NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
637971 |
6gms   |
18823 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6gms
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 1929
_Distance_constraint_stats_list.Viol_count 1410
_Distance_constraint_stats_list.Viol_total 9249.953
_Distance_constraint_stats_list.Viol_max 3.728
_Distance_constraint_stats_list.Viol_rms 0.0966
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0120
_Distance_constraint_stats_list.Viol_average_violations_only 0.3280
_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 3 ASN 3.866 0.845 12 2 "[ . 1 + - 2]"
1 4 TYR 2.559 1.017 11 1 "[ . 1+ . 2]"
1 5 LEU 1.942 1.017 11 1 "[ . 1+ . 2]"
1 6 ARG 11.762 2.266 15 4 "[ . 1*- + *2]"
1 7 LYS 20.695 3.728 1 11 "[+ *.* * 1 -* ** ***]"
1 8 ALA 2.382 0.255 16 0 "[ . 1 . 2]"
1 9 ALA 1.831 0.386 4 0 "[ . 1 . 2]"
1 10 LEU 17.647 1.452 15 5 "[ -. *1 + * *]"
1 11 THR 2.350 0.703 18 4 "[ .*- 1 * . + 2]"
1 12 ASP 9.399 0.889 17 5 "[ *. * - . +* 2]"
1 13 MET 15.206 0.747 10 5 "[ *. * +- . *]"
1 14 LEU 10.176 0.938 8 7 "[ *.*-+ 1* * . *]"
1 15 GLN 9.167 0.938 8 5 "[ *. + * . *- 2]"
1 16 THR 9.366 0.846 16 9 "[- .*** * * .+ **2]"
1 17 PHE 7.183 1.155 3 6 "[ +*. * 1 -* * 2]"
1 18 VAL 4.667 0.739 3 3 "[ + . 1 - . * 2]"
1 19 PRO 1.621 0.208 13 0 "[ . 1 . 2]"
1 20 TYR 11.087 0.846 16 9 "[- .*** * * .+ **2]"
1 21 ARG 13.098 1.341 17 5 "[ * * 1 *- . + 2]"
1 22 THR 2.995 0.794 9 3 "[ . +1 . * -]"
1 23 ALA 0.625 0.327 9 0 "[ . 1 . 2]"
1 24 VAL 4.362 0.489 8 0 "[ . 1 . 2]"
1 25 GLU 5.451 1.341 17 2 "[ - 1 . + 2]"
1 26 LEU 4.520 0.794 9 3 "[ . +1 . * -]"
1 27 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 ALA 3.078 0.452 9 0 "[ . 1 . 2]"
1 29 LEU 6.674 0.634 9 2 "[ . +1 . -2]"
1 30 GLU 6.134 0.634 9 2 "[ . +1 . -2]"
1 31 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 GLY 0.337 0.088 14 0 "[ . 1 . 2]"
1 33 GLY 5.259 0.787 10 2 "[- . + . 2]"
1 34 LEU 17.173 2.579 7 10 "[** . +* - * .* ***]"
1 35 ASP 6.386 0.787 10 2 "[- . + . 2]"
1 36 THR 2.813 0.588 12 1 "[ . 1 + . 2]"
1 37 CYS 2.592 0.646 1 3 "[+ . * . - 2]"
1 38 ASP 2.286 0.697 6 1 "[ .+ 1 . 2]"
1 39 GLY 1.224 0.895 17 1 "[ . 1 . + 2]"
1 40 GLY 0.457 0.157 3 0 "[ . 1 . 2]"
1 41 SER 1.944 1.203 3 1 "[ + . 1 . 2]"
1 42 ASN 2.640 1.203 3 2 "[ + . 1 - . 2]"
1 43 GLY 0.457 0.157 3 0 "[ . 1 . 2]"
1 44 ILE 6.041 0.697 6 2 "[ .+ 1 . - 2]"
1 45 PRO 4.812 0.517 17 1 "[ . 1 . + 2]"
1 46 SER 3.388 0.503 4 1 "[ +. 1 . 2]"
1 47 PRO 1.418 0.592 8 1 "[ . + 1 . 2]"
1 48 THR 2.626 0.777 15 3 "[ - 1 + *2]"
1 49 THR 4.477 0.482 19 0 "[ . 1 . 2]"
1 50 THR 9.094 1.052 3 7 "[ + * * *1- * . *]"
1 51 ARG 5.043 0.697 2 1 "[ + . 1 . 2]"
1 52 TYR 7.852 0.697 2 2 "[ + . 1 - . 2]"
1 53 VAL 10.377 1.052 3 7 "[ + * * *1* - . *]"
1 54 SER 6.806 1.208 17 3 "[ . 1 . + *-]"
1 55 ALA 1.554 0.713 5 1 "[ + 1 . 2]"
1 56 MET 4.875 0.713 5 2 "[ + * 1 . 2]"
1 57 SER 0.578 0.544 5 1 "[ + 1 . 2]"
1 58 VAL 8.417 0.895 17 2 "[* . 1 . + 2]"
1 59 ALA 4.300 1.879 16 1 "[ . 1 .+ 2]"
1 60 LYS 5.608 0.714 20 3 "[ . 1 *. - +]"
1 61 GLY 1.877 0.317 13 0 "[ . 1 . 2]"
1 62 VAL 18.412 1.879 16 8 "[- *** * *1* .+ 2]"
1 63 VAL 3.695 0.214 11 0 "[ . 1 . 2]"
1 64 SER 8.462 0.815 13 8 "[** ** * 1 + - * 2]"
1 65 LEU 7.934 1.197 11 5 "[* . 1+ **- 2]"
1 66 THR 8.312 0.725 13 3 "[ . * *+ . 2]"
1 67 GLY 0.004 0.004 4 0 "[ . 1 . 2]"
1 68 GLN 23.642 1.208 17 15 "[****** *** **.*+ *-]"
1 69 GLU 7.100 0.508 10 6 "[- * ** + * . 2]"
1 70 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 LEU 32.886 1.570 12 12 "[ * *. *1*+- ******]"
1 72 ASN 9.410 0.733 19 4 "[ *. 1 * . +-]"
1 73 GLY 19.617 1.171 4 16 "[***+** -** ***.** **]"
1 74 LEU 0.512 0.190 7 0 "[ . 1 . 2]"
1 75 SER 3.170 0.693 10 2 "[ . + - . 2]"
1 76 VAL 6.184 1.197 11 2 "[ . 1+ -. 2]"
1 77 VAL 11.016 0.815 13 8 "[ * ** * 1* + .-* 2]"
1 78 MET 6.712 1.676 17 5 "[ *- . * .*+ 2]"
1 79 THR 1.167 0.323 6 0 "[ . 1 . 2]"
1 80 PRO 16.125 1.676 17 10 "[ *-** * *** .*+ 2]"
1 81 GLY 1.489 0.441 18 0 "[ . 1 . 2]"
1 82 TRP 24.913 2.397 6 8 "[ * *.+*- 1** . *2]"
1 84 ASN 25.078 2.397 6 8 "[ * *.+*- 1** . *2]"
1 85 ALA 0.008 0.008 12 0 "[ . 1 . 2]"
1 86 ASN 27.288 2.835 7 14 "[ * *. +******-.* ***]"
1 87 GLY 0.157 0.157 5 0 "[ . 1 . 2]"
1 88 VAL 27.288 2.835 7 14 "[ * *. +******-.* ***]"
1 89 THR 0.552 0.441 18 0 "[ . 1 . 2]"
1 90 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 TRP 13.481 0.955 12 2 "[ . 1 + . - 2]"
1 92 ALA 5.488 0.411 5 0 "[ . 1 . 2]"
1 93 ARG 4.638 1.155 3 4 "[* + .- * . 2]"
1 94 ASN 10.489 1.142 15 9 "[ *. * 1* **+-** 2]"
1 95 CYS 5.224 1.451 15 2 "[ . 1 - + 2]"
1 96 ASN 5.948 0.582 4 2 "[ +. 1 . -]"
1 97 ILE 11.674 0.582 4 2 "[ +. 1 . -]"
1 98 GLN 0.505 0.396 6 0 "[ . 1 . 2]"
1 99 SER 3.841 0.475 16 0 "[ . 1 . 2]"
1 100 ASP 3.257 0.468 9 0 "[ . 1 . 2]"
1 101 SER 0.289 0.067 20 0 "[ . 1 . 2]"
1 102 ALA 16.361 0.904 16 11 "[ - *. *1 ** *+****]"
1 103 LEU 6.045 0.806 16 4 "[ . 1 -* .+ *2]"
1 104 GLN 9.630 1.053 15 6 "[ * . 1** +- *]"
1 105 GLN 17.330 3.728 1 9 "[+ .* * 1 -* .* ***]"
1 106 ALA 16.401 2.266 15 7 "[* . * 1 *- +* *2]"
1 107 CYS 9.666 1.452 15 1 "[ . 1 + 2]"
1 108 GLU 21.886 1.997 18 14 "[ ***.*- *1*** ** +**]"
1 109 ASP 4.280 1.316 18 2 "[ . 1 - + 2]"
1 110 VAL 0.756 0.663 18 1 "[ . 1 . + 2]"
1 111 PHE 11.327 1.142 15 7 "[ *. * * - *+ * 2]"
1 112 ARG 3.936 0.779 18 1 "[ . 1 . + 2]"
1 113 PHE 11.726 1.997 18 8 "[ *. * - *** +*2]"
1 114 ASP 8.430 0.962 9 5 "[ * . +1 . * -*]"
1 115 ASP 4.716 0.559 17 8 "[ *. ** 1**- . + *]"
1 116 ALA 13.284 0.962 9 8 "[ * . * +1 - *. * **]"
1 117 ASN 4.267 0.823 2 4 "[ + . 1 . * -*]"
1 118 LEU 8.383 0.733 19 5 "[ . * * - *. +2]"
1 119 VAL 11.263 2.578 17 8 "[ * . * *-*.*+ *]"
1 120 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 121 ARG 20.611 2.578 17 9 "[ * . ***-*.*+ *]"
1 122 GLY 4.179 0.757 13 3 "[ * . 1- + . 2]"
1 123 SER 10.427 1.636 18 8 "[ - .* 1* **. +**]"
1 124 GLY 3.336 0.784 14 4 "[ . 1 +. -**]"
1 125 LEU 14.272 1.636 18 8 "[ * .* 1* **. +**]"
1 126 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 127 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 112 ARG HB2 1 113 PHE H 3.466 . 4.968 3.182 2.559 4.574 . 0 0 "[ . 1 . 2]" 1
2 1 113 PHE H 1 113 PHE QB 3.441 . 4.335 2.922 2.426 3.222 . 0 0 "[ . 1 . 2]" 1
3 1 112 ARG HA 1 113 PHE H 2.434 . 3.175 2.194 2.104 2.318 . 0 0 "[ . 1 . 2]" 1
4 1 113 PHE H 1 113 PHE QD 4.136 . 6.275 2.836 2.002 3.618 . 0 0 "[ . 1 . 2]" 1
5 1 105 GLN H 1 105 GLN HB2 2.184 . 2.780 2.455 2.253 2.579 . 0 0 "[ . 1 . 2]" 1
6 1 104 GLN HB3 1 105 GLN H 2.404 . 3.126 2.618 2.454 2.734 . 0 0 "[ . 1 . 2]" 1
7 1 105 GLN H 1 105 GLN QG . . 3.018 2.372 2.027 3.924 0.906 8 2 "[ .- + 1 . 2]" 1
8 1 105 GLN H 1 105 GLN HA 2.686 . 3.588 2.781 2.763 2.831 . 0 0 "[ . 1 . 2]" 1
9 1 102 ALA HA 1 105 GLN H 2.996 . 4.118 3.331 3.104 3.494 . 0 0 "[ . 1 . 2]" 1
10 1 96 ASN H 1 96 ASN QB 2.373 . 3.077 2.462 2.368 2.537 . 0 0 "[ . 1 . 2]" 1
11 1 93 ARG H 1 93 ARG QD 3.720 . 3.996 3.283 2.109 4.653 0.657 10 3 "[* .- + . 2]" 1
12 1 91 TRP HD1 1 92 ALA H 4.366 . 6.749 4.618 4.407 4.756 . 0 0 "[ . 1 . 2]" 1
13 1 91 TRP H 1 91 TRP HB2 3.769 . 5.544 2.622 2.444 2.830 . 0 0 "[ . 1 . 2]" 1
14 1 85 ALA H 1 85 ALA HA 2.650 . 3.528 2.861 2.802 2.901 . 0 0 "[ . 1 . 2]" 1
15 1 82 TRP HE1 1 84 ASN HA 5.036 . 8.206 7.901 4.858 10.603 2.397 6 7 "[ - *.+** 1 * . *2]" 1
16 1 80 PRO QD 1 91 TRP HE1 4.895 . 7.890 4.925 3.896 5.694 . 0 0 "[ . 1 . 2]" 1
17 1 21 ARG HA 1 91 TRP HE1 4.410 . 6.841 4.457 3.261 5.584 . 0 0 "[ . 1 . 2]" 1
18 1 21 ARG QD 1 91 TRP HE1 3.142 . 4.376 3.602 1.791 4.784 0.408 7 0 "[ . 1 . 2]" 1
19 1 91 TRP HB3 1 91 TRP HE1 5.214 . 8.612 4.798 4.760 4.855 . 0 0 "[ . 1 . 2]" 1
20 1 80 PRO QB 1 91 TRP HE1 3.146 . 4.383 3.007 2.577 3.812 . 0 0 "[ . 1 . 2]" 1
21 1 18 VAL QG 1 91 TRP HE1 4.735 . 7.537 6.680 5.649 8.218 0.681 17 1 "[ . 1 . + 2]" 1
22 1 80 PRO QB 1 81 GLY H 3.625 . 5.267 3.169 2.718 3.387 . 0 0 "[ . 1 . 2]" 1
23 1 81 GLY H 1 92 ALA H 5.040 . 8.215 4.194 3.485 4.876 . 0 0 "[ . 1 . 2]" 1
24 1 81 GLY H 1 91 TRP HD1 4.760 . 7.592 5.058 4.279 5.815 . 0 0 "[ . 1 . 2]" 1
25 1 81 GLY H 1 91 TRP HA 3.823 . 5.649 3.259 2.764 3.659 . 0 0 "[ . 1 . 2]" 1
26 1 78 MET H 1 79 THR H 4.340 . 6.695 4.319 4.278 4.382 . 0 0 "[ . 1 . 2]" 1
27 1 79 THR H 1 91 TRP HD1 3.892 . 5.785 5.240 4.362 5.908 0.123 13 0 "[ . 1 . 2]" 1
28 1 78 MET HA 1 79 THR H 2.316 . 2.987 2.138 2.098 2.184 . 0 0 "[ . 1 . 2]" 1
29 1 79 THR H 1 93 ARG HA 3.548 . 5.121 3.631 3.228 3.884 . 0 0 "[ . 1 . 2]" 1
30 1 17 PHE QE 1 78 MET H 5.559 . 9.422 6.161 5.591 7.147 . 0 0 "[ . 1 . 2]" 1
31 1 78 MET H 1 91 TRP HD1 5.360 . 8.951 7.086 6.153 7.870 . 0 0 "[ . 1 . 2]" 1
32 1 63 VAL HB 1 78 MET H 3.912 . 5.825 4.497 3.551 5.120 . 0 0 "[ . 1 . 2]" 1
33 1 77 VAL MG1 1 78 MET H 3.029 . 4.176 3.173 3.029 3.247 . 0 0 "[ . 1 . 2]" 1
34 1 76 VAL QG 1 78 MET H 3.971 . 5.942 3.571 3.416 3.774 . 0 0 "[ . 1 . 2]" 1
35 1 67 GLY H 1 76 VAL H 4.270 . 6.550 4.954 4.456 5.548 . 0 0 "[ . 1 . 2]" 1
36 1 74 LEU H 1 75 SER H 4.501 . 7.033 4.507 4.440 4.565 . 0 0 "[ . 1 . 2]" 1
37 1 75 SER H 1 75 SER HA 2.959 . 4.053 2.943 2.928 2.948 . 0 0 "[ . 1 . 2]" 1
38 1 74 LEU HA 1 75 SER H 2.228 . 2.849 2.168 2.131 2.214 . 0 0 "[ . 1 . 2]" 1
39 1 75 SER H 1 97 ILE HA 3.996 . 5.992 3.843 3.610 4.243 . 0 0 "[ . 1 . 2]" 1
40 1 75 SER H 1 96 ASN QB 3.076 . 4.259 3.013 2.681 3.386 . 0 0 "[ . 1 . 2]" 1
41 1 74 LEU HB3 1 75 SER H 4.050 . 6.100 4.110 3.996 4.318 . 0 0 "[ . 1 . 2]" 1
42 1 73 GLY H 1 74 LEU H 2.494 . 3.272 2.802 2.677 2.987 . 0 0 "[ . 1 . 2]" 1
43 1 67 GLY H 1 74 LEU H 3.606 . 5.232 3.443 3.304 3.584 . 0 0 "[ . 1 . 2]" 1
44 1 74 LEU H 1 74 LEU HA 2.897 . 3.946 2.900 2.855 2.925 . 0 0 "[ . 1 . 2]" 1
45 1 67 GLY HA2 1 74 LEU H 3.571 . 5.165 2.982 2.670 3.857 . 0 0 "[ . 1 . 2]" 1
46 1 68 GLN HA 1 73 GLY H 4.200 . 6.405 7.109 6.626 7.576 1.171 4 15 "[***+** -** **.** **]" 1
47 1 73 GLY H 1 73 GLY HA2 2.501 . 3.283 2.329 2.311 2.338 . 0 0 "[ . 1 . 2]" 1
48 1 72 ASN HA 1 73 GLY H 2.205 . 2.813 2.193 2.156 2.227 . 0 0 "[ . 1 . 2]" 1
49 1 73 GLY H 1 73 GLY HA3 2.857 . 3.877 2.894 2.866 2.906 . 0 0 "[ . 1 . 2]" 1
50 1 72 ASN H 1 72 ASN HB3 2.588 . 3.425 2.585 2.379 2.797 . 0 0 "[ . 1 . 2]" 1
51 1 72 ASN H 1 72 ASN HB2 2.376 . 3.082 2.554 2.267 3.597 0.515 20 1 "[ . 1 . +]" 1
52 1 70 SER HA 1 72 ASN H 3.241 . 4.554 3.477 3.363 3.559 . 0 0 "[ . 1 . 2]" 1
53 1 72 ASN H 1 72 ASN HA 2.682 . 3.581 2.779 2.761 2.819 . 0 0 "[ . 1 . 2]" 1
54 1 71 LEU HA 1 72 ASN H 2.842 . 3.851 2.804 2.761 2.849 . 0 0 "[ . 1 . 2]" 1
55 1 72 ASN H 1 74 LEU H 4.381 . 6.780 4.363 4.261 4.433 . 0 0 "[ . 1 . 2]" 1
56 1 71 LEU H 1 72 ASN H 2.446 . 3.194 3.084 2.963 3.179 . 0 0 "[ . 1 . 2]" 1
57 1 72 ASN H 1 73 GLY H 4.405 . 6.831 4.594 4.552 4.616 . 0 0 "[ . 1 . 2]" 1
58 1 68 GLN H 1 69 GLU H 4.714 . 7.492 4.483 4.385 4.523 . 0 0 "[ . 1 . 2]" 1
59 1 68 GLN H 1 73 GLY H 4.893 . 7.886 5.299 4.868 5.711 . 0 0 "[ . 1 . 2]" 1
60 1 67 GLY HA2 1 68 GLN H 2.445 . 3.192 2.731 2.676 2.786 . 0 0 "[ . 1 . 2]" 1
61 1 66 THR HA 1 68 GLN H 4.313 . 6.638 3.985 3.767 4.190 . 0 0 "[ . 1 . 2]" 1
62 1 68 GLN H 1 71 LEU HA 4.464 . 6.955 5.394 5.211 5.703 . 0 0 "[ . 1 . 2]" 1
63 1 68 GLN H 1 72 ASN HA 4.715 . 7.493 4.350 3.950 4.733 . 0 0 "[ . 1 . 2]" 1
64 1 67 GLY HA3 1 68 GLN H 3.134 . 4.362 3.552 3.530 3.576 . 0 0 "[ . 1 . 2]" 1
65 1 54 SER QB 1 68 GLN H 4.448 . 5.253 4.247 3.867 5.123 . 0 0 "[ . 1 . 2]" 1
66 1 68 GLN H 1 71 LEU HB3 3.767 . 5.541 4.081 3.870 4.420 . 0 0 "[ . 1 . 2]" 1
67 1 68 GLN H 1 68 GLN QB 3.344 . 3.726 2.241 2.129 2.305 . 0 0 "[ . 1 . 2]" 1
68 1 68 GLN H 1 71 LEU HB2 2.854 . 3.872 2.869 2.642 3.218 . 0 0 "[ . 1 . 2]" 1
69 1 68 GLN H 1 74 LEU QD 4.088 . 6.177 3.887 3.655 4.276 . 0 0 "[ . 1 . 2]" 1
70 1 65 LEU QD 1 68 GLN H 4.149 . 6.300 5.404 4.313 6.155 . 0 0 "[ . 1 . 2]" 1
71 1 67 GLY H 1 74 LEU QD 3.937 . 5.875 4.175 3.930 4.680 . 0 0 "[ . 1 . 2]" 1
72 1 67 GLY H 1 68 GLN QB 3.756 . 5.519 4.551 4.314 4.695 . 0 0 "[ . 1 . 2]" 1
73 1 65 LEU QB 1 67 GLY H 4.126 . 6.254 5.331 4.920 5.893 . 0 0 "[ . 1 . 2]" 1
74 1 67 GLY H 1 74 LEU HB3 3.786 . 5.578 4.136 3.793 4.381 . 0 0 "[ . 1 . 2]" 1
75 1 67 GLY H 1 67 GLY HA3 2.742 . 3.682 2.739 2.709 2.822 . 0 0 "[ . 1 . 2]" 1
76 1 66 THR HB 1 67 GLY H 4.032 . 6.064 3.903 3.735 4.094 . 0 0 "[ . 1 . 2]" 1
77 1 67 GLY H 1 74 LEU HA 3.620 . 5.258 4.765 4.637 4.929 . 0 0 "[ . 1 . 2]" 1
78 1 67 GLY H 1 68 GLN HA 3.696 . 5.403 5.321 5.181 5.407 0.004 4 0 "[ . 1 . 2]" 1
79 1 66 THR HA 1 67 GLY H 2.231 . 2.853 2.174 2.079 2.337 . 0 0 "[ . 1 . 2]" 1
80 1 67 GLY H 1 67 GLY HA2 2.632 . 3.498 2.308 2.277 2.318 . 0 0 "[ . 1 . 2]" 1
81 1 67 GLY H 1 75 SER HA 3.358 . 4.768 3.456 3.072 4.083 . 0 0 "[ . 1 . 2]" 1
82 1 67 GLY H 1 68 GLN H 3.431 . 4.902 3.002 2.703 3.096 . 0 0 "[ . 1 . 2]" 1
83 1 65 LEU H 1 66 THR H 4.277 . 6.563 4.433 4.194 4.519 . 0 0 "[ . 1 . 2]" 1
84 1 56 MET HA 1 66 THR H 3.667 . 5.348 3.696 3.176 4.174 . 0 0 "[ . 1 . 2]" 1
85 1 65 LEU H 1 77 VAL MG2 3.484 . 5.002 4.120 3.776 4.464 . 0 0 "[ . 1 . 2]" 1
86 1 65 LEU H 1 65 LEU QD 2.708 . 3.624 2.197 1.983 2.297 0.017 14 0 "[ . 1 . 2]" 1
87 1 65 LEU H 1 76 VAL QG 4.242 . 6.270 3.627 2.784 3.834 . 0 0 "[ . 1 . 2]" 1
88 1 65 LEU H 1 65 LEU QB 2.714 . 3.635 2.593 2.505 3.091 . 0 0 "[ . 1 . 2]" 1
89 1 63 VAL QG 1 65 LEU H 4.386 . 6.790 4.431 3.926 4.774 . 0 0 "[ . 1 . 2]" 1
90 1 63 VAL HB 1 65 LEU H 4.646 . 7.344 5.521 5.194 5.961 . 0 0 "[ . 1 . 2]" 1
91 1 65 LEU H 1 77 VAL HA 3.800 . 5.605 3.624 3.376 3.807 . 0 0 "[ . 1 . 2]" 1
92 1 65 LEU H 1 66 THR HA 4.573 . 7.188 4.854 4.719 5.040 . 0 0 "[ . 1 . 2]" 1
93 1 64 SER HA 1 65 LEU H 2.203 . 2.809 2.109 2.089 2.129 . 0 0 "[ . 1 . 2]" 1
94 1 65 LEU H 1 75 SER HA 4.355 . 6.726 4.508 4.170 4.764 . 0 0 "[ . 1 . 2]" 1
95 1 56 MET HA 1 65 LEU H 4.379 . 6.776 4.582 4.413 4.835 . 0 0 "[ . 1 . 2]" 1
96 1 63 VAL H 1 65 LEU H 4.152 . 6.307 6.330 6.210 6.427 0.120 5 0 "[ . 1 . 2]" 1
97 1 65 LEU H 1 67 GLY H 4.761 . 7.595 6.835 6.543 7.321 . 0 0 "[ . 1 . 2]" 1
98 1 65 LEU H 1 76 VAL H 2.752 . 3.698 2.949 2.791 3.078 . 0 0 "[ . 1 . 2]" 1
99 1 65 LEU H 1 78 MET H 4.033 . 6.066 4.453 4.256 4.817 . 0 0 "[ . 1 . 2]" 1
100 1 63 VAL H 1 64 SER H 3.758 . 5.524 4.017 3.912 4.135 . 0 0 "[ . 1 . 2]" 1
101 1 65 LEU H 1 96 ASN H 4.689 . 7.437 7.148 6.846 7.491 0.054 14 0 "[ . 1 . 2]" 1
102 1 64 SER H 1 65 LEU H 4.353 . 6.722 4.429 4.396 4.459 . 0 0 "[ . 1 . 2]" 1
103 1 56 MET HA 1 64 SER H 4.160 . 6.324 4.694 4.470 4.897 . 0 0 "[ . 1 . 2]" 1
104 1 64 SER H 1 64 SER HA 2.987 . 4.102 2.926 2.909 2.934 . 0 0 "[ . 1 . 2]" 1
105 1 63 VAL HA 1 64 SER H 2.143 . 2.717 2.098 2.070 2.141 . 0 0 "[ . 1 . 2]" 1
106 1 64 SER H 1 64 SER HB2 2.741 . 3.680 2.857 2.526 3.642 . 0 0 "[ . 1 . 2]" 1
107 1 63 VAL HB 1 64 SER H 4.238 . 6.484 3.779 3.393 4.360 . 0 0 "[ . 1 . 2]" 1
108 1 62 VAL QG 1 64 SER H 4.184 . 5.136 3.840 3.553 4.030 . 0 0 "[ . 1 . 2]" 1
109 1 63 VAL H 1 77 VAL MG1 3.690 . 5.392 4.010 3.665 4.230 . 0 0 "[ . 1 . 2]" 1
110 1 62 VAL HA 1 63 VAL H 2.311 . 2.979 2.294 2.226 2.342 . 0 0 "[ . 1 . 2]" 1
111 1 17 PHE QE 1 63 VAL H 5.254 . 8.705 5.742 5.164 6.099 . 0 0 "[ . 1 . 2]" 1
112 1 63 VAL H 1 91 TRP HD1 4.992 . 8.107 6.238 4.845 6.912 . 0 0 "[ . 1 . 2]" 1
113 1 63 VAL H 1 78 MET H 3.371 . 4.791 3.100 2.793 3.324 . 0 0 "[ . 1 . 2]" 1
114 1 60 LYS H 1 62 VAL H 4.130 . 6.262 4.326 4.189 4.587 . 0 0 "[ . 1 . 2]" 1
115 1 62 VAL H 1 63 VAL H 4.232 . 6.471 4.666 4.625 4.694 . 0 0 "[ . 1 . 2]" 1
116 1 59 ALA H 1 62 VAL H 2.933 . 4.008 3.523 3.281 3.822 . 0 0 "[ . 1 . 2]" 1
117 1 61 GLY H 1 62 VAL H 2.941 . 4.022 2.994 2.910 3.098 . 0 0 "[ . 1 . 2]" 1
118 1 38 ASP HA 1 62 VAL H 4.418 . 6.858 5.896 5.609 6.270 . 0 0 "[ . 1 . 2]" 1
119 1 62 VAL H 1 62 VAL HA 2.820 . 3.814 2.840 2.818 2.862 . 0 0 "[ . 1 . 2]" 1
120 1 61 GLY QA 1 62 VAL H 3.123 . 4.342 2.799 2.755 2.835 . 0 0 "[ . 1 . 2]" 1
121 1 62 VAL H 1 62 VAL HB 2.302 . 2.965 2.657 2.552 3.667 0.702 16 1 "[ . 1 .+ 2]" 1
122 1 62 VAL H 1 80 PRO HG3 3.933 . 5.867 4.979 3.897 6.200 0.333 11 0 "[ . 1 . 2]" 1
123 1 59 ALA MB 1 62 VAL H 3.282 . 4.628 4.121 3.975 4.291 . 0 0 "[ . 1 . 2]" 1
124 1 62 VAL H 1 63 VAL QG 3.301 . 4.663 4.264 4.130 4.421 . 0 0 "[ . 1 . 2]" 1
125 1 58 VAL MG1 1 61 GLY H 2.968 . 4.069 2.741 2.535 3.055 . 0 0 "[ . 1 . 2]" 1
126 1 34 LEU HG 1 61 GLY H 5.402 . 9.050 6.820 6.524 7.874 . 0 0 "[ . 1 . 2]" 1
127 1 34 LEU QD 1 61 GLY H 4.288 . 6.586 4.200 3.938 4.928 . 0 0 "[ . 1 . 2]" 1
128 1 38 ASP HA 1 61 GLY H 3.767 . 5.541 3.353 3.085 3.724 . 0 0 "[ . 1 . 2]" 1
129 1 37 CYS QB 1 61 GLY H 3.752 . 4.527 2.800 2.472 3.237 . 0 0 "[ . 1 . 2]" 1
130 1 60 LYS HA 1 61 GLY H 2.675 . 3.569 2.720 2.662 2.772 . 0 0 "[ . 1 . 2]" 1
131 1 59 ALA MB 1 60 LYS H 3.157 . 4.403 3.297 3.267 3.321 . 0 0 "[ . 1 . 2]" 1
132 1 58 VAL MG1 1 60 LYS H 4.118 . 6.238 3.804 3.691 3.917 . 0 0 "[ . 1 . 2]" 1
133 1 60 LYS H 1 60 LYS HG2 2.794 . 3.770 2.870 2.675 3.590 . 0 0 "[ . 1 . 2]" 1
134 1 38 ASP QB 1 60 LYS H . . 5.578 3.222 2.101 3.816 . 0 0 "[ . 1 . 2]" 1
135 1 60 LYS H 1 60 LYS QE 4.313 . 6.638 4.078 3.404 4.981 . 0 0 "[ . 1 . 2]" 1
136 1 35 ASP HA 1 60 LYS H 5.122 . 8.402 5.090 4.546 5.581 . 0 0 "[ . 1 . 2]" 1
137 1 60 LYS H 1 60 LYS HA 2.340 . 3.025 2.320 2.305 2.335 . 0 0 "[ . 1 . 2]" 1
138 1 60 LYS H 1 61 GLY QA 5.120 . 8.397 4.705 4.589 4.800 . 0 0 "[ . 1 . 2]" 1
139 1 59 ALA HA 1 60 LYS H 2.176 . 2.768 2.057 2.048 2.077 . 0 0 "[ . 1 . 2]" 1
140 1 38 ASP HA 1 60 LYS H 3.152 . 4.394 2.668 2.344 3.037 . 0 0 "[ . 1 . 2]" 1
141 1 60 LYS H 1 61 GLY H 2.958 . 4.052 2.841 2.712 2.954 . 0 0 "[ . 1 . 2]" 1
142 1 39 GLY H 1 60 LYS H 4.793 . 7.665 4.347 3.927 4.779 . 0 0 "[ . 1 . 2]" 1
143 1 59 ALA H 1 60 LYS H 3.961 . 5.922 3.945 3.844 4.023 . 0 0 "[ . 1 . 2]" 1
144 1 58 VAL HA 1 59 ALA H 2.201 . 2.806 2.167 2.143 2.180 . 0 0 "[ . 1 . 2]" 1
145 1 38 ASP HA 1 59 ALA H 3.578 . 5.178 4.661 4.352 5.009 . 0 0 "[ . 1 . 2]" 1
146 1 59 ALA H 1 62 VAL HB 3.149 . 4.388 3.375 2.682 5.330 0.942 16 1 "[ . 1 .+ 2]" 1
147 1 58 VAL HB 1 59 ALA H 4.284 . 6.578 4.226 4.157 4.290 . 0 0 "[ . 1 . 2]" 1
148 1 59 ALA H 1 63 VAL QG 4.356 . 6.728 3.485 3.285 3.751 . 0 0 "[ . 1 . 2]" 1
149 1 59 ALA H 1 62 VAL QG 4.171 . 6.346 3.746 3.082 3.921 . 0 0 "[ . 1 . 2]" 1
150 1 58 VAL MG2 1 59 ALA H 3.436 . 4.912 4.200 4.150 4.256 . 0 0 "[ . 1 . 2]" 1
151 1 58 VAL H 1 59 ALA MB 3.482 . 4.998 4.437 4.184 4.717 . 0 0 "[ . 1 . 2]" 1
152 1 58 VAL H 1 58 VAL HB 2.721 . 3.646 2.690 2.561 2.788 . 0 0 "[ . 1 . 2]" 1
153 1 47 PRO QG 1 58 VAL H 5.076 . 8.297 2.812 1.949 3.897 . 0 0 "[ . 1 . 2]" 1
154 1 47 PRO HB3 1 58 VAL H 4.039 . 6.078 3.143 2.397 4.342 . 0 0 "[ . 1 . 2]" 1
155 1 56 MET HB2 1 58 VAL H 4.385 . 6.789 5.735 5.130 6.123 . 0 0 "[ . 1 . 2]" 1
156 1 39 GLY HA3 1 58 VAL H 2.903 . 3.956 3.671 3.127 4.851 0.895 17 1 "[ . 1 . + 2]" 1
157 1 57 SER HA 1 58 VAL H 2.214 . 2.827 2.257 2.174 2.327 . 0 0 "[ . 1 . 2]" 1
158 1 58 VAL H 1 58 VAL HA 2.905 . 3.960 2.944 2.926 2.949 . 0 0 "[ . 1 . 2]" 1
159 1 38 ASP HA 1 58 VAL H 4.263 . 6.535 5.676 5.275 6.251 . 0 0 "[ . 1 . 2]" 1
160 1 58 VAL H 1 59 ALA H 3.707 . 5.425 4.273 4.158 4.347 . 0 0 "[ . 1 . 2]" 1
161 1 39 GLY H 1 58 VAL H 3.750 . 5.507 3.974 3.500 4.720 . 0 0 "[ . 1 . 2]" 1
162 1 57 SER H 1 58 VAL H 4.396 . 6.812 4.368 4.157 4.457 . 0 0 "[ . 1 . 2]" 1
163 1 57 SER H 1 64 SER H 2.761 . 3.714 3.003 2.840 3.175 . 0 0 "[ . 1 . 2]" 1
164 1 56 MET H 1 57 SER H 4.165 . 6.333 4.208 4.136 4.362 . 0 0 "[ . 1 . 2]" 1
165 1 57 SER H 1 64 SER HA 4.446 . 6.916 4.695 4.553 4.936 . 0 0 "[ . 1 . 2]" 1
166 1 56 MET HA 1 57 SER H 2.239 . 2.865 2.212 2.174 2.356 . 0 0 "[ . 1 . 2]" 1
167 1 57 SER H 1 65 LEU HA 4.182 . 6.368 3.816 3.603 4.043 . 0 0 "[ . 1 . 2]" 1
168 1 57 SER H 1 57 SER HA 2.958 . 4.051 2.931 2.872 2.949 . 0 0 "[ . 1 . 2]" 1
169 1 56 MET QG 1 57 SER H 4.031 . 6.063 4.087 3.857 4.459 . 0 0 "[ . 1 . 2]" 1
170 1 47 PRO QG 1 57 SER H 4.880 . 7.705 5.320 4.037 6.765 . 0 0 "[ . 1 . 2]" 1
171 1 56 MET HB2 1 57 SER H 2.619 . 3.476 2.929 2.333 4.020 0.544 5 1 "[ + 1 . 2]" 1
172 1 57 SER H 1 65 LEU QB 5.237 . 8.665 5.339 4.111 5.705 . 0 0 "[ . 1 . 2]" 1
173 1 57 SER H 1 63 VAL QG 3.971 . 5.943 3.968 2.951 4.574 . 0 0 "[ . 1 . 2]" 1
174 1 49 THR MG 1 57 SER H 5.123 . 8.404 6.150 5.776 6.542 . 0 0 "[ . 1 . 2]" 1
175 1 57 SER H 1 65 LEU QD 4.513 . 7.059 3.969 2.926 4.570 . 0 0 "[ . 1 . 2]" 1
176 1 117 ASN H 1 118 LEU H 2.732 . 3.665 2.336 2.170 2.494 . 0 0 "[ . 1 . 2]" 1
177 1 56 MET H 1 56 MET HA 2.839 . 3.846 2.852 2.811 2.924 . 0 0 "[ . 1 . 2]" 1
178 1 55 ALA HA 1 56 MET H 2.083 . 2.625 2.240 2.166 2.401 . 0 0 "[ . 1 . 2]" 1
179 1 56 MET H 1 65 LEU HA 4.324 . 6.661 4.550 4.270 4.931 . 0 0 "[ . 1 . 2]" 1
180 1 47 PRO QG 1 56 MET H 4.111 . 6.223 5.607 4.562 6.815 0.592 8 1 "[ . + 1 . 2]" 1
181 1 49 THR MG 1 56 MET H 3.508 . 5.046 3.123 2.687 3.770 . 0 0 "[ . 1 . 2]" 1
182 1 54 SER QB 1 55 ALA H 2.630 . 3.495 2.575 2.405 2.816 . 0 0 "[ . 1 . 2]" 1
183 1 55 ALA H 1 55 ALA HA 2.617 . 3.473 2.851 2.816 2.913 . 0 0 "[ . 1 . 2]" 1
184 1 55 ALA H 1 56 MET HA 4.181 . 6.366 4.898 4.744 5.034 . 0 0 "[ . 1 . 2]" 1
185 1 55 ALA H 1 56 MET H 3.734 . 5.476 4.224 4.083 4.381 . 0 0 "[ . 1 . 2]" 1
186 1 54 SER H 1 55 ALA H 2.162 . 2.746 2.383 2.243 2.566 . 0 0 "[ . 1 . 2]" 1
187 1 23 ALA H 1 24 VAL H 2.568 . 3.392 2.533 2.459 2.590 . 0 0 "[ . 1 . 2]" 1
