NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
552904 |
2lxc   |
18671 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lxc
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 3819
_Distance_constraint_stats_list.Viol_count 3423
_Distance_constraint_stats_list.Viol_total 11095.058
_Distance_constraint_stats_list.Viol_max 3.354
_Distance_constraint_stats_list.Viol_rms 0.1490
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0291
_Distance_constraint_stats_list.Viol_average_violations_only 0.3241
_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 5.738 0.894 2 3 "[ + *- 1]"
1 2 VAL 2.365 0.636 5 2 "[ +- 1]"
1 3 HIS 0.000 0.000 . 0 "[ . 1]"
1 4 LEU 5.057 0.965 2 1 "[ + . 1]"
1 5 THR 4.282 0.453 6 0 "[ . 1]"
1 6 LEU 18.262 2.296 9 8 "[ ***** -+*]"
1 7 LYS 47.092 1.992 7 9 "[***** +-**]"
1 8 LYS 24.128 1.723 8 10 [****-**+**]
1 9 ILE 64.461 2.384 3 10 [**+-******]
1 10 GLN 26.314 2.135 4 9 "[* *+-*****]"
1 11 ALA 28.807 1.983 1 9 "[+ **-*****]"
1 12 PRO 0.835 0.325 3 0 "[ . 1]"
1 13 LYS 54.351 2.135 4 9 "[* *+******]"
1 14 PHE 14.712 1.936 10 6 "[ * - ***+]"
1 15 SER 3.784 0.453 6 0 "[ . 1]"
1 16 ILE 19.421 2.947 9 7 "[ ***.* *+*]"
1 17 GLU 0.400 0.193 2 0 "[ . 1]"
1 18 HIS 23.539 2.947 9 6 "[ **.- *+*]"
1 19 ASP 0.441 0.224 2 0 "[ . 1]"
1 20 PHE 9.053 1.191 2 3 "[ + * - 1]"
1 21 SER 0.820 0.328 4 0 "[ . 1]"
1 22 PRO 0.308 0.106 2 0 "[ . 1]"
1 23 SER 0.178 0.098 7 0 "[ . 1]"
1 24 ASP 6.099 0.738 2 5 "[ +**. - *1]"
1 25 THR 16.125 2.116 5 6 "[*- +* **1]"
1 26 ILE 3.632 0.345 5 0 "[ . 1]"
1 27 LEU 14.543 1.452 1 6 "[+ *** -*1]"
1 28 GLN 15.326 1.353 6 4 "[ * *.+ - 1]"
1 29 ILE 2.999 0.315 8 0 "[ . 1]"
1 30 LYS 2.490 1.514 1 1 "[+ . 1]"
1 31 GLN 14.646 1.308 8 6 "[* * *- +*1]"
1 32 HIS 0.000 0.000 . 0 "[ . 1]"
1 33 LEU 19.033 2.296 9 7 "[ ***.* *+*]"
1 34 ILE 9.877 1.097 1 7 "[+ ** ***-]"
1 35 SER 2.218 0.482 7 0 "[ . 1]"
1 36 GLU 4.651 0.852 6 1 "[ .+ 1]"
1 37 GLU 0.149 0.149 3 0 "[ . 1]"
1 38 LYS 0.149 0.149 3 0 "[ . 1]"
1 39 ALA 0.723 0.262 5 0 "[ . 1]"
1 40 SER 2.880 0.407 4 0 "[ . 1]"
1 41 HIS 7.521 0.920 9 6 "[ ** **+-]"
1 42 ILE 20.131 1.514 1 5 "[+ * .- **1]"
1 43 SER 3.336 1.440 1 1 "[+ . 1]"
1 44 GLU 14.581 1.234 5 8 "[* **+** *-]"
1 45 ILE 0.618 0.287 5 0 "[ . 1]"
1 46 LYS 23.903 3.354 5 9 "[* **+***-*]"
1 47 LEU 8.537 0.609 5 1 "[ + 1]"
1 48 LEU 39.356 1.683 5 10 [-***+*****]
1 49 LEU 36.399 3.107 2 10 [*+***-****]
1 50 LYS 48.713 3.107 2 10 [*+****-***]
1 51 GLY 1.983 0.510 1 1 "[+ . 1]"
1 52 LYS 26.158 1.607 1 10 [+*******-*]
1 53 VAL 34.126 3.354 5 9 "[* **+***-*]"
1 54 LEU 23.284 1.607 1 6 "[+* *** * 1]"
1 55 HIS 3.491 0.520 5 1 "[ + 1]"
1 56 ASP 1.587 0.412 2 0 "[ . 1]"
1 57 ASN 9.271 2.116 5 5 "[* +* -*1]"
1 58 LEU 3.912 0.680 5 1 "[ + 1]"
1 59 PHE 1.741 0.395 5 0 "[ . 1]"
1 60 LEU 7.786 0.629 4 4 "[ *+. - *1]"
1 61 SER 1.266 0.579 5 1 "[ + 1]"
1 62 ASP 2.869 0.680 5 1 "[ + 1]"
1 63 LEU 9.670 1.592 5 8 "[ **+***-*]"
1 64 LYS 2.954 0.811 5 1 "[ + 1]"
1 65 VAL 1.299 0.674 2 1 "[ + . 1]"
1 66 THR 6.510 0.942 7 4 "[ * +-*1]"
1 67 PRO 4.735 0.942 7 4 "[ * +-*1]"
1 68 ALA 0.557 0.365 2 0 "[ . 1]"
1 69 ASN 19.951 1.979 2 8 "[*+ *-*** *]"
1 70 SER 1.240 0.674 2 2 "[ + - 1]"
1 71 THR 5.694 2.383 9 3 "[ * -. +1]"
1 72 ILE 10.914 1.448 7 6 "[ ** .*+- *]"
1 73 THR 21.520 2.384 3 10 [-*+*******]
1 74 VAL 0.093 0.047 3 0 "[ . 1]"
1 75 MET 10.155 1.683 5 8 "[- **+****1]"
1 76 ILE 20.556 1.936 10 10 [*-*******+]
1 77 LYS 6.660 0.679 8 2 "[ - . + 1]"
1 78 PRO 17.171 1.359 10 10 [*-*******+]
1 79 ASN 6.194 0.516 9 2 "[ . +-]"
1 80 LEU 8.615 0.835 6 3 "[* -+ 1]"
1 81 GLU 3.097 0.472 10 0 "[ . 1]"
2 3 ASP 2.425 0.863 1 3 "[+ - *]"
2 4 SER 3.667 0.863 1 3 "[+ - *]"
2 5 ALA 5.282 0.707 5 2 "[ -+ 1]"
2 6 SER 0.694 0.225 2 0 "[ . 1]"
2 7 LYS 12.718 1.310 9 7 "[*- *.***+1]"
2 8 GLU 6.481 0.624 6 2 "[ .+ -]"
2 9 GLU 3.559 0.889 4 1 "[ +. 1]"
2 10 ILE 14.495 0.967 5 5 "[ +-* **]"
2 11 ALA 10.714 1.378 5 5 "[*- *+ *]"
2 13 LEU 26.460 2.093 7 10 [**-***+***]
2 14 ILE 27.123 2.093 7 10 [*-****+***]
2 15 VAL 26.982 1.437 9 10 [***-****+*]
2 16 ASN 2.400 0.700 5 1 "[ + 1]"
2 17 TYR 4.870 0.485 9 0 "[ . 1]"
2 18 PHE 3.080 0.481 9 0 "[ . 1]"
2 19 SER 10.377 1.015 9 8 "[ ******+-]"
2 20 SER 0.640 0.457 9 0 "[ . 1]"
2 21 ILE 28.675 1.008 2 9 "[*+*** **-*]"
2 22 VAL 33.394 1.659 2 10 [*+***-****]
2 23 GLU 2.959 1.019 1 1 "[+ . 1]"
2 24 LYS 6.958 0.944 4 4 "[* +. *-]"
2 25 LYS 6.056 1.019 1 3 "[+ *. -]"
2 26 GLU 6.120 0.823 1 3 "[+ . *-]"
2 27 ILE 39.103 1.992 2 9 "[*+*** **-*]"
2 28 SER 8.320 1.436 7 6 "[ * *.-+* *]"
2 29 GLU 0.271 0.071 1 0 "[ . 1]"
2 30 ASP 0.405 0.146 5 0 "[ . 1]"
2 31 GLY 0.784 0.182 2 0 "[ . 1]"
2 32 ALA 6.073 1.992 2 3 "[ + . * -]"
2 33 ASP 0.000 0.000 . 0 "[ . 1]"
2 34 SER 0.000 0.000 . 0 "[ . 1]"
2 35 LEU 13.433 0.913 10 3 "[* .- +]"
2 36 ASN 17.091 1.639 3 8 "[ +******-]"
2 37 VAL 14.416 0.709 2 5 "[*+ -.* * 1]"
2 38 ALA 14.806 1.649 2 4 "[ + *. * -]"
2 39 MET 10.886 0.639 4 2 "[ +. - 1]"
2 40 ASP 1.400 0.268 2 0 "[ . 1]"
2 41 CYS 13.568 0.757 8 9 [-***.**+**]
2 42 ILE 14.034 0.892 4 4 "[-* +. * 1]"
2 43 SER 12.847 0.757 8 9 [****.-*+**]
2 44 GLU 0.496 0.496 1 0 "[ . 1]"
2 45 ALA 1.451 0.387 6 0 "[ . 1]"
2 46 PHE 23.224 1.310 9 10 [*-******+*]
2 47 GLY 0.000 0.000 . 0 "[ . 1]"
2 48 PHE 11.486 0.500 6 0 "[ . 1]"
2 49 GLU 5.302 1.138 4 2 "[ - +. 1]"
2 50 ARG 11.282 1.437 9 7 "[** *** +*]"
2 51 GLU 3.023 0.521 9 1 "[ . +1]"
2 52 ALA 5.099 1.138 4 1 "[ +. 1]"
2 53 VAL 25.054 1.161 1 10 [+**-******]
2 54 SER 7.458 0.748 4 10 [***+*****-]
2 55 GLY 0.545 0.081 3 0 "[ . 1]"
2 56 ILE 26.406 1.070 4 10 [***+******]
2 57 LEU 25.214 1.161 1 10 [+*******-*]
2 58 GLY 8.026 0.549 10 5 "[* ** -+]"
2 59 LYS 0.000 0.000 . 0 "[ . 1]"
2 62 PHE 6.062 1.002 2 2 "[ + -. 1]"
2 64 GLY 0.000 0.000 . 0 "[ . 1]"
2 66 HIS 0.074 0.074 4 0 "[ . 1]"
2 70 ILE 4.782 0.700 4 3 "[ +- *]"
2 73 SER 1.788 0.585 10 2 "[ - +]"
2 74 ALA 0.444 0.198 4 0 "[ . 1]"
3 3 ASP 2.997 0.809 10 4 "[* * -+]"
3 4 SER 5.150 0.809 10 4 "[* * -+]"
3 5 ALA 5.471 0.553 4 1 "[ +. 1]"
3 6 SER 0.453 0.120 2 0 "[ . 1]"
3 7 LYS 15.903 1.011 10 6 "[- *** *+]"
3 8 GLU 10.998 1.011 10 5 "[-* .* *+]"
3 9 GLU 5.697 1.102 9 3 "[ -.* +1]"
3 10 ILE 12.613 1.007 9 4 "[* * * +1]"
3 11 ALA 12.597 1.067 7 6 "[ ** .*+*-1]"
3 13 LEU 22.527 2.097 1 9 "[+**** -***]"
3 14 ILE 29.351 2.097 1 10 [+*******-*]
3 15 VAL 29.377 2.278 9 9 [****.***+-]
3 16 ASN 4.598 1.548 9 2 "[ . -+1]"
3 17 TYR 5.047 0.406 8 0 "[ . 1]"
3 18 PHE 4.177 0.530 3 1 "[ + . 1]"
3 19 SER 13.275 1.330 4 9 "[** +*****-]"
3 20 SER 0.396 0.396 6 0 "[ . 1]"
3 21 ILE 30.531 0.967 5 9 "[**- +*****]"
3 22 VAL 24.418 1.574 4 10 [***+*****-]
3 23 GLU 2.140 0.397 9 0 "[ . 1]"
3 24 LYS 6.838 0.743 7 3 "[- . +* 1]"
3 25 LYS 4.765 0.541 7 1 "[ . + 1]"
3 26 GLU 5.753 0.504 1 1 "[+ . 1]"
3 27 ILE 31.150 1.351 1 10 [+********-]
3 28 SER 9.406 1.097 3 9 "[* +**-****]"
3 29 GLU 1.197 0.977 3 1 "[ + . 1]"
3 30 ASP 0.235 0.079 7 0 "[ . 1]"
3 31 GLY 2.266 0.387 6 0 "[ . 1]"
3 32 ALA 5.694 0.697 1 4 "[+ - .* * 1]"
3 33 ASP 0.140 0.140 10 0 "[ . 1]"
3 34 SER 0.000 0.000 . 0 "[ . 1]"
3 35 LEU 8.663 0.725 1 2 "[+ . -]"
3 36 ASN 15.939 1.574 4 9 "[*- +******]"
3 37 VAL 18.174 0.812 1 10 [+****-****]
3 38 ALA 13.586 0.896 4 4 "[ * +. * -]"
3 39 MET 10.021 1.031 1 4 "[+ ** -]"
3 40 ASP 2.781 0.274 5 0 "[ . 1]"
3 41 CYS 17.789 1.224 7 10 [-*****+***]
3 42 ILE 20.405 1.649 2 4 "[ + *. * -]"
3 43 SER 15.423 1.224 7 8 [****.-+**1]
3 44 GLU 0.039 0.039 3 0 "[ . 1]"
3 45 ALA 0.444 0.182 2 0 "[ . 1]"
3 46 PHE 18.414 1.436 7 8 "[ ****-+* *]"
3 47 GLY 0.000 0.000 . 0 "[ . 1]"
3 48 PHE 14.655 1.786 9 5 "[ * . *-+*]"
3 49 GLU 5.439 0.670 3 3 "[- + . *1]"
3 50 ARG 17.321 1.448 10 7 "[* -*.* **+]"
3 51 GLU 3.373 0.690 8 2 "[ - . + 1]"
3 52 ALA 5.568 0.670 3 3 "[- + . *1]"
3 53 VAL 31.733 2.384 9 9 "[*-*** **+*]"
3 54 SER 6.350 0.700 4 6 "[*- +* ** 1]"
3 55 GLY 0.669 0.090 6 0 "[ . 1]"
3 56 ILE 33.297 2.301 9 9 "[****- **+*]"
3 57 LEU 22.700 2.384 9 5 "[* ** +-]"
3 58 GLY 5.672 0.696 9 2 "[ . +-]"
3 59 LYS 0.300 0.300 1 0 "[ . 1]"
3 62 PHE 4.477 0.685 4 1 "[ +. 1]"
3 64 GLY 0.000 0.000 . 0 "[ . 1]"
3 66 HIS 0.196 0.196 4 0 "[ . 1]"
3 70 ILE 4.322 1.002 2 3 "[-+ . *]"
3 73 SER 1.858 0.678 10 2 "[- . +]"
3 74 ALA 0.541 0.241 4 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 48 LEU QD 1 73 THR H 5.156 2.498 7.814 4.920 4.527 5.268 . 0 0 "[ . 1]" 1
2 1 48 LEU H 1 48 LEU QD . 2.146 2.637 3.044 2.424 3.656 1.019 10 4 "[* - *+]" 1
3 1 47 LEU H 1 48 LEU QD 2.663 . 6.000 4.233 3.606 5.337 . 0 0 "[ . 1]" 1
4 1 48 LEU QD 1 52 LYS H 3.964 2.392 5.536 4.092 3.421 4.634 . 0 0 "[ . 1]" 1
5 1 30 LYS H 1 47 LEU QD 3.401 2.244 4.558 3.972 3.700 4.111 . 0 0 "[ . 1]" 1
6 1 48 LEU HA 1 48 LEU QD 2.420 . 3.006 1.940 1.871 2.083 . 0 0 "[ . 1]" 1
7 1 48 LEU QD 1 51 GLY HA3 3.430 2.488 6.000 4.291 3.528 4.877 . 0 0 "[ . 1]" 1
8 1 48 LEU QD 1 75 MET QG . . 2.168 3.061 2.263 3.851 1.683 5 8 "[- **+****1]" 1
9 1 48 LEU QD 1 53 VAL HB 2.449 . 6.000 3.079 2.501 4.234 . 0 0 "[ . 1]" 1
10 1 48 LEU QD 1 48 LEU HG 1.841 . 2.179 1.884 1.872 1.894 . 0 0 "[ . 1]" 1
11 1 30 LYS QB 1 47 LEU QD 3.887 2.376 5.398 4.014 3.830 4.265 . 0 0 "[ . 1]" 1
12 1 30 LYS HA 1 47 LEU QD 3.508 2.278 4.738 3.588 3.393 3.888 . 0 0 "[ . 1]" 1
13 1 26 ILE HA 1 47 LEU QD 3.397 2.243 4.551 4.578 4.065 4.852 0.301 7 0 "[ . 1]" 1
14 1 47 LEU HA 1 47 LEU QD . 2.147 2.561 1.954 1.876 2.056 0.271 6 0 "[ . 1]" 1
15 1 26 ILE MD 1 26 ILE HG12 1.933 . 2.307 2.117 2.113 2.125 . 0 0 "[ . 1]" 1
16 1 26 ILE MD 1 26 ILE HG13 1.879 . 2.232 2.119 2.112 2.123 . 0 0 "[ . 1]" 1
17 1 26 ILE HB 1 26 ILE MD 3.018 2.107 3.929 3.233 3.219 3.239 . 0 0 "[ . 1]" 1
18 1 26 ILE HA 1 26 ILE MD 2.026 . 2.437 2.075 1.992 2.145 . 0 0 "[ . 1]" 1
19 1 26 ILE MD 1 60 LEU HA 3.017 2.107 3.927 3.671 3.505 3.879 . 0 0 "[ . 1]" 1
20 1 26 ILE MD 1 60 LEU H 3.909 2.381 5.437 4.226 4.045 4.575 . 0 0 "[ . 1]" 1
21 1 26 ILE H 1 26 ILE MD 3.096 2.137 4.055 2.959 2.706 3.276 . 0 0 "[ . 1]" 1
22 1 25 THR HA 1 26 ILE MD 4.029 2.406 5.652 3.992 3.736 4.449 . 0 0 "[ . 1]" 1
23 1 26 ILE MD 1 29 ILE HG12 4.182 2.433 5.931 4.619 4.396 4.834 . 0 0 "[ . 1]" 1
24 1 72 ILE H 1 72 ILE MD 3.595 2.303 4.887 3.417 2.887 3.795 . 0 0 "[ . 1]" 1
25 1 48 LEU H 1 72 ILE MD 3.608 2.306 4.910 5.539 4.885 6.358 1.448 7 6 "[ ** .*+- *]" 1
26 1 49 LEU H 1 72 ILE MD 4.089 2.417 5.761 5.218 4.723 6.151 0.390 7 0 "[ . 1]" 1
27 1 71 THR H 1 72 ILE MD 3.539 2.287 4.791 4.085 3.564 4.508 . 0 0 "[ . 1]" 1
28 1 49 LEU HA 1 72 ILE MD 2.971 2.088 3.854 3.485 3.047 4.203 0.349 7 0 "[ . 1]" 1
29 1 72 ILE HA 1 72 ILE MD 2.118 . 2.566 2.299 2.052 2.893 0.327 7 0 "[ . 1]" 1
30 1 65 VAL HA 1 72 ILE MD 3.234 . 6.000 4.563 4.246 5.080 . 0 0 "[ . 1]" 1
31 1 34 ILE MD 1 40 SER H 4.180 2.433 5.927 5.273 4.602 5.642 . 0 0 "[ . 1]" 1
32 1 34 ILE H 1 34 ILE MD 3.187 2.171 4.203 3.465 3.360 3.741 . 0 0 "[ . 1]" 1
33 1 34 ILE MD 1 41 HIS HB2 4.094 2.418 5.770 5.363 4.684 5.812 0.042 9 0 "[ . 1]" 1
34 1 34 ILE HB 1 34 ILE MD 2.126 . 2.578 2.391 2.296 2.563 . 0 0 "[ . 1]" 1
35 1 34 ILE MD 1 41 HIS HA 2.191 . 2.671 3.088 2.281 3.591 0.920 9 6 "[ ** **+-]" 1
36 1 34 ILE HA 1 34 ILE MD 2.893 2.056 3.730 3.890 3.776 3.949 0.219 5 0 "[ . 1]" 1
37 1 34 ILE MD 1 42 ILE HA 2.294 . 2.820 2.629 2.239 3.010 0.190 1 0 "[ . 1]" 1
38 1 20 PHE QD 1 29 ILE MD 3.965 2.393 5.537 3.775 3.284 4.188 . 0 0 "[ . 1]" 1
39 1 20 PHE QE 1 29 ILE MD 4.261 2.446 6.076 3.680 3.149 4.052 . 0 0 "[ . 1]" 1
40 1 26 ILE HA 1 29 ILE MD 2.203 . 2.688 2.311 2.072 2.658 . 0 0 "[ . 1]" 1
41 1 26 ILE HB 1 29 ILE MD 3.759 2.346 5.172 4.598 4.354 4.905 . 0 0 "[ . 1]" 1
42 1 29 ILE HB 1 29 ILE MD 2.252 . 2.759 2.420 2.351 2.475 . 0 0 "[ . 1]" 1
43 1 29 ILE MD 1 29 ILE HG13 1.966 . 2.352 2.118 2.102 2.126 . 0 0 "[ . 1]" 1
44 1 6 LEU HB2 1 16 ILE MD 3.052 2.121 3.983 3.221 2.979 3.511 . 0 0 "[ . 1]" 1
45 1 16 ILE HB 1 16 ILE MD 2.142 . 2.601 2.399 2.329 2.505 . 0 0 "[ . 1]" 1
46 1 16 ILE MD 1 16 ILE HG13 1.733 . 2.033 2.119 2.114 2.125 0.092 3 0 "[ . 1]" 1
47 1 16 ILE MD 1 33 LEU HA 3.199 2.175 4.223 4.566 4.252 4.979 0.756 10 3 "[ * . -+]" 1
48 1 16 ILE MD 1 18 HIS HE1 2.858 2.041 3.675 4.221 1.979 6.622 2.947 9 6 "[ **.- *+*]" 1
49 1 6 LEU H 1 16 ILE MD 4.829 2.497 7.161 4.692 4.544 4.956 . 0 0 "[ . 1]" 1
50 1 14 PHE QE 1 16 ILE MD 3.969 2.394 5.544 2.792 2.008 3.510 0.386 10 0 "[ . 1]" 1
51 1 16 ILE MD 1 20 PHE HZ 4.375 2.461 6.289 5.314 4.469 7.298 1.009 2 1 "[ + . 1]" 1
52 1 9 ILE H 1 9 ILE MD 1.941 . 2.318 3.512 2.322 3.798 1.480 3 9 "[* +**-****]" 1
53 1 31 GLN H 1 42 ILE MD 3.341 2.225 4.457 4.239 3.212 5.635 1.178 1 1 "[+ . 1]" 1
54 1 9 ILE MD 1 10 GLN H 3.031 2.112 3.950 4.338 4.035 4.719 0.769 5 2 "[ + -1]" 1
55 1 31 GLN QE 1 42 ILE MD 3.240 2.190 3.270 3.600 2.383 4.442 1.172 8 5 "[* * .- +*1]" 1
56 1 9 ILE MD 1 73 THR HB 1.812 . 2.140 3.926 3.013 4.524 2.384 3 10 [**+******-] 1
57 1 27 LEU HA 1 42 ILE MD 2.555 . 3.208 3.483 3.096 4.660 1.452 1 2 "[+ . -1]" 1
58 1 30 LYS HA 1 45 ILE MD 2.672 . 3.386 2.743 2.511 2.978 . 0 0 "[ . 1]" 1
59 1 45 ILE H 1 45 ILE MD 3.746 2.343 5.149 3.809 3.730 3.895 . 0 0 "[ . 1]" 1
60 1 40 SER H 1 45 ILE MD 3.645 2.316 4.974 4.328 3.936 4.755 . 0 0 "[ . 1]" 1
61 1 11 ALA MB 1 12 PRO HB2 3.607 2.306 4.908 4.830 4.680 4.958 0.050 5 0 "[ . 1]" 1
62 1 11 ALA MB 1 13 LYS QE 3.057 2.123 3.991 5.238 2.944 5.974 1.983 1 9 "[+ **-*****]" 1
63 1 11 ALA MB 1 12 PRO HA 2.341 . 2.889 2.416 2.319 2.564 . 0 0 "[ . 1]" 1
64 1 11 ALA MB 1 12 PRO HD2 3.514 2.279 4.749 4.632 4.520 4.723 . 0 0 "[ . 1]" 1
65 1 11 ALA H 1 11 ALA MB 1.847 . 2.188 2.252 2.237 2.270 0.082 7 0 "[ . 1]" 1
66 1 11 ALA MB 1 13 LYS H 2.716 . 3.454 3.465 3.195 3.874 0.420 5 0 "[ . 1]" 1
67 1 15 SER HA 1 16 ILE MG 3.416 2.249 4.583 4.059 3.838 4.314 . 0 0 "[ . 1]" 1
68 1 16 ILE HA 1 16 ILE MG 2.129 . 2.582 2.288 2.155 2.393 . 0 0 "[ . 1]" 1
69 1 16 ILE H 1 16 ILE MG 2.819 2.024 3.614 3.065 2.819 3.353 . 0 0 "[ . 1]" 1
70 1 16 ILE MG 1 17 GLU H 3.207 2.178 4.236 3.564 3.316 3.722 . 0 0 "[ . 1]" 1
71 1 14 PHE QD 1 16 ILE MG 2.937 2.075 3.799 2.677 1.996 3.892 0.093 2 0 "[ . 1]" 1
72 1 26 ILE MG 1 55 HIS HA 3.344 . 6.000 4.784 4.376 5.127 . 0 0 "[ . 1]" 1
73 1 26 ILE MG 1 56 ASP HA 2.608 . 3.288 3.190 2.459 3.497 0.209 10 0 "[ . 1]" 1
74 1 26 ILE MG 1 27 LEU HA 3.494 2.273 4.715 3.887 3.536 4.015 . 0 0 "[ . 1]" 1
75 1 26 ILE HB 1 26 ILE MG 2.006 . 2.409 2.122 2.109 2.132 . 0 0 "[ . 1]" 1
76 1 76 ILE HA 1 76 ILE MG 2.176 . 2.650 2.309 2.229 2.452 . 0 0 "[ . 1]" 1
77 1 76 ILE MG 1 77 LYS HA 3.272 2.202 4.342 3.818 3.647 4.075 . 0 0 "[ . 1]" 1
78 1 40 SER HA 1 76 ILE MG 3.596 2.303 4.889 4.998 4.290 5.296 0.407 4 0 "[ . 1]" 1
79 1 39 ALA HA 1 76 ILE MG 2.559 . 3.214 2.438 2.174 2.798 . 0 0 "[ . 1]" 1
80 1 76 ILE MG 1 78 PRO QD . 2.377 2.746 3.769 3.246 4.105 1.359 10 10 [*-*******+] 1
81 1 8 LYS QE 1 76 ILE MG 3.340 2.225 4.455 3.601 3.105 3.735 . 0 0 "[ . 1]" 1
82 1 40 SER H 1 76 ILE MG 2.931 2.072 3.790 2.563 1.942 2.834 0.130 5 0 "[ . 1]" 1
83 1 1 MET HA 1 1 MET ME 3.100 2.139 4.061 4.153 2.856 4.700 0.639 5 1 "[ + 1]" 1
84 1 20 PHE QD 1 29 ILE MG 4.563 2.481 6.645 4.724 3.690 4.929 . 0 0 "[ . 1]" 1
85 1 20 PHE QE 1 29 ILE MG 3.928 2.385 5.471 3.393 2.597 3.695 . 0 0 "[ . 1]" 1
86 1 20 PHE HZ 1 29 ILE MG 3.113 2.144 4.082 3.175 2.802 3.344 . 0 0 "[ . 1]" 1
87 1 29 ILE MG 1 47 LEU HA 4.651 2.488 6.814 6.214 5.885 6.679 . 0 0 "[ . 1]" 1
88 1 6 LEU HA 1 29 ILE MG 4.052 2.410 5.694 5.006 4.692 5.394 . 0 0 "[ . 1]" 1
89 1 29 ILE HA 1 29 ILE MG 2.300 . 2.829 2.360 2.296 2.439 . 0 0 "[ . 1]" 1
90 1 29 ILE HB 1 29 ILE MG 1.952 . 2.333 2.126 2.114 2.133 . 0 0 "[ . 1]" 1
91 1 2 VAL QG 1 21 SER HA 3.156 2.160 4.152 3.740 3.465 3.995 . 0 0 "[ . 1]" 1
92 1 2 VAL QG 1 22 PRO HA 2.454 . 3.056 2.549 2.070 2.872 . 0 0 "[ . 1]" 1
93 1 2 VAL QG 1 22 PRO HD3 2.806 2.019 3.593 2.794 2.381 3.207 . 0 0 "[ . 1]" 1
94 1 2 VAL HA 1 2 VAL QG 3.107 2.142 3.382 2.173 2.092 2.334 0.050 7 0 "[ . 1]" 1
95 1 5 THR MG 1 17 GLU HG2 2.395 . 2.969 2.094 1.907 2.468 . 0 0 "[ . 1]" 1
96 1 5 THR MG 1 17 GLU HG3 3.073 2.129 4.017 2.473 2.062 3.177 0.067 9 0 "[ . 1]" 1
97 1 5 THR MG 1 17 GLU HA 3.020 2.108 3.932 3.212 2.889 3.517 . 0 0 "[ . 1]" 1
98 1 5 THR HB 1 5 THR MG 2.041 . 2.458 2.135 2.133 2.138 . 0 0 "[ . 1]" 1
99 1 5 THR MG 1 15 SER HB3 2.631 . 3.323 3.465 3.109 3.776 0.453 6 0 "[ . 1]" 1
100 1 71 THR HA 1 71 THR MG 2.313 . 2.848 2.287 2.112 2.392 . 0 0 "[ . 1]" 1
101 1 71 THR HB 1 71 THR MG 1.941 . 2.318 2.133 2.127 2.138 . 0 0 "[ . 1]" 1
102 1 71 THR MG 1 72 ILE H 2.718 . 3.457 2.869 2.599 3.585 0.128 2 0 "[ . 1]" 1
103 1 7 LYS H 1 71 THR MG 3.496 2.274 4.718 3.874 3.501 4.838 0.120 2 0 "[ . 1]" 1
104 1 49 LEU H 1 54 LEU QD 2.670 . 3.383 2.918 2.550 3.350 . 0 0 "[ . 1]" 1
105 1 54 LEU QD 1 55 HIS H 3.495 2.273 4.717 3.695 3.484 3.909 . 0 0 "[ . 1]" 1
106 1 53 VAL H 1 54 LEU QD 3.998 2.399 5.597 4.454 4.248 5.124 . 0 0 "[ . 1]" 1
107 1 54 LEU HA 1 54 LEU QD 2.197 . 2.680 2.231 1.984 2.883 0.203 1 0 "[ . 1]" 1
108 1 53 VAL HA 1 54 LEU QD 2.920 2.067 3.773 3.562 2.928 4.265 0.492 2 0 "[ . 1]" 1
109 1 52 LYS QE 1 54 LEU QD 2.345 . 6.000 4.258 3.622 4.675 . 0 0 "[ . 1]" 1
110 1 5 THR MG 1 6 LEU H 2.423 . 3.010 3.019 2.944 3.116 0.106 2 0 "[ . 1]" 1
111 1 5 THR MG 1 16 ILE H 2.943 2.077 3.809 3.901 3.602 4.126 0.317 6 0 "[ . 1]" 1
112 1 5 THR MG 1 7 LYS H 3.443 2.258 4.628 4.405 4.143 4.660 0.032 7 0 "[ . 1]" 1
113 1 5 THR H 1 5 THR MG 3.497 2.274 4.720 3.820 3.808 3.841 . 0 0 "[ . 1]" 1
114 1 48 LEU H 1 53 VAL QG 3.294 . 6.000 5.528 5.102 5.813 . 0 0 "[ . 1]" 1
115 1 53 VAL QG 1 54 LEU H 2.153 . 2.617 2.484 2.191 3.296 0.679 1 1 "[+ . 1]" 1
116 1 25 THR H 1 25 THR MG 2.536 . 3.179 3.621 3.124 3.861 0.682 6 6 "[*- *+ **1]" 1
117 1 25 THR MG 1 59 PHE QD 2.603 . 3.280 3.102 2.301 3.675 0.395 5 0 "[ . 1]" 1
118 1 39 ALA MB 1 41 HIS H 3.166 2.164 4.168 3.342 2.704 3.674 . 0 0 "[ . 1]" 1
119 1 39 ALA MB 1 40 SER H 2.374 . 2.937 2.620 2.311 2.911 . 0 0 "[ . 1]" 1
120 1 38 LYS H 1 39 ALA MB 3.958 2.392 5.524 3.892 3.799 4.029 . 0 0 "[ . 1]" 1
121 1 73 THR MG 1 74 VAL H 3.340 2.225 4.455 3.168 2.717 3.415 . 0 0 "[ . 1]" 1
122 1 9 ILE H 1 73 THR MG 3.636 2.314 4.958 3.829 3.432 4.055 . 0 0 "[ . 1]" 1
123 1 39 ALA HA 1 39 ALA MB 1.957 . 2.340 2.127 2.112 2.135 . 0 0 "[ . 1]" 1
124 1 34 ILE HA 1 39 ALA MB 2.368 . 2.929 2.288 1.977 2.554 . 0 0 "[ . 1]" 1
125 1 66 THR HA 1 66 THR MG 2.090 . 2.527 2.136 1.961 2.209 . 0 0 "[ . 1]" 1
126 1 66 THR MG 1 67 PRO HD2 3.148 2.157 4.139 2.550 2.103 3.386 0.054 2 0 "[ . 1]" 1
127 1 73 THR HB 1 73 THR MG 2.019 . 2.427 2.133 2.121 2.139 . 0 0 "[ . 1]" 1
128 1 73 THR HA 1 73 THR MG 2.062 . 2.487 2.154 2.088 2.227 . 0 0 "[ . 1]" 1
129 1 33 LEU HB2 1 39 ALA MB 2.621 . 3.308 2.632 2.407 3.225 . 0 0 "[ . 1]" 1
130 1 66 THR MG 1 69 ASN HB3 4.205 2.436 5.974 5.228 3.857 5.980 0.006 6 0 "[ . 1]" 1
131 1 66 THR MG 1 69 ASN HB2 3.725 2.337 5.113 4.134 3.803 4.607 . 0 0 "[ . 1]" 1
132 1 53 VAL HB 1 53 VAL QG 1.768 . 2.081 1.891 1.878 1.898 . 0 0 "[ . 1]" 1
133 1 46 LYS QE 1 53 VAL QG 2.263 . 2.775 3.845 2.820 6.129 3.354 5 8 "[ **+****-]" 1
134 1 25 THR HA 1 25 THR MG 2.198 . 2.681 2.208 2.153 2.326 . 0 0 "[ . 1]" 1
135 1 53 VAL QG 1 55 HIS HA 2.163 . 6.000 4.193 3.461 5.449 . 0 0 "[ . 1]" 1
136 1 25 THR HB 1 25 THR MG 1.793 . 2.114 2.132 2.127 2.135 0.021 3 0 "[ . 1]" 1
137 1 53 VAL HA 1 53 VAL QG 2.062 . 2.487 2.239 2.123 2.342 . 0 0 "[ . 1]" 1
138 1 68 ALA H 1 68 ALA MB 2.352 . 2.905 2.284 2.210 2.365 . 0 0 "[ . 1]" 1
139 1 68 ALA MB 1 69 ASN QD 4.990 2.500 6.082 4.012 2.739 5.806 . 0 0 "[ . 1]" 1
140 1 68 ALA MB 1 69 ASN HA 3.616 2.309 4.923 4.229 4.143 4.283 . 0 0 "[ . 1]" 1
141 1 68 ALA HA 1 68 ALA MB 1.853 . 2.196 2.126 2.121 2.133 . 0 0 "[ . 1]" 1
142 1 67 PRO HD2 1 68 ALA MB 3.705 2.332 5.078 4.048 3.757 4.479 . 0 0 "[ . 1]" 1
143 1 60 LEU H 1 60 LEU QD 3.106 2.142 4.070 2.938 2.631 3.218 . 0 0 "[ . 1]" 1
144 1 26 ILE H 1 60 LEU QD 3.376 2.237 4.515 4.406 3.890 4.860 0.345 5 0 "[ . 1]" 1
145 1 20 PHE QD 1 60 LEU QD 3.926 2.385 5.467 3.390 3.170 3.651 . 0 0 "[ . 1]" 1
146 1 6 LEU QD 1 20 PHE QE 3.464 2.264 4.406 2.467 2.172 3.099 0.092 3 0 "[ . 1]" 1
147 1 6 LEU QD 1 20 PHE HZ 3.107 2.142 3.265 3.587 2.819 4.456 1.191 2 3 "[ + * - 1]" 1
148 1 63 LEU H 1 63 LEU QD 2.411 . 2.992 2.694 2.530 2.830 . 0 0 "[ . 1]" 1
149 1 6 LEU QD 1 72 ILE H 3.453 2.261 4.645 3.575 3.305 4.259 . 0 0 "[ . 1]" 1
150 1 6 LEU QD 1 7 LYS H 3.262 2.451 4.326 3.453 3.225 3.581 . 0 0 "[ . 1]" 1
151 1 63 LEU QD 1 64 LYS H 2.642 . 3.340 2.959 2.789 3.245 . 0 0 "[ . 1]" 1
152 1 63 LEU QD 1 65 VAL H 2.649 . 3.351 3.110 2.849 3.373 0.022 1 0 "[ . 1]" 1
153 1 27 LEU QD 1 31 GLN QE . 2.286 2.632 3.020 2.632 3.940 1.308 8 2 "[ - + 1]" 1
154 1 27 LEU QD 1 31 GLN H 3.827 2.363 5.291 3.510 3.323 3.754 . 0 0 "[ . 1]" 1
155 1 55 HIS H 1 58 LEU HG 2.946 . 6.000 4.294 4.002 5.242 . 0 0 "[ . 1]" 1
156 1 58 LEU H 1 58 LEU HG 3.397 2.243 4.551 4.549 4.434 4.589 0.038 9 0 "[ . 1]" 1
157 1 33 LEU H 1 33 LEU QD 3.686 2.328 4.427 2.899 2.733 3.211 . 0 0 "[ . 1]" 1
158 1 6 LEU QD 1 16 ILE H 3.938 2.387 5.489 4.054 3.895 4.311 . 0 0 "[ . 1]" 1
159 1 6 LEU H 1 6 LEU QD 2.440 2.142 3.035 2.063 1.864 2.213 0.278 5 0 "[ . 1]" 1
160 1 58 LEU HA 1 58 LEU HG 2.273 . 6.000 2.791 2.446 3.096 . 0 0 "[ . 1]" 1
161 1 58 LEU HG 1 62 ASP QB . 2.260 4.638 2.742 2.565 3.169 . 0 0 "[ . 1]" 1
162 1 33 LEU HA 1 33 LEU QD 2.581 2.295 3.247 2.174 2.058 2.274 0.237 5 0 "[ . 1]" 1
163 1 6 LEU QD 1 17 GLU HA 3.718 2.335 5.101 3.436 3.022 3.695 . 0 0 "[ . 1]" 1
164 1 6 LEU HA 1 6 LEU QD . 2.071 2.917 1.932 1.870 2.027 0.201 1 0 "[ . 1]" 1
165 1 6 LEU QD 1 6 LEU HG 1.744 . 2.048 1.889 1.881 1.894 . 0 0 "[ . 1]" 1
166 1 6 LEU QD 1 18 HIS HB2 3.566 2.295 4.837 2.937 2.505 3.517 . 0 0 "[ . 1]" 1
167 1 20 PHE HA 1 60 LEU QD 4.002 2.302 4.886 4.325 4.238 4.513 . 0 0 "[ . 1]" 1
168 1 60 LEU HA 1 60 LEU QD 2.030 . 2.442 2.005 1.909 2.124 . 0 0 "[ . 1]" 1
169 1 24 ASP HB3 1 60 LEU QD . 2.179 2.506 2.846 2.330 3.135 0.629 4 4 "[ *+. - *1]" 1
170 1 25 THR HA 1 60 LEU QD 3.402 2.245 4.559 4.275 3.630 4.785 0.226 5 0 "[ . 1]" 1
171 1 60 LEU QD 1 60 LEU HG 1.702 . 6.000 1.891 1.888 1.895 . 0 0 "[ . 1]" 1
172 1 24 ASP HB2 1 60 LEU QD 3.087 2.134 4.040 2.685 2.417 3.064 . 0 0 "[ . 1]" 1
173 1 20 PHE HB3 1 60 LEU QD 2.158 . 2.624 2.526 2.269 2.822 0.198 3 0 "[ . 1]" 1
174 1 27 LEU QD 1 28 GLN QE 2.872 2.047 3.294 3.528 2.480 4.647 1.353 6 3 "[ *.+ - 1]" 1
175 1 58 LEU H 1 58 LEU QD 3.309 2.214 4.404 3.398 2.932 3.647 . 0 0 "[ . 1]" 1
176 1 58 LEU QD 1 59 PHE H 2.704 . 3.435 2.830 2.175 3.578 0.143 5 0 "[ . 1]" 1
177 1 29 ILE HG12 1 29 ILE MG 2.805 2.018 3.592 2.360 2.292 2.431 . 0 0 "[ . 1]" 1
178 1 29 ILE MD 1 29 ILE HG12 2.736 . 3.485 2.117 2.107 2.131 . 0 0 "[ . 1]" 1
179 1 20 PHE QE 1 29 ILE HG12 5.295 2.491 8.099 3.045 2.616 3.358 . 0 0 "[ . 1]" 1
180 1 20 PHE HZ 1 29 ILE HG12 4.734 2.493 6.975 3.033 2.677 3.519 . 0 0 "[ . 1]" 1
181 1 45 ILE H 1 45 ILE MG 3.539 2.287 4.791 3.833 3.805 3.882 . 0 0 "[ . 1]" 1
182 1 45 ILE MG 1 46 LYS H 2.459 . 3.063 2.750 2.484 2.887 . 0 0 "[ . 1]" 1
183 1 45 ILE MG 1 47 LEU H 3.522 2.281 4.763 3.827 3.706 3.999 . 0 0 "[ . 1]" 1
184 1 30 LYS HA 1 45 ILE MG 2.887 2.053 3.721 2.911 2.684 3.147 . 0 0 "[ . 1]" 1
185 1 45 ILE MG 1 47 LEU HA 3.432 2.254 4.610 4.261 4.105 4.367 . 0 0 "[ . 1]" 1
186 1 45 ILE MG 1 76 ILE HA 3.651 2.318 4.984 4.046 3.751 4.249 . 0 0 "[ . 1]" 1
187 1 45 ILE HA 1 45 ILE MG 2.245 . 2.749 2.382 2.333 2.434 . 0 0 "[ . 1]" 1
188 1 72 ILE H 1 72 ILE MG 3.771 2.349 5.193 3.834 3.782 3.883 . 0 0 "[ . 1]" 1
189 1 48 LEU H 1 72 ILE MG 2.572 . 3.234 3.404 3.095 3.873 0.639 2 1 "[ + . 1]" 1
190 1 6 LEU H 1 16 ILE HB 4.666 2.489 6.843 5.042 4.819 5.248 . 0 0 "[ . 1]" 1
191 1 60 LEU HA 1 60 LEU HB2 3.554 2.291 4.817 3.012 2.998 3.019 . 0 0 "[ . 1]" 1
192 1 60 LEU H 1 60 LEU HB3 4.319 2.453 6.185 3.585 3.558 3.601 . 0 0 "[ . 1]" 1
193 1 60 LEU HA 1 60 LEU HB3 2.869 2.046 3.692 2.504 2.456 2.577 . 0 0 "[ . 1]" 1
194 1 44 GLU H 1 45 ILE HB 5.354 2.488 8.220 4.682 4.476 5.063 . 0 0 "[ . 1]" 1
195 1 79 ASN HB2 1 79 ASN QD 3.833 2.455 5.302 3.172 2.261 3.335 0.194 2 0 "[ . 1]" 1
196 1 79 ASN HB3 1 79 ASN QD 3.895 2.458 5.412 2.472 2.121 3.302 0.337 9 0 "[ . 1]" 1
197 1 79 ASN HB2 1 80 LEU H 3.649 2.317 4.981 3.619 2.622 4.620 . 0 0 "[ . 1]" 1
198 1 79 ASN HB3 1 80 LEU H 4.050 2.410 5.690 4.187 3.819 4.513 . 0 0 "[ . 1]" 1
199 1 79 ASN H 1 79 ASN HB2 3.101 2.140 4.062 2.651 2.127 3.726 0.013 2 0 "[ . 1]" 1
200 1 79 ASN H 1 79 ASN HB3 2.925 2.069 3.781 3.555 3.027 3.687 . 0 0 "[ . 1]" 1
201 1 59 PHE HB2 1 59 PHE QD 4.006 2.401 5.611 2.414 2.280 2.545 0.121 6 0 "[ . 1]" 1
202 1 59 PHE HB3 1 59 PHE QD 4.034 2.406 5.662 2.367 2.279 2.515 0.127 3 0 "[ . 1]" 1
203 1 79 ASN HA 1 79 ASN HB2 2.543 . 3.190 2.957 2.478 3.030 . 0 0 "[ . 1]" 1
204 1 79 ASN HA 1 79 ASN HB3 2.585 . 3.253 2.469 2.347 2.786 . 0 0 "[ . 1]" 1
205 1 9 ILE HB 1 10 GLN H 2.888 2.054 3.722 2.363 1.979 2.782 0.075 10 0 "[ . 1]" 1
206 1 9 ILE HA 1 9 ILE HB 2.494 . 3.116 3.020 3.005 3.025 . 0 0 "[ . 1]" 1
207 1 8 LYS HB2 1 13 LYS HA 6.761 2.190 11.332 4.321 3.981 4.705 . 0 0 "[ . 1]" 1
208 1 8 LYS HB2 1 8 LYS QE 5.649 2.458 8.840 4.060 3.977 4.100 . 0 0 "[ . 1]" 1
209 1 8 LYS HB2 1 14 PHE HZ 3.966 2.393 5.539 3.415 2.996 4.308 . 0 0 "[ . 1]" 1
210 1 8 LYS HB2 1 8 LYS QG 3.922 2.384 5.460 2.441 2.407 2.472 . 0 0 "[ . 1]" 1
211 1 8 LYS HB3 1 8 LYS QE 6.122 2.374 9.870 4.450 4.194 4.566 . 0 0 "[ . 1]" 1
212 1 8 LYS HA 1 8 LYS HB3 4.063 2.412 5.714 3.020 3.009 3.024 . 0 0 "[ . 1]" 1
213 1 8 LYS HB3 1 8 LYS QG 3.229 2.186 4.272 2.179 2.138 2.284 0.048 8 0 "[ . 1]" 1
214 1 46 LYS QB 1 46 LYS QE . 2.387 2.871 2.416 1.889 3.664 0.793 5 2 "[- + 1]" 1
215 1 13 LYS HA 1 13 LYS QB 3.250 2.194 3.255 2.220 2.146 2.412 0.048 3 0 "[ . 1]" 1
216 1 77 LYS QB 1 77 LYS QE 2.487 . 3.106 2.297 1.956 3.785 0.679 8 1 "[ . + 1]" 1
217 1 77 LYS HA 1 77 LYS QB . 2.084 2.793 2.387 2.301 2.546 . 0 0 "[ . 1]" 1
218 1 77 LYS QB 1 78 PRO QD 4.733 2.493 6.905 3.157 2.972 3.564 . 0 0 "[ . 1]" 1
219 1 10 GLN HA 1 10 GLN HG3 2.639 . 3.335 2.812 2.248 3.321 . 0 0 "[ . 1]" 1
220 1 12 PRO HA 1 12 PRO HB3 2.690 . 3.414 2.283 2.269 2.312 . 0 0 "[ . 1]" 1
221 1 31 GLN HA 1 31 GLN HG2 3.396 2.243 4.549 2.850 2.570 3.038 . 0 0 "[ . 1]" 1
222 1 31 GLN HA 1 31 GLN HG3 3.437 2.256 4.618 3.715 3.585 3.764 . 0 0 "[ . 1]" 1
223 1 28 GLN HA 1 31 GLN HG3 3.426 2.252 4.600 3.709 3.402 4.184 . 0 0 "[ . 1]" 1
224 1 26 ILE HB 1 55 HIS HB2 5.004 2.500 7.508 5.902 5.563 6.109 . 0 0 "[ . 1]" 1
225 1 10 GLN HG2 1 11 ALA H 3.994 2.399 5.589 4.048 3.673 4.516 . 0 0 "[ . 1]" 1
226 1 10 GLN HG3 1 11 ALA H 4.175 2.432 5.918 4.641 3.962 4.961 . 0 0 "[ . 1]" 1
227 1 31 GLN H 1 31 GLN HG3 3.895 2.378 5.412 3.705 3.559 4.208 . 0 0 "[ . 1]" 1
228 1 31 GLN HG3 1 32 HIS H 5.584 2.466 8.702 5.041 4.910 5.274 . 0 0 "[ . 1]" 1
229 1 28 GLN QE 1 31 GLN HG3 4.084 2.416 5.752 4.278 3.113 5.520 . 0 0 "[ . 1]" 1
230 1 12 PRO HB3 1 13 LYS H 4.217 2.439 5.995 3.726 3.498 4.011 . 0 0 "[ . 1]" 1
231 1 31 GLN QE 1 31 GLN HG2 2.787 2.287 3.564 2.825 2.223 3.291 0.064 5 0 "[ . 1]" 1
232 1 46 LYS QB 1 47 LEU H 4.652 2.488 4.834 3.404 3.139 3.683 . 0 0 "[ . 1]" 1
233 1 13 LYS H 1 13 LYS QB . 2.452 3.631 2.639 2.133 3.001 0.319 8 0 "[ . 1]" 1
234 1 52 LYS H 1 52 LYS HB2 3.148 2.157 4.139 2.457 2.174 2.600 . 0 0 "[ . 1]" 1
235 1 77 LYS H 1 77 LYS QB . 2.272 3.044 2.547 2.434 2.705 . 0 0 "[ . 1]" 1
236 1 14 PHE HZ 1 74 VAL HB 4.888 2.499 7.277 4.413 3.649 5.552 . 0 0 "[ . 1]" 1
237 1 7 LYS HB2 1 8 LYS H 5.244 2.494 7.994 4.445 4.369 4.547 . 0 0 "[ . 1]" 1
238 1 46 LYS H 1 46 LYS QB 4.022 2.405 5.639 2.763 2.605 3.237 . 0 0 "[ . 1]" 1
239 1 28 GLN QE 1 28 GLN QG . 2.444 3.077 2.147 2.110 2.179 0.334 8 0 "[ . 1]" 1
240 1 17 GLU HG3 1 18 HIS H 5.573 2.467 8.679 4.987 4.727 5.213 . 0 0 "[ . 1]" 1
241 1 37 GLU H 1 37 GLU HG2 3.426 2.252 4.600 3.177 2.610 4.214 . 0 0 "[ . 1]" 1
242 1 57 ASN HB3 1 57 ASN HD21 4.695 2.491 6.899 3.181 2.189 3.545 0.302 10 0 "[ . 1]" 1
243 1 8 LYS QD 1 14 PHE HZ 3.146 2.403 4.135 3.615 2.736 4.953 0.818 10 1 "[ . +]" 1
244 1 8 LYS QD 1 14 PHE QE 5.026 2.500 7.552 2.588 1.977 2.931 0.523 9 2 "[ - +1]" 1
245 1 9 ILE H 1 9 ILE QG 2.291 2.255 2.816 2.352 2.009 3.513 0.697 2 1 "[ + . 1]" 1
246 1 31 GLN QE 1 42 ILE QG 4.956 2.500 7.412 5.356 4.250 6.146 . 0 0 "[ . 1]" 1
247 1 42 ILE H 1 42 ILE QG 4.292 2.498 6.134 3.773 2.174 3.991 0.324 1 0 "[ . 1]" 1
248 1 6 LEU H 1 16 ILE HG12 4.080 2.416 5.744 4.350 4.016 4.956 . 0 0 "[ . 1]" 1
249 1 7 LYS HB3 1 8 LYS H 5.214 2.496 7.932 4.415 4.334 4.580 . 0 0 "[ . 1]" 1
250 1 19 ASP HB2 1 20 PHE H 4.445 2.469 6.421 3.468 3.013 4.556 . 0 0 "[ . 1]" 1
251 1 4 LEU HB3 1 20 PHE QE 5.021 2.500 7.542 4.285 3.441 5.511 . 0 0 "[ . 1]" 1
252 1 4 LEU HB2 1 20 PHE QD 5.849 2.428 9.270 2.509 1.996 3.206 0.432 1 0 "[ . 1]" 1
253 1 4 LEU HB3 1 20 PHE QD 4.971 . 6.000 4.040 3.475 4.828 . 0 0 "[ . 1]" 1
254 1 4 LEU HB2 1 20 PHE QE 5.900 2.419 9.381 3.316 2.652 4.047 . 0 0 "[ . 1]" 1
255 1 48 LEU HB3 1 73 THR H 5.635 2.460 8.810 4.148 3.189 4.803 . 0 0 "[ . 1]" 1
256 1 48 LEU HB2 1 73 THR H 6.490 2.278 10.702 4.256 3.928 4.646 . 0 0 "[ . 1]" 1
257 1 48 LEU H 1 48 LEU HB2 4.875 2.499 7.251 2.404 2.358 2.494 0.141 9 0 "[ . 1]" 1
258 1 48 LEU HB3 1 49 LEU H 4.695 2.490 6.900 3.364 3.031 3.954 . 0 0 "[ . 1]" 1
259 1 48 LEU HB2 1 49 LEU H 3.571 2.296 4.846 4.322 4.196 4.540 . 0 0 "[ . 1]" 1
260 1 4 LEU HA 1 4 LEU HB2 3.591 2.301 4.881 3.007 2.975 3.020 . 0 0 "[ . 1]" 1
261 1 48 LEU HA 1 48 LEU HB3 4.103 2.420 5.786 2.749 2.594 2.985 . 0 0 "[ . 1]" 1
262 1 48 LEU HB3 1 73 THR HB 4.844 2.498 7.190 3.193 1.943 3.911 0.555 1 1 "[+ . 1]" 1
263 1 48 LEU HA 1 48 LEU HB2 3.458 2.262 4.654 2.912 2.676 3.016 . 0 0 "[ . 1]" 1
264 1 48 LEU HB2 1 73 THR HB 5.904 2.419 9.389 2.639 2.167 3.371 0.252 2 0 "[ . 1]" 1
265 1 48 LEU HB3 1 52 LYS H 6.461 2.286 10.636 5.605 4.716 6.523 . 0 0 "[ . 1]" 1
266 1 48 LEU HB2 1 52 LYS H 5.016 2.500 7.532 7.084 6.399 7.519 . 0 0 "[ . 1]" 1
267 1 20 PHE HB3 1 20 PHE QD 4.230 2.440 6.020 2.413 2.332 2.518 0.108 2 0 "[ . 1]" 1
268 1 20 PHE HA 1 20 PHE HB3 3.652 2.318 4.986 2.543 2.470 2.650 . 0 0 "[ . 1]" 1
269 1 58 LEU H 1 58 LEU HB3 2.522 . 3.158 2.905 2.614 3.262 0.104 5 0 "[ . 1]" 1
270 1 63 LEU HB2 1 64 LYS H 4.171 2.431 5.911 3.940 3.848 4.034 . 0 0 "[ . 1]" 1
271 1 63 LEU H 1 63 LEU HB2 3.533 2.285 4.781 3.619 3.589 3.648 . 0 0 "[ . 1]" 1
272 1 47 LEU H 1 47 LEU HB2 4.854 2.497 7.211 2.369 2.165 2.566 0.332 7 0 "[ . 1]" 1
273 1 58 LEU HB3 1 59 PHE H 4.134 2.425 5.843 3.551 3.223 3.846 . 0 0 "[ . 1]" 1
274 1 58 LEU HB2 1 59 PHE H 3.983 2.396 5.570 4.210 4.108 4.281 . 0 0 "[ . 1]" 1
275 1 26 ILE H 1 58 LEU HB3 4.393 2.463 6.323 4.121 3.773 4.530 . 0 0 "[ . 1]" 1
276 1 80 LEU H 1 80 LEU HB3 2.786 2.010 3.562 3.616 3.584 3.653 0.091 6 0 "[ . 1]" 1
277 1 6 LEU H 1 6 LEU HB3 3.752 2.344 5.160 3.605 3.557 3.655 . 0 0 "[ . 1]" 1
278 1 6 LEU HB3 1 7 LYS H 4.411 2.465 6.357 3.523 3.304 3.694 . 0 0 "[ . 1]" 1
279 1 42 ILE H 1 42 ILE HB 2.992 2.097 3.887 2.807 2.521 3.630 . 0 0 "[ . 1]" 1
280 1 51 GLY HA2 1 52 LYS H 4.395 2.464 6.326 3.513 3.484 3.538 . 0 0 "[ . 1]" 1
281 1 51 GLY HA3 1 52 LYS H 4.818 2.496 7.140 2.716 2.691 2.758 . 0 0 "[ . 1]" 1
282 1 51 GLY H 1 51 GLY HA3 3.846 2.367 5.325 2.890 2.866 2.909 . 0 0 "[ . 1]" 1
283 1 49 LEU HB2 1 50 LYS H 6.035 2.393 9.677 4.424 4.254 4.517 . 0 0 "[ . 1]" 1
284 1 19 ASP HA 1 20 PHE QD 5.797 2.436 9.158 3.757 3.443 4.480 . 0 0 "[ . 1]" 1
285 1 5 THR H 1 6 LEU HA 4.465 2.471 6.459 5.022 4.963 5.075 . 0 0 "[ . 1]" 1
286 1 68 ALA HA 1 69 ASN H 3.408 2.247 4.569 3.194 3.077 3.281 . 0 0 "[ . 1]" 1
287 1 68 ALA H 1 68 ALA HA 3.514 2.279 4.749 2.897 2.866 2.937 . 0 0 "[ . 1]" 1
288 1 57 ASN HA 1 57 ASN HD21 4.543 2.479 6.607 3.055 1.876 4.488 0.603 8 1 "[ . + 1]" 1
289 1 48 LEU H 1 48 LEU HA 3.655 2.319 4.991 2.945 2.939 2.952 . 0 0 "[ . 1]" 1
290 1 7 LYS HA 1 14 PHE H 5.300 2.491 8.109 4.785 4.341 5.185 . 0 0 "[ . 1]" 1
291 1 46 LYS H 1 46 LYS HA 3.266 2.199 4.333 2.945 2.915 2.958 . 0 0 "[ . 1]" 1
292 1 52 LYS H 1 52 LYS HA 3.402 2.245 4.559 2.817 2.794 2.847 . 0 0 "[ . 1]" 1
293 1 7 LYS HA 1 16 ILE H 4.288 2.449 6.127 4.063 3.929 4.325 . 0 0 "[ . 1]" 1
294 1 79 ASN H 1 80 LEU HA 5.169 2.497 7.841 4.900 4.560 5.128 . 0 0 "[ . 1]" 1
295 1 7 LYS H 1 7 LYS HA 3.279 2.204 4.354 2.946 2.937 2.951 . 0 0 "[ . 1]" 1
296 1 62 ASP HA 1 64 LYS H 4.907 2.499 7.315 4.240 4.075 4.377 . 0 0 "[ . 1]" 1
297 1 24 ASP HA 1 59 PHE QD 5.480 2.477 8.483 4.179 3.744 5.241 . 0 0 "[ . 1]" 1
298 1 7 LYS HA 1 14 PHE QD 5.614 2.462 8.766 4.912 3.975 5.527 . 0 0 "[ . 1]" 1
299 1 14 PHE QD 1 15 SER HA 4.448 2.469 6.427 3.409 2.963 4.203 . 0 0 "[ . 1]" 1
300 1 14 PHE HA 1 14 PHE QD 4.688 2.490 6.886 3.734 3.718 3.748 . 0 0 "[ . 1]" 1
301 1 23 SER HA 1 24 ASP H 3.488 2.272 4.704 3.084 3.018 3.171 . 0 0 "[ . 1]" 1
302 1 23 SER H 1 23 SER HA 3.362 2.232 4.492 2.930 2.902 2.945 . 0 0 "[ . 1]" 1
303 1 23 SER HA 1 59 PHE QD 3.848 2.368 5.328 3.419 2.599 4.495 . 0 0 "[ . 1]" 1
304 1 70 SER HA 1 71 THR H 3.204 2.178 4.230 3.103 2.993 3.231 . 0 0 "[ . 1]" 1
305 1 37 GLU H 1 37 GLU HA 2.664 . 3.374 2.263 2.246 2.272 . 0 0 "[ . 1]" 1
306 1 60 LEU HA 1 61 SER H 3.913 2.382 5.444 3.519 3.481 3.558 . 0 0 "[ . 1]" 1
307 1 81 GLU H 1 81 GLU HA 2.688 . 3.411 2.878 2.821 2.943 . 0 0 "[ . 1]" 1
308 1 56 ASP HA 1 58 LEU H 4.373 2.461 6.285 3.875 3.724 3.976 . 0 0 "[ . 1]" 1
309 1 59 PHE HA 1 59 PHE QD 4.150 2.428 5.872 2.975 2.626 3.095 . 0 0 "[ . 1]" 1
310 1 31 GLN HA 1 35 SER H 4.419 2.466 6.372 4.215 4.093 4.397 . 0 0 "[ . 1]" 1
311 1 25 THR HA 1 59 PHE QD 5.457 2.479 8.435 3.690 3.082 4.407 . 0 0 "[ . 1]" 1
312 1 40 SER HA 1 41 HIS H 4.457 2.471 6.443 3.542 3.414 3.584 . 0 0 "[ . 1]" 1
313 1 32 HIS HA 1 35 SER H 3.944 2.388 5.500 3.352 3.203 3.618 . 0 0 "[ . 1]" 1
314 1 32 HIS HA 1 36 GLU H 4.866 2.498 7.234 4.455 4.252 4.705 . 0 0 "[ . 1]" 1
315 1 61 SER HA 1 63 LEU H 3.967 2.393 5.541 4.646 4.488 4.832 . 0 0 "[ . 1]" 1
316 1 43 SER H 1 43 SER HA 3.407 2.246 4.568 2.741 2.705 2.773 . 0 0 "[ . 1]" 1
317 1 40 SER H 1 40 SER HA 3.595 2.302 4.888 2.919 2.884 2.940 . 0 0 "[ . 1]" 1
318 1 35 SER HA 1 37 GLU H 3.955 2.391 5.519 3.568 3.431 3.653 . 0 0 "[ . 1]" 1
319 1 26 ILE H 1 26 ILE HA 3.276 2.202 4.350 2.817 2.799 2.840 . 0 0 "[ . 1]" 1
320 1 9 ILE HA 1 10 GLN H 3.107 2.142 4.072 3.558 3.509 3.592 . 0 0 "[ . 1]" 1
321 1 26 ILE HA 1 29 ILE H 3.602 2.305 4.899 3.261 3.176 3.304 . 0 0 "[ . 1]" 1
322 1 5 THR H 1 71 THR HA 4.004 2.401 5.607 3.069 2.747 4.596 . 0 0 "[ . 1]" 1
323 1 71 THR H 1 71 THR HA 3.849 2.367 5.331 2.931 2.869 2.941 . 0 0 "[ . 1]" 1
324 1 35 SER HA 1 36 GLU H 3.982 2.396 5.568 3.451 3.363 3.491 . 0 0 "[ . 1]" 1
325 1 65 VAL HA 1 66 THR H 2.302 . 2.832 2.152 2.135 2.178 . 0 0 "[ . 1]" 1
326 1 73 THR H 1 73 THR HA 3.651 2.318 4.984 2.888 2.881 2.905 . 0 0 "[ . 1]" 1
327 1 11 ALA H 1 12 PRO HA 3.088 . 6.000 4.780 4.721 4.855 . 0 0 "[ . 1]" 1
328 1 21 SER H 1 21 SER HB3 2.989 2.096 3.882 3.233 2.335 3.656 . 0 0 "[ . 1]" 1
329 1 70 SER H 1 70 SER QB 3.857 2.370 4.030 3.262 2.360 3.399 0.010 2 0 "[ . 1]" 1
330 1 21 SER HB3 1 24 ASP H 4.664 2.489 6.839 4.031 3.023 4.948 . 0 0 "[ . 1]" 1
331 1 23 SER H 1 23 SER HB3 3.578 2.298 4.858 3.387 2.699 3.747 . 0 0 "[ . 1]" 1
332 1 21 SER HB3 1 23 SER H 3.415 2.249 4.581 3.199 2.961 3.763 . 0 0 "[ . 1]" 1
333 1 21 SER HB2 1 23 SER H 3.208 2.179 4.237 3.277 2.639 4.317 0.080 3 0 "[ . 1]" 1
334 1 23 SER H 1 23 SER HB2 3.077 2.130 4.024 2.790 2.484 3.468 . 0 0 "[ . 1]" 1
335 1 23 SER HB2 1 59 PHE QD 4.286 2.449 6.123 5.142 4.012 5.910 . 0 0 "[ . 1]" 1
336 1 23 SER HB3 1 59 PHE QD 3.961 2.392 5.530 4.465 3.547 4.908 . 0 0 "[ . 1]" 1
337 1 22 PRO HA 1 60 LEU H 5.272 2.493 8.051 5.178 4.626 5.833 . 0 0 "[ . 1]" 1
338 1 22 PRO HA 1 61 SER H 4.250 2.444 6.056 4.451 3.702 5.156 . 0 0 "[ . 1]" 1
339 1 20 PHE QE 1 29 ILE HA 4.565 2.481 6.649 3.491 3.098 3.987 . 0 0 "[ . 1]" 1
340 1 29 ILE HA 1 32 HIS H 4.214 2.438 5.990 3.459 3.298 3.541 . 0 0 "[ . 1]" 1
341 1 42 ILE HA 1 44 GLU H 3.803 2.357 5.249 3.898 3.674 4.309 . 0 0 "[ . 1]" 1
342 1 67 PRO HA 1 69 ASN H 4.352 2.458 6.246 3.470 3.336 3.796 . 0 0 "[ . 1]" 1
343 1 67 PRO HA 1 68 ALA H 4.410 2.466 6.354 3.440 3.386 3.549 . 0 0 "[ . 1]" 1
344 1 71 THR HB 1 72 ILE H 4.608 2.485 6.731 4.066 3.575 4.218 . 0 0 "[ . 1]" 1
345 1 66 THR HB 1 68 ALA H 3.516 2.279 4.753 2.771 2.446 3.207 . 0 0 "[ . 1]" 1
346 1 78 PRO QD 1 79 ASN H 5.957 2.408 9.506 4.890 4.828 4.977 . 0 0 "[ . 1]" 1
347 1 77 LYS H 1 78 PRO QD 4.742 2.493 4.845 4.085 3.920 4.186 . 0 0 "[ . 1]" 1
348 1 38 LYS H 1 39 ALA HA 5.388 2.485 8.291 4.807 4.745 4.884 . 0 0 "[ . 1]" 1
349 1 72 ILE H 1 72 ILE HA 3.633 2.313 4.953 2.940 2.904 2.950 . 0 0 "[ . 1]" 1
350 1 43 SER HA 1 45 ILE H 4.119 2.422 5.816 3.869 3.734 3.957 . 0 0 "[ . 1]" 1
351 1 20 PHE HA 1 20 PHE QD 4.108 2.421 5.795 2.866 2.583 3.020 . 0 0 "[ . 1]" 1
352 1 14 PHE QD 1 16 ILE HA 5.479 2.477 8.481 4.908 4.597 5.407 . 0 0 "[ . 1]" 1
353 1 20 PHE HZ 1 29 ILE HA 4.068 2.413 5.723 3.114 2.695 3.631 . 0 0 "[ . 1]" 1
354 1 22 PRO HD3 1 23 SER H 5.470 2.478 8.462 4.023 3.880 4.178 . 0 0 "[ . 1]" 1
355 1 19 ASP H 1 19 ASP HB2 3.511 2.279 4.743 3.435 2.591 3.781 . 0 0 "[ . 1]" 1
356 1 27 LEU H 1 28 GLN QG 5.215 2.496 7.934 4.401 3.821 5.417 . 0 0 "[ . 1]" 1
357 1 1 MET HB2 1 2 VAL H 5.780 2.440 9.120 3.494 2.048 4.379 0.392 2 0 "[ . 1]" 1
358 1 18 HIS HB2 1 20 PHE QE 4.705 2.491 6.919 3.161 2.431 3.934 0.060 1 0 "[ . 1]" 1
359 1 18 HIS HB3 1 20 PHE QE 4.588 2.483 6.693 2.783 2.106 3.765 0.377 10 0 "[ . 1]" 1
360 1 18 HIS HB2 1 20 PHE HZ 4.628 2.486 6.770 4.179 3.349 4.897 . 0 0 "[ . 1]" 1
361 1 18 HIS HB3 1 20 PHE HZ 4.157 2.429 5.885 3.742 3.102 4.454 . 0 0 "[ . 1]" 1
362 1 18 HIS HB2 1 20 PHE QD 5.568 2.468 8.668 4.553 3.205 5.513 . 0 0 "[ . 1]" 1
363 1 18 HIS HB3 1 20 PHE QD 5.295 2.491 8.099 3.774 3.118 4.632 . 0 0 "[ . 1]" 1
364 1 75 MET H 1 75 MET QG 3.316 2.216 4.416 3.359 2.591 3.976 . 0 0 "[ . 1]" 1
365 1 22 PRO HB3 1 23 SER H 3.899 2.379 5.419 4.260 4.014 4.362 . 0 0 "[ . 1]" 1
366 1 32 HIS HB3 1 33 LEU H 4.521 2.477 6.565 2.680 2.575 2.802 . 0 0 "[ . 1]" 1
367 1 20 PHE QE 1 32 HIS HB3 6.014 2.397 9.631 4.735 3.987 5.107 . 0 0 "[ . 1]" 1
368 1 20 PHE HZ 1 32 HIS HB3 5.208 2.495 7.921 4.003 2.814 4.511 . 0 0 "[ . 1]" 1
369 1 20 PHE QE 1 32 HIS HB2 5.352 2.487 8.217 4.226 3.540 4.575 . 0 0 "[ . 1]" 1
370 1 20 PHE HZ 1 32 HIS HB2 4.627 2.486 6.768 4.155 3.072 4.825 . 0 0 "[ . 1]" 1
371 1 50 LYS H 1 50 LYS QB 3.578 2.382 4.008 2.790 2.684 3.042 . 0 0 "[ . 1]" 1
372 1 50 LYS QB 1 51 GLY H 4.162 2.430 4.640 3.985 3.909 4.033 . 0 0 "[ . 1]" 1
373 1 10 GLN H 1 10 GLN HB2 2.836 2.032 3.640 2.461 2.323 2.804 . 0 0 "[ . 1]" 1
374 1 72 ILE H 1 72 ILE HG12 3.257 2.196 4.318 2.335 1.853 2.676 0.343 7 0 "[ . 1]" 1
375 1 49 LEU HG 1 50 LYS H 4.468 2.471 6.465 3.893 3.773 4.004 . 0 0 "[ . 1]" 1
376 1 31 GLN H 1 31 GLN HB3 4.463 2.471 6.455 3.562 3.342 3.605 . 0 0 "[ . 1]" 1
377 1 31 GLN HB3 1 31 GLN QE 6.154 2.366 9.942 3.647 2.650 4.085 . 0 0 "[ . 1]" 1
378 1 22 PRO HG2 1 23 SER H 3.465 2.264 4.666 2.949 2.634 4.127 . 0 0 "[ . 1]" 1
379 1 50 LYS H 1 50 LYS QD 4.114 2.422 5.806 3.491 1.705 4.808 0.717 5 1 "[ + 1]" 1
380 1 50 LYS QD 1 51 GLY H 4.204 2.437 5.971 4.287 3.850 5.751 . 0 0 "[ . 1]" 1
381 1 48 LEU H 1 48 LEU HG 3.526 2.283 4.769 4.601 4.388 4.796 0.027 1 0 "[ . 1]" 1
382 1 64 LYS HB2 1 65 VAL H 4.410 2.465 6.355 4.476 4.437 4.502 . 0 0 "[ . 1]" 1
383 1 46 LYS H 1 46 LYS HG3 3.289 2.208 4.370 3.675 2.957 4.710 0.340 1 0 "[ . 1]" 1
384 1 46 LYS H 1 46 LYS HG2 3.766 2.348 5.184 2.984 2.071 4.676 0.277 10 0 "[ . 1]" 1
385 1 50 LYS H 1 50 LYS HG2 4.810 2.497 7.123 4.858 3.696 5.145 . 0 0 "[ . 1]" 1
386 1 50 LYS H 1 50 LYS HG3 4.732 2.493 6.971 4.632 4.151 4.814 . 0 0 "[ . 1]" 1
387 1 64 LYS H 1 64 LYS QG 2.939 2.075 3.787 2.759 2.613 2.914 . 0 0 "[ . 1]" 1
388 1 12 PRO HB2 1 12 PRO HD3 4.759 2.494 7.024 3.944 3.901 3.975 . 0 0 "[ . 1]" 1
389 1 12 PRO HD3 1 12 PRO HG3 2.839 2.033 3.645 2.303 2.274 2.326 . 0 0 "[ . 1]" 1
390 1 11 ALA MB 1 12 PRO HD3 4.713 2.492 6.934 3.986 3.911 4.036 . 0 0 "[ . 1]" 1
391 1 11 ALA HA 1 12 PRO HD2 5.150 2.497 7.803 4.459 4.440 4.476 . 0 0 "[ . 1]" 1
392 1 11 ALA HA 1 12 PRO HD3 5.192 2.496 7.888 4.554 4.536 4.591 . 0 0 "[ . 1]" 1
393 1 12 PRO HD2 1 12 PRO HG2 2.978 2.091 3.865 2.316 2.282 2.341 . 0 0 "[ . 1]" 1
394 1 12 PRO HD2 1 12 PRO HG3 3.159 2.161 4.157 2.914 2.731 2.999 . 0 0 "[ . 1]" 1
395 1 78 PRO QB 1 78 PRO QD 4.291 2.449 5.192 2.799 2.752 2.866 . 0 0 "[ . 1]" 1
396 1 77 LYS HA 1 78 PRO QD . . 2.305 1.914 1.841 1.967 0.138 8 0 "[ . 1]" 1
397 1 78 PRO HA 1 78 PRO QD 4.212 2.438 5.986 3.372 3.265 3.452 . 0 0 "[ . 1]" 1
398 1 21 SER HA 1 22 PRO HD2 3.201 2.177 4.225 2.279 2.132 2.478 0.045 7 0 "[ . 1]" 1
399 1 66 THR HB 1 67 PRO HD3 3.960 2.392 5.528 4.551 3.988 4.876 . 0 0 "[ . 1]" 1
400 1 22 PRO HD2 1 22 PRO HG3 3.190 2.172 4.208 2.713 2.672 2.973 . 0 0 "[ . 1]" 1
401 1 22 PRO HD3 1 22 PRO HG3 3.089 2.135 4.043 2.305 2.288 2.315 . 0 0 "[ . 1]" 1
402 1 66 THR MG 1 67 PRO HD3 4.400 2.464 6.336 3.664 3.432 3.870 . 0 0 "[ . 1]" 1
403 1 2 VAL QG 1 22 PRO HD2 5.088 2.499 7.677 4.151 3.842 4.406 . 0 0 "[ . 1]" 1
404 1 77 LYS QE 1 78 PRO QD 6.884 2.465 8.709 3.192 2.116 4.904 0.349 10 0 "[ . 1]" 1
405 1 11 ALA HA 1 13 LYS QE 4.104 2.420 5.788 5.235 3.174 5.759 . 0 0 "[ . 1]" 1
406 1 11 ALA HA 1 12 PRO HB2 4.741 2.493 6.989 4.408 4.379 4.478 . 0 0 "[ . 1]" 1
407 1 34 ILE MD 1 39 ALA HA 5.084 2.499 7.669 5.869 5.462 6.127 . 0 0 "[ . 1]" 1
408 1 39 ALA HA 1 40 SER HB2 5.131 2.498 7.764 4.915 4.194 5.260 . 0 0 "[ . 1]" 1
409 1 6 LEU HA 1 6 LEU HB2 3.366 2.233 4.499 3.016 2.999 3.024 . 0 0 "[ . 1]" 1
410 1 6 LEU HA 1 72 ILE HB 3.167 2.164 4.170 2.688 2.301 3.285 . 0 0 "[ . 1]" 1
411 1 4 LEU HA 1 4 LEU HB3 3.821 2.361 5.281 2.569 2.428 2.666 . 0 0 "[ . 1]" 1
412 1 6 LEU HA 1 6 LEU HB3 2.916 2.066 3.766 2.528 2.468 2.603 . 0 0 "[ . 1]" 1
413 1 47 LEU HA 1 47 LEU HB3 3.588 2.301 4.875 2.557 2.437 2.718 . 0 0 "[ . 1]" 1
414 1 75 MET HA 1 75 MET QG 3.038 2.247 3.961 2.559 2.215 3.028 0.032 4 0 "[ . 1]" 1
415 1 78 PRO QB 1 79 ASN HA 4.154 2.428 5.880 4.500 4.331 4.646 . 0 0 "[ . 1]" 1
416 1 57 ASN HA 1 57 ASN HB3 3.002 2.101 3.903 2.898 2.491 3.022 . 0 0 "[ . 1]" 1
417 1 57 ASN HA 1 57 ASN HB2 2.839 2.033 3.645 2.637 2.414 3.013 . 0 0 "[ . 1]" 1
418 1 25 THR MG 1 57 ASN HA 3.327 2.220 4.434 2.727 2.235 3.181 . 0 0 "[ . 1]" 1
419 1 77 LYS HA 1 77 LYS QE 4.193 2.435 5.951 3.091 2.101 4.253 0.334 9 0 "[ . 1]" 1
