NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
531725 |
2l9j   |
17451 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2l9j
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 1539
_Distance_constraint_stats_list.Viol_count 2079
_Distance_constraint_stats_list.Viol_total 2026.741
_Distance_constraint_stats_list.Viol_max 0.360
_Distance_constraint_stats_list.Viol_rms 0.0185
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0033
_Distance_constraint_stats_list.Viol_average_violations_only 0.0487
_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 4 ILE 0.004 0.004 10 0 "[ . 1 . 2]"
1 7 ALA 0.002 0.002 2 0 "[ . 1 . 2]"
1 8 ALA 0.179 0.065 3 0 "[ . 1 . 2]"
1 9 GLU 0.327 0.065 3 0 "[ . 1 . 2]"
1 10 LEU 0.709 0.083 13 0 "[ . 1 . 2]"
1 11 ASP 1.027 0.120 4 0 "[ . 1 . 2]"
1 12 ARG 0.691 0.170 12 0 "[ . 1 . 2]"
1 13 THR 0.657 0.146 10 0 "[ . 1 . 2]"
1 14 GLU 1.116 0.260 10 0 "[ . 1 . 2]"
1 15 GLU 1.504 0.320 1 0 "[ . 1 . 2]"
1 16 TYR 1.450 0.320 1 0 "[ . 1 . 2]"
1 17 ALA 0.118 0.054 14 0 "[ . 1 . 2]"
1 18 LEU 1.762 0.209 6 0 "[ . 1 . 2]"
1 19 GLY 0.547 0.103 11 0 "[ . 1 . 2]"
1 20 VAL 1.063 0.081 11 0 "[ . 1 . 2]"
1 21 VAL 4.594 0.229 6 0 "[ . 1 . 2]"
1 22 GLY 3.178 0.229 6 0 "[ . 1 . 2]"
1 23 VAL 1.793 0.124 12 0 "[ . 1 . 2]"
1 24 LEU 2.101 0.170 17 0 "[ . 1 . 2]"
1 25 GLU 1.108 0.152 13 0 "[ . 1 . 2]"
1 26 SER 0.139 0.052 3 0 "[ . 1 . 2]"
1 27 TYR 1.243 0.085 12 0 "[ . 1 . 2]"
1 28 ILE 1.385 0.094 15 0 "[ . 1 . 2]"
1 29 GLY 0.142 0.067 2 0 "[ . 1 . 2]"
1 30 SER 0.315 0.116 20 0 "[ . 1 . 2]"
1 31 ILE 1.945 0.119 5 0 "[ . 1 . 2]"
1 32 ASN 2.150 0.123 15 0 "[ . 1 . 2]"
1 33 ASN 0.649 0.123 15 0 "[ . 1 . 2]"
1 34 ILE 3.417 0.216 19 0 "[ . 1 . 2]"
1 35 THR 1.386 0.163 1 0 "[ . 1 . 2]"
1 36 LYS 0.537 0.084 16 0 "[ . 1 . 2]"
1 37 GLN 1.033 0.083 8 0 "[ . 1 . 2]"
1 38 SER 0.415 0.310 8 0 "[ . 1 . 2]"
1 39 ALA 0.213 0.104 18 0 "[ . 1 . 2]"
1 40 CYS 0.870 0.074 19 0 "[ . 1 . 2]"
1 41 VAL 1.462 0.310 8 0 "[ . 1 . 2]"
1 42 ALA 1.852 0.101 4 0 "[ . 1 . 2]"
1 43 MET 9.179 0.249 13 0 "[ . 1 . 2]"
1 44 SER 0.969 0.108 14 0 "[ . 1 . 2]"
1 45 LYS 1.849 0.212 6 0 "[ . 1 . 2]"
1 46 LEU 8.779 0.249 13 0 "[ . 1 . 2]"
1 47 LEU 2.264 0.136 13 0 "[ . 1 . 2]"
1 48 THR 0.964 0.136 13 0 "[ . 1 . 2]"
1 49 GLU 0.381 0.041 14 0 "[ . 1 . 2]"
1 50 LEU 1.009 0.130 16 0 "[ . 1 . 2]"
1 51 ASN 0.646 0.094 8 0 "[ . 1 . 2]"
1 52 SER 0.318 0.062 6 0 "[ . 1 . 2]"
1 53 ASP 0.952 0.171 10 0 "[ . 1 . 2]"
1 54 ASP 0.941 0.092 18 0 "[ . 1 . 2]"
1 55 ILE 4.493 0.195 18 0 "[ . 1 . 2]"
1 56 LYS 1.615 0.195 18 0 "[ . 1 . 2]"
1 57 LYS 1.685 0.126 10 0 "[ . 1 . 2]"
1 58 LEU 0.743 0.052 6 0 "[ . 1 . 2]"
1 59 ARG 0.220 0.034 19 0 "[ . 1 . 2]"
1 60 ASP 0.338 0.052 6 0 "[ . 1 . 2]"
1 61 ASN 0.461 0.061 10 0 "[ . 1 . 2]"
1 62 GLU 1.167 0.119 17 0 "[ . 1 . 2]"
1 63 GLU 0.191 0.041 2 0 "[ . 1 . 2]"
1 64 PRO 0.443 0.081 1 0 "[ . 1 . 2]"
1 65 ASN 1.422 0.103 9 0 "[ . 1 . 2]"
1 66 SER 2.164 0.103 9 0 "[ . 1 . 2]"
1 67 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 LYS 2.286 0.127 12 0 "[ . 1 . 2]"
1 69 ILE 1.504 0.060 6 0 "[ . 1 . 2]"
1 70 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 VAL 3.584 0.133 15 0 "[ . 1 . 2]"
1 72 TYR 0.888 0.063 16 0 "[ . 1 . 2]"
1 73 ASN 0.005 0.004 11 0 "[ . 1 . 2]"
1 74 THR 0.009 0.006 6 0 "[ . 1 . 2]"
1 75 VAL 2.688 0.138 15 0 "[ . 1 . 2]"
1 76 ILE 0.331 0.043 7 0 "[ . 1 . 2]"
1 77 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 TYR 2.577 0.115 10 0 "[ . 1 . 2]"
1 79 ILE 3.403 0.115 10 0 "[ . 1 . 2]"
1 80 GLU 1.581 0.102 20 0 "[ . 1 . 2]"
1 81 SER 3.036 0.112 14 0 "[ . 1 . 2]"
1 82 ASN 3.334 0.112 14 0 "[ . 1 . 2]"
1 83 ARG 1.111 0.085 6 0 "[ . 1 . 2]"
1 84 LYS 0.735 0.228 15 0 "[ . 1 . 2]"
1 85 ASN 0.174 0.022 14 0 "[ . 1 . 2]"
1 86 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 LYS 0.882 0.259 3 0 "[ . 1 . 2]"
1 88 GLN 0.481 0.035 20 0 "[ . 1 . 2]"
1 89 THR 0.526 0.055 4 0 "[ . 1 . 2]"
1 90 ILE 0.817 0.080 17 0 "[ . 1 . 2]"
1 91 HIS 1.031 0.155 2 0 "[ . 1 . 2]"
1 92 LEU 1.107 0.137 11 0 "[ . 1 . 2]"
1 93 LEU 2.363 0.096 5 0 "[ . 1 . 2]"
1 94 LYS 4.554 0.181 14 0 "[ . 1 . 2]"
1 95 ARG 3.465 0.192 13 0 "[ . 1 . 2]"
1 96 LEU 0.726 0.102 17 0 "[ . 1 . 2]"
1 97 PRO 1.360 0.150 17 0 "[ . 1 . 2]"
1 98 ALA 0.358 0.101 17 0 "[ . 1 . 2]"
1 99 ASP 0.318 0.150 17 0 "[ . 1 . 2]"
1 100 VAL 9.442 0.312 19 0 "[ . 1 . 2]"
1 101 LEU 15.963 0.360 9 0 "[ . 1 . 2]"
1 102 LYS 1.290 0.094 15 0 "[ . 1 . 2]"
1 103 LYS 2.766 0.298 4 0 "[ . 1 . 2]"
1 104 THR 2.120 0.138 12 0 "[ . 1 . 2]"
1 105 ILE 3.880 0.360 9 0 "[ . 1 . 2]"
1 106 LYS 0.329 0.037 3 0 "[ . 1 . 2]"
1 107 ASN 0.745 0.080 15 0 "[ . 1 . 2]"
1 108 THR 0.911 0.075 19 0 "[ . 1 . 2]"
1 109 LEU 1.025 0.084 8 0 "[ . 1 . 2]"
1 110 ASP 0.212 0.059 7 0 "[ . 1 . 2]"
1 111 ILE 0.374 0.069 6 0 "[ . 1 . 2]"
1 112 HIS 0.814 0.088 16 0 "[ . 1 . 2]"
1 113 LYS 2.616 0.203 1 0 "[ . 1 . 2]"
1 114 SER 0.540 0.158 14 0 "[ . 1 . 2]"
1 115 ILE 4.671 0.254 9 0 "[ . 1 . 2]"
1 116 THR 3.227 0.254 9 0 "[ . 1 . 2]"
1 117 ILE 1.212 0.150 16 0 "[ . 1 . 2]"
1 118 ASN 0.548 0.117 15 0 "[ . 1 . 2]"
1 119 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 120 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 121 LYS 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 4 ILE H 1 4 ILE HG13 3.500 . 5.000 2.864 1.996 4.346 0.004 10 0 "[ . 1 . 2]" 1
2 1 4 ILE HA 1 4 ILE MG 3.000 . 4.100 2.322 2.219 3.192 . 0 0 "[ . 1 . 2]" 1
3 1 7 ALA H 1 7 ALA MB 2.900 . 4.000 2.590 2.204 2.860 . 0 0 "[ . 1 . 2]" 1
4 1 7 ALA MB 1 8 ALA H 3.000 . 4.100 2.989 1.898 3.723 0.002 2 0 "[ . 1 . 2]" 1
5 1 8 ALA H 1 8 ALA MB 3.000 . 4.200 2.616 2.209 2.891 . 0 0 "[ . 1 . 2]" 1
6 1 8 ALA HA 1 9 GLU H 2.600 . 3.500 2.643 2.147 3.565 0.065 3 0 "[ . 1 . 2]" 1
7 1 8 ALA MB 1 9 GLU H 3.100 . 4.300 2.915 1.882 3.725 0.018 17 0 "[ . 1 . 2]" 1
8 1 8 ALA MB 1 9 GLU HA 3.700 . 5.400 4.187 3.735 4.949 . 0 0 "[ . 1 . 2]" 1
9 1 9 GLU H 1 9 GLU HB3 3.000 . 4.100 3.431 2.519 3.992 . 0 0 "[ . 1 . 2]" 1
10 1 9 GLU H 1 9 GLU HG2 3.400 . 4.800 3.332 2.070 4.675 . 0 0 "[ . 1 . 2]" 1
11 1 9 GLU H 1 9 GLU HG3 3.600 . 5.200 3.192 1.996 4.860 0.004 5 0 "[ . 1 . 2]" 1
12 1 9 GLU HA 1 10 LEU H 2.500 . 3.300 2.587 2.144 3.324 0.024 1 0 "[ . 1 . 2]" 1
13 1 9 GLU HB2 1 10 LEU H 3.100 . 4.300 3.461 1.930 4.355 0.055 15 0 "[ . 1 . 2]" 1
14 1 9 GLU HG2 1 10 LEU H 3.700 . 5.400 4.055 2.884 5.136 . 0 0 "[ . 1 . 2]" 1
15 1 9 GLU HG3 1 10 LEU H 3.700 . 5.500 4.508 3.033 5.510 0.010 16 0 "[ . 1 . 2]" 1
16 1 10 LEU H 1 10 LEU HB2 2.500 . 3.300 2.764 2.280 3.318 0.018 5 0 "[ . 1 . 2]" 1
17 1 10 LEU H 1 10 LEU MD1 3.500 . 5.000 3.468 1.958 4.930 0.042 15 0 "[ . 1 . 2]" 1
18 1 10 LEU H 1 10 LEU MD2 3.700 . 5.400 3.768 2.543 4.914 . 0 0 "[ . 1 . 2]" 1
19 1 10 LEU H 1 11 ASP H 2.800 . 3.800 3.094 2.387 3.870 0.070 19 0 "[ . 1 . 2]" 1
20 1 10 LEU HA 1 10 LEU MD2 2.800 . 3.800 3.003 2.131 3.833 0.033 16 0 "[ . 1 . 2]" 1
21 1 10 LEU HB2 1 11 ASP H 3.500 . 5.100 2.935 1.875 4.664 0.025 10 0 "[ . 1 . 2]" 1
22 1 10 LEU HB3 1 10 LEU MD1 2.800 . 3.800 2.787 2.274 3.214 . 0 0 "[ . 1 . 2]" 1
23 1 10 LEU HB3 1 10 LEU MD2 2.900 . 4.000 2.356 2.213 3.221 . 0 0 "[ . 1 . 2]" 1
24 1 10 LEU HB3 1 11 ASP H 3.700 . 5.500 3.101 1.817 4.417 0.083 13 0 "[ . 1 . 2]" 1
25 1 10 LEU MD1 1 11 ASP H 3.000 . 4.100 3.853 2.919 4.124 0.024 5 0 "[ . 1 . 2]" 1
26 1 10 LEU HG 1 11 ASP H 3.700 . 5.500 4.104 1.969 5.402 . 0 0 "[ . 1 . 2]" 1
27 1 11 ASP H 1 11 ASP HB2 2.900 . 3.900 2.871 2.358 3.704 . 0 0 "[ . 1 . 2]" 1
28 1 11 ASP H 1 11 ASP HB3 2.800 . 3.800 3.467 2.418 3.920 0.120 4 0 "[ . 1 . 2]" 1
29 1 11 ASP HA 1 12 ARG H 2.600 . 3.400 2.669 2.146 3.479 0.079 8 0 "[ . 1 . 2]" 1
30 1 11 ASP HB3 1 13 THR H 3.400 . 4.900 4.109 2.715 4.963 0.063 10 0 "[ . 1 . 2]" 1
31 1 12 ARG H 1 12 ARG HB3 2.800 . 3.800 3.400 2.522 3.743 . 0 0 "[ . 1 . 2]" 1
32 1 12 ARG H 1 12 ARG HG2 3.600 . 5.200 3.845 2.068 4.890 . 0 0 "[ . 1 . 2]" 1
33 1 12 ARG H 1 12 ARG HG3 3.700 . 5.500 3.422 2.045 5.122 . 0 0 "[ . 1 . 2]" 1
34 1 12 ARG HA 1 12 ARG QD 3.000 . 4.200 3.860 2.605 4.370 0.170 12 0 "[ . 1 . 2]" 1
35 1 12 ARG HA 1 12 ARG HG2 2.900 . 4.000 2.855 2.343 3.625 . 0 0 "[ . 1 . 2]" 1
36 1 12 ARG HB2 1 12 ARG QD 2.900 . 4.000 2.736 2.291 3.438 . 0 0 "[ . 1 . 2]" 1
37 1 12 ARG HB2 1 13 THR H 3.200 . 4.500 3.760 1.922 4.593 0.093 18 0 "[ . 1 . 2]" 1
38 1 12 ARG HB3 1 12 ARG QD 2.800 . 3.800 2.696 2.268 3.554 . 0 0 "[ . 1 . 2]" 1
39 1 12 ARG HB3 1 13 THR H 3.400 . 4.900 3.678 2.024 4.592 . 0 0 "[ . 1 . 2]" 1
40 1 12 ARG HG2 1 13 THR H 3.700 . 5.500 4.373 2.054 5.646 0.146 10 0 "[ . 1 . 2]" 1
41 1 12 ARG HG3 1 13 THR H 3.700 . 5.500 4.568 3.720 5.223 . 0 0 "[ . 1 . 2]" 1
42 1 13 THR H 1 13 THR MG 2.900 . 4.000 3.257 1.797 4.022 0.022 7 0 "[ . 1 . 2]" 1
43 1 13 THR H 1 14 GLU H 3.200 . 4.500 3.753 1.885 4.530 0.030 15 0 "[ . 1 . 2]" 1
44 1 13 THR HA 1 13 THR MG 2.600 . 3.400 2.565 2.253 3.199 . 0 0 "[ . 1 . 2]" 1
45 1 13 THR HA 1 14 GLU H 2.500 . 3.300 2.469 2.150 3.332 0.032 9 0 "[ . 1 . 2]" 1
46 1 13 THR MG 1 14 GLU H 3.200 . 4.500 3.308 1.900 4.087 0.000 18 0 "[ . 1 . 2]" 1
47 1 13 THR MG 1 15 GLU H 3.300 . 4.600 4.033 2.449 4.648 0.048 10 0 "[ . 1 . 2]" 1
48 1 14 GLU H 1 14 GLU HB2 2.900 . 4.000 2.889 2.404 3.538 . 0 0 "[ . 1 . 2]" 1
49 1 14 GLU H 1 14 GLU HB3 2.700 . 3.600 3.226 2.478 3.860 0.260 10 0 "[ . 1 . 2]" 1
50 1 14 GLU H 1 14 GLU HG2 3.400 . 4.800 4.030 2.141 4.819 0.019 20 0 "[ . 1 . 2]" 1
51 1 14 GLU H 1 14 GLU HG3 3.600 . 5.200 4.071 2.202 5.189 . 0 0 "[ . 1 . 2]" 1
52 1 14 GLU H 1 15 GLU H 3.200 . 4.400 3.513 2.410 4.471 0.071 10 0 "[ . 1 . 2]" 1
53 1 14 GLU HA 1 14 GLU HG2 3.000 . 4.100 2.940 2.329 3.663 . 0 0 "[ . 1 . 2]" 1
54 1 14 GLU HA 1 15 GLU H 2.600 . 3.500 2.804 2.145 3.565 0.065 1 0 "[ . 1 . 2]" 1
55 1 15 GLU H 1 15 GLU QB 2.500 . 3.300 2.734 2.211 3.246 . 0 0 "[ . 1 . 2]" 1
56 1 15 GLU H 1 15 GLU HG2 3.600 . 5.200 4.138 2.823 5.222 0.022 2 0 "[ . 1 . 2]" 1
57 1 15 GLU H 1 15 GLU HG3 3.700 . 5.500 4.057 2.148 4.861 . 0 0 "[ . 1 . 2]" 1
58 1 15 GLU H 1 16 TYR H 2.900 . 4.000 3.715 2.885 4.227 0.227 13 0 "[ . 1 . 2]" 1
59 1 15 GLU HA 1 15 GLU HG2 3.000 . 4.200 3.083 2.323 3.674 . 0 0 "[ . 1 . 2]" 1
60 1 15 GLU HA 1 16 TYR H 2.700 . 3.600 2.478 2.146 3.574 . 0 0 "[ . 1 . 2]" 1
61 1 15 GLU HA 1 16 TYR HB3 3.500 . 5.000 4.865 4.567 5.320 0.320 1 0 "[ . 1 . 2]" 1
62 1 15 GLU QB 1 16 TYR H 3.100 . 4.300 3.484 1.786 4.036 0.114 13 0 "[ . 1 . 2]" 1
63 1 16 TYR H 1 16 TYR HB2 2.900 . 3.900 3.564 2.345 3.943 0.043 16 0 "[ . 1 . 2]" 1
64 1 16 TYR H 1 16 TYR HB3 2.700 . 3.600 2.936 2.535 3.696 0.096 1 0 "[ . 1 . 2]" 1
65 1 16 TYR H 1 16 TYR QD 3.000 . 4.200 2.551 1.799 4.287 0.087 10 0 "[ . 1 . 2]" 1
66 1 16 TYR H 1 17 ALA MB 3.700 . 5.500 4.626 3.401 5.554 0.054 14 0 "[ . 1 . 2]" 1
67 1 16 TYR HA 1 16 TYR QD 2.800 . 3.800 3.495 2.417 3.704 . 0 0 "[ . 1 . 2]" 1
68 1 16 TYR HB2 1 17 ALA H 3.200 . 4.500 3.072 1.891 4.415 0.009 8 0 "[ . 1 . 2]" 1
69 1 16 TYR HB2 1 18 LEU H 3.200 . 4.500 3.974 2.623 4.550 0.050 8 0 "[ . 1 . 2]" 1
70 1 17 ALA H 1 17 ALA MB 2.600 . 3.400 2.745 2.224 2.941 . 0 0 "[ . 1 . 2]" 1
71 1 17 ALA H 1 18 LEU H 2.900 . 4.000 2.789 1.934 4.035 0.035 20 0 "[ . 1 . 2]" 1
72 1 17 ALA MB 1 18 LEU H 3.000 . 4.100 3.185 1.906 3.711 . 0 0 "[ . 1 . 2]" 1
73 1 18 LEU H 1 18 LEU HB3 2.800 . 3.700 3.592 2.911 3.909 0.209 6 0 "[ . 1 . 2]" 1
74 1 18 LEU H 1 18 LEU MD2 3.000 . 4.100 2.947 1.892 4.198 0.098 9 0 "[ . 1 . 2]" 1
75 1 18 LEU H 1 18 LEU HG 2.700 . 3.600 2.686 1.793 3.707 0.107 9 0 "[ . 1 . 2]" 1
76 1 18 LEU HA 1 18 LEU MD1 3.100 . 4.300 3.536 2.656 4.104 . 0 0 "[ . 1 . 2]" 1
77 1 18 LEU HA 1 18 LEU MD2 2.700 . 3.600 2.619 2.107 3.704 0.104 7 0 "[ . 1 . 2]" 1
78 1 18 LEU HA 1 18 LEU HG 2.800 . 3.800 3.002 2.326 3.622 . 0 0 "[ . 1 . 2]" 1
79 1 18 LEU HB2 1 18 LEU MD1 2.900 . 3.900 2.348 2.206 2.446 . 0 0 "[ . 1 . 2]" 1
80 1 18 LEU HB2 1 18 LEU MD2 2.700 . 3.600 2.998 2.387 3.204 . 0 0 "[ . 1 . 2]" 1
81 1 18 LEU HB2 1 19 GLY H 3.000 . 4.100 3.076 1.882 4.138 0.038 6 0 "[ . 1 . 2]" 1
82 1 18 LEU HB2 1 20 VAL H 3.700 . 5.500 3.522 2.684 5.035 . 0 0 "[ . 1 . 2]" 1
83 1 18 LEU HB2 1 20 VAL MG2 3.400 . 4.900 3.512 2.272 4.907 0.007 11 0 "[ . 1 . 2]" 1
84 1 18 LEU HB3 1 18 LEU MD1 2.900 . 3.900 2.574 2.270 3.202 . 0 0 "[ . 1 . 2]" 1
85 1 18 LEU HB3 1 18 LEU MD2 2.700 . 3.600 2.320 2.213 2.390 . 0 0 "[ . 1 . 2]" 1
86 1 18 LEU HB3 1 19 GLY H 3.300 . 4.700 3.017 1.891 4.558 0.009 16 0 "[ . 1 . 2]" 1
87 1 18 LEU HB3 1 20 VAL MG2 3.100 . 4.300 3.302 2.301 4.213 . 0 0 "[ . 1 . 2]" 1
88 1 18 LEU MD1 1 19 GLY H 3.600 . 5.200 4.392 3.803 5.303 0.103 11 0 "[ . 1 . 2]" 1
89 1 18 LEU MD2 1 19 GLY H 3.700 . 5.500 4.117 3.596 4.914 . 0 0 "[ . 1 . 2]" 1
90 1 19 GLY H 1 20 VAL H 3.000 . 4.200 2.728 1.759 3.659 0.041 1 0 "[ . 1 . 2]" 1
91 1 19 GLY H 1 20 VAL MG2 3.300 . 4.700 3.803 2.846 4.576 . 0 0 "[ . 1 . 2]" 1
92 1 19 GLY HA2 1 20 VAL H 2.600 . 3.500 2.948 2.282 3.567 0.067 19 0 "[ . 1 . 2]" 1
93 1 19 GLY HA2 1 20 VAL MG2 3.500 . 5.000 4.618 4.043 5.048 0.048 14 0 "[ . 1 . 2]" 1
94 1 19 GLY HA2 1 21 VAL H 3.200 . 4.500 3.949 3.537 4.527 0.027 19 0 "[ . 1 . 2]" 1
95 1 20 VAL H 1 20 VAL HB 2.800 . 3.800 2.507 2.428 2.646 . 0 0 "[ . 1 . 2]" 1
96 1 20 VAL H 1 20 VAL MG1 2.900 . 3.900 3.746 3.733 3.752 . 0 0 "[ . 1 . 2]" 1
97 1 20 VAL H 1 20 VAL MG2 2.500 . 3.300 2.049 1.781 2.180 . 0 0 "[ . 1 . 2]" 1
98 1 20 VAL H 1 22 GLY H 3.200 . 4.500 3.971 3.743 4.190 . 0 0 "[ . 1 . 2]" 1
99 1 20 VAL H 1 42 ALA MB 3.700 . 5.500 5.103 4.962 5.246 . 0 0 "[ . 1 . 2]" 1
100 1 20 VAL HA 1 20 VAL MG1 2.700 . 3.600 2.376 2.342 2.429 . 0 0 "[ . 1 . 2]" 1
101 1 20 VAL HA 1 20 VAL MG2 2.600 . 3.400 2.301 2.241 2.414 . 0 0 "[ . 1 . 2]" 1
102 1 20 VAL HA 1 23 VAL HB 3.300 . 4.700 3.572 3.282 3.845 . 0 0 "[ . 1 . 2]" 1
103 1 20 VAL HA 1 23 VAL MG2 2.700 . 3.600 3.484 3.173 3.650 0.050 6 0 "[ . 1 . 2]" 1
104 1 20 VAL HA 1 42 ALA MB 2.900 . 4.000 2.669 2.485 2.843 . 0 0 "[ . 1 . 2]" 1
105 1 20 VAL HB 1 21 VAL H 2.600 . 3.400 2.407 2.156 2.612 . 0 0 "[ . 1 . 2]" 1
106 1 20 VAL MG1 1 21 VAL H 2.500 . 3.300 3.144 2.721 3.296 . 0 0 "[ . 1 . 2]" 1
107 1 20 VAL MG1 1 42 ALA HA 3.000 . 4.100 2.673 2.289 2.901 . 0 0 "[ . 1 . 2]" 1
108 1 20 VAL MG1 1 42 ALA MB 2.500 . 3.300 2.245 2.043 2.346 . 0 0 "[ . 1 . 2]" 1
109 1 20 VAL MG1 1 45 LYS H 3.600 . 5.200 3.532 3.296 3.841 . 0 0 "[ . 1 . 2]" 1
110 1 20 VAL MG1 1 46 LEU H 2.900 . 3.900 2.826 2.649 3.027 . 0 0 "[ . 1 . 2]" 1
111 1 20 VAL MG1 1 46 LEU HB2 3.100 . 4.300 2.484 2.270 2.862 . 0 0 "[ . 1 . 2]" 1
112 1 20 VAL MG1 1 46 LEU HB3 3.200 . 4.500 3.882 3.693 4.158 . 0 0 "[ . 1 . 2]" 1
113 1 20 VAL MG1 1 46 LEU MD1 3.000 . 4.100 3.040 2.468 3.488 . 0 0 "[ . 1 . 2]" 1
114 1 20 VAL MG2 1 21 VAL H 3.000 . 4.200 3.819 3.583 3.920 . 0 0 "[ . 1 . 2]" 1
115 1 20 VAL MG2 1 42 ALA HA 2.900 . 4.000 3.447 3.080 3.763 . 0 0 "[ . 1 . 2]" 1
116 1 20 VAL MG2 1 42 ALA MB 2.700 . 3.600 3.578 3.299 3.681 0.081 11 0 "[ . 1 . 2]" 1
117 1 20 VAL MG2 1 45 LYS QD 2.700 . 3.600 2.656 2.158 3.633 0.033 14 0 "[ . 1 . 2]" 1
118 1 20 VAL MG2 1 46 LEU H 3.200 . 4.500 4.447 4.200 4.542 0.042 2 0 "[ . 1 . 2]" 1
119 1 20 VAL MG2 1 46 LEU HA 3.700 . 5.400 4.441 4.303 4.609 . 0 0 "[ . 1 . 2]" 1
120 1 21 VAL H 1 21 VAL HB 2.700 . 3.600 3.546 2.560 3.605 0.005 13 0 "[ . 1 . 2]" 1
121 1 21 VAL H 1 21 VAL MG1 2.700 . 3.600 2.012 1.853 2.100 . 0 0 "[ . 1 . 2]" 1
122 1 21 VAL H 1 22 GLY H 2.700 . 3.600 2.477 2.443 2.664 . 0 0 "[ . 1 . 2]" 1
123 1 21 VAL HA 1 21 VAL MG1 2.500 . 3.300 2.433 2.352 3.192 . 0 0 "[ . 1 . 2]" 1
124 1 21 VAL HA 1 21 VAL MG2 2.500 . 3.300 3.147 2.321 3.192 . 0 0 "[ . 1 . 2]" 1
125 1 21 VAL HA 1 24 LEU H 3.300 . 4.700 3.359 3.235 3.489 . 0 0 "[ . 1 . 2]" 1
126 1 21 VAL HA 1 24 LEU HB2 3.200 . 4.500 2.839 2.512 3.078 . 0 0 "[ . 1 . 2]" 1
127 1 21 VAL HA 1 24 LEU HB3 3.500 . 5.000 4.475 4.140 4.714 . 0 0 "[ . 1 . 2]" 1
128 1 21 VAL HA 1 24 LEU MD1 2.900 . 4.000 2.402 2.291 2.863 . 0 0 "[ . 1 . 2]" 1
129 1 21 VAL HA 1 25 GLU H 3.500 . 5.000 3.987 3.614 4.241 . 0 0 "[ . 1 . 2]" 1
130 1 21 VAL HA 1 46 LEU MD1 3.200 . 4.400 3.186 2.664 3.668 . 0 0 "[ . 1 . 2]" 1
131 1 21 VAL HA 1 46 LEU MD2 3.600 . 5.200 5.233 4.671 5.326 0.126 1 0 "[ . 1 . 2]" 1
132 1 21 VAL HB 1 22 GLY H 2.800 . 3.800 3.905 3.861 4.029 0.229 6 0 "[ . 1 . 2]" 1
133 1 21 VAL MG1 1 22 GLY H 3.000 . 4.100 3.693 2.233 3.848 . 0 0 "[ . 1 . 2]" 1
134 1 21 VAL MG1 1 46 LEU MD2 3.100 . 4.300 3.441 3.186 4.446 0.146 6 0 "[ . 1 . 2]" 1
135 1 21 VAL MG2 1 22 GLY H 3.200 . 4.500 2.141 1.873 3.706 0.027 13 0 "[ . 1 . 2]" 1
136 1 21 VAL MG2 1 22 GLY HA2 3.400 . 4.800 3.090 2.913 3.665 . 0 0 "[ . 1 . 2]" 1
137 1 21 VAL MG2 1 25 GLU H 3.400 . 4.900 4.600 3.592 4.799 . 0 0 "[ . 1 . 2]" 1
138 1 21 VAL MG2 1 25 GLU HG2 2.900 . 3.900 3.888 2.577 4.052 0.152 13 0 "[ . 1 . 2]" 1
139 1 21 VAL MG2 1 25 GLU HG3 3.500 . 5.100 3.579 2.740 3.912 . 0 0 "[ . 1 . 2]" 1
