NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
607182 |
5jtr   |
30086 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5jtr
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 1614
_Distance_constraint_stats_list.Viol_count 5565
_Distance_constraint_stats_list.Viol_total 41366.230
_Distance_constraint_stats_list.Viol_max 6.345
_Distance_constraint_stats_list.Viol_rms 0.2684
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0641
_Distance_constraint_stats_list.Viol_average_violations_only 0.3717
_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 9 MET 14.967 3.834 1 9 "[+ *.*- *** * * 2]"
1 10 THR 0.580 0.119 20 0 "[ . 1 . 2]"
1 11 PHE 33.852 4.260 11 12 "[* **.** **+ * ***2]"
1 12 GLN 3.180 0.784 1 2 "[+ . 1- . 2]"
1 13 ILE 102.152 4.035 7 13 "[*** .*+* 1** .*-***]"
1 14 GLN 23.086 1.581 7 12 "[**- .*+* 1* .*****]"
1 15 ARG 33.439 2.687 7 12 "[*** .*+* 1* .****-]"
1 16 ILE 1.284 1.231 16 1 "[ . 1 .+ 2]"
1 17 TYR 4.848 0.362 3 0 "[ . 1 . 2]"
1 18 THR 0.131 0.086 16 0 "[ . 1 . 2]"
1 19 LYS 1.118 0.319 13 0 "[ . 1 . 2]"
1 20 ASP 2.498 0.367 13 0 "[ . 1 . 2]"
1 21 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 SER 0.014 0.014 1 0 "[ . 1 . 2]"
1 23 PHE 5.214 0.390 17 0 "[ . 1 . 2]"
1 24 GLU 6.101 0.390 17 0 "[ . 1 . 2]"
1 25 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 ALA 2.260 0.227 12 0 "[ . 1 . 2]"
1 30 HIS 6.511 0.410 2 0 "[ . 1 . 2]"
1 31 VAL 11.947 1.484 11 3 "[ - * 1+ . 2]"
1 32 PHE 4.151 0.410 2 0 "[ . 1 . 2]"
1 33 GLN 0.950 0.313 6 0 "[ . 1 . 2]"
1 34 LYS 3.079 0.497 6 0 "[ . 1 . 2]"
1 35 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 TRP 15.516 1.484 11 7 "[ -* * 1+** . *2]"
1 37 GLN 6.130 0.782 13 2 "[ . 1 -+ . 2]"
1 39 GLU 11.192 1.137 1 7 "[+ - .** 1 * . ** 2]"
1 40 VAL 6.451 1.412 15 4 "[ - 1 +* *]"
1 41 LYS 3.434 0.488 19 0 "[ . 1 . 2]"
1 42 LEU 5.094 1.412 15 3 "[ - 1 + *]"
1 43 ASP 7.895 0.934 7 5 "[ .*+ 1 *. -*2]"
1 44 LEU 5.545 0.662 5 2 "[ + 1 . -2]"
1 45 ASP 4.320 0.662 5 2 "[ + 1 . -2]"
1 46 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 ALA 6.197 0.445 6 0 "[ . 1 . 2]"
1 48 SER 7.288 0.445 6 0 "[ . 1 . 2]"
1 49 SER 4.234 0.888 7 3 "[ . + 1 . - *]"
1 50 GLN 15.933 4.108 10 7 "[ *- ** * + .* 2]"
1 51 LEU 7.851 0.481 20 0 "[ . 1 . 2]"
1 52 ALA 4.114 0.376 15 0 "[ . 1 . 2]"
1 53 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 VAL 9.372 0.481 20 0 "[ . 1 . 2]"
1 56 TYR 40.751 4.108 10 12 "[**- ** * +* .****2]"
1 57 GLU 3.259 0.888 7 3 "[ . + 1 . - *]"
1 58 VAL 1.265 0.355 11 0 "[ . 1 . 2]"
1 59 VAL 2.470 0.350 10 0 "[ . 1 . 2]"
1 60 LEU 0.517 0.186 12 0 "[ . 1 . 2]"
1 61 ARG 2.466 0.408 7 0 "[ . 1 . 2]"
1 62 VAL 4.936 0.448 7 0 "[ . 1 . 2]"
1 63 THR 4.234 0.283 3 0 "[ . 1 . 2]"
1 64 VAL 2.157 0.458 7 0 "[ . 1 . 2]"
1 65 THR 3.159 0.488 19 0 "[ . 1 . 2]"
1 66 ALA 7.558 0.622 19 2 "[ . 1- . +2]"
1 67 SER 17.502 1.137 1 9 "[+ * .*** 1 -* . ** 2]"
1 68 LEU 10.312 0.576 17 4 "[ *- *1 . + 2]"
1 69 GLY 14.542 0.783 8 6 "[ ** +*1 - . * 2]"
1 70 GLU 1.842 0.284 2 0 "[ . 1 . 2]"
1 71 GLU 2.505 0.261 2 0 "[ . 1 . 2]"
1 72 THR 0.897 0.215 2 0 "[ . 1 . 2]"
1 73 ALA 4.403 0.422 9 0 "[ . 1 . 2]"
1 74 PHE 7.761 1.597 19 6 "[ * * 1 *.*- +2]"
1 75 LEU 1.177 0.285 17 0 "[ . 1 . 2]"
1 76 CYS 5.540 0.520 11 1 "[ . 1+ . 2]"
1 77 GLU 1.914 0.588 1 2 "[+ . 1 - 2]"
1 78 VAL 0.102 0.102 1 0 "[ . 1 . 2]"
1 79 GLN 3.091 0.367 13 0 "[ . 1 . 2]"
1 80 GLN 0.402 0.304 13 0 "[ . 1 . 2]"
1 81 GLY 3.992 0.362 3 0 "[ . 1 . 2]"
1 82 GLY 1.630 0.355 11 0 "[ . 1 . 2]"
1 83 ILE 52.082 4.035 7 12 "[**- .*+* 1* .*****]"
1 84 PHE 7.372 1.871 11 6 "[ * . ** 1+ . -* 2]"
1 85 SER 3.894 0.784 1 1 "[+ . 1 . 2]"
1 86 ILE 36.363 3.590 2 13 "[*+**-* * ** .****2]"
1 87 ALA 30.600 3.465 1 17 "[+******- ****** ** *]"
1 88 GLY 6.074 0.720 1 3 "[+ . 1 *. -2]"
1 89 ILE 38.090 3.465 1 18 "[+******- ****** ****]"
1 90 GLU 2.746 0.592 1 1 "[+ . 1 . 2]"
1 91 GLY 0.087 0.087 18 0 "[ . 1 . 2]"
1 92 THR 3.026 0.266 14 0 "[ . 1 . 2]"
1 93 GLN 1.052 0.179 19 0 "[ . 1 . 2]"
1 94 MET 26.565 3.590 2 9 "[*+**** * - . *2]"
1 95 ALA 13.718 1.414 8 11 "[ ** ** + * - ** **2]"
1 96 HIS 13.694 0.769 17 15 "[*-**.* ***** **+ **]"
1 97 CYS 4.871 0.438 17 0 "[ . 1 . 2]"
1 98 LEU 46.810 1.414 8 18 "[****** +***** **-***]"
1 99 GLY 22.577 0.839 8 7 "[ * . + * .* *-*]"
1 100 ALA 21.485 0.929 18 13 "[* **.*** 1****. -+ *]"
1 101 TYR 6.189 1.595 19 3 "[ . -1 * . +2]"
1 102 CYS 21.140 0.929 18 14 "[* **. ** *** *.**+-*]"
1 105 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 TYR 17.032 2.096 13 15 "[* - ******* + *****2]"
1 110 ALA 3.481 0.192 20 0 "[ . 1 . 2]"
1 111 ARG 2.056 0.155 18 0 "[ . 1 . 2]"
1 112 GLU 1.131 0.192 20 0 "[ . 1 . 2]"
1 113 CYS 3.066 0.514 9 1 "[ . +1 . 2]"
1 114 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 115 THR 2.145 0.514 9 1 "[ . +1 . 2]"
1 116 SER 2.099 0.180 4 0 "[ . 1 . 2]"
1 117 MET 1.945 0.588 1 2 "[+ . 1 - 2]"
1 118 VAL 1.011 0.382 14 0 "[ . 1 . 2]"
1 119 SER 1.562 0.435 16 0 "[ . 1 . 2]"
1 121 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 122 THR 1.495 0.187 6 0 "[ . 1 . 2]"
1 123 PHE 8.380 0.995 3 5 "[ *+ * 1 .- *2]"
1 125 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 126 LEU 12.759 1.597 19 5 "[ * * 1 *. - +2]"
1 127 ASN 5.372 0.484 14 0 "[ . 1 . 2]"
1 128 LEU 7.515 1.221 16 6 "[ .** 1 *.+ -*2]"
1 129 ALA 0.925 0.464 3 0 "[ . 1 . 2]"
1 131 VAL 27.932 3.529 2 12 "[*+ *.*** - ***. **]"
1 133 PHE 38.921 3.529 2 16 "[*+ *.***-* ***** ***]"
1 134 ASP 1.435 0.265 16 0 "[ . 1 . 2]"
1 135 ALA 9.710 0.739 16 6 "[* . -1 *+ **2]"
1 136 LEU 2.794 0.626 9 1 "[ . +1 . 2]"
1 137 PHE 3.654 0.388 11 0 "[ . 1 . 2]"
1 138 MET 14.653 1.802 11 10 "[ * .*** -+* *** 2]"
1 139 ASN 4.013 0.416 12 0 "[ . 1 . 2]"
1 140 TYR 4.847 0.313 9 0 "[ . 1 . 2]"
1 141 LEU 17.681 1.802 11 10 "[ * .*** -+* *** 2]"
2 9 MET 13.482 1.760 5 10 "[ **+** *1* *.* -2]"
2 10 THR 9.229 0.643 5 5 "[ -*+ ** . 2]"
2 11 PHE 13.627 0.934 15 7 "[ -** ** + *]"
2 12 GLN 7.749 0.934 15 2 "[ . 1 + -]"
2 13 ILE 5.792 0.521 14 1 "[ . 1 +. 2]"
2 14 GLN 6.944 0.522 5 1 "[ + 1 . 2]"
2 15 ARG 5.605 0.521 14 1 "[ . 1 +. 2]"
2 16 ILE 0.163 0.093 16 0 "[ . 1 . 2]"
2 17 TYR 0.016 0.016 14 0 "[ . 1 . 2]"
2 18 THR 1.495 0.187 6 0 "[ . 1 . 2]"
2 19 LYS 1.807 0.296 7 0 "[ . 1 . 2]"
2 20 ASP 1.176 0.296 7 0 "[ . 1 . 2]"
2 21 ILE 0.557 0.145 1 0 "[ . 1 . 2]"
2 22 SER 3.531 0.410 11 0 "[ . 1 . 2]"
2 23 PHE 1.512 0.162 16 0 "[ . 1 . 2]"
2 24 GLU 1.373 0.162 16 0 "[ . 1 . 2]"
2 25 ALA 0.475 0.135 6 0 "[ . 1 . 2]"
2 27 ASN 0.117 0.059 17 0 "[ . 1 . 2]"
2 28 ALA 5.689 0.486 20 0 "[ . 1 . 2]"
2 30 HIS 0.293 0.077 8 0 "[ . 1 . 2]"
2 31 VAL 4.971 0.558 16 1 "[ . 1 .+ 2]"
2 32 PHE 2.673 0.558 16 1 "[ . 1 .+ 2]"
2 33 GLN 1.645 0.480 20 0 "[ . 1 . 2]"
2 34 LYS 0.519 0.175 8 0 "[ . 1 . 2]"
2 35 ASP 0.519 0.175 8 0 "[ . 1 . 2]"
2 36 TRP 21.269 2.395 7 12 "[ * **+*** **. **-]"
2 37 GLN 9.777 2.395 7 7 "[ - +*** *. *2]"
2 39 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 40 VAL 1.586 0.654 8 1 "[ . + 1 . 2]"
2 41 LYS 25.159 2.728 19 16 "[*******-** *** * +*]"
2 42 LEU 24.712 1.720 1 9 "[+ * . ** * *- . **2]"
2 43 ASP 2.649 0.259 5 0 "[ . 1 . 2]"
2 44 LEU 27.361 2.889 4 13 "[ *-+* * 1** ***** *]"
2 45 ASP 0.532 0.532 3 1 "[ + . 1 . 2]"
2 46 THR 0.202 0.202 1 0 "[ . 1 . 2]"
2 47 ALA 4.950 0.332 14 0 "[ . 1 . 2]"
2 48 SER 5.417 0.318 3 0 "[ . 1 . 2]"
2 49 SER 9.032 0.823 5 6 "[ **+ - * *. 2]"
2 50 GLN 0.468 0.215 1 0 "[ . 1 . 2]"
2 51 LEU 4.173 0.562 18 1 "[ . 1 . + 2]"
2 52 ALA 0.608 0.147 3 0 "[ . 1 . 2]"
2 53 ASP 0.074 0.055 10 0 "[ . 1 . 2]"
2 54 ASP 0.068 0.041 17 0 "[ . 1 . 2]"
2 55 VAL 5.553 0.487 5 0 "[ . 1 . 2]"
2 56 TYR 66.760 4.334 18 16 "[******** * * ****+ *]"
2 57 GLU 3.014 0.546 3 1 "[ + . 1 . 2]"
2 58 VAL 11.899 1.119 10 7 "[** *. - + . ** 2]"
2 59 VAL 5.913 0.823 5 5 "[ *+ - * *. 2]"
2 60 LEU 4.088 0.540 5 1 "[ + 1 . 2]"
2 61 ARG 0.613 0.332 14 0 "[ . 1 . 2]"
2 62 VAL 9.759 1.237 12 7 "[*- . * 1 +* * * 2]"
2 63 THR 3.009 0.224 4 0 "[ . 1 . 2]"
2 64 VAL 14.740 2.592 19 7 "[ *.** 1 * . - +*]"
2 65 THR 23.465 3.359 19 11 "[* **** * *-. * +*]"
2 66 ALA 4.072 0.638 17 1 "[ . 1 . + 2]"
2 67 SER 0.447 0.447 18 0 "[ . 1 . 2]"
2 68 LEU 14.694 1.751 18 9 "[ * .***** * . + -]"
2 69 GLY 0.247 0.129 3 0 "[ . 1 . 2]"
2 70 GLU 0.447 0.344 14 0 "[ . 1 . 2]"
2 71 GLU 3.717 0.344 14 0 "[ . 1 . 2]"
2 72 THR 0.002 0.002 2 0 "[ . 1 . 2]"
2 73 ALA 1.060 0.268 2 0 "[ . 1 . 2]"
2 74 PHE 6.781 0.654 8 2 "[ . + 1 . - 2]"
2 75 LEU 0.111 0.106 17 0 "[ . 1 . 2]"
2 76 CYS 4.111 0.548 17 1 "[ . 1 . + 2]"
2 77 GLU 0.033 0.033 14 0 "[ . 1 . 2]"
2 78 VAL 1.329 0.234 8 0 "[ . 1 . 2]"
2 79 GLN 3.691 0.410 11 0 "[ . 1 . 2]"
2 80 GLN 0.905 0.365 12 0 "[ . 1 . 2]"
2 81 GLY 1.771 0.219 13 0 "[ . 1 . 2]"
2 82 GLY 2.889 0.540 5 1 "[ + 1 . 2]"
2 83 ILE 9.936 0.522 5 1 "[ + 1 . 2]"
2 84 PHE 5.357 0.627 10 3 "[ *. - + . 2]"
2 85 SER 0.445 0.330 18 0 "[ . 1 . 2]"
2 86 ILE 43.016 4.334 18 17 "[******** * * *-**+**]"
2 87 ALA 1.895 0.513 8 1 "[ . + 1 . 2]"
2 88 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 89 ILE 28.663 1.760 5 14 "[ ***+****** **- *2]"
2 90 GLU 4.442 0.709 15 1 "[ . 1 + 2]"
2 91 GLY 0.085 0.085 8 0 "[ . 1 . 2]"
2 92 THR 4.173 0.306 3 0 "[ . 1 . 2]"
2 93 GLN 3.001 0.306 3 0 "[ . 1 . 2]"
2 94 MET 33.677 2.419 5 12 "[*** + ** ** **-* 2]"
2 95 ALA 6.231 0.592 18 4 "[ * - * 1 . + 2]"
2 96 HIS 12.995 1.017 2 11 "[ + **** 1 -* ** **2]"
2 97 CYS 3.389 0.400 10 0 "[ . 1 . 2]"
2 98 LEU 36.917 1.119 10 15 "[** ***** + ** -****2]"
2 99 GLY 7.813 0.559 4 1 "[ +. 1 . 2]"
2 100 ALA 11.638 0.898 17 3 "[ - * 1 . + 2]"
2 101 TYR 1.617 0.228 4 0 "[ . 1 . 2]"
2 102 CYS 8.140 0.898 17 4 "[ *-* 1 . + 2]"
2 105 ILE 0.052 0.052 20 0 "[ . 1 . 2]"
2 109 TYR 1.302 0.181 3 0 "[ . 1 . 2]"
2 110 ALA 4.342 0.272 10 0 "[ . 1 . 2]"
2 111 ARG 4.199 0.272 10 0 "[ . 1 . 2]"
2 112 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 113 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 114 ILE 19.560 2.512 19 12 "[* **.*-* 1 ** . **+*]"
2 115 THR 0.069 0.069 19 0 "[ . 1 . 2]"
2 116 SER 5.873 0.452 19 0 "[ . 1 . 2]"
2 117 MET 1.457 0.228 18 0 "[ . 1 . 2]"
2 118 VAL 9.740 1.421 19 4 "[ .* 1 - . +*]"
2 119 SER 0.508 0.156 16 0 "[ . 1 . 2]"
2 121 GLY 5.269 0.554 13 3 "[ . 1 + . *-]"
2 122 THR 0.086 0.086 16 0 "[ . 1 . 2]"
2 123 PHE 7.339 0.554 13 3 "[ . 1 + . *-]"
2 125 GLN 13.289 2.134 19 9 "[ *- * 1 **** +*]"
2 126 LEU 84.677 3.359 19 16 "[********** *** * +*]"
2 127 ASN 5.630 0.741 20 5 "[ .* * * . -+]"
2 128 LEU 9.530 1.390 18 7 "[*-* . * * * + 2]"
2 129 ALA 1.440 0.696 1 1 "[+ . 1 . 2]"
2 131 VAL 44.400 4.409 4 13 "[ **+*-* 1** *.*** *]"
2 133 PHE 78.743 4.409 4 16 "[ **+**** ***-*.*** *]"
2 134 ASP 8.021 0.754 2 2 "[ + . 1- . 2]"
2 135 ALA 4.724 1.430 18 3 "[ . 1 - . *+ 2]"
2 136 LEU 27.949 1.347 17 13 "[ ***** * ** * +***]"
2 137 PHE 10.744 1.263 20 6 "[ ** 1 * -*+]"
2 138 MET 12.641 2.693 1 9 "[+** ** 1 *-*. * 2]"
2 139 ASN 4.124 0.649 8 1 "[ . + 1 . 2]"
2 140 TYR 2.132 0.625 19 1 "[ . 1 . +2]"
2 141 LEU 2.735 0.399 14 0 "[ . 1 . 2]"
3 9 MET 20.100 2.462 16 13 "[ ** * *- 1****.+* **]"
3 10 THR 10.729 1.022 7 6 "[ * . +* 1- ** 2]"
3 11 PHE 15.739 0.825 2 10 "[*+ .** ** -* . * *]"
3 12 GLN 18.050 0.825 2 10 "[*+ .** ** -* . * *]"
3 13 ILE 16.948 2.062 11 4 "[-** . 1+ . 2]"
3 14 GLN 4.500 1.541 11 4 "[-** . 1+ . 2]"
3 15 ARG 5.477 2.062 11 4 "[*-* . 1+ . 2]"
3 16 ILE 0.166 0.139 3 0 "[ . 1 . 2]"
3 17 TYR 1.617 0.216 20 0 "[ . 1 . 2]"
3 18 THR 0.020 0.019 12 0 "[ . 1 . 2]"
3 19 LYS 7.882 0.656 6 3 "[ -.+ 1 . *2]"
3 20 ASP 1.016 0.232 13 0 "[ . 1 . 2]"
3 21 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
3 22 SER 3.503 0.627 14 1 "[ . 1 +. 2]"
3 23 PHE 0.228 0.095 14 0 "[ . 1 . 2]"
3 24 GLU 1.690 0.390 8 0 "[ . 1 . 2]"
3 25 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
3 27 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
3 28 ALA 1.215 0.293 20 0 "[ . 1 . 2]"
3 30 HIS 0.917 0.179 1 0 "[ . 1 . 2]"
3 31 VAL 2.986 0.637 13 1 "[ . 1 + . 2]"
3 32 PHE 1.536 0.388 17 0 "[ . 1 . 2]"
3 33 GLN 3.014 0.637 13 1 "[ . 1 + . 2]"
3 34 LYS 2.597 0.293 16 0 "[ . 1 . 2]"
3 35 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
3 36 TRP 0.252 0.198 10 0 "[ . 1 . 2]"
3 37 GLN 0.428 0.198 10 0 "[ . 1 . 2]"
3 39 GLU 3.262 1.049 1 3 "[+ . 1 - . * 2]"
3 40 VAL 1.960 0.247 14 0 "[ . 1 . 2]"
3 41 LYS 10.675 2.253 1 6 "[+ .* 1* **. *2]"
3 42 LEU 5.473 0.598 7 3 "[ . + 1 - . * 2]"
3 43 ASP 2.518 0.344 17 0 "[ . 1 . 2]"
3 44 LEU 5.045 0.748 17 2 "[ . - 1 . + 2]"
3 45 ASP 10.117 1.616 2 6 "[ +* * - 1 * * 2]"
3 46 THR 0.067 0.067 2 0 "[ . 1 . 2]"
3 47 ALA 0.351 0.112 16 0 "[ . 1 . 2]"
3 48 SER 0.303 0.122 11 0 "[ . 1 . 2]"
3 49 SER 1.933 0.480 4 0 "[ . 1 . 2]"
3 50 GLN 0.097 0.046 17 0 "[ . 1 . 2]"
3 51 LEU 3.970 0.365 1 0 "[ . 1 . 2]"
3 52 ALA 0.476 0.245 12 0 "[ . 1 . 2]"
3 53 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
3 54 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
3 55 VAL 18.815 2.180 10 9 "[ - *** +* ** *2]"
3 56 TYR 35.969 2.458 13 16 "[** ****- ***+**** *2]"
3 57 GLU 1.309 0.480 4 0 "[ . 1 . 2]"
3 58 VAL 6.819 0.859 5 5 "[ * +* *1 - 2]"
3 59 VAL 1.121 0.282 5 0 "[ . 1 . 2]"
3 60 LEU 9.044 1.616 2 4 "[ +* - 1 * 2]"
3 61 ARG 0.500 0.168 2 0 "[ . 1 . 2]"
3 62 VAL 2.622 0.487 2 0 "[ . 1 . 2]"
3 63 THR 0.132 0.044 10 0 "[ . 1 . 2]"
3 64 VAL 4.533 1.022 1 1 "[+ . 1 . 2]"
3 65 THR 6.794 0.598 7 2 "[ . + 1 - . 2]"
3 66 ALA 1.655 0.265 9 0 "[ . 1 . 2]"
3 67 SER 4.056 0.636 1 1 "[+ . 1 . 2]"
3 68 LEU 14.740 0.826 19 13 "[ ** * * ***** *- +*]"
3 69 GLY 8.204 1.049 1 3 "[+ . 1 - . * 2]"
3 70 GLU 15.972 0.826 19 10 "[ * * * **** *- +2]"
3 71 GLU 5.078 0.396 7 0 "[ . 1 . 2]"
3 72 THR 0.000 0.000 . 0 "[ . 1 . 2]"
3 73 ALA 3.830 0.592 3 4 "[ + . 1* * . -]"
3 74 PHE 1.237 1.012 1 1 "[+ . 1 . 2]"
3 75 LEU 1.366 0.390 8 0 "[ . 1 . 2]"
3 76 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
3 77 GLU 3.283 0.627 14 1 "[ . 1 +. 2]"
3 78 VAL 4.266 0.427 15 0 "[ . 1 . 2]"
3 79 GLN 8.582 0.656 6 3 "[ -.+ 1 . *2]"
3 80 GLN 1.947 0.357 13 0 "[ . 1 . 2]"
3 81 GLY 1.819 0.342 16 0 "[ . 1 . 2]"
3 82 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
3 83 ILE 5.931 1.634 11 4 "[*-* . 1+ . 2]"
3 84 PHE 6.948 0.859 5 5 "[ * +* *1 - 2]"
3 85 SER 1.548 0.304 1 0 "[ . 1 . 2]"
3 86 ILE 32.523 4.125 13 14 "[** ** * 1**+*** **-]"
3 87 ALA 21.521 0.986 2 9 "[ + ** **1 ** * -]"
3 88 GLY 25.895 2.285 13 10 "[ ** . * 1 *+*** *-]"
3 89 ILE 67.489 2.462 16 19 [*********1****-+****]
3 90 GLU 14.709 1.537 11 13 "[* **.* - 1+***.*** *]"
3 91 GLY 1.006 0.399 13 0 "[ . 1 . 2]"
3 92 THR 0.000 0.000 . 0 "[ . 1 . 2]"
3 93 GLN 1.532 0.587 17 1 "[ . 1 . + 2]"
3 94 MET 63.289 4.125 13 14 "[* *** - ***+*.*** *]"
3 95 ALA 0.055 0.055 11 0 "[ . 1 . 2]"
3 96 HIS 3.788 0.666 10 1 "[ . + . 2]"
3 97 CYS 1.218 0.206 20 0 "[ . 1 . 2]"
3 98 LEU 7.541 1.463 12 5 "[ .- * + *. * 2]"
3 99 GLY 41.511 1.529 14 20 [********-****+******]
3 100 ALA 14.952 0.656 12 7 "[ *. * * + *.- *]"
3 101 TYR 14.884 0.936 14 12 "[ **** * -** +** *]"
3 102 CYS 24.756 1.529 14 20 [********-****+******]
3 105 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
3 109 TYR 1.193 0.160 16 0 "[ . 1 . 2]"
3 110 ALA 4.969 0.297 11 0 "[ . 1 . 2]"
3 111 ARG 3.691 0.292 14 0 "[ . 1 . 2]"
3 112 GLU 1.017 0.297 11 0 "[ . 1 . 2]"
3 113 CYS 0.919 0.250 20 0 "[ . 1 . 2]"
3 114 ILE 0.385 0.120 6 0 "[ . 1 . 2]"
3 115 THR 7.912 1.530 7 6 "[* .*+ 1 * *. - 2]"
3 116 SER 6.097 0.292 8 0 "[ . 1 . 2]"
3 117 MET 3.556 0.292 8 0 "[ . 1 . 2]"
3 118 VAL 3.636 0.384 1 0 "[ . 1 . 2]"
3 119 SER 0.185 0.071 10 0 "[ . 1 . 2]"
3 121 GLY 6.775 0.680 18 4 "[ *. * 1 - . + 2]"
3 122 THR 0.000 0.000 . 0 "[ . 1 . 2]"
3 123 PHE 8.215 0.680 18 5 "[ *. * 1*- . + 2]"
3 125 GLN 13.289 2.134 19 9 "[ *- * 1 **** +*]"
3 126 LEU 34.135 2.253 1 15 "[+* -*** *1******* *2]"
3 127 ASN 13.810 1.588 14 12 "[** -** *1* *+** *2]"
3 128 LEU 1.043 0.527 18 1 "[ . 1 . + 2]"
3 129 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
3 131 VAL 16.631 2.096 13 15 "[* - ******* + *****2]"
3 133 PHE 4.116 0.681 4 2 "[ +. - . 2]"
3 134 ASP 1.510 0.238 7 0 "[ . 1 . 2]"
3 135 ALA 13.462 2.057 8 8 "[ **. *+ -** . * 2]"
3 136 LEU 3.241 0.700 8 1 "[ . + 1 . 2]"
3 137 PHE 6.676 2.413 18 4 "[ * - 1 * . + 2]"
3 138 MET 22.623 4.260 11 11 "[* **.***-1+* . **2]"
3 139 ASN 1.174 0.700 8 1 "[ . + 1 . 2]"
3 140 TYR 23.504 1.703 10 9 "[* *.*** + * -*]"
3 141 LEU 29.217 2.413 18 13 "[* ****** * * * +-*]"
4 9 MET 10.054 2.693 1 9 "[+** ** 1 *-*. * 2]"
4 10 THR 0.718 0.342 15 0 "[ . 1 . 2]"
4 11 PHE 30.555 1.404 14 11 "[ -**. **1 *+. ****]"
4 12 GLN 12.874 0.710 17 1 "[ . 1 . + 2]"
4 13 ILE 32.603 3.497 11 10 "[** .- * *+ * * ** 2]"
4 14 GLN 4.370 0.528 20 1 "[ . 1 . +]"
4 15 ARG 0.494 0.152 1 0 "[ . 1 . 2]"
4 16 ILE 8.812 1.230 1 7 "[+ .* 1 * ** -*2]"
4 17 TYR 6.691 0.427 6 0 "[ . 1 . 2]"
4 18 THR 0.000 0.000 . 0 "[ . 1 . 2]"
4 19 LYS 20.663 1.111 10 20 [***-*****+**********]
4 20 ASP 7.618 0.548 14 3 "[ . * +.- 2]"
4 21 ILE 0.281 0.123 2 0 "[ . 1 . 2]"
4 22 SER 3.860 0.494 10 0 "[ . 1 . 2]"
4 23 PHE 0.573 0.176 17 0 "[ . 1 . 2]"
4 24 GLU 2.362 0.252 14 0 "[ . 1 . 2]"
4 25 ALA 0.216 0.104 6 0 "[ . 1 . 2]"
4 27 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
4 28 ALA 6.362 0.578 10 2 "[ . + . -2]"
4 30 HIS 4.422 0.578 10 2 "[ . + . -2]"
4 31 VAL 1.788 0.420 19 0 "[ . 1 . 2]"
4 32 PHE 0.939 0.438 2 0 "[ . 1 . 2]"
4 33 GLN 1.093 0.438 2 0 "[ . 1 . 2]"
4 34 LYS 0.635 0.148 20 0 "[ . 1 . 2]"
4 35 ASP 44.088 6.345 10 14 "[*** * -* + ***** **]"
4 36 TRP 53.733 6.345 10 14 "[*** * -* + ***** **]"
4 37 GLN 9.709 1.722 16 6 "[ * * 1 * *.+ -2]"
4 39 GLU 8.144 0.744 2 8 "[*+*** 1 -* *]"
4 40 VAL 2.544 0.630 3 1 "[ + . 1 . 2]"
4 41 LYS 2.335 0.578 15 2 "[ - . 1 + 2]"
4 42 LEU 0.693 0.220 2 0 "[ . 1 . 2]"
4 43 ASP 2.590 0.272 19 0 "[ . 1 . 2]"
4 44 LEU 13.380 2.237 19 5 "[ - .* 1* . +*]"
4 45 ASP 2.732 1.171 3 1 "[ + . 1 . 2]"
4 46 THR 1.050 0.115 3 0 "[ . 1 . 2]"
4 47 ALA 40.953 3.541 4 18 "[***+*****-****** **]"
4 48 SER 4.782 0.548 7 2 "[ . + 1 .- 2]"
4 49 SER 21.202 1.646 20 14 "[* ****- *1** .****+]"
4 50 GLN 26.184 3.498 17 7 "[* .* 1*** .*+ 2]"
4 51 LEU 2.378 0.195 2 0 "[ . 1 . 2]"
4 52 ALA 1.834 0.195 2 0 "[ . 1 . 2]"
4 53 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
4 54 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
4 55 VAL 3.278 0.267 11 0 "[ . 1 . 2]"
4 56 TYR 48.551 3.498 17 16 "[* ****- *1*** **+***]"
4 57 GLU 6.208 0.475 9 0 "[ . 1 . 2]"
4 58 VAL 12.963 0.699 10 13 "[ - * ** + ********]"
4 59 VAL 12.350 0.946 7 6 "[ * *. + * .- *]"
4 60 LEU 6.825 0.661 7 5 "[ * . + * * - 2]"
4 61 ARG 0.544 0.266 1 0 "[ . 1 . 2]"
4 62 VAL 1.018 0.228 14 0 "[ . 1 . 2]"
4 63 THR 0.621 0.180 2 0 "[ . 1 . 2]"
4 64 VAL 3.065 0.916 11 2 "[ -. 1+ . 2]"
4 65 THR 2.657 0.578 15 2 "[ - . 1 + 2]"
4 66 ALA 0.617 0.151 16 0 "[ . 1 . 2]"
4 67 SER 8.144 0.744 2 8 "[*+*** 1 -* *]"
4 68 LEU 7.707 0.594 14 2 "[ . 1 -+. 2]"
4 69 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
4 70 GLU 0.113 0.113 16 0 "[ . 1 . 2]"
4 71 GLU 6.324 0.594 14 2 "[ . 1 -+. 2]"
4 72 THR 0.000 0.000 . 0 "[ . 1 . 2]"
4 73 ALA 0.034 0.018 19 0 "[ . 1 . 2]"
4 74 PHE 1.535 0.258 18 0 "[ . 1 . 2]"
4 75 LEU 2.692 0.258 18 0 "[ . 1 . 2]"
4 76 CYS 0.004 0.004 15 0 "[ . 1 . 2]"
4 77 GLU 3.864 0.494 10 0 "[ . 1 . 2]"
4 78 VAL 0.001 0.001 10 0 "[ . 1 . 2]"
4 79 GLN 26.653 1.111 10 20 [*********+*****-****]
4 80 GLN 4.597 0.443 14 0 "[ . 1 . 2]"
4 81 GLY 7.242 0.427 6 0 "[ . 1 . 2]"
4 82 GLY 16.721 0.699 10 13 "[ * * ** + ****-***]"
4 83 ILE 3.645 0.528 20 1 "[ . 1 . +]"
4 84 PHE 1.757 0.396 3 0 "[ . 1 . 2]"
4 85 SER 22.637 1.404 14 11 "[ -**. **1 *+. ****]"
4 86 ILE 61.927 3.635 18 15 "[ * ***** -** *** +**]"
4 87 ALA 10.792 1.160 5 6 "[ + ** -* . * 2]"
4 88 GLY 30.804 2.926 18 12 "[ * ***-* *** ** + 2]"