188 1 66 THR H 1 67 GLY H 3.752 . 5.512 4.380 4.269 4.519 . 0 0 "[ . 1 . 2]" 1
189 1 54 SER H 1 68 GLN H 4.371 . 6.759 5.367 4.601 5.835 . 0 0 "[ . 1 . 2]" 1
190 1 65 LEU HA 1 66 THR H 2.354 . 3.047 2.257 2.166 2.371 . 0 0 "[ . 1 . 2]" 1
191 1 53 VAL HA 1 54 SER H 2.071 . 2.607 2.135 2.087 2.161 . 0 0 "[ . 1 . 2]" 1
192 1 66 THR H 1 66 THR HA 2.907 . 3.963 2.938 2.912 2.950 . 0 0 "[ . 1 . 2]" 1
193 1 66 THR H 1 66 THR HB 2.514 . 3.304 2.779 2.615 2.941 . 0 0 "[ . 1 . 2]" 1
194 1 54 SER H 1 54 SER HA 2.982 . 4.094 2.897 2.864 2.923 . 0 0 "[ . 1 . 2]" 1
195 1 54 SER H 1 54 SER QB 2.961 . 4.057 2.390 2.296 2.525 . 0 0 "[ . 1 . 2]" 1
196 1 66 THR H 1 67 GLY HA3 3.849 . 5.701 5.420 4.909 5.568 . 0 0 "[ . 1 . 2]" 1
197 1 54 SER H 1 68 GLN QB 3.282 . 4.629 4.084 3.782 4.708 0.079 17 0 "[ . 1 . 2]" 1
198 1 65 LEU QB 1 66 THR H . . 4.098 2.919 2.544 3.425 . 0 0 "[ . 1 . 2]" 1
199 1 55 ALA MB 1 66 THR H 2.905 . 3.960 2.660 2.170 3.246 . 0 0 "[ . 1 . 2]" 1
200 1 49 THR MG 1 54 SER H 3.834 . 5.672 4.227 3.948 4.563 . 0 0 "[ . 1 . 2]" 1
201 1 65 LEU QD 1 66 THR H 4.611 . 7.269 4.037 3.585 4.411 . 0 0 "[ . 1 . 2]" 1
202 1 49 THR MG 1 53 VAL H 4.099 . 6.199 4.989 4.782 5.207 . 0 0 "[ . 1 . 2]" 1
203 1 53 VAL H 1 53 VAL MG2 2.712 . 3.631 2.548 2.410 2.787 . 0 0 "[ . 1 . 2]" 1
204 1 53 VAL H 1 53 VAL HB 2.334 . 3.015 2.499 2.422 2.635 . 0 0 "[ . 1 . 2]" 1
205 1 52 TYR HB3 1 53 VAL H 4.466 . 6.959 4.226 4.003 4.490 . 0 0 "[ . 1 . 2]" 1
206 1 53 VAL H 1 68 GLN QE 3.712 . 5.434 3.996 3.396 4.912 . 0 0 "[ . 1 . 2]" 1
207 1 51 ARG H 1 52 TYR H 3.204 . 4.487 2.880 2.690 2.972 . 0 0 "[ . 1 . 2]" 1
208 1 52 TYR H 1 53 VAL H 2.393 . 3.109 2.484 2.313 2.786 . 0 0 "[ . 1 . 2]" 1
209 1 52 TYR H 1 52 TYR HB3 3.798 . 5.601 3.636 3.578 3.685 . 0 0 "[ . 1 . 2]" 1
210 1 52 TYR H 1 53 VAL HB 4.443 . 6.910 4.670 4.562 4.907 . 0 0 "[ . 1 . 2]" 1
211 1 52 TYR H 1 52 TYR HB2 2.824 . 3.821 2.494 2.387 2.595 . 0 0 "[ . 1 . 2]" 1
212 1 50 THR HA 1 51 ARG H 2.847 . 3.861 2.624 2.566 2.662 . 0 0 "[ . 1 . 2]" 1
213 1 50 THR HB 1 51 ARG H 2.706 . 3.621 2.145 2.044 2.278 . 0 0 "[ . 1 . 2]" 1
214 1 50 THR MG 1 51 ARG H 4.090 . 6.181 3.629 3.230 3.794 . 0 0 "[ . 1 . 2]" 1
215 1 51 ARG H 1 51 ARG HB2 2.844 . 3.855 2.634 2.493 3.616 . 0 0 "[ . 1 . 2]" 1
216 1 50 THR H 1 50 THR HA 2.704 . 3.618 2.867 2.832 2.898 . 0 0 "[ . 1 . 2]" 1
217 1 50 THR H 1 50 THR HB 3.175 . 4.435 3.628 3.527 3.973 . 0 0 "[ . 1 . 2]" 1
218 1 49 THR HA 1 50 THR H 2.133 . 2.702 2.155 2.093 2.579 . 0 0 "[ . 1 . 2]" 1
219 1 50 THR H 1 53 VAL HB 2.197 . 2.801 1.985 1.713 2.235 . 0 0 "[ . 1 . 2]" 1
220 1 49 THR MG 1 50 THR H 3.622 . 5.261 3.768 2.934 4.004 . 0 0 "[ . 1 . 2]" 1
221 1 48 THR MG 1 49 THR H 2.926 . 3.996 3.105 2.503 3.843 . 0 0 "[ . 1 . 2]" 1
222 1 49 THR H 1 49 THR MG 2.721 . 3.646 3.079 2.829 3.217 . 0 0 "[ . 1 . 2]" 1
223 1 49 THR H 1 53 VAL MG2 4.604 . 7.253 6.107 5.678 6.548 . 0 0 "[ . 1 . 2]" 1
224 1 48 THR HB 1 49 THR H 2.909 . 3.967 3.441 1.925 4.086 0.119 15 0 "[ . 1 . 2]" 1
225 1 49 THR H 1 49 THR HA 2.602 . 3.448 2.932 2.913 2.942 . 0 0 "[ . 1 . 2]" 1
226 1 49 THR H 1 49 THR HB 3.513 . 5.056 3.740 3.461 3.835 . 0 0 "[ . 1 . 2]" 1
227 1 48 THR HA 1 49 THR H 2.322 . 2.996 2.472 2.127 2.683 . 0 0 "[ . 1 . 2]" 1
228 1 48 THR H 1 49 THR H 4.430 . 6.883 4.407 4.321 4.524 . 0 0 "[ . 1 . 2]" 1
229 1 49 THR H 1 50 THR H 3.758 . 5.523 4.271 4.184 4.399 . 0 0 "[ . 1 . 2]" 1
230 1 47 PRO HA 1 48 THR H 2.226 . 2.846 2.121 2.086 2.257 . 0 0 "[ . 1 . 2]" 1
231 1 47 PRO HD2 1 48 THR H 4.388 . 6.795 5.671 5.582 5.787 . 0 0 "[ . 1 . 2]" 1
232 1 48 THR H 1 56 MET QG 3.098 . 4.298 3.731 3.093 4.993 0.695 5 1 "[ + 1 . 2]" 1
233 1 47 PRO QG 1 48 THR H 4.598 . 7.241 4.726 4.364 4.820 . 0 0 "[ . 1 . 2]" 1
234 1 47 PRO HB3 1 48 THR H 3.387 . 4.821 3.829 3.491 4.002 . 0 0 "[ . 1 . 2]" 1
235 1 48 THR H 1 49 THR MG 3.951 . 5.903 4.672 4.211 5.305 . 0 0 "[ . 1 . 2]" 1
236 1 48 THR H 1 58 VAL MG2 3.726 . 5.461 4.663 3.850 5.418 . 0 0 "[ . 1 . 2]" 1
237 1 25 GLU H 1 25 GLU HA 2.942 . 4.024 2.823 2.797 2.845 . 0 0 "[ . 1 . 2]" 1
238 1 25 GLU H 1 25 GLU QG 2.503 . 3.286 2.169 1.996 2.596 . 0 0 "[ . 1 . 2]" 1
239 1 118 LEU HA 1 119 VAL H 2.308 . 2.974 2.295 2.118 2.804 . 0 0 "[ . 1 . 2]" 1
240 1 86 ASN H 1 87 GLY H 2.558 . 3.376 2.269 2.034 2.490 . 0 0 "[ . 1 . 2]" 1
241 1 85 ALA HA 1 87 GLY H 3.659 . 5.333 4.221 3.610 5.108 . 0 0 "[ . 1 . 2]" 1
242 1 91 TRP H 1 92 ALA H 4.590 . 7.223 4.296 4.097 4.462 . 0 0 "[ . 1 . 2]" 1
243 1 80 PRO HA 1 91 TRP H 3.292 . 4.646 4.633 4.367 5.056 0.410 14 0 "[ . 1 . 2]" 1
244 1 89 THR H 1 89 THR HA 2.627 . 3.490 2.832 2.271 2.939 . 0 0 "[ . 1 . 2]" 1
245 1 88 VAL HA 1 89 THR H 3.289 . 4.642 2.623 2.135 3.528 . 0 0 "[ . 1 . 2]" 1
246 1 84 ASN HA 1 85 ALA H 3.425 . 4.892 3.490 3.448 3.540 . 0 0 "[ . 1 . 2]" 1
247 1 85 ALA H 1 86 ASN H 2.402 . 3.123 2.545 2.303 2.824 . 0 0 "[ . 1 . 2]" 1
248 1 85 ALA H 1 87 GLY H 3.643 . 5.302 3.771 3.483 4.307 . 0 0 "[ . 1 . 2]" 1
249 1 80 PRO HA 1 81 GLY H 2.636 . 3.505 2.174 2.112 2.293 . 0 0 "[ . 1 . 2]" 1
250 1 79 THR H 1 80 PRO QD 3.862 . 5.726 3.703 3.455 4.061 . 0 0 "[ . 1 . 2]" 1
251 1 79 THR H 1 79 THR HB 2.685 . 3.586 2.672 2.578 2.754 . 0 0 "[ . 1 . 2]" 1
252 1 46 SER H 1 46 SER HB2 2.385 . 3.096 2.881 2.461 3.599 0.503 4 1 "[ +. 1 . 2]" 1
253 1 46 SER H 1 46 SER HB3 3.180 . 4.444 3.163 2.425 3.580 . 0 0 "[ . 1 . 2]" 1
254 1 43 GLY HA2 1 44 ILE H 3.201 . 4.482 3.357 3.177 3.448 . 0 0 "[ . 1 . 2]" 1
255 1 43 GLY HA3 1 44 ILE H 3.382 . 4.812 3.181 3.084 3.360 . 0 0 "[ . 1 . 2]" 1
256 1 44 ILE H 1 44 ILE HA 2.412 . 3.139 2.890 2.841 2.915 . 0 0 "[ . 1 . 2]" 1
257 1 42 ASN H 1 42 ASN HA 2.573 . 3.400 2.264 2.257 2.283 . 0 0 "[ . 1 . 2]" 1
258 1 40 GLY H 1 41 SER H 2.519 . 3.312 2.064 1.879 2.276 . 0 0 "[ . 1 . 2]" 1
259 1 89 THR H 1 89 THR HB 3.151 . 4.392 3.216 2.600 3.812 . 0 0 "[ . 1 . 2]" 1
260 1 44 ILE H 1 44 ILE HB 2.336 . 3.018 2.501 2.387 2.562 . 0 0 "[ . 1 . 2]" 1
261 1 14 LEU H 1 15 GLN H 2.716 . 3.638 2.688 2.641 2.745 . 0 0 "[ . 1 . 2]" 1
262 1 42 ASN H 1 44 ILE H 4.832 . 7.750 4.214 4.047 4.344 . 0 0 "[ . 1 . 2]" 1
263 1 37 CYS HA 1 42 ASN QD 5.367 . 6.808 4.590 3.642 5.577 . 0 0 "[ . 1 . 2]" 1
264 1 42 ASN HA 1 42 ASN QD . . 5.527 3.531 2.799 3.993 . 0 0 "[ . 1 . 2]" 1
265 1 36 THR HB 1 42 ASN QD . . 3.995 3.179 2.176 4.583 0.588 12 1 "[ . 1 + . 2]" 1
266 1 36 THR MG 1 42 ASN QD 5.078 . 6.951 3.474 2.584 4.697 . 0 0 "[ . 1 . 2]" 1
267 1 68 GLN QB 1 68 GLN QE 4.008 . 5.074 3.362 2.704 3.715 . 0 0 "[ . 1 . 2]" 1
268 1 54 SER HA 1 68 GLN QE 4.258 . 5.976 4.924 3.716 7.008 1.032 17 3 "[ . 1 . + *-]" 1
269 1 54 SER QB 1 68 GLN QE 4.447 . 5.950 4.051 2.763 6.624 0.674 17 1 "[ . 1 . + 2]" 1
270 1 52 TYR H 1 68 GLN QE 4.543 . 7.122 5.169 4.020 6.940 . 0 0 "[ . 1 . 2]" 1
271 1 17 PHE QE 1 21 ARG H 4.172 . 6.348 4.960 4.640 5.478 . 0 0 "[ . 1 . 2]" 1
272 1 8 ALA H 1 9 ALA H 2.640 . 3.511 2.758 2.617 2.865 . 0 0 "[ . 1 . 2]" 1
273 1 9 ALA H 1 10 LEU H 2.501 . 3.283 2.619 2.512 2.713 . 0 0 "[ . 1 . 2]" 1
274 1 9 ALA H 1 11 THR H 3.421 . 4.884 3.833 3.716 3.950 . 0 0 "[ . 1 . 2]" 1
275 1 35 ASP H 1 37 CYS H 3.190 . 4.462 4.100 3.927 4.309 . 0 0 "[ . 1 . 2]" 1
276 1 6 ARG HA 1 9 ALA H 2.831 . 3.833 3.298 3.103 3.544 . 0 0 "[ . 1 . 2]" 1
277 1 9 ALA H 1 9 ALA HA 2.687 . 3.589 2.825 2.804 2.845 . 0 0 "[ . 1 . 2]" 1
278 1 9 ALA H 1 9 ALA MB 2.222 . 2.839 2.246 2.236 2.258 . 0 0 "[ . 1 . 2]" 1
279 1 9 ALA H 1 10 LEU QD 3.724 . 5.457 4.458 3.577 4.791 . 0 0 "[ . 1 . 2]" 1
280 1 91 TRP HA 1 92 ALA H 2.537 . 3.341 2.160 2.126 2.215 . 0 0 "[ . 1 . 2]" 1
281 1 80 PRO HA 1 92 ALA H 3.972 . 5.944 3.209 2.362 3.607 . 0 0 "[ . 1 . 2]" 1
282 1 79 THR HB 1 92 ALA H 3.537 . 5.101 3.473 3.031 4.146 . 0 0 "[ . 1 . 2]" 1
283 1 91 TRP HB3 1 92 ALA H 4.426 . 6.874 3.391 3.213 3.479 . 0 0 "[ . 1 . 2]" 1
284 1 91 TRP HB2 1 92 ALA H 3.774 . 5.554 4.262 4.160 4.387 . 0 0 "[ . 1 . 2]" 1
285 1 61 GLY QA 1 63 VAL H 4.766 . 7.605 5.514 5.388 5.612 . 0 0 "[ . 1 . 2]" 1
286 1 63 VAL H 1 77 VAL HA 4.578 . 7.198 4.519 4.162 4.731 . 0 0 "[ . 1 . 2]" 1
287 1 63 VAL H 1 80 PRO QD 3.966 . 5.932 3.391 3.137 3.868 . 0 0 "[ . 1 . 2]" 1
288 1 63 VAL H 1 63 VAL HB 2.902 . 3.955 3.493 2.779 3.894 . 0 0 "[ . 1 . 2]" 1
289 1 63 VAL H 1 80 PRO HG3 4.437 . 6.898 5.138 4.900 5.369 . 0 0 "[ . 1 . 2]" 1
290 1 63 VAL H 1 78 MET QG 4.370 . 6.758 4.050 3.749 4.527 . 0 0 "[ . 1 . 2]" 1
291 1 62 VAL QG 1 63 VAL H . . 3.595 2.423 2.279 3.168 . 0 0 "[ . 1 . 2]" 1
292 1 76 VAL HA 1 78 MET H 4.440 . 6.904 5.526 5.409 5.686 . 0 0 "[ . 1 . 2]" 1
293 1 77 VAL HA 1 78 MET H 2.475 . 3.240 2.144 2.116 2.159 . 0 0 "[ . 1 . 2]" 1
294 1 77 VAL HB 1 78 MET H 4.126 . 6.254 4.354 4.298 4.391 . 0 0 "[ . 1 . 2]" 1
295 1 78 MET H 1 78 MET QG 4.276 . 6.508 4.033 3.976 4.078 . 0 0 "[ . 1 . 2]" 1
296 1 60 LYS H 1 62 VAL QG 4.578 . 7.198 4.915 4.371 5.062 . 0 0 "[ . 1 . 2]" 1
297 1 97 ILE HA 1 98 GLN H 2.716 . 3.638 2.187 2.166 2.223 . 0 0 "[ . 1 . 2]" 1
298 1 97 ILE HB 1 98 GLN H 3.700 . 5.411 4.391 4.288 4.465 . 0 0 "[ . 1 . 2]" 1
299 1 97 ILE HG12 1 98 GLN H 4.367 . 6.751 4.956 4.783 5.094 . 0 0 "[ . 1 . 2]" 1
300 1 97 ILE HG13 1 98 GLN H 3.664 . 5.342 3.557 3.339 3.787 . 0 0 "[ . 1 . 2]" 1
301 1 77 VAL H 1 94 ASN HA 4.535 . 7.106 4.606 4.449 4.771 . 0 0 "[ . 1 . 2]" 1
302 1 76 VAL QG 1 77 VAL H . . 3.641 2.637 2.537 2.802 . 0 0 "[ . 1 . 2]" 1
303 1 77 VAL H 1 94 ASN HB2 3.892 . 5.786 3.995 2.601 4.871 . 0 0 "[ . 1 . 2]" 1
304 1 77 VAL H 1 77 VAL HB 2.631 . 3.496 2.689 2.653 2.748 . 0 0 "[ . 1 . 2]" 1
305 1 77 VAL H 1 93 ARG HB3 4.530 . 7.095 5.495 4.833 6.493 . 0 0 "[ . 1 . 2]" 1
306 1 76 VAL HB 1 77 VAL H 3.852 . 5.706 4.116 4.052 4.180 . 0 0 "[ . 1 . 2]" 1
307 1 77 VAL H 1 77 VAL MG2 2.768 . 3.726 2.653 2.555 2.774 . 0 0 "[ . 1 . 2]" 1
308 1 64 SER HA 1 76 VAL H 4.249 . 6.506 4.575 4.280 4.741 . 0 0 "[ . 1 . 2]" 1
309 1 75 SER HA 1 76 VAL H 2.155 . 2.735 2.146 2.121 2.176 . 0 0 "[ . 1 . 2]" 1
310 1 66 THR HA 1 76 VAL H 3.901 . 5.803 3.469 3.185 3.736 . 0 0 "[ . 1 . 2]" 1
311 1 68 GLN QB 1 76 VAL H 3.708 . 5.426 5.015 4.259 5.587 0.161 13 0 "[ . 1 . 2]" 1
312 1 65 LEU QB 1 76 VAL H 3.212 . 4.501 3.130 2.840 4.527 0.026 14 0 "[ . 1 . 2]" 1
313 1 76 VAL H 1 76 VAL HB 2.576 . 3.405 2.654 2.558 3.114 . 0 0 "[ . 1 . 2]" 1
314 1 66 THR MG 1 76 VAL H 4.641 . 7.334 4.924 4.556 5.283 . 0 0 "[ . 1 . 2]" 1
315 1 65 LEU QD 1 76 VAL H 4.433 . 5.257 3.933 3.615 4.077 . 0 0 "[ . 1 . 2]" 1
316 1 111 PHE HA 1 113 PHE H 4.468 . 6.964 6.139 5.019 6.408 . 0 0 "[ . 1 . 2]" 1
317 1 102 ALA H 1 103 LEU HA 4.108 . 6.218 5.280 5.213 5.308 . 0 0 "[ . 1 . 2]" 1
318 1 44 ILE H 1 45 PRO HD2 4.296 . 6.603 5.160 4.793 5.401 . 0 0 "[ . 1 . 2]" 1
319 1 101 SER HB3 1 102 ALA H 2.946 . 4.030 3.817 2.880 4.097 0.067 20 0 "[ . 1 . 2]" 1
320 1 38 ASP QB 1 44 ILE H 4.487 . 7.004 6.272 5.586 6.733 . 0 0 "[ . 1 . 2]" 1
321 1 102 ALA H 1 102 ALA MB 2.170 . 2.758 2.235 2.228 2.244 . 0 0 "[ . 1 . 2]" 1
322 1 116 ALA H 1 118 LEU QD 5.039 . 8.213 4.815 4.353 5.250 . 0 0 "[ . 1 . 2]" 1
323 1 44 ILE H 1 44 ILE MD 3.636 . 5.289 3.715 3.263 3.837 . 0 0 "[ . 1 . 2]" 1
324 1 44 ILE H 1 44 ILE QG 2.760 . 3.712 2.326 2.225 2.407 . 0 0 "[ . 1 . 2]" 1
325 1 71 LEU HA 1 102 ALA H 4.970 . 8.058 8.611 8.359 8.962 0.904 16 11 "[ - *. *1 ** *+****]" 1
326 1 12 ASP H 1 12 ASP HA 2.706 . 3.621 2.837 2.803 2.860 . 0 0 "[ . 1 . 2]" 1
327 1 11 THR HB 1 12 ASP H 2.730 . 3.661 2.646 2.493 2.741 . 0 0 "[ . 1 . 2]" 1
328 1 8 ALA HA 1 12 ASP H 3.885 . 5.772 3.987 3.735 4.215 . 0 0 "[ . 1 . 2]" 1
329 1 10 LEU HA 1 12 ASP H 3.888 . 5.777 4.261 4.071 4.410 . 0 0 "[ . 1 . 2]" 1
330 1 39 GLY HA2 1 44 ILE H 4.100 . 6.201 5.565 5.387 5.905 . 0 0 "[ . 1 . 2]" 1
331 1 11 THR HA 1 12 ASP H 3.469 . 4.974 3.526 3.501 3.550 . 0 0 "[ . 1 . 2]" 1
332 1 9 ALA HA 1 12 ASP H 3.067 . 4.243 3.358 3.203 3.486 . 0 0 "[ . 1 . 2]" 1
333 1 12 ASP H 1 12 ASP HB2 2.682 . 3.581 2.533 2.235 2.728 . 0 0 "[ . 1 . 2]" 1
334 1 12 ASP H 1 12 ASP HB3 2.428 . 3.165 2.769 2.350 3.599 0.434 17 0 "[ . 1 . 2]" 1
335 1 12 ASP H 1 15 GLN HB2 4.407 . 6.834 5.007 4.776 5.185 . 0 0 "[ . 1 . 2]" 1
336 1 102 ALA H 1 104 GLN HB3 4.210 . 6.426 5.020 4.840 5.199 . 0 0 "[ . 1 . 2]" 1
337 1 116 ALA H 1 118 LEU HG 3.289 . 4.641 4.832 4.203 5.374 0.733 19 4 "[ . * 1 - *. +2]" 1
338 1 8 ALA MB 1 12 ASP H 4.430 . 6.883 4.424 4.283 4.576 . 0 0 "[ . 1 . 2]" 1
339 1 44 ILE H 1 44 ILE MG 3.576 . 5.174 3.779 3.737 3.805 . 0 0 "[ . 1 . 2]" 1
340 1 11 THR MG 1 12 ASP H 3.563 . 5.150 3.565 3.335 3.670 . 0 0 "[ . 1 . 2]" 1
341 1 100 ASP HA 1 102 ALA H 3.883 . 5.768 3.338 3.208 3.529 . 0 0 "[ . 1 . 2]" 1
342 1 114 ASP HA 1 116 ALA H 3.398 . 4.841 3.843 3.433 4.370 . 0 0 "[ . 1 . 2]" 1
343 1 113 PHE QB 1 116 ALA H 4.453 . 6.932 6.190 5.770 6.571 . 0 0 "[ . 1 . 2]" 1
344 1 114 ASP HB2 1 116 ALA H 2.831 . 3.833 3.424 2.526 4.521 0.688 9 1 "[ . +1 . 2]" 1
345 1 116 ALA H 1 116 ALA MB 2.143 . 2.717 2.252 2.230 2.280 . 0 0 "[ . 1 . 2]" 1
346 1 94 ASN HA 1 95 CYS H 2.298 . 2.958 2.163 2.126 2.205 . 0 0 "[ . 1 . 2]" 1
347 1 95 CYS H 1 95 CYS HA 2.884 . 3.924 2.941 2.933 2.950 . 0 0 "[ . 1 . 2]" 1
348 1 28 ALA H 1 28 ALA HA 2.784 . 3.753 2.805 2.733 2.873 . 0 0 "[ . 1 . 2]" 1
349 1 95 CYS H 1 95 CYS QB 2.617 . 3.473 2.466 2.305 2.551 . 0 0 "[ . 1 . 2]" 1
350 1 95 CYS H 1 111 PHE HB2 4.289 . 6.588 5.898 4.921 7.579 0.991 15 2 "[ . 1 - + 2]" 1
351 1 94 ASN HB3 1 95 CYS H 3.851 . 5.705 3.885 3.183 4.343 . 0 0 "[ . 1 . 2]" 1
352 1 26 LEU HB2 1 28 ALA H 4.574 . 7.190 5.079 4.665 5.418 . 0 0 "[ . 1 . 2]" 1
353 1 26 LEU HB3 1 28 ALA H 3.762 . 5.531 5.374 4.959 5.891 0.360 1 0 "[ . 1 . 2]" 1
354 1 28 ALA H 1 34 LEU QD 3.545 . 5.116 3.600 3.132 4.557 . 0 0 "[ . 1 . 2]" 1
355 1 27 CYS HA 1 28 ALA H 3.535 . 5.097 3.516 3.400 3.574 . 0 0 "[ . 1 . 2]" 1
356 1 26 LEU HA 1 28 ALA H 3.816 . 5.636 4.462 3.979 4.999 . 0 0 "[ . 1 . 2]" 1
357 1 28 ALA H 1 34 LEU HA 4.325 . 6.663 4.777 4.018 5.246 . 0 0 "[ . 1 . 2]" 1
358 1 95 CYS H 1 108 GLU HA 3.854 . 5.710 5.160 4.335 7.161 1.451 15 1 "[ . 1 + 2]" 1
359 1 28 ALA H 1 28 ALA MB 2.348 . 3.037 2.244 2.209 2.285 . 0 0 "[ . 1 . 2]" 1
360 1 24 VAL MG1 1 28 ALA H 3.408 . 4.860 3.891 3.652 4.259 . 0 0 "[ . 1 . 2]" 1
361 1 65 LEU H 1 77 VAL HB 4.442 . 6.909 6.237 5.965 6.469 . 0 0 "[ . 1 . 2]" 1
362 1 38 ASP H 1 59 ALA HA 4.851 . 7.792 5.882 5.444 6.136 . 0 0 "[ . 1 . 2]" 1
363 1 38 ASP H 1 42 ASN HA 4.749 . 7.568 6.488 6.062 7.041 . 0 0 "[ . 1 . 2]" 1
364 1 69 GLU H 1 71 LEU HB2 3.863 . 5.728 5.193 5.136 5.308 . 0 0 "[ . 1 . 2]" 1
365 1 68 GLN HA 1 69 GLU H 2.631 . 3.497 2.152 2.121 2.181 . 0 0 "[ . 1 . 2]" 1
366 1 37 CYS HA 1 38 ASP H 2.364 . 3.062 2.470 2.363 2.591 . 0 0 "[ . 1 . 2]" 1
367 1 6 ARG HA 1 8 ALA H 4.087 . 6.175 4.574 4.448 4.739 . 0 0 "[ . 1 . 2]" 1
368 1 69 GLU H 1 69 GLU HA 2.161 . 2.745 2.269 2.258 2.296 . 0 0 "[ . 1 . 2]" 1
369 1 37 CYS QB 1 38 ASP H 4.026 . 5.992 3.908 3.861 4.043 . 0 0 "[ . 1 . 2]" 1
370 1 38 ASP H 1 38 ASP QB 3.076 . 3.599 2.424 2.288 2.565 . 0 0 "[ . 1 . 2]" 1
371 1 69 GLU H 1 69 GLU HB3 3.845 . 5.693 4.029 3.878 4.081 . 0 0 "[ . 1 . 2]" 1
372 1 69 GLU H 1 69 GLU HG3 3.320 . 4.698 3.896 2.738 4.963 0.265 10 0 "[ . 1 . 2]" 1
373 1 38 ASP H 1 44 ILE HB 4.043 . 6.087 4.080 3.560 4.549 . 0 0 "[ . 1 . 2]" 1
374 1 68 GLN QB 1 69 GLU H 3.685 . 5.279 3.784 3.684 3.830 . 0 0 "[ . 1 . 2]" 1
375 1 78 MET HA 1 94 ASN H 3.543 . 5.113 3.730 3.265 3.992 . 0 0 "[ . 1 . 2]" 1
376 1 93 ARG HA 1 94 ASN H 2.282 . 2.933 2.168 2.097 2.266 . 0 0 "[ . 1 . 2]" 1
377 1 4 TYR HA 1 8 ALA H 4.518 . 7.070 4.154 3.636 4.589 . 0 0 "[ . 1 . 2]" 1
378 1 7 LYS HA 1 8 ALA H 3.717 . 5.444 3.596 3.569 3.619 . 0 0 "[ . 1 . 2]" 1
379 1 94 ASN H 1 111 PHE HB2 4.823 . 7.731 5.847 5.159 6.431 . 0 0 "[ . 1 . 2]" 1
380 1 114 ASP H 1 117 ASN HB3 4.699 . 7.459 4.686 2.508 7.179 . 0 0 "[ . 1 . 2]" 1
381 1 94 ASN H 1 94 ASN HB3 2.875 . 3.908 3.171 2.717 3.851 . 0 0 "[ . 1 . 2]" 1
382 1 94 ASN H 1 95 CYS QB 4.845 . 7.780 5.575 4.937 5.947 . 0 0 "[ . 1 . 2]" 1
383 1 94 ASN H 1 94 ASN HB2 3.160 . 4.408 3.035 2.483 3.341 . 0 0 "[ . 1 . 2]" 1
384 1 7 LYS HB2 1 8 ALA H 2.679 . 3.576 2.840 2.396 3.831 0.255 16 0 "[ . 1 . 2]" 1
385 1 7 LYS HD2 1 8 ALA H 4.924 . 7.954 5.386 4.815 6.068 . 0 0 "[ . 1 . 2]" 1
386 1 93 ARG HB3 1 94 ASN H 2.901 . 3.953 3.194 2.762 4.101 0.148 3 0 "[ . 1 . 2]" 1
387 1 5 LEU HB3 1 8 ALA H 3.934 . 5.869 5.407 5.116 5.736 . 0 0 "[ . 1 . 2]" 1
388 1 8 ALA H 1 8 ALA MB 2.379 . 3.087 2.205 2.194 2.216 . 0 0 "[ . 1 . 2]" 1
389 1 8 ALA H 1 9 ALA MB 4.873 . 7.842 4.444 4.306 4.532 . 0 0 "[ . 1 . 2]" 1
390 1 113 PHE HA 1 114 ASP H 2.323 . 2.998 2.132 2.085 2.204 . 0 0 "[ . 1 . 2]" 1
391 1 114 ASP H 1 115 ASP HA 4.120 . 6.242 5.502 5.340 5.638 . 0 0 "[ . 1 . 2]" 1
392 1 114 ASP H 1 116 ALA HA 4.766 . 7.605 7.476 6.890 7.927 0.322 15 0 "[ . 1 . 2]" 1
393 1 113 PHE QB 1 114 ASP H 4.002 . 5.042 3.336 3.131 3.630 . 0 0 "[ . 1 . 2]" 1
394 1 114 ASP H 1 114 ASP HB2 2.663 . 3.549 2.675 2.414 3.643 0.094 2 0 "[ . 1 . 2]" 1
395 1 114 ASP H 1 114 ASP HB3 3.002 . 4.129 3.339 2.525 3.631 . 0 0 "[ . 1 . 2]" 1
396 1 114 ASP H 1 118 LEU HG 3.990 . 5.980 4.961 4.048 5.773 . 0 0 "[ . 1 . 2]" 1
397 1 5 LEU MD2 1 8 ALA H 4.603 . 7.252 4.890 4.513 5.242 . 0 0 "[ . 1 . 2]" 1
398 1 64 SER H 1 65 LEU HA 4.078 . 6.157 5.162 5.090 5.260 . 0 0 "[ . 1 . 2]" 1
399 1 96 ASN HA 1 97 ILE H 2.085 . 2.628 2.153 2.119 2.196 . 0 0 "[ . 1 . 2]" 1
400 1 117 ASN HA 1 119 VAL H 4.372 . 6.761 5.677 4.724 6.782 0.021 5 0 "[ . 1 . 2]" 1
401 1 66 THR HA 1 96 ASN H 4.931 . 7.970 6.883 6.477 7.346 . 0 0 "[ . 1 . 2]" 1
402 1 97 ILE H 1 97 ILE HA 2.743 . 3.683 2.920 2.913 2.928 . 0 0 "[ . 1 . 2]" 1
403 1 119 VAL H 1 120 PRO QD 4.958 . 8.031 4.225 4.095 4.340 . 0 0 "[ . 1 . 2]" 1
404 1 97 ILE H 1 97 ILE HG12 3.913 . 5.827 4.964 4.918 5.008 . 0 0 "[ . 1 . 2]" 1
405 1 74 LEU HB2 1 97 ILE H 4.547 . 7.132 5.407 5.224 5.682 . 0 0 "[ . 1 . 2]" 1
406 1 97 ILE H 1 97 ILE HG13 3.303 . 4.667 4.368 4.294 4.417 . 0 0 "[ . 1 . 2]" 1
407 1 118 LEU QD 1 119 VAL H 5.135 . 8.431 3.650 3.001 4.038 . 0 0 "[ . 1 . 2]" 1
408 1 96 ASN H 1 96 ASN HA 2.738 . 3.675 2.948 2.938 2.952 . 0 0 "[ . 1 . 2]" 1
409 1 95 CYS HA 1 96 ASN H 2.192 . 2.793 2.164 2.136 2.190 . 0 0 "[ . 1 . 2]" 1
410 1 97 ILE H 1 100 ASP HA 4.896 . 7.893 7.938 7.700 8.218 0.325 3 0 "[ . 1 . 2]" 1
411 1 3 ASN HA 1 5 LEU H 3.847 . 5.696 3.774 3.467 4.171 . 0 0 "[ . 1 . 2]" 1
412 1 96 ASN H 1 97 ILE HA 4.232 . 6.471 5.145 5.059 5.206 . 0 0 "[ . 1 . 2]" 1
413 1 4 TYR HA 1 5 LEU H 3.275 . 4.616 3.526 3.491 3.577 . 0 0 "[ . 1 . 2]" 1
414 1 5 LEU H 1 5 LEU HA 2.921 . 3.988 2.848 2.817 2.886 . 0 0 "[ . 1 . 2]" 1
415 1 8 ALA HA 1 9 ALA H 3.022 . 4.163 3.524 3.477 3.549 . 0 0 "[ . 1 . 2]" 1
416 1 5 LEU H 1 6 ARG HA 4.913 . 7.930 5.172 5.034 5.291 . 0 0 "[ . 1 . 2]" 1
417 1 75 SER QB 1 96 ASN H 3.479 . 4.992 3.622 3.425 3.854 . 0 0 "[ . 1 . 2]" 1
418 1 95 CYS QB 1 96 ASN H 4.372 . 4.775 3.428 3.285 3.788 . 0 0 "[ . 1 . 2]" 1
419 1 4 TYR QB 1 5 LEU H 3.161 . 4.410 2.694 2.391 3.486 . 0 0 "[ . 1 . 2]" 1
420 1 94 ASN HB3 1 96 ASN H 3.983 . 5.966 5.214 4.843 5.927 . 0 0 "[ . 1 . 2]" 1
421 1 119 VAL H 1 119 VAL HB 2.543 . 3.351 2.721 2.518 3.055 . 0 0 "[ . 1 . 2]" 1
422 1 9 ALA H 1 10 LEU HB2 5.025 . 8.181 4.743 4.433 4.895 . 0 0 "[ . 1 . 2]" 1
423 1 96 ASN H 1 97 ILE HB 4.365 . 6.747 4.870 4.770 4.945 . 0 0 "[ . 1 . 2]" 1
424 1 5 LEU H 1 5 LEU HB2 2.514 . 3.304 2.446 2.290 2.528 . 0 0 "[ . 1 . 2]" 1
425 1 118 LEU HB3 1 119 VAL H 4.101 . 6.204 3.381 1.697 4.219 0.301 4 0 "[ . 1 . 2]" 1
426 1 64 SER H 1 65 LEU HG 4.230 . 6.466 5.645 4.852 7.154 0.688 1 3 "[+ . 1 * - 2]" 1
427 1 5 LEU H 1 5 LEU HG 2.643 . 3.516 2.498 2.244 4.048 0.532 11 1 "[ . 1+ . 2]" 1
428 1 8 ALA MB 1 9 ALA H 2.548 . 3.360 2.650 2.539 2.830 . 0 0 "[ . 1 . 2]" 1
429 1 66 THR MG 1 96 ASN H 4.619 . 7.286 6.865 6.310 7.618 0.332 10 0 "[ . 1 . 2]" 1
430 1 59 ALA MB 1 64 SER H 4.169 . 6.342 4.847 4.406 5.499 . 0 0 "[ . 1 . 2]" 1
431 1 5 LEU H 1 5 LEU MD2 3.992 . 5.984 3.369 2.256 3.589 . 0 0 "[ . 1 . 2]" 1
432 1 76 VAL QG 1 96 ASN H 3.650 . 5.316 3.931 3.611 4.421 . 0 0 "[ . 1 . 2]" 1
433 1 37 CYS H 1 61 GLY QA 4.549 . 7.136 4.763 4.382 5.021 . 0 0 "[ . 1 . 2]" 1
434 1 69 GLU HB2 1 70 SER H 4.655 . 7.364 2.307 1.991 3.308 . 0 0 "[ . 1 . 2]" 1
435 1 5 LEU H 1 5 LEU HB3 3.517 . 5.063 3.599 3.556 3.626 . 0 0 "[ . 1 . 2]" 1
436 1 34 LEU HB3 1 37 CYS H 3.331 . 4.718 4.105 3.926 4.811 0.093 10 0 "[ . 1 . 2]" 1
437 1 100 ASP HA 1 103 LEU H 4.242 . 6.492 4.292 4.122 4.633 . 0 0 "[ . 1 . 2]" 1
438 1 37 CYS H 1 37 CYS HA 2.886 . 3.927 2.920 2.899 2.941 . 0 0 "[ . 1 . 2]" 1
439 1 36 THR HA 1 37 CYS H 2.932 . 4.007 3.266 3.111 3.350 . 0 0 "[ . 1 . 2]" 1
440 1 73 GLY HA2 1 74 LEU H 3.326 . 4.709 3.415 3.351 3.472 . 0 0 "[ . 1 . 2]" 1
441 1 36 THR HB 1 37 CYS H 3.927 . 5.855 4.245 4.042 4.406 . 0 0 "[ . 1 . 2]" 1
442 1 103 LEU H 1 103 LEU HA 2.606 . 3.455 2.835 2.800 2.859 . 0 0 "[ . 1 . 2]" 1
443 1 7 LYS HA 1 9 ALA H 3.105 . 4.310 4.292 4.066 4.507 0.197 14 0 "[ . 1 . 2]" 1
444 1 67 GLY HA3 1 74 LEU H 4.690 . 7.440 4.453 4.073 5.336 . 0 0 "[ . 1 . 2]" 1
445 1 37 CYS H 1 60 LYS HA 2.746 . 3.689 3.156 2.720 3.375 . 0 0 "[ . 1 . 2]" 1
446 1 37 CYS H 1 37 CYS QB . . 3.231 2.486 2.367 2.583 . 0 0 "[ . 1 . 2]" 1
447 1 100 ASP QB 1 103 LEU H 3.362 . 4.775 2.684 2.439 3.265 . 0 0 "[ . 1 . 2]" 1
