NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
607071 |
5jtp   |
30084 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5jtp
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 1537
_Distance_constraint_stats_list.Viol_count 4697
_Distance_constraint_stats_list.Viol_total 27915.264
_Distance_constraint_stats_list.Viol_max 4.313
_Distance_constraint_stats_list.Viol_rms 0.1879
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0454
_Distance_constraint_stats_list.Viol_average_violations_only 0.2972
_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 0.295 0.204 20 0 "[ . 1 . 2]"
1 11 PHE 14.056 1.031 7 17 "[*-* .*+ ************]"
1 12 GLN 3.978 0.582 1 2 "[+ . 1 - 2]"
1 13 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 GLN 3.874 0.545 14 2 "[ . 1- +. 2]"
1 15 ARG 3.046 0.467 7 0 "[ . 1 . 2]"
1 16 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 TYR 0.335 0.163 14 0 "[ . 1 . 2]"
1 18 THR 0.355 0.101 8 0 "[ . 1 . 2]"
1 19 LYS 1.288 0.276 8 0 "[ . 1 . 2]"
1 20 ASP 0.239 0.142 8 0 "[ . 1 . 2]"
1 21 ILE 0.824 0.120 7 0 "[ . 1 . 2]"
1 22 SER 1.145 0.134 3 0 "[ . 1 . 2]"
1 23 PHE 5.031 1.297 8 2 "[ . + 1 . - 2]"
1 24 GLU 0.362 0.092 18 0 "[ . 1 . 2]"
1 25 ALA 0.559 0.262 1 0 "[ . 1 . 2]"
1 27 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 ALA 2.211 0.272 10 0 "[ . 1 . 2]"
1 30 HIS 1.362 0.272 10 0 "[ . 1 . 2]"
1 31 VAL 3.368 0.804 15 1 "[ . 1 + 2]"
1 32 PHE 2.027 0.452 1 0 "[ . 1 . 2]"
1 33 GLN 0.547 0.130 6 0 "[ . 1 . 2]"
1 34 LYS 0.663 0.130 6 0 "[ . 1 . 2]"
1 35 ASP 1.292 0.707 1 2 "[+ . -1 . 2]"
1 36 TRP 22.838 2.431 1 8 "[+ ***-*1 ** 2]"
1 37 GLN 6.915 0.546 6 2 "[ .+ - 1 . 2]"
1 39 GLU 20.097 1.304 2 11 "[*+ **** * **-* 2]"
1 40 VAL 1.936 0.286 14 0 "[ . 1 . 2]"
1 41 LYS 3.615 0.515 7 1 "[ . + 1 . 2]"
1 42 LEU 5.892 0.982 3 5 "[ *+ . *1 * . - 2]"
1 43 ASP 1.094 0.408 19 0 "[ . 1 . 2]"
1 44 LEU 32.501 1.878 15 13 "[* * . ** *** *+*- **]"
1 45 ASP 14.849 1.281 15 13 "[* * . ** *** *+*- **]"
1 46 THR 20.918 1.878 15 12 "[* . ** **- *+** **]"
1 47 ALA 2.679 0.456 10 0 "[ . 1 . 2]"
1 48 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 GLN 0.570 0.115 20 0 "[ . 1 . 2]"
1 51 LEU 6.126 0.383 18 0 "[ . 1 . 2]"
1 52 ALA 4.212 0.383 18 0 "[ . 1 . 2]"
1 53 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 ASP 14.207 3.062 13 7 "[* *. *1* +*. - 2]"
1 55 VAL 28.330 2.955 4 10 "[***+. *1* **. - *]"
1 56 TYR 42.173 3.062 13 10 "[****. *1* +*. - *]"
1 57 GLU 0.621 0.115 20 0 "[ . 1 . 2]"
1 58 VAL 11.046 0.982 5 10 "[* +* *1 - ** * **]"
1 59 VAL 12.731 0.768 8 4 "[ * +-1 . *2]"
1 60 LEU 1.348 0.293 5 0 "[ . 1 . 2]"
1 61 ARG 1.545 0.456 10 0 "[ . 1 . 2]"
1 62 VAL 4.153 0.723 14 1 "[ . 1 +. 2]"
1 63 THR 0.512 0.224 2 0 "[ . 1 . 2]"
1 64 VAL 5.398 0.515 7 1 "[ . + 1 . 2]"
1 65 THR 3.490 0.334 1 0 "[ . 1 . 2]"
1 66 ALA 16.266 1.166 6 14 "[** **+**** * **- *2]"
1 67 SER 10.565 1.304 2 11 "[*+ **** * **-* 2]"
1 68 LEU 46.784 2.431 1 13 "[+ * ****** ** .** -]"
1 69 GLY 3.027 0.291 12 0 "[ . 1 . 2]"
1 70 GLU 14.233 0.976 13 8 "[ * .* ** *+ . * *]"
1 71 GLU 7.780 0.555 13 2 "[ . 1 + . -]"
1 72 THR 0.468 0.368 7 0 "[ . 1 . 2]"
1 73 ALA 17.226 1.999 7 6 "[* - +**1 .* 2]"
1 74 PHE 1.365 0.238 11 0 "[ . 1 . 2]"
1 75 LEU 0.102 0.058 5 0 "[ . 1 . 2]"
1 76 CYS 6.364 0.704 4 7 "[** +. *1 * .- *2]"
1 77 GLU 0.054 0.054 1 0 "[ . 1 . 2]"
1 78 VAL 0.110 0.054 1 0 "[ . 1 . 2]"
1 79 GLN 1.743 0.276 8 0 "[ . 1 . 2]"
1 80 GLN 1.936 0.414 20 0 "[ . 1 . 2]"
1 81 GLY 3.689 0.687 8 1 "[ . + 1 . 2]"
1 82 GLY 8.460 0.768 8 4 "[ * +-1 . *2]"
1 83 ILE 3.957 0.467 7 0 "[ . 1 . 2]"
1 84 PHE 10.519 0.982 5 10 "[* +* *1 - ** * **]"
1 85 SER 6.286 0.545 14 3 "[ . 1* +- 2]"
1 86 ILE 2.946 0.884 9 1 "[ . +1 . 2]"
1 87 ALA 4.714 0.742 12 3 "[ . * 1 + . -2]"
1 88 GLY 6.102 0.527 10 2 "[- . + . 2]"
1 89 ILE 9.015 0.742 12 5 "[- . * * + . *2]"
1 90 GLU 4.252 0.741 3 2 "[ + . 1 - . 2]"
1 91 GLY 2.677 1.592 4 1 "[ +. 1 . 2]"
1 92 THR 0.733 0.103 13 0 "[ . 1 . 2]"
1 93 GLN 0.873 0.140 13 0 "[ . 1 . 2]"
1 94 MET 7.589 1.592 4 4 "[ *+. 1 * . - 2]"
1 95 ALA 3.897 1.261 13 2 "[ .- 1 + . 2]"
1 96 HIS 8.385 0.694 1 3 "[+ . * 1 -. 2]"
1 97 CYS 5.157 0.497 10 0 "[ . 1 . 2]"
1 98 LEU 24.538 1.261 13 6 "[* .* * 1 +-. * 2]"
1 99 GLY 21.982 1.008 6 12 "[ * -+* ** ** * ***2]"
1 100 ALA 16.387 1.083 10 10 "[ * -* * + ** * * *2]"
1 101 TYR 4.387 0.501 17 1 "[ . 1 . + 2]"
1 102 CYS 37.416 1.083 10 18 "[ ** *****+******-***]"
1 109 TYR 0.069 0.048 1 0 "[ . 1 . 2]"
1 110 ALA 3.821 0.226 14 0 "[ . 1 . 2]"
1 111 ARG 2.804 0.193 5 0 "[ . 1 . 2]"
1 112 GLU 0.759 0.296 19 0 "[ . 1 . 2]"
1 113 CYS 0.071 0.036 9 0 "[ . 1 . 2]"
1 114 ILE 1.256 0.275 19 0 "[ . 1 . 2]"
1 115 THR 0.190 0.124 20 0 "[ . 1 . 2]"
1 116 SER 0.112 0.041 1 0 "[ . 1 . 2]"
1 117 MET 14.646 1.428 8 7 "[ * .- + * * * *2]"
1 118 VAL 5.390 0.880 14 4 "[* . * 1 +. -]"
1 119 SER 1.345 0.234 14 0 "[ . 1 . 2]"
1 121 GLY 1.112 0.193 8 0 "[ . 1 . 2]"
1 122 THR 1.318 0.210 2 0 "[ . 1 . 2]"
1 123 PHE 6.569 0.880 14 4 "[* . * 1 +. -]"
1 125 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 126 LEU 5.564 0.520 9 1 "[ . +1 . 2]"
1 127 ASN 3.888 0.520 9 1 "[ . +1 . 2]"
1 128 LEU 1.297 0.723 14 1 "[ . 1 +. 2]"
1 129 ALA 5.338 0.982 3 5 "[ *+ . *1 * . - 2]"
1 131 VAL 5.763 0.714 16 4 "[ * 1- .+ *2]"
1 133 PHE 6.022 0.714 16 4 "[ * 1- .+ *2]"
1 134 ASP 0.199 0.069 9 0 "[ . 1 . 2]"
1 135 ALA 0.276 0.120 12 0 "[ . 1 . 2]"
1 136 LEU 0.939 0.294 12 0 "[ . 1 . 2]"
1 137 PHE 0.169 0.068 2 0 "[ . 1 . 2]"
1 138 MET 0.724 0.294 12 0 "[ . 1 . 2]"
1 139 ASN 0.154 0.154 19 0 "[ . 1 . 2]"
1 140 TYR 1.180 0.194 12 0 "[ . 1 . 2]"
1 141 LEU 1.215 0.194 12 0 "[ . 1 . 2]"
2 9 MET 0.156 0.156 7 0 "[ . 1 . 2]"
2 10 THR 2.355 0.660 17 1 "[ . 1 . + 2]"
2 11 PHE 9.968 1.207 6 8 "[** -+ * ** * 2]"
2 12 GLN 11.133 1.207 6 8 "[** -+ * ** * 2]"
2 13 ILE 1.165 0.159 2 0 "[ . 1 . 2]"
2 14 GLN 4.082 0.453 17 0 "[ . 1 . 2]"
2 15 ARG 4.052 0.386 19 0 "[ . 1 . 2]"
2 16 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
2 17 TYR 0.487 0.137 16 0 "[ . 1 . 2]"
2 18 THR 1.318 0.210 2 0 "[ . 1 . 2]"
2 19 LYS 0.168 0.061 16 0 "[ . 1 . 2]"
2 20 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 21 ILE 8.429 1.428 8 7 "[ * .- + * * * *2]"
2 22 SER 8.636 0.636 18 4 "[ -* .* 1 . + 2]"
2 23 PHE 0.260 0.137 4 0 "[ . 1 . 2]"
2 24 GLU 0.260 0.137 4 0 "[ . 1 . 2]"
2 25 ALA 0.642 0.162 15 0 "[ . 1 . 2]"
2 27 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
2 28 ALA 10.186 0.861 16 4 "[ -* . 1 .+* 2]"
2 30 HIS 10.909 0.861 16 4 "[ -* . 1 .+* 2]"
2 31 VAL 2.438 0.249 19 0 "[ . 1 . 2]"
2 32 PHE 2.021 0.329 16 0 "[ . 1 . 2]"
2 33 GLN 0.022 0.022 11 0 "[ . 1 . 2]"
2 34 LYS 0.171 0.117 11 0 "[ . 1 . 2]"
2 35 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 36 TRP 33.129 2.480 5 6 "[ + *1** *- 2]"
2 37 GLN 25.195 2.312 12 6 "[ - *1*+ ** 2]"
2 39 GLU 8.636 2.480 5 6 "[ + *1** *- 2]"
2 40 VAL 9.054 1.132 17 6 "[ . -* * .*+ *]"
2 41 LYS 0.887 0.265 3 0 "[ . 1 . 2]"
2 42 LEU 53.489 1.996 10 20 [*********+*********-]
2 43 ASP 16.148 1.381 13 15 "[ ** *** ****+ ** **-]"
2 44 LEU 0.721 0.554 16 1 "[ . 1 .+ 2]"
2 45 ASP 2.735 0.395 1 0 "[ . 1 . 2]"
2 46 THR 2.735 0.395 1 0 "[ . 1 . 2]"
2 47 ALA 3.939 0.597 4 2 "[ +. 1 - . 2]"
2 48 SER 1.831 0.222 19 0 "[ . 1 . 2]"
2 49 SER 12.817 1.075 2 9 "[ + *. ***1**- * 2]"
2 50 GLN 2.753 0.302 10 0 "[ . 1 . 2]"
2 51 LEU 2.057 0.294 11 0 "[ . 1 . 2]"
2 52 ALA 0.680 0.164 18 0 "[ . 1 . 2]"
2 53 ASP 0.056 0.051 16 0 "[ . 1 . 2]"
2 54 ASP 0.283 0.098 11 0 "[ . 1 . 2]"
2 55 VAL 6.927 0.676 12 1 "[ . 1 + . 2]"
2 56 TYR 22.636 2.547 10 10 "[ * * * + ** .*-* *]"
2 57 GLU 12.543 1.075 2 9 "[ + *. ***1**- * 2]"
2 58 VAL 1.075 0.242 2 0 "[ . 1 . 2]"
2 59 VAL 5.468 0.597 4 2 "[ +. 1 - . 2]"
2 60 LEU 4.553 0.487 18 0 "[ . 1 . 2]"
2 61 ARG 0.206 0.129 19 0 "[ . 1 . 2]"
2 62 VAL 7.682 1.105 19 7 "[ ** . *1* * - +2]"
2 63 THR 0.139 0.068 16 0 "[ . 1 . 2]"
2 64 VAL 7.369 0.435 3 0 "[ . 1 . 2]"
2 65 THR 3.135 0.312 15 0 "[ . 1 . 2]"
2 66 ALA 10.103 0.578 11 4 "[ . 1+ -*. * 2]"
2 67 SER 0.935 0.349 19 0 "[ . 1 . 2]"
2 68 LEU 8.737 0.319 15 0 "[ . 1 . 2]"
2 69 GLY 2.215 0.236 20 0 "[ . 1 . 2]"
2 70 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 71 GLU 5.423 0.319 15 0 "[ . 1 . 2]"
2 72 THR 0.896 0.213 12 0 "[ . 1 . 2]"
2 73 ALA 4.612 0.372 14 0 "[ . 1 . 2]"
2 74 PHE 15.237 0.625 11 7 "[ * * 1+ -*. ** 2]"
2 75 LEU 7.676 0.625 11 4 "[ - * 1+ . * 2]"
2 76 CYS 1.512 0.310 5 0 "[ . 1 . 2]"
2 77 GLU 0.100 0.091 1 0 "[ . 1 . 2]"
2 78 VAL 0.365 0.091 1 0 "[ . 1 . 2]"
2 79 GLN 8.476 0.636 18 4 "[ -* .* 1 . + 2]"
2 80 GLN 0.035 0.035 14 0 "[ . 1 . 2]"
2 81 GLY 0.287 0.061 16 0 "[ . 1 . 2]"
2 82 GLY 4.473 0.487 18 0 "[ . 1 . 2]"
2 83 ILE 9.154 0.453 17 0 "[ . 1 . 2]"
2 84 PHE 2.240 0.275 6 0 "[ . 1 . 2]"
2 85 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 86 ILE 0.706 0.646 17 1 "[ . 1 . + 2]"
2 87 ALA 6.882 0.722 18 4 "[ . * . -+ *]"
2 88 GLY 3.087 0.468 8 0 "[ . 1 . 2]"
2 89 ILE 11.791 0.722 18 4 "[ . * . -+ *]"
2 90 GLU 0.786 0.747 17 1 "[ . 1 . + 2]"
2 91 GLY 5.245 1.902 2 4 "[ + . * 1 -. * 2]"
2 92 THR 8.195 0.540 17 2 "[ . - 1 . + 2]"
2 93 GLN 3.899 0.389 7 0 "[ . 1 . 2]"
2 94 MET 16.994 1.902 2 6 "[ + . -* 1 ** * 2]"
2 95 ALA 5.496 1.772 2 4 "[ + . * 1 * - 2]"
2 96 HIS 5.697 0.439 18 0 "[ . 1 . 2]"
2 97 CYS 2.967 0.301 12 0 "[ . 1 . 2]"
2 98 LEU 20.842 2.547 10 9 "[ * * * + * .*** -]"
2 99 GLY 20.354 0.607 3 6 "[ *+ . * 1 ** . - 2]"
2 100 ALA 10.304 0.526 10 1 "[ . + . 2]"
2 101 TYR 6.078 0.539 8 2 "[ . + 1 - . 2]"
2 102 CYS 13.255 0.607 3 7 "[ *+ . * * ** . - 2]"
2 109 TYR 0.370 0.123 3 0 "[ . 1 . 2]"
2 110 ALA 3.125 0.174 20 0 "[ . 1 . 2]"
2 111 ARG 2.032 0.174 20 0 "[ . 1 . 2]"
2 112 GLU 0.723 0.119 8 0 "[ . 1 . 2]"
2 113 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 114 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
2 115 THR 0.000 0.000 . 0 "[ . 1 . 2]"
2 116 SER 0.021 0.021 16 0 "[ . 1 . 2]"
2 117 MET 0.220 0.217 6 0 "[ . 1 . 2]"
2 118 VAL 0.232 0.114 2 0 "[ . 1 . 2]"
2 119 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 121 GLY 4.475 0.463 6 0 "[ . 1 . 2]"
2 122 THR 0.238 0.101 8 0 "[ . 1 . 2]"
2 123 PHE 4.475 0.463 6 0 "[ . 1 . 2]"
2 125 GLN 0.266 0.261 11 0 "[ . 1 . 2]"
2 126 LEU 10.398 1.151 9 6 "[ * - * +1 .* *2]"
2 127 ASN 13.129 1.090 9 10 "[ * -** +* **.* *2]"
2 128 LEU 39.122 1.996 10 20 [********-+**********]
2 129 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 131 VAL 4.980 1.300 8 4 "[ . + * . - *]"
2 133 PHE 20.004 0.752 19 10 "[ ** * *1 *- ** +*]"
2 134 ASP 8.436 0.424 3 0 "[ . 1 . 2]"
2 135 ALA 12.487 0.752 19 9 "[ ** * *1 * ** +-]"
2 136 LEU 6.999 0.683 10 3 "[ . + - . * 2]"
2 137 PHE 0.080 0.080 6 0 "[ . 1 . 2]"
2 138 MET 0.000 0.000 . 0 "[ . 1 . 2]"
2 139 ASN 0.076 0.076 8 0 "[ . 1 . 2]"
2 140 TYR 0.115 0.080 6 0 "[ . 1 . 2]"
2 141 LEU 0.111 0.076 8 0 "[ . 1 . 2]"
3 9 MET 25.953 2.265 13 15 "[****.-***1 *+*** * *]"
3 10 THR 12.589 1.204 20 5 "[ -.** 1 . * +]"
3 11 PHE 23.287 1.185 15 18 "[**-*.*********+* ***]"
3 12 GLN 9.733 0.764 19 6 "[* . - 1 * *.* +2]"
3 13 ILE 1.948 0.236 13 0 "[ . 1 . 2]"
3 14 GLN 0.185 0.083 20 0 "[ . 1 . 2]"
3 15 ARG 0.246 0.083 20 0 "[ . 1 . 2]"
3 16 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
3 17 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
3 18 THR 0.047 0.028 15 0 "[ . 1 . 2]"
3 19 LYS 0.231 0.144 3 0 "[ . 1 . 2]"
3 20 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
3 21 ILE 4.495 0.506 1 1 "[+ . 1 . 2]"
3 22 SER 12.536 0.768 12 15 "[****.** **+ *.-****]"
3 23 PHE 1.998 0.246 11 0 "[ . 1 . 2]"
3 24 GLU 1.998 0.246 11 0 "[ . 1 . 2]"
3 25 ALA 3.131 0.415 15 0 "[ . 1 . 2]"
3 27 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
3 28 ALA 8.377 0.591 16 4 "[ . 1-* .+* 2]"
3 30 HIS 9.514 0.591 16 4 "[ . 1-* .+* 2]"
3 31 VAL 0.207 0.063 16 0 "[ . 1 . 2]"
3 32 PHE 1.485 0.273 11 0 "[ . 1 . 2]"
3 33 GLN 0.196 0.178 20 0 "[ . 1 . 2]"
3 34 LYS 0.308 0.178 20 0 "[ . 1 . 2]"
3 35 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
3 36 TRP 1.162 0.262 17 0 "[ . 1 . 2]"
3 37 GLN 1.414 0.262 17 0 "[ . 1 . 2]"
3 39 GLU 3.459 0.784 12 3 "[ . 1 + . -* 2]"
3 40 VAL 16.543 2.452 13 11 "[ *. *- ***+ .****2]"
3 41 LYS 18.400 1.966 8 11 "[ *. + -****.****2]"
3 42 LEU 38.727 2.452 13 13 "[ * *. ** ***+*.-***2]"
3 43 ASP 2.189 0.590 9 1 "[ . +1 . 2]"
3 44 LEU 2.213 0.749 2 1 "[ + . 1 . 2]"
3 45 ASP 1.121 0.398 20 0 "[ . 1 . 2]"
3 46 THR 0.057 0.027 12 0 "[ . 1 . 2]"
3 47 ALA 6.040 0.582 14 4 "[ ** - 1 +. 2]"
3 48 SER 6.366 0.645 14 1 "[ . 1 +. 2]"
3 49 SER 12.909 0.912 2 10 "[ +*-. * * *** * *]"
3 50 GLN 11.937 3.302 1 1 "[+ . 1 . 2]"
3 51 LEU 6.847 1.299 1 1 "[+ . 1 . 2]"
3 52 ALA 1.222 0.197 1 0 "[ . 1 . 2]"
3 53 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
3 54 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
3 55 VAL 7.608 0.420 8 0 "[ . 1 . 2]"
3 56 TYR 11.787 3.302 1 1 "[+ . 1 . 2]"
3 57 GLU 7.427 0.462 5 0 "[ . 1 . 2]"
3 58 VAL 6.899 0.391 20 0 "[ . 1 . 2]"
3 59 VAL 16.529 0.912 2 10 "[ +*-. * * *** * *]"
3 60 LEU 2.367 0.477 14 0 "[ . 1 . 2]"
3 61 ARG 5.663 0.582 14 4 "[ ** - 1 +. 2]"
3 62 VAL 0.751 0.135 5 0 "[ . 1 . 2]"
3 63 THR 3.582 0.590 9 1 "[ . +1 . 2]"
3 64 VAL 2.705 0.241 18 0 "[ . 1 . 2]"
3 65 THR 3.772 0.444 10 0 "[ . 1 . 2]"
3 66 ALA 8.392 0.885 6 6 "[ .+* -1 .* **]"
3 67 SER 5.177 0.784 12 3 "[ . 1 + . -* 2]"
3 68 LEU 12.090 0.828 2 9 "[*+ . *** - ** *]"
3 69 GLY 8.063 0.494 11 0 "[ . 1 . 2]"
3 70 GLU 15.478 0.828 2 9 "[*+ . *** - ** *]"
3 71 GLU 4.023 0.297 10 0 "[ . 1 . 2]"
3 72 THR 0.000 0.000 . 0 "[ . 1 . 2]"
3 73 ALA 1.173 0.276 8 0 "[ . 1 . 2]"
3 74 PHE 1.799 0.528 10 2 "[ . + . -]"
3 75 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
3 76 CYS 7.704 0.885 6 6 "[ .+* -1 .* **]"
3 77 GLU 1.756 0.202 17 0 "[ . 1 . 2]"
3 78 VAL 1.520 0.202 17 0 "[ . 1 . 2]"
3 79 GLN 11.263 0.768 12 15 "[****.** **+ *.-****]"
3 80 GLN 0.778 0.477 14 0 "[ . 1 . 2]"
3 81 GLY 1.302 0.250 14 0 "[ . 1 . 2]"
3 82 GLY 3.637 0.391 20 0 "[ . 1 . 2]"
3 83 ILE 0.073 0.044 19 0 "[ . 1 . 2]"
3 84 PHE 0.607 0.248 15 0 "[ . 1 . 2]"
3 85 SER 0.000 0.000 . 0 "[ . 1 . 2]"
3 86 ILE 0.852 0.319 12 0 "[ . 1 . 2]"
3 87 ALA 5.200 0.509 1 2 "[+ . 1 . - 2]"
3 88 GLY 1.990 0.187 10 0 "[ . 1 . 2]"
3 89 ILE 25.476 2.265 13 12 "[* **.*** 1 *+** - *]"
3 90 GLU 0.336 0.226 17 0 "[ . 1 . 2]"
3 91 GLY 12.937 2.208 2 10 "[ +**.- *** * **]"
3 92 THR 0.000 0.000 . 0 "[ . 1 . 2]"
3 93 GLN 0.640 0.314 8 0 "[ . 1 . 2]"
3 94 MET 14.757 2.208 2 10 "[ +**.- *** * **]"
3 95 ALA 1.791 0.424 1 0 "[ . 1 . 2]"
3 96 HIS 8.813 0.687 1 3 "[+ . 1 .* -2]"
3 97 CYS 13.338 1.665 15 8 "[ * .** *1 +* - *]"
3 98 LEU 14.927 0.687 1 3 "[+ . 1 .* *2]"
3 99 GLY 1.170 0.205 16 0 "[ . 1 . 2]"
3 100 ALA 8.162 0.421 1 0 "[ . 1 . 2]"
3 101 TYR 3.330 0.558 1 1 "[+ . 1 . 2]"
3 102 CYS 13.255 1.185 15 12 "[ *-*.* **** * + * *]"
3 109 TYR 0.905 0.296 19 0 "[ . 1 . 2]"
3 110 ALA 12.178 0.605 19 2 "[ . 1- . +2]"
3 111 ARG 8.111 0.292 20 0 "[ . 1 . 2]"
3 112 GLU 11.266 0.605 19 2 "[ . 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 0.362 0.097 9 0 "[ . 1 . 2]"
3 117 MET 0.000 0.000 . 0 "[ . 1 . 2]"
3 118 VAL 0.362 0.097 9 0 "[ . 1 . 2]"
3 119 SER 0.000 0.000 . 0 "[ . 1 . 2]"
3 121 GLY 8.807 0.587 7 8 "[ **+ 1*- ** *]"
3 122 THR 0.032 0.032 6 0 "[ . 1 . 2]"
3 123 PHE 10.606 0.587 7 9 "[ **+ **- ** *]"
3 125 GLN 0.266 0.261 11 0 "[ . 1 . 2]"
3 126 LEU 12.422 1.294 1 6 "[+* .** ** . 2]"
3 127 ASN 4.645 0.627 6 3 "[- .+ * . 2]"
3 128 LEU 10.301 1.294 1 8 "[+* . * ** *-* 2]"
3 129 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
3 131 VAL 3.462 0.707 10 3 "[ . + * - 2]"
3 133 PHE 6.342 0.596 11 3 "[ * . 1+ -. 2]"
3 134 ASP 2.885 0.391 14 0 "[ . 1 . 2]"
3 135 ALA 1.005 0.542 16 1 "[ . 1 .+ 2]"
3 136 LEU 4.999 0.596 11 3 "[ * . 1+ -. 2]"
3 137 PHE 5.733 2.421 6 1 "[ .+ 1 . 2]"
3 138 MET 1.458 0.542 16 1 "[ . 1 .+ 2]"
3 139 ASN 0.207 0.154 6 0 "[ . 1 . 2]"
3 140 TYR 5.804 1.355 16 2 "[ .- 1 .+ 2]"
3 141 LEU 7.682 2.421 6 2 "[ .+ 1 .* 2]"
4 9 MET 0.000 0.000 . 0 "[ . 1 . 2]"
4 10 THR 1.123 0.387 15 0 "[ . 1 . 2]"
4 11 PHE 11.232 0.615 9 4 "[ * +* - . 2]"
4 12 GLN 6.099 0.487 20 0 "[ . 1 . 2]"
4 13 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
4 14 GLN 6.015 0.384 14 0 "[ . 1 . 2]"
4 15 ARG 4.944 0.318 8 0 "[ . 1 . 2]"
4 16 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
4 17 TYR 2.174 0.300 8 0 "[ . 1 . 2]"
4 18 THR 0.032 0.032 6 0 "[ . 1 . 2]"
4 19 LYS 7.941 0.666 18 3 "[ - 1 . + *]"
4 20 ASP 5.552 0.547 8 1 "[ . + 1 . 2]"
4 21 ILE 3.131 0.415 15 0 "[ . 1 . 2]"
4 22 SER 0.000 0.000 . 0 "[ . 1 . 2]"
4 23 PHE 11.911 0.572 13 2 "[- . 1 + . 2]"
4 24 GLU 6.564 0.572 13 1 "[ . 1 + . 2]"
4 25 ALA 0.002 0.002 4 0 "[ . 1 . 2]"
4 27 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
4 28 ALA 15.826 0.894 1 19 "[+-*************** **]"
4 30 HIS 15.915 0.894 1 19 "[+-*************** **]"
4 31 VAL 2.974 0.228 2 0 "[ . 1 . 2]"
4 32 PHE 2.324 0.250 18 0 "[ . 1 . 2]"
4 33 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
4 34 LYS 0.145 0.088 13 0 "[ . 1 . 2]"
4 35 ASP 1.243 0.198 14 0 "[ . 1 . 2]"
4 36 TRP 53.250 4.313 2 11 "[*+ * 1**- **** *]"
4 37 GLN 22.202 2.595 15 6 "[** . 1 *- + * 2]"
4 39 GLU 12.223 3.297 2 6 "[*+ . 1 * * - *]"
4 40 VAL 1.201 0.186 17 0 "[ . 1 . 2]"
4 41 LYS 2.933 0.852 4 2 "[ +. 1 - . 2]"
4 42 LEU 15.070 1.709 20 13 "[*-* * * * * *****+]"
4 43 ASP 31.773 2.559 13 18 "[* *****-*** +*******]"
4 44 LEU 14.187 0.941 6 11 "[ ***+* ** -** * 2]"
4 45 ASP 12.614 0.801 18 6 "[ . * ** -*. + 2]"
4 46 THR 6.984 0.405 6 0 "[ . 1 . 2]"
4 47 ALA 0.434 0.263 11 0 "[ . 1 . 2]"
4 48 SER 0.000 0.000 . 0 "[ . 1 . 2]"
4 49 SER 21.459 2.543 17 11 "[ * ******-* . + *2]"
4 50 GLN 9.232 0.970 12 4 "[ - . * 1 + . * 2]"
4 51 LEU 1.236 0.348 16 0 "[ . 1 . 2]"
4 52 ALA 0.014 0.014 10 0 "[ . 1 . 2]"
4 53 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
4 54 ASP 0.186 0.115 1 0 "[ . 1 . 2]"
4 55 VAL 4.152 0.307 4 0 "[ . 1 . 2]"
4 56 TYR 58.215 3.183 13 15 "[ *-******* *+*. ***2]"
4 57 GLU 10.199 0.718 7 4 "[ - . + 1 . ** 2]"
4 58 VAL 6.579 0.610 14 6 "[* *. 1 **+.- 2]"
4 59 VAL 3.061 0.655 19 2 "[ . 1- . +2]"
4 60 LEU 2.576 0.583 6 1 "[ .+ 1 . 2]"
4 61 ARG 1.510 0.263 11 0 "[ . 1 . 2]"
4 62 VAL 0.579 0.131 19 0 "[ . 1 . 2]"
4 63 THR 0.000 0.000 . 0 "[ . 1 . 2]"
4 64 VAL 2.363 1.117 3 1 "[ + . 1 . 2]"
4 65 THR 2.724 0.852 4 2 "[ +. 1 - . 2]"
4 66 ALA 0.010 0.010 14 0 "[ . 1 . 2]"
4 67 SER 1.323 0.417 10 0 "[ . 1 . 2]"
4 68 LEU 1.928 0.365 7 0 "[ . 1 . 2]"
4 69 GLY 18.576 4.313 2 8 "[*+ - 1** ** * 2]"
4 70 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
4 71 GLU 0.978 0.365 7 0 "[ . 1 . 2]"
4 72 THR 0.000 0.000 . 0 "[ . 1 . 2]"
4 73 ALA 3.600 0.280 14 0 "[ . 1 . 2]"
4 74 PHE 12.335 0.649 4 10 "[** +.** *1 *-* * 2]"
4 75 LEU 10.704 0.649 4 10 "[** +.** *1 *-* * 2]"
