NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
395088 |
1rjv   |
6049 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1rjv
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 1071
_Distance_constraint_stats_list.Viol_count 634
_Distance_constraint_stats_list.Viol_total 2313.025
_Distance_constraint_stats_list.Viol_max 0.992
_Distance_constraint_stats_list.Viol_rms 0.0486
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0060
_Distance_constraint_stats_list.Viol_average_violations_only 0.1920
_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 MET 0.000 0.000 . 0 "[ . 1 . ]"
1 2 SER 0.250 0.088 4 0 "[ . 1 . ]"
1 3 MET 0.080 0.027 8 0 "[ . 1 . ]"
1 4 THR 2.013 0.344 14 0 "[ . 1 . ]"
1 5 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 6 LEU 0.298 0.199 5 0 "[ . 1 . ]"
1 7 LEU 0.846 0.112 10 0 "[ . 1 . ]"
1 8 ASN 0.846 0.112 10 0 "[ . 1 . ]"
1 9 ALA 0.059 0.059 17 0 "[ . 1 . ]"
1 10 GLU 0.004 0.004 16 0 "[ . 1 . ]"
1 11 ASP 0.731 0.099 13 0 "[ . 1 . ]"
1 12 ILE 5.518 0.378 13 0 "[ . 1 . ]"
1 13 LYS 2.258 0.605 11 2 "[ . - 1+ . ]"
1 14 LYS 0.574 0.062 2 0 "[ . 1 . ]"
1 15 ALA 3.311 0.378 13 0 "[ . 1 . ]"
1 16 VAL 8.272 0.403 14 0 "[ . 1 . ]"
1 17 GLY 8.630 0.605 11 2 "[ . - 1+ . ]"
1 18 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 19 PHE 1.814 0.199 8 0 "[ . 1 . ]"
1 20 SER 0.013 0.013 7 0 "[ . 1 . ]"
1 21 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 22 THR 0.000 0.000 . 0 "[ . 1 . ]"
1 23 ASP 0.434 0.145 18 0 "[ . 1 . ]"
1 24 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 25 PHE 2.752 0.594 13 1 "[ . 1 + . ]"
1 26 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 27 HIS 0.623 0.297 5 0 "[ . 1 . ]"
1 28 LYS 0.623 0.297 5 0 "[ . 1 . ]"
1 29 LYS 0.054 0.054 14 0 "[ . 1 . ]"
1 30 PHE 0.537 0.105 2 0 "[ . 1 . ]"
1 31 PHE 9.046 0.749 5 6 "[ + -*** . *]"
1 32 GLN 0.000 0.000 . 0 "[ . 1 . ]"
1 33 MET 0.612 0.171 18 0 "[ . 1 . ]"
1 34 VAL 4.200 0.222 5 0 "[ . 1 . ]"
1 35 GLY 0.480 0.337 2 0 "[ . 1 . ]"
1 36 LEU 7.432 0.749 5 6 "[ + -*** . *]"
1 37 LYS 0.337 0.337 2 0 "[ . 1 . ]"
1 38 LYS 9.206 0.992 9 9 "[*- . *+* *. ***]"
1 39 LYS 10.222 0.992 9 9 "[*- . *+* *. ***]"
1 40 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 41 ALA 0.438 0.137 19 0 "[ . 1 . ]"
1 42 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 43 ASP 1.103 0.389 9 0 "[ . 1 . ]"
1 44 VAL 0.028 0.028 16 0 "[ . 1 . ]"
1 45 LYS 0.458 0.137 19 0 "[ . 1 . ]"
1 46 LYS 0.307 0.199 5 0 "[ . 1 . ]"
1 47 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 48 PHE 5.266 0.655 3 4 "[ + ** 1 . - ]"
1 51 LEU 8.496 0.806 14 4 "[ - *. * 1 +. ]"
1 52 ASP 0.274 0.128 9 0 "[ . 1 . ]"
1 53 LYS 7.968 0.963 3 7 "[ +*. **-1 * .* ]"
1 54 ASP 6.756 0.963 3 7 "[ +*. **-1 * .* ]"
1 55 LYS 1.656 0.506 17 1 "[ . 1 . + ]"
1 56 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 57 GLY 1.656 0.506 17 1 "[ . 1 . + ]"
1 58 PHE 0.032 0.031 2 0 "[ . 1 . ]"
1 59 ILE 3.623 0.489 5 0 "[ . 1 . ]"
1 60 GLU 2.855 0.301 5 0 "[ . 1 . ]"
1 61 GLU 6.067 0.486 2 0 "[ . 1 . ]"
1 62 ASP 7.941 0.486 2 0 "[ . 1 . ]"
1 63 GLU 4.832 0.314 8 0 "[ . 1 . ]"
1 64 LEU 1.681 0.543 11 1 "[ . 1+ . ]"
1 65 GLY 0.202 0.081 15 0 "[ . 1 . ]"
1 66 PHE 0.000 0.000 . 0 "[ . 1 . ]"
1 67 ILE 2.501 0.426 6 0 "[ . 1 . ]"
1 68 LEU 2.348 0.594 13 1 "[ . 1 + . ]"
1 69 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 70 GLY 2.058 0.426 6 0 "[ . 1 . ]"
1 71 PHE 0.091 0.086 10 0 "[ . 1 . ]"
1 72 SER 0.345 0.092 17 0 "[ . 1 . ]"
1 73 PRO 0.000 0.000 . 0 "[ . 1 . ]"
1 74 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 75 ALA 0.056 0.056 17 0 "[ . 1 . ]"
1 76 ARG 5.826 0.618 18 7 "[ - . *1 * *. *+*]"
1 77 ASP 5.532 0.618 18 7 "[ - . *1 * *. *+*]"
1 78 LEU 1.113 0.294 7 0 "[ . 1 . ]"
1 79 SER 0.333 0.110 18 0 "[ . 1 . ]"
1 80 ALA 0.235 0.032 9 0 "[ . 1 . ]"
1 81 LYS 0.137 0.110 18 0 "[ . 1 . ]"
1 82 GLU 0.450 0.145 18 0 "[ . 1 . ]"
1 85 MET 0.000 0.000 . 0 "[ . 1 . ]"
1 86 LEU 3.032 0.543 11 1 "[ . 1+ . ]"
1 87 MET 3.704 0.436 2 0 "[ . 1 . ]"
1 88 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 89 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 90 GLY 1.358 0.436 2 0 "[ . 1 . ]"
1 91 ASP 6.286 0.394 19 0 "[ . 1 . ]"
1 92 LYS 3.612 0.680 9 3 "[ .* +1 - . ]"
1 93 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 94 GLY 3.612 0.680 9 3 "[ .* +1 - . ]"
1 95 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 96 GLY 6.286 0.394 19 0 "[ . 1 . ]"
1 97 LYS 0.384 0.076 7 0 "[ . 1 . ]"
1 98 ILE 3.163 0.489 5 0 "[ . 1 . ]"
1 99 GLY 8.914 0.860 13 9 "[ . ****-*+ .* * ]"
1 100 VAL 0.079 0.064 3 0 "[ . 1 . ]"
1 101 ASP 20.752 0.860 13 14 "[ * ******-*+ .****]"
1 102 GLU 6.554 0.615 18 4 "[ . 1- .* +*]"
1 103 PHE 0.000 0.000 . 0 "[ . 1 . ]"
1 104 SER 0.322 0.075 16 0 "[ . 1 . ]"
1 105 THR 0.000 0.000 . 0 "[ . 1 . ]"
1 106 LEU 0.928 0.449 6 0 "[ . 1 . ]"
1 107 VAL 0.463 0.075 16 0 "[ . 1 . ]"
1 108 ALA 0.165 0.033 17 0 "[ . 1 . ]"
1 109 GLU 0.256 0.091 13 0 "[ . 1 . ]"
1 110 SER 0.196 0.068 14 0 "[ . 1 . ]"
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 MET HA 1 2 SER HA . . 6.400 4.797 4.366 5.378 . 0 0 "[ . 1 . ]" 1
2 1 1 MET HA 1 2 SER QB . . 6.900 4.700 4.148 5.488 . 0 0 "[ . 1 . ]" 1
3 1 1 MET QB 1 2 SER HA . . 7.500 4.651 4.017 5.540 . 0 0 "[ . 1 . ]" 1
4 1 1 MET QB 1 6 LEU HG . . 7.500 4.767 2.201 6.277 . 0 0 "[ . 1 . ]" 1
5 1 1 MET QB 1 46 LYS QB . . 7.400 3.978 2.070 6.586 . 0 0 "[ . 1 . ]" 1
6 1 1 MET QB 1 46 LYS QG . . 7.400 4.089 2.314 6.595 . 0 0 "[ . 1 . ]" 1
7 1 1 MET QG 1 5 ASP QB . . 8.500 5.659 2.995 6.790 . 0 0 "[ . 1 . ]" 1
8 1 1 MET QG 1 6 LEU HG . . 7.500 4.574 2.354 6.580 . 0 0 "[ . 1 . ]" 1
9 1 1 MET QG 1 6 LEU MD1 . . 8.500 3.983 2.200 6.620 . 0 0 "[ . 1 . ]" 1
10 1 1 MET QG 1 46 LYS QB . . 7.100 4.047 2.088 6.283 . 0 0 "[ . 1 . ]" 1
11 1 2 SER HA 1 3 MET HA . . 5.200 4.549 4.379 4.862 . 0 0 "[ . 1 . ]" 1
12 1 2 SER HA 1 3 MET QB . . 6.900 4.482 4.022 5.561 . 0 0 "[ . 1 . ]" 1
13 1 2 SER HA 1 4 THR HB . . 4.900 4.573 3.927 4.988 0.088 4 0 "[ . 1 . ]" 1
14 1 2 SER HA 1 4 THR MG . . 7.500 5.686 5.200 6.093 . 0 0 "[ . 1 . ]" 1
15 1 2 SER HA 1 5 ASP QB . . 7.500 4.784 4.183 6.013 . 0 0 "[ . 1 . ]" 1
16 1 2 SER QB 1 3 MET HA . . 6.200 4.647 3.715 4.978 . 0 0 "[ . 1 . ]" 1
17 1 2 SER QB 1 4 THR MG . . 8.500 4.698 3.797 6.341 . 0 0 "[ . 1 . ]" 1
18 1 3 MET HA 1 3 MET QG . . 4.000 2.662 2.060 3.503 . 0 0 "[ . 1 . ]" 1
19 1 3 MET HA 1 4 THR HB . . 5.400 4.862 4.352 5.427 0.027 8 0 "[ . 1 . ]" 1
20 1 3 MET HA 1 5 ASP QB . . 7.500 5.382 4.593 6.141 . 0 0 "[ . 1 . ]" 1
21 1 3 MET HA 1 6 LEU QB . . 4.800 3.198 2.085 4.067 . 0 0 "[ . 1 . ]" 1
22 1 3 MET HA 1 6 LEU HG . . 6.500 4.746 2.642 6.048 . 0 0 "[ . 1 . ]" 1
23 1 3 MET HA 1 6 LEU MD1 . . 7.500 4.602 2.220 6.594 . 0 0 "[ . 1 . ]" 1
24 1 3 MET HA 1 7 LEU QB . . 6.900 3.646 2.371 5.596 . 0 0 "[ . 1 . ]" 1
25 1 3 MET HA 1 7 LEU HG . . 6.500 4.124 2.440 5.192 . 0 0 "[ . 1 . ]" 1
26 1 3 MET HA 1 7 LEU QD . . 7.500 3.369 2.011 4.399 . 0 0 "[ . 1 . ]" 1
27 1 3 MET HA 1 47 VAL QG . . 7.500 4.504 3.467 4.983 . 0 0 "[ . 1 . ]" 1
28 1 3 MET HB3 1 6 LEU QB . . 6.500 5.492 4.314 6.430 . 0 0 "[ . 1 . ]" 1
29 1 3 MET QB 1 4 THR HB . . 7.500 4.858 4.253 5.510 . 0 0 "[ . 1 . ]" 1
30 1 3 MET QB 1 4 THR MG . . 8.500 5.597 5.144 5.974 . 0 0 "[ . 1 . ]" 1
31 1 3 MET QB 1 6 LEU HG . . 7.500 6.216 4.587 6.742 . 0 0 "[ . 1 . ]" 1
32 1 3 MET QB 1 6 LEU MD1 . . 8.500 5.685 3.081 7.335 . 0 0 "[ . 1 . ]" 1
33 1 3 MET QB 1 7 LEU HG . . 7.500 4.709 3.291 6.205 . 0 0 "[ . 1 . ]" 1
34 1 3 MET QB 1 7 LEU QD . . 8.500 3.707 1.987 4.645 . 0 0 "[ . 1 . ]" 1
35 1 3 MET QB 1 12 ILE MD . . 8.500 3.203 2.200 4.069 . 0 0 "[ . 1 . ]" 1
36 1 3 MET QB 1 71 PHE HA . . 7.500 3.106 2.549 3.755 . 0 0 "[ . 1 . ]" 1
37 1 3 MET QB 1 71 PHE HB3 . . 7.500 4.624 4.033 5.273 . 0 0 "[ . 1 . ]" 1
38 1 3 MET QG 1 4 THR MG . . 8.500 6.126 5.441 6.415 . 0 0 "[ . 1 . ]" 1
39 1 3 MET QG 1 6 LEU QB . . 7.400 4.563 2.335 5.931 . 0 0 "[ . 1 . ]" 1
40 1 3 MET QG 1 6 LEU HG . . 7.500 6.044 4.029 6.715 . 0 0 "[ . 1 . ]" 1
41 1 3 MET QG 1 7 LEU QB . . 8.500 3.996 2.274 5.916 . 0 0 "[ . 1 . ]" 1
42 1 3 MET QG 1 7 LEU HG . . 7.500 4.212 2.329 6.766 . 0 0 "[ . 1 . ]" 1
43 1 3 MET QG 1 7 LEU QD . . 8.500 3.276 2.043 5.038 . 0 0 "[ . 1 . ]" 1
44 1 3 MET QG 1 12 ILE MD . . 8.500 3.217 1.914 4.944 . 0 0 "[ . 1 . ]" 1
45 1 3 MET QG 1 47 VAL HA . . 7.500 4.490 3.519 5.667 . 0 0 "[ . 1 . ]" 1
46 1 3 MET QG 1 47 VAL QG . . 8.500 3.824 2.878 5.099 . 0 0 "[ . 1 . ]" 1
47 1 3 MET QG 1 71 PHE HA . . 7.500 2.600 1.987 4.134 . 0 0 "[ . 1 . ]" 1
48 1 3 MET QG 1 71 PHE HB2 . . 7.500 5.212 4.636 6.550 . 0 0 "[ . 1 . ]" 1
49 1 3 MET QG 1 71 PHE HB3 . . 7.500 4.308 3.263 5.645 . 0 0 "[ . 1 . ]" 1
50 1 3 MET QG 1 71 PHE QD . . 9.500 3.267 2.160 4.576 . 0 0 "[ . 1 . ]" 1
51 1 4 THR HA 1 4 THR MG . . 3.400 2.650 2.524 2.789 . 0 0 "[ . 1 . ]" 1
52 1 4 THR HA 1 5 ASP HA . . 5.700 4.740 4.652 4.834 . 0 0 "[ . 1 . ]" 1
53 1 4 THR HA 1 9 ALA HA . . 3.500 2.957 2.470 3.559 0.059 17 0 "[ . 1 . ]" 1
54 1 4 THR HA 1 12 ILE MD . . 7.500 3.385 2.752 3.913 . 0 0 "[ . 1 . ]" 1
55 1 4 THR HB 1 9 ALA HA . . 6.500 5.529 4.990 5.929 . 0 0 "[ . 1 . ]" 1
56 1 4 THR HB 1 9 ALA MB . . 7.500 4.360 3.977 4.959 . 0 0 "[ . 1 . ]" 1
57 1 4 THR HB 1 12 ILE MD . . 7.500 5.511 4.872 5.878 . 0 0 "[ . 1 . ]" 1
58 1 4 THR MG 1 9 ALA HA . . 7.500 4.044 3.425 4.582 . 0 0 "[ . 1 . ]" 1
59 1 4 THR MG 1 9 ALA MB . . 7.600 2.269 2.052 2.933 . 0 0 "[ . 1 . ]" 1
60 1 4 THR MG 1 12 ILE MG . . 7.700 5.216 4.584 5.355 . 0 0 "[ . 1 . ]" 1
61 1 4 THR MG 1 12 ILE HG13 . . 7.500 7.531 7.090 7.844 0.344 14 0 "[ . 1 . ]" 1
62 1 4 THR MG 1 12 ILE MD . . 7.900 5.138 4.688 5.500 . 0 0 "[ . 1 . ]" 1
63 1 5 ASP HA 1 6 LEU HA . . 5.100 4.842 4.595 4.943 . 0 0 "[ . 1 . ]" 1
64 1 5 ASP QB 1 6 LEU MD1 . . 8.500 4.685 3.865 6.171 . 0 0 "[ . 1 . ]" 1
65 1 6 LEU HA 1 6 LEU MD1 . . 3.900 3.222 2.156 3.911 0.011 17 0 "[ . 1 . ]" 1
66 1 6 LEU QB 1 7 LEU QB . . 7.500 3.855 3.480 4.217 . 0 0 "[ . 1 . ]" 1
67 1 6 LEU QB 1 7 LEU HG . . 5.800 3.804 2.295 4.975 . 0 0 "[ . 1 . ]" 1
68 1 6 LEU QB 1 7 LEU QD . . 7.200 2.877 1.965 3.987 . 0 0 "[ . 1 . ]" 1
69 1 6 LEU QB 1 39 LYS QG . . 6.700 4.535 3.488 5.284 . 0 0 "[ . 1 . ]" 1
70 1 6 LEU QB 1 46 LYS QG . . 5.900 5.038 3.885 6.099 0.199 5 0 "[ . 1 . ]" 1
71 1 6 LEU QB 1 47 VAL QG . . 7.500 3.686 3.003 4.183 . 0 0 "[ . 1 . ]" 1
72 1 6 LEU HG 1 46 LYS QB . . 6.500 3.978 2.124 5.001 . 0 0 "[ . 1 . ]" 1
73 1 6 LEU HG 1 47 VAL QG . . 7.200 5.256 2.901 6.139 . 0 0 "[ . 1 . ]" 1
74 1 6 LEU MD1 1 7 LEU HG . . 7.500 5.335 3.554 7.037 . 0 0 "[ . 1 . ]" 1
75 1 6 LEU MD1 1 43 ASP HA . . 7.500 3.243 2.508 4.128 . 0 0 "[ . 1 . ]" 1
76 1 6 LEU MD1 1 43 ASP QB . . 7.500 4.096 1.997 4.917 . 0 0 "[ . 1 . ]" 1
77 1 6 LEU MD1 1 46 LYS QB . . 7.500 2.601 1.912 4.332 . 0 0 "[ . 1 . ]" 1
78 1 6 LEU MD1 1 46 LYS QD . . 8.500 3.125 2.117 4.308 . 0 0 "[ . 1 . ]" 1
79 1 6 LEU MD1 1 46 LYS QE . . 8.500 3.979 2.422 5.652 . 0 0 "[ . 1 . ]" 1
80 1 6 LEU MD1 1 47 VAL HA . . 7.500 5.203 3.480 7.093 . 0 0 "[ . 1 . ]" 1
81 1 6 LEU MD1 1 47 VAL QG . . 7.400 3.868 1.965 5.122 . 0 0 "[ . 1 . ]" 1
82 1 7 LEU HA 1 8 ASN HA . . 5.000 4.960 4.438 5.112 0.112 10 0 "[ . 1 . ]" 1
83 1 7 LEU HA 1 11 ASP QB . . 6.300 5.324 4.801 5.668 . 0 0 "[ . 1 . ]" 1
84 1 7 LEU HA 1 34 VAL MG2 . . 7.500 5.087 4.435 5.791 . 0 0 "[ . 1 . ]" 1
85 1 7 LEU HA 1 39 LYS QD . . 7.500 2.415 1.897 2.852 . 0 0 "[ . 1 . ]" 1
86 1 7 LEU QB 1 11 ASP QB . . 8.500 3.770 3.273 4.734 . 0 0 "[ . 1 . ]" 1
87 1 7 LEU QB 1 12 ILE MG . . 8.500 5.147 4.847 6.405 . 0 0 "[ . 1 . ]" 1
88 1 7 LEU QB 1 12 ILE HG12 . . 7.500 4.311 3.962 6.650 . 0 0 "[ . 1 . ]" 1
89 1 7 LEU QB 1 12 ILE HG13 . . 7.500 4.441 4.196 6.706 . 0 0 "[ . 1 . ]" 1
90 1 7 LEU QB 1 12 ILE MD . . 8.500 2.098 1.905 3.925 . 0 0 "[ . 1 . ]" 1
91 1 7 LEU QB 1 34 VAL MG1 . . 8.500 4.284 3.207 5.412 . 0 0 "[ . 1 . ]" 1
92 1 7 LEU QB 1 34 VAL MG2 . . 8.500 2.999 2.166 3.827 . 0 0 "[ . 1 . ]" 1
93 1 7 LEU QB 1 39 LYS QD . . 8.500 3.892 2.317 4.472 . 0 0 "[ . 1 . ]" 1
94 1 7 LEU QB 1 71 PHE QE . . 9.500 5.899 4.697 7.020 . 0 0 "[ . 1 . ]" 1
95 1 7 LEU HG 1 8 ASN QB . . 7.500 5.992 4.904 6.486 . 0 0 "[ . 1 . ]" 1
96 1 7 LEU HG 1 12 ILE MD . . 7.500 3.085 2.284 4.148 . 0 0 "[ . 1 . ]" 1
97 1 7 LEU HG 1 34 VAL MG1 . . 7.500 4.839 3.700 6.196 . 0 0 "[ . 1 . ]" 1
98 1 7 LEU HG 1 36 LEU MD1 . . 6.700 4.807 3.914 6.025 . 0 0 "[ . 1 . ]" 1
99 1 7 LEU HG 1 39 LYS QD . . 7.500 4.845 3.017 6.024 . 0 0 "[ . 1 . ]" 1
100 1 7 LEU HG 1 47 VAL QG . . 7.100 3.036 2.173 4.487 . 0 0 "[ . 1 . ]" 1
101 1 7 LEU HG 1 71 PHE QD . . 8.500 5.444 4.014 7.010 . 0 0 "[ . 1 . ]" 1
102 1 7 LEU HG 1 71 PHE QE . . 8.500 5.454 3.470 6.509 . 0 0 "[ . 1 . ]" 1
103 1 7 LEU QD 1 11 ASP QB . . 8.500 3.982 1.958 5.117 . 0 0 "[ . 1 . ]" 1
104 1 7 LEU QD 1 12 ILE HG12 . . 5.800 4.281 3.629 5.041 . 0 0 "[ . 1 . ]" 1
105 1 7 LEU QD 1 34 VAL HA . . 7.500 4.466 3.166 6.031 . 0 0 "[ . 1 . ]" 1
106 1 7 LEU QD 1 34 VAL MG1 . . 8.500 2.766 2.082 4.007 . 0 0 "[ . 1 . ]" 1
107 1 7 LEU QD 1 36 LEU HG . . 6.700 2.263 1.924 3.098 . 0 0 "[ . 1 . ]" 1
108 1 7 LEU QD 1 36 LEU MD1 . . 8.500 3.099 2.521 3.745 . 0 0 "[ . 1 . ]" 1
109 1 7 LEU QD 1 47 VAL QG . . 7.100 1.939 1.710 2.541 . 0 0 "[ . 1 . ]" 1
110 1 8 ASN HA 1 9 ALA HA . . 5.700 4.534 4.441 4.574 . 0 0 "[ . 1 . ]" 1
111 1 8 ASN HA 1 9 ALA MB . . 6.800 4.058 3.923 4.175 . 0 0 "[ . 1 . ]" 1
112 1 8 ASN HA 1 10 GLU QB . . 7.500 4.975 4.498 6.082 . 0 0 "[ . 1 . ]" 1
113 1 8 ASN HA 1 11 ASP QB . . 7.500 4.824 4.541 5.802 . 0 0 "[ . 1 . ]" 1
114 1 8 ASN QB 1 11 ASP HA . . 7.500 4.362 4.128 5.031 . 0 0 "[ . 1 . ]" 1
115 1 8 ASN QB 1 11 ASP QB . . 7.500 2.363 2.061 3.307 . 0 0 "[ . 1 . ]" 1
116 1 8 ASN QB 1 12 ILE HG12 . . 7.500 6.547 6.229 7.336 . 0 0 "[ . 1 . ]" 1
117 1 9 ALA HA 1 10 GLU HA . . 5.900 4.902 4.778 4.978 . 0 0 "[ . 1 . ]" 1
118 1 9 ALA HA 1 10 GLU QG . . 7.500 5.565 4.988 6.528 . 0 0 "[ . 1 . ]" 1
119 1 9 ALA HA 1 12 ILE HB . . 5.000 2.297 2.103 2.794 . 0 0 "[ . 1 . ]" 1
120 1 9 ALA HA 1 12 ILE MG . . 7.500 2.983 2.418 3.240 . 0 0 "[ . 1 . ]" 1
121 1 9 ALA HA 1 12 ILE HG12 . . 6.100 4.214 3.856 4.675 . 0 0 "[ . 1 . ]" 1
122 1 9 ALA HA 1 12 ILE HG13 . . 6.500 5.149 4.874 5.510 . 0 0 "[ . 1 . ]" 1
123 1 9 ALA HA 1 12 ILE MD . . 6.600 3.281 2.618 4.368 . 0 0 "[ . 1 . ]" 1
124 1 9 ALA HA 1 13 LYS QB . . 6.300 4.990 4.533 5.638 . 0 0 "[ . 1 . ]" 1
125 1 9 ALA MB 1 10 GLU HA . . 5.000 4.004 3.891 4.120 . 0 0 "[ . 1 . ]" 1
126 1 9 ALA MB 1 10 GLU QG . . 8.500 3.814 3.203 5.221 . 0 0 "[ . 1 . ]" 1
127 1 9 ALA MB 1 12 ILE HB . . 7.500 3.950 3.676 4.416 . 0 0 "[ . 1 . ]" 1
128 1 9 ALA MB 1 12 ILE MG . . 8.500 3.745 3.311 4.040 . 0 0 "[ . 1 . ]" 1
129 1 9 ALA MB 1 12 ILE MD . . 8.500 4.417 3.914 5.366 . 0 0 "[ . 1 . ]" 1
130 1 9 ALA MB 1 13 LYS QB . . 8.500 4.498 4.013 5.203 . 0 0 "[ . 1 . ]" 1
131 1 10 GLU HA 1 11 ASP HA . . 4.900 4.822 4.660 4.904 0.004 16 0 "[ . 1 . ]" 1
132 1 10 GLU HA 1 13 LYS QB . . 6.000 2.674 2.384 3.325 . 0 0 "[ . 1 . ]" 1
133 1 10 GLU HA 1 13 LYS QG . . 6.400 3.686 3.375 4.093 . 0 0 "[ . 1 . ]" 1
134 1 10 GLU HA 1 13 LYS QE . . 7.500 5.377 1.976 6.373 . 0 0 "[ . 1 . ]" 1
135 1 10 GLU HA 1 14 LYS QD . . 7.500 5.531 4.100 6.683 . 0 0 "[ . 1 . ]" 1
136 1 10 GLU QB 1 11 ASP HA . . 7.500 4.014 3.805 4.383 . 0 0 "[ . 1 . ]" 1
137 1 10 GLU QB 1 13 LYS QB . . 8.100 4.377 4.089 4.745 . 0 0 "[ . 1 . ]" 1
138 1 10 GLU QB 1 14 LYS QG . . 8.500 5.302 4.300 6.352 . 0 0 "[ . 1 . ]" 1
139 1 10 GLU QB 1 14 LYS QD . . 8.500 4.901 3.640 6.108 . 0 0 "[ . 1 . ]" 1
140 1 10 GLU QG 1 13 LYS QE . . 8.500 6.006 2.841 6.781 . 0 0 "[ . 1 . ]" 1
141 1 11 ASP HA 1 14 LYS QB . . 4.900 3.130 2.667 4.850 . 0 0 "[ . 1 . ]" 1
142 1 11 ASP HA 1 14 LYS QD . . 7.500 3.653 2.180 5.627 . 0 0 "[ . 1 . ]" 1
143 1 11 ASP HA 1 34 VAL HA . . 3.400 3.427 3.261 3.499 0.099 13 0 "[ . 1 . ]" 1
144 1 11 ASP QB 1 12 ILE HA . . 6.900 4.180 3.974 4.845 . 0 0 "[ . 1 . ]" 1
145 1 11 ASP QB 1 12 ILE HB . . 7.500 4.471 4.117 5.530 . 0 0 "[ . 1 . ]" 1
146 1 11 ASP QB 1 12 ILE HG13 . . 7.500 5.228 4.957 6.212 . 0 0 "[ . 1 . ]" 1
147 1 11 ASP QB 1 34 VAL HA . . 7.500 2.058 1.981 2.222 . 0 0 "[ . 1 . ]" 1
148 1 11 ASP QB 1 34 VAL MG2 . . 8.500 3.031 2.830 3.529 . 0 0 "[ . 1 . ]" 1
149 1 11 ASP QB 1 38 LYS QE . . 8.500 4.991 3.940 6.449 . 0 0 "[ . 1 . ]" 1
150 1 12 ILE HA 1 12 ILE MG . . 3.400 2.870 2.836 3.011 . 0 0 "[ . 1 . ]" 1
151 1 12 ILE HA 1 12 ILE HG12 . . 3.800 3.504 3.480 3.554 . 0 0 "[ . 1 . ]" 1
152 1 12 ILE HA 1 12 ILE HG13 . . 3.500 2.180 2.148 2.244 . 0 0 "[ . 1 . ]" 1
153 1 12 ILE HA 1 12 ILE MD . . 3.400 2.779 2.419 2.858 . 0 0 "[ . 1 . ]" 1
154 1 12 ILE HA 1 13 LYS HA . . 5.400 4.809 4.730 4.883 . 0 0 "[ . 1 . ]" 1
155 1 12 ILE HA 1 15 ALA MB . . 3.400 2.127 1.950 2.305 . 0 0 "[ . 1 . ]" 1
156 1 12 ILE HA 1 16 VAL MG1 . . 7.500 6.197 4.789 6.346 . 0 0 "[ . 1 . ]" 1
157 1 12 ILE HA 1 16 VAL MG2 . . 7.500 3.755 3.424 4.510 . 0 0 "[ . 1 . ]" 1
158 1 12 ILE HA 1 34 VAL HA . . 3.600 3.684 3.617 3.750 0.150 11 0 "[ . 1 . ]" 1
159 1 12 ILE HA 1 34 VAL MG1 . . 7.500 4.788 4.541 4.938 . 0 0 "[ . 1 . ]" 1
160 1 12 ILE HA 1 34 VAL MG2 . . 7.000 2.103 1.958 2.267 . 0 0 "[ . 1 . ]" 1
161 1 12 ILE HA 1 71 PHE HB2 . . 6.500 6.271 5.900 6.504 0.004 14 0 "[ . 1 . ]" 1
162 1 12 ILE HA 1 71 PHE HB3 . . 6.500 4.721 4.453 4.943 . 0 0 "[ . 1 . ]" 1
163 1 12 ILE HA 1 71 PHE QD . . 8.500 5.279 3.619 6.084 . 0 0 "[ . 1 . ]" 1
164 1 12 ILE HB 1 12 ILE MD . . 3.400 2.254 2.205 2.276 . 0 0 "[ . 1 . ]" 1
165 1 12 ILE HB 1 13 LYS HA . . 5.900 5.142 4.980 5.633 . 0 0 "[ . 1 . ]" 1
166 1 12 ILE HB 1 16 VAL MG2 . . 7.500 4.952 4.765 5.345 . 0 0 "[ . 1 . ]" 1
167 1 12 ILE HB 1 71 PHE HB3 . . 6.500 5.879 5.239 6.427 . 0 0 "[ . 1 . ]" 1
168 1 12 ILE HG12 1 12 ILE MG . . 3.700 2.104 2.081 2.123 . 0 0 "[ . 1 . ]" 1
169 1 12 ILE HG13 1 12 ILE MG . . 3.400 2.605 2.487 2.648 . 0 0 "[ . 1 . ]" 1
170 1 12 ILE MG 1 13 LYS HA . . 7.500 3.204 3.087 3.322 . 0 0 "[ . 1 . ]" 1
171 1 12 ILE MG 1 16 VAL HA . . 7.500 5.356 5.071 5.648 . 0 0 "[ . 1 . ]" 1
172 1 12 ILE MG 1 16 VAL MG2 . . 7.100 2.493 2.254 3.070 . 0 0 "[ . 1 . ]" 1
173 1 12 ILE MG 1 34 VAL HA . . 7.500 5.863 5.779 5.931 . 0 0 "[ . 1 . ]" 1
174 1 12 ILE MG 1 71 PHE HA . . 7.500 4.644 4.180 5.128 . 0 0 "[ . 1 . ]" 1
175 1 12 ILE MG 1 71 PHE HB2 . . 7.500 4.778 4.336 5.292 . 0 0 "[ . 1 . ]" 1
176 1 12 ILE MG 1 71 PHE HB3 . . 7.500 3.660 3.209 4.201 . 0 0 "[ . 1 . ]" 1
177 1 12 ILE MG 1 72 SER HA . . 7.500 4.128 3.915 4.329 . 0 0 "[ . 1 . ]" 1
178 1 12 ILE MG 1 72 SER QB . . 8.500 2.338 1.920 2.883 . 0 0 "[ . 1 . ]" 1
179 1 12 ILE HG12 1 13 LYS HA . . 6.500 6.504 6.225 6.615 0.115 8 0 "[ . 1 . ]" 1
180 1 12 ILE HG13 1 15 ALA HA . . 6.400 6.309 5.840 6.778 0.378 13 0 "[ . 1 . ]" 1
181 1 12 ILE HG13 1 16 VAL MG2 . . 7.500 3.886 2.983 5.268 . 0 0 "[ . 1 . ]" 1
182 1 12 ILE MD 1 13 LYS HA . . 7.500 6.240 6.196 6.279 . 0 0 "[ . 1 . ]" 1
183 1 12 ILE MD 1 34 VAL MG1 . . 8.500 4.027 3.851 4.368 . 0 0 "[ . 1 . ]" 1
184 1 12 ILE MD 1 71 PHE HA . . 7.500 4.576 3.143 5.030 . 0 0 "[ . 1 . ]" 1
185 1 12 ILE MD 1 71 PHE HB2 . . 7.500 5.907 4.488 6.248 . 0 0 "[ . 1 . ]" 1
186 1 12 ILE MD 1 71 PHE HB3 . . 7.500 4.486 3.144 4.849 . 0 0 "[ . 1 . ]" 1
187 1 13 LYS HA 1 13 LYS QG . . 3.400 3.071 2.155 3.395 . 0 0 "[ . 1 . ]" 1
188 1 13 LYS HA 1 13 LYS QE . . 5.900 4.292 3.377 5.277 . 0 0 "[ . 1 . ]" 1
189 1 13 LYS HA 1 16 VAL HB . . 5.200 3.539 3.082 4.897 . 0 0 "[ . 1 . ]" 1
190 1 13 LYS HA 1 16 VAL MG1 . . 7.500 4.769 4.152 5.060 . 0 0 "[ . 1 . ]" 1
191 1 13 LYS HA 1 16 VAL MG2 . . 7.500 3.764 2.131 4.255 . 0 0 "[ . 1 . ]" 1
192 1 13 LYS HA 1 72 SER QB . . 7.500 4.958 4.608 5.350 . 0 0 "[ . 1 . ]" 1
193 1 13 LYS QG 1 16 VAL HB . . 6.500 5.769 4.513 6.654 0.154 15 0 "[ . 1 . ]" 1
194 1 13 LYS QG 1 16 VAL MG2 . . 7.500 5.764 4.007 6.317 . 0 0 "[ . 1 . ]" 1
195 1 13 LYS QG 1 17 GLY HA3 . . 6.500 5.923 5.133 7.105 0.605 11 2 "[ . - 1+ . ]" 1
196 1 13 LYS QG 1 14 LYS QG . . 7.500 3.452 2.219 6.473 . 0 0 "[ . 1 . ]" 1
197 1 13 LYS QG 1 14 LYS QD . . 5.700 4.279 2.680 5.221 . 0 0 "[ . 1 . ]" 1
198 1 14 LYS HA 1 15 ALA HA . . 4.800 4.829 4.785 4.862 0.062 2 0 "[ . 1 . ]" 1
199 1 14 LYS QB 1 33 MET HG3 . . 6.500 4.286 2.315 5.361 . 0 0 "[ . 1 . ]" 1
200 1 15 ALA HA 1 16 VAL HA . . 5.400 4.807 4.767 4.852 . 0 0 "[ . 1 . ]" 1
201 1 15 ALA HA 1 18 ALA MB . . 3.900 2.851 2.425 3.068 . 0 0 "[ . 1 . ]" 1
202 1 15 ALA HA 1 30 PHE HA . . 3.000 2.996 2.770 3.105 0.105 2 0 "[ . 1 . ]" 1
203 1 15 ALA HA 1 33 MET QB . . 7.500 2.961 2.390 3.468 . 0 0 "[ . 1 . ]" 1
204 1 15 ALA HA 1 33 MET HG2 . . 5.800 5.509 3.952 5.971 0.171 18 0 "[ . 1 . ]" 1
205 1 15 ALA HA 1 33 MET HG3 . . 6.500 5.184 3.305 6.506 0.006 14 0 "[ . 1 . ]" 1
206 1 15 ALA MB 1 16 VAL HA . . 4.600 3.813 3.732 3.875 . 0 0 "[ . 1 . ]" 1
207 1 15 ALA MB 1 16 VAL HB . . 7.200 4.465 4.237 5.332 . 0 0 "[ . 1 . ]" 1
208 1 15 ALA MB 1 16 VAL MG1 . . 7.100 4.790 3.433 5.015 . 0 0 "[ . 1 . ]" 1
209 1 15 ALA MB 1 19 PHE QD . . 9.500 5.161 4.611 6.011 . 0 0 "[ . 1 . ]" 1
210 1 15 ALA MB 1 19 PHE QE . . 9.500 5.343 4.914 6.045 . 0 0 "[ . 1 . ]" 1
211 1 15 ALA MB 1 30 PHE HA . . 7.500 3.615 2.824 3.995 . 0 0 "[ . 1 . ]" 1
212 1 15 ALA MB 1 30 PHE QE . . 9.500 2.664 2.476 2.826 . 0 0 "[ . 1 . ]" 1
213 1 15 ALA MB 1 30 PHE HZ . . 7.500 3.011 2.377 3.870 . 0 0 "[ . 1 . ]" 1
214 1 15 ALA MB 1 33 MET QB . . 8.500 3.534 2.649 4.102 . 0 0 "[ . 1 . ]" 1
215 1 15 ALA MB 1 33 MET HG3 . . 7.500 5.839 4.422 6.782 . 0 0 "[ . 1 . ]" 1
216 1 15 ALA MB 1 34 VAL HA . . 7.500 2.711 2.469 3.112 . 0 0 "[ . 1 . ]" 1
217 1 15 ALA MB 1 34 VAL MG1 . . 8.500 3.146 2.972 3.284 . 0 0 "[ . 1 . ]" 1
218 1 15 ALA MB 1 34 VAL MG2 . . 7.700 2.140 1.979 2.525 . 0 0 "[ . 1 . ]" 1
219 1 16 VAL HA 1 16 VAL MG1 . . 3.400 2.424 2.249 2.524 . 0 0 "[ . 1 . ]" 1
220 1 16 VAL HA 1 16 VAL MG2 . . 3.500 2.426 2.288 3.129 . 0 0 "[ . 1 . ]" 1
221 1 16 VAL HA 1 17 GLY HA2 . . 4.500 4.877 4.811 4.903 0.403 14 0 "[ . 1 . ]" 1
222 1 16 VAL HA 1 19 PHE QB . . 7.500 3.487 3.097 3.925 . 0 0 "[ . 1 . ]" 1
