NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
607134 |
5jtq   |
30085 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5jtq
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 1471
_Distance_constraint_stats_list.Viol_count 4849
_Distance_constraint_stats_list.Viol_total 29668.539
_Distance_constraint_stats_list.Viol_max 5.071
_Distance_constraint_stats_list.Viol_rms 0.2090
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0504
_Distance_constraint_stats_list.Viol_average_violations_only 0.3059
_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 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 THR 3.854 0.796 3 3 "[ + . * 1 -. 2]"
1 11 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 GLN 0.005 0.005 1 0 "[ . 1 . 2]"
1 13 ILE 0.005 0.005 1 0 "[ . 1 . 2]"
1 14 GLN 7.398 0.708 20 5 "[-* * 1 * . +]"
1 15 ARG 1.952 0.279 20 0 "[ . 1 . 2]"
1 16 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 TYR 48.344 4.122 16 9 "[ -*.* *** *.+ *2]"
1 18 THR 0.729 0.227 16 0 "[ . 1 . 2]"
1 19 LYS 8.439 0.708 10 4 "[ . -*+ * . 2]"
1 20 ASP 0.963 0.149 14 0 "[ . 1 . 2]"
1 21 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 PHE 2.362 0.332 4 0 "[ . 1 . 2]"
1 24 GLU 2.420 0.332 4 0 "[ . 1 . 2]"
1 25 ALA 0.395 0.163 2 0 "[ . 1 . 2]"
1 27 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 ALA 1.265 0.210 12 0 "[ . 1 . 2]"
1 30 HIS 0.912 0.210 12 0 "[ . 1 . 2]"
1 31 VAL 24.040 5.071 19 7 "[ *-** 1 ** . +2]"
1 32 PHE 0.660 0.160 14 0 "[ . 1 . 2]"
1 33 GLN 1.154 0.223 9 0 "[ . 1 . 2]"
1 34 LYS 3.651 0.484 9 0 "[ . 1 . 2]"
1 35 ASP 18.323 2.322 19 12 "[ * *** **** .* -+*]"
1 36 TRP 21.822 5.071 19 7 "[ *-** 1 ** . +2]"
1 37 GLN 3.898 0.443 20 0 "[ . 1 . 2]"
1 39 GLU 21.428 1.179 6 12 "[ * *.+ - 1* *******]"
1 40 VAL 4.766 0.361 15 0 "[ . 1 . 2]"
1 41 LYS 11.630 0.992 9 7 "[ .* +1 * *. -**]"
1 42 LEU 3.530 0.992 9 4 "[ .* +1 *. - 2]"
1 43 ASP 23.466 2.151 8 14 "[ ** .**+** ** .****-]"
1 44 LEU 16.757 1.750 18 5 "[ . * 1 ** . + -]"
1 45 ASP 2.953 0.594 15 1 "[ . 1 + 2]"
1 46 THR 0.057 0.048 6 0 "[ . 1 . 2]"
1 47 ALA 3.615 1.276 15 3 "[ .- 1 + * 2]"
1 48 SER 0.363 0.139 6 0 "[ . 1 . 2]"
1 49 SER 6.119 0.720 6 2 "[- .+ 1 . 2]"
1 50 GLN 2.228 0.228 4 0 "[ . 1 . 2]"
1 51 LEU 3.800 0.308 19 0 "[ . 1 . 2]"
1 52 ALA 3.123 0.308 19 0 "[ . 1 . 2]"
1 53 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 ASP 0.289 0.122 3 0 "[ . 1 . 2]"
1 55 VAL 8.006 0.473 20 0 "[ . 1 . 2]"
1 56 TYR 7.187 0.473 20 0 "[ . 1 . 2]"
1 57 GLU 1.895 0.290 5 0 "[ . 1 . 2]"
1 58 VAL 9.525 1.276 15 5 "[* .* 1 * + * 2]"
1 59 VAL 4.768 0.720 6 2 "[- .+ 1 . 2]"
1 60 LEU 0.088 0.070 14 0 "[ . 1 . 2]"
1 61 ARG 3.128 0.594 15 1 "[ . 1 + 2]"
1 62 VAL 4.617 0.595 18 1 "[ . 1 . + 2]"
1 63 THR 4.960 0.717 18 2 "[ . 1 - . + 2]"
1 64 VAL 4.523 0.832 19 2 "[ . 1 . +-]"
1 65 THR 3.967 0.794 18 2 "[ . 1 - . + 2]"
1 66 ALA 5.328 0.644 12 2 "[ . 1 + . -2]"
1 67 SER 17.006 1.179 6 12 "[ * *.+ - 1* *******]"
1 68 LEU 38.039 2.322 19 17 "[ *********-* *** *+*]"
1 69 GLY 13.558 0.699 6 3 "[ * .+ - . 2]"
1 70 GLU 0.777 0.106 20 0 "[ . 1 . 2]"
1 71 GLU 4.855 0.311 2 0 "[ . 1 . 2]"
1 72 THR 3.459 0.311 2 0 "[ . 1 . 2]"
1 73 ALA 14.440 1.837 19 7 "[ *. **1- ** +2]"
1 74 PHE 5.376 1.079 14 1 "[ . 1 +. 2]"
1 75 LEU 0.471 0.095 17 0 "[ . 1 . 2]"
1 76 CYS 0.533 0.095 17 0 "[ . 1 . 2]"
1 77 GLU 0.430 0.156 20 0 "[ . 1 . 2]"
1 78 VAL 2.577 0.234 16 0 "[ . 1 . 2]"
1 79 GLN 12.044 0.708 10 4 "[ . -*+ * . 2]"
1 80 GLN 2.182 0.266 20 0 "[ . 1 . 2]"
1 81 GLY 2.288 0.290 8 0 "[ . 1 . 2]"
1 82 GLY 2.941 0.529 15 1 "[ . 1 + 2]"
1 83 ILE 7.133 0.708 20 5 "[-* * 1 * . +]"
1 84 PHE 1.020 0.329 17 0 "[ . 1 . 2]"
1 85 SER 0.319 0.130 9 0 "[ . 1 . 2]"
1 86 ILE 0.319 0.130 9 0 "[ . 1 . 2]"
1 87 ALA 4.108 0.796 3 3 "[ + . * 1 -. 2]"
1 88 GLY 13.077 0.890 9 18 "[***** -*+* *********]"
1 89 ILE 12.823 0.890 9 18 "[***** -*+* *********]"
1 90 GLU 0.739 0.564 14 1 "[ . 1 +. 2]"
1 91 GLY 11.579 2.207 20 5 "[ * . -* . * +]"
1 92 THR 1.275 0.236 15 0 "[ . 1 . 2]"
1 93 GLN 0.379 0.118 3 0 "[ . 1 . 2]"
1 94 MET 17.734 2.207 20 11 "[** . *****- **+]"
1 95 ALA 4.492 0.465 7 0 "[ . 1 . 2]"
1 96 HIS 19.667 0.949 20 11 "[*- .* **1****. * +]"
1 97 CYS 6.582 0.395 14 0 "[ . 1 . 2]"
1 98 LEU 36.050 0.949 20 13 "[** .* **1****- * *+]"
1 99 GLY 25.076 0.926 7 11 "[ **** +**1 .**-*2]"
1 100 ALA 16.389 0.812 4 12 "[* +**** * ** .** -2]"
1 101 TYR 15.178 3.200 4 3 "[ *+. 1 .- 2]"
1 102 CYS 29.883 0.926 7 15 "[* ****+*** ** .**-*2]"
1 105 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 TYR 0.880 0.118 2 0 "[ . 1 . 2]"
1 110 ALA 3.328 0.194 5 0 "[ . 1 . 2]"
1 111 ARG 2.655 0.194 5 0 "[ . 1 . 2]"
1 112 GLU 3.086 0.308 6 0 "[ . 1 . 2]"
1 113 CYS 4.138 0.308 6 0 "[ . 1 . 2]"
1 114 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 115 THR 0.626 0.208 20 0 "[ . 1 . 2]"
1 116 SER 0.518 0.158 1 0 "[ . 1 . 2]"
1 117 MET 0.064 0.064 20 0 "[ . 1 . 2]"
1 118 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 119 SER 1.239 0.256 16 0 "[ . 1 . 2]"
1 121 GLY 0.078 0.048 19 0 "[ . 1 . 2]"
1 122 THR 0.112 0.041 13 0 "[ . 1 . 2]"
1 123 PHE 6.176 1.079 14 1 "[ . 1 +. 2]"
1 125 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 126 LEU 4.370 0.644 12 1 "[ . 1 + . 2]"
1 127 ASN 2.396 0.372 10 0 "[ . 1 . 2]"
1 128 LEU 35.540 2.151 8 16 "[ ** .**+** ********-]"
1 129 ALA 6.504 0.801 17 5 "[- . * * * + 2]"
1 131 VAL 19.103 1.559 8 11 "[ * . +*1*****-* *2]"
1 133 PHE 31.957 1.197 11 15 "[*** ** -*1+ ***** **]"
1 134 ASP 8.558 0.391 5 0 "[ . 1 . 2]"
1 135 ALA 17.334 0.954 3 15 "[**+ ** -*1* ***** **]"
1 136 LEU 9.308 0.777 17 4 "[ . 1 -** + 2]"
1 137 PHE 4.649 0.443 4 0 "[ . 1 . 2]"
1 138 MET 0.751 0.234 18 0 "[ . 1 . 2]"
1 139 ASN 5.090 0.645 14 1 "[ . 1 +. 2]"
1 140 TYR 2.857 0.617 13 1 "[ . 1 + . 2]"
1 141 LEU 3.253 0.617 13 1 "[ . 1 + . 2]"
2 9 MET 0.000 0.000 . 0 "[ . 1 . 2]"
2 10 THR 0.566 0.420 6 0 "[ . 1 . 2]"
2 11 PHE 4.013 0.550 5 1 "[ + 1 . 2]"
2 12 GLN 6.429 0.550 5 1 "[ + 1 . 2]"
2 13 ILE 3.491 0.878 4 1 "[ +. 1 . 2]"
2 14 GLN 4.960 0.430 20 0 "[ . 1 . 2]"
2 15 ARG 3.582 0.295 20 0 "[ . 1 . 2]"
2 16 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
2 17 TYR 0.155 0.089 9 0 "[ . 1 . 2]"
2 18 THR 0.112 0.041 13 0 "[ . 1 . 2]"
2 19 LYS 1.311 0.186 2 0 "[ . 1 . 2]"
2 20 ASP 2.415 0.299 1 0 "[ . 1 . 2]"
2 21 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
2 22 SER 7.383 0.641 20 2 "[ .- 1 . +]"
2 23 PHE 0.807 0.132 1 0 "[ . 1 . 2]"
2 24 GLU 0.340 0.132 1 0 "[ . 1 . 2]"
2 25 ALA 1.008 0.154 7 0 "[ . 1 . 2]"
2 27 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
2 28 ALA 47.933 4.122 16 9 "[ -*.* *** *.+ *2]"
2 30 HIS 1.939 0.335 8 0 "[ . 1 . 2]"
2 31 VAL 8.611 0.777 6 6 "[* *+ * - . * 2]"
2 32 PHE 3.612 0.593 17 2 "[ . 1 - . + 2]"
2 33 GLN 1.002 0.159 12 0 "[ . 1 . 2]"
2 34 LYS 8.040 0.777 6 5 "[* *+ - * . 2]"
2 35 ASP 33.423 4.183 7 12 "[- * .*+**1****. * *]"
2 36 TRP 52.779 4.183 7 20 [-*****+*************]
2 37 GLN 18.358 2.399 20 13 "[** ** ** * ****-+]"
2 39 GLU 2.418 0.541 2 1 "[ + . 1 . 2]"
2 40 VAL 10.924 1.616 16 7 "[ . *-1*** .+ *]"
2 41 LYS 2.300 0.333 11 0 "[ . 1 . 2]"
2 42 LEU 47.335 2.136 12 17 "[ ***.******+ *-*****]"
2 43 ASP 1.871 0.544 14 1 "[ . 1 +. 2]"
2 44 LEU 7.832 1.267 3 5 "[ +*. *1 -. *]"
2 45 ASP 5.834 0.619 8 2 "[ .- + 1 . 2]"
2 46 THR 1.449 0.413 14 0 "[ . 1 . 2]"
2 47 ALA 18.663 1.607 13 8 "[* . ** 1 +*. - **]"
2 48 SER 2.873 0.449 14 0 "[ . 1 . 2]"
2 49 SER 8.006 0.924 6 5 "[ -+ 1* * . *2]"
2 50 GLN 0.157 0.037 18 0 "[ . 1 . 2]"
2 51 LEU 1.735 0.303 7 0 "[ . 1 . 2]"
2 52 ALA 0.752 0.197 14 0 "[ . 1 . 2]"
2 53 ASP 0.006 0.006 9 0 "[ . 1 . 2]"
2 54 ASP 0.342 0.089 1 0 "[ . 1 . 2]"
2 55 VAL 2.720 0.303 7 0 "[ . 1 . 2]"
2 56 TYR 29.786 2.925 17 10 "[ * .*** 1 * * +-**]"
2 57 GLU 11.595 0.924 6 4 "[ -+ 1* * . 2]"
2 58 VAL 8.596 1.607 13 6 "[* . ** 1 + . - *2]"
2 59 VAL 13.787 1.077 8 6 "[* . + 1 -*. **]"
2 60 LEU 3.975 0.495 18 0 "[ . 1 . 2]"
2 61 ARG 6.692 0.619 8 2 "[ .- + 1 . 2]"
2 62 VAL 13.633 0.886 11 12 "[ * *. *- *+** .* ***]"
2 63 THR 2.625 0.238 13 0 "[ . 1 . 2]"
2 64 VAL 20.699 1.105 11 12 "[ * *-** **+ * ***]"
2 65 THR 3.683 0.333 11 0 "[ . 1 . 2]"
2 66 ALA 6.461 0.413 10 0 "[ . 1 . 2]"
2 67 SER 2.094 0.541 2 1 "[ + . 1 . 2]"
2 68 LEU 6.490 0.978 1 2 "[+ . 1* . 2]"
2 69 GLY 2.268 0.978 1 2 "[+ . 1- . 2]"
2 70 GLU 0.250 0.221 10 0 "[ . 1 . 2]"
2 71 GLU 1.377 0.235 20 0 "[ . 1 . 2]"
2 72 THR 1.803 0.365 1 0 "[ . 1 . 2]"
2 73 ALA 6.769 0.539 1 1 "[+ . 1 . 2]"
2 74 PHE 15.367 1.616 16 7 "[ . *-1*** .+ *]"
2 75 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 76 CYS 9.578 0.714 2 11 "[ + *-** *** . ***]"
2 77 GLU 0.466 0.103 20 0 "[ . 1 . 2]"
2 78 VAL 11.676 0.711 19 11 "[ * *. *- * ** .* *+*]"
2 79 GLN 8.568 0.641 20 2 "[ .- 1 . +]"
2 80 GLN 3.703 0.495 18 0 "[ . 1 . 2]"
2 81 GLY 0.844 0.186 2 0 "[ . 1 . 2]"
2 82 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 83 ILE 6.799 0.430 20 0 "[ . 1 . 2]"
2 84 PHE 0.054 0.054 8 0 "[ . 1 . 2]"
2 85 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 86 ILE 0.304 0.304 1 0 "[ . 1 . 2]"
2 87 ALA 5.320 0.926 2 4 "[ + . ** - . 2]"
2 88 GLY 1.140 0.227 2 0 "[ . 1 . 2]"
2 89 ILE 7.025 0.926 2 4 "[ + . ** - . 2]"
2 90 GLU 0.231 0.178 11 0 "[ . 1 . 2]"
2 91 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 92 THR 4.983 0.334 4 0 "[ . 1 . 2]"
2 93 GLN 5.851 0.719 20 1 "[ . 1 . +]"
2 94 MET 26.265 2.925 17 8 "[ * .*-* 1 * . +* *]"
2 95 ALA 4.124 0.661 7 2 "[ . + -1 . 2]"
2 96 HIS 29.380 4.015 17 13 "[*** . ***1** *.-+* *]"
2 97 CYS 2.378 0.326 14 0 "[ . 1 . 2]"
2 98 LEU 28.703 1.423 15 13 "[* * .** *1** *+-** *]"
2 99 GLY 7.889 0.528 19 1 "[ . 1 . +2]"
2 100 ALA 11.754 0.627 9 3 "[ -* +1 . 2]"
2 101 TYR 4.325 0.362 1 0 "[ . 1 . 2]"
2 102 CYS 10.774 0.627 9 4 "[ -* +1 . *2]"
2 109 TYR 1.462 0.194 20 0 "[ . 1 . 2]"
2 110 ALA 11.573 0.550 13 2 "[ . 1 + . -]"
2 111 ARG 4.240 0.258 2 0 "[ . 1 . 2]"
2 112 GLU 9.476 0.550 13 2 "[ . 1 + . -]"
2 113 CYS 0.923 0.133 14 0 "[ . 1 . 2]"
2 114 ILE 0.146 0.059 19 0 "[ . 1 . 2]"
2 115 THR 0.000 0.000 . 0 "[ . 1 . 2]"
2 116 SER 0.050 0.050 18 0 "[ . 1 . 2]"
2 117 MET 0.000 0.000 . 0 "[ . 1 . 2]"
2 118 VAL 0.150 0.100 8 0 "[ . 1 . 2]"
2 119 SER 0.825 0.641 1 1 "[+ . 1 . 2]"
2 121 GLY 2.359 0.427 5 0 "[ . 1 . 2]"
2 122 THR 0.000 0.000 . 0 "[ . 1 . 2]"
2 123 PHE 2.455 0.641 1 1 "[+ . 1 . 2]"
2 125 GLN 6.305 1.283 10 6 "[ . + *.*- **]"
2 126 LEU 21.152 1.302 12 10 "[ -. ***1*+ *. * **]"
2 127 ASN 4.996 0.586 17 2 "[ . 1 -. + 2]"
2 128 LEU 31.847 1.885 12 15 "[****. ***1*+***- **]"
2 129 ALA 28.388 2.136 12 15 "[ ***.** ***+ -.*****]"
2 131 VAL 10.746 1.543 14 8 "[* * . **1 *+.- *]"
2 133 PHE 1.240 0.274 7 0 "[ . 1 . 2]"
2 134 ASP 0.017 0.017 13 0 "[ . 1 . 2]"
2 135 ALA 1.169 0.274 7 0 "[ . 1 . 2]"
2 136 LEU 4.147 1.267 3 3 "[ +*. 1 -. 2]"
2 137 PHE 19.021 4.015 17 7 "[ * . ***1* . + -]"
2 138 MET 2.107 0.517 15 1 "[ . 1 + 2]"
2 139 ASN 1.256 0.357 15 0 "[ . 1 . 2]"
2 140 TYR 0.454 0.204 15 0 "[ . 1 . 2]"
2 141 LEU 4.012 1.220 8 2 "[ . + 1 - 2]"
3 9 MET 40.174 2.024 14 19 "[**-**********+*** **]"
3 10 THR 33.811 1.421 19 20 [**********-*******+*]
3 11 PHE 19.018 0.809 6 8 "[ ** .+ * * . **-2]"
3 12 GLN 15.327 0.553 17 2 "[ . 1 . + -2]"
3 13 ILE 7.998 0.627 1 1 "[+ . 1 . 2]"
3 14 GLN 2.811 0.291 9 0 "[ . 1 . 2]"
3 15 ARG 2.005 0.291 9 0 "[ . 1 . 2]"
3 16 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
3 17 TYR 1.674 0.138 12 0 "[ . 1 . 2]"
3 18 THR 0.326 0.108 20 0 "[ . 1 . 2]"
3 19 LYS 0.923 0.447 11 0 "[ . 1 . 2]"
3 20 ASP 0.221 0.128 11 0 "[ . 1 . 2]"
3 21 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
3 22 SER 12.284 0.921 14 14 "[ * ** ***- *+*** **]"
3 23 PHE 0.714 0.168 16 0 "[ . 1 . 2]"
3 24 GLU 0.808 0.168 16 0 "[ . 1 . 2]"
3 25 ALA 6.604 0.816 19 7 "[ **.- * . *+*]"
3 27 ASN 0.114 0.114 16 0 "[ . 1 . 2]"
3 28 ALA 0.361 0.114 16 0 "[ . 1 . 2]"
3 30 HIS 1.715 0.438 2 0 "[ . 1 . 2]"
3 31 VAL 14.527 1.421 7 14 "[ * *. +**1 *-*******]"
3 32 PHE 15.684 1.421 7 14 "[ * *. +**1 *-*******]"
3 33 GLN 0.902 0.304 7 0 "[ . 1 . 2]"
3 34 LYS 0.344 0.259 15 0 "[ . 1 . 2]"
3 35 ASP 2.777 1.165 8 1 "[ . + 1 . 2]"
3 36 TRP 0.340 0.261 8 0 "[ . 1 . 2]"
3 37 GLN 3.117 1.165 8 1 "[ . + 1 . 2]"
3 39 GLU 33.456 1.203 5 20 [**-*+***************]
3 40 VAL 5.971 0.457 8 0 "[ . 1 . 2]"
3 41 LYS 13.380 0.992 5 13 "[** *+-**** ** **2]"
3 42 LEU 26.831 2.189 4 13 "[ *+.***-* ***** *]"
3 43 ASP 17.454 1.594 17 12 "[ * .***** *-*+* *]"
3 44 LEU 11.556 1.387 15 6 "[ *. -1 +* * *]"
3 45 ASP 5.584 1.446 13 1 "[ . 1 + . 2]"
3 46 THR 3.576 1.344 13 1 "[ . 1 + . 2]"
3 47 ALA 7.619 1.246 3 5 "[ + . - * .** 2]"
3 48 SER 0.000 0.000 . 0 "[ . 1 . 2]"
3 49 SER 6.994 0.680 12 4 "[ - . * 1 + * 2]"
3 50 GLN 0.517 0.162 5 0 "[ . 1 . 2]"
3 51 LEU 5.174 0.276 6 0 "[ . 1 . 2]"
3 52 ALA 3.520 0.276 6 0 "[ . 1 . 2]"
3 53 ASP 0.024 0.024 6 0 "[ . 1 . 2]"
3 54 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
3 55 VAL 1.988 0.256 7 0 "[ . 1 . 2]"
3 56 TYR 0.310 0.179 7 0 "[ . 1 . 2]"
3 57 GLU 6.682 0.680 12 4 "[ - . * 1 + * 2]"
3 58 VAL 10.438 1.246 3 7 "[ + * * ** .*- 2]"
3 59 VAL 5.654 0.480 10 0 "[ . 1 . 2]"
3 60 LEU 6.979 1.446 13 1 "[ . 1 + . 2]"
3 61 ARG 1.498 0.754 13 1 "[ . 1 + . 2]"
3 62 VAL 5.710 0.949 18 3 "[* . 1 . +-2]"
3 63 THR 0.035 0.035 19 0 "[ . 1 . 2]"
3 64 VAL 2.682 0.422 1 0 "[ . 1 . 2]"
3 65 THR 11.418 0.992 5 13 "[** *+-**** ** **2]"
3 66 ALA 8.470 0.639 7 3 "[ - * + 1 . 2]"
3 67 SER 17.062 1.203 5 20 [****+*******-*******]
3 68 LEU 12.532 1.185 13 11 "[* * * -**1**+ * *]"
3 69 GLY 28.214 1.735 13 10 "[ * ***1 +***- *]"
3 70 GLU 11.560 1.456 20 10 "[ * ***1 ****- +]"
3 71 GLU 11.928 1.735 13 9 "[ * ***1 +**- *]"
3 72 THR 0.000 0.000 . 0 "[ . 1 . 2]"
3 73 ALA 2.615 0.456 10 0 "[ . 1 . 2]"
3 74 PHE 2.014 0.407 19 0 "[ . 1 . 2]"
3 75 LEU 0.178 0.094 15 0 "[ . 1 . 2]"
3 76 CYS 0.934 0.267 20 0 "[ . 1 . 2]"
3 77 GLU 0.584 0.200 1 0 "[ . 1 . 2]"
3 78 VAL 2.664 0.409 13 0 "[ . 1 . 2]"
3 79 GLN 12.039 0.921 14 14 "[ * ** ***- *+*** **]"
3 80 GLN 1.484 0.295 3 0 "[ . 1 . 2]"
3 81 GLY 1.698 0.417 1 0 "[ . 1 . 2]"
3 82 GLY 0.385 0.135 8 0 "[ . 1 . 2]"
3 83 ILE 0.806 0.224 11 0 "[ . 1 . 2]"
3 84 PHE 3.445 0.608 5 3 "[ + 1 * . - 2]"
3 85 SER 0.628 0.262 2 0 "[ . 1 . 2]"
3 86 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
3 87 ALA 22.649 2.024 14 13 "[ - .*** ****+**** 2]"
3 88 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
3 89 ILE 9.532 1.421 19 6 "[* . *1- .** +2]"
3 90 GLU 0.010 0.008 18 0 "[ . 1 . 2]"
3 91 GLY 7.149 2.794 13 5 "[ *. * 1 +*.- 2]"
3 92 THR 1.767 0.466 19 0 "[ . 1 . 2]"
3 93 GLN 1.767 0.466 19 0 "[ . 1 . 2]"
3 94 MET 8.356 2.794 13 5 "[ *. * 1 +*.- 2]"
3 95 ALA 1.378 0.367 14 0 "[ . 1 . 2]"
3 96 HIS 11.859 0.740 10 10 "[*-* . **+** *. *2]"
3 97 CYS 0.721 0.118 12 0 "[ . 1 . 2]"
3 98 LEU 16.031 0.740 10 10 "[*-* . **+** *. *2]"
3 99 GLY 6.108 0.563 16 1 "[ . 1 .+ 2]"
3 100 ALA 10.254 0.741 4 6 "[* +. - 1 * .* * 2]"
3 101 TYR 1.032 0.147 20 0 "[ . 1 . 2]"
3 102 CYS 8.385 0.741 4 6 "[* +. - 1 * .* * 2]"
3 109 TYR 0.061 0.061 6 0 "[ . 1 . 2]"
3 110 ALA 3.205 0.239 7 0 "[ . 1 . 2]"
3 111 ARG 3.267 0.239 7 0 "[ . 1 . 2]"
3 112 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
3 113 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
3 114 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
3 115 THR 0.000 0.000 . 0 "[ . 1 . 2]"
3 116 SER 0.089 0.041 14 0 "[ . 1 . 2]"
3 117 MET 0.000 0.000 . 0 "[ . 1 . 2]"
3 118 VAL 0.089 0.041 14 0 "[ . 1 . 2]"
3 119 SER 0.050 0.050 3 0 "[ . 1 . 2]"
3 121 GLY 3.993 0.510 4 2 "[ +. 1 . - 2]"
3 122 THR 0.001 0.001 3 0 "[ . 1 . 2]"
3 123 PHE 4.295 0.510 4 2 "[ +. 1 . - 2]"
3 125 GLN 6.305 1.283 10 6 "[ . + *.*- **]"
3 126 LEU 6.074 0.681 15 1 "[ . 1 + 2]"
3 127 ASN 5.045 0.681 15 1 "[ . 1 + 2]"
3 128 LEU 11.186 0.949 18 8 "[* - . 1 * * *+**]"
3 129 ALA 3.929 0.761 13 4 "[ - . 1 + . * *]"
3 131 VAL 9.748 2.189 4 4 "[ +. 1 * - *]"
3 133 PHE 9.404 1.119 4 1 "[ +. 1 . 2]"
3 134 ASP 6.586 0.579 14 1 "[ . 1 +. 2]"
3 135 ALA 15.818 3.200 4 4 "[ *+. 1 -.* 2]"
3 136 LEU 2.976 0.377 5 0 "[ . 1 . 2]"
3 137 PHE 61.547 4.676 20 15 "[****.****1- * * ***+]"
3 138 MET 4.059 0.409 9 0 "[ . 1 . 2]"
3 139 ASN 0.149 0.107 17 0 "[ . 1 . 2]"
3 140 TYR 6.615 1.018 17 3 "[ . 1 * . + -]"
3 141 LEU 62.014 4.676 20 15 "[****.****1- * * ***+]"
4 9 MET 0.000 0.000 . 0 "[ . 1 . 2]"
4 10 THR 4.834 0.529 2 1 "[ + . 1 . 2]"
4 11 PHE 10.996 0.624 11 4 "[ . 1+ -* * 2]"
4 12 GLN 6.876 0.493 14 0 "[ . 1 . 2]"
4 13 ILE 0.047 0.033 14 0 "[ . 1 . 2]"
4 14 GLN 7.728 0.621 12 1 "[ . 1 + . 2]"
4 15 ARG 3.488 0.313 13 0 "[ . 1 . 2]"
4 16 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
4 17 TYR 0.136 0.114 9 0 "[ . 1 . 2]"
4 18 THR 0.001 0.001 3 0 "[ . 1 . 2]"
4 19 LYS 10.797 0.693 5 13 "[****+****- * *.* 2]"
4 20 ASP 7.880 0.558 12 1 "[ . 1 + . 2]"
4 21 ILE 6.494 0.816 19 7 "[ **.- * . *+*]"
4 22 SER 0.000 0.000 . 0 "[ . 1 . 2]"
4 23 PHE 11.190 0.599 13 4 "[* .-* 1 + . 2]"
4 24 GLU 11.028 0.599 13 4 "[* .-* 1 + . 2]"
4 25 ALA 0.515 0.146 2 0 "[ . 1 . 2]"
4 27 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
4 28 ALA 4.512 0.370 4 0 "[ . 1 . 2]"
4 30 HIS 1.781 0.370 4 0 "[ . 1 . 2]"
4 31 VAL 3.289 0.359 17 0 "[ . 1 . 2]"
4 32 PHE 2.160 0.359 17 0 "[ . 1 . 2]"
4 33 GLN 0.074 0.074 14 0 "[ . 1 . 2]"
4 34 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
4 35 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
4 36 TRP 2.188 1.589 12 1 "[ . 1 + . 2]"
4 37 GLN 0.740 0.563 5 1 "[ + 1 . 2]"
4 39 GLU 0.149 0.149 5 0 "[ . 1 . 2]"
4 40 VAL 21.814 2.066 15 11 "[* **. ***** **+ 2]"
4 41 LYS 7.096 0.702 3 6 "[* + . *1* *- 2]"
4 42 LEU 1.744 0.749 9 1 "[ . +1 . 2]"
4 43 ASP 0.460 0.182 7 0 "[ . 1 . 2]"
4 44 LEU 0.230 0.086 1 0 "[ . 1 . 2]"
4 45 ASP 5.919 0.433 5 0 "[ . 1 . 2]"
4 46 THR 5.930 0.433 5 0 "[ . 1 . 2]"
4 47 ALA 1.903 1.192 7 1 "[ . + 1 . 2]"
4 48 SER 0.184 0.156 19 0 "[ . 1 . 2]"
4 49 SER 2.136 0.255 10 0 "[ . 1 . 2]"
4 50 GLN 1.193 0.227 17 0 "[ . 1 . 2]"
4 51 LEU 4.864 0.532 16 1 "[ . 1 .+ 2]"
4 52 ALA 0.984 0.114 11 0 "[ . 1 . 2]"
4 53 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