448 1 37 CYS H 1 38 ASP QB 3.786 . 5.578 4.557 3.955 5.293 . 0 0 "[ . 1 . 2]" 1
449 1 72 ASN HB3 1 74 LEU H 4.342 . 6.699 4.974 4.865 5.361 . 0 0 "[ . 1 . 2]" 1
450 1 71 LEU HB2 1 74 LEU H 4.021 . 6.042 4.509 4.427 4.591 . 0 0 "[ . 1 . 2]" 1
451 1 71 LEU HB3 1 74 LEU H 3.050 . 4.212 3.924 3.840 3.997 . 0 0 "[ . 1 . 2]" 1
452 1 103 LEU H 1 103 LEU HB2 2.098 . 2.648 2.479 2.438 2.536 . 0 0 "[ . 1 . 2]" 1
453 1 74 LEU H 1 74 LEU HB2 2.552 . 3.366 2.667 2.588 2.768 . 0 0 "[ . 1 . 2]" 1
454 1 71 LEU QD 1 103 LEU H 3.304 . 4.668 4.659 4.299 4.934 0.266 12 0 "[ . 1 . 2]" 1
455 1 34 LEU QD 1 37 CYS H 4.160 . 6.323 4.485 4.157 4.909 . 0 0 "[ . 1 . 2]" 1
456 1 66 THR HA 1 74 LEU H 4.890 . 7.879 5.240 4.879 5.454 . 0 0 "[ . 1 . 2]" 1
457 1 73 GLY HA3 1 74 LEU H 3.122 . 4.340 3.095 3.007 3.182 . 0 0 "[ . 1 . 2]" 1
458 1 35 ASP QB 1 37 CYS H 4.208 . 6.421 4.473 4.356 4.645 . 0 0 "[ . 1 . 2]" 1
459 1 74 LEU H 1 74 LEU HB3 2.299 . 2.960 2.428 2.326 2.492 . 0 0 "[ . 1 . 2]" 1
460 1 104 GLN HB2 1 108 GLU H 4.070 . 6.141 5.395 5.024 6.000 . 0 0 "[ . 1 . 2]" 1
461 1 74 LEU H 1 97 ILE HB 4.138 . 6.278 4.307 4.060 4.436 . 0 0 "[ . 1 . 2]" 1
462 1 106 ALA MB 1 108 GLU H 4.507 . 7.046 4.617 4.445 4.758 . 0 0 "[ . 1 . 2]" 1
463 1 66 THR MG 1 74 LEU H 3.652 . 5.319 4.486 3.854 4.884 . 0 0 "[ . 1 . 2]" 1
464 1 74 LEU H 1 74 LEU QD 3.420 . 4.882 3.700 3.675 3.743 . 0 0 "[ . 1 . 2]" 1
465 1 23 ALA HA 1 24 VAL H 3.293 . 4.649 3.474 3.452 3.497 . 0 0 "[ . 1 . 2]" 1
466 1 107 CYS HA 1 108 GLU H 3.444 . 4.927 3.551 3.511 3.585 . 0 0 "[ . 1 . 2]" 1
467 1 20 TYR HA 1 24 VAL H 3.443 . 4.924 4.510 4.111 5.101 0.177 8 0 "[ . 1 . 2]" 1
468 1 24 VAL H 1 24 VAL HA 2.837 . 3.843 2.848 2.815 2.875 . 0 0 "[ . 1 . 2]" 1
469 1 95 CYS QB 1 108 GLU H 3.521 . 5.071 3.811 3.309 4.767 . 0 0 "[ . 1 . 2]" 1
470 1 104 GLN HA 1 106 ALA H 4.055 . 6.111 4.258 4.058 4.534 . 0 0 "[ . 1 . 2]" 1
471 1 24 VAL H 1 37 CYS QB 4.497 . 7.024 6.108 5.590 7.049 0.025 7 0 "[ . 1 . 2]" 1
472 1 107 CYS HB3 1 108 GLU H 3.821 . 5.646 2.808 2.364 3.926 . 0 0 "[ . 1 . 2]" 1
473 1 24 VAL H 1 24 VAL HB 2.355 . 3.048 2.506 2.461 2.559 . 0 0 "[ . 1 . 2]" 1
474 1 108 GLU H 1 108 GLU QG . . 3.381 3.073 2.156 3.959 0.578 16 9 "[ * *.*- *1 * *+ *2]" 1
475 1 24 VAL H 1 25 GLU QG 4.386 . 6.791 4.132 3.892 4.721 . 0 0 "[ . 1 . 2]" 1
476 1 75 SER H 1 97 ILE HB 3.613 . 5.245 3.910 3.640 4.224 . 0 0 "[ . 1 . 2]" 1
477 1 24 VAL H 1 26 LEU HB2 3.866 . 5.734 4.945 4.577 5.238 . 0 0 "[ . 1 . 2]" 1
478 1 23 ALA MB 1 24 VAL H 2.705 . 3.620 2.556 2.486 2.644 . 0 0 "[ . 1 . 2]" 1
479 1 24 VAL H 1 24 VAL MG2 2.449 . 3.199 2.221 2.093 2.315 . 0 0 "[ . 1 . 2]" 1
480 1 66 THR MG 1 75 SER H 3.379 . 4.806 4.558 3.891 5.260 0.454 13 0 "[ . 1 . 2]" 1
481 1 21 ARG QG 1 24 VAL H 4.793 . 7.664 5.321 5.049 5.667 . 0 0 "[ . 1 . 2]" 1
482 1 74 LEU HB2 1 75 SER H 4.140 . 6.282 4.185 4.086 4.306 . 0 0 "[ . 1 . 2]" 1
483 1 24 VAL H 1 26 LEU QD 3.991 . 5.982 4.962 4.786 5.079 . 0 0 "[ . 1 . 2]" 1
484 1 115 ASP HA 1 118 LEU H 3.767 . 5.541 3.334 2.804 4.135 . 0 0 "[ . 1 . 2]" 1
485 1 71 LEU HA 1 103 LEU H 5.149 . 8.463 6.018 5.785 6.479 . 0 0 "[ . 1 . 2]" 1
486 1 120 PRO HA 1 121 ARG H 2.078 . 2.618 2.174 2.134 2.310 . 0 0 "[ . 1 . 2]" 1
487 1 121 ARG H 1 121 ARG HA 2.741 . 3.680 2.929 2.851 2.949 . 0 0 "[ . 1 . 2]" 1
488 1 106 ALA H 1 106 ALA HA 2.437 . 3.179 2.850 2.829 2.859 . 0 0 "[ . 1 . 2]" 1
489 1 105 GLN HA 1 108 GLU H 3.261 . 4.590 3.990 3.635 4.227 . 0 0 "[ . 1 . 2]" 1
490 1 105 GLN HA 1 106 ALA H 3.331 . 4.718 3.520 3.478 3.556 . 0 0 "[ . 1 . 2]" 1
491 1 108 GLU H 1 108 GLU HA 2.640 . 3.511 2.810 2.761 2.841 . 0 0 "[ . 1 . 2]" 1
492 1 106 ALA H 1 107 CYS HB2 4.463 . 6.952 5.263 4.857 6.266 . 0 0 "[ . 1 . 2]" 1
493 1 104 GLN HA 1 108 GLU H 3.769 . 5.545 3.425 3.106 3.915 . 0 0 "[ . 1 . 2]" 1
494 1 117 ASN HB3 1 118 LEU H 3.890 . 5.782 3.816 2.926 4.355 . 0 0 "[ . 1 . 2]" 1
495 1 117 ASN HB2 1 118 LEU H 3.473 . 4.981 3.866 3.119 4.511 . 0 0 "[ . 1 . 2]" 1
496 1 105 GLN QG 1 106 ALA H 4.564 . 6.486 4.092 3.787 4.245 . 0 0 "[ . 1 . 2]" 1
497 1 120 PRO HB2 1 121 ARG H 3.402 . 4.849 3.469 2.902 3.842 . 0 0 "[ . 1 . 2]" 1
498 1 105 GLN HB2 1 106 ALA H 2.443 . 3.189 2.764 2.422 3.778 0.589 8 1 "[ . + 1 . 2]" 1
499 1 121 ARG H 1 121 ARG HB3 2.732 . 3.665 3.524 2.597 3.882 0.217 11 0 "[ . 1 . 2]" 1
500 1 121 ARG H 1 121 ARG HG2 2.935 . 4.012 3.408 2.230 4.978 0.966 12 3 "[ . * +- . 2]" 1
501 1 101 SER H 1 102 ALA MB 4.935 . 7.979 4.365 4.321 4.393 . 0 0 "[ . 1 . 2]" 1
502 1 106 ALA H 1 106 ALA MB 2.150 . 2.728 2.244 2.238 2.251 . 0 0 "[ . 1 . 2]" 1
503 1 75 SER H 1 97 ILE MG 3.863 . 5.729 4.800 4.611 5.049 . 0 0 "[ . 1 . 2]" 1
504 1 10 LEU QD 1 106 ALA H 3.752 . 5.512 4.574 4.314 5.679 0.167 15 0 "[ . 1 . 2]" 1
505 1 75 SER H 1 76 VAL QG 3.958 . 5.916 4.469 4.318 5.003 . 0 0 "[ . 1 . 2]" 1
506 1 55 ALA H 1 67 GLY HA2 4.834 . 7.755 6.807 5.296 7.454 . 0 0 "[ . 1 . 2]" 1
507 1 55 ALA H 1 65 LEU HA 3.924 . 5.849 4.685 4.392 5.013 . 0 0 "[ . 1 . 2]" 1
508 1 100 ASP HA 1 101 SER H 2.800 . 3.780 2.280 2.177 2.384 . 0 0 "[ . 1 . 2]" 1
509 1 117 ASN HA 1 118 LEU H 2.697 . 3.607 3.262 3.008 3.481 . 0 0 "[ . 1 . 2]" 1
510 1 118 LEU H 1 118 LEU HA 2.742 . 3.682 2.918 2.817 2.945 . 0 0 "[ . 1 . 2]" 1
511 1 21 ARG HA 1 23 ALA H 3.881 . 5.764 4.257 4.018 4.473 . 0 0 "[ . 1 . 2]" 1
512 1 55 ALA H 1 56 MET QG 5.000 . 8.125 4.338 3.508 4.730 . 0 0 "[ . 1 . 2]" 1
513 1 23 ALA H 1 25 GLU QG 3.832 . 5.668 4.953 4.279 5.608 . 0 0 "[ . 1 . 2]" 1
514 1 55 ALA H 1 56 MET HB3 3.731 . 5.471 4.444 4.056 6.184 0.713 5 1 "[ + 1 . 2]" 1
515 1 118 LEU H 1 118 LEU HG 2.448 . 3.197 2.686 2.138 3.140 . 0 0 "[ . 1 . 2]" 1
516 1 55 ALA H 1 55 ALA MB 2.471 . 3.235 2.803 2.638 2.876 . 0 0 "[ . 1 . 2]" 1
517 1 49 THR MG 1 55 ALA H 3.065 . 4.240 3.348 3.061 3.894 . 0 0 "[ . 1 . 2]" 1
518 1 10 LEU QD 1 108 GLU H 4.174 . 6.352 4.898 4.666 5.621 . 0 0 "[ . 1 . 2]" 1
519 1 21 ARG QG 1 23 ALA H 4.672 . 7.401 5.683 5.521 6.024 . 0 0 "[ . 1 . 2]" 1
520 1 49 THR HB 1 55 ALA H 3.843 . 5.689 5.008 4.619 6.171 0.482 19 0 "[ . 1 . 2]" 1
521 1 12 ASP HA 1 14 LEU H 3.863 . 5.729 4.398 4.311 4.526 . 0 0 "[ . 1 . 2]" 1
522 1 23 ALA H 1 23 ALA HA 2.506 . 3.291 2.829 2.811 2.849 . 0 0 "[ . 1 . 2]" 1
523 1 14 LEU H 1 14 LEU HA 2.775 . 3.737 2.807 2.784 2.821 . 0 0 "[ . 1 . 2]" 1
524 1 22 THR HB 1 23 ALA H 2.456 . 3.210 2.555 2.438 2.690 . 0 0 "[ . 1 . 2]" 1
525 1 100 ASP QB 1 101 SER H 4.753 . 7.577 3.794 3.676 3.966 . 0 0 "[ . 1 . 2]" 1
526 1 13 MET HG2 1 14 LEU H 3.032 . 4.181 4.421 2.892 4.741 0.560 4 4 "[ +. * 1- . *]" 1
527 1 55 ALA H 1 68 GLN QB 3.722 . 5.454 4.505 4.018 5.465 0.011 17 0 "[ . 1 . 2]" 1
528 1 14 LEU H 1 14 LEU HB3 2.490 . 3.265 2.513 2.443 2.764 . 0 0 "[ . 1 . 2]" 1
529 1 23 ALA H 1 26 LEU HB2 3.661 . 5.336 5.046 4.623 5.663 0.327 9 0 "[ . 1 . 2]" 1
530 1 23 ALA H 1 23 ALA MB 2.248 . 2.880 2.239 2.230 2.246 . 0 0 "[ . 1 . 2]" 1
531 1 11 THR MG 1 14 LEU H 4.159 . 6.321 4.657 4.571 4.815 . 0 0 "[ . 1 . 2]" 1
532 1 14 LEU H 1 110 VAL MG2 4.124 . 6.250 5.373 4.923 6.298 0.048 19 0 "[ . 1 . 2]" 1
533 1 10 LEU QD 1 14 LEU H 4.176 . 6.356 5.132 4.648 5.491 . 0 0 "[ . 1 . 2]" 1
534 1 14 LEU H 1 14 LEU HB2 2.466 . 3.226 2.479 2.219 2.557 . 0 0 "[ . 1 . 2]" 1
535 1 14 LEU H 1 110 VAL MG1 3.775 . 5.556 3.626 3.312 4.150 . 0 0 "[ . 1 . 2]" 1
536 1 17 PHE HA 1 21 ARG H 4.446 . 6.917 4.530 4.335 4.886 . 0 0 "[ . 1 . 2]" 1
537 1 19 PRO HA 1 21 ARG H 4.137 . 6.276 4.242 4.010 4.422 . 0 0 "[ . 1 . 2]" 1
538 1 14 LEU H 1 17 PHE HB2 4.628 . 7.305 5.343 4.878 5.802 . 0 0 "[ . 1 . 2]" 1
539 1 11 THR HA 1 14 LEU H 3.115 . 4.328 3.388 3.251 3.568 . 0 0 "[ . 1 . 2]" 1
540 1 12 ASP HB2 1 14 LEU H 4.967 . 8.050 5.654 5.045 5.965 . 0 0 "[ . 1 . 2]" 1
541 1 4 TYR H 1 5 LEU HB2 4.805 . 7.691 4.825 4.518 5.003 . 0 0 "[ . 1 . 2]" 1
542 1 21 ARG H 1 23 ALA MB 3.842 . 5.687 4.935 4.753 5.104 . 0 0 "[ . 1 . 2]" 1
543 1 14 LEU H 1 14 LEU HG 4.041 . 6.083 4.469 4.441 4.545 . 0 0 "[ . 1 . 2]" 1
544 1 18 VAL QG 1 21 ARG H 4.072 . 6.145 4.174 4.070 4.255 . 0 0 "[ . 1 . 2]" 1
545 1 77 VAL MG1 1 79 THR H 4.132 . 6.266 3.874 3.704 4.034 . 0 0 "[ . 1 . 2]" 1
546 1 20 TYR HA 1 21 ARG H 3.451 . 4.940 3.478 3.450 3.520 . 0 0 "[ . 1 . 2]" 1
547 1 113 PHE QB 1 115 ASP H 5.023 . 6.217 5.450 4.608 5.817 . 0 0 "[ . 1 . 2]" 1
548 1 18 VAL HA 1 21 ARG H 3.293 . 4.648 3.359 3.126 3.509 . 0 0 "[ . 1 . 2]" 1
549 1 20 TYR HB3 1 21 ARG H 3.740 . 5.489 3.694 3.406 3.874 . 0 0 "[ . 1 . 2]" 1
550 1 114 ASP HB3 1 115 ASP H 3.119 . 4.335 3.248 2.530 4.189 . 0 0 "[ . 1 . 2]" 1
551 1 21 ARG H 1 21 ARG QG 2.479 . 3.247 2.221 2.057 2.433 . 0 0 "[ . 1 . 2]" 1
552 1 115 ASP H 1 118 LEU QD 4.278 . 6.565 4.170 3.588 4.658 . 0 0 "[ . 1 . 2]" 1
553 1 58 VAL H 1 58 VAL MG1 4.700 . 7.462 3.877 3.815 3.924 . 0 0 "[ . 1 . 2]" 1
554 1 77 VAL HA 1 79 THR H 4.906 . 7.915 5.539 5.449 5.708 . 0 0 "[ . 1 . 2]" 1
555 1 114 ASP HA 1 115 ASP H 2.222 . 2.839 2.222 2.120 2.430 . 0 0 "[ . 1 . 2]" 1
556 1 115 ASP H 1 115 ASP HA 2.561 . 3.381 2.814 2.736 2.908 . 0 0 "[ . 1 . 2]" 1
557 1 109 ASP HA 1 112 ARG H 3.702 . 5.415 4.504 3.950 4.729 . 0 0 "[ . 1 . 2]" 1
558 1 115 ASP H 1 116 ALA HA 4.752 . 7.575 5.181 4.801 5.443 . 0 0 "[ . 1 . 2]" 1
559 1 112 ARG H 1 112 ARG HA 2.627 . 3.489 2.773 2.708 2.946 . 0 0 "[ . 1 . 2]" 1
560 1 111 PHE HA 1 112 ARG H 2.376 . 3.082 2.968 2.847 3.444 0.362 16 0 "[ . 1 . 2]" 1
561 1 108 GLU HA 1 112 ARG H 3.635 . 5.287 4.164 3.531 4.600 . 0 0 "[ . 1 . 2]" 1
562 1 111 PHE HB2 1 112 ARG H 3.617 . 5.253 3.973 3.279 4.145 . 0 0 "[ . 1 . 2]" 1
563 1 111 PHE HB3 1 112 ARG H 3.954 . 5.908 4.329 3.880 4.424 . 0 0 "[ . 1 . 2]" 1
564 1 115 ASP H 1 115 ASP HB3 2.369 . 3.070 3.009 2.357 3.629 0.559 17 8 "[ *. ** 1**- . + *]" 1
565 1 112 ARG H 1 112 ARG HB3 2.231 . 2.853 2.576 2.332 3.632 0.779 18 1 "[ . 1 . + 2]" 1
566 1 79 THR H 1 93 ARG HB2 4.808 . 7.697 6.231 5.807 6.508 . 0 0 "[ . 1 . 2]" 1
567 1 78 MET QG 1 79 THR H 4.172 . 5.358 3.216 2.958 3.464 . 0 0 "[ . 1 . 2]" 1
568 1 112 ARG H 1 112 ARG HG2 3.374 . 4.797 2.693 1.959 4.538 . 0 0 "[ . 1 . 2]" 1
569 1 125 LEU H 1 125 LEU HB2 2.372 . 3.075 2.475 2.273 2.582 . 0 0 "[ . 1 . 2]" 1
570 1 79 THR H 1 92 ALA MB 3.029 . 4.176 2.943 2.702 3.491 . 0 0 "[ . 1 . 2]" 1
571 1 62 VAL QG 1 79 THR H 3.760 . 5.527 3.869 3.657 4.506 . 0 0 "[ . 1 . 2]" 1
572 1 125 LEU H 1 125 LEU MD1 4.446 . 6.917 3.627 2.050 3.932 . 0 0 "[ . 1 . 2]" 1
573 1 110 VAL MG1 1 112 ARG H 4.075 . 6.151 4.373 4.172 4.912 . 0 0 "[ . 1 . 2]" 1
574 1 123 SER HA 1 125 LEU H 4.487 . 7.003 3.575 3.305 3.966 . 0 0 "[ . 1 . 2]" 1
575 1 125 LEU H 1 125 LEU HA 2.934 . 4.010 2.909 2.843 2.935 . 0 0 "[ . 1 . 2]" 1
576 1 125 LEU H 1 126 GLU HA 4.112 . 6.225 5.028 4.787 5.355 . 0 0 "[ . 1 . 2]" 1
577 1 125 LEU HA 1 126 GLU H 2.382 . 3.091 2.232 2.121 2.305 . 0 0 "[ . 1 . 2]" 1
578 1 126 GLU H 1 126 GLU HA 2.834 . 3.838 2.902 2.827 2.945 . 0 0 "[ . 1 . 2]" 1
579 1 100 ASP HA 1 104 GLN H 4.600 . 7.245 5.672 5.346 5.921 . 0 0 "[ . 1 . 2]" 1
580 1 12 ASP HA 1 13 MET H 3.509 . 5.048 3.525 3.505 3.557 . 0 0 "[ . 1 . 2]" 1
581 1 103 LEU HA 1 104 GLN H 3.223 . 4.522 3.499 3.481 3.518 . 0 0 "[ . 1 . 2]" 1
582 1 13 MET H 1 13 MET HA 2.758 . 3.708 2.820 2.803 2.842 . 0 0 "[ . 1 . 2]" 1
583 1 9 ALA HA 1 13 MET H 3.768 . 5.542 4.217 4.091 4.356 . 0 0 "[ . 1 . 2]" 1
584 1 12 ASP HB2 1 13 MET H 3.599 . 5.218 3.593 2.640 3.950 . 0 0 "[ . 1 . 2]" 1
585 1 27 CYS H 1 37 CYS QB 4.920 . 7.945 5.335 4.620 5.651 . 0 0 "[ . 1 . 2]" 1
586 1 12 ASP HB3 1 13 MET H 2.729 . 3.660 2.829 2.543 3.577 . 0 0 "[ . 1 . 2]" 1
587 1 104 GLN H 1 105 GLN QG 3.974 . 5.948 4.411 3.923 6.236 0.288 8 0 "[ . 1 . 2]" 1
588 1 104 GLN H 1 104 GLN HB3 2.281 . 2.932 2.437 2.369 2.541 . 0 0 "[ . 1 . 2]" 1
589 1 104 GLN H 1 104 GLN HB2 2.531 . 3.332 2.661 2.585 2.758 . 0 0 "[ . 1 . 2]" 1
590 1 13 MET H 1 14 LEU HB3 4.172 . 6.348 4.796 4.648 5.054 . 0 0 "[ . 1 . 2]" 1
591 1 103 LEU HB2 1 104 GLN H 2.838 . 3.845 2.746 2.614 2.833 . 0 0 "[ . 1 . 2]" 1
592 1 11 THR MG 1 13 MET H 4.168 . 6.339 5.103 4.946 5.231 . 0 0 "[ . 1 . 2]" 1
593 1 74 LEU QD 1 104 GLN H 3.505 . 5.040 3.414 3.202 3.681 . 0 0 "[ . 1 . 2]" 1
594 1 27 CYS H 1 27 CYS HA 2.919 . 3.984 2.830 2.777 2.876 . 0 0 "[ . 1 . 2]" 1
595 1 27 CYS H 1 27 CYS HB3 2.342 . 3.028 2.445 2.250 2.786 . 0 0 "[ . 1 . 2]" 1
596 1 26 LEU HB2 1 27 CYS H 2.537 . 3.342 2.743 2.449 2.907 . 0 0 "[ . 1 . 2]" 1
597 1 26 LEU HB3 1 27 CYS H 3.196 . 4.473 3.226 3.055 3.581 . 0 0 "[ . 1 . 2]" 1
598 1 27 CYS H 1 28 ALA MB 4.091 . 6.183 4.281 4.124 4.512 . 0 0 "[ . 1 . 2]" 1
599 1 85 ALA H 1 86 ASN HA 4.777 . 7.629 5.162 4.996 5.360 . 0 0 "[ . 1 . 2]" 1
600 1 85 ALA H 1 86 ASN QB 5.446 . 6.321 4.593 4.260 4.994 . 0 0 "[ . 1 . 2]" 1
601 1 97 ILE HA 1 100 ASP H 5.110 . 8.375 4.579 4.445 4.824 . 0 0 "[ . 1 . 2]" 1
602 1 99 SER HA 1 100 ASP H 2.864 . 3.889 3.329 3.116 3.461 . 0 0 "[ . 1 . 2]" 1
603 1 100 ASP H 1 100 ASP QB 3.777 . 4.333 2.729 2.639 2.891 . 0 0 "[ . 1 . 2]" 1
604 1 97 ILE HG12 1 100 ASP H 4.057 . 6.114 3.381 2.997 3.732 . 0 0 "[ . 1 . 2]" 1
605 1 97 ILE HG13 1 100 ASP H 2.543 . 3.351 1.957 1.712 2.297 0.023 3 0 "[ . 1 . 2]" 1
606 1 97 ILE MG 1 100 ASP H 3.495 . 5.022 3.477 3.232 3.590 . 0 0 "[ . 1 . 2]" 1
607 1 97 ILE HB 1 100 ASP H 5.087 . 8.322 4.924 4.721 5.224 . 0 0 "[ . 1 . 2]" 1
608 1 3 ASN HA 1 6 ARG H 3.965 . 5.930 3.455 2.912 4.033 . 0 0 "[ . 1 . 2]" 1
609 1 107 CYS HA 1 110 VAL H 3.236 . 4.545 3.649 3.482 3.788 . 0 0 "[ . 1 . 2]" 1
610 1 5 LEU HA 1 6 ARG H 3.478 . 4.990 3.520 3.473 3.561 . 0 0 "[ . 1 . 2]" 1
611 1 110 VAL H 1 111 PHE HB2 4.798 . 7.676 4.586 4.534 4.623 . 0 0 "[ . 1 . 2]" 1
612 1 109 ASP QB 1 110 VAL H 3.849 . 3.876 2.424 2.304 2.644 . 0 0 "[ . 1 . 2]" 1
613 1 10 LEU HB2 1 110 VAL H 4.378 . 6.773 4.963 4.129 5.434 . 0 0 "[ . 1 . 2]" 1
614 1 110 VAL H 1 110 VAL HB 2.436 . 3.177 2.473 2.443 2.530 . 0 0 "[ . 1 . 2]" 1
615 1 5 LEU HB2 1 6 ARG H 2.545 . 3.354 2.612 2.441 2.827 . 0 0 "[ . 1 . 2]" 1
616 1 6 ARG H 1 6 ARG HG2 3.562 . 5.148 4.389 4.267 4.594 . 0 0 "[ . 1 . 2]" 1
617 1 6 ARG H 1 6 ARG HG3 4.056 . 6.112 4.481 4.447 4.543 . 0 0 "[ . 1 . 2]" 1
618 1 88 VAL QG 1 89 THR H 4.023 . 4.698 3.128 2.109 3.771 . 0 0 "[ . 1 . 2]" 1
619 1 110 VAL H 1 110 VAL MG2 2.553 . 3.368 2.319 2.255 2.402 . 0 0 "[ . 1 . 2]" 1
620 1 10 LEU QD 1 110 VAL H 3.541 . 5.108 3.949 3.499 4.244 . 0 0 "[ . 1 . 2]" 1
621 1 14 LEU QD 1 110 VAL H 4.632 . 7.314 5.452 5.141 6.112 . 0 0 "[ . 1 . 2]" 1
622 1 110 VAL H 1 110 VAL MG1 3.794 . 5.593 3.773 3.762 3.794 . 0 0 "[ . 1 . 2]" 1
623 1 109 ASP HA 1 110 VAL H 3.560 . 5.144 3.557 3.531 3.582 . 0 0 "[ . 1 . 2]" 1
624 1 18 VAL H 1 19 PRO HD2 2.767 . 3.724 2.780 2.550 2.942 . 0 0 "[ . 1 . 2]" 1
625 1 18 VAL H 1 19 PRO HD3 3.064 . 4.238 2.992 2.890 3.108 . 0 0 "[ . 1 . 2]" 1
626 1 18 VAL H 1 20 TYR HB2 4.157 . 6.317 5.154 4.851 5.349 . 0 0 "[ . 1 . 2]" 1
627 1 18 VAL H 1 21 ARG QD 3.810 . 5.624 4.971 4.196 6.363 0.739 3 2 "[ + . 1 - . 2]" 1
628 1 18 VAL H 1 18 VAL HB 2.396 . 3.114 2.546 2.502 2.597 . 0 0 "[ . 1 . 2]" 1
629 1 18 VAL H 1 19 PRO HG3 5.363 . 8.958 5.201 5.095 5.294 . 0 0 "[ . 1 . 2]" 1
630 1 18 VAL H 1 19 PRO HG2 4.577 . 7.195 4.953 4.754 5.060 . 0 0 "[ . 1 . 2]" 1
631 1 7 LYS HD3 1 110 VAL H 4.423 . 6.868 5.495 4.446 7.531 0.663 18 1 "[ . 1 . + 2]" 1
632 1 106 ALA MB 1 110 VAL H 4.119 . 6.240 5.077 4.643 5.354 . 0 0 "[ . 1 . 2]" 1
633 1 10 LEU HB3 1 110 VAL H 3.890 . 5.782 4.894 4.425 5.445 . 0 0 "[ . 1 . 2]" 1
634 1 22 THR HA 1 26 LEU H 3.738 . 5.485 3.998 3.721 4.486 . 0 0 "[ . 1 . 2]" 1
635 1 24 VAL HA 1 26 LEU H 4.106 . 6.214 4.425 4.183 4.596 . 0 0 "[ . 1 . 2]" 1
636 1 16 THR MG 1 17 PHE H 3.540 . 5.106 3.757 3.670 3.957 . 0 0 "[ . 1 . 2]" 1
637 1 26 LEU H 1 26 LEU QD 3.353 . 4.758 2.551 2.269 3.200 . 0 0 "[ . 1 . 2]" 1
638 1 14 LEU QD 1 17 PHE H 4.456 . 6.938 4.356 3.892 4.523 . 0 0 "[ . 1 . 2]" 1
639 1 93 ARG H 1 94 ASN HA 4.048 . 6.096 5.084 4.977 5.158 . 0 0 "[ . 1 . 2]" 1
640 1 16 THR HB 1 17 PHE H 2.856 . 3.876 2.835 2.669 3.023 . 0 0 "[ . 1 . 2]" 1
641 1 17 PHE H 1 17 PHE HA 2.889 . 3.932 2.841 2.824 2.847 . 0 0 "[ . 1 . 2]" 1
642 1 12 ASP HA 1 17 PHE H 5.005 . 8.136 6.405 6.132 6.711 . 0 0 "[ . 1 . 2]" 1
643 1 26 LEU H 1 26 LEU HA 2.631 . 3.497 2.812 2.795 2.831 . 0 0 "[ . 1 . 2]" 1
644 1 18 VAL H 1 19 PRO HA 4.311 . 6.634 5.676 5.584 5.723 . 0 0 "[ . 1 . 2]" 1
645 1 25 GLU HA 1 26 LEU H 3.459 . 4.955 3.530 3.504 3.548 . 0 0 "[ . 1 . 2]" 1
646 1 17 PHE H 1 17 PHE HB2 2.615 . 3.470 2.571 2.454 2.671 . 0 0 "[ . 1 . 2]" 1
647 1 26 LEU H 1 26 LEU HB2 2.144 . 2.719 2.220 2.122 2.494 . 0 0 "[ . 1 . 2]" 1
648 1 93 ARG H 1 93 ARG HB2 2.636 . 3.505 2.629 2.471 3.761 0.256 3 0 "[ . 1 . 2]" 1
649 1 26 LEU H 1 26 LEU HB3 3.415 . 4.873 3.495 3.427 3.587 . 0 0 "[ . 1 . 2]" 1
650 1 23 ALA MB 1 26 LEU H 4.732 . 7.531 4.688 4.478 5.005 . 0 0 "[ . 1 . 2]" 1
651 1 7 LYS H 1 10 LEU HB3 4.508 . 7.048 6.933 6.669 7.675 0.627 4 1 "[ +. 1 . 2]" 1
652 1 24 VAL MG1 1 25 GLU H 3.404 . 4.852 3.382 3.213 3.540 . 0 0 "[ . 1 . 2]" 1
653 1 48 THR H 1 49 THR HA 4.475 . 6.978 4.822 4.586 5.151 . 0 0 "[ . 1 . 2]" 1
654 1 5 LEU HA 1 7 LYS H 3.740 . 5.488 4.256 4.138 4.398 . 0 0 "[ . 1 . 2]" 1
655 1 21 ARG HA 1 25 GLU H 3.722 . 5.453 3.938 3.516 4.080 . 0 0 "[ . 1 . 2]" 1
656 1 3 ASN HA 1 7 LYS H 4.296 . 6.603 4.429 3.902 4.893 . 0 0 "[ . 1 . 2]" 1
657 1 25 GLU H 1 26 LEU HB2 4.338 . 6.690 4.543 4.400 4.874 . 0 0 "[ . 1 . 2]" 1
658 1 6 ARG HG3 1 7 LYS H 4.168 . 6.340 4.516 4.012 4.790 . 0 0 "[ . 1 . 2]" 1
659 1 7 LYS H 1 10 LEU QD 4.352 . 6.719 4.232 3.744 4.535 . 0 0 "[ . 1 . 2]" 1
660 1 4 TYR HA 1 7 LYS H 3.745 . 5.498 3.332 3.168 3.560 . 0 0 "[ . 1 . 2]" 1
661 1 7 LYS H 1 7 LYS HA 2.775 . 3.737 2.794 2.776 2.821 . 0 0 "[ . 1 . 2]" 1
662 1 6 ARG HG2 1 7 LYS H 2.948 . 4.034 3.730 3.207 4.770 0.736 15 1 "[ . 1 + 2]" 1
663 1 28 ALA MB 1 30 GLU H 4.773 . 7.620 4.486 4.214 4.899 . 0 0 "[ . 1 . 2]" 1
664 1 49 THR HA 1 51 ARG H 4.974 . 8.067 6.376 6.323 6.609 . 0 0 "[ . 1 . 2]" 1
665 1 29 LEU HA 1 30 GLU H 3.336 . 4.727 3.464 3.378 3.567 . 0 0 "[ . 1 . 2]" 1
666 1 106 ALA HA 1 107 CYS H 3.216 . 4.509 3.545 3.519 3.568 . 0 0 "[ . 1 . 2]" 1
667 1 107 CYS H 1 107 CYS HA 2.799 . 3.778 2.830 2.806 2.847 . 0 0 "[ . 1 . 2]" 1
668 1 105 GLN HA 1 107 CYS H 4.080 . 6.161 4.676 4.464 4.757 . 0 0 "[ . 1 . 2]" 1
669 1 107 CYS H 1 107 CYS HB2 2.473 . 3.238 2.824 2.468 3.623 0.385 15 0 "[ . 1 . 2]" 1
670 1 107 CYS H 1 111 PHE HB2 4.213 . 6.432 6.140 5.544 6.727 0.295 18 0 "[ . 1 . 2]" 1
671 1 29 LEU HB2 1 30 GLU H 2.774 . 3.736 3.409 2.522 4.159 0.423 11 0 "[ . 1 . 2]" 1
672 1 29 LEU HB3 1 30 GLU H 2.593 . 3.433 3.378 2.498 4.067 0.634 9 2 "[ . +1 . -2]" 1
673 1 51 ARG H 1 51 ARG HB3 3.119 . 4.335 2.473 2.333 2.562 . 0 0 "[ . 1 . 2]" 1
674 1 51 ARG H 1 51 ARG QG 3.673 . 5.359 3.944 3.141 4.046 . 0 0 "[ . 1 . 2]" 1
675 1 71 LEU QD 1 107 CYS H 3.515 . 5.059 3.080 2.718 3.479 . 0 0 "[ . 1 . 2]" 1
676 1 10 LEU HA 1 107 CYS H 4.923 . 7.953 8.299 7.795 9.405 1.452 15 1 "[ . 1 + 2]" 1
677 1 104 GLN HA 1 107 CYS H 3.527 . 5.082 3.328 3.154 3.510 . 0 0 "[ . 1 . 2]" 1
678 1 107 CYS H 1 107 CYS HB3 2.717 . 3.640 2.516 2.178 2.647 . 0 0 "[ . 1 . 2]" 1
679 1 95 CYS QB 1 107 CYS H 4.586 . 7.215 4.781 4.425 5.448 . 0 0 "[ . 1 . 2]" 1
680 1 103 LEU HB3 1 107 CYS H 3.665 . 5.344 4.885 4.540 5.226 . 0 0 "[ . 1 . 2]" 1
681 1 105 GLN HB2 1 107 CYS H 4.628 . 7.305 5.160 4.928 5.848 . 0 0 "[ . 1 . 2]" 1
682 1 30 GLU H 1 30 GLU HG2 5.003 . 8.132 4.518 4.397 4.632 . 0 0 "[ . 1 . 2]" 1
683 1 16 THR H 1 16 THR HB 2.469 . 3.231 2.570 2.532 2.635 . 0 0 "[ . 1 . 2]" 1
684 1 28 ALA HA 1 30 GLU H 3.656 . 5.327 4.308 3.963 4.983 . 0 0 "[ . 1 . 2]" 1
685 1 16 THR H 1 17 PHE HB2 4.690 . 7.439 4.781 4.597 4.939 . 0 0 "[ . 1 . 2]" 1
686 1 16 THR H 1 17 PHE HB3 4.963 . 8.042 4.695 4.570 4.875 . 0 0 "[ . 1 . 2]" 1
687 1 15 GLN HB2 1 16 THR H 2.854 . 3.872 2.954 2.695 3.972 0.100 18 0 "[ . 1 . 2]" 1
688 1 15 GLN HB3 1 16 THR H 3.532 . 5.091 3.734 2.829 3.902 . 0 0 "[ . 1 . 2]" 1
689 1 10 LEU H 1 10 LEU HB2 3.427 . 4.895 2.472 2.212 2.564 . 0 0 "[ . 1 . 2]" 1
690 1 16 THR H 1 18 VAL QG 4.452 . 6.929 4.469 4.322 4.742 . 0 0 "[ . 1 . 2]" 1
691 1 10 LEU H 1 11 THR HB 4.968 . 8.053 4.810 4.671 4.931 . 0 0 "[ . 1 . 2]" 1
692 1 29 LEU H 1 29 LEU HA 2.990 . 4.107 2.878 2.837 2.891 . 0 0 "[ . 1 . 2]" 1
693 1 10 LEU H 1 10 LEU HA 2.792 . 3.767 2.833 2.813 2.843 . 0 0 "[ . 1 . 2]" 1
694 1 109 ASP H 1 109 ASP QB 2.417 . 3.147 2.256 2.177 2.289 . 0 0 "[ . 1 . 2]" 1
695 1 10 LEU H 1 10 LEU HG 2.515 . 3.306 2.562 2.072 4.188 0.882 17 4 "[ -. *1 . + *]" 1
696 1 6 ARG HG3 1 10 LEU H 4.092 . 6.185 4.505 4.006 5.076 . 0 0 "[ . 1 . 2]" 1
697 1 10 LEU H 1 10 LEU HB3 2.646 . 3.521 3.575 3.505 3.612 0.091 4 0 "[ . 1 . 2]" 1
698 1 16 THR H 1 16 THR MG 3.664 . 5.342 3.775 3.765 3.782 . 0 0 "[ . 1 . 2]" 1
699 1 10 LEU H 1 110 VAL MG2 4.398 . 6.816 3.933 3.576 4.185 . 0 0 "[ . 1 . 2]" 1
700 1 10 LEU H 1 10 LEU QD 2.892 . 3.938 2.812 1.899 3.136 . 0 0 "[ . 1 . 2]" 1
701 1 10 LEU H 1 110 VAL MG1 4.502 . 7.036 4.824 4.155 5.166 . 0 0 "[ . 1 . 2]" 1
702 1 68 GLN HA 1 71 LEU H 4.186 . 6.376 4.984 4.848 5.140 . 0 0 "[ . 1 . 2]" 1
703 1 15 GLN H 1 16 THR HB 4.826 . 7.737 4.956 4.852 5.043 . 0 0 "[ . 1 . 2]" 1
704 1 109 ASP H 1 109 ASP HA 2.618 . 3.475 2.835 2.807 2.857 . 0 0 "[ . 1 . 2]" 1