223 1 16 VAL HA 1 30 PHE QE . . 8.500 2.750 2.157 3.289 . 0 0 "[ . 1 . ]" 1
224 1 16 VAL HA 1 68 LEU MD1 . . 7.500 4.048 2.604 5.240 . 0 0 "[ . 1 . ]" 1
225 1 16 VAL HA 1 75 ALA MB . . 7.500 5.492 4.495 6.018 . 0 0 "[ . 1 . ]" 1
226 1 16 VAL HB 1 68 LEU QB . . 5.900 5.751 4.963 6.085 0.185 2 0 "[ . 1 . ]" 1
227 1 16 VAL HB 1 75 ALA HA . . 6.500 5.658 4.193 6.556 0.056 17 0 "[ . 1 . ]" 1
228 1 16 VAL HB 1 75 ALA MB . . 7.500 5.953 5.103 6.289 . 0 0 "[ . 1 . ]" 1
229 1 16 VAL MG1 1 20 SER HA . . 7.500 4.541 4.047 6.239 . 0 0 "[ . 1 . ]" 1
230 1 16 VAL MG1 1 30 PHE QE . . 9.500 4.447 3.653 5.017 . 0 0 "[ . 1 . ]" 1
231 1 16 VAL MG1 1 68 LEU QB . . 7.500 3.182 2.859 3.573 . 0 0 "[ . 1 . ]" 1
232 1 16 VAL MG1 1 68 LEU MD1 . . 8.500 3.492 2.184 5.276 . 0 0 "[ . 1 . ]" 1
233 1 16 VAL MG1 1 71 PHE HB2 . . 7.500 4.636 3.332 5.121 . 0 0 "[ . 1 . ]" 1
234 1 16 VAL MG1 1 71 PHE HB3 . . 7.500 5.054 3.386 5.732 . 0 0 "[ . 1 . ]" 1
235 1 16 VAL MG1 1 72 SER QB . . 8.500 3.336 2.122 3.800 . 0 0 "[ . 1 . ]" 1
236 1 16 VAL MG1 1 75 ALA HA . . 7.500 2.719 2.062 3.391 . 0 0 "[ . 1 . ]" 1
237 1 16 VAL MG1 1 75 ALA MB . . 6.900 3.450 2.566 3.808 . 0 0 "[ . 1 . ]" 1
238 1 16 VAL MG2 1 30 PHE QD . . 9.500 5.104 4.268 6.118 . 0 0 "[ . 1 . ]" 1
239 1 16 VAL MG2 1 30 PHE QE . . 9.500 3.392 2.593 4.856 . 0 0 "[ . 1 . ]" 1
240 1 16 VAL MG2 1 30 PHE HZ . . 7.500 4.031 2.890 5.398 . 0 0 "[ . 1 . ]" 1
241 1 16 VAL MG2 1 68 LEU QB . . 7.500 3.541 3.065 5.509 . 0 0 "[ . 1 . ]" 1
242 1 16 VAL MG2 1 68 LEU MD1 . . 8.500 4.452 3.414 5.628 . 0 0 "[ . 1 . ]" 1
243 1 16 VAL MG2 1 71 PHE HB2 . . 7.500 3.156 2.493 5.551 . 0 0 "[ . 1 . ]" 1
244 1 16 VAL MG2 1 71 PHE HB3 . . 7.500 3.092 2.627 5.163 . 0 0 "[ . 1 . ]" 1
245 1 17 GLY HA2 1 20 SER HA . . 5.800 5.136 4.631 5.813 0.013 7 0 "[ . 1 . ]" 1
246 1 17 GLY HA2 1 20 SER QB . . 7.500 2.437 2.079 2.933 . 0 0 "[ . 1 . ]" 1
247 1 18 ALA HA 1 19 PHE HA . . 6.500 4.743 4.562 4.863 . 0 0 "[ . 1 . ]" 1
248 1 18 ALA MB 1 33 MET HG3 . . 7.500 4.089 2.797 5.581 . 0 0 "[ . 1 . ]" 1
249 1 19 PHE HA 1 25 PHE HA . . 3.300 3.375 2.933 3.499 0.199 8 0 "[ . 1 . ]" 1
250 1 19 PHE HA 1 68 LEU MD1 . . 7.500 4.255 3.952 4.587 . 0 0 "[ . 1 . ]" 1
251 1 19 PHE QB 1 24 SER QB . . 8.500 5.979 5.158 6.675 . 0 0 "[ . 1 . ]" 1
252 1 19 PHE QB 1 25 PHE QB . . 8.500 5.341 4.521 6.007 . 0 0 "[ . 1 . ]" 1
253 1 19 PHE QB 1 25 PHE QD . . 9.500 3.706 2.761 5.115 . 0 0 "[ . 1 . ]" 1
254 1 19 PHE QB 1 25 PHE QE . . 9.500 4.190 2.862 6.216 . 0 0 "[ . 1 . ]" 1
255 1 19 PHE QB 1 30 PHE QD . . 9.500 3.647 3.198 4.255 . 0 0 "[ . 1 . ]" 1
256 1 19 PHE QD 1 30 PHE HA . . 8.500 5.294 4.494 5.734 . 0 0 "[ . 1 . ]" 1
257 1 19 PHE QD 1 30 PHE QB . . 9.500 3.355 2.403 3.905 . 0 0 "[ . 1 . ]" 1
258 1 19 PHE QE 1 30 PHE QB . . 9.500 2.633 1.961 3.250 . 0 0 "[ . 1 . ]" 1
259 1 19 PHE QE 1 98 ILE MG . . 9.500 7.112 7.011 7.173 . 0 0 "[ . 1 . ]" 1
260 1 19 PHE QE 1 106 LEU MD1 . . 9.500 6.982 5.787 8.650 . 0 0 "[ . 1 . ]" 1
261 1 20 SER HA 1 21 ALA HA . . 6.500 4.451 4.354 4.550 . 0 0 "[ . 1 . ]" 1
262 1 20 SER HA 1 76 ARG QD . . 7.500 4.718 3.636 6.006 . 0 0 "[ . 1 . ]" 1
263 1 20 SER QB 1 21 ALA HA . . 7.500 4.773 4.457 5.096 . 0 0 "[ . 1 . ]" 1
264 1 20 SER QB 1 76 ARG QD . . 8.500 4.779 3.995 5.859 . 0 0 "[ . 1 . ]" 1
265 1 21 ALA HA 1 22 THR HA . . 4.900 4.564 4.413 4.859 . 0 0 "[ . 1 . ]" 1
266 1 21 ALA HA 1 22 THR HB . . 6.300 5.935 5.721 6.144 . 0 0 "[ . 1 . ]" 1
267 1 21 ALA HA 1 22 THR MG . . 7.500 3.737 3.335 4.095 . 0 0 "[ . 1 . ]" 1
268 1 21 ALA HA 1 76 ARG QD . . 7.500 6.136 4.604 6.708 . 0 0 "[ . 1 . ]" 1
269 1 21 ALA MB 1 24 SER HA . . 5.900 4.353 4.030 4.611 . 0 0 "[ . 1 . ]" 1
270 1 21 ALA MB 1 24 SER QB . . 8.500 2.033 1.893 2.282 . 0 0 "[ . 1 . ]" 1
271 1 22 THR HA 1 22 THR MG . . 3.500 2.324 2.252 2.415 . 0 0 "[ . 1 . ]" 1
272 1 22 THR HA 1 23 ASP HA . . 6.500 4.542 4.252 4.762 . 0 0 "[ . 1 . ]" 1
273 1 22 THR HA 1 79 SER QB . . 7.500 2.934 2.084 4.245 . 0 0 "[ . 1 . ]" 1
274 1 22 THR HB 1 23 ASP HA . . 6.500 4.815 4.417 5.347 . 0 0 "[ . 1 . ]" 1
275 1 22 THR HB 1 23 ASP QB . . 7.500 4.084 3.460 4.898 . 0 0 "[ . 1 . ]" 1
276 1 22 THR HB 1 79 SER QB . . 7.500 2.552 2.061 3.911 . 0 0 "[ . 1 . ]" 1
277 1 22 THR HB 1 81 LYS QG . . 6.500 5.602 5.181 6.250 . 0 0 "[ . 1 . ]" 1
278 1 22 THR MG 1 23 ASP HA . . 7.500 5.674 5.520 5.945 . 0 0 "[ . 1 . ]" 1
279 1 22 THR MG 1 76 ARG QD . . 8.500 5.741 4.925 6.320 . 0 0 "[ . 1 . ]" 1
280 1 22 THR MG 1 79 SER QB . . 8.500 3.360 2.411 4.944 . 0 0 "[ . 1 . ]" 1
281 1 23 ASP HA 1 25 PHE HA . . 6.500 5.642 5.193 6.083 . 0 0 "[ . 1 . ]" 1
282 1 23 ASP HA 1 25 PHE QB . . 7.500 4.068 3.306 4.630 . 0 0 "[ . 1 . ]" 1
283 1 23 ASP HA 1 79 SER QB . . 7.500 3.044 2.316 4.781 . 0 0 "[ . 1 . ]" 1
284 1 23 ASP HA 1 81 LYS HB2 . . 6.500 3.931 3.371 4.458 . 0 0 "[ . 1 . ]" 1
285 1 23 ASP HA 1 81 LYS QG . . 6.500 5.359 4.983 6.186 . 0 0 "[ . 1 . ]" 1
286 1 23 ASP HA 1 81 LYS QD . . 7.500 6.037 4.723 6.772 . 0 0 "[ . 1 . ]" 1
287 1 23 ASP HA 1 82 GLU HA . . 3.300 3.205 2.811 3.445 0.145 18 0 "[ . 1 . ]" 1
288 1 23 ASP HA 1 82 GLU QB . . 7.500 2.147 1.866 3.060 . 0 0 "[ . 1 . ]" 1
289 1 23 ASP HA 1 82 GLU QG . . 7.500 2.408 1.990 3.449 . 0 0 "[ . 1 . ]" 1
290 1 23 ASP QB 1 25 PHE HA . . 7.500 6.717 6.608 6.883 . 0 0 "[ . 1 . ]" 1
291 1 23 ASP QB 1 79 SER QB . . 8.500 3.041 2.086 4.149 . 0 0 "[ . 1 . ]" 1
292 1 23 ASP QB 1 80 ALA MB . . 8.500 6.111 5.196 6.382 . 0 0 "[ . 1 . ]" 1
293 1 23 ASP QB 1 81 LYS HB2 . . 6.900 2.397 2.026 2.870 . 0 0 "[ . 1 . ]" 1
294 1 23 ASP QB 1 81 LYS QD . . 8.500 4.270 2.830 5.462 . 0 0 "[ . 1 . ]" 1
295 1 23 ASP QB 1 82 GLU QG . . 8.500 3.913 3.281 4.874 . 0 0 "[ . 1 . ]" 1
296 1 24 SER HA 1 82 GLU QB . . 7.500 6.226 5.357 6.759 . 0 0 "[ . 1 . ]" 1
297 1 24 SER QB 1 25 PHE QB . . 8.500 5.024 4.316 5.278 . 0 0 "[ . 1 . ]" 1
298 1 25 PHE HA 1 26 ASP HA . . 5.700 4.643 4.325 5.401 . 0 0 "[ . 1 . ]" 1
299 1 25 PHE HA 1 26 ASP QB . . 7.500 4.158 3.470 4.485 . 0 0 "[ . 1 . ]" 1
300 1 25 PHE QB 1 78 LEU MD2 . . 8.500 4.845 3.621 5.737 . 0 0 "[ . 1 . ]" 1
301 1 25 PHE QB 1 82 GLU HA . . 7.500 3.623 3.007 4.215 . 0 0 "[ . 1 . ]" 1
302 1 25 PHE QB 1 82 GLU QB . . 8.500 3.817 2.020 4.303 . 0 0 "[ . 1 . ]" 1
303 1 25 PHE QB 1 82 GLU QG . . 8.500 2.266 1.896 3.995 . 0 0 "[ . 1 . ]" 1
304 1 25 PHE QD 1 30 PHE QB . . 9.500 5.531 4.723 6.081 . 0 0 "[ . 1 . ]" 1
305 1 25 PHE QD 1 68 LEU HG . . 8.500 6.105 4.918 6.793 . 0 0 "[ . 1 . ]" 1
306 1 25 PHE QD 1 68 LEU MD1 . . 9.500 4.653 3.229 5.568 . 0 0 "[ . 1 . ]" 1
307 1 25 PHE QD 1 78 LEU MD2 . . 9.500 3.731 2.298 5.528 . 0 0 "[ . 1 . ]" 1
308 1 25 PHE QD 1 86 LEU HG . . 8.500 4.797 3.223 6.227 . 0 0 "[ . 1 . ]" 1
309 1 25 PHE QD 1 86 LEU QD . . 9.500 2.887 2.195 3.593 . 0 0 "[ . 1 . ]" 1
310 1 25 PHE QE 1 30 PHE QB . . 9.500 5.142 4.725 5.935 . 0 0 "[ . 1 . ]" 1
311 1 25 PHE QE 1 67 ILE MG . . 9.500 4.018 2.932 5.361 . 0 0 "[ . 1 . ]" 1
312 1 25 PHE QE 1 67 ILE MD . . 9.500 3.948 3.182 4.647 . 0 0 "[ . 1 . ]" 1
313 1 25 PHE QE 1 68 LEU MD1 . . 9.500 4.452 2.013 5.947 . 0 0 "[ . 1 . ]" 1
314 1 25 PHE QE 1 86 LEU HG . . 8.500 3.908 2.238 4.870 . 0 0 "[ . 1 . ]" 1
315 1 25 PHE QE 1 86 LEU QD . . 9.500 2.252 2.039 2.675 . 0 0 "[ . 1 . ]" 1
316 1 25 PHE HZ 1 27 HIS HA . . 6.500 4.574 3.757 5.540 . 0 0 "[ . 1 . ]" 1
317 1 25 PHE HZ 1 30 PHE QB . . 7.500 5.688 5.084 6.710 . 0 0 "[ . 1 . ]" 1
318 1 25 PHE HZ 1 67 ILE MG . . 7.500 4.745 2.835 6.009 . 0 0 "[ . 1 . ]" 1
319 1 25 PHE HZ 1 67 ILE MD . . 7.500 4.285 2.428 6.051 . 0 0 "[ . 1 . ]" 1
320 1 25 PHE HZ 1 68 LEU MD1 . . 7.500 6.359 3.548 8.094 0.594 13 1 "[ . 1 + . ]" 1
321 1 25 PHE HZ 1 86 LEU HG . . 6.500 4.049 2.413 5.409 . 0 0 "[ . 1 . ]" 1
322 1 26 ASP HA 1 27 HIS HA . . 6.500 4.694 4.522 4.852 . 0 0 "[ . 1 . ]" 1
323 1 26 ASP HA 1 27 HIS HB2 . . 6.500 5.685 4.293 6.145 . 0 0 "[ . 1 . ]" 1
324 1 26 ASP QB 1 28 LYS QB . . 8.500 5.093 3.734 6.429 . 0 0 "[ . 1 . ]" 1
325 1 26 ASP QB 1 29 LYS QB . . 7.500 2.409 1.973 2.903 . 0 0 "[ . 1 . ]" 1
326 1 26 ASP QB 1 30 PHE QB . . 8.500 4.069 3.286 4.697 . 0 0 "[ . 1 . ]" 1
327 1 27 HIS HA 1 28 LYS HA . . 5.600 4.955 4.798 5.105 . 0 0 "[ . 1 . ]" 1
328 1 27 HIS HA 1 30 PHE QB . . 7.000 2.336 2.061 2.737 . 0 0 "[ . 1 . ]" 1
329 1 27 HIS HA 1 31 PHE QD . . 8.500 3.642 3.215 4.644 . 0 0 "[ . 1 . ]" 1
330 1 27 HIS HA 1 31 PHE QE . . 8.500 4.865 3.963 6.387 . 0 0 "[ . 1 . ]" 1
331 1 27 HIS HB2 1 28 LYS HA . . 5.500 4.827 4.170 5.797 0.297 5 0 "[ . 1 . ]" 1
332 1 27 HIS HB2 1 30 PHE QB . . 7.000 4.374 3.539 5.135 . 0 0 "[ . 1 . ]" 1
333 1 27 HIS HB2 1 86 LEU QD . . 7.500 4.667 3.487 5.751 . 0 0 "[ . 1 . ]" 1
334 1 27 HIS HB2 1 106 LEU QB . . 7.500 5.120 3.685 6.716 . 0 0 "[ . 1 . ]" 1
335 1 27 HIS HB3 1 30 PHE QB . . 7.500 4.504 3.998 5.060 . 0 0 "[ . 1 . ]" 1
336 1 27 HIS HB3 1 106 LEU QB . . 7.500 5.792 3.973 6.710 . 0 0 "[ . 1 . ]" 1
337 1 28 LYS HA 1 28 LYS QG . . 3.800 2.886 2.162 3.555 . 0 0 "[ . 1 . ]" 1
338 1 28 LYS HA 1 28 LYS QD . . 5.000 3.950 2.716 4.479 . 0 0 "[ . 1 . ]" 1
339 1 28 LYS HA 1 28 LYS QE . . 6.300 4.624 2.831 5.564 . 0 0 "[ . 1 . ]" 1
340 1 28 LYS HA 1 31 PHE HB2 . . 6.500 3.271 2.704 4.240 . 0 0 "[ . 1 . ]" 1
341 1 28 LYS HA 1 31 PHE HB3 . . 6.500 4.599 4.222 5.362 . 0 0 "[ . 1 . ]" 1
342 1 28 LYS HA 1 31 PHE QD . . 8.500 4.844 4.362 5.760 . 0 0 "[ . 1 . ]" 1
343 1 28 LYS HA 1 31 PHE QE . . 8.500 6.553 5.939 7.582 . 0 0 "[ . 1 . ]" 1
344 1 28 LYS HA 1 32 GLN QB . . 6.800 5.212 4.749 5.599 . 0 0 "[ . 1 . ]" 1
345 1 28 LYS HA 1 32 GLN QG . . 7.500 4.242 3.510 5.563 . 0 0 "[ . 1 . ]" 1
346 1 28 LYS HA 1 107 VAL MG1 . . 7.500 2.789 2.121 3.711 . 0 0 "[ . 1 . ]" 1
347 1 28 LYS HA 1 108 ALA MB . . 7.500 6.272 5.833 6.379 . 0 0 "[ . 1 . ]" 1
348 1 28 LYS HA 1 110 SER HA . . 4.700 3.789 3.060 4.243 . 0 0 "[ . 1 . ]" 1
349 1 28 LYS HA 1 110 SER QB . . 7.500 4.217 3.061 5.068 . 0 0 "[ . 1 . ]" 1
350 1 28 LYS QB 1 29 LYS HA . . 6.400 4.055 3.640 4.698 . 0 0 "[ . 1 . ]" 1
351 1 28 LYS QB 1 29 LYS QB . . 6.900 3.988 3.352 4.725 . 0 0 "[ . 1 . ]" 1
352 1 28 LYS QB 1 31 PHE HB3 . . 7.500 6.108 5.594 6.785 . 0 0 "[ . 1 . ]" 1
353 1 28 LYS QB 1 32 GLN QB . . 8.500 5.028 4.389 5.642 . 0 0 "[ . 1 . ]" 1
354 1 28 LYS QB 1 32 GLN QG . . 8.500 4.472 3.738 5.118 . 0 0 "[ . 1 . ]" 1
355 1 28 LYS QB 1 108 ALA HA . . 7.500 5.643 4.670 6.728 . 0 0 "[ . 1 . ]" 1
356 1 28 LYS QG 1 110 SER HA . . 6.500 2.375 1.973 3.124 . 0 0 "[ . 1 . ]" 1
357 1 28 LYS QD 1 110 SER HA . . 7.500 3.876 2.505 4.499 . 0 0 "[ . 1 . ]" 1
358 1 28 LYS QE 1 110 SER HA . . 7.500 4.447 3.274 5.335 . 0 0 "[ . 1 . ]" 1
359 1 29 LYS HA 1 32 GLN QG . . 7.500 3.940 3.489 4.170 . 0 0 "[ . 1 . ]" 1
360 1 29 LYS HA 1 33 MET QB . . 6.800 4.860 4.615 5.192 . 0 0 "[ . 1 . ]" 1
361 1 29 LYS HA 1 33 MET HG3 . . 6.500 4.413 3.721 6.488 . 0 0 "[ . 1 . ]" 1
362 1 29 LYS HA 1 110 SER QB . . 7.500 6.158 4.941 6.793 . 0 0 "[ . 1 . ]" 1
363 1 29 LYS QB 1 30 PHE HA . . 5.900 4.043 3.733 4.454 . 0 0 "[ . 1 . ]" 1
364 1 29 LYS QB 1 33 MET HG3 . . 5.900 4.191 2.701 5.954 0.054 14 0 "[ . 1 . ]" 1
365 1 30 PHE HA 1 31 PHE HA . . 5.700 4.810 4.749 4.857 . 0 0 "[ . 1 . ]" 1
366 1 30 PHE HA 1 33 MET QB . . 7.100 2.701 2.424 3.039 . 0 0 "[ . 1 . ]" 1
367 1 30 PHE QB 1 31 PHE QD . . 9.500 3.052 2.570 3.866 . 0 0 "[ . 1 . ]" 1
368 1 30 PHE QB 1 31 PHE QE . . 9.500 4.745 4.167 5.780 . 0 0 "[ . 1 . ]" 1
369 1 30 PHE QB 1 33 MET QB . . 8.500 4.603 4.384 4.867 . 0 0 "[ . 1 . ]" 1
370 1 30 PHE QD 1 31 PHE HA . . 8.500 2.997 2.601 4.336 . 0 0 "[ . 1 . ]" 1
371 1 30 PHE QD 1 34 VAL MG1 . . 9.500 2.994 2.510 4.338 . 0 0 "[ . 1 . ]" 1
372 1 30 PHE QD 1 68 LEU MD1 . . 9.500 5.142 4.724 5.572 . 0 0 "[ . 1 . ]" 1
373 1 30 PHE QE 1 34 VAL MG1 . . 9.500 2.912 2.288 4.597 . 0 0 "[ . 1 . ]" 1
374 1 30 PHE QE 1 34 VAL MG2 . . 9.500 3.267 2.521 4.685 . 0 0 "[ . 1 . ]" 1
375 1 30 PHE QE 1 67 ILE MD . . 9.500 4.489 2.913 5.219 . 0 0 "[ . 1 . ]" 1
376 1 30 PHE QE 1 68 LEU MD1 . . 9.500 4.540 4.014 5.351 . 0 0 "[ . 1 . ]" 1
377 1 30 PHE HZ 1 34 VAL MG1 . . 7.500 4.378 3.784 5.331 . 0 0 "[ . 1 . ]" 1
378 1 30 PHE HZ 1 34 VAL MG2 . . 7.500 3.609 2.780 5.174 . 0 0 "[ . 1 . ]" 1
379 1 30 PHE HZ 1 68 LEU MD1 . . 7.500 5.802 4.620 6.952 . 0 0 "[ . 1 . ]" 1
380 1 30 PHE HZ 1 71 PHE HB2 . . 6.500 3.463 2.898 3.942 . 0 0 "[ . 1 . ]" 1
381 1 31 PHE HA 1 32 GLN HA . . 5.700 4.764 4.669 4.821 . 0 0 "[ . 1 . ]" 1
382 1 31 PHE HA 1 34 VAL HA . . 6.400 5.744 5.657 5.819 . 0 0 "[ . 1 . ]" 1
383 1 31 PHE HA 1 34 VAL MG1 . . 7.300 1.995 1.882 2.142 . 0 0 "[ . 1 . ]" 1
384 1 31 PHE HA 1 34 VAL MG2 . . 7.500 4.479 4.274 4.751 . 0 0 "[ . 1 . ]" 1
385 1 31 PHE HA 1 36 LEU MD1 . . 7.500 2.538 2.266 2.878 . 0 0 "[ . 1 . ]" 1
386 1 31 PHE HA 1 37 LYS QG . . 7.500 4.981 4.565 6.594 . 0 0 "[ . 1 . ]" 1
387 1 31 PHE HB2 1 107 VAL MG1 . . 7.500 2.377 2.090 2.642 . 0 0 "[ . 1 . ]" 1
388 1 31 PHE HB3 1 34 VAL HB . . 6.500 6.586 6.426 6.722 0.222 5 0 "[ . 1 . ]" 1
389 1 31 PHE HB3 1 34 VAL MG1 . . 7.500 4.011 3.856 4.227 . 0 0 "[ . 1 . ]" 1
390 1 31 PHE HB3 1 34 VAL MG2 . . 7.500 6.557 6.291 6.879 . 0 0 "[ . 1 . ]" 1
391 1 31 PHE HB3 1 36 LEU HG . . 5.400 5.774 5.383 6.149 0.749 5 6 "[ + -*** . *]" 1
392 1 31 PHE HB3 1 36 LEU MD1 . . 7.200 4.066 3.669 4.530 . 0 0 "[ . 1 . ]" 1
393 1 31 PHE HB3 1 37 LYS QG . . 7.500 2.782 2.222 4.866 . 0 0 "[ . 1 . ]" 1
394 1 31 PHE HB3 1 107 VAL MG1 . . 7.500 3.445 3.134 3.804 . 0 0 "[ . 1 . ]" 1
395 1 31 PHE HB3 1 110 SER QB . . 7.500 7.118 6.615 7.555 0.055 4 0 "[ . 1 . ]" 1
396 1 31 PHE QD 1 36 LEU QB . . 9.500 2.342 2.188 2.730 . 0 0 "[ . 1 . ]" 1
397 1 31 PHE QD 1 103 PHE QB . . 9.500 5.864 5.038 6.295 . 0 0 "[ . 1 . ]" 1
398 1 31 PHE QD 1 107 VAL HA . . 8.500 5.464 5.190 5.653 . 0 0 "[ . 1 . ]" 1
399 1 31 PHE QD 1 110 SER QB . . 9.500 7.475 7.288 7.598 . 0 0 "[ . 1 . ]" 1
400 1 31 PHE QE 1 67 ILE MD . . 9.500 4.960 4.156 5.681 . 0 0 "[ . 1 . ]" 1
401 1 32 GLN HA 1 34 VAL MG1 . . 7.500 4.481 4.218 4.879 . 0 0 "[ . 1 . ]" 1
402 1 32 GLN HA 1 37 LYS QB . . 6.500 3.775 3.320 5.369 . 0 0 "[ . 1 . ]" 1
403 1 32 GLN HA 1 37 LYS QG . . 7.500 4.837 3.383 5.545 . 0 0 "[ . 1 . ]" 1
404 1 32 GLN HA 1 37 LYS QD . . 7.500 5.421 3.786 5.849 . 0 0 "[ . 1 . ]" 1
405 1 32 GLN QB 1 33 MET HA . . 6.900 4.013 3.896 4.128 . 0 0 "[ . 1 . ]" 1
406 1 32 GLN QB 1 33 MET HG2 . . 7.500 4.341 3.310 5.652 . 0 0 "[ . 1 . ]" 1
407 1 32 GLN QB 1 33 MET HG3 . . 7.500 4.067 3.100 5.306 . 0 0 "[ . 1 . ]" 1
408 1 32 GLN QB 1 37 LYS QB . . 7.500 5.272 4.951 6.433 . 0 0 "[ . 1 . ]" 1
409 1 32 GLN QB 1 37 LYS QG . . 8.500 5.922 4.809 6.451 . 0 0 "[ . 1 . ]" 1
410 1 32 GLN QG 1 37 LYS QB . . 7.500 3.857 3.527 4.722 . 0 0 "[ . 1 . ]" 1
411 1 32 GLN QG 1 108 ALA MB . . 8.500 5.830 5.172 6.300 . 0 0 "[ . 1 . ]" 1
412 1 33 MET HA 1 33 MET HG2 . . 3.800 2.674 2.300 3.616 . 0 0 "[ . 1 . ]" 1
413 1 33 MET HA 1 33 MET HG3 . . 3.900 3.094 2.131 3.767 . 0 0 "[ . 1 . ]" 1
414 1 33 MET HA 1 34 VAL HA . . 6.400 4.820 4.749 4.873 . 0 0 "[ . 1 . ]" 1
415 1 33 MET QB 1 34 VAL HA . . 7.500 4.040 3.790 4.226 . 0 0 "[ . 1 . ]" 1
416 1 33 MET QB 1 34 VAL HB . . 7.500 3.908 3.646 4.057 . 0 0 "[ . 1 . ]" 1
417 1 33 MET QB 1 34 VAL MG2 . . 8.500 4.835 4.462 4.982 . 0 0 "[ . 1 . ]" 1
418 1 34 VAL HA 1 34 VAL MG2 . . 3.400 2.222 2.157 2.264 . 0 0 "[ . 1 . ]" 1
419 1 34 VAL HB 1 36 LEU HG . . 5.900 4.730 4.392 5.378 . 0 0 "[ . 1 . ]" 1
420 1 34 VAL HB 1 71 PHE QE . . 8.500 5.648 3.698 6.802 . 0 0 "[ . 1 . ]" 1
421 1 34 VAL MG1 1 36 LEU QB . . 8.500 2.210 1.988 2.385 . 0 0 "[ . 1 . ]" 1
422 1 34 VAL MG2 1 35 GLY QA . . 7.500 4.544 4.411 4.659 . 0 0 "[ . 1 . ]" 1
423 1 34 VAL MG2 1 36 LEU HG . . 7.500 3.043 2.395 3.862 . 0 0 "[ . 1 . ]" 1
424 1 34 VAL MG2 1 36 LEU MD1 . . 8.500 3.164 2.735 3.598 . 0 0 "[ . 1 . ]" 1
425 1 35 GLY QA 1 36 LEU HA . . 4.300 4.242 4.174 4.329 0.029 15 0 "[ . 1 . ]" 1
426 1 35 GLY QA 1 37 LYS QB . . 5.300 4.523 4.029 5.637 0.337 2 0 "[ . 1 . ]" 1
427 1 35 GLY QA 1 38 LYS QG . . 7.500 3.017 2.562 3.508 . 0 0 "[ . 1 . ]" 1
428 1 35 GLY QA 1 38 LYS QD . . 7.500 2.300 1.977 4.298 . 0 0 "[ . 1 . ]" 1
429 1 35 GLY QA 1 38 LYS QE . . 7.500 2.993 1.916 4.192 . 0 0 "[ . 1 . ]" 1
430 1 35 GLY QA 1 36 LEU HG . . 6.500 5.300 5.058 5.675 . 0 0 "[ . 1 . ]" 1
431 1 35 GLY QA 1 38 LYS HA . . 5.300 5.060 4.820 5.411 0.111 7 0 "[ . 1 . ]" 1
432 1 35 GLY QA 1 38 LYS HB2 . . 5.800 3.927 2.843 4.481 . 0 0 "[ . 1 . ]" 1
433 1 35 GLY QA 1 38 LYS HB3 . . 4.800 2.944 2.362 4.584 . 0 0 "[ . 1 . ]" 1
434 1 36 LEU HA 1 36 LEU HG . . 3.800 2.471 2.182 2.728 . 0 0 "[ . 1 . ]" 1
435 1 36 LEU HA 1 36 LEU MD1 . . 3.800 3.792 3.673 3.840 0.040 19 0 "[ . 1 . ]" 1
436 1 36 LEU HA 1 37 LYS HA . . 6.300 4.928 4.711 4.997 . 0 0 "[ . 1 . ]" 1
437 1 36 LEU HA 1 38 LYS QG . . 7.500 5.073 4.727 5.903 . 0 0 "[ . 1 . ]" 1
438 1 36 LEU HA 1 39 LYS HB2 . . 5.000 2.983 2.529 3.588 . 0 0 "[ . 1 . ]" 1
439 1 36 LEU HA 1 39 LYS HB3 . . 5.700 4.262 3.423 4.866 . 0 0 "[ . 1 . ]" 1
440 1 36 LEU HA 1 39 LYS QG . . 7.500 3.516 2.276 4.782 . 0 0 "[ . 1 . ]" 1
441 1 36 LEU HA 1 39 LYS QD . . 7.500 4.412 3.716 5.082 . 0 0 "[ . 1 . ]" 1
442 1 36 LEU HA 1 44 VAL QG . . 8.900 3.990 3.386 4.431 . 0 0 "[ . 1 . ]" 1
443 1 36 LEU HA 1 47 VAL QG . . 7.500 3.880 3.381 4.117 . 0 0 "[ . 1 . ]" 1
444 1 36 LEU QB 1 37 LYS HA . . 7.500 3.942 3.809 4.055 . 0 0 "[ . 1 . ]" 1
445 1 36 LEU QB 1 37 LYS QG . . 8.500 3.767 3.292 5.102 . 0 0 "[ . 1 . ]" 1
446 1 36 LEU QB 1 44 VAL QG . . 9.900 3.231 2.580 3.851 . 0 0 "[ . 1 . ]" 1
447 1 36 LEU QB 1 107 VAL MG1 . . 8.500 4.795 4.460 5.097 . 0 0 "[ . 1 . ]" 1
448 1 36 LEU HG 1 47 VAL QG . . 7.500 3.144 2.216 3.546 . 0 0 "[ . 1 . ]" 1
449 1 36 LEU HG 1 71 PHE QE . . 8.500 4.204 3.307 5.063 . 0 0 "[ . 1 . ]" 1
450 1 36 LEU MD1 1 39 LYS HB2 . . 7.500 5.930 5.682 6.199 . 0 0 "[ . 1 . ]" 1
451 1 36 LEU MD1 1 39 LYS HB3 . . 7.500 6.745 5.970 7.405 . 0 0 "[ . 1 . ]" 1
452 1 36 LEU MD1 1 39 LYS QG . . 8.500 5.889 4.991 6.851 . 0 0 "[ . 1 . ]" 1
453 1 36 LEU MD1 1 39 LYS QD . . 8.500 6.687 6.070 7.282 . 0 0 "[ . 1 . ]" 1
454 1 36 LEU MD1 1 44 VAL QG . . 9.900 3.651 3.354 3.914 . 0 0 "[ . 1 . ]" 1
455 1 36 LEU MD1 1 47 VAL HB . . 7.500 4.209 3.739 4.543 . 0 0 "[ . 1 . ]" 1
456 1 36 LEU MD1 1 47 VAL QG . . 8.500 2.137 1.911 2.358 . 0 0 "[ . 1 . ]" 1
457 1 36 LEU MD1 1 51 LEU MD1 . . 8.500 4.507 3.760 5.393 . 0 0 "[ . 1 . ]" 1
458 1 36 LEU MD1 1 107 VAL MG1 . . 8.500 4.489 4.266 4.692 . 0 0 "[ . 1 . ]" 1
459 1 37 LYS HA 1 38 LYS HA . . 6.500 4.720 4.679 4.781 . 0 0 "[ . 1 . ]" 1
460 1 37 LYS HA 1 105 THR MG . . 7.500 6.272 6.044 6.352 . 0 0 "[ . 1 . ]" 1
461 1 37 LYS HA 1 107 VAL MG1 . . 7.500 6.682 6.099 7.100 . 0 0 "[ . 1 . ]" 1
462 1 37 LYS HA 1 108 ALA MB . . 7.000 5.456 5.139 5.862 . 0 0 "[ . 1 . ]" 1
463 1 37 LYS QB 1 38 LYS HB3 . . 5.700 4.508 4.021 5.612 . 0 0 "[ . 1 . ]" 1
464 1 37 LYS QB 1 38 LYS HA . . 5.700 4.224 3.978 4.947 . 0 0 "[ . 1 . ]" 1
465 1 37 LYS QB 1 38 LYS QG . . 7.200 5.236 3.086 6.327 . 0 0 "[ . 1 . ]" 1
466 1 37 LYS QB 1 108 ALA MB . . 7.500 4.353 3.545 4.802 . 0 0 "[ . 1 . ]" 1
467 1 37 LYS QG 1 105 THR MG . . 8.500 5.123 4.653 6.353 . 0 0 "[ . 1 . ]" 1
468 1 37 LYS QG 1 107 VAL MG1 . . 8.500 4.482 3.903 5.982 . 0 0 "[ . 1 . ]" 1
469 1 37 LYS QG 1 108 ALA MB . . 5.900 3.448 2.941 4.381 . 0 0 "[ . 1 . ]" 1
470 1 37 LYS QD 1 105 THR MG . . 8.500 5.107 4.590 5.780 . 0 0 "[ . 1 . ]" 1
471 1 38 LYS HA 1 39 LYS HA . . 4.800 4.725 4.641 4.782 . 0 0 "[ . 1 . ]" 1
472 1 38 LYS HB2 1 38 LYS QE . . 4.300 3.832 2.335 4.244 . 0 0 "[ . 1 . ]" 1
473 1 38 LYS HB2 1 39 LYS HA . . 5.900 5.492 4.582 5.848 . 0 0 "[ . 1 . ]" 1
474 1 38 LYS HB2 1 39 LYS QD . . 7.500 5.506 3.348 7.134 . 0 0 "[ . 1 . ]" 1
475 1 38 LYS HB3 1 39 LYS HB2 . . 5.500 5.847 5.076 6.492 0.992 9 8 "[*- . +* *. ***]" 1
476 1 38 LYS QG 1 39 LYS HB2 . . 7.500 4.545 3.308 6.500 . 0 0 "[ . 1 . ]" 1
477 1 38 LYS QG 1 39 LYS QG . . 8.500 3.900 2.519 6.796 . 0 0 "[ . 1 . ]" 1
478 1 38 LYS QG 1 39 LYS QD . . 8.500 3.501 2.234 5.906 . 0 0 "[ . 1 . ]" 1
479 1 38 LYS QD 1 39 LYS QD . . 8.500 4.776 3.620 6.114 . 0 0 "[ . 1 . ]" 1
480 1 38 LYS QE 1 39 LYS HB3 . . 7.500 6.529 5.395 8.220 0.720 8 1 "[ . + 1 . ]" 1
481 1 39 LYS HA 1 39 LYS QD . . 4.800 2.710 2.175 3.730 . 0 0 "[ . 1 . ]" 1
482 1 39 LYS HA 1 40 SER QB . . 7.500 4.359 4.015 4.694 . 0 0 "[ . 1 . ]" 1
483 1 39 LYS HA 1 43 ASP QB . . 5.200 4.217 3.934 4.539 . 0 0 "[ . 1 . ]" 1
484 1 39 LYS HB2 1 43 ASP QB . . 6.300 3.335 2.517 4.018 . 0 0 "[ . 1 . ]" 1
485 1 39 LYS HB2 1 44 VAL HA . . 6.500 5.699 4.765 6.528 0.028 16 0 "[ . 1 . ]" 1
486 1 39 LYS HB2 1 44 VAL QG . . 8.900 3.990 2.927 4.818 . 0 0 "[ . 1 . ]" 1
487 1 39 LYS HB3 1 40 SER HA . . 5.300 4.842 4.696 5.022 . 0 0 "[ . 1 . ]" 1
488 1 39 LYS HB3 1 43 ASP HA . . 5.300 5.216 4.803 5.689 0.389 9 0 "[ . 1 . ]" 1
489 1 39 LYS HB3 1 43 ASP QB . . 6.400 2.428 2.172 2.904 . 0 0 "[ . 1 . ]" 1
490 1 39 LYS HB3 1 44 VAL QG . . 8.900 4.238 2.850 5.694 . 0 0 "[ . 1 . ]" 1
491 1 39 LYS QG 1 43 ASP HA . . 7.500 5.609 4.528 6.741 . 0 0 "[ . 1 . ]" 1
492 1 39 LYS QG 1 43 ASP QB . . 7.500 3.332 2.331 4.233 . 0 0 "[ . 1 . ]" 1
493 1 39 LYS QG 1 44 VAL HA . . 7.500 6.086 5.428 6.703 . 0 0 "[ . 1 . ]" 1
494 1 39 LYS QG 1 44 VAL QG . . 9.900 4.788 4.001 5.585 . 0 0 "[ . 1 . ]" 1
495 1 39 LYS QG 1 47 VAL QG . . 8.500 4.221 3.664 4.701 . 0 0 "[ . 1 . ]" 1
496 1 39 LYS QD 1 43 ASP QB . . 7.500 4.334 3.696 4.887 . 0 0 "[ . 1 . ]" 1
497 1 40 SER HA 1 43 ASP QB . . 5.000 4.277 3.996 4.623 . 0 0 "[ . 1 . ]" 1
498 1 40 SER HA 1 44 VAL QG . . 8.900 5.094 4.305 5.624 . 0 0 "[ . 1 . ]" 1
499 1 41 ALA HA 1 42 ASP HA . . 5.000 4.809 4.660 4.895 . 0 0 "[ . 1 . ]" 1
500 1 41 ALA HA 1 44 VAL HB . . 5.300 2.479 2.178 3.157 . 0 0 "[ . 1 . ]" 1
501 1 41 ALA HA 1 44 VAL QG . . 8.900 2.892 2.383 3.152 . 0 0 "[ . 1 . ]" 1
502 1 41 ALA HA 1 45 LYS QG . . 6.500 6.009 4.813 6.637 0.137 19 0 "[ . 1 . ]" 1
503 1 41 ALA MB 1 42 ASP HA . . 4.600 3.873 3.851 3.893 . 0 0 "[ . 1 . ]" 1
504 1 41 ALA MB 1 42 ASP QB . . 8.500 3.991 3.650 4.511 . 0 0 "[ . 1 . ]" 1
505 1 41 ALA MB 1 44 VAL HB . . 7.500 4.044 3.812 4.646 . 0 0 "[ . 1 . ]" 1