140 1 22 GLY H 1 23 VAL H 2.800 . 3.800 2.678 2.563 2.823 . 0 0 "[ . 1 . 2]" 1
141 1 22 GLY H 1 23 VAL HB 3.700 . 5.500 4.807 4.598 5.003 . 0 0 "[ . 1 . 2]" 1
142 1 22 GLY H 1 23 VAL MG2 3.200 . 4.500 4.229 4.052 4.382 . 0 0 "[ . 1 . 2]" 1
143 1 22 GLY H 1 24 LEU HB2 3.700 . 5.500 5.349 5.083 5.515 0.015 17 0 "[ . 1 . 2]" 1
144 1 22 GLY H 1 25 GLU HB2 3.700 . 5.500 5.107 4.856 5.350 . 0 0 "[ . 1 . 2]" 1
145 1 22 GLY H 1 42 ALA MB 3.700 . 5.500 5.551 5.497 5.601 0.101 4 0 "[ . 1 . 2]" 1
146 1 22 GLY HA2 1 25 GLU H 3.400 . 4.900 3.642 3.435 3.786 . 0 0 "[ . 1 . 2]" 1
147 1 22 GLY HA2 1 25 GLU HB2 3.300 . 4.600 2.710 2.534 2.912 . 0 0 "[ . 1 . 2]" 1
148 1 22 GLY HA3 1 23 VAL HB 3.700 . 5.500 5.254 5.115 5.370 . 0 0 "[ . 1 . 2]" 1
149 1 22 GLY HA3 1 25 GLU HB2 3.700 . 5.500 4.326 4.135 4.521 . 0 0 "[ . 1 . 2]" 1
150 1 23 VAL H 1 23 VAL HB 2.500 . 3.300 2.369 2.271 2.484 . 0 0 "[ . 1 . 2]" 1
151 1 23 VAL H 1 23 VAL MG1 3.000 . 4.100 3.724 3.692 3.748 . 0 0 "[ . 1 . 2]" 1
152 1 23 VAL H 1 23 VAL MG2 2.500 . 3.300 2.329 2.081 2.479 . 0 0 "[ . 1 . 2]" 1
153 1 23 VAL H 1 24 LEU H 2.800 . 3.800 2.560 2.455 2.670 . 0 0 "[ . 1 . 2]" 1
154 1 23 VAL H 1 42 ALA MB 3.200 . 4.500 4.209 4.049 4.417 . 0 0 "[ . 1 . 2]" 1
155 1 23 VAL HA 1 23 VAL MG1 2.700 . 3.600 2.418 2.329 2.527 . 0 0 "[ . 1 . 2]" 1
156 1 23 VAL HA 1 23 VAL MG2 2.600 . 3.400 2.302 2.266 2.388 . 0 0 "[ . 1 . 2]" 1
157 1 23 VAL HA 1 25 GLU H 3.700 . 5.500 4.650 4.314 4.848 . 0 0 "[ . 1 . 2]" 1
158 1 23 VAL HA 1 26 SER H 3.300 . 4.700 3.616 3.482 3.733 . 0 0 "[ . 1 . 2]" 1
159 1 23 VAL HA 1 26 SER HB2 3.200 . 4.500 3.576 2.826 4.527 0.027 19 0 "[ . 1 . 2]" 1
160 1 23 VAL HA 1 27 TYR H 3.200 . 4.500 4.477 4.256 4.560 0.060 6 0 "[ . 1 . 2]" 1
161 1 23 VAL HA 1 34 ILE MD 3.100 . 4.300 3.520 2.792 4.355 0.055 1 0 "[ . 1 . 2]" 1
162 1 23 VAL HA 1 34 ILE HG12 3.400 . 4.900 3.955 3.089 4.715 . 0 0 "[ . 1 . 2]" 1
163 1 23 VAL HA 1 34 ILE HG13 3.400 . 4.900 3.329 2.835 4.055 . 0 0 "[ . 1 . 2]" 1
164 1 23 VAL HB 1 24 LEU H 3.000 . 4.100 2.549 2.436 2.680 . 0 0 "[ . 1 . 2]" 1
165 1 23 VAL HB 1 42 ALA MB 3.000 . 4.100 2.696 2.503 2.991 . 0 0 "[ . 1 . 2]" 1
166 1 23 VAL MG1 1 24 LEU H 3.000 . 4.200 3.211 3.008 3.391 . 0 0 "[ . 1 . 2]" 1
167 1 23 VAL MG1 1 24 LEU HA 3.100 . 4.300 3.296 3.147 3.441 . 0 0 "[ . 1 . 2]" 1
168 1 23 VAL MG1 1 24 LEU HG 3.200 . 4.500 3.354 3.159 3.836 . 0 0 "[ . 1 . 2]" 1
169 1 23 VAL MG1 1 34 ILE HB 3.500 . 5.000 3.848 3.442 4.163 . 0 0 "[ . 1 . 2]" 1
170 1 23 VAL MG1 1 34 ILE HG12 3.000 . 4.100 3.313 2.283 3.814 . 0 0 "[ . 1 . 2]" 1
171 1 23 VAL MG1 1 34 ILE MG 2.500 . 3.300 1.967 1.871 2.130 . 0 0 "[ . 1 . 2]" 1
172 1 23 VAL MG1 1 38 SER HB2 3.400 . 4.800 3.569 2.706 4.020 . 0 0 "[ . 1 . 2]" 1
173 1 23 VAL MG1 1 38 SER HB3 3.200 . 4.500 2.809 2.379 4.176 . 0 0 "[ . 1 . 2]" 1
174 1 23 VAL MG1 1 39 ALA H 3.200 . 4.500 4.225 3.776 4.519 0.019 8 0 "[ . 1 . 2]" 1
175 1 23 VAL MG1 1 39 ALA HA 2.700 . 3.600 2.749 2.457 3.176 . 0 0 "[ . 1 . 2]" 1
176 1 23 VAL MG1 1 42 ALA H 3.300 . 4.700 4.428 4.153 4.753 0.053 6 0 "[ . 1 . 2]" 1
177 1 23 VAL MG1 1 42 ALA HA 3.700 . 5.500 5.051 4.831 5.311 . 0 0 "[ . 1 . 2]" 1
178 1 23 VAL MG1 1 42 ALA MB 2.500 . 3.300 2.724 2.548 2.893 . 0 0 "[ . 1 . 2]" 1
179 1 23 VAL MG2 1 24 LEU H 3.000 . 4.100 3.891 3.781 3.970 . 0 0 "[ . 1 . 2]" 1
180 1 23 VAL MG2 1 34 ILE HG12 3.400 . 4.800 4.695 4.131 4.924 0.124 12 0 "[ . 1 . 2]" 1
181 1 23 VAL MG2 1 42 ALA MB 2.700 . 3.600 3.300 2.952 3.633 0.033 8 0 "[ . 1 . 2]" 1
182 1 24 LEU H 1 24 LEU HB3 2.900 . 4.000 3.571 3.535 3.593 . 0 0 "[ . 1 . 2]" 1
183 1 24 LEU H 1 24 LEU MD1 3.200 . 4.500 3.209 3.133 3.398 . 0 0 "[ . 1 . 2]" 1
184 1 24 LEU H 1 24 LEU MD2 3.000 . 4.100 3.739 3.098 4.019 . 0 0 "[ . 1 . 2]" 1
185 1 24 LEU H 1 24 LEU HG 2.600 . 3.400 2.356 1.842 2.728 . 0 0 "[ . 1 . 2]" 1
186 1 24 LEU H 1 25 GLU H 2.800 . 3.800 2.724 2.585 2.851 . 0 0 "[ . 1 . 2]" 1
187 1 24 LEU H 1 42 ALA MB 3.100 . 4.300 3.658 3.506 3.809 . 0 0 "[ . 1 . 2]" 1
188 1 24 LEU HA 1 24 LEU MD1 3.300 . 4.700 3.823 3.775 3.877 . 0 0 "[ . 1 . 2]" 1
189 1 24 LEU HA 1 24 LEU MD2 2.500 . 3.300 2.256 2.198 2.294 . 0 0 "[ . 1 . 2]" 1
190 1 24 LEU HA 1 27 TYR H 3.200 . 4.400 3.222 3.115 3.420 . 0 0 "[ . 1 . 2]" 1
191 1 24 LEU HA 1 105 ILE MD 3.400 . 4.800 3.858 3.416 4.179 . 0 0 "[ . 1 . 2]" 1
192 1 24 LEU HB2 1 24 LEU MD1 2.900 . 3.900 2.230 2.194 2.289 . 0 0 "[ . 1 . 2]" 1
193 1 24 LEU HB2 1 24 LEU MD2 2.500 . 3.300 3.177 3.156 3.205 . 0 0 "[ . 1 . 2]" 1
194 1 24 LEU HB2 1 25 GLU H 2.600 . 3.500 2.542 2.290 2.868 . 0 0 "[ . 1 . 2]" 1
195 1 24 LEU HB2 1 46 LEU MD1 3.700 . 5.400 3.887 3.354 4.208 . 0 0 "[ . 1 . 2]" 1
196 1 24 LEU HB3 1 24 LEU MD1 3.000 . 4.100 2.598 2.482 2.684 . 0 0 "[ . 1 . 2]" 1
197 1 24 LEU HB3 1 24 LEU MD2 2.900 . 4.000 2.223 2.203 2.265 . 0 0 "[ . 1 . 2]" 1
198 1 24 LEU HB3 1 25 GLU H 3.100 . 4.300 3.461 3.203 3.687 . 0 0 "[ . 1 . 2]" 1
199 1 24 LEU HB3 1 109 LEU MD1 3.600 . 5.200 2.896 2.350 3.707 . 0 0 "[ . 1 . 2]" 1
200 1 24 LEU MD1 1 25 GLU H 3.300 . 4.600 4.307 4.099 4.586 . 0 0 "[ . 1 . 2]" 1
201 1 24 LEU MD1 1 42 ALA HA 3.700 . 5.500 4.606 4.017 5.047 . 0 0 "[ . 1 . 2]" 1
202 1 24 LEU MD1 1 42 ALA MB 2.800 . 3.800 2.664 2.142 3.140 . 0 0 "[ . 1 . 2]" 1
203 1 24 LEU MD1 1 43 MET HA 2.800 . 3.800 2.291 2.197 2.494 . 0 0 "[ . 1 . 2]" 1
204 1 24 LEU MD1 1 43 MET HB3 3.000 . 4.100 4.153 4.000 4.270 0.170 17 0 "[ . 1 . 2]" 1
205 1 24 LEU MD1 1 43 MET HG2 3.300 . 4.700 3.336 2.075 3.664 . 0 0 "[ . 1 . 2]" 1
206 1 24 LEU MD1 1 43 MET HG3 3.300 . 4.600 2.247 2.074 3.537 . 0 0 "[ . 1 . 2]" 1
207 1 24 LEU MD1 1 46 LEU H 3.500 . 5.000 4.572 4.261 4.875 . 0 0 "[ . 1 . 2]" 1
208 1 24 LEU MD1 1 46 LEU HB2 3.300 . 4.600 3.122 2.895 3.433 . 0 0 "[ . 1 . 2]" 1
209 1 24 LEU MD1 1 46 LEU HB3 3.100 . 4.300 3.845 3.590 4.215 . 0 0 "[ . 1 . 2]" 1
210 1 24 LEU MD1 1 46 LEU MD1 2.500 . 3.300 1.950 1.884 1.985 . 0 0 "[ . 1 . 2]" 1
211 1 24 LEU MD1 1 46 LEU MD2 3.100 . 4.300 4.112 3.864 4.226 . 0 0 "[ . 1 . 2]" 1
212 1 24 LEU MD2 1 39 ALA HA 2.800 . 3.800 2.729 2.288 3.107 . 0 0 "[ . 1 . 2]" 1
213 1 24 LEU MD2 1 42 ALA MB 2.500 . 3.300 2.850 2.194 3.162 . 0 0 "[ . 1 . 2]" 1
214 1 24 LEU MD2 1 43 MET H 2.700 . 3.600 2.977 2.231 3.283 . 0 0 "[ . 1 . 2]" 1
215 1 24 LEU MD2 1 43 MET HG2 3.000 . 4.100 3.870 2.286 4.218 0.118 14 0 "[ . 1 . 2]" 1
216 1 24 LEU MD2 1 43 MET HG3 3.000 . 4.100 2.628 2.079 3.155 . 0 0 "[ . 1 . 2]" 1
217 1 24 LEU MD2 1 44 SER H 3.700 . 5.500 5.255 4.598 5.534 0.034 16 0 "[ . 1 . 2]" 1
218 1 24 LEU MD2 1 46 LEU MD1 3.400 . 4.800 3.758 3.611 3.889 . 0 0 "[ . 1 . 2]" 1
219 1 24 LEU HG 1 42 ALA HA 3.700 . 5.500 5.388 5.012 5.571 0.071 1 0 "[ . 1 . 2]" 1
220 1 24 LEU HG 1 42 ALA MB 2.700 . 3.600 2.503 2.190 2.835 . 0 0 "[ . 1 . 2]" 1
221 1 24 LEU HG 1 46 LEU MD1 3.500 . 5.000 4.301 4.187 4.386 . 0 0 "[ . 1 . 2]" 1
222 1 25 GLU H 1 25 GLU HB2 2.700 . 3.600 2.436 2.329 2.586 . 0 0 "[ . 1 . 2]" 1
223 1 25 GLU H 1 25 GLU HB3 2.900 . 4.000 3.577 3.561 3.584 . 0 0 "[ . 1 . 2]" 1
224 1 25 GLU H 1 25 GLU HG2 2.700 . 3.600 2.267 2.043 3.341 . 0 0 "[ . 1 . 2]" 1
225 1 25 GLU H 1 26 SER H 2.800 . 3.800 2.718 2.533 2.828 . 0 0 "[ . 1 . 2]" 1
226 1 25 GLU H 1 27 TYR HB3 3.700 . 5.500 5.294 5.182 5.404 . 0 0 "[ . 1 . 2]" 1
227 1 25 GLU H 1 109 LEU MD1 3.700 . 5.500 4.094 3.754 4.601 . 0 0 "[ . 1 . 2]" 1
228 1 25 GLU HA 1 25 GLU HG3 3.000 . 4.100 3.639 2.878 3.712 . 0 0 "[ . 1 . 2]" 1
229 1 25 GLU HA 1 28 ILE H 3.100 . 4.300 3.919 3.765 4.051 . 0 0 "[ . 1 . 2]" 1
230 1 25 GLU HA 1 28 ILE MD 2.600 . 3.500 2.299 2.122 2.670 . 0 0 "[ . 1 . 2]" 1
231 1 25 GLU HA 1 28 ILE QG 2.800 . 3.800 2.284 2.142 2.388 . 0 0 "[ . 1 . 2]" 1
232 1 25 GLU HA 1 29 GLY H 3.600 . 5.200 4.321 3.741 5.216 0.016 2 0 "[ . 1 . 2]" 1
233 1 25 GLU HB2 1 26 SER H 2.800 . 3.800 2.816 2.635 2.954 . 0 0 "[ . 1 . 2]" 1
234 1 25 GLU HB2 1 28 ILE MD 3.700 . 5.500 4.753 4.515 5.115 . 0 0 "[ . 1 . 2]" 1
235 1 25 GLU HB2 1 109 LEU MD1 3.700 . 5.500 5.136 4.703 5.514 0.014 2 0 "[ . 1 . 2]" 1
236 1 25 GLU HB3 1 26 SER H 3.100 . 4.300 3.725 3.590 3.881 . 0 0 "[ . 1 . 2]" 1
237 1 25 GLU HG2 1 109 LEU MD1 3.200 . 4.400 3.336 2.923 3.832 . 0 0 "[ . 1 . 2]" 1
238 1 26 SER H 1 26 SER HB3 2.800 . 3.800 3.126 2.262 3.618 . 0 0 "[ . 1 . 2]" 1
239 1 26 SER H 1 27 TYR H 2.800 . 3.800 2.498 2.438 2.660 . 0 0 "[ . 1 . 2]" 1
240 1 26 SER H 1 28 ILE MD 3.700 . 5.500 5.091 4.868 5.354 . 0 0 "[ . 1 . 2]" 1
241 1 26 SER HA 1 29 GLY H 3.100 . 4.300 3.521 3.426 3.713 . 0 0 "[ . 1 . 2]" 1
242 1 26 SER HA 1 31 ILE MD 3.000 . 4.200 3.035 2.241 4.207 0.007 2 0 "[ . 1 . 2]" 1
243 1 26 SER HA 1 31 ILE HG12 3.200 . 4.400 3.335 2.347 4.412 0.012 16 0 "[ . 1 . 2]" 1
244 1 26 SER HA 1 31 ILE HG13 3.100 . 4.300 3.397 2.646 4.292 . 0 0 "[ . 1 . 2]" 1
245 1 26 SER HB2 1 27 TYR H 2.900 . 4.000 3.232 2.620 4.052 0.052 3 0 "[ . 1 . 2]" 1
246 1 26 SER HB3 1 27 TYR H 3.400 . 4.800 3.603 2.604 4.124 . 0 0 "[ . 1 . 2]" 1
247 1 27 TYR H 1 27 TYR HB2 2.900 . 3.900 2.583 2.495 2.642 . 0 0 "[ . 1 . 2]" 1
248 1 27 TYR H 1 27 TYR HB3 2.700 . 3.600 2.478 2.410 2.568 . 0 0 "[ . 1 . 2]" 1
249 1 27 TYR H 1 27 TYR QD 3.300 . 4.700 4.181 4.177 4.185 . 0 0 "[ . 1 . 2]" 1
250 1 27 TYR H 1 28 ILE H 2.900 . 4.000 2.836 2.741 2.897 . 0 0 "[ . 1 . 2]" 1
251 1 27 TYR H 1 28 ILE QG 3.300 . 4.700 3.762 3.664 3.952 . 0 0 "[ . 1 . 2]" 1
252 1 27 TYR H 1 28 ILE MG 3.700 . 5.400 4.374 4.256 4.639 . 0 0 "[ . 1 . 2]" 1
253 1 27 TYR H 1 34 ILE HG12 3.200 . 4.500 3.879 3.194 4.533 0.033 9 0 "[ . 1 . 2]" 1
254 1 27 TYR H 1 34 ILE HG13 3.500 . 5.000 4.041 3.274 5.014 0.014 5 0 "[ . 1 . 2]" 1
255 1 27 TYR H 1 34 ILE MG 3.700 . 5.500 3.831 3.480 4.671 . 0 0 "[ . 1 . 2]" 1
256 1 27 TYR HA 1 27 TYR QD 2.900 . 4.000 2.390 2.325 2.839 . 0 0 "[ . 1 . 2]" 1
257 1 27 TYR HA 1 34 ILE HB 3.000 . 4.100 2.737 2.346 3.030 . 0 0 "[ . 1 . 2]" 1
258 1 27 TYR HA 1 34 ILE HG13 3.600 . 5.200 4.598 4.104 5.235 0.035 2 0 "[ . 1 . 2]" 1
259 1 27 TYR HA 1 34 ILE MG 3.400 . 4.800 3.915 3.345 4.554 . 0 0 "[ . 1 . 2]" 1
260 1 27 TYR HB2 1 34 ILE MD 3.300 . 4.700 4.565 4.053 4.785 0.085 12 0 "[ . 1 . 2]" 1
261 1 27 TYR HB2 1 34 ILE MG 3.000 . 4.100 2.473 2.144 3.375 . 0 0 "[ . 1 . 2]" 1
262 1 27 TYR HB2 1 39 ALA MB 3.100 . 4.300 3.041 2.776 3.512 . 0 0 "[ . 1 . 2]" 1
263 1 27 TYR HB3 1 28 ILE H 3.000 . 4.100 2.222 2.121 2.336 . 0 0 "[ . 1 . 2]" 1
264 1 27 TYR HB3 1 28 ILE MG 3.100 . 4.300 3.060 2.827 3.267 . 0 0 "[ . 1 . 2]" 1
265 1 27 TYR QD 1 28 ILE MG 3.000 . 4.100 2.525 2.232 2.847 . 0 0 "[ . 1 . 2]" 1
266 1 27 TYR QD 1 34 ILE HB 3.200 . 4.500 2.656 2.388 3.011 . 0 0 "[ . 1 . 2]" 1
267 1 27 TYR QD 1 34 ILE MG 2.900 . 4.000 3.205 2.488 3.688 . 0 0 "[ . 1 . 2]" 1
268 1 27 TYR QD 1 39 ALA MB 3.000 . 4.200 3.261 2.907 3.574 . 0 0 "[ . 1 . 2]" 1
269 1 27 TYR QD 1 102 LYS HA 3.400 . 4.900 4.031 3.533 4.491 . 0 0 "[ . 1 . 2]" 1
270 1 27 TYR QD 1 105 ILE MD 2.900 . 3.900 2.390 2.089 2.985 . 0 0 "[ . 1 . 2]" 1
271 1 27 TYR QE 1 34 ILE MG 3.600 . 5.200 4.601 4.049 4.966 . 0 0 "[ . 1 . 2]" 1
272 1 27 TYR QE 1 36 LYS HA 3.300 . 4.700 3.958 2.622 4.402 . 0 0 "[ . 1 . 2]" 1
273 1 27 TYR QE 1 39 ALA MB 3.300 . 4.700 3.897 3.604 4.181 . 0 0 "[ . 1 . 2]" 1
274 1 27 TYR QE 1 101 LEU HB3 3.500 . 5.000 3.885 3.276 5.014 0.014 9 0 "[ . 1 . 2]" 1
275 1 27 TYR QE 1 101 LEU MD1 3.200 . 4.500 3.116 2.350 3.811 . 0 0 "[ . 1 . 2]" 1
276 1 27 TYR QE 1 101 LEU HG 3.700 . 5.500 5.431 4.656 5.559 0.059 5 0 "[ . 1 . 2]" 1
277 1 27 TYR QE 1 102 LYS H 3.300 . 4.600 4.174 3.626 4.611 0.011 9 0 "[ . 1 . 2]" 1
278 1 27 TYR QE 1 102 LYS HG3 3.500 . 5.000 3.537 2.517 5.008 0.008 2 0 "[ . 1 . 2]" 1
279 1 27 TYR QE 1 105 ILE MD 2.700 . 3.600 2.845 2.355 3.526 . 0 0 "[ . 1 . 2]" 1
280 1 28 ILE H 1 28 ILE HB 2.900 . 3.900 3.604 3.598 3.615 . 0 0 "[ . 1 . 2]" 1
281 1 28 ILE H 1 28 ILE MD 3.200 . 4.400 3.562 3.445 3.787 . 0 0 "[ . 1 . 2]" 1
282 1 28 ILE H 1 28 ILE QG 2.700 . 3.600 1.989 1.925 2.171 . 0 0 "[ . 1 . 2]" 1
283 1 28 ILE H 1 28 ILE MG 2.700 . 3.600 2.120 2.051 2.264 . 0 0 "[ . 1 . 2]" 1
284 1 28 ILE H 1 29 GLY H 2.800 . 3.800 2.645 2.554 2.742 . 0 0 "[ . 1 . 2]" 1
285 1 28 ILE HA 1 28 ILE QG 3.000 . 4.100 3.316 3.296 3.410 . 0 0 "[ . 1 . 2]" 1
286 1 28 ILE HA 1 28 ILE MG 2.700 . 3.600 2.312 2.240 2.364 . 0 0 "[ . 1 . 2]" 1
287 1 28 ILE HA 1 102 LYS QD 3.200 . 4.500 3.173 2.235 4.162 . 0 0 "[ . 1 . 2]" 1
288 1 28 ILE HA 1 102 LYS HE3 3.500 . 5.000 4.044 2.357 5.063 0.063 2 0 "[ . 1 . 2]" 1
289 1 28 ILE HA 1 102 LYS HG2 3.300 . 4.700 3.760 3.210 4.716 0.016 2 0 "[ . 1 . 2]" 1
290 1 28 ILE HB 1 28 ILE MD 2.600 . 3.500 2.306 2.196 2.384 . 0 0 "[ . 1 . 2]" 1
291 1 28 ILE HB 1 29 GLY H 3.000 . 4.100 3.981 3.826 4.167 0.067 2 0 "[ . 1 . 2]" 1
292 1 28 ILE MD 1 28 ILE MG 2.400 . 3.100 2.136 1.914 3.110 0.010 1 0 "[ . 1 . 2]" 1
293 1 28 ILE QG 1 28 ILE MG 2.600 . 3.500 2.257 2.059 2.328 . 0 0 "[ . 1 . 2]" 1
294 1 28 ILE QG 1 29 GLY H 2.900 . 4.000 2.348 2.109 2.782 . 0 0 "[ . 1 . 2]" 1
295 1 28 ILE QG 1 105 ILE MG 3.600 . 5.200 3.816 3.085 4.538 . 0 0 "[ . 1 . 2]" 1
296 1 28 ILE MG 1 29 GLY H 3.100 . 4.300 3.995 3.878 4.177 . 0 0 "[ . 1 . 2]" 1
297 1 28 ILE MG 1 102 LYS HA 2.700 . 3.600 3.019 2.715 3.594 . 0 0 "[ . 1 . 2]" 1
298 1 28 ILE MG 1 102 LYS HB2 3.200 . 4.500 4.190 3.636 4.444 . 0 0 "[ . 1 . 2]" 1
299 1 28 ILE MG 1 102 LYS HB3 3.200 . 4.500 4.538 4.493 4.594 0.094 15 0 "[ . 1 . 2]" 1
300 1 28 ILE MG 1 102 LYS HE2 3.500 . 5.000 4.188 3.048 5.058 0.058 16 0 "[ . 1 . 2]" 1
301 1 28 ILE MG 1 102 LYS HE3 3.400 . 4.800 4.410 3.403 4.879 0.079 2 0 "[ . 1 . 2]" 1
302 1 28 ILE MG 1 105 ILE HB 3.300 . 4.700 2.705 2.309 3.078 . 0 0 "[ . 1 . 2]" 1
303 1 28 ILE MG 1 106 LYS H 3.500 . 5.000 3.959 3.642 4.237 . 0 0 "[ . 1 . 2]" 1
304 1 30 SER H 1 31 ILE H 2.800 . 3.800 2.549 1.777 3.402 0.023 6 0 "[ . 1 . 2]" 1
305 1 30 SER HB2 1 31 ILE H 3.200 . 4.500 4.111 2.429 4.616 0.116 20 0 "[ . 1 . 2]" 1
306 1 30 SER HB3 1 31 ILE H 3.300 . 4.600 4.162 2.530 4.645 0.045 7 0 "[ . 1 . 2]" 1
307 1 31 ILE H 1 31 ILE HG12 2.900 . 3.900 2.445 1.880 3.934 0.034 4 0 "[ . 1 . 2]" 1
308 1 31 ILE H 1 31 ILE HG13 2.800 . 3.800 2.781 2.037 3.319 . 0 0 "[ . 1 . 2]" 1
309 1 31 ILE H 1 31 ILE MG 2.900 . 4.000 3.028 2.073 3.920 . 0 0 "[ . 1 . 2]" 1
310 1 31 ILE H 1 32 ASN H 3.300 . 4.600 3.292 1.957 4.631 0.043 11 0 "[ . 1 . 2]" 1
311 1 31 ILE HA 1 31 ILE MG 2.600 . 3.500 2.273 2.214 2.347 . 0 0 "[ . 1 . 2]" 1
312 1 31 ILE HA 1 32 ASN H 2.600 . 3.500 3.097 2.226 3.554 0.054 13 0 "[ . 1 . 2]" 1
313 1 31 ILE HB 1 31 ILE MD 2.700 . 3.600 2.350 2.245 3.199 . 0 0 "[ . 1 . 2]" 1
314 1 31 ILE HB 1 32 ASN H 2.900 . 3.900 2.677 1.845 3.930 0.055 4 0 "[ . 1 . 2]" 1
315 1 31 ILE MD 1 32 ASN HD21 2.900 . 4.000 3.039 1.941 3.940 . 0 0 "[ . 1 . 2]" 1
316 1 31 ILE MD 1 32 ASN HD22 3.000 . 4.100 2.713 1.895 4.021 0.005 15 0 "[ . 1 . 2]" 1
317 1 31 ILE HG12 1 32 ASN H 3.300 . 4.700 3.949 2.474 4.753 0.053 20 0 "[ . 1 . 2]" 1
318 1 31 ILE HG12 1 32 ASN HD21 3.300 . 4.600 3.972 1.998 4.691 0.091 12 0 "[ . 1 . 2]" 1
319 1 31 ILE HG12 1 32 ASN HD22 3.400 . 4.800 4.473 2.837 4.919 0.119 5 0 "[ . 1 . 2]" 1
320 1 31 ILE HG13 1 31 ILE MG 3.000 . 4.200 3.161 2.588 3.199 . 0 0 "[ . 1 . 2]" 1
321 1 31 ILE MG 1 32 ASN H 3.000 . 4.200 3.570 2.679 4.140 . 0 0 "[ . 1 . 2]" 1
322 1 32 ASN H 1 33 ASN H 3.200 . 4.500 3.964 2.426 4.623 0.123 15 0 "[ . 1 . 2]" 1
323 1 32 ASN HA 1 33 ASN H 2.700 . 3.600 3.108 2.373 3.470 . 0 0 "[ . 1 . 2]" 1
324 1 32 ASN HB2 1 34 ILE MD 3.100 . 4.300 2.983 2.114 3.762 . 0 0 "[ . 1 . 2]" 1
325 1 32 ASN HB3 1 34 ILE MD 3.300 . 4.600 3.223 2.278 4.493 . 0 0 "[ . 1 . 2]" 1
326 1 33 ASN H 1 34 ILE H 3.000 . 4.100 2.830 1.893 3.913 0.007 19 0 "[ . 1 . 2]" 1
327 1 33 ASN HB3 1 33 ASN HD21 2.900 . 3.900 3.017 2.283 3.617 . 0 0 "[ . 1 . 2]" 1
328 1 34 ILE H 1 34 ILE HB 2.700 . 3.600 2.667 2.266 3.609 0.009 9 0 "[ . 1 . 2]" 1
329 1 34 ILE H 1 34 ILE MD 3.100 . 4.300 2.435 1.766 3.725 0.134 19 0 "[ . 1 . 2]" 1
330 1 34 ILE H 1 34 ILE HG12 2.900 . 3.900 2.877 1.898 4.116 0.216 19 0 "[ . 1 . 2]" 1
331 1 34 ILE H 1 34 ILE HG13 3.000 . 4.100 3.794 3.350 4.208 0.108 8 0 "[ . 1 . 2]" 1
332 1 34 ILE H 1 34 ILE MG 3.200 . 4.500 3.769 3.672 4.033 . 0 0 "[ . 1 . 2]" 1
333 1 34 ILE HA 1 34 ILE MD 2.600 . 3.500 2.166 2.075 2.282 . 0 0 "[ . 1 . 2]" 1
334 1 34 ILE HA 1 34 ILE MG 2.700 . 3.600 2.408 2.293 2.545 . 0 0 "[ . 1 . 2]" 1
335 1 34 ILE HA 1 35 THR H 2.400 . 3.100 2.169 2.118 2.377 . 0 0 "[ . 1 . 2]" 1
336 1 34 ILE HB 1 34 ILE MD 3.000 . 4.100 2.903 2.412 3.221 . 0 0 "[ . 1 . 2]" 1
337 1 34 ILE MD 1 34 ILE MG 2.600 . 3.400 2.397 1.809 3.234 . 0 0 "[ . 1 . 2]" 1
338 1 34 ILE MD 1 35 THR H 2.900 . 4.000 3.829 3.223 4.163 0.163 1 0 "[ . 1 . 2]" 1
339 1 34 ILE HG12 1 34 ILE MG 3.000 . 4.100 2.874 2.381 3.202 . 0 0 "[ . 1 . 2]" 1
340 1 34 ILE HG13 1 34 ILE MG 2.900 . 3.900 2.333 2.306 2.578 . 0 0 "[ . 1 . 2]" 1