420 1 24 ASP HA 1 24 ASP HB3 3.566 2.295 4.837 2.850 2.757 2.976 . 0 0 "[ . 1]" 1
421 1 24 ASP HA 1 24 ASP HB2 2.786 2.010 3.562 2.845 2.682 2.934 . 0 0 "[ . 1]" 1
422 1 55 HIS HA 1 55 HIS HB2 3.283 2.205 4.361 3.004 2.978 3.023 . 0 0 "[ . 1]" 1
423 1 48 LEU HA 1 54 LEU QD 2.634 . 3.328 3.485 3.051 4.090 0.762 2 1 "[ + . 1]" 1
424 1 24 ASP HA 1 25 THR MG 3.686 2.328 5.044 4.720 3.819 5.384 0.340 5 0 "[ . 1]" 1
425 1 67 PRO HB3 1 68 ALA HA 4.228 2.440 6.016 5.589 5.242 5.678 . 0 0 "[ . 1]" 1
426 1 49 LEU HA 1 49 LEU HB3 2.680 . 3.398 3.019 2.987 3.034 . 0 0 "[ . 1]" 1
427 1 54 LEU HA 1 58 LEU HG 3.179 . 6.000 5.124 4.815 5.515 . 0 0 "[ . 1]" 1
428 1 69 ASN HA 1 69 ASN HB3 2.714 . 3.450 2.702 2.578 3.031 . 0 0 "[ . 1]" 1
429 1 69 ASN HA 1 69 ASN HB2 3.023 2.109 3.937 2.913 2.499 3.017 . 0 0 "[ . 1]" 1
430 1 8 LYS HA 1 8 LYS HB2 3.126 2.149 4.103 2.427 2.371 2.513 . 0 0 "[ . 1]" 1
431 1 18 HIS HA 1 18 HIS HB3 3.287 2.207 4.367 2.780 2.532 3.028 . 0 0 "[ . 1]" 1
432 1 18 HIS HA 1 18 HIS HB2 3.378 2.237 4.519 2.841 2.542 3.022 . 0 0 "[ . 1]" 1
433 1 36 GLU HA 1 36 GLU HB3 2.712 . 3.448 2.549 2.396 2.959 . 0 0 "[ . 1]" 1
434 1 33 LEU HA 1 33 LEU HB2 3.511 2.278 4.744 3.015 3.006 3.024 . 0 0 "[ . 1]" 1
435 1 33 LEU HA 1 33 LEU HG 3.350 2.228 4.472 3.170 2.859 3.321 . 0 0 "[ . 1]" 1
436 1 33 LEU HA 1 36 GLU QG 3.495 2.274 4.716 3.717 2.934 5.239 0.523 6 1 "[ .+ 1]" 1
437 1 33 LEU HA 1 36 GLU HB2 3.222 2.184 4.260 3.098 2.781 3.644 . 0 0 "[ . 1]" 1
438 1 49 LEU QD 1 50 LYS HA 3.972 2.394 5.550 4.731 4.477 4.956 . 0 0 "[ . 1]" 1
439 1 27 LEU HA 1 27 LEU HB3 2.937 2.075 3.799 2.951 2.915 3.007 . 0 0 "[ . 1]" 1
440 1 7 LYS HA 1 8 LYS HB2 5.494 2.475 8.513 4.762 4.609 4.878 . 0 0 "[ . 1]" 1
441 1 5 THR MG 1 15 SER HA 4.517 2.476 6.558 4.188 3.622 4.572 . 0 0 "[ . 1]" 1
442 1 25 THR HA 1 59 PHE HB2 6.568 2.254 10.882 5.228 5.028 5.385 . 0 0 "[ . 1]" 1
443 1 25 THR HA 1 59 PHE HB3 5.718 2.449 8.987 4.496 4.135 4.800 . 0 0 "[ . 1]" 1
444 1 25 THR HA 1 26 ILE HB 5.720 2.448 8.992 4.883 4.699 4.941 . 0 0 "[ . 1]" 1
445 1 25 THR HA 1 26 ILE HG12 4.611 2.485 6.737 3.777 3.654 3.905 . 0 0 "[ . 1]" 1
446 1 25 THR HA 1 59 PHE HA 3.045 2.118 3.972 2.392 2.128 2.585 . 0 0 "[ . 1]" 1
447 1 16 ILE HA 1 16 ILE HB 2.642 . 3.340 2.514 2.445 2.594 . 0 0 "[ . 1]" 1
448 1 16 ILE HA 1 16 ILE HG13 3.717 2.335 5.099 3.710 3.644 3.790 . 0 0 "[ . 1]" 1
449 1 66 THR HA 1 67 PRO HD2 2.999 2.100 3.898 2.116 1.954 2.547 0.146 8 0 "[ . 1]" 1
450 1 40 SER HA 1 40 SER HB3 2.918 2.066 3.770 2.400 2.262 3.016 . 0 0 "[ . 1]" 1
451 1 40 SER HA 1 40 SER HB2 2.747 . 3.501 2.949 2.589 3.026 . 0 0 "[ . 1]" 1
452 1 26 ILE HA 1 26 ILE HB 3.271 2.201 4.341 3.024 3.022 3.027 . 0 0 "[ . 1]" 1
453 1 26 ILE HA 1 28 GLN HB3 5.458 2.479 8.437 6.281 5.922 6.585 . 0 0 "[ . 1]" 1
454 1 26 ILE HA 1 26 ILE HG12 3.274 2.202 4.346 3.174 3.004 3.281 . 0 0 "[ . 1]" 1
455 1 26 ILE HA 1 26 ILE HG13 3.730 2.339 5.121 3.732 3.664 3.779 . 0 0 "[ . 1]" 1
456 1 26 ILE HA 1 29 ILE HG13 3.023 2.109 3.937 2.722 2.523 2.898 . 0 0 "[ . 1]" 1
457 1 26 ILE HA 1 26 ILE MG 2.223 . 2.717 2.367 2.309 2.483 . 0 0 "[ . 1]" 1
458 1 26 ILE HA 1 29 ILE HG12 5.012 2.500 7.524 4.269 4.098 4.430 . 0 0 "[ . 1]" 1
459 1 2 VAL HA 1 2 VAL HB 3.551 2.290 4.812 2.898 2.407 3.025 . 0 0 "[ . 1]" 1
460 1 30 LYS HA 1 30 LYS QB . 2.193 3.220 2.421 2.359 2.473 . 0 0 "[ . 1]" 1
461 1 74 VAL HA 1 74 VAL HB 3.021 2.108 3.934 3.012 2.993 3.021 . 0 0 "[ . 1]" 1
462 1 9 ILE HA 1 9 ILE QG 2.666 2.303 3.377 2.404 2.236 2.506 0.067 2 0 "[ . 1]" 1
463 1 9 ILE HA 1 13 LYS QE 3.629 2.312 4.946 3.186 2.478 4.316 . 0 0 "[ . 1]" 1
464 1 71 THR HA 1 72 ILE HB 5.492 2.476 8.508 4.804 4.562 5.279 . 0 0 "[ . 1]" 1
465 1 7 LYS HB2 1 71 THR HA 4.696 2.491 6.901 4.927 4.428 5.445 . 0 0 "[ . 1]" 1
466 1 16 ILE HA 1 16 ILE HG12 3.592 2.302 4.882 3.719 3.650 3.811 . 0 0 "[ . 1]" 1
467 1 16 ILE HA 1 16 ILE MD 4.482 2.473 6.491 4.189 4.175 4.205 . 0 0 "[ . 1]" 1
468 1 34 ILE MD 1 40 SER HA 4.318 2.453 6.183 5.262 4.374 5.760 . 0 0 "[ . 1]" 1
469 1 25 THR HB 1 26 ILE HB 4.783 2.495 7.071 4.878 4.309 5.537 . 0 0 "[ . 1]" 1
470 1 25 THR HB 1 26 ILE HA 5.588 2.466 8.710 4.779 4.565 5.086 . 0 0 "[ . 1]" 1
471 1 25 THR HA 1 25 THR HB 3.095 2.137 4.053 2.847 2.595 3.020 . 0 0 "[ . 1]" 1
472 1 25 THR HB 1 28 GLN H 5.520 2.472 8.568 3.122 2.685 3.698 . 0 0 "[ . 1]" 1
473 1 66 THR HB 1 67 PRO HD2 2.492 . 3.113 3.528 3.093 4.055 0.942 7 4 "[ * +-*1]" 1
474 1 66 THR HB 1 66 THR MG 2.107 . 2.551 2.131 2.103 2.136 . 0 0 "[ . 1]" 1
475 1 48 LEU QD 1 73 THR HB 3.597 2.303 4.891 3.786 3.142 4.287 . 0 0 "[ . 1]" 1
476 1 66 THR HB 1 69 ASN HB2 6.232 2.348 10.116 2.825 2.209 3.421 0.139 8 0 "[ . 1]" 1
477 1 67 PRO HA 1 68 ALA MB 4.911 2.500 7.322 4.959 4.899 5.014 . 0 0 "[ . 1]" 1
478 1 67 PRO HA 1 67 PRO HG2 4.071 2.414 5.728 3.894 3.843 4.014 . 0 0 "[ . 1]" 1
479 1 67 PRO HA 1 67 PRO HD2 4.262 2.446 6.078 4.075 3.949 4.104 . 0 0 "[ . 1]" 1
480 1 22 PRO HA 1 60 LEU HB3 3.897 2.379 5.415 3.435 3.046 3.974 . 0 0 "[ . 1]" 1
481 1 15 SER HA 1 15 SER HB3 2.966 2.086 3.846 2.458 2.409 2.504 . 0 0 "[ . 1]" 1
482 1 15 SER HA 1 15 SER HB2 2.983 2.093 3.873 3.031 3.025 3.036 . 0 0 "[ . 1]" 1
483 1 21 SER HA 1 22 PRO HA 5.098 2.499 7.697 4.425 4.407 4.449 . 0 0 "[ . 1]" 1
484 1 29 ILE HA 1 29 ILE MD 4.346 2.457 6.235 3.875 3.809 3.943 . 0 0 "[ . 1]" 1
485 1 29 ILE HA 1 29 ILE HG12 3.306 2.213 4.399 2.623 2.504 2.751 . 0 0 "[ . 1]" 1
486 1 30 LYS QB 1 42 ILE HA 3.361 2.232 4.490 3.299 2.822 3.656 . 0 0 "[ . 1]" 1
487 1 42 ILE HA 1 45 ILE MD 2.377 . 2.942 1.975 1.897 2.038 . 0 0 "[ . 1]" 1
488 1 65 VAL HA 1 66 THR MG 3.652 2.319 4.985 4.800 4.249 5.272 0.287 5 0 "[ . 1]" 1
489 1 42 ILE HA 1 45 ILE HB 2.819 2.025 3.613 3.103 2.799 3.320 . 0 0 "[ . 1]" 1
490 1 42 ILE HA 1 42 ILE QG 2.509 2.272 3.139 2.583 2.302 3.335 0.196 1 0 "[ . 1]" 1
491 1 40 SER HB3 1 41 HIS HB2 4.778 2.495 7.061 4.402 3.520 5.399 . 0 0 "[ . 1]" 1
492 1 44 GLU QG 1 78 PRO HA 3.429 2.253 4.605 4.876 3.051 5.839 1.234 5 3 "[- + *]" 1
493 1 5 THR HA 1 17 GLU HG2 3.967 2.393 5.541 2.982 2.266 4.442 0.127 2 0 "[ . 1]" 1
494 1 5 THR HA 1 17 GLU HB3 5.275 2.492 8.058 3.996 3.509 4.285 . 0 0 "[ . 1]" 1
495 1 5 THR HA 1 5 THR MG 2.742 . 3.494 2.317 2.246 2.354 . 0 0 "[ . 1]" 1
496 1 59 PHE HA 1 59 PHE HB2 3.793 2.355 5.231 3.019 3.003 3.029 . 0 0 "[ . 1]" 1
497 1 14 PHE HA 1 14 PHE HB3 3.051 2.120 3.982 2.478 2.391 2.567 . 0 0 "[ . 1]" 1
498 1 14 PHE HA 1 14 PHE HB2 3.089 2.135 4.043 2.438 2.364 2.518 . 0 0 "[ . 1]" 1
499 1 59 PHE HA 1 59 PHE HB3 3.372 2.235 4.509 2.533 2.360 2.623 . 0 0 "[ . 1]" 1
500 1 81 GLU HA 1 81 GLU HB2 2.230 . 2.727 2.767 2.498 3.018 0.291 5 0 "[ . 1]" 1
501 1 44 GLU HA 1 44 GLU QG 3.163 2.162 4.164 3.123 2.181 3.385 . 0 0 "[ . 1]" 1
502 1 27 LEU HA 1 27 LEU QD . . 2.297 1.893 1.833 1.956 0.011 2 0 "[ . 1]" 1
503 1 47 LEU HA 1 73 THR HB 5.721 2.448 8.994 5.006 4.619 5.446 . 0 0 "[ . 1]" 1
504 1 7 LYS HA 1 15 SER HA 3.003 2.101 3.905 2.570 2.376 2.870 . 0 0 "[ . 1]" 1
505 1 23 SER HA 1 23 SER HB2 2.931 2.072 3.790 2.863 2.517 3.025 . 0 0 "[ . 1]" 1
506 1 47 LEU HA 1 74 VAL HA 3.457 2.262 4.652 2.893 2.704 3.026 . 0 0 "[ . 1]" 1
507 1 32 HIS HA 1 32 HIS HB3 3.139 2.154 4.124 3.019 2.982 3.031 . 0 0 "[ . 1]" 1
508 1 32 HIS HA 1 32 HIS HB2 3.532 2.284 4.780 2.531 2.455 2.659 . 0 0 "[ . 1]" 1
509 1 48 LEU HA 1 53 VAL HA 3.167 2.164 4.170 2.802 2.361 3.024 . 0 0 "[ . 1]" 1
510 1 49 LEU HA 1 50 LYS HA 4.778 2.495 7.061 4.386 4.319 4.446 . 0 0 "[ . 1]" 1
511 1 50 LYS HA 1 50 LYS QE 4.077 2.415 5.739 3.976 3.144 5.097 . 0 0 "[ . 1]" 1
512 1 21 SER HA 1 21 SER HB3 2.510 . 3.140 2.540 2.255 3.032 . 0 0 "[ . 1]" 1
513 1 28 GLN HA 1 28 GLN HB2 3.250 2.194 4.306 3.006 2.935 3.025 . 0 0 "[ . 1]" 1
514 1 28 GLN HA 1 28 GLN HB3 2.944 2.077 3.811 2.497 2.338 2.737 . 0 0 "[ . 1]" 1
515 1 42 ILE MG 1 43 SER HA 3.071 2.128 4.014 3.639 3.060 5.454 1.440 1 1 "[+ . 1]" 1
516 1 59 PHE HA 1 60 LEU HG 4.599 2.484 6.714 4.089 3.935 4.307 . 0 0 "[ . 1]" 1
517 1 25 THR MG 1 59 PHE HA 3.097 2.138 4.056 3.017 2.465 3.545 . 0 0 "[ . 1]" 1
518 1 34 ILE HA 1 34 ILE HG12 2.612 . 3.294 2.675 2.440 2.789 . 0 0 "[ . 1]" 1
519 1 60 LEU HA 1 63 LEU HG 2.544 . 3.191 2.361 2.133 2.661 . 0 0 "[ . 1]" 1
520 1 68 ALA HA 1 69 ASN HA 4.450 2.469 6.431 4.473 4.438 4.513 . 0 0 "[ . 1]" 1
521 1 5 THR HA 1 17 GLU HA 2.820 2.025 3.615 2.296 2.239 2.342 . 0 0 "[ . 1]" 1
522 1 55 HIS HA 1 55 HIS HB3 2.799 2.016 3.582 2.571 2.462 2.671 . 0 0 "[ . 1]" 1
523 1 10 GLN HA 1 10 GLN HG2 3.168 2.164 4.172 2.747 2.342 3.379 . 0 0 "[ . 1]" 1
524 1 41 HIS HB2 1 43 SER HB2 4.946 2.500 7.392 4.806 3.453 5.861 . 0 0 "[ . 1]" 1
525 1 21 SER HB2 1 24 ASP HB2 3.500 2.275 4.725 3.244 2.502 4.421 . 0 0 "[ . 1]" 1
526 1 12 PRO HA 1 12 PRO HD2 4.462 2.471 6.453 3.965 3.900 4.092 . 0 0 "[ . 1]" 1
527 1 4 LEU HB2 1 4 LEU MD1 3.097 2.138 4.056 2.306 2.121 3.198 0.017 8 0 "[ . 1]" 1
528 1 48 LEU HB3 1 48 LEU QD 2.791 2.012 3.570 2.384 2.251 2.506 . 0 0 "[ . 1]" 1
529 1 49 LEU HB3 1 49 LEU HG 3.137 2.153 4.121 2.540 2.505 2.579 . 0 0 "[ . 1]" 1
530 1 47 LEU HA 1 47 LEU HB2 3.574 2.297 4.851 3.005 2.951 3.018 . 0 0 "[ . 1]" 1
531 1 24 ASP HB2 1 25 THR H 3.988 2.398 5.578 3.980 3.876 4.153 . 0 0 "[ . 1]" 1
532 1 19 ASP HA 1 19 ASP HB3 3.341 2.225 4.457 2.491 2.247 3.025 . 0 0 "[ . 1]" 1
533 1 19 ASP HB3 1 20 PHE HA 4.304 2.452 6.156 5.483 4.533 5.801 . 0 0 "[ . 1]" 1
534 1 56 ASP HA 1 56 ASP HB3 3.398 2.244 4.552 2.501 2.273 2.610 . 0 0 "[ . 1]" 1
535 1 55 HIS HA 1 58 LEU HB2 5.430 2.482 8.378 4.148 3.965 4.683 . 0 0 "[ . 1]" 1
536 1 27 LEU HA 1 27 LEU HB2 3.546 2.289 4.803 2.718 2.590 2.777 . 0 0 "[ . 1]" 1
537 1 19 ASP HB2 1 20 PHE HA 3.977 2.396 5.558 4.738 4.199 5.782 0.224 2 0 "[ . 1]" 1
538 1 16 ILE HB 1 17 GLU HA 4.510 2.476 6.544 4.446 4.313 4.571 . 0 0 "[ . 1]" 1
539 1 63 LEU HA 1 63 LEU HB2 3.062 2.124 4.000 2.478 2.427 2.523 . 0 0 "[ . 1]" 1
540 1 60 LEU HA 1 63 LEU HB2 4.771 2.494 7.048 5.079 4.854 5.336 . 0 0 "[ . 1]" 1
541 1 58 LEU HA 1 58 LEU HB2 2.820 2.024 3.616 2.678 2.539 2.855 . 0 0 "[ . 1]" 1
542 1 7 LYS HA 1 7 LYS HB2 2.949 2.080 3.818 2.453 2.336 2.565 . 0 0 "[ . 1]" 1
543 1 7 LYS HB2 1 73 THR HA 3.470 . 6.000 4.445 3.963 4.785 . 0 0 "[ . 1]" 1
544 1 7 LYS HB2 1 7 LYS QE 5.119 2.498 7.740 3.943 3.467 4.272 . 0 0 "[ . 1]" 1
545 1 7 LYS HB3 1 15 SER HA 5.514 2.473 8.555 5.424 5.069 5.745 . 0 0 "[ . 1]" 1
546 1 7 LYS HA 1 7 LYS HB3 3.168 2.164 4.172 3.017 3.001 3.026 . 0 0 "[ . 1]" 1
547 1 7 LYS HB3 1 73 THR HA 3.734 2.340 5.128 2.790 2.517 3.065 . 0 0 "[ . 1]" 1
548 1 7 LYS HB3 1 7 LYS QE 5.062 2.500 7.624 3.546 2.624 4.426 . 0 0 "[ . 1]" 1
549 1 37 GLU HA 1 37 GLU HG2 2.927 2.070 3.784 2.869 2.389 3.193 . 0 0 "[ . 1]" 1
550 1 34 ILE HA 1 34 ILE HB 3.088 2.134 4.042 3.019 3.011 3.026 . 0 0 "[ . 1]" 1
551 1 81 GLU HA 1 81 GLU HG2 3.828 2.363 5.293 3.354 2.779 3.814 . 0 0 "[ . 1]" 1
552 1 81 GLU HA 1 81 GLU HG3 3.355 2.229 4.481 3.594 3.166 3.831 . 0 0 "[ . 1]" 1
553 1 17 GLU HA 1 17 GLU HG2 2.958 2.083 3.833 2.671 2.199 3.634 . 0 0 "[ . 1]" 1
554 1 17 GLU HA 1 17 GLU HG3 3.463 2.264 4.662 2.976 2.741 3.350 . 0 0 "[ . 1]" 1
555 1 16 ILE HA 1 17 GLU HG2 4.419 2.466 6.372 5.053 4.556 5.397 . 0 0 "[ . 1]" 1
556 1 16 ILE HA 1 17 GLU HG3 3.726 2.337 5.115 3.706 3.233 4.245 . 0 0 "[ . 1]" 1
557 1 28 GLN HA 1 28 GLN QG 3.903 2.380 4.165 2.963 2.725 3.190 . 0 0 "[ . 1]" 1
558 1 45 ILE HA 1 46 LYS QB 4.617 2.486 6.748 4.511 4.168 4.654 . 0 0 "[ . 1]" 1
559 1 46 LYS HA 1 46 LYS QB 3.137 2.153 4.121 2.300 2.171 2.434 . 0 0 "[ . 1]" 1
560 1 36 GLU HA 1 36 GLU QG 3.459 2.262 4.656 2.514 2.108 3.086 0.154 6 0 "[ . 1]" 1
561 1 35 SER HB2 1 36 GLU QG 3.638 2.315 4.961 4.017 3.208 5.170 0.209 6 0 "[ . 1]" 1
562 1 24 ASP HA 1 28 GLN QG 4.003 2.401 5.605 4.093 3.477 4.962 . 0 0 "[ . 1]" 1
563 1 7 LYS HB2 1 15 SER HA 5.201 2.496 7.906 4.349 3.769 4.786 . 0 0 "[ . 1]" 1
564 1 19 ASP HA 1 19 ASP HB2 3.469 2.265 4.673 2.579 2.382 2.779 . 0 0 "[ . 1]" 1
565 1 54 LEU HA 1 54 LEU HB3 3.335 2.222 4.448 2.728 2.554 2.904 . 0 0 "[ . 1]" 1
566 1 12 PRO HA 1 12 PRO HG2 4.142 2.426 5.858 3.997 3.878 4.078 . 0 0 "[ . 1]" 1
567 1 12 PRO HA 1 12 PRO HG3 4.041 2.408 5.674 3.482 3.149 4.018 . 0 0 "[ . 1]" 1
568 1 11 ALA MB 1 12 PRO HG2 4.974 2.500 7.448 5.262 5.206 5.336 . 0 0 "[ . 1]" 1
569 1 11 ALA MB 1 12 PRO HG3 4.782 2.495 7.069 4.442 4.067 5.223 . 0 0 "[ . 1]" 1
570 1 1 MET HB3 1 20 PHE HA 3.995 2.399 5.591 4.884 4.040 6.485 0.894 2 1 "[ + . 1]" 1
571 1 1 MET HB2 1 20 PHE HA 4.616 2.485 6.747 5.725 4.197 6.703 . 0 0 "[ . 1]" 1
572 1 1 MET HA 1 1 MET HB3 3.466 2.265 4.667 2.589 2.400 2.902 . 0 0 "[ . 1]" 1
573 1 1 MET HA 1 1 MET HB2 3.492 2.272 4.712 2.983 2.800 3.029 . 0 0 "[ . 1]" 1
574 1 49 LEU QD 1 69 ASN HB3 2.897 2.058 3.736 3.071 2.639 3.588 . 0 0 "[ . 1]" 1
575 1 26 ILE MG 1 29 ILE HB 2.481 . 3.096 2.911 2.705 3.045 . 0 0 "[ . 1]" 1
576 1 63 LEU HB2 1 63 LEU QD 2.113 . 2.560 2.076 2.046 2.099 . 0 0 "[ . 1]" 1
577 1 6 LEU HB3 1 6 LEU HG 3.163 2.163 4.163 2.322 2.294 2.360 . 0 0 "[ . 1]" 1
578 1 6 LEU HB3 1 74 VAL MG2 2.325 . 2.866 2.338 2.063 2.653 . 0 0 "[ . 1]" 1
579 1 42 ILE HB 1 42 ILE QG 2.504 . 3.131 2.376 2.284 2.486 . 0 0 "[ . 1]" 1
580 1 34 ILE MD 1 42 ILE HB 2.507 . 3.136 2.284 1.898 4.233 1.097 1 1 "[+ . 1]" 1
581 1 42 ILE HA 1 42 ILE HB 2.545 . 3.193 2.387 2.283 2.467 . 0 0 "[ . 1]" 1
582 1 41 HIS HA 1 42 ILE HB 3.988 2.398 5.578 4.828 4.557 5.800 0.222 1 0 "[ . 1]" 1
583 1 9 ILE HB 1 9 ILE QG 2.744 . 3.497 2.372 2.328 2.438 . 0 0 "[ . 1]" 1
584 1 80 LEU HA 1 80 LEU HB3 2.725 . 3.468 2.459 2.349 2.525 . 0 0 "[ . 1]" 1
585 1 80 LEU HA 1 80 LEU HB2 2.467 . 3.075 3.017 3.000 3.022 . 0 0 "[ . 1]" 1
586 1 60 LEU HB3 1 63 LEU QD 3.067 2.126 4.008 3.631 3.378 3.810 . 0 0 "[ . 1]" 1
587 1 27 LEU HB2 1 28 GLN QG 6.200 2.356 10.044 4.582 4.238 5.672 . 0 0 "[ . 1]" 1
588 1 27 LEU HB3 1 28 GLN QG 6.159 2.366 9.952 3.581 3.258 4.145 . 0 0 "[ . 1]" 1
589 1 25 THR MG 1 28 GLN QG 4.282 2.448 6.116 4.433 4.085 5.359 . 0 0 "[ . 1]" 1
590 1 49 LEU HB2 1 54 LEU QD 2.474 . 3.086 2.212 1.951 2.558 . 0 0 "[ . 1]" 1
591 1 49 LEU HB2 1 49 LEU HG 2.902 2.060 3.744 3.016 3.005 3.021 . 0 0 "[ . 1]" 1
592 1 49 LEU HA 1 49 LEU HB2 3.989 2.398 5.580 2.404 2.313 2.455 0.085 6 0 "[ . 1]" 1
593 1 33 LEU HB3 1 33 LEU HG 4.024 2.405 5.643 3.017 3.010 3.020 . 0 0 "[ . 1]" 1
594 1 33 LEU HB3 1 39 ALA MB 4.262 2.446 6.078 2.510 2.184 2.887 0.262 5 0 "[ . 1]" 1
595 1 33 LEU HA 1 33 LEU HB3 3.659 2.320 4.998 2.427 2.357 2.568 . 0 0 "[ . 1]" 1
596 1 33 LEU H 1 33 LEU HB3 4.857 2.498 7.216 3.586 3.570 3.600 . 0 0 "[ . 1]" 1
597 1 65 VAL HA 1 65 VAL HB 2.518 . 3.152 2.957 2.382 3.027 . 0 0 "[ . 1]" 1
598 1 27 LEU QD 1 31 GLN HG3 2.414 . 2.997 2.885 2.644 3.101 0.104 10 0 "[ . 1]" 1
599 1 74 VAL HB 1 74 VAL MG2 1.891 . 2.249 2.127 2.116 2.130 . 0 0 "[ . 1]" 1
600 1 29 ILE HB 1 29 ILE HG12 4.027 2.406 5.648 3.028 3.022 3.033 . 0 0 "[ . 1]" 1
601 1 9 ILE QG 1 73 THR HA 3.848 2.368 4.280 4.271 3.805 5.788 1.508 2 1 "[ + . 1]" 1
602 1 63 LEU HA 1 63 LEU HG 3.772 2.349 5.195 3.628 3.607 3.654 . 0 0 "[ . 1]" 1
603 1 80 LEU HA 1 80 LEU HG 2.996 2.099 3.893 3.070 2.890 3.238 . 0 0 "[ . 1]" 1
604 1 27 LEU HA 1 27 LEU HG 3.594 2.302 4.886 3.664 3.631 3.708 . 0 0 "[ . 1]" 1
605 1 54 LEU H 1 54 LEU HG 3.610 2.306 4.914 4.453 3.924 4.692 . 0 0 "[ . 1]" 1
606 1 4 LEU HA 1 4 LEU MD2 2.702 . 3.432 3.453 3.040 3.662 0.230 7 0 "[ . 1]" 1
607 1 7 LYS HA 1 7 LYS HG2 3.417 2.250 4.584 3.190 2.700 3.925 . 0 0 "[ . 1]" 1
608 1 47 LEU QD 1 74 VAL HA 2.162 . 2.630 2.098 1.966 2.255 . 0 0 "[ . 1]" 1
609 1 50 LYS HA 1 50 LYS HG2 3.214 2.181 4.247 3.609 3.125 3.736 . 0 0 "[ . 1]" 1
610 1 50 LYS HA 1 50 LYS HG3 3.010 2.104 3.916 2.818 2.421 3.054 . 0 0 "[ . 1]" 1
611 1 50 LYS QE 1 50 LYS HG2 3.183 2.170 4.196 2.550 2.338 2.994 . 0 0 "[ . 1]" 1
612 1 7 LYS QE 1 7 LYS HG3 2.903 2.060 3.746 2.760 2.385 3.245 . 0 0 "[ . 1]" 1
613 1 27 LEU QD 1 31 GLN HG2 2.141 . 2.599 2.405 2.236 2.681 0.082 5 0 "[ . 1]" 1
614 1 58 LEU HG 1 59 PHE H 2.290 . 2.815 2.635 2.477 2.937 0.122 5 0 "[ . 1]" 1
615 1 37 GLU HA 1 37 GLU HB2 3.646 2.316 4.976 3.007 2.928 3.026 . 0 0 "[ . 1]" 1
616 1 49 LEU QD 1 72 ILE HA 3.547 2.289 4.805 3.005 2.580 3.236 . 0 0 "[ . 1]" 1
617 1 60 LEU HA 1 60 LEU HG 3.231 2.187 4.275 3.163 2.866 3.340 . 0 0 "[ . 1]" 1
618 1 77 LYS HA 1 78 PRO HG3 4.598 2.484 6.712 4.348 4.129 4.392 . 0 0 "[ . 1]" 1
619 1 77 LYS HA 1 78 PRO HG2 4.763 2.494 7.032 4.239 4.072 4.411 . 0 0 "[ . 1]" 1
620 1 78 PRO HA 1 78 PRO HG2 3.827 2.363 5.291 3.891 3.851 4.026 . 0 0 "[ . 1]" 1
621 1 78 PRO QD 1 78 PRO HG3 2.419 . 3.004 2.180 2.170 2.217 . 0 0 "[ . 1]" 1
622 1 22 PRO HD3 1 22 PRO HG2 2.613 . 3.296 2.965 2.719 3.000 . 0 0 "[ . 1]" 1
623 1 30 LYS HA 1 33 LEU QD 2.564 . 3.222 2.184 1.887 2.554 0.019 8 0 "[ . 1]" 1
624 1 34 ILE H 1 34 ILE HG13 2.363 . 2.921 1.947 1.769 2.265 0.036 10 0 "[ . 1]" 1
625 1 14 PHE HZ 1 33 LEU QD 3.232 2.187 4.277 2.088 1.851 2.817 0.336 9 0 "[ . 1]" 1
626 1 14 PHE QE 1 33 LEU QD 4.212 2.438 5.986 2.755 2.385 2.915 0.053 6 0 "[ . 1]" 1
627 1 50 LYS HA 1 50 LYS QD 2.225 . 2.720 2.162 1.857 3.892 1.172 9 1 "[ . +1]" 1
628 1 67 PRO HB3 1 67 PRO HD3 4.369 2.460 6.278 3.113 2.918 3.983 . 0 0 "[ . 1]" 1
629 1 67 PRO HB2 1 67 PRO HD2 4.251 2.444 6.058 3.933 3.076 4.064 . 0 0 "[ . 1]" 1
630 1 47 LEU HA 1 75 MET QG 4.660 2.488 6.832 4.978 3.830 6.015 . 0 0 "[ . 1]" 1
631 1 22 PRO HA 1 22 PRO HB3 2.896 2.057 3.735 2.284 2.268 2.300 . 0 0 "[ . 1]" 1
632 1 22 PRO HB3 1 22 PRO HD2 3.492 2.272 4.712 3.890 3.870 3.924 . 0 0 "[ . 1]" 1
633 1 7 LYS QE 1 9 ILE HB 4.203 2.437 5.969 5.237 4.566 5.974 0.005 7 0 "[ . 1]" 1
634 1 7 LYS QD 1 7 LYS QE 1.824 . 6.000 2.060 2.026 2.090 . 0 0 "[ . 1]" 1
635 1 7 LYS QE 1 7 LYS HG2 2.105 . 2.548 2.243 2.031 2.647 0.099 6 0 "[ . 1]" 1
636 1 7 LYS QE 1 9 ILE MG 2.638 . 3.334 4.250 3.575 5.202 1.868 2 7 "[ +-** ** *]" 1
637 1 7 LYS HA 1 7 LYS QE 4.368 2.460 6.276 4.667 4.347 4.869 . 0 0 "[ . 1]" 1
638 1 7 LYS QE 1 9 ILE HA 2.498 . 3.122 4.149 3.309 5.114 1.992 7 7 "[ ***- +* *]" 1
639 1 7 LYS QE 1 8 LYS H 4.474 2.472 6.476 5.239 4.647 5.757 . 0 0 "[ . 1]" 1
640 1 50 LYS H 1 50 LYS QE 3.737 2.340 5.134 5.096 3.580 6.466 1.332 9 2 "[ -. +1]" 1
641 1 50 LYS QE 1 69 ASN QD 2.813 2.299 3.604 3.787 2.568 5.583 1.979 2 3 "[ + . - *]" 1
642 1 50 LYS QB 1 50 LYS QE 1.898 . 2.258 3.405 2.148 3.881 1.623 5 8 "[** *+***-1]" 1
643 1 50 LYS QD 1 50 LYS QE 1.834 . 6.000 1.994 1.972 2.022 . 0 0 "[ . 1]" 1
644 1 50 LYS QE 1 71 THR MG 3.438 . 6.000 5.475 3.132 8.383 2.383 9 2 "[ -. +1]" 1
645 1 49 LEU QD 1 50 LYS QE 2.525 . 3.162 5.394 3.963 6.269 3.107 2 10 [*+**-*****] 1
646 1 50 LYS QE 1 69 ASN HA 3.707 . 6.000 4.941 3.589 6.256 0.256 2 0 "[ . 1]" 1
647 1 69 ASN HB2 1 71 THR HB 5.956 2.409 9.503 5.773 5.295 6.638 . 0 0 "[ . 1]" 1
648 1 41 HIS HA 1 41 HIS HB2 3.072 2.128 4.016 2.859 2.628 3.031 . 0 0 "[ . 1]" 1
649 1 40 SER HB2 1 41 HIS HB2 5.181 2.497 7.865 3.578 3.158 5.267 . 0 0 "[ . 1]" 1
650 1 10 GLN HA 1 10 GLN HB2 3.141 2.155 4.127 3.014 3.001 3.024 . 0 0 "[ . 1]" 1
651 1 50 LYS HA 1 50 LYS QB 3.027 2.173 3.472 2.444 2.377 2.515 . 0 0 "[ . 1]" 1
652 1 8 LYS QD 1 8 LYS QE 2.328 . 2.870 2.000 1.978 2.018 . 0 0 "[ . 1]" 1
653 1 48 LEU HG 1 53 VAL HA 3.176 2.167 4.185 4.927 4.502 5.786 1.601 1 9 "[+ ***-****]" 1
654 1 48 LEU HA 1 48 LEU HG 3.344 2.226 4.462 3.633 3.222 3.737 . 0 0 "[ . 1]" 1
655 1 40 SER H 1 76 ILE MD 3.230 2.187 4.273 3.907 3.347 4.488 0.215 3 0 "[ . 1]" 1
656 1 14 PHE HZ 1 76 ILE MD 2.454 . 3.056 3.621 2.997 4.992 1.936 10 5 "[ - . ***+]" 1
657 1 14 PHE QE 1 76 ILE MD 3.664 2.321 5.007 3.276 2.785 3.821 . 0 0 "[ . 1]" 1
658 1 76 ILE HA 1 76 ILE MD 3.198 2.175 4.221 3.913 3.861 3.978 . 0 0 "[ . 1]" 1
659 1 39 ALA HA 1 76 ILE MD 2.702 . 3.432 2.592 1.887 3.195 0.085 5 0 "[ . 1]" 1
660 1 8 LYS QE 1 76 ILE MD 2.267 . 2.781 2.520 2.012 3.087 0.306 3 0 "[ . 1]" 1
661 1 8 LYS QD 1 76 ILE MD 1.910 . 2.275 2.228 1.980 2.443 0.168 8 0 "[ . 1]" 1
662 1 46 LYS HG2 1 47 LEU H 4.811 2.496 7.126 4.771 2.987 5.328 . 0 0 "[ . 1]" 1
663 1 14 PHE QD 1 16 ILE HG13 3.786 2.352 5.220 4.214 3.500 5.148 . 0 0 "[ . 1]" 1
664 1 27 LEU HG 1 31 GLN QE 4.875 2.499 5.996 5.453 4.814 6.650 0.654 8 2 "[ - + 1]" 1
665 1 27 LEU H 1 27 LEU HG 4.678 2.489 6.867 4.410 4.358 4.469 . 0 0 "[ . 1]" 1
666 1 14 PHE QD 1 16 ILE HG12 4.546 2.480 6.612 2.592 2.176 3.584 0.304 6 0 "[ . 1]" 1
667 1 24 ASP H 1 60 LEU HG 3.589 2.301 4.877 3.678 3.327 4.314 . 0 0 "[ . 1]" 1
668 1 7 LYS QD 1 9 ILE HA 3.963 2.392 5.534 5.605 3.933 6.320 0.786 2 2 "[ + . - 1]" 1
669 1 52 LYS H 1 52 LYS QD 5.320 2.489 8.151 4.372 4.206 4.645 . 0 0 "[ . 1]" 1
670 1 7 LYS QD 1 15 SER HA 4.369 2.460 6.278 5.436 4.212 5.903 . 0 0 "[ . 1]" 1
671 1 7 LYS HA 1 7 LYS QD 2.690 . 3.413 3.823 2.438 4.128 0.715 5 6 "[*** + -*1]" 1
672 1 30 LYS QB 1 42 ILE QG 2.407 . 2.986 2.509 1.967 4.500 1.514 1 1 "[+ . 1]" 1
673 1 60 LEU H 1 60 LEU HG 2.333 . 2.877 2.339 2.203 2.551 . 0 0 "[ . 1]" 1
674 1 42 ILE QG 1 43 SER HA 3.592 2.302 4.882 3.438 3.073 3.897 . 0 0 "[ . 1]" 1
675 1 50 LYS HG2 1 69 ASN QD 6.157 2.366 9.948 2.865 1.703 4.133 0.663 5 1 "[ + 1]" 1
676 1 50 LYS HG3 1 69 ASN QD 5.953 2.409 9.497 4.087 2.309 4.790 0.100 5 0 "[ . 1]" 1
677 1 7 LYS HA 1 7 LYS HG3 4.130 2.424 5.836 2.692 2.311 3.429 0.113 7 0 "[ . 1]" 1
678 1 52 LYS HA 1 52 LYS HG3 3.393 2.242 4.544 2.544 2.388 2.826 . 0 0 "[ . 1]" 1
679 1 7 LYS HG3 1 8 LYS H 4.711 2.492 6.930 3.842 3.565 4.285 . 0 0 "[ . 1]" 1
680 1 76 ILE HA 1 77 LYS QB 5.099 2.499 7.699 4.384 4.020 4.527 . 0 0 "[ . 1]" 1
681 1 77 LYS HA 1 77 LYS HG2 2.706 . 3.438 3.015 2.480 3.378 . 0 0 "[ . 1]" 1
682 1 77 LYS HA 1 77 LYS HG3 2.999 2.100 3.898 3.573 2.817 3.836 . 0 0 "[ . 1]" 1
683 1 46 LYS HA 1 46 LYS HG3 3.153 2.159 4.147 3.626 2.340 4.100 . 0 0 "[ . 1]" 1
684 1 64 LYS HA 1 64 LYS QG 2.665 . 3.375 2.447 2.368 2.525 . 0 0 "[ . 1]" 1
685 1 52 LYS HG2 1 53 VAL HA 3.432 2.254 4.610 4.783 4.290 5.535 0.925 1 2 "[+ . - 1]" 1
686 1 77 LYS HG2 1 78 PRO QD 4.078 2.415 5.741 4.414 3.822 4.836 . 0 0 "[ . 1]" 1
687 1 77 LYS QE 1 77 LYS HG2 2.925 2.069 3.781 3.080 2.216 3.361 . 0 0 "[ . 1]" 1
688 1 46 LYS HA 1 46 LYS HG2 3.433 2.255 4.611 3.035 2.516 3.550 . 0 0 "[ . 1]" 1
689 1 46 LYS QE 1 46 LYS HG2 3.050 2.120 3.980 3.013 2.257 3.315 . 0 0 "[ . 1]" 1
690 1 6 LEU HA 1 74 VAL MG2 2.680 . 3.398 2.958 2.554 3.175 . 0 0 "[ . 1]" 1
691 1 73 THR HA 1 74 VAL MG2 3.175 2.167 4.183 3.390 3.268 3.609 . 0 0 "[ . 1]" 1
692 1 47 LEU HA 1 74 VAL MG2 3.305 2.213 4.397 4.245 4.027 4.412 0.015 5 0 "[ . 1]" 1
693 1 6 LEU HA 1 72 ILE MG 3.749 2.344 5.154 4.040 3.388 4.769 . 0 0 "[ . 1]" 1
694 1 9 ILE HA 1 9 ILE MG 1.787 . 6.000 2.413 2.304 2.585 . 0 0 "[ . 1]" 1
695 1 41 HIS HA 1 42 ILE MG 3.086 2.134 4.038 3.668 3.424 3.975 . 0 0 "[ . 1]" 1
696 1 42 ILE HA 1 42 ILE MG 2.511 . 3.141 3.111 2.330 3.222 0.081 7 0 "[ . 1]" 1
697 1 34 ILE MG 1 35 SER HA 3.021 2.108 3.934 3.733 3.449 3.975 0.041 3 0 "[ . 1]" 1
698 1 34 ILE HA 1 34 ILE MG 1.979 . 2.371 2.336 2.225 2.400 0.029 2 0 "[ . 1]" 1
699 1 47 LEU HA 1 72 ILE MG 2.842 2.034 3.650 3.555 3.304 4.075 0.425 2 0 "[ . 1]" 1
700 1 72 ILE HA 1 72 ILE MG 2.270 . 2.785 2.313 2.122 2.427 . 0 0 "[ . 1]" 1
701 1 49 LEU HA 1 49 LEU QD 2.001 . 2.401 2.282 2.149 2.397 . 0 0 "[ . 1]" 1
702 1 80 LEU HA 1 80 LEU MD2 2.005 . 2.407 2.157 2.013 2.529 0.122 10 0 "[ . 1]" 1
703 1 4 LEU HA 1 4 LEU MD1 2.866 2.045 3.687 3.076 1.963 3.704 0.082 5 0 "[ . 1]" 1
704 1 27 LEU QD 1 56 ASP HA 3.261 2.198 4.324 3.185 2.924 3.982 . 0 0 "[ . 1]" 1
705 1 4 LEU MD1 1 60 LEU HA 3.056 . 6.000 5.342 4.998 5.756 . 0 0 "[ . 1]" 1
706 1 60 LEU HA 1 63 LEU QD 2.253 . 2.760 2.098 1.951 2.209 . 0 0 "[ . 1]" 1
707 1 4 LEU MD1 1 20 PHE HB3 2.488 . 6.000 3.955 3.197 5.830 . 0 0 "[ . 1]" 1
708 1 76 ILE HA 1 76 ILE HG12 2.815 2.022 3.608 2.718 2.593 2.848 . 0 0 "[ . 1]" 1
709 1 76 ILE HA 1 76 ILE HG13 3.085 2.133 4.037 3.105 2.865 3.233 . 0 0 "[ . 1]" 1
710 1 72 ILE HA 1 72 ILE HG12 3.256 2.196 4.316 3.172 2.950 3.475 . 0 0 "[ . 1]" 1
711 1 72 ILE HA 1 72 ILE HG13 3.742 2.342 5.142 3.876 3.770 4.141 . 0 0 "[ . 1]" 1
712 1 34 ILE HA 1 34 ILE HG13 3.055 2.122 3.988 3.087 2.902 3.262 . 0 0 "[ . 1]" 1
713 1 27 LEU QD 1 56 ASP HB3 2.073 . 2.503 2.152 1.889 2.915 0.412 2 0 "[ . 1]" 1
714 1 2 VAL HB 1 2 VAL QG 1.814 . 2.143 1.894 1.886 1.897 . 0 0 "[ . 1]" 1
715 1 76 ILE HB 1 76 ILE MG 1.740 . 2.043 2.128 2.114 2.136 0.093 3 0 "[ . 1]" 1
716 1 16 ILE HG13 1 16 ILE MG 1.902 . 6.000 3.202 3.191 3.207 . 0 0 "[ . 1]" 1
717 1 26 ILE HG13 1 26 ILE MG 2.055 . 2.477 2.281 2.130 2.390 . 0 0 "[ . 1]" 1
718 1 34 ILE HB 1 34 ILE MG 1.746 . 2.051 2.128 2.119 2.137 0.086 4 0 "[ . 1]" 1
719 1 49 LEU QD 1 50 LYS QD 3.715 2.335 5.095 4.575 3.314 5.539 0.444 10 0 "[ . 1]" 1
720 1 52 LYS QD 1 54 LEU QD 2.562 . 3.218 3.688 3.025 4.825 1.607 1 5 "[+* -.* * 1]" 1
721 1 52 LYS QE 1 54 LEU HG 1.972 . 6.000 6.291 4.818 7.395 1.395 5 4 "[ * -+* 1]" 1
722 1 64 LYS HE2 1 64 LYS QG 2.071 . 2.500 2.500 2.315 3.311 0.811 5 1 "[ + 1]" 1
723 1 58 LEU QD 1 62 ASP QB 2.450 . 3.050 2.905 2.135 3.730 0.680 5 1 "[ + 1]" 1
724 1 64 LYS H 1 64 LYS HE2 4.924 2.500 7.348 4.742 3.798 5.979 . 0 0 "[ . 1]" 1
725 1 46 LYS H 1 46 LYS QE 5.775 2.440 9.110 5.001 4.279 6.191 . 0 0 "[ . 1]" 1
726 1 8 LYS QE 1 14 PHE HZ 4.340 2.457 6.223 5.504 4.469 6.858 0.635 10 1 "[ . +]" 1
727 1 21 SER H 1 22 PRO HD2 7.158 2.034 12.282 4.826 4.728 5.117 . 0 0 "[ . 1]" 1
728 1 14 PHE HB3 1 14 PHE QD 4.191 2.435 5.947 2.404 2.293 2.642 0.142 5 0 "[ . 1]" 1
729 1 20 PHE QD 1 24 ASP HB2 6.572 2.253 10.891 4.058 3.495 4.559 . 0 0 "[ . 1]" 1
730 1 17 GLU H 1 17 GLU HB2 3.505 2.277 4.733 2.602 2.453 2.970 . 0 0 "[ . 1]" 1
731 1 17 GLU HB2 1 18 HIS H 3.844 2.367 5.321 4.191 3.936 4.444 . 0 0 "[ . 1]" 1
732 1 9 ILE H 1 74 VAL HB 4.962 2.500 7.424 4.023 3.660 4.372 . 0 0 "[ . 1]" 1
733 1 34 ILE HG12 1 35 SER H 5.392 2.484 8.300 4.906 4.811 5.048 . 0 0 "[ . 1]" 1
734 1 49 LEU QD 1 69 ASN QD . 2.061 2.558 3.419 2.406 4.447 1.889 4 7 "[* +***- *]" 1
735 1 49 LEU QD 1 50 LYS H . 2.485 3.706 3.250 3.108 3.470 . 0 0 "[ . 1]" 1
736 1 21 SER HA 1 22 PRO HG2 4.919 2.500 7.338 4.422 4.314 4.537 . 0 0 "[ . 1]" 1
737 1 4 LEU HG 1 71 THR HA 4.820 2.496 7.144 6.424 5.823 8.109 0.965 2 1 "[ + . 1]" 1
738 1 6 LEU HA 1 6 LEU HG 3.773 2.349 5.197 3.666 3.598 3.715 . 0 0 "[ . 1]" 1
739 1 54 LEU H 1 54 LEU HB3 4.946 2.499 7.393 3.417 3.100 3.631 . 0 0 "[ . 1]" 1
740 1 54 LEU HB3 1 55 HIS H 4.428 2.467 6.389 2.883 2.615 4.062 . 0 0 "[ . 1]" 1
741 1 16 ILE HB 1 16 ILE HG13 2.729 . 3.474 2.500 2.433 2.542 . 0 0 "[ . 1]" 1
742 1 16 ILE HB 1 16 ILE HG12 2.399 . 2.974 3.025 3.020 3.029 0.055 5 0 "[ . 1]" 1
743 1 25 THR HA 1 57 ASN HA 5.516 2.474 8.558 5.311 4.880 5.863 . 0 0 "[ . 1]" 1
744 1 7 LYS H 1 71 THR HA 6.121 2.374 9.868 5.129 4.927 5.347 . 0 0 "[ . 1]" 1
745 1 21 SER H 1 22 PRO HD3 6.757 2.191 11.323 5.107 4.626 5.241 . 0 0 "[ . 1]" 1
746 1 25 THR H 1 28 GLN QG 3.736 2.341 5.131 2.788 2.256 3.579 0.085 10 0 "[ . 1]" 1
747 1 13 LYS H 1 13 LYS QD 4.686 2.490 6.882 3.960 3.619 4.693 . 0 0 "[ . 1]" 1
748 1 63 LEU HG 1 64 LYS H 3.691 2.328 5.054 2.425 2.261 2.560 0.067 1 0 "[ . 1]" 1
749 1 6 LEU H 1 16 ILE HG13 4.272 2.447 6.097 3.290 3.124 3.625 . 0 0 "[ . 1]" 1
750 1 14 PHE QE 1 74 VAL HB 6.424 2.297 10.551 4.375 3.998 4.807 . 0 0 "[ . 1]" 1
751 1 1 MET HG2 1 2 VAL H 5.020 2.500 7.540 3.882 2.632 4.953 . 0 0 "[ . 1]" 1
752 1 5 THR HA 1 16 ILE H 5.816 2.433 9.199 4.886 4.616 5.178 . 0 0 "[ . 1]" 1
753 1 66 THR HB 1 69 ASN H 5.562 2.469 8.655 3.149 2.720 3.486 . 0 0 "[ . 1]" 1
754 1 8 LYS QE 1 76 ILE HB 2.237 . 2.737 2.088 1.879 2.243 . 0 0 "[ . 1]" 1
755 1 76 ILE HA 1 76 ILE HB 3.254 2.195 4.313 3.019 3.003 3.029 . 0 0 "[ . 1]" 1
756 1 17 GLU HA 1 18 HIS HB2 6.424 2.297 10.551 4.305 4.033 4.519 . 0 0 "[ . 1]" 1
757 1 60 LEU HA 1 63 LEU HB3 4.588 2.483 6.693 4.703 4.507 4.901 . 0 0 "[ . 1]" 1
758 1 26 ILE HB 1 58 LEU HB3 4.271 2.446 6.096 4.069 3.591 4.460 . 0 0 "[ . 1]" 1
759 1 55 HIS HB3 1 58 LEU HB3 5.222 2.495 7.949 5.058 4.537 5.777 . 0 0 "[ . 1]" 1
760 1 33 LEU HB2 1 33 LEU QD 2.378 . 2.943 2.240 2.182 2.328 . 0 0 "[ . 1]" 1
761 1 33 LEU QD 1 33 LEU HG 1.885 . 2.240 1.890 1.875 1.896 . 0 0 "[ . 1]" 1
762 1 10 GLN HA 1 13 LYS QE 2.920 2.068 3.772 5.245 4.128 5.907 2.135 4 9 "[* *+-*****]" 1
763 1 50 LYS HA 1 52 LYS H 4.800 2.496 7.104 4.384 4.264 4.461 . 0 0 "[ . 1]" 1
764 1 25 THR HA 1 26 ILE HA 5.025 2.500 7.550 4.330 4.313 4.350 . 0 0 "[ . 1]" 1
765 1 12 PRO HB2 1 13 LYS H 4.071 2.413 5.729 3.631 3.266 3.783 . 0 0 "[ . 1]" 1
766 1 11 ALA HA 1 13 LYS H 2.321 . 2.860 2.412 2.244 2.747 . 0 0 "[ . 1]" 1
767 1 12 PRO HA 1 13 LYS H 2.457 . 3.061 2.176 2.144 2.196 . 0 0 "[ . 1]" 1
768 1 13 LYS H 1 13 LYS HA 2.780 2.007 3.553 2.904 2.884 2.919 . 0 0 "[ . 1]" 1
769 1 6 LEU H 1 7 LYS H 4.643 2.487 6.799 4.383 4.291 4.467 . 0 0 "[ . 1]" 1
770 1 7 LYS H 1 72 ILE H 3.684 2.327 5.041 3.613 3.389 3.815 . 0 0 "[ . 1]" 1
771 1 7 LYS H 1 7 LYS HG2 4.149 2.428 5.870 4.457 4.320 4.628 . 0 0 "[ . 1]" 1
772 1 7 LYS H 1 15 SER HA 4.807 2.496 7.118 4.818 4.639 5.065 . 0 0 "[ . 1]" 1
773 1 6 LEU HA 1 7 LYS H 2.362 . 2.920 2.133 2.111 2.156 . 0 0 "[ . 1]" 1
774 1 7 LYS H 1 73 THR HA 3.394 2.242 4.546 3.278 2.925 3.595 . 0 0 "[ . 1]" 1
775 1 6 LEU HB2 1 7 LYS H 3.756 2.345 5.167 4.351 4.192 4.471 . 0 0 "[ . 1]" 1
776 1 7 LYS H 1 7 LYS HB2 2.957 2.083 3.831 3.037 2.808 3.230 . 0 0 "[ . 1]" 1
777 1 7 LYS H 1 7 LYS HB3 2.853 2.039 3.667 2.595 2.311 2.742 . 0 0 "[ . 1]" 1
778 1 7 LYS H 1 72 ILE HB 3.556 2.291 4.821 3.643 3.149 4.127 . 0 0 "[ . 1]" 1
779 1 8 LYS H 1 8 LYS HB2 3.094 2.137 4.051 2.872 2.716 2.971 . 0 0 "[ . 1]" 1
780 1 7 LYS H 1 8 LYS H 4.258 2.445 6.071 4.076 4.004 4.152 . 0 0 "[ . 1]" 1
781 1 8 LYS H 1 9 ILE H 4.101 2.419 5.783 4.344 4.228 4.422 . 0 0 "[ . 1]" 1
782 1 8 LYS H 1 14 PHE QD 4.451 2.469 6.433 4.046 3.636 4.413 . 0 0 "[ . 1]" 1
783 1 8 LYS H 1 15 SER HA 3.143 2.155 4.131 3.316 3.075 3.703 . 0 0 "[ . 1]" 1
784 1 7 LYS HA 1 8 LYS H 2.326 . 2.867 2.164 2.138 2.202 . 0 0 "[ . 1]" 1
785 1 8 LYS H 1 13 LYS HA 4.806 2.496 7.116 4.680 4.360 4.892 . 0 0 "[ . 1]" 1
786 1 7 LYS QD 1 8 LYS H 2.827 2.028 3.626 5.033 2.941 5.349 1.723 8 9 "[-**** *+**]" 1
787 1 8 LYS H 1 8 LYS HB3 2.785 2.009 3.561 2.440 2.294 2.603 . 0 0 "[ . 1]" 1
788 1 8 LYS H 1 14 PHE QE 5.864 2.425 9.303 4.463 4.000 4.782 . 0 0 "[ . 1]" 1
789 1 48 LEU H 1 73 THR H 3.402 2.244 4.560 3.539 3.097 3.906 . 0 0 "[ . 1]" 1
790 1 72 ILE HA 1 73 THR H 2.498 . 3.122 2.144 2.119 2.174 . 0 0 "[ . 1]" 1
791 1 73 THR H 1 73 THR HB 3.611 2.307 4.915 3.140 2.758 3.354 . 0 0 "[ . 1]" 1
792 1 72 ILE HB 1 73 THR H 3.982 2.396 5.568 4.126 3.801 4.339 . 0 0 "[ . 1]" 1
793 1 73 THR H 1 73 THR MG 2.725 . 3.468 3.490 3.223 3.755 0.287 1 0 "[ . 1]" 1
794 1 72 ILE MG 1 73 THR H 2.567 . 3.226 2.888 2.651 3.228 0.002 2 0 "[ . 1]" 1
795 1 72 ILE MD 1 73 THR H 3.649 2.318 4.980 4.037 3.687 4.718 . 0 0 "[ . 1]" 1
796 1 47 LEU HA 1 73 THR H 5.003 2.500 7.506 5.053 4.823 5.256 . 0 0 "[ . 1]" 1
797 1 4 LEU H 1 20 PHE QD 5.126 2.498 7.754 3.807 3.459 4.168 . 0 0 "[ . 1]" 1
798 1 4 LEU H 1 17 GLU HA 4.765 2.494 7.036 4.748 4.430 5.008 . 0 0 "[ . 1]" 1
799 1 3 HIS HA 1 4 LEU H 3.807 . 6.000 2.152 2.120 2.195 . 0 0 "[ . 1]" 1
800 1 3 HIS HB3 1 4 LEU H 4.534 2.478 6.590 3.610 3.268 4.195 . 0 0 "[ . 1]" 1
801 1 4 LEU HB3 1 5 THR H 4.246 2.443 6.049 3.346 3.030 3.539 . 0 0 "[ . 1]" 1
802 1 9 ILE H 1 9 ILE HA 2.737 . 3.486 2.882 2.852 2.899 . 0 0 "[ . 1]" 1
803 1 6 LEU H 1 17 GLU HA 3.339 2.224 4.454 3.125 2.952 3.351 . 0 0 "[ . 1]" 1
804 1 5 THR HA 1 6 LEU H 2.447 . 3.046 2.146 2.117 2.168 . 0 0 "[ . 1]" 1
805 1 5 THR HB 1 6 LEU H 4.660 2.488 6.832 4.234 4.153 4.280 . 0 0 "[ . 1]" 1
806 1 6 LEU H 1 6 LEU HB2 2.987 2.095 3.879 2.390 2.289 2.502 . 0 0 "[ . 1]" 1
807 1 6 LEU H 1 6 LEU HG 3.514 2.279 4.749 4.135 4.077 4.261 . 0 0 "[ . 1]" 1
808 1 58 LEU H 1 58 LEU HA 2.555 . 3.208 2.855 2.826 2.881 . 0 0 "[ . 1]" 1
809 1 55 HIS HA 1 58 LEU H 4.335 2.456 6.214 4.651 4.526 4.720 . 0 0 "[ . 1]" 1
810 1 57 ASN HA 1 58 LEU H 3.108 2.142 4.074 3.163 3.055 3.348 . 0 0 "[ . 1]" 1
811 1 55 HIS HB3 1 58 LEU H 3.973 2.395 5.551 3.616 3.467 3.875 . 0 0 "[ . 1]" 1
812 1 57 ASN HB2 1 58 LEU H 4.041 2.408 5.674 4.275 3.748 4.438 . 0 0 "[ . 1]" 1
813 1 58 LEU H 1 58 LEU HB2 2.178 . 2.653 2.235 2.131 2.418 . 0 0 "[ . 1]" 1
814 1 26 ILE HG13 1 58 LEU H 3.525 2.283 4.767 4.102 3.880 4.429 . 0 0 "[ . 1]" 1
815 1 57 ASN HB3 1 58 LEU H 3.741 2.342 5.140 3.921 3.685 4.266 . 0 0 "[ . 1]" 1
816 1 58 LEU H 1 59 PHE H 4.052 2.410 5.694 4.594 4.562 4.610 . 0 0 "[ . 1]" 1
817 1 14 PHE H 1 14 PHE HA 2.769 2.003 3.535 2.817 2.781 2.843 . 0 0 "[ . 1]" 1
818 1 13 LYS HA 1 14 PHE H 2.306 . 2.838 2.292 2.251 2.347 . 0 0 "[ . 1]" 1
819 1 14 PHE H 1 14 PHE HB3 4.222 2.440 6.004 3.538 3.448 3.636 . 0 0 "[ . 1]" 1
820 1 14 PHE H 1 14 PHE HB2 3.705 2.332 5.078 4.075 4.021 4.143 . 0 0 "[ . 1]" 1
821 1 13 LYS QB 1 14 PHE H . . 2.534 2.650 2.422 3.207 0.673 8 1 "[ . + 1]" 1
822 1 8 LYS QG 1 14 PHE H 3.641 2.315 4.967 3.354 2.931 4.119 . 0 0 "[ . 1]" 1
823 1 8 LYS HB3 1 14 PHE H 2.347 . 2.898 2.207 1.951 2.683 . 0 0 "[ . 1]" 1
824 1 8 LYS HB2 1 14 PHE H 4.269 2.447 6.091 3.900 3.707 4.247 . 0 0 "[ . 1]" 1
825 1 13 LYS H 1 14 PHE H 4.522 2.477 6.567 4.579 4.547 4.602 . 0 0 "[ . 1]" 1
826 1 8 LYS H 1 14 PHE H 3.009 2.104 3.914 3.044 2.795 3.249 . 0 0 "[ . 1]" 1
827 1 8 LYS H 1 16 ILE H 4.858 2.498 7.218 4.857 4.674 5.163 . 0 0 "[ . 1]" 1
828 1 14 PHE QD 1 16 ILE H 4.237 2.441 6.033 3.270 2.806 4.089 . 0 0 "[ . 1]" 1
829 1 15 SER HA 1 16 ILE H 2.371 . 2.933 2.161 2.124 2.194 . 0 0 "[ . 1]" 1
830 1 16 ILE H 1 16 ILE HA 2.952 2.081 3.823 2.944 2.935 2.949 . 0 0 "[ . 1]" 1
831 1 15 SER HB3 1 16 ILE H 3.644 2.316 4.972 3.699 3.201 3.900 . 0 0 "[ . 1]" 1
832 1 15 SER HB2 1 16 ILE H 4.513 2.476 6.550 4.361 4.055 4.463 . 0 0 "[ . 1]" 1
833 1 6 LEU H 1 16 ILE H 3.301 2.211 4.391 3.398 3.210 3.570 . 0 0 "[ . 1]" 1
834 1 6 LEU HB2 1 16 ILE H 3.481 2.269 4.693 2.899 2.766 3.103 . 0 0 "[ . 1]" 1
835 1 16 ILE H 1 16 ILE HB 3.508 2.277 4.739 3.788 3.741 3.854 . 0 0 "[ . 1]" 1
836 1 16 ILE H 1 16 ILE HG13 2.681 . 3.400 2.775 2.507 2.901 . 0 0 "[ . 1]" 1
837 1 16 ILE H 1 16 ILE HG12 2.804 2.018 3.590 2.305 2.036 2.487 . 0 0 "[ . 1]" 1
838 1 16 ILE H 1 16 ILE MD 4.101 2.420 5.782 3.885 3.736 4.007 . 0 0 "[ . 1]" 1
839 1 59 PHE HA 1 60 LEU H 2.671 . 3.385 2.268 2.225 2.296 . 0 0 "[ . 1]" 1
840 1 60 LEU H 1 60 LEU HA 2.960 2.084 3.836 2.781 2.757 2.796 . 0 0 "[ . 1]" 1
841 1 59 PHE HB3 1 60 LEU H 3.144 2.156 4.132 2.836 2.736 2.970 . 0 0 "[ . 1]" 1
842 1 60 LEU H 1 60 LEU HB2 2.843 2.035 3.651 2.477 2.333 2.546 . 0 0 "[ . 1]" 1
843 1 59 PHE HB2 1 60 LEU H 4.355 2.458 6.252 3.966 3.730 4.119 . 0 0 "[ . 1]" 1
844 1 59 PHE QD 1 60 LEU H 5.159 2.497 7.821 3.799 3.401 4.395 . 0 0 "[ . 1]" 1
845 1 25 THR HA 1 60 LEU H 3.602 2.305 4.899 3.568 3.004 4.045 . 0 0 "[ . 1]" 1
846 1 18 HIS H 1 20 PHE QD 5.040 2.500 7.580 4.998 4.754 5.519 . 0 0 "[ . 1]" 1
847 1 18 HIS H 1 19 ASP H 4.495 2.474 6.516 4.391 4.305 4.481 . 0 0 "[ . 1]" 1
848 1 17 GLU HA 1 18 HIS H 2.214 . 2.704 2.174 2.125 2.249 . 0 0 "[ . 1]" 1
849 1 5 THR HA 1 18 HIS H 3.229 2.186 4.272 3.463 3.213 3.687 . 0 0 "[ . 1]" 1
850 1 18 HIS H 1 18 HIS HA 2.954 2.082 3.826 2.924 2.905 2.955 . 0 0 "[ . 1]" 1
851 1 18 HIS H 1 18 HIS HB2 3.204 2.178 4.230 2.828 2.564 3.250 . 0 0 "[ . 1]" 1
852 1 17 GLU HG2 1 18 HIS H 4.292 2.450 6.134 4.440 3.912 5.470 . 0 0 "[ . 1]" 1
853 1 18 HIS H 1 18 HIS HB3 3.102 2.140 4.064 3.445 2.891 3.852 . 0 0 "[ . 1]" 1
854 1 4 LEU HB3 1 18 HIS H 3.730 2.339 5.121 4.926 4.650 5.365 0.244 8 0 "[ . 1]" 1
855 1 5 THR MG 1 18 HIS H 4.704 2.492 6.916 4.873 4.554 5.155 . 0 0 "[ . 1]" 1
856 1 6 LEU QD 1 18 HIS H 3.121 2.147 4.095 3.182 2.744 3.520 . 0 0 "[ . 1]" 1
857 1 6 LEU H 1 18 HIS H 4.124 2.424 5.824 4.126 3.765 4.400 . 0 0 "[ . 1]" 1
858 1 55 HIS HA 1 56 ASP H 2.095 . 2.534 2.290 2.189 2.357 . 0 0 "[ . 1]" 1
859 1 56 ASP H 1 58 LEU H 3.954 2.391 5.517 4.048 3.908 4.149 . 0 0 "[ . 1]" 1
860 1 56 ASP H 1 56 ASP HA 2.779 2.007 3.551 2.754 2.729 2.802 . 0 0 "[ . 1]" 1
861 1 55 HIS HB3 1 56 ASP H 2.901 2.060 3.742 2.620 2.481 2.911 . 0 0 "[ . 1]" 1
862 1 55 HIS HB2 1 56 ASP H 3.728 2.338 5.118 3.881 3.787 3.957 . 0 0 "[ . 1]" 1
863 1 27 LEU HA 1 28 GLN H 3.633 2.313 4.953 3.533 3.511 3.556 . 0 0 "[ . 1]" 1
864 1 28 GLN H 1 29 ILE HG13 4.168 2.431 5.905 4.007 3.853 4.213 . 0 0 "[ . 1]" 1
865 1 26 ILE HA 1 28 GLN H 3.908 2.381 5.435 4.006 3.889 4.204 . 0 0 "[ . 1]" 1
866 1 28 GLN H 1 28 GLN HB2 2.785 2.009 3.561 2.481 2.119 2.818 . 0 0 "[ . 1]" 1
867 1 28 GLN H 1 28 GLN QG 2.355 . 2.910 2.297 1.746 3.160 0.250 2 0 "[ . 1]" 1
868 1 28 GLN H 1 28 GLN HB3 3.126 2.149 4.103 3.563 3.429 3.604 . 0 0 "[ . 1]" 1
869 1 27 LEU HB2 1 28 GLN H 3.271 2.201 4.341 3.443 3.314 3.639 . 0 0 "[ . 1]" 1
870 1 27 LEU HB3 1 28 GLN H 2.907 2.062 3.752 2.724 2.530 2.850 . 0 0 "[ . 1]" 1
871 1 27 LEU QD 1 28 GLN H 3.251 2.194 4.308 3.780 3.447 3.918 . 0 0 "[ . 1]" 1
872 1 25 THR H 1 28 GLN H 3.912 2.382 5.442 3.890 3.631 4.073 . 0 0 "[ . 1]" 1
873 1 59 PHE H 1 62 ASP H 4.315 2.453 6.177 3.844 3.701 3.982 . 0 0 "[ . 1]" 1
874 1 59 PHE H 1 59 PHE QD 3.578 2.298 4.858 2.662 2.250 3.074 0.048 10 0 "[ . 1]" 1
875 1 59 PHE H 1 59 PHE HA 2.989 2.095 3.883 2.934 2.919 2.941 . 0 0 "[ . 1]" 1
876 1 58 LEU HA 1 59 PHE H 2.206 . 2.692 2.219 2.164 2.261 . 0 0 "[ . 1]" 1
877 1 59 PHE H 1 59 PHE HB2 2.645 . 3.345 2.452 2.301 2.750 . 0 0 "[ . 1]" 1
878 1 59 PHE H 1 60 LEU H 4.455 2.471 6.439 4.524 4.501 4.551 . 0 0 "[ . 1]" 1
879 1 49 LEU H 1 49 LEU HB2 2.742 . 3.494 3.191 2.887 3.337 . 0 0 "[ . 1]" 1
880 1 49 LEU H 1 54 LEU HB2 3.674 . 6.000 4.412 3.492 5.454 . 0 0 "[ . 1]" 1
881 1 49 LEU H 1 49 LEU HB3 3.250 2.194 4.306 2.541 2.135 2.651 0.059 6 0 "[ . 1]" 1
882 1 49 LEU H 1 52 LYS H 3.124 2.148 4.100 3.982 3.732 4.760 0.660 6 1 "[ .+ 1]" 1
883 1 48 LEU HA 1 49 LEU H 2.597 . 3.272 2.240 2.213 2.279 . 0 0 "[ . 1]" 1
884 1 49 LEU H 1 53 VAL HA 3.648 2.317 4.979 3.483 3.211 3.677 . 0 0 "[ . 1]" 1
885 1 48 LEU H 1 49 LEU H 4.611 2.485 6.737 4.407 4.106 4.481 . 0 0 "[ . 1]" 1
886 1 47 LEU HA 1 48 LEU H 2.502 . 3.128 2.118 2.071 2.158 . 0 0 "[ . 1]" 1
887 1 48 LEU H 1 72 ILE HA 4.332 2.455 6.209 4.940 4.502 5.438 . 0 0 "[ . 1]" 1
888 1 48 LEU H 1 74 VAL HA 4.044 2.409 5.679 3.711 3.529 3.943 . 0 0 "[ . 1]" 1
889 1 48 LEU H 1 73 THR HB 4.150 2.428 5.872 3.384 2.933 3.866 . 0 0 "[ . 1]" 1
890 1 48 LEU H 1 75 MET QG 4.678 2.489 6.867 4.646 3.393 5.413 . 0 0 "[ . 1]" 1
891 1 48 LEU H 1 48 LEU HB3 2.760 . 3.522 3.361 2.757 3.651 0.129 2 0 "[ . 1]" 1
892 1 51 GLY H 1 51 GLY HA2 4.068 2.413 5.723 2.320 2.293 2.341 0.120 3 0 "[ . 1]" 1
893 1 50 LYS HA 1 51 GLY H 2.907 2.062 3.752 2.508 2.428 2.606 . 0 0 "[ . 1]" 1
894 1 50 LYS H 1 52 LYS H 4.263 2.446 6.080 4.650 4.568 4.791 . 0 0 "[ . 1]" 1
895 1 52 LYS H 1 53 VAL H 4.536 2.478 6.594 4.553 4.501 4.640 . 0 0 "[ . 1]" 1
896 1 51 GLY H 1 52 LYS H 2.847 2.036 3.658 3.287 3.185 3.432 . 0 0 "[ . 1]" 1
897 1 48 LEU HA 1 52 LYS H 4.672 2.489 6.855 5.668 5.302 5.913 . 0 0 "[ . 1]" 1
898 1 49 LEU HA 1 52 LYS H 4.589 2.483 6.695 5.229 5.119 5.413 . 0 0 "[ . 1]" 1
899 1 52 LYS H 1 52 LYS HB3 2.437 . 3.031 2.620 2.423 2.842 . 0 0 "[ . 1]" 1
900 1 29 ILE H 1 29 ILE HG13 2.152 . 2.615 1.945 1.812 2.134 . 0 0 "[ . 1]" 1
901 1 29 ILE H 1 29 ILE HG12 4.026 2.405 5.647 3.209 3.134 3.302 . 0 0 "[ . 1]" 1
902 1 28 GLN HB2 1 29 ILE H 3.208 2.179 4.237 2.669 2.506 3.065 . 0 0 "[ . 1]" 1
903 1 29 ILE H 1 29 ILE MD 3.696 2.330 5.062 3.508 3.397 3.641 . 0 0 "[ . 1]" 1
904 1 20 PHE QE 1 29 ILE H 6.243 2.346 10.140 4.500 3.916 5.078 . 0 0 "[ . 1]" 1
905 1 4 LEU H 1 19 ASP H 5.167 2.497 7.837 4.825 4.701 5.024 . 0 0 "[ . 1]" 1
906 1 19 ASP H 1 19 ASP HA 3.403 2.245 4.561 2.936 2.925 2.945 . 0 0 "[ . 1]" 1
907 1 18 HIS HA 1 19 ASP H 2.685 . 3.406 2.324 2.232 2.435 . 0 0 "[ . 1]" 1
908 1 19 ASP H 1 19 ASP HB3 3.030 2.112 3.948 3.087 2.465 3.535 . 0 0 "[ . 1]" 1
909 1 20 PHE H 1 20 PHE HB3 3.689 2.328 5.050 3.723 3.600 3.816 . 0 0 "[ . 1]" 1
910 1 20 PHE H 1 20 PHE QD 4.050 2.409 5.691 3.079 2.710 3.422 . 0 0 "[ . 1]" 1
911 1 20 PHE H 1 21 SER H 4.837 2.498 7.176 4.459 4.429 4.482 . 0 0 "[ . 1]" 1
912 1 20 PHE QD 1 21 SER H 4.745 2.494 6.996 3.391 2.955 3.770 . 0 0 "[ . 1]" 1
913 1 22 PRO HA 1 23 SER H 3.393 2.242 4.544 3.468 3.422 3.526 . 0 0 "[ . 1]" 1
914 1 22 PRO HD2 1 23 SER H 2.520 . 3.155 2.971 2.689 3.253 0.098 7 0 "[ . 1]" 1
915 1 22 PRO HA 1 24 ASP H 3.661 2.321 5.001 3.743 3.544 3.902 . 0 0 "[ . 1]" 1
916 1 21 SER HB2 1 24 ASP H 3.371 2.235 4.507 3.576 2.860 4.835 0.328 4 0 "[ . 1]" 1
917 1 24 ASP H 1 24 ASP HB3 2.653 . 3.357 3.237 2.903 3.403 0.046 7 0 "[ . 1]" 1
918 1 24 ASP H 1 24 ASP HB2 2.842 2.034 3.650 2.185 2.124 2.413 . 0 0 "[ . 1]" 1
919 1 24 ASP H 1 60 LEU HB2 3.385 2.239 4.531 3.304 2.916 3.566 . 0 0 "[ . 1]" 1
920 1 24 ASP H 1 60 LEU QD 3.277 2.203 4.351 3.110 2.736 3.244 . 0 0 "[ . 1]" 1
921 1 25 THR H 1 25 THR HA 3.526 2.282 4.770 2.946 2.940 2.956 . 0 0 "[ . 1]" 1
922 1 24 ASP HA 1 25 THR H 2.767 2.001 3.533 2.387 2.278 2.493 . 0 0 "[ . 1]" 1
923 1 25 THR H 1 25 THR HB 4.537 2.478 6.596 3.201 2.717 3.639 . 0 0 "[ . 1]" 1
924 1 24 ASP HB3 1 25 THR H 3.829 2.363 5.295 2.783 2.539 3.051 . 0 0 "[ . 1]" 1
925 1 25 THR HA 1 26 ILE H 2.957 2.083 3.831 2.300 2.249 2.371 . 0 0 "[ . 1]" 1
926 1 26 ILE H 1 59 PHE HA 4.441 2.469 6.413 3.682 3.162 3.942 . 0 0 "[ . 1]" 1
927 1 25 THR HB 1 26 ILE H 2.828 2.028 3.628 3.125 2.504 3.765 0.137 5 0 "[ . 1]" 1
928 1 26 ILE H 1 26 ILE HB 2.984 2.093 3.875 2.589 2.460 2.669 . 0 0 "[ . 1]" 1
929 1 26 ILE H 1 26 ILE HG12 2.367 . 2.927 2.046 1.910 2.210 . 0 0 "[ . 1]" 1
930 1 26 ILE H 1 26 ILE HG13 4.257 2.444 6.070 3.575 3.480 3.650 . 0 0 "[ . 1]" 1
931 1 26 ILE H 1 58 LEU H 4.175 2.432 5.918 3.958 3.739 4.258 . 0 0 "[ . 1]" 1
932 1 29 ILE HG12 1 30 LYS H 5.824 2.432 9.216 4.805 4.761 4.843 . 0 0 "[ . 1]" 1
933 1 29 ILE MD 1 30 LYS H 4.688 2.490 6.886 4.322 4.120 4.495 . 0 0 "[ . 1]" 1
934 1 30 LYS H 1 30 LYS HA 3.228 2.186 4.270 2.768 2.755 2.798 . 0 0 "[ . 1]" 1
935 1 29 ILE HA 1 30 LYS H 3.824 2.361 5.287 3.534 3.520 3.546 . 0 0 "[ . 1]" 1
936 1 41 HIS H 1 41 HIS HB2 3.124 2.148 4.100 2.839 2.604 3.083 . 0 0 "[ . 1]" 1
937 1 41 HIS HB2 1 44 GLU H 3.385 2.239 4.531 3.834 3.069 4.797 0.266 6 0 "[ . 1]" 1
938 1 30 LYS H 1 30 LYS QB . 2.417 3.406 2.367 2.227 2.522 0.190 8 0 "[ . 1]" 1
939 1 31 GLN H 1 31 GLN HG2 2.098 . 2.538 2.486 2.273 3.361 0.823 5 1 "[ + 1]" 1
940 1 31 GLN H 1 31 GLN HB2 2.505 . 3.132 2.376 2.072 2.484 . 0 0 "[ . 1]" 1
