ILE MG 0.000 . 5.800 4.461 4.170 4.731 . 0 0 "[ . 1 . 2]" 1
700 1 61 ARG H 1 63 LYS HG2 0.000 . 5.800 4.941 4.311 5.807 0.007 6 0 "[ . 1 . 2]" 1
701 1 58 LEU MD1 1 61 ARG H 0.000 . 5.800 5.151 4.373 5.895 0.095 17 0 "[ . 1 . 2]" 1
702 1 57 ALA MB 1 61 ARG H 0.000 . 5.800 4.731 4.350 5.028 . 0 0 "[ . 1 . 2]" 1
703 1 113 LEU QB 1 114 ARG H 0.000 . 5.100 3.367 2.976 3.655 . 0 0 "[ . 1 . 2]" 1
704 1 60 LYS HA 1 61 ARG H 0.000 . 5.460 3.479 3.389 3.518 . 0 0 "[ . 1 . 2]" 1
705 1 60 LYS HE2 1 61 ARG H 0.000 . 5.800 4.667 3.188 5.433 . 0 0 "[ . 1 . 2]" 1
706 1 58 LEU HA 1 61 ARG H 0.000 . 5.800 3.562 2.914 4.191 . 0 0 "[ . 1 . 2]" 1
707 1 61 ARG H 1 62 ILE HA 0.000 . 5.800 5.131 4.985 5.304 . 0 0 "[ . 1 . 2]" 1
708 1 60 LYS H 1 61 ARG H 0.000 . 4.730 2.597 2.485 2.753 . 0 0 "[ . 1 . 2]" 1
709 1 61 ARG H 1 62 ILE H 0.000 . 4.570 2.580 2.383 2.764 . 0 0 "[ . 1 . 2]" 1
710 1 114 ARG H 1 115 LEU H 0.000 . 4.560 2.675 2.485 2.824 . 0 0 "[ . 1 . 2]" 1
711 1 99 LEU HB2 1 100 TYR H 0.000 . 5.330 3.977 2.744 4.326 . 0 0 "[ . 1 . 2]" 1
712 1 113 LEU HA 1 114 ARG H 0.000 . 5.320 3.191 3.025 3.328 . 0 0 "[ . 1 . 2]" 1
713 1 114 ARG H 1 115 LEU MD2 0.000 . 5.400 4.326 4.036 4.613 . 0 0 "[ . 1 . 2]" 1
714 1 64 LYS H 1 64 LYS HB2 0.000 . 4.230 2.534 2.310 2.788 . 0 0 "[ . 1 . 2]" 1
715 1 63 LYS HG2 1 64 LYS H 0.000 . 5.150 3.505 2.632 4.792 . 0 0 "[ . 1 . 2]" 1
716 1 127 TRP HA 1 128 GLY H 0.000 . 4.410 2.396 2.019 3.515 . 0 0 "[ . 1 . 2]" 1
717 1 67 LYS HA 1 68 VAL H 0.000 . 3.800 2.032 1.947 2.133 . 0 0 "[ . 1 . 2]" 1
718 1 99 LEU H 1 100 TYR H 0.000 . 4.780 2.569 2.402 2.703 . 0 0 "[ . 1 . 2]" 1
719 1 63 LYS H 1 64 LYS H 0.000 . 4.950 2.531 2.354 2.756 . 0 0 "[ . 1 . 2]" 1
720 1 93 ALA HA 1 95 ILE H 0.000 . 5.780 4.717 4.513 4.954 . 0 0 "[ . 1 . 2]" 1
721 1 69 PRO HA 1 70 ASP H 0.000 . 4.020 2.802 2.111 3.589 . 0 0 "[ . 1 . 2]" 1
722 1 62 ILE MG 1 66 TYR H 0.000 . 5.020 4.184 3.899 4.866 . 0 0 "[ . 1 . 2]" 1
723 1 70 ASP H 1 70 ASP QB 0.000 . 3.780 2.470 2.236 2.845 . 0 0 "[ . 1 . 2]" 1
724 1 69 PRO HB3 1 70 ASP H 0.000 . 4.200 3.135 2.418 4.231 0.031 13 0 "[ . 1 . 2]" 1
725 1 98 ILE MG 1 99 LEU H 0.000 . 4.850 3.978 2.911 4.212 . 0 0 "[ . 1 . 2]" 1
726 1 98 ILE HB 1 99 LEU H 0.000 . 5.150 3.565 2.333 3.884 . 0 0 "[ . 1 . 2]" 1
727 1 96 GLN HA 1 99 LEU H 0.000 . 5.800 3.483 3.216 3.790 . 0 0 "[ . 1 . 2]" 1
728 1 98 ILE HA 1 99 LEU H 0.000 . 5.800 3.456 3.383 3.535 . 0 0 "[ . 1 . 2]" 1
729 1 62 ILE HA 1 64 LYS H 0.000 . 5.570 3.739 3.385 4.039 . 0 0 "[ . 1 . 2]" 1
730 1 88 ARG HA 1 89 GLN H 0.000 . 5.800 3.529 3.340 3.607 . 0 0 "[ . 1 . 2]" 1
731 1 89 GLN H 1 89 GLN HG2 0.000 . 4.980 4.462 4.209 4.633 . 0 0 "[ . 1 . 2]" 1
732 1 88 ARG H 1 89 GLN H 0.000 . 5.140 2.824 2.464 3.017 . 0 0 "[ . 1 . 2]" 1
733 1 89 GLN H 1 89 GLN HG3 0.000 . 5.090 4.463 4.098 4.612 . 0 0 "[ . 1 . 2]" 1
734 1 89 GLN H 1 89 GLN HB2 0.000 . 4.340 2.556 2.296 2.780 . 0 0 "[ . 1 . 2]" 1
735 1 62 ILE HB 1 66 TYR H 0.000 . 5.800 3.229 2.961 3.951 . 0 0 "[ . 1 . 2]" 1
736 1 103 GLN HA 1 104 GLU H 0.000 . 5.050 3.275 2.262 3.605 . 0 0 "[ . 1 . 2]" 1
737 1 102 ASN HB3 1 104 GLU H 0.000 . 5.250 4.703 4.367 5.327 0.077 18 0 "[ . 1 . 2]" 1
738 1 104 GLU H 1 104 GLU HG2 0.000 . 4.520 3.804 3.258 4.710 0.190 12 0 "[ . 1 . 2]" 1
739 1 111 GLU H 1 111 GLU QB 0.000 . 3.850 2.324 2.177 2.487 . 0 0 "[ . 1 . 2]" 1
740 1 103 GLN HG2 1 104 GLU H 0.000 . 4.760 4.422 2.789 4.919 0.159 9 0 "[ . 1 . 2]" 1
741 1 110 LEU MD2 1 111 GLU H 0.000 . 5.390 4.683 3.983 4.863 . 0 0 "[ . 1 . 2]" 1
742 1 101 LEU HB2 1 104 GLU H 0.000 . 5.070 5.155 5.012 5.309 0.239 18 0 "[ . 1 . 2]" 1
743 1 102 ASN HA 1 104 GLU H 0.000 . 5.800 4.444 3.854 5.649 . 0 0 "[ . 1 . 2]" 1
744 1 104 GLU H 1 105 VAL H 0.000 . 5.390 4.089 3.222 4.767 . 0 0 "[ . 1 . 2]" 1
745 1 102 ASN H 1 104 GLU H 0.000 . 5.800 3.141 2.784 3.690 . 0 0 "[ . 1 . 2]" 1
746 1 111 GLU H 1 112 PHE QB 0.000 . 5.800 4.241 3.913 4.544 . 0 0 "[ . 1 . 2]" 1
747 1 102 ASN HB2 1 104 GLU H 0.000 . 5.800 5.641 5.140 5.878 0.078 12 0 "[ . 1 . 2]" 1
748 1 28 PRO HB3 1 29 GLU H 0.000 . 5.140 4.042 3.513 4.423 . 0 0 "[ . 1 . 2]" 1
749 1 28 PRO HB2 1 29 GLU H 0.000 . 4.550 2.924 2.021 3.886 . 0 0 "[ . 1 . 2]" 1
750 1 115 LEU H 1 115 LEU MD1 0.000 . 5.160 3.821 3.557 4.007 . 0 0 "[ . 1 . 2]" 1
751 1 115 LEU H 1 115 LEU HB2 0.000 . 4.360 2.598 2.348 2.826 . 0 0 "[ . 1 . 2]" 1
752 1 113 LEU QB 1 115 LEU H 0.000 . 5.440 3.443 2.969 3.936 . 0 0 "[ . 1 . 2]" 1
753 1 110 LEU MD1 1 115 LEU H 0.000 . 5.800 3.957 2.862 4.796 . 0 0 "[ . 1 . 2]" 1
754 1 64 LYS HB2 1 65 LEU H 0.000 . 5.290 3.757 3.004 4.319 . 0 0 "[ . 1 . 2]" 1
755 1 65 LEU H 1 65 LEU HB2 0.000 . 4.350 2.600 2.307 2.790 . 0 0 "[ . 1 . 2]" 1
756 1 106 PRO HB2 1 109 LEU H 0.000 . 5.280 2.782 2.039 4.313 . 0 0 "[ . 1 . 2]" 1
757 1 109 LEU H 1 109 LEU MD2 0.000 . 5.250 3.126 1.724 4.294 . 0 0 "[ . 1 . 2]" 1
758 1 64 LYS HB3 1 65 LEU H 0.000 . 5.800 3.603 2.808 4.280 . 0 0 "[ . 1 . 2]" 1
759 1 107 LYS HA 1 109 LEU H 0.000 . 5.800 4.104 3.785 4.637 . 0 0 "[ . 1 . 2]" 1
760 1 108 GLU HA 1 109 LEU H 0.000 . 5.800 3.548 3.404 3.636 . 0 0 "[ . 1 . 2]" 1
761 1 28 PRO HA 1 29 GLU H 0.000 . 4.880 3.463 3.212 3.563 . 0 0 "[ . 1 . 2]" 1
762 1 114 ARG HA 1 115 LEU H 0.000 . 4.640 2.538 2.217 2.893 . 0 0 "[ . 1 . 2]" 1
763 1 113 LEU HA 1 115 LEU H 0.000 . 5.800 5.021 4.459 5.384 . 0 0 "[ . 1 . 2]" 1
764 1 64 LYS H 1 65 LEU H 0.000 . 3.920 2.410 2.162 2.636 . 0 0 "[ . 1 . 2]" 1
765 1 85 GLU H 1 86 GLN H 0.000 . 4.940 2.784 2.421 3.102 . 0 0 "[ . 1 . 2]" 1
766 1 109 LEU H 1 110 LEU H 0.000 . 4.670 2.397 2.168 2.608 . 0 0 "[ . 1 . 2]" 1
767 1 108 GLU HB2 1 109 LEU H 0.000 . 5.410 3.835 2.973 4.278 . 0 0 "[ . 1 . 2]" 1
768 1 106 PRO HB3 1 109 LEU H 0.000 . 5.420 4.146 3.373 5.469 0.049 16 0 "[ . 1 . 2]" 1
769 1 108 GLU H 1 108 GLU HG2 0.000 . 5.100 4.122 1.948 4.742 . 0 0 "[ . 1 . 2]" 1
770 1 107 LYS HG2 1 108 GLU H 0.000 . 5.470 4.932 3.879 5.224 . 0 0 "[ . 1 . 2]" 1
771 1 33 MET HG3 1 34 VAL H 0.000 . 5.780 3.381 2.299 4.615 . 0 0 "[ . 1 . 2]" 1
772 1 33 MET ME 1 34 VAL H 0.000 . 5.510 3.887 2.957 4.434 . 0 0 "[ . 1 . 2]" 1
773 1 16 SER QB 1 17 VAL H 0.000 . 4.360 2.688 2.338 2.843 . 0 0 "[ . 1 . 2]" 1
774 1 19 PRO HA 1 34 VAL H 0.000 . 5.440 3.109 2.766 3.654 . 0 0 "[ . 1 . 2]" 1
775 1 33 MET HA 1 34 VAL H 0.000 . 4.620 2.185 1.904 2.421 . 0 0 "[ . 1 . 2]" 1
776 1 107 LYS HA 1 108 GLU H 0.000 . 5.800 3.439 3.383 3.488 . 0 0 "[ . 1 . 2]" 1