341 1 34 ILE MG 1 35 THR H 2.700 . 3.600 2.687 1.784 3.338 0.016 12 0 "[ . 1 . 2]" 1
342 1 34 ILE MG 1 38 SER H 3.500 . 5.000 3.895 3.537 4.197 . 0 0 "[ . 1 . 2]" 1
343 1 34 ILE MG 1 38 SER HB2 2.900 . 3.900 2.245 2.034 2.585 . 0 0 "[ . 1 . 2]" 1
344 1 34 ILE MG 1 38 SER HB3 3.100 . 4.300 2.732 2.278 3.451 . 0 0 "[ . 1 . 2]" 1
345 1 34 ILE MG 1 39 ALA H 3.000 . 4.100 3.091 2.789 3.524 . 0 0 "[ . 1 . 2]" 1
346 1 34 ILE MG 1 39 ALA HA 3.300 . 4.700 3.153 2.791 3.640 . 0 0 "[ . 1 . 2]" 1
347 1 34 ILE MG 1 39 ALA MB 2.700 . 3.600 2.516 2.175 2.961 . 0 0 "[ . 1 . 2]" 1
348 1 35 THR H 1 35 THR MG 2.700 . 3.600 2.442 1.987 2.945 . 0 0 "[ . 1 . 2]" 1
349 1 35 THR H 1 38 SER H 3.400 . 4.900 3.842 3.364 4.412 . 0 0 "[ . 1 . 2]" 1
350 1 35 THR H 1 38 SER HB2 2.900 . 3.900 2.698 1.898 3.670 0.002 13 0 "[ . 1 . 2]" 1
351 1 35 THR HA 1 35 THR MG 2.400 . 3.100 2.313 2.259 2.456 . 0 0 "[ . 1 . 2]" 1
352 1 35 THR HB 1 36 LYS HB3 3.300 . 4.600 4.472 4.179 4.684 0.084 16 0 "[ . 1 . 2]" 1
353 1 35 THR MG 1 36 LYS H 3.300 . 4.600 3.699 3.421 3.974 . 0 0 "[ . 1 . 2]" 1
354 1 36 LYS H 1 36 LYS HB2 2.900 . 3.900 2.341 2.239 2.533 . 0 0 "[ . 1 . 2]" 1
355 1 36 LYS H 1 36 LYS HB3 2.900 . 4.000 2.750 2.507 2.849 . 0 0 "[ . 1 . 2]" 1
356 1 36 LYS H 1 36 LYS HG2 3.700 . 5.400 4.540 4.462 4.670 . 0 0 "[ . 1 . 2]" 1
357 1 36 LYS H 1 37 GLN H 3.000 . 4.200 2.872 2.771 2.929 . 0 0 "[ . 1 . 2]" 1
358 1 36 LYS HA 1 36 LYS HG2 2.900 . 4.000 3.111 2.701 3.693 . 0 0 "[ . 1 . 2]" 1
359 1 36 LYS HA 1 39 ALA H 3.200 . 4.500 3.426 3.265 3.550 . 0 0 "[ . 1 . 2]" 1
360 1 36 LYS HA 1 39 ALA MB 2.900 . 3.900 2.575 2.343 2.774 . 0 0 "[ . 1 . 2]" 1
361 1 36 LYS HA 1 101 LEU MD1 3.400 . 4.800 4.136 3.531 4.831 0.031 16 0 "[ . 1 . 2]" 1
362 1 36 LYS HB2 1 36 LYS QD 3.000 . 4.100 2.547 2.239 3.100 . 0 0 "[ . 1 . 2]" 1
363 1 36 LYS HB2 1 36 LYS HE2 3.300 . 4.600 3.694 2.329 4.593 . 0 0 "[ . 1 . 2]" 1
364 1 36 LYS HB2 1 36 LYS HE3 3.300 . 4.700 3.544 2.328 4.710 0.010 11 0 "[ . 1 . 2]" 1
365 1 36 LYS HB2 1 37 GLN H 3.100 . 4.300 3.811 3.629 3.943 . 0 0 "[ . 1 . 2]" 1
366 1 36 LYS HB3 1 37 GLN H 2.800 . 3.800 2.639 2.462 2.804 . 0 0 "[ . 1 . 2]" 1
367 1 36 LYS QD 1 101 LEU MD1 3.300 . 4.700 3.037 2.010 4.715 0.015 8 0 "[ . 1 . 2]" 1
368 1 36 LYS HE2 1 98 ALA MB 3.300 . 4.700 3.737 2.304 4.682 . 0 0 "[ . 1 . 2]" 1
369 1 36 LYS HE2 1 101 LEU MD1 3.100 . 4.300 3.046 2.137 4.307 0.007 8 0 "[ . 1 . 2]" 1
370 1 36 LYS HE3 1 98 ALA HA 3.300 . 4.700 3.753 2.339 4.721 0.021 5 0 "[ . 1 . 2]" 1
371 1 36 LYS HE3 1 98 ALA MB 3.200 . 4.500 3.296 2.227 4.128 . 0 0 "[ . 1 . 2]" 1
372 1 36 LYS HE3 1 101 LEU MD1 3.000 . 4.100 3.333 2.164 4.133 0.033 12 0 "[ . 1 . 2]" 1
373 1 36 LYS HG2 1 101 LEU MD1 3.300 . 4.700 3.589 2.663 4.756 0.056 18 0 "[ . 1 . 2]" 1
374 1 37 GLN H 1 37 GLN HB2 2.700 . 3.600 3.091 2.336 3.598 . 0 0 "[ . 1 . 2]" 1
375 1 37 GLN H 1 37 GLN HB3 2.900 . 4.000 2.545 2.364 2.741 . 0 0 "[ . 1 . 2]" 1
376 1 37 GLN H 1 37 GLN HE22 3.300 . 4.700 4.707 4.645 4.751 0.051 7 0 "[ . 1 . 2]" 1
377 1 37 GLN H 1 37 GLN HG2 3.300 . 4.700 3.229 2.208 4.648 . 0 0 "[ . 1 . 2]" 1
378 1 37 GLN H 1 38 SER H 2.900 . 4.000 2.706 2.642 2.811 . 0 0 "[ . 1 . 2]" 1
379 1 37 GLN HA 1 39 ALA H 3.200 . 4.500 4.093 3.957 4.207 . 0 0 "[ . 1 . 2]" 1
380 1 37 GLN HA 1 40 CYS H 3.200 . 4.500 3.475 3.287 3.607 . 0 0 "[ . 1 . 2]" 1
381 1 37 GLN HA 1 40 CYS HB2 3.100 . 4.300 3.025 2.832 3.294 . 0 0 "[ . 1 . 2]" 1
382 1 37 GLN HB2 1 38 SER H 3.200 . 4.500 3.717 3.646 3.797 . 0 0 "[ . 1 . 2]" 1
383 1 37 GLN HB3 1 38 SER H 2.900 . 3.900 3.240 2.455 3.771 . 0 0 "[ . 1 . 2]" 1
384 1 37 GLN HG2 1 41 VAL MG1 3.500 . 5.000 5.032 4.951 5.083 0.083 8 0 "[ . 1 . 2]" 1
385 1 37 GLN HG3 1 38 SER H 3.300 . 4.700 3.062 2.354 4.063 . 0 0 "[ . 1 . 2]" 1
386 1 37 GLN HG3 1 41 VAL MG1 3.000 . 4.100 3.935 3.740 4.105 0.005 6 0 "[ . 1 . 2]" 1
387 1 38 SER H 1 38 SER HB2 2.700 . 3.600 2.446 2.273 3.543 . 0 0 "[ . 1 . 2]" 1
388 1 38 SER H 1 39 ALA H 2.700 . 3.600 2.598 2.517 2.677 . 0 0 "[ . 1 . 2]" 1
389 1 38 SER H 1 39 ALA MB 3.300 . 4.600 4.283 4.223 4.350 . 0 0 "[ . 1 . 2]" 1
390 1 38 SER H 1 41 VAL MG1 3.700 . 5.400 4.118 4.063 4.703 . 0 0 "[ . 1 . 2]" 1
391 1 38 SER HA 1 41 VAL H 3.100 . 4.300 3.882 3.789 3.951 . 0 0 "[ . 1 . 2]" 1
392 1 38 SER HA 1 41 VAL HB 3.200 . 4.400 4.223 4.030 4.710 0.310 8 0 "[ . 1 . 2]" 1
393 1 38 SER HA 1 41 VAL MG1 2.900 . 4.000 2.138 2.055 3.370 . 0 0 "[ . 1 . 2]" 1
394 1 38 SER HB2 1 39 ALA H 2.900 . 4.000 2.987 2.881 3.666 . 0 0 "[ . 1 . 2]" 1
395 1 38 SER HB2 1 39 ALA MB 3.200 . 4.500 4.161 4.013 4.604 0.104 18 0 "[ . 1 . 2]" 1
396 1 38 SER HB3 1 39 ALA H 3.400 . 4.800 3.833 3.749 4.199 . 0 0 "[ . 1 . 2]" 1
397 1 39 ALA H 1 39 ALA MB 2.400 . 3.100 2.231 2.200 2.258 . 0 0 "[ . 1 . 2]" 1
398 1 39 ALA HA 1 42 ALA H 3.200 . 4.500 3.809 3.616 3.932 . 0 0 "[ . 1 . 2]" 1
399 1 39 ALA HA 1 42 ALA MB 2.800 . 3.800 2.898 2.693 3.063 . 0 0 "[ . 1 . 2]" 1
400 1 39 ALA HA 1 105 ILE MD 3.500 . 5.000 4.694 4.152 5.038 0.038 16 0 "[ . 1 . 2]" 1
401 1 39 ALA MB 1 40 CYS H 2.800 . 3.700 2.485 2.410 2.563 . 0 0 "[ . 1 . 2]" 1
402 1 39 ALA MB 1 40 CYS HA 3.300 . 4.700 3.788 3.745 3.815 . 0 0 "[ . 1 . 2]" 1
403 1 39 ALA MB 1 105 ILE MD 2.600 . 3.400 2.752 2.356 3.173 . 0 0 "[ . 1 . 2]" 1
404 1 40 CYS H 1 40 CYS HB2 2.800 . 3.800 2.479 2.351 2.633 . 0 0 "[ . 1 . 2]" 1
405 1 40 CYS H 1 40 CYS HB3 2.900 . 4.000 3.583 3.569 3.592 . 0 0 "[ . 1 . 2]" 1
406 1 40 CYS H 1 90 ILE MG 3.600 . 5.200 4.959 4.678 5.215 0.015 18 0 "[ . 1 . 2]" 1
407 1 40 CYS HA 1 41 VAL HA 3.500 . 5.100 4.815 4.786 4.825 . 0 0 "[ . 1 . 2]" 1
408 1 40 CYS HA 1 43 MET H 3.000 . 4.200 3.610 3.425 3.804 . 0 0 "[ . 1 . 2]" 1
409 1 40 CYS HA 1 43 MET HB2 3.100 . 4.300 2.983 2.799 3.178 . 0 0 "[ . 1 . 2]" 1
410 1 40 CYS HA 1 43 MET HG2 3.700 . 5.500 5.535 5.425 5.574 0.074 19 0 "[ . 1 . 2]" 1
411 1 40 CYS HA 1 93 LEU HB2 3.500 . 5.000 4.742 4.280 5.028 0.028 18 0 "[ . 1 . 2]" 1
412 1 40 CYS HA 1 93 LEU MD1 3.100 . 4.300 2.537 2.208 2.961 . 0 0 "[ . 1 . 2]" 1
413 1 40 CYS HB2 1 41 VAL H 3.000 . 4.100 2.389 2.342 2.446 . 0 0 "[ . 1 . 2]" 1
414 1 40 CYS HB2 1 90 ILE MG 2.800 . 3.800 2.898 2.513 3.239 . 0 0 "[ . 1 . 2]" 1
415 1 40 CYS HB3 1 41 VAL H 3.100 . 4.300 3.429 3.295 3.587 . 0 0 "[ . 1 . 2]" 1
416 1 40 CYS HB3 1 90 ILE HA 3.400 . 4.900 3.148 2.371 3.974 . 0 0 "[ . 1 . 2]" 1
417 1 40 CYS HB3 1 90 ILE MG 2.900 . 4.000 2.390 2.279 2.766 . 0 0 "[ . 1 . 2]" 1
418 1 40 CYS HB3 1 93 LEU HB2 3.300 . 4.700 3.664 2.848 4.118 . 0 0 "[ . 1 . 2]" 1
419 1 41 VAL H 1 41 VAL HB 2.500 . 3.300 2.607 2.449 3.551 0.251 8 0 "[ . 1 . 2]" 1
420 1 41 VAL H 1 41 VAL MG1 2.600 . 3.500 1.962 1.835 2.183 . 0 0 "[ . 1 . 2]" 1
421 1 41 VAL H 1 41 VAL MG2 3.000 . 4.200 3.668 2.048 3.758 . 0 0 "[ . 1 . 2]" 1
422 1 41 VAL H 1 90 ILE MD 3.400 . 4.800 4.490 3.866 4.806 0.006 3 0 "[ . 1 . 2]" 1
423 1 41 VAL HA 1 41 VAL MG1 2.600 . 3.400 3.156 2.425 3.199 . 0 0 "[ . 1 . 2]" 1
424 1 41 VAL HA 1 41 VAL MG2 2.600 . 3.400 2.374 2.297 3.188 . 0 0 "[ . 1 . 2]" 1
425 1 41 VAL HA 1 44 SER HB2 3.100 . 4.300 3.094 2.737 4.228 . 0 0 "[ . 1 . 2]" 1
426 1 41 VAL HA 1 90 ILE MD 2.900 . 4.000 3.207 2.464 3.785 . 0 0 "[ . 1 . 2]" 1
427 1 41 VAL HA 1 90 ILE HG12 3.200 . 4.400 3.659 2.862 4.301 . 0 0 "[ . 1 . 2]" 1
428 1 41 VAL HB 1 42 ALA H 3.000 . 4.100 3.858 3.622 3.915 . 0 0 "[ . 1 . 2]" 1
429 1 41 VAL MG2 1 42 ALA H 3.000 . 4.100 3.263 1.836 3.491 0.064 8 0 "[ . 1 . 2]" 1
430 1 41 VAL MG2 1 42 ALA HA 3.000 . 4.100 3.397 3.116 3.600 . 0 0 "[ . 1 . 2]" 1
431 1 41 VAL MG2 1 44 SER H 3.700 . 5.500 4.464 4.263 4.853 . 0 0 "[ . 1 . 2]" 1
432 1 41 VAL MG2 1 45 LYS H 3.700 . 5.500 4.438 4.143 5.291 . 0 0 "[ . 1 . 2]" 1
433 1 41 VAL MG2 1 45 LYS QD 2.900 . 4.000 3.359 2.745 4.045 0.045 8 0 "[ . 1 . 2]" 1
434 1 41 VAL MG2 1 45 LYS HE2 3.500 . 5.000 3.940 2.457 5.027 0.027 9 0 "[ . 1 . 2]" 1
435 1 41 VAL MG2 1 45 LYS HE3 3.600 . 5.200 3.796 2.179 5.217 0.017 20 0 "[ . 1 . 2]" 1
436 1 42 ALA H 1 42 ALA MB 2.500 . 3.300 2.203 2.183 2.246 . 0 0 "[ . 1 . 2]" 1
437 1 42 ALA H 1 43 MET H 2.700 . 3.600 2.826 2.693 2.927 . 0 0 "[ . 1 . 2]" 1
438 1 42 ALA H 1 45 LYS H 3.600 . 5.300 5.164 5.045 5.282 . 0 0 "[ . 1 . 2]" 1
439 1 42 ALA HA 1 45 LYS H 3.100 . 4.300 3.561 3.495 3.691 . 0 0 "[ . 1 . 2]" 1
440 1 42 ALA HA 1 45 LYS HB2 3.000 . 4.100 3.451 3.260 3.588 . 0 0 "[ . 1 . 2]" 1
441 1 42 ALA HA 1 45 LYS HB3 3.700 . 5.500 5.130 4.948 5.266 . 0 0 "[ . 1 . 2]" 1
442 1 42 ALA HA 1 45 LYS QD 2.900 . 4.000 2.907 2.623 3.270 . 0 0 "[ . 1 . 2]" 1
443 1 42 ALA MB 1 43 MET H 2.800 . 3.800 2.327 2.257 2.490 . 0 0 "[ . 1 . 2]" 1
444 1 42 ALA MB 1 44 SER H 3.200 . 4.500 4.329 4.261 4.488 . 0 0 "[ . 1 . 2]" 1
445 1 42 ALA MB 1 46 LEU H 3.700 . 5.500 4.876 4.639 5.066 . 0 0 "[ . 1 . 2]" 1
446 1 43 MET H 1 43 MET HB2 2.600 . 3.500 2.138 2.076 2.305 . 0 0 "[ . 1 . 2]" 1
447 1 43 MET H 1 43 MET HB3 2.700 . 3.600 3.186 2.916 3.562 . 0 0 "[ . 1 . 2]" 1
448 1 43 MET H 1 44 SER H 2.800 . 3.800 2.756 2.629 2.820 . 0 0 "[ . 1 . 2]" 1
449 1 43 MET H 1 45 LYS H 3.600 . 5.300 4.456 4.327 4.561 . 0 0 "[ . 1 . 2]" 1
450 1 43 MET H 1 46 LEU MD1 3.300 . 4.700 4.755 4.669 4.861 0.161 17 0 "[ . 1 . 2]" 1
451 1 43 MET HA 1 43 MET ME 3.500 . 5.100 4.209 3.788 4.337 . 0 0 "[ . 1 . 2]" 1
452 1 43 MET HA 1 46 LEU H 3.000 . 4.100 3.212 3.062 3.351 . 0 0 "[ . 1 . 2]" 1
453 1 43 MET HA 1 46 LEU HB2 3.200 . 4.500 2.261 2.225 2.318 . 0 0 "[ . 1 . 2]" 1
454 1 43 MET HA 1 46 LEU HB3 3.200 . 4.500 2.666 2.314 3.251 . 0 0 "[ . 1 . 2]" 1
455 1 43 MET HA 1 46 LEU MD1 3.000 . 4.100 2.628 2.397 2.822 . 0 0 "[ . 1 . 2]" 1
456 1 43 MET HB2 1 44 SER H 2.900 . 4.000 3.410 2.855 3.748 . 0 0 "[ . 1 . 2]" 1
457 1 43 MET HB2 1 44 SER HA 3.700 . 5.400 5.239 4.581 5.508 0.108 14 0 "[ . 1 . 2]" 1
458 1 43 MET HB2 1 46 LEU MD1 3.700 . 5.400 4.566 4.209 5.139 . 0 0 "[ . 1 . 2]" 1
459 1 43 MET HB2 1 93 LEU MD1 3.700 . 5.500 3.798 3.012 4.099 . 0 0 "[ . 1 . 2]" 1
460 1 43 MET HB2 1 93 LEU MD2 3.700 . 5.500 5.121 3.855 5.520 0.020 14 0 "[ . 1 . 2]" 1
461 1 43 MET HB3 1 44 SER H 2.900 . 4.000 3.041 2.861 3.480 . 0 0 "[ . 1 . 2]" 1
462 1 43 MET HB3 1 46 LEU MD1 3.200 . 4.500 4.680 4.560 4.749 0.249 13 0 "[ . 1 . 2]" 1
463 1 43 MET HB3 1 93 LEU MD1 3.500 . 5.000 3.481 2.748 4.311 . 0 0 "[ . 1 . 2]" 1
464 1 43 MET ME 1 43 MET HG2 2.700 . 3.600 2.277 2.185 3.282 . 0 0 "[ . 1 . 2]" 1
465 1 43 MET ME 1 43 MET HG3 2.800 . 3.800 3.216 2.227 3.331 . 0 0 "[ . 1 . 2]" 1
466 1 43 MET ME 1 44 SER H 3.500 . 5.000 4.932 4.654 5.037 0.037 15 0 "[ . 1 . 2]" 1
467 1 43 MET ME 1 44 SER HA 3.700 . 5.500 4.843 4.149 5.477 . 0 0 "[ . 1 . 2]" 1
468 1 43 MET ME 1 47 LEU MD1 3.200 . 4.400 2.964 2.572 3.514 . 0 0 "[ . 1 . 2]" 1
469 1 43 MET ME 1 47 LEU MD2 2.600 . 3.400 2.914 2.148 3.418 0.018 7 0 "[ . 1 . 2]" 1
470 1 43 MET ME 1 78 TYR HB2 3.400 . 4.900 4.650 4.055 4.937 0.037 19 0 "[ . 1 . 2]" 1
471 1 43 MET ME 1 78 TYR HB3 3.600 . 5.200 4.002 3.316 4.346 . 0 0 "[ . 1 . 2]" 1
472 1 43 MET ME 1 78 TYR QD 3.300 . 4.700 3.731 2.714 4.416 . 0 0 "[ . 1 . 2]" 1
473 1 43 MET ME 1 78 TYR QE 3.600 . 5.200 4.202 3.183 5.223 0.023 9 0 "[ . 1 . 2]" 1
474 1 43 MET ME 1 93 LEU MD1 2.800 . 3.800 2.893 2.376 3.745 . 0 0 "[ . 1 . 2]" 1
475 1 43 MET ME 1 93 LEU MD2 2.800 . 3.800 2.568 2.115 3.807 0.007 9 0 "[ . 1 . 2]" 1
476 1 43 MET ME 1 104 THR HB 3.400 . 4.800 4.117 3.365 4.623 . 0 0 "[ . 1 . 2]" 1
477 1 43 MET ME 1 104 THR MG 2.400 . 3.100 2.749 2.210 3.115 0.015 18 0 "[ . 1 . 2]" 1
478 1 43 MET ME 1 105 ILE HA 2.900 . 3.900 3.650 3.186 3.908 0.008 14 0 "[ . 1 . 2]" 1
479 1 43 MET ME 1 108 THR H 3.700 . 5.400 5.306 4.922 5.408 0.008 15 0 "[ . 1 . 2]" 1
480 1 43 MET ME 1 108 THR HA 3.700 . 5.500 5.332 4.778 5.527 0.027 15 0 "[ . 1 . 2]" 1
481 1 43 MET ME 1 108 THR HB 3.000 . 4.100 4.008 3.494 4.127 0.027 18 0 "[ . 1 . 2]" 1
482 1 43 MET ME 1 108 THR MG 2.800 . 3.800 2.927 2.198 3.182 . 0 0 "[ . 1 . 2]" 1
483 1 43 MET HG2 1 46 LEU HB3 3.500 . 5.000 3.385 3.130 4.134 . 0 0 "[ . 1 . 2]" 1
484 1 43 MET HG2 1 46 LEU MD1 3.000 . 4.200 3.094 2.662 3.387 . 0 0 "[ . 1 . 2]" 1
485 1 43 MET HG3 1 46 LEU HB3 3.500 . 5.000 4.052 3.768 4.924 . 0 0 "[ . 1 . 2]" 1
486 1 43 MET HG3 1 46 LEU MD1 3.000 . 4.200 2.915 2.528 4.124 . 0 0 "[ . 1 . 2]" 1
487 1 43 MET HG3 1 46 LEU MD2 3.400 . 4.900 4.947 4.893 5.035 0.135 9 0 "[ . 1 . 2]" 1
488 1 44 SER H 1 44 SER HB2 2.700 . 3.600 2.496 2.286 3.540 . 0 0 "[ . 1 . 2]" 1
489 1 44 SER H 1 44 SER HB3 2.800 . 3.700 2.931 2.261 3.588 . 0 0 "[ . 1 . 2]" 1
490 1 44 SER H 1 45 LYS H 2.800 . 3.800 2.798 2.718 2.900 . 0 0 "[ . 1 . 2]" 1
491 1 44 SER H 1 47 LEU MD1 3.200 . 4.500 4.433 3.988 4.567 0.067 17 0 "[ . 1 . 2]" 1
492 1 44 SER HA 1 47 LEU H 3.100 . 4.300 3.663 3.528 3.791 . 0 0 "[ . 1 . 2]" 1
493 1 44 SER HA 1 47 LEU HB2 3.700 . 5.500 3.659 3.333 3.998 . 0 0 "[ . 1 . 2]" 1
494 1 44 SER HA 1 47 LEU MD1 3.100 . 4.300 2.401 2.235 2.771 . 0 0 "[ . 1 . 2]" 1
495 1 44 SER HB2 1 45 LYS H 3.200 . 4.500 3.453 2.470 3.884 . 0 0 "[ . 1 . 2]" 1
496 1 44 SER HB2 1 90 ILE MD 3.000 . 4.200 3.877 2.945 4.231 0.031 7 0 "[ . 1 . 2]" 1
497 1 44 SER HB2 1 90 ILE HG12 3.700 . 5.400 4.240 3.264 5.421 0.021 16 0 "[ . 1 . 2]" 1
498 1 44 SER HB3 1 45 LYS H 3.200 . 4.500 2.929 2.430 3.908 . 0 0 "[ . 1 . 2]" 1
499 1 45 LYS H 1 45 LYS HB2 2.700 . 3.600 2.418 2.299 2.529 . 0 0 "[ . 1 . 2]" 1
500 1 45 LYS H 1 45 LYS HB3 2.800 . 3.800 3.600 3.571 3.620 . 0 0 "[ . 1 . 2]" 1
501 1 45 LYS H 1 45 LYS QD 2.600 . 3.500 3.333 1.962 3.523 0.023 6 0 "[ . 1 . 2]" 1
502 1 45 LYS H 1 45 LYS HG3 3.000 . 4.100 2.465 2.121 3.779 . 0 0 "[ . 1 . 2]" 1
503 1 45 LYS H 1 46 LEU H 2.800 . 3.800 2.369 2.297 2.425 . 0 0 "[ . 1 . 2]" 1
504 1 45 LYS H 1 46 LEU HB3 3.400 . 4.900 4.926 4.816 5.112 0.212 6 0 "[ . 1 . 2]" 1
505 1 45 LYS HA 1 45 LYS QD 3.000 . 4.100 3.917 2.619 4.151 0.051 20 0 "[ . 1 . 2]" 1
506 1 45 LYS HA 1 45 LYS HG2 2.800 . 3.800 2.712 2.580 3.612 . 0 0 "[ . 1 . 2]" 1
507 1 45 LYS HA 1 45 LYS HG3 2.800 . 3.800 2.751 2.327 2.926 . 0 0 "[ . 1 . 2]" 1
508 1 45 LYS HA 1 47 LEU H 3.200 . 4.500 4.467 4.158 4.625 0.125 5 0 "[ . 1 . 2]" 1
509 1 45 LYS HA 1 48 THR HB 3.100 . 4.300 3.560 3.015 4.383 0.083 10 0 "[ . 1 . 2]" 1
510 1 45 LYS HA 1 48 THR MG 3.500 . 5.100 4.167 2.517 4.674 . 0 0 "[ . 1 . 2]" 1
511 1 45 LYS HB2 1 45 LYS QD 2.800 . 3.800 2.311 2.263 2.343 . 0 0 "[ . 1 . 2]" 1
512 1 45 LYS HB2 1 46 LEU H 2.800 . 3.800 3.014 2.888 3.087 . 0 0 "[ . 1 . 2]" 1
513 1 45 LYS HB3 1 46 LEU H 3.000 . 4.100 3.924 3.818 4.003 . 0 0 "[ . 1 . 2]" 1
514 1 45 LYS QD 1 46 LEU H 3.500 . 5.000 4.742 3.906 4.935 . 0 0 "[ . 1 . 2]" 1
515 1 45 LYS HG3 1 46 LEU H 3.700 . 5.500 4.414 4.143 5.108 . 0 0 "[ . 1 . 2]" 1
516 1 46 LEU H 1 46 LEU HB3 2.700 . 3.600 2.766 2.624 3.024 . 0 0 "[ . 1 . 2]" 1
517 1 46 LEU H 1 46 LEU MD1 3.200 . 4.500 4.125 3.956 4.172 . 0 0 "[ . 1 . 2]" 1
518 1 46 LEU H 1 46 LEU MD2 3.300 . 4.700 4.187 4.144 4.262 . 0 0 "[ . 1 . 2]" 1
519 1 46 LEU H 1 46 LEU HG 3.000 . 4.200 4.166 3.812 4.320 0.120 9 0 "[ . 1 . 2]" 1
520 1 46 LEU H 1 47 LEU H 2.800 . 3.800 2.632 2.587 2.689 . 0 0 "[ . 1 . 2]" 1
521 1 46 LEU HA 1 46 LEU MD1 3.400 . 4.900 3.730 3.576 3.792 . 0 0 "[ . 1 . 2]" 1
522 1 46 LEU HA 1 46 LEU MD2 2.500 . 3.300 2.525 2.267 3.073 . 0 0 "[ . 1 . 2]" 1
523 1 46 LEU HA 1 49 GLU H 3.100 . 4.300 3.823 3.477 4.087 . 0 0 "[ . 1 . 2]" 1
524 1 46 LEU HB2 1 46 LEU MD1 3.100 . 4.300 2.300 2.235 2.367 . 0 0 "[ . 1 . 2]" 1
525 1 46 LEU HB2 1 47 LEU H 3.200 . 4.400 3.499 3.317 3.630 . 0 0 "[ . 1 . 2]" 1
526 1 46 LEU HB2 1 108 THR MG 3.400 . 4.900 4.836 4.566 4.957 0.057 2 0 "[ . 1 . 2]" 1
527 1 46 LEU HB3 1 46 LEU MD1 2.700 . 3.600 2.384 2.313 2.557 . 0 0 "[ . 1 . 2]" 1
528 1 46 LEU HB3 1 47 LEU H 3.100 . 4.300 2.447 2.361 2.728 . 0 0 "[ . 1 . 2]" 1
529 1 46 LEU MD1 1 47 LEU H 3.300 . 4.700 4.424 4.284 4.662 . 0 0 "[ . 1 . 2]" 1
530 1 46 LEU MD1 1 108 THR MG 2.600 . 3.400 2.526 2.205 3.040 . 0 0 "[ . 1 . 2]" 1
531 1 46 LEU MD1 1 109 LEU HA 3.200 . 4.500 3.941 3.449 4.471 . 0 0 "[ . 1 . 2]" 1
532 1 46 LEU MD2 1 47 LEU H 3.400 . 4.800 3.506 3.268 4.035 . 0 0 "[ . 1 . 2]" 1
533 1 46 LEU MD2 1 49 GLU H 3.400 . 4.800 3.892 3.445 4.427 . 0 0 "[ . 1 . 2]" 1
534 1 46 LEU MD2 1 50 LEU MD1 3.200 . 4.500 2.235 1.913 3.733 . 0 0 "[ . 1 . 2]" 1
535 1 46 LEU MD2 1 50 LEU MD2 3.300 . 4.600 3.107 2.191 3.492 . 0 0 "[ . 1 . 2]" 1
536 1 47 LEU H 1 47 LEU HB2 2.800 . 3.800 2.596 2.541 2.705 . 0 0 "[ . 1 . 2]" 1
537 1 47 LEU H 1 47 LEU HB3 3.000 . 4.100 3.595 3.585 3.602 . 0 0 "[ . 1 . 2]" 1
538 1 47 LEU H 1 47 LEU MD1 3.100 . 4.300 3.307 3.189 3.459 . 0 0 "[ . 1 . 2]" 1
539 1 47 LEU H 1 47 LEU MD2 3.000 . 4.100 3.284 2.893 3.478 . 0 0 "[ . 1 . 2]" 1
540 1 47 LEU H 1 47 LEU HG 2.700 . 3.600 1.921 1.777 2.024 0.023 6 0 "[ . 1 . 2]" 1
541 1 47 LEU H 1 48 THR H 2.900 . 3.900 2.744 2.607 2.853 . 0 0 "[ . 1 . 2]" 1
542 1 47 LEU H 1 108 THR MG 3.500 . 5.000 4.964 4.599 5.075 0.075 19 0 "[ . 1 . 2]" 1