506 1 41 ALA MB 1 45 LYS QB . . 7.500 4.802 4.084 5.648 . 0 0 "[ . 1 . ]" 1
507 1 41 ALA MB 1 45 LYS QG . . 7.500 5.162 4.289 5.863 . 0 0 "[ . 1 . ]" 1
508 1 41 ALA MB 1 45 LYS QE . . 8.500 5.029 3.853 6.204 . 0 0 "[ . 1 . ]" 1
509 1 42 ASP HA 1 43 ASP HA . . 5.700 4.825 4.615 4.938 . 0 0 "[ . 1 . ]" 1
510 1 42 ASP HA 1 45 LYS QB . . 5.500 2.494 2.154 2.961 . 0 0 "[ . 1 . ]" 1
511 1 42 ASP HA 1 45 LYS QG . . 6.500 3.751 3.036 4.502 . 0 0 "[ . 1 . ]" 1
512 1 42 ASP HA 1 46 LYS QD . . 7.500 4.578 3.723 6.183 . 0 0 "[ . 1 . ]" 1
513 1 42 ASP QB 1 43 ASP HA . . 7.500 4.246 3.978 4.626 . 0 0 "[ . 1 . ]" 1
514 1 42 ASP QB 1 43 ASP QB . . 6.700 4.226 3.808 4.712 . 0 0 "[ . 1 . ]" 1
515 1 43 ASP HA 1 44 VAL HA . . 6.500 4.930 4.795 5.022 . 0 0 "[ . 1 . ]" 1
516 1 43 ASP HA 1 46 LYS QB . . 5.600 3.009 2.483 3.579 . 0 0 "[ . 1 . ]" 1
517 1 43 ASP HA 1 46 LYS QD . . 7.500 2.931 2.144 4.127 . 0 0 "[ . 1 . ]" 1
518 1 43 ASP HA 1 46 LYS QE . . 7.500 4.720 3.653 6.011 . 0 0 "[ . 1 . ]" 1
519 1 43 ASP QB 1 44 VAL HB . . 6.100 4.175 3.879 4.862 . 0 0 "[ . 1 . ]" 1
520 1 43 ASP QB 1 44 VAL QG . . 8.900 3.523 2.955 4.203 . 0 0 "[ . 1 . ]" 1
521 1 43 ASP QB 1 46 LYS QD . . 7.100 4.752 4.003 5.795 . 0 0 "[ . 1 . ]" 1
522 1 43 ASP QB 1 44 VAL HA . . 5.200 4.040 3.857 4.198 . 0 0 "[ . 1 . ]" 1
523 1 43 ASP QB 1 46 LYS QB . . 5.900 4.747 4.462 5.116 . 0 0 "[ . 1 . ]" 1
524 1 43 ASP QB 1 47 VAL QG . . 7.500 3.505 3.225 3.949 . 0 0 "[ . 1 . ]" 1
525 1 44 VAL HA 1 45 LYS HA . . 6.400 4.890 4.811 5.037 . 0 0 "[ . 1 . ]" 1
526 1 44 VAL HA 1 46 LYS QB . . 6.500 5.293 4.891 5.618 . 0 0 "[ . 1 . ]" 1
527 1 44 VAL HA 1 47 VAL HB . . 5.200 2.189 2.052 2.396 . 0 0 "[ . 1 . ]" 1
528 1 44 VAL HA 1 47 VAL QG . . 7.500 2.257 1.983 2.791 . 0 0 "[ . 1 . ]" 1
529 1 44 VAL HB 1 45 LYS HA . . 6.300 5.256 4.435 5.953 . 0 0 "[ . 1 . ]" 1
530 1 44 VAL HB 1 45 LYS QB . . 6.500 4.865 4.313 5.878 . 0 0 "[ . 1 . ]" 1
531 1 44 VAL QG 1 47 VAL HB . . 8.900 3.170 2.727 3.565 . 0 0 "[ . 1 . ]" 1
532 1 44 VAL QG 1 105 THR HA . . 8.900 5.731 5.281 6.056 . 0 0 "[ . 1 . ]" 1
533 1 44 VAL QG 1 105 THR MG . . 9.100 4.429 3.865 4.802 . 0 0 "[ . 1 . ]" 1
534 1 44 VAL QG 1 106 LEU MD1 . . 9.900 7.265 6.616 7.841 . 0 0 "[ . 1 . ]" 1
535 1 44 VAL QG 1 107 VAL MG1 . . 9.900 5.446 4.854 6.077 . 0 0 "[ . 1 . ]" 1
536 1 44 VAL QG 1 107 VAL MG2 . . 9.900 4.443 3.957 4.874 . 0 0 "[ . 1 . ]" 1
537 1 45 LYS HA 1 45 LYS QG . . 3.700 2.430 2.052 3.420 . 0 0 "[ . 1 . ]" 1
538 1 45 LYS HA 1 46 LYS HA . . 5.700 4.744 4.683 4.800 . 0 0 "[ . 1 . ]" 1
539 1 45 LYS QB 1 46 LYS QG . . 5.800 4.195 3.020 5.396 . 0 0 "[ . 1 . ]" 1
540 1 45 LYS QB 1 100 VAL MG1 . . 7.500 4.198 3.057 4.928 . 0 0 "[ . 1 . ]" 1
541 1 45 LYS QB 1 46 LYS QB . . 4.900 4.413 4.077 4.919 0.019 17 0 "[ . 1 . ]" 1
542 1 46 LYS HA 1 46 LYS QG . . 3.700 2.424 2.167 3.288 . 0 0 "[ . 1 . ]" 1
543 1 46 LYS HA 1 48 PHE QB . . 6.200 5.079 4.790 5.265 . 0 0 "[ . 1 . ]" 1
544 1 46 LYS QB 1 47 VAL HA . . 4.900 4.161 3.969 4.516 . 0 0 "[ . 1 . ]" 1
545 1 46 LYS QB 1 47 VAL HB . . 6.000 5.085 4.921 5.445 . 0 0 "[ . 1 . ]" 1
546 1 46 LYS QB 1 47 VAL QG . . 7.500 3.504 3.225 3.951 . 0 0 "[ . 1 . ]" 1
547 1 47 VAL HA 1 48 PHE QB . . 7.500 5.158 5.103 5.224 . 0 0 "[ . 1 . ]" 1
548 1 47 VAL HB 1 48 PHE QB . . 7.500 3.930 3.791 4.121 . 0 0 "[ . 1 . ]" 1
549 1 47 VAL QG 1 51 LEU MD1 . . 8.000 3.063 2.081 4.046 . 0 0 "[ . 1 . ]" 1
550 1 47 VAL QG 1 48 PHE HA . . 7.500 3.400 3.194 3.765 . 0 0 "[ . 1 . ]" 1
551 1 47 VAL QG 1 48 PHE QB . . 8.500 3.799 3.606 4.127 . 0 0 "[ . 1 . ]" 1
552 1 47 VAL QG 1 51 LEU HB2 . . 7.500 5.199 4.513 5.870 . 0 0 "[ . 1 . ]" 1
553 1 47 VAL QG 1 51 LEU HG . . 7.500 4.351 3.358 5.101 . 0 0 "[ . 1 . ]" 1
554 1 47 VAL QG 1 107 VAL MG1 . . 8.500 5.973 5.523 6.352 . 0 0 "[ . 1 . ]" 1
555 1 47 VAL QG 1 107 VAL MG2 . . 8.500 5.786 5.469 6.380 . 0 0 "[ . 1 . ]" 1
556 1 48 PHE H 1 98 ILE MG . . 7.500 6.377 6.325 6.427 . 0 0 "[ . 1 . ]" 1
557 1 48 PHE HA 1 59 ILE MD . . 7.500 3.485 2.853 5.438 . 0 0 "[ . 1 . ]" 1
558 1 48 PHE QB 1 100 VAL MG1 . . 8.500 3.606 3.351 4.320 . 0 0 "[ . 1 . ]" 1
559 1 48 PHE QB 1 101 ASP HB3 . . 7.500 7.773 7.459 8.155 0.655 3 4 "[ + ** 1 . - ]" 1
560 1 48 PHE QD 1 52 ASP HA . . 8.500 6.096 5.458 6.523 . 0 0 "[ . 1 . ]" 1
561 1 48 PHE QD 1 52 ASP QB . . 9.500 4.024 3.559 4.671 . 0 0 "[ . 1 . ]" 1
562 1 48 PHE QD 1 59 ILE QG . . 9.500 3.818 3.478 5.187 . 0 0 "[ . 1 . ]" 1
563 1 48 PHE QD 1 59 ILE MD . . 9.500 2.604 2.134 4.678 . 0 0 "[ . 1 . ]" 1
564 1 48 PHE QD 1 98 ILE MG . . 9.500 2.785 2.582 3.149 . 0 0 "[ . 1 . ]" 1
565 1 48 PHE QD 1 98 ILE MD . . 9.500 5.256 4.865 5.617 . 0 0 "[ . 1 . ]" 1
566 1 48 PHE QD 1 99 GLY QA . . 8.500 4.108 3.453 4.457 . 0 0 "[ . 1 . ]" 1
567 1 48 PHE QD 1 100 VAL HA . . 8.500 3.316 2.922 3.721 . 0 0 "[ . 1 . ]" 1
568 1 48 PHE QD 1 100 VAL HB . . 8.500 2.663 2.275 3.076 . 0 0 "[ . 1 . ]" 1
569 1 48 PHE QD 1 100 VAL MG1 . . 9.500 3.484 3.013 3.922 . 0 0 "[ . 1 . ]" 1
570 1 48 PHE QD 1 103 PHE HA . . 8.500 6.540 5.793 7.590 . 0 0 "[ . 1 . ]" 1
571 1 48 PHE QD 1 103 PHE QB . . 9.500 3.801 3.110 5.155 . 0 0 "[ . 1 . ]" 1
572 1 48 PHE QE 1 52 ASP QB . . 9.500 3.553 2.816 4.304 . 0 0 "[ . 1 . ]" 1
573 1 48 PHE QE 1 57 GLY HA2 . . 8.500 2.510 2.170 3.220 . 0 0 "[ . 1 . ]" 1
574 1 48 PHE QE 1 57 GLY HA3 . . 8.500 3.693 2.931 4.300 . 0 0 "[ . 1 . ]" 1
575 1 48 PHE QE 1 58 PHE HA . . 8.500 3.483 3.057 3.626 . 0 0 "[ . 1 . ]" 1
576 1 48 PHE QE 1 59 ILE QG . . 9.500 2.456 2.211 4.128 . 0 0 "[ . 1 . ]" 1
577 1 48 PHE QE 1 98 ILE MG . . 9.500 2.495 2.144 3.474 . 0 0 "[ . 1 . ]" 1
578 1 48 PHE QE 1 99 GLY QA . . 8.500 3.080 2.500 3.331 . 0 0 "[ . 1 . ]" 1
579 1 48 PHE QE 1 100 VAL HA . . 8.500 4.555 4.093 4.892 . 0 0 "[ . 1 . ]" 1
580 1 48 PHE QE 1 100 VAL HB . . 8.500 3.960 3.370 4.298 . 0 0 "[ . 1 . ]" 1
581 1 48 PHE QE 1 100 VAL MG1 . . 9.500 4.052 3.600 4.636 . 0 0 "[ . 1 . ]" 1
582 1 48 PHE HZ 1 58 PHE HA . . 6.500 2.392 2.058 3.561 . 0 0 "[ . 1 . ]" 1
583 1 48 PHE HZ 1 100 VAL HA . . 6.500 5.782 5.039 6.515 0.015 16 0 "[ . 1 . ]" 1
584 1 48 PHE HZ 1 100 VAL MG1 . . 7.500 5.210 4.764 5.700 . 0 0 "[ . 1 . ]" 1
585 1 51 LEU HA 1 51 LEU HG . . 3.900 3.224 2.560 3.742 . 0 0 "[ . 1 . ]" 1
586 1 51 LEU HA 1 51 LEU MD1 . . 3.400 3.202 2.129 4.206 0.806 14 4 "[ - *. * 1 +. ]" 1
587 1 51 LEU HA 1 52 ASP HA . . 6.500 4.841 4.649 4.956 . 0 0 "[ . 1 . ]" 1
588 1 51 LEU HA 1 53 LYS HA . . 6.500 5.620 5.146 6.157 . 0 0 "[ . 1 . ]" 1
589 1 51 LEU HA 1 53 LYS HG2 . . 6.500 4.546 3.270 6.487 . 0 0 "[ . 1 . ]" 1
590 1 51 LEU HA 1 53 LYS QD . . 7.500 4.913 3.405 6.693 . 0 0 "[ . 1 . ]" 1
591 1 51 LEU HA 1 59 ILE MG . . 7.500 5.305 4.586 6.251 . 0 0 "[ . 1 . ]" 1
592 1 51 LEU HA 1 59 ILE MD . . 7.500 4.222 3.451 4.571 . 0 0 "[ . 1 . ]" 1
593 1 51 LEU HA 1 63 GLU QB . . 6.500 4.988 4.471 5.961 . 0 0 "[ . 1 . ]" 1
594 1 51 LEU HA 1 67 ILE HA . . 3.700 3.725 3.448 3.825 0.125 12 0 "[ . 1 . ]" 1
595 1 51 LEU HA 1 67 ILE MG . . 7.500 5.494 4.608 5.933 . 0 0 "[ . 1 . ]" 1
596 1 51 LEU HA 1 67 ILE QG . . 6.500 3.985 3.039 5.981 . 0 0 "[ . 1 . ]" 1
597 1 51 LEU HA 1 67 ILE MD . . 7.500 4.270 3.805 4.625 . 0 0 "[ . 1 . ]" 1
598 1 51 LEU HA 1 70 GLY HA3 . . 3.300 2.844 2.253 3.503 0.203 4 0 "[ . 1 . ]" 1
599 1 51 LEU HB2 1 51 LEU HG . . 2.800 2.725 2.364 3.060 0.260 3 0 "[ . 1 . ]" 1
600 1 51 LEU HB2 1 52 ASP HA . . 4.500 4.372 4.028 4.628 0.128 9 0 "[ . 1 . ]" 1
601 1 51 LEU HB2 1 52 ASP QB . . 6.500 3.964 3.378 4.834 . 0 0 "[ . 1 . ]" 1
602 1 51 LEU HB2 1 59 ILE HA . . 6.500 6.080 5.376 6.854 0.354 3 0 "[ . 1 . ]" 1
603 1 51 LEU HB2 1 59 ILE MG . . 7.300 4.351 3.588 5.035 . 0 0 "[ . 1 . ]" 1
604 1 51 LEU HB2 1 59 ILE QG . . 7.500 3.206 2.394 3.867 . 0 0 "[ . 1 . ]" 1
605 1 51 LEU HB2 1 59 ILE MD . . 7.200 2.119 2.014 2.285 . 0 0 "[ . 1 . ]" 1
606 1 51 LEU HB2 1 63 GLU QB . . 6.500 5.463 4.617 6.535 0.035 15 0 "[ . 1 . ]" 1
607 1 51 LEU HB2 1 67 ILE QG . . 6.500 4.147 2.132 6.285 . 0 0 "[ . 1 . ]" 1
608 1 51 LEU HB2 1 67 ILE MD . . 7.500 4.346 2.904 4.919 . 0 0 "[ . 1 . ]" 1
609 1 51 LEU HB3 1 51 LEU MD1 . . 3.600 2.805 2.281 3.252 . 0 0 "[ . 1 . ]" 1
610 1 51 LEU HB3 1 52 ASP HA . . 6.500 4.702 4.065 5.793 . 0 0 "[ . 1 . ]" 1
611 1 51 LEU HB3 1 59 ILE QG . . 7.500 3.374 2.655 5.247 . 0 0 "[ . 1 . ]" 1
612 1 51 LEU HB3 1 59 ILE MD . . 7.500 2.432 2.032 3.470 . 0 0 "[ . 1 . ]" 1
613 1 51 LEU HB3 1 63 GLU QB . . 5.900 4.636 3.985 6.214 0.314 8 0 "[ . 1 . ]" 1
614 1 51 LEU HB3 1 67 ILE QG . . 6.500 2.866 2.102 5.046 . 0 0 "[ . 1 . ]" 1
615 1 51 LEU HG 1 59 ILE MD . . 7.500 3.550 2.684 3.998 . 0 0 "[ . 1 . ]" 1
616 1 51 LEU HG 1 67 ILE QG . . 6.300 3.670 2.170 6.136 . 0 0 "[ . 1 . ]" 1
617 1 51 LEU HG 1 67 ILE MD . . 7.500 3.106 2.077 4.390 . 0 0 "[ . 1 . ]" 1
618 1 51 LEU HG 1 71 PHE QE . . 8.500 3.916 2.512 5.315 . 0 0 "[ . 1 . ]" 1
619 1 51 LEU MD1 1 59 ILE QG . . 8.500 4.480 3.434 5.452 . 0 0 "[ . 1 . ]" 1
620 1 51 LEU MD1 1 59 ILE MD . . 8.500 3.059 1.960 4.135 . 0 0 "[ . 1 . ]" 1
621 1 51 LEU MD1 1 67 ILE HA . . 7.500 4.728 3.536 5.603 . 0 0 "[ . 1 . ]" 1
622 1 51 LEU MD1 1 67 ILE HB . . 7.500 4.684 2.710 6.057 . 0 0 "[ . 1 . ]" 1
623 1 51 LEU MD1 1 67 ILE QG . . 7.500 3.351 2.335 5.333 . 0 0 "[ . 1 . ]" 1
624 1 51 LEU MD1 1 70 GLY HA2 . . 7.500 5.479 3.711 7.509 0.009 8 0 "[ . 1 . ]" 1
625 1 51 LEU MD1 1 70 GLY HA3 . . 7.400 4.059 2.294 6.066 . 0 0 "[ . 1 . ]" 1
626 1 51 LEU MD1 1 71 PHE HA . . 7.500 4.916 3.396 7.393 . 0 0 "[ . 1 . ]" 1
627 1 52 ASP HA 1 53 LYS HA . . 5.800 4.576 4.412 4.700 . 0 0 "[ . 1 . ]" 1
628 1 52 ASP HA 1 53 LYS QB . . 5.500 4.402 3.932 4.784 . 0 0 "[ . 1 . ]" 1
629 1 52 ASP HA 1 59 ILE MG . . 7.500 4.212 3.448 5.063 . 0 0 "[ . 1 . ]" 1
630 1 52 ASP HA 1 59 ILE QG . . 7.500 2.752 2.212 3.461 . 0 0 "[ . 1 . ]" 1
631 1 52 ASP HA 1 59 ILE MD . . 7.500 4.070 2.870 4.765 . 0 0 "[ . 1 . ]" 1
632 1 52 ASP HA 1 63 GLU QB . . 6.500 3.991 3.631 4.425 . 0 0 "[ . 1 . ]" 1
633 1 52 ASP HA 1 63 GLU QG . . 7.500 3.807 2.654 4.891 . 0 0 "[ . 1 . ]" 1
634 1 52 ASP QB 1 55 LYS HA . . 7.500 3.254 2.116 4.036 . 0 0 "[ . 1 . ]" 1
635 1 52 ASP QB 1 55 LYS QB . . 8.500 4.957 3.563 5.817 . 0 0 "[ . 1 . ]" 1
636 1 52 ASP QB 1 55 LYS QG . . 8.500 4.742 3.086 5.730 . 0 0 "[ . 1 . ]" 1
637 1 52 ASP QB 1 55 LYS QD . . 8.500 4.550 2.710 6.207 . 0 0 "[ . 1 . ]" 1
638 1 52 ASP QB 1 55 LYS QE . . 8.500 3.963 2.564 6.576 . 0 0 "[ . 1 . ]" 1
639 1 52 ASP QB 1 58 PHE QD . . 9.500 6.429 6.002 6.829 . 0 0 "[ . 1 . ]" 1
640 1 52 ASP QB 1 59 ILE HB . . 7.500 5.449 4.590 6.655 . 0 0 "[ . 1 . ]" 1
641 1 52 ASP QB 1 59 ILE MG . . 8.500 4.981 4.317 5.590 . 0 0 "[ . 1 . ]" 1
642 1 52 ASP QB 1 59 ILE MD . . 8.500 3.655 2.539 4.576 . 0 0 "[ . 1 . ]" 1
643 1 53 LYS HA 1 53 LYS HG2 . . 3.500 2.872 2.066 3.854 0.354 5 0 "[ . 1 . ]" 1
644 1 53 LYS HA 1 53 LYS HG3 . . 3.800 3.401 2.322 3.816 0.016 13 0 "[ . 1 . ]" 1
645 1 53 LYS HA 1 53 LYS QD . . 4.900 3.322 2.116 4.436 . 0 0 "[ . 1 . ]" 1
646 1 53 LYS HA 1 53 LYS QE . . 5.200 3.615 1.807 4.415 . 0 0 "[ . 1 . ]" 1
647 1 53 LYS HA 1 54 ASP HA . . 5.400 4.636 4.164 4.976 . 0 0 "[ . 1 . ]" 1
648 1 53 LYS HA 1 55 LYS QD . . 7.500 5.356 3.236 6.724 . 0 0 "[ . 1 . ]" 1
649 1 53 LYS HA 1 55 LYS QE . . 7.500 4.339 2.825 6.212 . 0 0 "[ . 1 . ]" 1
650 1 53 LYS HA 1 63 GLU QG . . 7.500 4.707 4.042 5.225 . 0 0 "[ . 1 . ]" 1
651 1 53 LYS QB 1 54 ASP HB2 . . 6.100 5.566 4.702 6.442 0.342 2 0 "[ . 1 . ]" 1
652 1 53 LYS QB 1 54 ASP HB3 . . 6.500 4.507 3.959 6.115 . 0 0 "[ . 1 . ]" 1
653 1 53 LYS QB 1 55 LYS QE . . 7.500 5.840 4.706 6.683 . 0 0 "[ . 1 . ]" 1
654 1 53 LYS QB 1 63 GLU HA . . 6.500 4.510 3.790 5.625 . 0 0 "[ . 1 . ]" 1
655 1 53 LYS QB 1 63 GLU QB . . 5.100 3.982 3.033 5.016 . 0 0 "[ . 1 . ]" 1
656 1 53 LYS QB 1 63 GLU QG . . 7.500 2.629 2.082 3.955 . 0 0 "[ . 1 . ]" 1
657 1 53 LYS HG2 1 63 GLU QB . . 5.500 4.796 3.417 5.639 0.139 12 0 "[ . 1 . ]" 1
658 1 53 LYS HG2 1 63 GLU QG . . 7.500 3.892 2.101 5.090 . 0 0 "[ . 1 . ]" 1
659 1 53 LYS HG3 1 54 ASP HA . . 6.500 6.226 3.617 7.463 0.963 3 7 "[ +*. **-1 * .* ]" 1
660 1 53 LYS QD 1 63 GLU HA . . 7.500 5.347 3.399 6.592 . 0 0 "[ . 1 . ]" 1
661 1 53 LYS QD 1 63 GLU QG . . 8.500 4.249 2.472 5.373 . 0 0 "[ . 1 . ]" 1
662 1 53 LYS QD 1 66 PHE QB . . 8.500 6.136 4.919 6.769 . 0 0 "[ . 1 . ]" 1
663 1 53 LYS QD 1 69 LYS QB . . 8.500 3.863 2.934 5.613 . 0 0 "[ . 1 . ]" 1
664 1 53 LYS QE 1 54 ASP HA . . 7.500 6.113 4.271 6.740 . 0 0 "[ . 1 . ]" 1
665 1 54 ASP HA 1 55 LYS HA . . 6.300 5.252 5.132 5.368 . 0 0 "[ . 1 . ]" 1
666 1 54 ASP HB2 1 56 SER QB . . 7.500 4.105 2.808 5.309 . 0 0 "[ . 1 . ]" 1
667 1 55 LYS HA 1 55 LYS QD . . 5.000 2.935 2.025 4.205 . 0 0 "[ . 1 . ]" 1
668 1 55 LYS HA 1 56 SER HA . . 5.100 4.623 4.226 4.901 . 0 0 "[ . 1 . ]" 1
669 1 55 LYS HA 1 57 GLY HA2 . . 5.100 4.962 4.462 5.606 0.506 17 1 "[ . 1 . + ]" 1
670 1 55 LYS QE 1 57 GLY HA2 . . 7.500 6.505 5.498 7.479 . 0 0 "[ . 1 . ]" 1
671 1 56 SER HA 1 57 GLY HA3 . . 5.900 4.591 4.445 4.734 . 0 0 "[ . 1 . ]" 1
672 1 57 GLY HA2 1 58 PHE QD . . 8.500 4.927 4.637 5.227 . 0 0 "[ . 1 . ]" 1
673 1 57 GLY HA3 1 58 PHE QD . . 8.500 4.017 3.470 4.491 . 0 0 "[ . 1 . ]" 1
674 1 58 PHE HA 1 59 ILE HB . . 6.500 4.710 4.356 5.088 . 0 0 "[ . 1 . ]" 1
675 1 58 PHE HA 1 59 ILE QG . . 7.500 4.046 3.592 5.017 . 0 0 "[ . 1 . ]" 1
676 1 58 PHE HA 1 99 GLY QA . . 3.800 3.578 3.249 3.831 0.031 2 0 "[ . 1 . ]" 1
677 1 58 PHE QB 1 60 GLU HA . . 6.400 5.340 4.965 5.632 . 0 0 "[ . 1 . ]" 1
678 1 58 PHE QB 1 60 GLU QB . . 7.500 4.575 3.820 5.299 . 0 0 "[ . 1 . ]" 1
679 1 58 PHE QB 1 60 GLU QG . . 7.000 4.170 2.696 5.694 . 0 0 "[ . 1 . ]" 1
680 1 58 PHE QB 1 97 LYS QB . . 6.500 2.152 1.978 2.260 . 0 0 "[ . 1 . ]" 1
681 1 58 PHE QB 1 97 LYS QG . . 7.500 2.352 2.063 3.586 . 0 0 "[ . 1 . ]" 1
682 1 58 PHE QB 1 97 LYS QD . . 6.500 3.236 2.000 3.992 . 0 0 "[ . 1 . ]" 1
683 1 58 PHE QB 1 97 LYS QE . . 7.500 2.613 1.929 4.572 . 0 0 "[ . 1 . ]" 1
684 1 58 PHE QB 1 59 ILE HA . . 6.500 4.308 3.964 4.568 . 0 0 "[ . 1 . ]" 1
685 1 58 PHE QD 1 97 LYS QB . . 8.500 2.840 2.233 3.712 . 0 0 "[ . 1 . ]" 1
686 1 58 PHE QD 1 97 LYS QD . . 8.500 4.293 3.304 4.840 . 0 0 "[ . 1 . ]" 1
687 1 58 PHE QD 1 97 LYS QE . . 9.500 3.494 2.579 5.377 . 0 0 "[ . 1 . ]" 1
688 1 58 PHE QD 1 98 ILE MG . . 9.500 6.249 5.357 6.732 . 0 0 "[ . 1 . ]" 1
689 1 58 PHE QD 1 99 GLY QA . . 8.500 3.917 3.256 4.248 . 0 0 "[ . 1 . ]" 1
690 1 59 ILE HA 1 59 ILE MG . . 3.600 2.500 2.317 2.977 . 0 0 "[ . 1 . ]" 1
691 1 59 ILE HA 1 59 ILE MD . . 4.800 3.884 3.652 3.955 . 0 0 "[ . 1 . ]" 1
692 1 59 ILE HA 1 63 GLU QB . . 6.500 3.429 3.142 3.679 . 0 0 "[ . 1 . ]" 1
693 1 59 ILE HB 1 59 ILE MD . . 3.500 2.248 2.174 2.526 . 0 0 "[ . 1 . ]" 1
694 1 59 ILE HB 1 64 LEU QB . . 7.500 5.298 4.458 6.346 . 0 0 "[ . 1 . ]" 1
695 1 59 ILE HB 1 64 LEU HG . . 6.500 5.858 5.007 6.605 0.105 5 0 "[ . 1 . ]" 1
696 1 59 ILE HB 1 64 LEU MD1 . . 7.500 3.581 2.686 4.469 . 0 0 "[ . 1 . ]" 1
697 1 59 ILE HB 1 67 ILE HB . . 6.500 6.052 5.535 6.426 . 0 0 "[ . 1 . ]" 1
698 1 59 ILE HB 1 97 LYS QG . . 7.500 5.319 4.793 6.749 . 0 0 "[ . 1 . ]" 1
699 1 59 ILE HB 1 98 ILE HA . . 6.500 4.817 4.508 5.111 . 0 0 "[ . 1 . ]" 1
700 1 59 ILE HB 1 98 ILE HB . . 5.800 2.049 1.991 2.173 . 0 0 "[ . 1 . ]" 1
701 1 59 ILE HB 1 98 ILE MG . . 7.500 3.274 2.721 3.523 . 0 0 "[ . 1 . ]" 1
702 1 59 ILE HB 1 98 ILE HG12 . . 6.000 4.924 4.197 5.111 . 0 0 "[ . 1 . ]" 1
703 1 59 ILE HB 1 98 ILE HG13 . . 4.000 4.019 2.717 4.489 0.489 5 0 "[ . 1 . ]" 1
704 1 59 ILE HB 1 98 ILE MD . . 7.500 3.348 2.785 3.776 . 0 0 "[ . 1 . ]" 1
705 1 59 ILE HB 1 103 PHE QE . . 8.500 6.081 5.549 6.801 . 0 0 "[ . 1 . ]" 1
706 1 59 ILE MG 1 63 GLU QB . . 7.500 2.271 1.992 3.208 . 0 0 "[ . 1 . ]" 1
707 1 59 ILE MG 1 63 GLU QG . . 8.500 4.026 3.513 5.117 . 0 0 "[ . 1 . ]" 1
708 1 59 ILE MG 1 64 LEU HA . . 7.500 3.073 2.551 3.436 . 0 0 "[ . 1 . ]" 1
709 1 59 ILE MG 1 64 LEU QB . . 8.500 2.885 2.078 3.639 . 0 0 "[ . 1 . ]" 1
710 1 59 ILE MG 1 64 LEU MD1 . . 8.500 2.056 1.867 2.352 . 0 0 "[ . 1 . ]" 1
711 1 59 ILE MG 1 67 ILE HB . . 7.500 3.495 3.041 4.085 . 0 0 "[ . 1 . ]" 1
712 1 59 ILE MG 1 67 ILE QG . . 7.500 3.329 2.625 4.738 . 0 0 "[ . 1 . ]" 1
713 1 59 ILE MG 1 67 ILE MD . . 7.800 4.459 4.086 5.035 . 0 0 "[ . 1 . ]" 1
714 1 59 ILE MG 1 98 ILE HB . . 7.500 3.244 2.333 3.764 . 0 0 "[ . 1 . ]" 1
715 1 59 ILE MG 1 98 ILE MG . . 8.500 3.880 3.237 4.321 . 0 0 "[ . 1 . ]" 1
716 1 59 ILE MG 1 98 ILE HG12 . . 7.500 5.200 3.922 5.569 . 0 0 "[ . 1 . ]" 1
717 1 59 ILE MG 1 98 ILE MD . . 8.500 3.001 2.092 3.738 . 0 0 "[ . 1 . ]" 1
718 1 59 ILE QG 1 63 GLU QB . . 7.500 3.427 2.128 4.127 . 0 0 "[ . 1 . ]" 1
719 1 59 ILE QG 1 64 LEU QB . . 8.500 5.676 4.796 6.487 . 0 0 "[ . 1 . ]" 1
720 1 59 ILE QG 1 67 ILE QG . . 7.500 4.618 3.754 6.329 . 0 0 "[ . 1 . ]" 1
721 1 59 ILE QG 1 67 ILE MD . . 8.500 5.419 5.040 5.947 . 0 0 "[ . 1 . ]" 1
722 1 59 ILE QG 1 98 ILE HB . . 7.500 3.811 2.481 4.240 . 0 0 "[ . 1 . ]" 1
723 1 59 ILE QG 1 98 ILE MG . . 8.500 3.828 3.142 4.404 . 0 0 "[ . 1 . ]" 1
724 1 59 ILE MD 1 64 LEU HG . . 7.500 5.357 3.805 6.266 . 0 0 "[ . 1 . ]" 1
725 1 59 ILE MD 1 67 ILE MG . . 8.500 4.135 2.707 5.364 . 0 0 "[ . 1 . ]" 1
726 1 59 ILE MD 1 67 ILE QG . . 7.500 3.170 2.100 4.671 . 0 0 "[ . 1 . ]" 1
727 1 59 ILE MD 1 67 ILE MD . . 8.500 3.774 3.328 4.353 . 0 0 "[ . 1 . ]" 1
728 1 59 ILE MD 1 98 ILE HB . . 7.500 2.679 2.181 3.804 . 0 0 "[ . 1 . ]" 1
729 1 59 ILE MD 1 98 ILE MG . . 8.500 2.304 2.063 3.389 . 0 0 "[ . 1 . ]" 1
730 1 59 ILE MD 1 98 ILE MD . . 8.500 3.135 2.224 3.542 . 0 0 "[ . 1 . ]" 1
731 1 59 ILE MD 1 103 PHE QB . . 8.500 4.492 4.140 5.792 . 0 0 "[ . 1 . ]" 1
732 1 59 ILE MD 1 103 PHE QD . . 9.500 4.094 3.550 5.859 . 0 0 "[ . 1 . ]" 1
733 1 59 ILE MD 1 103 PHE QE . . 9.500 3.836 3.172 5.878 . 0 0 "[ . 1 . ]" 1
734 1 60 GLU HA 1 61 GLU HA . . 6.500 4.246 4.108 4.405 . 0 0 "[ . 1 . ]" 1
735 1 60 GLU HA 1 61 GLU HG3 . . 6.500 5.441 4.016 6.208 . 0 0 "[ . 1 . ]" 1
736 1 60 GLU HA 1 63 GLU QB . . 5.100 5.210 4.989 5.401 0.301 5 0 "[ . 1 . ]" 1
737 1 60 GLU HA 1 97 LYS HA . . 3.600 3.566 3.305 3.676 0.076 7 0 "[ . 1 . ]" 1
738 1 60 GLU HA 1 97 LYS QB . . 6.500 4.537 4.124 5.100 . 0 0 "[ . 1 . ]" 1
739 1 60 GLU HA 1 97 LYS QG . . 7.500 3.170 2.613 5.029 . 0 0 "[ . 1 . ]" 1
740 1 60 GLU QB 1 61 GLU HA . . 7.300 4.561 4.373 4.739 . 0 0 "[ . 1 . ]" 1
741 1 60 GLU QB 1 61 GLU QB . . 8.500 4.258 3.834 4.570 . 0 0 "[ . 1 . ]" 1
742 1 60 GLU QB 1 61 GLU HG3 . . 7.500 4.186 3.232 5.053 . 0 0 "[ . 1 . ]" 1
743 1 60 GLU QB 1 61 GLU HG2 . . 7.500 3.929 2.796 5.167 . 0 0 "[ . 1 . ]" 1
744 1 60 GLU QB 1 62 ASP HB3 . . 7.500 4.530 3.257 5.168 . 0 0 "[ . 1 . ]" 1
745 1 60 GLU QB 1 63 GLU QB . . 7.500 4.750 3.870 5.689 . 0 0 "[ . 1 . ]" 1
746 1 60 GLU QB 1 63 GLU QG . . 8.500 5.340 4.012 6.280 . 0 0 "[ . 1 . ]" 1
747 1 60 GLU QG 1 97 LYS QG . . 8.500 3.152 1.838 6.059 . 0 0 "[ . 1 . ]" 1
748 1 60 GLU QG 1 97 LYS QD . . 7.500 3.738 2.351 5.257 . 0 0 "[ . 1 . ]" 1
749 1 61 GLU HA 1 62 ASP HB2 . . 5.400 5.690 5.424 5.886 0.486 2 0 "[ . 1 . ]" 1
750 1 61 GLU HA 1 64 LEU QB . . 6.100 1.945 1.903 2.010 . 0 0 "[ . 1 . ]" 1
751 1 61 GLU HA 1 64 LEU HG . . 6.500 4.591 4.319 4.869 . 0 0 "[ . 1 . ]" 1
752 1 61 GLU HA 1 64 LEU MD1 . . 7.500 3.366 2.337 4.201 . 0 0 "[ . 1 . ]" 1
753 1 61 GLU HA 1 64 LEU MD2 . . 7.500 2.906 2.428 3.504 . 0 0 "[ . 1 . ]" 1
754 1 61 GLU QB 1 64 LEU QB . . 7.700 3.479 3.244 3.870 . 0 0 "[ . 1 . ]" 1
755 1 61 GLU QB 1 64 LEU MD1 . . 8.500 4.389 3.409 5.618 . 0 0 "[ . 1 . ]" 1
756 1 61 GLU HG3 1 62 ASP HB2 . . 6.500 4.630 3.560 6.916 0.416 13 0 "[ . 1 . ]" 1
757 1 62 ASP HA 1 63 GLU QB . . 5.400 5.497 5.377 5.618 0.218 18 0 "[ . 1 . ]" 1
758 1 62 ASP HA 1 65 GLY HA3 . . 6.000 5.250 4.761 5.637 . 0 0 "[ . 1 . ]" 1
759 1 62 ASP HB3 1 66 PHE QD . . 8.500 7.116 6.448 7.797 . 0 0 "[ . 1 . ]" 1
760 1 63 GLU HA 1 64 LEU HA . . 6.500 4.905 4.819 4.985 . 0 0 "[ . 1 . ]" 1
761 1 63 GLU HA 1 66 PHE QD . . 8.500 4.195 3.321 4.777 . 0 0 "[ . 1 . ]" 1
762 1 63 GLU QB 1 64 LEU QB . . 7.500 3.861 3.471 4.149 . 0 0 "[ . 1 . ]" 1
763 1 63 GLU QB 1 67 ILE HA . . 5.200 3.762 2.888 4.377 . 0 0 "[ . 1 . ]" 1
764 1 64 LEU HA 1 64 LEU HG . . 4.100 2.295 2.115 2.485 . 0 0 "[ . 1 . ]" 1
765 1 64 LEU HA 1 67 ILE HB . . 6.000 2.909 2.163 4.501 . 0 0 "[ . 1 . ]" 1
766 1 64 LEU HA 1 67 ILE MG . . 7.500 2.462 1.884 3.246 . 0 0 "[ . 1 . ]" 1
767 1 64 LEU QB 1 65 GLY HA3 . . 7.500 4.602 4.264 4.954 . 0 0 "[ . 1 . ]" 1
768 1 64 LEU QB 1 87 MET HA . . 7.500 5.160 4.585 5.807 . 0 0 "[ . 1 . ]" 1
769 1 64 LEU QB 1 87 MET QB . . 8.200 4.396 3.813 5.695 . 0 0 "[ . 1 . ]" 1
770 1 64 LEU HG 1 65 GLY HA3 . . 6.500 6.443 6.121 6.581 0.081 15 0 "[ . 1 . ]" 1
771 1 64 LEU HG 1 65 GLY HA2 . . 6.500 5.542 5.072 6.041 . 0 0 "[ . 1 . ]" 1
772 1 64 LEU HG 1 67 ILE HB . . 6.500 4.421 3.263 5.294 . 0 0 "[ . 1 . ]" 1
773 1 64 LEU HG 1 67 ILE MG . . 7.500 3.065 2.195 3.880 . 0 0 "[ . 1 . ]" 1
774 1 64 LEU HG 1 67 ILE MD . . 7.500 5.311 4.691 6.024 . 0 0 "[ . 1 . ]" 1
775 1 64 LEU HG 1 78 LEU HG . . 6.500 6.422 5.680 6.623 0.123 10 0 "[ . 1 . ]" 1
776 1 64 LEU HG 1 78 LEU MD2 . . 7.500 6.364 4.369 7.191 . 0 0 "[ . 1 . ]" 1
777 1 64 LEU HG 1 86 LEU HB3 . . 6.100 3.930 3.018 4.708 . 0 0 "[ . 1 . ]" 1
778 1 64 LEU HG 1 86 LEU HB2 . . 5.600 5.088 4.283 6.143 0.543 11 1 "[ . 1+ . ]" 1
779 1 64 LEU HG 1 86 LEU HG . . 6.500 3.623 2.238 5.009 . 0 0 "[ . 1 . ]" 1
780 1 64 LEU HG 1 86 LEU QD . . 7.400 2.386 1.951 3.949 . 0 0 "[ . 1 . ]" 1
781 1 64 LEU HG 1 87 MET QB . . 7.500 5.083 4.234 6.460 . 0 0 "[ . 1 . ]" 1
782 1 64 LEU MD1 1 65 GLY HA3 . . 7.500 6.654 6.475 6.884 . 0 0 "[ . 1 . ]" 1
783 1 64 LEU MD1 1 65 GLY HA2 . . 7.500 6.142 5.890 6.328 . 0 0 "[ . 1 . ]" 1
784 1 64 LEU MD1 1 67 ILE HB . . 7.500 4.457 3.000 5.916 . 0 0 "[ . 1 . ]" 1
785 1 64 LEU MD1 1 67 ILE MG . . 8.200 3.698 3.284 4.793 . 0 0 "[ . 1 . ]" 1
786 1 64 LEU MD1 1 67 ILE QG . . 8.500 4.153 3.041 5.065 . 0 0 "[ . 1 . ]" 1
787 1 64 LEU MD1 1 67 ILE MD . . 7.300 5.139 4.272 5.831 . 0 0 "[ . 1 . ]" 1
788 1 64 LEU MD1 1 78 LEU HG . . 7.500 7.210 6.643 7.624 0.124 10 0 "[ . 1 . ]" 1
