NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
387122 |
1m60   |
5026 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1m60
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 1461
_Distance_constraint_stats_list.Viol_count 98
_Distance_constraint_stats_list.Viol_total 4.974
_Distance_constraint_stats_list.Viol_max 0.230
_Distance_constraint_stats_list.Viol_rms 0.0166
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0034
_Distance_constraint_stats_list.Viol_average_violations_only 0.0508
_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 1 GLY 0.125 0.089 1 0 "[ ]"
1 2 ASP 0.190 0.089 1 0 "[ ]"
1 3 VAL 0.225 0.148 1 0 "[ ]"
1 4 GLU 0.157 0.051 1 0 "[ ]"
1 5 LYS 0.179 0.092 1 0 "[ ]"
1 6 GLY 0.171 0.099 1 0 "[ ]"
1 7 LYS 0.187 0.116 1 0 "[ ]"
1 8 LYS 0.000 0.000 . 0 "[ ]"
1 9 ILE 0.103 0.052 1 0 "[ ]"
1 10 PHE 0.000 0.000 . 0 "[ ]"
1 11 VAL 0.042 0.042 1 0 "[ ]"
1 12 GLN 0.129 0.052 1 0 "[ ]"
1 13 LYS 0.000 0.000 . 0 "[ ]"
1 14 CYS 0.122 0.080 1 0 "[ ]"
1 15 ALA 0.019 0.019 1 0 "[ ]"
1 16 GLN 0.009 0.009 1 0 "[ ]"
1 17 CYS 0.009 0.009 1 0 "[ ]"
1 18 HIS 0.061 0.042 1 0 "[ ]"
1 19 THR 0.087 0.087 1 0 "[ ]"
1 20 VAL 0.146 0.109 1 0 "[ ]"
1 21 GLU 0.041 0.041 1 0 "[ ]"
1 22 LYS 0.041 0.041 1 0 "[ ]"
1 23 GLY 0.000 0.000 . 0 "[ ]"
1 24 GLY 0.000 0.000 . 0 "[ ]"
1 25 LYS 0.209 0.091 1 0 "[ ]"
1 26 HIS 0.215 0.091 1 0 "[ ]"
1 27 LYS 0.000 0.000 . 0 "[ ]"
1 28 THR 0.000 0.000 . 0 "[ ]"
1 29 GLY 0.000 0.000 . 0 "[ ]"
1 30 PRO 0.070 0.070 1 0 "[ ]"
1 31 ASN 0.038 0.038 1 0 "[ ]"
1 32 LEU 0.087 0.087 1 0 "[ ]"
1 33 HIS 0.109 0.109 1 0 "[ ]"
1 34 GLY 0.000 0.000 . 0 "[ ]"
1 35 LEU 0.087 0.087 1 0 "[ ]"
1 36 PHE 0.022 0.022 1 0 "[ ]"
1 37 GLY 0.000 0.000 . 0 "[ ]"
1 38 ARG 0.046 0.046 1 0 "[ ]"
1 39 LYS 0.000 0.000 . 0 "[ ]"
1 40 THR 0.036 0.020 1 0 "[ ]"
1 41 GLY 0.000 0.000 . 0 "[ ]"
1 42 GLN 0.043 0.043 1 0 "[ ]"
1 43 ALA 0.134 0.083 1 0 "[ ]"
1 44 PRO 0.000 0.000 . 0 "[ ]"
1 45 GLY 0.000 0.000 . 0 "[ ]"
1 46 PHE 0.000 0.000 . 0 "[ ]"
1 47 THR 0.119 0.083 1 0 "[ ]"
1 48 TYR 0.084 0.040 1 0 "[ ]"
1 49 THR 0.048 0.029 1 0 "[ ]"
1 50 ASP 0.091 0.089 1 0 "[ ]"
1 51 ALA 0.117 0.089 1 0 "[ ]"
1 52 ASN 0.088 0.068 1 0 "[ ]"
1 53 LYS 0.233 0.230 1 0 "[ ]"
1 54 ASN 0.172 0.070 1 0 "[ ]"
1 55 LYS 0.070 0.070 1 0 "[ ]"
1 56 GLY 0.051 0.031 1 0 "[ ]"
1 57 ILE 0.090 0.031 1 0 "[ ]"
1 58 THR 0.020 0.020 1 0 "[ ]"
1 59 TRP 0.210 0.153 1 0 "[ ]"
1 60 LYS 0.000 0.000 . 0 "[ ]"
1 61 GLU 0.153 0.153 1 0 "[ ]"
1 62 GLU 0.216 0.090 1 0 "[ ]"
1 63 THR 0.129 0.129 1 0 "[ ]"
1 64 LEU 0.114 0.044 1 0 "[ ]"
1 65 MET 0.255 0.088 1 0 "[ ]"
1 66 GLU 0.383 0.153 1 0 "[ ]"
1 67 TYR 0.082 0.064 1 0 "[ ]"
1 68 LEU 0.022 0.022 1 0 "[ ]"
1 69 GLU 0.000 0.000 . 0 "[ ]"
1 70 ASN 0.000 0.000 . 0 "[ ]"
1 71 PRO 0.022 0.022 1 0 "[ ]"
1 72 LYS 0.000 0.000 . 0 "[ ]"
1 73 LYS 0.000 0.000 . 0 "[ ]"
1 74 TYR 0.064 0.064 1 0 "[ ]"
1 75 ILE 0.000 0.000 . 0 "[ ]"
1 76 PRO 0.035 0.035 1 0 "[ ]"
1 77 GLY 0.035 0.035 1 0 "[ ]"
1 78 THR 0.000 0.000 . 0 "[ ]"
1 79 LYS 0.000 0.000 . 0 "[ ]"
1 80 MET 0.052 0.031 1 0 "[ ]"
1 81 ILE 0.000 0.000 . 0 "[ ]"
1 82 PHE 0.132 0.080 1 0 "[ ]"
1 83 ALA 0.000 0.000 . 0 "[ ]"
1 84 GLY 0.000 0.000 . 0 "[ ]"
1 85 ILE 0.044 0.044 1 0 "[ ]"
1 86 LYS 0.000 0.000 . 0 "[ ]"
1 87 LYS 0.071 0.035 1 0 "[ ]"
1 88 LYS 0.056 0.035 1 0 "[ ]"
1 89 THR 0.009 0.009 1 0 "[ ]"
1 90 GLU 0.180 0.120 1 0 "[ ]"
1 91 ARG 0.136 0.120 1 0 "[ ]"
1 92 GLU 0.312 0.130 1 0 "[ ]"
1 93 ASP 0.036 0.036 1 0 "[ ]"
1 94 LEU 0.229 0.130 1 0 "[ ]"
1 95 ILE 0.115 0.115 1 0 "[ ]"
1 96 ALA 0.000 0.000 . 0 "[ ]"
1 97 TYR 0.282 0.148 1 0 "[ ]"
1 98 LEU 0.123 0.115 1 0 "[ ]"
1 99 LYS 0.151 0.089 1 0 "[ ]"
1 100 LYS 0.000 0.000 . 0 "[ ]"
1 101 ALA 0.000 0.000 . 0 "[ ]"
1 102 THR 0.000 0.000 . 0 "[ ]"
1 103 ASN 0.129 0.076 1 0 "[ ]"
1 104 GLU 0.000 0.000 . 0 "[ ]"
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 1 GLY H1 1 2 ASP H . . 4.000 4.089 4.089 4.089 0.089 1 0 "[ ]" 1
2 1 1 GLY H1 1 93 ASP HA . . 4.300 4.336 4.336 4.336 0.036 1 0 "[ ]" 1
3 1 1 GLY H1 1 96 ALA MB . . 5.700 3.383 3.383 3.383 . 0 0 "[ ]" 1
4 1 1 GLY QA 1 2 ASP QB . . 5.550 3.785 3.785 3.785 . 0 0 "[ ]" 1
5 1 1 GLY QA 1 93 ASP HA . . 3.650 2.360 2.360 2.360 . 0 0 "[ ]" 1
6 1 1 GLY QA 1 93 ASP QB . . 7.750 3.723 3.723 3.723 . 0 0 "[ ]" 1
7 1 1 GLY QA 1 96 ALA H . . 5.080 4.539 4.539 4.539 . 0 0 "[ ]" 1
8 1 1 GLY QA 1 96 ALA MB . . 5.080 3.232 3.232 3.232 . 0 0 "[ ]" 1
9 1 1 GLY HA3 1 2 ASP H . . 3.600 2.484 2.484 2.484 . 0 0 "[ ]" 1
10 1 1 GLY HA3 1 93 ASP HA . . 4.000 2.390 2.390 2.390 . 0 0 "[ ]" 1
11 1 1 GLY HA3 1 96 ALA MB . . 5.400 3.329 3.329 3.329 . 0 0 "[ ]" 1
12 1 2 ASP H 1 2 ASP HB2 . . 3.600 2.441 2.441 2.441 . 0 0 "[ ]" 1
13 1 2 ASP H 1 2 ASP QB . . 3.390 2.406 2.406 2.406 . 0 0 "[ ]" 1
14 1 2 ASP H 1 2 ASP HB3 . . 3.600 3.640 3.640 3.640 0.040 1 0 "[ ]" 1
15 1 2 ASP H 1 3 VAL H . . 4.800 4.459 4.459 4.459 . 0 0 "[ ]" 1
16 1 2 ASP H 1 4 GLU H . . 5.400 5.396 5.396 5.396 . 0 0 "[ ]" 1
17 1 2 ASP H 1 5 LYS QB . . 6.900 3.024 3.024 3.024 . 0 0 "[ ]" 1
18 1 2 ASP H 1 6 GLY H . . 6.000 3.788 3.788 3.788 . 0 0 "[ ]" 1
19 1 2 ASP H 1 93 ASP H . . 5.500 4.397 4.397 4.397 . 0 0 "[ ]" 1
20 1 2 ASP H 1 93 ASP HA . . 3.100 2.208 2.208 2.208 . 0 0 "[ ]" 1
21 1 2 ASP H 1 93 ASP QB . . 6.880 3.461 3.461 3.461 . 0 0 "[ ]" 1
22 1 2 ASP H 1 96 ALA MB . . 6.000 3.148 3.148 3.148 . 0 0 "[ ]" 1
23 1 2 ASP HA 1 3 VAL H . . 3.300 2.320 2.320 2.320 . 0 0 "[ ]" 1
24 1 2 ASP HA 1 3 VAL MG1 . . 6.600 5.531 5.531 5.531 . 0 0 "[ ]" 1
25 1 2 ASP HA 1 4 GLU H . . 4.400 4.136 4.136 4.136 . 0 0 "[ ]" 1
26 1 2 ASP QB 1 3 VAL H . . 4.210 3.164 3.164 3.164 . 0 0 "[ ]" 1
27 1 2 ASP QB 1 4 GLU H . . 6.480 2.985 2.985 2.985 . 0 0 "[ ]" 1
28 1 2 ASP QB 1 5 LYS H . . 4.470 2.462 2.462 2.462 . 0 0 "[ ]" 1
29 1 2 ASP QB 1 5 LYS QB . . 5.430 2.102 2.102 2.102 . 0 0 "[ ]" 1
30 1 2 ASP QB 1 5 LYS QD . . 7.880 2.582 2.582 2.582 . 0 0 "[ ]" 1
31 1 2 ASP QB 1 6 GLY H . . 6.880 3.485 3.485 3.485 . 0 0 "[ ]" 1
32 1 2 ASP QB 1 96 ALA MB . . 6.280 4.164 4.164 4.164 . 0 0 "[ ]" 1
33 1 2 ASP HB2 1 3 VAL H . . 4.500 4.133 4.133 4.133 . 0 0 "[ ]" 1
34 1 2 ASP HB2 1 5 LYS H . . 4.800 2.626 2.626 2.626 . 0 0 "[ ]" 1
35 1 2 ASP HB2 1 5 LYS HA . . 5.500 4.633 4.633 4.633 . 0 0 "[ ]" 1
36 1 2 ASP HB2 1 5 LYS QB . . 5.600 2.116 2.116 2.116 . 0 0 "[ ]" 1
37 1 2 ASP HB3 1 3 VAL H . . 4.500 3.284 3.284 3.284 . 0 0 "[ ]" 1
38 1 2 ASP HB3 1 5 LYS H . . 4.800 2.977 2.977 2.977 . 0 0 "[ ]" 1
39 1 2 ASP HB3 1 5 LYS HA . . 5.500 5.561 5.561 5.561 0.061 1 0 "[ ]" 1
40 1 2 ASP HB3 1 5 LYS QB . . 5.600 3.610 3.610 3.610 . 0 0 "[ ]" 1
41 1 3 VAL H 1 3 VAL HB . . 3.500 2.268 2.268 2.268 . 0 0 "[ ]" 1
42 1 3 VAL H 1 3 VAL MG1 . . 4.300 3.664 3.664 3.664 . 0 0 "[ ]" 1
43 1 3 VAL H 1 3 VAL MG2 . . 4.400 2.288 2.288 2.288 . 0 0 "[ ]" 1
44 1 3 VAL H 1 4 GLU H . . 3.400 2.715 2.715 2.715 . 0 0 "[ ]" 1
45 1 3 VAL H 1 96 ALA MB . . 6.900 3.075 3.075 3.075 . 0 0 "[ ]" 1
46 1 3 VAL H 1 97 TYR HA . . 4.900 4.901 4.901 4.901 0.001 1 0 "[ ]" 1
47 1 3 VAL HA 1 3 VAL MG2 . . 3.700 2.375 2.375 2.375 . 0 0 "[ ]" 1
48 1 3 VAL HA 1 5 LYS H . . 4.600 4.627 4.627 4.627 0.027 1 0 "[ ]" 1
49 1 3 VAL HA 1 6 GLY H . . 4.000 3.312 3.312 3.312 . 0 0 "[ ]" 1
50 1 3 VAL HA 1 6 GLY QA . . 4.780 3.069 3.069 3.069 . 0 0 "[ ]" 1
51 1 3 VAL HA 1 7 LYS H . . 4.000 3.957 3.957 3.957 . 0 0 "[ ]" 1
52 1 3 VAL HA 1 96 ALA MB . . 5.400 2.939 2.939 2.939 . 0 0 "[ ]" 1
53 1 3 VAL HA 1 97 TYR HA . . 3.900 2.544 2.544 2.544 . 0 0 "[ ]" 1
54 1 3 VAL HA 1 97 TYR HD1 . . 4.700 3.772 3.772 3.772 . 0 0 "[ ]" 1
55 1 3 VAL HB 1 4 GLU H . . 3.500 2.742 2.742 2.742 . 0 0 "[ ]" 1
56 1 3 VAL HB 1 4 GLU HA . . 4.500 4.388 4.388 4.388 . 0 0 "[ ]" 1
57 1 3 VAL HB 1 6 GLY H . . 5.400 5.421 5.421 5.421 0.021 1 0 "[ ]" 1
58 1 3 VAL HB 1 97 TYR HA . . 4.300 4.328 4.328 4.328 0.028 1 0 "[ ]" 1
59 1 3 VAL HB 1 97 TYR HD1 . . 4.700 4.848 4.848 4.848 0.148 1 0 "[ ]" 1
60 1 3 VAL MG1 1 4 GLU H . . 4.600 3.345 3.345 3.345 . 0 0 "[ ]" 1
61 1 3 VAL MG1 1 4 GLU HA . . 6.300 3.236 3.236 3.236 . 0 0 "[ ]" 1
62 1 3 VAL MG1 1 4 GLU QB . . 6.380 4.514 4.514 4.514 . 0 0 "[ ]" 1
63 1 3 VAL MG1 1 96 ALA MB . . 6.300 4.379 4.379 4.379 . 0 0 "[ ]" 1
64 1 3 VAL MG1 1 97 TYR H . . 7.000 4.450 4.450 4.450 . 0 0 "[ ]" 1
65 1 3 VAL MG1 1 97 TYR HA . . 5.200 2.208 2.208 2.208 . 0 0 "[ ]" 1
66 1 3 VAL MG1 1 97 TYR HB2 . . 6.000 2.948 2.948 2.948 . 0 0 "[ ]" 1
67 1 3 VAL MG1 1 97 TYR HD1 . . 5.800 2.061 2.061 2.061 . 0 0 "[ ]" 1
68 1 3 VAL MG2 1 4 GLU H . . 5.100 4.079 4.079 4.079 . 0 0 "[ ]" 1
69 1 3 VAL MG2 1 4 GLU HA . . 6.500 5.420 5.420 5.420 . 0 0 "[ ]" 1
70 1 3 VAL MG2 1 96 ALA MB . . 6.600 2.448 2.448 2.448 . 0 0 "[ ]" 1
71 1 3 VAL MG2 1 97 TYR H . . 6.500 3.586 3.586 3.586 . 0 0 "[ ]" 1
72 1 3 VAL MG2 1 97 TYR HA . . 4.300 2.036 2.036 2.036 . 0 0 "[ ]" 1
73 1 3 VAL MG2 1 97 TYR HB2 . . 5.300 3.618 3.618 3.618 . 0 0 "[ ]" 1
74 1 3 VAL MG2 1 97 TYR HD1 . . 5.000 3.853 3.853 3.853 . 0 0 "[ ]" 1
75 1 3 VAL MG2 1 97 TYR HD2 . . 6.900 5.854 5.854 5.854 . 0 0 "[ ]" 1
76 1 3 VAL MG2 1 97 TYR HE1 . . 6.800 5.689 5.689 5.689 . 0 0 "[ ]" 1
77 1 4 GLU H 1 4 GLU HB2 . . 3.500 2.407 2.407 2.407 . 0 0 "[ ]" 1
78 1 4 GLU H 1 4 GLU QB . . 3.240 2.369 2.369 2.369 . 0 0 "[ ]" 1
79 1 4 GLU H 1 4 GLU HB3 . . 3.500 3.547 3.547 3.547 0.047 1 0 "[ ]" 1
80 1 4 GLU H 1 4 GLU HG2 . . 3.400 3.401 3.401 3.401 0.001 1 0 "[ ]" 1
81 1 4 GLU H 1 4 GLU QG . . 3.130 2.208 2.208 2.208 . 0 0 "[ ]" 1
82 1 4 GLU H 1 4 GLU HG3 . . 3.400 2.237 2.237 2.237 . 0 0 "[ ]" 1
83 1 4 GLU H 1 6 GLY H . . 3.900 3.951 3.951 3.951 0.051 1 0 "[ ]" 1
84 1 4 GLU HA 1 4 GLU HB2 . . 3.000 3.035 3.035 3.035 0.035 1 0 "[ ]" 1
85 1 4 GLU HA 1 4 GLU HB3 . . 3.000 2.477 2.477 2.477 . 0 0 "[ ]" 1
86 1 4 GLU HA 1 4 GLU HG2 . . 3.000 2.397 2.397 2.397 . 0 0 "[ ]" 1
87 1 4 GLU HA 1 4 GLU HG3 . . 3.000 3.022 3.022 3.022 0.022 1 0 "[ ]" 1
88 1 4 GLU HA 1 5 LYS H . . 3.600 3.588 3.588 3.588 . 0 0 "[ ]" 1
89 1 4 GLU HA 1 6 GLY H . . 5.900 4.575 4.575 4.575 . 0 0 "[ ]" 1
90 1 4 GLU HA 1 7 LYS H . . 3.900 3.323 3.323 3.323 . 0 0 "[ ]" 1
91 1 4 GLU HA 1 7 LYS QB . . 5.000 2.695 2.695 2.695 . 0 0 "[ ]" 1
92 1 4 GLU HA 1 7 LYS QG . . 5.780 3.338 3.338 3.338 . 0 0 "[ ]" 1
93 1 4 GLU HA 1 8 LYS H . . 4.900 4.554 4.554 4.554 . 0 0 "[ ]" 1
94 1 4 GLU QB 1 5 LYS HA . . 5.080 4.066 4.066 4.066 . 0 0 "[ ]" 1
95 1 4 GLU QB 1 5 LYS QB . . 7.180 4.401 4.401 4.401 . 0 0 "[ ]" 1
96 1 4 GLU HB2 1 5 LYS H . . 3.600 2.600 2.600 2.600 . 0 0 "[ ]" 1
97 1 4 GLU HB3 1 5 LYS H . . 3.600 3.592 3.592 3.592 . 0 0 "[ ]" 1
98 1 4 GLU QG 1 5 LYS H . . 5.680 4.098 4.098 4.098 . 0 0 "[ ]" 1
99 1 5 LYS H 1 5 LYS QB . . 3.900 2.382 2.382 2.382 . 0 0 "[ ]" 1
100 1 5 LYS H 1 5 LYS QD . . 5.200 3.740 3.740 3.740 . 0 0 "[ ]" 1
101 1 5 LYS H 1 5 LYS HG2 . . 3.200 3.292 3.292 3.292 0.092 1 0 "[ ]" 1
102 1 5 LYS H 1 5 LYS QG . . 2.930 2.091 2.091 2.091 . 0 0 "[ ]" 1
103 1 5 LYS H 1 5 LYS HG3 . . 3.200 2.115 2.115 2.115 . 0 0 "[ ]" 1
104 1 5 LYS H 1 6 GLY H . . 3.200 2.687 2.687 2.687 . 0 0 "[ ]" 1
105 1 5 LYS H 1 8 LYS QB . . 6.100 5.473 5.473 5.473 . 0 0 "[ ]" 1
106 1 5 LYS H 1 8 LYS QG . . 6.100 4.731 4.731 4.731 . 0 0 "[ ]" 1
107 1 5 LYS HA 1 5 LYS HG2 . . 3.100 2.269 2.269 2.269 . 0 0 "[ ]" 1
108 1 5 LYS HA 1 5 LYS QG . . 2.770 2.196 2.196 2.196 . 0 0 "[ ]" 1
109 1 5 LYS HA 1 5 LYS HG3 . . 3.100 2.928 2.928 2.928 . 0 0 "[ ]" 1
110 1 5 LYS HA 1 7 LYS H . . 5.200 4.415 4.415 4.415 . 0 0 "[ ]" 1
111 1 5 LYS HA 1 8 LYS H . . 4.300 3.426 3.426 3.426 . 0 0 "[ ]" 1
112 1 5 LYS HA 1 8 LYS QB . . 5.000 2.947 2.947 2.947 . 0 0 "[ ]" 1
113 1 5 LYS HA 1 8 LYS QG . . 6.100 2.816 2.816 2.816 . 0 0 "[ ]" 1
114 1 5 LYS QB 1 6 GLY H . . 4.900 2.566 2.566 2.566 . 0 0 "[ ]" 1
115 1 5 LYS QG 1 9 ILE QG . . 5.610 4.494 4.494 4.494 . 0 0 "[ ]" 1
116 1 5 LYS HG2 1 9 ILE HG12 . . 6.650 5.013 5.013 5.013 . 0 0 "[ ]" 1
117 1 5 LYS HG2 1 9 ILE HG13 . . 6.650 5.816 5.816 5.816 . 0 0 "[ ]" 1
118 1 5 LYS HG3 1 9 ILE HG12 . . 6.650 6.023 6.023 6.023 . 0 0 "[ ]" 1
119 1 5 LYS HG3 1 9 ILE HG13 . . 6.650 6.644 6.644 6.644 . 0 0 "[ ]" 1
120 1 6 GLY H 1 7 LYS H . . 3.500 3.047 3.047 3.047 . 0 0 "[ ]" 1
121 1 6 GLY H 1 93 ASP HB2 . . 6.000 4.722 4.722 4.722 . 0 0 "[ ]" 1
122 1 6 GLY H 1 93 ASP QB . . 5.450 2.936 2.936 2.936 . 0 0 "[ ]" 1
123 1 6 GLY H 1 93 ASP HB3 . . 6.000 2.965 2.965 2.965 . 0 0 "[ ]" 1
124 1 6 GLY H 1 94 LEU HA . . 5.000 5.099 5.099 5.099 0.099 1 0 "[ ]" 1
125 1 6 GLY H 1 96 ALA MB . . 7.000 4.054 4.054 4.054 . 0 0 "[ ]" 1
126 1 6 GLY QA 1 9 ILE H . . 6.180 3.470 3.470 3.470 . 0 0 "[ ]" 1
127 1 6 GLY QA 1 93 ASP QB . . 6.950 2.399 2.399 2.399 . 0 0 "[ ]" 1
128 1 6 GLY QA 1 94 LEU HA . . 4.680 2.749 2.749 2.749 . 0 0 "[ ]" 1
129 1 6 GLY QA 1 94 LEU QD . . 8.050 3.180 3.180 3.180 . 0 0 "[ ]" 1
130 1 6 GLY QA 1 96 ALA H . . 5.580 4.903 4.903 4.903 . 0 0 "[ ]" 1
131 1 7 LYS H 1 7 LYS HD2 . . 5.900 4.970 4.970 4.970 . 0 0 "[ ]" 1
132 1 7 LYS H 1 7 LYS QD . . 5.400 4.254 4.254 4.254 . 0 0 "[ ]" 1
133 1 7 LYS H 1 7 LYS HD3 . . 5.900 4.624 4.624 4.624 . 0 0 "[ ]" 1
134 1 7 LYS H 1 7 LYS HG2 . . 3.700 2.972 2.972 2.972 . 0 0 "[ ]" 1
135 1 7 LYS H 1 7 LYS QG . . 3.350 2.866 2.866 2.866 . 0 0 "[ ]" 1
136 1 7 LYS H 1 7 LYS HG3 . . 3.700 3.759 3.759 3.759 0.059 1 0 "[ ]" 1
137 1 7 LYS H 1 8 LYS H . . 3.600 2.921 2.921 2.921 . 0 0 "[ ]" 1
138 1 7 LYS H 1 9 ILE H . . 6.000 4.421 4.421 4.421 . 0 0 "[ ]" 1
139 1 7 LYS H 1 97 TYR HB2 . . 4.700 2.944 2.944 2.944 . 0 0 "[ ]" 1
140 1 7 LYS H 1 97 TYR HB3 . . 5.400 4.106 4.106 4.106 . 0 0 "[ ]" 1