777 1 108 GLU H 1 109 LEU H 0.000 . 5.300 2.758 2.583 3.098 . 0 0 "[ . 1 . 2]" 1
778 1 107 LYS H 1 108 GLU H 0.000 . 5.530 2.610 2.461 2.845 . 0 0 "[ . 1 . 2]" 1
779 1 58 LEU MD2 1 59 HIS H 0.000 . 5.800 3.626 2.218 4.225 . 0 0 "[ . 1 . 2]" 1
780 1 58 LEU MD1 1 59 HIS H 0.000 . 5.800 4.140 3.320 4.379 . 0 0 "[ . 1 . 2]" 1
781 1 122 PRO HB2 1 123 LYS H 0.000 . 5.240 3.466 2.100 4.266 . 0 0 "[ . 1 . 2]" 1
782 1 123 LYS H 1 124 ALA H 0.000 . 5.080 3.745 2.327 4.359 . 0 0 "[ . 1 . 2]" 1
783 1 57 ALA MB 1 58 LEU H 0.000 . 4.620 2.508 2.401 2.696 . 0 0 "[ . 1 . 2]" 1
784 1 58 LEU HB2 1 59 HIS H 0.000 . 5.690 3.816 3.675 4.062 . 0 0 "[ . 1 . 2]" 1
785 1 58 LEU HB3 1 59 HIS H 0.000 . 5.490 2.846 2.252 4.076 . 0 0 "[ . 1 . 2]" 1
786 1 56 HIS HA 1 59 HIS H 0.000 . 5.770 3.675 3.246 4.047 . 0 0 "[ . 1 . 2]" 1
787 1 58 LEU HA 1 59 HIS H 0.000 . 5.800 3.488 3.421 3.534 . 0 0 "[ . 1 . 2]" 1
788 1 122 PRO HA 1 123 LYS H 0.000 . 4.500 2.424 2.072 3.535 . 0 0 "[ . 1 . 2]" 1
789 1 58 LEU H 1 58 LEU MD2 0.000 . 5.570 3.527 1.894 4.218 . 0 0 "[ . 1 . 2]" 1
790 1 58 LEU H 1 58 LEU HG 0.000 . 5.370 4.064 2.719 4.512 . 0 0 "[ . 1 . 2]" 1
791 1 57 ALA H 1 58 LEU H 0.000 . 4.730 2.676 2.532 2.940 . 0 0 "[ . 1 . 2]" 1
792 1 58 LEU H 1 59 HIS H 0.000 . 5.120 2.672 2.384 2.794 . 0 0 "[ . 1 . 2]" 1
793 1 58 LEU H 1 61 ARG H 0.000 . 5.760 4.816 4.551 5.107 . 0 0 "[ . 1 . 2]" 1
794 1 84 LEU QB 1 85 GLU H 0.000 . 5.460 3.183 2.892 3.481 . 0 0 "[ . 1 . 2]" 1
795 1 12 VAL MG1 1 14 ILE H 0.000 . 5.800 5.159 4.625 5.930 0.130 5 0 "[ . 1 . 2]" 1
796 1 84 LEU MD1 1 85 GLU H 0.000 . 5.800 4.495 3.970 4.788 . 0 0 "[ . 1 . 2]" 1
797 1 54 GLU HA 1 55 PHE H 0.000 . 5.800 3.555 3.452 3.623 . 0 0 "[ . 1 . 2]" 1
798 1 93 ALA H 1 94 TYR H 0.000 . 4.620 2.698 2.497 2.813 . 0 0 "[ . 1 . 2]" 1
799 1 13 HIS HB3 1 14 ILE H 0.000 . 5.390 3.868 3.635 4.061 . 0 0 "[ . 1 . 2]" 1
800 1 13 HIS HB2 1 14 ILE H 0.000 . 5.240 2.615 2.264 2.944 . 0 0 "[ . 1 . 2]" 1
801 1 14 ILE H 1 15 PRO HD2 0.000 . 5.800 4.767 4.542 5.141 . 0 0 "[ . 1 . 2]" 1
802 1 13 HIS HA 1 14 ILE H 0.000 . 4.760 2.323 2.128 2.593 . 0 0 "[ . 1 . 2]" 1
803 1 92 GLU HG2 1 93 ALA H 0.000 . 5.080 3.800 2.759 5.151 0.071 14 0 "[ . 1 . 2]" 1
804 1 110 LEU H 1 110 LEU MD2 0.000 . 5.150 3.906 3.737 4.312 . 0 0 "[ . 1 . 2]" 1
805 1 56 HIS HB2 1 57 ALA H 0.000 . 5.240 3.549 2.509 4.080 . 0 0 "[ . 1 . 2]" 1
806 1 56 HIS HB3 1 57 ALA H 0.000 . 5.440 2.975 2.338 4.300 . 0 0 "[ . 1 . 2]" 1
807 1 29 GLU HG2 1 30 LYS H 0.000 . 5.800 3.631 1.945 5.158 . 0 0 "[ . 1 . 2]" 1
808 1 29 GLU HB2 1 30 LYS H 0.000 . 5.260 3.312 1.916 4.474 . 0 0 "[ . 1 . 2]" 1
809 1 57 ALA H 1 60 LYS HG2 0.000 . 5.270 4.813 4.123 5.374 0.104 20 0 "[ . 1 . 2]" 1
810 1 21 ALA MB 1 22 GLU H 0.000 . 4.610 2.860 2.288 3.494 . 0 0 "[ . 1 . 2]" 1
811 1 24 PRO HB3 1 25 ARG H 0.000 . 4.680 3.507 2.686 4.167 . 0 0 "[ . 1 . 2]" 1
812 1 24 PRO HB2 1 25 ARG H 0.000 . 4.190 2.394 1.773 3.516 . 0 0 "[ . 1 . 2]" 1
813 1 33 MET H 1 33 MET HG2 0.000 . 5.080 4.333 2.236 4.877 . 0 0 "[ . 1 . 2]" 1
814 1 29 GLU HA 1 30 LYS H 0.000 . 4.900 3.146 2.142 3.618 . 0 0 "[ . 1 . 2]" 1
815 1 21 ALA HA 1 22 GLU H 0.000 . 3.740 2.213 1.981 2.413 . 0 0 "[ . 1 . 2]" 1
816 1 92 GLU H 1 93 ALA H 0.000 . 4.820 2.680 2.570 2.796 . 0 0 "[ . 1 . 2]" 1
817 1 107 LYS HA 1 110 LEU H 0.000 . 4.990 3.268 2.866 3.703 . 0 0 "[ . 1 . 2]" 1
818 1 108 GLU HA 1 110 LEU H 0.000 . 5.800 4.133 3.783 4.493 . 0 0 "[ . 1 . 2]" 1
819 1 98 ILE H 1 98 ILE HG12 0.000 . 5.000 2.068 1.826 3.374 . 0 0 "[ . 1 . 2]" 1
820 1 98 ILE H 1 98 ILE MD 0.000 . 4.620 3.573 3.487 3.622 . 0 0 "[ . 1 . 2]" 1
821 1 94 TYR HB3 1 98 ILE H 0.000 . 5.800 5.119 4.404 5.858 0.058 19 0 "[ . 1 . 2]" 1
822 1 95 ILE HA 1 98 ILE H 0.000 . 5.400 3.537 3.091 3.856 . 0 0 "[ . 1 . 2]" 1
823 1 98 ILE H 1 99 LEU H 0.000 . 4.950 2.670 2.481 2.965 . 0 0 "[ . 1 . 2]" 1
824 1 97 GLY H 1 98 ILE H 0.000 . 5.410 2.843 2.621 2.930 . 0 0 "[ . 1 . 2]" 1
825 1 61 ARG H 1 63 LYS H 0.000 . 5.800 3.897 3.666 4.143 . 0 0 "[ . 1 . 2]" 1
826 1 66 TYR QD 1 67 LYS H 0.000 . 5.650 2.482 2.064 3.165 . 0 0 "[ . 1 . 2]" 1
827 1 67 LYS H 1 68 VAL H 0.000 . 5.310 4.397 4.308 4.528 . 0 0 "[ . 1 . 2]" 1
828 1 115 LEU HA 1 116 ARG H 0.000 . 4.800 2.945 2.151 3.425 . 0 0 "[ . 1 . 2]" 1
829 1 60 LYS HA 1 63 LYS H 0.000 . 5.800 3.408 2.819 4.410 . 0 0 "[ . 1 . 2]" 1
830 1 62 ILE MD 1 63 LYS H 0.000 . 5.800 4.484 4.210 4.830 . 0 0 "[ . 1 . 2]" 1
831 1 62 ILE HG13 1 63 LYS H 0.000 . 4.600 3.004 2.648 3.463 . 0 0 "[ . 1 . 2]" 1
832 1 63 LYS H 1 63 LYS HG3 0.000 . 4.690 3.060 2.150 3.710 . 0 0 "[ . 1 . 2]" 1
833 1 62 ILE HG12 1 63 LYS H 0.000 . 4.410 3.475 3.162 3.866 . 0 0 "[ . 1 . 2]" 1
834 1 63 LYS H 1 63 LYS HG2 0.000 . 5.430 2.833 2.208 3.746 . 0 0 "[ . 1 . 2]" 1
835 1 67 LYS H 1 67 LYS HB2 0.000 . 4.250 2.509 2.282 2.634 . 0 0 "[ . 1 . 2]" 1
836 1 67 LYS H 1 67 LYS HG2 0.000 . 4.800 3.518 2.126 4.537 . 0 0 "[ . 1 . 2]" 1
837 1 11 GLU QB 1 12 VAL H 0.000 . 4.720 3.246 2.631 3.416 . 0 0 "[ . 1 . 2]" 1
838 1 11 GLU HG2 1 12 VAL H 0.000 . 5.410 4.571 4.094 5.195 . 0 0 "[ . 1 . 2]" 1
839 1 66 TYR HB2 1 67 LYS H 0.000 . 4.660 2.377 2.164 2.648 . 0 0 "[ . 1 . 2]" 1
840 1 43 GLY H 1 44 ARG H 0.000 . 4.740 2.605 1.737 3.691 . 0 0 "[ . 1 . 2]" 1
841 1 41 CYS H 1 44 ARG H 0.000 . 4.560 3.521 3.052 4.133 . 0 0 "[ . 1 . 2]" 1
842 1 13 HIS H 1 38 GLU H 0.000 . 5.470 3.159 2.771 3.333 . 0 0 "[ . 1 . 2]" 1
843 1 93 ALA HA 1 94 TYR H 0.000 . 4.750 3.526 3.469 3.574 . 0 0 "[ . 1 . 2]" 1
844 1 40 LEU HA 1 44 ARG H 0.000 . 5.630 4.803 3.963 5.539 . 0 0 "[ . 1 . 2]" 1
845 1 42 SER QB 1 44 ARG H 0.000 . 5.800 3.650 3.142 4.992 . 0 0 "[ . 1 . 2]" 1
846 1 62 ILE HA 1 63 LYS H 0.000 . 5.780 3.414 3.279 3.504 . 0 0 "[ . 1 . 2]" 1
847 1 44 ARG H 1 44 ARG HG2 0.000 . 4.710 3.769 2.099 4.708 . 0 0 "[ . 1 . 2]" 1
848 1 44 ARG H 1 44 ARG HG3 0.000 . 4.820 3.530 2.131 4.500 . 0 0 "[ . 1 . 2]" 1
849 1 44 ARG H 1 44 ARG HB2 0.000 . 4.060 2.644 2.238 3.686 . 0 0 "[ . 1 . 2]" 1
850 1 12 VAL H 1 13 HIS H 0.000 . 5.800 4.239 4.036 4.361 . 0 0 "[ . 1 . 2]" 1
851 1 12 VAL MG1 1 13 HIS H 0.000 . 4.490 2.755 2.426 3.092 . 0 0 "[ . 1 . 2]" 1
852 1 13 HIS H 1 38 GLU HG2 0.000 . 5.800 4.881 4.241 5.876 0.076 16 0 "[ . 1 . 2]" 1
853 1 12 VAL HB 1 13 HIS H 0.000 . 5.760 3.978 2.955 4.221 . 0 0 "[ . 1 . 2]" 1
854 1 86 GLN HB3 1 87 ARG H 0.000 . 4.700 3.052 2.380 3.920 . 0 0 "[ . 1 . 2]" 1
855 1 86 GLN HB2 1 87 ARG H 0.000 . 5.330 3.323 2.323 4.032 . 0 0 "[ . 1 . 2]" 1