789 1 64 LEU MD1 1 78 LEU MD2 . . 8.500 6.828 5.257 7.570 . 0 0 "[ . 1 . ]" 1
790 1 64 LEU MD1 1 86 LEU QD . . 6.000 2.549 2.035 3.086 . 0 0 "[ . 1 . ]" 1
791 1 64 LEU MD1 1 87 MET HA . . 7.100 2.956 2.253 3.654 . 0 0 "[ . 1 . ]" 1
792 1 64 LEU MD2 1 67 ILE HB . . 7.100 5.550 4.410 6.272 . 0 0 "[ . 1 . ]" 1
793 1 64 LEU MD2 1 67 ILE MG . . 8.500 4.053 2.736 5.006 . 0 0 "[ . 1 . ]" 1
794 1 65 GLY HA3 1 66 PHE QB . . 5.600 4.154 3.973 4.309 . 0 0 "[ . 1 . ]" 1
795 1 65 GLY HA3 1 78 LEU QB . . 7.500 4.646 4.011 6.352 . 0 0 "[ . 1 . ]" 1
796 1 65 GLY HA3 1 78 LEU HG . . 6.500 5.325 4.755 6.196 . 0 0 "[ . 1 . ]" 1
797 1 65 GLY HA2 1 67 ILE MG . . 7.500 4.702 4.310 5.124 . 0 0 "[ . 1 . ]" 1
798 1 65 GLY HA2 1 78 LEU QB . . 7.500 3.165 2.568 5.062 . 0 0 "[ . 1 . ]" 1
799 1 65 GLY HA2 1 78 LEU HG . . 6.500 4.196 3.467 4.663 . 0 0 "[ . 1 . ]" 1
800 1 66 PHE HA 1 69 LYS QG . . 7.500 5.123 3.988 6.002 . 0 0 "[ . 1 . ]" 1
801 1 66 PHE QB 1 67 ILE HA . . 7.500 5.196 5.096 5.349 . 0 0 "[ . 1 . ]" 1
802 1 66 PHE QB 1 69 LYS QG . . 8.500 3.317 2.362 4.049 . 0 0 "[ . 1 . ]" 1
803 1 67 ILE HA 1 67 ILE QG . . 3.700 2.740 2.352 3.496 . 0 0 "[ . 1 . ]" 1
804 1 67 ILE HA 1 67 ILE MD . . 4.000 3.422 3.356 3.498 . 0 0 "[ . 1 . ]" 1
805 1 67 ILE HA 1 68 LEU QB . . 6.500 5.375 5.186 5.712 . 0 0 "[ . 1 . ]" 1
806 1 67 ILE HA 1 69 LYS QB . . 7.500 4.641 4.260 4.877 . 0 0 "[ . 1 . ]" 1
807 1 67 ILE HA 1 70 GLY HA3 . . 6.500 5.018 4.716 5.316 . 0 0 "[ . 1 . ]" 1
808 1 67 ILE HA 1 71 PHE QE . . 8.500 6.207 5.474 6.474 . 0 0 "[ . 1 . ]" 1
809 1 67 ILE MG 1 68 LEU HA . . 7.500 4.346 3.586 5.560 . 0 0 "[ . 1 . ]" 1
810 1 67 ILE MG 1 68 LEU QB . . 7.500 4.334 3.498 5.647 . 0 0 "[ . 1 . ]" 1
811 1 67 ILE MG 1 68 LEU HG . . 7.500 3.600 2.517 5.397 . 0 0 "[ . 1 . ]" 1
812 1 67 ILE MG 1 68 LEU MD1 . . 8.500 3.887 2.015 6.077 . 0 0 "[ . 1 . ]" 1
813 1 67 ILE MG 1 78 LEU HG . . 7.500 3.713 2.981 4.670 . 0 0 "[ . 1 . ]" 1
814 1 67 ILE MG 1 78 LEU MD2 . . 8.500 3.903 2.194 5.089 . 0 0 "[ . 1 . ]" 1
815 1 67 ILE MG 1 86 LEU QD . . 8.500 2.602 2.139 3.831 . 0 0 "[ . 1 . ]" 1
816 1 67 ILE QG 1 68 LEU HA . . 6.500 4.472 3.826 4.861 . 0 0 "[ . 1 . ]" 1
817 1 67 ILE QG 1 86 LEU HG . . 6.500 5.502 4.353 6.180 . 0 0 "[ . 1 . ]" 1
818 1 67 ILE QG 1 86 LEU QD . . 7.500 3.445 2.316 4.994 . 0 0 "[ . 1 . ]" 1
819 1 67 ILE QG 1 70 GLY HA3 . . 6.500 5.552 4.678 6.926 0.426 6 0 "[ . 1 . ]" 1
820 1 67 ILE MD 1 68 LEU MD1 . . 8.500 4.072 2.249 4.802 . 0 0 "[ . 1 . ]" 1
821 1 67 ILE MD 1 71 PHE HA . . 7.500 5.669 5.389 5.928 . 0 0 "[ . 1 . ]" 1
822 1 67 ILE MD 1 71 PHE HB2 . . 7.500 4.418 4.052 4.858 . 0 0 "[ . 1 . ]" 1
823 1 67 ILE MD 1 71 PHE QE . . 9.500 2.218 2.067 2.328 . 0 0 "[ . 1 . ]" 1
824 1 67 ILE MD 1 78 LEU HG . . 7.500 5.719 5.244 6.290 . 0 0 "[ . 1 . ]" 1
825 1 67 ILE MD 1 78 LEU MD2 . . 8.500 4.908 3.886 5.922 . 0 0 "[ . 1 . ]" 1
826 1 67 ILE MD 1 86 LEU QD . . 8.500 3.586 3.141 4.755 . 0 0 "[ . 1 . ]" 1
827 1 68 LEU HA 1 68 LEU HG . . 4.100 2.893 2.279 4.124 0.024 12 0 "[ . 1 . ]" 1
828 1 68 LEU HA 1 68 LEU MD1 . . 4.000 3.773 2.920 4.219 0.219 9 0 "[ . 1 . ]" 1
829 1 68 LEU HA 1 69 LYS QG . . 7.500 6.020 5.469 6.501 . 0 0 "[ . 1 . ]" 1
830 1 68 LEU HA 1 71 PHE HB2 . . 6.500 2.668 2.243 3.184 . 0 0 "[ . 1 . ]" 1
831 1 68 LEU HA 1 71 PHE HB3 . . 6.500 4.335 3.963 4.762 . 0 0 "[ . 1 . ]" 1
832 1 68 LEU HA 1 75 ALA MB . . 7.500 3.748 3.601 3.834 . 0 0 "[ . 1 . ]" 1
833 1 68 LEU QB 1 69 LYS QG . . 7.500 4.569 3.912 5.349 . 0 0 "[ . 1 . ]" 1
834 1 68 LEU QB 1 71 PHE HA . . 6.500 6.204 5.805 6.586 0.086 10 0 "[ . 1 . ]" 1
835 1 68 LEU QB 1 75 ALA HA . . 6.500 2.413 2.042 3.278 . 0 0 "[ . 1 . ]" 1
836 1 68 LEU QB 1 75 ALA MB . . 7.500 1.978 1.873 2.212 . 0 0 "[ . 1 . ]" 1
837 1 68 LEU QB 1 76 ARG QG . . 6.500 5.264 4.824 6.098 . 0 0 "[ . 1 . ]" 1
838 1 68 LEU QB 1 78 LEU HG . . 6.500 4.823 4.155 6.034 . 0 0 "[ . 1 . ]" 1
839 1 68 LEU HG 1 75 ALA MB . . 7.500 4.104 2.382 4.477 . 0 0 "[ . 1 . ]" 1
840 1 68 LEU MD1 1 75 ALA MB . . 8.500 3.297 2.163 4.069 . 0 0 "[ . 1 . ]" 1
841 1 69 LYS HA 1 73 PRO HA . . 6.500 3.796 3.599 4.114 . 0 0 "[ . 1 . ]" 1
842 1 69 LYS HA 1 75 ALA MB . . 7.000 2.290 2.114 2.491 . 0 0 "[ . 1 . ]" 1
843 1 69 LYS QB 1 75 ALA MB . . 8.500 3.002 2.424 3.422 . 0 0 "[ . 1 . ]" 1
844 1 69 LYS QG 1 73 PRO HA . . 7.500 3.533 2.779 4.071 . 0 0 "[ . 1 . ]" 1
845 1 69 LYS QG 1 75 ALA MB . . 8.500 2.202 1.913 2.894 . 0 0 "[ . 1 . ]" 1
846 1 69 LYS QG 1 77 ASP HA . . 7.500 6.344 5.530 6.721 . 0 0 "[ . 1 . ]" 1
847 1 70 GLY HA2 1 71 PHE HA . . 6.500 4.760 4.607 4.842 . 0 0 "[ . 1 . ]" 1
848 1 70 GLY HA2 1 72 SER QB . . 6.700 6.651 6.487 6.792 0.092 17 0 "[ . 1 . ]" 1
849 1 70 GLY HA2 1 75 ALA MB . . 7.500 5.950 5.737 6.057 . 0 0 "[ . 1 . ]" 1
850 1 70 GLY HA3 1 71 PHE HA . . 6.400 4.438 4.293 4.624 . 0 0 "[ . 1 . ]" 1
851 1 70 GLY HA3 1 71 PHE QD . . 8.500 4.921 3.873 5.322 . 0 0 "[ . 1 . ]" 1
852 1 71 PHE HB3 1 72 SER QB . . 7.500 3.447 3.027 3.833 . 0 0 "[ . 1 . ]" 1
853 1 72 SER HA 1 73 PRO HA . . 6.500 4.533 4.470 4.609 . 0 0 "[ . 1 . ]" 1
854 1 72 SER HA 1 73 PRO HB2 . . 6.000 5.892 5.811 5.936 . 0 0 "[ . 1 . ]" 1
855 1 72 SER HA 1 73 PRO HB3 . . 5.600 5.087 4.956 5.170 . 0 0 "[ . 1 . ]" 1
856 1 72 SER HA 1 73 PRO HG3 . . 6.500 4.859 4.743 4.923 . 0 0 "[ . 1 . ]" 1
857 1 72 SER HA 1 73 PRO HD2 . . 6.200 2.650 2.355 3.015 . 0 0 "[ . 1 . ]" 1
858 1 72 SER HA 1 73 PRO HD3 . . 4.500 2.691 2.567 2.779 . 0 0 "[ . 1 . ]" 1
859 1 72 SER QB 1 73 PRO HB2 . . 7.500 5.230 4.821 6.142 . 0 0 "[ . 1 . ]" 1
860 1 72 SER QB 1 73 PRO HG2 . . 7.500 3.848 3.285 4.843 . 0 0 "[ . 1 . ]" 1
861 1 72 SER QB 1 73 PRO HG3 . . 7.500 4.815 4.355 5.628 . 0 0 "[ . 1 . ]" 1
862 1 72 SER QB 1 75 ALA MB . . 8.500 4.431 4.068 5.087 . 0 0 "[ . 1 . ]" 1
863 1 73 PRO HA 1 74 ASP HA . . 5.900 4.456 4.272 4.595 . 0 0 "[ . 1 . ]" 1
864 1 73 PRO HA 1 74 ASP QB . . 6.500 4.630 4.420 4.865 . 0 0 "[ . 1 . ]" 1
865 1 73 PRO HA 1 75 ALA MB . . 5.800 3.392 2.988 3.701 . 0 0 "[ . 1 . ]" 1
866 1 73 PRO HB2 1 73 PRO HG3 . . 3.100 2.700 2.687 2.759 . 0 0 "[ . 1 . ]" 1
867 1 73 PRO HB2 1 74 ASP QB . . 7.500 3.865 3.439 4.402 . 0 0 "[ . 1 . ]" 1
868 1 73 PRO HB3 1 74 ASP QB . . 7.500 5.296 4.995 5.696 . 0 0 "[ . 1 . ]" 1
869 1 73 PRO QB 1 74 ASP HA . . 7.500 4.153 3.970 4.291 . 0 0 "[ . 1 . ]" 1
870 1 73 PRO HG2 1 75 ALA MB . . 7.500 6.113 5.908 6.231 . 0 0 "[ . 1 . ]" 1
871 1 74 ASP HA 1 75 ALA HA . . 5.600 4.914 4.783 5.046 . 0 0 "[ . 1 . ]" 1
872 1 74 ASP HA 1 75 ALA MB . . 6.100 4.325 3.752 4.842 . 0 0 "[ . 1 . ]" 1
873 1 74 ASP QB 1 75 ALA HA . . 7.500 4.740 4.137 5.157 . 0 0 "[ . 1 . ]" 1
874 1 74 ASP QB 1 76 ARG QG . . 7.500 4.390 3.982 5.373 . 0 0 "[ . 1 . ]" 1
875 1 74 ASP QB 1 76 ARG QD . . 8.500 5.399 4.288 6.357 . 0 0 "[ . 1 . ]" 1
876 1 75 ALA HA 1 76 ARG HA . . 5.900 5.232 4.528 5.406 . 0 0 "[ . 1 . ]" 1
877 1 75 ALA HA 1 76 ARG HB2 . . 6.400 5.100 4.606 5.772 . 0 0 "[ . 1 . ]" 1
878 1 75 ALA HA 1 76 ARG QG . . 6.500 3.878 3.330 4.083 . 0 0 "[ . 1 . ]" 1
879 1 75 ALA MB 1 76 ARG HA . . 6.200 4.060 3.801 4.608 . 0 0 "[ . 1 . ]" 1
880 1 75 ALA MB 1 76 ARG HB2 . . 7.500 5.049 4.801 6.147 . 0 0 "[ . 1 . ]" 1
881 1 75 ALA MB 1 76 ARG QG . . 6.700 4.114 3.890 4.696 . 0 0 "[ . 1 . ]" 1
882 1 76 ARG HA 1 77 ASP HA . . 5.300 4.401 4.265 4.506 . 0 0 "[ . 1 . ]" 1
883 1 76 ARG HA 1 77 ASP HB2 . . 5.200 5.153 4.200 5.818 0.618 18 7 "[ - . *1 * *. *+*]" 1
884 1 76 ARG HA 1 77 ASP HB3 . . 6.500 5.027 4.457 5.914 . 0 0 "[ . 1 . ]" 1
885 1 76 ARG HB3 1 77 ASP HA . . 6.400 4.937 4.714 5.961 . 0 0 "[ . 1 . ]" 1
886 1 76 ARG HB3 1 77 ASP HB2 . . 6.500 5.072 3.954 7.098 0.598 17 1 "[ . 1 . + ]" 1
887 1 76 ARG QG 1 78 LEU MD2 . . 7.500 5.467 3.840 7.794 0.294 7 0 "[ . 1 . ]" 1
888 1 78 LEU HA 1 78 LEU MD2 . . 4.200 2.387 2.133 4.135 . 0 0 "[ . 1 . ]" 1
889 1 78 LEU HA 1 79 SER HA . . 5.800 4.385 4.287 4.444 . 0 0 "[ . 1 . ]" 1
890 1 78 LEU HA 1 79 SER QB . . 5.400 4.239 4.032 4.626 . 0 0 "[ . 1 . ]" 1
891 1 78 LEU HA 1 82 GLU QB . . 7.500 4.115 3.631 5.090 . 0 0 "[ . 1 . ]" 1
892 1 78 LEU QB 1 79 SER HA . . 5.400 4.485 4.271 4.694 . 0 0 "[ . 1 . ]" 1
893 1 78 LEU QB 1 82 GLU QB . . 8.500 2.400 2.086 3.600 . 0 0 "[ . 1 . ]" 1
894 1 78 LEU HG 1 86 LEU QD . . 7.500 4.691 2.958 6.739 . 0 0 "[ . 1 . ]" 1
895 1 78 LEU MD2 1 82 GLU QB . . 8.500 3.675 2.207 4.671 . 0 0 "[ . 1 . ]" 1
896 1 79 SER HA 1 80 ALA HA . . 4.400 4.405 4.349 4.432 0.032 9 0 "[ . 1 . ]" 1
897 1 79 SER HA 1 80 ALA MB . . 4.900 4.037 3.975 4.090 . 0 0 "[ . 1 . ]" 1
898 1 79 SER HA 1 81 LYS QG . . 6.500 5.335 4.800 6.610 0.110 18 0 "[ . 1 . ]" 1
899 1 79 SER HA 1 81 LYS QD . . 7.500 6.100 3.923 6.743 . 0 0 "[ . 1 . ]" 1
900 1 79 SER HA 1 82 GLU QG . . 7.500 5.909 3.919 6.643 . 0 0 "[ . 1 . ]" 1
901 1 79 SER QB 1 80 ALA MB . . 8.500 4.406 3.623 4.749 . 0 0 "[ . 1 . ]" 1
902 1 79 SER QB 1 81 LYS HB2 . . 7.500 3.510 3.037 4.411 . 0 0 "[ . 1 . ]" 1
903 1 79 SER QB 1 81 LYS QG . . 7.500 3.803 2.721 4.560 . 0 0 "[ . 1 . ]" 1
904 1 79 SER QB 1 81 LYS QD . . 8.500 4.561 2.053 5.539 . 0 0 "[ . 1 . ]" 1
905 1 80 ALA HA 1 81 LYS HA . . 4.900 4.827 4.684 4.907 0.007 14 0 "[ . 1 . ]" 1
906 1 80 ALA MB 1 81 LYS HA . . 4.900 4.033 3.864 4.109 . 0 0 "[ . 1 . ]" 1
907 1 80 ALA MB 1 81 LYS QG . . 7.500 3.537 2.990 4.359 . 0 0 "[ . 1 . ]" 1
908 1 80 ALA MB 1 81 LYS QD . . 8.500 3.655 2.554 5.194 . 0 0 "[ . 1 . ]" 1
909 1 81 LYS HB2 1 82 GLU HA . . 4.500 4.201 3.884 4.516 0.016 15 0 "[ . 1 . ]" 1
910 1 81 LYS HB2 1 82 GLU QB . . 7.500 4.060 3.739 4.451 . 0 0 "[ . 1 . ]" 1
911 1 81 LYS HB2 1 82 GLU QG . . 7.500 5.061 3.679 5.554 . 0 0 "[ . 1 . ]" 1
912 1 81 LYS HB3 1 82 GLU HA . . 5.100 4.789 4.276 5.084 . 0 0 "[ . 1 . ]" 1
913 1 81 LYS HB3 1 82 GLU QG . . 7.500 6.041 4.801 6.531 . 0 0 "[ . 1 . ]" 1
914 1 81 LYS QG 1 82 GLU QG . . 7.500 6.310 5.415 6.703 . 0 0 "[ . 1 . ]" 1
915 1 82 GLU HA 1 85 MET QB . . 6.300 3.184 2.748 3.656 . 0 0 "[ . 1 . ]" 1
916 1 82 GLU QB 1 85 MET QB . . 8.500 4.990 4.079 5.412 . 0 0 "[ . 1 . ]" 1
917 1 82 GLU QB 1 86 LEU QD . . 8.500 4.066 3.432 5.000 . 0 0 "[ . 1 . ]" 1
918 1 85 MET HA 1 86 LEU HA . . 6.500 4.866 4.745 4.996 . 0 0 "[ . 1 . ]" 1
919 1 85 MET HA 1 87 MET QG . . 7.500 6.229 4.584 6.742 . 0 0 "[ . 1 . ]" 1
920 1 85 MET HA 1 88 ALA MB . . 3.400 2.732 2.487 2.853 . 0 0 "[ . 1 . ]" 1
921 1 85 MET QB 1 86 LEU HA . . 6.800 4.065 3.843 4.391 . 0 0 "[ . 1 . ]" 1
922 1 86 LEU HA 1 86 LEU HG . . 4.200 3.144 2.363 3.655 . 0 0 "[ . 1 . ]" 1
923 1 86 LEU HA 1 86 LEU QD . . 3.700 2.398 1.937 2.973 . 0 0 "[ . 1 . ]" 1
924 1 86 LEU HA 1 87 MET HA . . 5.000 4.823 4.697 4.944 . 0 0 "[ . 1 . ]" 1
925 1 86 LEU HB3 1 87 MET HA . . 4.500 4.560 3.869 4.909 0.409 13 0 "[ . 1 . ]" 1
926 1 86 LEU HB2 1 86 LEU HG . . 3.100 2.763 2.245 3.064 . 0 0 "[ . 1 . ]" 1
927 1 86 LEU HG 1 87 MET HA . . 6.100 4.633 3.481 6.207 0.107 9 0 "[ . 1 . ]" 1
928 1 86 LEU HG 1 89 ALA MB . . 7.500 5.349 4.380 5.981 . 0 0 "[ . 1 . ]" 1
929 1 86 LEU HG 1 90 GLY HA2 . . 6.500 5.917 4.756 6.541 0.041 9 0 "[ . 1 . ]" 1
930 1 86 LEU HG 1 90 GLY HA3 . . 6.500 4.785 3.665 5.835 . 0 0 "[ . 1 . ]" 1
931 1 86 LEU QD 1 106 LEU MD1 . . 7.300 4.688 3.062 5.788 . 0 0 "[ . 1 . ]" 1
932 1 87 MET HA 1 88 ALA HA . . 6.100 4.807 4.772 4.863 . 0 0 "[ . 1 . ]" 1
933 1 87 MET HA 1 90 GLY HA3 . . 4.400 4.255 3.495 4.836 0.436 2 0 "[ . 1 . ]" 1
934 1 87 MET HA 1 98 ILE MD . . 7.500 3.688 2.962 4.128 . 0 0 "[ . 1 . ]" 1
935 1 87 MET QG 1 98 ILE MD . . 8.500 5.225 4.333 6.075 . 0 0 "[ . 1 . ]" 1
936 1 88 ALA HA 1 89 ALA HA . . 5.400 4.747 4.715 4.776 . 0 0 "[ . 1 . ]" 1
937 1 89 ALA MB 1 90 GLY HA3 . . 6.400 4.255 4.025 4.627 . 0 0 "[ . 1 . ]" 1
938 1 89 ALA MB 1 106 LEU MD1 . . 8.500 3.392 2.450 4.795 . 0 0 "[ . 1 . ]" 1
939 1 90 GLY HA2 1 98 ILE MD . . 7.500 3.386 3.048 3.712 . 0 0 "[ . 1 . ]" 1
940 1 90 GLY HA2 1 106 LEU MD1 . . 7.500 2.935 2.026 4.007 . 0 0 "[ . 1 . ]" 1
941 1 90 GLY HA3 1 106 LEU MD1 . . 7.500 4.269 3.477 5.346 . 0 0 "[ . 1 . ]" 1
942 1 91 ASP HA 1 92 LYS HA . . 6.500 4.674 4.568 4.832 . 0 0 "[ . 1 . ]" 1
943 1 91 ASP HA 1 96 GLY QA . . 4.900 5.231 5.102 5.294 0.394 19 0 "[ . 1 . ]" 1
944 1 91 ASP HA 1 98 ILE HA . . 5.000 3.143 2.851 3.551 . 0 0 "[ . 1 . ]" 1
945 1 91 ASP HA 1 98 ILE MG . . 7.500 4.884 4.375 5.320 . 0 0 "[ . 1 . ]" 1
946 1 91 ASP HA 1 98 ILE MD . . 7.500 5.140 4.752 5.631 . 0 0 "[ . 1 . ]" 1
947 1 91 ASP HB2 1 98 ILE MD . . 7.500 5.003 4.396 5.709 . 0 0 "[ . 1 . ]" 1
948 1 91 ASP HB3 1 98 ILE MD . . 7.500 5.719 5.311 6.247 . 0 0 "[ . 1 . ]" 1
949 1 92 LYS HA 1 92 LYS QD . . 5.000 3.302 2.098 4.372 . 0 0 "[ . 1 . ]" 1
950 1 92 LYS HA 1 92 LYS QE . . 6.000 3.899 2.129 5.358 . 0 0 "[ . 1 . ]" 1
951 1 92 LYS HA 1 94 GLY HA3 . . 6.100 6.156 5.456 6.780 0.680 9 3 "[ .* +1 - . ]" 1
952 1 92 LYS QB 1 93 ASP HA . . 7.500 4.299 3.906 4.784 . 0 0 "[ . 1 . ]" 1
953 1 92 LYS QB 1 93 ASP QB . . 8.500 4.477 3.630 5.453 . 0 0 "[ . 1 . ]" 1
954 1 92 LYS QB 1 102 GLU QG . . 8.500 3.978 2.780 5.563 . 0 0 "[ . 1 . ]" 1
955 1 92 LYS QB 1 106 LEU MD1 . . 8.500 3.931 2.145 6.182 . 0 0 "[ . 1 . ]" 1
956 1 92 LYS QG 1 98 ILE HG12 . . 7.500 6.017 5.461 6.419 . 0 0 "[ . 1 . ]" 1
957 1 92 LYS QG 1 98 ILE MD . . 8.500 6.331 6.247 6.421 . 0 0 "[ . 1 . ]" 1
958 1 92 LYS QG 1 102 GLU HA . . 7.500 4.455 2.846 6.453 . 0 0 "[ . 1 . ]" 1
959 1 92 LYS QD 1 102 GLU QG . . 8.500 4.906 2.454 6.763 . 0 0 "[ . 1 . ]" 1
960 1 93 ASP HA 1 94 GLY HA3 . . 5.900 4.612 4.517 4.682 . 0 0 "[ . 1 . ]" 1
961 1 93 ASP QB 1 95 ASP QB . . 7.500 3.992 3.432 5.422 . 0 0 "[ . 1 . ]" 1
962 1 94 GLY HA3 1 95 ASP HA . . 5.800 4.638 4.460 4.778 . 0 0 "[ . 1 . ]" 1
963 1 95 ASP QB 1 97 LYS QB . . 5.900 3.370 2.524 4.949 . 0 0 "[ . 1 . ]" 1
964 1 96 GLY QA 1 97 LYS QG . . 7.500 4.123 3.621 4.354 . 0 0 "[ . 1 . ]" 1
965 1 97 LYS HA 1 97 LYS QE . . 5.500 4.371 2.078 4.922 . 0 0 "[ . 1 . ]" 1
966 1 97 LYS HA 1 98 ILE HA . . 6.500 4.453 4.397 4.532 . 0 0 "[ . 1 . ]" 1
967 1 97 LYS HA 1 98 ILE HG12 . . 6.500 5.398 4.486 5.961 . 0 0 "[ . 1 . ]" 1
968 1 97 LYS HA 1 98 ILE HG13 . . 6.500 4.041 3.581 4.382 . 0 0 "[ . 1 . ]" 1
969 1 97 LYS QB 1 97 LYS QE . . 4.200 2.585 1.942 3.528 . 0 0 "[ . 1 . ]" 1
970 1 97 LYS QB 1 98 ILE HB . . 6.500 4.605 4.355 5.210 . 0 0 "[ . 1 . ]" 1
971 1 97 LYS QB 1 98 ILE HG12 . . 6.500 5.972 5.364 6.268 . 0 0 "[ . 1 . ]" 1
972 1 98 ILE HA 1 98 ILE MG . . 3.700 2.637 2.530 2.765 . 0 0 "[ . 1 . ]" 1
973 1 98 ILE HA 1 98 ILE HG12 . . 4.400 2.427 2.229 2.662 . 0 0 "[ . 1 . ]" 1
974 1 98 ILE HA 1 99 GLY QA . . 5.800 3.961 3.910 4.021 . 0 0 "[ . 1 . ]" 1
975 1 98 ILE HA 1 102 GLU QB . . 7.500 3.864 3.600 4.259 . 0 0 "[ . 1 . ]" 1
976 1 98 ILE HB 1 98 ILE MD . . 3.600 2.446 2.232 2.710 . 0 0 "[ . 1 . ]" 1
977 1 98 ILE HB 1 102 GLU QB . . 7.500 6.064 5.661 6.576 . 0 0 "[ . 1 . ]" 1
978 1 98 ILE HG12 1 98 ILE MG . . 3.400 2.416 2.233 2.658 . 0 0 "[ . 1 . ]" 1
979 1 98 ILE MG 1 99 GLY QA . . 7.500 3.445 3.238 3.645 . 0 0 "[ . 1 . ]" 1
980 1 98 ILE MG 1 102 GLU QB . . 8.500 3.716 3.162 4.202 . 0 0 "[ . 1 . ]" 1
981 1 98 ILE MG 1 103 PHE HA . . 7.500 3.587 3.266 4.216 . 0 0 "[ . 1 . ]" 1
982 1 98 ILE MG 1 103 PHE QB . . 8.500 2.085 1.837 2.243 . 0 0 "[ . 1 . ]" 1
983 1 98 ILE MG 1 103 PHE QD . . 9.500 2.510 2.256 2.711 . 0 0 "[ . 1 . ]" 1
984 1 98 ILE MG 1 103 PHE QE . . 9.500 3.231 2.940 3.875 . 0 0 "[ . 1 . ]" 1
985 1 98 ILE MG 1 106 LEU HG . . 7.500 5.377 4.458 6.371 . 0 0 "[ . 1 . ]" 1
986 1 98 ILE MG 1 106 LEU MD1 . . 8.500 5.243 3.928 6.625 . 0 0 "[ . 1 . ]" 1
987 1 98 ILE HG13 1 102 GLU QB . . 7.500 5.954 4.999 6.704 . 0 0 "[ . 1 . ]" 1
988 1 98 ILE MD 1 106 LEU HG . . 7.500 5.314 4.336 6.281 . 0 0 "[ . 1 . ]" 1
989 1 99 GLY QA 1 100 VAL MG1 . . 7.500 3.618 3.374 3.875 . 0 0 "[ . 1 . ]" 1
990 1 99 GLY QA 1 100 VAL MG2 . . 7.500 5.035 4.968 5.086 . 0 0 "[ . 1 . ]" 1
991 1 99 GLY QA 1 101 ASP HB3 . . 5.400 5.170 4.695 5.835 0.435 3 0 "[ . 1 . ]" 1
992 1 99 GLY QA 1 101 ASP HB2 . . 5.000 5.363 4.281 5.860 0.860 13 9 "[ . ****-*+ .* * ]" 1
993 1 99 GLY QA 1 102 GLU QB . . 7.500 3.710 2.864 4.144 . 0 0 "[ . 1 . ]" 1
994 1 99 GLY QA 1 102 GLU QG . . 7.500 3.845 2.736 4.817 . 0 0 "[ . 1 . ]" 1
995 1 100 VAL HA 1 100 VAL MG1 . . 3.400 3.297 3.275 3.310 . 0 0 "[ . 1 . ]" 1
996 1 100 VAL HA 1 101 ASP HA . . 4.900 4.795 4.691 4.964 0.064 3 0 "[ . 1 . ]" 1
997 1 100 VAL HA 1 103 PHE QB . . 6.500 2.910 2.335 4.723 . 0 0 "[ . 1 . ]" 1
998 1 100 VAL HA 1 103 PHE QD . . 8.500 3.645 2.439 4.100 . 0 0 "[ . 1 . ]" 1
999 1 100 VAL HA 1 103 PHE QE . . 8.500 5.405 2.123 6.160 . 0 0 "[ . 1 . ]" 1
1000 1 100 VAL HB 1 103 PHE QB . . 7.500 4.958 4.427 6.730 . 0 0 "[ . 1 . ]" 1
1001 1 100 VAL HB 1 103 PHE QD . . 8.500 5.405 4.636 5.765 . 0 0 "[ . 1 . ]" 1
1002 1 100 VAL HB 1 103 PHE QE . . 8.500 6.876 3.580 7.624 . 0 0 "[ . 1 . ]" 1
1003 1 100 VAL MG1 1 103 PHE QD . . 9.500 5.971 4.898 6.346 . 0 0 "[ . 1 . ]" 1
1004 1 100 VAL MG1 1 103 PHE QE . . 9.500 7.344 4.787 7.941 . 0 0 "[ . 1 . ]" 1
1005 1 100 VAL MG2 1 101 ASP HA . . 7.500 3.407 2.884 3.855 . 0 0 "[ . 1 . ]" 1
1006 1 100 VAL MG2 1 103 PHE QD . . 9.500 4.397 3.602 5.176 . 0 0 "[ . 1 . ]" 1
1007 1 101 ASP HA 1 102 GLU HA . . 6.100 4.895 4.805 5.013 . 0 0 "[ . 1 . ]" 1
1008 1 101 ASP HA 1 104 SER QB . . 6.300 2.810 2.277 3.207 . 0 0 "[ . 1 . ]" 1
1009 1 101 ASP HB3 1 102 GLU HA . . 4.400 4.412 4.166 4.631 0.231 11 0 "[ . 1 . ]" 1
1010 1 101 ASP HB3 1 102 GLU QG . . 7.500 3.517 3.076 4.092 . 0 0 "[ . 1 . ]" 1
1011 1 101 ASP HB3 1 104 SER QB . . 7.500 5.218 4.852 5.519 . 0 0 "[ . 1 . ]" 1
1012 1 101 ASP HB2 1 102 GLU QB . . 5.600 5.814 4.373 6.215 0.615 18 4 "[ . 1- .* +*]" 1
1013 1 101 ASP HB2 1 102 GLU QG . . 6.100 4.769 2.954 5.690 . 0 0 "[ . 1 . ]" 1
1014 1 101 ASP HB2 1 105 THR MG . . 7.500 5.785 4.784 6.389 . 0 0 "[ . 1 . ]" 1
1015 1 102 GLU HA 1 103 PHE HA . . 5.000 4.773 4.627 4.932 . 0 0 "[ . 1 . ]" 1
1016 1 102 GLU HA 1 105 THR HB . . 6.500 5.091 4.625 5.536 . 0 0 "[ . 1 . ]" 1
1017 1 102 GLU HA 1 105 THR MG . . 7.500 4.446 4.168 4.680 . 0 0 "[ . 1 . ]" 1
1018 1 102 GLU HA 1 106 LEU QB . . 5.900 4.149 3.650 4.674 . 0 0 "[ . 1 . ]" 1
1019 1 102 GLU HA 1 106 LEU MD1 . . 7.500 5.918 3.882 6.596 . 0 0 "[ . 1 . ]" 1
1020 1 102 GLU QB 1 103 PHE QB . . 8.500 3.467 3.253 3.687 . 0 0 "[ . 1 . ]" 1
1021 1 102 GLU QG 1 105 THR MG . . 8.500 5.834 5.442 6.114 . 0 0 "[ . 1 . ]" 1
1022 1 103 PHE HA 1 104 SER HA . . 5.300 4.941 4.761 5.045 . 0 0 "[ . 1 . ]" 1
1023 1 103 PHE HA 1 106 LEU QB . . 6.200 2.278 2.057 2.538 . 0 0 "[ . 1 . ]" 1
1024 1 103 PHE HA 1 106 LEU HG . . 6.500 3.585 2.805 4.677 . 0 0 "[ . 1 . ]" 1
1025 1 103 PHE HA 1 106 LEU MD1 . . 7.500 3.848 2.626 4.837 . 0 0 "[ . 1 . ]" 1
1026 1 103 PHE QB 1 104 SER HA . . 7.500 4.322 4.041 5.029 . 0 0 "[ . 1 . ]" 1
1027 1 103 PHE QB 1 107 VAL MG1 . . 8.500 4.948 4.362 5.689 . 0 0 "[ . 1 . ]" 1
1028 1 103 PHE QE 1 106 LEU MD1 . . 9.500 4.852 2.774 8.114 . 0 0 "[ . 1 . ]" 1
1029 1 104 SER HA 1 105 THR MG . . 7.500 4.425 4.175 4.775 . 0 0 "[ . 1 . ]" 1
1030 1 104 SER HA 1 106 LEU QB . . 7.500 5.041 4.431 5.496 . 0 0 "[ . 1 . ]" 1
1031 1 104 SER HA 1 107 VAL HB . . 6.300 6.218 5.688 6.375 0.075 16 0 "[ . 1 . ]" 1
1032 1 104 SER HA 1 107 VAL MG1 . . 7.500 4.475 2.884 4.949 . 0 0 "[ . 1 . ]" 1
1033 1 104 SER HA 1 107 VAL MG2 . . 7.500 3.228 2.987 3.588 . 0 0 "[ . 1 . ]" 1
1034 1 104 SER QB 1 107 VAL MG2 . . 8.500 4.604 4.324 4.885 . 0 0 "[ . 1 . ]" 1
1035 1 105 THR HA 1 105 THR MG . . 3.400 2.271 2.203 2.493 . 0 0 "[ . 1 . ]" 1
1036 1 105 THR HA 1 106 LEU HA . . 5.400 5.049 4.922 5.165 . 0 0 "[ . 1 . ]" 1
1037 1 105 THR HA 1 107 VAL MG1 . . 6.900 5.414 4.880 5.841 . 0 0 "[ . 1 . ]" 1
1038 1 105 THR HA 1 108 ALA HA . . 6.000 5.007 4.651 5.384 . 0 0 "[ . 1 . ]" 1
1039 1 105 THR HA 1 108 ALA MB . . 3.400 2.461 2.189 2.835 . 0 0 "[ . 1 . ]" 1
1040 1 105 THR HB 1 106 LEU HA . . 5.500 4.992 4.695 5.160 . 0 0 "[ . 1 . ]" 1
1041 1 105 THR HB 1 108 ALA MB . . 7.500 3.455 3.082 3.826 . 0 0 "[ . 1 . ]" 1
1042 1 105 THR HB 1 109 GLU QG . . 7.500 4.360 3.561 5.022 . 0 0 "[ . 1 . ]" 1
1043 1 105 THR MG 1 106 LEU MD1 . . 8.200 6.654 5.997 6.935 . 0 0 "[ . 1 . ]" 1
1044 1 105 THR MG 1 108 ALA MB . . 8.500 3.441 3.138 3.807 . 0 0 "[ . 1 . ]" 1
1045 1 105 THR MG 1 109 GLU QG . . 8.500 5.436 4.794 5.959 . 0 0 "[ . 1 . ]" 1
1046 1 106 LEU HA 1 106 LEU MD1 . . 3.500 2.814 2.097 3.949 0.449 6 0 "[ . 1 . ]" 1
1047 1 106 LEU HA 1 107 VAL HA . . 6.500 4.759 4.645 4.845 . 0 0 "[ . 1 . ]" 1
1048 1 106 LEU HA 1 109 GLU HB2 . . 5.700 3.421 2.258 5.409 . 0 0 "[ . 1 . ]" 1
1049 1 106 LEU HA 1 109 GLU HB3 . . 5.600 4.483 3.518 5.393 . 0 0 "[ . 1 . ]" 1
1050 1 106 LEU HA 1 109 GLU QG . . 7.500 3.336 2.057 4.334 . 0 0 "[ . 1 . ]" 1
1051 1 106 LEU QB 1 107 VAL HA . . 7.500 4.220 3.697 4.644 . 0 0 "[ . 1 . ]" 1
1052 1 106 LEU QB 1 107 VAL MG2 . . 8.500 3.758 3.204 4.827 . 0 0 "[ . 1 . ]" 1
1053 1 106 LEU QB 1 109 GLU HB3 . . 6.800 6.208 5.379 6.891 0.091 13 0 "[ . 1 . ]" 1
1054 1 106 LEU MD1 1 107 VAL MG1 . . 8.500 3.176 1.990 4.571 . 0 0 "[ . 1 . ]" 1
1055 1 106 LEU MD1 1 107 VAL MG2 . . 8.500 4.708 3.673 5.840 . 0 0 "[ . 1 . ]" 1
1056 1 107 VAL HA 1 107 VAL MG1 . . 3.400 2.291 2.178 2.561 . 0 0 "[ . 1 . ]" 1
1057 1 107 VAL HA 1 108 ALA HA . . 6.500 4.731 4.668 4.805 . 0 0 "[ . 1 . ]" 1
1058 1 107 VAL HA 1 110 SER QB . . 7.500 4.136 3.467 4.989 . 0 0 "[ . 1 . ]" 1
1059 1 107 VAL HB 1 108 ALA HA . . 5.800 4.824 4.627 5.040 . 0 0 "[ . 1 . ]" 1
1060 1 107 VAL HB 1 110 SER HA . . 4.800 4.607 3.987 4.868 0.068 14 0 "[ . 1 . ]" 1
1061 1 107 VAL HB 1 110 SER QB . . 7.500 4.900 4.493 5.288 . 0 0 "[ . 1 . ]" 1
1062 1 107 VAL MG1 1 108 ALA HA . . 7.500 5.655 5.537 5.719 . 0 0 "[ . 1 . ]" 1
1063 1 107 VAL MG1 1 108 ALA MB . . 8.500 5.098 4.883 5.250 . 0 0 "[ . 1 . ]" 1
1064 1 107 VAL MG2 1 108 ALA HA . . 7.500 3.782 3.381 4.091 . 0 0 "[ . 1 . ]" 1
1065 1 107 VAL MG2 1 108 ALA MB . . 8.500 3.072 2.845 3.317 . 0 0 "[ . 1 . ]" 1
1066 1 108 ALA HA 1 109 GLU HA . . 4.900 4.864 4.717 4.933 0.033 17 0 "[ . 1 . ]" 1
1067 1 108 ALA MB 1 109 GLU HA . . 5.700 4.253 4.137 4.434 . 0 0 "[ . 1 . ]" 1