141 1 7 LYS H 1 97 TYR HD1 . . 5.400 3.712 3.712 3.712 . 0 0 "[ ]" 1
142 1 7 LYS HA 1 7 LYS HD2 . . 3.200 3.121 3.121 3.121 . 0 0 "[ ]" 1
143 1 7 LYS HA 1 7 LYS HD3 . . 3.200 2.346 2.346 2.346 . 0 0 "[ ]" 1
144 1 7 LYS HA 1 7 LYS HG2 . . 3.400 2.440 2.440 2.440 . 0 0 "[ ]" 1
145 1 7 LYS HA 1 7 LYS QG . . 3.080 2.397 2.397 2.397 . 0 0 "[ ]" 1
146 1 7 LYS HA 1 7 LYS HG3 . . 3.400 3.516 3.516 3.516 0.116 1 0 "[ ]" 1
147 1 7 LYS HA 1 9 ILE H . . 6.000 4.928 4.928 4.928 . 0 0 "[ ]" 1
148 1 7 LYS HA 1 10 PHE H . . 4.200 3.883 3.883 3.883 . 0 0 "[ ]" 1
149 1 7 LYS HA 1 10 PHE QB . . 4.580 2.873 2.873 2.873 . 0 0 "[ ]" 1
150 1 7 LYS HA 1 11 VAL H . . 4.900 4.092 4.092 4.092 . 0 0 "[ ]" 1
151 1 7 LYS HA 1 97 TYR HD1 . . 4.900 3.915 3.915 3.915 . 0 0 "[ ]" 1
152 1 7 LYS HA 1 97 TYR HD2 . . 4.600 4.612 4.612 4.612 0.012 1 0 "[ ]" 1
153 1 7 LYS HA 1 97 TYR HE1 . . 5.500 4.160 4.160 4.160 . 0 0 "[ ]" 1
154 1 7 LYS HA 1 97 TYR HE2 . . 5.500 4.623 4.623 4.623 . 0 0 "[ ]" 1
155 1 7 LYS QB 1 8 LYS H . . 5.200 2.428 2.428 2.428 . 0 0 "[ ]" 1
156 1 7 LYS QB 1 97 TYR HD1 . . 6.400 4.265 4.265 4.265 . 0 0 "[ ]" 1
157 1 7 LYS QB 1 97 TYR HE1 . . 7.000 4.845 4.845 4.845 . 0 0 "[ ]" 1
158 1 7 LYS QD 1 8 LYS H . . 6.880 4.564 4.564 4.564 . 0 0 "[ ]" 1
159 1 7 LYS QD 1 97 TYR HE1 . . 5.680 3.004 3.004 3.004 . 0 0 "[ ]" 1
160 1 7 LYS QG 1 8 LYS H . . 6.080 4.224 4.224 4.224 . 0 0 "[ ]" 1
161 1 7 LYS QG 1 97 TYR HD1 . . 5.280 2.458 2.458 2.458 . 0 0 "[ ]" 1
162 1 7 LYS QG 1 97 TYR HE1 . . 4.600 2.755 2.755 2.755 . 0 0 "[ ]" 1
163 1 7 LYS HG2 1 97 TYR HE1 . . 5.200 2.808 2.808 2.808 . 0 0 "[ ]" 1
164 1 7 LYS HG3 1 97 TYR HE1 . . 5.200 3.999 3.999 3.999 . 0 0 "[ ]" 1
165 1 8 LYS H 1 8 LYS QB . . 3.900 2.550 2.550 2.550 . 0 0 "[ ]" 1
166 1 8 LYS H 1 8 LYS QD . . 4.500 3.005 3.005 3.005 . 0 0 "[ ]" 1
167 1 8 LYS H 1 8 LYS QG . . 4.900 2.092 2.092 2.092 . 0 0 "[ ]" 1
168 1 8 LYS H 1 9 ILE H . . 3.400 2.810 2.810 2.810 . 0 0 "[ ]" 1
169 1 8 LYS H 1 9 ILE QG . . 5.880 4.319 4.319 4.319 . 0 0 "[ ]" 1
170 1 8 LYS H 1 10 PHE H . . 4.500 4.198 4.198 4.198 . 0 0 "[ ]" 1
171 1 8 LYS H 1 10 PHE HB2 . . 6.000 5.957 5.957 5.957 . 0 0 "[ ]" 1
172 1 8 LYS H 1 10 PHE QB . . 5.740 4.899 4.899 4.899 . 0 0 "[ ]" 1
173 1 8 LYS H 1 10 PHE HB3 . . 6.000 5.211 5.211 5.211 . 0 0 "[ ]" 1
174 1 8 LYS H 1 11 VAL MG1 . . 6.400 5.373 5.373 5.373 . 0 0 "[ ]" 1
175 1 8 LYS HA 1 8 LYS QD . . 4.800 2.232 2.232 2.232 . 0 0 "[ ]" 1
176 1 8 LYS HA 1 8 LYS QG . . 3.900 3.156 3.156 3.156 . 0 0 "[ ]" 1
177 1 8 LYS HA 1 11 VAL H . . 3.900 3.525 3.525 3.525 . 0 0 "[ ]" 1
178 1 8 LYS HA 1 11 VAL HB . . 3.200 2.828 2.828 2.828 . 0 0 "[ ]" 1
179 1 8 LYS HA 1 11 VAL MG1 . . 4.600 3.079 3.079 3.079 . 0 0 "[ ]" 1
180 1 8 LYS HA 1 11 VAL MG2 . . 5.100 4.249 4.249 4.249 . 0 0 "[ ]" 1
181 1 8 LYS HA 1 12 GLN H . . 4.700 4.101 4.101 4.101 . 0 0 "[ ]" 1
182 1 8 LYS QB 1 9 ILE H . . 4.300 2.312 2.312 2.312 . 0 0 "[ ]" 1
183 1 8 LYS QB 1 10 PHE H . . 6.200 4.663 4.663 4.663 . 0 0 "[ ]" 1
184 1 9 ILE H 1 9 ILE HB . . 3.400 2.477 2.477 2.477 . 0 0 "[ ]" 1
185 1 9 ILE H 1 9 ILE MD . . 4.300 3.314 3.314 3.314 . 0 0 "[ ]" 1
186 1 9 ILE H 1 9 ILE HG12 . . 3.800 2.127 2.127 2.127 . 0 0 "[ ]" 1
187 1 9 ILE H 1 9 ILE QG . . 3.450 2.111 2.111 2.111 . 0 0 "[ ]" 1
188 1 9 ILE H 1 9 ILE HG13 . . 3.800 3.522 3.522 3.522 . 0 0 "[ ]" 1
189 1 9 ILE H 1 10 PHE H . . 3.400 2.794 2.794 2.794 . 0 0 "[ ]" 1
190 1 9 ILE H 1 11 VAL H . . 6.000 4.197 4.197 4.197 . 0 0 "[ ]" 1
191 1 9 ILE HA 1 9 ILE MD . . 4.100 2.180 2.180 2.180 . 0 0 "[ ]" 1
192 1 9 ILE HA 1 9 ILE HG12 . . 3.700 3.096 3.096 3.096 . 0 0 "[ ]" 1
193 1 9 ILE HA 1 9 ILE QG . . 3.300 2.958 2.958 2.958 . 0 0 "[ ]" 1
194 1 9 ILE HA 1 9 ILE HG13 . . 3.700 3.752 3.752 3.752 0.052 1 0 "[ ]" 1
195 1 9 ILE HA 1 9 ILE MG . . 3.700 2.410 2.410 2.410 . 0 0 "[ ]" 1
196 1 9 ILE HA 1 11 VAL H . . 4.900 4.479 4.479 4.479 . 0 0 "[ ]" 1
197 1 9 ILE HA 1 12 GLN H . . 3.800 3.261 3.261 3.261 . 0 0 "[ ]" 1
198 1 9 ILE HA 1 12 GLN HB2 . . 4.100 2.381 2.381 2.381 . 0 0 "[ ]" 1
199 1 9 ILE HA 1 12 GLN HB3 . . 3.900 3.952 3.952 3.952 0.052 1 0 "[ ]" 1
200 1 9 ILE HA 1 13 LYS H . . 4.600 3.726 3.726 3.726 . 0 0 "[ ]" 1
201 1 9 ILE HB 1 10 PHE H . . 3.400 2.754 2.754 2.754 . 0 0 "[ ]" 1
202 1 9 ILE MD 1 94 LEU QD . . 8.470 4.261 4.261 4.261 . 0 0 "[ ]" 1
203 1 9 ILE QG 1 10 PHE H . . 5.880 4.156 4.156 4.156 . 0 0 "[ ]" 1
204 1 9 ILE MG 1 10 PHE H . . 5.900 3.523 3.523 3.523 . 0 0 "[ ]" 1
205 1 9 ILE MG 1 13 LYS H . . 7.000 3.806 3.806 3.806 . 0 0 "[ ]" 1
206 1 9 ILE MG 1 13 LYS QB . . 8.000 3.363 3.363 3.363 . 0 0 "[ ]" 1
207 1 9 ILE MG 1 13 LYS QD . . 7.300 3.714 3.714 3.714 . 0 0 "[ ]" 1
208 1 9 ILE MG 1 13 LYS QG . . 7.300 2.155 2.155 2.155 . 0 0 "[ ]" 1
209 1 9 ILE MG 1 94 LEU HA . . 7.000 4.325 4.325 4.325 . 0 0 "[ ]" 1
210 1 9 ILE MG 1 94 LEU QD . . 6.970 1.976 1.976 1.976 . 0 0 "[ ]" 1
211 1 9 ILE MG 1 94 LEU HG . . 4.600 2.354 2.354 2.354 . 0 0 "[ ]" 1
212 1 10 PHE H 1 10 PHE HB2 . . 3.400 2.528 2.528 2.528 . 0 0 "[ ]" 1
213 1 10 PHE H 1 10 PHE HB3 . . 3.400 2.561 2.561 2.561 . 0 0 "[ ]" 1
214 1 10 PHE H 1 10 PHE HD2 . . 6.000 4.743 4.743 4.743 . 0 0 "[ ]" 1
215 1 10 PHE H 1 11 VAL H . . 4.000 2.731 2.731 2.731 . 0 0 "[ ]" 1
216 1 10 PHE H 1 12 GLN H . . 5.600 4.075 4.075 4.075 . 0 0 "[ ]" 1
217 1 10 PHE H 1 94 LEU MD1 . . 6.200 4.889 4.889 4.889 . 0 0 "[ ]" 1
218 1 10 PHE H 1 94 LEU QD . . 5.550 2.801 2.801 2.801 . 0 0 "[ ]" 1
219 1 10 PHE H 1 94 LEU MD2 . . 6.200 2.818 2.818 2.818 . 0 0 "[ ]" 1
220 1 10 PHE H 1 94 LEU HG . . 5.200 4.388 4.388 4.388 . 0 0 "[ ]" 1
221 1 10 PHE HA 1 10 PHE HD1 . . 5.000 3.969 3.969 3.969 . 0 0 "[ ]" 1
222 1 10 PHE HA 1 13 LYS H . . 4.800 3.595 3.595 3.595 . 0 0 "[ ]" 1
223 1 10 PHE HA 1 14 CYS H . . 4.100 2.999 2.999 2.999 . 0 0 "[ ]" 1
224 1 10 PHE HA 1 94 LEU QD . . 6.470 2.129 2.129 2.129 . 0 0 "[ ]" 1
225 1 10 PHE QB 1 11 VAL H . . 4.180 2.511 2.511 2.511 . 0 0 "[ ]" 1
226 1 10 PHE QB 1 94 LEU HA . . 6.880 3.962 3.962 3.962 . 0 0 "[ ]" 1
227 1 10 PHE QB 1 94 LEU QD . . 5.810 2.248 2.248 2.248 . 0 0 "[ ]" 1
228 1 10 PHE QB 1 97 TYR HD1 . . 6.580 5.347 5.347 5.347 . 0 0 "[ ]" 1
229 1 10 PHE QB 1 97 TYR HD2 . . 6.880 3.025 3.025 3.025 . 0 0 "[ ]" 1
230 1 10 PHE HB2 1 11 VAL H . . 4.700 3.858 3.858 3.858 . 0 0 "[ ]" 1
231 1 10 PHE HB2 1 94 LEU MD1 . . 7.740 4.939 4.939 4.939 . 0 0 "[ ]" 1
232 1 10 PHE HB2 1 94 LEU MD2 . . 7.740 2.274 2.274 2.274 . 0 0 "[ ]" 1
233 1 10 PHE HB3 1 11 VAL H . . 4.700 2.544 2.544 2.544 . 0 0 "[ ]" 1
234 1 10 PHE HB3 1 94 LEU MD1 . . 7.740 6.116 6.116 6.116 . 0 0 "[ ]" 1
235 1 10 PHE HB3 1 94 LEU MD2 . . 7.740 3.632 3.632 3.632 . 0 0 "[ ]" 1
236 1 10 PHE HD2 1 20 VAL QG . . 8.560 3.896 3.896 3.896 . 0 0 "[ ]" 1
237 1 10 PHE HD2 1 32 LEU MD1 . . 6.500 4.920 4.920 4.920 . 0 0 "[ ]" 1
238 1 10 PHE HD2 1 98 LEU MD1 . . 5.600 2.867 2.867 2.867 . 0 0 "[ ]" 1
239 1 10 PHE HE1 1 32 LEU MD1 . . 6.900 6.143 6.143 6.143 . 0 0 "[ ]" 1
240 1 10 PHE HE1 1 98 LEU MD1 . . 7.000 6.274 6.274 6.274 . 0 0 "[ ]" 1
241 1 10 PHE HZ 1 15 ALA HA . . 4.900 4.867 4.867 4.867 . 0 0 "[ ]" 1
242 1 10 PHE HZ 1 15 ALA MB . . 7.000 5.831 5.831 5.831 . 0 0 "[ ]" 1
243 1 10 PHE HZ 1 18 HIS HB2 . . 4.500 2.431 2.431 2.431 . 0 0 "[ ]" 1
244 1 10 PHE HZ 1 18 HIS HB3 . . 4.500 2.522 2.522 2.522 . 0 0 "[ ]" 1
245 1 10 PHE HZ 1 19 THR HA . . 5.900 3.286 3.286 3.286 . 0 0 "[ ]" 1
246 1 10 PHE HZ 1 20 VAL MG1 . . 7.000 2.619 2.619 2.619 . 0 0 "[ ]" 1
247 1 10 PHE HZ 1 20 VAL QG . . 5.880 2.608 2.608 2.608 . 0 0 "[ ]" 1
248 1 10 PHE HZ 1 20 VAL MG2 . . 7.000 4.821 4.821 4.821 . 0 0 "[ ]" 1
249 1 10 PHE HZ 1 32 LEU MD1 . . 5.600 4.048 4.048 4.048 . 0 0 "[ ]" 1
250 1 10 PHE HZ 1 98 LEU MD1 . . 7.000 5.138 5.138 5.138 . 0 0 "[ ]" 1
251 1 11 VAL H 1 11 VAL HB . . 3.000 2.067 2.067 2.067 . 0 0 "[ ]" 1
252 1 11 VAL H 1 11 VAL MG1 . . 3.900 3.308 3.308 3.308 . 0 0 "[ ]" 1
253 1 11 VAL H 1 11 VAL MG2 . . 4.400 3.136 3.136 3.136 . 0 0 "[ ]" 1
254 1 11 VAL H 1 12 GLN H . . 3.500 2.694 2.694 2.694 . 0 0 "[ ]" 1
255 1 11 VAL H 1 15 ALA MB . . 5.800 4.580 4.580 4.580 . 0 0 "[ ]" 1
256 1 11 VAL HA 1 11 VAL MG1 . . 3.700 2.924 2.924 2.924 . 0 0 "[ ]" 1
257 1 11 VAL HA 1 11 VAL MG2 . . 3.700 2.137 2.137 2.137 . 0 0 "[ ]" 1
258 1 11 VAL HA 1 12 GLN HA . . 4.700 4.742 4.742 4.742 0.042 1 0 "[ ]" 1
259 1 11 VAL HA 1 14 CYS H . . 5.600 4.198 4.198 4.198 . 0 0 "[ ]" 1
260 1 11 VAL HA 1 15 ALA H . . 4.300 2.892 2.892 2.892 . 0 0 "[ ]" 1
261 1 11 VAL HA 1 15 ALA MB . . 3.500 2.037 2.037 2.037 . 0 0 "[ ]" 1
262 1 11 VAL HB 1 12 GLN H . . 3.700 3.398 3.398 3.398 . 0 0 "[ ]" 1
263 1 11 VAL HB 1 15 ALA MB . . 6.400 4.410 4.410 4.410 . 0 0 "[ ]" 1
264 1 11 VAL MG1 1 12 GLN H . . 6.100 2.722 2.722 2.722 . 0 0 "[ ]" 1
265 1 11 VAL MG1 1 15 ALA HA . . 6.500 5.494 5.494 5.494 . 0 0 "[ ]" 1
266 1 11 VAL MG2 1 12 GLN H . . 5.800 4.360 4.360 4.360 . 0 0 "[ ]" 1
267 1 11 VAL MG2 1 12 GLN HA . . 6.300 5.266 5.266 5.266 . 0 0 "[ ]" 1
268 1 11 VAL MG2 1 15 ALA MB . . 6.200 2.560 2.560 2.560 . 0 0 "[ ]" 1
269 1 12 GLN H 1 12 GLN HB2 . . 3.400 2.255 2.255 2.255 . 0 0 "[ ]" 1
270 1 12 GLN H 1 12 GLN HB3 . . 3.500 3.524 3.524 3.524 0.024 1 0 "[ ]" 1
271 1 12 GLN H 1 12 GLN HG2 . . 4.200 3.764 3.764 3.764 . 0 0 "[ ]" 1
272 1 12 GLN H 1 12 GLN QG . . 3.860 2.450 2.450 2.450 . 0 0 "[ ]" 1
273 1 12 GLN H 1 12 GLN HG3 . . 4.200 2.482 2.482 2.482 . 0 0 "[ ]" 1
274 1 12 GLN H 1 13 LYS H . . 3.400 2.686 2.686 2.686 . 0 0 "[ ]" 1
275 1 12 GLN H 1 13 LYS QG . . 6.900 4.076 4.076 4.076 . 0 0 "[ ]" 1
276 1 12 GLN H 1 14 CYS H . . 5.000 4.342 4.342 4.342 . 0 0 "[ ]" 1
277 1 12 GLN HA 1 12 GLN HG2 . . 3.300 2.562 2.562 2.562 . 0 0 "[ ]" 1
278 1 12 GLN HA 1 12 GLN HG3 . . 3.300 2.803 2.803 2.803 . 0 0 "[ ]" 1
279 1 12 GLN HA 1 13 LYS QG . . 7.000 4.801 4.801 4.801 . 0 0 "[ ]" 1
280 1 12 GLN HA 1 14 CYS H . . 5.300 5.174 5.174 5.174 . 0 0 "[ ]" 1
281 1 12 GLN HA 1 15 ALA H . . 5.900 5.140 5.140 5.140 . 0 0 "[ ]" 1
282 1 12 GLN HB2 1 13 LYS H . . 4.300 2.396 2.396 2.396 . 0 0 "[ ]" 1
283 1 12 GLN HB2 1 13 LYS QG . . 6.600 2.634 2.634 2.634 . 0 0 "[ ]" 1
284 1 12 GLN HB3 1 13 LYS H . . 4.200 3.221 3.221 3.221 . 0 0 "[ ]" 1
285 1 12 GLN HB3 1 13 LYS QG . . 7.000 3.200 3.200 3.200 . 0 0 "[ ]" 1
286 1 12 GLN HE22 1 12 GLN HG2 . . 3.700 3.712 3.712 3.712 0.012 1 0 "[ ]" 1
287 1 12 GLN HE22 1 12 GLN HG3 . . 3.700 3.612 3.612 3.612 . 0 0 "[ ]" 1
288 1 13 LYS H 1 13 LYS QD . . 4.600 3.749 3.749 3.749 . 0 0 "[ ]" 1
289 1 13 LYS H 1 13 LYS QG . . 4.600 2.165 2.165 2.165 . 0 0 "[ ]" 1
290 1 13 LYS H 1 14 CYS H . . 3.200 2.601 2.601 2.601 . 0 0 "[ ]" 1
291 1 13 LYS H 1 15 ALA H . . 4.500 4.122 4.122 4.122 . 0 0 "[ ]" 1
292 1 13 LYS HA 1 13 LYS QD . . 4.400 2.502 2.502 2.502 . 0 0 "[ ]" 1
293 1 13 LYS HA 1 13 LYS QG . . 3.900 2.953 2.953 2.953 . 0 0 "[ ]" 1
294 1 13 LYS QB 1 14 CYS H . . 6.000 2.427 2.427 2.427 . 0 0 "[ ]" 1
295 1 13 LYS QB 1 82 PHE QE . . 9.000 3.008 3.008 3.008 . 0 0 "[ ]" 1
296 1 13 LYS QD 1 14 CYS H . . 7.000 5.053 5.053 5.053 . 0 0 "[ ]" 1
297 1 13 LYS QD 1 82 PHE QE . . 8.800 3.820 3.820 3.820 . 0 0 "[ ]" 1
298 1 13 LYS QD 1 82 PHE HZ . . 7.000 3.899 3.899 3.899 . 0 0 "[ ]" 1
299 1 13 LYS QG 1 14 CYS H . . 7.000 3.938 3.938 3.938 . 0 0 "[ ]" 1
300 1 13 LYS QG 1 82 PHE HZ . . 7.000 4.384 4.384 4.384 . 0 0 "[ ]" 1
301 1 14 CYS H 1 14 CYS HB2 . . 4.000 2.855 2.855 2.855 . 0 0 "[ ]" 1
302 1 14 CYS H 1 15 ALA H . . 3.200 2.317 2.317 2.317 . 0 0 "[ ]" 1
303 1 14 CYS H 1 15 ALA MB . . 4.900 4.095 4.095 4.095 . 0 0 "[ ]" 1
304 1 14 CYS H 1 16 GLN H . . 5.600 4.443 4.443 4.443 . 0 0 "[ ]" 1
305 1 14 CYS HA 1 18 HIS HD2 . . 5.100 3.396 3.396 3.396 . 0 0 "[ ]" 1
306 1 14 CYS HB2 1 15 ALA H . . 4.700 2.952 2.952 2.952 . 0 0 "[ ]" 1
307 1 14 CYS HB2 1 18 HIS HB2 . . 6.000 3.114 3.114 3.114 . 0 0 "[ ]" 1
308 1 14 CYS HB2 1 18 HIS HB3 . . 5.300 4.610 4.610 4.610 . 0 0 "[ ]" 1
309 1 14 CYS HB2 1 18 HIS HD2 . . 4.000 4.042 4.042 4.042 0.042 1 0 "[ ]" 1
310 1 14 CYS HB2 1 82 PHE HZ . . 6.000 6.080 6.080 6.080 0.080 1 0 "[ ]" 1
311 1 14 CYS HB3 1 15 ALA H . . 4.400 4.188 4.188 4.188 . 0 0 "[ ]" 1
312 1 14 CYS HB3 1 18 HIS HD2 . . 5.100 2.589 2.589 2.589 . 0 0 "[ ]" 1
313 1 15 ALA H 1 15 ALA MB . . 3.500 2.337 2.337 2.337 . 0 0 "[ ]" 1
314 1 15 ALA H 1 16 GLN H . . 3.500 3.036 3.036 3.036 . 0 0 "[ ]" 1
315 1 15 ALA HA 1 17 CYS H . . 4.800 3.914 3.914 3.914 . 0 0 "[ ]" 1
316 1 15 ALA HA 1 18 HIS H . . 3.600 3.619 3.619 3.619 0.019 1 0 "[ ]" 1
317 1 15 ALA MB 1 16 GLN H . . 3.800 2.363 2.363 2.363 . 0 0 "[ ]" 1
318 1 15 ALA MB 1 16 GLN HA . . 4.800 3.616 3.616 3.616 . 0 0 "[ ]" 1
319 1 15 ALA MB 1 17 CYS H . . 5.000 4.201 4.201 4.201 . 0 0 "[ ]" 1
320 1 15 ALA MB 1 18 HIS H . . 5.700 4.697 4.697 4.697 . 0 0 "[ ]" 1
321 1 16 GLN H 1 16 GLN HB2 . . 3.600 2.460 2.460 2.460 . 0 0 "[ ]" 1
322 1 16 GLN H 1 16 GLN HB3 . . 3.600 3.552 3.552 3.552 . 0 0 "[ ]" 1
323 1 16 GLN H 1 16 GLN HG2 . . 4.500 3.341 3.341 3.341 . 0 0 "[ ]" 1
324 1 16 GLN H 1 16 GLN QG . . 3.930 2.063 2.063 2.063 . 0 0 "[ ]" 1
325 1 16 GLN H 1 16 GLN HG3 . . 4.500 2.083 2.083 2.083 . 0 0 "[ ]" 1
326 1 16 GLN H 1 17 CYS H . . 3.800 2.796 2.796 2.796 . 0 0 "[ ]" 1
327 1 16 GLN H 1 18 HIS H . . 5.400 4.253 4.253 4.253 . 0 0 "[ ]" 1
328 1 16 GLN HA 1 16 GLN HG2 . . 3.400 2.515 2.515 2.515 . 0 0 "[ ]" 1
329 1 16 GLN HA 1 16 GLN QG . . 3.180 2.393 2.393 2.393 . 0 0 "[ ]" 1
330 1 16 GLN HA 1 16 GLN HG3 . . 3.400 2.996 2.996 2.996 . 0 0 "[ ]" 1
331 1 16 GLN HA 1 18 HIS H . . 6.000 5.211 5.211 5.211 . 0 0 "[ ]" 1