543 1 47 LEU HA 1 47 LEU MD1 3.300 . 4.700 3.871 3.827 3.899 . 0 0 "[ . 1 . 2]" 1
544 1 47 LEU HA 1 47 LEU MD2 2.700 . 3.600 2.216 2.154 2.249 . 0 0 "[ . 1 . 2]" 1
545 1 47 LEU HA 1 49 GLU H 3.400 . 4.900 3.814 3.587 4.419 . 0 0 "[ . 1 . 2]" 1
546 1 47 LEU HA 1 50 LEU H 3.100 . 4.300 3.208 2.927 3.578 . 0 0 "[ . 1 . 2]" 1
547 1 47 LEU HA 1 50 LEU HB2 3.300 . 4.700 2.916 2.311 3.432 . 0 0 "[ . 1 . 2]" 1
548 1 47 LEU HA 1 50 LEU MD1 2.900 . 4.000 3.448 2.825 4.130 0.130 16 0 "[ . 1 . 2]" 1
549 1 47 LEU HB2 1 48 THR H 2.900 . 4.000 2.714 2.454 3.209 . 0 0 "[ . 1 . 2]" 1
550 1 47 LEU HB2 1 82 ASN HD22 3.300 . 4.600 3.321 2.755 4.336 . 0 0 "[ . 1 . 2]" 1
551 1 47 LEU HB3 1 47 LEU MD1 3.000 . 4.200 2.485 2.361 2.576 . 0 0 "[ . 1 . 2]" 1
552 1 47 LEU HB3 1 48 THR H 3.000 . 4.100 3.800 3.541 4.111 0.011 16 0 "[ . 1 . 2]" 1
553 1 47 LEU HB3 1 79 ILE HA 3.200 . 4.500 3.336 2.603 3.880 . 0 0 "[ . 1 . 2]" 1
554 1 47 LEU HB3 1 82 ASN HD21 3.100 . 4.300 2.913 1.869 3.846 0.031 11 0 "[ . 1 . 2]" 1
555 1 47 LEU HB3 1 82 ASN HD22 3.000 . 4.200 3.863 3.102 4.210 0.010 2 0 "[ . 1 . 2]" 1
556 1 47 LEU MD1 1 78 TYR HA 3.300 . 4.700 4.518 3.686 4.709 0.009 2 0 "[ . 1 . 2]" 1
557 1 47 LEU MD1 1 78 TYR HB3 2.900 . 4.000 2.949 2.345 3.246 . 0 0 "[ . 1 . 2]" 1
558 1 47 LEU MD1 1 79 ILE MG 3.200 . 4.500 4.361 3.906 4.525 0.025 9 0 "[ . 1 . 2]" 1
559 1 47 LEU MD1 1 82 ASN H 3.200 . 4.500 4.299 3.644 4.537 0.037 14 0 "[ . 1 . 2]" 1
560 1 47 LEU MD1 1 82 ASN HB3 3.200 . 4.500 3.103 2.265 3.508 . 0 0 "[ . 1 . 2]" 1
561 1 47 LEU MD1 1 89 THR MG 2.900 . 3.900 2.544 1.993 3.098 . 0 0 "[ . 1 . 2]" 1
562 1 47 LEU MD2 1 48 THR H 3.300 . 4.700 4.720 4.574 4.836 0.136 13 0 "[ . 1 . 2]" 1
563 1 47 LEU MD2 1 78 TYR HB2 3.100 . 4.300 3.607 3.064 4.188 . 0 0 "[ . 1 . 2]" 1
564 1 47 LEU MD2 1 78 TYR HB3 3.300 . 4.600 3.175 2.514 3.666 . 0 0 "[ . 1 . 2]" 1
565 1 47 LEU MD2 1 79 ILE HA 3.100 . 4.300 3.322 2.809 4.065 . 0 0 "[ . 1 . 2]" 1
566 1 47 LEU MD2 1 79 ILE HG12 2.900 . 3.900 2.367 2.276 2.998 . 0 0 "[ . 1 . 2]" 1
567 1 48 THR H 1 48 THR HB 2.600 . 3.500 2.699 2.313 3.590 0.090 10 0 "[ . 1 . 2]" 1
568 1 48 THR H 1 48 THR MG 3.100 . 4.300 3.519 1.916 3.759 . 0 0 "[ . 1 . 2]" 1
569 1 48 THR HA 1 48 THR MG 2.600 . 3.400 2.389 2.252 3.198 . 0 0 "[ . 1 . 2]" 1
570 1 48 THR HB 1 49 GLU H 3.000 . 4.100 2.967 2.347 3.955 . 0 0 "[ . 1 . 2]" 1
571 1 48 THR MG 1 49 GLU H 3.000 . 4.100 3.545 1.894 3.993 0.006 7 0 "[ . 1 . 2]" 1
572 1 48 THR MG 1 49 GLU HA 3.700 . 5.500 3.763 3.182 5.477 . 0 0 "[ . 1 . 2]" 1
573 1 48 THR MG 1 49 GLU HG2 3.500 . 5.000 3.944 2.067 5.033 0.033 10 0 "[ . 1 . 2]" 1
574 1 48 THR MG 1 49 GLU HG3 3.400 . 4.900 4.240 3.436 4.941 0.041 14 0 "[ . 1 . 2]" 1
575 1 49 GLU H 1 49 GLU HB2 3.000 . 4.100 2.480 2.335 2.710 . 0 0 "[ . 1 . 2]" 1
576 1 49 GLU H 1 49 GLU HB3 2.700 . 3.600 3.609 3.581 3.626 0.026 4 0 "[ . 1 . 2]" 1
577 1 49 GLU H 1 49 GLU HG2 2.800 . 3.800 3.088 2.081 3.669 . 0 0 "[ . 1 . 2]" 1
578 1 49 GLU H 1 49 GLU HG3 3.100 . 4.300 2.651 1.965 3.753 . 0 0 "[ . 1 . 2]" 1
579 1 49 GLU H 1 50 LEU H 2.500 . 3.300 2.569 2.370 2.831 . 0 0 "[ . 1 . 2]" 1
580 1 49 GLU H 1 50 LEU MD2 3.700 . 5.500 4.578 2.835 5.499 . 0 0 "[ . 1 . 2]" 1
581 1 49 GLU HA 1 49 GLU HG3 2.900 . 3.900 3.272 2.915 3.752 . 0 0 "[ . 1 . 2]" 1
582 1 49 GLU HB2 1 50 LEU H 3.300 . 4.600 2.341 2.061 3.257 . 0 0 "[ . 1 . 2]" 1
583 1 49 GLU HB3 1 50 LEU H 3.000 . 4.100 3.429 3.163 4.116 0.016 16 0 "[ . 1 . 2]" 1
584 1 49 GLU HG3 1 50 LEU H 3.600 . 5.200 4.245 3.672 4.816 . 0 0 "[ . 1 . 2]" 1
585 1 50 LEU H 1 50 LEU HB2 2.500 . 3.300 2.682 2.307 2.757 . 0 0 "[ . 1 . 2]" 1
586 1 50 LEU H 1 50 LEU HB3 2.800 . 3.800 3.590 3.571 3.616 . 0 0 "[ . 1 . 2]" 1
587 1 50 LEU H 1 50 LEU MD2 3.000 . 4.100 2.733 1.938 3.258 . 0 0 "[ . 1 . 2]" 1
588 1 50 LEU H 1 50 LEU HG 2.800 . 3.800 1.930 1.800 3.740 0.000 5 0 "[ . 1 . 2]" 1
589 1 50 LEU H 1 51 ASN HA 3.700 . 5.400 5.351 5.204 5.436 0.036 19 0 "[ . 1 . 2]" 1
590 1 50 LEU HA 1 50 LEU MD1 3.000 . 4.100 3.754 2.230 3.904 . 0 0 "[ . 1 . 2]" 1
591 1 50 LEU HA 1 50 LEU MD2 2.600 . 3.400 2.174 2.134 2.255 . 0 0 "[ . 1 . 2]" 1
592 1 50 LEU HA 1 51 ASN H 2.400 . 3.100 2.260 2.142 2.666 . 0 0 "[ . 1 . 2]" 1
593 1 50 LEU HB2 1 50 LEU MD1 2.700 . 3.600 2.410 2.219 3.193 . 0 0 "[ . 1 . 2]" 1
594 1 50 LEU HB2 1 51 ASN H 3.400 . 4.900 3.990 2.851 4.329 . 0 0 "[ . 1 . 2]" 1
595 1 50 LEU HB3 1 50 LEU MD1 2.800 . 3.800 2.348 2.209 2.549 . 0 0 "[ . 1 . 2]" 1
596 1 50 LEU HB3 1 51 ASN H 3.000 . 4.200 3.350 2.093 3.861 . 0 0 "[ . 1 . 2]" 1
597 1 50 LEU MD1 1 51 ASN H 3.700 . 5.400 5.012 2.971 5.430 0.030 19 0 "[ . 1 . 2]" 1
598 1 50 LEU MD1 1 111 ILE HB 3.000 . 4.200 2.711 2.268 3.574 . 0 0 "[ . 1 . 2]" 1
599 1 50 LEU MD1 1 112 HIS HA 3.400 . 4.800 3.801 3.214 4.564 . 0 0 "[ . 1 . 2]" 1
600 1 50 LEU MD1 1 112 HIS HB3 3.200 . 4.500 4.208 3.857 4.560 0.060 2 0 "[ . 1 . 2]" 1
601 1 50 LEU MD2 1 51 ASN H 3.000 . 4.100 3.892 3.619 4.185 0.085 16 0 "[ . 1 . 2]" 1
602 1 50 LEU MD2 1 112 HIS H 3.100 . 4.300 3.985 3.570 4.341 0.041 2 0 "[ . 1 . 2]" 1
603 1 50 LEU MD2 1 112 HIS HA 2.600 . 3.400 2.906 2.442 3.488 0.088 16 0 "[ . 1 . 2]" 1
604 1 50 LEU MD2 1 112 HIS HB2 3.500 . 5.000 3.024 2.342 5.084 0.084 19 0 "[ . 1 . 2]" 1
605 1 50 LEU MD2 1 112 HIS HB3 3.100 . 4.300 4.241 3.902 4.337 0.037 15 0 "[ . 1 . 2]" 1
606 1 50 LEU MD2 1 112 HIS HD2 3.200 . 4.400 2.927 2.317 4.428 0.028 20 0 "[ . 1 . 2]" 1
607 1 50 LEU HG 1 51 ASN H 3.700 . 5.400 5.122 4.649 5.310 . 0 0 "[ . 1 . 2]" 1
608 1 51 ASN H 1 51 ASN HB2 2.800 . 3.800 2.579 2.351 2.857 . 0 0 "[ . 1 . 2]" 1
609 1 51 ASN H 1 51 ASN HB3 2.800 . 3.800 3.586 2.635 3.894 0.094 8 0 "[ . 1 . 2]" 1
610 1 51 ASN H 1 55 ILE MD 3.700 . 5.500 4.075 3.113 4.557 . 0 0 "[ . 1 . 2]" 1
611 1 51 ASN HA 1 79 ILE MG 3.500 . 5.000 2.962 2.766 3.612 . 0 0 "[ . 1 . 2]" 1
612 1 51 ASN HB2 1 53 ASP H 3.400 . 4.800 4.015 3.568 4.841 0.041 17 0 "[ . 1 . 2]" 1
613 1 51 ASN HB2 1 54 ASP H 3.100 . 4.300 2.899 2.457 4.214 . 0 0 "[ . 1 . 2]" 1
614 1 51 ASN HB3 1 54 ASP H 3.000 . 4.100 3.244 2.481 3.590 . 0 0 "[ . 1 . 2]" 1
615 1 52 SER H 1 53 ASP H 3.300 . 4.700 2.812 2.773 2.846 . 0 0 "[ . 1 . 2]" 1
616 1 52 SER HA 1 54 ASP H 3.200 . 4.500 4.059 3.973 4.135 . 0 0 "[ . 1 . 2]" 1
617 1 52 SER HA 1 55 ILE H 3.200 . 4.500 3.408 3.287 3.597 . 0 0 "[ . 1 . 2]" 1
618 1 52 SER HA 1 55 ILE MD 3.000 . 4.100 3.825 2.870 4.162 0.062 6 0 "[ . 1 . 2]" 1
619 1 52 SER HA 1 55 ILE MG 3.700 . 5.400 4.609 4.506 4.748 . 0 0 "[ . 1 . 2]" 1
620 1 52 SER HA 1 76 ILE MD 3.700 . 5.500 4.985 4.638 5.299 . 0 0 "[ . 1 . 2]" 1
621 1 52 SER HA 1 76 ILE MG 3.700 . 5.500 3.747 3.350 4.049 . 0 0 "[ . 1 . 2]" 1
622 1 52 SER HA 1 79 ILE MD 2.800 . 3.800 2.085 2.057 2.212 . 0 0 "[ . 1 . 2]" 1
623 1 52 SER HA 1 79 ILE MG 3.300 . 4.700 2.835 2.464 3.327 . 0 0 "[ . 1 . 2]" 1
624 1 52 SER HB2 1 53 ASP H 3.400 . 4.800 3.423 2.446 3.945 . 0 0 "[ . 1 . 2]" 1
625 1 52 SER HB2 1 76 ILE MD 3.700 . 5.500 4.639 3.993 5.501 0.001 3 0 "[ . 1 . 2]" 1
626 1 52 SER HB2 1 76 ILE MG 3.100 . 4.300 2.767 2.302 3.796 . 0 0 "[ . 1 . 2]" 1
627 1 52 SER HB2 1 79 ILE MD 3.100 . 4.300 3.644 2.687 4.198 . 0 0 "[ . 1 . 2]" 1
628 1 52 SER HB2 1 79 ILE MG 3.500 . 5.000 3.325 2.144 3.744 . 0 0 "[ . 1 . 2]" 1
629 1 52 SER HB3 1 53 ASP H 3.400 . 4.800 3.566 2.458 4.030 . 0 0 "[ . 1 . 2]" 1
630 1 52 SER HB3 1 76 ILE HG12 3.700 . 5.500 4.728 3.367 5.510 0.010 1 0 "[ . 1 . 2]" 1
631 1 52 SER HB3 1 76 ILE MG 3.100 . 4.300 3.288 2.296 4.205 . 0 0 "[ . 1 . 2]" 1
632 1 52 SER HB3 1 79 ILE MD 3.100 . 4.300 3.319 2.491 4.290 . 0 0 "[ . 1 . 2]" 1
633 1 53 ASP H 1 53 ASP HB2 2.800 . 3.800 3.164 2.581 3.587 . 0 0 "[ . 1 . 2]" 1
634 1 53 ASP H 1 53 ASP HB3 2.800 . 3.800 2.558 2.409 3.552 . 0 0 "[ . 1 . 2]" 1
635 1 53 ASP H 1 54 ASP H 2.800 . 3.800 2.720 2.628 2.764 . 0 0 "[ . 1 . 2]" 1
636 1 53 ASP HA 1 56 LYS H 3.200 . 4.500 3.336 3.157 3.558 . 0 0 "[ . 1 . 2]" 1
637 1 53 ASP HA 1 56 LYS HB2 2.900 . 3.900 2.777 2.529 3.276 . 0 0 "[ . 1 . 2]" 1
638 1 53 ASP HA 1 56 LYS HD2 3.000 . 4.100 2.403 2.345 2.777 . 0 0 "[ . 1 . 2]" 1
639 1 53 ASP HA 1 56 LYS HD3 3.300 . 4.700 4.070 3.953 4.342 . 0 0 "[ . 1 . 2]" 1
640 1 53 ASP HB2 1 54 ASP H 3.300 . 4.700 3.872 2.869 4.103 . 0 0 "[ . 1 . 2]" 1
641 1 53 ASP HB2 1 56 LYS HB2 3.300 . 4.700 4.515 4.110 4.871 0.171 10 0 "[ . 1 . 2]" 1
642 1 53 ASP HB3 1 54 ASP H 2.900 . 4.000 3.594 2.827 4.092 0.092 18 0 "[ . 1 . 2]" 1
643 1 54 ASP H 1 54 ASP HB2 2.700 . 3.600 2.379 2.355 2.416 . 0 0 "[ . 1 . 2]" 1
644 1 54 ASP H 1 55 ILE H 2.700 . 3.600 2.655 2.606 2.733 . 0 0 "[ . 1 . 2]" 1
645 1 54 ASP H 1 55 ILE HB 3.700 . 5.500 4.988 4.694 5.134 . 0 0 "[ . 1 . 2]" 1
646 1 54 ASP H 1 55 ILE MD 3.300 . 4.600 4.078 3.357 4.378 . 0 0 "[ . 1 . 2]" 1
647 1 54 ASP H 1 56 LYS HB2 3.700 . 5.500 5.091 4.946 5.497 . 0 0 "[ . 1 . 2]" 1
648 1 54 ASP H 1 57 LYS QB 3.700 . 5.500 5.430 5.097 5.574 0.074 20 0 "[ . 1 . 2]" 1
649 1 54 ASP HA 1 55 ILE MD 3.600 . 5.200 4.423 4.106 4.597 . 0 0 "[ . 1 . 2]" 1
650 1 54 ASP HA 1 57 LYS H 3.100 . 4.300 3.746 3.653 3.797 . 0 0 "[ . 1 . 2]" 1
651 1 54 ASP HA 1 57 LYS QB 3.000 . 4.100 3.237 2.849 3.352 . 0 0 "[ . 1 . 2]" 1
652 1 54 ASP HA 1 57 LYS QD 3.000 . 4.200 3.621 2.390 4.253 0.053 13 0 "[ . 1 . 2]" 1
653 1 54 ASP HA 1 58 LEU MD1 3.700 . 5.500 4.856 4.068 5.192 . 0 0 "[ . 1 . 2]" 1
654 1 54 ASP HB2 1 55 ILE H 3.100 . 4.300 3.803 3.774 3.859 . 0 0 "[ . 1 . 2]" 1
655 1 54 ASP HB2 1 55 ILE MD 3.400 . 4.800 4.033 3.600 4.206 . 0 0 "[ . 1 . 2]" 1
656 1 54 ASP HB3 1 55 ILE H 3.000 . 4.100 2.667 2.554 2.779 . 0 0 "[ . 1 . 2]" 1
657 1 54 ASP HB3 1 55 ILE HB 3.700 . 5.500 5.034 4.670 5.202 . 0 0 "[ . 1 . 2]" 1
658 1 54 ASP HB3 1 55 ILE MD 3.100 . 4.300 2.491 2.201 2.622 . 0 0 "[ . 1 . 2]" 1
659 1 54 ASP HB3 1 57 LYS QB 3.700 . 5.500 5.450 5.179 5.528 0.028 6 0 "[ . 1 . 2]" 1
660 1 55 ILE H 1 55 ILE HB 2.500 . 3.300 2.586 2.290 2.711 . 0 0 "[ . 1 . 2]" 1
661 1 55 ILE H 1 55 ILE MD 2.700 . 3.600 2.373 1.746 2.737 0.054 16 0 "[ . 1 . 2]" 1
662 1 55 ILE H 1 55 ILE HG12 2.800 . 3.800 2.351 1.850 3.697 . 0 0 "[ . 1 . 2]" 1
663 1 55 ILE H 1 55 ILE HG13 3.100 . 4.300 3.560 3.430 3.842 . 0 0 "[ . 1 . 2]" 1
664 1 55 ILE H 1 55 ILE MG 3.100 . 4.300 3.727 3.702 3.754 . 0 0 "[ . 1 . 2]" 1
665 1 55 ILE H 1 56 LYS H 2.700 . 3.600 2.588 2.453 2.750 . 0 0 "[ . 1 . 2]" 1
666 1 55 ILE HA 1 55 ILE MD 2.800 . 3.800 2.161 2.092 2.371 . 0 0 "[ . 1 . 2]" 1
667 1 55 ILE HA 1 55 ILE HG13 3.000 . 4.100 3.441 2.509 3.767 . 0 0 "[ . 1 . 2]" 1
668 1 55 ILE HA 1 55 ILE MG 2.600 . 3.500 2.323 2.235 2.497 . 0 0 "[ . 1 . 2]" 1
669 1 55 ILE HA 1 57 LYS H 3.400 . 4.900 4.394 4.273 4.697 . 0 0 "[ . 1 . 2]" 1
670 1 55 ILE HA 1 58 LEU H 2.900 . 4.000 3.373 3.245 3.544 . 0 0 "[ . 1 . 2]" 1
671 1 55 ILE HA 1 58 LEU HB3 3.200 . 4.500 4.511 4.456 4.533 0.033 7 0 "[ . 1 . 2]" 1
672 1 55 ILE HA 1 58 LEU MD1 2.900 . 4.000 2.346 2.275 2.472 . 0 0 "[ . 1 . 2]" 1
673 1 55 ILE HA 1 72 TYR QE 3.500 . 5.000 4.528 4.143 4.769 . 0 0 "[ . 1 . 2]" 1
674 1 55 ILE HB 1 55 ILE MD 2.800 . 3.800 3.011 2.428 3.205 . 0 0 "[ . 1 . 2]" 1
675 1 55 ILE HB 1 56 LYS H 2.800 . 3.800 2.626 2.412 2.712 . 0 0 "[ . 1 . 2]" 1
676 1 55 ILE MD 1 56 LYS H 3.500 . 5.000 4.213 3.799 4.373 . 0 0 "[ . 1 . 2]" 1
677 1 55 ILE MD 1 75 VAL MG2 3.200 . 4.500 4.227 3.981 4.552 0.052 18 0 "[ . 1 . 2]" 1
678 1 55 ILE MD 1 111 ILE HB 3.300 . 4.700 3.974 3.815 4.479 . 0 0 "[ . 1 . 2]" 1
679 1 55 ILE MD 1 111 ILE MG 2.300 . 2.900 2.128 1.962 2.796 . 0 0 "[ . 1 . 2]" 1
680 1 55 ILE HG12 1 55 ILE MG 2.900 . 4.000 2.988 2.363 3.195 . 0 0 "[ . 1 . 2]" 1
681 1 55 ILE HG12 1 56 LYS H 3.400 . 4.800 4.146 3.807 4.995 0.195 18 0 "[ . 1 . 2]" 1
682 1 55 ILE HG12 1 111 ILE MG 3.200 . 4.500 4.433 3.960 4.569 0.069 6 0 "[ . 1 . 2]" 1
683 1 55 ILE HG13 1 55 ILE MG 2.700 . 3.600 2.311 2.258 2.343 . 0 0 "[ . 1 . 2]" 1
684 1 55 ILE HG13 1 111 ILE MD 3.000 . 4.100 3.113 2.069 3.546 . 0 0 "[ . 1 . 2]" 1
685 1 55 ILE MG 1 56 LYS H 3.300 . 4.600 3.593 3.003 3.812 . 0 0 "[ . 1 . 2]" 1
686 1 55 ILE MG 1 57 LYS H 3.500 . 5.100 5.095 4.884 5.226 0.126 10 0 "[ . 1 . 2]" 1
687 1 55 ILE MG 1 58 LEU H 3.300 . 4.700 4.423 4.209 4.698 . 0 0 "[ . 1 . 2]" 1
688 1 55 ILE MG 1 59 ARG H 3.600 . 5.200 3.645 3.356 3.895 . 0 0 "[ . 1 . 2]" 1
689 1 55 ILE MG 1 72 TYR HA 3.000 . 4.100 3.338 3.083 3.492 . 0 0 "[ . 1 . 2]" 1
690 1 55 ILE MG 1 72 TYR HB2 3.100 . 4.300 4.228 3.738 4.335 0.035 10 0 "[ . 1 . 2]" 1
691 1 55 ILE MG 1 72 TYR HB3 3.000 . 4.100 2.818 2.310 2.944 . 0 0 "[ . 1 . 2]" 1
692 1 55 ILE MG 1 72 TYR QD 2.900 . 3.900 2.119 2.039 2.262 . 0 0 "[ . 1 . 2]" 1
693 1 55 ILE MG 1 72 TYR QE 2.900 . 3.900 3.211 2.804 3.922 0.022 16 0 "[ . 1 . 2]" 1
694 1 55 ILE MG 1 75 VAL HB 3.200 . 4.500 2.419 2.292 2.524 . 0 0 "[ . 1 . 2]" 1
695 1 55 ILE MG 1 75 VAL MG2 2.400 . 3.100 3.173 3.136 3.238 0.138 15 0 "[ . 1 . 2]" 1
696 1 56 LYS H 1 56 LYS HB2 2.900 . 4.000 2.450 2.359 2.683 . 0 0 "[ . 1 . 2]" 1
697 1 56 LYS H 1 56 LYS HD2 3.400 . 4.900 4.055 3.905 4.124 . 0 0 "[ . 1 . 2]" 1
698 1 56 LYS H 1 56 LYS HG2 3.500 . 5.000 3.365 2.867 3.597 . 0 0 "[ . 1 . 2]" 1
699 1 56 LYS H 1 56 LYS HG3 3.100 . 4.300 2.222 1.884 2.388 0.016 7 0 "[ . 1 . 2]" 1
700 1 56 LYS H 1 57 LYS H 2.800 . 3.800 2.854 2.760 2.918 . 0 0 "[ . 1 . 2]" 1
701 1 56 LYS H 1 76 ILE MD 3.700 . 5.400 4.242 3.796 4.721 . 0 0 "[ . 1 . 2]" 1
702 1 56 LYS HA 1 56 LYS HE2 3.700 . 5.500 5.022 4.807 5.447 . 0 0 "[ . 1 . 2]" 1
703 1 56 LYS HA 1 56 LYS HG3 3.000 . 4.100 2.976 2.845 3.241 . 0 0 "[ . 1 . 2]" 1
704 1 56 LYS HA 1 59 ARG HB2 3.400 . 4.800 3.189 2.864 3.862 . 0 0 "[ . 1 . 2]" 1
705 1 56 LYS HA 1 59 ARG HB3 3.400 . 4.900 2.563 2.346 2.717 . 0 0 "[ . 1 . 2]" 1
706 1 56 LYS HA 1 59 ARG HD3 3.700 . 5.500 4.041 3.268 5.461 . 0 0 "[ . 1 . 2]" 1
707 1 56 LYS HA 1 76 ILE MD 3.000 . 4.100 3.610 3.011 4.110 0.010 18 0 "[ . 1 . 2]" 1
708 1 56 LYS HB3 1 56 LYS HE2 3.600 . 5.200 4.499 4.323 4.651 . 0 0 "[ . 1 . 2]" 1
709 1 56 LYS HE2 1 76 ILE MD 3.000 . 4.100 3.186 2.653 3.893 . 0 0 "[ . 1 . 2]" 1
710 1 56 LYS HE2 1 76 ILE MG 2.800 . 3.800 3.398 2.730 3.806 0.006 7 0 "[ . 1 . 2]" 1
711 1 56 LYS HE3 1 56 LYS HG2 3.100 . 4.300 3.439 3.092 3.774 . 0 0 "[ . 1 . 2]" 1
712 1 56 LYS HE3 1 76 ILE MD 3.200 . 4.500 4.015 3.419 4.509 0.009 11 0 "[ . 1 . 2]" 1
713 1 56 LYS HE3 1 76 ILE MG 3.600 . 5.200 3.932 3.243 4.796 . 0 0 "[ . 1 . 2]" 1
714 1 56 LYS HG2 1 76 ILE MD 3.100 . 4.300 2.887 2.382 3.457 . 0 0 "[ . 1 . 2]" 1
715 1 56 LYS HG3 1 76 ILE MD 3.000 . 4.100 3.268 2.869 3.849 . 0 0 "[ . 1 . 2]" 1
716 1 57 LYS H 1 57 LYS QB 2.300 . 3.000 2.263 2.189 2.376 . 0 0 "[ . 1 . 2]" 1
717 1 57 LYS H 1 57 LYS HG2 3.200 . 4.500 4.101 3.406 4.523 0.023 19 0 "[ . 1 . 2]" 1
718 1 57 LYS H 1 57 LYS HG3 3.100 . 4.300 3.417 2.317 4.319 0.019 7 0 "[ . 1 . 2]" 1
719 1 57 LYS H 1 58 LEU H 2.700 . 3.600 2.841 2.782 2.924 . 0 0 "[ . 1 . 2]" 1
720 1 57 LYS HA 1 57 LYS QD 3.100 . 4.300 3.963 3.883 4.131 . 0 0 "[ . 1 . 2]" 1
721 1 57 LYS HA 1 57 LYS HG2 3.100 . 4.300 2.691 2.318 2.997 . 0 0 "[ . 1 . 2]" 1
722 1 57 LYS HA 1 57 LYS HG3 3.000 . 4.100 2.583 2.347 2.990 . 0 0 "[ . 1 . 2]" 1
723 1 57 LYS HA 1 60 ASP HB3 3.100 . 4.300 3.121 2.855 3.663 . 0 0 "[ . 1 . 2]" 1
724 1 57 LYS QB 1 57 LYS QD 2.600 . 3.500 2.155 2.115 2.291 . 0 0 "[ . 1 . 2]" 1
725 1 57 LYS QB 1 57 LYS QE 2.900 . 3.900 3.346 2.173 3.671 . 0 0 "[ . 1 . 2]" 1
726 1 57 LYS QB 1 58 LEU H 2.700 . 3.600 2.401 2.199 2.583 . 0 0 "[ . 1 . 2]" 1
727 1 57 LYS QB 1 58 LEU HB2 3.600 . 5.200 4.689 4.418 4.854 . 0 0 "[ . 1 . 2]" 1
728 1 57 LYS QB 1 59 ARG H 3.600 . 5.200 4.536 4.347 4.786 . 0 0 "[ . 1 . 2]" 1
729 1 57 LYS QE 1 57 LYS HG3 2.900 . 4.000 2.595 2.259 3.430 . 0 0 "[ . 1 . 2]" 1
730 1 57 LYS HG3 1 58 LEU H 3.700 . 5.400 4.627 4.395 4.882 . 0 0 "[ . 1 . 2]" 1
731 1 58 LEU H 1 58 LEU HB2 2.900 . 3.900 2.612 2.446 2.685 . 0 0 "[ . 1 . 2]" 1
732 1 58 LEU H 1 58 LEU HB3 2.700 . 3.600 3.590 3.576 3.611 0.011 18 0 "[ . 1 . 2]" 1
733 1 58 LEU H 1 58 LEU MD1 3.000 . 4.100 3.394 3.156 3.496 . 0 0 "[ . 1 . 2]" 1
734 1 58 LEU H 1 58 LEU MD2 3.200 . 4.400 3.123 2.778 3.699 . 0 0 "[ . 1 . 2]" 1
735 1 58 LEU H 1 58 LEU HG 2.500 . 3.300 1.911 1.795 2.240 . 0 0 "[ . 1 . 2]" 1
736 1 58 LEU H 1 59 ARG H 2.900 . 3.900 2.623 2.435 2.862 . 0 0 "[ . 1 . 2]" 1
737 1 58 LEU H 1 59 ARG HB3 3.700 . 5.500 4.947 4.692 5.177 . 0 0 "[ . 1 . 2]" 1
738 1 58 LEU HA 1 58 LEU MD2 2.400 . 3.100 2.192 2.154 2.256 . 0 0 "[ . 1 . 2]" 1
739 1 58 LEU HA 1 60 ASP HB3 3.700 . 5.500 5.295 4.784 5.552 0.052 6 0 "[ . 1 . 2]" 1
740 1 58 LEU HA 1 61 ASN H 3.100 . 4.300 3.783 3.635 4.011 . 0 0 "[ . 1 . 2]" 1
741 1 58 LEU HA 1 61 ASN HB3 3.700 . 5.500 4.327 3.267 5.048 . 0 0 "[ . 1 . 2]" 1
742 1 58 LEU HB2 1 58 LEU MD1 2.700 . 3.600 2.315 2.243 2.379 . 0 0 "[ . 1 . 2]" 1
743 1 58 LEU HB2 1 59 ARG H 3.100 . 4.300 2.669 2.296 2.790 . 0 0 "[ . 1 . 2]" 1