705 1 28 ALA HA 1 34 LEU H 4.156 . 6.315 4.449 3.982 4.894 . 0 0 "[ . 1 . 2]" 1
706 1 8 ALA HA 1 10 LEU H 3.819 . 5.643 4.423 4.309 4.541 . 0 0 "[ . 1 . 2]" 1
707 1 108 GLU HA 1 109 ASP H 3.262 . 4.592 3.458 3.440 3.495 . 0 0 "[ . 1 . 2]" 1
708 1 95 CYS QB 1 109 ASP H 4.555 . 7.149 5.972 5.399 7.086 . 0 0 "[ . 1 . 2]" 1
709 1 69 GLU HG3 1 71 LEU H 4.604 . 7.253 5.374 4.961 5.728 . 0 0 "[ . 1 . 2]" 1
710 1 91 TRP H 1 92 ALA MB 4.404 . 6.829 5.211 4.878 5.470 . 0 0 "[ . 1 . 2]" 1
711 1 109 ASP H 1 110 VAL MG2 4.036 . 6.072 4.302 4.134 4.465 . 0 0 "[ . 1 . 2]" 1
712 1 27 CYS HA 1 29 LEU H 3.893 . 5.787 4.185 3.891 4.565 . 0 0 "[ . 1 . 2]" 1
713 1 70 SER QB 1 71 LEU H 3.291 . 4.645 3.206 3.168 3.255 . 0 0 "[ . 1 . 2]" 1
714 1 11 THR HA 1 15 GLN H 3.816 . 5.637 4.050 3.920 4.168 . 0 0 "[ . 1 . 2]" 1
715 1 104 GLN HA 1 109 ASP H 4.897 . 7.894 5.877 5.455 6.345 . 0 0 "[ . 1 . 2]" 1
716 1 71 LEU H 1 72 ASN HB2 3.875 . 5.752 5.120 4.758 6.449 0.697 20 2 "[ -. 1 . +]" 1
717 1 109 ASP QB 1 111 PHE H 4.566 . 7.172 4.615 4.465 4.862 . 0 0 "[ . 1 . 2]" 1
718 1 71 LEU H 1 71 LEU HB2 2.767 . 3.724 2.546 2.503 2.592 . 0 0 "[ . 1 . 2]" 1
719 1 72 ASN H 1 103 LEU HB2 4.473 . 6.973 6.417 6.050 6.780 . 0 0 "[ . 1 . 2]" 1
720 1 14 LEU HG 1 15 GLN H 3.532 . 5.091 3.937 3.661 4.899 . 0 0 "[ . 1 . 2]" 1
721 1 11 THR MG 1 15 GLN H 3.781 . 5.568 3.930 3.832 4.094 . 0 0 "[ . 1 . 2]" 1
722 1 15 GLN H 1 18 VAL QG 4.268 . 6.545 4.152 3.924 4.482 . 0 0 "[ . 1 . 2]" 1
723 1 109 ASP HA 1 111 PHE H 4.613 . 7.273 4.965 4.715 5.159 . 0 0 "[ . 1 . 2]" 1
724 1 12 ASP HA 1 15 GLN H 3.231 . 4.536 3.228 3.016 3.380 . 0 0 "[ . 1 . 2]" 1
725 1 70 SER HA 1 71 LEU H 3.220 . 4.516 3.351 3.333 3.364 . 0 0 "[ . 1 . 2]" 1
726 1 111 PHE H 1 111 PHE HA 2.794 . 3.770 2.891 2.844 2.917 . 0 0 "[ . 1 . 2]" 1
727 1 15 GLN H 1 15 GLN HA 2.604 . 3.451 2.821 2.804 2.834 . 0 0 "[ . 1 . 2]" 1
728 1 13 MET HA 1 15 GLN H 3.987 . 5.974 4.382 4.251 4.556 . 0 0 "[ . 1 . 2]" 1
729 1 15 GLN H 1 15 GLN HB2 2.366 . 3.066 2.423 2.312 2.506 . 0 0 "[ . 1 . 2]" 1
730 1 69 GLU HB2 1 72 ASN H 4.390 . 6.799 6.037 5.736 6.903 0.104 10 0 "[ . 1 . 2]" 1
731 1 15 GLN H 1 15 GLN HB3 3.369 . 4.788 3.536 2.549 3.608 . 0 0 "[ . 1 . 2]" 1
732 1 71 LEU HB2 1 72 ASN H 3.842 . 5.687 4.160 4.122 4.201 . 0 0 "[ . 1 . 2]" 1
733 1 14 LEU HB3 1 15 GLN H 2.698 . 3.608 2.541 2.418 2.617 . 0 0 "[ . 1 . 2]" 1
734 1 111 PHE H 1 112 ARG HB3 4.446 . 6.917 4.864 4.600 6.054 . 0 0 "[ . 1 . 2]" 1
735 1 29 LEU H 1 29 LEU HB3 2.874 . 3.906 3.108 2.465 3.614 . 0 0 "[ . 1 . 2]" 1
736 1 71 LEU HB3 1 72 ASN H 4.144 . 6.291 4.460 4.430 4.476 . 0 0 "[ . 1 . 2]" 1
737 1 111 PHE H 1 112 ARG HG2 5.108 . 8.369 5.301 4.501 7.082 . 0 0 "[ . 1 . 2]" 1
738 1 34 LEU H 1 34 LEU HB3 3.389 . 4.825 3.579 3.549 3.627 . 0 0 "[ . 1 . 2]" 1
739 1 71 LEU H 1 71 LEU HG 2.857 . 3.877 2.322 2.227 2.444 . 0 0 "[ . 1 . 2]" 1
740 1 71 LEU H 1 71 LEU QD 4.182 . 6.368 3.054 2.983 3.121 . 0 0 "[ . 1 . 2]" 1
741 1 14 LEU QD 1 15 GLN H 3.442 . 4.923 3.744 3.229 3.894 . 0 0 "[ . 1 . 2]" 1
742 1 67 GLY HA2 1 71 LEU H 4.127 . 6.256 5.015 4.476 5.419 . 0 0 "[ . 1 . 2]" 1
743 1 70 SER QB 1 72 ASN H 4.497 . 7.025 4.420 4.161 4.645 . 0 0 "[ . 1 . 2]" 1
744 1 111 PHE H 1 111 PHE HB2 2.796 . 3.773 2.400 2.264 2.455 . 0 0 "[ . 1 . 2]" 1
745 1 111 PHE H 1 111 PHE HB3 3.370 . 4.789 3.612 3.544 3.651 . 0 0 "[ . 1 . 2]" 1
746 1 110 VAL HB 1 111 PHE H 2.776 . 3.739 2.522 2.427 2.740 . 0 0 "[ . 1 . 2]" 1
747 1 110 VAL MG2 1 111 PHE H 4.088 . 6.177 3.796 3.695 3.936 . 0 0 "[ . 1 . 2]" 1
748 1 14 LEU QD 1 111 PHE H 4.238 . 6.483 4.391 3.987 4.822 . 0 0 "[ . 1 . 2]" 1
749 1 110 VAL MG1 1 111 PHE H 3.596 . 5.213 3.327 3.236 3.503 . 0 0 "[ . 1 . 2]" 1
750 1 41 SER HA 1 42 ASN H 2.723 . 3.650 2.391 2.261 2.534 . 0 0 "[ . 1 . 2]" 1
751 1 104 GLN HA 1 105 GLN H 3.397 . 4.839 3.524 3.504 3.540 . 0 0 "[ . 1 . 2]" 1
752 1 105 GLN H 1 109 ASP QB 4.448 . 6.921 6.312 5.942 6.913 . 0 0 "[ . 1 . 2]" 1
753 1 102 ALA MB 1 105 GLN H 4.102 . 6.206 4.510 4.337 4.680 . 0 0 "[ . 1 . 2]" 1
754 1 41 SER HB2 1 42 ASN H 3.659 . 5.332 3.208 2.253 4.054 . 0 0 "[ . 1 . 2]" 1
755 1 42 ASN H 1 42 ASN QB 4.483 . 5.440 3.257 2.909 3.386 . 0 0 "[ . 1 . 2]" 1
756 1 35 ASP H 1 61 GLY QA 4.655 . 7.363 6.124 5.573 6.866 . 0 0 "[ . 1 . 2]" 1
757 1 34 LEU HA 1 35 ASP H 2.954 . 4.044 3.283 3.229 3.439 . 0 0 "[ . 1 . 2]" 1
758 1 35 ASP H 1 60 LYS HA 4.257 . 6.523 4.894 4.520 5.213 . 0 0 "[ . 1 . 2]" 1
759 1 71 LEU H 1 72 ASN HB3 4.524 . 7.083 5.586 4.954 5.853 . 0 0 "[ . 1 . 2]" 1
760 1 68 GLN QB 1 71 LEU H 3.883 . 5.768 4.315 3.920 4.604 . 0 0 "[ . 1 . 2]" 1
761 1 34 LEU HB3 1 35 ASP H 3.725 . 5.459 4.142 3.791 4.276 . 0 0 "[ . 1 . 2]" 1
762 1 34 LEU HB2 1 35 ASP H 3.169 . 4.424 3.432 2.832 3.555 . 0 0 "[ . 1 . 2]" 1
763 1 34 LEU QD 1 35 ASP H 4.729 . 7.524 4.353 3.968 4.452 . 0 0 "[ . 1 . 2]" 1
764 1 17 PHE HA 1 20 TYR H 3.820 . 5.644 3.437 3.321 3.586 . 0 0 "[ . 1 . 2]" 1
765 1 19 PRO HD2 1 20 TYR H 2.826 . 3.825 2.861 2.636 3.036 . 0 0 "[ . 1 . 2]" 1
766 1 19 PRO HD3 1 20 TYR H 3.936 . 5.872 4.071 3.919 4.218 . 0 0 "[ . 1 . 2]" 1
767 1 20 TYR H 1 20 TYR HB2 2.739 . 3.676 2.343 2.264 2.415 . 0 0 "[ . 1 . 2]" 1
768 1 20 TYR H 1 20 TYR HB3 3.974 . 5.948 3.579 3.544 3.604 . 0 0 "[ . 1 . 2]" 1
769 1 19 PRO HB3 1 20 TYR H 4.315 . 6.642 4.136 3.918 4.288 . 0 0 "[ . 1 . 2]" 1
770 1 19 PRO HG3 1 20 TYR H 4.141 . 6.285 4.677 4.550 4.801 . 0 0 "[ . 1 . 2]" 1
771 1 20 TYR H 1 21 ARG QG 3.599 . 5.218 3.930 3.571 4.276 . 0 0 "[ . 1 . 2]" 1
772 1 18 VAL QG 1 20 TYR H 3.854 . 5.710 4.422 4.220 4.637 . 0 0 "[ . 1 . 2]" 1
773 1 16 THR HA 1 20 TYR H 4.648 . 7.349 5.415 4.805 5.804 . 0 0 "[ . 1 . 2]" 1
774 1 17 PHE HB3 1 20 TYR H 4.562 . 7.164 5.457 5.250 5.663 . 0 0 "[ . 1 . 2]" 1
775 1 115 ASP HA 1 117 ASN H 3.817 . 5.639 3.817 3.409 4.488 . 0 0 "[ . 1 . 2]" 1
776 1 117 ASN H 1 117 ASN HA 2.619 . 3.476 2.917 2.879 2.943 . 0 0 "[ . 1 . 2]" 1
777 1 45 PRO HA 1 46 SER H 3.120 . 4.337 2.279 2.150 2.433 . 0 0 "[ . 1 . 2]" 1
778 1 116 ALA HA 1 117 ASN H 2.707 . 3.623 3.452 3.376 3.560 . 0 0 "[ . 1 . 2]" 1
779 1 46 SER H 1 47 PRO HD3 4.108 . 6.218 5.050 4.865 5.277 . 0 0 "[ . 1 . 2]" 1
780 1 113 PHE QB 1 117 ASN H 4.237 . 6.481 5.255 4.189 6.595 0.114 2 0 "[ . 1 . 2]" 1
781 1 114 ASP HB3 1 117 ASN H 4.820 . 7.724 3.857 2.807 5.012 . 0 0 "[ . 1 . 2]" 1
782 1 45 PRO QB 1 46 SER H 2.899 . 3.949 2.828 2.529 3.141 . 0 0 "[ . 1 . 2]" 1
783 1 56 MET H 1 65 LEU QB 4.615 . 7.278 5.738 4.669 6.479 . 0 0 "[ . 1 . 2]" 1
784 1 117 ASN H 1 118 LEU HA 3.957 . 5.914 4.884 4.673 5.072 . 0 0 "[ . 1 . 2]" 1
785 1 117 ASN H 1 117 ASN HB3 3.184 . 4.451 3.144 2.411 3.684 . 0 0 "[ . 1 . 2]" 1
786 1 117 ASN H 1 118 LEU HG 3.839 . 5.681 3.634 3.218 4.017 . 0 0 "[ . 1 . 2]" 1
787 1 41 SER H 1 41 SER HA 2.732 . 3.665 2.915 2.897 2.942 . 0 0 "[ . 1 . 2]" 1
788 1 41 SER H 1 42 ASN HA 4.368 . 6.753 5.922 5.866 6.011 . 0 0 "[ . 1 . 2]" 1
789 1 11 THR H 1 11 THR HB 2.438 . 3.181 2.567 2.477 2.626 . 0 0 "[ . 1 . 2]" 1
790 1 8 ALA HA 1 11 THR H 3.129 . 4.353 3.183 2.966 3.404 . 0 0 "[ . 1 . 2]" 1
791 1 38 ASP QB 1 41 SER H 4.855 . 5.266 3.828 3.364 4.273 . 0 0 "[ . 1 . 2]" 1
792 1 11 THR H 1 12 ASP HB3 4.437 . 6.898 5.151 4.575 6.257 . 0 0 "[ . 1 . 2]" 1
793 1 41 SER H 1 44 ILE HB 2.319 . 2.992 2.914 2.605 3.167 0.175 18 0 "[ . 1 . 2]" 1
794 1 10 LEU HB2 1 11 THR H 3.442 . 4.923 2.707 2.597 2.839 . 0 0 "[ . 1 . 2]" 1
795 1 10 LEU HG 1 11 THR H 4.050 . 6.100 4.424 4.126 5.316 . 0 0 "[ . 1 . 2]" 1
796 1 8 ALA MB 1 11 THR H 4.070 . 6.141 4.378 4.223 4.550 . 0 0 "[ . 1 . 2]" 1
797 1 73 GLY H 1 97 ILE MD 4.258 . 6.525 4.537 4.255 4.811 . 0 0 "[ . 1 . 2]" 1
798 1 10 LEU QD 1 11 THR H 3.947 . 5.895 4.022 3.680 4.135 . 0 0 "[ . 1 . 2]" 1
799 1 11 THR H 1 110 VAL MG1 3.735 . 5.479 3.344 2.805 3.664 . 0 0 "[ . 1 . 2]" 1
800 1 67 GLY HA3 1 73 GLY H 3.864 . 5.730 3.075 2.519 3.756 . 0 0 "[ . 1 . 2]" 1
801 1 9 ALA HA 1 11 THR H 4.334 . 6.682 4.274 4.104 4.441 . 0 0 "[ . 1 . 2]" 1
802 1 72 ASN HB2 1 73 GLY H 4.165 . 6.334 4.053 2.955 4.254 . 0 0 "[ . 1 . 2]" 1
803 1 72 ASN HB3 1 73 GLY H 3.837 . 5.677 4.044 3.815 4.158 . 0 0 "[ . 1 . 2]" 1
804 1 73 GLY H 1 74 LEU HB3 4.627 . 7.303 5.042 4.939 5.181 . 0 0 "[ . 1 . 2]" 1
805 1 66 THR MG 1 73 GLY H 4.088 . 6.177 3.867 3.262 4.292 . 0 0 "[ . 1 . 2]" 1
806 1 73 GLY H 1 74 LEU HB2 5.066 . 8.274 5.415 5.219 5.623 . 0 0 "[ . 1 . 2]" 1
807 1 40 GLY H 1 44 ILE HA 4.491 . 7.012 4.714 4.623 4.889 . 0 0 "[ . 1 . 2]" 1
808 1 40 GLY H 1 44 ILE MD 4.775 . 7.625 4.741 4.346 5.340 . 0 0 "[ . 1 . 2]" 1
809 1 40 GLY H 1 40 GLY HA2 2.841 . 3.850 2.461 2.357 2.548 . 0 0 "[ . 1 . 2]" 1
810 1 40 GLY H 1 43 GLY HA2 4.505 . 7.042 6.877 6.149 7.199 0.157 3 0 "[ . 1 . 2]" 1
811 1 40 GLY H 1 44 ILE HB 3.174 . 4.433 2.952 2.679 3.219 . 0 0 "[ . 1 . 2]" 1
812 1 40 GLY H 1 58 VAL HB 4.987 . 8.095 5.225 4.911 5.710 . 0 0 "[ . 1 . 2]" 1
813 1 40 GLY H 1 44 ILE QG 5.198 . 8.576 4.891 4.545 5.116 . 0 0 "[ . 1 . 2]" 1
814 1 42 ASN QB 1 42 ASN QD . . 3.922 2.191 2.138 2.245 . 0 0 "[ . 1 . 2]" 1
815 1 67 GLY H 1 73 GLY HA3 5.063 . 8.267 5.593 5.307 5.939 . 0 0 "[ . 1 . 2]" 1
816 1 22 THR H 1 22 THR HB 2.552 . 3.366 2.716 2.652 2.827 . 0 0 "[ . 1 . 2]" 1
817 1 22 THR H 1 22 THR HA 2.716 . 3.638 2.719 2.699 2.743 . 0 0 "[ . 1 . 2]" 1
818 1 18 VAL HA 1 22 THR H 4.051 . 6.103 4.694 4.123 5.174 . 0 0 "[ . 1 . 2]" 1
819 1 21 ARG QD 1 22 THR H 4.929 . 7.966 5.075 4.613 5.319 . 0 0 "[ . 1 . 2]" 1
820 1 19 PRO HB3 1 22 THR H 4.767 . 7.607 5.674 5.440 5.922 . 0 0 "[ . 1 . 2]" 1
821 1 22 THR H 1 23 ALA MB 4.077 . 6.155 4.607 4.545 4.654 . 0 0 "[ . 1 . 2]" 1
822 1 21 ARG HB2 1 22 THR H 2.621 . 3.480 2.491 2.274 2.699 . 0 0 "[ . 1 . 2]" 1
823 1 21 ARG QG 1 22 THR H 3.297 . 4.656 4.006 3.861 4.211 . 0 0 "[ . 1 . 2]" 1
824 1 18 VAL QG 1 22 THR H 3.759 . 5.526 4.224 3.723 4.686 . 0 0 "[ . 1 . 2]" 1
825 1 50 THR H 1 56 MET QG 4.646 . 7.344 4.810 4.310 5.434 . 0 0 "[ . 1 . 2]" 1
826 1 97 ILE HB 1 99 SER H 4.492 . 7.014 5.352 5.034 5.498 . 0 0 "[ . 1 . 2]" 1
827 1 97 ILE HG12 1 99 SER H 5.161 . 8.491 4.600 4.278 4.739 . 0 0 "[ . 1 . 2]" 1
828 1 97 ILE HG13 1 99 SER H 3.872 . 5.746 2.996 2.570 3.140 . 0 0 "[ . 1 . 2]" 1
829 1 97 ILE MD 1 99 SER H 3.993 . 5.986 2.896 2.451 3.139 . 0 0 "[ . 1 . 2]" 1
830 1 28 ALA HA 1 31 HIS H 4.436 . 6.895 3.999 3.735 4.327 . 0 0 "[ . 1 . 2]" 1
831 1 30 GLU HA 1 31 HIS H 3.683 . 5.379 3.523 3.485 3.550 . 0 0 "[ . 1 . 2]" 1
832 1 31 HIS H 1 31 HIS HB2 3.489 . 5.011 2.769 2.458 3.002 . 0 0 "[ . 1 . 2]" 1
833 1 30 GLU HB3 1 31 HIS H 4.313 . 6.639 2.629 2.516 2.819 . 0 0 "[ . 1 . 2]" 1
834 1 29 LEU HB3 1 31 HIS H 4.593 . 7.230 5.469 4.916 5.743 . 0 0 "[ . 1 . 2]" 1
835 1 30 GLU HB2 1 31 HIS H 3.082 . 4.270 3.850 3.655 3.990 . 0 0 "[ . 1 . 2]" 1
836 1 29 LEU HA 1 31 HIS H 4.791 . 7.661 4.403 4.031 4.830 . 0 0 "[ . 1 . 2]" 1
837 1 31 HIS HA 1 32 GLY H 3.457 . 4.951 3.346 3.292 3.402 . 0 0 "[ . 1 . 2]" 1
838 1 28 ALA HA 1 32 GLY H 3.525 . 5.078 3.915 3.421 4.418 . 0 0 "[ . 1 . 2]" 1
839 1 29 LEU HA 1 32 GLY H 3.290 . 4.643 3.431 2.837 3.852 . 0 0 "[ . 1 . 2]" 1
840 1 31 HIS HB2 1 32 GLY H 4.257 . 6.522 3.842 3.239 4.228 . 0 0 "[ . 1 . 2]" 1
841 1 28 ALA MB 1 32 GLY H 4.820 . 7.724 4.595 4.396 4.955 . 0 0 "[ . 1 . 2]" 1
842 1 15 GLN QE 1 18 VAL QG 4.228 . 6.463 2.957 2.307 3.608 . 0 0 "[ . 1 . 2]" 1
843 1 11 THR MG 1 15 GLN QE 3.909 . 5.354 3.319 2.341 4.751 . 0 0 "[ . 1 . 2]" 1
844 1 86 ASN HA 1 87 GLY H 3.188 . 4.459 3.322 2.927 3.512 . 0 0 "[ . 1 . 2]" 1
845 1 84 ASN HA 1 87 GLY H 3.423 . 4.888 3.797 3.083 5.045 0.157 5 0 "[ . 1 . 2]" 1
846 1 86 ASN QB 1 87 GLY H 3.861 . 4.389 3.203 2.797 3.833 . 0 0 "[ . 1 . 2]" 1
847 1 85 ALA MB 1 87 GLY H 4.048 . 6.097 4.273 3.988 4.707 . 0 0 "[ . 1 . 2]" 1
848 1 87 GLY H 1 88 VAL QG 4.222 . 6.450 4.324 3.211 5.491 . 0 0 "[ . 1 . 2]" 1
849 1 51 ARG HD3 1 52 TYR H 4.878 . 7.852 5.088 2.556 5.755 . 0 0 "[ . 1 . 2]" 1
850 1 51 ARG HB3 1 52 TYR H 4.210 . 6.426 2.761 2.615 4.084 . 0 0 "[ . 1 . 2]" 1
851 1 50 THR MG 1 52 TYR H 4.642 . 7.336 4.644 4.297 4.975 . 0 0 "[ . 1 . 2]" 1
852 1 51 ARG HB2 1 52 TYR H 2.844 . 3.855 4.001 3.888 4.083 0.228 20 0 "[ . 1 . 2]" 1
853 1 51 ARG QG 1 52 TYR H 2.995 . 4.116 3.402 2.295 3.673 . 0 0 "[ . 1 . 2]" 1
854 1 49 THR HA 1 52 TYR H 5.661 . 9.667 6.814 6.506 7.136 . 0 0 "[ . 1 . 2]" 1
855 1 123 SER HA 1 124 GLY H 3.294 . 4.650 2.218 2.113 2.499 . 0 0 "[ . 1 . 2]" 1
856 1 121 ARG HB3 1 122 GLY H 4.814 . 7.711 3.733 2.931 4.413 . 0 0 "[ . 1 . 2]" 1
857 1 121 ARG HA 1 122 GLY H 2.931 . 4.005 2.186 2.130 2.294 . 0 0 "[ . 1 . 2]" 1
858 1 79 THR HB 1 81 GLY H 4.151 . 6.305 5.997 5.519 6.628 0.323 6 0 "[ . 1 . 2]" 1
859 1 34 LEU HA 1 36 THR H 3.745 . 5.498 3.703 3.501 3.946 . 0 0 "[ . 1 . 2]" 1
860 1 36 THR H 1 37 CYS HA 4.030 . 6.061 4.922 4.803 5.074 . 0 0 "[ . 1 . 2]" 1
861 1 36 THR H 1 36 THR HA 2.827 . 3.826 2.890 2.848 2.912 . 0 0 "[ . 1 . 2]" 1
862 1 36 THR H 1 36 THR HB 3.862 . 5.726 3.398 2.564 3.633 . 0 0 "[ . 1 . 2]" 1
863 1 35 ASP HA 1 36 THR H 3.214 . 4.505 3.509 3.456 3.538 . 0 0 "[ . 1 . 2]" 1
864 1 36 THR H 1 37 CYS QB 4.335 . 6.684 4.456 3.977 4.646 . 0 0 "[ . 1 . 2]" 1
865 1 35 ASP QB 1 36 THR H 2.756 . 3.705 2.726 2.540 2.989 . 0 0 "[ . 1 . 2]" 1
866 1 30 GLU HG2 1 33 GLY H 5.528 . 9.348 8.123 7.252 8.985 . 0 0 "[ . 1 . 2]" 1
867 1 29 LEU HA 1 33 GLY H 4.444 . 6.913 6.019 5.206 6.896 . 0 0 "[ . 1 . 2]" 1
868 1 34 LEU HG 1 36 THR H 4.683 . 7.424 6.228 5.897 6.451 . 0 0 "[ . 1 . 2]" 1
869 1 31 HIS HA 1 33 GLY H 4.627 . 7.303 4.208 4.098 4.650 . 0 0 "[ . 1 . 2]" 1
870 1 31 HIS HB3 1 33 GLY H 3.751 . 5.510 3.136 2.776 3.875 . 0 0 "[ . 1 . 2]" 1
871 1 31 HIS HB2 1 33 GLY H 4.178 . 6.360 3.943 2.923 4.646 . 0 0 "[ . 1 . 2]" 1
872 1 28 ALA MB 1 33 GLY H 3.898 . 5.797 5.272 3.760 5.736 . 0 0 "[ . 1 . 2]" 1
873 1 39 GLY H 1 58 VAL MG1 4.577 . 7.196 2.827 2.362 3.119 . 0 0 "[ . 1 . 2]" 1
874 1 39 GLY H 1 47 PRO HD2 4.198 . 6.401 5.510 5.102 6.010 . 0 0 "[ . 1 . 2]" 1
875 1 38 ASP QB 1 39 GLY H 3.356 . 4.764 3.287 2.499 3.723 . 0 0 "[ . 1 . 2]" 1
876 1 38 ASP HA 1 39 GLY H 2.667 . 3.556 2.248 2.182 2.355 . 0 0 "[ . 1 . 2]" 1
877 1 39 GLY H 1 57 SER HA 4.915 . 7.934 6.139 5.622 6.791 . 0 0 "[ . 1 . 2]" 1
878 1 39 GLY H 1 47 PRO QG 4.726 . 7.518 4.855 4.586 5.255 . 0 0 "[ . 1 . 2]" 1
879 1 39 GLY H 1 58 VAL MG2 3.629 . 5.275 3.990 3.757 4.181 . 0 0 "[ . 1 . 2]" 1
880 1 41 SER HA 1 43 GLY H 4.108 . 6.217 3.597 3.386 3.879 . 0 0 "[ . 1 . 2]" 1
881 1 43 GLY H 1 44 ILE HA 4.367 . 6.751 5.206 5.146 5.265 . 0 0 "[ . 1 . 2]" 1
882 1 42 ASN QB 1 43 GLY H 4.592 . 7.227 3.851 3.791 3.945 . 0 0 "[ . 1 . 2]" 1
883 1 42 ASN HA 1 43 GLY H 2.812 . 3.800 2.830 2.719 2.934 . 0 0 "[ . 1 . 2]" 1
884 1 43 GLY H 1 43 GLY HA2 2.486 . 3.258 2.325 2.298 2.340 . 0 0 "[ . 1 . 2]" 1
885 1 43 GLY H 1 44 ILE MD 5.598 . 9.516 5.704 5.139 6.053 . 0 0 "[ . 1 . 2]" 1
886 1 61 GLY H 1 62 VAL HA 4.694 . 7.448 5.360 5.290 5.426 . 0 0 "[ . 1 . 2]" 1
887 1 34 LEU HA 1 61 GLY H 4.418 . 6.858 5.541 5.055 5.802 . 0 0 "[ . 1 . 2]" 1
888 1 35 ASP HA 1 61 GLY H 5.034 . 8.202 5.743 5.094 6.147 . 0 0 "[ . 1 . 2]" 1
889 1 59 ALA H 1 61 GLY H 3.782 . 5.570 3.808 3.671 3.930 . 0 0 "[ . 1 . 2]" 1
890 1 42 ASN H 1 43 GLY H 3.167 . 4.420 2.802 2.632 2.908 . 0 0 "[ . 1 . 2]" 1
891 1 43 GLY H 1 44 ILE H 2.833 . 3.836 2.696 2.573 2.848 . 0 0 "[ . 1 . 2]" 1
892 1 31 HIS H 1 33 GLY H 4.039 . 6.078 4.204 3.828 4.600 . 0 0 "[ . 1 . 2]" 1
893 1 32 GLY H 1 33 GLY H 2.732 . 3.665 3.144 2.820 3.391 . 0 0 "[ . 1 . 2]" 1
894 1 33 GLY H 1 34 LEU H 4.363 . 6.743 4.507 4.220 4.572 . 0 0 "[ . 1 . 2]" 1
895 1 81 GLY H 1 89 THR H 4.773 . 7.621 5.968 3.805 8.062 0.441 18 0 "[ . 1 . 2]" 1
896 1 50 THR H 1 53 VAL H 3.228 . 4.531 3.528 3.167 3.919 . 0 0 "[ . 1 . 2]" 1
897 1 50 THR H 1 52 TYR H 4.538 . 7.112 4.963 4.631 5.240 . 0 0 "[ . 1 . 2]" 1
898 1 21 ARG H 1 22 THR H 2.786 . 3.756 2.779 2.691 2.931 . 0 0 "[ . 1 . 2]" 1
899 1 20 TYR QD 1 22 THR H 5.368 . 8.970 6.123 5.854 6.383 . 0 0 "[ . 1 . 2]" 1
900 1 39 GLY H 1 40 GLY H 4.204 . 6.413 4.330 4.067 4.478 . 0 0 "[ . 1 . 2]" 1
901 1 40 GLY H 1 44 ILE H 4.126 . 6.254 4.387 4.108 4.632 . 0 0 "[ . 1 . 2]" 1
902 1 41 SER H 1 42 ASN H 4.157 . 6.317 4.402 4.365 4.464 . 0 0 "[ . 1 . 2]" 1
903 1 35 ASP H 1 36 THR H 2.890 . 3.934 2.839 2.688 2.926 . 0 0 "[ . 1 . 2]" 1
904 1 17 PHE QD 1 20 TYR H 4.076 . 6.153 4.556 4.294 4.957 . 0 0 "[ . 1 . 2]" 1
905 1 106 ALA H 1 107 CYS H 2.646 . 3.521 2.563 2.492 2.671 . 0 0 "[ . 1 . 2]" 1
906 1 109 ASP H 1 111 PHE H 4.196 . 6.397 4.060 3.946 4.210 . 0 0 "[ . 1 . 2]" 1
907 1 70 SER H 1 71 LEU H 3.410 . 4.864 2.601 2.504 2.753 . 0 0 "[ . 1 . 2]" 1
908 1 24 VAL H 1 26 LEU H 4.015 . 6.030 4.057 3.904 4.271 . 0 0 "[ . 1 . 2]" 1
909 1 28 ALA H 1 30 GLU H 4.370 . 6.757 4.110 3.630 4.599 . 0 0 "[ . 1 . 2]" 1
910 1 92 ALA H 1 93 ARG H 4.340 . 6.695 4.429 4.298 4.566 . 0 0 "[ . 1 . 2]" 1
911 1 110 VAL H 1 111 PHE H 2.600 . 3.445 2.424 2.372 2.516 . 0 0 "[ . 1 . 2]" 1
912 1 25 GLU H 1 26 LEU H 2.601 . 3.447 2.637 2.545 2.720 . 0 0 "[ . 1 . 2]" 1
913 1 16 THR H 1 17 PHE H 2.632 . 3.498 2.437 2.412 2.459 . 0 0 "[ . 1 . 2]" 1
914 1 14 LEU H 1 111 PHE QE 4.370 . 6.757 4.522 4.255 5.033 . 0 0 "[ . 1 . 2]" 1
915 1 14 LEU H 1 111 PHE HZ 3.680 . 5.373 4.048 3.620 4.839 . 0 0 "[ . 1 . 2]" 1
916 1 13 MET H 1 111 PHE QE 5.374 . 8.984 5.794 5.317 6.478 . 0 0 "[ . 1 . 2]" 1
917 1 112 ARG H 1 113 PHE H 4.281 . 6.572 4.515 4.079 4.632 . 0 0 "[ . 1 . 2]" 1
918 1 111 PHE H 1 112 ARG H 2.831 . 3.833 2.813 2.491 2.986 . 0 0 "[ . 1 . 2]" 1
919 1 110 VAL H 1 112 ARG H 3.950 . 5.900 4.007 3.847 4.123 . 0 0 "[ . 1 . 2]" 1
920 1 100 ASP H 1 101 SER H 3.557 . 5.139 3.561 3.282 3.854 . 0 0 "[ . 1 . 2]" 1
921 1 99 SER H 1 100 ASP H 3.072 . 4.252 2.435 2.255 2.667 . 0 0 "[ . 1 . 2]" 1
922 1 125 LEU H 1 126 GLU H 3.463 . 4.962 4.059 3.857 4.451 . 0 0 "[ . 1 . 2]" 1
923 1 24 VAL H 1 25 GLU H 2.670 . 3.561 2.602 2.470 2.745 . 0 0 "[ . 1 . 2]" 1
924 1 24 VAL H 1 27 CYS H 4.076 . 6.153 4.759 4.561 4.965 . 0 0 "[ . 1 . 2]" 1
925 1 21 ARG H 1 24 VAL H 3.807 . 5.619 4.716 4.564 5.013 . 0 0 "[ . 1 . 2]" 1
926 1 75 SER H 1 96 ASN H 2.963 . 4.060 3.027 2.838 3.281 . 0 0 "[ . 1 . 2]" 1
927 1 96 ASN H 1 97 ILE H 3.869 . 5.740 4.091 4.035 4.173 . 0 0 "[ . 1 . 2]" 1
928 1 94 ASN H 1 95 CYS H 4.231 . 6.469 4.194 3.967 4.374 . 0 0 "[ . 1 . 2]" 1
929 1 36 THR H 1 37 CYS H 2.390 . 3.104 2.530 2.416 2.739 . 0 0 "[ . 1 . 2]" 1
930 1 113 PHE QD 1 114 ASP H 4.719 . 7.503 4.575 4.056 4.774 . 0 0 "[ . 1 . 2]" 1
931 1 4 TYR QD 1 5 LEU H 4.688 . 7.435 3.874 3.121 4.188 . 0 0 "[ . 1 . 2]" 1
932 1 6 ARG H 1 8 ALA H 4.372 . 6.761 4.344 4.104 4.579 . 0 0 "[ . 1 . 2]" 1
933 1 118 LEU H 1 119 VAL H 3.521 . 5.071 4.213 3.738 4.628 . 0 0 "[ . 1 . 2]" 1
934 1 113 PHE H 1 114 ASP H 3.570 . 5.163 4.261 3.923 4.477 . 0 0 "[ . 1 . 2]" 1
935 1 38 ASP H 1 39 GLY H 3.998 . 5.996 4.494 4.403 4.544 . 0 0 "[ . 1 . 2]" 1
936 1 35 ASP H 1 38 ASP H 4.765 . 7.603 7.545 7.296 7.863 0.260 14 0 "[ . 1 . 2]" 1
937 1 26 LEU H 1 28 ALA H 4.192 . 6.388 4.056 3.731 4.541 . 0 0 "[ . 1 . 2]" 1
938 1 25 GLU H 1 28 ALA H 4.122 . 6.246 4.615 4.438 4.868 . 0 0 "[ . 1 . 2]" 1
939 1 27 CYS H 1 28 ALA H 2.733 . 3.666 2.643 2.416 2.956 . 0 0 "[ . 1 . 2]" 1
940 1 28 ALA H 1 29 LEU H 2.821 . 3.815 2.677 2.416 2.900 . 0 0 "[ . 1 . 2]" 1
941 1 28 ALA H 1 33 GLY H 4.679 . 7.416 7.191 4.858 7.868 0.452 9 0 "[ . 1 . 2]" 1
942 1 12 ASP H 1 13 MET H 2.386 . 3.098 2.570 2.461 2.727 . 0 0 "[ . 1 . 2]" 1
943 1 101 SER H 1 102 ALA H 2.990 . 4.108 2.698 2.656 2.730 . 0 0 "[ . 1 . 2]" 1
944 1 77 VAL H 1 95 CYS H 4.643 . 7.338 4.903 4.680 5.064 . 0 0 "[ . 1 . 2]" 1
945 1 77 VAL H 1 96 ASN H 4.216 . 6.438 4.574 4.297 4.832 . 0 0 "[ . 1 . 2]" 1
946 1 77 VAL H 1 78 MET H 4.109 . 6.220 4.049 4.002 4.182 . 0 0 "[ . 1 . 2]" 1
947 1 76 VAL H 1 77 VAL H 4.087 . 6.175 4.458 4.368 4.526 . 0 0 "[ . 1 . 2]" 1
948 1 68 GLN HA 1 68 GLN QE 5.028 . 8.188 2.736 2.439 3.777 . 0 0 "[ . 1 . 2]" 1
949 1 21 ARG H 1 91 TRP HE1 5.133 . 8.427 6.569 5.717 7.992 . 0 0 "[ . 1 . 2]" 1
950 1 22 THR H 1 23 ALA H 2.681 . 3.580 2.959 2.876 3.019 . 0 0 "[ . 1 . 2]" 1
951 1 28 ALA H 1 34 LEU HG 4.680 . 7.418 5.490 4.522 6.961 . 0 0 "[ . 1 . 2]" 1
952 1 24 VAL HB 1 28 ALA H 4.537 . 7.110 5.638 5.429 5.912 . 0 0 "[ . 1 . 2]" 1
953 1 28 ALA H 1 37 CYS QB 4.543 . 7.123 4.715 4.108 5.473 . 0 0 "[ . 1 . 2]" 1
954 1 91 TRP H 1 91 TRP HD1 3.999 . 5.998 5.142 4.428 5.455 . 0 0 "[ . 1 . 2]" 1
955 1 67 GLY H 1 75 SER H 3.947 . 5.895 4.870 4.683 5.325 . 0 0 "[ . 1 . 2]" 1
956 1 74 LEU H 1 76 VAL QG 4.912 . 7.929 5.833 5.301 6.164 . 0 0 "[ . 1 . 2]" 1
957 1 103 LEU H 1 104 GLN H 2.346 . 3.034 2.520 2.447 2.685 . 0 0 "[ . 1 . 2]" 1
958 1 105 GLN H 1 106 ALA H 2.490 . 3.265 2.752 2.542 2.872 . 0 0 "[ . 1 . 2]" 1
959 1 102 ALA H 1 103 LEU H 2.463 . 3.221 2.676 2.608 2.703 . 0 0 "[ . 1 . 2]" 1
960 1 6 ARG H 1 7 LYS HA 5.100 . 8.351 5.215 5.169 5.296 . 0 0 "[ . 1 . 2]" 1
961 1 5 LEU HG 1 6 ARG H 4.663 . 7.380 4.397 4.206 5.183 . 0 0 "[ . 1 . 2]" 1
962 1 7 LYS H 1 8 ALA H 2.933 . 4.008 2.837 2.706 2.950 . 0 0 "[ . 1 . 2]" 1
963 1 6 ARG H 1 7 LYS H 2.846 . 3.859 2.607 2.551 2.690 . 0 0 "[ . 1 . 2]" 1
964 1 7 LYS H 1 9 ALA H 4.061 . 6.122 4.037 3.901 4.158 . 0 0 "[ . 1 . 2]" 1