4 76 CYS 0.027 0.012 10 0 "[ . 1 . 2]"
4 77 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
4 78 VAL 0.441 0.079 11 0 "[ . 1 . 2]"
4 79 GLN 13.187 0.666 18 4 "[ - * 1 . + *]"
4 80 GLN 1.573 0.310 10 0 "[ . 1 . 2]"
4 81 GLY 2.079 0.300 8 0 "[ . 1 . 2]"
4 82 GLY 2.374 0.583 6 1 "[ .+ 1 . 2]"
4 83 ILE 5.135 0.384 14 0 "[ . 1 . 2]"
4 84 PHE 6.643 0.610 14 6 "[* *. 1 **+.- 2]"
4 85 SER 0.528 0.182 13 0 "[ . 1 . 2]"
4 86 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
4 87 ALA 4.402 0.848 13 2 "[ - 1 + . 2]"
4 88 GLY 1.844 0.328 6 0 "[ . 1 . 2]"
4 89 ILE 5.097 0.848 13 2 "[ - 1 + . 2]"
4 90 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
4 91 GLY 11.350 1.437 8 9 "[ . *+** **- **2]"
4 92 THR 1.384 0.457 10 0 "[ . 1 . 2]"
4 93 GLN 0.215 0.133 15 0 "[ . 1 . 2]"
4 94 MET 47.219 3.183 13 14 "[ * *-*******+*. **2]"
4 95 ALA 13.649 1.437 8 9 "[ . *+** **- **2]"
4 96 HIS 5.861 0.537 12 1 "[ . 1 + . 2]"
4 97 CYS 0.421 0.140 13 0 "[ . 1 . 2]"
4 98 LEU 32.295 2.092 19 14 "[ *********-* . **+2]"
4 99 GLY 1.289 0.312 11 0 "[ . 1 . 2]"
4 100 ALA 3.436 0.412 10 0 "[ . 1 . 2]"
4 101 TYR 0.003 0.003 10 0 "[ . 1 . 2]"
4 102 CYS 7.525 0.615 9 4 "[ * +* - . 2]"
4 105 ILE 0.012 0.012 18 0 "[ . 1 . 2]"
4 109 TYR 0.023 0.023 10 0 "[ . 1 . 2]"
4 110 ALA 3.989 0.310 10 0 "[ . 1 . 2]"
4 111 ARG 1.232 0.129 4 0 "[ . 1 . 2]"
4 112 GLU 1.515 0.148 6 0 "[ . 1 . 2]"
4 113 CYS 0.437 0.092 19 0 "[ . 1 . 2]"
4 114 ILE 0.048 0.048 19 0 "[ . 1 . 2]"
4 115 THR 0.000 0.000 . 0 "[ . 1 . 2]"
4 116 SER 0.048 0.048 19 0 "[ . 1 . 2]"
4 117 MET 0.000 0.000 . 0 "[ . 1 . 2]"
4 118 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
4 119 SER 0.000 0.000 . 0 "[ . 1 . 2]"
4 121 GLY 4.499 0.357 8 0 "[ . 1 . 2]"
4 122 THR 0.057 0.034 13 0 "[ . 1 . 2]"
4 123 PHE 4.528 0.357 8 0 "[ . 1 . 2]"
4 125 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
4 126 LEU 11.126 1.511 17 5 "[ * . * - * . + 2]"
4 127 ASN 2.391 0.399 7 0 "[ . 1 . 2]"
4 128 LEU 38.619 2.559 13 17 "[* * ***-*** +*******]"
4 129 ALA 15.596 1.709 20 13 "[*-* * * * * *****+]"
4 131 VAL 9.902 1.395 7 7 "[ **.*+ 1 * .*- 2]"
4 133 PHE 10.513 1.050 3 5 "[ + * - 1 . * *2]"
4 134 ASP 3.662 0.330 19 0 "[ . 1 . 2]"
4 135 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
4 136 LEU 15.646 1.395 7 7 "[ *** + 1 * . * *2]"
4 137 PHE 0.779 0.433 16 0 "[ . 1 . 2]"
4 138 MET 0.085 0.085 18 0 "[ . 1 . 2]"
4 139 ASN 0.671 0.406 16 0 "[ . 1 . 2]"
4 140 TYR 0.732 0.433 16 0 "[ . 1 . 2]"
4 141 LEU 0.350 0.165 8 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 9 MET H 1 10 THR H 3.320 . 4.840 4.507 4.260 4.629 . 0 0 "[ . 1 . 2]" 1
2 1 10 THR H 1 11 PHE H 3.110 . 4.420 4.148 3.849 4.289 . 0 0 "[ . 1 . 2]" 1
3 1 10 THR H 1 87 ALA H 2.680 . 3.560 3.109 2.625 3.764 0.204 20 0 "[ . 1 . 2]" 1
4 1 11 PHE H 1 12 GLN H 3.190 . 4.580 4.205 3.958 4.345 . 0 0 "[ . 1 . 2]" 1
5 1 11 PHE QD 1 12 GLN H 2.620 . 3.440 2.592 1.712 4.022 0.582 1 1 "[+ . 1 . 2]" 1
6 1 11 PHE QD 1 101 TYR QD 3.510 . 5.220 4.517 3.721 4.754 . 0 0 "[ . 1 . 2]" 1
7 1 11 PHE QD 1 101 TYR QE 3.350 . 4.900 2.802 2.557 3.530 . 0 0 "[ . 1 . 2]" 1
8 1 11 PHE QE 1 12 GLN H 3.230 . 4.660 4.138 3.694 5.119 0.459 1 0 "[ . 1 . 2]" 1
9 1 11 PHE QE 1 84 PHE QD 2.890 . 3.980 2.546 2.029 3.596 . 0 0 "[ . 1 . 2]" 1
10 1 11 PHE QE 1 84 PHE QE 3.390 . 4.980 4.116 3.801 4.322 . 0 0 "[ . 1 . 2]" 1
11 1 11 PHE QE 1 101 TYR QD 3.340 . 4.880 3.897 3.090 4.067 . 0 0 "[ . 1 . 2]" 1
12 1 11 PHE QE 1 101 TYR QE 3.510 . 5.220 2.642 2.152 3.374 . 0 0 "[ . 1 . 2]" 1
13 1 11 PHE QE 1 102 CYS H 3.450 . 5.100 5.712 4.739 6.131 1.031 7 16 "[ -* .*+ ************]" 1
14 1 12 GLN H 1 13 ILE H 3.070 . 4.340 4.010 3.736 4.294 . 0 0 "[ . 1 . 2]" 1
15 1 12 GLN H 1 85 SER H 2.510 . 3.220 3.202 2.572 3.730 0.510 15 1 "[ . 1 + 2]" 1
16 1 13 ILE H 1 14 GLN H 3.200 . 4.600 4.373 4.293 4.443 . 0 0 "[ . 1 . 2]" 1
17 1 14 GLN H 1 15 ARG H 2.230 . 2.660 2.420 2.280 2.561 . 0 0 "[ . 1 . 2]" 1
18 1 14 GLN H 1 83 ILE H 3.340 . 4.880 4.804 4.382 5.141 0.261 18 0 "[ . 1 . 2]" 1
19 1 14 GLN H 1 84 PHE H 3.390 . 4.980 4.827 4.412 5.459 0.479 7 0 "[ . 1 . 2]" 1
20 1 14 GLN H 1 84 PHE QD 3.480 . 5.160 4.373 3.898 5.104 . 0 0 "[ . 1 . 2]" 1
21 1 14 GLN H 1 85 SER H 2.850 . 3.900 3.747 2.824 4.445 0.545 14 2 "[ . 1- +. 2]" 1
22 1 15 ARG H 1 16 ILE H 3.140 . 4.480 4.113 3.887 4.250 . 0 0 "[ . 1 . 2]" 1
23 1 15 ARG H 1 83 ILE H 2.550 . 3.300 3.433 3.029 3.767 0.467 7 0 "[ . 1 . 2]" 1
24 1 16 ILE H 1 17 TYR H 3.190 . 4.580 4.380 4.263 4.486 . 0 0 "[ . 1 . 2]" 1
25 1 17 TYR H 1 18 THR H 3.170 . 4.540 4.298 4.182 4.368 . 0 0 "[ . 1 . 2]" 1
26 1 17 TYR H 1 81 GLY H 2.870 . 3.940 3.890 3.634 4.103 0.163 14 0 "[ . 1 . 2]" 1
27 1 17 TYR H 1 82 GLY H 3.510 . 5.220 4.977 4.617 5.159 . 0 0 "[ . 1 . 2]" 1
28 1 17 TYR QD 1 18 THR H 3.150 . 4.500 3.654 3.091 4.290 . 0 0 "[ . 1 . 2]" 1
29 1 17 TYR QD 2 32 PHE QE 2.860 . 3.920 3.437 3.031 3.745 . 0 0 "[ . 1 . 2]" 1
30 1 17 TYR QE 1 83 ILE H 3.500 . 5.200 3.177 2.479 3.615 . 0 0 "[ . 1 . 2]" 1
31 1 17 TYR QE 2 28 ALA MB 3.500 . 5.200 1.963 1.764 2.274 0.036 17 0 "[ . 1 . 2]" 1
32 1 17 TYR QE 2 32 PHE QE 3.070 . 4.340 2.912 2.801 3.134 . 0 0 "[ . 1 . 2]" 1
33 1 18 THR H 1 19 LYS H 3.200 . 4.600 4.378 4.291 4.490 . 0 0 "[ . 1 . 2]" 1
34 1 18 THR H 1 81 GLY H 3.340 . 4.880 4.756 4.526 4.954 0.074 3 0 "[ . 1 . 2]" 1
35 1 18 THR H 2 121 GLY H 3.290 . 4.780 4.214 3.869 4.547 . 0 0 "[ . 1 . 2]" 1
36 1 18 THR H 2 122 THR H 3.330 . 4.860 4.659 4.407 4.961 0.101 8 0 "[ . 1 . 2]" 1
37 1 19 LYS H 1 20 ASP H 2.240 . 2.680 2.320 2.219 2.476 . 0 0 "[ . 1 . 2]" 1
38 1 19 LYS H 1 59 VAL MG1 3.300 . 4.800 4.345 3.949 4.715 . 0 0 "[ . 1 . 2]" 1
39 1 19 LYS H 1 79 GLN H 3.380 . 4.960 4.965 4.664 5.236 0.276 8 0 "[ . 1 . 2]" 1
40 1 19 LYS H 1 81 GLY H 2.340 . 2.880 2.680 2.391 2.954 0.074 7 0 "[ . 1 . 2]" 1
41 1 20 ASP H 1 21 ILE H 3.170 . 4.540 4.208 4.118 4.270 . 0 0 "[ . 1 . 2]" 1
42 1 20 ASP H 1 79 GLN H 2.710 . 3.620 3.529 3.292 3.762 0.142 8 0 "[ . 1 . 2]" 1
43 1 21 ILE H 1 22 SER H 3.040 . 4.280 4.317 4.227 4.400 0.120 7 0 "[ . 1 . 2]" 1
44 1 21 ILE H 2 23 PHE H 2.900 . 4.000 2.865 2.558 3.116 . 0 0 "[ . 1 . 2]" 1
45 1 21 ILE H 2 23 PHE QD 3.220 . 4.640 3.718 3.308 4.122 . 0 0 "[ . 1 . 2]" 1
46 1 22 SER H 1 23 PHE H 3.220 . 4.640 4.154 3.766 4.303 . 0 0 "[ . 1 . 2]" 1
47 1 22 SER H 1 77 GLU H 2.860 . 3.920 3.229 2.960 3.455 . 0 0 "[ . 1 . 2]" 1
48 1 22 SER H 1 78 VAL H 3.490 . 5.180 5.064 4.917 5.231 0.051 13 0 "[ . 1 . 2]" 1
49 1 22 SER H 1 78 VAL MG2 3.480 . 5.160 3.275 3.171 3.418 . 0 0 "[ . 1 . 2]" 1
50 1 22 SER H 1 79 GLN H 3.500 . 5.200 5.039 4.788 5.334 0.134 3 0 "[ . 1 . 2]" 1
51 1 23 PHE H 1 24 GLU H 3.000 . 4.200 4.138 3.924 4.292 0.092 18 0 "[ . 1 . 2]" 1
52 1 23 PHE H 1 117 MET ME 3.470 . 5.140 4.622 3.320 6.437 1.297 8 2 "[ . + 1 . - 2]" 1
53 1 23 PHE H 2 21 ILE H 2.540 . 3.280 2.695 2.425 2.975 . 0 0 "[ . 1 . 2]" 1
54 1 23 PHE QD 1 24 GLU H 2.860 . 3.920 3.595 3.208 4.006 0.086 4 0 "[ . 1 . 2]" 1
55 1 23 PHE QD 1 117 MET ME 3.090 . 4.380 3.411 2.438 5.375 0.995 8 2 "[ . + 1 . - 2]" 1
56 1 23 PHE QD 2 21 ILE H 3.020 . 4.240 3.192 2.555 4.148 . 0 0 "[ . 1 . 2]" 1
57 1 23 PHE QE 1 24 GLU H 3.520 . 5.240 4.680 4.370 5.111 . 0 0 "[ . 1 . 2]" 1
58 1 23 PHE QE 1 25 ALA MB 3.120 . 4.440 2.825 2.530 3.062 . 0 0 "[ . 1 . 2]" 1
59 1 23 PHE QE 1 121 GLY H 3.360 . 4.920 4.257 3.895 4.554 . 0 0 "[ . 1 . 2]" 1
60 1 24 GLU H 1 25 ALA H 3.250 . 4.700 4.170 3.970 4.394 . 0 0 "[ . 1 . 2]" 1
61 1 24 GLU H 1 75 LEU H 2.500 . 3.200 2.783 2.447 3.258 0.058 5 0 "[ . 1 . 2]" 1
62 1 24 GLU H 2 21 ILE H 3.450 . 5.100 4.891 4.748 5.041 . 0 0 "[ . 1 . 2]" 1
63 1 25 ALA MB 1 28 ALA H 3.280 . 4.760 3.183 2.891 3.421 . 0 0 "[ . 1 . 2]" 1
64 1 25 ALA MB 1 28 ALA MB 3.020 . 4.240 1.881 1.538 2.095 0.262 1 0 "[ . 1 . 2]" 1
65 1 27 ASN H 1 28 ALA H 2.430 . 3.060 2.609 2.372 2.885 . 0 0 "[ . 1 . 2]" 1
66 1 28 ALA H 1 30 HIS H 2.890 . 3.980 4.018 3.797 4.252 0.272 10 0 "[ . 1 . 2]" 1
67 1 28 ALA MB 1 30 HIS H 3.520 . 5.240 4.339 4.227 4.472 . 0 0 "[ . 1 . 2]" 1
68 1 28 ALA MB 2 17 TYR QD 3.230 . 4.660 2.678 2.131 3.203 . 0 0 "[ . 1 . 2]" 1
69 1 28 ALA MB 2 17 TYR QE 3.080 . 4.360 1.967 1.663 2.430 0.137 16 0 "[ . 1 . 2]" 1
70 1 30 HIS H 1 31 VAL H 2.330 . 2.860 2.413 2.125 2.672 . 0 0 "[ . 1 . 2]" 1
71 1 30 HIS H 1 32 PHE H 3.090 . 4.380 4.018 3.542 4.426 0.046 16 0 "[ . 1 . 2]" 1
72 1 31 VAL H 1 32 PHE H 2.360 . 2.920 2.575 2.406 2.835 . 0 0 "[ . 1 . 2]" 1
73 1 31 VAL H 1 33 GLN H 3.240 . 4.680 4.146 3.864 4.448 . 0 0 "[ . 1 . 2]" 1
74 1 31 VAL H 1 34 LYS H 3.430 . 5.060 4.793 4.437 5.146 0.086 15 0 "[ . 1 . 2]" 1
75 1 31 VAL QG 1 32 PHE H 2.420 . 3.040 2.741 2.319 3.492 0.452 1 0 "[ . 1 . 2]" 1
76 1 31 VAL QG 1 36 TRP HE3 2.340 . 2.880 2.430 1.965 3.684 0.804 15 1 "[ . 1 + 2]" 1
77 1 31 VAL QG 1 36 TRP HZ3 2.930 . 4.060 2.244 2.031 2.656 . 0 0 "[ . 1 . 2]" 1
78 1 32 PHE H 1 33 GLN H 2.340 . 2.880 2.591 2.244 2.778 . 0 0 "[ . 1 . 2]" 1
79 1 32 PHE H 1 34 LYS H 3.180 . 4.560 4.075 3.703 4.479 . 0 0 "[ . 1 . 2]" 1
80 1 32 PHE QD 1 33 GLN H 3.270 . 4.740 3.849 3.026 4.628 . 0 0 "[ . 1 . 2]" 1
81 1 33 GLN H 1 34 LYS H 2.120 . 2.440 2.377 2.221 2.570 0.130 6 0 "[ . 1 . 2]" 1
82 1 34 LYS H 1 35 ASP H 3.340 . 4.880 4.609 4.580 4.646 . 0 0 "[ . 1 . 2]" 1
83 1 35 ASP H 1 36 TRP H 3.330 . 4.860 4.578 4.451 4.660 . 0 0 "[ . 1 . 2]" 1
84 1 35 ASP H 1 68 LEU QD 3.340 . 4.880 4.114 3.274 5.587 0.707 1 2 "[+ . -1 . 2]" 1
85 1 36 TRP H 1 37 GLN H 2.890 . 3.980 4.035 3.737 4.206 0.226 6 0 "[ . 1 . 2]" 1
86 1 36 TRP HE3 1 37 GLN H 2.960 . 4.120 4.355 3.884 4.666 0.546 6 2 "[ .+ - 1 . 2]" 1
87 1 36 TRP HE3 1 68 LEU QD 3.360 . 4.920 3.894 2.103 6.840 1.920 1 4 "[+ - * *1 . 2]" 1
88 1 36 TRP HE3 1 73 ALA MB 3.410 . 5.020 3.822 3.529 4.073 . 0 0 "[ . 1 . 2]" 1
89 1 36 TRP HZ3 1 68 LEU QD 3.320 . 4.840 4.296 2.353 7.271 2.431 1 6 "[+ * *-*1 .* 2]" 1
90 1 36 TRP HZ3 1 73 ALA MB 2.380 . 2.960 2.071 1.783 2.342 0.017 8 0 "[ . 1 . 2]" 1
91 1 36 TRP HZ3 1 123 PHE QE 3.090 . 4.380 3.184 2.727 3.974 . 0 0 "[ . 1 . 2]" 1
92 1 37 GLN H 1 68 LEU QD 3.300 . 4.480 2.775 1.670 4.487 0.130 16 0 "[ . 1 . 2]" 1
93 1 39 GLU H 1 40 VAL H 2.940 . 4.080 4.158 3.894 4.366 0.286 14 0 "[ . 1 . 2]" 1
94 1 39 GLU H 1 66 ALA MB 2.800 . 3.800 4.164 3.403 4.966 1.166 6 9 "[ * *+*- * *** 2]" 1
95 1 39 GLU H 1 67 SER H 2.010 . 2.220 2.652 1.791 3.524 1.304 2 11 "[*+ **** * **-* 2]" 1
96 1 39 GLU H 1 68 LEU H 3.460 . 5.120 4.575 3.891 5.116 . 0 0 "[ . 1 . 2]" 1
97 1 40 VAL H 1 41 LYS H 3.190 . 4.580 4.238 4.074 4.521 . 0 0 "[ . 1 . 2]" 1
98 1 40 VAL MG1 1 41 LYS H 3.470 . 5.140 3.991 3.193 4.353 . 0 0 "[ . 1 . 2]" 1
99 1 41 LYS H 1 42 LEU H 3.120 . 4.440 4.386 4.156 4.615 0.175 17 0 "[ . 1 . 2]" 1
100 1 41 LYS H 1 64 VAL QG 3.100 . 4.400 4.299 3.739 4.915 0.515 7 1 "[ . + 1 . 2]" 1
101 1 41 LYS H 1 65 THR H 2.670 . 3.540 3.443 2.885 3.855 0.315 18 0 "[ . 1 . 2]" 1
102 1 42 LEU H 1 43 ASP H 3.290 . 4.780 4.295 4.039 4.535 . 0 0 "[ . 1 . 2]" 1
103 1 42 LEU QD 1 43 ASP H 2.640 . 3.480 2.473 1.927 3.081 . 0 0 "[ . 1 . 2]" 1
104 1 42 LEU QD 1 62 VAL QG 2.990 . 4.180 2.153 1.741 3.285 0.059 1 0 "[ . 1 . 2]" 1
105 1 42 LEU QD 1 64 VAL QG 2.690 . 3.580 1.983 1.832 2.167 . 0 0 "[ . 1 . 2]" 1
106 1 42 LEU QD 1 128 LEU MD1 3.510 . 5.220 2.403 1.772 3.693 0.028 16 0 "[ . 1 . 2]" 1
107 1 42 LEU QD 1 128 LEU MD2 3.390 . 4.980 2.728 1.802 3.713 . 0 0 "[ . 1 . 2]" 1
108 1 42 LEU QD 1 129 ALA H 3.010 . 4.220 4.364 3.601 5.202 0.982 3 5 "[ *+ . *1 * . - 2]" 1
109 1 42 LEU QD 1 131 VAL QG 3.350 . 4.900 3.369 2.488 4.359 . 0 0 "[ . 1 . 2]" 1
110 1 43 ASP H 1 44 LEU H 3.110 . 4.410 4.320 4.023 4.461 0.051 3 0 "[ . 1 . 2]" 1
111 1 43 ASP H 1 62 VAL QG 3.490 . 5.180 4.440 3.657 5.588 0.408 19 0 "[ . 1 . 2]" 1
112 1 43 ASP H 1 63 THR H 2.730 . 3.660 3.328 2.685 3.884 0.224 2 0 "[ . 1 . 2]" 1
113 1 43 ASP H 1 64 VAL QG 3.330 . 4.860 4.285 3.818 4.643 . 0 0 "[ . 1 . 2]" 1
114 1 44 LEU H 1 45 ASP H 3.280 . 4.760 4.357 4.084 4.572 . 0 0 "[ . 1 . 2]" 1
115 1 44 LEU QD 1 45 ASP H 2.270 . 2.740 3.299 1.719 4.021 1.281 15 13 "[* * . ** *** *+*- **]" 1
116 1 44 LEU QD 1 46 THR H 3.220 . 4.640 5.284 3.003 6.518 1.878 15 12 "[* . ** **- *+** **]" 1
117 1 44 LEU QD 1 60 LEU QD 3.140 . 4.480 2.294 1.727 3.138 0.073 17 0 "[ . 1 . 2]" 1
118 1 44 LEU QD 1 133 PHE QE 3.290 . 4.410 2.190 1.598 2.932 0.202 4 0 "[ . 1 . 2]" 1
119 1 45 ASP H 1 46 THR H 3.020 . 4.240 4.311 4.104 4.446 0.206 8 0 "[ . 1 . 2]" 1
120 1 45 ASP H 1 61 ARG H 3.000 . 4.200 3.564 3.178 4.021 . 0 0 "[ . 1 . 2]" 1
121 1 46 THR H 1 47 ALA H 3.220 . 4.640 4.320 4.195 4.435 . 0 0 "[ . 1 . 2]" 1
122 1 47 ALA H 1 48 SER H 3.190 . 4.580 4.351 3.999 4.440 . 0 0 "[ . 1 . 2]" 1
123 1 47 ALA H 1 58 VAL QG 3.040 . 4.280 3.641 3.034 4.661 0.381 15 0 "[ . 1 . 2]" 1
124 1 47 ALA H 1 59 VAL H 2.950 . 4.100 3.078 2.701 3.408 . 0 0 "[ . 1 . 2]" 1
125 1 47 ALA H 1 61 ARG H 3.130 . 4.460 4.401 4.073 4.916 0.456 10 0 "[ . 1 . 2]" 1
126 1 47 ALA MB 1 48 SER H 2.800 . 3.800 2.859 2.619 3.426 . 0 0 "[ . 1 . 2]" 1
127 1 47 ALA MB 1 59 VAL H 3.470 . 5.140 3.544 3.105 4.103 . 0 0 "[ . 1 . 2]" 1
128 1 48 SER H 1 49 SER H 3.260 . 4.720 4.500 4.427 4.599 . 0 0 "[ . 1 . 2]" 1
129 1 49 SER H 1 50 GLN H 3.070 . 4.340 4.163 4.019 4.337 . 0 0 "[ . 1 . 2]" 1
130 1 49 SER H 1 57 GLU H 2.850 . 3.900 3.129 2.622 3.851 . 0 0 "[ . 1 . 2]" 1
131 1 49 SER H 1 58 VAL QG 3.340 . 4.880 4.034 3.281 4.348 . 0 0 "[ . 1 . 2]" 1
132 1 50 GLN H 1 51 LEU H 3.230 . 4.660 4.361 4.212 4.569 . 0 0 "[ . 1 . 2]" 1
133 1 50 GLN H 1 57 GLU H 3.420 . 5.040 4.996 4.719 5.155 0.115 20 0 "[ . 1 . 2]" 1
134 1 51 LEU H 1 52 ALA H 1.920 . 2.040 2.240 1.869 2.423 0.383 18 0 "[ . 1 . 2]" 1
135 1 51 LEU H 1 55 VAL H 3.290 . 4.780 4.828 4.450 5.064 0.284 11 0 "[ . 1 . 2]" 1
136 1 51 LEU H 1 55 VAL MG1 3.320 . 4.840 3.572 3.262 3.938 . 0 0 "[ . 1 . 2]" 1
137 1 51 LEU H 1 57 GLU H 3.050 . 4.300 3.792 3.197 4.350 0.050 14 0 "[ . 1 . 2]" 1
138 1 51 LEU MD1 1 55 VAL MG1 3.250 . 4.700 2.380 2.118 2.648 . 0 0 "[ . 1 . 2]" 1
139 1 51 LEU MD1 1 57 GLU H 3.140 . 4.480 3.814 3.367 4.415 . 0 0 "[ . 1 . 2]" 1
140 1 52 ALA H 1 53 ASP H 3.200 . 4.600 4.350 4.319 4.381 . 0 0 "[ . 1 . 2]" 1
141 1 52 ALA H 1 55 VAL H 2.850 . 3.900 3.505 3.318 3.628 . 0 0 "[ . 1 . 2]" 1
142 1 52 ALA H 1 55 VAL MG1 3.010 . 4.220 3.391 3.080 3.704 . 0 0 "[ . 1 . 2]" 1
143 1 52 ALA H 1 55 VAL MG2 3.360 . 4.920 3.996 3.616 4.330 . 0 0 "[ . 1 . 2]" 1
144 1 52 ALA MB 1 53 ASP H 2.490 . 3.180 2.134 1.913 2.481 . 0 0 "[ . 1 . 2]" 1
145 1 52 ALA MB 1 55 VAL MG1 3.340 . 4.880 3.086 2.910 3.315 . 0 0 "[ . 1 . 2]" 1
146 1 52 ALA MB 1 55 VAL MG2 2.980 . 4.160 2.165 1.909 2.572 . 0 0 "[ . 1 . 2]" 1
147 1 53 ASP H 1 54 ASP H 3.290 . 4.780 4.465 4.317 4.567 . 0 0 "[ . 1 . 2]" 1
148 1 53 ASP H 1 55 VAL H 3.370 . 4.940 4.209 4.044 4.458 . 0 0 "[ . 1 . 2]" 1
149 1 53 ASP H 1 55 VAL MG2 3.490 . 5.180 4.119 3.674 4.528 . 0 0 "[ . 1 . 2]" 1
150 1 54 ASP H 1 55 VAL H 2.360 . 2.920 2.724 2.612 2.954 0.034 16 0 "[ . 1 . 2]" 1
151 1 54 ASP H 1 56 TYR QE 3.330 . 4.860 4.673 2.005 7.922 3.062 13 7 "[* *. *1* +*. - 2]" 1
152 1 55 VAL H 1 56 TYR H 2.850 . 3.900 4.220 4.032 4.345 0.445 9 0 "[ . 1 . 2]" 1
153 1 55 VAL H 1 56 TYR QD 3.200 . 4.600 4.338 3.258 5.485 0.885 4 2 "[ +. 1 . - 2]" 1
154 1 55 VAL H 1 56 TYR QE 3.230 . 4.660 5.179 3.394 7.615 2.955 4 10 "[**-+. *1* **. * *]" 1
155 1 55 VAL MG1 1 56 TYR H 3.150 . 4.500 2.991 2.815 3.194 . 0 0 "[ . 1 . 2]" 1
156 1 56 TYR H 1 57 GLU H 3.220 . 4.640 4.318 4.125 4.461 . 0 0 "[ . 1 . 2]" 1
157 1 56 TYR H 1 84 PHE H 3.040 . 4.280 3.561 3.131 3.944 . 0 0 "[ . 1 . 2]" 1
158 1 56 TYR H 1 86 ILE H 2.870 . 3.940 3.779 3.131 4.824 0.884 9 1 "[ . +1 . 2]" 1
159 1 56 TYR QD 1 57 GLU H 3.370 . 4.940 3.693 2.811 4.390 . 0 0 "[ . 1 . 2]" 1
160 1 57 GLU H 1 58 VAL H 3.180 . 4.560 4.380 4.123 4.530 . 0 0 "[ . 1 . 2]" 1
161 1 58 VAL H 1 59 VAL H 3.140 . 4.480 4.359 4.188 4.461 . 0 0 "[ . 1 . 2]" 1
162 1 58 VAL H 1 82 GLY H 2.740 . 3.680 3.253 2.832 3.590 . 0 0 "[ . 1 . 2]" 1
163 1 58 VAL H 1 84 PHE H 2.810 . 3.820 4.314 3.787 4.802 0.982 5 10 "[* +* *1 - ** * **]" 1
164 1 58 VAL H 1 84 PHE QD 3.230 . 4.660 2.756 2.369 3.179 . 0 0 "[ . 1 . 2]" 1
165 1 58 VAL H 1 84 PHE QE 3.300 . 4.800 2.956 2.292 3.798 . 0 0 "[ . 1 . 2]" 1
166 1 58 VAL QG 1 59 VAL H 2.890 . 3.980 2.869 2.314 3.590 . 0 0 "[ . 1 . 2]" 1
167 1 59 VAL H 1 60 LEU H 3.260 . 4.720 4.177 4.085 4.355 . 0 0 "[ . 1 . 2]" 1
168 1 59 VAL H 1 82 GLY H 3.320 . 4.830 5.150 4.862 5.598 0.768 8 4 "[ * +-1 . *2]" 1
169 1 59 VAL MG1 1 60 LEU H 2.600 . 3.400 3.187 2.945 3.336 . 0 0 "[ . 1 . 2]" 1
170 1 59 VAL MG1 1 80 GLN H 2.820 . 3.840 3.824 3.413 4.254 0.414 20 0 "[ . 1 . 2]" 1
171 1 59 VAL MG1 1 81 GLY H 2.970 . 4.140 3.995 3.366 4.827 0.687 8 1 "[ . + 1 . 2]" 1
172 1 59 VAL MG2 1 60 LEU H 3.450 . 5.100 4.302 4.206 4.383 . 0 0 "[ . 1 . 2]" 1
173 1 59 VAL MG2 1 81 GLY H 3.290 . 4.780 4.634 4.230 5.270 0.490 8 0 "[ . 1 . 2]" 1
174 1 59 VAL MG2 1 82 GLY H 2.890 . 3.990 3.836 3.303 4.398 0.408 8 0 "[ . 1 . 2]" 1
175 1 60 LEU H 1 61 ARG H 3.180 . 4.560 4.180 4.087 4.351 . 0 0 "[ . 1 . 2]" 1
176 1 60 LEU H 1 80 GLN H 2.950 . 4.100 3.876 3.521 4.224 0.124 17 0 "[ . 1 . 2]" 1
177 1 60 LEU H 1 82 GLY H 3.500 . 5.200 4.970 4.612 5.493 0.293 5 0 "[ . 1 . 2]" 1
178 1 60 LEU QD 1 61 ARG H 3.370 . 4.940 3.070 2.703 3.446 . 0 0 "[ . 1 . 2]" 1
179 1 60 LEU QD 1 62 VAL QG 2.380 . 2.960 2.328 1.680 3.198 0.238 4 0 "[ . 1 . 2]" 1
180 1 60 LEU QD 1 110 ALA MB 2.780 . 3.760 2.778 2.221 3.697 . 0 0 "[ . 1 . 2]" 1
181 1 60 LEU QD 1 133 PHE QE 3.090 . 4.380 2.866 2.591 3.412 . 0 0 "[ . 1 . 2]" 1
182 1 61 ARG H 1 62 VAL H 3.200 . 4.600 4.266 4.160 4.439 . 0 0 "[ . 1 . 2]" 1
183 1 62 VAL H 1 63 THR H 3.090 . 4.380 4.259 3.953 4.465 0.085 19 0 "[ . 1 . 2]" 1
184 1 62 VAL H 1 78 VAL H 2.880 . 3.960 3.273 3.075 3.624 . 0 0 "[ . 1 . 2]" 1
185 1 62 VAL H 1 80 GLN H 3.320 . 4.840 3.949 3.630 4.506 . 0 0 "[ . 1 . 2]" 1
186 1 62 VAL QG 1 63 THR H 2.960 . 4.120 3.151 2.401 3.699 . 0 0 "[ . 1 . 2]" 1
187 1 62 VAL QG 1 64 VAL QG 2.780 . 3.760 2.822 2.211 4.202 0.442 5 0 "[ . 1 . 2]" 1
188 1 62 VAL QG 1 110 ALA MB 3.050 . 4.300 1.978 1.574 2.676 0.226 14 0 "[ . 1 . 2]" 1
189 1 62 VAL QG 1 128 LEU MD1 3.340 . 4.880 3.276 1.817 4.168 . 0 0 "[ . 1 . 2]" 1
190 1 62 VAL QG 1 128 LEU MD2 2.820 . 3.840 3.214 2.007 4.563 0.723 14 1 "[ . 1 +. 2]" 1
191 1 63 THR H 1 64 VAL H 3.260 . 4.720 4.328 4.199 4.512 . 0 0 "[ . 1 . 2]" 1
192 1 63 THR H 1 64 VAL QG 3.470 . 5.140 4.268 3.800 4.515 . 0 0 "[ . 1 . 2]" 1
193 1 64 VAL H 1 65 THR H 2.970 . 4.140 4.237 3.965 4.474 0.334 1 0 "[ . 1 . 2]" 1
194 1 64 VAL H 1 75 LEU MD1 3.230 . 4.660 3.365 3.015 3.827 . 0 0 "[ . 1 . 2]" 1
195 1 64 VAL H 1 76 CYS H 3.000 . 4.200 3.309 2.890 3.676 . 0 0 "[ . 1 . 2]" 1