856 1 40 LEU HB2 1 46 HIS H 0.000 . 5.670 4.989 4.441 5.697 0.027 9 0 "[ . 1 . 2]" 1
857 1 39 VAL HB 1 46 HIS H 0.000 . 5.480 3.765 3.301 4.212 . 0 0 "[ . 1 . 2]" 1
858 1 46 HIS H 1 47 THR H 0.000 . 5.800 4.174 3.793 4.477 . 0 0 "[ . 1 . 2]" 1
859 1 40 LEU HA 1 46 HIS H 0.000 . 5.360 3.592 3.106 4.165 . 0 0 "[ . 1 . 2]" 1
860 1 45 ARG HA 1 46 HIS H 0.000 . 4.000 2.186 2.024 2.407 . 0 0 "[ . 1 . 2]" 1
861 1 91 LEU HA 1 92 GLU H 0.000 . 5.240 3.518 3.464 3.587 . 0 0 "[ . 1 . 2]" 1
862 1 53 SER HA 1 54 GLU H 0.000 . 5.800 3.525 3.463 3.603 . 0 0 "[ . 1 . 2]" 1
863 1 52 TYR HB3 1 54 GLU H 0.000 . 5.800 5.283 4.574 5.921 0.121 17 0 "[ . 1 . 2]" 1
864 1 92 GLU H 1 92 GLU HG2 0.000 . 4.990 4.003 2.231 4.530 . 0 0 "[ . 1 . 2]" 1
865 1 91 LEU HB2 1 92 GLU H 0.000 . 5.550 2.901 2.750 3.036 . 0 0 "[ . 1 . 2]" 1
866 1 14 ILE MD 1 92 GLU H 0.000 . 5.510 2.775 2.429 3.710 . 0 0 "[ . 1 . 2]" 1
867 1 91 LEU HB3 1 92 GLU H 0.000 . 5.800 3.641 3.461 3.796 . 0 0 "[ . 1 . 2]" 1
868 1 14 ILE MG 1 92 GLU H 0.000 . 5.800 5.143 4.644 5.824 0.024 9 0 "[ . 1 . 2]" 1
869 1 38 GLU HG2 1 46 HIS H 0.000 . 5.800 3.934 2.982 5.274 . 0 0 "[ . 1 . 2]" 1
870 1 45 ARG HB2 1 46 HIS H 0.000 . 5.610 2.998 2.162 3.848 . 0 0 "[ . 1 . 2]" 1
871 1 20 GLU H 1 20 GLU HG2 0.000 . 4.810 3.414 1.979 4.789 . 0 0 "[ . 1 . 2]" 1
872 1 20 GLU H 1 34 VAL MG1 0.000 . 5.370 2.475 1.727 3.364 . 0 0 "[ . 1 . 2]" 1
873 1 20 GLU H 1 33 MET HA 0.000 . 5.400 3.082 2.241 4.249 . 0 0 "[ . 1 . 2]" 1
874 1 91 LEU H 1 92 GLU H 0.000 . 5.110 2.640 2.530 2.840 . 0 0 "[ . 1 . 2]" 1
875 1 84 LEU H 1 84 LEU MD1 0.000 . 5.730 3.914 3.388 4.323 . 0 0 "[ . 1 . 2]" 1
876 1 8 LEU H 1 9 GLU H 0.000 . 5.800 3.285 1.722 4.550 . 0 0 "[ . 1 . 2]" 1
877 1 112 PHE H 1 113 LEU H 0.000 . 5.090 2.509 2.293 2.829 . 0 0 "[ . 1 . 2]" 1
878 1 111 GLU H 1 112 PHE H 0.000 . 4.760 2.509 2.406 2.598 . 0 0 "[ . 1 . 2]" 1
879 1 109 LEU HA 1 112 PHE H 0.000 . 4.780 2.969 2.411 3.280 . 0 0 "[ . 1 . 2]" 1
880 1 7 HIS QB 1 8 LEU H 0.000 . 5.800 3.605 2.032 4.064 . 0 0 "[ . 1 . 2]" 1
881 1 111 GLU QB 1 112 PHE H 0.000 . 4.790 3.005 2.757 3.229 . 0 0 "[ . 1 . 2]" 1
882 1 112 PHE H 1 115 LEU MD2 0.000 . 5.520 5.683 5.618 5.791 0.271 9 0 "[ . 1 . 2]" 1
883 1 110 LEU MD1 1 112 PHE H 0.000 . 5.800 5.032 4.814 5.458 . 0 0 "[ . 1 . 2]" 1
884 1 84 LEU H 1 84 LEU MD2 0.000 . 5.800 2.940 2.169 4.023 . 0 0 "[ . 1 . 2]" 1
885 1 10 LEU H 1 11 GLU QB 0.000 . 5.630 5.108 4.139 5.734 0.104 17 0 "[ . 1 . 2]" 1
886 1 10 LEU H 1 11 GLU HG3 0.000 . 5.800 4.132 3.033 5.846 0.046 7 0 "[ . 1 . 2]" 1
887 1 10 LEU H 1 10 LEU MD2 0.000 . 5.570 3.876 2.617 4.684 . 0 0 "[ . 1 . 2]" 1
888 1 123 LYS HA 1 124 ALA H 0.000 . 4.420 2.299 2.050 3.498 . 0 0 "[ . 1 . 2]" 1
889 1 9 GLU HA 1 10 LEU H 0.000 . 4.160 2.202 1.996 2.966 . 0 0 "[ . 1 . 2]" 1
890 1 88 ARG HA 1 91 LEU H 0.000 . 5.460 3.875 3.377 4.325 . 0 0 "[ . 1 . 2]" 1
891 1 123 LYS HB2 1 124 ALA H 0.000 . 5.650 4.242 2.805 4.631 . 0 0 "[ . 1 . 2]" 1
892 1 10 LEU H 1 40 LEU HB3 0.000 . 5.800 5.461 4.608 5.912 0.112 17 0 "[ . 1 . 2]" 1
893 1 10 LEU MD2 1 11 GLU H 0.000 . 4.900 3.868 2.587 4.914 0.014 15 0 "[ . 1 . 2]" 1
894 1 11 GLU H 1 11 GLU HG2 0.000 . 5.560 3.901 2.467 4.283 . 0 0 "[ . 1 . 2]" 1
895 1 10 LEU HB3 1 11 GLU H 0.000 . 5.800 3.685 3.051 4.346 . 0 0 "[ . 1 . 2]" 1
896 1 11 GLU H 1 40 LEU HB2 0.000 . 5.210 3.652 3.224 4.259 . 0 0 "[ . 1 . 2]" 1
897 1 91 LEU H 1 91 LEU MD1 0.000 . 5.800 3.648 3.269 3.821 . 0 0 "[ . 1 . 2]" 1
898 1 91 LEU H 1 93 ALA H 0.000 . 5.800 4.171 4.061 4.309 . 0 0 "[ . 1 . 2]" 1
899 1 9 GLU H 1 10 LEU H 0.000 . 5.140 3.681 2.477 4.642 . 0 0 "[ . 1 . 2]" 1
900 1 35 PHE H 1 50 ARG H 0.000 . 5.700 3.254 2.855 3.654 . 0 0 "[ . 1 . 2]" 1
901 1 36 ARG HA 1 50 ARG H 0.000 . 5.730 3.199 2.722 3.511 . 0 0 "[ . 1 . 2]" 1
902 1 49 PRO HA 1 50 ARG H 0.000 . 4.510 2.164 2.115 2.205 . 0 0 "[ . 1 . 2]" 1
903 1 10 LEU HA 1 11 GLU H 0.000 . 4.250 2.125 2.009 2.210 . 0 0 "[ . 1 . 2]" 1
904 1 49 PRO HB2 1 50 ARG H 0.000 . 5.710 3.903 3.585 4.090 . 0 0 "[ . 1 . 2]" 1
905 1 49 PRO HB3 1 50 ARG H 0.000 . 5.230 3.953 3.530 4.239 . 0 0 "[ . 1 . 2]" 1
906 1 37 VAL MG1 1 50 ARG H 0.000 . 5.540 3.898 3.493 4.485 . 0 0 "[ . 1 . 2]" 1
907 1 34 VAL MG2 1 50 ARG H 0.000 . 5.000 2.705 2.228 4.235 . 0 0 "[ . 1 . 2]" 1
908 1 11 GLU H 1 40 LEU HB3 0.000 . 5.800 2.011 1.647 2.584 . 0 0 "[ . 1 . 2]" 1
909 1 50 ARG HA 1 51 ARG H 0.000 . 4.830 2.226 1.967 2.463 . 0 0 "[ . 1 . 2]" 1
910 1 50 ARG HD3 1 51 ARG H 0.000 . 5.800 4.493 1.779 5.915 0.115 17 0 "[ . 1 . 2]" 1
911 1 51 ARG H 1 51 ARG HG2 0.000 . 4.970 3.493 1.836 4.621 . 0 0 "[ . 1 . 2]" 1
912 1 34 VAL MG2 1 51 ARG H 0.000 . 5.800 3.530 2.652 5.802 0.002 18 0 "[ . 1 . 2]" 1
913 1 105 VAL H 1 105 VAL MG1 0.000 . 4.470 2.412 1.912 3.578 . 0 0 "[ . 1 . 2]" 1
914 1 104 GLU HB3 1 105 VAL H 0.000 . 5.350 3.288 1.816 4.506 . 0 0 "[ . 1 . 2]" 1
915 1 40 LEU HB2 1 41 CYS H 0.000 . 5.100 4.417 4.278 4.560 . 0 0 "[ . 1 . 2]" 1
916 1 41 CYS H 1 45 ARG HB3 0.000 . 5.800 4.465 3.482 5.887 0.087 16 0 "[ . 1 . 2]" 1
917 1 41 CYS H 1 44 ARG HB2 0.000 . 5.760 4.151 3.398 5.482 . 0 0 "[ . 1 . 2]" 1
918 1 40 LEU HB3 1 41 CYS H 0.000 . 5.800 4.170 4.078 4.347 . 0 0 "[ . 1 . 2]" 1
919 1 34 VAL HB 1 35 PHE H 0.000 . 5.350 4.004 2.946 4.359 . 0 0 "[ . 1 . 2]" 1
920 1 20 GLU HA 1 21 ALA H 0.000 . 4.370 3.223 2.204 3.553 . 0 0 "[ . 1 . 2]" 1
921 1 104 GLU HA 1 105 VAL H 0.000 . 4.080 3.189 2.016 3.544 . 0 0 "[ . 1 . 2]" 1
922 1 40 LEU HA 1 41 CYS H 0.000 . 4.330 2.107 2.041 2.187 . 0 0 "[ . 1 . 2]" 1
923 1 41 CYS H 1 45 ARG HA 0.000 . 5.720 3.188 2.685 3.643 . 0 0 "[ . 1 . 2]" 1
924 1 35 PHE H 1 35 PHE QE 0.000 . 5.620 4.224 4.017 4.374 . 0 0 "[ . 1 . 2]" 1
925 1 20 GLU H 1 21 ALA H 0.000 . 5.170 2.476 1.693 4.483 . 0 0 "[ . 1 . 2]" 1
926 1 34 VAL MG1 1 35 PHE H 0.000 . 5.320 4.003 3.736 4.182 . 0 0 "[ . 1 . 2]" 1
927 1 34 VAL HA 1 35 PHE H 0.000 . 4.680 2.176 2.069 2.304 . 0 0 "[ . 1 . 2]" 1
928 1 41 CYS H 1 42 SER H 0.000 . 5.800 4.057 3.781 4.235 . 0 0 "[ . 1 . 2]" 1
929 1 37 VAL H 1 47 THR HA 0.000 . 5.800 4.765 4.035 5.162 . 0 0 "[ . 1 . 2]" 1
930 1 37 VAL H 1 49 PRO HA 0.000 . 5.670 3.419 3.177 3.823 . 0 0 "[ . 1 . 2]" 1
931 1 36 ARG H 1 37 VAL H 0.000 . 5.800 4.175 4.083 4.320 . 0 0 "[ . 1 . 2]" 1
932 1 36 ARG H 1 36 ARG HG2 0.000 . 4.980 3.490 2.150 4.438 . 0 0 "[ . 1 . 2]" 1
933 1 35 PHE HB2 1 36 ARG H 0.000 . 5.620 2.792 2.516 3.217 . 0 0 "[ . 1 . 2]" 1