4 54 ASP 0.181 0.077 20 0 "[ . 1 . 2]"
4 55 VAL 11.671 0.532 16 1 "[ . 1 .+ 2]"
4 56 TYR 7.513 0.372 19 0 "[ . 1 . 2]"
4 57 GLU 1.273 0.255 10 0 "[ . 1 . 2]"
4 58 VAL 4.321 1.192 7 4 "[ . + 1 - . * *]"
4 59 VAL 0.184 0.156 19 0 "[ . 1 . 2]"
4 60 LEU 4.412 0.650 20 3 "[ *- . 1 . +]"
4 61 ARG 0.425 0.191 11 0 "[ . 1 . 2]"
4 62 VAL 0.515 0.191 11 0 "[ . 1 . 2]"
4 63 THR 0.331 0.182 7 0 "[ . 1 . 2]"
4 64 VAL 0.677 0.153 1 0 "[ . 1 . 2]"
4 65 THR 18.533 2.066 15 11 "[* **. -**** **+ 2]"
4 66 ALA 8.972 0.976 4 3 "[ *+. * 1 . 2]"
4 67 SER 0.470 0.149 5 0 "[ . 1 . 2]"
4 68 LEU 4.009 1.589 12 2 "[ - 1 + . 2]"
4 69 GLY 0.190 0.190 19 0 "[ . 1 . 2]"
4 70 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
4 71 GLU 0.031 0.031 5 0 "[ . 1 . 2]"
4 72 THR 0.000 0.000 . 0 "[ . 1 . 2]"
4 73 ALA 0.538 0.231 9 0 "[ . 1 . 2]"
4 74 PHE 9.732 0.594 10 2 "[ -. + . 2]"
4 75 LEU 5.645 0.594 10 1 "[ . + . 2]"
4 76 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
4 77 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
4 78 VAL 0.787 0.127 1 0 "[ . 1 . 2]"
4 79 GLN 19.248 0.693 5 13 "[****+****- * *.* 2]"
4 80 GLN 0.805 0.147 5 0 "[ . 1 . 2]"
4 81 GLY 0.215 0.075 19 0 "[ . 1 . 2]"
4 82 GLY 4.214 0.650 20 3 "[ *- . 1 . +]"
4 83 ILE 6.510 0.621 12 1 "[ . 1 + . 2]"
4 84 PHE 0.351 0.277 1 0 "[ . 1 . 2]"
4 85 SER 0.000 0.000 . 0 "[ . 1 . 2]"
4 86 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
4 87 ALA 11.660 0.752 18 7 "[ - .** * *. + *]"
4 88 GLY 3.605 0.234 3 0 "[ . 1 . 2]"
4 89 ILE 13.511 0.752 18 7 "[ - .** * *. + *]"
4 90 GLU 1.225 0.351 14 0 "[ . 1 . 2]"
4 91 GLY 3.497 1.297 3 4 "[- + . 1** . 2]"
4 92 THR 5.113 0.331 20 0 "[ . 1 . 2]"
4 93 GLN 2.940 0.329 18 0 "[ . 1 . 2]"
4 94 MET 7.472 1.297 3 4 "[- + . 1** . 2]"
4 95 ALA 0.458 0.305 16 0 "[ . 1 . 2]"
4 96 HIS 3.836 0.349 13 0 "[ . 1 . 2]"
4 97 CYS 0.004 0.004 20 0 "[ . 1 . 2]"
4 98 LEU 6.663 0.834 18 3 "[ . 1 - . + *]"
4 99 GLY 0.857 0.250 19 0 "[ . 1 . 2]"
4 100 ALA 8.056 0.763 2 4 "[ + . * 1 . -*]"
4 101 TYR 0.637 0.161 8 0 "[ . 1 . 2]"
4 102 CYS 11.997 0.763 2 8 "[ + . * 1* -* ***]"
4 105 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
4 109 TYR 1.298 0.141 5 0 "[ . 1 . 2]"
4 110 ALA 4.307 0.297 1 0 "[ . 1 . 2]"
4 111 ARG 0.033 0.033 3 0 "[ . 1 . 2]"
4 112 GLU 2.955 0.297 1 0 "[ . 1 . 2]"
4 113 CYS 1.668 0.210 2 0 "[ . 1 . 2]"
4 114 ILE 1.027 0.081 17 0 "[ . 1 . 2]"
4 115 THR 0.491 0.210 2 0 "[ . 1 . 2]"
4 116 SER 0.000 0.000 . 0 "[ . 1 . 2]"
4 117 MET 0.000 0.000 . 0 "[ . 1 . 2]"
4 118 VAL 0.006 0.006 4 0 "[ . 1 . 2]"
4 119 SER 0.006 0.006 4 0 "[ . 1 . 2]"
4 121 GLY 5.037 0.433 11 0 "[ . 1 . 2]"
4 122 THR 0.041 0.014 7 0 "[ . 1 . 2]"
4 123 PHE 5.079 0.433 11 0 "[ . 1 . 2]"
4 125 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
4 126 LEU 1.764 0.242 5 0 "[ . 1 . 2]"
4 127 ASN 0.912 0.242 5 0 "[ . 1 . 2]"
4 128 LEU 5.597 1.239 9 3 "[ . +1 *. -]"
4 129 ALA 5.011 1.239 9 4 "[ *. +1 *. -]"
4 131 VAL 8.716 1.021 2 9 "[*+ -. 1****.** 2]"
4 133 PHE 31.418 2.532 14 15 "[****.* **1*-*+*** *2]"
4 134 ASP 2.846 0.491 16 0 "[ . 1 . 2]"
4 135 ALA 5.279 0.524 12 1 "[ . 1 + . 2]"
4 136 LEU 15.661 2.532 14 12 "[****.- **1 +*** *2]"
4 137 PHE 2.161 0.611 20 1 "[ . 1 . +]"
4 138 MET 1.087 0.272 18 0 "[ . 1 . 2]"
4 139 ASN 1.655 0.249 4 0 "[ . 1 . 2]"
4 140 TYR 1.214 0.334 4 0 "[ . 1 . 2]"
4 141 LEU 2.414 0.611 20 1 "[ . 1 . +]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 9 MET H 1 10 THR H 3.310 . 4.820 4.451 4.116 4.636 . 0 0 "[ . 1 . 2]" 1
2 1 10 THR H 1 11 PHE H 3.040 . 4.280 4.036 3.720 4.245 . 0 0 "[ . 1 . 2]" 1
3 1 10 THR H 1 87 ALA H 2.380 . 2.960 3.109 2.741 3.756 0.796 3 3 "[ + . * 1 -. 2]" 1
4 1 11 PHE H 1 12 GLN H 3.140 . 4.480 4.149 4.021 4.432 . 0 0 "[ . 1 . 2]" 1
5 1 11 PHE QD 1 12 GLN H 3.370 . 4.940 4.431 2.992 4.800 . 0 0 "[ . 1 . 2]" 1
6 1 12 GLN H 1 13 ILE H 3.050 . 4.300 4.140 3.953 4.305 0.005 1 0 "[ . 1 . 2]" 1
7 1 12 GLN H 1 85 SER H 2.950 . 4.100 3.204 2.818 3.735 . 0 0 "[ . 1 . 2]" 1
8 1 13 ILE H 1 14 GLN H 3.300 . 4.800 4.388 4.100 4.600 . 0 0 "[ . 1 . 2]" 1
9 1 14 GLN H 1 15 ARG H 2.070 . 2.340 2.345 2.053 2.572 0.232 16 0 "[ . 1 . 2]" 1
10 1 14 GLN H 1 83 ILE H 3.080 . 4.360 4.672 4.342 5.068 0.708 20 5 "[-* * 1 * . +]" 1
11 1 14 GLN H 1 85 SER H 3.240 . 4.680 3.926 3.324 4.348 . 0 0 "[ . 1 . 2]" 1
12 1 15 ARG H 1 16 ILE H 3.180 . 4.560 4.238 4.058 4.367 . 0 0 "[ . 1 . 2]" 1
13 1 15 ARG H 1 83 ILE H 2.550 . 3.300 3.267 3.044 3.579 0.279 20 0 "[ . 1 . 2]" 1
14 1 16 ILE H 1 17 TYR H 3.200 . 4.600 4.116 3.828 4.404 . 0 0 "[ . 1 . 2]" 1
15 1 16 ILE H 1 17 TYR QD 3.510 . 5.220 2.976 2.188 3.919 . 0 0 "[ . 1 . 2]" 1
16 1 17 TYR H 1 18 THR H 3.190 . 4.580 4.362 4.296 4.408 . 0 0 "[ . 1 . 2]" 1
17 1 17 TYR H 1 81 GLY H 2.870 . 3.940 4.038 3.741 4.230 0.290 8 0 "[ . 1 . 2]" 1
18 1 17 TYR QD 1 18 THR H 3.020 . 4.240 3.339 2.954 3.867 . 0 0 "[ . 1 . 2]" 1
19 1 17 TYR QD 2 28 ALA MB 3.410 . 5.020 4.823 3.147 6.953 1.933 14 9 "[ -*.* *** +.* *2]" 1
20 1 17 TYR QE 2 28 ALA MB 3.150 . 4.500 4.649 1.576 8.622 4.122 16 9 "[ -*.* *** *.+ *2]" 1
21 1 18 THR H 1 19 LYS H 3.270 . 4.740 4.403 4.266 4.540 . 0 0 "[ . 1 . 2]" 1
22 1 18 THR H 2 121 GLY H 3.280 . 4.760 4.520 4.053 4.987 0.227 16 0 "[ . 1 . 2]" 1
23 1 19 LYS H 1 20 ASP H 2.040 . 2.280 2.294 2.138 2.429 0.149 14 0 "[ . 1 . 2]" 1
24 1 19 LYS H 1 79 GLN H 3.160 . 4.520 4.899 4.709 5.228 0.708 10 4 "[ . -*+ * . 2]" 1
25 1 19 LYS H 1 81 GLY H 2.730 . 3.660 2.527 2.336 2.836 . 0 0 "[ . 1 . 2]" 1
26 1 20 ASP H 1 21 ILE H 3.160 . 4.520 4.261 4.183 4.347 . 0 0 "[ . 1 . 2]" 1
27 1 20 ASP H 1 79 GLN H 2.700 . 3.600 3.451 3.287 3.644 0.044 8 0 "[ . 1 . 2]" 1
28 1 21 ILE H 1 22 SER H 3.200 . 4.600 4.276 4.214 4.352 . 0 0 "[ . 1 . 2]" 1
29 1 21 ILE H 2 23 PHE H 2.860 . 3.920 2.890 2.606 3.162 . 0 0 "[ . 1 . 2]" 1
30 1 22 SER H 1 23 PHE H 3.170 . 4.540 4.064 3.765 4.211 . 0 0 "[ . 1 . 2]" 1
31 1 22 SER H 1 77 GLU H 2.760 . 3.720 3.247 2.990 3.608 . 0 0 "[ . 1 . 2]" 1
32 1 22 SER H 1 78 VAL MG2 3.240 . 4.680 3.141 2.950 3.308 . 0 0 "[ . 1 . 2]" 1
33 1 22 SER H 1 117 MET ME 3.370 . 4.940 3.157 2.848 3.448 . 0 0 "[ . 1 . 2]" 1
34 1 23 PHE H 1 24 GLU H 3.080 . 4.360 4.192 3.926 4.412 0.052 12 0 "[ . 1 . 2]" 1
35 1 23 PHE H 2 21 ILE H 2.440 . 3.080 2.717 2.521 2.896 . 0 0 "[ . 1 . 2]" 1
36 1 23 PHE QD 1 24 GLU H 2.730 . 3.660 3.686 3.231 3.992 0.332 4 0 "[ . 1 . 2]" 1
37 1 23 PHE QD 1 117 MET ME 3.390 . 4.980 2.460 2.147 2.763 . 0 0 "[ . 1 . 2]" 1
38 1 23 PHE QD 2 21 ILE H 2.980 . 4.160 3.495 2.840 4.141 . 0 0 "[ . 1 . 2]" 1
39 1 23 PHE QE 1 24 GLU H 3.360 . 4.920 4.722 4.088 5.099 0.179 1 0 "[ . 1 . 2]" 1
40 1 23 PHE QE 1 25 ALA MB 3.040 . 4.280 2.823 2.518 3.136 . 0 0 "[ . 1 . 2]" 1
41 1 23 PHE QE 1 74 PHE QD 3.500 . 5.200 2.609 2.350 2.981 . 0 0 "[ . 1 . 2]" 1
42 1 23 PHE QE 1 121 GLY H 3.470 . 5.140 4.245 3.731 4.718 . 0 0 "[ . 1 . 2]" 1
43 1 24 GLU H 1 25 ALA H 3.200 . 4.600 4.247 3.974 4.422 . 0 0 "[ . 1 . 2]" 1
44 1 24 GLU H 1 75 LEU H 2.620 . 3.440 3.018 2.717 3.498 0.058 14 0 "[ . 1 . 2]" 1
45 1 25 ALA MB 1 28 ALA H 3.350 . 4.900 3.245 2.973 3.581 . 0 0 "[ . 1 . 2]" 1
46 1 25 ALA MB 1 28 ALA MB 3.010 . 4.220 1.873 1.637 2.058 0.163 2 0 "[ . 1 . 2]" 1
47 1 25 ALA MB 1 123 PHE QE 3.480 . 5.160 2.293 2.071 2.714 . 0 0 "[ . 1 . 2]" 1
48 1 27 ASN H 1 28 ALA H 2.490 . 3.180 2.681 2.510 3.007 . 0 0 "[ . 1 . 2]" 1
49 1 28 ALA H 1 30 HIS H 2.890 . 3.990 3.995 3.822 4.200 0.210 12 0 "[ . 1 . 2]" 1
50 1 28 ALA MB 1 30 HIS H 3.530 . 5.250 4.342 4.218 4.436 . 0 0 "[ . 1 . 2]" 1
51 1 28 ALA MB 2 17 TYR QD 3.300 . 4.800 2.686 2.207 3.362 . 0 0 "[ . 1 . 2]" 1
52 1 28 ALA MB 2 17 TYR QE 3.010 . 4.220 1.969 1.711 2.354 0.089 9 0 "[ . 1 . 2]" 1
53 1 30 HIS H 1 31 VAL H 2.300 . 2.800 2.502 2.314 2.660 . 0 0 "[ . 1 . 2]" 1
54 1 30 HIS H 1 31 VAL QG 3.510 . 5.220 3.687 3.226 4.007 . 0 0 "[ . 1 . 2]" 1
55 1 30 HIS H 1 32 PHE H 3.200 . 4.600 4.258 3.920 4.760 0.160 14 0 "[ . 1 . 2]" 1
56 1 31 VAL H 1 32 PHE H 2.360 . 2.920 2.667 2.445 2.892 . 0 0 "[ . 1 . 2]" 1
57 1 31 VAL H 1 33 GLN H 3.240 . 4.680 4.352 4.018 4.749 0.069 3 0 "[ . 1 . 2]" 1
58 1 31 VAL H 1 34 LYS H 3.300 . 4.800 4.862 4.593 5.284 0.484 9 0 "[ . 1 . 2]" 1
59 1 31 VAL QG 1 32 PHE H 3.260 . 4.720 2.992 2.277 3.544 . 0 0 "[ . 1 . 2]" 1
60 1 31 VAL QG 1 36 TRP HE1 2.470 . 3.140 3.898 2.264 8.211 5.071 19 7 "[ *-** 1 ** . +2]" 1
61 1 31 VAL QG 1 123 PHE QE 3.200 . 4.600 1.922 1.524 2.348 0.276 12 0 "[ . 1 . 2]" 1
62 1 32 PHE H 1 33 GLN H 2.310 . 2.820 2.580 2.415 2.798 . 0 0 "[ . 1 . 2]" 1
63 1 32 PHE H 1 34 LYS H 2.940 . 4.080 3.916 3.585 4.238 0.158 20 0 "[ . 1 . 2]" 1
64 1 32 PHE QD 1 33 GLN H 3.190 . 4.580 3.954 3.498 4.332 . 0 0 "[ . 1 . 2]" 1
65 1 33 GLN H 1 34 LYS H 2.070 . 2.340 2.361 2.142 2.563 0.223 9 0 "[ . 1 . 2]" 1
66 1 34 LYS H 1 35 ASP H 3.310 . 4.820 4.602 4.559 4.629 . 0 0 "[ . 1 . 2]" 1
67 1 35 ASP H 1 36 TRP H 3.310 . 4.820 4.557 4.435 4.648 . 0 0 "[ . 1 . 2]" 1
68 1 35 ASP H 1 37 GLN H 3.480 . 5.160 5.242 4.576 5.603 0.443 20 0 "[ . 1 . 2]" 1
69 1 35 ASP H 1 68 LEU QD 2.210 . 2.620 3.336 2.004 4.942 2.322 19 12 "[ * *** **** .* -+*]" 1
70 1 36 TRP H 1 37 GLN H 2.820 . 3.840 3.759 3.490 4.088 0.248 9 0 "[ . 1 . 2]" 1
71 1 37 GLN H 1 68 LEU QD 2.930 . 4.060 2.809 1.786 3.640 0.014 10 0 "[ . 1 . 2]" 1
72 1 39 GLU H 1 40 VAL H 2.960 . 4.120 4.287 3.888 4.481 0.361 15 0 "[ . 1 . 2]" 1
73 1 39 GLU H 1 66 ALA MB 3.010 . 4.220 4.323 3.850 4.796 0.576 19 1 "[ . 1 . +2]" 1
74 1 39 GLU H 1 67 SER H 1.930 . 2.060 2.665 2.024 3.239 1.179 6 12 "[ * *.+ - 1* *******]" 1
75 1 39 GLU H 1 68 LEU H 3.230 . 4.660 4.618 4.013 5.325 0.665 6 1 "[ .+ 1 . 2]" 1
76 1 40 VAL H 1 41 LYS H 3.270 . 4.740 4.247 4.013 4.513 . 0 0 "[ . 1 . 2]" 1
77 1 40 VAL MG1 1 41 LYS H 3.390 . 4.980 3.520 2.432 4.142 . 0 0 "[ . 1 . 2]" 1
78 1 40 VAL MG1 1 126 LEU QD 2.430 . 3.020 2.309 1.732 3.360 0.340 15 0 "[ . 1 . 2]" 1
79 1 40 VAL MG2 1 41 LYS H 3.490 . 5.180 4.177 2.622 4.411 . 0 0 "[ . 1 . 2]" 1
80 1 41 LYS H 1 42 LEU H 3.270 . 4.740 4.409 4.171 4.561 . 0 0 "[ . 1 . 2]" 1
81 1 41 LYS H 1 42 LEU QD 3.460 . 5.120 4.501 3.095 6.112 0.992 9 4 "[ .* +1 *. - 2]" 1
82 1 41 LYS H 1 64 VAL MG1 3.010 . 4.220 4.309 3.449 5.052 0.832 19 2 "[ . 1 . +-]" 1
83 1 41 LYS H 1 65 THR H 2.470 . 3.140 3.242 2.609 3.934 0.794 18 2 "[ . 1 - . + 2]" 1
84 1 42 LEU H 1 43 ASP H 3.170 . 4.540 4.331 4.008 4.571 0.031 14 0 "[ . 1 . 2]" 1
85 1 42 LEU QD 1 128 LEU QD 3.210 . 3.680 2.111 1.727 2.737 0.073 4 0 "[ . 1 . 2]" 1
86 1 43 ASP H 1 44 LEU H 2.970 . 4.140 4.300 4.076 4.498 0.358 5 0 "[ . 1 . 2]" 1
87 1 43 ASP H 1 44 LEU QD 3.200 . 4.600 4.059 3.229 5.815 1.215 13 3 "[ . 1 + . * -]" 1
88 1 43 ASP H 1 62 VAL QG 3.380 . 4.960 3.685 3.102 4.346 . 0 0 "[ . 1 . 2]" 1
89 1 43 ASP H 1 63 THR H 2.810 . 3.820 2.982 2.632 3.418 . 0 0 "[ . 1 . 2]" 1
90 1 43 ASP H 1 128 LEU QD 2.940 . 4.080 4.911 3.481 6.231 2.151 8 14 "[ ** .**+** ** .****-]" 1
91 1 44 LEU H 1 45 ASP H 3.270 . 4.740 4.379 4.191 4.499 . 0 0 "[ . 1 . 2]" 1
92 1 44 LEU H 1 63 THR H 3.470 . 5.140 4.995 4.777 5.413 0.273 13 0 "[ . 1 . 2]" 1
93 1 44 LEU QD 1 45 ASP H 3.320 . 4.830 3.876 2.647 4.496 . 0 0 "[ . 1 . 2]" 1
94 1 44 LEU QD 1 60 LEU MD2 3.410 . 5.020 3.155 1.926 4.130 . 0 0 "[ . 1 . 2]" 1
95 1 44 LEU QD 1 62 VAL QG 2.660 . 3.520 2.932 1.801 4.115 0.595 18 1 "[ . 1 . + 2]" 1
96 1 44 LEU QD 1 63 THR H 3.420 . 5.040 4.479 3.366 5.757 0.717 18 2 "[ . 1 - . + 2]" 1
97 1 44 LEU QD 1 128 LEU QD 2.990 . 4.180 3.914 1.976 5.930 1.750 18 4 "[ . * 1 *- . + 2]" 1
98 1 44 LEU QD 1 131 VAL QG 3.220 . 4.640 2.849 1.716 4.834 0.194 14 0 "[ . 1 . 2]" 1
99 1 45 ASP H 1 46 THR H 3.120 . 4.440 4.345 4.194 4.488 0.048 6 0 "[ . 1 . 2]" 1
100 1 45 ASP H 1 60 LEU MD2 2.730 . 3.660 2.642 2.109 3.136 . 0 0 "[ . 1 . 2]" 1
101 1 45 ASP H 1 61 ARG H 2.560 . 3.320 3.401 2.842 3.914 0.594 15 1 "[ . 1 + 2]" 1
102 1 45 ASP H 1 62 VAL QG 3.470 . 5.140 3.924 3.577 4.405 . 0 0 "[ . 1 . 2]" 1
103 1 46 THR H 1 47 ALA H 3.260 . 4.720 4.315 4.181 4.440 . 0 0 "[ . 1 . 2]" 1
104 1 47 ALA H 1 48 SER H 3.110 . 4.410 4.269 3.995 4.410 . 0 0 "[ . 1 . 2]" 1
105 1 47 ALA H 1 58 VAL QG 2.660 . 3.520 3.478 2.802 4.796 1.276 15 3 "[ .- 1 + * 2]" 1
106 1 47 ALA H 1 59 VAL H 2.870 . 3.940 3.247 2.814 3.696 . 0 0 "[ . 1 . 2]" 1
107 1 47 ALA H 1 61 ARG H 3.460 . 5.120 4.700 3.854 5.343 0.223 6 0 "[ . 1 . 2]" 1
108 1 47 ALA MB 1 48 SER H 2.810 . 3.820 2.981 2.671 3.443 . 0 0 "[ . 1 . 2]" 1
109 1 47 ALA MB 1 59 VAL H 3.240 . 4.680 3.573 3.074 4.235 . 0 0 "[ . 1 . 2]" 1
110 1 48 SER H 1 49 SER H 3.260 . 4.720 4.550 4.435 4.664 . 0 0 "[ . 1 . 2]" 1
111 1 48 SER H 1 59 VAL H 3.410 . 5.020 4.932 4.623 5.159 0.139 6 0 "[ . 1 . 2]" 1
112 1 49 SER H 1 50 GLN H 2.970 . 4.140 4.075 3.877 4.368 0.228 4 0 "[ . 1 . 2]" 1
113 1 49 SER H 1 57 GLU H 2.620 . 3.440 3.218 2.800 3.730 0.290 5 0 "[ . 1 . 2]" 1
114 1 49 SER H 1 58 VAL H 3.500 . 5.200 5.048 4.820 5.499 0.299 18 0 "[ . 1 . 2]" 1
115 1 49 SER H 1 58 VAL QG 3.350 . 4.900 3.764 3.237 4.146 . 0 0 "[ . 1 . 2]" 1
116 1 49 SER H 1 59 VAL H 3.460 . 5.120 5.242 4.485 5.840 0.720 6 2 "[- .+ 1 . 2]" 1
117 1 50 GLN H 1 51 LEU H 3.300 . 4.800 4.339 4.240 4.450 . 0 0 "[ . 1 . 2]" 1
118 1 50 GLN H 1 57 GLU H 3.390 . 4.980 4.976 4.575 5.197 0.217 10 0 "[ . 1 . 2]" 1
119 1 51 LEU H 1 52 ALA H 1.980 . 2.160 2.298 1.934 2.468 0.308 19 0 "[ . 1 . 2]" 1
120 1 51 LEU H 1 55 VAL H 3.290 . 4.780 4.634 4.361 4.974 0.194 17 0 "[ . 1 . 2]" 1
121 1 51 LEU H 1 55 VAL MG1 3.280 . 4.760 3.580 3.143 3.901 . 0 0 "[ . 1 . 2]" 1
122 1 51 LEU H 1 57 GLU H 3.040 . 4.280 3.665 3.197 4.358 0.078 3 0 "[ . 1 . 2]" 1
123 1 51 LEU MD1 1 52 ALA H 3.500 . 5.200 4.553 4.336 4.749 . 0 0 "[ . 1 . 2]" 1
124 1 51 LEU MD1 1 55 VAL MG1 2.860 . 3.920 2.406 2.030 2.930 . 0 0 "[ . 1 . 2]" 1
125 1 51 LEU MD1 1 57 GLU H 3.180 . 4.560 3.604 2.974 4.388 . 0 0 "[ . 1 . 2]" 1
126 1 52 ALA H 1 53 ASP H 3.170 . 4.540 4.351 4.331 4.373 . 0 0 "[ . 1 . 2]" 1
127 1 52 ALA H 1 55 VAL H 2.880 . 3.960 3.301 3.030 3.843 . 0 0 "[ . 1 . 2]" 1
128 1 52 ALA H 1 55 VAL MG1 3.020 . 4.240 3.506 3.276 3.786 . 0 0 "[ . 1 . 2]" 1
129 1 52 ALA H 1 55 VAL MG2 3.340 . 4.880 3.877 3.642 4.220 . 0 0 "[ . 1 . 2]" 1
130 1 52 ALA MB 1 53 ASP H 2.310 . 2.820 2.097 1.995 2.333 . 0 0 "[ . 1 . 2]" 1
131 1 52 ALA MB 1 55 VAL MG2 3.130 . 4.460 2.085 1.960 2.384 . 0 0 "[ . 1 . 2]" 1
132 1 53 ASP H 1 54 ASP H 3.270 . 4.740 4.358 4.214 4.520 . 0 0 "[ . 1 . 2]" 1
133 1 53 ASP H 1 55 VAL H 3.400 . 5.000 4.160 3.943 4.377 . 0 0 "[ . 1 . 2]" 1
134 1 53 ASP H 1 55 VAL MG2 3.490 . 5.180 3.825 3.568 4.142 . 0 0 "[ . 1 . 2]" 1
135 1 54 ASP H 1 55 VAL H 2.290 . 2.780 2.741 2.535 2.902 0.122 3 0 "[ . 1 . 2]" 1
136 1 54 ASP H 1 56 TYR QE 3.320 . 4.840 3.757 2.372 4.584 . 0 0 "[ . 1 . 2]" 1
137 1 55 VAL H 1 56 TYR H 2.860 . 3.920 4.257 4.022 4.393 0.473 20 0 "[ . 1 . 2]" 1
138 1 55 VAL H 1 56 TYR QD 3.220 . 4.640 4.265 3.284 4.714 0.074 20 0 "[ . 1 . 2]" 1
139 1 55 VAL H 1 56 TYR QE 3.240 . 4.680 4.250 3.545 4.921 0.241 4 0 "[ . 1 . 2]" 1
140 1 55 VAL MG1 1 56 TYR H 3.110 . 4.420 3.012 2.880 3.196 . 0 0 "[ . 1 . 2]" 1
141 1 56 TYR H 1 57 GLU H 3.220 . 4.640 4.289 4.156 4.462 . 0 0 "[ . 1 . 2]" 1
142 1 56 TYR H 1 84 PHE H 3.050 . 4.300 3.579 3.263 4.034 . 0 0 "[ . 1 . 2]" 1
143 1 56 TYR H 1 86 ILE H 3.120 . 4.440 3.572 2.926 4.142 . 0 0 "[ . 1 . 2]" 1
144 1 56 TYR QD 1 57 GLU H 3.370 . 4.940 4.309 3.473 4.847 . 0 0 "[ . 1 . 2]" 1
145 1 57 GLU H 1 58 VAL H 3.200 . 4.600 4.326 4.071 4.558 . 0 0 "[ . 1 . 2]" 1
146 1 57 GLU H 1 84 PHE H 3.380 . 4.960 4.647 4.459 5.026 0.066 11 0 "[ . 1 . 2]" 1
147 1 58 VAL H 1 59 VAL H 3.240 . 4.680 4.304 4.220 4.412 . 0 0 "[ . 1 . 2]" 1
148 1 58 VAL H 1 82 GLY H 2.550 . 3.300 3.404 3.077 3.829 0.529 15 1 "[ . 1 + 2]" 1
149 1 58 VAL H 1 84 PHE H 3.000 . 4.200 4.025 3.422 4.529 0.329 17 0 "[ . 1 . 2]" 1
150 1 58 VAL H 1 84 PHE QD 3.210 . 4.620 2.601 2.139 2.998 . 0 0 "[ . 1 . 2]" 1
151 1 58 VAL H 1 84 PHE QE 3.290 . 4.780 3.112 2.521 3.663 . 0 0 "[ . 1 . 2]" 1
152 1 58 VAL QG 1 59 VAL H 2.650 . 3.500 3.025 2.708 3.624 0.124 6 0 "[ . 1 . 2]" 1
153 1 58 VAL QG 1 98 LEU MD2 2.570 . 3.340 2.649 1.887 4.102 0.762 12 2 "[- . 1 + . 2]" 1
154 1 59 VAL H 1 60 LEU H 3.230 . 4.660 4.434 4.322 4.528 . 0 0 "[ . 1 . 2]" 1
155 1 59 VAL MG1 1 60 LEU H 2.700 . 3.600 2.576 2.067 2.946 . 0 0 "[ . 1 . 2]" 1
156 1 59 VAL MG1 1 80 GLN H 3.300 . 4.800 3.681 3.319 3.812 . 0 0 "[ . 1 . 2]" 1
157 1 59 VAL MG1 1 81 GLY H 3.400 . 5.000 3.535 3.151 4.020 . 0 0 "[ . 1 . 2]" 1
158 1 59 VAL MG2 1 60 LEU H 3.510 . 5.220 4.076 3.970 4.221 . 0 0 "[ . 1 . 2]" 1
159 1 60 LEU H 1 61 ARG H 3.250 . 4.700 4.228 4.071 4.328 . 0 0 "[ . 1 . 2]" 1
160 1 60 LEU H 1 80 GLN H 2.880 . 3.960 3.612 3.122 3.974 0.014 16 0 "[ . 1 . 2]" 1
161 1 60 LEU H 1 81 GLY H 3.280 . 4.760 4.530 4.357 4.745 . 0 0 "[ . 1 . 2]" 1
162 1 60 LEU H 1 82 GLY H 3.480 . 5.160 4.716 4.334 5.130 . 0 0 "[ . 1 . 2]" 1
163 1 60 LEU MD1 1 62 VAL QG 2.930 . 4.060 2.352 1.869 2.637 . 0 0 "[ . 1 . 2]" 1
164 1 60 LEU MD1 1 110 ALA MB 3.240 . 4.680 2.529 2.133 2.946 . 0 0 "[ . 1 . 2]" 1
165 1 60 LEU MD2 1 61 ARG H 2.380 . 2.960 2.506 2.382 2.583 . 0 0 "[ . 1 . 2]" 1
166 1 60 LEU MD2 1 62 VAL H 3.230 . 4.660 3.435 3.088 4.235 . 0 0 "[ . 1 . 2]" 1
167 1 60 LEU MD2 1 62 VAL QG 2.350 . 2.900 1.942 1.730 2.556 0.070 14 0 "[ . 1 . 2]" 1
168 1 61 ARG H 1 62 VAL H 3.090 . 4.380 4.162 4.071 4.377 . 0 0 "[ . 1 . 2]" 1
169 1 61 ARG H 1 62 VAL QG 3.370 . 4.940 4.210 3.874 4.420 . 0 0 "[ . 1 . 2]" 1
170 1 62 VAL H 1 63 THR H 3.040 . 4.280 4.409 4.203 4.522 0.242 19 0 "[ . 1 . 2]" 1
171 1 62 VAL H 1 78 VAL H 2.890 . 3.980 3.310 3.132 3.650 . 0 0 "[ . 1 . 2]" 1
172 1 62 VAL H 1 80 GLN H 3.230 . 4.660 3.965 3.642 4.179 . 0 0 "[ . 1 . 2]" 1
173 1 62 VAL QG 1 63 THR H 3.000 . 4.200 2.603 2.290 3.066 . 0 0 "[ . 1 . 2]" 1
174 1 62 VAL QG 1 64 VAL MG2 3.070 . 4.340 2.367 2.088 2.743 . 0 0 "[ . 1 . 2]" 1
175 1 62 VAL QG 1 110 ALA MB 2.990 . 4.180 1.959 1.728 2.233 0.072 2 0 "[ . 1 . 2]" 1
176 1 62 VAL QG 1 128 LEU QD 3.190 . 4.580 2.565 1.781 4.281 0.019 3 0 "[ . 1 . 2]" 1
177 1 63 THR H 1 64 VAL H 3.290 . 4.780 4.350 4.212 4.485 . 0 0 "[ . 1 . 2]" 1
178 1 64 VAL H 1 65 THR H 3.030 . 4.260 4.038 3.860 4.346 0.086 8 0 "[ . 1 . 2]" 1