332 1 16 GLN HB2 1 17 CYS H . . 3.900 2.993 2.993 2.993 . 0 0 "[ ]" 1
333 1 16 GLN HB3 1 17 CYS H . . 3.900 3.909 3.909 3.909 0.009 1 0 "[ ]" 1
334 1 17 CYS H 1 17 CYS HB2 . . 3.900 2.509 2.509 2.509 . 0 0 "[ ]" 1
335 1 17 CYS H 1 17 CYS HB3 . . 3.800 3.712 3.712 3.712 . 0 0 "[ ]" 1
336 1 17 CYS H 1 18 HIS H . . 3.200 2.025 2.025 2.025 . 0 0 "[ ]" 1
337 1 17 CYS H 1 18 HIS HD2 . . 6.000 4.235 4.235 4.235 . 0 0 "[ ]" 1
338 1 17 CYS HB2 1 18 HIS H . . 6.000 2.753 2.753 2.753 . 0 0 "[ ]" 1
339 1 17 CYS HB2 1 18 HIS HD2 . . 4.700 2.733 2.733 2.733 . 0 0 "[ ]" 1
340 1 17 CYS HB2 1 28 THR HB . . 5.700 3.742 3.742 3.742 . 0 0 "[ ]" 1
341 1 17 CYS HB2 1 29 GLY H . . 5.600 4.452 4.452 4.452 . 0 0 "[ ]" 1
342 1 17 CYS HB3 1 18 HIS H . . 4.800 3.743 3.743 3.743 . 0 0 "[ ]" 1
343 1 17 CYS HB3 1 18 HIS HD2 . . 4.500 3.708 3.708 3.708 . 0 0 "[ ]" 1
344 1 17 CYS HB3 1 28 THR HB . . 6.000 2.204 2.204 2.204 . 0 0 "[ ]" 1
345 1 17 CYS HB3 1 29 GLY H . . 5.000 3.176 3.176 3.176 . 0 0 "[ ]" 1
346 1 18 HIS H 1 18 HIS HB3 . . 4.000 3.719 3.719 3.719 . 0 0 "[ ]" 1
347 1 18 HIS H 1 18 HIS HD2 . . 4.400 3.175 3.175 3.175 . 0 0 "[ ]" 1
348 1 18 HIS HA 1 19 THR H . . 3.300 2.341 2.341 2.341 . 0 0 "[ ]" 1
349 1 18 HIS HA 1 19 THR MG . . 5.700 3.508 3.508 3.508 . 0 0 "[ ]" 1
350 1 18 HIS HB2 1 18 HIS HD2 . . 3.800 2.608 2.608 2.608 . 0 0 "[ ]" 1
351 1 18 HIS HB2 1 19 THR H . . 4.700 3.659 3.659 3.659 . 0 0 "[ ]" 1
352 1 18 HIS HB2 1 32 LEU MD1 . . 5.700 4.364 4.364 4.364 . 0 0 "[ ]" 1
353 1 18 HIS HB3 1 18 HIS HD2 . . 3.800 3.770 3.770 3.770 . 0 0 "[ ]" 1
354 1 18 HIS HB3 1 32 LEU MD1 . . 6.500 3.917 3.917 3.917 . 0 0 "[ ]" 1
355 1 18 HIS HD2 1 32 LEU MD1 . . 6.400 4.454 4.454 4.454 . 0 0 "[ ]" 1
356 1 19 THR H 1 19 THR MG . . 4.800 2.620 2.620 2.620 . 0 0 "[ ]" 1
357 1 19 THR H 1 31 ASN HA . . 5.000 3.888 3.888 3.888 . 0 0 "[ ]" 1
358 1 19 THR HA 1 20 VAL H . . 3.100 2.316 2.316 2.316 . 0 0 "[ ]" 1
359 1 19 THR HA 1 20 VAL MG1 . . 6.700 3.937 3.937 3.937 . 0 0 "[ ]" 1
360 1 19 THR HA 1 20 VAL QG . . 5.880 3.862 3.862 3.862 . 0 0 "[ ]" 1
361 1 19 THR HA 1 20 VAL MG2 . . 6.700 5.583 5.583 5.583 . 0 0 "[ ]" 1
362 1 19 THR HA 1 24 GLY QA . . 6.380 4.770 4.770 4.770 . 0 0 "[ ]" 1
363 1 19 THR HA 1 25 LYS H . . 5.800 5.887 5.887 5.887 0.087 1 0 "[ ]" 1
364 1 19 THR MG 1 20 VAL H . . 7.000 4.341 4.341 4.341 . 0 0 "[ ]" 1
365 1 19 THR MG 1 24 GLY QA . . 7.880 2.288 2.288 2.288 . 0 0 "[ ]" 1
366 1 19 THR MG 1 25 LYS H . . 5.600 1.990 1.990 1.990 . 0 0 "[ ]" 1
367 1 19 THR MG 1 25 LYS QB . . 5.080 2.786 2.786 2.786 . 0 0 "[ ]" 1
368 1 20 VAL H 1 20 VAL MG1 . . 4.700 2.082 2.082 2.082 . 0 0 "[ ]" 1
369 1 20 VAL H 1 20 VAL QG . . 3.980 2.072 2.072 2.072 . 0 0 "[ ]" 1
370 1 20 VAL H 1 20 VAL MG2 . . 4.700 3.774 3.774 3.774 . 0 0 "[ ]" 1
371 1 20 VAL HA 1 20 VAL HB . . 3.000 2.401 2.401 2.401 . 0 0 "[ ]" 1
372 1 20 VAL HA 1 32 LEU H . . 4.100 3.686 3.686 3.686 . 0 0 "[ ]" 1
373 1 20 VAL HA 1 32 LEU MD1 . . 7.000 5.425 5.425 5.425 . 0 0 "[ ]" 1
374 1 20 VAL HA 1 33 HIS H . . 4.700 4.809 4.809 4.809 0.109 1 0 "[ ]" 1
375 1 20 VAL HB 1 31 ASN HD21 . . 4.200 4.238 4.238 4.238 0.038 1 0 "[ ]" 1
376 1 20 VAL HB 1 98 LEU MD1 . . 6.600 5.331 5.331 5.331 . 0 0 "[ ]" 1
377 1 20 VAL HB 1 101 ALA MB . . 6.100 5.143 5.143 5.143 . 0 0 "[ ]" 1
378 1 20 VAL HB 1 102 THR MG . . 5.300 3.705 3.705 3.705 . 0 0 "[ ]" 1
379 1 20 VAL QG 1 21 GLU H . . 7.360 3.664 3.664 3.664 . 0 0 "[ ]" 1
380 1 20 VAL QG 1 21 GLU HA . . 7.360 3.779 3.779 3.779 . 0 0 "[ ]" 1
381 1 20 VAL QG 1 22 LYS H . . 7.460 4.215 4.215 4.215 . 0 0 "[ ]" 1
382 1 20 VAL QG 1 32 LEU H . . 8.560 2.183 2.183 2.183 . 0 0 "[ ]" 1
383 1 20 VAL QG 1 32 LEU HB2 . . 8.560 2.282 2.282 2.282 . 0 0 "[ ]" 1
384 1 20 VAL QG 1 32 LEU HB3 . . 8.460 3.612 3.612 3.612 . 0 0 "[ ]" 1
385 1 20 VAL QG 1 32 LEU MD1 . . 7.460 2.670 2.670 2.670 . 0 0 "[ ]" 1
386 1 20 VAL QG 1 32 LEU MD2 . . 9.560 4.142 4.142 4.142 . 0 0 "[ ]" 1
387 1 20 VAL QG 1 97 TYR HE2 . . 6.240 2.847 2.847 2.847 . 0 0 "[ ]" 1
388 1 20 VAL QG 1 98 LEU MD1 . . 7.460 3.027 3.027 3.027 . 0 0 "[ ]" 1
389 1 20 VAL QG 1 101 ALA MB . . 6.060 2.454 2.454 2.454 . 0 0 "[ ]" 1
390 1 20 VAL QG 1 102 THR MG . . 6.210 1.824 1.824 1.824 . 0 0 "[ ]" 1
391 1 20 VAL MG1 1 97 TYR HE2 . . 7.000 2.860 2.860 2.860 . 0 0 "[ ]" 1
392 1 20 VAL MG1 1 101 ALA MB . . 6.500 2.525 2.525 2.525 . 0 0 "[ ]" 1
393 1 20 VAL MG1 1 102 THR MG . . 6.600 2.281 2.281 2.281 . 0 0 "[ ]" 1
394 1 20 VAL MG2 1 97 TYR HE2 . . 7.000 5.159 5.159 5.159 . 0 0 "[ ]" 1
395 1 20 VAL MG2 1 101 ALA MB . . 6.500 3.337 3.337 3.337 . 0 0 "[ ]" 1
396 1 20 VAL MG2 1 102 THR MG . . 6.600 1.919 1.919 1.919 . 0 0 "[ ]" 1
397 1 21 GLU H 1 21 GLU QB . . 3.900 2.796 2.796 2.796 . 0 0 "[ ]" 1
398 1 21 GLU H 1 22 LYS H . . 3.400 3.441 3.441 3.441 0.041 1 0 "[ ]" 1
399 1 21 GLU H 1 24 GLY H . . 5.900 2.992 2.992 2.992 . 0 0 "[ ]" 1
400 1 21 GLU HA 1 22 LYS HA . . 4.700 4.216 4.216 4.216 . 0 0 "[ ]" 1
401 1 21 GLU HA 1 22 LYS QB . . 5.400 4.324 4.324 4.324 . 0 0 "[ ]" 1
402 1 21 GLU HA 1 22 LYS QG . . 5.480 2.958 2.958 2.958 . 0 0 "[ ]" 1
403 1 21 GLU QB 1 22 LYS QG . . 7.880 3.857 3.857 3.857 . 0 0 "[ ]" 1
404 1 22 LYS H 1 22 LYS QD . . 5.900 4.641 4.641 4.641 . 0 0 "[ ]" 1
405 1 22 LYS H 1 22 LYS HG2 . . 4.700 3.502 3.502 3.502 . 0 0 "[ ]" 1
406 1 22 LYS H 1 22 LYS QG . . 4.090 2.711 2.711 2.711 . 0 0 "[ ]" 1
407 1 22 LYS H 1 22 LYS HG3 . . 4.700 2.823 2.823 2.823 . 0 0 "[ ]" 1
408 1 22 LYS H 1 23 GLY H . . 5.900 2.709 2.709 2.709 . 0 0 "[ ]" 1
409 1 22 LYS H 1 24 GLY H . . 6.000 4.119 4.119 4.119 . 0 0 "[ ]" 1
410 1 22 LYS HA 1 22 LYS QD . . 4.800 4.069 4.069 4.069 . 0 0 "[ ]" 1
411 1 22 LYS HA 1 22 LYS HG2 . . 3.300 2.674 2.674 2.674 . 0 0 "[ ]" 1
412 1 22 LYS HA 1 22 LYS QG . . 3.080 2.523 2.523 2.523 . 0 0 "[ ]" 1
413 1 22 LYS HA 1 22 LYS HG3 . . 3.300 3.095 3.095 3.095 . 0 0 "[ ]" 1
414 1 22 LYS HA 1 23 GLY H . . 3.300 2.707 2.707 2.707 . 0 0 "[ ]" 1
415 1 22 LYS QD 1 23 GLY H . . 7.000 5.939 5.939 5.939 . 0 0 "[ ]" 1
416 1 22 LYS QG 1 23 GLY H . . 5.640 4.533 4.533 4.533 . 0 0 "[ ]" 1
417 1 22 LYS HG2 1 23 GLY H . . 6.000 5.226 5.226 5.226 . 0 0 "[ ]" 1
418 1 22 LYS HG3 1 23 GLY H . . 6.000 4.971 4.971 4.971 . 0 0 "[ ]" 1
419 1 23 GLY H 1 24 GLY H . . 3.700 2.476 2.476 2.476 . 0 0 "[ ]" 1
420 1 24 GLY H 1 25 LYS H . . 5.400 4.587 4.587 4.587 . 0 0 "[ ]" 1
421 1 24 GLY HA3 1 25 LYS H . . 3.300 2.640 2.640 2.640 . 0 0 "[ ]" 1
422 1 25 LYS H 1 25 LYS HB2 . . 3.600 2.556 2.556 2.556 . 0 0 "[ ]" 1
423 1 25 LYS H 1 25 LYS QB . . 3.390 2.508 2.508 2.508 . 0 0 "[ ]" 1
424 1 25 LYS H 1 25 LYS HB3 . . 3.600 3.630 3.630 3.630 0.030 1 0 "[ ]" 1
425 1 25 LYS H 1 25 LYS QD . . 5.000 3.933 3.933 3.933 . 0 0 "[ ]" 1
426 1 25 LYS H 1 25 LYS QG . . 4.400 2.215 2.215 2.215 . 0 0 "[ ]" 1
427 1 25 LYS H 1 26 HIS H . . 6.000 4.500 4.500 4.500 . 0 0 "[ ]" 1
428 1 25 LYS HA 1 25 LYS QD . . 4.400 3.924 3.924 3.924 . 0 0 "[ ]" 1
429 1 25 LYS HA 1 25 LYS QG . . 4.000 2.414 2.414 2.414 . 0 0 "[ ]" 1
430 1 25 LYS HA 1 26 HIS H . . 3.100 2.135 2.135 2.135 . 0 0 "[ ]" 1
431 1 25 LYS HB2 1 26 HIS H . . 4.100 4.191 4.191 4.191 0.091 1 0 "[ ]" 1
432 1 25 LYS HB3 1 26 HIS H . . 4.100 3.366 3.366 3.366 . 0 0 "[ ]" 1
433 1 25 LYS QG 1 26 HIS H . . 7.000 4.222 4.222 4.222 . 0 0 "[ ]" 1
434 1 26 HIS H 1 26 HIS HB2 . . 3.900 2.438 2.438 2.438 . 0 0 "[ ]" 1
435 1 26 HIS H 1 26 HIS HB3 . . 3.900 3.575 3.575 3.575 . 0 0 "[ ]" 1
436 1 26 HIS H 1 26 HIS HD1 . . 4.100 2.617 2.617 2.617 . 0 0 "[ ]" 1
437 1 26 HIS H 1 26 HIS HD2 . . 4.500 4.553 4.553 4.553 0.053 1 0 "[ ]" 1
438 1 26 HIS H 1 27 LYS QB . . 6.000 4.990 4.990 4.990 . 0 0 "[ ]" 1
439 1 26 HIS HA 1 26 HIS HD2 . . 4.900 4.742 4.742 4.742 . 0 0 "[ ]" 1
440 1 26 HIS HA 1 27 LYS H . . 3.500 2.477 2.477 2.477 . 0 0 "[ ]" 1
441 1 26 HIS HA 1 31 ASN H . . 4.600 4.010 4.010 4.010 . 0 0 "[ ]" 1
442 1 26 HIS QB 1 26 HIS HD2 . . 3.600 2.580 2.580 2.580 . 0 0 "[ ]" 1
443 1 26 HIS QB 1 27 LYS H . . 4.590 3.923 3.923 3.923 . 0 0 "[ ]" 1
444 1 26 HIS QB 1 46 PHE HD2 . . 5.690 4.077 4.077 4.077 . 0 0 "[ ]" 1
445 1 26 HIS HB2 1 26 HIS HD2 . . 3.900 2.882 2.882 2.882 . 0 0 "[ ]" 1
446 1 26 HIS HB2 1 27 LYS H . . 5.400 4.465 4.465 4.465 . 0 0 "[ ]" 1
447 1 26 HIS HB2 1 46 PHE HD2 . . 6.000 5.630 5.630 5.630 . 0 0 "[ ]" 1
448 1 26 HIS HB3 1 26 HIS HD2 . . 3.900 2.911 2.911 2.911 . 0 0 "[ ]" 1
449 1 26 HIS HB3 1 27 LYS H . . 5.400 4.348 4.348 4.348 . 0 0 "[ ]" 1
450 1 26 HIS HB3 1 46 PHE HD2 . . 6.000 4.184 4.184 4.184 . 0 0 "[ ]" 1
451 1 26 HIS HD1 1 30 PRO HA . . 5.700 3.545 3.545 3.545 . 0 0 "[ ]" 1
452 1 26 HIS HD1 1 30 PRO HB2 . . 4.900 4.970 4.970 4.970 0.070 1 0 "[ ]" 1
453 1 26 HIS HD1 1 31 ASN H . . 4.900 3.108 3.108 3.108 . 0 0 "[ ]" 1
454 1 26 HIS HD1 1 46 PHE QB . . 6.880 5.113 5.113 5.113 . 0 0 "[ ]" 1
455 1 26 HIS HD2 1 30 PRO HA . . 6.000 3.929 3.929 3.929 . 0 0 "[ ]" 1
456 1 26 HIS HD2 1 31 ASN H . . 4.600 4.054 4.054 4.054 . 0 0 "[ ]" 1
457 1 26 HIS HD2 1 46 PHE HB2 . . 6.000 2.388 2.388 2.388 . 0 0 "[ ]" 1
458 1 26 HIS HD2 1 46 PHE HB3 . . 6.000 2.748 2.748 2.748 . 0 0 "[ ]" 1
459 1 26 HIS HD2 1 46 PHE HD2 . . 6.000 5.092 5.092 5.092 . 0 0 "[ ]" 1
460 1 27 LYS H 1 27 LYS QD . . 5.300 4.309 4.309 4.309 . 0 0 "[ ]" 1
461 1 27 LYS HA 1 27 LYS QD . . 4.800 4.080 4.080 4.080 . 0 0 "[ ]" 1
462 1 27 LYS QB 1 28 THR H . . 5.300 2.082 2.082 2.082 . 0 0 "[ ]" 1
463 1 28 THR H 1 28 THR HB . . 3.700 3.080 3.080 3.080 . 0 0 "[ ]" 1
464 1 28 THR H 1 29 GLY H . . 4.000 1.961 1.961 1.961 . 0 0 "[ ]" 1
465 1 28 THR HA 1 28 THR MG . . 3.500 2.201 2.201 2.201 . 0 0 "[ ]" 1
466 1 28 THR HB 1 29 GLY H . . 4.100 3.529 3.529 3.529 . 0 0 "[ ]" 1
467 1 28 THR MG 1 29 GLY H . . 6.400 4.417 4.417 4.417 . 0 0 "[ ]" 1
468 1 29 GLY H 1 30 PRO QG . . 6.880 5.941 5.941 5.941 . 0 0 "[ ]" 1
469 1 29 GLY QA 1 30 PRO QG . . 5.410 3.874 3.874 3.874 . 0 0 "[ ]" 1
470 1 29 GLY QA 1 46 PHE HZ . . 5.030 3.353 3.353 3.353 . 0 0 "[ ]" 1
471 1 29 GLY HA3 1 46 PHE HZ . . 5.300 4.900 4.900 4.900 . 0 0 "[ ]" 1
472 1 30 PRO HA 1 31 ASN H . . 3.500 2.541 2.541 2.541 . 0 0 "[ ]" 1
473 1 30 PRO HA 1 31 ASN HB2 . . 6.000 4.796 4.796 4.796 . 0 0 "[ ]" 1
474 1 30 PRO HA 1 31 ASN QB . . 5.740 4.608 4.608 4.608 . 0 0 "[ ]" 1
475 1 30 PRO HA 1 31 ASN HB3 . . 6.000 5.961 5.961 5.961 . 0 0 "[ ]" 1
476 1 30 PRO HA 1 31 ASN HD21 . . 6.000 3.808 3.808 3.808 . 0 0 "[ ]" 1
477 1 30 PRO HA 1 46 PHE HD2 . . 6.000 4.351 4.351 4.351 . 0 0 "[ ]" 1
478 1 30 PRO HB2 1 31 ASN HD21 . . 5.800 4.868 4.868 4.868 . 0 0 "[ ]" 1
479 1 30 PRO QG 1 46 PHE HZ . . 6.880 6.156 6.156 6.156 . 0 0 "[ ]" 1
480 1 31 ASN H 1 31 ASN HB2 . . 4.200 2.304 2.304 2.304 . 0 0 "[ ]" 1
481 1 31 ASN H 1 31 ASN HB3 . . 4.200 3.560 3.560 3.560 . 0 0 "[ ]" 1
482 1 31 ASN H 1 32 LEU H . . 6.000 4.342 4.342 4.342 . 0 0 "[ ]" 1
483 1 31 ASN HA 1 31 ASN HD22 . . 5.000 3.371 3.371 3.371 . 0 0 "[ ]" 1
484 1 31 ASN HA 1 32 LEU H . . 3.600 2.158 2.158 2.158 . 0 0 "[ ]" 1
485 1 31 ASN HD22 1 32 LEU H . . 6.000 5.437 5.437 5.437 . 0 0 "[ ]" 1
486 1 32 LEU H 1 32 LEU MD1 . . 5.600 3.145 3.145 3.145 . 0 0 "[ ]" 1
487 1 32 LEU H 1 32 LEU HG . . 3.800 2.051 2.051 2.051 . 0 0 "[ ]" 1
488 1 32 LEU H 1 33 HIS H . . 4.300 3.318 3.318 3.318 . 0 0 "[ ]" 1
489 1 32 LEU HA 1 32 LEU MD2 . . 3.700 2.493 2.493 2.493 . 0 0 "[ ]" 1
490 1 32 LEU HA 1 32 LEU HG . . 4.100 3.101 3.101 3.101 . 0 0 "[ ]" 1
491 1 32 LEU HA 1 35 LEU MD2 . . 6.700 3.864 3.864 3.864 . 0 0 "[ ]" 1
492 1 32 LEU HB2 1 33 HIS H . . 5.300 4.265 4.265 4.265 . 0 0 "[ ]" 1
493 1 32 LEU HB2 1 35 LEU H . . 5.100 5.187 5.187 5.187 0.087 1 0 "[ ]" 1
494 1 32 LEU HB3 1 33 HIS H . . 5.400 4.549 4.549 4.549 . 0 0 "[ ]" 1
495 1 32 LEU MD1 1 35 LEU MD2 . . 8.000 3.208 3.208 3.208 . 0 0 "[ ]" 1
496 1 32 LEU MD1 1 64 LEU MD2 . . 7.200 3.901 3.901 3.901 . 0 0 "[ ]" 1
497 1 32 LEU MD1 1 98 LEU MD1 . . 6.000 3.558 3.558 3.558 . 0 0 "[ ]" 1
498 1 32 LEU MD1 1 98 LEU MD2 . . 8.000 3.726 3.726 3.726 . 0 0 "[ ]" 1
499 1 32 LEU MD1 1 102 THR MG . . 7.800 3.045 3.045 3.045 . 0 0 "[ ]" 1
500 1 32 LEU MD2 1 35 LEU MD2 . . 6.100 2.301 2.301 2.301 . 0 0 "[ ]" 1
501 1 32 LEU MD2 1 64 LEU MD2 . . 6.600 4.123 4.123 4.123 . 0 0 "[ ]" 1
502 1 32 LEU MD2 1 98 LEU MD2 . . 7.600 5.286 5.286 5.286 . 0 0 "[ ]" 1
503 1 32 LEU HG 1 35 LEU MD2 . . 7.000 4.605 4.605 4.605 . 0 0 "[ ]" 1
504 1 33 HIS H 1 34 GLY H . . 4.900 4.014 4.014 4.014 . 0 0 "[ ]" 1
505 1 33 HIS HA 1 35 LEU H . . 5.100 5.004 5.004 5.004 . 0 0 "[ ]" 1
506 1 33 HIS QB 1 34 GLY H . . 7.000 4.062 4.062 4.062 . 0 0 "[ ]" 1
507 1 34 GLY H 1 35 LEU H . . 4.000 2.655 2.655 2.655 . 0 0 "[ ]" 1
508 1 34 GLY H 1 102 THR HA . . 5.300 2.098 2.098 2.098 . 0 0 "[ ]" 1
509 1 34 GLY H 1 102 THR HB . . 6.000 2.357 2.357 2.357 . 0 0 "[ ]" 1
510 1 34 GLY H 1 102 THR MG . . 7.000 3.176 3.176 3.176 . 0 0 "[ ]" 1
511 1 35 LEU H 1 35 LEU HB2 . . 3.700 2.229 2.229 2.229 . 0 0 "[ ]" 1
512 1 35 LEU H 1 35 LEU QB . . 3.350 2.206 2.206 2.206 . 0 0 "[ ]" 1
513 1 35 LEU H 1 35 LEU HB3 . . 3.700 3.527 3.527 3.527 . 0 0 "[ ]" 1
514 1 35 LEU H 1 35 LEU MD2 . . 5.600 4.075 4.075 4.075 . 0 0 "[ ]" 1
515 1 35 LEU H 1 36 PHE H . . 4.900 2.590 2.590 2.590 . 0 0 "[ ]" 1
516 1 35 LEU H 1 102 THR HB . . 4.400 2.113 2.113 2.113 . 0 0 "[ ]" 1
517 1 35 LEU H 1 102 THR MG . . 7.000 3.858 3.858 3.858 . 0 0 "[ ]" 1
518 1 35 LEU HA 1 35 LEU MD2 . . 4.000 2.126 2.126 2.126 . 0 0 "[ ]" 1
519 1 35 LEU QB 1 36 PHE H . . 4.480 2.605 2.605 2.605 . 0 0 "[ ]" 1
520 1 35 LEU QB 1 36 PHE QD . . 7.780 3.561 3.561 3.561 . 0 0 "[ ]" 1