196 1 64 VAL QG 1 65 THR H 2.920 . 4.040 2.915 2.602 3.124 . 0 0 "[ . 1 . 2]" 1
197 1 64 VAL QG 1 66 ALA H 3.500 . 5.200 3.634 3.244 4.400 . 0 0 "[ . 1 . 2]" 1
198 1 64 VAL QG 1 126 LEU MD1 3.060 . 4.320 3.270 2.595 3.677 . 0 0 "[ . 1 . 2]" 1
199 1 64 VAL QG 1 126 LEU MD2 2.660 . 3.520 1.816 1.720 1.915 0.080 10 0 "[ . 1 . 2]" 1
200 1 65 THR H 1 66 ALA H 3.130 . 4.460 4.198 4.008 4.365 . 0 0 "[ . 1 . 2]" 1
201 1 66 ALA H 1 67 SER H 3.090 . 4.380 4.178 3.950 4.456 0.076 13 0 "[ . 1 . 2]" 1
202 1 66 ALA H 1 73 ALA H 3.340 . 4.880 4.645 4.247 5.037 0.157 14 0 "[ . 1 . 2]" 1
203 1 66 ALA H 1 74 PHE H 2.740 . 3.680 3.503 3.222 3.778 0.098 14 0 "[ . 1 . 2]" 1
204 1 66 ALA H 1 74 PHE QD 3.290 . 4.780 4.376 3.948 4.647 . 0 0 "[ . 1 . 2]" 1
205 1 66 ALA H 1 74 PHE QE 3.320 . 4.830 4.699 4.230 5.068 0.238 11 0 "[ . 1 . 2]" 1
206 1 66 ALA H 1 76 CYS H 3.210 . 4.620 4.920 4.408 5.324 0.704 4 7 "[** +. *1 * .- *2]" 1
207 1 66 ALA MB 1 67 SER H 3.040 . 4.280 3.366 3.033 3.501 . 0 0 "[ . 1 . 2]" 1
208 1 66 ALA MB 1 73 ALA H 3.480 . 5.160 3.877 3.045 4.310 . 0 0 "[ . 1 . 2]" 1
209 1 66 ALA MB 1 73 ALA MB 3.130 . 4.460 2.591 2.057 3.112 . 0 0 "[ . 1 . 2]" 1
210 1 66 ALA MB 1 74 PHE H 3.150 . 4.500 2.810 1.959 3.325 . 0 0 "[ . 1 . 2]" 1
211 1 66 ALA MB 1 74 PHE QD 3.230 . 4.660 3.208 3.061 3.439 . 0 0 "[ . 1 . 2]" 1
212 1 66 ALA MB 1 74 PHE QE 2.710 . 3.620 2.857 2.692 2.980 . 0 0 "[ . 1 . 2]" 1
213 1 67 SER H 1 68 LEU H 3.240 . 4.680 4.321 4.157 4.489 . 0 0 "[ . 1 . 2]" 1
214 1 67 SER H 1 73 ALA H 3.170 . 4.540 4.507 4.186 4.858 0.318 2 0 "[ . 1 . 2]" 1
215 1 68 LEU H 1 69 GLY H 2.830 . 3.860 3.832 3.333 4.034 0.174 19 0 "[ . 1 . 2]" 1
216 1 68 LEU H 1 70 GLU H 3.400 . 5.000 5.446 4.849 5.976 0.976 13 8 "[ * .* -* *+ . * *]" 1
217 1 68 LEU H 1 71 GLU H 2.960 . 4.120 4.212 3.941 4.647 0.527 20 1 "[ . 1 . +]" 1
218 1 68 LEU H 1 72 THR H 3.480 . 5.160 4.958 4.646 5.528 0.368 7 0 "[ . 1 . 2]" 1
219 1 68 LEU H 1 73 ALA H 2.810 . 3.820 3.459 2.657 3.926 0.106 7 0 "[ . 1 . 2]" 1
220 1 68 LEU H 1 73 ALA MB 3.450 . 5.100 3.716 2.965 4.136 . 0 0 "[ . 1 . 2]" 1
221 1 68 LEU QD 1 71 GLU H 3.380 . 4.960 4.448 3.414 5.440 0.480 2 0 "[ . 1 . 2]" 1
222 1 68 LEU QD 1 73 ALA H 3.180 . 4.560 4.032 2.601 6.559 1.999 7 6 "[* - +**1 .* 2]" 1
223 1 68 LEU QD 1 73 ALA MB 2.960 . 4.120 2.959 1.671 5.393 1.273 1 5 "[+ - * *1 .* 2]" 1
224 1 69 GLY H 1 70 GLU H 3.020 . 4.240 4.306 4.012 4.531 0.291 12 0 "[ . 1 . 2]" 1
225 1 69 GLY H 1 71 GLU H 3.400 . 5.000 4.751 4.233 5.066 0.066 18 0 "[ . 1 . 2]" 1
226 1 70 GLU H 1 71 GLU H 1.900 . 2.000 2.145 1.903 2.555 0.555 13 1 "[ . 1 + . 2]" 1
227 1 71 GLU H 1 72 THR H 3.270 . 4.740 4.349 4.007 4.580 . 0 0 "[ . 1 . 2]" 1
228 1 72 THR H 1 73 ALA H 3.280 . 4.760 4.510 4.348 4.609 . 0 0 "[ . 1 . 2]" 1
229 1 73 ALA H 1 74 PHE H 2.220 . 2.640 2.566 2.357 2.796 0.156 16 0 "[ . 1 . 2]" 1
230 1 73 ALA MB 1 74 PHE H 2.580 . 3.360 2.141 2.029 2.247 . 0 0 "[ . 1 . 2]" 1
231 1 73 ALA MB 1 74 PHE QD 3.350 . 4.900 2.542 2.175 2.784 . 0 0 "[ . 1 . 2]" 1
232 1 73 ALA MB 1 123 PHE QE 3.470 . 5.140 3.084 2.402 3.895 . 0 0 "[ . 1 . 2]" 1
233 1 74 PHE H 1 75 LEU H 3.090 . 4.380 4.329 4.260 4.371 . 0 0 "[ . 1 . 2]" 1
234 1 74 PHE QD 1 75 LEU H 3.210 . 4.620 3.416 2.815 3.727 . 0 0 "[ . 1 . 2]" 1
235 1 74 PHE QD 1 123 PHE QD 3.140 . 4.480 3.165 2.890 3.438 . 0 0 "[ . 1 . 2]" 1
236 1 74 PHE QD 1 123 PHE QE 2.850 . 3.900 3.588 3.151 3.997 0.097 12 0 "[ . 1 . 2]" 1
237 1 74 PHE QE 1 118 VAL MG1 3.160 . 4.520 3.176 2.558 4.448 . 0 0 "[ . 1 . 2]" 1
238 1 74 PHE QE 1 123 PHE QD 3.270 . 4.740 3.956 3.545 4.420 . 0 0 "[ . 1 . 2]" 1
239 1 74 PHE QE 1 126 LEU MD2 3.120 . 4.440 2.489 2.033 3.100 . 0 0 "[ . 1 . 2]" 1
240 1 75 LEU H 1 76 CYS H 3.160 . 4.520 4.205 3.898 4.389 . 0 0 "[ . 1 . 2]" 1
241 1 75 LEU MD1 1 76 CYS H 2.680 . 3.570 2.483 1.993 3.043 . 0 0 "[ . 1 . 2]" 1
242 1 76 CYS H 1 77 GLU H 3.230 . 4.660 4.110 3.831 4.348 . 0 0 "[ . 1 . 2]" 1
243 1 77 GLU H 1 78 VAL H 3.030 . 4.260 4.195 4.059 4.314 0.054 1 0 "[ . 1 . 2]" 1
244 1 77 GLU H 1 78 VAL MG2 3.100 . 4.400 3.454 3.171 3.588 . 0 0 "[ . 1 . 2]" 1
245 1 78 VAL H 1 79 GLN H 3.190 . 4.580 4.066 3.952 4.321 . 0 0 "[ . 1 . 2]" 1
246 1 78 VAL MG1 1 79 GLN H 2.540 . 3.280 3.118 2.612 3.276 . 0 0 "[ . 1 . 2]" 1
247 1 78 VAL MG1 1 80 GLN H 3.050 . 4.300 2.831 2.541 3.216 . 0 0 "[ . 1 . 2]" 1
248 1 78 VAL MG2 1 79 GLN H 3.430 . 5.060 4.131 3.957 4.255 . 0 0 "[ . 1 . 2]" 1
249 1 78 VAL MG2 1 114 ILE H 3.450 . 5.100 3.309 2.987 3.659 . 0 0 "[ . 1 . 2]" 1
250 1 79 GLN H 1 80 GLN H 2.910 . 4.020 3.925 3.766 4.084 0.064 11 0 "[ . 1 . 2]" 1
251 1 80 GLN H 1 81 GLY H 3.140 . 4.480 4.297 4.161 4.458 . 0 0 "[ . 1 . 2]" 1
252 1 80 GLN H 1 110 ALA MB 3.260 . 4.720 3.616 3.527 3.794 . 0 0 "[ . 1 . 2]" 1
253 1 81 GLY H 1 82 GLY H 3.300 . 4.800 4.526 4.446 4.577 . 0 0 "[ . 1 . 2]" 1
254 1 82 GLY H 1 83 ILE H 3.080 . 4.360 4.136 3.943 4.334 . 0 0 "[ . 1 . 2]" 1
255 1 82 GLY H 1 84 PHE QE 3.500 . 5.200 3.787 3.245 4.277 . 0 0 "[ . 1 . 2]" 1
256 1 83 ILE H 1 84 PHE H 3.220 . 4.640 4.436 4.365 4.524 . 0 0 "[ . 1 . 2]" 1
257 1 84 PHE H 1 85 SER H 3.260 . 4.720 4.214 4.102 4.362 . 0 0 "[ . 1 . 2]" 1
258 1 84 PHE QD 1 85 SER H 3.340 . 4.880 4.358 4.178 4.679 . 0 0 "[ . 1 . 2]" 1
259 1 85 SER H 1 86 ILE H 3.020 . 4.240 4.259 3.997 4.446 0.206 20 0 "[ . 1 . 2]" 1
260 1 86 ILE H 1 87 ALA H 3.280 . 4.760 4.471 4.380 4.549 . 0 0 "[ . 1 . 2]" 1
261 1 87 ALA H 1 88 GLY H 3.050 . 4.300 4.316 4.133 4.415 0.115 8 0 "[ . 1 . 2]" 1
262 1 87 ALA H 1 89 ILE H 2.990 . 4.180 4.313 3.692 4.922 0.742 12 3 "[ . * 1 + . -2]" 1
263 1 87 ALA MB 1 88 GLY H 2.820 . 3.840 2.612 2.163 3.011 . 0 0 "[ . 1 . 2]" 1
264 1 88 GLY H 1 89 ILE H 2.100 . 2.400 2.667 2.404 2.927 0.527 10 2 "[- . + . 2]" 1
265 1 89 ILE H 1 90 GLU H 3.260 . 4.720 4.457 4.388 4.533 . 0 0 "[ . 1 . 2]" 1
266 1 90 GLU H 1 91 GLY H 3.190 . 4.580 4.397 4.349 4.458 . 0 0 "[ . 1 . 2]" 1
267 1 90 GLU H 1 94 MET H 2.660 . 3.520 3.683 3.110 4.261 0.741 3 2 "[ + . 1 - . 2]" 1
268 1 91 GLY H 1 92 THR H 3.320 . 4.840 4.569 4.464 4.666 . 0 0 "[ . 1 . 2]" 1
269 1 91 GLY H 1 94 MET H 3.440 . 5.080 4.155 3.771 4.699 . 0 0 "[ . 1 . 2]" 1
270 1 91 GLY H 1 94 MET ME 3.120 . 4.440 3.357 2.207 6.032 1.592 4 1 "[ +. 1 . 2]" 1
271 1 92 THR H 1 93 GLN H 2.150 . 2.500 2.509 2.382 2.603 0.103 13 0 "[ . 1 . 2]" 1
272 1 92 THR H 1 94 MET H 3.250 . 4.700 4.323 4.026 4.561 . 0 0 "[ . 1 . 2]" 1
273 1 93 GLN H 1 94 MET H 2.450 . 3.100 2.624 2.533 2.718 . 0 0 "[ . 1 . 2]" 1
274 1 93 GLN H 1 95 ALA H 3.040 . 4.280 3.883 3.623 4.420 0.140 13 0 "[ . 1 . 2]" 1
275 1 93 GLN H 1 96 HIS H 3.470 . 5.140 4.606 4.401 4.807 . 0 0 "[ . 1 . 2]" 1
276 1 94 MET H 1 95 ALA H 2.360 . 2.920 2.560 2.425 2.748 . 0 0 "[ . 1 . 2]" 1
277 1 94 MET H 1 96 HIS H 3.140 . 4.480 3.980 3.641 4.259 . 0 0 "[ . 1 . 2]" 1
278 1 94 MET H 1 97 CYS H 3.400 . 5.000 4.709 4.487 4.962 . 0 0 "[ . 1 . 2]" 1
279 1 94 MET ME 1 98 LEU QD 3.460 . 5.120 3.695 2.090 5.779 0.659 17 1 "[ . 1 . + 2]" 1
280 1 95 ALA H 1 96 HIS H 2.270 . 2.740 2.605 2.485 2.772 0.032 15 0 "[ . 1 . 2]" 1
281 1 95 ALA H 1 97 CYS H 3.040 . 4.280 4.022 3.821 4.300 0.020 15 0 "[ . 1 . 2]" 1
282 1 95 ALA H 1 98 LEU H 3.390 . 4.980 4.942 4.530 5.402 0.422 8 0 "[ . 1 . 2]" 1
283 1 95 ALA H 1 98 LEU QD 3.410 . 5.020 4.528 3.772 6.281 1.261 13 2 "[ .- 1 + . 2]" 1
284 1 95 ALA MB 1 96 HIS H 2.690 . 3.580 2.730 2.586 2.857 . 0 0 "[ . 1 . 2]" 1
285 1 95 ALA MB 1 137 PHE QE 2.870 . 3.940 2.932 2.402 3.561 . 0 0 "[ . 1 . 2]" 1
286 1 96 HIS H 1 97 CYS H 2.180 . 2.560 2.580 2.422 2.703 0.143 20 0 "[ . 1 . 2]" 1
287 1 96 HIS H 1 98 LEU H 2.930 . 4.060 4.317 3.817 4.754 0.694 1 3 "[+ . * 1 -. 2]" 1
288 1 96 HIS H 1 99 GLY H 3.200 . 4.600 4.654 4.262 4.887 0.287 9 0 "[ . 1 . 2]" 1
289 1 96 HIS H 1 137 PHE QE 2.950 . 4.100 3.820 3.476 4.094 . 0 0 "[ . 1 . 2]" 1
290 1 97 CYS H 1 98 LEU H 2.240 . 2.680 2.731 2.509 3.008 0.328 1 0 "[ . 1 . 2]" 1
291 1 97 CYS H 1 99 GLY H 2.850 . 3.900 3.958 3.598 4.397 0.497 10 0 "[ . 1 . 2]" 1
292 1 97 CYS H 1 100 ALA H 3.450 . 5.100 4.976 4.801 5.174 0.074 9 0 "[ . 1 . 2]" 1
293 1 97 CYS H 1 101 TYR H 3.490 . 5.180 4.872 4.671 5.182 0.002 17 0 "[ . 1 . 2]" 1
294 1 98 LEU H 1 99 GLY H 2.030 . 2.260 2.479 2.211 2.713 0.453 10 0 "[ . 1 . 2]" 1
295 1 98 LEU H 1 100 ALA H 2.900 . 4.000 4.154 3.711 4.484 0.484 17 0 "[ . 1 . 2]" 1
296 1 98 LEU H 1 101 TYR H 3.370 . 4.940 4.937 4.346 5.431 0.491 17 0 "[ . 1 . 2]" 1
297 1 98 LEU H 1 102 CYS H 3.340 . 4.880 4.999 4.805 5.151 0.271 19 0 "[ . 1 . 2]" 1
298 1 98 LEU QD 1 99 GLY H 3.220 . 4.640 3.175 2.250 4.207 . 0 0 "[ . 1 . 2]" 1
299 1 99 GLY H 1 100 ALA H 2.050 . 2.310 2.429 2.301 2.660 0.350 17 0 "[ . 1 . 2]" 1
300 1 99 GLY H 1 100 ALA MB 3.370 . 4.940 4.081 3.879 4.684 . 0 0 "[ . 1 . 2]" 1
301 1 99 GLY H 1 101 TYR H 2.980 . 4.160 4.133 3.950 4.316 0.156 6 0 "[ . 1 . 2]" 1
302 1 99 GLY H 1 102 CYS H 3.130 . 4.460 4.976 4.579 5.468 1.008 6 12 "[ * -+* ** ** * ***2]" 1
303 1 100 ALA H 1 101 TYR H 2.090 . 2.380 2.227 1.886 2.376 . 0 0 "[ . 1 . 2]" 1
304 1 100 ALA H 1 102 CYS H 2.460 . 3.120 3.626 3.235 4.203 1.083 10 10 "[ * -* * + ** * * *2]" 1
305 1 100 ALA MB 1 101 TYR H 2.450 . 3.100 2.251 2.126 2.526 . 0 0 "[ . 1 . 2]" 1
306 1 100 ALA MB 1 133 PHE QD 3.410 . 5.020 4.490 3.971 5.000 . 0 0 "[ . 1 . 2]" 1
307 1 100 ALA MB 1 134 ASP H 3.130 . 4.460 3.294 2.849 3.526 . 0 0 "[ . 1 . 2]" 1
308 1 101 TYR H 1 102 CYS H 2.300 . 2.800 2.864 2.647 3.301 0.501 17 1 "[ . 1 . + 2]" 1
309 1 101 TYR QD 1 102 CYS H 3.110 . 4.420 3.120 2.798 3.918 . 0 0 "[ . 1 . 2]" 1
310 1 109 TYR H 1 110 ALA H 2.220 . 2.640 2.599 2.520 2.688 0.048 1 0 "[ . 1 . 2]" 1
311 1 109 TYR H 1 111 ARG H 3.010 . 4.220 4.021 3.884 4.131 . 0 0 "[ . 1 . 2]" 1
312 1 109 TYR QD 1 110 ALA H 3.460 . 5.120 4.137 3.914 4.300 . 0 0 "[ . 1 . 2]" 1
313 1 110 ALA H 1 111 ARG H 2.120 . 2.440 2.580 2.527 2.633 0.193 5 0 "[ . 1 . 2]" 1
314 1 110 ALA H 1 112 GLU H 3.020 . 4.240 4.189 4.044 4.337 0.097 9 0 "[ . 1 . 2]" 1
315 1 110 ALA MB 1 111 ARG H 2.680 . 3.570 2.565 2.475 2.671 . 0 0 "[ . 1 . 2]" 1
316 1 111 ARG H 1 112 GLU H 2.360 . 2.920 2.836 2.765 2.900 . 0 0 "[ . 1 . 2]" 1
317 1 111 ARG H 1 113 CYS H 3.220 . 4.640 4.287 4.202 4.364 . 0 0 "[ . 1 . 2]" 1
318 1 111 ARG H 1 114 ILE H 3.510 . 5.220 4.956 4.899 5.051 . 0 0 "[ . 1 . 2]" 1
319 1 112 GLU H 1 113 CYS H 2.300 . 2.800 2.715 2.636 2.797 . 0 0 "[ . 1 . 2]" 1
320 1 112 GLU H 1 114 ILE H 3.110 . 4.410 4.210 4.035 4.419 0.009 18 0 "[ . 1 . 2]" 1
321 1 112 GLU H 1 115 THR H 3.510 . 5.220 4.695 4.520 4.805 . 0 0 "[ . 1 . 2]" 1
322 1 112 GLU H 3 109 TYR QE 3.190 . 4.580 4.424 4.231 4.876 0.296 19 0 "[ . 1 . 2]" 1
323 1 113 CYS H 1 114 ILE H 2.350 . 2.900 2.709 2.589 2.846 . 0 0 "[ . 1 . 2]" 1
324 1 113 CYS H 1 115 THR H 3.340 . 4.880 4.227 4.027 4.406 . 0 0 "[ . 1 . 2]" 1
325 1 113 CYS H 1 116 SER H 3.390 . 4.980 4.865 4.740 5.016 0.036 9 0 "[ . 1 . 2]" 1
326 1 114 ILE H 1 115 THR H 2.420 . 3.040 2.608 2.359 2.815 . 0 0 "[ . 1 . 2]" 1
327 1 114 ILE H 1 116 SER H 3.100 . 4.400 4.111 3.910 4.306 . 0 0 "[ . 1 . 2]" 1
328 1 114 ILE H 1 117 MET H 3.280 . 4.760 4.771 4.508 5.035 0.275 19 0 "[ . 1 . 2]" 1
329 1 115 THR H 1 116 SER H 2.410 . 3.020 2.734 2.585 2.925 . 0 0 "[ . 1 . 2]" 1
330 1 115 THR H 1 117 MET H 3.170 . 4.540 4.225 3.861 4.472 . 0 0 "[ . 1 . 2]" 1
331 1 115 THR H 1 118 VAL H 3.370 . 4.940 4.895 4.768 5.064 0.124 20 0 "[ . 1 . 2]" 1
332 1 116 SER H 1 117 MET H 2.340 . 2.880 2.647 2.492 2.726 . 0 0 "[ . 1 . 2]" 1
333 1 116 SER H 1 118 VAL H 3.080 . 4.360 4.187 3.988 4.401 0.041 1 0 "[ . 1 . 2]" 1
334 1 116 SER H 1 119 SER H 3.450 . 5.100 4.817 4.712 4.956 . 0 0 "[ . 1 . 2]" 1
335 1 117 MET H 1 118 VAL H 2.320 . 2.840 2.722 2.590 2.835 . 0 0 "[ . 1 . 2]" 1
336 1 117 MET H 1 119 SER H 3.180 . 4.560 4.218 3.997 4.390 . 0 0 "[ . 1 . 2]" 1
337 1 117 MET ME 2 21 ILE H 3.520 . 5.240 5.580 4.648 6.668 1.428 8 7 "[ * .- + * * * *2]" 1
338 1 117 MET ME 2 117 MET ME 3.180 . 4.560 3.575 1.883 4.777 0.217 6 0 "[ . 1 . 2]" 1
339 1 118 VAL H 1 119 SER H 2.350 . 2.900 2.652 2.547 2.752 . 0 0 "[ . 1 . 2]" 1
340 1 118 VAL MG1 1 119 SER H 3.040 . 4.280 3.398 2.313 4.002 . 0 0 "[ . 1 . 2]" 1
341 1 118 VAL MG1 1 123 PHE H 3.220 . 4.640 3.956 3.479 5.287 0.647 1 2 "[+ . 1 . -]" 1
342 1 118 VAL MG1 1 123 PHE QD 3.040 . 4.280 3.645 3.185 5.160 0.880 14 2 "[ . - 1 +. 2]" 1
343 1 118 VAL MG1 1 126 LEU MD2 3.350 . 4.900 3.200 2.518 3.729 . 0 0 "[ . 1 . 2]" 1
344 1 118 VAL MG2 1 119 SER H 3.270 . 4.740 3.608 2.203 3.978 . 0 0 "[ . 1 . 2]" 1
345 1 118 VAL MG2 1 126 LEU MD2 2.560 . 3.320 2.568 1.792 3.773 0.453 4 0 "[ . 1 . 2]" 1
346 1 119 SER H 1 121 GLY H 3.140 . 4.480 3.961 3.785 4.090 . 0 0 "[ . 1 . 2]" 1
347 1 119 SER H 1 123 PHE H 3.440 . 5.080 5.105 4.651 5.314 0.234 14 0 "[ . 1 . 2]" 1
348 1 121 GLY H 1 122 THR H 2.440 . 3.080 2.588 2.497 2.844 . 0 0 "[ . 1 . 2]" 1
349 1 121 GLY H 1 123 PHE H 2.770 . 3.740 3.769 3.566 3.933 0.193 8 0 "[ . 1 . 2]" 1
350 1 121 GLY H 2 18 THR H 3.370 . 4.940 4.297 4.048 4.494 . 0 0 "[ . 1 . 2]" 1
351 1 122 THR H 1 123 PHE H 2.370 . 2.940 2.625 2.561 2.855 . 0 0 "[ . 1 . 2]" 1
352 1 122 THR H 2 18 THR H 3.050 . 4.300 4.325 3.952 4.510 0.210 2 0 "[ . 1 . 2]" 1
353 1 125 GLN H 1 126 LEU H 3.340 . 4.880 4.579 4.514 4.654 . 0 0 "[ . 1 . 2]" 1
354 1 126 LEU H 1 127 ASN H 2.850 . 3.900 4.094 3.937 4.420 0.520 9 1 "[ . +1 . 2]" 1
355 1 126 LEU MD1 1 127 ASN H 2.830 . 3.860 2.840 2.290 3.454 . 0 0 "[ . 1 . 2]" 1
356 1 126 LEU MD1 1 128 LEU H 3.360 . 4.920 3.707 2.572 4.344 . 0 0 "[ . 1 . 2]" 1
357 1 127 ASN H 1 128 LEU H 3.100 . 4.400 4.013 3.559 4.327 . 0 0 "[ . 1 . 2]" 1
358 1 128 LEU H 1 129 ALA H 3.270 . 4.740 4.587 4.473 4.648 . 0 0 "[ . 1 . 2]" 1
359 1 131 VAL H 1 133 PHE H 3.460 . 5.120 5.382 4.876 5.834 0.714 16 4 "[ * 1- .+ *2]" 1
360 1 131 VAL QG 1 133 PHE H 3.340 . 4.880 3.425 3.106 3.989 . 0 0 "[ . 1 . 2]" 1
361 1 131 VAL QG 1 136 LEU MD1 2.280 . 2.760 2.088 1.801 2.577 . 0 0 "[ . 1 . 2]" 1
362 1 131 VAL QG 1 136 LEU MD2 3.450 . 5.100 3.663 2.524 4.022 . 0 0 "[ . 1 . 2]" 1
363 1 133 PHE H 1 134 ASP H 2.360 . 2.920 2.700 2.591 2.833 . 0 0 "[ . 1 . 2]" 1
364 1 133 PHE H 1 135 ALA H 3.220 . 4.640 4.487 4.279 4.675 0.035 14 0 "[ . 1 . 2]" 1
365 1 133 PHE H 1 136 LEU H 3.480 . 5.160 4.926 4.764 5.167 0.007 19 0 "[ . 1 . 2]" 1
366 1 133 PHE QD 1 134 ASP H 3.340 . 4.880 4.278 4.061 4.556 . 0 0 "[ . 1 . 2]" 1
367 1 134 ASP H 1 135 ALA H 2.300 . 2.800 2.705 2.588 2.842 0.042 4 0 "[ . 1 . 2]" 1
368 1 134 ASP H 1 136 LEU H 3.010 . 4.220 4.072 3.878 4.289 0.069 9 0 "[ . 1 . 2]" 1
369 1 134 ASP H 1 137 PHE H 3.420 . 5.040 4.642 4.448 4.893 . 0 0 "[ . 1 . 2]" 1
370 1 135 ALA H 1 136 LEU H 2.320 . 2.840 2.662 2.475 2.778 . 0 0 "[ . 1 . 2]" 1
371 1 135 ALA H 1 137 PHE H 3.240 . 4.680 4.111 3.800 4.296 . 0 0 "[ . 1 . 2]" 1
372 1 135 ALA H 1 138 MET H 3.390 . 4.980 4.731 4.517 5.100 0.120 12 0 "[ . 1 . 2]" 1
373 1 135 ALA MB 1 136 LEU H 2.690 . 3.580 2.474 2.275 2.638 . 0 0 "[ . 1 . 2]" 1
374 1 136 LEU H 1 137 PHE H 2.290 . 2.780 2.673 2.585 2.848 0.068 2 0 "[ . 1 . 2]" 1
375 1 136 LEU H 1 138 MET H 2.980 . 4.160 4.073 3.861 4.454 0.294 12 0 "[ . 1 . 2]" 1
376 1 136 LEU H 1 139 ASN H 3.480 . 5.160 4.900 4.692 5.314 0.154 19 0 "[ . 1 . 2]" 1
377 1 137 PHE H 1 138 MET H 2.320 . 2.840 2.557 2.475 2.717 . 0 0 "[ . 1 . 2]" 1
378 1 137 PHE H 1 139 ASN H 3.180 . 4.560 4.114 3.940 4.368 . 0 0 "[ . 1 . 2]" 1
379 1 137 PHE QD 1 138 MET H 3.100 . 4.400 3.865 3.499 4.192 . 0 0 "[ . 1 . 2]" 1
380 1 137 PHE QD 1 141 LEU H 3.340 . 4.880 4.492 3.909 4.797 . 0 0 "[ . 1 . 2]" 1
381 1 137 PHE QE 1 141 LEU MD1 3.460 . 5.120 2.200 1.779 3.308 0.021 9 0 "[ . 1 . 2]" 1
382 1 138 MET H 1 139 ASN H 2.390 . 2.980 2.664 2.479 2.795 . 0 0 "[ . 1 . 2]" 1
383 1 138 MET H 1 140 TYR H 3.120 . 4.440 4.179 3.937 4.459 0.019 16 0 "[ . 1 . 2]" 1
384 1 138 MET H 1 141 LEU H 3.290 . 4.780 4.560 4.422 4.725 . 0 0 "[ . 1 . 2]" 1
385 1 138 MET ME 1 141 LEU MD2 3.260 . 4.720 2.264 1.783 2.945 0.017 16 0 "[ . 1 . 2]" 1
386 1 139 ASN H 1 140 TYR H 2.360 . 2.920 2.697 2.530 2.826 . 0 0 "[ . 1 . 2]" 1
387 1 139 ASN H 1 141 LEU H 3.060 . 4.320 3.946 3.807 4.194 . 0 0 "[ . 1 . 2]" 1
388 1 140 TYR H 1 141 LEU H 2.120 . 2.440 2.457 2.232 2.634 0.194 12 0 "[ . 1 . 2]" 1
389 1 140 TYR QD 1 141 LEU H 3.060 . 4.320 3.708 2.884 4.029 . 0 0 "[ . 1 . 2]" 1
390 2 9 MET H 2 10 THR H 3.340 . 4.880 4.543 4.424 4.711 . 0 0 "[ . 1 . 2]" 1
391 2 9 MET ME 2 10 THR H 2.500 . 3.200 2.745 2.430 3.356 0.156 7 0 "[ . 1 . 2]" 1
392 2 9 MET ME 2 11 PHE H 3.240 . 4.680 3.457 3.090 4.029 . 0 0 "[ . 1 . 2]" 1
393 2 9 MET ME 2 11 PHE QD 3.190 . 4.580 2.771 1.906 3.619 . 0 0 "[ . 1 . 2]" 1
394 2 10 THR H 2 11 PHE H 3.060 . 4.320 4.098 3.833 4.225 . 0 0 "[ . 1 . 2]" 1
395 2 10 THR H 2 87 ALA H 2.920 . 4.040 3.115 2.774 3.528 . 0 0 "[ . 1 . 2]" 1
396 2 10 THR H 2 89 ILE H 2.910 . 4.020 3.996 3.641 4.680 0.660 17 1 "[ . 1 . + 2]" 1
397 2 11 PHE H 2 12 GLN H 3.160 . 4.520 4.311 4.117 4.457 . 0 0 "[ . 1 . 2]" 1
398 2 11 PHE QD 2 12 GLN H 2.540 . 3.280 3.368 2.990 3.846 0.566 5 1 "[ + 1 . 2]" 1
399 2 11 PHE QE 2 12 GLN H 3.130 . 4.460 4.735 4.168 5.667 1.207 6 7 "[-* .+ * ** * 2]" 1
400 2 11 PHE QE 2 84 PHE QD 3.300 . 4.800 2.952 2.383 3.355 . 0 0 "[ . 1 . 2]" 1
401 2 11 PHE QE 2 101 TYR QD 3.320 . 4.830 2.918 1.977 3.857 . 0 0 "[ . 1 . 2]" 1
402 2 11 PHE QE 2 101 TYR QE 3.460 . 5.120 3.083 2.863 3.276 . 0 0 "[ . 1 . 2]" 1
403 2 12 GLN H 2 13 ILE H 3.010 . 4.220 4.263 4.068 4.379 0.159 2 0 "[ . 1 . 2]" 1
404 2 12 GLN H 2 85 SER H 2.830 . 3.860 2.937 2.594 3.480 . 0 0 "[ . 1 . 2]" 1
405 2 13 ILE H 2 14 GLN H 3.330 . 4.860 4.428 4.337 4.475 . 0 0 "[ . 1 . 2]" 1
406 2 13 ILE H 4 129 ALA MB 3.180 . 4.560 3.665 2.818 4.433 . 0 0 "[ . 1 . 2]" 1
407 2 14 GLN H 2 15 ARG H 2.080 . 2.360 2.274 2.114 2.450 0.090 12 0 "[ . 1 . 2]" 1
408 2 14 GLN H 2 83 ILE H 3.170 . 4.540 4.686 4.218 4.993 0.453 17 0 "[ . 1 . 2]" 1
409 2 14 GLN H 2 84 PHE QD 3.240 . 4.680 4.127 3.587 4.955 0.275 6 0 "[ . 1 . 2]" 1
410 2 14 GLN H 2 85 SER H 3.410 . 5.020 4.189 3.739 4.769 . 0 0 "[ . 1 . 2]" 1
411 2 15 ARG H 2 16 ILE H 3.110 . 4.420 4.082 3.988 4.151 . 0 0 "[ . 1 . 2]" 1
412 2 15 ARG H 2 83 ILE H 2.480 . 3.160 3.354 3.121 3.546 0.386 19 0 "[ . 1 . 2]" 1
413 2 16 ILE H 2 17 TYR H 3.260 . 4.720 4.446 4.317 4.480 . 0 0 "[ . 1 . 2]" 1
414 2 17 TYR H 2 18 THR H 3.160 . 4.520 4.251 4.154 4.354 . 0 0 "[ . 1 . 2]" 1
415 2 17 TYR H 2 81 GLY H 2.920 . 4.040 3.929 3.837 4.099 0.059 1 0 "[ . 1 . 2]" 1
416 2 17 TYR QD 2 18 THR H 3.220 . 4.640 3.991 3.406 4.457 . 0 0 "[ . 1 . 2]" 1
417 2 17 TYR QE 2 83 ILE H 3.380 . 4.960 2.865 2.021 3.606 . 0 0 "[ . 1 . 2]" 1
418 2 18 THR H 2 19 LYS H 3.280 . 4.760 4.458 4.380 4.504 . 0 0 "[ . 1 . 2]" 1
419 2 19 LYS H 2 20 ASP H 2.120 . 2.440 2.210 2.141 2.405 . 0 0 "[ . 1 . 2]" 1