1068 1 108 ALA MB 1 109 GLU HB3 . . 7.500 5.330 4.189 5.826 . 0 0 "[ . 1 . ]" 1
1069 1 108 ALA MB 1 109 GLU QG . . 8.500 3.890 3.329 4.445 . 0 0 "[ . 1 . ]" 1
1070 1 109 GLU HA 1 110 SER HA . . 6.500 5.301 5.205 5.377 . 0 0 "[ . 1 . ]" 1
1071 1 109 GLU HA 1 110 SER QB . . 6.300 4.666 4.366 4.962 . 0 0 "[ . 1 . ]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 1084
_Distance_constraint_stats_list.Viol_count 714
_Distance_constraint_stats_list.Viol_total 1674.250
_Distance_constraint_stats_list.Viol_max 0.610
_Distance_constraint_stats_list.Viol_rms 0.0322
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0043
_Distance_constraint_stats_list.Viol_average_violations_only 0.1234
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 0.000 0.000 . 0 "[ . 1 . ]"
1 2 SER 0.022 0.022 3 0 "[ . 1 . ]"
1 3 MET 0.000 0.000 . 0 "[ . 1 . ]"
1 4 THR 0.414 0.046 8 0 "[ . 1 . ]"
1 5 ASP 0.046 0.023 7 0 "[ . 1 . ]"
1 6 LEU 0.633 0.271 11 0 "[ . 1 . ]"
1 7 LEU 0.540 0.096 6 0 "[ . 1 . ]"
1 8 ASN 0.466 0.096 6 0 "[ . 1 . ]"
1 9 ALA 0.291 0.043 11 0 "[ . 1 . ]"
1 10 GLU 0.172 0.062 16 0 "[ . 1 . ]"
1 11 ASP 2.465 0.256 4 0 "[ . 1 . ]"
1 12 ILE 0.122 0.043 3 0 "[ . 1 . ]"
1 13 LYS 5.699 0.346 5 0 "[ . 1 . ]"
1 14 LYS 0.254 0.207 7 0 "[ . 1 . ]"
1 15 ALA 0.901 0.078 19 0 "[ . 1 . ]"
1 16 VAL 0.915 0.078 19 0 "[ . 1 . ]"
1 17 GLY 0.009 0.009 2 0 "[ . 1 . ]"
1 18 ALA 0.046 0.046 5 0 "[ . 1 . ]"
1 19 PHE 12.026 0.494 11 0 "[ . 1 . ]"
1 20 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 21 ALA 0.259 0.103 1 0 "[ . 1 . ]"
1 22 THR 0.000 0.000 . 0 "[ . 1 . ]"
1 23 ASP 3.226 0.264 6 0 "[ . 1 . ]"
1 24 SER 7.074 0.494 11 0 "[ . 1 . ]"
1 25 PHE 4.343 0.418 2 0 "[ . 1 . ]"
1 26 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 27 HIS 0.000 0.000 . 0 "[ . 1 . ]"
1 28 LYS 6.164 0.607 9 3 "[ . +1 .* - ]"
1 29 LYS 0.679 0.185 5 0 "[ . 1 . ]"
1 30 PHE 0.101 0.101 10 0 "[ . 1 . ]"
1 31 PHE 5.062 0.607 9 3 "[ . +1 .* - ]"
1 32 GLN 0.838 0.089 9 0 "[ . 1 . ]"
1 33 MET 1.406 0.610 14 1 "[ . 1 +. ]"
1 34 VAL 0.121 0.070 16 0 "[ . 1 . ]"
1 35 GLY 0.000 0.000 . 0 "[ . 1 . ]"
1 36 LEU 3.116 0.320 16 0 "[ . 1 . ]"
1 37 LYS 0.644 0.081 11 0 "[ . 1 . ]"
1 38 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 39 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 40 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 41 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 42 ASP 0.090 0.064 2 0 "[ . 1 . ]"
1 43 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 44 VAL 2.722 0.322 1 0 "[ . 1 . ]"
1 45 LYS 8.388 0.322 1 0 "[ . 1 . ]"
1 46 LYS 0.912 0.251 7 0 "[ . 1 . ]"
1 47 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 48 PHE 4.722 0.314 17 0 "[ . 1 . ]"
1 49 HIS 0.289 0.071 7 0 "[ . 1 . ]"
1 50 MET 0.338 0.071 7 0 "[ . 1 . ]"
1 51 LEU 0.892 0.332 9 0 "[ . 1 . ]"
1 52 ASP 0.076 0.076 8 0 "[ . 1 . ]"
1 53 LYS 0.373 0.080 8 0 "[ . 1 . ]"
1 54 ASP 0.000 0.000 1 0 "[ . 1 . ]"
1 55 LYS 0.000 0.000 1 0 "[ . 1 . ]"
1 56 SER 0.009 0.009 16 0 "[ . 1 . ]"
1 57 GLY 0.009 0.009 16 0 "[ . 1 . ]"
1 58 PHE 1.156 0.109 6 0 "[ . 1 . ]"
1 59 ILE 0.247 0.083 15 0 "[ . 1 . ]"
1 60 GLU 4.185 0.231 16 0 "[ . 1 . ]"
1 61 GLU 3.067 0.549 1 1 "[+ . 1 . ]"
1 62 ASP 0.569 0.267 11 0 "[ . 1 . ]"
1 63 GLU 1.531 0.215 9 0 "[ . 1 . ]"
1 64 LEU 2.629 0.215 9 0 "[ . 1 . ]"
1 65 GLY 3.988 0.549 1 1 "[+ . 1 . ]"
1 66 PHE 0.000 0.000 . 0 "[ . 1 . ]"
1 67 ILE 1.098 0.169 12 0 "[ . 1 . ]"
1 68 LEU 0.812 0.169 12 0 "[ . 1 . ]"
1 69 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 70 GLY 6.715 0.528 12 1 "[ . 1 + . ]"
1 71 PHE 6.965 0.528 12 1 "[ . 1 + . ]"
1 72 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 73 PRO 0.000 0.000 . 0 "[ . 1 . ]"
1 74 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 75 ALA 0.001 0.001 10 0 "[ . 1 . ]"
1 76 ARG 2.824 0.200 9 0 "[ . 1 . ]"
1 77 ASP 0.980 0.250 8 0 "[ . 1 . ]"
1 78 LEU 11.943 0.429 11 0 "[ . 1 . ]"
1 79 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 80 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 81 LYS 3.290 0.264 6 0 "[ . 1 . ]"
1 82 GLU 6.251 0.429 11 0 "[ . 1 . ]"
1 84 LYS 2.483 0.434 18 0 "[ . 1 . ]"
1 85 MET 0.077 0.035 1 0 "[ . 1 . ]"
1 86 LEU 0.272 0.054 17 0 "[ . 1 . ]"
1 87 MET 0.000 0.000 . 0 "[ . 1 . ]"
1 88 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 89 ALA 0.272 0.054 17 0 "[ . 1 . ]"
1 90 GLY 0.031 0.023 1 0 "[ . 1 . ]"
1 91 ASP 1.339 0.148 17 0 "[ . 1 . ]"
1 92 LYS 0.023 0.023 1 0 "[ . 1 . ]"
1 93 ASP 0.669 0.157 1 0 "[ . 1 . ]"
1 94 GLY 0.329 0.157 1 0 "[ . 1 . ]"
1 95 ASP 0.339 0.060 5 0 "[ . 1 . ]"
1 96 GLY 0.000 0.000 . 0 "[ . 1 . ]"
1 97 LYS 3.535 0.231 16 0 "[ . 1 . ]"
1 98 ILE 1.000 0.109 6 0 "[ . 1 . ]"
1 99 GLY 1.578 0.148 17 0 "[ . 1 . ]"
1 100 VAL 3.190 0.216 14 0 "[ . 1 . ]"
1 101 ASP 0.568 0.122 11 0 "[ . 1 . ]"
1 102 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 103 PHE 0.000 0.000 . 0 "[ . 1 . ]"
1 104 SER 0.295 0.046 7 0 "[ . 1 . ]"
1 105 THR 0.873 0.064 17 0 "[ . 1 . ]"
1 106 LEU 2.752 0.420 8 0 "[ . 1 . ]"
1 107 VAL 1.471 0.119 7 0 "[ . 1 . ]"
1 108 ALA 2.047 0.152 15 0 "[ . 1 . ]"
1 109 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 110 SER 0.072 0.045 10 0 "[ . 1 . ]"
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 MET H1 1 1 MET HA . . 5.500 2.638 2.380 2.939 . 0 0 "[ . 1 . ]" 2
2 1 1 MET H1 1 1 MET QB . . 5.500 3.097 2.459 3.413 . 0 0 "[ . 1 . ]" 2
3 1 1 MET H1 1 1 MET QG . . 7.100 3.755 2.027 4.478 . 0 0 "[ . 1 . ]" 2
4 1 1 MET H1 1 2 SER H . . 6.500 3.194 2.027 4.366 . 0 0 "[ . 1 . ]" 2
5 1 1 MET HA 1 2 SER H . . 4.800 3.159 2.157 3.663 . 0 0 "[ . 1 . ]" 2
6 1 1 MET QB 1 2 SER H . . 6.100 2.812 1.984 4.045 . 0 0 "[ . 1 . ]" 2
7 1 1 MET QG 1 2 SER H . . 7.500 3.138 1.764 4.818 . 0 0 "[ . 1 . ]" 2
8 1 2 SER H 1 4 THR H . . 6.500 5.279 4.725 5.884 . 0 0 "[ . 1 . ]" 2
9 1 2 SER H 1 5 ASP H . . 6.300 5.384 4.141 6.322 0.022 3 0 "[ . 1 . ]" 2
10 1 2 SER H 1 5 ASP QB . . 6.800 5.193 3.008 6.068 . 0 0 "[ . 1 . ]" 2
11 1 2 SER HA 1 3 MET H . . 3.700 2.517 2.145 3.541 . 0 0 "[ . 1 . ]" 2
12 1 2 SER HA 1 4 THR H . . 5.900 4.323 3.609 5.153 . 0 0 "[ . 1 . ]" 2
13 1 2 SER HA 1 5 ASP H . . 6.500 4.550 4.062 5.298 . 0 0 "[ . 1 . ]" 2
14 1 2 SER QB 1 3 MET H . . 6.100 3.471 1.822 4.018 . 0 0 "[ . 1 . ]" 2
15 1 2 SER QB 1 4 THR H . . 6.400 4.161 3.293 5.437 . 0 0 "[ . 1 . ]" 2
16 1 2 SER QB 1 5 ASP H . . 7.300 3.564 2.527 5.324 . 0 0 "[ . 1 . ]" 2
17 1 3 MET H 1 4 THR H . . 4.700 3.481 2.773 4.192 . 0 0 "[ . 1 . ]" 2
18 1 3 MET H 1 4 THR HB . . 5.800 4.489 3.949 4.777 . 0 0 "[ . 1 . ]" 2
19 1 3 MET H 1 5 ASP H . . 5.700 4.723 4.271 5.380 . 0 0 "[ . 1 . ]" 2
20 1 3 MET H 1 6 LEU HG . . 6.500 5.666 4.594 6.438 . 0 0 "[ . 1 . ]" 2
21 1 3 MET H 1 50 MET HB2 . . 6.500 5.086 4.278 5.659 . 0 0 "[ . 1 . ]" 2
22 1 3 MET HA 1 4 THR H . . 4.900 2.724 1.987 3.530 . 0 0 "[ . 1 . ]" 2
23 1 3 MET HA 1 5 ASP H . . 6.500 4.094 3.766 4.534 . 0 0 "[ . 1 . ]" 2
24 1 3 MET HA 1 7 LEU H . . 6.500 3.508 2.858 4.126 . 0 0 "[ . 1 . ]" 2
25 1 3 MET QB 1 4 THR H . . 5.600 3.489 2.370 3.995 . 0 0 "[ . 1 . ]" 2
26 1 3 MET QG 1 4 THR H . . 7.500 4.118 2.828 4.833 . 0 0 "[ . 1 . ]" 2
27 1 3 MET QG 1 7 LEU H . . 7.500 4.815 2.951 6.156 . 0 0 "[ . 1 . ]" 2
28 1 4 THR H 1 4 THR MG . . 4.800 3.820 3.603 4.004 . 0 0 "[ . 1 . ]" 2
29 1 4 THR H 1 5 ASP QB . . 7.500 4.228 3.685 4.849 . 0 0 "[ . 1 . ]" 2
30 1 4 THR H 1 6 LEU H . . 5.800 3.434 2.547 4.631 . 0 0 "[ . 1 . ]" 2
31 1 4 THR H 1 7 LEU H . . 5.500 3.700 2.667 5.019 . 0 0 "[ . 1 . ]" 2
32 1 4 THR H 1 7 LEU HG . . 6.500 5.614 3.562 6.546 0.046 8 0 "[ . 1 . ]" 2
33 1 4 THR H 1 12 ILE MD . . 6.900 4.000 3.021 4.667 . 0 0 "[ . 1 . ]" 2
34 1 4 THR HA 1 5 ASP H . . 3.700 3.572 3.533 3.613 . 0 0 "[ . 1 . ]" 2
35 1 4 THR HA 1 6 LEU H . . 5.400 4.978 3.833 5.422 0.022 4 0 "[ . 1 . ]" 2
36 1 4 THR HA 1 7 LEU H . . 6.500 4.648 3.929 5.589 . 0 0 "[ . 1 . ]" 2
37 1 4 THR HA 1 9 ALA H . . 3.000 2.955 2.676 3.043 0.043 11 0 "[ . 1 . ]" 2
38 1 4 THR HB 1 5 ASP H . . 4.900 2.607 2.201 3.192 . 0 0 "[ . 1 . ]" 2
39 1 4 THR MG 1 5 ASP H . . 7.500 3.042 2.602 3.660 . 0 0 "[ . 1 . ]" 2
40 1 4 THR MG 1 9 ALA H . . 5.900 3.332 2.295 4.217 . 0 0 "[ . 1 . ]" 2
41 1 5 ASP H 1 6 LEU H . . 3.400 2.323 2.077 2.649 . 0 0 "[ . 1 . ]" 2
42 1 5 ASP H 1 6 LEU QB . . 5.800 4.157 3.699 4.521 . 0 0 "[ . 1 . ]" 2
43 1 5 ASP H 1 6 LEU MD1 . . 7.500 5.370 4.566 6.253 . 0 0 "[ . 1 . ]" 2
44 1 5 ASP H 1 7 LEU H . . 4.600 3.975 3.524 4.623 0.023 7 0 "[ . 1 . ]" 2
45 1 5 ASP HA 1 6 LEU H . . 4.600 3.533 3.188 3.587 . 0 0 "[ . 1 . ]" 2
46 1 5 ASP QB 1 6 LEU H . . 5.800 2.578 2.169 3.529 . 0 0 "[ . 1 . ]" 2
47 1 6 LEU H 1 6 LEU QB . . 3.700 2.313 2.153 2.455 . 0 0 "[ . 1 . ]" 2
48 1 6 LEU H 1 6 LEU HG . . 5.200 3.038 2.278 4.757 . 0 0 "[ . 1 . ]" 2
49 1 6 LEU H 1 6 LEU MD1 . . 4.000 3.776 3.342 4.271 0.271 11 0 "[ . 1 . ]" 2
50 1 6 LEU H 1 7 LEU H . . 3.300 2.653 2.148 3.003 . 0 0 "[ . 1 . ]" 2
51 1 6 LEU H 1 7 LEU QB . . 5.500 4.680 3.994 4.952 . 0 0 "[ . 1 . ]" 2
52 1 6 LEU H 1 7 LEU HG . . 6.500 5.613 3.967 6.540 0.040 14 0 "[ . 1 . ]" 2
53 1 6 LEU HA 1 7 LEU H . . 5.100 3.551 3.456 3.644 . 0 0 "[ . 1 . ]" 2
54 1 6 LEU QB 1 7 LEU H . . 4.000 2.374 2.032 2.881 . 0 0 "[ . 1 . ]" 2
55 1 6 LEU QB 1 8 ASN H . . 6.500 5.140 4.467 6.084 . 0 0 "[ . 1 . ]" 2
56 1 6 LEU HG 1 7 LEU H . . 6.200 4.507 4.055 4.924 . 0 0 "[ . 1 . ]" 2
57 1 6 LEU MD1 1 46 LYS H . . 7.500 4.588 4.033 5.942 . 0 0 "[ . 1 . ]" 2
58 1 6 LEU MD1 1 47 VAL H . . 6.700 4.610 3.547 6.310 . 0 0 "[ . 1 . ]" 2
59 1 7 LEU H 1 7 LEU HG . . 4.500 3.341 2.155 4.416 . 0 0 "[ . 1 . ]" 2
60 1 7 LEU H 1 7 LEU QD . . 4.000 2.921 2.089 3.473 . 0 0 "[ . 1 . ]" 2
61 1 7 LEU H 1 8 ASN H . . 5.500 3.146 2.218 4.579 . 0 0 "[ . 1 . ]" 2
62 1 7 LEU H 1 12 ILE MD . . 6.100 3.952 3.303 4.444 . 0 0 "[ . 1 . ]" 2
63 1 7 LEU HA 1 8 ASN H . . 3.700 3.336 2.402 3.527 . 0 0 "[ . 1 . ]" 2
64 1 7 LEU HA 1 8 ASN HD21 . . 6.500 5.385 3.380 6.576 0.076 9 0 "[ . 1 . ]" 2
65 1 7 LEU HA 1 8 ASN HD22 . . 6.500 5.996 4.781 6.596 0.096 6 0 "[ . 1 . ]" 2
66 1 7 LEU QB 1 8 ASN H . . 5.000 2.233 1.802 3.782 . 0 0 "[ . 1 . ]" 2
67 1 7 LEU QB 1 12 ILE H . . 7.400 4.381 4.005 5.232 . 0 0 "[ . 1 . ]" 2
68 1 7 LEU HG 1 8 ASN H . . 6.200 4.317 3.068 5.024 . 0 0 "[ . 1 . ]" 2
69 1 7 LEU QD 1 8 ASN H . . 4.900 3.526 2.221 4.470 . 0 0 "[ . 1 . ]" 2
70 1 7 LEU QD 1 36 LEU H . . 5.000 3.691 2.736 4.427 . 0 0 "[ . 1 . ]" 2
71 1 8 ASN H 1 9 ALA H . . 5.800 3.671 3.308 4.286 . 0 0 "[ . 1 . ]" 2
72 1 8 ASN H 1 10 GLU H . . 5.600 5.428 5.102 5.662 0.062 16 0 "[ . 1 . ]" 2
73 1 8 ASN H 1 11 ASP H . . 5.900 4.986 3.715 5.796 . 0 0 "[ . 1 . ]" 2
74 1 8 ASN H 1 11 ASP QB . . 5.900 4.177 3.128 5.133 . 0 0 "[ . 1 . ]" 2
75 1 8 ASN H 1 12 ILE QG . . 7.500 4.886 4.362 6.245 . 0 0 "[ . 1 . ]" 2
76 1 8 ASN H 1 12 ILE MD . . 7.500 2.752 2.208 4.457 . 0 0 "[ . 1 . ]" 2
77 1 8 ASN HA 1 9 ALA H . . 5.200 2.248 2.169 2.308 . 0 0 "[ . 1 . ]" 2
78 1 8 ASN HA 1 10 GLU H . . 6.500 3.909 3.640 4.210 . 0 0 "[ . 1 . ]" 2
79 1 8 ASN HA 1 11 ASP H . . 6.500 4.486 4.296 4.822 . 0 0 "[ . 1 . ]" 2
80 1 8 ASN QB 1 9 ALA H . . 6.300 3.559 3.268 3.926 . 0 0 "[ . 1 . ]" 2
81 1 8 ASN QB 1 10 GLU H . . 6.600 2.980 2.508 3.502 . 0 0 "[ . 1 . ]" 2
82 1 8 ASN QB 1 11 ASP H . . 5.900 2.287 1.980 2.965 . 0 0 "[ . 1 . ]" 2
83 1 9 ALA H 1 9 ALA MB . . 3.400 2.217 2.141 2.261 . 0 0 "[ . 1 . ]" 2
84 1 9 ALA H 1 10 GLU H . . 4.200 2.990 2.680 3.237 . 0 0 "[ . 1 . ]" 2
85 1 9 ALA H 1 10 GLU QB . . 7.300 4.864 4.510 5.287 . 0 0 "[ . 1 . ]" 2
86 1 9 ALA H 1 11 ASP H . . 6.500 4.577 4.260 4.949 . 0 0 "[ . 1 . ]" 2
87 1 9 ALA H 1 12 ILE QG . . 7.500 5.874 5.569 6.529 . 0 0 "[ . 1 . ]" 2
88 1 9 ALA H 1 12 ILE MD . . 7.500 4.257 3.766 5.688 . 0 0 "[ . 1 . ]" 2
89 1 9 ALA HA 1 10 GLU H . . 5.400 3.568 3.481 3.603 . 0 0 "[ . 1 . ]" 2
90 1 9 ALA HA 1 12 ILE H . . 5.400 3.502 3.216 3.767 . 0 0 "[ . 1 . ]" 2
91 1 9 ALA MB 1 10 GLU H . . 3.550 2.662 2.528 2.828 . 0 0 "[ . 1 . ]" 2
92 1 10 GLU H 1 11 ASP H . . 3.500 2.784 2.554 2.968 . 0 0 "[ . 1 . ]" 2
93 1 10 GLU H 1 11 ASP QB . . 7.200 4.820 4.570 5.095 . 0 0 "[ . 1 . ]" 2
94 1 10 GLU H 1 12 ILE H . . 5.300 4.159 3.843 4.464 . 0 0 "[ . 1 . ]" 2
95 1 10 GLU H 1 12 ILE HB . . 6.500 4.806 4.536 5.324 . 0 0 "[ . 1 . ]" 2
96 1 10 GLU H 1 13 LYS H . . 6.500 4.684 4.558 4.965 . 0 0 "[ . 1 . ]" 2
97 1 10 GLU HA 1 11 ASP H . . 4.600 3.551 3.474 3.646 . 0 0 "[ . 1 . ]" 2
98 1 10 GLU HA 1 12 ILE H . . 5.000 4.669 4.398 5.010 0.010 6 0 "[ . 1 . ]" 2
99 1 10 GLU HA 1 13 LYS H . . 5.500 3.516 3.365 3.808 . 0 0 "[ . 1 . ]" 2
100 1 10 GLU HA 1 14 LYS H . . 6.500 4.707 4.297 5.252 . 0 0 "[ . 1 . ]" 2
101 1 10 GLU QB 1 11 ASP H . . 5.200 2.565 2.159 3.621 . 0 0 "[ . 1 . ]" 2
102 1 10 GLU QG 1 11 ASP H . . 7.500 4.100 2.291 4.495 . 0 0 "[ . 1 . ]" 2
103 1 11 ASP H 1 12 ILE H . . 3.600 2.605 2.261 2.860 . 0 0 "[ . 1 . ]" 2
104 1 11 ASP H 1 12 ILE HB . . 4.600 4.397 3.923 4.643 0.043 3 0 "[ . 1 . ]" 2
105 1 11 ASP H 1 12 ILE QG . . 7.500 5.919 5.529 6.334 . 0 0 "[ . 1 . ]" 2
106 1 11 ASP H 1 13 LYS H . . 5.900 4.060 3.674 4.302 . 0 0 "[ . 1 . ]" 2
107 1 11 ASP H 1 13 LYS QG . . 5.800 5.861 5.323 6.056 0.256 4 0 "[ . 1 . ]" 2
108 1 11 ASP H 1 14 LYS H . . 5.900 5.014 4.849 5.425 . 0 0 "[ . 1 . ]" 2
109 1 11 ASP HA 1 12 ILE H . . 5.000 3.586 3.547 3.651 . 0 0 "[ . 1 . ]" 2
110 1 11 ASP HA 1 14 LYS H . . 5.600 3.455 3.167 3.628 . 0 0 "[ . 1 . ]" 2
111 1 11 ASP HA 1 15 ALA H . . 5.300 4.188 4.010 4.402 . 0 0 "[ . 1 . ]" 2
112 1 11 ASP QB 1 12 ILE H . . 5.400 2.634 2.391 3.578 . 0 0 "[ . 1 . ]" 2
113 1 11 ASP QB 1 14 LYS H . . 7.500 4.904 4.700 5.180 . 0 0 "[ . 1 . ]" 2
114 1 12 ILE H 1 12 ILE HB . . 3.300 2.174 2.129 2.222 . 0 0 "[ . 1 . ]" 2
115 1 12 ILE H 1 12 ILE MG . . 4.500 3.581 3.199 3.663 . 0 0 "[ . 1 . ]" 2
116 1 12 ILE H 1 12 ILE MD . . 3.900 2.509 2.331 3.275 . 0 0 "[ . 1 . ]" 2
117 1 12 ILE H 1 13 LYS H . . 4.200 2.920 2.849 2.988 . 0 0 "[ . 1 . ]" 2
118 1 12 ILE H 1 14 LYS H . . 5.000 4.494 4.289 4.924 . 0 0 "[ . 1 . ]" 2
119 1 12 ILE H 1 34 VAL MG1 . . 7.500 5.750 5.589 5.924 . 0 0 "[ . 1 . ]" 2
120 1 12 ILE HA 1 13 LYS H . . 5.000 3.574 3.532 3.599 . 0 0 "[ . 1 . ]" 2
121 1 12 ILE HA 1 14 LYS H . . 6.500 4.427 4.242 4.810 . 0 0 "[ . 1 . ]" 2
122 1 12 ILE HA 1 15 ALA H . . 5.500 3.187 2.974 3.515 . 0 0 "[ . 1 . ]" 2
123 1 12 ILE HA 1 16 VAL H . . 6.500 3.620 3.504 3.878 . 0 0 "[ . 1 . ]" 2
124 1 12 ILE MG 1 72 SER H . . 5.900 4.772 4.419 4.944 . 0 0 "[ . 1 . ]" 2
125 1 13 LYS H 1 13 LYS QG . . 3.500 3.517 2.681 3.846 0.346 5 0 "[ . 1 . ]" 2
126 1 13 LYS H 1 13 LYS QD . . 5.100 4.363 3.921 4.577 . 0 0 "[ . 1 . ]" 2
127 1 13 LYS H 1 14 LYS H . . 3.400 2.906 2.681 3.168 . 0 0 "[ . 1 . ]" 2
128 1 13 LYS H 1 14 LYS QB . . 5.400 4.914 4.662 5.607 0.207 7 0 "[ . 1 . ]" 2
129 1 13 LYS H 1 14 LYS QG . . 7.500 5.118 4.371 6.141 . 0 0 "[ . 1 . ]" 2
130 1 13 LYS H 1 15 ALA H . . 5.100 4.112 3.973 4.207 . 0 0 "[ . 1 . ]" 2
131 1 13 LYS H 1 16 VAL H . . 5.100 4.899 4.810 5.063 . 0 0 "[ . 1 . ]" 2
132 1 13 LYS HA 1 14 LYS H . . 4.200 3.567 3.507 3.612 . 0 0 "[ . 1 . ]" 2
133 1 13 LYS HA 1 15 ALA H . . 5.900 4.469 4.266 4.617 . 0 0 "[ . 1 . ]" 2
134 1 13 LYS HA 1 16 VAL H . . 5.600 3.835 3.526 4.104 . 0 0 "[ . 1 . ]" 2
135 1 13 LYS HA 1 17 GLY H . . 6.300 4.265 3.903 4.662 . 0 0 "[ . 1 . ]" 2
136 1 13 LYS QB 1 14 LYS H . . 5.500 2.918 2.508 3.437 . 0 0 "[ . 1 . ]" 2
137 1 13 LYS QG 1 14 LYS H . . 5.200 3.134 2.312 4.484 . 0 0 "[ . 1 . ]" 2
138 1 13 LYS QG 1 15 ALA H . . 6.500 5.168 4.477 6.133 . 0 0 "[ . 1 . ]" 2
139 1 13 LYS QD 1 14 LYS H . . 7.500 4.383 3.891 4.867 . 0 0 "[ . 1 . ]" 2
140 1 13 LYS QD 1 15 ALA H . . 7.500 6.023 5.311 6.755 . 0 0 "[ . 1 . ]" 2
141 1 14 LYS H 1 14 LYS QD . . 5.700 3.465 2.089 4.169 . 0 0 "[ . 1 . ]" 2
142 1 14 LYS H 1 15 ALA H . . 3.800 2.561 2.392 2.709 . 0 0 "[ . 1 . ]" 2
143 1 14 LYS H 1 16 VAL H . . 5.700 4.549 4.380 4.723 . 0 0 "[ . 1 . ]" 2
144 1 14 LYS H 1 17 GLY H . . 6.100 4.865 4.668 5.138 . 0 0 "[ . 1 . ]" 2
145 1 14 LYS HA 1 15 ALA H . . 4.900 3.528 3.488 3.551 . 0 0 "[ . 1 . ]" 2
146 1 14 LYS HA 1 16 VAL H . . 6.200 4.830 4.716 4.990 . 0 0 "[ . 1 . ]" 2
147 1 14 LYS HA 1 18 ALA H . . 5.200 4.631 4.175 5.246 0.046 5 0 "[ . 1 . ]" 2
148 1 14 LYS QB 1 15 ALA H . . 4.100 2.817 2.643 3.685 . 0 0 "[ . 1 . ]" 2
149 1 14 LYS QB 1 16 VAL H . . 6.500 5.223 5.082 5.600 . 0 0 "[ . 1 . ]" 2
150 1 14 LYS QB 1 18 ALA H . . 6.400 5.200 4.577 5.611 . 0 0 "[ . 1 . ]" 2
151 1 14 LYS QG 1 15 ALA H . . 7.100 4.234 2.505 4.656 . 0 0 "[ . 1 . ]" 2
152 1 15 ALA H 1 16 VAL H . . 4.000 2.991 2.882 3.064 . 0 0 "[ . 1 . ]" 2
153 1 15 ALA H 1 16 VAL MG1 . . 7.500 6.131 5.205 6.246 . 0 0 "[ . 1 . ]" 2
154 1 15 ALA H 1 16 VAL MG2 . . 4.500 4.522 4.100 4.578 0.078 19 0 "[ . 1 . ]" 2
155 1 15 ALA H 1 17 GLY H . . 4.200 4.093 3.980 4.209 0.009 2 0 "[ . 1 . ]" 2
156 1 15 ALA H 1 18 ALA H . . 6.500 4.923 4.578 5.253 . 0 0 "[ . 1 . ]" 2
157 1 15 ALA HA 1 16 VAL H . . 5.500 3.626 3.595 3.664 . 0 0 "[ . 1 . ]" 2
158 1 15 ALA HA 1 18 ALA H . . 5.500 3.500 3.151 3.724 . 0 0 "[ . 1 . ]" 2
159 1 15 ALA MB 1 16 VAL H . . 4.200 2.220 2.058 2.372 . 0 0 "[ . 1 . ]" 2
160 1 15 ALA MB 1 33 MET H . . 7.500 5.237 4.578 5.624 . 0 0 "[ . 1 . ]" 2
161 1 15 ALA MB 1 34 VAL H . . 4.300 3.289 2.781 3.591 . 0 0 "[ . 1 . ]" 2
162 1 16 VAL H 1 16 VAL HB . . 3.700 2.629 2.464 3.724 0.024 15 0 "[ . 1 . ]" 2
163 1 16 VAL H 1 16 VAL MG2 . . 3.400 2.142 2.002 2.254 . 0 0 "[ . 1 . ]" 2
164 1 16 VAL H 1 17 GLY H . . 3.800 2.761 2.693 2.859 . 0 0 "[ . 1 . ]" 2
165 1 16 VAL H 1 18 ALA H . . 6.500 4.179 4.046 4.286 . 0 0 "[ . 1 . ]" 2
166 1 16 VAL HA 1 17 GLY H . . 3.800 3.546 3.505 3.596 . 0 0 "[ . 1 . ]" 2
167 1 16 VAL HB 1 17 GLY H . . 4.000 2.909 2.702 3.732 . 0 0 "[ . 1 . ]" 2
168 1 16 VAL MG1 1 17 GLY H . . 6.500 3.685 3.513 4.283 . 0 0 "[ . 1 . ]" 2
169 1 16 VAL MG1 1 72 SER H . . 6.900 4.660 3.497 5.175 . 0 0 "[ . 1 . ]" 2
170 1 16 VAL MG2 1 17 GLY H . . 5.600 3.917 2.401 4.101 . 0 0 "[ . 1 . ]" 2
171 1 16 VAL MG2 1 18 ALA H . . 7.500 5.209 4.643 5.542 . 0 0 "[ . 1 . ]" 2
172 1 16 VAL MG2 1 19 PHE H . . 7.500 5.392 5.069 5.836 . 0 0 "[ . 1 . ]" 2
173 1 17 GLY H 1 18 ALA H . . 3.600 2.789 2.717 2.873 . 0 0 "[ . 1 . ]" 2
174 1 17 GLY H 1 18 ALA MB . . 5.200 4.371 4.337 4.403 . 0 0 "[ . 1 . ]" 2
175 1 17 GLY H 1 19 PHE HB2 . . 6.500 6.127 5.802 6.425 . 0 0 "[ . 1 . ]" 2
176 1 17 GLY HA2 1 18 ALA H . . 4.500 3.514 3.406 3.609 . 0 0 "[ . 1 . ]" 2
177 1 17 GLY HA2 1 19 PHE H . . 6.500 4.689 3.883 5.187 . 0 0 "[ . 1 . ]" 2
178 1 17 GLY HA3 1 18 ALA H . . 4.600 3.139 2.748 3.306 . 0 0 "[ . 1 . ]" 2
179 1 17 GLY HA3 1 19 PHE H . . 6.500 5.161 4.486 5.654 . 0 0 "[ . 1 . ]" 2
180 1 18 ALA H 1 18 ALA MB . . 3.400 2.237 2.191 2.304 . 0 0 "[ . 1 . ]" 2
181 1 18 ALA H 1 19 PHE H . . 3.300 2.576 2.253 2.918 . 0 0 "[ . 1 . ]" 2
182 1 18 ALA H 1 19 PHE HB2 . . 6.500 4.779 4.345 5.319 . 0 0 "[ . 1 . ]" 2
183 1 18 ALA H 1 19 PHE QD . . 8.500 5.249 4.538 5.767 . 0 0 "[ . 1 . ]" 2
184 1 18 ALA H 1 19 PHE QE . . 8.500 6.687 6.216 7.099 . 0 0 "[ . 1 . ]" 2
185 1 18 ALA H 1 20 SER H . . 4.700 3.687 3.438 4.198 . 0 0 "[ . 1 . ]" 2
186 1 18 ALA HA 1 19 PHE H . . 4.700 3.586 3.463 3.651 . 0 0 "[ . 1 . ]" 2
187 1 18 ALA HA 1 20 SER H . . 6.500 4.202 3.813 4.640 . 0 0 "[ . 1 . ]" 2
188 1 18 ALA MB 1 19 PHE H . . 3.700 2.587 2.176 3.092 . 0 0 "[ . 1 . ]" 2
189 1 19 PHE H 1 19 PHE HB2 . . 4.400 2.468 2.255 2.697 . 0 0 "[ . 1 . ]" 2
190 1 19 PHE H 1 19 PHE HB3 . . 3.900 3.664 3.548 3.816 . 0 0 "[ . 1 . ]" 2
191 1 19 PHE H 1 19 PHE QE . . 6.700 5.116 4.686 5.520 . 0 0 "[ . 1 . ]" 2
192 1 19 PHE H 1 20 SER H . . 3.500 2.528 2.095 2.786 . 0 0 "[ . 1 . ]" 2
193 1 19 PHE H 1 20 SER QB . . 7.300 4.358 3.931 4.801 . 0 0 "[ . 1 . ]" 2
194 1 19 PHE HA 1 20 SER H . . 4.300 3.469 3.248 3.628 . 0 0 "[ . 1 . ]" 2
195 1 19 PHE HA 1 21 ALA H . . 6.000 3.955 3.521 4.296 . 0 0 "[ . 1 . ]" 2
196 1 19 PHE HB2 1 20 SER H . . 6.000 3.372 3.029 3.857 . 0 0 "[ . 1 . ]" 2
197 1 19 PHE HB3 1 20 SER H . . 4.600 4.090 3.711 4.382 . 0 0 "[ . 1 . ]" 2
198 1 19 PHE HB3 1 24 SER H . . 6.500 6.869 6.475 6.994 0.494 11 0 "[ . 1 . ]" 2
199 1 19 PHE HB3 1 25 PHE H . . 6.500 6.487 5.092 6.918 0.418 2 0 "[ . 1 . ]" 2
200 1 19 PHE QD 1 24 SER H . . 8.500 6.595 5.929 7.441 . 0 0 "[ . 1 . ]" 2
201 1 19 PHE QD 1 25 PHE H . . 8.500 5.306 4.370 6.044 . 0 0 "[ . 1 . ]" 2
202 1 19 PHE QD 1 27 HIS H . . 8.500 4.775 4.089 5.868 . 0 0 "[ . 1 . ]" 2
203 1 19 PHE QD 1 30 PHE H . . 8.500 5.069 4.083 5.661 . 0 0 "[ . 1 . ]" 2
204 1 19 PHE QE 1 20 SER H . . 8.500 6.867 6.714 7.011 . 0 0 "[ . 1 . ]" 2
205 1 19 PHE QE 1 27 HIS H . . 8.500 2.936 2.320 4.178 . 0 0 "[ . 1 . ]" 2
206 1 19 PHE HZ 1 29 LYS H . . 6.500 6.509 6.149 6.685 0.185 5 0 "[ . 1 . ]" 2
207 1 20 SER H 1 21 ALA H . . 4.000 3.737 3.583 3.911 . 0 0 "[ . 1 . ]" 2
208 1 20 SER H 1 21 ALA MB . . 7.500 4.356 4.092 4.644 . 0 0 "[ . 1 . ]" 2
209 1 20 SER HA 1 21 ALA H . . 5.300 2.479 2.269 2.757 . 0 0 "[ . 1 . ]" 2
210 1 20 SER QB 1 21 ALA H . . 5.400 3.971 3.838 4.065 . 0 0 "[ . 1 . ]" 2
211 1 21 ALA H 1 21 ALA MB . . 3.400 2.611 2.462 2.701 . 0 0 "[ . 1 . ]" 2
212 1 21 ALA H 1 22 THR H . . 5.200 4.152 2.446 4.458 . 0 0 "[ . 1 . ]" 2
213 1 21 ALA H 1 24 SER QB . . 7.500 4.669 4.105 5.039 . 0 0 "[ . 1 . ]" 2
214 1 21 ALA H 1 76 ARG QG . . 6.500 6.117 5.261 6.603 0.103 1 0 "[ . 1 . ]" 2
215 1 21 ALA HA 1 22 THR H . . 4.100 2.732 2.423 2.976 . 0 0 "[ . 1 . ]" 2
216 1 21 ALA MB 1 22 THR H . . 5.100 2.299 1.916 3.673 . 0 0 "[ . 1 . ]" 2
217 1 21 ALA MB 1 24 SER H . . 4.100 2.944 2.494 3.449 . 0 0 "[ . 1 . ]" 2
218 1 22 THR H 1 22 THR MG . . 3.700 2.729 2.407 3.122 . 0 0 "[ . 1 . ]" 2
219 1 22 THR H 1 23 ASP H . . 5.500 3.571 2.748 4.357 . 0 0 "[ . 1 . ]" 2
220 1 22 THR HA 1 23 ASP H . . 4.100 2.911 2.048 3.531 . 0 0 "[ . 1 . ]" 2
221 1 22 THR HA 1 24 SER H . . 6.200 4.312 3.554 4.996 . 0 0 "[ . 1 . ]" 2
222 1 22 THR HA 1 79 SER H . . 4.200 3.225 2.575 3.662 . 0 0 "[ . 1 . ]" 2
223 1 22 THR HB 1 23 ASP H . . 6.000 3.118 1.987 3.839 . 0 0 "[ . 1 . ]" 2