4 89 ILE 68.046 3.352 18 18 "[******** ****-***+ *]"
4 90 GLU 5.485 1.107 5 4 "[ +** 1 - . 2]"
4 91 GLY 0.090 0.090 18 0 "[ . 1 . 2]"
4 92 THR 4.275 0.425 12 0 "[ . 1 . 2]"
4 93 GLN 0.946 0.168 12 0 "[ . 1 . 2]"
4 94 MET 44.370 3.635 18 19 "[******** ****-***+**]"
4 95 ALA 12.210 1.648 2 9 "[ +*** * *. *-*2]"
4 96 HIS 2.735 0.231 13 0 "[ . 1 . 2]"
4 97 CYS 0.627 0.206 1 0 "[ . 1 . 2]"
4 98 LEU 44.985 3.541 4 20 [***+*************-**]
4 99 GLY 3.042 0.376 6 0 "[ . 1 . 2]"
4 100 ALA 9.458 0.648 11 3 "[ . 1+ .-* 2]"
4 101 TYR 18.851 3.497 11 10 "[** .- * *+ * * ** 2]"
4 102 CYS 8.438 0.566 17 2 "[ . 1 .-+ 2]"
4 105 ILE 10.007 2.342 11 7 "[ * . * *+ * - * 2]"
4 109 TYR 8.820 1.230 1 7 "[+ .* 1 * ** -*2]"
4 110 ALA 2.441 0.258 5 0 "[ . 1 . 2]"
4 111 ARG 0.881 0.181 16 0 "[ . 1 . 2]"
4 112 GLU 1.670 0.258 5 0 "[ . 1 . 2]"
4 113 CYS 0.862 0.255 2 0 "[ . 1 . 2]"
4 114 ILE 0.580 0.118 5 0 "[ . 1 . 2]"
4 115 THR 0.000 0.000 . 0 "[ . 1 . 2]"
4 116 SER 0.777 0.118 5 0 "[ . 1 . 2]"
4 117 MET 0.049 0.049 19 0 "[ . 1 . 2]"
4 118 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
4 119 SER 0.000 0.000 . 0 "[ . 1 . 2]"
4 121 GLY 0.937 0.308 13 0 "[ . 1 . 2]"
4 122 THR 0.000 0.000 . 0 "[ . 1 . 2]"
4 123 PHE 1.176 0.308 13 0 "[ . 1 . 2]"
4 125 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
4 126 LEU 7.174 0.916 11 3 "[ *-. 1+ . 2]"
4 127 ASN 3.668 0.392 18 0 "[ . 1 . 2]"
4 128 LEU 1.212 0.498 3 0 "[ . 1 . 2]"
4 129 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
4 131 VAL 12.395 3.100 20 8 "[* * .** 1* .- *+]"
4 133 PHE 28.415 3.100 20 11 "[*-* ** 1* .****+]"
4 134 ASP 2.919 0.416 5 0 "[ . 1 . 2]"
4 135 ALA 6.627 0.381 14 0 "[ . 1 . 2]"
4 136 LEU 24.163 1.082 11 12 "[-** *** 1+ ** ** *]"
4 137 PHE 22.428 2.570 11 8 "[* * .- * 1+* *. *2]"
4 138 MET 2.647 0.327 19 0 "[ . 1 . 2]"
4 139 ASN 7.277 0.824 6 2 "[- .+ 1 . 2]"
4 140 TYR 10.471 1.024 6 7 "[** *+ 1 ** *]"
4 141 LEU 22.158 2.570 11 6 "[ * . * 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 9 MET H 1 10 THR H 3.230 . 4.660 4.429 4.072 4.632 . 0 0 "[ . 1 . 2]" 1
2 1 9 MET ME 1 11 PHE H 3.470 . 5.140 5.489 3.299 8.974 3.834 1 9 "[+ *.*- *** * * 2]" 1
3 1 10 THR H 1 11 PHE H 2.990 . 4.180 4.124 3.746 4.299 0.119 20 0 "[ . 1 . 2]" 1
4 1 10 THR H 1 87 ALA H 2.820 . 3.840 3.231 2.779 3.633 . 0 0 "[ . 1 . 2]" 1
5 1 11 PHE H 1 12 GLN H 3.280 . 4.760 4.373 4.161 4.548 . 0 0 "[ . 1 . 2]" 1
6 1 11 PHE QD 1 12 GLN H 2.560 . 3.320 2.985 2.475 3.832 0.512 11 1 "[ . 1+ . 2]" 1
7 1 11 PHE QD 3 138 MET ME 3.160 . 4.520 4.676 2.293 8.780 4.260 11 8 "[* *-.** 1+ . **2]" 1
8 1 11 PHE QE 1 12 GLN H 3.150 . 4.500 4.129 3.742 4.845 0.345 11 0 "[ . 1 . 2]" 1
9 1 11 PHE QE 1 84 PHE QD 3.160 . 4.520 3.125 2.683 3.451 . 0 0 "[ . 1 . 2]" 1
10 1 11 PHE QE 1 84 PHE QE 3.490 . 5.180 4.103 3.754 4.407 . 0 0 "[ . 1 . 2]" 1
11 1 11 PHE QE 1 101 TYR QD 3.350 . 4.900 3.867 3.577 4.023 . 0 0 "[ . 1 . 2]" 1
12 1 11 PHE QE 1 101 TYR QE 3.470 . 5.140 2.509 2.180 3.111 . 0 0 "[ . 1 . 2]" 1
13 1 12 GLN H 1 13 ILE H 3.020 . 4.240 4.172 3.921 4.296 0.056 6 0 "[ . 1 . 2]" 1
14 1 12 GLN H 1 85 SER H 2.590 . 3.380 3.216 2.325 4.164 0.784 1 1 "[+ . 1 . 2]" 1
15 1 13 ILE H 1 14 GLN H 3.290 . 4.780 4.414 4.105 4.544 . 0 0 "[ . 1 . 2]" 1
16 1 13 ILE H 3 135 ALA MB 2.740 . 3.680 3.547 1.993 5.737 2.057 8 6 "[ - . *+ 1** . * 2]" 1
17 1 13 ILE MD 1 14 GLN H 2.600 . 3.400 3.781 2.066 4.981 1.581 7 12 "[*** .*+* 1* .****-]" 1
18 1 13 ILE MD 1 15 ARG H 2.650 . 3.500 4.344 1.945 6.187 2.687 7 12 "[*** .*+* 1* .****-]" 1
19 1 13 ILE MD 1 16 ILE MD 3.160 . 4.520 3.660 2.767 5.751 1.231 16 1 "[ . 1 .+ 2]" 1
20 1 13 ILE MD 1 83 ILE H 2.920 . 4.040 5.906 3.126 8.075 4.035 7 12 "[*** .*+* 1* .****-]" 1
21 1 13 ILE MD 1 84 PHE QD 2.840 . 3.880 3.033 2.005 4.802 0.922 11 1 "[ . 1+ . 2]" 1
22 1 13 ILE MD 1 84 PHE QE 2.510 . 3.220 2.935 1.793 5.091 1.871 11 6 "[ * . ** 1+ . -* 2]" 1
23 1 14 GLN H 1 15 ARG H 2.120 . 2.440 2.288 2.063 2.486 0.046 6 0 "[ . 1 . 2]" 1
24 1 14 GLN H 1 83 ILE H 3.100 . 4.400 4.674 4.301 4.931 0.531 7 4 "[ - . +* 1 . * 2]" 1
25 1 14 GLN H 1 84 PHE H 3.320 . 4.840 4.693 4.497 4.973 0.133 4 0 "[ . 1 . 2]" 1
26 1 14 GLN H 1 84 PHE QD 3.430 . 5.060 3.813 3.161 4.523 . 0 0 "[ . 1 . 2]" 1
27 1 14 GLN H 1 85 SER H 3.110 . 4.410 3.921 3.357 4.583 0.173 16 0 "[ . 1 . 2]" 1
28 1 15 ARG H 1 16 ILE H 3.120 . 4.440 4.095 3.856 4.275 . 0 0 "[ . 1 . 2]" 1
29 1 15 ARG H 1 83 ILE H 2.410 . 3.020 3.313 3.163 3.476 0.456 7 0 "[ . 1 . 2]" 1
30 1 15 ARG H 1 83 ILE MD 3.260 . 4.720 4.288 3.685 4.633 . 0 0 "[ . 1 . 2]" 1
31 1 16 ILE H 1 17 TYR H 3.240 . 4.680 4.434 4.202 4.522 . 0 0 "[ . 1 . 2]" 1
32 1 16 ILE H 1 83 ILE H 3.490 . 5.180 5.087 4.945 5.233 0.053 16 0 "[ . 1 . 2]" 1
33 1 16 ILE MD 1 109 TYR QD 3.140 . 4.480 3.067 2.576 3.363 . 0 0 "[ . 1 . 2]" 1
34 1 16 ILE MD 1 109 TYR QE 2.720 . 3.640 2.647 2.443 2.934 . 0 0 "[ . 1 . 2]" 1
35 1 17 TYR H 1 18 THR H 3.190 . 4.580 4.312 4.080 4.390 . 0 0 "[ . 1 . 2]" 1
36 1 17 TYR H 1 81 GLY H 2.800 . 3.800 3.979 3.762 4.162 0.362 3 0 "[ . 1 . 2]" 1
37 1 17 TYR H 1 82 GLY H 3.460 . 5.120 5.068 4.914 5.259 0.139 19 0 "[ . 1 . 2]" 1
38 1 17 TYR QD 1 18 THR H 3.060 . 4.320 3.787 3.240 4.345 0.025 13 0 "[ . 1 . 2]" 1
39 1 17 TYR QE 1 83 ILE MD 3.200 . 4.600 2.630 2.209 2.970 . 0 0 "[ . 1 . 2]" 1
40 1 17 TYR QE 2 28 ALA MB 3.340 . 4.880 2.025 1.445 2.625 0.355 8 0 "[ . 1 . 2]" 1
41 1 18 THR H 1 19 LYS H 3.160 . 4.520 4.393 4.276 4.520 0.000 17 0 "[ . 1 . 2]" 1
42 1 18 THR H 1 81 GLY H 3.390 . 4.980 4.850 4.590 5.000 0.020 2 0 "[ . 1 . 2]" 1
43 1 18 THR H 2 121 GLY H 3.150 . 4.500 3.968 3.707 4.162 . 0 0 "[ . 1 . 2]" 1
44 1 18 THR H 2 122 THR H 3.340 . 4.880 4.485 4.199 4.966 0.086 16 0 "[ . 1 . 2]" 1
45 1 19 LYS H 1 20 ASP H 2.340 . 2.880 2.305 2.123 2.433 . 0 0 "[ . 1 . 2]" 1
46 1 19 LYS H 1 59 VAL MG1 3.470 . 5.140 4.097 3.909 4.330 . 0 0 "[ . 1 . 2]" 1
47 1 19 LYS H 1 79 GLN H 3.370 . 4.940 4.866 4.673 5.083 0.143 16 0 "[ . 1 . 2]" 1
48 1 19 LYS H 1 80 GLN H 3.470 . 5.140 5.026 4.839 5.444 0.304 13 0 "[ . 1 . 2]" 1
49 1 19 LYS H 1 81 GLY H 2.260 . 2.720 2.540 2.360 3.039 0.319 13 0 "[ . 1 . 2]" 1
50 1 20 ASP H 1 21 ILE H 3.160 . 4.520 4.222 4.078 4.300 . 0 0 "[ . 1 . 2]" 1
51 1 20 ASP H 1 79 GLN H 2.560 . 3.320 3.424 3.110 3.687 0.367 13 0 "[ . 1 . 2]" 1
52 1 21 ILE H 1 22 SER H 3.190 . 4.580 4.274 4.193 4.381 . 0 0 "[ . 1 . 2]" 1
53 1 21 ILE H 1 79 GLN H 3.500 . 5.200 4.816 4.596 4.997 . 0 0 "[ . 1 . 2]" 1
54 1 21 ILE H 2 23 PHE H 2.780 . 3.760 2.816 2.565 3.202 . 0 0 "[ . 1 . 2]" 1
55 1 21 ILE H 2 23 PHE QD 3.030 . 4.260 3.648 2.520 3.994 . 0 0 "[ . 1 . 2]" 1
56 1 21 ILE MD 1 78 VAL MG1 3.380 . 4.960 3.779 3.543 3.905 . 0 0 "[ . 1 . 2]" 1
57 1 21 ILE MD 2 23 PHE QD 3.350 . 4.900 3.000 2.615 3.371 . 0 0 "[ . 1 . 2]" 1
58 1 21 ILE MD 2 117 MET ME 3.470 . 5.140 3.559 2.731 3.934 . 0 0 "[ . 1 . 2]" 1
59 1 22 SER H 1 23 PHE H 3.160 . 4.520 4.009 3.815 4.217 . 0 0 "[ . 1 . 2]" 1
60 1 22 SER H 1 77 GLU H 2.730 . 3.660 3.197 2.941 3.674 0.014 1 0 "[ . 1 . 2]" 1
61 1 22 SER H 1 78 VAL H 3.470 . 5.140 5.030 4.925 5.128 . 0 0 "[ . 1 . 2]" 1
62 1 22 SER H 1 78 VAL MG2 3.250 . 4.700 3.136 2.857 3.259 . 0 0 "[ . 1 . 2]" 1
63 1 22 SER H 1 117 MET ME 3.380 . 4.960 3.206 2.915 3.417 . 0 0 "[ . 1 . 2]" 1
64 1 23 PHE H 1 24 GLU H 3.100 . 4.400 4.150 3.934 4.390 . 0 0 "[ . 1 . 2]" 1
65 1 23 PHE H 2 21 ILE H 2.610 . 3.420 2.779 2.572 3.142 . 0 0 "[ . 1 . 2]" 1
66 1 23 PHE QD 1 24 GLU H 2.730 . 3.660 3.773 3.450 4.050 0.390 17 0 "[ . 1 . 2]" 1
67 1 23 PHE QD 1 117 MET ME 3.420 . 5.040 2.513 2.355 2.673 . 0 0 "[ . 1 . 2]" 1
68 1 23 PHE QD 2 21 ILE H 2.990 . 4.180 3.657 3.123 4.278 0.098 6 0 "[ . 1 . 2]" 1
69 1 23 PHE QE 1 24 GLU H 3.350 . 4.900 4.877 4.452 5.207 0.307 12 0 "[ . 1 . 2]" 1
70 1 23 PHE QE 1 25 ALA MB 3.040 . 4.280 2.865 2.567 3.101 . 0 0 "[ . 1 . 2]" 1
71 1 23 PHE QE 1 74 PHE QD 3.360 . 4.920 3.006 2.671 3.374 . 0 0 "[ . 1 . 2]" 1
72 1 23 PHE QE 1 121 GLY H 3.440 . 5.080 4.118 3.784 4.622 . 0 0 "[ . 1 . 2]" 1
73 1 24 GLU H 1 25 ALA H 3.200 . 4.600 4.232 4.033 4.409 . 0 0 "[ . 1 . 2]" 1
74 1 24 GLU H 1 75 LEU H 2.400 . 3.000 2.953 2.630 3.285 0.285 17 0 "[ . 1 . 2]" 1
75 1 25 ALA MB 1 28 ALA H 3.410 . 5.020 3.284 3.140 3.586 . 0 0 "[ . 1 . 2]" 1
76 1 25 ALA MB 1 28 ALA MB 3.050 . 4.300 1.922 1.813 2.047 . 0 0 "[ . 1 . 2]" 1
77 1 27 ASN H 1 28 ALA H 2.510 . 3.220 2.684 2.394 3.019 . 0 0 "[ . 1 . 2]" 1
78 1 28 ALA H 1 30 HIS H 2.860 . 3.920 4.018 3.874 4.147 0.227 12 0 "[ . 1 . 2]" 1
79 1 28 ALA H 1 31 VAL H 3.520 . 5.240 5.042 4.886 5.456 0.216 16 0 "[ . 1 . 2]" 1
80 1 28 ALA MB 1 30 HIS H 3.430 . 5.060 4.371 4.215 4.482 . 0 0 "[ . 1 . 2]" 1
81 1 28 ALA MB 2 17 TYR QD 3.440 . 5.080 2.503 2.136 2.894 . 0 0 "[ . 1 . 2]" 1
82 1 28 ALA MB 2 17 TYR QE 3.210 . 4.620 1.996 1.784 2.591 0.016 14 0 "[ . 1 . 2]" 1
83 1 30 HIS H 1 31 VAL H 2.120 . 2.440 2.539 2.274 2.728 0.288 2 0 "[ . 1 . 2]" 1
84 1 30 HIS H 1 31 VAL QG 3.500 . 5.200 3.873 3.434 4.216 . 0 0 "[ . 1 . 2]" 1
85 1 30 HIS H 1 32 PHE H 3.020 . 4.240 4.320 3.958 4.650 0.410 2 0 "[ . 1 . 2]" 1
86 1 31 VAL H 1 32 PHE H 2.340 . 2.880 2.692 2.515 2.803 . 0 0 "[ . 1 . 2]" 1
87 1 31 VAL H 1 33 GLN H 3.240 . 4.680 4.428 4.103 4.608 . 0 0 "[ . 1 . 2]" 1
88 1 31 VAL H 1 34 LYS H 3.340 . 4.880 4.878 4.604 5.377 0.497 6 0 "[ . 1 . 2]" 1
89 1 31 VAL H 1 68 LEU MD1 3.520 . 5.240 4.735 4.101 5.669 0.429 13 0 "[ . 1 . 2]" 1
90 1 31 VAL QG 1 32 PHE H 2.490 . 3.180 2.777 2.339 3.536 0.356 12 0 "[ . 1 . 2]" 1
91 1 31 VAL QG 1 36 TRP HE3 2.250 . 2.700 2.606 2.071 4.184 1.484 11 2 "[ - . 1+ . 2]" 1
92 1 31 VAL QG 1 36 TRP HZ3 2.530 . 3.260 2.772 1.842 3.972 0.712 5 1 "[ + 1 . 2]" 1
93 1 31 VAL QG 1 68 LEU MD1 2.990 . 4.180 2.000 1.649 2.673 0.151 17 0 "[ . 1 . 2]" 1
94 1 31 VAL QG 1 68 LEU MD2 3.200 . 4.600 3.338 2.905 4.011 . 0 0 "[ . 1 . 2]" 1
95 1 31 VAL QG 1 123 PHE QE 3.430 . 5.060 1.827 1.525 2.074 0.275 3 0 "[ . 1 . 2]" 1
96 1 32 PHE H 1 33 GLN H 2.280 . 2.760 2.607 2.385 2.802 0.042 12 0 "[ . 1 . 2]" 1
97 1 32 PHE H 1 34 LYS H 2.950 . 4.100 3.872 3.583 4.459 0.359 6 0 "[ . 1 . 2]" 1
98 1 32 PHE QD 1 33 GLN H 3.250 . 4.700 3.949 3.694 4.718 0.018 2 0 "[ . 1 . 2]" 1
99 1 33 GLN H 1 34 LYS H 2.090 . 2.380 2.345 2.126 2.693 0.313 6 0 "[ . 1 . 2]" 1
100 1 34 LYS H 1 35 ASP H 3.300 . 4.800 4.587 4.468 4.645 . 0 0 "[ . 1 . 2]" 1
101 1 35 ASP H 1 36 TRP H 3.340 . 4.880 4.572 4.447 4.644 . 0 0 "[ . 1 . 2]" 1
102 1 36 TRP H 1 37 GLN H 2.830 . 3.860 3.936 3.705 4.293 0.433 6 0 "[ . 1 . 2]" 1
103 1 36 TRP HE3 1 37 GLN H 2.960 . 4.120 4.297 3.889 4.902 0.782 13 2 "[ . 1 -+ . 2]" 1
104 1 36 TRP HE3 1 68 LEU MD1 3.100 . 4.400 2.733 2.353 3.249 . 0 0 "[ . 1 . 2]" 1
105 1 36 TRP HE3 1 68 LEU MD2 2.300 . 2.800 2.229 1.933 3.003 0.203 6 0 "[ . 1 . 2]" 1
106 1 36 TRP HE3 1 73 ALA MB 3.440 . 5.080 3.530 3.004 3.789 . 0 0 "[ . 1 . 2]" 1
107 1 36 TRP HZ3 1 68 LEU MD1 3.160 . 4.520 3.062 2.549 3.591 . 0 0 "[ . 1 . 2]" 1
108 1 36 TRP HZ3 1 68 LEU MD2 2.630 . 3.460 2.770 2.539 3.139 . 0 0 "[ . 1 . 2]" 1
109 1 36 TRP HZ3 1 73 ALA MB 2.470 . 3.140 1.894 1.727 2.067 0.073 19 0 "[ . 1 . 2]" 1
110 1 36 TRP HZ3 1 123 PHE QD 3.470 . 5.140 3.893 2.848 4.853 . 0 0 "[ . 1 . 2]" 1
111 1 36 TRP HZ3 1 123 PHE QE 2.810 . 3.820 3.785 2.810 4.815 0.995 3 4 "[ *+ * 1 . -2]" 1
112 1 37 GLN H 1 68 LEU MD1 3.510 . 5.220 4.010 3.530 4.537 . 0 0 "[ . 1 . 2]" 1
113 1 37 GLN H 1 68 LEU MD2 2.330 . 2.860 1.983 1.736 2.452 0.064 11 0 "[ . 1 . 2]" 1
114 1 39 GLU H 1 40 VAL H 2.970 . 4.140 4.064 3.860 4.340 0.200 17 0 "[ . 1 . 2]" 1
115 1 39 GLU H 1 66 ALA MB 3.110 . 4.420 4.106 3.572 4.586 0.166 1 0 "[ . 1 . 2]" 1
116 1 39 GLU H 1 67 SER H 1.890 . 1.980 2.468 2.030 3.117 1.137 1 7 "[+ - .** 1 * . ** 2]" 1
117 1 39 GLU H 1 68 LEU H 3.430 . 5.060 4.827 4.614 5.157 0.097 15 0 "[ . 1 . 2]" 1
118 1 39 GLU H 1 69 GLY H 3.230 . 4.660 4.227 3.859 4.920 0.260 7 0 "[ . 1 . 2]" 1
119 1 40 VAL H 1 41 LYS H 3.260 . 4.720 4.304 4.051 4.555 . 0 0 "[ . 1 . 2]" 1
120 1 40 VAL QG 1 41 LYS H 2.770 . 3.740 3.234 2.581 3.755 0.015 15 0 "[ . 1 . 2]" 1
121 1 40 VAL QG 1 42 LEU QD 2.800 . 3.800 3.159 2.006 5.212 1.412 15 3 "[ - 1 + *]" 1
122 1 40 VAL QG 1 64 VAL MG1 2.960 . 4.120 2.752 1.677 4.077 0.123 4 0 "[ . 1 . 2]" 1
123 1 40 VAL QG 1 126 LEU QD 3.020 . 4.180 2.110 1.733 2.948 0.067 1 0 "[ . 1 . 2]" 1
124 1 40 VAL QG 1 128 LEU QD 2.840 . 3.880 3.176 1.607 5.101 1.221 16 1 "[ . 1 .+ 2]" 1
125 1 41 LYS H 1 42 LEU H 3.200 . 4.600 4.394 4.154 4.586 . 0 0 "[ . 1 . 2]" 1
126 1 41 LYS H 1 64 VAL MG1 3.170 . 4.540 4.210 3.405 4.832 0.292 18 0 "[ . 1 . 2]" 1
127 1 41 LYS H 1 65 THR H 2.400 . 3.000 3.051 2.531 3.488 0.488 19 0 "[ . 1 . 2]" 1
128 1 42 LEU H 1 43 ASP H 3.260 . 4.720 4.273 3.971 4.524 . 0 0 "[ . 1 . 2]" 1
129 1 42 LEU QD 1 128 LEU QD 2.710 . 3.080 1.828 1.564 2.171 0.236 9 0 "[ . 1 . 2]" 1
130 1 43 ASP H 1 44 LEU H 2.970 . 4.140 4.309 3.986 4.484 0.344 16 0 "[ . 1 . 2]" 1
131 1 43 ASP H 1 63 THR H 2.810 . 3.820 3.072 2.809 3.560 . 0 0 "[ . 1 . 2]" 1
132 1 43 ASP H 1 128 LEU QD 3.520 . 5.240 5.102 3.789 6.174 0.934 7 5 "[ .*+ 1 *. -*2]" 1
133 1 44 LEU H 1 45 ASP H 3.290 . 4.780 4.334 4.167 4.495 . 0 0 "[ . 1 . 2]" 1
134 1 44 LEU MD1 1 45 ASP H 2.950 . 4.100 3.005 2.283 4.762 0.662 5 2 "[ + 1 . -2]" 1
135 1 44 LEU MD1 1 60 LEU MD2 2.890 . 3.980 2.134 1.789 3.699 0.011 17 0 "[ . 1 . 2]" 1
136 1 44 LEU MD1 1 62 VAL QG 3.410 . 4.320 2.783 1.875 3.973 . 0 0 "[ . 1 . 2]" 1
137 1 44 LEU MD2 1 45 ASP H 3.350 . 4.900 4.448 2.557 5.035 0.135 4 0 "[ . 1 . 2]" 1
138 1 45 ASP H 1 46 THR H 3.140 . 4.480 4.380 4.255 4.442 . 0 0 "[ . 1 . 2]" 1
139 1 45 ASP H 1 60 LEU MD2 3.110 . 4.420 3.138 2.619 3.579 . 0 0 "[ . 1 . 2]" 1
140 1 45 ASP H 1 61 ARG H 2.690 . 3.580 3.656 3.148 3.988 0.408 7 0 "[ . 1 . 2]" 1
141 1 46 THR H 1 47 ALA H 3.280 . 4.760 4.384 4.294 4.502 . 0 0 "[ . 1 . 2]" 1
142 1 47 ALA H 1 48 SER H 2.880 . 3.960 4.259 3.899 4.405 0.445 6 0 "[ . 1 . 2]" 1
143 1 47 ALA H 1 58 VAL MG1 3.320 . 4.830 3.509 2.889 4.094 . 0 0 "[ . 1 . 2]" 1
144 1 47 ALA H 1 59 VAL H 2.830 . 3.860 3.227 2.827 4.023 0.163 15 0 "[ . 1 . 2]" 1
145 1 47 ALA MB 1 48 SER H 3.000 . 4.200 2.952 2.619 3.408 . 0 0 "[ . 1 . 2]" 1
146 1 47 ALA MB 1 59 VAL H 3.520 . 5.240 3.416 2.648 4.166 . 0 0 "[ . 1 . 2]" 1
147 1 48 SER H 1 49 SER H 3.230 . 4.660 4.480 4.405 4.587 . 0 0 "[ . 1 . 2]" 1
148 1 48 SER H 1 59 VAL H 3.290 . 4.780 4.786 4.472 5.047 0.267 20 0 "[ . 1 . 2]" 1
149 1 49 SER H 1 50 GLN H 3.070 . 4.340 4.127 3.974 4.290 . 0 0 "[ . 1 . 2]" 1
150 1 49 SER H 1 56 TYR QD 3.510 . 5.220 3.903 2.536 5.155 . 0 0 "[ . 1 . 2]" 1
151 1 49 SER H 1 57 GLU H 2.450 . 3.100 3.124 2.619 3.988 0.888 7 3 "[ . + 1 . - *]" 1
152 1 49 SER H 1 59 VAL H 3.480 . 5.160 4.985 4.452 5.510 0.350 10 0 "[ . 1 . 2]" 1
153 1 50 GLN H 1 51 LEU H 3.300 . 4.800 4.408 4.271 4.636 . 0 0 "[ . 1 . 2]" 1
154 1 50 GLN H 1 56 TYR QE 3.340 . 4.880 5.335 3.778 8.988 4.108 10 7 "[ *- ** * + .* 2]" 1
155 1 50 GLN H 1 57 GLU H 3.460 . 5.120 4.926 4.568 5.170 0.050 10 0 "[ . 1 . 2]" 1
156 1 51 LEU H 1 52 ALA H 1.910 . 2.020 2.209 1.835 2.396 0.376 15 0 "[ . 1 . 2]" 1
157 1 51 LEU H 1 55 VAL H 3.260 . 4.720 4.889 4.564 5.201 0.481 20 0 "[ . 1 . 2]" 1
158 1 51 LEU H 1 55 VAL MG1 3.270 . 4.740 3.587 3.099 4.039 . 0 0 "[ . 1 . 2]" 1
159 1 51 LEU H 1 57 GLU H 3.120 . 4.440 3.883 3.459 4.305 . 0 0 "[ . 1 . 2]" 1
160 1 51 LEU MD1 1 55 VAL MG1 3.050 . 4.300 2.417 2.042 3.010 . 0 0 "[ . 1 . 2]" 1
161 1 51 LEU MD1 1 57 GLU H 3.230 . 4.660 3.955 3.279 4.498 . 0 0 "[ . 1 . 2]" 1
162 1 52 ALA H 1 53 ASP H 3.170 . 4.540 4.349 4.295 4.381 . 0 0 "[ . 1 . 2]" 1
163 1 52 ALA H 1 55 VAL H 2.830 . 3.860 3.533 3.258 3.842 . 0 0 "[ . 1 . 2]" 1
164 1 52 ALA H 1 55 VAL MG1 3.020 . 4.240 3.400 2.995 3.776 . 0 0 "[ . 1 . 2]" 1
165 1 52 ALA H 1 55 VAL MG2 3.320 . 4.830 4.080 3.796 4.465 . 0 0 "[ . 1 . 2]" 1
166 1 52 ALA MB 1 53 ASP H 2.310 . 2.820 2.099 1.896 2.201 . 0 0 "[ . 1 . 2]" 1
167 1 52 ALA MB 1 55 VAL MG1 3.410 . 5.020 3.042 2.632 3.365 . 0 0 "[ . 1 . 2]" 1
168 1 52 ALA MB 1 55 VAL MG2 2.970 . 4.140 2.208 2.041 2.640 . 0 0 "[ . 1 . 2]" 1
169 1 53 ASP H 1 54 ASP H 3.280 . 4.760 4.452 4.296 4.541 . 0 0 "[ . 1 . 2]" 1
170 1 53 ASP H 1 55 VAL H 3.330 . 4.860 4.111 3.914 4.460 . 0 0 "[ . 1 . 2]" 1
171 1 53 ASP H 1 55 VAL MG2 3.290 . 4.780 4.063 3.735 4.744 . 0 0 "[ . 1 . 2]" 1
172 1 54 ASP H 1 55 VAL H 2.360 . 2.920 2.766 2.535 2.875 . 0 0 "[ . 1 . 2]" 1
173 1 55 VAL H 1 56 TYR H 2.870 . 3.940 4.222 4.064 4.317 0.377 12 0 "[ . 1 . 2]" 1
174 1 55 VAL MG1 1 56 TYR H 3.150 . 4.500 3.008 2.803 3.153 . 0 0 "[ . 1 . 2]" 1
175 1 55 VAL MG1 1 84 PHE H 3.510 . 5.220 4.163 3.600 4.597 . 0 0 "[ . 1 . 2]" 1
176 1 56 TYR H 1 57 GLU H 3.230 . 4.660 4.331 4.142 4.457 . 0 0 "[ . 1 . 2]" 1
177 1 56 TYR H 1 84 PHE H 3.050 . 4.300 3.563 3.350 3.755 . 0 0 "[ . 1 . 2]" 1
178 1 56 TYR H 1 86 ILE H 2.500 . 3.200 3.879 3.086 4.850 1.650 16 11 "[*** ** ** .+*-*2]" 1
179 1 56 TYR QD 1 57 GLU H 3.090 . 4.380 3.573 1.961 4.407 0.027 17 0 "[ . 1 . 2]" 1
180 1 56 TYR QD 1 86 ILE MD 3.250 . 4.700 4.083 2.020 6.560 1.860 3 5 "[* + -* 1* . 2]" 1
181 1 57 GLU H 1 58 VAL H 3.220 . 4.640 4.258 4.063 4.444 . 0 0 "[ . 1 . 2]" 1
182 1 57 GLU H 1 84 PHE H 3.490 . 5.180 4.668 4.353 5.041 . 0 0 "[ . 1 . 2]" 1
183 1 58 VAL H 1 59 VAL H 3.190 . 4.580 4.259 4.096 4.362 . 0 0 "[ . 1 . 2]" 1
184 1 58 VAL H 1 82 GLY H 2.730 . 3.660 3.499 3.016 4.015 0.355 11 0 "[ . 1 . 2]" 1
185 1 58 VAL H 1 84 PHE H 2.960 . 4.120 3.949 3.536 4.349 0.229 7 0 "[ . 1 . 2]" 1
186 1 58 VAL H 1 84 PHE QD 3.260 . 4.720 2.710 2.071 3.371 . 0 0 "[ . 1 . 2]" 1
187 1 58 VAL MG1 1 59 VAL H 2.810 . 3.820 2.997 2.876 3.149 . 0 0 "[ . 1 . 2]" 1
188 1 58 VAL MG2 1 59 VAL H 3.490 . 5.180 4.215 4.087 4.299 . 0 0 "[ . 1 . 2]" 1
189 1 58 VAL MG2 1 84 PHE QD 3.470 . 5.140 2.456 1.882 3.222 . 0 0 "[ . 1 . 2]" 1
190 1 58 VAL MG2 1 98 LEU QD 3.280 . 4.760 2.479 1.929 4.154 . 0 0 "[ . 1 . 2]" 1
191 1 59 VAL H 1 60 LEU H 3.230 . 4.660 4.431 4.375 4.485 . 0 0 "[ . 1 . 2]" 1
192 1 59 VAL H 1 82 GLY H 3.510 . 5.220 4.663 4.399 4.887 . 0 0 "[ . 1 . 2]" 1
193 1 59 VAL MG1 1 60 LEU H 2.730 . 3.660 2.605 2.453 2.681 . 0 0 "[ . 1 . 2]" 1
194 1 59 VAL MG1 1 80 GLN H 3.440 . 5.080 3.668 3.469 3.841 . 0 0 "[ . 1 . 2]" 1
195 1 59 VAL MG1 1 81 GLY H 3.400 . 5.000 3.379 3.162 3.856 . 0 0 "[ . 1 . 2]" 1
196 1 60 LEU H 1 61 ARG H 3.250 . 4.700 4.242 4.143 4.351 . 0 0 "[ . 1 . 2]" 1
197 1 60 LEU H 1 80 GLN H 3.060 . 4.320 3.701 3.363 4.101 . 0 0 "[ . 1 . 2]" 1
198 1 60 LEU H 1 81 GLY H 3.260 . 4.720 4.499 4.359 4.752 0.032 7 0 "[ . 1 . 2]" 1
199 1 60 LEU H 1 82 GLY H 3.250 . 4.700 4.529 4.297 4.886 0.186 12 0 "[ . 1 . 2]" 1
200 1 60 LEU MD1 1 62 VAL QG 2.780 . 3.760 2.312 1.877 2.576 . 0 0 "[ . 1 . 2]" 1
201 1 60 LEU MD1 1 110 ALA MB 3.070 . 4.340 2.342 2.040 2.610 . 0 0 "[ . 1 . 2]" 1
202 1 60 LEU MD2 1 61 ARG H 2.310 . 2.820 2.501 2.377 2.576 . 0 0 "[ . 1 . 2]" 1
203 1 60 LEU MD2 1 62 VAL H 3.280 . 4.760 3.349 2.990 4.357 . 0 0 "[ . 1 . 2]" 1
204 1 60 LEU MD2 1 62 VAL QG 2.420 . 3.040 2.003 1.855 2.568 . 0 0 "[ . 1 . 2]" 1
205 1 61 ARG H 1 62 VAL H 3.090 . 4.380 4.096 4.037 4.215 . 0 0 "[ . 1 . 2]" 1
206 1 61 ARG H 1 62 VAL QG 3.340 . 4.880 4.204 3.884 4.437 . 0 0 "[ . 1 . 2]" 1
207 1 62 VAL H 1 63 THR H 3.030 . 4.260 4.472 4.302 4.543 0.283 3 0 "[ . 1 . 2]" 1
208 1 62 VAL H 1 78 VAL H 2.970 . 4.140 3.316 3.152 3.484 . 0 0 "[ . 1 . 2]" 1
209 1 62 VAL H 1 80 GLN H 3.090 . 4.380 3.991 3.704 4.290 . 0 0 "[ . 1 . 2]" 1
210 1 62 VAL QG 1 63 THR H 3.010 . 4.220 2.539 2.271 3.036 . 0 0 "[ . 1 . 2]" 1
211 1 62 VAL QG 1 64 VAL MG2 3.160 . 4.520 2.431 2.171 2.732 . 0 0 "[ . 1 . 2]" 1
212 1 62 VAL QG 1 110 ALA MB 3.090 . 4.380 1.952 1.697 2.211 0.103 5 0 "[ . 1 . 2]" 1
213 1 62 VAL QG 1 114 ILE MD 2.410 . 3.020 2.180 1.966 2.298 . 0 0 "[ . 1 . 2]" 1