744 1 58 LEU HB3 1 58 LEU MD1 2.800 . 3.800 2.423 2.339 2.588 . 0 0 "[ . 1 . 2]" 1
745 1 58 LEU HB3 1 59 ARG H 2.900 . 3.900 3.821 3.406 3.934 0.034 19 0 "[ . 1 . 2]" 1
746 1 58 LEU HB3 1 72 TYR QE 3.100 . 4.300 3.808 3.442 4.311 0.011 4 0 "[ . 1 . 2]" 1
747 1 58 LEU MD1 1 59 ARG H 3.700 . 5.400 4.431 4.083 4.534 . 0 0 "[ . 1 . 2]" 1
748 1 58 LEU MD1 1 72 TYR QE 2.900 . 3.900 3.183 2.710 3.876 . 0 0 "[ . 1 . 2]" 1
749 1 58 LEU MD1 1 111 ILE HA 3.300 . 4.700 3.422 2.782 4.022 . 0 0 "[ . 1 . 2]" 1
750 1 58 LEU MD2 1 59 ARG H 3.700 . 5.500 4.615 4.454 4.864 . 0 0 "[ . 1 . 2]" 1
751 1 58 LEU HG 1 59 ARG H 3.500 . 5.100 4.054 3.894 4.464 . 0 0 "[ . 1 . 2]" 1
752 1 59 ARG H 1 59 ARG HB2 2.800 . 3.800 2.478 2.337 2.614 . 0 0 "[ . 1 . 2]" 1
753 1 59 ARG H 1 59 ARG HB3 2.800 . 3.800 2.606 2.470 2.754 . 0 0 "[ . 1 . 2]" 1
754 1 59 ARG H 1 59 ARG HG2 3.700 . 5.400 4.465 4.414 4.499 . 0 0 "[ . 1 . 2]" 1
755 1 59 ARG H 1 60 ASP H 2.900 . 3.900 2.704 2.603 2.809 . 0 0 "[ . 1 . 2]" 1
756 1 59 ARG HA 1 62 GLU HB2 3.300 . 4.700 3.870 3.265 4.207 . 0 0 "[ . 1 . 2]" 1
757 1 59 ARG HA 1 62 GLU HG3 3.400 . 4.800 3.859 2.989 4.806 0.006 8 0 "[ . 1 . 2]" 1
758 1 59 ARG HA 1 72 TYR QD 3.000 . 4.100 3.548 3.312 3.771 . 0 0 "[ . 1 . 2]" 1
759 1 59 ARG HA 1 72 TYR QE 3.200 . 4.400 4.229 3.725 4.420 0.020 15 0 "[ . 1 . 2]" 1
760 1 59 ARG HB2 1 60 ASP H 3.100 . 4.300 3.706 3.566 3.928 . 0 0 "[ . 1 . 2]" 1
761 1 59 ARG HB3 1 72 TYR HB2 3.700 . 5.500 5.187 4.883 5.431 . 0 0 "[ . 1 . 2]" 1
762 1 59 ARG HB3 1 72 TYR HB3 3.400 . 4.900 4.337 3.985 4.583 . 0 0 "[ . 1 . 2]" 1
763 1 59 ARG HD2 1 69 ILE MG 3.100 . 4.300 2.827 2.199 4.296 . 0 0 "[ . 1 . 2]" 1
764 1 59 ARG HD3 1 69 ILE MG 3.200 . 4.500 3.707 2.321 4.250 . 0 0 "[ . 1 . 2]" 1
765 1 59 ARG HG3 1 69 ILE HA 3.300 . 4.700 3.000 2.593 3.395 . 0 0 "[ . 1 . 2]" 1
766 1 59 ARG HG3 1 69 ILE MG 3.000 . 4.100 3.456 2.569 4.127 0.027 16 0 "[ . 1 . 2]" 1
767 1 60 ASP H 1 60 ASP HB2 2.700 . 3.600 2.456 2.323 2.543 . 0 0 "[ . 1 . 2]" 1
768 1 60 ASP H 1 60 ASP HB3 2.700 . 3.600 2.612 2.511 2.776 . 0 0 "[ . 1 . 2]" 1
769 1 60 ASP H 1 61 ASN H 2.800 . 3.800 2.798 2.765 2.855 . 0 0 "[ . 1 . 2]" 1
770 1 60 ASP HA 1 62 GLU H 3.100 . 4.300 3.375 3.240 3.686 . 0 0 "[ . 1 . 2]" 1
771 1 60 ASP HB3 1 61 ASN H 2.500 . 3.300 3.105 2.842 3.322 0.022 10 0 "[ . 1 . 2]" 1
772 1 61 ASN H 1 61 ASN HB2 2.800 . 3.800 2.799 2.403 3.614 . 0 0 "[ . 1 . 2]" 1
773 1 61 ASN H 1 61 ASN HB3 2.800 . 3.800 3.314 2.360 3.601 . 0 0 "[ . 1 . 2]" 1
774 1 61 ASN H 1 61 ASN HD21 3.100 . 4.300 3.233 1.889 4.361 0.061 10 0 "[ . 1 . 2]" 1
775 1 61 ASN H 1 61 ASN HD22 3.300 . 4.700 3.830 3.218 4.322 . 0 0 "[ . 1 . 2]" 1
776 1 61 ASN H 1 62 GLU HA 3.700 . 5.400 5.172 4.981 5.285 . 0 0 "[ . 1 . 2]" 1
777 1 61 ASN H 1 62 GLU HB2 3.300 . 4.700 4.665 4.430 4.755 0.055 6 0 "[ . 1 . 2]" 1
778 1 61 ASN HB3 1 61 ASN HD21 2.900 . 4.000 2.917 2.248 3.582 . 0 0 "[ . 1 . 2]" 1
779 1 61 ASN HB3 1 62 GLU H 3.200 . 4.400 4.195 4.028 4.291 . 0 0 "[ . 1 . 2]" 1
780 1 62 GLU H 1 62 GLU HB2 2.600 . 3.500 2.447 2.284 2.720 . 0 0 "[ . 1 . 2]" 1
781 1 62 GLU H 1 62 GLU HB3 3.000 . 4.100 3.652 3.554 3.827 . 0 0 "[ . 1 . 2]" 1
782 1 62 GLU H 1 62 GLU HG2 2.700 . 3.600 2.820 2.303 3.719 0.119 17 0 "[ . 1 . 2]" 1
783 1 62 GLU H 1 62 GLU HG3 3.100 . 4.300 3.839 2.537 4.128 . 0 0 "[ . 1 . 2]" 1
784 1 62 GLU HA 1 62 GLU HG2 3.100 . 4.300 2.854 2.376 3.661 . 0 0 "[ . 1 . 2]" 1
785 1 62 GLU HA 1 63 GLU H 2.400 . 3.100 2.349 2.176 2.592 . 0 0 "[ . 1 . 2]" 1
786 1 62 GLU HB2 1 63 GLU H 3.000 . 4.200 3.790 3.311 4.229 0.029 18 0 "[ . 1 . 2]" 1
787 1 62 GLU HB2 1 66 SER HB3 3.700 . 5.400 4.200 3.418 4.979 . 0 0 "[ . 1 . 2]" 1
788 1 62 GLU HB2 1 69 ILE MD 3.100 . 4.300 3.256 2.314 3.965 . 0 0 "[ . 1 . 2]" 1
789 1 62 GLU HB3 1 63 GLU H 2.800 . 3.800 2.615 2.075 3.170 . 0 0 "[ . 1 . 2]" 1
790 1 62 GLU HB3 1 66 SER HB2 3.400 . 4.800 3.666 2.548 4.255 . 0 0 "[ . 1 . 2]" 1
791 1 62 GLU HB3 1 66 SER HB3 3.100 . 4.300 2.822 2.335 3.481 . 0 0 "[ . 1 . 2]" 1
792 1 62 GLU HB3 1 69 ILE MD 3.000 . 4.100 3.278 2.670 3.858 . 0 0 "[ . 1 . 2]" 1
793 1 62 GLU HB3 1 69 ILE HG12 3.300 . 4.700 3.441 2.691 4.272 . 0 0 "[ . 1 . 2]" 1
794 1 62 GLU HB3 1 69 ILE HG13 3.400 . 4.900 4.197 3.478 4.950 0.050 18 0 "[ . 1 . 2]" 1
795 1 62 GLU HG2 1 69 ILE MD 3.700 . 5.500 5.194 4.240 5.560 0.060 6 0 "[ . 1 . 2]" 1
796 1 62 GLU HG2 1 72 TYR QE 3.300 . 4.700 4.410 3.560 4.707 0.007 18 0 "[ . 1 . 2]" 1
797 1 62 GLU HG3 1 72 TYR QE 3.000 . 4.100 3.925 3.498 4.138 0.038 19 0 "[ . 1 . 2]" 1
798 1 63 GLU H 1 63 GLU HB2 2.800 . 3.800 2.324 2.266 2.441 . 0 0 "[ . 1 . 2]" 1
799 1 63 GLU H 1 63 GLU HB3 2.700 . 3.600 3.565 3.544 3.603 0.003 9 0 "[ . 1 . 2]" 1
800 1 63 GLU H 1 63 GLU HG2 2.800 . 3.800 3.421 2.258 3.824 0.024 10 0 "[ . 1 . 2]" 1
801 1 63 GLU H 1 66 SER HB3 3.400 . 4.900 3.234 2.501 4.454 . 0 0 "[ . 1 . 2]" 1
802 1 63 GLU HA 1 63 GLU HG2 3.000 . 4.200 2.852 2.356 3.639 . 0 0 "[ . 1 . 2]" 1
803 1 63 GLU HA 1 64 PRO HD2 2.600 . 3.500 2.454 2.326 2.582 . 0 0 "[ . 1 . 2]" 1
804 1 63 GLU HA 1 64 PRO HD3 2.800 . 3.800 2.374 2.266 2.545 . 0 0 "[ . 1 . 2]" 1
805 1 63 GLU HA 1 64 PRO QG 3.400 . 4.800 4.064 4.033 4.076 . 0 0 "[ . 1 . 2]" 1
806 1 63 GLU HA 1 69 ILE MD 3.600 . 5.200 4.922 4.135 5.241 0.041 2 0 "[ . 1 . 2]" 1
807 1 63 GLU HB2 1 64 PRO HD2 3.400 . 4.800 3.894 3.823 4.169 . 0 0 "[ . 1 . 2]" 1
808 1 63 GLU HB2 1 66 SER HB3 3.200 . 4.500 3.256 2.532 4.244 . 0 0 "[ . 1 . 2]" 1
809 1 63 GLU HB3 1 64 PRO HD2 3.000 . 4.100 2.347 2.301 2.737 . 0 0 "[ . 1 . 2]" 1
810 1 63 GLU HB3 1 66 SER HB3 3.500 . 5.000 4.542 3.883 5.035 0.035 12 0 "[ . 1 . 2]" 1
811 1 64 PRO HA 1 69 ILE MD 2.900 . 3.900 3.402 2.763 3.941 0.041 9 0 "[ . 1 . 2]" 1
812 1 64 PRO HB2 1 69 ILE MD 3.600 . 5.300 5.220 4.887 5.339 0.039 4 0 "[ . 1 . 2]" 1
813 1 64 PRO HB3 1 65 ASN H 3.200 . 4.500 4.257 3.691 4.581 0.081 1 0 "[ . 1 . 2]" 1
814 1 64 PRO QG 1 65 ASN H 3.200 . 4.500 3.758 2.478 4.506 0.006 2 0 "[ . 1 . 2]" 1
815 1 65 ASN H 1 65 ASN HD22 3.300 . 4.600 3.890 2.664 4.455 . 0 0 "[ . 1 . 2]" 1
816 1 65 ASN H 1 66 SER H 2.800 . 3.800 3.653 1.999 3.903 0.103 9 0 "[ . 1 . 2]" 1
817 1 65 ASN H 1 66 SER HB3 3.400 . 4.800 3.926 3.396 4.428 . 0 0 "[ . 1 . 2]" 1
818 1 65 ASN HB2 1 65 ASN HD21 2.900 . 4.000 2.770 2.246 3.604 . 0 0 "[ . 1 . 2]" 1
819 1 65 ASN HB2 1 66 SER HB3 3.700 . 5.500 5.446 4.763 5.571 0.071 17 0 "[ . 1 . 2]" 1
820 1 66 SER H 1 66 SER HB3 2.600 . 3.400 2.785 2.109 2.964 . 0 0 "[ . 1 . 2]" 1
821 1 66 SER H 1 69 ILE H 3.200 . 4.500 4.267 4.059 4.550 0.050 1 0 "[ . 1 . 2]" 1
822 1 66 SER H 1 69 ILE HB 3.100 . 4.300 3.708 3.416 4.295 . 0 0 "[ . 1 . 2]" 1
823 1 66 SER H 1 69 ILE MD 2.900 . 4.000 2.462 1.741 3.972 0.059 19 0 "[ . 1 . 2]" 1
824 1 66 SER H 1 69 ILE MG 3.300 . 4.600 4.102 3.847 4.438 . 0 0 "[ . 1 . 2]" 1
825 1 66 SER HA 1 67 PRO HD2 2.700 . 3.600 2.712 2.590 2.826 . 0 0 "[ . 1 . 2]" 1
826 1 66 SER HA 1 67 PRO HD3 2.600 . 3.500 2.317 2.306 2.352 . 0 0 "[ . 1 . 2]" 1
827 1 66 SER HA 1 67 PRO HG2 3.500 . 5.100 4.764 4.688 4.835 . 0 0 "[ . 1 . 2]" 1
828 1 66 SER HA 1 67 PRO HG3 3.700 . 5.400 4.584 4.563 4.601 . 0 0 "[ . 1 . 2]" 1
829 1 66 SER HB2 1 68 LYS HG2 3.700 . 5.500 4.927 3.958 5.545 0.045 16 0 "[ . 1 . 2]" 1
830 1 66 SER HB2 1 69 ILE MD 3.500 . 5.000 4.170 3.836 4.665 . 0 0 "[ . 1 . 2]" 1
831 1 66 SER HB2 1 69 ILE HG12 3.400 . 4.900 4.601 3.987 4.949 0.049 17 0 "[ . 1 . 2]" 1
832 1 66 SER HB2 1 69 ILE HG13 3.700 . 5.500 4.326 3.868 5.324 . 0 0 "[ . 1 . 2]" 1
833 1 66 SER HB3 1 69 ILE H 3.200 . 4.500 4.385 4.078 4.523 0.023 16 0 "[ . 1 . 2]" 1
834 1 66 SER HB3 1 69 ILE HB 3.700 . 5.500 5.165 4.829 5.437 . 0 0 "[ . 1 . 2]" 1
835 1 66 SER HB3 1 69 ILE MD 3.000 . 4.100 2.727 2.307 3.346 . 0 0 "[ . 1 . 2]" 1
836 1 66 SER HB3 1 69 ILE HG12 3.200 . 4.500 3.302 2.727 3.585 . 0 0 "[ . 1 . 2]" 1
837 1 67 PRO HA 1 69 ILE H 3.300 . 4.600 3.621 3.416 3.892 . 0 0 "[ . 1 . 2]" 1
838 1 67 PRO HA 1 70 ARG H 3.200 . 4.500 3.874 3.634 4.180 . 0 0 "[ . 1 . 2]" 1
839 1 67 PRO HB3 1 68 LYS H 3.100 . 4.300 4.125 4.072 4.184 . 0 0 "[ . 1 . 2]" 1
840 1 67 PRO HD2 1 68 LYS H 2.900 . 3.900 2.476 2.326 2.648 . 0 0 "[ . 1 . 2]" 1
841 1 67 PRO HD2 1 69 ILE H 3.500 . 5.100 4.430 4.340 4.604 . 0 0 "[ . 1 . 2]" 1
842 1 67 PRO HG2 1 68 LYS H 3.200 . 4.400 2.289 2.168 2.418 . 0 0 "[ . 1 . 2]" 1
843 1 68 LYS H 1 68 LYS HB2 2.700 . 3.600 2.694 2.510 2.857 . 0 0 "[ . 1 . 2]" 1
844 1 68 LYS H 1 68 LYS HB3 3.000 . 4.100 3.560 3.531 3.594 . 0 0 "[ . 1 . 2]" 1
845 1 68 LYS H 1 68 LYS HG2 2.800 . 3.800 2.080 1.794 2.515 0.006 18 0 "[ . 1 . 2]" 1
846 1 68 LYS H 1 68 LYS HG3 3.000 . 4.100 2.829 1.860 3.411 0.040 11 0 "[ . 1 . 2]" 1
847 1 68 LYS H 1 69 ILE H 2.800 . 3.800 2.678 2.580 2.738 . 0 0 "[ . 1 . 2]" 1
848 1 68 LYS H 1 71 VAL MG1 3.300 . 4.700 4.386 4.308 4.440 . 0 0 "[ . 1 . 2]" 1
849 1 68 LYS HA 1 68 LYS QD 3.300 . 4.700 2.821 2.125 4.173 . 0 0 "[ . 1 . 2]" 1
850 1 68 LYS HA 1 68 LYS HG3 3.000 . 4.100 3.683 3.468 3.815 . 0 0 "[ . 1 . 2]" 1
851 1 68 LYS HA 1 71 VAL H 2.900 . 4.000 3.443 3.108 3.581 . 0 0 "[ . 1 . 2]" 1
852 1 68 LYS HA 1 71 VAL HB 3.200 . 4.500 4.239 4.128 4.596 0.096 6 0 "[ . 1 . 2]" 1
853 1 68 LYS HA 1 71 VAL MG1 2.600 . 3.500 2.129 2.075 2.275 . 0 0 "[ . 1 . 2]" 1
854 1 68 LYS HA 1 71 VAL MG2 3.200 . 4.500 4.256 2.260 4.627 0.127 12 0 "[ . 1 . 2]" 1
855 1 68 LYS HA 1 72 TYR H 3.200 . 4.500 4.087 3.595 4.469 . 0 0 "[ . 1 . 2]" 1
856 1 68 LYS HB2 1 69 ILE H 3.200 . 4.500 3.339 3.101 3.597 . 0 0 "[ . 1 . 2]" 1
857 1 68 LYS HB2 1 72 TYR QE 3.400 . 4.800 3.836 3.162 4.312 . 0 0 "[ . 1 . 2]" 1
858 1 68 LYS HB3 1 68 LYS HE2 3.600 . 5.200 4.184 2.324 4.771 . 0 0 "[ . 1 . 2]" 1
859 1 68 LYS HB3 1 68 LYS HE3 3.700 . 5.500 4.039 2.325 4.803 . 0 0 "[ . 1 . 2]" 1
860 1 68 LYS HB3 1 72 TYR H 3.600 . 5.200 4.584 4.199 5.037 . 0 0 "[ . 1 . 2]" 1
861 1 68 LYS HB3 1 72 TYR HB2 3.700 . 5.500 4.733 4.358 5.507 0.007 9 0 "[ . 1 . 2]" 1
862 1 68 LYS HB3 1 72 TYR QD 3.500 . 5.000 2.772 2.331 3.606 . 0 0 "[ . 1 . 2]" 1
863 1 68 LYS HB3 1 72 TYR QE 3.000 . 4.100 2.909 2.333 3.363 . 0 0 "[ . 1 . 2]" 1
864 1 69 ILE H 1 69 ILE HB 2.500 . 3.300 2.612 2.453 2.698 . 0 0 "[ . 1 . 2]" 1
865 1 69 ILE H 1 69 ILE MD 3.100 . 4.300 3.456 2.692 3.706 . 0 0 "[ . 1 . 2]" 1
866 1 69 ILE H 1 69 ILE HG12 2.700 . 3.600 2.596 1.924 3.071 . 0 0 "[ . 1 . 2]" 1
867 1 69 ILE H 1 69 ILE HG13 2.900 . 3.900 2.536 1.878 3.565 0.022 17 0 "[ . 1 . 2]" 1
868 1 69 ILE H 1 69 ILE MG 3.200 . 4.500 3.755 3.740 3.778 . 0 0 "[ . 1 . 2]" 1
869 1 69 ILE H 1 70 ARG H 2.600 . 3.500 2.612 2.584 2.711 . 0 0 "[ . 1 . 2]" 1
870 1 69 ILE H 1 71 VAL MG1 3.600 . 5.200 4.086 3.949 4.490 . 0 0 "[ . 1 . 2]" 1
871 1 69 ILE HA 1 69 ILE MD 3.000 . 4.100 3.117 2.083 3.761 . 0 0 "[ . 1 . 2]" 1
872 1 69 ILE HA 1 69 ILE HG13 3.000 . 4.200 3.454 3.207 3.784 . 0 0 "[ . 1 . 2]" 1
873 1 69 ILE HA 1 69 ILE MG 2.600 . 3.500 2.320 2.270 2.360 . 0 0 "[ . 1 . 2]" 1
874 1 69 ILE HA 1 72 TYR H 3.100 . 4.300 3.809 3.594 3.996 . 0 0 "[ . 1 . 2]" 1
875 1 69 ILE HA 1 72 TYR HB2 3.300 . 4.600 2.982 2.727 3.224 . 0 0 "[ . 1 . 2]" 1
876 1 69 ILE HA 1 72 TYR QD 3.000 . 4.200 3.668 3.129 3.974 . 0 0 "[ . 1 . 2]" 1
877 1 69 ILE HB 1 69 ILE MD 2.800 . 3.800 2.728 2.372 3.219 . 0 0 "[ . 1 . 2]" 1
878 1 69 ILE HB 1 70 ARG H 2.500 . 3.300 2.745 2.566 2.804 . 0 0 "[ . 1 . 2]" 1
879 1 69 ILE HG13 1 69 ILE MG 2.800 . 3.800 2.894 2.292 3.198 . 0 0 "[ . 1 . 2]" 1
880 1 69 ILE MG 1 70 ARG H 3.000 . 4.100 3.708 3.512 3.798 . 0 0 "[ . 1 . 2]" 1
881 1 69 ILE MG 1 70 ARG HA 3.200 . 4.500 3.732 3.438 3.852 . 0 0 "[ . 1 . 2]" 1
882 1 69 ILE MG 1 73 ASN H 3.700 . 5.500 4.064 3.912 4.186 . 0 0 "[ . 1 . 2]" 1
883 1 69 ILE MG 1 73 ASN HB2 3.300 . 4.700 3.198 3.002 3.333 . 0 0 "[ . 1 . 2]" 1
884 1 69 ILE MG 1 73 ASN HB3 3.700 . 5.500 4.270 3.866 4.661 . 0 0 "[ . 1 . 2]" 1
885 1 70 ARG H 1 70 ARG HB2 2.500 . 3.300 2.468 2.360 2.629 . 0 0 "[ . 1 . 2]" 1
886 1 70 ARG H 1 70 ARG HB3 2.600 . 3.500 2.622 2.433 2.717 . 0 0 "[ . 1 . 2]" 1
887 1 70 ARG H 1 70 ARG QG 3.000 . 4.100 3.977 3.936 4.062 . 0 0 "[ . 1 . 2]" 1
888 1 70 ARG H 1 71 VAL H 2.700 . 3.600 2.656 2.635 2.684 . 0 0 "[ . 1 . 2]" 1
889 1 70 ARG H 1 71 VAL MG1 3.200 . 4.500 3.565 3.513 3.623 . 0 0 "[ . 1 . 2]" 1
890 1 70 ARG HA 1 70 ARG QD 3.500 . 5.000 3.622 2.281 4.159 . 0 0 "[ . 1 . 2]" 1
891 1 70 ARG HA 1 70 ARG QG 2.900 . 3.900 2.392 2.260 3.046 . 0 0 "[ . 1 . 2]" 1
892 1 70 ARG HA 1 73 ASN HB2 3.000 . 4.100 3.498 3.274 3.733 . 0 0 "[ . 1 . 2]" 1
893 1 70 ARG HA 1 73 ASN HB3 3.200 . 4.400 2.782 2.555 3.026 . 0 0 "[ . 1 . 2]" 1
894 1 70 ARG HB2 1 70 ARG QD 2.900 . 4.000 2.536 2.230 3.118 . 0 0 "[ . 1 . 2]" 1
895 1 70 ARG HB3 1 70 ARG QD 3.000 . 4.200 2.766 2.277 3.571 . 0 0 "[ . 1 . 2]" 1
896 1 70 ARG HB3 1 71 VAL H 2.900 . 3.900 2.515 2.442 2.625 . 0 0 "[ . 1 . 2]" 1
897 1 70 ARG HB3 1 71 VAL MG1 3.300 . 4.700 3.792 2.917 3.984 . 0 0 "[ . 1 . 2]" 1
898 1 70 ARG QG 1 71 VAL H 3.300 . 4.600 3.692 3.482 3.900 . 0 0 "[ . 1 . 2]" 1
899 1 70 ARG QG 1 74 THR H 3.400 . 4.800 4.443 4.209 4.747 . 0 0 "[ . 1 . 2]" 1
900 1 71 VAL H 1 71 VAL HB 2.800 . 3.800 2.816 2.613 3.591 . 0 0 "[ . 1 . 2]" 1
901 1 71 VAL H 1 71 VAL MG1 2.500 . 3.300 1.784 1.722 1.859 . 0 0 "[ . 1 . 2]" 1
902 1 71 VAL H 1 71 VAL MG2 3.000 . 4.100 3.596 2.657 3.761 . 0 0 "[ . 1 . 2]" 1
903 1 71 VAL H 1 72 TYR H 2.700 . 3.600 2.724 2.610 2.851 . 0 0 "[ . 1 . 2]" 1
904 1 71 VAL HA 1 71 VAL MG1 2.500 . 3.300 3.095 2.591 3.187 . 0 0 "[ . 1 . 2]" 1
905 1 71 VAL HA 1 71 VAL MG2 2.600 . 3.500 2.498 2.341 3.176 . 0 0 "[ . 1 . 2]" 1
906 1 71 VAL HA 1 74 THR H 3.100 . 4.300 3.502 3.373 3.577 . 0 0 "[ . 1 . 2]" 1
907 1 71 VAL HA 1 74 THR HB 2.900 . 3.900 3.220 2.950 3.532 . 0 0 "[ . 1 . 2]" 1
908 1 71 VAL HB 1 72 TYR H 3.000 . 4.100 3.962 3.890 4.121 0.021 6 0 "[ . 1 . 2]" 1
909 1 71 VAL HB 1 107 ASN HD22 3.300 . 4.700 4.019 3.485 4.299 . 0 0 "[ . 1 . 2]" 1
910 1 71 VAL MG1 1 72 TYR H 2.900 . 3.900 2.134 1.837 3.435 0.063 16 0 "[ . 1 . 2]" 1
911 1 71 VAL MG1 1 73 ASN H 3.700 . 5.500 4.226 3.986 5.168 . 0 0 "[ . 1 . 2]" 1
912 1 71 VAL MG1 1 74 THR H 3.700 . 5.400 4.959 4.795 5.367 . 0 0 "[ . 1 . 2]" 1
913 1 71 VAL MG1 1 107 ASN HD21 3.600 . 5.200 4.714 3.951 4.994 . 0 0 "[ . 1 . 2]" 1
914 1 71 VAL MG1 1 107 ASN HD22 3.300 . 4.600 4.524 3.988 4.623 0.023 2 0 "[ . 1 . 2]" 1
915 1 71 VAL MG2 1 72 TYR H 2.900 . 4.000 3.068 1.840 3.322 . 0 0 "[ . 1 . 2]" 1
916 1 71 VAL MG2 1 72 TYR HA 3.300 . 4.700 3.269 2.993 3.347 . 0 0 "[ . 1 . 2]" 1
917 1 71 VAL MG2 1 72 TYR QD 3.400 . 4.800 4.097 3.001 4.360 . 0 0 "[ . 1 . 2]" 1
918 1 71 VAL MG2 1 72 TYR QE 3.500 . 5.000 4.663 3.697 4.941 . 0 0 "[ . 1 . 2]" 1
919 1 71 VAL MG2 1 74 THR HB 3.500 . 5.000 3.883 3.521 4.950 . 0 0 "[ . 1 . 2]" 1
920 1 71 VAL MG2 1 75 VAL HB 3.700 . 5.400 5.449 5.406 5.533 0.133 15 0 "[ . 1 . 2]" 1
921 1 71 VAL MG2 1 107 ASN HA 3.300 . 4.600 4.359 3.708 4.637 0.037 6 0 "[ . 1 . 2]" 1
922 1 71 VAL MG2 1 107 ASN HB2 3.000 . 4.100 3.718 3.263 4.180 0.080 15 0 "[ . 1 . 2]" 1
923 1 71 VAL MG2 1 107 ASN HB3 2.800 . 3.800 2.888 2.346 3.295 . 0 0 "[ . 1 . 2]" 1
924 1 71 VAL MG2 1 107 ASN HD21 3.100 . 4.300 2.486 2.121 3.852 . 0 0 "[ . 1 . 2]" 1
925 1 71 VAL MG2 1 107 ASN HD22 3.200 . 4.500 2.751 2.242 4.509 0.009 17 0 "[ . 1 . 2]" 1
926 1 72 TYR H 1 72 TYR HB2 2.800 . 3.800 2.216 2.185 2.280 . 0 0 "[ . 1 . 2]" 1
927 1 72 TYR H 1 72 TYR HB3 2.900 . 4.000 3.521 3.499 3.560 . 0 0 "[ . 1 . 2]" 1
928 1 72 TYR H 1 72 TYR QD 3.100 . 4.300 3.217 3.132 3.287 . 0 0 "[ . 1 . 2]" 1
929 1 72 TYR H 1 73 ASN H 2.900 . 3.900 2.629 2.586 2.664 . 0 0 "[ . 1 . 2]" 1
930 1 72 TYR HA 1 72 TYR QD 2.900 . 3.900 2.304 2.281 2.324 . 0 0 "[ . 1 . 2]" 1
931 1 72 TYR HA 1 75 VAL H 3.200 . 4.500 3.399 3.256 3.510 . 0 0 "[ . 1 . 2]" 1
932 1 72 TYR HA 1 75 VAL HB 3.200 . 4.500 3.414 3.134 3.678 . 0 0 "[ . 1 . 2]" 1
933 1 72 TYR HA 1 75 VAL MG1 3.600 . 5.200 4.437 4.276 4.602 . 0 0 "[ . 1 . 2]" 1
934 1 72 TYR HA 1 111 ILE MD 3.100 . 4.300 4.202 3.973 4.334 0.034 2 0 "[ . 1 . 2]" 1
935 1 72 TYR HB2 1 73 ASN H 2.800 . 3.800 2.842 2.749 2.904 . 0 0 "[ . 1 . 2]" 1
936 1 72 TYR HB3 1 76 ILE MD 3.200 . 4.500 4.055 3.705 4.410 . 0 0 "[ . 1 . 2]" 1
937 1 72 TYR QD 1 111 ILE MD 2.900 . 4.000 3.178 2.955 3.600 . 0 0 "[ . 1 . 2]" 1
938 1 72 TYR QE 1 111 ILE MD 3.000 . 4.100 2.958 2.079 3.556 . 0 0 "[ . 1 . 2]" 1
939 1 72 TYR QE 1 111 ILE HG12 2.700 . 3.600 2.365 2.329 2.645 . 0 0 "[ . 1 . 2]" 1
940 1 73 ASN H 1 73 ASN HB2 2.700 . 3.600 2.514 2.372 2.604 . 0 0 "[ . 1 . 2]" 1
941 1 73 ASN H 1 73 ASN HB3 2.900 . 3.900 2.558 2.467 2.711 . 0 0 "[ . 1 . 2]" 1
942 1 73 ASN H 1 73 ASN HD21 3.300 . 4.700 4.487 4.280 4.690 . 0 0 "[ . 1 . 2]" 1
943 1 73 ASN H 1 74 THR H 2.700 . 3.600 2.690 2.606 2.760 . 0 0 "[ . 1 . 2]" 1
944 1 73 ASN HA 1 76 ILE H 3.000 . 4.200 3.533 3.422 3.648 . 0 0 "[ . 1 . 2]" 1