934 1 45 ARG H 1 45 ARG HG2 0.000 . 5.180 2.631 2.192 3.758 . 0 0 "[ . 1 . 2]" 1
935 1 44 ARG HB2 1 45 ARG H 0.000 . 4.700 3.990 2.464 4.339 . 0 0 "[ . 1 . 2]" 1
936 1 35 PHE HB3 1 36 ARG H 0.000 . 5.800 3.762 3.552 4.038 . 0 0 "[ . 1 . 2]" 1
937 1 35 PHE HA 1 36 ARG H 0.000 . 4.500 2.183 2.083 2.260 . 0 0 "[ . 1 . 2]" 1
938 1 41 CYS HA 1 42 SER H 0.000 . 5.200 2.132 2.081 2.198 . 0 0 "[ . 1 . 2]" 1
939 1 36 ARG H 1 50 ARG H 0.000 . 5.800 4.784 4.445 4.990 . 0 0 "[ . 1 . 2]" 1
940 1 42 SER H 1 43 GLY H 0.000 . 5.800 2.880 2.520 3.970 . 0 0 "[ . 1 . 2]" 1
941 1 44 ARG HA 1 45 ARG H 0.000 . 4.040 2.183 2.018 2.348 . 0 0 "[ . 1 . 2]" 1
942 1 45 ARG H 1 45 ARG HD3 0.000 . 5.800 3.998 1.760 5.119 . 0 0 "[ . 1 . 2]" 1
943 1 70 ASP QB 1 71 PHE H 0.000 . 4.910 2.605 1.792 3.420 . 0 0 "[ . 1 . 2]" 1
944 1 70 ASP HA 1 71 PHE H 0.000 . 4.060 2.513 1.992 3.055 . 0 0 "[ . 1 . 2]" 1
945 1 37 VAL H 1 48 VAL H 0.000 . 5.620 3.289 2.763 3.538 . 0 0 "[ . 1 . 2]" 1
946 1 47 THR H 1 48 VAL H 0.000 . 5.800 4.265 4.054 4.389 . 0 0 "[ . 1 . 2]" 1
947 1 36 ARG HA 1 48 VAL H 0.000 . 5.800 4.211 3.998 4.436 . 0 0 "[ . 1 . 2]" 1
948 1 47 THR HB 1 48 VAL H 0.000 . 5.700 4.230 3.659 4.421 . 0 0 "[ . 1 . 2]" 1
949 1 38 GLU HA 1 48 VAL H 0.000 . 5.800 3.038 2.729 3.812 . 0 0 "[ . 1 . 2]" 1
950 1 37 VAL MG1 1 48 VAL H 0.000 . 5.800 4.908 4.488 5.262 . 0 0 "[ . 1 . 2]" 1
951 1 48 VAL H 1 48 VAL MG2 0.000 . 4.720 2.448 2.029 2.737 . 0 0 "[ . 1 . 2]" 1
952 1 38 GLU HA 1 39 VAL H 0.000 . 4.710 2.032 1.995 2.102 . 0 0 "[ . 1 . 2]" 1
953 1 39 VAL H 1 47 THR HA 0.000 . 5.740 3.797 3.366 4.092 . 0 0 "[ . 1 . 2]" 1
954 1 39 VAL H 1 40 LEU H 0.000 . 5.280 4.238 4.105 4.339 . 0 0 "[ . 1 . 2]" 1
955 1 39 VAL HA 1 40 LEU H 0.000 . 4.270 2.163 2.109 2.215 . 0 0 "[ . 1 . 2]" 1
956 1 39 VAL HB 1 40 LEU H 0.000 . 5.800 4.315 4.143 4.409 . 0 0 "[ . 1 . 2]" 1
957 1 39 VAL MG2 1 40 LEU H 0.000 . 4.510 4.258 4.105 4.362 . 0 0 "[ . 1 . 2]" 1
958 1 40 LEU H 1 40 LEU MD2 0.000 . 5.660 4.168 4.063 4.265 . 0 0 "[ . 1 . 2]" 1
959 1 11 GLU HG3 1 40 LEU H 0.000 . 5.800 5.538 3.862 5.846 0.046 4 0 "[ . 1 . 2]" 1
960 1 11 GLU QB 1 40 LEU H 0.000 . 5.800 3.841 3.322 5.080 . 0 0 "[ . 1 . 2]" 1
961 1 105 VAL MG2 1 107 LYS H 0.000 . 5.800 4.941 4.318 5.303 . 0 0 "[ . 1 . 2]" 1
962 1 107 LYS H 1 107 LYS HG2 0.000 . 5.500 4.421 4.078 4.505 . 0 0 "[ . 1 . 2]" 1
963 1 106 PRO HA 1 107 LYS H 0.000 . 4.660 2.108 2.048 2.225 . 0 0 "[ . 1 . 2]" 1
964 1 107 LYS H 1 107 LYS HD2 0.000 . 5.600 4.833 4.651 5.207 . 0 0 "[ . 1 . 2]" 1
965 1 37 VAL MG1 1 38 GLU H 0.000 . 5.730 4.038 3.831 4.199 . 0 0 "[ . 1 . 2]" 1
966 1 12 VAL MG1 1 38 GLU H 0.000 . 4.860 3.967 3.542 4.449 . 0 0 "[ . 1 . 2]" 1
967 1 15 PRO HD3 1 38 GLU H 0.000 . 5.800 2.942 2.410 3.314 . 0 0 "[ . 1 . 2]" 1
968 1 14 ILE HA 1 38 GLU H 0.000 . 5.730 2.832 2.532 3.122 . 0 0 "[ . 1 . 2]" 1
969 1 15 PRO HD2 1 38 GLU H 0.000 . 5.780 3.240 2.811 3.776 . 0 0 "[ . 1 . 2]" 1
970 1 37 VAL HA 1 38 GLU H 0.000 . 4.640 2.133 1.998 2.360 . 0 0 "[ . 1 . 2]" 1
971 1 40 LEU MD1 1 41 CYS H 0.000 . 5.380 4.714 2.870 5.047 . 0 0 "[ . 1 . 2]" 1
972 1 11 GLU H 1 12 VAL H 0.000 . 5.800 4.118 3.793 4.388 . 0 0 "[ . 1 . 2]" 1
973 1 12 VAL HA 1 13 HIS H 0.000 . 4.090 2.151 2.078 2.241 . 0 0 "[ . 1 . 2]" 1
974 1 39 VAL H 1 46 HIS H 0.000 . 4.680 3.030 2.538 3.392 . 0 0 "[ . 1 . 2]" 1
975 1 86 GLN H 1 87 ARG H 0.000 . 4.980 2.670 2.463 2.922 . 0 0 "[ . 1 . 2]" 1
976 1 91 LEU HA 1 95 ILE H 0.000 . 5.800 3.850 2.941 4.384 . 0 0 "[ . 1 . 2]" 1
977 1 94 TYR HB3 1 95 ILE H 0.000 . 5.400 3.476 2.476 3.855 . 0 0 "[ . 1 . 2]" 1
978 1 100 TYR HB2 1 101 LEU H 0.000 . 5.580 4.061 3.905 4.252 . 0 0 "[ . 1 . 2]" 1
979 1 100 TYR HB3 1 101 LEU H 0.000 . 5.540 2.953 2.644 3.439 . 0 0 "[ . 1 . 2]" 1
980 1 94 TYR HB2 1 95 ILE H 0.000 . 5.720 3.031 2.452 4.069 . 0 0 "[ . 1 . 2]" 1
981 1 25 ARG H 1 26 GLN H 0.000 . 5.800 4.415 4.206 4.691 . 0 0 "[ . 1 . 2]" 1
982 1 38 GLU HB2 1 39 VAL H 0.000 . 5.800 4.335 4.230 4.503 . 0 0 "[ . 1 . 2]" 1
983 1 66 TYR HB3 1 67 LYS H 0.000 . 4.910 3.712 3.545 3.900 . 0 0 "[ . 1 . 2]" 1
984 1 55 PHE QD 1 56 HIS H 0.000 . 5.800 3.760 3.004 4.572 . 0 0 "[ . 1 . 2]" 1
985 1 16 SER H 1 36 ARG H 0.000 . 5.800 3.632 3.279 3.881 . 0 0 "[ . 1 . 2]" 1
986 1 45 ARG HB3 1 46 HIS H 0.000 . 5.800 3.724 2.217 4.225 . 0 0 "[ . 1 . 2]" 1
987 1 20 GLU QB 1 21 ALA H 0.000 . 5.200 3.107 1.726 4.036 . 0 0 "[ . 1 . 2]" 1
988 1 20 GLU HG2 1 21 ALA H 0.000 . 5.260 3.953 1.724 4.864 . 0 0 "[ . 1 . 2]" 1
989 1 110 LEU H 1 111 GLU H 0.000 . 4.770 2.621 2.420 2.813 . 0 0 "[ . 1 . 2]" 1
990 1 66 TYR H 1 66 TYR QD 0.000 . 5.160 3.042 2.194 3.444 . 0 0 "[ . 1 . 2]" 1
991 1 66 TYR H 1 67 LYS H 0.000 . 5.800 4.402 4.361 4.450 . 0 0 "[ . 1 . 2]" 1
992 1 65 LEU HB2 1 66 TYR H 0.000 . 4.590 3.464 2.493 4.180 . 0 0 "[ . 1 . 2]" 1
993 1 62 ILE MD 1 66 TYR H 0.000 . 5.630 4.881 4.676 5.521 . 0 0 "[ . 1 . 2]" 1
994 1 16 SER H 1 17 VAL H 0.000 . 5.800 4.325 4.246 4.396 . 0 0 "[ . 1 . 2]" 1
995 1 127 TRP HB3 1 128 GLY H 0.000 . 5.360 4.085 2.866 4.475 . 0 0 "[ . 1 . 2]" 1
996 1 127 TRP HB2 1 128 GLY H 0.000 . 5.080 4.213 2.572 4.502 . 0 0 "[ . 1 . 2]" 1
997 1 86 GLN H 1 86 GLN HG2 0.000 . 4.900 3.933 2.103 4.655 . 0 0 "[ . 1 . 2]" 1
998 1 14 ILE HG12 1 38 GLU H 0.000 . 5.800 3.885 3.444 5.499 . 0 0 "[ . 1 . 2]" 1
999 1 110 LEU H 1 110 LEU MD1 0.000 . 5.080 3.032 1.858 4.325 . 0 0 "[ . 1 . 2]" 1
1000 1 109 LEU HB2 1 110 LEU H 0.000 . 5.800 3.183 2.622 4.043 . 0 0 "[ . 1 . 2]" 1
1001 1 78 ASN HA 1 79 TRP H 0.000 . 5.630 3.222 3.008 3.422 . 0 0 "[ . 1 . 2]" 1
1002 1 11 GLU H 1 40 LEU H 0.000 . 4.890 3.136 2.856 3.373 . 0 0 "[ . 1 . 2]" 1
1003 1 35 PHE H 1 51 ARG HA 0.000 . 5.800 3.295 2.525 3.745 . 0 0 "[ . 1 . 2]" 1
1004 1 52 TYR H 1 54 GLU H 0.000 . 5.800 4.258 3.753 4.783 . 0 0 "[ . 1 . 2]" 1
1005 1 51 ARG H 1 52 TYR H 0.000 . 5.800 4.546 4.400 4.642 . 0 0 "[ . 1 . 2]" 1
1006 1 37 VAL HB 1 38 GLU H 0.000 . 5.800 3.373 2.620 3.704 . 0 0 "[ . 1 . 2]" 1
1007 1 14 ILE HG13 1 38 GLU H 0.000 . 5.800 4.545 3.784 5.006 . 0 0 "[ . 1 . 2]" 1
1008 1 35 PHE H 1 36 ARG H 0.000 . 5.800 4.434 4.335 4.498 . 0 0 "[ . 1 . 2]" 1
1009 1 18 GLY H 1 36 ARG H 0.000 . 5.400 4.698 4.082 5.307 . 0 0 "[ . 1 . 2]" 1
1010 1 18 GLY H 1 33 MET HA 0.000 . 5.800 4.925 3.874 5.787 . 0 0 "[ . 1 . 2]" 1
1011 1 18 GLY H 1 19 PRO HD3 0.000 . 5.800 4.696 4.114 4.936 . 0 0 "[ . 1 . 2]" 1