965 1 8 ALA H 1 9 ALA HA 5.361 . 8.954 5.338 5.227 5.428 . 0 0 "[ . 1 . 2]" 1
966 1 37 CYS H 1 60 LYS H 3.881 . 5.764 4.874 4.515 5.159 . 0 0 "[ . 1 . 2]" 1
967 1 10 LEU H 1 11 THR H 2.643 . 3.516 2.549 2.490 2.611 . 0 0 "[ . 1 . 2]" 1
968 1 11 THR H 1 12 ASP H 2.378 . 3.085 2.609 2.528 2.736 . 0 0 "[ . 1 . 2]" 1
969 1 12 ASP H 1 110 VAL MG1 5.029 . 8.190 4.718 4.539 4.946 . 0 0 "[ . 1 . 2]" 1
970 1 12 ASP H 1 14 LEU HB3 4.710 . 7.483 5.016 4.751 5.254 . 0 0 "[ . 1 . 2]" 1
971 1 10 LEU HB2 1 12 ASP H 5.171 . 8.514 5.045 4.916 5.236 . 0 0 "[ . 1 . 2]" 1
972 1 10 LEU H 1 12 ASP H 3.647 . 5.310 4.041 3.928 4.165 . 0 0 "[ . 1 . 2]" 1
973 1 12 ASP H 1 14 LEU H 3.863 . 5.729 4.024 3.892 4.207 . 0 0 "[ . 1 . 2]" 1
974 1 13 MET H 1 14 LEU H 2.579 . 3.411 2.669 2.586 2.727 . 0 0 "[ . 1 . 2]" 1
975 1 26 LEU H 1 27 CYS H 2.424 . 3.158 2.694 2.595 2.756 . 0 0 "[ . 1 . 2]" 1
976 1 108 GLU H 1 109 ASP H 2.634 . 3.501 2.627 2.503 2.768 . 0 0 "[ . 1 . 2]" 1
977 1 27 CYS HA 1 30 GLU H 3.417 . 4.877 3.454 2.988 3.969 . 0 0 "[ . 1 . 2]" 1
978 1 30 GLU H 1 31 HIS HB2 5.471 . 9.213 5.135 4.745 5.436 . 0 0 "[ . 1 . 2]" 1
979 1 37 CYS H 1 38 ASP HA 4.572 . 7.185 4.940 4.749 5.098 . 0 0 "[ . 1 . 2]" 1
980 1 88 VAL HB 1 89 THR H 4.042 . 6.084 3.878 2.138 4.623 . 0 0 "[ . 1 . 2]" 1
981 1 4 TYR QD 1 5 LEU MD2 3.703 . 5.417 3.988 2.942 5.564 0.147 17 0 "[ . 1 . 2]" 1
982 1 4 TYR QD 1 5 LEU HG 3.993 . 5.986 4.269 3.247 7.003 1.017 11 1 "[ . 1+ . 2]" 1
983 1 4 TYR HA 1 4 TYR QD 3.686 . 5.384 2.806 2.189 3.734 . 0 0 "[ . 1 . 2]" 1
984 1 107 CYS HA 1 111 PHE QD 3.137 . 4.367 2.611 2.385 2.916 . 0 0 "[ . 1 . 2]" 1
985 1 111 PHE HB2 1 111 PHE QD 3.178 . 4.441 2.377 2.331 2.459 . 0 0 "[ . 1 . 2]" 1
986 1 111 PHE HB3 1 111 PHE QD 3.129 . 4.352 2.416 2.333 2.473 . 0 0 "[ . 1 . 2]" 1
987 1 110 VAL HB 1 111 PHE QD 3.619 . 5.256 2.930 2.487 3.256 . 0 0 "[ . 1 . 2]" 1
988 1 111 PHE HB2 1 111 PHE QE 3.336 . 4.727 4.410 4.394 4.430 . 0 0 "[ . 1 . 2]" 1
989 1 51 ARG HD3 1 52 TYR QD 3.809 . 5.622 5.010 3.695 6.319 0.697 2 1 "[ + . 1 . 2]" 1
990 1 14 LEU QD 1 111 PHE QD 3.315 . 4.689 2.824 2.439 3.129 . 0 0 "[ . 1 . 2]" 1
991 1 110 VAL MG1 1 111 PHE QD 3.668 . 5.350 3.597 3.411 3.806 . 0 0 "[ . 1 . 2]" 1
992 1 14 LEU HB2 1 111 PHE HZ 3.188 . 4.459 3.851 3.351 4.604 0.145 3 0 "[ . 1 . 2]" 1
993 1 17 PHE HB2 1 17 PHE QD 3.375 . 4.799 2.678 2.567 2.747 . 0 0 "[ . 1 . 2]" 1
994 1 17 PHE HB3 1 17 PHE QD 3.451 . 4.940 2.265 2.247 2.289 . 0 0 "[ . 1 . 2]" 1
995 1 17 PHE HA 1 17 PHE QD 3.567 . 5.157 2.240 2.007 2.552 . 0 0 "[ . 1 . 2]" 1
996 1 17 PHE QE 1 21 ARG QG 3.506 . 5.043 3.108 2.719 3.577 . 0 0 "[ . 1 . 2]" 1
997 1 17 PHE QD 1 21 ARG QG 3.663 . 5.340 3.320 3.195 3.665 . 0 0 "[ . 1 . 2]" 1
998 1 14 LEU QD 1 17 PHE QE 3.695 . 5.402 4.284 3.937 4.642 . 0 0 "[ . 1 . 2]" 1
999 1 17 PHE HZ 1 21 ARG QG 3.292 . 4.646 3.664 3.084 4.356 . 0 0 "[ . 1 . 2]" 1
1000 1 113 PHE HA 1 113 PHE QD 3.337 . 4.729 3.443 2.249 3.722 . 0 0 "[ . 1 . 2]" 1
1001 1 80 PRO HA 1 91 TRP HD1 3.397 . 4.839 3.134 2.503 3.873 . 0 0 "[ . 1 . 2]" 1
1002 1 113 PHE QB 1 113 PHE QD 3.180 . 4.340 2.135 2.131 2.155 . 0 0 "[ . 1 . 2]" 1
1003 1 113 PHE QB 1 113 PHE QE 3.974 . 5.949 3.932 3.923 3.942 . 0 0 "[ . 1 . 2]" 1
1004 1 20 TYR HB3 1 20 TYR QD 3.495 . 5.021 2.377 2.280 2.522 . 0 0 "[ . 1 . 2]" 1
1005 1 108 GLU QG 1 113 PHE QE 4.174 . 6.352 4.388 2.144 8.349 1.997 18 3 "[ . 1 .- +*2]" 1
1006 1 78 MET QG 1 91 TRP HD1 3.283 . 4.630 2.705 1.996 3.399 . 0 0 "[ . 1 . 2]" 1
1007 1 21 ARG QG 1 91 TRP HD1 3.642 . 5.300 4.954 4.208 6.255 0.955 12 2 "[ . 1 + . - 2]" 1
1008 1 14 LEU HA 1 17 PHE QD 4.298 . 6.607 3.918 3.615 4.261 . 0 0 "[ . 1 . 2]" 1
1009 1 17 PHE H 1 17 PHE HB3 3.072 . 4.252 2.518 2.418 2.651 . 0 0 "[ . 1 . 2]" 1
1010 1 51 ARG HA 1 52 TYR QD 4.389 . 6.797 5.348 5.086 5.624 . 0 0 "[ . 1 . 2]" 1
1011 1 51 ARG HA 1 52 TYR QE 4.573 . 7.187 6.209 5.924 6.606 . 0 0 "[ . 1 . 2]" 1
1012 1 15 GLN HB2 1 15 GLN QE 4.308 . 6.628 3.868 1.824 4.312 0.164 18 0 "[ . 1 . 2]" 1
1013 1 110 VAL HB 1 111 PHE QE 3.786 . 5.577 3.746 3.430 4.105 . 0 0 "[ . 1 . 2]" 1
1014 1 51 ARG QG 1 52 TYR QD 3.344 . 4.742 3.245 2.938 3.762 . 0 0 "[ . 1 . 2]" 1
1015 1 10 LEU QD 1 111 PHE QE 3.158 . 4.405 2.688 1.949 3.241 0.032 4 0 "[ . 1 . 2]" 1
1016 1 14 LEU QD 1 111 PHE QE 3.249 . 4.569 2.776 2.463 3.345 . 0 0 "[ . 1 . 2]" 1
1017 1 51 ARG HB2 1 52 TYR QD 3.747 . 5.502 5.149 4.757 5.418 . 0 0 "[ . 1 . 2]" 1
1018 1 110 VAL MG2 1 111 PHE QE 3.950 . 5.900 4.555 4.183 4.982 . 0 0 "[ . 1 . 2]" 1
1019 1 10 LEU HB3 1 111 PHE QE 4.363 . 6.742 2.613 2.138 3.392 . 0 0 "[ . 1 . 2]" 1
1020 1 30 GLU HG2 1 31 HIS H 4.447 . 6.918 4.342 3.607 5.049 . 0 0 "[ . 1 . 2]" 1
1021 1 85 ALA MB 1 86 ASN H 3.348 . 4.749 2.641 2.227 3.185 . 0 0 "[ . 1 . 2]" 1
1022 1 58 VAL MG2 1 61 GLY H 3.729 . 5.468 5.388 5.150 5.585 0.117 17 0 "[ . 1 . 2]" 1
1023 1 64 SER H 1 65 LEU QD 3.413 . 4.869 3.929 3.481 4.387 . 0 0 "[ . 1 . 2]" 1
1024 1 76 VAL HA 1 77 VAL H 2.469 . 3.231 2.217 2.157 2.263 . 0 0 "[ . 1 . 2]" 1
1025 1 93 ARG QG 1 111 PHE QD 4.805 . 7.691 3.434 2.129 5.218 . 0 0 "[ . 1 . 2]" 1
1026 1 112 ARG HB2 1 113 PHE QD 4.497 . 7.025 5.132 4.377 6.548 . 0 0 "[ . 1 . 2]" 1
1027 1 107 CYS H 1 109 ASP H 3.548 . 5.121 3.938 3.838 4.091 . 0 0 "[ . 1 . 2]" 1
1028 1 123 SER H 1 125 LEU H 3.189 . 4.460 4.780 3.677 6.096 1.636 18 8 "[ - .* 1* **. +**]" 1
1029 1 29 LEU H 1 30 GLU H 2.707 . 3.623 2.439 2.351 2.557 . 0 0 "[ . 1 . 2]" 1
1030 1 30 GLU H 1 31 HIS H 2.510 . 3.298 2.599 2.486 2.751 . 0 0 "[ . 1 . 2]" 1
1031 1 37 CYS H 1 61 GLY H 3.810 . 5.624 4.343 4.007 4.561 . 0 0 "[ . 1 . 2]" 1
1032 1 110 VAL H 1 111 PHE QD 3.998 . 5.996 4.020 3.778 4.165 . 0 0 "[ . 1 . 2]" 1
1033 1 109 ASP H 1 111 PHE QD 3.668 . 5.350 5.328 5.082 5.603 0.253 14 0 "[ . 1 . 2]" 1
1034 1 33 GLY H 1 35 ASP H 3.222 . 4.520 4.659 4.302 5.307 0.787 10 2 "[- . + . 2]" 1
1035 1 18 VAL H 1 20 TYR H 3.222 . 4.520 4.212 3.971 4.450 . 0 0 "[ . 1 . 2]" 1
1036 1 109 ASP H 1 110 VAL H 2.433 . 3.173 2.676 2.563 2.769 . 0 0 "[ . 1 . 2]" 1
1037 1 31 HIS H 1 32 GLY H 2.478 . 3.246 2.005 1.935 2.340 . 0 0 "[ . 1 . 2]" 1
1038 1 8 ALA H 1 10 LEU H 3.064 . 4.237 4.311 4.182 4.471 0.234 4 0 "[ . 1 . 2]" 1
1039 1 29 LEU H 1 32 GLY H 3.202 . 4.484 4.404 4.143 4.572 0.088 14 0 "[ . 1 . 2]" 1
1040 1 52 TYR H 1 52 TYR QD 3.052 . 4.216 3.035 2.360 3.352 . 0 0 "[ . 1 . 2]" 1
1041 1 17 PHE QD 1 111 PHE QE 3.381 . 4.810 4.257 3.328 4.978 0.168 11 0 "[ . 1 . 2]" 1
1042 1 63 VAL QG 1 78 MET H 4.306 . 6.623 3.260 2.604 4.089 . 0 0 "[ . 1 . 2]" 1
1043 1 63 VAL H 1 63 VAL QG 3.288 . 4.216 2.457 2.159 2.878 . 0 0 "[ . 1 . 2]" 1
1044 1 74 LEU QD 1 76 VAL H 3.293 . 4.648 3.185 2.832 4.154 . 0 0 "[ . 1 . 2]" 1
1045 1 58 VAL MG1 1 59 ALA H 3.608 . 5.236 2.901 2.792 3.002 . 0 0 "[ . 1 . 2]" 1
1046 1 103 LEU HG 1 104 GLN H 3.441 . 4.921 4.343 4.189 4.460 . 0 0 "[ . 1 . 2]" 1
1047 1 14 LEU QD 1 15 GLN QE 3.898 . 4.074 2.988 2.097 5.012 0.938 8 1 "[ . + 1 . 2]" 1
1048 1 113 PHE QD 1 118 LEU QD 3.026 . 4.171 2.166 1.805 3.312 0.076 17 0 "[ . 1 . 2]" 1
1049 1 113 PHE QE 1 118 LEU QD 2.925 . 3.994 3.315 2.635 4.624 0.630 10 1 "[ . + . 2]" 1
1050 1 64 SER HA 1 77 VAL MG2 3.430 . 4.900 3.264 2.909 3.591 . 0 0 "[ . 1 . 2]" 1
1051 1 64 SER HA 1 77 VAL MG1 3.581 . 5.184 3.603 3.222 3.874 . 0 0 "[ . 1 . 2]" 1
1052 1 38 ASP HA 1 58 VAL MG1 2.494 . 3.272 2.712 2.457 3.078 . 0 0 "[ . 1 . 2]" 1
1053 1 74 LEU QD 1 95 CYS HA 3.039 . 4.194 2.857 2.538 3.486 . 0 0 "[ . 1 . 2]" 1
1054 1 76 VAL HA 1 76 VAL QG 2.699 . 3.609 2.159 2.143 2.346 . 0 0 "[ . 1 . 2]" 1
1055 1 77 VAL HA 1 77 VAL MG1 2.585 . 3.420 2.364 2.340 2.386 . 0 0 "[ . 1 . 2]" 1
1056 1 10 LEU QD 1 107 CYS HA 2.722 . 3.648 2.309 2.048 2.978 . 0 0 "[ . 1 . 2]" 1
1057 1 34 LEU QD 1 61 GLY QA 2.761 . 3.714 2.140 1.836 3.077 0.163 9 0 "[ . 1 . 2]" 1
1058 1 34 LEU HA 1 34 LEU QD 2.617 . 3.473 2.290 2.054 3.037 . 0 0 "[ . 1 . 2]" 1
1059 1 59 ALA HA 1 59 ALA MB 2.160 . 2.743 2.130 2.127 2.135 . 0 0 "[ . 1 . 2]" 1
1060 1 65 LEU HA 1 65 LEU QD 2.765 . 3.721 2.858 2.108 3.377 . 0 0 "[ . 1 . 2]" 1
1061 1 48 THR HA 1 48 THR MG 2.894 . 3.941 2.899 2.293 3.220 . 0 0 "[ . 1 . 2]" 1
1062 1 50 THR HA 1 50 THR MG 2.582 . 3.415 2.377 2.214 2.474 . 0 0 "[ . 1 . 2]" 1
1063 1 53 VAL HA 1 53 VAL MG2 2.030 . 2.545 2.324 2.277 2.381 . 0 0 "[ . 1 . 2]" 1
1064 1 92 ALA HA 1 92 ALA MB 2.215 . 2.828 2.130 2.121 2.135 . 0 0 "[ . 1 . 2]" 1
1065 1 50 THR HB 1 50 THR MG 2.165 . 2.751 2.134 2.132 2.136 . 0 0 "[ . 1 . 2]" 1
1066 1 77 VAL HA 1 77 VAL MG2 2.437 . 3.179 2.430 2.393 2.472 . 0 0 "[ . 1 . 2]" 1
1067 1 66 THR HA 1 66 THR MG 2.498 . 3.278 2.338 2.299 2.391 . 0 0 "[ . 1 . 2]" 1
1068 1 49 THR MG 1 55 ALA HA 2.185 . 2.782 2.279 1.998 3.085 0.303 19 0 "[ . 1 . 2]" 1
1069 1 49 THR HA 1 53 VAL MG1 2.572 . 3.399 2.664 2.460 2.858 . 0 0 "[ . 1 . 2]" 1
1070 1 55 ALA HA 1 55 ALA MB 2.064 . 2.597 2.130 2.126 2.134 . 0 0 "[ . 1 . 2]" 1
1071 1 115 ASP HA 1 118 LEU QD 2.567 . 3.391 2.397 1.993 3.184 . 0 0 "[ . 1 . 2]" 1
1072 1 62 VAL HA 1 62 VAL QG 2.227 . 2.847 2.148 2.121 2.450 . 0 0 "[ . 1 . 2]" 1
1073 1 125 LEU HA 1 125 LEU MD2 2.610 . 3.461 2.416 2.090 3.756 0.295 18 0 "[ . 1 . 2]" 1
1074 1 5 LEU HA 1 5 LEU MD2 2.123 . 2.686 2.067 1.980 2.632 . 0 0 "[ . 1 . 2]" 1
1075 1 64 SER HB3 1 77 VAL MG2 2.899 . 3.950 3.307 2.603 4.377 0.427 13 0 "[ . 1 . 2]" 1
1076 1 29 LEU HA 1 29 LEU QD 2.385 . 3.096 2.055 1.885 2.141 . 0 0 "[ . 1 . 2]" 1
1077 1 11 THR HB 1 11 THR MG 2.093 . 2.640 2.135 2.132 2.138 . 0 0 "[ . 1 . 2]" 1
1078 1 78 MET QG 1 80 PRO QD 1.986 . 2.479 2.689 2.101 4.155 1.676 17 5 "[ *- . * .*+ 2]" 1
1079 1 34 LEU HA 1 34 LEU HB3 2.588 . 3.425 2.499 2.408 2.559 . 0 0 "[ . 1 . 2]" 1
1080 1 66 THR MG 1 75 SER QB 2.680 . 3.578 3.199 2.412 4.271 0.693 10 2 "[ . + - . 2]" 1
1081 1 110 VAL MG1 1 110 VAL MG2 2.031 . 2.547 2.083 2.078 2.088 . 0 0 "[ . 1 . 2]" 1
1082 1 77 VAL MG2 1 94 ASN HB3 3.160 . 4.408 3.660 3.147 4.346 . 0 0 "[ . 1 . 2]" 1
1083 1 51 ARG HD3 1 51 ARG QG 2.453 . 3.205 2.337 2.179 2.385 . 0 0 "[ . 1 . 2]" 1
1084 1 53 VAL MG1 1 56 MET QG . . 2.666 2.378 2.050 2.858 0.192 17 0 "[ . 1 . 2]" 1
1085 1 52 TYR HB2 1 53 VAL MG2 2.593 . 3.434 3.546 3.263 3.937 0.503 13 1 "[ . 1 + . 2]" 1
1086 1 14 LEU QD 1 111 PHE HA 2.818 . 3.811 2.939 2.041 3.553 . 0 0 "[ . 1 . 2]" 1
1087 1 12 ASP HA 1 15 GLN HB3 4.566 . 7.172 3.964 2.346 4.240 . 0 0 "[ . 1 . 2]" 1
1088 1 68 GLN QE 1 69 GLU HB3 4.641 . 7.334 4.318 3.618 7.073 . 0 0 "[ . 1 . 2]" 1
1089 1 68 GLN QE 1 69 GLU HB2 4.041 . 6.083 3.447 2.076 5.784 . 0 0 "[ . 1 . 2]" 1
1090 1 69 GLU HB3 1 71 LEU H 4.093 . 6.187 3.787 2.771 4.137 . 0 0 "[ . 1 . 2]" 1
1091 1 69 GLU H 1 69 GLU HB2 3.297 . 4.655 3.401 2.991 3.574 . 0 0 "[ . 1 . 2]" 1
1092 1 69 GLU HA 1 69 GLU HB2 2.925 . 3.995 2.998 2.741 3.025 . 0 0 "[ . 1 . 2]" 1
1093 1 69 GLU HB3 1 69 GLU HG2 2.001 . 2.502 2.824 2.443 3.010 0.508 10 6 "[- * ** + * . 2]" 1
1094 1 86 ASN H 1 86 ASN QB 2.873 . 3.905 2.401 2.295 2.553 . 0 0 "[ . 1 . 2]" 1
1095 1 86 ASN QB 1 86 ASN HD21 4.103 . 5.522 2.307 2.152 2.827 . 0 0 "[ . 1 . 2]" 1
1096 1 86 ASN HA 1 86 ASN QB 4.415 . 4.853 2.409 2.174 2.452 . 0 0 "[ . 1 . 2]" 1
1097 1 77 VAL HB 1 94 ASN HB2 3.433 . 4.906 3.225 2.023 4.087 . 0 0 "[ . 1 . 2]" 1
1098 1 86 ASN QB 1 88 VAL QG 2.316 . 2.987 3.311 1.837 5.822 2.835 7 7 "[ *. + **** -. 2]" 1
1099 1 85 ALA MB 1 86 ASN QB 4.220 . 6.446 3.974 3.491 4.423 . 0 0 "[ . 1 . 2]" 1
1100 1 93 ARG HA 1 94 ASN HB3 4.879 . 7.855 4.952 4.415 5.672 . 0 0 "[ . 1 . 2]" 1
1101 1 93 ARG HA 1 94 ASN HB2 4.716 . 7.496 4.449 4.203 4.599 . 0 0 "[ . 1 . 2]" 1
1102 1 94 ASN HB3 1 94 ASN QD 4.351 . 6.717 3.005 2.214 3.331 . 0 0 "[ . 1 . 2]" 1
1103 1 52 TYR HB2 1 53 VAL H 3.168 . 4.422 3.456 3.067 4.036 . 0 0 "[ . 1 . 2]" 1
1104 1 77 VAL H 1 94 ASN HB3 2.774 . 3.736 3.387 2.706 4.283 0.547 16 1 "[ . 1 .+ 2]" 1
1105 1 94 ASN HB2 1 95 CYS H 4.030 . 6.060 4.279 4.141 4.459 . 0 0 "[ . 1 . 2]" 1
1106 1 77 VAL HB 1 94 ASN HB3 2.493 . 3.270 2.793 2.046 3.904 0.634 13 4 "[ . 1* + .-* 2]" 1
1107 1 75 SER HA 1 96 ASN QB 4.955 . 8.024 4.780 4.636 4.945 . 0 0 "[ . 1 . 2]" 1
1108 1 104 GLN QG 1 105 GLN H 2.895 . 3.943 3.447 3.277 3.649 . 0 0 "[ . 1 . 2]" 1
1109 1 104 GLN QG 1 109 ASP H 4.182 . 5.504 5.376 4.809 6.238 0.734 15 1 "[ . 1 + 2]" 1
1110 1 17 PHE QE 1 63 VAL HB 3.419 . 4.880 4.159 3.355 5.094 0.214 11 0 "[ . 1 . 2]" 1
1111 1 105 GLN HE21 1 105 GLN QG 4.186 . 6.376 2.398 2.158 2.798 . 0 0 "[ . 1 . 2]" 1
1112 1 105 GLN HA 1 105 GLN QG 2.892 . 3.748 2.601 2.344 3.042 . 0 0 "[ . 1 . 2]" 1
1113 1 74 LEU QD 1 107 CYS HB3 2.477 . 3.244 2.489 2.294 2.861 . 0 0 "[ . 1 . 2]" 1
1114 1 72 ASN HA 1 72 ASN HB2 2.778 . 3.743 2.480 2.381 2.585 . 0 0 "[ . 1 . 2]" 1
1115 1 108 GLU HA 1 108 GLU QG 2.934 . 4.010 2.942 2.332 3.452 . 0 0 "[ . 1 . 2]" 1
1116 1 3 ASN QB 1 6 ARG HB2 4.215 . 6.436 3.722 2.437 4.582 . 0 0 "[ . 1 . 2]" 1
1117 1 106 ALA MB 1 107 CYS HB3 3.714 . 5.438 4.363 3.794 4.669 . 0 0 "[ . 1 . 2]" 1
1118 1 16 THR MG 1 20 TYR HB2 3.393 . 4.832 5.280 4.516 5.678 0.846 16 9 "[- .*** * * .+ **2]" 1
1119 1 74 LEU QD 1 107 CYS HB2 2.563 . 3.384 2.516 2.118 3.273 . 0 0 "[ . 1 . 2]" 1
1120 1 20 TYR HB2 1 20 TYR QD 3.252 . 4.574 2.454 2.328 2.702 . 0 0 "[ . 1 . 2]" 1
1121 1 104 GLN QG 1 108 GLU QG 3.429 . 4.899 3.371 2.091 4.697 . 0 0 "[ . 1 . 2]" 1
1122 1 44 ILE HB 1 44 ILE QG 3.132 . 4.358 2.331 2.188 2.364 . 0 0 "[ . 1 . 2]" 1
1123 1 20 TYR HB2 1 21 ARG QG 3.397 . 4.839 3.800 3.599 4.171 . 0 0 "[ . 1 . 2]" 1
1124 1 20 TYR HB3 1 21 ARG QG 3.529 . 5.085 4.654 4.350 5.001 . 0 0 "[ . 1 . 2]" 1
1125 1 69 GLU H 1 69 GLU HG2 4.251 . 6.510 3.142 2.802 3.932 . 0 0 "[ . 1 . 2]" 1
1126 1 69 GLU HA 1 69 GLU HG2 2.718 . 3.641 2.781 2.324 3.299 . 0 0 "[ . 1 . 2]" 1
1127 1 27 CYS HB3 1 37 CYS QB 3.497 . 5.025 3.588 3.083 4.789 . 0 0 "[ . 1 . 2]" 1
1128 1 69 GLU HB3 1 69 GLU HG3 2.494 . 3.271 2.612 2.335 3.004 . 0 0 "[ . 1 . 2]" 1
1129 1 4 TYR QB 1 5 LEU HG 3.525 . 5.078 3.568 3.112 5.325 0.247 11 0 "[ . 1 . 2]" 1
1130 1 34 LEU HB3 1 37 CYS QB 2.563 . 3.384 2.843 2.585 4.030 0.646 1 2 "[+ . - . 2]" 1
1131 1 34 LEU HA 1 37 CYS QB 3.945 . 4.228 3.062 2.671 3.385 . 0 0 "[ . 1 . 2]" 1
1132 1 30 GLU HA 1 30 GLU HG3 3.242 . 4.556 2.834 2.452 3.433 . 0 0 "[ . 1 . 2]" 1
1133 1 39 GLY H 1 58 VAL HB 2.548 . 3.359 2.348 2.110 2.547 . 0 0 "[ . 1 . 2]" 1
1134 1 104 GLN QG 1 105 GLN HA 2.792 . 3.767 3.421 3.190 3.636 . 0 0 "[ . 1 . 2]" 1
1135 1 104 GLN HA 1 104 GLN QG 2.822 . 3.817 2.506 2.450 2.576 . 0 0 "[ . 1 . 2]" 1
1136 1 65 LEU QB 1 76 VAL HB 2.482 . 3.252 2.436 1.987 4.438 1.186 11 2 "[ . 1+ -. 2]" 1
1137 1 47 PRO HB3 1 58 VAL MG2 2.390 . 3.104 2.447 1.916 3.036 . 0 0 "[ . 1 . 2]" 1
1138 1 65 LEU QD 1 76 VAL HB 2.547 . 3.358 2.445 2.039 4.555 1.197 11 1 "[ . 1+ . 2]" 1
1139 1 93 ARG HB2 1 93 ARG QD 3.475 . 4.984 2.666 2.094 3.457 . 0 0 "[ . 1 . 2]" 1
1140 1 93 ARG HB3 1 93 ARG QD 4.270 . 6.549 2.874 2.141 3.554 . 0 0 "[ . 1 . 2]" 1
1141 1 107 CYS HA 1 110 VAL HB 3.357 . 4.766 3.618 3.236 3.905 . 0 0 "[ . 1 . 2]" 1
1142 1 13 MET HA 1 13 MET HG3 3.957 . 5.914 3.297 2.781 3.759 . 0 0 "[ . 1 . 2]" 1
1143 1 119 VAL HB 1 120 PRO QD 3.574 . 5.171 3.816 3.623 4.130 . 0 0 "[ . 1 . 2]" 1
1144 1 120 PRO HB2 1 120 PRO QD 3.476 . 4.987 3.326 2.893 3.548 . 0 0 "[ . 1 . 2]" 1
1145 1 110 VAL HB 1 110 VAL MG2 2.171 . 2.760 2.127 2.124 2.130 . 0 0 "[ . 1 . 2]" 1
1146 1 10 LEU QD 1 110 VAL HB 3.064 . 4.237 3.369 2.942 3.812 . 0 0 "[ . 1 . 2]" 1
1147 1 110 VAL HB 1 110 VAL MG1 2.257 . 2.894 2.129 2.126 2.132 . 0 0 "[ . 1 . 2]" 1
1148 1 24 VAL HB 1 25 GLU H 2.804 . 3.787 2.626 2.495 2.750 . 0 0 "[ . 1 . 2]" 1
1149 1 91 TRP H 1 91 TRP HB3 2.726 . 3.655 3.754 3.643 3.886 0.231 6 0 "[ . 1 . 2]" 1
1150 1 23 ALA H 1 24 VAL HB 3.779 . 5.564 4.733 4.621 4.811 . 0 0 "[ . 1 . 2]" 1
1151 1 21 ARG H 1 24 VAL HB 3.732 . 5.473 5.068 4.854 5.397 . 0 0 "[ . 1 . 2]" 1
1152 1 91 TRP HB3 1 91 TRP HD1 3.639 . 5.295 2.678 2.581 2.808 . 0 0 "[ . 1 . 2]" 1
1153 1 120 PRO HB3 1 120 PRO QD 3.688 . 5.389 3.148 2.886 3.541 . 0 0 "[ . 1 . 2]" 1
1154 1 91 TRP HB2 1 92 ALA MB 3.618 . 5.255 5.517 5.426 5.666 0.411 5 0 "[ . 1 . 2]" 1
1155 1 62 VAL HB 1 63 VAL H 3.242 . 4.556 3.943 2.987 4.096 . 0 0 "[ . 1 . 2]" 1
1156 1 56 MET H 1 56 MET QG 3.292 . 4.647 2.741 2.638 3.125 . 0 0 "[ . 1 . 2]" 1
1157 1 91 TRP HB2 1 91 TRP HD1 2.836 . 3.841 3.811 3.734 3.877 0.036 3 0 "[ . 1 . 2]" 1
1158 1 54 SER QB 1 68 GLN QB 3.295 . 4.652 4.073 3.343 5.860 1.208 17 2 "[ . 1 . + -]" 1
1159 1 45 PRO QB 1 45 PRO HG2 . . 2.477 2.202 2.172 2.242 . 0 0 "[ . 1 . 2]" 1
1160 1 62 VAL HB 1 62 VAL QG 2.027 . 2.208 1.894 1.889 1.897 . 0 0 "[ . 1 . 2]" 1
1161 1 121 ARG H 1 121 ARG HB2 3.804 . 5.612 2.712 2.518 3.159 . 0 0 "[ . 1 . 2]" 1
1162 1 19 PRO HB2 1 20 TYR H 3.190 . 4.462 2.848 2.503 3.109 . 0 0 "[ . 1 . 2]" 1
1163 1 19 PRO HB2 1 19 PRO HD2 3.184 . 4.451 2.982 2.947 3.025 . 0 0 "[ . 1 . 2]" 1
1164 1 108 GLU H 1 108 GLU QB 2.337 . 3.020 2.338 2.174 2.488 . 0 0 "[ . 1 . 2]" 1
1165 1 30 GLU H 1 30 GLU HB2 2.644 . 3.518 2.499 2.279 2.643 . 0 0 "[ . 1 . 2]" 1
1166 1 97 ILE HB 1 97 ILE HG13 2.965 . 4.064 3.014 3.009 3.019 . 0 0 "[ . 1 . 2]" 1
1167 1 62 VAL QG 1 80 PRO QB 4.309 . 6.630 4.470 3.912 4.822 . 0 0 "[ . 1 . 2]" 1
1168 1 108 GLU QB 1 109 ASP H 3.689 . 5.390 3.288 2.700 3.685 . 0 0 "[ . 1 . 2]" 1
1169 1 19 PRO HD2 1 19 PRO HG3 2.922 . 3.989 2.985 2.977 2.991 . 0 0 "[ . 1 . 2]" 1
1170 1 104 GLN QG 1 108 GLU QB 1.824 . 2.240 2.557 2.038 3.293 1.053 15 6 "[ * . 1** +- *]" 1
1171 1 19 PRO HB2 1 19 PRO HG2 2.382 . 3.091 2.321 2.312 2.326 . 0 0 "[ . 1 . 2]" 1
1172 1 76 VAL QG 1 78 MET QG 3.626 . 5.270 4.798 4.275 5.075 . 0 0 "[ . 1 . 2]" 1
1173 1 19 PRO HG2 1 20 TYR H 3.892 . 5.785 4.199 3.927 4.454 . 0 0 "[ . 1 . 2]" 1
1174 1 21 ARG H 1 21 ARG HB2 2.808 . 3.794 2.526 2.385 2.638 . 0 0 "[ . 1 . 2]" 1
1175 1 19 PRO HG2 1 21 ARG H 4.424 . 6.870 6.253 6.097 6.455 . 0 0 "[ . 1 . 2]" 1
1176 1 15 GLN HA 1 15 GLN HB3 2.540 . 3.347 2.544 2.486 3.025 . 0 0 "[ . 1 . 2]" 1
1177 1 104 GLN HA 1 104 GLN HB2 2.858 . 3.879 2.413 2.369 2.456 . 0 0 "[ . 1 . 2]" 1
1178 1 21 ARG HB2 1 21 ARG QD 3.216 . 4.509 3.079 2.402 3.528 . 0 0 "[ . 1 . 2]" 1
1179 1 11 THR MG 1 15 GLN HB2 3.889 . 5.779 4.186 3.172 4.600 . 0 0 "[ . 1 . 2]" 1
1180 1 19 PRO HA 1 19 PRO HG2 3.791 . 5.587 3.925 3.895 3.961 . 0 0 "[ . 1 . 2]" 1
1181 1 6 ARG HA 1 6 ARG HG3 2.835 . 3.839 2.622 2.500 2.945 . 0 0 "[ . 1 . 2]" 1
1182 1 3 ASN QB 1 6 ARG HG3 4.583 . 7.208 4.777 3.806 5.370 . 0 0 "[ . 1 . 2]" 1
1183 1 74 LEU HB3 1 74 LEU HG 2.477 . 3.244 2.974 2.473 3.014 . 0 0 "[ . 1 . 2]" 1
1184 1 93 ARG H 1 93 ARG QG 4.365 . 6.747 3.066 2.019 3.653 . 0 0 "[ . 1 . 2]" 1
1185 1 29 LEU H 1 29 LEU HG 3.214 . 4.505 3.525 2.489 4.515 0.010 13 0 "[ . 1 . 2]" 1
1186 1 17 PHE QE 1 93 ARG QG 4.484 . 6.998 5.506 4.373 8.153 1.155 3 1 "[ + . 1 . 2]" 1
1187 1 26 LEU HA 1 26 LEU HG 2.979 . 4.088 3.538 2.894 3.685 . 0 0 "[ . 1 . 2]" 1
1188 1 44 ILE QG 1 45 PRO HD2 3.550 . 5.126 4.072 3.746 4.608 . 0 0 "[ . 1 . 2]" 1
1189 1 93 ARG QG 1 111 PHE HB3 4.354 . 6.723 3.258 2.098 4.280 . 0 0 "[ . 1 . 2]" 1
1190 1 3 ASN QB 1 6 ARG HG2 3.496 . 5.023 3.740 3.263 4.071 . 0 0 "[ . 1 . 2]" 1
1191 1 44 ILE QG 1 44 ILE MG 2.050 . 2.575 2.341 2.281 2.380 . 0 0 "[ . 1 . 2]" 1
1192 1 34 LEU H 1 34 LEU HG 2.975 . 4.082 2.549 2.341 2.846 . 0 0 "[ . 1 . 2]" 1
1193 1 80 PRO QD 1 80 PRO HG3 2.708 . 3.625 2.211 2.181 2.252 . 0 0 "[ . 1 . 2]" 1
1194 1 42 ASN QB 1 44 ILE QG 2.891 . 3.936 3.095 2.569 3.581 . 0 0 "[ . 1 . 2]" 1
1195 1 71 LEU HB2 1 71 LEU HG 2.271 . 2.916 2.457 2.418 2.501 . 0 0 "[ . 1 . 2]" 1
1196 1 14 LEU HB3 1 14 LEU QD 2.133 . 2.702 2.205 2.166 2.332 . 0 0 "[ . 1 . 2]" 1
1197 1 78 MET QG 1 80 PRO HG3 3.413 . 4.869 3.765 2.841 5.042 0.173 10 0 "[ . 1 . 2]" 1
1198 1 62 VAL QG 1 80 PRO HG2 . . 3.385 3.670 2.736 4.376 0.991 16 7 "[ -** * *1* .+ 2]" 1
1199 1 14 LEU H 1 14 LEU QD 4.128 . 6.258 3.698 3.566 3.735 . 0 0 "[ . 1 . 2]" 1
1200 1 103 LEU H 1 103 LEU HG 2.616 . 3.472 2.333 2.267 2.451 . 0 0 "[ . 1 . 2]" 1
1201 1 70 SER QB 1 71 LEU HG 2.785 . 3.755 3.535 3.383 3.746 . 0 0 "[ . 1 . 2]" 1
1202 1 34 LEU HA 1 34 LEU HG 2.785 . 3.754 2.812 2.463 3.075 . 0 0 "[ . 1 . 2]" 1
1203 1 51 ARG HA 1 51 ARG QG 3.522 . 5.072 2.785 2.419 3.508 . 0 0 "[ . 1 . 2]" 1
1204 1 51 ARG QG 1 52 TYR HB3 3.688 . 5.388 4.998 4.469 5.446 0.058 19 0 "[ . 1 . 2]" 1
1205 1 113 PHE QB 1 118 LEU QD 2.973 . 4.078 2.270 1.681 3.027 0.187 15 0 "[ . 1 . 2]" 1
1206 1 14 LEU QD 1 14 LEU HG 1.948 . 2.422 1.893 1.887 1.895 . 0 0 "[ . 1 . 2]" 1
1207 1 60 LYS H 1 60 LYS HG3 4.609 . 7.264 4.059 2.569 4.350 . 0 0 "[ . 1 . 2]" 1
1208 1 60 LYS QE 1 60 LYS HG2 2.734 . 3.668 2.488 2.253 2.962 . 0 0 "[ . 1 . 2]" 1
1209 1 60 LYS QE 1 60 LYS HG3 2.851 . 3.867 2.590 2.327 2.924 . 0 0 "[ . 1 . 2]" 1
1210 1 24 VAL MG2 1 61 GLY H 3.716 . 5.442 5.195 4.543 5.759 0.317 13 0 "[ . 1 . 2]" 1
1211 1 34 LEU H 1 34 LEU QD 3.950 . 5.900 3.003 1.955 3.289 0.045 6 0 "[ . 1 . 2]" 1
1212 1 21 ARG H 1 24 VAL MG2 3.128 . 4.351 4.322 4.058 4.840 0.489 8 0 "[ . 1 . 2]" 1
1213 1 24 VAL HA 1 24 VAL MG2 2.444 . 3.191 2.355 2.326 2.383 . 0 0 "[ . 1 . 2]" 1
1214 1 24 VAL HB 1 24 VAL MG2 2.160 . 2.743 2.130 2.127 2.132 . 0 0 "[ . 1 . 2]" 1
1215 1 34 LEU QD 1 80 PRO HG2 2.583 . 3.417 2.450 1.879 3.101 . 0 0 "[ . 1 . 2]" 1