420 2 19 LYS H 2 79 GLN H 3.170 . 4.540 4.187 3.965 4.412 . 0 0 "[ . 1 . 2]" 1
421 2 19 LYS H 2 80 GLN H 3.410 . 5.020 4.951 4.838 5.055 0.035 14 0 "[ . 1 . 2]" 1
422 2 19 LYS H 2 81 GLY H 2.440 . 3.080 2.958 2.674 3.141 0.061 16 0 "[ . 1 . 2]" 1
423 2 20 ASP H 2 21 ILE H 3.140 . 4.480 4.226 4.113 4.408 . 0 0 "[ . 1 . 2]" 1
424 2 20 ASP H 2 79 GLN H 2.570 . 3.340 3.139 3.031 3.277 . 0 0 "[ . 1 . 2]" 1
425 2 21 ILE H 2 22 SER H 3.240 . 4.680 4.305 4.254 4.359 . 0 0 "[ . 1 . 2]" 1
426 2 21 ILE H 2 79 GLN H 3.510 . 5.220 5.088 4.860 5.241 0.021 6 0 "[ . 1 . 2]" 1
427 2 22 SER H 2 23 PHE H 3.080 . 4.360 4.143 3.853 4.245 . 0 0 "[ . 1 . 2]" 1
428 2 22 SER H 2 77 GLU H 2.650 . 3.500 3.110 2.775 3.476 . 0 0 "[ . 1 . 2]" 1
429 2 22 SER H 2 78 VAL H 3.470 . 5.140 5.117 5.002 5.181 0.041 10 0 "[ . 1 . 2]" 1
430 2 22 SER H 2 78 VAL MG2 3.330 . 4.860 3.911 3.104 4.237 . 0 0 "[ . 1 . 2]" 1
431 2 22 SER H 2 79 GLN H 3.450 . 5.100 5.523 5.237 5.736 0.636 18 4 "[ -* .* 1 . + 2]" 1
432 2 23 PHE H 2 24 GLU H 2.960 . 4.120 3.979 3.787 4.257 0.137 4 0 "[ . 1 . 2]" 1
433 2 23 PHE QD 2 24 GLU H 2.940 . 4.080 3.752 3.334 3.963 . 0 0 "[ . 1 . 2]" 1
434 2 23 PHE QE 2 25 ALA MB 3.460 . 5.120 2.799 2.515 3.103 . 0 0 "[ . 1 . 2]" 1
435 2 23 PHE QE 2 121 GLY H 3.120 . 4.440 3.642 3.409 4.015 . 0 0 "[ . 1 . 2]" 1
436 2 24 GLU H 2 25 ALA H 3.250 . 4.700 4.159 3.950 4.369 . 0 0 "[ . 1 . 2]" 1
437 2 24 GLU H 2 75 LEU H 2.740 . 3.680 2.932 2.595 3.244 . 0 0 "[ . 1 . 2]" 1
438 2 25 ALA MB 2 28 ALA H 3.050 . 4.300 3.206 2.836 3.516 . 0 0 "[ . 1 . 2]" 1
439 2 25 ALA MB 2 28 ALA MB 2.650 . 3.500 1.832 1.638 1.963 0.162 15 0 "[ . 1 . 2]" 1
440 2 27 ASN H 2 28 ALA H 2.410 . 3.020 2.522 2.181 2.819 . 0 0 "[ . 1 . 2]" 1
441 2 28 ALA H 2 30 HIS H 2.970 . 4.140 4.592 4.469 5.001 0.861 16 4 "[ -* . 1 .+* 2]" 1
442 2 28 ALA H 2 31 VAL H 3.320 . 4.830 4.807 4.639 4.952 0.122 16 0 "[ . 1 . 2]" 1
443 2 30 HIS H 2 31 VAL H 2.340 . 2.880 2.318 2.150 2.525 . 0 0 "[ . 1 . 2]" 1
444 2 30 HIS H 2 32 PHE H 2.850 . 3.900 3.964 3.756 4.229 0.329 16 0 "[ . 1 . 2]" 1
445 2 31 VAL H 2 32 PHE H 2.360 . 2.920 2.485 2.319 2.665 . 0 0 "[ . 1 . 2]" 1
446 2 31 VAL H 2 33 GLN H 3.230 . 4.660 4.327 4.110 4.505 . 0 0 "[ . 1 . 2]" 1
447 2 31 VAL MG1 2 32 PHE H 2.490 . 3.180 2.661 2.503 2.721 . 0 0 "[ . 1 . 2]" 1
448 2 31 VAL MG1 2 32 PHE QD 3.390 . 4.980 3.161 2.916 3.383 . 0 0 "[ . 1 . 2]" 1
449 2 31 VAL MG1 2 68 LEU MD1 3.160 . 4.520 2.835 2.158 3.336 . 0 0 "[ . 1 . 2]" 1
450 2 31 VAL MG1 2 123 PHE QE 3.080 . 4.360 2.219 1.949 2.650 . 0 0 "[ . 1 . 2]" 1
451 2 31 VAL MG2 2 32 PHE H 3.470 . 5.140 4.160 4.056 4.293 . 0 0 "[ . 1 . 2]" 1
452 2 31 VAL MG2 2 34 LYS H 3.400 . 5.000 4.244 3.942 4.483 . 0 0 "[ . 1 . 2]" 1
453 2 31 VAL MG2 2 68 LEU H 3.150 . 4.500 3.108 2.760 3.569 . 0 0 "[ . 1 . 2]" 1
454 2 31 VAL MG2 2 68 LEU MD1 2.400 . 3.000 1.739 1.551 2.295 0.249 19 0 "[ . 1 . 2]" 1
455 2 31 VAL MG2 2 68 LEU MD2 3.470 . 5.140 3.945 3.870 4.056 . 0 0 "[ . 1 . 2]" 1
456 2 31 VAL MG2 2 73 ALA MB 3.360 . 4.920 2.590 2.366 2.807 . 0 0 "[ . 1 . 2]" 1
457 2 32 PHE H 2 33 GLN H 2.360 . 2.920 2.750 2.670 2.802 . 0 0 "[ . 1 . 2]" 1
458 2 32 PHE H 2 34 LYS H 3.170 . 4.540 4.412 4.227 4.657 0.117 11 0 "[ . 1 . 2]" 1
459 2 32 PHE QD 2 33 GLN H 3.440 . 5.080 4.784 4.713 4.921 . 0 0 "[ . 1 . 2]" 1
460 2 33 GLN H 2 34 LYS H 2.280 . 2.760 2.629 2.526 2.782 0.022 11 0 "[ . 1 . 2]" 1
461 2 34 LYS H 2 35 ASP H 3.160 . 4.520 4.056 3.710 4.278 . 0 0 "[ . 1 . 2]" 1
462 2 35 ASP H 2 36 TRP H 3.030 . 4.260 4.036 3.842 4.210 . 0 0 "[ . 1 . 2]" 1
463 2 36 TRP H 2 37 GLN H 3.170 . 4.540 4.298 4.242 4.337 . 0 0 "[ . 1 . 2]" 1
464 2 36 TRP H 2 68 LEU MD1 3.120 . 4.440 3.460 3.131 4.020 . 0 0 "[ . 1 . 2]" 1
465 2 36 TRP H 2 68 LEU MD2 2.930 . 4.060 2.977 2.764 3.279 . 0 0 "[ . 1 . 2]" 1
466 2 36 TRP HE1 2 37 GLN H 3.210 . 4.620 4.396 3.689 4.814 0.194 17 0 "[ . 1 . 2]" 1
467 2 36 TRP HE1 2 39 GLU H 3.490 . 5.180 4.899 3.275 7.660 2.480 5 6 "[ + *1** *- 2]" 1
468 2 36 TRP HE3 2 37 GLN H 2.540 . 3.280 3.601 2.618 5.359 2.079 12 6 "[ - *1*+ ** 2]" 1
469 2 36 TRP HZ3 2 37 GLN H 3.230 . 4.660 4.983 3.919 6.972 2.312 12 6 "[ - *1*+ ** 2]" 1
470 2 37 GLN H 2 68 LEU MD2 3.490 . 5.180 4.240 3.984 4.572 . 0 0 "[ . 1 . 2]" 1
471 2 39 GLU H 2 40 VAL H 3.230 . 4.660 4.468 4.290 4.591 . 0 0 "[ . 1 . 2]" 1
472 2 39 GLU H 2 67 SER H 2.660 . 3.520 3.328 2.827 3.869 0.349 19 0 "[ . 1 . 2]" 1
473 2 40 VAL H 2 41 LYS H 3.290 . 4.780 4.478 4.294 4.555 . 0 0 "[ . 1 . 2]" 1
474 2 40 VAL QG 2 41 LYS H 2.530 . 3.260 3.055 2.622 3.487 0.227 11 0 "[ . 1 . 2]" 1
475 2 40 VAL QG 2 42 LEU H 3.530 . 5.250 3.918 3.303 4.682 . 0 0 "[ . 1 . 2]" 1
476 2 40 VAL QG 2 64 VAL QG 2.310 . 2.820 2.318 1.684 2.968 0.148 18 0 "[ . 1 . 2]" 1
477 2 40 VAL QG 2 66 ALA MB 3.410 . 5.020 2.218 1.719 3.225 0.081 19 0 "[ . 1 . 2]" 1
478 2 40 VAL QG 2 74 PHE QE 3.150 . 4.500 3.558 2.854 4.308 . 0 0 "[ . 1 . 2]" 1
479 2 40 VAL QG 2 126 LEU QD 2.450 . 2.940 1.908 1.719 2.116 0.081 13 0 "[ . 1 . 2]" 1
480 2 40 VAL QG 2 128 LEU QD 2.890 . 3.480 3.751 2.447 4.612 1.132 17 6 "[ . -* * .*+ *]" 1
481 2 41 LYS H 2 42 LEU H 3.090 . 4.380 4.149 3.865 4.403 0.023 14 0 "[ . 1 . 2]" 1
482 2 41 LYS H 2 64 VAL QG 2.960 . 4.120 3.505 2.737 4.385 0.265 3 0 "[ . 1 . 2]" 1
483 2 41 LYS H 2 65 THR H 2.770 . 3.740 3.039 2.330 3.581 . 0 0 "[ . 1 . 2]" 1
484 2 42 LEU H 2 43 ASP H 3.310 . 4.820 4.501 4.336 4.575 . 0 0 "[ . 1 . 2]" 1
485 2 42 LEU H 2 128 LEU QD 3.030 . 4.260 5.452 4.942 6.256 1.996 10 20 [*-*******+**********] 1
486 2 42 LEU QD 2 43 ASP H 2.410 . 3.020 3.691 1.932 4.401 1.381 13 15 "[ ** *** ****+ ** **-]" 1
487 2 42 LEU QD 2 44 LEU QD 3.260 . 4.720 3.588 2.113 5.274 0.554 16 1 "[ . 1 .+ 2]" 1
488 2 42 LEU QD 2 62 VAL QG 2.410 . 3.020 3.206 1.890 4.125 1.105 19 7 "[ ** . *1* * - +2]" 1
489 2 42 LEU QD 2 64 VAL QG 2.750 . 3.700 3.026 1.896 4.135 0.435 3 0 "[ . 1 . 2]" 1
490 2 42 LEU QD 2 128 LEU QD 3.480 . 4.800 2.075 1.598 3.604 0.202 14 0 "[ . 1 . 2]" 1
491 2 42 LEU QD 2 131 VAL QG 2.860 . 3.920 3.615 2.785 5.220 1.300 8 2 "[ . + 1 . -]" 1
492 2 43 ASP H 2 44 LEU H 3.160 . 4.520 4.195 3.934 4.428 . 0 0 "[ . 1 . 2]" 1
493 2 43 ASP H 2 62 VAL QG 3.090 . 4.380 3.680 3.417 4.073 . 0 0 "[ . 1 . 2]" 1
494 2 43 ASP H 2 63 THR H 2.820 . 3.840 3.236 2.875 3.681 . 0 0 "[ . 1 . 2]" 1
495 2 43 ASP H 2 64 VAL QG 3.390 . 4.980 3.967 3.445 4.456 . 0 0 "[ . 1 . 2]" 1
496 2 44 LEU H 2 45 ASP H 3.280 . 4.760 4.397 4.113 4.584 . 0 0 "[ . 1 . 2]" 1
497 2 44 LEU QD 2 45 ASP H 3.370 . 4.940 3.149 1.824 3.932 . 0 0 "[ . 1 . 2]" 1
498 2 44 LEU QD 2 131 VAL QG 3.200 . 4.600 3.053 1.835 4.552 . 0 0 "[ . 1 . 2]" 1
499 2 45 ASP H 2 46 THR H 2.930 . 4.060 4.155 3.825 4.455 0.395 1 0 "[ . 1 . 2]" 1
500 2 45 ASP H 2 60 LEU MD2 3.260 . 4.720 3.430 2.900 3.775 . 0 0 "[ . 1 . 2]" 1
501 2 45 ASP H 2 61 ARG H 2.920 . 4.040 3.363 2.779 3.931 . 0 0 "[ . 1 . 2]" 1
502 2 46 THR H 2 47 ALA H 3.240 . 4.680 4.195 4.081 4.370 . 0 0 "[ . 1 . 2]" 1
503 2 46 THR H 2 61 ARG H 3.510 . 5.220 4.873 4.689 5.056 . 0 0 "[ . 1 . 2]" 1
504 2 47 ALA H 2 48 SER H 3.090 . 4.380 4.382 4.024 4.516 0.136 10 0 "[ . 1 . 2]" 1
505 2 47 ALA H 2 59 VAL H 2.540 . 3.280 3.353 2.904 3.877 0.597 4 2 "[ +. 1 - . 2]" 1
506 2 47 ALA H 2 61 ARG H 3.370 . 4.940 4.410 3.949 5.069 0.129 19 0 "[ . 1 . 2]" 1
507 2 47 ALA MB 2 48 SER H 2.910 . 4.020 2.834 2.473 3.331 . 0 0 "[ . 1 . 2]" 1
508 2 47 ALA MB 2 59 VAL H 3.480 . 5.160 4.082 3.292 4.688 . 0 0 "[ . 1 . 2]" 1
509 2 48 SER H 2 49 SER H 3.290 . 4.780 4.454 4.385 4.562 . 0 0 "[ . 1 . 2]" 1
510 2 48 SER H 2 59 VAL H 3.350 . 4.900 4.755 4.420 5.122 0.222 19 0 "[ . 1 . 2]" 1
511 2 49 SER H 2 50 GLN H 3.200 . 4.600 4.283 4.212 4.389 . 0 0 "[ . 1 . 2]" 1
512 2 49 SER H 2 57 GLU H 2.080 . 2.360 2.873 2.387 3.435 1.075 2 9 "[ + *. ***1**- * 2]" 1
513 2 49 SER H 2 58 VAL H 3.410 . 5.020 4.946 4.701 5.122 0.102 10 0 "[ . 1 . 2]" 1
514 2 49 SER H 2 59 VAL H 3.520 . 5.240 5.229 4.825 5.735 0.495 19 0 "[ . 1 . 2]" 1
515 2 50 GLN H 2 51 LEU H 3.090 . 4.380 4.381 4.141 4.578 0.198 12 0 "[ . 1 . 2]" 1
516 2 50 GLN H 2 57 GLU H 3.350 . 4.900 4.966 4.763 5.202 0.302 10 0 "[ . 1 . 2]" 1
517 2 51 LEU H 2 52 ALA H 2.100 . 2.400 2.346 2.116 2.564 0.164 18 0 "[ . 1 . 2]" 1
518 2 51 LEU H 2 55 VAL H 3.420 . 5.040 4.925 4.724 5.334 0.294 11 0 "[ . 1 . 2]" 1
519 2 51 LEU H 2 55 VAL MG1 3.300 . 4.800 3.475 2.937 3.901 . 0 0 "[ . 1 . 2]" 1
520 2 51 LEU H 2 56 TYR H 3.500 . 5.200 4.792 4.382 5.202 0.002 3 0 "[ . 1 . 2]" 1
521 2 51 LEU H 2 57 GLU H 3.120 . 4.440 3.891 3.189 4.390 . 0 0 "[ . 1 . 2]" 1
522 2 51 LEU MD1 2 55 VAL MG1 3.020 . 4.240 2.204 1.959 2.402 . 0 0 "[ . 1 . 2]" 1
523 2 52 ALA H 2 53 ASP H 3.170 . 4.540 4.321 4.259 4.362 . 0 0 "[ . 1 . 2]" 1
524 2 52 ALA H 2 55 VAL H 2.850 . 3.900 3.545 3.244 3.767 . 0 0 "[ . 1 . 2]" 1
525 2 52 ALA H 2 55 VAL MG1 3.120 . 4.440 3.301 2.947 3.541 . 0 0 "[ . 1 . 2]" 1
526 2 52 ALA MB 2 53 ASP H 2.310 . 2.820 1.915 1.749 2.279 0.051 16 0 "[ . 1 . 2]" 1
527 2 52 ALA MB 2 55 VAL MG2 3.290 . 4.780 2.592 2.287 2.791 . 0 0 "[ . 1 . 2]" 1
528 2 53 ASP H 2 54 ASP H 3.260 . 4.720 4.457 4.260 4.604 . 0 0 "[ . 1 . 2]" 1
529 2 53 ASP H 2 55 VAL H 3.400 . 5.000 4.168 3.936 4.547 . 0 0 "[ . 1 . 2]" 1
530 2 54 ASP H 2 55 VAL H 2.300 . 2.800 2.743 2.516 2.898 0.098 11 0 "[ . 1 . 2]" 1
531 2 55 VAL H 2 56 TYR H 2.880 . 3.960 4.185 3.944 4.341 0.381 16 0 "[ . 1 . 2]" 1
532 2 55 VAL H 2 56 TYR QD 3.490 . 5.180 4.565 3.448 5.856 0.676 12 1 "[ . 1 + . 2]" 1
533 2 55 VAL MG1 2 56 TYR H 3.040 . 4.280 3.029 2.810 3.257 . 0 0 "[ . 1 . 2]" 1
534 2 55 VAL MG1 2 84 PHE H 3.240 . 4.680 3.836 3.461 4.237 . 0 0 "[ . 1 . 2]" 1
535 2 56 TYR H 2 57 GLU H 3.290 . 4.780 4.394 4.295 4.510 . 0 0 "[ . 1 . 2]" 1
536 2 56 TYR H 2 84 PHE H 3.120 . 4.440 3.485 3.234 3.734 . 0 0 "[ . 1 . 2]" 1
537 2 56 TYR H 2 86 ILE H 3.070 . 4.340 3.856 3.265 4.986 0.646 17 1 "[ . 1 . + 2]" 1
538 2 56 TYR H 2 98 LEU QD 3.240 . 4.680 5.306 4.022 7.227 2.547 10 9 "[ * * * + * .*** -]" 1
539 2 56 TYR QD 2 57 GLU H 3.040 . 4.280 3.587 2.746 4.375 0.095 1 0 "[ . 1 . 2]" 1
540 2 56 TYR QD 2 98 LEU QD 3.150 . 4.200 2.842 1.914 4.289 0.089 10 0 "[ . 1 . 2]" 1
541 2 57 GLU H 2 58 VAL H 2.990 . 4.180 4.093 3.873 4.422 0.242 2 0 "[ . 1 . 2]" 1
542 2 58 VAL H 2 59 VAL H 3.240 . 4.680 4.503 4.408 4.547 . 0 0 "[ . 1 . 2]" 1
543 2 58 VAL H 2 82 GLY H 2.940 . 4.080 3.377 3.159 3.589 . 0 0 "[ . 1 . 2]" 1
544 2 58 VAL H 2 84 PHE H 3.180 . 4.560 4.263 3.904 4.584 0.024 17 0 "[ . 1 . 2]" 1
545 2 58 VAL H 2 84 PHE QD 3.350 . 4.900 2.846 2.600 3.128 . 0 0 "[ . 1 . 2]" 1
546 2 58 VAL H 2 84 PHE QE 3.420 . 5.040 3.191 2.758 3.665 . 0 0 "[ . 1 . 2]" 1
547 2 58 VAL MG1 2 59 VAL H 2.780 . 3.760 2.389 2.272 2.949 . 0 0 "[ . 1 . 2]" 1
548 2 58 VAL MG2 2 59 VAL H 3.500 . 5.200 3.943 3.799 4.140 . 0 0 "[ . 1 . 2]" 1
549 2 58 VAL MG2 2 84 PHE QD 3.480 . 5.160 2.522 2.238 2.818 . 0 0 "[ . 1 . 2]" 1
550 2 58 VAL MG2 2 98 LEU QD 3.140 . 4.000 2.723 1.994 4.114 0.114 10 0 "[ . 1 . 2]" 1
551 2 59 VAL H 2 60 LEU H 3.200 . 4.600 4.219 3.997 4.417 . 0 0 "[ . 1 . 2]" 1
552 2 59 VAL MG1 2 60 LEU H 2.730 . 3.660 2.742 2.211 3.080 . 0 0 "[ . 1 . 2]" 1
553 2 59 VAL MG2 2 60 LEU H 3.530 . 5.250 4.154 4.023 4.272 . 0 0 "[ . 1 . 2]" 1
554 2 60 LEU H 2 61 ARG H 3.240 . 4.680 4.169 3.895 4.435 . 0 0 "[ . 1 . 2]" 1
555 2 60 LEU H 2 80 GLN H 2.910 . 4.020 3.643 3.303 3.932 . 0 0 "[ . 1 . 2]" 1
556 2 60 LEU H 2 81 GLY H 3.270 . 4.740 4.542 4.359 4.743 0.003 16 0 "[ . 1 . 2]" 1
557 2 60 LEU H 2 82 GLY H 3.350 . 4.900 5.100 4.696 5.387 0.487 18 0 "[ . 1 . 2]" 1
558 2 60 LEU MD1 2 62 VAL QG 3.160 . 4.520 2.860 2.369 3.032 . 0 0 "[ . 1 . 2]" 1
559 2 60 LEU MD1 2 110 ALA H 3.160 . 4.520 4.010 3.932 4.095 . 0 0 "[ . 1 . 2]" 1
560 2 60 LEU MD1 2 110 ALA MB 2.860 . 3.920 2.455 2.296 2.572 . 0 0 "[ . 1 . 2]" 1
561 2 60 LEU MD2 2 61 ARG H 2.330 . 2.860 2.654 2.223 2.934 0.074 16 0 "[ . 1 . 2]" 1
562 2 60 LEU MD2 2 62 VAL H 3.190 . 4.580 3.486 3.221 3.688 . 0 0 "[ . 1 . 2]" 1
563 2 60 LEU MD2 2 62 VAL QG 2.280 . 2.760 1.912 1.796 1.986 0.004 5 0 "[ . 1 . 2]" 1
564 2 60 LEU MD2 2 110 ALA MB 3.360 . 4.920 3.323 3.124 3.619 . 0 0 "[ . 1 . 2]" 1
565 2 61 ARG H 2 62 VAL H 3.120 . 4.440 4.337 4.072 4.443 0.003 17 0 "[ . 1 . 2]" 1
566 2 61 ARG H 2 62 VAL QG 3.290 . 4.780 4.326 4.026 4.481 . 0 0 "[ . 1 . 2]" 1
567 2 62 VAL H 2 63 THR H 3.040 . 4.280 4.131 3.951 4.348 0.068 16 0 "[ . 1 . 2]" 1
568 2 62 VAL H 2 78 VAL H 2.610 . 3.420 3.135 2.952 3.505 0.085 12 0 "[ . 1 . 2]" 1
569 2 62 VAL H 2 80 GLN H 3.380 . 4.960 4.370 3.989 4.588 . 0 0 "[ . 1 . 2]" 1
570 2 62 VAL QG 2 63 THR H 2.950 . 4.100 3.041 2.555 3.267 . 0 0 "[ . 1 . 2]" 1
571 2 62 VAL QG 2 64 VAL QG 3.020 . 4.240 2.448 2.120 2.836 . 0 0 "[ . 1 . 2]" 1
572 2 62 VAL QG 2 110 ALA MB 3.040 . 4.280 2.175 1.991 2.491 . 0 0 "[ . 1 . 2]" 1
573 2 63 THR H 2 64 VAL H 3.290 . 4.780 4.431 4.299 4.509 . 0 0 "[ . 1 . 2]" 1
574 2 64 VAL H 2 65 THR H 2.900 . 4.000 4.136 3.775 4.312 0.312 15 0 "[ . 1 . 2]" 1
575 2 64 VAL H 2 76 CYS H 2.580 . 3.360 3.391 3.154 3.670 0.310 5 0 "[ . 1 . 2]" 1
576 2 64 VAL QG 2 65 THR H 3.060 . 4.320 2.908 2.545 3.312 . 0 0 "[ . 1 . 2]" 1
577 2 64 VAL QG 2 74 PHE QE 3.470 . 5.140 2.343 1.947 2.761 . 0 0 "[ . 1 . 2]" 1
578 2 64 VAL QG 2 76 CYS H 3.430 . 5.060 3.567 2.894 4.152 . 0 0 "[ . 1 . 2]" 1
579 2 64 VAL QG 2 126 LEU QD 2.730 . 3.660 2.261 1.677 4.067 0.407 9 0 "[ . 1 . 2]" 1
580 2 64 VAL QG 2 128 LEU QD 2.880 . 3.960 2.505 1.915 3.217 . 0 0 "[ . 1 . 2]" 1
581 2 65 THR H 2 66 ALA H 3.290 . 4.780 4.457 4.113 4.589 . 0 0 "[ . 1 . 2]" 1
582 2 65 THR H 2 76 CYS H 3.520 . 5.240 5.074 4.877 5.176 . 0 0 "[ . 1 . 2]" 1
583 2 66 ALA H 2 67 SER H 3.210 . 4.620 4.361 4.260 4.515 . 0 0 "[ . 1 . 2]" 1
584 2 66 ALA H 2 73 ALA H 3.050 . 4.300 4.403 4.144 4.672 0.372 14 0 "[ . 1 . 2]" 1
585 2 66 ALA H 2 74 PHE H 2.520 . 3.240 3.617 3.344 3.818 0.578 11 4 "[ . 1+ -*. * 2]" 1
586 2 66 ALA H 2 74 PHE QD 3.480 . 5.160 4.824 4.334 5.187 0.027 13 0 "[ . 1 . 2]" 1
587 2 66 ALA H 2 75 LEU MD2 2.350 . 2.900 2.472 2.061 2.750 . 0 0 "[ . 1 . 2]" 1
588 2 66 ALA MB 2 67 SER H 2.670 . 3.540 2.725 2.496 2.988 . 0 0 "[ . 1 . 2]" 1
589 2 66 ALA MB 2 73 ALA H 3.280 . 4.760 3.857 3.405 4.191 . 0 0 "[ . 1 . 2]" 1
590 2 66 ALA MB 2 73 ALA MB 2.760 . 3.720 2.635 2.298 2.948 . 0 0 "[ . 1 . 2]" 1
591 2 66 ALA MB 2 74 PHE H 2.710 . 3.620 2.597 2.061 2.913 . 0 0 "[ . 1 . 2]" 1
592 2 66 ALA MB 2 74 PHE QD 2.820 . 3.840 3.012 2.918 3.102 . 0 0 "[ . 1 . 2]" 1
593 2 66 ALA MB 2 74 PHE QE 2.470 . 3.150 2.794 2.715 2.881 . 0 0 "[ . 1 . 2]" 1
594 2 67 SER H 2 68 LEU H 3.140 . 4.480 4.234 4.164 4.279 . 0 0 "[ . 1 . 2]" 1
595 2 67 SER H 2 73 ALA H 3.030 . 4.260 4.132 3.930 4.322 0.062 7 0 "[ . 1 . 2]" 1
596 2 67 SER H 2 73 ALA MB 2.940 . 4.080 3.598 3.325 4.029 . 0 0 "[ . 1 . 2]" 1
597 2 67 SER H 2 74 PHE H 3.470 . 5.140 4.866 4.677 5.265 0.125 7 0 "[ . 1 . 2]" 1
598 2 68 LEU H 2 69 GLY H 3.050 . 4.300 4.281 4.108 4.418 0.118 14 0 "[ . 1 . 2]" 1
599 2 68 LEU H 2 71 GLU H 2.840 . 3.880 4.065 3.829 4.199 0.319 15 0 "[ . 1 . 2]" 1
600 2 68 LEU H 2 72 THR H 3.480 . 5.160 5.158 4.949 5.373 0.213 12 0 "[ . 1 . 2]" 1
601 2 68 LEU H 2 73 ALA H 2.470 . 3.150 3.200 2.959 3.342 0.192 1 0 "[ . 1 . 2]" 1
602 2 68 LEU H 2 73 ALA MB 2.610 . 3.420 2.456 2.151 2.951 . 0 0 "[ . 1 . 2]" 1
603 2 68 LEU MD1 2 73 ALA MB 2.970 . 4.140 2.516 2.164 2.955 . 0 0 "[ . 1 . 2]" 1
604 2 68 LEU MD2 2 69 GLY H 3.190 . 4.580 3.458 3.294 3.846 . 0 0 "[ . 1 . 2]" 1
605 2 68 LEU MD2 2 73 ALA MB 3.510 . 5.220 3.537 3.253 3.742 . 0 0 "[ . 1 . 2]" 1
606 2 69 GLY H 2 70 GLU H 3.200 . 4.600 4.423 4.338 4.596 . 0 0 "[ . 1 . 2]" 1
607 2 69 GLY H 2 71 GLU H 3.230 . 4.660 4.726 4.521 4.896 0.236 20 0 "[ . 1 . 2]" 1
608 2 70 GLU H 2 71 GLU H 2.270 . 2.740 2.307 2.019 2.690 . 0 0 "[ . 1 . 2]" 1
609 2 71 GLU H 2 72 THR H 3.200 . 4.600 4.475 4.377 4.535 . 0 0 "[ . 1 . 2]" 1
610 2 72 THR H 2 73 ALA H 3.300 . 4.800 4.559 4.447 4.619 . 0 0 "[ . 1 . 2]" 1
611 2 73 ALA H 2 74 PHE H 2.210 . 2.620 2.477 2.318 2.680 0.060 12 0 "[ . 1 . 2]" 1
612 2 73 ALA H 2 75 LEU MD2 3.340 . 4.880 4.759 4.341 5.066 0.186 18 0 "[ . 1 . 2]" 1
613 2 73 ALA MB 2 74 PHE H 2.500 . 3.200 2.088 1.985 2.241 . 0 0 "[ . 1 . 2]" 1
614 2 73 ALA MB 2 74 PHE QD 3.270 . 4.740 2.535 2.305 2.725 . 0 0 "[ . 1 . 2]" 1
615 2 74 PHE H 2 75 LEU H 3.120 . 4.440 4.310 4.253 4.344 . 0 0 "[ . 1 . 2]" 1
616 2 74 PHE H 2 75 LEU MD2 2.840 . 3.880 4.236 3.867 4.505 0.625 11 4 "[ - * 1+ . * 2]" 1
617 2 74 PHE QD 2 75 LEU H 3.200 . 4.600 3.420 3.112 3.816 . 0 0 "[ . 1 . 2]" 1
618 2 74 PHE QD 2 123 PHE QD 3.200 . 4.600 2.999 2.701 3.261 . 0 0 "[ . 1 . 2]" 1
619 2 74 PHE QD 2 123 PHE QE 3.280 . 4.760 3.570 3.311 3.844 . 0 0 "[ . 1 . 2]" 1
620 2 74 PHE QE 2 126 LEU QD 2.690 . 3.580 2.591 1.956 3.875 0.295 17 0 "[ . 1 . 2]" 1
621 2 75 LEU H 2 76 CYS H 3.110 . 4.410 4.162 3.992 4.414 0.004 3 0 "[ . 1 . 2]" 1
622 2 76 CYS H 2 77 GLU H 3.240 . 4.680 4.399 4.214 4.503 . 0 0 "[ . 1 . 2]" 1
623 2 77 GLU H 2 78 VAL H 3.020 . 4.240 4.081 3.967 4.331 0.091 1 0 "[ . 1 . 2]" 1
624 2 77 GLU H 2 78 VAL MG2 3.180 . 4.560 3.521 3.394 4.058 . 0 0 "[ . 1 . 2]" 1
625 2 78 VAL H 2 79 GLN H 3.200 . 4.600 4.378 4.326 4.415 . 0 0 "[ . 1 . 2]" 1
626 2 78 VAL MG1 2 79 GLN H 2.570 . 3.340 2.362 2.282 2.416 . 0 0 "[ . 1 . 2]" 1
627 2 78 VAL MG1 2 80 GLN H 3.020 . 4.240 2.731 2.561 3.046 . 0 0 "[ . 1 . 2]" 1
628 2 78 VAL MG1 2 110 ALA MB 3.410 . 5.020 2.932 2.781 3.258 . 0 0 "[ . 1 . 2]" 1
629 2 78 VAL MG2 2 79 GLN H 3.400 . 5.000 3.967 3.752 4.050 . 0 0 "[ . 1 . 2]" 1
630 2 78 VAL MG2 2 114 ILE H 2.950 . 4.100 2.693 2.575 2.972 . 0 0 "[ . 1 . 2]" 1
631 2 79 GLN H 2 80 GLN H 2.930 . 4.060 3.750 3.628 3.940 . 0 0 "[ . 1 . 2]" 1
632 2 80 GLN H 2 81 GLY H 3.180 . 4.560 4.218 4.159 4.261 . 0 0 "[ . 1 . 2]" 1
633 2 80 GLN H 2 110 ALA MB 2.940 . 4.080 3.318 3.144 3.642 . 0 0 "[ . 1 . 2]" 1
634 2 81 GLY H 2 82 GLY H 3.270 . 4.740 4.543 4.512 4.587 . 0 0 "[ . 1 . 2]" 1
635 2 82 GLY H 2 83 ILE H 3.220 . 4.640 4.073 3.984 4.175 . 0 0 "[ . 1 . 2]" 1
636 2 82 GLY H 2 84 PHE QE 3.300 . 4.800 4.008 3.698 4.394 . 0 0 "[ . 1 . 2]" 1
637 2 83 ILE H 2 84 PHE H 3.280 . 4.760 4.466 4.413 4.511 . 0 0 "[ . 1 . 2]" 1
638 2 83 ILE H 2 84 PHE QE 3.360 . 4.920 4.982 4.752 5.150 0.230 17 0 "[ . 1 . 2]" 1
639 2 84 PHE H 2 85 SER H 3.150 . 4.500 4.331 4.245 4.424 . 0 0 "[ . 1 . 2]" 1
640 2 84 PHE QD 2 85 SER H 3.400 . 5.000 4.292 3.891 4.566 . 0 0 "[ . 1 . 2]" 1
641 2 85 SER H 2 86 ILE H 3.270 . 4.740 4.189 3.969 4.394 . 0 0 "[ . 1 . 2]" 1
642 2 86 ILE H 2 87 ALA H 3.170 . 4.540 4.469 4.324 4.559 0.019 10 0 "[ . 1 . 2]" 1
643 2 87 ALA H 2 88 GLY H 3.090 . 4.380 4.352 4.238 4.462 0.082 20 0 "[ . 1 . 2]" 1
644 2 87 ALA H 2 89 ILE H 2.730 . 3.660 3.993 3.678 4.382 0.722 18 4 "[ . * . -+ *]" 1
645 2 87 ALA MB 2 88 GLY H 2.850 . 3.900 2.605 2.305 2.989 . 0 0 "[ . 1 . 2]" 1