521 1 35 LEU QB 1 59 TRP HD1 . . 6.280 4.880 4.880 4.880 . 0 0 "[ ]" 1
522 1 35 LEU QB 1 64 LEU MD2 . . 6.380 2.973 2.973 2.973 . 0 0 "[ ]" 1
523 1 35 LEU QB 1 98 LEU MD1 . . 6.780 5.041 5.041 5.041 . 0 0 "[ ]" 1
524 1 35 LEU QB 1 98 LEU MD2 . . 7.080 3.881 3.881 3.881 . 0 0 "[ ]" 1
525 1 35 LEU QB 1 102 THR MG . . 6.180 3.693 3.693 3.693 . 0 0 "[ ]" 1
526 1 35 LEU MD2 1 36 PHE H . . 7.000 4.705 4.705 4.705 . 0 0 "[ ]" 1
527 1 35 LEU MD2 1 59 TRP HB2 . . 7.000 2.921 2.921 2.921 . 0 0 "[ ]" 1
528 1 35 LEU MD2 1 59 TRP HB3 . . 7.000 2.448 2.448 2.448 . 0 0 "[ ]" 1
529 1 35 LEU MD2 1 59 TRP HD1 . . 7.000 2.896 2.896 2.896 . 0 0 "[ ]" 1
530 1 35 LEU MD2 1 64 LEU HG . . 4.700 3.946 3.946 3.946 . 0 0 "[ ]" 1
531 1 35 LEU MD2 1 102 THR MG . . 6.400 4.248 4.248 4.248 . 0 0 "[ ]" 1
532 1 36 PHE H 1 36 PHE HB2 . . 3.300 2.589 2.589 2.589 . 0 0 "[ ]" 1
533 1 36 PHE H 1 36 PHE HB3 . . 3.700 3.598 3.598 3.598 . 0 0 "[ ]" 1
534 1 36 PHE H 1 36 PHE QE . . 5.500 3.769 3.769 3.769 . 0 0 "[ ]" 1
535 1 36 PHE H 1 37 GLY H . . 5.700 4.328 4.328 4.328 . 0 0 "[ ]" 1
536 1 36 PHE HA 1 37 GLY H . . 3.000 2.169 2.169 2.169 . 0 0 "[ ]" 1
537 1 36 PHE HA 1 38 ARG H . . 4.000 3.643 3.643 3.643 . 0 0 "[ ]" 1
538 1 36 PHE HB2 1 37 GLY H . . 5.600 4.462 4.462 4.462 . 0 0 "[ ]" 1
539 1 36 PHE HB3 1 37 GLY H . . 5.300 3.841 3.841 3.841 . 0 0 "[ ]" 1
540 1 36 PHE QD 1 37 GLY H . . 8.000 4.544 4.544 4.544 . 0 0 "[ ]" 1
541 1 36 PHE QD 1 60 LYS HA . . 6.300 2.315 2.315 2.315 . 0 0 "[ ]" 1
542 1 36 PHE QD 1 60 LYS QB . . 7.980 3.271 3.271 3.271 . 0 0 "[ ]" 1
543 1 36 PHE QD 1 61 GLU H . . 8.000 2.507 2.507 2.507 . 0 0 "[ ]" 1
544 1 36 PHE QD 1 61 GLU QB . . 9.000 3.686 3.686 3.686 . 0 0 "[ ]" 1
545 1 36 PHE QD 1 64 LEU MD1 . . 9.000 3.486 3.486 3.486 . 0 0 "[ ]" 1
546 1 36 PHE QD 1 64 LEU MD2 . . 8.100 5.681 5.681 5.681 . 0 0 "[ ]" 1
547 1 36 PHE QD 1 64 LEU HG . . 7.400 5.529 5.529 5.529 . 0 0 "[ ]" 1
548 1 36 PHE QD 1 95 ILE MG . . 9.000 4.458 4.458 4.458 . 0 0 "[ ]" 1
549 1 36 PHE QD 1 99 LYS HA . . 7.300 3.669 3.669 3.669 . 0 0 "[ ]" 1
550 1 36 PHE QD 1 99 LYS QG . . 8.880 3.521 3.521 3.521 . 0 0 "[ ]" 1
551 1 36 PHE QD 1 102 THR MG . . 9.000 5.504 5.504 5.504 . 0 0 "[ ]" 1
552 1 36 PHE QE 1 60 LYS HA . . 7.500 3.630 3.630 3.630 . 0 0 "[ ]" 1
553 1 36 PHE QE 1 60 LYS QB . . 8.880 4.590 4.590 4.590 . 0 0 "[ ]" 1
554 1 36 PHE QE 1 61 GLU H . . 7.500 2.828 2.828 2.828 . 0 0 "[ ]" 1
555 1 36 PHE QE 1 61 GLU HA . . 6.800 2.382 2.382 2.382 . 0 0 "[ ]" 1
556 1 36 PHE QE 1 61 GLU QB . . 8.900 2.504 2.504 2.504 . 0 0 "[ ]" 1
557 1 36 PHE QE 1 61 GLU QG . . 7.780 4.089 4.089 4.089 . 0 0 "[ ]" 1
558 1 36 PHE QE 1 64 LEU MD1 . . 7.600 2.379 2.379 2.379 . 0 0 "[ ]" 1
559 1 36 PHE QE 1 64 LEU MD2 . . 7.800 4.897 4.897 4.897 . 0 0 "[ ]" 1
560 1 36 PHE QE 1 64 LEU HG . . 7.600 4.812 4.812 4.812 . 0 0 "[ ]" 1
561 1 36 PHE QE 1 95 ILE HA . . 8.000 4.369 4.369 4.369 . 0 0 "[ ]" 1
562 1 36 PHE QE 1 95 ILE MD . . 9.000 3.708 3.708 3.708 . 0 0 "[ ]" 1
563 1 36 PHE QE 1 95 ILE MG . . 7.300 2.544 2.544 2.544 . 0 0 "[ ]" 1
564 1 36 PHE QE 1 98 LEU HA . . 7.800 3.921 3.921 3.921 . 0 0 "[ ]" 1
565 1 36 PHE QE 1 98 LEU HB2 . . 7.700 3.650 3.650 3.650 . 0 0 "[ ]" 1
566 1 36 PHE QE 1 98 LEU QB . . 7.210 2.328 2.328 2.328 . 0 0 "[ ]" 1
567 1 36 PHE QE 1 98 LEU HB3 . . 7.700 2.355 2.355 2.355 . 0 0 "[ ]" 1
568 1 36 PHE QE 1 98 LEU MD1 . . 9.000 4.824 4.824 4.824 . 0 0 "[ ]" 1
569 1 36 PHE QE 1 98 LEU MD2 . . 8.800 3.841 3.841 3.841 . 0 0 "[ ]" 1
570 1 36 PHE QE 1 98 LEU HG . . 6.400 4.118 4.118 4.118 . 0 0 "[ ]" 1
571 1 36 PHE QE 1 99 LYS H . . 7.600 3.671 3.671 3.671 . 0 0 "[ ]" 1
572 1 36 PHE QE 1 99 LYS HA . . 6.700 2.620 2.620 2.620 . 0 0 "[ ]" 1
573 1 36 PHE QE 1 99 LYS HB2 . . 8.000 4.666 4.666 4.666 . 0 0 "[ ]" 1
574 1 36 PHE QE 1 99 LYS QB . . 7.470 4.232 4.232 4.232 . 0 0 "[ ]" 1
575 1 36 PHE QE 1 99 LYS HB3 . . 8.000 4.846 4.846 4.846 . 0 0 "[ ]" 1
576 1 36 PHE QE 1 99 LYS QG . . 8.880 2.874 2.874 2.874 . 0 0 "[ ]" 1
577 1 36 PHE HZ 1 61 GLU HA . . 6.000 4.251 4.251 4.251 . 0 0 "[ ]" 1
578 1 36 PHE HZ 1 64 LEU MD1 . . 5.000 2.882 2.882 2.882 . 0 0 "[ ]" 1
579 1 36 PHE HZ 1 64 LEU MD2 . . 6.700 5.022 5.022 5.022 . 0 0 "[ ]" 1
580 1 36 PHE HZ 1 64 LEU HG . . 5.800 5.822 5.822 5.822 0.022 1 0 "[ ]" 1
581 1 36 PHE HZ 1 95 ILE HA . . 4.900 3.271 3.271 3.271 . 0 0 "[ ]" 1
582 1 36 PHE HZ 1 95 ILE MD . . 7.000 3.659 3.659 3.659 . 0 0 "[ ]" 1
583 1 36 PHE HZ 1 95 ILE MG . . 4.400 2.671 2.671 2.671 . 0 0 "[ ]" 1
584 1 36 PHE HZ 1 98 LEU QB . . 5.280 2.055 2.055 2.055 . 0 0 "[ ]" 1
585 1 36 PHE HZ 1 98 LEU MD1 . . 5.500 4.689 4.689 4.689 . 0 0 "[ ]" 1
586 1 36 PHE HZ 1 98 LEU MD2 . . 6.100 2.877 2.877 2.877 . 0 0 "[ ]" 1
587 1 36 PHE HZ 1 99 LYS H . . 4.900 3.765 3.765 3.765 . 0 0 "[ ]" 1
588 1 36 PHE HZ 1 99 LYS HA . . 5.400 4.144 4.144 4.144 . 0 0 "[ ]" 1
589 1 36 PHE HZ 1 99 LYS QB . . 5.980 4.598 4.598 4.598 . 0 0 "[ ]" 1
590 1 37 GLY H 1 38 ARG H . . 3.600 2.278 2.278 2.278 . 0 0 "[ ]" 1
591 1 37 GLY H 1 58 THR MG . . 6.000 3.214 3.214 3.214 . 0 0 "[ ]" 1
592 1 37 GLY H 1 59 TRP HB2 . . 6.000 3.714 3.714 3.714 . 0 0 "[ ]" 1
593 1 37 GLY H 1 60 LYS HA . . 6.000 3.602 3.602 3.602 . 0 0 "[ ]" 1
594 1 37 GLY HA3 1 58 THR MG . . 5.400 3.738 3.738 3.738 . 0 0 "[ ]" 1
595 1 38 ARG H 1 38 ARG HB2 . . 4.000 2.361 2.361 2.361 . 0 0 "[ ]" 1
596 1 38 ARG H 1 38 ARG QB . . 3.750 2.206 2.206 2.206 . 0 0 "[ ]" 1
597 1 38 ARG H 1 38 ARG HB3 . . 4.000 2.646 2.646 2.646 . 0 0 "[ ]" 1
598 1 38 ARG H 1 38 ARG QG . . 4.980 3.928 3.928 3.928 . 0 0 "[ ]" 1
599 1 38 ARG H 1 39 LYS H . . 5.800 4.630 4.630 4.630 . 0 0 "[ ]" 1
600 1 38 ARG H 1 58 THR MG . . 6.400 3.940 3.940 3.940 . 0 0 "[ ]" 1
601 1 38 ARG H 1 59 TRP HB3 . . 5.800 4.536 4.536 4.536 . 0 0 "[ ]" 1
602 1 38 ARG HA 1 38 ARG QG . . 3.820 2.254 2.254 2.254 . 0 0 "[ ]" 1
603 1 38 ARG HA 1 39 LYS H . . 3.400 2.243 2.243 2.243 . 0 0 "[ ]" 1
604 1 38 ARG QB 1 38 ARG HE . . 4.280 2.601 2.601 2.601 . 0 0 "[ ]" 1
605 1 38 ARG QB 1 39 LYS H . . 4.320 3.583 3.583 3.583 . 0 0 "[ ]" 1
606 1 38 ARG HB2 1 39 LYS H . . 4.600 4.214 4.214 4.214 . 0 0 "[ ]" 1
607 1 38 ARG HB2 1 59 TRP HB3 . . 5.400 5.446 5.446 5.446 0.046 1 0 "[ ]" 1
608 1 38 ARG HB3 1 39 LYS H . . 4.600 3.877 3.877 3.877 . 0 0 "[ ]" 1
609 1 38 ARG HB3 1 59 TRP HB3 . . 5.400 4.274 4.274 4.274 . 0 0 "[ ]" 1
610 1 38 ARG HE 1 38 ARG QG . . 3.890 3.075 3.075 3.075 . 0 0 "[ ]" 1
611 1 39 LYS H 1 39 LYS QB . . 3.770 2.322 2.322 2.322 . 0 0 "[ ]" 1
612 1 39 LYS H 1 40 THR H . . 5.700 4.599 4.599 4.599 . 0 0 "[ ]" 1
613 1 39 LYS HA 1 40 THR H . . 3.600 2.379 2.379 2.379 . 0 0 "[ ]" 1
614 1 39 LYS HA 1 40 THR MG . . 7.000 3.548 3.548 3.548 . 0 0 "[ ]" 1
615 1 39 LYS HA 1 58 THR HA . . 5.500 2.824 2.824 2.824 . 0 0 "[ ]" 1
616 1 39 LYS QB 1 40 THR H . . 4.530 3.560 3.560 3.560 . 0 0 "[ ]" 1
617 1 39 LYS QB 1 42 GLN HG2 . . 5.780 4.722 4.722 4.722 . 0 0 "[ ]" 1
618 1 39 LYS QB 1 58 THR HA . . 5.480 4.060 4.060 4.060 . 0 0 "[ ]" 1
619 1 39 LYS HB2 1 40 THR H . . 5.300 4.090 4.090 4.090 . 0 0 "[ ]" 1
620 1 39 LYS HB3 1 40 THR H . . 5.300 3.915 3.915 3.915 . 0 0 "[ ]" 1
621 1 40 THR H 1 40 THR MG . . 4.300 2.076 2.076 2.076 . 0 0 "[ ]" 1
622 1 40 THR H 1 57 ILE H . . 5.100 3.258 3.258 3.258 . 0 0 "[ ]" 1
623 1 40 THR H 1 57 ILE HB . . 6.000 6.016 6.016 6.016 0.016 1 0 "[ ]" 1
624 1 40 THR H 1 57 ILE MD . . 7.000 5.384 5.384 5.384 . 0 0 "[ ]" 1
625 1 40 THR H 1 58 THR HA . . 5.800 4.616 4.616 4.616 . 0 0 "[ ]" 1
626 1 40 THR H 1 59 TRP HE1 . . 6.000 4.605 4.605 4.605 . 0 0 "[ ]" 1
627 1 40 THR HA 1 41 GLY H . . 3.600 2.263 2.263 2.263 . 0 0 "[ ]" 1
628 1 40 THR HA 1 41 GLY QA . . 6.380 4.026 4.026 4.026 . 0 0 "[ ]" 1
629 1 40 THR HA 1 56 GLY HA2 . . 5.000 5.020 5.020 5.020 0.020 1 0 "[ ]" 1
630 1 40 THR HA 1 59 TRP HD1 . . 5.100 3.110 3.110 3.110 . 0 0 "[ ]" 1
631 1 40 THR HA 1 59 TRP HE1 . . 4.200 2.336 2.336 2.336 . 0 0 "[ ]" 1
632 1 40 THR HA 1 59 TRP HZ2 . . 6.000 4.615 4.615 4.615 . 0 0 "[ ]" 1
633 1 40 THR HB 1 41 GLY H . . 4.300 2.645 2.645 2.645 . 0 0 "[ ]" 1
634 1 40 THR HB 1 56 GLY HA2 . . 6.000 4.688 4.688 4.688 . 0 0 "[ ]" 1
635 1 40 THR MG 1 41 GLY H . . 7.000 3.653 3.653 3.653 . 0 0 "[ ]" 1
636 1 40 THR MG 1 55 LYS H . . 7.000 4.145 4.145 4.145 . 0 0 "[ ]" 1
637 1 40 THR MG 1 55 LYS HB2 . . 5.900 3.227 3.227 3.227 . 0 0 "[ ]" 1
638 1 40 THR MG 1 56 GLY H . . 7.000 2.940 2.940 2.940 . 0 0 "[ ]" 1
639 1 40 THR MG 1 57 ILE H . . 5.600 2.146 2.146 2.146 . 0 0 "[ ]" 1
640 1 40 THR MG 1 57 ILE HB . . 6.100 4.303 4.303 4.303 . 0 0 "[ ]" 1
641 1 40 THR MG 1 57 ILE MD . . 5.600 3.084 3.084 3.084 . 0 0 "[ ]" 1
642 1 40 THR MG 1 57 ILE QG . . 6.180 1.990 1.990 1.990 . 0 0 "[ ]" 1
643 1 40 THR MG 1 59 TRP HD1 . . 6.700 3.671 3.671 3.671 . 0 0 "[ ]" 1
644 1 40 THR MG 1 59 TRP HE1 . . 5.400 2.341 2.341 2.341 . 0 0 "[ ]" 1
645 1 40 THR MG 1 59 TRP HH2 . . 7.000 4.092 4.092 4.092 . 0 0 "[ ]" 1
646 1 40 THR MG 1 59 TRP HZ2 . . 5.100 2.668 2.668 2.668 . 0 0 "[ ]" 1
647 1 41 GLY H 1 53 LYS HA . . 5.200 4.096 4.096 4.096 . 0 0 "[ ]" 1
648 1 41 GLY H 1 59 TRP HE1 . . 5.900 3.079 3.079 3.079 . 0 0 "[ ]" 1
649 1 41 GLY QA 1 42 GLN QB . . 5.980 4.202 4.202 4.202 . 0 0 "[ ]" 1
650 1 41 GLY QA 1 53 LYS HA . . 3.600 2.467 2.467 2.467 . 0 0 "[ ]" 1
651 1 41 GLY QA 1 53 LYS QB . . 6.180 2.253 2.253 2.253 . 0 0 "[ ]" 1
652 1 41 GLY HA3 1 53 LYS HA . . 3.800 2.497 2.497 2.497 . 0 0 "[ ]" 1
653 1 42 GLN H 1 42 GLN HG2 . . 3.200 3.063 3.063 3.063 . 0 0 "[ ]" 1
654 1 42 GLN H 1 42 GLN HG3 . . 3.500 2.575 2.575 2.575 . 0 0 "[ ]" 1
655 1 42 GLN HA 1 42 GLN HG2 . . 3.400 2.525 2.525 2.525 . 0 0 "[ ]" 1
656 1 42 GLN HA 1 42 GLN HG3 . . 3.300 3.164 3.164 3.164 . 0 0 "[ ]" 1
657 1 42 GLN HA 1 43 ALA HA . . 6.000 4.539 4.539 4.539 . 0 0 "[ ]" 1
658 1 42 GLN QB 1 48 TYR HD2 . . 6.300 5.118 5.118 5.118 . 0 0 "[ ]" 1
659 1 42 GLN HG2 1 43 ALA H . . 5.400 5.063 5.063 5.063 . 0 0 "[ ]" 1
660 1 42 GLN HG3 1 43 ALA H . . 5.100 5.143 5.143 5.143 0.043 1 0 "[ ]" 1
661 1 43 ALA H 1 43 ALA MB . . 3.500 2.444 2.444 2.444 . 0 0 "[ ]" 1
662 1 43 ALA H 1 44 PRO HD2 . . 5.200 4.081 4.081 4.081 . 0 0 "[ ]" 1
663 1 43 ALA H 1 47 THR HG1 . . 4.700 4.783 4.783 4.783 0.083 1 0 "[ ]" 1
664 1 43 ALA H 1 48 TYR HE1 . . 5.800 5.808 5.808 5.808 0.008 1 0 "[ ]" 1
665 1 43 ALA H 1 48 TYR HE2 . . 5.100 2.003 2.003 2.003 . 0 0 "[ ]" 1
666 1 43 ALA MB 1 46 PHE H . . 3.600 3.011 3.011 3.011 . 0 0 "[ ]" 1
667 1 43 ALA MB 1 46 PHE HB2 . . 6.600 4.012 4.012 4.012 . 0 0 "[ ]" 1
668 1 43 ALA MB 1 46 PHE QB . . 6.200 2.449 2.449 2.449 . 0 0 "[ ]" 1
669 1 43 ALA MB 1 46 PHE HB3 . . 6.600 2.470 2.470 2.470 . 0 0 "[ ]" 1
670 1 43 ALA MB 1 47 THR HA . . 3.600 2.999 2.999 2.999 . 0 0 "[ ]" 1
671 1 43 ALA MB 1 47 THR HG1 . . 5.900 4.345 4.345 4.345 . 0 0 "[ ]" 1
672 1 43 ALA MB 1 47 THR MG . . 7.900 4.455 4.455 4.455 . 0 0 "[ ]" 1
673 1 43 ALA MB 1 48 TYR HD1 . . 7.000 5.546 5.546 5.546 . 0 0 "[ ]" 1
674 1 44 PRO HA 1 45 GLY QA . . 5.380 4.464 4.464 4.464 . 0 0 "[ ]" 1
675 1 45 GLY H 1 46 PHE H . . 6.000 2.836 2.836 2.836 . 0 0 "[ ]" 1
676 1 45 GLY QA 1 46 PHE QB . . 7.750 3.735 3.735 3.735 . 0 0 "[ ]" 1
677 1 46 PHE H 1 46 PHE HB2 . . 3.600 3.499 3.499 3.499 . 0 0 "[ ]" 1
678 1 46 PHE H 1 46 PHE QB . . 3.390 2.840 2.840 2.840 . 0 0 "[ ]" 1
679 1 46 PHE H 1 46 PHE HB3 . . 3.600 3.004 3.004 3.004 . 0 0 "[ ]" 1
680 1 46 PHE H 1 47 THR H . . 4.400 2.896 2.896 2.896 . 0 0 "[ ]" 1
681 1 46 PHE HA 1 46 PHE HD2 . . 4.300 4.239 4.239 4.239 . 0 0 "[ ]" 1
682 1 46 PHE HA 1 47 THR HB . . 6.000 4.796 4.796 4.796 . 0 0 "[ ]" 1
683 1 46 PHE HD2 1 48 TYR HA . . 6.000 4.159 4.159 4.159 . 0 0 "[ ]" 1
684 1 46 PHE HE2 1 48 TYR HA . . 5.500 4.192 4.192 4.192 . 0 0 "[ ]" 1
685 1 46 PHE HE2 1 48 TYR QB . . 6.880 5.321 5.321 5.321 . 0 0 "[ ]" 1
686 1 46 PHE HZ 1 79 LYS QE . . 6.800 3.211 3.211 3.211 . 0 0 "[ ]" 1
687 1 47 THR H 1 47 THR HB . . 3.800 2.513 2.513 2.513 . 0 0 "[ ]" 1
688 1 47 THR H 1 47 THR MG . . 4.800 3.755 3.755 3.755 . 0 0 "[ ]" 1
689 1 47 THR H 1 48 TYR H . . 4.400 4.393 4.393 4.393 . 0 0 "[ ]" 1
690 1 47 THR HA 1 47 THR MG . . 3.600 2.432 2.432 2.432 . 0 0 "[ ]" 1
691 1 47 THR HA 1 48 TYR H . . 3.100 1.983 1.983 1.983 . 0 0 "[ ]" 1
692 1 47 THR HG1 1 48 TYR HE1 . . 5.000 5.030 5.030 5.030 0.030 1 0 "[ ]" 1
693 1 47 THR HG1 1 48 TYR HE2 . . 5.000 5.006 5.006 5.006 0.006 1 0 "[ ]" 1
694 1 47 THR MG 1 48 TYR H . . 6.200 2.868 2.868 2.868 . 0 0 "[ ]" 1
695 1 48 TYR H 1 48 TYR HB2 . . 3.800 3.467 3.467 3.467 . 0 0 "[ ]" 1
696 1 48 TYR H 1 48 TYR QB . . 3.600 2.584 2.584 2.584 . 0 0 "[ ]" 1
697 1 48 TYR H 1 48 TYR HB3 . . 3.800 2.666 2.666 2.666 . 0 0 "[ ]" 1
698 1 48 TYR H 1 48 TYR HD1 . . 5.000 3.387 3.387 3.387 . 0 0 "[ ]" 1
699 1 48 TYR H 1 49 THR H . . 6.000 4.577 4.577 4.577 . 0 0 "[ ]" 1
700 1 48 TYR HA 1 48 TYR HD1 . . 4.400 4.108 4.108 4.108 . 0 0 "[ ]" 1
701 1 48 TYR HA 1 48 TYR HD2 . . 4.100 4.140 4.140 4.140 0.040 1 0 "[ ]" 1
702 1 48 TYR HA 1 49 THR H . . 3.600 2.428 2.428 2.428 . 0 0 "[ ]" 1
703 1 48 TYR HA 1 49 THR HG1 . . 6.000 3.666 3.666 3.666 . 0 0 "[ ]" 1
704 1 48 TYR QB 1 49 THR H . . 4.430 2.313 2.313 2.313 . 0 0 "[ ]" 1
705 1 48 TYR QB 1 50 ASP H . . 5.680 2.103 2.103 2.103 . 0 0 "[ ]" 1
706 1 48 TYR HB2 1 49 THR H . . 4.900 2.358 2.358 2.358 . 0 0 "[ ]" 1
707 1 48 TYR HB3 1 49 THR H . . 4.900 3.349 3.349 3.349 . 0 0 "[ ]" 1
708 1 48 TYR HD2 1 49 THR H . . 6.000 5.512 5.512 5.512 . 0 0 "[ ]" 1
709 1 49 THR H 1 49 THR HB . . 4.000 2.373 2.373 2.373 . 0 0 "[ ]" 1
710 1 49 THR H 1 49 THR HG1 . . 3.600 1.957 1.957 1.957 . 0 0 "[ ]" 1