214 1 62 VAL QG 1 128 LEU QD 2.990 . 4.180 3.115 2.078 4.628 0.448 7 0 "[ . 1 . 2]" 1
215 1 63 THR H 1 64 VAL H 3.270 . 4.740 4.317 4.201 4.415 . 0 0 "[ . 1 . 2]" 1
216 1 64 VAL H 1 65 THR H 2.990 . 4.180 4.099 3.934 4.316 0.136 11 0 "[ . 1 . 2]" 1
217 1 64 VAL H 1 75 LEU MD1 3.120 . 4.440 3.240 2.742 3.720 . 0 0 "[ . 1 . 2]" 1
218 1 64 VAL H 1 76 CYS H 2.660 . 3.520 3.124 2.778 3.539 0.019 16 0 "[ . 1 . 2]" 1
219 1 64 VAL H 1 77 GLU H 3.450 . 5.100 4.830 4.554 5.015 . 0 0 "[ . 1 . 2]" 1
220 1 64 VAL MG1 1 65 THR H 2.930 . 4.060 3.110 2.571 3.280 . 0 0 "[ . 1 . 2]" 1
221 1 64 VAL MG1 1 126 LEU QD 2.740 . 3.680 2.448 1.847 4.019 0.339 14 0 "[ . 1 . 2]" 1
222 1 64 VAL MG2 1 114 ILE MD 3.140 . 4.480 2.016 1.834 2.237 . 0 0 "[ . 1 . 2]" 1
223 1 64 VAL MG2 1 128 LEU QD 2.890 . 3.990 2.596 1.812 4.448 0.458 7 0 "[ . 1 . 2]" 1
224 1 65 THR H 1 66 ALA H 3.270 . 4.740 4.428 4.246 4.556 . 0 0 "[ . 1 . 2]" 1
225 1 65 THR H 1 76 CYS H 3.390 . 4.980 4.904 4.738 5.104 0.124 2 0 "[ . 1 . 2]" 1
226 1 66 ALA H 1 67 SER H 2.970 . 4.140 4.145 3.991 4.315 0.175 18 0 "[ . 1 . 2]" 1
227 1 66 ALA H 1 73 ALA H 3.170 . 4.540 4.444 4.253 4.803 0.263 3 0 "[ . 1 . 2]" 1
228 1 66 ALA H 1 74 PHE H 2.660 . 3.520 3.339 3.111 3.559 0.039 20 0 "[ . 1 . 2]" 1
229 1 66 ALA H 1 74 PHE QD 3.460 . 5.120 4.226 3.940 4.604 . 0 0 "[ . 1 . 2]" 1
230 1 66 ALA H 1 76 CYS H 3.320 . 4.830 5.050 4.623 5.350 0.520 11 1 "[ . 1+ . 2]" 1
231 1 66 ALA MB 1 67 SER H 3.050 . 4.300 3.375 3.175 3.537 . 0 0 "[ . 1 . 2]" 1
232 1 66 ALA MB 1 73 ALA H 3.450 . 5.100 3.585 3.228 3.930 . 0 0 "[ . 1 . 2]" 1
233 1 66 ALA MB 1 73 ALA MB 3.040 . 4.280 2.289 2.155 2.512 . 0 0 "[ . 1 . 2]" 1
234 1 66 ALA MB 1 74 PHE H 2.990 . 4.180 2.570 2.246 3.085 . 0 0 "[ . 1 . 2]" 1
235 1 66 ALA MB 1 74 PHE QD 3.090 . 4.380 3.143 2.989 3.442 . 0 0 "[ . 1 . 2]" 1
236 1 66 ALA MB 1 74 PHE QE 2.660 . 3.520 2.892 2.793 3.095 . 0 0 "[ . 1 . 2]" 1
237 1 66 ALA MB 1 126 LEU QD 3.510 . 5.220 4.222 3.155 5.842 0.622 19 1 "[ . 1 . +2]" 1
238 1 67 SER H 1 68 LEU H 3.260 . 4.720 4.350 4.244 4.483 . 0 0 "[ . 1 . 2]" 1
239 1 67 SER H 1 69 GLY H 3.340 . 4.880 5.150 4.621 5.663 0.783 8 4 "[ .* + 1 - . * 2]" 1
240 1 67 SER H 1 73 ALA H 3.220 . 4.640 4.582 4.216 4.851 0.211 7 0 "[ . 1 . 2]" 1
241 1 68 LEU H 1 69 GLY H 2.590 . 3.380 3.676 3.099 3.956 0.576 17 4 "[ *- *1 . + 2]" 1
242 1 68 LEU H 1 71 GLU H 2.990 . 4.180 3.856 3.214 4.441 0.261 2 0 "[ . 1 . 2]" 1
243 1 68 LEU H 1 72 THR H 3.250 . 4.700 4.638 4.349 4.915 0.215 2 0 "[ . 1 . 2]" 1
244 1 68 LEU H 1 73 ALA H 2.620 . 3.440 3.277 2.881 3.698 0.258 8 0 "[ . 1 . 2]" 1
245 1 68 LEU H 1 73 ALA MB 3.130 . 4.460 3.621 3.043 4.325 . 0 0 "[ . 1 . 2]" 1
246 1 68 LEU MD1 1 73 ALA MB 3.040 . 4.280 2.291 1.723 2.835 0.077 13 0 "[ . 1 . 2]" 1
247 1 68 LEU MD2 1 73 ALA MB 2.860 . 3.920 2.618 2.209 2.948 . 0 0 "[ . 1 . 2]" 1
248 1 69 GLY H 1 70 GLU H 2.990 . 4.180 4.143 3.996 4.464 0.284 2 0 "[ . 1 . 2]" 1
249 1 69 GLY H 1 71 GLU H 3.230 . 4.660 4.613 4.211 4.906 0.246 18 0 "[ . 1 . 2]" 1
250 1 70 GLU H 1 71 GLU H 1.990 . 2.180 2.093 1.757 2.394 0.214 1 0 "[ . 1 . 2]" 1
251 1 71 GLU H 1 72 THR H 3.190 . 4.580 4.339 4.159 4.543 . 0 0 "[ . 1 . 2]" 1
252 1 72 THR H 1 73 ALA H 3.330 . 4.860 4.516 4.343 4.577 . 0 0 "[ . 1 . 2]" 1
253 1 73 ALA H 1 74 PHE H 2.120 . 2.440 2.521 2.398 2.862 0.422 9 0 "[ . 1 . 2]" 1
254 1 73 ALA MB 1 74 PHE H 2.540 . 3.280 2.162 2.021 2.281 . 0 0 "[ . 1 . 2]" 1
255 1 73 ALA MB 1 74 PHE QD 3.350 . 4.900 2.699 2.491 2.960 . 0 0 "[ . 1 . 2]" 1
256 1 73 ALA MB 1 123 PHE QE 3.440 . 5.080 3.603 2.444 4.464 . 0 0 "[ . 1 . 2]" 1
257 1 74 PHE H 1 75 LEU H 3.090 . 4.380 4.342 4.311 4.368 . 0 0 "[ . 1 . 2]" 1
258 1 74 PHE QD 1 75 LEU H 3.190 . 4.580 3.112 2.709 3.575 . 0 0 "[ . 1 . 2]" 1
259 1 74 PHE QD 1 123 PHE QD 3.480 . 5.160 3.246 2.574 4.056 . 0 0 "[ . 1 . 2]" 1
260 1 74 PHE QD 1 123 PHE QE 3.200 . 4.600 3.395 2.739 5.120 0.520 16 1 "[ . 1 .+ 2]" 1
261 1 74 PHE QE 1 118 VAL MG1 3.240 . 4.680 2.932 2.752 3.075 . 0 0 "[ . 1 . 2]" 1
262 1 74 PHE QE 1 118 VAL MG2 3.070 . 4.340 2.466 2.238 2.696 . 0 0 "[ . 1 . 2]" 1
263 1 74 PHE QE 1 123 PHE QD 3.410 . 5.020 3.704 3.121 4.305 . 0 0 "[ . 1 . 2]" 1
264 1 74 PHE QE 1 126 LEU QD 2.970 . 4.140 3.977 2.787 5.737 1.597 19 5 "[ * * 1 *. - +2]" 1
265 1 75 LEU H 1 76 CYS H 3.190 . 4.580 4.259 3.971 4.426 . 0 0 "[ . 1 . 2]" 1
266 1 75 LEU MD1 1 76 CYS H 2.490 . 3.180 2.015 1.737 2.582 0.063 2 0 "[ . 1 . 2]" 1
267 1 76 CYS H 1 77 GLU H 3.240 . 4.680 4.260 3.755 4.481 . 0 0 "[ . 1 . 2]" 1
268 1 77 GLU H 1 78 VAL H 3.030 . 4.260 4.098 3.984 4.362 0.102 1 0 "[ . 1 . 2]" 1
269 1 77 GLU H 1 78 VAL MG2 3.090 . 4.380 3.401 3.160 4.165 . 0 0 "[ . 1 . 2]" 1
270 1 77 GLU H 1 117 MET ME 2.250 . 2.700 2.740 2.519 3.288 0.588 1 2 "[+ . 1 - 2]" 1
271 1 78 VAL H 1 79 GLN H 3.150 . 4.500 4.081 3.948 4.252 . 0 0 "[ . 1 . 2]" 1
272 1 78 VAL MG1 1 79 GLN H 2.630 . 3.460 3.079 2.704 3.259 . 0 0 "[ . 1 . 2]" 1
273 1 78 VAL MG1 1 80 GLN H 2.900 . 4.000 2.783 2.620 3.184 . 0 0 "[ . 1 . 2]" 1
274 1 78 VAL MG1 1 114 ILE H 3.390 . 4.980 4.017 3.725 4.225 . 0 0 "[ . 1 . 2]" 1
275 1 78 VAL MG2 1 79 GLN H 3.430 . 5.060 4.086 3.872 4.179 . 0 0 "[ . 1 . 2]" 1
276 1 78 VAL MG2 1 114 ILE H 3.040 . 4.280 3.102 2.907 3.321 . 0 0 "[ . 1 . 2]" 1
277 1 78 VAL MG2 1 117 MET ME 2.730 . 3.660 2.202 2.049 2.480 . 0 0 "[ . 1 . 2]" 1
278 1 79 GLN H 1 80 GLN H 2.880 . 3.960 3.897 3.762 4.056 0.096 1 0 "[ . 1 . 2]" 1
279 1 80 GLN H 1 81 GLY H 3.190 . 4.580 4.172 4.083 4.252 . 0 0 "[ . 1 . 2]" 1
280 1 80 GLN H 1 110 ALA MB 3.190 . 4.580 3.522 3.220 3.784 . 0 0 "[ . 1 . 2]" 1
281 1 81 GLY H 1 82 GLY H 3.270 . 4.740 4.562 4.524 4.612 . 0 0 "[ . 1 . 2]" 1
282 1 82 GLY H 1 83 ILE H 3.200 . 4.600 4.153 3.992 4.321 . 0 0 "[ . 1 . 2]" 1
283 1 82 GLY H 1 84 PHE QE 3.490 . 5.180 3.928 3.369 4.269 . 0 0 "[ . 1 . 2]" 1
284 1 83 ILE H 1 84 PHE H 3.280 . 4.760 4.477 4.402 4.523 . 0 0 "[ . 1 . 2]" 1
285 1 84 PHE H 1 85 SER H 3.180 . 4.560 4.240 4.064 4.430 . 0 0 "[ . 1 . 2]" 1
286 1 84 PHE QD 1 85 SER H 3.330 . 4.860 4.340 4.017 4.668 . 0 0 "[ . 1 . 2]" 1
287 1 85 SER H 1 86 ILE H 3.020 . 4.240 4.327 4.058 4.500 0.260 17 0 "[ . 1 . 2]" 1
288 1 86 ILE H 1 87 ALA H 3.260 . 4.720 4.345 4.070 4.515 . 0 0 "[ . 1 . 2]" 1
289 1 86 ILE MD 1 87 ALA H 3.310 . 4.820 3.884 1.775 4.871 0.051 4 0 "[ . 1 . 2]" 1
290 1 86 ILE MD 1 89 ILE MD 3.130 . 4.460 2.514 1.806 4.769 0.309 14 0 "[ . 1 . 2]" 1
291 1 86 ILE MD 1 94 MET ME 2.450 . 3.100 3.347 1.819 6.690 3.590 2 9 "[*+**** * - . *2]" 1
292 1 87 ALA H 1 88 GLY H 3.050 . 4.300 4.343 4.247 4.405 0.105 1 0 "[ . 1 . 2]" 1
293 1 87 ALA H 1 89 ILE H 2.970 . 4.140 4.468 3.806 5.095 0.955 1 7 "[+ .**- 1* * . * 2]" 1
294 1 87 ALA H 1 89 ILE MD 2.090 . 2.380 3.507 2.452 5.845 3.465 1 17 "[+-****** ****** ** *]" 1
295 1 87 ALA MB 1 88 GLY H 2.820 . 3.840 2.369 2.099 2.819 . 0 0 "[ . 1 . 2]" 1
296 1 88 GLY H 1 89 ILE H 2.110 . 2.420 2.593 2.181 3.087 0.667 14 2 "[ . 1 +. -2]" 1
297 1 88 GLY H 1 89 ILE MD 2.990 . 4.180 3.712 2.756 4.900 0.720 1 1 "[+ . 1 . 2]" 1
298 1 89 ILE H 1 90 GLU H 3.260 . 4.720 4.472 4.343 4.550 . 0 0 "[ . 1 . 2]" 1
299 1 89 ILE MD 1 94 MET ME 3.260 . 4.720 3.450 2.108 6.032 1.312 19 2 "[ .- 1 . +2]" 1
300 1 90 GLU H 1 91 GLY H 3.190 . 4.580 4.394 4.322 4.456 . 0 0 "[ . 1 . 2]" 1
301 1 90 GLU H 1 94 MET H 2.820 . 3.840 3.760 2.795 4.432 0.592 1 1 "[+ . 1 . 2]" 1
302 1 91 GLY H 1 92 THR H 3.330 . 4.860 4.538 4.424 4.618 . 0 0 "[ . 1 . 2]" 1
303 1 91 GLY H 1 94 MET H 3.400 . 5.000 4.433 4.045 5.087 0.087 18 0 "[ . 1 . 2]" 1
304 1 92 THR H 1 93 GLN H 2.160 . 2.520 2.523 2.311 2.699 0.179 19 0 "[ . 1 . 2]" 1
305 1 92 THR H 1 94 MET H 3.080 . 4.360 4.412 4.072 4.626 0.266 14 0 "[ . 1 . 2]" 1
306 1 92 THR H 1 95 ALA H 3.490 . 5.180 4.897 4.598 5.293 0.113 18 0 "[ . 1 . 2]" 1
307 1 93 GLN H 1 94 MET H 2.370 . 2.940 2.622 2.531 2.748 . 0 0 "[ . 1 . 2]" 1
308 1 93 GLN H 1 95 ALA H 3.150 . 4.500 3.940 3.630 4.317 . 0 0 "[ . 1 . 2]" 1
309 1 93 GLN H 1 96 HIS H 3.390 . 4.980 4.672 4.319 5.148 0.168 17 0 "[ . 1 . 2]" 1
310 1 94 MET H 1 95 ALA H 2.280 . 2.760 2.518 2.336 2.695 . 0 0 "[ . 1 . 2]" 1
311 1 94 MET H 1 96 HIS H 2.990 . 4.180 3.972 3.757 4.261 0.081 16 0 "[ . 1 . 2]" 1
312 1 94 MET H 1 97 CYS H 3.280 . 4.760 4.724 4.496 5.198 0.438 17 0 "[ . 1 . 2]" 1
313 1 94 MET ME 1 98 LEU QD 2.990 . 4.180 2.786 1.682 5.107 0.927 8 3 "[ .* + 1 . -2]" 1
314 1 95 ALA H 1 96 HIS H 2.280 . 2.760 2.608 2.478 2.772 0.012 16 0 "[ . 1 . 2]" 1
315 1 95 ALA H 1 97 CYS H 3.050 . 4.300 4.107 3.802 4.456 0.156 7 0 "[ . 1 . 2]" 1
316 1 95 ALA H 1 98 LEU H 3.370 . 4.940 5.044 4.876 5.269 0.329 17 0 "[ . 1 . 2]" 1
317 1 95 ALA H 1 98 LEU QD 3.390 . 4.980 5.389 4.049 6.394 1.414 8 11 "[ ** ** + * - ** **2]" 1
318 1 95 ALA MB 1 96 HIS H 2.700 . 3.600 2.752 2.550 2.891 . 0 0 "[ . 1 . 2]" 1
319 1 96 HIS H 1 97 CYS H 2.180 . 2.560 2.555 2.328 2.787 0.227 1 0 "[ . 1 . 2]" 1
320 1 96 HIS H 1 98 LEU H 2.920 . 4.040 4.573 4.219 4.809 0.769 17 15 "[*-**.* ***** **+ **]" 1
321 1 96 HIS H 1 99 GLY H 3.180 . 4.560 4.626 4.384 4.941 0.381 17 0 "[ . 1 . 2]" 1
322 1 97 CYS H 1 98 LEU H 2.240 . 2.680 2.805 2.558 2.944 0.264 14 0 "[ . 1 . 2]" 1
323 1 97 CYS H 1 99 GLY H 2.840 . 3.880 3.818 3.619 3.992 0.112 13 0 "[ . 1 . 2]" 1
324 1 97 CYS H 1 100 ALA H 3.440 . 5.080 4.802 4.654 4.992 . 0 0 "[ . 1 . 2]" 1
325 1 97 CYS H 1 101 TYR H 3.490 . 5.180 4.852 4.698 4.999 . 0 0 "[ . 1 . 2]" 1
326 1 98 LEU H 1 99 GLY H 2.030 . 2.260 2.606 2.372 2.727 0.467 18 0 "[ . 1 . 2]" 1
327 1 98 LEU H 1 100 ALA H 2.900 . 4.000 4.349 4.123 4.532 0.532 20 5 "[ *.* 1 * . - +]" 1
328 1 98 LEU H 1 101 TYR H 3.370 . 4.940 4.997 4.655 5.321 0.381 9 0 "[ . 1 . 2]" 1
329 1 98 LEU H 1 102 CYS H 3.340 . 4.880 4.929 4.656 5.054 0.174 17 0 "[ . 1 . 2]" 1
330 1 98 LEU QD 1 99 GLY H 3.230 . 4.660 3.612 2.625 4.260 . 0 0 "[ . 1 . 2]" 1
331 1 99 GLY H 1 100 ALA H 2.060 . 2.320 2.525 2.318 2.634 0.314 2 0 "[ . 1 . 2]" 1
332 1 99 GLY H 1 100 ALA MB 3.380 . 4.960 4.339 4.148 4.464 . 0 0 "[ . 1 . 2]" 1
333 1 99 GLY H 1 101 TYR H 2.980 . 4.160 4.105 3.833 4.281 0.121 2 0 "[ . 1 . 2]" 1
334 1 99 GLY H 1 102 CYS H 3.130 . 4.460 4.906 4.526 5.299 0.839 8 7 "[ * . + * .* *-*]" 1
335 1 100 ALA H 1 101 TYR H 2.090 . 2.380 2.070 1.912 2.227 . 0 0 "[ . 1 . 2]" 1
336 1 100 ALA H 1 102 CYS H 2.470 . 3.140 3.660 3.311 4.069 0.929 18 11 "[* **. ** 1-* *. *+ *]" 1
337 1 100 ALA MB 1 101 TYR H 2.450 . 3.100 2.514 2.336 2.732 . 0 0 "[ . 1 . 2]" 1
338 1 101 TYR H 1 102 CYS H 2.300 . 2.800 2.746 2.550 2.920 0.120 4 0 "[ . 1 . 2]" 1
339 1 101 TYR QD 1 102 CYS H 3.110 . 4.420 3.206 2.839 3.593 . 0 0 "[ . 1 . 2]" 1
340 1 101 TYR QE 1 105 ILE MD 3.050 . 4.300 3.163 2.414 3.924 . 0 0 "[ . 1 . 2]" 1
341 1 101 TYR QE 3 138 MET ME 3.360 . 4.920 3.827 1.990 6.515 1.595 19 3 "[ . -1 * . +2]" 1
342 1 109 TYR H 1 110 ALA H 2.150 . 2.500 2.492 2.352 2.572 0.072 2 0 "[ . 1 . 2]" 1
343 1 109 TYR H 1 111 ARG H 2.980 . 4.160 3.993 3.762 4.154 . 0 0 "[ . 1 . 2]" 1
344 1 109 TYR QD 1 110 ALA H 3.400 . 5.000 4.139 3.827 4.738 . 0 0 "[ . 1 . 2]" 1
345 1 109 TYR QE 3 131 VAL H 3.120 . 4.440 5.194 3.724 6.536 2.096 13 15 "[* - ******* + *****2]" 1
346 1 110 ALA H 1 111 ARG H 2.140 . 2.480 2.579 2.479 2.635 0.155 18 0 "[ . 1 . 2]" 1
347 1 110 ALA H 1 112 GLU H 2.970 . 4.140 4.137 3.878 4.332 0.192 20 0 "[ . 1 . 2]" 1
348 1 110 ALA MB 1 111 ARG H 2.640 . 3.480 2.464 2.326 2.584 . 0 0 "[ . 1 . 2]" 1
349 1 110 ALA MB 1 114 ILE MD 3.480 . 5.160 3.075 2.878 3.401 . 0 0 "[ . 1 . 2]" 1
350 1 111 ARG H 1 112 GLU H 2.360 . 2.920 2.851 2.687 2.968 0.048 16 0 "[ . 1 . 2]" 1
351 1 111 ARG H 1 113 CYS H 3.150 . 4.500 4.299 4.194 4.433 . 0 0 "[ . 1 . 2]" 1
352 1 112 GLU H 1 113 CYS H 2.270 . 2.740 2.710 2.612 2.901 0.161 9 0 "[ . 1 . 2]" 1
353 1 112 GLU H 1 114 ILE H 3.370 . 4.940 4.303 4.113 4.456 . 0 0 "[ . 1 . 2]" 1
354 1 112 GLU H 1 115 THR H 3.410 . 5.020 4.699 4.550 5.017 . 0 0 "[ . 1 . 2]" 1
355 1 112 GLU H 3 109 TYR QE 3.440 . 5.080 4.498 4.223 4.868 . 0 0 "[ . 1 . 2]" 1
356 1 113 CYS H 1 114 ILE H 2.420 . 3.040 2.739 2.657 2.810 . 0 0 "[ . 1 . 2]" 1
357 1 113 CYS H 1 115 THR H 2.970 . 4.140 4.166 3.919 4.654 0.514 9 1 "[ . +1 . 2]" 1
358 1 113 CYS H 1 116 SER H 3.300 . 4.800 4.870 4.775 4.980 0.180 4 0 "[ . 1 . 2]" 1
359 1 114 ILE H 1 115 THR H 2.380 . 2.960 2.653 2.427 2.837 . 0 0 "[ . 1 . 2]" 1
360 1 114 ILE H 1 116 SER H 3.110 . 4.410 4.216 3.998 4.323 . 0 0 "[ . 1 . 2]" 1
361 1 114 ILE H 1 117 MET H 3.450 . 5.100 4.881 4.769 4.982 . 0 0 "[ . 1 . 2]" 1
362 1 115 THR H 1 116 SER H 2.270 . 2.740 2.763 2.696 2.878 0.138 9 0 "[ . 1 . 2]" 1
363 1 115 THR H 1 117 MET H 3.140 . 4.480 4.275 4.064 4.590 0.110 9 0 "[ . 1 . 2]" 1
364 1 116 SER H 1 117 MET H 2.260 . 2.730 2.646 2.568 2.759 0.029 20 0 "[ . 1 . 2]" 1
365 1 116 SER H 1 118 VAL H 3.200 . 4.600 4.132 4.022 4.278 . 0 0 "[ . 1 . 2]" 1
366 1 117 MET H 1 118 VAL H 2.440 . 3.080 2.706 2.532 2.803 . 0 0 "[ . 1 . 2]" 1
367 1 117 MET H 1 119 SER H 3.320 . 4.830 4.295 4.171 4.396 . 0 0 "[ . 1 . 2]" 1
368 1 117 MET H 2 117 MET ME 3.400 . 5.000 4.020 3.755 4.546 . 0 0 "[ . 1 . 2]" 1
369 1 118 VAL H 1 119 SER H 2.470 . 3.140 2.734 2.630 2.789 . 0 0 "[ . 1 . 2]" 1
370 1 118 VAL H 1 121 GLY H 3.460 . 5.120 4.770 4.575 4.957 . 0 0 "[ . 1 . 2]" 1
371 1 118 VAL MG1 1 119 SER H 2.900 . 4.000 3.291 3.182 3.499 . 0 0 "[ . 1 . 2]" 1
372 1 118 VAL MG1 1 123 PHE H 3.210 . 4.620 3.794 3.217 4.177 . 0 0 "[ . 1 . 2]" 1
373 1 118 VAL MG1 1 123 PHE QD 3.080 . 4.360 3.308 2.798 4.642 0.282 16 0 "[ . 1 . 2]" 1
374 1 118 VAL MG1 1 126 LEU H 3.340 . 4.880 3.238 2.874 3.489 . 0 0 "[ . 1 . 2]" 1
375 1 118 VAL MG2 1 119 SER H 3.220 . 4.640 3.904 3.804 4.006 . 0 0 "[ . 1 . 2]" 1
376 1 118 VAL MG2 1 126 LEU QD 3.130 . 4.460 3.575 2.517 4.842 0.382 14 0 "[ . 1 . 2]" 1
377 1 119 SER H 1 121 GLY H 3.150 . 4.500 4.019 3.742 4.191 . 0 0 "[ . 1 . 2]" 1
378 1 119 SER H 1 123 PHE H 3.400 . 5.000 5.021 4.750 5.435 0.435 16 0 "[ . 1 . 2]" 1
379 1 121 GLY H 1 122 THR H 2.450 . 3.100 2.725 2.583 2.996 . 0 0 "[ . 1 . 2]" 1
380 1 121 GLY H 1 123 PHE H 2.910 . 4.020 3.690 3.457 3.996 . 0 0 "[ . 1 . 2]" 1
381 1 121 GLY H 2 18 THR H 3.280 . 4.760 4.288 4.094 4.678 . 0 0 "[ . 1 . 2]" 1
382 1 122 THR H 1 123 PHE H 2.420 . 3.040 2.606 2.512 2.896 . 0 0 "[ . 1 . 2]" 1
383 1 122 THR H 2 18 THR H 2.940 . 4.080 4.137 3.869 4.267 0.187 6 0 "[ . 1 . 2]" 1
384 1 125 GLN H 1 126 LEU H 3.300 . 4.800 4.622 4.537 4.667 . 0 0 "[ . 1 . 2]" 1
385 1 126 LEU H 1 127 ASN H 2.830 . 3.860 4.106 3.758 4.344 0.484 14 0 "[ . 1 . 2]" 1
386 1 126 LEU QD 1 127 ASN H 2.920 . 4.040 2.941 2.230 4.385 0.345 10 0 "[ . 1 . 2]" 1
387 1 126 LEU QD 1 128 LEU QD 3.090 . 4.380 2.342 1.924 3.798 . 0 0 "[ . 1 . 2]" 1
388 1 127 ASN H 1 128 LEU H 3.150 . 4.500 4.071 3.858 4.225 . 0 0 "[ . 1 . 2]" 1
389 1 128 LEU H 1 129 ALA H 3.240 . 4.680 4.587 4.415 4.661 . 0 0 "[ . 1 . 2]" 1
390 1 128 LEU QD 1 129 ALA H 3.400 . 5.000 3.041 1.751 4.169 0.049 7 0 "[ . 1 . 2]" 1
391 1 129 ALA MB 3 13 ILE H 3.010 . 4.220 3.561 2.700 4.684 0.464 3 0 "[ . 1 . 2]" 1
392 1 131 VAL QG 1 133 PHE H 3.510 . 5.220 3.295 2.208 4.605 . 0 0 "[ . 1 . 2]" 1
393 1 131 VAL QG 1 133 PHE QD 3.120 . 4.440 3.746 1.892 5.669 1.229 2 3 "[ + -. 1 * . 2]" 1
394 1 131 VAL QG 1 133 PHE QE 2.720 . 3.640 4.508 2.474 7.169 3.529 2 12 "[*+ *.*** - ***. **]" 1
395 1 133 PHE H 1 134 ASP H 2.190 . 2.580 2.584 2.351 2.845 0.265 16 0 "[ . 1 . 2]" 1
396 1 133 PHE H 1 135 ALA H 2.850 . 3.900 4.329 3.939 4.639 0.739 16 6 "[* . -1 *+ **2]" 1
397 1 133 PHE H 1 136 LEU H 3.430 . 5.060 4.910 4.516 5.686 0.626 9 1 "[ . +1 . 2]" 1
398 1 133 PHE QD 1 134 ASP H 3.230 . 4.660 4.082 3.058 4.612 . 0 0 "[ . 1 . 2]" 1
399 1 134 ASP H 1 135 ALA H 2.310 . 2.820 2.685 2.515 2.894 0.074 11 0 "[ . 1 . 2]" 1
400 1 134 ASP H 1 136 LEU H 3.330 . 4.860 4.104 3.602 4.826 . 0 0 "[ . 1 . 2]" 1
401 1 134 ASP H 1 137 PHE H 3.420 . 5.040 4.773 4.531 5.175 0.135 18 0 "[ . 1 . 2]" 1
402 1 135 ALA H 1 136 LEU H 2.390 . 2.980 2.614 2.392 2.881 . 0 0 "[ . 1 . 2]" 1
403 1 135 ALA H 1 137 PHE H 2.970 . 4.140 4.090 3.736 4.361 0.221 18 0 "[ . 1 . 2]" 1
404 1 135 ALA MB 1 136 LEU H 2.470 . 3.140 2.588 2.248 2.999 . 0 0 "[ . 1 . 2]" 1
405 1 136 LEU H 1 137 PHE H 2.330 . 2.860 2.664 2.445 2.886 0.026 13 0 "[ . 1 . 2]" 1
406 1 136 LEU H 1 138 MET H 3.440 . 5.080 4.344 3.656 4.766 . 0 0 "[ . 1 . 2]" 1
407 1 136 LEU H 1 139 ASN H 3.360 . 4.920 4.900 4.436 5.336 0.416 12 0 "[ . 1 . 2]" 1
408 1 137 PHE H 1 138 MET H 2.490 . 3.180 2.693 2.399 2.871 . 0 0 "[ . 1 . 2]" 1
409 1 137 PHE H 1 139 ASN H 2.970 . 4.140 4.106 3.719 4.528 0.388 11 0 "[ . 1 . 2]" 1
410 1 137 PHE H 1 140 TYR H 3.370 . 4.940 4.799 4.436 5.216 0.276 12 0 "[ . 1 . 2]" 1
411 1 137 PHE QD 1 138 MET H 3.180 . 4.560 3.657 3.039 4.832 0.272 11 0 "[ . 1 . 2]" 1
412 1 137 PHE QD 1 141 LEU QD 3.230 . 4.660 3.356 2.002 4.423 . 0 0 "[ . 1 . 2]" 1
413 1 138 MET H 1 139 ASN H 2.260 . 2.720 2.650 2.433 2.834 0.114 20 0 "[ . 1 . 2]" 1
414 1 138 MET H 1 140 TYR H 3.100 . 4.400 4.170 3.926 4.486 0.086 20 0 "[ . 1 . 2]" 1
415 1 138 MET H 1 141 LEU H 3.290 . 4.780 4.782 4.529 5.149 0.369 4 0 "[ . 1 . 2]" 1
416 1 138 MET H 1 141 LEU QD 3.130 . 4.460 5.027 3.985 6.262 1.802 11 10 "[ * .*** -+* *** 2]" 1
417 1 139 ASN H 1 140 TYR H 2.320 . 2.840 2.696 2.414 2.978 0.138 7 0 "[ . 1 . 2]" 1
418 1 139 ASN H 1 141 LEU H 3.020 . 4.240 4.109 3.709 4.608 0.368 4 0 "[ . 1 . 2]" 1
419 1 140 TYR H 1 141 LEU H 2.100 . 2.400 2.550 2.238 2.713 0.313 9 0 "[ . 1 . 2]" 1
420 1 140 TYR QD 1 141 LEU H 3.080 . 4.360 3.792 3.222 4.076 . 0 0 "[ . 1 . 2]" 1
421 2 9 MET H 2 10 THR H 3.340 . 4.880 4.537 4.436 4.615 . 0 0 "[ . 1 . 2]" 1
422 2 9 MET H 2 89 ILE H 3.150 . 4.500 5.125 4.045 6.260 1.760 5 10 "[ **+** *1* *.* -2]" 1
423 2 9 MET ME 2 10 THR H 2.450 . 3.100 2.747 2.490 3.470 0.370 20 0 "[ . 1 . 2]" 1
424 2 9 MET ME 2 11 PHE H 2.950 . 4.100 3.611 3.304 4.208 0.108 5 0 "[ . 1 . 2]" 1
425 2 9 MET ME 2 11 PHE QD 3.260 . 4.720 3.026 2.214 3.777 . 0 0 "[ . 1 . 2]" 1
426 2 10 THR H 2 11 PHE H 2.770 . 3.740 4.179 3.907 4.383 0.643 5 5 "[ -*+ ** . 2]" 1
427 2 10 THR H 2 87 ALA H 2.640 . 3.480 3.060 2.725 3.468 . 0 0 "[ . 1 . 2]" 1
428 2 10 THR H 2 89 ILE H 3.160 . 4.520 4.012 3.296 4.599 0.079 6 0 "[ . 1 . 2]" 1
429 2 11 PHE H 2 12 GLN H 3.200 . 4.600 4.253 4.060 4.436 . 0 0 "[ . 1 . 2]" 1
430 2 11 PHE QD 2 12 GLN H 2.620 . 3.440 3.513 3.057 3.958 0.518 20 1 "[ . 1 . +]" 1
431 2 11 PHE QE 2 12 GLN H 3.220 . 4.640 4.538 3.982 5.574 0.934 15 1 "[ . 1 + 2]" 1
432 2 11 PHE QE 2 13 ILE H 3.480 . 5.160 4.191 3.647 4.791 . 0 0 "[ . 1 . 2]" 1
433 2 11 PHE QE 2 84 PHE QD 3.440 . 5.080 3.247 2.702 3.657 . 0 0 "[ . 1 . 2]" 1
434 2 11 PHE QE 2 101 TYR QD 3.260 . 4.720 3.175 2.070 3.842 . 0 0 "[ . 1 . 2]" 1
435 2 11 PHE QE 2 101 TYR QE 3.380 . 4.960 3.066 2.601 3.774 . 0 0 "[ . 1 . 2]" 1
436 2 11 PHE QE 2 105 ILE MD 3.140 . 4.480 2.532 2.157 2.852 . 0 0 "[ . 1 . 2]" 1
437 2 12 GLN H 2 13 ILE H 2.910 . 4.020 4.148 3.828 4.390 0.370 4 0 "[ . 1 . 2]" 1
438 2 12 GLN H 2 85 SER H 2.630 . 3.460 2.988 2.456 3.440 . 0 0 "[ . 1 . 2]" 1
439 2 13 ILE H 2 14 GLN H 3.330 . 4.860 4.488 4.280 4.602 . 0 0 "[ . 1 . 2]" 1
440 2 13 ILE H 4 129 ALA MB 3.220 . 4.640 3.653 2.181 4.373 . 0 0 "[ . 1 . 2]" 1
441 2 13 ILE MD 2 14 GLN H 3.350 . 4.900 4.163 2.049 5.365 0.465 14 0 "[ . 1 . 2]" 1
442 2 13 ILE MD 2 15 ARG H 3.350 . 4.900 4.085 2.371 5.421 0.521 14 1 "[ . 1 +. 2]" 1
443 2 13 ILE MD 2 16 ILE MD 2.640 . 3.480 2.166 1.707 3.001 0.093 16 0 "[ . 1 . 2]" 1
444 2 13 ILE MD 2 84 PHE QE 3.430 . 5.060 2.651 2.052 4.040 . 0 0 "[ . 1 . 2]" 1
445 2 13 ILE MD 2 105 ILE MD 3.470 . 5.140 3.147 1.844 5.192 0.052 20 0 "[ . 1 . 2]" 1
446 2 14 GLN H 2 15 ARG H 2.110 . 2.420 2.254 2.074 2.464 0.044 16 0 "[ . 1 . 2]" 1