941 1 32 HIS HA 1 33 LEU H 3.847 2.367 5.327 3.525 3.517 3.546 . 0 0 "[ . 1]" 1
942 1 32 HIS HB2 1 33 LEU H 3.197 2.175 4.219 3.823 3.524 3.958 . 0 0 "[ . 1]" 1
943 1 20 PHE QE 1 32 HIS H 4.940 2.500 7.380 5.687 5.311 6.106 . 0 0 "[ . 1]" 1
944 1 20 PHE HZ 1 32 HIS H 4.721 2.492 6.950 5.775 4.954 6.283 . 0 0 "[ . 1]" 1
945 1 34 ILE H 1 34 ILE HA 2.770 2.003 3.537 2.845 2.813 2.867 . 0 0 "[ . 1]" 1
946 1 63 LEU H 1 63 LEU HA 2.847 2.036 3.658 2.874 2.854 2.895 . 0 0 "[ . 1]" 1
947 1 62 ASP HA 1 63 LEU H 3.403 2.245 4.561 3.550 3.541 3.561 . 0 0 "[ . 1]" 1
948 1 62 ASP QB 1 63 LEU H 3.005 2.429 3.908 2.489 2.366 2.597 0.063 1 0 "[ . 1]" 1
949 1 34 ILE H 1 34 ILE HB 2.444 . 3.041 2.658 2.491 2.777 . 0 0 "[ . 1]" 1
950 1 34 ILE H 1 34 ILE HG12 3.336 2.223 4.449 3.252 3.031 3.450 . 0 0 "[ . 1]" 1
951 1 34 ILE H 1 35 SER H 2.467 . 3.076 2.557 2.481 2.669 . 0 0 "[ . 1]" 1
952 1 35 SER H 1 36 GLU H 2.709 . 3.443 2.639 2.580 2.709 . 0 0 "[ . 1]" 1
953 1 35 SER H 1 35 SER HA 2.744 . 3.497 2.819 2.796 2.837 . 0 0 "[ . 1]" 1
954 1 35 SER H 1 35 SER HB2 2.333 . 2.877 2.474 2.153 2.660 . 0 0 "[ . 1]" 1
955 1 36 GLU H 1 37 GLU H 2.669 . 3.381 2.450 2.329 2.526 . 0 0 "[ . 1]" 1
956 1 36 GLU H 1 36 GLU HB3 3.658 2.320 4.996 3.565 2.929 3.707 . 0 0 "[ . 1]" 1
957 1 34 ILE HB 1 36 GLU H 4.285 2.449 6.121 4.838 4.714 4.933 . 0 0 "[ . 1]" 1
958 1 36 GLU H 1 36 GLU QG 2.493 . 3.114 2.825 2.332 3.966 0.852 6 1 "[ .+ 1]" 1
959 1 36 GLU H 1 36 GLU HB2 2.543 . 3.190 2.447 2.285 2.653 . 0 0 "[ . 1]" 1
960 1 40 SER H 1 41 HIS HA 3.331 . 6.000 4.835 4.725 5.008 . 0 0 "[ . 1]" 1
961 1 39 ALA HA 1 40 SER H 2.846 2.036 3.656 2.318 2.238 2.437 . 0 0 "[ . 1]" 1
962 1 40 SER H 1 40 SER HB3 3.016 2.106 3.926 3.553 2.710 3.728 . 0 0 "[ . 1]" 1
963 1 40 SER H 1 40 SER HB2 3.326 2.220 4.432 2.786 2.590 3.011 . 0 0 "[ . 1]" 1
964 1 40 SER H 1 45 ILE HG12 4.964 2.499 7.429 4.636 4.076 4.963 . 0 0 "[ . 1]" 1
965 1 40 SER H 1 41 HIS H 2.899 2.059 3.739 2.316 2.069 2.557 . 0 0 "[ . 1]" 1
966 1 41 HIS HA 1 43 SER H 3.558 2.292 4.824 4.118 3.958 4.263 . 0 0 "[ . 1]" 1
967 1 43 SER H 1 43 SER HB2 3.395 2.243 4.547 2.861 2.317 3.494 . 0 0 "[ . 1]" 1
968 1 41 HIS HB2 1 43 SER H 4.006 2.402 5.610 4.508 3.339 5.037 . 0 0 "[ . 1]" 1
969 1 42 ILE HB 1 43 SER H 4.220 2.439 6.001 3.905 3.792 4.087 . 0 0 "[ . 1]" 1
970 1 42 ILE QG 1 43 SER H 3.789 2.481 5.225 3.221 2.129 3.717 0.352 1 0 "[ . 1]" 1
971 1 42 ILE MG 1 43 SER H 2.896 2.058 3.734 2.108 1.735 3.839 0.323 8 0 "[ . 1]" 1
972 1 4 LEU H 1 18 HIS H 3.188 2.172 4.204 3.215 2.810 3.471 . 0 0 "[ . 1]" 1
973 1 61 SER H 1 62 ASP H 2.655 . 3.360 2.484 2.434 2.529 . 0 0 "[ . 1]" 1
974 1 43 SER H 1 44 GLU H 3.327 2.220 4.434 2.913 2.809 3.080 . 0 0 "[ . 1]" 1
975 1 44 GLU H 1 44 GLU QG . 2.449 3.551 2.083 1.719 3.514 0.730 7 7 "[- **.*+ **]" 1
976 1 44 GLU H 1 44 GLU QB 2.889 2.054 3.724 2.821 2.419 3.064 . 0 0 "[ . 1]" 1
977 1 45 ILE HA 1 46 LYS H 2.296 . 2.823 2.143 2.116 2.188 . 0 0 "[ . 1]" 1
978 1 46 LYS H 1 47 LEU H 4.277 2.448 6.106 4.206 4.168 4.232 . 0 0 "[ . 1]" 1
979 1 46 LYS H 1 76 ILE HA 3.911 2.381 5.441 3.574 3.379 3.909 . 0 0 "[ . 1]" 1
980 1 46 LYS H 1 75 MET HB2 4.005 2.401 5.609 3.274 2.783 3.575 . 0 0 "[ . 1]" 1
981 1 47 LEU H 1 47 LEU HB3 2.670 . 3.383 3.591 3.422 3.693 0.310 5 0 "[ . 1]" 1
982 1 47 LEU H 1 47 LEU QD 2.195 . 2.677 2.353 2.040 3.286 0.609 5 1 "[ + 1]" 1
983 1 49 LEU H 1 50 LYS H 4.097 2.418 5.776 3.868 3.658 4.207 . 0 0 "[ . 1]" 1
984 1 39 ALA H 1 39 ALA MB 2.215 . 2.706 2.557 2.408 2.644 . 0 0 "[ . 1]" 1
985 1 66 THR H 1 66 THR MG 2.635 . 3.329 3.202 2.633 3.653 0.324 5 0 "[ . 1]" 1
986 1 74 VAL HA 1 75 MET H 2.382 . 2.950 2.106 2.068 2.134 . 0 0 "[ . 1]" 1
987 1 71 THR H 1 71 THR HB 2.668 . 3.380 2.840 2.678 3.386 0.006 6 0 "[ . 1]" 1
988 1 71 THR H 1 71 THR MG 3.625 2.311 4.939 3.829 3.610 3.920 . 0 0 "[ . 1]" 1
989 1 55 HIS HB3 1 57 ASN H 2.787 2.010 3.564 3.051 2.844 3.224 . 0 0 "[ . 1]" 1
990 1 57 ASN H 1 57 ASN HB3 2.849 2.037 3.661 2.847 2.551 3.629 . 0 0 "[ . 1]" 1
991 1 57 ASN H 1 57 ASN HB2 2.562 . 3.218 2.570 2.364 3.615 0.397 2 0 "[ . 1]" 1
992 1 69 ASN H 1 69 ASN QD 5.692 2.470 8.622 4.080 3.436 4.815 . 0 0 "[ . 1]" 1
993 1 68 ALA H 1 69 ASN H 2.603 . 3.281 2.496 2.275 2.723 . 0 0 "[ . 1]" 1
994 1 68 ALA MB 1 69 ASN H 2.759 . 3.520 3.353 3.231 3.494 . 0 0 "[ . 1]" 1
995 1 59 PHE HB2 1 62 ASP H 3.119 2.146 4.092 2.873 2.565 3.091 . 0 0 "[ . 1]" 1
996 1 62 ASP H 1 62 ASP QB 2.532 . 3.173 2.300 2.212 2.345 . 0 0 "[ . 1]" 1
997 1 62 ASP H 1 63 LEU HG 3.473 2.267 4.679 3.748 3.566 4.063 . 0 0 "[ . 1]" 1
998 1 58 LEU HG 1 62 ASP H 4.107 2.420 5.794 4.722 4.297 5.500 . 0 0 "[ . 1]" 1
999 1 62 ASP H 1 63 LEU QD 3.918 2.383 5.453 3.939 3.716 4.156 . 0 0 "[ . 1]" 1
1000 1 62 ASP H 1 62 ASP HA 2.856 2.040 3.672 2.890 2.868 2.917 . 0 0 "[ . 1]" 1
1001 1 61 SER HA 1 62 ASP H 3.346 2.227 4.465 3.419 3.367 3.505 . 0 0 "[ . 1]" 1
1002 1 60 LEU HA 1 62 ASP H 3.389 2.241 4.537 3.940 3.735 4.200 . 0 0 "[ . 1]" 1
1003 1 59 PHE HB3 1 61 SER H 3.136 2.152 4.120 2.748 2.534 3.227 . 0 0 "[ . 1]" 1
1004 1 60 LEU HB2 1 61 SER H 2.807 2.019 3.595 2.791 2.687 2.959 . 0 0 "[ . 1]" 1
1005 1 61 SER H 1 63 LEU HG 4.634 2.487 6.781 4.652 4.392 4.963 . 0 0 "[ . 1]" 1
1006 1 60 LEU QD 1 61 SER H 4.750 2.494 7.006 4.169 4.127 4.233 . 0 0 "[ . 1]" 1
1007 1 61 SER H 1 61 SER HA 2.833 2.030 3.636 2.859 2.844 2.874 . 0 0 "[ . 1]" 1
1008 1 61 SER H 1 61 SER HB2 2.880 2.050 3.710 3.406 3.223 3.509 . 0 0 "[ . 1]" 1
1009 1 61 SER H 1 61 SER HB3 3.163 2.163 4.163 3.086 2.914 3.316 . 0 0 "[ . 1]" 1
1010 1 59 PHE HB2 1 61 SER H 3.534 2.285 4.783 3.646 3.269 3.954 . 0 0 "[ . 1]" 1
1011 1 60 LEU HG 1 61 SER H 4.471 2.472 6.470 4.498 4.379 4.680 . 0 0 "[ . 1]" 1
1012 1 60 LEU HB3 1 61 SER H 4.136 2.426 5.846 3.705 3.522 3.896 . 0 0 "[ . 1]" 1
1013 1 61 SER H 1 63 LEU H 4.279 2.448 6.110 4.330 4.239 4.402 . 0 0 "[ . 1]" 1
1014 1 59 PHE QD 1 61 SER H 5.245 2.494 7.996 4.481 3.977 4.999 . 0 0 "[ . 1]" 1
1015 1 60 LEU H 1 61 SER H 2.804 2.018 3.590 2.785 2.706 2.904 . 0 0 "[ . 1]" 1
1016 1 27 LEU H 1 27 LEU HA 2.869 2.046 3.692 2.770 2.742 2.787 . 0 0 "[ . 1]" 1
1017 1 26 ILE HA 1 27 LEU H 3.432 2.254 4.610 3.433 3.404 3.475 . 0 0 "[ . 1]" 1
1018 1 26 ILE HB 1 27 LEU H 2.853 2.039 3.667 2.986 2.875 3.059 . 0 0 "[ . 1]" 1
1019 1 27 LEU H 1 27 LEU HB2 2.418 . 3.003 2.080 2.029 2.210 . 0 0 "[ . 1]" 1
1020 1 27 LEU H 1 27 LEU HB3 2.694 . 3.420 3.015 2.750 3.129 . 0 0 "[ . 1]" 1
1021 1 41 HIS HA 1 42 ILE H 2.353 . 2.907 2.221 2.124 2.280 . 0 0 "[ . 1]" 1
1022 1 42 ILE H 1 42 ILE HA 3.738 2.341 5.135 2.816 2.783 2.839 . 0 0 "[ . 1]" 1
1023 1 41 HIS HB2 1 42 ILE H 4.141 2.426 5.856 4.213 3.634 4.472 . 0 0 "[ . 1]" 1
1024 1 42 ILE H 1 42 ILE MG 2.764 . 3.528 1.903 1.616 2.193 0.384 3 0 "[ . 1]" 1
1025 1 75 MET H 1 75 MET HB2 3.162 2.162 4.162 2.626 2.504 2.790 . 0 0 "[ . 1]" 1
1026 1 75 MET H 1 75 MET HB3 2.832 2.030 3.634 3.744 3.661 3.862 0.228 2 0 "[ . 1]" 1
1027 1 15 SER H 1 15 SER HA 3.464 2.264 4.664 2.905 2.892 2.926 . 0 0 "[ . 1]" 1
1028 1 14 PHE HA 1 15 SER H 2.901 2.059 3.743 2.409 2.311 2.535 . 0 0 "[ . 1]" 1
1029 1 15 SER H 1 15 SER HB3 4.189 2.434 5.944 3.918 3.897 3.948 . 0 0 "[ . 1]" 1
1030 1 15 SER H 1 15 SER HB2 3.383 2.238 4.528 2.896 2.855 2.962 . 0 0 "[ . 1]" 1
1031 1 14 PHE HB3 1 15 SER H 2.919 2.067 3.771 3.777 3.621 3.888 0.117 5 0 "[ . 1]" 1
1032 1 14 PHE HB2 1 15 SER H 4.706 2.492 6.920 2.426 2.317 2.563 0.175 3 0 "[ . 1]" 1
1033 1 7 LYS QD 1 15 SER H 4.967 2.500 7.434 7.258 5.916 7.852 0.418 8 0 "[ . 1]" 1
1034 1 15 SER H 1 16 ILE MG 3.357 2.230 4.484 3.324 3.128 3.654 . 0 0 "[ . 1]" 1
1035 1 14 PHE H 1 15 SER H 4.496 2.474 6.518 4.321 4.288 4.337 . 0 0 "[ . 1]" 1
1036 1 14 PHE QD 1 15 SER H 4.704 2.491 6.917 3.198 2.941 3.509 . 0 0 "[ . 1]" 1
1037 1 15 SER H 1 16 ILE H 4.589 2.483 6.695 3.881 3.710 4.196 . 0 0 "[ . 1]" 1
1038 1 48 LEU HA 1 54 LEU H 3.275 2.202 4.348 3.143 2.679 3.665 . 0 0 "[ . 1]" 1
1039 1 53 VAL HA 1 54 LEU H 2.503 . 3.129 2.163 2.129 2.187 . 0 0 "[ . 1]" 1
1040 1 53 VAL HB 1 54 LEU H 4.242 2.443 6.041 3.969 2.949 4.134 . 0 0 "[ . 1]" 1
1041 1 54 LEU H 1 54 LEU HB2 2.514 . 3.146 2.295 2.203 2.399 . 0 0 "[ . 1]" 1
1042 1 54 LEU H 1 54 LEU QD 2.404 . 2.982 2.897 2.438 3.410 0.428 2 0 "[ . 1]" 1
1043 1 26 ILE MD 1 54 LEU H 6.127 2.374 9.880 6.283 6.078 6.436 . 0 0 "[ . 1]" 1
1044 1 62 ASP H 1 63 LEU H 2.243 . 2.746 2.428 2.321 2.535 . 0 0 "[ . 1]" 1
1045 1 9 ILE H 1 10 GLN H 2.205 . 2.691 2.585 2.388 2.777 0.086 10 0 "[ . 1]" 1
1046 1 8 LYS HA 1 10 GLN H 3.486 2.271 4.701 4.146 3.675 4.441 . 0 0 "[ . 1]" 1
1047 1 10 GLN H 1 10 GLN HA 2.474 . 3.086 2.821 2.790 2.891 . 0 0 "[ . 1]" 1
1048 1 10 GLN H 1 10 GLN HG2 3.350 2.228 4.472 3.641 2.925 4.061 . 0 0 "[ . 1]" 1
1049 1 10 GLN H 1 10 GLN HG3 2.533 . 3.174 2.395 1.794 3.088 0.098 8 0 "[ . 1]" 1
1050 1 8 LYS QG 1 10 GLN H 2.201 . 2.686 3.156 2.605 3.501 0.815 10 6 "[ **.*-* +]" 1
1051 1 9 ILE QG 1 10 GLN H 3.726 2.337 5.115 3.941 3.629 4.429 . 0 0 "[ . 1]" 1
1052 1 63 LEU H 1 63 LEU HG 1.828 . 2.162 2.029 1.864 2.242 0.080 7 0 "[ . 1]" 1
1053 1 49 LEU HA 1 50 LYS H 2.564 . 3.222 2.161 2.099 2.217 . 0 0 "[ . 1]" 1
1054 1 50 LYS H 1 50 LYS HA 2.454 . 3.056 2.285 2.261 2.303 . 0 0 "[ . 1]" 1
1055 1 49 LEU HB3 1 50 LYS H 4.812 2.496 7.128 4.480 4.442 4.517 . 0 0 "[ . 1]" 1
1056 1 50 LYS H 1 51 GLY H 3.688 2.328 5.048 3.111 2.853 3.356 . 0 0 "[ . 1]" 1
1057 1 2 VAL H 1 20 PHE HA 3.870 . 6.000 4.884 4.657 5.170 . 0 0 "[ . 1]" 1
1058 1 1 MET HA 1 2 VAL H 2.762 . 3.525 2.573 2.152 3.531 0.006 2 0 "[ . 1]" 1
1059 1 73 THR HA 1 74 VAL H 2.372 . 2.935 2.131 2.109 2.143 . 0 0 "[ . 1]" 1
1060 1 74 VAL H 1 74 VAL HB 2.667 . 3.379 2.669 2.568 2.825 . 0 0 "[ . 1]" 1
1061 1 64 LYS HA 1 65 VAL H 2.047 . 2.466 2.200 2.169 2.228 . 0 0 "[ . 1]" 1
1062 1 65 VAL H 1 65 VAL HB 2.279 . 2.798 2.694 2.619 2.886 0.088 5 0 "[ . 1]" 1
1063 1 65 VAL H 1 65 VAL QG 1.760 . 2.070 1.912 1.790 2.016 . 0 0 "[ . 1]" 1
1064 1 79 ASN H 1 80 LEU H 2.638 . 6.000 2.664 2.174 4.245 . 0 0 "[ . 1]" 1
1065 1 79 ASN HA 1 80 LEU H 1.626 . 6.000 3.107 2.177 3.485 . 0 0 "[ . 1]" 1
1066 1 80 LEU H 1 80 LEU HA 2.197 . 2.680 2.889 2.848 2.930 0.250 6 0 "[ . 1]" 1
1067 1 78 PRO QB 1 80 LEU H 3.738 2.341 4.424 3.274 2.701 4.552 0.128 2 0 "[ . 1]" 1
1068 1 80 LEU H 1 80 LEU HG 1.749 . 2.055 2.431 1.902 2.890 0.835 6 3 "[* -+ 1]" 1
1069 1 63 LEU H 1 64 LYS H 2.410 . 2.991 2.413 2.333 2.476 . 0 0 "[ . 1]" 1
1070 1 3 HIS H 1 3 HIS HB3 3.363 2.232 4.494 3.260 2.552 3.660 . 0 0 "[ . 1]" 1
1071 1 73 THR HB 1 74 VAL H 4.359 2.459 6.259 3.777 3.485 4.128 . 0 0 "[ . 1]" 1
1072 1 74 VAL H 1 74 VAL MG2 2.154 . 2.618 2.187 2.106 2.269 . 0 0 "[ . 1]" 1
1073 1 53 VAL H 1 53 VAL HB 2.546 . 3.194 2.745 2.535 3.631 0.437 1 0 "[ . 1]" 1
1074 1 52 LYS HG2 1 53 VAL H 2.979 2.092 3.866 3.432 2.764 4.443 0.577 1 1 "[+ . 1]" 1
1075 1 52 LYS HG3 1 53 VAL H 2.900 2.059 3.741 3.190 2.478 3.659 . 0 0 "[ . 1]" 1
1076 1 53 VAL H 1 53 VAL QG 2.907 2.062 3.752 2.008 1.745 2.202 0.317 1 0 "[ . 1]" 1
1077 1 52 LYS HA 1 53 VAL H 2.595 . 3.268 2.182 2.142 2.226 . 0 0 "[ . 1]" 1
1078 1 53 VAL H 1 53 VAL HA 2.891 2.055 3.727 2.878 2.821 2.919 . 0 0 "[ . 1]" 1
1079 1 10 GLN HA 1 11 ALA H 1.789 . 6.000 2.361 2.264 2.442 . 0 0 "[ . 1]" 1
1080 1 11 ALA H 1 13 LYS QE 3.608 2.306 4.910 6.008 3.955 6.696 1.786 1 9 "[+ **-*****]" 1
1081 1 10 GLN HB3 1 11 ALA H 2.457 . 3.061 2.544 2.399 2.757 . 0 0 "[ . 1]" 1
1082 1 80 LEU HA 1 81 GLU H 1.778 . 6.000 2.336 2.126 3.440 . 0 0 "[ . 1]" 1
1083 1 81 GLU H 1 81 GLU HB2 2.403 . 6.000 3.249 2.423 3.939 . 0 0 "[ . 1]" 1
1084 1 80 LEU MD2 1 81 GLU H 3.211 2.180 4.242 3.761 3.310 4.669 0.427 5 0 "[ . 1]" 1
1085 1 8 LYS HB3 1 10 GLN H 4.156 2.428 5.884 5.456 4.637 5.860 . 0 0 "[ . 1]" 1
1086 1 33 LEU HA 1 34 ILE H 3.687 2.327 5.047 3.537 3.523 3.559 . 0 0 "[ . 1]" 1
1087 1 33 LEU HB2 1 34 ILE H 2.785 2.009 3.561 2.587 2.482 2.696 . 0 0 "[ . 1]" 1
1088 1 8 LYS QD 1 10 GLN H 3.689 2.328 5.050 4.080 3.606 4.795 . 0 0 "[ . 1]" 1
1089 1 69 ASN H 1 69 ASN HA 2.699 . 3.427 2.935 2.919 2.947 . 0 0 "[ . 1]" 1
1090 1 66 THR HA 1 69 ASN H 4.465 2.471 6.459 4.752 4.521 4.862 . 0 0 "[ . 1]" 1
1091 1 69 ASN H 1 70 SER QB 3.968 2.393 5.543 4.210 3.947 4.382 . 0 0 "[ . 1]" 1
1092 1 67 PRO HD2 1 69 ASN H 4.918 2.499 7.337 4.814 4.556 4.919 . 0 0 "[ . 1]" 1
1093 1 69 ASN H 1 69 ASN HB2 2.532 . 3.173 2.683 2.479 3.235 0.062 2 0 "[ . 1]" 1
1094 1 69 ASN H 1 69 ASN HB3 3.015 2.106 3.924 3.534 2.855 3.739 . 0 0 "[ . 1]" 1
1095 1 63 LEU H 1 63 LEU HB3 2.763 . 3.526 2.770 2.698 2.926 . 0 0 "[ . 1]" 1
1096 1 20 PHE HA 1 21 SER H 2.616 . 3.301 2.443 2.274 2.500 . 0 0 "[ . 1]" 1
1097 1 44 GLU H 1 45 ILE HA 4.848 2.498 7.198 4.831 4.666 4.994 . 0 0 "[ . 1]" 1
1098 1 43 SER HB2 1 44 GLU H 4.166 2.430 5.902 3.288 2.570 4.105 . 0 0 "[ . 1]" 1
1099 1 21 SER H 1 21 SER HB2 2.843 2.035 3.651 2.761 2.482 3.126 . 0 0 "[ . 1]" 1
1100 1 40 SER HB3 1 41 HIS H 3.080 2.131 4.029 3.707 2.112 4.251 0.222 9 0 "[ . 1]" 1
1101 1 40 SER HB2 1 41 HIS H 3.635 2.314 4.956 2.690 2.166 3.456 0.148 1 0 "[ . 1]" 1
1102 1 20 PHE HB3 1 21 SER H 2.996 2.098 3.894 2.326 2.195 2.747 . 0 0 "[ . 1]" 1
1103 1 21 SER H 1 24 ASP HB3 4.199 2.436 5.962 3.808 3.545 4.062 . 0 0 "[ . 1]" 1
1104 1 21 SER H 1 24 ASP HB2 3.450 2.260 4.640 2.632 2.343 2.894 . 0 0 "[ . 1]" 1
1105 1 20 PHE HB2 1 21 SER H 3.663 2.321 5.005 3.614 3.468 4.001 . 0 0 "[ . 1]" 1
1106 1 41 HIS H 1 44 GLU QB 3.394 2.242 4.546 4.028 2.866 5.344 0.798 9 1 "[ . +1]" 1
1107 1 21 SER H 1 60 LEU QD 3.728 2.338 5.118 3.665 3.542 3.911 . 0 0 "[ . 1]" 1
1108 1 34 ILE MD 1 41 HIS H 3.726 2.338 5.114 4.385 3.813 4.774 . 0 0 "[ . 1]" 1
1109 1 4 LEU HA 1 5 THR H 2.520 . 3.155 2.158 2.124 2.203 . 0 0 "[ . 1]" 1
1110 1 5 THR H 1 5 THR HB 3.081 2.132 4.030 2.660 2.592 2.769 . 0 0 "[ . 1]" 1
1111 1 4 LEU H 1 4 LEU HB3 3.356 2.230 4.482 3.702 3.597 3.811 . 0 0 "[ . 1]" 1
1112 1 4 LEU H 1 4 LEU MD2 4.091 2.417 5.765 4.354 2.724 4.606 . 0 0 "[ . 1]" 1
1113 1 5 THR H 1 72 ILE H 3.804 2.357 5.251 3.556 3.398 3.700 . 0 0 "[ . 1]" 1
1114 1 5 THR H 1 17 GLU HA 5.503 2.475 8.531 4.856 4.694 5.007 . 0 0 "[ . 1]" 1
1115 1 5 THR H 1 6 LEU H 4.571 2.482 6.660 4.316 4.272 4.350 . 0 0 "[ . 1]" 1
1116 1 9 ILE H 1 74 VAL H 3.962 2.393 5.531 3.716 3.506 4.103 . 0 0 "[ . 1]" 1
1117 1 8 LYS HA 1 9 ILE H 2.243 . 2.746 2.123 2.102 2.167 . 0 0 "[ . 1]" 1
1118 1 9 ILE H 1 9 ILE HB 2.687 . 3.409 2.499 2.292 2.647 . 0 0 "[ . 1]" 1
1119 1 9 ILE H 1 10 GLN HG3 4.200 2.436 5.964 4.627 3.984 5.620 . 0 0 "[ . 1]" 1
1120 1 8 LYS HB2 1 9 ILE H 4.616 2.486 6.746 4.294 4.226 4.419 . 0 0 "[ . 1]" 1
1121 1 10 GLN H 1 11 ALA H 3.800 2.356 5.244 4.628 4.594 4.657 . 0 0 "[ . 1]" 1
1122 1 14 PHE H 1 15 SER HA 4.447 2.470 6.424 4.712 4.644 4.780 . 0 0 "[ . 1]" 1
1123 1 16 ILE HB 1 17 GLU H 2.427 . 3.016 2.579 2.383 2.762 . 0 0 "[ . 1]" 1
1124 1 16 ILE HG13 1 17 GLU H 4.253 2.444 6.062 4.023 3.632 4.298 . 0 0 "[ . 1]" 1
1125 1 16 ILE HG12 1 17 GLU H 3.805 2.357 5.253 4.906 4.722 5.063 . 0 0 "[ . 1]" 1
1126 1 5 THR MG 1 17 GLU H 4.472 2.472 6.472 4.476 4.296 4.671 . 0 0 "[ . 1]" 1
1127 1 16 ILE MD 1 17 GLU H 4.395 2.463 6.327 4.435 4.041 4.639 . 0 0 "[ . 1]" 1
1128 1 17 GLU H 1 17 GLU HG2 3.804 2.357 5.251 4.044 3.633 4.364 . 0 0 "[ . 1]" 1
1129 1 17 GLU H 1 17 GLU HG3 2.708 . 3.441 2.993 2.422 3.454 0.013 2 0 "[ . 1]" 1
1130 1 17 GLU H 1 17 GLU HA 2.908 2.062 3.754 2.945 2.939 2.952 . 0 0 "[ . 1]" 1
1131 1 16 ILE HA 1 17 GLU H 2.212 . 2.701 2.321 2.249 2.440 . 0 0 "[ . 1]" 1
1132 1 16 ILE H 1 17 GLU H 4.118 2.423 5.813 4.455 4.411 4.493 . 0 0 "[ . 1]" 1
1133 1 18 HIS HB2 1 19 ASP H 3.627 2.312 4.942 3.980 3.683 4.160 . 0 0 "[ . 1]" 1
1134 1 19 ASP HA 1 20 PHE H 2.684 . 3.404 2.157 2.126 2.192 . 0 0 "[ . 1]" 1
1135 1 2 VAL QG 1 20 PHE H 3.677 2.325 5.029 3.785 2.905 4.122 . 0 0 "[ . 1]" 1
1136 1 20 PHE H 1 60 LEU QD 4.133 2.425 5.841 3.987 3.788 4.285 . 0 0 "[ . 1]" 1
1137 1 23 SER H 1 24 ASP HB3 4.954 2.499 7.409 5.535 5.296 5.896 . 0 0 "[ . 1]" 1
1138 1 23 SER H 1 24 ASP HB2 4.840 2.498 7.182 4.064 3.882 4.366 . 0 0 "[ . 1]" 1
1139 1 22 PRO HB2 1 23 SER H 3.654 2.319 4.989 3.396 2.712 3.623 . 0 0 "[ . 1]" 1
1140 1 24 ASP H 1 61 SER H 4.758 2.494 7.022 4.736 4.370 4.960 . 0 0 "[ . 1]" 1
1141 1 24 ASP H 1 25 THR H 4.608 2.485 6.731 4.577 4.524 4.600 . 0 0 "[ . 1]" 1
1142 1 24 ASP H 1 59 PHE QD 5.217 2.495 7.939 4.426 4.031 5.729 . 0 0 "[ . 1]" 1
1143 1 27 LEU H 1 27 LEU QD 3.406 2.246 4.566 3.264 3.113 3.584 . 0 0 "[ . 1]" 1
1144 1 26 ILE MD 1 27 LEU H 4.168 2.431 5.905 4.537 4.423 4.673 . 0 0 "[ . 1]" 1
1145 1 25 THR HA 1 27 LEU H 4.464 2.471 6.457 3.915 3.841 4.040 . 0 0 "[ . 1]" 1
1146 1 25 THR HB 1 27 LEU H 2.919 2.067 3.771 2.411 2.039 3.111 0.028 10 0 "[ . 1]" 1
1147 1 27 LEU H 1 58 LEU H 4.347 2.457 6.237 4.871 4.569 5.154 . 0 0 "[ . 1]" 1
1148 1 27 LEU H 1 28 GLN H 2.781 2.008 3.554 2.758 2.697 2.814 . 0 0 "[ . 1]" 1
1149 1 28 GLN H 1 28 GLN QE 3.948 2.390 5.506 3.402 2.584 4.300 . 0 0 "[ . 1]" 1
1150 1 24 ASP HB3 1 28 GLN H 5.082 2.499 7.665 5.481 5.078 5.835 . 0 0 "[ . 1]" 1
1151 1 28 GLN H 1 29 ILE HG12 6.117 2.375 9.859 5.538 5.431 5.678 . 0 0 "[ . 1]" 1
1152 1 30 LYS QB 1 31 GLN H 2.666 . 3.377 2.482 2.382 2.541 . 0 0 "[ . 1]" 1
1153 1 28 GLN HA 1 31 GLN H 3.194 2.174 4.214 3.553 3.470 3.698 . 0 0 "[ . 1]" 1
1154 1 29 ILE HA 1 31 GLN H 3.837 2.365 5.309 4.501 4.345 4.684 . 0 0 "[ . 1]" 1
1155 1 31 GLN H 1 32 HIS HB2 5.155 2.498 7.812 4.872 4.395 5.136 . 0 0 "[ . 1]" 1
1156 1 30 LYS H 1 31 GLN H 2.735 . 3.483 2.836 2.718 2.879 . 0 0 "[ . 1]" 1
1157 1 31 GLN H 1 32 HIS H 2.646 . 3.346 2.632 2.435 2.739 . 0 0 "[ . 1]" 1
1158 1 32 HIS H 1 33 LEU H 2.692 . 3.417 2.612 2.550 2.661 . 0 0 "[ . 1]" 1
1159 1 32 HIS H 1 32 HIS HA 2.774 2.005 3.543 2.826 2.812 2.842 . 0 0 "[ . 1]" 1
1160 1 32 HIS H 1 32 HIS HB3 2.814 2.022 3.606 2.657 2.522 2.902 . 0 0 "[ . 1]" 1
1161 1 32 HIS H 1 32 HIS HB2 2.617 . 3.302 2.437 2.210 2.576 . 0 0 "[ . 1]" 1
1162 1 31 GLN HG2 1 32 HIS H 4.217 2.438 5.996 4.519 4.365 5.007 . 0 0 "[ . 1]" 1
1163 1 31 GLN HB3 1 32 HIS H 3.508 2.278 4.738 3.597 3.201 3.767 . 0 0 "[ . 1]" 1
1164 1 31 GLN HB2 1 32 HIS H 2.724 . 3.466 2.793 2.673 3.152 . 0 0 "[ . 1]" 1
1165 1 29 ILE MG 1 32 HIS H 3.769 2.349 5.189 4.561 4.494 4.642 . 0 0 "[ . 1]" 1
1166 1 33 LEU H 1 33 LEU HB2 2.741 . 3.492 2.608 2.360 2.759 . 0 0 "[ . 1]" 1
1167 1 33 LEU H 1 33 LEU HG 2.449 . 3.049 2.081 1.829 2.524 0.020 7 0 "[ . 1]" 1
1168 1 29 ILE MG 1 33 LEU H 3.420 2.250 4.590 4.084 3.846 4.209 . 0 0 "[ . 1]" 1
1169 1 31 GLN H 1 33 LEU H 4.292 2.450 6.134 4.161 4.087 4.210 . 0 0 "[ . 1]" 1
1170 1 33 LEU H 1 35 SER H 4.223 2.440 6.006 4.044 3.894 4.186 . 0 0 "[ . 1]" 1
1171 1 34 ILE HB 1 35 SER H 2.515 . 3.148 2.649 2.495 2.820 . 0 0 "[ . 1]" 1
1172 1 35 SER H 1 36 GLU QG 4.115 2.422 5.808 4.512 3.965 6.246 0.438 6 0 "[ . 1]" 1
1173 1 34 ILE MG 1 35 SER H 2.912 2.064 3.760 3.662 3.447 3.884 0.124 3 0 "[ . 1]" 1
1174 1 34 ILE MD 1 35 SER H 4.163 2.430 5.896 4.453 4.273 4.707 . 0 0 "[ . 1]" 1
1175 1 33 LEU HA 1 35 SER H 3.950 2.390 5.510 4.423 4.213 4.604 . 0 0 "[ . 1]" 1
1176 1 33 LEU HA 1 36 GLU H 3.375 2.236 4.514 3.560 3.424 3.734 . 0 0 "[ . 1]" 1
1177 1 34 ILE MG 1 36 GLU H 3.475 2.267 4.683 4.788 4.688 4.876 0.193 5 0 "[ . 1]" 1
1178 1 35 SER H 1 37 GLU H 4.187 2.434 5.940 4.099 3.942 4.287 . 0 0 "[ . 1]" 1
1179 1 34 ILE MD 1 39 ALA H 3.996 . 6.000 5.636 5.310 5.798 . 0 0 "[ . 1]" 1
1180 1 39 ALA H 1 39 ALA HA 2.518 . 3.152 2.933 2.923 2.942 . 0 0 "[ . 1]" 1
1181 1 38 LYS HA 1 39 ALA H 3.149 2.157 4.141 3.335 3.291 3.429 . 0 0 "[ . 1]" 1
1182 1 39 ALA H 1 40 SER H 3.917 2.383 5.451 4.403 4.323 4.476 . 0 0 "[ . 1]" 1
1183 1 38 LYS H 1 39 ALA H 2.104 . 2.547 2.077 2.000 2.138 . 0 0 "[ . 1]" 1
1184 1 44 GLU H 1 45 ILE H 2.812 2.021 3.603 2.483 2.280 2.771 . 0 0 "[ . 1]" 1
1185 1 45 ILE H 1 46 LYS H 4.499 2.475 6.523 4.404 4.354 4.458 . 0 0 "[ . 1]" 1
1186 1 42 ILE HA 1 45 ILE H 3.952 2.390 5.514 3.580 3.260 3.845 . 0 0 "[ . 1]" 1
1187 1 44 GLU HA 1 45 ILE H 3.489 2.271 4.707 3.169 3.090 3.305 . 0 0 "[ . 1]" 1
1188 1 44 GLU QB 1 45 ILE H 4.635 2.487 6.783 3.691 3.459 3.925 . 0 0 "[ . 1]" 1
1189 1 45 ILE H 1 45 ILE HB 2.655 . 3.360 2.599 2.554 2.691 . 0 0 "[ . 1]" 1
1190 1 47 LEU H 1 53 VAL HA 4.637 2.487 6.787 6.061 5.669 6.450 . 0 0 "[ . 1]" 1
1191 1 46 LYS HA 1 47 LEU H 2.155 . 2.619 2.159 2.141 2.189 . 0 0 "[ . 1]" 1
1192 1 53 VAL H 1 54 LEU H 4.308 2.452 6.164 4.566 4.529 4.613 . 0 0 "[ . 1]" 1
1193 1 55 HIS H 1 58 LEU QD 2.870 2.047 3.693 1.929 1.597 2.799 0.450 10 0 "[ . 1]" 1
1194 1 55 HIS H 1 55 HIS HB3 3.739 2.341 5.137 3.673 3.583 3.755 . 0 0 "[ . 1]" 1
1195 1 55 HIS H 1 55 HIS HB2 2.545 . 3.193 2.525 2.447 2.629 . 0 0 "[ . 1]" 1
1196 1 55 HIS H 1 58 LEU HB2 2.806 2.018 3.594 2.316 1.956 3.397 0.062 5 0 "[ . 1]" 1
1197 1 54 LEU HA 1 55 HIS H 2.129 . 2.582 2.361 2.130 2.445 . 0 0 "[ . 1]" 1
1198 1 55 HIS H 1 55 HIS HA 2.759 . 3.520 2.919 2.825 2.936 . 0 0 "[ . 1]" 1
1199 1 55 HIS H 1 58 LEU H 3.975 2.395 5.555 3.965 3.603 4.639 . 0 0 "[ . 1]" 1
1200 1 54 LEU H 1 55 HIS H 4.529 2.478 6.580 4.514 4.071 4.585 . 0 0 "[ . 1]" 1
1201 1 25 THR HB 1 57 ASN H 4.202 2.437 5.967 6.650 5.706 8.083 2.116 5 5 "[* +* *-1]" 1
1202 1 56 ASP HA 1 57 ASN H 3.373 2.236 4.510 3.556 3.524 3.582 . 0 0 "[ . 1]" 1
1203 1 57 ASN H 1 58 LEU H 2.303 . 2.833 2.621 2.495 2.684 . 0 0 "[ . 1]" 1
1204 1 57 ASN H 1 57 ASN HD22 5.388 2.485 8.291 5.507 4.619 5.911 . 0 0 "[ . 1]" 1
1205 1 25 THR HA 1 58 LEU H 4.774 2.495 7.053 5.380 5.139 5.785 . 0 0 "[ . 1]" 1
1206 1 26 ILE H 1 60 LEU H 4.943 2.500 7.386 4.909 4.514 5.178 . 0 0 "[ . 1]" 1
1207 1 60 LEU H 1 62 ASP H 4.188 2.434 5.942 4.036 3.896 4.182 . 0 0 "[ . 1]" 1
1208 1 62 ASP H 1 64 LYS H 4.234 2.441 6.027 3.551 3.396 3.707 . 0 0 "[ . 1]" 1
1209 1 64 LYS H 1 65 VAL H 3.056 2.122 3.990 3.379 3.233 3.534 . 0 0 "[ . 1]" 1
1210 1 65 VAL HB 1 66 THR H 3.316 2.217 4.415 4.260 4.115 4.342 . 0 0 "[ . 1]" 1
1211 1 67 PRO HD2 1 68 ALA H 3.349 2.227 4.471 2.823 2.522 3.057 . 0 0 "[ . 1]" 1
1212 1 66 THR H 1 69 ASN QD 4.642 2.487 6.797 4.334 3.708 6.034 . 0 0 "[ . 1]" 1
1213 1 67 PRO HB2 1 68 ALA H 4.705 2.492 6.918 3.530 3.054 3.731 . 0 0 "[ . 1]" 1
1214 1 67 PRO HB3 1 68 ALA H 3.732 2.339 5.125 4.311 4.170 4.405 . 0 0 "[ . 1]" 1
1215 1 69 ASN HA 1 70 SER H 2.900 2.059 3.741 3.432 2.396 3.563 . 0 0 "[ . 1]" 1
1216 1 69 ASN HB2 1 70 SER H 2.649 . 6.000 2.549 2.097 4.627 . 0 0 "[ . 1]" 1
1217 1 69 ASN HB3 1 70 SER H 3.636 2.314 4.958 2.746 1.810 4.436 0.504 5 1 "[ + 1]" 1
1218 1 65 VAL HB 1 70 SER H 4.848 2.498 7.198 6.103 5.482 7.872 0.674 2 1 "[ + . 1]" 1
1219 1 10 GLN HA 1 10 GLN HE22 4.538 2.479 6.597 5.879 5.642 6.032 . 0 0 "[ . 1]" 1
1220 1 10 GLN HE22 1 10 GLN HG2 3.603 2.305 4.901 3.502 3.428 3.781 . 0 0 "[ . 1]" 1
1221 1 10 GLN HE22 1 10 GLN HG3 3.912 2.381 5.443 3.812 3.477 4.061 . 0 0 "[ . 1]" 1
1222 1 10 GLN HA 1 10 GLN HE21 3.783 2.352 5.214 4.800 4.345 5.072 . 0 0 "[ . 1]" 1
1223 1 10 GLN HE21 1 10 GLN HG2 2.576 . 3.239 2.281 2.100 2.928 . 0 0 "[ . 1]" 1
1224 1 10 GLN HE21 1 10 GLN HG3 2.616 . 3.300 2.980 2.200 3.479 0.179 8 0 "[ . 1]" 1
1225 1 64 LYS H 1 64 LYS HA 2.324 . 2.864 2.261 2.256 2.265 . 0 0 "[ . 1]" 1
1226 1 28 GLN HB3 1 28 GLN QE 4.976 2.500 7.452 3.927 3.624 4.148 . 0 0 "[ . 1]" 1
1227 1 27 LEU HB3 1 28 GLN QE 3.244 2.191 4.297 3.093 2.067 4.190 0.124 3 0 "[ . 1]" 1
1228 1 25 THR HB 1 28 GLN QE 6.416 2.300 10.532 4.113 3.194 4.902 . 0 0 "[ . 1]" 1
1229 1 28 GLN HA 1 28 GLN QE 3.350 2.426 4.472 3.082 2.140 3.990 0.286 5 0 "[ . 1]" 1
1230 1 27 LEU HB2 1 28 GLN QE 3.945 2.422 5.502 4.392 3.349 5.384 . 0 0 "[ . 1]" 1
1231 1 30 LYS QB 1 31 GLN QE 5.537 2.471 8.603 5.236 4.786 5.737 . 0 0 "[ . 1]" 1
1232 1 31 GLN HA 1 31 GLN QE 4.376 2.461 6.291 3.996 3.349 4.213 . 0 0 "[ . 1]" 1
1233 1 31 GLN QE 1 31 GLN HG3 . 2.275 3.297 2.260 2.138 2.831 0.137 10 0 "[ . 1]" 1
1234 1 31 GLN HB2 1 31 GLN QE 5.587 2.496 7.904 4.194 3.732 4.308 . 0 0 "[ . 1]" 1
1235 1 31 GLN H 1 31 GLN QE 5.291 2.491 8.091 4.964 4.834 5.130 . 0 0 "[ . 1]" 1
1236 1 69 ASN HA 1 69 ASN QD 4.684 2.498 6.878 3.762 2.892 4.058 . 0 0 "[ . 1]" 1
1237 1 69 ASN HB2 1 69 ASN QD . 2.224 3.208 2.226 2.094 2.869 0.130 6 0 "[ . 1]" 1
1238 1 69 ASN HB3 1 69 ASN QD . 2.268 2.920 2.933 2.177 3.265 0.345 4 0 "[ . 1]" 1
1239 1 66 THR MG 1 69 ASN QD 4.279 2.448 6.063 3.471 2.686 4.899 . 0 0 "[ . 1]" 1
1240 1 49 LEU HG 1 69 ASN QD 3.421 2.250 4.592 4.128 2.270 5.592 1.000 4 2 "[ +- 1]" 1
1241 1 79 ASN H 1 79 ASN QD 4.559 2.500 6.638 3.659 3.087 3.978 . 0 0 "[ . 1]" 1
1242 1 57 ASN H 1 57 ASN HD21 4.838 2.498 7.178 4.444 4.161 4.876 . 0 0 "[ . 1]" 1
1243 1 77 LYS QB 1 79 ASN QD 4.589 2.483 6.695 3.950 3.214 4.928 . 0 0 "[ . 1]" 1
1244 1 8 LYS HB2 1 74 VAL H 4.426 2.467 6.385 4.330 4.002 4.656 . 0 0 "[ . 1]" 1
1245 1 7 LYS H 1 73 THR H 4.978 2.499 7.457 4.830 4.647 4.972 . 0 0 "[ . 1]" 1
1246 1 9 ILE H 1 10 GLN HG2 5.064 2.500 7.628 6.081 5.360 6.556 . 0 0 "[ . 1]" 1
1247 1 8 LYS HB2 1 10 GLN H 5.245 2.494 7.996 5.592 5.114 5.975 . 0 0 "[ . 1]" 1
1248 1 20 PHE H 1 20 PHE HB2 3.051 2.120 3.982 2.567 2.440 2.705 . 0 0 "[ . 1]" 1
1249 1 19 ASP HB3 1 20 PHE H 3.763 2.347 5.179 4.001 3.591 4.255 . 0 0 "[ . 1]" 1
1250 1 23 SER H 1 24 ASP H 2.545 . 3.193 2.500 2.316 2.718 . 0 0 "[ . 1]" 1
1251 1 21 SER H 1 24 ASP H 4.729 2.493 6.965 4.249 4.020 4.656 . 0 0 "[ . 1]" 1
1252 1 24 ASP H 1 60 LEU H 4.267 2.446 6.088 3.887 3.736 4.060 . 0 0 "[ . 1]" 1
1253 1 25 THR H 1 26 ILE H 5.107 2.499 7.715 4.502 4.475 4.525 . 0 0 "[ . 1]" 1
1254 1 26 ILE H 1 29 ILE MD 4.978 2.500 7.456 4.607 4.439 4.919 . 0 0 "[ . 1]" 1
1255 1 25 THR H 1 27 LEU H 5.121 2.498 7.744 4.801 4.597 5.070 . 0 0 "[ . 1]" 1
1256 1 26 ILE H 1 28 GLN H 4.938 2.500 7.376 4.412 4.313 4.490 . 0 0 "[ . 1]" 1
1257 1 25 THR HA 1 28 GLN H 5.272 2.493 8.051 4.817 4.743 4.944 . 0 0 "[ . 1]" 1
1258 1 25 THR H 1 28 GLN QE 5.654 2.457 8.851 4.459 3.089 5.946 . 0 0 "[ . 1]" 1
1259 1 30 LYS H 1 32 HIS H 4.927 2.499 7.355 4.126 3.953 4.231 . 0 0 "[ . 1]" 1
1260 1 28 GLN HA 1 30 LYS H 4.922 2.499 7.345 4.596 4.481 4.730 . 0 0 "[ . 1]" 1
1261 1 20 PHE HZ 1 33 LEU H 5.178 2.497 7.859 6.375 5.323 6.959 . 0 0 "[ . 1]" 1
1262 1 42 ILE H 1 43 SER H 4.068 2.413 5.723 2.625 2.500 2.760 . 0 0 "[ . 1]" 1
1263 1 43 SER H 1 45 ILE H 5.711 2.450 8.972 4.267 4.102 4.407 . 0 0 "[ . 1]" 1
1264 1 46 LYS H 1 47 LEU HA 4.885 2.499 7.271 4.699 4.519 4.787 . 0 0 "[ . 1]" 1
1265 1 47 LEU H 1 75 MET H 3.934 2.386 5.482 4.999 4.927 5.068 . 0 0 "[ . 1]" 1
1266 1 49 LEU H 1 52 LYS HA 4.610 2.485 6.735 4.860 4.709 5.406 . 0 0 "[ . 1]" 1
1267 1 48 LEU HA 1 53 VAL H 5.241 2.495 7.987 5.263 4.811 5.522 . 0 0 "[ . 1]" 1
1268 1 55 HIS HA 1 57 ASN H 3.559 2.292 4.826 4.592 4.197 4.847 0.021 10 0 "[ . 1]" 1
1269 1 57 ASN H 1 57 ASN HA 2.748 . 3.503 2.906 2.859 2.930 . 0 0 "[ . 1]" 1
1270 1 25 THR HA 1 59 PHE H 4.938 2.499 7.377 4.881 4.779 5.017 . 0 0 "[ . 1]" 1
1271 1 71 THR H 1 72 ILE H 4.499 2.475 6.523 4.285 4.134 4.355 . 0 0 "[ . 1]" 1
1272 1 69 ASN HB2 1 71 THR H 4.695 2.491 6.899 3.865 3.487 5.022 . 0 0 "[ . 1]" 1
1273 1 69 ASN HB3 1 71 THR H 3.835 2.364 5.306 2.715 2.249 4.769 0.115 1 0 "[ . 1]" 1
1274 1 72 ILE H 1 72 ILE HG13 4.346 2.457 6.235 3.768 3.513 3.971 . 0 0 "[ . 1]" 1
1275 1 72 ILE H 1 72 ILE HB 3.030 2.112 3.948 2.736 2.544 3.228 . 0 0 "[ . 1]" 1
1276 1 71 THR HA 1 72 ILE H 2.761 . 3.523 2.135 2.110 2.234 . 0 0 "[ . 1]" 1
1277 1 49 LEU H 1 73 THR H 5.231 2.495 7.967 4.886 4.412 5.011 . 0 0 "[ . 1]" 1
1278 1 72 ILE H 1 73 THR H 4.734 2.493 6.975 4.308 4.184 4.394 . 0 0 "[ . 1]" 1
1279 1 75 MET HB2 1 76 ILE H 3.396 2.243 4.549 4.318 4.191 4.442 . 0 0 "[ . 1]" 1
1280 1 76 ILE H 1 76 ILE HB 2.559 . 3.214 2.964 2.814 3.093 . 0 0 "[ . 1]" 1
1281 1 8 LYS QE 1 76 ILE H 2.462 . 3.068 2.392 2.037 2.718 . 0 0 "[ . 1]" 1
1282 1 75 MET HA 1 76 ILE H 2.130 . 2.584 2.137 2.082 2.172 . 0 0 "[ . 1]" 1
1283 1 77 LYS H 1 77 LYS HG2 3.125 2.149 4.101 3.228 2.585 4.197 0.096 8 0 "[ . 1]" 1
1284 1 77 LYS H 1 77 LYS QE 5.989 2.402 9.576 4.954 4.475 6.185 . 0 0 "[ . 1]" 1
1285 1 45 ILE HA 1 77 LYS H 3.948 2.389 5.507 4.285 4.075 4.604 . 0 0 "[ . 1]" 1
1286 1 77 LYS H 1 77 LYS HA 2.716 . 3.454 2.935 2.891 2.949 . 0 0 "[ . 1]" 1
1287 1 76 ILE HA 1 77 LYS H 2.152 . 2.615 2.235 2.181 2.285 . 0 0 "[ . 1]" 1
1288 1 76 ILE MG 1 77 LYS H 2.384 . 2.952 2.313 2.043 3.512 0.560 2 1 "[ + . 1]" 1
1289 1 78 PRO QB 1 79 ASN H 3.784 2.352 4.134 3.448 2.966 3.607 . 0 0 "[ . 1]" 1
1290 1 44 GLU QG 1 79 ASN H 3.204 2.178 4.230 4.248 3.239 4.746 0.516 9 1 "[ . +1]" 1
1291 1 79 ASN H 1 79 ASN HA 2.275 . 2.793 2.902 2.849 2.938 0.145 9 0 "[ . 1]" 1
1292 1 78 PRO HA 1 79 ASN H 1.973 . 2.362 2.155 2.122 2.184 . 0 0 "[ . 1]" 1
1293 1 34 ILE MD 1 42 ILE H 2.981 2.092 3.870 2.518 2.151 2.886 . 0 0 "[ . 1]" 1
1294 1 2 VAL H 1 3 HIS H 4.818 2.496 7.140 4.459 4.297 4.531 . 0 0 "[ . 1]" 1
1295 1 48 LEU HA 1 51 GLY H 6.070 2.385 9.755 5.015 4.734 5.339 . 0 0 "[ . 1]" 1
1296 1 1 MET HB3 1 2 VAL H 4.197 2.436 5.958 2.528 1.800 3.364 0.636 5 2 "[ +- 1]" 1
1297 1 5 THR H 1 5 THR HA 3.228 2.186 4.270 2.924 2.907 2.939 . 0 0 "[ . 1]" 1
1298 1 35 SER HB2 1 36 GLU H 2.851 2.038 3.664 3.412 2.976 4.146 0.482 7 0 "[ . 1]" 1
1299 1 47 LEU HA 1 75 MET H 3.710 2.334 5.086 3.338 3.137 3.455 . 0 0 "[ . 1]" 1
1300 1 43 SER H 1 47 LEU QD 5.593 2.464 8.722 4.353 3.862 4.647 . 0 0 "[ . 1]" 1
1301 1 47 LEU QD 1 48 LEU H 3.971 2.394 5.548 2.715 2.588 2.909 . 0 0 "[ . 1]" 1
1302 1 45 ILE HB 1 47 LEU QD 2.622 . 3.310 3.301 3.104 3.597 0.287 5 0 "[ . 1]" 1
1303 1 26 ILE MD 1 54 LEU H 4.429 2.467 6.391 5.054 4.815 5.264 . 0 0 "[ . 1]" 1
1304 1 26 ILE MD 1 29 ILE H 3.913 2.382 5.444 4.447 4.355 4.516 . 0 0 "[ . 1]" 1
1305 1 6 LEU HA 1 72 ILE MD 3.862 2.370 5.354 4.045 3.349 4.408 . 0 0 "[ . 1]" 1
1306 1 32 HIS H 1 34 ILE MD 4.294 2.450 6.138 5.098 4.854 5.473 . 0 0 "[ . 1]" 1
1307 1 30 LYS QB 1 34 ILE MD 2.786 2.010 3.562 3.381 3.172 3.656 0.094 4 0 "[ . 1]" 1
1308 1 29 ILE H 1 29 ILE MD 3.456 2.262 4.650 3.363 3.251 3.480 . 0 0 "[ . 1]" 1
1309 1 9 ILE MD 1 73 THR H 4.096 2.418 5.774 4.223 3.798 4.577 . 0 0 "[ . 1]" 1
1310 1 30 LYS QB 1 45 ILE MD 2.270 . 2.785 2.165 1.979 2.367 . 0 0 "[ . 1]" 1
1311 1 45 ILE HB 1 45 ILE MD 1.807 . 2.134 1.971 1.953 1.996 . 0 0 "[ . 1]" 1
1312 1 11 ALA MB 1 12 PRO HB3 3.772 2.349 5.195 3.951 3.744 4.090 . 0 0 "[ . 1]" 1
1313 1 10 GLN HB2 1 11 ALA MB 3.279 2.204 4.354 4.163 3.941 4.679 0.325 3 0 "[ . 1]" 1
1314 1 26 ILE MG 1 56 ASP H 3.483 2.270 4.696 4.552 3.886 4.812 0.116 7 0 "[ . 1]" 1
1315 1 25 THR HA 1 26 ILE MG 4.497 2.475 6.519 4.676 4.452 4.978 . 0 0 "[ . 1]" 1
1316 1 29 ILE H 1 29 ILE MG 3.122 2.147 4.097 3.187 3.071 3.280 . 0 0 "[ . 1]" 1
1317 1 6 LEU HB2 1 29 ILE MG 3.709 2.333 5.085 4.017 3.863 4.070 . 0 0 "[ . 1]" 1
1318 1 2 VAL QG 1 4 LEU HA 4.343 2.456 6.230 3.943 3.723 4.079 . 0 0 "[ . 1]" 1
1319 1 2 VAL QG 1 24 ASP H 3.540 2.287 4.793 3.896 3.464 4.091 . 0 0 "[ . 1]" 1
1320 1 5 THR MG 1 6 LEU HA 2.729 . 3.474 3.381 3.264 3.532 0.058 2 0 "[ . 1]" 1
1321 1 5 THR H 1 71 THR MG 4.245 2.443 6.047 4.443 4.002 5.591 . 0 0 "[ . 1]" 1
1322 1 25 THR MG 1 26 ILE H 3.009 2.103 3.915 2.592 2.011 3.276 0.092 6 0 "[ . 1]" 1
1323 1 10 GLN H 1 73 THR MG 4.474 2.472 6.476 5.419 4.900 5.729 . 0 0 "[ . 1]" 1
1324 1 9 ILE HB 1 73 THR MG 3.055 . 6.000 3.992 3.708 4.244 . 0 0 "[ . 1]" 1
1325 1 24 ASP HB2 1 25 THR MG 3.294 2.209 4.379 4.343 4.002 5.117 0.738 2 1 "[ + . 1]" 1
1326 1 59 PHE H 1 60 LEU QD 4.272 2.447 6.097 4.050 3.988 4.107 . 0 0 "[ . 1]" 1
1327 1 6 LEU QD 1 18 HIS HE1 4.695 2.490 6.900 5.336 3.726 6.140 . 0 0 "[ . 1]" 1
1328 1 6 LEU QD 1 18 HIS H 3.591 2.302 4.880 2.986 2.681 3.164 . 0 0 "[ . 1]" 1
1329 1 27 LEU QD 1 28 GLN QE 3.650 2.317 4.983 3.248 2.450 3.831 . 0 0 "[ . 1]" 1
1330 1 27 LEU H 1 27 LEU QD 3.298 2.211 4.385 3.141 2.965 3.477 . 0 0 "[ . 1]" 1
1331 1 6 LEU QD 1 18 HIS HE1 3.358 2.230 4.486 5.501 3.317 6.782 2.296 9 6 "[ **.* *+-]" 1
1332 1 32 HIS H 1 33 LEU QD 4.631 2.486 6.776 4.080 3.966 4.284 . 0 0 "[ . 1]" 1
1333 1 6 LEU HB2 1 6 LEU QD 2.347 . 2.898 1.974 1.933 2.021 . 0 0 "[ . 1]" 1
1334 1 22 PRO HA 1 60 LEU QD 3.748 2.343 5.153 3.024 2.835 3.265 . 0 0 "[ . 1]" 1
1335 1 20 PHE HB3 1 60 LEU QD 2.524 . 6.000 2.494 2.252 2.753 . 0 0 "[ . 1]" 1
1336 1 46 LYS QE 1 48 LEU QD 2.967 2.087 3.847 3.709 3.233 4.484 0.637 5 1 "[ + 1]" 1
1337 1 54 LEU HA 1 54 LEU QD 3.034 2.114 3.954 2.225 1.981 2.869 0.133 2 0 "[ . 1]" 1
1338 1 22 PRO HA 1 60 LEU QD 2.933 2.073 3.793 2.170 1.967 2.683 0.106 2 0 "[ . 1]" 1
1339 1 48 LEU QD 1 53 VAL HA 3.007 2.103 3.911 1.800 1.683 1.994 0.420 3 0 "[ . 1]" 1
1340 1 48 LEU QD 1 73 THR H 3.792 2.354 5.230 4.348 4.067 4.497 . 0 0 "[ . 1]" 1
1341 1 4 LEU MD2 1 20 PHE QE 3.942 2.388 5.496 3.869 3.347 4.512 . 0 0 "[ . 1]" 1
1342 1 4 LEU MD2 1 20 PHE QD 3.436 2.255 4.617 2.911 2.409 3.479 . 0 0 "[ . 1]" 1
1343 1 30 LYS H 1 45 ILE MG 3.939 2.387 5.491 4.478 4.233 4.680 . 0 0 "[ . 1]" 1
1344 1 30 LYS QB 1 45 ILE MG 2.922 2.068 3.776 3.222 2.877 3.521 . 0 0 "[ . 1]" 1
1345 1 45 ILE HB 1 45 ILE MG 1.774 . 2.089 1.978 1.958 2.002 . 0 0 "[ . 1]" 1
1346 1 10 GLN HE22 1 73 THR MG 5.452 2.479 8.425 7.109 6.023 7.680 . 0 0 "[ . 1]" 1
1347 1 22 PRO HA 1 60 LEU HB3 3.999 2.400 5.598 3.308 2.981 3.707 . 0 0 "[ . 1]" 1
1348 1 24 ASP H 1 60 LEU HB3 4.722 2.492 6.952 3.998 3.835 4.158 . 0 0 "[ . 1]" 1
1349 1 40 SER H 1 76 ILE HB 4.523 2.477 6.569 3.958 3.819 4.074 . 0 0 "[ . 1]" 1
1350 1 65 VAL HA 1 69 ASN HB3 4.704 2.491 6.917 4.603 4.364 4.800 . 0 0 "[ . 1]" 1
1351 1 65 VAL HA 1 69 ASN HB2 4.526 2.478 6.574 4.318 4.156 4.721 . 0 0 "[ . 1]" 1
1352 1 8 LYS HB2 1 74 VAL MG2 3.577 2.297 4.857 2.972 2.754 3.161 . 0 0 "[ . 1]" 1
1353 1 8 LYS HB2 1 8 LYS QD 2.979 2.092 3.866 2.096 2.073 2.112 0.019 1 0 "[ . 1]" 1
1354 1 8 LYS HB3 1 8 LYS QD 3.234 2.188 4.280 2.115 2.105 2.126 0.083 5 0 "[ . 1]" 1
1355 1 13 LYS QB 1 13 LYS QE 3.079 2.131 4.027 1.840 1.703 2.061 0.428 1 0 "[ . 1]" 1
1356 1 10 GLN HA 1 10 GLN HG2 2.838 2.033 3.643 2.680 2.324 3.191 . 0 0 "[ . 1]" 1
1357 1 10 GLN HE21 1 10 GLN HG2 2.567 . 3.226 2.124 2.021 2.429 . 0 0 "[ . 1]" 1
1358 1 10 GLN H 1 10 GLN HG2 3.505 2.277 4.733 3.536 2.907 3.890 . 0 0 "[ . 1]" 1
1359 1 41 HIS H 1 41 HIS HB2 3.630 2.312 4.948 2.744 2.470 3.048 . 0 0 "[ . 1]" 1
1360 1 29 ILE H 1 29 ILE HB 2.748 . 3.503 2.212 2.159 2.294 . 0 0 "[ . 1]" 1
1361 1 28 GLN QE 1 28 GLN QG 4.080 2.416 4.744 2.138 2.101 2.173 0.315 8 0 "[ . 1]" 1
1362 1 27 LEU HB2 1 28 GLN QE 5.701 2.451 8.951 4.234 3.327 4.998 . 0 0 "[ . 1]" 1
1363 1 80 LEU H 1 80 LEU HB2 3.075 2.130 4.020 2.467 2.368 2.703 . 0 0 "[ . 1]" 1
1364 1 47 LEU HB3 1 48 LEU H 5.177 2.497 7.857 3.270 3.006 3.616 . 0 0 "[ . 1]" 1
1365 1 10 GLN H 1 10 GLN HA 2.560 . 3.215 2.536 2.513 2.577 . 0 0 "[ . 1]" 1
1366 1 64 LYS H 1 64 LYS HA 2.043 . 2.461 2.014 1.947 2.236 . 0 0 "[ . 1]" 1
1367 1 56 ASP H 1 58 LEU HA 4.105 2.420 5.790 4.707 4.579 4.923 . 0 0 "[ . 1]" 1
1368 1 32 HIS H 1 33 LEU HA 4.752 2.494 7.010 3.907 3.677 4.311 . 0 0 "[ . 1]" 1
1369 1 33 LEU H 1 33 LEU HA 3.350 2.228 4.472 2.710 2.702 2.717 . 0 0 "[ . 1]" 1
1370 1 27 LEU H 1 27 LEU HA 3.255 2.195 4.315 2.672 2.647 2.688 . 0 0 "[ . 1]" 1
1371 1 27 LEU HA 1 28 GLN H 3.341 2.225 4.457 3.380 3.357 3.406 . 0 0 "[ . 1]" 1
1372 1 25 THR HA 1 59 PHE H 5.537 2.471 8.603 4.689 4.554 4.821 . 0 0 "[ . 1]" 1
1373 1 34 ILE HA 1 37 GLU H 3.651 2.318 4.984 3.146 3.017 3.247 . 0 0 "[ . 1]" 1
1374 1 40 SER HB2 1 41 HIS H 3.746 2.343 5.149 2.625 2.156 3.168 0.187 1 0 "[ . 1]" 1
1375 1 29 ILE H 1 29 ILE HA 3.343 2.226 4.460 2.714 2.705 2.724 . 0 0 "[ . 1]" 1
1376 1 15 SER HB3 1 16 ILE H 3.184 2.170 4.198 3.196 2.659 3.350 . 0 0 "[ . 1]" 1
1377 1 15 SER HB2 1 16 ILE H 3.444 2.258 4.630 2.752 2.574 2.961 . 0 0 "[ . 1]" 1
1378 1 7 LYS H 1 73 THR HB 4.514 2.477 6.551 3.361 2.926 3.810 . 0 0 "[ . 1]" 1
1379 1 69 ASN HA 1 70 SER H 3.070 2.127 4.013 3.153 2.308 3.340 . 0 0 "[ . 1]" 1
1380 1 40 SER H 1 78 PRO QD 5.959 2.409 9.509 4.662 4.552 4.785 . 0 0 "[ . 1]" 1
1381 1 7 LYS H 1 72 ILE HA 4.466 2.471 6.461 4.390 4.170 4.610 . 0 0 "[ . 1]" 1
1382 1 28 GLN HA 1 28 GLN QE 3.544 2.288 4.800 2.805 2.122 3.302 0.166 5 0 "[ . 1]" 1
1383 1 66 THR H 1 67 PRO HD3 5.521 2.473 8.569 3.758 3.568 3.882 . 0 0 "[ . 1]" 1
1384 1 18 HIS H 1 18 HIS HB3 3.757 2.346 5.168 2.416 2.292 2.508 0.054 9 0 "[ . 1]" 1
1385 1 36 GLU HB3 1 37 GLU H 4.508 2.476 6.540 3.718 3.199 3.951 . 0 0 "[ . 1]" 1
1386 1 10 GLN HB3 1 11 ALA H 2.790 2.011 3.569 2.322 2.223 2.471 . 0 0 "[ . 1]" 1
1387 1 46 LYS HG3 1 47 LEU H 4.469 2.472 6.466 4.256 3.013 4.695 . 0 0 "[ . 1]" 1
1388 1 37 GLU H 1 37 GLU HB2 4.016 2.403 5.629 3.310 3.111 3.427 . 0 0 "[ . 1]" 1
1389 1 37 GLU H 1 37 GLU HB3 4.406 2.465 6.347 3.753 3.700 3.769 . 0 0 "[ . 1]" 1
1390 1 48 LEU QD 1 51 GLY HA2 5.206 2.496 7.916 3.175 2.326 3.792 0.170 1 0 "[ . 1]" 1
1391 1 48 LEU HB3 1 51 GLY HA2 5.590 2.465 8.715 4.230 3.000 5.196 . 0 0 "[ . 1]" 1
1392 1 48 LEU HB3 1 51 GLY HA3 6.019 2.396 9.642 5.131 4.166 6.023 . 0 0 "[ . 1]" 1
1393 1 77 LYS QG 1 78 PRO QD 4.900 2.499 6.114 4.049 3.663 4.383 . 0 0 "[ . 1]" 1
1394 1 67 PRO HA 1 67 PRO HD3 4.009 2.401 5.617 3.083 2.973 3.166 . 0 0 "[ . 1]" 1
1395 1 11 ALA HA 1 12 PRO HB3 4.949 2.500 7.398 4.140 4.041 4.247 . 0 0 "[ . 1]" 1
1396 1 11 ALA HA 1 13 LYS QB 4.831 2.497 7.165 3.412 2.931 3.992 . 0 0 "[ . 1]" 1
1397 1 33 LEU HB2 1 39 ALA HA 4.988 2.500 7.476 4.867 4.701 5.256 . 0 0 "[ . 1]" 1
1398 1 39 ALA HA 1 45 ILE HG12 4.102 2.419 5.785 3.791 3.561 4.028 . 0 0 "[ . 1]" 1
1399 1 39 ALA HA 1 76 ILE MD 2.606 . 3.285 2.183 1.778 2.483 0.149 5 0 "[ . 1]" 1
1400 1 6 LEU HA 1 6 LEU HG 3.967 2.393 5.541 3.524 3.468 3.559 . 0 0 "[ . 1]" 1
1401 1 4 LEU HA 1 4 LEU HB2 3.090 2.135 4.045 2.345 2.226 2.886 . 0 0 "[ . 1]" 1
1402 1 2 VAL QG 1 4 LEU HA 3.116 2.145 4.087 2.987 1.959 3.483 0.186 5 0 "[ . 1]" 1
1403 1 46 LYS QB 1 47 LEU HA 4.403 2.465 6.341 4.131 4.040 4.212 . 0 0 "[ . 1]" 1
1404 1 49 LEU HA 1 50 LYS QB 3.546 2.289 4.803 3.921 3.786 4.040 . 0 0 "[ . 1]" 1
1405 1 77 LYS HA 1 77 LYS QG 2.783 2.009 3.557 2.850 2.397 3.117 . 0 0 "[ . 1]" 1
1406 1 79 ASN HA 1 79 ASN QB 2.339 . 2.886 2.342 2.184 2.532 . 0 0 "[ . 1]" 1
1407 1 77 LYS QB 1 79 ASN HA 4.631 2.486 6.776 4.180 4.113 4.273 . 0 0 "[ . 1]" 1
1408 1 79 ASN HA 1 80 LEU HB3 3.671 2.324 5.018 4.826 3.908 5.175 0.157 8 0 "[ . 1]" 1
1409 1 79 ASN HA 1 80 LEU QD 4.497 2.474 6.520 4.952 4.308 5.293 . 0 0 "[ . 1]" 1
1410 1 26 ILE HB 1 57 ASN HA 4.138 2.426 5.850 3.741 3.636 3.837 . 0 0 "[ . 1]" 1
1411 1 26 ILE HG12 1 57 ASN HA 3.832 2.363 5.301 3.599 3.009 4.012 . 0 0 "[ . 1]" 1
1412 1 7 LYS HA 1 7 LYS HB3 3.127 2.149 4.105 2.736 2.522 2.911 . 0 0 "[ . 1]" 1
1413 1 5 THR MG 1 7 LYS HA 3.840 2.365 5.315 2.653 2.303 3.247 0.062 7 0 "[ . 1]" 1
1414 1 46 LYS HA 1 46 LYS QB 2.570 . 3.231 2.247 2.123 2.304 . 0 0 "[ . 1]" 1
1415 1 45 ILE MG 1 46 LYS HA 2.917 2.066 3.768 2.986 2.714 3.460 . 0 0 "[ . 1]" 1
1416 1 7 LYS HA 1 9 ILE MD 4.203 2.436 5.970 3.936 3.792 4.102 . 0 0 "[ . 1]" 1
1417 1 34 ILE MG 1 41 HIS HA 3.278 2.203 4.353 3.308 3.011 3.537 . 0 0 "[ . 1]" 1
1418 1 62 ASP HA 1 64 LYS QG 3.929 2.385 5.473 3.817 3.625 3.933 . 0 0 "[ . 1]" 1
1419 1 48 LEU HB3 1 49 LEU HA 3.162 2.162 4.162 3.110 2.959 3.288 . 0 0 "[ . 1]" 1
1420 1 48 LEU MD1 1 49 LEU HA 3.834 2.364 5.304 3.552 3.313 3.728 . 0 0 "[ . 1]" 1
1421 1 52 LYS QE 1 63 LEU HA 3.012 2.105 3.919 3.407 2.348 3.861 . 0 0 "[ . 1]" 1
1422 1 57 ASN HB3 1 58 LEU HA 4.251 2.444 6.058 3.634 3.466 3.731 . 0 0 "[ . 1]" 1
1423 1 63 LEU HA 1 63 LEU HB2 2.105 . 2.548 2.370 2.333 2.403 . 0 0 "[ . 1]" 1
1424 1 36 GLU HA 1 36 GLU QG 2.611 . 3.293 2.363 2.068 2.719 . 0 0 "[ . 1]" 1
1425 1 63 LEU HA 1 63 LEU HB3 2.021 . 2.430 2.112 2.077 2.150 . 0 0 "[ . 1]" 1
1426 1 13 LYS HA 1 13 LYS QG 2.752 . 3.509 3.063 2.416 3.378 . 0 0 "[ . 1]" 1
1427 1 50 LYS HA 1 50 LYS QG 2.971 2.088 3.854 2.721 2.343 2.899 . 0 0 "[ . 1]" 1
1428 1 27 LEU HA 1 27 LEU HB2 2.804 2.017 3.591 2.375 2.228 2.472 . 0 0 "[ . 1]" 1
1429 1 17 GLU HA 1 17 GLU QB 2.908 2.062 3.754 2.375 2.210 2.443 . 0 0 "[ . 1]" 1
1430 1 7 LYS QD 1 15 SER HA 4.199 2.436 5.962 4.479 3.964 4.734 . 0 0 "[ . 1]" 1
1431 1 24 ASP HB2 1 25 THR HA 5.656 2.457 8.855 4.314 4.035 4.620 . 0 0 "[ . 1]" 1
1432 1 7 LYS QD 1 9 ILE HA 3.154 2.159 4.149 4.372 3.690 5.008 0.859 10 3 "[ *-. +]" 1
1433 1 7 LYS HG2 1 9 ILE HA 3.737 2.341 5.133 2.392 2.232 2.490 0.109 2 0 "[ . 1]" 1
1434 1 6 LEU QD 1 71 THR HA 4.478 2.473 6.483 4.061 3.866 4.365 . 0 0 "[ . 1]" 1
1435 1 9 ILE MD 1 73 THR HA 3.041 2.116 3.966 3.269 3.070 3.487 . 0 0 "[ . 1]" 1
1436 1 48 LEU HA 1 48 LEU HB3 3.271 2.201 4.341 2.662 2.546 2.830 . 0 0 "[ . 1]" 1
1437 1 47 LEU HB3 1 48 LEU HA 4.088 2.416 5.760 3.888 3.781 3.997 . 0 0 "[ . 1]" 1
1438 1 25 THR HB 1 26 ILE HG12 4.310 2.453 6.167 2.763 2.397 3.632 0.056 7 0 "[ . 1]" 1
1439 1 25 THR HB 1 28 GLN HB2 6.464 2.285 10.643 3.323 2.668 3.990 . 0 0 "[ . 1]" 1
1440 1 49 LEU QD 1 66 THR HB 4.935 2.499 7.371 4.105 3.755 4.429 . 0 0 "[ . 1]" 1
1441 1 7 LYS HB3 1 71 THR HB 3.931 2.386 5.476 4.048 3.566 4.322 . 0 0 "[ . 1]" 1
1442 1 9 ILE HB 1 73 THR HB 4.171 2.431 5.911 4.560 3.907 5.024 . 0 0 "[ . 1]" 1
1443 1 5 THR HB 1 17 GLU HG3 5.522 2.472 8.572 3.879 3.319 4.678 . 0 0 "[ . 1]" 1
1444 1 5 THR HB 1 71 THR HA 3.176 2.167 4.185 2.190 2.006 2.612 0.161 5 0 "[ . 1]" 1
1445 1 2 VAL QG 1 67 PRO HA 3.238 . 6.000 3.885 3.585 4.086 . 0 0 "[ . 1]" 1
1446 1 22 PRO HA 1 22 PRO HB3 2.717 . 3.455 2.190 2.068 2.252 . 0 0 "[ . 1]" 1
1447 1 63 LEU HB3 1 65 VAL HA 4.744 2.493 6.995 4.445 3.245 5.225 . 0 0 "[ . 1]" 1
1448 1 49 LEU QD 1 65 VAL HA 2.102 . 2.544 2.083 2.030 2.120 . 0 0 "[ . 1]" 1
1449 1 7 LYS HG2 1 15 SER HB2 3.082 . 6.000 4.108 3.796 4.653 . 0 0 "[ . 1]" 1
1450 1 5 THR HA 1 6 LEU HB2 5.229 2.495 7.963 3.597 3.068 4.083 . 0 0 "[ . 1]" 1
1451 1 22 PRO HB3 1 23 SER HA 4.125 2.424 5.826 5.202 4.915 5.308 . 0 0 "[ . 1]" 1
1452 1 26 ILE HB 1 56 ASP HA 2.567 . 3.226 2.236 1.723 2.379 0.185 2 0 "[ . 1]" 1
1453 1 37 GLU HA 1 37 GLU HB3 2.592 . 3.264 2.344 2.219 2.434 . 0 0 "[ . 1]" 1
1454 1 81 GLU HA 1 81 GLU QG 3.088 2.134 4.042 3.063 2.610 3.343 . 0 0 "[ . 1]" 1
1455 1 45 ILE HG12 1 76 ILE HA 3.104 2.141 4.067 2.906 2.837 2.949 . 0 0 "[ . 1]" 1
1456 1 72 ILE HA 1 72 ILE QG 3.112 2.144 4.080 3.035 2.850 3.306 . 0 0 "[ . 1]" 1
1457 1 1 MET HG2 1 21 SER HA 4.428 2.467 6.389 3.256 2.474 4.106 . 0 0 "[ . 1]" 1
1458 1 68 ALA HA 1 69 ASN HA 4.304 2.452 6.156 4.037 3.938 4.089 . 0 0 "[ . 1]" 1
1459 1 69 ASN HA 1 70 SER QB 4.505 2.475 6.535 4.152 4.071 4.343 . 0 0 "[ . 1]" 1