646 2 88 GLY H 2 89 ILE H 2.560 . 3.320 3.331 2.713 3.788 0.468 8 0 "[ . 1 . 2]" 1
647 2 89 ILE H 2 90 GLU H 3.340 . 4.880 4.614 4.511 4.707 . 0 0 "[ . 1 . 2]" 1
648 2 90 GLU H 2 91 GLY H 3.110 . 4.410 4.351 4.257 4.423 0.013 10 0 "[ . 1 . 2]" 1
649 2 90 GLU H 2 93 GLN H 3.460 . 5.120 4.005 3.654 4.697 . 0 0 "[ . 1 . 2]" 1
650 2 90 GLU H 2 94 MET H 2.780 . 3.760 3.466 2.941 4.507 0.747 17 1 "[ . 1 . + 2]" 1
651 2 91 GLY H 2 92 THR H 3.210 . 4.620 4.475 4.208 4.593 . 0 0 "[ . 1 . 2]" 1
652 2 91 GLY H 2 94 MET H 3.290 . 4.780 4.145 3.618 4.758 . 0 0 "[ . 1 . 2]" 1
653 2 91 GLY H 2 94 MET ME 2.830 . 3.860 3.708 1.917 5.762 1.902 2 4 "[ + . * 1 -. * 2]" 1
654 2 92 THR H 2 93 GLN H 2.020 . 2.240 2.411 2.046 2.629 0.389 7 0 "[ . 1 . 2]" 1
655 2 92 THR H 2 94 MET H 2.910 . 4.020 4.238 3.991 4.560 0.540 17 2 "[ . - 1 . + 2]" 1
656 2 93 GLN H 2 94 MET H 2.360 . 2.920 2.627 2.476 2.791 . 0 0 "[ . 1 . 2]" 1
657 2 93 GLN H 2 95 ALA H 3.410 . 5.020 3.933 3.734 4.405 . 0 0 "[ . 1 . 2]" 1
658 2 93 GLN H 2 96 HIS H 3.390 . 4.980 4.716 4.548 5.082 0.102 10 0 "[ . 1 . 2]" 1
659 2 94 MET H 2 95 ALA H 2.400 . 3.000 2.519 2.362 2.758 . 0 0 "[ . 1 . 2]" 1
660 2 94 MET H 2 96 HIS H 2.940 . 4.080 4.014 3.802 4.274 0.194 9 0 "[ . 1 . 2]" 1
661 2 94 MET H 2 97 CYS H 3.270 . 4.740 4.745 4.548 5.037 0.297 10 0 "[ . 1 . 2]" 1
662 2 94 MET ME 2 95 ALA H 2.960 . 4.120 3.977 2.652 5.892 1.772 2 4 "[ + . * 1 * - 2]" 1
663 2 95 ALA H 2 96 HIS H 2.320 . 2.840 2.590 2.395 2.734 . 0 0 "[ . 1 . 2]" 1
664 2 95 ALA H 2 97 CYS H 3.170 . 4.540 3.972 3.864 4.185 . 0 0 "[ . 1 . 2]" 1
665 2 95 ALA H 2 98 LEU H 3.430 . 5.060 5.025 4.826 5.185 0.125 17 0 "[ . 1 . 2]" 1
666 2 95 ALA MB 2 96 HIS H 2.690 . 3.580 2.634 2.351 2.894 . 0 0 "[ . 1 . 2]" 1
667 2 95 ALA MB 2 137 PHE QE 2.950 . 4.100 2.767 2.434 3.146 . 0 0 "[ . 1 . 2]" 1
668 2 96 HIS H 2 97 CYS H 2.270 . 2.740 2.564 2.364 2.704 . 0 0 "[ . 1 . 2]" 1
669 2 96 HIS H 2 98 LEU H 3.110 . 4.410 4.585 4.144 4.849 0.439 18 0 "[ . 1 . 2]" 1
670 2 96 HIS H 2 99 GLY H 3.290 . 4.780 4.740 4.262 4.962 0.182 9 0 "[ . 1 . 2]" 1
671 2 96 HIS H 2 137 PHE QE 3.030 . 4.260 3.496 3.058 4.000 . 0 0 "[ . 1 . 2]" 1
672 2 97 CYS H 2 98 LEU H 2.310 . 2.820 2.779 2.600 2.915 0.095 1 0 "[ . 1 . 2]" 1
673 2 97 CYS H 2 99 GLY H 2.820 . 3.840 3.856 3.594 4.141 0.301 12 0 "[ . 1 . 2]" 1
674 2 97 CYS H 2 100 ALA H 3.430 . 5.060 4.885 4.597 5.139 0.079 16 0 "[ . 1 . 2]" 1
675 2 97 CYS H 2 101 TYR H 3.420 . 5.040 4.791 4.620 5.262 0.222 16 0 "[ . 1 . 2]" 1
676 2 98 LEU H 2 99 GLY H 2.230 . 2.660 2.576 2.226 2.717 0.057 10 0 "[ . 1 . 2]" 1
677 2 98 LEU H 2 100 ALA H 3.070 . 4.340 4.250 4.103 4.374 0.034 5 0 "[ . 1 . 2]" 1
678 2 98 LEU H 2 101 TYR H 3.420 . 5.040 4.961 4.861 5.086 0.046 16 0 "[ . 1 . 2]" 1
679 2 98 LEU H 2 102 CYS H 3.400 . 5.000 4.919 4.711 5.073 0.073 10 0 "[ . 1 . 2]" 1
680 2 99 GLY H 2 100 ALA H 2.010 . 2.220 2.454 2.349 2.600 0.380 8 0 "[ . 1 . 2]" 1
681 2 99 GLY H 2 100 ALA MB 3.360 . 4.920 4.096 3.956 4.321 . 0 0 "[ . 1 . 2]" 1
682 2 99 GLY H 2 101 TYR H 2.840 . 3.880 4.120 3.886 4.419 0.539 8 2 "[ . + 1 - . 2]" 1
683 2 99 GLY H 2 102 CYS H 3.080 . 4.360 4.779 4.562 4.967 0.607 3 6 "[ *+ . * 1 ** . - 2]" 1
684 2 100 ALA H 2 101 TYR H 2.030 . 2.260 2.225 1.939 2.484 0.224 8 0 "[ . 1 . 2]" 1
685 2 100 ALA H 2 102 CYS H 2.470 . 3.150 3.379 3.095 3.676 0.526 10 1 "[ . + . 2]" 1
686 2 100 ALA MB 2 101 TYR H 2.510 . 3.220 2.335 2.059 2.681 . 0 0 "[ . 1 . 2]" 1
687 2 100 ALA MB 2 134 ASP H 3.250 . 4.700 3.288 2.814 4.549 . 0 0 "[ . 1 . 2]" 1
688 2 100 ALA MB 2 137 PHE QD 3.510 . 5.220 3.174 2.732 3.776 . 0 0 "[ . 1 . 2]" 1
689 2 101 TYR H 2 102 CYS H 2.320 . 2.840 2.685 2.552 2.968 0.128 16 0 "[ . 1 . 2]" 1
690 2 101 TYR QD 2 102 CYS H 3.110 . 4.410 3.538 3.205 3.827 . 0 0 "[ . 1 . 2]" 1
691 2 109 TYR H 2 110 ALA H 2.230 . 2.660 2.667 2.576 2.783 0.123 3 0 "[ . 1 . 2]" 1
692 2 109 TYR H 2 111 ARG H 3.050 . 4.300 3.940 3.806 4.082 . 0 0 "[ . 1 . 2]" 1
693 2 109 TYR H 2 112 GLU H 3.510 . 5.220 4.841 4.667 4.971 . 0 0 "[ . 1 . 2]" 1
694 2 109 TYR QD 2 110 ALA H 3.380 . 4.960 3.903 3.818 4.090 . 0 0 "[ . 1 . 2]" 1
695 2 110 ALA H 2 111 ARG H 2.180 . 2.560 2.662 2.596 2.734 0.174 20 0 "[ . 1 . 2]" 1
696 2 110 ALA H 2 112 GLU H 3.140 . 4.480 4.494 4.364 4.599 0.119 8 0 "[ . 1 . 2]" 1
697 2 110 ALA H 2 113 CYS H 3.470 . 5.140 4.856 4.713 4.924 . 0 0 "[ . 1 . 2]" 1
698 2 110 ALA MB 2 111 ARG H 2.600 . 3.400 2.549 2.466 2.701 . 0 0 "[ . 1 . 2]" 1
699 2 111 ARG H 2 112 GLU H 2.450 . 3.100 2.832 2.695 2.962 . 0 0 "[ . 1 . 2]" 1
700 2 111 ARG H 2 113 CYS H 3.200 . 4.600 3.989 3.860 4.174 . 0 0 "[ . 1 . 2]" 1
701 2 111 ARG H 2 114 ILE H 3.460 . 5.120 4.852 4.777 4.919 . 0 0 "[ . 1 . 2]" 1
702 2 112 GLU H 2 113 CYS H 2.420 . 3.040 2.599 2.548 2.732 . 0 0 "[ . 1 . 2]" 1
703 2 112 GLU H 2 114 ILE H 3.150 . 4.500 4.318 4.212 4.437 . 0 0 "[ . 1 . 2]" 1
704 2 113 CYS H 2 114 ILE H 2.390 . 2.980 2.667 2.588 2.749 . 0 0 "[ . 1 . 2]" 1
705 2 113 CYS H 2 115 THR H 3.390 . 4.980 4.216 4.092 4.335 . 0 0 "[ . 1 . 2]" 1
706 2 113 CYS H 2 116 SER H 3.430 . 5.060 4.689 4.614 4.780 . 0 0 "[ . 1 . 2]" 1
707 2 114 ILE H 2 115 THR H 2.440 . 3.080 2.688 2.527 2.783 . 0 0 "[ . 1 . 2]" 1
708 2 114 ILE H 2 116 SER H 2.980 . 4.160 4.012 3.899 4.118 . 0 0 "[ . 1 . 2]" 1
709 2 114 ILE H 2 117 MET H 3.520 . 5.240 4.930 4.685 5.016 . 0 0 "[ . 1 . 2]" 1
710 2 115 THR H 2 116 SER H 2.360 . 2.920 2.713 2.675 2.783 . 0 0 "[ . 1 . 2]" 1
711 2 115 THR H 2 117 MET H 3.400 . 5.000 4.369 4.241 4.450 . 0 0 "[ . 1 . 2]" 1
712 2 115 THR H 2 118 VAL H 3.520 . 5.240 4.849 4.759 4.957 . 0 0 "[ . 1 . 2]" 1
713 2 116 SER H 2 117 MET H 2.410 . 3.020 2.730 2.647 2.808 . 0 0 "[ . 1 . 2]" 1
714 2 116 SER H 2 118 VAL H 3.030 . 4.260 4.132 4.037 4.281 0.021 16 0 "[ . 1 . 2]" 1
715 2 117 MET H 2 118 VAL H 2.380 . 2.960 2.595 2.484 2.734 . 0 0 "[ . 1 . 2]" 1
716 2 117 MET H 2 119 SER H 3.150 . 4.500 4.100 3.949 4.244 . 0 0 "[ . 1 . 2]" 1
717 2 118 VAL H 2 119 SER H 2.360 . 2.920 2.676 2.600 2.735 . 0 0 "[ . 1 . 2]" 1
718 2 118 VAL MG1 2 119 SER H 3.190 . 4.580 3.384 3.243 3.477 . 0 0 "[ . 1 . 2]" 1
719 2 118 VAL MG1 2 123 PHE H 3.040 . 4.280 3.335 3.073 3.577 . 0 0 "[ . 1 . 2]" 1
720 2 118 VAL MG1 2 123 PHE QD 3.240 . 4.680 3.580 3.101 3.773 . 0 0 "[ . 1 . 2]" 1
721 2 118 VAL MG1 2 126 LEU H 3.400 . 5.000 3.477 3.061 4.053 . 0 0 "[ . 1 . 2]" 1
722 2 118 VAL MG2 2 119 SER H 3.350 . 4.900 3.810 3.637 3.992 . 0 0 "[ . 1 . 2]" 1
723 2 118 VAL MG2 2 126 LEU QD 2.540 . 3.280 2.454 1.852 3.394 0.114 2 0 "[ . 1 . 2]" 1
724 2 119 SER H 2 121 GLY H 3.030 . 4.260 4.082 3.957 4.192 . 0 0 "[ . 1 . 2]" 1
725 2 121 GLY H 2 122 THR H 2.330 . 2.860 2.631 2.523 2.727 . 0 0 "[ . 1 . 2]" 1
726 2 121 GLY H 2 123 PHE H 2.760 . 3.720 3.944 3.721 4.183 0.463 6 0 "[ . 1 . 2]" 1
727 2 122 THR H 2 123 PHE H 2.380 . 2.960 2.787 2.675 2.848 . 0 0 "[ . 1 . 2]" 1
728 2 125 GLN H 2 126 LEU H 3.330 . 4.860 4.517 4.363 4.640 . 0 0 "[ . 1 . 2]" 1
729 2 125 GLN H 3 125 GLN H 2.800 . 3.800 3.419 3.062 4.061 0.261 11 0 "[ . 1 . 2]" 1
730 2 126 LEU H 2 127 ASN H 2.740 . 3.680 4.053 3.653 4.404 0.724 19 5 "[ * - * 1 .* +2]" 1
731 2 126 LEU QD 2 128 LEU QD 3.020 . 4.240 3.117 2.018 5.391 1.151 9 1 "[ . +1 . 2]" 1
732 2 127 ASN H 2 128 LEU H 3.080 . 4.360 4.268 3.991 4.538 0.178 4 0 "[ . 1 . 2]" 1
733 2 127 ASN H 2 128 LEU QD 3.440 . 5.080 4.756 3.806 6.170 1.090 9 5 "[ .* +* *-. 2]" 1
734 2 128 LEU H 2 129 ALA H 3.260 . 4.720 4.566 4.418 4.649 . 0 0 "[ . 1 . 2]" 1
735 2 128 LEU QD 2 129 ALA H 3.050 . 4.300 2.984 1.949 3.796 . 0 0 "[ . 1 . 2]" 1
736 2 131 VAL QG 2 136 LEU MD2 3.080 . 4.360 3.357 1.991 5.043 0.683 10 2 "[ . + . - 2]" 1
737 2 133 PHE H 2 134 ASP H 2.110 . 2.420 2.698 2.431 2.844 0.424 3 0 "[ . 1 . 2]" 1
738 2 133 PHE H 2 135 ALA H 2.890 . 3.990 4.481 4.302 4.742 0.752 19 9 "[ ** * *1 * ** +-]" 1
739 2 133 PHE H 2 136 LEU H 3.350 . 4.900 5.113 4.670 5.422 0.522 13 1 "[ . 1 + . 2]" 1
740 2 133 PHE QD 2 134 ASP H 3.410 . 5.020 4.205 3.380 4.580 . 0 0 "[ . 1 . 2]" 1
741 2 134 ASP H 2 135 ALA H 2.200 . 2.600 2.701 2.497 2.836 0.236 20 0 "[ . 1 . 2]" 1
742 2 134 ASP H 2 136 LEU H 3.120 . 4.440 4.197 3.706 4.628 0.188 14 0 "[ . 1 . 2]" 1
743 2 134 ASP H 2 137 PHE H 3.450 . 5.100 4.632 4.333 4.829 . 0 0 "[ . 1 . 2]" 1
744 2 135 ALA H 2 136 LEU H 2.310 . 2.820 2.644 2.497 2.836 0.016 14 0 "[ . 1 . 2]" 1
745 2 135 ALA H 2 137 PHE H 3.040 . 4.280 3.885 3.716 4.129 . 0 0 "[ . 1 . 2]" 1
746 2 135 ALA MB 2 136 LEU H 2.540 . 3.280 2.484 2.253 2.742 . 0 0 "[ . 1 . 2]" 1
747 2 135 ALA MB 2 136 LEU MD2 3.380 . 4.960 3.928 1.993 5.388 0.428 17 0 "[ . 1 . 2]" 1
748 2 136 LEU H 2 137 PHE H 2.380 . 2.960 2.510 2.342 2.705 . 0 0 "[ . 1 . 2]" 1
749 2 136 LEU H 2 138 MET H 3.230 . 4.660 4.206 3.780 4.486 . 0 0 "[ . 1 . 2]" 1
750 2 137 PHE H 2 138 MET H 2.390 . 2.980 2.594 2.500 2.716 . 0 0 "[ . 1 . 2]" 1
751 2 137 PHE H 2 139 ASN H 3.110 . 4.420 4.063 3.783 4.302 . 0 0 "[ . 1 . 2]" 1
752 2 137 PHE H 2 140 TYR H 3.410 . 5.020 4.697 4.430 5.100 0.080 6 0 "[ . 1 . 2]" 1
753 2 137 PHE QD 2 138 MET H 3.120 . 4.440 3.917 3.482 4.318 . 0 0 "[ . 1 . 2]" 1
754 2 137 PHE QD 2 141 LEU MD1 3.390 . 4.980 2.897 2.338 3.317 . 0 0 "[ . 1 . 2]" 1
755 2 137 PHE QD 2 141 LEU MD2 3.470 . 5.140 3.645 3.208 4.421 . 0 0 "[ . 1 . 2]" 1
756 2 137 PHE QE 2 141 LEU MD1 3.070 . 4.340 2.306 2.058 3.229 . 0 0 "[ . 1 . 2]" 1
757 2 137 PHE QE 2 141 LEU MD2 2.890 . 3.980 2.904 2.491 3.558 . 0 0 "[ . 1 . 2]" 1
758 2 138 MET H 2 139 ASN H 2.360 . 2.920 2.622 2.479 2.717 . 0 0 "[ . 1 . 2]" 1
759 2 138 MET H 2 140 TYR H 3.120 . 4.440 3.912 3.755 4.088 . 0 0 "[ . 1 . 2]" 1
760 2 139 ASN H 2 140 TYR H 2.210 . 2.620 2.421 2.285 2.498 . 0 0 "[ . 1 . 2]" 1
761 2 139 ASN H 2 141 LEU H 3.030 . 4.260 4.098 3.899 4.336 0.076 8 0 "[ . 1 . 2]" 1
762 2 140 TYR H 2 141 LEU H 2.350 . 2.900 2.577 2.318 2.751 . 0 0 "[ . 1 . 2]" 1
763 2 140 TYR QD 2 141 LEU H 3.290 . 4.780 4.279 3.917 4.542 . 0 0 "[ . 1 . 2]" 1
764 2 140 TYR QD 2 141 LEU MD2 3.400 . 5.000 2.259 1.765 2.556 0.035 8 0 "[ . 1 . 2]" 1
765 3 9 MET H 3 10 THR H 2.890 . 3.980 3.800 3.639 4.281 0.301 13 0 "[ . 1 . 2]" 1
766 3 9 MET H 3 89 ILE H 2.940 . 4.080 4.733 3.375 6.345 2.265 13 11 "[* **.-** 1 *+** *]" 1
767 3 9 MET ME 3 97 CYS H 3.480 . 5.160 5.557 4.233 6.825 1.665 15 8 "[ * .** *1 +* - *]" 1
768 3 10 THR H 3 11 PHE H 2.800 . 3.800 4.034 3.707 4.272 0.472 8 0 "[ . 1 . 2]" 1
769 3 10 THR H 3 87 ALA H 2.770 . 3.740 2.954 2.494 3.562 . 0 0 "[ . 1 . 2]" 1
770 3 10 THR H 3 89 ILE H 2.960 . 4.120 4.391 3.375 5.324 1.204 20 5 "[ -.** 1 . * +]" 1
771 3 11 PHE H 3 12 GLN H 3.320 . 4.830 4.310 4.125 4.541 . 0 0 "[ . 1 . 2]" 1
772 3 11 PHE QD 3 12 GLN H 2.470 . 3.140 2.817 1.935 3.904 0.764 19 6 "[* . - 1 * *.* +2]" 1
773 3 11 PHE QD 3 101 TYR QD 3.330 . 4.860 4.307 3.469 4.938 0.078 15 0 "[ . 1 . 2]" 1
774 3 11 PHE QD 3 101 TYR QE 3.180 . 4.560 2.756 2.191 3.291 . 0 0 "[ . 1 . 2]" 1
775 3 11 PHE QE 3 12 GLN H 3.060 . 4.320 4.339 3.869 4.989 0.669 19 3 "[ . 1 *.- +2]" 1
776 3 11 PHE QE 3 84 PHE QD 3.020 . 4.240 2.618 1.866 3.470 . 0 0 "[ . 1 . 2]" 1
777 3 11 PHE QE 3 84 PHE QE 3.410 . 5.020 3.941 3.610 4.224 . 0 0 "[ . 1 . 2]" 1
778 3 11 PHE QE 3 101 TYR QD 3.130 . 4.460 3.428 2.612 3.963 . 0 0 "[ . 1 . 2]" 1
779 3 11 PHE QE 3 101 TYR QE 3.330 . 4.860 2.704 2.227 3.363 . 0 0 "[ . 1 . 2]" 1
780 3 11 PHE QE 3 102 CYS H 3.330 . 4.860 5.279 4.299 6.045 1.185 15 12 "[ *-*.* **** * + * *]" 1
781 3 12 GLN H 3 13 ILE H 2.930 . 4.060 4.137 3.925 4.296 0.236 13 0 "[ . 1 . 2]" 1
782 3 12 GLN H 3 85 SER H 2.880 . 3.960 3.424 2.975 3.841 . 0 0 "[ . 1 . 2]" 1
783 3 13 ILE H 3 14 GLN H 3.320 . 4.840 4.461 4.412 4.517 . 0 0 "[ . 1 . 2]" 1
784 3 14 GLN H 3 15 ARG H 2.090 . 2.380 2.305 2.131 2.463 0.083 20 0 "[ . 1 . 2]" 1
785 3 14 GLN H 3 83 ILE H 3.390 . 4.980 4.621 4.240 4.891 . 0 0 "[ . 1 . 2]" 1
786 3 14 GLN H 3 84 PHE QD 3.250 . 4.700 3.746 3.116 4.139 . 0 0 "[ . 1 . 2]" 1
787 3 14 GLN H 3 85 SER H 3.300 . 4.800 3.768 3.461 4.155 . 0 0 "[ . 1 . 2]" 1
788 3 15 ARG H 3 16 ILE H 3.050 . 4.300 4.114 3.934 4.270 . 0 0 "[ . 1 . 2]" 1
789 3 15 ARG H 3 83 ILE H 2.620 . 3.440 3.313 3.048 3.484 0.044 19 0 "[ . 1 . 2]" 1
790 3 16 ILE H 3 17 TYR H 3.270 . 4.740 4.424 4.308 4.539 . 0 0 "[ . 1 . 2]" 1
791 3 17 TYR H 3 18 THR H 3.180 . 4.560 4.325 4.256 4.356 . 0 0 "[ . 1 . 2]" 1
792 3 17 TYR H 3 81 GLY H 3.000 . 4.200 3.934 3.787 4.095 . 0 0 "[ . 1 . 2]" 1
793 3 17 TYR H 3 82 GLY H 3.520 . 5.240 5.023 4.890 5.192 . 0 0 "[ . 1 . 2]" 1
794 3 17 TYR QD 3 18 THR H 2.930 . 4.060 3.528 3.236 3.899 . 0 0 "[ . 1 . 2]" 1
795 3 17 TYR QD 4 28 ALA MB 3.260 . 4.720 3.197 3.062 3.407 . 0 0 "[ . 1 . 2]" 1
796 3 17 TYR QD 4 32 PHE QE 3.070 . 4.340 3.263 3.001 3.433 . 0 0 "[ . 1 . 2]" 1
797 3 17 TYR QE 3 83 ILE H 3.470 . 5.140 3.003 2.690 3.351 . 0 0 "[ . 1 . 2]" 1
798 3 17 TYR QE 4 28 ALA MB 2.930 . 4.060 1.960 1.824 2.151 . 0 0 "[ . 1 . 2]" 1
799 3 17 TYR QE 4 32 PHE QE 3.330 . 4.860 2.888 2.820 2.996 . 0 0 "[ . 1 . 2]" 1
800 3 18 THR H 3 19 LYS H 3.200 . 4.600 4.351 4.248 4.426 . 0 0 "[ . 1 . 2]" 1
801 3 18 THR H 3 81 GLY H 3.400 . 5.000 4.846 4.618 5.019 0.019 16 0 "[ . 1 . 2]" 1
802 3 18 THR H 4 121 GLY H 3.130 . 4.460 4.238 4.069 4.488 0.028 15 0 "[ . 1 . 2]" 1
803 3 18 THR H 4 122 THR H 3.410 . 5.020 4.674 4.467 4.874 . 0 0 "[ . 1 . 2]" 1
804 3 19 LYS H 3 20 ASP H 2.190 . 2.580 2.413 2.221 2.514 . 0 0 "[ . 1 . 2]" 1
805 3 19 LYS H 3 79 GLN H 3.520 . 5.240 4.686 4.230 5.072 . 0 0 "[ . 1 . 2]" 1
806 3 19 LYS H 3 81 GLY H 2.240 . 2.680 2.494 2.234 2.824 0.144 3 0 "[ . 1 . 2]" 1
807 3 20 ASP H 3 21 ILE H 3.160 . 4.520 4.241 4.171 4.313 . 0 0 "[ . 1 . 2]" 1
808 3 20 ASP H 3 79 GLN H 2.790 . 3.780 3.227 3.040 3.553 . 0 0 "[ . 1 . 2]" 1
809 3 20 ASP H 3 81 GLY H 3.410 . 5.020 4.653 4.442 4.824 . 0 0 "[ . 1 . 2]" 1
810 3 21 ILE H 3 22 SER H 3.220 . 4.640 4.288 4.226 4.350 . 0 0 "[ . 1 . 2]" 1
811 3 21 ILE H 3 79 GLN H 3.450 . 5.100 4.817 4.679 5.060 . 0 0 "[ . 1 . 2]" 1
812 3 21 ILE H 4 23 PHE H 2.220 . 2.640 2.865 2.706 3.146 0.506 1 1 "[+ . 1 . 2]" 1
813 3 21 ILE H 4 23 PHE QD 3.260 . 4.720 3.372 2.917 4.021 . 0 0 "[ . 1 . 2]" 1
814 3 22 SER H 3 23 PHE H 3.080 . 4.360 4.243 4.193 4.272 . 0 0 "[ . 1 . 2]" 1
815 3 22 SER H 3 77 GLU H 2.830 . 3.860 3.319 2.947 3.750 . 0 0 "[ . 1 . 2]" 1
816 3 22 SER H 3 78 VAL H 3.450 . 5.100 5.092 4.922 5.241 0.141 2 0 "[ . 1 . 2]" 1
817 3 22 SER H 3 78 VAL MG2 3.040 . 4.280 3.284 2.982 3.673 . 0 0 "[ . 1 . 2]" 1
818 3 22 SER H 3 79 GLN H 3.280 . 4.760 5.323 4.897 5.528 0.768 12 15 "[****.** **+ *.-****]" 1
819 3 22 SER H 4 23 PHE H 3.420 . 5.040 5.027 4.835 5.247 0.207 14 0 "[ . 1 . 2]" 1
820 3 23 PHE H 3 24 GLU H 2.950 . 4.100 4.170 3.792 4.346 0.246 11 0 "[ . 1 . 2]" 1
821 3 23 PHE H 4 21 ILE H 2.800 . 3.800 2.670 2.517 2.938 . 0 0 "[ . 1 . 2]" 1
822 3 23 PHE QD 3 24 GLU H 2.920 . 4.040 3.447 3.172 3.941 . 0 0 "[ . 1 . 2]" 1
823 3 23 PHE QD 4 21 ILE H 3.230 . 4.660 4.119 3.900 4.362 . 0 0 "[ . 1 . 2]" 1
824 3 23 PHE QE 3 25 ALA MB 3.110 . 4.420 2.559 2.263 2.835 . 0 0 "[ . 1 . 2]" 1
825 3 23 PHE QE 3 74 PHE QD 3.500 . 5.200 2.718 2.270 3.605 . 0 0 "[ . 1 . 2]" 1
826 3 23 PHE QE 3 121 GLY H 3.500 . 5.200 3.898 3.660 4.122 . 0 0 "[ . 1 . 2]" 1
827 3 24 GLU H 3 25 ALA H 3.250 . 4.700 4.078 3.881 4.206 . 0 0 "[ . 1 . 2]" 1
828 3 24 GLU H 3 75 LEU H 2.710 . 3.620 3.039 2.811 3.317 . 0 0 "[ . 1 . 2]" 1
829 3 24 GLU H 4 21 ILE H 3.490 . 5.180 5.061 4.870 5.131 . 0 0 "[ . 1 . 2]" 1
830 3 25 ALA H 4 21 ILE H 3.520 . 5.240 5.367 5.119 5.655 0.415 15 0 "[ . 1 . 2]" 1
831 3 25 ALA MB 3 28 ALA H 3.360 . 4.920 3.255 3.141 3.420 . 0 0 "[ . 1 . 2]" 1
832 3 25 ALA MB 3 28 ALA MB 3.140 . 4.480 1.993 1.876 2.141 . 0 0 "[ . 1 . 2]" 1
833 3 25 ALA MB 3 123 PHE QE 3.460 . 5.120 2.356 2.147 2.602 . 0 0 "[ . 1 . 2]" 1
834 3 27 ASN H 3 28 ALA H 2.560 . 3.320 2.690 2.493 2.971 . 0 0 "[ . 1 . 2]" 1
835 3 28 ALA H 3 30 HIS H 2.960 . 4.120 4.527 4.326 4.711 0.591 16 4 "[ . 1-* .+* 2]" 1
836 3 28 ALA H 3 31 VAL H 3.340 . 4.880 4.829 4.759 4.943 0.063 16 0 "[ . 1 . 2]" 1
837 3 28 ALA MB 3 32 PHE QE 3.340 . 4.880 2.878 2.761 2.959 . 0 0 "[ . 1 . 2]" 1
838 3 28 ALA MB 4 17 TYR QD 3.340 . 4.880 2.885 2.680 3.345 . 0 0 "[ . 1 . 2]" 1
839 3 28 ALA MB 4 17 TYR QE 3.140 . 4.480 1.981 1.727 2.411 0.073 15 0 "[ . 1 . 2]" 1
840 3 30 HIS H 3 31 VAL H 2.350 . 2.900 2.627 2.592 2.668 . 0 0 "[ . 1 . 2]" 1
841 3 30 HIS H 3 32 PHE H 2.930 . 4.060 4.116 3.935 4.333 0.273 11 0 "[ . 1 . 2]" 1
842 3 31 VAL H 3 32 PHE H 2.380 . 2.960 2.498 2.409 2.621 . 0 0 "[ . 1 . 2]" 1
843 3 31 VAL H 3 33 GLN H 3.190 . 4.580 4.210 4.064 4.480 . 0 0 "[ . 1 . 2]" 1
844 3 31 VAL MG1 3 32 PHE H 2.380 . 2.960 2.586 2.505 2.778 . 0 0 "[ . 1 . 2]" 1
845 3 31 VAL MG1 3 32 PHE QD 3.110 . 4.410 2.932 2.583 3.221 . 0 0 "[ . 1 . 2]" 1
846 3 31 VAL MG1 3 32 PHE QE 3.380 . 4.960 3.364 3.162 3.695 . 0 0 "[ . 1 . 2]" 1
847 3 31 VAL MG1 3 123 PHE QE 2.980 . 4.160 2.388 2.205 2.633 . 0 0 "[ . 1 . 2]" 1
848 3 31 VAL MG2 3 32 PHE H 3.380 . 4.960 4.081 3.929 4.187 . 0 0 "[ . 1 . 2]" 1
849 3 31 VAL MG2 3 68 LEU MD1 2.470 . 3.140 1.905 1.757 2.014 0.043 10 0 "[ . 1 . 2]" 1
850 3 31 VAL MG2 3 73 ALA H 3.440 . 5.080 3.929 3.599 4.170 . 0 0 "[ . 1 . 2]" 1
851 3 31 VAL MG2 3 73 ALA MB 2.670 . 3.540 2.680 2.387 3.019 . 0 0 "[ . 1 . 2]" 1
852 3 32 PHE H 3 33 GLN H 2.350 . 2.900 2.653 2.550 2.777 . 0 0 "[ . 1 . 2]" 1
853 3 32 PHE H 3 34 LYS H 3.200 . 4.600 4.171 3.905 4.712 0.112 20 0 "[ . 1 . 2]" 1
854 3 32 PHE QD 3 33 GLN H 3.340 . 4.880 4.646 4.482 4.727 . 0 0 "[ . 1 . 2]" 1
855 3 32 PHE QE 4 17 TYR QD 3.080 . 4.360 3.156 2.984 3.438 . 0 0 "[ . 1 . 2]" 1
856 3 32 PHE QE 4 17 TYR QE 3.440 . 5.080 2.962 2.858 3.117 . 0 0 "[ . 1 . 2]" 1
857 3 33 GLN H 3 34 LYS H 2.390 . 2.980 2.674 2.368 3.158 0.178 20 0 "[ . 1 . 2]" 1
858 3 34 LYS H 3 35 ASP H 3.280 . 4.760 4.550 4.407 4.616 . 0 0 "[ . 1 . 2]" 1
859 3 35 ASP H 3 36 TRP H 3.250 . 4.700 4.492 4.258 4.596 . 0 0 "[ . 1 . 2]" 1
860 3 36 TRP H 3 37 GLN H 2.950 . 4.100 4.109 3.711 4.362 0.262 17 0 "[ . 1 . 2]" 1
861 3 37 GLN H 3 68 LEU MD2 2.320 . 2.840 1.997 1.702 2.562 0.098 18 0 "[ . 1 . 2]" 1
862 3 39 GLU H 3 40 VAL H 3.090 . 4.380 4.161 3.860 4.412 0.032 4 0 "[ . 1 . 2]" 1
863 3 39 GLU H 3 67 SER H 2.320 . 2.840 2.866 2.200 3.624 0.784 12 3 "[ . 1 + . -* 2]" 1
864 3 39 GLU H 3 68 LEU H 3.440 . 5.080 4.681 4.458 5.067 . 0 0 "[ . 1 . 2]" 1
865 3 39 GLU H 3 69 GLY H 3.320 . 4.830 4.092 3.031 4.790 . 0 0 "[ . 1 . 2]" 1
866 3 40 VAL H 3 41 LYS H 3.190 . 4.580 4.317 4.130 4.555 . 0 0 "[ . 1 . 2]" 1
867 3 40 VAL QG 3 41 LYS H 2.960 . 4.120 3.344 2.405 3.752 . 0 0 "[ . 1 . 2]" 1
868 3 40 VAL QG 3 42 LEU H 3.300 . 4.800 4.110 3.056 5.054 0.254 12 0 "[ . 1 . 2]" 1
869 3 40 VAL QG 3 42 LEU QD 2.240 . 2.680 3.300 1.974 5.132 2.452 13 11 "[ *. *- ***+ .****2]" 1