447 2 14 GLN H 2 83 ILE H 3.120 . 4.440 4.688 4.348 4.962 0.522 5 1 "[ + 1 . 2]" 1
448 2 14 GLN H 2 84 PHE H 3.430 . 5.060 4.848 4.534 5.071 0.011 1 0 "[ . 1 . 2]" 1
449 2 14 GLN H 2 84 PHE QD 3.280 . 4.760 3.863 2.957 4.726 . 0 0 "[ . 1 . 2]" 1
450 2 14 GLN H 2 85 SER H 3.290 . 4.780 4.446 3.814 5.110 0.330 18 0 "[ . 1 . 2]" 1
451 2 15 ARG H 2 16 ILE H 3.130 . 4.460 4.195 4.125 4.277 . 0 0 "[ . 1 . 2]" 1
452 2 15 ARG H 2 83 ILE H 2.450 . 3.100 3.317 3.198 3.451 0.351 4 0 "[ . 1 . 2]" 1
453 2 15 ARG H 2 83 ILE MD 3.500 . 5.200 4.203 3.866 4.819 . 0 0 "[ . 1 . 2]" 1
454 2 16 ILE H 2 17 TYR H 3.260 . 4.720 4.460 4.400 4.505 . 0 0 "[ . 1 . 2]" 1
455 2 16 ILE MD 2 109 TYR QD 2.850 . 3.900 3.576 3.296 3.837 . 0 0 "[ . 1 . 2]" 1
456 2 16 ILE MD 2 109 TYR QE 2.590 . 3.380 2.451 2.230 2.740 . 0 0 "[ . 1 . 2]" 1
457 2 17 TYR H 2 18 THR H 3.150 . 4.500 4.256 4.141 4.350 . 0 0 "[ . 1 . 2]" 1
458 2 17 TYR H 2 81 GLY H 3.070 . 4.340 3.992 3.878 4.192 . 0 0 "[ . 1 . 2]" 1
459 2 17 TYR QD 2 18 THR H 3.190 . 4.580 4.048 3.479 4.356 . 0 0 "[ . 1 . 2]" 1
460 2 17 TYR QE 2 83 ILE H 3.390 . 4.980 2.850 1.991 3.728 . 0 0 "[ . 1 . 2]" 1
461 2 17 TYR QE 2 83 ILE MD 3.140 . 4.480 2.645 2.233 3.124 . 0 0 "[ . 1 . 2]" 1
462 2 18 THR H 2 19 LYS H 3.290 . 4.780 4.443 4.358 4.503 . 0 0 "[ . 1 . 2]" 1
463 2 19 LYS H 2 20 ASP H 2.030 . 2.260 2.263 2.123 2.556 0.296 7 0 "[ . 1 . 2]" 1
464 2 19 LYS H 2 79 GLN H 3.310 . 4.820 4.515 4.309 4.693 . 0 0 "[ . 1 . 2]" 1
465 2 19 LYS H 2 81 GLY H 2.300 . 2.800 2.777 2.459 3.019 0.219 13 0 "[ . 1 . 2]" 1
466 2 20 ASP H 2 21 ILE H 3.150 . 4.500 4.265 4.161 4.322 . 0 0 "[ . 1 . 2]" 1
467 2 20 ASP H 2 21 ILE MD 3.340 . 4.880 3.989 3.885 4.165 . 0 0 "[ . 1 . 2]" 1
468 2 20 ASP H 2 79 GLN H 2.830 . 3.860 3.351 3.159 3.473 . 0 0 "[ . 1 . 2]" 1
469 2 20 ASP H 2 81 GLY H 3.350 . 4.900 4.820 4.654 5.044 0.144 11 0 "[ . 1 . 2]" 1
470 2 21 ILE H 2 22 SER H 3.110 . 4.410 4.262 4.196 4.338 . 0 0 "[ . 1 . 2]" 1
471 2 21 ILE MD 2 22 SER H 3.280 . 4.760 3.439 3.272 3.586 . 0 0 "[ . 1 . 2]" 1
472 2 21 ILE MD 2 78 VAL MG1 2.430 . 3.060 1.969 1.708 2.082 0.092 16 0 "[ . 1 . 2]" 1
473 2 21 ILE MD 2 78 VAL MG2 2.780 . 3.760 1.901 1.764 2.077 0.036 20 0 "[ . 1 . 2]" 1
474 2 21 ILE MD 2 79 GLN H 2.410 . 3.020 2.882 2.582 3.165 0.145 1 0 "[ . 1 . 2]" 1
475 2 22 SER H 2 23 PHE H 3.240 . 4.680 4.151 4.016 4.280 . 0 0 "[ . 1 . 2]" 1
476 2 22 SER H 2 77 GLU H 2.720 . 3.640 3.247 3.023 3.426 . 0 0 "[ . 1 . 2]" 1
477 2 22 SER H 2 78 VAL H 3.460 . 5.120 5.073 4.852 5.200 0.080 7 0 "[ . 1 . 2]" 1
478 2 22 SER H 2 79 GLN H 3.450 . 5.100 5.255 4.954 5.510 0.410 11 0 "[ . 1 . 2]" 1
479 2 23 PHE H 2 24 GLU H 2.980 . 4.160 3.930 3.774 4.154 . 0 0 "[ . 1 . 2]" 1
480 2 23 PHE H 2 77 GLU H 3.480 . 5.160 5.042 4.766 5.193 0.033 14 0 "[ . 1 . 2]" 1
481 2 23 PHE QD 2 24 GLU H 2.820 . 3.840 3.799 3.382 4.002 0.162 16 0 "[ . 1 . 2]" 1
482 2 23 PHE QE 2 24 GLU H 3.470 . 5.140 4.873 4.339 5.141 0.001 11 0 "[ . 1 . 2]" 1
483 2 23 PHE QE 2 25 ALA MB 3.320 . 4.830 2.770 2.448 3.154 . 0 0 "[ . 1 . 2]" 1
484 2 23 PHE QE 2 74 PHE QD 3.460 . 5.120 2.671 1.869 3.087 . 0 0 "[ . 1 . 2]" 1
485 2 23 PHE QE 2 75 LEU H 3.510 . 5.220 4.633 4.117 5.326 0.106 17 0 "[ . 1 . 2]" 1
486 2 24 GLU H 2 25 ALA H 3.260 . 4.720 4.197 3.992 4.395 . 0 0 "[ . 1 . 2]" 1
487 2 24 GLU H 2 75 LEU H 2.630 . 3.460 3.090 2.631 3.396 . 0 0 "[ . 1 . 2]" 1
488 2 24 GLU H 2 76 CYS H 3.480 . 5.160 4.791 4.226 5.074 . 0 0 "[ . 1 . 2]" 1
489 2 25 ALA H 2 75 LEU H 3.490 . 5.180 4.776 4.431 4.997 . 0 0 "[ . 1 . 2]" 1
490 2 25 ALA MB 2 27 ASN H 3.310 . 4.820 3.810 3.452 4.299 . 0 0 "[ . 1 . 2]" 1
491 2 25 ALA MB 2 28 ALA H 2.840 . 3.880 2.992 2.707 3.313 . 0 0 "[ . 1 . 2]" 1
492 2 25 ALA MB 2 28 ALA MB 2.520 . 3.240 1.838 1.665 1.971 0.135 6 0 "[ . 1 . 2]" 1
493 2 27 ASN H 2 28 ALA H 2.220 . 2.640 2.493 2.319 2.699 0.059 17 0 "[ . 1 . 2]" 1
494 2 28 ALA H 2 30 HIS H 2.990 . 4.180 4.122 3.969 4.257 0.077 8 0 "[ . 1 . 2]" 1
495 2 28 ALA H 2 31 VAL H 3.510 . 5.220 5.402 4.998 5.706 0.486 20 0 "[ . 1 . 2]" 1
496 2 30 HIS H 2 31 VAL H 2.270 . 2.740 2.448 2.249 2.650 . 0 0 "[ . 1 . 2]" 1
497 2 30 HIS H 2 32 PHE H 3.320 . 4.840 4.329 4.094 4.659 . 0 0 "[ . 1 . 2]" 1
498 2 31 VAL H 2 32 PHE H 2.380 . 2.960 2.625 2.401 2.776 . 0 0 "[ . 1 . 2]" 1
499 2 31 VAL H 2 33 GLN H 3.270 . 4.740 4.262 3.677 4.655 . 0 0 "[ . 1 . 2]" 1
500 2 31 VAL QG 2 32 PHE H 2.410 . 3.020 2.619 2.331 3.578 0.558 16 1 "[ . 1 .+ 2]" 1
501 2 31 VAL QG 2 68 LEU QD 3.290 . 4.780 1.976 1.769 2.340 0.031 12 0 "[ . 1 . 2]" 1
502 2 32 PHE H 2 33 GLN H 2.340 . 2.880 2.587 2.309 2.787 . 0 0 "[ . 1 . 2]" 1
503 2 32 PHE H 2 34 LYS H 3.190 . 4.580 3.986 3.728 4.422 . 0 0 "[ . 1 . 2]" 1
504 2 32 PHE QD 2 33 GLN H 2.930 . 4.060 3.976 3.555 4.540 0.480 20 0 "[ . 1 . 2]" 1
505 2 33 GLN H 2 34 LYS H 2.390 . 2.980 2.464 2.308 2.666 . 0 0 "[ . 1 . 2]" 1
506 2 34 LYS H 2 35 ASP H 2.960 . 4.120 3.900 3.508 4.295 0.175 8 0 "[ . 1 . 2]" 1
507 2 35 ASP H 2 36 TRP H 2.980 . 4.160 3.839 3.731 3.929 . 0 0 "[ . 1 . 2]" 1
508 2 36 TRP H 2 37 GLN H 3.190 . 4.580 4.297 4.209 4.379 . 0 0 "[ . 1 . 2]" 1
509 2 36 TRP H 2 68 LEU QD 2.990 . 4.180 3.234 2.791 3.594 . 0 0 "[ . 1 . 2]" 1
510 2 36 TRP HE1 2 37 GLN H 3.120 . 4.440 4.599 3.654 6.835 2.395 7 7 "[ - +*** *. *2]" 1
511 2 36 TRP HE3 2 68 LEU QD 3.240 . 4.680 5.093 3.784 6.431 1.751 18 9 "[ * .***** * . + -]" 1
512 2 39 GLU H 2 40 VAL H 3.270 . 4.740 4.368 4.244 4.636 . 0 0 "[ . 1 . 2]" 1
513 2 39 GLU H 2 67 SER H 2.990 . 4.180 3.010 2.595 3.587 . 0 0 "[ . 1 . 2]" 1
514 2 40 VAL H 2 41 LYS H 3.190 . 4.580 4.461 4.370 4.570 . 0 0 "[ . 1 . 2]" 1
515 2 40 VAL QG 2 41 LYS H 2.960 . 4.120 2.874 2.499 3.584 . 0 0 "[ . 1 . 2]" 1
516 2 40 VAL QG 2 64 VAL QG 3.130 . 4.460 2.512 2.041 3.716 . 0 0 "[ . 1 . 2]" 1
517 2 40 VAL QG 2 66 ALA MB 3.250 . 4.700 2.801 1.752 3.853 0.048 9 0 "[ . 1 . 2]" 1
518 2 40 VAL QG 2 74 PHE QE 2.780 . 3.760 2.839 2.080 4.414 0.654 8 1 "[ . + 1 . 2]" 1
519 2 40 VAL QG 2 118 VAL QG 3.280 . 4.760 3.015 1.725 4.027 0.075 11 0 "[ . 1 . 2]" 1
520 2 40 VAL QG 2 126 LEU QD 2.640 . 3.480 2.324 1.508 3.924 0.444 20 0 "[ . 1 . 2]" 1
521 2 41 LYS H 2 42 LEU H 3.160 . 4.520 4.289 3.871 4.458 . 0 0 "[ . 1 . 2]" 1
522 2 41 LYS H 2 64 VAL QG 2.960 . 4.120 2.990 2.383 4.142 0.022 9 0 "[ . 1 . 2]" 1
523 2 41 LYS H 2 65 THR H 2.760 . 3.720 3.590 3.073 4.004 0.284 14 0 "[ . 1 . 2]" 1
524 2 41 LYS H 2 66 ALA MB 3.390 . 4.980 3.640 3.155 4.196 . 0 0 "[ . 1 . 2]" 1
525 2 41 LYS H 2 126 LEU QD 2.430 . 3.060 4.276 3.181 5.788 2.728 19 16 "[*******-** *** * +*]" 1
526 2 42 LEU H 2 43 ASP H 3.240 . 4.680 4.467 4.383 4.577 . 0 0 "[ . 1 . 2]" 1
527 2 42 LEU H 2 65 THR H 3.410 . 5.020 4.947 4.576 5.298 0.278 17 0 "[ . 1 . 2]" 1
528 2 42 LEU H 2 126 LEU QD 2.920 . 4.040 3.905 2.147 5.679 1.639 19 3 "[ . * 1 - . +2]" 1
529 2 42 LEU QD 2 43 ASP H 3.400 . 5.000 3.642 2.238 4.252 . 0 0 "[ . 1 . 2]" 1
530 2 42 LEU QD 2 62 VAL QG 2.330 . 2.860 2.683 1.796 4.097 1.237 12 5 "[* . * 1 +- . * 2]" 1
531 2 42 LEU QD 2 64 VAL QG 3.190 . 4.580 2.977 1.688 4.413 0.112 13 0 "[ . 1 . 2]" 1
532 2 42 LEU QD 2 114 ILE MD 2.790 . 3.780 3.429 2.001 5.500 1.720 1 5 "[+ - . * 1 * . * 2]" 1
533 2 42 LEU QD 2 126 LEU QD 2.910 . 4.020 2.154 1.529 3.814 0.271 14 0 "[ . 1 . 2]" 1
534 2 42 LEU QD 2 128 LEU H 3.130 . 4.460 3.924 1.906 5.850 1.390 18 4 "[ * . - * . + 2]" 1
535 2 42 LEU QD 2 128 LEU QD 2.800 . 3.800 2.079 1.625 2.824 0.175 2 0 "[ . 1 . 2]" 1
536 2 42 LEU QD 2 129 ALA H 3.520 . 5.240 4.420 3.061 5.203 . 0 0 "[ . 1 . 2]" 1
537 2 43 ASP H 2 44 LEU H 3.250 . 4.700 4.336 3.945 4.449 . 0 0 "[ . 1 . 2]" 1
538 2 43 ASP H 2 62 VAL QG 3.070 . 4.340 3.093 2.705 3.450 . 0 0 "[ . 1 . 2]" 1
539 2 43 ASP H 2 63 THR H 2.600 . 3.400 3.244 2.736 3.624 0.224 4 0 "[ . 1 . 2]" 1
540 2 43 ASP H 2 64 VAL H 3.450 . 5.100 4.998 4.764 5.288 0.188 18 0 "[ . 1 . 2]" 1
541 2 43 ASP H 2 64 VAL QG 3.520 . 5.240 3.677 3.039 4.077 . 0 0 "[ . 1 . 2]" 1
542 2 43 ASP H 2 65 THR H 3.450 . 5.100 4.997 4.542 5.359 0.259 5 0 "[ . 1 . 2]" 1
543 2 44 LEU H 2 45 ASP H 3.290 . 4.780 4.416 3.855 4.580 . 0 0 "[ . 1 . 2]" 1
544 2 44 LEU QD 2 45 ASP H 2.560 . 3.320 2.673 2.220 3.852 0.532 3 1 "[ + . 1 . 2]" 1
545 2 44 LEU QD 2 60 LEU QD 2.920 . 4.040 2.221 1.817 3.120 . 0 0 "[ . 1 . 2]" 1
546 2 44 LEU QD 2 62 VAL QG 3.250 . 4.700 2.829 2.021 3.589 . 0 0 "[ . 1 . 2]" 1
547 2 44 LEU QD 2 128 LEU QD 3.220 . 4.640 3.503 1.811 5.354 0.714 15 1 "[ . 1 + 2]" 1
548 2 44 LEU QD 2 131 VAL QG 3.470 . 5.140 3.956 1.693 5.853 0.713 14 2 "[ - . 1 +. 2]" 1
549 2 44 LEU QD 2 133 PHE QE 3.260 . 4.720 5.401 2.279 7.609 2.889 4 12 "[ -*+* * 1** *.*** *]" 1
550 2 45 ASP H 2 46 THR H 3.220 . 4.640 4.354 4.188 4.487 . 0 0 "[ . 1 . 2]" 1
551 2 45 ASP H 2 60 LEU QD 3.010 . 4.220 3.163 2.782 3.569 . 0 0 "[ . 1 . 2]" 1
552 2 45 ASP H 2 61 ARG H 3.010 . 4.220 3.910 3.631 4.203 . 0 0 "[ . 1 . 2]" 1
553 2 45 ASP H 2 62 VAL QG 3.160 . 4.520 3.644 3.341 4.053 . 0 0 "[ . 1 . 2]" 1
554 2 45 ASP H 2 63 THR H 3.500 . 5.200 4.515 3.910 4.941 . 0 0 "[ . 1 . 2]" 1
555 2 46 THR H 2 47 ALA H 3.150 . 4.500 4.271 3.963 4.499 . 0 0 "[ . 1 . 2]" 1
556 2 46 THR H 2 61 ARG H 3.500 . 5.200 4.883 4.576 5.402 0.202 1 0 "[ . 1 . 2]" 1
557 2 47 ALA H 2 48 SER H 2.990 . 4.180 4.405 4.240 4.498 0.318 3 0 "[ . 1 . 2]" 1
558 2 47 ALA H 2 58 VAL QG 3.310 . 4.820 3.927 3.400 4.864 0.044 15 0 "[ . 1 . 2]" 1
559 2 47 ALA H 2 59 VAL H 3.040 . 4.280 3.859 3.338 4.262 . 0 0 "[ . 1 . 2]" 1
560 2 47 ALA H 2 61 ARG H 3.010 . 4.220 3.850 3.384 4.552 0.332 14 0 "[ . 1 . 2]" 1
561 2 47 ALA MB 2 48 SER H 2.960 . 4.120 2.714 2.491 3.233 . 0 0 "[ . 1 . 2]" 1
562 2 48 SER H 2 49 SER H 3.250 . 4.700 4.413 4.387 4.446 . 0 0 "[ . 1 . 2]" 1
563 2 48 SER H 2 59 VAL H 3.180 . 4.560 4.460 4.144 4.758 0.198 10 0 "[ . 1 . 2]" 1
564 2 49 SER H 2 50 GLN H 3.200 . 4.600 4.297 4.192 4.383 . 0 0 "[ . 1 . 2]" 1
565 2 49 SER H 2 57 GLU H 2.500 . 3.200 3.183 2.837 3.746 0.546 3 1 "[ + . 1 . 2]" 1
566 2 49 SER H 2 58 VAL H 3.320 . 4.840 4.903 4.563 5.272 0.432 4 0 "[ . 1 . 2]" 1
567 2 49 SER H 2 59 VAL H 3.030 . 4.260 4.493 4.112 5.083 0.823 5 5 "[ *+ - * *. 2]" 1
568 2 49 SER H 2 59 VAL MG2 3.410 . 5.020 4.274 3.821 4.833 . 0 0 "[ . 1 . 2]" 1
569 2 50 GLN H 2 51 LEU H 3.190 . 4.580 4.402 4.249 4.553 . 0 0 "[ . 1 . 2]" 1
570 2 50 GLN H 2 57 GLU H 3.340 . 4.880 4.748 4.366 5.095 0.215 1 0 "[ . 1 . 2]" 1
571 2 51 LEU H 2 52 ALA H 2.070 . 2.340 2.257 2.126 2.467 0.127 9 0 "[ . 1 . 2]" 1
572 2 51 LEU H 2 55 VAL H 3.370 . 4.940 4.910 4.710 5.181 0.241 3 0 "[ . 1 . 2]" 1
573 2 51 LEU H 2 55 VAL MG1 3.290 . 4.780 3.550 3.201 3.801 . 0 0 "[ . 1 . 2]" 1
574 2 51 LEU H 2 56 TYR H 3.430 . 5.060 4.753 4.369 5.230 0.170 3 0 "[ . 1 . 2]" 1
575 2 51 LEU H 2 56 TYR QD 3.510 . 5.220 4.976 3.732 5.782 0.562 18 1 "[ . 1 . + 2]" 1
576 2 51 LEU H 2 57 GLU H 2.920 . 4.040 3.899 3.339 4.291 0.251 14 0 "[ . 1 . 2]" 1
577 2 51 LEU MD1 2 55 VAL MG1 2.910 . 4.020 2.396 2.164 2.643 . 0 0 "[ . 1 . 2]" 1
578 2 51 LEU MD1 2 83 ILE MD 3.030 . 4.260 2.438 2.281 2.745 . 0 0 "[ . 1 . 2]" 1
579 2 52 ALA H 2 53 ASP H 3.170 . 4.540 4.319 4.275 4.368 . 0 0 "[ . 1 . 2]" 1
580 2 52 ALA H 2 55 VAL H 2.760 . 3.720 3.564 3.445 3.867 0.147 3 0 "[ . 1 . 2]" 1
581 2 52 ALA H 2 55 VAL MG1 2.990 . 4.180 3.336 3.130 3.620 . 0 0 "[ . 1 . 2]" 1
582 2 52 ALA H 2 55 VAL MG2 3.440 . 5.080 4.199 3.864 4.578 . 0 0 "[ . 1 . 2]" 1
583 2 52 ALA MB 2 53 ASP H 2.310 . 2.820 1.884 1.745 2.202 0.055 10 0 "[ . 1 . 2]" 1
584 2 52 ALA MB 2 55 VAL MG1 3.500 . 5.200 3.034 2.855 3.180 . 0 0 "[ . 1 . 2]" 1
585 2 52 ALA MB 2 55 VAL MG2 3.260 . 4.720 2.610 2.301 2.857 . 0 0 "[ . 1 . 2]" 1
586 2 53 ASP H 2 54 ASP H 3.280 . 4.760 4.450 4.304 4.562 . 0 0 "[ . 1 . 2]" 1
587 2 53 ASP H 2 55 VAL H 3.290 . 4.780 4.123 4.005 4.261 . 0 0 "[ . 1 . 2]" 1
588 2 54 ASP H 2 55 VAL H 2.350 . 2.900 2.760 2.626 2.941 0.041 17 0 "[ . 1 . 2]" 1
589 2 55 VAL H 2 56 TYR H 2.800 . 3.800 4.029 3.826 4.287 0.487 5 0 "[ . 1 . 2]" 1
590 2 55 VAL MG1 2 56 TYR H 3.190 . 4.580 3.356 2.976 3.646 . 0 0 "[ . 1 . 2]" 1
591 2 56 TYR H 2 57 GLU H 3.300 . 4.800 4.450 4.348 4.528 . 0 0 "[ . 1 . 2]" 1
592 2 56 TYR H 2 84 PHE H 3.180 . 4.560 3.750 3.395 4.024 . 0 0 "[ . 1 . 2]" 1
593 2 56 TYR H 2 86 ILE H 2.970 . 4.140 3.807 2.944 4.807 0.667 5 1 "[ + 1 . 2]" 1
594 2 56 TYR H 2 86 ILE MD 2.760 . 3.720 5.094 2.702 8.054 4.334 18 16 "[-******* * * ****+ *]" 1
595 2 56 TYR QD 2 57 GLU H 3.010 . 4.220 3.514 2.953 4.114 . 0 0 "[ . 1 . 2]" 1
596 2 56 TYR QD 2 86 ILE MD 2.980 . 4.160 3.594 2.338 6.183 2.023 18 5 "[ *-*. * 1 . + 2]" 1
597 2 56 TYR QD 2 94 MET ME 3.280 . 4.760 4.621 3.010 7.146 2.386 5 6 "[-** + * . * 2]" 1
598 2 56 TYR QD 2 98 LEU QD 3.430 . 5.060 3.859 2.784 5.521 0.461 17 0 "[ . 1 . 2]" 1
599 2 56 TYR QE 2 94 MET ME 3.140 . 4.480 4.092 1.520 6.899 2.419 5 6 "[-** + * . * 2]" 1
600 2 57 GLU H 2 58 VAL H 3.010 . 4.220 4.008 3.706 4.305 0.085 2 0 "[ . 1 . 2]" 1
601 2 57 GLU H 2 84 PHE H 3.460 . 5.120 4.792 4.515 5.143 0.023 15 0 "[ . 1 . 2]" 1
602 2 58 VAL H 2 59 VAL H 3.250 . 4.700 4.424 4.317 4.534 . 0 0 "[ . 1 . 2]" 1
603 2 58 VAL H 2 82 GLY H 3.000 . 4.200 3.331 2.943 3.568 . 0 0 "[ . 1 . 2]" 1
604 2 58 VAL H 2 84 PHE H 2.860 . 3.920 4.107 3.558 4.547 0.627 10 3 "[ *. - + . 2]" 1
605 2 58 VAL H 2 84 PHE QD 2.990 . 4.180 2.907 2.461 3.119 . 0 0 "[ . 1 . 2]" 1
606 2 58 VAL H 2 84 PHE QE 3.280 . 4.760 3.409 3.041 3.774 . 0 0 "[ . 1 . 2]" 1
607 2 58 VAL QG 2 59 VAL H 2.740 . 3.680 2.783 2.594 3.281 . 0 0 "[ . 1 . 2]" 1
608 2 58 VAL QG 2 84 PHE QD 3.480 . 5.160 2.391 2.012 2.873 . 0 0 "[ . 1 . 2]" 1
609 2 58 VAL QG 2 98 LEU QD . . 3.120 2.998 1.954 4.239 1.119 10 5 "[** . + . *- 2]" 1
610 2 59 VAL H 2 60 LEU H 3.240 . 4.680 4.314 4.228 4.468 . 0 0 "[ . 1 . 2]" 1
611 2 59 VAL H 2 82 GLY H 3.460 . 5.120 4.934 4.794 5.173 0.053 17 0 "[ . 1 . 2]" 1
612 2 59 VAL MG1 2 60 LEU H 2.640 . 3.480 2.911 2.305 3.142 . 0 0 "[ . 1 . 2]" 1
613 2 59 VAL MG1 2 80 GLN H 3.280 . 4.760 3.812 3.426 4.053 . 0 0 "[ . 1 . 2]" 1
614 2 59 VAL MG1 2 81 GLY H 3.250 . 4.700 3.704 3.382 4.071 . 0 0 "[ . 1 . 2]" 1
615 2 59 VAL MG2 2 60 LEU H 3.500 . 5.200 4.234 4.000 4.301 . 0 0 "[ . 1 . 2]" 1
616 2 59 VAL MG2 2 82 GLY H 3.280 . 4.760 3.824 3.646 4.163 . 0 0 "[ . 1 . 2]" 1
617 2 60 LEU H 2 61 ARG H 3.200 . 4.600 4.308 4.099 4.477 . 0 0 "[ . 1 . 2]" 1
618 2 60 LEU H 2 80 GLN H 2.760 . 3.720 3.652 3.301 4.085 0.365 12 0 "[ . 1 . 2]" 1
619 2 60 LEU H 2 81 GLY H 3.240 . 4.680 4.565 4.420 4.775 0.095 12 0 "[ . 1 . 2]" 1
620 2 60 LEU H 2 82 GLY H 3.290 . 4.780 4.903 4.545 5.320 0.540 5 1 "[ + 1 . 2]" 1
621 2 60 LEU QD 2 61 ARG H 2.540 . 3.280 2.476 2.074 2.742 . 0 0 "[ . 1 . 2]" 1
622 2 60 LEU QD 2 62 VAL H 3.400 . 5.000 3.313 3.103 3.534 . 0 0 "[ . 1 . 2]" 1
623 2 60 LEU QD 2 62 VAL QG . . 2.700 1.874 1.735 2.007 0.065 4 0 "[ . 1 . 2]" 1
624 2 60 LEU QD 2 80 GLN H 3.490 . 5.180 3.853 3.275 4.056 . 0 0 "[ . 1 . 2]" 1
625 2 60 LEU QD 2 110 ALA H 3.180 . 4.560 3.770 3.518 4.077 . 0 0 "[ . 1 . 2]" 1
626 2 60 LEU QD 2 110 ALA MB 2.920 . 4.040 2.246 2.047 2.599 . 0 0 "[ . 1 . 2]" 1
627 2 61 ARG H 2 62 VAL H 3.260 . 4.720 4.286 4.076 4.454 . 0 0 "[ . 1 . 2]" 1
628 2 61 ARG H 2 62 VAL QG 3.390 . 4.980 4.322 3.995 4.585 . 0 0 "[ . 1 . 2]" 1
629 2 62 VAL H 2 63 THR H 3.000 . 4.200 4.282 4.109 4.417 0.217 17 0 "[ . 1 . 2]" 1
630 2 62 VAL H 2 78 VAL H 2.480 . 3.160 3.149 2.888 3.394 0.234 8 0 "[ . 1 . 2]" 1
631 2 62 VAL H 2 80 GLN H 3.530 . 5.250 4.427 4.086 4.771 . 0 0 "[ . 1 . 2]" 1
632 2 62 VAL QG 2 63 THR H 2.880 . 3.960 2.853 2.664 3.171 . 0 0 "[ . 1 . 2]" 1
633 2 62 VAL QG 2 64 VAL QG 3.330 . 4.860 2.794 2.306 3.321 . 0 0 "[ . 1 . 2]" 1
634 2 62 VAL QG 2 110 ALA MB 3.130 . 4.460 2.126 1.956 2.221 . 0 0 "[ . 1 . 2]" 1
635 2 62 VAL QG 2 114 ILE MD 2.520 . 3.240 2.007 1.918 2.101 . 0 0 "[ . 1 . 2]" 1
636 2 62 VAL QG 2 128 LEU QD 2.980 . 4.160 2.699 1.726 4.927 0.767 15 2 "[ - . 1 + 2]" 1
637 2 63 THR H 2 64 VAL H 3.290 . 4.780 4.473 4.301 4.553 . 0 0 "[ . 1 . 2]" 1
638 2 64 VAL H 2 65 THR H 3.200 . 4.600 4.233 3.941 4.435 . 0 0 "[ . 1 . 2]" 1
639 2 64 VAL H 2 76 CYS H 2.460 . 3.120 3.290 3.023 3.668 0.548 17 1 "[ . 1 . + 2]" 1
640 2 64 VAL H 2 77 GLU H 3.500 . 5.200 4.782 4.407 5.060 . 0 0 "[ . 1 . 2]" 1
641 2 64 VAL QG 2 65 THR H 2.560 . 3.320 2.752 2.535 3.113 . 0 0 "[ . 1 . 2]" 1
642 2 64 VAL QG 2 74 PHE QE 3.090 . 4.380 2.259 1.886 2.989 . 0 0 "[ . 1 . 2]" 1
643 2 64 VAL QG 2 76 CYS H 3.030 . 4.260 3.374 2.586 4.049 . 0 0 "[ . 1 . 2]" 1
644 2 64 VAL QG 2 114 ILE MD 2.600 . 3.400 1.934 1.742 2.070 0.058 4 0 "[ . 1 . 2]" 1
645 2 64 VAL QG 2 118 VAL QG 3.470 . 5.140 2.755 2.466 2.991 . 0 0 "[ . 1 . 2]" 1
646 2 64 VAL QG 2 126 LEU QD 2.560 . 3.100 3.056 1.752 5.692 2.592 19 7 "[ -.** 1 * . * +*]" 1
647 2 65 THR H 2 66 ALA H 3.210 . 4.620 4.423 4.349 4.543 . 0 0 "[ . 1 . 2]" 1
648 2 65 THR H 2 76 CYS H 3.530 . 5.250 5.079 4.833 5.673 0.423 17 0 "[ . 1 . 2]" 1
649 2 65 THR H 2 126 LEU QD 3.330 . 4.860 5.792 4.226 8.219 3.359 19 11 "[* **** * *-. * +*]" 1
650 2 66 ALA H 2 67 SER H 3.190 . 4.580 4.352 4.215 4.441 . 0 0 "[ . 1 . 2]" 1
651 2 66 ALA H 2 73 ALA H 3.030 . 4.260 4.221 3.813 4.416 0.156 17 0 "[ . 1 . 2]" 1
652 2 66 ALA H 2 74 PHE H 2.630 . 3.460 3.575 3.188 4.098 0.638 17 1 "[ . 1 . + 2]" 1
653 2 66 ALA H 2 75 LEU MD2 2.660 . 3.520 2.517 2.190 2.943 . 0 0 "[ . 1 . 2]" 1
654 2 66 ALA MB 2 67 SER H 2.710 . 3.620 2.732 2.416 3.056 . 0 0 "[ . 1 . 2]" 1
655 2 66 ALA MB 2 73 ALA H 3.300 . 4.800 3.669 3.196 4.187 . 0 0 "[ . 1 . 2]" 1
656 2 66 ALA MB 2 73 ALA MB 2.850 . 3.900 2.328 2.057 2.618 . 0 0 "[ . 1 . 2]" 1
657 2 66 ALA MB 2 74 PHE H 2.690 . 3.580 2.412 1.959 3.781 0.201 18 0 "[ . 1 . 2]" 1
658 2 66 ALA MB 2 74 PHE QD 2.870 . 3.940 2.861 2.134 2.981 . 0 0 "[ . 1 . 2]" 1
659 2 66 ALA MB 2 74 PHE QE 2.670 . 3.540 2.670 1.599 2.831 0.201 18 0 "[ . 1 . 2]" 1
660 2 67 SER H 2 68 LEU H 3.160 . 4.520 4.268 4.175 4.350 . 0 0 "[ . 1 . 2]" 1
661 2 67 SER H 2 73 ALA H 3.070 . 4.340 4.015 3.731 4.323 . 0 0 "[ . 1 . 2]" 1
662 2 67 SER H 2 73 ALA MB 2.930 . 4.060 3.221 2.916 3.491 . 0 0 "[ . 1 . 2]" 1
663 2 67 SER H 2 74 PHE H 3.460 . 5.120 4.774 4.548 5.567 0.447 18 0 "[ . 1 . 2]" 1
664 2 68 LEU H 2 69 GLY H 3.020 . 4.240 4.153 3.871 4.270 0.030 20 0 "[ . 1 . 2]" 1
665 2 68 LEU H 2 71 GLU H 2.770 . 3.740 3.845 3.373 4.056 0.316 7 0 "[ . 1 . 2]" 1
666 2 68 LEU H 2 73 ALA H 3.030 . 4.260 3.252 2.902 3.925 . 0 0 "[ . 1 . 2]" 1
667 2 68 LEU H 2 73 ALA MB 3.010 . 4.220 2.614 2.232 3.214 . 0 0 "[ . 1 . 2]" 1
668 2 68 LEU QD 2 69 GLY H 3.150 . 4.500 3.792 3.429 4.053 . 0 0 "[ . 1 . 2]" 1
669 2 69 GLY H 2 70 GLU H 3.190 . 4.580 4.427 4.223 4.585 0.005 8 0 "[ . 1 . 2]" 1
670 2 69 GLY H 2 71 GLU H 3.250 . 4.700 4.567 4.221 4.829 0.129 3 0 "[ . 1 . 2]" 1
671 2 70 GLU H 2 71 GLU H 2.350 . 2.900 2.414 2.103 3.244 0.344 14 0 "[ . 1 . 2]" 1
672 2 71 GLU H 2 72 THR H 3.170 . 4.540 4.456 4.237 4.542 0.002 2 0 "[ . 1 . 2]" 1
673 2 72 THR H 2 73 ALA H 3.330 . 4.860 4.557 4.397 4.630 . 0 0 "[ . 1 . 2]" 1
674 2 73 ALA H 2 74 PHE H 2.150 . 2.500 2.418 2.248 2.768 0.268 2 0 "[ . 1 . 2]" 1
675 2 73 ALA MB 2 74 PHE H 2.490 . 3.180 2.079 1.918 2.246 . 0 0 "[ . 1 . 2]" 1
676 2 73 ALA MB 2 74 PHE QD 3.440 . 5.080 2.660 1.947 3.347 . 0 0 "[ . 1 . 2]" 1
677 2 73 ALA MB 2 123 PHE QE 3.360 . 4.920 3.637 2.500 4.952 0.032 6 0 "[ . 1 . 2]" 1
678 2 74 PHE H 2 75 LEU H 3.180 . 4.560 4.303 4.243 4.354 . 0 0 "[ . 1 . 2]" 1
679 2 74 PHE QD 2 75 LEU H 2.910 . 4.020 3.233 2.795 3.876 . 0 0 "[ . 1 . 2]" 1
680 2 74 PHE QD 2 123 PHE QD 3.010 . 4.220 3.264 2.451 3.992 . 0 0 "[ . 1 . 2]" 1
681 2 74 PHE QD 2 123 PHE QE 2.820 . 3.840 3.624 3.094 4.089 0.249 18 0 "[ . 1 . 2]" 1
682 2 74 PHE QE 2 118 VAL QG 3.020 . 4.240 2.250 1.676 2.500 0.124 18 0 "[ . 1 . 2]" 1
683 2 74 PHE QE 2 123 PHE QD 3.020 . 4.240 3.634 2.840 4.262 0.022 18 0 "[ . 1 . 2]" 1