1012 1 18 GLY H 1 19 PRO HD2 0.000 . 5.800 5.030 4.705 5.354 . 0 0 "[ . 1 . 2]" 1
1013 1 18 GLY H 1 33 MET HG3 0.000 . 5.800 4.993 3.883 5.945 0.145 12 0 "[ . 1 . 2]" 1
1014 1 35 PHE QE 1 52 TYR H 0.000 . 5.800 3.896 2.844 4.996 . 0 0 "[ . 1 . 2]" 1
1015 1 35 PHE QD 1 52 TYR H 0.000 . 5.800 4.758 4.117 5.433 . 0 0 "[ . 1 . 2]" 1
1016 1 51 ARG HG2 1 52 TYR H 0.000 . 5.800 3.616 1.937 4.934 . 0 0 "[ . 1 . 2]" 1
1017 1 53 SER H 1 54 GLU H 0.000 . 5.800 2.675 2.547 2.786 . 0 0 "[ . 1 . 2]" 1
1018 1 51 ARG H 1 54 GLU H 0.000 . 5.800 4.039 3.506 4.759 . 0 0 "[ . 1 . 2]" 1
1019 1 92 GLU HA 1 93 ALA H 0.000 . 5.650 3.521 3.472 3.549 . 0 0 "[ . 1 . 2]" 1
1020 1 89 GLN HA 1 93 ALA H 0.000 . 5.630 3.899 3.492 4.186 . 0 0 "[ . 1 . 2]" 1
1021 1 91 LEU MD1 1 93 ALA H 0.000 . 5.800 5.759 5.584 5.847 0.047 17 0 "[ . 1 . 2]" 1
1022 1 55 PHE H 1 55 PHE QD 0.000 . 5.460 3.844 2.355 4.263 . 0 0 "[ . 1 . 2]" 1
1023 1 55 PHE H 1 58 LEU H 0.000 . 5.690 4.730 4.493 5.078 . 0 0 "[ . 1 . 2]" 1
1024 1 109 LEU HA 1 111 GLU H 0.000 . 5.790 4.164 3.866 4.519 . 0 0 "[ . 1 . 2]" 1
1025 1 110 LEU HA 1 111 GLU H 0.000 . 5.060 3.488 3.399 3.550 . 0 0 "[ . 1 . 2]" 1
1026 1 111 GLU HA 1 112 PHE H 0.000 . 5.620 3.467 3.385 3.553 . 0 0 "[ . 1 . 2]" 1
1027 1 17 VAL MG1 1 34 VAL H 0.000 . 5.800 3.381 3.086 3.834 . 0 0 "[ . 1 . 2]" 1
1028 1 33 MET HG2 1 34 VAL H 0.000 . 5.800 3.669 2.565 5.097 . 0 0 "[ . 1 . 2]" 1
1029 1 17 VAL MG1 1 36 ARG H 0.000 . 5.800 4.108 3.726 4.544 . 0 0 "[ . 1 . 2]" 1
1030 1 100 TYR HA 1 102 ASN H 0.000 . 5.800 4.889 4.701 5.144 . 0 0 "[ . 1 . 2]" 1
1031 1 102 ASN HB2 1 103 GLN H 0.000 . 5.800 3.718 2.992 4.286 . 0 0 "[ . 1 . 2]" 1
1032 1 102 ASN HB3 1 103 GLN H 0.000 . 5.800 2.434 1.754 3.850 . 0 0 "[ . 1 . 2]" 1
1033 1 25 ARG H 1 25 ARG HD2 0.000 . 5.650 4.900 3.929 5.639 . 0 0 "[ . 1 . 2]" 1
1034 1 34 VAL HA 1 50 ARG H 0.000 . 5.800 4.562 3.956 5.186 . 0 0 "[ . 1 . 2]" 1
1035 1 76 LEU H 1 76 LEU MD1 0.000 . 5.800 3.995 2.524 4.431 . 0 0 "[ . 1 . 2]" 1
1036 1 41 CYS HA 1 43 GLY H 0.000 . 5.800 3.975 3.364 5.038 . 0 0 "[ . 1 . 2]" 1
1037 1 42 SER HA 1 43 GLY H 0.000 . 4.390 2.990 2.086 3.592 . 0 0 "[ . 1 . 2]" 1
1038 1 42 SER QB 1 43 GLY H 0.000 . 5.800 3.586 2.163 4.057 . 0 0 "[ . 1 . 2]" 1
1039 1 10 LEU H 1 11 GLU H 0.000 . 5.800 4.042 3.649 4.299 . 0 0 "[ . 1 . 2]" 1
1040 1 82 ARG HA 1 83 GLY H 0.000 . 5.660 2.906 2.131 3.588 . 0 0 "[ . 1 . 2]" 1
1041 1 74 LYS HA 1 75 ARG H 0.000 . 5.680 3.430 3.293 3.592 . 0 0 "[ . 1 . 2]" 1
1042 1 56 HIS H 1 58 LEU H 0.000 . 5.800 4.185 3.827 4.669 . 0 0 "[ . 1 . 2]" 1
1043 1 55 PHE H 1 56 HIS H 0.000 . 5.280 2.677 2.464 2.953 . 0 0 "[ . 1 . 2]" 1
1044 1 56 HIS H 1 56 HIS HD2 0.000 . 5.800 4.516 2.731 5.081 . 0 0 "[ . 1 . 2]" 1
1045 1 57 ALA HA 1 58 LEU H 0.000 . 5.710 3.548 3.474 3.666 . 0 0 "[ . 1 . 2]" 1
1046 1 119 PRO HB3 1 120 THR H 0.000 . 5.800 3.703 2.734 4.541 . 0 0 "[ . 1 . 2]" 1
1047 1 120 THR H 1 121 ASP H 0.000 . 5.540 4.000 2.318 4.523 . 0 0 "[ . 1 . 2]" 1
1048 1 86 GLN HA 1 87 ARG H 0.000 . 5.530 3.526 3.470 3.575 . 0 0 "[ . 1 . 2]" 1
1049 1 84 LEU MD1 1 87 ARG H 0.000 . 5.800 3.676 3.063 4.250 . 0 0 "[ . 1 . 2]" 1
1050 1 84 LEU H 1 86 GLN H 0.000 . 5.800 4.587 4.186 5.629 . 0 0 "[ . 1 . 2]" 1
1051 1 84 LEU HA 1 85 GLU H 0.000 . 5.800 3.329 3.217 3.469 . 0 0 "[ . 1 . 2]" 1
1052 1 62 ILE H 1 63 LYS H 0.000 . 4.500 2.674 2.472 2.878 . 0 0 "[ . 1 . 2]" 1
1053 1 115 LEU H 1 116 ARG H 0.000 . 4.780 3.086 2.253 4.495 . 0 0 "[ . 1 . 2]" 1
1054 1 100 TYR H 1 101 LEU H 0.000 . 4.500 2.404 2.115 2.671 . 0 0 "[ . 1 . 2]" 1
1055 1 127 TRP H 1 128 GLY H 0.000 . 4.140 3.562 1.729 4.246 0.106 2 0 "[ . 1 . 2]" 1
1056 1 104 GLU HG2 1 105 VAL H 0.000 . 5.360 3.669 1.535 5.051 . 0 0 "[ . 1 . 2]" 1
1057 1 38 GLU HG2 1 39 VAL H 0.000 . 5.800 3.629 3.197 4.420 . 0 0 "[ . 1 . 2]" 1
1058 1 37 VAL H 1 50 ARG H 0.000 . 5.800 3.662 3.282 4.174 . 0 0 "[ . 1 . 2]" 1
1059 1 33 MET H 1 34 VAL H 0.000 . 5.690 4.322 3.708 4.586 . 0 0 "[ . 1 . 2]" 1
1060 1 56 HIS HA 1 57 ALA H 0.000 . 5.800 3.530 3.439 3.578 . 0 0 "[ . 1 . 2]" 1
1061 1 29 GLU H 1 30 LYS H 0.000 . 5.800 3.001 1.938 4.530 . 0 0 "[ . 1 . 2]" 1
1062 1 55 PHE H 1 57 ALA H 0.000 . 5.070 4.256 3.973 4.561 . 0 0 "[ . 1 . 2]" 1
1063 1 27 SER HB2 1 29 GLU H 0.000 . 5.290 3.477 2.845 4.567 . 0 0 "[ . 1 . 2]" 1
1064 1 45 ARG H 1 46 HIS H 0.000 . 5.300 4.357 4.100 4.575 . 0 0 "[ . 1 . 2]" 1
1065 1 105 VAL MG2 1 108 GLU H 0.000 . 5.800 5.766 5.542 5.870 0.070 18 0 "[ . 1 . 2]" 1
1066 1 107 LYS HD2 1 108 GLU H 0.000 . 5.270 4.272 3.590 5.372 0.102 15 0 "[ . 1 . 2]" 1
1067 1 108 GLU H 1 110 LEU H 0.000 . 5.800 4.002 3.713 4.335 . 0 0 "[ . 1 . 2]" 1
1068 1 108 GLU HG2 1 109 LEU H 0.000 . 5.800 4.526 3.948 5.307 . 0 0 "[ . 1 . 2]" 1
1069 1 112 PHE H 1 115 LEU H 0.000 . 5.800 4.392 3.968 4.740 . 0 0 "[ . 1 . 2]" 1
1070 1 94 TYR HA 1 96 GLN H 0.000 . 5.400 4.550 4.295 4.889 . 0 0 "[ . 1 . 2]" 1
1071 1 95 ILE HA 1 96 GLN H 0.000 . 5.710 3.547 3.477 3.599 . 0 0 "[ . 1 . 2]" 1
1072 1 109 LEU HA 1 110 LEU H 0.000 . 5.800 3.437 3.344 3.478 . 0 0 "[ . 1 . 2]" 1
1073 1 117 HIS HA 1 118 PHE H 0.000 . 4.890 2.682 2.023 3.519 . 0 0 "[ . 1 . 2]" 1
1074 1 50 ARG HD2 1 51 ARG H 0.000 . 5.420 4.476 3.057 5.424 0.004 6 0 "[ . 1 . 2]" 1
1075 1 35 PHE HB3 1 50 ARG H 0.000 . 5.800 5.670 5.444 5.815 0.015 9 0 "[ . 1 . 2]" 1
1076 1 101 LEU H 1 101 LEU MD1 0.000 . 5.380 3.707 3.653 3.827 . 0 0 "[ . 1 . 2]" 1
1077 1 58 LEU MD1 1 62 ILE H 0.000 . 5.800 4.379 3.522 5.185 . 0 0 "[ . 1 . 2]" 1
1078 1 95 ILE H 1 95 ILE MD 0.000 . 5.350 3.521 2.550 4.470 . 0 0 "[ . 1 . 2]" 1
1079 1 98 ILE HA 1 101 LEU H 0.000 . 5.800 3.220 2.795 4.004 . 0 0 "[ . 1 . 2]" 1
1080 1 95 ILE H 1 95 ILE HG12 0.000 . 5.130 2.758 1.847 4.624 . 0 0 "[ . 1 . 2]" 1
1081 1 95 ILE H 1 96 GLN H 0.000 . 4.660 2.669 2.548 2.866 . 0 0 "[ . 1 . 2]" 1
1082 1 99 LEU H 1 99 LEU MD1 0.000 . 5.160 4.059 3.350 4.445 . 0 0 "[ . 1 . 2]" 1
1083 1 95 ILE HA 1 99 LEU H 0.000 . 5.800 4.198 3.839 4.533 . 0 0 "[ . 1 . 2]" 1
1084 1 99 LEU H 1 101 LEU H 0.000 . 5.800 3.900 3.781 4.165 . 0 0 "[ . 1 . 2]" 1
1085 1 68 VAL H 1 101 LEU MD2 0.000 . 5.600 5.638 5.322 5.698 0.098 11 0 "[ . 1 . 2]" 1
1086 1 68 VAL H 1 101 LEU MD1 0.000 . 5.480 3.719 3.486 4.017 . 0 0 "[ . 1 . 2]" 1
1087 1 87 ARG H 1 88 ARG H 0.000 . 5.170 2.698 2.462 2.896 . 0 0 "[ . 1 . 2]" 1
1088 1 78 ASN QB 1 79 TRP H 0.000 . 5.690 3.357 2.835 3.748 . 0 0 "[ . 1 . 2]" 1
1089 1 107 LYS HB3 1 108 GLU H 0.000 . 5.100 3.005 2.679 3.155 . 0 0 "[ . 1 . 2]" 1