1460 1 4 LEU HA 1 5 THR HB 4.885 2.499 7.271 3.411 2.886 4.057 . 0 0 "[ . 1]" 1
1461 1 23 SER HA 1 23 SER HB3 2.582 . 3.249 2.131 2.030 2.264 . 0 0 "[ . 1]" 1
1462 1 28 GLN HA 1 28 GLN QG 3.124 2.148 4.100 2.858 2.691 3.009 . 0 0 "[ . 1]" 1
1463 1 45 ILE HA 1 45 ILE MD 3.407 2.246 4.568 3.595 3.530 3.690 . 0 0 "[ . 1]" 1
1464 1 28 GLN HA 1 29 ILE HG13 4.873 2.498 7.248 3.390 3.056 3.800 . 0 0 "[ . 1]" 1
1465 1 27 LEU HB3 1 28 GLN HA 3.824 2.362 5.286 3.207 2.955 3.469 . 0 0 "[ . 1]" 1
1466 1 7 LYS QD 1 15 SER HB3 4.184 2.434 5.934 4.524 3.852 5.106 . 0 0 "[ . 1]" 1
1467 1 26 ILE HB 1 55 HIS HA 4.964 2.500 7.428 4.339 4.274 4.452 . 0 0 "[ . 1]" 1
1468 1 2 VAL HB 1 70 SER QB 4.582 2.483 6.681 5.911 5.664 6.278 . 0 0 "[ . 1]" 1
1469 1 2 VAL QG 1 70 SER QB 3.203 . 6.000 3.456 2.960 3.727 . 0 0 "[ . 1]" 1
1470 1 1 MET HB3 1 21 SER HB3 5.190 2.497 7.883 3.800 2.661 4.762 . 0 0 "[ . 1]" 1
1471 1 17 GLU QB 1 18 HIS HA 4.412 2.466 6.358 4.070 3.954 4.199 . 0 0 "[ . 1]" 1
1472 1 4 LEU HB3 1 4 LEU MD2 2.918 2.067 3.769 1.980 1.889 2.287 0.178 2 0 "[ . 1]" 1
1473 1 56 ASP H 1 56 ASP HB3 3.672 2.323 5.021 3.062 2.911 3.183 . 0 0 "[ . 1]" 1
1474 1 27 LEU HA 1 56 ASP QB 4.803 2.496 7.110 4.083 2.809 4.393 . 0 0 "[ . 1]" 1
1475 1 15 SER HB3 1 17 GLU HG2 4.930 2.500 7.360 4.495 3.963 5.361 . 0 0 "[ . 1]" 1
1476 1 5 THR HB 1 7 LYS HB2 4.651 2.488 6.814 4.361 4.062 4.745 . 0 0 "[ . 1]" 1
1477 1 5 THR HB 1 7 LYS HB3 4.815 2.497 7.133 4.456 3.810 4.657 . 0 0 "[ . 1]" 1
1478 1 49 LEU QD 1 69 ASN HB2 3.385 2.239 4.531 3.494 2.793 4.592 0.061 2 0 "[ . 1]" 1
1479 1 7 LYS HB2 1 7 LYS HG3 2.547 . 3.196 2.304 2.173 2.686 . 0 0 "[ . 1]" 1
1480 1 7 LYS HB2 1 9 ILE MD 4.219 2.439 5.999 4.596 4.357 4.710 . 0 0 "[ . 1]" 1
1481 1 58 LEU HB3 1 58 LEU QD 1.967 . 2.354 2.097 2.039 2.149 . 0 0 "[ . 1]" 1
1482 1 6 LEU HB2 1 74 VAL MG2 2.659 . 3.366 3.002 2.855 3.185 . 0 0 "[ . 1]" 1
1483 1 6 LEU HB3 1 16 ILE HB 5.005 2.500 7.510 4.508 4.245 4.799 . 0 0 "[ . 1]" 1
1484 1 42 ILE HB 1 42 ILE MD 1.836 . 2.173 1.987 1.926 2.020 . 0 0 "[ . 1]" 1
1485 1 25 THR MG 1 57 ASN HB3 4.498 2.475 6.521 4.540 4.068 4.950 . 0 0 "[ . 1]" 1
1486 1 9 ILE HB 1 9 ILE MD 1.773 . 2.087 1.831 1.805 1.845 . 0 0 "[ . 1]" 1
1487 1 27 LEU HB2 1 27 LEU QD 2.500 . 3.125 1.946 1.903 1.980 . 0 0 "[ . 1]" 1
1488 1 49 LEU HB2 1 49 LEU QD 2.451 . 3.052 2.124 2.074 2.165 . 0 0 "[ . 1]" 1
1489 1 4 LEU MD1 1 18 HIS HB3 3.090 2.135 4.045 3.531 2.484 4.092 0.047 3 0 "[ . 1]" 1
1490 1 34 ILE MG 1 41 HIS HB2 4.179 2.433 5.925 4.870 4.286 5.216 . 0 0 "[ . 1]" 1
1491 1 8 LYS QG 1 10 GLN HG3 3.779 2.351 5.207 3.836 3.724 3.942 . 0 0 "[ . 1]" 1
1492 1 26 ILE HB 1 47 LEU HB3 4.215 2.438 5.992 4.119 3.709 4.297 . 0 0 "[ . 1]" 1
1493 1 77 LYS QB 1 77 LYS QG 2.436 . 2.817 2.005 1.956 2.081 . 0 0 "[ . 1]" 1
1494 1 74 VAL MG2 1 75 MET HB3 3.795 2.355 5.235 3.945 3.787 4.463 . 0 0 "[ . 1]" 1
1495 1 26 ILE HG12 1 56 ASP HB2 4.980 2.500 7.460 4.832 3.000 5.105 . 0 0 "[ . 1]" 1
1496 1 27 LEU HB3 1 56 ASP HB3 3.896 2.378 5.414 3.949 3.811 4.119 . 0 0 "[ . 1]" 1
1497 1 52 LYS QE 1 54 LEU HG 3.625 2.311 4.939 4.995 4.571 5.459 0.520 5 1 "[ + 1]" 1
1498 1 21 SER HA 1 60 LEU QD 3.614 2.308 4.920 4.167 3.994 4.437 . 0 0 "[ . 1]" 1
1499 1 27 LEU QD 1 31 GLN HB2 3.506 2.277 4.735 3.742 2.865 4.019 . 0 0 "[ . 1]" 1
1500 1 33 LEU HG 1 34 ILE HG13 2.381 . 6.000 4.095 3.970 4.359 . 0 0 "[ . 1]" 1
1501 1 33 LEU QD 1 39 ALA HA 3.350 . 6.000 4.091 3.955 4.210 . 0 0 "[ . 1]" 1
1502 1 32 HIS H 1 33 LEU QD 4.795 2.496 7.094 4.134 4.033 4.349 . 0 0 "[ . 1]" 1
1503 1 18 HIS HE1 1 33 LEU QD 4.827 2.497 7.157 5.792 3.701 6.686 . 0 0 "[ . 1]" 1
1504 1 18 HIS HA 1 18 HIS HB3 2.610 . 3.291 2.100 2.061 2.131 . 0 0 "[ . 1]" 1
1505 1 64 LYS H 1 65 VAL HB 4.718 2.492 6.944 5.297 4.822 5.838 . 0 0 "[ . 1]" 1
1506 1 46 LYS QB 1 75 MET QG 3.536 2.286 4.786 3.592 3.245 3.906 . 0 0 "[ . 1]" 1
1507 1 9 ILE QG 1 75 MET QG 3.685 . 6.000 3.866 2.937 4.499 . 0 0 "[ . 1]" 1
1508 1 7 LYS QE 1 7 LYS HG3 1.981 . 6.000 2.288 1.844 2.879 . 0 0 "[ . 1]" 1
1509 1 50 LYS QE 1 50 LYS QG 2.461 . 3.067 2.405 2.267 2.687 . 0 0 "[ . 1]" 1
1510 1 69 ASN HB3 1 70 SER QB 5.579 2.467 8.691 4.002 3.486 5.299 . 0 0 "[ . 1]" 1
1511 1 13 LYS QB 1 13 LYS HG2 2.639 . 3.336 2.094 2.030 2.177 . 0 0 "[ . 1]" 1
1512 1 8 LYS HB3 1 13 LYS QB 3.752 2.344 5.160 3.891 3.570 4.120 . 0 0 "[ . 1]" 1
1513 1 76 ILE H 1 76 ILE MD 3.442 2.257 4.627 3.931 3.848 4.018 . 0 0 "[ . 1]" 1
1514 1 27 LEU HG 1 28 GLN QE 4.412 2.465 6.359 4.061 3.714 4.415 . 0 0 "[ . 1]" 1
1515 1 15 SER HA 1 16 ILE HG12 4.877 2.498 7.256 3.839 3.577 4.011 . 0 0 "[ . 1]" 1
1516 1 29 ILE H 1 47 LEU HG 4.152 2.428 5.876 5.094 4.783 5.388 . 0 0 "[ . 1]" 1
1517 1 25 THR HA 1 60 LEU HG 3.564 2.294 4.834 3.400 3.065 3.562 . 0 0 "[ . 1]" 1
1518 1 62 ASP H 1 63 LEU HG 4.030 2.406 5.654 3.491 3.392 3.589 . 0 0 "[ . 1]" 1
1519 1 40 SER H 1 45 ILE HG12 4.630 2.486 6.774 4.068 3.788 4.197 . 0 0 "[ . 1]" 1
1520 1 52 LYS HA 1 52 LYS HG2 2.769 2.002 3.536 2.368 2.258 2.441 . 0 0 "[ . 1]" 1
1521 1 64 LYS HE2 1 64 LYS QG 2.446 . 3.044 2.232 2.063 2.947 . 0 0 "[ . 1]" 1
1522 1 63 LEU HA 1 63 LEU QD 2.497 . 3.121 3.184 3.123 3.285 0.164 7 0 "[ . 1]" 1
1523 1 6 LEU HA 1 72 ILE HG13 5.024 2.500 7.548 4.216 3.829 4.432 . 0 0 "[ . 1]" 1
1524 1 2 VAL HB 1 2 VAL QG 1.784 . 2.102 1.688 1.684 1.692 . 0 0 "[ . 1]" 1
1525 1 6 LEU HB2 1 16 ILE MG 3.366 2.233 4.499 4.293 4.040 4.692 0.193 2 0 "[ . 1]" 1
1526 1 26 ILE HG12 1 26 ILE MG 2.449 . 3.049 3.069 2.955 3.127 0.078 2 0 "[ . 1]" 1
1527 1 52 LYS QD 1 54 LEU QD 1.883 . 2.238 2.084 2.063 2.132 . 0 0 "[ . 1]" 1
1528 1 27 LEU QD 1 27 LEU HG 1.566 . 1.811 1.683 1.679 1.685 . 0 0 "[ . 1]" 1
1529 1 9 ILE MD 1 9 ILE QG 1.783 . 2.101 1.801 1.739 1.820 . 0 0 "[ . 1]" 1
1530 1 9 ILE MG 1 13 LYS QD 2.766 2.001 3.531 2.952 1.947 3.887 0.356 8 0 "[ . 1]" 1
1531 1 55 HIS HA 1 58 LEU HB3 4.203 2.437 5.969 5.024 4.719 5.227 . 0 0 "[ . 1]" 1
1532 1 25 THR MG 1 59 PHE HB2 5.065 2.499 7.631 4.183 3.903 4.476 . 0 0 "[ . 1]" 1
1533 1 46 LYS QB 1 46 LYS QE 1.694 . 1.981 1.875 1.735 2.077 0.096 5 0 "[ . 1]" 1
1534 1 46 LYS QE 1 53 VAL QG 2.305 . 2.836 3.556 2.766 4.428 1.592 5 8 "[ **+***-*]" 1
1535 1 77 LYS QB 1 77 LYS QE 1.653 . 1.926 2.012 1.862 2.312 0.386 8 0 "[ . 1]" 1
1536 1 77 LYS QE 1 77 LYS QG 2.421 . 3.007 2.311 2.185 2.400 . 0 0 "[ . 1]" 1
1537 1 13 LYS QE 1 13 LYS QG 2.069 . 2.497 2.676 2.312 2.931 0.434 1 0 "[ . 1]" 1
1538 1 14 PHE HA 1 14 PHE HB2 3.491 2.273 4.709 2.306 2.250 2.390 0.023 10 0 "[ . 1]" 1
1539 1 41 HIS HA 1 45 ILE HG12 4.258 2.445 6.071 5.368 5.218 5.671 . 0 0 "[ . 1]" 1
1540 1 30 LYS HA 1 45 ILE HB 4.001 2.401 5.601 3.870 3.601 4.066 . 0 0 "[ . 1]" 1
1541 1 75 MET HA 1 76 ILE HB 4.666 2.489 6.843 4.192 4.095 4.258 . 0 0 "[ . 1]" 1
1542 1 26 ILE HB 1 27 LEU HB2 3.899 2.379 5.419 3.582 3.378 3.793 . 0 0 "[ . 1]" 1
1543 1 50 LYS QB 1 71 THR MG 3.351 . 6.000 4.648 4.470 5.268 . 0 0 "[ . 1]" 1
1544 1 52 LYS QE 1 54 LEU HA 3.003 2.101 3.905 3.684 2.356 4.484 0.579 5 1 "[ + 1]" 1
1545 1 12 PRO HB3 1 13 LYS H 3.974 2.395 5.553 3.651 3.459 3.858 . 0 0 "[ . 1]" 1
1546 1 13 LYS H 1 13 LYS QB 3.609 2.306 4.912 2.588 2.130 2.863 0.176 8 0 "[ . 1]" 1
1547 1 13 LYS H 1 13 LYS QG 2.583 . 3.250 2.240 1.698 3.282 0.218 3 0 "[ . 1]" 1
1548 1 5 THR MG 1 7 LYS H 3.604 2.305 4.903 3.473 3.316 3.862 . 0 0 "[ . 1]" 1
1549 1 6 LEU QD 1 7 LYS H 2.634 . 3.328 2.417 2.259 2.574 . 0 0 "[ . 1]" 1
1550 1 7 LYS HB2 1 8 LYS H 4.141 2.426 5.856 3.815 3.735 3.924 . 0 0 "[ . 1]" 1
1551 1 7 LYS HG2 1 8 LYS H 3.245 2.192 4.298 3.448 3.132 3.859 . 0 0 "[ . 1]" 1
1552 1 7 LYS HG3 1 8 LYS H 3.919 2.383 5.455 3.712 3.490 4.051 . 0 0 "[ . 1]" 1
1553 1 8 LYS H 1 9 ILE MD 3.630 2.313 4.947 3.647 3.399 3.861 . 0 0 "[ . 1]" 1
1554 1 7 LYS HB3 1 73 THR H 4.149 2.428 5.870 4.550 4.230 4.789 . 0 0 "[ . 1]" 1
1555 1 4 LEU H 1 4 LEU HA 3.114 2.144 4.084 2.655 2.530 2.795 . 0 0 "[ . 1]" 1
1556 1 4 LEU HB2 1 5 THR H 3.066 2.126 4.006 3.812 3.684 4.167 0.161 5 0 "[ . 1]" 1
1557 1 2 VAL QG 1 5 THR H 3.644 2.316 4.972 4.150 3.351 4.387 . 0 0 "[ . 1]" 1
1558 1 9 ILE HB 1 10 GLN H 2.194 . 2.675 2.117 1.922 2.288 . 0 0 "[ . 1]" 1
1559 1 6 LEU H 1 16 ILE HB 4.359 2.459 6.259 4.339 4.039 4.567 . 0 0 "[ . 1]" 1
1560 1 6 LEU H 1 16 ILE MD 4.345 2.457 6.233 4.499 4.364 4.783 . 0 0 "[ . 1]" 1
1561 1 26 ILE HB 1 58 LEU H 3.326 2.220 4.432 3.437 3.259 3.620 . 0 0 "[ . 1]" 1
1562 1 26 ILE H 1 58 LEU H 3.655 2.319 4.991 3.515 3.345 3.922 . 0 0 "[ . 1]" 1
1563 1 13 LYS QG 1 14 PHE H 3.902 2.379 5.425 3.914 3.174 4.395 . 0 0 "[ . 1]" 1
1564 1 6 LEU HA 1 16 ILE H 3.731 2.339 5.123 3.861 3.734 4.060 . 0 0 "[ . 1]" 1
1565 1 6 LEU QD 1 16 ILE H 4.503 2.475 6.531 4.039 3.884 4.294 . 0 0 "[ . 1]" 1
1566 1 25 THR MG 1 60 LEU H 3.540 2.287 4.793 2.903 2.605 3.187 . 0 0 "[ . 1]" 1
1567 1 4 LEU HA 1 18 HIS H 4.063 2.412 5.714 4.329 4.171 4.402 . 0 0 "[ . 1]" 1
1568 1 4 LEU HB2 1 20 PHE H 4.600 2.484 6.716 4.274 3.976 4.482 . 0 0 "[ . 1]" 1
1569 1 17 GLU QB 1 18 HIS H 3.145 2.156 4.134 3.188 2.736 3.456 . 0 0 "[ . 1]" 1
1570 1 4 LEU HB2 1 18 HIS H 3.861 2.370 5.352 4.057 3.848 4.375 . 0 0 "[ . 1]" 1
1571 1 4 LEU MD1 1 18 HIS H 3.957 2.391 5.523 3.152 2.736 3.476 . 0 0 "[ . 1]" 1
1572 1 56 ASP H 1 56 ASP QB 2.600 . 3.276 2.475 2.288 2.828 . 0 0 "[ . 1]" 1
1573 1 26 ILE MG 1 56 ASP H 3.638 2.315 4.961 4.537 3.858 4.864 . 0 0 "[ . 1]" 1
1574 1 26 ILE HG12 1 56 ASP H 4.825 2.497 7.153 4.564 4.392 4.943 . 0 0 "[ . 1]" 1
1575 1 59 PHE H 1 59 PHE HB3 3.027 2.111 3.943 2.357 2.133 2.552 . 0 0 "[ . 1]" 1
1576 1 26 ILE HG12 1 59 PHE H 3.216 2.182 4.250 3.949 3.849 4.016 . 0 0 "[ . 1]" 1
1577 1 48 LEU HB3 1 49 LEU H 3.416 2.249 4.583 3.235 2.973 3.693 . 0 0 "[ . 1]" 1
1578 1 49 LEU H 1 49 LEU QD 3.219 2.183 4.255 3.723 3.245 3.852 . 0 0 "[ . 1]" 1
1579 1 48 LEU QD 1 49 LEU H 2.692 . 3.417 2.412 1.900 2.896 0.067 9 0 "[ . 1]" 1
1580 1 47 LEU HB3 1 48 LEU H 3.870 2.372 5.368 3.206 2.977 3.435 . 0 0 "[ . 1]" 1
1581 1 47 LEU QD 1 48 LEU H 2.572 . 3.234 2.927 2.699 3.089 . 0 0 "[ . 1]" 1
1582 1 47 LEU H 1 48 LEU H 4.300 2.451 6.149 3.935 3.742 3.976 . 0 0 "[ . 1]" 1
1583 1 48 LEU HB3 1 51 GLY H 4.071 2.414 5.728 3.061 2.405 3.555 0.009 10 0 "[ . 1]" 1
1584 1 48 LEU QD 1 51 GLY H 4.237 2.442 6.032 3.298 1.932 4.140 0.510 1 1 "[+ . 1]" 1
1585 1 28 GLN HA 1 29 ILE H 2.917 2.066 3.768 2.710 2.693 2.729 . 0 0 "[ . 1]" 1
1586 1 29 ILE H 1 29 ILE HA 3.103 2.140 4.066 2.463 2.451 2.485 . 0 0 "[ . 1]" 1
1587 1 29 ILE H 1 29 ILE HB 2.317 . 2.854 2.252 2.079 2.368 . 0 0 "[ . 1]" 1
1588 1 48 LEU HB2 1 52 LYS H 3.449 2.260 4.638 4.478 4.374 4.545 . 0 0 "[ . 1]" 1
1589 1 29 ILE H 1 29 ILE MG 3.154 2.159 4.149 3.677 3.655 3.717 . 0 0 "[ . 1]" 1
1590 1 28 GLN QG 1 29 ILE H 4.217 2.439 5.995 3.962 3.521 4.428 . 0 0 "[ . 1]" 1
1591 1 18 HIS H 1 19 ASP H 4.327 2.455 6.199 3.915 3.874 3.964 . 0 0 "[ . 1]" 1
1592 1 21 SER HB2 1 23 SER H 2.668 . 3.380 2.555 2.390 2.885 . 0 0 "[ . 1]" 1
1593 1 21 SER HB3 1 24 ASP H 4.016 2.403 5.629 3.786 2.995 4.338 . 0 0 "[ . 1]" 1
1594 1 26 ILE H 1 56 ASP HA 4.723 2.492 6.954 4.457 3.829 4.634 . 0 0 "[ . 1]" 1
1595 1 25 THR MG 1 26 ILE H 3.401 2.244 4.558 2.551 2.005 3.145 0.239 6 0 "[ . 1]" 1
1596 1 30 LYS H 1 42 ILE MD 3.663 2.321 5.005 3.690 3.474 3.821 . 0 0 "[ . 1]" 1
1597 1 30 LYS QB 1 31 GLN H 3.221 2.184 4.258 2.437 2.349 2.492 . 0 0 "[ . 1]" 1
1598 1 30 LYS HA 1 33 LEU H 3.588 2.300 4.876 3.360 3.255 3.506 . 0 0 "[ . 1]" 1
1599 1 32 HIS HB3 1 33 LEU H 2.996 2.099 3.893 2.442 2.382 2.502 . 0 0 "[ . 1]" 1
1600 1 35 SER HA 1 36 GLU H 2.781 2.008 3.554 2.773 2.762 2.787 . 0 0 "[ . 1]" 1
1601 1 35 SER HA 1 37 GLU H 2.907 2.062 3.752 2.943 2.893 2.998 . 0 0 "[ . 1]" 1
1602 1 37 GLU H 1 37 GLU HA 2.323 . 2.863 2.189 2.170 2.203 . 0 0 "[ . 1]" 1
1603 1 36 GLU HB3 1 37 GLU H 2.866 2.045 3.687 2.874 2.533 3.357 . 0 0 "[ . 1]" 1
1604 1 33 LEU HA 1 37 GLU H 4.331 2.455 6.207 4.044 3.752 4.615 . 0 0 "[ . 1]" 1
1605 1 26 ILE HG12 1 57 ASN H 4.058 2.412 5.704 4.178 4.068 4.392 . 0 0 "[ . 1]" 1
1606 1 25 THR MG 1 57 ASN H 3.963 2.392 5.534 4.530 4.227 4.972 . 0 0 "[ . 1]" 1
1607 1 36 GLU QG 1 37 GLU H 4.465 2.471 6.459 4.132 3.927 4.250 . 0 0 "[ . 1]" 1
1608 1 36 GLU HB2 1 37 GLU H 3.014 2.105 3.923 3.156 2.956 3.874 . 0 0 "[ . 1]" 1
1609 1 33 LEU HB3 1 38 LYS H 3.333 2.222 4.444 4.170 3.714 4.593 0.149 3 0 "[ . 1]" 1
1610 1 33 LEU HB3 1 40 SER H 5.226 2.495 7.957 5.756 5.181 6.153 . 0 0 "[ . 1]" 1
1611 1 45 ILE HB 1 46 LYS H 3.330 2.221 4.439 2.724 2.581 3.128 . 0 0 "[ . 1]" 1
1612 1 46 LYS H 1 46 LYS QB 2.698 . 3.426 2.666 2.449 3.015 . 0 0 "[ . 1]" 1
1613 1 56 ASP QB 1 57 ASN H 2.747 . 3.502 2.494 2.282 3.209 . 0 0 "[ . 1]" 1
1614 1 59 PHE HA 1 61 SER H 4.357 2.459 6.255 3.999 3.859 4.089 . 0 0 "[ . 1]" 1
1615 1 47 LEU HB3 1 54 LEU H 3.705 2.332 5.078 3.344 3.031 3.536 . 0 0 "[ . 1]" 1
1616 1 46 LYS QB 1 54 LEU H 4.163 2.430 5.896 4.731 4.370 5.289 . 0 0 "[ . 1]" 1
1617 1 8 LYS QD 1 10 GLN H 3.665 2.322 5.008 2.999 2.592 3.279 . 0 0 "[ . 1]" 1
1618 1 9 ILE MD 1 10 GLN H 2.922 2.068 3.776 3.103 2.817 3.578 . 0 0 "[ . 1]" 1
1619 1 49 LEU HG 1 50 LYS H 3.810 2.358 5.262 3.572 3.256 3.700 . 0 0 "[ . 1]" 1
1620 1 48 LEU QD 1 50 LYS H 4.463 2.471 6.455 4.308 3.448 4.781 . 0 0 "[ . 1]" 1
1621 1 63 LEU HB2 1 65 VAL H 2.710 . 6.000 4.113 3.696 4.423 . 0 0 "[ . 1]" 1
1622 1 79 ASN QB 1 80 LEU H 2.829 . 6.000 3.351 2.579 3.929 . 0 0 "[ . 1]" 1
1623 1 80 LEU H 1 80 LEU QD 3.166 2.164 4.168 3.165 2.905 3.419 . 0 0 "[ . 1]" 1
1624 1 59 PHE H 1 63 LEU H 4.260 2.446 6.074 3.758 3.638 3.876 . 0 0 "[ . 1]" 1
1625 1 2 VAL H 1 3 HIS H 4.723 2.492 6.954 3.952 3.889 3.996 . 0 0 "[ . 1]" 1
1626 1 6 LEU HA 1 74 VAL H 4.187 2.434 5.940 4.303 4.118 4.457 . 0 0 "[ . 1]" 1
1627 1 7 LYS HB3 1 74 VAL H 3.989 2.398 5.580 3.339 3.222 3.480 . 0 0 "[ . 1]" 1
1628 1 52 LYS HB3 1 53 VAL H 4.153 2.428 5.878 3.848 3.245 4.104 . 0 0 "[ . 1]" 1
1629 1 3 HIS H 1 3 HIS HA 3.418 2.250 4.586 2.596 2.587 2.608 . 0 0 "[ . 1]" 1
1630 1 11 ALA H 1 13 LYS QG 3.972 2.394 5.550 4.869 3.637 6.450 0.900 8 1 "[ . + 1]" 1
1631 1 81 GLU H 1 81 GLU QG 2.460 . 3.065 1.997 1.588 2.784 0.267 10 0 "[ . 1]" 1
1632 1 80 LEU QB 1 81 GLU H 2.560 . 3.215 3.050 2.305 3.687 0.472 10 0 "[ . 1]" 1
1633 1 8 LYS QD 1 10 GLN H 3.644 2.316 4.972 3.853 3.452 4.501 . 0 0 "[ . 1]" 1
1634 1 34 ILE H 1 34 ILE MG 2.714 . 3.451 2.584 2.468 2.701 . 0 0 "[ . 1]" 1
1635 1 67 PRO HA 1 69 ASN H 2.792 2.012 3.572 2.947 2.871 3.025 . 0 0 "[ . 1]" 1
1636 1 44 GLU H 1 45 ILE HB 4.258 2.445 6.071 4.219 4.048 4.475 . 0 0 "[ . 1]" 1
1637 1 42 ILE MG 1 44 GLU H 3.783 2.352 5.214 3.982 3.749 4.229 . 0 0 "[ . 1]" 1
1638 1 29 ILE MG 1 34 ILE H 4.355 2.458 6.252 4.862 4.628 4.942 . 0 0 "[ . 1]" 1
1639 1 26 ILE HB 1 30 LYS H 4.756 2.494 7.018 4.540 4.388 5.082 . 0 0 "[ . 1]" 1
1640 1 4 LEU H 1 4 LEU HB2 3.419 2.250 4.588 2.532 2.450 2.591 . 0 0 "[ . 1]" 1
1641 1 2 VAL QG 1 4 LEU H 3.346 2.227 4.465 2.868 2.596 3.502 . 0 0 "[ . 1]" 1
1642 1 7 LYS QD 1 9 ILE H 3.630 2.313 4.947 3.060 2.687 3.335 . 0 0 "[ . 1]" 1
1643 1 8 LYS QG 1 9 ILE H 2.811 2.021 3.601 2.217 1.988 2.609 0.033 10 0 "[ . 1]" 1
1644 1 21 SER HA 1 23 SER H 4.004 2.401 5.607 3.750 3.603 3.919 . 0 0 "[ . 1]" 1
1645 1 22 PRO HB3 1 23 SER H 3.006 2.102 3.910 3.796 3.698 3.895 . 0 0 "[ . 1]" 1
1646 1 20 PHE QD 1 25 THR H 5.467 2.478 8.456 4.396 4.032 5.008 . 0 0 "[ . 1]" 1
1647 1 24 ASP HB2 1 25 THR H 3.028 2.111 3.945 2.572 2.228 2.928 . 0 0 "[ . 1]" 1
1648 1 25 THR MG 1 27 LEU H 3.448 2.259 4.637 2.936 1.781 3.807 0.478 5 0 "[ . 1]" 1
1649 1 27 LEU H 1 29 ILE H 4.039 2.407 5.671 3.962 3.842 4.087 . 0 0 "[ . 1]" 1
1650 1 27 LEU HB3 1 31 GLN H 4.878 2.499 7.257 4.492 4.309 4.799 . 0 0 "[ . 1]" 1
1651 1 27 LEU QD 1 31 GLN H 3.161 2.162 4.160 3.297 2.916 3.476 . 0 0 "[ . 1]" 1
1652 1 30 LYS HA 1 31 GLN H 2.792 2.013 3.571 2.715 2.696 2.750 . 0 0 "[ . 1]" 1
1653 1 30 LYS HA 1 32 HIS H 3.410 2.247 4.573 3.366 3.329 3.398 . 0 0 "[ . 1]" 1
1654 1 33 LEU H 1 34 ILE HG12 4.899 2.499 7.299 4.897 4.678 5.115 . 0 0 "[ . 1]" 1
1655 1 33 LEU H 1 33 LEU HB3 3.230 2.187 4.273 2.778 2.653 2.993 . 0 0 "[ . 1]" 1
1656 1 6 LEU QD 1 33 LEU H 3.296 2.210 4.382 4.104 3.995 4.253 . 0 0 "[ . 1]" 1
1657 1 34 ILE HG12 1 35 SER H 4.199 2.436 5.962 4.334 4.215 4.474 . 0 0 "[ . 1]" 1
1658 1 32 HIS H 1 35 SER H 3.827 2.363 5.291 3.857 3.741 4.020 . 0 0 "[ . 1]" 1
1659 1 34 ILE MG 1 39 ALA H 3.022 2.109 3.935 3.669 3.441 3.856 . 0 0 "[ . 1]" 1
1660 1 34 ILE HA 1 39 ALA H 2.544 . 3.191 2.470 2.346 2.581 . 0 0 "[ . 1]" 1
1661 1 26 ILE MG 1 55 HIS H 3.218 2.182 4.254 3.502 3.406 3.609 . 0 0 "[ . 1]" 1
1662 1 26 ILE HB 1 55 HIS H 5.149 2.498 7.800 4.772 4.488 5.493 . 0 0 "[ . 1]" 1
1663 1 24 ASP H 1 60 LEU H 4.268 2.447 6.089 3.522 3.439 3.632 . 0 0 "[ . 1]" 1
1664 1 66 THR H 1 69 ASN HB3 3.841 2.365 5.317 4.552 3.158 5.032 . 0 0 "[ . 1]" 1
1665 1 66 THR H 1 69 ASN HB2 2.902 2.060 3.744 3.695 3.368 4.109 0.365 2 0 "[ . 1]" 1
1666 1 49 LEU QD 1 66 THR H 2.570 . 3.231 2.587 2.281 2.786 . 0 0 "[ . 1]" 1
1667 1 65 VAL HA 1 66 THR H 2.207 . 2.694 2.097 2.083 2.120 . 0 0 "[ . 1]" 1
1668 1 66 THR H 1 69 ASN HA 5.207 2.495 7.919 4.904 4.652 5.047 . 0 0 "[ . 1]" 1
1669 1 66 THR H 1 70 SER H 5.076 2.500 7.652 4.004 3.718 5.053 . 0 0 "[ . 1]" 1
1670 1 67 PRO HA 1 70 SER H 3.480 2.269 4.691 3.138 2.358 3.297 . 0 0 "[ . 1]" 1
1671 1 49 LEU QD 1 70 SER H 3.378 2.237 4.519 3.133 2.640 4.333 . 0 0 "[ . 1]" 1
1672 1 10 GLN QB 1 10 GLN HE22 3.870 2.372 5.368 3.960 3.609 4.074 . 0 0 "[ . 1]" 1
1673 1 9 ILE MD 1 10 GLN HE22 4.418 2.467 6.369 5.817 4.859 6.345 . 0 0 "[ . 1]" 1
1674 1 10 GLN QB 1 10 GLN HE21 2.826 2.028 3.624 3.513 2.732 3.749 0.125 2 0 "[ . 1]" 1
1675 1 9 ILE MD 1 10 GLN HE21 3.819 2.360 5.278 5.150 4.669 5.828 0.550 5 1 "[ + 1]" 1
1676 1 63 LEU QD 1 64 LYS H 3.605 2.305 4.905 2.872 2.730 3.082 . 0 0 "[ . 1]" 1
1677 1 28 GLN HB2 1 28 GLN QE 3.849 2.439 5.330 2.139 2.104 2.168 0.335 8 0 "[ . 1]" 1
1678 1 27 LEU HB3 1 28 GLN QE 4.791 2.496 7.086 3.045 2.060 4.099 0.436 3 0 "[ . 1]" 1
1679 1 27 LEU HG 1 31 GLN QE 4.270 2.447 5.242 4.708 4.119 5.669 0.427 8 0 "[ . 1]" 1
1680 1 27 LEU QD 1 31 GLN QE 2.799 2.015 3.583 2.877 2.606 3.737 0.154 8 0 "[ . 1]" 1
1681 1 27 LEU HB2 1 31 GLN QE 4.708 2.491 6.925 5.067 4.707 5.603 . 0 0 "[ . 1]" 1
1682 1 27 LEU HA 1 31 GLN QE 4.474 2.472 6.476 3.935 3.341 4.134 . 0 0 "[ . 1]" 1
1683 1 49 LEU HG 1 69 ASN QD 3.302 2.212 4.392 3.379 2.264 4.255 . 0 0 "[ . 1]" 1
1684 1 66 THR H 1 69 ASN QD 5.064 2.499 7.629 3.939 3.602 5.267 . 0 0 "[ . 1]" 1
1685 1 79 ASN QB 1 79 ASN QD 2.962 2.085 3.839 2.309 2.078 2.662 0.007 9 0 "[ . 1]" 1
1686 1 44 GLU QG 1 79 ASN QD 6.191 2.499 7.299 2.490 1.987 3.273 0.512 10 1 "[ . +]" 1
1687 1 77 LYS QB 1 79 ASN QD 4.997 2.500 7.494 3.862 3.192 4.549 . 0 0 "[ . 1]" 1
1688 1 27 LEU QD 1 57 ASN HD22 4.269 2.447 6.091 4.889 3.714 5.604 . 0 0 "[ . 1]" 1
1689 1 27 LEU QD 1 57 ASN HD21 4.321 2.454 6.188 4.117 3.002 5.100 . 0 0 "[ . 1]" 1
1690 1 4 LEU H 1 18 HIS H 3.685 2.327 5.043 3.098 2.771 3.280 . 0 0 "[ . 1]" 1
1691 1 45 ILE H 1 45 ILE MD 3.262 2.198 4.326 3.403 3.367 3.455 . 0 0 "[ . 1]" 1
1692 1 50 LYS H 1 71 THR HB 4.935 2.499 7.371 4.535 3.794 5.049 . 0 0 "[ . 1]" 1
1693 1 62 ASP H 1 64 LYS H 3.523 2.282 4.764 3.077 3.002 3.186 . 0 0 "[ . 1]" 1
1694 1 69 ASN HA 1 71 THR H 2.896 2.057 3.735 2.816 2.616 2.873 . 0 0 "[ . 1]" 1
1695 1 4 LEU HG 1 72 ILE H 4.158 2.429 5.887 4.495 4.294 4.794 . 0 0 "[ . 1]" 1
1696 1 6 LEU QD 1 72 ILE H 3.482 2.270 4.694 3.271 3.129 3.549 . 0 0 "[ . 1]" 1
1697 1 5 THR HB 1 72 ILE H 4.099 2.419 5.779 3.227 2.954 3.387 . 0 0 "[ . 1]" 1
1698 1 47 LEU QD 1 75 MET H 2.721 . 3.461 2.891 2.638 3.107 . 0 0 "[ . 1]" 1
1699 1 10 GLN HG3 1 76 ILE H 4.325 2.454 6.196 3.845 3.345 4.283 . 0 0 "[ . 1]" 1
1700 1 76 ILE H 1 76 ILE MD 3.071 2.128 4.014 3.607 3.520 3.662 . 0 0 "[ . 1]" 1
1701 1 40 SER H 1 77 LYS H 4.579 2.483 6.675 4.592 4.404 4.747 . 0 0 "[ . 1]" 1
1702 1 44 GLU QG 1 77 LYS H 4.917 2.499 7.335 3.884 2.837 4.491 . 0 0 "[ . 1]" 1
1703 1 45 ILE HG12 1 77 LYS H 3.062 2.124 4.000 2.501 2.410 2.624 . 0 0 "[ . 1]" 1
1704 1 79 ASN H 1 80 LEU HB3 4.612 2.485 6.739 3.803 3.139 4.858 . 0 0 "[ . 1]" 1
1705 1 79 ASN H 1 79 ASN QB 2.461 . 3.067 2.525 2.105 2.902 . 0 0 "[ . 1]" 1
1706 1 76 ILE MG 1 79 ASN H 4.760 2.494 7.026 4.343 4.034 5.175 . 0 0 "[ . 1]" 1
1707 1 41 HIS H 1 42 ILE H 5.420 2.482 8.358 3.778 3.700 3.850 . 0 0 "[ . 1]" 1
1708 1 46 LYS QB 1 47 LEU H 3.527 2.283 4.771 3.249 2.906 3.348 . 0 0 "[ . 1]" 1
1709 2 15 VAL HA 2 15 VAL QG 2.412 . 2.994 2.278 2.175 2.377 . 0 0 "[ . 1]" 1
1710 3 15 VAL HA 3 15 VAL QG 2.412 . 2.994 2.283 2.205 2.323 . 0 0 "[ . 1]" 1
1711 2 15 VAL H 2 15 VAL HB 3.154 2.159 4.149 3.639 3.628 3.659 . 0 0 "[ . 1]" 1
1712 3 15 VAL H 3 15 VAL HB 3.154 2.159 4.149 3.646 3.622 3.675 . 0 0 "[ . 1]" 1
1713 2 16 ASN HA 2 16 ASN HB2 3.177 2.168 4.186 2.397 2.301 2.532 . 0 0 "[ . 1]" 1
1714 3 16 ASN HA 3 16 ASN HB2 3.177 2.168 4.186 2.362 2.267 2.503 . 0 0 "[ . 1]" 1
1715 2 18 PHE HB2 2 18 PHE QD 3.997 2.399 5.595 2.635 2.487 2.761 . 0 0 "[ . 1]" 1
1716 3 18 PHE HB2 3 18 PHE QD 3.997 2.399 5.595 2.647 2.584 2.738 . 0 0 "[ . 1]" 1
1717 2 18 PHE HB3 2 18 PHE QD 3.909 2.381 5.437 2.554 2.367 2.695 0.014 8 0 "[ . 1]" 1
1718 3 18 PHE HB3 3 18 PHE QD 3.909 2.381 5.437 2.562 2.440 2.628 . 0 0 "[ . 1]" 1
1719 2 18 PHE H 2 18 PHE HB3 4.661 2.489 6.833 3.572 3.531 3.606 . 0 0 "[ . 1]" 1
1720 3 18 PHE H 3 18 PHE HB3 4.661 2.489 6.833 3.564 3.518 3.600 . 0 0 "[ . 1]" 1
1721 2 18 PHE HB2 2 39 MET ME 4.343 2.457 6.229 2.593 2.102 3.737 0.355 2 0 "[ . 1]" 1
1722 3 18 PHE HB2 3 39 MET ME 4.343 2.457 6.229 3.129 2.319 3.848 0.138 10 0 "[ . 1]" 1
1723 2 19 SER H 2 19 SER QB . 2.168 3.022 2.575 2.412 2.693 . 0 0 "[ . 1]" 1
1724 3 19 SER H 3 19 SER QB . 2.168 3.022 2.598 2.450 2.782 . 0 0 "[ . 1]" 1
1725 2 21 ILE HA 2 21 ILE QG 3.037 2.115 3.902 2.871 2.730 2.999 . 0 0 "[ . 1]" 1
1726 3 21 ILE HA 3 21 ILE QG 3.037 2.115 3.902 2.840 2.556 2.958 . 0 0 "[ . 1]" 1
1727 2 22 VAL HA 2 22 VAL HB 2.776 2.005 3.547 2.439 2.380 2.499 . 0 0 "[ . 1]" 1
1728 3 22 VAL HA 3 22 VAL HB 2.776 2.005 3.547 2.423 2.364 2.475 . 0 0 "[ . 1]" 1
1729 2 22 VAL H 2 22 VAL QG . . 2.383 1.904 1.838 1.986 0.087 10 0 "[ . 1]" 1
1730 3 22 VAL H 3 22 VAL QG . . 2.383 1.911 1.857 1.975 0.068 7 0 "[ . 1]" 1
1731 2 23 GLU H 2 23 GLU HB3 2.692 . 3.417 2.685 2.187 3.165 . 0 0 "[ . 1]" 1
1732 3 23 GLU H 3 23 GLU HB3 2.692 . 3.417 2.577 2.108 2.982 . 0 0 "[ . 1]" 1
1733 2 23 GLU H 2 23 GLU HG2 4.140 2.426 5.854 4.429 4.219 4.620 . 0 0 "[ . 1]" 1
1734 3 23 GLU H 3 23 GLU HG2 4.140 2.426 5.854 4.416 4.067 4.638 . 0 0 "[ . 1]" 1
1735 2 23 GLU H 2 23 GLU HG3 3.469 2.265 4.673 4.540 4.427 4.626 . 0 0 "[ . 1]" 1
1736 3 23 GLU H 3 23 GLU HG3 3.469 2.265 4.673 4.541 4.471 4.597 . 0 0 "[ . 1]" 1
1737 2 24 LYS HA 2 24 LYS HG3 2.870 2.047 3.693 3.094 2.258 3.737 0.044 4 0 "[ . 1]" 1
1738 3 24 LYS HA 3 24 LYS QG . 2.047 2.812 2.418 2.279 2.546 . 0 0 "[ . 1]" 1
1739 2 24 LYS H 2 24 LYS HB3 3.958 2.392 5.524 3.604 3.533 3.720 . 0 0 "[ . 1]" 1
1740 3 24 LYS H 3 24 LYS HB3 3.958 2.392 5.524 3.519 2.794 3.667 . 0 0 "[ . 1]" 1
1741 2 24 LYS H 2 24 LYS HB2 2.724 . 3.466 2.375 2.249 2.556 . 0 0 "[ . 1]" 1
1742 3 24 LYS H 3 24 LYS HB2 2.724 . 3.466 2.440 2.260 2.602 . 0 0 "[ . 1]" 1
1743 2 24 LYS HE2 2 24 LYS HG2 3.404 2.245 4.563 3.753 2.524 4.128 . 0 0 "[ . 1]" 1
1744 3 24 LYS HE2 3 24 LYS QG 3.404 2.245 4.404 2.876 2.427 3.339 . 0 0 "[ . 1]" 1
1745 2 24 LYS HE2 2 24 LYS HG3 3.309 2.214 4.404 3.067 2.579 3.727 . 0 0 "[ . 1]" 1
1746 2 24 LYS H 2 24 LYS QD 4.011 2.402 5.620 4.271 2.753 4.718 . 0 0 "[ . 1]" 1
1747 3 24 LYS H 3 24 LYS HD2 4.011 2.402 5.620 4.311 2.551 5.117 . 0 0 "[ . 1]" 1
1748 2 24 LYS H 2 24 LYS HE2 4.649 2.488 6.810 5.255 4.514 5.869 . 0 0 "[ . 1]" 1
1749 3 24 LYS H 3 24 LYS HE2 4.649 2.488 6.810 5.149 4.385 5.960 . 0 0 "[ . 1]" 1
1750 2 25 LYS HA 2 25 LYS HG2 2.881 2.051 3.711 2.761 2.198 3.338 . 0 0 "[ . 1]" 1
1751 3 25 LYS HA 3 25 LYS HG2 2.881 2.051 3.711 2.764 2.353 3.368 . 0 0 "[ . 1]" 1
1752 2 25 LYS H 2 25 LYS HB2 4.100 2.419 5.781 3.500 3.299 3.732 . 0 0 "[ . 1]" 1
1753 3 25 LYS H 3 25 LYS HB2 4.100 2.419 5.781 3.542 3.301 3.765 . 0 0 "[ . 1]" 1
1754 2 25 LYS H 2 25 LYS HB3 4.171 2.431 5.911 4.033 3.966 4.088 . 0 0 "[ . 1]" 1
1755 3 25 LYS H 3 25 LYS HB3 4.171 2.431 5.911 4.041 3.927 4.104 . 0 0 "[ . 1]" 1
1756 2 25 LYS HB2 2 25 LYS HG2 2.797 2.015 3.579 2.728 2.441 3.006 . 0 0 "[ . 1]" 1
1757 3 25 LYS HB2 3 25 LYS HG2 2.797 2.015 3.579 2.750 2.454 3.012 . 0 0 "[ . 1]" 1
1758 2 25 LYS H 2 25 LYS QE 4.912 2.499 7.325 4.635 3.605 5.346 . 0 0 "[ . 1]" 1
1759 3 25 LYS H 3 25 LYS HE2 4.912 2.499 7.325 5.228 3.766 5.614 . 0 0 "[ . 1]" 1
1760 2 26 GLU H 2 26 GLU HB3 4.050 2.410 5.690 3.575 3.490 3.636 . 0 0 "[ . 1]" 1
1761 3 26 GLU H 3 26 GLU QB . 2.410 3.157 2.336 2.135 2.630 0.275 3 0 "[ . 1]" 1
1762 2 26 GLU HB2 2 26 GLU QG 2.501 . 3.126 2.323 2.261 2.403 . 0 0 "[ . 1]" 1
1763 3 26 GLU QB 3 26 GLU QG 2.501 . 3.126 2.071 2.054 2.084 . 0 0 "[ . 1]" 1
1764 2 27 ILE HA 2 27 ILE MD 3.955 2.390 5.520 3.493 2.071 3.796 0.319 2 0 "[ . 1]" 1
1765 3 27 ILE HA 3 27 ILE MD 3.955 2.390 5.520 3.720 3.665 3.767 . 0 0 "[ . 1]" 1
1766 2 27 ILE HA 2 27 ILE MG 3.000 2.100 3.900 3.209 3.202 3.214 . 0 0 "[ . 1]" 1
1767 3 27 ILE HA 3 27 ILE MG 3.000 2.100 3.900 3.205 3.187 3.214 . 0 0 "[ . 1]" 1
1768 2 27 ILE HA 2 27 ILE HG13 2.664 . 3.374 2.394 2.286 2.828 . 0 0 "[ . 1]" 1
1769 3 27 ILE HA 3 27 ILE HG13 2.664 . 3.374 2.349 2.295 2.400 . 0 0 "[ . 1]" 1
1770 2 27 ILE HA 2 27 ILE HG12 3.226 2.185 4.267 3.159 2.959 3.720 . 0 0 "[ . 1]" 1
1771 3 27 ILE HA 3 27 ILE HG12 3.226 2.185 4.267 3.046 2.903 3.198 . 0 0 "[ . 1]" 1
1772 2 35 LEU HA 2 35 LEU HB2 3.173 2.166 4.180 3.021 3.016 3.028 . 0 0 "[ . 1]" 1
1773 3 35 LEU HA 3 35 LEU HB2 3.173 2.166 4.180 3.019 3.013 3.023 . 0 0 "[ . 1]" 1
1774 2 27 ILE HB 2 27 ILE MD 2.445 . 3.043 2.366 2.209 2.439 . 0 0 "[ . 1]" 1
1775 3 27 ILE HB 3 27 ILE MD 2.445 . 3.043 2.361 2.217 2.444 . 0 0 "[ . 1]" 1
1776 2 17 TYR HA 2 17 TYR HB3 3.372 2.235 4.509 2.816 2.555 3.018 . 0 0 "[ . 1]" 1
1777 3 17 TYR HA 3 17 TYR HB3 3.372 2.235 4.509 2.843 2.647 3.026 . 0 0 "[ . 1]" 1
1778 2 17 TYR HA 2 17 TYR HB2 3.425 2.252 4.598 2.808 2.526 3.015 . 0 0 "[ . 1]" 1
1779 3 17 TYR HA 3 17 TYR HB2 3.425 2.252 4.598 2.792 2.524 2.982 . 0 0 "[ . 1]" 1
1780 2 17 TYR HB3 2 17 TYR QD 4.126 2.424 5.828 2.456 2.306 2.732 0.118 10 0 "[ . 1]" 1
1781 3 17 TYR HB3 3 17 TYR QD 4.126 2.424 5.828 2.407 2.291 2.657 0.133 10 0 "[ . 1]" 1
1782 2 17 TYR HB2 2 17 TYR QD 4.084 2.416 5.752 2.390 2.294 2.555 0.122 2 0 "[ . 1]" 1
1783 3 17 TYR HB2 3 17 TYR QD 4.084 2.416 5.752 2.432 2.284 2.590 0.132 2 0 "[ . 1]" 1
1784 2 29 GLU HA 2 29 GLU QG 3.000 2.100 3.900 2.592 2.206 3.024 . 0 0 "[ . 1]" 1
1785 3 29 GLU HA 3 29 GLU QG 3.000 2.100 3.900 2.575 2.300 2.873 . 0 0 "[ . 1]" 1
1786 2 29 GLU HA 2 29 GLU HB2 2.432 . 3.024 3.011 2.984 3.027 0.003 5 0 "[ . 1]" 1
1787 3 29 GLU HA 3 29 GLU HB2 2.432 . 3.024 2.973 2.613 3.024 0.000 8 0 "[ . 1]" 1
1788 2 28 SER HA 2 29 GLU QG 4.772 2.495 7.049 4.041 3.681 4.511 . 0 0 "[ . 1]" 1
1789 3 28 SER HA 3 29 GLU QG 4.772 2.495 7.049 4.156 3.659 5.652 . 0 0 "[ . 1]" 1
1790 2 28 SER HA 2 29 GLU H 2.497 . 3.121 2.355 2.308 2.404 . 0 0 "[ . 1]" 1
1791 3 28 SER HA 3 29 GLU H 2.497 . 3.121 2.367 2.316 2.435 . 0 0 "[ . 1]" 1
1792 2 30 ASP H 2 30 ASP HA 3.458 2.262 4.654 2.806 2.787 2.853 . 0 0 "[ . 1]" 1
1793 3 30 ASP H 3 30 ASP HA 3.458 2.262 4.654 2.807 2.775 2.839 . 0 0 "[ . 1]" 1
1794 2 36 ASN HA 2 39 MET ME 2.827 2.028 3.626 2.363 1.978 2.899 0.050 2 0 "[ . 1]" 1
1795 3 36 ASN HA 3 39 MET ME 2.827 2.028 3.626 2.089 1.946 2.268 0.082 4 0 "[ . 1]" 1
1796 2 9 GLU HA 2 9 GLU QG 2.754 2.182 3.512 2.370 2.193 2.538 . 0 0 "[ . 1]" 1
1797 3 9 GLU HA 3 9 GLU QG 2.754 2.182 3.512 2.397 2.236 2.511 . 0 0 "[ . 1]" 1
1798 2 23 GLU HA 2 23 GLU HB3 2.730 . 3.475 2.991 2.894 3.021 . 0 0 "[ . 1]" 1
1799 3 23 GLU HA 3 23 GLU HB3 2.730 . 3.475 2.997 2.949 3.027 . 0 0 "[ . 1]" 1
1800 2 35 LEU HA 2 35 LEU QD 2.462 2.304 3.068 2.086 1.985 2.210 0.319 7 0 "[ . 1]" 1
1801 3 35 LEU HA 3 35 LEU QD 2.462 2.304 3.068 2.066 1.953 2.185 0.351 1 0 "[ . 1]" 1
1802 2 35 LEU H 2 35 LEU HB3 3.536 2.285 4.787 3.603 3.594 3.619 . 0 0 "[ . 1]" 1
1803 3 35 LEU H 3 35 LEU HB3 3.536 2.285 4.787 3.608 3.597 3.632 . 0 0 "[ . 1]" 1
1804 2 35 LEU HB2 2 35 LEU QD 2.425 . 3.013 2.298 2.226 2.357 . 0 0 "[ . 1]" 1
1805 3 35 LEU HB2 3 35 LEU QD 2.425 . 3.013 2.317 2.260 2.397 . 0 0 "[ . 1]" 1
1806 2 35 LEU HB3 2 35 LEU QD 3.097 2.138 3.534 2.105 2.072 2.150 0.066 6 0 "[ . 1]" 1
1807 3 35 LEU HB3 3 35 LEU QD 3.097 2.138 3.534 2.107 2.043 2.144 0.095 2 0 "[ . 1]" 1
1808 2 35 LEU H 2 35 LEU QD 4.496 2.475 6.517 2.981 2.851 3.142 . 0 0 "[ . 1]" 1
1809 3 35 LEU H 3 35 LEU QD 4.496 2.475 6.517 2.924 2.800 3.090 . 0 0 "[ . 1]" 1
1810 2 35 LEU HA 2 35 LEU HG 3.552 2.290 4.814 3.211 3.105 3.359 . 0 0 "[ . 1]" 1
1811 3 35 LEU HA 3 35 LEU HG 3.552 2.290 4.814 3.271 3.176 3.342 . 0 0 "[ . 1]" 1
1812 2 36 ASN HA 2 36 ASN QD 4.851 2.498 7.204 3.695 2.726 4.208 . 0 0 "[ . 1]" 1
1813 3 36 ASN HA 3 36 ASN QD 4.851 2.498 7.204 3.573 2.834 4.195 . 0 0 "[ . 1]" 1
1814 2 36 ASN H 2 36 ASN HB2 3.071 2.128 4.014 2.432 2.114 2.778 0.014 2 0 "[ . 1]" 1
1815 3 36 ASN H 3 36 ASN HB2 3.071 2.128 4.014 2.480 2.122 2.980 0.006 8 0 "[ . 1]" 1
1816 2 36 ASN H 2 36 ASN HB3 3.326 2.220 4.432 2.793 2.307 3.531 . 0 0 "[ . 1]" 1
1817 3 36 ASN H 3 36 ASN HB3 3.326 2.220 4.432 2.911 2.238 3.602 . 0 0 "[ . 1]" 1
1818 2 36 ASN HB2 2 36 ASN QD 3.358 2.492 4.486 2.712 2.183 3.266 0.309 10 0 "[ . 1]" 1
1819 3 36 ASN HB2 3 36 ASN QD 3.358 2.492 4.486 2.339 2.147 2.871 0.345 1 0 "[ . 1]" 1
1820 2 36 ASN HB3 2 36 ASN QD 3.248 2.486 4.303 2.517 2.099 3.294 0.387 3 0 "[ . 1]" 1
1821 3 36 ASN HB3 3 36 ASN QD 3.248 2.486 4.303 2.877 2.157 3.314 0.329 9 0 "[ . 1]" 1
1822 2 36 ASN HB3 2 37 VAL H 3.476 2.268 4.684 2.653 2.385 3.296 . 0 0 "[ . 1]" 1
1823 3 36 ASN HB3 3 37 VAL H 3.476 2.268 4.684 2.729 2.254 3.259 0.014 4 0 "[ . 1]" 1
1824 2 37 VAL HA 2 37 VAL QG 3.095 2.137 3.227 2.261 2.083 2.338 0.054 3 0 "[ . 1]" 1
1825 3 37 VAL HA 3 37 VAL QG 3.095 2.137 3.227 2.337 2.249 2.441 . 0 0 "[ . 1]" 1
1826 2 37 VAL HA 2 37 VAL HB 3.104 2.141 4.067 2.471 2.420 2.581 . 0 0 "[ . 1]" 1
1827 3 37 VAL HA 3 37 VAL HB 3.104 2.141 4.067 2.436 2.382 2.500 . 0 0 "[ . 1]" 1
1828 2 37 VAL HB 2 37 VAL QG 2.157 . 2.547 1.888 1.885 1.891 . 0 0 "[ . 1]" 1
1829 3 37 VAL HB 3 37 VAL QG 2.157 . 2.547 1.886 1.882 1.891 . 0 0 "[ . 1]" 1
1830 2 38 ALA H 2 38 ALA HA 3.304 2.212 4.396 2.826 2.815 2.838 . 0 0 "[ . 1]" 1
1831 3 38 ALA H 3 38 ALA HA 3.304 2.212 4.396 2.821 2.796 2.842 . 0 0 "[ . 1]" 1
1832 2 38 ALA HA 2 38 ALA MB 2.208 . 2.696 2.132 2.126 2.135 . 0 0 "[ . 1]" 1
1833 3 38 ALA HA 3 38 ALA MB 2.208 . 2.696 2.128 2.125 2.132 . 0 0 "[ . 1]" 1
1834 2 38 ALA H 2 38 ALA MB 2.534 . 3.176 2.243 2.222 2.262 . 0 0 "[ . 1]" 1
1835 3 38 ALA H 3 38 ALA MB 2.534 . 3.176 2.239 2.225 2.252 . 0 0 "[ . 1]" 1
1836 2 35 LEU QD 2 38 ALA MB 2.753 . 3.511 3.364 3.229 3.578 0.067 1 0 "[ . 1]" 1
1837 3 35 LEU QD 3 38 ALA MB 2.753 . 3.511 3.342 3.052 3.520 0.009 5 0 "[ . 1]" 1
1838 2 39 MET HA 2 39 MET HG2 3.446 2.259 4.633 2.850 2.206 3.133 0.053 4 0 "[ . 1]" 1
1839 3 39 MET HA 3 39 MET HG2 3.446 2.259 4.633 2.566 2.242 2.934 0.017 3 0 "[ . 1]" 1
1840 2 42 ILE H 2 42 ILE MG 3.825 2.362 5.288 3.749 3.722 3.772 . 0 0 "[ . 1]" 1
1841 3 42 ILE H 3 42 ILE MG 3.825 2.362 5.288 3.728 3.615 3.762 . 0 0 "[ . 1]" 1
1842 2 43 SER HA 2 43 SER QB 2.986 2.220 3.878 2.362 2.310 2.529 . 0 0 "[ . 1]" 1
1843 3 43 SER HA 3 43 SER QB 2.986 2.220 3.878 2.342 2.307 2.367 . 0 0 "[ . 1]" 1
1844 2 7 LYS QD 2 46 PHE QD 3.754 2.345 5.163 3.188 2.656 3.649 . 0 0 "[ . 1]" 1
1845 3 7 LYS HD3 3 46 PHE QD 3.754 2.345 5.163 3.106 2.347 4.375 . 0 0 "[ . 1]" 1
1846 2 49 GLU H 2 49 GLU HA 3.557 2.292 4.822 2.917 2.840 2.946 . 0 0 "[ . 1]" 1
1847 3 49 GLU H 3 49 GLU HA 3.557 2.292 4.822 2.910 2.880 2.936 . 0 0 "[ . 1]" 1
1848 2 49 GLU H 2 49 GLU QB . 2.434 2.982 2.330 2.092 2.536 0.342 5 0 "[ . 1]" 1
1849 3 49 GLU H 3 49 GLU QB . 2.434 2.982 2.381 2.123 2.580 0.311 5 0 "[ . 1]" 1
1850 2 49 GLU H 2 49 GLU HG2 3.001 2.101 3.901 4.017 3.428 4.424 0.523 2 1 "[ + . 1]" 1
1851 3 49 GLU H 3 49 GLU HG2 3.001 2.101 3.901 3.952 3.287 4.355 0.454 4 0 "[ . 1]" 1
1852 2 49 GLU HG2 2 50 ARG H 4.661 2.488 6.834 4.307 3.463 4.730 . 0 0 "[ . 1]" 1
1853 3 49 GLU HG2 3 50 ARG H 4.661 2.488 6.834 4.498 3.793 5.007 . 0 0 "[ . 1]" 1
1854 2 50 ARG HD2 2 50 ARG HE 3.250 2.194 4.306 2.674 2.394 2.888 . 0 0 "[ . 1]" 1
1855 3 50 ARG HD2 3 50 ARG HE 3.250 2.194 4.306 2.697 2.375 2.950 . 0 0 "[ . 1]" 1
1856 2 50 ARG H 2 50 ARG HD2 5.536 2.471 8.601 3.862 2.123 4.442 0.348 9 0 "[ . 1]" 1
1857 3 50 ARG H 3 50 ARG HD2 5.536 2.471 8.601 4.096 3.805 4.521 . 0 0 "[ . 1]" 1
1858 2 14 ILE MD 2 14 ILE HG13 2.249 . 2.755 2.109 2.074 2.118 . 0 0 "[ . 1]" 1
1859 3 14 ILE MD 3 14 ILE HG13 2.249 . 2.755 2.115 2.109 2.121 . 0 0 "[ . 1]" 1
1860 2 8 GLU HB2 2 8 GLU HG2 2.907 2.062 3.752 2.998 2.973 3.011 . 0 0 "[ . 1]" 1
1861 3 8 GLU HB2 3 8 GLU QG 2.907 2.062 3.689 2.368 2.255 2.509 . 0 0 "[ . 1]" 1
1862 2 9 GLU H 2 9 GLU HB2 3.104 2.140 4.068 2.430 2.299 2.551 . 0 0 "[ . 1]" 1
1863 3 9 GLU H 3 9 GLU HB2 3.104 2.140 4.068 2.443 2.320 2.566 . 0 0 "[ . 1]" 1
1864 2 9 GLU H 2 9 GLU QG . 2.468 3.169 2.545 2.102 3.299 0.366 10 0 "[ . 1]" 1
1865 3 9 GLU H 3 9 GLU QG . 2.468 3.169 2.481 2.014 3.138 0.454 1 0 "[ . 1]" 1
1866 2 7 LYS H 2 7 LYS QD 5.370 2.498 7.246 3.977 3.773 4.194 . 0 0 "[ . 1]" 1
1867 3 7 LYS H 3 7 LYS HD3 5.370 2.486 8.254 4.607 4.382 4.789 . 0 0 "[ . 1]" 1
1868 3 7 LYS H 3 7 LYS HD2 4.872 2.498 7.246 4.258 3.079 4.813 . 0 0 "[ . 1]" 1
1869 2 59 LYS QB 2 59 LYS HE2 4.732 2.493 6.971 4.083 3.946 4.226 . 0 0 "[ . 1]" 1
1870 3 59 LYS QB 3 59 LYS HE2 4.732 2.493 6.971 4.092 3.884 4.255 . 0 0 "[ . 1]" 1
1871 2 7 LYS HB3 2 46 PHE HZ 4.209 2.437 5.981 4.532 3.860 5.304 . 0 0 "[ . 1]" 1
1872 3 7 LYS QB 3 46 PHE HZ . 2.437 4.019 3.283 2.311 3.900 0.126 7 0 "[ . 1]" 1
1873 2 7 LYS HB2 2 46 PHE QD 4.720 2.492 6.948 3.502 2.965 4.470 . 0 0 "[ . 1]" 1
1874 3 7 LYS QB 3 46 PHE QD 4.720 2.492 6.948 3.320 2.843 4.418 . 0 0 "[ . 1]" 1
1875 2 7 LYS HB2 2 46 PHE HZ 3.074 2.129 4.019 3.543 2.751 4.197 0.178 9 0 "[ . 1]" 1
1876 2 22 VAL H 2 22 VAL HB 3.039 2.116 3.962 3.661 3.648 3.676 . 0 0 "[ . 1]" 1
1877 3 22 VAL H 3 22 VAL HB 3.039 2.116 3.962 3.664 3.650 3.678 . 0 0 "[ . 1]" 1
1878 2 7 LYS QD 2 46 PHE HZ 3.119 2.469 4.092 4.584 3.366 5.402 1.310 9 7 "[*- *.***+1]" 1
1879 3 7 LYS HD3 3 46 PHE HZ 3.119 2.146 4.092 4.396 3.173 4.922 0.830 4 4 "[ -+* *]" 1
1880 3 7 LYS HD2 3 46 PHE HZ 4.445 2.469 6.421 6.039 4.787 6.513 0.092 4 0 "[ . 1]" 1
1881 2 29 GLU HB2 2 30 ASP H 3.438 2.256 4.620 2.551 2.206 2.839 0.050 1 0 "[ . 1]" 1
1882 3 29 GLU HB2 3 30 ASP H 3.438 2.256 4.620 2.755 2.464 3.714 . 0 0 "[ . 1]" 1
1883 2 23 GLU HB2 2 24 LYS H 3.146 2.156 4.136 3.713 3.509 4.037 . 0 0 "[ . 1]" 1
1884 3 23 GLU HB2 3 24 LYS H 3.146 2.156 4.136 3.681 3.387 4.022 . 0 0 "[ . 1]" 1
1885 2 23 GLU HG2 2 24 LYS H 4.562 2.481 6.643 4.435 3.209 5.459 . 0 0 "[ . 1]" 1
1886 3 23 GLU HG2 3 24 LYS H 4.562 2.481 6.643 4.062 2.811 5.537 . 0 0 "[ . 1]" 1
1887 2 23 GLU HG3 2 24 LYS H 4.381 2.461 6.301 4.611 4.136 5.009 . 0 0 "[ . 1]" 1
1888 3 23 GLU HG3 3 24 LYS H 4.381 2.461 6.301 4.332 3.711 4.925 . 0 0 "[ . 1]" 1
1889 2 57 LEU H 2 57 LEU HG 2.248 . 2.753 2.285 2.121 2.462 . 0 0 "[ . 1]" 1
1890 3 57 LEU H 3 57 LEU HG 2.248 . 2.753 2.321 2.013 3.895 1.142 9 1 "[ . +1]" 1
1891 2 27 ILE H 2 27 ILE HG13 4.495 2.474 6.516 4.700 4.510 4.815 . 0 0 "[ . 1]" 1
1892 3 27 ILE H 3 27 ILE HG13 4.495 2.474 6.516 4.675 4.564 4.736 . 0 0 "[ . 1]" 1
1893 2 27 ILE H 2 27 ILE HG12 4.314 2.453 6.175 4.761 4.653 5.040 . 0 0 "[ . 1]" 1
1894 3 27 ILE H 3 27 ILE HG12 4.314 2.453 6.175 4.630 4.565 4.694 . 0 0 "[ . 1]" 1
1895 2 16 ASN H 2 57 LEU QD 3.670 2.323 5.017 3.895 3.701 4.108 . 0 0 "[ . 1]" 1
1896 3 16 ASN H 3 57 LEU QD 3.670 2.323 5.017 3.876 3.539 4.061 . 0 0 "[ . 1]" 1
1897 2 16 ASN HB2 2 57 LEU QD 2.991 2.097 3.274 2.491 2.048 2.801 0.049 8 0 "[ . 1]" 1
1898 3 16 ASN HB2 3 57 LEU QD 2.991 2.097 3.274 2.624 2.107 2.893 . 0 0 "[ . 1]" 1
1899 2 53 VAL HB 2 57 LEU QD . 2.290 3.509 2.482 2.077 3.076 0.213 10 0 "[ . 1]" 1
1900 3 53 VAL HB 3 57 LEU QD . 2.290 3.509 2.558 2.305 3.888 0.379 9 0 "[ . 1]" 1
1901 2 57 LEU QD 2 57 LEU HG 1.856 . 2.073 1.892 1.885 1.896 . 0 0 "[ . 1]" 1
1902 3 57 LEU QD 3 57 LEU HG 1.856 . 2.073 1.893 1.886 1.897 . 0 0 "[ . 1]" 1
1903 2 57 LEU QB 2 57 LEU QD 2.344 . 2.880 1.932 1.884 1.954 0.048 10 0 "[ . 1]" 1
1904 3 57 LEU QB 3 57 LEU QD 2.344 . 2.880 1.925 1.874 1.958 0.058 9 0 "[ . 1]" 1
1905 2 16 ASN HA 2 53 VAL QG 3.219 2.183 4.255 2.545 2.251 2.827 . 0 0 "[ . 1]" 1
1906 3 16 ASN HA 3 53 VAL QG 3.219 2.183 4.255 2.762 2.438 3.782 . 0 0 "[ . 1]" 1
1907 2 53 VAL HB 2 53 VAL QG 1.935 . 2.309 1.893 1.888 1.898 . 0 0 "[ . 1]" 1
1908 3 53 VAL HB 3 53 VAL QG 1.935 . 2.309 1.890 1.883 1.895 . 0 0 "[ . 1]" 1
1909 2 13 LEU HA 2 57 LEU QD . 2.088 2.942 2.211 1.954 2.460 0.134 9 0 "[ . 1]" 1
1910 3 13 LEU HA 3 57 LEU QD . 2.088 2.942 2.119 1.902 2.379 0.186 10 0 "[ . 1]" 1
1911 2 27 ILE MD 2 31 GLY HA2 3.508 2.277 4.739 3.732 3.350 4.478 . 0 0 "[ . 1]" 1
1912 3 27 ILE MD 3 31 GLY HA2 3.508 2.277 4.739 3.409 3.107 3.709 . 0 0 "[ . 1]" 1
1913 2 21 ILE MG 2 27 ILE MD 2.079 . 2.511 3.090 2.663 3.519 1.008 2 8 "[*+**. **-*]" 1
1914 3 21 ILE MG 3 27 ILE MD 2.079 . 2.511 3.134 2.779 3.325 0.814 7 9 "[**- **+***]" 1
1915 2 27 ILE MD 2 27 ILE MG 1.882 . 2.236 2.179 1.859 3.231 0.995 2 1 "[ + . 1]" 1
1916 3 27 ILE MD 3 27 ILE MG 1.882 . 2.236 2.019 1.851 2.202 . 0 0 "[ . 1]" 1
1917 2 70 ILE HA 2 70 ILE MD 4.134 2.425 5.843 3.857 3.780 3.922 . 0 0 "[ . 1]" 1
1918 3 70 ILE HA 3 70 ILE MD 4.134 2.425 5.843 3.876 3.802 4.155 . 0 0 "[ . 1]" 1
1919 2 10 ILE MD 3 21 ILE QG 2.996 . 6.000 6.048 5.524 6.593 0.593 5 1 "[ + 1]" 1
1920 2 21 ILE QG 3 10 ILE MD 2.996 . 6.000 6.063 5.348 7.007 1.007 9 2 "[ - +1]" 1
1921 2 5 ALA MB 2 10 ILE MD 1.683 . 1.966 2.282 2.066 2.673 0.707 5 1 "[ + 1]" 1
1922 3 5 ALA MB 3 10 ILE MD 1.683 . 1.966 2.228 2.089 2.445 0.479 1 0 "[ . 1]" 1
1923 2 10 ILE MD 2 10 ILE HG13 2.077 . 2.508 2.109 2.095 2.121 . 0 0 "[ . 1]" 1
1924 3 10 ILE MD 3 10 ILE HG13 2.077 . 2.508 2.113 2.099 2.122 . 0 0 "[ . 1]" 1
1925 2 10 ILE HA 2 10 ILE MD 2.817 2.023 3.611 2.054 1.886 2.198 0.137 6 0 "[ . 1]" 1
1926 3 10 ILE HA 3 10 ILE MD 2.817 2.023 3.611 2.054 1.955 2.139 0.068 6 0 "[ . 1]" 1
1927 2 21 ILE HA 2 21 ILE MD 2.710 . 3.444 2.022 1.964 2.079 0.012 1 0 "[ . 1]" 1
1928 3 21 ILE HA 3 21 ILE MD 2.710 . 3.444 2.017 1.959 2.133 0.017 5 0 "[ . 1]" 1
1929 2 21 ILE MD 3 7 LYS HE2 3.219 2.183 4.255 3.350 2.253 4.071 . 0 0 "[ . 1]" 1
1930 2 7 LYS HE2 3 21 ILE MD 3.219 2.183 4.255 3.594 2.925 4.306 0.051 8 0 "[ . 1]" 1
1931 2 21 ILE MD 2 26 GLU QG 3.554 2.291 4.817 3.947 3.649 4.346 . 0 0 "[ . 1]" 1
1932 3 21 ILE MD 3 26 GLU QG 3.554 2.291 4.817 3.514 3.070 4.072 . 0 0 "[ . 1]" 1
1933 2 21 ILE MD 2 26 GLU HB2 2.926 2.070 3.782 2.747 2.409 3.166 . 0 0 "[ . 1]" 1
1934 3 21 ILE MD 3 26 GLU QB 2.926 2.070 3.782 2.521 2.259 2.803 . 0 0 "[ . 1]" 1
1935 2 21 ILE MD 2 21 ILE QG 2.022 . 2.417 1.882 1.876 1.889 . 0 0 "[ . 1]" 1
1936 3 21 ILE MD 3 21 ILE QG 2.022 . 2.417 1.884 1.877 1.889 . 0 0 "[ . 1]" 1
1937 2 15 VAL QG 2 16 ASN HB3 4.381 2.494 6.300 3.824 3.507 4.047 . 0 0 "[ . 1]" 1
1938 3 15 VAL QG 3 16 ASN HB3 4.381 2.494 6.300 3.786 3.506 4.090 . 0 0 "[ . 1]" 1
1939 2 15 VAL HB 2 15 VAL QG 1.952 . 2.333 1.890 1.882 1.895 . 0 0 "[ . 1]" 1
1940 3 15 VAL HB 3 15 VAL QG 1.952 . 2.333 1.892 1.885 1.896 . 0 0 "[ . 1]" 1
1941 2 15 VAL QG 2 53 VAL HB 3.274 2.202 4.346 4.326 4.123 4.476 0.130 8 0 "[ . 1]" 1
1942 3 15 VAL QG 3 53 VAL HB 3.274 2.202 4.346 4.483 4.054 6.624 2.278 9 1 "[ . +1]" 1
1943 2 15 VAL QG 2 50 ARG QG . 2.160 2.604 2.799 2.231 4.041 1.437 9 2 "[ - +1]" 1
1944 3 15 VAL QG 3 50 ARG QG . 2.160 2.604 2.979 2.113 4.052 1.448 10 4 "[ * . *-+]" 1
1945 2 35 LEU QD 3 42 ILE HA 3.115 2.145 4.085 2.616 2.169 3.172 . 0 0 "[ . 1]" 1
1946 2 42 ILE HA 3 35 LEU QD 3.115 2.145 4.085 3.141 2.814 3.622 . 0 0 "[ . 1]" 1
1947 2 35 LEU QD 2 35 LEU HG 2.042 . 2.459 1.893 1.888 1.896 . 0 0 "[ . 1]" 1
1948 3 35 LEU QD 3 35 LEU HG 2.042 . 2.459 1.892 1.884 1.899 . 0 0 "[ . 1]" 1
1949 2 57 LEU HA 2 57 LEU QD . 2.298 3.029 2.113 2.076 2.220 0.222 8 0 "[ . 1]" 1
1950 3 57 LEU HA 3 57 LEU QD . 2.298 3.029 2.188 2.072 2.536 0.226 4 0 "[ . 1]" 1
1951 2 21 ILE HB 2 21 ILE QG 2.639 . 3.335 2.185 2.183 2.187 . 0 0 "[ . 1]" 1
1952 3 21 ILE HB 3 21 ILE QG 2.639 . 3.335 2.183 2.176 2.188 . 0 0 "[ . 1]" 1
1953 2 25 LYS HB2 2 25 LYS QE 4.602 2.484 6.720 4.114 3.382 4.471 . 0 0 "[ . 1]" 1
1954 3 25 LYS HB2 3 25 LYS HE2 4.602 2.484 6.720 4.579 4.356 4.802 . 0 0 "[ . 1]" 1
1955 2 15 VAL QG 2 56 ILE HB 3.554 . 6.000 5.538 5.323 5.785 . 0 0 "[ . 1]" 1
1956 3 15 VAL QG 3 56 ILE HB 3.554 . 6.000 5.747 5.509 6.488 0.488 9 0 "[ . 1]" 1
1957 2 56 ILE HB 2 56 ILE HG13 2.672 . 3.386 2.542 2.471 2.696 . 0 0 "[ . 1]" 1
1958 3 56 ILE HB 3 56 ILE HG13 2.672 . 3.386 2.508 2.433 2.562 . 0 0 "[ . 1]" 1
1959 2 56 ILE HB 2 56 ILE MD 2.483 . 3.099 2.354 2.226 2.444 . 0 0 "[ . 1]" 1
1960 3 56 ILE HB 3 56 ILE MD 2.483 . 3.099 2.390 2.268 2.500 . 0 0 "[ . 1]" 1
1961 2 27 ILE HB 2 27 ILE MG 2.044 . 2.462 2.120 2.110 2.129 . 0 0 "[ . 1]" 1
1962 3 27 ILE HB 3 27 ILE MG 2.044 . 2.462 2.120 2.109 2.128 . 0 0 "[ . 1]" 1
1963 2 25 LYS HB3 2 25 LYS QE 4.547 2.480 6.614 3.795 2.001 4.158 0.479 1 0 "[ . 1]" 1
1964 3 25 LYS HB3 3 25 LYS HE2 4.547 2.480 6.614 4.479 4.332 4.619 . 0 0 "[ . 1]" 1
1965 2 7 LYS QD 2 7 LYS HE2 2.625 . 3.193 2.167 2.156 2.179 . 0 0 "[ . 1]" 1
1966 3 7 LYS HD2 3 7 LYS HE2 2.625 . 3.314 2.539 2.426 2.664 . 0 0 "[ . 1]" 1
1967 2 25 LYS QD 2 25 LYS QE 2.485 . 3.102 2.049 1.993 2.091 . 0 0 "[ . 1]" 1
1968 3 25 LYS QD 3 25 LYS HE2 2.485 . 3.102 2.365 2.325 2.433 . 0 0 "[ . 1]" 1
1969 2 7 LYS HE2 2 7 LYS HG2 3.603 2.305 4.901 3.706 3.662 3.757 . 0 0 "[ . 1]" 1
1970 3 7 LYS HE2 3 7 LYS QG 3.603 2.305 4.901 3.444 3.275 3.550 . 0 0 "[ . 1]" 1
1971 2 25 LYS QE 2 25 LYS HG2 2.266 . 2.779 2.502 2.177 3.005 0.226 10 0 "[ . 1]" 1
1972 3 25 LYS HE2 3 25 LYS HG2 2.266 . 2.779 2.866 2.265 3.082 0.303 10 0 "[ . 1]" 1
1973 2 7 LYS HE2 3 27 ILE MG 4.587 2.483 6.691 5.142 4.581 5.634 . 0 0 "[ . 1]" 1
1974 2 27 ILE MG 3 7 LYS HE2 4.587 2.483 6.691 5.099 4.726 5.748 . 0 0 "[ . 1]" 1
1975 3 7 LYS HD3 3 7 LYS HE2 2.545 . 3.193 2.356 2.265 2.446 . 0 0 "[ . 1]" 1