711 1 49 THR H 1 49 THR MG . . 4.300 3.673 3.673 3.673 . 0 0 "[ ]" 1
712 1 49 THR H 1 50 ASP H . . 4.900 2.574 2.574 2.574 . 0 0 "[ ]" 1
713 1 49 THR H 1 52 ASN H . . 5.700 3.848 3.848 3.848 . 0 0 "[ ]" 1
714 1 49 THR H 1 52 ASN QB . . 6.180 3.471 3.471 3.471 . 0 0 "[ ]" 1
715 1 49 THR HA 1 49 THR HG1 . . 3.500 3.106 3.106 3.106 . 0 0 "[ ]" 1
716 1 49 THR HA 1 50 ASP H . . 3.400 3.386 3.386 3.386 . 0 0 "[ ]" 1
717 1 49 THR HA 1 50 ASP QB . . 7.000 4.298 4.298 4.298 . 0 0 "[ ]" 1
718 1 49 THR HA 1 51 ALA H . . 4.100 4.129 4.129 4.129 0.029 1 0 "[ ]" 1
719 1 49 THR HB 1 50 ASP H . . 3.500 3.304 3.304 3.304 . 0 0 "[ ]" 1
720 1 49 THR HB 1 51 ALA H . . 3.400 3.128 3.128 3.128 . 0 0 "[ ]" 1
721 1 49 THR HB 1 51 ALA MB . . 5.800 2.591 2.591 2.591 . 0 0 "[ ]" 1
722 1 49 THR HB 1 52 ASN H . . 4.900 2.809 2.809 2.809 . 0 0 "[ ]" 1
723 1 49 THR HG1 1 51 ALA H . . 6.000 5.196 5.196 5.196 . 0 0 "[ ]" 1
724 1 49 THR HG1 1 51 ALA MB . . 6.700 4.481 4.481 4.481 . 0 0 "[ ]" 1
725 1 49 THR HG1 1 52 ASN H . . 5.200 4.561 4.561 4.561 . 0 0 "[ ]" 1
726 1 49 THR HG1 1 52 ASN HB2 . . 6.000 4.479 4.479 4.479 . 0 0 "[ ]" 1
727 1 49 THR HG1 1 52 ASN HB3 . . 6.000 6.020 6.020 6.020 0.020 1 0 "[ ]" 1
728 1 49 THR HG1 1 78 THR HA . . 5.300 5.152 5.152 5.152 . 0 0 "[ ]" 1
729 1 49 THR MG 1 50 ASP H . . 5.500 4.061 4.061 4.061 . 0 0 "[ ]" 1
730 1 49 THR MG 1 51 ALA H . . 6.200 2.575 2.575 2.575 . 0 0 "[ ]" 1
731 1 49 THR MG 1 51 ALA MB . . 6.400 2.307 2.307 2.307 . 0 0 "[ ]" 1
732 1 49 THR MG 1 52 ASN H . . 6.100 3.931 3.931 3.931 . 0 0 "[ ]" 1
733 1 49 THR MG 1 79 LYS H . . 5.200 3.553 3.553 3.553 . 0 0 "[ ]" 1
734 1 49 THR MG 1 79 LYS HA . . 7.000 4.280 4.280 4.280 . 0 0 "[ ]" 1
735 1 49 THR MG 1 79 LYS HB2 . . 6.500 2.468 2.468 2.468 . 0 0 "[ ]" 1
736 1 49 THR MG 1 79 LYS QB . . 6.100 2.437 2.437 2.437 . 0 0 "[ ]" 1
737 1 49 THR MG 1 79 LYS HB3 . . 6.500 3.762 3.762 3.762 . 0 0 "[ ]" 1
738 1 49 THR MG 1 79 LYS QE . . 7.800 4.671 4.671 4.671 . 0 0 "[ ]" 1
739 1 50 ASP H 1 51 ALA H . . 3.700 3.196 3.196 3.196 . 0 0 "[ ]" 1
740 1 50 ASP H 1 51 ALA HA . . 5.200 5.289 5.289 5.289 0.089 1 0 "[ ]" 1
741 1 50 ASP H 1 53 LYS H . . 4.100 4.102 4.102 4.102 0.002 1 0 "[ ]" 1
742 1 50 ASP HA 1 53 LYS H . . 4.400 4.232 4.232 4.232 . 0 0 "[ ]" 1
743 1 50 ASP HA 1 53 LYS QB . . 4.600 2.205 2.205 2.205 . 0 0 "[ ]" 1
744 1 50 ASP HA 1 54 ASN H . . 4.400 3.876 3.876 3.876 . 0 0 "[ ]" 1
745 1 50 ASP QB 1 51 ALA HA . . 6.200 4.412 4.412 4.412 . 0 0 "[ ]" 1
746 1 50 ASP QB 1 54 ASN HD21 . . 7.000 4.002 4.002 4.002 . 0 0 "[ ]" 1
747 1 50 ASP QB 1 54 ASN HD22 . . 7.000 3.324 3.324 3.324 . 0 0 "[ ]" 1
748 1 51 ALA H 1 51 ALA MB . . 3.500 2.246 2.246 2.246 . 0 0 "[ ]" 1
749 1 51 ALA H 1 52 ASN H . . 3.800 3.138 3.138 3.138 . 0 0 "[ ]" 1
750 1 51 ALA HA 1 53 LYS H . . 6.000 5.800 5.800 5.800 . 0 0 "[ ]" 1
751 1 51 ALA HA 1 54 ASN H . . 4.300 3.585 3.585 3.585 . 0 0 "[ ]" 1
752 1 51 ALA HA 1 54 ASN HB2 . . 4.600 2.707 2.707 2.707 . 0 0 "[ ]" 1
753 1 51 ALA HA 1 54 ASN HB3 . . 4.600 4.281 4.281 4.281 . 0 0 "[ ]" 1
754 1 51 ALA HA 1 54 ASN HD22 . . 6.000 4.217 4.217 4.217 . 0 0 "[ ]" 1
755 1 51 ALA HA 1 55 LYS H . . 4.900 4.639 4.639 4.639 . 0 0 "[ ]" 1
756 1 51 ALA HA 1 75 ILE MG . . 7.000 3.736 3.736 3.736 . 0 0 "[ ]" 1
757 1 51 ALA MB 1 52 ASN H . . 3.700 2.351 2.351 2.351 . 0 0 "[ ]" 1
758 1 51 ALA MB 1 54 ASN H . . 7.000 4.518 4.518 4.518 . 0 0 "[ ]" 1
759 1 51 ALA MB 1 54 ASN QB . . 6.280 4.129 4.129 4.129 . 0 0 "[ ]" 1
760 1 51 ALA MB 1 75 ILE MD . . 7.200 4.564 4.564 4.564 . 0 0 "[ ]" 1
761 1 51 ALA MB 1 75 ILE MG . . 5.300 2.260 2.260 2.260 . 0 0 "[ ]" 1
762 1 51 ALA MB 1 78 THR H . . 6.300 4.101 4.101 4.101 . 0 0 "[ ]" 1
763 1 51 ALA MB 1 78 THR HA . . 5.900 3.695 3.695 3.695 . 0 0 "[ ]" 1
764 1 51 ALA MB 1 78 THR HB . . 6.600 4.893 4.893 4.893 . 0 0 "[ ]" 1
765 1 52 ASN H 1 52 ASN HB2 . . 3.800 2.220 2.220 2.220 . 0 0 "[ ]" 1
766 1 52 ASN H 1 52 ASN QB . . 3.500 2.197 2.197 2.197 . 0 0 "[ ]" 1
767 1 52 ASN H 1 52 ASN HB3 . . 3.800 3.505 3.505 3.505 . 0 0 "[ ]" 1
768 1 52 ASN H 1 53 LYS H . . 3.900 3.272 3.272 3.272 . 0 0 "[ ]" 1
769 1 52 ASN H 1 53 LYS QB . . 6.000 3.552 3.552 3.552 . 0 0 "[ ]" 1
770 1 52 ASN H 1 54 ASN H . . 4.600 3.845 3.845 3.845 . 0 0 "[ ]" 1
771 1 52 ASN H 1 75 ILE MG . . 6.800 3.138 3.138 3.138 . 0 0 "[ ]" 1
772 1 52 ASN HA 1 54 ASN H . . 4.000 4.068 4.068 4.068 0.068 1 0 "[ ]" 1
773 1 52 ASN HA 1 55 LYS H . . 5.000 3.671 3.671 3.671 . 0 0 "[ ]" 1
774 1 52 ASN HA 1 55 LYS HB2 . . 6.000 3.438 3.438 3.438 . 0 0 "[ ]" 1
775 1 52 ASN HA 1 56 GLY H . . 6.000 5.336 5.336 5.336 . 0 0 "[ ]" 1
776 1 52 ASN HA 1 75 ILE MG . . 4.900 2.188 2.188 2.188 . 0 0 "[ ]" 1
777 1 52 ASN QB 1 53 LYS H . . 4.010 2.039 2.039 2.039 . 0 0 "[ ]" 1
778 1 52 ASN QB 1 75 ILE HB . . 5.980 5.356 5.356 5.356 . 0 0 "[ ]" 1
779 1 52 ASN QB 1 75 ILE MG . . 6.840 3.586 3.586 3.586 . 0 0 "[ ]" 1
780 1 52 ASN HB2 1 53 LYS H . . 4.300 2.247 2.247 2.247 . 0 0 "[ ]" 1
781 1 52 ASN HB2 1 54 ASN H . . 5.200 4.783 4.783 4.783 . 0 0 "[ ]" 1
782 1 52 ASN HB2 1 75 ILE MG . . 7.000 3.969 3.969 3.969 . 0 0 "[ ]" 1
783 1 52 ASN HB3 1 53 LYS H . . 4.300 2.336 2.336 2.336 . 0 0 "[ ]" 1
784 1 52 ASN HB3 1 54 ASN H . . 5.200 5.112 5.112 5.112 . 0 0 "[ ]" 1
785 1 52 ASN HB3 1 75 ILE MG . . 7.000 4.087 4.087 4.087 . 0 0 "[ ]" 1
786 1 53 LYS H 1 53 LYS QG . . 4.500 3.783 3.783 3.783 . 0 0 "[ ]" 1
787 1 53 LYS H 1 54 ASN H . . 3.700 3.485 3.485 3.485 . 0 0 "[ ]" 1
788 1 53 LYS H 1 55 LYS H . . 5.200 4.772 4.772 4.772 . 0 0 "[ ]" 1
789 1 53 LYS HA 1 53 LYS HE2 . . 4.000 3.602 3.602 3.602 . 0 0 "[ ]" 1
790 1 53 LYS HA 1 53 LYS QE . . 3.800 3.413 3.413 3.413 . 0 0 "[ ]" 1
791 1 53 LYS HA 1 53 LYS HE3 . . 4.000 4.230 4.230 4.230 0.230 1 0 "[ ]" 1
792 1 53 LYS HA 1 53 LYS QG . . 3.800 3.266 3.266 3.266 . 0 0 "[ ]" 1
793 1 53 LYS HA 1 55 LYS H . . 5.500 4.727 4.727 4.727 . 0 0 "[ ]" 1
794 1 53 LYS QB 1 54 ASN H . . 4.800 2.886 2.886 2.886 . 0 0 "[ ]" 1
795 1 53 LYS QG 1 54 ASN H . . 7.000 2.707 2.707 2.707 . 0 0 "[ ]" 1
796 1 54 ASN H 1 54 ASN HB2 . . 3.700 2.311 2.311 2.311 . 0 0 "[ ]" 1
797 1 54 ASN H 1 54 ASN HB3 . . 3.700 3.571 3.571 3.571 . 0 0 "[ ]" 1
798 1 54 ASN H 1 55 LYS H . . 3.500 2.646 2.646 2.646 . 0 0 "[ ]" 1
799 1 54 ASN HB2 1 54 ASN HD22 . . 3.800 3.531 3.531 3.531 . 0 0 "[ ]" 1
800 1 54 ASN HB2 1 55 LYS H . . 3.600 3.047 3.047 3.047 . 0 0 "[ ]" 1
801 1 54 ASN HB3 1 54 ASN HD22 . . 3.800 3.834 3.834 3.834 0.034 1 0 "[ ]" 1
802 1 54 ASN HB3 1 55 LYS H . . 3.600 3.670 3.670 3.670 0.070 1 0 "[ ]" 1
803 1 55 LYS H 1 55 LYS HB2 . . 3.700 2.153 2.153 2.153 . 0 0 "[ ]" 1
804 1 55 LYS H 1 55 LYS HB3 . . 3.500 3.362 3.362 3.362 . 0 0 "[ ]" 1
805 1 55 LYS H 1 56 GLY H . . 4.000 2.804 2.804 2.804 . 0 0 "[ ]" 1
806 1 55 LYS H 1 75 ILE MD . . 7.000 4.233 4.233 4.233 . 0 0 "[ ]" 1
807 1 55 LYS H 1 75 ILE MG . . 7.000 4.230 4.230 4.230 . 0 0 "[ ]" 1
808 1 55 LYS HA 1 75 ILE MD . . 6.400 5.332 5.332 5.332 . 0 0 "[ ]" 1
809 1 55 LYS HB2 1 56 GLY H . . 4.300 3.327 3.327 3.327 . 0 0 "[ ]" 1
810 1 55 LYS HB2 1 57 ILE H . . 4.400 4.393 4.393 4.393 . 0 0 "[ ]" 1
811 1 55 LYS HB2 1 75 ILE MD . . 5.500 2.867 2.867 2.867 . 0 0 "[ ]" 1
812 1 55 LYS HB3 1 56 GLY H . . 4.700 3.079 3.079 3.079 . 0 0 "[ ]" 1
813 1 55 LYS HB3 1 75 ILE MD . . 5.100 3.388 3.388 3.388 . 0 0 "[ ]" 1
814 1 56 GLY H 1 57 ILE H . . 4.100 2.882 2.882 2.882 . 0 0 "[ ]" 1
815 1 56 GLY HA2 1 57 ILE HA . . 4.600 4.631 4.631 4.631 0.031 1 0 "[ ]" 1
816 1 57 ILE H 1 57 ILE MD . . 5.200 3.796 3.796 3.796 . 0 0 "[ ]" 1
817 1 57 ILE H 1 57 ILE HG12 . . 3.000 2.154 2.154 2.154 . 0 0 "[ ]" 1
818 1 57 ILE H 1 57 ILE HG13 . . 3.000 3.021 3.021 3.021 0.021 1 0 "[ ]" 1
819 1 57 ILE H 1 57 ILE MG . . 4.400 2.319 2.319 2.319 . 0 0 "[ ]" 1
820 1 57 ILE H 1 58 THR H . . 5.200 4.352 4.352 4.352 . 0 0 "[ ]" 1
821 1 57 ILE HA 1 57 ILE HB . . 2.600 2.396 2.396 2.396 . 0 0 "[ ]" 1
822 1 57 ILE HA 1 57 ILE HG12 . . 3.800 3.801 3.801 3.801 0.001 1 0 "[ ]" 1
823 1 57 ILE HA 1 57 ILE QG . . 3.600 3.315 3.315 3.315 . 0 0 "[ ]" 1
824 1 57 ILE HA 1 57 ILE HG13 . . 3.800 3.652 3.652 3.652 . 0 0 "[ ]" 1
825 1 57 ILE HA 1 58 THR H . . 3.100 2.992 2.992 2.992 . 0 0 "[ ]" 1
826 1 57 ILE HA 1 58 THR HB . . 5.000 5.020 5.020 5.020 0.020 1 0 "[ ]" 1
827 1 57 ILE HB 1 57 ILE QG . . 2.690 2.428 2.428 2.428 . 0 0 "[ ]" 1
828 1 57 ILE HB 1 58 THR H . . 3.600 1.972 1.972 1.972 . 0 0 "[ ]" 1
829 1 57 ILE HB 1 74 TYR QE . . 6.900 4.727 4.727 4.727 . 0 0 "[ ]" 1
830 1 57 ILE MD 1 58 THR H . . 5.900 2.963 2.963 2.963 . 0 0 "[ ]" 1
831 1 57 ILE MD 1 59 TRP H . . 7.000 4.708 4.708 4.708 . 0 0 "[ ]" 1
832 1 57 ILE MD 1 59 TRP HD1 . . 7.000 5.448 5.448 5.448 . 0 0 "[ ]" 1
833 1 57 ILE MD 1 59 TRP HE3 . . 6.400 3.353 3.353 3.353 . 0 0 "[ ]" 1
834 1 57 ILE MD 1 59 TRP HZ2 . . 7.000 3.811 3.811 3.811 . 0 0 "[ ]" 1
835 1 57 ILE MD 1 59 TRP HZ3 . . 6.900 2.826 2.826 2.826 . 0 0 "[ ]" 1
836 1 57 ILE MD 1 63 THR HA . . 7.000 4.022 4.022 4.022 . 0 0 "[ ]" 1
837 1 57 ILE MD 1 63 THR HB . . 4.900 2.324 2.324 2.324 . 0 0 "[ ]" 1
838 1 57 ILE MD 1 63 THR HG1 . . 6.200 3.316 3.316 3.316 . 0 0 "[ ]" 1
839 1 57 ILE MD 1 63 THR MG . . 6.100 2.362 2.362 2.362 . 0 0 "[ ]" 1
840 1 57 ILE MD 1 74 TYR QD . . 9.000 2.260 2.260 2.260 . 0 0 "[ ]" 1
841 1 57 ILE MD 1 74 TYR QE . . 7.300 2.332 2.332 2.332 . 0 0 "[ ]" 1
842 1 57 ILE QG 1 58 THR H . . 4.590 2.454 2.454 2.454 . 0 0 "[ ]" 1
843 1 57 ILE QG 1 59 TRP H . . 6.880 3.812 3.812 3.812 . 0 0 "[ ]" 1
844 1 57 ILE QG 1 59 TRP HD1 . . 5.380 4.861 4.861 4.861 . 0 0 "[ ]" 1
845 1 57 ILE QG 1 59 TRP HE1 . . 6.580 4.566 4.566 4.566 . 0 0 "[ ]" 1
846 1 57 ILE QG 1 59 TRP HZ3 . . 5.980 4.663 4.663 4.663 . 0 0 "[ ]" 1
847 1 57 ILE QG 1 63 THR HA . . 6.880 6.167 6.167 6.167 . 0 0 "[ ]" 1
848 1 57 ILE QG 1 63 THR MG . . 5.780 3.946 3.946 3.946 . 0 0 "[ ]" 1
849 1 57 ILE QG 1 74 TYR QE . . 7.610 4.466 4.466 4.466 . 0 0 "[ ]" 1
850 1 57 ILE HG12 1 58 THR H . . 5.100 3.865 3.865 3.865 . 0 0 "[ ]" 1
851 1 57 ILE HG12 1 74 TYR QD . . 8.000 4.241 4.241 4.241 . 0 0 "[ ]" 1
852 1 57 ILE HG12 1 74 TYR QE . . 8.000 4.997 4.997 4.997 . 0 0 "[ ]" 1
853 1 57 ILE HG13 1 58 THR H . . 5.100 2.482 2.482 2.482 . 0 0 "[ ]" 1
854 1 57 ILE HG13 1 74 TYR QD . . 8.000 5.000 5.000 5.000 . 0 0 "[ ]" 1
855 1 57 ILE HG13 1 74 TYR QE . . 8.000 5.028 5.028 5.028 . 0 0 "[ ]" 1
856 1 57 ILE MG 1 74 TYR QE . . 7.500 4.059 4.059 4.059 . 0 0 "[ ]" 1
857 1 58 THR H 1 58 THR HB . . 3.300 2.833 2.833 2.833 . 0 0 "[ ]" 1
858 1 58 THR H 1 58 THR MG . . 4.800 3.945 3.945 3.945 . 0 0 "[ ]" 1
859 1 58 THR H 1 59 TRP H . . 5.100 4.025 4.025 4.025 . 0 0 "[ ]" 1
860 1 58 THR H 1 59 TRP HE3 . . 6.000 5.778 5.778 5.778 . 0 0 "[ ]" 1
861 1 58 THR H 1 63 THR HG1 . . 5.100 3.903 3.903 3.903 . 0 0 "[ ]" 1
862 1 58 THR H 1 63 THR MG . . 5.800 3.357 3.357 3.357 . 0 0 "[ ]" 1
863 1 58 THR HA 1 58 THR MG . . 3.700 2.314 2.314 2.314 . 0 0 "[ ]" 1
864 1 58 THR MG 1 59 TRP H . . 5.400 3.098 3.098 3.098 . 0 0 "[ ]" 1
865 1 59 TRP H 1 59 TRP HD1 . . 4.100 3.429 3.429 3.429 . 0 0 "[ ]" 1
866 1 59 TRP H 1 59 TRP HE3 . . 6.000 4.841 4.841 4.841 . 0 0 "[ ]" 1
867 1 59 TRP HB2 1 59 TRP HD1 . . 3.600 2.497 2.497 2.497 . 0 0 "[ ]" 1
868 1 59 TRP HB3 1 59 TRP HD1 . . 3.600 3.510 3.510 3.510 . 0 0 "[ ]" 1
869 1 59 TRP HE3 1 63 THR HB . . 6.000 2.584 2.584 2.584 . 0 0 "[ ]" 1
870 1 59 TRP HE3 1 63 THR HG1 . . 6.000 3.260 3.260 3.260 . 0 0 "[ ]" 1
871 1 59 TRP HE3 1 63 THR MG . . 7.000 4.129 4.129 4.129 . 0 0 "[ ]" 1
872 1 59 TRP HE3 1 64 LEU H . . 5.200 3.094 3.094 3.094 . 0 0 "[ ]" 1
873 1 59 TRP HE3 1 64 LEU HA . . 5.200 3.047 3.047 3.047 . 0 0 "[ ]" 1
874 1 59 TRP HE3 1 64 LEU HB2 . . 4.600 4.539 4.539 4.539 . 0 0 "[ ]" 1
875 1 59 TRP HE3 1 64 LEU MD1 . . 5.300 4.090 4.090 4.090 . 0 0 "[ ]" 1
876 1 59 TRP HE3 1 64 LEU MD2 . . 5.200 2.829 2.829 2.829 . 0 0 "[ ]" 1
877 1 59 TRP HH2 1 67 TYR HB2 . . 5.000 2.378 2.378 2.378 . 0 0 "[ ]" 1
878 1 59 TRP HH2 1 74 TYR QB . . 6.780 3.315 3.315 3.315 . 0 0 "[ ]" 1
879 1 59 TRP HH2 1 74 TYR QD . . 7.400 2.715 2.715 2.715 . 0 0 "[ ]" 1
880 1 59 TRP HH2 1 74 TYR QE . . 7.700 4.309 4.309 4.309 . 0 0 "[ ]" 1
881 1 59 TRP HH2 1 75 ILE MD . . 5.500 2.900 2.900 2.900 . 0 0 "[ ]" 1
882 1 59 TRP HZ2 1 75 ILE MD . . 6.500 2.660 2.660 2.660 . 0 0 "[ ]" 1
883 1 59 TRP HZ3 1 63 THR HA . . 4.600 3.762 3.762 3.762 . 0 0 "[ ]" 1
884 1 59 TRP HZ3 1 63 THR HB . . 6.000 2.667 2.667 2.667 . 0 0 "[ ]" 1
885 1 59 TRP HZ3 1 64 LEU HA . . 4.300 3.152 3.152 3.152 . 0 0 "[ ]" 1
886 1 59 TRP HZ3 1 64 LEU HB2 . . 5.700 5.711 5.711 5.711 0.011 1 0 "[ ]" 1
887 1 59 TRP HZ3 1 64 LEU MD1 . . 7.000 5.755 5.755 5.755 . 0 0 "[ ]" 1
888 1 59 TRP HZ3 1 64 LEU MD2 . . 6.000 3.804 3.804 3.804 . 0 0 "[ ]" 1
889 1 59 TRP HZ3 1 66 GLU HB3 . . 5.300 5.453 5.453 5.453 0.153 1 0 "[ ]" 1
890 1 59 TRP HZ3 1 67 TYR H . . 5.500 3.279 3.279 3.279 . 0 0 "[ ]" 1
891 1 59 TRP HZ3 1 67 TYR HA . . 5.400 4.622 4.622 4.622 . 0 0 "[ ]" 1
892 1 59 TRP HZ3 1 67 TYR HB2 . . 4.300 2.309 2.309 2.309 . 0 0 "[ ]" 1
893 1 59 TRP HZ3 1 67 TYR HB3 . . 4.400 2.727 2.727 2.727 . 0 0 "[ ]" 1
894 1 60 LYS HA 1 62 GLU H . . 5.800 4.988 4.988 4.988 . 0 0 "[ ]" 1
895 1 60 LYS HA 1 63 THR H . . 5.600 5.428 5.428 5.428 . 0 0 "[ ]" 1
896 1 60 LYS HA 1 63 THR MG . . 7.000 5.809 5.809 5.809 . 0 0 "[ ]" 1
897 1 60 LYS QB 1 61 GLU H . . 3.760 2.262 2.262 2.262 . 0 0 "[ ]" 1
898 1 60 LYS QB 1 61 GLU HA . . 5.980 4.630 4.630 4.630 . 0 0 "[ ]" 1
899 1 60 LYS HB2 1 61 GLU H . . 4.100 2.282 2.282 2.282 . 0 0 "[ ]" 1