179 1 64 VAL H 1 75 LEU MD1 3.080 . 4.360 3.145 2.795 3.512 . 0 0 "[ . 1 . 2]" 1
180 1 64 VAL H 1 76 CYS H 2.600 . 3.400 3.171 2.801 3.426 0.026 12 0 "[ . 1 . 2]" 1
181 1 64 VAL MG1 1 65 THR H 2.920 . 4.040 3.103 2.561 3.315 . 0 0 "[ . 1 . 2]" 1
182 1 64 VAL MG1 1 126 LEU QD 3.420 . 5.040 2.708 2.043 4.152 . 0 0 "[ . 1 . 2]" 1
183 1 65 THR H 1 66 ALA H 3.270 . 4.740 4.412 4.287 4.529 . 0 0 "[ . 1 . 2]" 1
184 1 65 THR H 1 75 LEU MD1 3.450 . 5.100 3.937 3.678 4.395 . 0 0 "[ . 1 . 2]" 1
185 1 65 THR H 1 76 CYS H 3.510 . 5.220 4.927 4.757 5.134 . 0 0 "[ . 1 . 2]" 1
186 1 66 ALA H 1 67 SER H 2.980 . 4.160 4.124 3.950 4.319 0.159 10 0 "[ . 1 . 2]" 1
187 1 66 ALA H 1 73 ALA H 3.220 . 4.640 4.610 4.208 4.918 0.278 2 0 "[ . 1 . 2]" 1
188 1 66 ALA H 1 74 PHE H 2.700 . 3.600 3.395 3.208 3.560 . 0 0 "[ . 1 . 2]" 1
189 1 66 ALA H 1 76 CYS H 3.520 . 5.240 4.965 4.536 5.296 0.056 8 0 "[ . 1 . 2]" 1
190 1 66 ALA MB 1 67 SER H 3.040 . 4.280 3.355 2.961 3.522 . 0 0 "[ . 1 . 2]" 1
191 1 66 ALA MB 1 73 ALA H 3.450 . 5.100 3.788 3.590 3.986 . 0 0 "[ . 1 . 2]" 1
192 1 66 ALA MB 1 73 ALA MB 3.070 . 4.340 2.355 1.985 2.684 . 0 0 "[ . 1 . 2]" 1
193 1 66 ALA MB 1 74 PHE H 2.970 . 4.140 2.650 2.395 2.923 . 0 0 "[ . 1 . 2]" 1
194 1 66 ALA MB 1 74 PHE QD 3.160 . 4.520 3.089 1.756 3.250 0.044 14 0 "[ . 1 . 2]" 1
195 1 66 ALA MB 1 74 PHE QE 2.730 . 3.660 2.882 2.680 3.004 . 0 0 "[ . 1 . 2]" 1
196 1 66 ALA MB 1 126 LEU QD 2.990 . 4.180 2.903 2.014 4.824 0.644 12 1 "[ . 1 + . 2]" 1
197 1 67 SER H 1 68 LEU H 3.180 . 4.560 4.292 4.171 4.437 . 0 0 "[ . 1 . 2]" 1
198 1 67 SER H 1 69 GLY H 3.420 . 5.040 5.229 4.906 5.739 0.699 6 1 "[ .+ 1 . 2]" 1
199 1 67 SER H 1 73 ALA H 3.180 . 4.560 4.383 4.162 4.779 0.219 6 0 "[ . 1 . 2]" 1
200 1 68 LEU H 1 69 GLY H 2.630 . 3.460 3.875 3.630 3.987 0.527 2 2 "[ + . - . 2]" 1
201 1 68 LEU H 1 71 GLU H 3.320 . 4.830 4.308 3.906 4.737 . 0 0 "[ . 1 . 2]" 1
202 1 68 LEU H 1 73 ALA H 2.770 . 3.740 3.239 2.373 4.182 0.442 19 0 "[ . 1 . 2]" 1
203 1 68 LEU H 1 73 ALA MB 3.180 . 4.560 3.360 2.590 4.410 . 0 0 "[ . 1 . 2]" 1
204 1 68 LEU QD 1 73 ALA H 3.260 . 4.720 4.306 2.630 6.557 1.837 19 7 "[ *. **1* -* +2]" 1
205 1 68 LEU QD 1 73 ALA MB 2.880 . 3.960 2.961 1.763 5.310 1.350 19 3 "[ . 1- * +2]" 1
206 1 69 GLY H 1 70 GLU H 3.120 . 4.440 4.282 3.927 4.546 0.106 20 0 "[ . 1 . 2]" 1
207 1 69 GLY H 1 71 GLU H 3.370 . 4.940 4.879 4.615 5.152 0.212 4 0 "[ . 1 . 2]" 1
208 1 70 GLU H 1 71 GLU H 2.020 . 2.240 2.123 1.796 2.343 0.103 17 0 "[ . 1 . 2]" 1
209 1 71 GLU H 1 72 THR H 3.050 . 4.300 4.458 4.126 4.611 0.311 2 0 "[ . 1 . 2]" 1
210 1 72 THR H 1 73 ALA H 3.340 . 4.880 4.485 4.300 4.593 . 0 0 "[ . 1 . 2]" 1
211 1 73 ALA H 1 74 PHE H 2.170 . 2.540 2.570 2.460 2.779 0.239 16 0 "[ . 1 . 2]" 1
212 1 73 ALA MB 1 74 PHE H 2.520 . 3.240 2.182 1.955 2.300 . 0 0 "[ . 1 . 2]" 1
213 1 73 ALA MB 1 74 PHE QD 3.200 . 4.600 2.401 2.093 3.385 . 0 0 "[ . 1 . 2]" 1
214 1 73 ALA MB 1 74 PHE QE 3.450 . 5.100 3.306 2.975 5.176 0.076 14 0 "[ . 1 . 2]" 1
215 1 74 PHE H 1 75 LEU H 3.120 . 4.440 4.350 4.315 4.393 . 0 0 "[ . 1 . 2]" 1
216 1 74 PHE QD 1 75 LEU H 3.230 . 4.660 3.218 2.898 3.714 . 0 0 "[ . 1 . 2]" 1
217 1 74 PHE QD 1 123 PHE QD 2.850 . 3.900 3.525 3.212 3.669 . 0 0 "[ . 1 . 2]" 1
218 1 74 PHE QD 1 123 PHE QE 2.780 . 3.760 3.702 3.296 4.459 0.699 14 1 "[ . 1 +. 2]" 1
219 1 74 PHE QE 1 118 VAL MG1 3.030 . 4.260 2.842 2.471 3.144 . 0 0 "[ . 1 . 2]" 1
220 1 74 PHE QE 1 118 VAL MG2 3.430 . 5.060 2.136 1.876 2.491 . 0 0 "[ . 1 . 2]" 1
221 1 74 PHE QE 1 123 PHE QD 2.830 . 3.860 3.682 3.228 4.708 0.848 14 1 "[ . 1 +. 2]" 1
222 1 74 PHE QE 1 123 PHE QE 3.410 . 5.020 4.827 4.355 6.099 1.079 14 1 "[ . 1 +. 2]" 1
223 1 74 PHE QE 1 126 LEU QD 3.170 . 4.540 2.956 2.212 5.035 0.495 12 0 "[ . 1 . 2]" 1
224 1 75 LEU H 1 76 CYS H 3.270 . 4.740 4.324 4.094 4.463 . 0 0 "[ . 1 . 2]" 1
225 1 75 LEU MD1 1 76 CYS H 2.260 . 2.730 1.942 1.705 2.571 0.095 17 0 "[ . 1 . 2]" 1
226 1 75 LEU MD2 1 76 CYS H 3.380 . 4.960 4.313 4.139 4.866 . 0 0 "[ . 1 . 2]" 1
227 1 76 CYS H 1 77 GLU H 3.190 . 4.580 4.226 3.700 4.494 . 0 0 "[ . 1 . 2]" 1
228 1 77 GLU H 1 78 VAL H 3.030 . 4.260 4.181 4.024 4.416 0.156 20 0 "[ . 1 . 2]" 1
229 1 77 GLU H 1 78 VAL MG2 3.080 . 4.360 3.524 3.265 4.139 . 0 0 "[ . 1 . 2]" 1
230 1 77 GLU H 1 117 MET ME 2.520 . 3.240 2.678 2.227 3.304 0.064 20 0 "[ . 1 . 2]" 1
231 1 78 VAL H 1 79 GLN H 3.200 . 4.600 4.091 3.880 4.301 . 0 0 "[ . 1 . 2]" 1
232 1 78 VAL MG1 1 79 GLN H 2.410 . 3.020 3.054 2.518 3.254 0.234 16 0 "[ . 1 . 2]" 1
233 1 78 VAL MG1 1 80 GLN H 2.900 . 4.000 2.842 2.662 3.020 . 0 0 "[ . 1 . 2]" 1
234 1 78 VAL MG1 1 114 ILE H 3.360 . 4.920 3.981 3.691 4.397 . 0 0 "[ . 1 . 2]" 1
235 1 78 VAL MG2 1 79 GLN H 3.360 . 4.920 4.046 3.896 4.145 . 0 0 "[ . 1 . 2]" 1
236 1 78 VAL MG2 1 114 ILE H 3.030 . 4.260 3.037 2.868 3.288 . 0 0 "[ . 1 . 2]" 1
237 1 78 VAL MG2 1 117 MET ME 2.770 . 3.740 2.231 2.051 2.499 . 0 0 "[ . 1 . 2]" 1
238 1 79 GLN H 1 80 GLN H 2.820 . 3.840 3.948 3.831 4.106 0.266 20 0 "[ . 1 . 2]" 1
239 1 80 GLN H 1 81 GLY H 3.230 . 4.660 4.189 4.103 4.249 . 0 0 "[ . 1 . 2]" 1
240 1 80 GLN H 1 110 ALA MB 3.050 . 4.300 3.443 3.106 3.727 . 0 0 "[ . 1 . 2]" 1
241 1 81 GLY H 1 82 GLY H 3.280 . 4.760 4.539 4.497 4.579 . 0 0 "[ . 1 . 2]" 1
242 1 82 GLY H 1 83 ILE H 3.190 . 4.580 4.186 4.074 4.348 . 0 0 "[ . 1 . 2]" 1
243 1 82 GLY H 1 84 PHE QE 3.400 . 5.000 3.680 3.307 4.091 . 0 0 "[ . 1 . 2]" 1
244 1 83 ILE H 1 84 PHE H 3.160 . 4.520 4.482 4.369 4.547 0.027 13 0 "[ . 1 . 2]" 1
245 1 84 PHE H 1 85 SER H 3.180 . 4.560 4.182 4.105 4.357 . 0 0 "[ . 1 . 2]" 1
246 1 84 PHE QD 1 85 SER H 3.450 . 5.100 4.548 4.309 4.865 . 0 0 "[ . 1 . 2]" 1
247 1 85 SER H 1 86 ILE H 3.060 . 4.320 4.248 3.994 4.450 0.130 9 0 "[ . 1 . 2]" 1
248 1 86 ILE H 1 87 ALA H 3.240 . 4.680 4.394 4.214 4.499 . 0 0 "[ . 1 . 2]" 1
249 1 87 ALA H 1 88 GLY H 3.070 . 4.340 4.329 4.206 4.387 0.047 20 0 "[ . 1 . 2]" 1
250 1 87 ALA H 1 89 ILE H 3.360 . 4.920 4.256 3.882 4.597 . 0 0 "[ . 1 . 2]" 1
251 1 87 ALA MB 1 88 GLY H 2.820 . 3.840 2.471 2.127 2.980 . 0 0 "[ . 1 . 2]" 1
252 1 88 GLY H 1 89 ILE H 1.930 . 2.060 2.701 2.371 2.950 0.890 9 18 "[***** -*+* *********]" 1
253 1 89 ILE H 1 90 GLU H 3.220 . 4.640 4.466 4.373 4.527 . 0 0 "[ . 1 . 2]" 1
254 1 90 GLU H 1 91 GLY H 3.180 . 4.560 4.396 4.330 4.482 . 0 0 "[ . 1 . 2]" 1
255 1 90 GLU H 1 94 MET H 2.960 . 4.120 3.924 3.391 4.684 0.564 14 1 "[ . 1 +. 2]" 1
256 1 91 GLY H 1 92 THR H 3.330 . 4.860 4.561 4.409 4.631 . 0 0 "[ . 1 . 2]" 1
257 1 91 GLY H 1 94 MET H 3.230 . 4.660 4.342 3.986 4.853 0.193 20 0 "[ . 1 . 2]" 1
258 1 91 GLY H 1 94 MET ME 3.370 . 4.940 4.261 2.202 7.147 2.207 20 5 "[ * . -* . * +]" 1
259 1 91 GLY H 1 95 ALA H 3.460 . 5.120 5.006 4.701 5.585 0.465 7 0 "[ . 1 . 2]" 1
260 1 92 THR H 1 93 GLN H 2.240 . 2.680 2.605 2.460 2.781 0.101 1 0 "[ . 1 . 2]" 1
261 1 92 THR H 1 94 MET H 3.190 . 4.580 4.502 4.128 4.816 0.236 15 0 "[ . 1 . 2]" 1
262 1 92 THR H 1 95 ALA H 3.340 . 4.880 4.781 4.655 4.978 0.098 3 0 "[ . 1 . 2]" 1
263 1 93 GLN H 1 94 MET H 2.390 . 2.980 2.680 2.554 2.783 . 0 0 "[ . 1 . 2]" 1
264 1 93 GLN H 1 95 ALA H 3.020 . 4.240 3.898 3.620 4.358 0.118 3 0 "[ . 1 . 2]" 1
265 1 93 GLN H 1 96 HIS H 3.440 . 5.080 4.594 4.383 4.816 . 0 0 "[ . 1 . 2]" 1
266 1 94 MET H 1 95 ALA H 2.150 . 2.500 2.509 2.381 2.777 0.277 1 0 "[ . 1 . 2]" 1
267 1 94 MET H 1 96 HIS H 3.010 . 4.220 4.033 3.842 4.328 0.108 6 0 "[ . 1 . 2]" 1
268 1 94 MET H 1 97 CYS H 3.360 . 4.920 4.580 4.410 4.755 . 0 0 "[ . 1 . 2]" 1
269 1 94 MET ME 1 98 LEU MD1 2.970 . 4.140 3.937 2.023 5.067 0.927 14 6 "[* . 1 **+- *2]" 1
270 1 95 ALA H 1 96 HIS H 2.310 . 2.820 2.660 2.553 2.795 . 0 0 "[ . 1 . 2]" 1
271 1 95 ALA H 1 97 CYS H 3.050 . 4.300 3.991 3.837 4.103 . 0 0 "[ . 1 . 2]" 1
272 1 95 ALA H 1 98 LEU H 3.380 . 4.960 5.007 4.779 5.302 0.342 12 0 "[ . 1 . 2]" 1
273 1 95 ALA MB 1 96 HIS H 2.690 . 3.580 2.563 2.260 2.803 . 0 0 "[ . 1 . 2]" 1
274 1 96 HIS H 1 97 CYS H 2.170 . 2.540 2.688 2.492 2.866 0.326 5 0 "[ . 1 . 2]" 1
275 1 96 HIS H 1 98 LEU H 2.920 . 4.040 4.613 4.185 4.989 0.949 20 11 "[-* .* **1****. * +]" 1
276 1 96 HIS H 1 99 GLY H 3.200 . 4.600 4.846 4.557 5.157 0.557 2 1 "[ + . 1 . 2]" 1
277 1 97 CYS H 1 98 LEU H 2.220 . 2.640 2.766 2.590 3.035 0.395 14 0 "[ . 1 . 2]" 1
278 1 97 CYS H 1 99 GLY H 2.850 . 3.900 3.868 3.699 4.202 0.302 3 0 "[ . 1 . 2]" 1
279 1 97 CYS H 1 100 ALA H 3.430 . 5.060 4.756 4.443 5.036 . 0 0 "[ . 1 . 2]" 1
280 1 97 CYS H 1 101 TYR H 3.440 . 5.080 4.742 4.567 4.952 . 0 0 "[ . 1 . 2]" 1
281 1 98 LEU H 1 99 GLY H 2.030 . 2.260 2.480 2.193 2.719 0.459 14 0 "[ . 1 . 2]" 1
282 1 98 LEU H 1 100 ALA H 2.890 . 3.980 4.086 3.589 4.339 0.359 14 0 "[ . 1 . 2]" 1
283 1 98 LEU H 1 101 TYR H 3.340 . 4.880 4.974 4.645 5.210 0.330 17 0 "[ . 1 . 2]" 1
284 1 98 LEU H 1 102 CYS H 3.300 . 4.800 5.010 4.769 5.193 0.393 16 0 "[ . 1 . 2]" 1
285 1 99 GLY H 1 100 ALA H 2.040 . 2.280 2.362 2.180 2.496 0.216 3 0 "[ . 1 . 2]" 1
286 1 99 GLY H 1 100 ALA MB 3.370 . 4.940 4.106 3.973 4.280 . 0 0 "[ . 1 . 2]" 1
287 1 99 GLY H 1 101 TYR H 2.960 . 4.120 4.228 3.852 4.494 0.374 7 0 "[ . 1 . 2]" 1
288 1 99 GLY H 1 102 CYS H 3.080 . 4.360 4.877 4.451 5.286 0.926 7 10 "[ *** +**1 .**-*2]" 1
289 1 100 ALA H 1 101 TYR H 2.090 . 2.380 2.367 2.090 2.642 0.262 19 0 "[ . 1 . 2]" 1
290 1 100 ALA H 1 102 CYS H 2.410 . 3.020 3.562 3.288 3.832 0.812 4 12 "[* +**** * ** .** -2]" 1
291 1 100 ALA MB 1 101 TYR H 2.460 . 3.120 2.225 2.025 2.460 . 0 0 "[ . 1 . 2]" 1
292 1 101 TYR H 1 102 CYS H 2.280 . 2.760 2.977 2.628 3.167 0.407 10 0 "[ . 1 . 2]" 1
293 1 101 TYR QD 1 102 CYS H 3.110 . 4.410 3.545 3.141 3.867 . 0 0 "[ . 1 . 2]" 1
294 1 101 TYR QE 3 135 ALA MB 3.200 . 4.600 3.776 1.985 7.800 3.200 4 3 "[ *+. 1 .- 2]" 1
295 1 102 CYS H 1 105 ILE H 3.520 . 5.240 4.774 4.567 5.044 . 0 0 "[ . 1 . 2]" 1
296 1 109 TYR H 1 110 ALA H 2.150 . 2.500 2.515 2.370 2.615 0.115 4 0 "[ . 1 . 2]" 1
297 1 109 TYR H 1 111 ARG H 2.950 . 4.100 4.012 3.840 4.218 0.118 2 0 "[ . 1 . 2]" 1
298 1 109 TYR QD 1 110 ALA H 3.400 . 5.000 4.297 4.050 4.863 . 0 0 "[ . 1 . 2]" 1
299 1 110 ALA H 1 111 ARG H 2.130 . 2.460 2.581 2.500 2.654 0.194 5 0 "[ . 1 . 2]" 1
300 1 110 ALA H 1 112 GLU H 3.000 . 4.200 4.075 3.886 4.309 0.109 3 0 "[ . 1 . 2]" 1
301 1 110 ALA H 1 113 CYS H 3.430 . 5.060 4.792 4.656 5.002 . 0 0 "[ . 1 . 2]" 1
302 1 110 ALA MB 1 111 ARG H 2.660 . 3.520 2.451 2.277 2.596 . 0 0 "[ . 1 . 2]" 1
303 1 111 ARG H 1 112 GLU H 2.370 . 2.940 2.810 2.622 2.942 0.002 8 0 "[ . 1 . 2]" 1
304 1 111 ARG H 1 113 CYS H 3.120 . 4.440 4.344 4.216 4.453 0.013 2 0 "[ . 1 . 2]" 1
305 1 112 GLU H 1 113 CYS H 2.200 . 2.600 2.748 2.700 2.908 0.308 6 0 "[ . 1 . 2]" 1
306 1 112 GLU H 1 114 ILE H 3.330 . 4.860 4.272 4.110 4.451 . 0 0 "[ . 1 . 2]" 1
307 1 112 GLU H 1 115 THR H 3.440 . 5.080 4.798 4.675 4.984 . 0 0 "[ . 1 . 2]" 1
308 1 113 CYS H 1 114 ILE H 2.460 . 3.120 2.732 2.608 2.838 . 0 0 "[ . 1 . 2]" 1
309 1 113 CYS H 1 115 THR H 3.070 . 4.340 4.327 4.085 4.548 0.208 20 0 "[ . 1 . 2]" 1
310 1 113 CYS H 1 116 SER H 3.320 . 4.840 4.841 4.745 4.998 0.158 1 0 "[ . 1 . 2]" 1
311 1 114 ILE H 1 115 THR H 2.390 . 2.980 2.731 2.552 2.880 . 0 0 "[ . 1 . 2]" 1
312 1 114 ILE H 1 116 SER H 3.070 . 4.340 4.119 3.943 4.273 . 0 0 "[ . 1 . 2]" 1
313 1 114 ILE H 1 117 MET H 3.500 . 5.200 4.882 4.768 5.038 . 0 0 "[ . 1 . 2]" 1
314 1 115 THR H 1 116 SER H 2.320 . 2.840 2.743 2.659 2.836 . 0 0 "[ . 1 . 2]" 1
315 1 115 THR H 1 117 MET H 3.230 . 4.660 4.343 4.243 4.488 . 0 0 "[ . 1 . 2]" 1
316 1 116 SER H 1 117 MET H 2.310 . 2.820 2.653 2.560 2.729 . 0 0 "[ . 1 . 2]" 1
317 1 116 SER H 1 118 VAL H 3.140 . 4.480 4.022 3.938 4.138 . 0 0 "[ . 1 . 2]" 1
318 1 116 SER H 1 119 SER H 3.510 . 5.220 4.752 4.689 4.915 . 0 0 "[ . 1 . 2]" 1
319 1 117 MET H 1 118 VAL H 2.390 . 2.980 2.693 2.618 2.798 . 0 0 "[ . 1 . 2]" 1
320 1 117 MET H 1 119 SER H 3.230 . 4.660 4.276 4.221 4.347 . 0 0 "[ . 1 . 2]" 1
321 1 117 MET ME 1 118 VAL H 3.470 . 5.140 4.043 3.744 4.359 . 0 0 "[ . 1 . 2]" 1
322 1 118 VAL H 1 119 SER H 2.430 . 3.060 2.737 2.674 2.819 . 0 0 "[ . 1 . 2]" 1
323 1 118 VAL H 1 121 GLY H 3.390 . 4.980 4.671 4.458 4.918 . 0 0 "[ . 1 . 2]" 1
324 1 118 VAL MG1 1 119 SER H 3.010 . 4.220 3.377 3.286 3.564 . 0 0 "[ . 1 . 2]" 1
325 1 118 VAL MG1 1 123 PHE H 3.110 . 4.410 3.554 3.198 3.857 . 0 0 "[ . 1 . 2]" 1
326 1 118 VAL MG1 1 123 PHE QD 3.280 . 4.760 3.308 2.955 3.858 . 0 0 "[ . 1 . 2]" 1
327 1 118 VAL MG1 1 125 GLN H 3.270 . 4.740 4.132 3.786 4.711 . 0 0 "[ . 1 . 2]" 1
328 1 118 VAL MG1 1 126 LEU H 3.180 . 4.560 2.859 2.484 3.317 . 0 0 "[ . 1 . 2]" 1
329 1 118 VAL MG2 1 119 SER H 3.250 . 4.700 3.842 3.684 3.929 . 0 0 "[ . 1 . 2]" 1
330 1 118 VAL MG2 1 126 LEU H 3.250 . 4.700 3.417 2.839 4.107 . 0 0 "[ . 1 . 2]" 1
331 1 119 SER H 1 121 GLY H 3.080 . 4.360 3.892 3.681 4.077 . 0 0 "[ . 1 . 2]" 1
332 1 119 SER H 1 123 PHE H 3.400 . 5.000 5.014 4.769 5.256 0.256 16 0 "[ . 1 . 2]" 1
333 1 121 GLY H 1 122 THR H 2.420 . 3.040 2.600 2.512 2.766 . 0 0 "[ . 1 . 2]" 1
334 1 121 GLY H 1 123 PHE H 2.860 . 3.920 3.784 3.638 3.968 0.048 19 0 "[ . 1 . 2]" 1
335 1 121 GLY H 2 18 THR H 3.370 . 4.940 4.310 4.049 4.615 . 0 0 "[ . 1 . 2]" 1
336 1 122 THR H 1 123 PHE H 2.410 . 3.020 2.620 2.475 2.896 . 0 0 "[ . 1 . 2]" 1
337 1 122 THR H 2 18 THR H 3.110 . 4.410 4.310 3.972 4.451 0.041 13 0 "[ . 1 . 2]" 1
338 1 125 GLN H 1 126 LEU H 3.320 . 4.840 4.602 4.520 4.664 . 0 0 "[ . 1 . 2]" 1
339 1 126 LEU H 1 127 ASN H 2.830 . 3.860 3.972 3.775 4.232 0.372 10 0 "[ . 1 . 2]" 1
340 1 126 LEU QD 1 127 ASN H 3.460 . 5.120 3.590 2.546 3.959 . 0 0 "[ . 1 . 2]" 1
341 1 127 ASN H 1 128 LEU H 3.220 . 4.640 4.280 3.842 4.449 . 0 0 "[ . 1 . 2]" 1
342 1 128 LEU H 1 129 ALA H 3.240 . 4.680 4.602 4.487 4.652 . 0 0 "[ . 1 . 2]" 1
343 1 128 LEU QD 1 129 ALA H 2.670 . 3.540 3.458 2.054 4.341 0.801 17 4 "[ . * * - + 2]" 1
344 1 128 LEU QD 1 129 ALA MB 3.480 . 5.160 4.387 2.892 5.191 0.031 17 0 "[ . 1 . 2]" 1
345 1 128 LEU QD 1 131 VAL QG 3.260 . 4.720 4.598 2.857 6.279 1.559 8 6 "[ . +-1 * ** * 2]" 1
346 1 129 ALA MB 3 13 ILE H 3.050 . 4.300 4.040 3.255 4.927 0.627 1 1 "[+ . 1 . 2]" 1
347 1 131 VAL H 1 133 PHE H 3.290 . 4.780 5.364 4.825 5.977 1.197 11 10 "[ * . **1+ ***-* *2]" 1
348 1 131 VAL QG 1 133 PHE H 3.300 . 4.800 3.389 2.706 4.156 . 0 0 "[ . 1 . 2]" 1
349 1 133 PHE H 1 134 ASP H 2.170 . 2.540 2.575 2.284 2.798 0.258 16 0 "[ . 1 . 2]" 1
350 1 133 PHE H 1 135 ALA H 2.770 . 3.740 4.356 4.031 4.694 0.954 3 15 "[**+ ** -*1* ***** **]" 1
351 1 133 PHE H 1 136 LEU H 3.260 . 4.720 4.972 4.462 5.497 0.777 17 4 "[ . 1 -** + 2]" 1
352 1 133 PHE QD 1 134 ASP H 3.090 . 4.380 4.231 3.788 4.732 0.352 16 0 "[ . 1 . 2]" 1
353 1 134 ASP H 1 135 ALA H 2.160 . 2.520 2.746 2.480 2.911 0.391 5 0 "[ . 1 . 2]" 1
354 1 134 ASP H 1 136 LEU H 3.000 . 4.200 4.109 3.705 4.511 0.311 13 0 "[ . 1 . 2]" 1
355 1 134 ASP H 1 137 PHE H 3.500 . 5.200 4.973 4.533 5.449 0.249 2 0 "[ . 1 . 2]" 1
356 1 135 ALA H 1 136 LEU H 2.320 . 2.840 2.642 2.427 2.848 0.008 13 0 "[ . 1 . 2]" 1
357 1 135 ALA H 1 137 PHE H 3.160 . 4.520 4.309 3.918 4.745 0.225 2 0 "[ . 1 . 2]" 1
358 1 135 ALA H 1 138 MET H 3.470 . 5.140 4.766 4.451 5.289 0.149 9 0 "[ . 1 . 2]" 1
359 1 135 ALA MB 1 136 LEU H 2.690 . 3.580 2.683 2.429 3.009 . 0 0 "[ . 1 . 2]" 1
360 1 136 LEU H 1 137 PHE H 2.280 . 2.760 2.696 2.500 2.900 0.140 20 0 "[ . 1 . 2]" 1
361 1 136 LEU H 1 138 MET H 3.200 . 4.600 4.010 3.690 4.347 . 0 0 "[ . 1 . 2]" 1
362 1 136 LEU H 1 139 ASN H 3.330 . 4.860 4.900 4.651 5.505 0.645 14 1 "[ . 1 +. 2]" 1
363 1 136 LEU MD1 1 137 PHE H 3.290 . 4.780 4.436 2.318 4.885 0.105 14 0 "[ . 1 . 2]" 1
364 1 137 PHE H 1 138 MET H 2.330 . 2.860 2.549 2.353 2.772 . 0 0 "[ . 1 . 2]" 1
365 1 137 PHE H 1 139 ASN H 2.960 . 4.120 4.221 3.770 4.563 0.443 4 0 "[ . 1 . 2]" 1
366 1 137 PHE QD 1 138 MET H 3.120 . 4.440 4.083 3.412 4.614 0.174 19 0 "[ . 1 . 2]" 1
367 1 138 MET H 1 139 ASN H 2.370 . 2.940 2.625 2.364 2.891 . 0 0 "[ . 1 . 2]" 1
368 1 138 MET H 1 140 TYR H 3.170 . 4.540 4.113 3.700 4.395 . 0 0 "[ . 1 . 2]" 1
369 1 138 MET H 1 141 LEU H 3.290 . 4.780 4.592 4.381 5.014 0.234 18 0 "[ . 1 . 2]" 1
370 1 138 MET ME 1 141 LEU MD2 3.160 . 4.520 2.250 1.898 3.035 . 0 0 "[ . 1 . 2]" 1
371 1 139 ASN H 1 140 TYR H 2.360 . 2.920 2.690 2.511 2.839 . 0 0 "[ . 1 . 2]" 1
372 1 139 ASN H 1 141 LEU H 3.040 . 4.280 4.006 3.702 4.443 0.163 13 0 "[ . 1 . 2]" 1
373 1 140 TYR H 1 141 LEU H 2.080 . 2.360 2.490 2.262 2.977 0.617 13 1 "[ . 1 + . 2]" 1
374 1 140 TYR QD 1 141 LEU H 3.060 . 4.320 3.843 3.358 4.050 . 0 0 "[ . 1 . 2]" 1
375 2 9 MET H 2 10 THR H 3.340 . 4.880 4.585 4.474 4.698 . 0 0 "[ . 1 . 2]" 1
376 2 9 MET ME 2 10 THR H 2.890 . 3.990 2.731 2.442 3.957 . 0 0 "[ . 1 . 2]" 1
377 2 9 MET ME 2 11 PHE H 3.150 . 4.500 3.509 3.185 3.858 . 0 0 "[ . 1 . 2]" 1
378 2 9 MET ME 2 11 PHE QD 3.430 . 5.060 2.866 2.126 3.408 . 0 0 "[ . 1 . 2]" 1
379 2 10 THR H 2 11 PHE H 3.070 . 4.340 4.134 3.870 4.274 . 0 0 "[ . 1 . 2]" 1
380 2 10 THR H 2 87 ALA H 2.680 . 3.560 2.968 2.566 3.453 . 0 0 "[ . 1 . 2]" 1
381 2 10 THR H 2 89 ILE H 3.160 . 4.520 4.067 3.227 4.940 0.420 6 0 "[ . 1 . 2]" 1
382 2 11 PHE H 2 12 GLN H 3.130 . 4.460 4.304 3.984 4.527 0.067 17 0 "[ . 1 . 2]" 1
383 2 11 PHE QD 2 12 GLN H 2.610 . 3.420 3.528 3.079 3.970 0.550 5 1 "[ + 1 . 2]" 1
384 2 11 PHE QE 2 12 GLN H 3.220 . 4.640 4.467 3.909 5.046 0.406 5 0 "[ . 1 . 2]" 1
385 2 11 PHE QE 2 84 PHE QD 3.330 . 4.860 3.450 2.402 4.074 . 0 0 "[ . 1 . 2]" 1
386 2 11 PHE QE 2 101 TYR QD 3.210 . 4.620 3.270 2.805 3.620 . 0 0 "[ . 1 . 2]" 1
387 2 11 PHE QE 2 101 TYR QE 3.330 . 4.860 3.077 2.734 4.169 . 0 0 "[ . 1 . 2]" 1
388 2 12 GLN H 2 13 ILE H 2.960 . 4.120 4.233 3.979 4.351 0.231 12 0 "[ . 1 . 2]" 1
389 2 12 GLN H 2 85 SER H 2.660 . 3.520 3.035 2.483 3.487 . 0 0 "[ . 1 . 2]" 1
390 2 13 ILE H 2 14 GLN H 3.330 . 4.860 4.436 4.291 4.598 . 0 0 "[ . 1 . 2]" 1
391 2 13 ILE H 4 129 ALA MB 3.330 . 4.860 4.136 2.726 5.738 0.878 4 1 "[ +. 1 . 2]" 1
392 2 14 GLN H 2 15 ARG H 2.090 . 2.380 2.371 2.143 2.531 0.151 1 0 "[ . 1 . 2]" 1
393 2 14 GLN H 2 83 ILE H 3.200 . 4.600 4.799 4.496 5.030 0.430 20 0 "[ . 1 . 2]" 1