1976 2 50 ARG HB2 2 50 ARG HD2 2.934 2.073 3.795 2.671 2.174 3.427 . 0 0 "[ . 1]" 1
1977 3 50 ARG HB2 3 50 ARG HD2 2.934 2.073 3.795 2.656 2.362 3.261 . 0 0 "[ . 1]" 1
1978 2 50 ARG HD2 2 50 ARG QG 2.270 2.048 2.785 2.368 2.282 2.526 . 0 0 "[ . 1]" 1
1979 3 50 ARG HD2 3 50 ARG QG 2.270 2.048 2.785 2.376 2.270 2.521 . 0 0 "[ . 1]" 1
1980 2 15 VAL QG 2 50 ARG HD2 3.790 2.354 5.226 4.363 3.801 5.612 0.386 5 0 "[ . 1]" 1
1981 3 15 VAL QG 3 50 ARG HD2 3.790 2.354 5.226 4.112 3.068 5.096 . 0 0 "[ . 1]" 1
1982 2 16 ASN HB3 2 53 VAL QG 3.657 2.319 4.995 3.256 2.940 3.528 . 0 0 "[ . 1]" 1
1983 3 16 ASN HB3 3 53 VAL QG 3.657 2.319 4.995 3.222 2.727 4.587 . 0 0 "[ . 1]" 1
1984 2 16 ASN HB3 2 57 LEU QD 2.850 2.038 3.662 2.752 2.463 3.108 . 0 0 "[ . 1]" 1
1985 3 16 ASN HB3 3 57 LEU QD 2.850 2.038 3.662 2.606 2.318 2.936 . 0 0 "[ . 1]" 1
1986 2 8 GLU HB3 2 8 GLU HG2 2.749 . 3.505 2.384 2.298 2.471 . 0 0 "[ . 1]" 1
1987 3 8 GLU HB3 3 8 GLU QG 2.749 . 3.505 2.302 2.129 2.422 . 0 0 "[ . 1]" 1
1988 2 8 GLU HB2 2 8 GLU HG3 2.867 2.045 3.689 2.509 2.413 2.625 . 0 0 "[ . 1]" 1
1989 2 11 ALA HA 2 14 ILE HB 2.732 . 3.478 2.828 2.336 3.361 . 0 0 "[ . 1]" 1
1990 3 11 ALA HA 3 14 ILE HB 2.732 . 3.478 2.922 2.458 3.578 0.100 5 0 "[ . 1]" 1
1991 2 11 ALA HA 2 11 ALA MB 2.066 . 2.493 2.124 2.110 2.130 . 0 0 "[ . 1]" 1
1992 3 11 ALA HA 3 11 ALA MB 2.066 . 2.493 2.125 2.118 2.131 . 0 0 "[ . 1]" 1
1993 2 11 ALA HA 2 14 ILE MD 2.473 . 3.085 2.584 1.866 4.037 0.952 5 1 "[ + 1]" 1
1994 3 11 ALA HA 3 14 ILE MD 2.473 . 3.085 3.073 2.101 3.934 0.849 7 4 "[ .*+*-1]" 1
1995 2 10 ILE MG 2 11 ALA HA 3.191 2.173 4.209 3.359 3.195 3.534 . 0 0 "[ . 1]" 1
1996 3 10 ILE MG 3 11 ALA HA 3.191 2.173 4.209 3.353 3.169 3.478 . 0 0 "[ . 1]" 1
1997 2 11 ALA HA 2 42 ILE MG 2.111 . 2.557 3.025 2.782 3.449 0.892 4 3 "[-* +. 1]" 1
1998 3 11 ALA HA 3 42 ILE MG 2.111 . 2.557 2.646 2.322 2.810 0.253 5 0 "[ . 1]" 1
1999 2 32 ALA HA 2 32 ALA MB 1.998 . 2.397 2.128 2.115 2.134 . 0 0 "[ . 1]" 1
2000 3 32 ALA HA 3 32 ALA MB 1.998 . 2.397 2.130 2.126 2.135 . 0 0 "[ . 1]" 1
2001 2 22 VAL QG 2 32 ALA HA 2.067 . 2.494 2.383 1.983 2.677 0.183 1 0 "[ . 1]" 1
2002 3 22 VAL QG 3 32 ALA HA 2.067 . 2.494 2.179 1.893 2.538 0.044 10 0 "[ . 1]" 1
2003 2 27 ILE MG 2 32 ALA HA 2.416 . 3.000 2.597 2.477 2.809 . 0 0 "[ . 1]" 1
2004 3 27 ILE MG 3 32 ALA HA 2.416 . 3.000 2.549 2.330 2.743 . 0 0 "[ . 1]" 1
2005 2 32 ALA HA 2 35 LEU QD 2.735 . 3.483 2.658 2.259 2.990 . 0 0 "[ . 1]" 1
2006 3 32 ALA HA 3 35 LEU QD 2.735 . 3.483 2.717 2.497 2.873 . 0 0 "[ . 1]" 1
2007 2 27 ILE MD 2 32 ALA HA 2.645 . 3.344 3.814 3.311 5.336 1.992 2 3 "[ + . * -]" 1
2008 3 27 ILE MD 3 32 ALA HA 2.645 . 3.344 3.751 3.259 4.041 0.697 1 4 "[+ - .* * 1]" 1
2009 2 24 LYS HA 2 26 GLU QG 4.352 2.458 6.246 4.435 4.241 5.037 . 0 0 "[ . 1]" 1
2010 3 24 LYS HA 3 26 GLU QG 4.352 2.458 6.246 4.567 4.338 4.830 . 0 0 "[ . 1]" 1
2011 2 26 GLU HA 2 26 GLU HB2 3.288 2.207 4.369 3.004 2.947 3.026 . 0 0 "[ . 1]" 1
2012 3 26 GLU HA 3 26 GLU QB 3.288 2.207 4.369 2.411 2.272 2.505 . 0 0 "[ . 1]" 1
2013 2 57 LEU HA 2 57 LEU QB 2.648 . 3.349 2.343 2.307 2.370 . 0 0 "[ . 1]" 1
2014 3 57 LEU HA 3 57 LEU QB 2.648 . 3.349 2.347 2.298 2.498 . 0 0 "[ . 1]" 1
2015 2 24 LYS HA 2 24 LYS HB3 2.442 . 3.038 2.550 2.478 2.614 . 0 0 "[ . 1]" 1
2016 3 24 LYS HA 3 24 LYS HB3 2.442 . 3.038 2.549 2.388 2.995 . 0 0 "[ . 1]" 1
2017 2 24 LYS HA 2 24 LYS HG2 2.288 . 2.812 2.523 2.271 3.223 0.411 5 0 "[ . 1]" 1
2018 2 40 ASP HA 2 40 ASP HB2 2.850 2.038 3.662 2.632 2.442 2.920 . 0 0 "[ . 1]" 1
2019 3 40 ASP HA 3 40 ASP HB2 2.850 2.038 3.662 2.994 2.957 3.023 . 0 0 "[ . 1]" 1
2020 2 25 LYS HA 2 25 LYS QD 4.243 2.443 6.043 2.997 2.015 4.121 0.428 7 0 "[ . 1]" 1
2021 3 25 LYS HA 3 25 LYS QD 4.243 2.443 6.043 3.030 1.902 3.967 0.541 7 1 "[ . + 1]" 1
2022 2 24 LYS HA 2 26 GLU HB2 3.620 . 6.000 6.250 5.753 6.823 0.823 1 3 "[+ . *-]" 1
2023 3 24 LYS HA 3 26 GLU QB 3.620 . 6.000 6.072 5.601 6.504 0.504 1 1 "[+ . 1]" 1
2024 2 51 GLU HA 2 51 GLU HG3 3.169 2.164 4.174 3.511 2.387 4.251 0.077 8 0 "[ . 1]" 1
2025 3 51 GLU HA 3 51 GLU HG3 3.169 2.164 4.174 3.439 2.001 4.253 0.163 10 0 "[ . 1]" 1
2026 2 51 GLU HA 2 51 GLU QB 2.509 . 3.138 2.259 2.148 2.400 . 0 0 "[ . 1]" 1
2027 3 51 GLU HA 3 51 GLU QB 2.509 . 3.138 2.315 2.160 2.512 . 0 0 "[ . 1]" 1
2028 2 15 VAL QG 2 50 ARG HA 2.595 . 3.268 2.183 1.913 2.706 0.009 8 0 "[ . 1]" 1
2029 3 15 VAL QG 3 50 ARG HA 2.595 . 3.268 2.147 1.983 2.305 . 0 0 "[ . 1]" 1
2030 2 50 ARG HA 2 50 ARG HB2 2.816 2.023 3.609 2.959 2.525 3.033 . 0 0 "[ . 1]" 1
2031 3 50 ARG HA 3 50 ARG HB2 2.816 2.023 3.609 2.914 2.630 3.024 . 0 0 "[ . 1]" 1
2032 2 9 GLU HA 2 9 GLU HB3 2.835 2.031 3.639 2.530 2.442 2.620 . 0 0 "[ . 1]" 1
2033 3 9 GLU HA 3 9 GLU HB3 2.835 2.031 3.639 2.505 2.463 2.565 . 0 0 "[ . 1]" 1
2034 2 50 ARG HA 2 50 ARG QG 2.793 2.013 3.573 2.725 2.468 3.426 . 0 0 "[ . 1]" 1
2035 3 50 ARG HA 3 50 ARG QG 2.793 2.013 3.573 2.819 2.511 3.299 . 0 0 "[ . 1]" 1
2036 2 9 GLU HA 2 56 ILE MG 2.236 . 2.736 2.306 2.063 2.591 . 0 0 "[ . 1]" 1
2037 3 9 GLU HA 3 56 ILE MG 2.236 . 2.736 2.326 2.044 3.838 1.102 9 1 "[ . +1]" 1
2038 2 7 LYS HA 2 10 ILE HG12 2.825 2.027 3.623 3.425 3.095 3.998 0.375 9 0 "[ . 1]" 1
2039 3 7 LYS HA 3 10 ILE HG12 2.825 2.027 3.623 3.356 2.889 3.810 0.187 6 0 "[ . 1]" 1
2040 2 22 VAL QG 2 23 GLU HA 3.137 2.153 4.121 3.241 2.956 3.363 . 0 0 "[ . 1]" 1
2041 3 22 VAL QG 3 23 GLU HA 3.137 2.153 4.121 3.256 3.098 3.391 . 0 0 "[ . 1]" 1
2042 2 45 ALA HA 2 45 ALA MB 2.192 . 2.672 2.121 2.100 2.131 . 0 0 "[ . 1]" 1
2043 3 45 ALA HA 3 45 ALA MB 2.192 . 2.672 2.121 2.113 2.127 . 0 0 "[ . 1]" 1
2044 2 45 ALA HA 3 27 ILE MD 3.637 2.314 4.960 3.942 3.526 4.324 . 0 0 "[ . 1]" 1
2045 2 27 ILE MD 3 45 ALA HA 3.637 2.314 4.960 3.699 3.332 4.444 . 0 0 "[ . 1]" 1
2046 2 29 GLU HA 2 32 ALA MB 2.494 . 3.116 2.533 2.191 3.187 0.071 1 0 "[ . 1]" 1
2047 3 29 GLU HA 3 32 ALA MB 2.494 . 3.116 2.443 2.115 2.719 . 0 0 "[ . 1]" 1
2048 2 23 GLU HA 2 23 GLU HG2 2.905 2.061 3.749 3.210 2.335 3.693 . 0 0 "[ . 1]" 1
2049 3 23 GLU HA 3 23 GLU HG2 2.905 2.061 3.749 3.297 2.252 3.699 . 0 0 "[ . 1]" 1
2050 2 44 GLU HA 2 44 GLU HB2 2.979 2.091 3.867 2.701 2.376 3.025 . 0 0 "[ . 1]" 1
2051 3 44 GLU HA 3 44 GLU HB2 2.979 2.091 3.867 2.466 2.329 2.922 . 0 0 "[ . 1]" 1
2052 2 27 ILE HA 2 27 ILE HB 2.623 . 3.311 2.527 2.466 2.575 . 0 0 "[ . 1]" 1
2053 3 27 ILE HA 3 27 ILE HB 2.623 . 3.311 2.533 2.500 2.563 . 0 0 "[ . 1]" 1
2054 2 13 LEU HA 2 56 ILE HB 3.679 . 6.000 6.803 6.641 7.070 1.070 4 10 [***+-*****] 1
2055 3 13 LEU HA 3 56 ILE HB 3.679 . 6.000 6.813 6.421 7.491 1.491 9 9 "[***** -*+*]" 1
2056 2 13 LEU HA 2 14 ILE MD 3.272 2.201 4.343 5.565 4.599 6.436 2.093 7 6 "[ -*.*+**1]" 1
2057 3 13 LEU HA 3 14 ILE MD 3.272 2.201 4.343 5.291 4.450 6.440 2.097 1 4 "[+ ** -]" 1
2058 2 13 LEU HA 2 13 LEU MD2 2.734 . 3.482 2.139 1.933 2.460 0.053 8 0 "[ . 1]" 1
2059 3 13 LEU HA 3 13 LEU MD2 2.734 . 3.482 2.113 1.967 2.258 0.019 7 0 "[ . 1]" 1
2060 2 13 LEU HA 2 57 LEU QB 3.380 2.238 4.522 4.978 4.610 5.268 0.746 6 5 "[ *- .+** 1]" 1
2061 3 13 LEU HA 3 57 LEU QB 3.380 2.238 4.522 4.821 4.692 4.986 0.464 2 0 "[ . 1]" 1
2062 2 38 ALA HA 2 41 CYS QB 3.222 2.184 4.260 2.754 2.150 3.073 0.034 5 0 "[ . 1]" 1
2063 3 38 ALA HA 3 41 CYS QB 3.222 2.184 4.260 2.394 2.063 2.708 0.121 3 0 "[ . 1]" 1
2064 2 37 VAL QG 2 38 ALA HA 3.177 2.168 4.186 3.108 3.008 3.152 . 0 0 "[ . 1]" 1
2065 3 37 VAL QG 3 38 ALA HA 3.177 2.168 4.186 3.070 3.028 3.126 . 0 0 "[ . 1]" 1
2066 2 74 ALA HA 2 74 ALA MB 2.158 . 2.624 2.127 2.113 2.133 . 0 0 "[ . 1]" 1
2067 3 74 ALA HA 3 74 ALA MB 2.158 . 2.624 2.130 2.125 2.135 . 0 0 "[ . 1]" 1
2068 2 53 VAL HA 2 56 ILE HB 2.707 . 3.440 3.354 2.888 3.658 0.218 3 0 "[ . 1]" 1
2069 2 53 VAL HA 2 53 VAL QG 2.803 2.017 2.998 2.177 2.102 2.241 . 0 0 "[ . 1]" 1
2070 3 53 VAL HA 3 53 VAL QG 2.803 2.017 2.998 2.217 2.155 2.310 . 0 0 "[ . 1]" 1
2071 2 53 VAL HA 2 53 VAL HB 2.895 2.057 3.733 2.584 2.522 2.662 . 0 0 "[ . 1]" 1
2072 3 53 VAL HA 3 53 VAL HB 2.895 2.057 3.733 2.537 2.438 2.593 . 0 0 "[ . 1]" 1
2073 2 22 VAL HA 2 32 ALA MB 3.359 2.231 4.487 3.306 3.053 3.473 . 0 0 "[ . 1]" 1
2074 3 22 VAL HA 3 32 ALA MB 3.359 2.231 4.487 3.252 3.104 3.560 . 0 0 "[ . 1]" 1
2075 2 22 VAL HA 2 22 VAL QG 2.290 2.052 2.814 2.306 2.222 2.412 . 0 0 "[ . 1]" 1
2076 3 22 VAL HA 3 22 VAL QG 2.290 2.052 2.814 2.318 2.270 2.429 . 0 0 "[ . 1]" 1
2077 2 21 ILE MG 2 22 VAL HA 3.104 2.140 4.068 3.278 3.108 3.483 . 0 0 "[ . 1]" 1
2078 3 21 ILE MG 3 22 VAL HA 3.104 2.140 4.068 3.255 3.007 3.439 . 0 0 "[ . 1]" 1
2079 2 22 VAL HA 2 27 ILE MG 2.597 . 3.271 3.004 2.412 3.668 0.397 1 0 "[ . 1]" 1
2080 3 22 VAL HA 3 27 ILE MG 2.597 . 3.271 3.074 2.771 3.511 0.240 1 0 "[ . 1]" 1
2081 2 14 ILE HA 2 14 ILE HB 3.191 2.173 4.209 2.993 2.933 3.022 . 0 0 "[ . 1]" 1
2082 3 14 ILE HA 3 14 ILE HB 3.191 2.173 4.209 2.974 2.925 3.020 . 0 0 "[ . 1]" 1
2083 2 42 ILE HA 2 42 ILE HG13 3.027 2.111 3.943 2.771 2.665 2.901 . 0 0 "[ . 1]" 1
2084 3 42 ILE HA 3 42 ILE QG 3.027 2.111 3.943 2.401 2.103 2.627 0.008 8 0 "[ . 1]" 1
2085 2 42 ILE HA 2 42 ILE MG 2.314 . 2.850 2.467 2.363 2.602 . 0 0 "[ . 1]" 1
2086 3 42 ILE HA 3 42 ILE MG 2.314 . 2.850 2.452 2.244 2.674 . 0 0 "[ . 1]" 1
2087 2 14 ILE HA 2 14 ILE MG 2.636 . 3.331 2.526 2.209 2.844 . 0 0 "[ . 1]" 1
2088 3 14 ILE HA 3 14 ILE MG 2.636 . 3.331 2.576 2.216 2.841 . 0 0 "[ . 1]" 1
2089 2 14 ILE HA 2 14 ILE HG12 2.492 . 3.113 3.057 2.563 3.591 0.478 1 0 "[ . 1]" 1
2090 3 14 ILE HA 3 14 ILE HG12 2.492 . 3.113 3.213 2.584 3.582 0.469 9 0 "[ . 1]" 1
2091 2 10 ILE HA 2 10 ILE MG 2.426 . 3.014 2.430 2.332 2.519 . 0 0 "[ . 1]" 1
2092 3 10 ILE HA 3 10 ILE MG 2.426 . 3.014 2.418 2.361 2.546 . 0 0 "[ . 1]" 1
2093 2 56 ILE HA 2 56 ILE HG12 2.736 . 3.485 2.676 2.530 2.928 . 0 0 "[ . 1]" 1
2094 3 56 ILE HA 3 56 ILE HG12 2.736 . 3.485 2.681 2.483 3.512 0.027 9 0 "[ . 1]" 1
2095 2 56 ILE HA 2 56 ILE HG13 3.204 2.178 4.230 2.963 2.733 3.150 . 0 0 "[ . 1]" 1
2096 3 56 ILE HA 3 56 ILE HG13 3.204 2.178 4.230 3.061 2.757 3.751 . 0 0 "[ . 1]" 1
2097 2 56 ILE HA 2 56 ILE MG 2.554 . 3.206 2.351 2.288 2.438 . 0 0 "[ . 1]" 1
2098 3 56 ILE HA 3 56 ILE MG 2.554 . 3.206 2.346 2.092 2.440 . 0 0 "[ . 1]" 1
2099 2 56 ILE HA 2 56 ILE MD 4.087 2.417 5.757 3.880 3.836 3.929 . 0 0 "[ . 1]" 1
2100 3 56 ILE HA 3 56 ILE MD 4.087 2.417 5.757 3.876 3.789 4.127 . 0 0 "[ . 1]" 1
2101 2 21 ILE HA 2 21 ILE HB 3.101 2.139 4.063 3.019 3.009 3.026 . 0 0 "[ . 1]" 1
2102 3 21 ILE HA 3 21 ILE HB 3.101 2.139 4.063 3.018 2.998 3.029 . 0 0 "[ . 1]" 1
2103 2 21 ILE HA 2 26 GLU HB2 2.913 2.065 3.761 3.060 2.815 3.236 . 0 0 "[ . 1]" 1
2104 3 21 ILE HA 3 26 GLU QB 2.913 2.065 3.761 3.009 2.737 3.397 . 0 0 "[ . 1]" 1
2105 2 21 ILE HA 2 24 LYS HB2 3.155 2.160 4.150 3.504 3.005 4.367 0.217 9 0 "[ . 1]" 1
2106 3 21 ILE HA 3 24 LYS HB2 3.155 2.160 4.150 3.744 3.316 4.346 0.196 1 0 "[ . 1]" 1
2107 2 21 ILE HA 2 24 LYS QD 3.795 2.355 5.235 5.223 4.028 6.179 0.944 4 1 "[ +. 1]" 1
2108 3 21 ILE HA 3 24 LYS HD2 3.795 2.355 5.235 5.170 3.867 5.859 0.624 1 2 "[+ . - 1]" 1
2109 2 70 ILE HA 2 70 ILE QG 3.497 2.274 3.847 2.487 2.346 2.600 . 0 0 "[ . 1]" 1
2110 3 70 ILE HA 3 70 ILE QG 3.497 2.274 3.847 2.502 2.356 3.158 . 0 0 "[ . 1]" 1
2111 2 19 SER HA 2 39 MET ME 3.119 2.146 4.092 2.889 2.525 3.233 . 0 0 "[ . 1]" 1
2112 3 19 SER HA 3 39 MET ME 3.119 2.146 4.092 2.950 2.557 3.208 . 0 0 "[ . 1]" 1
2113 2 19 SER HA 2 22 VAL QG 2.751 . 3.508 2.161 2.041 2.304 . 0 0 "[ . 1]" 1
2114 3 19 SER HA 3 22 VAL QG 2.751 . 3.508 2.179 1.983 2.426 0.011 7 0 "[ . 1]" 1
2115 2 54 SER HA 2 57 LEU QD 3.397 2.243 4.551 4.213 3.804 4.766 0.215 1 0 "[ . 1]" 1
2116 3 54 SER HA 3 57 LEU QD 3.397 2.243 4.551 4.448 3.927 4.971 0.420 9 0 "[ . 1]" 1
2117 2 8 GLU HA 2 8 GLU HB2 2.967 2.087 3.847 2.648 2.407 3.021 . 0 0 "[ . 1]" 1
2118 3 8 GLU HA 3 8 GLU HB2 2.967 2.087 3.847 2.662 2.405 3.021 . 0 0 "[ . 1]" 1
2119 2 15 VAL QG 2 39 MET HA 2.978 2.091 3.865 2.885 2.182 3.506 . 0 0 "[ . 1]" 1
2120 3 15 VAL QG 3 39 MET HA 2.978 2.091 3.865 2.515 2.176 2.739 . 0 0 "[ . 1]" 1
2121 2 39 MET HA 2 42 ILE MD 2.793 2.013 3.573 2.620 2.275 3.097 . 0 0 "[ . 1]" 1
2122 3 39 MET HA 3 42 ILE MD 2.793 2.013 3.573 2.822 2.469 3.389 . 0 0 "[ . 1]" 1
2123 2 8 GLU HA 2 8 GLU HG2 3.561 2.293 4.829 3.010 2.458 3.240 . 0 0 "[ . 1]" 1
2124 3 8 GLU HA 3 8 GLU QG 3.561 2.293 4.063 2.530 2.257 3.316 0.036 10 0 "[ . 1]" 1
2125 2 8 GLU HA 2 8 GLU HG3 3.101 2.139 4.063 2.585 2.291 3.047 . 0 0 "[ . 1]" 1
2126 2 8 GLU HA 2 8 GLU HB3 3.421 2.251 4.591 2.866 2.485 3.027 . 0 0 "[ . 1]" 1
2127 3 8 GLU HA 3 8 GLU HB3 3.421 2.251 4.591 2.793 2.346 3.027 . 0 0 "[ . 1]" 1
2128 2 8 GLU HA 2 11 ALA MB 2.683 . 3.403 2.654 2.483 2.795 . 0 0 "[ . 1]" 1
2129 3 8 GLU HA 3 11 ALA MB 2.683 . 3.403 2.852 2.673 2.972 . 0 0 "[ . 1]" 1
2130 2 52 ALA HA 2 52 ALA MB 2.135 . 2.591 2.123 2.117 2.128 . 0 0 "[ . 1]" 1
2131 3 52 ALA HA 3 52 ALA MB 2.135 . 2.591 2.126 2.112 2.130 . 0 0 "[ . 1]" 1
2132 2 5 ALA HA 2 5 ALA MB 2.193 . 2.674 2.128 2.122 2.136 . 0 0 "[ . 1]" 1
2133 3 5 ALA HA 3 5 ALA MB 2.193 . 2.674 2.128 2.119 2.138 . 0 0 "[ . 1]" 1
2134 2 48 PHE HA 2 48 PHE HB3 3.104 2.141 4.067 2.576 2.540 2.596 . 0 0 "[ . 1]" 1
2135 3 48 PHE HA 3 48 PHE HB3 3.104 2.141 4.067 2.578 2.524 2.629 . 0 0 "[ . 1]" 1
2136 2 48 PHE HA 2 48 PHE HB2 2.870 2.046 3.694 2.352 2.328 2.384 . 0 0 "[ . 1]" 1
2137 3 48 PHE HA 3 48 PHE HB2 2.870 2.046 3.694 2.352 2.319 2.386 . 0 0 "[ . 1]" 1
2138 2 48 PHE HB3 2 48 PHE QD 3.838 2.365 5.311 2.535 2.431 2.573 . 0 0 "[ . 1]" 1
2139 3 48 PHE HB3 3 48 PHE QD 3.838 2.365 5.311 2.536 2.426 2.605 . 0 0 "[ . 1]" 1
2140 2 48 PHE HB2 2 48 PHE QD 3.686 2.327 5.045 2.283 2.268 2.325 0.059 6 0 "[ . 1]" 1
2141 3 48 PHE HB2 3 48 PHE QD 3.686 2.327 5.045 2.286 2.260 2.346 0.067 7 0 "[ . 1]" 1
2142 2 40 ASP H 2 40 ASP HB2 3.303 2.212 4.394 2.312 2.112 2.614 0.100 2 0 "[ . 1]" 1
2143 3 40 ASP H 3 40 ASP HB2 3.303 2.212 4.394 2.286 2.203 2.449 0.009 5 0 "[ . 1]" 1
2144 2 30 ASP HB2 2 31 GLY H 3.406 2.246 4.566 3.108 2.566 3.853 . 0 0 "[ . 1]" 1
2145 3 30 ASP HB2 3 31 GLY H 3.406 2.246 4.566 3.204 2.277 3.808 . 0 0 "[ . 1]" 1
2146 2 30 ASP HB3 2 31 GLY H 3.773 2.350 5.196 3.037 2.456 3.372 . 0 0 "[ . 1]" 1
2147 3 30 ASP HB3 3 31 GLY H 3.773 2.350 5.196 2.849 2.301 3.716 0.049 3 0 "[ . 1]" 1
2148 2 46 PHE HB3 2 46 PHE QD 3.688 2.328 5.048 2.459 2.339 2.578 . 0 0 "[ . 1]" 1
2149 3 46 PHE HB3 3 46 PHE QD 3.688 2.328 5.048 2.459 2.271 2.533 0.057 7 0 "[ . 1]" 1
2150 2 46 PHE HB2 2 46 PHE QD 3.333 2.222 4.444 2.330 2.264 2.461 . 0 0 "[ . 1]" 1
2151 3 46 PHE HB2 3 46 PHE QD 3.333 2.222 4.444 2.341 2.278 2.568 . 0 0 "[ . 1]" 1
2152 2 46 PHE HB2 2 48 PHE QD 3.724 2.337 5.111 2.075 1.875 2.189 0.462 1 0 "[ . 1]" 1
2153 3 46 PHE HB2 3 48 PHE QD 3.724 2.337 5.111 2.091 1.926 2.307 0.411 1 0 "[ . 1]" 1
2154 2 56 ILE HB 2 57 LEU H 2.494 . 3.116 2.464 2.294 2.558 . 0 0 "[ . 1]" 1
2155 3 56 ILE HB 3 57 LEU H 2.494 . 3.116 2.329 2.034 3.450 0.334 9 0 "[ . 1]" 1
2156 2 56 ILE H 2 56 ILE HB 2.735 . 3.483 2.580 2.470 2.662 . 0 0 "[ . 1]" 1
2157 3 56 ILE H 3 56 ILE HB 2.735 . 3.483 2.634 2.449 3.511 0.028 9 0 "[ . 1]" 1
2158 2 70 ILE H 2 70 ILE HB 2.768 2.002 3.534 2.625 2.479 2.769 . 0 0 "[ . 1]" 1
2159 3 70 ILE H 3 70 ILE HB 2.768 2.002 3.534 2.620 2.423 3.421 . 0 0 "[ . 1]" 1
2160 2 10 ILE HB 2 11 ALA H 2.720 . 3.460 2.501 2.441 2.584 . 0 0 "[ . 1]" 1
2161 3 10 ILE HB 3 11 ALA H 2.720 . 3.460 2.506 2.402 2.596 . 0 0 "[ . 1]" 1
2162 2 51 GLU H 2 51 GLU HG3 2.866 2.045 3.687 3.277 2.489 3.554 . 0 0 "[ . 1]" 1
2163 3 51 GLU H 3 51 GLU HG3 2.866 2.045 3.687 3.473 2.939 3.839 0.152 3 0 "[ . 1]" 1
2164 2 51 GLU H 2 51 GLU HG2 4.235 2.441 6.029 2.817 2.024 4.036 0.417 6 0 "[ . 1]" 1
2165 3 51 GLU H 3 51 GLU HG2 4.235 2.441 6.029 2.818 1.751 4.525 0.690 8 1 "[ . + 1]" 1
2166 2 23 GLU HB3 2 24 LYS H 3.131 2.151 4.111 2.636 2.296 3.231 . 0 0 "[ . 1]" 1
2167 3 23 GLU HB3 3 24 LYS H 3.131 2.151 4.111 2.476 2.230 3.288 . 0 0 "[ . 1]" 1
2168 2 70 ILE H 2 70 ILE QG 2.575 2.192 3.238 2.156 1.858 2.552 0.334 8 0 "[ . 1]" 1
2169 3 70 ILE H 3 70 ILE QG 2.575 2.192 3.238 2.241 1.771 2.533 0.421 2 0 "[ . 1]" 1
2170 2 35 LEU QD 3 46 PHE HZ 2.637 2.157 3.332 2.702 2.353 3.280 . 0 0 "[ . 1]" 1
2171 2 46 PHE HZ 3 35 LEU QD 2.637 2.157 3.332 2.643 2.361 3.061 . 0 0 "[ . 1]" 1
2172 2 15 VAL H 2 15 VAL QG 2.335 . 2.880 1.898 1.863 1.958 . 0 0 "[ . 1]" 1
2173 3 15 VAL H 3 15 VAL QG 2.335 . 2.880 1.905 1.837 1.967 . 0 0 "[ . 1]" 1
2174 2 15 VAL QG 2 48 PHE QE 3.363 2.232 4.494 2.154 2.003 2.285 0.229 10 0 "[ . 1]" 1
2175 3 15 VAL QG 3 48 PHE QE 3.363 2.232 4.494 2.284 2.015 2.484 0.217 9 0 "[ . 1]" 1
2176 2 15 VAL QG 2 48 PHE HZ 2.506 2.193 3.134 2.098 1.954 2.292 0.239 1 0 "[ . 1]" 1
2177 3 15 VAL QG 3 48 PHE HZ 2.506 2.193 3.134 2.228 2.005 2.411 0.188 3 0 "[ . 1]" 1
2178 2 52 ALA H 2 53 VAL QG 3.842 2.366 5.318 3.401 3.253 3.486 . 0 0 "[ . 1]" 1
2179 3 52 ALA H 3 53 VAL QG 3.842 2.366 5.318 3.338 3.056 3.794 . 0 0 "[ . 1]" 1
2180 2 37 VAL H 2 37 VAL QG 2.606 2.410 3.285 2.078 1.888 2.431 0.522 4 1 "[ +. 1]" 1
2181 3 37 VAL H 3 37 VAL QG 2.606 2.410 3.285 2.031 1.812 2.224 0.598 5 1 "[ + 1]" 1
2182 2 57 LEU QD 2 62 PHE QD 3.663 2.445 5.005 3.427 2.761 4.015 . 0 0 "[ . 1]" 1
2183 3 57 LEU QD 3 62 PHE QD 3.663 2.445 5.005 3.221 2.663 3.594 . 0 0 "[ . 1]" 1
2184 2 53 VAL H 2 53 VAL QG . . 2.408 1.794 1.667 1.854 0.234 6 0 "[ . 1]" 1
2185 3 53 VAL H 3 53 VAL QG . . 2.408 1.851 1.802 1.912 0.099 10 0 "[ . 1]" 1
2186 2 48 PHE QE 2 53 VAL QG 3.818 2.360 5.276 3.642 2.795 4.236 . 0 0 "[ . 1]" 1
2187 3 48 PHE QE 3 53 VAL QG 3.818 2.360 5.276 3.589 2.894 6.027 0.751 9 1 "[ . +1]" 1
2188 2 22 VAL QG 2 36 ASN QD 2.981 2.331 3.870 4.075 2.112 5.509 1.639 3 5 "[ +*.-** 1]" 1
2189 3 22 VAL QG 3 36 ASN QD 2.981 2.331 3.870 3.759 2.190 5.444 1.574 4 3 "[ +- *1]" 1
2190 2 52 ALA H 2 52 ALA MB 2.180 . 2.655 2.298 2.230 2.349 . 0 0 "[ . 1]" 1
2191 3 52 ALA H 3 52 ALA MB 2.180 . 2.655 2.306 2.204 2.385 . 0 0 "[ . 1]" 1
2192 2 52 ALA MB 2 53 VAL H 3.191 2.173 4.209 3.362 3.300 3.435 . 0 0 "[ . 1]" 1
2193 3 52 ALA MB 3 53 VAL H 3.191 2.173 4.209 3.332 3.273 3.403 . 0 0 "[ . 1]" 1
2194 2 48 PHE QD 2 52 ALA MB 3.687 2.327 5.047 2.754 2.285 3.390 0.042 7 0 "[ . 1]" 1
2195 3 48 PHE QD 3 52 ALA MB 3.687 2.327 5.047 2.745 2.276 3.440 0.051 9 0 "[ . 1]" 1
2196 2 42 ILE MG 2 46 PHE QD 3.142 2.155 4.129 2.195 1.797 2.475 0.358 8 0 "[ . 1]" 1
2197 3 42 ILE MG 3 46 PHE QD 3.142 2.155 4.129 2.226 2.056 2.616 0.099 2 0 "[ . 1]" 1
2198 2 42 ILE MG 2 48 PHE HZ 2.897 2.058 3.736 3.123 2.829 3.278 . 0 0 "[ . 1]" 1
2199 3 42 ILE MG 3 48 PHE HZ 2.897 2.058 3.736 3.057 2.581 3.573 . 0 0 "[ . 1]" 1
2200 2 38 ALA MB 2 39 MET H 2.821 2.025 3.617 2.564 2.447 2.712 . 0 0 "[ . 1]" 1
2201 3 38 ALA MB 3 39 MET H 2.821 2.025 3.617 2.705 2.545 2.794 . 0 0 "[ . 1]" 1
2202 2 18 PHE QD 2 38 ALA MB 3.598 2.304 4.892 3.648 3.281 4.160 . 0 0 "[ . 1]" 1
2203 3 18 PHE QD 3 38 ALA MB 3.598 2.304 4.892 3.481 2.825 3.843 . 0 0 "[ . 1]" 1
2204 2 10 ILE MG 3 17 TYR H 3.782 2.351 5.213 4.851 4.738 4.993 . 0 0 "[ . 1]" 1
2205 2 17 TYR H 3 10 ILE MG 3.782 2.351 5.213 4.890 4.771 5.095 . 0 0 "[ . 1]" 1
2206 2 21 ILE MG 2 22 VAL H 2.996 2.098 3.894 3.297 3.163 3.530 . 0 0 "[ . 1]" 1
2207 3 21 ILE MG 3 22 VAL H 2.996 2.098 3.894 3.281 2.891 3.477 . 0 0 "[ . 1]" 1
2208 2 21 ILE MG 3 46 PHE HZ 2.422 . 3.008 3.029 2.541 3.507 0.499 1 0 "[ . 1]" 1
2209 2 46 PHE HZ 3 21 ILE MG 2.422 . 3.008 3.141 2.573 3.890 0.882 9 1 "[ . +1]" 1
2210 2 70 ILE MG 2 73 SER H 2.910 . 6.000 3.910 2.475 4.759 . 0 0 "[ . 1]" 1
2211 3 70 ILE MG 3 73 SER H 2.910 . 6.000 3.885 2.760 5.152 . 0 0 "[ . 1]" 1
2212 2 70 ILE H 2 70 ILE MG 3.708 2.333 5.083 3.791 3.755 3.834 . 0 0 "[ . 1]" 1
2213 3 70 ILE H 3 70 ILE MG 3.708 2.333 5.083 3.740 3.349 3.809 . 0 0 "[ . 1]" 1
2214 2 42 ILE H 2 42 ILE MD 3.690 2.328 5.052 3.410 3.233 3.623 . 0 0 "[ . 1]" 1
2215 3 42 ILE H 3 42 ILE MD 3.690 2.328 5.052 3.096 2.083 3.451 0.245 2 0 "[ . 1]" 1
2216 2 42 ILE MD 3 18 PHE QE 3.176 2.167 4.185 2.676 2.216 2.999 . 0 0 "[ . 1]" 1
2217 2 18 PHE QE 3 42 ILE MD 3.176 2.167 4.185 2.918 2.595 3.386 . 0 0 "[ . 1]" 1
2218 2 42 ILE MD 3 18 PHE HZ 2.200 . 2.684 2.071 1.916 2.230 . 0 0 "[ . 1]" 1
2219 2 18 PHE HZ 3 42 ILE MD 2.200 . 2.684 2.170 1.824 2.513 . 0 0 "[ . 1]" 1
2220 2 27 ILE MD 3 46 PHE QD 3.770 2.429 5.191 3.237 2.764 3.519 . 0 0 "[ . 1]" 1
2221 2 46 PHE QD 3 27 ILE MD 3.770 2.429 5.191 3.321 2.714 3.813 . 0 0 "[ . 1]" 1
2222 2 27 ILE MD 3 46 PHE HZ 2.565 . 3.223 3.345 3.146 3.879 0.656 2 1 "[ + . 1]" 1
2223 2 46 PHE HZ 3 27 ILE MD 2.565 . 3.223 3.272 2.694 3.651 0.428 6 0 "[ . 1]" 1
2224 2 70 ILE H 2 70 ILE MD 4.090 2.417 5.763 3.648 3.502 3.886 . 0 0 "[ . 1]" 1
2225 3 70 ILE H 3 70 ILE MD 4.090 2.417 5.763 3.622 3.478 3.793 . 0 0 "[ . 1]" 1
2226 2 70 ILE MD 3 62 PHE QD 3.720 . 6.000 5.490 2.850 6.475 0.475 1 0 "[ . 1]" 1
2227 2 62 PHE QD 3 70 ILE MD 3.720 . 6.000 5.392 2.891 7.002 1.002 2 1 "[ + . 1]" 1
2228 2 21 ILE MD 3 46 PHE HZ 2.153 . 6.000 4.209 3.428 4.730 . 0 0 "[ . 1]" 1
2229 2 46 PHE HZ 3 21 ILE MD 2.153 . 6.000 4.381 3.426 5.077 . 0 0 "[ . 1]" 1
2230 2 48 PHE QD 2 56 ILE MD 3.401 2.244 4.558 2.500 2.252 2.822 . 0 0 "[ . 1]" 1
2231 3 48 PHE QD 3 56 ILE MD 3.401 2.244 4.558 2.601 2.299 2.932 . 0 0 "[ . 1]" 1
2232 2 45 ALA H 2 45 ALA HA 2.996 2.098 3.894 2.815 2.785 2.855 . 0 0 "[ . 1]" 1
2233 3 45 ALA H 3 45 ALA HA 2.996 2.098 3.894 2.797 2.771 2.838 . 0 0 "[ . 1]" 1
2234 2 48 PHE HA 2 48 PHE QD 4.478 2.473 6.483 3.721 3.710 3.731 . 0 0 "[ . 1]" 1
2235 3 48 PHE HA 3 48 PHE QD 4.478 2.473 6.483 3.718 3.711 3.732 . 0 0 "[ . 1]" 1
2236 2 5 ALA HA 2 6 SER H 2.610 . 3.291 2.251 2.147 2.463 . 0 0 "[ . 1]" 1
2237 3 5 ALA HA 3 6 SER H 2.610 . 3.291 2.293 2.209 2.532 . 0 0 "[ . 1]" 1
2238 2 47 GLY HA2 2 48 PHE H 3.624 2.310 4.938 2.678 2.587 2.837 . 0 0 "[ . 1]" 1
2239 3 47 GLY HA2 3 48 PHE H 3.624 2.310 4.938 2.653 2.539 2.830 . 0 0 "[ . 1]" 1
2240 2 24 LYS HA 2 26 GLU H 3.842 2.366 5.318 5.006 4.775 5.171 . 0 0 "[ . 1]" 1
2241 3 24 LYS HA 3 26 GLU H 3.842 2.366 5.318 5.048 4.824 5.283 . 0 0 "[ . 1]" 1
2242 2 11 ALA HA 2 48 PHE HZ 3.196 . 6.000 4.039 3.797 4.318 . 0 0 "[ . 1]" 1
2243 3 11 ALA HA 3 48 PHE HZ 3.196 . 6.000 3.988 3.833 4.139 . 0 0 "[ . 1]" 1
2244 2 48 PHE QE 2 50 ARG HA 3.962 2.392 5.532 3.226 2.893 3.909 . 0 0 "[ . 1]" 1
2245 3 48 PHE QE 3 50 ARG HA 3.962 2.392 5.532 3.106 2.600 3.419 . 0 0 "[ . 1]" 1
2246 2 50 ARG HA 2 52 ALA H 3.364 2.232 4.496 3.645 3.407 3.904 . 0 0 "[ . 1]" 1
2247 3 50 ARG HA 3 52 ALA H 3.364 2.232 4.496 3.557 3.367 3.702 . 0 0 "[ . 1]" 1
2248 2 19 SER QB 2 20 SER H 4.106 2.420 5.792 2.951 2.562 3.414 . 0 0 "[ . 1]" 1
2249 3 19 SER QB 3 20 SER H 4.106 2.420 5.792 2.939 2.528 3.365 . 0 0 "[ . 1]" 1
2250 2 43 SER QB 2 44 GLU H . 2.385 3.765 2.562 2.459 2.711 . 0 0 "[ . 1]" 1
2251 3 43 SER QB 3 44 GLU H . 2.385 3.765 2.494 2.346 2.601 0.039 3 0 "[ . 1]" 1
2252 2 54 SER HB3 2 55 GLY H 4.400 2.464 6.336 4.139 3.864 4.370 . 0 0 "[ . 1]" 1
2253 3 54 SER HB2 3 55 GLY H 4.400 2.464 6.336 2.941 2.526 3.207 . 0 0 "[ . 1]" 1
2254 2 17 TYR HA 2 17 TYR QD 3.642 2.315 4.969 2.630 2.040 2.905 0.275 2 0 "[ . 1]" 1
2255 3 17 TYR HA 3 17 TYR QD 3.642 2.315 4.969 2.723 2.226 3.021 0.089 2 0 "[ . 1]" 1
2256 2 28 SER HB2 2 29 GLU H 2.872 2.047 3.697 2.939 2.531 3.585 . 0 0 "[ . 1]" 1
2257 3 28 SER HB2 3 29 GLU H 2.872 2.047 3.697 3.170 2.572 3.610 . 0 0 "[ . 1]" 1
2258 2 28 SER HB3 2 29 GLU H 4.262 2.446 6.078 3.273 2.773 3.701 . 0 0 "[ . 1]" 1
2259 3 28 SER HB3 3 29 GLU H 4.262 2.446 6.078 3.024 2.499 3.713 . 0 0 "[ . 1]" 1
2260 2 73 SER H 2 73 SER QB 3.000 2.100 3.900 3.104 2.740 3.423 . 0 0 "[ . 1]" 1
2261 3 73 SER H 3 73 SER QB 3.000 2.100 3.900 3.037 2.519 3.392 . 0 0 "[ . 1]" 1
2262 2 52 ALA MB 2 56 ILE MD 2.033 . 6.000 2.474 2.120 2.874 . 0 0 "[ . 1]" 1
2263 3 52 ALA MB 3 56 ILE MD 2.033 . 6.000 2.629 1.990 3.063 . 0 0 "[ . 1]" 1
2264 2 14 ILE HB 2 14 ILE MG 2.168 . 2.638 2.118 2.085 2.132 . 0 0 "[ . 1]" 1
2265 3 14 ILE HB 3 14 ILE MG 2.168 . 2.638 2.119 2.103 2.130 . 0 0 "[ . 1]" 1
2266 2 14 ILE HG13 2 14 ILE MG 2.473 . 3.084 2.794 2.218 3.201 0.117 4 0 "[ . 1]" 1
2267 3 14 ILE HG13 3 14 ILE MG 2.473 . 3.084 2.702 2.281 3.205 0.121 4 0 "[ . 1]" 1
2268 2 14 ILE MG 2 15 VAL QG 2.826 2.027 3.625 2.965 2.341 3.492 . 0 0 "[ . 1]" 1
2269 3 14 ILE MG 3 15 VAL QG 2.826 2.027 3.625 2.831 2.217 3.575 . 0 0 "[ . 1]" 1
2270 2 14 ILE MG 2 42 ILE MD 1.750 . 2.056 1.952 1.784 2.168 0.112 7 0 "[ . 1]" 1
2271 3 14 ILE MG 3 42 ILE MD 1.750 . 2.056 1.986 1.816 2.291 0.235 2 0 "[ . 1]" 1
2272 2 21 ILE MG 3 7 LYS HE2 3.230 2.187 4.273 3.344 2.691 3.967 . 0 0 "[ . 1]" 1
2273 2 7 LYS HE2 3 21 ILE MG 3.230 2.187 4.273 3.596 2.697 4.240 . 0 0 "[ . 1]" 1
2274 2 21 ILE HB 2 21 ILE MG 1.946 . 2.325 2.125 2.119 2.128 . 0 0 "[ . 1]" 1
2275 3 21 ILE HB 3 21 ILE MG 1.946 . 2.325 2.125 2.120 2.128 . 0 0 "[ . 1]" 1
2276 2 21 ILE MG 2 26 GLU HB2 2.496 . 3.119 2.395 2.055 2.733 . 0 0 "[ . 1]" 1
2277 3 21 ILE MG 3 26 GLU QB 2.496 . 3.119 2.236 1.951 2.716 . 0 0 "[ . 1]" 1
2278 2 21 ILE MG 2 27 ILE HB 1.976 . 2.367 2.544 2.138 2.791 0.424 3 0 "[ . 1]" 1
2279 3 21 ILE MG 3 27 ILE HB 1.976 . 2.367 2.518 2.282 2.787 0.420 10 0 "[ . 1]" 1
2280 2 21 ILE QG 2 21 ILE MG 2.178 . 2.652 2.264 2.202 2.312 . 0 0 "[ . 1]" 1
2281 3 21 ILE QG 3 21 ILE MG 2.178 . 2.652 2.273 2.154 2.394 . 0 0 "[ . 1]" 1
2282 2 70 ILE HB 2 70 ILE MG 2.013 . 2.418 2.128 2.122 2.133 . 0 0 "[ . 1]" 1
2283 3 70 ILE HB 3 70 ILE MG 2.013 . 2.418 2.128 2.116 2.133 . 0 0 "[ . 1]" 1
2284 2 70 ILE QG 2 70 ILE MG 2.740 . 2.978 2.333 2.220 2.414 . 0 0 "[ . 1]" 1
2285 3 70 ILE QG 3 70 ILE MG 2.740 . 2.978 2.289 2.191 2.359 . 0 0 "[ . 1]" 1
2286 2 9 GLU QG 2 56 ILE MG 2.663 2.163 3.372 2.570 2.018 2.906 0.145 4 0 "[ . 1]" 1
2287 3 9 GLU QG 3 56 ILE MG 2.663 2.163 3.372 2.484 2.095 3.088 0.068 4 0 "[ . 1]" 1
2288 2 56 ILE HB 2 56 ILE MG 1.746 . 2.051 2.130 2.125 2.135 0.084 4 0 "[ . 1]" 1
2289 3 56 ILE HB 3 56 ILE MG 1.746 . 2.051 2.127 2.114 2.136 0.085 10 0 "[ . 1]" 1
2290 2 26 GLU HB2 2 27 ILE MG 3.486 2.271 4.701 4.348 4.245 4.518 . 0 0 "[ . 1]" 1
2291 3 26 GLU QB 3 27 ILE MG 3.486 2.271 4.701 4.077 3.860 4.332 . 0 0 "[ . 1]" 1
2292 2 22 VAL QG 2 27 ILE MG 2.252 . 2.759 2.779 2.270 3.430 0.671 1 1 "[+ . 1]" 1
2293 3 22 VAL QG 3 27 ILE MG 2.252 . 2.759 2.820 2.554 3.135 0.376 10 0 "[ . 1]" 1
2294 2 22 VAL HB 2 27 ILE MG 3.313 2.216 4.410 4.436 3.650 5.106 0.696 10 3 "[- . *+]" 1
2295 3 22 VAL HB 3 27 ILE MG 3.313 2.216 4.410 4.463 4.006 4.926 0.516 10 1 "[ . +]" 1
2296 2 14 ILE HB 2 14 ILE MD 2.628 . 3.319 2.465 2.206 3.223 . 0 0 "[ . 1]" 1
2297 3 14 ILE HB 3 14 ILE MD 2.628 . 3.319 2.467 2.329 2.587 . 0 0 "[ . 1]" 1
2298 2 70 ILE HB 2 70 ILE MD 2.458 . 3.062 2.432 2.317 2.500 . 0 0 "[ . 1]" 1
2299 3 70 ILE HB 3 70 ILE MD 2.458 . 3.062 2.424 2.331 2.489 . 0 0 "[ . 1]" 1
2300 2 70 ILE MD 2 70 ILE QG 2.122 . 2.501 1.885 1.879 1.889 . 0 0 "[ . 1]" 1
2301 3 70 ILE MD 3 70 ILE QG 2.122 . 2.501 1.883 1.875 1.888 . 0 0 "[ . 1]" 1
2302 2 56 ILE MD 2 56 ILE HG13 2.089 . 2.525 2.117 2.101 2.126 . 0 0 "[ . 1]" 1
2303 3 56 ILE MD 3 56 ILE HG13 2.089 . 2.525 2.117 2.108 2.126 . 0 0 "[ . 1]" 1
2304 2 56 ILE MD 2 56 ILE MG 1.931 . 2.304 2.099 1.921 2.374 0.070 3 0 "[ . 1]" 1
2305 3 56 ILE MD 3 56 ILE MG 1.931 . 2.304 2.001 1.833 2.162 . 0 0 "[ . 1]" 1
2306 2 10 ILE MD 2 10 ILE MG 1.928 . 2.300 1.996 1.873 2.150 . 0 0 "[ . 1]" 1
2307 3 10 ILE MD 3 10 ILE MG 1.928 . 2.300 2.021 1.932 2.115 . 0 0 "[ . 1]" 1
2308 2 42 ILE MD 2 42 ILE HG13 2.240 . 2.742 2.118 2.111 2.121 . 0 0 "[ . 1]" 1
2309 2 42 ILE HB 2 42 ILE MD 2.390 . 2.961 2.334 2.275 2.395 . 0 0 "[ . 1]" 1
2310 3 42 ILE HB 3 42 ILE MD 2.390 . 2.961 2.312 2.148 2.425 . 0 0 "[ . 1]" 1
2311 2 53 VAL HA 2 56 ILE MD 2.761 . 3.523 3.399 2.839 3.882 0.359 2 0 "[ . 1]" 1
2312 3 53 VAL HA 3 56 ILE MD 2.761 . 3.523 3.402 2.352 5.824 2.301 9 1 "[ . +1]" 1
2313 2 48 PHE HB3 2 56 ILE MD 3.688 2.328 5.048 3.806 3.604 3.951 . 0 0 "[ . 1]" 1
2314 3 48 PHE HB3 3 56 ILE MD 3.688 2.328 5.048 3.996 3.416 4.252 . 0 0 "[ . 1]" 1
2315 2 48 PHE HB2 2 56 ILE MD 2.957 2.083 3.831 2.911 2.700 3.094 . 0 0 "[ . 1]" 1
2316 3 48 PHE HB2 3 56 ILE MD 2.957 2.083 3.831 3.169 2.747 3.531 . 0 0 "[ . 1]" 1
2317 2 21 ILE HA 2 21 ILE MG 2.437 . 3.031 2.502 2.383 2.634 . 0 0 "[ . 1]" 1
2318 3 21 ILE HA 3 21 ILE MG 2.437 . 3.031 2.516 2.434 2.674 . 0 0 "[ . 1]" 1
2319 2 70 ILE HA 2 70 ILE MG 2.506 . 3.134 2.325 2.221 2.447 . 0 0 "[ . 1]" 1
2320 3 70 ILE HA 3 70 ILE MG 2.506 . 3.134 2.364 2.119 2.490 . 0 0 "[ . 1]" 1
2321 2 42 ILE HG13 2 42 ILE MG 3.233 2.187 4.279 3.187 3.169 3.201 . 0 0 "[ . 1]" 1
2322 3 42 ILE QG 3 42 ILE MG 3.233 2.187 4.279 2.188 2.064 2.260 0.123 8 0 "[ . 1]" 1
2323 2 37 VAL HB 2 38 ALA MB 3.723 2.337 5.109 5.427 5.317 5.526 0.417 4 0 "[ . 1]" 1
2324 3 37 VAL HB 3 38 ALA MB 3.723 2.337 5.109 5.420 5.317 5.515 0.406 6 0 "[ . 1]" 1
2325 2 38 ALA MB 3 42 ILE QG 2.368 . 2.929 3.262 2.816 4.578 1.649 2 2 "[ + -. 1]" 1
2326 2 42 ILE HG13 3 38 ALA MB 2.368 . 2.929 3.060 2.919 3.314 0.385 3 0 "[ . 1]" 1
2327 2 42 ILE HB 2 42 ILE MG 2.195 . 2.677 2.126 2.107 2.130 . 0 0 "[ . 1]" 1
2328 3 42 ILE HB 3 42 ILE MG 2.195 . 2.677 2.127 2.121 2.136 . 0 0 "[ . 1]" 1
2329 2 14 ILE HG12 2 14 ILE MG 2.437 . 3.031 2.393 1.958 3.174 0.143 5 0 "[ . 1]" 1
2330 3 14 ILE HG12 3 14 ILE MG 2.437 . 3.031 2.327 2.184 2.397 . 0 0 "[ . 1]" 1
2331 2 15 VAL QG 2 57 LEU QD 2.662 . 6.000 3.821 3.708 4.057 . 0 0 "[ . 1]" 1
2332 3 15 VAL QG 3 57 LEU QD 2.662 . 6.000 3.871 3.512 4.066 . 0 0 "[ . 1]" 1
2333 2 53 VAL QG 2 57 LEU HG 2.464 . 3.071 3.559 3.055 4.156 1.085 1 4 "[+ *. -*]" 1
2334 3 53 VAL QG 3 57 LEU HG 2.464 . 3.071 3.747 3.212 5.455 2.384 9 5 "[* -* +*]" 1
2335 2 22 VAL QG 2 32 ALA MB 2.613 . 2.725 2.124 2.008 2.305 . 0 0 "[ . 1]" 1
2336 3 22 VAL QG 3 32 ALA MB 2.613 . 2.725 2.276 2.003 2.531 . 0 0 "[ . 1]" 1
2337 2 22 VAL HB 2 22 VAL QG 1.935 . 2.309 1.892 1.886 1.896 . 0 0 "[ . 1]" 1
2338 3 22 VAL HB 3 22 VAL QG 1.935 . 2.309 1.891 1.887 1.898 . 0 0 "[ . 1]" 1
2339 2 21 ILE HB 2 22 VAL QG 2.313 . 2.848 3.103 3.037 3.186 0.338 2 0 "[ . 1]" 1
2340 3 21 ILE HB 3 22 VAL QG 2.313 . 2.848 3.112 3.021 3.201 0.353 5 0 "[ . 1]" 1
2341 2 37 VAL QG 2 39 MET QB 4.105 2.420 5.790 4.921 4.823 5.057 . 0 0 "[ . 1]" 1
2342 3 37 VAL QG 3 39 MET QB 4.105 2.420 5.790 4.903 4.808 5.096 . 0 0 "[ . 1]" 1
2343 2 37 VAL QG 2 38 ALA MB 2.801 2.016 3.586 3.042 2.965 3.117 . 0 0 "[ . 1]" 1
2344 3 37 VAL QG 3 38 ALA MB 2.801 2.016 3.586 2.941 2.865 2.992 . 0 0 "[ . 1]" 1
2345 2 13 LEU MD2 2 57 LEU QD 2.830 2.029 3.407 2.341 1.919 3.036 0.110 3 0 "[ . 1]" 1
2346 3 13 LEU MD2 3 57 LEU QD 2.830 2.029 3.407 2.388 1.995 2.930 0.034 2 0 "[ . 1]" 1
2347 2 21 ILE MG 2 35 LEU QD 2.010 . 2.414 2.569 2.211 2.820 0.406 6 0 "[ . 1]" 1
2348 3 21 ILE MG 3 35 LEU QD 2.010 . 2.414 2.413 2.089 2.616 0.202 7 0 "[ . 1]" 1
2349 2 56 ILE MD 2 56 ILE HG12 2.329 . 2.871 2.115 2.098 2.122 . 0 0 "[ . 1]" 1
2350 3 56 ILE MD 3 56 ILE HG12 2.329 . 2.871 2.114 2.106 2.121 . 0 0 "[ . 1]" 1
2351 2 27 ILE HG12 2 27 ILE MG 2.303 . 2.834 2.339 2.155 2.455 . 0 0 "[ . 1]" 1
2352 3 27 ILE HG12 3 27 ILE MG 2.303 . 2.834 2.356 2.247 2.419 . 0 0 "[ . 1]" 1
2353 2 27 ILE MD 2 27 ILE HG12 2.225 . 2.720 2.116 2.109 2.122 . 0 0 "[ . 1]" 1
2354 3 27 ILE MD 3 27 ILE HG12 2.225 . 2.720 2.114 2.095 2.120 . 0 0 "[ . 1]" 1
2355 2 27 ILE MD 2 27 ILE HG13 2.322 . 2.861 2.117 2.114 2.120 . 0 0 "[ . 1]" 1
2356 3 27 ILE MD 3 27 ILE HG13 2.322 . 2.861 2.116 2.095 2.121 . 0 0 "[ . 1]" 1
2357 2 56 ILE HG13 2 56 ILE MG 3.117 2.146 4.088 3.191 3.107 3.230 . 0 0 "[ . 1]" 1
2358 3 56 ILE HG13 3 56 ILE MG 3.117 2.146 4.088 3.200 3.183 3.216 . 0 0 "[ . 1]" 1
2359 2 23 GLU HA 2 23 GLU HB2 3.297 2.210 4.384 2.552 2.314 2.802 . 0 0 "[ . 1]" 1
2360 3 23 GLU HA 3 23 GLU HB2 3.297 2.210 4.384 2.510 2.280 2.711 . 0 0 "[ . 1]" 1
2361 2 51 GLU HA 2 51 GLU HG2 3.445 2.258 4.632 3.494 2.775 3.707 . 0 0 "[ . 1]" 1
2362 3 51 GLU HA 3 51 GLU HG2 3.445 2.258 4.632 3.327 2.834 3.688 . 0 0 "[ . 1]" 1
2363 2 23 GLU HA 2 23 GLU HG3 3.377 2.237 4.517 2.961 2.688 3.598 . 0 0 "[ . 1]" 1
2364 3 23 GLU HA 3 23 GLU HG3 3.377 2.237 4.517 2.952 2.720 3.440 . 0 0 "[ . 1]" 1
2365 2 20 SER HA 2 23 GLU HB2 2.877 2.049 3.705 3.107 2.482 3.744 0.039 5 0 "[ . 1]" 1
2366 3 20 SER HA 3 23 GLU HB2 2.877 2.049 3.705 2.999 2.571 3.704 . 0 0 "[ . 1]" 1
2367 2 10 ILE HB 2 10 ILE HG12 2.559 . 3.214 2.440 2.401 2.484 . 0 0 "[ . 1]" 1
2368 3 10 ILE HB 3 10 ILE HG12 2.559 . 3.214 2.438 2.413 2.476 . 0 0 "[ . 1]" 1
2369 2 59 LYS QB 3 70 ILE QG 3.305 . 6.000 5.312 4.807 5.910 . 0 0 "[ . 1]" 1
2370 2 70 ILE QG 3 59 LYS QB 3.305 . 6.000 5.202 4.589 6.300 0.300 1 0 "[ . 1]" 1
2371 2 15 VAL QG 2 43 SER HA 3.002 2.101 3.903 3.606 3.481 3.831 . 0 0 "[ . 1]" 1
2372 3 15 VAL QG 3 43 SER HA 3.002 2.101 3.903 3.664 3.388 3.948 0.045 7 0 "[ . 1]" 1
2373 2 16 ASN HB2 2 53 VAL QG 2.242 . 2.745 2.019 1.916 2.168 . 0 0 "[ . 1]" 1
2374 3 16 ASN HB2 3 53 VAL QG 2.242 . 2.745 2.163 1.888 3.333 0.588 9 1 "[ . +1]" 1
2375 2 36 ASN HB3 2 37 VAL QG 4.381 2.461 6.301 4.105 3.653 4.582 . 0 0 "[ . 1]" 1
2376 3 36 ASN HB3 3 37 VAL QG 4.381 2.461 6.301 4.112 3.599 4.622 . 0 0 "[ . 1]" 1
2377 2 24 LYS HB3 2 24 LYS HG3 3.183 2.170 4.196 2.943 2.586 3.012 . 0 0 "[ . 1]" 1
2378 3 24 LYS HB3 3 24 LYS QG 3.183 2.170 4.196 2.336 2.159 2.429 0.011 5 0 "[ . 1]" 1
2379 2 25 LYS HB3 2 25 LYS HG2 2.494 . 3.116 2.769 2.305 3.013 . 0 0 "[ . 1]" 1
2380 3 25 LYS HB3 3 25 LYS HG2 2.494 . 3.116 2.757 2.476 3.013 . 0 0 "[ . 1]" 1
2381 2 48 PHE HZ 2 53 VAL QG 3.981 . 6.000 5.093 4.298 5.874 . 0 0 "[ . 1]" 1
2382 3 48 PHE HZ 3 53 VAL QG 3.981 . 6.000 5.001 4.266 7.786 1.786 9 1 "[ . +1]" 1
2383 2 35 LEU QD 3 46 PHE QD 4.177 2.445 5.922 3.440 3.036 3.797 . 0 0 "[ . 1]" 1
2384 2 46 PHE QD 3 35 LEU QD 4.177 2.445 5.922 3.535 3.278 3.939 . 0 0 "[ . 1]" 1
2385 2 7 LYS HE2 2 46 PHE HZ 4.571 2.482 6.660 6.064 5.210 6.893 0.233 9 0 "[ . 1]" 1
2386 3 7 LYS HE2 3 46 PHE HZ 4.571 2.482 6.660 5.723 5.141 6.468 . 0 0 "[ . 1]" 1
2387 2 31 GLY HA2 2 32 ALA H 4.190 2.435 5.945 3.526 3.496 3.548 . 0 0 "[ . 1]" 1
2388 3 31 GLY HA2 3 32 ALA H 4.190 2.435 5.945 3.525 3.501 3.554 . 0 0 "[ . 1]" 1
2389 2 29 GLU HA 2 30 ASP H 4.237 2.442 6.032 3.552 3.497 3.597 . 0 0 "[ . 1]" 1
2390 3 29 GLU HA 3 30 ASP H 4.237 2.442 6.032 3.524 3.438 3.564 . 0 0 "[ . 1]" 1
2391 2 50 ARG HA 2 51 GLU H 3.817 2.360 5.274 3.467 3.437 3.532 . 0 0 "[ . 1]" 1
2392 3 50 ARG HA 3 51 GLU H 3.817 2.360 5.274 3.456 3.371 3.526 . 0 0 "[ . 1]" 1
2393 2 19 SER QB 2 39 MET QB 3.999 2.400 5.598 5.771 5.257 6.237 0.639 4 1 "[ +. 1]" 1
2394 3 19 SER QB 3 39 MET QB 3.999 2.400 5.598 5.805 5.093 6.629 1.031 1 4 "[+ ** -]" 1
2395 2 53 VAL HB 2 57 LEU HG 2.648 . 3.349 3.727 3.399 4.510 1.161 1 2 "[+ -. 1]" 1
2396 2 22 VAL HB 2 32 ALA MB 3.008 2.103 3.913 2.862 2.115 3.507 . 0 0 "[ . 1]" 1
2397 3 22 VAL HB 3 32 ALA MB 3.008 2.103 3.913 2.725 2.297 3.034 . 0 0 "[ . 1]" 1
2398 2 70 ILE HB 2 70 ILE QG 3.148 2.157 4.139 2.367 2.323 2.416 . 0 0 "[ . 1]" 1
2399 3 70 ILE HB 3 70 ILE QG 3.148 2.157 4.139 2.387 2.345 2.415 . 0 0 "[ . 1]" 1
2400 2 22 VAL QG 2 35 LEU QD . 2.206 2.315 2.674 2.287 3.228 0.913 10 3 "[* .- +]" 1
2401 3 22 VAL QG 3 35 LEU QD . 2.206 2.315 2.355 1.977 3.040 0.725 1 2 "[+ . -]" 1
2402 2 22 VAL QG 2 27 ILE MD 2.675 . 3.390 4.403 3.752 5.049 1.659 2 8 "[*+-** ***]" 1
2403 3 22 VAL QG 3 27 ILE MD 2.675 . 3.390 4.334 4.063 4.741 1.351 1 10 [+***-*****] 1
2404 2 10 ILE HB 2 10 ILE MG 2.086 . 2.521 2.123 2.111 2.129 . 0 0 "[ . 1]" 1
2405 3 10 ILE HB 3 10 ILE MG 2.086 . 2.521 2.121 2.105 2.129 . 0 0 "[ . 1]" 1
2406 2 10 ILE MG 3 21 ILE QG 3.087 . 6.000 4.513 4.055 5.206 . 0 0 "[ . 1]" 1
2407 2 21 ILE QG 3 10 ILE MG 3.087 . 6.000 4.440 3.908 5.076 . 0 0 "[ . 1]" 1
2408 2 5 ALA MB 2 10 ILE MG 2.981 . 6.000 4.559 4.061 4.887 . 0 0 "[ . 1]" 1
2409 3 5 ALA MB 3 10 ILE MG 2.981 . 6.000 4.511 4.105 4.693 . 0 0 "[ . 1]" 1
2410 2 52 ALA MB 2 56 ILE H 3.848 2.367 5.329 3.870 3.646 4.298 . 0 0 "[ . 1]" 1
2411 3 52 ALA MB 3 56 ILE H 3.848 2.367 5.329 3.961 3.349 4.639 . 0 0 "[ . 1]" 1
2412 2 51 GLU H 2 52 ALA MB 4.308 2.452 6.164 4.161 4.072 4.309 . 0 0 "[ . 1]" 1
2413 3 51 GLU H 3 52 ALA MB 4.308 2.452 6.164 4.163 4.063 4.257 . 0 0 "[ . 1]" 1
2414 2 14 ILE MG 2 17 TYR QD 4.775 2.495 7.055 5.503 4.932 6.071 . 0 0 "[ . 1]" 1
2415 3 14 ILE MG 3 17 TYR QD 4.775 2.495 7.055 5.437 4.711 6.055 . 0 0 "[ . 1]" 1
2416 2 17 TYR QD 2 21 ILE MG 5.196 2.496 7.896 5.323 4.545 6.615 . 0 0 "[ . 1]" 1
2417 3 17 TYR QD 3 21 ILE MG 5.196 2.496 7.896 5.230 4.242 6.097 . 0 0 "[ . 1]" 1
2418 2 14 ILE MG 2 15 VAL H 3.350 2.228 4.472 2.980 2.481 3.478 . 0 0 "[ . 1]" 1
2419 3 14 ILE MG 3 15 VAL H 3.350 2.228 4.472 2.930 2.391 3.616 . 0 0 "[ . 1]" 1
2420 2 10 ILE MG 3 18 PHE QE 4.263 2.446 6.080 3.575 2.860 4.192 . 0 0 "[ . 1]" 1
2421 2 18 PHE QE 3 10 ILE MG 4.263 2.446 6.080 3.632 3.140 4.791 . 0 0 "[ . 1]" 1
2422 2 7 LYS HG3 2 46 PHE HZ 4.511 2.476 6.546 5.693 4.380 6.603 0.057 9 0 "[ . 1]" 1
2423 3 7 LYS QG 3 46 PHE HZ 4.511 2.495 6.546 4.830 3.171 5.582 . 0 0 "[ . 1]" 1
2424 2 7 LYS HG3 2 46 PHE QD 4.910 2.499 7.321 3.745 3.241 4.139 . 0 0 "[ . 1]" 1
2425 3 7 LYS QG 3 46 PHE QD 4.910 2.499 7.321 3.665 3.219 4.788 . 0 0 "[ . 1]" 1
2426 2 7 LYS HG2 2 46 PHE HZ 5.210 2.495 7.925 6.394 5.476 7.054 . 0 0 "[ . 1]" 1
2427 2 26 GLU HB3 2 27 ILE H 4.674 2.490 6.858 4.342 4.159 4.496 . 0 0 "[ . 1]" 1
2428 3 26 GLU QB 3 27 ILE H 4.674 2.490 4.754 3.401 3.081 3.590 . 0 0 "[ . 1]" 1
2429 2 49 GLU QB 2 50 ARG H 3.174 2.167 4.181 2.849 2.663 3.074 . 0 0 "[ . 1]" 1
2430 3 49 GLU QB 3 50 ARG H 3.174 2.167 4.181 2.970 2.794 3.191 . 0 0 "[ . 1]" 1
2431 2 49 GLU QB 2 51 GLU H 3.270 2.201 4.339 2.502 2.246 2.701 . 0 0 "[ . 1]" 1
2432 3 49 GLU QB 3 51 GLU H 3.270 2.201 4.339 2.572 2.311 2.948 . 0 0 "[ . 1]" 1
2433 2 49 GLU QB 2 52 ALA H . 2.355 3.741 3.078 2.469 3.545 . 0 0 "[ . 1]" 1
2434 3 49 GLU QB 3 52 ALA H . 2.355 3.741 3.222 2.843 3.491 . 0 0 "[ . 1]" 1
2435 2 21 ILE HB 2 23 GLU H 5.009 2.500 7.518 4.858 4.679 5.055 . 0 0 "[ . 1]" 1
2436 3 21 ILE HB 3 23 GLU H 5.009 2.500 7.518 4.815 4.672 5.000 . 0 0 "[ . 1]" 1
2437 2 48 PHE HB3 2 52 ALA MB 4.165 2.430 5.900 4.958 4.526 5.347 . 0 0 "[ . 1]" 1
2438 3 48 PHE HB3 3 52 ALA MB 4.165 2.430 5.900 5.031 4.429 5.567 . 0 0 "[ . 1]" 1
2439 2 48 PHE HB2 2 52 ALA MB 3.371 2.234 4.508 3.493 3.114 3.867 . 0 0 "[ . 1]" 1
2440 3 48 PHE HB2 3 52 ALA MB 3.371 2.234 4.508 3.572 3.019 4.085 . 0 0 "[ . 1]" 1
2441 2 52 ALA MB 2 53 VAL HA 3.728 2.338 5.118 4.137 4.083 4.190 . 0 0 "[ . 1]" 1
2442 3 52 ALA MB 3 53 VAL HA 3.728 2.338 5.118 4.112 3.962 4.204 . 0 0 "[ . 1]" 1
2443 2 49 GLU QB 2 52 ALA MB . 2.183 2.581 2.631 1.912 3.719 1.138 4 1 "[ +. 1]" 1
2444 3 49 GLU QB 3 52 ALA MB . 2.183 2.581 2.696 1.950 3.251 0.670 3 3 "[- + . *1]" 1
2445 2 48 PHE HB2 2 56 ILE MG 3.922 2.383 5.461 5.604 5.295 5.961 0.500 6 0 "[ . 1]" 1
2446 3 48 PHE HB2 3 56 ILE MG 3.922 2.383 5.461 5.829 5.054 6.347 0.886 2 4 "[ + . *- *]" 1
2447 2 53 VAL HA 2 56 ILE MG 4.351 2.458 6.244 4.742 4.319 5.041 . 0 0 "[ . 1]" 1
2448 3 53 VAL HA 3 56 ILE MG 4.351 2.458 6.244 4.707 4.060 7.321 1.077 9 1 "[ . +1]" 1
2449 2 8 GLU HG2 2 56 ILE MG 3.136 2.152 4.120 2.953 1.981 4.744 0.624 6 2 "[ .+ -]" 1
2450 3 8 GLU QG 3 56 ILE MG 3.136 2.444 4.120 3.038 2.045 4.954 0.834 2 1 "[ + . 1]" 1
2451 2 56 ILE MG 2 57 LEU HA 4.080 2.415 5.745 3.480 3.204 3.641 . 0 0 "[ . 1]" 1
2452 3 56 ILE MG 3 57 LEU HA 4.080 2.415 5.745 3.520 3.170 5.224 . 0 0 "[ . 1]" 1
2453 2 15 VAL HA 2 42 ILE MD 3.860 2.370 5.350 4.904 4.337 5.354 0.004 2 0 "[ . 1]" 1
2454 3 15 VAL HA 3 42 ILE MD 3.860 2.370 5.350 4.473 3.350 5.517 0.167 2 0 "[ . 1]" 1
2455 2 35 LEU HB2 2 36 ASN H 3.591 2.302 4.880 2.671 2.526 2.871 . 0 0 "[ . 1]" 1
2456 3 35 LEU HB2 3 36 ASN H 3.591 2.302 4.880 2.820 2.673 2.950 . 0 0 "[ . 1]" 1
2457 2 45 ALA HA 2 46 PHE H 3.733 2.339 5.127 3.534 3.488 3.574 . 0 0 "[ . 1]" 1
2458 3 45 ALA HA 3 46 PHE H 3.733 2.339 5.127 3.558 3.540 3.573 . 0 0 "[ . 1]" 1
2459 2 15 VAL QG 2 18 PHE H 4.488 2.474 6.502 4.666 4.593 4.746 . 0 0 "[ . 1]" 1
2460 3 15 VAL QG 3 18 PHE H 4.488 2.474 6.502 4.623 4.565 4.717 . 0 0 "[ . 1]" 1
2461 2 15 VAL QG 2 19 SER H 4.395 2.464 6.326 4.721 4.597 4.836 . 0 0 "[ . 1]" 1
2462 3 15 VAL QG 3 19 SER H 4.395 2.464 6.326 4.779 4.735 4.839 . 0 0 "[ . 1]" 1
2463 2 53 VAL H 2 56 ILE MD 3.677 2.325 5.029 4.429 4.046 4.900 . 0 0 "[ . 1]" 1
2464 3 53 VAL H 3 56 ILE MD 3.677 2.325 5.029 4.478 3.849 5.705 0.676 9 1 "[ . +1]" 1
2465 2 49 GLU H 2 56 ILE MD 3.713 2.334 5.092 4.302 3.817 4.581 . 0 0 "[ . 1]" 1
2466 3 49 GLU H 3 56 ILE MD 3.713 2.334 5.092 4.604 3.823 4.990 . 0 0 "[ . 1]" 1
2467 2 42 ILE MG 2 46 PHE HB2 3.635 2.314 4.956 3.650 3.320 3.945 . 0 0 "[ . 1]" 1
2468 3 42 ILE MG 3 46 PHE HB2 3.635 2.314 4.956 3.711 3.175 3.970 . 0 0 "[ . 1]" 1
2469 2 27 ILE MD 2 30 ASP HB2 5.084 2.499 7.669 6.898 6.250 7.725 0.056 1 0 "[ . 1]" 1
2470 3 27 ILE MD 3 30 ASP HB2 5.084 2.499 7.669 6.694 5.513 7.732 0.063 1 0 "[ . 1]" 1
2471 2 8 GLU HG2 2 56 ILE MD 3.559 2.292 4.826 3.107 2.168 4.657 0.124 4 0 "[ . 1]" 1
2472 3 8 GLU QG 3 56 ILE MD 3.559 2.292 4.826 3.092 2.153 4.651 0.139 8 0 "[ . 1]" 1
2473 2 7 LYS HA 2 10 ILE MD 4.607 2.484 6.730 4.757 4.479 5.130 . 0 0 "[ . 1]" 1
2474 3 7 LYS HA 3 10 ILE MD 4.607 2.484 6.730 4.669 4.351 5.034 . 0 0 "[ . 1]" 1
2475 2 39 MET ME 2 39 MET HG2 3.233 2.188 4.278 3.400 3.392 3.408 . 0 0 "[ . 1]" 1
2476 3 39 MET ME 3 39 MET HG2 3.233 2.188 4.278 3.395 3.367 3.406 . 0 0 "[ . 1]" 1
2477 2 39 MET ME 2 39 MET HG3 3.270 2.201 4.339 2.584 2.469 2.644 . 0 0 "[ . 1]" 1
2478 3 39 MET ME 3 39 MET HG3 3.270 2.201 4.339 2.496 2.380 2.605 . 0 0 "[ . 1]" 1
2479 2 36 ASN HB2 2 39 MET ME 4.360 2.459 6.261 4.298 3.623 5.364 . 0 0 "[ . 1]" 1
2480 3 36 ASN HB2 3 39 MET ME 4.360 2.459 6.261 4.060 3.559 4.597 . 0 0 "[ . 1]" 1
2481 2 13 LEU MD2 2 17 TYR HB3 3.433 . 6.000 5.500 4.299 6.214 0.214 7 0 "[ . 1]" 1
2482 3 13 LEU MD2 3 17 TYR HB3 3.433 . 6.000 5.326 4.056 6.406 0.406 8 0 "[ . 1]" 1
2483 2 18 PHE HB3 2 35 LEU QD 4.142 2.444 5.858 3.571 3.313 3.793 . 0 0 "[ . 1]" 1
2484 3 18 PHE HB3 3 35 LEU QD 4.142 2.444 5.858 3.338 2.623 3.660 . 0 0 "[ . 1]" 1
2485 2 17 TYR HB2 3 10 ILE MG 3.431 2.254 4.608 3.073 2.944 3.227 . 0 0 "[ . 1]" 1
2486 2 10 ILE MG 3 17 TYR HB2 3.431 2.254 4.608 3.078 2.963 3.333 . 0 0 "[ . 1]" 1
2487 2 31 GLY HA2 3 45 ALA MB 3.847 2.367 5.327 2.554 2.242 2.838 0.125 6 0 "[ . 1]" 1
2488 2 45 ALA MB 3 31 GLY HA2 3.847 2.367 5.327 2.353 1.980 2.871 0.387 6 0 "[ . 1]" 1