224 1 22 THR HB 1 79 SER H . . 6.500 4.426 4.064 5.131 . 0 0 "[ . 1 . ]" 2
225 1 22 THR MG 1 23 ASP H . . 7.500 3.842 3.543 4.256 . 0 0 "[ . 1 . ]" 2
226 1 22 THR MG 1 24 SER H . . 7.100 5.197 5.005 5.608 . 0 0 "[ . 1 . ]" 2
227 1 23 ASP H 1 24 SER H . . 4.100 2.638 2.081 3.476 . 0 0 "[ . 1 . ]" 2
228 1 23 ASP H 1 25 PHE H . . 6.500 4.974 4.445 5.691 . 0 0 "[ . 1 . ]" 2
229 1 23 ASP H 1 25 PHE QB . . 7.500 5.598 4.354 6.521 . 0 0 "[ . 1 . ]" 2
230 1 23 ASP H 1 78 LEU HA . . 6.500 5.749 4.443 6.513 0.013 6 0 "[ . 1 . ]" 2
231 1 23 ASP H 1 79 SER H . . 6.400 4.109 2.796 4.961 . 0 0 "[ . 1 . ]" 2
232 1 23 ASP H 1 79 SER QB . . 7.500 3.103 2.092 4.042 . 0 0 "[ . 1 . ]" 2
233 1 23 ASP H 1 81 LYS QG . . 5.800 5.964 5.708 6.064 0.264 6 0 "[ . 1 . ]" 2
234 1 23 ASP H 1 82 GLU QB . . 7.500 3.668 2.287 4.605 . 0 0 "[ . 1 . ]" 2
235 1 23 ASP HA 1 24 SER H . . 4.600 3.180 2.590 3.461 . 0 0 "[ . 1 . ]" 2
236 1 23 ASP HA 1 25 PHE H . . 6.100 3.759 3.334 4.525 . 0 0 "[ . 1 . ]" 2
237 1 23 ASP HA 1 79 SER H . . 5.400 4.200 3.582 5.104 . 0 0 "[ . 1 . ]" 2
238 1 23 ASP HA 1 82 GLU H . . 4.600 3.397 2.984 4.075 . 0 0 "[ . 1 . ]" 2
239 1 23 ASP QB 1 24 SER H . . 6.200 3.651 3.261 4.010 . 0 0 "[ . 1 . ]" 2
240 1 23 ASP QB 1 25 PHE H . . 6.900 4.636 4.339 5.127 . 0 0 "[ . 1 . ]" 2
241 1 24 SER H 1 25 PHE H . . 3.900 3.189 2.212 3.935 0.035 17 0 "[ . 1 . ]" 2
242 1 24 SER H 1 25 PHE HA . . 6.500 4.725 3.937 5.309 . 0 0 "[ . 1 . ]" 2
243 1 24 SER H 1 25 PHE QB . . 7.500 4.554 3.836 4.936 . 0 0 "[ . 1 . ]" 2
244 1 24 SER H 1 25 PHE QD . . 8.500 5.891 4.816 6.585 . 0 0 "[ . 1 . ]" 2
245 1 24 SER H 1 82 GLU QG . . 7.500 3.949 2.794 5.500 . 0 0 "[ . 1 . ]" 2
246 1 24 SER HA 1 25 PHE H . . 4.800 2.811 2.232 3.586 . 0 0 "[ . 1 . ]" 2
247 1 24 SER QB 1 25 PHE H . . 7.500 3.694 2.429 4.010 . 0 0 "[ . 1 . ]" 2
248 1 24 SER QB 1 26 ASP H . . 7.500 5.183 4.019 6.222 . 0 0 "[ . 1 . ]" 2
249 1 25 PHE H 1 78 LEU MD2 . . 7.500 5.896 4.221 7.318 . 0 0 "[ . 1 . ]" 2
250 1 25 PHE H 1 82 GLU QB . . 6.900 4.645 3.356 5.467 . 0 0 "[ . 1 . ]" 2
251 1 25 PHE H 1 82 GLU QG . . 7.200 3.162 2.538 5.598 . 0 0 "[ . 1 . ]" 2
252 1 25 PHE HA 1 27 HIS H . . 6.200 4.610 3.979 5.484 . 0 0 "[ . 1 . ]" 2
253 1 25 PHE QB 1 27 HIS H . . 6.800 4.219 3.541 4.747 . 0 0 "[ . 1 . ]" 2
254 1 25 PHE QD 1 29 LYS H . . 8.500 7.102 6.485 7.445 . 0 0 "[ . 1 . ]" 2
255 1 25 PHE QE 1 27 HIS H . . 8.500 3.632 2.896 4.678 . 0 0 "[ . 1 . ]" 2
256 1 27 HIS H 1 27 HIS HB2 . . 4.200 3.331 2.086 3.683 . 0 0 "[ . 1 . ]" 2
257 1 27 HIS H 1 28 LYS H . . 4.700 3.049 2.675 3.624 . 0 0 "[ . 1 . ]" 2
258 1 27 HIS H 1 28 LYS QB . . 7.500 5.066 4.226 5.582 . 0 0 "[ . 1 . ]" 2
259 1 27 HIS H 1 28 LYS QG . . 6.500 4.859 3.477 6.046 . 0 0 "[ . 1 . ]" 2
260 1 27 HIS H 1 28 LYS QE . . 7.500 4.374 2.548 6.747 . 0 0 "[ . 1 . ]" 2
261 1 27 HIS H 1 29 LYS H . . 6.400 4.522 4.149 4.874 . 0 0 "[ . 1 . ]" 2
262 1 27 HIS H 1 30 PHE H . . 6.500 4.697 4.538 4.952 . 0 0 "[ . 1 . ]" 2
263 1 27 HIS H 1 30 PHE QB . . 7.500 4.341 4.021 4.717 . 0 0 "[ . 1 . ]" 2
264 1 27 HIS H 1 31 PHE H . . 6.500 5.952 5.846 6.149 . 0 0 "[ . 1 . ]" 2
265 1 27 HIS H 1 86 LEU QD . . 6.300 5.006 3.753 5.864 . 0 0 "[ . 1 . ]" 2
266 1 27 HIS HA 1 28 LYS H . . 6.000 3.490 3.385 3.592 . 0 0 "[ . 1 . ]" 2
267 1 27 HIS HA 1 29 LYS H . . 6.500 4.496 3.852 5.015 . 0 0 "[ . 1 . ]" 2
268 1 27 HIS HA 1 30 PHE H . . 6.500 3.534 3.022 3.933 . 0 0 "[ . 1 . ]" 2
269 1 27 HIS HB2 1 31 PHE H . . 6.500 5.003 4.135 6.077 . 0 0 "[ . 1 . ]" 2
270 1 27 HIS HB3 1 28 LYS H . . 4.400 3.695 2.528 4.143 . 0 0 "[ . 1 . ]" 2
271 1 28 LYS H 1 28 LYS QG . . 3.400 2.565 1.872 3.395 . 0 0 "[ . 1 . ]" 2
272 1 28 LYS H 1 28 LYS QD . . 5.400 2.735 1.730 4.555 . 0 0 "[ . 1 . ]" 2
273 1 28 LYS H 1 28 LYS QE . . 7.000 3.283 1.983 4.668 . 0 0 "[ . 1 . ]" 2
274 1 28 LYS H 1 29 LYS H . . 3.800 2.913 2.667 3.233 . 0 0 "[ . 1 . ]" 2
275 1 28 LYS H 1 30 PHE H . . 5.900 4.260 4.010 4.560 . 0 0 "[ . 1 . ]" 2
276 1 28 LYS H 1 30 PHE QB . . 7.500 4.664 4.433 4.944 . 0 0 "[ . 1 . ]" 2
277 1 28 LYS H 1 31 PHE H . . 6.500 4.790 4.650 5.060 . 0 0 "[ . 1 . ]" 2
278 1 28 LYS H 1 31 PHE HB3 . . 6.500 6.761 6.431 7.107 0.607 9 3 "[ . +1 .* - ]" 2
279 1 28 LYS HA 1 29 LYS H . . 4.200 3.586 3.444 3.710 . 0 0 "[ . 1 . ]" 2
280 1 28 LYS HA 1 30 PHE H . . 5.500 4.824 4.556 5.041 . 0 0 "[ . 1 . ]" 2
281 1 28 LYS HA 1 31 PHE H . . 5.800 3.988 3.659 4.569 . 0 0 "[ . 1 . ]" 2
282 1 28 LYS HA 1 32 GLN H . . 4.700 4.420 3.909 4.789 0.089 9 0 "[ . 1 . ]" 2
283 1 28 LYS HA 1 32 GLN HE21 . . 6.500 3.500 2.856 5.619 . 0 0 "[ . 1 . ]" 2
284 1 28 LYS HA 1 110 SER H . . 5.300 4.895 4.163 5.345 0.045 10 0 "[ . 1 . ]" 2
285 1 28 LYS QB 1 29 LYS H . . 6.800 2.685 2.002 3.669 . 0 0 "[ . 1 . ]" 2
286 1 28 LYS QB 1 30 PHE H . . 7.500 4.819 4.146 5.463 . 0 0 "[ . 1 . ]" 2
287 1 28 LYS QB 1 31 PHE H . . 7.500 5.251 5.119 5.461 . 0 0 "[ . 1 . ]" 2
288 1 28 LYS QB 1 32 GLN H . . 7.500 5.199 4.699 5.552 . 0 0 "[ . 1 . ]" 2
289 1 28 LYS QB 1 32 GLN HE21 . . 7.500 3.113 2.591 4.977 . 0 0 "[ . 1 . ]" 2
290 1 28 LYS QB 1 32 GLN HE22 . . 7.500 3.044 2.307 4.614 . 0 0 "[ . 1 . ]" 2
291 1 28 LYS QG 1 30 PHE H . . 6.200 5.472 4.223 6.301 0.101 10 0 "[ . 1 . ]" 2
292 1 28 LYS QG 1 110 SER H . . 6.500 4.005 2.621 5.110 . 0 0 "[ . 1 . ]" 2
293 1 28 LYS QG 1 108 ALA H . . 6.500 5.891 4.582 6.652 0.152 15 0 "[ . 1 . ]" 2
294 1 28 LYS QD 1 29 LYS H . . 6.500 3.451 2.126 5.291 . 0 0 "[ . 1 . ]" 2
295 1 28 LYS QE 1 29 LYS H . . 7.500 3.851 2.118 5.046 . 0 0 "[ . 1 . ]" 2
296 1 28 LYS QE 1 30 PHE H . . 6.800 5.696 4.501 6.111 . 0 0 "[ . 1 . ]" 2
297 1 29 LYS H 1 29 LYS QB . . 3.700 2.161 1.908 2.563 . 0 0 "[ . 1 . ]" 2
298 1 29 LYS H 1 29 LYS QD . . 5.100 4.133 2.658 4.614 . 0 0 "[ . 1 . ]" 2
299 1 29 LYS H 1 29 LYS QE . . 6.100 4.961 3.559 5.546 . 0 0 "[ . 1 . ]" 2
300 1 29 LYS H 1 30 PHE H . . 4.400 2.574 2.242 2.872 . 0 0 "[ . 1 . ]" 2
301 1 29 LYS H 1 31 PHE H . . 6.500 4.341 3.846 4.654 . 0 0 "[ . 1 . ]" 2
302 1 29 LYS H 1 32 GLN H . . 6.500 4.750 4.554 4.946 . 0 0 "[ . 1 . ]" 2
303 1 29 LYS H 1 32 GLN HE21 . . 6.500 4.819 4.014 6.079 . 0 0 "[ . 1 . ]" 2
304 1 29 LYS HA 1 30 PHE H . . 4.000 3.575 3.532 3.621 . 0 0 "[ . 1 . ]" 2
305 1 29 LYS HA 1 31 PHE H . . 6.500 4.739 4.548 4.963 . 0 0 "[ . 1 . ]" 2
306 1 29 LYS HA 1 32 GLN H . . 6.500 3.433 3.113 3.598 . 0 0 "[ . 1 . ]" 2
307 1 29 LYS QB 1 30 PHE H . . 3.600 2.588 2.407 2.951 . 0 0 "[ . 1 . ]" 2
308 1 29 LYS QB 1 31 PHE H . . 6.500 5.003 4.781 5.274 . 0 0 "[ . 1 . ]" 2
309 1 29 LYS QB 1 33 MET H . . 6.000 4.679 3.993 5.089 . 0 0 "[ . 1 . ]" 2
310 1 30 PHE H 1 31 PHE H . . 3.900 3.032 2.918 3.165 . 0 0 "[ . 1 . ]" 2
311 1 30 PHE H 1 31 PHE QD . . 8.500 4.967 4.539 5.777 . 0 0 "[ . 1 . ]" 2
312 1 30 PHE H 1 32 GLN H . . 5.700 4.189 4.025 4.358 . 0 0 "[ . 1 . ]" 2
313 1 30 PHE H 1 32 GLN QB . . 6.100 4.956 4.751 5.201 . 0 0 "[ . 1 . ]" 2
314 1 30 PHE H 1 33 MET H . . 5.200 4.714 4.621 4.829 . 0 0 "[ . 1 . ]" 2
315 1 30 PHE HA 1 31 PHE H . . 4.800 3.633 3.611 3.653 . 0 0 "[ . 1 . ]" 2
316 1 30 PHE HA 1 32 GLN H . . 5.600 4.392 4.154 4.693 . 0 0 "[ . 1 . ]" 2
317 1 30 PHE QB 1 31 PHE H . . 5.800 2.331 2.221 2.429 . 0 0 "[ . 1 . ]" 2
318 1 30 PHE QD 1 31 PHE H . . 8.500 2.970 2.704 3.581 . 0 0 "[ . 1 . ]" 2
319 1 31 PHE H 1 31 PHE HB2 . . 3.700 2.205 2.080 2.296 . 0 0 "[ . 1 . ]" 2
320 1 31 PHE H 1 31 PHE HB3 . . 4.100 3.493 3.341 3.559 . 0 0 "[ . 1 . ]" 2
321 1 31 PHE H 1 32 GLN H . . 3.500 2.813 2.757 2.879 . 0 0 "[ . 1 . ]" 2
322 1 31 PHE H 1 32 GLN QB . . 6.000 4.738 4.611 4.898 . 0 0 "[ . 1 . ]" 2
323 1 31 PHE H 1 33 MET H . . 4.600 4.507 4.254 4.614 0.014 11 0 "[ . 1 . ]" 2
324 1 31 PHE H 1 34 VAL H . . 5.100 4.841 4.777 4.920 . 0 0 "[ . 1 . ]" 2
325 1 31 PHE H 1 34 VAL MG1 . . 7.500 3.980 3.769 4.232 . 0 0 "[ . 1 . ]" 2
326 1 31 PHE H 1 37 LYS QE . . 7.500 5.599 4.829 6.507 . 0 0 "[ . 1 . ]" 2
327 1 31 PHE HA 1 32 GLN H . . 5.400 3.527 3.445 3.601 . 0 0 "[ . 1 . ]" 2
328 1 31 PHE HA 1 34 VAL H . . 6.500 3.806 3.519 3.915 . 0 0 "[ . 1 . ]" 2
329 1 31 PHE HA 1 35 GLY H . . 6.500 4.543 3.994 4.773 . 0 0 "[ . 1 . ]" 2
330 1 31 PHE HA 1 36 LEU H . . 4.200 3.195 3.045 3.402 . 0 0 "[ . 1 . ]" 2
331 1 31 PHE HB2 1 32 GLN H . . 4.500 3.148 2.878 3.362 . 0 0 "[ . 1 . ]" 2
332 1 31 PHE HB2 1 36 LEU H . . 6.500 5.532 5.174 5.889 . 0 0 "[ . 1 . ]" 2
333 1 31 PHE HB3 1 32 GLN H . . 4.800 3.463 3.099 3.819 . 0 0 "[ . 1 . ]" 2
334 1 31 PHE HB3 1 36 LEU H . . 6.500 4.317 3.801 4.713 . 0 0 "[ . 1 . ]" 2
335 1 31 PHE HB3 1 37 LYS H . . 6.500 3.057 2.673 3.366 . 0 0 "[ . 1 . ]" 2
336 1 31 PHE QD 1 32 GLN H . . 8.500 4.702 4.572 4.836 . 0 0 "[ . 1 . ]" 2
337 1 31 PHE QD 1 36 LEU H . . 8.500 4.616 4.231 4.954 . 0 0 "[ . 1 . ]" 2
338 1 31 PHE QD 1 110 SER H . . 8.500 7.643 7.588 7.693 . 0 0 "[ . 1 . ]" 2
339 1 31 PHE QE 1 32 GLN H . . 8.500 6.805 6.683 6.916 . 0 0 "[ . 1 . ]" 2
340 1 32 GLN H 1 33 MET H . . 4.000 2.642 2.474 2.820 . 0 0 "[ . 1 . ]" 2
341 1 32 GLN H 1 34 VAL H . . 5.500 4.128 3.820 4.439 . 0 0 "[ . 1 . ]" 2
342 1 32 GLN H 1 34 VAL MG1 . . 7.500 4.093 3.742 4.516 . 0 0 "[ . 1 . ]" 2
343 1 32 GLN H 1 37 LYS QB . . 7.500 5.196 4.762 6.152 . 0 0 "[ . 1 . ]" 2
344 1 32 GLN H 1 37 LYS QG . . 7.500 5.349 4.829 6.134 . 0 0 "[ . 1 . ]" 2
345 1 32 GLN H 1 37 LYS QE . . 7.500 4.297 3.897 4.794 . 0 0 "[ . 1 . ]" 2
346 1 32 GLN HA 1 33 MET H . . 4.800 3.600 3.516 3.636 . 0 0 "[ . 1 . ]" 2
347 1 32 GLN HA 1 34 VAL H . . 5.600 4.716 4.540 4.977 . 0 0 "[ . 1 . ]" 2
348 1 32 GLN HA 1 35 GLY H . . 5.000 3.619 3.458 3.766 . 0 0 "[ . 1 . ]" 2
349 1 32 GLN HA 1 36 LEU H . . 5.900 4.402 4.039 4.799 . 0 0 "[ . 1 . ]" 2
350 1 32 GLN HA 1 37 LYS H . . 4.500 4.521 4.394 4.581 0.081 11 0 "[ . 1 . ]" 2
351 1 32 GLN QB 1 33 MET H . . 5.200 2.488 2.371 2.740 . 0 0 "[ . 1 . ]" 2
352 1 33 MET H 1 33 MET HG2 . . 3.800 3.339 2.314 4.410 0.610 14 1 "[ . 1 +. ]" 2
353 1 33 MET H 1 33 MET HG3 . . 4.600 2.985 2.265 4.085 . 0 0 "[ . 1 . ]" 2
354 1 33 MET H 1 34 VAL H . . 4.300 2.815 2.734 2.894 . 0 0 "[ . 1 . ]" 2
355 1 33 MET H 1 34 VAL HB . . 5.100 4.962 4.861 5.055 . 0 0 "[ . 1 . ]" 2
356 1 33 MET H 1 34 VAL MG1 . . 7.500 4.193 3.886 4.509 . 0 0 "[ . 1 . ]" 2
357 1 33 MET H 1 34 VAL MG2 . . 7.500 6.029 5.953 6.100 . 0 0 "[ . 1 . ]" 2
358 1 33 MET H 1 35 GLY H . . 6.500 3.900 3.654 4.141 . 0 0 "[ . 1 . ]" 2
359 1 33 MET H 1 37 LYS QE . . 7.200 6.221 5.863 6.492 . 0 0 "[ . 1 . ]" 2
360 1 33 MET HA 1 34 VAL H . . 4.300 3.574 3.549 3.646 . 0 0 "[ . 1 . ]" 2
361 1 33 MET HA 1 35 GLY H . . 4.600 3.769 3.611 4.051 . 0 0 "[ . 1 . ]" 2
362 1 33 MET QB 1 34 VAL H . . 5.800 2.587 2.412 2.735 . 0 0 "[ . 1 . ]" 2
363 1 33 MET QB 1 35 GLY H . . 7.500 4.370 4.210 4.465 . 0 0 "[ . 1 . ]" 2
364 1 34 VAL H 1 34 VAL HB . . 3.400 2.304 2.246 2.380 . 0 0 "[ . 1 . ]" 2
365 1 34 VAL H 1 35 GLY H . . 3.700 2.657 2.556 2.761 . 0 0 "[ . 1 . ]" 2
366 1 34 VAL H 1 35 GLY QA . . 5.700 4.503 4.406 4.592 . 0 0 "[ . 1 . ]" 2
367 1 34 VAL H 1 36 LEU H . . 6.500 4.025 3.863 4.169 . 0 0 "[ . 1 . ]" 2
368 1 34 VAL H 1 36 LEU HG . . 6.200 5.796 5.517 6.270 0.070 16 0 "[ . 1 . ]" 2
369 1 34 VAL HA 1 35 GLY H . . 4.700 3.426 3.350 3.549 . 0 0 "[ . 1 . ]" 2
370 1 34 VAL HB 1 35 GLY H . . 4.500 4.172 4.058 4.247 . 0 0 "[ . 1 . ]" 2
371 1 34 VAL HB 1 36 LEU H . . 6.200 4.414 4.217 4.622 . 0 0 "[ . 1 . ]" 2
372 1 34 VAL MG1 1 35 GLY H . . 4.900 2.804 2.403 3.039 . 0 0 "[ . 1 . ]" 2
373 1 34 VAL MG1 1 36 LEU H . . 3.700 1.877 1.674 2.090 . 0 0 "[ . 1 . ]" 2
374 1 34 VAL MG1 1 37 LYS H . . 7.500 3.891 3.766 4.087 . 0 0 "[ . 1 . ]" 2
375 1 34 VAL MG2 1 35 GLY H . . 5.900 4.310 4.136 4.398 . 0 0 "[ . 1 . ]" 2
376 1 34 VAL MG2 1 36 LEU H . . 6.000 3.879 3.510 4.241 . 0 0 "[ . 1 . ]" 2
377 1 35 GLY H 1 36 LEU H . . 3.400 2.831 2.551 2.996 . 0 0 "[ . 1 . ]" 2
378 1 35 GLY H 1 36 LEU QB . . 7.500 4.564 4.207 4.853 . 0 0 "[ . 1 . ]" 2
379 1 35 GLY H 1 36 LEU HG . . 6.300 5.607 5.049 6.122 . 0 0 "[ . 1 . ]" 2
380 1 35 GLY H 1 37 LYS QE . . 7.500 6.413 6.074 6.706 . 0 0 "[ . 1 . ]" 2
381 1 35 GLY H 1 38 LYS QG . . 7.500 5.491 4.547 6.057 . 0 0 "[ . 1 . ]" 2
382 1 35 GLY QA 1 36 LEU H . . 4.400 2.892 2.770 2.963 . 0 0 "[ . 1 . ]" 2
383 1 35 GLY QA 1 38 LYS H . . 6.500 3.234 2.927 3.434 . 0 0 "[ . 1 . ]" 2
384 1 35 GLY QA 1 37 LYS H . . 6.000 4.241 3.885 4.567 . 0 0 "[ . 1 . ]" 2
385 1 36 LEU H 1 36 LEU HG . . 3.800 3.245 2.873 3.790 . 0 0 "[ . 1 . ]" 2
386 1 36 LEU H 1 36 LEU MD1 . . 3.600 3.753 3.545 3.920 0.320 16 0 "[ . 1 . ]" 2
387 1 36 LEU H 1 37 LYS H . . 3.900 2.886 2.590 3.193 . 0 0 "[ . 1 . ]" 2
388 1 36 LEU H 1 37 LYS QG . . 6.300 5.159 4.588 5.654 . 0 0 "[ . 1 . ]" 2
389 1 36 LEU H 1 37 LYS QE . . 7.500 5.832 5.405 6.446 . 0 0 "[ . 1 . ]" 2
390 1 36 LEU H 1 38 LYS H . . 5.500 3.868 3.541 4.086 . 0 0 "[ . 1 . ]" 2
391 1 36 LEU H 1 39 LYS QD . . 7.200 5.858 4.607 6.481 . 0 0 "[ . 1 . ]" 2
392 1 36 LEU HA 1 37 LYS H . . 4.400 3.442 3.387 3.543 . 0 0 "[ . 1 . ]" 2
393 1 36 LEU HA 1 38 LYS H . . 5.600 3.832 3.707 4.108 . 0 0 "[ . 1 . ]" 2
394 1 36 LEU QB 1 37 LYS H . . 6.800 2.204 1.972 2.417 . 0 0 "[ . 1 . ]" 2
395 1 36 LEU QB 1 39 LYS H . . 5.800 4.750 4.610 4.925 . 0 0 "[ . 1 . ]" 2
396 1 37 LYS H 1 37 LYS QB . . 3.500 2.394 2.137 2.585 . 0 0 "[ . 1 . ]" 2
397 1 37 LYS H 1 37 LYS QG . . 4.800 2.778 2.342 3.753 . 0 0 "[ . 1 . ]" 2
398 1 37 LYS H 1 37 LYS QE . . 7.000 4.122 3.659 4.543 . 0 0 "[ . 1 . ]" 2
399 1 37 LYS H 1 38 LYS H . . 3.800 2.988 2.807 3.119 . 0 0 "[ . 1 . ]" 2
400 1 37 LYS H 1 38 LYS QG . . 7.500 5.524 4.356 6.054 . 0 0 "[ . 1 . ]" 2
401 1 37 LYS H 1 39 LYS H . . 4.500 4.271 4.132 4.338 . 0 0 "[ . 1 . ]" 2
402 1 37 LYS H 1 47 VAL QG . . 7.500 5.639 5.586 5.673 . 0 0 "[ . 1 . ]" 2
403 1 37 LYS HA 1 38 LYS H . . 4.200 3.485 3.332 3.530 . 0 0 "[ . 1 . ]" 2
404 1 37 LYS HA 1 39 LYS H . . 6.500 4.008 3.630 4.248 . 0 0 "[ . 1 . ]" 2
405 1 37 LYS QG 1 39 LYS H . . 6.500 5.545 4.804 5.812 . 0 0 "[ . 1 . ]" 2
406 1 37 LYS QG 1 110 SER H . . 7.500 6.682 6.491 6.775 . 0 0 "[ . 1 . ]" 2
407 1 37 LYS QD 1 108 ALA H . . 7.100 3.382 3.050 4.089 . 0 0 "[ . 1 . ]" 2
408 1 37 LYS QD 1 110 SER H . . 7.500 5.241 4.542 5.824 . 0 0 "[ . 1 . ]" 2
409 1 37 LYS QE 1 110 SER H . . 7.500 5.581 4.281 6.298 . 0 0 "[ . 1 . ]" 2
410 1 38 LYS H 1 38 LYS HB2 . . 4.000 3.405 2.624 3.633 . 0 0 "[ . 1 . ]" 2
411 1 38 LYS H 1 38 LYS HB3 . . 3.800 2.537 2.134 3.729 . 0 0 "[ . 1 . ]" 2
412 1 38 LYS H 1 38 LYS QG . . 4.800 3.100 2.438 3.515 . 0 0 "[ . 1 . ]" 2
413 1 38 LYS H 1 38 LYS QD . . 5.000 4.035 3.783 4.491 . 0 0 "[ . 1 . ]" 2
414 1 38 LYS H 1 39 LYS H . . 3.000 2.253 2.151 2.362 . 0 0 "[ . 1 . ]" 2
415 1 38 LYS H 1 39 LYS QB . . 7.500 4.142 3.755 4.538 . 0 0 "[ . 1 . ]" 2
416 1 38 LYS H 1 39 LYS QD . . 7.500 5.065 3.950 6.222 . 0 0 "[ . 1 . ]" 2
417 1 39 LYS H 1 39 LYS QG . . 5.000 3.158 2.252 4.079 . 0 0 "[ . 1 . ]" 2
418 1 39 LYS H 1 39 LYS QD . . 5.900 3.718 2.709 4.431 . 0 0 "[ . 1 . ]" 2
419 1 39 LYS H 1 39 LYS QE . . 5.900 4.504 3.038 5.301 . 0 0 "[ . 1 . ]" 2
420 1 39 LYS H 1 40 SER H . . 5.400 4.551 4.501 4.621 . 0 0 "[ . 1 . ]" 2
421 1 39 LYS HA 1 40 SER H . . 4.400 2.472 2.339 2.661 . 0 0 "[ . 1 . ]" 2
422 1 39 LYS QG 1 40 SER H . . 6.300 3.458 2.154 4.472 . 0 0 "[ . 1 . ]" 2
423 1 40 SER H 1 41 ALA H . . 5.700 4.663 4.617 4.714 . 0 0 "[ . 1 . ]" 2
424 1 40 SER H 1 42 ASP H . . 6.500 5.372 5.079 5.764 . 0 0 "[ . 1 . ]" 2
425 1 40 SER H 1 43 ASP H . . 6.200 3.966 3.723 4.282 . 0 0 "[ . 1 . ]" 2
426 1 40 SER H 1 43 ASP QB . . 4.800 2.591 2.269 3.002 . 0 0 "[ . 1 . ]" 2
427 1 40 SER H 1 44 VAL MG1 . . 7.500 7.003 6.670 7.487 . 0 0 "[ . 1 . ]" 2
428 1 40 SER HA 1 41 ALA H . . 4.100 2.346 2.287 2.409 . 0 0 "[ . 1 . ]" 2
429 1 40 SER HA 1 42 ASP H . . 6.100 4.310 3.985 4.652 . 0 0 "[ . 1 . ]" 2
430 1 40 SER HA 1 43 ASP H . . 6.500 4.428 4.174 4.724 . 0 0 "[ . 1 . ]" 2
431 1 40 SER QB 1 41 ALA H . . 6.700 2.988 2.330 3.420 . 0 0 "[ . 1 . ]" 2
432 1 40 SER QB 1 42 ASP H . . 7.500 2.913 2.420 3.382 . 0 0 "[ . 1 . ]" 2
433 1 40 SER QB 1 43 ASP H . . 7.500 2.491 1.998 2.867 . 0 0 "[ . 1 . ]" 2
434 1 41 ALA H 1 41 ALA MB . . 3.400 2.200 2.153 2.231 . 0 0 "[ . 1 . ]" 2
435 1 41 ALA H 1 42 ASP H . . 4.000 2.769 2.556 2.943 . 0 0 "[ . 1 . ]" 2
436 1 41 ALA H 1 42 ASP QB . . 7.500 4.624 4.259 4.967 . 0 0 "[ . 1 . ]" 2
437 1 41 ALA H 1 43 ASP H . . 6.200 4.041 3.845 4.275 . 0 0 "[ . 1 . ]" 2
438 1 41 ALA H 1 44 VAL H . . 6.300 4.809 4.689 5.054 . 0 0 "[ . 1 . ]" 2
439 1 41 ALA H 1 44 VAL HB . . 6.500 4.878 4.569 5.871 . 0 0 "[ . 1 . ]" 2
440 1 41 ALA H 1 44 VAL MG2 . . 7.500 5.223 4.267 6.297 . 0 0 "[ . 1 . ]" 2
441 1 41 ALA HA 1 42 ASP H . . 4.200 3.584 3.532 3.620 . 0 0 "[ . 1 . ]" 2
442 1 41 ALA HA 1 43 ASP H . . 6.000 4.094 3.796 4.475 . 0 0 "[ . 1 . ]" 2
443 1 41 ALA HA 1 44 VAL H . . 4.500 3.430 3.276 3.590 . 0 0 "[ . 1 . ]" 2
444 1 41 ALA HA 1 45 LYS H . . 6.500 4.277 3.787 4.783 . 0 0 "[ . 1 . ]" 2
445 1 41 ALA MB 1 42 ASP H . . 3.400 2.451 2.294 2.593 . 0 0 "[ . 1 . ]" 2
446 1 41 ALA MB 1 43 ASP H . . 5.200 4.336 4.232 4.408 . 0 0 "[ . 1 . ]" 2
447 1 41 ALA MB 1 45 LYS H . . 6.200 4.698 4.289 5.122 . 0 0 "[ . 1 . ]" 2
448 1 42 ASP H 1 43 ASP H . . 3.300 2.691 2.541 2.867 . 0 0 "[ . 1 . ]" 2
449 1 42 ASP H 1 44 VAL H . . 4.600 4.398 4.184 4.604 0.004 19 0 "[ . 1 . ]" 2
450 1 42 ASP H 1 44 VAL MG1 . . 7.500 5.624 4.902 6.686 . 0 0 "[ . 1 . ]" 2
451 1 42 ASP H 1 45 LYS H . . 5.000 4.811 4.603 5.064 0.064 2 0 "[ . 1 . ]" 2
452 1 42 ASP HA 1 43 ASP H . . 4.200 3.485 3.364 3.539 . 0 0 "[ . 1 . ]" 2
453 1 42 ASP HA 1 44 VAL H . . 6.500 4.687 4.373 4.880 . 0 0 "[ . 1 . ]" 2
454 1 42 ASP HA 1 45 LYS H . . 5.600 3.383 3.115 3.671 . 0 0 "[ . 1 . ]" 2
455 1 42 ASP QB 1 43 ASP H . . 5.200 2.997 2.525 3.445 . 0 0 "[ . 1 . ]" 2
456 1 42 ASP QB 1 44 VAL H . . 7.500 5.096 4.906 5.406 . 0 0 "[ . 1 . ]" 2
457 1 43 ASP H 1 43 ASP QB . . 3.400 2.272 2.122 2.401 . 0 0 "[ . 1 . ]" 2
458 1 43 ASP H 1 44 VAL H . . 3.700 2.538 2.209 2.789 . 0 0 "[ . 1 . ]" 2
459 1 43 ASP H 1 44 VAL HA . . 6.500 5.161 4.885 5.405 . 0 0 "[ . 1 . ]" 2
460 1 43 ASP H 1 44 VAL HB . . 6.500 4.193 3.692 4.950 . 0 0 "[ . 1 . ]" 2
461 1 43 ASP H 1 44 VAL MG2 . . 5.600 4.729 3.802 5.472 . 0 0 "[ . 1 . ]" 2
462 1 43 ASP H 1 45 LYS H . . 6.300 3.882 3.636 4.079 . 0 0 "[ . 1 . ]" 2
463 1 43 ASP H 1 46 LYS H . . 6.400 4.891 4.663 5.201 . 0 0 "[ . 1 . ]" 2
464 1 43 ASP H 1 46 LYS QG . . 7.500 6.378 5.119 6.744 . 0 0 "[ . 1 . ]" 2
465 1 43 ASP H 1 46 LYS QD . . 7.500 4.837 4.311 6.100 . 0 0 "[ . 1 . ]" 2
466 1 43 ASP HA 1 44 VAL H . . 5.000 3.606 3.562 3.669 . 0 0 "[ . 1 . ]" 2
467 1 43 ASP HA 1 45 LYS H . . 6.500 4.314 4.069 4.529 . 0 0 "[ . 1 . ]" 2
468 1 43 ASP HA 1 46 LYS H . . 5.500 3.385 3.064 3.689 . 0 0 "[ . 1 . ]" 2
469 1 43 ASP QB 1 44 VAL H . . 4.500 2.376 2.198 2.588 . 0 0 "[ . 1 . ]" 2
470 1 44 VAL H 1 44 VAL HB . . 3.700 2.125 1.990 2.816 . 0 0 "[ . 1 . ]" 2
471 1 44 VAL H 1 44 VAL MG1 . . 4.200 3.508 2.933 3.641 . 0 0 "[ . 1 . ]" 2
472 1 44 VAL H 1 44 VAL MG2 . . 3.900 2.695 1.878 3.528 . 0 0 "[ . 1 . ]" 2
473 1 44 VAL H 1 45 LYS H . . 4.900 2.933 2.860 3.058 . 0 0 "[ . 1 . ]" 2
474 1 44 VAL H 1 45 LYS QB . . 4.500 4.574 4.367 4.822 0.322 1 0 "[ . 1 . ]" 2
475 1 44 VAL H 1 45 LYS QG . . 5.900 5.749 4.807 6.071 0.171 9 0 "[ . 1 . ]" 2
476 1 44 VAL H 1 46 LYS QB . . 6.200 5.419 5.125 5.693 . 0 0 "[ . 1 . ]" 2
477 1 44 VAL H 1 47 VAL H . . 4.900 4.636 4.510 4.757 . 0 0 "[ . 1 . ]" 2
478 1 44 VAL H 1 47 VAL QG . . 4.500 3.725 3.467 4.027 . 0 0 "[ . 1 . ]" 2
479 1 44 VAL HA 1 45 LYS H . . 5.500 3.550 3.468 3.619 . 0 0 "[ . 1 . ]" 2
480 1 44 VAL HA 1 46 LYS H . . 6.500 4.351 3.985 4.750 . 0 0 "[ . 1 . ]" 2
481 1 44 VAL HA 1 47 VAL H . . 5.300 3.199 2.973 3.512 . 0 0 "[ . 1 . ]" 2
482 1 44 VAL HB 1 45 LYS H . . 4.500 3.159 2.802 3.861 . 0 0 "[ . 1 . ]" 2
483 1 44 VAL MG1 1 45 LYS H . . 7.500 2.932 2.497 3.816 . 0 0 "[ . 1 . ]" 2
484 1 44 VAL MG1 1 46 LYS H . . 7.500 5.002 4.682 5.517 . 0 0 "[ . 1 . ]" 2
485 1 44 VAL MG1 1 102 GLU H . . 7.500 5.961 5.415 6.450 . 0 0 "[ . 1 . ]" 2
486 1 45 LYS H 1 45 LYS QB . . 3.600 2.097 1.974 2.313 . 0 0 "[ . 1 . ]" 2
487 1 45 LYS H 1 45 LYS QG . . 3.900 3.294 2.474 3.676 . 0 0 "[ . 1 . ]" 2
488 1 45 LYS H 1 46 LYS H . . 4.000 2.891 2.717 3.100 . 0 0 "[ . 1 . ]" 2
489 1 45 LYS H 1 46 LYS HA . . 6.200 5.551 5.432 5.674 . 0 0 "[ . 1 . ]" 2
490 1 45 LYS H 1 46 LYS QB . . 4.900 4.872 4.676 5.151 0.251 7 0 "[ . 1 . ]" 2
491 1 45 LYS H 1 46 LYS QG . . 7.500 5.647 4.416 6.211 . 0 0 "[ . 1 . ]" 2
492 1 45 LYS H 1 47 VAL H . . 5.300 4.063 3.935 4.173 . 0 0 "[ . 1 . ]" 2
493 1 45 LYS H 1 48 PHE H . . 5.200 5.063 4.732 5.273 0.073 11 0 "[ . 1 . ]" 2
494 1 45 LYS HA 1 48 PHE H . . 6.500 3.975 3.555 4.437 . 0 0 "[ . 1 . ]" 2
495 1 45 LYS QB 1 46 LYS H . . 5.800 2.770 2.411 3.075 . 0 0 "[ . 1 . ]" 2
496 1 45 LYS QG 1 48 PHE H . . 5.400 5.629 5.285 5.714 0.314 17 0 "[ . 1 . ]" 2
497 1 46 LYS H 1 46 LYS QB . . 3.900 2.365 2.143 2.573 . 0 0 "[ . 1 . ]" 2
498 1 46 LYS H 1 46 LYS QD . . 6.200 2.692 2.068 4.158 . 0 0 "[ . 1 . ]" 2
499 1 46 LYS H 1 48 PHE H . . 5.900 4.654 4.391 4.922 . 0 0 "[ . 1 . ]" 2
500 1 46 LYS HA 1 49 HIS H . . 6.500 3.376 3.171 3.655 . 0 0 "[ . 1 . ]" 2
501 1 46 LYS QB 1 47 VAL H . . 4.000 2.878 2.643 3.258 . 0 0 "[ . 1 . ]" 2
502 1 47 VAL H 1 47 VAL HB . . 3.500 2.523 2.387 2.661 . 0 0 "[ . 1 . ]" 2
503 1 47 VAL H 1 48 PHE H . . 3.700 3.104 2.957 3.302 . 0 0 "[ . 1 . ]" 2
504 1 47 VAL H 1 48 PHE QB . . 7.500 4.473 4.304 4.642 . 0 0 "[ . 1 . ]" 2
505 1 47 VAL H 1 50 MET H . . 6.500 5.038 4.738 5.376 . 0 0 "[ . 1 . ]" 2
506 1 47 VAL HA 1 48 PHE H . . 5.300 3.674 3.618 3.723 . 0 0 "[ . 1 . ]" 2
507 1 47 VAL HB 1 48 PHE H . . 3.700 2.328 2.181 2.489 . 0 0 "[ . 1 . ]" 2
508 1 47 VAL QG 1 48 PHE H . . 5.100 2.899 2.624 3.116 . 0 0 "[ . 1 . ]" 2
509 1 48 PHE H 1 49 HIS H . . 4.200 2.980 2.806 3.161 . 0 0 "[ . 1 . ]" 2
510 1 48 PHE H 1 50 MET H . . 4.600 4.372 4.197 4.649 0.049 4 0 "[ . 1 . ]" 2
511 1 48 PHE H 1 51 LEU H . . 6.200 5.266 4.898 5.552 . 0 0 "[ . 1 . ]" 2
512 1 48 PHE H 1 103 PHE QE . . 8.500 5.461 3.051 6.497 . 0 0 "[ . 1 . ]" 2