1216 1 18 VAL H 1 18 VAL QG 2.185 . 2.782 2.093 2.035 2.159 . 0 0 "[ . 1 . 2]" 1
1217 1 14 LEU QD 1 17 PHE QD 2.933 . 4.008 2.764 2.420 3.049 . 0 0 "[ . 1 . 2]" 1
1218 1 14 LEU HA 1 14 LEU QD 2.599 . 3.444 2.187 1.985 2.281 . 0 0 "[ . 1 . 2]" 1
1219 1 18 VAL HA 1 18 VAL QG 2.133 . 2.702 2.113 2.105 2.117 . 0 0 "[ . 1 . 2]" 1
1220 1 69 GLU HB2 1 71 LEU QD 3.191 . 4.463 3.842 3.190 4.465 0.002 19 0 "[ . 1 . 2]" 1
1221 1 74 LEU QD 1 103 LEU HB3 2.015 . 2.523 2.323 2.178 2.466 . 0 0 "[ . 1 . 2]" 1
1222 1 50 THR H 1 50 THR MG 2.423 . 3.157 2.362 2.066 3.063 . 0 0 "[ . 1 . 2]" 1
1223 1 50 THR H 1 53 VAL MG1 3.449 . 4.936 3.200 3.050 3.356 . 0 0 "[ . 1 . 2]" 1
1224 1 74 LEU QD 1 75 SER H 3.156 . 4.401 2.742 2.279 2.896 . 0 0 "[ . 1 . 2]" 1
1225 1 61 GLY H 1 62 VAL QG 3.655 . 5.325 4.408 4.058 4.467 . 0 0 "[ . 1 . 2]" 1
1226 1 71 LEU QD 1 106 ALA H 2.970 . 4.073 4.088 3.687 4.752 0.679 16 3 "[ . 1 - .+ *2]" 1
1227 1 74 LEU QD 1 103 LEU HA 3.743 . 5.495 3.861 3.717 3.988 . 0 0 "[ . 1 . 2]" 1
1228 1 15 GLN HA 1 18 VAL QG 2.268 . 2.911 2.311 2.096 2.818 . 0 0 "[ . 1 . 2]" 1
1229 1 24 VAL HA 1 24 VAL MG1 2.538 . 3.343 2.442 2.393 2.486 . 0 0 "[ . 1 . 2]" 1
1230 1 24 VAL HB 1 24 VAL MG1 2.148 . 2.724 2.130 2.128 2.133 . 0 0 "[ . 1 . 2]" 1
1231 1 49 THR MG 1 56 MET QG 3.646 . 5.308 2.374 1.894 2.903 0.090 19 0 "[ . 1 . 2]" 1
1232 1 66 THR MG 1 67 GLY H 2.577 . 3.407 2.364 2.091 2.663 . 0 0 "[ . 1 . 2]" 1
1233 1 76 VAL H 1 76 VAL QG 2.679 . 3.576 2.356 2.076 2.533 . 0 0 "[ . 1 . 2]" 1
1234 1 53 VAL MG1 1 54 SER H 2.325 . 3.001 2.599 2.479 2.839 . 0 0 "[ . 1 . 2]" 1
1235 1 22 THR H 1 22 THR MG 3.119 . 4.335 3.722 3.687 3.746 . 0 0 "[ . 1 . 2]" 1
1236 1 62 VAL H 1 62 VAL QG 2.294 . 2.952 2.000 1.852 2.059 . 0 0 "[ . 1 . 2]" 1
1237 1 22 THR MG 1 23 ALA H 2.838 . 3.845 3.578 3.404 3.716 . 0 0 "[ . 1 . 2]" 1
1238 1 53 VAL MG1 1 55 ALA H 2.194 . 2.796 2.467 2.342 2.650 . 0 0 "[ . 1 . 2]" 1
1239 1 76 VAL QG 1 111 PHE QD 3.707 . 5.039 2.950 2.431 3.329 . 0 0 "[ . 1 . 2]" 1
1240 1 16 THR MG 1 20 TYR QD 2.830 . 3.831 3.283 3.005 3.606 . 0 0 "[ . 1 . 2]" 1
1241 1 49 THR MG 1 54 SER HA 3.205 . 4.489 3.824 3.372 4.265 . 0 0 "[ . 1 . 2]" 1
1242 1 49 THR MG 1 54 SER QB 3.729 . 5.467 4.637 4.333 5.065 . 0 0 "[ . 1 . 2]" 1
1243 1 50 THR MG 1 53 VAL HB 2.625 . 3.487 3.735 3.118 4.539 1.052 3 7 "[ + * * *1- * . *]" 1
1244 1 74 LEU HB3 1 74 LEU QD 2.209 . 2.819 2.107 2.091 2.292 . 0 0 "[ . 1 . 2]" 1
1245 1 76 VAL HB 1 76 VAL QG 1.991 . 2.474 1.893 1.890 1.894 . 0 0 "[ . 1 . 2]" 1
1246 1 63 VAL QG 1 64 SER H 3.075 . 4.257 3.381 2.954 3.627 . 0 0 "[ . 1 . 2]" 1
1247 1 58 VAL H 1 58 VAL MG2 2.436 . 3.178 2.548 2.352 2.794 . 0 0 "[ . 1 . 2]" 1
1248 1 55 ALA MB 1 56 MET H 2.593 . 3.433 2.730 2.418 2.946 . 0 0 "[ . 1 . 2]" 1
1249 1 11 THR H 1 11 THR MG 3.152 . 4.394 3.762 3.751 3.771 . 0 0 "[ . 1 . 2]" 1
1250 1 58 VAL MG1 1 62 VAL H 2.868 . 3.896 4.204 3.964 4.416 0.520 1 1 "[+ . 1 . 2]" 1
1251 1 17 PHE QE 1 63 VAL QG 3.131 . 4.315 2.470 1.888 2.771 0.018 3 0 "[ . 1 . 2]" 1
1252 1 63 VAL HB 1 63 VAL QG 2.179 . 2.773 1.895 1.892 1.899 . 0 0 "[ . 1 . 2]" 1
1253 1 58 VAL HB 1 58 VAL MG2 1.738 . 2.116 2.123 2.122 2.126 0.010 7 0 "[ . 1 . 2]" 1
1254 1 63 VAL MG1 1 63 VAL MG2 1.630 . 1.962 2.078 2.071 2.083 0.121 18 0 "[ . 1 . 2]" 1
1255 1 92 ALA H 1 92 ALA MB 2.344 . 3.031 2.313 2.257 2.360 . 0 0 "[ . 1 . 2]" 1
1256 1 59 ALA H 1 59 ALA MB 2.462 . 3.220 2.578 2.546 2.640 . 0 0 "[ . 1 . 2]" 1
1257 1 92 ALA MB 1 93 ARG H 3.001 . 4.127 3.082 2.699 3.292 . 0 0 "[ . 1 . 2]" 1
1258 1 36 THR H 1 36 THR MG 2.489 . 3.263 2.483 1.931 3.127 . 0 0 "[ . 1 . 2]" 1
1259 1 119 VAL H 1 119 VAL QG 2.263 . 2.903 2.031 1.902 2.443 . 0 0 "[ . 1 . 2]" 1
1260 1 62 VAL QG 1 80 PRO QD . . 3.325 2.220 1.822 2.472 0.163 17 0 "[ . 1 . 2]" 1
1261 1 119 VAL QG 1 120 PRO QD . . 2.747 2.218 1.974 2.578 . 0 0 "[ . 1 . 2]" 1
1262 1 58 VAL HB 1 58 VAL MG1 1.901 . 2.353 2.126 2.123 2.130 . 0 0 "[ . 1 . 2]" 1
1263 1 76 VAL QG 1 94 ASN H 2.718 . 3.642 3.192 2.745 3.598 . 0 0 "[ . 1 . 2]" 1
1264 1 76 VAL QG 1 111 PHE QE 3.577 . 5.177 3.189 2.881 3.618 . 0 0 "[ . 1 . 2]" 1
1265 1 59 ALA MB 1 60 LYS QE 3.191 . 4.464 4.297 3.664 4.835 0.371 17 0 "[ . 1 . 2]" 1
1266 1 59 ALA MB 1 62 VAL HB 2.401 . 3.122 2.924 2.433 5.001 1.879 16 1 "[ . 1 .+ 2]" 1
1267 1 65 LEU QD 1 76 VAL QG 2.195 . 2.797 2.586 2.043 2.826 0.029 20 0 "[ . 1 . 2]" 1
1268 1 76 VAL MG1 1 76 VAL MG2 1.788 . 2.188 2.083 2.078 2.091 . 0 0 "[ . 1 . 2]" 1
1269 1 23 ALA MB 1 25 GLU H 3.773 . 5.552 4.561 4.461 4.678 . 0 0 "[ . 1 . 2]" 1
1270 1 85 ALA H 1 85 ALA MB 2.115 . 2.674 2.258 2.229 2.287 . 0 0 "[ . 1 . 2]" 1
1271 1 23 ALA HA 1 23 ALA MB 2.218 . 2.833 2.133 2.131 2.135 . 0 0 "[ . 1 . 2]" 1
1272 1 20 TYR HB3 1 23 ALA MB 3.299 . 4.659 3.957 3.595 4.573 . 0 0 "[ . 1 . 2]" 1
1273 1 48 THR H 1 48 THR MG 2.380 . 3.088 2.583 2.052 3.865 0.777 15 2 "[ . 1 + -2]" 1
1274 1 116 ALA HA 1 116 ALA MB 2.141 . 2.714 2.130 2.126 2.133 . 0 0 "[ . 1 . 2]" 1
1275 1 48 THR HB 1 48 THR MG 2.182 . 2.777 2.133 2.131 2.136 . 0 0 "[ . 1 . 2]" 1
1276 1 114 ASP HB2 1 116 ALA MB 2.951 . 4.039 3.550 2.933 5.001 0.962 9 1 "[ . +1 . 2]" 1
1277 1 106 ALA MB 1 107 CYS H 2.555 . 3.371 2.467 2.413 2.579 . 0 0 "[ . 1 . 2]" 1
1278 1 9 ALA MB 1 10 LEU H 2.596 . 3.438 2.444 2.387 2.507 . 0 0 "[ . 1 . 2]" 1
1279 1 28 ALA MB 1 29 LEU H 2.751 . 3.697 2.686 2.472 2.949 . 0 0 "[ . 1 . 2]" 1
1280 1 106 ALA HA 1 106 ALA MB 2.022 . 2.533 2.126 2.123 2.129 . 0 0 "[ . 1 . 2]" 1
1281 1 6 ARG HA 1 9 ALA MB 2.563 . 3.384 2.529 2.258 2.776 . 0 0 "[ . 1 . 2]" 1
1282 1 3 ASN QB 1 106 ALA MB 2.709 . 3.627 3.101 2.156 4.472 0.845 12 2 "[ . 1 + - 2]" 1
1283 1 10 LEU QD 1 106 ALA MB 1.642 . 1.979 2.136 1.953 3.128 1.149 15 1 "[ . 1 + 2]" 1
1284 1 102 ALA MB 1 103 LEU H 2.395 . 3.112 2.602 2.429 2.723 . 0 0 "[ . 1 . 2]" 1
1285 1 40 GLY H 1 44 ILE MG 2.864 . 3.890 2.834 2.629 3.040 . 0 0 "[ . 1 . 2]" 1
1286 1 102 ALA HA 1 102 ALA MB 2.090 . 2.636 2.126 2.124 2.129 . 0 0 "[ . 1 . 2]" 1
1287 1 8 ALA HA 1 8 ALA MB 2.030 . 2.545 2.124 2.121 2.127 . 0 0 "[ . 1 . 2]" 1
1288 1 44 ILE MG 1 45 PRO HD2 2.973 . 4.078 2.316 2.133 2.685 . 0 0 "[ . 1 . 2]" 1
1289 1 39 GLY HA2 1 44 ILE MG 2.414 . 3.142 2.257 2.104 2.499 . 0 0 "[ . 1 . 2]" 1
1290 1 44 ILE HB 1 44 ILE MG 2.140 . 2.712 2.131 2.127 2.133 . 0 0 "[ . 1 . 2]" 1
1291 1 100 ASP QB 1 102 ALA MB 3.897 . 5.795 3.395 3.036 4.161 . 0 0 "[ . 1 . 2]" 1
1292 1 102 ALA MB 1 105 GLN HB2 3.130 . 4.355 4.057 3.710 4.584 0.229 6 0 "[ . 1 . 2]" 1
1293 1 9 ALA MB 1 10 LEU HB2 3.813 . 5.630 4.511 4.237 4.644 . 0 0 "[ . 1 . 2]" 1
1294 1 97 ILE MD 1 98 GLN H 3.239 . 4.551 2.806 2.583 3.070 . 0 0 "[ . 1 . 2]" 1
1295 1 97 ILE H 1 97 ILE MG 2.254 . 2.889 2.232 2.165 2.277 . 0 0 "[ . 1 . 2]" 1
1296 1 74 LEU H 1 97 ILE MD 2.804 . 3.787 2.853 2.698 3.060 . 0 0 "[ . 1 . 2]" 1
1297 1 97 ILE HA 1 97 ILE MD 3.013 . 4.148 2.187 2.073 2.262 . 0 0 "[ . 1 . 2]" 1
1298 1 97 ILE MD 1 97 ILE HG12 1.726 . 2.099 2.113 2.111 2.117 0.018 7 0 "[ . 1 . 2]" 1
1299 1 38 ASP H 1 44 ILE MD 3.040 . 4.195 3.102 2.453 4.892 0.697 6 1 "[ .+ 1 . 2]" 1
1300 1 73 GLY HA3 1 97 ILE MD 2.189 . 2.788 2.764 2.529 2.940 0.152 17 0 "[ . 1 . 2]" 1
1301 1 44 ILE HB 1 44 ILE MD 2.238 . 2.864 2.537 2.420 3.239 0.375 6 0 "[ . 1 . 2]" 1
1302 1 44 ILE MD 1 44 ILE QG 2.056 . 2.585 1.886 1.883 1.888 . 0 0 "[ . 1 . 2]" 1
1303 1 44 ILE MD 1 44 ILE MG 1.759 . 2.146 1.910 1.879 1.951 . 0 0 "[ . 1 . 2]" 1
1304 1 64 SER HA 1 77 VAL HA 3.281 . 4.627 2.348 2.159 2.580 . 0 0 "[ . 1 . 2]" 1
1305 1 64 SER HA 1 64 SER HB3 2.739 . 3.677 2.626 2.335 3.029 . 0 0 "[ . 1 . 2]" 1
1306 1 56 MET HA 1 65 LEU QD 3.522 . 5.072 3.465 2.601 4.076 . 0 0 "[ . 1 . 2]" 1
1307 1 56 MET HA 1 56 MET QG 3.590 . 5.201 3.330 2.474 3.464 . 0 0 "[ . 1 . 2]" 1
1308 1 93 ARG HA 1 93 ARG HB3 2.414 . 3.143 2.477 2.295 2.548 . 0 0 "[ . 1 . 2]" 1
1309 1 78 MET HA 1 92 ALA MB 3.528 . 5.084 4.488 4.199 5.097 0.013 11 0 "[ . 1 . 2]" 1
1310 1 79 THR HB 1 92 ALA MB 2.335 . 3.017 2.043 1.841 2.428 . 0 0 "[ . 1 . 2]" 1
1311 1 18 VAL H 1 18 VAL HA 2.575 . 3.404 2.743 2.721 2.783 . 0 0 "[ . 1 . 2]" 1
1312 1 17 PHE QD 1 18 VAL HA 4.240 . 6.487 4.267 3.839 4.633 . 0 0 "[ . 1 . 2]" 1
1313 1 18 VAL HA 1 19 PRO HD3 3.635 . 5.286 3.941 3.889 3.993 . 0 0 "[ . 1 . 2]" 1
1314 1 18 VAL HA 1 21 ARG QD . . 4.186 3.141 1.934 4.659 0.473 13 0 "[ . 1 . 2]" 1
1315 1 18 VAL HA 1 18 VAL HB 2.718 . 3.642 3.013 3.009 3.021 . 0 0 "[ . 1 . 2]" 1
1316 1 18 VAL HA 1 21 ARG QG 2.544 . 3.353 2.351 2.074 2.752 . 0 0 "[ . 1 . 2]" 1
1317 1 22 THR HB 1 26 LEU QD 3.160 . 4.408 4.149 3.735 4.611 0.203 17 0 "[ . 1 . 2]" 1
1318 1 21 ARG HB2 1 22 THR HB 3.942 . 5.885 5.179 4.919 5.416 . 0 0 "[ . 1 . 2]" 1
1319 1 22 THR HB 1 22 THR MG 2.064 . 2.597 2.134 2.133 2.136 . 0 0 "[ . 1 . 2]" 1
1320 1 24 VAL HA 1 28 ALA H 3.666 . 5.346 4.052 3.809 4.310 . 0 0 "[ . 1 . 2]" 1
1321 1 24 VAL HA 1 27 CYS H 3.194 . 4.469 3.509 3.251 3.767 . 0 0 "[ . 1 . 2]" 1
1322 1 23 ALA MB 1 24 VAL HA 3.505 . 5.041 3.868 3.792 3.910 . 0 0 "[ . 1 . 2]" 1
1323 1 11 THR H 1 11 THR HA 2.895 . 3.943 2.820 2.792 2.835 . 0 0 "[ . 1 . 2]" 1
1324 1 22 THR HA 1 23 ALA H 3.259 . 4.586 3.556 3.538 3.570 . 0 0 "[ . 1 . 2]" 1
1325 1 11 THR HA 1 11 THR MG 2.411 . 3.138 2.375 2.329 2.432 . 0 0 "[ . 1 . 2]" 1
1326 1 11 THR HA 1 14 LEU QD 2.685 . 3.586 3.330 2.940 4.176 0.590 6 3 "[ .+- 1 * . 2]" 1
1327 1 22 THR HA 1 25 GLU H 3.471 . 4.977 3.347 3.174 3.716 . 0 0 "[ . 1 . 2]" 1
1328 1 110 VAL H 1 110 VAL HA 2.822 . 3.818 2.894 2.882 2.904 . 0 0 "[ . 1 . 2]" 1
1329 1 109 ASP QB 1 110 VAL HA 4.384 . 6.786 4.125 3.874 4.252 . 0 0 "[ . 1 . 2]" 1
1330 1 22 THR HA 1 25 GLU QG 2.940 . 4.020 2.863 1.945 3.579 . 0 0 "[ . 1 . 2]" 1
1331 1 22 THR HA 1 22 THR MG 2.327 . 3.004 2.339 2.293 2.368 . 0 0 "[ . 1 . 2]" 1
1332 1 110 VAL HA 1 110 VAL MG2 2.259 . 2.897 2.346 2.296 2.380 . 0 0 "[ . 1 . 2]" 1
1333 1 22 THR HA 1 26 LEU QD 2.794 . 3.770 3.529 2.618 4.564 0.794 9 3 "[ . +1 . * -]" 1
1334 1 11 THR HA 1 110 VAL MG1 2.277 . 2.925 2.104 1.908 2.536 . 0 0 "[ . 1 . 2]" 1
1335 1 75 SER QB 1 96 ASN QB 2.303 . 2.966 2.410 2.218 2.576 . 0 0 "[ . 1 . 2]" 1
1336 1 57 SER H 1 64 SER HB2 3.593 . 5.207 4.349 3.387 5.241 0.034 19 0 "[ . 1 . 2]" 1
1337 1 6 ARG HG3 1 70 SER QB 3.573 . 5.169 3.248 2.354 3.941 . 0 0 "[ . 1 . 2]" 1
1338 1 20 TYR HA 1 20 TYR QD 3.205 . 4.489 2.961 2.658 3.138 . 0 0 "[ . 1 . 2]" 1
1339 1 20 TYR HA 1 20 TYR HB3 2.921 . 3.988 2.567 2.514 2.627 . 0 0 "[ . 1 . 2]" 1
1340 1 45 PRO QB 1 46 SER HB2 3.656 . 5.327 4.727 3.887 5.587 0.260 4 0 "[ . 1 . 2]" 1
1341 1 20 TYR HA 1 23 ALA MB 2.596 . 3.438 2.976 2.570 3.456 0.018 8 0 "[ . 1 . 2]" 1
1342 1 19 PRO HB2 1 20 TYR HA 2.864 . 3.889 3.969 3.873 4.097 0.208 13 0 "[ . 1 . 2]" 1
1343 1 70 SER QB 1 71 LEU QD 2.976 . 4.083 3.107 2.967 3.234 . 0 0 "[ . 1 . 2]" 1
1344 1 104 GLN HA 1 107 CYS HB3 4.236 . 6.479 2.860 2.045 4.278 . 0 0 "[ . 1 . 2]" 1
1345 1 95 CYS QB 1 104 GLN HA 3.143 . 4.378 3.028 2.616 3.865 . 0 0 "[ . 1 . 2]" 1
1346 1 46 SER HB3 1 47 PRO QG 4.858 . 7.808 4.424 3.745 5.296 . 0 0 "[ . 1 . 2]" 1
1347 1 25 GLU HA 1 28 ALA H 3.291 . 4.645 3.351 2.913 3.550 . 0 0 "[ . 1 . 2]" 1
1348 1 24 VAL MG1 1 25 GLU HA 2.528 . 3.327 3.368 3.204 3.552 0.225 19 0 "[ . 1 . 2]" 1
1349 1 13 MET HA 1 13 MET HG2 2.525 . 3.322 3.577 2.450 3.813 0.491 9 0 "[ . 1 . 2]" 1
1350 1 21 ARG HA 1 25 GLU QG 2.808 . 3.793 3.905 3.148 5.134 1.341 17 2 "[ - 1 . + 2]" 1
1351 1 104 GLN QG 1 108 GLU HA 3.763 . 5.533 4.618 4.114 5.348 . 0 0 "[ . 1 . 2]" 1
1352 1 7 LYS HA 1 7 LYS HG3 2.592 . 3.432 3.079 2.433 3.750 0.318 11 0 "[ . 1 . 2]" 1
1353 1 7 LYS HA 1 10 LEU QD 2.363 . 3.061 2.510 2.215 2.726 . 0 0 "[ . 1 . 2]" 1
1354 1 21 ARG HA 1 24 VAL H 3.683 . 5.378 3.179 2.988 3.395 . 0 0 "[ . 1 . 2]" 1
1355 1 30 GLU H 1 30 GLU HA 2.518 . 3.310 2.835 2.792 2.875 . 0 0 "[ . 1 . 2]" 1
1356 1 21 ARG HA 1 22 THR H 3.352 . 4.757 3.550 3.524 3.574 . 0 0 "[ . 1 . 2]" 1
1357 1 51 ARG HA 1 52 TYR H 3.350 . 4.752 3.575 3.546 3.611 . 0 0 "[ . 1 . 2]" 1
1358 1 21 ARG H 1 21 ARG HA 2.622 . 3.481 2.791 2.772 2.809 . 0 0 "[ . 1 . 2]" 1
1359 1 68 GLN QE 1 69 GLU HA 4.089 . 6.171 3.510 3.096 6.267 0.096 9 0 "[ . 1 . 2]" 1
1360 1 69 GLU HA 1 69 GLU HB3 2.541 . 3.348 2.549 2.453 2.942 . 0 0 "[ . 1 . 2]" 1
1361 1 21 ARG HA 1 24 VAL HB 2.784 . 3.753 2.416 2.226 2.682 . 0 0 "[ . 1 . 2]" 1
1362 1 69 GLU HA 1 69 GLU HG3 2.819 . 3.812 3.462 2.948 3.750 . 0 0 "[ . 1 . 2]" 1
1363 1 30 GLU HA 1 30 GLU HB2 2.647 . 3.523 2.486 2.419 2.599 . 0 0 "[ . 1 . 2]" 1
1364 1 51 ARG HA 1 51 ARG HB3 2.362 . 3.059 2.988 2.447 3.024 . 0 0 "[ . 1 . 2]" 1
1365 1 21 ARG HA 1 21 ARG QG 3.127 . 3.619 2.541 2.386 2.910 . 0 0 "[ . 1 . 2]" 1
1366 1 51 ARG HA 1 51 ARG HB2 2.704 . 3.618 2.408 2.338 2.461 . 0 0 "[ . 1 . 2]" 1
1367 1 10 LEU HA 1 14 LEU H 3.565 . 5.154 4.037 3.768 4.253 . 0 0 "[ . 1 . 2]" 1
1368 1 15 GLN HA 1 18 VAL H 2.649 . 3.526 3.343 3.114 3.567 0.041 6 0 "[ . 1 . 2]" 1
1369 1 14 LEU HA 1 17 PHE H 2.738 . 3.675 3.260 3.161 3.398 . 0 0 "[ . 1 . 2]" 1
1370 1 35 ASP H 1 35 ASP HA 2.328 . 3.005 2.745 2.721 2.790 . 0 0 "[ . 1 . 2]" 1
1371 1 14 LEU HA 1 111 PHE QE 3.536 . 5.099 3.488 3.240 3.750 . 0 0 "[ . 1 . 2]" 1
1372 1 14 LEU HA 1 17 PHE HB3 3.297 . 4.656 2.684 2.259 2.867 . 0 0 "[ . 1 . 2]" 1
1373 1 10 LEU HA 1 10 LEU QD 2.232 . 2.854 2.058 1.936 2.159 . 0 0 "[ . 1 . 2]" 1
1374 1 14 LEU HA 1 14 LEU HB2 2.307 . 2.972 2.464 2.419 2.604 . 0 0 "[ . 1 . 2]" 1
1375 1 37 CYS QB 1 60 LYS HA 3.276 . 4.618 3.389 2.949 3.854 . 0 0 "[ . 1 . 2]" 1
1376 1 60 LYS HA 1 60 LYS HG2 2.737 . 3.673 3.125 2.499 3.345 . 0 0 "[ . 1 . 2]" 1
1377 1 34 LEU HA 1 37 CYS H 3.576 . 5.175 3.470 3.248 3.904 . 0 0 "[ . 1 . 2]" 1
1378 1 8 ALA H 1 8 ALA HA 2.738 . 3.675 2.770 2.743 2.803 . 0 0 "[ . 1 . 2]" 1
1379 1 9 ALA HA 1 12 ASP HB3 3.045 . 4.204 3.235 2.516 4.590 0.386 4 0 "[ . 1 . 2]" 1
1380 1 8 ALA MB 1 9 ALA HA 3.413 . 4.869 3.863 3.814 3.928 . 0 0 "[ . 1 . 2]" 1
1381 1 9 ALA HA 1 9 ALA MB 2.185 . 2.782 2.132 2.130 2.136 . 0 0 "[ . 1 . 2]" 1
1382 1 9 ALA HA 1 10 LEU H 3.426 . 4.893 3.524 3.507 3.545 . 0 0 "[ . 1 . 2]" 1
1383 1 80 PRO QD 1 80 PRO HG2 3.499 . 5.029 2.206 2.186 2.233 . 0 0 "[ . 1 . 2]" 1
1384 1 62 VAL HA 1 80 PRO QD 3.537 . 5.100 1.986 1.856 2.146 0.118 20 0 "[ . 1 . 2]" 1
1385 1 47 PRO HD3 1 47 PRO QG 2.536 . 3.340 2.248 2.240 2.253 . 0 0 "[ . 1 . 2]" 1
1386 1 45 PRO HD2 1 45 PRO HG2 2.509 . 3.296 2.309 2.274 2.325 . 0 0 "[ . 1 . 2]" 1
1387 1 44 ILE MG 1 45 PRO HD3 2.434 . 3.175 3.269 3.069 3.573 0.398 15 0 "[ . 1 . 2]" 1
1388 1 44 ILE MD 1 45 PRO HD3 4.303 . 6.618 5.083 3.673 5.609 . 0 0 "[ . 1 . 2]" 1
1389 1 18 VAL QG 1 19 PRO HD3 2.921 . 3.988 2.798 2.716 2.879 . 0 0 "[ . 1 . 2]" 1
1390 1 18 VAL HB 1 19 PRO HD2 3.197 . 4.475 3.130 3.025 3.230 . 0 0 "[ . 1 . 2]" 1
1391 1 18 VAL HB 1 19 PRO HD3 1.850 . 2.278 1.800 1.759 1.833 . 0 0 "[ . 1 . 2]" 1
1392 1 18 VAL QG 1 19 PRO HD2 3.904 . 5.809 3.662 3.608 3.723 . 0 0 "[ . 1 . 2]" 1
1393 1 40 GLY HA3 1 41 SER H 3.241 . 4.554 3.324 3.238 3.424 . 0 0 "[ . 1 . 2]" 1
1394 1 39 GLY HA2 1 44 ILE HB 3.279 . 4.623 3.320 3.120 3.739 . 0 0 "[ . 1 . 2]" 1
1395 1 95 CYS QB 1 104 GLN QG 2.765 . 3.721 2.627 2.179 3.298 . 0 0 "[ . 1 . 2]" 1
1396 1 39 GLY HA3 1 58 VAL HB 2.423 . 3.157 2.287 2.096 2.641 . 0 0 "[ . 1 . 2]" 1
1397 1 74 LEU QD 1 95 CYS QB 2.665 . 3.553 2.228 1.810 3.487 0.190 7 0 "[ . 1 . 2]" 1
1398 1 67 GLY HA3 1 74 LEU HB3 4.337 . 6.688 5.687 5.105 6.447 . 0 0 "[ . 1 . 2]" 1
1399 1 61 GLY QA 1 63 VAL QG 2.933 . 4.009 3.618 3.460 3.790 . 0 0 "[ . 1 . 2]" 1
1400 1 121 ARG HB3 1 122 GLY HA3 3.410 . 4.863 4.961 4.304 5.620 0.757 13 3 "[ * . 1- + . 2]" 1
1401 1 65 LEU QB 1 65 LEU QD 2.693 . 3.599 1.937 1.887 2.077 0.034 19 0 "[ . 1 . 2]" 1
1402 1 74 LEU HB2 1 74 LEU QD 2.431 . 3.170 2.141 2.112 2.170 . 0 0 "[ . 1 . 2]" 1
1403 1 51 ARG HA 1 51 ARG HD2 4.215 . 6.436 3.732 2.170 4.962 . 0 0 "[ . 1 . 2]" 1
1404 1 66 THR MG 1 73 GLY HA3 3.563 . 5.150 5.291 4.517 5.875 0.725 13 2 "[ . 1 -+ . 2]" 1
1405 1 21 ARG H 1 21 ARG QD 4.475 . 6.979 4.024 3.422 4.324 . 0 0 "[ . 1 . 2]" 1
1406 1 17 PHE QD 1 21 ARG QD 4.550 . 5.333 3.315 2.836 4.141 . 0 0 "[ . 1 . 2]" 1
1407 1 17 PHE QE 1 21 ARG QD 3.728 . 4.804 3.084 2.452 3.927 . 0 0 "[ . 1 . 2]" 1
1408 1 51 ARG HB3 1 51 ARG HD3 3.475 . 4.985 3.176 2.492 3.752 . 0 0 "[ . 1 . 2]" 1
1409 1 21 ARG QD 1 21 ARG QG 3.219 . 3.360 2.007 1.987 2.095 . 0 0 "[ . 1 . 2]" 1
1410 1 29 LEU H 1 29 LEU HB2 3.381 . 4.810 2.471 2.234 2.632 . 0 0 "[ . 1 . 2]" 1
1411 1 29 LEU HB2 1 29 LEU QD 2.704 . 3.618 2.201 2.110 2.344 . 0 0 "[ . 1 . 2]" 1
1412 1 10 LEU HB2 1 10 LEU QD 2.773 . 3.734 2.243 2.076 2.314 . 0 0 "[ . 1 . 2]" 1
1413 1 34 LEU HB3 1 34 LEU QD 3.253 . 4.575 2.099 2.076 2.118 . 0 0 "[ . 1 . 2]" 1
1414 1 118 LEU H 1 118 LEU HB2 4.082 . 6.165 2.753 2.432 3.940 . 0 0 "[ . 1 . 2]" 1
1415 1 109 ASP HA 1 109 ASP QB 3.155 . 4.400 2.396 2.353 2.494 . 0 0 "[ . 1 . 2]" 1
1416 1 7 LYS QE 1 106 ALA HA 3.844 . 5.691 3.158 1.889 6.543 0.852 1 1 "[+ . 1 . 2]" 1
1417 1 106 ALA HA 1 109 ASP QB 3.156 . 4.038 2.977 2.747 3.208 . 0 0 "[ . 1 . 2]" 1
1418 1 71 LEU HB3 1 103 LEU HA 3.613 . 5.245 5.416 4.483 6.051 0.806 16 4 "[ . 1 -* .+ *2]" 1
1419 1 100 ASP QB 1 103 LEU HG 2.194 . 2.796 2.146 1.994 2.842 0.046 9 0 "[ . 1 . 2]" 1
1420 1 35 ASP QB 1 36 THR MG 2.701 . 3.613 3.226 2.784 4.084 0.471 6 0 "[ . 1 . 2]" 1
1421 1 71 LEU HB3 1 100 ASP QB 4.282 . 6.574 6.518 6.000 7.042 0.468 9 0 "[ . 1 . 2]" 1
1422 1 100 ASP QB 1 103 LEU HB2 3.311 . 4.681 2.877 2.425 3.253 . 0 0 "[ . 1 . 2]" 1
1423 1 14 LEU HB3 1 14 LEU HG 2.944 . 4.028 2.541 2.444 2.596 . 0 0 "[ . 1 . 2]" 1
1424 1 97 ILE MG 1 100 ASP QB 3.166 . 4.419 3.522 3.332 3.793 . 0 0 "[ . 1 . 2]" 1
1425 1 11 THR HA 1 14 LEU HB3 3.308 . 4.676 2.635 2.410 2.869 . 0 0 "[ . 1 . 2]" 1
1426 1 17 PHE HB2 1 111 PHE QE 4.295 . 6.601 4.402 3.423 4.933 . 0 0 "[ . 1 . 2]" 1
1427 1 17 PHE HB3 1 111 PHE QE 4.335 . 6.684 4.569 3.795 4.897 . 0 0 "[ . 1 . 2]" 1
1428 1 113 PHE QB 1 118 LEU HG 3.195 . 4.471 3.388 2.560 4.718 0.247 13 0 "[ . 1 . 2]" 1
1429 1 97 ILE HB 1 97 ILE HG12 2.481 . 3.251 2.502 2.472 2.534 . 0 0 "[ . 1 . 2]" 1
1430 1 17 PHE HB3 1 18 VAL QG 3.964 . 5.928 3.565 3.361 3.648 . 0 0 "[ . 1 . 2]" 1
1431 1 14 LEU QD 1 17 PHE HB2 4.022 . 6.044 3.931 3.637 4.179 . 0 0 "[ . 1 . 2]" 1
1432 1 14 LEU QD 1 17 PHE HB3 3.569 . 5.161 2.958 2.725 3.133 . 0 0 "[ . 1 . 2]" 1
1433 1 49 THR HB 1 50 THR H 2.444 . 3.191 3.234 1.988 3.429 0.238 20 0 "[ . 1 . 2]" 1
1434 1 48 THR H 1 48 THR HB 3.396 . 4.838 3.224 2.651 3.827 . 0 0 "[ . 1 . 2]" 1
1435 1 49 THR HB 1 49 THR MG 2.023 . 2.535 2.132 2.129 2.134 . 0 0 "[ . 1 . 2]" 1
1436 1 16 THR HB 1 16 THR MG 2.225 . 2.844 2.138 2.137 2.140 . 0 0 "[ . 1 . 2]" 1
1437 1 36 THR HB 1 36 THR MG 1.974 . 2.461 2.134 2.129 2.137 . 0 0 "[ . 1 . 2]" 1
1438 1 66 THR HB 1 66 THR MG 1.918 . 2.378 2.137 2.135 2.140 . 0 0 "[ . 1 . 2]" 1
1439 1 13 MET HA 1 16 THR HB 2.985 . 4.099 2.798 2.469 3.078 . 0 0 "[ . 1 . 2]" 1
1440 1 16 THR HA 1 16 THR MG 2.362 . 3.060 2.364 2.324 2.388 . 0 0 "[ . 1 . 2]" 1
1441 1 18 VAL QG 1 19 PRO HA 3.038 . 4.191 3.344 3.204 3.534 . 0 0 "[ . 1 . 2]" 1
1442 1 47 PRO HA 1 58 VAL MG2 3.086 . 4.277 3.352 2.646 3.875 . 0 0 "[ . 1 . 2]" 1
1443 1 19 PRO HA 1 19 PRO HB3 2.355 . 3.048 2.290 2.279 2.298 . 0 0 "[ . 1 . 2]" 1
1444 1 19 PRO HA 1 20 TYR H 3.367 . 4.784 3.562 3.502 3.619 . 0 0 "[ . 1 . 2]" 1
1445 1 19 PRO HA 1 22 THR H 3.453 . 4.943 3.670 3.389 3.892 . 0 0 "[ . 1 . 2]" 1
1446 1 120 PRO HA 1 120 PRO HB3 2.278 . 2.927 2.291 2.259 2.309 . 0 0 "[ . 1 . 2]" 1
1447 1 44 ILE HA 1 45 PRO HD3 3.260 . 4.589 2.003 1.810 2.430 0.121 20 0 "[ . 1 . 2]" 1
1448 1 12 ASP HA 1 12 ASP HB2 2.581 . 3.414 2.594 2.381 3.023 . 0 0 "[ . 1 . 2]" 1
1449 1 12 ASP HA 1 15 GLN HB2 2.322 . 2.996 2.464 2.206 3.003 0.007 18 0 "[ . 1 . 2]" 1
1450 1 44 ILE HA 1 44 ILE MG 2.524 . 3.320 2.411 2.375 2.494 . 0 0 "[ . 1 . 2]" 1
1451 1 26 LEU HA 1 26 LEU QD 2.124 . 2.688 1.923 1.845 2.086 . 0 0 "[ . 1 . 2]" 1
1452 1 74 LEU QD 1 75 SER HA 3.140 . 4.373 3.041 2.831 4.096 . 0 0 "[ . 1 . 2]" 1
1453 1 66 THR MG 1 75 SER HA 3.768 . 5.543 3.294 2.814 3.813 . 0 0 "[ . 1 . 2]" 1
1454 1 75 SER HA 1 76 VAL QG 3.672 . 5.358 3.549 3.396 3.632 . 0 0 "[ . 1 . 2]" 1
1455 1 85 ALA HA 1 85 ALA MB 2.027 . 2.541 2.125 2.121 2.129 . 0 0 "[ . 1 . 2]" 1
1456 1 58 VAL MG1 1 61 GLY QA 3.825 . 5.654 2.961 2.601 3.537 . 0 0 "[ . 1 . 2]" 1
1457 1 73 GLY HA2 1 97 ILE MD 3.602 . 5.223 3.880 3.704 4.084 . 0 0 "[ . 1 . 2]" 1
1458 1 4 TYR HA 1 7 LYS HB2 2.527 . 3.325 2.616 2.158 3.060 . 0 0 "[ . 1 . 2]" 1
1459 1 107 CYS HA 1 107 CYS HB3 2.565 . 3.387 2.883 2.433 3.029 . 0 0 "[ . 1 . 2]" 1
1460 1 119 VAL HA 1 120 PRO QD 2.419 . 2.595 1.930 1.774 1.998 . 0 0 "[ . 1 . 2]" 1
1461 1 58 VAL HA 1 58 VAL MG2 2.078 . 2.618 2.464 2.424 2.491 . 0 0 "[ . 1 . 2]" 1
1462 1 63 VAL HA 1 63 VAL QG 2.368 . 3.069 2.221 2.128 2.294 . 0 0 "[ . 1 . 2]" 1
1463 1 58 VAL HA 1 58 VAL HB 2.985 . 4.099 3.024 3.019 3.028 . 0 0 "[ . 1 . 2]" 1
1464 1 40 GLY HA2 1 41 SER H 3.086 . 4.276 3.251 3.101 3.319 . 0 0 "[ . 1 . 2]" 1
1465 1 95 CYS QB 1 107 CYS HB3 4.486 . 7.001 3.027 2.311 4.576 . 0 0 "[ . 1 . 2]" 1
1466 1 118 LEU HA 1 118 LEU QD 2.336 . 3.018 2.288 2.005 3.453 0.435 13 0 "[ . 1 . 2]" 1
1467 1 11 THR MG 1 12 ASP HA 3.073 . 4.254 3.583 3.340 3.703 . 0 0 "[ . 1 . 2]" 1