2489 2 27 ILE MD 2 31 GLY HA3 2.961 2.084 3.838 2.696 2.385 3.156 . 0 0 "[ . 1]" 1
2490 3 27 ILE MD 3 31 GLY HA3 2.961 2.084 3.838 2.383 2.135 2.784 . 0 0 "[ . 1]" 1
2491 2 48 PHE HA 2 49 GLU QB 5.487 2.476 8.498 4.343 4.039 4.583 . 0 0 "[ . 1]" 1
2492 3 48 PHE HA 3 49 GLU QB 5.487 2.476 8.498 4.392 3.937 4.683 . 0 0 "[ . 1]" 1
2493 2 48 PHE HA 2 52 ALA MB 4.533 2.478 6.588 4.588 4.327 4.976 . 0 0 "[ . 1]" 1
2494 3 48 PHE HA 3 52 ALA MB 4.533 2.478 6.588 4.718 4.324 5.046 . 0 0 "[ . 1]" 1
2495 2 48 PHE HA 2 56 ILE MD 4.389 2.463 6.315 4.855 4.652 5.059 . 0 0 "[ . 1]" 1
2496 3 48 PHE HA 3 56 ILE MD 4.389 2.463 6.315 5.131 4.697 5.544 . 0 0 "[ . 1]" 1
2497 2 7 LYS HA 2 10 ILE MG 4.293 2.450 6.136 4.110 3.942 4.306 . 0 0 "[ . 1]" 1
2498 3 7 LYS HA 3 10 ILE MG 4.293 2.450 6.136 3.928 3.768 4.104 . 0 0 "[ . 1]" 1
2499 2 50 ARG HA 2 50 ARG HD2 4.503 2.475 6.531 4.606 3.800 4.816 . 0 0 "[ . 1]" 1
2500 3 50 ARG HA 3 50 ARG HD2 4.503 2.475 6.531 4.646 4.471 4.805 . 0 0 "[ . 1]" 1
2501 2 9 GLU HA 2 57 LEU QD 3.054 2.121 3.987 3.027 2.469 3.339 . 0 0 "[ . 1]" 1
2502 3 9 GLU HA 3 57 LEU QD 3.054 2.121 3.987 3.116 2.504 4.469 0.482 9 0 "[ . 1]" 1
2503 2 17 TYR HA 2 21 ILE QG 4.081 2.416 5.746 3.745 3.606 3.935 . 0 0 "[ . 1]" 1
2504 3 17 TYR HA 3 21 ILE QG 4.081 2.416 5.746 3.773 3.658 3.922 . 0 0 "[ . 1]" 1
2505 2 54 SER HB3 2 57 LEU QB 5.358 2.487 8.229 5.481 5.109 5.968 . 0 0 "[ . 1]" 1
2506 3 54 SER HB2 3 57 LEU QB 5.358 2.487 8.229 6.298 5.849 6.711 . 0 0 "[ . 1]" 1
2507 2 15 VAL HA 2 18 PHE QD 4.630 2.487 6.773 3.676 2.903 4.221 . 0 0 "[ . 1]" 1
2508 3 15 VAL HA 3 18 PHE QD 4.630 2.487 6.773 3.543 3.240 3.796 . 0 0 "[ . 1]" 1
2509 2 15 VAL HA 2 16 ASN H 3.382 2.238 4.526 3.488 3.446 3.508 . 0 0 "[ . 1]" 1
2510 3 15 VAL HA 3 16 ASN H 3.382 2.238 4.526 3.474 3.452 3.509 . 0 0 "[ . 1]" 1
2511 2 15 VAL HA 2 15 VAL HB 2.916 2.066 3.766 2.444 2.393 2.480 . 0 0 "[ . 1]" 1
2512 3 15 VAL HA 3 15 VAL HB 2.916 2.066 3.766 2.463 2.412 2.505 . 0 0 "[ . 1]" 1
2513 2 14 ILE MG 2 15 VAL HA 3.142 2.155 4.129 3.135 2.743 3.620 . 0 0 "[ . 1]" 1
2514 3 14 ILE MG 3 15 VAL HA 3.142 2.155 4.129 3.173 2.658 3.748 . 0 0 "[ . 1]" 1
2515 2 6 SER H 2 6 SER HB2 3.540 2.287 4.793 3.138 2.673 3.704 . 0 0 "[ . 1]" 1
2516 3 6 SER H 3 6 SER HB2 3.540 2.287 4.793 3.199 2.712 3.684 . 0 0 "[ . 1]" 1
2517 2 70 ILE H 2 73 SER QB 5.055 2.500 7.610 5.412 3.951 7.303 . 0 0 "[ . 1]" 1
2518 3 70 ILE H 3 73 SER QB 5.055 2.500 7.610 5.376 3.648 7.691 0.081 10 0 "[ . 1]" 1
2519 2 70 ILE H 2 70 ILE HA 3.428 2.253 4.603 2.884 2.844 2.918 . 0 0 "[ . 1]" 1
2520 3 70 ILE H 3 70 ILE HA 3.428 2.253 4.603 2.891 2.865 2.917 . 0 0 "[ . 1]" 1
2521 2 43 SER HA 2 48 PHE HZ 3.776 2.351 5.201 3.452 3.109 3.725 . 0 0 "[ . 1]" 1
2522 3 43 SER HA 3 48 PHE HZ 3.776 2.351 5.201 3.501 3.017 3.820 . 0 0 "[ . 1]" 1
2523 2 43 SER HA 2 48 PHE QE 4.049 2.410 5.688 2.177 1.991 2.521 0.419 6 0 "[ . 1]" 1
2524 3 43 SER HA 3 48 PHE QE 4.049 2.410 5.688 2.202 2.045 2.439 0.365 2 0 "[ . 1]" 1
2525 2 46 PHE H 2 47 GLY HA3 5.281 2.492 8.070 5.001 4.892 5.113 . 0 0 "[ . 1]" 1
2526 3 46 PHE H 3 47 GLY HA3 5.281 2.492 8.070 5.024 4.966 5.103 . 0 0 "[ . 1]" 1
2527 2 16 ASN H 2 53 VAL QG . 2.439 3.622 3.059 2.881 3.264 . 0 0 "[ . 1]" 1
2528 3 16 ASN H 3 53 VAL QG . 2.439 3.622 3.259 2.856 5.170 1.548 9 1 "[ . +1]" 1
2529 2 35 LEU QD 3 42 ILE QG 3.825 2.362 5.288 2.487 1.951 2.964 0.411 2 0 "[ . 1]" 1
2530 2 42 ILE HG13 3 35 LEU QD 3.825 2.362 5.288 3.719 3.397 4.272 . 0 0 "[ . 1]" 1
2531 2 21 ILE HB 2 35 LEU QD 2.533 . 3.174 3.140 2.583 3.402 0.228 3 0 "[ . 1]" 1
2532 3 21 ILE HB 3 35 LEU QD 2.533 . 3.174 2.872 2.590 3.155 . 0 0 "[ . 1]" 1
2533 2 56 ILE HA 2 56 ILE HB 3.410 2.247 4.573 3.017 3.007 3.023 . 0 0 "[ . 1]" 1
2534 3 56 ILE HA 3 56 ILE HB 3.410 2.247 4.573 2.987 2.712 3.023 . 0 0 "[ . 1]" 1
2535 2 70 ILE HA 2 70 ILE HB 3.400 2.244 4.556 3.018 3.006 3.026 . 0 0 "[ . 1]" 1
2536 3 70 ILE HA 3 70 ILE HB 3.400 2.244 4.556 2.992 2.751 3.026 . 0 0 "[ . 1]" 1
2537 2 9 GLU HA 2 57 LEU HG 4.305 2.452 6.158 4.859 3.927 5.575 . 0 0 "[ . 1]" 1
2538 3 9 GLU HA 3 57 LEU HG 4.305 2.452 6.158 4.573 3.662 5.338 . 0 0 "[ . 1]" 1
2539 2 50 ARG HA 2 53 VAL QG 3.306 2.213 4.399 3.475 2.705 4.193 . 0 0 "[ . 1]" 1
2540 3 50 ARG HA 3 53 VAL QG 3.306 2.213 4.399 3.494 2.466 5.472 1.073 9 1 "[ . +1]" 1
2541 2 53 VAL QG 2 54 SER HA 4.212 2.437 5.987 3.611 3.380 3.855 . 0 0 "[ . 1]" 1
2542 3 53 VAL QG 3 54 SER HA 4.212 2.437 5.987 3.496 3.150 3.731 . 0 0 "[ . 1]" 1
2543 2 42 ILE MG 2 43 SER HA 3.499 2.275 4.723 3.336 3.070 3.555 . 0 0 "[ . 1]" 1
2544 3 42 ILE MG 3 43 SER HA 3.499 2.275 4.723 3.458 2.949 3.915 . 0 0 "[ . 1]" 1
2545 2 54 SER HB3 3 70 ILE MG 3.649 2.317 4.981 3.077 1.933 4.934 0.384 9 0 "[ . 1]" 1
2546 2 70 ILE MG 3 54 SER HB2 3.649 2.317 4.981 4.212 3.476 5.681 0.700 4 1 "[ +. 1]" 1
2547 2 39 MET HA 2 42 ILE HB 3.250 2.194 4.306 2.881 2.545 3.354 . 0 0 "[ . 1]" 1
2548 3 39 MET HA 3 42 ILE HB 3.250 2.194 4.306 3.380 3.000 3.904 . 0 0 "[ . 1]" 1
2549 2 27 ILE HG13 2 28 SER HA 5.518 2.473 8.563 5.071 4.319 5.443 . 0 0 "[ . 1]" 1
2550 3 27 ILE HG13 3 28 SER HA 5.518 2.473 8.563 5.259 5.061 5.501 . 0 0 "[ . 1]" 1
2551 2 27 ILE HA 2 35 LEU QD 4.344 2.457 6.231 5.426 5.203 5.736 . 0 0 "[ . 1]" 1
2552 3 27 ILE HA 3 35 LEU QD 4.344 2.457 6.231 5.425 5.139 5.713 . 0 0 "[ . 1]" 1
2553 2 24 LYS HA 2 24 LYS HE2 5.481 2.477 8.485 5.681 4.543 6.205 . 0 0 "[ . 1]" 1
2554 3 24 LYS HA 3 24 LYS HE2 5.481 2.477 8.485 5.505 4.310 6.180 . 0 0 "[ . 1]" 1
2555 2 31 GLY HA3 3 45 ALA HA 4.227 2.441 6.013 3.468 2.770 4.337 . 0 0 "[ . 1]" 1
2556 2 45 ALA HA 3 31 GLY HA3 4.227 2.441 6.013 3.910 3.481 4.277 . 0 0 "[ . 1]" 1
2557 2 31 GLY HA2 3 45 ALA HA 3.400 2.244 4.556 3.142 2.567 3.791 . 0 0 "[ . 1]" 1
2558 2 45 ALA HA 3 31 GLY HA2 3.400 2.244 4.556 3.436 2.933 3.928 . 0 0 "[ . 1]" 1
2559 2 7 LYS HE2 3 26 GLU QB 3.288 2.207 4.369 2.107 1.888 2.477 0.319 1 0 "[ . 1]" 1
2560 2 26 GLU HB3 3 7 LYS HE2 3.288 2.207 4.369 2.078 1.973 2.211 0.234 9 0 "[ . 1]" 1
2561 2 7 LYS HE3 3 26 GLU QB 3.130 2.150 4.110 2.593 2.178 2.991 . 0 0 "[ . 1]" 1
2562 2 26 GLU HB3 3 7 LYS HE3 3.130 2.150 4.110 2.845 2.457 3.629 . 0 0 "[ . 1]" 1
2563 2 10 ILE HA 2 10 ILE HG12 3.948 2.390 5.506 3.056 2.916 3.190 . 0 0 "[ . 1]" 1
2564 3 10 ILE HA 3 10 ILE HG12 3.948 2.390 5.506 3.047 2.938 3.124 . 0 0 "[ . 1]" 1
2565 2 10 ILE HG12 2 10 ILE MG 2.871 2.047 3.695 3.200 3.188 3.208 . 0 0 "[ . 1]" 1
2566 3 10 ILE HG12 3 10 ILE MG 2.871 2.047 3.695 3.200 3.192 3.210 . 0 0 "[ . 1]" 1
2567 2 14 ILE HB 2 14 ILE HG13 2.867 2.045 3.689 2.710 2.451 3.021 . 0 0 "[ . 1]" 1
2568 3 14 ILE HB 3 14 ILE HG13 2.867 2.045 3.689 2.811 2.458 3.025 . 0 0 "[ . 1]" 1
2569 2 8 GLU HG3 2 11 ALA MB 3.897 2.378 5.416 4.259 3.762 5.047 . 0 0 "[ . 1]" 1
2570 3 8 GLU QG 3 11 ALA MB 3.897 2.378 5.416 4.229 3.758 5.256 . 0 0 "[ . 1]" 1
2571 2 42 ILE HA 2 42 ILE HB 3.734 2.340 5.128 3.020 3.009 3.029 . 0 0 "[ . 1]" 1
2572 3 42 ILE HA 3 42 ILE HB 3.734 2.340 5.128 3.016 2.986 3.030 . 0 0 "[ . 1]" 1
2573 2 15 VAL QG 2 42 ILE HB 2.859 2.042 3.676 3.305 2.785 3.743 0.067 2 0 "[ . 1]" 1
2574 3 15 VAL QG 3 42 ILE HB 2.859 2.042 3.676 2.857 2.390 3.197 . 0 0 "[ . 1]" 1
2575 2 73 SER HA 2 73 SER QB 3.347 2.227 4.467 2.270 2.160 2.396 0.067 1 0 "[ . 1]" 1
2576 3 73 SER HA 3 73 SER QB 3.347 2.227 4.467 2.292 2.178 2.395 0.049 1 0 "[ . 1]" 1
2577 2 66 HIS HB2 2 66 HIS HD2 3.955 2.391 5.519 3.232 2.709 3.876 . 0 0 "[ . 1]" 1
2578 3 66 HIS HB2 3 66 HIS HD2 3.955 2.391 5.519 3.237 2.689 3.888 . 0 0 "[ . 1]" 1
2579 2 66 HIS H 2 66 HIS HB3 4.267 2.446 6.088 3.193 2.540 3.581 . 0 0 "[ . 1]" 1
2580 3 66 HIS H 3 66 HIS HB3 4.267 2.446 6.088 3.201 2.573 3.586 . 0 0 "[ . 1]" 1
2581 2 66 HIS H 2 66 HIS HB2 3.966 2.393 5.539 3.457 2.319 3.988 0.074 4 0 "[ . 1]" 1
2582 3 66 HIS H 3 66 HIS HB2 3.966 2.393 5.539 3.381 2.197 3.994 0.196 4 0 "[ . 1]" 1
2583 2 37 VAL HA 2 38 ALA MB 4.694 2.491 6.897 5.025 5.005 5.042 . 0 0 "[ . 1]" 1
2584 3 37 VAL HA 3 38 ALA MB 4.694 2.491 6.897 5.033 5.004 5.053 . 0 0 "[ . 1]" 1
2585 2 28 SER HB3 2 30 ASP H 4.710 2.491 6.929 4.208 3.764 4.703 . 0 0 "[ . 1]" 1
2586 3 28 SER HB3 3 30 ASP H 4.710 2.491 6.929 3.732 3.149 4.495 . 0 0 "[ . 1]" 1
2587 2 5 ALA MB 2 10 ILE HA 4.121 2.423 5.819 4.542 3.991 5.538 . 0 0 "[ . 1]" 1
2588 3 5 ALA MB 3 10 ILE HA 4.121 2.423 5.819 4.536 3.928 5.233 . 0 0 "[ . 1]" 1
2589 2 41 CYS H 2 41 CYS QB 3.382 2.238 4.526 2.400 2.092 2.618 0.146 9 0 "[ . 1]" 1
2590 3 41 CYS H 3 41 CYS QB 3.382 2.238 4.526 2.332 2.101 2.609 0.137 5 0 "[ . 1]" 1
2591 2 37 VAL QG 2 41 CYS QB 3.832 2.363 5.301 3.785 3.014 4.349 . 0 0 "[ . 1]" 1
2592 3 37 VAL QG 3 41 CYS QB 3.832 2.363 5.301 3.802 3.126 4.263 . 0 0 "[ . 1]" 1
2593 2 41 CYS H 2 41 CYS HA 4.013 2.403 5.623 2.800 2.754 2.832 . 0 0 "[ . 1]" 1
2594 3 41 CYS H 3 41 CYS HA 4.013 2.403 5.623 2.814 2.798 2.830 . 0 0 "[ . 1]" 1
2595 2 27 ILE HG13 2 31 GLY HA2 5.736 2.446 9.026 5.502 4.385 6.264 . 0 0 "[ . 1]" 1
2596 3 27 ILE HG13 3 31 GLY HA2 5.736 2.446 9.026 5.562 5.357 5.780 . 0 0 "[ . 1]" 1
2597 2 39 MET HA 2 39 MET HG3 3.899 2.378 5.420 2.888 2.677 3.219 . 0 0 "[ . 1]" 1
2598 3 39 MET HA 3 39 MET HG3 3.899 2.378 5.420 2.760 2.552 3.113 . 0 0 "[ . 1]" 1
2599 2 35 LEU HA 2 35 LEU HB3 3.450 2.260 4.640 2.452 2.387 2.493 . 0 0 "[ . 1]" 1
2600 3 35 LEU HA 3 35 LEU HB3 3.450 2.260 4.640 2.432 2.406 2.482 . 0 0 "[ . 1]" 1
2601 2 27 ILE HG12 2 31 GLY HA3 2.753 . 3.511 2.679 2.237 3.165 . 0 0 "[ . 1]" 1
2602 3 27 ILE HG12 3 31 GLY HA3 2.753 . 3.511 2.503 2.274 2.685 . 0 0 "[ . 1]" 1
2603 2 24 LYS HB3 2 24 LYS HE2 4.469 2.472 6.466 4.471 4.088 5.269 . 0 0 "[ . 1]" 1
2604 3 24 LYS HB3 3 24 LYS HE2 4.469 2.472 6.466 4.330 2.016 5.451 0.456 6 0 "[ . 1]" 1
2605 2 39 MET H 2 39 MET HG3 3.711 2.334 5.088 4.317 2.921 4.616 . 0 0 "[ . 1]" 1
2606 3 39 MET H 3 39 MET HG3 3.711 2.334 5.088 3.655 2.534 4.401 . 0 0 "[ . 1]" 1
2607 2 14 ILE HA 2 18 PHE H 3.798 2.356 5.240 3.943 3.742 4.085 . 0 0 "[ . 1]" 1
2608 3 14 ILE HA 3 18 PHE H 3.798 2.356 5.240 3.986 3.866 4.106 . 0 0 "[ . 1]" 1
2609 2 14 ILE MD 2 15 VAL H 4.649 2.488 6.810 4.286 4.065 4.461 . 0 0 "[ . 1]" 1
2610 3 14 ILE MD 3 15 VAL H 4.649 2.488 6.810 4.278 4.084 4.401 . 0 0 "[ . 1]" 1
2611 2 15 VAL HB 2 16 ASN HA 3.417 2.249 4.585 4.589 4.481 4.742 0.157 8 0 "[ . 1]" 1
2612 3 15 VAL HB 3 16 ASN HA 3.417 2.249 4.585 4.578 4.473 4.713 0.128 10 0 "[ . 1]" 1
2613 2 21 ILE MD 2 35 LEU QD 2.927 . 6.000 4.461 4.094 4.708 . 0 0 "[ . 1]" 1
2614 3 21 ILE MD 3 35 LEU QD 2.927 . 6.000 4.316 3.911 4.590 . 0 0 "[ . 1]" 1
2615 2 15 VAL QG 2 43 SER QB 2.495 . 3.118 3.530 3.366 3.728 0.610 8 1 "[ . + 1]" 1
2616 3 15 VAL QG 3 43 SER QB 2.495 . 3.118 3.663 3.371 3.975 0.857 7 6 "[ ***.-+* 1]" 1
2617 2 8 GLU HG3 2 56 ILE MG 4.254 2.444 6.064 4.078 3.098 5.401 . 0 0 "[ . 1]" 1
2618 2 10 ILE HA 2 10 ILE HB 3.723 2.337 5.109 3.022 3.010 3.030 . 0 0 "[ . 1]" 1
2619 3 10 ILE HA 3 10 ILE HB 3.723 2.337 5.109 3.023 3.014 3.029 . 0 0 "[ . 1]" 1
2620 2 14 ILE HB 2 14 ILE HG12 3.336 2.223 4.449 2.754 2.372 3.026 . 0 0 "[ . 1]" 1
2621 3 14 ILE HB 3 14 ILE HG12 3.336 2.223 4.449 2.671 2.390 3.026 . 0 0 "[ . 1]" 1
2622 2 23 GLU HA 2 25 LYS QE 4.226 2.440 6.012 4.860 2.937 7.031 1.019 1 1 "[+ . 1]" 1
2623 3 23 GLU HA 3 25 LYS HE2 4.226 2.440 6.012 5.337 3.662 6.039 0.027 9 0 "[ . 1]" 1
2624 2 14 ILE HB 2 15 VAL H 3.061 2.124 3.998 2.497 2.220 2.928 . 0 0 "[ . 1]" 1
2625 3 14 ILE HB 3 15 VAL H 3.061 2.124 3.998 2.623 2.165 2.941 . 0 0 "[ . 1]" 1
2626 2 64 GLY H 2 64 GLY HA2 3.864 2.371 5.357 2.911 2.847 2.955 . 0 0 "[ . 1]" 1
2627 3 64 GLY H 3 64 GLY HA2 3.864 2.371 5.357 2.914 2.875 2.944 . 0 0 "[ . 1]" 1
2628 2 17 TYR HA 2 18 PHE H 4.091 2.417 5.765 3.549 3.526 3.565 . 0 0 "[ . 1]" 1
2629 3 17 TYR HA 3 18 PHE H 4.091 2.417 5.765 3.539 3.513 3.561 . 0 0 "[ . 1]" 1
2630 2 18 PHE QD 2 39 MET HA 4.669 2.489 6.849 3.209 2.565 3.674 . 0 0 "[ . 1]" 1
2631 3 18 PHE QD 3 39 MET HA 4.669 2.489 6.849 3.030 2.342 3.437 0.147 8 0 "[ . 1]" 1
2632 2 21 ILE HA 2 26 GLU H 3.726 2.338 5.114 3.712 3.282 4.054 . 0 0 "[ . 1]" 1
2633 3 21 ILE HA 3 26 GLU H 3.726 2.338 5.114 3.649 3.362 3.946 . 0 0 "[ . 1]" 1
2634 2 17 TYR HB3 2 19 SER H 5.523 2.473 8.573 5.394 5.003 5.737 . 0 0 "[ . 1]" 1
2635 3 17 TYR HB3 3 19 SER H 5.523 2.473 8.573 5.317 5.015 5.555 . 0 0 "[ . 1]" 1
2636 2 50 ARG HE 2 50 ARG QG 3.618 2.448 4.927 2.622 2.077 3.049 0.371 9 0 "[ . 1]" 1
2637 3 50 ARG HE 3 50 ARG QG 3.618 2.448 4.927 2.631 2.255 3.177 0.193 10 0 "[ . 1]" 1
2638 2 27 ILE HG12 2 32 ALA H 3.712 2.334 5.090 3.642 2.953 4.214 . 0 0 "[ . 1]" 1
2639 3 27 ILE HG12 3 32 ALA H 3.712 2.334 5.090 3.643 3.247 4.077 . 0 0 "[ . 1]" 1
2640 2 18 PHE H 2 21 ILE MD 4.849 2.498 7.200 5.866 5.431 6.349 . 0 0 "[ . 1]" 1
2641 3 18 PHE H 3 21 ILE MD 4.849 2.498 7.200 5.944 5.643 6.090 . 0 0 "[ . 1]" 1
2642 2 17 TYR QD 2 21 ILE MD 4.190 2.435 5.945 3.478 2.915 4.911 . 0 0 "[ . 1]" 1
2643 3 17 TYR QD 3 21 ILE MD 4.190 2.435 5.945 3.429 2.913 4.045 . 0 0 "[ . 1]" 1
2644 2 17 TYR QD 2 21 ILE QG 4.018 2.404 5.632 3.098 2.592 4.353 . 0 0 "[ . 1]" 1
2645 3 17 TYR QD 3 21 ILE QG 4.018 2.404 5.632 3.043 2.238 3.667 0.166 5 0 "[ . 1]" 1
2646 2 17 TYR QD 2 18 PHE QD 4.916 2.500 7.332 4.183 2.539 5.393 . 0 0 "[ . 1]" 1
2647 3 17 TYR QD 3 18 PHE QD 4.916 2.500 7.332 4.224 2.660 5.354 . 0 0 "[ . 1]" 1
2648 2 46 PHE HB3 2 48 PHE QD 5.251 2.494 8.008 2.758 2.467 3.157 0.027 5 0 "[ . 1]" 1
2649 3 46 PHE HB3 3 48 PHE QD 5.251 2.494 8.008 3.006 2.730 3.489 . 0 0 "[ . 1]" 1
2650 2 48 PHE QD 2 49 GLU QB 4.756 2.494 7.018 4.474 4.191 4.729 . 0 0 "[ . 1]" 1
2651 3 48 PHE QD 3 49 GLU QB 4.756 2.494 7.018 4.457 4.209 4.705 . 0 0 "[ . 1]" 1
2652 2 15 VAL QG 2 48 PHE QD 4.648 2.488 5.462 3.788 3.661 3.940 . 0 0 "[ . 1]" 1
2653 3 15 VAL QG 3 48 PHE QD 4.648 2.488 5.462 3.923 3.638 4.055 . 0 0 "[ . 1]" 1
2654 2 11 ALA MB 2 48 PHE QD 3.828 2.363 5.293 3.683 3.472 3.974 . 0 0 "[ . 1]" 1
2655 3 11 ALA MB 3 48 PHE QD 3.828 2.363 5.293 3.668 3.359 4.058 . 0 0 "[ . 1]" 1
2656 2 8 GLU HG3 2 46 PHE QD 4.707 2.491 6.923 4.793 3.870 5.559 . 0 0 "[ . 1]" 1
2657 3 8 GLU QG 3 46 PHE QD 4.707 2.491 6.923 5.044 4.021 5.864 . 0 0 "[ . 1]" 1
2658 2 14 ILE MG 2 18 PHE QE 3.562 2.294 4.830 2.784 2.426 3.033 . 0 0 "[ . 1]" 1
2659 3 14 ILE MG 3 18 PHE QE 3.562 2.294 4.830 2.918 2.746 3.151 . 0 0 "[ . 1]" 1
2660 2 11 ALA MB 2 48 PHE QE 2.801 2.017 3.585 2.350 2.184 2.604 . 0 0 "[ . 1]" 1
2661 3 11 ALA MB 3 48 PHE QE 2.801 2.017 3.585 2.232 2.040 2.585 . 0 0 "[ . 1]" 1
2662 2 46 PHE HB2 2 48 PHE QE 4.037 2.407 5.667 2.313 2.011 2.526 0.396 2 0 "[ . 1]" 1
2663 3 46 PHE HB2 3 48 PHE QE 4.037 2.407 5.667 2.470 2.017 3.050 0.390 5 0 "[ . 1]" 1
2664 2 9 GLU HB3 2 62 PHE QD 4.581 2.483 6.679 4.866 3.576 7.568 0.889 4 1 "[ +. 1]" 1
2665 3 9 GLU HB3 3 62 PHE QD 4.581 2.483 6.679 4.917 3.786 7.364 0.685 4 1 "[ +. 1]" 1
2666 2 56 ILE HB 2 62 PHE QD 5.242 2.494 7.990 7.879 7.163 8.630 0.640 4 1 "[ +. 1]" 1
2667 3 56 ILE HB 3 62 PHE QD 5.242 2.494 7.990 7.765 7.038 8.354 0.364 4 0 "[ . 1]" 1
2668 2 13 LEU MD2 2 62 PHE QD 4.080 2.415 5.745 3.020 2.056 3.941 0.359 4 0 "[ . 1]" 1
2669 3 13 LEU MD2 3 62 PHE QD 4.080 2.415 5.745 3.250 2.009 4.289 0.406 4 0 "[ . 1]" 1
2670 2 18 PHE HZ 3 14 ILE MD 3.839 2.365 5.313 3.980 2.266 5.794 0.481 9 0 "[ . 1]" 1
2671 2 14 ILE MD 3 18 PHE HZ 3.839 2.365 5.313 3.303 2.273 5.305 0.092 4 0 "[ . 1]" 1
2672 2 18 PHE QE 3 14 ILE MD 4.584 2.483 6.685 3.441 2.427 5.294 0.056 1 0 "[ . 1]" 1
2673 2 14 ILE MD 3 18 PHE QE 4.584 2.483 6.685 2.898 1.953 4.712 0.530 3 1 "[ + . 1]" 1
2674 2 5 ALA H 2 5 ALA HA 2.387 . 2.957 2.907 2.790 2.944 . 0 0 "[ . 1]" 1
2675 3 5 ALA H 3 5 ALA HA 2.387 . 2.957 2.890 2.671 2.941 . 0 0 "[ . 1]" 1
2676 2 5 ALA H 2 5 ALA MB 2.281 . 2.801 2.357 2.230 2.684 . 0 0 "[ . 1]" 1
2677 3 5 ALA H 3 5 ALA MB 2.281 . 2.801 2.401 2.226 2.613 . 0 0 "[ . 1]" 1
2678 2 50 ARG H 2 50 ARG QG 2.706 2.371 3.438 1.933 1.607 2.445 0.764 1 5 "[+- .** *]" 1
2679 3 50 ARG H 3 50 ARG QG 2.706 2.371 3.438 1.819 1.657 2.201 0.714 3 6 "[* +*.* - *]" 1
2680 2 50 ARG H 2 50 ARG HB2 2.395 . 2.968 2.809 2.501 3.581 0.613 9 1 "[ . +1]" 1
2681 3 50 ARG H 3 50 ARG HB2 2.395 . 2.968 2.981 2.645 3.533 0.565 3 2 "[ + . -]" 1
2682 2 49 GLU HA 2 50 ARG H 2.339 . 2.886 2.248 2.151 2.324 . 0 0 "[ . 1]" 1
2683 3 49 GLU HA 3 50 ARG H 2.339 . 2.886 2.211 2.159 2.265 . 0 0 "[ . 1]" 1
2684 2 31 GLY H 2 32 ALA H 2.811 2.021 3.601 2.602 2.499 2.739 . 0 0 "[ . 1]" 1
2685 3 31 GLY H 3 32 ALA H 2.811 2.021 3.601 2.609 2.566 2.650 . 0 0 "[ . 1]" 1
2686 2 32 ALA H 2 33 ASP H 2.752 . 3.509 2.679 2.607 2.761 . 0 0 "[ . 1]" 1
2687 3 32 ALA H 3 33 ASP H 2.752 . 3.509 2.729 2.620 2.830 . 0 0 "[ . 1]" 1
2688 2 32 ALA H 2 32 ALA MB 2.191 . 2.671 2.217 2.167 2.248 . 0 0 "[ . 1]" 1
2689 3 32 ALA H 3 32 ALA MB 2.191 . 2.671 2.225 2.212 2.240 . 0 0 "[ . 1]" 1
2690 2 27 ILE MG 2 32 ALA H 2.771 2.003 3.539 2.825 2.671 3.119 . 0 0 "[ . 1]" 1
2691 3 27 ILE MG 3 32 ALA H 2.771 2.003 3.539 2.667 2.458 2.847 . 0 0 "[ . 1]" 1
2692 2 27 ILE MD 2 32 ALA H 3.473 2.267 4.679 3.991 3.510 4.686 0.007 2 0 "[ . 1]" 1
2693 3 27 ILE MD 3 32 ALA H 3.473 2.267 4.679 3.802 3.456 4.190 . 0 0 "[ . 1]" 1
2694 2 29 GLU HA 2 32 ALA H 3.216 2.182 4.250 3.416 3.236 3.724 . 0 0 "[ . 1]" 1
2695 3 29 GLU HA 3 32 ALA H 3.216 2.182 4.250 3.384 3.255 3.515 . 0 0 "[ . 1]" 1
2696 2 32 ALA H 2 32 ALA HA 2.737 . 3.486 2.807 2.797 2.820 . 0 0 "[ . 1]" 1
2697 3 32 ALA H 3 32 ALA HA 2.737 . 3.486 2.795 2.771 2.814 . 0 0 "[ . 1]" 1
2698 2 31 GLY HA3 2 32 ALA H 2.837 2.032 3.642 2.811 2.727 2.910 . 0 0 "[ . 1]" 1
2699 3 31 GLY HA3 3 32 ALA H 2.837 2.032 3.642 2.838 2.759 2.934 . 0 0 "[ . 1]" 1
2700 2 21 ILE H 2 22 VAL H 2.762 . 3.525 2.367 2.312 2.408 . 0 0 "[ . 1]" 1
2701 3 21 ILE H 3 22 VAL H 2.762 . 3.525 2.399 2.313 2.436 . 0 0 "[ . 1]" 1
2702 2 20 SER HB2 2 21 ILE H 3.360 2.231 4.489 3.732 3.157 4.076 . 0 0 "[ . 1]" 1
2703 3 20 SER HB2 3 21 ILE H 3.360 2.231 4.489 3.649 3.095 3.970 . 0 0 "[ . 1]" 1
2704 2 21 ILE H 2 21 ILE HA 2.994 2.098 3.890 2.899 2.889 2.915 . 0 0 "[ . 1]" 1
2705 3 21 ILE H 3 21 ILE HA 2.994 2.098 3.890 2.891 2.878 2.903 . 0 0 "[ . 1]" 1
2706 2 21 ILE H 2 21 ILE HB 2.562 . 3.219 2.417 2.340 2.530 . 0 0 "[ . 1]" 1
2707 3 21 ILE H 3 21 ILE HB 2.562 . 3.219 2.400 2.255 2.470 . 0 0 "[ . 1]" 1
2708 2 21 ILE H 2 21 ILE QG 2.564 2.390 3.221 2.592 2.421 2.741 . 0 0 "[ . 1]" 1
2709 3 21 ILE H 3 21 ILE QG 2.564 2.390 3.221 2.589 2.429 2.827 . 0 0 "[ . 1]" 1
2710 2 6 SER H 2 9 GLU HB3 4.537 2.478 6.596 4.110 3.806 4.585 . 0 0 "[ . 1]" 1
2711 3 6 SER H 3 9 GLU HB3 4.537 2.478 6.596 4.169 3.733 4.846 . 0 0 "[ . 1]" 1
2712 2 5 ALA MB 2 6 SER H 2.796 2.014 3.578 2.834 2.280 3.179 . 0 0 "[ . 1]" 1
2713 3 5 ALA MB 3 6 SER H 2.796 2.014 3.578 2.704 2.331 2.985 . 0 0 "[ . 1]" 1
2714 2 6 SER H 2 9 GLU HB2 3.130 2.150 4.110 2.694 2.375 3.266 . 0 0 "[ . 1]" 1
2715 3 6 SER H 3 9 GLU HB2 3.130 2.150 4.110 2.704 2.274 3.507 . 0 0 "[ . 1]" 1
2716 2 6 SER H 2 6 SER HB3 3.252 2.195 4.309 3.191 2.530 3.669 . 0 0 "[ . 1]" 1
2717 3 6 SER H 3 6 SER HB3 3.252 2.195 4.309 3.293 2.661 3.720 . 0 0 "[ . 1]" 1
2718 2 5 ALA H 2 6 SER H 4.351 2.458 6.244 4.499 4.353 4.575 . 0 0 "[ . 1]" 1
2719 3 5 ALA H 3 6 SER H 4.351 2.458 6.244 4.486 4.350 4.634 . 0 0 "[ . 1]" 1
2720 2 6 SER HB3 2 7 LYS H 3.738 2.341 5.135 3.321 2.440 3.902 . 0 0 "[ . 1]" 1
2721 3 6 SER HB3 3 7 LYS H 3.738 2.341 5.135 3.333 2.666 3.743 . 0 0 "[ . 1]" 1
2722 2 7 LYS H 2 7 LYS HB3 2.723 . 3.465 2.737 2.509 2.964 . 0 0 "[ . 1]" 1
2723 3 7 LYS H 3 7 LYS QB 2.723 . 3.465 2.572 2.306 2.839 . 0 0 "[ . 1]" 1
2724 2 7 LYS H 2 7 LYS HG3 3.673 2.324 5.022 3.001 2.746 3.345 . 0 0 "[ . 1]" 1
2725 3 7 LYS H 3 7 LYS QG . 2.324 3.119 2.037 1.573 2.575 0.751 1 1 "[+ . 1]" 1
2726 2 7 LYS H 2 7 LYS HG2 2.496 . 3.119 1.890 1.601 2.217 0.272 1 0 "[ . 1]" 1
2727 2 27 ILE MD 2 28 SER H 3.687 2.327 5.047 3.497 2.532 3.789 . 0 0 "[ . 1]" 1
2728 3 27 ILE MD 3 28 SER H 3.687 2.327 5.047 3.684 3.515 3.876 . 0 0 "[ . 1]" 1
2729 2 11 ALA H 2 11 ALA MB 1.934 . 2.308 2.210 2.151 2.226 . 0 0 "[ . 1]" 1
2730 3 11 ALA H 3 11 ALA MB 1.934 . 2.308 2.205 2.172 2.229 . 0 0 "[ . 1]" 1
2731 2 11 ALA H 2 11 ALA HA 2.398 . 2.973 2.789 2.774 2.805 . 0 0 "[ . 1]" 1
2732 3 11 ALA H 3 11 ALA HA 2.398 . 2.973 2.792 2.770 2.823 . 0 0 "[ . 1]" 1
2733 2 58 GLY H 2 58 GLY HA2 2.465 . 3.073 2.304 2.278 2.343 . 0 0 "[ . 1]" 1
2734 3 58 GLY H 3 58 GLY HA2 2.465 . 3.073 2.298 2.279 2.337 . 0 0 "[ . 1]" 1
2735 2 57 LEU QB 2 58 GLY H 2.976 2.434 3.862 2.080 1.948 2.322 0.486 10 0 "[ . 1]" 1
2736 3 57 LEU QB 3 58 GLY H 2.976 2.434 3.862 2.230 1.861 2.517 0.573 9 1 "[ . +1]" 1
2737 2 35 LEU HA 2 36 ASN H 3.827 2.363 5.291 3.506 3.470 3.537 . 0 0 "[ . 1]" 1
2738 3 35 LEU HA 3 36 ASN H 3.827 2.363 5.291 3.483 3.448 3.513 . 0 0 "[ . 1]" 1
2739 2 17 TYR H 2 17 TYR HB3 2.611 . 3.293 3.201 2.689 3.584 0.291 2 0 "[ . 1]" 1
2740 3 17 TYR H 3 17 TYR HB3 2.611 . 3.293 3.162 2.657 3.516 0.223 2 0 "[ . 1]" 1
2741 2 17 TYR H 2 17 TYR HB2 3.112 2.144 4.080 2.242 2.110 2.392 0.034 7 0 "[ . 1]" 1
2742 3 17 TYR H 3 17 TYR HB2 3.112 2.144 4.080 2.240 2.110 2.465 0.034 6 0 "[ . 1]" 1
2743 2 16 ASN HB3 2 17 TYR H 2.468 . 3.077 2.542 2.303 2.780 . 0 0 "[ . 1]" 1
2744 3 16 ASN HB3 3 17 TYR H 2.468 . 3.077 2.716 2.440 2.941 . 0 0 "[ . 1]" 1
2745 2 52 ALA H 2 52 ALA HA 2.690 . 3.413 2.904 2.874 2.937 . 0 0 "[ . 1]" 1
2746 3 52 ALA H 3 52 ALA HA 2.690 . 3.413 2.915 2.826 2.943 . 0 0 "[ . 1]" 1
2747 2 51 GLU QB 2 52 ALA H 3.560 2.293 4.827 3.573 3.120 3.919 . 0 0 "[ . 1]" 1
2748 3 51 GLU QB 3 52 ALA H 3.560 2.293 4.827 3.610 3.193 3.946 . 0 0 "[ . 1]" 1
2749 2 9 GLU HB3 2 10 ILE H 3.575 2.297 4.853 3.476 3.269 3.607 . 0 0 "[ . 1]" 1
2750 3 9 GLU HB3 3 10 ILE H 3.575 2.297 4.853 3.571 3.413 3.697 . 0 0 "[ . 1]" 1
2751 2 15 VAL QG 2 52 ALA H 3.567 . 6.000 4.399 4.037 4.946 . 0 0 "[ . 1]" 1
2752 3 15 VAL QG 3 52 ALA H 3.567 . 6.000 4.428 3.864 4.810 . 0 0 "[ . 1]" 1
2753 2 18 PHE H 2 18 PHE HB2 2.693 . 3.418 2.348 2.245 2.465 . 0 0 "[ . 1]" 1
2754 3 18 PHE H 3 18 PHE HB2 2.693 . 3.418 2.331 2.221 2.408 . 0 0 "[ . 1]" 1
2755 2 22 VAL H 2 22 VAL HA 2.762 . 3.525 2.877 2.856 2.898 . 0 0 "[ . 1]" 1
2756 3 22 VAL H 3 22 VAL HA 2.762 . 3.525 2.879 2.862 2.897 . 0 0 "[ . 1]" 1
2757 2 27 ILE HA 2 28 SER H 2.293 . 2.819 2.394 2.296 2.545 . 0 0 "[ . 1]" 1
2758 3 27 ILE HA 3 28 SER H 2.293 . 2.819 2.395 2.298 2.474 . 0 0 "[ . 1]" 1
2759 2 28 SER H 2 28 SER HA 2.836 2.032 3.640 2.815 2.778 2.847 . 0 0 "[ . 1]" 1
2760 3 28 SER H 3 28 SER HA 2.836 2.032 3.640 2.803 2.774 2.832 . 0 0 "[ . 1]" 1
2761 2 28 SER H 2 28 SER HB3 2.701 . 3.431 3.140 2.684 3.505 0.074 1 0 "[ . 1]" 1
2762 3 28 SER H 3 28 SER HB3 2.701 . 3.431 3.295 2.740 3.595 0.164 10 0 "[ . 1]" 1
2763 2 28 SER HB2 2 30 ASP H 3.565 2.294 4.836 2.960 2.489 3.804 . 0 0 "[ . 1]" 1
2764 3 28 SER HB2 3 30 ASP H 3.565 2.294 4.836 2.921 2.351 3.283 . 0 0 "[ . 1]" 1
2765 2 30 ASP H 2 30 ASP HB3 3.035 2.114 3.956 3.258 2.556 3.559 . 0 0 "[ . 1]" 1
2766 3 30 ASP H 3 30 ASP HB3 3.035 2.114 3.956 3.045 2.605 3.583 . 0 0 "[ . 1]" 1
2767 2 30 ASP H 2 30 ASP HB2 3.389 2.241 4.537 2.255 2.095 2.465 0.146 5 0 "[ . 1]" 1
2768 3 30 ASP H 3 30 ASP HB2 3.389 2.241 4.537 2.399 2.162 2.771 0.079 7 0 "[ . 1]" 1
2769 2 37 VAL H 2 37 VAL HB 2.903 2.060 3.746 2.578 2.404 2.669 . 0 0 "[ . 1]" 1
2770 3 37 VAL H 3 37 VAL HB 2.903 2.060 3.746 2.625 2.480 2.743 . 0 0 "[ . 1]" 1
2771 2 37 VAL HB 2 41 CYS H 4.084 2.416 5.752 6.211 5.884 6.461 0.709 2 5 "[-+ *.* * 1]" 1
2772 3 37 VAL HB 3 41 CYS H 4.084 2.416 5.752 6.454 6.321 6.564 0.812 1 10 [+****-****] 1
2773 2 42 ILE H 2 42 ILE HG13 2.535 . 3.178 2.272 1.996 2.536 . 0 0 "[ . 1]" 1
2774 3 42 ILE H 3 42 ILE QG 2.535 2.441 3.178 2.271 1.761 3.476 0.680 4 2 "[ +. - 1]" 1
2775 2 42 ILE H 2 42 ILE HB 2.739 . 3.489 2.443 2.346 2.579 . 0 0 "[ . 1]" 1
2776 3 42 ILE H 3 42 ILE HB 2.739 . 3.489 2.478 2.210 2.731 . 0 0 "[ . 1]" 1
2777 2 16 ASN H 2 16 ASN HB3 2.425 . 3.013 2.367 2.185 2.627 . 0 0 "[ . 1]" 1
2778 3 16 ASN H 3 16 ASN HB3 2.425 . 3.013 2.295 2.107 2.553 . 0 0 "[ . 1]" 1
2779 2 16 ASN H 2 16 ASN HB2 2.456 . 3.059 2.735 2.420 2.975 . 0 0 "[ . 1]" 1
2780 3 16 ASN H 3 16 ASN HB2 2.456 . 3.059 2.885 2.596 3.154 0.095 6 0 "[ . 1]" 1
2781 2 15 VAL HB 2 16 ASN H 2.726 . 6.000 3.908 3.825 4.046 . 0 0 "[ . 1]" 1
2782 3 15 VAL HB 3 16 ASN H 2.726 . 6.000 3.980 3.849 4.058 . 0 0 "[ . 1]" 1
2783 2 43 SER H 2 43 SER QB 2.621 2.073 3.308 2.477 2.058 2.589 0.015 7 0 "[ . 1]" 1
2784 3 43 SER H 3 43 SER QB 2.621 2.073 3.308 2.518 2.477 2.595 . 0 0 "[ . 1]" 1
2785 2 42 ILE HG13 2 43 SER H 4.130 2.424 5.836 4.351 4.198 4.507 . 0 0 "[ . 1]" 1
2786 3 42 ILE QG 3 43 SER H 4.130 2.500 5.836 4.031 3.659 4.489 . 0 0 "[ . 1]" 1
2787 2 42 ILE HB 2 43 SER H 2.644 . 3.343 2.648 2.507 2.809 . 0 0 "[ . 1]" 1
2788 3 42 ILE HB 3 43 SER H 2.644 . 3.343 2.611 2.397 2.760 . 0 0 "[ . 1]" 1
2789 2 15 VAL QG 2 43 SER H 3.165 2.163 4.167 3.669 3.200 4.026 . 0 0 "[ . 1]" 1
2790 3 15 VAL QG 3 43 SER H 3.165 2.163 4.167 3.439 3.144 3.775 . 0 0 "[ . 1]" 1
2791 2 42 ILE MG 2 43 SER H 3.202 2.176 4.228 3.319 3.037 3.557 . 0 0 "[ . 1]" 1
2792 3 42 ILE MG 3 43 SER H 3.202 2.176 4.228 3.385 2.813 3.779 . 0 0 "[ . 1]" 1
2793 2 48 PHE H 2 48 PHE HB3 3.073 2.129 4.017 3.172 3.005 3.293 . 0 0 "[ . 1]" 1
2794 3 48 PHE H 3 48 PHE HB3 3.073 2.129 4.017 3.179 2.984 3.296 . 0 0 "[ . 1]" 1
2795 2 24 LYS HB2 2 25 LYS H 3.206 2.178 4.234 3.518 3.361 3.679 . 0 0 "[ . 1]" 1
2796 3 24 LYS HB2 3 25 LYS H 3.206 2.178 4.234 3.533 3.307 4.044 . 0 0 "[ . 1]" 1
2797 2 25 LYS H 2 25 LYS HG2 2.519 . 3.153 3.158 2.729 4.076 0.923 4 2 "[ +. -]" 1
2798 3 25 LYS H 3 25 LYS HG2 2.519 . 3.153 3.145 2.669 3.589 0.436 9 0 "[ . 1]" 1
2799 2 48 PHE H 2 48 PHE HA 2.773 2.004 3.542 2.907 2.889 2.938 . 0 0 "[ . 1]" 1
2800 3 48 PHE H 3 48 PHE HA 2.773 2.004 3.542 2.907 2.889 2.936 . 0 0 "[ . 1]" 1
2801 2 53 VAL HB 2 54 SER H 2.876 2.049 3.703 3.061 2.810 3.320 . 0 0 "[ . 1]" 1
2802 3 53 VAL HB 3 54 SER H 2.876 2.049 3.703 3.462 3.175 3.839 0.136 10 0 "[ . 1]" 1
2803 2 53 VAL QG 2 54 SER H 2.970 2.368 3.852 1.716 1.620 1.818 0.748 4 10 [***+*****-] 1
2804 3 53 VAL QG 3 54 SER H 2.970 2.368 3.852 1.962 1.793 2.324 0.575 8 5 "[*- * *+ 1]" 1
2805 2 48 PHE HA 2 49 GLU H 2.399 . 2.974 2.414 2.321 2.500 . 0 0 "[ . 1]" 1
2806 3 48 PHE HA 3 49 GLU H 2.399 . 2.974 2.402 2.317 2.607 . 0 0 "[ . 1]" 1
2807 2 49 GLU H 2 52 ALA MB 3.033 2.113 3.953 2.935 2.751 3.384 . 0 0 "[ . 1]" 1
2808 3 49 GLU H 3 52 ALA MB 3.033 2.113 3.953 3.101 2.774 3.351 . 0 0 "[ . 1]" 1
2809 2 51 GLU H 2 51 GLU QB 3.056 2.122 3.990 2.642 2.336 2.901 . 0 0 "[ . 1]" 1
2810 3 51 GLU H 3 51 GLU QB 3.056 2.122 3.990 2.531 2.140 2.866 . 0 0 "[ . 1]" 1
2811 2 50 ARG HB2 2 51 GLU H 2.698 . 3.426 2.987 2.585 3.947 0.521 9 1 "[ . +1]" 1
2812 3 50 ARG HB2 3 51 GLU H 2.698 . 3.426 3.104 2.673 3.947 0.521 3 1 "[ + . 1]" 1
2813 2 53 VAL H 2 53 VAL HA 2.665 . 3.375 2.708 2.690 2.732 . 0 0 "[ . 1]" 1
2814 3 53 VAL H 3 53 VAL HA 2.665 . 3.375 2.712 2.644 2.747 . 0 0 "[ . 1]" 1
2815 2 53 VAL H 2 53 VAL HB 2.520 . 6.000 3.615 3.583 3.630 . 0 0 "[ . 1]" 1
2816 3 53 VAL H 3 53 VAL HB 2.520 . 6.000 3.628 3.598 3.663 . 0 0 "[ . 1]" 1
2817 2 57 LEU H 2 57 LEU HA 2.821 2.025 3.617 2.865 2.829 2.896 . 0 0 "[ . 1]" 1
2818 3 57 LEU H 3 57 LEU HA 2.821 2.025 3.617 2.838 2.807 2.872 . 0 0 "[ . 1]" 1
2819 2 57 LEU H 2 57 LEU QD 3.039 2.116 3.962 3.027 2.870 3.193 . 0 0 "[ . 1]" 1
2820 3 57 LEU H 3 57 LEU QD 3.039 2.116 3.962 3.003 2.775 3.609 . 0 0 "[ . 1]" 1
2821 2 56 ILE HG12 2 57 LEU H 4.080 2.415 5.745 4.930 4.830 5.061 . 0 0 "[ . 1]" 1
2822 3 56 ILE HG12 3 57 LEU H 4.080 2.415 5.745 4.710 3.925 4.976 . 0 0 "[ . 1]" 1
2823 2 3 ASP H 2 4 SER H 2.728 . 3.472 3.370 2.848 4.335 0.863 1 3 "[+ - *]" 1
2824 3 3 ASP H 3 4 SER H 2.728 . 3.472 3.301 2.253 4.281 0.809 10 4 "[* * -+]" 1
2825 2 4 SER H 2 5 ALA MB 4.109 2.421 5.797 3.695 3.259 4.324 . 0 0 "[ . 1]" 1
2826 3 4 SER H 3 5 ALA MB 4.109 2.421 5.797 3.705 3.230 4.283 . 0 0 "[ . 1]" 1
2827 2 4 SER H 2 5 ALA HA 3.318 . 6.000 4.603 4.165 5.118 . 0 0 "[ . 1]" 1
2828 3 4 SER H 3 5 ALA HA 3.318 . 6.000 4.701 4.166 5.325 . 0 0 "[ . 1]" 1
2829 2 4 SER H 2 5 ALA H 2.670 . 3.383 2.259 1.533 3.535 0.424 7 0 "[ . 1]" 1
2830 3 4 SER H 3 5 ALA H 2.670 . 3.383 2.442 1.475 3.586 0.482 7 0 "[ . 1]" 1
2831 2 7 LYS H 2 46 PHE QD 5.388 2.485 8.291 6.302 6.086 6.561 . 0 0 "[ . 1]" 1
2832 3 7 LYS H 3 46 PHE QD 5.388 2.485 8.291 6.196 5.976 6.518 . 0 0 "[ . 1]" 1
2833 2 8 GLU H 2 8 GLU HG3 4.110 2.421 5.799 3.746 2.166 4.500 0.255 10 0 "[ . 1]" 1
2834 3 8 GLU H 3 8 GLU QG 4.110 2.445 5.799 3.206 1.720 4.014 0.725 6 1 "[ .+ 1]" 1
2835 2 8 GLU H 2 8 GLU HB3 2.835 2.031 3.639 2.899 2.424 3.592 . 0 0 "[ . 1]" 1
2836 3 8 GLU H 3 8 GLU HB3 2.835 2.031 3.639 2.919 2.436 3.590 . 0 0 "[ . 1]" 1
2837 2 8 GLU H 2 8 GLU HB2 2.437 . 3.031 2.426 2.162 2.609 . 0 0 "[ . 1]" 1
2838 3 8 GLU H 3 8 GLU HB2 2.437 . 3.031 2.558 2.273 3.569 0.538 6 1 "[ .+ 1]" 1
2839 2 7 LYS HG3 2 8 GLU H 2.600 . 3.276 2.131 1.853 2.448 0.071 8 0 "[ . 1]" 1
2840 3 7 LYS QG 3 8 GLU H 2.600 2.112 3.276 2.572 1.969 4.287 1.011 10 2 "[ . -+]" 1
2841 2 7 LYS HG2 2 8 GLU H 3.029 2.112 3.946 2.868 2.590 3.126 . 0 0 "[ . 1]" 1
2842 2 8 GLU H 2 8 GLU HG2 4.257 2.445 6.069 4.233 3.417 4.576 . 0 0 "[ . 1]" 1
2843 2 6 SER HB2 2 8 GLU H 3.337 2.223 4.451 3.412 2.889 4.634 0.183 4 0 "[ . 1]" 1
2844 3 6 SER HB2 3 8 GLU H 3.337 2.223 4.451 3.183 2.750 4.538 0.087 4 0 "[ . 1]" 1
2845 2 8 GLU H 2 8 GLU HA 2.952 2.081 3.823 2.782 2.757 2.794 . 0 0 "[ . 1]" 1
2846 3 8 GLU H 3 8 GLU HA 2.952 2.081 3.823 2.789 2.760 2.805 . 0 0 "[ . 1]" 1
2847 2 44 GLU H 2 44 GLU HB2 2.655 . 3.360 2.451 2.208 2.714 . 0 0 "[ . 1]" 1
2848 3 44 GLU H 3 44 GLU HB2 2.655 . 3.360 2.589 2.071 2.827 . 0 0 "[ . 1]" 1
2849 2 44 GLU H 2 44 GLU HG2 4.557 2.481 6.633 4.105 2.981 4.589 . 0 0 "[ . 1]" 1
2850 3 44 GLU H 3 44 GLU HG2 4.557 2.481 6.633 4.348 3.237 4.600 . 0 0 "[ . 1]" 1
2851 2 8 GLU HB3 2 9 GLU H 2.561 . 3.217 2.784 2.280 3.692 0.475 1 0 "[ . 1]" 1
2852 3 8 GLU HB3 3 9 GLU H 2.561 . 3.217 2.851 2.112 4.106 0.889 6 1 "[ .+ 1]" 1
2853 2 9 GLU H 2 9 GLU HB3 3.594 2.302 4.886 3.588 3.562 3.607 . 0 0 "[ . 1]" 1
2854 3 9 GLU H 3 9 GLU HB3 3.594 2.302 4.886 3.579 3.562 3.617 . 0 0 "[ . 1]" 1
2855 2 9 GLU H 2 9 GLU HA 2.800 2.016 3.584 2.804 2.785 2.827 . 0 0 "[ . 1]" 1
2856 3 9 GLU H 3 9 GLU HA 2.800 2.016 3.584 2.809 2.761 2.864 . 0 0 "[ . 1]" 1
2857 2 8 GLU HG2 2 9 GLU H 4.044 2.409 5.679 4.142 3.398 5.087 . 0 0 "[ . 1]" 1
2858 3 8 GLU QG 3 9 GLU H 4.044 2.409 5.679 3.592 2.296 4.085 0.113 6 0 "[ . 1]" 1
2859 2 6 SER HB2 2 9 GLU H 3.298 2.210 4.386 3.322 2.345 4.477 0.091 6 0 "[ . 1]" 1
2860 3 6 SER HB2 3 9 GLU H 3.298 2.210 4.386 3.221 2.280 4.484 0.098 4 0 "[ . 1]" 1
2861 2 6 SER HB3 2 9 GLU H 3.905 2.380 5.430 4.055 2.700 4.782 . 0 0 "[ . 1]" 1
2862 3 6 SER HB3 3 9 GLU H 3.905 2.380 5.430 4.154 2.874 4.805 . 0 0 "[ . 1]" 1
2863 2 8 GLU H 2 9 GLU H 2.733 . 3.480 2.811 2.729 2.939 . 0 0 "[ . 1]" 1
2864 3 8 GLU H 3 9 GLU H 2.733 . 3.480 2.807 2.683 2.944 . 0 0 "[ . 1]" 1
2865 2 6 SER H 2 9 GLU H 4.308 2.452 6.164 3.915 3.427 4.495 . 0 0 "[ . 1]" 1
2866 3 6 SER H 3 9 GLU H 4.308 2.452 6.164 3.907 3.448 4.799 . 0 0 "[ . 1]" 1
2867 2 11 ALA H 2 14 ILE MD 2.870 2.046 3.694 4.104 3.645 5.072 1.378 5 4 "[*- + *]" 1
2868 3 11 ALA H 3 14 ILE MD 2.870 2.046 3.694 4.408 3.967 4.761 1.067 7 6 "[ -* .*+**1]" 1
2869 2 41 CYS QB 2 42 ILE H 3.211 2.180 4.242 2.530 2.383 2.833 . 0 0 "[ . 1]" 1
2870 3 41 CYS QB 3 42 ILE H 3.211 2.180 4.242 2.419 2.306 2.517 . 0 0 "[ . 1]" 1
2871 2 15 VAL QG 2 42 ILE H 3.874 2.373 5.375 4.814 4.164 5.267 . 0 0 "[ . 1]" 1
2872 3 15 VAL QG 3 42 ILE H 3.874 2.373 5.375 4.338 4.064 4.629 . 0 0 "[ . 1]" 1
2873 2 15 VAL QG 2 16 ASN H . 2.236 2.966 2.248 2.076 2.364 0.160 3 0 "[ . 1]" 1
2874 3 15 VAL QG 3 16 ASN H . 2.236 2.966 2.390 2.249 2.494 . 0 0 "[ . 1]" 1
2875 2 38 ALA HA 2 42 ILE H 3.919 2.384 5.454 4.011 3.859 4.204 . 0 0 "[ . 1]" 1
2876 3 38 ALA HA 3 42 ILE H 3.919 2.384 5.454 4.115 3.851 4.462 . 0 0 "[ . 1]" 1
2877 2 16 ASN H 2 50 ARG HA 4.182 2.433 5.931 5.957 5.580 6.631 0.700 5 1 "[ + 1]" 1
2878 3 16 ASN H 3 50 ARG HA 4.182 2.433 5.931 6.047 5.497 6.510 0.579 8 1 "[ . + 1]" 1
2879 2 16 ASN H 2 16 ASN HD22 5.600 2.464 8.736 5.616 5.342 5.836 . 0 0 "[ . 1]" 1
2880 3 16 ASN H 3 16 ASN HD22 5.600 2.464 8.736 5.462 5.037 5.856 . 0 0 "[ . 1]" 1
2881 2 16 ASN H 2 17 TYR H 3.031 2.112 3.950 2.640 2.548 2.732 . 0 0 "[ . 1]" 1
2882 3 16 ASN H 3 17 TYR H 3.031 2.112 3.950 2.492 2.428 2.568 . 0 0 "[ . 1]" 1
2883 2 51 GLU H 2 52 ALA H 2.682 . 3.401 2.627 2.420 2.736 . 0 0 "[ . 1]" 1
2884 3 51 GLU H 3 52 ALA H 2.682 . 3.401 2.696 2.524 2.867 . 0 0 "[ . 1]" 1
2885 2 52 ALA H 2 53 VAL H 2.222 . 2.716 2.500 2.250 2.652 . 0 0 "[ . 1]" 1
2886 3 52 ALA H 3 53 VAL H 2.222 . 2.716 2.430 2.180 2.877 0.161 9 0 "[ . 1]" 1
2887 2 17 TYR H 2 17 TYR QD 4.425 2.467 6.383 3.511 3.027 4.138 . 0 0 "[ . 1]" 1
2888 3 17 TYR H 3 17 TYR QD 4.425 2.467 6.383 3.475 2.753 4.179 . 0 0 "[ . 1]" 1
2889 2 51 GLU HA 2 52 ALA H 2.979 2.091 3.867 3.273 3.093 3.392 . 0 0 "[ . 1]" 1
2890 3 51 GLU HA 3 52 ALA H 2.979 2.091 3.867 3.209 3.042 3.381 . 0 0 "[ . 1]" 1
2891 2 14 ILE MG 2 18 PHE H 3.899 2.379 5.419 4.049 3.836 4.349 . 0 0 "[ . 1]" 1
2892 3 14 ILE MG 3 18 PHE H 3.899 2.379 5.419 4.018 3.828 4.128 . 0 0 "[ . 1]" 1
2893 2 17 TYR QD 2 18 PHE H 4.921 2.499 7.343 4.311 3.768 4.708 . 0 0 "[ . 1]" 1
2894 3 17 TYR QD 3 18 PHE H 4.921 2.499 7.343 4.347 3.883 4.690 . 0 0 "[ . 1]" 1
2895 2 18 PHE H 2 19 SER H 2.930 2.071 3.789 2.849 2.763 2.912 . 0 0 "[ . 1]" 1
2896 3 18 PHE H 3 19 SER H 2.930 2.071 3.789 2.810 2.759 2.855 . 0 0 "[ . 1]" 1
2897 2 19 SER H 2 20 SER H 2.712 . 3.448 2.802 2.735 2.867 . 0 0 "[ . 1]" 1
2898 3 19 SER H 3 20 SER H 2.712 . 3.448 2.783 2.728 2.858 . 0 0 "[ . 1]" 1
2899 2 17 TYR H 2 19 SER H 3.660 2.321 4.999 4.379 4.152 4.558 . 0 0 "[ . 1]" 1
2900 3 17 TYR H 3 19 SER H 3.660 2.321 4.999 4.267 4.156 4.363 . 0 0 "[ . 1]" 1
2901 2 19 SER H 2 36 ASN HA 3.623 . 6.000 6.682 6.152 7.015 1.015 9 8 "[ ******+-]" 1
2902 3 19 SER H 3 36 ASN HA 3.623 . 6.000 6.868 6.475 7.330 1.330 4 9 "[*- +******]" 1
2903 2 18 PHE HB2 2 19 SER H 2.771 2.003 3.539 2.554 2.488 2.600 . 0 0 "[ . 1]" 1
2904 3 18 PHE HB2 3 19 SER H 2.771 2.003 3.539 2.588 2.494 2.704 . 0 0 "[ . 1]" 1
2905 2 18 PHE HB3 2 19 SER H 3.355 2.229 4.481 3.270 3.045 3.449 . 0 0 "[ . 1]" 1
2906 3 18 PHE HB3 3 19 SER H 3.355 2.229 4.481 3.297 3.120 3.432 . 0 0 "[ . 1]" 1
2907 2 20 SER H 2 21 ILE H 2.863 2.043 3.683 2.582 2.459 2.706 . 0 0 "[ . 1]" 1
2908 3 20 SER H 3 21 ILE H 2.863 2.043 3.683 2.574 2.405 2.638 . 0 0 "[ . 1]" 1
2909 2 22 VAL H 2 27 ILE MG 3.610 2.306 4.914 4.460 4.009 4.885 . 0 0 "[ . 1]" 1
2910 3 22 VAL H 3 27 ILE MG 3.610 2.306 4.914 4.499 4.277 4.854 . 0 0 "[ . 1]" 1
2911 2 74 ALA H 2 74 ALA MB 2.177 . 2.651 2.654 2.465 2.849 0.198 4 0 "[ . 1]" 1
2912 3 74 ALA H 3 74 ALA MB 2.177 . 2.651 2.637 2.297 2.892 0.241 4 0 "[ . 1]" 1
2913 2 21 ILE HB 2 22 VAL H 2.412 . 2.994 2.689 2.612 2.735 . 0 0 "[ . 1]" 1
2914 3 21 ILE HB 3 22 VAL H 2.412 . 2.994 2.720 2.633 2.852 . 0 0 "[ . 1]" 1
2915 2 21 ILE HA 2 22 VAL H 3.273 2.201 4.345 3.537 3.522 3.553 . 0 0 "[ . 1]" 1
2916 3 21 ILE HA 3 22 VAL H 3.273 2.201 4.345 3.536 3.518 3.553 . 0 0 "[ . 1]" 1
2917 2 23 GLU H 2 24 LYS H 2.434 . 3.026 2.664 2.547 2.784 . 0 0 "[ . 1]" 1
2918 3 23 GLU H 3 24 LYS H 2.434 . 3.026 2.685 2.445 2.837 . 0 0 "[ . 1]" 1
2919 2 22 VAL H 2 23 GLU H 2.352 . 2.905 2.411 2.267 2.576 . 0 0 "[ . 1]" 1
2920 3 22 VAL H 3 23 GLU H 2.352 . 2.905 2.387 2.285 2.525 . 0 0 "[ . 1]" 1
2921 2 21 ILE H 2 23 GLU H 3.941 2.388 5.494 3.612 3.509 3.757 . 0 0 "[ . 1]" 1
2922 3 21 ILE H 3 23 GLU H 3.941 2.388 5.494 3.596 3.464 3.788 . 0 0 "[ . 1]" 1
2923 2 20 SER HA 2 23 GLU H 3.112 2.144 4.080 3.528 3.267 3.748 . 0 0 "[ . 1]" 1
2924 3 20 SER HA 3 23 GLU H 3.112 2.144 4.080 3.453 3.201 3.795 . 0 0 "[ . 1]" 1
2925 2 23 GLU H 2 23 GLU HA 2.565 . 3.223 2.820 2.778 2.857 . 0 0 "[ . 1]" 1
2926 3 23 GLU H 3 23 GLU HA 2.565 . 3.223 2.831 2.803 2.871 . 0 0 "[ . 1]" 1
2927 2 21 ILE HA 2 23 GLU H 3.909 2.381 5.437 4.274 4.016 4.496 . 0 0 "[ . 1]" 1
2928 3 21 ILE HA 3 23 GLU H 3.909 2.381 5.437 4.134 3.962 4.423 . 0 0 "[ . 1]" 1
2929 2 22 VAL HA 2 23 GLU H 3.273 2.202 4.344 3.470 3.396 3.540 . 0 0 "[ . 1]" 1
2930 3 22 VAL HA 3 23 GLU H 3.273 2.202 4.344 3.436 3.375 3.507 . 0 0 "[ . 1]" 1
2931 2 23 GLU H 2 23 GLU HB2 2.099 . 2.540 2.396 2.103 2.795 0.255 10 0 "[ . 1]" 1
2932 3 23 GLU H 3 23 GLU HB2 2.099 . 2.540 2.491 2.206 2.937 0.397 9 0 "[ . 1]" 1
2933 2 23 GLU H 2 24 LYS HG2 4.771 2.494 7.048 6.077 4.960 6.945 . 0 0 "[ . 1]" 1
2934 3 23 GLU H 3 24 LYS QG 4.771 2.494 7.048 4.838 4.109 6.008 . 0 0 "[ . 1]" 1
2935 2 22 VAL QG 2 23 GLU H 2.282 . 2.803 2.299 2.183 2.469 . 0 0 "[ . 1]" 1
2936 3 22 VAL QG 3 23 GLU H 2.282 . 2.803 2.413 2.267 2.511 . 0 0 "[ . 1]" 1
2937 2 24 LYS H 2 24 LYS HG3 2.589 . 3.259 2.937 2.606 3.598 0.339 4 0 "[ . 1]" 1
2938 3 24 LYS H 3 24 LYS QG 2.589 2.198 3.259 2.676 2.008 4.002 0.743 7 1 "[ . + 1]" 1
2939 2 24 LYS H 2 24 LYS HG2 3.261 2.198 4.324 3.694 2.613 4.284 . 0 0 "[ . 1]" 1
2940 2 24 LYS H 2 24 LYS HA 2.885 2.053 3.717 2.897 2.842 2.948 . 0 0 "[ . 1]" 1
2941 3 24 LYS H 3 24 LYS HA 2.885 2.053 3.717 2.888 2.834 2.926 . 0 0 "[ . 1]" 1
2942 2 23 GLU HA 2 24 LYS H 3.429 2.253 4.605 3.539 3.471 3.569 . 0 0 "[ . 1]" 1
2943 3 23 GLU HA 3 24 LYS H 3.429 2.253 4.605 3.548 3.420 3.581 . 0 0 "[ . 1]" 1
2944 2 23 GLU H 2 25 LYS H 3.965 2.393 5.537 3.668 3.516 3.765 . 0 0 "[ . 1]" 1
2945 3 23 GLU H 3 25 LYS H 3.965 2.393 5.537 3.594 3.435 3.804 . 0 0 "[ . 1]" 1
2946 2 24 LYS HA 2 25 LYS H 3.022 2.109 3.935 3.256 3.181 3.322 . 0 0 "[ . 1]" 1
2947 3 24 LYS HA 3 25 LYS H 3.022 2.109 3.935 3.284 3.199 3.351 . 0 0 "[ . 1]" 1
2948 2 25 LYS H 2 25 LYS HA 2.173 . 2.645 2.264 2.252 2.276 . 0 0 "[ . 1]" 1
2949 3 25 LYS H 3 25 LYS HA 2.173 . 2.645 2.265 2.257 2.276 . 0 0 "[ . 1]" 1
2950 2 22 VAL HA 2 25 LYS H 3.298 2.210 4.386 3.277 2.903 3.460 . 0 0 "[ . 1]" 1
2951 3 22 VAL HA 3 25 LYS H 3.298 2.210 4.386 3.312 3.172 3.448 . 0 0 "[ . 1]" 1
2952 2 21 ILE MG 2 25 LYS H 4.122 2.423 5.821 4.681 4.474 4.941 . 0 0 "[ . 1]" 1
2953 3 21 ILE MG 3 25 LYS H 4.122 2.423 5.821 4.663 4.475 4.750 . 0 0 "[ . 1]" 1
2954 2 22 VAL HA 2 26 GLU H 3.625 2.311 4.939 3.761 3.502 4.174 . 0 0 "[ . 1]" 1
2955 3 22 VAL HA 3 26 GLU H 3.625 2.311 4.939 3.828 3.565 4.108 . 0 0 "[ . 1]" 1
2956 2 25 LYS HA 2 26 GLU H 2.749 . 3.504 2.652 2.546 2.803 . 0 0 "[ . 1]" 1
2957 3 25 LYS HA 3 26 GLU H 2.749 . 3.504 2.645 2.525 2.733 . 0 0 "[ . 1]" 1
2958 2 26 GLU H 2 26 GLU HB2 2.521 . 3.157 2.365 2.257 2.545 . 0 0 "[ . 1]" 1
2959 2 26 GLU H 2 26 GLU QG 2.832 2.030 3.634 2.737 2.249 3.392 . 0 0 "[ . 1]" 1
2960 3 26 GLU H 3 26 GLU QG 2.832 2.030 3.634 2.694 1.984 3.133 0.046 10 0 "[ . 1]" 1
2961 2 21 ILE MG 2 26 GLU H 3.166 2.164 4.168 3.100 2.778 3.398 . 0 0 "[ . 1]" 1
2962 3 21 ILE MG 3 26 GLU H 3.166 2.164 4.168 3.096 2.734 3.414 . 0 0 "[ . 1]" 1
2963 2 27 ILE H 2 27 ILE MD 4.057 2.411 5.703 4.886 4.403 5.017 . 0 0 "[ . 1]" 1
2964 3 27 ILE H 3 27 ILE MD 4.057 2.411 5.703 4.777 4.580 4.855 . 0 0 "[ . 1]" 1
2965 2 21 ILE MG 2 27 ILE H 3.219 2.183 4.255 3.829 3.577 4.138 . 0 0 "[ . 1]" 1
2966 3 21 ILE MG 3 27 ILE H 3.219 2.183 4.255 3.363 2.963 3.687 . 0 0 "[ . 1]" 1
2967 2 27 ILE H 2 27 ILE MG 2.307 . 2.839 2.580 2.240 2.806 . 0 0 "[ . 1]" 1
2968 3 27 ILE H 3 27 ILE MG 2.307 . 2.839 2.370 2.180 2.552 . 0 0 "[ . 1]" 1
2969 2 25 LYS HB2 2 27 ILE H 4.072 2.414 5.730 4.867 4.656 5.078 . 0 0 "[ . 1]" 1
2970 3 25 LYS HB2 3 27 ILE H 4.072 2.414 5.730 4.978 4.730 5.264 . 0 0 "[ . 1]" 1
2971 2 26 GLU HB2 2 27 ILE H 3.517 2.280 4.754 4.009 3.776 4.143 . 0 0 "[ . 1]" 1
2972 2 27 ILE H 2 27 ILE HB 2.910 2.063 3.757 3.316 3.211 3.402 . 0 0 "[ . 1]" 1
2973 3 27 ILE H 3 27 ILE HB 2.910 2.063 3.757 3.105 2.874 3.231 . 0 0 "[ . 1]" 1
2974 2 27 ILE H 2 27 ILE HA 2.709 . 3.443 2.872 2.841 2.908 . 0 0 "[ . 1]" 1
2975 3 27 ILE H 3 27 ILE HA 2.709 . 3.443 2.922 2.897 2.942 . 0 0 "[ . 1]" 1
2976 2 26 GLU HA 2 27 ILE H 2.793 2.013 3.573 2.977 2.838 3.119 . 0 0 "[ . 1]" 1
2977 3 26 GLU HA 3 27 ILE H 2.793 2.013 3.573 3.229 3.097 3.363 . 0 0 "[ . 1]" 1
2978 2 25 LYS HA 2 27 ILE H 2.874 2.048 3.700 3.105 2.935 3.286 . 0 0 "[ . 1]" 1
2979 3 25 LYS HA 3 27 ILE H 2.874 2.048 3.700 2.974 2.884 3.029 . 0 0 "[ . 1]" 1
2980 2 26 GLU H 2 27 ILE H 2.519 . 3.154 2.764 2.467 3.064 . 0 0 "[ . 1]" 1
2981 3 26 GLU H 3 27 ILE H 2.519 . 3.154 2.487 2.319 2.639 . 0 0 "[ . 1]" 1
2982 2 25 LYS H 2 27 ILE H 3.961 2.392 5.530 4.763 4.379 5.111 . 0 0 "[ . 1]" 1
2983 3 25 LYS H 3 27 ILE H 3.961 2.392 5.530 4.534 4.353 4.712 . 0 0 "[ . 1]" 1
2984 2 27 ILE H 2 28 SER H 3.976 2.395 5.557 4.341 4.322 4.357 . 0 0 "[ . 1]" 1
2985 3 27 ILE H 3 28 SER H 3.976 2.395 5.557 4.407 4.357 4.483 . 0 0 "[ . 1]" 1
2986 2 28 SER H 3 46 PHE QD 3.541 . 6.000 6.632 6.270 7.436 1.436 7 5 "[ *.-+* *]" 1
2987 2 46 PHE QD 3 28 SER H 3.541 . 6.000 6.802 6.384 7.097 1.097 3 9 "[* +**-****]" 1
2988 2 28 SER H 2 29 GLU H 4.590 2.483 6.697 4.633 4.601 4.652 . 0 0 "[ . 1]" 1
2989 3 28 SER H 3 29 GLU H 4.590 2.483 6.697 4.634 4.615 4.653 . 0 0 "[ . 1]" 1
2990 2 28 SER H 2 35 LEU QD 4.310 2.452 6.168 5.588 5.228 5.847 . 0 0 "[ . 1]" 1
2991 3 28 SER H 3 35 LEU QD 4.310 2.452 6.168 5.712 5.362 5.943 . 0 0 "[ . 1]" 1
2992 2 27 ILE HG13 2 28 SER H 2.606 . 3.285 2.380 1.775 2.683 0.152 8 0 "[ . 1]" 1
2993 3 27 ILE HG13 3 28 SER H 2.606 . 3.285 2.514 2.308 2.750 . 0 0 "[ . 1]" 1
2994 2 21 ILE MG 2 28 SER H 4.345 2.457 6.233 5.658 5.249 5.929 . 0 0 "[ . 1]" 1
2995 3 21 ILE MG 3 28 SER H 4.345 2.457 6.233 5.620 5.382 5.882 . 0 0 "[ . 1]" 1
2996 2 27 ILE HG12 2 28 SER H 2.289 . 2.813 2.281 1.714 3.793 0.980 2 1 "[ + . 1]" 1
2997 3 27 ILE HG12 3 28 SER H 2.289 . 2.813 2.078 1.764 2.484 0.001 5 0 "[ . 1]" 1
2998 2 29 GLU H 2 29 GLU QG 2.337 . 2.883 2.381 1.850 2.931 0.048 7 0 "[ . 1]" 1
2999 3 29 GLU H 3 29 GLU QG 2.337 . 2.883 2.479 1.926 3.860 0.977 3 1 "[ + . 1]" 1
3000 2 29 GLU H 2 29 GLU HB2 2.747 . 3.502 2.431 2.245 2.705 . 0 0 "[ . 1]" 1
3001 3 29 GLU H 3 29 GLU HB2 2.747 . 3.502 2.432 2.222 2.604 . 0 0 "[ . 1]" 1
3002 2 29 GLU H 2 29 GLU HA 2.651 . 3.354 2.786 2.750 2.804 . 0 0 "[ . 1]" 1
3003 3 29 GLU H 3 29 GLU HA 2.651 . 3.354 2.785 2.757 2.813 . 0 0 "[ . 1]" 1
3004 2 29 GLU H 2 30 ASP H 3.008 2.103 3.913 2.824 2.699 3.085 . 0 0 "[ . 1]" 1
3005 3 29 GLU H 3 30 ASP H 3.008 2.103 3.913 2.757 2.608 2.907 . 0 0 "[ . 1]" 1
3006 2 31 GLY H 2 31 GLY HA3 2.863 2.043 3.683 2.299 2.292 2.309 . 0 0 "[ . 1]" 1