513 1 48 PHE HA 1 49 HIS H . . 5.200 3.582 3.528 3.641 . 0 0 "[ . 1 . ]" 2
514 1 48 PHE HA 1 50 MET H . . 5.200 3.986 3.682 4.392 . 0 0 "[ . 1 . ]" 2
515 1 48 PHE HA 1 51 LEU H . . 5.800 3.513 3.083 3.809 . 0 0 "[ . 1 . ]" 2
516 1 48 PHE HA 1 52 ASP H . . 5.300 4.294 3.729 5.195 . 0 0 "[ . 1 . ]" 2
517 1 48 PHE QD 1 52 ASP H . . 8.500 4.732 4.119 5.412 . 0 0 "[ . 1 . ]" 2
518 1 48 PHE QD 1 100 VAL H . . 8.500 3.541 3.356 3.916 . 0 0 "[ . 1 . ]" 2
519 1 48 PHE QD 1 103 PHE H . . 8.400 5.550 5.038 6.121 . 0 0 "[ . 1 . ]" 2
520 1 48 PHE QE 1 57 GLY H . . 8.500 4.223 2.830 5.086 . 0 0 "[ . 1 . ]" 2
521 1 48 PHE QE 1 58 PHE H . . 8.500 4.110 3.674 4.571 . 0 0 "[ . 1 . ]" 2
522 1 48 PHE QE 1 59 ILE H . . 8.500 2.854 2.556 3.295 . 0 0 "[ . 1 . ]" 2
523 1 48 PHE QE 1 100 VAL H . . 8.500 3.487 2.997 3.838 . 0 0 "[ . 1 . ]" 2
524 1 48 PHE QE 1 101 ASP H . . 8.500 6.115 5.692 6.663 . 0 0 "[ . 1 . ]" 2
525 1 48 PHE QE 1 103 PHE H . . 8.500 6.083 5.345 6.720 . 0 0 "[ . 1 . ]" 2
526 1 48 PHE HZ 1 100 VAL H . . 6.500 4.039 3.445 5.046 . 0 0 "[ . 1 . ]" 2
527 1 49 HIS H 1 50 MET H . . 4.100 2.880 2.723 2.944 . 0 0 "[ . 1 . ]" 2
528 1 49 HIS H 1 50 MET HB2 . . 5.100 4.905 4.584 5.166 0.066 18 0 "[ . 1 . ]" 2
529 1 49 HIS H 1 50 MET HB3 . . 5.500 5.442 5.297 5.571 0.071 7 0 "[ . 1 . ]" 2
530 1 49 HIS H 1 50 MET QG . . 7.400 6.480 5.965 6.634 . 0 0 "[ . 1 . ]" 2
531 1 49 HIS HA 1 50 MET H . . 5.700 3.510 3.365 3.587 . 0 0 "[ . 1 . ]" 2
532 1 50 MET H 1 50 MET HB2 . . 3.700 2.371 2.193 2.705 . 0 0 "[ . 1 . ]" 2
533 1 50 MET H 1 50 MET HB3 . . 4.100 2.715 2.590 2.942 . 0 0 "[ . 1 . ]" 2
534 1 50 MET HA 1 51 LEU H . . 5.200 3.524 3.422 3.617 . 0 0 "[ . 1 . ]" 2
535 1 50 MET HA 1 52 ASP H . . 6.500 4.548 4.121 4.898 . 0 0 "[ . 1 . ]" 2
536 1 50 MET HB2 1 51 LEU H . . 4.700 3.818 3.500 3.995 . 0 0 "[ . 1 . ]" 2
537 1 50 MET HB2 1 52 ASP H . . 6.500 5.804 5.500 6.011 . 0 0 "[ . 1 . ]" 2
538 1 50 MET HB3 1 51 LEU H . . 6.500 2.874 2.573 3.212 . 0 0 "[ . 1 . ]" 2
539 1 50 MET QG 1 51 LEU H . . 6.700 4.212 3.793 4.678 . 0 0 "[ . 1 . ]" 2
540 1 50 MET QG 1 52 ASP H . . 7.500 5.848 5.524 6.129 . 0 0 "[ . 1 . ]" 2
541 1 51 LEU H 1 51 LEU HB2 . . 3.500 2.567 2.318 3.629 0.129 8 0 "[ . 1 . ]" 2
542 1 51 LEU H 1 51 LEU HB3 . . 4.200 3.539 3.115 3.625 . 0 0 "[ . 1 . ]" 2
543 1 51 LEU H 1 51 LEU HG . . 4.000 3.126 1.915 4.058 0.058 5 0 "[ . 1 . ]" 2
544 1 51 LEU H 1 52 ASP H . . 3.500 2.475 2.204 2.643 . 0 0 "[ . 1 . ]" 2
545 1 51 LEU H 1 52 ASP QB . . 6.900 4.162 3.865 4.595 . 0 0 "[ . 1 . ]" 2
546 1 51 LEU H 1 59 ILE MD . . 6.200 4.180 3.904 4.801 . 0 0 "[ . 1 . ]" 2
547 1 51 LEU HA 1 52 ASP H . . 4.600 3.566 3.497 3.641 . 0 0 "[ . 1 . ]" 2
548 1 51 LEU HB2 1 52 ASP H . . 3.500 2.616 2.313 3.576 0.076 8 0 "[ . 1 . ]" 2
549 1 51 LEU HB3 1 52 ASP H . . 5.800 3.666 3.349 4.282 . 0 0 "[ . 1 . ]" 2
550 1 51 LEU HB3 1 71 PHE H . . 6.500 6.100 4.410 6.832 0.332 9 0 "[ . 1 . ]" 2
551 1 51 LEU HG 1 52 ASP H . . 5.300 4.446 2.353 5.214 . 0 0 "[ . 1 . ]" 2
552 1 51 LEU QD 1 52 ASP H . . 8.600 3.695 3.295 4.091 . 0 0 "[ . 1 . ]" 2
553 1 51 LEU QD 1 53 LYS H . . 8.900 5.634 5.208 6.334 . 0 0 "[ . 1 . ]" 2
554 1 51 LEU QD 1 70 GLY H . . 8.900 3.822 2.791 5.311 . 0 0 "[ . 1 . ]" 2
555 1 51 LEU QD 1 71 PHE H . . 8.900 3.458 2.677 4.615 . 0 0 "[ . 1 . ]" 2
556 1 52 ASP H 1 53 LYS H . . 5.500 4.006 3.587 4.520 . 0 0 "[ . 1 . ]" 2
557 1 52 ASP H 1 59 ILE QG . . 7.500 3.516 3.192 4.044 . 0 0 "[ . 1 . ]" 2
558 1 52 ASP H 1 59 ILE MD . . 6.100 3.514 2.770 4.131 . 0 0 "[ . 1 . ]" 2
559 1 52 ASP HA 1 53 LYS H . . 3.700 2.309 2.079 2.636 . 0 0 "[ . 1 . ]" 2
560 1 52 ASP HA 1 54 ASP H . . 6.500 3.628 3.215 4.050 . 0 0 "[ . 1 . ]" 2
561 1 52 ASP HA 1 55 LYS H . . 6.500 4.163 3.591 4.838 . 0 0 "[ . 1 . ]" 2
562 1 52 ASP HA 1 56 SER H . . 6.300 5.064 4.501 5.934 . 0 0 "[ . 1 . ]" 2
563 1 52 ASP HA 1 59 ILE H . . 6.500 5.689 5.005 6.216 . 0 0 "[ . 1 . ]" 2
564 1 52 ASP HA 1 60 GLU H . . 6.500 5.483 5.109 5.839 . 0 0 "[ . 1 . ]" 2
565 1 52 ASP QB 1 53 LYS H . . 7.500 4.018 3.885 4.089 . 0 0 "[ . 1 . ]" 2
566 1 52 ASP QB 1 58 PHE H . . 7.400 3.980 3.533 4.658 . 0 0 "[ . 1 . ]" 2
567 1 53 LYS H 1 53 LYS QD . . 5.500 4.129 3.515 4.734 . 0 0 "[ . 1 . ]" 2
568 1 53 LYS H 1 53 LYS QE . . 7.400 4.546 2.988 5.237 . 0 0 "[ . 1 . ]" 2
569 1 53 LYS H 1 54 ASP H . . 4.100 2.876 2.435 3.328 . 0 0 "[ . 1 . ]" 2
570 1 53 LYS H 1 55 LYS H . . 6.500 4.217 3.595 4.710 . 0 0 "[ . 1 . ]" 2
571 1 53 LYS H 1 59 ILE MD . . 7.500 5.322 3.777 5.998 . 0 0 "[ . 1 . ]" 2
572 1 53 LYS H 1 63 GLU HA . . 5.400 5.316 5.047 5.480 0.080 8 0 "[ . 1 . ]" 2
573 1 53 LYS H 1 63 GLU QB . . 6.500 3.619 2.838 4.139 . 0 0 "[ . 1 . ]" 2
574 1 53 LYS H 1 63 GLU QG . . 7.500 2.715 1.970 3.372 . 0 0 "[ . 1 . ]" 2
575 1 53 LYS H 1 66 PHE QD . . 8.500 7.331 6.756 7.600 . 0 0 "[ . 1 . ]" 2
576 1 53 LYS HA 1 54 ASP H . . 5.100 3.250 2.528 3.559 . 0 0 "[ . 1 . ]" 2
577 1 53 LYS HA 1 55 LYS H . . 5.300 4.039 3.532 4.763 . 0 0 "[ . 1 . ]" 2
578 1 53 LYS QB 1 54 ASP H . . 4.000 3.341 2.498 3.922 . 0 0 "[ . 1 . ]" 2
579 1 53 LYS QB 1 55 LYS H . . 6.500 4.905 4.274 5.636 . 0 0 "[ . 1 . ]" 2
580 1 53 LYS QG 1 54 ASP H . . 7.300 4.111 2.303 4.854 . 0 0 "[ . 1 . ]" 2
581 1 53 LYS QD 1 54 ASP H . . 7.500 5.106 3.695 5.719 . 0 0 "[ . 1 . ]" 2
582 1 53 LYS QD 1 55 LYS H . . 7.500 6.535 5.682 6.754 . 0 0 "[ . 1 . ]" 2
583 1 53 LYS QE 1 54 ASP H . . 7.100 5.339 4.421 6.112 . 0 0 "[ . 1 . ]" 2
584 1 54 ASP H 1 54 ASP HB2 . . 4.300 3.645 2.575 4.095 . 0 0 "[ . 1 . ]" 2
585 1 54 ASP H 1 54 ASP HB3 . . 4.200 2.960 2.487 3.645 . 0 0 "[ . 1 . ]" 2
586 1 54 ASP H 1 55 LYS H . . 3.400 2.269 1.894 2.893 . 0 0 "[ . 1 . ]" 2
587 1 54 ASP H 1 55 LYS HA . . 5.100 4.324 3.482 5.100 0.000 1 0 "[ . 1 . ]" 2
588 1 54 ASP H 1 55 LYS QG . . 6.200 4.750 3.589 5.625 . 0 0 "[ . 1 . ]" 2
589 1 54 ASP H 1 55 LYS QD . . 7.000 5.545 4.428 6.268 . 0 0 "[ . 1 . ]" 2
590 1 54 ASP H 1 56 SER H . . 5.400 4.096 3.459 4.760 . 0 0 "[ . 1 . ]" 2
591 1 54 ASP H 1 63 GLU QG . . 7.500 3.886 2.594 5.104 . 0 0 "[ . 1 . ]" 2
592 1 54 ASP HA 1 55 LYS H . . 4.900 3.445 3.285 3.563 . 0 0 "[ . 1 . ]" 2
593 1 54 ASP HA 1 56 SER H . . 6.500 4.911 4.291 5.896 . 0 0 "[ . 1 . ]" 2
594 1 54 ASP HB2 1 55 LYS H . . 6.500 4.070 2.931 4.437 . 0 0 "[ . 1 . ]" 2
595 1 54 ASP HB2 1 56 SER H . . 6.500 4.194 2.136 5.820 . 0 0 "[ . 1 . ]" 2
596 1 54 ASP HB3 1 55 LYS H . . 6.500 4.096 2.858 4.429 . 0 0 "[ . 1 . ]" 2
597 1 54 ASP HB3 1 56 SER H . . 6.500 4.696 2.833 6.187 . 0 0 "[ . 1 . ]" 2
598 1 55 LYS H 1 56 SER H . . 3.700 2.692 2.104 3.140 . 0 0 "[ . 1 . ]" 2
599 1 55 LYS H 1 57 GLY H . . 6.500 4.329 3.720 4.722 . 0 0 "[ . 1 . ]" 2
600 1 55 LYS H 1 58 PHE H . . 6.500 5.681 5.147 6.082 . 0 0 "[ . 1 . ]" 2
601 1 55 LYS HA 1 56 SER H . . 4.100 2.819 2.208 3.345 . 0 0 "[ . 1 . ]" 2
602 1 55 LYS HA 1 57 GLY H . . 5.100 3.382 3.054 3.854 . 0 0 "[ . 1 . ]" 2
603 1 55 LYS HA 1 58 PHE H . . 6.500 5.427 4.910 5.861 . 0 0 "[ . 1 . ]" 2
604 1 55 LYS QB 1 56 SER H . . 6.900 3.879 3.507 4.099 . 0 0 "[ . 1 . ]" 2
605 1 55 LYS QG 1 56 SER H . . 7.500 4.648 3.958 4.979 . 0 0 "[ . 1 . ]" 2
606 1 55 LYS QD 1 56 SER H . . 7.500 5.186 3.947 6.095 . 0 0 "[ . 1 . ]" 2
607 1 56 SER H 1 57 GLY H . . 3.800 2.516 1.938 3.251 . 0 0 "[ . 1 . ]" 2
608 1 56 SER H 1 57 GLY HA2 . . 6.500 4.840 4.216 5.657 . 0 0 "[ . 1 . ]" 2
609 1 56 SER H 1 57 GLY HA3 . . 5.800 5.230 4.714 5.809 0.009 16 0 "[ . 1 . ]" 2
610 1 56 SER H 1 58 PHE H . . 5.500 3.835 3.383 4.350 . 0 0 "[ . 1 . ]" 2
611 1 56 SER HA 1 57 GLY H . . 4.800 3.456 3.385 3.528 . 0 0 "[ . 1 . ]" 2
612 1 56 SER HA 1 58 PHE H . . 5.200 4.731 4.334 5.135 . 0 0 "[ . 1 . ]" 2
613 1 56 SER QB 1 57 GLY H . . 6.100 3.730 2.653 3.979 . 0 0 "[ . 1 . ]" 2
614 1 56 SER QB 1 58 PHE H . . 7.500 3.841 2.508 4.448 . 0 0 "[ . 1 . ]" 2
615 1 57 GLY H 1 58 PHE H . . 3.400 2.384 2.008 2.642 . 0 0 "[ . 1 . ]" 2
616 1 57 GLY H 1 58 PHE QD . . 8.500 4.631 4.012 5.445 . 0 0 "[ . 1 . ]" 2
617 1 57 GLY HA2 1 58 PHE H . . 4.600 3.155 2.932 3.356 . 0 0 "[ . 1 . ]" 2
618 1 57 GLY HA3 1 58 PHE H . . 5.000 3.435 3.320 3.570 . 0 0 "[ . 1 . ]" 2
619 1 58 PHE H 1 59 ILE H . . 5.900 4.186 3.922 4.492 . 0 0 "[ . 1 . ]" 2
620 1 58 PHE H 1 59 ILE HA . . 5.800 4.615 4.435 4.880 . 0 0 "[ . 1 . ]" 2
621 1 58 PHE HA 1 59 ILE H . . 3.700 2.266 2.158 2.357 . 0 0 "[ . 1 . ]" 2
622 1 58 PHE HA 1 98 ILE H . . 4.600 4.649 4.540 4.709 0.109 6 0 "[ . 1 . ]" 2
623 1 58 PHE HA 1 100 VAL H . . 5.700 5.403 5.145 5.707 0.007 6 0 "[ . 1 . ]" 2
624 1 58 PHE QB 1 59 ILE H . . 4.300 3.282 2.740 3.654 . 0 0 "[ . 1 . ]" 2
625 1 58 PHE QB 1 98 ILE H . . 6.500 4.599 4.066 4.947 . 0 0 "[ . 1 . ]" 2
626 1 58 PHE QB 1 60 GLU H . . 5.200 4.959 4.525 5.269 0.069 4 0 "[ . 1 . ]" 2
627 1 58 PHE QD 1 59 ILE H . . 8.500 4.438 3.949 4.953 . 0 0 "[ . 1 . ]" 2
628 1 58 PHE QD 1 98 ILE H . . 8.500 5.493 4.541 6.304 . 0 0 "[ . 1 . ]" 2
629 1 58 PHE QD 1 99 GLY H . . 8.500 5.442 4.393 6.222 . 0 0 "[ . 1 . ]" 2
630 1 58 PHE QD 1 100 VAL H . . 8.500 6.056 5.470 6.444 . 0 0 "[ . 1 . ]" 2
631 1 59 ILE H 1 59 ILE HB . . 3.900 2.495 2.166 2.831 . 0 0 "[ . 1 . ]" 2
632 1 59 ILE H 1 59 ILE MD . . 5.100 3.599 3.252 4.299 . 0 0 "[ . 1 . ]" 2
633 1 59 ILE H 1 60 GLU H . . 6.500 4.470 4.263 4.569 . 0 0 "[ . 1 . ]" 2
634 1 59 ILE H 1 60 GLU HA . . 6.500 5.384 5.084 5.558 . 0 0 "[ . 1 . ]" 2
635 1 59 ILE H 1 97 LYS HA . . 5.000 4.387 3.732 4.860 . 0 0 "[ . 1 . ]" 2
636 1 59 ILE H 1 97 LYS QB . . 5.900 3.010 2.458 3.630 . 0 0 "[ . 1 . ]" 2
637 1 59 ILE H 1 97 LYS QD . . 6.500 5.519 3.716 6.227 . 0 0 "[ . 1 . ]" 2
638 1 59 ILE H 1 98 ILE H . . 4.300 3.082 2.807 3.351 . 0 0 "[ . 1 . ]" 2
639 1 59 ILE H 1 98 ILE HB . . 6.200 3.309 2.639 3.670 . 0 0 "[ . 1 . ]" 2
640 1 59 ILE H 1 99 GLY H . . 5.300 5.223 4.985 5.383 0.083 15 0 "[ . 1 . ]" 2
641 1 59 ILE H 1 103 PHE QE . . 8.500 7.516 6.756 7.683 . 0 0 "[ . 1 . ]" 2
642 1 59 ILE HA 1 60 GLU H . . 3.300 2.081 1.991 2.147 . 0 0 "[ . 1 . ]" 2
643 1 59 ILE HB 1 60 GLU H . . 4.800 4.100 3.882 4.507 . 0 0 "[ . 1 . ]" 2
644 1 59 ILE HB 1 98 ILE H . . 5.200 3.061 2.712 3.713 . 0 0 "[ . 1 . ]" 2
645 1 59 ILE MG 1 60 GLU H . . 6.100 2.604 2.387 3.164 . 0 0 "[ . 1 . ]" 2
646 1 59 ILE MG 1 63 GLU H . . 7.400 3.970 3.694 4.704 . 0 0 "[ . 1 . ]" 2
647 1 59 ILE MG 1 64 LEU H . . 7.500 3.090 2.829 3.395 . 0 0 "[ . 1 . ]" 2
648 1 59 ILE MG 1 98 ILE H . . 6.900 3.860 2.766 4.453 . 0 0 "[ . 1 . ]" 2
649 1 59 ILE QG 1 60 GLU H . . 7.500 4.014 3.153 4.291 . 0 0 "[ . 1 . ]" 2
650 1 59 ILE QG 1 64 LEU H . . 7.400 5.549 3.988 6.194 . 0 0 "[ . 1 . ]" 2
651 1 59 ILE QG 1 98 ILE H . . 7.500 4.795 4.145 5.305 . 0 0 "[ . 1 . ]" 2
652 1 59 ILE MD 1 60 GLU H . . 6.100 5.062 4.583 5.152 . 0 0 "[ . 1 . ]" 2
653 1 59 ILE MD 1 98 ILE H . . 7.500 4.473 4.101 5.344 . 0 0 "[ . 1 . ]" 2
654 1 60 GLU H 1 61 GLU H . . 6.000 4.455 4.400 4.574 . 0 0 "[ . 1 . ]" 2
655 1 60 GLU H 1 62 ASP QB . . 7.500 4.580 4.077 4.902 . 0 0 "[ . 1 . ]" 2
656 1 60 GLU H 1 63 GLU H . . 5.000 3.527 3.081 3.916 . 0 0 "[ . 1 . ]" 2
657 1 60 GLU H 1 63 GLU QB . . 5.600 2.908 2.530 3.217 . 0 0 "[ . 1 . ]" 2
658 1 60 GLU H 1 63 GLU QG . . 7.500 4.319 3.858 4.897 . 0 0 "[ . 1 . ]" 2
659 1 60 GLU H 1 64 LEU HG . . 6.500 6.468 5.835 6.605 0.105 7 0 "[ . 1 . ]" 2
660 1 60 GLU H 1 97 LYS HA . . 5.300 5.347 5.113 5.400 0.100 13 0 "[ . 1 . ]" 2
661 1 60 GLU H 1 97 LYS QB . . 6.500 5.196 4.696 5.863 . 0 0 "[ . 1 . ]" 2
662 1 60 GLU H 1 97 LYS QG . . 6.500 4.428 3.837 6.448 . 0 0 "[ . 1 . ]" 2
663 1 60 GLU H 1 97 LYS QD . . 6.000 5.775 3.556 6.231 0.231 16 0 "[ . 1 . ]" 2
664 1 60 GLU HA 1 61 GLU H . . 3.600 2.520 2.416 2.654 . 0 0 "[ . 1 . ]" 2
665 1 60 GLU HA 1 98 ILE H . . 5.800 4.444 3.997 4.711 . 0 0 "[ . 1 . ]" 2
666 1 60 GLU QB 1 61 GLU H . . 5.400 2.334 2.034 2.688 . 0 0 "[ . 1 . ]" 2
667 1 60 GLU QB 1 62 ASP H . . 7.500 3.278 2.703 3.929 . 0 0 "[ . 1 . ]" 2
668 1 60 GLU QB 1 63 GLU H . . 7.400 4.143 3.355 4.960 . 0 0 "[ . 1 . ]" 2
669 1 61 GLU H 1 61 GLU HG3 . . 3.800 3.070 2.061 3.668 . 0 0 "[ . 1 . ]" 2
670 1 61 GLU H 1 61 GLU HG2 . . 3.200 2.637 2.166 3.442 0.242 19 0 "[ . 1 . ]" 2
671 1 61 GLU H 1 62 ASP H . . 4.300 3.038 2.868 3.154 . 0 0 "[ . 1 . ]" 2
672 1 61 GLU H 1 62 ASP QB . . 6.600 4.720 4.519 4.985 . 0 0 "[ . 1 . ]" 2
673 1 61 GLU H 1 63 GLU H . . 6.500 4.776 4.490 5.100 . 0 0 "[ . 1 . ]" 2
674 1 61 GLU H 1 97 LYS HA . . 6.500 5.726 5.511 6.025 . 0 0 "[ . 1 . ]" 2
675 1 61 GLU H 1 97 LYS QG . . 6.500 4.955 4.476 6.593 0.093 12 0 "[ . 1 . ]" 2
676 1 61 GLU H 1 97 LYS QD . . 6.500 5.833 4.588 6.624 0.124 11 0 "[ . 1 . ]" 2
677 1 61 GLU HA 1 62 ASP H . . 5.400 3.519 3.459 3.547 . 0 0 "[ . 1 . ]" 2
678 1 61 GLU HA 1 65 GLY H . . 6.500 3.930 3.422 4.590 . 0 0 "[ . 1 . ]" 2
679 1 61 GLU QB 1 62 ASP H . . 5.200 3.468 2.749 3.763 . 0 0 "[ . 1 . ]" 2
680 1 61 GLU HG3 1 62 ASP H . . 6.200 2.914 2.123 5.087 . 0 0 "[ . 1 . ]" 2
681 1 61 GLU HG3 1 65 GLY H . . 6.500 6.271 5.759 7.049 0.549 1 1 "[+ . 1 . ]" 2
682 1 61 GLU HG2 1 62 ASP H . . 4.700 3.568 2.599 4.967 0.267 11 0 "[ . 1 . ]" 2
683 1 62 ASP H 1 63 GLU H . . 3.800 2.945 2.768 3.133 . 0 0 "[ . 1 . ]" 2
684 1 62 ASP H 1 63 GLU QB . . 5.500 4.915 4.556 5.277 . 0 0 "[ . 1 . ]" 2
685 1 62 ASP H 1 63 GLU QG . . 7.300 5.235 4.813 5.832 . 0 0 "[ . 1 . ]" 2
686 1 62 ASP H 1 64 LEU H . . 6.500 3.973 3.723 4.135 . 0 0 "[ . 1 . ]" 2
687 1 62 ASP H 1 65 GLY H . . 6.500 5.062 4.751 5.430 . 0 0 "[ . 1 . ]" 2
688 1 62 ASP HA 1 63 GLU H . . 4.800 3.588 3.519 3.657 . 0 0 "[ . 1 . ]" 2
689 1 62 ASP HA 1 65 GLY H . . 5.800 4.331 3.943 4.737 . 0 0 "[ . 1 . ]" 2
690 1 63 GLU H 1 63 GLU QB . . 3.200 2.339 2.193 2.536 . 0 0 "[ . 1 . ]" 2
691 1 63 GLU H 1 63 GLU QG . . 5.000 2.829 2.444 3.368 . 0 0 "[ . 1 . ]" 2
692 1 63 GLU H 1 64 LEU H . . 3.700 2.293 2.069 2.573 . 0 0 "[ . 1 . ]" 2
693 1 63 GLU H 1 64 LEU QB . . 7.500 3.836 3.578 4.040 . 0 0 "[ . 1 . ]" 2
694 1 63 GLU H 1 64 LEU HG . . 6.500 6.472 6.257 6.548 0.048 10 0 "[ . 1 . ]" 2
695 1 63 GLU H 1 64 LEU MD1 . . 5.400 5.080 4.393 5.615 0.215 9 0 "[ . 1 . ]" 2
696 1 63 GLU H 1 65 GLY H . . 5.200 4.234 3.952 4.530 . 0 0 "[ . 1 . ]" 2
697 1 63 GLU H 1 66 PHE H . . 6.300 5.591 5.328 5.988 . 0 0 "[ . 1 . ]" 2
698 1 63 GLU H 1 66 PHE QD . . 8.500 6.272 5.393 7.048 . 0 0 "[ . 1 . ]" 2
699 1 63 GLU H 1 66 PHE QE . . 8.200 5.611 4.677 6.644 . 0 0 "[ . 1 . ]" 2
700 1 63 GLU HA 1 64 LEU H . . 5.100 3.541 3.482 3.567 . 0 0 "[ . 1 . ]" 2
701 1 64 LEU H 1 64 LEU HG . . 4.200 4.216 3.960 4.263 0.063 1 0 "[ . 1 . ]" 2
702 1 64 LEU H 1 64 LEU MD1 . . 4.800 3.527 2.892 3.974 . 0 0 "[ . 1 . ]" 2
703 1 64 LEU H 1 65 GLY H . . 4.000 2.921 2.793 3.035 . 0 0 "[ . 1 . ]" 2
704 1 64 LEU H 1 66 PHE H . . 6.500 4.456 4.276 4.614 . 0 0 "[ . 1 . ]" 2
705 1 64 LEU HA 1 65 GLY H . . 4.200 3.523 3.462 3.607 . 0 0 "[ . 1 . ]" 2
706 1 64 LEU HA 1 67 ILE H . . 6.500 3.409 2.983 3.797 . 0 0 "[ . 1 . ]" 2
707 1 64 LEU QB 1 65 GLY H . . 5.600 2.793 2.466 3.114 . 0 0 "[ . 1 . ]" 2
708 1 64 LEU QB 1 66 PHE H . . 7.500 4.755 4.574 5.002 . 0 0 "[ . 1 . ]" 2
709 1 64 LEU HG 1 65 GLY H . . 5.200 4.788 4.647 4.922 . 0 0 "[ . 1 . ]" 2
710 1 64 LEU HG 1 67 ILE H . . 6.500 5.059 4.310 5.618 . 0 0 "[ . 1 . ]" 2
711 1 64 LEU MD1 1 65 GLY H . . 6.400 4.965 4.651 5.271 . 0 0 "[ . 1 . ]" 2
712 1 64 LEU MD1 1 87 MET H . . 6.300 3.947 3.296 4.633 . 0 0 "[ . 1 . ]" 2
713 1 64 LEU MD2 1 65 GLY H . . 5.000 4.238 3.707 4.624 . 0 0 "[ . 1 . ]" 2
714 1 64 LEU MD2 1 67 ILE H . . 7.500 5.632 4.235 6.555 . 0 0 "[ . 1 . ]" 2
715 1 64 LEU MD2 1 87 MET H . . 7.500 2.741 2.400 3.828 . 0 0 "[ . 1 . ]" 2
716 1 65 GLY H 1 66 PHE H . . 3.300 2.957 2.706 3.269 . 0 0 "[ . 1 . ]" 2
717 1 65 GLY H 1 78 LEU HG . . 6.500 6.103 5.577 6.585 0.085 7 0 "[ . 1 . ]" 2
718 1 65 GLY HA3 1 66 PHE H . . 4.000 3.046 2.802 3.222 . 0 0 "[ . 1 . ]" 2
719 1 65 GLY HA3 1 67 ILE H . . 5.400 5.017 4.731 5.366 . 0 0 "[ . 1 . ]" 2
720 1 65 GLY HA3 1 78 LEU H . . 4.400 4.487 4.251 4.732 0.332 7 0 "[ . 1 . ]" 2
721 1 65 GLY HA2 1 66 PHE H . . 5.000 3.571 3.485 3.668 . 0 0 "[ . 1 . ]" 2
722 1 65 GLY HA2 1 67 ILE H . . 6.500 4.792 4.565 5.212 . 0 0 "[ . 1 . ]" 2
723 1 65 GLY HA2 1 78 LEU H . . 4.700 3.710 3.350 3.936 . 0 0 "[ . 1 . ]" 2
724 1 66 PHE H 1 66 PHE QE . . 6.400 4.423 4.249 4.712 . 0 0 "[ . 1 . ]" 2
725 1 66 PHE H 1 67 ILE H . . 3.800 2.386 2.063 2.903 . 0 0 "[ . 1 . ]" 2
726 1 66 PHE H 1 67 ILE HA . . 5.200 4.236 4.028 4.354 . 0 0 "[ . 1 . ]" 2
727 1 66 PHE H 1 67 ILE HB . . 6.500 4.488 3.880 5.757 . 0 0 "[ . 1 . ]" 2
728 1 66 PHE H 1 67 ILE MG . . 7.500 3.524 3.136 3.984 . 0 0 "[ . 1 . ]" 2
729 1 66 PHE H 1 78 LEU HG . . 6.500 4.758 4.082 6.287 . 0 0 "[ . 1 . ]" 2
730 1 66 PHE HA 1 67 ILE H . . 5.000 2.850 2.623 3.112 . 0 0 "[ . 1 . ]" 2
731 1 66 PHE HA 1 68 LEU H . . 6.500 3.486 3.208 3.931 . 0 0 "[ . 1 . ]" 2
732 1 66 PHE HA 1 69 LYS H . . 6.500 4.063 3.723 4.306 . 0 0 "[ . 1 . ]" 2
733 1 66 PHE HA 1 78 LEU H . . 6.500 3.269 2.910 3.908 . 0 0 "[ . 1 . ]" 2
734 1 66 PHE QB 1 67 ILE H . . 7.500 4.068 4.005 4.150 . 0 0 "[ . 1 . ]" 2
735 1 66 PHE QD 1 69 LYS H . . 7.500 3.844 3.514 4.424 . 0 0 "[ . 1 . ]" 2
736 1 67 ILE H 1 67 ILE HB . . 3.600 2.758 2.282 3.609 0.009 15 0 "[ . 1 . ]" 2
737 1 67 ILE H 1 67 ILE MG . . 3.400 1.897 1.736 2.218 . 0 0 "[ . 1 . ]" 2
738 1 67 ILE H 1 67 ILE MD . . 4.900 4.090 3.888 4.191 . 0 0 "[ . 1 . ]" 2
739 1 67 ILE H 1 68 LEU H . . 4.600 2.895 2.623 3.237 . 0 0 "[ . 1 . ]" 2
740 1 67 ILE H 1 68 LEU HG . . 5.100 4.913 3.934 5.269 0.169 12 0 "[ . 1 . ]" 2
741 1 67 ILE H 1 69 LYS H . . 5.600 4.396 4.176 4.556 . 0 0 "[ . 1 . ]" 2
742 1 67 ILE H 1 70 GLY H . . 5.800 5.787 5.610 5.864 0.064 5 0 "[ . 1 . ]" 2
743 1 67 ILE H 1 78 LEU H . . 5.800 5.181 4.679 5.440 . 0 0 "[ . 1 . ]" 2
744 1 67 ILE H 1 78 LEU HG . . 6.500 4.051 3.094 5.517 . 0 0 "[ . 1 . ]" 2
745 1 67 ILE H 1 78 LEU MD2 . . 7.500 4.789 3.607 5.872 . 0 0 "[ . 1 . ]" 2
746 1 67 ILE HA 1 68 LEU H . . 4.600 3.499 3.423 3.556 . 0 0 "[ . 1 . ]" 2
747 1 67 ILE HA 1 70 GLY H . . 6.500 3.873 3.659 4.090 . 0 0 "[ . 1 . ]" 2
748 1 67 ILE HB 1 68 LEU H . . 6.500 4.044 3.835 4.227 . 0 0 "[ . 1 . ]" 2
749 1 67 ILE MG 1 68 LEU H . . 4.500 2.668 2.085 3.807 . 0 0 "[ . 1 . ]" 2
750 1 67 ILE MG 1 69 LYS H . . 7.500 4.774 4.464 5.246 . 0 0 "[ . 1 . ]" 2
751 1 67 ILE MG 1 70 GLY H . . 7.500 5.460 5.269 5.643 . 0 0 "[ . 1 . ]" 2
752 1 67 ILE MG 1 78 LEU H . . 7.500 5.217 4.522 6.070 . 0 0 "[ . 1 . ]" 2
753 1 67 ILE QG 1 68 LEU H . . 7.500 3.636 2.128 4.263 . 0 0 "[ . 1 . ]" 2
754 1 68 LEU H 1 68 LEU QB . . 3.500 2.435 2.220 2.955 . 0 0 "[ . 1 . ]" 2
755 1 68 LEU H 1 68 LEU HG . . 3.400 2.524 1.980 3.371 . 0 0 "[ . 1 . ]" 2
756 1 68 LEU H 1 68 LEU MD1 . . 4.100 3.079 2.018 3.885 . 0 0 "[ . 1 . ]" 2
757 1 68 LEU H 1 69 LYS H . . 3.800 2.907 2.836 3.009 . 0 0 "[ . 1 . ]" 2
758 1 68 LEU H 1 69 LYS QG . . 7.100 5.655 4.681 6.333 . 0 0 "[ . 1 . ]" 2
759 1 68 LEU H 1 70 GLY H . . 5.700 4.392 4.318 4.484 . 0 0 "[ . 1 . ]" 2
760 1 68 LEU H 1 71 PHE H . . 6.500 5.123 4.874 5.280 . 0 0 "[ . 1 . ]" 2
761 1 68 LEU H 1 75 ALA MB . . 6.400 3.709 3.442 4.041 . 0 0 "[ . 1 . ]" 2
762 1 68 LEU H 1 78 LEU MD2 . . 6.100 4.183 3.237 5.367 . 0 0 "[ . 1 . ]" 2
763 1 68 LEU HA 1 69 LYS H . . 5.100 3.530 3.489 3.575 . 0 0 "[ . 1 . ]" 2
764 1 68 LEU HA 1 70 GLY H . . 5.200 3.595 3.397 3.765 . 0 0 "[ . 1 . ]" 2
765 1 68 LEU HA 1 71 PHE H . . 6.000 2.916 2.569 3.216 . 0 0 "[ . 1 . ]" 2
766 1 68 LEU QB 1 69 LYS H . . 4.700 3.084 2.732 3.646 . 0 0 "[ . 1 . ]" 2
767 1 68 LEU QB 1 70 GLY H . . 6.500 4.573 4.464 4.753 . 0 0 "[ . 1 . ]" 2
768 1 68 LEU QB 1 72 SER H . . 5.200 4.148 3.881 4.535 . 0 0 "[ . 1 . ]" 2
769 1 68 LEU QB 1 76 ARG H . . 6.500 4.429 3.222 5.343 . 0 0 "[ . 1 . ]" 2
770 1 68 LEU QB 1 71 PHE H . . 6.500 4.364 4.083 4.592 . 0 0 "[ . 1 . ]" 2
771 1 68 LEU HG 1 69 LYS H . . 6.000 4.621 3.000 5.064 . 0 0 "[ . 1 . ]" 2
772 1 69 LYS H 1 69 LYS QG . . 5.100 3.355 2.557 3.860 . 0 0 "[ . 1 . ]" 2
773 1 69 LYS H 1 69 LYS QD . . 5.100 4.436 4.154 4.591 . 0 0 "[ . 1 . ]" 2
774 1 69 LYS H 1 70 GLY H . . 3.700 2.692 2.579 2.768 . 0 0 "[ . 1 . ]" 2
775 1 69 LYS H 1 71 PHE H . . 5.700 4.245 3.972 4.419 . 0 0 "[ . 1 . ]" 2
776 1 69 LYS H 1 72 SER H . . 6.500 4.870 4.740 4.978 . 0 0 "[ . 1 . ]" 2
777 1 69 LYS H 1 75 ALA MB . . 4.900 2.618 2.398 2.863 . 0 0 "[ . 1 . ]" 2
778 1 69 LYS H 1 78 LEU MD2 . . 7.500 6.078 5.143 7.051 . 0 0 "[ . 1 . ]" 2
779 1 69 LYS HA 1 70 GLY H . . 6.500 3.413 3.313 3.493 . 0 0 "[ . 1 . ]" 2
780 1 69 LYS HA 1 71 PHE H . . 6.500 4.212 3.763 4.502 . 0 0 "[ . 1 . ]" 2
781 1 69 LYS QB 1 75 ALA H . . 7.500 5.372 4.756 5.762 . 0 0 "[ . 1 . ]" 2
782 1 69 LYS QG 1 70 GLY H . . 6.400 4.738 4.505 4.985 . 0 0 "[ . 1 . ]" 2
783 1 69 LYS QD 1 70 GLY H . . 7.500 5.070 4.424 5.692 . 0 0 "[ . 1 . ]" 2
784 1 70 GLY H 1 71 PHE H . . 4.000 2.416 2.279 2.618 . 0 0 "[ . 1 . ]" 2
785 1 70 GLY H 1 71 PHE HB3 . . 5.600 5.939 5.763 6.128 0.528 12 1 "[ . 1 + . ]" 2
786 1 70 GLY H 1 71 PHE QD . . 8.500 4.627 3.634 4.976 . 0 0 "[ . 1 . ]" 2
787 1 70 GLY H 1 72 SER H . . 6.500 4.060 3.931 4.205 . 0 0 "[ . 1 . ]" 2
788 1 70 GLY H 1 72 SER QB . . 7.500 6.496 6.331 6.693 . 0 0 "[ . 1 . ]" 2
789 1 70 GLY HA2 1 71 PHE H . . 5.200 3.561 3.397 3.613 . 0 0 "[ . 1 . ]" 2
790 1 70 GLY HA3 1 71 PHE H . . 4.400 2.910 2.611 3.282 . 0 0 "[ . 1 . ]" 2
791 1 71 PHE H 1 71 PHE HB2 . . 4.300 2.421 2.302 2.535 . 0 0 "[ . 1 . ]" 2
792 1 71 PHE H 1 71 PHE HB3 . . 4.300 3.603 3.552 3.672 . 0 0 "[ . 1 . ]" 2
793 1 71 PHE H 1 72 SER H . . 3.400 2.745 2.300 2.991 . 0 0 "[ . 1 . ]" 2
794 1 71 PHE H 1 72 SER QB . . 6.300 4.969 4.660 5.148 . 0 0 "[ . 1 . ]" 2
795 1 71 PHE HA 1 72 SER H . . 5.300 3.663 3.633 3.699 . 0 0 "[ . 1 . ]" 2
796 1 71 PHE HB2 1 72 SER H . . 4.000 2.820 2.521 2.989 . 0 0 "[ . 1 . ]" 2
797 1 71 PHE HB3 1 72 SER H . . 4.800 3.606 3.346 3.885 . 0 0 "[ . 1 . ]" 2
798 1 71 PHE QD 1 72 SER H . . 8.500 4.595 4.361 4.762 . 0 0 "[ . 1 . ]" 2
799 1 72 SER H 1 73 PRO HA . . 5.000 4.810 4.730 4.897 . 0 0 "[ . 1 . ]" 2
800 1 72 SER H 1 73 PRO QD . . 6.900 4.396 4.294 4.433 . 0 0 "[ . 1 . ]" 2