870 3 41 LYS H 3 42 LEU H 2.980 . 4.160 4.153 3.914 4.332 0.172 4 0 "[ . 1 . 2]" 1
871 3 41 LYS H 3 42 LEU QD 3.020 . 4.240 4.873 3.581 6.206 1.966 8 11 "[ *. + -****.****2]" 1
872 3 41 LYS H 3 64 VAL QG 3.490 . 5.180 4.125 3.356 4.899 . 0 0 "[ . 1 . 2]" 1
873 3 41 LYS H 3 65 THR H 2.890 . 3.980 3.499 3.029 3.990 0.010 8 0 "[ . 1 . 2]" 1
874 3 41 LYS H 3 67 SER H 3.340 . 4.880 4.664 4.097 5.302 0.422 13 0 "[ . 1 . 2]" 1
875 3 42 LEU H 3 43 ASP H 3.250 . 4.700 4.484 4.271 4.606 . 0 0 "[ . 1 . 2]" 1
876 3 42 LEU H 3 65 THR H 3.260 . 4.720 4.884 4.547 5.164 0.444 10 0 "[ . 1 . 2]" 1
877 3 42 LEU QD 3 43 ASP H 3.220 . 4.640 3.152 1.805 4.347 . 0 0 "[ . 1 . 2]" 1
878 3 42 LEU QD 3 44 LEU QD 3.120 . 4.440 3.124 1.986 5.189 0.749 2 1 "[ + . 1 . 2]" 1
879 3 42 LEU QD 3 64 VAL QG 3.360 . 4.920 2.393 1.818 4.727 . 0 0 "[ . 1 . 2]" 1
880 3 42 LEU QD 3 128 LEU QD 3.310 . 4.160 2.119 1.625 4.723 0.563 16 1 "[ . 1 .+ 2]" 1
881 3 43 ASP H 3 44 LEU H 3.250 . 4.700 4.179 3.864 4.394 . 0 0 "[ . 1 . 2]" 1
882 3 43 ASP H 3 63 THR H 2.530 . 3.260 3.154 2.385 3.850 0.590 9 1 "[ . +1 . 2]" 1
883 3 43 ASP H 3 64 VAL H 3.530 . 5.250 4.964 4.589 5.286 0.036 16 0 "[ . 1 . 2]" 1
884 3 43 ASP H 3 65 THR H 3.350 . 4.900 4.585 4.093 5.065 0.165 7 0 "[ . 1 . 2]" 1
885 3 44 LEU H 3 45 ASP H 3.150 . 4.500 4.380 4.174 4.545 0.045 19 0 "[ . 1 . 2]" 1
886 3 44 LEU QD 3 45 ASP H 3.520 . 5.240 3.366 2.331 4.376 . 0 0 "[ . 1 . 2]" 1
887 3 44 LEU QD 3 128 LEU QD 2.860 . 3.920 3.364 1.904 4.093 0.173 10 0 "[ . 1 . 2]" 1
888 3 44 LEU QD 3 131 VAL QG 3.460 . 5.120 2.761 1.701 4.011 0.099 19 0 "[ . 1 . 2]" 1
889 3 44 LEU QD 3 133 PHE QE 3.230 . 4.660 2.255 1.586 4.284 0.214 6 0 "[ . 1 . 2]" 1
890 3 45 ASP H 3 46 THR H 3.130 . 4.460 4.318 4.124 4.478 0.018 18 0 "[ . 1 . 2]" 1
891 3 45 ASP H 3 60 LEU MD2 3.160 . 4.520 3.114 2.718 3.461 . 0 0 "[ . 1 . 2]" 1
892 3 45 ASP H 3 61 ARG H 3.050 . 4.300 3.579 3.370 3.940 . 0 0 "[ . 1 . 2]" 1
893 3 45 ASP H 3 63 THR H 3.460 . 5.120 4.981 4.008 5.518 0.398 20 0 "[ . 1 . 2]" 1
894 3 46 THR H 3 47 ALA H 3.220 . 4.640 4.266 4.092 4.421 . 0 0 "[ . 1 . 2]" 1
895 3 46 THR H 3 61 ARG H 3.370 . 4.940 4.748 4.507 4.967 0.027 12 0 "[ . 1 . 2]" 1
896 3 47 ALA H 3 48 SER H 3.230 . 4.660 4.378 4.185 4.507 . 0 0 "[ . 1 . 2]" 1
897 3 47 ALA H 3 58 VAL MG1 3.400 . 5.000 3.941 3.325 4.402 . 0 0 "[ . 1 . 2]" 1
898 3 47 ALA H 3 59 VAL H 2.730 . 3.660 3.144 2.759 3.578 . 0 0 "[ . 1 . 2]" 1
899 3 47 ALA H 3 60 LEU H 3.510 . 5.220 5.149 4.852 5.465 0.245 8 0 "[ . 1 . 2]" 1
900 3 47 ALA H 3 61 ARG H 3.010 . 4.220 4.462 3.711 4.802 0.582 14 4 "[ ** - 1 +. 2]" 1
901 3 47 ALA MB 3 48 SER H 2.480 . 3.160 2.620 2.270 2.969 . 0 0 "[ . 1 . 2]" 1
902 3 47 ALA MB 3 59 VAL H 3.280 . 4.760 3.964 3.209 4.453 . 0 0 "[ . 1 . 2]" 1
903 3 48 SER H 3 49 SER H 3.150 . 4.500 4.378 4.288 4.451 . 0 0 "[ . 1 . 2]" 1
904 3 48 SER H 3 59 VAL H 3.200 . 4.600 4.916 4.554 5.245 0.645 14 1 "[ . 1 +. 2]" 1
905 3 49 SER H 3 50 GLN H 3.140 . 4.480 4.288 4.175 4.401 . 0 0 "[ . 1 . 2]" 1
906 3 49 SER H 3 57 GLU H 2.520 . 3.240 3.182 2.622 3.515 0.275 19 0 "[ . 1 . 2]" 1
907 3 49 SER H 3 58 VAL H 3.390 . 4.980 5.096 4.939 5.219 0.239 17 0 "[ . 1 . 2]" 1
908 3 49 SER H 3 59 VAL H 3.340 . 4.880 5.345 4.898 5.792 0.912 2 10 "[ +*-. * * *** * *]" 1
909 3 50 GLN H 3 51 LEU H 3.330 . 4.860 4.465 4.372 4.588 . 0 0 "[ . 1 . 2]" 1
910 3 50 GLN H 3 56 TYR QD 3.370 . 4.940 4.346 3.431 7.117 2.177 1 1 "[+ . 1 . 2]" 1
911 3 50 GLN H 3 56 TYR QE 3.060 . 4.320 3.831 2.837 7.622 3.302 1 1 "[+ . 1 . 2]" 1
912 3 50 GLN H 3 57 GLU H 3.250 . 4.700 5.000 4.738 5.162 0.462 5 0 "[ . 1 . 2]" 1
913 3 51 LEU H 3 52 ALA H 1.970 . 2.140 2.166 1.991 2.337 0.197 1 0 "[ . 1 . 2]" 1
914 3 51 LEU H 3 55 VAL H 3.180 . 4.560 4.750 4.552 4.980 0.420 8 0 "[ . 1 . 2]" 1
915 3 51 LEU H 3 55 VAL MG1 3.120 . 4.440 3.466 3.220 3.766 . 0 0 "[ . 1 . 2]" 1
916 3 51 LEU H 3 56 TYR H 3.410 . 5.020 4.882 4.659 5.248 0.228 1 0 "[ . 1 . 2]" 1
917 3 51 LEU H 3 56 TYR QD 3.490 . 5.180 4.754 3.779 6.479 1.299 1 1 "[+ . 1 . 2]" 1
918 3 51 LEU H 3 57 GLU H 2.940 . 4.080 3.627 3.317 4.004 . 0 0 "[ . 1 . 2]" 1
919 3 51 LEU MD1 3 55 VAL MG1 2.750 . 3.700 2.361 2.179 2.738 . 0 0 "[ . 1 . 2]" 1
920 3 51 LEU MD1 3 57 GLU H 3.340 . 4.880 3.553 3.201 4.042 . 0 0 "[ . 1 . 2]" 1
921 3 51 LEU MD2 3 57 GLU H 3.020 . 4.240 3.768 3.374 4.463 0.223 1 0 "[ . 1 . 2]" 1
922 3 52 ALA H 3 53 ASP H 3.170 . 4.540 4.336 4.296 4.386 . 0 0 "[ . 1 . 2]" 1
923 3 52 ALA H 3 55 VAL H 2.720 . 3.640 3.543 3.426 3.786 0.146 8 0 "[ . 1 . 2]" 1
924 3 52 ALA H 3 55 VAL MG1 2.870 . 3.940 3.290 3.057 3.497 . 0 0 "[ . 1 . 2]" 1
925 3 52 ALA H 3 55 VAL MG2 3.180 . 4.560 4.051 3.576 4.360 . 0 0 "[ . 1 . 2]" 1
926 3 52 ALA MB 3 53 ASP H 2.310 . 2.820 1.995 1.848 2.458 . 0 0 "[ . 1 . 2]" 1
927 3 52 ALA MB 3 55 VAL MG2 3.090 . 4.380 2.414 2.035 2.751 . 0 0 "[ . 1 . 2]" 1
928 3 53 ASP H 3 54 ASP H 3.270 . 4.740 4.462 4.343 4.589 . 0 0 "[ . 1 . 2]" 1
929 3 53 ASP H 3 55 VAL H 3.350 . 4.900 4.207 4.005 4.439 . 0 0 "[ . 1 . 2]" 1
930 3 53 ASP H 3 55 VAL MG2 3.400 . 5.000 4.157 3.710 4.496 . 0 0 "[ . 1 . 2]" 1
931 3 54 ASP H 3 55 VAL H 2.360 . 2.920 2.751 2.580 2.904 . 0 0 "[ . 1 . 2]" 1
932 3 55 VAL H 3 56 TYR H 2.920 . 4.040 4.154 3.892 4.432 0.392 19 0 "[ . 1 . 2]" 1
933 3 55 VAL H 3 86 ILE H 3.460 . 5.120 5.027 4.649 5.439 0.319 12 0 "[ . 1 . 2]" 1
934 3 55 VAL MG1 3 56 TYR H 3.070 . 4.340 3.141 2.786 3.458 . 0 0 "[ . 1 . 2]" 1
935 3 55 VAL MG1 3 84 PHE H 3.480 . 5.160 3.940 3.513 4.308 . 0 0 "[ . 1 . 2]" 1
936 3 56 TYR H 3 57 GLU H 3.210 . 4.620 4.307 4.155 4.465 . 0 0 "[ . 1 . 2]" 1
937 3 56 TYR H 3 84 PHE H 2.820 . 3.840 3.663 3.263 4.088 0.248 15 0 "[ . 1 . 2]" 1
938 3 56 TYR H 3 86 ILE H 3.060 . 4.320 3.711 3.229 4.260 . 0 0 "[ . 1 . 2]" 1
939 3 56 TYR QD 3 57 GLU H 3.040 . 4.280 3.510 2.490 3.988 . 0 0 "[ . 1 . 2]" 1
940 3 56 TYR QD 3 98 LEU QD 3.020 . 4.240 2.729 1.879 4.827 0.587 1 1 "[+ . 1 . 2]" 1
941 3 56 TYR QE 3 98 LEU QD 3.330 . 4.860 2.964 1.761 3.625 0.039 4 0 "[ . 1 . 2]" 1
942 3 57 GLU H 3 58 VAL H 3.290 . 4.780 4.424 4.059 4.565 . 0 0 "[ . 1 . 2]" 1
943 3 58 VAL H 3 59 VAL H 3.080 . 4.360 4.395 4.261 4.476 0.116 3 0 "[ . 1 . 2]" 1
944 3 58 VAL H 3 82 GLY H 2.450 . 3.100 3.254 2.885 3.491 0.391 20 0 "[ . 1 . 2]" 1
945 3 58 VAL H 3 84 PHE H 3.400 . 5.000 4.110 3.887 4.644 . 0 0 "[ . 1 . 2]" 1
946 3 58 VAL MG1 3 59 VAL H 2.840 . 3.880 2.496 2.191 2.915 . 0 0 "[ . 1 . 2]" 1
947 3 58 VAL MG2 3 84 PHE QD 3.520 . 5.240 2.553 2.293 2.760 . 0 0 "[ . 1 . 2]" 1
948 3 58 VAL MG2 3 98 LEU QD 3.000 . 4.200 2.395 1.903 4.098 . 0 0 "[ . 1 . 2]" 1
949 3 59 VAL H 3 60 LEU H 3.250 . 4.700 4.278 4.013 4.443 . 0 0 "[ . 1 . 2]" 1
950 3 59 VAL MG1 3 60 LEU H 2.580 . 3.360 2.582 2.139 3.183 . 0 0 "[ . 1 . 2]" 1
951 3 59 VAL MG1 3 80 GLN H 3.300 . 4.800 3.461 3.142 4.131 . 0 0 "[ . 1 . 2]" 1
952 3 59 VAL MG2 3 60 LEU H 3.410 . 5.020 4.098 3.965 4.236 . 0 0 "[ . 1 . 2]" 1
953 3 59 VAL MG2 3 82 GLY H 3.380 . 4.960 3.458 2.933 3.957 . 0 0 "[ . 1 . 2]" 1
954 3 60 LEU H 3 61 ARG H 3.230 . 4.660 4.072 3.899 4.268 . 0 0 "[ . 1 . 2]" 1
955 3 60 LEU H 3 80 GLN H 2.700 . 3.600 3.445 3.144 4.077 0.477 14 0 "[ . 1 . 2]" 1
956 3 60 LEU H 3 81 GLY H 3.250 . 4.700 4.672 4.349 4.950 0.250 14 0 "[ . 1 . 2]" 1
957 3 60 LEU MD1 3 62 VAL MG2 2.870 . 3.940 2.146 1.838 2.703 . 0 0 "[ . 1 . 2]" 1
958 3 60 LEU MD1 3 110 ALA H 3.110 . 4.410 3.991 3.879 4.137 . 0 0 "[ . 1 . 2]" 1
959 3 60 LEU MD1 3 110 ALA MB 2.520 . 3.240 2.338 2.186 2.430 . 0 0 "[ . 1 . 2]" 1
960 3 60 LEU MD2 3 61 ARG H 2.320 . 2.840 2.503 2.322 2.625 . 0 0 "[ . 1 . 2]" 1
961 3 60 LEU MD2 3 62 VAL H 3.260 . 4.720 4.073 3.578 4.662 . 0 0 "[ . 1 . 2]" 1
962 3 60 LEU MD2 3 62 VAL MG2 2.450 . 3.100 2.420 1.875 2.860 . 0 0 "[ . 1 . 2]" 1
963 3 60 LEU MD2 3 110 ALA MB 3.460 . 5.120 3.998 3.475 4.345 . 0 0 "[ . 1 . 2]" 1
964 3 61 ARG H 3 62 VAL H 3.110 . 4.420 4.316 4.153 4.525 0.105 4 0 "[ . 1 . 2]" 1
965 3 61 ARG H 3 62 VAL MG2 3.430 . 5.060 4.344 4.186 4.515 . 0 0 "[ . 1 . 2]" 1
966 3 62 VAL H 3 63 THR H 3.070 . 4.340 4.317 4.096 4.475 0.135 5 0 "[ . 1 . 2]" 1
967 3 62 VAL H 3 78 VAL H 2.680 . 3.560 3.198 2.818 3.557 . 0 0 "[ . 1 . 2]" 1
968 3 62 VAL H 3 80 GLN H 3.300 . 4.800 4.154 3.927 4.517 . 0 0 "[ . 1 . 2]" 1
969 3 62 VAL MG1 3 63 THR H 2.940 . 4.080 2.738 2.505 3.267 . 0 0 "[ . 1 . 2]" 1
970 3 62 VAL MG1 3 64 VAL QG 2.790 . 3.780 2.555 2.105 2.948 . 0 0 "[ . 1 . 2]" 1
971 3 62 VAL MG1 3 128 LEU QD 3.320 . 4.840 2.619 1.804 3.195 . 0 0 "[ . 1 . 2]" 1
972 3 62 VAL MG2 3 110 ALA MB 2.880 . 3.960 2.064 1.831 2.195 . 0 0 "[ . 1 . 2]" 1
973 3 63 THR H 3 64 VAL H 3.200 . 4.600 4.245 4.076 4.490 . 0 0 "[ . 1 . 2]" 1
974 3 64 VAL H 3 65 THR H 3.090 . 4.380 4.218 3.928 4.402 0.022 20 0 "[ . 1 . 2]" 1
975 3 64 VAL H 3 75 LEU MD1 3.380 . 4.960 4.038 3.372 4.306 . 0 0 "[ . 1 . 2]" 1
976 3 64 VAL H 3 76 CYS H 2.670 . 3.540 3.176 2.853 3.605 0.065 15 0 "[ . 1 . 2]" 1
977 3 64 VAL H 3 77 GLU H 3.390 . 4.980 4.959 4.770 5.121 0.141 3 0 "[ . 1 . 2]" 1
978 3 64 VAL QG 3 65 THR H 2.930 . 4.060 2.888 2.526 3.166 . 0 0 "[ . 1 . 2]" 1
979 3 64 VAL QG 3 126 LEU QD 2.750 . 3.360 1.810 1.559 2.354 0.241 18 0 "[ . 1 . 2]" 1
980 3 65 THR H 3 66 ALA H 3.230 . 4.660 4.405 4.148 4.527 . 0 0 "[ . 1 . 2]" 1
981 3 66 ALA H 3 67 SER H 3.070 . 4.340 4.130 3.869 4.414 0.074 2 0 "[ . 1 . 2]" 1
982 3 66 ALA H 3 73 ALA H 3.270 . 4.740 4.458 4.099 4.847 0.107 2 0 "[ . 1 . 2]" 1
983 3 66 ALA H 3 74 PHE H 2.640 . 3.480 3.326 3.027 3.452 . 0 0 "[ . 1 . 2]" 1
984 3 66 ALA H 3 75 LEU MD2 3.460 . 5.120 3.813 3.532 4.064 . 0 0 "[ . 1 . 2]" 1
985 3 66 ALA H 3 76 CYS H 3.420 . 5.040 5.408 4.869 5.925 0.885 6 6 "[ .+* -1 .* **]" 1
986 3 66 ALA MB 3 67 SER H 3.030 . 4.260 3.284 3.020 3.588 . 0 0 "[ . 1 . 2]" 1
987 3 66 ALA MB 3 73 ALA H 3.450 . 5.100 3.634 3.141 3.990 . 0 0 "[ . 1 . 2]" 1
988 3 66 ALA MB 3 73 ALA MB 2.970 . 4.140 2.127 1.759 2.612 0.041 20 0 "[ . 1 . 2]" 1
989 3 66 ALA MB 3 74 PHE H 3.150 . 4.500 2.555 2.204 2.923 . 0 0 "[ . 1 . 2]" 1
990 3 66 ALA MB 3 74 PHE QD 3.500 . 5.200 3.038 2.814 3.196 . 0 0 "[ . 1 . 2]" 1
991 3 66 ALA MB 3 74 PHE QE 3.040 . 4.280 2.820 2.599 2.966 . 0 0 "[ . 1 . 2]" 1
992 3 66 ALA MB 3 126 LEU QD 3.220 . 4.640 3.714 2.838 4.882 0.242 9 0 "[ . 1 . 2]" 1
993 3 67 SER H 3 68 LEU H 3.240 . 4.680 4.302 4.207 4.440 . 0 0 "[ . 1 . 2]" 1
994 3 67 SER H 3 69 GLY H 3.460 . 5.120 4.758 4.552 5.185 0.065 4 0 "[ . 1 . 2]" 1
995 3 67 SER H 3 73 ALA H 3.290 . 4.780 4.420 4.206 4.779 . 0 0 "[ . 1 . 2]" 1
996 3 68 LEU H 3 69 GLY H 2.420 . 3.040 3.015 2.102 3.507 0.467 6 0 "[ . 1 . 2]" 1
997 3 68 LEU H 3 70 GLU H 3.240 . 4.680 5.016 4.514 5.508 0.828 2 9 "[*+ . *** - ** *]" 1
998 3 68 LEU H 3 71 GLU H 3.060 . 4.320 4.050 3.579 4.530 0.210 11 0 "[ . 1 . 2]" 1
999 3 68 LEU H 3 73 ALA H 2.750 . 3.700 3.516 3.056 3.976 0.276 8 0 "[ . 1 . 2]" 1
1000 3 68 LEU MD1 3 73 ALA H 3.390 . 4.980 4.053 3.420 4.886 . 0 0 "[ . 1 . 2]" 1
1001 3 68 LEU MD1 3 73 ALA MB 3.170 . 4.540 2.664 1.815 3.367 . 0 0 "[ . 1 . 2]" 1
1002 3 69 GLY H 3 70 GLU H 2.810 . 3.820 4.050 3.716 4.314 0.494 11 0 "[ . 1 . 2]" 1
1003 3 69 GLY H 3 71 GLU H 3.260 . 4.720 4.478 3.986 4.802 0.082 11 0 "[ . 1 . 2]" 1
1004 3 70 GLU H 3 71 GLU H 1.880 . 1.960 2.109 1.809 2.257 0.297 10 0 "[ . 1 . 2]" 1
1005 3 71 GLU H 3 72 THR H 3.210 . 4.620 4.446 4.292 4.515 . 0 0 "[ . 1 . 2]" 1
1006 3 72 THR H 3 73 ALA H 3.250 . 4.700 4.490 4.402 4.537 . 0 0 "[ . 1 . 2]" 1
1007 3 73 ALA H 3 74 PHE H 2.390 . 2.980 2.617 2.521 2.755 . 0 0 "[ . 1 . 2]" 1
1008 3 73 ALA MB 3 74 PHE H 2.510 . 3.220 2.223 2.052 2.318 . 0 0 "[ . 1 . 2]" 1
1009 3 73 ALA MB 3 74 PHE QD 3.260 . 4.720 2.543 2.293 3.004 . 0 0 "[ . 1 . 2]" 1
1010 3 74 PHE H 3 75 LEU H 3.120 . 4.440 4.328 4.241 4.383 . 0 0 "[ . 1 . 2]" 1
1011 3 74 PHE QD 3 75 LEU H 3.180 . 4.560 3.285 2.891 3.559 . 0 0 "[ . 1 . 2]" 1
1012 3 74 PHE QD 3 123 PHE QD 3.360 . 4.920 3.032 2.522 3.460 . 0 0 "[ . 1 . 2]" 1
1013 3 74 PHE QD 3 123 PHE QE 2.890 . 3.980 3.203 2.936 3.588 . 0 0 "[ . 1 . 2]" 1
1014 3 74 PHE QE 3 118 VAL MG1 3.220 . 4.640 3.266 2.839 3.580 . 0 0 "[ . 1 . 2]" 1
1015 3 74 PHE QE 3 118 VAL MG2 3.460 . 5.120 2.601 2.142 3.587 . 0 0 "[ . 1 . 2]" 1
1016 3 74 PHE QE 3 123 PHE QD 3.020 . 4.240 3.467 3.121 4.032 . 0 0 "[ . 1 . 2]" 1
1017 3 74 PHE QE 3 123 PHE QE 3.260 . 4.720 4.714 4.277 5.248 0.528 10 2 "[ . + . -]" 1
1018 3 74 PHE QE 3 126 LEU QD 3.180 . 4.560 2.672 1.849 4.073 . 0 0 "[ . 1 . 2]" 1
1019 3 75 LEU H 3 76 CYS H 3.190 . 4.580 4.246 3.890 4.414 . 0 0 "[ . 1 . 2]" 1
1020 3 75 LEU MD1 3 76 CYS H 2.700 . 3.600 2.399 2.054 3.155 . 0 0 "[ . 1 . 2]" 1
1021 3 75 LEU MD1 3 77 GLU H 3.280 . 4.760 3.661 2.888 4.290 . 0 0 "[ . 1 . 2]" 1
1022 3 75 LEU MD2 3 76 CYS H 2.860 . 3.920 2.498 2.196 3.245 . 0 0 "[ . 1 . 2]" 1
1023 3 76 CYS H 3 77 GLU H 3.240 . 4.680 4.258 3.923 4.523 . 0 0 "[ . 1 . 2]" 1
1024 3 77 GLU H 3 78 VAL H 2.980 . 4.160 4.197 4.068 4.362 0.202 17 0 "[ . 1 . 2]" 1
1025 3 77 GLU H 3 78 VAL MG2 3.180 . 4.560 3.702 3.305 4.412 . 0 0 "[ . 1 . 2]" 1
1026 3 78 VAL H 3 79 GLN H 3.220 . 4.640 4.197 3.983 4.381 . 0 0 "[ . 1 . 2]" 1
1027 3 78 VAL MG1 3 79 GLN H 2.510 . 3.220 2.741 2.479 3.189 . 0 0 "[ . 1 . 2]" 1
1028 3 78 VAL MG1 3 80 GLN H 3.030 . 4.260 2.929 2.720 3.096 . 0 0 "[ . 1 . 2]" 1
1029 3 78 VAL MG1 3 114 ILE H 3.510 . 5.220 4.276 4.043 4.590 . 0 0 "[ . 1 . 2]" 1
1030 3 78 VAL MG2 3 79 GLN H 3.370 . 4.940 4.066 3.873 4.239 . 0 0 "[ . 1 . 2]" 1
1031 3 78 VAL MG2 3 114 ILE H 3.130 . 4.460 2.974 2.825 3.163 . 0 0 "[ . 1 . 2]" 1
1032 3 79 GLN H 3 80 GLN H 2.940 . 4.080 3.921 3.804 4.020 . 0 0 "[ . 1 . 2]" 1
1033 3 80 GLN H 3 81 GLY H 3.180 . 4.560 4.231 4.164 4.323 . 0 0 "[ . 1 . 2]" 1
1034 3 80 GLN H 3 110 ALA MB 3.010 . 4.220 3.475 3.260 3.710 . 0 0 "[ . 1 . 2]" 1
1035 3 81 GLY H 3 82 GLY H 3.290 . 4.780 4.556 4.502 4.604 . 0 0 "[ . 1 . 2]" 1
1036 3 82 GLY H 3 83 ILE H 3.040 . 4.280 4.046 3.869 4.291 0.011 7 0 "[ . 1 . 2]" 1
1037 3 83 ILE H 3 84 PHE H 3.300 . 4.800 4.471 4.423 4.521 . 0 0 "[ . 1 . 2]" 1
1038 3 84 PHE H 3 85 SER H 3.190 . 4.580 4.171 4.119 4.336 . 0 0 "[ . 1 . 2]" 1
1039 3 84 PHE QD 3 85 SER H 3.260 . 4.720 4.322 4.072 4.514 . 0 0 "[ . 1 . 2]" 1
1040 3 85 SER H 3 86 ILE H 3.220 . 4.640 4.391 4.251 4.575 . 0 0 "[ . 1 . 2]" 1
1041 3 86 ILE H 3 87 ALA H 3.220 . 4.640 4.355 3.961 4.477 . 0 0 "[ . 1 . 2]" 1
1042 3 87 ALA H 3 88 GLY H 3.050 . 4.300 4.388 4.259 4.487 0.187 10 0 "[ . 1 . 2]" 1
1043 3 87 ALA H 3 89 ILE H 2.900 . 4.000 4.135 3.734 4.509 0.509 1 2 "[+ . 1 . - 2]" 1
1044 3 87 ALA MB 3 88 GLY H 2.880 . 3.960 2.550 2.270 2.903 . 0 0 "[ . 1 . 2]" 1
1045 3 88 GLY H 3 89 ILE H 2.620 . 3.440 3.131 2.756 3.534 0.094 16 0 "[ . 1 . 2]" 1
1046 3 89 ILE H 3 90 GLU H 3.290 . 4.780 4.555 4.460 4.654 . 0 0 "[ . 1 . 2]" 1
1047 3 90 GLU H 3 91 GLY H 3.190 . 4.580 4.364 4.251 4.427 . 0 0 "[ . 1 . 2]" 1
1048 3 90 GLU H 3 93 GLN H 3.400 . 5.000 4.273 3.634 5.226 0.226 17 0 "[ . 1 . 2]" 1
1049 3 90 GLU H 3 94 MET H 3.110 . 4.410 3.712 2.914 4.434 0.024 17 0 "[ . 1 . 2]" 1
1050 3 91 GLY H 3 92 THR H 3.330 . 4.860 4.500 4.417 4.618 . 0 0 "[ . 1 . 2]" 1
1051 3 91 GLY H 3 94 MET H 3.090 . 4.380 3.951 3.690 4.254 . 0 0 "[ . 1 . 2]" 1
1052 3 91 GLY H 3 94 MET ME 2.630 . 3.460 3.640 1.795 5.668 2.208 2 10 "[ +**.- *** * **]" 1
1053 3 92 THR H 3 93 GLN H 2.360 . 2.920 2.545 2.389 2.722 . 0 0 "[ . 1 . 2]" 1
1054 3 92 THR H 3 94 MET H 3.220 . 4.640 4.207 3.917 4.448 . 0 0 "[ . 1 . 2]" 1
1055 3 93 GLN H 3 94 MET H 2.370 . 2.940 2.602 2.455 2.759 . 0 0 "[ . 1 . 2]" 1
1056 3 93 GLN H 3 95 ALA H 3.320 . 4.840 3.875 3.674 4.228 . 0 0 "[ . 1 . 2]" 1
1057 3 93 GLN H 3 96 HIS H 3.380 . 4.960 4.767 4.325 5.274 0.314 8 0 "[ . 1 . 2]" 1
1058 3 94 MET H 3 95 ALA H 2.370 . 2.940 2.506 2.428 2.682 . 0 0 "[ . 1 . 2]" 1
1059 3 94 MET H 3 96 HIS H 2.950 . 4.100 4.121 3.698 4.517 0.417 8 0 "[ . 1 . 2]" 1
1060 3 94 MET H 3 97 CYS H 3.390 . 4.980 4.653 4.480 4.870 . 0 0 "[ . 1 . 2]" 1
1061 3 95 ALA H 3 96 HIS H 2.310 . 2.820 2.726 2.540 2.944 0.124 4 0 "[ . 1 . 2]" 1
1062 3 95 ALA H 3 97 CYS H 3.320 . 4.840 4.069 3.846 4.199 . 0 0 "[ . 1 . 2]" 1
1063 3 95 ALA H 3 98 LEU H 3.350 . 4.900 4.973 4.801 5.324 0.424 1 0 "[ . 1 . 2]" 1
1064 3 95 ALA MB 3 96 HIS H 2.710 . 3.620 2.567 2.393 2.734 . 0 0 "[ . 1 . 2]" 1
1065 3 95 ALA MB 3 137 PHE QE 3.380 . 4.960 2.633 2.386 3.093 . 0 0 "[ . 1 . 2]" 1
1066 3 96 HIS H 3 97 CYS H 2.350 . 2.900 2.534 2.441 2.663 . 0 0 "[ . 1 . 2]" 1
1067 3 96 HIS H 3 98 LEU H 2.850 . 3.900 4.218 4.052 4.587 0.687 1 3 "[+ . 1 .* -2]" 1
1068 3 96 HIS H 3 99 GLY H 3.210 . 4.620 4.385 4.238 4.825 0.205 16 0 "[ . 1 . 2]" 1
1069 3 96 HIS H 3 137 PHE QE 3.300 . 4.800 3.469 3.284 3.819 . 0 0 "[ . 1 . 2]" 1
1070 3 97 CYS H 3 98 LEU H 2.280 . 2.760 2.727 2.626 2.867 0.107 1 0 "[ . 1 . 2]" 1
1071 3 97 CYS H 3 99 GLY H 3.020 . 4.240 3.739 3.534 4.096 . 0 0 "[ . 1 . 2]" 1
1072 3 97 CYS H 3 100 ALA H 3.510 . 5.220 5.215 4.923 5.411 0.191 3 0 "[ . 1 . 2]" 1
1073 3 97 CYS H 3 101 TYR H 3.480 . 5.160 5.180 4.766 5.542 0.382 3 0 "[ . 1 . 2]" 1
1074 3 98 LEU H 3 99 GLY H 2.140 . 2.480 2.265 2.161 2.553 0.073 16 0 "[ . 1 . 2]" 1
1075 3 98 LEU H 3 100 ALA H 2.920 . 4.040 4.258 4.054 4.461 0.421 1 0 "[ . 1 . 2]" 1
1076 3 98 LEU H 3 101 TYR H 3.380 . 4.960 4.949 4.759 5.518 0.558 1 1 "[+ . 1 . 2]" 1
1077 3 98 LEU H 3 102 CYS H 3.380 . 4.960 4.832 4.644 5.224 0.264 1 0 "[ . 1 . 2]" 1
1078 3 99 GLY H 3 100 ALA H 2.180 . 2.560 2.588 2.497 2.699 0.139 16 0 "[ . 1 . 2]" 1
1079 3 99 GLY H 3 100 ALA MB 3.380 . 4.960 4.407 3.964 4.584 . 0 0 "[ . 1 . 2]" 1
1080 3 99 GLY H 3 101 TYR H 3.180 . 4.560 3.929 3.704 4.452 . 0 0 "[ . 1 . 2]" 1
1081 3 99 GLY H 3 102 CYS H 3.350 . 4.900 4.632 4.230 5.018 0.118 1 0 "[ . 1 . 2]" 1
1082 3 100 ALA H 3 101 TYR H 2.170 . 2.540 1.926 1.745 2.543 0.055 9 0 "[ . 1 . 2]" 1
1083 3 100 ALA H 3 102 CYS H 2.520 . 3.240 3.293 2.940 3.634 0.394 17 0 "[ . 1 . 2]" 1
1084 3 100 ALA MB 3 101 TYR H 2.400 . 3.000 2.550 2.145 2.709 . 0 0 "[ . 1 . 2]" 1
1085 3 100 ALA MB 3 134 ASP H 3.400 . 5.000 3.057 2.620 3.450 . 0 0 "[ . 1 . 2]" 1
1086 3 100 ALA MB 3 137 PHE H 3.450 . 5.100 3.731 3.219 4.150 . 0 0 "[ . 1 . 2]" 1
1087 3 100 ALA MB 3 137 PHE QD 3.320 . 4.830 2.958 2.059 3.652 . 0 0 "[ . 1 . 2]" 1
1088 3 101 TYR H 3 102 CYS H 2.330 . 2.860 2.808 2.694 2.930 0.070 3 0 "[ . 1 . 2]" 1
1089 3 101 TYR QD 3 102 CYS H 3.080 . 4.360 3.265 2.914 3.850 . 0 0 "[ . 1 . 2]" 1
1090 3 109 TYR H 3 110 ALA H 2.210 . 2.620 2.631 2.573 2.681 0.061 18 0 "[ . 1 . 2]" 1
1091 3 109 TYR H 3 111 ARG H 3.010 . 4.220 3.929 3.744 4.081 . 0 0 "[ . 1 . 2]" 1
1092 3 109 TYR H 3 112 GLU H 3.440 . 5.080 4.840 4.674 5.053 . 0 0 "[ . 1 . 2]" 1
1093 3 109 TYR QD 3 110 ALA H 3.420 . 5.040 3.941 3.823 4.234 . 0 0 "[ . 1 . 2]" 1
1094 3 110 ALA H 3 111 ARG H 2.120 . 2.440 2.656 2.574 2.721 0.281 14 0 "[ . 1 . 2]" 1