394 2 14 GLN H 2 84 PHE QD 3.340 . 4.880 4.004 3.496 4.528 . 0 0 "[ . 1 . 2]" 1
395 2 14 GLN H 2 85 SER H 3.270 . 4.740 4.095 3.445 4.722 . 0 0 "[ . 1 . 2]" 1
396 2 15 ARG H 2 16 ILE H 3.110 . 4.420 4.171 4.051 4.292 . 0 0 "[ . 1 . 2]" 1
397 2 15 ARG H 2 83 ILE H 2.480 . 3.160 3.295 3.157 3.455 0.295 20 0 "[ . 1 . 2]" 1
398 2 16 ILE H 2 17 TYR H 3.260 . 4.720 4.469 4.396 4.511 . 0 0 "[ . 1 . 2]" 1
399 2 17 TYR H 2 18 THR H 3.140 . 4.480 4.239 4.160 4.333 . 0 0 "[ . 1 . 2]" 1
400 2 17 TYR H 2 81 GLY H 3.030 . 4.260 3.892 3.760 4.023 . 0 0 "[ . 1 . 2]" 1
401 2 17 TYR QD 2 18 THR H 3.240 . 4.680 4.133 3.482 4.399 . 0 0 "[ . 1 . 2]" 1
402 2 17 TYR QE 2 83 ILE H 3.350 . 4.900 2.818 2.293 3.430 . 0 0 "[ . 1 . 2]" 1
403 2 18 THR H 2 19 LYS H 3.290 . 4.780 4.446 4.389 4.497 . 0 0 "[ . 1 . 2]" 1
404 2 19 LYS H 2 20 ASP H 2.100 . 2.400 2.223 2.134 2.361 . 0 0 "[ . 1 . 2]" 1
405 2 19 LYS H 2 79 GLN H 3.060 . 4.320 4.261 3.972 4.482 0.162 10 0 "[ . 1 . 2]" 1
406 2 19 LYS H 2 80 GLN H 3.390 . 4.980 4.968 4.896 5.069 0.089 6 0 "[ . 1 . 2]" 1
407 2 19 LYS H 2 81 GLY H 2.420 . 3.040 2.928 2.717 3.226 0.186 2 0 "[ . 1 . 2]" 1
408 2 20 ASP H 2 21 ILE H 3.170 . 4.540 4.238 4.114 4.302 . 0 0 "[ . 1 . 2]" 1
409 2 20 ASP H 2 78 VAL MG1 3.350 . 4.900 4.198 3.986 4.353 . 0 0 "[ . 1 . 2]" 1
410 2 20 ASP H 2 79 GLN H 2.430 . 3.060 3.175 2.979 3.359 0.299 1 0 "[ . 1 . 2]" 1
411 2 21 ILE H 2 22 SER H 3.170 . 4.540 4.269 4.193 4.434 . 0 0 "[ . 1 . 2]" 1
412 2 21 ILE H 2 79 GLN H 3.510 . 5.220 5.040 4.830 5.148 . 0 0 "[ . 1 . 2]" 1
413 2 22 SER H 2 23 PHE H 3.220 . 4.640 4.173 3.850 4.272 . 0 0 "[ . 1 . 2]" 1
414 2 22 SER H 2 77 GLU H 2.670 . 3.540 3.073 2.795 3.317 . 0 0 "[ . 1 . 2]" 1
415 2 22 SER H 2 78 VAL H 3.400 . 5.000 5.057 4.883 5.180 0.180 20 0 "[ . 1 . 2]" 1
416 2 22 SER H 2 78 VAL MG2 2.920 . 4.040 3.815 3.010 4.201 0.161 20 0 "[ . 1 . 2]" 1
417 2 22 SER H 2 79 GLN H 3.500 . 5.200 5.477 5.249 5.841 0.641 20 2 "[ .- 1 . +]" 1
418 2 23 PHE H 2 24 GLU H 2.980 . 4.160 3.960 3.815 4.134 . 0 0 "[ . 1 . 2]" 1
419 2 23 PHE H 2 77 GLU H 3.460 . 5.120 5.068 4.598 5.223 0.103 20 0 "[ . 1 . 2]" 1
420 2 23 PHE QD 2 24 GLU H 2.840 . 3.880 3.755 3.533 4.012 0.132 1 0 "[ . 1 . 2]" 1
421 2 23 PHE QE 2 24 GLU H 3.490 . 5.180 4.806 4.520 5.151 . 0 0 "[ . 1 . 2]" 1
422 2 23 PHE QE 2 25 ALA MB 3.460 . 5.120 2.750 2.419 3.183 . 0 0 "[ . 1 . 2]" 1
423 2 23 PHE QE 2 121 GLY H 3.070 . 4.340 3.850 3.503 4.173 . 0 0 "[ . 1 . 2]" 1
424 2 24 GLU H 2 25 ALA H 3.260 . 4.720 4.213 4.058 4.440 . 0 0 "[ . 1 . 2]" 1
425 2 24 GLU H 2 75 LEU H 2.830 . 3.860 3.077 2.738 3.504 . 0 0 "[ . 1 . 2]" 1
426 2 24 GLU H 2 76 CYS H 3.410 . 5.020 4.702 4.508 4.989 . 0 0 "[ . 1 . 2]" 1
427 2 25 ALA MB 2 27 ASN H 3.430 . 5.060 3.768 3.390 4.396 . 0 0 "[ . 1 . 2]" 1
428 2 25 ALA MB 2 28 ALA H 2.940 . 4.080 2.977 2.408 3.335 . 0 0 "[ . 1 . 2]" 1
429 2 25 ALA MB 2 28 ALA MB 2.620 . 3.440 1.804 1.646 1.986 0.154 7 0 "[ . 1 . 2]" 1
430 2 27 ASN H 2 28 ALA H 2.240 . 2.680 2.418 2.204 2.614 . 0 0 "[ . 1 . 2]" 1
431 2 28 ALA H 2 30 HIS H 3.000 . 4.200 4.185 3.982 4.414 0.214 14 0 "[ . 1 . 2]" 1
432 2 30 HIS H 2 31 VAL H 2.300 . 2.800 2.291 2.138 2.477 . 0 0 "[ . 1 . 2]" 1
433 2 30 HIS H 2 32 PHE H 3.200 . 4.600 4.113 3.156 4.935 0.335 8 0 "[ . 1 . 2]" 1
434 2 31 VAL H 2 32 PHE H 2.370 . 2.940 2.579 2.368 2.887 . 0 0 "[ . 1 . 2]" 1
435 2 31 VAL H 2 33 GLN H 3.250 . 4.700 4.377 4.103 4.628 . 0 0 "[ . 1 . 2]" 1
436 2 31 VAL H 2 34 LYS H 3.360 . 4.920 5.243 4.811 5.697 0.777 6 5 "[* *+ - * . 2]" 1
437 2 31 VAL QG 2 32 PHE H 2.420 . 3.040 2.790 2.316 3.633 0.593 17 2 "[ . 1 - . + 2]" 1
438 2 32 PHE H 2 33 GLN H 2.330 . 2.860 2.666 2.425 2.889 0.029 2 0 "[ . 1 . 2]" 1
439 2 32 PHE H 2 34 LYS H 2.990 . 4.180 4.046 3.749 4.406 0.226 10 0 "[ . 1 . 2]" 1
440 2 32 PHE QD 2 33 GLN H 3.370 . 4.940 3.734 3.202 4.436 . 0 0 "[ . 1 . 2]" 1
441 2 33 GLN H 2 34 LYS H 2.130 . 2.460 2.480 2.289 2.619 0.159 12 0 "[ . 1 . 2]" 1
442 2 34 LYS H 2 35 ASP H 3.140 . 4.480 4.082 3.454 4.360 . 0 0 "[ . 1 . 2]" 1
443 2 35 ASP H 2 36 TRP H 2.940 . 4.080 3.869 3.614 4.268 0.188 3 0 "[ . 1 . 2]" 1
444 2 35 ASP H 2 36 TRP HE3 3.050 . 4.300 5.832 3.623 8.483 4.183 7 12 "[- * .*+**1****. * *]" 1
445 2 36 TRP H 2 37 GLN H 3.160 . 4.520 4.343 4.304 4.383 . 0 0 "[ . 1 . 2]" 1
446 2 36 TRP H 2 68 LEU QD 3.450 . 5.100 2.542 1.971 3.277 . 0 0 "[ . 1 . 2]" 1
447 2 36 TRP HE1 2 37 GLN H 3.370 . 4.940 5.539 3.791 7.339 2.399 20 13 "[** ** ** * ****-+]" 1
448 2 36 TRP HE3 2 68 LEU QD 3.270 . 4.740 2.802 1.551 5.225 0.485 6 0 "[ . 1 . 2]" 1
449 2 37 GLN H 2 68 LEU QD 3.390 . 4.980 3.912 3.296 4.290 . 0 0 "[ . 1 . 2]" 1
450 2 39 GLU H 2 40 VAL H 3.160 . 4.520 4.361 4.293 4.529 0.009 19 0 "[ . 1 . 2]" 1
451 2 39 GLU H 2 66 ALA MB 3.320 . 4.830 4.531 3.850 5.073 0.243 20 0 "[ . 1 . 2]" 1
452 2 39 GLU H 2 67 SER H 2.450 . 3.100 3.090 2.343 3.641 0.541 2 1 "[ + . 1 . 2]" 1
453 2 39 GLU H 2 68 LEU QD 3.400 . 5.000 4.155 3.361 4.866 . 0 0 "[ . 1 . 2]" 1
454 2 40 VAL H 2 41 LYS H 3.300 . 4.800 4.492 4.395 4.578 . 0 0 "[ . 1 . 2]" 1
455 2 40 VAL H 2 66 ALA MB 3.470 . 5.140 4.782 4.057 5.387 0.247 20 0 "[ . 1 . 2]" 1
456 2 40 VAL QG 2 41 LYS H 3.390 . 4.740 3.067 2.338 3.585 . 0 0 "[ . 1 . 2]" 1
457 2 40 VAL QG 2 42 LEU H 3.520 . 5.240 4.101 3.190 5.086 . 0 0 "[ . 1 . 2]" 1
458 2 40 VAL QG 2 42 LEU QD 3.440 . 5.080 3.158 1.879 4.981 . 0 0 "[ . 1 . 2]" 1
459 2 40 VAL QG 2 64 VAL QG 3.300 . 4.800 2.979 1.819 3.631 . 0 0 "[ . 1 . 2]" 1
460 2 40 VAL QG 2 66 ALA MB 3.010 . 4.220 2.511 1.889 4.281 0.061 16 0 "[ . 1 . 2]" 1
461 2 40 VAL QG 2 74 PHE QE 2.660 . 3.520 3.947 2.992 5.136 1.616 16 7 "[ . *-1*** .+ *]" 1
462 2 40 VAL QG 2 126 LEU QD 2.610 . 3.420 1.909 1.510 2.458 0.290 14 0 "[ . 1 . 2]" 1
463 2 41 LYS H 2 42 LEU H 2.980 . 4.160 4.085 3.781 4.344 0.184 7 0 "[ . 1 . 2]" 1
464 2 41 LYS H 2 64 VAL QG 2.800 . 3.800 3.653 3.134 4.092 0.292 4 0 "[ . 1 . 2]" 1
465 2 41 LYS H 2 65 THR H 2.680 . 3.570 3.111 2.609 3.903 0.333 11 0 "[ . 1 . 2]" 1
466 2 41 LYS H 2 66 ALA MB 3.380 . 4.960 4.216 3.881 4.609 . 0 0 "[ . 1 . 2]" 1
467 2 42 LEU H 2 43 ASP H 3.270 . 4.740 4.495 4.327 4.612 . 0 0 "[ . 1 . 2]" 1
468 2 42 LEU QD 2 62 VAL QG 3.390 . 4.980 3.485 2.001 4.819 . 0 0 "[ . 1 . 2]" 1
469 2 42 LEU QD 2 64 VAL QG 3.190 . 3.260 3.161 1.578 4.365 1.105 11 4 "[ . - 1+ * *]" 1
470 2 42 LEU QD 2 126 LEU QD 2.870 . 3.940 3.659 1.769 5.242 1.302 12 6 "[ -. ** 1*+ . *]" 1
471 2 42 LEU QD 2 128 LEU H 3.440 . 5.080 5.460 4.203 6.965 1.885 12 8 "[ * . * *1*+ - **]" 1
472 2 42 LEU QD 2 128 LEU QD . . 3.320 2.213 1.748 3.276 0.052 4 0 "[ . 1 . 2]" 1
473 2 42 LEU QD 2 129 ALA H 2.390 . 2.980 3.982 2.078 5.116 2.136 12 15 "[ ***.** ***+ -.*****]" 1
474 2 42 LEU QD 2 129 ALA MB 3.390 . 4.980 4.274 2.407 5.575 0.595 10 1 "[ . + . 2]" 1
475 2 43 ASP H 2 44 LEU H 3.190 . 4.580 4.178 3.823 4.419 . 0 0 "[ . 1 . 2]" 1
476 2 43 ASP H 2 62 VAL QG 2.820 . 3.840 3.506 3.153 3.845 0.005 11 0 "[ . 1 . 2]" 1
477 2 43 ASP H 2 63 THR H 2.780 . 3.760 3.213 2.808 3.817 0.057 6 0 "[ . 1 . 2]" 1
478 2 43 ASP H 2 64 VAL QG 3.350 . 4.900 3.927 3.531 4.237 . 0 0 "[ . 1 . 2]" 1
479 2 43 ASP H 2 128 LEU QD 3.440 . 5.080 4.788 3.856 5.624 0.544 14 1 "[ . 1 +. 2]" 1
480 2 44 LEU H 2 45 ASP H 3.290 . 4.780 4.435 4.286 4.505 . 0 0 "[ . 1 . 2]" 1
481 2 44 LEU QD 2 131 VAL QG . . 3.180 2.528 1.607 4.288 1.108 14 3 "[ . -1 +. *]" 1
482 2 44 LEU QD 2 133 PHE QD 3.420 . 5.040 3.512 2.457 5.201 0.161 20 0 "[ . 1 . 2]" 1
483 2 44 LEU QD 2 133 PHE QE 3.270 . 4.740 2.372 1.909 3.654 . 0 0 "[ . 1 . 2]" 1
484 2 44 LEU QD 2 136 LEU QD 3.200 . 4.600 3.582 2.023 5.867 1.267 3 3 "[ +*. 1 -. 2]" 1
485 2 45 ASP H 2 46 THR H 3.240 . 4.680 4.293 4.168 4.380 . 0 0 "[ . 1 . 2]" 1
486 2 45 ASP H 2 60 LEU MD2 2.670 . 3.540 3.166 2.657 3.627 0.087 17 0 "[ . 1 . 2]" 1
487 2 45 ASP H 2 61 ARG H 2.490 . 3.180 3.427 2.889 3.799 0.619 8 2 "[ .- + 1 . 2]" 1
488 2 45 ASP H 2 62 VAL QG 3.080 . 4.360 4.048 3.721 4.496 0.136 14 0 "[ . 1 . 2]" 1
489 2 46 THR H 2 47 ALA H 3.060 . 4.320 4.236 4.082 4.439 0.119 15 0 "[ . 1 . 2]" 1
490 2 46 THR H 2 61 ARG H 3.410 . 5.020 4.941 4.435 5.433 0.413 14 0 "[ . 1 . 2]" 1
491 2 47 ALA H 2 48 SER H 3.260 . 4.720 4.394 4.133 4.494 . 0 0 "[ . 1 . 2]" 1
492 2 47 ALA H 2 58 VAL QG 2.780 . 3.760 4.080 3.460 5.367 1.607 13 6 "[* . ** 1 + . - *2]" 1
493 2 47 ALA H 2 59 VAL H 2.610 . 3.420 3.665 3.045 4.039 0.619 14 2 "[ . 1 -+. 2]" 1
494 2 47 ALA H 2 61 ARG H 3.360 . 4.920 4.263 3.679 4.935 0.015 3 0 "[ . 1 . 2]" 1
495 2 47 ALA MB 2 48 SER H 2.600 . 3.400 2.745 2.516 3.301 . 0 0 "[ . 1 . 2]" 1
496 2 47 ALA MB 2 59 VAL H 2.620 . 3.440 3.662 3.108 4.517 1.077 8 5 "[- . + 1 *. **]" 1
497 2 47 ALA MB 2 59 VAL MG1 3.350 . 4.900 3.312 2.669 4.125 . 0 0 "[ . 1 . 2]" 1
498 2 47 ALA MB 2 59 VAL MG2 3.190 . 4.580 3.273 2.737 3.972 . 0 0 "[ . 1 . 2]" 1
499 2 48 SER H 2 49 SER H 3.220 . 4.640 4.420 4.360 4.527 . 0 0 "[ . 1 . 2]" 1
500 2 48 SER H 2 59 VAL H 3.100 . 4.400 4.524 4.209 4.849 0.449 14 0 "[ . 1 . 2]" 1
501 2 49 SER H 2 50 GLN H 3.180 . 4.560 4.261 4.156 4.350 . 0 0 "[ . 1 . 2]" 1
502 2 49 SER H 2 56 TYR QD 3.230 . 4.660 4.008 3.157 5.430 0.770 19 1 "[ . 1 . +2]" 1
503 2 49 SER H 2 57 GLU H 2.310 . 2.820 3.129 2.271 3.744 0.924 6 4 "[ -+ 1* * . 2]" 1
504 2 50 GLN H 2 51 LEU H 3.110 . 4.420 4.328 4.141 4.457 0.037 18 0 "[ . 1 . 2]" 1
505 2 50 GLN H 2 57 GLU H 3.480 . 5.160 4.814 4.360 5.086 . 0 0 "[ . 1 . 2]" 1
506 2 51 LEU H 2 52 ALA H 2.070 . 2.340 2.326 2.119 2.537 0.197 14 0 "[ . 1 . 2]" 1
507 2 51 LEU H 2 55 VAL H 3.410 . 5.020 4.993 4.783 5.323 0.303 7 0 "[ . 1 . 2]" 1
508 2 51 LEU H 2 55 VAL MG1 3.320 . 4.840 3.508 3.099 3.714 . 0 0 "[ . 1 . 2]" 1
509 2 51 LEU H 2 57 GLU H 3.190 . 4.580 3.724 3.286 4.384 . 0 0 "[ . 1 . 2]" 1
510 2 51 LEU MD1 2 55 VAL MG1 2.670 . 3.540 2.423 2.006 2.758 . 0 0 "[ . 1 . 2]" 1
511 2 51 LEU MD1 2 57 GLU H 3.510 . 5.220 4.420 3.622 5.032 . 0 0 "[ . 1 . 2]" 1
512 2 51 LEU MD1 2 84 PHE H 3.380 . 4.960 4.641 3.915 4.921 . 0 0 "[ . 1 . 2]" 1
513 2 52 ALA H 2 53 ASP H 3.180 . 4.560 4.335 4.307 4.390 . 0 0 "[ . 1 . 2]" 1
514 2 52 ALA H 2 55 VAL H 2.860 . 3.920 3.587 3.398 3.781 . 0 0 "[ . 1 . 2]" 1
515 2 52 ALA H 2 55 VAL MG1 3.150 . 4.500 3.336 3.092 3.570 . 0 0 "[ . 1 . 2]" 1
516 2 52 ALA H 2 55 VAL MG2 3.430 . 5.060 4.154 3.909 4.454 . 0 0 "[ . 1 . 2]" 1
517 2 52 ALA MB 2 53 ASP H 2.310 . 2.820 1.965 1.794 2.255 0.006 9 0 "[ . 1 . 2]" 1
518 2 52 ALA MB 2 55 VAL MG2 3.170 . 4.540 2.535 2.210 2.828 . 0 0 "[ . 1 . 2]" 1
519 2 53 ASP H 2 54 ASP H 3.260 . 4.720 4.500 4.342 4.577 . 0 0 "[ . 1 . 2]" 1
520 2 53 ASP H 2 55 VAL H 3.440 . 5.080 4.206 4.038 4.423 . 0 0 "[ . 1 . 2]" 1
521 2 53 ASP H 2 55 VAL MG2 3.520 . 5.240 4.272 3.758 4.602 . 0 0 "[ . 1 . 2]" 1
522 2 54 ASP H 2 55 VAL H 2.290 . 2.780 2.752 2.522 2.869 0.089 1 0 "[ . 1 . 2]" 1
523 2 55 VAL H 2 56 TYR H 2.860 . 3.920 3.948 3.649 4.206 0.286 1 0 "[ . 1 . 2]" 1
524 2 55 VAL MG1 2 56 TYR H 3.080 . 4.360 3.435 2.903 3.676 . 0 0 "[ . 1 . 2]" 1
525 2 55 VAL MG1 2 84 PHE H 3.200 . 4.600 3.965 3.589 4.355 . 0 0 "[ . 1 . 2]" 1
526 2 56 TYR H 2 57 GLU H 3.300 . 4.800 4.444 4.339 4.526 . 0 0 "[ . 1 . 2]" 1
527 2 56 TYR H 2 84 PHE H 2.920 . 4.040 3.609 3.372 4.094 0.054 8 0 "[ . 1 . 2]" 1
528 2 56 TYR H 2 86 ILE H 3.220 . 4.640 3.872 3.226 4.944 0.304 1 0 "[ . 1 . 2]" 1
529 2 56 TYR QD 2 57 GLU H 2.820 . 3.840 3.652 2.064 4.271 0.431 4 0 "[ . 1 . 2]" 1
530 2 56 TYR QD 2 94 MET ME 3.520 . 5.240 5.352 2.795 8.165 2.925 17 8 "[ * .**- 1 * . +* *]" 1
531 2 56 TYR QD 2 98 LEU QD 2.780 . 3.760 3.153 2.258 5.183 1.423 15 2 "[ . 1 + - 2]" 1
532 2 56 TYR QE 2 98 LEU QD 3.170 . 4.540 3.762 1.691 5.299 0.759 15 1 "[ . 1 + 2]" 1
533 2 57 GLU H 2 58 VAL H 2.920 . 4.040 4.026 3.671 4.399 0.359 9 0 "[ . 1 . 2]" 1
534 2 57 GLU H 2 58 VAL QG 3.480 . 5.160 3.942 3.428 4.550 . 0 0 "[ . 1 . 2]" 1
535 2 58 VAL H 2 59 VAL H 3.250 . 4.700 4.431 4.298 4.539 . 0 0 "[ . 1 . 2]" 1
536 2 58 VAL H 2 82 GLY H 2.920 . 4.040 3.420 3.027 3.584 . 0 0 "[ . 1 . 2]" 1
537 2 58 VAL H 2 84 PHE H 3.430 . 5.060 4.210 3.780 4.809 . 0 0 "[ . 1 . 2]" 1
538 2 58 VAL H 2 84 PHE QD 3.340 . 4.880 2.786 2.460 3.306 . 0 0 "[ . 1 . 2]" 1
539 2 58 VAL H 2 84 PHE QE 3.380 . 4.960 3.253 2.738 3.767 . 0 0 "[ . 1 . 2]" 1
540 2 58 VAL QG 2 59 VAL H 2.710 . 3.620 2.867 2.463 3.487 . 0 0 "[ . 1 . 2]" 1
541 2 58 VAL QG 2 98 LEU QD 3.320 . 4.840 2.510 1.819 3.848 . 0 0 "[ . 1 . 2]" 1
542 2 59 VAL H 2 60 LEU H 3.240 . 4.680 4.349 4.228 4.505 . 0 0 "[ . 1 . 2]" 1
543 2 59 VAL MG1 2 60 LEU H 2.630 . 3.460 2.766 2.055 3.127 . 0 0 "[ . 1 . 2]" 1
544 2 59 VAL MG1 2 80 GLN H 3.150 . 4.500 3.807 3.501 4.173 . 0 0 "[ . 1 . 2]" 1
545 2 59 VAL MG1 2 81 GLY H 3.280 . 4.760 3.617 3.302 3.883 . 0 0 "[ . 1 . 2]" 1
546 2 59 VAL MG2 2 60 LEU H 3.490 . 5.180 4.204 4.024 4.315 . 0 0 "[ . 1 . 2]" 1
547 2 60 LEU H 2 61 ARG H 3.230 . 4.660 4.307 4.094 4.483 . 0 0 "[ . 1 . 2]" 1
548 2 60 LEU H 2 80 GLN H 2.680 . 3.560 3.689 3.197 4.055 0.495 18 0 "[ . 1 . 2]" 1
549 2 60 LEU H 2 81 GLY H 3.240 . 4.680 4.587 4.343 4.825 0.145 1 0 "[ . 1 . 2]" 1
550 2 60 LEU MD1 2 62 VAL QG 3.480 . 5.160 2.821 2.474 3.386 . 0 0 "[ . 1 . 2]" 1
551 2 60 LEU MD1 2 110 ALA H 3.450 . 5.100 4.168 3.935 4.406 . 0 0 "[ . 1 . 2]" 1
552 2 60 LEU MD1 2 110 ALA MB 3.200 . 4.600 2.648 2.311 2.977 . 0 0 "[ . 1 . 2]" 1
553 2 60 LEU MD1 2 133 PHE QE 3.350 . 4.900 3.175 3.007 3.400 . 0 0 "[ . 1 . 2]" 1
554 2 60 LEU MD2 2 61 ARG H 2.540 . 3.280 2.422 1.941 2.730 . 0 0 "[ . 1 . 2]" 1
555 2 60 LEU MD2 2 62 VAL H 3.300 . 4.800 3.420 3.173 3.702 . 0 0 "[ . 1 . 2]" 1
556 2 60 LEU MD2 2 62 VAL QG 2.210 . 2.620 1.942 1.801 2.012 . 0 0 "[ . 1 . 2]" 1
557 2 60 LEU MD2 2 110 ALA MB 2.970 . 4.140 3.409 2.912 3.685 . 0 0 "[ . 1 . 2]" 1
558 2 61 ARG H 2 62 VAL H 3.210 . 4.620 4.259 4.053 4.414 . 0 0 "[ . 1 . 2]" 1
559 2 61 ARG H 2 62 VAL QG 3.360 . 4.920 4.238 3.899 4.471 . 0 0 "[ . 1 . 2]" 1
560 2 62 VAL H 2 63 THR H 2.970 . 4.140 4.255 4.001 4.378 0.238 13 0 "[ . 1 . 2]" 1
561 2 62 VAL H 2 78 VAL H 2.300 . 2.800 3.292 2.976 3.511 0.711 19 11 "[ * *. *- * ** .* *+*]" 1
562 2 62 VAL QG 2 63 THR H 2.990 . 4.180 2.862 2.401 3.249 . 0 0 "[ . 1 . 2]" 1
563 2 62 VAL QG 2 64 VAL QG 3.130 . 4.460 2.597 2.168 2.928 . 0 0 "[ . 1 . 2]" 1
564 2 62 VAL QG 2 110 ALA MB 2.820 . 3.840 2.172 1.967 2.255 . 0 0 "[ . 1 . 2]" 1
565 2 62 VAL QG 2 128 LEU QD 2.340 . 2.880 2.383 1.694 3.766 0.886 11 1 "[ . 1+ . 2]" 1
566 2 63 THR H 2 64 VAL H 3.280 . 4.760 4.415 4.304 4.495 . 0 0 "[ . 1 . 2]" 1
567 2 64 VAL H 2 65 THR H 2.940 . 4.080 4.215 3.694 4.395 0.315 18 0 "[ . 1 . 2]" 1
568 2 64 VAL H 2 76 CYS H 2.380 . 2.960 3.439 3.118 3.674 0.714 2 11 "[ + *-** *** . ***]" 1
569 2 64 VAL QG 2 65 THR H 3.100 . 4.400 2.745 2.459 3.323 . 0 0 "[ . 1 . 2]" 1
570 2 64 VAL QG 2 74 PHE QE 2.640 . 3.480 2.635 2.077 3.514 0.034 12 0 "[ . 1 . 2]" 1
571 2 64 VAL QG 2 126 LEU QD 3.170 . 4.540 2.502 1.661 3.744 0.139 6 0 "[ . 1 . 2]" 1
572 2 64 VAL QG 2 128 LEU QD 3.280 . 4.760 2.530 1.848 3.455 . 0 0 "[ . 1 . 2]" 1
573 2 65 THR H 2 66 ALA H 3.280 . 4.760 4.403 4.289 4.581 . 0 0 "[ . 1 . 2]" 1
574 2 66 ALA H 2 67 SER H 3.210 . 4.620 4.273 4.111 4.391 . 0 0 "[ . 1 . 2]" 1
575 2 66 ALA H 2 73 ALA H 3.010 . 4.220 4.389 4.110 4.633 0.413 10 0 "[ . 1 . 2]" 1
576 2 66 ALA H 2 74 PHE H 2.610 . 3.420 3.506 3.198 3.656 0.236 17 0 "[ . 1 . 2]" 1
577 2 66 ALA H 2 74 PHE QD 3.510 . 5.220 4.791 4.498 5.016 . 0 0 "[ . 1 . 2]" 1
578 2 66 ALA H 2 75 LEU MD2 2.510 . 3.220 2.541 2.162 3.077 . 0 0 "[ . 1 . 2]" 1
579 2 66 ALA MB 2 67 SER H 2.590 . 3.380 2.909 2.566 3.180 . 0 0 "[ . 1 . 2]" 1
580 2 66 ALA MB 2 73 ALA H 3.320 . 4.830 3.821 3.617 4.063 . 0 0 "[ . 1 . 2]" 1
581 2 66 ALA MB 2 73 ALA MB 2.770 . 3.740 2.361 1.972 2.633 . 0 0 "[ . 1 . 2]" 1
582 2 66 ALA MB 2 74 PHE H 2.850 . 3.900 2.541 2.269 2.850 . 0 0 "[ . 1 . 2]" 1
583 2 66 ALA MB 2 74 PHE QD 3.010 . 4.220 3.033 2.808 3.136 . 0 0 "[ . 1 . 2]" 1
584 2 66 ALA MB 2 74 PHE QE 2.750 . 3.700 2.814 2.682 2.951 . 0 0 "[ . 1 . 2]" 1
585 2 67 SER H 2 68 LEU H 3.090 . 4.380 4.276 4.174 4.387 0.007 12 0 "[ . 1 . 2]" 1
586 2 67 SER H 2 73 ALA H 3.130 . 4.460 4.128 3.963 4.335 . 0 0 "[ . 1 . 2]" 1
587 2 67 SER H 2 73 ALA MB 2.850 . 3.900 3.500 3.198 3.750 . 0 0 "[ . 1 . 2]" 1
588 2 67 SER H 2 74 PHE H 3.500 . 5.200 4.907 4.790 5.016 . 0 0 "[ . 1 . 2]" 1
589 2 68 LEU H 2 69 GLY H 3.190 . 4.580 4.222 3.864 4.483 . 0 0 "[ . 1 . 2]" 1
590 2 68 LEU H 2 71 GLU H 2.890 . 3.990 3.981 3.733 4.225 0.235 20 0 "[ . 1 . 2]" 1
591 2 68 LEU H 2 72 THR H 3.390 . 4.980 5.044 4.825 5.345 0.365 1 0 "[ . 1 . 2]" 1
592 2 68 LEU H 2 73 ALA H 2.730 . 3.660 3.117 2.695 4.199 0.539 1 1 "[+ . 1 . 2]" 1
593 2 68 LEU H 2 73 ALA MB 2.620 . 3.440 2.418 2.071 2.772 . 0 0 "[ . 1 . 2]" 1
594 2 68 LEU QD 2 69 GLY H 2.520 . 3.240 2.738 2.135 4.218 0.978 1 2 "[+ . 1- . 2]" 1
595 2 68 LEU QD 2 73 ALA MB 3.410 . 5.020 2.942 1.740 3.514 0.060 1 0 "[ . 1 . 2]" 1
596 2 69 GLY H 2 70 GLU H 3.220 . 4.640 4.472 4.349 4.583 . 0 0 "[ . 1 . 2]" 1
597 2 69 GLY H 2 71 GLU H 3.290 . 4.780 4.619 4.369 4.881 0.101 7 0 "[ . 1 . 2]" 1
598 2 70 GLU H 2 71 GLU H 2.300 . 2.800 2.472 2.059 3.021 0.221 10 0 "[ . 1 . 2]" 1
599 2 71 GLU H 2 72 THR H 3.190 . 4.580 4.423 4.318 4.513 . 0 0 "[ . 1 . 2]" 1
600 2 72 THR H 2 73 ALA H 3.330 . 4.860 4.564 4.465 4.635 . 0 0 "[ . 1 . 2]" 1
601 2 73 ALA H 2 74 PHE H 2.060 . 2.320 2.442 2.217 2.730 0.410 13 0 "[ . 1 . 2]" 1
602 2 73 ALA MB 2 74 PHE H 2.540 . 3.280 2.107 1.914 2.219 . 0 0 "[ . 1 . 2]" 1
603 2 73 ALA MB 2 74 PHE QD 3.440 . 5.080 2.537 2.376 2.780 . 0 0 "[ . 1 . 2]" 1
604 2 74 PHE H 2 75 LEU H 3.160 . 4.520 4.307 4.267 4.342 . 0 0 "[ . 1 . 2]" 1
605 2 74 PHE H 2 75 LEU MD2 3.250 . 4.700 4.192 3.857 4.439 . 0 0 "[ . 1 . 2]" 1
606 2 74 PHE QD 2 75 LEU H 2.980 . 4.160 3.359 3.088 3.657 . 0 0 "[ . 1 . 2]" 1
607 2 74 PHE QD 2 123 PHE QE 3.430 . 5.060 3.516 2.909 4.162 . 0 0 "[ . 1 . 2]" 1
608 2 74 PHE QE 2 126 LEU QD 2.990 . 4.180 3.188 1.747 4.622 0.442 17 0 "[ . 1 . 2]" 1
609 2 75 LEU H 2 76 CYS H 3.180 . 4.560 4.292 3.957 4.422 . 0 0 "[ . 1 . 2]" 1