801 1 72 SER H 1 74 ASP H . . 6.700 6.588 6.561 6.628 . 0 0 "[ . 1 . ]" 2
802 1 72 SER H 1 75 ALA H . . 6.500 5.060 4.717 5.279 . 0 0 "[ . 1 . ]" 2
803 1 72 SER H 1 75 ALA MB . . 4.500 3.488 3.212 3.682 . 0 0 "[ . 1 . ]" 2
804 1 72 SER HA 1 74 ASP H . . 6.600 6.520 6.446 6.564 . 0 0 "[ . 1 . ]" 2
805 1 72 SER QB 1 74 ASP H . . 7.300 5.494 5.176 6.479 . 0 0 "[ . 1 . ]" 2
806 1 72 SER QB 1 75 ALA H . . 7.500 4.753 4.009 5.893 . 0 0 "[ . 1 . ]" 2
807 1 73 PRO HA 1 74 ASP H . . 5.300 2.349 2.254 2.456 . 0 0 "[ . 1 . ]" 2
808 1 73 PRO HB2 1 74 ASP H . . 3.500 2.479 2.311 2.637 . 0 0 "[ . 1 . ]" 2
809 1 73 PRO HB3 1 74 ASP H . . 4.900 3.393 3.276 3.503 . 0 0 "[ . 1 . ]" 2
810 1 73 PRO QG 1 74 ASP H . . 6.400 4.016 3.848 4.152 . 0 0 "[ . 1 . ]" 2
811 1 73 PRO QD 1 74 ASP H . . 7.400 4.816 4.754 4.888 . 0 0 "[ . 1 . ]" 2
812 1 74 ASP H 1 75 ALA H . . 3.600 2.625 2.334 2.902 . 0 0 "[ . 1 . ]" 2
813 1 74 ASP H 1 75 ALA HA . . 5.500 5.229 4.859 5.430 . 0 0 "[ . 1 . ]" 2
814 1 74 ASP H 1 75 ALA MB . . 5.200 3.797 3.412 4.073 . 0 0 "[ . 1 . ]" 2
815 1 74 ASP H 1 76 ARG QG . . 5.600 4.999 4.612 5.211 . 0 0 "[ . 1 . ]" 2
816 1 74 ASP HA 1 75 ALA H . . 4.600 3.081 2.854 3.476 . 0 0 "[ . 1 . ]" 2
817 1 74 ASP QB 1 75 ALA H . . 6.900 3.533 2.429 3.806 . 0 0 "[ . 1 . ]" 2
818 1 75 ALA H 1 75 ALA MB . . 3.400 2.053 1.991 2.124 . 0 0 "[ . 1 . ]" 2
819 1 75 ALA H 1 76 ARG H . . 4.600 3.276 2.868 4.601 0.001 10 0 "[ . 1 . ]" 2
820 1 75 ALA H 1 76 ARG QG . . 5.500 4.284 4.045 4.726 . 0 0 "[ . 1 . ]" 2
821 1 75 ALA HA 1 76 ARG H . . 5.600 3.282 2.195 3.532 . 0 0 "[ . 1 . ]" 2
822 1 75 ALA MB 1 76 ARG H . . 4.900 2.468 2.064 3.684 . 0 0 "[ . 1 . ]" 2
823 1 76 ARG H 1 76 ARG HB2 . . 4.100 3.691 2.656 4.010 . 0 0 "[ . 1 . ]" 2
824 1 76 ARG H 1 76 ARG HB3 . . 4.300 3.905 2.880 4.105 . 0 0 "[ . 1 . ]" 2
825 1 76 ARG H 1 76 ARG QG . . 3.300 2.579 1.893 2.883 . 0 0 "[ . 1 . ]" 2
826 1 76 ARG H 1 77 ASP H . . 5.000 4.541 4.409 4.712 . 0 0 "[ . 1 . ]" 2
827 1 76 ARG HA 1 77 ASP H . . 3.400 2.470 2.341 2.707 . 0 0 "[ . 1 . ]" 2
828 1 76 ARG HB2 1 77 ASP H . . 4.000 3.028 2.574 3.477 . 0 0 "[ . 1 . ]" 2
829 1 76 ARG HB3 1 77 ASP H . . 3.800 2.327 2.076 3.685 . 0 0 "[ . 1 . ]" 2
830 1 76 ARG QG 1 77 ASP H . . 5.400 4.087 3.902 4.317 . 0 0 "[ . 1 . ]" 2
831 1 76 ARG QG 1 78 LEU H . . 6.500 6.598 5.864 6.700 0.200 9 0 "[ . 1 . ]" 2
832 1 76 ARG QD 1 77 ASP H . . 7.500 4.409 4.038 4.937 . 0 0 "[ . 1 . ]" 2
833 1 77 ASP H 1 77 ASP HB2 . . 4.300 2.989 2.347 3.535 . 0 0 "[ . 1 . ]" 2
834 1 77 ASP H 1 77 ASP HB3 . . 3.900 2.950 2.495 3.600 . 0 0 "[ . 1 . ]" 2
835 1 77 ASP H 1 78 LEU H . . 6.500 4.364 4.240 4.541 . 0 0 "[ . 1 . ]" 2
836 1 77 ASP HA 1 78 LEU H . . 3.700 2.108 2.061 2.198 . 0 0 "[ . 1 . ]" 2
837 1 77 ASP HB2 1 78 LEU H . . 4.300 3.998 3.310 4.550 0.250 8 0 "[ . 1 . ]" 2
838 1 77 ASP HB3 1 78 LEU H . . 5.000 4.048 3.394 4.465 . 0 0 "[ . 1 . ]" 2
839 1 78 LEU H 1 78 LEU HG . . 4.800 2.342 2.014 3.920 . 0 0 "[ . 1 . ]" 2
840 1 78 LEU H 1 78 LEU MD2 . . 4.600 3.101 2.347 3.682 . 0 0 "[ . 1 . ]" 2
841 1 78 LEU H 1 79 SER H . . 6.500 4.696 4.631 4.758 . 0 0 "[ . 1 . ]" 2
842 1 78 LEU HA 1 79 SER H . . 3.900 2.349 2.252 2.497 . 0 0 "[ . 1 . ]" 2
843 1 78 LEU QB 1 79 SER H . . 4.600 2.596 2.033 2.970 . 0 0 "[ . 1 . ]" 2
844 1 78 LEU QB 1 82 GLU H . . 4.300 4.629 4.416 4.729 0.429 11 0 "[ . 1 . ]" 2
845 1 78 LEU HG 1 79 SER H . . 6.500 5.059 4.154 5.392 . 0 0 "[ . 1 . ]" 2
846 1 78 LEU MD2 1 79 SER H . . 6.800 3.658 3.182 4.569 . 0 0 "[ . 1 . ]" 2
847 1 79 SER H 1 82 GLU H . . 6.300 4.062 3.858 4.291 . 0 0 "[ . 1 . ]" 2
848 1 79 SER H 1 82 GLU QB . . 7.500 2.711 2.377 4.269 . 0 0 "[ . 1 . ]" 2
849 1 79 SER H 1 82 GLU QG . . 6.400 3.809 2.500 4.724 . 0 0 "[ . 1 . ]" 2
850 1 79 SER HA 1 80 ALA H . . 3.400 2.242 2.175 2.345 . 0 0 "[ . 1 . ]" 2
851 1 79 SER HA 1 81 LYS H . . 5.500 4.036 3.810 4.395 . 0 0 "[ . 1 . ]" 2
852 1 79 SER QB 1 80 ALA H . . 6.000 3.281 2.504 3.636 . 0 0 "[ . 1 . ]" 2
853 1 79 SER QB 1 81 LYS H . . 7.500 3.022 2.195 3.506 . 0 0 "[ . 1 . ]" 2
854 1 79 SER QB 1 82 GLU H . . 6.000 2.563 2.172 3.528 . 0 0 "[ . 1 . ]" 2
855 1 80 ALA H 1 80 ALA MB . . 3.400 2.196 2.155 2.231 . 0 0 "[ . 1 . ]" 2
856 1 80 ALA H 1 81 LYS H . . 4.400 2.803 2.680 3.014 . 0 0 "[ . 1 . ]" 2
857 1 80 ALA H 1 81 LYS QG . . 6.500 4.335 3.863 5.446 . 0 0 "[ . 1 . ]" 2
858 1 80 ALA HA 1 81 LYS H . . 6.500 3.534 3.473 3.629 . 0 0 "[ . 1 . ]" 2
859 1 81 LYS H 1 81 LYS HB2 . . 3.800 2.736 2.420 3.057 . 0 0 "[ . 1 . ]" 2
860 1 81 LYS H 1 81 LYS HB3 . . 3.900 3.660 3.583 3.741 . 0 0 "[ . 1 . ]" 2
861 1 81 LYS H 1 81 LYS QG . . 3.400 2.322 1.995 3.381 . 0 0 "[ . 1 . ]" 2
862 1 81 LYS H 1 82 GLU H . . 3.900 2.483 2.233 2.763 . 0 0 "[ . 1 . ]" 2
863 1 81 LYS HA 1 82 GLU H . . 5.100 3.534 3.479 3.625 . 0 0 "[ . 1 . ]" 2
864 1 81 LYS HA 1 85 MET H . . 4.200 4.092 3.792 4.235 0.035 1 0 "[ . 1 . ]" 2
865 1 81 LYS HB2 1 82 GLU H . . 3.300 2.741 2.437 3.081 . 0 0 "[ . 1 . ]" 2
866 1 81 LYS HB3 1 82 GLU H . . 5.500 3.903 3.401 4.186 . 0 0 "[ . 1 . ]" 2
867 1 84 LYS H 1 84 LYS HG2 . . 5.000 4.294 3.635 4.614 . 0 0 "[ . 1 . ]" 2
868 1 84 LYS H 1 84 LYS HG3 . . 4.100 3.684 2.297 4.534 0.434 18 0 "[ . 1 . ]" 2
869 1 84 LYS H 1 84 LYS QD . . 5.100 4.134 3.494 4.400 . 0 0 "[ . 1 . ]" 2
870 1 84 LYS H 1 85 MET H . . 4.100 2.982 2.841 3.129 . 0 0 "[ . 1 . ]" 2
871 1 84 LYS H 1 87 MET H . . 5.800 4.792 4.688 4.894 . 0 0 "[ . 1 . ]" 2
872 1 84 LYS HA 1 85 MET H . . 5.900 3.607 3.571 3.633 . 0 0 "[ . 1 . ]" 2
873 1 84 LYS HA 1 86 LEU H . . 6.300 4.753 4.395 4.951 . 0 0 "[ . 1 . ]" 2
874 1 84 LYS HA 1 87 MET H . . 6.000 3.905 3.636 4.084 . 0 0 "[ . 1 . ]" 2
875 1 85 MET H 1 86 LEU HB3 . . 6.000 4.768 4.329 5.987 . 0 0 "[ . 1 . ]" 2
876 1 85 MET H 1 86 LEU HB2 . . 6.500 4.921 4.445 5.267 . 0 0 "[ . 1 . ]" 2
877 1 85 MET HA 1 86 LEU H . . 4.700 3.573 3.514 3.619 . 0 0 "[ . 1 . ]" 2
878 1 85 MET QB 1 86 LEU H . . 5.300 2.681 2.499 2.862 . 0 0 "[ . 1 . ]" 2
879 1 86 LEU H 1 86 LEU HB3 . . 3.600 2.470 2.147 3.392 . 0 0 "[ . 1 . ]" 2
880 1 86 LEU H 1 86 LEU HB2 . . 3.500 2.437 2.123 2.663 . 0 0 "[ . 1 . ]" 2
881 1 86 LEU H 1 86 LEU HG . . 4.600 4.328 4.049 4.516 . 0 0 "[ . 1 . ]" 2
882 1 86 LEU H 1 86 LEU QD . . 4.200 3.656 2.482 3.807 . 0 0 "[ . 1 . ]" 2
883 1 86 LEU H 1 87 MET H . . 3.500 2.886 2.690 2.982 . 0 0 "[ . 1 . ]" 2
884 1 86 LEU H 1 89 ALA H . . 4.700 4.707 4.651 4.754 0.054 17 0 "[ . 1 . ]" 2
885 1 86 LEU HA 1 87 MET H . . 4.700 3.631 3.588 3.681 . 0 0 "[ . 1 . ]" 2
886 1 86 LEU HB3 1 87 MET H . . 3.400 2.691 2.377 2.992 . 0 0 "[ . 1 . ]" 2
887 1 86 LEU HB3 1 88 ALA H . . 5.900 5.324 4.936 5.576 . 0 0 "[ . 1 . ]" 2
888 1 86 LEU HB2 1 87 MET H . . 4.200 3.922 3.019 4.169 . 0 0 "[ . 1 . ]" 2
889 1 86 LEU QD 1 87 MET H . . 4.200 3.658 2.900 4.089 . 0 0 "[ . 1 . ]" 2
890 1 86 LEU QD 1 89 ALA H . . 7.500 4.671 3.811 5.078 . 0 0 "[ . 1 . ]" 2
891 1 86 LEU QD 1 90 GLY H . . 4.800 3.288 2.649 3.695 . 0 0 "[ . 1 . ]" 2
892 1 86 LEU QD 1 91 ASP H . . 7.500 4.754 4.382 5.209 . 0 0 "[ . 1 . ]" 2
893 1 87 MET H 1 88 ALA H . . 3.900 2.916 2.796 3.043 . 0 0 "[ . 1 . ]" 2
894 1 87 MET H 1 89 ALA H . . 6.500 4.416 4.284 4.613 . 0 0 "[ . 1 . ]" 2
895 1 87 MET QB 1 88 ALA H . . 5.200 2.590 2.167 3.649 . 0 0 "[ . 1 . ]" 2
896 1 87 MET QB 1 89 ALA H . . 7.500 4.935 4.668 5.630 . 0 0 "[ . 1 . ]" 2
897 1 88 ALA H 1 88 ALA MB . . 3.400 2.187 2.175 2.218 . 0 0 "[ . 1 . ]" 2
898 1 88 ALA H 1 89 ALA H . . 3.400 2.870 2.786 2.965 . 0 0 "[ . 1 . ]" 2
899 1 88 ALA H 1 90 GLY H . . 6.100 4.312 4.016 4.647 . 0 0 "[ . 1 . ]" 2
900 1 88 ALA H 1 91 ASP H . . 6.500 4.990 4.838 5.151 . 0 0 "[ . 1 . ]" 2
901 1 88 ALA HA 1 89 ALA H . . 3.900 3.609 3.576 3.646 . 0 0 "[ . 1 . ]" 2
902 1 89 ALA H 1 89 ALA MB . . 3.400 2.228 2.202 2.248 . 0 0 "[ . 1 . ]" 2
903 1 89 ALA H 1 90 GLY H . . 3.600 2.626 2.501 2.742 . 0 0 "[ . 1 . ]" 2
904 1 89 ALA H 1 91 ASP H . . 6.200 4.343 4.058 4.701 . 0 0 "[ . 1 . ]" 2
905 1 89 ALA H 1 106 LEU MD1 . . 7.500 5.798 5.068 6.364 . 0 0 "[ . 1 . ]" 2
906 1 89 ALA HA 1 90 GLY H . . 3.800 3.583 3.504 3.655 . 0 0 "[ . 1 . ]" 2
907 1 89 ALA MB 1 90 GLY H . . 4.300 2.656 2.258 3.127 . 0 0 "[ . 1 . ]" 2
908 1 90 GLY H 1 91 ASP H . . 3.700 2.729 2.506 3.013 . 0 0 "[ . 1 . ]" 2
909 1 90 GLY H 1 91 ASP HB2 . . 5.800 5.357 5.017 5.808 0.008 6 0 "[ . 1 . ]" 2
910 1 90 GLY H 1 91 ASP HB3 . . 6.200 4.868 4.565 5.296 . 0 0 "[ . 1 . ]" 2
911 1 90 GLY H 1 92 LYS H . . 5.900 5.274 4.792 5.923 0.023 1 0 "[ . 1 . ]" 2
912 1 90 GLY H 1 98 ILE MD . . 6.700 3.798 3.579 4.099 . 0 0 "[ . 1 . ]" 2
913 1 90 GLY H 1 106 LEU MD1 . . 5.600 4.462 3.666 5.130 . 0 0 "[ . 1 . ]" 2
914 1 90 GLY HA2 1 91 ASP H . . 4.600 3.592 3.498 3.634 . 0 0 "[ . 1 . ]" 2
915 1 90 GLY HA3 1 91 ASP H . . 4.400 2.796 2.570 3.095 . 0 0 "[ . 1 . ]" 2
916 1 91 ASP H 1 91 ASP HB2 . . 3.800 2.749 2.585 3.034 . 0 0 "[ . 1 . ]" 2
917 1 91 ASP H 1 92 LYS H . . 6.500 3.724 3.418 4.095 . 0 0 "[ . 1 . ]" 2
918 1 91 ASP H 1 92 LYS HA . . 5.800 5.079 4.702 5.308 . 0 0 "[ . 1 . ]" 2
919 1 91 ASP H 1 92 LYS QB . . 7.500 5.491 5.039 5.816 . 0 0 "[ . 1 . ]" 2
920 1 91 ASP H 1 93 ASP H . . 6.400 5.389 5.164 5.699 . 0 0 "[ . 1 . ]" 2
921 1 91 ASP H 1 94 GLY H . . 6.500 5.595 5.049 5.856 . 0 0 "[ . 1 . ]" 2
922 1 91 ASP H 1 98 ILE HG13 . . 6.500 3.782 3.238 4.497 . 0 0 "[ . 1 . ]" 2
923 1 91 ASP H 1 98 ILE MD . . 7.500 4.131 3.817 4.619 . 0 0 "[ . 1 . ]" 2
924 1 91 ASP H 1 106 LEU MD1 . . 7.500 5.385 3.999 6.453 . 0 0 "[ . 1 . ]" 2
925 1 91 ASP HA 1 92 LYS H . . 3.700 2.529 2.213 2.857 . 0 0 "[ . 1 . ]" 2
926 1 91 ASP HA 1 93 ASP H . . 5.700 3.195 2.946 3.578 . 0 0 "[ . 1 . ]" 2
927 1 91 ASP HA 1 99 GLY H . . 4.000 4.070 4.017 4.148 0.148 17 0 "[ . 1 . ]" 2
928 1 91 ASP HB3 1 92 LYS H . . 5.400 4.482 4.378 4.585 . 0 0 "[ . 1 . ]" 2
929 1 91 ASP HB3 1 93 ASP H . . 6.500 4.816 4.207 5.251 . 0 0 "[ . 1 . ]" 2
930 1 91 ASP HB3 1 94 GLY H . . 6.500 4.082 3.588 4.244 . 0 0 "[ . 1 . ]" 2
931 1 91 ASP QB 1 96 GLY H . . 7.500 3.113 2.160 3.398 . 0 0 "[ . 1 . ]" 2
932 1 91 ASP QB 1 97 LYS H . . 7.500 3.100 2.767 3.483 . 0 0 "[ . 1 . ]" 2
933 1 92 LYS H 1 92 LYS QD . . 5.800 4.213 3.691 4.528 . 0 0 "[ . 1 . ]" 2
934 1 92 LYS H 1 92 LYS QE . . 6.600 4.641 3.697 5.379 . 0 0 "[ . 1 . ]" 2
935 1 92 LYS H 1 93 ASP H . . 4.100 2.801 2.278 3.123 . 0 0 "[ . 1 . ]" 2
936 1 92 LYS H 1 94 GLY H . . 5.100 4.481 4.254 4.888 . 0 0 "[ . 1 . ]" 2
937 1 92 LYS H 1 95 ASP H . . 6.500 6.047 5.554 6.428 . 0 0 "[ . 1 . ]" 2
938 1 92 LYS H 1 102 GLU QB . . 7.500 3.259 2.428 3.699 . 0 0 "[ . 1 . ]" 2
939 1 92 LYS H 1 102 GLU QG . . 7.500 4.266 3.329 5.459 . 0 0 "[ . 1 . ]" 2
940 1 92 LYS HA 1 93 ASP H . . 4.400 3.364 3.192 3.512 . 0 0 "[ . 1 . ]" 2
941 1 92 LYS HA 1 94 GLY H . . 6.300 4.015 3.545 4.621 . 0 0 "[ . 1 . ]" 2
942 1 92 LYS QB 1 93 ASP H . . 5.400 3.363 2.861 3.882 . 0 0 "[ . 1 . ]" 2
943 1 92 LYS QB 1 94 GLY H . . 7.500 4.960 4.646 5.193 . 0 0 "[ . 1 . ]" 2
944 1 92 LYS QB 1 95 ASP H . . 7.500 6.797 6.514 6.980 . 0 0 "[ . 1 . ]" 2
945 1 92 LYS QG 1 93 ASP H . . 7.500 3.885 2.630 4.800 . 0 0 "[ . 1 . ]" 2
946 1 92 LYS QD 1 93 ASP H . . 7.500 4.889 3.476 5.810 . 0 0 "[ . 1 . ]" 2
947 1 93 ASP H 1 94 GLY H . . 3.600 2.473 2.235 2.769 . 0 0 "[ . 1 . ]" 2
948 1 93 ASP H 1 94 GLY HA3 . . 5.300 5.161 4.943 5.457 0.157 1 0 "[ . 1 . ]" 2
949 1 93 ASP H 1 95 ASP H . . 4.100 4.012 3.660 4.160 0.060 5 0 "[ . 1 . ]" 2
950 1 93 ASP H 1 95 ASP QB . . 6.500 5.528 5.105 6.537 0.037 17 0 "[ . 1 . ]" 2
951 1 93 ASP H 1 102 GLU QB . . 7.500 4.020 3.480 4.347 . 0 0 "[ . 1 . ]" 2
952 1 93 ASP H 1 102 GLU QG . . 7.500 3.581 2.401 4.505 . 0 0 "[ . 1 . ]" 2
953 1 93 ASP HA 1 94 GLY H . . 4.500 3.538 3.454 3.603 . 0 0 "[ . 1 . ]" 2
954 1 93 ASP QB 1 94 GLY H . . 7.500 3.070 2.590 3.731 . 0 0 "[ . 1 . ]" 2
955 1 94 GLY H 1 95 ASP H . . 3.800 2.503 2.043 2.682 . 0 0 "[ . 1 . ]" 2
956 1 94 GLY H 1 95 ASP QB . . 6.500 4.788 4.233 5.418 . 0 0 "[ . 1 . ]" 2
957 1 94 GLY H 1 96 GLY H . . 6.500 3.819 3.381 4.250 . 0 0 "[ . 1 . ]" 2
958 1 94 GLY HA2 1 95 ASP H . . 5.200 3.078 2.922 3.407 . 0 0 "[ . 1 . ]" 2
959 1 94 GLY HA2 1 96 GLY H . . 6.500 3.504 3.217 4.162 . 0 0 "[ . 1 . ]" 2
960 1 94 GLY HA3 1 95 ASP H . . 4.700 3.487 3.306 3.537 . 0 0 "[ . 1 . ]" 2
961 1 95 ASP H 1 95 ASP QB . . 3.900 2.666 2.326 3.054 . 0 0 "[ . 1 . ]" 2
962 1 95 ASP H 1 96 GLY H . . 3.600 2.309 2.106 2.826 . 0 0 "[ . 1 . ]" 2
963 1 95 ASP H 1 96 GLY QA . . 5.000 4.210 4.048 4.696 . 0 0 "[ . 1 . ]" 2
964 1 95 ASP H 1 97 LYS H . . 6.500 3.732 3.407 4.149 . 0 0 "[ . 1 . ]" 2
965 1 95 ASP HA 1 96 GLY H . . 5.100 3.376 3.178 3.449 . 0 0 "[ . 1 . ]" 2
966 1 95 ASP HA 1 97 LYS H . . 6.500 4.463 3.940 4.889 . 0 0 "[ . 1 . ]" 2
967 1 95 ASP QB 1 96 GLY H . . 6.300 3.168 2.336 3.982 . 0 0 "[ . 1 . ]" 2
968 1 95 ASP QB 1 97 LYS H . . 6.500 2.640 2.030 4.282 . 0 0 "[ . 1 . ]" 2
969 1 96 GLY H 1 97 LYS H . . 3.700 2.652 2.331 2.981 . 0 0 "[ . 1 . ]" 2
970 1 96 GLY H 1 97 LYS QG . . 6.500 5.516 4.783 5.803 . 0 0 "[ . 1 . ]" 2
971 1 96 GLY QA 1 97 LYS H . . 4.400 2.941 2.887 3.006 . 0 0 "[ . 1 . ]" 2
972 1 97 LYS H 1 97 LYS QG . . 4.200 3.463 2.377 3.893 . 0 0 "[ . 1 . ]" 2
973 1 97 LYS H 1 97 LYS QD . . 4.400 3.377 2.786 4.108 . 0 0 "[ . 1 . ]" 2
974 1 97 LYS H 1 97 LYS QE . . 6.500 4.390 2.303 5.428 . 0 0 "[ . 1 . ]" 2
975 1 97 LYS H 1 98 ILE H . . 5.000 4.411 4.292 4.516 . 0 0 "[ . 1 . ]" 2
976 1 97 LYS QB 1 98 ILE H . . 4.200 2.774 2.452 3.470 . 0 0 "[ . 1 . ]" 2
977 1 97 LYS QG 1 98 ILE H . . 6.500 3.811 3.439 4.741 . 0 0 "[ . 1 . ]" 2
978 1 98 ILE H 1 98 ILE HB . . 3.700 2.382 2.281 2.461 . 0 0 "[ . 1 . ]" 2
979 1 98 ILE H 1 98 ILE MG . . 4.800 3.815 3.736 3.869 . 0 0 "[ . 1 . ]" 2
980 1 98 ILE H 1 98 ILE HG12 . . 4.600 3.835 3.072 4.302 . 0 0 "[ . 1 . ]" 2
981 1 98 ILE H 1 98 ILE HG13 . . 4.400 2.660 2.135 3.093 . 0 0 "[ . 1 . ]" 2
982 1 98 ILE H 1 99 GLY H . . 6.500 4.445 4.361 4.635 . 0 0 "[ . 1 . ]" 2
983 1 98 ILE HA 1 99 GLY H . . 3.900 2.091 1.999 2.209 . 0 0 "[ . 1 . ]" 2
984 1 98 ILE HB 1 99 GLY H . . 6.500 4.368 4.103 4.533 . 0 0 "[ . 1 . ]" 2
985 1 98 ILE MG 1 99 GLY H . . 5.400 3.019 2.613 3.168 . 0 0 "[ . 1 . ]" 2
986 1 98 ILE MG 1 100 VAL H . . 7.200 4.297 3.957 4.638 . 0 0 "[ . 1 . ]" 2
987 1 98 ILE MG 1 102 GLU H . . 7.500 5.259 4.842 5.681 . 0 0 "[ . 1 . ]" 2
988 1 98 ILE HG12 1 99 GLY H . . 6.500 4.205 3.876 4.418 . 0 0 "[ . 1 . ]" 2
989 1 98 ILE MD 1 99 GLY H . . 7.500 5.166 4.940 5.326 . 0 0 "[ . 1 . ]" 2
990 1 99 GLY H 1 100 VAL H . . 5.500 4.490 4.372 4.576 . 0 0 "[ . 1 . ]" 2
991 1 99 GLY H 1 101 ASP H . . 6.500 5.586 5.268 5.861 . 0 0 "[ . 1 . ]" 2
992 1 99 GLY H 1 102 GLU H . . 6.100 4.373 4.152 4.571 . 0 0 "[ . 1 . ]" 2
993 1 99 GLY H 1 102 GLU QB . . 5.900 2.787 2.377 3.141 . 0 0 "[ . 1 . ]" 2
994 1 99 GLY H 1 102 GLU QG . . 7.400 3.924 3.132 4.785 . 0 0 "[ . 1 . ]" 2
995 1 99 GLY H 1 103 PHE H . . 6.500 3.841 3.209 4.078 . 0 0 "[ . 1 . ]" 2
996 1 99 GLY QA 1 100 VAL H . . 4.200 2.164 2.126 2.214 . 0 0 "[ . 1 . ]" 2
997 1 99 GLY QA 1 101 ASP H . . 4.900 3.850 3.593 4.041 . 0 0 "[ . 1 . ]" 2
998 1 100 VAL H 1 100 VAL MG2 . . 3.600 3.747 3.681 3.816 0.216 14 0 "[ . 1 . ]" 2
999 1 100 VAL H 1 101 ASP H . . 4.000 3.189 3.039 3.386 . 0 0 "[ . 1 . ]" 2
1000 1 100 VAL H 1 102 GLU H . . 5.000 4.565 4.253 4.869 . 0 0 "[ . 1 . ]" 2
1001 1 100 VAL H 1 103 PHE QD . . 8.500 5.581 3.868 6.020 . 0 0 "[ . 1 . ]" 2
1002 1 100 VAL H 1 103 PHE QE . . 8.500 7.160 4.482 7.632 . 0 0 "[ . 1 . ]" 2
1003 1 100 VAL HA 1 101 ASP H . . 4.900 3.563 3.519 3.612 . 0 0 "[ . 1 . ]" 2
1004 1 100 VAL HA 1 102 GLU H . . 5.700 4.549 4.307 4.813 . 0 0 "[ . 1 . ]" 2
1005 1 100 VAL HA 1 103 PHE H . . 5.000 3.651 3.326 4.370 . 0 0 "[ . 1 . ]" 2
1006 1 100 VAL HA 1 104 SER H . . 6.300 3.925 3.635 4.614 . 0 0 "[ . 1 . ]" 2
1007 1 100 VAL HB 1 101 ASP H . . 4.400 3.896 3.724 3.988 . 0 0 "[ . 1 . ]" 2
1008 1 100 VAL HB 1 102 GLU H . . 6.500 5.901 5.614 6.167 . 0 0 "[ . 1 . ]" 2
1009 1 100 VAL MG1 1 101 ASP H . . 5.700 2.077 1.796 2.267 . 0 0 "[ . 1 . ]" 2
1010 1 100 VAL MG1 1 104 SER H . . 7.500 5.330 5.073 5.767 . 0 0 "[ . 1 . ]" 2
1011 1 100 VAL MG2 1 101 ASP H . . 3.500 3.320 2.779 3.622 0.122 11 0 "[ . 1 . ]" 2
1012 1 100 VAL MG2 1 102 GLU H . . 7.500 4.996 4.656 5.357 . 0 0 "[ . 1 . ]" 2
1013 1 101 ASP H 1 101 ASP HB3 . . 4.300 2.738 2.427 3.385 . 0 0 "[ . 1 . ]" 2
1014 1 101 ASP H 1 101 ASP HB2 . . 3.700 2.228 1.980 2.441 . 0 0 "[ . 1 . ]" 2
1015 1 101 ASP H 1 102 GLU H . . 3.500 2.669 2.309 2.895 . 0 0 "[ . 1 . ]" 2
1016 1 101 ASP H 1 102 GLU QB . . 7.000 4.717 4.013 5.003 . 0 0 "[ . 1 . ]" 2
1017 1 101 ASP H 1 103 PHE H . . 5.900 4.278 4.100 4.829 . 0 0 "[ . 1 . ]" 2
1018 1 101 ASP H 1 104 SER H . . 4.800 4.793 4.667 4.846 0.046 7 0 "[ . 1 . ]" 2
1019 1 101 ASP HA 1 102 GLU H . . 4.900 3.518 3.440 3.628 . 0 0 "[ . 1 . ]" 2
1020 1 101 ASP HB3 1 102 GLU H . . 4.700 2.730 2.425 3.245 . 0 0 "[ . 1 . ]" 2
1021 1 101 ASP HB2 1 102 GLU H . . 4.300 3.607 2.317 3.929 . 0 0 "[ . 1 . ]" 2
1022 1 101 ASP HB2 1 103 PHE H . . 6.500 5.860 4.769 6.494 . 0 0 "[ . 1 . ]" 2
1023 1 102 GLU H 1 103 PHE H . . 3.900 2.756 2.581 3.084 . 0 0 "[ . 1 . ]" 2
1024 1 102 GLU H 1 103 PHE QB . . 7.500 4.412 4.148 4.985 . 0 0 "[ . 1 . ]" 2
1025 1 102 GLU H 1 104 SER H . . 6.500 4.177 3.865 4.475 . 0 0 "[ . 1 . ]" 2
1026 1 102 GLU H 1 105 THR H . . 5.600 5.026 4.675 5.346 . 0 0 "[ . 1 . ]" 2
1027 1 102 GLU HA 1 103 PHE H . . 4.600 3.607 3.581 3.634 . 0 0 "[ . 1 . ]" 2
1028 1 102 GLU HA 1 104 SER H . . 4.800 4.556 4.287 4.745 . 0 0 "[ . 1 . ]" 2
1029 1 102 GLU HA 1 105 THR H . . 4.400 3.727 3.462 4.083 . 0 0 "[ . 1 . ]" 2
1030 1 102 GLU QB 1 103 PHE H . . 5.200 2.152 1.937 2.333 . 0 0 "[ . 1 . ]" 2
1031 1 103 PHE H 1 104 SER H . . 3.800 2.856 2.675 3.007 . 0 0 "[ . 1 . ]" 2
1032 1 103 PHE H 1 106 LEU QB . . 7.500 4.186 3.792 4.386 . 0 0 "[ . 1 . ]" 2
1033 1 103 PHE HA 1 104 SER H . . 3.600 3.501 3.440 3.545 . 0 0 "[ . 1 . ]" 2
1034 1 103 PHE QB 1 104 SER H . . 5.000 2.788 2.501 3.701 . 0 0 "[ . 1 . ]" 2
1035 1 103 PHE QB 1 105 THR H . . 7.500 4.901 4.612 5.918 . 0 0 "[ . 1 . ]" 2
1036 1 103 PHE QD 1 104 SER H . . 8.500 4.247 2.220 4.660 . 0 0 "[ . 1 . ]" 2
1037 1 103 PHE QE 1 104 SER H . . 8.500 6.111 4.048 6.625 . 0 0 "[ . 1 . ]" 2
1038 1 103 PHE QE 1 106 LEU H . . 8.500 7.253 6.919 7.593 . 0 0 "[ . 1 . ]" 2
1039 1 104 SER H 1 105 THR H . . 3.600 2.842 2.652 3.073 . 0 0 "[ . 1 . ]" 2
1040 1 104 SER H 1 105 THR MG . . 6.400 4.317 4.088 4.602 . 0 0 "[ . 1 . ]" 2
1041 1 104 SER H 1 106 LEU H . . 5.600 4.223 3.876 4.405 . 0 0 "[ . 1 . ]" 2
1042 1 104 SER H 1 107 VAL H . . 5.700 5.508 4.988 5.731 0.031 9 0 "[ . 1 . ]" 2
1043 1 104 SER HA 1 105 THR H . . 3.600 3.569 3.500 3.620 0.020 18 0 "[ . 1 . ]" 2
1044 1 104 SER QB 1 105 THR H . . 6.800 2.579 2.143 2.979 . 0 0 "[ . 1 . ]" 2
1045 1 105 THR H 1 105 THR HB . . 3.600 3.638 3.603 3.664 0.064 17 0 "[ . 1 . ]" 2
1046 1 105 THR H 1 105 THR MG . . 4.400 2.615 2.127 2.812 . 0 0 "[ . 1 . ]" 2
1047 1 105 THR H 1 106 LEU H . . 3.800 2.180 2.008 2.698 . 0 0 "[ . 1 . ]" 2
1048 1 105 THR H 1 106 LEU QB . . 6.500 3.612 3.252 4.246 . 0 0 "[ . 1 . ]" 2
1049 1 105 THR H 1 107 VAL H . . 5.700 4.006 3.703 4.459 . 0 0 "[ . 1 . ]" 2
1050 1 105 THR H 1 108 ALA H . . 6.500 4.979 4.639 5.489 . 0 0 "[ . 1 . ]" 2
1051 1 105 THR HA 1 106 LEU H . . 3.800 3.450 3.385 3.498 . 0 0 "[ . 1 . ]" 2
1052 1 105 THR HB 1 106 LEU H . . 5.500 3.825 3.670 4.042 . 0 0 "[ . 1 . ]" 2
1053 1 105 THR HB 1 107 VAL H . . 5.500 5.372 5.122 5.544 0.044 4 0 "[ . 1 . ]" 2
1054 1 105 THR MG 1 106 LEU H . . 4.800 4.035 3.912 4.069 . 0 0 "[ . 1 . ]" 2
1055 1 105 THR MG 1 108 ALA H . . 7.200 4.852 4.509 5.083 . 0 0 "[ . 1 . ]" 2
1056 1 106 LEU H 1 106 LEU HG . . 4.900 4.330 4.192 4.468 . 0 0 "[ . 1 . ]" 2
1057 1 106 LEU H 1 106 LEU MD1 . . 4.000 4.117 3.465 4.420 0.420 8 0 "[ . 1 . ]" 2
1058 1 106 LEU H 1 107 VAL H . . 3.600 2.918 2.798 3.076 . 0 0 "[ . 1 . ]" 2
1059 1 106 LEU H 1 107 VAL HA . . 6.100 5.571 5.457 5.664 . 0 0 "[ . 1 . ]" 2
1060 1 106 LEU H 1 107 VAL MG2 . . 6.600 4.112 3.777 4.984 . 0 0 "[ . 1 . ]" 2
1061 1 106 LEU HA 1 107 VAL H . . 4.400 3.515 3.426 3.653 . 0 0 "[ . 1 . ]" 2
1062 1 106 LEU HA 1 108 ALA H . . 4.500 4.200 3.928 4.422 . 0 0 "[ . 1 . ]" 2
1063 1 106 LEU MD1 1 107 VAL H . . 6.900 3.818 2.865 4.782 . 0 0 "[ . 1 . ]" 2
1064 1 107 VAL H 1 107 VAL HB . . 4.200 3.584 3.513 3.672 . 0 0 "[ . 1 . ]" 2
1065 1 107 VAL H 1 107 VAL MG1 . . 4.100 2.395 2.198 2.608 . 0 0 "[ . 1 . ]" 2
1066 1 107 VAL H 1 108 ALA H . . 3.600 2.447 2.251 2.604 . 0 0 "[ . 1 . ]" 2
1067 1 107 VAL H 1 109 GLU H . . 5.500 4.131 3.807 4.352 . 0 0 "[ . 1 . ]" 2
1068 1 107 VAL H 1 110 SER H . . 6.100 4.513 3.947 5.413 . 0 0 "[ . 1 . ]" 2
1069 1 107 VAL HA 1 108 ALA H . . 4.800 3.335 3.174 3.404 . 0 0 "[ . 1 . ]" 2
1070 1 107 VAL HA 1 110 SER H . . 6.500 2.993 2.659 3.391 . 0 0 "[ . 1 . ]" 2
1071 1 107 VAL HB 1 108 ALA H . . 4.000 4.067 4.029 4.119 0.119 7 0 "[ . 1 . ]" 2
1072 1 107 VAL MG1 1 108 ALA H . . 5.900 4.094 3.886 4.207 . 0 0 "[ . 1 . ]" 2
1073 1 107 VAL MG2 1 108 ALA H . . 5.400 2.517 2.332 2.679 . 0 0 "[ . 1 . ]" 2
1074 1 108 ALA H 1 108 ALA MB . . 3.400 2.307 2.205 2.403 . 0 0 "[ . 1 . ]" 2
1075 1 108 ALA H 1 109 GLU QG . . 7.500 4.289 3.252 5.320 . 0 0 "[ . 1 . ]" 2
1076 1 108 ALA HA 1 109 GLU H . . 3.700 3.579 3.491 3.630 . 0 0 "[ . 1 . ]" 2
1077 1 108 ALA MB 1 109 GLU H . . 3.600 2.573 2.249 2.954 . 0 0 "[ . 1 . ]" 2
1078 1 109 GLU H 1 109 GLU HB2 . . 4.400 2.535 2.037 3.696 . 0 0 "[ . 1 . ]" 2
1079 1 109 GLU H 1 109 GLU HB3 . . 3.700 3.391 2.580 3.669 . 0 0 "[ . 1 . ]" 2
1080 1 109 GLU H 1 110 SER H . . 3.900 2.689 2.524 2.825 . 0 0 "[ . 1 . ]" 2
1081 1 109 GLU HA 1 110 SER H . . 4.200 3.489 3.300 3.628 . 0 0 "[ . 1 . ]" 2
1082 1 109 GLU HB2 1 110 SER H . . 5.800 3.335 2.768 4.363 . 0 0 "[ . 1 . ]" 2
1083 1 109 GLU HB3 1 110 SER H . . 4.900 3.894 3.045 4.342 . 0 0 "[ . 1 . ]" 2
1084 1 109 GLU QG 1 110 SER H . . 7.500 4.152 2.467 4.675 . 0 0 "[ . 1 . ]" 2
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