1095 3 110 ALA H 3 112 GLU H 2.940 . 4.080 4.454 4.313 4.685 0.605 19 2 "[ . 1- . +2]" 1
1096 3 110 ALA H 3 113 CYS H 3.490 . 5.180 4.880 4.800 4.978 . 0 0 "[ . 1 . 2]" 1
1097 3 110 ALA MB 3 111 ARG H 2.690 . 3.580 2.553 2.421 2.846 . 0 0 "[ . 1 . 2]" 1
1098 3 111 ARG H 3 112 GLU H 2.250 . 2.700 2.889 2.796 2.992 0.292 20 0 "[ . 1 . 2]" 1
1099 3 111 ARG H 3 113 CYS H 3.190 . 4.580 4.093 3.898 4.212 . 0 0 "[ . 1 . 2]" 1
1100 3 112 GLU H 3 113 CYS H 2.330 . 2.860 2.605 2.531 2.652 . 0 0 "[ . 1 . 2]" 1
1101 3 112 GLU H 3 114 ILE H 3.210 . 4.620 4.222 4.106 4.355 . 0 0 "[ . 1 . 2]" 1
1102 3 112 GLU H 3 115 THR H 3.460 . 5.120 4.825 4.719 5.011 . 0 0 "[ . 1 . 2]" 1
1103 3 113 CYS H 3 114 ILE H 2.450 . 3.100 2.595 2.543 2.674 . 0 0 "[ . 1 . 2]" 1
1104 3 113 CYS H 3 115 THR H 3.200 . 4.600 4.146 3.969 4.344 . 0 0 "[ . 1 . 2]" 1
1105 3 113 CYS H 3 116 SER H 3.430 . 5.060 4.699 4.611 4.822 . 0 0 "[ . 1 . 2]" 1
1106 3 114 ILE H 3 115 THR H 2.430 . 3.060 2.599 2.471 2.670 . 0 0 "[ . 1 . 2]" 1
1107 3 114 ILE H 3 116 SER H 3.080 . 4.360 3.971 3.735 4.071 . 0 0 "[ . 1 . 2]" 1
1108 3 114 ILE H 3 117 MET H 3.500 . 5.200 4.787 4.520 4.890 . 0 0 "[ . 1 . 2]" 1
1109 3 115 THR H 3 116 SER H 2.350 . 2.900 2.672 2.597 2.733 . 0 0 "[ . 1 . 2]" 1
1110 3 115 THR H 3 117 MET H 3.330 . 4.860 4.314 4.185 4.495 . 0 0 "[ . 1 . 2]" 1
1111 3 115 THR H 3 118 VAL H 3.480 . 5.160 4.769 4.641 4.913 . 0 0 "[ . 1 . 2]" 1
1112 3 116 SER H 3 117 MET H 2.350 . 2.900 2.704 2.608 2.832 . 0 0 "[ . 1 . 2]" 1
1113 3 116 SER H 3 118 VAL H 2.950 . 4.100 4.090 3.933 4.197 0.097 9 0 "[ . 1 . 2]" 1
1114 3 116 SER H 3 119 SER H 3.430 . 5.060 4.726 4.633 4.819 . 0 0 "[ . 1 . 2]" 1
1115 3 117 MET H 3 118 VAL H 2.360 . 2.920 2.776 2.690 2.884 . 0 0 "[ . 1 . 2]" 1
1116 3 117 MET H 3 119 SER H 3.210 . 4.620 4.253 4.135 4.441 . 0 0 "[ . 1 . 2]" 1
1117 3 117 MET ME 4 117 MET ME 2.930 . 4.060 3.462 3.152 3.802 . 0 0 "[ . 1 . 2]" 1
1118 3 118 VAL H 3 119 SER H 2.290 . 2.780 2.616 2.512 2.693 . 0 0 "[ . 1 . 2]" 1
1119 3 118 VAL MG1 3 119 SER H 3.100 . 4.400 3.353 3.235 3.522 . 0 0 "[ . 1 . 2]" 1
1120 3 118 VAL MG1 3 123 PHE H 3.150 . 4.500 3.098 3.033 3.183 . 0 0 "[ . 1 . 2]" 1
1121 3 118 VAL MG1 3 123 PHE QD 3.080 . 4.360 3.454 3.232 3.634 . 0 0 "[ . 1 . 2]" 1
1122 3 118 VAL MG1 3 126 LEU H 3.490 . 5.180 3.455 2.621 3.831 . 0 0 "[ . 1 . 2]" 1
1123 3 118 VAL MG2 3 119 SER H 3.300 . 4.800 3.844 3.669 4.032 . 0 0 "[ . 1 . 2]" 1
1124 3 119 SER H 3 121 GLY H 3.060 . 4.320 4.151 3.977 4.267 . 0 0 "[ . 1 . 2]" 1
1125 3 121 GLY H 3 122 THR H 2.370 . 2.940 2.566 2.491 2.648 . 0 0 "[ . 1 . 2]" 1
1126 3 121 GLY H 3 123 PHE H 2.730 . 3.660 4.100 3.866 4.247 0.587 7 8 "[ **+ 1*- ** *]" 1
1127 3 121 GLY H 4 18 THR H 3.190 . 4.580 4.013 3.822 4.175 . 0 0 "[ . 1 . 2]" 1
1128 3 122 THR H 3 123 PHE H 2.370 . 2.940 2.738 2.652 2.856 . 0 0 "[ . 1 . 2]" 1
1129 3 122 THR H 4 18 THR H 3.270 . 4.740 4.581 4.468 4.772 0.032 6 0 "[ . 1 . 2]" 1
1130 3 125 GLN H 3 126 LEU H 3.320 . 4.830 4.542 4.408 4.641 . 0 0 "[ . 1 . 2]" 1
1131 3 126 LEU H 3 127 ASN H 2.740 . 3.680 3.879 3.421 4.307 0.627 6 3 "[- .+ * . 2]" 1
1132 3 126 LEU QD 3 127 ASN H 3.380 . 4.960 3.751 2.541 4.550 . 0 0 "[ . 1 . 2]" 1
1133 3 126 LEU QD 3 128 LEU H 3.420 . 5.040 4.569 2.863 6.334 1.294 1 4 "[+* . - 1* . 2]" 1
1134 3 127 ASN H 3 128 LEU H 3.220 . 4.640 4.261 3.971 4.466 . 0 0 "[ . 1 . 2]" 1
1135 3 128 LEU H 3 129 ALA H 3.240 . 4.680 4.550 4.419 4.608 . 0 0 "[ . 1 . 2]" 1
1136 3 128 LEU QD 3 129 ALA H 3.360 . 4.920 2.941 1.823 4.433 . 0 0 "[ . 1 . 2]" 1
1137 3 128 LEU QD 3 131 VAL QG 3.030 . 4.260 3.536 2.182 4.967 0.707 10 3 "[ . + * - 2]" 1
1138 3 131 VAL QG 3 133 PHE H 3.470 . 5.140 3.200 2.155 3.923 . 0 0 "[ . 1 . 2]" 1
1139 3 131 VAL QG 3 133 PHE QD 3.250 . 4.700 3.143 2.051 3.614 . 0 0 "[ . 1 . 2]" 1
1140 3 131 VAL QG 3 133 PHE QE 2.940 . 4.080 2.932 2.722 3.656 . 0 0 "[ . 1 . 2]" 1
1141 3 133 PHE H 3 134 ASP H 2.170 . 2.540 2.630 2.393 2.766 0.226 1 0 "[ . 1 . 2]" 1
1142 3 133 PHE H 3 135 ALA H 3.230 . 4.660 4.445 4.198 4.786 0.126 1 0 "[ . 1 . 2]" 1
1143 3 133 PHE H 3 136 LEU H 3.370 . 4.940 5.081 4.585 5.536 0.596 11 3 "[ * . 1+ -. 2]" 1
1144 3 133 PHE QD 3 134 ASP H 3.320 . 4.830 4.041 3.077 4.486 . 0 0 "[ . 1 . 2]" 1
1145 3 134 ASP H 3 135 ALA H 2.440 . 3.080 2.714 2.560 2.842 . 0 0 "[ . 1 . 2]" 1
1146 3 134 ASP H 3 136 LEU H 3.010 . 4.220 4.118 3.581 4.611 0.391 14 0 "[ . 1 . 2]" 1
1147 3 134 ASP H 3 137 PHE H 3.510 . 5.220 4.757 4.474 5.030 . 0 0 "[ . 1 . 2]" 1
1148 3 135 ALA H 3 136 LEU H 2.260 . 2.730 2.643 2.402 2.781 0.051 14 0 "[ . 1 . 2]" 1
1149 3 135 ALA H 3 137 PHE H 3.340 . 4.880 4.124 3.772 4.476 . 0 0 "[ . 1 . 2]" 1
1150 3 135 ALA H 3 138 MET H 3.510 . 5.220 4.909 4.642 5.762 0.542 16 1 "[ . 1 .+ 2]" 1
1151 3 135 ALA MB 3 136 LEU H 2.680 . 3.570 2.587 2.380 2.819 . 0 0 "[ . 1 . 2]" 1
1152 3 136 LEU H 3 137 PHE H 2.440 . 3.080 2.621 2.442 2.881 . 0 0 "[ . 1 . 2]" 1
1153 3 136 LEU H 3 138 MET H 3.060 . 4.320 4.033 3.746 4.628 0.308 6 0 "[ . 1 . 2]" 1
1154 3 136 LEU MD2 3 137 PHE H 3.470 . 5.140 4.680 3.935 5.148 0.008 13 0 "[ . 1 . 2]" 1
1155 3 137 PHE H 3 138 MET H 2.380 . 2.960 2.532 2.349 2.815 . 0 0 "[ . 1 . 2]" 1
1156 3 137 PHE H 3 139 ASN H 3.310 . 4.820 4.290 3.887 4.792 . 0 0 "[ . 1 . 2]" 1
1157 3 137 PHE H 3 140 TYR H 3.360 . 4.920 4.840 4.405 5.669 0.749 6 1 "[ .+ 1 . 2]" 1
1158 3 137 PHE QD 3 138 MET H 3.230 . 4.660 4.263 3.615 4.564 . 0 0 "[ . 1 . 2]" 1
1159 3 137 PHE QD 3 141 LEU H 3.240 . 4.680 3.813 2.906 7.101 2.421 6 1 "[ .+ 1 . 2]" 1
1160 3 137 PHE QE 3 141 LEU H 3.470 . 5.140 4.421 3.335 6.741 1.601 6 1 "[ .+ 1 . 2]" 1
1161 3 138 MET H 3 139 ASN H 2.430 . 3.060 2.649 2.485 2.950 . 0 0 "[ . 1 . 2]" 1
1162 3 138 MET H 3 140 TYR H 3.040 . 4.280 3.968 3.697 4.514 0.234 6 0 "[ . 1 . 2]" 1
1163 3 139 ASN H 3 140 TYR H 2.240 . 2.680 2.596 2.471 2.834 0.154 6 0 "[ . 1 . 2]" 1
1164 3 140 TYR H 3 141 LEU H 2.660 . 3.520 3.324 3.161 4.502 0.982 6 1 "[ .+ 1 . 2]" 1
1165 3 140 TYR QD 3 141 LEU H 2.420 . 3.040 2.644 2.161 4.279 1.239 16 1 "[ . 1 .+ 2]" 1
1166 3 140 TYR QE 3 141 LEU H 3.380 . 4.960 4.615 4.193 6.315 1.355 16 1 "[ . 1 .+ 2]" 1
1167 4 9 MET H 4 10 THR H 3.270 . 4.740 4.520 4.255 4.653 . 0 0 "[ . 1 . 2]" 1
1168 4 10 THR H 4 11 PHE H 3.240 . 4.680 4.366 4.195 4.467 . 0 0 "[ . 1 . 2]" 1
1169 4 10 THR H 4 87 ALA H 2.510 . 3.220 3.059 2.740 3.607 0.387 15 0 "[ . 1 . 2]" 1
1170 4 11 PHE H 4 12 GLN H 3.000 . 4.200 3.493 3.244 3.894 . 0 0 "[ . 1 . 2]" 1
1171 4 11 PHE QD 4 12 GLN H 2.860 . 3.920 4.194 3.874 4.407 0.487 20 0 "[ . 1 . 2]" 1
1172 4 11 PHE QE 4 84 PHE QD 3.140 . 4.480 3.335 2.906 3.701 . 0 0 "[ . 1 . 2]" 1
1173 4 11 PHE QE 4 101 TYR QD 3.200 . 4.600 3.279 2.917 3.481 . 0 0 "[ . 1 . 2]" 1
1174 4 11 PHE QE 4 102 CYS H 3.180 . 4.560 4.813 4.294 5.175 0.615 9 4 "[ * +* - . 2]" 1
1175 4 12 GLN H 4 13 ILE H 3.160 . 4.520 4.275 4.194 4.420 . 0 0 "[ . 1 . 2]" 1
1176 4 12 GLN H 4 85 SER H 2.630 . 3.460 3.242 2.793 3.642 0.182 13 0 "[ . 1 . 2]" 1
1177 4 13 ILE H 4 14 GLN H 3.330 . 4.860 4.435 4.320 4.511 . 0 0 "[ . 1 . 2]" 1
1178 4 14 GLN H 4 15 ARG H 2.030 . 2.260 2.402 2.320 2.556 0.296 1 0 "[ . 1 . 2]" 1
1179 4 14 GLN H 4 83 ILE H 3.140 . 4.480 4.625 4.428 4.864 0.384 14 0 "[ . 1 . 2]" 1
1180 4 14 GLN H 4 84 PHE H 3.470 . 5.140 4.645 4.244 4.840 . 0 0 "[ . 1 . 2]" 1
1181 4 14 GLN H 4 84 PHE QD 3.340 . 4.880 4.278 3.434 5.040 0.160 2 0 "[ . 1 . 2]" 1
1182 4 14 GLN H 4 85 SER H 3.250 . 4.700 3.762 3.215 4.442 . 0 0 "[ . 1 . 2]" 1
1183 4 15 ARG H 4 16 ILE H 3.090 . 4.380 4.074 3.856 4.263 . 0 0 "[ . 1 . 2]" 1
1184 4 15 ARG H 4 83 ILE H 2.520 . 3.240 3.335 3.162 3.558 0.318 8 0 "[ . 1 . 2]" 1
1185 4 16 ILE H 4 17 TYR H 3.250 . 4.700 4.420 4.289 4.511 . 0 0 "[ . 1 . 2]" 1
1186 4 17 TYR H 4 18 THR H 3.180 . 4.560 4.316 4.223 4.365 . 0 0 "[ . 1 . 2]" 1
1187 4 17 TYR H 4 81 GLY H 2.840 . 3.880 3.977 3.817 4.180 0.300 8 0 "[ . 1 . 2]" 1
1188 4 17 TYR QD 4 18 THR H 3.040 . 4.280 3.644 3.061 4.099 . 0 0 "[ . 1 . 2]" 1
1189 4 17 TYR QE 4 83 ILE H 3.490 . 5.180 3.184 2.623 3.476 . 0 0 "[ . 1 . 2]" 1
1190 4 18 THR H 4 19 LYS H 3.280 . 4.760 4.353 4.283 4.442 . 0 0 "[ . 1 . 2]" 1
1191 4 18 THR H 4 81 GLY H 3.490 . 5.180 4.921 4.804 5.061 . 0 0 "[ . 1 . 2]" 1
1192 4 19 LYS H 4 20 ASP H 2.020 . 2.240 2.204 2.062 2.324 0.084 9 0 "[ . 1 . 2]" 1
1193 4 19 LYS H 4 79 GLN H 3.090 . 4.380 4.755 4.362 5.046 0.666 18 3 "[ - 1 . + *]" 1
1194 4 19 LYS H 4 80 GLN H 3.520 . 5.240 5.097 4.962 5.319 0.079 3 0 "[ . 1 . 2]" 1
1195 4 19 LYS H 4 81 GLY H 2.740 . 3.680 2.828 2.581 3.093 . 0 0 "[ . 1 . 2]" 1
1196 4 20 ASP H 4 21 ILE H 3.160 . 4.520 4.164 4.065 4.286 . 0 0 "[ . 1 . 2]" 1
1197 4 20 ASP H 4 78 VAL MG1 3.500 . 5.200 4.244 3.764 4.560 . 0 0 "[ . 1 . 2]" 1
1198 4 20 ASP H 4 79 GLN H 2.510 . 3.220 3.482 3.293 3.767 0.547 8 1 "[ . + 1 . 2]" 1
1199 4 21 ILE H 4 22 SER H 3.100 . 4.400 4.293 4.201 4.337 . 0 0 "[ . 1 . 2]" 1
1200 4 22 SER H 4 23 PHE H 3.160 . 4.520 4.101 3.848 4.226 . 0 0 "[ . 1 . 2]" 1
1201 4 22 SER H 4 77 GLU H 2.760 . 3.720 3.114 2.874 3.445 . 0 0 "[ . 1 . 2]" 1
1202 4 22 SER H 4 78 VAL MG2 2.990 . 4.180 3.237 2.800 3.625 . 0 0 "[ . 1 . 2]" 1
1203 4 22 SER H 4 117 MET ME 3.260 . 4.720 3.212 2.915 3.493 . 0 0 "[ . 1 . 2]" 1
1204 4 23 PHE H 4 24 GLU H 3.220 . 4.640 4.170 3.963 4.408 . 0 0 "[ . 1 . 2]" 1
1205 4 23 PHE QD 4 24 GLU H 2.550 . 3.300 3.523 3.094 3.872 0.572 13 1 "[ . 1 + . 2]" 1
1206 4 23 PHE QE 4 24 GLU H 3.140 . 4.480 4.500 4.127 4.895 0.415 13 0 "[ . 1 . 2]" 1
1207 4 23 PHE QE 4 25 ALA MB 3.150 . 4.500 2.788 2.414 3.089 . 0 0 "[ . 1 . 2]" 1
1208 4 23 PHE QE 4 75 LEU H 3.500 . 5.200 4.467 3.809 4.825 . 0 0 "[ . 1 . 2]" 1
1209 4 23 PHE QE 4 121 GLY H 3.380 . 4.960 4.025 3.779 4.211 . 0 0 "[ . 1 . 2]" 1
1210 4 24 GLU H 4 25 ALA H 3.140 . 4.480 4.220 3.964 4.438 . 0 0 "[ . 1 . 2]" 1
1211 4 24 GLU H 4 75 LEU H 2.860 . 3.920 3.051 2.748 3.336 . 0 0 "[ . 1 . 2]" 1
1212 4 25 ALA MB 4 28 ALA H 3.330 . 4.860 3.369 3.058 3.741 . 0 0 "[ . 1 . 2]" 1
1213 4 25 ALA MB 4 28 ALA MB 2.880 . 3.960 2.003 1.798 2.140 0.002 4 0 "[ . 1 . 2]" 1
1214 4 27 ASN H 4 28 ALA H 2.540 . 3.280 2.580 2.332 3.089 . 0 0 "[ . 1 . 2]" 1
1215 4 28 ALA H 4 30 HIS H 2.840 . 3.880 4.560 4.256 4.774 0.894 1 19 "[+-*************** **]" 1
1216 4 28 ALA H 4 31 VAL H 3.240 . 4.680 4.791 4.691 4.902 0.222 19 0 "[ . 1 . 2]" 1
1217 4 28 ALA MB 4 30 HIS H 3.460 . 5.120 4.331 4.250 4.476 . 0 0 "[ . 1 . 2]" 1
1218 4 28 ALA MB 4 32 PHE QE 3.120 . 4.440 3.074 2.902 3.349 . 0 0 "[ . 1 . 2]" 1
1219 4 30 HIS H 4 31 VAL H 2.150 . 2.500 2.451 2.309 2.578 0.078 18 0 "[ . 1 . 2]" 1
1220 4 30 HIS H 4 31 VAL MG1 3.490 . 5.180 3.866 3.573 4.071 . 0 0 "[ . 1 . 2]" 1
1221 4 30 HIS H 4 32 PHE H 2.810 . 3.820 3.927 3.792 4.070 0.250 18 0 "[ . 1 . 2]" 1
1222 4 31 VAL H 4 32 PHE H 2.240 . 2.680 2.412 2.373 2.473 . 0 0 "[ . 1 . 2]" 1
1223 4 31 VAL H 4 33 GLN H 3.170 . 4.540 4.163 4.079 4.273 . 0 0 "[ . 1 . 2]" 1
1224 4 31 VAL MG1 4 32 PHE H 2.470 . 3.140 2.544 2.405 2.706 . 0 0 "[ . 1 . 2]" 1
1225 4 31 VAL MG1 4 32 PHE QD 3.220 . 4.640 3.069 2.744 3.331 . 0 0 "[ . 1 . 2]" 1
1226 4 31 VAL MG1 4 32 PHE QE 3.490 . 5.180 3.612 3.274 3.976 . 0 0 "[ . 1 . 2]" 1
1227 4 31 VAL MG1 4 68 LEU MD1 3.340 . 4.880 2.915 2.548 3.284 . 0 0 "[ . 1 . 2]" 1
1228 4 31 VAL MG1 4 123 PHE QE 2.830 . 3.860 2.152 1.909 2.333 . 0 0 "[ . 1 . 2]" 1
1229 4 31 VAL MG2 4 32 PHE H 3.430 . 5.060 4.136 4.016 4.238 . 0 0 "[ . 1 . 2]" 1
1230 4 31 VAL MG2 4 34 LYS H 3.380 . 4.960 4.232 3.808 4.392 . 0 0 "[ . 1 . 2]" 1
1231 4 31 VAL MG2 4 68 LEU H 3.260 . 4.720 3.154 2.964 3.387 . 0 0 "[ . 1 . 2]" 1
1232 4 31 VAL MG2 4 68 LEU MD1 2.340 . 2.880 1.836 1.572 2.022 0.228 2 0 "[ . 1 . 2]" 1
1233 4 31 VAL MG2 4 73 ALA MB 3.440 . 5.080 2.821 2.522 3.019 . 0 0 "[ . 1 . 2]" 1
1234 4 32 PHE H 4 33 GLN H 2.350 . 2.900 2.666 2.538 2.829 . 0 0 "[ . 1 . 2]" 1
1235 4 32 PHE H 4 34 LYS H 3.120 . 4.440 4.302 4.087 4.528 0.088 13 0 "[ . 1 . 2]" 1
1236 4 32 PHE QD 4 33 GLN H 3.350 . 4.900 4.672 4.530 4.779 . 0 0 "[ . 1 . 2]" 1
1237 4 33 GLN H 4 34 LYS H 2.280 . 2.760 2.645 2.525 2.752 . 0 0 "[ . 1 . 2]" 1
1238 4 34 LYS H 4 35 ASP H 3.180 . 4.560 4.046 3.786 4.264 . 0 0 "[ . 1 . 2]" 1
1239 4 35 ASP H 4 36 TRP H 2.870 . 3.940 3.963 3.685 4.138 0.198 14 0 "[ . 1 . 2]" 1
1240 4 36 TRP H 4 37 GLN H 3.200 . 4.600 4.352 4.289 4.421 . 0 0 "[ . 1 . 2]" 1
1241 4 36 TRP H 4 68 LEU MD2 2.780 . 3.760 2.802 2.668 3.019 . 0 0 "[ . 1 . 2]" 1
1242 4 36 TRP HE1 4 37 GLN H 3.200 . 4.600 4.490 3.646 4.879 0.279 14 0 "[ . 1 . 2]" 1
1243 4 36 TRP HE1 4 39 GLU H 3.120 . 4.440 4.530 2.557 7.737 3.297 2 6 "[*+ . 1 * * - *]" 1
1244 4 36 TRP HE1 4 69 GLY H 3.350 . 4.900 5.693 4.018 9.213 4.313 2 8 "[*+ - 1** ** * 2]" 1
1245 4 36 TRP HE3 4 37 GLN H 2.500 . 3.200 3.496 2.655 5.526 2.326 15 6 "[** . 1 *- + * 2]" 1
1246 4 36 TRP HZ3 4 37 GLN H 3.190 . 4.580 4.878 4.005 7.175 2.595 15 5 "[** . 1 * + - 2]" 1
1247 4 37 GLN H 4 68 LEU MD2 3.410 . 5.020 4.208 4.039 4.347 . 0 0 "[ . 1 . 2]" 1
1248 4 39 GLU H 4 40 VAL H 3.280 . 4.760 4.478 4.413 4.664 . 0 0 "[ . 1 . 2]" 1
1249 4 39 GLU H 4 66 ALA MB 3.510 . 5.220 4.288 3.348 4.739 . 0 0 "[ . 1 . 2]" 1
1250 4 39 GLU H 4 67 SER H 2.620 . 3.440 3.267 2.884 3.857 0.417 10 0 "[ . 1 . 2]" 1
1251 4 40 VAL H 4 41 LYS H 3.180 . 4.560 4.371 4.202 4.520 . 0 0 "[ . 1 . 2]" 1
1252 4 40 VAL QG 4 41 LYS H 3.440 . 5.080 3.127 2.336 3.683 . 0 0 "[ . 1 . 2]" 1
1253 4 40 VAL QG 4 74 PHE QE 3.030 . 4.260 3.602 2.951 4.446 0.186 17 0 "[ . 1 . 2]" 1
1254 4 40 VAL QG 4 126 LEU QD 2.660 . 3.460 1.926 1.636 2.655 0.164 11 0 "[ . 1 . 2]" 1
1255 4 41 LYS H 4 42 LEU H 3.300 . 4.800 4.319 4.105 4.529 . 0 0 "[ . 1 . 2]" 1
1256 4 41 LYS H 4 64 VAL QG 3.070 . 4.340 3.727 3.079 4.480 0.140 12 0 "[ . 1 . 2]" 1
1257 4 41 LYS H 4 65 THR H 2.530 . 3.260 3.266 2.683 4.112 0.852 4 2 "[ +. 1 - . 2]" 1
1258 4 41 LYS H 4 66 ALA H 3.480 . 5.160 4.770 4.428 5.119 . 0 0 "[ . 1 . 2]" 1
1259 4 41 LYS H 4 66 ALA MB 3.300 . 4.800 4.191 3.885 4.519 . 0 0 "[ . 1 . 2]" 1
1260 4 42 LEU H 4 43 ASP H 3.250 . 4.700 4.376 4.045 4.553 . 0 0 "[ . 1 . 2]" 1
1261 4 42 LEU QD 4 128 LEU QD 2.670 . 3.540 2.168 1.626 4.296 0.756 15 1 "[ . 1 + 2]" 1
1262 4 42 LEU QD 4 129 ALA H 2.940 . 4.080 4.619 2.797 5.789 1.709 20 13 "[*-* * * * * *****+]" 1
1263 4 43 ASP H 4 44 LEU H 2.990 . 4.180 4.315 4.098 4.518 0.338 16 0 "[ . 1 . 2]" 1
1264 4 43 ASP H 4 44 LEU QD 3.440 . 5.080 4.516 3.099 6.021 0.941 6 5 "[ ***+ 1 - 2]" 1
1265 4 43 ASP H 4 62 VAL MG1 3.500 . 5.200 4.337 3.542 4.739 . 0 0 "[ . 1 . 2]" 1
1266 4 43 ASP H 4 63 THR H 2.890 . 3.980 3.346 2.870 3.963 . 0 0 "[ . 1 . 2]" 1
1267 4 43 ASP H 4 128 LEU QD 3.100 . 4.400 5.606 4.179 6.959 2.559 13 17 "[* * ***-*** +*******]" 1
1268 4 44 LEU H 4 45 ASP H 3.280 . 4.760 4.394 4.183 4.513 . 0 0 "[ . 1 . 2]" 1
1269 4 44 LEU QD 4 45 ASP H 2.430 . 3.060 3.222 2.385 3.861 0.801 18 6 "[ . * ** -*. + 2]" 1
1270 4 44 LEU QD 4 60 LEU QD 2.990 . 4.180 2.339 1.666 3.533 0.134 15 0 "[ . 1 . 2]" 1
1271 4 44 LEU QD 4 133 PHE QE 3.330 . 4.860 2.319 1.684 3.987 0.116 16 0 "[ . 1 . 2]" 1
1272 4 45 ASP H 4 46 THR H 2.890 . 3.990 4.296 4.160 4.395 0.405 6 0 "[ . 1 . 2]" 1
1273 4 45 ASP H 4 60 LEU QD 2.800 . 3.800 3.145 2.617 3.555 . 0 0 "[ . 1 . 2]" 1
1274 4 45 ASP H 4 61 ARG H 2.980 . 4.160 3.468 2.865 3.882 . 0 0 "[ . 1 . 2]" 1
1275 4 46 THR H 4 47 ALA H 3.230 . 4.660 4.444 4.372 4.506 . 0 0 "[ . 1 . 2]" 1
1276 4 46 THR H 4 61 ARG H 3.350 . 4.900 4.856 4.440 5.123 0.223 11 0 "[ . 1 . 2]" 1
1277 4 47 ALA H 4 48 SER H 3.190 . 4.580 4.345 4.283 4.396 . 0 0 "[ . 1 . 2]" 1
1278 4 47 ALA H 4 58 VAL MG1 3.270 . 4.740 3.367 2.862 3.908 . 0 0 "[ . 1 . 2]" 1
1279 4 47 ALA H 4 59 VAL H 2.810 . 3.820 3.230 2.753 3.613 . 0 0 "[ . 1 . 2]" 1
1280 4 47 ALA H 4 61 ARG H 3.390 . 4.980 4.758 4.445 5.243 0.263 11 0 "[ . 1 . 2]" 1
1281 4 47 ALA MB 4 48 SER H 2.370 . 2.940 2.430 2.166 2.923 . 0 0 "[ . 1 . 2]" 1
1282 4 47 ALA MB 4 59 VAL H 3.440 . 5.080 3.256 2.866 3.747 . 0 0 "[ . 1 . 2]" 1
1283 4 48 SER H 4 49 SER H 3.200 . 4.600 4.343 4.301 4.437 . 0 0 "[ . 1 . 2]" 1
1284 4 48 SER H 4 59 VAL H 3.490 . 5.180 4.423 4.000 4.933 . 0 0 "[ . 1 . 2]" 1
1285 4 49 SER H 4 50 GLN H 2.970 . 4.140 4.185 3.905 4.351 0.211 12 0 "[ . 1 . 2]" 1
1286 4 49 SER H 4 56 TYR QD 3.210 . 4.620 3.644 2.330 4.970 0.350 17 0 "[ . 1 . 2]" 1
1287 4 49 SER H 4 56 TYR QE 3.180 . 4.560 4.483 2.366 7.103 2.543 17 6 "[ * . *- * * . + 2]" 1
1288 4 49 SER H 4 57 GLU H 2.640 . 3.480 3.188 2.762 3.672 0.192 13 0 "[ . 1 . 2]" 1
1289 4 49 SER H 4 59 VAL H 3.440 . 5.080 5.120 4.544 5.735 0.655 19 2 "[ . 1- . +2]" 1
1290 4 49 SER H 4 98 LEU QD 3.160 . 4.520 4.495 3.820 5.599 1.079 6 3 "[ *+ -1 . 2]" 1
1291 4 50 GLN H 4 51 LEU H 3.300 . 4.800 4.475 4.367 4.592 . 0 0 "[ . 1 . 2]" 1
1292 4 50 GLN H 4 56 TYR QE 3.090 . 4.380 4.021 3.050 5.350 0.970 12 4 "[ - . * 1 + . * 2]" 1
1293 4 50 GLN H 4 57 GLU H 3.260 . 4.720 4.937 4.568 5.151 0.431 2 0 "[ . 1 . 2]" 1
1294 4 51 LEU H 4 52 ALA H 2.030 . 2.260 2.174 1.998 2.274 0.014 10 0 "[ . 1 . 2]" 1
1295 4 51 LEU H 4 55 VAL H 3.430 . 5.060 4.839 4.570 5.114 0.054 13 0 "[ . 1 . 2]" 1
1296 4 51 LEU H 4 55 VAL MG1 3.180 . 4.560 3.407 2.967 3.914 . 0 0 "[ . 1 . 2]" 1
1297 4 51 LEU H 4 57 GLU H 2.850 . 3.900 3.675 3.312 4.248 0.348 16 0 "[ . 1 . 2]" 1
1298 4 51 LEU MD1 4 55 VAL MG1 2.870 . 3.940 2.628 2.205 3.145 . 0 0 "[ . 1 . 2]" 1
1299 4 51 LEU MD2 4 57 GLU H 3.330 . 4.860 3.807 3.313 4.337 . 0 0 "[ . 1 . 2]" 1
1300 4 52 ALA H 4 53 ASP H 3.170 . 4.540 4.334 4.312 4.393 . 0 0 "[ . 1 . 2]" 1
1301 4 52 ALA H 4 55 VAL H 2.960 . 4.120 3.595 3.392 3.913 . 0 0 "[ . 1 . 2]" 1
1302 4 52 ALA H 4 55 VAL MG1 3.040 . 4.280 3.319 3.096 3.650 . 0 0 "[ . 1 . 2]" 1
1303 4 52 ALA H 4 55 VAL MG2 3.470 . 5.140 4.211 3.875 4.461 . 0 0 "[ . 1 . 2]" 1
1304 4 52 ALA MB 4 53 ASP H 2.310 . 2.820 1.957 1.838 2.243 . 0 0 "[ . 1 . 2]" 1
1305 4 52 ALA MB 4 55 VAL MG2 3.370 . 4.940 2.537 2.096 2.807 . 0 0 "[ . 1 . 2]" 1
1306 4 53 ASP H 4 54 ASP H 3.280 . 4.760 4.477 4.312 4.636 . 0 0 "[ . 1 . 2]" 1
1307 4 53 ASP H 4 55 VAL H 3.460 . 5.120 4.188 3.964 4.482 . 0 0 "[ . 1 . 2]" 1
1308 4 54 ASP H 4 55 VAL H 2.300 . 2.800 2.725 2.591 2.915 0.115 1 0 "[ . 1 . 2]" 1
1309 4 55 VAL H 4 56 TYR H 2.920 . 4.040 4.235 4.108 4.347 0.307 4 0 "[ . 1 . 2]" 1
1310 4 55 VAL MG1 4 56 TYR H 2.980 . 4.160 2.822 2.704 2.974 . 0 0 "[ . 1 . 2]" 1
1311 4 56 TYR H 4 57 GLU H 3.250 . 4.700 4.262 4.121 4.448 . 0 0 "[ . 1 . 2]" 1
1312 4 56 TYR H 4 84 PHE H 2.980 . 4.160 3.409 3.008 3.767 . 0 0 "[ . 1 . 2]" 1
1313 4 56 TYR H 4 86 ILE H 3.340 . 4.880 3.759 3.324 4.252 . 0 0 "[ . 1 . 2]" 1
1314 4 56 TYR QD 4 57 GLU H 2.790 . 3.780 3.439 1.725 4.498 0.718 7 4 "[ - . + 1 . ** 2]" 1
1315 4 56 TYR QD 4 94 MET ME 3.390 . 4.980 5.986 2.618 8.163 3.183 13 13 "[ * *-***** *+*. **2]" 1