1468 1 49 THR HA 1 49 THR MG 2.193 . 2.794 2.271 2.194 2.343 . 0 0 "[ . 1 . 2]" 1
1469 1 97 ILE HA 1 97 ILE HB 2.450 . 3.200 2.392 2.360 2.410 . 0 0 "[ . 1 . 2]" 1
1470 1 49 THR HA 1 56 MET QG 2.620 . 3.478 3.311 2.791 3.738 0.260 9 0 "[ . 1 . 2]" 1
1471 1 119 VAL HA 1 119 VAL HB 2.474 . 3.239 2.573 2.391 3.026 . 0 0 "[ . 1 . 2]" 1
1472 1 13 MET HG3 1 111 PHE HZ 3.146 . 4.383 3.248 2.332 5.130 0.747 10 1 "[ . + . 2]" 1
1473 1 81 GLY H 1 92 ALA H 4.611 . 7.269 3.755 3.345 3.967 . 0 0 "[ . 1 . 2]" 1
1474 1 34 LEU QD 1 91 TRP HE1 3.765 . 5.537 4.661 2.760 5.802 0.265 1 0 "[ . 1 . 2]" 1
1475 1 77 VAL H 1 78 MET H 4.218 . 6.442 3.873 3.773 3.974 . 0 0 "[ . 1 . 2]" 1
1476 1 78 MET H 1 78 MET QB 2.891 . 3.936 2.352 2.271 2.440 . 0 0 "[ . 1 . 2]" 1
1477 1 66 THR H 1 76 VAL H 4.145 . 6.293 4.026 3.966 4.093 . 0 0 "[ . 1 . 2]" 1
1478 1 69 GLU HA 1 72 ASN H 4.130 . 6.262 4.305 4.102 4.509 . 0 0 "[ . 1 . 2]" 1
1479 1 68 GLN H 1 72 ASN H 3.612 . 5.243 4.169 4.084 4.261 . 0 0 "[ . 1 . 2]" 1
1480 1 53 VAL HA 1 68 GLN H 4.259 . 6.526 6.079 4.863 6.787 0.261 18 0 "[ . 1 . 2]" 1
1481 1 68 GLN H 1 68 GLN QG 4.258 . 6.524 3.997 3.803 4.067 . 0 0 "[ . 1 . 2]" 1
1482 1 65 LEU H 1 65 LEU QB 3.162 . 4.411 2.522 2.486 2.583 . 0 0 "[ . 1 . 2]" 1
1483 1 56 MET QB 1 65 LEU H 4.891 . 7.881 5.051 4.545 5.981 . 0 0 "[ . 1 . 2]" 1
1484 1 64 SER QB 1 65 LEU H 3.578 . 5.178 3.397 3.152 3.806 . 0 0 "[ . 1 . 2]" 1
1485 1 56 MET QB 1 64 SER H 4.361 . 6.739 4.844 4.613 5.160 . 0 0 "[ . 1 . 2]" 1
1486 1 58 VAL MG2 1 64 SER H 3.165 . 4.417 3.311 2.921 3.544 . 0 0 "[ . 1 . 2]" 1
1487 1 63 VAL H 1 64 SER HA 4.628 . 7.306 4.124 3.995 4.206 . 0 0 "[ . 1 . 2]" 1
1488 1 58 VAL HA 1 62 VAL H 3.805 . 5.615 4.459 4.321 4.681 . 0 0 "[ . 1 . 2]" 1
1489 1 60 LYS HA 1 62 VAL H 3.778 . 5.562 3.348 3.206 3.517 . 0 0 "[ . 1 . 2]" 1
1490 1 60 LYS HB2 1 62 VAL H 3.568 . 5.159 3.195 2.958 3.412 . 0 0 "[ . 1 . 2]" 1
1491 1 60 LYS QD 1 62 VAL H 5.102 . 8.355 5.519 5.221 5.662 . 0 0 "[ . 1 . 2]" 1
1492 1 34 LEU HG 1 62 VAL H 4.331 . 6.676 6.471 5.960 6.973 0.297 1 0 "[ . 1 . 2]" 1
1493 1 58 VAL HA 1 61 GLY H 3.906 . 5.813 3.849 3.749 4.020 . 0 0 "[ . 1 . 2]" 1
1494 1 34 LEU HB3 1 61 GLY H 3.137 . 4.367 3.751 3.568 4.373 0.006 1 0 "[ . 1 . 2]" 1
1495 1 60 LYS QD 1 61 GLY H 4.399 . 6.817 4.724 4.301 5.902 . 0 0 "[ . 1 . 2]" 1
1496 1 60 LYS QB 1 61 GLY H 4.310 . 6.632 3.883 3.862 3.904 . 0 0 "[ . 1 . 2]" 1
1497 1 60 LYS H 1 60 LYS QB 3.918 . 5.837 3.370 3.286 3.424 . 0 0 "[ . 1 . 2]" 1
1498 1 60 LYS H 1 60 LYS QD 3.209 . 4.496 3.050 2.477 4.640 0.144 17 0 "[ . 1 . 2]" 1
1499 1 37 CYS QB 1 60 LYS H 5.071 . 8.286 3.797 3.276 4.361 . 0 0 "[ . 1 . 2]" 1
1500 1 37 CYS H 1 60 LYS H 4.003 . 6.006 4.045 3.858 4.216 . 0 0 "[ . 1 . 2]" 1
1501 1 58 VAL H 1 59 ALA H 3.479 . 4.992 3.924 3.849 4.040 . 0 0 "[ . 1 . 2]" 1
1502 1 57 SER QB 1 58 VAL H 2.795 . 3.771 3.131 2.720 3.670 . 0 0 "[ . 1 . 2]" 1
1503 1 57 SER H 1 58 VAL HA 3.787 . 5.580 3.836 3.617 3.995 . 0 0 "[ . 1 . 2]" 1
1504 1 57 SER H 1 57 SER QB 2.970 . 4.072 2.729 2.556 3.240 . 0 0 "[ . 1 . 2]" 1
1505 1 57 SER H 1 58 VAL MG2 3.001 . 4.127 3.596 2.907 4.046 . 0 0 "[ . 1 . 2]" 1
1506 1 56 MET H 1 56 MET HB3 2.861 . 3.884 2.657 2.562 3.001 . 0 0 "[ . 1 . 2]" 1
1507 1 53 VAL MG1 1 56 MET H 3.642 . 5.300 3.648 3.408 3.888 . 0 0 "[ . 1 . 2]" 1
1508 1 53 VAL HB 1 54 SER H 3.334 . 4.723 3.806 3.311 4.118 . 0 0 "[ . 1 . 2]" 1
1509 1 54 SER H 1 56 MET HB3 3.964 . 5.928 4.088 3.528 4.475 . 0 0 "[ . 1 . 2]" 1
1510 1 54 SER H 1 56 MET QG 5.040 . 8.215 4.954 4.171 5.354 . 0 0 "[ . 1 . 2]" 1
1511 1 50 THR H 1 53 VAL QG 3.139 . 4.371 2.639 2.354 3.065 . 0 0 "[ . 1 . 2]" 1
1512 1 25 GLU H 1 25 GLU QB 3.022 . 4.164 2.503 2.257 2.608 . 0 0 "[ . 1 . 2]" 1
1513 1 90 GLY QA 1 91 TRP H 2.750 . 3.695 2.274 2.125 2.712 . 0 0 "[ . 1 . 2]" 1
1514 1 41 SER QB 1 42 ASN QD . . 4.797 3.210 2.147 6.000 1.203 3 1 "[ + . 1 . 2]" 1
1515 1 68 GLN QE 1 68 GLN QG 4.580 . 7.202 2.155 2.123 2.196 . 0 0 "[ . 1 . 2]" 1
1516 1 63 VAL H 1 78 MET QB 3.380 . 4.808 2.841 2.130 3.173 . 0 0 "[ . 1 . 2]" 1
1517 1 65 LEU HA 1 78 MET H 4.298 . 6.607 6.473 6.354 6.652 0.045 14 0 "[ . 1 . 2]" 1
1518 1 76 VAL HB 1 78 MET H 3.884 . 5.770 4.886 4.631 6.009 0.239 11 0 "[ . 1 . 2]" 1
1519 1 74 LEU HA 1 98 GLN H 5.159 . 8.486 4.395 4.232 4.721 . 0 0 "[ . 1 . 2]" 1
1520 1 98 GLN H 1 98 GLN QG 3.636 . 5.289 3.122 1.918 4.056 0.065 8 0 "[ . 1 . 2]" 1
1521 1 62 VAL QG 1 92 ALA H 4.051 . 6.102 4.868 3.000 5.741 . 0 0 "[ . 1 . 2]" 1
1522 1 64 SER HA 1 77 VAL H 4.302 . 6.615 4.160 3.928 4.345 . 0 0 "[ . 1 . 2]" 1
1523 1 55 ALA MB 1 76 VAL H 4.370 . 6.757 5.868 5.703 6.060 . 0 0 "[ . 1 . 2]" 1
1524 1 65 LEU QD 1 76 VAL H 4.250 . 6.507 3.040 2.780 3.642 . 0 0 "[ . 1 . 2]" 1
1525 1 101 SER HA 1 102 ALA H 2.531 . 3.332 2.697 2.688 2.719 . 0 0 "[ . 1 . 2]" 1
1526 1 102 ALA H 1 105 GLN QB 4.602 . 7.249 5.227 4.738 5.664 . 0 0 "[ . 1 . 2]" 1
1527 1 97 ILE MG 1 102 ALA H 4.222 . 6.450 4.089 3.981 4.239 . 0 0 "[ . 1 . 2]" 1
1528 1 44 ILE H 1 45 PRO HA 3.872 . 5.746 5.139 4.971 5.316 . 0 0 "[ . 1 . 2]" 1
1529 1 44 ILE H 1 45 PRO HD3 4.810 . 7.701 4.435 4.246 4.727 . 0 0 "[ . 1 . 2]" 1
1530 1 12 ASP H 1 15 GLN QG 4.006 . 6.012 4.593 4.230 6.109 0.097 18 0 "[ . 1 . 2]" 1
1531 1 12 ASP H 1 13 MET QB 4.942 . 7.995 4.411 4.202 5.057 . 0 0 "[ . 1 . 2]" 1
1532 1 9 ALA MB 1 12 ASP H 4.144 . 6.291 4.247 4.133 4.358 . 0 0 "[ . 1 . 2]" 1
1533 1 10 LEU QD 1 12 ASP H 4.698 . 7.457 4.838 4.655 5.058 . 0 0 "[ . 1 . 2]" 1
1534 1 94 ASN HB2 1 95 CYS H 3.459 . 4.954 2.451 2.297 2.530 . 0 0 "[ . 1 . 2]" 1
1535 1 26 LEU QD 1 28 ALA H 4.934 . 7.977 5.111 4.723 5.810 . 0 0 "[ . 1 . 2]" 1
1536 1 74 LEU QD 1 95 CYS H 4.712 . 7.487 4.820 4.351 5.440 . 0 0 "[ . 1 . 2]" 1
1537 1 27 CYS QB 1 28 ALA H 2.793 . 3.768 2.798 2.292 3.684 . 0 0 "[ . 1 . 2]" 1
1538 1 28 ALA H 1 29 LEU HB2 4.404 . 6.829 4.543 4.004 5.142 . 0 0 "[ . 1 . 2]" 1
1539 1 28 ALA H 1 29 LEU QD 4.592 . 7.227 5.141 4.077 5.756 . 0 0 "[ . 1 . 2]" 1
1540 1 38 ASP H 1 41 SER QB 3.850 . 5.703 3.931 2.536 5.410 . 0 0 "[ . 1 . 2]" 1
1541 1 38 ASP H 1 39 GLY HA2 4.285 . 6.581 4.319 4.101 4.585 . 0 0 "[ . 1 . 2]" 1
1542 1 68 GLN HG2 1 69 GLU H 2.735 . 3.670 3.285 2.829 3.460 . 0 0 "[ . 1 . 2]" 1
1543 1 36 THR MG 1 38 ASP H 4.341 . 6.696 5.138 4.558 5.475 . 0 0 "[ . 1 . 2]" 1
1544 1 7 LYS QG 1 8 ALA H 4.340 . 6.694 4.053 3.553 4.302 . 0 0 "[ . 1 . 2]" 1
1545 1 93 ARG HB2 1 94 ASN H 3.697 . 5.406 3.623 2.844 3.944 . 0 0 "[ . 1 . 2]" 1
1546 1 76 VAL HB 1 94 ASN H 4.215 . 6.436 4.830 4.630 4.975 . 0 0 "[ . 1 . 2]" 1
1547 1 65 LEU QD 1 94 ASN H 4.326 . 6.665 4.517 4.197 4.801 . 0 0 "[ . 1 . 2]" 1
1548 1 57 SER HA 1 64 SER H 5.238 . 8.668 4.267 4.044 4.390 . 0 0 "[ . 1 . 2]" 1
1549 1 74 LEU QD 1 97 ILE H 3.790 . 5.586 3.979 3.156 4.201 . 0 0 "[ . 1 . 2]" 1
1550 1 96 ASN QB 1 97 ILE H 3.191 . 4.464 3.770 3.537 3.960 . 0 0 "[ . 1 . 2]" 1
1551 1 5 LEU H 1 7 LYS QB 3.985 . 5.970 4.683 4.287 5.044 . 0 0 "[ . 1 . 2]" 1
1552 1 77 VAL MG2 1 96 ASN H 3.673 . 5.359 3.900 3.577 4.083 . 0 0 "[ . 1 . 2]" 1
1553 1 74 LEU QD 1 96 ASN H 2.588 . 3.425 2.796 2.460 3.066 . 0 0 "[ . 1 . 2]" 1
1554 1 57 SER QB 1 64 SER H 3.716 . 5.442 3.377 2.811 4.547 . 0 0 "[ . 1 . 2]" 1
1555 1 37 CYS H 1 60 LYS QB 4.535 . 7.106 4.577 3.990 4.968 . 0 0 "[ . 1 . 2]" 1
1556 1 5 LEU HB2 1 9 ALA H 3.924 . 5.848 5.088 4.952 5.257 . 0 0 "[ . 1 . 2]" 1
1557 1 71 LEU HA 1 74 LEU H 4.011 . 6.022 4.100 3.972 4.247 . 0 0 "[ . 1 . 2]" 1
1558 1 27 CYS QB 1 37 CYS H 4.463 . 6.953 5.029 4.139 5.634 . 0 0 "[ . 1 . 2]" 1
1559 1 37 CYS H 1 60 LYS QD 3.692 . 5.396 4.216 3.566 5.896 0.500 20 0 "[ . 1 . 2]" 1
1560 1 24 VAL MG1 1 37 CYS H 4.694 . 7.448 4.727 4.360 5.012 . 0 0 "[ . 1 . 2]" 1
1561 1 22 THR HB 1 24 VAL H 4.371 . 6.759 4.463 4.382 4.542 . 0 0 "[ . 1 . 2]" 1
1562 1 3 ASN QB 1 106 ALA H 3.622 . 5.262 4.445 3.935 4.891 . 0 0 "[ . 1 . 2]" 1
1563 1 24 VAL H 1 25 GLU QB 5.045 . 8.227 4.676 4.398 4.858 . 0 0 "[ . 1 . 2]" 1
1564 1 104 GLN QG 1 108 GLU H 3.038 . 4.192 3.510 3.096 4.194 0.002 15 0 "[ . 1 . 2]" 1
1565 1 21 ARG HB2 1 24 VAL H 4.023 . 6.046 4.729 4.563 4.905 . 0 0 "[ . 1 . 2]" 1
1566 1 74 LEU QD 1 75 SER H 2.436 . 3.178 2.462 2.246 2.577 . 0 0 "[ . 1 . 2]" 1
1567 1 121 ARG H 1 121 ARG QD 4.799 . 7.678 4.028 3.309 4.791 . 0 0 "[ . 1 . 2]" 1
1568 1 120 PRO QG 1 121 ARG H 4.838 . 7.763 4.624 4.310 4.769 . 0 0 "[ . 1 . 2]" 1
1569 1 118 LEU H 1 118 LEU QD 3.705 . 5.421 3.291 3.039 3.550 . 0 0 "[ . 1 . 2]" 1
1570 1 101 SER H 1 101 SER QB 2.963 . 4.061 2.476 2.241 2.621 . 0 0 "[ . 1 . 2]" 1
1571 1 13 MET QB 1 14 LEU H 3.252 . 4.574 2.580 2.416 3.453 . 0 0 "[ . 1 . 2]" 1
1572 1 55 ALA H 1 56 MET HB3 3.662 . 5.338 3.860 3.489 4.124 . 0 0 "[ . 1 . 2]" 1
1573 1 19 PRO HD2 1 21 ARG H 4.170 . 6.344 4.260 4.194 4.375 . 0 0 "[ . 1 . 2]" 1
1574 1 14 LEU H 1 15 GLN QG 4.593 . 7.230 4.553 4.342 6.280 . 0 0 "[ . 1 . 2]" 1
1575 1 10 LEU HB2 1 14 LEU H 3.740 . 5.488 5.121 4.964 5.390 . 0 0 "[ . 1 . 2]" 1
1576 1 21 ARG H 1 22 THR MG 4.593 . 7.230 5.340 5.252 5.456 . 0 0 "[ . 1 . 2]" 1
1577 1 78 MET QB 1 79 THR H 4.184 . 6.372 3.884 3.818 3.918 . 0 0 "[ . 1 . 2]" 1
1578 1 124 GLY QA 1 125 LEU H 2.676 . 3.571 2.836 2.732 2.922 . 0 0 "[ . 1 . 2]" 1
1579 1 112 ARG H 1 112 ARG QD 4.549 . 7.135 4.030 3.506 4.714 . 0 0 "[ . 1 . 2]" 1
1580 1 108 GLU QB 1 112 ARG H 4.151 . 6.305 5.443 4.598 5.988 . 0 0 "[ . 1 . 2]" 1
1581 1 125 LEU QD 1 126 GLU H 5.280 . 8.764 3.875 3.142 4.482 . 0 0 "[ . 1 . 2]" 1
1582 1 14 LEU QD 1 112 ARG H 3.628 . 5.273 4.593 4.074 5.233 . 0 0 "[ . 1 . 2]" 1
1583 1 79 THR H 1 91 TRP HA 4.299 . 6.609 4.100 3.971 4.243 . 0 0 "[ . 1 . 2]" 1
1584 1 79 THR H 1 91 TRP HB3 4.847 . 7.784 4.353 3.790 4.741 . 0 0 "[ . 1 . 2]" 1
1585 1 126 GLU H 1 126 GLU QG 3.402 . 4.848 3.231 2.058 4.171 . 0 0 "[ . 1 . 2]" 1
1586 1 125 LEU QB 1 126 GLU H 3.683 . 5.379 3.684 3.271 3.787 . 0 0 "[ . 1 . 2]" 1
1587 1 13 MET H 1 14 LEU HB2 4.365 . 6.746 4.664 4.422 4.757 . 0 0 "[ . 1 . 2]" 1
1588 1 26 LEU HA 1 27 CYS H 2.921 . 3.988 3.369 3.345 3.409 . 0 0 "[ . 1 . 2]" 1
1589 1 100 ASP QB 1 104 GLN H 4.146 . 6.295 4.064 3.778 4.311 . 0 0 "[ . 1 . 2]" 1
1590 1 104 GLN H 1 108 GLU QB 4.130 . 6.262 5.472 5.182 5.924 . 0 0 "[ . 1 . 2]" 1
1591 1 126 GLU H 1 126 GLU QB 2.687 . 3.589 2.424 2.246 2.693 . 0 0 "[ . 1 . 2]" 1
1592 1 84 ASN QB 1 85 ALA H 2.888 . 3.931 2.909 2.573 3.682 . 0 0 "[ . 1 . 2]" 1
1593 1 98 GLN QB 1 100 ASP H 4.834 . 7.755 4.824 4.616 5.121 . 0 0 "[ . 1 . 2]" 1
1594 1 74 LEU HA 1 100 ASP H 5.238 . 8.668 6.199 6.015 6.546 . 0 0 "[ . 1 . 2]" 1
1595 1 6 ARG H 1 6 ARG QD 5.068 . 8.279 4.675 4.352 4.874 . 0 0 "[ . 1 . 2]" 1
1596 1 6 ARG H 1 7 LYS QB 4.714 . 7.491 4.475 4.259 4.683 . 0 0 "[ . 1 . 2]" 1
1597 1 10 LEU QD 1 110 VAL H 3.987 . 5.974 3.869 3.451 4.156 . 0 0 "[ . 1 . 2]" 1
1598 1 14 LEU HA 1 18 VAL H 3.175 . 4.435 3.805 3.721 3.844 . 0 0 "[ . 1 . 2]" 1
1599 1 14 LEU HG 1 17 PHE H 3.874 . 5.750 3.741 3.512 4.238 . 0 0 "[ . 1 . 2]" 1
1600 1 22 THR MG 1 26 LEU H 4.196 . 6.396 3.715 3.588 3.876 . 0 0 "[ . 1 . 2]" 1
1601 1 14 LEU HA 1 17 PHE H 2.946 . 4.031 2.992 2.943 3.066 . 0 0 "[ . 1 . 2]" 1
1602 1 24 VAL MG1 1 26 LEU H 4.377 . 6.771 4.265 4.077 4.494 . 0 0 "[ . 1 . 2]" 1
1603 1 14 LEU HB2 1 17 PHE H 4.084 . 6.008 3.757 3.247 3.973 . 0 0 "[ . 1 . 2]" 1
1604 1 26 LEU H 1 27 CYS QB 4.550 . 7.138 4.548 4.224 5.139 . 0 0 "[ . 1 . 2]" 1
1605 1 17 PHE H 1 17 PHE HB3 2.644 . 3.518 2.347 2.287 2.434 . 0 0 "[ . 1 . 2]" 1
1606 1 17 PHE H 1 20 TYR HB2 4.390 . 6.799 4.724 4.383 4.940 . 0 0 "[ . 1 . 2]" 1
1607 1 25 GLU QG 1 26 LEU H 3.031 . 4.180 3.904 2.275 4.271 0.091 5 0 "[ . 1 . 2]" 1
1608 1 13 MET HG2 1 17 PHE H 4.196 . 6.397 4.275 3.979 4.694 . 0 0 "[ . 1 . 2]" 1
1609 1 25 GLU QB 1 26 LEU H 3.242 . 4.555 2.620 2.434 3.510 . 0 0 "[ . 1 . 2]" 1
1610 1 93 ARG H 1 93 ARG HB3 3.727 . 5.464 2.883 2.010 3.276 . 0 0 "[ . 1 . 2]" 1
1611 1 25 GLU H 1 26 LEU QD 4.393 . 6.805 4.198 3.896 4.831 . 0 0 "[ . 1 . 2]" 1
1612 1 4 TYR QB 1 7 LYS H 4.494 . 7.019 4.317 3.872 4.506 . 0 0 "[ . 1 . 2]" 1
1613 1 7 LYS H 1 7 LYS QB 2.293 . 2.950 2.323 2.052 2.474 . 0 0 "[ . 1 . 2]" 1
1614 1 7 LYS H 1 7 LYS QG 3.185 . 4.453 2.895 2.326 4.050 . 0 0 "[ . 1 . 2]" 1
1615 1 107 CYS H 1 108 GLU QB 4.527 . 7.089 4.086 3.783 4.440 . 0 0 "[ . 1 . 2]" 1
1616 1 6 ARG HG2 1 107 CYS H 4.418 . 6.858 5.143 4.761 5.501 . 0 0 "[ . 1 . 2]" 1
1617 1 29 LEU QD 1 30 GLU H 4.514 . 7.061 4.168 3.845 4.316 . 0 0 "[ . 1 . 2]" 1
1618 1 107 CYS H 1 109 ASP QB 3.942 . 5.884 4.785 4.627 5.071 . 0 0 "[ . 1 . 2]" 1
1619 1 10 LEU QD 1 107 CYS H 3.173 . 4.432 3.139 2.965 3.349 . 0 0 "[ . 1 . 2]" 1
1620 1 104 GLN HB3 1 107 CYS H 4.511 . 7.055 4.481 4.325 4.685 . 0 0 "[ . 1 . 2]" 1
1621 1 62 VAL H 1 78 MET QB 4.595 . 7.235 6.755 5.977 7.160 . 0 0 "[ . 1 . 2]" 1
1622 1 7 LYS HD3 1 107 CYS H 4.236 . 6.479 5.386 4.974 5.737 . 0 0 "[ . 1 . 2]" 1
1623 1 15 GLN HA 1 16 THR H 2.695 . 3.603 2.743 2.732 2.749 . 0 0 "[ . 1 . 2]" 1
1624 1 12 ASP QB 1 16 THR H 4.615 . 7.278 4.632 4.347 5.008 . 0 0 "[ . 1 . 2]" 1
1625 1 15 GLN QG 1 16 THR H 4.378 . 6.773 4.229 3.896 4.408 . 0 0 "[ . 1 . 2]" 1
1626 1 8 ALA MB 1 10 LEU H 3.903 . 5.808 4.369 4.074 4.623 . 0 0 "[ . 1 . 2]" 1
1627 1 29 LEU H 1 29 LEU HB2 3.002 . 4.128 2.370 2.195 2.614 . 0 0 "[ . 1 . 2]" 1
1628 1 6 ARG QD 1 72 ASN H 4.335 . 6.684 6.283 5.450 7.417 0.733 19 2 "[ . 1 - . +2]" 1
1629 1 12 ASP QB 1 15 GLN H 4.460 . 6.947 4.816 4.712 4.940 . 0 0 "[ . 1 . 2]" 1
1630 1 25 GLU HA 1 29 LEU H 4.272 . 6.553 3.754 3.460 3.902 . 0 0 "[ . 1 . 2]" 1
1631 1 111 PHE H 1 112 ARG QD 4.993 . 8.110 6.161 5.643 6.687 . 0 0 "[ . 1 . 2]" 1
1632 1 69 GLU HB3 1 72 ASN H 4.229 . 6.465 5.683 5.330 5.939 . 0 0 "[ . 1 . 2]" 1
1633 1 15 GLN H 1 15 GLN QG 2.626 . 3.488 2.446 2.256 4.029 0.541 18 1 "[ . 1 . + 2]" 1
1634 1 29 LEU H 1 29 LEU QD 4.019 . 6.039 3.434 2.485 3.763 . 0 0 "[ . 1 . 2]" 1
1635 1 71 LEU QD 1 72 ASN H 4.152 . 6.307 4.009 3.954 4.064 . 0 0 "[ . 1 . 2]" 1
1636 1 10 LEU QD 1 111 PHE H 4.417 . 6.856 4.378 4.098 4.701 . 0 0 "[ . 1 . 2]" 1
1637 1 10 LEU QD 1 109 ASP H 3.515 . 5.060 4.192 4.026 4.392 . 0 0 "[ . 1 . 2]" 1
1638 1 72 ASN H 1 74 LEU QD 4.259 . 6.526 5.174 5.020 5.448 . 0 0 "[ . 1 . 2]" 1
1639 1 33 GLY QA 1 34 LEU H 2.907 . 3.963 2.174 2.134 2.240 . 0 0 "[ . 1 . 2]" 1
1640 1 108 GLU HA 1 111 PHE H 3.366 . 4.783 3.204 3.028 3.379 . 0 0 "[ . 1 . 2]" 1
1641 1 93 ARG HB3 1 111 PHE H 5.391 . 9.024 4.731 4.239 5.438 . 0 0 "[ . 1 . 2]" 1
1642 1 28 ALA MB 1 29 LEU H 2.850 . 3.865 2.239 2.142 2.334 . 0 0 "[ . 1 . 2]" 1
1643 1 10 LEU QD 1 111 PHE H 4.263 . 6.535 3.976 3.796 4.270 . 0 0 "[ . 1 . 2]" 1
1644 1 71 LEU QD 1 105 GLN H 4.152 . 6.306 4.986 4.713 5.284 . 0 0 "[ . 1 . 2]" 1
1645 1 35 ASP H 1 60 LYS HB3 4.828 . 7.742 3.805 3.566 4.082 . 0 0 "[ . 1 . 2]" 1
1646 1 34 LEU HG 1 35 ASP H 4.280 . 6.570 4.169 4.032 4.245 . 0 0 "[ . 1 . 2]" 1
1647 1 35 ASP H 1 35 ASP QB 2.311 . 2.979 2.427 2.230 2.731 . 0 0 "[ . 1 . 2]" 1
1648 1 55 ALA MB 1 56 MET H 2.598 . 3.442 2.458 2.244 2.601 . 0 0 "[ . 1 . 2]" 1
1649 1 47 PRO HA 1 56 MET H 4.175 . 6.354 5.340 4.709 5.813 . 0 0 "[ . 1 . 2]" 1
1650 1 44 ILE MG 1 46 SER H 4.678 . 7.414 4.471 4.231 4.632 . 0 0 "[ . 1 . 2]" 1
1651 1 45 PRO HA 1 46 SER H 2.114 . 2.673 2.182 2.070 2.319 . 0 0 "[ . 1 . 2]" 1
1652 1 56 MET H 1 57 SER QB 4.241 . 6.490 4.905 4.253 5.502 . 0 0 "[ . 1 . 2]" 1
1653 1 56 MET H 1 56 MET QG 2.376 . 3.082 2.358 2.205 2.488 . 0 0 "[ . 1 . 2]" 1
1654 1 41 SER H 1 41 SER QB 2.434 . 3.174 2.900 2.584 3.221 0.047 18 0 "[ . 1 . 2]" 1
1655 1 11 THR H 1 11 THR HA 2.522 . 3.317 2.675 2.641 2.706 . 0 0 "[ . 1 . 2]" 1
1656 1 11 THR H 1 12 ASP HB2 4.976 . 8.071 3.694 3.317 4.080 . 0 0 "[ . 1 . 2]" 1
1657 1 9 ALA MB 1 11 THR H 3.584 . 5.190 3.707 3.487 3.767 . 0 0 "[ . 1 . 2]" 1
1658 1 39 GLY HA2 1 40 GLY H 2.106 . 2.661 2.119 2.082 2.206 . 0 0 "[ . 1 . 2]" 1
1659 1 40 GLY H 1 44 ILE MD 4.497 . 7.025 4.226 4.011 4.573 . 0 0 "[ . 1 . 2]" 1
1660 1 67 GLY H 1 71 LEU HA 4.420 . 6.862 6.139 5.911 6.403 . 0 0 "[ . 1 . 2]" 1
1661 1 20 TYR HB3 1 22 THR H 4.707 . 7.477 4.709 4.578 4.905 . 0 0 "[ . 1 . 2]" 1
1662 1 98 GLN HA 1 99 SER H 2.925 . 3.994 2.785 2.765 2.805 . 0 0 "[ . 1 . 2]" 1
1663 1 98 GLN QB 1 99 SER H 3.859 . 5.720 3.025 2.682 3.643 . 0 0 "[ . 1 . 2]" 1
1664 1 32 GLY H 1 32 GLY QA 2.505 . 3.289 2.202 2.178 2.231 . 0 0 "[ . 1 . 2]" 1
1665 1 29 LEU HB2 1 32 GLY H 5.226 . 8.640 4.309 4.187 4.414 . 0 0 "[ . 1 . 2]" 1
1666 1 29 LEU QD 1 32 GLY H 4.772 . 7.618 4.685 4.021 5.150 . 0 0 "[ . 1 . 2]" 1
1667 1 32 GLY H 1 33 GLY QA 4.159 . 6.321 4.556 4.361 4.757 . 0 0 "[ . 1 . 2]" 1
1668 1 15 GLN QE 1 15 GLN QG 3.305 . 4.670 2.218 2.133 2.690 . 0 0 "[ . 1 . 2]" 1
1669 1 32 GLY QA 1 33 GLY H 3.147 . 4.385 2.821 2.784 2.864 . 0 0 "[ . 1 . 2]" 1
1670 1 39 GLY H 1 39 GLY QA 2.540 . 3.346 2.209 2.197 2.225 . 0 0 "[ . 1 . 2]" 1
1671 1 39 GLY H 1 58 VAL HA 3.754 . 5.516 3.556 3.213 3.924 . 0 0 "[ . 1 . 2]" 1
1672 1 39 GLY H 1 44 ILE MG 3.949 . 5.899 3.920 3.645 4.088 . 0 0 "[ . 1 . 2]" 1
1673 1 41 SER QB 1 43 GLY H 4.908 . 7.918 4.780 4.440 5.270 . 0 0 "[ . 1 . 2]" 1
1674 1 33 GLY H 1 36 THR H 3.975 . 5.950 4.442 3.872 4.599 . 0 0 "[ . 1 . 2]" 1
1675 1 79 THR H 1 93 ARG H 4.603 . 7.252 4.094 3.996 4.181 . 0 0 "[ . 1 . 2]" 1
1676 1 17 PHE H 1 17 PHE QD 4.107 . 6.215 3.716 3.599 3.796 . 0 0 "[ . 1 . 2]" 1
1677 1 77 VAL H 1 96 ASN H 4.243 . 6.493 4.462 4.218 4.713 . 0 0 "[ . 1 . 2]" 1
1678 1 22 THR H 1 24 VAL H 3.708 . 5.426 3.653 3.543 3.742 . 0 0 "[ . 1 . 2]" 1
1679 1 75 SER H 1 97 ILE H 3.830 . 5.664 3.785 3.721 3.854 . 0 0 "[ . 1 . 2]" 1
1680 1 79 THR H 1 94 ASN H 4.454 . 6.934 4.660 4.260 4.853 . 0 0 "[ . 1 . 2]" 1
1681 1 106 ALA H 1 108 GLU H 3.501 . 5.033 3.844 3.721 3.919 . 0 0 "[ . 1 . 2]" 1
1682 1 13 MET H 1 14 LEU H 2.594 . 3.435 2.385 2.334 2.431 . 0 0 "[ . 1 . 2]" 1
1683 1 77 VAL H 1 95 CYS H 4.198 . 6.400 3.967 3.783 4.067 . 0 0 "[ . 1 . 2]" 1
1684 1 49 THR HB 1 68 GLN QE 5.220 . 8.626 6.002 5.069 6.795 . 0 0 "[ . 1 . 2]" 1
1685 1 5 LEU QD 1 6 ARG H 4.731 . 7.528 3.828 3.663 3.915 . 0 0 "[ . 1 . 2]" 1
1686 1 4 TYR QB 1 4 TYR QE 4.100 . 6.202 3.944 3.936 3.959 . 0 0 "[ . 1 . 2]" 1
1687 1 93 ARG HB3 1 111 PHE QD 4.035 . 6.071 3.160 2.102 4.070 . 0 0 "[ . 1 . 2]" 1
1688 1 10 LEU QD 1 111 PHE QD 3.527 . 5.082 3.228 2.934 3.549 . 0 0 "[ . 1 . 2]" 1
1689 1 10 LEU QD 1 111 PHE QD 3.512 . 5.054 3.361 2.989 3.661 . 0 0 "[ . 1 . 2]" 1
1690 1 74 LEU QD 1 76 VAL QG 2.813 . 3.802 1.983 1.869 2.560 . 0 0 "[ . 1 . 2]" 1
1691 1 14 LEU HG 1 17 PHE QD 3.527 . 5.082 3.241 3.125 3.447 . 0 0 "[ . 1 . 2]" 1
1692 1 77 VAL H 1 77 VAL HB 3.147 . 4.385 2.581 2.346 2.681 . 0 0 "[ . 1 . 2]" 1
1693 1 58 VAL HB 1 59 ALA H 4.090 . 6.181 2.863 2.524 3.281 . 0 0 "[ . 1 . 2]" 1
1694 1 76 VAL H 1 76 VAL HB 2.871 . 3.901 2.175 2.137 2.261 . 0 0 "[ . 1 . 2]" 1
1695 1 28 ALA H 1 28 ALA MB 2.389 . 3.102 2.113 2.089 2.147 . 0 0 "[ . 1 . 2]" 1
1696 1 24 VAL MG1 1 25 GLU H 3.943 . 5.887 3.154 3.040 3.251 . 0 0 "[ . 1 . 2]" 1
1697 1 16 THR MG 1 17 PHE H 4.037 . 6.074 3.595 3.511 3.722 . 0 0 "[ . 1 . 2]" 1
1698 1 14 LEU HB2 1 15 GLN H 4.431 . 6.885 3.370 3.033 3.465 . 0 0 "[ . 1 . 2]" 1
1699 1 24 VAL HB 1 25 GLU H 3.506 . 5.043 2.315 2.180 2.609 . 0 0 "[ . 1 . 2]" 1
1700 1 13 MET H 1 13 MET QB 3.088 . 4.280 2.325 2.230 2.618 . 0 0 "[ . 1 . 2]" 1
1701 1 74 LEU HA 1 96 ASN H 4.422 . 6.866 4.084 3.866 4.303 . 0 0 "[ . 1 . 2]" 1
1702 1 27 CYS HA 1 28 ALA H 3.265 . 4.598 2.798 2.768 2.816 . 0 0 "[ . 1 . 2]" 1
1703 1 54 SER H 1 54 SER HA 3.697 . 5.406 2.536 2.522 2.548 . 0 0 "[ . 1 . 2]" 1
1704 1 16 THR H 1 16 THR HA 3.555 . 5.135 2.739 2.715 2.756 . 0 0 "[ . 1 . 2]" 1
1705 1 30 GLU H 1 30 GLU HA 3.631 . 5.279 2.595 2.371 2.774 . 0 0 "[ . 1 . 2]" 1
1706 1 26 LEU H 1 26 LEU HA 3.154 . 4.397 2.687 2.673 2.708 . 0 0 "[ . 1 . 2]" 1
1707 1 19 PRO HB3 1 20 TYR H 4.260 . 6.529 3.777 3.625 4.008 . 0 0 "[ . 1 . 2]" 1
1708 1 25 GLU H 1 26 LEU H 3.020 . 4.160 2.365 2.323 2.405 . 0 0 "[ . 1 . 2]" 1
1709 1 26 LEU H 1 27 CYS H 2.916 . 3.979 2.312 2.259 2.387 . 0 0 "[ . 1 . 2]" 1
1710 1 17 PHE QE 1 111 PHE QD 3.259 . 4.586 4.276 2.225 5.728 1.142 15 5 "[ *. * 1 -+ * 2]" 1
1711 1 62 VAL QG 1 78 MET H 3.796 . 5.597 3.474 3.311 3.912 . 0 0 "[ . 1 . 2]" 1
1712 1 65 LEU QD 1 66 THR H 4.615 . 7.278 3.894 3.519 4.183 . 0 0 "[ . 1 . 2]" 1
1713 1 10 LEU QD 1 107 CYS H 3.530 . 5.088 3.010 2.875 3.157 . 0 0 "[ . 1 . 2]" 1
1714 1 22 THR H 1 23 ALA MB 4.378 . 6.774 3.394 3.340 3.473 . 0 0 "[ . 1 . 2]" 1
1715 1 14 LEU QD 1 17 PHE QE 3.344 . 4.742 3.608 3.333 3.888 . 0 0 "[ . 1 . 2]" 1
1716 1 14 LEU QD 1 17 PHE QD 3.573 . 5.169 2.711 2.323 2.963 . 0 0 "[ . 1 . 2]" 1
1717 1 10 LEU QD 1 111 PHE QE 3.615 . 5.249 2.612 1.942 2.997 0.039 4 0 "[ . 1 . 2]" 1
1718 1 40 GLY H 1 58 VAL MG2 3.981 . 5.962 5.129 4.748 5.585 . 0 0 "[ . 1 . 2]" 1
1719 1 20 TYR QD 1 21 ARG HG3 3.966 . 5.932 4.664 4.063 5.647 . 0 0 "[ . 1 . 2]" 1
1720 1 14 LEU HG 1 111 PHE QD 4.145 . 6.292 4.376 3.804 4.644 . 0 0 "[ . 1 . 2]" 1
1721 1 14 LEU HG 1 111 PHE QD 4.256 . 6.520 4.418 4.030 4.901 . 0 0 "[ . 1 . 2]" 1
1722 1 28 ALA MB 1 33 GLY H 3.659 . 5.333 3.953 3.498 4.159 . 0 0 "[ . 1 . 2]" 1
1723 1 71 LEU HA 1 74 LEU MD1 3.339 . 4.732 3.217 3.034 3.374 . 0 0 "[ . 1 . 2]" 1
1724 1 50 THR HB 1 53 VAL MG2 3.565 . 5.154 3.609 3.063 3.884 . 0 0 "[ . 1 . 2]" 1