684 2 74 PHE QE 2 123 PHE QE 3.500 . 5.200 4.884 3.589 5.539 0.339 4 0 "[ . 1 . 2]" 1
685 2 75 LEU H 2 76 CYS H 3.120 . 4.440 4.152 3.837 4.445 0.005 20 0 "[ . 1 . 2]" 1
686 2 75 LEU MD2 2 76 CYS H 3.520 . 5.240 3.764 3.423 4.040 . 0 0 "[ . 1 . 2]" 1
687 2 76 CYS H 2 77 GLU H 3.260 . 4.720 4.436 4.271 4.539 . 0 0 "[ . 1 . 2]" 1
688 2 77 GLU H 2 78 VAL H 3.060 . 4.320 4.078 3.980 4.266 . 0 0 "[ . 1 . 2]" 1
689 2 77 GLU H 2 78 VAL MG2 3.280 . 4.760 3.569 3.466 4.053 . 0 0 "[ . 1 . 2]" 1
690 2 78 VAL H 2 79 GLN H 3.220 . 4.640 4.377 4.323 4.420 . 0 0 "[ . 1 . 2]" 1
691 2 78 VAL H 2 114 ILE MD 3.170 . 4.540 3.358 2.961 3.553 . 0 0 "[ . 1 . 2]" 1
692 2 78 VAL MG1 2 79 GLN H 2.500 . 3.200 2.366 2.279 2.450 . 0 0 "[ . 1 . 2]" 1
693 2 78 VAL MG1 2 80 GLN H 2.920 . 4.040 2.763 2.520 3.018 . 0 0 "[ . 1 . 2]" 1
694 2 78 VAL MG1 2 110 ALA MB 3.130 . 4.460 2.867 2.747 3.042 . 0 0 "[ . 1 . 2]" 1
695 2 78 VAL MG1 2 114 ILE H 3.410 . 5.020 4.098 3.802 4.401 . 0 0 "[ . 1 . 2]" 1
696 2 78 VAL MG2 2 79 GLN H 3.360 . 4.920 3.882 3.711 3.986 . 0 0 "[ . 1 . 2]" 1
697 2 78 VAL MG2 2 114 ILE H 2.860 . 3.920 2.723 2.485 3.002 . 0 0 "[ . 1 . 2]" 1
698 2 78 VAL MG2 2 114 ILE MD 3.260 . 4.720 3.220 3.012 3.407 . 0 0 "[ . 1 . 2]" 1
699 2 79 GLN H 2 80 GLN H 2.880 . 3.960 3.749 3.637 3.898 . 0 0 "[ . 1 . 2]" 1
700 2 80 GLN H 2 81 GLY H 3.140 . 4.480 4.233 4.165 4.298 . 0 0 "[ . 1 . 2]" 1
701 2 80 GLN H 2 110 ALA MB 3.080 . 4.360 3.396 3.145 3.753 . 0 0 "[ . 1 . 2]" 1
702 2 81 GLY H 2 82 GLY H 3.310 . 4.820 4.555 4.506 4.626 . 0 0 "[ . 1 . 2]" 1
703 2 82 GLY H 2 83 ILE H 3.150 . 4.500 4.104 4.032 4.247 . 0 0 "[ . 1 . 2]" 1
704 2 82 GLY H 2 84 PHE QE 3.410 . 5.020 4.087 3.819 4.372 . 0 0 "[ . 1 . 2]" 1
705 2 83 ILE H 2 84 PHE H 3.270 . 4.740 4.441 4.342 4.521 . 0 0 "[ . 1 . 2]" 1
706 2 83 ILE H 2 84 PHE QE 3.420 . 5.040 5.022 4.808 5.176 0.136 20 0 "[ . 1 . 2]" 1
707 2 84 PHE H 2 85 SER H 3.160 . 4.520 4.339 4.220 4.450 . 0 0 "[ . 1 . 2]" 1
708 2 84 PHE QD 2 85 SER H 3.400 . 5.000 4.197 3.956 4.668 . 0 0 "[ . 1 . 2]" 1
709 2 85 SER H 2 86 ILE H 3.250 . 4.700 4.243 3.981 4.369 . 0 0 "[ . 1 . 2]" 1
710 2 86 ILE H 2 87 ALA H 3.190 . 4.580 4.354 4.030 4.469 . 0 0 "[ . 1 . 2]" 1
711 2 86 ILE MD 2 94 MET ME 3.230 . 4.660 3.010 1.946 5.852 1.192 2 1 "[ + . 1 . 2]" 1
712 2 86 ILE MD 2 98 LEU QD 3.050 . 4.300 3.712 1.920 5.241 0.941 4 5 "[ * +* 1 - *2]" 1
713 2 87 ALA H 2 88 GLY H 3.200 . 4.600 4.372 4.346 4.409 . 0 0 "[ . 1 . 2]" 1
714 2 87 ALA H 2 89 ILE H 3.000 . 4.200 4.184 3.698 4.713 0.513 8 1 "[ . + 1 . 2]" 1
715 2 87 ALA MB 2 88 GLY H 2.530 . 3.260 2.326 2.199 2.559 . 0 0 "[ . 1 . 2]" 1
716 2 88 GLY H 2 89 ILE H 2.910 . 4.020 3.245 2.788 3.751 . 0 0 "[ . 1 . 2]" 1
717 2 89 ILE H 2 90 GLU H 3.340 . 4.880 4.647 4.573 4.701 . 0 0 "[ . 1 . 2]" 1
718 2 89 ILE MD 2 90 GLU H 2.970 . 4.140 4.291 3.503 4.849 0.709 15 1 "[ . 1 + 2]" 1
719 2 89 ILE MD 2 94 MET H 3.160 . 4.520 4.841 3.334 5.871 1.351 5 10 "[ ** + ** ** **- 2]" 1
720 2 90 GLU H 2 91 GLY H 3.180 . 4.560 4.324 4.236 4.411 . 0 0 "[ . 1 . 2]" 1
721 2 90 GLU H 2 94 MET H 3.210 . 4.620 3.528 2.961 4.597 . 0 0 "[ . 1 . 2]" 1
722 2 91 GLY H 2 92 THR H 3.270 . 4.740 4.452 4.226 4.590 . 0 0 "[ . 1 . 2]" 1
723 2 91 GLY H 2 94 MET H 3.240 . 4.680 4.110 3.636 4.765 0.085 8 0 "[ . 1 . 2]" 1
724 2 92 THR H 2 93 GLN H 2.110 . 2.420 2.564 2.346 2.726 0.306 3 0 "[ . 1 . 2]" 1
725 2 92 THR H 2 94 MET H 3.000 . 4.200 4.218 4.004 4.451 0.251 4 0 "[ . 1 . 2]" 1
726 2 93 GLN H 2 94 MET H 2.360 . 2.920 2.618 2.477 2.796 . 0 0 "[ . 1 . 2]" 1
727 2 93 GLN H 2 95 ALA H 3.460 . 5.120 4.133 3.803 4.544 . 0 0 "[ . 1 . 2]" 1
728 2 93 GLN H 2 96 HIS H 3.440 . 5.080 4.771 4.541 5.120 0.040 8 0 "[ . 1 . 2]" 1
729 2 94 MET H 2 95 ALA H 2.450 . 3.100 2.573 2.388 2.719 . 0 0 "[ . 1 . 2]" 1
730 2 94 MET H 2 96 HIS H 2.950 . 4.100 3.943 3.716 4.194 0.094 2 0 "[ . 1 . 2]" 1
731 2 94 MET H 2 97 CYS H 3.390 . 4.980 4.754 4.473 5.380 0.400 10 0 "[ . 1 . 2]" 1
732 2 94 MET ME 2 98 LEU QD 2.900 . 4.000 2.510 1.609 4.900 0.900 5 1 "[ + 1 . 2]" 1
733 2 95 ALA H 2 96 HIS H 2.340 . 2.880 2.638 2.541 2.763 . 0 0 "[ . 1 . 2]" 1
734 2 95 ALA H 2 97 CYS H 3.310 . 4.820 4.081 3.866 4.419 . 0 0 "[ . 1 . 2]" 1
735 2 95 ALA H 2 98 LEU H 3.360 . 4.920 5.225 4.781 5.512 0.592 18 4 "[ * - * 1 . + 2]" 1
736 2 95 ALA MB 2 96 HIS H 2.700 . 3.600 2.797 2.476 3.041 . 0 0 "[ . 1 . 2]" 1
737 2 96 HIS H 2 97 CYS H 2.360 . 2.920 2.501 2.221 2.647 . 0 0 "[ . 1 . 2]" 1
738 2 96 HIS H 2 98 LEU H 2.930 . 4.060 4.657 4.083 5.077 1.017 2 11 "[ + **** 1 -* ** **2]" 1
739 2 96 HIS H 2 99 GLY H 3.290 . 4.780 4.704 4.371 5.154 0.374 19 0 "[ . 1 . 2]" 1
740 2 97 CYS H 2 98 LEU H 2.250 . 2.700 2.830 2.622 3.018 0.318 2 0 "[ . 1 . 2]" 1
741 2 97 CYS H 2 99 GLY H 2.950 . 4.100 3.738 3.456 3.981 . 0 0 "[ . 1 . 2]" 1
742 2 97 CYS H 2 100 ALA H 3.410 . 5.020 4.809 4.499 5.071 0.051 4 0 "[ . 1 . 2]" 1
743 2 97 CYS H 2 101 TYR H 3.500 . 5.200 4.847 4.646 5.106 . 0 0 "[ . 1 . 2]" 1
744 2 98 LEU H 2 99 GLY H 2.190 . 2.580 2.527 2.268 2.775 0.195 9 0 "[ . 1 . 2]" 1
745 2 98 LEU H 2 100 ALA H 2.940 . 4.080 4.254 3.954 4.451 0.371 3 0 "[ . 1 . 2]" 1
746 2 98 LEU H 2 101 TYR H 3.370 . 4.940 4.932 4.706 5.099 0.159 18 0 "[ . 1 . 2]" 1
747 2 98 LEU H 2 102 CYS H 3.440 . 5.080 4.919 4.680 5.262 0.182 5 0 "[ . 1 . 2]" 1
748 2 99 GLY H 2 100 ALA H 2.050 . 2.310 2.455 2.295 2.692 0.382 4 0 "[ . 1 . 2]" 1
749 2 99 GLY H 2 100 ALA MB 3.350 . 4.900 4.179 3.944 4.555 . 0 0 "[ . 1 . 2]" 1
750 2 99 GLY H 2 101 TYR H 3.020 . 4.240 4.063 3.799 4.468 0.228 4 0 "[ . 1 . 2]" 1
751 2 99 GLY H 2 102 CYS H 3.230 . 4.660 4.799 4.526 5.219 0.559 4 1 "[ +. 1 . 2]" 1
752 2 100 ALA H 2 101 TYR H 2.080 . 2.360 2.146 1.974 2.465 0.105 16 0 "[ . 1 . 2]" 1
753 2 100 ALA H 2 102 CYS H 2.540 . 3.280 3.504 3.193 4.178 0.898 17 3 "[ - * 1 . + 2]" 1
754 2 100 ALA MB 2 101 TYR H 2.470 . 3.150 2.476 2.077 2.707 . 0 0 "[ . 1 . 2]" 1
755 2 100 ALA MB 2 133 PHE QD 2.820 . 3.840 2.854 1.841 4.063 0.223 20 0 "[ . 1 . 2]" 1
756 2 101 TYR H 2 102 CYS H 2.280 . 2.760 2.694 2.541 2.857 0.097 17 0 "[ . 1 . 2]" 1
757 2 101 TYR QD 2 102 CYS H 3.110 . 4.420 3.532 2.824 4.032 . 0 0 "[ . 1 . 2]" 1
758 2 101 TYR QE 2 105 ILE MD 3.190 . 4.580 2.524 2.111 2.741 . 0 0 "[ . 1 . 2]" 1
759 2 109 TYR H 2 110 ALA H 2.230 . 2.660 2.690 2.619 2.785 0.125 16 0 "[ . 1 . 2]" 1
760 2 109 TYR H 2 111 ARG H 2.950 . 4.100 4.077 3.875 4.281 0.181 3 0 "[ . 1 . 2]" 1
761 2 109 TYR QD 2 110 ALA H 3.400 . 5.000 3.977 3.880 4.155 . 0 0 "[ . 1 . 2]" 1
762 2 110 ALA H 2 111 ARG H 2.130 . 2.460 2.641 2.545 2.732 0.272 10 0 "[ . 1 . 2]" 1
763 2 110 ALA H 2 112 GLU H 3.290 . 4.780 4.346 4.051 4.516 . 0 0 "[ . 1 . 2]" 1
764 2 110 ALA H 2 113 CYS H 3.490 . 5.180 4.751 4.613 4.914 . 0 0 "[ . 1 . 2]" 1
765 2 110 ALA MB 2 111 ARG H 2.710 . 3.620 2.532 2.378 2.688 . 0 0 "[ . 1 . 2]" 1
766 2 111 ARG H 2 112 GLU H 2.490 . 3.180 2.822 2.600 2.994 . 0 0 "[ . 1 . 2]" 1
767 2 111 ARG H 2 113 CYS H 3.030 . 4.260 4.037 3.765 4.260 . 0 0 "[ . 1 . 2]" 1
768 2 112 GLU H 2 113 CYS H 2.350 . 2.900 2.596 2.517 2.788 . 0 0 "[ . 1 . 2]" 1
769 2 112 GLU H 2 114 ILE H 3.490 . 5.180 4.351 4.080 4.914 . 0 0 "[ . 1 . 2]" 1
770 2 113 CYS H 2 114 ILE H 2.490 . 3.180 2.683 2.496 2.923 . 0 0 "[ . 1 . 2]" 1
771 2 113 CYS H 2 115 THR H 3.160 . 4.520 4.177 3.889 4.451 . 0 0 "[ . 1 . 2]" 1
772 2 113 CYS H 2 116 SER H 3.400 . 5.000 4.679 4.501 4.838 . 0 0 "[ . 1 . 2]" 1
773 2 114 ILE H 2 115 THR H 2.410 . 3.020 2.694 2.561 2.800 . 0 0 "[ . 1 . 2]" 1
774 2 114 ILE H 2 116 SER H 3.060 . 4.320 4.001 3.793 4.139 . 0 0 "[ . 1 . 2]" 1
775 2 114 ILE H 2 117 MET H 3.430 . 5.060 4.781 4.582 4.923 . 0 0 "[ . 1 . 2]" 1
776 2 114 ILE MD 2 126 LEU QD 3.140 . 4.480 4.255 2.011 6.992 2.512 19 8 "[* *.*- 1 * . * +*]" 1
777 2 115 THR H 2 116 SER H 2.380 . 2.960 2.730 2.594 2.833 . 0 0 "[ . 1 . 2]" 1
778 2 115 THR H 2 117 MET H 3.320 . 4.830 4.367 3.962 4.590 . 0 0 "[ . 1 . 2]" 1
779 2 115 THR H 2 118 VAL H 3.470 . 5.140 4.934 4.757 5.209 0.069 19 0 "[ . 1 . 2]" 1
780 2 116 SER H 2 117 MET H 2.250 . 2.700 2.738 2.473 2.928 0.228 18 0 "[ . 1 . 2]" 1
781 2 116 SER H 2 118 VAL H 2.900 . 4.000 4.207 3.875 4.452 0.452 19 0 "[ . 1 . 2]" 1
782 2 116 SER H 2 119 SER H 3.350 . 4.900 4.778 4.583 5.005 0.105 16 0 "[ . 1 . 2]" 1
783 2 117 MET H 2 118 VAL H 2.360 . 2.920 2.631 2.449 2.734 . 0 0 "[ . 1 . 2]" 1
784 2 117 MET H 2 119 SER H 3.090 . 4.380 4.104 3.754 4.260 . 0 0 "[ . 1 . 2]" 1
785 2 118 VAL H 2 119 SER H 2.230 . 2.660 2.584 2.462 2.740 0.080 1 0 "[ . 1 . 2]" 1
786 2 118 VAL QG 2 119 SER H 3.200 . 4.600 3.233 2.521 3.447 . 0 0 "[ . 1 . 2]" 1
787 2 118 VAL QG 2 123 PHE H 3.040 . 4.280 3.229 2.786 3.668 . 0 0 "[ . 1 . 2]" 1
788 2 118 VAL QG 2 123 PHE QD 3.150 . 4.500 3.320 2.684 3.754 . 0 0 "[ . 1 . 2]" 1
789 2 118 VAL QG 2 126 LEU QD 3.290 . 4.780 4.190 2.152 6.201 1.421 19 4 "[ .* 1 - . +*]" 1
790 2 119 SER H 2 121 GLY H 3.020 . 4.240 4.096 3.828 4.252 0.012 17 0 "[ . 1 . 2]" 1
791 2 119 SER H 2 123 PHE H 3.510 . 5.220 4.864 4.562 5.376 0.156 16 0 "[ . 1 . 2]" 1
792 2 121 GLY H 2 122 THR H 2.350 . 2.900 2.671 2.567 2.815 . 0 0 "[ . 1 . 2]" 1
793 2 121 GLY H 2 123 PHE H 2.740 . 3.680 3.930 3.454 4.234 0.554 13 3 "[ . 1 + . *-]" 1
794 2 122 THR H 2 123 PHE H 2.370 . 2.940 2.717 2.612 2.836 . 0 0 "[ . 1 . 2]" 1
795 2 125 GLN H 2 126 LEU H 3.340 . 4.880 4.602 4.512 4.674 . 0 0 "[ . 1 . 2]" 1
796 2 125 GLN H 3 125 GLN H 2.880 . 3.960 4.467 3.249 6.094 2.134 19 9 "[ *- * 1 **** +*]" 1
797 2 126 LEU H 2 127 ASN H 2.700 . 3.600 3.834 3.348 4.341 0.741 20 5 "[ .* * * . -+]" 1
798 2 127 ASN H 2 128 LEU H 3.260 . 4.720 4.211 3.698 4.560 . 0 0 "[ . 1 . 2]" 1
799 2 128 LEU H 2 129 ALA H 3.220 . 4.640 4.588 4.526 4.648 0.008 2 0 "[ . 1 . 2]" 1
800 2 128 LEU QD 2 129 ALA H 2.480 . 3.160 2.254 1.546 3.856 0.696 1 1 "[+ . 1 . 2]" 1
801 2 128 LEU QD 2 129 ALA MB 3.380 . 4.960 3.145 2.367 4.893 . 0 0 "[ . 1 . 2]" 1
802 2 131 VAL QG 2 133 PHE QD 3.280 . 4.760 4.138 2.567 6.116 1.356 4 2 "[ +. 1 .- 2]" 1
803 2 131 VAL QG 2 133 PHE QE 2.520 . 3.240 4.973 2.695 7.649 4.409 4 13 "[ **+*-* 1** *.*** *]" 1
804 2 131 VAL QG 2 136 LEU QD 3.370 . 4.940 4.005 1.904 6.287 1.347 17 2 "[ .- 1 . + 2]" 1
805 2 133 PHE H 2 134 ASP H 2.120 . 2.440 2.602 2.429 2.838 0.398 14 0 "[ . 1 . 2]" 1
806 2 133 PHE H 2 135 ALA H 3.150 . 4.500 4.434 4.070 5.017 0.517 13 1 "[ . 1 + . 2]" 1
807 2 133 PHE H 2 136 LEU H 3.280 . 4.760 5.231 4.726 5.940 1.180 2 9 "[ +**** * ** . - 2]" 1
808 2 133 PHE QD 2 134 ASP H 3.300 . 4.800 4.064 3.013 4.794 . 0 0 "[ . 1 . 2]" 1
809 2 134 ASP H 2 135 ALA H 2.320 . 2.840 2.696 2.518 2.848 0.008 8 0 "[ . 1 . 2]" 1
810 2 134 ASP H 2 136 LEU H 2.900 . 4.000 4.177 3.585 4.754 0.754 2 2 "[ + . 1- . 2]" 1
811 2 134 ASP H 2 137 PHE H 3.500 . 5.200 4.924 4.538 5.566 0.366 13 0 "[ . 1 . 2]" 1
812 2 135 ALA H 2 136 LEU H 2.380 . 2.960 2.682 2.504 2.876 . 0 0 "[ . 1 . 2]" 1
813 2 135 ALA H 2 137 PHE H 3.200 . 4.600 4.219 3.933 4.883 0.283 13 0 "[ . 1 . 2]" 1
814 2 135 ALA H 2 138 MET H 3.480 . 5.160 4.823 4.568 5.273 0.113 13 0 "[ . 1 . 2]" 1
815 2 135 ALA MB 2 136 LEU H 2.660 . 3.520 2.650 2.371 3.137 . 0 0 "[ . 1 . 2]" 1
816 2 135 ALA MB 4 13 ILE H 3.520 . 5.240 4.523 3.120 6.670 1.430 18 2 "[ . 1 . -+ 2]" 1
817 2 136 LEU H 2 137 PHE H 2.380 . 2.960 2.658 2.487 2.999 0.039 13 0 "[ . 1 . 2]" 1
818 2 136 LEU H 2 138 MET H 3.080 . 4.360 4.061 3.725 4.282 . 0 0 "[ . 1 . 2]" 1
819 2 136 LEU H 2 139 ASN H 3.390 . 4.980 5.008 4.624 5.629 0.649 8 1 "[ . + 1 . 2]" 1
820 2 136 LEU QD 2 137 PHE H 2.770 . 3.740 3.606 2.937 4.147 0.407 7 0 "[ . 1 . 2]" 1
821 2 136 LEU QD 2 137 PHE QD 3.470 . 5.140 4.709 3.210 6.403 1.263 20 6 "[ ** 1 * -*+]" 1
822 2 136 LEU QD 2 140 TYR QD 3.490 . 5.180 3.808 2.121 5.805 0.625 19 1 "[ . 1 . +2]" 1
823 2 137 PHE H 2 138 MET H 2.240 . 2.680 2.637 2.518 2.718 0.038 11 0 "[ . 1 . 2]" 1
824 2 137 PHE H 2 139 ASN H 3.020 . 4.240 4.189 3.851 4.423 0.183 12 0 "[ . 1 . 2]" 1
825 2 137 PHE H 2 140 TYR H 3.350 . 4.900 4.851 4.578 5.180 0.280 8 0 "[ . 1 . 2]" 1
826 2 137 PHE QD 2 138 MET H 3.350 . 4.900 3.956 3.364 4.685 . 0 0 "[ . 1 . 2]" 1
827 2 138 MET H 2 139 ASN H 2.230 . 2.660 2.634 2.541 2.731 0.071 10 0 "[ . 1 . 2]" 1
828 2 138 MET H 2 140 TYR H 3.020 . 4.240 4.048 3.725 4.315 0.075 5 0 "[ . 1 . 2]" 1
829 2 138 MET H 2 141 LEU H 3.330 . 4.860 4.921 4.641 5.259 0.399 14 0 "[ . 1 . 2]" 1
830 2 138 MET ME 4 9 MET ME 3.280 . 4.760 4.538 2.471 7.453 2.693 1 9 "[+** ** 1 *-*. * 2]" 1
831 2 139 ASN H 2 140 TYR H 2.200 . 2.600 2.392 2.164 2.512 . 0 0 "[ . 1 . 2]" 1
832 2 139 ASN H 2 141 LEU H 2.960 . 4.120 4.032 3.468 4.344 0.224 14 0 "[ . 1 . 2]" 1
833 2 140 TYR H 2 141 LEU H 2.220 . 2.640 2.481 2.277 2.653 0.013 1 0 "[ . 1 . 2]" 1
834 2 140 TYR QD 2 141 LEU H 3.410 . 5.020 4.198 3.592 4.717 . 0 0 "[ . 1 . 2]" 1
835 3 9 MET H 3 10 THR H 2.890 . 3.980 3.770 3.589 4.182 0.202 3 0 "[ . 1 . 2]" 1
836 3 9 MET H 3 89 ILE H 2.830 . 3.860 4.820 3.438 6.322 2.462 16 13 "[ ** * *- 1****.+* **]" 1
837 3 10 THR H 3 11 PHE H 2.960 . 4.120 4.038 3.514 4.350 0.230 17 0 "[ . 1 . 2]" 1
838 3 10 THR H 3 87 ALA H 2.470 . 3.140 3.350 2.941 4.126 0.986 2 2 "[ + . 1 - 2]" 1
839 3 10 THR H 3 89 ILE H 2.930 . 4.060 4.095 3.308 5.082 1.022 7 4 "[ . +* 1- .* 2]" 1
840 3 11 PHE H 3 12 GLN H 3.260 . 4.720 4.361 4.185 4.570 . 0 0 "[ . 1 . 2]" 1
841 3 11 PHE QD 3 12 GLN H 2.500 . 3.200 3.571 2.935 3.906 0.706 9 9 "[* .** +* -* . * *]" 1
842 3 11 PHE QE 3 12 GLN H 3.080 . 4.360 4.683 4.085 5.185 0.825 2 6 "[ + . - ** * . * 2]" 1
843 3 11 PHE QE 3 84 PHE QD 3.030 . 4.260 3.196 2.329 3.541 . 0 0 "[ . 1 . 2]" 1
844 3 11 PHE QE 3 84 PHE QE 3.500 . 5.200 3.662 3.096 3.973 . 0 0 "[ . 1 . 2]" 1
845 3 11 PHE QE 3 101 TYR QD 3.470 . 5.140 3.139 2.095 3.715 . 0 0 "[ . 1 . 2]" 1
846 3 12 GLN H 3 13 ILE H 2.940 . 4.080 4.140 3.835 4.296 0.216 6 0 "[ . 1 . 2]" 1
847 3 12 GLN H 3 85 SER H 2.720 . 3.640 3.548 2.487 3.944 0.304 1 0 "[ . 1 . 2]" 1
848 3 13 ILE H 3 14 GLN H 3.290 . 4.780 4.531 4.338 4.604 . 0 0 "[ . 1 . 2]" 1
849 3 13 ILE MD 3 14 GLN H 2.640 . 3.480 2.576 1.848 5.021 1.541 11 4 "[-** . 1+ . 2]" 1
850 3 13 ILE MD 3 15 ARG H 2.640 . 3.480 2.822 2.114 5.542 2.062 11 4 "[*-* . 1+ . 2]" 1
851 3 13 ILE MD 3 16 ILE MD 3.120 . 4.440 2.505 1.661 2.849 0.139 3 0 "[ . 1 . 2]" 1
852 3 13 ILE MD 3 83 ILE H 3.370 . 4.940 4.101 2.903 6.574 1.634 11 4 "[*-* . 1+ . 2]" 1
853 3 13 ILE MD 3 84 PHE QD 3.240 . 4.680 3.163 2.406 4.668 . 0 0 "[ . 1 . 2]" 1
854 3 13 ILE MD 3 84 PHE QE 2.840 . 3.880 2.472 2.012 4.156 0.276 15 0 "[ . 1 . 2]" 1
855 3 14 GLN H 3 15 ARG H 2.030 . 2.260 2.198 2.004 2.460 0.200 8 0 "[ . 1 . 2]" 1
856 3 14 GLN H 3 83 ILE H 3.330 . 4.860 4.565 4.181 4.932 0.072 6 0 "[ . 1 . 2]" 1
857 3 14 GLN H 3 84 PHE QD 3.500 . 5.200 4.028 3.351 4.660 . 0 0 "[ . 1 . 2]" 1
858 3 14 GLN H 3 85 SER H 3.330 . 4.860 4.058 3.364 4.601 . 0 0 "[ . 1 . 2]" 1
859 3 15 ARG H 3 16 ILE H 3.130 . 4.460 4.101 3.975 4.355 . 0 0 "[ . 1 . 2]" 1
860 3 15 ARG H 3 83 ILE H 2.740 . 3.680 3.290 2.961 3.497 . 0 0 "[ . 1 . 2]" 1
861 3 16 ILE H 3 17 TYR H 3.220 . 4.640 4.449 4.337 4.535 . 0 0 "[ . 1 . 2]" 1
862 3 16 ILE MD 3 109 TYR QD 3.020 . 4.240 3.522 3.351 3.759 . 0 0 "[ . 1 . 2]" 1
863 3 16 ILE MD 3 109 TYR QE 2.440 . 3.080 2.484 2.389 2.605 . 0 0 "[ . 1 . 2]" 1
864 3 17 TYR H 3 18 THR H 3.180 . 4.560 4.275 4.186 4.324 . 0 0 "[ . 1 . 2]" 1
865 3 17 TYR H 3 81 GLY H 3.060 . 4.320 3.864 3.544 3.992 . 0 0 "[ . 1 . 2]" 1
866 3 17 TYR QD 3 18 THR H 3.020 . 4.240 3.718 3.386 3.971 . 0 0 "[ . 1 . 2]" 1
867 3 17 TYR QD 4 28 ALA MB 3.390 . 4.980 3.129 2.862 3.350 . 0 0 "[ . 1 . 2]" 1
868 3 17 TYR QE 3 83 ILE H 3.300 . 4.800 3.335 2.936 3.672 . 0 0 "[ . 1 . 2]" 1
869 3 17 TYR QE 3 83 ILE MD 3.150 . 4.500 2.714 2.376 2.897 . 0 0 "[ . 1 . 2]" 1
870 3 17 TYR QE 4 28 ALA MB 3.010 . 4.220 1.759 1.584 2.193 0.216 20 0 "[ . 1 . 2]" 1
871 3 18 THR H 3 19 LYS H 3.260 . 4.720 4.430 4.260 4.556 . 0 0 "[ . 1 . 2]" 1
872 3 18 THR H 3 81 GLY H 3.430 . 5.060 4.783 4.500 5.079 0.019 12 0 "[ . 1 . 2]" 1
873 3 18 THR H 4 121 GLY H 3.180 . 4.560 4.303 4.036 4.561 0.001 20 0 "[ . 1 . 2]" 1
874 3 19 LYS H 3 20 ASP H 2.140 . 2.480 2.404 2.118 2.525 0.045 2 0 "[ . 1 . 2]" 1
875 3 19 LYS H 3 59 VAL MG1 3.240 . 4.680 4.073 3.723 4.593 . 0 0 "[ . 1 . 2]" 1
876 3 19 LYS H 3 79 GLN H 3.170 . 4.540 4.845 4.142 5.196 0.656 6 3 "[ -.+ 1 . *2]" 1
877 3 19 LYS H 3 80 GLN H 3.430 . 5.060 4.981 4.829 5.161 0.101 12 0 "[ . 1 . 2]" 1
878 3 19 LYS H 3 81 GLY H 2.280 . 2.760 2.547 2.176 3.102 0.342 16 0 "[ . 1 . 2]" 1
879 3 20 ASP H 3 21 ILE H 3.180 . 4.560 4.217 3.990 4.304 . 0 0 "[ . 1 . 2]" 1
880 3 20 ASP H 3 79 GLN H 2.590 . 3.380 3.346 3.124 3.612 0.232 13 0 "[ . 1 . 2]" 1
881 3 20 ASP H 3 81 GLY H 3.460 . 5.120 4.724 4.424 5.231 0.111 16 0 "[ . 1 . 2]" 1
882 3 21 ILE H 3 22 SER H 3.130 . 4.460 4.298 4.232 4.431 . 0 0 "[ . 1 . 2]" 1
883 3 21 ILE H 4 23 PHE H 2.530 . 3.260 2.907 2.697 3.252 . 0 0 "[ . 1 . 2]" 1
884 3 21 ILE H 4 23 PHE QD 3.180 . 4.560 3.205 2.676 3.787 . 0 0 "[ . 1 . 2]" 1
885 3 21 ILE H 4 24 GLU H 3.510 . 5.220 5.009 4.902 5.100 . 0 0 "[ . 1 . 2]" 1
886 3 21 ILE MD 3 78 VAL MG1 3.520 . 5.240 3.602 3.404 3.831 . 0 0 "[ . 1 . 2]" 1
887 3 21 ILE MD 4 23 PHE QD 3.090 . 4.380 3.016 2.649 3.284 . 0 0 "[ . 1 . 2]" 1
888 3 22 SER H 3 23 PHE H 3.190 . 4.580 4.251 4.207 4.283 . 0 0 "[ . 1 . 2]" 1
889 3 22 SER H 3 77 GLU H 2.520 . 3.240 3.335 2.879 3.867 0.627 14 1 "[ . 1 +. 2]" 1
890 3 22 SER H 3 78 VAL H 3.440 . 5.080 5.053 4.883 5.187 0.107 16 0 "[ . 1 . 2]" 1
891 3 22 SER H 3 78 VAL MG2 3.340 . 4.880 3.188 2.924 3.844 . 0 0 "[ . 1 . 2]" 1
892 3 22 SER H 3 79 GLN H 3.510 . 5.220 5.159 4.863 5.392 0.172 16 0 "[ . 1 . 2]" 1
893 3 23 PHE H 3 24 GLU H 2.970 . 4.140 3.952 3.771 4.235 0.095 14 0 "[ . 1 . 2]" 1
894 3 23 PHE H 3 77 GLU H 3.530 . 5.250 4.984 4.875 5.286 0.036 14 0 "[ . 1 . 2]" 1
895 3 23 PHE H 4 21 ILE H 2.670 . 3.540 2.745 2.616 2.920 . 0 0 "[ . 1 . 2]" 1
896 3 23 PHE QD 3 24 GLU H 2.890 . 3.980 3.749 3.368 4.040 0.060 16 0 "[ . 1 . 2]" 1
897 3 23 PHE QD 4 21 ILE H 3.200 . 4.600 4.136 3.810 4.324 . 0 0 "[ . 1 . 2]" 1
898 3 23 PHE QD 4 21 ILE MD 3.170 . 4.540 2.972 2.419 3.321 . 0 0 "[ . 1 . 2]" 1
899 3 23 PHE QE 3 25 ALA MB 3.180 . 4.560 2.644 2.346 2.961 . 0 0 "[ . 1 . 2]" 1
900 3 23 PHE QE 3 74 PHE QD 3.520 . 5.240 2.830 2.567 3.119 . 0 0 "[ . 1 . 2]" 1
901 3 23 PHE QE 3 121 GLY H 3.460 . 5.120 3.739 3.438 3.939 . 0 0 "[ . 1 . 2]" 1
902 3 24 GLU H 3 25 ALA H 3.250 . 4.700 4.222 4.087 4.368 . 0 0 "[ . 1 . 2]" 1
903 3 24 GLU H 3 75 LEU H 2.590 . 3.380 3.383 2.941 3.770 0.390 8 0 "[ . 1 . 2]" 1
904 3 24 GLU H 3 75 LEU MD1 3.400 . 5.000 3.982 3.371 4.525 . 0 0 "[ . 1 . 2]" 1
905 3 24 GLU H 4 21 ILE H 3.480 . 5.160 5.017 4.844 5.279 0.119 1 0 "[ . 1 . 2]" 1
906 3 25 ALA MB 3 28 ALA H 3.300 . 4.800 3.224 2.949 3.609 . 0 0 "[ . 1 . 2]" 1
907 3 25 ALA MB 3 28 ALA MB 3.060 . 4.320 2.044 1.824 2.395 . 0 0 "[ . 1 . 2]" 1
908 3 27 ASN H 3 28 ALA H 2.470 . 3.150 2.699 2.221 3.099 . 0 0 "[ . 1 . 2]" 1
909 3 28 ALA H 3 30 HIS H 2.940 . 4.080 4.012 3.632 4.259 0.179 1 0 "[ . 1 . 2]" 1
910 3 28 ALA H 3 31 VAL H 3.490 . 5.180 4.913 4.728 5.051 . 0 0 "[ . 1 . 2]" 1
911 3 28 ALA MB 4 17 TYR QD 3.350 . 4.900 2.913 2.103 3.791 . 0 0 "[ . 1 . 2]" 1
912 3 28 ALA MB 4 17 TYR QE 3.130 . 4.460 2.107 1.507 2.720 0.293 20 0 "[ . 1 . 2]" 1
913 3 30 HIS H 3 31 VAL H 2.320 . 2.840 2.596 2.545 2.719 . 0 0 "[ . 1 . 2]" 1
914 3 30 HIS H 3 32 PHE H 3.130 . 4.460 4.129 3.668 4.558 0.098 1 0 "[ . 1 . 2]" 1
915 3 31 VAL H 3 32 PHE H 2.350 . 2.900 2.558 2.417 2.797 . 0 0 "[ . 1 . 2]" 1
916 3 31 VAL H 3 33 GLN H 3.260 . 4.720 4.712 4.432 5.357 0.637 13 1 "[ . 1 + . 2]" 1
917 3 31 VAL QG 3 32 PHE H 2.450 . 3.100 2.760 2.513 3.488 0.388 17 0 "[ . 1 . 2]" 1