1316 4 56 TYR QD 4 98 LEU QD 2.780 . 3.260 2.815 1.882 4.041 0.781 17 1 "[ . 1 . + 2]" 1
1317 4 56 TYR QE 4 98 LEU QD 3.320 . 3.640 3.378 2.242 5.099 1.459 17 5 "[ * . - * . +* 2]" 1
1318 4 57 GLU H 4 58 VAL H 3.150 . 4.500 4.403 4.211 4.549 0.049 3 0 "[ . 1 . 2]" 1
1319 4 58 VAL H 4 59 VAL H 3.150 . 4.500 4.326 4.130 4.494 . 0 0 "[ . 1 . 2]" 1
1320 4 58 VAL H 4 82 GLY H 2.870 . 3.940 3.107 2.711 3.472 . 0 0 "[ . 1 . 2]" 1
1321 4 58 VAL H 4 84 PHE H 2.960 . 4.120 4.438 3.990 4.730 0.610 14 6 "[* *. 1 **+.- 2]" 1
1322 4 58 VAL H 4 84 PHE QD 3.500 . 5.200 2.904 2.488 3.398 . 0 0 "[ . 1 . 2]" 1
1323 4 58 VAL MG1 4 59 VAL H 2.890 . 3.990 2.599 2.306 3.005 . 0 0 "[ . 1 . 2]" 1
1324 4 58 VAL MG2 4 98 LEU QD 2.810 . 3.820 2.258 1.817 2.912 . 0 0 "[ . 1 . 2]" 1
1325 4 59 VAL H 4 60 LEU H 3.270 . 4.740 4.361 4.197 4.497 . 0 0 "[ . 1 . 2]" 1
1326 4 59 VAL MG1 4 60 LEU H 2.480 . 3.160 2.610 2.279 3.164 0.004 1 0 "[ . 1 . 2]" 1
1327 4 59 VAL MG1 4 80 GLN H 3.480 . 5.160 3.657 3.462 3.963 . 0 0 "[ . 1 . 2]" 1
1328 4 59 VAL MG2 4 60 LEU H 3.380 . 4.960 4.162 4.040 4.269 . 0 0 "[ . 1 . 2]" 1
1329 4 59 VAL MG2 4 82 GLY H 3.390 . 4.980 3.628 3.423 3.973 . 0 0 "[ . 1 . 2]" 1
1330 4 60 LEU H 4 61 ARG H 3.240 . 4.680 4.276 4.092 4.408 . 0 0 "[ . 1 . 2]" 1
1331 4 60 LEU H 4 80 GLN H 2.950 . 4.100 3.505 3.228 3.872 . 0 0 "[ . 1 . 2]" 1
1332 4 60 LEU H 4 81 GLY H 3.330 . 4.860 4.559 4.299 4.746 . 0 0 "[ . 1 . 2]" 1
1333 4 60 LEU H 4 82 GLY H 3.370 . 4.940 4.956 4.501 5.523 0.583 6 1 "[ .+ 1 . 2]" 1
1334 4 60 LEU QD 4 61 ARG H 2.180 . 2.560 2.253 2.145 2.343 . 0 0 "[ . 1 . 2]" 1
1335 4 60 LEU QD 4 62 VAL H 3.350 . 4.900 3.364 3.132 3.767 . 0 0 "[ . 1 . 2]" 1
1336 4 60 LEU QD 4 62 VAL MG2 2.910 . 4.020 1.882 1.775 2.011 0.025 19 0 "[ . 1 . 2]" 1
1337 4 60 LEU QD 4 110 ALA MB 3.180 . 4.560 2.492 2.188 2.764 . 0 0 "[ . 1 . 2]" 1
1338 4 61 ARG H 4 62 VAL H 2.990 . 4.180 4.050 3.866 4.265 0.085 8 0 "[ . 1 . 2]" 1
1339 4 61 ARG H 4 62 VAL MG2 3.490 . 5.180 4.194 3.797 4.426 . 0 0 "[ . 1 . 2]" 1
1340 4 62 VAL H 4 63 THR H 3.250 . 4.700 4.352 4.139 4.529 . 0 0 "[ . 1 . 2]" 1
1341 4 62 VAL H 4 78 VAL H 2.950 . 4.100 3.287 2.935 3.670 . 0 0 "[ . 1 . 2]" 1
1342 4 62 VAL H 4 80 GLN H 3.040 . 4.280 3.989 3.707 4.300 0.020 12 0 "[ . 1 . 2]" 1
1343 4 62 VAL H 4 110 ALA MB 3.460 . 5.120 3.709 3.376 4.198 . 0 0 "[ . 1 . 2]" 1
1344 4 62 VAL MG1 4 63 THR H 2.660 . 3.520 2.813 2.381 3.341 . 0 0 "[ . 1 . 2]" 1
1345 4 62 VAL MG1 4 64 VAL QG 3.120 . 4.440 2.578 2.187 3.036 . 0 0 "[ . 1 . 2]" 1
1346 4 62 VAL MG2 4 63 THR H 3.510 . 5.220 4.128 3.958 4.252 . 0 0 "[ . 1 . 2]" 1
1347 4 62 VAL MG2 4 110 ALA MB 2.670 . 3.540 1.983 1.669 2.202 0.131 19 0 "[ . 1 . 2]" 1
1348 4 62 VAL MG2 4 111 ARG H 3.390 . 4.980 4.232 3.966 4.433 . 0 0 "[ . 1 . 2]" 1
1349 4 63 THR H 4 64 VAL H 3.240 . 4.680 4.399 4.283 4.515 . 0 0 "[ . 1 . 2]" 1
1350 4 64 VAL H 4 65 THR H 3.090 . 4.380 4.029 3.789 4.254 . 0 0 "[ . 1 . 2]" 1
1351 4 64 VAL H 4 76 CYS H 2.810 . 3.820 3.215 3.069 3.411 . 0 0 "[ . 1 . 2]" 1
1352 4 64 VAL QG 4 65 THR H 2.800 . 3.800 3.066 2.674 3.317 . 0 0 "[ . 1 . 2]" 1
1353 4 64 VAL QG 4 74 PHE QE 3.060 . 4.320 2.238 1.932 2.773 . 0 0 "[ . 1 . 2]" 1
1354 4 64 VAL QG 4 76 CYS H 3.470 . 5.140 3.932 3.339 4.297 . 0 0 "[ . 1 . 2]" 1
1355 4 64 VAL QG 4 126 LEU QD 2.300 . 2.800 2.168 1.646 3.917 1.117 3 1 "[ + . 1 . 2]" 1
1356 4 65 THR H 4 66 ALA H 3.200 . 4.600 4.175 3.876 4.383 . 0 0 "[ . 1 . 2]" 1
1357 4 66 ALA H 4 67 SER H 3.230 . 4.660 4.519 4.419 4.590 . 0 0 "[ . 1 . 2]" 1
1358 4 66 ALA H 4 73 ALA H 3.290 . 4.780 4.555 4.312 4.790 0.010 14 0 "[ . 1 . 2]" 1
1359 4 66 ALA H 4 74 PHE H 2.790 . 3.780 3.481 3.315 3.635 . 0 0 "[ . 1 . 2]" 1
1360 4 66 ALA H 4 75 LEU QD 2.460 . 3.120 2.778 2.350 3.112 . 0 0 "[ . 1 . 2]" 1
1361 4 66 ALA MB 4 67 SER H 2.550 . 3.300 2.622 2.401 2.824 . 0 0 "[ . 1 . 2]" 1
1362 4 66 ALA MB 4 73 ALA H 3.430 . 5.060 3.698 3.408 4.123 . 0 0 "[ . 1 . 2]" 1
1363 4 66 ALA MB 4 73 ALA MB 2.800 . 3.800 2.339 2.159 2.516 . 0 0 "[ . 1 . 2]" 1
1364 4 66 ALA MB 4 74 PHE H 2.840 . 3.880 2.206 1.978 2.768 . 0 0 "[ . 1 . 2]" 1
1365 4 66 ALA MB 4 74 PHE QD 2.860 . 3.920 2.952 2.853 3.084 . 0 0 "[ . 1 . 2]" 1
1366 4 66 ALA MB 4 74 PHE QE 2.460 . 3.120 2.800 2.688 2.885 . 0 0 "[ . 1 . 2]" 1
1367 4 67 SER H 4 68 LEU H 3.020 . 4.240 4.215 4.100 4.377 0.137 10 0 "[ . 1 . 2]" 1
1368 4 67 SER H 4 73 ALA H 3.110 . 4.420 3.998 3.838 4.260 . 0 0 "[ . 1 . 2]" 1
1369 4 67 SER H 4 73 ALA MB 2.680 . 3.570 3.283 3.093 3.550 . 0 0 "[ . 1 . 2]" 1
1370 4 67 SER H 4 74 PHE H 3.420 . 5.040 4.692 4.476 5.006 . 0 0 "[ . 1 . 2]" 1
1371 4 68 LEU H 4 69 GLY H 3.260 . 4.720 4.203 3.996 4.400 . 0 0 "[ . 1 . 2]" 1
1372 4 68 LEU H 4 71 GLU H 2.950 . 4.100 4.079 3.780 4.465 0.365 7 0 "[ . 1 . 2]" 1
1373 4 68 LEU H 4 73 ALA H 2.620 . 3.440 3.107 2.952 3.318 . 0 0 "[ . 1 . 2]" 1
1374 4 68 LEU H 4 73 ALA MB 2.490 . 3.180 2.234 2.027 2.377 . 0 0 "[ . 1 . 2]" 1
1375 4 68 LEU MD1 4 73 ALA MB 2.570 . 3.340 2.388 2.104 2.630 . 0 0 "[ . 1 . 2]" 1
1376 4 68 LEU MD2 4 69 GLY H 3.380 . 4.960 3.686 3.320 3.888 . 0 0 "[ . 1 . 2]" 1
1377 4 69 GLY H 4 70 GLU H 3.230 . 4.660 4.462 4.322 4.590 . 0 0 "[ . 1 . 2]" 1
1378 4 69 GLY H 4 71 GLU H 3.400 . 5.000 4.619 4.373 4.762 . 0 0 "[ . 1 . 2]" 1
1379 4 70 GLU H 4 71 GLU H 2.330 . 2.860 2.466 2.046 2.765 . 0 0 "[ . 1 . 2]" 1
1380 4 71 GLU H 4 72 THR H 3.200 . 4.600 4.442 4.387 4.482 . 0 0 "[ . 1 . 2]" 1
1381 4 72 THR H 4 73 ALA H 3.310 . 4.820 4.540 4.433 4.609 . 0 0 "[ . 1 . 2]" 1
1382 4 73 ALA H 4 74 PHE H 2.170 . 2.540 2.660 2.467 2.820 0.280 14 0 "[ . 1 . 2]" 1
1383 4 73 ALA H 4 75 LEU QD 3.160 . 4.520 4.522 4.302 4.716 0.196 18 0 "[ . 1 . 2]" 1
1384 4 73 ALA MB 4 74 PHE H 2.490 . 3.180 1.994 1.914 2.075 . 0 0 "[ . 1 . 2]" 1
1385 4 73 ALA MB 4 74 PHE QD 3.290 . 4.780 2.520 1.898 2.792 . 0 0 "[ . 1 . 2]" 1
1386 4 74 PHE H 4 75 LEU H 3.070 . 4.340 4.282 4.150 4.358 0.018 8 0 "[ . 1 . 2]" 1
1387 4 74 PHE H 4 75 LEU QD 2.720 . 3.640 4.117 3.811 4.289 0.649 4 10 "[** +.** *1 *-* * 2]" 1
1388 4 74 PHE QD 4 75 LEU H 3.250 . 4.700 3.813 3.082 4.465 . 0 0 "[ . 1 . 2]" 1
1389 4 74 PHE QD 4 123 PHE QD 3.310 . 4.820 2.960 2.701 3.177 . 0 0 "[ . 1 . 2]" 1
1390 4 74 PHE QD 4 123 PHE QE 3.450 . 5.100 3.621 3.221 3.866 . 0 0 "[ . 1 . 2]" 1
1391 4 74 PHE QE 4 126 LEU QD 3.060 . 4.320 2.485 1.839 3.612 . 0 0 "[ . 1 . 2]" 1
1392 4 75 LEU H 4 76 CYS H 3.140 . 4.480 4.399 4.174 4.492 0.012 10 0 "[ . 1 . 2]" 1
1393 4 76 CYS H 4 77 GLU H 3.220 . 4.640 4.237 4.047 4.436 . 0 0 "[ . 1 . 2]" 1
1394 4 77 GLU H 4 78 VAL H 3.060 . 4.320 4.118 3.976 4.226 . 0 0 "[ . 1 . 2]" 1
1395 4 77 GLU H 4 78 VAL MG2 3.180 . 4.560 3.371 3.010 3.692 . 0 0 "[ . 1 . 2]" 1
1396 4 77 GLU H 4 117 MET ME 3.480 . 5.160 3.367 2.896 3.740 . 0 0 "[ . 1 . 2]" 1
1397 4 78 VAL H 4 79 GLN H 3.210 . 4.620 4.118 3.994 4.307 . 0 0 "[ . 1 . 2]" 1
1398 4 78 VAL MG1 4 79 GLN H 2.430 . 3.060 2.988 2.402 3.139 0.079 11 0 "[ . 1 . 2]" 1
1399 4 78 VAL MG1 4 80 GLN H 2.980 . 4.160 2.841 2.686 2.928 . 0 0 "[ . 1 . 2]" 1
1400 4 78 VAL MG2 4 79 GLN H 3.340 . 4.880 4.222 3.998 4.285 . 0 0 "[ . 1 . 2]" 1
1401 4 78 VAL MG2 4 114 ILE H 3.200 . 4.600 3.065 2.800 3.404 . 0 0 "[ . 1 . 2]" 1
1402 4 78 VAL MG2 4 117 MET ME 2.240 . 2.680 2.137 2.040 2.239 . 0 0 "[ . 1 . 2]" 1
1403 4 79 GLN H 4 80 GLN H 2.910 . 4.020 3.884 3.613 3.999 . 0 0 "[ . 1 . 2]" 1
1404 4 80 GLN H 4 81 GLY H 3.260 . 4.720 4.194 4.128 4.284 . 0 0 "[ . 1 . 2]" 1
1405 4 80 GLN H 4 110 ALA MB 2.890 . 3.980 3.981 3.724 4.290 0.310 10 0 "[ . 1 . 2]" 1
1406 4 81 GLY H 4 82 GLY H 3.250 . 4.700 4.570 4.548 4.596 . 0 0 "[ . 1 . 2]" 1
1407 4 82 GLY H 4 83 ILE H 3.170 . 4.540 4.200 4.127 4.296 . 0 0 "[ . 1 . 2]" 1
1408 4 83 ILE H 4 84 PHE H 3.260 . 4.720 4.478 4.374 4.559 . 0 0 "[ . 1 . 2]" 1
1409 4 84 PHE H 4 85 SER H 3.250 . 4.700 4.303 4.169 4.462 . 0 0 "[ . 1 . 2]" 1
1410 4 84 PHE QD 4 85 SER H 3.270 . 4.740 4.342 3.955 4.702 . 0 0 "[ . 1 . 2]" 1
1411 4 85 SER H 4 86 ILE H 3.230 . 4.660 4.263 4.026 4.414 . 0 0 "[ . 1 . 2]" 1
1412 4 86 ILE H 4 87 ALA H 3.180 . 4.560 4.401 4.209 4.513 . 0 0 "[ . 1 . 2]" 1
1413 4 87 ALA H 4 88 GLY H 3.100 . 4.400 4.344 4.165 4.413 0.013 13 0 "[ . 1 . 2]" 1
1414 4 87 ALA H 4 89 ILE H 3.050 . 4.300 4.302 3.546 5.148 0.848 13 2 "[ - 1 + . 2]" 1
1415 4 87 ALA MB 4 88 GLY H 2.810 . 3.820 2.567 2.243 3.100 . 0 0 "[ . 1 . 2]" 1
1416 4 88 GLY H 4 89 ILE H 2.190 . 2.580 2.645 2.418 2.908 0.328 6 0 "[ . 1 . 2]" 1
1417 4 89 ILE H 4 90 GLU H 3.240 . 4.680 4.446 4.287 4.580 . 0 0 "[ . 1 . 2]" 1
1418 4 90 GLU H 4 91 GLY H 3.180 . 4.560 4.396 4.274 4.464 . 0 0 "[ . 1 . 2]" 1
1419 4 90 GLU H 4 94 MET H 3.220 . 4.640 3.613 2.888 4.535 . 0 0 "[ . 1 . 2]" 1
1420 4 91 GLY H 4 92 THR H 3.320 . 4.830 4.499 4.255 4.600 . 0 0 "[ . 1 . 2]" 1
1421 4 91 GLY H 4 94 MET H 3.160 . 4.520 4.211 3.808 4.709 0.189 7 0 "[ . 1 . 2]" 1
1422 4 91 GLY H 4 95 ALA H 3.330 . 4.860 5.417 4.835 6.297 1.437 8 9 "[ . *+** **- **2]" 1
1423 4 92 THR H 4 93 GLN H 2.230 . 2.660 2.525 2.259 2.742 0.082 3 0 "[ . 1 . 2]" 1
1424 4 92 THR H 4 94 MET H 3.110 . 4.410 4.211 3.857 4.453 0.043 4 0 "[ . 1 . 2]" 1
1425 4 92 THR H 4 95 ALA H 3.440 . 5.080 4.992 4.442 5.537 0.457 10 0 "[ . 1 . 2]" 1
1426 4 93 GLN H 4 94 MET H 2.350 . 2.900 2.608 2.486 2.735 . 0 0 "[ . 1 . 2]" 1
1427 4 93 GLN H 4 95 ALA H 3.220 . 4.640 4.131 3.793 4.541 . 0 0 "[ . 1 . 2]" 1
1428 4 93 GLN H 4 96 HIS H 3.400 . 5.000 4.684 4.350 5.133 0.133 15 0 "[ . 1 . 2]" 1
1429 4 94 MET H 4 95 ALA H 2.200 . 2.600 2.624 2.415 2.878 0.278 10 0 "[ . 1 . 2]" 1
1430 4 94 MET H 4 96 HIS H 2.880 . 3.960 3.967 3.655 4.285 0.325 15 0 "[ . 1 . 2]" 1
1431 4 94 MET H 4 97 CYS H 3.390 . 4.980 4.717 4.527 4.944 . 0 0 "[ . 1 . 2]" 1
1432 4 94 MET ME 4 98 LEU QD 2.590 . 3.380 3.843 1.612 5.472 2.092 19 10 "[ *. ****-** . *+2]" 1
1433 4 95 ALA H 4 96 HIS H 2.360 . 2.920 2.598 2.323 2.796 . 0 0 "[ . 1 . 2]" 1
1434 4 95 ALA H 4 97 CYS H 3.290 . 4.780 4.077 3.918 4.448 . 0 0 "[ . 1 . 2]" 1
1435 4 95 ALA H 4 98 LEU H 3.390 . 4.980 4.857 4.628 5.118 0.138 19 0 "[ . 1 . 2]" 1
1436 4 95 ALA MB 4 96 HIS H 2.690 . 3.580 2.645 2.406 2.869 . 0 0 "[ . 1 . 2]" 1
1437 4 96 HIS H 4 97 CYS H 2.310 . 2.820 2.581 2.411 2.747 . 0 0 "[ . 1 . 2]" 1
1438 4 96 HIS H 4 98 LEU H 2.920 . 4.040 4.240 3.755 4.577 0.537 12 1 "[ . 1 + . 2]" 1
1439 4 96 HIS H 4 99 GLY H 3.430 . 5.060 4.714 4.418 5.057 . 0 0 "[ . 1 . 2]" 1
1440 4 96 HIS H 4 137 PHE QE 3.440 . 5.080 3.615 3.133 4.083 . 0 0 "[ . 1 . 2]" 1
1441 4 97 CYS H 4 98 LEU H 2.290 . 2.780 2.545 2.393 2.726 . 0 0 "[ . 1 . 2]" 1
1442 4 97 CYS H 4 99 GLY H 3.090 . 4.380 3.955 3.623 4.427 0.047 13 0 "[ . 1 . 2]" 1
1443 4 97 CYS H 4 100 ALA H 3.470 . 5.140 4.970 4.545 5.280 0.140 13 0 "[ . 1 . 2]" 1
1444 4 97 CYS H 4 101 TYR H 3.530 . 5.250 4.897 4.597 5.058 . 0 0 "[ . 1 . 2]" 1
1445 4 98 LEU H 4 99 GLY H 2.260 . 2.730 2.447 2.267 2.775 0.045 10 0 "[ . 1 . 2]" 1
1446 4 98 LEU H 4 100 ALA H 2.960 . 4.120 4.052 3.665 4.279 0.159 7 0 "[ . 1 . 2]" 1
1447 4 98 LEU H 4 102 CYS H 3.470 . 5.140 4.916 4.676 5.108 . 0 0 "[ . 1 . 2]" 1
1448 4 99 GLY H 4 100 ALA H 2.150 . 2.500 2.503 2.362 2.812 0.312 11 0 "[ . 1 . 2]" 1
1449 4 99 GLY H 4 100 ALA MB 3.330 . 4.860 4.043 3.872 4.267 . 0 0 "[ . 1 . 2]" 1
1450 4 99 GLY H 4 101 TYR H 3.330 . 4.860 4.264 3.996 4.524 . 0 0 "[ . 1 . 2]" 1
1451 4 99 GLY H 4 102 CYS H 3.400 . 5.000 4.783 4.557 5.153 0.153 10 0 "[ . 1 . 2]" 1
1452 4 100 ALA H 4 101 TYR H 2.270 . 2.740 2.312 2.093 2.590 . 0 0 "[ . 1 . 2]" 1
1453 4 100 ALA H 4 102 CYS H 2.520 . 3.240 3.249 2.964 3.652 0.412 10 0 "[ . 1 . 2]" 1
1454 4 100 ALA MB 4 101 TYR H 2.320 . 2.840 2.267 2.114 2.470 . 0 0 "[ . 1 . 2]" 1
1455 4 100 ALA MB 4 134 ASP H 3.380 . 4.960 3.393 2.925 4.003 . 0 0 "[ . 1 . 2]" 1
1456 4 101 TYR H 4 102 CYS H 2.290 . 2.780 2.678 2.601 2.783 0.003 10 0 "[ . 1 . 2]" 1
1457 4 101 TYR QD 4 102 CYS H 3.110 . 4.410 3.854 3.431 4.266 . 0 0 "[ . 1 . 2]" 1
1458 4 102 CYS H 4 105 ILE H 3.510 . 5.220 4.804 4.646 5.232 0.012 18 0 "[ . 1 . 2]" 1
1459 4 109 TYR H 4 110 ALA H 2.240 . 2.680 2.553 2.502 2.632 . 0 0 "[ . 1 . 2]" 1
1460 4 109 TYR H 4 111 ARG H 3.090 . 4.380 4.195 4.034 4.403 0.023 10 0 "[ . 1 . 2]" 1
1461 4 109 TYR H 4 112 GLU H 3.440 . 5.080 4.704 4.560 4.842 . 0 0 "[ . 1 . 2]" 1
1462 4 109 TYR QD 4 110 ALA H 3.350 . 4.900 4.256 4.033 4.463 . 0 0 "[ . 1 . 2]" 1
1463 4 110 ALA H 4 111 ARG H 2.200 . 2.600 2.657 2.567 2.729 0.129 4 0 "[ . 1 . 2]" 1
1464 4 110 ALA H 4 112 GLU H 2.920 . 4.040 4.077 3.956 4.188 0.148 6 0 "[ . 1 . 2]" 1
1465 4 110 ALA H 4 113 CYS H 3.420 . 5.040 4.865 4.765 4.953 . 0 0 "[ . 1 . 2]" 1
1466 4 110 ALA MB 4 111 ARG H 2.560 . 3.320 2.342 2.164 2.502 . 0 0 "[ . 1 . 2]" 1
1467 4 111 ARG H 4 112 GLU H 2.360 . 2.920 2.802 2.706 2.891 . 0 0 "[ . 1 . 2]" 1
1468 4 111 ARG H 4 113 CYS H 3.210 . 4.620 4.429 4.248 4.565 . 0 0 "[ . 1 . 2]" 1
1469 4 112 GLU H 4 113 CYS H 2.260 . 2.730 2.739 2.635 2.822 0.092 19 0 "[ . 1 . 2]" 1
1470 4 112 GLU H 4 114 ILE H 3.270 . 4.740 4.276 4.185 4.356 . 0 0 "[ . 1 . 2]" 1
1471 4 112 GLU H 4 115 THR H 3.480 . 5.160 4.699 4.592 4.816 . 0 0 "[ . 1 . 2]" 1
1472 4 113 CYS H 4 114 ILE H 2.470 . 3.150 2.754 2.717 2.791 . 0 0 "[ . 1 . 2]" 1
1473 4 113 CYS H 4 115 THR H 3.180 . 4.560 4.248 4.116 4.399 . 0 0 "[ . 1 . 2]" 1
1474 4 113 CYS H 4 116 SER H 3.430 . 5.060 4.888 4.809 4.952 . 0 0 "[ . 1 . 2]" 1
1475 4 114 ILE H 4 115 THR H 2.420 . 3.040 2.769 2.683 2.843 . 0 0 "[ . 1 . 2]" 1
1476 4 114 ILE H 4 116 SER H 3.070 . 4.340 4.263 4.183 4.388 0.048 19 0 "[ . 1 . 2]" 1
1477 4 114 ILE H 4 117 MET ME 3.390 . 4.980 3.605 3.415 3.672 . 0 0 "[ . 1 . 2]" 1
1478 4 115 THR H 4 116 SER H 2.350 . 2.900 2.740 2.657 2.835 . 0 0 "[ . 1 . 2]" 1
1479 4 115 THR H 4 117 MET H 3.380 . 4.960 4.275 4.188 4.364 . 0 0 "[ . 1 . 2]" 1
1480 4 115 THR H 4 118 VAL H 3.490 . 5.180 4.783 4.731 4.871 . 0 0 "[ . 1 . 2]" 1
1481 4 115 THR H 4 118 VAL MG2 3.490 . 5.180 4.209 3.909 4.367 . 0 0 "[ . 1 . 2]" 1
1482 4 116 SER H 4 117 MET H 2.400 . 3.000 2.654 2.583 2.708 . 0 0 "[ . 1 . 2]" 1
1483 4 116 SER H 4 118 VAL H 2.990 . 4.180 4.000 3.908 4.106 . 0 0 "[ . 1 . 2]" 1
1484 4 117 MET H 4 118 VAL H 2.340 . 2.880 2.580 2.539 2.622 . 0 0 "[ . 1 . 2]" 1
1485 4 117 MET H 4 119 SER H 3.150 . 4.500 4.180 4.109 4.270 . 0 0 "[ . 1 . 2]" 1
1486 4 118 VAL H 4 119 SER H 2.350 . 2.900 2.645 2.529 2.705 . 0 0 "[ . 1 . 2]" 1
1487 4 118 VAL MG1 4 119 SER H 3.210 . 4.620 3.372 3.290 3.453 . 0 0 "[ . 1 . 2]" 1
1488 4 118 VAL MG1 4 123 PHE H 3.010 . 4.220 3.408 3.126 3.553 . 0 0 "[ . 1 . 2]" 1
1489 4 118 VAL MG1 4 123 PHE QD 3.240 . 4.680 3.530 3.333 3.669 . 0 0 "[ . 1 . 2]" 1
1490 4 118 VAL MG1 4 126 LEU H 3.380 . 4.960 2.994 2.547 3.241 . 0 0 "[ . 1 . 2]" 1
1491 4 118 VAL MG2 4 119 SER H 3.360 . 4.920 3.938 3.864 4.027 . 0 0 "[ . 1 . 2]" 1
1492 4 118 VAL MG2 4 126 LEU H 3.490 . 5.180 3.818 3.449 4.278 . 0 0 "[ . 1 . 2]" 1
1493 4 119 SER H 4 121 GLY H 3.030 . 4.260 3.935 3.827 4.031 . 0 0 "[ . 1 . 2]" 1
1494 4 121 GLY H 4 122 THR H 2.300 . 2.800 2.514 2.436 2.648 . 0 0 "[ . 1 . 2]" 1
1495 4 121 GLY H 4 123 PHE H 2.770 . 3.740 3.964 3.764 4.097 0.357 8 0 "[ . 1 . 2]" 1
1496 4 122 THR H 4 123 PHE H 2.340 . 2.880 2.811 2.722 2.914 0.034 13 0 "[ . 1 . 2]" 1
1497 4 125 GLN H 4 126 LEU H 3.330 . 4.860 4.609 4.488 4.680 . 0 0 "[ . 1 . 2]" 1
1498 4 126 LEU H 4 127 ASN H 2.920 . 4.040 4.063 3.878 4.233 0.193 2 0 "[ . 1 . 2]" 1
1499 4 126 LEU QD 4 127 ASN H 2.870 . 3.940 3.316 2.535 4.339 0.399 7 0 "[ . 1 . 2]" 1
1500 4 126 LEU QD 4 128 LEU H 2.990 . 4.180 4.195 2.724 5.691 1.511 17 5 "[ * . * - * . + 2]" 1
1501 4 127 ASN H 4 128 LEU H 2.960 . 4.120 4.067 3.863 4.302 0.182 2 0 "[ . 1 . 2]" 1
1502 4 128 LEU H 4 129 ALA H 3.340 . 4.880 4.520 4.436 4.614 . 0 0 "[ . 1 . 2]" 1
1503 4 128 LEU QD 4 129 ALA H 3.330 . 3.500 3.061 1.963 4.423 0.923 15 1 "[ . 1 + 2]" 1
1504 4 128 LEU QD 4 131 VAL QG 3.170 . 4.540 4.304 2.152 5.777 1.237 6 2 "[ .+ 1 .- 2]" 1
1505 4 131 VAL QG 4 133 PHE QE 3.510 . 5.220 3.437 2.548 5.399 0.179 12 0 "[ . 1 . 2]" 1
1506 4 131 VAL QG 4 136 LEU QD 2.420 . 3.040 2.951 2.064 4.435 1.395 7 5 "[ **. + 1 * . - 2]" 1
1507 4 133 PHE H 4 134 ASP H 2.150 . 2.500 2.576 2.323 2.733 0.233 20 0 "[ . 1 . 2]" 1
1508 4 133 PHE H 4 135 ALA H 3.380 . 4.960 4.687 4.278 4.889 . 0 0 "[ . 1 . 2]" 1
1509 4 133 PHE H 4 136 LEU H 3.390 . 4.980 5.274 4.870 5.616 0.636 5 4 "[ * + - 1 . *2]" 1
1510 4 133 PHE H 4 136 LEU QD 3.520 . 5.240 4.668 3.536 6.290 1.050 3 2 "[ + . 1 . - 2]" 1
1511 4 133 PHE QD 4 134 ASP H 3.220 . 4.640 4.244 3.506 4.638 . 0 0 "[ . 1 . 2]" 1
1512 4 133 PHE QD 4 136 LEU QD 3.470 . 5.140 4.188 2.536 5.407 0.267 4 0 "[ . 1 . 2]" 1
1513 4 134 ASP H 4 135 ALA H 2.530 . 3.260 2.813 2.658 2.953 . 0 0 "[ . 1 . 2]" 1
1514 4 134 ASP H 4 136 LEU H 3.000 . 4.200 4.210 3.817 4.530 0.330 19 0 "[ . 1 . 2]" 1
1515 4 134 ASP H 4 137 PHE H 3.430 . 5.060 4.741 4.650 5.107 0.047 16 0 "[ . 1 . 2]" 1
1516 4 135 ALA H 4 136 LEU H 2.300 . 2.800 2.653 2.501 2.794 . 0 0 "[ . 1 . 2]" 1
1517 4 135 ALA H 4 137 PHE H 3.200 . 4.600 4.020 3.880 4.226 . 0 0 "[ . 1 . 2]" 1
1518 4 135 ALA H 4 138 MET ME 3.410 . 5.020 3.493 3.336 3.605 . 0 0 "[ . 1 . 2]" 1
1519 4 135 ALA MB 4 136 LEU H 2.670 . 3.540 2.506 2.369 2.667 . 0 0 "[ . 1 . 2]" 1
1520 4 136 LEU H 4 137 PHE H 2.390 . 2.980 2.605 2.428 2.767 . 0 0 "[ . 1 . 2]" 1
1521 4 136 LEU H 4 138 MET H 3.230 . 4.660 4.226 4.116 4.395 . 0 0 "[ . 1 . 2]" 1
1522 4 136 LEU H 4 139 ASN H 3.510 . 5.220 4.981 4.656 5.626 0.406 16 0 "[ . 1 . 2]" 1
1523 4 137 PHE H 4 138 MET H 2.360 . 2.920 2.586 2.477 2.670 . 0 0 "[ . 1 . 2]" 1
1524 4 137 PHE H 4 139 ASN H 3.150 . 4.500 4.056 3.754 4.323 . 0 0 "[ . 1 . 2]" 1
1525 4 137 PHE H 4 140 TYR H 3.340 . 4.880 4.698 4.331 5.313 0.433 16 0 "[ . 1 . 2]" 1
1526 4 137 PHE QD 4 138 MET H 3.060 . 4.320 3.721 3.458 4.216 . 0 0 "[ . 1 . 2]" 1
1527 4 137 PHE QD 4 141 LEU MD1 3.020 . 4.240 3.227 2.972 3.369 . 0 0 "[ . 1 . 2]" 1
1528 4 137 PHE QE 4 141 LEU MD1 2.680 . 3.560 2.847 2.491 2.971 . 0 0 "[ . 1 . 2]" 1
1529 4 137 PHE QE 4 141 LEU MD2 3.130 . 4.460 2.565 2.226 3.069 . 0 0 "[ . 1 . 2]" 1
1530 4 138 MET H 4 139 ASN H 2.400 . 3.000 2.626 2.535 2.761 . 0 0 "[ . 1 . 2]" 1
1531 4 138 MET H 4 140 TYR H 3.140 . 4.480 4.030 3.822 4.396 . 0 0 "[ . 1 . 2]" 1
1532 4 138 MET H 4 141 LEU H 3.480 . 5.160 4.917 4.759 5.245 0.085 18 0 "[ . 1 . 2]" 1
1533 4 139 ASN H 4 140 TYR H 2.280 . 2.760 2.589 2.468 2.737 . 0 0 "[ . 1 . 2]" 1
1534 4 139 ASN H 4 141 LEU H 3.040 . 4.280 4.177 3.907 4.445 0.165 8 0 "[ . 1 . 2]" 1
1535 4 140 TYR H 4 141 LEU H 2.360 . 2.920 2.669 2.407 2.800 . 0 0 "[ . 1 . 2]" 1
1536 4 140 TYR QD 4 141 LEU H 3.050 . 4.300 3.746 3.525 4.003 . 0 0 "[ . 1 . 2]" 1
1537 4 140 TYR QD 4 141 LEU MD1 3.200 . 4.600 2.125 1.927 2.604 . 0 0 "[ . 1 . 2]" 1
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