900 1 60 LYS HB3 1 61 GLU H . . 4.100 3.707 3.707 3.707 . 0 0 "[ ]" 1
901 1 60 LYS QG 1 62 GLU H . . 5.320 2.933 2.933 2.933 . 0 0 "[ ]" 1
902 1 60 LYS QG 1 62 GLU QG . . 6.700 4.261 4.261 4.261 . 0 0 "[ ]" 1
903 1 60 LYS QG 1 63 THR H . . 5.230 2.348 2.348 2.348 . 0 0 "[ ]" 1
904 1 60 LYS HG2 1 62 GLU H . . 6.000 4.715 4.715 4.715 . 0 0 "[ ]" 1
905 1 60 LYS HG2 1 62 GLU QG . . 7.000 5.870 5.870 5.870 . 0 0 "[ ]" 1
906 1 60 LYS HG2 1 63 THR H . . 6.000 3.460 3.460 3.460 . 0 0 "[ ]" 1
907 1 60 LYS HG3 1 62 GLU H . . 6.000 2.962 2.962 2.962 . 0 0 "[ ]" 1
908 1 60 LYS HG3 1 62 GLU QG . . 7.000 4.375 4.375 4.375 . 0 0 "[ ]" 1
909 1 60 LYS HG3 1 63 THR H . . 6.000 2.389 2.389 2.389 . 0 0 "[ ]" 1
910 1 61 GLU H 1 61 GLU HG2 . . 3.600 2.004 2.004 2.004 . 0 0 "[ ]" 1
911 1 61 GLU H 1 61 GLU HG3 . . 3.600 3.398 3.398 3.398 . 0 0 "[ ]" 1
912 1 61 GLU H 1 62 GLU H . . 3.800 3.171 3.171 3.171 . 0 0 "[ ]" 1
913 1 61 GLU HA 1 61 GLU HG2 . . 3.700 3.664 3.664 3.664 . 0 0 "[ ]" 1
914 1 61 GLU HA 1 61 GLU HG3 . . 3.700 3.853 3.853 3.853 0.153 1 0 "[ ]" 1
915 1 61 GLU HA 1 64 LEU H . . 4.400 3.896 3.896 3.896 . 0 0 "[ ]" 1
916 1 61 GLU HA 1 64 LEU MD1 . . 5.800 2.570 2.570 2.570 . 0 0 "[ ]" 1
917 1 61 GLU HA 1 95 ILE MG . . 4.800 2.396 2.396 2.396 . 0 0 "[ ]" 1
918 1 61 GLU QB 1 95 ILE MG . . 6.600 1.992 1.992 1.992 . 0 0 "[ ]" 1
919 1 61 GLU QB 1 99 LYS HG2 . . 6.900 4.967 4.967 4.967 . 0 0 "[ ]" 1
920 1 61 GLU QB 1 99 LYS QG . . 6.650 3.964 3.964 3.964 . 0 0 "[ ]" 1
921 1 61 GLU QB 1 99 LYS HG3 . . 6.900 4.167 4.167 4.167 . 0 0 "[ ]" 1
922 1 61 GLU QG 1 62 GLU H . . 4.330 2.176 2.176 2.176 . 0 0 "[ ]" 1
923 1 61 GLU QG 1 95 ILE MG . . 5.980 3.812 3.812 3.812 . 0 0 "[ ]" 1
924 1 61 GLU HG2 1 62 GLU H . . 4.800 2.595 2.595 2.595 . 0 0 "[ ]" 1
925 1 61 GLU HG3 1 62 GLU H . . 4.800 2.337 2.337 2.337 . 0 0 "[ ]" 1
926 1 62 GLU H 1 62 GLU HB2 . . 3.600 2.430 2.430 2.430 . 0 0 "[ ]" 1
927 1 62 GLU H 1 62 GLU HB3 . . 3.600 3.575 3.575 3.575 . 0 0 "[ ]" 1
928 1 62 GLU H 1 62 GLU QG . . 5.000 2.222 2.222 2.222 . 0 0 "[ ]" 1
929 1 62 GLU H 1 63 THR H . . 3.800 3.281 3.281 3.281 . 0 0 "[ ]" 1
930 1 62 GLU H 1 64 LEU H . . 6.000 4.322 4.322 4.322 . 0 0 "[ ]" 1
931 1 62 GLU HA 1 62 GLU HB2 . . 2.900 2.990 2.990 2.990 0.090 1 0 "[ ]" 1
932 1 62 GLU HA 1 62 GLU HB3 . . 2.900 2.517 2.517 2.517 . 0 0 "[ ]" 1
933 1 62 GLU HA 1 63 THR MG . . 6.300 5.150 5.150 5.150 . 0 0 "[ ]" 1
934 1 62 GLU HA 1 64 LEU H . . 6.000 4.570 4.570 4.570 . 0 0 "[ ]" 1
935 1 62 GLU HA 1 65 MET H . . 4.200 3.667 3.667 3.667 . 0 0 "[ ]" 1
936 1 62 GLU HA 1 65 MET HB2 . . 4.800 4.888 4.888 4.888 0.088 1 0 "[ ]" 1
937 1 62 GLU HA 1 65 MET HB3 . . 4.300 4.338 4.338 4.338 0.038 1 0 "[ ]" 1
938 1 62 GLU HA 1 65 MET QG . . 5.980 2.047 2.047 2.047 . 0 0 "[ ]" 1
939 1 62 GLU QB 1 63 THR H . . 3.850 2.089 2.089 2.089 . 0 0 "[ ]" 1
940 1 62 GLU QB 1 63 THR MG . . 7.880 3.147 3.147 3.147 . 0 0 "[ ]" 1
941 1 62 GLU HB2 1 63 THR H . . 4.100 2.132 2.132 2.132 . 0 0 "[ ]" 1
942 1 62 GLU HB3 1 63 THR H . . 4.100 3.001 3.001 3.001 . 0 0 "[ ]" 1
943 1 63 THR H 1 63 THR HG1 . . 4.400 3.224 3.224 3.224 . 0 0 "[ ]" 1
944 1 63 THR H 1 63 THR MG . . 4.200 2.249 2.249 2.249 . 0 0 "[ ]" 1
945 1 63 THR H 1 64 LEU H . . 3.300 3.017 3.017 3.017 . 0 0 "[ ]" 1
946 1 63 THR H 1 65 MET H . . 6.000 4.744 4.744 4.744 . 0 0 "[ ]" 1
947 1 63 THR H 1 66 GLU H . . 6.000 4.730 4.730 4.730 . 0 0 "[ ]" 1
948 1 63 THR H 1 66 GLU HB2 . . 4.300 4.429 4.429 4.429 0.129 1 0 "[ ]" 1
949 1 63 THR H 1 66 GLU QG . . 6.680 4.335 4.335 4.335 . 0 0 "[ ]" 1
950 1 63 THR HA 1 63 THR MG . . 3.500 2.229 2.229 2.229 . 0 0 "[ ]" 1
951 1 63 THR HA 1 64 LEU HG . . 6.000 5.563 5.563 5.563 . 0 0 "[ ]" 1
952 1 63 THR HA 1 65 MET H . . 5.100 4.953 4.953 4.953 . 0 0 "[ ]" 1
953 1 63 THR HA 1 66 GLU H . . 4.100 3.604 3.604 3.604 . 0 0 "[ ]" 1
954 1 63 THR HA 1 66 GLU HB2 . . 3.600 2.293 2.293 2.293 . 0 0 "[ ]" 1
955 1 63 THR HA 1 66 GLU HB3 . . 4.100 3.651 3.651 3.651 . 0 0 "[ ]" 1
956 1 63 THR HA 1 74 TYR QE . . 8.000 2.956 2.956 2.956 . 0 0 "[ ]" 1
957 1 63 THR HB 1 74 TYR QE . . 8.000 2.710 2.710 2.710 . 0 0 "[ ]" 1
958 1 63 THR MG 1 64 LEU H . . 7.000 4.177 4.177 4.177 . 0 0 "[ ]" 1
959 1 63 THR MG 1 66 GLU HB2 . . 5.400 4.016 4.016 4.016 . 0 0 "[ ]" 1
960 1 63 THR MG 1 74 TYR QE . . 9.000 2.446 2.446 2.446 . 0 0 "[ ]" 1
961 1 64 LEU H 1 64 LEU HB2 . . 3.600 2.336 2.336 2.336 . 0 0 "[ ]" 1
962 1 64 LEU H 1 64 LEU HB3 . . 3.500 3.544 3.544 3.544 0.044 1 0 "[ ]" 1
963 1 64 LEU H 1 64 LEU MD1 . . 4.900 3.357 3.357 3.357 . 0 0 "[ ]" 1
964 1 64 LEU H 1 64 LEU MD2 . . 5.700 3.700 3.700 3.700 . 0 0 "[ ]" 1
965 1 64 LEU H 1 64 LEU HG . . 3.500 2.415 2.415 2.415 . 0 0 "[ ]" 1
966 1 64 LEU H 1 65 MET H . . 3.700 3.002 3.002 3.002 . 0 0 "[ ]" 1
967 1 64 LEU H 1 66 GLU H . . 6.000 4.004 4.004 4.004 . 0 0 "[ ]" 1
968 1 64 LEU H 1 67 TYR H . . 5.400 4.770 4.770 4.770 . 0 0 "[ ]" 1
969 1 64 LEU H 1 95 ILE MD . . 7.000 4.279 4.279 4.279 . 0 0 "[ ]" 1
970 1 64 LEU HA 1 64 LEU MD2 . . 3.800 2.129 2.129 2.129 . 0 0 "[ ]" 1
971 1 64 LEU HA 1 64 LEU HG . . 3.700 2.837 2.837 2.837 . 0 0 "[ ]" 1
972 1 64 LEU HA 1 66 GLU H . . 4.200 4.204 4.204 4.204 0.004 1 0 "[ ]" 1
973 1 64 LEU HA 1 67 TYR H . . 4.300 3.613 3.613 3.613 . 0 0 "[ ]" 1
974 1 64 LEU HA 1 68 LEU H . . 4.800 3.758 3.758 3.758 . 0 0 "[ ]" 1
975 1 64 LEU HB2 1 64 LEU HG . . 2.700 2.599 2.599 2.599 . 0 0 "[ ]" 1
976 1 64 LEU HB3 1 64 LEU HG . . 3.000 3.034 3.034 3.034 0.034 1 0 "[ ]" 1
977 1 64 LEU MD1 1 65 MET H . . 7.000 4.322 4.322 4.322 . 0 0 "[ ]" 1
978 1 64 LEU MD1 1 95 ILE HA . . 7.000 3.966 3.966 3.966 . 0 0 "[ ]" 1
979 1 64 LEU MD1 1 95 ILE MD . . 6.100 2.607 2.607 2.607 . 0 0 "[ ]" 1
980 1 64 LEU MD1 1 95 ILE MG . . 6.300 3.170 3.170 3.170 . 0 0 "[ ]" 1
981 1 64 LEU MD1 1 98 LEU MD2 . . 6.900 2.170 2.170 2.170 . 0 0 "[ ]" 1
982 1 64 LEU MD2 1 65 MET H . . 7.000 4.760 4.760 4.760 . 0 0 "[ ]" 1
983 1 64 LEU MD2 1 68 LEU MD1 . . 7.700 3.136 3.136 3.136 . 0 0 "[ ]" 1
984 1 64 LEU MD2 1 68 LEU MD2 . . 6.200 4.035 4.035 4.035 . 0 0 "[ ]" 1
985 1 64 LEU MD2 1 95 ILE MG . . 7.300 5.069 5.069 5.069 . 0 0 "[ ]" 1
986 1 64 LEU HG 1 65 MET H . . 5.700 4.629 4.629 4.629 . 0 0 "[ ]" 1
987 1 64 LEU HG 1 95 ILE MD . . 5.700 4.272 4.272 4.272 . 0 0 "[ ]" 1
988 1 65 MET H 1 65 MET HB2 . . 3.500 3.587 3.587 3.587 0.087 1 0 "[ ]" 1
989 1 65 MET H 1 65 MET HB3 . . 3.200 2.549 2.549 2.549 . 0 0 "[ ]" 1
990 1 65 MET H 1 65 MET ME . . 5.500 3.845 3.845 3.845 . 0 0 "[ ]" 1
991 1 65 MET H 1 65 MET HG2 . . 3.700 2.242 2.242 2.242 . 0 0 "[ ]" 1
992 1 65 MET H 1 65 MET HG3 . . 3.700 3.186 3.186 3.186 . 0 0 "[ ]" 1
993 1 65 MET H 1 66 GLU H . . 3.700 2.675 2.675 2.675 . 0 0 "[ ]" 1
994 1 65 MET H 1 67 TYR H . . 5.600 4.723 4.723 4.723 . 0 0 "[ ]" 1
995 1 65 MET H 1 95 ILE MD . . 5.400 2.819 2.819 2.819 . 0 0 "[ ]" 1
996 1 65 MET HA 1 65 MET HG2 . . 4.000 3.776 3.776 3.776 . 0 0 "[ ]" 1
997 1 65 MET HA 1 65 MET QG . . 3.650 3.331 3.331 3.331 . 0 0 "[ ]" 1
998 1 65 MET HA 1 65 MET HG3 . . 4.000 3.704 3.704 3.704 . 0 0 "[ ]" 1
999 1 65 MET HA 1 67 TYR H . . 5.000 5.002 5.002 5.002 0.002 1 0 "[ ]" 1
1000 1 65 MET HA 1 95 ILE MD . . 4.600 2.858 2.858 2.858 . 0 0 "[ ]" 1
1001 1 65 MET HB2 1 66 GLU H . . 3.900 3.937 3.937 3.937 0.037 1 0 "[ ]" 1
1002 1 65 MET HB2 1 95 ILE MD . . 6.000 4.126 4.126 4.126 . 0 0 "[ ]" 1
1003 1 65 MET HB3 1 66 GLU H . . 4.100 4.102 4.102 4.102 0.002 1 0 "[ ]" 1
1004 1 65 MET HB3 1 95 ILE MD . . 4.300 2.885 2.885 2.885 . 0 0 "[ ]" 1
1005 1 65 MET HB3 1 95 ILE MG . . 5.900 4.161 4.161 4.161 . 0 0 "[ ]" 1
1006 1 65 MET ME 1 92 GLU H . . 6.300 4.119 4.119 4.119 . 0 0 "[ ]" 1
1007 1 65 MET ME 1 92 GLU HA . . 4.600 3.449 3.449 3.449 . 0 0 "[ ]" 1
1008 1 65 MET ME 1 92 GLU QB . . 5.900 4.359 4.359 4.359 . 0 0 "[ ]" 1
1009 1 65 MET ME 1 95 ILE MD . . 5.600 3.892 3.892 3.892 . 0 0 "[ ]" 1
1010 1 65 MET QG 1 95 ILE MD . . 5.680 3.989 3.989 3.989 . 0 0 "[ ]" 1
1011 1 65 MET HG2 1 66 GLU H . . 6.000 3.098 3.098 3.098 . 0 0 "[ ]" 1
1012 1 65 MET HG2 1 95 ILE MD . . 6.400 4.169 4.169 4.169 . 0 0 "[ ]" 1
1013 1 65 MET HG3 1 66 GLU H . . 6.000 2.477 2.477 2.477 . 0 0 "[ ]" 1
1014 1 65 MET HG3 1 95 ILE MD . . 6.400 5.086 5.086 5.086 . 0 0 "[ ]" 1
1015 1 66 GLU H 1 66 GLU HB2 . . 3.200 2.175 2.175 2.175 . 0 0 "[ ]" 1
1016 1 66 GLU H 1 66 GLU HB3 . . 3.500 3.455 3.455 3.455 . 0 0 "[ ]" 1
1017 1 66 GLU H 1 67 TYR H . . 3.500 2.857 2.857 2.857 . 0 0 "[ ]" 1
1018 1 66 GLU HA 1 66 GLU HB2 . . 3.000 3.042 3.042 3.042 0.042 1 0 "[ ]" 1
1019 1 66 GLU HA 1 66 GLU QG . . 3.550 3.004 3.004 3.004 . 0 0 "[ ]" 1
1020 1 66 GLU HA 1 69 GLU H . . 4.600 3.425 3.425 3.425 . 0 0 "[ ]" 1
1021 1 66 GLU HB2 1 66 GLU QG . . 2.650 2.158 2.158 2.158 . 0 0 "[ ]" 1
1022 1 66 GLU HB2 1 67 TYR H . . 3.200 2.536 2.536 2.536 . 0 0 "[ ]" 1
1023 1 66 GLU HB2 1 67 TYR HA . . 4.800 4.816 4.816 4.816 0.016 1 0 "[ ]" 1
1024 1 66 GLU HB2 1 68 LEU H . . 5.300 4.922 4.922 4.922 . 0 0 "[ ]" 1
1025 1 66 GLU HB3 1 67 TYR H . . 3.600 3.059 3.059 3.059 . 0 0 "[ ]" 1
1026 1 66 GLU HB3 1 74 TYR QD . . 8.000 4.129 4.129 4.129 . 0 0 "[ ]" 1
1027 1 66 GLU HB3 1 74 TYR QE . . 7.300 2.405 2.405 2.405 . 0 0 "[ ]" 1
1028 1 66 GLU QG 1 74 TYR QD . . 8.880 5.604 5.604 5.604 . 0 0 "[ ]" 1
1029 1 66 GLU QG 1 74 TYR QE . . 8.880 3.803 3.803 3.803 . 0 0 "[ ]" 1
1030 1 67 TYR H 1 67 TYR HB2 . . 3.600 2.495 2.495 2.495 . 0 0 "[ ]" 1
1031 1 67 TYR H 1 67 TYR HB3 . . 3.700 2.374 2.374 2.374 . 0 0 "[ ]" 1
1032 1 67 TYR H 1 74 TYR QD . . 8.000 4.298 4.298 4.298 . 0 0 "[ ]" 1
1033 1 67 TYR H 1 74 TYR QE . . 8.000 3.909 3.909 3.909 . 0 0 "[ ]" 1
1034 1 67 TYR HA 1 68 LEU HA . . 4.900 4.777 4.777 4.777 . 0 0 "[ ]" 1
1035 1 67 TYR HA 1 70 ASN H . . 4.200 3.276 3.276 3.276 . 0 0 "[ ]" 1
1036 1 67 TYR HA 1 70 ASN HB2 . . 5.200 5.111 5.111 5.111 . 0 0 "[ ]" 1
1037 1 67 TYR HA 1 70 ASN QB . . 4.640 4.202 4.202 4.202 . 0 0 "[ ]" 1
1038 1 67 TYR HA 1 70 ASN HB3 . . 5.200 4.469 4.469 4.469 . 0 0 "[ ]" 1
1039 1 67 TYR HA 1 74 TYR H . . 4.100 4.164 4.164 4.164 0.064 1 0 "[ ]" 1
1040 1 67 TYR HA 1 74 TYR QB . . 5.380 3.251 3.251 3.251 . 0 0 "[ ]" 1
1041 1 67 TYR HA 1 74 TYR QD . . 6.700 3.153 3.153 3.153 . 0 0 "[ ]" 1
1042 1 67 TYR HA 1 74 TYR QE . . 8.000 4.135 4.135 4.135 . 0 0 "[ ]" 1
1043 1 67 TYR HB2 1 68 LEU H . . 4.400 3.955 3.955 3.955 . 0 0 "[ ]" 1
1044 1 67 TYR HB2 1 74 TYR QD . . 6.300 3.073 3.073 3.073 . 0 0 "[ ]" 1
1045 1 67 TYR HB3 1 68 LEU H . . 4.200 2.624 2.624 2.624 . 0 0 "[ ]" 1
1046 1 67 TYR HB3 1 68 LEU HA . . 6.000 4.478 4.478 4.478 . 0 0 "[ ]" 1
1047 1 67 TYR HB3 1 68 LEU QB . . 7.000 4.546 4.546 4.546 . 0 0 "[ ]" 1
1048 1 67 TYR HB3 1 68 LEU MD1 . . 7.000 4.553 4.553 4.553 . 0 0 "[ ]" 1
1049 1 67 TYR HB3 1 68 LEU MD2 . . 6.500 4.303 4.303 4.303 . 0 0 "[ ]" 1
1050 1 67 TYR HB3 1 74 TYR QD . . 8.000 4.574 4.574 4.574 . 0 0 "[ ]" 1
1051 1 68 LEU H 1 68 LEU MD1 . . 5.200 3.442 3.442 3.442 . 0 0 "[ ]" 1
1052 1 68 LEU H 1 68 LEU MD2 . . 4.400 3.641 3.641 3.641 . 0 0 "[ ]" 1
1053 1 68 LEU H 1 68 LEU HG . . 3.200 2.375 2.375 2.375 . 0 0 "[ ]" 1
1054 1 68 LEU H 1 69 GLU H . . 3.800 2.730 2.730 2.730 . 0 0 "[ ]" 1
1055 1 68 LEU H 1 70 ASN H . . 5.300 4.280 4.280 4.280 . 0 0 "[ ]" 1
1056 1 68 LEU HA 1 68 LEU MD1 . . 4.400 3.763 3.763 3.763 . 0 0 "[ ]" 1
1057 1 68 LEU HA 1 68 LEU MD2 . . 4.500 2.094 2.094 2.094 . 0 0 "[ ]" 1
1058 1 68 LEU HA 1 68 LEU HG . . 3.600 2.875 2.875 2.875 . 0 0 "[ ]" 1
1059 1 68 LEU HA 1 70 ASN H . . 4.800 4.630 4.630 4.630 . 0 0 "[ ]" 1
1060 1 68 LEU HA 1 71 PRO HG2 . . 6.000 6.022 6.022 6.022 0.022 1 0 "[ ]" 1
1061 1 68 LEU HA 1 71 PRO HG3 . . 6.000 4.555 4.555 4.555 . 0 0 "[ ]" 1
1062 1 68 LEU MD1 1 69 GLU H . . 7.000 5.016 5.016 5.016 . 0 0 "[ ]" 1
1063 1 68 LEU MD1 1 82 PHE QD . . 9.000 6.176 6.176 6.176 . 0 0 "[ ]" 1
1064 1 68 LEU MD1 1 82 PHE QE . . 9.000 4.618 4.618 4.618 . 0 0 "[ ]" 1
1065 1 68 LEU MD1 1 85 ILE MD . . 7.900 3.800 3.800 3.800 . 0 0 "[ ]" 1
1066 1 68 LEU MD2 1 69 GLU H . . 7.000 4.941 4.941 4.941 . 0 0 "[ ]" 1
1067 1 69 GLU H 1 69 GLU HB2 . . 4.200 2.260 2.260 2.260 . 0 0 "[ ]" 1
1068 1 69 GLU H 1 69 GLU QB . . 3.720 2.183 2.183 2.183 . 0 0 "[ ]" 1
1069 1 69 GLU H 1 69 GLU HB3 . . 4.200 2.887 2.887 2.887 . 0 0 "[ ]" 1
1070 1 69 GLU H 1 69 GLU QG . . 4.300 3.880 3.880 3.880 . 0 0 "[ ]" 1
1071 1 69 GLU H 1 70 ASN H . . 3.400 2.304 2.304 2.304 . 0 0 "[ ]" 1
1072 1 69 GLU QB 1 70 ASN H . . 4.280 2.178 2.178 2.178 . 0 0 "[ ]" 1
1073 1 69 GLU QB 1 70 ASN QB . . 7.150 2.294 2.294 2.294 . 0 0 "[ ]" 1
1074 1 69 GLU HB2 1 70 ASN H . . 4.800 3.102 3.102 3.102 . 0 0 "[ ]" 1
1075 1 69 GLU HB3 1 70 ASN H . . 4.800 2.225 2.225 2.225 . 0 0 "[ ]" 1
1076 1 69 GLU QG 1 70 ASN H . . 6.700 4.198 4.198 4.198 . 0 0 "[ ]" 1
1077 1 70 ASN H 1 70 ASN HB2 . . 3.900 2.523 2.523 2.523 . 0 0 "[ ]" 1
1078 1 70 ASN H 1 70 ASN HB3 . . 3.900 3.057 3.057 3.057 . 0 0 "[ ]" 1
1079 1 70 ASN H 1 71 PRO HA . . 5.100 4.313 4.313 4.313 . 0 0 "[ ]" 1
1080 1 70 ASN H 1 71 PRO HD2 . . 6.000 4.341 4.341 4.341 . 0 0 "[ ]" 1
1081 1 70 ASN H 1 71 PRO HD3 . . 5.300 3.475 3.475 3.475 . 0 0 "[ ]" 1
1082 1 70 ASN HA 1 71 PRO HA . . 4.600 4.577 4.577 4.577 . 0 0 "[ ]" 1
1083 1 70 ASN HA 1 71 PRO HD2 . . 3.800 2.281 2.281 2.281 . 0 0 "[ ]" 1
1084 1 70 ASN HA 1 71 PRO QG . . 5.720 4.103 4.103 4.103 . 0 0 "[ ]" 1
1085 1 70 ASN HA 1 72 LYS H . . 6.000 3.642 3.642 3.642 . 0 0 "[ ]" 1
1086 1 70 ASN HA 1 73 LYS H . . 6.000 4.115 4.115 4.115 . 0 0 "[ ]" 1
1087 1 70 ASN HA 1 73 LYS QB . . 5.200 4.516 4.516 4.516 . 0 0 "[ ]" 1
1088 1 70 ASN HA 1 73 LYS QG . . 5.480 4.637 4.637 4.637 . 0 0 "[ ]" 1