918 3 31 VAL QG 3 34 LYS H 3.460 . 5.120 3.973 3.563 4.535 . 0 0 "[ . 1 . 2]" 1
919 3 31 VAL QG 3 68 LEU MD1 3.390 . 4.980 2.067 1.554 4.482 0.246 17 0 "[ . 1 . 2]" 1
920 3 31 VAL QG 3 123 PHE QE 3.120 . 4.440 2.029 1.543 3.548 0.257 13 0 "[ . 1 . 2]" 1
921 3 32 PHE H 3 33 GLN H 2.380 . 2.960 2.790 2.664 2.970 0.010 13 0 "[ . 1 . 2]" 1
922 3 32 PHE H 3 34 LYS H 3.160 . 4.520 4.434 4.029 4.755 0.235 14 0 "[ . 1 . 2]" 1
923 3 32 PHE QD 3 33 GLN H 3.150 . 4.500 3.814 3.373 4.416 . 0 0 "[ . 1 . 2]" 1
924 3 33 GLN H 3 34 LYS H 2.330 . 2.860 2.827 2.408 3.153 0.293 16 0 "[ . 1 . 2]" 1
925 3 34 LYS H 3 35 ASP H 3.250 . 4.700 4.524 4.473 4.635 . 0 0 "[ . 1 . 2]" 1
926 3 35 ASP H 3 36 TRP H 3.260 . 4.720 4.445 4.291 4.555 . 0 0 "[ . 1 . 2]" 1
927 3 36 TRP H 3 37 GLN H 2.960 . 4.120 3.940 3.598 4.318 0.198 10 0 "[ . 1 . 2]" 1
928 3 37 GLN H 3 68 LEU MD2 2.300 . 2.800 2.030 1.730 2.613 0.070 11 0 "[ . 1 . 2]" 1
929 3 39 GLU H 3 40 VAL H 3.060 . 4.320 4.136 3.840 4.445 0.125 19 0 "[ . 1 . 2]" 1
930 3 39 GLU H 3 67 SER H 2.540 . 3.280 2.538 2.062 3.086 . 0 0 "[ . 1 . 2]" 1
931 3 39 GLU H 3 68 LEU H 3.470 . 5.140 4.803 4.353 5.251 0.111 1 0 "[ . 1 . 2]" 1
932 3 39 GLU H 3 69 GLY H 3.090 . 4.380 4.370 3.733 5.429 1.049 1 3 "[+ . 1 - . * 2]" 1
933 3 40 VAL H 3 41 LYS H 3.240 . 4.680 4.172 3.843 4.521 . 0 0 "[ . 1 . 2]" 1
934 3 40 VAL QG 3 41 LYS H 2.840 . 3.880 3.436 2.295 3.876 . 0 0 "[ . 1 . 2]" 1
935 3 40 VAL QG 3 64 VAL QG 3.530 . 5.250 2.867 1.767 4.051 0.033 19 0 "[ . 1 . 2]" 1
936 3 40 VAL QG 3 126 LEU QD 2.300 . 2.800 1.939 1.553 3.011 0.247 14 0 "[ . 1 . 2]" 1
937 3 40 VAL QG 3 128 LEU QD 2.680 . 3.560 2.212 1.559 3.775 0.241 2 0 "[ . 1 . 2]" 1
938 3 41 LYS H 3 42 LEU H 3.200 . 4.600 4.323 3.968 4.540 . 0 0 "[ . 1 . 2]" 1
939 3 41 LYS H 3 64 VAL QG 3.170 . 4.540 3.509 2.998 4.560 0.020 11 0 "[ . 1 . 2]" 1
940 3 41 LYS H 3 65 THR H 2.880 . 3.960 3.523 3.025 3.985 0.025 8 0 "[ . 1 . 2]" 1
941 3 41 LYS H 3 67 SER H 3.430 . 5.060 4.913 4.354 5.696 0.636 1 1 "[+ . 1 . 2]" 1
942 3 41 LYS H 3 126 LEU QD 3.210 . 4.620 4.664 3.314 6.873 2.253 1 6 "[+ .- 1* **. *2]" 1
943 3 42 LEU H 3 43 ASP H 3.240 . 4.680 4.509 4.361 4.632 . 0 0 "[ . 1 . 2]" 1
944 3 42 LEU H 3 65 THR H 3.300 . 4.800 4.997 4.554 5.398 0.598 7 2 "[ . + 1 - . 2]" 1
945 3 42 LEU MD1 3 43 ASP H 3.220 . 4.640 3.874 2.101 4.839 0.199 19 0 "[ . 1 . 2]" 1
946 3 42 LEU MD2 3 128 LEU QD 2.680 . 3.560 2.309 1.780 4.087 0.527 18 1 "[ . 1 . + 2]" 1
947 3 43 ASP H 3 44 LEU H 3.190 . 4.580 4.304 4.105 4.411 . 0 0 "[ . 1 . 2]" 1
948 3 43 ASP H 3 62 VAL MG1 3.170 . 4.540 3.288 2.478 4.041 . 0 0 "[ . 1 . 2]" 1
949 3 43 ASP H 3 63 THR H 2.730 . 3.660 2.986 2.113 3.527 . 0 0 "[ . 1 . 2]" 1
950 3 43 ASP H 3 64 VAL QG 3.520 . 5.240 3.770 3.185 4.175 . 0 0 "[ . 1 . 2]" 1
951 3 43 ASP H 3 65 THR H 3.400 . 5.000 5.027 4.582 5.344 0.344 17 0 "[ . 1 . 2]" 1
952 3 44 LEU H 3 45 ASP H 3.250 . 4.700 4.252 3.897 4.500 . 0 0 "[ . 1 . 2]" 1
953 3 44 LEU MD1 3 45 ASP H 3.120 . 4.440 3.810 2.111 5.188 0.748 17 2 "[ . - 1 . + 2]" 1
954 3 44 LEU MD1 3 60 LEU QD 3.470 . 4.380 2.531 1.775 4.435 0.055 13 0 "[ . 1 . 2]" 1
955 3 44 LEU MD2 3 45 ASP H 3.340 . 4.880 4.334 2.696 5.183 0.303 1 0 "[ . 1 . 2]" 1
956 3 45 ASP H 3 46 THR H 3.220 . 4.640 4.417 4.256 4.527 . 0 0 "[ . 1 . 2]" 1
957 3 45 ASP H 3 60 LEU QD 2.640 . 3.480 3.290 2.348 5.096 1.616 2 4 "[ +* - 1 * 2]" 1
958 3 45 ASP H 3 61 ARG H 3.030 . 4.260 3.770 3.467 4.259 . 0 0 "[ . 1 . 2]" 1
959 3 46 THR H 3 47 ALA H 3.140 . 4.480 4.329 4.140 4.472 . 0 0 "[ . 1 . 2]" 1
960 3 46 THR H 3 61 ARG H 3.460 . 5.120 4.884 4.542 5.187 0.067 2 0 "[ . 1 . 2]" 1
961 3 47 ALA H 3 48 SER H 3.130 . 4.460 4.430 4.321 4.504 0.044 9 0 "[ . 1 . 2]" 1
962 3 47 ALA H 3 58 VAL QG 3.400 . 5.000 3.899 3.222 4.821 . 0 0 "[ . 1 . 2]" 1
963 3 47 ALA H 3 59 VAL H 2.910 . 4.020 3.445 2.892 3.913 . 0 0 "[ . 1 . 2]" 1
964 3 47 ALA H 3 61 ARG H 3.040 . 4.280 3.937 3.355 4.392 0.112 16 0 "[ . 1 . 2]" 1
965 3 47 ALA MB 3 48 SER H 2.820 . 3.840 2.604 2.426 2.817 . 0 0 "[ . 1 . 2]" 1
966 3 47 ALA MB 3 59 VAL H 3.510 . 5.220 3.420 2.919 4.020 . 0 0 "[ . 1 . 2]" 1
967 3 48 SER H 3 49 SER H 3.190 . 4.580 4.338 4.271 4.394 . 0 0 "[ . 1 . 2]" 1
968 3 48 SER H 3 59 VAL H 3.350 . 4.900 4.650 4.285 5.022 0.122 11 0 "[ . 1 . 2]" 1
969 3 49 SER H 3 50 GLN H 3.070 . 4.340 4.216 4.044 4.386 0.046 17 0 "[ . 1 . 2]" 1
970 3 49 SER H 3 57 GLU H 2.470 . 3.140 3.103 2.808 3.620 0.480 4 0 "[ . 1 . 2]" 1
971 3 49 SER H 3 59 VAL H 3.510 . 5.220 5.016 4.496 5.502 0.282 5 0 "[ . 1 . 2]" 1
972 3 50 GLN H 3 51 LEU H 3.330 . 4.860 4.487 4.316 4.593 . 0 0 "[ . 1 . 2]" 1
973 3 50 GLN H 3 57 GLU H 3.460 . 5.120 4.940 4.572 5.153 0.033 20 0 "[ . 1 . 2]" 1
974 3 51 LEU H 3 52 ALA H 2.090 . 2.380 2.149 1.934 2.391 0.011 7 0 "[ . 1 . 2]" 1
975 3 51 LEU H 3 55 VAL H 3.250 . 4.700 4.825 4.423 5.065 0.365 1 0 "[ . 1 . 2]" 1
976 3 51 LEU H 3 55 VAL MG1 3.410 . 5.020 3.654 3.345 4.328 . 0 0 "[ . 1 . 2]" 1
977 3 51 LEU H 3 57 GLU H 3.200 . 4.600 3.967 3.408 4.492 . 0 0 "[ . 1 . 2]" 1
978 3 51 LEU MD1 3 55 VAL MG1 3.110 . 4.420 2.410 2.126 2.977 . 0 0 "[ . 1 . 2]" 1
979 3 51 LEU MD1 3 57 GLU H 3.480 . 5.160 3.844 2.985 4.404 . 0 0 "[ . 1 . 2]" 1
980 3 51 LEU MD1 3 83 ILE MD 2.440 . 3.080 1.753 1.695 1.819 0.105 8 0 "[ . 1 . 2]" 1
981 3 52 ALA H 3 53 ASP H 3.170 . 4.540 4.319 4.278 4.360 . 0 0 "[ . 1 . 2]" 1
982 3 52 ALA H 3 55 VAL H 2.820 . 3.840 3.584 3.416 3.754 . 0 0 "[ . 1 . 2]" 1
983 3 52 ALA H 3 55 VAL MG1 2.860 . 3.920 3.449 2.877 3.833 . 0 0 "[ . 1 . 2]" 1
984 3 52 ALA H 3 55 VAL MG2 3.170 . 4.540 4.291 3.821 4.785 0.245 12 0 "[ . 1 . 2]" 1
985 3 52 ALA MB 3 53 ASP H 2.310 . 2.820 1.910 1.802 2.072 . 0 0 "[ . 1 . 2]" 1
986 3 52 ALA MB 3 55 VAL MG1 3.510 . 5.220 3.025 2.734 3.195 . 0 0 "[ . 1 . 2]" 1
987 3 52 ALA MB 3 55 VAL MG2 3.060 . 4.320 2.582 2.043 2.884 . 0 0 "[ . 1 . 2]" 1
988 3 53 ASP H 3 54 ASP H 3.280 . 4.760 4.447 4.286 4.534 . 0 0 "[ . 1 . 2]" 1
989 3 53 ASP H 3 55 VAL H 3.360 . 4.920 4.134 3.799 4.373 . 0 0 "[ . 1 . 2]" 1
990 3 53 ASP H 3 55 VAL MG2 3.360 . 4.920 4.188 3.557 4.852 . 0 0 "[ . 1 . 2]" 1
991 3 54 ASP H 3 55 VAL H 2.360 . 2.920 2.757 2.617 2.864 . 0 0 "[ . 1 . 2]" 1
992 3 55 VAL H 3 56 TYR H 3.090 . 4.380 4.178 3.939 4.321 . 0 0 "[ . 1 . 2]" 1
993 3 55 VAL H 3 56 TYR QD 3.370 . 4.940 4.285 3.398 5.329 0.389 6 0 "[ . 1 . 2]" 1
994 3 55 VAL H 3 56 TYR QE 3.350 . 4.900 5.232 3.515 7.080 2.180 10 9 "[ - *** +* ** *2]" 1
995 3 55 VAL MG1 3 56 TYR H 2.780 . 3.760 3.037 2.675 3.419 . 0 0 "[ . 1 . 2]" 1
996 3 55 VAL MG2 3 56 TYR H 3.510 . 5.220 4.197 4.072 4.381 . 0 0 "[ . 1 . 2]" 1
997 3 56 TYR H 3 57 GLU H 3.230 . 4.660 4.373 4.170 4.484 . 0 0 "[ . 1 . 2]" 1
998 3 56 TYR H 3 84 PHE H 3.000 . 4.200 3.490 3.112 3.927 . 0 0 "[ . 1 . 2]" 1
999 3 56 TYR H 3 86 ILE H 3.030 . 4.260 3.953 3.029 4.949 0.689 11 2 "[ . 1+ .- 2]" 1
1000 3 56 TYR QD 3 57 GLU H 3.270 . 4.740 3.598 2.736 4.345 . 0 0 "[ . 1 . 2]" 1
1001 3 56 TYR QE 3 86 ILE MD 3.320 . 4.830 3.453 2.558 5.414 0.584 8 1 "[ . + 1 . 2]" 1
1002 3 56 TYR QE 3 94 MET ME 3.390 . 4.980 5.442 2.004 7.438 2.458 13 11 "[* *** ***+*.*- 2]" 1
1003 3 57 GLU H 3 58 VAL H 3.120 . 4.440 4.256 4.011 4.467 0.027 16 0 "[ . 1 . 2]" 1
1004 3 58 VAL H 3 59 VAL H 3.170 . 4.540 4.352 4.147 4.492 . 0 0 "[ . 1 . 2]" 1
1005 3 58 VAL H 3 82 GLY H 2.770 . 3.740 3.248 3.024 3.626 . 0 0 "[ . 1 . 2]" 1
1006 3 58 VAL H 3 84 PHE H 2.890 . 3.980 4.298 3.773 4.839 0.859 5 5 "[ * +* *1 - 2]" 1
1007 3 58 VAL H 3 84 PHE QD 3.210 . 4.620 3.036 2.392 3.540 . 0 0 "[ . 1 . 2]" 1
1008 3 58 VAL H 3 84 PHE QE 3.350 . 4.900 3.513 2.935 4.211 . 0 0 "[ . 1 . 2]" 1
1009 3 58 VAL QG 3 59 VAL H 2.840 . 3.880 2.847 2.463 3.498 . 0 0 "[ . 1 . 2]" 1
1010 3 58 VAL QG 3 98 LEU QD 2.900 . 4.000 3.124 1.994 4.112 0.112 13 0 "[ . 1 . 2]" 1
1011 3 59 VAL H 3 60 LEU H 3.250 . 4.700 4.135 4.003 4.253 . 0 0 "[ . 1 . 2]" 1
1012 3 59 VAL H 3 82 GLY H 3.530 . 5.250 4.944 4.753 5.100 . 0 0 "[ . 1 . 2]" 1
1013 3 59 VAL MG1 3 60 LEU H 2.540 . 3.280 3.203 3.025 3.370 0.090 4 0 "[ . 1 . 2]" 1
1014 3 59 VAL MG1 3 80 GLN H 2.980 . 4.160 3.480 3.123 3.973 . 0 0 "[ . 1 . 2]" 1
1015 3 59 VAL MG1 3 81 GLY H 2.950 . 4.100 3.663 3.279 4.315 0.215 17 0 "[ . 1 . 2]" 1
1016 3 59 VAL MG2 3 60 LEU H 3.460 . 5.120 4.284 4.204 4.380 . 0 0 "[ . 1 . 2]" 1
1017 3 59 VAL MG2 3 81 GLY H 3.460 . 5.120 4.207 3.873 4.739 . 0 0 "[ . 1 . 2]" 1
1018 3 59 VAL MG2 3 82 GLY H 3.020 . 4.240 3.370 2.900 3.907 . 0 0 "[ . 1 . 2]" 1
1019 3 60 LEU H 3 61 ARG H 3.120 . 4.440 4.271 4.161 4.493 0.053 3 0 "[ . 1 . 2]" 1
1020 3 60 LEU H 3 80 GLN H 2.810 . 3.820 3.701 3.255 4.177 0.357 13 0 "[ . 1 . 2]" 1
1021 3 60 LEU H 3 81 GLY H 3.440 . 5.080 5.034 4.892 5.191 0.111 3 0 "[ . 1 . 2]" 1
1022 3 60 LEU QD 3 61 ARG H 2.730 . 3.660 2.874 2.472 3.828 0.168 2 0 "[ . 1 . 2]" 1
1023 3 60 LEU QD 3 62 VAL H 3.310 . 4.820 3.946 3.289 5.307 0.487 2 0 "[ . 1 . 2]" 1
1024 3 60 LEU QD 3 62 VAL MG2 3.150 . 3.280 2.175 1.749 3.236 0.051 8 0 "[ . 1 . 2]" 1
1025 3 61 ARG H 3 62 VAL H 3.170 . 4.540 4.290 4.145 4.549 0.009 20 0 "[ . 1 . 2]" 1
1026 3 62 VAL H 3 63 THR H 3.120 . 4.440 4.364 4.141 4.484 0.044 10 0 "[ . 1 . 2]" 1
1027 3 62 VAL H 3 78 VAL H 2.650 . 3.500 3.391 3.054 3.625 0.125 7 0 "[ . 1 . 2]" 1
1028 3 62 VAL H 3 80 GLN H 3.180 . 4.560 4.009 3.601 4.263 . 0 0 "[ . 1 . 2]" 1
1029 3 62 VAL MG1 3 63 THR H 2.940 . 4.080 2.735 2.499 3.253 . 0 0 "[ . 1 . 2]" 1
1030 3 62 VAL MG1 3 64 VAL QG 2.990 . 4.180 2.792 2.486 3.202 . 0 0 "[ . 1 . 2]" 1
1031 3 62 VAL MG1 3 114 ILE MD 2.760 . 3.720 2.106 1.869 2.328 . 0 0 "[ . 1 . 2]" 1
1032 3 62 VAL MG2 3 110 ALA MB 2.960 . 4.120 2.033 1.846 2.181 . 0 0 "[ . 1 . 2]" 1
1033 3 63 THR H 3 64 VAL H 3.180 . 4.560 4.324 4.157 4.496 . 0 0 "[ . 1 . 2]" 1
1034 3 64 VAL H 3 65 THR H 3.200 . 4.600 4.223 3.989 4.457 . 0 0 "[ . 1 . 2]" 1
1035 3 64 VAL H 3 75 LEU MD2 3.400 . 5.000 3.917 3.377 4.277 . 0 0 "[ . 1 . 2]" 1
1036 3 64 VAL H 3 76 CYS H 2.710 . 3.620 3.294 2.893 3.582 . 0 0 "[ . 1 . 2]" 1
1037 3 64 VAL H 3 77 GLU H 3.380 . 4.960 4.808 4.578 5.051 0.091 15 0 "[ . 1 . 2]" 1
1038 3 64 VAL H 3 78 VAL H 3.400 . 5.000 5.100 4.800 5.427 0.427 15 0 "[ . 1 . 2]" 1
1039 3 64 VAL H 3 114 ILE MD 3.250 . 4.700 3.782 2.654 4.699 . 0 0 "[ . 1 . 2]" 1
1040 3 64 VAL QG 3 65 THR H 2.760 . 3.720 2.872 2.512 3.137 . 0 0 "[ . 1 . 2]" 1
1041 3 64 VAL QG 3 114 ILE MD 2.560 . 3.320 1.865 1.680 2.225 0.120 6 0 "[ . 1 . 2]" 1
1042 3 64 VAL QG 3 126 LEU QD 2.580 . 3.360 2.206 1.615 4.382 1.022 1 1 "[+ . 1 . 2]" 1
1043 3 65 THR H 3 66 ALA H 3.250 . 4.700 4.439 4.048 4.544 . 0 0 "[ . 1 . 2]" 1
1044 3 65 THR H 3 75 LEU MD2 3.460 . 5.120 3.926 3.755 4.247 . 0 0 "[ . 1 . 2]" 1
1045 3 66 ALA H 3 67 SER H 2.960 . 4.120 4.159 3.904 4.385 0.265 9 0 "[ . 1 . 2]" 1
1046 3 66 ALA H 3 73 ALA H 3.330 . 4.860 4.506 4.302 4.794 . 0 0 "[ . 1 . 2]" 1
1047 3 66 ALA H 3 74 PHE H 2.760 . 3.720 3.433 3.261 3.609 . 0 0 "[ . 1 . 2]" 1
1048 3 66 ALA H 3 75 LEU MD2 3.160 . 4.520 3.601 3.386 3.873 . 0 0 "[ . 1 . 2]" 1
1049 3 66 ALA MB 3 67 SER H 3.070 . 4.340 3.243 2.971 3.523 . 0 0 "[ . 1 . 2]" 1
1050 3 66 ALA MB 3 73 ALA H 3.440 . 5.080 3.592 3.291 3.870 . 0 0 "[ . 1 . 2]" 1
1051 3 66 ALA MB 3 73 ALA MB 3.020 . 4.240 2.163 1.986 2.600 . 0 0 "[ . 1 . 2]" 1
1052 3 66 ALA MB 3 74 PHE H 2.740 . 3.680 2.373 2.117 2.687 . 0 0 "[ . 1 . 2]" 1
1053 3 66 ALA MB 3 74 PHE QD 2.780 . 3.760 2.993 2.848 3.090 . 0 0 "[ . 1 . 2]" 1
1054 3 66 ALA MB 3 74 PHE QE 2.400 . 3.000 2.813 2.761 2.923 . 0 0 "[ . 1 . 2]" 1
1055 3 67 SER H 3 68 LEU H 3.250 . 4.700 4.327 4.203 4.438 . 0 0 "[ . 1 . 2]" 1
1056 3 67 SER H 3 69 GLY H 3.460 . 5.120 4.740 4.480 5.233 0.113 1 0 "[ . 1 . 2]" 1
1057 3 67 SER H 3 73 ALA H 3.200 . 4.600 4.300 3.925 4.586 . 0 0 "[ . 1 . 2]" 1
1058 3 68 LEU H 3 69 GLY H 2.470 . 3.150 2.945 2.318 3.473 0.323 5 0 "[ . 1 . 2]" 1
1059 3 68 LEU H 3 70 GLU H 3.250 . 4.700 5.014 3.805 5.526 0.826 19 10 "[ * * * **** *- +2]" 1
1060 3 68 LEU H 3 71 GLU H 3.010 . 4.220 4.016 3.192 4.616 0.396 7 0 "[ . 1 . 2]" 1
1061 3 68 LEU H 3 72 THR H 3.500 . 5.200 4.858 4.625 5.028 . 0 0 "[ . 1 . 2]" 1
1062 3 68 LEU H 3 73 ALA H 2.670 . 3.540 3.519 2.836 4.132 0.592 3 3 "[ + . 1 * . -]" 1
1063 3 68 LEU H 3 73 ALA MB 3.240 . 4.680 3.656 2.944 4.456 . 0 0 "[ . 1 . 2]" 1
1064 3 68 LEU MD1 3 73 ALA H 3.370 . 4.940 3.950 3.296 4.492 . 0 0 "[ . 1 . 2]" 1
1065 3 68 LEU MD1 3 73 ALA MB 2.860 . 3.920 2.610 2.215 3.010 . 0 0 "[ . 1 . 2]" 1
1066 3 68 LEU MD2 3 73 ALA MB 3.220 . 4.640 2.510 2.172 3.138 . 0 0 "[ . 1 . 2]" 1
1067 3 69 GLY H 3 70 GLU H 2.880 . 3.960 4.130 3.687 4.346 0.386 7 0 "[ . 1 . 2]" 1
1068 3 69 GLY H 3 71 GLU H 3.330 . 4.860 4.501 3.922 4.957 0.097 7 0 "[ . 1 . 2]" 1
1069 3 70 GLU H 3 71 GLU H 1.890 . 1.980 2.132 1.792 2.255 0.275 19 0 "[ . 1 . 2]" 1
1070 3 71 GLU H 3 72 THR H 3.200 . 4.600 4.436 4.137 4.565 . 0 0 "[ . 1 . 2]" 1
1071 3 72 THR H 3 73 ALA H 3.290 . 4.780 4.511 4.423 4.642 . 0 0 "[ . 1 . 2]" 1
1072 3 73 ALA H 3 74 PHE H 2.280 . 2.760 2.521 2.342 2.679 . 0 0 "[ . 1 . 2]" 1
1073 3 73 ALA MB 3 74 PHE H 2.470 . 3.140 2.313 2.147 2.426 . 0 0 "[ . 1 . 2]" 1
1074 3 73 ALA MB 3 74 PHE QD 3.320 . 4.830 2.737 2.588 3.069 . 0 0 "[ . 1 . 2]" 1
1075 3 73 ALA MB 3 123 PHE QE 3.260 . 4.720 3.834 2.679 5.310 0.590 11 1 "[ . 1+ . 2]" 1
1076 3 74 PHE H 3 75 LEU H 3.170 . 4.540 4.344 4.303 4.378 . 0 0 "[ . 1 . 2]" 1
1077 3 74 PHE QD 3 75 LEU H 3.060 . 4.320 3.024 2.814 3.332 . 0 0 "[ . 1 . 2]" 1
1078 3 74 PHE QD 3 123 PHE QD 3.350 . 4.900 3.225 2.894 3.431 . 0 0 "[ . 1 . 2]" 1
1079 3 74 PHE QD 3 123 PHE QE 3.300 . 4.800 3.538 3.116 3.960 . 0 0 "[ . 1 . 2]" 1
1080 3 74 PHE QE 3 118 VAL QG 3.030 . 4.260 2.348 2.064 2.561 . 0 0 "[ . 1 . 2]" 1
1081 3 74 PHE QE 3 123 PHE QD 3.190 . 4.580 3.604 2.956 3.999 . 0 0 "[ . 1 . 2]" 1
1082 3 74 PHE QE 3 126 LEU QD 3.090 . 4.380 3.160 2.302 5.392 1.012 1 1 "[+ . 1 . 2]" 1
1083 3 75 LEU H 3 76 CYS H 3.200 . 4.600 4.287 3.879 4.410 . 0 0 "[ . 1 . 2]" 1
1084 3 75 LEU MD1 3 76 CYS H 2.550 . 3.300 2.202 1.930 3.085 . 0 0 "[ . 1 . 2]" 1
1085 3 75 LEU MD1 3 77 GLU H 3.320 . 4.830 3.873 3.304 4.218 . 0 0 "[ . 1 . 2]" 1
1086 3 75 LEU MD2 3 76 CYS H 2.460 . 3.120 2.505 2.135 3.028 . 0 0 "[ . 1 . 2]" 1
1087 3 76 CYS H 3 77 GLU H 3.220 . 4.640 4.335 3.991 4.524 . 0 0 "[ . 1 . 2]" 1
1088 3 77 GLU H 3 78 VAL H 2.980 . 4.160 4.145 3.944 4.365 0.205 14 0 "[ . 1 . 2]" 1
1089 3 77 GLU H 3 78 VAL MG2 3.230 . 4.660 3.672 3.424 4.422 . 0 0 "[ . 1 . 2]" 1
1090 3 78 VAL H 3 79 GLN H 3.220 . 4.640 4.180 3.916 4.404 . 0 0 "[ . 1 . 2]" 1
1091 3 78 VAL H 3 114 ILE MD 2.830 . 3.860 3.230 2.652 3.941 0.081 16 0 "[ . 1 . 2]" 1
1092 3 78 VAL MG1 3 79 GLN H 2.560 . 3.320 2.843 2.305 3.266 . 0 0 "[ . 1 . 2]" 1
1093 3 78 VAL MG1 3 80 GLN H 3.020 . 4.240 3.066 2.775 3.434 . 0 0 "[ . 1 . 2]" 1
1094 3 78 VAL MG1 3 110 ALA MB 3.280 . 4.760 2.748 2.147 3.284 . 0 0 "[ . 1 . 2]" 1
1095 3 78 VAL MG2 3 79 GLN H 3.400 . 5.000 4.038 3.814 4.197 . 0 0 "[ . 1 . 2]" 1
1096 3 78 VAL MG2 3 114 ILE H 3.080 . 4.360 3.005 2.809 3.222 . 0 0 "[ . 1 . 2]" 1
1097 3 78 VAL MG2 3 114 ILE MD 3.150 . 4.500 3.393 3.181 3.525 . 0 0 "[ . 1 . 2]" 1
1098 3 79 GLN H 3 80 GLN H 2.930 . 4.060 4.027 3.833 4.181 0.121 3 0 "[ . 1 . 2]" 1
1099 3 80 GLN H 3 81 GLY H 3.120 . 4.440 4.335 4.221 4.544 0.104 17 0 "[ . 1 . 2]" 1
1100 3 80 GLN H 3 110 ALA MB 3.030 . 4.260 3.426 3.174 3.839 . 0 0 "[ . 1 . 2]" 1
1101 3 81 GLY H 3 82 GLY H 3.310 . 4.820 4.558 4.446 4.605 . 0 0 "[ . 1 . 2]" 1
1102 3 82 GLY H 3 83 ILE H 3.090 . 4.380 4.076 3.936 4.187 . 0 0 "[ . 1 . 2]" 1
1103 3 82 GLY H 3 84 PHE QE 3.390 . 4.980 4.179 3.741 4.622 . 0 0 "[ . 1 . 2]" 1
1104 3 83 ILE H 3 84 PHE H 3.170 . 4.540 4.438 4.338 4.505 . 0 0 "[ . 1 . 2]" 1
1105 3 84 PHE H 3 85 SER H 3.270 . 4.740 4.196 4.099 4.422 . 0 0 "[ . 1 . 2]" 1
1106 3 84 PHE QD 3 85 SER H 3.330 . 4.860 4.324 3.961 4.612 . 0 0 "[ . 1 . 2]" 1
1107 3 85 SER H 3 86 ILE H 3.190 . 4.580 4.321 4.127 4.576 . 0 0 "[ . 1 . 2]" 1
1108 3 86 ILE H 3 87 ALA H 3.230 . 4.660 4.350 4.082 4.524 . 0 0 "[ . 1 . 2]" 1
1109 3 86 ILE MD 3 87 ALA H 3.100 . 4.400 3.750 2.639 4.801 0.401 13 0 "[ . 1 . 2]" 1
1110 3 86 ILE MD 3 88 GLY H 3.360 . 4.920 5.295 3.756 7.205 2.285 13 9 "[ * . * 1 *+*** *-]" 1
1111 3 86 ILE MD 3 89 ILE MD 3.330 . 4.860 2.504 1.788 5.139 0.279 13 0 "[ . 1 . 2]" 1
1112 3 86 ILE MD 3 94 MET ME 2.630 . 3.460 3.955 1.791 7.585 4.125 13 9 "[* ** 1**+*.- * 2]" 1
1113 3 87 ALA H 3 88 GLY H 2.850 . 3.900 4.333 4.223 4.412 0.512 12 2 "[ . 1 + . -]" 1
1114 3 87 ALA H 3 89 ILE H 2.760 . 3.720 4.059 3.518 4.664 0.944 5 6 "[ * +* *-1 * . 2]" 1
1115 3 87 ALA MB 3 88 GLY H 3.010 . 4.220 2.476 1.954 2.980 . 0 0 "[ . 1 . 2]" 1
1116 3 88 GLY H 3 89 ILE H 2.240 . 2.680 2.957 2.530 3.630 0.950 13 4 "[ ** . 1 + - 2]" 1
1117 3 89 ILE H 3 90 GLU H 3.320 . 4.830 4.547 3.980 4.703 . 0 0 "[ . 1 . 2]" 1
1118 3 89 ILE MD 3 90 GLU H 2.820 . 3.840 4.409 3.035 5.377 1.537 11 13 "[* **.* - 1+***.*** *]" 1
1119 3 89 ILE MD 3 94 MET H 3.080 . 4.360 4.888 3.147 6.647 2.287 13 10 "[* *.* - 1**+*. * *]" 1
1120 3 89 ILE MD 3 94 MET ME 2.580 . 3.360 2.905 1.660 4.705 1.345 13 2 "[ . - 1 + . 2]" 1
1121 3 90 GLU H 3 91 GLY H 3.140 . 4.480 4.338 4.219 4.402 . 0 0 "[ . 1 . 2]" 1
1122 3 90 GLU H 3 93 GLN H 3.250 . 4.700 4.191 3.488 5.287 0.587 17 1 "[ . 1 . + 2]" 1
1123 3 90 GLU H 3 94 MET H 2.780 . 3.760 3.523 2.812 4.045 0.285 6 0 "[ . 1 . 2]" 1
1124 3 91 GLY H 3 92 THR H 3.330 . 4.860 4.520 4.368 4.685 . 0 0 "[ . 1 . 2]" 1
1125 3 91 GLY H 3 94 MET H 3.140 . 4.480 4.247 3.748 4.879 0.399 13 0 "[ . 1 . 2]" 1
1126 3 92 THR H 3 93 GLN H 2.360 . 2.920 2.593 2.402 2.884 . 0 0 "[ . 1 . 2]" 1
1127 3 92 THR H 3 94 MET H 3.210 . 4.620 4.353 4.040 4.596 . 0 0 "[ . 1 . 2]" 1
1128 3 93 GLN H 3 94 MET H 2.370 . 2.940 2.692 2.458 2.834 . 0 0 "[ . 1 . 2]" 1
1129 3 93 GLN H 3 96 HIS H 3.400 . 5.000 4.818 4.596 5.418 0.418 10 0 "[ . 1 . 2]" 1
1130 3 94 MET H 3 95 ALA H 2.580 . 3.360 2.652 2.395 3.171 . 0 0 "[ . 1 . 2]" 1
1131 3 94 MET H 3 96 HIS H 2.910 . 4.020 4.128 3.895 4.686 0.666 10 1 "[ . + . 2]" 1
1132 3 94 MET H 3 97 CYS H 3.330 . 4.860 4.735 4.506 5.005 0.145 10 0 "[ . 1 . 2]" 1
1133 3 94 MET ME 3 98 LEU QD 2.960 . 4.120 3.647 1.920 5.583 1.463 12 5 "[ .- * + *. * 2]" 1
1134 3 95 ALA H 3 96 HIS H 2.300 . 2.800 2.567 1.745 2.772 0.055 11 0 "[ . 1 . 2]" 1
1135 3 95 ALA H 3 97 CYS H 3.130 . 4.460 3.953 3.559 4.254 . 0 0 "[ . 1 . 2]" 1
1136 3 95 ALA MB 3 96 HIS H 2.720 . 3.640 2.684 2.449 3.003 . 0 0 "[ . 1 . 2]" 1
1137 3 96 HIS H 3 97 CYS H 2.290 . 2.780 2.466 2.309 2.643 . 0 0 "[ . 1 . 2]" 1
1138 3 96 HIS H 3 98 LEU H 3.290 . 4.780 4.563 3.838 5.177 0.397 10 0 "[ . 1 . 2]" 1
1139 3 97 CYS H 3 98 LEU H 2.320 . 2.840 2.777 2.456 3.039 0.199 10 0 "[ . 1 . 2]" 1
1140 3 97 CYS H 3 99 GLY H 3.000 . 4.200 3.761 3.559 4.406 0.206 20 0 "[ . 1 . 2]" 1
1141 3 98 LEU H 3 99 GLY H 2.450 . 3.100 2.411 1.779 2.643 0.021 8 0 "[ . 1 . 2]" 1
1142 3 98 LEU H 3 100 ALA H 3.440 . 5.080 4.180 3.442 4.444 . 0 0 "[ . 1 . 2]" 1
1143 3 99 GLY H 3 100 ALA H 1.940 . 2.080 2.521 2.315 2.736 0.656 12 6 "[ *. * + *.- *]" 1
1144 3 99 GLY H 3 101 TYR H 2.630 . 3.460 4.044 3.813 4.396 0.936 14 12 "[ **** * -** +** *]" 1
1145 3 99 GLY H 3 102 CYS H 2.810 . 3.820 4.852 4.331 5.349 1.529 14 20 [********-****+******] 1
1146 3 100 ALA H 3 101 TYR H 1.890 . 1.980 2.101 1.889 2.314 0.334 4 0 "[ . 1 . 2]" 1
1147 3 100 ALA H 3 102 CYS H 2.620 . 3.440 3.592 3.252 4.034 0.594 8 1 "[ . + 1 . 2]" 1
1148 3 100 ALA MB 3 101 TYR H 2.640 . 3.480 2.537 2.223 2.909 . 0 0 "[ . 1 . 2]" 1
1149 3 101 TYR H 3 102 CYS H 2.320 . 2.840 2.765 2.540 3.042 0.202 8 0 "[ . 1 . 2]" 1
1150 3 101 TYR QD 3 102 CYS H 3.070 . 4.340 3.416 2.364 4.068 . 0 0 "[ . 1 . 2]" 1
1151 3 101 TYR QE 3 105 ILE MD 3.210 . 4.620 3.307 2.856 3.889 . 0 0 "[ . 1 . 2]" 1