1090 1 20 GLU H 1 34 VAL H 0.000 . 5.800 3.149 2.922 3.550 . 0 0 "[ . 1 . 2]" 1
1091 1 52 TYR QD 1 53 SER H 0.000 . 5.800 3.592 2.370 4.605 . 0 0 "[ . 1 . 2]" 1
1092 1 41 CYS HB3 1 42 SER H 0.000 . 5.800 4.185 3.371 4.457 . 0 0 "[ . 1 . 2]" 1
1093 1 10 LEU MD2 1 42 SER H 0.000 . 5.800 3.254 1.839 5.611 . 0 0 "[ . 1 . 2]" 1
1094 1 20 GLU QB 1 34 VAL H 0.000 . 5.710 4.484 2.691 5.742 0.032 9 0 "[ . 1 . 2]" 1
1095 1 14 ILE H 1 92 GLU HA 0.000 . 5.800 4.593 3.062 5.600 . 0 0 "[ . 1 . 2]" 1
1096 1 14 ILE H 1 15 PRO HD3 0.000 . 5.800 4.082 3.762 4.382 . 0 0 "[ . 1 . 2]" 1
1097 1 50 ARG H 1 51 ARG H 0.000 . 5.800 4.280 4.087 4.456 . 0 0 "[ . 1 . 2]" 1
1098 1 91 LEU MD1 1 95 ILE H 0.000 . 5.800 4.716 4.024 5.265 . 0 0 "[ . 1 . 2]" 1
1099 1 85 GLU HA 1 89 GLN H 0.000 . 5.800 3.919 3.453 4.259 . 0 0 "[ . 1 . 2]" 1
1100 1 84 LEU HA 1 88 ARG H 0.000 . 5.800 4.106 3.337 4.936 . 0 0 "[ . 1 . 2]" 1
1101 1 101 LEU MD1 1 102 ASN H 0.000 . 5.800 4.323 4.038 4.499 . 0 0 "[ . 1 . 2]" 1
1102 1 100 TYR H 1 102 ASN H 0.000 . 5.800 4.677 4.532 4.881 . 0 0 "[ . 1 . 2]" 1
1103 1 86 GLN H 1 88 ARG H 0.000 . 5.800 4.368 4.027 4.744 . 0 0 "[ . 1 . 2]" 1
1104 1 89 GLN HG3 1 93 ALA H 0.000 . 5.000 4.859 4.350 5.046 0.046 14 0 "[ . 1 . 2]" 1
1105 1 16 SER QB 1 18 GLY H 0.000 . 5.800 5.039 4.574 5.449 . 0 0 "[ . 1 . 2]" 1
1106 1 18 GLY H 1 20 GLU H 0.000 . 5.800 4.926 3.861 5.810 0.010 2 0 "[ . 1 . 2]" 1
1107 1 37 VAL H 1 38 GLU H 0.000 . 5.800 4.396 4.181 4.553 . 0 0 "[ . 1 . 2]" 1
1108 1 80 ARG HA 1 81 THR H 0.000 . 5.800 3.483 3.405 3.548 . 0 0 "[ . 1 . 2]" 1
1109 1 55 PHE H 1 95 ILE MD 0.000 . 5.800 5.867 5.642 6.034 0.234 15 0 "[ . 1 . 2]" 1
1110 1 80 ARG HB3 1 81 THR H 0.000 . 5.800 3.489 2.566 4.151 . 0 0 "[ . 1 . 2]" 1
1111 1 74 LYS HE2 1 75 ARG H 0.000 . 5.800 5.027 3.685 5.750 . 0 0 "[ . 1 . 2]" 1
1112 1 82 ARG HB3 1 83 GLY H 0.000 . 5.800 2.832 1.840 3.932 . 0 0 "[ . 1 . 2]" 1
1113 1 82 ARG HB2 1 83 GLY H 0.000 . 5.800 3.336 2.075 4.197 . 0 0 "[ . 1 . 2]" 1
1114 1 87 ARG H 1 87 ARG HD2 0.000 . 5.800 4.977 4.696 5.859 0.059 11 0 "[ . 1 . 2]" 1
1115 1 11 GLU H 1 42 SER H 0.000 . 5.800 5.141 4.346 5.596 . 0 0 "[ . 1 . 2]" 1
1116 1 11 GLU H 1 39 VAL HA 0.000 . 5.800 4.949 4.700 5.144 . 0 0 "[ . 1 . 2]" 1
1117 1 67 LYS HB2 1 103 GLN H 0.000 . 5.800 5.218 4.227 5.889 0.089 6 0 "[ . 1 . 2]" 1
1118 1 32 HIS HB3 1 33 MET H 0.000 . 5.730 4.237 3.456 4.555 . 0 0 "[ . 1 . 2]" 1
1119 1 13 HIS H 1 38 GLU HB3 0.000 . 5.710 3.440 2.995 4.387 . 0 0 "[ . 1 . 2]" 1
1120 1 54 GLU H 1 54 GLU HG2 0.000 . 5.100 3.552 2.130 4.429 . 0 0 "[ . 1 . 2]" 1
1121 1 110 LEU H 1 115 LEU HB2 0.000 . 4.500 4.045 3.476 4.541 0.041 19 0 "[ . 1 . 2]" 1
1122 1 106 PRO HB2 1 108 GLU H 0.000 . 5.800 3.066 2.238 3.846 . 0 0 "[ . 1 . 2]" 1
1123 1 37 VAL HB 1 48 VAL H 0.000 . 5.640 4.959 4.651 5.183 . 0 0 "[ . 1 . 2]" 1
1124 1 14 ILE HG12 1 36 ARG H 0.000 . 5.800 5.176 4.318 5.808 0.008 13 0 "[ . 1 . 2]" 1
1125 1 37 VAL H 1 48 VAL HB 0.000 . 5.800 3.612 3.194 3.983 . 0 0 "[ . 1 . 2]" 1
1126 1 107 LYS H 1 110 LEU MD2 0.000 . 5.800 5.481 4.623 5.917 0.117 4 0 "[ . 1 . 2]" 1
1127 1 90 GLY HA3 1 91 LEU H 0.000 . 5.800 2.686 2.629 2.719 . 0 0 "[ . 1 . 2]" 1
1128 1 51 ARG HB3 1 52 TYR H 0.000 . 5.800 3.448 2.334 4.177 . 0 0 "[ . 1 . 2]" 1
1129 1 51 ARG H 1 51 ARG HD2 0.000 . 5.800 5.153 4.604 5.930 0.130 20 0 "[ . 1 . 2]" 1
1130 1 41 CYS HB2 1 42 SER H 0.000 . 5.800 4.032 3.201 4.463 . 0 0 "[ . 1 . 2]" 1
1131 1 109 LEU H 1 109 LEU MD1 0.000 . 5.440 3.439 2.216 4.075 . 0 0 "[ . 1 . 2]" 1
1132 1 77 PRO HA 1 78 ASN H 0.000 . 5.800 2.314 2.131 2.386 . 0 0 "[ . 1 . 2]" 1
1133 1 79 TRP H 1 82 ARG HB2 0.000 . 5.800 4.953 3.404 5.847 0.047 1 0 "[ . 1 . 2]" 1
1134 1 51 ARG HB3 1 53 SER H 0.000 . 5.800 3.753 2.214 5.012 . 0 0 "[ . 1 . 2]" 1
1135 1 110 LEU HA 1 116 ARG H 0.000 . 5.800 4.194 2.745 5.843 0.043 8 0 "[ . 1 . 2]" 1
1136 1 16 SER H 1 36 ARG HB3 0.000 . 5.800 4.655 3.064 5.372 . 0 0 "[ . 1 . 2]" 1
1137 1 87 ARG HG2 1 89 GLN H 0.000 . 5.690 5.657 5.390 6.012 0.322 14 0 "[ . 1 . 2]" 1
1138 1 29 GLU HB3 1 30 LYS H 0.000 . 5.800 3.455 2.096 4.249 . 0 0 "[ . 1 . 2]" 1
1139 1 58 LEU MD1 1 108 GLU H 0.000 . 5.800 4.852 3.986 5.910 0.110 3 0 "[ . 1 . 2]" 1
1140 1 62 ILE MG 1 108 GLU H 0.000 . 5.800 4.301 3.657 5.073 . 0 0 "[ . 1 . 2]" 1
1141 1 13 HIS H 1 14 ILE H 0.000 . 5.800 4.302 4.048 4.386 . 0 0 "[ . 1 . 2]" 1
1142 1 99 LEU MD2 1 101 LEU H 0.000 . 5.800 5.024 4.526 5.805 0.005 7 0 "[ . 1 . 2]" 1
1143 1 87 ARG HG2 1 88 ARG H 0.000 . 5.260 3.563 3.204 4.235 . 0 0 "[ . 1 . 2]" 1
1144 1 54 GLU HB3 1 55 PHE H 0.000 . 5.770 3.499 2.342 4.086 . 0 0 "[ . 1 . 2]" 1
1145 1 52 TYR H 1 53 SER H 0.000 . 5.800 2.697 2.431 2.957 . 0 0 "[ . 1 . 2]" 1
1146 1 33 MET H 1 34 VAL MG1 0.000 . 5.800 4.933 3.878 5.753 . 0 0 "[ . 1 . 2]" 1
1147 1 26 GLN HB2 1 27 SER H 0.000 . 5.800 4.324 3.659 4.535 . 0 0 "[ . 1 . 2]" 1
1148 1 108 GLU HG2 1 112 PHE H 0.000 . 5.800 5.329 4.556 6.041 0.241 7 0 "[ . 1 . 2]" 1
1149 1 55 PHE HA 1 57 ALA H 0.000 . 5.660 4.380 3.921 4.746 . 0 0 "[ . 1 . 2]" 1
1150 1 110 LEU MD2 1 118 PHE H 0.000 . 5.800 4.538 3.124 5.838 0.038 13 0 "[ . 1 . 2]" 1
1151 1 26 GLN HA 1 27 SER H 0.000 . 5.440 2.091 1.985 2.195 . 0 0 "[ . 1 . 2]" 1
1152 1 20 GLU H 1 21 ALA MB 0.000 . 5.800 4.127 3.292 5.683 . 0 0 "[ . 1 . 2]" 1
1153 1 70 ASP H 1 71 PHE H 0.000 . 4.760 4.542 4.244 4.760 . 0 0 "[ . 1 . 2]" 1
1154 1 71 PHE H 1 72 PRO HD2 0.000 . 5.800 5.103 4.732 5.383 . 0 0 "[ . 1 . 2]" 1
1155 1 21 ALA H 1 34 VAL MG2 0.000 . 5.800 5.078 3.083 5.953 0.153 2 0 "[ . 1 . 2]" 1
1156 1 106 PRO HB2 1 107 LYS H 0.000 . 5.800 3.721 2.809 4.165 . 0 0 "[ . 1 . 2]" 1
1157 1 26 GLN HB3 1 27 SER H 0.000 . 5.800 4.114 3.582 4.437 . 0 0 "[ . 1 . 2]" 1
1158 1 26 GLN HG2 1 27 SER H 0.000 . 5.800 4.343 3.362 5.833 0.033 12 0 "[ . 1 . 2]" 1
1159 1 108 GLU H 1 111 GLU QB 0.000 . 5.800 4.972 4.312 5.637 . 0 0 "[ . 1 . 2]" 1
1160 1 106 PRO HD2 1 109 LEU H 0.000 . 5.800 4.763 3.491 5.733 . 0 0 "[ . 1 . 2]" 1
1161 1 80 ARG HB2 1 81 THR H 0.000 . 5.800 3.311 2.355 4.099 . 0 0 "[ . 1 . 2]" 1
1162 1 61 ARG H 1 61 ARG HD2 0.000 . 5.800 4.769 4.050 5.180 . 0 0 "[ . 1 . 2]" 1
1163 1 113 LEU H 1 115 LEU HB2 0.000 . 5.550 4.740 4.054 5.242 . 0 0 "[ . 1 . 2]" 1
1164 1 46 HIS HD2 1 47 THR H 0.000 . 5.800 4.689 3.219 5.858 0.058 4 0 "[ . 1 . 2]" 1
1165 1 22 GLU HB2 1 23 GLY H 0.000 . 5.610 3.312 2.300 4.494 . 0 0 "[ . 1 . 2]" 1