610 2 75 LEU MD2 2 76 CYS H 3.440 . 5.080 3.737 3.520 3.994 . 0 0 "[ . 1 . 2]" 1
611 2 76 CYS H 2 77 GLU H 3.170 . 4.540 4.348 4.148 4.467 . 0 0 "[ . 1 . 2]" 1
612 2 77 GLU H 2 78 VAL H 3.160 . 4.520 4.081 3.986 4.153 . 0 0 "[ . 1 . 2]" 1
613 2 77 GLU H 2 78 VAL MG2 3.130 . 4.460 3.492 3.363 3.721 . 0 0 "[ . 1 . 2]" 1
614 2 78 VAL H 2 79 GLN H 3.170 . 4.540 4.387 4.342 4.458 . 0 0 "[ . 1 . 2]" 1
615 2 78 VAL MG1 2 79 GLN H 2.400 . 3.000 2.333 2.234 2.418 . 0 0 "[ . 1 . 2]" 1
616 2 78 VAL MG1 2 80 GLN H 3.080 . 4.360 2.914 2.717 3.146 . 0 0 "[ . 1 . 2]" 1
617 2 78 VAL MG2 2 79 GLN H 3.360 . 4.920 3.942 3.796 4.003 . 0 0 "[ . 1 . 2]" 1
618 2 78 VAL MG2 2 114 ILE H 3.230 . 4.660 2.671 2.519 2.984 . 0 0 "[ . 1 . 2]" 1
619 2 79 GLN H 2 80 GLN H 2.920 . 4.040 3.857 3.747 3.979 . 0 0 "[ . 1 . 2]" 1
620 2 80 GLN H 2 81 GLY H 3.150 . 4.500 4.209 4.142 4.306 . 0 0 "[ . 1 . 2]" 1
621 2 80 GLN H 2 110 ALA MB 3.170 . 4.540 3.257 3.079 3.420 . 0 0 "[ . 1 . 2]" 1
622 2 81 GLY H 2 82 GLY H 3.260 . 4.720 4.550 4.514 4.574 . 0 0 "[ . 1 . 2]" 1
623 2 82 GLY H 2 83 ILE H 3.220 . 4.640 4.084 3.966 4.212 . 0 0 "[ . 1 . 2]" 1
624 2 82 GLY H 2 84 PHE QE 3.200 . 4.600 3.993 3.730 4.313 . 0 0 "[ . 1 . 2]" 1
625 2 83 ILE H 2 84 PHE H 3.290 . 4.780 4.462 4.351 4.537 . 0 0 "[ . 1 . 2]" 1
626 2 83 ILE H 2 84 PHE QE 3.510 . 5.220 5.055 4.899 5.187 . 0 0 "[ . 1 . 2]" 1
627 2 84 PHE H 2 85 SER H 3.150 . 4.500 4.360 4.264 4.448 . 0 0 "[ . 1 . 2]" 1
628 2 84 PHE QD 2 85 SER H 3.390 . 4.980 4.085 3.834 4.407 . 0 0 "[ . 1 . 2]" 1
629 2 85 SER H 2 86 ILE H 3.220 . 4.640 4.171 3.782 4.453 . 0 0 "[ . 1 . 2]" 1
630 2 86 ILE H 2 87 ALA H 3.200 . 4.600 4.299 4.049 4.435 . 0 0 "[ . 1 . 2]" 1
631 2 87 ALA H 2 88 GLY H 3.170 . 4.540 4.387 4.137 4.531 . 0 0 "[ . 1 . 2]" 1
632 2 87 ALA H 2 89 ILE H 2.820 . 3.840 4.100 3.765 4.766 0.926 2 4 "[ + . ** - . 2]" 1
633 2 87 ALA MB 2 88 GLY H 2.700 . 3.600 2.583 2.257 3.079 . 0 0 "[ . 1 . 2]" 1
634 2 88 GLY H 2 89 ILE H 2.630 . 3.460 3.276 2.747 3.687 0.227 2 0 "[ . 1 . 2]" 1
635 2 89 ILE H 2 90 GLU H 3.320 . 4.830 4.616 4.531 4.701 . 0 0 "[ . 1 . 2]" 1
636 2 90 GLU H 2 91 GLY H 3.190 . 4.580 4.367 4.236 4.420 . 0 0 "[ . 1 . 2]" 1
637 2 90 GLU H 2 94 MET H 3.030 . 4.260 3.577 2.935 4.438 0.178 11 0 "[ . 1 . 2]" 1
638 2 91 GLY H 2 92 THR H 3.260 . 4.720 4.520 4.405 4.586 . 0 0 "[ . 1 . 2]" 1
639 2 91 GLY H 2 94 MET H 3.270 . 4.740 4.182 3.752 4.653 . 0 0 "[ . 1 . 2]" 1
640 2 92 THR H 2 93 GLN H 2.080 . 2.360 2.554 2.251 2.694 0.334 4 0 "[ . 1 . 2]" 1
641 2 92 THR H 2 94 MET H 3.070 . 4.340 4.270 3.939 4.624 0.284 14 0 "[ . 1 . 2]" 1
642 2 93 GLN H 2 94 MET H 2.400 . 3.000 2.625 2.477 2.988 . 0 0 "[ . 1 . 2]" 1
643 2 93 GLN H 2 95 ALA H 3.430 . 5.060 4.047 3.768 4.391 . 0 0 "[ . 1 . 2]" 1
644 2 93 GLN H 2 96 HIS H 3.360 . 4.920 4.868 4.510 5.639 0.719 20 1 "[ . 1 . +]" 1
645 2 94 MET H 2 95 ALA H 2.490 . 3.180 2.578 2.371 2.891 . 0 0 "[ . 1 . 2]" 1
646 2 94 MET H 2 96 HIS H 2.980 . 4.160 4.075 3.732 4.499 0.339 20 0 "[ . 1 . 2]" 1
647 2 94 MET H 2 97 CYS H 3.470 . 5.140 4.790 4.467 5.277 0.137 7 0 "[ . 1 . 2]" 1
648 2 94 MET ME 2 98 LEU QD 3.290 . 4.080 3.022 1.711 5.371 1.291 6 4 "[ .+- 1 . * *]" 1
649 2 95 ALA H 2 96 HIS H 2.340 . 2.880 2.649 2.485 2.789 . 0 0 "[ . 1 . 2]" 1
650 2 95 ALA H 2 97 CYS H 3.330 . 4.860 4.013 3.854 4.300 . 0 0 "[ . 1 . 2]" 1
651 2 95 ALA H 2 98 LEU H 3.390 . 4.980 5.170 4.781 5.641 0.661 7 2 "[ . + -1 . 2]" 1
652 2 95 ALA MB 2 96 HIS H 2.700 . 3.600 2.720 2.583 2.917 . 0 0 "[ . 1 . 2]" 1
653 2 96 HIS H 2 97 CYS H 2.400 . 3.000 2.466 2.300 2.668 . 0 0 "[ . 1 . 2]" 1
654 2 96 HIS H 2 98 LEU H 2.960 . 4.120 4.585 4.153 4.949 0.829 7 9 "[* * . + *1** *.- * 2]" 1
655 2 96 HIS H 2 99 GLY H 3.360 . 4.920 4.661 4.467 4.953 0.033 7 0 "[ . 1 . 2]" 1
656 2 96 HIS H 2 137 PHE QE 3.440 . 5.080 5.390 3.808 9.095 4.015 17 7 "[ * . ***1* . + -]" 1
657 2 97 CYS H 2 98 LEU H 2.250 . 2.700 2.756 2.552 3.026 0.326 14 0 "[ . 1 . 2]" 1
658 2 97 CYS H 2 99 GLY H 2.980 . 4.160 3.672 3.425 4.074 . 0 0 "[ . 1 . 2]" 1
659 2 97 CYS H 2 100 ALA H 3.390 . 4.980 4.670 4.119 5.166 0.186 10 0 "[ . 1 . 2]" 1
660 2 97 CYS H 2 101 TYR H 3.430 . 5.060 4.862 4.500 5.310 0.250 10 0 "[ . 1 . 2]" 1
661 2 98 LEU H 2 99 GLY H 2.210 . 2.620 2.466 2.184 2.682 0.062 14 0 "[ . 1 . 2]" 1
662 2 98 LEU H 2 100 ALA H 2.930 . 4.060 4.151 3.805 4.369 0.309 1 0 "[ . 1 . 2]" 1
663 2 98 LEU H 2 101 TYR H 3.280 . 4.760 4.866 4.499 5.122 0.362 1 0 "[ . 1 . 2]" 1
664 2 98 LEU H 2 102 CYS H 3.440 . 5.080 4.945 4.608 5.240 0.160 16 0 "[ . 1 . 2]" 1
665 2 99 GLY H 2 100 ALA H 2.050 . 2.300 2.462 2.331 2.563 0.263 19 0 "[ . 1 . 2]" 1
666 2 99 GLY H 2 100 ALA MB 3.350 . 4.900 4.168 3.996 4.375 . 0 0 "[ . 1 . 2]" 1
667 2 99 GLY H 2 101 TYR H 2.970 . 4.140 4.133 3.997 4.322 0.182 16 0 "[ . 1 . 2]" 1
668 2 99 GLY H 2 102 CYS H 3.220 . 4.640 4.827 4.541 5.168 0.528 19 1 "[ . 1 . +2]" 1
669 2 100 ALA H 2 101 TYR H 2.030 . 2.260 2.189 2.046 2.330 0.070 12 0 "[ . 1 . 2]" 1
670 2 100 ALA H 2 102 CYS H 2.530 . 3.260 3.543 3.180 3.887 0.627 9 3 "[ -* +1 . 2]" 1
671 2 100 ALA MB 2 101 TYR H 2.520 . 3.240 2.418 2.236 2.716 . 0 0 "[ . 1 . 2]" 1
672 2 100 ALA MB 2 133 PHE QD 3.500 . 5.200 4.366 4.000 5.043 . 0 0 "[ . 1 . 2]" 1
673 2 100 ALA MB 2 134 ASP H 3.020 . 4.240 2.784 2.438 3.511 . 0 0 "[ . 1 . 2]" 1
674 2 101 TYR H 2 102 CYS H 2.250 . 2.700 2.707 2.520 2.899 0.199 14 0 "[ . 1 . 2]" 1
675 2 101 TYR QD 2 102 CYS H 3.140 . 4.480 3.620 3.325 4.008 . 0 0 "[ . 1 . 2]" 1
676 2 109 TYR H 2 110 ALA H 2.190 . 2.580 2.643 2.578 2.744 0.164 13 0 "[ . 1 . 2]" 1
677 2 109 TYR H 2 111 ARG H 2.960 . 4.120 3.929 3.797 4.069 . 0 0 "[ . 1 . 2]" 1
678 2 109 TYR H 2 112 GLU H 3.390 . 4.980 4.849 4.720 5.174 0.194 20 0 "[ . 1 . 2]" 1
679 2 109 TYR QD 2 110 ALA H 3.390 . 4.980 3.980 3.800 4.370 . 0 0 "[ . 1 . 2]" 1
680 2 110 ALA H 2 111 ARG H 2.150 . 2.500 2.636 2.512 2.758 0.258 2 0 "[ . 1 . 2]" 1
681 2 110 ALA H 2 112 GLU H 2.970 . 4.140 4.499 4.364 4.690 0.550 13 2 "[ . 1 + . -]" 1
682 2 110 ALA H 2 113 CYS H 3.350 . 4.900 4.887 4.764 4.981 0.081 20 0 "[ . 1 . 2]" 1
683 2 110 ALA MB 2 111 ARG H 2.660 . 3.520 2.554 2.497 2.662 . 0 0 "[ . 1 . 2]" 1
684 2 111 ARG H 2 112 GLU H 2.300 . 2.800 2.868 2.719 3.055 0.255 2 0 "[ . 1 . 2]" 1
685 2 111 ARG H 2 113 CYS H 3.040 . 4.280 4.035 3.838 4.197 . 0 0 "[ . 1 . 2]" 1
686 2 112 GLU H 2 113 CYS H 2.220 . 2.640 2.630 2.538 2.773 0.133 14 0 "[ . 1 . 2]" 1
687 2 112 GLU H 2 114 ILE H 3.140 . 4.480 4.367 4.186 4.539 0.059 19 0 "[ . 1 . 2]" 1
688 2 113 CYS H 2 114 ILE H 2.340 . 2.880 2.706 2.610 2.925 0.045 10 0 "[ . 1 . 2]" 1
689 2 113 CYS H 2 115 THR H 3.220 . 4.640 4.231 4.029 4.432 . 0 0 "[ . 1 . 2]" 1
690 2 113 CYS H 2 116 SER H 3.470 . 5.140 4.720 4.618 4.883 . 0 0 "[ . 1 . 2]" 1
691 2 114 ILE H 2 115 THR H 2.370 . 2.940 2.719 2.579 2.857 . 0 0 "[ . 1 . 2]" 1
692 2 114 ILE H 2 116 SER H 3.040 . 4.280 4.072 3.912 4.270 . 0 0 "[ . 1 . 2]" 1
693 2 115 THR H 2 116 SER H 2.360 . 2.920 2.683 2.568 2.777 . 0 0 "[ . 1 . 2]" 1
694 2 115 THR H 2 117 MET H 3.390 . 4.980 4.313 4.096 4.498 . 0 0 "[ . 1 . 2]" 1
695 2 115 THR H 2 118 VAL H 3.480 . 5.160 4.860 4.708 5.029 . 0 0 "[ . 1 . 2]" 1
696 2 115 THR H 2 118 VAL QG 3.500 . 5.200 4.215 4.008 4.491 . 0 0 "[ . 1 . 2]" 1
697 2 116 SER H 2 117 MET H 2.420 . 3.040 2.706 2.496 2.815 . 0 0 "[ . 1 . 2]" 1
698 2 116 SER H 2 118 VAL H 3.020 . 4.240 4.107 3.827 4.290 0.050 18 0 "[ . 1 . 2]" 1
699 2 117 MET H 2 118 VAL H 2.350 . 2.900 2.623 2.405 2.766 . 0 0 "[ . 1 . 2]" 1
700 2 117 MET H 2 119 SER H 3.320 . 4.830 4.183 3.967 4.494 . 0 0 "[ . 1 . 2]" 1
701 2 118 VAL H 2 119 SER H 2.440 . 3.080 2.672 2.495 2.830 . 0 0 "[ . 1 . 2]" 1
702 2 118 VAL QG 2 119 SER H 2.970 . 4.140 3.095 2.283 3.307 . 0 0 "[ . 1 . 2]" 1
703 2 118 VAL QG 2 123 PHE H 3.020 . 4.240 3.526 3.175 3.853 . 0 0 "[ . 1 . 2]" 1
704 2 118 VAL QG 2 123 PHE QD 3.170 . 4.540 3.252 2.738 3.660 . 0 0 "[ . 1 . 2]" 1
705 2 118 VAL QG 2 126 LEU QD 3.510 . 5.220 2.862 1.700 3.916 0.100 8 0 "[ . 1 . 2]" 1
706 2 119 SER H 2 121 GLY H 3.130 . 4.460 4.084 3.956 4.235 . 0 0 "[ . 1 . 2]" 1
707 2 119 SER H 2 123 PHE H 3.520 . 5.240 5.119 4.838 5.881 0.641 1 1 "[+ . 1 . 2]" 1
708 2 121 GLY H 2 122 THR H 2.330 . 2.860 2.655 2.502 2.782 . 0 0 "[ . 1 . 2]" 1
709 2 121 GLY H 2 123 PHE H 2.760 . 3.720 3.658 3.277 4.147 0.427 5 0 "[ . 1 . 2]" 1
710 2 122 THR H 2 123 PHE H 2.380 . 2.960 2.728 2.559 2.943 . 0 0 "[ . 1 . 2]" 1
711 2 125 GLN H 2 126 LEU H 3.320 . 4.840 4.525 4.352 4.657 . 0 0 "[ . 1 . 2]" 1
712 2 125 GLN H 3 125 GLN H 2.990 . 4.180 4.126 2.879 5.463 1.283 10 6 "[ . + *.*- **]" 1
713 2 126 LEU H 2 127 ASN H 2.720 . 3.640 3.854 3.256 4.226 0.586 17 2 "[ . 1 -. + 2]" 1
714 2 126 LEU QD 2 127 ASN H 3.130 . 4.460 3.380 2.571 4.420 . 0 0 "[ . 1 . 2]" 1
715 2 126 LEU QD 2 128 LEU H 3.480 . 5.160 4.821 3.343 6.391 1.231 4 5 "[ +. -1 * . **]" 1
716 2 127 ASN H 2 128 LEU H 3.240 . 4.680 4.363 4.038 4.533 . 0 0 "[ . 1 . 2]" 1
717 2 128 LEU H 2 129 ALA H 3.320 . 4.840 4.535 4.289 4.648 . 0 0 "[ . 1 . 2]" 1
718 2 128 LEU QD 2 129 ALA H . . 3.340 3.266 1.909 4.502 1.162 14 3 "[ . 1 +.* -2]" 1
719 2 128 LEU QD 2 131 VAL QG 2.890 . 3.980 3.927 2.018 5.523 1.543 14 7 "[* * . **1 *+.- 2]" 1
720 2 133 PHE H 2 134 ASP H 2.300 . 2.800 2.631 2.529 2.817 0.017 13 0 "[ . 1 . 2]" 1
721 2 133 PHE H 2 135 ALA H 3.090 . 4.380 4.336 4.098 4.654 0.274 7 0 "[ . 1 . 2]" 1
722 2 133 PHE QD 2 134 ASP H 3.180 . 4.560 3.988 3.592 4.255 . 0 0 "[ . 1 . 2]" 1
723 2 134 ASP H 2 135 ALA H 2.380 . 2.960 2.733 2.520 2.930 . 0 0 "[ . 1 . 2]" 1
724 2 134 ASP H 2 136 LEU H 3.250 . 4.700 4.118 3.732 4.614 . 0 0 "[ . 1 . 2]" 1
725 2 135 ALA H 2 136 LEU H 2.400 . 3.000 2.627 2.483 2.793 . 0 0 "[ . 1 . 2]" 1
726 2 135 ALA H 2 137 PHE H 3.280 . 4.760 4.221 3.899 4.695 . 0 0 "[ . 1 . 2]" 1
727 2 135 ALA H 2 138 MET H 3.330 . 4.860 4.719 4.502 4.937 0.077 3 0 "[ . 1 . 2]" 1
728 2 135 ALA MB 2 136 LEU H 2.570 . 3.340 2.661 2.330 2.945 . 0 0 "[ . 1 . 2]" 1
729 2 136 LEU H 2 137 PHE H 2.440 . 3.080 2.676 2.479 2.822 . 0 0 "[ . 1 . 2]" 1
730 2 136 LEU H 2 138 MET H 3.020 . 4.240 4.016 3.628 4.386 0.146 19 0 "[ . 1 . 2]" 1
731 2 136 LEU H 2 139 ASN H 3.500 . 5.200 4.829 4.535 5.435 0.235 11 0 "[ . 1 . 2]" 1
732 2 136 LEU QD 2 137 PHE H 3.370 . 4.940 3.658 3.020 4.206 . 0 0 "[ . 1 . 2]" 1
733 2 137 PHE H 2 138 MET H 2.280 . 2.760 2.596 2.339 2.788 0.028 12 0 "[ . 1 . 2]" 1
734 2 137 PHE H 2 139 ASN H 3.110 . 4.420 4.085 3.905 4.317 . 0 0 "[ . 1 . 2]" 1
735 2 137 PHE H 2 140 TYR H 3.440 . 5.080 4.816 4.564 5.284 0.204 15 0 "[ . 1 . 2]" 1
736 2 137 PHE QD 2 138 MET H 3.370 . 4.940 4.020 3.091 4.702 . 0 0 "[ . 1 . 2]" 1
737 2 137 PHE QD 2 141 LEU QD 3.090 . 4.380 3.118 2.145 4.338 . 0 0 "[ . 1 . 2]" 1
738 2 137 PHE QE 2 141 LEU QD 3.200 . 4.600 2.750 1.975 5.820 1.220 8 1 "[ . + 1 . 2]" 1
739 2 138 MET H 2 139 ASN H 2.340 . 2.880 2.592 2.480 2.791 . 0 0 "[ . 1 . 2]" 1
740 2 138 MET H 2 140 TYR H 3.070 . 4.340 3.970 3.728 4.293 . 0 0 "[ . 1 . 2]" 1
741 2 138 MET H 2 141 LEU H 3.440 . 5.080 4.987 4.589 5.597 0.517 15 1 "[ . 1 + 2]" 1
742 2 139 ASN H 2 140 TYR H 2.190 . 2.580 2.465 2.351 2.520 . 0 0 "[ . 1 . 2]" 1
743 2 139 ASN H 2 141 LEU H 3.000 . 4.200 4.016 3.663 4.557 0.357 15 0 "[ . 1 . 2]" 1
744 2 140 TYR H 2 141 LEU H 2.250 . 2.700 2.542 2.330 2.734 0.034 15 0 "[ . 1 . 2]" 1
745 2 140 TYR QD 2 141 LEU H 3.360 . 4.920 4.047 3.275 4.473 . 0 0 "[ . 1 . 2]" 1
746 3 9 MET H 3 10 THR H 3.190 . 4.580 3.780 3.585 4.049 . 0 0 "[ . 1 . 2]" 1
747 3 9 MET ME 3 10 THR H 3.050 . 4.300 5.265 4.517 5.705 1.405 19 19 "[*********-******* +*]" 1
748 3 9 MET ME 3 11 PHE H 3.500 . 5.200 4.682 3.760 6.009 0.809 6 4 "[ - .+ 1 * . * 2]" 1
749 3 9 MET ME 3 11 PHE QD 3.270 . 4.740 3.833 1.886 5.221 0.481 13 0 "[ . 1 . 2]" 1
750 3 9 MET ME 3 87 ALA H 3.470 . 5.140 5.815 3.489 7.164 2.024 14 12 "[ - .*** ****+*** 2]" 1
751 3 10 THR H 3 11 PHE H 2.750 . 3.700 3.987 3.680 4.274 0.574 2 3 "[ + . * . - 2]" 1
752 3 10 THR H 3 87 ALA H 2.600 . 3.400 3.429 2.937 3.942 0.542 18 2 "[ - . 1 . + 2]" 1
753 3 10 THR H 3 89 ILE H 2.780 . 3.760 4.011 3.468 5.181 1.421 19 6 "[* . *1- .** +2]" 1
754 3 11 PHE H 3 12 GLN H 3.260 . 4.720 4.413 4.307 4.527 . 0 0 "[ . 1 . 2]" 1
755 3 11 PHE QD 3 12 GLN H 2.550 . 3.300 3.595 3.319 3.853 0.553 17 2 "[ . 1 . + -2]" 1
756 3 11 PHE QD 3 101 TYR QD 3.500 . 5.200 4.297 3.746 4.752 . 0 0 "[ . 1 . 2]" 1
757 3 11 PHE QD 3 101 TYR QE 3.470 . 5.140 3.349 2.660 4.014 . 0 0 "[ . 1 . 2]" 1
758 3 11 PHE QE 3 12 GLN H 3.130 . 4.460 4.568 4.234 4.950 0.490 17 0 "[ . 1 . 2]" 1
759 3 11 PHE QE 3 13 ILE H 3.410 . 5.020 4.542 4.077 5.284 0.264 15 0 "[ . 1 . 2]" 1
760 3 11 PHE QE 3 84 PHE QD 3.140 . 4.480 3.273 2.665 3.489 . 0 0 "[ . 1 . 2]" 1
761 3 11 PHE QE 3 84 PHE QE 3.490 . 5.180 3.788 3.248 4.180 . 0 0 "[ . 1 . 2]" 1
762 3 11 PHE QE 3 101 TYR QD 3.170 . 4.540 3.382 2.979 3.638 . 0 0 "[ . 1 . 2]" 1
763 3 11 PHE QE 3 101 TYR QE 3.330 . 4.860 2.698 2.021 3.393 . 0 0 "[ . 1 . 2]" 1
764 3 12 GLN H 3 13 ILE H 2.870 . 3.940 4.228 4.017 4.345 0.405 15 0 "[ . 1 . 2]" 1
765 3 12 GLN H 3 85 SER H 2.610 . 3.420 3.258 2.757 3.682 0.262 2 0 "[ . 1 . 2]" 1
766 3 13 ILE H 3 14 GLN H 3.320 . 4.830 4.457 4.267 4.597 . 0 0 "[ . 1 . 2]" 1
767 3 14 GLN H 3 15 ARG H 2.010 . 2.220 2.300 2.103 2.511 0.291 9 0 "[ . 1 . 2]" 1
768 3 14 GLN H 3 83 ILE H 3.310 . 4.820 4.746 3.945 5.044 0.224 11 0 "[ . 1 . 2]" 1
769 3 14 GLN H 3 84 PHE QD 3.430 . 5.060 3.721 3.207 4.404 . 0 0 "[ . 1 . 2]" 1
770 3 14 GLN H 3 85 SER H 3.250 . 4.700 3.971 3.436 4.567 . 0 0 "[ . 1 . 2]" 1
771 3 15 ARG H 3 16 ILE H 3.150 . 4.500 4.176 3.946 4.310 . 0 0 "[ . 1 . 2]" 1
772 3 15 ARG H 3 83 ILE H 2.660 . 3.520 3.299 2.814 3.515 . 0 0 "[ . 1 . 2]" 1
773 3 16 ILE H 3 17 TYR H 3.220 . 4.640 4.428 4.326 4.542 . 0 0 "[ . 1 . 2]" 1
774 3 17 TYR H 3 18 THR H 3.180 . 4.560 4.286 4.180 4.340 . 0 0 "[ . 1 . 2]" 1
775 3 17 TYR H 3 81 GLY H 2.870 . 3.940 3.910 3.577 4.057 0.117 20 0 "[ . 1 . 2]" 1
776 3 17 TYR QD 3 18 THR H 3.010 . 4.220 3.757 3.487 4.128 . 0 0 "[ . 1 . 2]" 1
777 3 17 TYR QD 4 28 ALA MB 3.280 . 4.760 3.126 2.835 3.294 . 0 0 "[ . 1 . 2]" 1
778 3 17 TYR QE 3 83 ILE H 3.350 . 4.900 3.279 2.925 3.602 . 0 0 "[ . 1 . 2]" 1
779 3 17 TYR QE 4 28 ALA MB 2.980 . 4.160 1.798 1.662 2.144 0.138 12 0 "[ . 1 . 2]" 1
780 3 18 THR H 3 19 LYS H 3.140 . 4.480 4.388 4.232 4.564 0.084 12 0 "[ . 1 . 2]" 1
781 3 18 THR H 3 81 GLY H 3.400 . 5.000 4.861 4.499 5.108 0.108 20 0 "[ . 1 . 2]" 1
782 3 18 THR H 4 121 GLY H 3.290 . 4.780 4.188 3.993 4.429 . 0 0 "[ . 1 . 2]" 1
783 3 18 THR H 4 122 THR H 3.470 . 5.140 4.649 4.518 4.887 . 0 0 "[ . 1 . 2]" 1
784 3 19 LYS H 3 20 ASP H 2.260 . 2.730 2.418 2.268 2.563 . 0 0 "[ . 1 . 2]" 1
785 3 19 LYS H 3 59 VAL MG1 3.200 . 4.600 4.340 3.790 5.047 0.447 11 0 "[ . 1 . 2]" 1
786 3 19 LYS H 3 81 GLY H 2.210 . 2.620 2.440 2.184 2.791 0.171 1 0 "[ . 1 . 2]" 1
787 3 20 ASP H 3 21 ILE H 3.170 . 4.540 4.255 4.085 4.316 . 0 0 "[ . 1 . 2]" 1
788 3 20 ASP H 3 59 VAL MG1 3.470 . 5.140 4.776 4.261 5.268 0.128 11 0 "[ . 1 . 2]" 1
789 3 20 ASP H 3 79 GLN H 2.820 . 3.840 3.219 2.971 3.477 . 0 0 "[ . 1 . 2]" 1
790 3 20 ASP H 3 81 GLY H 3.430 . 5.060 4.619 4.334 4.994 . 0 0 "[ . 1 . 2]" 1
791 3 21 ILE H 3 22 SER H 3.070 . 4.340 4.261 4.162 4.308 . 0 0 "[ . 1 . 2]" 1
792 3 21 ILE H 3 79 GLN H 3.480 . 5.160 4.710 4.524 4.874 . 0 0 "[ . 1 . 2]" 1
793 3 21 ILE H 4 23 PHE H 2.460 . 3.120 2.922 2.776 3.092 . 0 0 "[ . 1 . 2]" 1
794 3 21 ILE H 4 23 PHE QD 3.190 . 4.580 3.298 2.788 3.894 . 0 0 "[ . 1 . 2]" 1
795 3 22 SER H 3 23 PHE H 3.220 . 4.640 4.250 4.208 4.285 . 0 0 "[ . 1 . 2]" 1
796 3 22 SER H 3 77 GLU H 2.790 . 3.780 3.216 2.901 3.655 . 0 0 "[ . 1 . 2]" 1
797 3 22 SER H 3 78 VAL H 3.460 . 5.120 5.058 4.905 5.206 0.086 7 0 "[ . 1 . 2]" 1
798 3 22 SER H 3 78 VAL MG2 3.500 . 5.200 3.117 2.841 3.401 . 0 0 "[ . 1 . 2]" 1
799 3 22 SER H 3 79 GLN H 3.270 . 4.740 5.342 5.068 5.661 0.921 14 14 "[ * ** ***- *+*** **]" 1
800 3 22 SER H 4 23 PHE H 3.520 . 5.240 5.131 4.918 5.402 0.162 12 0 "[ . 1 . 2]" 1
801 3 23 PHE H 3 24 GLU H 2.990 . 4.180 4.044 3.785 4.266 0.086 10 0 "[ . 1 . 2]" 1
802 3 23 PHE H 4 21 ILE H 2.820 . 3.840 2.692 2.549 2.980 . 0 0 "[ . 1 . 2]" 1
803 3 23 PHE QD 3 24 GLU H 2.850 . 3.900 3.603 3.179 4.068 0.168 16 0 "[ . 1 . 2]" 1
804 3 23 PHE QD 4 21 ILE H 3.440 . 5.080 4.114 3.834 4.263 . 0 0 "[ . 1 . 2]" 1
805 3 23 PHE QE 3 24 GLU H 3.510 . 5.220 4.593 4.048 5.160 . 0 0 "[ . 1 . 2]" 1
806 3 23 PHE QE 3 25 ALA MB 3.030 . 4.260 2.556 2.328 2.901 . 0 0 "[ . 1 . 2]" 1
807 3 23 PHE QE 3 121 GLY H 3.440 . 5.080 3.699 3.415 3.880 . 0 0 "[ . 1 . 2]" 1
808 3 24 GLU H 3 25 ALA H 3.260 . 4.720 4.235 4.071 4.422 . 0 0 "[ . 1 . 2]" 1
809 3 24 GLU H 3 75 LEU H 2.690 . 3.580 3.127 2.877 3.674 0.094 15 0 "[ . 1 . 2]" 1
810 3 24 GLU H 3 75 LEU MD1 3.490 . 5.180 3.827 3.279 4.484 . 0 0 "[ . 1 . 2]" 1
811 3 25 ALA H 4 21 ILE H 3.510 . 5.220 5.525 5.002 6.036 0.816 19 7 "[ **.- * . *+*]" 1
812 3 25 ALA MB 3 27 ASN H 3.460 . 5.120 3.871 3.544 4.200 . 0 0 "[ . 1 . 2]" 1
813 3 25 ALA MB 3 28 ALA H 3.230 . 4.660 3.180 2.927 3.369 . 0 0 "[ . 1 . 2]" 1
814 3 25 ALA MB 3 28 ALA MB 3.110 . 4.410 1.917 1.718 2.202 0.082 20 0 "[ . 1 . 2]" 1
815 3 25 ALA MB 3 123 PHE QE 3.350 . 4.900 2.211 1.947 2.587 . 0 0 "[ . 1 . 2]" 1
816 3 27 ASN H 3 28 ALA H 2.430 . 3.060 2.815 2.617 3.174 0.114 16 0 "[ . 1 . 2]" 1
817 3 28 ALA H 3 30 HIS H 2.980 . 4.160 4.013 3.881 4.157 . 0 0 "[ . 1 . 2]" 1
818 3 28 ALA MB 4 17 TYR QD 3.300 . 4.800 2.833 2.419 3.300 . 0 0 "[ . 1 . 2]" 1
819 3 28 ALA MB 4 17 TYR QE 3.080 . 4.360 2.051 1.686 2.503 0.114 9 0 "[ . 1 . 2]" 1
820 3 30 HIS H 3 31 VAL H 2.350 . 2.900 2.652 2.481 2.770 . 0 0 "[ . 1 . 2]" 1
821 3 30 HIS H 3 32 PHE H 3.210 . 4.620 4.536 3.961 5.058 0.438 2 0 "[ . 1 . 2]" 1
822 3 31 VAL H 3 32 PHE H 2.370 . 2.940 2.823 2.530 3.098 0.158 2 0 "[ . 1 . 2]" 1
823 3 31 VAL H 3 33 GLN H 3.240 . 4.680 4.538 4.169 4.984 0.304 7 0 "[ . 1 . 2]" 1
824 3 31 VAL QG 3 32 PHE H 2.400 . 3.000 2.555 2.156 3.392 0.392 1 0 "[ . 1 . 2]" 1
825 3 31 VAL QG 3 32 PHE QD 3.200 . 4.600 4.124 2.897 5.064 0.464 7 0 "[ . 1 . 2]" 1