1089 1 70 ASN QB 1 71 PRO HA . . 5.270 4.637 4.637 4.637 . 0 0 "[ ]" 1
1090 1 70 ASN QB 1 72 LYS H . . 6.680 4.658 4.658 4.658 . 0 0 "[ ]" 1
1091 1 70 ASN QB 1 73 LYS H . . 5.280 3.447 3.447 3.447 . 0 0 "[ ]" 1
1092 1 70 ASN QB 1 73 LYS QB . . 5.980 2.366 2.366 2.366 . 0 0 "[ ]" 1
1093 1 70 ASN QB 1 74 TYR H . . 6.280 4.008 4.008 4.008 . 0 0 "[ ]" 1
1094 1 70 ASN HB2 1 71 PRO HA . . 6.000 5.791 5.791 5.791 . 0 0 "[ ]" 1
1095 1 70 ASN HB3 1 71 PRO HA . . 6.000 4.880 4.880 4.880 . 0 0 "[ ]" 1
1096 1 71 PRO HA 1 73 LYS H . . 5.200 4.282 4.282 4.282 . 0 0 "[ ]" 1
1097 1 71 PRO HA 1 74 TYR HB2 . . 4.800 2.819 2.819 2.819 . 0 0 "[ ]" 1
1098 1 71 PRO HA 1 74 TYR QB . . 4.380 2.785 2.785 2.785 . 0 0 "[ ]" 1
1099 1 71 PRO HA 1 74 TYR HB3 . . 4.800 4.336 4.336 4.336 . 0 0 "[ ]" 1
1100 1 71 PRO HA 1 75 ILE H . . 5.700 3.969 3.969 3.969 . 0 0 "[ ]" 1
1101 1 71 PRO HB2 1 72 LYS H . . 3.800 3.563 3.563 3.563 . 0 0 "[ ]" 1
1102 1 71 PRO HB3 1 72 LYS H . . 4.400 4.231 4.231 4.231 . 0 0 "[ ]" 1
1103 1 71 PRO QG 1 80 MET ME . . 5.840 2.512 2.512 2.512 . 0 0 "[ ]" 1
1104 1 71 PRO QG 1 82 PHE QD . . 7.500 3.184 3.184 3.184 . 0 0 "[ ]" 1
1105 1 71 PRO HG2 1 80 MET ME . . 6.000 3.746 3.746 3.746 . 0 0 "[ ]" 1
1106 1 71 PRO HG2 1 82 PHE QD . . 7.700 4.863 4.863 4.863 . 0 0 "[ ]" 1
1107 1 71 PRO HG3 1 80 MET ME . . 6.000 2.552 2.552 2.552 . 0 0 "[ ]" 1
1108 1 71 PRO HG3 1 82 PHE QD . . 7.700 3.227 3.227 3.227 . 0 0 "[ ]" 1
1109 1 72 LYS H 1 72 LYS HB2 . . 3.800 2.334 2.334 2.334 . 0 0 "[ ]" 1
1110 1 72 LYS H 1 72 LYS HB3 . . 3.800 2.712 2.712 2.712 . 0 0 "[ ]" 1
1111 1 72 LYS H 1 73 LYS H . . 3.300 2.733 2.733 2.733 . 0 0 "[ ]" 1
1112 1 72 LYS H 1 74 TYR H . . 5.800 4.373 4.373 4.373 . 0 0 "[ ]" 1
1113 1 72 LYS H 1 78 THR MG . . 5.500 3.072 3.072 3.072 . 0 0 "[ ]" 1
1114 1 72 LYS HA 1 74 TYR H . . 4.900 4.485 4.485 4.485 . 0 0 "[ ]" 1
1115 1 72 LYS HA 1 75 ILE H . . 3.800 3.353 3.353 3.353 . 0 0 "[ ]" 1
1116 1 72 LYS HA 1 78 THR H . . 4.500 3.654 3.654 3.654 . 0 0 "[ ]" 1
1117 1 72 LYS HA 1 78 THR HB . . 4.500 3.720 3.720 3.720 . 0 0 "[ ]" 1
1118 1 72 LYS HA 1 78 THR MG . . 4.600 2.302 2.302 2.302 . 0 0 "[ ]" 1
1119 1 72 LYS QB 1 73 LYS H . . 5.180 2.897 2.897 2.897 . 0 0 "[ ]" 1
1120 1 72 LYS QB 1 78 THR MG . . 5.590 2.970 2.970 2.970 . 0 0 "[ ]" 1
1121 1 72 LYS HB2 1 72 LYS QE . . 5.000 3.931 3.931 3.931 . 0 0 "[ ]" 1
1122 1 72 LYS HB2 1 78 THR MG . . 6.000 3.036 3.036 3.036 . 0 0 "[ ]" 1
1123 1 72 LYS HB3 1 72 LYS QE . . 5.000 4.068 4.068 4.068 . 0 0 "[ ]" 1
1124 1 72 LYS HB3 1 78 THR MG . . 6.000 4.215 4.215 4.215 . 0 0 "[ ]" 1
1125 1 72 LYS QG 1 73 LYS H . . 7.000 4.139 4.139 4.139 . 0 0 "[ ]" 1
1126 1 72 LYS QG 1 78 THR MG . . 6.600 2.863 2.863 2.863 . 0 0 "[ ]" 1
1127 1 73 LYS H 1 73 LYS QB . . 3.900 2.246 2.246 2.246 . 0 0 "[ ]" 1
1128 1 73 LYS H 1 74 TYR H . . 3.300 2.663 2.663 2.663 . 0 0 "[ ]" 1
1129 1 73 LYS H 1 75 ILE H . . 5.100 4.282 4.282 4.282 . 0 0 "[ ]" 1
1130 1 73 LYS HA 1 73 LYS QG . . 3.580 2.585 2.585 2.585 . 0 0 "[ ]" 1
1131 1 73 LYS QB 1 74 TYR H . . 5.000 2.474 2.474 2.474 . 0 0 "[ ]" 1
1132 1 73 LYS QG 1 74 TYR H . . 6.680 4.219 4.219 4.219 . 0 0 "[ ]" 1
1133 1 74 TYR H 1 74 TYR HB2 . . 3.500 2.118 2.118 2.118 . 0 0 "[ ]" 1
1134 1 74 TYR H 1 74 TYR HB3 . . 3.500 3.473 3.473 3.473 . 0 0 "[ ]" 1
1135 1 74 TYR H 1 74 TYR QE . . 5.000 4.474 4.474 4.474 . 0 0 "[ ]" 1
1136 1 74 TYR H 1 75 ILE H . . 3.400 2.883 2.883 2.883 . 0 0 "[ ]" 1
1137 1 74 TYR HA 1 74 TYR QE . . 4.900 4.337 4.337 4.337 . 0 0 "[ ]" 1
1138 1 74 TYR QD 1 75 ILE MD . . 7.700 3.677 3.677 3.677 . 0 0 "[ ]" 1
1139 1 74 TYR QD 1 75 ILE QG . . 8.700 3.983 3.983 3.983 . 0 0 "[ ]" 1
1140 1 74 TYR QD 1 75 ILE MG . . 9.000 6.090 6.090 6.090 . 0 0 "[ ]" 1
1141 1 75 ILE H 1 75 ILE HB . . 3.800 2.569 2.569 2.569 . 0 0 "[ ]" 1
1142 1 75 ILE H 1 78 THR MG . . 7.000 3.882 3.882 3.882 . 0 0 "[ ]" 1
1143 1 75 ILE HA 1 76 PRO HD2 . . 3.800 2.149 2.149 2.149 . 0 0 "[ ]" 1
1144 1 75 ILE HB 1 78 THR H . . 6.000 3.848 3.848 3.848 . 0 0 "[ ]" 1
1145 1 75 ILE HB 1 78 THR MG . . 6.400 3.701 3.701 3.701 . 0 0 "[ ]" 1
1146 1 75 ILE MD 1 78 THR MG . . 8.000 4.707 4.707 4.707 . 0 0 "[ ]" 1
1147 1 75 ILE QG 1 78 THR MG . . 8.000 5.302 5.302 5.302 . 0 0 "[ ]" 1
1148 1 75 ILE MG 1 76 PRO HD2 . . 6.400 3.052 3.052 3.052 . 0 0 "[ ]" 1
1149 1 75 ILE MG 1 76 PRO HD3 . . 6.600 4.203 4.203 4.203 . 0 0 "[ ]" 1
1150 1 75 ILE MG 1 78 THR H . . 6.000 2.556 2.556 2.556 . 0 0 "[ ]" 1
1151 1 75 ILE MG 1 78 THR HA . . 6.800 2.640 2.640 2.640 . 0 0 "[ ]" 1
1152 1 75 ILE MG 1 78 THR HB . . 4.300 2.654 2.654 2.654 . 0 0 "[ ]" 1
1153 1 75 ILE MG 1 78 THR MG . . 6.900 3.701 3.701 3.701 . 0 0 "[ ]" 1
1154 1 76 PRO HA 1 77 GLY H . . 3.500 3.535 3.535 3.535 0.035 1 0 "[ ]" 1
1155 1 76 PRO HB2 1 77 GLY H . . 4.700 3.336 3.336 3.336 . 0 0 "[ ]" 1
1156 1 76 PRO HB3 1 77 GLY H . . 4.700 4.172 4.172 4.172 . 0 0 "[ ]" 1
1157 1 76 PRO HD3 1 77 GLY H . . 5.800 4.014 4.014 4.014 . 0 0 "[ ]" 1
1158 1 77 GLY H 1 78 THR H . . 4.400 2.979 2.979 2.979 . 0 0 "[ ]" 1
1159 1 77 GLY H 1 78 THR MG . . 7.000 4.602 4.602 4.602 . 0 0 "[ ]" 1
1160 1 78 THR H 1 78 THR HB . . 3.600 2.490 2.490 2.490 . 0 0 "[ ]" 1
1161 1 78 THR H 1 78 THR MG . . 3.700 2.078 2.078 2.078 . 0 0 "[ ]" 1
1162 1 78 THR HA 1 78 THR HG1 . . 3.500 3.064 3.064 3.064 . 0 0 "[ ]" 1
1163 1 78 THR HA 1 80 MET H . . 5.800 4.071 4.071 4.071 . 0 0 "[ ]" 1
1164 1 78 THR HB 1 79 LYS H . . 5.300 4.484 4.484 4.484 . 0 0 "[ ]" 1
1165 1 78 THR MG 1 79 LYS H . . 7.000 4.291 4.291 4.291 . 0 0 "[ ]" 1
1166 1 78 THR MG 1 80 MET H . . 5.300 2.878 2.878 2.878 . 0 0 "[ ]" 1
1167 1 78 THR MG 1 80 MET HB2 . . 5.800 4.437 4.437 4.437 . 0 0 "[ ]" 1
1168 1 78 THR MG 1 80 MET HB3 . . 7.000 3.129 3.129 3.129 . 0 0 "[ ]" 1
1169 1 79 LYS H 1 79 LYS QD . . 4.980 4.568 4.568 4.568 . 0 0 "[ ]" 1
1170 1 79 LYS H 1 79 LYS QG . . 4.780 3.852 3.852 3.852 . 0 0 "[ ]" 1
1171 1 79 LYS H 1 80 MET H . . 4.200 3.348 3.348 3.348 . 0 0 "[ ]" 1
1172 1 79 LYS HA 1 79 LYS QD . . 4.480 3.677 3.677 3.677 . 0 0 "[ ]" 1
1173 1 79 LYS QB 1 79 LYS QD . . 3.340 2.563 2.563 2.563 . 0 0 "[ ]" 1
1174 1 79 LYS QB 1 80 MET H . . 5.480 3.950 3.950 3.950 . 0 0 "[ ]" 1
1175 1 80 MET H 1 80 MET HB2 . . 3.900 3.148 3.148 3.148 . 0 0 "[ ]" 1
1176 1 80 MET HA 1 80 MET HG3 . . 3.900 2.496 2.496 2.496 . 0 0 "[ ]" 1
1177 1 80 MET HA 1 81 ILE H . . 3.500 2.335 2.335 2.335 . 0 0 "[ ]" 1
1178 1 80 MET ME 1 82 PHE HB2 . . 6.200 3.931 3.931 3.931 . 0 0 "[ ]" 1
1179 1 80 MET ME 1 82 PHE HB3 . . 6.200 3.270 3.270 3.270 . 0 0 "[ ]" 1
1180 1 80 MET ME 1 82 PHE QD . . 8.200 2.509 2.509 2.509 . 0 0 "[ ]" 1
1181 1 80 MET ME 1 82 PHE QE . . 9.000 3.397 3.397 3.397 . 0 0 "[ ]" 1
1182 1 80 MET HG2 1 82 PHE HB2 . . 6.000 2.410 2.410 2.410 . 0 0 "[ ]" 1
1183 1 80 MET HG2 1 82 PHE QD . . 8.000 3.096 3.096 3.096 . 0 0 "[ ]" 1
1184 1 80 MET HG2 1 82 PHE HZ . . 6.000 6.021 6.021 6.021 0.021 1 0 "[ ]" 1
1185 1 80 MET HG3 1 81 ILE H . . 6.000 4.087 4.087 4.087 . 0 0 "[ ]" 1
1186 1 80 MET HG3 1 82 PHE HB2 . . 6.000 2.484 2.484 2.484 . 0 0 "[ ]" 1
1187 1 80 MET HG3 1 82 PHE QE . . 8.000 5.030 5.030 5.030 . 0 0 "[ ]" 1
1188 1 80 MET HG3 1 82 PHE HZ . . 6.000 6.031 6.031 6.031 0.031 1 0 "[ ]" 1
1189 1 81 ILE H 1 81 ILE HB . . 3.600 2.671 2.671 2.671 . 0 0 "[ ]" 1
1190 1 81 ILE H 1 81 ILE MD . . 5.200 4.212 4.212 4.212 . 0 0 "[ ]" 1
1191 1 81 ILE H 1 81 ILE QG . . 4.680 4.061 4.061 4.061 . 0 0 "[ ]" 1
1192 1 81 ILE H 1 82 PHE H . . 4.500 4.053 4.053 4.053 . 0 0 "[ ]" 1
1193 1 81 ILE HA 1 81 ILE MD . . 4.000 2.166 2.166 2.166 . 0 0 "[ ]" 1
1194 1 81 ILE HA 1 81 ILE QG . . 3.890 3.087 3.087 3.087 . 0 0 "[ ]" 1
1195 1 81 ILE HA 1 82 PHE H . . 3.100 2.242 2.242 2.242 . 0 0 "[ ]" 1
1196 1 81 ILE HB 1 82 PHE H . . 5.100 4.499 4.499 4.499 . 0 0 "[ ]" 1
1197 1 81 ILE MD 1 82 PHE H . . 7.000 3.170 3.170 3.170 . 0 0 "[ ]" 1
1198 1 81 ILE MG 1 82 PHE H . . 7.000 4.397 4.397 4.397 . 0 0 "[ ]" 1
1199 1 82 PHE H 1 82 PHE HB2 . . 3.700 2.885 2.885 2.885 . 0 0 "[ ]" 1
1200 1 82 PHE H 1 82 PHE QE . . 7.000 6.305 6.305 6.305 . 0 0 "[ ]" 1
1201 1 82 PHE HA 1 83 ALA MB . . 4.600 3.879 3.879 3.879 . 0 0 "[ ]" 1
1202 1 82 PHE QD 1 83 ALA HA . . 8.000 5.188 5.188 5.188 . 0 0 "[ ]" 1
1203 1 82 PHE QD 1 84 GLY QA . . 8.880 3.299 3.299 3.299 . 0 0 "[ ]" 1
1204 1 82 PHE QE 1 84 GLY HA3 . . 8.000 5.815 5.815 5.815 . 0 0 "[ ]" 1
1205 1 82 PHE QE 1 85 ILE H . . 8.000 4.063 4.063 4.063 . 0 0 "[ ]" 1
1206 1 82 PHE QE 1 85 ILE MD . . 8.100 3.067 3.067 3.067 . 0 0 "[ ]" 1
1207 1 82 PHE QE 1 85 ILE HG12 . . 7.700 4.079 4.079 4.079 . 0 0 "[ ]" 1
1208 1 82 PHE QE 1 85 ILE QG . . 7.310 2.898 2.898 2.898 . 0 0 "[ ]" 1
1209 1 82 PHE QE 1 85 ILE HG13 . . 7.700 2.965 2.965 2.965 . 0 0 "[ ]" 1
1210 1 82 PHE HZ 1 84 GLY QA . . 6.880 5.922 5.922 5.922 . 0 0 "[ ]" 1
1211 1 82 PHE HZ 1 85 ILE H . . 6.000 5.645 5.645 5.645 . 0 0 "[ ]" 1
1212 1 82 PHE HZ 1 85 ILE HB . . 6.000 5.723 5.723 5.723 . 0 0 "[ ]" 1
1213 1 82 PHE HZ 1 85 ILE MD . . 5.400 2.413 2.413 2.413 . 0 0 "[ ]" 1
1214 1 82 PHE HZ 1 85 ILE HG12 . . 5.000 4.121 4.121 4.121 . 0 0 "[ ]" 1
1215 1 82 PHE HZ 1 85 ILE QG . . 4.680 3.421 3.421 3.421 . 0 0 "[ ]" 1
1216 1 82 PHE HZ 1 85 ILE HG13 . . 5.000 3.655 3.655 3.655 . 0 0 "[ ]" 1
1217 1 83 ALA HA 1 84 GLY QA . . 5.580 4.410 4.410 4.410 . 0 0 "[ ]" 1
1218 1 83 ALA MB 1 84 GLY QA . . 5.030 3.753 3.753 3.753 . 0 0 "[ ]" 1
1219 1 83 ALA MB 1 84 GLY HA3 . . 5.300 4.135 4.135 4.135 . 0 0 "[ ]" 1
1220 1 84 GLY HA3 1 85 ILE H . . 3.600 3.384 3.384 3.384 . 0 0 "[ ]" 1
1221 1 85 ILE H 1 85 ILE HB . . 3.600 2.687 2.687 2.687 . 0 0 "[ ]" 1
1222 1 85 ILE H 1 85 ILE HG12 . . 3.800 3.486 3.486 3.486 . 0 0 "[ ]" 1
1223 1 85 ILE H 1 85 ILE QG . . 3.550 2.243 2.243 2.243 . 0 0 "[ ]" 1
1224 1 85 ILE H 1 85 ILE HG13 . . 3.800 2.271 2.271 2.271 . 0 0 "[ ]" 1
1225 1 85 ILE H 1 86 LYS H . . 3.900 3.742 3.742 3.742 . 0 0 "[ ]" 1
1226 1 85 ILE H 1 86 LYS HA . . 5.100 4.948 4.948 4.948 . 0 0 "[ ]" 1
1227 1 85 ILE HA 1 85 ILE MD . . 4.800 3.867 3.867 3.867 . 0 0 "[ ]" 1
1228 1 85 ILE HA 1 85 ILE HG12 . . 3.400 2.598 2.598 2.598 . 0 0 "[ ]" 1
1229 1 85 ILE HA 1 85 ILE HG13 . . 3.400 3.157 3.157 3.157 . 0 0 "[ ]" 1
1230 1 85 ILE HA 1 86 LYS H . . 3.600 2.349 2.349 2.349 . 0 0 "[ ]" 1
1231 1 85 ILE HB 1 86 LYS H . . 4.700 4.473 4.473 4.473 . 0 0 "[ ]" 1
1232 1 85 ILE HB 1 90 GLU H . . 5.900 5.944 5.944 5.944 0.044 1 0 "[ ]" 1
1233 1 85 ILE MD 1 90 GLU HB2 . . 6.100 4.299 4.299 4.299 . 0 0 "[ ]" 1
1234 1 85 ILE MD 1 90 GLU HB3 . . 4.200 3.516 3.516 3.516 . 0 0 "[ ]" 1
1235 1 85 ILE MD 1 90 GLU QG . . 7.280 4.972 4.972 4.972 . 0 0 "[ ]" 1
1236 1 85 ILE MD 1 91 ARG HA . . 6.000 3.887 3.887 3.887 . 0 0 "[ ]" 1
1237 1 85 ILE MD 1 94 LEU QD . . 6.970 2.122 2.122 2.122 . 0 0 "[ ]" 1
1238 1 85 ILE MG 1 86 LYS H . . 5.900 3.747 3.747 3.747 . 0 0 "[ ]" 1
1239 1 85 ILE MG 1 87 LYS H . . 5.100 3.064 3.064 3.064 . 0 0 "[ ]" 1
1240 1 85 ILE MG 1 87 LYS HB2 . . 5.500 2.766 2.766 2.766 . 0 0 "[ ]" 1
1241 1 85 ILE MG 1 87 LYS QB . . 5.230 2.726 2.726 2.726 . 0 0 "[ ]" 1
1242 1 85 ILE MG 1 87 LYS HB3 . . 5.500 4.124 4.124 4.124 . 0 0 "[ ]" 1
1243 1 85 ILE MG 1 90 GLU H . . 7.000 3.991 3.991 3.991 . 0 0 "[ ]" 1
1244 1 85 ILE MG 1 90 GLU HB2 . . 4.500 2.226 2.226 2.226 . 0 0 "[ ]" 1
1245 1 85 ILE MG 1 90 GLU HB3 . . 4.400 2.256 2.256 2.256 . 0 0 "[ ]" 1
1246 1 85 ILE MG 1 90 GLU QG . . 5.980 3.502 3.502 3.502 . 0 0 "[ ]" 1
1247 1 85 ILE MG 1 91 ARG H . . 6.000 3.633 3.633 3.633 . 0 0 "[ ]" 1
1248 1 85 ILE MG 1 91 ARG HA . . 5.000 4.057 4.057 4.057 . 0 0 "[ ]" 1
1249 1 85 ILE MG 1 91 ARG QB . . 6.500 4.506 4.506 4.506 . 0 0 "[ ]" 1
1250 1 86 LYS H 1 86 LYS HG2 . . 4.900 4.596 4.596 4.596 . 0 0 "[ ]" 1
1251 1 86 LYS H 1 86 LYS QG . . 4.530 3.883 3.883 3.883 . 0 0 "[ ]" 1
1252 1 86 LYS H 1 86 LYS HG3 . . 4.900 4.186 4.186 4.186 . 0 0 "[ ]" 1
1253 1 86 LYS H 1 87 LYS H . . 4.100 3.367 3.367 3.367 . 0 0 "[ ]" 1
1254 1 86 LYS H 1 87 LYS QG . . 6.780 5.288 5.288 5.288 . 0 0 "[ ]" 1
1255 1 86 LYS HA 1 86 LYS HG2 . . 3.900 3.070 3.070 3.070 . 0 0 "[ ]" 1
1256 1 86 LYS HA 1 86 LYS QG . . 3.650 2.364 2.364 2.364 . 0 0 "[ ]" 1
1257 1 86 LYS HA 1 86 LYS HG3 . . 3.900 2.458 2.458 2.458 . 0 0 "[ ]" 1
1258 1 86 LYS QB 1 87 LYS H . . 5.300 2.428 2.428 2.428 . 0 0 "[ ]" 1
1259 1 87 LYS H 1 87 LYS HB2 . . 3.500 2.369 2.369 2.369 . 0 0 "[ ]" 1
1260 1 87 LYS H 1 87 LYS QB . . 3.290 2.335 2.335 2.335 . 0 0 "[ ]" 1
1261 1 87 LYS H 1 87 LYS HB3 . . 3.500 3.535 3.535 3.535 0.035 1 0 "[ ]" 1
1262 1 87 LYS H 1 87 LYS HG2 . . 3.400 3.089 3.089 3.089 . 0 0 "[ ]" 1
1263 1 87 LYS H 1 87 LYS QG . . 3.180 2.569 2.569 2.569 . 0 0 "[ ]" 1
1264 1 87 LYS H 1 87 LYS HG3 . . 3.400 2.747 2.747 2.747 . 0 0 "[ ]" 1
1265 1 87 LYS HA 1 87 LYS HG2 . . 3.600 2.353 2.353 2.353 . 0 0 "[ ]" 1
1266 1 87 LYS HA 1 87 LYS QG . . 3.200 2.318 2.318 2.318 . 0 0 "[ ]" 1
1267 1 87 LYS HA 1 87 LYS HG3 . . 3.600 3.488 3.488 3.488 . 0 0 "[ ]" 1
1268 1 87 LYS HA 1 88 LYS HA . . 4.500 4.535 4.535 4.535 0.035 1 0 "[ ]" 1
1269 1 87 LYS HA 1 89 THR H . . 4.400 3.587 3.587 3.587 . 0 0 "[ ]" 1
1270 1 87 LYS QB 1 90 GLU H . . 3.700 2.281 2.281 2.281 . 0 0 "[ ]" 1
1271 1 87 LYS HB2 1 90 GLU H . . 3.900 3.052 3.052 3.052 . 0 0 "[ ]" 1
1272 1 87 LYS HB3 1 90 GLU H . . 3.900 2.355 2.355 2.355 . 0 0 "[ ]" 1
1273 1 88 LYS HA 1 88 LYS HB2 . . 3.000 3.012 3.012 3.012 0.012 1 0 "[ ]" 1
1274 1 88 LYS HA 1 88 LYS HB3 . . 3.000 2.667 2.667 2.667 . 0 0 "[ ]" 1
1275 1 88 LYS HA 1 88 LYS QG . . 3.710 2.517 2.517 2.517 . 0 0 "[ ]" 1