1152 3 109 TYR H 3 110 ALA H 2.230 . 2.660 2.697 2.614 2.801 0.141 4 0 "[ . 1 . 2]" 1
1153 3 109 TYR H 3 111 ARG H 2.940 . 4.080 4.020 3.881 4.240 0.160 16 0 "[ . 1 . 2]" 1
1154 3 109 TYR QD 3 110 ALA H 3.390 . 4.980 4.057 3.890 4.244 . 0 0 "[ . 1 . 2]" 1
1155 3 110 ALA H 3 111 ARG H 2.100 . 2.400 2.572 2.439 2.692 0.292 14 0 "[ . 1 . 2]" 1
1156 3 110 ALA H 3 112 GLU H 3.060 . 4.320 4.284 4.009 4.617 0.297 11 0 "[ . 1 . 2]" 1
1157 3 110 ALA H 3 113 CYS H 3.360 . 4.920 4.743 4.604 4.980 0.060 11 0 "[ . 1 . 2]" 1
1158 3 110 ALA MB 3 111 ARG H 2.700 . 3.600 2.548 2.430 2.713 . 0 0 "[ . 1 . 2]" 1
1159 3 111 ARG H 3 112 GLU H 2.380 . 2.960 2.784 2.654 2.906 . 0 0 "[ . 1 . 2]" 1
1160 3 111 ARG H 3 113 CYS H 3.020 . 4.240 4.027 3.863 4.189 . 0 0 "[ . 1 . 2]" 1
1161 3 112 GLU H 3 113 CYS H 2.180 . 2.560 2.553 2.456 2.810 0.250 20 0 "[ . 1 . 2]" 1
1162 3 112 GLU H 3 114 ILE H 3.400 . 5.000 4.235 3.964 4.520 . 0 0 "[ . 1 . 2]" 1
1163 3 112 GLU H 3 115 THR H 3.460 . 5.120 4.814 4.609 5.162 0.042 16 0 "[ . 1 . 2]" 1
1164 3 113 CYS H 3 114 ILE H 2.490 . 3.180 2.645 2.559 2.771 . 0 0 "[ . 1 . 2]" 1
1165 3 113 CYS H 3 115 THR H 2.990 . 4.180 4.112 3.989 4.356 0.176 13 0 "[ . 1 . 2]" 1
1166 3 114 ILE H 3 115 THR H 2.350 . 2.900 2.575 2.486 2.690 . 0 0 "[ . 1 . 2]" 1
1167 3 114 ILE H 3 116 SER H 3.170 . 4.540 4.040 3.825 4.249 . 0 0 "[ . 1 . 2]" 1
1168 3 114 ILE H 3 117 MET H 3.450 . 5.100 4.787 4.619 5.012 . 0 0 "[ . 1 . 2]" 1
1169 3 115 THR H 3 116 SER H 2.370 . 2.940 2.737 2.643 2.868 . 0 0 "[ . 1 . 2]" 1
1170 3 115 THR H 3 117 MET H 3.180 . 4.560 4.331 4.145 4.540 . 0 0 "[ . 1 . 2]" 1
1171 3 115 THR H 3 118 VAL H 3.520 . 5.240 4.918 4.735 5.074 . 0 0 "[ . 1 . 2]" 1
1172 3 115 THR H 3 126 LEU H 3.420 . 5.040 5.310 4.500 6.570 1.530 7 6 "[* .*+ 1 * *. - 2]" 1
1173 3 116 SER H 3 117 MET H 2.190 . 2.580 2.744 2.611 2.872 0.292 8 0 "[ . 1 . 2]" 1
1174 3 116 SER H 3 118 VAL H 2.950 . 4.100 4.241 4.103 4.388 0.288 15 0 "[ . 1 . 2]" 1
1175 3 116 SER H 3 119 SER H 3.450 . 5.100 4.877 4.664 5.023 . 0 0 "[ . 1 . 2]" 1
1176 3 117 MET H 3 118 VAL H 2.360 . 2.920 2.833 2.739 2.936 0.016 10 0 "[ . 1 . 2]" 1
1177 3 117 MET H 3 119 SER H 3.130 . 4.460 4.304 4.148 4.531 0.071 10 0 "[ . 1 . 2]" 1
1178 3 117 MET ME 4 21 ILE MD 2.490 . 3.180 1.871 1.677 2.017 0.123 2 0 "[ . 1 . 2]" 1
1179 3 117 MET ME 4 117 MET ME 2.710 . 3.620 3.324 3.032 3.669 0.049 19 0 "[ . 1 . 2]" 1
1180 3 118 VAL H 3 119 SER H 2.230 . 2.660 2.616 2.528 2.716 0.056 7 0 "[ . 1 . 2]" 1
1181 3 118 VAL QG 3 119 SER H 3.190 . 4.580 3.202 3.086 3.371 . 0 0 "[ . 1 . 2]" 1
1182 3 118 VAL QG 3 123 PHE H 3.070 . 4.340 3.148 2.796 3.456 . 0 0 "[ . 1 . 2]" 1
1183 3 118 VAL QG 3 123 PHE QD 3.150 . 4.500 3.295 3.017 3.617 . 0 0 "[ . 1 . 2]" 1
1184 3 118 VAL QG 3 126 LEU H 3.410 . 4.420 3.010 2.265 3.918 . 0 0 "[ . 1 . 2]" 1
1185 3 118 VAL QG 3 126 LEU QD 2.700 . 3.600 2.294 1.662 3.984 0.384 1 0 "[ . 1 . 2]" 1
1186 3 119 SER H 3 121 GLY H 3.060 . 4.320 4.154 3.979 4.301 . 0 0 "[ . 1 . 2]" 1
1187 3 119 SER H 3 123 PHE H 3.500 . 5.200 4.919 4.680 5.093 . 0 0 "[ . 1 . 2]" 1
1188 3 121 GLY H 3 122 THR H 2.380 . 2.960 2.637 2.504 2.769 . 0 0 "[ . 1 . 2]" 1
1189 3 121 GLY H 3 123 PHE H 2.690 . 3.580 3.919 3.665 4.260 0.680 18 4 "[ *. * 1 - . + 2]" 1
1190 3 121 GLY H 4 18 THR H 3.170 . 4.540 4.046 3.792 4.403 . 0 0 "[ . 1 . 2]" 1
1191 3 122 THR H 3 123 PHE H 2.360 . 2.920 2.700 2.577 2.837 . 0 0 "[ . 1 . 2]" 1
1192 3 122 THR H 4 18 THR H 3.320 . 4.840 4.493 4.259 4.741 . 0 0 "[ . 1 . 2]" 1
1193 3 125 GLN H 3 126 LEU H 3.340 . 4.880 4.612 4.434 4.735 . 0 0 "[ . 1 . 2]" 1
1194 3 126 LEU H 3 127 ASN H 2.330 . 2.860 3.438 2.233 4.448 1.588 14 12 "[** -** *1* *+** *2]" 1
1195 3 126 LEU QD 3 128 LEU QD 3.510 . 5.220 2.263 1.827 3.189 . 0 0 "[ . 1 . 2]" 1
1196 3 127 ASN H 3 128 LEU H 3.020 . 4.240 3.869 3.635 4.221 . 0 0 "[ . 1 . 2]" 1
1197 3 127 ASN H 3 128 LEU QD 3.500 . 5.200 3.845 3.226 5.129 . 0 0 "[ . 1 . 2]" 1
1198 3 128 LEU H 3 129 ALA H 3.310 . 4.820 4.523 4.123 4.630 . 0 0 "[ . 1 . 2]" 1
1199 3 128 LEU QD 3 129 ALA H 3.340 . 4.880 3.422 2.649 4.074 . 0 0 "[ . 1 . 2]" 1
1200 3 133 PHE H 3 134 ASP H 2.310 . 2.820 2.696 2.425 3.006 0.186 15 0 "[ . 1 . 2]" 1
1201 3 133 PHE H 3 135 ALA H 3.070 . 4.340 4.453 4.003 5.021 0.681 4 2 "[ +. - . 2]" 1
1202 3 133 PHE QD 3 134 ASP H 2.980 . 4.160 3.832 3.088 4.398 0.238 7 0 "[ . 1 . 2]" 1
1203 3 134 ASP H 3 135 ALA H 2.310 . 2.820 2.691 2.414 3.013 0.193 11 0 "[ . 1 . 2]" 1
1204 3 134 ASP H 3 136 LEU H 3.270 . 4.740 4.265 4.008 4.477 . 0 0 "[ . 1 . 2]" 1
1205 3 135 ALA H 3 136 LEU H 2.420 . 3.040 2.691 2.629 2.792 . 0 0 "[ . 1 . 2]" 1
1206 3 135 ALA H 3 137 PHE H 3.360 . 4.920 4.077 3.762 4.346 . 0 0 "[ . 1 . 2]" 1
1207 3 135 ALA H 3 138 MET H 3.380 . 4.960 4.884 4.551 5.590 0.630 8 1 "[ . + 1 . 2]" 1
1208 3 135 ALA MB 3 136 LEU H 2.540 . 3.280 2.549 2.363 2.734 . 0 0 "[ . 1 . 2]" 1
1209 3 136 LEU H 3 137 PHE H 2.480 . 3.160 2.583 2.399 2.773 . 0 0 "[ . 1 . 2]" 1
1210 3 136 LEU H 3 138 MET H 3.030 . 4.260 4.188 3.833 4.549 0.289 10 0 "[ . 1 . 2]" 1
1211 3 136 LEU H 3 139 ASN H 3.470 . 5.140 4.937 4.635 5.840 0.700 8 1 "[ . + 1 . 2]" 1
1212 3 136 LEU MD2 3 137 PHE H 3.250 . 4.700 4.392 3.474 5.138 0.438 16 0 "[ . 1 . 2]" 1
1213 3 137 PHE H 3 138 MET H 2.360 . 2.920 2.622 2.437 2.865 . 0 0 "[ . 1 . 2]" 1
1214 3 137 PHE H 3 139 ASN H 3.260 . 4.720 4.143 3.727 4.708 . 0 0 "[ . 1 . 2]" 1
1215 3 137 PHE QD 3 138 MET H 3.170 . 4.540 3.844 3.180 4.541 0.001 11 0 "[ . 1 . 2]" 1
1216 3 137 PHE QE 3 141 LEU QD 2.980 . 4.160 3.364 2.348 6.573 2.413 18 4 "[ * - 1 * . + 2]" 1
1217 3 138 MET H 3 139 ASN H 2.360 . 2.920 2.609 2.444 2.875 . 0 0 "[ . 1 . 2]" 1
1218 3 138 MET H 3 140 TYR H 3.390 . 4.980 4.039 3.811 4.240 . 0 0 "[ . 1 . 2]" 1
1219 3 139 ASN H 3 140 TYR H 2.510 . 3.220 2.599 2.453 2.813 . 0 0 "[ . 1 . 2]" 1
1220 3 140 TYR H 3 141 LEU H 3.170 . 4.540 3.537 3.003 4.419 . 0 0 "[ . 1 . 2]" 1
1221 3 140 TYR QD 3 141 LEU H 2.260 . 2.720 3.071 1.579 4.229 1.509 10 7 "[* *.*-* + . *]" 1
1222 3 140 TYR QE 3 141 LEU H 3.170 . 4.540 5.016 3.810 6.243 1.703 10 9 "[* *.*** + * -*]" 1
1223 4 9 MET H 4 10 THR H 3.280 . 4.760 4.527 4.449 4.603 . 0 0 "[ . 1 . 2]" 1
1224 4 9 MET ME 4 10 THR H 3.170 . 4.540 3.606 3.108 4.177 . 0 0 "[ . 1 . 2]" 1
1225 4 9 MET ME 4 11 PHE H 3.470 . 5.140 3.503 2.921 3.799 . 0 0 "[ . 1 . 2]" 1
1226 4 10 THR H 4 11 PHE H 3.180 . 4.560 4.331 4.192 4.456 . 0 0 "[ . 1 . 2]" 1
1227 4 10 THR H 4 87 ALA H 2.600 . 3.400 3.097 2.743 3.742 0.342 15 0 "[ . 1 . 2]" 1
1228 4 10 THR H 4 87 ALA MB 3.490 . 5.180 3.396 2.746 4.318 . 0 0 "[ . 1 . 2]" 1
1229 4 11 PHE H 4 12 GLN H 2.980 . 4.160 3.629 3.286 4.100 . 0 0 "[ . 1 . 2]" 1
1230 4 11 PHE QD 4 12 GLN H 2.810 . 3.820 4.061 3.436 4.275 0.455 11 0 "[ . 1 . 2]" 1
1231 4 11 PHE QD 4 85 SER H 3.430 . 5.060 5.403 4.194 6.089 1.029 17 8 "[ *. **1 **. + -*]" 1
1232 4 11 PHE QE 4 12 GLN H 3.460 . 5.120 5.236 4.352 5.538 0.418 9 0 "[ . 1 . 2]" 1
1233 4 11 PHE QE 4 84 PHE QD 2.930 . 4.060 3.335 2.360 3.841 . 0 0 "[ . 1 . 2]" 1
1234 4 11 PHE QE 4 85 SER H 3.450 . 5.100 5.701 4.699 6.504 1.404 14 11 "[ -**. **1 *+. ****]" 1
1235 4 11 PHE QE 4 101 TYR QD 3.250 . 4.700 3.309 2.640 3.788 . 0 0 "[ . 1 . 2]" 1
1236 4 11 PHE QE 4 101 TYR QE 3.490 . 5.180 2.761 1.999 3.338 . 0 0 "[ . 1 . 2]" 1
1237 4 11 PHE QE 4 102 CYS H 3.470 . 5.140 4.845 4.382 5.478 0.338 17 0 "[ . 1 . 2]" 1
1238 4 12 GLN H 4 13 ILE H 3.070 . 4.340 4.350 4.157 4.473 0.133 20 0 "[ . 1 . 2]" 1
1239 4 12 GLN H 4 85 SER H 2.410 . 3.020 2.975 2.377 3.730 0.710 17 1 "[ . 1 . + 2]" 1
1240 4 13 ILE H 4 14 GLN H 3.320 . 4.830 4.422 4.155 4.582 . 0 0 "[ . 1 . 2]" 1
1241 4 13 ILE MD 4 101 TYR QE 3.520 . 5.240 5.843 2.982 8.737 3.497 11 10 "[** .- * *+ * * ** 2]" 1
1242 4 13 ILE MD 4 105 ILE MD 2.840 . 3.880 3.958 2.221 6.222 2.342 11 7 "[ * . * *+ * - * 2]" 1
1243 4 14 GLN H 4 15 ARG H 2.120 . 2.440 2.321 2.048 2.592 0.152 1 0 "[ . 1 . 2]" 1
1244 4 14 GLN H 4 83 ILE H 3.030 . 4.260 4.419 3.966 4.788 0.528 20 1 "[ . 1 . +]" 1
1245 4 14 GLN H 4 84 PHE QD 3.380 . 4.960 4.314 3.635 5.107 0.147 13 0 "[ . 1 . 2]" 1
1246 4 14 GLN H 4 85 SER H 3.470 . 5.140 4.361 3.607 5.186 0.046 18 0 "[ . 1 . 2]" 1
1247 4 15 ARG H 4 16 ILE H 3.170 . 4.540 4.158 3.947 4.350 . 0 0 "[ . 1 . 2]" 1
1248 4 15 ARG H 4 16 ILE MD 3.360 . 4.920 3.554 2.908 4.651 . 0 0 "[ . 1 . 2]" 1
1249 4 15 ARG H 4 83 ILE H 2.540 . 3.280 3.131 2.829 3.304 0.024 3 0 "[ . 1 . 2]" 1
1250 4 16 ILE H 4 17 TYR H 3.220 . 4.640 4.341 4.171 4.451 . 0 0 "[ . 1 . 2]" 1
1251 4 16 ILE MD 4 109 TYR QD 3.390 . 4.980 4.662 3.415 5.510 0.530 18 1 "[ . 1 . + 2]" 1
1252 4 16 ILE MD 4 109 TYR QE 2.940 . 4.080 4.203 2.584 5.310 1.230 1 7 "[+ .* 1 * ** -*2]" 1
1253 4 17 TYR H 4 18 THR H 3.150 . 4.500 4.327 4.219 4.388 . 0 0 "[ . 1 . 2]" 1
1254 4 17 TYR H 4 81 GLY H 2.710 . 3.620 3.917 3.773 4.047 0.427 6 0 "[ . 1 . 2]" 1
1255 4 17 TYR QD 4 18 THR H 3.200 . 4.600 3.877 3.227 4.566 . 0 0 "[ . 1 . 2]" 1
1256 4 17 TYR QD 4 81 GLY H 3.410 . 5.020 4.273 3.368 5.254 0.234 16 0 "[ . 1 . 2]" 1
1257 4 17 TYR QE 4 83 ILE MD 3.160 . 4.520 2.713 2.236 3.297 . 0 0 "[ . 1 . 2]" 1
1258 4 18 THR H 4 19 LYS H 3.290 . 4.780 4.358 4.265 4.429 . 0 0 "[ . 1 . 2]" 1
1259 4 18 THR H 4 81 GLY H 3.510 . 5.220 4.989 4.864 5.117 . 0 0 "[ . 1 . 2]" 1
1260 4 19 LYS H 4 20 ASP H 2.090 . 2.380 2.272 2.197 2.367 . 0 0 "[ . 1 . 2]" 1
1261 4 19 LYS H 4 79 GLN H 2.930 . 4.060 4.938 4.630 5.171 1.111 10 20 [***-*****+**********] 1
1262 4 19 LYS H 4 80 GLN H 3.360 . 4.920 5.074 4.905 5.363 0.443 14 0 "[ . 1 . 2]" 1
1263 4 19 LYS H 4 81 GLY H 2.780 . 3.760 2.692 2.443 2.972 . 0 0 "[ . 1 . 2]" 1
1264 4 20 ASP H 4 21 ILE H 3.160 . 4.520 4.182 4.076 4.322 . 0 0 "[ . 1 . 2]" 1
1265 4 20 ASP H 4 79 GLN H 2.470 . 3.140 3.521 3.263 3.688 0.548 14 3 "[ . * +.- 2]" 1
1266 4 21 ILE H 4 22 SER H 3.200 . 4.600 4.282 4.194 4.324 . 0 0 "[ . 1 . 2]" 1
1267 4 21 ILE MD 4 78 VAL MG1 3.430 . 5.060 3.457 3.256 3.715 . 0 0 "[ . 1 . 2]" 1
1268 4 22 SER H 4 23 PHE H 3.170 . 4.540 4.154 3.866 4.254 . 0 0 "[ . 1 . 2]" 1
1269 4 22 SER H 4 77 GLU H 2.380 . 2.960 3.140 2.800 3.454 0.494 10 0 "[ . 1 . 2]" 1
1270 4 22 SER H 4 78 VAL H 3.510 . 5.220 5.002 4.870 5.127 . 0 0 "[ . 1 . 2]" 1
1271 4 22 SER H 4 78 VAL MG2 3.230 . 4.660 3.168 2.813 3.391 . 0 0 "[ . 1 . 2]" 1
1272 4 22 SER H 4 117 MET ME 3.400 . 5.000 3.214 2.653 3.495 . 0 0 "[ . 1 . 2]" 1
1273 4 23 PHE H 4 24 GLU H 3.020 . 4.240 4.061 3.841 4.311 0.071 15 0 "[ . 1 . 2]" 1
1274 4 23 PHE QD 4 24 GLU H 2.840 . 3.880 3.712 3.376 4.056 0.176 17 0 "[ . 1 . 2]" 1
1275 4 23 PHE QE 4 24 GLU H 3.500 . 5.200 4.742 4.279 5.153 . 0 0 "[ . 1 . 2]" 1
1276 4 23 PHE QE 4 25 ALA MB 3.450 . 5.100 2.813 2.514 3.108 . 0 0 "[ . 1 . 2]" 1
1277 4 23 PHE QE 4 74 PHE QD 3.510 . 5.220 2.639 2.349 2.991 . 0 0 "[ . 1 . 2]" 1
1278 4 23 PHE QE 4 121 GLY H 3.390 . 4.980 4.176 3.830 4.503 . 0 0 "[ . 1 . 2]" 1
1279 4 24 GLU H 4 25 ALA H 3.230 . 4.660 4.213 3.998 4.407 . 0 0 "[ . 1 . 2]" 1
1280 4 24 GLU H 4 75 LEU H 2.480 . 3.160 3.181 2.759 3.412 0.252 14 0 "[ . 1 . 2]" 1
1281 4 24 GLU H 4 76 CYS H 3.500 . 5.200 4.740 4.478 4.992 . 0 0 "[ . 1 . 2]" 1
1282 4 25 ALA MB 4 28 ALA H 3.250 . 4.700 3.477 3.096 3.856 . 0 0 "[ . 1 . 2]" 1
1283 4 25 ALA MB 4 28 ALA MB 2.840 . 3.880 1.883 1.696 2.114 0.104 6 0 "[ . 1 . 2]" 1
1284 4 27 ASN H 4 28 ALA H 2.510 . 3.220 2.737 2.418 3.116 . 0 0 "[ . 1 . 2]" 1
1285 4 28 ALA H 4 30 HIS H 2.890 . 3.990 4.195 3.856 4.568 0.578 10 2 "[ . + . -2]" 1
1286 4 28 ALA H 4 31 VAL H 3.330 . 4.860 4.796 4.659 4.906 0.046 17 0 "[ . 1 . 2]" 1
1287 4 28 ALA MB 4 30 HIS H 3.510 . 5.220 4.292 4.150 4.464 . 0 0 "[ . 1 . 2]" 1
1288 4 30 HIS H 4 31 VAL H 2.230 . 2.660 2.420 2.261 2.653 . 0 0 "[ . 1 . 2]" 1
1289 4 30 HIS H 4 32 PHE H 2.920 . 4.040 3.820 3.584 4.012 . 0 0 "[ . 1 . 2]" 1
1290 4 31 VAL H 4 32 PHE H 2.280 . 2.760 2.474 2.319 2.674 . 0 0 "[ . 1 . 2]" 1
1291 4 31 VAL H 4 33 GLN H 3.190 . 4.580 4.225 4.033 4.391 . 0 0 "[ . 1 . 2]" 1
1292 4 31 VAL MG1 4 32 PHE H 3.160 . 4.520 3.319 2.808 4.264 . 0 0 "[ . 1 . 2]" 1
1293 4 31 VAL MG1 4 34 LYS H 3.400 . 5.000 4.425 3.916 5.008 0.008 12 0 "[ . 1 . 2]" 1
1294 4 31 VAL MG1 4 68 LEU MD1 2.290 . 2.780 2.346 1.689 3.200 0.420 19 0 "[ . 1 . 2]" 1
1295 4 31 VAL MG1 4 73 ALA MB 3.430 . 5.060 3.178 2.454 3.704 . 0 0 "[ . 1 . 2]" 1
1296 4 31 VAL MG1 4 123 PHE QE 3.340 . 4.880 2.325 1.665 4.424 0.135 18 0 "[ . 1 . 2]" 1
1297 4 31 VAL MG2 4 32 PHE H 3.440 . 5.080 4.116 2.867 4.417 . 0 0 "[ . 1 . 2]" 1
1298 4 31 VAL MG2 4 68 LEU MD1 2.960 . 4.120 2.266 1.677 3.470 0.123 19 0 "[ . 1 . 2]" 1
1299 4 31 VAL MG2 4 73 ALA MB 3.380 . 4.960 3.017 2.362 3.606 . 0 0 "[ . 1 . 2]" 1
1300 4 32 PHE H 4 33 GLN H 2.360 . 2.920 2.727 2.617 2.968 0.048 4 0 "[ . 1 . 2]" 1
1301 4 32 PHE H 4 34 LYS H 3.090 . 4.380 4.155 3.813 4.508 0.128 20 0 "[ . 1 . 2]" 1
1302 4 32 PHE QD 4 33 GLN H 3.080 . 4.360 3.963 3.436 4.798 0.438 2 0 "[ . 1 . 2]" 1
1303 4 33 GLN H 4 34 LYS H 2.210 . 2.620 2.572 2.337 2.768 0.148 20 0 "[ . 1 . 2]" 1
1304 4 34 LYS H 4 35 ASP H 3.180 . 4.560 4.075 3.693 4.340 . 0 0 "[ . 1 . 2]" 1
1305 4 35 ASP H 4 36 TRP H 2.970 . 4.140 3.588 3.126 4.179 0.039 10 0 "[ . 1 . 2]" 1
1306 4 35 ASP H 4 36 TRP HE1 2.450 . 3.100 5.289 2.841 9.445 6.345 10 14 "[*** * -* + ***** **]" 1
1307 4 36 TRP H 4 37 GLN H 3.220 . 4.640 4.426 4.323 4.501 . 0 0 "[ . 1 . 2]" 1
1308 4 36 TRP H 4 68 LEU MD2 2.660 . 3.520 2.670 2.255 2.894 . 0 0 "[ . 1 . 2]" 1
1309 4 36 TRP HE3 4 37 GLN H 2.990 . 4.180 4.495 3.050 5.902 1.722 16 6 "[ * * 1 * *.+ -2]" 1
1310 4 37 GLN H 4 68 LEU MD2 3.190 . 4.580 3.919 3.483 4.643 0.063 5 0 "[ . 1 . 2]" 1
1311 4 39 GLU H 4 40 VAL H 3.330 . 4.860 4.467 4.390 4.604 . 0 0 "[ . 1 . 2]" 1
1312 4 39 GLU H 4 67 SER H 2.260 . 2.730 3.137 2.841 3.474 0.744 2 8 "[*+*** 1 -* *]" 1
1313 4 40 VAL H 4 41 LYS H 3.090 . 4.380 4.273 4.110 4.475 0.095 2 0 "[ . 1 . 2]" 1
1314 4 40 VAL QG 4 41 LYS H 2.940 . 4.080 3.326 2.871 3.706 . 0 0 "[ . 1 . 2]" 1
1315 4 40 VAL QG 4 42 LEU MD1 3.410 . 5.020 2.843 1.847 4.948 . 0 0 "[ . 1 . 2]" 1
1316 4 40 VAL QG 4 42 LEU MD2 3.360 . 4.920 3.392 1.843 4.348 . 0 0 "[ . 1 . 2]" 1
1317 4 40 VAL QG 4 64 VAL MG1 3.260 . 4.720 2.154 1.605 2.735 0.195 7 0 "[ . 1 . 2]" 1
1318 4 40 VAL QG 4 126 LEU MD1 2.410 . 3.020 1.951 1.678 2.309 0.122 5 0 "[ . 1 . 2]" 1
1319 4 40 VAL QG 4 126 LEU MD2 . . 3.100 2.261 1.767 3.730 0.630 3 1 "[ + . 1 . 2]" 1
1320 4 40 VAL QG 4 128 LEU QD 2.670 . 3.540 2.912 2.211 3.561 0.021 8 0 "[ . 1 . 2]" 1
1321 4 41 LYS H 4 42 LEU H 3.160 . 4.520 4.333 4.213 4.510 . 0 0 "[ . 1 . 2]" 1
1322 4 41 LYS H 4 64 VAL MG1 3.200 . 4.600 3.884 3.290 4.417 . 0 0 "[ . 1 . 2]" 1
1323 4 41 LYS H 4 65 THR H 2.490 . 3.180 3.165 2.481 3.758 0.578 15 2 "[ - . 1 + 2]" 1
1324 4 41 LYS H 4 66 ALA H 3.510 . 5.220 4.696 4.503 5.067 . 0 0 "[ . 1 . 2]" 1
1325 4 42 LEU H 4 43 ASP H 3.280 . 4.760 4.410 4.277 4.566 . 0 0 "[ . 1 . 2]" 1
1326 4 42 LEU MD2 4 128 LEU QD 2.600 . 3.400 1.952 1.580 2.640 0.220 2 0 "[ . 1 . 2]" 1
1327 4 43 ASP H 4 44 LEU H 3.020 . 4.240 4.347 4.077 4.512 0.272 19 0 "[ . 1 . 2]" 1
1328 4 43 ASP H 4 62 VAL MG1 3.500 . 5.200 4.342 3.689 4.852 . 0 0 "[ . 1 . 2]" 1
1329 4 43 ASP H 4 63 THR H 2.580 . 3.360 3.090 2.618 3.540 0.180 2 0 "[ . 1 . 2]" 1
1330 4 44 LEU H 4 45 ASP H 3.290 . 4.780 4.401 4.228 4.471 . 0 0 "[ . 1 . 2]" 1
1331 4 44 LEU QD 4 45 ASP H 2.420 . 3.040 2.611 2.293 4.211 1.171 3 1 "[ + . 1 . 2]" 1
1332 4 44 LEU QD 4 60 LEU MD2 3.010 . 4.220 2.130 1.804 3.071 . 0 0 "[ . 1 . 2]" 1
1333 4 44 LEU QD 4 133 PHE QE 3.270 . 4.740 4.061 2.191 6.977 2.237 19 5 "[ * .* 1* . +-]" 1
1334 4 45 ASP H 4 46 THR H 3.050 . 4.300 4.341 4.073 4.415 0.115 3 0 "[ . 1 . 2]" 1
1335 4 45 ASP H 4 60 LEU MD2 2.970 . 4.140 3.237 2.818 3.538 . 0 0 "[ . 1 . 2]" 1
1336 4 45 ASP H 4 61 ARG H 2.720 . 3.640 3.503 2.929 3.906 0.266 1 0 "[ . 1 . 2]" 1
1337 4 46 THR H 4 47 ALA H 3.280 . 4.760 4.387 4.317 4.463 . 0 0 "[ . 1 . 2]" 1
1338 4 47 ALA H 4 48 SER H 3.190 . 4.580 4.362 4.318 4.384 . 0 0 "[ . 1 . 2]" 1
1339 4 47 ALA H 4 58 VAL QG 3.410 . 5.020 3.499 3.078 4.593 . 0 0 "[ . 1 . 2]" 1
1340 4 47 ALA H 4 59 VAL H 2.550 . 3.300 3.131 2.948 3.479 0.179 4 0 "[ . 1 . 2]" 1
1341 4 47 ALA H 4 98 LEU QD 2.930 . 4.060 5.729 4.363 7.601 3.541 4 18 "[***+***********- **]" 1
1342 4 47 ALA MB 4 48 SER H 2.370 . 2.940 2.401 2.180 2.875 . 0 0 "[ . 1 . 2]" 1
1343 4 47 ALA MB 4 59 VAL H 2.430 . 3.060 3.414 2.945 4.006 0.946 7 5 "[ * *. + - . *]" 1
1344 4 47 ALA MB 4 59 VAL MG2 3.210 . 4.620 3.066 2.638 3.634 . 0 0 "[ . 1 . 2]" 1
1345 4 48 SER H 4 49 SER H 3.180 . 4.560 4.347 4.305 4.397 . 0 0 "[ . 1 . 2]" 1
1346 4 48 SER H 4 59 VAL H 3.060 . 4.320 4.548 4.223 4.868 0.548 7 2 "[ . + 1 .- 2]" 1
1347 4 49 SER H 4 50 GLN H 2.950 . 4.100 4.162 4.000 4.322 0.222 15 0 "[ . 1 . 2]" 1
1348 4 49 SER H 4 56 TYR QD 2.890 . 3.990 3.604 2.480 4.350 0.360 4 0 "[ . 1 . 2]" 1
1349 4 49 SER H 4 56 TYR QE 3.230 . 4.660 5.196 2.863 6.306 1.646 20 14 "[* ****- *1** .****+]" 1
1350 4 49 SER H 4 57 GLU H 2.380 . 2.960 3.152 2.716 3.435 0.475 9 0 "[ . 1 . 2]" 1
1351 4 50 GLN H 4 51 LEU H 3.270 . 4.740 4.496 4.427 4.593 . 0 0 "[ . 1 . 2]" 1
1352 4 50 GLN H 4 56 TYR QD 3.480 . 5.160 4.441 3.330 5.820 0.660 17 1 "[ . 1 . + 2]" 1
1353 4 50 GLN H 4 56 TYR QE 2.970 . 4.140 5.097 3.209 7.638 3.498 17 7 "[* .* 1**- .*+ 2]" 1
1354 4 50 GLN H 4 57 GLU H 3.490 . 5.180 5.049 4.792 5.303 0.123 15 0 "[ . 1 . 2]" 1
1355 4 51 LEU H 4 52 ALA H 1.940 . 2.080 2.170 2.039 2.275 0.195 2 0 "[ . 1 . 2]" 1
1356 4 51 LEU H 4 55 VAL H 3.350 . 4.900 4.819 4.589 5.092 0.192 14 0 "[ . 1 . 2]" 1
1357 4 51 LEU H 4 55 VAL MG1 3.430 . 5.060 3.363 2.971 3.916 . 0 0 "[ . 1 . 2]" 1
1358 4 51 LEU H 4 57 GLU H 3.080 . 4.360 3.686 3.354 4.037 . 0 0 "[ . 1 . 2]" 1
1359 4 51 LEU MD1 4 55 VAL MG1 3.250 . 4.700 2.621 2.247 2.983 . 0 0 "[ . 1 . 2]" 1
1360 4 51 LEU MD1 4 57 GLU H 3.160 . 4.520 3.514 3.090 4.068 . 0 0 "[ . 1 . 2]" 1
1361 4 51 LEU MD1 4 83 ILE MD 3.150 . 4.500 2.400 2.139 2.552 . 0 0 "[ . 1 . 2]" 1
1362 4 51 LEU MD2 4 57 GLU H 3.380 . 4.960 3.480 3.137 3.960 . 0 0 "[ . 1 . 2]" 1
1363 4 52 ALA H 4 53 ASP H 3.170 . 4.540 4.335 4.306 4.362 . 0 0 "[ . 1 . 2]" 1
1364 4 52 ALA H 4 55 VAL H 2.920 . 4.040 3.613 3.411 4.032 . 0 0 "[ . 1 . 2]" 1
1365 4 52 ALA H 4 55 VAL MG1 3.170 . 4.540 3.326 2.975 3.642 . 0 0 "[ . 1 . 2]" 1
1366 4 52 ALA MB 4 53 ASP H 2.310 . 2.820 1.907 1.806 2.105 . 0 0 "[ . 1 . 2]" 1
1367 4 52 ALA MB 4 55 VAL MG1 3.480 . 5.160 3.027 2.781 3.315 . 0 0 "[ . 1 . 2]" 1
1368 4 52 ALA MB 4 55 VAL MG2 3.130 . 4.460 2.545 2.342 2.734 . 0 0 "[ . 1 . 2]" 1
1369 4 53 ASP H 4 54 ASP H 3.260 . 4.720 4.492 4.326 4.601 . 0 0 "[ . 1 . 2]" 1
1370 4 53 ASP H 4 55 VAL H 3.380 . 4.960 4.263 3.978 4.573 . 0 0 "[ . 1 . 2]" 1
1371 4 53 ASP H 4 55 VAL MG2 3.470 . 5.140 4.149 3.829 4.526 . 0 0 "[ . 1 . 2]" 1
1372 4 54 ASP H 4 55 VAL H 2.310 . 2.820 2.715 2.503 2.791 . 0 0 "[ . 1 . 2]" 1
1373 4 55 VAL H 4 56 TYR H 2.970 . 4.140 4.276 4.135 4.407 0.267 11 0 "[ . 1 . 2]" 1
1374 4 55 VAL MG1 4 56 TYR H 2.950 . 4.100 2.759 2.565 2.872 . 0 0 "[ . 1 . 2]" 1
1375 4 56 TYR H 4 57 GLU H 3.220 . 4.640 4.264 4.115 4.392 . 0 0 "[ . 1 . 2]" 1
1376 4 56 TYR H 4 84 PHE H 3.010 . 4.220 3.380 3.078 3.714 . 0 0 "[ . 1 . 2]" 1
1377 4 56 TYR H 4 86 ILE H 2.840 . 3.880 3.957 3.228 4.571 0.691 15 5 "[ .** 1-* + 2]" 1
1378 4 56 TYR QD 4 57 GLU H 2.970 . 4.140 3.936 2.958 4.481 0.341 18 0 "[ . 1 . 2]" 1
1379 4 57 GLU H 4 58 VAL H 3.220 . 4.640 4.377 4.221 4.508 . 0 0 "[ . 1 . 2]" 1
1380 4 57 GLU H 4 84 PHE H 3.500 . 5.200 4.714 4.407 5.019 . 0 0 "[ . 1 . 2]" 1
1381 4 58 VAL H 4 59 VAL H 3.280 . 4.760 4.368 4.240 4.497 . 0 0 "[ . 1 . 2]" 1
1382 4 58 VAL H 4 82 GLY H 2.650 . 3.500 3.292 2.649 3.732 0.232 20 0 "[ . 1 . 2]" 1
1383 4 58 VAL H 4 84 PHE H 2.940 . 4.080 4.040 3.676 4.476 0.396 3 0 "[ . 1 . 2]" 1