945 1 73 ASN HA 1 76 ILE HB 2.800 . 3.800 3.367 3.148 3.618 . 0 0 "[ . 1 . 2]" 1
946 1 73 ASN HA 1 76 ILE MD 2.800 . 3.800 2.287 2.137 2.600 . 0 0 "[ . 1 . 2]" 1
947 1 73 ASN HA 1 76 ILE HG13 3.100 . 4.300 2.938 2.522 3.510 . 0 0 "[ . 1 . 2]" 1
948 1 73 ASN HB2 1 73 ASN HD21 2.900 . 3.900 2.923 2.368 3.621 . 0 0 "[ . 1 . 2]" 1
949 1 73 ASN HB2 1 74 THR H 3.100 . 4.300 3.901 3.790 4.034 . 0 0 "[ . 1 . 2]" 1
950 1 73 ASN HB3 1 73 ASN HD21 3.000 . 4.100 3.413 2.547 3.621 . 0 0 "[ . 1 . 2]" 1
951 1 73 ASN HB3 1 74 THR H 3.000 . 4.100 2.663 2.507 2.908 . 0 0 "[ . 1 . 2]" 1
952 1 73 ASN HD21 1 76 ILE MD 3.300 . 4.700 2.629 1.896 4.301 0.004 11 0 "[ . 1 . 2]" 1
953 1 73 ASN HD21 1 76 ILE HG13 3.700 . 5.500 4.360 3.183 5.440 . 0 0 "[ . 1 . 2]" 1
954 1 73 ASN HD21 1 76 ILE MG 3.700 . 5.400 4.293 3.577 5.331 . 0 0 "[ . 1 . 2]" 1
955 1 73 ASN HD22 1 76 ILE MG 3.500 . 5.100 4.451 3.917 4.959 . 0 0 "[ . 1 . 2]" 1
956 1 74 THR H 1 74 THR HB 2.600 . 3.400 2.635 2.456 2.761 . 0 0 "[ . 1 . 2]" 1
957 1 74 THR H 1 74 THR MG 3.000 . 4.200 3.730 3.710 3.748 . 0 0 "[ . 1 . 2]" 1
958 1 74 THR H 1 75 VAL MG2 3.200 . 4.500 3.873 3.646 4.015 . 0 0 "[ . 1 . 2]" 1
959 1 74 THR H 1 76 ILE HG13 3.700 . 5.500 5.083 4.692 5.506 0.006 6 0 "[ . 1 . 2]" 1
960 1 74 THR HA 1 74 THR MG 2.600 . 3.500 2.310 2.250 2.380 . 0 0 "[ . 1 . 2]" 1
961 1 74 THR HB 1 75 VAL H 2.800 . 3.800 2.520 2.438 2.612 . 0 0 "[ . 1 . 2]" 1
962 1 74 THR HB 1 75 VAL MG2 3.200 . 4.500 3.170 3.101 3.260 . 0 0 "[ . 1 . 2]" 1
963 1 74 THR MG 1 75 VAL H 3.100 . 4.300 3.545 3.313 3.725 . 0 0 "[ . 1 . 2]" 1
964 1 74 THR MG 1 75 VAL HA 3.400 . 4.900 3.705 3.372 3.992 . 0 0 "[ . 1 . 2]" 1
965 1 74 THR MG 1 78 TYR QD 2.900 . 4.000 2.929 2.537 3.173 . 0 0 "[ . 1 . 2]" 1
966 1 74 THR MG 1 78 TYR QE 2.500 . 3.300 2.234 2.035 2.514 . 0 0 "[ . 1 . 2]" 1
967 1 75 VAL H 1 75 VAL HB 2.600 . 3.400 2.659 2.563 2.755 . 0 0 "[ . 1 . 2]" 1
968 1 75 VAL H 1 75 VAL MG2 2.600 . 3.400 1.822 1.779 1.902 0.021 11 0 "[ . 1 . 2]" 1
969 1 75 VAL H 1 76 ILE H 2.900 . 3.900 2.793 2.746 2.877 . 0 0 "[ . 1 . 2]" 1
970 1 75 VAL HA 1 75 VAL MG1 2.700 . 3.600 2.294 2.259 2.317 . 0 0 "[ . 1 . 2]" 1
971 1 75 VAL HA 1 75 VAL MG2 2.700 . 3.600 2.435 2.414 2.456 . 0 0 "[ . 1 . 2]" 1
972 1 75 VAL HA 1 78 TYR H 3.000 . 4.100 3.501 3.373 3.668 . 0 0 "[ . 1 . 2]" 1
973 1 75 VAL HA 1 78 TYR HB2 3.000 . 4.200 3.090 2.670 3.330 . 0 0 "[ . 1 . 2]" 1
974 1 75 VAL HA 1 78 TYR QD 3.100 . 4.300 2.908 2.341 4.112 . 0 0 "[ . 1 . 2]" 1
975 1 75 VAL HA 1 79 ILE MD 3.500 . 5.000 4.514 4.395 4.672 . 0 0 "[ . 1 . 2]" 1
976 1 75 VAL HB 1 76 ILE H 2.900 . 4.000 2.533 2.312 2.654 . 0 0 "[ . 1 . 2]" 1
977 1 75 VAL HB 1 79 ILE MD 3.700 . 5.400 3.856 3.540 4.213 . 0 0 "[ . 1 . 2]" 1
978 1 75 VAL HB 1 111 ILE MD 3.200 . 4.500 3.622 3.385 4.119 . 0 0 "[ . 1 . 2]" 1
979 1 75 VAL MG1 1 76 ILE H 2.900 . 3.900 3.547 3.236 3.754 . 0 0 "[ . 1 . 2]" 1
980 1 75 VAL MG1 1 78 TYR HB2 3.300 . 4.700 3.678 3.413 3.876 . 0 0 "[ . 1 . 2]" 1
981 1 75 VAL MG1 1 79 ILE H 3.200 . 4.500 3.974 3.702 4.294 . 0 0 "[ . 1 . 2]" 1
982 1 75 VAL MG1 1 79 ILE MD 2.400 . 3.100 2.182 2.051 2.408 . 0 0 "[ . 1 . 2]" 1
983 1 75 VAL MG1 1 79 ILE HG12 3.000 . 4.100 3.703 3.437 4.071 . 0 0 "[ . 1 . 2]" 1
984 1 75 VAL MG1 1 79 ILE HG13 3.400 . 4.900 2.757 2.426 3.170 . 0 0 "[ . 1 . 2]" 1
985 1 75 VAL MG2 1 76 ILE H 3.100 . 4.300 3.683 3.552 3.809 . 0 0 "[ . 1 . 2]" 1
986 1 75 VAL MG2 1 79 ILE MD 3.400 . 4.900 4.474 4.324 4.755 . 0 0 "[ . 1 . 2]" 1
987 1 76 ILE H 1 76 ILE HB 2.500 . 3.300 2.613 2.529 2.681 . 0 0 "[ . 1 . 2]" 1
988 1 76 ILE H 1 76 ILE MD 2.900 . 4.000 3.448 3.364 3.565 . 0 0 "[ . 1 . 2]" 1
989 1 76 ILE H 1 76 ILE HG13 2.900 . 3.900 1.902 1.857 2.039 0.043 7 0 "[ . 1 . 2]" 1
990 1 76 ILE H 1 77 SER H 2.900 . 3.900 2.696 2.565 2.793 . 0 0 "[ . 1 . 2]" 1
991 1 76 ILE HA 1 76 ILE MD 3.300 . 4.600 3.829 3.782 3.843 . 0 0 "[ . 1 . 2]" 1
992 1 76 ILE HA 1 76 ILE MG 2.600 . 3.500 2.312 2.301 2.326 . 0 0 "[ . 1 . 2]" 1
993 1 76 ILE HA 1 79 ILE H 3.200 . 4.500 3.329 3.239 3.470 . 0 0 "[ . 1 . 2]" 1
994 1 76 ILE HA 1 79 ILE HB 2.800 . 3.800 2.689 2.548 2.900 . 0 0 "[ . 1 . 2]" 1
995 1 76 ILE HA 1 79 ILE MD 2.700 . 3.600 2.531 2.315 2.742 . 0 0 "[ . 1 . 2]" 1
996 1 76 ILE HA 1 80 GLU H 3.300 . 4.600 3.594 3.491 3.899 . 0 0 "[ . 1 . 2]" 1
997 1 76 ILE HB 1 76 ILE MD 2.600 . 3.500 2.280 2.252 2.371 . 0 0 "[ . 1 . 2]" 1
998 1 76 ILE HB 1 77 SER H 2.600 . 3.500 2.637 2.564 2.696 . 0 0 "[ . 1 . 2]" 1
999 1 76 ILE MD 1 76 ILE MG 2.400 . 3.200 1.956 1.915 1.993 . 0 0 "[ . 1 . 2]" 1
1000 1 76 ILE MG 1 77 SER H 2.900 . 4.000 3.598 3.465 3.752 . 0 0 "[ . 1 . 2]" 1
1001 1 76 ILE MG 1 77 SER HA 3.200 . 4.500 3.653 3.491 3.867 . 0 0 "[ . 1 . 2]" 1
1002 1 76 ILE MG 1 80 GLU HB2 3.300 . 4.700 3.312 3.160 3.824 . 0 0 "[ . 1 . 2]" 1
1003 1 76 ILE MG 1 80 GLU HG2 3.200 . 4.400 3.311 2.433 3.816 . 0 0 "[ . 1 . 2]" 1
1004 1 76 ILE MG 1 80 GLU HG3 3.100 . 4.300 2.303 2.169 2.731 . 0 0 "[ . 1 . 2]" 1
1005 1 77 SER H 1 77 SER QB 2.400 . 3.100 2.370 2.209 2.627 . 0 0 "[ . 1 . 2]" 1
1006 1 77 SER H 1 78 TYR H 2.700 . 3.600 2.729 2.647 2.771 . 0 0 "[ . 1 . 2]" 1
1007 1 77 SER HA 1 80 GLU HB2 3.200 . 4.500 3.061 2.863 3.167 . 0 0 "[ . 1 . 2]" 1
1008 1 77 SER HA 1 81 SER H 3.200 . 4.500 3.802 3.704 4.078 . 0 0 "[ . 1 . 2]" 1
1009 1 77 SER QB 1 78 TYR H 2.900 . 3.900 2.835 2.647 3.492 . 0 0 "[ . 1 . 2]" 1
1010 1 78 TYR H 1 78 TYR HB2 2.500 . 3.300 2.294 2.221 2.344 . 0 0 "[ . 1 . 2]" 1
1011 1 78 TYR H 1 78 TYR QD 3.100 . 4.300 2.574 1.981 2.961 . 0 0 "[ . 1 . 2]" 1
1012 1 78 TYR H 1 79 ILE H 2.800 . 3.800 2.468 2.417 2.509 . 0 0 "[ . 1 . 2]" 1
1013 1 78 TYR H 1 79 ILE HB 3.700 . 5.500 4.678 4.598 4.728 . 0 0 "[ . 1 . 2]" 1
1014 1 78 TYR H 1 79 ILE HG12 3.700 . 5.500 5.591 5.561 5.615 0.115 10 0 "[ . 1 . 2]" 1
1015 1 78 TYR H 1 80 GLU HB2 3.700 . 5.500 5.200 5.008 5.335 . 0 0 "[ . 1 . 2]" 1
1016 1 78 TYR HA 1 78 TYR QD 2.900 . 3.900 2.663 2.330 3.067 . 0 0 "[ . 1 . 2]" 1
1017 1 78 TYR HA 1 81 SER H 3.200 . 4.500 3.747 3.488 3.828 . 0 0 "[ . 1 . 2]" 1
1018 1 78 TYR HA 1 81 SER HB2 3.000 . 4.200 2.589 2.555 2.637 . 0 0 "[ . 1 . 2]" 1
1019 1 78 TYR HA 1 81 SER HB3 3.000 . 4.100 4.130 4.081 4.165 0.065 15 0 "[ . 1 . 2]" 1
1020 1 78 TYR HA 1 82 ASN H 3.300 . 4.600 3.848 3.536 4.298 . 0 0 "[ . 1 . 2]" 1
1021 1 78 TYR HB2 1 79 ILE H 3.100 . 4.300 2.741 2.613 2.877 . 0 0 "[ . 1 . 2]" 1
1022 1 78 TYR QD 1 89 THR MG 3.000 . 4.100 2.439 2.126 3.222 . 0 0 "[ . 1 . 2]" 1
1023 1 78 TYR QD 1 93 LEU MD2 3.500 . 5.000 3.568 3.076 4.283 . 0 0 "[ . 1 . 2]" 1
1024 1 78 TYR QD 1 104 THR MG 3.300 . 4.600 3.742 3.140 4.230 . 0 0 "[ . 1 . 2]" 1
1025 1 78 TYR QE 1 89 THR MG 3.300 . 4.700 3.789 3.469 4.520 . 0 0 "[ . 1 . 2]" 1
1026 1 78 TYR QE 1 92 LEU MD1 3.300 . 4.700 3.270 2.287 4.487 . 0 0 "[ . 1 . 2]" 1
1027 1 78 TYR QE 1 93 LEU MD2 3.000 . 4.100 2.470 2.100 3.306 . 0 0 "[ . 1 . 2]" 1
1028 1 78 TYR QE 1 93 LEU HG 3.700 . 5.500 3.302 2.341 3.918 . 0 0 "[ . 1 . 2]" 1
1029 1 78 TYR QE 1 104 THR MG 2.800 . 3.800 2.966 2.269 3.687 . 0 0 "[ . 1 . 2]" 1
1030 1 79 ILE H 1 79 ILE HB 2.600 . 3.500 2.501 2.463 2.544 . 0 0 "[ . 1 . 2]" 1
1031 1 79 ILE H 1 79 ILE MD 2.900 . 4.000 3.447 3.400 3.501 . 0 0 "[ . 1 . 2]" 1
1032 1 79 ILE H 1 79 ILE HG12 2.700 . 3.600 3.400 3.301 3.476 . 0 0 "[ . 1 . 2]" 1
1033 1 79 ILE H 1 79 ILE HG13 3.000 . 4.100 2.068 1.962 2.145 . 0 0 "[ . 1 . 2]" 1
1034 1 79 ILE H 1 79 ILE MG 3.400 . 4.800 3.746 3.741 3.755 . 0 0 "[ . 1 . 2]" 1
1035 1 79 ILE H 1 80 GLU H 2.900 . 4.000 2.713 2.691 2.740 . 0 0 "[ . 1 . 2]" 1
1036 1 79 ILE HA 1 79 ILE HG13 3.000 . 4.100 2.948 2.911 2.992 . 0 0 "[ . 1 . 2]" 1
1037 1 79 ILE HA 1 79 ILE MG 2.700 . 3.600 2.314 2.292 2.332 . 0 0 "[ . 1 . 2]" 1
1038 1 79 ILE HA 1 82 ASN H 3.400 . 4.800 3.500 3.417 3.557 . 0 0 "[ . 1 . 2]" 1
1039 1 79 ILE HA 1 82 ASN HB2 3.300 . 4.700 3.722 3.337 4.723 0.023 19 0 "[ . 1 . 2]" 1
1040 1 79 ILE HA 1 83 ARG H 3.300 . 4.700 4.392 4.031 4.769 0.069 6 0 "[ . 1 . 2]" 1
1041 1 79 ILE HB 1 79 ILE MD 2.800 . 3.800 2.327 2.295 2.354 . 0 0 "[ . 1 . 2]" 1
1042 1 79 ILE HB 1 80 GLU H 2.700 . 3.600 2.332 2.273 2.544 . 0 0 "[ . 1 . 2]" 1
1043 1 79 ILE MD 1 79 ILE MG 2.400 . 3.100 1.847 1.814 1.882 . 0 0 "[ . 1 . 2]" 1
1044 1 79 ILE HG12 1 79 ILE MG 2.700 . 3.600 2.347 2.329 2.376 . 0 0 "[ . 1 . 2]" 1
1045 1 79 ILE MG 1 80 GLU H 3.100 . 4.300 3.230 3.138 3.460 . 0 0 "[ . 1 . 2]" 1
1046 1 79 ILE MG 1 80 GLU HA 3.300 . 4.700 3.378 3.299 3.506 . 0 0 "[ . 1 . 2]" 1
1047 1 79 ILE MG 1 80 GLU HG3 3.500 . 5.000 4.065 3.726 5.031 0.031 8 0 "[ . 1 . 2]" 1
1048 1 79 ILE MG 1 81 SER H 3.400 . 4.900 4.950 4.854 4.981 0.081 19 0 "[ . 1 . 2]" 1
1049 1 79 ILE MG 1 83 ARG H 3.200 . 4.500 4.334 4.054 4.585 0.085 6 0 "[ . 1 . 2]" 1
1050 1 79 ILE MG 1 83 ARG QD 3.200 . 4.500 3.304 2.676 4.075 . 0 0 "[ . 1 . 2]" 1
1051 1 80 GLU H 1 80 GLU HB2 2.800 . 3.800 2.359 2.329 2.386 . 0 0 "[ . 1 . 2]" 1
1052 1 80 GLU H 1 80 GLU HG2 3.000 . 4.100 3.348 2.360 3.696 . 0 0 "[ . 1 . 2]" 1
1053 1 80 GLU H 1 80 GLU HG3 2.800 . 3.800 2.631 2.336 3.596 . 0 0 "[ . 1 . 2]" 1
1054 1 80 GLU HA 1 80 GLU HG3 2.900 . 4.000 3.030 2.786 3.655 . 0 0 "[ . 1 . 2]" 1
1055 1 80 GLU HA 1 83 ARG HB2 3.200 . 4.500 3.222 2.898 4.524 0.024 15 0 "[ . 1 . 2]" 1
1056 1 80 GLU HA 1 83 ARG QD 3.300 . 4.700 3.012 2.312 4.746 0.046 16 0 "[ . 1 . 2]" 1
1057 1 80 GLU HA 1 83 ARG HG2 3.400 . 4.800 4.608 3.474 4.847 0.047 4 0 "[ . 1 . 2]" 1
1058 1 80 GLU HA 1 83 ARG HG3 3.400 . 4.800 3.333 2.823 4.816 0.016 15 0 "[ . 1 . 2]" 1
1059 1 80 GLU HB2 1 81 SER H 2.900 . 3.900 2.601 2.541 2.696 . 0 0 "[ . 1 . 2]" 1
1060 1 80 GLU HB3 1 81 SER H 3.000 . 4.100 3.437 3.380 3.541 . 0 0 "[ . 1 . 2]" 1
1061 1 80 GLU HB3 1 82 ASN H 3.700 . 5.500 5.556 5.513 5.602 0.102 20 0 "[ . 1 . 2]" 1
1062 1 81 SER H 1 81 SER HB2 2.700 . 3.600 2.408 2.368 2.474 . 0 0 "[ . 1 . 2]" 1
1063 1 81 SER H 1 81 SER HB3 2.700 . 3.600 3.572 3.566 3.576 . 0 0 "[ . 1 . 2]" 1
1064 1 81 SER H 1 82 ASN H 2.800 . 3.800 2.684 2.647 2.761 . 0 0 "[ . 1 . 2]" 1
1065 1 81 SER H 1 83 ARG H 3.200 . 4.500 4.142 4.012 4.327 . 0 0 "[ . 1 . 2]" 1
1066 1 81 SER HA 1 84 LYS HB2 3.000 . 4.100 3.258 2.527 3.652 . 0 0 "[ . 1 . 2]" 1
1067 1 81 SER HB2 1 82 ASN H 3.000 . 4.100 2.509 2.412 2.686 . 0 0 "[ . 1 . 2]" 1
1068 1 81 SER HB2 1 82 ASN HB3 3.300 . 4.700 4.704 4.371 4.812 0.112 14 0 "[ . 1 . 2]" 1
1069 1 81 SER HB2 1 89 THR MG 3.200 . 4.500 3.542 2.706 4.486 . 0 0 "[ . 1 . 2]" 1
1070 1 82 ASN H 1 82 ASN HB2 2.800 . 3.700 2.808 2.568 3.586 . 0 0 "[ . 1 . 2]" 1
1071 1 82 ASN H 1 82 ASN HB3 2.600 . 3.500 2.391 2.284 2.435 . 0 0 "[ . 1 . 2]" 1
1072 1 82 ASN H 1 82 ASN HD21 3.300 . 4.700 4.443 3.405 4.770 0.070 2 0 "[ . 1 . 2]" 1
1073 1 82 ASN H 1 83 ARG H 2.800 . 3.800 2.772 2.715 2.838 . 0 0 "[ . 1 . 2]" 1
1074 1 82 ASN H 1 84 LYS H 3.400 . 4.900 4.198 4.158 4.279 . 0 0 "[ . 1 . 2]" 1
1075 1 82 ASN H 1 89 THR MG 3.100 . 4.300 3.748 3.171 4.263 . 0 0 "[ . 1 . 2]" 1
1076 1 82 ASN HA 1 85 ASN H 3.200 . 4.500 3.417 3.186 3.636 . 0 0 "[ . 1 . 2]" 1
1077 1 82 ASN HA 1 89 THR MG 3.100 . 4.300 3.522 3.032 4.075 . 0 0 "[ . 1 . 2]" 1
1078 1 82 ASN HB2 1 83 ARG H 2.900 . 4.000 4.016 3.979 4.045 0.045 14 0 "[ . 1 . 2]" 1
1079 1 82 ASN HB2 1 89 THR MG 3.100 . 4.300 2.851 2.458 4.162 . 0 0 "[ . 1 . 2]" 1
1080 1 82 ASN HB3 1 89 THR MG 2.900 . 4.000 3.886 3.171 4.028 0.028 16 0 "[ . 1 . 2]" 1
1081 1 83 ARG H 1 83 ARG HB2 2.800 . 3.800 2.491 2.347 3.437 . 0 0 "[ . 1 . 2]" 1
1082 1 83 ARG H 1 83 ARG QD 3.300 . 4.700 3.866 3.568 4.360 . 0 0 "[ . 1 . 2]" 1
1083 1 83 ARG H 1 83 ARG HG2 2.800 . 3.800 3.288 2.149 3.669 . 0 0 "[ . 1 . 2]" 1
1084 1 83 ARG H 1 83 ARG HG3 3.100 . 4.300 2.446 1.895 4.222 0.005 11 0 "[ . 1 . 2]" 1
1085 1 83 ARG H 1 84 LYS H 2.700 . 3.600 2.622 2.541 2.731 . 0 0 "[ . 1 . 2]" 1
1086 1 83 ARG H 1 85 ASN H 3.200 . 4.500 4.176 3.913 4.345 . 0 0 "[ . 1 . 2]" 1
1087 1 83 ARG HA 1 83 ARG QD 3.300 . 4.600 3.915 2.311 4.262 . 0 0 "[ . 1 . 2]" 1
1088 1 83 ARG HA 1 83 ARG HG2 2.900 . 4.000 2.524 2.330 3.729 . 0 0 "[ . 1 . 2]" 1
1089 1 83 ARG HB2 1 83 ARG QD 3.000 . 4.100 2.651 2.314 3.547 . 0 0 "[ . 1 . 2]" 1
1090 1 83 ARG HG3 1 84 LYS H 3.500 . 5.000 4.342 3.387 4.925 . 0 0 "[ . 1 . 2]" 1
1091 1 84 LYS H 1 84 LYS HB2 2.600 . 3.400 2.458 2.225 2.700 . 0 0 "[ . 1 . 2]" 1
1092 1 84 LYS H 1 84 LYS HD2 3.700 . 5.500 4.612 2.658 5.520 0.020 5 0 "[ . 1 . 2]" 1
1093 1 84 LYS H 1 84 LYS HG2 3.400 . 4.900 3.858 1.884 4.691 0.016 12 0 "[ . 1 . 2]" 1
1094 1 84 LYS H 1 84 LYS HG3 3.300 . 4.600 3.948 2.373 4.614 0.014 13 0 "[ . 1 . 2]" 1
1095 1 84 LYS H 1 85 ASN H 2.600 . 3.400 2.538 2.393 2.686 . 0 0 "[ . 1 . 2]" 1
1096 1 84 LYS HA 1 84 LYS HD2 3.000 . 4.100 3.475 2.319 4.328 0.228 15 0 "[ . 1 . 2]" 1
1097 1 84 LYS HA 1 84 LYS HD3 3.500 . 5.000 3.639 2.321 4.649 . 0 0 "[ . 1 . 2]" 1
1098 1 84 LYS HA 1 84 LYS HG3 2.900 . 3.900 2.862 2.344 3.790 . 0 0 "[ . 1 . 2]" 1
1099 1 84 LYS HB2 1 85 ASN H 2.800 . 3.800 3.293 2.419 3.802 0.002 19 0 "[ . 1 . 2]" 1
1100 1 84 LYS HB3 1 85 ASN H 3.000 . 4.100 2.953 2.402 3.863 . 0 0 "[ . 1 . 2]" 1
1101 1 85 ASN H 1 85 ASN HB2 3.000 . 4.100 3.585 2.928 4.002 . 0 0 "[ . 1 . 2]" 1
1102 1 85 ASN H 1 85 ASN HD21 3.300 . 4.700 3.763 1.878 4.719 0.022 14 0 "[ . 1 . 2]" 1
1103 1 85 ASN HA 1 87 LYS H 3.100 . 4.300 3.769 3.431 4.167 . 0 0 "[ . 1 . 2]" 1
1104 1 85 ASN HB2 1 88 GLN HB2 3.300 . 4.700 3.686 2.435 4.601 . 0 0 "[ . 1 . 2]" 1
1105 1 85 ASN HB2 1 88 GLN HB3 3.100 . 4.300 3.785 2.588 4.321 0.021 16 0 "[ . 1 . 2]" 1
1106 1 85 ASN HB3 1 85 ASN HD21 3.000 . 4.100 3.152 2.302 3.620 . 0 0 "[ . 1 . 2]" 1
1107 1 85 ASN HD21 1 88 GLN HB2 3.400 . 4.800 3.841 1.983 4.806 0.017 15 0 "[ . 1 . 2]" 1
1108 1 85 ASN HD21 1 88 GLN HB3 3.300 . 4.700 3.635 2.065 4.703 0.003 19 0 "[ . 1 . 2]" 1
1109 1 86 ASN H 1 86 ASN HB2 2.900 . 3.900 2.848 2.359 3.603 . 0 0 "[ . 1 . 2]" 1
1110 1 86 ASN H 1 86 ASN HB3 3.000 . 4.100 2.961 2.420 3.609 . 0 0 "[ . 1 . 2]" 1
1111 1 86 ASN HB2 1 86 ASN HD21 3.000 . 4.100 3.027 2.262 3.621 . 0 0 "[ . 1 . 2]" 1
1112 1 86 ASN HB2 1 87 LYS H 3.400 . 4.900 3.477 2.439 4.006 . 0 0 "[ . 1 . 2]" 1
1113 1 86 ASN HB3 1 87 LYS H 3.700 . 5.400 3.488 2.346 4.155 . 0 0 "[ . 1 . 2]" 1
1114 1 87 LYS H 1 87 LYS HB2 2.600 . 3.400 2.547 2.065 3.566 0.166 3 0 "[ . 1 . 2]" 1
1115 1 87 LYS H 1 87 LYS HB3 2.700 . 3.600 3.511 2.507 3.595 . 0 0 "[ . 1 . 2]" 1
1116 1 87 LYS H 1 87 LYS QD 3.300 . 4.700 3.622 1.811 4.352 0.089 17 0 "[ . 1 . 2]" 1
1117 1 87 LYS H 1 87 LYS HG2 2.700 . 3.600 3.081 1.804 3.700 0.100 17 0 "[ . 1 . 2]" 1
1118 1 87 LYS H 1 87 LYS HG3 3.100 . 4.300 2.535 1.937 4.317 0.017 18 0 "[ . 1 . 2]" 1
1119 1 87 LYS H 1 88 GLN H 2.600 . 3.400 2.739 2.522 2.870 . 0 0 "[ . 1 . 2]" 1
1120 1 87 LYS HA 1 87 LYS QD 3.000 . 4.100 3.609 2.134 4.359 0.259 3 0 "[ . 1 . 2]" 1
1121 1 87 LYS HA 1 87 LYS HG3 3.000 . 4.100 3.161 2.493 3.852 . 0 0 "[ . 1 . 2]" 1
1122 1 87 LYS HA 1 90 ILE H 3.200 . 4.500 3.731 3.627 3.889 . 0 0 "[ . 1 . 2]" 1
1123 1 87 LYS HA 1 90 ILE MD 2.800 . 3.800 2.613 2.302 2.997 . 0 0 "[ . 1 . 2]" 1
1124 1 87 LYS HA 1 91 HIS H 3.600 . 5.200 4.648 4.269 5.029 . 0 0 "[ . 1 . 2]" 1
1125 1 87 LYS HB2 1 87 LYS QD 2.600 . 3.500 2.781 2.315 3.309 . 0 0 "[ . 1 . 2]" 1
1126 1 87 LYS HB2 1 88 GLN H 2.700 . 3.600 2.765 2.402 3.516 . 0 0 "[ . 1 . 2]" 1
1127 1 87 LYS HB3 1 87 LYS QD 2.900 . 4.000 2.515 2.281 3.315 . 0 0 "[ . 1 . 2]" 1
1128 1 87 LYS HB3 1 88 GLN H 2.800 . 3.800 3.671 2.865 3.827 0.027 3 0 "[ . 1 . 2]" 1
1129 1 88 GLN H 1 88 GLN HB2 2.600 . 3.400 2.561 2.409 2.715 . 0 0 "[ . 1 . 2]" 1
1130 1 88 GLN H 1 88 GLN HB3 2.700 . 3.600 2.537 2.392 2.684 . 0 0 "[ . 1 . 2]" 1
1131 1 88 GLN H 1 88 GLN HG2 3.500 . 5.000 4.520 4.359 4.662 . 0 0 "[ . 1 . 2]" 1
1132 1 88 GLN H 1 88 GLN HG3 3.600 . 5.300 4.459 4.448 4.470 . 0 0 "[ . 1 . 2]" 1
1133 1 88 GLN H 1 89 THR H 2.700 . 3.600 2.532 2.477 2.586 . 0 0 "[ . 1 . 2]" 1
1134 1 88 GLN H 1 90 ILE H 3.300 . 4.700 4.191 4.028 4.480 . 0 0 "[ . 1 . 2]" 1
1135 1 88 GLN HA 1 91 HIS HB2 3.000 . 4.100 2.923 2.345 3.557 . 0 0 "[ . 1 . 2]" 1
1136 1 88 GLN HA 1 91 HIS HB3 2.900 . 4.000 3.213 2.442 4.035 0.035 20 0 "[ . 1 . 2]" 1
1137 1 88 GLN HB3 1 89 THR H 2.900 . 3.900 2.698 2.546 2.839 . 0 0 "[ . 1 . 2]" 1
1138 1 88 GLN HG3 1 89 THR H 3.200 . 4.500 4.308 4.024 4.533 0.033 2 0 "[ . 1 . 2]" 1
1139 1 88 GLN HG3 1 92 LEU MD1 3.100 . 4.300 3.493 2.131 4.328 0.028 17 0 "[ . 1 . 2]" 1
1140 1 89 THR H 1 89 THR HB 2.600 . 3.400 2.730 2.586 2.783 . 0 0 "[ . 1 . 2]" 1
1141 1 89 THR H 1 89 THR MG 3.100 . 4.300 3.714 3.695 3.743 . 0 0 "[ . 1 . 2]" 1
1142 1 89 THR H 1 90 ILE H 2.900 . 3.900 2.751 2.689 2.826 . 0 0 "[ . 1 . 2]" 1
1143 1 89 THR H 1 90 ILE HB 3.600 . 5.200 4.915 4.810 4.991 . 0 0 "[ . 1 . 2]" 1
1144 1 89 THR H 1 90 ILE MD 3.700 . 5.400 5.136 5.069 5.238 . 0 0 "[ . 1 . 2]" 1
1145 1 89 THR HA 1 89 THR MG 2.700 . 3.600 2.264 2.231 2.312 . 0 0 "[ . 1 . 2]" 1