1276 1 88 LYS HA 1 89 THR H . . 3.600 3.609 3.609 3.609 0.009 1 0 "[ ]" 1
1277 1 88 LYS HA 1 90 GLU H . . 5.400 4.431 4.431 4.431 . 0 0 "[ ]" 1
1278 1 88 LYS HA 1 91 ARG H . . 4.400 3.520 3.520 3.520 . 0 0 "[ ]" 1
1279 1 88 LYS HA 1 91 ARG QB . . 5.300 2.714 2.714 2.714 . 0 0 "[ ]" 1
1280 1 88 LYS HA 1 92 GLU H . . 4.600 4.039 4.039 4.039 . 0 0 "[ ]" 1
1281 1 88 LYS QB 1 89 THR H . . 3.960 2.581 2.581 2.581 . 0 0 "[ ]" 1
1282 1 88 LYS HB2 1 89 THR H . . 4.200 2.704 2.704 2.704 . 0 0 "[ ]" 1
1283 1 88 LYS HB3 1 89 THR H . . 4.200 3.269 3.269 3.269 . 0 0 "[ ]" 1
1284 1 89 THR H 1 89 THR HB . . 3.800 3.528 3.528 3.528 . 0 0 "[ ]" 1
1285 1 89 THR H 1 89 THR MG . . 3.600 2.157 2.157 2.157 . 0 0 "[ ]" 1
1286 1 89 THR H 1 90 GLU H . . 3.600 2.932 2.932 2.932 . 0 0 "[ ]" 1
1287 1 89 THR H 1 91 ARG H . . 6.000 4.147 4.147 4.147 . 0 0 "[ ]" 1
1288 1 89 THR HA 1 92 GLU H . . 3.700 3.306 3.306 3.306 . 0 0 "[ ]" 1
1289 1 89 THR HA 1 92 GLU QB . . 5.300 2.866 2.866 2.866 . 0 0 "[ ]" 1
1290 1 89 THR HA 1 92 GLU HG2 . . 4.300 4.115 4.115 4.115 . 0 0 "[ ]" 1
1291 1 89 THR HA 1 92 GLU HG3 . . 4.100 2.576 2.576 2.576 . 0 0 "[ ]" 1
1292 1 89 THR HA 1 93 ASP H . . 4.300 4.213 4.213 4.213 . 0 0 "[ ]" 1
1293 1 89 THR HB 1 90 GLU H . . 4.300 3.656 3.656 3.656 . 0 0 "[ ]" 1
1294 1 89 THR MG 1 90 GLU H . . 6.800 4.094 4.094 4.094 . 0 0 "[ ]" 1
1295 1 89 THR MG 1 92 GLU H . . 7.000 5.027 5.027 5.027 . 0 0 "[ ]" 1
1296 1 90 GLU H 1 90 GLU HB2 . . 3.500 2.261 2.261 2.261 . 0 0 "[ ]" 1
1297 1 90 GLU H 1 90 GLU HB3 . . 3.900 3.522 3.522 3.522 . 0 0 "[ ]" 1
1298 1 90 GLU H 1 90 GLU HG2 . . 3.900 3.893 3.893 3.893 . 0 0 "[ ]" 1
1299 1 90 GLU H 1 90 GLU QG . . 3.500 2.631 2.631 2.631 . 0 0 "[ ]" 1
1300 1 90 GLU H 1 90 GLU HG3 . . 3.900 2.675 2.675 2.675 . 0 0 "[ ]" 1
1301 1 90 GLU H 1 91 ARG H . . 3.400 2.366 2.366 2.366 . 0 0 "[ ]" 1
1302 1 90 GLU H 1 92 GLU H . . 6.000 4.143 4.143 4.143 . 0 0 "[ ]" 1
1303 1 90 GLU HA 1 90 GLU HG2 . . 3.100 2.486 2.486 2.486 . 0 0 "[ ]" 1
1304 1 90 GLU HA 1 90 GLU HG3 . . 3.100 2.784 2.784 2.784 . 0 0 "[ ]" 1
1305 1 90 GLU HA 1 93 ASP H . . 4.300 3.518 3.518 3.518 . 0 0 "[ ]" 1
1306 1 90 GLU HB2 1 91 ARG H . . 4.900 2.636 2.636 2.636 . 0 0 "[ ]" 1
1307 1 90 GLU HB3 1 91 ARG H . . 3.400 3.416 3.416 3.416 0.016 1 0 "[ ]" 1
1308 1 90 GLU HB3 1 91 ARG HA . . 3.900 4.020 4.020 4.020 0.120 1 0 "[ ]" 1
1309 1 90 GLU HB3 1 91 ARG QB . . 7.000 5.200 5.200 5.200 . 0 0 "[ ]" 1
1310 1 90 GLU HB3 1 92 GLU H . . 6.000 5.700 5.700 5.700 . 0 0 "[ ]" 1
1311 1 91 ARG H 1 92 GLU H . . 3.500 2.822 2.822 2.822 . 0 0 "[ ]" 1
1312 1 91 ARG H 1 93 ASP H . . 5.200 4.247 4.247 4.247 . 0 0 "[ ]" 1
1313 1 91 ARG HA 1 95 ILE H . . 5.300 4.062 4.062 4.062 . 0 0 "[ ]" 1
1314 1 91 ARG HA 1 95 ILE MD . . 5.400 4.506 4.506 4.506 . 0 0 "[ ]" 1
1315 1 91 ARG QB 1 92 GLU QB . . 6.000 4.806 4.806 4.806 . 0 0 "[ ]" 1
1316 1 91 ARG QB 1 93 ASP H . . 6.400 4.917 4.917 4.917 . 0 0 "[ ]" 1
1317 1 92 GLU H 1 92 GLU HG2 . . 3.100 3.201 3.201 3.201 0.101 1 0 "[ ]" 1
1318 1 92 GLU H 1 92 GLU HG3 . . 3.200 2.078 2.078 2.078 . 0 0 "[ ]" 1
1319 1 92 GLU H 1 93 ASP H . . 4.300 2.985 2.985 2.985 . 0 0 "[ ]" 1
1320 1 92 GLU HA 1 92 GLU HG2 . . 3.100 2.659 2.659 2.659 . 0 0 "[ ]" 1
1321 1 92 GLU HA 1 92 GLU HG3 . . 3.100 3.180 3.180 3.180 0.080 1 0 "[ ]" 1
1322 1 92 GLU HA 1 94 LEU H . . 3.900 4.030 4.030 4.030 0.130 1 0 "[ ]" 1
1323 1 92 GLU HA 1 95 ILE H . . 4.100 3.255 3.255 3.255 . 0 0 "[ ]" 1
1324 1 92 GLU HA 1 95 ILE HB . . 3.100 2.682 2.682 2.682 . 0 0 "[ ]" 1
1325 1 92 GLU HA 1 95 ILE QG . . 4.880 2.859 2.859 2.859 . 0 0 "[ ]" 1
1326 1 92 GLU HA 1 95 ILE MG . . 5.900 4.113 4.113 4.113 . 0 0 "[ ]" 1
1327 1 92 GLU HA 1 96 ALA H . . 6.000 3.778 3.778 3.778 . 0 0 "[ ]" 1
1328 1 93 ASP H 1 93 ASP HB2 . . 4.100 2.383 2.383 2.383 . 0 0 "[ ]" 1
1329 1 93 ASP H 1 93 ASP QB . . 3.850 2.350 2.350 2.350 . 0 0 "[ ]" 1
1330 1 93 ASP H 1 93 ASP HB3 . . 4.100 3.588 3.588 3.588 . 0 0 "[ ]" 1
1331 1 93 ASP H 1 94 LEU H . . 3.700 2.713 2.713 2.713 . 0 0 "[ ]" 1
1332 1 93 ASP H 1 94 LEU QD . . 8.570 4.730 4.730 4.730 . 0 0 "[ ]" 1
1333 1 93 ASP HA 1 96 ALA MB . . 3.600 2.525 2.525 2.525 . 0 0 "[ ]" 1
1334 1 93 ASP QB 1 94 LEU H . . 4.070 2.839 2.839 2.839 . 0 0 "[ ]" 1
1335 1 93 ASP HB2 1 94 LEU H . . 4.500 2.954 2.954 2.954 . 0 0 "[ ]" 1
1336 1 93 ASP HB3 1 94 LEU H . . 4.500 3.679 3.679 3.679 . 0 0 "[ ]" 1
1337 1 94 LEU H 1 94 LEU MD1 . . 4.900 3.321 3.321 3.321 . 0 0 "[ ]" 1
1338 1 94 LEU H 1 94 LEU MD2 . . 4.900 4.050 4.050 4.050 . 0 0 "[ ]" 1
1339 1 94 LEU H 1 94 LEU HG . . 2.800 2.779 2.779 2.779 . 0 0 "[ ]" 1
1340 1 94 LEU H 1 95 ILE H . . 3.700 2.535 2.535 2.535 . 0 0 "[ ]" 1
1341 1 94 LEU H 1 96 ALA H . . 5.800 3.879 3.879 3.879 . 0 0 "[ ]" 1
1342 1 94 LEU HA 1 94 LEU MD1 . . 4.500 3.797 3.797 3.797 . 0 0 "[ ]" 1
1343 1 94 LEU HA 1 94 LEU QD . . 3.910 2.228 2.228 2.228 . 0 0 "[ ]" 1
1344 1 94 LEU HA 1 94 LEU MD2 . . 4.500 2.243 2.243 2.243 . 0 0 "[ ]" 1
1345 1 94 LEU HA 1 94 LEU HG . . 3.200 2.570 2.570 2.570 . 0 0 "[ ]" 1
1346 1 94 LEU HA 1 98 LEU H . . 6.000 3.909 3.909 3.909 . 0 0 "[ ]" 1
1347 1 94 LEU QB 1 95 ILE H . . 5.300 2.636 2.636 2.636 . 0 0 "[ ]" 1
1348 1 94 LEU QD 1 97 TYR HD2 . . 7.070 3.556 3.556 3.556 . 0 0 "[ ]" 1
1349 1 94 LEU QD 1 98 LEU MD1 . . 8.070 3.225 3.225 3.225 . 0 0 "[ ]" 1
1350 1 94 LEU HG 1 95 ILE H . . 5.000 4.643 4.643 4.643 . 0 0 "[ ]" 1
1351 1 95 ILE H 1 95 ILE HB . . 3.100 2.522 2.522 2.522 . 0 0 "[ ]" 1
1352 1 95 ILE H 1 95 ILE MD . . 3.900 2.864 2.864 2.864 . 0 0 "[ ]" 1
1353 1 95 ILE H 1 95 ILE QG . . 4.180 2.218 2.218 2.218 . 0 0 "[ ]" 1
1354 1 95 ILE H 1 95 ILE MG . . 4.400 3.736 3.736 3.736 . 0 0 "[ ]" 1
1355 1 95 ILE H 1 96 ALA H . . 3.500 2.668 2.668 2.668 . 0 0 "[ ]" 1
1356 1 95 ILE H 1 96 ALA MB . . 5.100 4.282 4.282 4.282 . 0 0 "[ ]" 1
1357 1 95 ILE H 1 98 LEU MD2 . . 7.000 3.756 3.756 3.756 . 0 0 "[ ]" 1
1358 1 95 ILE HA 1 95 ILE QG . . 3.990 3.175 3.175 3.175 . 0 0 "[ ]" 1
1359 1 95 ILE HA 1 96 ALA MB . . 6.600 5.035 5.035 5.035 . 0 0 "[ ]" 1
1360 1 95 ILE HA 1 98 LEU H . . 3.900 3.409 3.409 3.409 . 0 0 "[ ]" 1
1361 1 95 ILE HA 1 98 LEU QB . . 4.580 2.101 2.101 2.101 . 0 0 "[ ]" 1
1362 1 95 ILE HA 1 98 LEU MD2 . . 4.800 2.217 2.217 2.217 . 0 0 "[ ]" 1
1363 1 95 ILE HA 1 98 LEU HG . . 4.300 4.415 4.415 4.415 0.115 1 0 "[ ]" 1
1364 1 95 ILE HB 1 96 ALA H . . 4.100 2.637 2.637 2.637 . 0 0 "[ ]" 1
1365 1 95 ILE MD 1 98 LEU MD1 . . 6.000 4.016 4.016 4.016 . 0 0 "[ ]" 1
1366 1 95 ILE MG 1 96 ALA H . . 6.800 3.533 3.533 3.533 . 0 0 "[ ]" 1
1367 1 95 ILE MG 1 96 ALA HA . . 6.200 3.683 3.683 3.683 . 0 0 "[ ]" 1
1368 1 96 ALA H 1 96 ALA MB . . 3.500 2.210 2.210 2.210 . 0 0 "[ ]" 1
1369 1 96 ALA HA 1 99 LYS H . . 4.200 3.400 3.400 3.400 . 0 0 "[ ]" 1
1370 1 96 ALA MB 1 97 TYR H . . 3.500 2.298 2.298 2.298 . 0 0 "[ ]" 1
1371 1 96 ALA MB 1 99 LYS H . . 6.500 4.477 4.477 4.477 . 0 0 "[ ]" 1
1372 1 97 TYR H 1 97 TYR HB2 . . 3.900 2.801 2.801 2.801 . 0 0 "[ ]" 1
1373 1 97 TYR H 1 97 TYR HB3 . . 3.500 2.310 2.310 2.310 . 0 0 "[ ]" 1
1374 1 97 TYR H 1 97 TYR HD1 . . 5.100 4.945 4.945 4.945 . 0 0 "[ ]" 1
1375 1 97 TYR H 1 97 TYR HD2 . . 4.800 4.291 4.291 4.291 . 0 0 "[ ]" 1
1376 1 97 TYR H 1 98 LEU H . . 3.700 2.848 2.848 2.848 . 0 0 "[ ]" 1
1377 1 97 TYR H 1 99 LYS H . . 5.400 4.144 4.144 4.144 . 0 0 "[ ]" 1
1378 1 97 TYR HA 1 97 TYR HD1 . . 3.000 2.759 2.759 2.759 . 0 0 "[ ]" 1
1379 1 97 TYR HA 1 97 TYR HD2 . . 4.500 4.253 4.253 4.253 . 0 0 "[ ]" 1
1380 1 97 TYR HA 1 97 TYR HE1 . . 5.400 4.895 4.895 4.895 . 0 0 "[ ]" 1
1381 1 97 TYR HA 1 99 LYS H . . 4.000 4.062 4.062 4.062 0.062 1 0 "[ ]" 1
1382 1 97 TYR HA 1 100 LYS H . . 5.300 3.185 3.185 3.185 . 0 0 "[ ]" 1
1383 1 97 TYR HA 1 100 LYS QB . . 5.700 3.510 3.510 3.510 . 0 0 "[ ]" 1
1384 1 97 TYR HB2 1 97 TYR HD1 . . 3.300 2.533 2.533 2.533 . 0 0 "[ ]" 1
1385 1 97 TYR HB2 1 97 TYR HD2 . . 3.600 3.566 3.566 3.566 . 0 0 "[ ]" 1
1386 1 97 TYR HB3 1 97 TYR HD1 . . 3.700 3.731 3.731 3.731 0.031 1 0 "[ ]" 1
1387 1 97 TYR HB3 1 97 TYR HD2 . . 3.100 2.307 2.307 2.307 . 0 0 "[ ]" 1
1388 1 97 TYR HB3 1 97 TYR HE2 . . 4.900 4.645 4.645 4.645 . 0 0 "[ ]" 1
1389 1 97 TYR HB3 1 98 LEU H . . 4.000 2.914 2.914 2.914 . 0 0 "[ ]" 1
1390 1 97 TYR HD1 1 98 LEU H . . 6.000 5.370 5.370 5.370 . 0 0 "[ ]" 1
1391 1 97 TYR HD1 1 101 ALA MB . . 6.600 3.863 3.863 3.863 . 0 0 "[ ]" 1
1392 1 97 TYR HD2 1 98 LEU H . . 5.400 3.101 3.101 3.101 . 0 0 "[ ]" 1
1393 1 97 TYR HD2 1 98 LEU QB . . 6.180 4.576 4.576 4.576 . 0 0 "[ ]" 1
1394 1 97 TYR HD2 1 98 LEU MD1 . . 5.800 2.375 2.375 2.375 . 0 0 "[ ]" 1
1395 1 97 TYR HE1 1 101 ALA MB . . 5.100 2.928 2.928 2.928 . 0 0 "[ ]" 1
1396 1 97 TYR HE2 1 98 LEU MD1 . . 5.800 3.201 3.201 3.201 . 0 0 "[ ]" 1
1397 1 97 TYR HE2 1 101 ALA MB . . 5.800 3.108 3.108 3.108 . 0 0 "[ ]" 1
1398 1 98 LEU H 1 98 LEU HB2 . . 3.600 2.193 2.193 2.193 . 0 0 "[ ]" 1
1399 1 98 LEU H 1 98 LEU QB . . 3.390 2.171 2.171 2.171 . 0 0 "[ ]" 1
1400 1 98 LEU H 1 98 LEU HB3 . . 3.600 3.491 3.491 3.491 . 0 0 "[ ]" 1
1401 1 98 LEU H 1 98 LEU MD1 . . 4.900 2.351 2.351 2.351 . 0 0 "[ ]" 1
1402 1 98 LEU H 1 98 LEU MD2 . . 4.900 3.429 3.429 3.429 . 0 0 "[ ]" 1
1403 1 98 LEU H 1 98 LEU HG . . 4.100 4.108 4.108 4.108 0.008 1 0 "[ ]" 1
1404 1 98 LEU H 1 99 LYS H . . 4.600 2.872 2.872 2.872 . 0 0 "[ ]" 1
1405 1 98 LEU HA 1 98 LEU MD1 . . 3.700 2.130 2.130 2.130 . 0 0 "[ ]" 1
1406 1 98 LEU HA 1 98 LEU MD2 . . 4.800 3.878 3.878 3.878 . 0 0 "[ ]" 1
1407 1 98 LEU HA 1 98 LEU HG . . 3.400 2.830 2.830 2.830 . 0 0 "[ ]" 1
1408 1 98 LEU HA 1 101 ALA H . . 4.400 3.464 3.464 3.464 . 0 0 "[ ]" 1
1409 1 98 LEU HA 1 101 ALA MB . . 3.500 2.336 2.336 2.336 . 0 0 "[ ]" 1
1410 1 98 LEU HA 1 102 THR H . . 4.700 2.326 2.326 2.326 . 0 0 "[ ]" 1
1411 1 98 LEU HA 1 102 THR MG . . 5.300 2.410 2.410 2.410 . 0 0 "[ ]" 1
1412 1 98 LEU HG 1 99 LYS H . . 5.300 5.205 5.205 5.205 . 0 0 "[ ]" 1
1413 1 99 LYS H 1 99 LYS HB2 . . 3.400 2.234 2.234 2.234 . 0 0 "[ ]" 1
1414 1 99 LYS H 1 99 LYS HB3 . . 3.400 3.489 3.489 3.489 0.089 1 0 "[ ]" 1
1415 1 99 LYS H 1 100 LYS H . . 3.600 2.762 2.762 2.762 . 0 0 "[ ]" 1
1416 1 99 LYS HA 1 99 LYS HG2 . . 3.200 2.277 2.277 2.277 . 0 0 "[ ]" 1
1417 1 99 LYS HA 1 99 LYS QG . . 2.980 2.181 2.181 2.181 . 0 0 "[ ]" 1
1418 1 99 LYS HA 1 99 LYS HG3 . . 3.200 2.788 2.788 2.788 . 0 0 "[ ]" 1
1419 1 99 LYS HA 1 102 THR H . . 6.000 4.445 4.445 4.445 . 0 0 "[ ]" 1
1420 1 99 LYS QB 1 100 LYS H . . 4.070 3.448 3.448 3.448 . 0 0 "[ ]" 1
1421 1 99 LYS HB2 1 100 LYS H . . 4.500 3.707 3.707 3.707 . 0 0 "[ ]" 1
1422 1 99 LYS HB3 1 100 LYS H . . 4.500 4.102 4.102 4.102 . 0 0 "[ ]" 1
1423 1 100 LYS H 1 100 LYS QB . . 3.800 2.805 2.805 2.805 . 0 0 "[ ]" 1
1424 1 100 LYS H 1 100 LYS QD . . 5.900 4.967 4.967 4.967 . 0 0 "[ ]" 1
1425 1 100 LYS H 1 100 LYS HG2 . . 4.400 4.003 4.003 4.003 . 0 0 "[ ]" 1
1426 1 100 LYS H 1 100 LYS QG . . 4.060 3.424 3.424 3.424 . 0 0 "[ ]" 1
1427 1 100 LYS H 1 100 LYS HG3 . . 4.400 3.720 3.720 3.720 . 0 0 "[ ]" 1
1428 1 100 LYS H 1 101 ALA H . . 3.200 2.593 2.593 2.593 . 0 0 "[ ]" 1
1429 1 100 LYS H 1 101 ALA HA . . 6.000 4.864 4.864 4.864 . 0 0 "[ ]" 1
1430 1 100 LYS H 1 101 ALA MB . . 4.700 3.720 3.720 3.720 . 0 0 "[ ]" 1
1431 1 100 LYS HA 1 100 LYS QD . . 4.100 3.687 3.687 3.687 . 0 0 "[ ]" 1
1432 1 100 LYS HA 1 100 LYS HG2 . . 3.600 2.171 2.171 2.171 . 0 0 "[ ]" 1
1433 1 100 LYS HA 1 100 LYS QG . . 3.240 2.141 2.141 2.141 . 0 0 "[ ]" 1
1434 1 100 LYS HA 1 100 LYS HG3 . . 3.600 3.264 3.264 3.264 . 0 0 "[ ]" 1
1435 1 100 LYS QB 1 101 ALA H . . 4.400 3.930 3.930 3.930 . 0 0 "[ ]" 1
1436 1 100 LYS QB 1 101 ALA MB . . 8.000 4.278 4.278 4.278 . 0 0 "[ ]" 1
1437 1 100 LYS QG 1 101 ALA H . . 6.780 4.397 4.397 4.397 . 0 0 "[ ]" 1
1438 1 101 ALA H 1 101 ALA MB . . 3.500 2.799 2.799 2.799 . 0 0 "[ ]" 1
1439 1 101 ALA H 1 102 THR H . . 3.500 2.118 2.118 2.118 . 0 0 "[ ]" 1
1440 1 101 ALA HA 1 102 THR MG . . 5.300 4.421 4.421 4.421 . 0 0 "[ ]" 1
1441 1 101 ALA HA 1 103 ASN H . . 4.300 3.969 3.969 3.969 . 0 0 "[ ]" 1
1442 1 101 ALA HA 1 104 GLU H . . 5.100 4.467 4.467 4.467 . 0 0 "[ ]" 1
1443 1 101 ALA MB 1 102 THR H . . 3.600 2.274 2.274 2.274 . 0 0 "[ ]" 1
1444 1 101 ALA MB 1 102 THR MG . . 7.000 2.423 2.423 2.423 . 0 0 "[ ]" 1
1445 1 101 ALA MB 1 103 ASN H . . 5.200 4.341 4.341 4.341 . 0 0 "[ ]" 1
1446 1 102 THR H 1 102 THR MG . . 4.300 2.341 2.341 2.341 . 0 0 "[ ]" 1
1447 1 102 THR H 1 103 ASN H . . 3.600 3.132 3.132 3.132 . 0 0 "[ ]" 1
1448 1 102 THR MG 1 103 ASN H . . 5.300 4.321 4.321 4.321 . 0 0 "[ ]" 1
1449 1 103 ASN H 1 103 ASN HB2 . . 3.400 3.416 3.416 3.416 0.016 1 0 "[ ]" 1
1450 1 103 ASN H 1 103 ASN HB3 . . 3.700 2.971 2.971 2.971 . 0 0 "[ ]" 1
1451 1 103 ASN H 1 104 GLU H . . 3.400 2.581 2.581 2.581 . 0 0 "[ ]" 1
1452 1 103 ASN HA 1 103 ASN HB2 . . 2.700 2.504 2.504 2.504 . 0 0 "[ ]" 1
1453 1 103 ASN HA 1 103 ASN HB3 . . 3.000 3.038 3.038 3.038 0.038 1 0 "[ ]" 1
1454 1 103 ASN HB2 1 103 ASN HD22 . . 3.800 3.876 3.876 3.876 0.076 1 0 "[ ]" 1
1455 1 103 ASN HB2 1 104 GLU H . . 5.500 3.615 3.615 3.615 . 0 0 "[ ]" 1
1456 1 103 ASN HB3 1 103 ASN HD22 . . 3.600 3.528 3.528 3.528 . 0 0 "[ ]" 1
1457 1 103 ASN HB3 1 104 GLU H . . 4.100 2.071 2.071 2.071 . 0 0 "[ ]" 1
1458 1 104 GLU H 1 104 GLU HB2 . . 4.200 3.685 3.685 3.685 . 0 0 "[ ]" 1
1459 1 104 GLU H 1 104 GLU HB3 . . 4.200 3.169 3.169 3.169 . 0 0 "[ ]" 1
1460 1 104 GLU H 1 104 GLU QG . . 4.800 4.346 4.346 4.346 . 0 0 "[ ]" 1
1461 1 104 GLU HA 1 104 GLU QG . . 3.400 2.592 2.592 2.592 . 0 0 "[ ]" 1
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