826 3 31 VAL QG 3 32 PHE QE 3.510 . 5.220 5.380 3.178 6.641 1.421 7 14 "[ * *. +**1 *-*******]" 1
827 3 32 PHE H 3 33 GLN H 2.360 . 2.920 2.664 2.371 2.912 . 0 0 "[ . 1 . 2]" 1
828 3 32 PHE H 3 34 LYS H 3.320 . 4.840 4.210 3.768 4.925 0.085 7 0 "[ . 1 . 2]" 1
829 3 32 PHE QD 3 33 GLN H 3.340 . 4.880 3.931 3.455 4.743 . 0 0 "[ . 1 . 2]" 1
830 3 33 GLN H 3 34 LYS H 2.460 . 3.120 2.633 2.330 3.379 0.259 15 0 "[ . 1 . 2]" 1
831 3 34 LYS H 3 35 ASP H 3.260 . 4.720 4.501 4.408 4.603 . 0 0 "[ . 1 . 2]" 1
832 3 35 ASP H 3 36 TRP H 3.270 . 4.740 4.470 4.119 4.573 . 0 0 "[ . 1 . 2]" 1
833 3 35 ASP H 3 37 GLN H 3.470 . 5.140 5.215 4.867 6.305 1.165 8 1 "[ . + 1 . 2]" 1
834 3 36 TRP H 3 37 GLN H 2.870 . 3.940 3.732 3.538 4.201 0.261 8 0 "[ . 1 . 2]" 1
835 3 39 GLU H 3 40 VAL H 2.910 . 4.020 4.213 4.011 4.412 0.392 4 0 "[ . 1 . 2]" 1
836 3 39 GLU H 3 66 ALA MB 3.440 . 5.080 5.345 4.986 5.719 0.639 7 3 "[ - * + 1 . 2]" 1
837 3 39 GLU H 3 67 SER H 2.150 . 2.500 3.331 3.062 3.703 1.203 5 20 [****+*******-*******] 1
838 3 39 GLU H 3 68 LEU H 2.860 . 3.920 4.216 3.422 5.068 1.148 15 8 "[* * * - 1** + *]" 1
839 3 40 VAL H 3 41 LYS H 3.310 . 4.820 4.279 4.100 4.568 . 0 0 "[ . 1 . 2]" 1
840 3 40 VAL H 3 67 SER H 3.480 . 5.160 4.910 4.539 5.332 0.172 6 0 "[ . 1 . 2]" 1
841 3 40 VAL QG 3 41 LYS H . . 3.280 3.262 2.580 3.737 0.457 8 0 "[ . 1 . 2]" 1
842 3 40 VAL QG 3 64 VAL MG1 2.890 . 3.990 2.461 1.942 3.812 . 0 0 "[ . 1 . 2]" 1
843 3 40 VAL QG 3 65 THR H 3.510 . 5.220 4.095 3.548 5.049 . 0 0 "[ . 1 . 2]" 1
844 3 40 VAL QG 3 126 LEU QD 2.710 . 3.620 1.918 1.671 2.530 0.129 20 0 "[ . 1 . 2]" 1
845 3 41 LYS H 3 42 LEU H 3.130 . 4.460 4.215 3.967 4.518 0.058 6 0 "[ . 1 . 2]" 1
846 3 41 LYS H 3 64 VAL MG1 3.220 . 4.640 4.417 3.620 4.827 0.187 19 0 "[ . 1 . 2]" 1
847 3 41 LYS H 3 65 THR H 2.370 . 2.940 3.511 2.992 3.932 0.992 5 13 "[** *+-**** ** **2]" 1
848 3 42 LEU H 3 43 ASP H 3.300 . 4.800 4.540 4.423 4.603 . 0 0 "[ . 1 . 2]" 1
849 3 42 LEU QD 3 43 ASP H 2.240 . 2.680 3.163 1.730 4.274 1.594 17 12 "[ * .-**** ***+* *]" 1
850 3 42 LEU QD 3 44 LEU H 3.380 . 4.960 4.466 2.387 6.347 1.387 15 4 "[ . 1 +* - *]" 1
851 3 42 LEU QD 3 44 LEU QD 2.850 . 3.900 3.027 1.919 5.096 1.196 15 3 "[ . -1 + *]" 1
852 3 42 LEU QD 3 62 VAL QG 3.310 . 4.820 3.457 2.014 4.841 0.021 14 0 "[ . 1 . 2]" 1
853 3 42 LEU QD 3 128 LEU QD 2.680 . 3.560 2.033 1.531 2.576 0.269 5 0 "[ . 1 . 2]" 1
854 3 42 LEU QD 3 131 VAL QG 3.340 . 4.880 4.293 3.076 7.069 2.189 4 4 "[ +. 1 * - *]" 1
855 3 43 ASP H 3 44 LEU H 2.970 . 4.140 4.163 3.815 4.413 0.273 17 0 "[ . 1 . 2]" 1
856 3 43 ASP H 3 62 VAL QG 3.530 . 5.250 3.702 3.172 4.353 . 0 0 "[ . 1 . 2]" 1
857 3 43 ASP H 3 63 THR H 2.780 . 3.760 3.139 2.780 3.431 . 0 0 "[ . 1 . 2]" 1
858 3 43 ASP H 3 128 LEU QD 3.410 . 5.020 4.551 3.118 5.802 0.782 18 2 "[ . 1 - + 2]" 1
859 3 44 LEU H 3 45 ASP H 3.270 . 4.740 4.328 4.058 4.524 . 0 0 "[ . 1 . 2]" 1
860 3 44 LEU QD 3 45 ASP H 3.370 . 4.940 3.571 2.043 4.468 . 0 0 "[ . 1 . 2]" 1
861 3 44 LEU QD 3 60 LEU QD 3.250 . 4.700 2.886 1.735 4.377 0.065 9 0 "[ . 1 . 2]" 1
862 3 44 LEU QD 3 131 VAL QG 3.320 . 4.830 3.297 2.016 6.011 1.181 4 1 "[ +. 1 . 2]" 1
863 3 45 ASP H 3 46 THR H 3.030 . 4.260 4.332 4.106 4.459 0.199 8 0 "[ . 1 . 2]" 1
864 3 45 ASP H 3 60 LEU QD 2.420 . 3.040 3.004 2.196 4.486 1.446 13 1 "[ . 1 + . 2]" 1
865 3 45 ASP H 3 61 ARG H 2.780 . 3.760 3.566 3.061 4.088 0.328 8 0 "[ . 1 . 2]" 1
866 3 46 THR H 3 47 ALA H 3.260 . 4.720 4.347 4.209 4.457 . 0 0 "[ . 1 . 2]" 1
867 3 46 THR H 3 60 LEU QD 3.130 . 4.460 4.310 3.610 5.804 1.344 13 1 "[ . 1 + . 2]" 1
868 3 46 THR H 3 61 ARG H 3.480 . 5.160 4.778 4.359 5.025 . 0 0 "[ . 1 . 2]" 1
869 3 47 ALA H 3 48 SER H 3.220 . 4.640 4.414 4.316 4.487 . 0 0 "[ . 1 . 2]" 1
870 3 47 ALA H 3 58 VAL QG 2.650 . 3.500 3.619 2.965 4.746 1.246 3 5 "[ + . - * .** 2]" 1
871 3 47 ALA H 3 59 VAL H 2.260 . 2.730 2.826 2.501 3.210 0.480 10 0 "[ . 1 . 2]" 1
872 3 47 ALA MB 3 48 SER H 2.430 . 3.060 2.429 2.175 2.852 . 0 0 "[ . 1 . 2]" 1
873 3 47 ALA MB 3 59 VAL H 2.910 . 4.020 3.369 2.902 3.914 . 0 0 "[ . 1 . 2]" 1
874 3 48 SER H 3 49 SER H 3.200 . 4.600 4.357 4.263 4.436 . 0 0 "[ . 1 . 2]" 1
875 3 48 SER H 3 59 VAL H 3.510 . 5.220 4.743 4.406 5.130 . 0 0 "[ . 1 . 2]" 1
876 3 49 SER H 3 50 GLN H 2.990 . 4.180 4.184 4.085 4.342 0.162 5 0 "[ . 1 . 2]" 1
877 3 49 SER H 3 57 GLU H 2.300 . 2.800 3.122 2.727 3.480 0.680 12 4 "[ - . * 1 + * 2]" 1
878 3 50 GLN H 3 51 LEU H 3.300 . 4.800 4.431 4.291 4.570 . 0 0 "[ . 1 . 2]" 1
879 3 50 GLN H 3 57 GLU H 3.450 . 5.100 4.973 4.759 5.142 0.042 2 0 "[ . 1 . 2]" 1
880 3 51 LEU H 3 52 ALA H 1.930 . 2.060 2.234 2.038 2.336 0.276 6 0 "[ . 1 . 2]" 1
881 3 51 LEU H 3 55 VAL H 3.270 . 4.740 4.790 4.489 4.996 0.256 7 0 "[ . 1 . 2]" 1
882 3 51 LEU H 3 55 VAL MG1 3.190 . 4.580 3.490 3.201 3.702 . 0 0 "[ . 1 . 2]" 1
883 3 51 LEU H 3 56 TYR H 3.490 . 5.180 4.773 4.564 4.896 . 0 0 "[ . 1 . 2]" 1
884 3 51 LEU H 3 57 GLU H 3.380 . 4.960 3.666 3.352 4.091 . 0 0 "[ . 1 . 2]" 1
885 3 51 LEU MD1 3 55 VAL MG1 3.080 . 4.360 2.331 2.077 2.518 . 0 0 "[ . 1 . 2]" 1
886 3 51 LEU MD2 3 57 GLU H 3.480 . 5.160 3.823 3.411 4.711 . 0 0 "[ . 1 . 2]" 1
887 3 52 ALA H 3 53 ASP H 3.170 . 4.540 4.327 4.300 4.390 . 0 0 "[ . 1 . 2]" 1
888 3 52 ALA H 3 55 VAL H 2.850 . 3.900 3.483 3.301 3.618 . 0 0 "[ . 1 . 2]" 1
889 3 52 ALA H 3 55 VAL MG1 2.940 . 4.080 3.351 3.185 3.686 . 0 0 "[ . 1 . 2]" 1
890 3 52 ALA H 3 55 VAL MG2 3.290 . 4.780 4.144 3.820 4.452 . 0 0 "[ . 1 . 2]" 1
891 3 52 ALA MB 3 53 ASP H 2.310 . 2.820 1.931 1.776 2.395 0.024 6 0 "[ . 1 . 2]" 1
892 3 52 ALA MB 3 55 VAL MG1 3.490 . 5.180 3.035 2.791 3.202 . 0 0 "[ . 1 . 2]" 1
893 3 52 ALA MB 3 55 VAL MG2 3.060 . 4.320 2.541 2.049 2.818 . 0 0 "[ . 1 . 2]" 1
894 3 53 ASP H 3 54 ASP H 3.290 . 4.780 4.421 4.261 4.545 . 0 0 "[ . 1 . 2]" 1
895 3 53 ASP H 3 55 VAL H 3.370 . 4.940 4.125 3.966 4.420 . 0 0 "[ . 1 . 2]" 1
896 3 53 ASP H 3 55 VAL MG2 3.390 . 4.980 4.162 3.689 4.609 . 0 0 "[ . 1 . 2]" 1
897 3 54 ASP H 3 55 VAL H 2.360 . 2.920 2.767 2.583 2.888 . 0 0 "[ . 1 . 2]" 1
898 3 55 VAL H 3 56 TYR H 3.170 . 4.540 4.218 4.061 4.353 . 0 0 "[ . 1 . 2]" 1
899 3 55 VAL H 3 56 TYR QD 3.340 . 4.880 4.226 3.564 4.779 . 0 0 "[ . 1 . 2]" 1
900 3 55 VAL H 3 56 TYR QE 3.230 . 4.660 4.291 3.734 4.839 0.179 7 0 "[ . 1 . 2]" 1
901 3 55 VAL MG1 3 56 TYR H 2.560 . 3.320 3.102 2.941 3.428 0.108 7 0 "[ . 1 . 2]" 1
902 3 55 VAL MG2 3 56 TYR H 3.410 . 5.020 4.177 4.016 4.297 . 0 0 "[ . 1 . 2]" 1
903 3 56 TYR H 3 57 GLU H 3.220 . 4.640 4.305 4.137 4.492 . 0 0 "[ . 1 . 2]" 1
904 3 56 TYR H 3 84 PHE H 2.910 . 4.020 3.444 3.220 3.705 . 0 0 "[ . 1 . 2]" 1
905 3 56 TYR H 3 86 ILE H 3.410 . 5.020 3.654 3.111 4.274 . 0 0 "[ . 1 . 2]" 1
906 3 56 TYR QD 3 57 GLU H 3.220 . 4.640 4.241 3.665 4.616 . 0 0 "[ . 1 . 2]" 1
907 3 57 GLU H 3 58 VAL H 3.160 . 4.520 4.406 4.191 4.555 0.035 15 0 "[ . 1 . 2]" 1
908 3 58 VAL H 3 59 VAL H 3.230 . 4.660 4.376 4.193 4.482 . 0 0 "[ . 1 . 2]" 1
909 3 58 VAL H 3 59 VAL MG2 3.440 . 5.080 4.257 3.741 4.529 . 0 0 "[ . 1 . 2]" 1
910 3 58 VAL H 3 82 GLY H 2.550 . 3.300 3.045 2.683 3.435 0.135 8 0 "[ . 1 . 2]" 1
911 3 58 VAL H 3 84 PHE H 3.080 . 4.360 4.418 3.891 4.968 0.608 5 3 "[ + 1 * . - 2]" 1
912 3 58 VAL QG 3 59 VAL H . . 3.100 2.835 2.413 3.475 0.375 17 0 "[ . 1 . 2]" 1
913 3 58 VAL QG 3 60 LEU H 3.470 . 5.140 3.731 3.388 4.678 . 0 0 "[ . 1 . 2]" 1
914 3 58 VAL QG 3 82 GLY H 3.130 . 4.460 3.956 3.144 4.513 0.053 7 0 "[ . 1 . 2]" 1
915 3 58 VAL QG 3 84 PHE H 3.530 . 5.250 4.471 4.043 4.813 . 0 0 "[ . 1 . 2]" 1
916 3 58 VAL QG 3 84 PHE QD 3.000 . 4.200 2.212 1.913 2.476 . 0 0 "[ . 1 . 2]" 1
917 3 58 VAL QG 3 84 PHE QE 2.970 . 4.140 2.674 2.020 3.156 . 0 0 "[ . 1 . 2]" 1
918 3 59 VAL H 3 60 LEU H 3.080 . 4.360 4.103 4.007 4.414 0.054 17 0 "[ . 1 . 2]" 1
919 3 59 VAL MG1 3 60 LEU H 2.780 . 3.760 3.264 2.743 3.380 . 0 0 "[ . 1 . 2]" 1
920 3 59 VAL MG1 3 80 GLN H 2.890 . 3.990 3.757 3.337 4.243 0.253 5 0 "[ . 1 . 2]" 1
921 3 59 VAL MG1 3 81 GLY H 3.080 . 4.360 3.882 3.333 4.777 0.417 1 0 "[ . 1 . 2]" 1
922 3 59 VAL MG2 3 81 GLY H 3.460 . 5.120 4.550 4.006 5.221 0.101 1 0 "[ . 1 . 2]" 1
923 3 59 VAL MG2 3 82 GLY H 3.120 . 4.440 3.719 3.244 4.196 . 0 0 "[ . 1 . 2]" 1
924 3 60 LEU H 3 61 ARG H 3.180 . 4.560 4.159 3.873 4.370 . 0 0 "[ . 1 . 2]" 1
925 3 60 LEU H 3 80 GLN H 2.830 . 3.860 3.770 3.323 4.155 0.295 3 0 "[ . 1 . 2]" 1
926 3 60 LEU QD 3 61 ARG H 2.760 . 3.720 2.836 2.563 4.474 0.754 13 1 "[ . 1 + . 2]" 1
927 3 60 LEU QD 3 62 VAL H 3.240 . 4.680 3.657 3.405 4.544 . 0 0 "[ . 1 . 2]" 1
928 3 60 LEU QD 3 62 VAL QG 2.640 . 3.480 1.948 1.780 2.292 0.020 20 0 "[ . 1 . 2]" 1
929 3 61 ARG H 3 62 VAL H 3.180 . 4.560 4.395 4.236 4.516 . 0 0 "[ . 1 . 2]" 1
930 3 62 VAL H 3 63 THR H 3.140 . 4.480 4.338 4.027 4.515 0.035 19 0 "[ . 1 . 2]" 1
931 3 62 VAL H 3 78 VAL H 2.490 . 3.180 3.259 3.036 3.589 0.409 13 0 "[ . 1 . 2]" 1
932 3 62 VAL H 3 79 GLN H 3.490 . 5.180 4.939 4.489 5.184 0.004 7 0 "[ . 1 . 2]" 1
933 3 62 VAL H 3 80 GLN H 3.150 . 4.500 4.045 3.744 4.417 . 0 0 "[ . 1 . 2]" 1
934 3 62 VAL QG 3 63 THR H 2.940 . 4.080 2.703 2.193 3.315 . 0 0 "[ . 1 . 2]" 1
935 3 62 VAL QG 3 64 VAL MG2 2.880 . 3.960 2.487 1.925 2.797 . 0 0 "[ . 1 . 2]" 1
936 3 62 VAL QG 3 80 GLN H 3.500 . 5.200 4.061 3.358 4.513 . 0 0 "[ . 1 . 2]" 1
937 3 62 VAL QG 3 110 ALA MB 2.810 . 3.820 2.012 1.858 2.132 . 0 0 "[ . 1 . 2]" 1
938 3 62 VAL QG 3 128 LEU QD 2.490 . 3.180 2.769 1.919 4.129 0.949 18 3 "[* . 1 . +-2]" 1
939 3 63 THR H 3 64 VAL H 3.190 . 4.580 4.262 4.061 4.473 . 0 0 "[ . 1 . 2]" 1
940 3 64 VAL H 3 65 THR H 3.100 . 4.400 4.148 3.943 4.373 . 0 0 "[ . 1 . 2]" 1
941 3 64 VAL H 3 75 LEU MD1 3.270 . 4.740 4.164 3.754 4.542 . 0 0 "[ . 1 . 2]" 1
942 3 64 VAL H 3 76 CYS H 2.560 . 3.320 3.238 2.850 3.587 0.267 20 0 "[ . 1 . 2]" 1
943 3 64 VAL H 3 77 GLU H 3.510 . 5.220 4.889 4.728 5.042 . 0 0 "[ . 1 . 2]" 1
944 3 64 VAL MG1 3 65 THR H 2.920 . 4.040 3.069 2.547 3.308 . 0 0 "[ . 1 . 2]" 1
945 3 64 VAL MG1 3 126 LEU QD 2.870 . 3.940 2.225 1.749 4.362 0.422 1 0 "[ . 1 . 2]" 1
946 3 64 VAL MG2 3 128 LEU QD 2.830 . 3.860 2.705 1.712 4.224 0.364 1 0 "[ . 1 . 2]" 1
947 3 65 THR H 3 66 ALA H 3.230 . 4.660 4.388 4.180 4.502 . 0 0 "[ . 1 . 2]" 1
948 3 65 THR H 3 75 LEU MD2 3.510 . 5.220 3.864 3.675 4.141 . 0 0 "[ . 1 . 2]" 1
949 3 66 ALA H 3 67 SER H 2.970 . 4.140 3.942 3.722 4.221 0.081 15 0 "[ . 1 . 2]" 1
950 3 66 ALA H 3 73 ALA H 3.220 . 4.640 4.726 4.529 5.096 0.456 10 0 "[ . 1 . 2]" 1
951 3 66 ALA H 3 74 PHE H 2.690 . 3.580 3.416 3.149 3.653 0.073 10 0 "[ . 1 . 2]" 1
952 3 66 ALA H 3 74 PHE QD 3.390 . 4.980 4.283 3.898 4.827 . 0 0 "[ . 1 . 2]" 1
953 3 66 ALA H 3 74 PHE QE 3.410 . 5.020 4.830 4.504 5.427 0.407 19 0 "[ . 1 . 2]" 1
954 3 66 ALA H 3 75 LEU MD2 3.350 . 4.900 3.692 3.453 3.944 . 0 0 "[ . 1 . 2]" 1
955 3 66 ALA MB 3 67 SER H 3.100 . 4.400 3.500 3.396 3.594 . 0 0 "[ . 1 . 2]" 1
956 3 66 ALA MB 3 73 ALA H 3.480 . 5.160 3.655 3.417 3.849 . 0 0 "[ . 1 . 2]" 1
957 3 66 ALA MB 3 73 ALA MB 3.010 . 4.220 2.171 1.932 2.529 . 0 0 "[ . 1 . 2]" 1
958 3 66 ALA MB 3 74 PHE H 3.190 . 4.580 2.352 2.147 2.593 . 0 0 "[ . 1 . 2]" 1
959 3 66 ALA MB 3 74 PHE QD 3.330 . 4.860 3.016 2.928 3.099 . 0 0 "[ . 1 . 2]" 1
960 3 66 ALA MB 3 74 PHE QE 2.760 . 3.720 2.890 2.765 3.053 . 0 0 "[ . 1 . 2]" 1
961 3 67 SER H 3 68 LEU H 3.100 . 4.400 4.263 4.107 4.385 . 0 0 "[ . 1 . 2]" 1
962 3 67 SER H 3 73 ALA H 3.400 . 5.000 4.432 4.219 4.725 . 0 0 "[ . 1 . 2]" 1
963 3 68 LEU H 3 69 GLY H 2.310 . 2.820 2.781 1.957 4.005 1.185 13 5 "[ * **1 + . -]" 1
964 3 68 LEU H 3 71 GLU H 3.360 . 4.920 4.180 3.495 4.888 . 0 0 "[ . 1 . 2]" 1
965 3 68 LEU H 3 73 ALA H 3.370 . 4.940 4.101 3.681 4.761 . 0 0 "[ . 1 . 2]" 1
966 3 69 GLY H 3 70 GLU H 2.420 . 3.040 3.583 2.864 4.496 1.456 20 10 "[ * ***1 ****- +]" 1
967 3 69 GLY H 3 71 GLU H 2.530 . 3.260 3.688 2.633 4.995 1.735 13 9 "[ * ***1 +**- *]" 1
968 3 70 GLU H 3 71 GLU H 2.010 . 2.220 2.182 1.809 2.271 0.051 14 0 "[ . 1 . 2]" 1
969 3 71 GLU H 3 72 THR H 3.180 . 4.560 4.137 4.000 4.429 . 0 0 "[ . 1 . 2]" 1
970 3 72 THR H 3 73 ALA H 3.270 . 4.740 4.457 4.350 4.524 . 0 0 "[ . 1 . 2]" 1
971 3 73 ALA H 3 74 PHE H 2.240 . 2.680 2.634 2.386 2.914 0.234 1 0 "[ . 1 . 2]" 1
972 3 73 ALA MB 3 74 PHE H 2.540 . 3.280 2.186 2.057 2.328 . 0 0 "[ . 1 . 2]" 1
973 3 73 ALA MB 3 74 PHE QD 3.270 . 4.740 2.624 2.321 3.020 . 0 0 "[ . 1 . 2]" 1
974 3 73 ALA MB 3 123 PHE QE 3.510 . 5.220 3.036 2.490 3.826 . 0 0 "[ . 1 . 2]" 1
975 3 74 PHE H 3 75 LEU H 3.190 . 4.580 4.335 4.205 4.381 . 0 0 "[ . 1 . 2]" 1
976 3 74 PHE QD 3 75 LEU H 2.880 . 3.960 3.216 2.761 3.861 . 0 0 "[ . 1 . 2]" 1
977 3 74 PHE QD 3 123 PHE QD 3.140 . 4.480 3.079 2.647 3.265 . 0 0 "[ . 1 . 2]" 1
978 3 74 PHE QD 3 123 PHE QE 2.830 . 3.860 3.475 3.163 3.818 . 0 0 "[ . 1 . 2]" 1
979 3 74 PHE QE 3 118 VAL MG1 3.070 . 4.340 2.865 2.500 3.152 . 0 0 "[ . 1 . 2]" 1
980 3 74 PHE QE 3 118 VAL MG2 3.270 . 4.740 2.598 2.431 2.856 . 0 0 "[ . 1 . 2]" 1
981 3 74 PHE QE 3 123 PHE QD 3.150 . 4.500 3.684 3.435 4.009 . 0 0 "[ . 1 . 2]" 1
982 3 74 PHE QE 3 123 PHE QE 3.520 . 5.240 4.995 4.637 5.368 0.128 10 0 "[ . 1 . 2]" 1
983 3 75 LEU H 3 76 CYS H 3.140 . 4.480 4.305 3.924 4.491 0.011 15 0 "[ . 1 . 2]" 1
984 3 75 LEU MD1 3 76 CYS H 2.450 . 3.100 2.288 2.087 3.173 0.073 5 0 "[ . 1 . 2]" 1
985 3 75 LEU MD1 3 77 GLU H 3.420 . 5.040 3.631 2.843 4.004 . 0 0 "[ . 1 . 2]" 1
986 3 75 LEU MD2 3 76 CYS H 2.850 . 3.900 2.367 2.052 3.091 . 0 0 "[ . 1 . 2]" 1
987 3 76 CYS H 3 77 GLU H 3.240 . 4.680 4.234 3.935 4.513 . 0 0 "[ . 1 . 2]" 1
988 3 77 GLU H 3 78 VAL H 3.000 . 4.200 4.167 4.023 4.400 0.200 1 0 "[ . 1 . 2]" 1
989 3 77 GLU H 3 78 VAL MG2 3.140 . 4.480 3.683 3.375 4.336 . 0 0 "[ . 1 . 2]" 1
990 3 78 VAL H 3 79 GLN H 3.110 . 4.420 4.165 3.973 4.361 . 0 0 "[ . 1 . 2]" 1
991 3 78 VAL MG1 3 79 GLN H 2.810 . 3.820 2.869 2.500 3.236 . 0 0 "[ . 1 . 2]" 1
992 3 78 VAL MG1 3 80 GLN H 3.120 . 4.440 3.131 2.820 3.642 . 0 0 "[ . 1 . 2]" 1
993 3 78 VAL MG1 3 110 ALA MB 2.970 . 4.140 2.686 2.136 3.189 . 0 0 "[ . 1 . 2]" 1
994 3 78 VAL MG1 3 114 ILE H 3.450 . 5.100 4.343 3.963 4.672 . 0 0 "[ . 1 . 2]" 1
995 3 78 VAL MG2 3 79 GLN H 3.500 . 5.200 4.095 3.911 4.225 . 0 0 "[ . 1 . 2]" 1
996 3 78 VAL MG2 3 114 ILE H 2.990 . 4.180 3.099 2.967 3.208 . 0 0 "[ . 1 . 2]" 1
997 3 79 GLN H 3 80 GLN H 3.010 . 4.220 4.026 3.819 4.204 . 0 0 "[ . 1 . 2]" 1
998 3 80 GLN H 3 81 GLY H 3.200 . 4.600 4.314 4.168 4.565 . 0 0 "[ . 1 . 2]" 1
999 3 80 GLN H 3 110 ALA MB 3.060 . 4.320 3.361 3.032 3.598 . 0 0 "[ . 1 . 2]" 1
1000 3 81 GLY H 3 82 GLY H 3.280 . 4.760 4.559 4.451 4.600 . 0 0 "[ . 1 . 2]" 1
1001 3 82 GLY H 3 83 ILE H 3.130 . 4.460 4.069 3.958 4.279 . 0 0 "[ . 1 . 2]" 1
1002 3 83 ILE H 3 84 PHE H 3.190 . 4.580 4.447 4.347 4.489 . 0 0 "[ . 1 . 2]" 1
1003 3 84 PHE H 3 85 SER H 3.270 . 4.740 4.238 4.114 4.401 . 0 0 "[ . 1 . 2]" 1
1004 3 84 PHE QD 3 85 SER H 3.250 . 4.700 4.181 3.774 4.475 . 0 0 "[ . 1 . 2]" 1
1005 3 85 SER H 3 86 ILE H 3.250 . 4.700 4.363 4.230 4.456 . 0 0 "[ . 1 . 2]" 1
1006 3 86 ILE H 3 87 ALA H 3.170 . 4.540 4.184 4.008 4.493 . 0 0 "[ . 1 . 2]" 1
1007 3 87 ALA H 3 88 GLY H 3.180 . 4.560 4.424 4.361 4.486 . 0 0 "[ . 1 . 2]" 1
1008 3 87 ALA H 3 89 ILE H 2.920 . 4.040 4.181 3.844 4.476 0.436 11 0 "[ . 1 . 2]" 1
1009 3 87 ALA MB 3 88 GLY H 2.710 . 3.620 2.544 2.297 2.836 . 0 0 "[ . 1 . 2]" 1
1010 3 88 GLY H 3 89 ILE H 2.750 . 3.700 3.173 2.766 3.514 . 0 0 "[ . 1 . 2]" 1
1011 3 89 ILE H 3 90 GLU H 3.280 . 4.760 4.539 4.424 4.626 . 0 0 "[ . 1 . 2]" 1
1012 3 90 GLU H 3 91 GLY H 3.190 . 4.580 4.373 4.327 4.412 . 0 0 "[ . 1 . 2]" 1
1013 3 90 GLU H 3 94 MET H 3.040 . 4.280 3.896 3.407 4.288 0.008 18 0 "[ . 1 . 2]" 1
1014 3 91 GLY H 3 92 THR H 3.280 . 4.760 4.587 4.377 4.654 . 0 0 "[ . 1 . 2]" 1
1015 3 91 GLY H 3 94 MET H 3.250 . 4.700 4.107 3.682 4.536 . 0 0 "[ . 1 . 2]" 1
1016 3 91 GLY H 3 94 MET ME 2.460 . 3.120 3.091 1.850 5.914 2.794 13 5 "[ *. * 1 +*.- 2]" 1
1017 3 92 THR H 3 93 GLN H 2.170 . 2.540 2.628 2.531 3.006 0.466 19 0 "[ . 1 . 2]" 1
1018 3 92 THR H 3 94 MET H 3.310 . 4.820 4.444 3.933 4.627 . 0 0 "[ . 1 . 2]" 1
1019 3 92 THR H 3 95 ALA H 3.500 . 5.200 4.736 4.487 5.009 . 0 0 "[ . 1 . 2]" 1
1020 3 93 GLN H 3 94 MET H 2.480 . 3.160 2.705 2.497 2.861 . 0 0 "[ . 1 . 2]" 1
1021 3 93 GLN H 3 95 ALA H 3.020 . 4.240 3.835 3.657 4.161 . 0 0 "[ . 1 . 2]" 1
1022 3 94 MET H 3 95 ALA H 2.360 . 2.920 2.497 2.355 2.619 . 0 0 "[ . 1 . 2]" 1
1023 3 94 MET H 3 96 HIS H 3.180 . 4.560 4.189 3.972 4.564 0.004 19 0 "[ . 1 . 2]" 1
1024 3 94 MET ME 3 95 ALA H 3.480 . 5.160 4.495 3.427 5.527 0.367 14 0 "[ . 1 . 2]" 1
1025 3 95 ALA H 3 96 HIS H 2.350 . 2.900 2.650 2.561 2.748 . 0 0 "[ . 1 . 2]" 1
1026 3 95 ALA H 3 97 CYS H 3.300 . 4.800 4.007 3.742 4.443 . 0 0 "[ . 1 . 2]" 1
1027 3 95 ALA H 3 98 LEU H 3.380 . 4.960 4.862 4.664 5.041 0.081 1 0 "[ . 1 . 2]" 1
1028 3 95 ALA MB 3 96 HIS H 2.700 . 3.600 2.627 2.411 2.935 . 0 0 "[ . 1 . 2]" 1
1029 3 96 HIS H 3 97 CYS H 2.320 . 2.840 2.653 2.539 2.877 0.037 20 0 "[ . 1 . 2]" 1
1030 3 96 HIS H 3 98 LEU H 2.910 . 4.020 4.483 4.088 4.760 0.740 10 10 "[*-* . **+** *. *2]" 1
1031 3 96 HIS H 3 99 GLY H 3.220 . 4.640 4.764 4.576 5.098 0.458 16 0 "[ . 1 . 2]" 1
1032 3 97 CYS H 3 98 LEU H 2.280 . 2.760 2.730 2.448 2.878 0.118 12 0 "[ . 1 . 2]" 1
1033 3 97 CYS H 3 99 GLY H 2.980 . 4.160 3.855 3.675 4.256 0.096 16 0 "[ . 1 . 2]" 1
1034 3 97 CYS H 3 100 ALA H 3.520 . 5.240 4.918 4.660 5.172 . 0 0 "[ . 1 . 2]" 1
1035 3 97 CYS H 3 101 TYR H 3.470 . 5.140 4.910 4.618 5.155 0.015 20 0 "[ . 1 . 2]" 1
1036 3 98 LEU H 3 99 GLY H 2.140 . 2.480 2.593 2.460 2.749 0.269 6 0 "[ . 1 . 2]" 1
1037 3 98 LEU H 3 100 ALA H 2.950 . 4.100 4.229 3.911 4.401 0.301 2 0 "[ . 1 . 2]" 1
1038 3 98 LEU H 3 101 TYR H 3.370 . 4.940 4.936 4.676 5.087 0.147 20 0 "[ . 1 . 2]" 1
1039 3 98 LEU H 3 102 CYS H 3.380 . 4.960 4.865 4.703 4.999 0.039 3 0 "[ . 1 . 2]" 1
1040 3 99 GLY H 3 100 ALA H 2.180 . 2.560 2.407 2.297 2.670 0.110 3 0 "[ . 1 . 2]" 1
1041 3 99 GLY H 3 100 ALA MB 3.400 . 5.000 4.085 3.885 4.232 . 0 0 "[ . 1 . 2]" 1
1042 3 99 GLY H 3 101 TYR H 3.140 . 4.480 4.113 3.858 4.490 0.010 16 0 "[ . 1 . 2]" 1