1146 1 89 THR HA 1 91 HIS H 3.700 . 5.500 4.458 4.191 4.944 . 0 0 "[ . 1 . 2]" 1
1147 1 89 THR HA 1 92 LEU HB2 3.100 . 4.300 3.299 2.795 3.605 . 0 0 "[ . 1 . 2]" 1
1148 1 89 THR HA 1 92 LEU HB3 3.400 . 4.800 4.624 3.326 4.855 0.055 4 0 "[ . 1 . 2]" 1
1149 1 89 THR HA 1 92 LEU MD1 2.900 . 4.000 2.436 2.171 3.612 . 0 0 "[ . 1 . 2]" 1
1150 1 89 THR HB 1 90 ILE H 3.000 . 4.100 2.613 2.359 2.874 . 0 0 "[ . 1 . 2]" 1
1151 1 89 THR MG 1 90 ILE H 3.200 . 4.500 3.726 3.396 3.926 . 0 0 "[ . 1 . 2]" 1
1152 1 89 THR MG 1 90 ILE HA 3.300 . 4.700 3.862 3.520 4.017 . 0 0 "[ . 1 . 2]" 1
1153 1 89 THR MG 1 93 LEU MD1 2.700 . 3.600 3.135 2.417 3.527 . 0 0 "[ . 1 . 2]" 1
1154 1 89 THR MG 1 93 LEU MD2 3.200 . 4.500 3.884 3.368 4.323 . 0 0 "[ . 1 . 2]" 1
1155 1 90 ILE H 1 90 ILE HB 2.500 . 3.300 2.443 2.367 2.496 . 0 0 "[ . 1 . 2]" 1
1156 1 90 ILE H 1 90 ILE MD 2.900 . 3.900 3.403 3.326 3.451 . 0 0 "[ . 1 . 2]" 1
1157 1 90 ILE H 1 90 ILE MG 3.000 . 4.100 3.744 3.730 3.751 . 0 0 "[ . 1 . 2]" 1
1158 1 90 ILE H 1 91 HIS H 2.900 . 3.900 2.586 2.479 2.741 . 0 0 "[ . 1 . 2]" 1
1159 1 90 ILE H 1 92 LEU H 3.500 . 5.000 4.133 3.804 4.312 . 0 0 "[ . 1 . 2]" 1
1160 1 90 ILE H 1 93 LEU MD1 3.400 . 4.800 4.516 3.848 4.812 0.012 7 0 "[ . 1 . 2]" 1
1161 1 90 ILE HA 1 90 ILE MD 3.000 . 4.100 3.822 3.809 3.840 . 0 0 "[ . 1 . 2]" 1
1162 1 90 ILE HA 1 90 ILE MG 2.800 . 3.800 2.356 2.325 2.403 . 0 0 "[ . 1 . 2]" 1
1163 1 90 ILE HA 1 93 LEU H 3.100 . 4.300 3.480 3.218 3.703 . 0 0 "[ . 1 . 2]" 1
1164 1 90 ILE HA 1 93 LEU HB2 3.500 . 5.000 3.318 2.425 3.556 . 0 0 "[ . 1 . 2]" 1
1165 1 90 ILE HA 1 93 LEU MD1 3.000 . 4.100 2.310 2.126 2.471 . 0 0 "[ . 1 . 2]" 1
1166 1 90 ILE HB 1 90 ILE MD 2.700 . 3.600 2.295 2.246 2.331 . 0 0 "[ . 1 . 2]" 1
1167 1 90 ILE HB 1 91 HIS H 3.000 . 4.100 2.637 2.311 2.735 . 0 0 "[ . 1 . 2]" 1
1168 1 90 ILE MD 1 90 ILE MG 2.400 . 3.100 1.870 1.821 1.936 . 0 0 "[ . 1 . 2]" 1
1169 1 90 ILE HG12 1 90 ILE MG 2.800 . 3.700 2.321 2.304 2.333 . 0 0 "[ . 1 . 2]" 1
1170 1 90 ILE MG 1 91 HIS H 3.100 . 4.300 3.402 3.106 3.542 . 0 0 "[ . 1 . 2]" 1
1171 1 90 ILE MG 1 91 HIS HA 3.400 . 4.900 3.418 3.256 3.541 . 0 0 "[ . 1 . 2]" 1
1172 1 90 ILE MG 1 94 LYS QB 3.300 . 4.700 4.290 3.311 4.762 0.062 3 0 "[ . 1 . 2]" 1
1173 1 90 ILE MG 1 94 LYS HD2 3.200 . 4.400 3.959 2.652 4.480 0.080 17 0 "[ . 1 . 2]" 1
1174 1 90 ILE MG 1 94 LYS HE3 3.100 . 4.300 3.320 2.527 4.377 0.077 7 0 "[ . 1 . 2]" 1
1175 1 90 ILE MG 1 94 LYS HG2 3.100 . 4.300 3.112 2.456 4.281 . 0 0 "[ . 1 . 2]" 1
1176 1 91 HIS H 1 91 HIS HB2 2.700 . 3.600 2.396 2.300 2.583 . 0 0 "[ . 1 . 2]" 1
1177 1 91 HIS H 1 91 HIS HB3 2.600 . 3.400 2.890 2.493 3.555 0.155 2 0 "[ . 1 . 2]" 1
1178 1 91 HIS H 1 92 LEU H 2.700 . 3.600 2.728 2.590 2.827 . 0 0 "[ . 1 . 2]" 1
1179 1 91 HIS H 1 92 LEU HB2 3.500 . 5.000 4.870 4.612 5.039 0.039 3 0 "[ . 1 . 2]" 1
1180 1 91 HIS HA 1 94 LYS H 3.200 . 4.500 3.347 3.120 3.646 . 0 0 "[ . 1 . 2]" 1
1181 1 91 HIS HA 1 94 LYS QB 2.800 . 3.800 2.806 2.323 3.913 0.113 11 0 "[ . 1 . 2]" 1
1182 1 91 HIS HB3 1 92 LEU H 3.000 . 4.100 2.889 2.436 3.635 . 0 0 "[ . 1 . 2]" 1
1183 1 92 LEU H 1 92 LEU HB2 2.600 . 3.400 2.455 2.215 2.669 . 0 0 "[ . 1 . 2]" 1
1184 1 92 LEU H 1 92 LEU HB3 2.700 . 3.600 3.510 2.873 3.623 0.023 11 0 "[ . 1 . 2]" 1
1185 1 92 LEU H 1 92 LEU MD1 3.100 . 4.300 3.395 1.990 4.249 . 0 0 "[ . 1 . 2]" 1
1186 1 92 LEU H 1 92 LEU MD2 3.400 . 4.900 3.495 2.826 4.233 . 0 0 "[ . 1 . 2]" 1
1187 1 92 LEU H 1 92 LEU HG 3.300 . 4.700 2.449 1.863 4.153 0.037 13 0 "[ . 1 . 2]" 1
1188 1 92 LEU H 1 93 LEU H 2.700 . 3.600 2.729 2.404 2.860 . 0 0 "[ . 1 . 2]" 1
1189 1 92 LEU HA 1 92 LEU MD1 3.100 . 4.300 3.747 2.639 3.852 . 0 0 "[ . 1 . 2]" 1
1190 1 92 LEU HA 1 92 LEU MD2 2.900 . 4.000 2.286 2.098 3.690 . 0 0 "[ . 1 . 2]" 1
1191 1 92 LEU HA 1 95 ARG H 3.400 . 4.800 3.440 3.120 3.692 . 0 0 "[ . 1 . 2]" 1
1192 1 92 LEU HA 1 95 ARG QD 3.200 . 4.400 3.090 2.084 4.396 . 0 0 "[ . 1 . 2]" 1
1193 1 92 LEU HB2 1 92 LEU MD1 2.800 . 3.800 2.294 2.254 2.431 . 0 0 "[ . 1 . 2]" 1
1194 1 92 LEU HB2 1 93 LEU H 2.900 . 4.000 2.727 2.489 3.477 . 0 0 "[ . 1 . 2]" 1
1195 1 92 LEU MD1 1 93 LEU H 3.700 . 5.400 4.423 3.973 4.603 . 0 0 "[ . 1 . 2]" 1
1196 1 92 LEU MD2 1 93 LEU H 3.700 . 5.500 4.557 3.439 4.850 . 0 0 "[ . 1 . 2]" 1
1197 1 92 LEU MD2 1 95 ARG QD 2.900 . 3.900 3.211 2.377 4.037 0.137 11 0 "[ . 1 . 2]" 1
1198 1 93 LEU H 1 93 LEU HB2 2.600 . 3.500 2.583 2.272 2.679 . 0 0 "[ . 1 . 2]" 1
1199 1 93 LEU H 1 93 LEU HB3 2.900 . 4.000 3.594 3.549 3.614 . 0 0 "[ . 1 . 2]" 1
1200 1 93 LEU H 1 93 LEU MD1 3.100 . 4.300 3.347 3.181 3.493 . 0 0 "[ . 1 . 2]" 1
1201 1 93 LEU H 1 93 LEU MD2 3.000 . 4.100 3.276 2.929 3.992 . 0 0 "[ . 1 . 2]" 1
1202 1 93 LEU H 1 93 LEU HG 3.000 . 4.100 1.974 1.833 2.680 0.067 3 0 "[ . 1 . 2]" 1
1203 1 93 LEU H 1 94 LYS H 2.800 . 3.800 2.575 2.393 2.697 . 0 0 "[ . 1 . 2]" 1
1204 1 93 LEU H 1 94 LYS HG2 3.300 . 4.700 4.236 3.893 4.756 0.056 16 0 "[ . 1 . 2]" 1
1205 1 93 LEU HA 1 93 LEU MD1 3.600 . 5.200 3.869 3.784 3.897 . 0 0 "[ . 1 . 2]" 1
1206 1 93 LEU HA 1 93 LEU MD2 2.700 . 3.600 2.219 2.170 2.265 . 0 0 "[ . 1 . 2]" 1
1207 1 93 LEU HA 1 96 LEU H 3.300 . 4.600 3.533 3.223 3.923 . 0 0 "[ . 1 . 2]" 1
1208 1 93 LEU HA 1 96 LEU HB2 3.400 . 4.800 3.154 2.444 4.118 . 0 0 "[ . 1 . 2]" 1
1209 1 93 LEU HA 1 96 LEU MD1 2.900 . 3.900 2.854 2.312 3.330 . 0 0 "[ . 1 . 2]" 1
1210 1 93 LEU HA 1 96 LEU HG 3.100 . 4.300 3.591 2.491 4.328 0.028 1 0 "[ . 1 . 2]" 1
1211 1 93 LEU HA 1 101 LEU MD2 3.100 . 4.300 4.114 3.206 4.396 0.096 5 0 "[ . 1 . 2]" 1
1212 1 93 LEU HB2 1 93 LEU MD2 2.700 . 3.600 3.196 3.173 3.204 . 0 0 "[ . 1 . 2]" 1
1213 1 93 LEU HB2 1 94 LYS H 2.600 . 3.400 2.880 2.769 3.006 . 0 0 "[ . 1 . 2]" 1
1214 1 93 LEU HB3 1 93 LEU MD1 3.100 . 4.300 2.485 2.362 2.590 . 0 0 "[ . 1 . 2]" 1
1215 1 93 LEU HB3 1 93 LEU MD2 2.900 . 4.000 2.240 2.207 2.274 . 0 0 "[ . 1 . 2]" 1
1216 1 93 LEU HB3 1 94 LYS H 3.000 . 4.100 3.946 3.479 4.027 . 0 0 "[ . 1 . 2]" 1
1217 1 93 LEU HB3 1 101 LEU MD2 3.100 . 4.300 3.100 2.569 3.545 . 0 0 "[ . 1 . 2]" 1
1218 1 93 LEU MD1 1 94 LYS H 3.200 . 4.500 4.542 4.456 4.585 0.085 19 0 "[ . 1 . 2]" 1
1219 1 93 LEU MD2 1 94 LYS H 3.400 . 4.900 4.705 4.530 4.861 . 0 0 "[ . 1 . 2]" 1
1220 1 93 LEU MD2 1 96 LEU MD1 2.800 . 3.800 3.012 2.316 3.723 . 0 0 "[ . 1 . 2]" 1
1221 1 93 LEU MD2 1 96 LEU HG 3.700 . 5.500 4.677 3.869 5.244 . 0 0 "[ . 1 . 2]" 1
1222 1 93 LEU MD2 1 101 LEU HB2 3.700 . 5.500 4.630 4.151 5.072 . 0 0 "[ . 1 . 2]" 1
1223 1 93 LEU MD2 1 101 LEU MD2 2.400 . 3.100 2.443 2.042 3.074 . 0 0 "[ . 1 . 2]" 1
1224 1 93 LEU MD2 1 104 THR MG 3.000 . 4.100 2.987 2.467 3.453 . 0 0 "[ . 1 . 2]" 1
1225 1 94 LYS H 1 94 LYS QB 2.700 . 3.600 2.471 2.302 2.709 . 0 0 "[ . 1 . 2]" 1
1226 1 94 LYS H 1 94 LYS HD2 3.500 . 5.000 4.631 3.576 5.009 0.009 9 0 "[ . 1 . 2]" 1
1227 1 94 LYS H 1 94 LYS HG2 2.900 . 3.900 2.330 2.007 2.786 . 0 0 "[ . 1 . 2]" 1
1228 1 94 LYS H 1 95 ARG H 2.700 . 3.600 2.518 2.397 2.630 . 0 0 "[ . 1 . 2]" 1
1229 1 94 LYS H 1 95 ARG HG2 3.700 . 5.400 4.383 3.709 5.066 . 0 0 "[ . 1 . 2]" 1
1230 1 94 LYS HA 1 94 LYS HE2 3.200 . 4.500 4.186 2.337 4.539 0.039 6 0 "[ . 1 . 2]" 1
1231 1 94 LYS HA 1 94 LYS HG2 2.900 . 3.900 2.765 2.539 3.650 . 0 0 "[ . 1 . 2]" 1
1232 1 94 LYS HA 1 95 ARG HG2 3.700 . 5.500 5.455 5.217 5.600 0.100 11 0 "[ . 1 . 2]" 1
1233 1 94 LYS QB 1 94 LYS HD2 2.600 . 3.500 2.598 2.299 3.383 . 0 0 "[ . 1 . 2]" 1
1234 1 94 LYS QB 1 94 LYS HD3 3.100 . 4.300 2.674 2.286 3.440 . 0 0 "[ . 1 . 2]" 1
1235 1 94 LYS QB 1 94 LYS HE2 3.100 . 4.300 3.628 2.130 4.415 0.115 14 0 "[ . 1 . 2]" 1
1236 1 94 LYS QB 1 94 LYS HE3 2.900 . 3.900 3.815 3.242 4.081 0.181 14 0 "[ . 1 . 2]" 1
1237 1 94 LYS HE3 1 94 LYS HG3 3.000 . 4.100 3.111 2.344 4.195 0.095 12 0 "[ . 1 . 2]" 1
1238 1 94 LYS HG2 1 95 ARG H 3.300 . 4.700 4.314 2.591 4.687 . 0 0 "[ . 1 . 2]" 1
1239 1 95 ARG H 1 95 ARG HB2 2.700 . 3.600 2.869 2.269 3.626 0.026 15 0 "[ . 1 . 2]" 1
1240 1 95 ARG H 1 95 ARG HB3 2.600 . 3.400 3.286 2.468 3.592 0.192 13 0 "[ . 1 . 2]" 1
1241 1 95 ARG H 1 95 ARG HG3 3.000 . 4.100 2.714 1.918 3.650 . 0 0 "[ . 1 . 2]" 1
1242 1 95 ARG H 1 96 LEU H 2.600 . 3.400 2.473 2.343 2.539 . 0 0 "[ . 1 . 2]" 1
1243 1 95 ARG H 1 96 LEU HG 3.500 . 5.000 3.921 3.437 4.649 . 0 0 "[ . 1 . 2]" 1
1244 1 95 ARG HA 1 95 ARG QD 3.300 . 4.700 3.851 2.308 4.583 . 0 0 "[ . 1 . 2]" 1
1245 1 95 ARG HA 1 95 ARG HG3 2.900 . 4.000 3.563 3.343 3.767 . 0 0 "[ . 1 . 2]" 1
1246 1 95 ARG HB2 1 95 ARG QD 3.000 . 4.100 2.907 2.321 3.607 . 0 0 "[ . 1 . 2]" 1
1247 1 95 ARG HB3 1 95 ARG QD 2.800 . 3.800 2.528 2.239 3.056 . 0 0 "[ . 1 . 2]" 1
1248 1 95 ARG HB3 1 96 LEU H 3.200 . 4.400 4.026 3.733 4.162 . 0 0 "[ . 1 . 2]" 1
1249 1 96 LEU H 1 96 LEU HB2 2.600 . 3.500 2.535 2.279 2.709 . 0 0 "[ . 1 . 2]" 1
1250 1 96 LEU H 1 96 LEU HB3 2.900 . 4.000 3.625 3.561 3.671 . 0 0 "[ . 1 . 2]" 1
1251 1 96 LEU H 1 96 LEU MD1 3.100 . 4.300 3.582 3.337 3.684 . 0 0 "[ . 1 . 2]" 1
1252 1 96 LEU H 1 96 LEU MD2 3.200 . 4.500 3.326 2.734 4.053 . 0 0 "[ . 1 . 2]" 1
1253 1 96 LEU H 1 96 LEU HG 2.500 . 3.300 2.284 1.931 2.824 . 0 0 "[ . 1 . 2]" 1
1254 1 96 LEU H 1 97 PRO HD2 3.400 . 4.900 4.933 4.900 5.002 0.102 17 0 "[ . 1 . 2]" 1
1255 1 96 LEU HA 1 96 LEU MD2 2.600 . 3.400 2.173 2.142 2.249 . 0 0 "[ . 1 . 2]" 1
1256 1 96 LEU HA 1 97 PRO HD2 2.800 . 3.800 2.430 2.313 2.484 . 0 0 "[ . 1 . 2]" 1
1257 1 96 LEU HA 1 97 PRO HD3 3.000 . 4.100 2.336 2.319 2.350 . 0 0 "[ . 1 . 2]" 1
1258 1 96 LEU HB2 1 96 LEU MD1 2.900 . 3.900 2.329 2.216 2.442 . 0 0 "[ . 1 . 2]" 1
1259 1 96 LEU HB2 1 97 PRO HD2 3.400 . 4.900 3.833 3.586 4.732 . 0 0 "[ . 1 . 2]" 1
1260 1 96 LEU HB3 1 97 PRO HD2 3.400 . 4.900 2.460 2.309 3.668 . 0 0 "[ . 1 . 2]" 1
1261 1 96 LEU HB3 1 101 LEU H 3.300 . 4.600 3.994 3.274 4.613 0.013 8 0 "[ . 1 . 2]" 1
1262 1 96 LEU MD1 1 101 LEU HA 3.200 . 4.400 3.875 3.228 4.385 . 0 0 "[ . 1 . 2]" 1
1263 1 96 LEU MD2 1 97 PRO HD2 3.100 . 4.300 2.978 2.256 3.739 . 0 0 "[ . 1 . 2]" 1
1264 1 96 LEU MD2 1 97 PRO HD3 3.000 . 4.100 3.529 3.006 3.874 . 0 0 "[ . 1 . 2]" 1
1265 1 97 PRO HB2 1 98 ALA MB 3.100 . 4.300 4.249 4.045 4.401 0.101 17 0 "[ . 1 . 2]" 1
1266 1 97 PRO HB2 1 100 VAL H 3.300 . 4.700 3.229 2.789 3.420 . 0 0 "[ . 1 . 2]" 1
1267 1 97 PRO HB2 1 100 VAL MG2 3.100 . 4.300 3.893 2.954 4.137 . 0 0 "[ . 1 . 2]" 1
1268 1 97 PRO HB3 1 99 ASP H 3.200 . 4.500 3.920 3.254 4.029 . 0 0 "[ . 1 . 2]" 1
1269 1 97 PRO HB3 1 100 VAL H 3.300 . 4.700 4.634 4.504 4.730 0.030 8 0 "[ . 1 . 2]" 1
1270 1 97 PRO HD2 1 100 VAL HB 3.200 . 4.500 2.478 2.342 3.095 . 0 0 "[ . 1 . 2]" 1
1271 1 97 PRO HD2 1 100 VAL MG2 3.100 . 4.300 2.755 2.442 3.076 . 0 0 "[ . 1 . 2]" 1
1272 1 97 PRO HD3 1 100 VAL MG2 2.900 . 4.000 3.857 3.724 3.972 . 0 0 "[ . 1 . 2]" 1
1273 1 97 PRO HG2 1 99 ASP H 3.100 . 4.300 3.505 3.228 4.450 0.150 17 0 "[ . 1 . 2]" 1
1274 1 97 PRO HG2 1 100 VAL MG2 2.700 . 3.600 2.290 2.178 3.008 . 0 0 "[ . 1 . 2]" 1
1275 1 97 PRO HG3 1 100 VAL MG2 3.100 . 4.300 3.146 2.820 4.338 0.038 18 0 "[ . 1 . 2]" 1
1276 1 98 ALA HA 1 101 LEU HB2 2.900 . 4.000 2.770 2.345 3.719 . 0 0 "[ . 1 . 2]" 1
1277 1 98 ALA HA 1 101 LEU HB3 2.700 . 3.600 2.340 2.319 2.453 . 0 0 "[ . 1 . 2]" 1
1278 1 98 ALA HA 1 101 LEU MD1 3.100 . 4.300 2.930 2.601 3.819 . 0 0 "[ . 1 . 2]" 1
1279 1 98 ALA HA 1 102 LYS H 3.400 . 4.800 3.764 3.475 4.041 . 0 0 "[ . 1 . 2]" 1
1280 1 98 ALA MB 1 99 ASP H 2.600 . 3.500 2.950 2.887 3.000 . 0 0 "[ . 1 . 2]" 1
1281 1 98 ALA MB 1 99 ASP HA 2.900 . 4.000 3.908 3.865 3.929 . 0 0 "[ . 1 . 2]" 1
1282 1 98 ALA MB 1 99 ASP HB3 3.700 . 5.400 5.132 4.872 5.422 0.022 6 0 "[ . 1 . 2]" 1
1283 1 99 ASP H 1 99 ASP HB2 2.800 . 3.800 2.589 2.464 2.660 . 0 0 "[ . 1 . 2]" 1
1284 1 99 ASP H 1 99 ASP HB3 2.800 . 3.700 2.994 2.437 3.604 . 0 0 "[ . 1 . 2]" 1
1285 1 99 ASP H 1 100 VAL H 2.700 . 3.600 2.560 2.533 2.603 . 0 0 "[ . 1 . 2]" 1
1286 1 99 ASP H 1 100 VAL MG2 3.300 . 4.600 4.246 3.812 4.367 . 0 0 "[ . 1 . 2]" 1
1287 1 99 ASP HA 1 102 LYS H 3.200 . 4.500 3.929 3.839 4.099 . 0 0 "[ . 1 . 2]" 1
1288 1 99 ASP HA 1 102 LYS HB3 3.100 . 4.300 3.896 3.690 4.063 . 0 0 "[ . 1 . 2]" 1
1289 1 99 ASP HB3 1 100 VAL H 3.500 . 5.000 3.168 2.495 3.890 . 0 0 "[ . 1 . 2]" 1
1290 1 100 VAL H 1 100 VAL HB 2.600 . 3.400 2.428 2.372 2.661 . 0 0 "[ . 1 . 2]" 1
1291 1 100 VAL H 1 100 VAL MG2 2.400 . 3.100 2.409 2.011 2.528 . 0 0 "[ . 1 . 2]" 1
1292 1 100 VAL H 1 101 LEU H 2.600 . 3.500 2.220 2.155 2.347 . 0 0 "[ . 1 . 2]" 1
1293 1 100 VAL H 1 101 LEU HB3 3.200 . 4.500 4.543 4.309 4.654 0.154 15 0 "[ . 1 . 2]" 1
1294 1 100 VAL H 1 101 LEU MD1 3.700 . 5.500 5.615 5.579 5.679 0.179 8 0 "[ . 1 . 2]" 1
1295 1 100 VAL HA 1 100 VAL MG1 2.400 . 3.200 2.370 2.275 2.408 . 0 0 "[ . 1 . 2]" 1
1296 1 100 VAL HA 1 100 VAL MG2 2.700 . 3.600 2.364 2.341 2.453 . 0 0 "[ . 1 . 2]" 1
1297 1 100 VAL HA 1 101 LEU HB3 3.700 . 5.500 5.746 5.614 5.812 0.312 19 0 "[ . 1 . 2]" 1
1298 1 100 VAL HA 1 103 LYS H 3.100 . 4.300 3.378 3.324 3.450 . 0 0 "[ . 1 . 2]" 1
1299 1 100 VAL HA 1 103 LYS QB 2.900 . 4.000 3.072 2.667 3.335 . 0 0 "[ . 1 . 2]" 1
1300 1 100 VAL HA 1 103 LYS QD 3.100 . 4.300 3.439 2.478 4.397 0.097 9 0 "[ . 1 . 2]" 1
1301 1 100 VAL HB 1 101 LEU H 2.800 . 3.800 2.730 2.581 2.816 . 0 0 "[ . 1 . 2]" 1
1302 1 100 VAL MG1 1 101 LEU H 3.300 . 4.600 3.502 3.372 3.743 . 0 0 "[ . 1 . 2]" 1
1303 1 100 VAL MG1 1 103 LYS H 3.500 . 5.000 4.274 4.184 4.463 . 0 0 "[ . 1 . 2]" 1
1304 1 100 VAL MG1 1 103 LYS QB 3.300 . 4.600 3.173 3.053 3.350 . 0 0 "[ . 1 . 2]" 1
1305 1 100 VAL MG1 1 104 THR H 3.200 . 4.500 3.836 3.655 4.139 . 0 0 "[ . 1 . 2]" 1
1306 1 100 VAL MG2 1 101 LEU H 3.400 . 4.800 3.859 3.534 3.927 . 0 0 "[ . 1 . 2]" 1
1307 1 101 LEU H 1 101 LEU HB2 3.000 . 4.100 2.234 2.085 2.552 . 0 0 "[ . 1 . 2]" 1
1308 1 101 LEU H 1 101 LEU HB3 2.600 . 3.500 2.663 2.370 2.799 . 0 0 "[ . 1 . 2]" 1
1309 1 101 LEU H 1 101 LEU MD1 3.000 . 4.100 4.082 3.976 4.138 0.038 5 0 "[ . 1 . 2]" 1
1310 1 101 LEU H 1 101 LEU MD2 3.000 . 4.100 4.112 4.021 4.193 0.093 16 0 "[ . 1 . 2]" 1
1311 1 101 LEU HA 1 101 LEU MD2 2.400 . 3.100 2.289 2.076 2.645 . 0 0 "[ . 1 . 2]" 1
1312 1 101 LEU HA 1 104 THR HB 3.000 . 4.100 2.869 2.633 3.280 . 0 0 "[ . 1 . 2]" 1
1313 1 101 LEU HA 1 105 ILE MD 3.700 . 5.400 4.711 4.546 5.045 . 0 0 "[ . 1 . 2]" 1
1314 1 101 LEU HB2 1 101 LEU MD1 2.900 . 4.000 2.605 2.310 3.204 . 0 0 "[ . 1 . 2]" 1
1315 1 101 LEU HB2 1 101 LEU MD2 3.000 . 4.100 2.965 2.417 3.202 . 0 0 "[ . 1 . 2]" 1
1316 1 101 LEU HB2 1 102 LYS H 3.000 . 4.100 3.592 3.449 3.896 . 0 0 "[ . 1 . 2]" 1
1317 1 101 LEU HB2 1 104 THR H 3.700 . 5.500 5.569 5.505 5.606 0.106 17 0 "[ . 1 . 2]" 1
1318 1 101 LEU HB2 1 105 ILE MD 3.500 . 5.000 5.153 5.037 5.360 0.360 9 0 "[ . 1 . 2]" 1
1319 1 101 LEU HB3 1 101 LEU MD1 2.800 . 3.800 2.305 2.212 2.382 . 0 0 "[ . 1 . 2]" 1
1320 1 101 LEU HB3 1 102 LYS H 2.900 . 3.900 2.416 2.332 2.546 . 0 0 "[ . 1 . 2]" 1
1321 1 101 LEU MD1 1 102 LYS H 3.600 . 5.200 3.806 2.610 4.364 . 0 0 "[ . 1 . 2]" 1
1322 1 101 LEU MD2 1 102 LYS H 3.300 . 4.700 3.650 3.355 4.168 . 0 0 "[ . 1 . 2]" 1
1323 1 101 LEU MD2 1 104 THR HB 3.000 . 4.100 2.619 2.342 3.089 . 0 0 "[ . 1 . 2]" 1
1324 1 102 LYS H 1 102 LYS HB2 2.600 . 3.500 2.333 2.283 2.552 . 0 0 "[ . 1 . 2]" 1
1325 1 102 LYS H 1 102 LYS HB3 2.600 . 3.400 2.761 2.517 2.821 . 0 0 "[ . 1 . 2]" 1
1326 1 102 LYS H 1 102 LYS HG3 3.300 . 4.700 4.286 4.228 4.424 . 0 0 "[ . 1 . 2]" 1
1327 1 102 LYS H 1 103 LYS H 2.800 . 3.800 2.741 2.704 2.765 . 0 0 "[ . 1 . 2]" 1
1328 1 102 LYS H 1 105 ILE MD 3.700 . 5.500 4.295 4.121 4.739 . 0 0 "[ . 1 . 2]" 1
1329 1 102 LYS HA 1 102 LYS QD 3.200 . 4.500 4.028 3.729 4.127 . 0 0 "[ . 1 . 2]" 1
1330 1 102 LYS HA 1 102 LYS HG3 2.800 . 3.800 2.508 2.329 2.605 . 0 0 "[ . 1 . 2]" 1
1331 1 102 LYS HA 1 105 ILE H 3.100 . 4.300 3.509 3.373 3.620 . 0 0 "[ . 1 . 2]" 1
1332 1 102 LYS HA 1 105 ILE HB 3.100 . 4.300 2.945 2.752 3.144 . 0 0 "[ . 1 . 2]" 1
1333 1 102 LYS HA 1 105 ILE MD 3.100 . 4.300 2.412 2.302 2.828 . 0 0 "[ . 1 . 2]" 1
1334 1 102 LYS HB3 1 102 LYS QD 3.000 . 4.100 2.434 2.246 3.084 . 0 0 "[ . 1 . 2]" 1
1335 1 102 LYS HB3 1 102 LYS HE2 3.300 . 4.700 3.739 2.318 4.540 . 0 0 "[ . 1 . 2]" 1
1336 1 102 LYS HB3 1 102 LYS HE3 3.300 . 4.700 3.672 2.323 4.710 0.010 7 0 "[ . 1 . 2]" 1
1337 1 102 LYS HB3 1 103 LYS H 2.800 . 3.800 2.756 2.674 2.869 . 0 0 "[ . 1 . 2]" 1
1338 1 102 LYS HG3 1 103 LYS H 3.700 . 5.500 5.037 4.561 5.132 . 0 0 "[ . 1 . 2]" 1
1339 1 103 LYS H 1 103 LYS QB 2.300 . 2.900 2.472 2.183 2.630 . 0 0 "[ . 1 . 2]" 1
1340 1 103 LYS H 1 103 LYS HG2 3.000 . 4.100 3.140 1.878 4.398 0.298 4 0 "[ . 1 . 2]" 1
1341 1 103 LYS H 1 103 LYS HG3 3.100 . 4.300 2.931 1.849 4.444 0.144 18 0 "[ . 1 . 2]" 1
1342 1 103 LYS H 1 104 THR H 2.800 . 3.800 2.517 2.500 2.560 . 0 0 "[ . 1 . 2]" 1
1343 1 103 LYS H 1 105 ILE H 3.300 . 4.600 4.110 4.033 4.183 . 0 0 "[ . 1 . 2]" 1