1725 1 16 THR HB 1 16 THR MG 2.345 . 3.032 1.980 1.968 1.997 . 0 0 "[ . 1 . 2]" 1
1726 1 49 THR HB 1 53 VAL MG1 2.222 . 2.839 2.278 1.944 2.739 . 0 0 "[ . 1 . 2]" 1
1727 1 49 THR HB 1 49 THR MG 2.118 . 2.679 1.905 1.895 2.008 . 0 0 "[ . 1 . 2]" 1
1728 1 26 LEU HA 1 26 LEU QD 2.209 . 2.819 1.826 1.741 1.948 . 0 0 "[ . 1 . 2]" 1
1729 1 71 LEU QD 1 106 ALA HA 3.060 . 4.231 4.411 4.039 4.706 0.475 16 0 "[ . 1 . 2]" 1
1730 1 64 SER QB 1 77 VAL MG2 2.802 . 3.783 2.830 2.426 3.029 . 0 0 "[ . 1 . 2]" 1
1731 1 39 GLY QA 1 58 VAL MG2 2.794 . 3.770 3.054 2.643 3.603 . 0 0 "[ . 1 . 2]" 1
1732 1 106 ALA HA 1 106 ALA MB 2.158 . 2.740 1.896 1.893 1.898 . 0 0 "[ . 1 . 2]" 1
1733 1 48 THR HB 1 48 THR MG 2.024 . 2.536 1.902 1.901 1.904 . 0 0 "[ . 1 . 2]" 1
1734 1 80 PRO HA 1 80 PRO QB 2.373 . 3.077 2.116 2.100 2.138 . 0 0 "[ . 1 . 2]" 1
1735 1 22 THR HA 1 22 THR MG 2.317 . 2.988 2.070 2.046 2.086 . 0 0 "[ . 1 . 2]" 1
1736 1 34 LEU HA 1 34 LEU HB3 2.485 . 3.257 2.130 2.082 2.155 . 0 0 "[ . 1 . 2]" 1
1737 1 17 PHE HB2 1 21 ARG QG 3.506 . 5.042 3.815 3.657 4.082 . 0 0 "[ . 1 . 2]" 1
1738 1 114 ASP HA 1 114 ASP HB2 3.057 . 4.225 2.492 2.205 2.701 . 0 0 "[ . 1 . 2]" 1
1739 1 18 VAL MG1 1 18 VAL MG2 1.879 . 2.320 1.855 1.851 1.859 . 0 0 "[ . 1 . 2]" 1
1740 1 5 LEU MD2 1 5 LEU HG 2.154 . 2.734 1.873 1.869 1.876 . 0 0 "[ . 1 . 2]" 1
1741 1 18 VAL HB 1 18 VAL QG . . 2.019 1.688 1.685 1.689 . 0 0 "[ . 1 . 2]" 1
1742 1 37 CYS QB 1 58 VAL MG1 2.829 . 3.829 3.625 3.036 4.346 0.517 17 1 "[ . 1 . + 2]" 1
1743 1 97 ILE MD 1 100 ASP QB 3.527 . 5.082 2.389 2.075 2.739 . 0 0 "[ . 1 . 2]" 1
1744 1 51 ARG HD2 1 51 ARG QG 2.785 . 3.754 2.156 1.784 2.350 0.032 1 0 "[ . 1 . 2]" 1
1745 1 125 LEU HA 1 125 LEU HB2 2.943 . 4.026 2.749 2.379 2.894 . 0 0 "[ . 1 . 2]" 1
1746 1 29 LEU HA 1 29 LEU HB2 2.559 . 3.377 2.562 2.371 2.856 . 0 0 "[ . 1 . 2]" 1
1747 1 25 GLU HA 1 25 GLU QB 2.627 . 3.490 2.352 2.177 2.458 . 0 0 "[ . 1 . 2]" 1
1748 1 69 GLU HB3 1 71 LEU QD 4.221 . 6.448 4.108 2.881 4.687 . 0 0 "[ . 1 . 2]" 1
1749 1 11 THR MG 1 15 GLN QG 2.796 . 3.774 2.551 2.304 4.477 0.703 18 1 "[ . 1 . + 2]" 1
1750 1 14 LEU QD 1 15 GLN QG 3.654 . 5.323 3.842 3.321 5.655 0.332 18 0 "[ . 1 . 2]" 1
1751 1 82 TRP HE1 1 84 ASN QB 4.652 . 7.357 6.716 3.388 9.504 2.147 7 7 "[ *.*+- 1** . *2]" 1
1752 1 3 ASN QB 1 4 TYR QD 4.029 . 6.058 5.517 4.316 6.502 0.444 4 0 "[ . 1 . 2]" 1
1753 1 96 ASN QB 1 96 ASN HD21 3.853 . 5.708 2.286 2.142 2.809 . 0 0 "[ . 1 . 2]" 1
1754 1 104 GLN H 1 104 GLN QG 3.333 . 4.721 3.243 3.125 3.376 . 0 0 "[ . 1 . 2]" 1
1755 1 12 ASP HB2 1 15 GLN QG 3.388 . 4.823 5.044 4.416 5.712 0.889 17 5 "[ *. * - . +* 2]" 1
1756 1 114 ASP H 1 117 ASN HB2 2.850 . 3.865 3.849 2.704 4.688 0.823 2 4 "[ + . 1 . * -*]" 1
1757 1 3 ASN HA 1 3 ASN QB 3.192 . 4.465 2.376 2.181 2.484 . 0 0 "[ . 1 . 2]" 1
1758 1 3 ASN QB 1 6 ARG H 3.278 . 4.621 3.787 2.625 4.355 . 0 0 "[ . 1 . 2]" 1
1759 1 104 GLN QG 1 107 CYS HB2 4.071 . 6.142 5.372 5.036 5.959 . 0 0 "[ . 1 . 2]" 1
1760 1 4 TYR QB 1 4 TYR QD 2.915 . 3.977 2.145 2.138 2.179 . 0 0 "[ . 1 . 2]" 1
1761 1 25 GLU HA 1 25 GLU QG 3.372 . 4.793 2.784 2.419 3.350 . 0 0 "[ . 1 . 2]" 1
1762 1 4 TYR QB 1 7 LYS HB2 3.991 . 5.982 4.242 3.773 4.673 . 0 0 "[ . 1 . 2]" 1
1763 1 56 MET QB 1 56 MET QG 2.819 . 3.812 2.065 1.977 2.090 . 0 0 "[ . 1 . 2]" 1
1764 1 53 VAL MG1 1 56 MET HB3 2.532 . 3.333 2.394 1.992 3.548 0.215 5 0 "[ . 1 . 2]" 1
1765 1 37 CYS QB 1 44 ILE MD 2.738 . 3.675 2.619 2.078 3.455 . 0 0 "[ . 1 . 2]" 1
1766 1 126 GLU HA 1 126 GLU QG 3.389 . 4.824 2.708 2.344 3.493 . 0 0 "[ . 1 . 2]" 1
1767 1 58 VAL HB 1 58 VAL MG1 1.961 . 2.442 1.772 1.771 1.774 . 0 0 "[ . 1 . 2]" 1
1768 1 98 GLN HA 1 98 GLN HG2 3.198 . 4.476 2.637 2.201 3.549 . 0 0 "[ . 1 . 2]" 1
1769 1 53 VAL HB 1 54 SER HA 4.010 . 6.020 4.802 4.680 4.920 . 0 0 "[ . 1 . 2]" 1
1770 1 73 GLY HA3 1 98 GLN HG2 4.011 . 6.022 5.264 4.649 6.418 0.396 6 0 "[ . 1 . 2]" 1
1771 1 105 GLN QB 1 105 GLN QG 2.188 . 2.786 2.043 1.966 2.086 . 0 0 "[ . 1 . 2]" 1
1772 1 98 GLN QB 1 98 GLN QG 2.001 . 2.501 1.928 1.875 1.961 . 0 0 "[ . 1 . 2]" 1
1773 1 53 VAL HB 1 53 VAL QG 1.825 . 2.241 1.691 1.689 1.693 . 0 0 "[ . 1 . 2]" 1
1774 1 7 LYS QB 1 7 LYS HG2 2.303 . 2.966 2.121 2.107 2.129 . 0 0 "[ . 1 . 2]" 1
1775 1 24 VAL HB 1 24 VAL QG 2.143 . 2.717 1.898 1.896 1.899 . 0 0 "[ . 1 . 2]" 1
1776 1 56 MET H 1 56 MET QG 3.371 . 4.791 2.377 2.278 2.462 . 0 0 "[ . 1 . 2]" 1
1777 1 78 MET QB 1 91 TRP HD1 3.639 . 5.294 4.582 3.891 5.392 0.098 3 0 "[ . 1 . 2]" 1
1778 1 17 PHE QE 1 78 MET QB 4.398 . 6.815 3.735 3.188 4.656 . 0 0 "[ . 1 . 2]" 1
1779 1 53 VAL MG1 1 56 MET QG 3.044 . 4.202 2.364 2.048 2.834 . 0 0 "[ . 1 . 2]" 1
1780 1 121 ARG H 1 121 ARG HB3 3.175 . 4.435 3.342 2.580 3.650 . 0 0 "[ . 1 . 2]" 1
1781 1 112 ARG HA 1 112 ARG QB 2.640 . 3.511 2.228 2.172 2.459 . 0 0 "[ . 1 . 2]" 1
1782 1 112 ARG HB3 1 112 ARG QD 2.692 . 3.598 2.617 2.343 3.490 . 0 0 "[ . 1 . 2]" 1
1783 1 112 ARG QB 1 112 ARG QD 2.584 . 3.419 2.287 2.122 2.777 . 0 0 "[ . 1 . 2]" 1
1784 1 108 GLU QG 1 112 ARG QB 3.248 . 4.567 4.116 2.637 4.934 0.367 3 0 "[ . 1 . 2]" 1
1785 1 60 LYS QB 1 60 LYS QE 4.359 . 6.580 3.721 3.512 3.866 . 0 0 "[ . 1 . 2]" 1
1786 1 51 ARG HB2 1 51 ARG QD 3.071 . 4.250 2.513 2.349 3.308 . 0 0 "[ . 1 . 2]" 1
1787 1 7 LYS H 1 7 LYS HD2 4.059 . 6.118 4.047 3.313 4.725 . 0 0 "[ . 1 . 2]" 1
1788 1 60 LYS QB 1 60 LYS HG2 2.478 . 3.246 2.162 2.103 2.288 . 0 0 "[ . 1 . 2]" 1
1789 1 97 ILE MD 1 97 ILE HG13 2.140 . 2.713 2.009 1.997 2.018 . 0 0 "[ . 1 . 2]" 1
1790 1 7 LYS QE 1 105 GLN HB2 3.470 . 4.975 5.354 3.667 8.703 3.728 1 9 "[+ .* * 1 -* .* ***]" 1
1791 1 108 GLU QB 1 108 GLU QG 2.881 . 3.919 2.077 2.021 2.087 . 0 0 "[ . 1 . 2]" 1
1792 1 98 GLN QB 1 98 GLN QG 2.134 . 2.703 2.055 1.991 2.088 . 0 0 "[ . 1 . 2]" 1
1793 1 97 ILE MG 1 108 GLU QB 4.042 . 6.085 5.527 4.951 6.278 0.193 15 0 "[ . 1 . 2]" 1
1794 1 104 GLN H 1 104 GLN HB2 2.403 . 3.125 2.264 2.155 2.324 . 0 0 "[ . 1 . 2]" 1
1795 1 19 PRO HG2 1 20 TYR QD 4.664 . 7.383 4.020 3.831 4.314 . 0 0 "[ . 1 . 2]" 1
1796 1 19 PRO HD2 1 19 PRO HG2 2.281 . 2.931 1.998 1.993 2.002 . 0 0 "[ . 1 . 2]" 1
1797 1 24 VAL MG1 1 25 GLU QB 4.007 . 6.014 4.649 4.260 4.847 . 0 0 "[ . 1 . 2]" 1
1798 1 112 ARG QG 1 113 PHE H 3.535 . 5.097 3.745 2.564 4.225 . 0 0 "[ . 1 . 2]" 1
1799 1 26 LEU HA 1 26 LEU HG 3.004 . 4.132 2.982 2.765 3.261 . 0 0 "[ . 1 . 2]" 1
1800 1 112 ARG HA 1 112 ARG QG 3.245 . 4.561 2.792 2.109 3.114 . 0 0 "[ . 1 . 2]" 1
1801 1 112 ARG HA 1 112 ARG HG2 3.197 . 4.475 2.977 2.153 3.363 . 0 0 "[ . 1 . 2]" 1
1802 1 112 ARG QD 1 112 ARG HG2 2.347 . 3.035 2.293 2.167 2.386 . 0 0 "[ . 1 . 2]" 1
1803 1 6 ARG QD 1 6 ARG HG2 2.425 . 3.160 2.130 2.021 2.294 . 0 0 "[ . 1 . 2]" 1
1804 1 34 LEU QB 1 34 LEU HG 2.106 . 2.660 2.444 2.369 2.522 . 0 0 "[ . 1 . 2]" 1
1805 1 5 LEU QD 1 5 LEU HG 2.171 . 2.760 1.896 1.892 1.898 . 0 0 "[ . 1 . 2]" 1
1806 1 5 LEU HA 1 5 LEU HG 3.244 . 4.559 2.759 2.682 2.936 . 0 0 "[ . 1 . 2]" 1
1807 1 6 ARG QD 1 71 LEU HG 3.034 . 4.185 3.919 2.746 5.755 1.570 12 4 "[ . 1-+ * *2]" 1
1808 1 115 ASP QB 1 118 LEU QD 3.388 . 4.823 3.691 3.076 4.459 . 0 0 "[ . 1 . 2]" 1
1809 1 7 LYS QD 1 7 LYS HG2 2.005 . 2.508 1.975 1.963 1.999 . 0 0 "[ . 1 . 2]" 1
1810 1 118 LEU HB2 1 118 LEU QD 1.820 . 2.234 1.802 1.763 1.814 . 0 0 "[ . 1 . 2]" 1
1811 1 7 LYS QD 1 7 LYS HG2 1.959 . 2.439 2.086 2.077 2.092 . 0 0 "[ . 1 . 2]" 1
1812 1 24 VAL MG2 1 25 GLU QG 4.290 . 6.591 4.692 4.452 5.316 . 0 0 "[ . 1 . 2]" 1
1813 1 29 LEU QD 1 29 LEU HG 1.817 . 2.230 1.894 1.893 1.896 . 0 0 "[ . 1 . 2]" 1
1814 1 34 LEU QB 1 34 LEU MD1 2.049 . 2.574 2.056 2.043 2.071 . 0 0 "[ . 1 . 2]" 1
1815 1 14 LEU H 1 14 LEU QD 4.114 . 6.229 3.507 3.412 3.592 . 0 0 "[ . 1 . 2]" 1
1816 1 71 LEU QD 1 103 LEU H 3.207 . 4.492 3.831 3.506 4.293 . 0 0 "[ . 1 . 2]" 1
1817 1 14 LEU QD 1 18 VAL H 4.041 . 6.082 3.820 3.299 4.054 . 0 0 "[ . 1 . 2]" 1
1818 1 4 TYR QB 1 5 LEU MD2 3.006 . 4.136 2.610 2.013 3.736 . 0 0 "[ . 1 . 2]" 1
1819 1 34 LEU QD 1 86 ASN QB 4.172 . 6.348 6.049 2.833 8.927 2.579 7 8 "[ * . +* 1 * .* *-*]" 1
1820 1 14 LEU HB3 1 14 LEU QD 2.824 . 3.821 2.022 1.796 2.190 0.031 18 0 "[ . 1 . 2]" 1
1821 1 125 LEU QB 1 125 LEU MD2 2.156 . 2.737 2.286 2.074 2.340 . 0 0 "[ . 1 . 2]" 1
1822 1 5 LEU HB3 1 5 LEU QD 1.961 . 2.442 2.121 2.103 2.305 . 0 0 "[ . 1 . 2]" 1
1823 1 74 LEU QD 1 96 ASN H 3.230 . 4.534 3.062 2.481 3.422 . 0 0 "[ . 1 . 2]" 1
1824 1 49 THR MG 1 54 SER H 3.983 . 5.966 3.498 3.008 3.629 . 0 0 "[ . 1 . 2]" 1
1825 1 76 VAL QG 1 77 VAL H 3.726 . 5.462 2.511 2.354 2.696 . 0 0 "[ . 1 . 2]" 1
1826 1 22 THR HB 1 22 THR MG 1.956 . 2.434 1.903 1.901 1.904 . 0 0 "[ . 1 . 2]" 1
1827 1 68 GLN QG 1 76 VAL QG 3.117 . 4.331 4.145 3.375 4.810 0.479 18 0 "[ . 1 . 2]" 1
1828 1 119 VAL QG 1 121 ARG QD 2.638 . 3.508 3.590 2.317 6.086 2.578 17 8 "[ * . * *-*.*+ *]" 1
1829 1 55 ALA MB 1 56 MET HB3 3.184 . 4.451 4.103 3.986 4.176 . 0 0 "[ . 1 . 2]" 1
1830 1 58 VAL H 1 58 VAL MG1 3.623 . 5.264 3.290 3.174 3.365 . 0 0 "[ . 1 . 2]" 1
1831 1 39 GLY QA 1 58 VAL MG1 3.118 . 4.333 3.178 2.767 3.639 . 0 0 "[ . 1 . 2]" 1
1832 1 62 VAL QG 1 80 PRO QD 2.752 . 3.699 2.161 1.819 2.379 . 0 0 "[ . 1 . 2]" 1
1833 1 119 VAL HB 1 119 VAL QG 1.771 . 2.163 1.894 1.891 1.898 . 0 0 "[ . 1 . 2]" 1
1834 1 76 VAL QG 1 78 MET QB 3.131 . 4.356 3.303 2.945 3.621 . 0 0 "[ . 1 . 2]" 1
1835 1 84 ASN QB 1 85 ALA MB 3.273 . 4.612 3.908 3.507 4.620 0.008 12 0 "[ . 1 . 2]" 1
1836 1 47 PRO HB2 1 48 THR MG 3.219 . 4.514 3.853 3.444 4.252 . 0 0 "[ . 1 . 2]" 1
1837 1 28 ALA MB 1 29 LEU HB2 2.905 . 3.960 3.514 2.884 4.044 0.084 5 0 "[ . 1 . 2]" 1
1838 1 6 ARG QD 1 106 ALA MB 2.872 . 3.903 3.045 2.089 6.169 2.266 15 1 "[ . 1 + 2]" 1
1839 1 9 ALA MB 1 12 ASP QB 4.055 . 6.111 3.972 3.716 4.125 . 0 0 "[ . 1 . 2]" 1
1840 1 105 GLN QB 1 106 ALA MB 3.092 . 4.287 3.723 3.557 3.868 . 0 0 "[ . 1 . 2]" 1
1841 1 3 ASN QB 1 102 ALA MB 4.220 . 6.446 5.592 3.980 6.943 0.497 1 0 "[ . 1 . 2]" 1
1842 1 44 ILE HA 1 44 ILE MD 3.399 . 4.843 3.283 2.078 3.502 . 0 0 "[ . 1 . 2]" 1
1843 1 97 ILE HB 1 97 ILE MD 1.879 . 2.320 1.978 1.970 1.989 . 0 0 "[ . 1 . 2]" 1
1844 1 72 ASN HB3 1 97 ILE MD 3.017 . 4.155 4.414 4.149 4.737 0.582 4 2 "[ +. 1 . -]" 1
1845 1 64 SER HA 1 65 LEU HG 4.008 . 6.016 4.158 3.866 4.591 . 0 0 "[ . 1 . 2]" 1
1846 1 64 SER HA 1 65 LEU QB 4.485 . 7.000 4.182 4.113 4.245 . 0 0 "[ . 1 . 2]" 1
1847 1 64 SER HA 1 77 VAL QG 2.936 . 4.014 3.030 2.708 3.304 . 0 0 "[ . 1 . 2]" 1
1848 1 56 MET HA 1 57 SER QB 4.093 . 6.187 4.215 3.932 4.431 . 0 0 "[ . 1 . 2]" 1
1849 1 56 MET HA 1 56 MET QB 2.367 . 3.067 2.186 2.156 2.370 . 0 0 "[ . 1 . 2]" 1
1850 1 78 MET HA 1 78 MET QB 2.979 . 4.089 2.379 2.332 2.453 . 0 0 "[ . 1 . 2]" 1
1851 1 18 VAL HA 1 20 TYR H 3.339 . 4.733 3.220 3.007 3.364 . 0 0 "[ . 1 . 2]" 1
1852 1 11 THR HA 1 14 LEU H 3.071 . 4.250 3.074 3.000 3.157 . 0 0 "[ . 1 . 2]" 1
1853 1 57 SER HA 1 57 SER QB 3.056 . 4.223 2.348 2.193 2.423 . 0 0 "[ . 1 . 2]" 1
1854 1 11 THR HA 1 14 LEU HB3 2.549 . 3.361 2.476 2.320 2.619 . 0 0 "[ . 1 . 2]" 1
1855 1 75 SER QB 1 76 VAL H 3.058 . 4.227 3.509 3.124 3.887 . 0 0 "[ . 1 . 2]" 1
1856 1 75 SER H 1 75 SER QB 2.693 . 3.599 2.524 2.361 2.672 . 0 0 "[ . 1 . 2]" 1
1857 1 64 SER HB3 1 77 VAL QG 2.484 . 3.255 3.129 2.323 4.070 0.815 13 6 "[ * ** - 1 + . * 2]" 1
1858 1 101 SER QB 1 102 ALA MB 3.931 . 5.862 4.094 3.935 4.513 . 0 0 "[ . 1 . 2]" 1
1859 1 53 VAL MG1 1 54 SER QB 3.279 . 4.623 3.004 2.900 3.127 . 0 0 "[ . 1 . 2]" 1
1860 1 99 SER H 1 99 SER HB2 3.578 . 5.178 2.978 2.463 3.406 . 0 0 "[ . 1 . 2]" 1
1861 1 20 TYR H 1 20 TYR HA 2.672 . 3.564 2.397 2.281 2.526 . 0 0 "[ . 1 . 2]" 1
1862 1 99 SER HA 1 99 SER QB 2.568 . 3.392 2.252 2.180 2.387 . 0 0 "[ . 1 . 2]" 1
1863 1 99 SER HA 1 99 SER QB 2.343 . 3.029 2.168 2.042 2.298 . 0 0 "[ . 1 . 2]" 1
1864 1 10 LEU QD 1 70 SER QB 3.591 . 5.203 3.739 2.623 4.643 . 0 0 "[ . 1 . 2]" 1
1865 1 104 GLN H 1 104 GLN HA 2.690 . 3.595 2.712 2.701 2.726 . 0 0 "[ . 1 . 2]" 1
1866 1 101 SER HA 1 104 GLN HA 4.147 . 6.297 4.977 4.771 5.248 . 0 0 "[ . 1 . 2]" 1
1867 1 104 GLN HA 1 104 GLN HB3 2.412 . 3.139 2.390 2.350 2.440 . 0 0 "[ . 1 . 2]" 1
1868 1 108 GLU HA 1 108 GLU QB 2.547 . 3.358 2.270 2.165 2.410 . 0 0 "[ . 1 . 2]" 1
1869 1 7 LYS HA 1 7 LYS QB 2.330 . 3.008 2.423 2.369 2.539 . 0 0 "[ . 1 . 2]" 1
1870 1 108 GLU HA 1 112 ARG QB 3.251 . 4.572 4.264 3.221 4.938 0.366 3 0 "[ . 1 . 2]" 1
1871 1 30 GLU H 1 30 GLU HA 2.476 . 3.242 2.501 2.479 2.528 . 0 0 "[ . 1 . 2]" 1
1872 1 69 GLU HA 1 69 GLU HB2 2.398 . 3.117 2.536 2.250 2.796 . 0 0 "[ . 1 . 2]" 1
1873 1 15 GLN HA 1 15 GLN HB3 2.098 . 2.648 2.262 2.217 2.406 . 0 0 "[ . 1 . 2]" 1
1874 1 35 ASP HA 1 60 LYS QD 1.882 . 2.325 1.947 1.743 2.745 0.420 20 0 "[ . 1 . 2]" 1
1875 1 35 ASP HA 1 35 ASP QB 2.186 . 2.783 2.356 2.275 2.467 . 0 0 "[ . 1 . 2]" 1
1876 1 60 LYS HA 1 60 LYS QD 2.591 . 3.430 2.481 2.030 4.054 0.624 20 3 "[ . 1 *. - +]" 1
1877 1 34 LEU HA 1 60 LYS QD 4.082 . 6.165 5.905 5.260 6.879 0.714 20 1 "[ . 1 . +]" 1
1878 1 34 LEU HA 1 34 LEU QB 2.612 . 3.465 2.384 2.317 2.425 . 0 0 "[ . 1 . 2]" 1
1879 1 9 ALA HA 1 11 THR H 3.630 . 5.278 3.777 3.663 3.853 . 0 0 "[ . 1 . 2]" 1
1880 1 45 PRO HD2 1 45 PRO HG3 2.788 . 3.760 2.128 2.100 2.142 . 0 0 "[ . 1 . 2]" 1
1881 1 120 PRO QD 1 120 PRO QG 2.349 . 3.039 1.964 1.955 1.975 . 0 0 "[ . 1 . 2]" 1
1882 1 95 CYS QB 1 108 GLU QB 3.707 . 5.425 3.238 2.375 4.459 . 0 0 "[ . 1 . 2]" 1
1883 1 38 ASP QB 1 39 GLY HA2 4.364 . 6.745 3.373 3.025 3.640 . 0 0 "[ . 1 . 2]" 1
1884 1 124 GLY QA 1 125 LEU HG 3.712 . 5.435 4.542 3.693 6.219 0.784 14 3 "[ . 1 +. *-]" 1
1885 1 24 VAL MG1 1 61 GLY QA 2.968 . 3.205 2.189 1.824 2.637 0.043 6 0 "[ . 1 . 2]" 1
1886 1 122 GLY QA 1 123 SER H 3.227 . 4.529 2.207 2.087 2.299 . 0 0 "[ . 1 . 2]" 1
1887 1 124 GLY QA 1 125 LEU MD2 3.596 . 5.212 4.014 2.994 5.764 0.552 18 1 "[ . 1 . + 2]" 1
1888 1 74 LEU HB3 1 74 LEU QD 2.653 . 3.533 2.062 2.054 2.112 . 0 0 "[ . 1 . 2]" 1
1889 1 26 LEU HB2 1 27 CYS QB 3.721 . 5.451 4.359 3.934 4.802 . 0 0 "[ . 1 . 2]" 1
1890 1 6 ARG QD 1 10 LEU QD 2.733 . 3.666 3.059 2.553 3.871 0.205 15 0 "[ . 1 . 2]" 1
1891 1 6 ARG QD 1 71 LEU QD 2.962 . 4.058 2.813 2.019 5.198 1.140 15 1 "[ . 1 + 2]" 1
1892 1 33 GLY H 1 33 GLY HA3 2.760 . 3.712 2.022 1.979 2.102 . 0 0 "[ . 1 . 2]" 1
1893 1 51 ARG HD3 1 52 TYR QR 4.242 . 6.491 4.200 2.552 5.674 . 0 0 "[ . 1 . 2]" 1
1894 1 121 ARG HA 1 121 ARG QD 2.875 . 3.908 2.795 2.050 4.272 0.364 8 0 "[ . 1 . 2]" 1
1895 1 17 PHE HB2 1 21 ARG QD 4.738 . 7.544 3.561 2.063 4.558 . 0 0 "[ . 1 . 2]" 1
1896 1 121 ARG QD 1 121 ARG HG2 2.170 . 2.759 2.127 2.118 2.132 . 0 0 "[ . 1 . 2]" 1
1897 1 112 ARG QD 1 112 ARG QG 2.161 . 2.745 2.039 1.976 2.092 . 0 0 "[ . 1 . 2]" 1
1898 1 28 ALA MB 1 33 GLY QA 4.412 . 6.845 3.815 3.508 4.063 . 0 0 "[ . 1 . 2]" 1
1899 1 18 VAL QG 1 21 ARG QD 3.763 . 5.533 3.264 2.399 4.258 . 0 0 "[ . 1 . 2]" 1
1900 1 10 LEU HA 1 10 LEU HB3 3.435 . 4.910 2.373 2.330 2.478 . 0 0 "[ . 1 . 2]" 1
1901 1 10 LEU HB3 1 10 LEU QD 2.531 . 3.332 2.078 2.011 2.300 . 0 0 "[ . 1 . 2]" 1
1902 1 26 LEU H 1 26 LEU HB3 3.720 . 5.450 2.618 2.391 3.278 . 0 0 "[ . 1 . 2]" 1
1903 1 26 LEU HA 1 26 LEU HB2 3.031 . 4.180 2.521 2.371 2.691 . 0 0 "[ . 1 . 2]" 1
1904 1 7 LYS HA 1 7 LYS QE 4.255 . 6.518 4.262 3.353 4.973 . 0 0 "[ . 1 . 2]" 1
1905 1 7 LYS QD 1 7 LYS QE 2.207 . 2.816 2.035 1.993 2.091 . 0 0 "[ . 1 . 2]" 1
1906 1 7 LYS QE 1 7 LYS HG2 2.415 . 3.144 2.459 2.278 3.143 . 0 0 "[ . 1 . 2]" 1
1907 1 118 LEU QB 1 118 LEU MD1 2.357 . 3.052 2.068 2.049 2.090 . 0 0 "[ . 1 . 2]" 1
1908 1 5 LEU HB3 1 5 LEU MD1 2.386 . 3.097 1.959 1.880 2.053 . 0 0 "[ . 1 . 2]" 1
1909 1 77 VAL H 1 94 ASN HB2 3.142 . 4.376 2.924 2.306 3.272 . 0 0 "[ . 1 . 2]" 1
1910 1 114 ASP H 1 114 ASP HB3 3.118 . 4.334 2.779 2.483 3.170 . 0 0 "[ . 1 . 2]" 1
1911 1 7 LYS QD 1 109 ASP QB 3.082 . 4.269 3.134 2.207 5.585 1.316 18 1 "[ . 1 . + 2]" 1
1912 1 35 ASP QB 1 60 LYS HD2 3.241 . 4.554 3.307 2.697 4.277 . 0 0 "[ . 1 . 2]" 1
1913 1 35 ASP QB 1 60 LYS HG2 4.773 . 7.621 5.580 3.395 6.234 . 0 0 "[ . 1 . 2]" 1
1914 1 5 LEU HB2 1 5 LEU MD1 2.102 . 2.655 1.968 1.938 2.087 . 0 0 "[ . 1 . 2]" 1
1915 1 114 ASP H 1 114 ASP HB2 2.477 . 3.244 2.336 2.133 2.573 . 0 0 "[ . 1 . 2]" 1
1916 1 75 SER H 1 97 ILE HB 4.171 . 6.346 3.652 3.473 3.850 . 0 0 "[ . 1 . 2]" 1
1917 1 47 PRO HA 1 47 PRO QB 2.410 . 3.136 2.173 2.165 2.184 . 0 0 "[ . 1 . 2]" 1
1918 1 45 PRO HA 1 46 SER H 2.125 . 2.690 1.976 1.909 2.028 . 0 0 "[ . 1 . 2]" 1
1919 1 45 PRO HA 1 45 PRO HD2 2.976 . 4.083 3.220 3.139 3.304 . 0 0 "[ . 1 . 2]" 1
1920 1 12 ASP HA 1 12 ASP QB 2.542 . 3.349 2.376 2.296 2.484 . 0 0 "[ . 1 . 2]" 1
1921 1 123 SER HA 1 123 SER QB 2.261 . 2.900 2.298 2.180 2.402 . 0 0 "[ . 1 . 2]" 1
1922 1 75 SER HA 1 75 SER QB 2.575 . 3.404 2.371 2.313 2.432 . 0 0 "[ . 1 . 2]" 1
1923 1 102 ALA HA 1 102 ALA MB 1.769 . 2.160 1.894 1.892 1.896 . 0 0 "[ . 1 . 2]" 1
1924 1 121 ARG HA 1 121 ARG QB 2.140 . 2.713 2.357 2.295 2.416 . 0 0 "[ . 1 . 2]" 1
1925 1 4 TYR HA 1 4 TYR QB 2.386 . 3.097 2.352 2.180 2.414 . 0 0 "[ . 1 . 2]" 1
1926 1 115 ASP H 1 115 ASP HA 2.439 . 3.183 2.674 2.644 2.698 . 0 0 "[ . 1 . 2]" 1
1927 1 102 ALA HA 1 103 LEU H 2.368 . 3.069 2.735 2.719 2.743 . 0 0 "[ . 1 . 2]" 1
1928 1 118 LEU HA 1 118 LEU QB 2.473 . 3.237 2.327 2.161 2.400 . 0 0 "[ . 1 . 2]" 1
1929 1 26 LEU HA 1 26 LEU HB2 2.178 . 2.771 2.329 2.250 2.653 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 30
_Distance_constraint_stats_list.Viol_count 231
_Distance_constraint_stats_list.Viol_total 1034.834
_Distance_constraint_stats_list.Viol_max 1.300
_Distance_constraint_stats_list.Viol_rms 0.2092
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0862
_Distance_constraint_stats_list.Viol_average_violations_only 0.2240
_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 9 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 LEU 0.392 0.165 15 0 "[ . 1 . 2]"
1 16 THR 32.293 1.300 16 19 [**************.+-***]
1 17 PHE 0.406 0.167 19 0 "[ . 1 . 2]"
1 18 VAL 0.392 0.165 15 0 "[ . 1 . 2]"
1 20 TYR 33.927 1.300 16 19 [**************.+-***]
1 21 ARG 5.255 0.239 3 0 "[ . 1 . 2]"
1 23 ALA 1.083 0.220 18 0 "[ . 1 . 2]"
1 24 VAL 2.735 0.388 8 0 "[ . 1 . 2]"
1 25 GLU 5.259 0.239 3 0 "[ . 1 . 2]"
1 27 CYS 1.083 0.220 18 0 "[ . 1 . 2]"
1 28 ALA 1.101 0.133 4 0 "[ . 1 . 2]"
1 29 LEU 0.410 0.115 2 0 "[ . 1 . 2]"
1 59 ALA 6.553 0.214 7 0 "[ . 1 . 2]"
1 62 VAL 6.553 0.214 7 0 "[ . 1 . 2]"
1 63 VAL 0.224 0.076 17 0 "[ . 1 . 2]"
1 65 LEU 2.795 0.140 17 0 "[ . 1 . 2]"
1 76 VAL 2.795 0.140 17 0 "[ . 1 . 2]"
1 78 MET 0.224 0.076 17 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 17 PHE O 1 21 ARG N 2.800 2.800 3.300 2.988 2.848 3.274 . 0 0 "[ . 1 . 2]" 2
2 1 17 PHE O 1 21 ARG H 1.800 . 2.300 2.151 1.951 2.467 0.167 19 0 "[ . 1 . 2]" 2
3 1 20 TYR O 1 24 VAL N 2.800 2.800 3.300 3.062 2.726 3.583 0.283 8 0 "[ . 1 . 2]" 2
4 1 20 TYR O 1 24 VAL H 1.800 . 2.300 2.166 1.821 2.688 0.388 8 0 "[ . 1 . 2]" 2
5 1 21 ARG O 1 25 GLU N 2.800 2.800 3.300 2.646 2.561 2.801 0.239 3 0 "[ . 1 . 2]" 2
6 1 21 ARG O 1 25 GLU H 1.800 . 2.300 1.717 1.578 1.874 0.222 3 0 "[ . 1 . 2]" 2
7 1 24 VAL O 1 28 ALA N 2.800 2.800 3.300 2.785 2.667 2.968 0.133 4 0 "[ . 1 . 2]" 2
8 1 24 VAL O 1 28 ALA H 1.800 . 2.300 1.910 1.714 2.220 0.086 20 0 "[ . 1 . 2]" 2
9 1 25 GLU O 1 29 LEU N 2.800 2.800 3.300 2.849 2.685 3.070 0.115 2 0 "[ . 1 . 2]" 2
10 1 25 GLU O 1 29 LEU H 1.800 . 2.300 2.034 1.848 2.287 . 0 0 "[ . 1 . 2]" 2
11 1 9 ALA O 1 13 MET N 2.800 2.800 3.300 2.992 2.878 3.144 . 0 0 "[ . 1 . 2]" 2
12 1 9 ALA O 1 13 MET H 1.800 . 2.300 2.066 1.959 2.203 . 0 0 "[ . 1 . 2]" 2
13 1 14 LEU O 1 18 VAL N 2.800 2.800 3.300 3.012 2.815 3.283 . 0 0 "[ . 1 . 2]" 2
14 1 14 LEU O 1 18 VAL H 1.800 . 2.300 2.168 1.970 2.465 0.165 15 0 "[ . 1 . 2]" 2
15 1 16 THR O 1 20 TYR N 2.800 2.800 3.300 4.026 3.465 4.326 1.026 19 18 "[** ***********.*-*+*]" 2
16 1 16 THR O 1 20 TYR H 1.800 . 2.300 3.189 2.613 3.600 1.300 16 19 [**************.+-***] 2
17 1 23 ALA O 1 27 CYS N 2.800 2.800 3.300 3.120 2.804 3.452 0.152 18 0 "[ . 1 . 2]" 2
18 1 23 ALA O 1 27 CYS H 1.800 . 2.300 2.190 1.846 2.520 0.220 18 0 "[ . 1 . 2]" 2
19 1 59 ALA N 1 62 VAL O 2.800 2.800 3.300 2.626 2.586 2.717 0.214 7 0 "[ . 1 . 2]" 2
20 1 59 ALA H 1 62 VAL O 1.800 . 2.300 1.655 1.609 1.774 0.191 9 0 "[ . 1 . 2]" 2
21 1 59 ALA O 1 62 VAL N 2.800 2.800 3.300 2.819 2.740 2.931 0.060 8 0 "[ . 1 . 2]" 2
22 1 59 ALA O 1 62 VAL H 1.800 . 2.300 2.112 1.972 2.309 0.009 16 0 "[ . 1 . 2]" 2
23 1 65 LEU O 1 76 VAL N 2.800 2.800 3.300 2.750 2.660 2.839 0.140 17 0 "[ . 1 . 2]" 2
24 1 65 LEU O 1 76 VAL H 1.800 . 2.300 1.816 1.700 1.909 0.100 19 0 "[ . 1 . 2]" 2
25 1 65 LEU N 1 76 VAL O 2.800 2.800 3.300 2.771 2.693 2.953 0.107 3 0 "[ . 1 . 2]" 2
26 1 65 LEU H 1 76 VAL O 1.800 . 2.300 1.813 1.714 1.992 0.086 3 0 "[ . 1 . 2]" 2
27 1 63 VAL O 1 78 MET N 2.800 2.800 3.300 2.866 2.724 3.017 0.076 17 0 "[ . 1 . 2]" 2
28 1 63 VAL O 1 78 MET H 1.800 . 2.300 1.899 1.778 2.044 0.022 17 0 "[ . 1 . 2]" 2
29 1 63 VAL N 1 78 MET O 2.800 2.800 3.300 2.879 2.779 2.966 0.021 7 0 "[ . 1 . 2]" 2
30 1 63 VAL H 1 78 MET O 1.800 . 2.300 1.950 1.828 2.081 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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