1043 3 99 GLY H 3 102 CYS H 3.320 . 4.830 4.813 4.640 5.393 0.563 16 1 "[ . 1 .+ 2]" 1
1044 3 100 ALA H 3 101 TYR H 2.140 . 2.480 2.254 2.081 2.574 0.094 16 0 "[ . 1 . 2]" 1
1045 3 100 ALA H 3 102 CYS H 2.490 . 3.180 3.541 3.269 3.921 0.741 4 6 "[* +. - 1 * .* * 2]" 1
1046 3 100 ALA MB 3 101 TYR H 2.420 . 3.040 2.328 2.116 2.493 . 0 0 "[ . 1 . 2]" 1
1047 3 100 ALA MB 3 134 ASP H 3.110 . 4.420 3.029 2.228 3.939 . 0 0 "[ . 1 . 2]" 1
1048 3 101 TYR H 3 102 CYS H 2.330 . 2.860 2.779 2.648 2.883 0.023 17 0 "[ . 1 . 2]" 1
1049 3 101 TYR QD 3 102 CYS H 3.110 . 4.410 3.286 2.840 3.726 . 0 0 "[ . 1 . 2]" 1
1050 3 109 TYR H 3 110 ALA H 2.310 . 2.820 2.651 2.518 2.760 . 0 0 "[ . 1 . 2]" 1
1051 3 109 TYR H 3 111 ARG H 3.010 . 4.220 3.952 3.787 4.281 0.061 6 0 "[ . 1 . 2]" 1
1052 3 109 TYR QD 3 110 ALA H 3.420 . 5.040 4.007 3.839 4.235 . 0 0 "[ . 1 . 2]" 1
1053 3 110 ALA H 3 111 ARG H 2.120 . 2.440 2.600 2.516 2.679 0.239 7 0 "[ . 1 . 2]" 1
1054 3 110 ALA H 3 112 GLU H 3.190 . 4.580 4.336 4.228 4.540 . 0 0 "[ . 1 . 2]" 1
1055 3 110 ALA H 3 113 CYS H 3.490 . 5.180 4.784 4.677 4.908 . 0 0 "[ . 1 . 2]" 1
1056 3 110 ALA MB 3 111 ARG H 2.700 . 3.600 2.580 2.489 2.696 . 0 0 "[ . 1 . 2]" 1
1057 3 111 ARG H 3 112 GLU H 2.440 . 3.080 2.765 2.655 2.940 . 0 0 "[ . 1 . 2]" 1
1058 3 111 ARG H 3 113 CYS H 3.120 . 4.440 3.988 3.852 4.193 . 0 0 "[ . 1 . 2]" 1
1059 3 111 ARG H 3 114 ILE H 3.410 . 5.020 4.770 4.613 4.916 . 0 0 "[ . 1 . 2]" 1
1060 3 112 GLU H 3 113 CYS H 2.360 . 2.920 2.546 2.473 2.650 . 0 0 "[ . 1 . 2]" 1
1061 3 112 GLU H 3 114 ILE H 3.250 . 4.700 4.112 3.988 4.332 . 0 0 "[ . 1 . 2]" 1
1062 3 112 GLU H 3 115 THR H 3.470 . 5.140 4.690 4.542 4.850 . 0 0 "[ . 1 . 2]" 1
1063 3 113 CYS H 3 114 ILE H 2.380 . 2.960 2.597 2.549 2.649 . 0 0 "[ . 1 . 2]" 1
1064 3 113 CYS H 3 115 THR H 3.150 . 4.500 4.114 3.959 4.272 . 0 0 "[ . 1 . 2]" 1
1065 3 113 CYS H 3 116 SER H 3.470 . 5.140 4.702 4.601 4.802 . 0 0 "[ . 1 . 2]" 1
1066 3 114 ILE H 3 115 THR H 2.410 . 3.020 2.587 2.504 2.654 . 0 0 "[ . 1 . 2]" 1
1067 3 114 ILE H 3 116 SER H 3.090 . 4.380 3.973 3.784 4.160 . 0 0 "[ . 1 . 2]" 1
1068 3 115 THR H 3 116 SER H 2.360 . 2.920 2.664 2.579 2.774 . 0 0 "[ . 1 . 2]" 1
1069 3 115 THR H 3 117 MET H 3.330 . 4.860 4.250 4.108 4.348 . 0 0 "[ . 1 . 2]" 1
1070 3 115 THR H 3 118 VAL H 3.500 . 5.200 4.729 4.626 4.860 . 0 0 "[ . 1 . 2]" 1
1071 3 116 SER H 3 117 MET H 2.350 . 2.900 2.680 2.574 2.748 . 0 0 "[ . 1 . 2]" 1
1072 3 116 SER H 3 118 VAL H 2.980 . 4.160 4.065 3.957 4.201 0.041 14 0 "[ . 1 . 2]" 1
1073 3 116 SER H 3 119 SER H 3.400 . 5.000 4.731 4.564 4.877 . 0 0 "[ . 1 . 2]" 1
1074 3 117 MET H 3 118 VAL H 2.360 . 2.920 2.791 2.743 2.882 . 0 0 "[ . 1 . 2]" 1
1075 3 117 MET H 3 119 SER H 3.250 . 4.700 4.260 4.085 4.392 . 0 0 "[ . 1 . 2]" 1
1076 3 117 MET ME 4 117 MET ME 3.290 . 4.780 3.424 3.064 3.808 . 0 0 "[ . 1 . 2]" 1
1077 3 118 VAL H 3 119 SER H 2.300 . 2.800 2.612 2.513 2.704 . 0 0 "[ . 1 . 2]" 1
1078 3 118 VAL H 3 121 GLY H 3.500 . 5.200 4.699 4.576 4.800 . 0 0 "[ . 1 . 2]" 1
1079 3 118 VAL MG1 3 119 SER H 3.030 . 4.260 3.421 3.298 3.645 . 0 0 "[ . 1 . 2]" 1
1080 3 118 VAL MG1 3 123 PHE H 3.140 . 4.480 3.149 3.020 3.449 . 0 0 "[ . 1 . 2]" 1
1081 3 118 VAL MG1 3 123 PHE QD 3.080 . 4.360 3.444 3.179 3.840 . 0 0 "[ . 1 . 2]" 1
1082 3 118 VAL MG1 3 126 LEU H 3.460 . 5.120 3.103 2.364 3.610 . 0 0 "[ . 1 . 2]" 1
1083 3 118 VAL MG2 3 119 SER H 3.260 . 4.720 3.817 3.724 3.970 . 0 0 "[ . 1 . 2]" 1
1084 3 119 SER H 3 121 GLY H 3.070 . 4.340 4.132 3.993 4.322 . 0 0 "[ . 1 . 2]" 1
1085 3 119 SER H 3 123 PHE H 3.470 . 5.140 4.911 4.700 5.190 0.050 3 0 "[ . 1 . 2]" 1
1086 3 121 GLY H 3 122 THR H 2.360 . 2.920 2.585 2.469 2.692 . 0 0 "[ . 1 . 2]" 1
1087 3 121 GLY H 3 123 PHE H 2.800 . 3.800 3.992 3.726 4.310 0.510 4 2 "[ +. 1 . - 2]" 1
1088 3 121 GLY H 4 18 THR H 3.160 . 4.520 4.092 3.886 4.249 . 0 0 "[ . 1 . 2]" 1
1089 3 122 THR H 3 123 PHE H 2.400 . 3.000 2.725 2.612 2.911 . 0 0 "[ . 1 . 2]" 1
1090 3 122 THR H 4 18 THR H 3.330 . 4.860 4.573 4.343 4.861 0.001 3 0 "[ . 1 . 2]" 1
1091 3 125 GLN H 3 126 LEU H 3.300 . 4.800 4.472 4.360 4.628 . 0 0 "[ . 1 . 2]" 1
1092 3 126 LEU H 3 127 ASN H 2.740 . 3.680 3.916 3.440 4.361 0.681 15 1 "[ . 1 + 2]" 1
1093 3 126 LEU QD 3 127 ASN H 3.100 . 4.400 3.088 2.398 3.613 . 0 0 "[ . 1 . 2]" 1
1094 3 126 LEU QD 3 128 LEU H 3.440 . 5.080 4.077 2.914 5.170 0.090 20 0 "[ . 1 . 2]" 1
1095 3 127 ASN H 3 128 LEU H 3.250 . 4.700 4.275 4.043 4.447 . 0 0 "[ . 1 . 2]" 1
1096 3 128 LEU H 3 129 ALA H 3.320 . 4.830 4.564 4.425 4.641 . 0 0 "[ . 1 . 2]" 1
1097 3 128 LEU QD 3 129 ALA H 2.400 . 3.000 2.590 1.657 3.761 0.761 13 4 "[ - . 1 + . * *]" 1
1098 3 128 LEU QD 3 129 ALA MB 3.380 . 4.960 3.567 2.589 4.835 . 0 0 "[ . 1 . 2]" 1
1099 3 131 VAL QG 3 133 PHE H 2.630 . 3.460 3.209 2.531 4.434 0.974 4 1 "[ +. 1 . 2]" 1
1100 3 131 VAL QG 3 133 PHE QD 3.230 . 4.660 4.163 3.220 5.779 1.119 4 1 "[ +. 1 . 2]" 1
1101 3 133 PHE H 3 134 ASP H 2.170 . 2.540 2.491 2.281 3.017 0.477 4 0 "[ . 1 . 2]" 1
1102 3 133 PHE H 3 135 ALA H 2.850 . 3.900 4.065 3.532 4.500 0.600 4 1 "[ +. 1 . 2]" 1
1103 3 133 PHE H 3 136 LEU H 3.470 . 5.140 4.923 4.451 5.517 0.377 5 0 "[ . 1 . 2]" 1
1104 3 133 PHE QD 3 134 ASP H 3.380 . 4.960 3.892 3.175 4.350 . 0 0 "[ . 1 . 2]" 1
1105 3 134 ASP H 3 135 ALA H 2.100 . 2.400 2.655 2.421 2.979 0.579 14 1 "[ . 1 +. 2]" 1
1106 3 134 ASP H 3 135 ALA MB 3.470 . 5.140 4.333 4.098 4.638 . 0 0 "[ . 1 . 2]" 1
1107 3 134 ASP H 3 136 LEU H 3.030 . 4.260 4.112 3.798 4.601 0.341 7 0 "[ . 1 . 2]" 1
1108 3 135 ALA H 3 136 LEU H 2.370 . 2.940 2.636 2.515 2.857 . 0 0 "[ . 1 . 2]" 1
1109 3 135 ALA H 3 137 PHE H 3.350 . 4.900 4.392 4.123 4.759 . 0 0 "[ . 1 . 2]" 1
1110 3 135 ALA H 3 138 MET H 3.400 . 5.000 4.869 4.600 5.409 0.409 9 0 "[ . 1 . 2]" 1
1111 3 135 ALA MB 3 136 LEU H 2.660 . 3.520 2.807 2.464 3.057 . 0 0 "[ . 1 . 2]" 1
1112 3 136 LEU H 3 137 PHE H 2.360 . 2.920 2.731 2.525 2.912 . 0 0 "[ . 1 . 2]" 1
1113 3 136 LEU H 3 138 MET H 2.930 . 4.060 4.013 3.680 4.349 0.289 9 0 "[ . 1 . 2]" 1
1114 3 137 PHE H 3 138 MET H 2.350 . 2.900 2.546 2.432 2.696 . 0 0 "[ . 1 . 2]" 1
1115 3 137 PHE H 3 140 TYR H 3.450 . 5.100 5.113 4.589 5.925 0.825 17 2 "[ . 1 . + -]" 1
1116 3 137 PHE QD 3 138 MET H 3.420 . 5.040 4.182 3.726 4.512 . 0 0 "[ . 1 . 2]" 1
1117 3 137 PHE QD 3 141 LEU H 3.390 . 4.980 5.458 3.766 8.543 3.563 20 9 "[ -*.** *1 * . ** +]" 1
1118 3 137 PHE QD 3 141 LEU QD 3.470 . 5.140 5.229 2.661 7.961 2.821 20 7 "[ *.* * 1- * * +]" 1
1119 3 137 PHE QE 3 141 LEU QD 3.310 . 4.820 6.005 2.708 9.496 4.676 20 14 "[*-**.****1* * * * *+]" 1
1120 3 138 MET H 3 139 ASN H 2.550 . 3.300 2.608 2.417 2.893 . 0 0 "[ . 1 . 2]" 1
1121 3 138 MET H 3 140 TYR H 3.000 . 4.200 4.148 3.929 4.602 0.402 17 0 "[ . 1 . 2]" 1
1122 3 139 ASN H 3 140 TYR H 2.330 . 2.860 2.645 2.531 2.967 0.107 17 0 "[ . 1 . 2]" 1
1123 3 140 TYR H 3 141 LEU H 2.640 . 3.480 3.404 3.088 4.498 1.018 17 3 "[ . 1 - . + *]" 1
1124 3 140 TYR QD 3 141 LEU H 3.030 . 4.260 3.109 2.210 4.273 0.013 2 0 "[ . 1 . 2]" 1
1125 4 9 MET H 4 10 THR H 3.270 . 4.740 4.542 4.484 4.646 . 0 0 "[ . 1 . 2]" 1
1126 4 9 MET ME 4 10 THR H 3.170 . 4.540 3.711 3.003 4.240 . 0 0 "[ . 1 . 2]" 1
1127 4 9 MET ME 4 11 PHE H 3.210 . 4.620 3.576 3.069 4.294 . 0 0 "[ . 1 . 2]" 1
1128 4 10 THR H 4 11 PHE H 3.180 . 4.560 4.321 4.138 4.489 . 0 0 "[ . 1 . 2]" 1
1129 4 10 THR H 4 87 ALA H 2.530 . 3.260 3.161 2.668 3.608 0.348 9 0 "[ . 1 . 2]" 1
1130 4 10 THR H 4 87 ALA MB 3.460 . 5.120 3.309 2.499 4.127 . 0 0 "[ . 1 . 2]" 1
1131 4 10 THR H 4 89 ILE H 3.080 . 4.360 4.474 3.934 4.889 0.529 2 1 "[ + . 1 . 2]" 1
1132 4 11 PHE H 4 12 GLN H 3.050 . 4.300 3.740 3.383 4.013 . 0 0 "[ . 1 . 2]" 1
1133 4 11 PHE QD 4 12 GLN H 2.800 . 3.800 4.007 3.569 4.293 0.493 14 0 "[ . 1 . 2]" 1
1134 4 11 PHE QE 4 12 GLN H 3.440 . 5.080 5.115 4.651 5.540 0.460 14 0 "[ . 1 . 2]" 1
1135 4 11 PHE QE 4 84 PHE QD 3.030 . 4.260 3.321 2.555 3.778 . 0 0 "[ . 1 . 2]" 1
1136 4 11 PHE QE 4 101 TYR QD 3.220 . 4.640 3.263 2.762 3.685 . 0 0 "[ . 1 . 2]" 1
1137 4 11 PHE QE 4 102 CYS H 3.250 . 4.700 4.856 4.095 5.324 0.624 11 4 "[ . 1+ -* * 2]" 1
1138 4 12 GLN H 4 13 ILE H 3.130 . 4.460 4.335 4.136 4.493 0.033 14 0 "[ . 1 . 2]" 1
1139 4 12 GLN H 4 85 SER H 2.710 . 3.620 2.779 2.456 3.239 . 0 0 "[ . 1 . 2]" 1
1140 4 13 ILE H 4 14 GLN H 3.330 . 4.860 4.386 4.195 4.610 . 0 0 "[ . 1 . 2]" 1
1141 4 14 GLN H 4 15 ARG H 2.060 . 2.320 2.409 2.126 2.633 0.313 13 0 "[ . 1 . 2]" 1
1142 4 14 GLN H 4 83 ILE H 3.110 . 4.410 4.670 4.246 5.031 0.621 12 1 "[ . 1 + . 2]" 1
1143 4 14 GLN H 4 84 PHE QD 3.450 . 5.100 4.184 3.481 5.110 0.010 17 0 "[ . 1 . 2]" 1
1144 4 14 GLN H 4 85 SER H 3.380 . 4.960 4.157 3.607 4.765 . 0 0 "[ . 1 . 2]" 1
1145 4 15 ARG H 4 16 ILE H 3.170 . 4.540 4.063 3.940 4.217 . 0 0 "[ . 1 . 2]" 1
1146 4 15 ARG H 4 83 ILE H 2.510 . 3.220 3.240 3.005 3.530 0.310 12 0 "[ . 1 . 2]" 1
1147 4 16 ILE H 4 17 TYR H 3.220 . 4.640 4.437 4.373 4.499 . 0 0 "[ . 1 . 2]" 1
1148 4 17 TYR H 4 18 THR H 3.160 . 4.520 4.331 4.205 4.374 . 0 0 "[ . 1 . 2]" 1
1149 4 17 TYR H 4 81 GLY H 3.010 . 4.220 4.010 3.853 4.184 . 0 0 "[ . 1 . 2]" 1
1150 4 17 TYR QD 4 18 THR H 3.070 . 4.340 3.412 3.004 4.265 . 0 0 "[ . 1 . 2]" 1
1151 4 18 THR H 4 19 LYS H 3.280 . 4.760 4.368 4.262 4.445 . 0 0 "[ . 1 . 2]" 1
1152 4 19 LYS H 4 20 ASP H 2.000 . 2.200 2.171 1.995 2.357 0.157 9 0 "[ . 1 . 2]" 1
1153 4 19 LYS H 4 79 GLN H 3.130 . 4.460 4.974 4.644 5.153 0.693 5 13 "[****+****- * *.* 2]" 1
1154 4 19 LYS H 4 81 GLY H 2.700 . 3.600 2.729 2.551 3.008 . 0 0 "[ . 1 . 2]" 1
1155 4 20 ASP H 4 21 ILE H 3.160 . 4.520 4.191 4.086 4.281 . 0 0 "[ . 1 . 2]" 1
1156 4 20 ASP H 4 79 GLN H 2.530 . 3.260 3.628 3.284 3.818 0.558 12 1 "[ . 1 + . 2]" 1
1157 4 21 ILE H 4 22 SER H 3.160 . 4.520 4.301 4.261 4.351 . 0 0 "[ . 1 . 2]" 1
1158 4 21 ILE H 4 79 GLN H 3.470 . 5.140 4.712 4.547 4.881 . 0 0 "[ . 1 . 2]" 1
1159 4 22 SER H 4 23 PHE H 3.140 . 4.480 4.216 4.165 4.261 . 0 0 "[ . 1 . 2]" 1
1160 4 22 SER H 4 77 GLU H 2.650 . 3.500 3.101 2.856 3.414 . 0 0 "[ . 1 . 2]" 1
1161 4 22 SER H 4 78 VAL MG2 2.980 . 4.160 3.160 2.782 3.368 . 0 0 "[ . 1 . 2]" 1
1162 4 22 SER H 4 117 MET ME 3.160 . 4.520 3.140 2.972 3.427 . 0 0 "[ . 1 . 2]" 1
1163 4 23 PHE H 4 24 GLU H 3.170 . 4.540 4.030 3.873 4.181 . 0 0 "[ . 1 . 2]" 1
1164 4 23 PHE QD 4 24 GLU H 2.560 . 3.320 3.674 3.416 3.919 0.599 13 4 "[* .-* 1 + . 2]" 1
1165 4 23 PHE QE 4 24 GLU H 3.150 . 4.500 4.685 4.318 5.053 0.553 13 1 "[ . 1 + . 2]" 1
1166 4 23 PHE QE 4 25 ALA MB 2.920 . 4.040 2.882 2.543 3.167 . 0 0 "[ . 1 . 2]" 1
1167 4 23 PHE QE 4 121 GLY H 3.520 . 5.240 4.151 3.872 4.431 . 0 0 "[ . 1 . 2]" 1
1168 4 24 GLU H 4 25 ALA H 3.170 . 4.540 4.277 4.056 4.408 . 0 0 "[ . 1 . 2]" 1
1169 4 24 GLU H 4 75 LEU H 2.810 . 3.820 3.052 2.599 3.444 . 0 0 "[ . 1 . 2]" 1
1170 4 24 GLU H 4 76 CYS H 3.440 . 5.080 4.633 4.475 4.835 . 0 0 "[ . 1 . 2]" 1
1171 4 25 ALA MB 4 28 ALA H 3.400 . 5.000 3.578 3.068 3.802 . 0 0 "[ . 1 . 2]" 1
1172 4 25 ALA MB 4 28 ALA MB 3.020 . 4.240 1.912 1.654 2.107 0.146 2 0 "[ . 1 . 2]" 1
1173 4 27 ASN H 4 28 ALA H 2.540 . 3.280 2.915 2.466 3.137 . 0 0 "[ . 1 . 2]" 1
1174 4 28 ALA H 4 30 HIS H 2.850 . 3.900 3.959 3.759 4.270 0.370 4 0 "[ . 1 . 2]" 1
1175 4 28 ALA H 4 31 VAL H 3.320 . 4.830 4.890 4.790 5.021 0.191 12 0 "[ . 1 . 2]" 1
1176 4 28 ALA MB 4 30 HIS H 3.470 . 5.140 4.200 4.145 4.319 . 0 0 "[ . 1 . 2]" 1
1177 4 30 HIS H 4 31 VAL H 2.200 . 2.600 2.411 2.302 2.610 0.010 1 0 "[ . 1 . 2]" 1
1178 4 30 HIS H 4 32 PHE H 2.830 . 3.860 3.602 3.420 3.958 0.098 14 0 "[ . 1 . 2]" 1
1179 4 31 VAL H 4 32 PHE H 2.290 . 2.780 2.413 2.304 2.596 . 0 0 "[ . 1 . 2]" 1
1180 4 31 VAL H 4 33 GLN H 3.240 . 4.680 4.134 3.951 4.324 . 0 0 "[ . 1 . 2]" 1
1181 4 31 VAL QG 4 32 PHE H 2.510 . 3.220 2.936 2.422 3.579 0.359 17 0 "[ . 1 . 2]" 1
1182 4 31 VAL QG 4 34 LYS H 3.440 . 5.080 3.904 3.699 4.121 . 0 0 "[ . 1 . 2]" 1
1183 4 31 VAL QG 4 123 PHE QE 2.720 . 3.640 2.362 1.876 3.068 . 0 0 "[ . 1 . 2]" 1
1184 4 32 PHE H 4 33 GLN H 2.360 . 2.920 2.714 2.601 2.875 . 0 0 "[ . 1 . 2]" 1
1185 4 32 PHE H 4 34 LYS H 3.140 . 4.480 4.201 3.960 4.398 . 0 0 "[ . 1 . 2]" 1
1186 4 32 PHE QD 4 33 GLN H 3.240 . 4.680 4.026 3.443 4.754 0.074 14 0 "[ . 1 . 2]" 1
1187 4 33 GLN H 4 34 LYS H 2.310 . 2.820 2.588 2.437 2.726 . 0 0 "[ . 1 . 2]" 1
1188 4 34 LYS H 4 35 ASP H 3.130 . 4.460 4.099 3.630 4.273 . 0 0 "[ . 1 . 2]" 1
1189 4 35 ASP H 4 36 TRP H 3.030 . 4.260 3.920 3.416 4.160 . 0 0 "[ . 1 . 2]" 1
1190 4 36 TRP H 4 37 GLN H 3.200 . 4.600 4.355 4.285 4.449 . 0 0 "[ . 1 . 2]" 1
1191 4 36 TRP HE1 4 68 LEU QD 2.950 . 4.100 3.995 2.974 5.689 1.589 12 1 "[ . 1 + . 2]" 1
1192 4 36 TRP HE3 4 68 LEU QD 3.500 . 5.200 4.658 1.785 5.300 0.100 4 0 "[ . 1 . 2]" 1
1193 4 37 GLN H 4 68 LEU QD 2.870 . 3.940 3.754 3.481 4.503 0.563 5 1 "[ + 1 . 2]" 1
1194 4 39 GLU H 4 40 VAL H 3.240 . 4.680 4.506 4.341 4.647 . 0 0 "[ . 1 . 2]" 1
1195 4 39 GLU H 4 67 SER H 2.910 . 4.020 3.459 2.943 4.169 0.149 5 0 "[ . 1 . 2]" 1
1196 4 39 GLU H 4 68 LEU QD 2.950 . 4.100 3.194 2.365 3.571 . 0 0 "[ . 1 . 2]" 1
1197 4 40 VAL H 4 41 LYS H 3.270 . 4.740 4.319 4.063 4.537 . 0 0 "[ . 1 . 2]" 1
1198 4 40 VAL H 4 66 ALA MB 3.360 . 4.920 4.876 4.530 5.312 0.392 3 0 "[ . 1 . 2]" 1
1199 4 40 VAL QG 4 41 LYS H . . 3.100 3.019 2.261 3.641 0.541 9 3 "[ . +1* - 2]" 1
1200 4 40 VAL QG 4 42 LEU QD 3.470 . 4.620 3.020 1.718 4.157 0.082 5 0 "[ . 1 . 2]" 1
1201 4 40 VAL QG 4 64 VAL MG1 . . 2.880 2.013 1.696 2.965 0.104 14 0 "[ . 1 . 2]" 1
1202 4 40 VAL QG 4 65 THR H 2.530 . 3.260 3.874 2.860 5.326 2.066 15 11 "[* **. -**** **+ 2]" 1
1203 4 40 VAL QG 4 66 ALA H 3.200 . 4.600 4.481 3.360 5.576 0.976 4 3 "[ *+. - 1 . 2]" 1
1204 4 40 VAL QG 4 66 ALA MB 2.980 . 4.160 2.524 1.745 3.703 0.055 9 0 "[ . 1 . 2]" 1
1205 4 40 VAL QG 4 74 PHE QE 3.240 . 4.680 3.840 3.052 4.846 0.166 13 0 "[ . 1 . 2]" 1
1206 4 40 VAL QG 4 126 LEU QD 3.140 . 3.380 1.894 1.602 2.733 0.198 5 0 "[ . 1 . 2]" 1
1207 4 41 LYS H 4 42 LEU H 3.270 . 4.740 4.348 4.075 4.574 . 0 0 "[ . 1 . 2]" 1
1208 4 41 LYS H 4 65 THR H 2.500 . 3.200 3.345 2.735 3.902 0.702 3 3 "[* + . 1 -. 2]" 1
1209 4 41 LYS H 4 66 ALA H 3.420 . 5.040 4.783 4.432 5.100 0.060 20 0 "[ . 1 . 2]" 1
1210 4 42 LEU H 4 43 ASP H 3.260 . 4.720 4.441 4.206 4.565 . 0 0 "[ . 1 . 2]" 1
1211 4 42 LEU QD 4 43 ASP H 3.140 . 4.480 3.103 1.992 4.065 . 0 0 "[ . 1 . 2]" 1
1212 4 42 LEU QD 4 128 LEU QD 2.650 . 3.040 2.087 1.503 3.789 0.749 9 1 "[ . +1 . 2]" 1
1213 4 43 ASP H 4 44 LEU H 3.090 . 4.380 4.322 4.085 4.466 0.086 1 0 "[ . 1 . 2]" 1
1214 4 43 ASP H 4 62 VAL MG1 3.520 . 5.240 4.196 3.236 5.026 . 0 0 "[ . 1 . 2]" 1
1215 4 43 ASP H 4 63 THR H 2.700 . 3.600 3.215 2.774 3.782 0.182 7 0 "[ . 1 . 2]" 1
1216 4 44 LEU H 4 45 ASP H 3.290 . 4.780 4.402 4.248 4.480 . 0 0 "[ . 1 . 2]" 1
1217 4 44 LEU QD 4 45 ASP H 3.490 . 5.180 3.621 2.131 4.301 . 0 0 "[ . 1 . 2]" 1
1218 4 45 ASP H 4 46 THR H 2.890 . 3.990 4.286 4.145 4.423 0.433 5 0 "[ . 1 . 2]" 1
1219 4 45 ASP H 4 60 LEU MD2 2.750 . 3.700 3.077 2.384 3.418 . 0 0 "[ . 1 . 2]" 1
1220 4 45 ASP H 4 61 ARG H 2.870 . 3.940 3.384 2.924 3.855 . 0 0 "[ . 1 . 2]" 1
1221 4 46 THR H 4 47 ALA H 3.270 . 4.740 4.447 4.340 4.540 . 0 0 "[ . 1 . 2]" 1
1222 4 46 THR H 4 61 ARG H 3.430 . 5.060 4.848 4.594 5.072 0.012 11 0 "[ . 1 . 2]" 1
1223 4 47 ALA H 4 48 SER H 3.190 . 4.580 4.359 4.259 4.388 . 0 0 "[ . 1 . 2]" 1
1224 4 47 ALA H 4 58 VAL QG 2.610 . 3.420 3.356 3.027 4.612 1.192 7 1 "[ . + 1 . 2]" 1
1225 4 47 ALA H 4 59 VAL H 2.760 . 3.720 3.158 2.699 3.548 . 0 0 "[ . 1 . 2]" 1
1226 4 47 ALA H 4 61 ARG H 3.470 . 5.140 4.896 4.499 5.215 0.075 5 0 "[ . 1 . 2]" 1
1227 4 47 ALA MB 4 48 SER H 2.370 . 2.940 2.397 2.231 2.821 . 0 0 "[ . 1 . 2]" 1
1228 4 47 ALA MB 4 59 VAL H 2.950 . 4.100 3.234 2.878 3.497 . 0 0 "[ . 1 . 2]" 1
1229 4 48 SER H 4 49 SER H 3.200 . 4.600 4.355 4.315 4.402 . 0 0 "[ . 1 . 2]" 1
1230 4 48 SER H 4 59 VAL H 3.210 . 4.620 4.455 4.178 4.776 0.156 19 0 "[ . 1 . 2]" 1
1231 4 49 SER H 4 50 GLN H 2.960 . 4.120 4.066 3.850 4.347 0.227 17 0 "[ . 1 . 2]" 1
1232 4 49 SER H 4 57 GLU H 2.620 . 3.440 3.361 2.979 3.695 0.255 10 0 "[ . 1 . 2]" 1
1233 4 49 SER H 4 58 VAL QG 3.450 . 5.100 4.277 3.565 4.866 . 0 0 "[ . 1 . 2]" 1
1234 4 50 GLN H 4 51 LEU H 3.300 . 4.800 4.452 4.357 4.547 . 0 0 "[ . 1 . 2]" 1
1235 4 50 GLN H 4 57 GLU H 3.420 . 5.040 4.900 4.702 5.100 0.060 7 0 "[ . 1 . 2]" 1
1236 4 51 LEU H 4 52 ALA H 1.980 . 2.160 2.189 2.060 2.274 0.114 11 0 "[ . 1 . 2]" 1
1237 4 51 LEU H 4 55 VAL H 3.230 . 4.660 4.849 4.620 5.192 0.532 16 1 "[ . 1 .+ 2]" 1
1238 4 51 LEU H 4 55 VAL MG1 3.310 . 4.820 3.418 3.080 3.644 . 0 0 "[ . 1 . 2]" 1
1239 4 51 LEU H 4 56 TYR H 3.460 . 5.120 4.721 4.582 4.923 . 0 0 "[ . 1 . 2]" 1
1240 4 51 LEU H 4 56 TYR QD 3.450 . 5.100 4.489 3.909 4.950 . 0 0 "[ . 1 . 2]" 1
1241 4 51 LEU H 4 57 GLU H 2.950 . 4.100 3.477 3.088 4.203 0.103 6 0 "[ . 1 . 2]" 1
1242 4 51 LEU MD1 4 55 VAL MG1 2.800 . 3.800 2.469 2.038 3.095 . 0 0 "[ . 1 . 2]" 1
1243 4 51 LEU MD1 4 57 GLU H 3.040 . 4.280 3.670 3.219 4.223 . 0 0 "[ . 1 . 2]" 1
1244 4 51 LEU MD2 4 57 GLU H 3.050 . 4.300 3.666 3.281 4.262 . 0 0 "[ . 1 . 2]" 1
1245 4 52 ALA H 4 53 ASP H 3.170 . 4.540 4.327 4.287 4.363 . 0 0 "[ . 1 . 2]" 1
1246 4 52 ALA H 4 55 VAL H 2.780 . 3.760 3.581 3.391 3.860 0.100 16 0 "[ . 1 . 2]" 1
1247 4 52 ALA H 4 55 VAL MG1 3.060 . 4.320 3.394 3.002 3.748 . 0 0 "[ . 1 . 2]" 1
1248 4 52 ALA H 4 55 VAL MG2 3.440 . 5.080 4.223 3.941 4.415 . 0 0 "[ . 1 . 2]" 1
1249 4 52 ALA MB 4 53 ASP H 2.310 . 2.820 1.924 1.817 2.033 . 0 0 "[ . 1 . 2]" 1
1250 4 52 ALA MB 4 55 VAL MG2 3.240 . 4.680 2.601 2.452 2.833 . 0 0 "[ . 1 . 2]" 1
1251 4 53 ASP H 4 54 ASP H 3.250 . 4.700 4.476 4.364 4.563 . 0 0 "[ . 1 . 2]" 1
1252 4 53 ASP H 4 55 VAL H 3.400 . 5.000 4.207 4.003 4.365 . 0 0 "[ . 1 . 2]" 1
1253 4 54 ASP H 4 55 VAL H 2.300 . 2.800 2.745 2.629 2.877 0.077 20 0 "[ . 1 . 2]" 1
1254 4 54 ASP H 4 56 TYR QE 3.110 . 4.410 3.536 2.429 4.173 . 0 0 "[ . 1 . 2]" 1
1255 4 55 VAL H 4 56 TYR H 2.900 . 4.000 4.252 4.130 4.366 0.366 7 0 "[ . 1 . 2]" 1
1256 4 55 VAL H 4 56 TYR QD 3.100 . 4.400 4.192 3.343 4.615 0.215 19 0 "[ . 1 . 2]" 1