1344 1 103 LYS HA 1 103 LYS QD 3.200 . 4.500 3.666 2.145 4.268 . 0 0 "[ . 1 . 2]" 1
1345 1 103 LYS HA 1 103 LYS HG2 3.000 . 4.200 2.790 2.391 3.379 . 0 0 "[ . 1 . 2]" 1
1346 1 103 LYS HA 1 103 LYS HG3 3.000 . 4.100 3.194 2.524 3.845 . 0 0 "[ . 1 . 2]" 1
1347 1 103 LYS HA 1 105 ILE H 3.700 . 5.400 4.381 4.200 4.573 . 0 0 "[ . 1 . 2]" 1
1348 1 103 LYS HA 1 106 LYS H 3.000 . 4.100 3.401 3.264 3.537 . 0 0 "[ . 1 . 2]" 1
1349 1 103 LYS HA 1 106 LYS HB2 3.000 . 4.100 2.877 2.579 3.187 . 0 0 "[ . 1 . 2]" 1
1350 1 103 LYS QB 1 104 THR H 2.700 . 3.600 2.598 2.511 2.665 . 0 0 "[ . 1 . 2]" 1
1351 1 103 LYS QE 1 103 LYS HG3 2.800 . 3.800 2.731 2.352 3.461 . 0 0 "[ . 1 . 2]" 1
1352 1 103 LYS HG2 1 104 THR H 3.300 . 4.600 4.255 3.436 4.738 0.138 12 0 "[ . 1 . 2]" 1
1353 1 104 THR H 1 104 THR HB 2.700 . 3.600 2.623 2.496 2.709 . 0 0 "[ . 1 . 2]" 1
1354 1 104 THR H 1 104 THR MG 3.200 . 4.500 3.738 3.718 3.750 . 0 0 "[ . 1 . 2]" 1
1355 1 104 THR H 1 105 ILE H 2.900 . 3.900 2.692 2.657 2.739 . 0 0 "[ . 1 . 2]" 1
1356 1 104 THR H 1 106 LYS H 3.100 . 4.300 4.082 4.015 4.188 . 0 0 "[ . 1 . 2]" 1
1357 1 104 THR H 1 106 LYS HB2 3.700 . 5.500 5.290 4.977 5.537 0.037 3 0 "[ . 1 . 2]" 1
1358 1 104 THR HA 1 104 THR MG 2.500 . 3.300 2.300 2.254 2.335 . 0 0 "[ . 1 . 2]" 1
1359 1 104 THR HA 1 107 ASN H 3.000 . 4.100 3.673 3.585 3.820 . 0 0 "[ . 1 . 2]" 1
1360 1 104 THR HA 1 107 ASN HB2 3.200 . 4.400 3.070 2.758 3.379 . 0 0 "[ . 1 . 2]" 1
1361 1 104 THR HA 1 107 ASN HB3 3.400 . 4.900 4.703 4.379 4.902 0.002 8 0 "[ . 1 . 2]" 1
1362 1 104 THR HA 1 107 ASN HD21 3.200 . 4.400 3.466 2.909 3.792 . 0 0 "[ . 1 . 2]" 1
1363 1 104 THR HB 1 105 ILE H 3.300 . 4.700 2.583 2.458 2.704 . 0 0 "[ . 1 . 2]" 1
1364 1 104 THR MG 1 105 ILE H 3.100 . 4.300 3.596 3.403 3.776 . 0 0 "[ . 1 . 2]" 1
1365 1 104 THR MG 1 107 ASN H 3.600 . 5.200 4.897 4.786 5.090 . 0 0 "[ . 1 . 2]" 1
1366 1 105 ILE H 1 105 ILE HB 2.500 . 3.300 2.419 2.336 2.520 . 0 0 "[ . 1 . 2]" 1
1367 1 105 ILE H 1 105 ILE MD 3.000 . 4.100 3.403 3.314 3.587 . 0 0 "[ . 1 . 2]" 1
1368 1 105 ILE H 1 105 ILE HG12 3.000 . 4.100 3.612 3.394 3.763 . 0 0 "[ . 1 . 2]" 1
1369 1 105 ILE H 1 105 ILE HG13 2.500 . 3.300 2.247 2.007 2.482 . 0 0 "[ . 1 . 2]" 1
1370 1 105 ILE H 1 105 ILE MG 3.300 . 4.700 3.738 3.723 3.747 . 0 0 "[ . 1 . 2]" 1
1371 1 105 ILE H 1 106 LYS H 2.900 . 4.000 2.608 2.515 2.695 . 0 0 "[ . 1 . 2]" 1
1372 1 105 ILE H 1 107 ASN H 3.500 . 5.000 4.436 4.321 4.553 . 0 0 "[ . 1 . 2]" 1
1373 1 105 ILE HA 1 105 ILE MD 3.300 . 4.700 3.814 3.778 3.841 . 0 0 "[ . 1 . 2]" 1
1374 1 105 ILE HA 1 105 ILE MG 2.800 . 3.800 2.390 2.323 2.482 . 0 0 "[ . 1 . 2]" 1
1375 1 105 ILE HA 1 108 THR H 3.200 . 4.500 3.489 3.408 3.577 . 0 0 "[ . 1 . 2]" 1
1376 1 105 ILE HA 1 108 THR HB 2.900 . 3.900 2.796 2.577 3.037 . 0 0 "[ . 1 . 2]" 1
1377 1 105 ILE HB 1 105 ILE MD 2.800 . 3.800 2.287 2.255 2.330 . 0 0 "[ . 1 . 2]" 1
1378 1 105 ILE HB 1 106 LYS H 2.500 . 3.300 2.738 2.598 2.969 . 0 0 "[ . 1 . 2]" 1
1379 1 105 ILE MG 1 106 LYS H 3.000 . 4.100 3.428 3.327 3.563 . 0 0 "[ . 1 . 2]" 1
1380 1 105 ILE MG 1 106 LYS HA 3.200 . 4.400 3.411 3.326 3.569 . 0 0 "[ . 1 . 2]" 1
1381 1 105 ILE MG 1 106 LYS QG 3.700 . 5.500 4.472 3.497 5.382 . 0 0 "[ . 1 . 2]" 1
1382 1 105 ILE MG 1 107 ASN H 3.700 . 5.500 5.208 5.080 5.331 . 0 0 "[ . 1 . 2]" 1
1383 1 105 ILE MG 1 109 LEU HB2 3.000 . 4.100 4.133 4.051 4.184 0.084 8 0 "[ . 1 . 2]" 1
1384 1 105 ILE MG 1 109 LEU MD1 2.400 . 3.100 2.012 1.932 2.224 . 0 0 "[ . 1 . 2]" 1
1385 1 105 ILE MG 1 109 LEU HG 3.600 . 5.200 2.834 2.648 3.235 . 0 0 "[ . 1 . 2]" 1
1386 1 106 LYS H 1 106 LYS HB2 2.600 . 3.400 2.347 2.224 2.451 . 0 0 "[ . 1 . 2]" 1
1387 1 106 LYS H 1 106 LYS HB3 2.700 . 3.600 3.130 2.688 3.587 . 0 0 "[ . 1 . 2]" 1
1388 1 106 LYS H 1 106 LYS HD2 3.700 . 5.500 4.765 4.315 5.503 0.003 3 0 "[ . 1 . 2]" 1
1389 1 106 LYS H 1 106 LYS QG 3.000 . 4.100 3.254 2.191 4.057 . 0 0 "[ . 1 . 2]" 1
1390 1 106 LYS H 1 108 THR H 3.300 . 4.700 3.842 3.735 3.963 . 0 0 "[ . 1 . 2]" 1
1391 1 106 LYS H 1 109 LEU MD1 3.100 . 4.300 4.215 4.063 4.332 0.032 6 0 "[ . 1 . 2]" 1
1392 1 106 LYS HA 1 106 LYS HD2 3.200 . 4.500 2.902 2.304 3.444 . 0 0 "[ . 1 . 2]" 1
1393 1 106 LYS HA 1 106 LYS HD3 3.100 . 4.300 2.794 2.321 3.513 . 0 0 "[ . 1 . 2]" 1
1394 1 106 LYS HA 1 106 LYS QG 2.900 . 3.900 2.528 2.378 2.649 . 0 0 "[ . 1 . 2]" 1
1395 1 106 LYS HA 1 109 LEU H 3.100 . 4.300 3.398 3.333 3.481 . 0 0 "[ . 1 . 2]" 1
1396 1 106 LYS HA 1 109 LEU HB2 3.100 . 4.300 2.935 2.729 3.088 . 0 0 "[ . 1 . 2]" 1
1397 1 106 LYS HA 1 109 LEU HB3 3.500 . 5.000 4.618 4.379 4.799 . 0 0 "[ . 1 . 2]" 1
1398 1 106 LYS HA 1 109 LEU MD1 2.600 . 3.500 2.559 2.311 2.764 . 0 0 "[ . 1 . 2]" 1
1399 1 106 LYS HA 1 109 LEU HG 3.400 . 4.800 4.028 3.714 4.350 . 0 0 "[ . 1 . 2]" 1
1400 1 106 LYS HB2 1 107 ASN H 2.700 . 3.600 3.006 2.304 3.592 . 0 0 "[ . 1 . 2]" 1
1401 1 106 LYS HB2 1 108 THR H 3.700 . 5.500 5.000 4.616 5.335 . 0 0 "[ . 1 . 2]" 1
1402 1 106 LYS HB3 1 107 ASN H 3.000 . 4.100 2.720 2.173 3.380 . 0 0 "[ . 1 . 2]" 1
1403 1 106 LYS HD3 1 109 LEU MD1 3.000 . 4.200 3.813 3.198 4.231 0.031 7 0 "[ . 1 . 2]" 1
1404 1 106 LYS QE 1 106 LYS QG 2.700 . 3.600 2.318 2.113 2.629 . 0 0 "[ . 1 . 2]" 1
1405 1 106 LYS QG 1 109 LEU MD1 3.200 . 4.500 4.020 3.734 4.422 . 0 0 "[ . 1 . 2]" 1
1406 1 107 ASN H 1 107 ASN HB2 2.600 . 3.500 2.448 2.366 2.847 . 0 0 "[ . 1 . 2]" 1
1407 1 107 ASN H 1 107 ASN HB3 2.900 . 3.900 3.572 3.550 3.579 . 0 0 "[ . 1 . 2]" 1
1408 1 107 ASN H 1 107 ASN HD21 3.200 . 4.500 3.982 3.836 4.119 . 0 0 "[ . 1 . 2]" 1
1409 1 107 ASN H 1 108 THR H 2.900 . 3.900 2.719 2.692 2.748 . 0 0 "[ . 1 . 2]" 1
1410 1 107 ASN H 1 109 LEU H 3.700 . 5.400 4.451 4.398 4.512 . 0 0 "[ . 1 . 2]" 1
1411 1 107 ASN HA 1 107 ASN HD21 3.300 . 4.600 4.452 4.422 4.579 . 0 0 "[ . 1 . 2]" 1
1412 1 107 ASN HA 1 110 ASP HB2 3.000 . 4.100 2.902 2.535 3.286 . 0 0 "[ . 1 . 2]" 1
1413 1 107 ASN HA 1 110 ASP HB3 3.200 . 4.500 3.458 2.765 4.285 . 0 0 "[ . 1 . 2]" 1
1414 1 107 ASN HA 1 111 ILE MD 3.600 . 5.200 4.980 4.491 5.236 0.036 19 0 "[ . 1 . 2]" 1
1415 1 107 ASN HB2 1 107 ASN HD21 2.800 . 3.800 2.468 2.406 2.555 . 0 0 "[ . 1 . 2]" 1
1416 1 107 ASN HB2 1 108 THR H 3.100 . 4.300 3.082 3.032 3.163 . 0 0 "[ . 1 . 2]" 1
1417 1 107 ASN HB2 1 109 LEU H 3.700 . 5.500 5.425 5.377 5.482 . 0 0 "[ . 1 . 2]" 1
1418 1 107 ASN HB3 1 108 THR H 3.200 . 4.500 3.922 3.821 4.261 . 0 0 "[ . 1 . 2]" 1
1419 1 107 ASN HD21 1 108 THR H 3.700 . 5.500 5.489 5.351 5.537 0.037 2 0 "[ . 1 . 2]" 1
1420 1 108 THR H 1 108 THR HB 2.400 . 3.100 2.547 2.415 2.747 . 0 0 "[ . 1 . 2]" 1
1421 1 108 THR H 1 108 THR MG 3.000 . 4.100 3.759 3.733 3.777 . 0 0 "[ . 1 . 2]" 1
1422 1 108 THR H 1 109 LEU H 2.800 . 3.800 2.468 2.428 2.508 . 0 0 "[ . 1 . 2]" 1
1423 1 108 THR H 1 109 LEU HG 3.700 . 5.500 4.313 4.017 4.825 . 0 0 "[ . 1 . 2]" 1
1424 1 108 THR H 1 111 ILE H 3.700 . 5.500 4.961 4.882 5.061 . 0 0 "[ . 1 . 2]" 1
1425 1 108 THR H 1 111 ILE HG13 3.700 . 5.500 5.328 4.910 5.510 0.010 8 0 "[ . 1 . 2]" 1
1426 1 108 THR HA 1 108 THR MG 2.700 . 3.600 2.308 2.273 2.343 . 0 0 "[ . 1 . 2]" 1
1427 1 108 THR HA 1 111 ILE HB 3.000 . 4.100 3.620 3.342 3.866 . 0 0 "[ . 1 . 2]" 1
1428 1 108 THR HA 1 111 ILE MD 2.900 . 4.000 2.393 2.263 2.821 . 0 0 "[ . 1 . 2]" 1
1429 1 108 THR HB 1 109 LEU H 2.700 . 3.600 2.479 2.432 2.519 . 0 0 "[ . 1 . 2]" 1
1430 1 108 THR MG 1 109 LEU H 3.100 . 4.300 3.499 3.284 3.799 . 0 0 "[ . 1 . 2]" 1
1431 1 109 LEU H 1 109 LEU HB2 2.700 . 3.600 2.441 2.267 2.554 . 0 0 "[ . 1 . 2]" 1
1432 1 109 LEU H 1 109 LEU HB3 3.000 . 4.100 3.585 3.545 3.608 . 0 0 "[ . 1 . 2]" 1
1433 1 109 LEU H 1 109 LEU MD1 2.900 . 4.000 3.248 3.169 3.321 . 0 0 "[ . 1 . 2]" 1
1434 1 109 LEU H 1 109 LEU MD2 3.000 . 4.100 3.654 3.367 3.982 . 0 0 "[ . 1 . 2]" 1
1435 1 109 LEU H 1 109 LEU HG 2.600 . 3.500 2.248 1.996 2.662 . 0 0 "[ . 1 . 2]" 1
1436 1 109 LEU H 1 110 ASP H 2.800 . 3.800 2.554 2.472 2.614 . 0 0 "[ . 1 . 2]" 1
1437 1 109 LEU H 1 110 ASP HB2 3.700 . 5.500 4.759 4.644 5.012 . 0 0 "[ . 1 . 2]" 1
1438 1 109 LEU HA 1 109 LEU MD1 3.200 . 4.500 3.853 3.787 3.896 . 0 0 "[ . 1 . 2]" 1
1439 1 109 LEU HA 1 109 LEU MD2 2.600 . 3.400 2.244 2.225 2.267 . 0 0 "[ . 1 . 2]" 1
1440 1 109 LEU HA 1 112 HIS HB2 3.200 . 4.500 3.406 3.035 3.786 . 0 0 "[ . 1 . 2]" 1
1441 1 109 LEU HA 1 112 HIS HB3 3.200 . 4.500 3.021 2.636 4.565 0.065 2 0 "[ . 1 . 2]" 1
1442 1 109 LEU HB2 1 109 LEU MD1 2.500 . 3.300 2.244 2.212 2.288 . 0 0 "[ . 1 . 2]" 1
1443 1 109 LEU HB2 1 109 LEU MD2 2.500 . 3.300 3.186 3.171 3.196 . 0 0 "[ . 1 . 2]" 1
1444 1 109 LEU HB2 1 110 ASP H 2.900 . 4.000 2.867 2.834 2.929 . 0 0 "[ . 1 . 2]" 1
1445 1 109 LEU HB3 1 109 LEU MD2 2.600 . 3.500 2.217 2.208 2.262 . 0 0 "[ . 1 . 2]" 1
1446 1 109 LEU HB3 1 110 ASP H 3.000 . 4.200 3.822 3.638 3.930 . 0 0 "[ . 1 . 2]" 1
1447 1 109 LEU MD1 1 110 ASP H 3.500 . 5.000 4.529 4.448 4.657 . 0 0 "[ . 1 . 2]" 1
1448 1 109 LEU MD2 1 110 ASP H 3.700 . 5.400 4.835 4.742 4.883 . 0 0 "[ . 1 . 2]" 1
1449 1 109 LEU MD2 1 112 HIS HB2 3.700 . 5.400 4.066 3.438 4.581 . 0 0 "[ . 1 . 2]" 1
1450 1 109 LEU MD2 1 113 LYS H 3.700 . 5.500 4.964 4.693 5.302 . 0 0 "[ . 1 . 2]" 1
1451 1 109 LEU HG 1 110 ASP H 3.400 . 4.800 4.374 4.161 4.668 . 0 0 "[ . 1 . 2]" 1
1452 1 110 ASP H 1 110 ASP HB2 2.600 . 3.400 2.452 2.375 2.628 . 0 0 "[ . 1 . 2]" 1
1453 1 110 ASP H 1 110 ASP HB3 2.800 . 3.800 3.055 2.463 3.589 . 0 0 "[ . 1 . 2]" 1
1454 1 110 ASP H 1 111 ILE H 2.900 . 3.900 2.674 2.600 2.750 . 0 0 "[ . 1 . 2]" 1
1455 1 110 ASP HA 1 113 LYS H 3.100 . 4.300 3.677 3.342 3.853 . 0 0 "[ . 1 . 2]" 1
1456 1 110 ASP HA 1 113 LYS HB2 2.900 . 4.000 3.147 2.758 4.020 0.020 8 0 "[ . 1 . 2]" 1
1457 1 110 ASP HA 1 113 LYS HG3 3.200 . 4.400 4.112 2.865 4.459 0.059 7 0 "[ . 1 . 2]" 1
1458 1 110 ASP HB2 1 111 ILE H 3.000 . 4.100 3.364 2.599 4.040 . 0 0 "[ . 1 . 2]" 1
1459 1 110 ASP HB3 1 111 ILE H 3.200 . 4.400 3.148 2.447 3.955 . 0 0 "[ . 1 . 2]" 1
1460 1 111 ILE H 1 111 ILE HB 2.500 . 3.300 2.488 2.422 2.624 . 0 0 "[ . 1 . 2]" 1
1461 1 111 ILE H 1 111 ILE MD 3.300 . 4.700 3.361 3.284 3.475 . 0 0 "[ . 1 . 2]" 1
1462 1 111 ILE H 1 111 ILE HG12 2.900 . 4.000 3.503 3.172 3.649 . 0 0 "[ . 1 . 2]" 1
1463 1 111 ILE H 1 111 ILE HG13 2.500 . 3.300 2.117 1.897 2.252 . 0 0 "[ . 1 . 2]" 1
1464 1 111 ILE H 1 111 ILE MG 3.200 . 4.500 3.747 3.738 3.753 . 0 0 "[ . 1 . 2]" 1
1465 1 111 ILE H 1 112 HIS H 2.800 . 3.800 2.602 2.524 2.786 . 0 0 "[ . 1 . 2]" 1
1466 1 111 ILE HA 1 111 ILE MD 3.300 . 4.600 3.842 3.818 3.853 . 0 0 "[ . 1 . 2]" 1
1467 1 111 ILE HA 1 111 ILE HG12 2.900 . 4.000 2.609 2.553 2.639 . 0 0 "[ . 1 . 2]" 1
1468 1 111 ILE HA 1 111 ILE HG13 2.900 . 3.900 2.880 2.788 3.135 . 0 0 "[ . 1 . 2]" 1
1469 1 111 ILE HA 1 111 ILE MG 2.700 . 3.600 2.328 2.290 2.371 . 0 0 "[ . 1 . 2]" 1
1470 1 111 ILE HA 1 114 SER H 3.100 . 4.300 3.462 3.256 3.682 . 0 0 "[ . 1 . 2]" 1
1471 1 111 ILE HA 1 114 SER HB2 3.100 . 4.300 3.447 2.440 4.319 0.019 15 0 "[ . 1 . 2]" 1
1472 1 111 ILE HB 1 111 ILE MD 2.800 . 3.800 2.303 2.249 2.337 . 0 0 "[ . 1 . 2]" 1
1473 1 111 ILE HB 1 112 HIS H 2.700 . 3.600 2.483 2.365 2.662 . 0 0 "[ . 1 . 2]" 1
1474 1 111 ILE HG13 1 111 ILE MG 2.900 . 3.900 3.185 3.182 3.193 . 0 0 "[ . 1 . 2]" 1
1475 1 111 ILE MG 1 112 HIS H 3.300 . 4.700 3.370 3.194 3.644 . 0 0 "[ . 1 . 2]" 1
1476 1 111 ILE MG 1 112 HIS HA 3.600 . 5.200 3.459 3.318 3.801 . 0 0 "[ . 1 . 2]" 1
1477 1 112 HIS H 1 112 HIS HB2 2.600 . 3.500 2.505 2.288 2.852 . 0 0 "[ . 1 . 2]" 1
1478 1 112 HIS H 1 112 HIS HB3 2.700 . 3.600 2.706 2.465 3.568 . 0 0 "[ . 1 . 2]" 1
1479 1 112 HIS H 1 113 LYS H 2.900 . 4.000 2.701 2.512 2.810 . 0 0 "[ . 1 . 2]" 1
1480 1 112 HIS HA 1 115 ILE MD 3.100 . 4.300 2.502 2.283 2.858 . 0 0 "[ . 1 . 2]" 1
1481 1 112 HIS HA 1 115 ILE HG13 3.300 . 4.600 3.227 2.419 3.599 . 0 0 "[ . 1 . 2]" 1
1482 1 112 HIS HA 1 115 ILE MG 3.200 . 4.500 3.906 3.754 4.118 . 0 0 "[ . 1 . 2]" 1
1483 1 112 HIS HB2 1 113 LYS H 2.800 . 3.800 3.638 2.475 3.859 0.059 7 0 "[ . 1 . 2]" 1
1484 1 112 HIS HB3 1 113 LYS H 3.000 . 4.200 2.617 2.420 3.824 . 0 0 "[ . 1 . 2]" 1
1485 1 113 LYS H 1 113 LYS HB2 2.600 . 3.400 2.493 2.389 2.662 . 0 0 "[ . 1 . 2]" 1
1486 1 113 LYS H 1 113 LYS HB3 2.700 . 3.600 3.290 2.363 3.597 . 0 0 "[ . 1 . 2]" 1
1487 1 113 LYS H 1 113 LYS QD 3.600 . 5.200 3.867 3.432 4.308 . 0 0 "[ . 1 . 2]" 1
1488 1 113 LYS H 1 113 LYS HG2 3.400 . 4.800 3.591 1.979 4.635 0.021 4 0 "[ . 1 . 2]" 1
1489 1 113 LYS H 1 113 LYS HG3 3.300 . 4.600 2.910 2.137 4.634 0.034 14 0 "[ . 1 . 2]" 1
1490 1 113 LYS H 1 114 SER H 2.700 . 3.600 2.615 2.482 2.812 . 0 0 "[ . 1 . 2]" 1
1491 1 113 LYS H 1 115 ILE MG 3.700 . 5.500 5.583 5.507 5.703 0.203 1 0 "[ . 1 . 2]" 1
1492 1 113 LYS HA 1 113 LYS QD 3.300 . 4.700 3.517 2.106 4.189 . 0 0 "[ . 1 . 2]" 1
1493 1 113 LYS HA 1 113 LYS HG3 2.900 . 4.000 3.134 2.745 3.783 . 0 0 "[ . 1 . 2]" 1
1494 1 113 LYS HA 1 116 THR H 3.200 . 4.500 3.417 3.071 3.757 . 0 0 "[ . 1 . 2]" 1
1495 1 113 LYS HA 1 116 THR MG 3.000 . 4.100 3.880 3.032 4.117 0.017 16 0 "[ . 1 . 2]" 1
1496 1 113 LYS HB2 1 113 LYS QE 3.500 . 5.000 3.414 2.142 4.567 . 0 0 "[ . 1 . 2]" 1
1497 1 113 LYS HB2 1 114 SER H 3.500 . 5.000 3.150 2.414 4.148 . 0 0 "[ . 1 . 2]" 1
1498 1 113 LYS HB3 1 114 SER H 3.400 . 4.900 3.558 2.452 3.971 . 0 0 "[ . 1 . 2]" 1
1499 1 113 LYS QE 1 113 LYS HG3 3.000 . 4.100 2.746 2.244 3.551 . 0 0 "[ . 1 . 2]" 1
1500 1 113 LYS HG3 1 114 SER H 3.200 . 4.500 4.392 3.922 4.658 0.158 14 0 "[ . 1 . 2]" 1
1501 1 114 SER H 1 114 SER HB2 2.700 . 3.600 2.832 2.303 3.597 . 0 0 "[ . 1 . 2]" 1
1502 1 114 SER H 1 114 SER HB3 2.800 . 3.800 2.697 2.229 3.596 . 0 0 "[ . 1 . 2]" 1
1503 1 114 SER H 1 115 ILE H 2.600 . 3.400 2.655 2.508 2.806 . 0 0 "[ . 1 . 2]" 1
1504 1 114 SER HA 1 115 ILE MG 3.500 . 5.000 4.798 4.511 5.001 0.001 13 0 "[ . 1 . 2]" 1
1505 1 114 SER HB3 1 115 ILE MG 3.400 . 4.900 3.535 2.721 4.529 . 0 0 "[ . 1 . 2]" 1
1506 1 115 ILE H 1 115 ILE HB 2.800 . 3.800 3.614 3.589 3.676 . 0 0 "[ . 1 . 2]" 1
1507 1 115 ILE H 1 115 ILE HG12 2.800 . 3.800 1.927 1.787 3.063 0.013 14 0 "[ . 1 . 2]" 1
1508 1 115 ILE H 1 115 ILE HG13 2.800 . 3.800 2.863 1.955 3.137 . 0 0 "[ . 1 . 2]" 1
1509 1 115 ILE H 1 115 ILE MG 2.800 . 3.800 2.351 2.184 2.517 . 0 0 "[ . 1 . 2]" 1
1510 1 115 ILE H 1 116 THR H 2.700 . 3.600 2.481 2.253 2.667 . 0 0 "[ . 1 . 2]" 1
1511 1 115 ILE HA 1 115 ILE HG13 3.100 . 4.300 3.699 3.584 3.746 . 0 0 "[ . 1 . 2]" 1
1512 1 115 ILE HA 1 115 ILE MG 2.600 . 3.500 2.275 2.252 2.350 . 0 0 "[ . 1 . 2]" 1
1513 1 115 ILE HB 1 115 ILE MD 2.600 . 3.500 2.305 2.201 2.398 . 0 0 "[ . 1 . 2]" 1
1514 1 115 ILE HB 1 116 THR H 3.000 . 4.100 4.088 3.782 4.354 0.254 9 0 "[ . 1 . 2]" 1
1515 1 115 ILE MD 1 116 THR H 3.300 . 4.700 4.287 2.932 4.898 0.198 9 0 "[ . 1 . 2]" 1
1516 1 115 ILE HG12 1 116 THR H 3.200 . 4.500 3.262 2.419 4.007 . 0 0 "[ . 1 . 2]" 1
1517 1 115 ILE HG13 1 116 THR H 3.200 . 4.500 2.848 2.193 3.543 . 0 0 "[ . 1 . 2]" 1
1518 1 115 ILE MG 1 116 THR H 3.200 . 4.500 4.067 3.860 4.220 . 0 0 "[ . 1 . 2]" 1
1519 1 116 THR H 1 116 THR HB 3.000 . 4.100 3.296 2.449 3.999 . 0 0 "[ . 1 . 2]" 1
1520 1 116 THR H 1 116 THR MG 2.900 . 4.000 3.226 2.074 3.981 . 0 0 "[ . 1 . 2]" 1
1521 1 116 THR H 1 117 ILE MG 3.500 . 5.000 4.618 3.628 5.064 0.064 2 0 "[ . 1 . 2]" 1
1522 1 116 THR HA 1 116 THR MG 2.600 . 3.400 2.416 2.241 3.200 . 0 0 "[ . 1 . 2]" 1
1523 1 116 THR HA 1 117 ILE MG 3.200 . 4.500 3.860 3.033 4.529 0.029 9 0 "[ . 1 . 2]" 1
1524 1 116 THR MG 1 117 ILE H 3.100 . 4.300 3.371 2.376 4.307 0.007 2 0 "[ . 1 . 2]" 1
1525 1 117 ILE H 1 117 ILE HB 2.900 . 3.900 3.547 2.533 3.871 . 0 0 "[ . 1 . 2]" 1
1526 1 117 ILE H 1 117 ILE HG12 3.300 . 4.700 2.768 1.859 4.575 0.041 4 0 "[ . 1 . 2]" 1
1527 1 117 ILE H 1 117 ILE HG13 3.300 . 4.700 3.320 2.286 4.716 0.016 19 0 "[ . 1 . 2]" 1
1528 1 117 ILE H 1 117 ILE MG 2.800 . 3.800 2.538 2.058 3.262 . 0 0 "[ . 1 . 2]" 1
1529 1 117 ILE H 1 118 ASN H 3.100 . 4.300 3.823 2.285 4.417 0.117 15 0 "[ . 1 . 2]" 1
1530 1 117 ILE HA 1 117 ILE HG13 3.000 . 4.100 3.362 2.404 4.250 0.150 16 0 "[ . 1 . 2]" 1
1531 1 117 ILE HA 1 117 ILE MG 2.600 . 3.500 2.546 2.232 3.213 . 0 0 "[ . 1 . 2]" 1
1532 1 117 ILE MG 1 118 ASN H 3.400 . 4.800 3.949 3.420 4.353 . 0 0 "[ . 1 . 2]" 1
1533 1 118 ASN H 1 118 ASN HB3 3.000 . 4.100 3.235 2.503 3.956 . 0 0 "[ . 1 . 2]" 1
1534 1 118 ASN HB3 1 119 ASN H 3.300 . 4.700 3.551 2.140 4.461 . 0 0 "[ . 1 . 2]" 1
1535 1 119 ASN HA 1 120 PRO HD2 2.700 . 3.600 2.393 2.336 2.534 . 0 0 "[ . 1 . 2]" 1
1536 1 119 ASN HA 1 120 PRO HD3 2.800 . 3.800 2.773 2.306 3.078 . 0 0 "[ . 1 . 2]" 1
1537 1 120 PRO HA 1 121 LYS H 2.700 . 3.600 2.756 2.175 3.579 . 0 0 "[ . 1 . 2]" 1
1538 1 120 PRO HB3 1 121 LYS H 3.200 . 4.500 3.769 2.504 4.480 . 0 0 "[ . 1 . 2]" 1
1539 1 121 LYS H 1 121 LYS QD 3.500 . 5.000 4.168 2.836 4.987 . 0 0 "[ . 1 . 2]" 1
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