1166 1 22 GLU HB3 1 23 GLY H 0.000 . 5.570 3.877 3.351 4.242 . 0 0 "[ . 1 . 2]" 1
1167 1 63 LYS HA 1 64 LYS H 0.000 . 5.110 3.413 3.289 3.481 . 0 0 "[ . 1 . 2]" 1
1168 1 31 SER HB2 1 32 HIS H 0.000 . 5.800 4.278 3.534 4.511 . 0 0 "[ . 1 . 2]" 1
1169 1 30 LYS HB3 1 32 HIS H 0.000 . 5.800 5.016 4.144 5.876 0.076 9 0 "[ . 1 . 2]" 1
1170 1 87 ARG H 1 89 GLN H 0.000 . 5.800 4.089 3.707 4.321 . 0 0 "[ . 1 . 2]" 1
1171 1 35 PHE QD 1 88 ARG H 0.000 . 5.800 5.895 5.844 6.000 0.200 11 0 "[ . 1 . 2]" 1
1172 1 112 PHE HA 1 114 ARG H 0.000 . 5.800 3.989 3.615 4.234 . 0 0 "[ . 1 . 2]" 1
1173 1 31 SER HA 1 32 HIS H 0.000 . 5.740 2.154 2.027 2.454 . 0 0 "[ . 1 . 2]" 1
1174 1 91 LEU H 1 94 TYR H 0.000 . 5.800 4.854 4.595 5.043 . 0 0 "[ . 1 . 2]" 1
1175 1 44 ARG H 1 45 ARG H 0.000 . 5.610 4.440 4.140 4.570 . 0 0 "[ . 1 . 2]" 1
1176 1 42 SER H 1 44 ARG H 0.000 . 5.800 4.512 4.074 5.414 . 0 0 "[ . 1 . 2]" 1
1177 1 30 LYS HB2 1 32 HIS H 0.000 . 5.800 5.488 4.172 5.868 0.068 15 0 "[ . 1 . 2]" 1
1178 1 97 GLY H 1 98 ILE MD 0.000 . 5.800 5.295 5.116 5.468 . 0 0 "[ . 1 . 2]" 1
1179 1 69 PRO HG2 1 97 GLY H 0.000 . 5.800 5.606 5.003 5.867 0.067 17 0 "[ . 1 . 2]" 1
1180 1 94 TYR HB3 1 97 GLY H 0.000 . 5.800 5.291 5.075 5.571 . 0 0 "[ . 1 . 2]" 1
1181 1 97 GLY H 1 99 LEU H 0.000 . 5.800 4.071 3.888 4.377 . 0 0 "[ . 1 . 2]" 1
1182 1 79 TRP HA 1 80 ARG H 0.000 . 5.800 3.278 2.717 3.513 . 0 0 "[ . 1 . 2]" 1
1183 1 79 TRP HB2 1 80 ARG H 0.000 . 5.800 3.440 2.135 4.468 . 0 0 "[ . 1 . 2]" 1
1184 1 58 LEU H 1 60 LYS H 0.000 . 5.800 4.159 3.954 4.281 . 0 0 "[ . 1 . 2]" 1
1185 1 56 HIS HA 1 60 LYS H 0.000 . 5.800 4.203 3.856 4.599 . 0 0 "[ . 1 . 2]" 1
1186 1 21 ALA MB 1 23 GLY H 0.000 . 5.800 5.025 4.240 5.876 0.076 15 0 "[ . 1 . 2]" 1
1187 1 25 ARG HB2 1 26 GLN H 0.000 . 5.800 3.380 1.985 4.074 . 0 0 "[ . 1 . 2]" 1
1188 1 17 VAL MG2 1 34 VAL H 0.000 . 5.800 5.757 5.502 5.889 0.089 9 0 "[ . 1 . 2]" 1
1189 1 39 VAL H 1 48 VAL H 0.000 . 5.800 4.044 3.642 4.632 . 0 0 "[ . 1 . 2]" 1
1190 1 63 LYS HG3 1 64 LYS H 0.000 . 4.380 2.861 2.349 4.516 0.136 19 0 "[ . 1 . 2]" 1
1191 1 35 PHE HB2 1 50 ARG H 0.000 . 5.800 5.120 4.938 5.277 . 0 0 "[ . 1 . 2]" 1
1192 1 112 PHE H 1 115 LEU HB2 0.000 . 5.800 5.380 4.739 5.837 0.037 3 0 "[ . 1 . 2]" 1
1193 1 68 VAL HA 1 98 ILE H 0.000 . 5.800 5.291 4.848 5.652 . 0 0 "[ . 1 . 2]" 1
1194 1 18 GLY H 1 36 ARG HD2 0.000 . 5.800 5.216 3.708 6.016 0.216 4 0 "[ . 1 . 2]" 1
1195 1 95 ILE H 1 98 ILE MD 0.000 . 5.800 4.550 3.745 4.893 . 0 0 "[ . 1 . 2]" 1
1196 1 112 PHE QD 1 113 LEU H 0.000 . 5.800 3.688 3.116 4.382 . 0 0 "[ . 1 . 2]" 1
1197 1 13 HIS H 1 37 VAL HA 0.000 . 5.800 4.738 4.192 5.252 . 0 0 "[ . 1 . 2]" 1
1198 1 30 LYS H 1 51 ARG HD2 0.000 . 5.800 5.787 4.782 5.976 0.176 20 0 "[ . 1 . 2]" 1
1199 1 20 GLU H 1 32 HIS HA 0.000 . 5.800 5.177 3.054 5.915 0.115 8 0 "[ . 1 . 2]" 1
1200 1 14 ILE HG12 1 37 VAL H 0.000 . 5.800 4.560 4.249 5.263 . 0 0 "[ . 1 . 2]" 1
1201 1 36 ARG HB2 1 37 VAL H 0.000 . 5.800 4.326 4.194 4.475 . 0 0 "[ . 1 . 2]" 1
1202 1 35 PHE QE 1 50 ARG H 0.000 . 5.800 4.549 4.156 5.076 . 0 0 "[ . 1 . 2]" 1
1203 1 91 LEU MD1 1 92 GLU H 0.000 . 5.800 4.786 4.703 4.840 . 0 0 "[ . 1 . 2]" 1
1204 1 54 GLU H 1 57 ALA MB 0.000 . 5.800 4.914 4.536 5.409 . 0 0 "[ . 1 . 2]" 1
1205 1 52 TYR HA 1 53 SER H 0.000 . 5.800 3.491 3.374 3.573 . 0 0 "[ . 1 . 2]" 1
1206 1 109 LEU H 1 111 GLU H 0.000 . 5.800 3.958 3.617 4.374 . 0 0 "[ . 1 . 2]" 1
1207 1 110 LEU HA 1 112 PHE H 0.000 . 5.800 4.060 3.687 4.467 . 0 0 "[ . 1 . 2]" 1
1208 1 56 HIS HA 1 58 LEU H 0.000 . 5.800 4.595 4.216 5.039 . 0 0 "[ . 1 . 2]" 1
1209 1 111 GLU QB 1 114 ARG H 0.000 . 5.800 4.999 4.496 5.310 . 0 0 "[ . 1 . 2]" 1
1210 1 106 PRO HG2 1 108 GLU H 0.000 . 5.800 5.044 2.951 5.814 0.014 19 0 "[ . 1 . 2]" 1
1211 1 34 VAL MG2 1 36 ARG H 0.000 . 5.800 4.503 4.071 5.026 . 0 0 "[ . 1 . 2]" 1
1212 1 67 LYS H 1 102 ASN HB2 0.000 . 5.800 4.065 2.712 5.823 0.023 5 0 "[ . 1 . 2]" 1
1213 1 67 LYS H 1 102 ASN HB3 0.000 . 5.800 3.651 2.175 5.820 0.020 20 0 "[ . 1 . 2]" 1
1214 1 52 TYR O 1 56 HIS H 0.000 . 2.300 2.063 1.843 2.382 0.082 10 0 "[ . 1 . 2]" 1
1215 1 53 SER O 1 57 ALA H 0.000 . 2.300 2.174 1.866 2.383 0.083 12 0 "[ . 1 . 2]" 1
1216 1 54 GLU O 1 58 LEU H 0.000 . 2.300 1.939 1.643 2.283 . 0 0 "[ . 1 . 2]" 1
1217 1 55 PHE O 1 59 HIS H 0.000 . 2.300 1.943 1.741 2.270 . 0 0 "[ . 1 . 2]" 1
1218 1 56 HIS O 1 60 LYS H 0.000 . 2.300 2.163 1.869 2.350 0.050 18 0 "[ . 1 . 2]" 1
1219 1 57 ALA O 1 61 ARG H 0.000 . 2.300 2.177 1.796 2.398 0.098 12 0 "[ . 1 . 2]" 1
1220 1 58 LEU O 1 62 ILE H 0.000 . 2.300 2.040 1.741 2.370 0.070 15 0 "[ . 1 . 2]" 1
1221 1 59 HIS O 1 63 LYS H 0.000 . 2.300 2.196 1.883 2.348 0.048 9 0 "[ . 1 . 2]" 1
1222 1 84 LEU O 1 88 ARG H 0.000 . 2.300 1.990 1.714 2.376 0.076 16 0 "[ . 1 . 2]" 1
1223 1 85 GLU O 1 89 GLN H 0.000 . 2.300 2.036 1.769 2.396 0.096 13 0 "[ . 1 . 2]" 1
1224 1 86 GLN O 1 90 GLY H 0.000 . 2.300 2.111 1.757 2.329 0.029 13 0 "[ . 1 . 2]" 1
1225 1 87 ARG O 1 91 LEU H 0.000 . 2.300 2.165 1.894 2.356 0.056 16 0 "[ . 1 . 2]" 1
1226 1 88 ARG O 1 92 GLU H 0.000 . 2.300 1.931 1.732 2.305 0.005 15 0 "[ . 1 . 2]" 1
1227 1 89 GLN O 1 93 ALA H 0.000 . 2.300 2.051 1.897 2.322 0.022 14 0 "[ . 1 . 2]" 1
1228 1 90 GLY O 1 94 TYR H 0.000 . 2.300 2.285 1.919 2.394 0.094 16 0 "[ . 1 . 2]" 1
1229 1 91 LEU O 1 95 ILE H 0.000 . 2.300 1.873 1.724 2.234 . 0 0 "[ . 1 . 2]" 1
1230 1 92 GLU O 1 96 GLN H 0.000 . 2.300 1.925 1.720 2.338 0.038 13 0 "[ . 1 . 2]" 1
1231 1 93 ALA O 1 97 GLY H 0.000 . 2.300 2.179 1.999 2.337 0.037 3 0 "[ . 1 . 2]" 1
1232 1 94 TYR O 1 98 ILE H 0.000 . 2.300 2.091 1.702 2.348 0.048 13 0 "[ . 1 . 2]" 1
1233 1 95 ILE O 1 99 LEU H 0.000 . 2.300 2.197 1.813 2.357 0.057 6 0 "[ . 1 . 2]" 1
1234 1 96 GLN O 1 100 TYR H 0.000 . 2.300 2.005 1.722 2.254 . 0 0 "[ . 1 . 2]" 1
1235 1 97 GLY O 1 101 LEU H 0.000 . 2.300 2.028 1.798 2.319 0.019 17 0 "[ . 1 . 2]" 1
1236 1 18 GLY O 1 34 VAL H 0.000 . 2.300 1.892 1.689 2.339 0.039 14 0 "[ . 1 . 2]" 1
1237 1 18 GLY H 1 34 VAL O 0.000 . 2.300 1.941 1.766 2.300 0.000 14 0 "[ . 1 . 2]" 1
1238 1 16 SER O 1 36 ARG H 0.000 . 2.300 2.001 1.741 2.275 . 0 0 "[ . 1 . 2]" 1
1239 1 13 HIS O 1 38 GLU H 0.000 . 2.300 1.845 1.702 2.054 . 0 0 "[ . 1 . 2]" 1
1240 1 13 HIS H 1 38 GLU O 0.000 . 2.300 1.998 1.849 2.191 . 0 0 "[ . 1 . 2]" 1
1241 1 11 GLU H 1 40 LEU O 0.000 . 2.300 2.167 1.888 2.370 0.070 2 0 "[ . 1 . 2]" 1