3007 3 31 GLY H 3 31 GLY HA3 2.863 2.043 3.683 2.295 2.289 2.303 . 0 0 "[ . 1]" 1
3008 2 31 GLY H 2 31 GLY HA2 3.483 2.270 4.696 2.835 2.805 2.861 . 0 0 "[ . 1]" 1
3009 3 31 GLY H 3 31 GLY HA2 3.483 2.270 4.696 2.830 2.819 2.841 . 0 0 "[ . 1]" 1
3010 2 36 ASN H 2 37 VAL H 3.521 2.281 4.761 2.795 2.715 2.907 . 0 0 "[ . 1]" 1
3011 3 36 ASN H 3 37 VAL H 3.521 2.281 4.761 2.758 2.618 2.904 . 0 0 "[ . 1]" 1
3012 2 36 ASN HB2 2 37 VAL H 3.312 2.215 4.409 3.483 2.725 3.975 . 0 0 "[ . 1]" 1
3013 3 36 ASN HB2 3 37 VAL H 3.312 2.215 4.409 3.281 2.314 4.056 . 0 0 "[ . 1]" 1
3014 2 37 VAL H 2 37 VAL HA 3.471 2.266 4.676 2.846 2.826 2.862 . 0 0 "[ . 1]" 1
3015 3 37 VAL H 3 37 VAL HA 3.471 2.266 4.676 2.832 2.814 2.866 . 0 0 "[ . 1]" 1
3016 2 18 PHE H 2 35 LEU HB2 5.056 2.500 7.612 7.091 6.671 7.451 . 0 0 "[ . 1]" 1
3017 3 18 PHE H 3 35 LEU HB2 5.056 2.500 7.612 6.907 6.662 7.199 . 0 0 "[ . 1]" 1
3018 2 39 MET H 2 39 MET HA 3.320 2.218 4.422 2.786 2.767 2.805 . 0 0 "[ . 1]" 1
3019 3 39 MET H 3 39 MET HA 3.320 2.218 4.422 2.778 2.755 2.800 . 0 0 "[ . 1]" 1
3020 2 39 MET H 2 39 MET HG2 4.182 2.433 5.931 4.312 3.659 4.474 . 0 0 "[ . 1]" 1
3021 3 39 MET H 3 39 MET HG2 4.182 2.433 5.931 4.171 3.461 4.515 . 0 0 "[ . 1]" 1
3022 2 39 MET H 2 39 MET QB 3.020 2.120 3.932 2.198 2.130 2.228 . 0 0 "[ . 1]" 1
3023 3 39 MET H 3 39 MET QB 3.020 2.120 3.932 2.187 2.039 2.356 0.081 1 0 "[ . 1]" 1
3024 2 39 MET H 2 39 MET ME 4.289 2.449 6.129 3.937 3.835 4.046 . 0 0 "[ . 1]" 1
3025 3 39 MET H 3 39 MET ME 4.289 2.449 6.129 3.854 3.748 4.064 . 0 0 "[ . 1]" 1
3026 2 39 MET H 2 42 ILE MD 3.569 2.295 4.843 4.081 3.814 4.421 . 0 0 "[ . 1]" 1
3027 3 39 MET H 3 42 ILE MD 3.569 2.295 4.843 4.350 4.102 4.565 . 0 0 "[ . 1]" 1
3028 2 41 CYS H 2 42 ILE H 3.238 2.190 4.286 2.728 2.628 2.882 . 0 0 "[ . 1]" 1
3029 3 41 CYS H 3 42 ILE H 3.238 2.190 4.286 2.667 2.599 2.706 . 0 0 "[ . 1]" 1
3030 2 42 ILE H 2 43 SER H 2.824 2.027 3.621 2.641 2.567 2.703 . 0 0 "[ . 1]" 1
3031 3 42 ILE H 3 43 SER H 2.824 2.027 3.621 2.579 2.478 2.698 . 0 0 "[ . 1]" 1
3032 2 42 ILE HA 2 43 SER H 3.617 2.308 4.926 3.540 3.506 3.565 . 0 0 "[ . 1]" 1
3033 3 42 ILE HA 3 43 SER H 3.617 2.308 4.926 3.533 3.500 3.556 . 0 0 "[ . 1]" 1
3034 2 42 ILE HG12 2 43 SER H 4.972 2.500 7.444 5.073 5.003 5.182 . 0 0 "[ . 1]" 1
3035 2 44 GLU H 2 45 ALA MB 4.159 2.430 5.888 4.212 4.136 4.301 . 0 0 "[ . 1]" 1
3036 3 44 GLU H 3 45 ALA MB 4.159 2.430 5.888 4.243 4.177 4.309 . 0 0 "[ . 1]" 1
3037 2 43 SER HA 2 44 GLU H 3.690 2.328 5.052 3.531 3.485 3.563 . 0 0 "[ . 1]" 1
3038 3 43 SER HA 3 44 GLU H 3.690 2.328 5.052 3.547 3.511 3.577 . 0 0 "[ . 1]" 1
3039 2 44 GLU H 2 44 GLU HA 2.898 2.058 3.738 2.846 2.831 2.872 . 0 0 "[ . 1]" 1
3040 3 44 GLU H 3 44 GLU HA 2.898 2.058 3.738 2.838 2.821 2.854 . 0 0 "[ . 1]" 1
3041 2 8 GLU HA 2 9 GLU H 3.544 2.288 4.800 3.554 3.519 3.583 . 0 0 "[ . 1]" 1
3042 3 8 GLU HA 3 9 GLU H 3.544 2.288 4.800 3.554 3.531 3.582 . 0 0 "[ . 1]" 1
3043 2 44 GLU H 2 45 ALA H 2.864 2.044 3.684 2.550 2.443 2.636 . 0 0 "[ . 1]" 1
3044 3 44 GLU H 3 45 ALA H 2.864 2.044 3.684 2.585 2.478 2.632 . 0 0 "[ . 1]" 1
3045 2 45 ALA H 2 46 PHE H 3.053 2.121 3.985 2.693 2.530 2.811 . 0 0 "[ . 1]" 1
3046 3 45 ALA H 3 46 PHE H 3.053 2.121 3.985 2.782 2.662 2.865 . 0 0 "[ . 1]" 1
3047 2 46 PHE H 2 46 PHE HB3 4.166 2.430 5.902 3.607 3.553 3.638 . 0 0 "[ . 1]" 1
3048 3 46 PHE H 3 46 PHE HB3 4.166 2.430 5.902 3.623 3.568 3.668 . 0 0 "[ . 1]" 1
3049 2 46 PHE H 2 46 PHE HB2 2.763 . 3.526 2.356 2.276 2.401 . 0 0 "[ . 1]" 1
3050 3 46 PHE H 3 46 PHE HB2 2.763 . 3.526 2.394 2.288 2.456 . 0 0 "[ . 1]" 1
3051 2 45 ALA MB 2 46 PHE H 2.566 . 3.224 2.627 2.405 2.825 . 0 0 "[ . 1]" 1
3052 3 45 ALA MB 3 46 PHE H 2.566 . 3.224 2.514 2.383 2.685 . 0 0 "[ . 1]" 1
3053 2 47 GLY H 2 47 GLY HA2 2.510 . 3.140 2.287 2.279 2.300 . 0 0 "[ . 1]" 1
3054 3 47 GLY H 3 47 GLY HA2 2.510 . 3.140 2.291 2.287 2.299 . 0 0 "[ . 1]" 1
3055 2 47 GLY H 2 47 GLY HA3 2.454 . 3.056 2.801 2.756 2.849 . 0 0 "[ . 1]" 1
3056 3 47 GLY H 3 47 GLY HA3 2.454 . 3.056 2.816 2.788 2.844 . 0 0 "[ . 1]" 1
3057 2 46 PHE HB3 2 47 GLY H 3.781 2.351 5.211 4.148 4.011 4.233 . 0 0 "[ . 1]" 1
3058 3 46 PHE HB3 3 47 GLY H 3.781 2.351 5.211 4.177 4.012 4.274 . 0 0 "[ . 1]" 1
3059 2 43 SER HA 2 47 GLY H 4.220 2.439 6.001 4.581 4.407 4.861 . 0 0 "[ . 1]" 1
3060 3 43 SER HA 3 47 GLY H 4.220 2.439 6.001 4.450 4.172 4.779 . 0 0 "[ . 1]" 1
3061 2 46 PHE HB2 2 47 GLY H 3.183 2.170 4.196 3.572 3.478 3.670 . 0 0 "[ . 1]" 1
3062 3 46 PHE HB2 3 47 GLY H 3.183 2.170 4.196 3.525 3.376 3.668 . 0 0 "[ . 1]" 1
3063 2 45 ALA MB 2 47 GLY H 3.835 2.364 5.306 4.236 4.103 4.341 . 0 0 "[ . 1]" 1
3064 3 45 ALA MB 3 47 GLY H 3.835 2.364 5.306 4.194 4.105 4.277 . 0 0 "[ . 1]" 1
3065 2 46 PHE H 2 47 GLY H 2.557 . 3.211 2.354 2.249 2.483 . 0 0 "[ . 1]" 1
3066 3 46 PHE H 3 47 GLY H 2.557 . 3.211 2.370 2.308 2.450 . 0 0 "[ . 1]" 1
3067 2 47 GLY H 2 48 PHE H 2.806 2.018 3.594 2.877 2.702 2.985 . 0 0 "[ . 1]" 1
3068 3 47 GLY H 3 48 PHE H 2.806 2.018 3.594 2.853 2.734 3.034 . 0 0 "[ . 1]" 1
3069 2 46 PHE H 2 48 PHE H 3.999 2.400 5.598 4.091 3.792 4.387 . 0 0 "[ . 1]" 1
3070 3 46 PHE H 3 48 PHE H 3.999 2.400 5.598 4.163 3.810 4.448 . 0 0 "[ . 1]" 1
3071 2 48 PHE H 2 48 PHE QD 3.781 2.351 5.211 2.448 2.226 2.899 0.125 1 0 "[ . 1]" 1
3072 3 48 PHE H 3 48 PHE QD 3.781 2.351 5.211 2.458 2.203 2.769 0.148 7 0 "[ . 1]" 1
3073 2 48 PHE H 2 49 GLU H 4.139 2.425 5.853 4.396 4.379 4.435 . 0 0 "[ . 1]" 1
3074 3 48 PHE H 3 49 GLU H 4.139 2.425 5.853 4.383 4.342 4.426 . 0 0 "[ . 1]" 1
3075 2 46 PHE HB2 2 48 PHE H 4.013 2.402 5.624 4.013 3.590 4.297 . 0 0 "[ . 1]" 1
3076 3 46 PHE HB2 3 48 PHE H 4.013 2.402 5.624 4.041 3.579 4.247 . 0 0 "[ . 1]" 1
3077 2 46 PHE HB3 2 48 PHE H 4.672 2.489 6.855 4.636 4.180 5.032 . 0 0 "[ . 1]" 1
3078 3 46 PHE HB3 3 48 PHE H 4.672 2.489 6.855 4.820 4.247 5.190 . 0 0 "[ . 1]" 1
3079 2 48 PHE HB3 2 49 GLU H 3.768 2.348 5.188 3.956 3.852 4.073 . 0 0 "[ . 1]" 1
3080 3 48 PHE HB3 3 49 GLU H 3.768 2.348 5.188 3.965 3.738 4.092 . 0 0 "[ . 1]" 1
3081 2 48 PHE HB2 2 49 GLU H 2.685 . 3.406 2.597 2.437 2.785 . 0 0 "[ . 1]" 1
3082 3 48 PHE HB2 3 49 GLU H 2.685 . 3.406 2.620 2.269 2.802 . 0 0 "[ . 1]" 1
3083 2 48 PHE QD 2 49 GLU H 4.367 2.460 6.274 3.191 2.922 3.500 . 0 0 "[ . 1]" 1
3084 3 48 PHE QD 3 49 GLU H 4.367 2.460 6.274 3.228 2.798 3.534 . 0 0 "[ . 1]" 1
3085 2 49 GLU H 2 50 ARG H 4.741 2.493 6.989 4.542 4.477 4.580 . 0 0 "[ . 1]" 1
3086 3 49 GLU H 3 50 ARG H 4.741 2.493 6.989 4.536 4.456 4.604 . 0 0 "[ . 1]" 1
3087 2 51 GLU HA 2 53 VAL H 3.488 2.271 4.705 3.315 3.098 3.718 . 0 0 "[ . 1]" 1
3088 3 51 GLU HA 3 53 VAL H 3.488 2.271 4.705 3.365 2.997 3.704 . 0 0 "[ . 1]" 1
3089 2 52 ALA HA 2 53 VAL H 3.051 2.120 3.982 3.210 3.194 3.230 . 0 0 "[ . 1]" 1
3090 3 52 ALA HA 3 53 VAL H 3.051 2.120 3.982 3.225 3.172 3.284 . 0 0 "[ . 1]" 1
3091 2 53 VAL H 2 56 ILE HG12 4.458 2.471 6.445 6.874 6.588 7.170 0.725 6 4 "[ -*.+* 1]" 1
3092 3 53 VAL H 3 56 ILE HG12 4.458 2.471 6.445 6.737 6.310 7.254 0.809 8 2 "[ - . + 1]" 1
3093 2 53 VAL H 2 54 SER H 2.967 2.087 3.847 3.195 3.041 3.290 . 0 0 "[ . 1]" 1
3094 3 53 VAL H 3 54 SER H 2.967 2.087 3.847 3.104 2.995 3.453 . 0 0 "[ . 1]" 1
3095 2 54 SER H 2 54 SER HB3 2.974 2.089 3.859 3.380 2.920 3.546 . 0 0 "[ . 1]" 1
3096 3 54 SER H 3 54 SER HB2 2.974 2.089 3.859 3.034 2.808 3.254 . 0 0 "[ . 1]" 1
3097 2 54 SER H 2 54 SER HA 2.882 2.051 3.713 2.740 2.701 2.784 . 0 0 "[ . 1]" 1
3098 3 54 SER H 3 54 SER HA 2.882 2.051 3.713 2.776 2.746 2.860 . 0 0 "[ . 1]" 1
3099 2 55 GLY H 2 55 GLY HA2 2.292 . 2.817 2.872 2.845 2.898 0.081 3 0 "[ . 1]" 1
3100 3 55 GLY H 3 55 GLY HA2 2.292 . 2.817 2.880 2.828 2.907 0.090 6 0 "[ . 1]" 1
3101 2 52 ALA HA 2 55 GLY H 3.400 2.244 4.556 3.513 3.381 3.627 . 0 0 "[ . 1]" 1
3102 3 52 ALA HA 3 55 GLY H 3.400 2.244 4.556 3.648 3.414 4.377 . 0 0 "[ . 1]" 1
3103 2 55 GLY H 2 56 ILE H 2.470 . 3.080 2.518 2.394 2.679 . 0 0 "[ . 1]" 1
3104 3 55 GLY H 3 56 ILE H 2.470 . 3.080 2.496 2.326 2.824 . 0 0 "[ . 1]" 1
3105 2 53 VAL H 2 55 GLY H 3.856 2.369 5.343 4.275 4.104 4.521 . 0 0 "[ . 1]" 1
3106 3 53 VAL H 3 55 GLY H 3.856 2.369 5.343 4.469 4.210 5.383 0.040 9 0 "[ . 1]" 1
3107 2 54 SER H 2 55 GLY H 3.453 2.260 4.646 2.865 2.743 2.992 . 0 0 "[ . 1]" 1
3108 3 54 SER H 3 55 GLY H 3.453 2.260 4.646 2.778 2.652 2.857 . 0 0 "[ . 1]" 1
3109 2 55 GLY HA2 2 56 ILE H 2.868 2.046 3.690 3.523 3.469 3.558 . 0 0 "[ . 1]" 1
3110 3 55 GLY HA2 3 56 ILE H 2.868 2.046 3.690 3.510 3.425 3.560 . 0 0 "[ . 1]" 1
3111 2 56 ILE H 2 56 ILE HA 2.957 2.082 3.832 2.893 2.877 2.902 . 0 0 "[ . 1]" 1
3112 3 56 ILE H 3 56 ILE HA 2.957 2.082 3.832 2.878 2.844 2.902 . 0 0 "[ . 1]" 1
3113 2 53 VAL HA 2 56 ILE H 3.284 2.205 4.363 3.625 3.338 3.814 . 0 0 "[ . 1]" 1
3114 3 53 VAL HA 3 56 ILE H 3.284 2.205 4.363 3.696 3.227 5.661 1.298 9 1 "[ . +1]" 1
3115 2 56 ILE H 2 56 ILE HG12 3.101 2.140 4.062 3.538 3.318 3.774 . 0 0 "[ . 1]" 1
3116 3 56 ILE H 3 56 ILE HG12 3.101 2.140 4.062 3.359 2.142 3.690 . 0 0 "[ . 1]" 1
3117 2 56 ILE H 2 56 ILE HG13 2.158 . 2.623 2.189 2.085 2.366 . 0 0 "[ . 1]" 1
3118 3 56 ILE H 3 56 ILE HG13 2.158 . 2.623 2.192 1.997 2.309 . 0 0 "[ . 1]" 1
3119 2 56 ILE H 2 56 ILE MG 3.599 2.303 4.895 3.797 3.773 3.822 . 0 0 "[ . 1]" 1
3120 3 56 ILE H 3 56 ILE MG 3.599 2.303 4.895 3.721 3.200 3.800 . 0 0 "[ . 1]" 1
3121 2 56 ILE H 2 56 ILE MD 3.784 2.352 5.216 3.469 3.017 3.641 . 0 0 "[ . 1]" 1
3122 3 56 ILE H 3 56 ILE MD 3.784 2.352 5.216 3.552 3.398 3.756 . 0 0 "[ . 1]" 1
3123 2 56 ILE MG 2 57 LEU H 3.487 2.271 4.703 3.425 3.209 3.584 . 0 0 "[ . 1]" 1
3124 3 56 ILE MG 3 57 LEU H 3.487 2.271 4.703 3.249 2.941 4.332 . 0 0 "[ . 1]" 1
3125 2 56 ILE HA 2 57 LEU H 3.653 2.318 4.988 3.563 3.533 3.602 . 0 0 "[ . 1]" 1
3126 3 56 ILE HA 3 57 LEU H 3.653 2.318 4.988 3.562 3.531 3.584 . 0 0 "[ . 1]" 1
3127 2 33 ASP H 2 33 ASP HB2 3.301 2.211 4.391 2.377 2.276 2.482 . 0 0 "[ . 1]" 1
3128 3 33 ASP H 3 33 ASP HB2 3.301 2.211 4.391 2.375 2.071 2.557 0.140 10 0 "[ . 1]" 1
3129 2 33 ASP H 2 34 SER H 3.221 2.183 4.259 2.555 2.484 2.678 . 0 0 "[ . 1]" 1
3130 3 33 ASP H 3 34 SER H 3.221 2.183 4.259 2.582 2.505 2.657 . 0 0 "[ . 1]" 1
3131 2 33 ASP H 2 33 ASP HB3 3.000 2.100 3.900 2.729 2.615 2.883 . 0 0 "[ . 1]" 1
3132 3 33 ASP H 3 33 ASP HB3 3.000 2.100 3.900 2.813 2.468 3.572 . 0 0 "[ . 1]" 1
3133 2 32 ALA HA 2 33 ASP H 3.208 2.179 4.237 3.531 3.504 3.559 . 0 0 "[ . 1]" 1
3134 3 32 ALA HA 3 33 ASP H 3.208 2.179 4.237 3.539 3.515 3.558 . 0 0 "[ . 1]" 1
3135 2 32 ALA MB 2 33 ASP H 2.638 . 3.334 2.571 2.476 2.772 . 0 0 "[ . 1]" 1
3136 3 32 ALA MB 3 33 ASP H 2.638 . 3.334 2.486 2.398 2.550 . 0 0 "[ . 1]" 1
3137 2 29 GLU HA 2 33 ASP H 3.755 2.345 5.165 4.137 3.703 4.570 . 0 0 "[ . 1]" 1
3138 3 29 GLU HA 3 33 ASP H 3.755 2.345 5.165 4.118 3.701 4.462 . 0 0 "[ . 1]" 1
3139 2 16 ASN HB3 2 16 ASN HD22 4.057 2.411 5.703 3.478 3.463 3.510 . 0 0 "[ . 1]" 1
3140 3 16 ASN HB3 3 16 ASN HD22 4.057 2.411 5.703 3.476 3.456 3.493 . 0 0 "[ . 1]" 1
3141 2 16 ASN HD22 2 57 LEU QD 3.883 2.375 5.391 3.560 3.208 3.913 . 0 0 "[ . 1]" 1
3142 3 16 ASN HD22 3 57 LEU QD 3.883 2.375 5.391 3.517 2.876 3.963 . 0 0 "[ . 1]" 1
3143 2 16 ASN HB3 2 16 ASN HD21 2.864 2.044 3.684 2.216 2.162 2.306 . 0 0 "[ . 1]" 1
3144 3 16 ASN HB3 3 16 ASN HD21 2.864 2.044 3.684 2.214 2.171 2.258 . 0 0 "[ . 1]" 1
3145 2 16 ASN HB2 2 16 ASN HD21 3.797 2.356 5.238 3.163 2.810 3.450 . 0 0 "[ . 1]" 1
3146 3 16 ASN HB2 3 16 ASN HD21 3.797 2.356 5.238 3.219 2.882 3.459 . 0 0 "[ . 1]" 1
3147 2 16 ASN HD21 2 57 LEU QD 3.612 2.308 4.916 2.902 2.115 3.712 0.193 5 0 "[ . 1]" 1
3148 3 16 ASN HD21 3 57 LEU QD 3.612 2.308 4.916 2.849 2.003 3.474 0.305 9 0 "[ . 1]" 1
3149 2 38 ALA MB 2 40 ASP H 4.243 2.443 6.043 4.591 4.340 4.775 . 0 0 "[ . 1]" 1
3150 3 38 ALA MB 3 40 ASP H 4.243 2.443 6.043 4.828 4.648 4.982 . 0 0 "[ . 1]" 1
3151 2 37 VAL QG 2 40 ASP H 4.123 2.423 5.823 4.235 4.094 4.419 . 0 0 "[ . 1]" 1
3152 3 37 VAL QG 3 40 ASP H 4.123 2.423 5.823 4.421 4.133 4.690 . 0 0 "[ . 1]" 1
3153 2 40 ASP H 2 40 ASP HB3 2.697 . 3.424 2.880 2.542 3.474 0.050 4 0 "[ . 1]" 1
3154 3 40 ASP H 3 40 ASP HB3 2.697 . 3.424 3.543 3.507 3.589 0.165 6 0 "[ . 1]" 1
3155 2 39 MET ME 2 40 ASP H 4.044 2.408 5.680 4.518 4.361 4.760 . 0 0 "[ . 1]" 1
3156 3 39 MET ME 3 40 ASP H 4.044 2.408 5.680 4.496 4.163 4.643 . 0 0 "[ . 1]" 1
3157 2 39 MET QB 2 40 ASP H 2.772 2.003 3.541 2.449 2.293 2.679 . 0 0 "[ . 1]" 1
3158 3 39 MET QB 3 40 ASP H 2.772 2.003 3.541 2.364 2.102 2.605 . 0 0 "[ . 1]" 1
3159 2 39 MET HA 2 40 ASP H 3.598 2.304 4.892 3.535 3.489 3.559 . 0 0 "[ . 1]" 1
3160 3 39 MET HA 3 40 ASP H 3.598 2.304 4.892 3.569 3.554 3.591 . 0 0 "[ . 1]" 1
3161 2 40 ASP H 2 40 ASP HA 2.937 2.075 3.799 2.817 2.807 2.845 . 0 0 "[ . 1]" 1
3162 3 40 ASP H 3 40 ASP HA 2.937 2.075 3.799 2.818 2.797 2.831 . 0 0 "[ . 1]" 1
3163 2 37 VAL HA 2 40 ASP H 3.294 2.209 4.379 3.377 3.210 3.584 . 0 0 "[ . 1]" 1
3164 3 37 VAL HA 3 40 ASP H 3.294 2.209 4.379 3.672 3.426 3.885 . 0 0 "[ . 1]" 1
3165 2 39 MET H 2 40 ASP H 3.016 2.106 3.926 2.740 2.594 2.846 . 0 0 "[ . 1]" 1
3166 3 39 MET H 3 40 ASP H 3.016 2.106 3.926 2.879 2.739 3.054 . 0 0 "[ . 1]" 1
3167 2 40 ASP H 2 41 CYS H 2.827 2.028 3.626 2.719 2.522 2.819 . 0 0 "[ . 1]" 1
3168 3 40 ASP H 3 41 CYS H 2.827 2.028 3.626 2.595 2.516 2.660 . 0 0 "[ . 1]" 1
3169 2 42 ILE H 2 42 ILE HG12 4.226 2.441 6.011 3.654 3.424 3.809 . 0 0 "[ . 1]" 1
3170 2 10 ILE H 2 10 ILE HA 2.933 2.073 3.793 2.439 2.431 2.447 . 0 0 "[ . 1]" 1
3171 3 10 ILE H 3 10 ILE HA 2.933 2.073 3.793 2.447 2.426 2.465 . 0 0 "[ . 1]" 1
3172 2 13 LEU H 2 13 LEU HA 3.100 2.139 4.061 2.641 2.631 2.652 . 0 0 "[ . 1]" 1
3173 3 13 LEU H 3 13 LEU HA 3.100 2.139 4.061 2.629 2.619 2.644 . 0 0 "[ . 1]" 1
3174 2 13 LEU HA 2 16 ASN HB3 3.495 2.273 4.717 2.350 2.198 2.457 0.075 8 0 "[ . 1]" 1
3175 3 13 LEU HA 3 16 ASN HB3 3.495 2.273 4.717 2.420 2.361 2.493 . 0 0 "[ . 1]" 1
3176 2 21 ILE HA 2 21 ILE MD 2.253 . 2.761 1.940 1.898 1.984 . 0 0 "[ . 1]" 1
3177 3 21 ILE HA 3 21 ILE MD 2.253 . 2.761 1.939 1.882 2.053 . 0 0 "[ . 1]" 1
3178 2 21 ILE H 2 21 ILE MG 3.228 2.186 4.270 3.369 3.277 3.471 . 0 0 "[ . 1]" 1
3179 3 21 ILE H 3 21 ILE MG 3.228 2.186 4.270 3.126 2.857 3.324 . 0 0 "[ . 1]" 1
3180 2 25 LYS HB3 2 28 SER HA 4.910 2.499 7.321 4.623 4.476 4.789 . 0 0 "[ . 1]" 1
3181 3 25 LYS HB3 3 28 SER HA 4.910 2.499 7.321 4.568 4.343 4.745 . 0 0 "[ . 1]" 1
3182 2 29 GLU HA 2 29 GLU HB2 2.705 . 3.437 2.501 2.294 2.692 . 0 0 "[ . 1]" 1
3183 3 29 GLU HA 3 29 GLU HB2 2.705 . 3.437 2.345 2.208 2.645 . 0 0 "[ . 1]" 1
3184 2 21 ILE HA 2 35 LEU QD 3.887 2.376 5.398 2.085 1.985 2.208 0.391 7 0 "[ . 1]" 1
3185 3 21 ILE HA 3 35 LEU QD 3.887 2.376 5.398 2.065 1.952 2.182 0.424 1 0 "[ . 1]" 1
3186 2 35 LEU HB3 2 35 LEU HG 2.648 . 3.349 2.678 2.436 2.901 . 0 0 "[ . 1]" 1
3187 2 45 ALA MB 3 35 LEU HG 2.648 . 3.349 2.863 2.808 2.938 . 0 0 "[ . 1]" 1
3188 2 35 LEU HA 2 38 ALA MB 2.161 . 2.628 1.998 1.937 2.063 . 0 0 "[ . 1]" 1
3189 3 35 LEU HA 3 38 ALA MB 2.161 . 2.628 1.992 1.895 2.044 . 0 0 "[ . 1]" 1
3190 2 44 GLU H 2 44 GLU HA 3.131 2.150 4.112 2.696 2.654 2.742 . 0 0 "[ . 1]" 1
3191 3 44 GLU H 3 44 GLU HA 3.131 2.150 4.112 2.695 2.663 2.739 . 0 0 "[ . 1]" 1
3192 2 22 VAL H 2 23 GLU HG3 4.892 2.498 7.286 5.523 4.596 6.056 . 0 0 "[ . 1]" 1
3193 3 22 VAL H 3 23 GLU HG3 4.892 2.498 7.286 5.616 4.862 6.041 . 0 0 "[ . 1]" 1
3194 2 8 GLU HG2 2 48 PHE QR 4.486 2.473 6.499 4.948 4.565 5.342 . 0 0 "[ . 1]" 1
3195 3 8 GLU QG 3 48 PHE QR 4.486 2.473 6.036 4.626 3.820 6.151 0.115 6 0 "[ . 1]" 1
3196 2 8 GLU HG3 2 48 PHE QR 4.239 2.442 6.036 4.829 4.100 6.329 0.293 1 0 "[ . 1]" 1
3197 2 7 LYS QD 2 7 LYS QE 2.470 . 3.080 2.014 1.998 2.025 . 0 0 "[ . 1]" 1
3198 3 7 LYS HD3 3 7 LYS QE 2.470 . 3.080 2.164 2.147 2.174 . 0 0 "[ . 1]" 1
3199 3 7 LYS HD2 3 7 LYS QE 2.721 . 3.461 2.408 2.330 2.482 . 0 0 "[ . 1]" 1
3200 2 53 VAL HB 2 55 GLY H 4.276 2.447 6.105 4.072 3.886 4.274 . 0 0 "[ . 1]" 1
3201 3 53 VAL HB 3 55 GLY H 4.276 2.447 6.105 4.033 3.701 4.424 . 0 0 "[ . 1]" 1
3202 2 7 LYS H 2 7 LYS HB2 3.952 2.390 5.514 3.137 3.035 3.251 . 0 0 "[ . 1]" 1
3203 3 7 LYS H 3 7 LYS QB 3.952 2.390 5.514 2.459 2.155 2.695 0.235 10 0 "[ . 1]" 1
3204 2 13 LEU H 2 57 LEU QD 2.842 2.034 3.650 2.531 2.346 2.651 . 0 0 "[ . 1]" 1
3205 3 13 LEU H 3 57 LEU QD 2.842 2.034 3.650 2.502 2.395 3.152 . 0 0 "[ . 1]" 1
3206 2 9 GLU H 2 57 LEU QD 4.419 2.466 6.372 3.502 3.174 3.832 . 0 0 "[ . 1]" 1
3207 3 9 GLU H 3 57 LEU QD 4.419 2.466 6.372 3.452 2.872 3.785 . 0 0 "[ . 1]" 1
3208 2 50 ARG HA 2 53 VAL QG 3.526 2.282 4.770 3.271 2.672 3.810 . 0 0 "[ . 1]" 1
3209 3 50 ARG HA 3 53 VAL QG 3.526 2.282 4.770 3.262 2.456 4.253 . 0 0 "[ . 1]" 1
3210 2 15 VAL HB 2 53 VAL QG 3.347 2.227 4.467 3.708 3.415 3.847 . 0 0 "[ . 1]" 1
3211 3 15 VAL HB 3 53 VAL QG 3.347 2.227 4.467 3.782 3.576 4.509 0.042 9 0 "[ . 1]" 1
3212 2 49 GLU QB 2 53 VAL QG 3.829 2.363 5.295 4.262 3.513 4.634 . 0 0 "[ . 1]" 1
3213 3 49 GLU QB 3 53 VAL QG 3.829 2.363 5.295 4.219 3.810 4.926 . 0 0 "[ . 1]" 1
3214 2 52 ALA MB 2 53 VAL QG 3.411 2.247 4.575 3.294 2.968 3.604 . 0 0 "[ . 1]" 1
3215 3 52 ALA MB 3 53 VAL QG 3.411 2.247 4.575 3.349 3.063 3.949 . 0 0 "[ . 1]" 1
3216 2 10 ILE HA 2 57 LEU QD 4.269 2.447 6.091 4.283 3.858 4.730 . 0 0 "[ . 1]" 1
3217 3 10 ILE HA 3 57 LEU QD 4.269 2.447 6.091 4.290 3.749 4.952 . 0 0 "[ . 1]" 1
3218 2 18 PHE HB3 2 27 ILE MD 4.072 2.414 5.730 4.695 4.025 5.309 . 0 0 "[ . 1]" 1
3219 2 7 LYS HE2 3 27 ILE MD 4.072 2.414 5.730 4.864 4.358 5.284 . 0 0 "[ . 1]" 1
3220 2 22 VAL HB 2 27 ILE MD 3.941 2.388 5.494 5.509 5.024 5.972 0.478 9 0 "[ . 1]" 1
3221 3 22 VAL HB 3 27 ILE MD 3.941 2.388 5.494 5.012 4.914 5.115 . 0 0 "[ . 1]" 1
3222 2 21 ILE HB 2 27 ILE MD 3.333 2.222 4.444 4.197 3.988 4.478 0.034 9 0 "[ . 1]" 1
3223 2 7 LYS HB2 3 27 ILE MD 3.333 2.222 4.444 4.345 4.027 4.636 0.192 4 0 "[ . 1]" 1
3224 2 27 ILE MD 3 7 LYS HD2 3.850 2.367 5.333 4.627 4.034 5.209 . 0 0 "[ . 1]" 1
3225 2 7 LYS QD 3 27 ILE MD 3.850 2.367 5.333 3.940 3.333 4.674 . 0 0 "[ . 1]" 1
3226 2 27 ILE MD 2 27 ILE HG12 1.869 . 2.218 2.081 2.040 2.116 . 0 0 "[ . 1]" 1
3227 3 27 ILE MD 3 27 ILE HG12 1.869 . 2.218 2.073 2.031 2.098 . 0 0 "[ . 1]" 1
3228 2 27 ILE MD 2 27 ILE HG13 1.829 . 2.164 1.941 1.868 2.052 . 0 0 "[ . 1]" 1
3229 2 45 ALA MB 3 27 ILE MD 1.829 . 2.164 1.979 1.815 2.075 . 0 0 "[ . 1]" 1
3230 2 8 GLU HA 2 10 ILE MD 4.462 2.471 6.453 4.936 4.818 5.059 . 0 0 "[ . 1]" 1
3231 2 13 LEU HA 3 10 ILE MD 4.462 2.471 6.453 4.970 4.857 5.044 . 0 0 "[ . 1]" 1
3232 2 21 ILE HB 2 21 ILE MD 2.655 . 3.360 2.553 2.218 3.145 . 0 0 "[ . 1]" 1
3233 2 7 LYS HB2 3 21 ILE MD 2.655 . 3.360 3.011 2.723 3.139 . 0 0 "[ . 1]" 1
3234 2 21 ILE MD 2 24 LYS QD 3.518 2.280 4.756 3.589 2.415 4.161 . 0 0 "[ . 1]" 1
3235 2 7 LYS HG2 3 21 ILE MD 3.518 2.280 4.756 4.103 3.609 4.359 . 0 0 "[ . 1]" 1
3236 2 15 VAL QG 2 49 GLU QB 3.877 2.374 5.380 3.772 2.967 4.449 . 0 0 "[ . 1]" 1
3237 3 15 VAL QG 3 49 GLU QB 3.877 2.374 5.380 3.648 2.978 4.048 . 0 0 "[ . 1]" 1
3238 2 15 VAL QG 2 50 ARG QG 3.595 2.303 4.887 2.741 2.222 3.800 0.081 8 0 "[ . 1]" 1
3239 3 15 VAL QG 3 50 ARG QG 3.595 2.303 4.887 2.870 2.110 3.767 0.193 4 0 "[ . 1]" 1
3240 2 21 ILE HB 2 35 LEU QD 3.265 2.199 4.331 3.094 2.573 3.336 . 0 0 "[ . 1]" 1
3241 2 7 LYS HB2 3 35 LEU QD 3.265 2.199 4.331 2.855 2.582 3.135 . 0 0 "[ . 1]" 1
3242 2 35 LEU HB3 2 35 LEU QD 2.301 . 2.831 1.988 1.944 2.109 . 0 0 "[ . 1]" 1
3243 2 45 ALA MB 3 35 LEU QD 2.301 . 2.831 2.037 1.968 2.097 . 0 0 "[ . 1]" 1
3244 2 14 ILE MG 2 35 LEU QD 2.667 . 3.378 2.555 2.206 2.791 . 0 0 "[ . 1]" 1
3245 3 14 ILE MG 3 35 LEU QD 2.667 . 3.378 2.403 2.086 2.603 . 0 0 "[ . 1]" 1
3246 2 25 LYS HB3 2 25 LYS QE 4.820 2.497 7.143 3.673 2.001 4.042 0.496 1 0 "[ . 1]" 1
3247 3 25 LYS HB3 3 25 LYS HE2 4.820 2.497 7.143 4.345 4.106 4.484 . 0 0 "[ . 1]" 1
3248 2 7 LYS HE2 3 21 ILE MD 3.168 2.165 4.171 3.155 2.547 3.655 . 0 0 "[ . 1]" 1
3249 2 21 ILE MD 3 7 LYS HE2 3.168 2.165 4.171 2.956 2.144 3.529 0.021 1 0 "[ . 1]" 1
3250 2 7 LYS HB3 2 7 LYS HE3 2.192 . 2.672 1.915 1.821 1.987 . 0 0 "[ . 1]" 1
3251 3 7 LYS QB 3 7 LYS HE3 2.192 . 2.672 2.037 1.815 2.522 . 0 0 "[ . 1]" 1
3252 2 7 LYS QD 2 7 LYS HE3 2.872 2.047 3.697 2.366 2.316 2.418 . 0 0 "[ . 1]" 1
3253 3 7 LYS HD2 3 7 LYS HE3 2.872 2.047 3.697 2.461 2.170 2.647 . 0 0 "[ . 1]" 1
3254 2 7 LYS HE3 3 21 ILE MD 2.859 2.042 3.676 2.446 2.047 2.862 . 0 0 "[ . 1]" 1
3255 2 21 ILE MD 3 7 LYS HE3 2.859 2.042 3.676 2.288 1.839 2.690 0.203 9 0 "[ . 1]" 1
3256 2 7 LYS HE3 2 10 ILE HG12 4.575 2.481 6.669 5.471 5.233 5.761 . 0 0 "[ . 1]" 1
3257 2 27 ILE MG 3 7 LYS HE3 4.575 2.481 6.669 5.447 4.891 5.719 . 0 0 "[ . 1]" 1
3258 2 11 ALA HA 2 14 ILE MG 3.367 2.233 4.501 3.862 3.405 4.262 . 0 0 "[ . 1]" 1
3259 2 14 ILE MG 3 11 ALA HA 3.367 2.233 4.501 3.849 3.315 4.381 . 0 0 "[ . 1]" 1
3260 2 11 ALA HA 2 14 ILE HG12 3.847 2.367 5.327 3.844 2.414 4.492 . 0 0 "[ . 1]" 1
3261 2 14 ILE HG12 3 11 ALA HA 3.847 2.367 5.327 4.101 3.788 4.552 . 0 0 "[ . 1]" 1
3262 2 26 GLU HA 2 26 GLU HB3 2.416 . 3.000 2.157 2.103 2.213 . 0 0 "[ . 1]" 1
3263 3 26 GLU HA 3 26 GLU QB 2.416 . 3.000 2.085 2.031 2.156 . 0 0 "[ . 1]" 1
3264 2 57 LEU HA 2 57 LEU QB 3.194 2.174 4.214 2.283 2.264 2.309 . 0 0 "[ . 1]" 1
3265 3 57 LEU HA 3 57 LEU QB 3.194 2.174 4.214 2.248 2.035 2.295 0.139 9 0 "[ . 1]" 1
3266 2 35 LEU HA 2 35 LEU HB3 2.906 2.062 3.750 2.365 2.316 2.403 . 0 0 "[ . 1]" 1
3267 3 35 LEU HA 3 35 LEU HB3 2.906 2.062 3.750 2.344 2.319 2.378 . 0 0 "[ . 1]" 1
3268 2 36 ASN HA 2 36 ASN HB2 2.936 2.074 3.798 2.424 2.233 2.656 . 0 0 "[ . 1]" 1
3269 3 36 ASN HA 3 36 ASN HB2 2.936 2.074 3.798 2.319 2.181 2.460 . 0 0 "[ . 1]" 1
3270 2 22 VAL QG 2 36 ASN HA 3.429 2.253 4.605 3.905 3.723 4.081 . 0 0 "[ . 1]" 1
3271 3 22 VAL QG 3 36 ASN HA 3.429 2.253 4.605 3.966 3.674 4.206 . 0 0 "[ . 1]" 1
3272 2 25 LYS HA 2 25 LYS QB 2.836 2.032 3.640 2.383 2.277 2.468 . 0 0 "[ . 1]" 1
3273 3 25 LYS HA 3 25 LYS QB 2.836 2.032 3.640 2.371 2.256 2.444 . 0 0 "[ . 1]" 1
3274 2 15 VAL QG 2 40 ASP HA 4.071 2.414 5.728 4.468 4.127 4.752 . 0 0 "[ . 1]" 1
3275 2 42 ILE MD 3 36 ASN HA 4.071 2.414 5.728 4.225 4.107 4.505 . 0 0 "[ . 1]" 1
3276 2 7 LYS HA 2 10 ILE HB 2.724 . 3.466 2.406 2.257 2.675 . 0 0 "[ . 1]" 1
3277 3 7 LYS HA 3 10 ILE HB 2.724 . 3.466 2.330 2.187 2.517 . 0 0 "[ . 1]" 1
3278 2 23 GLU HA 2 23 GLU QB 2.564 . 3.221 2.410 2.240 2.535 . 0 0 "[ . 1]" 1
3279 3 23 GLU HA 3 23 GLU QB 2.564 . 3.221 2.383 2.209 2.506 . 0 0 "[ . 1]" 1
3280 2 49 GLU HA 2 49 GLU QB 2.845 2.036 3.654 2.296 2.095 2.476 . 0 0 "[ . 1]" 1
3281 3 49 GLU HA 3 49 GLU QB 2.845 2.036 3.654 2.291 2.132 2.424 . 0 0 "[ . 1]" 1
3282 2 14 ILE HA 2 14 ILE MD 2.724 . 3.466 2.660 2.090 3.313 . 0 0 "[ . 1]" 1
3283 2 14 ILE MD 3 14 ILE HA 2.724 . 3.466 2.454 2.031 3.186 . 0 0 "[ . 1]" 1
3284 2 10 ILE HA 2 10 ILE HB 2.804 2.018 3.590 2.630 2.621 2.637 . 0 0 "[ . 1]" 1
3285 3 10 ILE HA 3 10 ILE HB 2.804 2.018 3.590 2.628 2.620 2.639 . 0 0 "[ . 1]" 1
3286 2 38 ALA MB 2 42 ILE HA 3.371 2.235 4.507 4.570 4.417 4.825 0.318 3 0 "[ . 1]" 1
3287 2 38 ALA MB 3 42 ILE HA 3.371 2.235 4.507 4.686 4.366 5.136 0.629 2 2 "[ + . - 1]" 1
3288 2 14 ILE HA 2 15 VAL QG 3.466 2.265 4.667 4.096 4.062 4.134 . 0 0 "[ . 1]" 1
3289 2 35 LEU HG 3 42 ILE HA 3.466 2.265 4.667 3.906 3.707 4.064 . 0 0 "[ . 1]" 1
3290 2 21 ILE HA 2 26 GLU HB3 3.859 2.370 5.348 3.721 3.209 4.127 . 0 0 "[ . 1]" 1
3291 3 21 ILE HA 3 26 GLU QB 3.859 2.370 5.348 2.777 2.476 3.026 . 0 0 "[ . 1]" 1
3292 2 11 ALA MB 2 43 SER QB 3.780 2.352 5.208 5.012 4.899 5.167 . 0 0 "[ . 1]" 1
3293 3 11 ALA MB 3 43 SER QB 3.780 2.352 5.208 4.955 4.856 5.161 . 0 0 "[ . 1]" 1
3294 2 19 SER HA 2 21 ILE MG 3.873 2.373 5.373 3.826 3.078 4.349 . 0 0 "[ . 1]" 1
3295 3 19 SER HA 3 21 ILE MG 3.873 2.373 5.373 3.856 3.221 4.470 . 0 0 "[ . 1]" 1
3296 2 19 SER HA 2 22 VAL HB 3.844 2.367 5.321 4.085 3.861 4.475 . 0 0 "[ . 1]" 1
3297 3 19 SER HA 3 22 VAL HB 3.844 2.367 5.321 4.161 3.865 4.424 . 0 0 "[ . 1]" 1
3298 2 39 MET HA 2 39 MET QB 3.090 2.135 4.045 2.249 2.201 2.392 . 0 0 "[ . 1]" 1
3299 3 39 MET HA 3 39 MET QB 3.090 2.135 4.045 2.288 2.220 2.361 . 0 0 "[ . 1]" 1
3300 2 48 PHE HA 2 49 GLU QB 4.707 2.492 6.922 4.134 3.845 4.361 . 0 0 "[ . 1]" 1
3301 3 48 PHE HA 3 49 GLU QB 4.707 2.492 6.922 4.145 3.836 4.358 . 0 0 "[ . 1]" 1
3302 2 26 GLU H 2 27 ILE HB 4.022 2.404 5.640 3.695 3.631 3.768 . 0 0 "[ . 1]" 1
3303 3 26 GLU H 3 27 ILE HB 4.022 2.404 5.640 3.732 3.648 3.804 . 0 0 "[ . 1]" 1
3304 2 57 LEU H 2 57 LEU QB 3.015 2.424 3.924 1.975 1.875 2.157 0.549 10 5 "[* ** -+]" 1
3305 3 57 LEU H 3 57 LEU QB 3.015 2.424 3.924 2.073 1.728 2.290 0.696 9 2 "[ . +-]" 1
3306 2 46 PHE HB3 2 46 PHE HZ 4.109 2.420 5.798 3.654 3.409 4.005 . 0 0 "[ . 1]" 1
3307 3 46 PHE HB3 3 46 PHE HZ 4.109 2.420 5.798 3.877 3.468 4.398 . 0 0 "[ . 1]" 1
3308 2 70 ILE HB 2 73 SER H 3.893 2.377 5.409 4.556 3.382 5.994 0.585 10 2 "[ - +]" 1
3309 2 56 ILE H 3 70 ILE HB 3.893 2.377 5.409 4.755 3.562 6.087 0.678 10 2 "[- . +]" 1
3310 2 11 ALA H 2 14 ILE HB 3.816 2.360 5.272 4.373 4.009 4.814 . 0 0 "[ . 1]" 1
3311 3 11 ALA H 3 14 ILE HB 3.816 2.360 5.272 4.410 4.015 4.908 . 0 0 "[ . 1]" 1
3312 2 29 GLU QG 2 31 GLY H 4.636 2.487 6.785 5.134 4.886 5.428 . 0 0 "[ . 1]" 1
3313 3 29 GLU QG 3 31 GLY H 4.636 2.487 6.785 5.231 5.075 5.469 . 0 0 "[ . 1]" 1
3314 2 49 GLU HG2 2 52 ALA H 4.290 2.449 6.131 4.683 4.305 5.175 . 0 0 "[ . 1]" 1
3315 3 49 GLU HG2 3 52 ALA H 4.290 2.449 6.131 4.853 4.638 5.170 . 0 0 "[ . 1]" 1
3316 2 16 ASN H 2 53 VAL HB 3.261 2.197 4.325 3.843 3.746 3.949 . 0 0 "[ . 1]" 1
3317 3 16 ASN H 3 53 VAL HB 3.261 2.197 4.325 3.917 3.783 4.066 . 0 0 "[ . 1]" 1
3318 2 49 GLU QB 2 51 GLU H 3.229 2.186 4.272 2.359 2.185 2.548 0.001 4 0 "[ . 1]" 1
3319 3 49 GLU QB 3 51 GLU H 3.229 2.186 4.272 2.414 2.280 2.772 . 0 0 "[ . 1]" 1
3320 2 44 GLU HB2 2 45 ALA H 3.536 2.286 4.786 3.075 2.616 3.389 . 0 0 "[ . 1]" 1
3321 3 44 GLU HB2 3 45 ALA H 3.536 2.286 4.786 3.281 2.774 3.501 . 0 0 "[ . 1]" 1
3322 2 13 LEU H 2 15 VAL QG 3.908 2.381 5.435 3.440 3.350 3.548 . 0 0 "[ . 1]" 1
3323 3 13 LEU H 3 15 VAL QG 3.908 2.381 5.435 3.427 3.341 3.471 . 0 0 "[ . 1]" 1
3324 2 48 PHE QR 2 53 VAL QG 3.176 . 6.000 3.520 2.742 4.015 . 0 0 "[ . 1]" 1
3325 3 48 PHE QR 3 53 VAL QG 3.176 . 6.000 3.458 2.847 5.447 . 0 0 "[ . 1]" 1
3326 2 22 VAL QG 2 23 GLU H 3.358 2.230 4.486 2.291 2.177 2.460 0.053 8 0 "[ . 1]" 1
3327 3 22 VAL QG 3 23 GLU H 3.358 2.230 4.486 2.401 2.259 2.498 . 0 0 "[ . 1]" 1
3328 2 13 LEU H 2 57 LEU QD 3.331 2.221 4.441 2.484 2.312 2.592 . 0 0 "[ . 1]" 1
3329 3 13 LEU H 3 57 LEU QD 3.331 2.221 4.441 2.439 2.358 2.818 . 0 0 "[ . 1]" 1
3330 2 18 PHE QD 2 35 LEU QD 2.682 . 3.401 2.471 2.277 2.880 . 0 0 "[ . 1]" 1
3331 2 46 PHE HZ 3 35 LEU QD 2.682 . 3.401 2.416 2.268 2.648 . 0 0 "[ . 1]" 1
3332 2 13 LEU H 2 53 VAL QG 3.601 2.304 4.898 3.193 3.093 3.249 . 0 0 "[ . 1]" 1
3333 3 13 LEU H 3 53 VAL QG 3.601 2.304 4.898 3.145 2.917 3.659 . 0 0 "[ . 1]" 1
3334 2 16 ASN H 2 53 VAL QG 2.514 . 3.146 2.232 2.134 2.350 . 0 0 "[ . 1]" 1
3335 3 16 ASN H 3 53 VAL QG 2.514 . 3.146 2.332 2.214 2.407 . 0 0 "[ . 1]" 1
3336 2 5 ALA MB 2 62 PHE QD 2.746 . 6.000 4.481 2.579 6.533 0.533 4 1 "[ +. 1]" 1
3337 2 62 PHE QD 3 5 ALA MB 2.746 . 6.000 4.416 2.409 6.553 0.553 4 1 "[ +. 1]" 1
3338 2 11 ALA H 2 14 ILE MG 3.931 2.386 5.476 5.147 4.935 5.260 . 0 0 "[ . 1]" 1
3339 2 11 ALA H 3 14 ILE MG 3.931 2.386 5.476 5.096 4.871 5.263 . 0 0 "[ . 1]" 1
3340 2 14 ILE MG 2 18 PHE QD 2.786 2.010 3.562 2.631 2.452 2.793 . 0 0 "[ . 1]" 1
3341 2 18 PHE HZ 3 14 ILE MG 2.786 2.010 3.562 2.654 2.345 2.763 . 0 0 "[ . 1]" 1
3342 2 42 ILE MG 2 48 PHE QE 2.399 . 2.975 2.313 2.087 2.616 . 0 0 "[ . 1]" 1
3343 2 18 PHE HZ 3 42 ILE MG 2.399 . 2.975 2.246 1.970 2.519 . 0 0 "[ . 1]" 1
3344 2 10 ILE H 2 56 ILE MG 3.267 2.200 4.334 3.322 3.132 3.463 . 0 0 "[ . 1]" 1
3345 3 10 ILE H 3 56 ILE MG 3.267 2.200 4.334 3.171 2.890 4.185 . 0 0 "[ . 1]" 1
3346 2 26 GLU H 2 27 ILE MG 3.242 2.191 4.293 2.988 2.805 3.097 . 0 0 "[ . 1]" 1
3347 3 26 GLU H 3 27 ILE MG 3.242 2.191 4.293 3.037 2.913 3.167 . 0 0 "[ . 1]" 1
3348 2 14 ILE MD 2 18 PHE QD 3.671 2.323 5.019 4.139 3.634 5.185 0.166 10 0 "[ . 1]" 1
3349 2 18 PHE QD 3 14 ILE MD 3.671 2.323 5.019 4.402 3.818 5.286 0.267 9 0 "[ . 1]" 1
3350 2 14 ILE MD 2 17 TYR QD 3.802 2.356 5.248 4.657 3.126 5.536 0.288 6 0 "[ . 1]" 1
3351 2 17 TYR QD 3 14 ILE MD 3.802 2.356 5.248 4.012 2.849 4.575 . 0 0 "[ . 1]" 1
3352 2 27 ILE MD 2 28 SER H 3.985 2.397 5.573 3.357 2.518 3.553 . 0 0 "[ . 1]" 1
3353 3 27 ILE MD 3 28 SER H 3.985 2.397 5.573 3.443 3.341 3.562 . 0 0 "[ . 1]" 1
3354 2 52 ALA H 2 56 ILE MD 3.957 2.391 5.523 3.771 3.475 3.970 . 0 0 "[ . 1]" 1
3355 3 52 ALA H 3 56 ILE MD 3.957 2.391 5.523 3.751 3.481 3.980 . 0 0 "[ . 1]" 1
3356 2 11 ALA H 2 11 ALA HA 2.561 . 3.217 2.665 2.637 2.689 . 0 0 "[ . 1]" 1
3357 3 11 ALA H 3 11 ALA HA 2.561 . 3.217 2.691 2.673 2.704 . 0 0 "[ . 1]" 1
3358 2 11 ALA HA 2 48 PHE QE 3.171 2.166 4.176 4.133 3.987 4.223 0.047 3 0 "[ . 1]" 1
3359 2 18 PHE HZ 3 11 ALA HA 3.171 2.166 4.176 4.129 4.000 4.296 0.120 7 0 "[ . 1]" 1
3360 2 30 ASP HA 2 33 ASP H 2.882 2.051 3.713 2.713 2.612 2.750 . 0 0 "[ . 1]" 1
3361 3 30 ASP HA 3 33 ASP H 2.882 2.051 3.713 2.729 2.682 2.766 . 0 0 "[ . 1]" 1
3362 2 30 ASP HA 2 32 ALA H 3.368 2.234 4.502 3.959 3.766 4.106 . 0 0 "[ . 1]" 1
3363 3 30 ASP HA 3 32 ALA H 3.368 2.234 4.502 3.899 3.762 4.058 . 0 0 "[ . 1]" 1
3364 2 57 LEU H 2 57 LEU HA 3.035 2.114 3.956 2.753 2.725 2.775 . 0 0 "[ . 1]" 1
3365 3 57 LEU H 3 57 LEU HA 3.035 2.114 3.956 2.730 2.704 2.757 . 0 0 "[ . 1]" 1
3366 2 54 SER HA 2 55 GLY H 3.445 2.258 4.632 2.646 2.451 2.830 . 0 0 "[ . 1]" 1
3367 3 54 SER HA 3 55 GLY H 3.445 2.258 4.632 2.850 2.757 2.964 . 0 0 "[ . 1]" 1
3368 2 8 GLU HA 2 9 GLU H 3.700 2.331 5.069 3.258 2.602 3.420 . 0 0 "[ . 1]" 1
3369 3 8 GLU HA 3 9 GLU H 3.700 2.331 5.069 3.325 2.676 3.468 . 0 0 "[ . 1]" 1
3370 2 8 GLU HA 2 46 PHE HZ 3.822 2.361 5.283 4.981 4.648 5.283 . 0 0 "[ . 1]" 1
3371 3 8 GLU HA 3 46 PHE HZ 3.822 2.361 5.283 4.948 4.535 5.290 0.007 8 0 "[ . 1]" 1
3372 2 10 ILE HA 2 62 PHE QE 4.120 2.422 5.818 4.216 3.981 4.545 . 0 0 "[ . 1]" 1
3373 2 18 PHE QD 3 42 ILE HA 4.120 2.422 5.818 4.050 3.655 4.251 . 0 0 "[ . 1]" 1
3374 2 6 SER HB3 2 7 LYS H 4.211 2.438 5.984 2.863 2.408 3.200 0.030 8 0 "[ . 1]" 1
3375 3 6 SER HB3 3 7 LYS H 4.211 2.438 5.984 2.767 2.318 3.321 0.120 2 0 "[ . 1]" 1
3376 2 28 SER H 2 28 SER HB2 4.235 2.442 6.028 2.628 2.274 3.034 0.168 9 0 "[ . 1]" 1
3377 3 28 SER H 3 28 SER HB2 4.235 2.442 6.028 2.491 2.163 3.064 0.279 1 0 "[ . 1]" 1
3378 2 6 SER HB2 2 7 LYS H 3.558 2.292 4.824 2.800 2.067 3.615 0.225 2 0 "[ . 1]" 1
3379 3 6 SER HB2 3 7 LYS H 3.558 2.292 4.824 2.752 2.263 3.634 0.029 6 0 "[ . 1]" 1
3380 2 21 ILE MG 2 26 GLU HB3 2.873 2.047 3.699 3.213 2.987 3.441 . 0 0 "[ . 1]" 1
3381 3 21 ILE MG 3 26 GLU QB 2.873 2.047 3.699 2.219 1.940 2.689 0.107 5 0 "[ . 1]" 1
3382 2 21 ILE QG 2 21 ILE MG 2.760 . 3.522 2.260 2.198 2.308 . 0 0 "[ . 1]" 1
3383 3 21 ILE QG 3 21 ILE MG 2.760 . 3.522 2.268 2.151 2.382 . 0 0 "[ . 1]" 1
3384 2 15 VAL QG 2 56 ILE MG 2.547 . 6.000 5.316 5.192 5.552 . 0 0 "[ . 1]" 1
3385 3 15 VAL QG 3 56 ILE MG 2.547 . 6.000 5.378 5.194 6.263 0.263 9 0 "[ . 1]" 1
3386 2 9 GLU HA 2 56 ILE MG 2.167 . 2.637 2.061 1.949 2.167 . 0 0 "[ . 1]" 1
3387 3 9 GLU HA 3 56 ILE MG 2.167 . 2.637 2.006 1.945 2.085 . 0 0 "[ . 1]" 1
3388 2 18 PHE HB3 2 27 ILE MG 3.710 . 6.000 4.898 4.599 5.363 . 0 0 "[ . 1]" 1
3389 2 7 LYS HE2 3 27 ILE MG 3.710 . 6.000 4.923 4.496 5.219 . 0 0 "[ . 1]" 1
3390 2 21 ILE HB 2 27 ILE MG 3.332 2.222 4.442 3.957 3.764 4.239 . 0 0 "[ . 1]" 1
3391 3 21 ILE HB 3 27 ILE MG 3.332 2.222 4.442 3.970 3.830 4.093 . 0 0 "[ . 1]" 1
3392 2 27 ILE HG12 2 27 ILE MG 1.832 . 2.167 1.991 1.845 2.104 . 0 0 "[ . 1]" 1
3393 3 27 ILE HG12 3 27 ILE MG 1.832 . 2.167 2.076 2.006 2.181 0.014 9 0 "[ . 1]" 1
3394 2 14 ILE HA 2 14 ILE MD 3.214 2.181 4.247 2.846 2.053 3.525 0.128 5 0 "[ . 1]" 1
3395 2 14 ILE HA 3 14 ILE MD 3.214 2.181 4.247 2.506 2.015 3.435 0.166 8 0 "[ . 1]" 1
3396 2 14 ILE MD 2 15 VAL QG 3.685 2.327 5.043 4.200 3.762 4.527 . 0 0 "[ . 1]" 1
3397 2 15 VAL QG 3 14 ILE MD 3.685 2.327 5.043 4.268 3.678 4.613 . 0 0 "[ . 1]" 1
3398 2 14 ILE MD 2 15 VAL QG 3.126 2.149 4.103 2.820 1.888 3.847 0.261 6 0 "[ . 1]" 1
3399 3 14 ILE MD 3 15 VAL QG 3.126 2.149 4.103 3.171 1.834 4.001 0.315 5 0 "[ . 1]" 1
3400 2 56 ILE HB 2 56 ILE MD 2.050 . 2.470 1.970 1.920 1.999 . 0 0 "[ . 1]" 1
3401 3 56 ILE HB 3 56 ILE MD 2.050 . 2.470 1.979 1.939 2.008 . 0 0 "[ . 1]" 1
3402 2 15 VAL QG 2 56 ILE MD 2.722 . 3.463 3.654 3.350 3.990 0.527 4 1 "[ +. 1]" 1
3403 3 15 VAL QG 3 56 ILE MD 2.722 . 3.463 3.596 3.096 4.352 0.889 9 1 "[ . +1]" 1
3404 2 70 ILE MD 3 13 LEU MD2 3.088 . 6.000 4.759 4.275 5.317 . 0 0 "[ . 1]" 1
3405 2 13 LEU MD2 3 70 ILE MD 3.088 . 6.000 4.780 4.307 5.804 . 0 0 "[ . 1]" 1
3406 2 21 ILE MD 2 27 ILE MD 3.018 2.107 3.929 4.322 4.071 4.464 0.535 7 4 "[* * + -1]" 1
3407 2 10 ILE MG 3 21 ILE MD 3.018 2.107 3.929 4.401 3.863 4.896 0.967 5 5 "[ +-* **]" 1
3408 2 14 ILE HA 2 42 ILE MD 4.083 2.416 5.750 3.731 3.662 3.787 . 0 0 "[ . 1]" 1
3409 3 14 ILE HA 3 42 ILE MD 4.083 2.416 5.750 3.639 2.907 3.843 . 0 0 "[ . 1]" 1
3410 2 38 ALA MB 2 42 ILE MD 1.981 . 2.373 2.411 1.953 2.674 0.301 10 0 "[ . 1]" 1
3411 2 38 ALA MB 3 42 ILE MD 1.981 . 2.373 2.686 2.337 3.269 0.896 4 3 "[ +. * -]" 1
3412 2 9 GLU HA 2 56 ILE MD 3.996 2.399 5.593 3.616 3.478 3.742 . 0 0 "[ . 1]" 1
3413 3 9 GLU HA 3 56 ILE MD 3.996 2.399 5.593 3.481 3.321 3.586 . 0 0 "[ . 1]" 1
3414 2 38 ALA MB 2 41 CYS QB 3.256 2.196 4.316 2.700 2.410 3.105 . 0 0 "[ . 1]" 1
3415 2 41 CYS QB 3 38 ALA MB 3.256 2.196 4.316 2.996 2.807 3.248 . 0 0 "[ . 1]" 1
3416 2 22 VAL HB 2 22 VAL QG 1.701 . 1.988 1.686 1.682 1.689 . 0 0 "[ . 1]" 1
3417 3 22 VAL HB 3 22 VAL QG 1.701 . 1.988 1.684 1.680 1.687 . 0 0 "[ . 1]" 1
3418 2 22 VAL QG 2 35 LEU QD 2.141 . 2.599 2.018 1.947 2.083 . 0 0 "[ . 1]" 1
3419 3 22 VAL QG 3 35 LEU QD 2.141 . 2.599 1.938 1.826 2.070 . 0 0 "[ . 1]" 1
3420 2 21 ILE MD 2 21 ILE QG 2.110 . 2.555 1.794 1.785 1.804 . 0 0 "[ . 1]" 1
3421 3 21 ILE MD 3 21 ILE QG 2.110 . 2.555 1.797 1.771 1.816 . 0 0 "[ . 1]" 1
3422 2 56 ILE HG12 2 56 ILE MG 2.200 . 2.684 1.806 1.779 1.825 . 0 0 "[ . 1]" 1
3423 3 56 ILE HG12 3 56 ILE MG 2.200 . 2.684 1.810 1.787 1.825 . 0 0 "[ . 1]" 1
3424 2 23 GLU HA 2 23 GLU HG2 3.100 2.139 4.061 2.422 2.070 2.673 0.069 4 0 "[ . 1]" 1
3425 3 23 GLU HA 3 23 GLU HG2 3.100 2.139 4.061 2.426 2.159 2.703 . 0 0 "[ . 1]" 1
3426 2 15 VAL QG 2 50 ARG HB2 4.169 2.431 5.907 3.587 2.827 4.163 . 0 0 "[ . 1]" 1
3427 3 15 VAL QG 3 50 ARG HB2 4.169 2.431 5.907 3.472 2.889 3.904 . 0 0 "[ . 1]" 1
3428 2 19 SER HA 2 22 VAL QG 3.392 2.242 3.763 2.129 2.022 2.259 0.220 8 0 "[ . 1]" 1
3429 3 19 SER HA 3 22 VAL QG 3.392 2.242 3.763 2.145 1.970 2.368 0.272 7 0 "[ . 1]" 1
3430 2 13 LEU HA 2 53 VAL QG 3.296 2.210 4.382 2.521 2.240 2.793 . 0 0 "[ . 1]" 1
3431 3 13 LEU HA 3 53 VAL QG 3.296 2.210 4.382 2.728 2.425 3.736 . 0 0 "[ . 1]" 1
3432 2 21 ILE HA 2 22 VAL QG 3.448 2.259 4.637 2.372 1.980 2.656 0.279 2 0 "[ . 1]" 1
3433 3 21 ILE HA 3 22 VAL QG 3.448 2.259 4.637 2.173 1.891 2.524 0.368 2 0 "[ . 1]" 1
3434 2 13 LEU HA 2 15 VAL QG 3.733 2.339 5.127 3.189 3.011 3.322 . 0 0 "[ . 1]" 1
3435 3 13 LEU HA 3 15 VAL QG 3.733 2.339 5.127 3.269 3.149 3.356 . 0 0 "[ . 1]" 1
3436 2 7 LYS HB2 2 7 LYS HG2 2.745 . 3.499 2.401 2.162 2.668 . 0 0 "[ . 1]" 1
3437 3 7 LYS QB 3 7 LYS QG 2.745 . 3.499 1.943 1.889 1.975 0.102 5 0 "[ . 1]" 1
3438 2 37 VAL QG 2 38 ALA H 3.509 2.278 4.740 2.161 2.069 2.230 0.209 2 0 "[ . 1]" 1
3439 3 37 VAL QG 3 38 ALA H 3.509 2.278 4.740 2.062 1.931 2.205 0.347 6 0 "[ . 1]" 1
3440 2 15 VAL QG 2 17 TYR H 4.332 2.455 6.209 3.860 3.722 4.040 . 0 0 "[ . 1]" 1
3441 3 15 VAL QG 3 17 TYR H 4.332 2.455 6.209 3.882 3.570 4.046 . 0 0 "[ . 1]" 1
3442 2 15 VAL QG 2 18 PHE QE 4.378 2.462 6.294 4.766 4.216 5.163 . 0 0 "[ . 1]" 1
3443 2 18 PHE QE 3 15 VAL QG 4.378 2.462 6.294 4.540 4.263 4.724 . 0 0 "[ . 1]" 1
3444 2 22 VAL QG 2 25 LYS H 3.982 2.397 5.567 4.013 3.930 4.074 . 0 0 "[ . 1]" 1
3445 3 22 VAL QG 3 25 LYS H 3.982 2.397 5.567 4.019 3.946 4.099 . 0 0 "[ . 1]" 1
3446 2 8 GLU HG3 2 9 GLU H 4.497 2.474 6.520 4.116 3.687 4.431 . 0 0 "[ . 1]" 1
3447 3 8 GLU QG 3 9 GLU H 4.497 2.474 6.520 3.438 2.295 3.823 0.179 6 0 "[ . 1]" 1
3448 2 9 GLU HA 2 10 ILE H 3.369 2.234 4.504 3.378 3.343 3.401 . 0 0 "[ . 1]" 1
3449 3 9 GLU HA 3 10 ILE H 3.369 2.234 4.504 3.344 3.297 3.434 . 0 0 "[ . 1]" 1
3450 2 36 ASN HA 2 36 ASN QD 4.199 2.436 5.962 3.627 2.719 4.123 . 0 0 "[ . 1]" 1
3451 3 36 ASN HA 3 36 ASN QD 4.199 2.436 5.962 3.415 2.824 4.100 . 0 0 "[ . 1]" 1
3452 2 19 SER HA 2 22 VAL HB 3.757 2.345 5.169 4.289 4.150 4.447 . 0 0 "[ . 1]" 1
3453 3 19 SER HA 3 22 VAL HB 3.757 2.345 5.169 4.345 4.136 4.511 . 0 0 "[ . 1]" 1
3454 2 11 ALA HA 2 14 ILE MG 3.991 2.398 5.584 3.873 3.409 4.090 . 0 0 "[ . 1]" 1
3455 2 11 ALA HA 3 14 ILE MG 3.991 2.398 5.584 3.800 3.313 4.200 . 0 0 "[ . 1]" 1
3456 2 19 SER HA 2 21 ILE MG 4.166 2.430 5.902 5.147 4.979 5.269 . 0 0 "[ . 1]" 1
3457 3 19 SER HA 3 21 ILE MG 4.166 2.430 5.902 5.127 5.008 5.233 . 0 0 "[ . 1]" 1
3458 2 10 ILE MG 2 11 ALA MB 3.398 2.244 4.552 3.833 3.593 4.025 . 0 0 "[ . 1]" 1
3459 3 10 ILE MG 3 11 ALA MB 3.398 2.244 4.552 3.756 3.580 3.966 . 0 0 "[ . 1]" 1
3460 2 10 ILE MG 2 14 ILE HB 3.973 2.395 5.551 4.298 3.811 4.884 . 0 0 "[ . 1]" 1
3461 2 14 ILE HB 3 10 ILE MG 3.973 2.395 5.551 4.161 3.510 4.882 . 0 0 "[ . 1]" 1
3462 2 10 ILE MG 3 18 PHE QD 3.765 2.347 5.183 4.001 3.566 4.506 . 0 0 "[ . 1]" 1
3463 2 18 PHE QD 3 10 ILE MG 3.765 2.347 5.183 4.060 3.648 4.918 . 0 0 "[ . 1]" 1
3464 2 5 ALA MB 2 9 GLU H 4.311 2.452 6.170 4.947 4.220 5.795 . 0 0 "[ . 1]" 1
3465 2 16 ASN HD22 3 5 ALA MB 4.311 2.452 6.170 5.079 4.112 5.989 . 0 0 "[ . 1]" 1
3466 2 9 GLU H 2 10 ILE MG 5.403 2.484 8.322 5.351 5.036 5.557 . 0 0 "[ . 1]" 1
3467 3 9 GLU H 3 10 ILE MG 5.403 2.484 8.322 5.326 5.171 5.538 . 0 0 "[ . 1]" 1
3468 2 32 ALA H 2 35 LEU QD 4.448 2.469 6.427 3.892 3.591 4.169 . 0 0 "[ . 1]" 1
3469 2 42 ILE H 3 35 LEU QD 4.448 2.469 6.427 4.124 4.016 4.268 . 0 0 "[ . 1]" 1
3470 2 23 GLU H 2 35 LEU QD 4.300 2.451 6.149 4.305 4.126 4.483 . 0 0 "[ . 1]" 1
3471 3 23 GLU H 3 35 LEU QD 4.300 2.451 6.149 4.297 4.231 4.341 . 0 0 "[ . 1]" 1
3472 2 34 SER H 2 35 LEU QD 4.819 2.496 7.142 3.347 2.991 3.601 . 0 0 "[ . 1]" 1
3473 2 46 PHE QD 3 35 LEU QD 4.819 2.496 7.142 3.419 3.204 3.738 . 0 0 "[ . 1]" 1
3474 2 7 LYS HG2 2 9 GLU H 5.192 2.497 7.887 4.693 4.469 4.923 . 0 0 "[ . 1]" 1
3475 3 7 LYS QG 3 9 GLU H 5.192 2.497 7.887 3.562 3.159 4.603 . 0 0 "[ . 1]" 1
3476 2 7 LYS H 2 7 LYS HG2 2.919 2.067 3.771 1.856 1.595 2.108 0.472 1 0 "[ . 1]" 1
3477 3 7 LYS H 3 7 LYS QG 2.919 2.067 3.771 1.904 1.561 2.555 0.506 1 1 "[+ . 1]" 1
3478 2 8 GLU HB3 2 48 PHE QR 4.807 2.497 7.117 6.045 5.221 6.576 . 0 0 "[ . 1]" 1
3479 3 8 GLU HB3 3 48 PHE QR 4.807 2.497 7.117 5.971 4.935 6.586 . 0 0 "[ . 1]" 1
3480 2 8 GLU HB2 2 46 PHE HZ 4.721 2.492 6.950 5.905 5.480 6.359 . 0 0 "[ . 1]" 1
3481 3 8 GLU HB2 3 46 PHE HZ 4.721 2.492 6.950 5.876 5.145 6.482 . 0 0 "[ . 1]" 1
3482 2 9 GLU HA 2 57 LEU QD 4.709 2.492 6.926 2.995 2.462 3.288 0.030 1 0 "[ . 1]" 1
3483 3 9 GLU HA 3 57 LEU QD 4.709 2.492 6.926 3.077 2.497 4.331 . 0 0 "[ . 1]" 1
3484 2 38 ALA HA 2 42 ILE MD 3.587 2.301 4.873 3.958 3.695 4.091 . 0 0 "[ . 1]" 1
3485 2 38 ALA HA 3 42 ILE MD 3.587 2.301 4.873 4.101 3.505 4.739 . 0 0 "[ . 1]" 1
3486 2 41 CYS QB 2 42 ILE MD 4.609 2.484 6.734 4.147 3.904 4.480 . 0 0 "[ . 1]" 1
3487 2 41 CYS QB 3 42 ILE MD 4.609 2.484 6.734 3.760 2.377 4.249 0.107 2 0 "[ . 1]" 1
3488 2 39 MET QB 2 42 ILE MD 4.034 2.407 5.661 3.926 3.623 4.341 . 0 0 "[ . 1]" 1
3489 3 39 MET QB 3 42 ILE MD 4.034 2.407 5.661 4.088 3.717 4.619 . 0 0 "[ . 1]" 1
3490 2 39 MET HG2 2 42 ILE MD 4.019 2.404 5.634 4.836 3.517 5.572 . 0 0 "[ . 1]" 1
3491 2 39 MET HG2 3 42 ILE MD 4.019 2.404 5.634 4.522 3.328 5.433 . 0 0 "[ . 1]" 1
3492 2 15 VAL HB 2 42 ILE MD 4.008 . 6.000 5.906 5.485 6.265 0.265 6 0 "[ . 1]" 1
3493 2 37 VAL HB 3 42 ILE MD 4.008 . 6.000 5.435 4.374 6.226 0.226 2 0 "[ . 1]" 1
3494 2 17 TYR H 2 21 ILE MD 4.463 2.471 6.455 4.299 3.940 4.552 . 0 0 "[ . 1]" 1
3495 3 17 TYR H 3 21 ILE MD 4.463 2.471 6.455 4.212 3.971 4.476 . 0 0 "[ . 1]" 1
3496 2 20 SER H 2 21 ILE MD 5.043 2.500 7.586 4.509 4.303 4.699 . 0 0 "[ . 1]" 1
3497 3 20 SER H 3 21 ILE MD 5.043 2.500 7.586 4.567 4.369 4.851 . 0 0 "[ . 1]" 1
3498 2 44 GLU H 2 45 ALA HA 4.227 2.440 6.014 3.769 3.709 3.818 . 0 0 "[ . 1]" 1
3499 3 44 GLU H 3 45 ALA HA 4.227 2.440 6.014 3.817 3.740 3.877 . 0 0 "[ . 1]" 1
3500 2 8 GLU HA 2 10 ILE H 3.664 2.322 5.006 3.435 3.312 3.638 . 0 0 "[ . 1]" 1
3501 3 8 GLU HA 3 10 ILE H 3.664 2.322 5.006 3.558 3.423 3.684 . 0 0 "[ . 1]" 1
3502 2 56 ILE HA 2 57 LEU H 3.818 2.360 5.276 3.513 3.468 3.557 . 0 0 "[ . 1]" 1
3503 3 56 ILE HA 3 57 LEU H 3.818 2.360 5.276 3.494 3.450 3.546 . 0 0 "[ . 1]" 1
3504 2 42 ILE HA 2 44 GLU H 4.086 2.417 5.755 3.337 3.001 3.637 . 0 0 "[ . 1]" 1
3505 3 42 ILE HA 3 44 GLU H 4.086 2.417 5.755 3.312 2.833 3.621 . 0 0 "[ . 1]" 1
3506 2 52 ALA H 2 53 VAL HA 3.826 2.362 5.290 3.424 3.234 3.692 . 0 0 "[ . 1]" 1
3507 3 52 ALA H 3 53 VAL HA 3.826 2.362 5.290 3.375 3.184 3.929 . 0 0 "[ . 1]" 1
3508 2 21 ILE H 2 22 VAL HA 4.096 2.418 5.774 4.238 3.860 4.547 . 0 0 "[ . 1]" 1
3509 3 21 ILE H 3 22 VAL HA 4.096 2.418 5.774 4.027 3.757 4.311 . 0 0 "[ . 1]" 1
3510 2 8 GLU HG3 2 42 ILE MG 3.920 . 6.000 5.545 4.974 5.992 . 0 0 "[ . 1]" 1
3511 3 8 GLU QG 3 42 ILE MG 3.920 . 6.000 5.322 4.940 5.616 . 0 0 "[ . 1]" 1
3512 2 25 LYS HA 2 27 ILE MG 3.603 2.305 4.901 3.444 3.228 3.645 . 0 0 "[ . 1]" 1
3513 3 25 LYS HA 3 27 ILE MG 3.603 2.305 4.901 3.505 3.160 3.761 . 0 0 "[ . 1]" 1
3514 2 15 VAL QG 2 39 MET HG2 4.183 2.434 5.932 2.402 2.042 2.869 0.392 3 0 "[ . 1]" 1
3515 3 15 VAL QG 3 39 MET HG2 4.183 2.434 5.932 2.324 2.031 2.687 0.403 7 0 "[ . 1]" 1
3516 2 15 VAL QG 2 39 MET HG3 4.411 2.465 6.357 2.314 1.882 3.692 0.583 7 1 "[ . + 1]" 1
3517 3 15 VAL QG 3 39 MET HG3 4.411 2.465 6.357 2.961 2.113 3.824 0.352 5 0 "[ . 1]" 1
3518 2 18 PHE HB3 2 21 ILE HB 3.959 2.391 5.527 2.445 2.167 3.033 0.224 3 0 "[ . 1]" 1
3519 3 18 PHE HB3 3 21 ILE HB 3.959 2.391 5.527 2.556 1.963 3.376 0.428 7 0 "[ . 1]" 1
3520 2 22 VAL QG 2 36 ASN HB2 4.514 2.477 6.551 3.449 3.022 3.785 . 0 0 "[ . 1]" 1
3521 3 22 VAL QG 3 36 ASN HB2 4.514 2.477 6.551 3.563 3.328 3.721 . 0 0 "[ . 1]" 1