1384 4 58 VAL QG 4 59 VAL H 3.330 . 4.500 2.783 2.394 3.478 . 0 0 "[ . 1 . 2]" 1
1385 4 58 VAL QG 4 82 GLY H 2.840 . 3.880 4.399 3.527 4.579 0.699 10 13 "[ - * ** + ********]" 1
1386 4 58 VAL QG 4 84 PHE QD 3.410 . 5.020 2.336 1.988 2.583 . 0 0 "[ . 1 . 2]" 1
1387 4 58 VAL QG 4 84 PHE QE 3.050 . 4.300 3.024 1.830 3.331 . 0 0 "[ . 1 . 2]" 1
1388 4 58 VAL QG 4 98 LEU QD 2.980 . 4.160 2.579 1.853 4.468 0.308 13 0 "[ . 1 . 2]" 1
1389 4 59 VAL H 4 60 LEU H 3.170 . 4.540 4.443 4.380 4.531 . 0 0 "[ . 1 . 2]" 1
1390 4 59 VAL MG1 4 60 LEU H 2.760 . 3.720 2.522 2.247 2.695 . 0 0 "[ . 1 . 2]" 1
1391 4 59 VAL MG2 4 60 LEU H 3.470 . 5.140 4.130 4.070 4.206 . 0 0 "[ . 1 . 2]" 1
1392 4 60 LEU H 4 61 ARG H 3.230 . 4.660 4.306 4.174 4.380 . 0 0 "[ . 1 . 2]" 1
1393 4 60 LEU H 4 80 GLN H 3.010 . 4.220 3.542 3.299 3.913 . 0 0 "[ . 1 . 2]" 1
1394 4 60 LEU H 4 81 GLY H 3.170 . 4.540 4.557 4.393 4.836 0.296 10 0 "[ . 1 . 2]" 1
1395 4 60 LEU H 4 82 GLY H 3.220 . 4.640 4.914 4.524 5.301 0.661 7 5 "[ * . + * * - 2]" 1
1396 4 60 LEU MD1 4 62 VAL MG2 2.610 . 3.420 2.167 1.742 2.510 0.058 16 0 "[ . 1 . 2]" 1
1397 4 60 LEU MD1 4 110 ALA H 3.200 . 4.600 4.294 4.029 4.591 . 0 0 "[ . 1 . 2]" 1
1398 4 60 LEU MD1 4 110 ALA MB 2.680 . 3.560 2.483 2.224 2.844 . 0 0 "[ . 1 . 2]" 1
1399 4 60 LEU MD1 4 111 ARG H 3.490 . 5.180 4.920 4.679 5.361 0.181 16 0 "[ . 1 . 2]" 1
1400 4 60 LEU MD2 4 61 ARG H 2.300 . 2.800 2.225 2.089 2.608 . 0 0 "[ . 1 . 2]" 1
1401 4 60 LEU MD2 4 62 VAL H 3.140 . 4.480 3.281 2.968 4.209 . 0 0 "[ . 1 . 2]" 1
1402 4 60 LEU MD2 4 62 VAL MG2 2.500 . 3.200 2.127 1.926 3.061 . 0 0 "[ . 1 . 2]" 1
1403 4 61 ARG H 4 62 VAL H 3.020 . 4.240 4.079 3.973 4.274 0.034 1 0 "[ . 1 . 2]" 1
1404 4 61 ARG H 4 62 VAL MG2 3.460 . 5.120 4.355 4.123 4.511 . 0 0 "[ . 1 . 2]" 1
1405 4 62 VAL H 4 63 THR H 3.090 . 4.380 4.350 4.111 4.451 0.071 7 0 "[ . 1 . 2]" 1
1406 4 62 VAL H 4 78 VAL H 2.920 . 4.040 3.366 3.119 3.635 . 0 0 "[ . 1 . 2]" 1
1407 4 62 VAL H 4 80 GLN H 3.130 . 4.460 4.019 3.820 4.272 . 0 0 "[ . 1 . 2]" 1
1408 4 62 VAL MG1 4 63 THR H 2.990 . 4.180 2.873 2.549 3.294 . 0 0 "[ . 1 . 2]" 1
1409 4 62 VAL MG1 4 64 VAL MG2 2.920 . 4.040 2.637 2.312 3.053 . 0 0 "[ . 1 . 2]" 1
1410 4 62 VAL MG1 4 114 ILE MD 2.730 . 3.660 1.998 1.880 2.206 . 0 0 "[ . 1 . 2]" 1
1411 4 62 VAL MG1 4 128 LEU QD 3.220 . 4.640 2.692 2.028 4.416 . 0 0 "[ . 1 . 2]" 1
1412 4 62 VAL MG2 4 110 ALA MB 2.980 . 4.160 2.000 1.572 2.216 0.228 14 0 "[ . 1 . 2]" 1
1413 4 63 THR H 4 64 VAL H 3.280 . 4.760 4.383 4.229 4.511 . 0 0 "[ . 1 . 2]" 1
1414 4 64 VAL H 4 65 THR H 2.960 . 4.120 3.996 3.728 4.307 0.187 13 0 "[ . 1 . 2]" 1
1415 4 64 VAL H 4 76 CYS H 2.860 . 3.920 3.400 3.097 3.618 . 0 0 "[ . 1 . 2]" 1
1416 4 64 VAL MG1 4 65 THR H 3.000 . 4.200 3.273 2.657 3.554 . 0 0 "[ . 1 . 2]" 1
1417 4 64 VAL MG1 4 66 ALA H 3.460 . 5.120 3.252 2.856 3.948 . 0 0 "[ . 1 . 2]" 1
1418 4 64 VAL MG1 4 66 ALA MB 3.470 . 5.140 2.539 1.986 3.111 . 0 0 "[ . 1 . 2]" 1
1419 4 64 VAL MG1 4 74 PHE QE 3.430 . 5.060 2.397 2.152 2.739 . 0 0 "[ . 1 . 2]" 1
1420 4 64 VAL MG1 4 126 LEU MD1 2.980 . 4.160 3.962 2.578 5.076 0.916 11 2 "[ -. 1+ . 2]" 1
1421 4 64 VAL MG2 4 114 ILE MD 2.750 . 3.700 1.879 1.722 2.066 0.078 3 0 "[ . 1 . 2]" 1
1422 4 64 VAL MG2 4 128 LEU QD 3.470 . 5.140 2.839 2.119 4.564 . 0 0 "[ . 1 . 2]" 1
1423 4 65 THR H 4 66 ALA H 3.140 . 4.480 4.057 3.836 4.409 . 0 0 "[ . 1 . 2]" 1
1424 4 66 ALA H 4 67 SER H 3.250 . 4.700 4.515 4.397 4.594 . 0 0 "[ . 1 . 2]" 1
1425 4 66 ALA H 4 74 PHE H 2.860 . 3.920 3.556 3.237 3.735 . 0 0 "[ . 1 . 2]" 1
1426 4 66 ALA H 4 74 PHE QD 3.360 . 4.920 4.374 3.977 4.573 . 0 0 "[ . 1 . 2]" 1
1427 4 66 ALA H 4 74 PHE QE 3.340 . 4.880 4.827 4.439 5.031 0.151 16 0 "[ . 1 . 2]" 1
1428 4 66 ALA H 4 75 LEU MD2 3.180 . 4.560 3.003 2.781 3.261 . 0 0 "[ . 1 . 2]" 1
1429 4 66 ALA H 4 76 CYS H 3.440 . 5.080 4.547 3.952 4.947 . 0 0 "[ . 1 . 2]" 1
1430 4 66 ALA MB 4 67 SER H 2.760 . 3.720 2.910 2.716 3.151 . 0 0 "[ . 1 . 2]" 1
1431 4 66 ALA MB 4 73 ALA MB 3.140 . 4.480 2.334 2.112 2.538 . 0 0 "[ . 1 . 2]" 1
1432 4 66 ALA MB 4 74 PHE H 3.200 . 4.600 2.385 1.921 2.897 . 0 0 "[ . 1 . 2]" 1
1433 4 66 ALA MB 4 74 PHE QD 3.170 . 4.540 2.962 2.187 3.131 . 0 0 "[ . 1 . 2]" 1
1434 4 66 ALA MB 4 74 PHE QE 2.630 . 3.460 2.799 2.020 2.912 . 0 0 "[ . 1 . 2]" 1
1435 4 67 SER H 4 68 LEU H 3.200 . 4.600 4.242 4.105 4.367 . 0 0 "[ . 1 . 2]" 1
1436 4 67 SER H 4 73 ALA H 3.290 . 4.780 4.063 3.926 4.268 . 0 0 "[ . 1 . 2]" 1
1437 4 67 SER H 4 73 ALA MB 3.130 . 4.460 3.338 3.139 3.491 . 0 0 "[ . 1 . 2]" 1
1438 4 68 LEU H 4 69 GLY H 3.190 . 4.580 4.187 3.948 4.371 . 0 0 "[ . 1 . 2]" 1
1439 4 68 LEU H 4 71 GLU H 2.770 . 3.740 4.030 3.553 4.334 0.594 14 2 "[ . 1 -+. 2]" 1
1440 4 68 LEU H 4 73 ALA H 2.720 . 3.640 3.054 2.747 3.500 . 0 0 "[ . 1 . 2]" 1
1441 4 68 LEU H 4 73 ALA MB 2.930 . 4.060 2.469 2.247 2.984 . 0 0 "[ . 1 . 2]" 1
1442 4 68 LEU MD1 4 73 ALA MB 2.620 . 3.440 2.228 1.828 2.652 . 0 0 "[ . 1 . 2]" 1
1443 4 69 GLY H 4 70 GLU H 3.230 . 4.660 4.486 4.381 4.623 . 0 0 "[ . 1 . 2]" 1
1444 4 69 GLY H 4 71 GLU H 3.450 . 5.100 4.573 4.255 4.823 . 0 0 "[ . 1 . 2]" 1
1445 4 70 GLU H 4 71 GLU H 2.420 . 3.040 2.474 2.112 3.153 0.113 16 0 "[ . 1 . 2]" 1
1446 4 71 GLU H 4 72 THR H 3.200 . 4.600 4.445 4.308 4.520 . 0 0 "[ . 1 . 2]" 1
1447 4 72 THR H 4 73 ALA H 3.250 . 4.700 4.525 4.416 4.584 . 0 0 "[ . 1 . 2]" 1
1448 4 73 ALA H 4 74 PHE H 2.280 . 2.760 2.573 2.357 2.778 0.018 19 0 "[ . 1 . 2]" 1
1449 4 73 ALA H 4 75 LEU MD2 3.470 . 5.140 4.663 4.367 5.150 0.010 19 0 "[ . 1 . 2]" 1
1450 4 73 ALA MB 4 74 PHE H 2.460 . 3.120 2.058 1.944 2.212 . 0 0 "[ . 1 . 2]" 1
1451 4 73 ALA MB 4 74 PHE QD 3.380 . 4.960 2.613 2.294 3.156 . 0 0 "[ . 1 . 2]" 1
1452 4 73 ALA MB 4 123 PHE QE 3.430 . 5.060 3.662 2.591 4.787 . 0 0 "[ . 1 . 2]" 1
1453 4 74 PHE H 4 75 LEU H 3.070 . 4.340 4.283 4.211 4.359 0.019 2 0 "[ . 1 . 2]" 1
1454 4 74 PHE H 4 75 LEU MD2 2.970 . 4.140 4.098 3.820 4.398 0.258 18 0 "[ . 1 . 2]" 1
1455 4 74 PHE QD 4 75 LEU H 3.190 . 4.580 3.620 3.015 4.094 . 0 0 "[ . 1 . 2]" 1
1456 4 74 PHE QD 4 123 PHE QD 3.090 . 4.380 3.334 2.780 4.151 . 0 0 "[ . 1 . 2]" 1
1457 4 74 PHE QD 4 123 PHE QE 3.050 . 4.300 3.545 3.121 3.987 . 0 0 "[ . 1 . 2]" 1
1458 4 74 PHE QE 4 118 VAL MG1 3.120 . 4.440 3.002 2.848 3.368 . 0 0 "[ . 1 . 2]" 1
1459 4 74 PHE QE 4 118 VAL MG2 3.050 . 4.300 2.310 2.001 2.684 . 0 0 "[ . 1 . 2]" 1
1460 4 74 PHE QE 4 123 PHE QD 3.380 . 4.960 3.720 3.417 4.502 . 0 0 "[ . 1 . 2]" 1
1461 4 75 LEU H 4 76 CYS H 3.260 . 4.720 4.382 3.831 4.538 . 0 0 "[ . 1 . 2]" 1
1462 4 76 CYS H 4 77 GLU H 3.170 . 4.540 4.246 3.774 4.544 0.004 15 0 "[ . 1 . 2]" 1
1463 4 77 GLU H 4 78 VAL H 3.040 . 4.280 4.153 4.034 4.281 0.001 10 0 "[ . 1 . 2]" 1
1464 4 77 GLU H 4 78 VAL MG2 3.130 . 4.460 3.444 3.344 3.795 . 0 0 "[ . 1 . 2]" 1
1465 4 77 GLU H 4 117 MET ME 3.370 . 4.940 3.468 3.112 3.817 . 0 0 "[ . 1 . 2]" 1
1466 4 78 VAL H 4 79 GLN H 3.210 . 4.620 4.119 4.059 4.344 . 0 0 "[ . 1 . 2]" 1
1467 4 78 VAL H 4 114 ILE MD 3.170 . 4.540 3.362 2.764 3.783 . 0 0 "[ . 1 . 2]" 1
1468 4 78 VAL MG1 4 79 GLN H 2.470 . 3.150 3.024 2.439 3.146 . 0 0 "[ . 1 . 2]" 1
1469 4 78 VAL MG1 4 80 GLN H 2.950 . 4.100 2.890 2.725 3.088 . 0 0 "[ . 1 . 2]" 1
1470 4 78 VAL MG1 4 110 ALA MB 3.440 . 5.080 3.419 3.119 3.664 . 0 0 "[ . 1 . 2]" 1
1471 4 78 VAL MG2 4 79 GLN H 3.410 . 5.020 4.200 3.974 4.271 . 0 0 "[ . 1 . 2]" 1
1472 4 78 VAL MG2 4 114 ILE H 2.830 . 3.860 3.010 2.747 3.227 . 0 0 "[ . 1 . 2]" 1
1473 4 78 VAL MG2 4 114 ILE MD 3.190 . 4.580 3.110 2.931 3.301 . 0 0 "[ . 1 . 2]" 1
1474 4 78 VAL MG2 4 117 MET ME 2.600 . 3.400 2.156 1.984 2.279 . 0 0 "[ . 1 . 2]" 1
1475 4 79 GLN H 4 80 GLN H 2.830 . 3.860 3.933 3.835 4.016 0.156 16 0 "[ . 1 . 2]" 1
1476 4 80 GLN H 4 81 GLY H 3.220 . 4.640 4.238 4.142 4.347 . 0 0 "[ . 1 . 2]" 1
1477 4 80 GLN H 4 110 ALA MB 2.960 . 4.120 3.737 3.433 4.012 . 0 0 "[ . 1 . 2]" 1
1478 4 81 GLY H 4 82 GLY H 3.280 . 4.760 4.567 4.520 4.606 . 0 0 "[ . 1 . 2]" 1
1479 4 82 GLY H 4 83 ILE H 3.170 . 4.540 4.224 4.117 4.310 . 0 0 "[ . 1 . 2]" 1
1480 4 82 GLY H 4 84 PHE QE 3.460 . 5.120 3.999 3.579 4.344 . 0 0 "[ . 1 . 2]" 1
1481 4 83 ILE H 4 84 PHE H 3.210 . 4.620 4.466 4.299 4.535 . 0 0 "[ . 1 . 2]" 1
1482 4 84 PHE H 4 85 SER H 3.260 . 4.720 4.327 4.200 4.451 . 0 0 "[ . 1 . 2]" 1
1483 4 84 PHE QD 4 85 SER H 3.280 . 4.760 4.199 3.834 4.513 . 0 0 "[ . 1 . 2]" 1
1484 4 85 SER H 4 86 ILE H 3.170 . 4.540 4.250 4.004 4.556 0.016 15 0 "[ . 1 . 2]" 1
1485 4 86 ILE H 4 87 ALA H 3.230 . 4.660 4.394 4.118 4.499 . 0 0 "[ . 1 . 2]" 1
1486 4 86 ILE MD 4 87 ALA H 3.010 . 4.220 4.255 3.088 5.380 1.160 5 6 "[ + ** -* . * 2]" 1
1487 4 86 ILE MD 4 88 GLY H 3.280 . 4.760 5.888 4.446 7.686 2.926 18 12 "[ - ***** *** ** + 2]" 1
1488 4 86 ILE MD 4 89 ILE H 3.060 . 4.320 5.210 3.814 7.672 3.352 18 13 "[ * ***** *** -** + 2]" 1
1489 4 86 ILE MD 4 89 ILE MD 2.700 . 3.600 2.677 1.719 5.044 1.444 18 3 "[ . - 1 * . + 2]" 1
1490 4 86 ILE MD 4 94 MET ME 2.630 . 3.460 3.019 1.892 7.095 3.635 18 4 "[ *. 1 . +*-]" 1
1491 4 87 ALA H 4 88 GLY H 3.020 . 4.240 4.343 4.266 4.388 0.148 5 0 "[ . 1 . 2]" 1
1492 4 87 ALA H 4 89 ILE H 3.170 . 4.540 4.467 3.798 4.951 0.411 18 0 "[ . 1 . 2]" 1
1493 4 87 ALA MB 4 88 GLY H 2.900 . 4.000 2.505 2.265 2.883 . 0 0 "[ . 1 . 2]" 1
1494 4 88 GLY H 4 89 ILE H 2.050 . 2.300 2.585 2.342 2.962 0.662 11 3 "[ . - 1+* . 2]" 1
1495 4 89 ILE H 4 90 GLU H 3.230 . 4.660 4.472 4.350 4.564 . 0 0 "[ . 1 . 2]" 1
1496 4 89 ILE H 4 94 MET ME 3.380 . 4.960 5.857 3.673 7.080 2.120 12 16 "[*** **** **+**-** *]" 1
1497 4 89 ILE MD 4 90 GLU H 2.910 . 4.020 4.141 3.428 5.127 1.107 5 4 "[ +** 1 - . 2]" 1
1498 4 89 ILE MD 4 94 MET H 3.150 . 4.500 4.792 3.285 5.811 1.311 7 10 "[* * **+* ** *-. 2]" 1
1499 4 89 ILE MD 4 94 MET ME 2.660 . 3.520 2.998 1.964 4.935 1.415 6 4 "[ .+- 1** . 2]" 1
1500 4 90 GLU H 4 91 GLY H 3.180 . 4.560 4.369 4.221 4.467 . 0 0 "[ . 1 . 2]" 1
1501 4 90 GLU H 4 94 MET H 3.070 . 4.340 3.635 2.819 4.820 0.480 12 0 "[ . 1 . 2]" 1
1502 4 91 GLY H 4 92 THR H 3.320 . 4.830 4.555 4.226 4.628 . 0 0 "[ . 1 . 2]" 1
1503 4 91 GLY H 4 94 MET H 3.330 . 4.860 4.398 4.092 4.950 0.090 18 0 "[ . 1 . 2]" 1
1504 4 92 THR H 4 93 GLN H 2.180 . 2.560 2.562 2.348 2.728 0.168 12 0 "[ . 1 . 2]" 1
1505 4 92 THR H 4 94 MET H 3.000 . 4.200 4.346 3.944 4.625 0.425 12 0 "[ . 1 . 2]" 1
1506 4 93 GLN H 4 94 MET H 2.350 . 2.900 2.675 2.536 2.799 . 0 0 "[ . 1 . 2]" 1
1507 4 93 GLN H 4 95 ALA H 3.280 . 4.760 4.127 3.781 4.454 . 0 0 "[ . 1 . 2]" 1
1508 4 93 GLN H 4 96 HIS H 3.370 . 4.940 4.781 4.603 5.014 0.074 11 0 "[ . 1 . 2]" 1
1509 4 94 MET H 4 95 ALA H 2.360 . 2.920 2.592 2.329 2.812 . 0 0 "[ . 1 . 2]" 1
1510 4 94 MET H 4 96 HIS H 3.070 . 4.340 4.047 3.768 4.401 0.061 11 0 "[ . 1 . 2]" 1
1511 4 94 MET H 4 97 CYS H 3.340 . 4.880 4.679 4.440 5.016 0.136 16 0 "[ . 1 . 2]" 1
1512 4 95 ALA H 4 96 HIS H 2.180 . 2.560 2.627 2.463 2.791 0.231 13 0 "[ . 1 . 2]" 1
1513 4 95 ALA H 4 97 CYS H 3.010 . 4.220 4.042 3.766 4.426 0.206 1 0 "[ . 1 . 2]" 1
1514 4 95 ALA H 4 98 LEU H 3.420 . 5.040 4.902 4.689 5.079 0.039 15 0 "[ . 1 . 2]" 1
1515 4 95 ALA MB 4 96 HIS H 2.610 . 3.420 2.686 2.436 2.989 . 0 0 "[ . 1 . 2]" 1
1516 4 95 ALA MB 4 98 LEU QD 2.990 . 4.180 4.525 3.107 5.828 1.648 2 9 "[ +*** * *. *-*2]" 1
1517 4 96 HIS H 4 97 CYS H 2.360 . 2.920 2.486 2.348 2.629 . 0 0 "[ . 1 . 2]" 1
1518 4 96 HIS H 4 98 LEU H 3.060 . 4.320 4.211 3.865 4.511 0.191 12 0 "[ . 1 . 2]" 1
1519 4 96 HIS H 4 99 GLY H 3.480 . 5.160 4.678 4.362 5.209 0.049 13 0 "[ . 1 . 2]" 1
1520 4 97 CYS H 4 98 LEU H 2.290 . 2.780 2.608 2.319 2.789 0.009 7 0 "[ . 1 . 2]" 1
1521 4 97 CYS H 4 99 GLY H 3.040 . 4.280 3.957 3.687 4.284 0.004 11 0 "[ . 1 . 2]" 1
1522 4 97 CYS H 4 100 ALA H 3.490 . 5.180 4.875 4.562 5.208 0.028 11 0 "[ . 1 . 2]" 1
1523 4 98 LEU H 4 99 GLY H 2.230 . 2.660 2.487 2.263 2.645 . 0 0 "[ . 1 . 2]" 1
1524 4 98 LEU H 4 100 ALA H 2.970 . 4.140 4.066 3.856 4.229 0.089 13 0 "[ . 1 . 2]" 1
1525 4 98 LEU H 4 101 TYR H 3.520 . 5.240 4.769 4.527 4.984 . 0 0 "[ . 1 . 2]" 1
1526 4 98 LEU H 4 102 CYS H 3.490 . 5.180 4.932 4.732 5.047 . 0 0 "[ . 1 . 2]" 1
1527 4 98 LEU QD 4 99 GLY H 3.190 . 4.580 3.496 2.348 4.286 . 0 0 "[ . 1 . 2]" 1
1528 4 99 GLY H 4 100 ALA H 2.150 . 2.500 2.542 2.280 2.719 0.219 18 0 "[ . 1 . 2]" 1
1529 4 99 GLY H 4 100 ALA MB 3.330 . 4.860 4.195 3.964 4.385 . 0 0 "[ . 1 . 2]" 1
1530 4 99 GLY H 4 101 TYR H 3.270 . 4.740 4.292 3.937 4.600 . 0 0 "[ . 1 . 2]" 1
1531 4 99 GLY H 4 102 CYS H 3.370 . 4.940 4.950 4.657 5.316 0.376 6 0 "[ . 1 . 2]" 1
1532 4 100 ALA H 4 101 TYR H 2.230 . 2.660 2.255 2.054 2.547 . 0 0 "[ . 1 . 2]" 1
1533 4 100 ALA H 4 102 CYS H 2.510 . 3.220 3.515 3.207 3.786 0.566 17 2 "[ . 1 .-+ 2]" 1
1534 4 100 ALA MB 4 101 TYR H 2.340 . 2.880 2.378 2.081 2.633 . 0 0 "[ . 1 . 2]" 1
1535 4 100 ALA MB 4 133 PHE H 3.460 . 5.120 4.144 3.186 5.475 0.355 11 0 "[ . 1 . 2]" 1
1536 4 100 ALA MB 4 133 PHE QD 3.130 . 4.460 3.071 1.769 5.108 0.648 11 1 "[ . 1+ . 2]" 1
1537 4 100 ALA MB 4 134 ASP H 3.410 . 5.020 3.883 1.955 5.083 0.063 10 0 "[ . 1 . 2]" 1
1538 4 101 TYR H 4 102 CYS H 2.280 . 2.760 2.717 2.570 2.844 0.084 3 0 "[ . 1 . 2]" 1
1539 4 101 TYR QD 4 102 CYS H 3.100 . 4.400 3.679 3.263 4.146 . 0 0 "[ . 1 . 2]" 1
1540 4 101 TYR QE 4 105 ILE MD 3.010 . 4.220 3.045 2.765 3.897 . 0 0 "[ . 1 . 2]" 1
1541 4 109 TYR H 4 110 ALA H 2.210 . 2.620 2.459 2.320 2.552 . 0 0 "[ . 1 . 2]" 1
1542 4 109 TYR H 4 111 ARG H 3.050 . 4.300 4.068 3.881 4.308 0.008 19 0 "[ . 1 . 2]" 1
1543 4 109 TYR H 4 112 GLU H 3.410 . 5.020 4.699 4.411 4.890 . 0 0 "[ . 1 . 2]" 1
1544 4 109 TYR QD 4 110 ALA H 3.350 . 4.900 4.121 3.962 4.357 . 0 0 "[ . 1 . 2]" 1
1545 4 110 ALA H 4 111 ARG H 2.200 . 2.600 2.611 2.515 2.702 0.102 16 0 "[ . 1 . 2]" 1
1546 4 110 ALA H 4 112 GLU H 2.940 . 4.080 4.114 3.902 4.338 0.258 5 0 "[ . 1 . 2]" 1
1547 4 110 ALA H 4 113 CYS H 3.460 . 5.120 4.870 4.756 5.190 0.070 2 0 "[ . 1 . 2]" 1
1548 4 110 ALA MB 4 111 ARG H 2.570 . 3.340 2.369 2.217 2.479 . 0 0 "[ . 1 . 2]" 1
1549 4 111 ARG H 4 112 GLU H 2.360 . 2.920 2.774 2.561 2.876 . 0 0 "[ . 1 . 2]" 1
1550 4 111 ARG H 4 113 CYS H 3.130 . 4.460 4.326 4.216 4.503 0.043 18 0 "[ . 1 . 2]" 1
1551 4 112 GLU H 4 113 CYS H 2.270 . 2.740 2.727 2.610 2.995 0.255 2 0 "[ . 1 . 2]" 1
1552 4 112 GLU H 4 114 ILE H 3.440 . 5.080 4.306 4.131 4.493 . 0 0 "[ . 1 . 2]" 1
1553 4 113 CYS H 4 114 ILE H 2.490 . 3.180 2.754 2.645 2.799 . 0 0 "[ . 1 . 2]" 1
1554 4 113 CYS H 4 115 THR H 3.150 . 4.500 4.182 4.047 4.420 . 0 0 "[ . 1 . 2]" 1
1555 4 113 CYS H 4 116 SER H 3.370 . 4.940 4.930 4.836 5.015 0.075 14 0 "[ . 1 . 2]" 1
1556 4 114 ILE H 4 115 THR H 2.420 . 3.040 2.715 2.606 2.872 . 0 0 "[ . 1 . 2]" 1
1557 4 114 ILE H 4 116 SER H 3.070 . 4.340 4.321 4.176 4.458 0.118 5 0 "[ . 1 . 2]" 1
1558 4 114 ILE H 4 117 MET ME 3.220 . 4.640 3.606 3.533 3.699 . 0 0 "[ . 1 . 2]" 1
1559 4 114 ILE MD 4 115 THR H 3.500 . 5.200 4.519 4.280 4.714 . 0 0 "[ . 1 . 2]" 1
1560 4 115 THR H 4 116 SER H 2.360 . 2.920 2.788 2.697 2.863 . 0 0 "[ . 1 . 2]" 1
1561 4 115 THR H 4 117 MET H 3.370 . 4.940 4.305 4.205 4.397 . 0 0 "[ . 1 . 2]" 1
1562 4 115 THR H 4 118 VAL H 3.450 . 5.100 4.825 4.759 4.902 . 0 0 "[ . 1 . 2]" 1
1563 4 115 THR H 4 118 VAL MG2 3.520 . 5.240 4.176 3.999 4.436 . 0 0 "[ . 1 . 2]" 1
1564 4 116 SER H 4 117 MET H 2.350 . 2.900 2.642 2.590 2.691 . 0 0 "[ . 1 . 2]" 1
1565 4 116 SER H 4 118 VAL H 3.000 . 4.200 4.020 3.936 4.104 . 0 0 "[ . 1 . 2]" 1
1566 4 116 SER H 4 119 SER H 3.500 . 5.200 4.815 4.725 4.941 . 0 0 "[ . 1 . 2]" 1
1567 4 117 MET H 4 118 VAL H 2.360 . 2.920 2.611 2.563 2.642 . 0 0 "[ . 1 . 2]" 1
1568 4 117 MET H 4 119 SER H 3.110 . 4.420 4.234 4.178 4.298 . 0 0 "[ . 1 . 2]" 1
1569 4 118 VAL H 4 119 SER H 2.360 . 2.920 2.670 2.597 2.733 . 0 0 "[ . 1 . 2]" 1
1570 4 118 VAL MG1 4 119 SER H 3.190 . 4.580 3.375 3.226 3.468 . 0 0 "[ . 1 . 2]" 1
1571 4 118 VAL MG1 4 123 PHE H 3.060 . 4.320 3.409 3.030 3.603 . 0 0 "[ . 1 . 2]" 1
1572 4 118 VAL MG1 4 123 PHE QD 3.190 . 4.580 3.366 3.080 3.926 . 0 0 "[ . 1 . 2]" 1
1573 4 118 VAL MG1 4 126 LEU H 3.430 . 5.060 3.291 3.124 3.528 . 0 0 "[ . 1 . 2]" 1
1574 4 118 VAL MG2 4 119 SER H 3.370 . 4.940 3.892 3.816 3.974 . 0 0 "[ . 1 . 2]" 1
1575 4 119 SER H 4 121 GLY H 2.980 . 4.160 3.931 3.832 4.114 . 0 0 "[ . 1 . 2]" 1
1576 4 121 GLY H 4 122 THR H 2.310 . 2.820 2.608 2.445 2.696 . 0 0 "[ . 1 . 2]" 1
1577 4 121 GLY H 4 123 PHE H 2.780 . 3.760 3.773 3.580 4.068 0.308 13 0 "[ . 1 . 2]" 1
1578 4 122 THR H 4 123 PHE H 2.350 . 2.900 2.721 2.576 2.834 . 0 0 "[ . 1 . 2]" 1
1579 4 125 GLN H 4 126 LEU H 3.330 . 4.860 4.567 4.484 4.631 . 0 0 "[ . 1 . 2]" 1
1580 4 126 LEU H 4 127 ASN H 2.840 . 3.880 4.063 3.886 4.272 0.392 18 0 "[ . 1 . 2]" 1
1581 4 126 LEU MD1 4 128 LEU QD 2.960 . 4.120 2.598 2.035 4.618 0.498 3 0 "[ . 1 . 2]" 1
1582 4 127 ASN H 4 128 LEU H 3.120 . 4.440 4.028 3.744 4.228 . 0 0 "[ . 1 . 2]" 1
1583 4 128 LEU H 4 129 ALA H 3.340 . 4.880 4.556 4.445 4.633 . 0 0 "[ . 1 . 2]" 1
1584 4 128 LEU QD 4 129 ALA H 3.240 . 4.680 3.388 2.034 3.872 . 0 0 "[ . 1 . 2]" 1
1585 4 131 VAL QG 4 133 PHE QE 2.890 . 3.990 3.711 2.274 7.090 3.100 20 6 "[* .* 1* .- *+]" 1
1586 4 131 VAL QG 4 136 LEU QD 2.990 . 4.180 3.109 1.960 5.262 1.082 11 3 "[ * . - 1+ . 2]" 1
1587 4 133 PHE H 4 134 ASP H 2.210 . 2.620 2.636 2.415 2.953 0.333 20 0 "[ . 1 . 2]" 1
1588 4 133 PHE H 4 135 ALA H 3.230 . 4.660 4.437 4.127 4.928 0.268 6 0 "[ . 1 . 2]" 1
1589 4 133 PHE H 4 136 LEU H 3.380 . 4.960 5.256 4.609 5.917 0.957 5 6 "[ -* + 1* . ** 2]" 1
1590 4 133 PHE QD 4 134 ASP H 3.210 . 4.620 4.227 2.993 4.783 0.163 11 0 "[ . 1 . 2]" 1
1591 4 134 ASP H 4 135 ALA H 2.410 . 3.020 2.721 2.431 3.076 0.056 6 0 "[ . 1 . 2]" 1
1592 4 134 ASP H 4 136 LEU H 3.060 . 4.320 4.259 3.790 4.736 0.416 5 0 "[ . 1 . 2]" 1
1593 4 134 ASP H 4 137 PHE H 3.460 . 5.120 4.902 4.624 5.432 0.312 3 0 "[ . 1 . 2]" 1
1594 4 135 ALA H 4 136 LEU H 2.140 . 2.480 2.737 2.596 2.861 0.381 14 0 "[ . 1 . 2]" 1
1595 4 135 ALA H 4 137 PHE H 3.060 . 4.320 4.192 3.833 4.510 0.190 11 0 "[ . 1 . 2]" 1
1596 4 135 ALA H 4 138 MET H 3.420 . 5.040 4.915 4.633 5.181 0.141 13 0 "[ . 1 . 2]" 1
1597 4 135 ALA MB 4 136 LEU H 2.650 . 3.500 2.566 2.321 2.882 . 0 0 "[ . 1 . 2]" 1
1598 4 136 LEU H 4 137 PHE H 2.390 . 2.980 2.622 2.401 2.752 . 0 0 "[ . 1 . 2]" 1
1599 4 136 LEU H 4 138 MET H 3.190 . 4.580 4.266 3.799 4.581 0.001 7 0 "[ . 1 . 2]" 1
1600 4 136 LEU H 4 139 ASN H 3.390 . 4.980 4.896 4.491 5.804 0.824 6 2 "[- .+ 1 . 2]" 1
1601 4 136 LEU QD 4 140 TYR H 3.500 . 5.200 5.120 3.205 6.224 1.024 6 7 "[** *+ 1 ** -]" 1
1602 4 137 PHE H 4 138 MET H 2.290 . 2.780 2.637 2.193 2.881 0.101 5 0 "[ . 1 . 2]" 1
1603 4 137 PHE H 4 139 ASN H 2.980 . 4.160 4.096 3.676 4.490 0.330 1 0 "[ . 1 . 2]" 1
1604 4 137 PHE H 4 140 TYR H 3.300 . 4.800 4.852 4.340 5.446 0.646 1 2 "[+ .- 1 . 2]" 1
1605 4 137 PHE QD 4 138 MET H 3.180 . 4.560 3.629 2.834 4.616 0.056 6 0 "[ . 1 . 2]" 1
1606 4 137 PHE QD 4 141 LEU QD 2.710 . 3.620 3.537 2.172 5.221 1.601 12 6 "[ * . * 1*+ *. -2]" 1
1607 4 137 PHE QE 4 141 LEU QD 2.590 . 3.380 3.435 1.967 5.950 2.570 11 6 "[ * . * 1+* *. -2]" 1
1608 4 138 MET H 4 139 ASN H 2.340 . 2.880 2.682 2.472 2.857 . 0 0 "[ . 1 . 2]" 1
1609 4 138 MET H 4 140 TYR H 3.230 . 4.660 4.162 3.863 4.521 . 0 0 "[ . 1 . 2]" 1
1610 4 138 MET H 4 141 LEU H 3.430 . 5.060 5.074 4.607 5.387 0.327 19 0 "[ . 1 . 2]" 1
1611 4 139 ASN H 4 140 TYR H 2.230 . 2.660 2.657 2.447 2.847 0.187 15 0 "[ . 1 . 2]" 1
1612 4 139 ASN H 4 141 LEU H 2.970 . 4.140 4.250 3.835 4.521 0.381 6 0 "[ . 1 . 2]" 1
1613 4 140 TYR H 4 141 LEU H 2.390 . 2.980 2.650 2.424 2.891 . 0 0 "[ . 1 . 2]" 1
1614 4 140 TYR QD 4 141 LEU H 3.030 . 4.260 3.903 3.379 4.637 0.377 17 0 "[ . 1 . 2]" 1
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