1257 4 55 VAL H 4 56 TYR QE 2.990 . 4.180 4.112 3.411 4.552 0.372 19 0 "[ . 1 . 2]" 1
1258 4 55 VAL MG1 4 56 TYR H 3.040 . 4.280 2.812 2.723 2.917 . 0 0 "[ . 1 . 2]" 1
1259 4 56 TYR H 4 57 GLU H 3.200 . 4.600 4.216 4.136 4.383 . 0 0 "[ . 1 . 2]" 1
1260 4 56 TYR H 4 84 PHE H 2.980 . 4.160 3.416 3.094 3.663 . 0 0 "[ . 1 . 2]" 1
1261 4 56 TYR H 4 86 ILE H 3.140 . 4.480 3.531 3.198 3.920 . 0 0 "[ . 1 . 2]" 1
1262 4 56 TYR QD 4 57 GLU H 3.430 . 5.060 4.325 3.867 4.691 . 0 0 "[ . 1 . 2]" 1
1263 4 57 GLU H 4 58 VAL H 3.260 . 4.720 4.430 4.276 4.530 . 0 0 "[ . 1 . 2]" 1
1264 4 58 VAL H 4 59 VAL H 3.160 . 4.520 4.349 4.214 4.485 . 0 0 "[ . 1 . 2]" 1
1265 4 58 VAL H 4 82 GLY H 2.620 . 3.440 3.043 2.672 3.486 0.046 7 0 "[ . 1 . 2]" 1
1266 4 58 VAL H 4 84 PHE H 3.160 . 4.520 4.264 3.640 4.797 0.277 1 0 "[ . 1 . 2]" 1
1267 4 58 VAL H 4 84 PHE QD 3.530 . 5.250 3.064 2.480 3.733 . 0 0 "[ . 1 . 2]" 1
1268 4 58 VAL QG 4 59 VAL H 2.780 . 3.760 2.645 2.295 3.425 . 0 0 "[ . 1 . 2]" 1
1269 4 58 VAL QG 4 98 LEU QD 2.230 . 2.660 2.409 1.800 3.494 0.834 18 3 "[ . 1 - . + *]" 1
1270 4 59 VAL H 4 60 LEU H 3.230 . 4.660 4.420 4.317 4.513 . 0 0 "[ . 1 . 2]" 1
1271 4 59 VAL MG1 4 60 LEU H 2.680 . 3.570 2.569 2.297 2.859 . 0 0 "[ . 1 . 2]" 1
1272 4 59 VAL MG1 4 80 GLN H 3.390 . 4.980 3.604 3.279 3.983 . 0 0 "[ . 1 . 2]" 1
1273 4 59 VAL MG1 4 81 GLY H 3.380 . 4.960 3.781 3.394 4.373 . 0 0 "[ . 1 . 2]" 1
1274 4 59 VAL MG2 4 60 LEU H 3.500 . 5.200 4.072 3.943 4.185 . 0 0 "[ . 1 . 2]" 1
1275 4 60 LEU H 4 61 ARG H 3.270 . 4.740 4.232 3.999 4.348 . 0 0 "[ . 1 . 2]" 1
1276 4 60 LEU H 4 80 GLN H 2.950 . 4.100 3.464 3.195 3.790 . 0 0 "[ . 1 . 2]" 1
1277 4 60 LEU H 4 81 GLY H 3.250 . 4.700 4.649 4.523 4.775 0.075 19 0 "[ . 1 . 2]" 1
1278 4 60 LEU H 4 82 GLY H 3.350 . 4.900 5.064 4.718 5.550 0.650 20 3 "[ *- . 1 . +]" 1
1279 4 60 LEU MD1 4 62 VAL MG2 2.820 . 3.840 2.129 1.848 2.404 . 0 0 "[ . 1 . 2]" 1
1280 4 60 LEU MD1 4 110 ALA MB 3.190 . 4.580 2.399 2.087 2.646 . 0 0 "[ . 1 . 2]" 1
1281 4 60 LEU MD2 4 61 ARG H 2.250 . 2.700 2.268 2.109 2.729 0.029 9 0 "[ . 1 . 2]" 1
1282 4 60 LEU MD2 4 62 VAL H 3.320 . 4.830 3.572 3.150 4.515 . 0 0 "[ . 1 . 2]" 1
1283 4 60 LEU MD2 4 62 VAL MG2 2.740 . 3.680 2.260 1.955 3.059 . 0 0 "[ . 1 . 2]" 1
1284 4 61 ARG H 4 62 VAL H 3.030 . 4.260 4.129 3.981 4.451 0.191 11 0 "[ . 1 . 2]" 1
1285 4 61 ARG H 4 62 VAL MG2 3.430 . 5.060 4.322 4.128 4.576 . 0 0 "[ . 1 . 2]" 1
1286 4 62 VAL H 4 63 THR H 3.120 . 4.440 4.345 4.105 4.477 0.037 13 0 "[ . 1 . 2]" 1
1287 4 62 VAL H 4 78 VAL H 2.950 . 4.100 3.261 3.003 3.466 . 0 0 "[ . 1 . 2]" 1
1288 4 62 VAL H 4 80 GLN H 3.130 . 4.460 4.052 3.774 4.348 . 0 0 "[ . 1 . 2]" 1
1289 4 62 VAL MG1 4 63 THR H 2.950 . 4.100 2.822 2.496 3.356 . 0 0 "[ . 1 . 2]" 1
1290 4 62 VAL MG1 4 64 VAL MG2 3.080 . 4.360 2.659 2.313 3.018 . 0 0 "[ . 1 . 2]" 1
1291 4 62 VAL MG1 4 128 LEU QD 3.450 . 5.100 2.458 1.914 3.566 . 0 0 "[ . 1 . 2]" 1
1292 4 62 VAL MG2 4 80 GLN H 3.490 . 5.180 4.605 4.219 4.894 . 0 0 "[ . 1 . 2]" 1
1293 4 62 VAL MG2 4 110 ALA MB 2.920 . 4.040 2.016 1.630 2.175 0.170 3 0 "[ . 1 . 2]" 1
1294 4 63 THR H 4 64 VAL H 3.270 . 4.740 4.366 4.273 4.493 . 0 0 "[ . 1 . 2]" 1
1295 4 64 VAL H 4 65 THR H 3.000 . 4.200 4.105 3.878 4.305 0.105 19 0 "[ . 1 . 2]" 1
1296 4 64 VAL H 4 76 CYS H 2.800 . 3.800 3.368 3.240 3.573 . 0 0 "[ . 1 . 2]" 1
1297 4 64 VAL MG1 4 65 THR H 3.000 . 4.200 3.092 2.646 3.458 . 0 0 "[ . 1 . 2]" 1
1298 4 64 VAL MG1 4 74 PHE QE 2.890 . 3.980 2.554 2.110 3.472 . 0 0 "[ . 1 . 2]" 1
1299 4 64 VAL MG1 4 126 LEU QD 2.720 . 3.640 2.031 1.647 2.507 0.153 1 0 "[ . 1 . 2]" 1
1300 4 64 VAL MG2 4 128 LEU QD 3.320 . 4.830 2.580 2.081 3.718 . 0 0 "[ . 1 . 2]" 1
1301 4 65 THR H 4 66 ALA H 3.140 . 4.480 4.085 3.712 4.387 . 0 0 "[ . 1 . 2]" 1
1302 4 66 ALA H 4 67 SER H 3.240 . 4.680 4.448 4.313 4.547 . 0 0 "[ . 1 . 2]" 1
1303 4 66 ALA H 4 74 PHE H 2.710 . 3.620 3.619 3.375 3.838 0.218 12 0 "[ . 1 . 2]" 1
1304 4 66 ALA H 4 74 PHE QD 3.310 . 4.820 4.581 4.318 4.988 0.168 4 0 "[ . 1 . 2]" 1
1305 4 66 ALA H 4 74 PHE QE 3.390 . 4.980 5.080 4.791 5.488 0.508 4 1 "[ +. 1 . 2]" 1
1306 4 66 ALA H 4 75 LEU MD2 2.540 . 3.280 2.707 2.360 3.041 . 0 0 "[ . 1 . 2]" 1
1307 4 66 ALA MB 4 67 SER H 2.690 . 3.580 2.935 2.518 3.166 . 0 0 "[ . 1 . 2]" 1
1308 4 66 ALA MB 4 73 ALA MB 2.870 . 3.940 2.409 2.110 2.816 . 0 0 "[ . 1 . 2]" 1
1309 4 66 ALA MB 4 74 PHE H 2.970 . 4.140 2.317 1.810 2.705 . 0 0 "[ . 1 . 2]" 1
1310 4 66 ALA MB 4 74 PHE QD 3.040 . 4.280 3.057 2.971 3.149 . 0 0 "[ . 1 . 2]" 1
1311 4 66 ALA MB 4 74 PHE QE 2.670 . 3.540 2.952 2.890 3.060 . 0 0 "[ . 1 . 2]" 1
1312 4 67 SER H 4 68 LEU H 3.020 . 4.240 4.201 4.003 4.385 0.145 4 0 "[ . 1 . 2]" 1
1313 4 67 SER H 4 73 ALA H 3.300 . 4.800 4.122 3.720 4.294 . 0 0 "[ . 1 . 2]" 1
1314 4 67 SER H 4 73 ALA MB 2.910 . 4.020 3.419 2.969 3.722 . 0 0 "[ . 1 . 2]" 1
1315 4 67 SER H 4 74 PHE H 3.510 . 5.220 4.777 4.467 4.953 . 0 0 "[ . 1 . 2]" 1
1316 4 68 LEU H 4 69 GLY H 3.180 . 4.560 4.239 3.977 4.409 . 0 0 "[ . 1 . 2]" 1
1317 4 68 LEU H 4 71 GLU H 3.240 . 4.680 4.002 3.604 4.711 0.031 5 0 "[ . 1 . 2]" 1
1318 4 68 LEU H 4 73 ALA H 2.590 . 3.380 3.302 2.972 3.611 0.231 9 0 "[ . 1 . 2]" 1
1319 4 68 LEU H 4 73 ALA MB 2.610 . 3.420 2.362 2.005 2.871 . 0 0 "[ . 1 . 2]" 1
1320 4 68 LEU QD 4 69 GLY H 2.330 . 2.860 2.529 2.016 3.050 0.190 19 0 "[ . 1 . 2]" 1
1321 4 69 GLY H 4 70 GLU H 3.310 . 4.820 4.467 4.312 4.609 . 0 0 "[ . 1 . 2]" 1
1322 4 69 GLY H 4 71 GLU H 3.440 . 5.080 4.579 4.190 4.852 . 0 0 "[ . 1 . 2]" 1
1323 4 70 GLU H 4 71 GLU H 2.400 . 3.000 2.431 2.019 2.866 . 0 0 "[ . 1 . 2]" 1
1324 4 71 GLU H 4 72 THR H 3.200 . 4.600 4.441 4.344 4.521 . 0 0 "[ . 1 . 2]" 1
1325 4 72 THR H 4 73 ALA H 3.240 . 4.680 4.524 4.389 4.649 . 0 0 "[ . 1 . 2]" 1
1326 4 73 ALA H 4 74 PHE H 2.430 . 3.060 2.589 2.361 2.841 . 0 0 "[ . 1 . 2]" 1
1327 4 73 ALA H 4 75 LEU MD2 3.490 . 5.180 4.513 3.954 5.093 . 0 0 "[ . 1 . 2]" 1
1328 4 73 ALA MB 4 74 PHE H 2.370 . 2.940 2.067 1.891 2.233 . 0 0 "[ . 1 . 2]" 1
1329 4 73 ALA MB 4 74 PHE QD 3.430 . 5.060 2.759 2.601 2.945 . 0 0 "[ . 1 . 2]" 1
1330 4 74 PHE H 4 75 LEU H 3.100 . 4.400 4.276 4.162 4.358 . 0 0 "[ . 1 . 2]" 1
1331 4 74 PHE H 4 75 LEU MD2 2.800 . 3.800 4.082 3.812 4.394 0.594 10 1 "[ . + . 2]" 1
1332 4 74 PHE QD 4 75 LEU H 3.120 . 4.440 3.611 2.942 4.214 . 0 0 "[ . 1 . 2]" 1
1333 4 74 PHE QD 4 123 PHE QD 3.450 . 5.100 3.518 3.170 3.869 . 0 0 "[ . 1 . 2]" 1
1334 4 74 PHE QD 4 123 PHE QE 3.490 . 5.180 4.103 3.647 4.704 . 0 0 "[ . 1 . 2]" 1
1335 4 74 PHE QE 4 126 LEU QD 3.050 . 4.300 2.786 1.899 3.858 . 0 0 "[ . 1 . 2]" 1
1336 4 75 LEU H 4 76 CYS H 3.220 . 4.640 4.456 4.352 4.545 . 0 0 "[ . 1 . 2]" 1
1337 4 76 CYS H 4 77 GLU H 3.160 . 4.520 4.250 4.195 4.291 . 0 0 "[ . 1 . 2]" 1
1338 4 77 GLU H 4 78 VAL H 3.110 . 4.410 4.120 4.027 4.202 . 0 0 "[ . 1 . 2]" 1
1339 4 77 GLU H 4 78 VAL MG2 3.240 . 4.680 3.382 3.087 3.519 . 0 0 "[ . 1 . 2]" 1
1340 4 78 VAL H 4 79 GLN H 3.210 . 4.620 4.112 4.002 4.351 . 0 0 "[ . 1 . 2]" 1
1341 4 78 VAL MG1 4 79 GLN H 2.420 . 3.040 3.038 2.418 3.167 0.127 1 0 "[ . 1 . 2]" 1
1342 4 78 VAL MG1 4 80 GLN H 2.930 . 4.060 2.850 2.746 2.978 . 0 0 "[ . 1 . 2]" 1
1343 4 78 VAL MG2 4 79 GLN H 3.350 . 4.900 4.227 4.038 4.301 . 0 0 "[ . 1 . 2]" 1
1344 4 78 VAL MG2 4 114 ILE H 3.400 . 5.000 2.969 2.663 3.254 . 0 0 "[ . 1 . 2]" 1
1345 4 78 VAL MG2 4 117 MET ME 2.230 . 2.660 2.109 1.959 2.233 . 0 0 "[ . 1 . 2]" 1
1346 4 79 GLN H 4 80 GLN H 2.850 . 3.900 3.925 3.692 4.047 0.147 5 0 "[ . 1 . 2]" 1
1347 4 80 GLN H 4 81 GLY H 3.230 . 4.660 4.272 4.179 4.394 . 0 0 "[ . 1 . 2]" 1
1348 4 80 GLN H 4 110 ALA MB 2.980 . 4.160 3.767 3.378 4.131 . 0 0 "[ . 1 . 2]" 1
1349 4 81 GLY H 4 82 GLY H 3.250 . 4.700 4.556 4.502 4.599 . 0 0 "[ . 1 . 2]" 1
1350 4 82 GLY H 4 83 ILE H 3.230 . 4.660 4.214 4.106 4.300 . 0 0 "[ . 1 . 2]" 1
1351 4 82 GLY H 4 84 PHE QE 3.370 . 4.940 3.891 3.636 4.190 . 0 0 "[ . 1 . 2]" 1
1352 4 83 ILE H 4 84 PHE H 3.270 . 4.740 4.432 4.282 4.517 . 0 0 "[ . 1 . 2]" 1
1353 4 84 PHE H 4 85 SER H 3.180 . 4.560 4.370 4.260 4.471 . 0 0 "[ . 1 . 2]" 1
1354 4 84 PHE QD 4 85 SER H 3.360 . 4.920 4.213 3.944 4.438 . 0 0 "[ . 1 . 2]" 1
1355 4 85 SER H 4 86 ILE H 3.210 . 4.620 4.257 4.115 4.461 . 0 0 "[ . 1 . 2]" 1
1356 4 86 ILE H 4 87 ALA H 3.220 . 4.640 4.202 4.016 4.516 . 0 0 "[ . 1 . 2]" 1
1357 4 87 ALA H 4 88 GLY H 3.050 . 4.300 4.389 4.199 4.466 0.166 5 0 "[ . 1 . 2]" 1
1358 4 87 ALA H 4 89 ILE H 2.790 . 3.780 4.198 3.863 4.532 0.752 18 7 "[ - .** * *. + *]" 1
1359 4 87 ALA MB 4 88 GLY H 2.900 . 4.000 2.640 2.350 3.261 . 0 0 "[ . 1 . 2]" 1
1360 4 88 GLY H 4 89 ILE H 2.250 . 2.700 2.747 2.435 2.934 0.234 3 0 "[ . 1 . 2]" 1
1361 4 89 ILE H 4 90 GLU H 3.270 . 4.740 4.362 4.230 4.514 . 0 0 "[ . 1 . 2]" 1
1362 4 90 GLU H 4 91 GLY H 3.190 . 4.580 4.393 4.353 4.457 . 0 0 "[ . 1 . 2]" 1
1363 4 90 GLU H 4 94 MET H 3.010 . 4.220 4.102 3.463 4.571 0.351 14 0 "[ . 1 . 2]" 1
1364 4 91 GLY H 4 92 THR H 3.290 . 4.780 4.562 4.238 4.632 . 0 0 "[ . 1 . 2]" 1
1365 4 91 GLY H 4 94 MET H 3.350 . 4.900 4.354 3.761 4.764 . 0 0 "[ . 1 . 2]" 1
1366 4 91 GLY H 4 94 MET ME 3.250 . 4.700 3.860 1.817 5.997 1.297 3 4 "[- + . 1** . 2]" 1
1367 4 92 THR H 4 93 GLN H 2.100 . 2.400 2.518 2.246 2.729 0.329 18 0 "[ . 1 . 2]" 1
1368 4 92 THR H 4 94 MET H 3.040 . 4.280 4.342 3.857 4.611 0.331 20 0 "[ . 1 . 2]" 1
1369 4 92 THR H 4 95 ALA H 3.430 . 5.060 4.847 4.530 5.365 0.305 16 0 "[ . 1 . 2]" 1
1370 4 93 GLN H 4 94 MET H 2.370 . 2.940 2.641 2.523 2.728 . 0 0 "[ . 1 . 2]" 1
1371 4 93 GLN H 4 95 ALA H 3.080 . 4.360 3.910 3.640 4.242 . 0 0 "[ . 1 . 2]" 1
1372 4 93 GLN H 4 96 HIS H 3.450 . 5.100 4.699 4.407 5.356 0.256 3 0 "[ . 1 . 2]" 1
1373 4 94 MET H 4 95 ALA H 2.210 . 2.620 2.544 2.441 2.699 0.079 13 0 "[ . 1 . 2]" 1
1374 4 94 MET H 4 96 HIS H 3.020 . 4.240 4.092 3.850 4.437 0.197 14 0 "[ . 1 . 2]" 1
1375 4 95 ALA H 4 96 HIS H 2.260 . 2.730 2.613 2.510 2.718 . 0 0 "[ . 1 . 2]" 1
1376 4 95 ALA H 4 97 CYS H 3.220 . 4.640 3.970 3.804 4.265 . 0 0 "[ . 1 . 2]" 1
1377 4 95 ALA H 4 98 LEU H 3.420 . 5.040 4.793 4.580 5.027 . 0 0 "[ . 1 . 2]" 1
1378 4 95 ALA MB 4 96 HIS H 2.690 . 3.580 2.617 2.362 2.804 . 0 0 "[ . 1 . 2]" 1
1379 4 96 HIS H 4 97 CYS H 2.340 . 2.880 2.586 2.475 2.694 . 0 0 "[ . 1 . 2]" 1
1380 4 96 HIS H 4 98 LEU H 2.960 . 4.120 4.269 4.056 4.469 0.349 13 0 "[ . 1 . 2]" 1
1381 4 96 HIS H 4 99 GLY H 3.460 . 5.120 4.661 4.397 4.867 . 0 0 "[ . 1 . 2]" 1
1382 4 97 CYS H 4 98 LEU H 2.300 . 2.800 2.683 2.596 2.804 0.004 20 0 "[ . 1 . 2]" 1
1383 4 97 CYS H 4 99 GLY H 3.090 . 4.380 3.881 3.717 4.253 . 0 0 "[ . 1 . 2]" 1
1384 4 97 CYS H 4 100 ALA H 3.460 . 5.120 4.893 4.606 5.113 . 0 0 "[ . 1 . 2]" 1
1385 4 98 LEU H 4 99 GLY H 2.260 . 2.730 2.528 2.410 2.637 . 0 0 "[ . 1 . 2]" 1
1386 4 98 LEU H 4 100 ALA H 2.960 . 4.120 4.167 4.033 4.325 0.205 13 0 "[ . 1 . 2]" 1
1387 4 98 LEU H 4 102 CYS H 3.480 . 5.160 4.956 4.687 5.107 . 0 0 "[ . 1 . 2]" 1
1388 4 99 GLY H 4 100 ALA H 2.150 . 2.500 2.415 2.217 2.629 0.129 14 0 "[ . 1 . 2]" 1
1389 4 99 GLY H 4 100 ALA MB 3.330 . 4.860 4.115 3.963 4.281 . 0 0 "[ . 1 . 2]" 1
1390 4 99 GLY H 4 101 TYR H 3.350 . 4.900 4.191 3.899 4.432 . 0 0 "[ . 1 . 2]" 1
1391 4 99 GLY H 4 102 CYS H 3.390 . 4.980 4.857 4.413 5.230 0.250 19 0 "[ . 1 . 2]" 1
1392 4 100 ALA H 4 101 TYR H 2.280 . 2.760 2.286 2.063 2.647 . 0 0 "[ . 1 . 2]" 1
1393 4 100 ALA H 4 102 CYS H 2.500 . 3.200 3.521 3.145 3.963 0.763 2 4 "[ + . * 1 . -*]" 1
1394 4 100 ALA MB 4 101 TYR H 2.310 . 2.820 2.323 2.130 2.525 . 0 0 "[ . 1 . 2]" 1
1395 4 100 ALA MB 4 102 CYS H 3.520 . 5.240 4.620 4.400 4.906 . 0 0 "[ . 1 . 2]" 1
1396 4 101 TYR H 4 102 CYS H 2.270 . 2.740 2.735 2.619 2.901 0.161 8 0 "[ . 1 . 2]" 1
1397 4 101 TYR QD 4 102 CYS H 3.110 . 4.410 3.613 3.180 4.023 . 0 0 "[ . 1 . 2]" 1
1398 4 102 CYS H 4 105 ILE H 3.510 . 5.220 4.834 4.687 5.012 . 0 0 "[ . 1 . 2]" 1
1399 4 109 TYR H 4 110 ALA H 2.110 . 2.420 2.484 2.399 2.561 0.141 5 0 "[ . 1 . 2]" 1
1400 4 109 TYR H 4 110 ALA MB 3.530 . 5.250 4.176 4.081 4.238 . 0 0 "[ . 1 . 2]" 1
1401 4 109 TYR H 4 111 ARG H 3.160 . 4.520 4.151 3.971 4.314 . 0 0 "[ . 1 . 2]" 1
1402 4 109 TYR H 4 112 GLU H 3.300 . 4.800 4.619 4.433 4.757 . 0 0 "[ . 1 . 2]" 1
1403 4 109 TYR QD 4 110 ALA H 3.390 . 4.980 4.291 4.061 4.556 . 0 0 "[ . 1 . 2]" 1
1404 4 110 ALA H 4 111 ARG H 2.290 . 2.780 2.629 2.501 2.737 . 0 0 "[ . 1 . 2]" 1
1405 4 110 ALA H 4 112 GLU H 2.820 . 3.840 3.978 3.805 4.137 0.297 1 0 "[ . 1 . 2]" 1
1406 4 110 ALA H 4 113 CYS H 3.440 . 5.080 4.827 4.723 4.947 . 0 0 "[ . 1 . 2]" 1
1407 4 110 ALA MB 4 111 ARG H 2.440 . 3.080 2.350 2.211 2.490 . 0 0 "[ . 1 . 2]" 1
1408 4 111 ARG H 4 112 GLU H 2.360 . 2.920 2.703 2.466 2.859 . 0 0 "[ . 1 . 2]" 1
1409 4 111 ARG H 4 113 CYS H 3.170 . 4.540 4.363 4.177 4.573 0.033 3 0 "[ . 1 . 2]" 1
1410 4 111 ARG H 4 114 ILE H 3.510 . 5.220 4.987 4.808 5.143 . 0 0 "[ . 1 . 2]" 1
1411 4 112 GLU H 4 113 CYS H 2.300 . 2.800 2.753 2.667 2.853 0.053 3 0 "[ . 1 . 2]" 1
1412 4 112 GLU H 4 114 ILE H 3.160 . 4.520 4.235 4.071 4.333 . 0 0 "[ . 1 . 2]" 1
1413 4 113 CYS H 4 114 ILE H 2.250 . 2.700 2.751 2.713 2.781 0.081 17 0 "[ . 1 . 2]" 1
1414 4 113 CYS H 4 115 THR H 3.020 . 4.240 4.229 4.050 4.450 0.210 2 0 "[ . 1 . 2]" 1
1415 4 114 ILE H 4 115 THR H 2.370 . 2.940 2.750 2.633 2.852 . 0 0 "[ . 1 . 2]" 1
1416 4 114 ILE H 4 116 SER H 3.390 . 4.980 4.258 4.141 4.376 . 0 0 "[ . 1 . 2]" 1
1417 4 114 ILE H 4 117 MET ME 3.470 . 5.140 3.594 3.520 3.634 . 0 0 "[ . 1 . 2]" 1
1418 4 115 THR H 4 116 SER H 2.420 . 3.040 2.735 2.654 2.822 . 0 0 "[ . 1 . 2]" 1
1419 4 115 THR H 4 117 MET H 3.180 . 4.560 4.291 4.212 4.435 . 0 0 "[ . 1 . 2]" 1
1420 4 115 THR H 4 118 VAL H 3.400 . 5.000 4.813 4.703 4.947 . 0 0 "[ . 1 . 2]" 1
1421 4 116 SER H 4 117 MET H 2.450 . 3.100 2.663 2.604 2.709 . 0 0 "[ . 1 . 2]" 1
1422 4 116 SER H 4 118 VAL H 3.110 . 4.420 4.015 3.888 4.128 . 0 0 "[ . 1 . 2]" 1
1423 4 116 SER H 4 119 SER H 3.390 . 4.980 4.744 4.632 4.832 . 0 0 "[ . 1 . 2]" 1
1424 4 117 MET H 4 118 VAL H 2.350 . 2.900 2.588 2.530 2.654 . 0 0 "[ . 1 . 2]" 1
1425 4 117 MET H 4 119 SER H 3.080 . 4.360 4.165 4.088 4.270 . 0 0 "[ . 1 . 2]" 1
1426 4 118 VAL H 4 119 SER H 2.250 . 2.700 2.633 2.540 2.706 0.006 4 0 "[ . 1 . 2]" 1
1427 4 118 VAL MG1 4 119 SER H 3.180 . 4.560 3.374 3.290 3.532 . 0 0 "[ . 1 . 2]" 1
1428 4 118 VAL MG1 4 123 PHE H 3.080 . 4.360 3.274 3.063 3.517 . 0 0 "[ . 1 . 2]" 1
1429 4 118 VAL MG1 4 123 PHE QD 3.130 . 4.460 3.430 3.111 3.814 . 0 0 "[ . 1 . 2]" 1
1430 4 118 VAL MG1 4 126 LEU H 3.460 . 5.120 3.073 2.663 3.397 . 0 0 "[ . 1 . 2]" 1
1431 4 118 VAL MG2 4 119 SER H 3.350 . 4.900 3.981 3.892 4.094 . 0 0 "[ . 1 . 2]" 1
1432 4 119 SER H 4 121 GLY H 3.020 . 4.240 3.905 3.728 4.078 . 0 0 "[ . 1 . 2]" 1
1433 4 119 SER H 4 123 PHE H 3.510 . 5.220 5.021 4.884 5.163 . 0 0 "[ . 1 . 2]" 1
1434 4 121 GLY H 4 122 THR H 2.300 . 2.800 2.533 2.440 2.648 . 0 0 "[ . 1 . 2]" 1
1435 4 121 GLY H 4 123 PHE H 2.740 . 3.680 3.930 3.638 4.113 0.433 11 0 "[ . 1 . 2]" 1
1436 4 122 THR H 4 123 PHE H 2.290 . 2.780 2.725 2.629 2.794 0.014 7 0 "[ . 1 . 2]" 1
1437 4 125 GLN H 4 126 LEU H 3.330 . 4.860 4.612 4.546 4.696 . 0 0 "[ . 1 . 2]" 1
1438 4 126 LEU H 4 127 ASN H 2.950 . 4.100 4.052 3.745 4.342 0.242 5 0 "[ . 1 . 2]" 1
1439 4 126 LEU QD 4 127 ASN H 2.800 . 3.800 2.959 2.069 3.365 . 0 0 "[ . 1 . 2]" 1
1440 4 126 LEU QD 4 128 LEU QD 3.420 . 5.040 2.394 1.908 3.672 . 0 0 "[ . 1 . 2]" 1
1441 4 127 ASN H 4 128 LEU H 3.180 . 4.560 4.117 3.813 4.405 . 0 0 "[ . 1 . 2]" 1
1442 4 128 LEU H 4 129 ALA H 3.330 . 4.860 4.524 4.423 4.640 . 0 0 "[ . 1 . 2]" 1
1443 4 128 LEU QD 4 129 ALA H 2.520 . 3.240 2.990 1.959 4.479 1.239 9 3 "[ . +1 *. -]" 1
1444 4 131 VAL H 4 133 PHE H 3.410 . 5.020 5.445 4.885 6.041 1.021 2 9 "[*+ -. 1****.** 2]" 1
1445 4 131 VAL QG 4 133 PHE H 3.200 . 4.600 3.449 2.559 4.239 . 0 0 "[ . 1 . 2]" 1
1446 4 133 PHE H 4 134 ASP H 2.120 . 2.440 2.562 2.350 2.931 0.491 16 0 "[ . 1 . 2]" 1
1447 4 133 PHE H 4 135 ALA H 3.040 . 4.280 4.485 4.085 4.804 0.524 12 1 "[ . 1 + . 2]" 1
1448 4 133 PHE QD 4 134 ASP H 3.370 . 4.940 3.998 3.158 4.591 . 0 0 "[ . 1 . 2]" 1
1449 4 133 PHE QE 4 136 LEU QD 3.440 . 5.080 5.205 2.422 7.612 2.532 14 12 "[****.- **1 +*** *2]" 1
1450 4 134 ASP H 4 135 ALA H 2.360 . 2.920 2.793 2.598 2.998 0.078 19 0 "[ . 1 . 2]" 1
1451 4 134 ASP H 4 136 LEU H 3.380 . 4.960 4.251 3.910 4.595 . 0 0 "[ . 1 . 2]" 1
1452 4 135 ALA H 4 136 LEU H 2.450 . 3.100 2.727 2.607 2.955 . 0 0 "[ . 1 . 2]" 1
1453 4 135 ALA H 4 137 PHE H 3.060 . 4.320 4.185 3.896 4.711 0.391 10 0 "[ . 1 . 2]" 1
1454 4 135 ALA H 4 138 MET H 3.520 . 5.240 4.870 4.669 5.158 . 0 0 "[ . 1 . 2]" 1
1455 4 135 ALA MB 4 136 LEU H 2.500 . 3.200 2.652 2.237 2.977 . 0 0 "[ . 1 . 2]" 1
1456 4 136 LEU H 4 137 PHE H 2.360 . 2.920 2.547 2.326 2.777 . 0 0 "[ . 1 . 2]" 1
1457 4 136 LEU H 4 138 MET H 3.140 . 4.480 4.046 3.774 4.582 0.102 13 0 "[ . 1 . 2]" 1
1458 4 136 LEU QD 4 137 PHE H 3.030 . 4.260 3.777 3.367 4.201 . 0 0 "[ . 1 . 2]" 1
1459 4 137 PHE H 4 138 MET H 2.310 . 2.820 2.623 2.420 2.822 0.002 13 0 "[ . 1 . 2]" 1
1460 4 137 PHE H 4 139 ASN H 3.160 . 4.520 4.232 3.783 4.712 0.192 5 0 "[ . 1 . 2]" 1
1461 4 137 PHE H 4 140 TYR H 3.480 . 5.160 4.956 4.593 5.494 0.334 4 0 "[ . 1 . 2]" 1
1462 4 137 PHE QD 4 138 MET H 3.420 . 5.040 4.040 2.841 4.672 . 0 0 "[ . 1 . 2]" 1
1463 4 137 PHE QD 4 141 LEU MD1 3.020 . 4.240 3.250 2.505 4.851 0.611 20 1 "[ . 1 . +]" 1
1464 4 138 MET H 4 139 ASN H 2.360 . 2.920 2.694 2.502 2.866 . 0 0 "[ . 1 . 2]" 1
1465 4 138 MET H 4 140 TYR H 3.180 . 4.560 4.138 3.900 4.420 . 0 0 "[ . 1 . 2]" 1
1466 4 138 MET H 4 141 LEU H 3.510 . 5.220 5.115 4.864 5.492 0.272 18 0 "[ . 1 . 2]" 1
1467 4 139 ASN H 4 140 TYR H 2.210 . 2.620 2.616 2.482 2.869 0.249 4 0 "[ . 1 . 2]" 1
1468 4 139 ASN H 4 141 LEU H 3.050 . 4.300 4.261 3.910 4.493 0.193 17 0 "[ . 1 . 2]" 1
1469 4 140 TYR H 4 141 LEU H 2.400 . 3.000 2.730 2.616 2.905 . 0 0 "[ . 1 . 2]" 1
1470 4 140 TYR QD 4 141 LEU H 2.940 . 4.080 3.682 3.450 4.073 . 0 0 "[ . 1 . 2]" 1
1471 4 140 TYR QD 4 141 LEU MD1 3.420 . 5.040 2.185 1.888 2.400 . 0 0 "[ . 1 . 2]" 1
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