1242 1 11 GLU O 1 40 LEU H 0.000 . 2.300 1.831 1.707 2.204 . 0 0 "[ . 1 . 2]" 1
1243 1 35 PHE H 1 50 ARG O 0.000 . 2.300 2.101 1.806 2.347 0.047 10 0 "[ . 1 . 2]" 1
1244 1 35 PHE O 1 50 ARG H 0.000 . 2.300 1.801 1.701 1.956 . 0 0 "[ . 1 . 2]" 1
1245 1 37 VAL H 1 48 VAL O 0.000 . 2.300 1.845 1.772 1.949 . 0 0 "[ . 1 . 2]" 1
1246 1 37 VAL O 1 48 VAL H 0.000 . 2.300 1.794 1.656 1.929 . 0 0 "[ . 1 . 2]" 1
1247 1 39 VAL H 1 46 HIS O 0.000 . 2.300 2.161 1.921 2.358 0.058 9 0 "[ . 1 . 2]" 1
1248 1 39 VAL O 1 46 HIS H 0.000 . 2.300 2.185 1.926 2.376 0.076 7 0 "[ . 1 . 2]" 1
1249 1 41 CYS H 1 44 ARG O 0.000 . 2.300 1.808 1.690 1.958 . 0 0 "[ . 1 . 2]" 1
1250 1 107 LYS O 1 111 GLU H 0.000 . 2.300 2.084 1.768 2.347 0.047 18 0 "[ . 1 . 2]" 1
1251 1 108 GLU O 1 112 PHE H 0.000 . 2.300 2.155 1.772 2.366 0.066 13 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 38
_Distance_constraint_stats_list.Viol_count 87
_Distance_constraint_stats_list.Viol_total 91.567
_Distance_constraint_stats_list.Viol_max 0.147
_Distance_constraint_stats_list.Viol_rms 0.0205
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0060
_Distance_constraint_stats_list.Viol_average_violations_only 0.0526
_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 11 GLU 0.125 0.068 16 0 "[ . 1 . 2]"
1 13 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 SER 0.052 0.052 19 0 "[ . 1 . 2]"
1 18 GLY 0.068 0.068 14 0 "[ . 1 . 2]"
1 34 VAL 0.068 0.068 14 0 "[ . 1 . 2]"
1 35 PHE 0.157 0.088 10 0 "[ . 1 . 2]"
1 36 ARG 0.052 0.052 19 0 "[ . 1 . 2]"
1 37 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 VAL 0.378 0.067 9 0 "[ . 1 . 2]"
1 40 LEU 0.125 0.068 16 0 "[ . 1 . 2]"
1 41 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 HIS 0.378 0.067 9 0 "[ . 1 . 2]"
1 48 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 ARG 0.157 0.088 10 0 "[ . 1 . 2]"
1 52 TYR 0.159 0.098 10 0 "[ . 1 . 2]"
1 53 SER 0.349 0.093 18 0 "[ . 1 . 2]"
1 54 GLU 0.054 0.029 7 0 "[ . 1 . 2]"
1 55 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 HIS 0.267 0.098 10 0 "[ . 1 . 2]"
1 57 ALA 0.597 0.093 18 0 "[ . 1 . 2]"
1 58 LEU 0.212 0.147 15 0 "[ . 1 . 2]"
1 59 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 LYS 0.108 0.069 9 0 "[ . 1 . 2]"
1 61 ARG 0.248 0.085 19 0 "[ . 1 . 2]"
1 62 ILE 0.158 0.147 15 0 "[ . 1 . 2]"
1 63 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 LEU 0.236 0.142 16 0 "[ . 1 . 2]"
1 85 GLU 0.056 0.053 13 0 "[ . 1 . 2]"
1 86 GLN 0.096 0.056 14 0 "[ . 1 . 2]"
1 87 ARG 0.656 0.121 16 0 "[ . 1 . 2]"
1 88 ARG 0.236 0.142 16 0 "[ . 1 . 2]"
1 89 GLN 0.117 0.053 13 0 "[ . 1 . 2]"
1 90 GLY 1.032 0.122 16 0 "[ . 1 . 2]"
1 91 LEU 0.660 0.121 16 0 "[ . 1 . 2]"
1 92 GLU 0.015 0.009 19 0 "[ . 1 . 2]"
1 93 ALA 0.061 0.034 4 0 "[ . 1 . 2]"
1 94 TYR 1.213 0.122 16 0 "[ . 1 . 2]"
1 95 ILE 0.359 0.079 6 0 "[ . 1 . 2]"
1 96 GLN 0.015 0.009 19 0 "[ . 1 . 2]"
1 97 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 ILE 0.277 0.103 13 0 "[ . 1 . 2]"
1 99 LEU 0.355 0.079 6 0 "[ . 1 . 2]"
1 100 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 LYS 0.030 0.029 13 0 "[ . 1 . 2]"
1 108 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 GLU 0.030 0.029 13 0 "[ . 1 . 2]"
1 112 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 52 TYR O 1 56 HIS N 0.000 . 3.200 2.972 2.773 3.298 0.098 10 0 "[ . 1 . 2]" 2
2 1 53 SER O 1 57 ALA N 0.000 . 3.200 3.091 2.818 3.293 0.093 18 0 "[ . 1 . 2]" 2
3 1 54 GLU O 1 58 LEU N 0.000 . 3.200 2.881 2.589 3.229 0.029 7 0 "[ . 1 . 2]" 2
4 1 55 PHE O 1 59 HIS N 0.000 . 3.200 2.871 2.686 3.183 . 0 0 "[ . 1 . 2]" 2
5 1 56 HIS O 1 60 LYS N 0.000 . 3.200 3.050 2.797 3.269 0.069 9 0 "[ . 1 . 2]" 2
6 1 57 ALA O 1 61 ARG N 0.000 . 3.200 3.045 2.668 3.285 0.085 19 0 "[ . 1 . 2]" 2
7 1 58 LEU O 1 62 ILE N 0.000 . 3.200 3.005 2.722 3.347 0.147 15 0 "[ . 1 . 2]" 2
8 1 59 HIS O 1 63 LYS N 0.000 . 3.200 2.934 2.772 3.132 . 0 0 "[ . 1 . 2]" 2
9 1 84 LEU O 1 88 ARG N 0.000 . 3.200 2.952 2.680 3.342 0.142 16 0 "[ . 1 . 2]" 2
10 1 85 GLU O 1 89 GLN N 0.000 . 3.200 2.950 2.685 3.253 0.053 13 0 "[ . 1 . 2]" 2
11 1 86 GLN O 1 90 GLY N 0.000 . 3.200 3.024 2.723 3.256 0.056 14 0 "[ . 1 . 2]" 2
12 1 87 ARG O 1 91 LEU N 0.000 . 3.200 3.131 2.873 3.321 0.121 16 0 "[ . 1 . 2]" 2
13 1 88 ARG O 1 92 GLU N 0.000 . 3.200 2.850 2.702 3.094 . 0 0 "[ . 1 . 2]" 2
14 1 89 GLN O 1 93 ALA N 0.000 . 3.200 2.967 2.800 3.234 0.034 4 0 "[ . 1 . 2]" 2
15 1 90 GLY O 1 94 TYR N 0.000 . 3.200 3.191 2.876 3.322 0.122 16 0 "[ . 1 . 2]" 2
16 1 91 LEU O 1 95 ILE N 0.000 . 3.200 2.834 2.672 3.204 0.004 11 0 "[ . 1 . 2]" 2
17 1 92 GLU O 1 96 GLN N 0.000 . 3.200 2.863 2.640 3.209 0.009 19 0 "[ . 1 . 2]" 2
18 1 93 ALA O 1 97 GLY N 0.000 . 3.200 2.976 2.837 3.194 . 0 0 "[ . 1 . 2]" 2
19 1 94 TYR O 1 98 ILE N 0.000 . 3.200 3.054 2.685 3.303 0.103 13 0 "[ . 1 . 2]" 2
20 1 95 ILE O 1 99 LEU N 0.000 . 3.200 3.108 2.769 3.279 0.079 6 0 "[ . 1 . 2]" 2
21 1 96 GLN O 1 100 TYR N 0.000 . 3.200 2.845 2.673 3.093 . 0 0 "[ . 1 . 2]" 2
22 1 97 GLY O 1 101 LEU N 0.000 . 3.200 2.825 2.666 3.111 . 0 0 "[ . 1 . 2]" 2
23 1 18 GLY O 1 34 VAL N 0.000 . 3.200 2.854 2.671 3.268 0.068 14 0 "[ . 1 . 2]" 2
24 1 18 GLY N 1 34 VAL O 0.000 . 3.200 2.865 2.718 3.150 . 0 0 "[ . 1 . 2]" 2
25 1 16 SER O 1 36 ARG N 0.000 . 3.200 2.966 2.703 3.252 0.052 19 0 "[ . 1 . 2]" 2
26 1 13 HIS O 1 38 GLU N 0.000 . 3.200 2.765 2.650 2.917 . 0 0 "[ . 1 . 2]" 2
27 1 13 HIS N 1 38 GLU O 0.000 . 3.200 2.946 2.819 3.125 . 0 0 "[ . 1 . 2]" 2
28 1 11 GLU N 1 40 LEU O 0.000 . 3.200 3.058 2.814 3.268 0.068 16 0 "[ . 1 . 2]" 2
29 1 11 GLU O 1 40 LEU N 0.000 . 3.200 2.757 2.685 3.058 . 0 0 "[ . 1 . 2]" 2
30 1 35 PHE N 1 50 ARG O 0.000 . 3.200 3.012 2.743 3.288 0.088 10 0 "[ . 1 . 2]" 2
31 1 35 PHE O 1 50 ARG N 0.000 . 3.200 2.760 2.662 2.875 . 0 0 "[ . 1 . 2]" 2
32 1 37 VAL N 1 48 VAL O 0.000 . 3.200 2.759 2.687 2.873 . 0 0 "[ . 1 . 2]" 2
33 1 37 VAL O 1 48 VAL N 0.000 . 3.200 2.754 2.617 2.869 . 0 0 "[ . 1 . 2]" 2
34 1 39 VAL N 1 46 HIS O 0.000 . 3.200 3.079 2.833 3.267 0.067 9 0 "[ . 1 . 2]" 2
35 1 39 VAL O 1 46 HIS N 0.000 . 3.200 3.057 2.889 3.252 0.052 8 0 "[ . 1 . 2]" 2
36 1 41 CYS N 1 44 ARG O 0.000 . 3.200 2.755 2.668 2.900 . 0 0 "[ . 1 . 2]" 2
37 1 107 LYS O 1 111 GLU N 0.000 . 3.200 2.967 2.688 3.229 0.029 13 0 "[ . 1 . 2]" 2
38 1 108 GLU O 1 112 PHE N 0.000 . 3.200 2.784 2.647 2.920 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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