3522 2 22 VAL QG 2 36 ASN HB3 4.542 2.479 6.605 3.803 3.492 4.098 . 0 0 "[ . 1]" 1
3523 3 22 VAL QG 3 36 ASN HB3 4.542 2.479 6.605 3.847 3.494 4.197 . 0 0 "[ . 1]" 1
3524 2 32 ALA MB 2 36 ASN HB3 5.084 2.499 7.669 4.907 4.454 5.492 . 0 0 "[ . 1]" 1
3525 3 32 ALA MB 3 36 ASN HB3 5.084 2.499 7.669 5.088 4.613 5.593 . 0 0 "[ . 1]" 1
3526 2 14 ILE MG 2 17 TYR HB2 4.335 2.456 6.214 4.583 4.334 4.844 . 0 0 "[ . 1]" 1
3527 3 14 ILE MG 3 17 TYR HB2 4.335 2.456 6.214 4.560 4.206 4.810 . 0 0 "[ . 1]" 1
3528 2 27 ILE HG13 2 31 GLY HA3 3.601 2.304 4.898 2.631 2.122 3.151 0.182 2 0 "[ . 1]" 1
3529 2 45 ALA MB 3 31 GLY HA3 3.601 2.304 4.898 2.658 2.238 3.180 0.066 2 0 "[ . 1]" 1
3530 2 17 TYR HA 3 10 ILE HG13 4.742 2.493 6.991 5.032 4.405 5.647 . 0 0 "[ . 1]" 1
3531 2 10 ILE HG13 3 17 TYR HA 4.742 2.493 6.991 4.235 3.665 5.190 . 0 0 "[ . 1]" 1
3532 2 17 TYR HA 2 21 ILE MD 4.605 2.484 6.726 4.152 3.994 4.356 . 0 0 "[ . 1]" 1
3533 3 17 TYR HA 3 21 ILE MD 4.605 2.484 6.726 4.234 4.004 4.579 . 0 0 "[ . 1]" 1
3534 2 14 ILE MD 2 17 TYR HA 4.420 2.467 6.373 6.291 5.745 6.858 0.485 9 0 "[ . 1]" 1
3535 2 14 ILE MD 3 17 TYR HA 4.420 2.467 6.373 6.251 5.825 6.771 0.398 5 0 "[ . 1]" 1
3536 2 15 VAL HA 2 39 MET QB 4.456 2.471 6.441 2.398 2.058 3.584 0.413 3 0 "[ . 1]" 1
3537 3 15 VAL HA 3 39 MET QB 4.456 2.471 6.441 2.790 1.958 3.549 0.513 10 1 "[ . +]" 1
3538 2 43 SER QB 2 48 PHE QR 4.579 2.495 6.676 3.604 3.437 3.929 . 0 0 "[ . 1]" 1
3539 3 43 SER QB 3 48 PHE QR 4.579 2.495 6.676 3.579 3.451 3.738 . 0 0 "[ . 1]" 1
3540 2 50 ARG HA 2 50 ARG HE 4.942 2.499 7.385 3.974 3.704 4.251 . 0 0 "[ . 1]" 1
3541 3 50 ARG HA 3 50 ARG HE 4.942 2.499 7.385 4.016 3.654 4.360 . 0 0 "[ . 1]" 1
3542 2 7 LYS QE 2 7 LYS HG2 3.559 2.292 4.826 2.765 2.604 2.938 . 0 0 "[ . 1]" 1
3543 3 7 LYS QE 3 7 LYS QG 3.559 2.472 4.826 2.548 2.192 2.799 0.280 9 0 "[ . 1]" 1
3544 2 7 LYS QE 2 7 LYS HG3 4.478 2.472 6.484 3.479 3.438 3.509 . 0 0 "[ . 1]" 1
3545 2 20 SER HB2 2 24 LYS QD 4.253 2.444 6.062 4.828 4.062 6.519 0.457 9 0 "[ . 1]" 1
3546 3 20 SER HB2 3 24 LYS HD2 4.253 2.444 6.062 4.476 3.600 5.598 . 0 0 "[ . 1]" 1
3547 2 20 SER HB2 2 21 ILE QG 3.799 2.355 5.243 3.670 3.355 4.348 . 0 0 "[ . 1]" 1
3548 3 20 SER HB2 3 21 ILE QG 3.799 2.355 5.243 3.777 3.351 4.334 . 0 0 "[ . 1]" 1
3549 2 14 ILE HA 2 15 VAL HA 4.742 2.493 6.991 3.873 3.724 4.043 . 0 0 "[ . 1]" 1
3550 3 14 ILE HA 3 15 VAL HA 4.742 2.493 6.991 3.794 3.550 3.958 . 0 0 "[ . 1]" 1
3551 2 36 ASN HB3 2 37 VAL HA 3.507 2.277 4.737 3.231 2.583 4.097 . 0 0 "[ . 1]" 1
3552 3 36 ASN HB3 3 37 VAL HA 3.507 2.277 4.737 4.028 3.766 4.379 . 0 0 "[ . 1]" 1
3553 2 43 SER QB 2 50 ARG QG 3.634 2.313 4.955 2.575 2.279 3.372 0.034 5 0 "[ . 1]" 1
3554 2 70 ILE HB 3 54 SER HA 3.634 2.313 4.955 2.547 2.087 3.138 0.226 7 0 "[ . 1]" 1
3555 2 27 ILE HG12 2 28 SER HA 4.584 2.482 6.686 4.176 4.021 4.590 . 0 0 "[ . 1]" 1
3556 3 27 ILE HG12 3 28 SER HA 4.584 2.482 6.686 4.111 4.031 4.206 . 0 0 "[ . 1]" 1
3557 2 15 VAL QG 2 16 ASN HA 3.677 2.325 5.029 2.456 2.216 2.665 0.109 3 0 "[ . 1]" 1
3558 3 15 VAL QG 3 16 ASN HA 3.677 2.325 5.029 2.607 2.385 3.074 . 0 0 "[ . 1]" 1
3559 2 21 ILE MD 2 26 GLU HA 4.523 2.477 6.569 4.272 3.995 4.483 . 0 0 "[ . 1]" 1
3560 3 21 ILE MD 3 26 GLU HA 4.523 2.477 6.569 4.235 4.017 4.425 . 0 0 "[ . 1]" 1
3561 2 11 ALA MB 2 46 PHE HB3 3.939 2.387 5.491 3.370 3.094 3.703 . 0 0 "[ . 1]" 1
3562 3 11 ALA MB 3 46 PHE HB3 3.939 2.387 5.491 3.553 3.299 3.919 . 0 0 "[ . 1]" 1
3563 2 42 ILE HB 2 42 ILE MD 2.237 . 2.737 1.971 1.954 1.987 . 0 0 "[ . 1]" 1
3564 3 42 ILE HB 3 42 ILE MD 2.237 . 2.737 1.964 1.905 1.998 . 0 0 "[ . 1]" 1
3565 2 15 VAL QG 2 16 ASN HB3 4.203 2.437 5.969 3.085 2.797 3.304 . 0 0 "[ . 1]" 1
3566 3 15 VAL QG 3 16 ASN HB3 4.203 2.437 5.969 3.016 2.638 3.710 . 0 0 "[ . 1]" 1
3567 2 11 ALA H 2 14 ILE HG12 4.398 2.464 6.332 5.023 3.517 5.739 . 0 0 "[ . 1]" 1
3568 2 11 ALA H 3 14 ILE HG12 4.398 2.464 6.332 5.145 4.651 5.497 . 0 0 "[ . 1]" 1
3569 2 14 ILE MD 2 14 ILE HG12 2.345 . 2.895 2.045 1.942 2.107 . 0 0 "[ . 1]" 1
3570 2 14 ILE MD 3 14 ILE HG12 2.345 . 2.895 2.004 1.696 2.103 0.099 5 0 "[ . 1]" 1
3571 2 14 ILE HB 2 15 VAL QG 3.505 2.277 4.733 2.906 2.537 3.333 . 0 0 "[ . 1]" 1
3572 3 14 ILE HB 3 15 VAL QG 3.505 2.277 4.733 2.907 2.319 3.366 . 0 0 "[ . 1]" 1
3573 2 18 PHE HB3 2 21 ILE QG 4.801 2.496 7.106 4.810 4.570 4.989 . 0 0 "[ . 1]" 1
3574 2 42 ILE MD 3 18 PHE HB3 4.801 2.496 7.106 4.843 4.644 5.046 . 0 0 "[ . 1]" 1
3575 2 15 VAL QG 2 18 PHE HB2 4.713 2.492 6.934 4.007 3.877 4.181 . 0 0 "[ . 1]" 1
3576 2 42 ILE MD 3 18 PHE HB2 4.713 2.492 6.934 3.912 3.779 4.063 . 0 0 "[ . 1]" 1
3577 2 35 LEU QD 2 36 ASN HB2 4.885 2.499 7.271 3.827 3.125 4.363 . 0 0 "[ . 1]" 1
3578 2 41 CYS QB 3 35 LEU QD 4.885 2.499 7.271 4.382 3.981 4.737 . 0 0 "[ . 1]" 1
3579 2 42 ILE HB 2 48 PHE QE 4.373 2.460 6.286 4.041 3.785 4.234 . 0 0 "[ . 1]" 1
3580 2 18 PHE HZ 3 42 ILE HB 4.373 2.460 6.286 3.828 3.351 4.103 . 0 0 "[ . 1]" 1
3581 2 41 CYS QB 2 45 ALA MB 4.268 2.447 6.089 3.605 3.305 4.176 . 0 0 "[ . 1]" 1
3582 2 37 VAL QG 3 41 CYS QB 4.268 2.447 6.089 3.697 3.399 4.036 . 0 0 "[ . 1]" 1
3583 2 38 ALA MB 2 41 CYS QB 3.495 2.274 4.716 3.116 2.834 3.465 . 0 0 "[ . 1]" 1
3584 2 38 ALA MB 3 41 CYS QB 3.495 2.274 4.716 2.653 2.386 2.964 . 0 0 "[ . 1]" 1
3585 2 37 VAL HB 2 41 CYS QB 4.256 2.445 6.067 5.945 5.400 6.247 0.180 6 0 "[ . 1]" 1
3586 2 37 VAL HB 3 41 CYS QB 4.256 2.445 6.067 5.985 5.571 6.355 0.288 4 0 "[ . 1]" 1
3587 2 37 VAL HA 2 38 ALA H 4.116 2.422 5.810 3.358 3.273 3.430 . 0 0 "[ . 1]" 1
3588 3 37 VAL HA 3 38 ALA H 4.116 2.422 5.810 3.418 3.395 3.449 . 0 0 "[ . 1]" 1
3589 2 17 TYR HB2 2 20 SER HB2 4.023 2.404 5.642 4.057 2.765 5.276 . 0 0 "[ . 1]" 1
3590 3 17 TYR HB2 3 20 SER HB2 4.023 2.404 5.642 4.380 2.624 6.038 0.396 6 0 "[ . 1]" 1
3591 2 8 GLU HB3 2 57 LEU QD 4.302 2.451 6.153 3.570 2.875 3.973 . 0 0 "[ . 1]" 1
3592 3 8 GLU HB3 3 57 LEU QD 4.302 2.451 6.153 3.570 2.697 4.535 . 0 0 "[ . 1]" 1
3593 2 15 VAL QG 2 50 ARG QG 3.574 2.297 4.851 2.632 2.177 3.349 0.120 8 0 "[ . 1]" 1
3594 3 15 VAL QG 3 50 ARG QG 3.574 2.297 4.851 2.761 2.097 3.509 0.200 4 0 "[ . 1]" 1
3595 2 35 LEU QD 3 7 LYS HE2 4.147 2.427 5.867 2.611 2.168 3.153 0.259 6 0 "[ . 1]" 1
3596 2 7 LYS HE2 3 35 LEU QD 4.147 2.427 5.867 3.127 2.810 3.590 . 0 0 "[ . 1]" 1
3597 2 21 ILE HB 2 35 LEU HB3 3.805 2.357 5.253 3.999 3.754 4.262 . 0 0 "[ . 1]" 1
3598 3 21 ILE HB 3 35 LEU HB3 3.805 2.357 5.253 3.735 3.438 3.931 . 0 0 "[ . 1]" 1
3599 2 21 ILE HB 2 27 ILE HB 3.707 2.333 5.081 4.078 3.836 4.334 . 0 0 "[ . 1]" 1
3600 3 21 ILE HB 3 27 ILE HB 3.707 2.333 5.081 3.803 3.412 3.980 . 0 0 "[ . 1]" 1
3601 2 27 ILE HG12 2 31 GLY HA2 4.692 2.490 6.894 3.741 3.531 4.107 . 0 0 "[ . 1]" 1
3602 3 27 ILE HG12 3 31 GLY HA2 4.692 2.490 6.894 3.719 3.518 3.886 . 0 0 "[ . 1]" 1
3603 2 7 LYS HB2 3 21 ILE MD 3.520 2.281 4.759 3.429 2.814 3.895 . 0 0 "[ . 1]" 1
3604 2 21 ILE MD 3 7 LYS QB 3.520 2.281 4.759 2.736 2.213 4.077 0.068 2 0 "[ . 1]" 1
3605 2 42 ILE MD 2 44 GLU H 4.666 2.489 6.843 4.878 4.531 5.106 . 0 0 "[ . 1]" 1
3606 3 42 ILE MD 3 44 GLU H 4.666 2.489 6.843 4.990 4.801 5.196 . 0 0 "[ . 1]" 1
3607 2 37 VAL QG 2 40 ASP HB3 3.772 2.349 5.195 3.240 2.772 3.842 . 0 0 "[ . 1]" 1
3608 3 37 VAL QG 3 40 ASP HB3 3.772 2.349 5.195 3.668 3.108 4.046 . 0 0 "[ . 1]" 1
3609 2 21 ILE MD 2 26 GLU HB2 2.737 . 3.486 2.247 1.963 2.517 0.025 5 0 "[ . 1]" 1
3610 3 21 ILE MD 3 26 GLU QB 2.737 2.184 3.486 2.069 1.855 2.242 0.329 5 0 "[ . 1]" 1
3611 2 7 LYS QD 3 21 ILE MD 3.204 2.177 4.231 3.503 2.995 3.943 . 0 0 "[ . 1]" 1
3612 2 21 ILE MD 3 7 LYS HD3 3.204 2.177 4.231 3.502 3.219 3.992 . 0 0 "[ . 1]" 1
3613 2 36 ASN QB 2 37 VAL HB 4.643 2.487 6.799 3.936 3.754 4.112 . 0 0 "[ . 1]" 1
3614 3 36 ASN QB 3 37 VAL HB 4.643 2.487 6.799 4.044 3.828 4.580 . 0 0 "[ . 1]" 1
3615 2 21 ILE MD 2 26 GLU HB3 3.222 2.184 4.260 3.041 2.821 3.352 . 0 0 "[ . 1]" 1
3616 2 50 ARG HA 2 50 ARG QG 3.859 2.369 5.349 2.550 2.377 2.814 . 0 0 "[ . 1]" 1
3617 3 50 ARG HA 3 50 ARG QG 3.859 2.369 5.349 2.569 2.065 2.916 0.304 9 0 "[ . 1]" 1
3618 2 38 ALA MB 2 42 ILE HA 3.806 2.358 5.254 4.657 4.371 5.049 . 0 0 "[ . 1]" 1
3619 2 42 ILE HA 3 38 ALA MB 3.806 2.358 5.254 4.585 4.467 4.807 . 0 0 "[ . 1]" 1
3620 2 30 ASP HA 2 32 ALA MB 4.124 2.424 5.824 4.569 4.427 4.682 . 0 0 "[ . 1]" 1
3621 3 30 ASP HA 3 32 ALA MB 4.124 2.424 5.824 4.569 4.408 4.736 . 0 0 "[ . 1]" 1
3622 2 9 GLU HA 2 13 LEU MD2 4.109 2.420 5.798 4.235 3.924 4.452 . 0 0 "[ . 1]" 1
3623 3 9 GLU HA 3 13 LEU MD2 4.109 2.420 5.798 3.929 3.617 4.266 . 0 0 "[ . 1]" 1
3624 2 27 ILE MG 2 34 SER H 4.345 2.457 6.233 5.041 4.853 5.214 . 0 0 "[ . 1]" 1
3625 2 46 PHE QD 3 27 ILE MG 4.345 2.457 6.233 4.929 4.783 5.021 . 0 0 "[ . 1]" 1
3626 2 10 ILE MD 2 46 PHE HZ 4.085 2.416 5.754 5.145 4.494 6.010 0.256 9 0 "[ . 1]" 1
3627 2 62 PHE QE 3 10 ILE MD 4.085 2.416 5.754 5.157 4.512 6.009 0.255 9 0 "[ . 1]" 1
3628 2 8 GLU HA 2 48 PHE HZ 3.785 2.352 5.218 3.985 3.763 4.238 . 0 0 "[ . 1]" 1
3629 3 8 GLU HA 3 48 PHE HZ 3.785 2.352 5.218 3.935 3.796 4.094 . 0 0 "[ . 1]" 1
3630 2 11 ALA MB 2 48 PHE HZ 2.801 2.016 3.586 2.510 2.368 2.768 . 0 0 "[ . 1]" 1
3631 3 11 ALA MB 3 48 PHE HZ 2.801 2.016 3.586 2.352 2.130 2.609 . 0 0 "[ . 1]" 1
3632 2 8 GLU HA 2 46 PHE HZ 3.947 2.389 5.505 4.009 3.903 4.125 . 0 0 "[ . 1]" 1
3633 3 8 GLU HA 3 46 PHE HZ 3.947 2.389 5.505 4.003 3.906 4.143 . 0 0 "[ . 1]" 1
3634 2 11 ALA MB 2 46 PHE QD 3.062 2.125 3.999 2.515 2.375 2.712 . 0 0 "[ . 1]" 1
3635 3 11 ALA MB 3 46 PHE QD 3.062 2.125 3.999 2.423 2.273 2.639 . 0 0 "[ . 1]" 1
3636 2 13 LEU MD2 2 17 TYR QD 3.877 2.374 5.380 2.694 2.268 2.861 0.106 10 0 "[ . 1]" 1
3637 2 10 ILE MG 3 17 TYR QD 3.877 2.374 5.380 2.558 2.167 2.873 0.207 6 0 "[ . 1]" 1
3638 2 14 ILE MD 2 17 TYR QD 3.908 2.381 5.435 4.231 2.728 5.182 . 0 0 "[ . 1]" 1
3639 2 14 ILE MD 3 17 TYR QD 3.908 2.381 5.435 4.400 3.534 5.241 . 0 0 "[ . 1]" 1
3640 2 8 GLU HA 2 48 PHE QD 4.749 2.493 7.005 4.944 4.822 5.139 . 0 0 "[ . 1]" 1
3641 3 8 GLU HA 3 48 PHE QD 4.749 2.493 7.005 4.880 4.461 5.382 . 0 0 "[ . 1]" 1
3642 2 48 PHE QD 2 49 GLU QB 5.784 2.439 9.129 4.393 4.125 4.657 . 0 0 "[ . 1]" 1
3643 3 48 PHE QD 3 49 GLU QB 5.784 2.439 9.129 4.375 4.156 4.624 . 0 0 "[ . 1]" 1
3644 2 46 PHE QD 3 21 ILE MD 4.707 2.491 6.923 4.869 4.499 5.345 . 0 0 "[ . 1]" 1
3645 2 21 ILE MD 3 46 PHE QD 4.707 2.491 6.923 4.738 4.276 5.519 . 0 0 "[ . 1]" 1
3646 2 7 LYS QD 2 46 PHE QD 4.425 2.467 6.383 2.978 2.577 3.327 . 0 0 "[ . 1]" 1
3647 3 7 LYS HD2 3 46 PHE QD 4.425 2.467 6.383 3.385 2.780 4.135 . 0 0 "[ . 1]" 1
3648 2 8 GLU HA 2 46 PHE QD 4.680 2.490 6.870 3.572 2.655 3.883 . 0 0 "[ . 1]" 1
3649 3 8 GLU HA 3 46 PHE QD 4.680 2.490 6.870 3.709 2.741 4.108 . 0 0 "[ . 1]" 1
3650 2 7 LYS HB3 2 46 PHE HZ 3.272 2.201 4.343 4.009 3.241 4.566 0.223 4 0 "[ . 1]" 1
3651 3 7 LYS QB 3 46 PHE HZ 3.272 2.201 4.343 3.188 2.258 3.652 . 0 0 "[ . 1]" 1
3652 2 7 LYS QD 2 46 PHE HZ 4.244 2.443 6.045 3.981 3.231 4.871 . 0 0 "[ . 1]" 1
3653 3 7 LYS HD2 3 46 PHE HZ 4.244 2.443 6.045 4.065 3.144 4.603 . 0 0 "[ . 1]" 1
3654 2 7 LYS HG2 2 46 PHE HZ 4.420 2.466 6.374 3.862 3.567 4.511 . 0 0 "[ . 1]" 1
3655 3 7 LYS QG 3 46 PHE HZ 4.420 2.466 6.374 3.584 3.093 3.948 . 0 0 "[ . 1]" 1
3656 2 15 VAL QG 2 48 PHE QE 2.790 2.012 3.568 2.011 1.856 2.197 0.156 9 0 "[ . 1]" 1
3657 3 15 VAL QG 3 48 PHE QE 2.790 2.012 3.568 2.042 1.894 2.187 0.118 8 0 "[ . 1]" 1
3658 2 46 PHE HZ 3 27 ILE MG 3.786 2.353 5.219 3.626 3.092 3.865 . 0 0 "[ . 1]" 1
3659 2 27 ILE MG 3 46 PHE HZ 3.786 2.353 5.219 3.755 3.251 4.188 . 0 0 "[ . 1]" 1
3660 2 46 PHE HZ 3 27 ILE MG 3.722 2.337 5.107 4.403 4.135 4.584 . 0 0 "[ . 1]" 1
3661 2 27 ILE MG 3 46 PHE HZ 3.722 2.337 5.107 4.438 4.259 4.586 . 0 0 "[ . 1]" 1
3662 2 46 PHE HZ 3 27 ILE MD 2.906 2.062 3.750 2.931 2.612 3.156 . 0 0 "[ . 1]" 1
3663 2 27 ILE MD 3 46 PHE HZ 2.906 2.062 3.750 2.921 2.706 3.101 . 0 0 "[ . 1]" 1
3664 2 18 PHE HZ 3 14 ILE MG 2.507 . 3.136 2.835 2.265 3.376 0.240 9 0 "[ . 1]" 1
3665 2 14 ILE MG 3 18 PHE HZ 2.507 . 3.136 2.763 2.398 3.177 0.041 1 0 "[ . 1]" 1
3666 2 8 GLU HG3 2 48 PHE QE 4.573 2.482 6.664 4.362 4.202 4.544 . 0 0 "[ . 1]" 1
3667 3 8 GLU QG 3 48 PHE QE 4.573 2.482 6.664 4.421 4.104 4.824 . 0 0 "[ . 1]" 1
3668 2 7 LYS HE3 2 46 PHE HZ 4.415 2.465 6.365 5.150 4.467 5.653 . 0 0 "[ . 1]" 1
3669 3 7 LYS HE3 3 46 PHE HZ 4.415 2.465 6.365 4.965 4.306 5.588 . 0 0 "[ . 1]" 1
3670 2 10 ILE MD 2 62 PHE QD 3.604 2.305 4.903 4.335 2.883 4.949 0.046 10 0 "[ . 1]" 1
3671 2 10 ILE MD 3 62 PHE QD 3.604 2.305 4.903 4.399 2.844 5.017 0.114 1 0 "[ . 1]" 1
3672 2 10 ILE HG13 2 62 PHE QD 5.000 2.500 7.500 5.818 5.153 6.464 . 0 0 "[ . 1]" 1
3673 3 10 ILE HG13 3 62 PHE QD 5.000 2.500 7.500 5.576 4.472 6.090 . 0 0 "[ . 1]" 1
3674 2 18 PHE QE 3 42 ILE MD 3.906 2.380 5.432 2.709 2.565 2.915 . 0 0 "[ . 1]" 1
3675 2 42 ILE MD 3 18 PHE QE 3.906 2.380 5.432 2.583 2.194 2.777 0.186 2 0 "[ . 1]" 1
3676 2 10 ILE H 2 46 PHE HZ 4.203 2.437 5.969 4.883 4.569 5.011 . 0 0 "[ . 1]" 1
3677 2 11 ALA H 3 18 PHE HZ 4.203 2.437 5.969 4.928 4.624 5.306 . 0 0 "[ . 1]" 1
3678 2 46 PHE QD 2 46 PHE HZ 3.035 2.114 3.956 2.766 2.491 3.222 . 0 0 "[ . 1]" 1
3679 3 46 PHE QD 3 46 PHE HZ 3.035 2.114 3.956 2.705 2.340 3.280 . 0 0 "[ . 1]" 1
3680 2 49 GLU QB 2 50 ARG H 2.936 2.074 3.798 2.835 2.656 3.031 . 0 0 "[ . 1]" 1
3681 3 49 GLU QB 3 50 ARG H 2.936 2.074 3.798 2.957 2.784 3.163 . 0 0 "[ . 1]" 1
3682 2 22 VAL QG 2 32 ALA H 3.956 2.391 5.521 4.106 3.164 4.480 . 0 0 "[ . 1]" 1
3683 3 22 VAL QG 3 32 ALA H 3.956 2.391 5.521 4.169 4.061 4.313 . 0 0 "[ . 1]" 1
3684 2 30 ASP HA 2 32 ALA H 4.409 2.465 6.353 4.218 4.003 4.338 . 0 0 "[ . 1]" 1
3685 3 30 ASP HA 3 32 ALA H 4.409 2.465 6.353 4.227 4.033 4.425 . 0 0 "[ . 1]" 1
3686 2 17 TYR HA 2 21 ILE H 3.839 2.365 5.313 3.329 3.314 3.357 . 0 0 "[ . 1]" 1
3687 3 17 TYR HA 3 21 ILE H 3.839 2.365 5.313 3.327 3.294 3.349 . 0 0 "[ . 1]" 1
3688 2 21 ILE H 2 22 VAL QG 3.918 2.383 5.453 3.357 3.297 3.395 . 0 0 "[ . 1]" 1
3689 3 21 ILE H 3 22 VAL QG 3.918 2.383 5.453 3.394 3.299 3.473 . 0 0 "[ . 1]" 1
3690 2 21 ILE H 2 21 ILE MD 3.424 2.251 4.597 3.226 3.084 3.358 . 0 0 "[ . 1]" 1
3691 3 21 ILE H 3 21 ILE MD 3.424 2.251 4.597 3.239 3.091 3.380 . 0 0 "[ . 1]" 1
3692 2 5 ALA HA 2 6 SER H 2.336 . 2.881 2.186 2.086 2.287 . 0 0 "[ . 1]" 1
3693 3 5 ALA HA 3 6 SER H 2.336 . 2.881 2.228 2.137 2.326 . 0 0 "[ . 1]" 1
3694 2 10 ILE H 2 10 ILE HA 3.001 2.100 3.902 2.711 2.700 2.723 . 0 0 "[ . 1]" 1
3695 3 10 ILE H 3 10 ILE HA 3.001 2.100 3.902 2.708 2.688 2.731 . 0 0 "[ . 1]" 1
3696 2 57 LEU QD 2 58 GLY H 4.410 2.465 6.355 3.768 3.599 3.911 . 0 0 "[ . 1]" 1
3697 3 57 LEU QD 3 58 GLY H 4.410 2.465 6.355 3.791 3.257 3.987 . 0 0 "[ . 1]" 1
3698 2 18 PHE HB2 2 36 ASN H 4.991 2.500 7.482 5.919 5.681 6.038 . 0 0 "[ . 1]" 1
3699 3 18 PHE HB2 3 36 ASN H 4.991 2.500 7.482 5.983 5.790 6.153 . 0 0 "[ . 1]" 1
3700 2 13 LEU MD2 2 17 TYR H 3.802 2.356 5.248 3.971 3.321 4.279 . 0 0 "[ . 1]" 1
3701 2 10 ILE MG 3 17 TYR H 3.802 2.356 5.248 3.935 3.394 4.385 . 0 0 "[ . 1]" 1
3702 2 49 GLU QB 2 52 ALA H 3.229 2.186 4.272 3.046 2.460 3.501 . 0 0 "[ . 1]" 1
3703 3 49 GLU QB 3 52 ALA H 3.229 2.186 4.272 3.188 2.828 3.432 . 0 0 "[ . 1]" 1
3704 2 10 ILE H 2 56 ILE HB 3.173 . 6.000 6.262 6.061 6.421 0.421 10 0 "[ . 1]" 1
3705 3 10 ILE H 3 56 ILE HB 3.173 . 6.000 6.191 5.745 6.331 0.331 5 0 "[ . 1]" 1
3706 2 10 ILE H 2 57 LEU MD2 3.306 2.213 4.399 4.323 4.124 4.483 0.084 6 0 "[ . 1]" 1
3707 2 21 ILE MD 3 11 ALA H 3.306 2.213 4.399 4.312 4.097 4.712 0.313 9 0 "[ . 1]" 1
3708 2 17 TYR HA 2 20 SER H 2.982 2.093 3.871 2.730 2.695 2.762 . 0 0 "[ . 1]" 1
3709 3 17 TYR HA 3 20 SER H 2.982 2.093 3.871 2.721 2.694 2.755 . 0 0 "[ . 1]" 1
3710 2 19 SER HA 2 20 SER H 2.546 . 3.194 3.016 2.534 3.193 . 0 0 "[ . 1]" 1
3711 3 19 SER HA 3 20 SER H 2.546 . 3.194 3.016 2.556 3.191 . 0 0 "[ . 1]" 1
3712 2 22 VAL H 2 22 VAL HB 2.913 2.064 3.762 3.514 3.464 3.569 . 0 0 "[ . 1]" 1
3713 3 22 VAL H 3 22 VAL HB 2.913 2.064 3.762 3.521 3.473 3.589 . 0 0 "[ . 1]" 1
3714 2 40 ASP HB3 2 41 CYS H 2.776 2.006 3.546 2.197 1.953 2.453 0.053 9 0 "[ . 1]" 1
3715 3 40 ASP HB3 3 41 CYS H 2.776 2.006 3.546 2.307 2.083 2.568 . 0 0 "[ . 1]" 1
3716 2 38 ALA MB 2 42 ILE H 3.750 2.344 5.156 3.948 3.799 4.051 . 0 0 "[ . 1]" 1
3717 2 38 ALA MB 3 42 ILE H 3.750 2.344 5.156 3.925 3.788 4.138 . 0 0 "[ . 1]" 1
3718 2 43 SER HA 2 48 PHE H 3.218 2.182 4.254 3.307 3.164 3.465 . 0 0 "[ . 1]" 1
3719 3 43 SER HA 3 48 PHE H 3.218 2.182 4.254 3.213 2.981 3.389 . 0 0 "[ . 1]" 1
3720 2 24 LYS HB3 2 25 LYS H 3.286 2.206 4.366 3.170 3.080 3.256 . 0 0 "[ . 1]" 1
3721 3 24 LYS HB3 3 25 LYS H 3.286 2.206 4.366 3.184 3.006 3.290 . 0 0 "[ . 1]" 1
3722 2 49 GLU QB 2 51 GLU H 2.603 . 3.280 2.398 2.222 2.544 . 0 0 "[ . 1]" 1
3723 3 49 GLU QB 3 51 GLU H 2.603 . 3.280 2.498 2.293 2.818 . 0 0 "[ . 1]" 1
3724 2 50 ARG QG 2 51 GLU H 4.104 2.420 5.788 3.453 2.347 3.766 0.073 9 0 "[ . 1]" 1
3725 3 50 ARG QG 3 51 GLU H 4.104 2.420 5.788 3.310 2.352 3.716 0.068 10 0 "[ . 1]" 1
3726 2 6 SER HB3 2 8 GLU H 3.422 2.251 4.593 3.255 3.025 3.447 . 0 0 "[ . 1]" 1
3727 3 6 SER HB3 3 8 GLU H 3.422 2.251 4.593 3.226 2.845 3.436 . 0 0 "[ . 1]" 1
3728 2 9 GLU H 2 10 ILE MD 3.593 2.302 4.884 3.667 3.488 3.850 . 0 0 "[ . 1]" 1
3729 3 9 GLU H 3 10 ILE MD 3.593 2.302 4.884 3.614 3.370 3.821 . 0 0 "[ . 1]" 1
3730 2 10 ILE H 2 10 ILE MG 3.280 2.204 4.356 3.089 2.964 3.180 . 0 0 "[ . 1]" 1
3731 3 10 ILE H 3 10 ILE MG 3.280 2.204 4.356 3.079 2.948 3.184 . 0 0 "[ . 1]" 1
3732 2 15 VAL H 2 18 PHE HB3 4.824 2.497 7.151 5.129 4.665 5.271 . 0 0 "[ . 1]" 1
3733 3 15 VAL H 3 18 PHE HB3 4.824 2.497 7.151 5.186 4.950 5.469 . 0 0 "[ . 1]" 1
3734 2 15 VAL H 2 41 CYS QB 3.563 . 6.000 6.624 6.495 6.757 0.757 8 9 [****.-*+**] 1
3735 3 15 VAL H 3 41 CYS QB 3.563 . 6.000 6.736 6.375 7.224 1.224 7 8 [-***.*+**1] 1
3736 2 42 ILE H 2 42 ILE MD 3.426 2.252 4.600 3.161 3.055 3.270 . 0 0 "[ . 1]" 1
3737 3 42 ILE H 3 42 ILE MD 3.426 2.252 4.600 2.929 2.071 3.193 0.181 2 0 "[ . 1]" 1
3738 2 14 ILE MG 2 16 ASN H 3.278 2.204 4.352 3.697 3.579 3.829 . 0 0 "[ . 1]" 1
3739 3 14 ILE MG 3 16 ASN H 3.278 2.204 4.352 3.673 3.409 3.840 . 0 0 "[ . 1]" 1
3740 2 14 ILE MD 2 17 TYR H 4.018 2.404 5.632 5.102 4.669 5.660 0.028 9 0 "[ . 1]" 1
3741 2 14 ILE MD 3 17 TYR H 4.018 2.404 5.632 4.997 4.507 5.473 . 0 0 "[ . 1]" 1
3742 2 15 VAL QG 2 18 PHE H 4.085 2.416 5.754 3.980 3.796 4.206 . 0 0 "[ . 1]" 1
3743 3 15 VAL QG 3 18 PHE H 4.085 2.416 5.754 3.986 3.861 4.087 . 0 0 "[ . 1]" 1
3744 2 14 ILE MD 2 18 PHE H 4.191 2.434 5.948 5.201 4.571 5.989 0.041 9 0 "[ . 1]" 1
3745 2 14 ILE MD 3 18 PHE H 4.191 2.434 5.948 5.091 4.797 5.704 . 0 0 "[ . 1]" 1
3746 2 19 SER H 2 19 SER HA 2.619 . 3.305 2.371 2.273 2.433 . 0 0 "[ . 1]" 1
3747 3 19 SER H 3 19 SER HA 2.619 . 3.305 2.386 2.298 2.488 . 0 0 "[ . 1]" 1
3748 2 15 VAL QG 2 19 SER H 4.167 2.430 5.904 4.189 4.078 4.284 . 0 0 "[ . 1]" 1
3749 3 15 VAL QG 3 19 SER H 4.167 2.430 5.904 4.234 4.145 4.330 . 0 0 "[ . 1]" 1
3750 2 19 SER H 2 22 VAL QG 4.546 2.479 6.613 4.018 3.840 4.165 . 0 0 "[ . 1]" 1
3751 3 19 SER H 3 22 VAL QG 4.546 2.479 6.613 4.034 3.882 4.214 . 0 0 "[ . 1]" 1
3752 2 14 ILE MG 2 19 SER H 4.179 2.433 5.925 5.331 5.147 5.483 . 0 0 "[ . 1]" 1
3753 3 14 ILE MG 3 19 SER H 4.179 2.433 5.925 5.419 5.283 5.567 . 0 0 "[ . 1]" 1
3754 2 20 SER H 2 21 ILE HB 4.316 2.453 6.179 4.381 4.238 4.553 . 0 0 "[ . 1]" 1
3755 3 20 SER H 3 21 ILE HB 4.316 2.453 6.179 4.458 4.218 4.602 . 0 0 "[ . 1]" 1
3756 2 19 SER HA 2 22 VAL H 3.477 2.268 4.686 3.528 3.467 3.620 . 0 0 "[ . 1]" 1
3757 3 19 SER HA 3 22 VAL H 3.477 2.268 4.686 3.524 3.392 3.689 . 0 0 "[ . 1]" 1
3758 2 23 GLU H 2 23 GLU QG 3.357 2.230 4.484 3.990 3.902 4.097 . 0 0 "[ . 1]" 1
3759 3 23 GLU H 3 23 GLU QG 3.357 2.230 4.484 3.980 3.809 4.076 . 0 0 "[ . 1]" 1
3760 2 23 GLU H 2 24 LYS HG3 3.846 2.367 5.325 4.778 4.518 5.328 0.003 4 0 "[ . 1]" 1
3761 3 23 GLU H 3 24 LYS QG 3.846 2.367 5.325 4.590 4.033 5.387 0.062 7 0 "[ . 1]" 1
3762 2 21 ILE MD 2 23 GLU H 4.007 2.402 5.612 4.539 4.389 4.670 . 0 0 "[ . 1]" 1
3763 3 21 ILE MD 3 23 GLU H 4.007 2.402 5.612 4.458 4.273 4.619 . 0 0 "[ . 1]" 1
3764 2 23 GLU HB3 2 24 LYS H 2.863 2.043 3.683 2.562 2.270 3.013 . 0 0 "[ . 1]" 1
3765 3 23 GLU HB3 3 24 LYS H 2.863 2.043 3.683 2.381 2.210 2.672 . 0 0 "[ . 1]" 1
3766 2 21 ILE MD 2 24 LYS H 4.166 2.430 5.902 4.425 4.357 4.536 . 0 0 "[ . 1]" 1
3767 3 21 ILE MD 3 24 LYS H 4.166 2.430 5.902 4.490 4.261 4.660 . 0 0 "[ . 1]" 1
3768 2 22 VAL QG 2 25 LYS H 4.027 2.406 5.648 4.341 4.189 4.432 . 0 0 "[ . 1]" 1
3769 3 22 VAL QG 3 25 LYS H 4.027 2.406 5.648 4.387 4.308 4.504 . 0 0 "[ . 1]" 1
3770 2 24 LYS HG3 2 26 GLU H 4.238 2.442 6.034 4.664 4.492 4.867 . 0 0 "[ . 1]" 1
3771 3 24 LYS QG 3 26 GLU H 4.238 2.442 6.034 4.507 4.376 4.643 . 0 0 "[ . 1]" 1
3772 2 22 VAL QG 2 27 ILE H 3.657 2.319 4.995 4.382 4.151 4.581 . 0 0 "[ . 1]" 1
3773 3 22 VAL QG 3 27 ILE H 3.657 2.319 4.995 4.274 4.160 4.392 . 0 0 "[ . 1]" 1
3774 2 26 GLU HB3 2 27 ILE H 3.779 2.351 5.207 3.935 3.860 3.981 . 0 0 "[ . 1]" 1
3775 3 26 GLU QB 3 27 ILE H 3.779 2.351 5.207 3.290 3.010 3.436 . 0 0 "[ . 1]" 1
3776 2 27 ILE H 2 27 ILE HG12 3.479 2.269 4.689 4.170 4.095 4.258 . 0 0 "[ . 1]" 1
3777 3 27 ILE H 3 27 ILE HG12 3.479 2.269 4.689 4.045 3.940 4.125 . 0 0 "[ . 1]" 1
3778 2 21 ILE HA 2 27 ILE H 4.179 2.433 5.925 5.465 5.297 5.726 . 0 0 "[ . 1]" 1
3779 3 21 ILE HA 3 27 ILE H 4.179 2.433 5.925 5.018 4.738 5.322 . 0 0 "[ . 1]" 1
3780 2 27 ILE HG12 2 29 GLU H 4.126 2.423 5.829 4.364 4.208 4.683 . 0 0 "[ . 1]" 1
3781 3 27 ILE HG12 3 29 GLU H 4.126 2.423 5.829 4.318 4.114 4.512 . 0 0 "[ . 1]" 1
3782 2 28 SER HA 2 29 GLU H 2.078 . 2.510 2.247 2.193 2.310 . 0 0 "[ . 1]" 1
3783 3 28 SER HA 3 29 GLU H 2.078 . 2.510 2.291 2.194 2.376 . 0 0 "[ . 1]" 1
3784 2 28 SER H 2 29 GLU H 3.875 2.373 5.377 3.891 3.689 3.999 . 0 0 "[ . 1]" 1
3785 3 28 SER H 3 29 GLU H 3.875 2.373 5.377 3.955 3.794 4.081 . 0 0 "[ . 1]" 1
3786 2 49 GLU H 2 49 GLU QB 2.789 2.011 3.567 2.312 2.074 2.517 . 0 0 "[ . 1]" 1
3787 3 49 GLU H 3 49 GLU QB 2.789 2.011 3.567 2.355 2.108 2.531 . 0 0 "[ . 1]" 1
3788 2 27 ILE HG13 2 31 GLY H 5.113 2.499 7.727 4.228 3.352 4.790 . 0 0 "[ . 1]" 1
3789 2 45 ALA MB 3 31 GLY H 5.113 2.499 7.727 4.186 3.752 4.726 . 0 0 "[ . 1]" 1
3790 2 35 LEU HA 2 39 MET H 3.567 2.295 4.839 3.256 3.197 3.290 . 0 0 "[ . 1]" 1
3791 3 35 LEU HA 3 39 MET H 3.567 2.295 4.839 3.265 3.238 3.307 . 0 0 "[ . 1]" 1
3792 2 46 PHE H 2 46 PHE QD 2.773 2.004 3.542 2.248 2.171 2.384 . 0 0 "[ . 1]" 1
3793 3 46 PHE H 3 46 PHE QD 2.773 2.004 3.542 2.233 2.075 2.300 . 0 0 "[ . 1]" 1
3794 2 8 GLU HA 2 46 PHE H 4.234 2.441 6.027 4.973 4.822 5.123 . 0 0 "[ . 1]" 1
3795 3 8 GLU HA 3 46 PHE H 4.234 2.441 6.027 5.006 4.893 5.141 . 0 0 "[ . 1]" 1
3796 2 48 PHE QR 2 52 ALA H 4.121 2.422 5.820 3.932 3.695 4.244 . 0 0 "[ . 1]" 1
3797 3 48 PHE QR 3 52 ALA H 4.121 2.422 5.820 3.852 3.537 4.379 . 0 0 "[ . 1]" 1
3798 2 50 ARG HA 2 53 VAL H 3.870 2.372 5.368 4.410 3.913 5.018 . 0 0 "[ . 1]" 1
3799 3 50 ARG HA 3 53 VAL H 3.870 2.372 5.368 4.355 3.673 5.441 0.073 9 0 "[ . 1]" 1
3800 2 55 GLY H 2 56 ILE HB 4.614 2.485 6.743 4.609 4.447 4.748 . 0 0 "[ . 1]" 1
3801 3 55 GLY H 3 56 ILE HB 4.614 2.485 6.743 4.484 4.355 4.584 . 0 0 "[ . 1]" 1
3802 2 55 GLY H 2 56 ILE H 2.321 . 2.860 2.235 2.157 2.334 . 0 0 "[ . 1]" 1
3803 3 55 GLY H 3 56 ILE H 2.321 . 2.860 2.272 2.178 2.352 . 0 0 "[ . 1]" 1
3804 2 56 ILE H 2 57 LEU QD 4.138 2.426 5.850 4.613 4.431 4.807 . 0 0 "[ . 1]" 1
3805 3 56 ILE H 3 57 LEU QD 4.138 2.426 5.850 4.750 4.498 5.324 . 0 0 "[ . 1]" 1
3806 2 15 VAL QG 2 57 LEU H 4.512 2.476 6.548 4.377 4.238 4.645 . 0 0 "[ . 1]" 1
3807 3 15 VAL QG 3 57 LEU H 4.512 2.476 6.548 4.341 4.179 4.931 . 0 0 "[ . 1]" 1
3808 2 22 VAL QG 2 33 ASP H 4.181 2.433 5.929 4.370 4.261 4.434 . 0 0 "[ . 1]" 1
3809 2 45 ALA MB 3 33 ASP H 4.181 2.433 5.929 4.348 4.244 4.496 . 0 0 "[ . 1]" 1
3810 2 30 ASP HA 2 33 ASP H 2.901 2.060 3.742 2.725 2.614 2.762 . 0 0 "[ . 1]" 1
3811 3 30 ASP HA 3 33 ASP H 2.901 2.060 3.742 2.735 2.676 2.777 . 0 0 "[ . 1]" 1
3812 2 40 ASP H 2 42 ILE MD 4.122 2.423 5.821 5.014 4.829 5.312 . 0 0 "[ . 1]" 1
3813 3 40 ASP H 3 42 ILE MD 4.122 2.423 5.821 5.140 4.850 5.398 . 0 0 "[ . 1]" 1
3814 2 37 VAL QG 2 40 ASP H 4.325 2.455 6.195 4.216 4.077 4.407 . 0 0 "[ . 1]" 1
3815 2 37 VAL QG 3 40 ASP H 4.325 2.455 6.195 4.401 4.118 4.661 . 0 0 "[ . 1]" 1
3816 2 39 MET QB 2 40 ASP H 3.324 2.219 4.429 2.104 1.951 2.199 0.268 2 0 "[ . 1]" 1
3817 3 39 MET QB 3 40 ASP H 3.324 2.219 4.429 2.063 1.945 2.243 0.274 5 0 "[ . 1]" 1
3818 2 15 VAL HB 2 40 ASP H 4.379 2.462 6.296 5.444 5.273 5.582 . 0 0 "[ . 1]" 1
3819 3 15 VAL HB 3 40 ASP H 4.379 2.462 6.296 5.555 5.400 5.682 . 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 12
_Distance_constraint_stats_list.Viol_count 43
_Distance_constraint_stats_list.Viol_total 266.268
_Distance_constraint_stats_list.Viol_max 2.606
_Distance_constraint_stats_list.Viol_rms 0.6058
_Distance_constraint_stats_list.Viol_average_all_restraints 0.2219
_Distance_constraint_stats_list.Viol_average_violations_only 0.6192
_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 7 LYS 21.688 2.606 8 10 [***-***+**]
1 9 ILE 0.684 0.145 10 0 "[ . 1]"
1 48 LEU 1.028 0.176 8 0 "[ . 1]"
1 51 GLY 0.000 0.000 . 0 "[ . 1]"
1 52 LYS 2.968 0.394 1 0 "[ . 1]"
1 73 THR 0.000 0.000 . 0 "[ . 1]"
1 75 MET 0.260 0.126 2 0 "[ . 1]"
2 33 ASP 3.176 0.394 1 0 "[ . 1]"
2 37 VAL 22.766 2.606 8 10 [***-***+**]
2 38 ALA 0.684 0.145 10 0 "[ . 1]"
2 40 ASP 3.176 0.394 1 0 "[ . 1]"
2 41 CYS 0.684 0.145 10 0 "[ . 1]"
3 33 ASP 3.176 0.394 1 0 "[ . 1]"
3 37 VAL 22.766 2.606 8 10 [***-***+**]
3 38 ALA 0.684 0.145 10 0 "[ . 1]"
3 40 ASP 3.176 0.394 1 0 "[ . 1]"
3 41 CYS 0.684 0.145 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 75 MET ME 2 38 ALA H 6.000 . 6.000 4.060 3.815 4.522 . 0 0 "[ . 1]" 2
2 1 75 MET ME 2 37 VAL H 6.000 . 6.000 5.333 4.868 6.051 0.051 5 0 "[ . 1]" 2
3 1 75 MET ME 2 33 ASP H 6.000 . 6.000 5.942 5.699 6.126 0.126 2 0 "[ . 1]" 2
4 1 48 LEU QD 2 33 ASP H 6.000 . 6.000 5.393 5.159 5.525 . 0 0 "[ . 1]" 2
5 1 48 LEU QD 2 37 VAL H 6.000 . 6.000 4.577 4.307 5.049 . 0 0 "[ . 1]" 2
6 1 48 LEU HG 2 37 VAL H 6.000 . 6.000 6.103 6.038 6.176 0.176 8 0 "[ . 1]" 2
7 1 9 ILE MG 2 38 ALA H 6.000 . 6.000 6.067 5.988 6.145 0.145 10 0 "[ . 1]" 2
8 1 7 LYS HE2 2 37 VAL H 6.000 . 6.000 8.169 7.453 8.606 2.606 8 10 [***-***+**] 2
9 1 52 LYS H 2 33 ASP H 6.000 . 6.000 6.297 6.222 6.394 0.394 1 0 "[ . 1]" 2
10 1 51 GLY H 2 33 ASP H 6.000 . 6.000 5.095 4.845 5.309 . 0 0 "[ . 1]" 2
11 1 73 THR MG 2 37 VAL H 6.000 . 6.000 4.664 4.329 5.359 . 0 0 "[ . 1]" 2
12 1 73 THR MG 2 38 ALA H 6.000 . 6.000 5.228 4.980 5.460 . 0 0 "[ . 1]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 150
_Distance_constraint_stats_list.Viol_count 302
_Distance_constraint_stats_list.Viol_total 250.524
_Distance_constraint_stats_list.Viol_max 0.898
_Distance_constraint_stats_list.Viol_rms 0.0719
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0167
_Distance_constraint_stats_list.Viol_average_violations_only 0.0830
_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 4 LEU 0.141 0.042 3 0 "[ . 1]"
1 5 THR 1.776 0.140 9 0 "[ . 1]"
1 6 LEU 0.412 0.069 2 0 "[ . 1]"
1 7 LYS 0.672 0.086 3 0 "[ . 1]"
1 8 LYS 1.244 0.132 4 0 "[ . 1]"
1 14 PHE 1.244 0.132 4 0 "[ . 1]"
1 16 ILE 0.412 0.069 2 0 "[ . 1]"
1 18 HIS 0.141 0.042 3 0 "[ . 1]"
1 24 ASP 0.065 0.055 1 0 "[ . 1]"
1 26 ILE 0.000 0.000 . 0 "[ . 1]"
1 27 LEU 0.071 0.071 2 0 "[ . 1]"
1 28 GLN 0.022 0.016 9 0 "[ . 1]"
1 29 ILE 0.000 0.000 . 0 "[ . 1]"
1 30 LYS 0.316 0.077 4 0 "[ . 1]"
1 31 GLN 0.071 0.071 2 0 "[ . 1]"
1 32 HIS 0.022 0.016 9 0 "[ . 1]"
1 33 LEU 0.000 0.000 . 0 "[ . 1]"
1 34 ILE 0.316 0.077 4 0 "[ . 1]"
1 35 SER 0.000 0.000 . 0 "[ . 1]"
1 44 GLU 8.390 0.898 10 6 "[ ***. - *+]"
1 46 LYS 0.539 0.068 3 0 "[ . 1]"
1 47 LEU 0.144 0.076 3 0 "[ . 1]"
1 48 LEU 0.384 0.090 1 0 "[ . 1]"
1 49 LEU 0.356 0.059 10 0 "[ . 1]"
1 52 LYS 0.356 0.059 10 0 "[ . 1]"
1 54 LEU 0.144 0.076 3 0 "[ . 1]"
1 58 LEU 0.000 0.000 . 0 "[ . 1]"
1 60 LEU 0.065 0.055 1 0 "[ . 1]"
1 70 SER 0.373 0.112 2 0 "[ . 1]"
1 72 ILE 1.605 0.140 9 0 "[ . 1]"
1 73 THR 0.384 0.090 1 0 "[ . 1]"
1 74 VAL 0.470 0.086 3 0 "[ . 1]"
1 75 MET 0.539 0.068 3 0 "[ . 1]"
1 77 LYS 8.390 0.898 10 6 "[ ***. - *+]"
2 7 LYS 0.079 0.048 10 0 "[ . 1]"
2 8 GLU 0.022 0.022 3 0 "[ . 1]"
2 9 GLU 0.000 0.000 . 0 "[ . 1]"
2 10 ILE 0.031 0.031 4 0 "[ . 1]"
2 11 ALA 0.093 0.048 10 0 "[ . 1]"
2 12 ALA 0.087 0.023 7 0 "[ . 1]"
2 13 LEU 0.029 0.025 1 0 "[ . 1]"
2 14 ILE 0.091 0.031 4 0 "[ . 1]"
2 15 VAL 0.098 0.042 8 0 "[ . 1]"
2 16 ASN 0.235 0.060 7 0 "[ . 1]"
2 17 TYR 0.116 0.050 10 0 "[ . 1]"
2 18 PHE 0.060 0.023 3 0 "[ . 1]"
2 19 SER 0.084 0.042 8 0 "[ . 1]"
2 20 SER 0.171 0.060 7 0 "[ . 1]"
2 21 ILE 0.087 0.050 10 0 "[ . 1]"
2 29 GLU 0.046 0.046 5 0 "[ . 1]"
2 30 ASP 0.199 0.067 10 0 "[ . 1]"
2 31 GLY 0.000 0.000 . 0 "[ . 1]"
2 32 ALA 0.033 0.023 7 0 "[ . 1]"
2 33 ASP 0.046 0.046 5 0 "[ . 1]"
2 34 SER 0.199 0.067 10 0 "[ . 1]"
2 35 LEU 0.103 0.041 8 0 "[ . 1]"
2 36 ASN 1.852 0.462 4 0 "[ . 1]"
2 37 VAL 0.042 0.037 4 0 "[ . 1]"
2 38 ALA 0.041 0.028 1 0 "[ . 1]"
2 39 MET 0.125 0.041 8 0 "[ . 1]"
2 40 ASP 1.858 0.462 4 0 "[ . 1]"
2 41 CYS 0.046 0.037 4 0 "[ . 1]"
2 42 ILE 0.041 0.028 1 0 "[ . 1]"
2 43 SER 0.022 0.021 6 0 "[ . 1]"
2 44 GLU 0.039 0.024 3 0 "[ . 1]"
2 45 ALA 0.005 0.005 8 0 "[ . 1]"
2 46 PHE 0.000 0.000 . 0 "[ . 1]"
3 7 LYS 0.093 0.049 5 0 "[ . 1]"
3 8 GLU 0.001 0.001 6 0 "[ . 1]"
3 9 GLU 0.008 0.006 6 0 "[ . 1]"
3 10 ILE 0.000 0.000 . 0 "[ . 1]"
3 11 ALA 0.107 0.049 5 0 "[ . 1]"
3 12 ALA 0.039 0.025 3 0 "[ . 1]"
3 13 LEU 0.008 0.006 6 0 "[ . 1]"
3 14 ILE 0.010 0.010 6 0 "[ . 1]"
3 15 VAL 0.302 0.063 2 0 "[ . 1]"
3 16 ASN 0.264 0.071 10 0 "[ . 1]"
3 17 TYR 0.000 0.000 . 0 "[ . 1]"
3 18 PHE 0.010 0.010 6 0 "[ . 1]"
3 19 SER 0.288 0.063 2 0 "[ . 1]"
3 20 SER 0.226 0.071 10 0 "[ . 1]"
3 21 ILE 0.000 0.000 . 0 "[ . 1]"
3 29 GLU 0.093 0.036 5 0 "[ . 1]"
3 30 ASP 0.109 0.052 3 0 "[ . 1]"
3 31 GLY 0.000 0.000 . 0 "[ . 1]"
3 32 ALA 0.028 0.028 4 0 "[ . 1]"
3 33 ASP 0.093 0.036 5 0 "[ . 1]"
3 34 SER 0.109 0.052 3 0 "[ . 1]"
3 35 LEU 0.036 0.018 4 0 "[ . 1]"
3 36 ASN 6.154 0.467 8 0 "[ . 1]"
3 37 VAL 0.261 0.064 10 0 "[ . 1]"
3 38 ALA 0.031 0.023 7 0 "[ . 1]"
3 39 MET 0.036 0.018 4 0 "[ . 1]"
3 40 ASP 6.276 0.467 8 0 "[ . 1]"
3 41 CYS 0.281 0.064 10 0 "[ . 1]"
3 42 ILE 0.031 0.023 7 0 "[ . 1]"
3 43 SER 0.000 0.000 . 0 "[ . 1]"
3 44 GLU 0.150 0.035 4 0 "[ . 1]"
3 45 ALA 0.020 0.020 2 0 "[ . 1]"
3 46 PHE 0.000 0.000 . 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 4 LEU H 1 18 HIS O 2.000 . 2.300 1.866 1.783 1.982 0.017 7 0 "[ . 1]" 3
2 1 4 LEU N 1 18 HIS O 3.000 2.800 3.300 2.832 2.758 2.929 0.042 3 0 "[ . 1]" 3
3 1 4 LEU O 1 18 HIS H 2.000 . 2.300 2.111 2.034 2.314 0.014 3 0 "[ . 1]" 3
4 1 4 LEU O 1 18 HIS N 3.000 2.800 3.300 3.074 3.012 3.274 . 0 0 "[ . 1]" 3
5 1 6 LEU H 1 16 ILE O 2.000 . 2.300 1.874 1.851 1.907 . 0 0 "[ . 1]" 3
6 1 6 LEU N 1 16 ILE O 3.000 2.800 3.300 2.762 2.731 2.797 0.069 2 0 "[ . 1]" 3
7 1 6 LEU O 1 16 ILE H 2.000 . 2.300 2.152 1.986 2.327 0.027 6 0 "[ . 1]" 3
8 1 6 LEU O 1 16 ILE N 3.000 2.800 3.300 3.016 2.900 3.158 . 0 0 "[ . 1]" 3
9 1 8 LYS O 1 14 PHE H 2.000 . 2.300 2.391 2.313 2.432 0.132 4 0 "[ . 1]" 3
10 1 8 LYS O 1 14 PHE N 3.000 2.800 3.300 3.314 3.259 3.364 0.064 4 0 "[ . 1]" 3
11 1 8 LYS H 1 14 PHE O 2.000 . 2.300 1.885 1.816 1.967 . 0 0 "[ . 1]" 3
12 1 8 LYS N 1 14 PHE O 3.000 2.800 3.300 2.817 2.751 2.897 0.049 10 0 "[ . 1]" 3
13 1 7 LYS H 1 72 ILE O 2.000 . 2.300 1.824 1.769 1.880 0.031 1 0 "[ . 1]" 3
14 1 7 LYS N 1 72 ILE O 3.000 2.800 3.300 2.795 2.747 2.843 0.053 1 0 "[ . 1]" 3
15 1 5 THR H 1 70 SER O 2.000 . 2.300 1.942 1.733 2.412 0.112 2 0 "[ . 1]" 3
16 1 5 THR N 1 70 SER O 3.000 2.800 3.300 2.860 2.707 3.210 0.093 8 0 "[ . 1]" 3
17 1 5 THR O 1 72 ILE H 2.000 . 2.300 1.767 1.676 2.064 0.124 9 0 "[ . 1]" 3
18 1 5 THR O 1 72 ILE N 3.000 2.800 3.300 2.732 2.660 2.931 0.140 9 0 "[ . 1]" 3
19 1 7 LYS O 1 74 VAL H 2.000 . 2.300 1.798 1.764 1.824 0.036 6 0 "[ . 1]" 3
20 1 7 LYS O 1 74 VAL N 3.000 2.800 3.300 2.764 2.714 2.792 0.086 3 0 "[ . 1]" 3
21 1 26 ILE O 1 30 LYS H 2.000 . 2.300 2.019 1.844 2.244 . 0 0 "[ . 1]" 3
22 1 26 ILE O 1 30 LYS N 3.000 2.800 3.300 2.991 2.820 3.193 . 0 0 "[ . 1]" 3
23 1 27 LEU O 1 31 GLN H 2.000 . 2.300 2.048 1.917 2.371 0.071 2 0 "[ . 1]" 3
24 1 27 LEU O 1 31 GLN N 3.000 2.800 3.300 2.990 2.857 3.287 . 0 0 "[ . 1]" 3
25 1 28 GLN O 1 32 HIS H 2.000 . 2.300 2.161 1.997 2.316 0.016 9 0 "[ . 1]" 3
26 1 28 GLN O 1 32 HIS N 3.000 2.800 3.300 3.027 2.795 3.224 0.005 5 0 "[ . 1]" 3
27 1 29 ILE O 1 33 LEU H 2.000 . 2.300 2.096 1.908 2.226 . 0 0 "[ . 1]" 3
28 1 29 ILE O 1 33 LEU N 3.000 2.800 3.300 2.989 2.855 3.103 . 0 0 "[ . 1]" 3
29 1 30 LYS O 1 34 ILE H 2.000 . 2.300 2.316 2.219 2.377 0.077 4 0 "[ . 1]" 3
30 1 30 LYS O 1 34 ILE N 3.000 2.800 3.300 3.242 3.138 3.306 0.006 4 0 "[ . 1]" 3
31 1 31 GLN O 1 35 SER H 2.000 . 2.300 2.056 1.935 2.232 . 0 0 "[ . 1]" 3
32 1 31 GLN O 1 35 SER N 3.000 2.800 3.300 2.963 2.858 3.078 . 0 0 "[ . 1]" 3
33 1 44 GLU O 1 77 LYS H 2.000 . 2.300 2.831 2.367 3.198 0.898 10 6 "[ ***. * -+]" 3
34 1 44 GLU O 1 77 LYS N 3.000 2.800 3.300 3.600 3.216 3.963 0.663 10 3 "[ * . - +]" 3
35 1 46 LYS H 1 75 MET O 2.000 . 2.300 1.828 1.753 2.007 0.047 3 0 "[ . 1]" 3
36 1 46 LYS N 1 75 MET O 3.000 2.800 3.300 2.806 2.732 2.979 0.068 3 0 "[ . 1]" 3
37 1 46 LYS O 1 75 MET H 2.000 . 2.300 2.271 2.139 2.358 0.058 2 0 "[ . 1]" 3
38 1 46 LYS O 1 75 MET N 3.000 2.800 3.300 3.048 2.952 3.143 . 0 0 "[ . 1]" 3
39 1 48 LEU H 1 73 THR O 2.000 . 2.300 1.899 1.793 2.120 0.007 2 0 "[ . 1]" 3
40 1 48 LEU N 1 73 THR O 3.000 2.800 3.300 2.859 2.759 3.072 0.041 6 0 "[ . 1]" 3
41 1 48 LEU O 1 73 THR H 2.000 . 2.300 1.928 1.764 2.081 0.036 1 0 "[ . 1]" 3
42 1 48 LEU O 1 73 THR N 3.000 2.800 3.300 2.796 2.710 2.911 0.090 1 0 "[ . 1]" 3
43 1 49 LEU H 1 52 LYS O 2.000 . 2.300 1.866 1.789 2.250 0.011 7 0 "[ . 1]" 3
44 1 49 LEU N 1 52 LYS O 3.000 2.800 3.300 2.767 2.741 2.806 0.059 10 0 "[ . 1]" 3
45 1 47 LEU O 1 54 LEU H 2.000 . 2.300 2.211 1.868 2.376 0.076 3 0 "[ . 1]" 3
46 1 47 LEU O 1 54 LEU N 3.000 2.800 3.300 3.088 2.829 3.253 . 0 0 "[ . 1]" 3
47 1 26 ILE H 1 58 LEU O 2.000 . 2.300 2.134 2.018 2.290 . 0 0 "[ . 1]" 3
48 1 26 ILE N 1 58 LEU O 3.000 2.800 3.300 3.070 2.950 3.229 . 0 0 "[ . 1]" 3
49 1 24 ASP O 1 60 LEU H 2.000 . 2.300 2.145 1.944 2.355 0.055 1 0 "[ . 1]" 3
50 1 24 ASP O 1 60 LEU N 3.000 2.800 3.300 3.095 2.919 3.271 . 0 0 "[ . 1]" 3
51 2 7 LYS O 2 11 ALA H 2.000 . 2.300 1.892 1.789 2.078 0.011 10 0 "[ . 1]" 3
52 2 7 LYS O 2 11 ALA N 3.000 2.800 3.300 2.851 2.752 3.033 0.048 10 0 "[ . 1]" 3
53 2 8 GLU O 2 12 ALA H 2.000 . 2.300 1.994 1.874 2.105 . 0 0 "[ . 1]" 3
54 2 8 GLU O 2 12 ALA N 3.000 2.800 3.300 2.924 2.778 3.024 0.022 3 0 "[ . 1]" 3
55 2 9 GLU O 2 13 LEU H 2.000 . 2.300 2.114 1.934 2.270 . 0 0 "[ . 1]" 3
56 2 9 GLU O 2 13 LEU N 3.000 2.800 3.300 2.964 2.830 3.099 . 0 0 "[ . 1]" 3
57 2 10 ILE O 2 14 ILE H 2.000 . 2.300 2.041 1.917 2.331 0.031 4 0 "[ . 1]" 3
58 2 10 ILE O 2 14 ILE N 3.000 2.800 3.300 2.917 2.817 3.188 . 0 0 "[ . 1]" 3
59 2 11 ALA O 2 15 VAL H 2.000 . 2.300 2.215 2.091 2.314 0.014 4 0 "[ . 1]" 3
60 2 11 ALA O 2 15 VAL N 3.000 2.800 3.300 3.179 3.066 3.273 . 0 0 "[ . 1]" 3
61 2 12 ALA O 2 16 ASN H 2.000 . 2.300 2.223 2.065 2.323 0.023 7 0 "[ . 1]" 3
62 2 12 ALA O 2 16 ASN N 3.000 2.800 3.300 3.079 2.936 3.185 . 0 0 "[ . 1]" 3
63 2 13 LEU O 2 17 TYR H 2.000 . 2.300 1.898 1.826 1.969 . 0 0 "[ . 1]" 3
64 2 13 LEU O 2 17 TYR N 3.000 2.800 3.300 2.845 2.775 2.931 0.025 1 0 "[ . 1]" 3
65 2 14 ILE O 2 18 PHE H 2.000 . 2.300 1.926 1.798 2.143 0.002 6 0 "[ . 1]" 3
66 2 14 ILE O 2 18 PHE N 3.000 2.800 3.300 2.892 2.777 3.093 0.023 3 0 "[ . 1]" 3
67 2 15 VAL O 2 19 SER H 2.000 . 2.300 2.222 2.060 2.342 0.042 8 0 "[ . 1]" 3
68 2 15 VAL O 2 19 SER N 3.000 2.800 3.300 3.171 3.020 3.294 . 0 0 "[ . 1]" 3
69 2 16 ASN O 2 20 SER H 2.000 . 2.300 2.279 2.165 2.360 0.060 7 0 "[ . 1]" 3
70 2 16 ASN O 2 20 SER N 3.000 2.800 3.300 3.196 3.084 3.299 . 0 0 "[ . 1]" 3
71 2 17 TYR O 2 21 ILE H 2.000 . 2.300 2.256 2.142 2.350 0.050 10 0 "[ . 1]" 3
72 2 17 TYR O 2 21 ILE N 3.000 2.800 3.300 2.921 2.803 3.039 . 0 0 "[ . 1]" 3
73 2 29 GLU O 2 33 ASP H 2.000 . 2.300 2.062 1.854 2.346 0.046 5 0 "[ . 1]" 3
74 2 29 GLU O 2 33 ASP N 3.000 2.800 3.300 2.970 2.820 3.219 . 0 0 "[ . 1]" 3
75 2 30 ASP O 2 34 SER H 2.000 . 2.300 2.185 1.872 2.367 0.067 10 0 "[ . 1]" 3
76 2 30 ASP O 2 34 SER N 3.000 2.800 3.300 3.082 2.799 3.281 0.001 1 0 "[ . 1]" 3
77 2 31 GLY O 2 35 LEU H 2.000 . 2.300 2.010 1.866 2.221 . 0 0 "[ . 1]" 3
78 2 31 GLY O 2 35 LEU N 3.000 2.800 3.300 2.924 2.809 3.137 . 0 0 "[ . 1]" 3
79 2 32 ALA O 2 36 ASN H 2.000 . 2.300 1.996 1.845 2.178 . 0 0 "[ . 1]" 3
80 2 32 ALA O 2 36 ASN N 3.000 2.800 3.300 2.874 2.777 3.001 0.023 7 0 "[ . 1]" 3
81 2 33 ASP O 2 37 VAL H 2.000 . 2.300 2.048 1.939 2.217 . 0 0 "[ . 1]" 3
82 2 33 ASP O 2 37 VAL N 3.000 2.800 3.300 3.012 2.898 3.174 . 0 0 "[ . 1]" 3
83 2 34 SER O 2 38 ALA H 2.000 . 2.300 2.081 1.919 2.228 . 0 0 "[ . 1]" 3
84 2 34 SER O 2 38 ALA N 3.000 2.800 3.300 2.979 2.834 3.124 . 0 0 "[ . 1]" 3
85 2 35 LEU O 2 39 MET H 2.000 . 2.300 1.923 1.863 2.006 . 0 0 "[ . 1]" 3
86 2 35 LEU O 2 39 MET N 3.000 2.800 3.300 2.810 2.759 2.862 0.041 8 0 "[ . 1]" 3
87 2 36 ASN O 2 40 ASP H 2.000 . 2.300 2.375 2.074 2.762 0.462 4 0 "[ . 1]" 3
88 2 36 ASN O 2 40 ASP N 3.000 2.800 3.300 3.295 2.983 3.672 0.372 4 0 "[ . 1]" 3
89 2 37 VAL O 2 41 CYS H 2.000 . 2.300 2.110 1.862 2.337 0.037 4 0 "[ . 1]" 3
90 2 37 VAL O 2 41 CYS N 3.000 2.800 3.300 3.061 2.832 3.303 0.003 4 0 "[ . 1]" 3
91 2 38 ALA O 2 42 ILE H 2.000 . 2.300 1.908 1.847 1.994 . 0 0 "[ . 1]" 3
92 2 38 ALA O 2 42 ILE N 3.000 2.800 3.300 2.848 2.772 2.921 0.028 1 0 "[ . 1]" 3
93 2 39 MET O 2 43 SER H 2.000 . 2.300 2.002 1.815 2.155 . 0 0 "[ . 1]" 3
94 2 39 MET O 2 43 SER N 3.000 2.800 3.300 2.926 2.779 3.056 0.021 6 0 "[ . 1]" 3
95 2 40 ASP O 2 44 GLU H 2.000 . 2.300 2.052 1.817 2.299 . 0 0 "[ . 1]" 3
96 2 40 ASP O 2 44 GLU N 3.000 2.800 3.300 2.975 2.776 3.216 0.024 3 0 "[ . 1]" 3
97 2 41 CYS O 2 45 ALA H 2.000 . 2.300 1.993 1.860 2.241 . 0 0 "[ . 1]" 3
98 2 41 CYS O 2 45 ALA N 3.000 2.800 3.300 2.869 2.795 3.098 0.005 8 0 "[ . 1]" 3
99 2 42 ILE O 2 46 PHE H 2.000 . 2.300 2.107 1.879 2.300 . 0 0 "[ . 1]" 3
100 2 42 ILE O 2 46 PHE N 3.000 2.800 3.300 3.012 2.856 3.190 . 0 0 "[ . 1]" 3
101 3 7 LYS O 3 11 ALA H 2.000 . 2.300 1.885 1.804 2.001 . 0 0 "[ . 1]" 3
102 3 7 LYS O 3 11 ALA N 3.000 2.800 3.300 2.840 2.751 2.949 0.049 5 0 "[ . 1]" 3
103 3 8 GLU O 3 12 ALA H 2.000 . 2.300 2.073 1.879 2.301 0.001 6 0 "[ . 1]" 3
104 3 8 GLU O 3 12 ALA N 3.000 2.800 3.300 3.005 2.837 3.188 . 0 0 "[ . 1]" 3
105 3 9 GLU O 3 13 LEU H 2.000 . 2.300 1.981 1.857 2.240 . 0 0 "[ . 1]" 3
106 3 9 GLU O 3 13 LEU N 3.000 2.800 3.300 2.879 2.794 3.104 0.006 6 0 "[ . 1]" 3
107 3 10 ILE O 3 14 ILE H 2.000 . 2.300 2.064 1.895 2.283 . 0 0 "[ . 1]" 3
108 3 10 ILE O 3 14 ILE N 3.000 2.800 3.300 2.962 2.811 3.190 . 0 0 "[ . 1]" 3
109 3 11 ALA O 3 15 VAL H 2.000 . 2.300 2.123 2.020 2.314 0.014 5 0 "[ . 1]" 3
110 3 11 ALA O 3 15 VAL N 3.000 2.800 3.300 3.094 2.990 3.283 . 0 0 "[ . 1]" 3
111 3 12 ALA O 3 16 ASN H 2.000 . 2.300 2.171 2.042 2.325 0.025 3 0 "[ . 1]" 3
112 3 12 ALA O 3 16 ASN N 3.000 2.800 3.300 2.987 2.875 3.135 . 0 0 "[ . 1]" 3
113 3 13 LEU O 3 17 TYR H 2.000 . 2.300 1.991 1.872 2.099 . 0 0 "[ . 1]" 3
114 3 13 LEU O 3 17 TYR N 3.000 2.800 3.300 2.904 2.814 3.007 . 0 0 "[ . 1]" 3
115 3 14 ILE O 3 18 PHE H 2.000 . 2.300 1.926 1.844 2.017 . 0 0 "[ . 1]" 3
116 3 14 ILE O 3 18 PHE N 3.000 2.800 3.300 2.888 2.790 2.978 0.010 6 0 "[ . 1]" 3
117 3 15 VAL O 3 19 SER H 2.000 . 2.300 2.310 2.209 2.363 0.063 2 0 "[ . 1]" 3
118 3 15 VAL O 3 19 SER N 3.000 2.800 3.300 3.249 3.145 3.310 0.010 2 0 "[ . 1]" 3
119 3 16 ASN O 3 20 SER H 2.000 . 2.300 2.289 2.173 2.371 0.071 10 0 "[ . 1]" 3
120 3 16 ASN O 3 20 SER N 3.000 2.800 3.300 3.213 3.094 3.296 . 0 0 "[ . 1]" 3
121 3 17 TYR O 3 21 ILE H 2.000 . 2.300 2.183 2.095 2.289 . 0 0 "[ . 1]" 3
122 3 17 TYR O 3 21 ILE N 3.000 2.800 3.300 2.897 2.833 2.985 . 0 0 "[ . 1]" 3
123 3 29 GLU O 3 33 ASP H 2.000 . 2.300 2.113 1.817 2.336 0.036 5 0 "[ . 1]" 3
124 3 29 GLU O 3 33 ASP N 3.000 2.800 3.300 3.042 2.776 3.272 0.024 6 0 "[ . 1]" 3
125 3 30 ASP O 3 34 SER H 2.000 . 2.300 2.237 2.141 2.352 0.052 3 0 "[ . 1]" 3
126 3 30 ASP O 3 34 SER N 3.000 2.800 3.300 3.139 3.052 3.264 . 0 0 "[ . 1]" 3
127 3 31 GLY O 3 35 LEU H 2.000 . 2.300 2.036 1.904 2.230 . 0 0 "[ . 1]" 3
128 3 31 GLY O 3 35 LEU N 3.000 2.800 3.300 2.921 2.819 3.037 . 0 0 "[ . 1]" 3
129 3 32 ALA O 3 36 ASN H 2.000 . 2.300 2.136 1.937 2.328 0.028 4 0 "[ . 1]" 3
130 3 32 ALA O 3 36 ASN N 3.000 2.800 3.300 2.962 2.817 3.088 . 0 0 "[ . 1]" 3
131 3 33 ASP O 3 37 VAL H 2.000 . 2.300 2.098 1.863 2.286 . 0 0 "[ . 1]" 3
132 3 33 ASP O 3 37 VAL N 3.000 2.800 3.300 3.062 2.840 3.249 . 0 0 "[ . 1]" 3
133 3 34 SER O 3 38 ALA H 2.000 . 2.300 2.118 1.997 2.266 . 0 0 "[ . 1]" 3
134 3 34 SER O 3 38 ALA N 3.000 2.800 3.300 3.028 2.915 3.168 . 0 0 "[ . 1]" 3
135 3 35 LEU O 3 39 MET H 2.000 . 2.300 2.072 1.898 2.292 . 0 0 "[ . 1]" 3
136 3 35 LEU O 3 39 MET N 3.000 2.800 3.300 2.879 2.782 3.075 0.018 4 0 "[ . 1]" 3
137 3 36 ASN O 3 40 ASP H 2.000 . 2.300 2.635 2.368 2.767 0.467 8 0 "[ . 1]" 3
138 3 36 ASN O 3 40 ASP N 3.000 2.800 3.300 3.577 3.332 3.705 0.405 8 0 "[ . 1]" 3
139 3 37 VAL O 3 41 CYS H 2.000 . 2.300 2.296 2.158 2.364 0.064 10 0 "[ . 1]" 3
140 3 37 VAL O 3 41 CYS N 3.000 2.800 3.300 3.154 3.039 3.221 . 0 0 "[ . 1]" 3
141 3 38 ALA O 3 42 ILE H 2.000 . 2.300 2.042 1.848 2.323 0.023 7 0 "[ . 1]" 3
142 3 38 ALA O 3 42 ILE N 3.000 2.800 3.300 2.982 2.807 3.237 . 0 0 "[ . 1]" 3
143 3 39 MET O 3 43 SER H 2.000 . 2.300 2.042 1.893 2.144 . 0 0 "[ . 1]" 3
144 3 39 MET O 3 43 SER N 3.000 2.800 3.300 2.978 2.854 3.091 . 0 0 "[ . 1]" 3
145 3 40 ASP O 3 44 GLU H 2.000 . 2.300 1.850 1.819 1.909 . 0 0 "[ . 1]" 3
146 3 40 ASP O 3 44 GLU N 3.000 2.800 3.300 2.789 2.765 2.824 0.035 4 0 "[ . 1]" 3
147 3 41 CYS O 3 45 ALA H 2.000 . 2.300 2.072 1.942 2.320 0.020 2 0 "[ . 1]" 3
148 3 41 CYS O 3 45 ALA N 3.000 2.800 3.300 2.967 2.892 3.160 . 0 0 "[ . 1]" 3
149 3 42 ILE O 3 46 PHE H 2.000 . 2.300 2.096 1.852 2.299 . 0 0 "[ . 1]" 3
150 3 42 ILE O 3 46 PHE N 3.000 2.800 3.300 3.035 2.822 3.208 . 0 0 "[ . 1]" 3
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